#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dfp s HIS 2 N 0.00 2.13 0.03 6.00 3.76 -1.26 -5.13 115.29 120.82 3dfp s HIS 2 Ca 0.00 -0.57 -0.26 0.00 -0.15 0.00 0.00 55.06 54.09 3dfp s HIS 2 Cb 0.00 -1.40 -0.05 0.00 1.11 0.00 0.00 32.58 32.24 3dfp s HIS 2 CO 0.00 -0.15 0.79 0.45 -0.85 0.00 0.00 174.74 174.98 3dfp s SER 3 N -0.21 7.21 -0.52 1.40 0.15 -1.26 -5.00 113.70 115.47 3dfp s SER 3 Ca -0.00 1.45 0.06 0.00 0.70 0.00 0.00 55.95 58.16 3dfp s SER 3 Cb -0.12 -2.48 0.22 0.00 -1.71 0.00 0.00 66.02 61.93 3dfp s SER 3 CO 0.02 -0.04 0.54 1.41 1.20 0.00 0.00 173.24 176.37 3dfp n HIS 4 N 3.10 1.25 -0.09 3.44 8.25 -1.26 -5.08 115.22 124.83 3dfp n HIS 4 Ca -0.01 -3.80 -0.04 0.00 -0.26 0.00 0.00 57.72 53.61 3dfp n HIS 4 Cb 0.50 -0.32 -0.01 0.00 1.12 0.00 0.00 29.99 31.28 3dfp n HIS 4 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3dfp n PRO 5 N 1.65 0.00 0.12 -0.41 -0.02 -1.26 -4.81 135.00 130.27 3dfp n PRO 5 Ca 0.25 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.73 3dfp n PRO 5 Cb 0.45 -0.11 0.07 0.00 -0.02 0.00 0.00 33.50 33.90 3dfp n PRO 5 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dfp h ALA 6 N 0.68 0.69 -3.46 3.55 0.00 -1.98 -3.45 119.26 115.30 3dfp h ALA 6 Ca -0.01 -0.60 -0.34 0.00 0.00 0.00 0.00 54.91 53.96 3dfp h ALA 6 Cb 0.10 -0.11 -0.23 0.00 0.00 0.00 0.00 17.79 17.56 3dfp h ALA 6 CO 0.08 0.83 -0.76 -0.51 0.00 0.00 0.00 179.25 178.89 3dfp s LEU 7 N -6.89 2.20 0.57 0.00 1.43 -1.26 -4.97 118.68 109.76 3dfp s LEU 7 Ca 0.01 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.61 3dfp s LEU 7 Cb 0.10 -0.33 0.02 0.00 0.03 0.00 0.00 46.19 46.00 3dfp s LEU 7 CO 0.76 -0.09 0.85 0.42 0.23 0.00 0.00 176.35 178.52 3dfp s THR 8 N -1.04 3.40 0.28 5.49 -4.23 -1.26 -4.91 115.64 113.37 3dfp s THR 8 Ca -0.04 -0.25 -0.01 0.00 -1.18 0.00 0.00 61.69 60.21 3dfp s THR 8 Cb -0.08 -3.33 0.28 0.00 1.34 0.00 0.00 72.50 70.70 3dfp s THR 8 CO 0.01 -0.30 1.89 -0.65 -0.54 0.00 0.00 174.62 175.02 3dfp h PRO 9 N -0.07 1.08 -0.25 3.99 0.11 -2.01 -1.74 132.00 133.10 3dfp h PRO 9 Ca -0.45 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 3dfp h PRO 9 Cb 1.27 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 3dfp h PRO 9 CO 0.59 0.71 0.11 0.93 -0.21 0.00 0.00 178.00 180.13 3dfp h GLU 10 N 1.11 0.36 -0.82 1.05 3.07 -2.00 -1.93 114.58 115.43 3dfp h GLU 10 Ca 0.43 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 59.22 3dfp h GLU 10 Cb 0.21 -0.06 -0.04 0.00 -0.84 0.00 0.00 28.75 28.02 3dfp h GLU 10 CO -0.17 0.38 0.46 1.96 -1.40 0.00 0.00 179.01 180.23 3dfp h GLN 11 N 0.26 1.13 -0.33 2.33 4.20 -1.82 -2.12 115.11 118.75 3dfp h GLN 11 Ca 0.08 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 3dfp h GLN 11 Cb 0.14 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 3dfp h GLN 11 CO -0.01 0.82 0.07 0.87 -0.67 0.00 0.00 178.83 179.91 3dfp h LYS 12 N 1.14 0.53 -0.58 1.46 1.57 -1.18 -2.32 116.57 117.19 3dfp h LYS 12 Ca 0.29 -0.13 0.06 0.00 -1.87 0.00 0.00 60.65 59.00 3dfp h LYS 12 Cb 0.01 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.20 3dfp h LYS 12 CO -0.05 0.60 0.28 -0.22 -0.57 0.00 0.00 179.45 179.50 3dfp h LYS 13 N 0.38 0.51 0.22 3.15 3.64 -0.99 0.55 116.57 124.02 3dfp h LYS 13 Ca 0.10 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3dfp h LYS 13 Cb 0.31 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3dfp h LYS 13 CO 0.00 0.34 -0.16 1.49 -2.27 0.00 0.00 179.45 178.85 3dfp h GLU 14 N 0.53 -0.37 -0.55 1.90 4.81 -1.21 -0.06 114.58 119.63 3dfp h GLU 14 Ca 0.27 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.51 3dfp h GLU 14 Cb 0.23 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 3dfp h GLU 14 CO -0.21 -0.24 0.27 -0.07 -0.73 0.00 0.00 179.01 178.02 3dfp h LEU 15 N -0.38 0.72 -0.62 1.64 3.38 -1.08 -1.59 115.31 117.37 3dfp h LEU 15 Ca -0.01 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 3dfp h LEU 15 Cb 0.33 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 3dfp h LEU 15 CO -0.00 0.64 0.27 -1.28 0.09 0.00 0.00 178.44 178.16 3dfp h SER 16 N 0.74 0.84 -0.56 -0.43 0.87 -0.77 -0.96 113.55 113.27 3dfp h SER 16 Ca 0.19 -0.16 -0.04 0.00 -1.23 0.00 0.00 61.79 60.56 3dfp h SER 16 Cb 0.11 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.83 3dfp h SER 16 CO -0.02 0.77 0.21 0.44 -0.53 0.00 0.00 176.83 177.69 3dfp h ASP 17 N 0.86 0.79 -0.28 6.23 3.32 -0.78 -1.62 116.42 124.94 3dfp h ASP 17 Ca 0.21 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3dfp h ASP 17 Cb 0.17 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 3dfp h ASP 17 CO -0.02 0.76 0.12 0.40 -1.72 0.00 0.00 179.24 178.78 3dfp h ILE 18 N 0.78 1.17 -0.43 0.35 2.04 -1.08 -2.01 117.51 118.33 3dfp h ILE 18 Ca 0.19 -0.51 0.04 0.00 1.00 0.00 0.00 64.86 65.58 3dfp h ILE 18 Cb 0.23 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 3dfp h ILE 18 CO -0.01 0.18 0.19 0.00 0.00 0.00 0.00 178.15 178.50 3dfp h ALA 19 N 0.97 0.52 -0.42 1.87 0.00 -0.99 -2.40 119.26 118.81 3dfp h ALA 19 Ca 0.10 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3dfp h ALA 19 Cb 0.16 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3dfp h ALA 19 CO -0.01 -0.18 -0.02 0.45 0.00 0.00 0.00 179.25 179.49 3dfp h HIS 20 N 0.38 0.72 -0.67 0.00 3.86 -1.18 -3.02 115.15 115.23 3dfp h HIS 20 Ca 0.19 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 3dfp h HIS 20 Cb 0.13 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.37 3dfp h HIS 20 CO -0.12 0.69 0.30 0.00 0.86 0.00 0.00 177.93 179.66 3dfp h ARG 21 N 0.64 0.99 -0.85 2.45 3.08 -0.88 -2.35 114.38 117.46 3dfp h ARG 21 Ca 0.13 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3dfp h ARG 21 Cb 0.43 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 30.27 3dfp h ARG 21 CO 0.02 0.80 0.49 0.82 -1.07 0.00 0.00 179.97 181.03 3dfp h ILE 22 N 0.94 1.24 -0.66 2.04 2.04 -1.34 -3.07 117.51 118.70 3dfp h ILE 22 Ca 0.23 -0.56 -0.28 0.00 1.00 0.00 0.00 64.86 65.25 3dfp h ILE 22 Cb 0.16 0.08 -0.17 0.00 -0.74 0.00 0.00 36.82 36.16 3dfp h ILE 22 CO -0.02 0.26 0.27 1.33 0.00 0.00 0.00 178.15 179.98 3dfp n VAL 23 N -4.41 2.85 -1.21 1.67 0.24 -1.16 -4.29 118.33 112.03 3dfp n VAL 23 Ca 0.09 -2.06 -0.35 0.00 -2.04 0.00 0.00 64.34 59.97 3dfp n VAL 23 Cb 0.07 -0.37 0.10 0.00 -1.47 0.00 0.00 33.84 32.17 3dfp n VAL 23 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dfp n ALA 24 N -0.77 -0.79 -1.64 2.33 0.00 -0.89 -4.74 120.51 114.00 3dfp n ALA 24 Ca 0.43 -0.28 -0.56 0.00 0.00 0.00 0.00 53.44 53.02 3dfp n ALA 24 Cb 1.33 -2.04 -0.07 0.00 0.00 0.00 0.00 19.45 18.67 3dfp n ALA 24 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3dfp n PRO 25 N -1.89 1.00 -0.58 0.00 -0.02 -1.26 -0.79 135.00 131.46 3dfp n PRO 25 Ca 0.12 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 3dfp n PRO 25 Cb 0.50 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 3dfp n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dfp n GLY 26 N 3.24 1.26 3.76 -1.23 0.00 -1.26 -5.04 105.19 105.91 3dfp n GLY 26 Ca 0.23 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 3dfp n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dfp s LYS 27 N -0.23 2.75 0.00 1.61 1.02 0.03 -4.47 119.74 120.44 3dfp s LYS 27 Ca 0.00 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.04 3dfp s LYS 27 Cb 0.00 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.76 3dfp s LYS 27 CO 0.00 0.47 0.00 0.41 -0.92 0.00 0.00 175.35 175.31 3dfp n GLY 28 N -0.29 4.10 3.26 -3.33 0.00 -0.24 -4.65 105.19 104.04 3dfp n GLY 28 Ca -0.09 -1.45 -0.28 0.00 0.00 0.00 0.00 46.02 44.20 3dfp n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dfp s ILE 29 N -1.87 1.82 -0.30 -0.61 1.01 0.11 -0.09 121.20 121.27 3dfp s ILE 29 Ca 0.00 -1.04 -0.09 0.00 0.00 0.00 0.00 60.65 59.51 3dfp s ILE 29 Cb 0.00 -1.52 -0.01 0.00 0.01 0.00 0.00 42.46 40.94 3dfp s ILE 29 CO 0.00 0.46 0.14 -0.22 0.00 0.00 0.00 174.94 175.31 3dfp s LEU 30 N -0.69 4.04 -0.66 2.97 2.96 -0.74 -2.26 118.68 124.30 3dfp s LEU 30 Ca 0.09 -0.52 -0.20 0.00 -0.22 0.00 0.00 54.13 53.28 3dfp s LEU 30 Cb -0.09 -1.98 0.10 0.00 0.50 0.00 0.00 46.19 44.72 3dfp s LEU 30 CO -0.00 -0.18 0.84 0.00 -1.32 0.00 0.00 176.35 175.68 3dfp s ALA 31 N 1.60 3.34 -0.21 5.97 0.00 0.19 -1.20 121.76 131.44 3dfp s ALA 31 Ca 0.04 -2.20 0.11 0.00 0.00 0.00 0.00 51.96 49.91 3dfp s ALA 31 Cb -0.17 -3.69 0.42 0.00 0.00 0.00 0.00 23.12 19.68 3dfp s ALA 31 CO 0.06 -2.55 1.23 0.00 0.00 0.00 0.00 175.76 174.49 3dfp n ALA 32 N 6.71 3.64 -0.01 0.00 0.00 -0.71 -4.29 120.51 125.86 3dfp n ALA 32 Ca -0.03 -3.27 -0.08 0.00 0.00 0.00 0.00 53.44 50.06 3dfp n ALA 32 Cb 0.44 -0.37 0.11 0.00 0.00 0.00 0.00 19.45 19.63 3dfp n ALA 32 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3dfp n ASN 33 N -1.13 3.33 -4.77 0.00 6.94 -0.85 -4.25 115.26 114.52 3dfp n ASN 33 Ca 0.20 -2.68 -0.39 0.00 -0.02 0.00 0.00 54.58 51.69 3dfp n ASN 33 Cb 0.70 -0.64 -0.00 0.00 -2.36 0.00 0.00 39.78 37.48 3dfp n ASN 33 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 3dfp s GLU 34 N -1.62 3.89 0.67 -3.83 8.01 -1.26 -4.43 118.70 120.13 3dfp s GLU 34 Ca 0.27 2.10 -0.03 0.00 0.01 0.00 0.00 54.97 57.31 3dfp s GLU 34 Cb 0.22 -2.68 0.08 0.00 -4.31 0.00 0.00 34.13 27.43 3dfp s GLU 34 CO 0.06 -0.54 0.95 -1.54 0.01 0.00 0.00 175.26 174.20 3dfp s SER 35 N -0.84 4.75 0.33 -0.19 1.04 -1.26 -4.75 113.70 112.78 3dfp s SER 35 Ca 0.59 0.09 0.04 0.00 0.48 0.00 0.00 55.95 57.14 3dfp s SER 35 Cb -0.37 -0.71 0.65 0.00 0.10 0.00 0.00 66.02 65.69 3dfp s SER 35 CO 0.47 -1.58 1.92 0.74 0.98 0.00 0.00 173.24 175.76 3dfp h THR 36 N -0.42 1.01 -0.11 2.02 2.02 -1.97 0.15 112.91 115.61 3dfp h THR 36 Ca -0.42 -0.30 -0.12 0.00 0.77 0.00 0.00 66.41 66.34 3dfp h THR 36 Cb 1.29 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 3dfp h THR 36 CO 0.51 0.16 -0.41 1.23 0.37 0.00 0.00 175.52 177.39 3dfp h GLY 37 N 0.88 0.51 2.00 2.16 0.00 -2.01 -2.56 103.07 104.05 3dfp h GLY 37 Ca 0.37 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 47.02 3dfp h GLY 37 CO -0.14 0.61 0.00 -1.14 0.00 0.00 0.00 176.54 175.87 3dfp n SER 38 N -4.32 0.66 0.04 0.19 3.41 -0.95 -2.94 113.62 109.71 3dfp n SER 38 Ca -0.08 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.23 3dfp n SER 38 Cb 0.54 -0.75 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 3dfp n SER 38 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dfp n ILE 39 N -2.14 0.26 0.01 -1.33 0.13 0.48 -4.49 119.36 112.28 3dfp n ILE 39 Ca 0.05 -0.40 -0.13 0.00 -1.10 0.00 0.00 62.75 61.17 3dfp n ILE 39 Cb 0.36 0.00 -0.07 0.00 -0.84 0.00 0.00 39.64 39.09 3dfp n ILE 39 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3dfp h ALA 40 N 2.25 -0.67 -0.94 1.51 0.00 -1.34 -2.15 119.26 117.93 3dfp h ALA 40 Ca 0.00 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.03 3dfp h ALA 40 Cb 0.88 0.83 -0.09 0.00 0.00 0.00 0.00 17.79 19.40 3dfp h ALA 40 CO 0.00 -0.97 0.56 -0.22 0.00 0.00 0.00 179.25 178.62 3dfp h LYS 41 N -0.53 0.78 -0.48 0.00 3.64 -1.79 -1.33 116.57 116.87 3dfp h LYS 41 Ca 0.06 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 3dfp h LYS 41 Cb 0.65 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.27 3dfp h LYS 41 CO -0.40 0.52 -0.06 0.00 -2.27 0.00 0.00 179.45 177.24 3dfp h ARG 42 N 0.81 0.88 0.00 1.90 3.08 -1.68 -1.11 114.38 118.26 3dfp h ARG 42 Ca 0.50 -0.31 -0.06 0.00 0.07 0.00 0.00 59.98 60.18 3dfp h ARG 42 Cb 0.64 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 3dfp h ARG 42 CO -0.32 0.95 -0.28 -0.07 -1.07 0.00 0.00 179.97 179.18 3dfp h LEU 43 N 0.74 0.00 -0.51 3.04 3.38 -0.98 -2.52 115.31 118.46 3dfp h LEU 43 Ca 0.13 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.95 3dfp h LEU 43 Cb 0.59 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3dfp h LEU 43 CO 0.04 0.28 -0.40 -0.61 