#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bmo s ALA 3 N 0.00 3.27 0.95 -1.84 0.00 -1.26 -5.02 121.76 117.85 3bmo s ALA 3 Ca 0.00 0.99 -0.12 0.00 0.00 0.00 0.00 51.96 52.83 3bmo s ALA 3 Cb 0.00 -3.38 0.16 0.00 0.00 0.00 0.00 23.12 19.90 3bmo s ALA 3 CO 0.00 -0.45 1.10 -1.25 0.00 0.00 0.00 175.76 175.16 3bmo s PRO 4 N -2.03 0.84 0.03 0.00 0.04 -1.26 -4.79 135.00 127.83 3bmo s PRO 4 Ca 0.53 0.52 0.05 0.00 0.04 0.00 0.00 61.00 62.13 3bmo s PRO 4 Cb -0.32 -1.79 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 3bmo s PRO 4 CO 0.41 -2.45 -0.14 0.00 0.04 0.00 0.00 177.00 174.86 3bmo s ALA 5 N -3.05 1.17 0.04 8.56 0.00 -1.26 -0.93 121.76 126.28 3bmo s ALA 5 Ca 0.64 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.88 3bmo s ALA 5 Cb -0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 3bmo s ALA 5 CO 0.56 0.24 -0.13 0.00 0.00 0.00 0.00 175.76 176.43 3bmo s ALA 6 N -0.72 1.07 -0.18 0.00 0.00 0.25 -0.28 121.76 121.90 3bmo s ALA 6 Ca 0.03 -0.79 -0.06 0.00 0.00 0.00 0.00 51.96 51.13 3bmo s ALA 6 Cb -0.07 -0.15 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 3bmo s ALA 6 CO 0.01 0.19 0.03 0.08 0.00 0.00 0.00 175.76 176.07 3bmo s VAL 7 N -0.87 4.52 -0.16 0.00 1.01 0.19 -0.71 120.40 124.37 3bmo s VAL 7 Ca 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 61.86 3bmo s VAL 7 Cb -0.08 -3.02 0.02 0.00 0.00 0.00 0.00 36.38 33.30 3bmo s VAL 7 CO 0.01 0.47 -0.18 -0.69 0.00 0.00 0.00 175.10 174.70 3bmo s VAL 8 N 0.39 1.90 0.35 2.92 1.01 -0.79 -0.14 120.40 126.05 3bmo s VAL 8 Ca 0.01 -0.85 -0.21 0.00 0.00 0.00 0.00 61.98 60.94 3bmo s VAL 8 Cb -0.13 -1.73 -0.10 0.00 0.00 0.00 0.00 36.38 34.43 3bmo s VAL 8 CO 0.01 0.51 0.87 0.42 0.00 0.00 0.00 175.10 176.92 3bmo s THR 9 N 1.25 4.44 -1.30 3.92 -4.23 -0.59 -2.13 115.64 117.00 3bmo s THR 9 Ca 0.03 1.42 -0.04 0.00 -1.18 0.00 0.00 61.69 61.91 3bmo s THR 9 Cb -0.13 -3.73 0.01 0.00 1.34 0.00 0.00 72.50 69.99 3bmo s THR 9 CO -0.10 -0.12 0.98 0.61 -0.54 0.00 0.00 174.62 175.46 3bmo n GLY 10 N -0.13 -0.41 0.74 3.99 0.00 -1.10 -2.75 105.19 105.53 3bmo n GLY 10 Ca 0.04 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.34 3bmo n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bmo n ALA 11 N -4.44 2.51 0.14 4.61 0.00 -0.28 -4.12 120.51 118.93 3bmo n ALA 11 Ca -0.18 -0.62 0.01 0.00 0.00 0.00 0.00 53.44 52.65 3bmo n ALA 11 Cb 0.63 -1.01 0.15 0.00 0.00 0.00 0.00 19.45 19.22 3bmo n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3bmo h ALA 12 N 4.41 0.82 -2.38 0.00 0.00 -1.88 -2.88 119.26 117.34 3bmo h ALA 12 Ca 0.00 -0.54 -0.18 0.00 0.00 0.00 0.00 54.91 54.19 3bmo h ALA 12 Cb 0.71 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.26 3bmo h ALA 12 CO 0.00 0.74 -0.66 0.15 0.00 0.00 0.00 179.25 179.49 3bmo s LYS 13 N -3.34 0.88 7.00 0.00 1.02 -1.26 -4.57 119.74 119.47 3bmo s LYS 13 Ca 0.00 -1.41 0.00 0.00 0.02 0.00 0.00 55.97 54.59 3bmo s LYS 13 Cb 0.11 0.20 0.00 0.00 -0.52 0.00 0.00 37.83 37.62 3bmo s LYS 13 CO 0.75 -0.22 0.00 0.54 -0.92 0.00 0.00 175.35 175.49 3bmo n ARG 14 N -0.07 0.00 -0.12 1.68 1.74 -1.26 -1.76 116.66 116.87 3bmo n ARG 14 Ca -0.07 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.89 3bmo n ARG 14 Cb 0.63 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 32.04 3bmo n ARG 14 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3bmo h ILE 15 N 0.00 1.28 -0.88 0.55 2.04 -1.92 -2.38 117.51 116.21 3bmo h ILE 15 Ca 0.00 -1.24 0.00 0.00 1.00 0.00 0.00 64.86 64.62 3bmo h ILE 15 Cb 0.00 1.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 3bmo h ILE 15 CO 0.00 0.41 0.55 1.23 0.00 0.00 0.00 178.15 180.34 3bmo h GLY 16 N 0.50 1.25 0.94 5.37 0.00 -1.67 -0.52 103.07 108.95 3bmo h GLY 16 Ca 0.08 -0.50 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 3bmo h GLY 16 CO 0.05 0.48 0.16 -0.09 0.00 0.00 0.00 176.54 177.14 3bmo h ARG 17 N 1.20 0.55 -0.91 4.80 2.43 -1.12 -0.88 114.38 120.46 3bmo h ARG 17 Ca 0.32 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.39 3bmo h ARG 17 Cb -0.09 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.32 3bmo h ARG 17 CO -0.06 0.51 0.55 0.00 -1.51 0.00 0.00 179.97 179.46 3bmo h ALA 18 N 1.01 1.26 -0.23 2.80 0.00 -0.87 -0.32 119.26 122.92 3bmo h ALA 18 Ca 0.13 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3bmo h ALA 18 Cb 0.16 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3bmo h ALA 18 CO -0.01 0.64 0.09 0.82 0.00 0.00 0.00 179.25 180.78 3bmo h ILE 19 N 1.25 1.18 -0.66 0.00 2.04 -0.86 -0.88 117.51 119.57 3bmo h ILE 19 Ca 0.33 -0.54 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 3bmo h ILE 19 Cb -0.06 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 3bmo h ILE 19 CO -0.06 0.18 0.39 0.00 0.00 0.00 0.00 178.15 178.65 3bmo h ALA 20 N 0.92 0.84 -0.14 1.87 0.00 -0.78 0.48 119.26 122.46 3bmo h ALA 20 Ca 0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3bmo h ALA 20 Cb 0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3bmo h ALA 20 CO -0.01 0.33 0.09 0.28 0.00 0.00 0.00 179.25 179.94 3bmo h VAL 21 N 0.90 1.06 -0.53 0.00 2.07 -0.93 -0.83 116.25 117.99 3bmo h VAL 21 Ca 0.24 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.53 3bmo h VAL 21 Cb -0.00 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 3bmo h VAL 21 CO -0.04 0.06 0.02 0.11 0.02 0.00 0.00 177.57 177.74 3bmo h LYS 22 N 0.16 0.92 -0.80 1.57 1.57 -0.88 0.30 116.57 119.42 3bmo h LYS 22 Ca 0.05 -0.28 0.02 0.00 -1.87 0.00 0.00 60.65 58.57 3bmo h LYS 22 Cb 0.02 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 3bmo h LYS 22 CO -0.01 0.93 0.52 -0.07 -0.57 0.00 0.00 179.45 180.25 3bmo h LEU 23 N 0.80 0.87 -0.41 2.94 3.38 -0.75 -1.18 115.31 120.96 3bmo h LEU 23 Ca 0.15 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3bmo h LEU 23 Cb 0.50 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3bmo h LEU 23 CO 0.02 0.62 0.15 -0.74 0.09 0.00 0.00 178.44 178.58 3bmo h HIS 24 N 1.03 0.64 0.00 1.13 2.76 -0.63 -1.30 115.15 118.78 3bmo h HIS 24 Ca 0.31 -0.05 -0.02 0.00 -2.20 0.00 0.00 60.37 58.40 3bmo h HIS 24 Cb -0.05 -0.19 -0.00 0.00 1.55 0.00 0.00 27.41 28.72 3bmo h HIS 24 CO -0.02 0.57 -0.10 1.96 -1.30 0.00 0.00 177.93 179.04 3bmo h GLN 25 N 0.52 0.00 0.00 5.26 4.20 -0.57 -0.29 115.11 124.23 3bmo h GLN 25 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 3bmo h GLN 25 Cb 0.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.00 3bmo h GLN 25 CO -0.01 0.10 0.00 1.15 -0.67 0.00 0.00 178.83 179.40 3bmo h THR 26 N 0.00 0.00 0.00 -0.54 2.02 -0.73 -3.47 112.91 110.19 3bmo h THR 26 Ca -0.00 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.71 3bmo h THR 26 Cb 0.19 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 3bmo h THR 26 CO 0.01 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.51 3bmo n GLY 27 N 0.97 1.09 3.81 2.16 0.00 -0.12 -5.09 105.19 108.01 3bmo n GLY 27 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 3bmo n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3bmo s TYR 28 N -2.00 3.24 0.25 1.61 1.51 -0.54 -4.43 117.35 116.99 3bmo s TYR 28 Ca 0.00 1.61 -0.16 0.00 -1.01 0.00 0.00 57.07 57.52 3bmo s TYR 28 Cb 0.00 -2.93 -0.08 0.00 -0.11 0.00 0.00 41.96 38.83 3bmo s TYR 28 CO 0.00 -0.33 0.68 1.03 -1.11 0.00 0.00 175.55 175.82 3bmo s ARG 29 N -3.08 4.05 -0.01 -0.62 0.52 -0.11 -4.15 118.95 115.55 3bmo s ARG 29 Ca 0.62 0.65 0.03 0.00 -0.52 0.00 0.00 55.73 56.52 3bmo s ARG 29 Cb -0.12 -2.68 -0.00 0.00 0.52 0.00 0.00 34.95 32.66 3bmo s ARG 29 CO 0.17 0.30 -0.09 0.08 0.02 0.00 0.00 175.30 175.78 3bmo s VAL 30 N -1.74 0.72 -0.32 3.52 1.01 0.05 -0.58 120.40 123.06 3bmo s VAL 30 Ca 0.47 -0.37 -0.13 0.00 0.00 0.00 0.00 61.98 61.95 3bmo s VAL 30 Cb -0.13 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 3bmo s VAL 30 CO 0.19 0.21 0.28 -0.69 0.00 0.00 0.00 175.10 175.10 3bmo s VAL 31 N -0.09 5.24 -0.66 2.92 1.01 0.11 -1.41 120.40 127.52 3bmo s VAL 31 Ca 0.02 0.05 -0.19 0.00 0.00 0.00 0.00 61.98 61.86 3bmo s VAL 31 Cb -0.05 -3.70 0.11 0.00 0.00 0.00 0.00 36.38 32.74 3bmo s VAL 31 CO -0.00 0.05 0.80 -0.63 0.00 0.00 0.00 175.10 175.32 3bmo s ILE 32 N 1.87 4.79 0.30 2.22 1.01 0.68 -1.89 121.20 130.17 3bmo s ILE 32 Ca 0.09 -1.08 -0.26 0.00 0.00 0.00 0.00 60.65 59.40 3bmo s ILE 32 Cb -0.17 -4.56 -0.10 0.00 0.01 0.00 0.00 42.46 37.65 3bmo s ILE 32 CO 0.11 -1.22 0.92 -2.28 0.00 0.00 0.00 174.94 172.46 3bmo s HIS 33 N 2.72 3.74 0.11 3.97 5.65 -0.91 -1.28 115.29 129.29 3bmo s HIS 33 Ca 0.16 1.77 -0.08 0.00 0.25 0.00 0.00 55.06 57.16 3bmo s HIS 33 Cb -0.20 -2.90 -0.01 0.00 -1.18 0.00 0.00 32.58 28.30 3bmo s HIS 33 CO 0.04 0.27 0.21 