0.09 0.00 0.00 178.44 177.84 3dfp h GLN 44 N 0.00 0.78 0.00 1.13 5.75 -0.75 0.13 115.11 122.14 3dfp h GLN 44 Ca -0.00 -0.40 -0.01 0.00 -0.15 0.00 0.00 58.65 58.08 3dfp h GLN 44 Cb 0.71 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.27 3dfp h GLN 44 CO 0.04 1.03 -0.06 0.66 -2.65 0.00 0.00 178.83 177.85 3dfp h SER 45 N 0.63 0.00 -0.20 -0.69 4.64 -0.75 -1.94 113.55 115.24 3dfp h SER 45 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3dfp h SER 45 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 3dfp h SER 45 CO 0.09 0.06 0.00 2.30 -0.87 0.00 0.00 176.83 178.41 3dfp n ILE 46 N -3.75 2.13 -3.56 0.95 -5.35 -1.12 -5.00 119.36 103.65 3dfp n ILE 46 Ca -0.02 -1.94 -0.24 0.00 -0.27 0.00 0.00 62.75 60.28 3dfp n ILE 46 Cb 0.16 -0.22 0.03 0.00 -1.74 0.00 0.00 39.64 37.87 3dfp n ILE 46 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dfp n GLY 47 N -0.70 -1.10 2.95 3.28 0.00 -0.73 -4.68 105.19 104.20 3dfp n GLY 47 Ca 0.19 0.49 -0.20 0.00 0.00 0.00 0.00 46.02 46.51 3dfp n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dfp s THR 48 N -3.29 0.66 0.28 2.61 2.01 0.40 -4.95 115.64 113.35 3dfp s THR 48 Ca 0.31 -0.25 -0.30 0.00 0.31 0.00 0.00 61.69 61.77 3dfp s THR 48 Cb -0.11 -0.62 -0.10 0.00 0.01 0.00 0.00 72.50 71.68 3dfp s THR 48 CO 0.84 0.23 1.48 -0.70 -0.69 0.00 0.00 174.62 175.78 3dfp s GLU 49 N 0.51 4.22 -1.26 4.92 2.12 -1.26 -4.32 118.70 123.63 3dfp s GLU 49 Ca -0.07 2.39 -0.17 0.00 0.36 0.00 0.00 54.97 57.48 3dfp s GLU 49 Cb -0.11 -3.07 0.11 0.00 0.26 0.00 0.00 34.13 31.31 3dfp s GLU 49 CO 0.01 -0.47 1.62 1.21 -0.54 0.00 0.00 175.26 177.09 3dfp s ASN 50 N 0.30 6.92 0.21 -1.70 3.84 -1.26 -4.77 114.94 118.47 3dfp s ASN 50 Ca 0.59 -2.63 0.11 0.00 0.21 0.00 0.00 52.86 51.14 3dfp s ASN 50 Cb -0.44 -2.51 -0.04 0.00 -0.55 0.00 0.00 41.25 37.71 3dfp s ASN 50 CO 0.47 -1.02 -0.18 0.42 -2.79 0.00 0.00 177.10 173.99 3dfp s THR 51 N 3.27 2.66 0.29 -5.21 -4.23 -1.26 -5.03 115.64 106.13 3dfp s THR 51 Ca 0.50 -1.98 0.02 0.00 -1.18 0.00 0.00 61.69 59.05 3dfp s THR 51 Cb 0.01 -2.32 0.29 0.00 1.34 0.00 0.00 72.50 71.83 3dfp s THR 51 CO 0.05 -0.17 1.82 -0.08 -0.54 0.00 0.00 174.62 175.70 3dfp h GLU 52 N 2.91 0.92 -0.18 3.99 4.81 -1.99 -1.04 114.58 124.00 3dfp h GLU 52 Ca -0.45 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3dfp h GLU 52 Cb 1.22 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 3dfp h GLU 52 CO 0.52 0.61 0.09 1.49 -0.73 0.00 0.00 179.01 180.99 3dfp h GLU 53 N 0.95 0.25 -0.68 1.92 4.57 -1.96 0.30 114.58 119.92 3dfp h GLU 53 Ca 0.51 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.63 3dfp h GLU 53 Cb 0.58 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.09 3dfp h GLU 53 CO -0.29 0.27 0.31 -0.91 -1.18 0.00 0.00 179.01 177.21 3dfp h ASN 54 N 0.17 0.88 -0.38 1.04 2.35 -1.66 0.91 115.58 118.89 3dfp h ASN 54 Ca 0.06 -0.10 -0.05 0.00 -0.55 0.00 0.00 56.30 55.66 3dfp h ASN 54 Cb 0.09 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 3dfp h ASN 54 CO -0.01 0.76 0.05 0.03 -1.65 0.00 0.00 177.43 176.61 3dfp h ARG 55 N 0.97 0.64 -0.79 0.81 3.08 -0.86 -0.97 114.38 117.26 3dfp h ARG 55 Ca 0.24 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 3dfp h ARG 55 Cb 0.12 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 3dfp h ARG 55 CO -0.03 0.71 0.47 -0.09 -1.07 0.00 0.00 179.97 179.96 3dfp h ARG 56 N 0.47 1.07 -0.45 0.04 2.43 0.25 -0.92 114.38 117.27 3dfp h ARG 56 Ca 0.11 -0.10 -0.06 0.00 -0.81 0.00 0.00 59.98 59.12 3dfp h ARG 56 Cb 0.39 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 3dfp h ARG 56 CO 0.01 0.76 0.04 0.35 -1.51 0.00 0.00 179.97 179.62 3dfp h PHE 57 N 1.08 0.83 -0.01 2.20 3.57 -0.63 0.36 116.94 124.33 3dfp h PHE 57 Ca 0.28 -0.13 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 3dfp h PHE 57 Cb -0.04 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 38.48 3dfp h PHE 57 CO -0.01 0.79 0.01 -0.92 -2.23 0.00 0.00 178.31 175.95 3dfp h TYR 58 N 0.63 0.02 -0.94 0.41 3.20 -0.87 0.57 116.97 119.99 3dfp h TYR 58 Ca 0.13 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.02 3dfp h TYR 58 Cb 0.43 -0.01 -0.05 0.00 1.54 0.00 0.00 36.73 38.65 3dfp h TYR 58 CO 0.03 0.14 0.62 0.00 -1.64 0.00 0.00 178.16 177.31 3dfp h ARG 59 N -0.11 1.22 -0.82 1.82 -0.00 -1.12 -1.52 114.38 113.86 3dfp h ARG 59 Ca 0.00 -0.07 0.01 0.00 -0.50 0.00 0.00 59.98 59.42 3dfp h ARG 59 Cb 0.13 -0.28 -0.04 0.00 0.00 0.00 0.00 29.97 29.78 3dfp h ARG 59 CO -0.00 0.81 0.54 0.37 0.00 0.00 0.00 179.97 181.69 3dfp h GLN 60 N 1.26 1.08 -0.86 0.04 4.15 -0.55 -0.99 115.11 119.24 3dfp h GLN 60 Ca 0.35 -0.06 0.07 0.00 0.77 0.00 0.00 58.65 59.78 3dfp h GLN 60 Cb -0.13 -0.24 -0.07 0.00 0.21 0.00 0.00 27.48 27.25 3dfp h GLN 60 CO -0.08 0.71 0.52 1.25 -1.93 0.00 0.00 178.83 179.30 3dfp h LEU 61 N 1.11 0.80 0.00 -2.39 6.46 0.12 -1.18 115.31 120.24 3dfp h LEU 61 Ca 0.30 0.03 -0.15 0.00 -0.12 0.00 0.00 57.88 57.94 3dfp h LEU 61 Cb -0.12 -0.14 0.01 0.00 -0.73 0.00 0.00 40.66 39.69 3dfp h LEU 61 CO -0.07 0.49 -0.59 -0.07 -0.62 0.00 0.00 178.44 177.59 3dfp h LEU 62 N 0.93 0.51 -1.28 2.25 3.38 -0.90 -3.30 115.31 116.90 3dfp h LEU 62 Ca 0.39 -0.77 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 3dfp h LEU 62 Cb 0.24 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3dfp h LEU 62 CO -0.20 1.21 -0.04 -0.07 0.09 0.00 0.00 178.44 179.43 3dfp h LEU 63 N -0.14 0.00 -3.28 1.67 3.38 -1.03 -3.13 115.31 112.78 3dfp h LEU 63 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3dfp h LEU 63 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 3dfp h LEU 63 CO 0.12 0.04 0.00 0.35 0.09 0.00 0.00 178.44 179.04 3dfp n THR 64 N -3.15 2.15 -1.17 0.22 -2.24 -0.46 -4.80 114.28 104.84 3dfp n THR 64 Ca 0.01 -1.39 -0.34 0.00 -2.27 0.00 0.00 64.05 60.06 3dfp n THR 64 Cb 0.35 -0.04 0.12 0.00 -2.10 0.00 0.00 70.33 68.65 3dfp n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dfp n ALA 65 N 0.60 -0.08 -0.62 6.98 0.00 -1.19 -4.93 120.51 121.28 3dfp n ALA 65 Ca 0.25 -0.30 -0.30 0.00 0.00 0.00 0.00 53.44 53.08 3dfp n ALA 65 Cb 0.95 -2.22 0.19 0.00 0.00 0.00 0.00 19.45 18.38 3dfp n ALA 65 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3dfp n ASP 66 N -2.88 -0.96 0.00 0.00 5.68 -1.26 -4.83 116.55 112.30 3dfp n ASP 66 Ca 0.13 0.16 0.00 0.00 -0.50 0.00 0.00 54.79 54.58 3dfp n ASP 66 Cb 0.50 -1.32 0.00 0.00 -1.14 0.00 0.00 41.12 39.16 3dfp n ASP 66 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3dfp n ASP 67 N -3.88 0.00 0.25 -1.12 8.00 -1.26 -2.50 116.55 116.05 3dfp n ASP 67 Ca 0.07 0.28 0.11 0.00 0.71 0.00 0.00 54.79 55.97 3dfp n ASP 67 Cb 0.54 -0.28 0.68 0.00 -0.02 0.00 0.00 41.12 42.03 3dfp n ASP 67 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3dfp h ARG 68 N 0.00 0.00 0.00 -1.24 3.08 -2.00 -2.40 114.38 111.82 3dfp h ARG 68 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dfp h ARG 68 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 3dfp h ARG 68 CO 0.00 0.14 -0.08 -0.39 -1.07 0.00 0.00 179.97 178.57 3dfp h VAL 69 N 0.00 0.00 -0.48 2.04 -1.51 -1.82 -3.38 116.25 111.10 3dfp h VAL 69 Ca -0.00 -0.55 0.10 0.00 -1.23 0.00 0.00 66.70 65.02 3dfp h VAL 69 Cb 0.34 1.50 -0.09 0.00 -2.13 0.00 0.00 31.29 30.91 3dfp h VAL 69 CO 0.02 0.00 -0.12 0.78 -1.23 0.00 0.00 177.57 177.02 3dfp h ASN 70 N 0.00 -0.44 0.49 4.19 4.21 -1.65 0.27 115.58 122.65 3dfp h ASN 70 Ca 0.00 0.14 0.00 0.00 1.21 0.00 0.00 56.30 57.65 3dfp h ASN 70 Cb 0.77 0.30 0.00 0.00 -1.12 0.00 0.00 38.32 38.27 3dfp h ASN 70 CO 0.00 -0.16 0.00 -0.81 -1.29 0.00 0.00 177.43 175.17 3dfp n PRO 71 N -5.35 0.33 -0.08 0.81 -0.04 -1.26 -3.50 135.00 125.92 3dfp n PRO 71 Ca 0.04 0.05 -0.13 0.00 -0.04 0.00 0.00 63.50 63.42 3dfp n PRO 71 Cb 0.26 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.07 3dfp n PRO 71 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dfp s ILE 73 N -2.53 4.88 -0.27 0.00 -1.09 -0.26 -1.08 121.20 120.85 3dfp s ILE 73 Ca -0.17 -0.73 0.22 0.00 -2.23 0.00 0.00 60.65 57.74 3dfp s ILE 73 Cb 0.07 -3.70 -0.14 0.00 -1.58 0.00 0.00 42.46 37.11 3dfp s ILE 73 CO 0.76 -0.24 0.86 0.61 -1.23 0.00 0.00 174.94 175.69 3dfp n GLY 74 N 5.07 -1.25 3.33 6.18 0.00 0.87 -4.39 105.19 115.00 3dfp n GLY 74 Ca -0.12 -0.37 -0.11 0.00 0.00 0.00 0.00 46.02 45.42 3dfp n GLY 74 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dfp s GLY 75 N -4.23 -0.31 -0.10 -0.02 0.00 -0.96 -1.64 107.32 100.06 3dfp s GLY 75 Ca -0.02 0.09 -0.03 0.00 0.00 0.00 0.00 44.72 44.76 3dfp s GLY 75 CO 0.83 -0.18 0.14 0.14 0.00 0.00 0.00 173.10 174.04 3dfp s VAL 76 N -3.51 -0.23 -0.18 1.40 1.01 -0.23 -1.79 120.40 116.88 3dfp s VAL 76 Ca 0.01 0.26 -0.19 0.00 0.00 0.00 0.00 61.98 62.06 3dfp s VAL 76 Cb 0.01 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 36.01 3dfp s VAL 76 CO -0.10 0.07 0.54 -0.63 0.00 0.00 0.00 175.10 174.98 3dfp s ILE 77 N 2.26 5.10 0.29 2.22 1.01 -0.34 -0.32 121.20 131.42 3dfp s ILE 77 Ca 0.04 1.01 0.10 0.00 0.00 0.00 0.00 60.65 61.80 3dfp s ILE 77 Cb -0.13 -3.86 -0.05 0.00 0.01 0.00 0.00 42.46 38.43 3dfp s ILE 77 CO -0.06 0.19 -0.03 -0.76 0.00 0.00 0.00 174.94 174.28 3dfp s LEU 78 N 1.50 3.04 0.33 2.97 1.43 -0.42 -1.73 118.68 125.79 3dfp s LEU 78 Ca 0.26 -0.81 -0.04 0.00 -1.03 0.00 0.00 54.13 52.50 3dfp s LEU 78 Cb -0.16 -1.51 -0.05 0.00 0.03 0.00 0.00 46.19 44.50 3dfp s LEU 78 CO 0.10 -0.07 0.59 0.12 0.23 0.00 0.00 176.35 177.32 3dfp s PHE 79 N -2.41 3.49 0.24 0.29 5.36 -1.26 -2.28 117.98 121.41 3dfp s PHE 79 Ca 0.32 0.62 -0.12 0.00 -0.96 0.00 0.00 56.93 56.79 3dfp s PHE 79 Cb -0.04 -2.10 0.32 0.00 -0.34 0.00 0.00 43.02 40.86 3dfp s PHE 79 CO 0.19 0.10 1.59 1.25 -1.46 0.00 0.00 175.22 176.89 3dfp h HIS 80 N 1.32 -0.50 -0.23 10.12 6.17 -1.92 -1.96 115.15 128.16 3dfp h HIS 80 Ca -0.48 0.07 0.06 0.00 0.71 0.00 0.00 60.37 60.73 3dfp h HIS 80 Cb 1.20 0.34 -0.07 0.00 2.52 0.00 0.00 27.41 31.40 3dfp h HIS 80 CO 0.56 -0.35 -0.24 1.49 0.71 0.00 0.00 177.93 180.10 3dfp h GLU 81 N -0.01 -0.25 -0.14 5.26 4.81 -1.97 -2.65 114.58 119.63 3dfp h GLU 81 Ca 0.37 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.59 3dfp h GLU 81 Cb 0.59 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 3dfp h GLU 81 CO -0.83 -0.16 -0.05 1.15 -0.73 0.00 0.00 179.01 178.39 3dfp h THR 82 N -0.25 1.13 -0.04 0.32 2.02 -1.76 -2.58 112.91 111.74 3dfp h THR 82 Ca 0.13 -0.53 0.01 0.00 0.77 0.00 0.00 66.41 66.80 3dfp h THR 82 Cb 0.46 1.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.95 3dfp h THR 82 CO -0.38 0.17 0.05 0.25 0.37 0.00 0.00 175.52 175.98 3dfp h LEU 83 N 0.20 0.00 -3.04 2.58 6.46 -1.11 -2.42 115.31 117.99 3dfp h LEU 83 Ca 0.05 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 3dfp h LEU 83 Cb 0.23 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.16 3dfp h LEU 83 CO 0.01 0.00 0.00 -1.22 -0.62 0.00 0.00 178.44 176.61 3dfp n TYR 84 N -3.76 0.59 -2.93 1.25 4.01 -0.98 -4.63 117.16 110.72 3dfp n TYR 84 Ca -0.02 -0.66 -0.19 0.00 -0.16 0.00 0.00 57.90 56.88 3dfp n TYR 84 Cb 0.13 -0.14 0.02 0.00 -0.31 0.00 0.00 39.34 39.04 3dfp n TYR 84 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3dfp s GLN 85 N -1.75 2.77 0.15 -0.72 -0.21 -0.91 -5.00 119.66 113.99 3dfp s GLN 85 Ca 0.29 -1.07 0.05 0.00 0.02 0.00 0.00 55.36 54.66 3dfp s GLN 85 Cb 0.20 -2.68 -0.04 0.00 1.00 0.00 0.00 33.01 31.49 3dfp s GLN 85 CO 0.12 -0.38 -0.12 0.15 -2.12 0.00 0.00 175.29 172.94 3dfp s LYS 86 N -4.47 1.08 0.82 2.91 1.02 -1.26 -2.10 119.74 117.74 3dfp s LYS 86 Ca 0.55 -1.40 -0.12 0.00 0.02 0.00 0.00 55.97 55.02 3dfp s LYS 86 Cb -0.10 -0.77 0.10 0.00 -0.52 0.00 0.00 37.83 36.54 3dfp s LYS 86 CO 0.35 0.12 1.18 0.00 -0.92 0.00 0.00 175.35 176.07 3dfp s ALA 87 N -2.90 2.68 0.29 5.17 0.00 -0.62 -4.89 121.76 121.49 3dfp s ALA 87 Ca 0.15 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.29 3dfp s ALA 87 Cb -0.00 -2.83 0.60 0.00 0.00 0.00 0.00 23.12 20.88 3dfp s ALA 87 CO 0.02 -1.76 1.82 -0.44 0.00 0.00 0.00 175.76 175.40 3dfp h ASP 88 N -1.09 0.90 0.00 0.00 3.32 -1.99 -0.24 116.42 117.33 3dfp h ASP 88 Ca -0.45 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.66 3dfp h ASP 88 Cb 1.31 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.74 3dfp h ASP 88 CO 0.59 0.44 0.00 -0.90 -1.72 0.00 0.00 179.24 177.65 3dfp n ASP 89 N -4.65 0.00 0.00 6.45 3.85 -1.26 -4.87 116.55 116.07 3dfp n ASP 89 Ca 0.20 -0.88 0.00 0.00 -0.71 0.00 0.00 54.79 53.40 3dfp n ASP 89 Cb 0.41 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.18 3dfp n ASP 89 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dfp n GLY 90 N 0.34 1.22 3.70 6.12 0.00 -0.10 -5.04 105.19 111.43 3dfp n GLY 90 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3dfp n GLY 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dfp s ARG 91 N -0.54 4.41 0.33 1.61 0.52 -1.26 -4.72 118.95 119.30 3dfp s ARG 91 Ca 0.00 1.67 -0.29 0.00 -0.52 0.00 0.00 55.73 56.59 3dfp s ARG 91 Cb 0.00 -3.47 -0.12 0.00 0.52 0.00 0.00 34.95 31.88 3dfp s ARG 91 CO 0.00 -0.33 1.48 -2.30 0.02 0.00 0.00 175.30 174.17 3dfp n PRO 92 N 4.59 2.54 -0.32 3.54 -0.02 -1.26 -1.58 135.00 142.49 3dfp n PRO 92 Ca 0.10 0.89 0.11 0.00 -2.02 0.00 0.00 63.50 62.58 3dfp n PRO 92 Cb 0.47 -2.61 0.28 0.00 -0.02 0.00 0.00 33.50 31.62 3dfp n PRO 92 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 3dfp h PHE 93 N 3.54 0.83 -0.95 6.00 0.04 -1.71 0.14 116.94 124.84 3dfp h PHE 93 Ca -0.48 0.04 0.10 0.00 2.80 0.00 0.00 57.97 60.42 3dfp h PHE 93 Cb 1.25 -0.23 -0.07 0.00 2.20 0.00 0.00 35.95 39.09 3dfp h PHE 93 CO 0.54 0.13 0.61 -1.35 -0.60 0.00 0.00 178.31 177.64 3dfp h PRO 94 N 0.60 0.95 -0.51 1.51 0.11 -1.85 -1.07 132.00 131.72 3dfp h PRO 94 Ca 0.53 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.52 3dfp h PRO 94 Cb 0.87 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.74 3dfp h PRO 94 CO -0.42 0.63 0.06 0.37 -0.21 0.00 0.00 178.00 178.43 3dfp h GLN 95 N 0.98 0.86 -0.57 1.05 4.15 -1.33 -1.30 115.11 118.95 3dfp h GLN 95 Ca 0.45 -0.24 0.01 0.00 0.77 0.00 0.00 58.65 59.63 3dfp h GLN 95 Cb 0.40 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.97 3dfp h GLN 95 CO -0.21 0.86 0.38 0.28 -1.93 0.00 0.00 178.83 178.21 3dfp h VAL 96 N 0.74 1.15 -0.25 2.39 2.07 -0.81 0.19 116.25 121.72 3dfp h VAL 96 Ca 0.15 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 3dfp h VAL 96 Cb 0.43 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 3dfp h VAL 96 CO 0.01 0.14 0.13 0.40 0.02 0.00 0.00 177.57 178.27 3dfp h ILE 97 N 0.77 1.14 -0.59 4.57 2.04 -1.01 -3.04 117.51 121.39 3dfp h ILE 97 Ca 0.21 -0.39 -0.10 0.00 1.00 0.00 0.00 64.86 65.58 3dfp h ILE 97 Cb -0.09 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 3dfp h ILE 97 CO -0.04 0.14 -0.04 0.11 0.00 0.00 0.00 178.15 178.31 3dfp h LYS 98 N 0.28 1.07 0.00 2.37 1.57 -0.99 -1.77 116.57 119.11 3dfp h LYS 98 Ca 0.09 -0.36 -0.00 0.00 -1.87 0.00 0.00 60.65 58.51 3dfp h LYS 98 Cb 0.10 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3dfp h LYS 98 CO -0.01 1.06 -0.01 0.66 -0.57 0.00 0.00 179.45 180.58 3dfp h SER 99 N 0.96 0.00 -0.56 0.86 4.64 -0.88 0.13 113.55 118.70 3dfp h SER 99 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3dfp h SER 99 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 3dfp h SER 99 CO 0.04 0.01 0.00 0.29 -0.87 0.00 0.00 176.83 176.30 3dfp n LYS 100 N -3.49 2.73 -0.87 4.77 5.02 -1.05 -4.93 118.16 120.35 3dfp n LYS 100 Ca -0.03 -2.18 0.00 0.00 -2.02 0.00 0.00 58.31 54.08 3dfp n LYS 100 Cb 0.10 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 3dfp n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dfp n GLY 101 N 1.22 0.53 3.88 0.72 0.00 0.45 -4.64 105.19 107.34 3dfp n GLY 101 Ca 0.20 -0.33 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 3dfp n GLY 101 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dfp s GLY 102 N -2.30 1.56 -0.06 -0.02 0.00 -0.69 -4.83 107.32 100.97 3dfp s GLY 102 Ca 0.00 -1.20 -0.09 0.00 0.00 0.00 0.00 44.72 43.42 3dfp s GLY 102 CO 0.00 -1.22 0.25 0.14 0.00 0.00 0.00 173.10 172.27 3dfp s VAL 103 N -1.87 5.32 -0.13 1.40 1.01 -0.65 -3.70 120.40 121.79 3dfp s VAL 103 Ca 0.33 0.40 -0.19 0.00 0.00 0.00 0.00 61.98 62.52 3dfp s VAL 103 Cb -0.10 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 3dfp s VAL 103 CO 0.26 0.56 0.52 -0.69 0.00 0.00 0.00 175.10 175.75 3dfp s VAL 104 N -1.10 5.15 0.29 2.92 1.01 -1.26 -1.06 120.40 126.35 3dfp s VAL 104 Ca 0.20 1.03 0.10 0.00 0.00 0.00 0.00 61.98 63.31 3dfp s VAL 104 Cb -0.14 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 3dfp s VAL 104 CO 0.09 0.29 -0.04 -0.83 0.00 0.00 0.00 175.10 174.60 3dfp s GLY 105 N 0.75 1.81 -0.02 4.51 0.00 0.56 -1.06 107.32 113.87 3dfp s GLY 105 Ca 0.27 -1.78 -0.02 0.00 0.00 0.00 0.00 44.72 43.19 3dfp s GLY 105 CO 0.11 -1.82 0.05 -1.50 0.00 0.00 0.00 173.10 169.94 3dfp s ILE 106 N -2.42 -0.01 0.06 0.90 1.10 -0.70 -1.31 121.20 118.82 3dfp s ILE 106 Ca 0.32 0.04 -0.30 0.00 -0.51 0.00 0.00 60.65 60.20 3dfp s ILE 106 Cb -0.05 -0.09 -0.05 0.00 0.15 0.00 0.00 42.46 42.43 3dfp s ILE 106 CO 0.19 0.02 1.06 -0.75 -2.11 0.00 0.00 174.94 173.35 3dfp s LYS 107 N 0.26 4.54 0.00 3.50 2.20 -0.97 -1.43 119.74 127.84 3dfp s LYS 107 Ca -0.02 1.58 0.00 0.00 -0.36 0.00 0.00 55.97 57.17 3dfp s LYS 107 Cb -0.03 -3.39 0.00 0.00 -1.51 0.00 0.00 37.83 32.91 3dfp s LYS 107 CO -0.01 -0.06 0.00 1.33 -0.36 0.00 0.00 175.35 176.25 3dfp n VAL 108 N 3.53 0.00 -1.72 4.02 0.24 -0.64 -4.73 118.33 119.03 3dfp n VAL 108 Ca 0.06 -0.42 -0.30 0.00 -2.04 0.00 0.00 64.34 61.64 3dfp n VAL 108 Cb 0.49 0.96 0.07 0.00 -1.47 0.00 0.00 33.84 33.88 3dfp n VAL 108 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 3dfp s ASP 109 N -0.98 4.95 -0.30 -1.34 1.47 -1.24 -4.87 116.67 114.37 3dfp s ASP 109 Ca 0.00 1.20 0.07 0.00 1.18 0.00 0.00 52.55 55.01 3dfp s ASP 109 Cb 0.00 -1.96 0.46 0.00 -0.34 0.00 0.00 42.92 41.08 3dfp s ASP 109 CO 0.00 -1.67 1.29 0.29 0.68 0.00 0.00 175.17 175.77 3dfp n LYS 110 N -3.22 2.89 0.00 2.11 5.02 0.04 -4.96 118.16 120.04 3dfp n LYS 110 Ca 0.07 -3.80 0.00 0.00 -2.02 0.00 0.00 58.31 52.56 3dfp n LYS 110 Cb 0.57 -2.08 0.00 0.00 -0.02 0.00 0.00 35.03 33.50 3dfp n LYS 110 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dfp n GLY 111 N -0.86 -1.58 3.90 0.72 0.00 -1.26 -4.72 105.19 101.39 3dfp n GLY 111 Ca 0.39 -1.56 -0.28 0.00 0.00 0.00 0.00 46.02 44.57 3dfp n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dfp s VAL 112 N -2.24 4.83 0.01 1.61 -7.23 -1.26 -1.98 120.40 114.14 3dfp s VAL 112 Ca 0.00 0.38 0.00 0.00 -1.81 0.00 0.00 61.98 60.55 3dfp s VAL 112 Cb 0.00 -3.86 -0.01 0.00 0.56 0.00 0.00 36.38 33.07 3dfp s VAL 112 CO 0.00 -0.92 -0.02 0.68 -0.31 0.00 0.00 175.10 174.53 3dfp s VAL 113 N -2.87 0.10 0.37 1.32 -7.23 -0.02 -4.88 120.40 107.19 3dfp s VAL 113 Ca 0.50 -0.50 -0.27 0.00 -1.81 0.00 0.00 61.98 59.89 3dfp s VAL 113 Cb -0.10 -0.17 -0.09 0.00 0.56 0.00 0.00 36.38 36.57 3dfp s VAL 113 CO 0.47 -0.26 1.29 -2.16 -0.31 0.00 0.00 175.10 174.14 3dfp s PRO 114 N -0.79 4.14 -0.40 4.82 0.04 -1.26 -1.39 135.00 140.16 3dfp s PRO 114 Ca -0.08 2.15 -0.17 0.00 0.04 0.00 0.00 61.00 62.94 3dfp s PRO 114 Cb -0.05 -2.89 0.01 0.00 0.04 0.00 0.00 34.50 31.61 3dfp s PRO 114 CO -0.00 -0.34 0.44 -0.51 0.04 0.00 0.00 177.00 176.63 3dfp s LEU 115 N -2.16 4.73 0.36 -3.56 1.43 -0.48 -4.84 118.68 114.15 3dfp s LEU 115 Ca 0.53 -0.53 -0.28 0.00 -1.03 0.00 0.00 54.13 52.82 3dfp s LEU 115 Cb -0.38 -2.42 -0.11 0.00 0.03 0.00 0.00 46.19 43.31 3dfp s LEU 115 CO 0.50 -0.55 1.47 0.00 0.23 0.00 0.00 176.35 178.00 3dfp n ALA 116 N 5.62 2.21 -0.78 4.21 0.00 -1.26 -2.64 120.51 127.87 3dfp n ALA 116 Ca -0.07 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.72 3dfp n ALA 116 Cb 0.48 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.53 3dfp n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dfp n GLY 117 N 0.72 0.58 3.56 0.00 0.00 -1.26 -5.05 105.19 103.73 3dfp n GLY 117 Ca 0.03 -0.25 -0.26 0.00 0.00 0.00 0.00 46.02 45.54 3dfp n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dfp s THR 118 N -2.00 1.87 -1.38 2.61 -4.23 -1.08 -5.04 115.64 106.39 3dfp s THR 118 Ca 0.00 -2.05 -0.10 0.00 -1.18 0.00 0.00 61.69 58.35 3dfp s THR 118 Cb 0.00 -2.84 0.09 0.00 1.34 0.00 0.00 72.50 71.09 3dfp s THR 118 CO 0.00 -0.07 2.19 -3.20 -0.54 0.00 0.00 174.62 173.00 3dfp n ASN 119 N -0.85 5.58 -1.25 3.99 4.05 -1.26 -4.50 115.26 121.02 3dfp n ASN 119 Ca -0.05 -2.97 -0.11 0.00 0.45 0.00 0.00 54.58 51.91 3dfp n ASN 119 Cb 0.66 -1.53 -0.01 0.00 1.23 0.00 0.00 39.78 40.14 3dfp n ASN 119 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3dfp n GLY 120 N 3.13 -0.05 3.95 8.20 0.00 -1.26 -5.03 105.19 114.13 3dfp n GLY 120 Ca 0.51 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 3dfp n GLY 120 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dfp s GLU 121 N -4.51 2.93 0.24 1.61 2.02 -1.26 -4.98 118.70 114.73 3dfp s GLU 121 Ca 0.00 -0.47 0.01 0.00 0.02 0.00 0.00 54.97 54.53 3dfp s GLU 121 Cb 0.00 -2.49 -0.04 0.00 0.10 0.00 0.00 34.13 31.70 3dfp s GLU 121 CO 0.00 -0.44 0.16 0.95 0.02 0.00 0.00 175.26 175.95 3dfp s THR 122 N -2.67 0.06 0.31 3.63 -4.23 -1.26 -1.39 115.64 110.09 3dfp s THR 122 Ca 0.51 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.07 3dfp s THR 122 Cb -0.10 -2.51 -0.02 0.00 1.34 0.00 0.00 72.50 71.21 3dfp s THR 122 CO 0.39 0.00 0.17 1.07 -0.54 0.00 0.00 174.62 175.71 3dfp n THR 123 N -0.37 0.00 -4.57 3.99 5.66 -0.49 -4.80 114.28 113.70 3dfp n THR 123 Ca 0.03 -1.99 -0.25 0.00 -3.05 0.00 0.00 64.05 58.78 3dfp n THR 123 Cb 0.65 0.83 -0.14 0.00 -1.55 0.00 0.00 70.33 70.12 3dfp n THR 123 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3dfp s THR 124 N -2.94 1.71 0.38 1.09 2.01 -1.26 -0.84 115.64 115.78 3dfp s THR 124 Ca 0.23 -1.29 0.08 0.00 0.31 0.00 0.00 61.69 61.02 3dfp s THR 124 Cb 0.01 -1.50 -0.04 0.00 0.01 0.00 0.00 72.50 70.98 3dfp s THR 124 CO 0.17 0.15 0.21 0.00 -0.69 0.00 0.00 174.62 174.46 3dfp s GLN 125 N -1.36 2.38 0.00 4.92 -2.07 -0.84 -4.92 119.66 117.77 3dfp s GLN 125 Ca 0.08 -1.62 0.00 0.00 -1.82 0.00 0.00 55.36 51.99 3dfp s GLN 125 Cb -0.09 -2.17 0.00 0.00 -1.09 0.00 0.00 33.01 29.66 3dfp s GLN 125 CO 0.02 -0.02 0.00 0.41 -1.32 0.00 0.00 175.29 174.38 3dfp n GLY 126 N -1.27 -0.90 0.13 2.60 0.00 -1.26 -0.78 105.19 103.71 3dfp n GLY 126 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 3dfp n GLY 126 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dfp h LEU 127 N 0.00 0.03 -9.43 0.99 3.38 -1.91 -3.41 115.31 104.96 3dfp h LEU 127 Ca 0.00 -0.02 -0.55 0.00 0.09 0.00 0.00 57.88 57.41 3dfp h LEU 127 Cb 0.00 -0.01 0.03 0.00 0.09 0.00 0.00 40.66 40.77 3dfp h LEU 127 CO 0.00 0.70 1.13 0.47 0.09 0.00 0.00 178.44 180.83 3dfp n ASP 128 N -3.74 3.95 -1.67 -0.43 8.00 -1.26 -1.67 116.55 119.74 3dfp n ASP 128 Ca -0.01 0.96 -0.20 0.00 0.71 0.00 0.00 54.79 56.25 3dfp n ASP 128 Cb 0.67 -1.51 -0.07 0.00 -0.02 0.00 0.00 41.12 40.19 3dfp n ASP 128 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dfp n GLY 129 N 4.31 1.53 0.23 0.44 0.00 -1.26 -4.87 105.19 105.57 3dfp n GLY 129 Ca 0.19 -0.05 -0.02 0.00 0.00 0.00 0.00 46.02 46.15 3dfp n GLY 129 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3dfp h LEU 130 N 0.00 0.41 -0.02 0.99 5.85 -1.54 -2.91 115.31 118.09 3dfp h LEU 130 Ca -0.42 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.17 3dfp h LEU 130 Cb 1.32 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 3dfp h LEU 130 CO 0.60 0.65 -0.01 -1.28 -0.34 0.00 0.00 178.44 178.06 3dfp h SER 131 N 0.37 -0.04 -0.83 1.25 0.87 -1.90 -0.74 113.55 112.54 3dfp h SER 