1.52 -0.65 0.00 0.00 174.74 176.13 3bmo s TYR 34 N -1.52 0.27 0.00 3.88 1.13 -0.56 -1.12 117.35 119.43 3bmo s TYR 34 Ca 0.48 -0.69 0.00 0.00 -1.41 0.00 0.00 57.07 55.45 3bmo s TYR 34 Cb -0.20 -0.09 0.00 0.00 -1.10 0.00 0.00 41.96 40.57 3bmo s TYR 34 CO 0.25 -0.59 0.00 1.58 -2.51 0.00 0.00 175.55 174.28 3bmo n HIS 35 N -0.11 0.00 0.46 -3.49 -0.00 -1.26 -1.05 115.22 109.78 3bmo n HIS 35 Ca -0.12 0.00 0.11 0.00 0.46 0.00 0.00 57.72 58.17 3bmo n HIS 35 Cb 0.63 0.00 -0.05 0.00 -0.12 0.00 0.00 29.99 30.45 3bmo n HIS 35 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 3bmo n ASN 36 N -2.15 0.54 -3.38 0.26 5.03 -1.26 -4.70 115.26 109.60 3bmo n ASN 36 Ca 0.00 -0.24 -0.40 0.00 0.87 0.00 0.00 54.58 54.81 3bmo n ASN 36 Cb 0.00 1.10 0.02 0.00 -1.02 0.00 0.00 39.78 39.88 3bmo n ASN 36 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 3bmo n SER 37 N -2.02 7.45 -0.17 6.41 7.64 -1.26 -4.74 113.62 126.93 3bmo n SER 37 Ca 0.01 -3.63 -0.07 0.00 1.01 0.00 0.00 58.87 56.19 3bmo n SER 37 Cb 0.46 -1.17 0.02 0.00 -1.01 0.00 0.00 64.21 62.50 3bmo n SER 37 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3bmo h ALA 38 N 3.90 0.63 -0.07 -0.43 0.00 -1.96 -0.60 119.26 120.74 3bmo h ALA 38 Ca 0.56 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.45 3bmo h ALA 38 Cb 0.27 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 3bmo h ALA 38 CO 1.26 0.11 -0.26 1.49 0.00 0.00 0.00 179.25 181.86 3bmo h GLU 39 N 0.66 -0.35 -0.60 0.00 4.57 -2.00 -0.92 114.58 115.95 3bmo h GLU 39 Ca 0.18 0.02 -0.10 0.00 -1.18 0.00 0.00 59.36 58.28 3bmo h GLU 39 Cb -0.02 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 3bmo h GLU 39 CO -0.03 -0.23 -0.00 0.00 -1.18 0.00 0.00 179.01 177.56 3bmo h ALA 40 N 0.52 0.85 -0.14 2.92 0.00 -1.87 -0.38 119.26 121.15 3bmo h ALA 40 Ca 0.08 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.70 3bmo h ALA 40 Cb 0.48 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3bmo h ALA 40 CO -0.27 0.67 -0.02 0.00 0.00 0.00 0.00 179.25 179.62 3bmo h ALA 41 N 1.01 0.10 -0.49 0.00 0.00 -0.79 -1.15 119.26 117.94 3bmo h ALA 41 Ca 0.17 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 3bmo h ALA 41 Cb 0.56 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3bmo h ALA 41 CO 0.03 -0.47 -0.11 0.28 0.00 0.00 0.00 179.25 178.98 3bmo h VAL 42 N 0.02 1.26 -0.71 0.00 2.07 -1.04 -0.92 116.25 116.92 3bmo h VAL 42 Ca 0.07 -1.22 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 3bmo h VAL 42 Cb 0.10 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 3bmo h VAL 42 CO -0.14 0.42 0.44 -1.28 0.02 0.00 0.00 177.57 177.04 3bmo h SER 43 N 0.81 0.85 -0.16 0.57 0.87 -0.88 0.46 113.55 116.08 3bmo h SER 43 Ca 0.13 -0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 3bmo h SER 43 Cb 0.63 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 3bmo h SER 43 CO 0.04 0.65 0.06 0.25 -0.53 0.00 0.00 176.83 177.31 3bmo h LEU 44 N 0.97 0.22 -0.82 2.23 5.85 -0.97 -1.51 115.31 121.29 3bmo h LEU 44 Ca 0.26 -0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.84 3bmo h LEU 44 Cb -0.05 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 40.87 3bmo h LEU 44 CO -0.05 0.34 0.52 0.00 -0.34 0.00 0.00 178.44 178.91 3bmo h ALA 45 N 0.89 1.08 -0.40 1.25 0.00 -0.70 -0.77 119.26 120.61 3bmo h ALA 45 Ca 0.05 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3bmo h ALA 45 Cb 0.19 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3bmo h ALA 45 CO -0.00 0.33 0.23 -0.44 0.00 0.00 0.00 179.25 179.37 3bmo h ASP 46 N 1.00 0.37 -0.46 0.00 3.32 -0.73 0.23 116.42 120.15 3bmo h ASP 46 Ca 0.33 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.38 3bmo h ASP 46 Cb 0.03 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 3bmo h ASP 46 CO -0.12 0.27 0.28 -0.08 -1.72 0.00 0.00 179.24 177.87 3bmo h GLU 47 N 0.47 0.63 -0.34 3.56 4.81 -0.58 -0.33 114.58 122.79 3bmo h GLU 47 Ca 0.16 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 59.19 3bmo h GLU 47 Cb 0.02 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 3bmo h GLU 47 CO -0.08 0.46 -0.35 -0.07 -0.73 0.00 0.00 179.01 178.23 3bmo h LEU 48 N 0.62 0.91 -1.26 1.64 3.38 -0.82 -2.89 115.31 116.88 3bmo h LEU 48 Ca 0.17 -0.47 -0.07 0.00 0.09 0.00 0.00 57.88 57.59 3bmo h LEU 48 Cb -0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3bmo h LEU 48 CO -0.03 1.19 -0.29 0.78 0.09 0.00 0.00 178.44 180.19 3bmo h ASN 49 N 0.64 0.13 -0.61 -0.43 2.35 -0.44 -1.45 115.58 115.76 3bmo h ASN 49 Ca 0.05 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 3bmo h ASN 49 Cb 0.94 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 39.25 3bmo h ASN 49 CO 0.09 0.42 0.33 0.50 -1.65 0.00 0.00 177.43 177.12 3bmo h LYS 50 N 0.12 0.89 -0.05 0.81 3.64 -0.98 -2.93 116.57 118.08 3bmo h LYS 50 Ca 0.02 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 3bmo h LYS 50 Cb 0.57 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3bmo h LYS 50 CO 0.04 0.67 -0.06 0.93 -2.27 0.00 0.00 179.45 178.77 3bmo h GLU 51 N 0.89 0.12 -3.07 1.90 4.39 -1.16 -3.44 114.58 114.20 3bmo h GLU 51 Ca 0.22 -0.07 -0.31 0.00 0.34 0.00 0.00 59.36 59.54 3bmo h GLU 51 Cb 0.06 0.00 -0.36 0.00 -0.10 0.00 0.00 28.75 28.35 3bmo h GLU 51 CO -0.03 0.60 -0.65 1.03 -1.16 0.00 0.00 179.01 178.79 3bmo s ARG 52 N -4.17 0.03 0.39 2.33 0.52 -0.62 -5.13 118.95 112.30 3bmo s ARG 52 Ca -0.15 0.48 -0.27 0.00 -0.52 0.00 0.00 55.73 55.26 3bmo s ARG 52 Cb 0.03 -0.46 -0.10 0.00 0.52 0.00 0.00 34.95 34.94 3bmo s ARG 52 CO 0.70 -0.36 1.43 0.45 0.02 0.00 0.00 175.30 177.54 3bmo s SER 53 N 2.27 6.30 -1.47 0.23 0.15 -1.11 -3.19 113.70 116.87 3bmo s SER 53 Ca 0.04 2.93 -0.12 0.00 0.70 0.00 0.00 55.95 59.49 3bmo s SER 53 Cb -0.12 -2.66 0.06 0.00 -1.71 0.00 0.00 66.02 61.59 3bmo s SER 53 CO -0.06 -0.89 1.06 0.59 1.20 0.00 0.00 173.24 175.14 3bmo n ASN 54 N 0.33 -5.38 -0.40 5.45 4.13 -1.26 -4.89 115.26 113.24 3bmo n ASN 54 Ca 0.02 -0.69 0.04 0.00 1.68 0.00 0.00 54.58 55.63 3bmo n ASN 54 Cb 0.41 -4.29 0.07 0.00 -1.54 0.00 0.00 39.78 34.42 3bmo n ASN 54 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 3bmo n THR 55 N -4.81 0.40 -3.75 3.41 -2.24 -1.19 -4.99 114.28 101.10 3bmo n THR 55 Ca 0.03 -0.70 -0.13 0.00 -2.27 0.00 0.00 64.05 60.98 3bmo n THR 55 Cb 0.54 0.91 -0.13 0.00 -2.10 0.00 0.00 70.33 69.54 3bmo n THR 55 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3bmo s ALA 56 N -0.82 -0.42 0.22 6.98 0.00 -1.26 -0.77 121.76 125.68 3bmo s ALA 56 Ca 0.13 0.78 0.04 0.00 0.00 0.00 0.00 51.96 52.91 3bmo s ALA 56 Cb 0.08 -0.50 -0.05 0.00 0.00 0.00 0.00 23.12 22.65 3bmo s ALA 56 CO 0.11 -0.16 -0.02 0.14 0.00 0.00 0.00 175.76 175.83 3bmo s VAL 57 N 1.00 1.09 0.24 0.00 -7.23 -0.50 -4.89 120.40 110.11 3bmo s VAL 57 Ca -0.07 -2.04 0.10 0.00 -1.81 0.00 0.00 61.98 58.15 3bmo s VAL 57 Cb -0.09 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 3bmo s VAL 57 CO -0.06 -0.39 -0.05 0.68 -0.31 0.00 0.00 175.10 174.97 3bmo s VAL 58 N -3.38 3.28 -0.16 1.32 -7.23 -1.26 -0.23 120.40 112.74 3bmo s VAL 58 Ca 0.27 -1.89 -0.05 0.00 -1.81 0.00 0.00 61.98 58.50 3bmo s VAL 58 Cb 0.05 -2.72 0.08 0.00 0.56 0.00 0.00 36.38 34.35 3bmo s VAL 58 CO 0.08 -0.30 0.30 0.00 -0.31 0.00 0.00 175.10 174.87 3bmo s GLN 60 N 2.47 4.33 -0.27 0.00 -0.44 -1.26 -1.50 119.66 122.99 3bmo s GLN 60 Ca 0.02 0.89 -0.26 0.00 -2.50 0.00 0.00 55.36 53.52 3bmo s GLN 60 Cb -0.13 -3.17 0.14 0.00 -1.64 0.00 0.00 33.01 28.21 3bmo s GLN 60 CO -0.10 0.57 1.12 0.00 0.50 0.00 0.00 175.29 177.37 3bmo s ALA 61 N -1.21 -2.02 -0.02 1.58 0.00 -0.21 -4.95 121.76 114.92 3bmo s ALA 61 Ca 0.34 1.79 -0.26 0.00 0.00 0.00 0.00 51.96 53.83 3bmo s ALA 61 Cb -0.20 -1.40 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 3bmo s ALA 61 CO 0.22 -0.22 0.81 0.34 0.00 0.00 0.00 175.76 176.91 3bmo s ASP 62 N -0.07 7.16 0.00 0.00 2.15 -1.26 -4.14 116.67 120.51 3bmo s ASP 62 Ca 0.03 1.40 0.18 0.00 0.43 0.00 0.00 52.55 54.59 3bmo s ASP 62 Cb -0.04 -2.48 0.41 0.00 -0.30 0.00 0.00 42.92 40.52 3bmo s ASP 62 CO -0.07 -0.14 1.34 0.18 -0.17 0.00 0.00 175.17 176.30 3bmo n LEU 63 N 3.64 3.28 -4.69 -1.34 4.77 -1.26 -4.93 117.00 116.48 3bmo n LEU 63 Ca 0.01 -1.73 -0.43 0.00 -0.03 0.00 0.00 56.01 53.83 3bmo n LEU 63 Cb 0.51 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 3bmo n LEU 63 CO 0.49 0.77 0.93 0.41 -1.33 0.00 0.00 177.39 178.66 3bmo n THR 64 N 1.15 1.71 -1.98 -5.08 -1.04 -1.26 -3.21 114.28 104.57 3bmo n THR 64 Ca 0.17 -0.43 -0.41 0.00 -2.04 0.00 0.00 64.05 61.34 3bmo n THR 64 Cb 0.52 -1.55 -0.02 0.00 -1.82 0.00 0.00 70.33 67.47 3bmo n THR 64 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3bmo