131 Ca 0.06 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 3dfp h SER 131 Cb 0.62 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.56 3dfp h SER 131 CO 0.04 -0.02 0.47 -0.33 -0.53 0.00 0.00 176.83 176.46 3dfp h GLU 132 N -0.01 1.15 -0.54 2.24 3.07 -1.96 -2.03 114.58 116.51 3dfp h GLU 132 Ca 0.01 -0.13 -0.09 0.00 -0.50 0.00 0.00 59.36 58.66 3dfp h GLU 132 Cb 0.03 -0.23 -0.02 0.00 -0.84 0.00 0.00 28.75 27.69 3dfp h GLU 132 CO -0.03 0.84 -0.01 0.00 -1.40 0.00 0.00 179.01 178.41 3dfp h ARG 133 N 1.16 0.96 -0.68 2.33 3.08 -1.27 -1.67 114.38 118.30 3dfp h ARG 133 Ca 0.30 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 3dfp h ARG 133 Cb 0.01 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 3dfp h ARG 133 CO -0.05 0.98 0.15 0.00 -1.07 0.00 0.00 179.97 179.98 3dfp h ALA 135 N 1.07 0.94 -0.30 0.00 0.00 -1.23 0.90 119.26 120.64 3dfp h ALA 135 Ca 0.21 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3dfp h ALA 135 Cb 0.39 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3dfp h ALA 135 CO 0.00 0.61 -0.06 0.37 0.00 0.00 0.00 179.25 180.17 3dfp h GLN 136 N 1.06 0.58 -0.62 0.00 5.75 -0.95 -2.18 115.11 118.74 3dfp h GLN 136 Ca 0.23 -0.22 -0.05 0.00 -0.15 0.00 0.00 58.65 58.47 3dfp h GLN 136 Cb 0.28 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.77 3dfp h GLN 136 CO -0.01 0.76 0.18 1.88 -2.65 0.00 0.00 178.83 178.99 3dfp h TYR 137 N 0.35 0.99 -0.49 3.99 0.05 -0.50 -1.76 116.97 119.60 3dfp h TYR 137 Ca 0.08 -0.09 -0.02 0.00 0.05 0.00 0.00 58.73 58.75 3dfp h TYR 137 Cb 0.54 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 3dfp h TYR 137 CO 0.05 0.80 0.24 -0.22 -1.05 0.00 0.00 178.16 177.98 3dfp h LYS 138 N 0.92 0.70 -0.22 4.88 1.63 -0.70 -0.95 116.57 122.82 3dfp h LYS 138 Ca 0.20 -0.10 -0.03 0.00 -0.85 0.00 0.00 60.65 59.87 3dfp h LYS 138 Cb 0.29 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.78 3dfp h LYS 138 CO -0.00 0.58 -0.01 -0.22 -3.45 0.00 0.00 179.45 176.34 3dfp h LYS 139 N 0.64 0.32 -0.71 1.90 3.64 -1.09 -2.73 116.57 118.55 3dfp h LYS 139 Ca 0.17 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3dfp h LYS 139 Cb 0.11 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 3dfp h LYS 139 CO -0.02 0.36 0.00 -0.25 -2.27 0.00 0.00 179.45 177.27 3dfp n ASP 140 N -4.35 3.82 0.00 4.20 8.00 -0.69 -4.92 116.55 122.62 3dfp n ASP 140 Ca 0.00 -2.52 0.00 0.00 0.71 0.00 0.00 54.79 52.98 3dfp n ASP 140 Cb 0.20 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.72 3dfp n ASP 140 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dfp n GLY 141 N 0.49 0.63 3.81 0.44 0.00 -1.03 -4.96 105.19 104.57 3dfp n GLY 141 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3dfp n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfp s ALA 142 N -2.00 3.48 0.00 4.61 0.00 -0.42 -4.49 121.76 122.94 3dfp s ALA 142 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.08 3dfp s ALA 142 Cb 0.00 -2.76 0.00 0.00 0.00 0.00 0.00 23.12 20.36 3dfp s ALA 142 CO 0.00 0.36 0.00 -0.25 0.00 0.00 0.00 175.76 175.87 3dfp n ASP 143 N 1.05 2.09 -3.94 0.00 10.43 -0.22 -4.13 116.55 121.83 3dfp n ASP 143 Ca -0.05 -0.24 -0.09 0.00 2.57 0.00 0.00 54.79 56.98 3dfp n ASP 143 Cb 0.51 0.91 -0.08 0.00 1.84 0.00 0.00 41.12 44.29 3dfp n ASP 143 CO 0.00 0.00 0.00 0.72 -1.07 0.00 0.00 177.20 176.85 3dfp s PHE 144 N -1.32 0.32 0.27 1.24 -0.71 -1.19 -1.07 117.98 115.52 3dfp s PHE 144 Ca 0.00 -0.75 0.03 0.00 -1.04 0.00 0.00 56.93 55.17 3dfp s PHE 144 Cb 0.00 -0.14 -0.06 0.00 -1.21 0.00 0.00 43.02 41.61 3dfp s PHE 144 CO 0.00 -0.56 0.03 0.00 -1.34 0.00 0.00 175.22 173.35 3dfp s ALA 145 N -3.91 2.02 -0.03 1.99 0.00 -0.20 -1.73 121.76 119.90 3dfp s ALA 145 Ca 0.10 -1.89 0.05 0.00 0.00 0.00 0.00 51.96 50.21 3dfp s ALA 145 Cb 0.05 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 23.79 3dfp s ALA 145 CO -0.07 -0.29 -0.19 0.21 0.00 0.00 0.00 175.76 175.42 3dfp s LYS 146 N -3.89 1.76 -0.16 0.00 2.20 -0.52 -2.64 119.74 116.50 3dfp s LYS 146 Ca 0.33 -0.67 -0.05 0.00 -0.36 0.00 0.00 55.97 55.22 3dfp s LYS 146 Cb 0.07 -1.59 0.08 0.00 -1.51 0.00 0.00 37.83 34.88 3dfp s LYS 146 CO 0.12 0.33 0.32 -0.46 -0.36 0.00 0.00 175.35 175.30 3dfp s TRP 147 N -0.18 -0.57 -0.18 4.03 -0.11 -1.26 -1.62 118.94 119.05 3dfp s TRP 147 Ca 0.01 1.17 -0.05 0.00 1.22 0.00 0.00 56.10 58.45 3dfp s TRP 147 Cb -0.10 0.09 -0.03 0.00 -1.50 0.00 0.00 33.47 31.93 3dfp s TRP 147 CO 0.01 -0.41 0.00 0.50 -4.62 0.00 0.00 176.95 172.43 3dfp s ARG 148 N 2.49 3.70 0.00 5.86 3.52 -1.26 -3.57 118.95 129.70 3dfp s ARG 148 Ca 0.00 -0.49 0.04 0.00 -0.13 0.00 0.00 55.73 55.16 3dfp s ARG 148 Cb -0.12 -3.05 -0.03 0.00 -1.56 0.00 0.00 34.95 30.18 3dfp s ARG 148 CO -0.10 0.13 -0.10 0.00 -0.81 0.00 0.00 175.30 174.42 3dfp s VAL 150 N -0.94 1.59 0.25 0.00 1.01 -1.26 -1.94 120.40 119.10 3dfp s VAL 150 Ca 0.16 -0.71 0.12 0.00 0.00 0.00 0.00 61.98 61.54 3dfp s VAL 150 Cb -0.11 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.79 3dfp s VAL 150 CO 0.06 0.46 -0.21 -0.76 0.00 0.00 0.00 175.10 174.65 3dfp s LEU 151 N 0.85 2.53 -0.01 3.92 1.43 -0.15 -4.47 118.68 122.78 3dfp s LEU 151 Ca -0.09 -0.97 0.02 0.00 -1.03 0.00 0.00 54.13 52.06 3dfp s LEU 151 Cb -0.15 -1.10 -0.00 0.00 0.03 0.00 0.00 46.19 44.96 3dfp s LEU 151 CO 0.00 0.06 -0.06 -0.75 0.23 0.00 0.00 176.35 175.83 3dfp s LYS 152 N -3.21 0.50 -0.30 1.70 2.20 -1.26 -1.47 119.74 117.89 3dfp s LYS 152 Ca 0.26 -0.20 -0.22 0.00 -0.36 0.00 0.00 55.97 55.45 3dfp s LYS 152 Cb -0.06 -0.49 -0.01 0.00 -1.51 0.00 0.00 37.83 35.77 3dfp s LYS 152 CO 0.13 0.11 0.70 0.42 -0.36 0.00 0.00 175.35 176.35 3dfp s ILE 153 N -0.06 4.88 0.00 5.43 1.01 -1.26 -2.27 121.20 128.93 3dfp s ILE 153 Ca 0.01 1.01 0.00 0.00 0.00 0.00 0.00 60.65 61.67 3dfp s ILE 153 Cb -0.03 -4.06 0.00 0.00 0.01 0.00 0.00 42.46 38.38 3dfp s ILE 153 CO -0.00 -0.18 0.00 0.61 0.00 0.00 0.00 174.94 175.37 3dfp n GLY 154 N 4.31 3.48 0.34 6.18 0.00 -0.24 -4.83 105.19 114.44 3dfp n GLY 154 Ca 0.01 -1.44 -0.04 0.00 0.00 0.00 0.00 46.02 44.56 3dfp n GLY 154 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3dfp h GLU 155 N 0.00 1.10 0.00 1.61 4.57 -2.02 -3.21 114.58 116.64 3dfp h GLU 155 Ca 0.00 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 3dfp h GLU 155 Cb 0.00 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.39 3dfp h GLU 155 CO 0.00 0.87 -0.00 0.72 -1.18 0.00 0.00 179.01 179.41 3dfp n HIS 156 N -4.31 0.00 -4.29 0.92 8.25 -1.26 -5.05 115.22 109.48 3dfp n HIS 156 Ca 0.07 -0.51 -0.22 0.00 -0.26 0.00 0.00 57.72 56.81 3dfp n HIS 156 Cb 0.15 -0.06 -0.12 0.00 1.12 0.00 0.00 29.99 31.09 3dfp n HIS 156 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3dfp s THR 157 N -1.09 1.65 0.17 1.59 -4.23 -1.21 -3.75 115.64 108.77 3dfp s THR 157 Ca 0.03 -1.72 -0.30 0.00 -1.18 0.00 0.00 61.69 58.51 3dfp s THR 157 Cb 0.02 -1.65 -0.08 0.00 1.34 0.00 0.00 72.50 72.14 3dfp s THR 157 CO 0.00 -0.25 1.13 -2.16 -0.54 0.00 0.00 174.62 172.80 3dfp s PRO 158 N -2.42 4.56 0.83 3.99 0.04 -0.96 -1.07 135.00 139.96 3dfp s PRO 158 Ca 0.10 1.76 -0.12 0.00 0.04 0.00 0.00 61.00 62.78 3dfp s PRO 158 Cb -0.07 -3.27 0.09 0.00 0.04 0.00 0.00 34.50 31.29 3dfp s PRO 158 CO 0.05 0.02 1.13 -1.54 0.04 0.00 0.00 177.00 176.69 3dfp s SER 159 N 0.01 4.24 0.28 6.66 1.04 -1.25 -4.86 113.70 119.82 3dfp s SER 159 Ca 0.51 1.05 -0.03 0.00 0.48 0.00 0.00 55.95 57.95 3dfp s SER 159 Cb -0.30 -1.68 0.39 0.00 0.10 0.00 0.00 66.02 64.52 3dfp s SER 159 CO 0.35 -2.10 1.96 0.00 0.98 0.00 0.00 173.24 174.43 3dfp h ALA 160 N -1.19 1.37 -0.07 5.32 0.00 -2.00 -2.04 119.26 120.65 3dfp h ALA 160 Ca -0.48 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 3dfp h ALA 160 Cb 1.30 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3dfp h ALA 160 CO 0.62 0.59 0.01 1.25 0.00 0.00 0.00 179.25 181.72 3dfp h LEU 161 N 1.20 0.12 -0.81 0.00 5.85 -1.99 -1.93 115.31 117.75 3dfp h LEU 161 Ca 0.32 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 3dfp h LEU 161 Cb -0.14 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 3dfp h LEU 161 CO -0.07 0.33 0.50 0.00 -0.34 0.00 0.00 178.44 178.87 3dfp h ALA 162 N 0.79 1.02 -0.26 1.25 0.00 -1.87 0.23 119.26 120.42 3dfp h ALA 162 Ca 0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3dfp h ALA 162 Cb 0.26 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3dfp h ALA 162 CO 0.00 0.47 -0.03 0.82 0.00 0.00 0.00 179.25 180.51 3dfp h ILE 163 N 1.10 1.27 -0.19 0.00 2.04 -1.38 -1.81 117.51 118.53 3dfp h ILE 163 Ca 0.29 -0.99 -0.04 0.00 1.00 0.00 0.00 64.86 65.12 3dfp h ILE 163 Cb -0.07 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 3dfp h ILE 163 CO -0.06 0.31 -0.03 -0.03 0.00 0.00 0.00 178.15 178.34 3dfp h MET 164 N 0.24 0.37 -0.47 2.37 4.05 -1.04 -2.25 114.93 118.20 3dfp h MET 164 Ca 0.07 -0.13 -0.06 0.00 -0.28 0.00 0.00 59.70 59.29 3dfp h MET 164 Cb 0.47 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.23 3dfp h MET 164 CO 0.02 0.61 0.05 1.49 0.23 0.00 0.00 176.91 179.31 3dfp h GLU 165 N 0.09 0.79 -0.37 0.39 4.57 -0.58 -1.74 114.58 117.73 3dfp h GLU 165 Ca 0.05 -0.23 -0.10 0.00 -1.18 0.00 0.00 59.36 57.90 3dfp h GLU 165 Cb 0.46 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.95 3dfp h GLU 165 CO 0.02 0.82 -0.19 -0.91 -1.18 0.00 0.00 179.01 177.57 3dfp h ASN 166 N 0.65 0.71 -0.00 1.04 2.35 -1.37 -1.43 115.58 117.52 3dfp h ASN 166 Ca 0.14 -0.23 -0.13 0.00 -0.55 0.00 0.00 56.30 55.52 3dfp h ASN 166 Cb 0.43 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 3dfp h ASN 166 CO 0.01 0.89 -0.41 0.00 -1.65 0.00 0.00 177.43 176.28 3dfp h ALA 167 N 1.17 0.88 -0.21 -0.83 0.00 -1.32 -2.32 119.26 116.62 3dfp h ALA 167 Ca 0.10 -0.44 -0.19 0.00 0.00 0.00 0.00 54.91 54.37 3dfp h ALA 167 Cb 0.66 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3dfp h ALA 167 CO 0.05 0.64 -0.63 -0.97 0.00 0.00 0.00 179.25 178.34 3dfp h ASN 168 N 0.43 0.85 0.72 0.00 -1.24 -1.04 -2.79 115.58 112.50 3dfp h ASN 168 Ca 0.04 -0.49 -0.10 0.00 0.71 0.00 0.00 56.30 56.45 3dfp h ASN 168 Cb 0.90 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.69 3dfp h ASN 168 CO 0.08 1.27 -0.48 1.62 -1.29 0.00 0.00 177.43 178.63 3dfp h VAL 169 N 0.55 1.14 -0.23 2.57 3.04 -1.23 -2.61 116.25 119.49 3dfp h VAL 169 Ca -0.01 -1.76 -0.12 0.00 -1.01 0.00 0.00 66.70 63.80 3dfp h VAL 169 Cb 1.23 2.00 -0.01 0.00 -2.01 0.00 0.00 31.29 32.50 3dfp h VAL 169 CO 0.13 0.47 -0.37 -0.07 -1.01 0.00 0.00 177.57 176.72 3dfp h LEU 170 N 0.00 0.53 -0.38 3.16 3.38 -1.36 -2.24 115.31 118.41 3dfp h LEU 170 Ca -0.00 -0.22 -0.15 0.00 0.09 0.00 0.00 57.88 57.60 3dfp h LEU 170 Cb 0.96 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 3dfp h LEU 170 CO 0.06 0.85 -0.33 0.00 0.09 0.00 0.00 178.44 179.11 3dfp h ALA 171 N 1.18 0.55 -0.21 1.53 0.00 -1.21 -1.31 119.26 119.80 3dfp h ALA 171 Ca 0.04 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 3dfp h ALA 171 Cb 0.84 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3dfp h ALA 171 CO 0.07 0.62 0.12 0.00 0.00 0.00 0.00 179.25 180.06 3dfp h ARG 172 N 0.71 0.29 -0.87 0.00 2.47 -1.40 -0.05 114.38 115.54 3dfp h ARG 172 Ca 0.07 -0.03 0.03 0.00 -1.26 0.00 0.00 59.98 58.78 3dfp h ARG 172 Cb 0.92 -0.06 -0.05 0.00 -1.65 0.00 0.00 29.97 29.14 3dfp h ARG 172 CO 0.09 0.27 0.56 -0.92 0.56 0.00 0.00 179.97 180.53 3dfp h TYR 173 N 0.23 1.06 -0.49 3.04 3.20 -1.34 -1.83 116.97 120.85 3dfp h TYR 173 Ca 0.07 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.89 3dfp h TYR 173 Cb 0.07 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 37.96 3dfp h TYR 173 CO -0.04 0.62 0.00 0.00 -1.64 0.00 0.00 178.16 177.11 3dfp h ALA 174 N 1.35 0.66 0.10 1.82 0.00 -0.85 -2.44 119.26 119.90 3dfp h ALA 174 Ca 0.34 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3dfp h ALA 174 