s ASN 65 N -0.14 6.60 0.19 8.00 2.47 -0.23 -4.71 114.94 127.12 3bmo s ASN 65 Ca 0.59 2.76 -0.22 0.00 0.42 0.00 0.00 52.86 56.41 3bmo s ASN 65 Cb -0.59 -2.64 0.07 0.00 -1.45 0.00 0.00 41.25 36.65 3bmo s ASN 65 CO 0.59 -0.71 1.02 -0.94 -3.72 0.00 0.00 177.10 173.33 3bmo s SER 66 N 0.09 -0.02 0.57 -4.21 1.04 -1.26 -4.85 113.70 105.07 3bmo s SER 66 Ca 0.56 -0.67 0.26 0.00 0.48 0.00 0.00 55.95 56.59 3bmo s SER 66 Cb -0.43 0.52 1.68 0.00 0.10 0.00 0.00 66.02 67.89 3bmo s SER 66 CO 0.49 -1.02 2.23 -0.55 0.98 0.00 0.00 173.24 175.37 3bmo h ASN 67 N 2.00 0.00 -0.02 7.02 -0.00 -2.05 -2.72 115.58 119.81 3bmo h ASN 67 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.03 3bmo h ASN 67 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.54 3bmo h ASN 67 CO 0.35 0.00 -0.12 1.33 -0.00 0.00 0.00 177.43 179.00 3bmo n VAL 68 N -4.01 0.00 -0.20 6.14 0.24 -1.26 -4.53 118.33 114.70 3bmo n VAL 68 Ca -0.03 -0.42 -0.06 0.00 -2.04 0.00 0.00 64.34 61.80 3bmo n VAL 68 Cb 0.09 1.34 0.04 0.00 -1.47 0.00 0.00 33.84 33.83 3bmo n VAL 68 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 3bmo h LEU 69 N 3.92 0.66 -0.44 1.34 5.85 -1.76 -0.68 115.31 124.19 3bmo h LEU 69 Ca 0.00 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.79 3bmo h LEU 69 Cb 0.89 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 41.70 3bmo h LEU 69 CO 0.00 0.47 0.04 -0.65 -0.34 0.00 0.00 178.44 177.96 3bmo h PRO 70 N 0.78 0.16 -0.86 5.25 0.11 -1.80 0.38 132.00 136.02 3bmo h PRO 70 Ca 0.22 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.34 3bmo h PRO 70 Cb -0.07 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 30.96 3bmo h PRO 70 CO -0.06 0.10 0.56 0.00 -0.21 0.00 0.00 178.00 178.40 3bmo h ALA 71 N 1.37 1.10 -0.60 -0.75 0.00 -1.76 -1.06 119.26 117.56 3bmo h ALA 71 Ca 0.22 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3bmo h ALA 71 Cb 0.30 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3bmo h ALA 71 CO -0.33 0.46 0.32 0.77 0.00 0.00 0.00 179.25 180.47 3bmo h SER 72 N 1.13 0.76 -0.41 0.00 0.02 -0.33 -0.84 113.55 113.89 3bmo h SER 72 Ca 0.32 -0.11 -0.11 0.00 -0.84 0.00 0.00 61.79 61.06 3bmo h SER 72 Cb -0.09 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.25 3bmo h SER 72 CO -0.08 0.65 -0.17 0.00 -1.14 0.00 0.00 176.83 176.09 3bmo h GLU 74 N 0.66 0.80 -0.72 0.00 4.39 -1.01 -2.40 114.58 116.30 3bmo h GLU 74 Ca 0.10 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.70 3bmo h GLU 74 Cb 0.72 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 29.15 3bmo h GLU 74 CO 0.05 0.53 0.27 1.49 -1.16 0.00 0.00 179.01 180.19 3bmo h GLU 75 N 0.82 1.08 -0.05 2.33 4.57 -0.79 0.86 114.58 123.40 3bmo h GLU 75 Ca 0.39 -0.20 -0.00 0.00 -1.18 0.00 0.00 59.36 58.37 3bmo h GLU 75 Cb 0.31 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 28.72 3bmo h GLU 75 CO -0.23 0.89 0.03 0.82 -1.18 0.00 0.00 179.01 179.34 3bmo h ILE 76 N 1.05 1.05 -0.50 2.32 2.04 -0.88 0.17 117.51 122.76 3bmo h ILE 76 Ca 0.24 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 3bmo h ILE 76 Cb 0.22 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 3bmo h ILE 76 CO -0.02 0.05 0.26 0.40 0.00 0.00 0.00 178.15 178.84 3bmo h ILE 77 N 0.02 1.18 -0.75 -0.67 1.08 -1.21 -2.72 117.51 114.44 3bmo h ILE 77 Ca 0.02 -0.49 0.00 0.00 -0.39 0.00 0.00 64.86 64.01 3bmo h ILE 77 Cb 0.05 0.58 -0.04 0.00 -3.07 0.00 0.00 36.82 34.34 3bmo h ILE 77 CO -0.00 0.20 0.48 0.78 -0.69 0.00 0.00 178.15 178.92 3bmo h ASN 78 N 0.67 0.87 -0.78 1.72 2.35 -0.56 -1.58 115.58 118.26 3bmo h ASN 78 Ca 0.18 -0.03 0.07 0.00 -0.55 0.00 0.00 56.30 55.97 3bmo h ASN 78 Cb 0.08 -0.22 -0.05 0.00 0.05 0.00 0.00 38.32 38.18 3bmo h ASN 78 CO -0.03 0.64 0.51 0.28 -1.65 0.00 0.00 177.43 177.19 3bmo h SER 79 N 1.02 0.73 -0.20 5.81 0.02 -0.34 0.57 113.55 121.15 3bmo h SER 79 Ca 0.27 0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 61.17 3bmo h SER 79 Cb -0.10 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 3bmo h SER 79 CO -0.06 0.46 -0.08 0.00 -1.14 0.00 0.00 176.83 176.01 3bmo h PHE 81 N 0.12 1.19 0.05 0.00 0.04 -1.06 -0.81 116.94 116.48 3bmo h PHE 81 Ca 0.05 -0.06 -0.00 0.00 2.80 0.00 0.00 57.97 60.75 3bmo h PHE 81 Cb 0.56 -0.37 0.00 0.00 2.20 0.00 0.00 35.95 38.35 3bmo h PHE 81 CO 0.06 0.87 -0.02 -0.09 -0.60 0.00 0.00 178.31 178.53 3bmo h ARG 82 N 1.18 -0.07 -0.39 1.51 2.43 -0.85 0.16 114.38 118.35 3bmo h ARG 82 Ca 0.28 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.30 3bmo h ARG 82 Cb 0.14 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 3bmo h ARG 82 CO -0.03 0.02 -0.36 0.00 -1.51 0.00 0.00 179.97 178.09 3bmo h ALA 83 N 0.80 0.62 0.00 2.80 0.00 -1.18 -3.40 119.26 118.91 3bmo h ALA 83 Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3bmo h ALA 83 Cb 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3bmo h ALA 83 CO 0.01 0.68 0.00 1.19 0.00 0.00 0.00 179.25 181.13 3bmo n PHE 84 N -4.06 0.00 -1.00 0.00 3.72 -0.32 -5.03 117.46 110.77 3bmo n PHE 84 Ca -0.02 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.38 3bmo n PHE 84 Cb 0.53 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.07 3bmo n PHE 84 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3bmo n GLY 85 N 0.58 0.48 3.60 1.37 0.00 0.54 -4.95 105.19 106.81 3bmo n GLY 85 Ca 0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 46.02 45.90 3bmo n GLY 85 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3bmo s ARG 86 N -0.19 0.79 -0.26 1.61 1.70 -1.26 -4.96 118.95 116.37 3bmo s ARG 86 Ca 0.00 -0.36 -0.01 0.00 -0.47 0.00 0.00 55.73 54.89 3bmo s ARG 86 Cb 0.00 0.32 0.14 0.00 -0.57 0.00 0.00 34.95 34.83 3bmo s ARG 86 CO 0.00 -0.35 0.34 0.00 -1.08 0.00 0.00 175.30 174.21 3bmo n ASP 88 N 5.34 0.47 -3.91 0.00 9.92 0.61 -4.96 116.55 124.02 3bmo n ASP 88 Ca -0.02 0.22 -0.17 0.00 -0.53 0.00 0.00 54.79 54.29 3bmo n ASP 88 Cb 0.49 0.45 -0.15 0.00 -0.64 0.00 0.00 41.12 41.27 3bmo n ASP 88 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3bmo s VAL 89 N -2.58 0.37 -0.13 2.53 1.01 -0.98 -1.46 120.40 119.17 3bmo s VAL 89 Ca -0.07 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 61.81 3bmo s VAL 89 Cb 0.07 -0.37 0.00 0.00 0.00 0.00 0.00 36.38 36.09 3bmo s VAL 89 CO 0.83 0.14 -0.21 -0.22 0.00 0.00 0.00 175.10 175.64 3bmo s LEU 90 N 0.36 2.18 -0.27 3.92 2.96 -0.86 -0.64 118.68 126.33 3bmo s LEU 90 Ca -0.04 -0.56 -0.02 0.00 -0.22 0.00 0.00 54.13 53.29 3bmo s LEU 90 Cb -0.07 -1.46 0.03 0.00 0.50 0.00 0.00 46.19 45.19 3bmo s LEU 90 CO -0.00 0.11 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.41 3bmo s VAL 91 N 0.64 2.94 -0.91 1.68 1.01 0.81 -0.93 120.40 125.63 3bmo s VAL 91 Ca -0.11 -1.12 -0.18 0.00 0.00 0.00 0.00 61.98 60.56 3bmo s VAL 91 Cb -0.16 -2.55 0.14 0.00 0.00 0.00 0.00 36.38 33.80 3bmo s VAL 91 CO 0.02 0.10 1.09 0.20 0.00 0.00 0.00 175.10 176.51 3bmo s ASN 92 N 1.31 6.62 -0.12 3.32 0.01 0.05 -1.55 114.94 124.58 3bmo s ASN 92 Ca -0.01 -2.06 0.04 0.00 -0.71 0.00 0.00 52.86 50.12 3bmo s ASN 92 Cb -0.18 -2.38 -0.11 0.00 0.41 0.00 0.00 41.25 39.00 3bmo s ASN 92 CO -0.03 -1.04 -0.06 -3.20 -1.51 0.00 0.00 177.10 171.26 3bmo n ASN 93 N 6.37 2.71 -4.63 -1.22 5.15 -1.26 -1.22 115.26 121.17 3bmo n ASN 93 Ca 0.22 -0.04 -0.43 0.00 -0.60 0.00 0.00 54.58 53.72 3bmo n ASN 93 Cb 0.49 0.17 -0.00 0.00 -0.53 0.00 0.00 39.78 39.91 3bmo n ASN 93 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3bmo n ALA 94 N -2.70 0.38 -3.62 5.20 0.00 -1.11 -4.90 120.51 113.76 3bmo n ALA 94 Ca -0.21 0.33 -0.04 0.00 0.00 0.00 0.00 53.44 53.52 3bmo n ALA 94 Cb 0.79 -2.11 -0.06 0.00 0.00 0.00 0.00 19.45 18.07 3bmo n ALA 94 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3bmo s SER 95 N -0.54 -0.73 0.17 0.00 0.15 -1.26 -4.52 113.70 106.97 3bmo s SER 95 Ca 0.59 1.13 -0.19 0.00 0.70 0.00 0.00 55.95 58.18 3bmo s SER 95 Cb -0.61 1.40 -0.08 0.00 -1.71 0.00 0.00 66.02 65.02 3bmo s SER 95 CO 0.60 -0.17 0.66 0.00 1.20 0.00 0.00 173.24 175.52 3bmo s ALA 96 N 1.67 3.49 -0.22 5.45 0.00 -1.26 -5.05 121.76 125.83 3bmo s ALA 96 Ca -0.09 0.09 -0.03 0.00 0.00 0.00 0.00 51.96 51.93 3bmo s ALA 96 Cb -0.05 -2.72 0.12 0.00 0.00 0.00 0.00 23.12 20.46 3bmo s ALA 96 CO -0.17 0.37 0.32 0.12 0.00 0.00 0.00 175.76 176.40 3bmo s PHE 97 N -1.39 -0.61 -0.03 0.00 5.36 -1.26 -4.85 117.98 115.20 3bmo s PHE 97 Ca 0.38 0.64 -0.29 0.00 -0.96 0.00 0.00 56.93 56.70 3bmo s PHE 97 Cb -0.17 -0.11 0.11 0.00 -0.34 0.00 0.00 43.02 42.50 3bmo s PHE 97 CO 0.21 -0.66 0.92 1.52 -1.46 0.00 0.00 175.22 175.75 3bmo s TYR 98 N 2.47 -0.32 0.47 10.12 -0.85 -1.26 -5.17 117.35 122.81 3bmo s TYR 98 Ca 0.10 0.20 -0.21 0.00 -0.52 0.00 0.00 57.07 56.63 3bmo s TYR 98 Cb -0.15 0.54 -0.08 0.00 0.38 0.00 0.00 41.96 42.64 3bmo s TYR 98 CO -0.14 -0.51 1.08 -1.25 -1.52 0.00 0.00 175.55 173.21 3bmo s PRO 99 N -3.03 3.80 -0.44 -3.49 0.04 -1.26 -4.69 135.00 125.93 3bmo s PRO 99 Ca 0.05 1.52 0.04 0.00 0.04 0.00 0.00 61.00 62.65 3bmo s PRO 99 Cb -0.01 -2.24 0.16 0.00 0.04 0.00 0.00 34.50 32.45 3bmo s PRO 99 CO -0.09 -0.46 0.34 0.95 0.04 0.00 0.00 177.00 177.78 3bmo s THR 100 N -1.78 0.66 0.48 1.26 -4.23 0.85 -4.99 115.64 107.88 3bmo s THR 100 Ca 0.65 -2.72 -0.24 0.00 -1.18 0.00 0.00 61.69 58.20 3bmo s THR 100 Cb -0.21 -1.46 -0.07 0.00 1.34 0.00 0.00 72.50 72.09 3bmo s THR 100 CO 0.26 -1.17 1.41 -2.84 -0.54 0.00 0.00 174.62 171.74 3bmo s PRO 101 N 0.02 3.54 0.21 3.99 0.02 -1.22 -4.30 135.00 137.26 3bmo s PRO 101 Ca 0.29 2.37 0.07 0.00 0.02 0.00 0.00 61.00 63.75 3bmo s PRO 101 Cb -0.02 -2.55 0.12 0.00 0.02 0.00 0.00 34.50 32.08 3bmo s PRO 101 CO -0.16 -0.92 1.47 -0.07 -0.33 0.00 0.00 177.00 176.99 3bmo h LEU 102 N 2.09 0.09 -8.50 -5.54 3.38 -2.01 -3.44 115.31 101.38 3bmo h LEU 102 Ca -0.51 -0.07 -0.68 0.00 0.09 0.00 0.00 57.88 56.72 3bmo h LEU 102 Cb 1.27 -0.03 -0.30 0.00 0.09 0.00 0.00 40.66 41.70 3bmo h LEU 102 CO 0.60 0.82 -0.84 0.68 0.09 0.00 0.00 178.44 179.79 3bmo s VAL 103 N -3.31 2.40 0.00 1.22 -7.23 -1.26 -5.25 120.40 106.96 3bmo s VAL 103 Ca -0.01 -0.92 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 3bmo s VAL 103 Cb 0.11 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 35.12 3bmo s VAL 103 CO 0.80 0.56 0.00 1.67 -0.31 0.00 0.00 175.10 177.81 3bmo n GLN 104 N 3.26 3.39 0.00 4.82 7.27 -1.26 -5.21 117.38 129.65 3bmo n GLN 104 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.89 3bmo n GLN 104 Cb 0.53 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.18 3bmo n GLN 104 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3bmo n GLY 113 N 5.00 0.80 3.79 1.69 0.00 -1.26 -5.25 105.19 109.96 3bmo n GLY 113 Ca 0.00 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 44.87 3bmo n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bmo s LYS 114 N 0.00 4.51 0.75 1.61 1.02 -1.26 -5.05 119.74 121.31 3bmo s LYS 114 Ca 0.00 1.14 -0.11 0.00 0.02 0.00 0.00 55.97 57.01 3bmo s LYS 114 Cb 0.00 -3.06 0.04 0.00 -0.52 0.00 0.00 37.83 34.29 3bmo s LYS 114 CO 0.00 0.46 1.09 0.95 -0.92 0.00 0.00 175.35 176.93 3bmo s THR 115 N -1.35 3.31 0.28 2.17 -4.23 -1.26 -4.86 115.64 109.70 3bmo s THR 115 Ca 0.41 0.46 -0.02 0.00 -1.18 0.00 0.00 61.69 61.36 3bmo s THR 115 Cb -0.21 -2.96 0.27 0.00 1.34 0.00 0.00 72.50 70.95 3bmo s THR 115 CO 0.25 -0.52 1.93 1.62 -0.54 0.00 0.00 174.62 177.35 3bmo h VAL 116 N -0.89 1.16 0.00 2.29 3.04 -1.99 -1.75 116.25 118.12 3bmo h VAL 116 Ca -0.44 -0.40 -0.08 0.00 -1.01 0.00 0.00 66.70 64.77 3bmo h VAL 116 Cb 1.23 -0.11 -0.01 0.00 -2.01 0.00 0.00 31.29 30.39 3bmo h VAL 116 CO 0.52 0.21 -0.36 -0.33 -1.01 0.00 0.00 177.57 176.60 3bmo h GLU 117 N 1.17 0.00 -0.53 4.17 4.39 -1.99 0.14 114.58 121.93 3bmo h GLU 117 Ca 0.37 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.95 3bmo h GLU 117 Cb 0.01 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 3bmo h GLU 117 CO -0.11 0.36 -0.14 1.15 -1.16 0.00 0.00 179.01 179.11 3bmo h THR 118 N 0.00 1.27 -0.63 1.13 2.02 -1.74 -0.80 112.91 114.15 3bmo h THR 118 Ca -0.00 -1.30 -0.06 0.00 0.77 0.00 0.00 66.41 65.81 3bmo h THR 118 Cb 0.69 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 3bmo h THR 118 CO 0.05 0.46 0.16 1.56 0.37 0.00 0.00 175.52 178.12 3bmo h GLN 119 N 0.90 1.00 -0.34 6.66 4.20 -0.63 0.27 115.11 127.18 3bmo h GLN 119 Ca 0.13 -0.24 0.03 0.00 0.06 0.00 0.00 58.65 58.64 3bmo h GLN 119 Cb 0.71 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 3bmo h GLN 119 CO 0.05 0.90 0.15 0.28 -0.67 0.00 0.00 178.83 179.55 3bmo h VAL 120 N 0.92 0.95 -0.60 -0.54 2.07 -0.63 -0.67 116.25 117.75 3bmo h VAL 120 Ca 0.20 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 3bmo h VAL 120 Cb 0.34 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 3bmo h VAL 120 CO 0.00 0.06 0.36 0.00 0.02 0.00 0.00 177.57 178.01 3bmo h ALA 121 N 1.19 0.77 0.11 1.67 0.00 -0.44 -0.93 119.26 121.63 3bmo h ALA 121 Ca 0.15 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3bmo h ALA 121 Cb 0.08 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3bmo h ALA 121 CO -0.12 0.25 -0.05 0.93 0.00 0.00 0.00 179.25 180.26 3bmo h GLU 122 N 0.81 -0.14 -0.07 0.00 5.08 -0.85 -0.25 114.58 119.16 3bmo h GLU 122 Ca 0.22 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.51 3bmo h GLU 122 Cb -0.01 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3bmo h GLU 122 CO -0.04 0.34 -0.26 -0.07 -1.00 0.00 0.00 179.01 177.99 3bmo h LEU 123 N -0.73 0.35 -0.21 1.33 3.38 -1.10 -0.85 115.31 117.49 3bmo h LEU 123 Ca -0.01 -0.63 -0.22 0.00 0.09 0.00 0.00 57.88 57.11 3bmo h LEU 123 Cb 0.55 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 3bmo h LEU 123 CO 0.02 0.92 -0.92 0.40 0.09 0.00 0.00 178.44 178.95 3bmo h ILE 124 N -0.20 1.43 0.72 1.22 1.08 -1.34 -2.83 117.51 117.59 3bmo h ILE 124 Ca -0.01 -2.49 -0.04 0.00 -0.39 0.00 0.00 64.86 61.93 3bmo h ILE 124 Cb 0.90 2.43 0.01 0.00 -3.07 0.00 0.00 36.82 37.08 3bmo h ILE 124 CO 0.05 0.74 -0.35 1.23 -0.69 0.00 0.00 178.15 179.14 3bmo h GLY 125 N 1.42 -1.01 0.97 5.37 0.00 -1.23 -0.55 103.07 108.03 3bmo h GLY 125 Ca -0.07 0.38 -0.06 0.00 0.00 0.00 0.00 47.33 47.57 3bmo h GLY 125 CO 0.15 -0.37 0.04 -0.91 0.00 0.00 0.00 176.54 175.45 3bmo h THR 126 N -0.98 1.25 0.00 4.70 1.35 -1.11 0.73 112.91 118.85 3bmo h THR 126 Ca -0.10 -0.97 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 3bmo h THR 126 Cb 0.75 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 3bmo h THR 126 CO 0.16 0.34 -0.18 0.78 -0.25 0.00 0.00 175.52 176.37 3bmo h ASN 127 N 0.62 0.00 0.00 5.36 2.35 -1.57 -3.40 115.58 118.94 3bmo h ASN 127 Ca 0.13 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 3bmo h ASN 127 Cb 0.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.81 3bmo h ASN 127 CO 0.02 0.01 0.00 0.00 -1.65 0.00 0.00 177.43 175.81 3bmo n ALA 128 N -1.99 2.83 -0.08 -0.83 0.00 -0.55 -4.43 120.51 115.46 3bmo n ALA 128 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.35 3bmo n ALA 128 Cb 0.49 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.89 3bmo n ALA 128 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3bmo h ILE 129 N 0.00 1.32 -0.12 0.00 2.04 -0.93 -1.52 117.51 118.29 3bmo h ILE 129 Ca 0.00 -1.35 0.00 0.00 1.00 0.00 0.00 64.86 64.52 3bmo h ILE 129 Cb 0.00 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 3bmo h ILE 129 CO 0.00 0.42 0.08 0.00 0.00 0.00 0.00 178.15 178.64 3bmo h ALA 130 N 0.68 0.15 -0.93 1.87 0.00 -1.10 0.14 119.26 120.07 3bmo h ALA 130 Ca 0.04 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.11 3bmo h ALA 130 Cb 0.74 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.41 3bmo h ALA 130 CO 0.05 -0.37 0.60 -1.35 0.00 0.00 0.00 179.25 178.18 3bmo h PRO 131 N 0.16 0.65 -0.15 0.00 0.11 -1.75 0.20 132.00 131.22 3bmo h PRO 131 Ca 0.04 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 3bmo h PRO 131 Cb -0.02 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 30.94 3bmo h PRO 131 CO -0.01 0.43 0.04 0.35 -0.21 0.00 0.00 178.00 178.60 3bmo h PHE 132 N 0.67 0.25 -0.48 0.65 3.57 -0.53 -0.16 116.94 120.91 3bmo h PHE 132 Ca 0.49 -0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.85 3bmo h PHE 132 Cb 0.86 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 3bmo h PHE 132 CO -0.00 0.37 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.24 3bmo h LEU 133 N 0.05 0.95 -0.96 0.59 3.38 -0.38 -0.79 115.31 118.15 3bmo h LEU 133 Ca 0.05 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 3bmo h LEU 133 Cb 0.24 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 3bmo h LEU 133 CO -0.00 1.10 0.35 -0.07 0.09 0.00 0.00 178.44 179.91 3bmo h LEU 134 N 0.79 1.00 -0.37 1.67 3.38 -0.58 -0.15 115.31 121.05 3bmo h LEU 134 Ca 0.12 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3bmo h LEU 134 Cb 0.69 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3bmo h LEU 134 CO 0.05 0.85 0.22 0.74 0.09 0.00 0.00 178.44 180.40 3bmo h THR 135 N 1.08 1.13 0.04 0.22 2.02 -0.70 -0.04 112.91 116.67 3bmo h THR 135 Ca 0.26 -0.30 0.01 0.00 0.77 0.00 0.00 66.41 67.15 3bmo h THR 135 Cb 0.13 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 3bmo h THR 135 CO -0.03 0.13 -0.11 0.24 0.37 0.00 0.00 175.52 176.12 3bmo h MET 136 N 0.49 -0.19 -0.71 6.66 2.86 -0.87 -0.37 114.93 122.79 3bmo h MET 136 Ca 0.13 0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.76 3bmo h MET 136 Cb 0.01 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 3bmo h MET 136 CO -0.02 -0.13 0.32 0.77 1.06 0.00 0.00 176.91 178.91 3bmo h SER 137 N -0.20 0.95 -0.30 1.22 0.02 -0.91 -0.33 113.55 113.99 3bmo h SER 137 Ca 0.03 -0.15 0.01 0.00 -0.84 0.00 0.00 61.79 60.84 3bmo h SER 137 Cb 0.23 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 3bmo h SER 137 CO -0.08 0.83 0.18 0.15 -1.14 0.00 0.00 176.83 176.77 3bmo h PHE 138 N 1.00 0.34 -0.27 3.45 3.04 -0.80 -2.28 116.94 121.42 3bmo h PHE 138 Ca 0.24 0.01 -0.18 0.00 3.98 0.00 0.00 57.97 62.02 3bmo h PHE 138 Cb 0.15 -0.11 0.00 0.00 2.56 0.00 0.00 35.95 38.55 3bmo h PHE 138 CO 0.01 0.21 -0.53 0.00 -2.02 0.00 0.00 178.31 175.98 3bmo h ALA 139 N 1.12 0.43 0.00 2.41 0.00 -0.89 -3.09 119.26 119.24 3bmo h ALA 139 Ca 0.11 -0.51 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 3bmo h ALA 139 Cb -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3bmo h ALA 139 CO -0.04 0.63 -0.29 1.96 0.00 0.00 0.00 179.25 181.50 3bmo h GLN 140 N 0.60 0.00 0.00 0.00 4.20 -0.97 -2.15 115.11 116.79 3bmo h GLN 140 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3bmo h GLN 140 Cb 1.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.92 3bmo h GLN 140 CO 0.12 0.29 0.00 0.54 -0.67 0.00 0.00 178.83 179.11 3bmo n ARG 141 N -3.85 0.00 -0.03 1.46 5.12 -0.87 -3.84 116.66 114.65 3bmo n ARG 141 Ca -0.02 0.02 -0.02 0.00 -1.93 0.00 0.00 57.85 55.90 3bmo n ARG 141 Cb 0.37 -1.50 -0.01 0.00 -1.16 0.00 0.00 32.46 30.16 3bmo n ARG 141 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3bmo n GLN 142 N -1.50 0.19 -1.20 5.56 1.13 -0.86 -5.05 117.38 115.65 3bmo n GLN 142 Ca 0.07 0.31 -0.34 0.00 -1.94 0.00 0.00 57.00 55.10 3bmo n GLN 142 Cb 0.33 -1.10 -0.04 0.00 0.11 0.00 0.00 30.24 29.54 3bmo n GLN 142 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 3bmo n LYS 143 N -3.26 3.33 -0.73 -1.09 3.00 -0.92 -5.14 118.16 113.36 3bmo n LYS 143 Ca -0.03 -1.99 -0.23 0.00 -0.00 0.00 0.00 58.31 56.06 3bmo n LYS 143 Cb 0.13 -2.68 0.19 0.00 0.00 0.00 0.00 35.03 32.67 3bmo n LYS 143 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3bmo n SER 151 N 3.57 -2.02 -4.83 3.14 2.88 -1.26 -4.92 113.62 110.17 3bmo n SER 151 Ca 0.71 -0.97 -0.32 0.00 -1.33 0.00 0.00 58.87 56.95 3bmo n SER 151 Cb 0.27 -0.76 -0.04 0.00 -0.75 0.00 0.00 64.21 62.93 3bmo n SER 151 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3bmo s SER 152 N -3.66 6.68 -0.41 -3.46 0.15 -1.26 -5.04 113.70 106.70 3bmo s SER 152 Ca 0.54 1.62 0.04 0.00 0.70 0.00 0.00 55.95 58.85 3bmo s SER 152 Cb -0.06 -2.52 0.18 0.00 -1.71 0.00 0.00 66.02 61.91 3bmo s SER 152 CO 0.42 -0.54 0.36 -3.20 1.20 0.00 0.00 173.24 171.47 3bmo n ASN 153 N -1.32 -0.39 -4.75 5.45 5.15 -1.26 -5.12 115.26 113.02 3bmo n ASN 153 Ca 0.07 -2.41 -0.39 0.00 -0.60 0.00 0.00 54.58 51.25 3bmo n ASN 153 Cb 0.54 -0.56 -0.05 0.00 -0.53 0.00 0.00 39.78 39.17 3bmo n ASN 153 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3bmo s LEU 154 N -0.06 4.37 0.17 1.20 1.43 -1.26 -4.82 118.68 119.71 3bmo s LEU 154 Ca 0.33 1.10 -0.20 0.00 -1.03 0.00 0.00 54.13 54.33 3bmo s LEU 154 Cb 0.05 -2.91 0.05 0.00 0.03 0.00 0.00 46.19 43.41 3bmo s LEU 154 CO -0.19 0.04 0.54 -0.94 0.23 0.00 0.00 176.35 176.02 3bmo s SER 155 N 0.15 -0.38 -0.03 2.29 1.04 -0.53 -2.07 113.70 114.17 3bmo s SER 155 Ca 0.31 -0.26 0.07 0.00 0.48 0.00 0.00 55.95 56.55 3bmo s SER 155 Cb -0.17 0.57 -0.02 0.00 0.10 0.00 0.00 66.02 66.50 3bmo s SER 155 CO 0.16 -0.99 -0.24 -0.63 0.98 0.00 0.00 173.24 172.52 3bmo s ILE 156 N -3.81 1.94 -0.16 -1.02 1.01 0.01 -2.03 121.20 117.14 3bmo s ILE 156 Ca 0.04 -1.04 0.00 0.00 0.00 0.00 0.00 60.65 59.66 3bmo s ILE 156 Cb -0.01 -1.62 0.03 0.00 0.01 0.00 0.00 42.46 40.87 3bmo s ILE 156 CO -0.09 0.55 -0.13 -0.69 0.00 0.00 0.00 174.94 174.58 3bmo s VAL 157 N -0.45 1.54 -0.19 2.92 1.01 -0.11 -1.32 120.40 123.80 3bmo s VAL 157 Ca 0.06 -0.68 -0.12 0.00 0.00 0.00 0.00 61.98 61.24 3bmo s VAL 157 Cb -0.11 -1.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 3bmo s VAL 157 CO 0.00 0.39 0.20 0.20 0.00 0.00 0.00 175.10 175.89 3bmo s ASN 158 N 1.49 6.28 -0.51 3.32 0.01 0.13 -0.77 114.94 124.88 3bmo s ASN 158 Ca 0.04 0.31 -0.28 0.00 -0.71 0.00 0.00 52.86 52.22 3bmo s ASN 158 Cb -0.13 -2.13 0.03 0.00 0.41 0.00 0.00 41.25 39.43 3bmo s ASN 158 CO -0.10 0.13 1.10 -0.76 -1.51 0.00 0.00 177.10 175.95 3bmo s LEU 159 N 0.53 3.69 0.00 0.60 2.01 -0.36 -1.38 118.68 123.78 3bmo s LEU 159 Ca 0.11 0.22 0.00 0.00 0.01 0.00 0.00 54.13 54.47 3bmo s LEU 159 Cb -0.12 -3.31 0.00 0.00 0.01 0.00 0.00 46.19 42.77 3bmo s LEU 159 CO 0.01 -1.28 0.00 0.00 1.01 0.00 0.00 176.35 176.09 3bmo s ASP 161 N -1.00 -1.16 0.33 0.00 -1.08 -1.26 -4.29 116.67 108.21 3bmo s ASP 161 Ca 0.00 1.48 0.25 0.00 -0.52 0.00 0.00 52.55 53.76 3bmo s ASP 161 Cb 0.00 2.28 1.17 0.00 -1.46 0.00 0.00 42.92 44.90 3bmo s ASP 161 CO 0.00 -0.22 1.76 0.00 0.52 0.00 0.00 175.17 177.23 3bmo h ALA 162 N 7.99 1.00 -0.64 3.66 0.00 -0.88 -2.99 119.26 127.40 3bmo h ALA 162 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3bmo h ALA 162 Cb 1.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3bmo h ALA 162 CO 0.12 0.00 0.00 -1.33 0.00 0.00 0.00 179.25 178.04 3bmo n MET 163 N -2.37 2.56 0.07 0.00 2.81 -1.26 -4.61 117.12 114.32 3bmo n MET 163 Ca 0.00 -2.33 0.17 0.00 -1.81 0.00 0.00 57.70 53.73 3bmo n MET 163 Cb 0.16 -1.53 0.68 0.00 -0.71 0.00 0.00 33.22 31.83 3bmo n MET 163 CO 0.00 0.00 0.00 -0.39 1.51 0.00 0.00 175.97 177.09 3bmo h VAL 164 N 3.75 0.79 -0.02 2.03 -1.51 -1.93 -0.49 116.25 118.87 3bmo h VAL 164 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 3bmo h VAL 164 Cb 0.90 0.80 0.00 0.00 -2.13 0.00 0.00 31.29 30.86 3bmo h VAL 164 CO 0.02 0.00 -0.07 0.47 -1.23 0.00 0.00 177.57 176.76 3bmo n ASP 165 N -4.40 1.92 -3.19 4.19 8.00 -1.26 -4.30 116.55 117.50 3bmo n ASP 165 Ca 0.06 -1.57 -0.21 0.00 0.71 0.00 0.00 54.79 53.78 3bmo n ASP 165 Cb 0.47 0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.57 3bmo n ASP 165 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3bmo n GLN 166 N 0.40 0.97 -1.73 -1.24 6.02 -0.22 -5.13 117.38 116.44 3bmo n GLN 166 Ca 0.16 -3.39 -0.30 0.00 -0.01 0.00 0.00 57.00 53.45 3bmo n GLN 166 Cb 0.43 -1.51 0.05 0.00 1.02 0.00 0.00 30.24 30.24 3bmo n GLN 166 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3bmo s PRO 167 N -1.87 2.80 0.23 -1.09 0.04 -1.07 -4.89 135.00 129.16 3bmo s PRO 167 Ca 0.38 0.66 -0.32 0.00 0.04 0.00 0.00 61.00 61.76 3bmo s PRO 167 Cb 0.26 -2.00 -0.13 0.00 0.04 0.00 0.00 34.50 32.66 3bmo s PRO 167 CO -0.09 -1.12 1.44 0.00 0.04 0.00 0.00 177.00 177.27 3bmo n MET 169 N 2.27 2.61 -1.28 0.00 1.56 -1.26 -2.63 117.12 118.39 3bmo n MET 169 Ca 0.12 0.94 -0.05 0.00 -0.27 0.00 0.00 57.70 58.44 3bmo n MET 169 Cb 0.31 -2.77 -0.02 0.00 2.15 0.00 0.00 33.22 32.88 3bmo n MET 169 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3bmo n ALA 170 N 4.10 -0.09 -1.87 -5.12 0.00 -1.26 -4.94 120.51 111.34 3bmo n ALA 170 Ca 0.17 0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.40 3bmo n ALA 170 Cb 0.33 -0.91 0.04 0.00 0.00 0.00 0.00 19.45 18.91 3bmo n ALA 170 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3bmo n PHE 171 N -2.99 3.01 -0.07 0.00 3.01 -1.08 -0.10 117.46 119.23 3bmo n PHE 171 Ca -0.06 -2.59 -0.09 0.00 1.01 0.00 0.00 57.45 55.72 3bmo n PHE 171 Cb 0.23 -0.71 -0.02 0.00 -0.01 0.00 0.00 39.48 38.97 3bmo n PHE 171 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3bmo h SER 172 N 2.25 0.25 -0.40 4.37 4.64 -1.84 -0.70 113.55 122.13 3bmo h SER 172 Ca 0.45 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.74 3bmo h SER 172 Cb 1.11 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 63.13 3bmo h SER 172 CO 1.08 0.19 0.13 -0.07 -0.87 0.00 0.00 176.83 177.28 3bmo h LEU 173 N 0.32 0.58 -0.23 5.97 3.38 -1.89 0.14 115.31 123.58 3bmo h LEU 173 Ca 0.10 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.91 3bmo h LEU 173 Cb -0.00 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 3bmo h LEU 173 CO -0.05 0.63 0.01 0.22 0.09 0.00 0.00 178.44 179.34 3bmo h TYR 174 N 0.50 0.01 -0.68 1.13 3.20 -1.80 -0.16 116.97 119.18 3bmo h TYR 174 Ca 0.13 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 3bmo h TYR 174 Cb 0.25 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.52 3bmo h TYR 174 CO 0.01 -0.02 0.42 -0.97 -1.64 0.00 0.00 178.16 175.96 3bmo h ASN 175 N 0.09 0.81 -0.67 -2.11 -1.24 -0.79 -0.48 115.58 111.19 3bmo h ASN 175 Ca 0.11 -0.05 0.03 0.00 0.71 0.00 0.00 56.30 57.10 3bmo