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3dfp h ALA 174 CO -0.11 0.46 -0.10 1.03 0.00 0.00 0.00 179.25 180.53 3dfp h SER 175 N 0.72 -0.27 -0.79 0.00 0.87 -0.54 -1.72 113.55 111.81 3dfp h SER 175 Ca 0.14 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.75 3dfp h SER 175 Cb 0.51 0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.52 3dfp h SER 175 CO 0.02 -0.16 0.51 0.40 -0.53 0.00 0.00 176.83 177.07 3dfp h ILE 176 N -0.23 1.14 -0.27 2.23 2.04 -1.34 -2.69 117.51 118.38 3dfp h ILE 176 Ca 0.00 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 3dfp h ILE 176 Cb 0.22 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 3dfp h ILE 176 CO -0.03 0.18 0.16 0.00 0.00 0.00 0.00 178.15 178.46 3dfp h GLN 178 N 0.34 0.00 0.00 0.00 4.20 -1.02 -1.05 115.11 117.58 3dfp h GLN 178 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 3dfp h GLN 178 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 3dfp h GLN 178 CO -0.02 0.00 0.00 1.04 -0.67 0.00 0.00 178.83 179.18 3dfp n GLN 179 N -2.85 0.22 -0.16 1.46 1.13 -1.04 -3.56 117.38 112.58 3dfp n GLN 179 Ca -0.00 0.18 0.10 0.00 -1.94 0.00 0.00 57.00 55.34 3dfp n GLN 179 Cb 0.20 -1.76 0.17 0.00 0.11 0.00 0.00 30.24 28.95 3dfp n GLN 179 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3dfp n ASN 180 N -2.14 2.63 -0.85 1.08 4.13 -0.49 -4.98 115.26 114.64 3dfp n ASN 180 Ca 0.06 -3.10 -0.10 0.00 1.68 0.00 0.00 54.58 53.12 3dfp n ASN 180 Cb 0.41 -0.46 -0.03 0.00 -1.54 0.00 0.00 39.78 38.16 3dfp n ASN 180 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3dfp n GLY 181 N -1.25 0.77 3.45 7.41 0.00 -1.14 -4.76 105.19 109.67 3dfp n GLY 181 Ca 0.17 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 45.30 3dfp n GLY 181 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dfp s ILE 182 N -2.40 3.71 -0.22 -0.61 -1.09 -0.67 -4.85 121.20 115.08 3dfp s ILE 182 Ca 0.00 -0.41 -0.29 0.00 -2.23 0.00 0.00 60.65 57.71 3dfp s ILE 182 Cb 0.00 -2.63 -0.01 0.00 -1.58 0.00 0.00 42.46 38.24 3dfp s ILE 182 CO 0.00 0.48 1.25 -0.69 -1.23 0.00 0.00 174.94 174.75 3dfp s VAL 183 N 0.59 4.28 -0.13 2.92 1.01 -0.23 -3.50 120.40 125.33 3dfp s VAL 183 Ca -0.03 1.52 -0.24 0.00 0.00 0.00 0.00 61.98 63.22 3dfp s VAL 183 Cb -0.15 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.12 3dfp s VAL 183 CO 0.03 -0.26 0.77 -2.16 0.00 0.00 0.00 175.10 173.48 3dfp s PRO 184 N 3.69 4.35 -0.38 2.72 0.04 -1.26 -1.03 135.00 143.13 3dfp s PRO 184 Ca 0.54 0.95 -0.16 0.00 0.04 0.00 0.00 61.00 62.36 3dfp s PRO 184 Cb -0.19 -3.53 0.00 0.00 0.04 0.00 0.00 34.50 30.83 3dfp s PRO 184 CO 0.16 -0.17 0.40 0.42 0.04 0.00 0.00 177.00 177.85 3dfp s ILE 185 N 1.61 5.13 -0.32 0.56 1.01 -1.08 -2.90 121.20 125.20 3dfp s ILE 185 Ca 0.38 -0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.60 3dfp s ILE 185 Cb -0.17 -3.93 0.02 0.00 0.01 0.00 0.00 42.46 38.38 3dfp s ILE 185 CO 0.15 -0.26 1.05 -0.69 0.00 0.00 0.00 174.94 175.20 3dfp s VAL 186 N 2.08 4.52 -0.45 2.92 1.01 -0.35 -4.13 120.40 126.00 3dfp s VAL 186 Ca 0.12 1.67 0.04 0.00 0.00 0.00 0.00 61.98 63.81 3dfp s VAL 186 Cb -0.17 -4.40 0.12 0.00 0.00 0.00 0.00 36.38 31.93 3dfp s VAL 186 CO 0.13 -0.48 0.19 -0.70 0.00 0.00 0.00 175.10 174.23 3dfp s GLU 187 N 3.62 1.72 -1.07 2.72 2.12 -1.23 -0.58 118.70 126.00 3dfp s GLU 187 Ca 0.44 -2.29 -0.08 0.00 0.36 0.00 0.00 54.97 53.41 3dfp s GLU 187 Cb -0.12 -3.16 0.27 0.00 0.26 0.00 0.00 34.13 31.38 3dfp s GLU 187 CO 0.16 -1.06 1.05 -1.25 -0.54 0.00 0.00 175.26 173.62 3dfp s PRO 188 N 0.19 4.03 -0.00 4.30 0.04 -1.24 -1.67 135.00 140.65 3dfp s PRO 188 Ca 0.15 -3.22 -0.30 0.00 0.04 0.00 0.00 61.00 57.67 3dfp s PRO 188 Cb -0.23 -4.45 -0.04 0.00 0.04 0.00 0.00 34.50 29.82 3dfp s PRO 188 CO -0.03 -1.25 1.14 -2.00 0.04 0.00 0.00 177.00 174.90 3dfp s GLU 189 N -1.26 4.43 -0.36 4.56 2.12 -0.82 -4.60 118.70 122.78 3dfp s GLU 189 Ca 0.30 1.63 -0.10 0.00 0.36 0.00 0.00 54.97 57.16 3dfp s GLU 189 Cb -0.10 -3.45 0.03 0.00 0.26 0.00 0.00 34.13 30.87 3dfp s GLU 189 CO -0.09 -0.27 0.19 0.42 -0.54 0.00 0.00 175.26 174.97 3dfp s ILE 190 N 1.48 4.47 0.53 -3.70 1.01 -1.26 -0.98 121.20 122.75 3dfp s ILE 190 Ca 0.56 -0.86 -0.21 0.00 0.00 0.00 0.00 60.65 60.14 3dfp s ILE 190 Cb -0.25 -3.48 -0.07 0.00 0.01 0.00 0.00 42.46 38.67 3dfp s ILE 190 CO 0.26 -0.20 1.01 0.18 0.00 0.00 0.00 174.94 176.18 3dfp n LEU 191 N 4.97 3.41 -0.45 2.97 4.77 -0.54 -4.87 117.00 127.27 3dfp n LEU 191 Ca -0.12 0.90 0.13 0.00 -0.03 0.00 0.00 56.01 56.89 3dfp n LEU 191 Cb 0.46 -1.39 0.50 0.00 -2.33 0.00 0.00 43.42 40.66 3dfp n LEU 191 CO 0.36 -1.63 0.85 -0.81 -1.33 0.00 0.00 177.39 174.83 3dfp n PRO 192 N -0.56 1.60 -2.01 3.23 -0.04 -1.26 -4.55 135.00 131.41 3dfp n PRO 192 Ca 0.12 -0.89 -0.41 0.00 -0.04 0.00 0.00 63.50 62.28 3dfp n PRO 192 Cb 0.44 -1.44 -0.02 0.00 -0.04 0.00 0.00 33.50 32.45 3dfp n PRO 192 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dfp s ASP 193 N -1.82 6.63 0.00 3.54 1.11 -1.26 -0.52 116.67 124.35 3dfp s ASP 193 Ca 0.36 2.78 0.00 0.00 0.18 0.00 0.00 52.55 55.87 3dfp s ASP 193 Cb 0.19 -2.65 0.00 0.00 1.07 0.00 0.00 42.92 41.54 3dfp s ASP 193 CO 0.30 -0.66 0.00 0.61 1.18 0.00 0.00 175.17 176.60 3dfp n GLY 194 N 1.06 1.03 0.75 0.21 0.00 -1.26 -4.64 105.19 102.35 3dfp n GLY 194 Ca 0.02 -2.26 0.08 0.00 0.00 0.00 0.00 46.02 43.86 3dfp n GLY 194 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dfp n ASP 195 N 0.00 3.49 -4.75 1.61 5.75 -1.26 0.04 116.55 121.43 3dfp n ASP 195 Ca 0.00 -2.74 -0.32 0.00 -0.01 0.00 0.00 54.79 51.72 3dfp n ASP 195 Cb 0.00 -0.44 0.09 0.00 -1.03 0.00 0.00 41.12 39.74 3dfp n ASP 195 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 3dfp s HIS 196 N -2.32 2.39 0.39 2.11 -3.43 -1.26 -4.25 115.29 108.92 3dfp s HIS 196 Ca 0.35 1.60 -0.03 0.00 -0.80 0.00 0.00 55.06 56.19 3dfp s HIS 196 Cb 0.27 -3.16 0.08 0.00 -1.43 0.00 0.00 32.58 28.35 3dfp s HIS 196 CO 0.10 -2.00 0.53 -0.40 -2.00 0.00 0.00 174.74 170.97 3dfp n ASP 197 N -3.33 0.47 -0.11 7.38 5.68 -1.26 -0.85 116.55 124.52 3dfp n ASP 197 Ca 0.10 -1.45 -0.12 0.00 -0.50 0.00 0.00 54.79 52.82 3dfp n ASP 197 Cb 0.52 -0.37 -0.03 0.00 -1.14 0.00 0.00 41.12 40.11 3dfp n ASP 197 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 3dfp h LEU 198 N 0.00 0.75 -1.50 -2.12 5.85 -1.93 -3.03 115.31 113.33 3dfp h LEU 198 Ca -0.17 -0.41 -0.05 0.00 0.84 0.00 0.00 57.88 58.08 3dfp h LEU 198 Cb 0.59 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 3dfp h LEU 198 CO 0.16 1.00 -0.25 0.07 -0.34 0.00 0.00 178.44 179.08 3dfp h LYS 199 N 0.50 0.00 -0.03 1.25 2.10 -1.95 -2.01 116.57 116.44 3dfp h LYS 199 Ca 0.07 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.54 3dfp h LYS 199 Cb 0.72 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.04 3dfp h LYS 199 CO 0.05 0.25 -0.79 -0.09 -2.00 0.00 0.00 179.45 176.87 3dfp h ARG 200 N 0.00 0.24 -0.30 0.07 2.43 -1.93 -1.98 114.38 112.90 3dfp h ARG 200 Ca -0.00 -0.22 -0.10 0.00 -0.81 0.00 0.00 59.98 58.84 3dfp h ARG 200 Cb 0.54 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3dfp h ARG 200 CO 0.03 0.91 -0.21 0.00 -1.51 0.00 0.00 179.97 179.19 3dfp h GLN 202 N 0.43 0.85 0.09 0.00 4.15 -1.32 0.05 115.11 119.36 3dfp h GLN 202 Ca 0.06 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 3dfp h GLN 202 Cb 0.76 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.26 3dfp h GLN 202 CO 0.06 0.56 -0.04 -0.92 -1.93 0.00 0.00 178.83 176.56 3dfp h TYR 203 N 0.88 -0.12 -0.79 3.99 3.20 -1.28 -0.94 116.97 121.92 3dfp h TYR 203 Ca 0.24 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 3dfp h TYR 203 Cb -0.08 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.19 3dfp h TYR 203 CO -0.03 -0.04 0.35 0.28 -1.64 0.00 0.00 178.16 177.08 3dfp h VAL 204 N -0.16 1.25 -0.69 1.81 2.07 -1.21 -2.09 116.25 117.24 3dfp h VAL 204 Ca -0.01 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.74 3dfp h VAL 204 Cb 0.12 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 3dfp h VAL 204 CO 0.02 0.31 0.35 0.74 0.02 0.00 0.00 177.57 179.02 3dfp h THR 205 N 1.12 1.22 -0.40 2.57 2.02 -0.82 -0.58 112.91 118.06 3dfp h THR 205 Ca 0.27 -0.59 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 3dfp h THR 205 Cb 0.16 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 66.90 3dfp h THR 205 CO -0.03 0.25 0.23 -0.33 0.37 0.00 0.00 175.52 176.01 3dfp h GLU 206 N 0.95 0.55 -0.60 6.66 5.08 -0.83 -1.27 114.58 125.12 3dfp h GLU 206 Ca 0.24 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.47 3dfp h GLU 206 Cb 0.08 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 3dfp h GLU 206 CO -0.03 0.43 0.10 0.87 -1.00 0.00 0.00 179.01 179.37 3dfp h LYS 207 N 0.52 0.99 0.14 2.33 1.79 -1.06 -1.96 116.57 119.32 3dfp h LYS 207 Ca 0.14 -0.27 -0.01 0.00 -2.18 0.00 0.00 60.65 58.34 3dfp h LYS 207 Cb 0.03 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.57 3dfp h LYS 207 CO -0.02 0.93 -0.07 0.28 -1.08 0.00 0.00 179.45 179.49 3dfp h VAL 208 N 0.90 0.97 -0.80 0.50 2.07 -0.97 -2.18 116.25 116.75 3dfp h VAL 208 Ca 0.18 -0.49 0.01 0.00 0.82 0.00 0.00 66.70 67.23 3dfp h VAL 208 Cb 0.42 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 3dfp h VAL 208 CO 0.01 0.12 0.53 -0.07 0.02 0.00 0.00 177.57 178.17 3dfp h LEU 209 N -0.42 0.90 -0.82 2.57 3.38 -1.24 -0.01 115.31 119.67 3dfp h LEU 209 Ca -0.02 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3dfp h LEU 209 Cb 0.33 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 3dfp h LEU 209 CO 0.03 0.64 0.51 0.00 0.09 0.00 0.00 178.44 179.71 3dfp h ALA 210 N 1.51 1.04 -0.31 1.53 0.00 -1.24 -1.04 119.26 120.76 3dfp h ALA 210 Ca 0.30 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 3dfp h ALA 210 Cb -0.08 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 3dfp h ALA 210 CO -0.07 0.49 -0.34 0.00 0.00 0.00 0.00 179.25 179.33 3dfp h ALA 211 N 1.27 0.82 0.03 0.00 0.00 -0.62 -2.68 119.26 118.08 3dfp h ALA 211 Ca 0.29 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3dfp h ALA 211 Cb -0.07 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3dfp h ALA 211 CO -0.06 0.64 -0.01 0.28 0.00 0.00 0.00 179.25 180.10 3dfp h VAL 212 N 0.58 1.10 0.00 0.00 2.07 -0.43 -2.12 116.25 117.45 3dfp h VAL 212 Ca 0.06 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 3dfp h VAL 212 Cb 0.86 1.36 -0.00 0.00 -1.52 0.00 0.00 31.29 31.98 3dfp h VAL 212 CO 0.07 0.10 -0.14 1.88 0.02 0.00 0.00 177.57 179.51 3dfp h TYR 213 N -0.21 0.00 -0.06 1.57 0.05 -1.22 -0.93 116.97 116.17 3dfp h TYR 213 Ca -0.00 0.00 -0.20 0.00 0.05 0.00 0.00 58.73 58.58 3dfp h TYR 213 Cb 0.19 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.93 3dfp h TYR 213 CO -0.02 0.14 -0.81 -0.22 -1.05 0.00 0.00 178.16 176.20 3dfp h LYS 214 N 0.00 0.43 -0.17 4.88 1.63 -1.36 -2.33 116.57 119.65 3dfp h LYS 214 Ca -0.00 -0.39 -0.18 0.00 -0.85 0.00 0.00 60.65 59.24 3dfp h LYS 214 Cb 0.64 0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.36 3dfp h LYS 214 CO 0.02 1.03 -0.62 0.00 -3.45 0.00 0.00 179.45 176.44 3dfp h ALA 215 N 0.84 0.61 -0.46 5.00 0.00 -0.89 -1.78 119.26 122.59 3dfp h ALA 215 Ca -0.05 -0.54 -0.06 0.00 0.00 0.00 0.00 54.91 54.26 3dfp h ALA 215 Cb 1.41 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 3dfp h ALA 215 CO 0.14 0.70 0.04 -0.07 0.00 0.00 0.00 179.25 180.07 3dfp h LEU 216 N 0.42 0.69 -0.25 0.00 3.38 -1.14 -2.07 115.31 116.34 3dfp h LEU 216 Ca -0.01 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 3dfp h LEU 216 Cb 1.18 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 3dfp h LEU 216 CO 0.12 0.73 -0.09 -1.28 0.09 0.00 0.00 178.44 178.01 3dfp h SER 217 N 0.69 0.51 -0.26 -0.43 0.87 -1.23 -0.73 113.55 112.97 3dfp h SER 217 Ca 0.14 -0.39 0.01 0.00 -1.23 0.00 0.00 61.79 60.33 3dfp h SER 217 Cb 0.37 