h ASN 175 Cb 0.13 -0.21 -0.04 0.00 0.73 0.00 0.00 38.32 38.93 3bmo h ASN 175 CO -0.17 0.63 0.41 0.24 -1.29 0.00 0.00 177.43 177.25 3bmo h MET 176 N 0.93 0.78 -0.54 6.67 2.86 -0.42 -0.24 114.93 124.96 3bmo h MET 176 Ca 0.25 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.83 3bmo h MET 176 Cb -0.05 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.41 3bmo h MET 176 CO -0.05 0.51 0.31 0.78 1.06 0.00 0.00 176.91 179.53 3bmo h GLY 177 N 0.80 0.80 1.40 8.32 0.00 -0.18 0.11 103.07 114.32 3bmo h GLY 177 Ca 0.27 -0.35 -0.14 0.00 0.00 0.00 0.00 47.33 47.11 3bmo h GLY 177 CO -0.12 0.34 -0.40 0.50 0.00 0.00 0.00 176.54 176.87 3bmo h LYS 178 N 0.73 0.66 -0.38 4.80 1.79 -0.80 -0.61 116.57 122.77 3bmo h LYS 178 Ca 0.19 -0.34 -0.01 0.00 -2.18 0.00 0.00 60.65 58.31 3bmo h LYS 178 Cb 0.02 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.66 3bmo h LYS 178 CO -0.03 0.94 0.21 0.45 -1.08 0.00 0.00 179.45 179.94 3bmo h HIS 179 N 0.55 0.52 -0.92 -1.35 3.86 -0.85 -1.56 115.15 115.39 3bmo h HIS 179 Ca 0.05 -0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.35 3bmo h HIS 179 Cb 0.92 -0.17 -0.07 0.00 1.06 0.00 0.00 27.41 29.15 3bmo h HIS 179 CO 0.04 0.41 0.59 0.00 0.86 0.00 0.00 177.93 179.84 3bmo h ALA 180 N 1.06 1.63 -0.39 2.45 0.00 -0.41 -1.75 119.26 121.86 3bmo h ALA 180 Ca 0.13 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 3bmo h ALA 180 Cb 0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3bmo h ALA 180 CO -0.02 0.16 -0.09 1.25 0.00 0.00 0.00 179.25 180.55 3bmo h LEU 181 N 0.89 0.65 -0.23 0.00 5.85 -0.55 0.78 115.31 122.70 3bmo h LEU 181 Ca 0.44 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 59.01 3bmo h LEU 181 Cb 0.47 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 3bmo h LEU 181 CO -0.20 0.78 0.05 0.58 -0.34 0.00 0.00 178.44 179.31 3bmo h VAL 182 N 0.61 0.91 -0.61 1.05 2.07 -0.49 0.21 116.25 120.00 3bmo h VAL 182 Ca 0.11 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.64 3bmo h VAL 182 Cb 0.52 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 3bmo h VAL 182 CO 0.03 0.03 0.31 1.23 0.02 0.00 0.00 177.57 179.19 3bmo h GLY 183 N 0.15 0.89 0.99 2.17 0.00 -0.71 -1.34 103.07 105.21 3bmo h GLY 183 Ca 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 3bmo h GLY 183 CO -0.13 0.11 0.32 -2.00 0.00 0.00 0.00 176.54 174.85 3bmo h LEU 184 N 0.58 0.73 -0.34 3.11 5.85 -0.63 0.43 115.31 125.05 3bmo h LEU 184 Ca 0.28 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.96 3bmo h LEU 184 Cb 0.21 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 3bmo h LEU 184 CO -0.20 0.61 0.08 0.74 -0.34 0.00 0.00 178.44 179.33 3bmo h THR 185 N 0.79 0.85 0.08 1.05 2.02 -0.23 0.10 112.91 117.57 3bmo h THR 185 Ca 0.21 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.31 3bmo h THR 185 Cb 0.04 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3bmo h THR 185 CO -0.03 0.04 -0.04 1.56 0.37 0.00 0.00 175.52 177.42 3bmo h GLN 186 N 0.20 -0.10 -0.45 6.66 4.20 -1.09 -1.42 115.11 123.11 3bmo h GLN 186 Ca 0.16 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.88 3bmo h GLN 186 Cb 0.16 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 3bmo h GLN 186 CO -0.20 0.24 0.29 0.77 -0.67 0.00 0.00 178.83 179.27 3bmo h SER 187 N -0.45 0.53 -0.11 1.46 0.02 -0.75 -1.60 113.55 112.64 3bmo h SER 187 Ca -0.01 -0.03 -0.14 0.00 -0.84 0.00 0.00 61.79 60.78 3bmo h SER 187 Cb 0.39 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 3bmo h SER 187 CO 0.02 0.39 -0.40 0.00 -1.14 0.00 0.00 176.83 175.70 3bmo h ALA 188 N 1.16 0.79 -0.24 3.77 0.00 -0.87 -1.24 119.26 122.63 3bmo h ALA 188 Ca 0.17 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.64 3bmo h ALA 188 Cb -0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3bmo h ALA 188 CO -0.03 0.65 0.14 0.00 0.00 0.00 0.00 179.25 180.01 3bmo h ALA 189 N 1.03 0.30 -0.32 0.00 0.00 -0.99 0.89 119.26 120.16 3bmo h ALA 189 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3bmo h ALA 189 Cb 0.92 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3bmo h ALA 189 CO 0.08 -0.25 0.20 1.25 0.00 0.00 0.00 179.25 180.54 3bmo h LEU 190 N 0.29 0.38 -0.14 0.00 5.85 -1.13 -2.48 115.31 118.09 3bmo h LEU 190 Ca 0.09 -0.04 -0.20 0.00 0.84 0.00 0.00 57.88 58.58 3bmo h LEU 190 Cb -0.01 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3bmo h LEU 190 CO -0.04 0.31 -0.94 -0.08 -0.34 0.00 0.00 178.44 177.34 3bmo h GLU 191 N 0.42 0.03 -0.00 1.25 4.81 -1.05 -3.27 114.58 116.77 3bmo h GLU 191 Ca 0.12 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3bmo h GLU 191 Cb -0.01 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3bmo h GLU 191 CO -0.02 0.95 -0.72 1.28 -0.73 0.00 0.00 179.01 179.77 3bmo n LEU 192 N -3.46 0.91 -0.34 1.64 4.77 0.29 -4.36 117.00 116.46 3bmo n LEU 192 Ca -0.01 -0.32 0.05 0.00 -0.03 0.00 0.00 56.01 55.70 3bmo n LEU 192 Cb 0.88 -0.10 0.20 0.00 -2.33 0.00 0.00 43.42 42.08 3bmo n LEU 192 CO 0.47 0.21 1.21 0.00 -1.33 0.00 0.00 177.39 177.95 3bmo h ALA 193 N 3.13 1.38 0.00 -1.18 0.00 -1.49 -0.73 119.26 120.37 3bmo h ALA 193 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3bmo h ALA 193 Cb 0.52 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3bmo h ALA 193 CO 0.00 0.22 -0.01 -1.35 0.00 0.00 0.00 179.25 178.11 3bmo h PRO 194 N 0.96 0.00 -0.16 0.00 0.11 -1.80 -0.54 132.00 130.57 3bmo h PRO 194 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 3bmo h PRO 194 Cb 0.39 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.50 3bmo h PRO 194 CO -0.24 0.01 0.00 0.66 -0.21 0.00 0.00 178.00 178.21 3bmo n TYR 195 N -3.36 0.20 -1.19 0.65 4.02 -0.30 -4.94 117.16 112.23 3bmo n TYR 195 Ca -0.03 -0.10 -0.07 0.00 -0.01 0.00 0.00 57.90 57.70 3bmo n TYR 195 Cb 0.09 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.38 3bmo n TYR 195 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3bmo n GLY 196 N 1.24 0.88 3.46 2.72 0.00 -0.21 -5.00 105.19 108.27 3bmo n GLY 196 Ca 0.17 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 3bmo n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3bmo s ILE 197 N -2.23 4.68 0.29 -0.61 1.01 -1.05 -4.19 121.20 119.09 3bmo s ILE 197 Ca 0.00 -0.33 -0.14 0.00 0.00 0.00 0.00 60.65 60.19 3bmo s ILE 197 Cb 0.00 -3.35 -0.08 0.00 0.01 0.00 0.00 42.46 39.04 3bmo s ILE 197 CO 0.00 0.11 0.68 -0.13 0.00 0.00 0.00 174.94 175.60 3bmo s ARG 198 N 1.63 3.97 -0.11 2.79 0.52 -0.88 -3.79 118.95 123.08 3bmo s ARG 198 Ca 0.05 0.57 -0.03 0.00 -0.52 0.00 0.00 55.73 55.80 3bmo s ARG 198 Cb -0.17 -2.53 0.04 0.00 0.52 0.00 0.00 34.95 32.81 3bmo s ARG 198 CO 0.07 0.22 0.07 0.08 0.02 0.00 0.00 175.30 175.76 3bmo s VAL 199 N -1.89 -0.04 0.30 3.52 1.01 -1.26 -0.81 120.40 121.23 3bmo s VAL 199 Ca 0.51 0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.63 3bmo s VAL 199 Cb -0.11 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 3bmo s VAL 199 CO 0.19 -0.03 0.18 0.20 0.00 0.00 0.00 175.10 175.63 3bmo s ASN 200 N 2.13 1.38 0.09 3.32 0.01 -0.43 0.16 114.94 121.59 3bmo s ASN 200 Ca 0.03 -1.57 0.02 0.00 -0.71 0.00 0.00 52.86 50.63 3bmo s ASN 200 Cb -0.14 0.42 -0.04 0.00 0.41 0.00 0.00 41.25 41.90 3bmo s ASN 200 CO -0.06 -0.92 -0.08 -0.83 -1.51 0.00 0.00 177.10 173.71 3bmo s GLY 201 N -3.35 0.75 -0.10 0.66 0.00 0.32 -0.70 107.32 104.91 3bmo s GLY 201 Ca 0.37 -1.22 0.03 0.00 0.00 0.00 0.00 44.72 43.90 3bmo s GLY 201 CO 0.19 -1.31 -0.20 0.14 0.00 0.00 0.00 173.10 171.92 3bmo s VAL 202 N -2.97 1.76 -0.54 1.40 1.01 -0.48 -1.10 120.40 119.48 3bmo s VAL 202 Ca 0.07 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.23 3bmo s VAL 202 Cb 0.01 -1.55 0.14 0.00 0.00 0.00 0.00 36.38 34.97 3bmo s VAL 202 CO -0.03 0.49 0.30 0.00 0.00 0.00 0.00 175.10 175.87 3bmo s ALA 203 N 0.59 3.37 0.81 5.51 0.00 0.09 -0.18 121.76 131.95 3bmo s ALA 203 Ca -0.14 -3.21 -0.12 0.00 0.00 0.00 0.00 51.96 48.49 3bmo s ALA 203 Cb -0.17 -2.32 0.08 0.00 0.00 0.00 0.00 23.12 20.72 3bmo s ALA 203 CO 0.05 -2.02 1.14 -2.14 0.00 0.00 0.00 175.76 172.79 3bmo s PRO 204 N -0.11 1.78 0.00 0.00 0.02 -1.26 -0.92 135.00 134.50 3bmo s PRO 204 Ca 0.16 1.47 0.00 0.00 0.02 0.00 0.00 61.00 62.65 3bmo s PRO 204 Cb -0.24 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.46 3bmo s PRO 204 CO -0.02 -2.05 0.00 0.41 -0.33 0.00 0.00 177.00 175.01 3bmo n GLY 205 N -0.24 -0.03 3.43 0.52 0.00 -1.16 -0.45 105.19 107.28 3bmo n GLY 205 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 3bmo n GLY 205 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3bmo s VAL 206 N 0.66 4.03 0.00 1.61 -7.23 -1.26 -4.83 120.40 113.37 3bmo s VAL 206 Ca 0.00 -0.28 0.00 0.00 -1.81 0.00 0.00 61.98 59.89 3bmo s VAL 206 Cb 0.00 -2.85 0.00 0.00 0.56 0.00 0.00 36.38 34.09 3bmo s VAL 206 CO 0.00 0.39 0.00 -0.24 -0.31 0.00 0.00 175.10 174.94 3bmo n SER 207 N 4.58 0.00 -4.67 4.85 2.88 -1.26 -0.88 113.62 119.11 3bmo n SER 207 Ca -0.17 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 56.91 3bmo n SER 207 Cb 0.51 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.93 3bmo n SER 207 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3bmo n LEU 208 N 0.00 3.73 -4.83 2.46 4.77 -1.23 -4.58 117.00 117.32 3bmo n LEU 208 Ca 0.00 0.95 -0.31 0.00 -0.03 0.00 0.00 56.01 56.62 3bmo n LEU 208 Cb 0.00 -1.43 0.05 0.00 -2.33 0.00 0.00 43.42 39.71 3bmo n LEU 208 CO 0.00 0.05 0.71 -0.76 -1.33 0.00 0.00 177.39 176.06 3bmo s LEU 209 N 4.24 3.08 0.25 2.23 1.43 -1.26 -4.94 118.68 123.72 3bmo s LEU 209 Ca 0.91 1.52 -0.31 0.00 -1.03 0.00 0.00 54.13 55.23 3bmo s LEU 209 Cb -0.59 -4.40 -0.13 0.00 0.03 0.00 0.00 46.19 41.10 3bmo s LEU 209 CO 0.48 -1.39 1.54 -2.65 0.23 0.00 0.00 176.35 174.56 3bmo n PRO 210 N -3.09 2.42 -0.23 1.29 -0.02 -1.26 -4.87 135.00 129.25 3bmo n PRO 210 Ca 0.07 0.86 0.11 0.00 -2.02 0.00 0.00 63.50 62.52 3bmo n PRO 210 Cb 0.54 -2.60 0.39 0.00 -0.02 0.00 0.00 33.50 31.81 3bmo n PRO 210 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 3bmo h VAL 211 N 3.31 0.89 0.00 -1.45 -1.51 -2.04 -1.41 116.25 114.04 3bmo h VAL 211 Ca -0.46 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 3bmo h VAL 211 Cb 1.24 0.16 0.00 0.00 -2.13 0.00 0.00 31.29 30.56 3bmo h VAL 211 CO 0.81 0.12 0.00 0.00 -1.23 0.00 0.00 177.57 177.27 3bmo h ALA 212 N 1.61 1.00 -2.81 5.19 0.00 -2.04 -3.46 119.26 118.75 3bmo h ALA 212 Ca 0.39 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.78 3bmo h ALA 212 Cb 0.60 0.00 0.07 0.00 0.00 0.00 0.00 17.79 18.46 3bmo h ALA 212 CO -0.16 0.00 0.76 1.41 0.00 0.00 0.00 179.25 181.27 3bmo s MET 213 N -3.27 4.23 0.50 0.00 0.00 -0.53 -4.96 119.30 115.26 3bmo s MET 213 Ca 0.07 2.38 -0.21 0.00 0.00 0.00 0.00 55.69 57.93 3bmo s MET 213 Cb 0.08 -3.06 -0.07 0.00 0.00 0.00 0.00 34.83 31.78 3bmo s MET 213 CO 0.59 -0.43 1.11 0.20 0.00 0.00 0.00 175.02 176.49 3bmo s GLY 214 N 0.15 2.66 0.36 2.11 0.00 -1.26 -4.84 107.32 106.49 3bmo s GLY 214 Ca 0.57 0.80 0.06 0.00 0.00 0.00 0.00 44.72 46.16 3bmo s GLY 214 CO 0.49 1.18 1.93 -2.09 0.00 0.00 0.00 173.10 174.62 3bmo h GLU 215 N 1.60 0.73 -0.19 2.90 4.57 -1.98 0.05 114.58 122.26 3bmo h GLU 215 Ca -0.50 -0.04 -0.16 0.00 -1.18 0.00 0.00 59.36 57.48 3bmo h GLU 215 Cb 1.25 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.67 3bmo h GLU 215 CO 0.59 0.48 -0.54 1.49 -1.18 0.00 0.00 179.01 179.85 3bmo h GLU 216 N 0.75 0.58 -0.58 1.92 4.57 -1.99 -1.58 114.58 118.25 3bmo h GLU 216 Ca 0.35 -0.36 -0.09 0.00 -1.18 0.00 0.00 59.36 58.08 3bmo h GLU 216 Cb 0.38 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 3bmo h GLU 216 CO -0.13 0.97 -0.01 1.49 -1.18 0.00 0.00 179.01 180.15 3bmo h GLU 217 N 0.44 1.03 -0.47 1.92 4.81 -1.69 -1.37 114.58 119.25 3bmo h GLU 217 Ca 0.01 -0.33 0.06 0.00 -0.13 0.00 0.00 59.36 58.96 3bmo h GLU 217 Cb 1.09 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 30.33 3bmo h GLU 217 CO 0.10 1.02 0.19 0.87 -0.73 0.00 0.00 179.01 180.46 3bmo h LYS 218 N 0.92 0.37 -0.40 1.92 1.57 -0.82 -2.42 116.57 117.70 3bmo h LYS 218 Ca 0.16 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.86 3bmo h LYS 218 Cb 0.56 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 3bmo h LYS 218 CO 0.03 0.24 -0.02 -0.44 -0.57 0.00 0.00 179.45 178.70 3bmo h ASP 219 N 0.38 0.62 -0.56 0.86 3.32 -1.00 -0.87 116.42 119.17 3bmo h ASP 219 Ca 0.22 -0.14 0.05 0.00 0.02 0.00 0.00 57.03 57.18 3bmo h ASP 219 Cb 0.19 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.53 3bmo h ASP 219 CO -0.20 0.70 0.29 0.11 -1.72 0.00 0.00 179.24 178.42 3bmo h LYS 220 N 0.61 0.54 -0.15 3.56 1.57 -0.80 -1.07 116.57 120.83 3bmo h LYS 220 Ca 0.12 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 3bmo h LYS 220 Cb 0.41 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3bmo h LYS 220 CO 0.02 0.35 0.01 -1.49 -0.57 0.00 0.00 179.45 177.77 3bmo h TRP 221 N 0.55 0.28 -0.77 -1.35 4.06 -1.07 -3.04 115.95 114.61 3bmo h TRP 221 Ca 0.25 -0.04 0.13 0.00 2.06 0.00 0.00 58.89 61.28 3bmo h TRP 221 Cb 0.15 -0.07 -0.09 0.00 -1.00 0.00 0.00 29.16 28.15 3bmo h TRP 221 CO -0.10 0.46 0.36 0.00 -3.56 0.00 0.00 178.44 175.61 3bmo h ARG 222 N 0.01 0.54 -0.01 0.49 3.08 -0.93 -1.65 114.38 115.90 3bmo h ARG 222 Ca 0.04 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3bmo h ARG 222 Cb 0.35 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 3bmo h ARG 222 CO 0.01 0.36 0.01 0.00 -1.07 0.00 0.00 179.97 179.28 3bmo h ARG 223 N 0.55 0.00 0.00 0.04 3.08 -1.09 -2.24 114.38 114.72 3bmo h ARG 223 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.45 3bmo h ARG 223 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 3bmo h ARG 223 CO -0.34 0.00 0.00 0.87 -1.07 0.00 0.00 179.97 179.43 3bmo h LYS 224 N 0.00 0.00 -6.05 0.04 1.57 -1.24 -3.46 116.57 107.44 3bmo h LYS 224 Ca 0.01 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.20 3bmo h LYS 224 Cb 0.04 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.26 3bmo h LYS 224 CO -0.00 0.00 0.61 0.08 -0.57 0.00 0.00 179.45 179.57 3bmo s VAL 225 N -3.34 4.63 0.25 0.50 1.01 -0.85 -4.81 120.40 117.79 3bmo s VAL 225 Ca 0.06 1.36 -0.05 0.00 0.00 0.00 0.00 61.98 63.35 3bmo s VAL 225 Cb 0.08 -4.30 0.25 0.00 0.00 0.00 0.00 36.38 32.41 3bmo s VAL 225 CO 0.60 -0.42 1.90 -0.65 0.00 0.00 0.00 175.10 176.53 3bmo h PRO 226 N 8.23 1.20 -5.11 2.72 0.11 -1.82 -1.65 132.00 135.69 3bmo h PRO 226 Ca -0.23 -0.07 -0.69 0.00 0.11 0.00 0.00 66.00 65.12 3bmo h PRO 226 Cb 1.08 -0.27 -0.16 0.00 0.11 0.00 0.00 31.00 31.75 3bmo h PRO 226 CO 0.97 0.79 1.12 -1.17 -0.21 0.00 0.00 178.00 179.50 3bmo s LEU 227 N -10.15 4.83 0.00 2.35 2.96 -0.40 -4.27 118.68 114.00 3bmo s LEU 227 Ca -0.13 -2.27 0.00 0.00 -0.22 0.00 0.00 54.13 51.51 3bmo s LEU 227 Cb 0.18 -2.43 0.00 0.00 0.50 0.00 0.00 46.19 44.45 3bmo s LEU 227 CO 0.81 -1.03 0.00 0.61 -1.32 0.00 0.00 176.35 175.42 3bmo n GLY 228 N 5.25 0.91 3.98 7.98 0.00 -1.26 -4.44 105.19 117.62 3bmo n GLY 228 Ca 0.30 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.02 3bmo n GLY 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bmo n ARG 229 N -2.00 -4.16 -3.86 1.61 5.12 -0.62 -4.95 116.66 107.80 3bmo n ARG 229 Ca 0.00 0.48 -0.09 0.00 -1.93 0.00 0.00 57.85 56.31 3bmo n ARG 229 Cb 0.00 -5.07 -0.07 0.00 -1.16 0.00 0.00 32.46 26.17 3bmo n ARG 229 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 3bmo s ARG 230 N -6.60 1.02 0.62 5.56 1.70 -1.20 -4.39 118.95 115.66 3bmo s ARG 230 Ca 0.41 -1.00 -0.13 0.00 -0.47 0.00 0.00 55.73 54.54 3bmo s ARG 230 Cb -0.21 0.38 -0.03 0.00 -0.57 0.00 0.00 34.95 34.52 3bmo s ARG 230 CO 0.87 -0.36 1.04 -1.83 -1.08 0.00 0.00 175.30 173.94 3bmo s GLU 231 N -3.89 3.39 0.33 3.89 1.03 -1.26 -4.86 118.70 117.33 3bmo s GLU 231 Ca 0.10 0.96 -0.28 0.00 0.03 0.00 0.00 54.97 55.77 3bmo s GLU 231 Cb 0.04 -2.05 -0.10 0.00 -0.80 0.00 0.00 34.13 31.21 3bmo s GLU 231 CO -0.07 -0.73 1.26 0.00 -1.33 0.00 0.00 175.26 174.40 3bmo s ALA 232 N -2.86 3.45 0.64 -0.84 0.00 -0.06 -4.94 121.76 117.15 3bmo s ALA 232 Ca 0.59 1.18 -0.15 0.00 0.00 0.00 0.00 51.96 53.58 3bmo s ALA 232 Cb -0.13 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 3bmo s ALA 232 CO 0.46 -0.57 1.11 -1.54 0.00 0.00 0.00 175.76 175.22 3bmo s SER 233 N -0.60 5.23 0.41 0.00 1.04 -1.26 -3.51 113.70 115.01 3bmo s SER 233 Ca 0.49 2.00 0.12 0.00 0.48 0.00 0.00 55.95 59.04 3bmo s SER 233 Cb -0.38 -2.55 0.95 0.00 0.10 0.00 0.00 66.02 64.14 3bmo s SER 233 CO 0.50 -1.54 1.97 0.00 0.98 0.00 0.00 173.24 175.15 3bmo h ALA 234 N 0.19 1.92 -0.30 5.32 0.00 -1.95 -1.99 119.26 122.45 3bmo h ALA 234 Ca -0.47 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 3bmo h ALA 234 Cb 1.25 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 3bmo h ALA 234 CO 0.55 -0.05 -0.16 0.93 0.00 0.00 0.00 179.25 180.51 3bmo h GLU 235 N 0.50 0.53 -0.51 0.00 3.07 -1.92 -0.42 114.58 115.83 3bmo h GLU 235 Ca 0.29 -0.17 -0.11 0.00 -0.50 0.00 0.00 59.36 58.87 3bmo h GLU 235 Cb 0.46 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 3bmo h GLU 235 CO -0.09 0.67 -0.12 1.96 -1.40 0.00 0.00 179.01 180.03 3bmo h GLN 236 N 0.48 0.97 -0.20 2.33 4.20 -1.74 0.87 115.11 122.02 3bmo h GLN 236 Ca 0.08 -0.36 -0.00 0.00 0.06 0.00 0.00 58.65 58.43 3bmo h GLN 236 Cb 0.55 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3bmo h