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 3dfp h SER 217 CO 0.01 0.78 0.17 0.44 -0.53 0.00 0.00 176.83 177.70 3dfp h ASP 218 N 0.24 0.26 -0.49 6.23 3.32 -1.05 -1.70 116.42 123.22 3dfp h ASP 218 Ca 0.06 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3dfp h ASP 218 Cb 0.57 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.06 3dfp h ASP 218 CO 0.03 0.18 0.00 1.41 -1.72 0.00 0.00 179.24 179.14 3dfp n HIS 219 N -4.50 1.01 -3.70 4.55 8.25 -0.80 -4.95 115.22 115.07 3dfp n HIS 219 Ca 0.01 -0.42 -0.27 0.00 -0.26 0.00 0.00 57.72 56.79 3dfp n HIS 219 Cb 0.11 -0.15 0.06 0.00 1.12 0.00 0.00 29.99 31.13 3dfp n HIS 219 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3dfp n HIS 220 N 0.83 -2.61 -2.59 4.41 8.25 -0.64 -4.90 115.22 117.98 3dfp n HIS 220 Ca 0.19 0.95 -0.40 0.00 -0.26 0.00 0.00 57.72 58.19 3dfp n HIS 220 Cb 0.63 -4.56 -0.05 0.00 1.12 0.00 0.00 29.99 27.13 3dfp n HIS 220 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3dfp s ILE 221 N -3.30 3.82 -0.79 1.59 -1.09 -0.31 -4.93 121.20 116.19 3dfp s ILE 221 Ca 0.61 1.76 -0.22 0.00 -2.23 0.00 0.00 60.65 60.57 3dfp s ILE 221 Cb -0.29 -4.12 0.09 0.00 -1.58 0.00 0.00 42.46 36.56 3dfp s ILE 221 CO 0.75 0.39 1.09 -0.47 -1.23 0.00 0.00 174.94 175.47 3dfp s TYR 222 N -0.92 2.78 0.26 3.97 5.04 -1.26 -4.84 117.35 122.38 3dfp s TYR 222 Ca 0.44 -0.83 -0.02 0.00 -2.44 0.00 0.00 57.07 54.23 3dfp s TYR 222 Cb -0.29 -4.35 0.47 0.00 0.35 0.00 0.00 41.96 38.14 3dfp s TYR 222 CO 0.36 -1.66 1.82 -0.07 -1.34 0.00 0.00 175.55 174.66 3dfp h LEU 223 N 11.31 0.77 -2.97 6.97 3.38 -1.94 -1.04 115.31 131.80 3dfp h LEU 223 Ca -0.09 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3dfp h LEU 223 Cb 1.05 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 3dfp h LEU 223 CO 1.19 0.42 0.01 -0.33 0.09 0.00 0.00 178.44 179.82 3dfp h GLU 224 N 0.87 0.00 -0.87 1.13 3.07 -1.90 -1.50 114.58 115.37 3dfp h GLU 224 Ca 0.44 0.00 -0.51 0.00 -0.50 0.00 0.00 59.36 58.79 3dfp h GLU 224 Cb 0.43 0.00 -0.28 0.00 -0.84 0.00 0.00 28.75 28.06 3dfp h GLU 224 CO -0.26 0.00 0.50 0.41 -1.40 0.00 0.00 179.01 178.26 3dfp n GLY 225 N -1.09 5.10 3.31 -3.84 0.00 -0.39 -4.43 105.19 103.85 3dfp n GLY 225 Ca -0.03 -1.57 -0.13 0.00 0.00 0.00 0.00 46.02 44.28 3dfp n GLY 225 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dfp s THR 226 N -3.83 0.00 0.06 2.61 -4.23 -0.56 -4.15 115.64 105.54 3dfp s THR 226 Ca 0.57 -1.87 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 3dfp s THR 226 Cb 0.47 -2.47 -0.04 0.00 1.34 0.00 0.00 72.50 71.81 3dfp s THR 226 CO 0.05 0.00 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.32 3dfp s LEU 227 N -3.19 2.44 -0.11 4.79 1.43 -1.14 -3.80 118.68 119.10 3dfp s LEU 227 Ca 0.36 -0.88 0.02 0.00 -1.03 0.00 0.00 54.13 52.60 3dfp s LEU 227 Cb 0.04 0.05 -0.01 0.00 0.03 0.00 0.00 46.19 46.30 3dfp s LEU 227 CO 0.16 -0.47 -0.18 -0.22 0.23 0.00 0.00 176.35 175.87 3dfp s LEU 228 N -2.60 2.42 -0.55 1.79 2.96 -0.42 -1.21 118.68 121.06 3dfp s LEU 228 Ca 0.03 -0.42 0.04 0.00 -0.22 0.00 0.00 54.13 53.56 3dfp s LEU 228 Cb 0.02 -1.51 0.14 0.00 0.50 0.00 0.00 46.19 45.34 3dfp s LEU 228 CO -0.06 0.18 0.31 -0.75 -1.32 0.00 0.00 176.35 174.71 3dfp s LYS 229 N 0.23 2.01 0.46 1.98 2.20 0.25 -0.32 119.74 126.56 3dfp s LYS 229 Ca -0.12 -2.72 0.08 0.00 -0.36 0.00 0.00 55.97 52.85 3dfp s LYS 229 Cb -0.16 -3.24 0.02 0.00 -1.51 0.00 0.00 37.83 32.93 3dfp s LYS 229 CO 0.06 -1.15 0.51 -1.25 -0.36 0.00 0.00 175.35 173.16 3dfp s PRO 230 N -0.48 2.53 0.45 4.03 0.04 -1.26 -3.68 135.00 136.64 3dfp s PRO 230 Ca 0.19 -1.54 -0.14 0.00 0.04 0.00 0.00 61.00 59.54 3dfp s PRO 230 Cb -0.21 -2.49 -0.07 0.00 0.04 0.00 0.00 34.50 31.76 3dfp s PRO 230 CO -0.04 -0.40 0.88 0.54 0.04 0.00 0.00 177.00 178.03 3dfp s ASN 231 N -4.31 6.61 0.79 6.66 4.22 -1.26 -2.43 114.94 125.21 3dfp s ASN 231 Ca 0.51 1.38 -0.12 0.00 -2.14 0.00 0.00 52.86 52.49 3dfp s ASN 231 Cb -0.05 -2.43 0.07 0.00 1.28 0.00 0.00 41.25 40.12 3dfp s ASN 231 CO 0.30 -0.48 1.11 -0.04 -2.04 0.00 0.00 177.10 175.95 3dfp s MET 232 N -3.87 2.13 -0.34 3.55 -1.94 -1.26 -4.95 119.30 112.61 3dfp s MET 232 Ca 0.56 0.54 -0.19 0.00 -1.71 0.00 0.00 55.69 54.88 3dfp s MET 232 Cb -0.10 -1.93 -0.00 0.00 2.01 0.00 0.00 34.83 34.80 3dfp s MET 232 CO 0.30 -1.56 0.56 0.08 -0.01 0.00 0.00 175.02 174.38 3dfp s VAL 233 N -3.23 4.97 0.21 -6.03 1.01 -1.26 -5.03 120.40 111.04 3dfp s VAL 233 Ca 0.61 0.51 -0.07 0.00 0.00 0.00 0.00 61.98 63.03 3dfp s VAL 233 Cb -0.14 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 3dfp s VAL 233 CO 0.53 -0.22 0.29 0.42 0.00 0.00 0.00 175.10 176.12 3dfp s THR 234 N 2.51 0.01 0.72 3.92 -4.23 -1.26 -4.56 115.64 112.75 3dfp s THR 234 Ca 0.21 -1.68 -0.11 0.00 -1.18 0.00 0.00 61.69 58.93 3dfp s THR 234 Cb -0.15 -2.27 0.02 0.00 1.34 0.00 0.00 72.50 71.44 3dfp s THR 234 CO 0.13 -0.06 1.08 -2.16 -0.54 0.00 0.00 174.62 173.08 3dfp s PRO 235 N -4.07 2.76 0.80 3.99 0.04 -1.26 -4.60 135.00 132.66 3dfp s PRO 235 Ca 0.29 0.60 -0.12 0.00 0.04 0.00 0.00 61.00 61.81 3dfp s PRO 235 Cb 0.03 -2.00 0.07 0.00 0.04 0.00 0.00 34.50 32.65 3dfp s PRO 235 CO 0.09 -1.13 1.13 0.20 0.04 0.00 0.00 177.00 177.32 3dfp s GLY 236 N -4.16 1.84 0.54 0.56 0.00 -0.03 -4.90 107.32 101.17 3dfp s GLY 236 Ca 0.58 0.49 0.22 0.00 0.00 0.00 0.00 44.72 46.02 3dfp s GLY 236 CO 0.53 0.87 2.10 0.45 0.00 0.00 0.00 173.10 177.05 3dfp h HIS 237 N -1.09 0.00 -0.67 1.90 3.86 -0.43 -1.98 115.15 116.74 3dfp h HIS 237 Ca -0.44 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.77 3dfp h HIS 237 Cb 1.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.72 3dfp h HIS 237 CO 0.54 0.00 0.00 0.00 0.86 0.00 0.00 177.93 179.33 3dfp n ALA 238 N -2.52 2.99 -2.28 2.45 0.00 0.11 -4.96 120.51 116.29 3dfp n ALA 238 Ca 0.02 -1.56 -0.42 0.00 0.00 0.00 0.00 53.44 51.48 3dfp n ALA 238 Cb 0.29 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 3dfp n ALA 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dfp n THR 240 N 3.58 0.46 -3.07 0.00 -2.24 -1.26 -4.84 114.28 106.92 3dfp n THR 240 Ca 0.08 -0.25 -0.37 0.00 -2.27 0.00 0.00 64.05 61.24 3dfp n THR 240 Cb 0.45 -0.40 -0.06 0.00 -2.10 0.00 0.00 70.33 68.22 3dfp n THR 240 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3dfp s GLN 241 N -3.11 4.33 -0.00 -0.78 0.74 -1.26 -5.07 119.66 114.50 3dfp s GLN 241 Ca 0.09 0.94 -0.00 0.00 0.05 0.00 0.00 55.36 56.44 3dfp s GLN 241 Cb 0.13 -2.96 -0.04 0.00 1.10 0.00 0.00 33.01 31.24 3dfp s GLN 241 CO 0.64 0.43 0.09 0.15 -0.55 0.00 0.00 175.29 176.05 3dfp s LYS 242 N -1.79 3.08 0.11 1.67 -0.14 -1.26 -5.03 119.74 116.38 3dfp s LYS 242 Ca 0.41 -0.48 0.03 0.00 -1.36 0.00 0.00 55.97 54.58 3dfp s LYS 242 Cb -0.18 -2.87 -0.04 0.00 -1.68 0.00 0.00 37.83 33.06 3dfp s LYS 242 CO 0.22 0.65 -0.09 0.71 -0.76 0.00 0.00 175.35 176.07 3dfp s TYR 243 N -1.21 1.07 0.50 3.18 1.51 -1.26 -5.16 117.35 115.99 3dfp s TYR 243 Ca 0.23 -0.74 0.01 0.00 -1.01 0.00 0.00 57.07 55.57 3dfp s TYR 243 Cb -0.12 -0.58 0.02 0.00 -0.11 0.00 0.00 41.96 41.17 3dfp s TYR 243 CO 0.14 -0.01 0.72 -1.54 -1.11 0.00 0.00 175.55 173.76 3dfp s SER 244 N -2.75 5.53 0.40 2.29 1.04 -1.26 -4.97 113.70 113.98 3dfp s SER 244 Ca 0.10 0.11 0.12 0.00 0.48 0.00 0.00 55.95 56.75 3dfp s SER 244 Cb 0.00 -1.16 0.84 0.00 0.10 0.00 0.00 66.02 65.80 3dfp s SER 244 CO -0.01 -0.94 1.92 0.45 0.98 0.00 0.00 173.24 175.64 3dfp h HIS 245 N 0.23 0.12 -0.45 5.02 3.86 -1.99 -2.04 115.15 119.89 3dfp h HIS 245 Ca -0.44 -0.01 -0.08 0.00 -1.16 0.00 0.00 60.37 58.68 3dfp h HIS 245 Cb 1.28 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 29.69 3dfp h HIS 245 CO 0.41 0.31 -0.05 0.93 0.86 0.00 0.00 177.93 180.39 3dfp h GLU 246 N 0.10 0.77 -0.18 2.45 3.07 -1.94 -0.16 114.58 118.70 3dfp h GLU 246 Ca 0.02 -0.23 -0.18 0.00 -0.50 0.00 0.00 59.36 58.47 3dfp h GLU 246 Cb 0.42 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.25 3dfp h GLU 246 CO 0.03 0.81 -0.62 0.93 -1.40 0.00 0.00 179.01 178.76 3dfp h GLU 247 N 0.71 0.62 -0.63 2.33 5.08 -1.80 -0.63 114.58 120.26 3dfp h GLU 247 Ca 0.13 -0.43 -0.08 0.00 -1.00 0.00 0.00 59.36 57.98 3dfp h GLU 247 Cb 0.51 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 3dfp h GLU 247 CO 0.03 1.04 0.07 0.82 -1.00 0.00 0.00 179.01 179.97 3dfp h ILE 248 N 0.46 1.26 -0.34 3.13 2.04 -1.18 -1.55 117.51 121.33 3dfp h ILE 248 Ca -0.01 -1.06 -0.05 0.00 1.00 0.00 0.00 64.86 64.74 3dfp h ILE 248 Cb 1.19 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 3dfp h ILE 248 CO 0.12 0.39 0.04 0.00 0.00 0.00 0.00 178.15 178.70 3dfp h ALA 249 N 1.02 0.46 -0.57 1.87 0.00 -0.87 -1.86 119.26 119.31 3dfp h ALA 249 Ca 0.19 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3dfp h ALA 249 Cb 0.48 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3dfp h ALA 249 CO 0.02 0.18 0.08 1.98 0.00 0.00 0.00 179.25 181.51 3dfp h MET 250 N 0.41 0.94 -0.48 0.00 1.85 -0.98 -1.09 114.93 115.58 3dfp h MET 250 Ca 0.10 -0.26 -0.10 0.00 -0.61 0.00 0.00 59.70 58.83 3dfp h MET 250 Cb 0.39 -0.11 -0.02 0.00 0.43 0.00 0.00 31.60 32.29 3dfp h MET 250 CO 0.01 0.91 -0.11 0.00 -0.40 0.00 0.00 176.91 177.32 3dfp h ALA 251 N 1.00 0.89 0.05 0.39 0.00 -1.26 -1.53 119.26 118.80 3dfp h ALA 251 Ca 0.17 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3dfp h ALA 251 Cb 0.43 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3dfp h ALA 251 CO 0.01 0.64 -0.02 1.15 0.00 0.00 0.00 179.25 181.02 3dfp h THR 252 N 0.80 1.18 -0.26 0.00 2.02 -1.16 -2.22 112.91 113.27 3dfp h THR 252 Ca 0.13 -0.76 -0.08 0.00 0.77 0.00 0.00 66.41 66.47 3dfp h THR 252 Cb 0.63 1.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.71 3dfp h THR 252 CO 0.04 0.19 -0.17 0.58 0.37 0.00 0.00 175.52 176.54 3dfp h VAL 253 N -0.41 1.24 -0.27 3.16 2.07 -1.21 -2.37 116.25 118.46 3dfp h VAL 253 Ca -0.01 -1.07 -0.08 0.00 0.82 0.00 0.00 66.70 66.36 3dfp h VAL 253 Cb 0.37 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3dfp h VAL 253 CO 0.01 0.35 -0.14 0.74 0.02 0.00 0.00 177.57 178.55 3dfp h THR 254 N 0.42 1.30 -0.46 2.57 2.02 -1.29 -1.61 112.91 115.85 3dfp h THR 254 Ca 0.07 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 66.03 3dfp h THR 254 Cb 0.53 1.52 -0.02 0.00 -1.74 0.00 0.00 68.15 68.44 3dfp h THR 254 CO 0.03 0.39 0.29 0.00 0.37 0.00 0.00 175.52 176.61 3dfp h ALA 255 N 0.74 0.58 -0.42 6.16 0.00 -1.23 -2.45 119.26 122.64 3dfp h ALA 255 Ca 0.06 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3dfp h ALA 255 Cb 0.65 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3dfp h ALA 255 CO 0.04 0.05 0.06 -0.07 0.00 0.00 0.00 179.25 179.33 3dfp h LEU 256 N 0.62 0.68 -2.02 0.00 3.38 -1.42 -2.90 115.31 113.65 3dfp h LEU 256 Ca 0.17 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 57.91 3dfp h LEU 256 Cb -0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3dfp h LEU 256 CO -0.03 0.77 0.10 0.03 0.09 0.00 0.00 178.44 179.39 3dfp h ARG 257 N 0.56 0.00 -0.01 1.13 3.08 -1.08 0.86 114.38 118.92 3dfp h ARG 257 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 3dfp h ARG 257 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 3dfp h ARG 257 CO 0.01 0.00 -0.14 0.54 -1.07 0.00 0.00 179.97 179.31 3dfp n ARG 258 N -4.47 0.85 0.00 0.04 1.74 -0.94 -4.55 116.66 109.33 3dfp n ARG 258 Ca 0.00 -0.39 0.00 0.00 -0.77 0.00 0.00 57.85 56.70 3dfp n ARG 258 Cb 0.22 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 3dfp n ARG 258 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3dfp n THR 259 N -0.74 0.00 -3.06 0.55 -2.24 -0.81 -5.01 114.28 102.96 3dfp n THR 259 Ca 0.15 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.51 3dfp n THR 259 Cb 0.30 -0.03 -0.06 0.00 -2.10 0.00 0.00 70.33 68.44 3dfp n THR 259 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3dfp s VAL 260 N -0.96 4.84 0.43 2.28 1.01 0.23 -4.80 120.40 123.43 3dfp s VAL 260 Ca 0.00 0.66 -0.26 0.00 0.00 0.00 0.00 61.98 62.38 3dfp s VAL 260 Cb 0.00 -4.12 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 3dfp s VAL 260 CO 0.00 -0.36 1.35 -2.65 0.00 0.00 0.00 175.10 173.44 3dfp n PRO 261 N 6.17 2.11 0.08 2.72 -0.02 -1.26 -4.84 135.00 139.95 3dfp n PRO 261 Ca 0.00 0.75 0.19 0.00 -2.02 0.00 0.00 63.50 62.42 3dfp n PRO 261 Cb 0.48 -2.50 0.73 0.00 -0.02 0.00 0.00 33.50 32.20 3dfp n PRO 261 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3dfp h PRO 262 N 2.24 0.00 0.00 0.52 0.11 -1.96 -1.84 132.00 131.06 3dfp h PRO 262 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3dfp h PRO 262 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3dfp h PRO 262 CO 0.61 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.40 3dfp h ALA 263 N 1.70 1.00 -2.35 -0.75 0.00 -1.92 -3.43 119.26 113.51 3dfp h ALA 263 Ca 0.19 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.56 3dfp h ALA 263 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3dfp h ALA 263 CO -0.00 0.00 0.99 0.08 0.00 0.00 0.00 179.25 180.31 3dfp s VAL 264 N -3.77 3.46 0.34 0.00 1.01 -0.69 -3.23 120.40 117.51 3dfp s VAL 264 Ca -0.01 0.76 0.01 0.00 0.00 0.00 0.00 61.98 62.74 3dfp s VAL 264 Cb 0.10 -3.49 0.26 0.00 0.00 0.00 0.00 36.38 33.25 3dfp s VAL 264 CO 0.42 -0.03 2.00 0.74 0.00 0.00 0.00 175.10 178.23 3dfp h THR 265 N 5.15 1.17 -1.91 3.92 2.02 -1.69 -3.44 112.91 118.13 3dfp h THR 265 Ca -0.40 -0.33 0.18 0.00 0.77 0.00 0.00 66.41 66.64 3dfp h THR 265 Cb 1.18 0.20 -0.16 0.00 -1.74 0.00 0.00 68.15 67.63 3dfp h THR 265 CO 0.93 0.17 0.64 -0.83 0.37 0.00 0.00 175.52 176.81 3dfp s GLY 266 N -3.45 -0.38 -0.19 2.16 0.00 -1.26 -3.76 107.32 100.44 3dfp s GLY 266 Ca -0.10 1.20 0.01 0.00 0.00 0.00 0.00 44.72 45.83 3dfp s GLY 266 CO 0.77 0.39 -0.18 0.14 0.00 0.00 0.00 173.10 174.23 3dfp s VAL 267 N -2.80 2.20 -0.44 1.40 1.01 -0.25 -1.31 120.40 120.21 3dfp s VAL 267 Ca 0.08 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.07 3dfp s VAL 267 Cb -0.01 -1.97 0.12 0.00 0.00 0.00 0.00 36.38 34.52 3dfp s VAL 267 CO -0.06 0.47 0.23 0.42 0.00 0.00 0.00 175.10 176.15 3dfp s THR 268 N 1.29 3.20 0.30 3.92 -4.23 0.57 -0.93 115.64 119.75 3dfp s THR 268 Ca 0.04 -2.31 -0.30 0.00 -1.18 0.00 0.00 61.69 57.95 3dfp s THR 268 Cb -0.14 -3.19 -0.11 0.00 1.34 0.00 0.00 72.50 70.40 3dfp s THR 268 CO -0.11 -0.72 1.53 -0.36 -0.54 0.00 0.00 174.62 174.42 3dfp s PHE 269 N 0.84 2.81 0.24 3.99 0.08 -0.75 -4.17 117.98 121.02 3dfp s PHE 269 Ca 0.10 0.93 -0.17 0.00 0.12 0.00 0.00 56.93 57.92 3dfp s PHE 269 Cb -0.22 -3.98 -0.08 0.00 -0.57 0.00 0.00 43.02 38.17 3dfp s PHE 269 CO -0.04 -3.19 0.69 -0.48 -0.10 0.00 0.00 175.22 172.10 3dfp s LEU 270 N -0.77 4.24 0.38 -0.37 0.05 -1.02 -2.03 118.68 119.16 3dfp s LEU 270 Ca 0.60 1.29 0.21 0.00 0.05 0.00 0.00 54.13 56.28 3dfp s LEU 270 Cb -0.46 -3.71 0.51 0.00 -2.05 0.00 0.00 46.19 40.49 3dfp s LEU 270 CO 0.49 -0.04 1.65 0.77 -0.55 0.00 0.00 176.35 178.67 3dfp h SER 271 N 3.00 0.00 -6.13 1.48 4.64 -1.92 -3.41 113.55 111.21 3dfp h SER 271 Ca -0.48 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.38 3dfp h SER 271 Cb 1.19 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.16 3dfp h SER 271 CO 0.66 0.28 -0.71 0.61 -0.87 0.00 0.00 176.83 176.80 3dfp n GLY 272 N 0.72 -0.48 2.49 -0.77 0.00 -1.26 -1.31 105.19 104.59 3dfp n GLY 272 Ca 0.02 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3dfp n GLY 272 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dfp n GLY 273 N -1.37 0.99 3.72 -0.02 0.00 -1.26 -4.92 105.19 102.33 3dfp n GLY 273 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3dfp n GLY 273 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dfp s GLN 274 N -0.17 1.68 0.84 1.61 -0.21 -0.43 -4.99 119.66 117.98 3dfp s GLN 274 Ca 0.00 1.39 -0.12 0.00 0.02 0.00 0.00 55.36 56.65 3dfp s GLN 274 Cb 0.00 -1.81 0.09 0.00 1.00 0.00 0.00 33.01 32.29 3dfp s GLN 274 CO 0.00 -2.11 1.10 -1.54 -2.12 0.00 0.00 175.29 170.61 3dfp s SER 275 N -2.96 4.11 0.14 5.90 1.04 -1.26 -4.62 113.70 116.05 3dfp s SER 275 Ca 0.65 1.35 -0.19 0.00 0.48 0.00 0.00 55.95 58.24 3dfp s SER 275 Cb -0.20 -2.06 -0.00 0.00 0.10 0.00 0.00 66.02 63.85 3dfp s SER 275 CO 0.56 -2.22 1.71 -0.33 0.98 0.00 0.00 173.24 173.94 3dfp h GLU 276 N -1.26 0.05 -0.50 4.02 5.08 -1.86 -0.83 114.58 119.28 3dfp h GLU 276 Ca -0.48 -0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.78 3dfp h GLU 276 Cb 1.28 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.50 3dfp h GLU 276 CO 0.58 0.03 -0.08 1.49 -1.00 0.00 0.00 179.01 180.04 3dfp h GLU 277 N 0.05 0.93 -0.36 2.33 4.57 -1.92 -2.89 114.58 117.29 3dfp h GLU 277 Ca 0.12 -0.34 -0.03 0.00 -1.18 0.00 0.00 59.36 57.93 3dfp h GLU 277 Cb 0.16 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 3dfp h GLU 277 CO -0.21 0.99 0.09 1.49 -1.18 0.00 0.00 179.01 180.20 3dfp h GLU 278 N 0.79 0.58 0.00 1.92 4.81 -1.86 -1.48 114.58 119.33 3dfp h GLU 278 Ca 0.13 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 3dfp h GLU 278 Cb 0.62 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 3dfp h GLU 278 CO 0.04 0.61 -0.14 0.00 -0.73 0.00 0.00 179.01 178.79 3dfp h ALA 279 N 0.94 1.57 0.09 2.92 0.00 -1.17 -1.74 119.26 121.87 3dfp h ALA 279 Ca 0.11 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 3dfp h ALA 279 Cb 0.29 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.08 3dfp h ALA 279 CO -0.00 0.17 -0.75 0.77 0.00 0.00 0.00 179.25 179.45 3dfp h SER 280 N 0.00 0.51 -0.60 0.00 0.02 -1.27 -2.81 113.55 109.40 3dfp h SER 280 Ca -0.00 -0.87 -0.03 0.00 -0.84 0.00 0.00 61.79 60.04 3dfp h SER 280 Cb 0.28 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 3dfp h SER 280 CO 0.02 1.33 0.25 0.40 -1.14 0.00 0.00 176.83 177.69 3dfp h ILE 281 N -0.24 1.22 -0.56 3.27 2.04 -1.08 -1.83 117.51 120.34 3dfp h ILE 281 Ca -0.12 -0.68 -0.09 0.00 1.00 0.00 0.00 64.86 64.97 3dfp h ILE 281 Cb 1.52 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 3dfp h ILE 281 CO 0.14 0.27 0.00 0.78 0.00 0.00 0.00 178.15 179.34 3dfp h ASN 282 N 0.83 0.97 -0.11 1.72 2.35 -1.43 -1.54 115.58 118.36 3dfp h ASN 282 Ca 0.20 -0.31 -0.06 0.00 -0.55 0.00 0.00 56.30 55.59 3dfp h ASN 282 Cb 0.18 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 3dfp h ASN 282 CO -0.02 1.04 -0.08 0.25 -1.65 0.00 0.00 177.43 176.97 3dfp h LEU 283 N 0.87 0.39 -0.06 1.61 5.85 -1.33 -1.33 115.31 121.32 3dfp h LEU 283 Ca 0.16 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 3dfp h LEU 283 Cb 0.54 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 3dfp h LEU 283 CO 0.03 0.52 0.00 -1.13 -0.34 0.00 0.00 178.44 177.52 3dfp h ASN 284 N 0.39 0.09 -0.78 1.25 -1.24 -0.98 -2.41 115.58 111.91 3dfp h ASN 284 Ca 0.08 -0.29 -0.01 0.00 0.71 0.00 0.00 56.30 56.79 3dfp h ASN 284 Cb 0.39 -0.03 -0.04 0.00 0.73 0.00 0.00 38.32 39.38 3dfp h ASN 284 CO 0.02 0.36 0.47 0.00 -1.29 0.00 0.00 177.43 176.99 3dfp h ALA 285 N 0.74 1.34 -0.91 1.57 0.00 -1.03 -1.86 119.26 119.12 3dfp h ALA 285 Ca 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3dfp h ALA 285 Cb 0.31 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3dfp h ALA 285 CO 0.00 0.56 0.56 0.82 0.00 0.00 0.00 179.25 181.20 3dfp h ILE 286 N 1.08 1.25 0.00 0.00 2.04 -1.12 -0.96 117.51 119.79 3dfp h ILE 286 Ca 0.28 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.63 3dfp h ILE 286 Cb -0.03 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.00 3dfp h ILE 286 CO -0.05 0.25 0.00 0.59 0.00 0.00 0.00 178.15 178.94 3dfp n ASN 287 N -4.40 0.57 -0.19 1.72 3.02 -0.79 -2.99 115.26 112.19 3dfp n ASN 287 Ca 0.10 0.58 0.10 0.00 -0.03 0.00 0.00 54.58 55.33 3dfp n ASN 287 Cb 0.05 -0.72 -0.07 0.00 -0.61 0.00 0.00 39.78 38.42 3dfp n ASN 287 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3dfp n LYS 288 N -2.06 0.61 -1.70 3.52 5.02 -0.70 -4.76 118.16 118.10 3dfp n LYS 288 Ca 0.05 -0.39 -0.44 0.00 -2.02 0.00 0.00 58.31 55.51 3dfp n LYS 288 Cb 0.34 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.86 3dfp n LYS 288 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dfp h PRO 290 N 5.77 0.55 -6.50 0.00 0.11 -1.91 -3.45 132.00 126.57 3dfp h PRO 290 Ca -0.45 -0.03 -0.57 0.00 0.11 0.00 0.00 66.00 65.06 3dfp h PRO 290 Cb 1.23 -0.12 0.18 0.00 0.11 0.00 0.00 31.00 32.40 3dfp h PRO 290 CO 0.88 0.36 -0.53 1.28 -0.21 0.00 0.00 178.00 179.78 3dfp n LEU 291 N -4.91 0.10 -4.72 2.35 4.77 -1.26 -4.92 117.00 108.41 3dfp n LEU 291 Ca 0.17 0.64 -0.41 0.00 -0.03 0.00 0.00 56.01 56.38 3dfp n LEU 291 Cb 0.46 -1.14 -0.04 0.00 -2.33 0.00 0.00 43.42 40.36 3dfp n LEU 291 CO 0.20 -3.37 0.71 -0.22 -1.33 0.00 0.00 177.39 173.38 3dfp s LEU 292 N 1.01 4.44 -0.28 2.23 2.96 -1.26 -5.04 118.68 122.75 3dfp s LEU 292 Ca 0.65 1.82 0.02 0.00 -0.22 0.00 0.00 54.13 56.40 3dfp s LEU 292 Cb -0.40 -3.58 0.07 0.00 0.50 0.00 0.00 46.19 42.78 3dfp s LEU 292 CO 0.58 -0.19 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.83 3dfp s LYS 293 N 0.37 1.82 0.00 1.98 3.01 -1.26 -5.00 119.74 120.67 3dfp s LYS 293 Ca 0.50 -1.37 0.21 0.00 -1.01 0.00 0.00 55.97 54.30 3dfp s LYS 293 Cb -0.24 -2.84 1.27 0.00 -1.01 0.00 0.00 37.83 35.00 3dfp s LYS 293 CO 0.30 -0.69 1.65 -0.35 0.51 0.00 0.00 175.35 176.77 3dfp n PRO 294 N 4.47 0.66 -4.19 -1.68 -0.04 -1.26 -4.79 135.00 128.17 3dfp n PRO 294 Ca -0.09 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.22 3dfp n PRO 294 Cb 0.43 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.28 3dfp n PRO 294 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3dfp s TRP 295 N -2.00 1.17 0.39 0.54 0.51 -1.26 -4.93 118.94 113.35 3dfp s TRP 295 Ca 0.32 -0.60 -0.26 0.00 -2.12 0.00 0.00 56.10 53.43 3dfp s TRP 295 Cb 0.15 -0.63 -0.09 0.00 -0.81 0.00 0.00 33.47 32.08 3dfp s TRP 295 CO 0.25 0.05 1.31 0.00 -0.51 0.00 0.00 176.95 178.04 3dfp s ALA 296 N -2.22 3.31 -0.30 0.98 0.00 -1.25 -4.86 121.76 117.41 3dfp s ALA 296 Ca 0.05 1.25 0.03 0.00 0.00 0.00 0.00 51.96 53.30 3dfp s ALA 296 Cb -0.04 -3.49 0.08 0.00 0.00 0.00 0.00 23.12 19.67 3dfp s ALA 296 CO 0.01 -0.81 -0.02 -0.51 0.00 0.00 0.00 175.76 174.43 3dfp s LEU 297 N -2.33 4.11 0.00 0.00 1.43 -1.26 -1.09 118.68 119.54 3dfp s LEU 297 Ca 0.56 -1.80 0.00 0.00 -1.03 0.00 0.00 54.13 51.86 3dfp s LEU 297 Cb -0.39 -1.58 0.00 0.00 0.03 0.00 0.00 46.19 44.26 3dfp s LEU 297 CO 0.50 -0.29 0.00 1.07 0.23 0.00 0.00 176.35 177.86 3dfp n THR 298 N 4.34 0.00 -4.34 5.49 5.66 -0.11 -4.69 114.28 120.64 3dfp n THR 298 Ca -0.04 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.72 3dfp n THR 298 Cb 0.42 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.12 3dfp n THR 298 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 3dfp s PHE 299 N -0.43 2.56 -0.48 1.09 -0.71 -1.26 -1.81 117.98 116.93 3dfp s PHE 299 Ca 0.00 -0.34 0.06 0.00 -1.04 0.00 0.00 56.93 55.61 3dfp s PHE 299 Cb 0.00 -1.30 0.21 0.00 -1.21 0.00 0.00 43.02 40.72 3dfp s PHE 299 CO 0.00 0.56 0.71 0.45 -1.34 0.00 0.00 175.22 175.61 3dfp n SER 300 N -0.88 -2.44 -4.91 1.98 2.88 -0.86 -0.71 113.62 108.67 3dfp n SER 300 Ca -0.05 -2.97 -0.31 0.00 -1.33 0.00 0.00 58.87 54.21 3dfp n SER 300 Cb 0.61 1.20 -0.04 0.00 -0.75 0.00 0.00 64.21 65.23 3dfp n SER 300 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3dfp s TYR 301 N 0.45 3.50 0.00 0.66 2.02 -0.96 -4.29 117.35 118.74 3dfp s TYR 301 Ca 0.32 0.26 0.00 0.00 -0.37 0.00 0.00 57.07 57.28 3dfp s TYR 301 Cb 0.11 -1.76 0.00 0.00 -0.40 0.00 0.00 41.96 39.91 3dfp s TYR 301 CO -0.15 0.60 0.00 0.41 -1.57 0.00 0.00 175.55 174.84 3dfp n GLY 302 N 0.42 0.19 0.26 0.71 0.00 -1.26 -0.64 105.19 104.87 3dfp n GLY 302 Ca -0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.07 3dfp n GLY 302 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3dfp h ARG 