GLN 236 CO 0.04 1.03 0.12 0.82 -0.67 0.00 0.00 178.83 180.16 3bmo h ILE 237 N 0.86 1.10 -0.77 2.54 1.08 -1.23 -2.96 117.51 118.13 3bmo h ILE 237 Ca 0.13 -0.25 0.06 0.00 -0.39 0.00 0.00 64.86 64.41 3bmo h ILE 237 Cb 0.68 0.90 -0.05 0.00 -3.07 0.00 0.00 36.82 35.28 3bmo h ILE 237 CO 0.05 0.09 0.50 0.00 -0.69 0.00 0.00 178.15 178.10 3bmo h ALA 238 N 1.01 1.62 -1.00 1.87 0.00 -0.75 -1.73 119.26 120.29 3bmo h ALA 238 Ca 0.07 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.06 3bmo h ALA 238 Cb 0.05 -0.23 -0.08 0.00 0.00 0.00 0.00 17.79 17.53 3bmo h ALA 238 CO -0.01 0.27 0.64 -0.44 0.00 0.00 0.00 179.25 179.70 3bmo h ASP 239 N 0.86 0.96 0.02 0.00 3.32 -0.66 0.42 116.42 121.33 3bmo h ASP 239 Ca 0.32 0.04 -0.17 0.00 0.02 0.00 0.00 57.03 57.24 3bmo h ASP 239 Cb 0.19 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 3bmo h ASP 239 CO -0.11 0.54 -0.57 0.00 -1.72 0.00 0.00 179.24 177.38 3bmo h ALA 240 N 1.52 0.66 -0.11 3.45 0.00 -1.31 -1.82 119.26 121.64 3bmo h ALA 240 Ca 0.48 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3bmo h ALA 240 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3bmo h ALA 240 CO -0.24 0.69 0.06 0.28 0.00 0.00 0.00 179.25 180.05 3bmo h VAL 241 N 0.44 1.09 -0.59 0.00 2.07 -1.16 -1.84 116.25 116.25 3bmo h VAL 241 Ca 0.00 -0.25 0.10 0.00 0.82 0.00 0.00 66.70 67.37 3bmo h VAL 241 Cb 1.13 1.05 -0.08 0.00 -1.52 0.00 0.00 31.29 31.87 3bmo h VAL 241 CO 0.11 0.08 0.17 0.40 0.02 0.00 0.00 177.57 178.35 3bmo h ILE 242 N 0.09 0.71 -0.08 4.57 1.08 -0.80 -1.58 117.51 121.50 3bmo h ILE 242 Ca 0.04 -0.11 0.02 0.00 -0.39 0.00 0.00 64.86 64.42 3bmo h ILE 242 Cb 0.08 0.35 -0.02 0.00 -3.07 0.00 0.00 36.82 34.16 3bmo h ILE 242 CO -0.01 0.06 -0.07 0.15 -0.69 0.00 0.00 178.15 177.60 3bmo h PHE 243 N 0.33 -0.16 -0.07 1.37 3.57 -1.17 -2.25 116.94 118.56 3bmo h PHE 243 Ca 0.31 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.79 3bmo h PHE 243 Cb 0.42 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 3bmo h PHE 243 CO -0.21 -0.10 -0.08 -0.07 -2.23 0.00 0.00 178.31 175.62 3bmo h LEU 244 N -0.08 0.10 0.00 0.59 3.38 -0.65 -1.92 115.31 116.73 3bmo h LEU 244 Ca 0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3bmo h LEU 244 Cb 0.16 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3bmo h LEU 244 CO -0.13 0.20 -0.38 1.33 0.09 0.00 0.00 178.44 179.55 3bmo n VAL 245 N -4.38 0.36 -1.65 1.22 0.24 -0.66 -4.74 118.33 108.72 3bmo n VAL 245 Ca -0.02 -0.23 -0.29 0.00 -2.04 0.00 0.00 64.34 61.77 3bmo n VAL 245 Cb 0.19 -0.25 0.12 0.00 -1.47 0.00 0.00 33.84 32.43 3bmo n VAL 245 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3bmo s SER 246 N -4.10 3.77 0.60 -1.34 1.04 -0.72 -4.95 113.70 108.00 3bmo s SER 246 Ca 0.09 0.89 0.38 0.00 0.48 0.00 0.00 55.95 57.79 3bmo s SER 246 Cb 0.14 -1.43 1.81 0.00 0.10 0.00 0.00 66.02 66.64 3bmo s SER 246 CO 0.67 -2.38 2.15 1.23 0.98 0.00 0.00 173.24 175.89 3bmo h GLY 247 N -1.38 0.00 1.32 7.32 0.00 -1.91 -2.27 103.07 106.15 3bmo h GLY 247 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 3bmo h GLY 247 CO 0.62 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.60 3bmo n SER 248 N -3.12 0.00 -0.31 0.19 7.64 -1.26 -2.93 113.62 113.82 3bmo n SER 248 Ca -0.01 -0.35 0.07 0.00 1.01 0.00 0.00 58.87 59.59 3bmo n SER 248 Cb 0.21 -0.16 0.13 0.00 -1.01 0.00 0.00 64.21 63.37 3bmo n SER 248 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3bmo n ALA 249 N -1.16 2.52 0.29 -0.43 0.00 -0.85 -4.87 120.51 116.01 3bmo n ALA 249 Ca 0.14 -2.52 0.18 0.00 0.00 0.00 0.00 53.44 51.24 3bmo n ALA 249 Cb 0.14 -0.41 0.87 0.00 0.00 0.00 0.00 19.45 20.05 3bmo n ALA 249 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3bmo h GLN 250 N 0.25 0.00 -0.03 0.00 1.08 -1.64 -1.03 115.11 113.74 3bmo h GLN 250 Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 3bmo h GLN 250 Cb 1.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.53 3bmo h GLN 250 CO 0.00 0.00 0.00 0.98 -0.95 0.00 0.00 178.83 178.86 3bmo n TYR 251 N -2.78 0.01 -3.22 2.96 9.36 -1.26 -4.94 117.16 117.29 3bmo n TYR 251 Ca -0.01 -0.01 -0.41 0.00 3.32 0.00 0.00 57.90 60.80 3bmo n TYR 251 Cb 0.13 -0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 38.76 3bmo n TYR 251 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 3bmo s ILE 252 N -1.78 5.03 -0.08 2.97 1.01 -0.39 -5.04 121.20 122.92 3bmo s ILE 252 Ca 0.25 0.70 -0.14 0.00 0.00 0.00 0.00 60.65 61.47 3bmo s ILE 252 Cb 0.18 -3.90 0.03 0.00 0.01 0.00 0.00 42.46 38.78 3bmo s ILE 252 CO 0.27 -0.05 0.34 0.28 0.00 0.00 0.00 174.94 175.77 3bmo s THR 253 N 2.40 0.03 -0.03 2.92 -1.32 -1.26 -4.65 115.64 113.72 3bmo s THR 253 Ca 0.21 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 3bmo s THR 253 Cb -0.15 -0.56 0.00 0.00 -1.51 0.00 0.00 72.50 70.28 3bmo s THR 253 CO 0.11 -0.12 0.00 0.61 -2.21 0.00 0.00 174.62 173.01 3bmo n GLY 254 N 2.14 0.47 3.78 6.08 0.00 0.12 -4.95 105.19 112.83 3bmo n GLY 254 Ca -0.17 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.22 3bmo n GLY 254 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3bmo s SER 255 N -2.26 5.78 -0.23 1.61 1.04 -1.26 -4.83 113.70 113.55 3bmo s SER 255 Ca 0.00 0.27 -0.00 0.00 0.48 0.00 0.00 55.95 56.70 3bmo s SER 255 Cb 0.00 -1.74 0.03 0.00 0.10 0.00 0.00 66.02 64.41 3bmo s SER 255 CO 0.00 0.37 -0.11 -0.63 0.98 0.00 0.00 173.24 173.85 3bmo s ILE 256 N -1.01 2.54 -0.40 -1.02 1.01 -1.26 -0.52 121.20 120.54 3bmo s ILE 256 Ca 0.16 -1.05 -0.20 0.00 0.00 0.00 0.00 60.65 59.56 3bmo s ILE 256 Cb -0.12 -2.24 0.01 0.00 0.01 0.00 0.00 42.46 40.12 3bmo s ILE 256 CO 0.06 0.29 0.62 -0.63 0.00 0.00 0.00 174.94 175.27 3bmo s ILE 257 N 1.29 4.88 0.21 2.92 1.01 -0.26 -4.91 121.20 126.35 3bmo s ILE 257 Ca 0.01 0.25 -0.30 0.00 0.00 0.00 0.00 60.65 60.60 3bmo s ILE 257 Cb -0.16 -4.13 -0.09 0.00 0.01 0.00 0.00 42.46 38.09 3bmo s ILE 257 CO -0.07 -0.47 1.34 -0.54 0.00 0.00 0.00 174.94 175.20 3bmo s LYS 258 N 2.71 4.36 -0.53 2.79 1.02 -1.26 -0.73 119.74 128.10 3bmo s LYS 258 Ca 0.22 2.11 0.05 0.00 0.02 0.00 0.00 55.97 58.37 3bmo s LYS 258 Cb -0.14 -3.17 0.19 0.00 -0.52 0.00 0.00 37.83 34.18 3bmo s LYS 258 CO 0.17 -0.28 0.45 0.28 -0.92 0.00 0.00 175.35 175.05 3bmo n VAL 259 N 2.50 0.13 -0.71 3.17 0.31 -0.10 -4.88 118.33 118.75 3bmo n VAL 259 Ca 0.06 -4.15 0.00 0.00 -0.01 0.00 0.00 64.34 60.24 3bmo n VAL 259 Cb 0.42 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 31.44 3bmo n VAL 259 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3bmo n ASP 260 N 2.17 0.44 -1.15 4.52 5.75 -1.26 -2.96 116.55 124.05 3bmo n ASP 260 Ca 0.26 -1.15 -0.15 0.00 -0.01 0.00 0.00 54.79 53.73 3bmo n ASP 260 Cb 0.44 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.46 3bmo n ASP 260 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3bmo n GLY 261 N -0.08 1.51 1.55 6.12 0.00 -1.26 -1.35 105.19 111.68 3bmo n GLY 261 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3bmo n GLY 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bmo n GLY 262 N -0.80 0.69 0.34 -0.02 0.00 -1.26 -1.27 105.19 102.88 3bmo n GLY 262 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 3bmo n GLY 262 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3bmo h LEU 263 N 0.00 0.97 -0.70 0.99 5.85 -1.53 -1.34 115.31 119.56 3bmo h LEU 263 Ca 0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3bmo h LEU 263 Cb 0.00 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.81 3bmo h LEU 263 CO 0.00 0.66 0.00 -1.54 -0.34 0.00 0.00 178.44 177.22 3bmo n SER 264 N -4.52 0.68 0.01 1.25 3.41 -1.26 -1.98 113.62 111.22 3bmo n SER 264 Ca 0.12 0.67 0.13 0.00 -0.26 0.00 0.00 58.87 59.53 3bmo n SER 264 Cb 0.10 -0.81 0.50 0.00 -0.26 0.00 0.00 64.21 63.74 3bmo n SER 264 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3bmo n LEU 265 N -2.25 0.22 -4.61 1.04 4.77 -0.50 -4.87 117.00 110.80 3bmo n LEU 265 Ca 0.02 0.39 -0.41 0.00 -0.03 0.00 0.00 56.01 55.98 3bmo n LEU 265 Cb 0.23 -0.42 -0.06 0.00 -2.33 0.00 0.00 43.42 40.85 3bmo n LEU 265 CO 0.20 0.01 0.49 -0.69 -1.33 0.00 0.00 177.39 176.07 3bmo s VAL 266 N -3.02 4.87 0.83 4.08 1.01 -0.84 -5.05 120.40 122.29 3bmo s VAL 266 Ca 0.13 1.05 -0.11 0.00 0.00 0.00 0.00 61.98 63.05 3bmo s VAL 266 Cb 0.18 -4.07 0.09 0.00 0.00 0.00 0.00 36.38 32.58 3bmo s VAL 266 CO 0.58 -0.18 1.10 -1.38 0.00 0.00 0.00 175.10 175.22 3bmo s HIS 267 N 2.77 2.34 -1.41 5.22 -3.43 -1.26 -5.09 115.29 114.43 3bmo s HIS 267 Ca 0.29 1.51 0.00 0.00 -0.80 0.00 0.00 55.06 56.06 3bmo s HIS 267 Cb -0.15 -3.12 0.00 0.00 -1.43 0.00 0.00 32.58 27.88 3bmo s HIS 267 CO 0.12 -2.15 0.35 0.00 -2.00 0.00 0.00 174.74 171.06