303 N 0.00 0.00 0.00 1.61 3.08 -1.95 -1.15 114.38 115.96 3dfp h ARG 303 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dfp h ARG 303 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3dfp h ARG 303 CO 0.00 0.11 0.00 0.00 -1.07 0.00 0.00 179.97 179.01 3dfp n ALA 304 N -2.37 1.34 0.00 0.04 0.00 -1.26 -1.02 120.51 117.24 3dfp n ALA 304 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3dfp n ALA 304 Cb 0.20 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.53 3dfp n ALA 304 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dfp n LEU 305 N -1.50 0.00 -0.02 0.00 4.77 -0.49 -4.53 117.00 115.23 3dfp n LEU 305 Ca 0.02 -0.09 0.03 0.00 -0.03 0.00 0.00 56.01 55.93 3dfp n LEU 305 Cb 0.09 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.07 3dfp n LEU 305 CO 0.07 0.00 -0.74 0.00 -1.33 0.00 0.00 177.39 175.39 3dfp n GLN 306 N -1.38 0.90 -0.05 3.23 6.02 -0.87 -4.57 117.38 120.66 3dfp n GLN 306 Ca 0.00 -0.09 -0.01 0.00 -0.01 0.00 0.00 57.00 56.89 3dfp n GLN 306 Cb 0.00 -1.32 -0.01 0.00 1.02 0.00 0.00 30.24 29.93 3dfp n GLN 306 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dfp n ALA 307 N -2.12 -0.08 0.22 -1.58 0.00 -0.19 -0.56 120.51 116.19 3dfp n ALA 307 Ca -0.08 0.10 0.05 0.00 0.00 0.00 0.00 53.44 53.52 3dfp n ALA 307 Cb 0.52 0.30 0.51 0.00 0.00 0.00 0.00 19.45 20.79 3dfp n ALA 307 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3dfp h SER 308 N 0.00 0.03 -0.24 0.00 0.02 -1.87 -2.79 113.55 108.69 3dfp h SER 308 Ca 0.02 -0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.79 3dfp h SER 308 Cb 0.05 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3dfp h SER 308 CO -0.12 0.18 -0.53 0.00 -1.14 0.00 0.00 176.83 175.22 3dfp h ALA 309 N 1.83 0.39 -0.58 3.77 0.00 -1.29 -1.75 119.26 121.63 3dfp h ALA 309 Ca 0.00 -0.51 -0.05 0.00 0.00 0.00 0.00 54.91 54.36 3dfp h ALA 309 Cb 0.28 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3dfp h ALA 309 CO 0.02 0.59 0.17 1.25 0.00 0.00 0.00 179.25 181.28 3dfp h LEU 310 N 0.53 0.81 -0.17 0.00 5.85 -0.64 -2.01 115.31 119.68 3dfp h LEU 310 Ca 0.00 -0.14 -0.10 0.00 0.84 0.00 0.00 57.88 58.49 3dfp h LEU 310 Cb 1.14 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.96 3dfp h LEU 310 CO 0.12 0.77 -0.27 0.50 -0.34 0.00 0.00 178.44 179.22 3dfp h LYS 311 N 0.85 0.49 -0.07 1.25 3.64 -1.44 -1.85 116.57 119.44 3dfp h LYS 311 Ca 0.19 -0.30 -0.05 0.00 -1.27 0.00 0.00 60.65 59.22 3dfp h LYS 311 Cb 0.27 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 3dfp h LYS 311 CO -0.01 0.89 -0.21 0.00 -2.27 0.00 0.00 179.45 177.86 3dfp h ALA 312 N 0.59 1.53 0.11 5.00 0.00 -1.21 -3.09 119.26 122.19 3dfp h ALA 312 Ca 0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3dfp h ALA 312 Cb 0.85 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3dfp h ALA 312 CO 0.06 0.34 -0.05 2.35 0.00 0.00 0.00 179.25 181.95 3dfp h TRP 313 N 0.10 -0.13 -1.05 0.00 7.01 -1.30 -3.42 115.95 117.16 3dfp h TRP 313 Ca 0.02 -0.00 -0.21 0.00 2.11 0.00 0.00 58.89 60.80 3dfp h TRP 313 Cb 0.43 0.04 -0.08 0.00 -2.10 0.00 0.00 29.16 27.45 3dfp h TRP 313 CO 0.00 0.37 -0.19 0.41 -2.79 0.00 0.00 178.44 176.24 3dfp n GLY 314 N 0.57 0.98 1.84 2.65 0.00 -0.70 -0.61 105.19 109.92 3dfp n GLY 314 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3dfp n GLY 314 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dfp n GLY 315 N -0.04 2.04 3.64 -0.02 0.00 -1.26 -4.86 105.19 104.68 3dfp n GLY 315 Ca -0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 3dfp n GLY 315 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dfp s LYS 316 N -0.43 4.04 0.60 1.61 -0.14 0.22 -4.90 119.74 120.74 3dfp s LYS 316 Ca 0.00 1.10 0.35 0.00 -1.36 0.00 0.00 55.97 56.07 3dfp s LYS 316 Cb 0.00 -3.76 1.92 0.00 -1.68 0.00 0.00 37.83 34.31 3dfp s LYS 316 CO 0.00 -0.94 2.23 0.87 -0.76 0.00 0.00 175.35 176.75 3dfp h LYS 317 N 8.29 0.00 0.00 1.68 1.57 -1.95 -0.34 116.57 125.81 3dfp h LYS 317 Ca -0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 3dfp h LYS 317 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 3dfp h LYS 317 CO 1.03 0.03 0.00 0.39 -0.57 0.00 0.00 179.45 180.33 3dfp n GLU 318 N -3.43 0.21 -0.08 3.15 4.71 -1.26 -2.54 120.64 121.40 3dfp n GLU 318 Ca -0.02 0.36 0.12 0.00 -0.01 0.00 0.00 57.16 57.60 3dfp n GLU 318 Cb 0.14 -1.84 0.32 0.00 -1.01 0.00 0.00 31.44 29.05 3dfp n GLU 318 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3dfp n ASN 319 N -2.23 2.28 -0.35 1.62 5.03 -0.14 -4.59 115.26 116.89 3dfp n ASN 319 Ca 0.03 -1.78 -0.09 0.00 0.87 0.00 0.00 54.58 53.61 3dfp n ASN 319 Cb 0.29 -0.11 -0.08 0.00 -1.02 0.00 0.00 39.78 38.86 3dfp n ASN 319 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 3dfp n LEU 320 N 0.74 -0.88 -0.03 3.41 7.94 -1.05 -0.60 117.00 126.54 3dfp n LEU 320 Ca 0.17 1.64 -0.08 0.00 -1.11 0.00 0.00 56.01 56.63 3dfp n LEU 320 Cb 0.44 -0.28 -0.02 0.00 0.53 0.00 0.00 43.42 44.10 3dfp n LEU 320 CO 0.15 -1.28 0.77 0.11 -1.11 0.00 0.00 177.39 176.02 3dfp h LYS 321 N 0.00 -0.13 -0.71 1.96 1.79 -1.87 -0.56 116.57 117.05 3dfp h LYS 321 Ca 0.13 0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.64 3dfp h LYS 321 Cb 0.34 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 30.98 3dfp h LYS 321 CO -0.78 -0.09 0.45 0.00 -1.08 0.00 0.00 179.45 177.96 3dfp h ALA 322 N 0.99 0.92 -0.34 3.86 0.00 -1.66 -1.55 119.26 121.49 3dfp h ALA 322 Ca 0.11 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3dfp h ALA 322 Cb 0.31 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3dfp h ALA 322 CO -0.28 0.24 0.09 0.00 0.00 0.00 0.00 179.25 179.31 3dfp h ALA 323 N 1.30 0.45 -0.34 0.00 0.00 -0.43 -2.88 119.26 117.35 3dfp h ALA 323 Ca 0.28 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3dfp h ALA 323 Cb -0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3dfp h ALA 323 CO -0.10 0.11 0.04 1.96 0.00 0.00 0.00 179.25 181.26 3dfp h GLN 324 N 0.40 0.50 -0.77 0.00 4.20 -0.86 -2.52 115.11 116.06 3dfp h GLN 324 Ca 0.11 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 3dfp h GLN 324 Cb 0.28 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 3dfp h GLN 324 CO -0.00 0.50 0.47 1.49 -0.67 0.00 0.00 178.83 180.62 3dfp h GLU 325 N 0.49 1.04 -0.11 1.46 4.57 -1.07 -0.16 114.58 120.80 3dfp h GLU 325 Ca 0.11 -0.09 -0.01 0.00 -1.18 0.00 0.00 59.36 58.19 3dfp h GLU 325 Cb 0.25 -0.22 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 3dfp h GLU 325 CO 0.00 0.73 0.02 0.93 -1.18 0.00 0.00 179.01 179.51 3dfp h GLU 326 N 1.06 0.19 -0.80 1.92 4.39 -1.34 -2.19 114.58 117.81 3dfp h GLU 326 Ca 0.28 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.94 3dfp h GLU 326 Cb -0.05 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.54 3dfp h GLU 326 CO -0.05 0.40 0.52 -0.92 -1.16 0.00 0.00 179.01 177.80 3dfp h TYR 327 N -0.04 0.98 -0.70 4.33 3.20 -1.32 -2.25 116.97 121.17 3dfp h TYR 327 Ca 0.03 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 3dfp h TYR 327 Cb 0.30 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 3dfp h TYR 327 CO 0.02 0.60 0.40 0.28 -1.64 0.00 0.00 178.16 177.81 3dfp h VAL 328 N 1.05 1.20 -0.23 1.81 2.07 -0.90 -2.00 116.25 119.25 3dfp h VAL 328 Ca 0.31 -0.49 -0.10 0.00 0.82 0.00 0.00 66.70 67.24 3dfp h VAL 328 Cb -0.07 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 29.94 3dfp h VAL 328 CO -0.09 0.22 -0.27 0.11 0.02 0.00 0.00 177.57 177.56 3dfp h LYS 329 N 0.97 0.45 0.00 1.57 1.57 -0.81 -1.53 116.57 118.78 3dfp h LYS 329 Ca 0.25 -0.17 -0.16 0.00 -1.87 0.00 0.00 60.65 58.69 3dfp h LYS 329 Cb 0.00 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 3dfp h LYS 329 CO -0.04 0.69 -0.76 0.00 -0.57 0.00 0.00 179.45 178.76 3dfp h ARG 330 N 0.40 0.00 -0.25 3.15 2.47 -1.11 -1.50 114.38 117.53 3dfp h ARG 330 Ca 0.06 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.71 3dfp h ARG 330 Cb 0.69 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.00 3dfp h ARG 330 CO 0.05 0.76 -0.11 0.00 0.56 0.00 0.00 179.97 181.23 3dfp h ALA 331 N 1.24 0.35 -0.60 0.04 0.00 -1.16 -1.13 119.26 118.00 3dfp h ALA 331 Ca -0.01 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.53 3dfp h ALA 331 Cb 1.46 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 3dfp h ALA 331 CO 0.10 0.20 0.11 -0.07 0.00 0.00 0.00 179.25 179.59 3dfp h LEU 332 N 0.25 0.94 -0.46 0.00 3.38 -1.25 -1.32 115.31 116.83 3dfp h LEU 332 Ca 0.06 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 3dfp h LEU 332 Cb 0.61 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3dfp h LEU 332 CO 0.03 0.95 0.23 0.00 0.09 0.00 0.00 178.44 179.75 3dfp h ALA 333 N 1.02 0.60 0.00 1.53 0.00 -1.15 -2.47 119.26 118.78 3dfp h ALA 333 Ca 0.18 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 3dfp h ALA 333 Cb 0.41 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3dfp h ALA 333 CO 0.01 0.14 -0.42 -0.91 0.00 0.00 0.00 179.25 178.07 3dfp h ASN 334 N 0.61 0.00 -0.48 0.00 2.35 -1.12 -1.40 115.58 115.55 3dfp h ASN 334 Ca 0.16 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.82 3dfp h ASN 334 Cb 0.09 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 3dfp h ASN 334 CO -0.02 0.42 -0.05 -1.28 -1.65 0.00 0.00 177.43 174.85 3dfp h SER 335 N 0.00 0.90 0.32 5.81 0.87 -0.99 -0.33 113.55 120.13 3dfp h SER 335 Ca -0.00 -0.26 -0.18 0.00 -1.23 0.00 0.00 61.79 60.12 3dfp h SER 335 Cb 1.06 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.77 3dfp h SER 335 CO 0.05 0.99 -0.73 -0.07 -0.53 0.00 0.00 176.83 176.54 3dfp h LEU 336 N 0.84 0.41 -0.10 2.23 3.38 -1.26 -3.29 115.31 117.53 3dfp h LEU 336 Ca 0.15 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 3dfp h LEU 336 Cb 0.56 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 3dfp h LEU 336 CO 0.03 1.01 0.05 0.00 0.09 0.00 0.00 178.44 179.62 3dfp h ALA 337 N 0.98 0.13 0.00 1.53 0.00 -0.66 -0.00 119.26 121.24 3dfp h ALA 337 Ca -0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3dfp h ALA 337 Cb 1.30 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3dfp h ALA 337 CO 0.12 -0.34 0.00 0.00 0.00 0.00 0.00 179.25 179.03 3dfp n GLN 339 N -0.68 3.14 -2.49 0.00 6.02 -0.75 -4.70 117.38 117.93 3dfp n GLN 339 Ca 0.04 -0.18 -0.08 0.00 -0.01 0.00 0.00 57.00 56.77 3dfp n GLN 339 Cb 0.02 -0.63 0.01 0.00 1.02 0.00 0.00 30.24 30.65 3dfp n GLN 339 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dfp n GLY 340 N 0.50 0.22 0.52 1.08 0.00 0.15 -4.95 105.19 102.71 3dfp n GLY 340 Ca 0.00 -0.46 0.06 0.00 0.00 0.00 0.00 46.02 45.61 3dfp n GLY 340 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dfp n LYS 341 N -1.92 0.86 -3.84 1.61 5.02 -0.11 -4.91 118.16 114.87 3dfp n LYS 341 Ca -0.05 -2.30 -0.36 0.00 -2.02 0.00 0.00 58.31 53.58 3dfp n LYS 341 Cb 0.55 -1.07 -0.06 0.00 -0.02 0.00 0.00 35.03 34.44 3dfp n LYS 341 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3dfp s TYR 342 N -1.86 3.59 -0.25 2.13 5.04 -1.24 -4.85 117.35 119.92 3dfp s TYR 342 Ca 0.26 0.53 -0.02 0.00 -2.44 0.00 0.00 57.07 55.40 3dfp s TYR 342 Cb 0.25 -1.94 0.14 0.00 0.35 0.00 0.00 41.96 40.76 3dfp s TYR 342 CO -0.03 0.69 0.39 0.95 -1.34 0.00 0.00 175.55 176.21 3dfp s THR 343 N -1.15 -0.63 0.37 4.34 -4.23 -1.26 -4.99 115.64 108.09 3dfp s THR 343 Ca 0.21 -0.08 0.19 0.00 -1.18 0.00 0.00 61.69 60.83 3dfp s THR 343 Cb -0.13 -0.84 0.37 0.00 1.34 0.00 0.00 72.50 73.24 3dfp s THR 343 CO 0.10 -0.13 1.64 -0.65 -0.54 0.00 0.00 174.62 175.05 3dfp h PRO 344 N 8.17 0.21 0.00 3.99 0.11 -1.99 -3.54 132.00 138.94 3dfp h PRO 344 Ca -0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.91 3dfp h PRO 344 Cb 1.15 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3dfp h PRO 344 CO 0.27 0.14 0.00 0.45 -0.21 0.00 0.00 178.00 178.65 3dfp n SER 345 N -5.01 0.00 -2.69 -2.05 2.88 -1.26 -5.27 113.62 100.22 3dfp n SER 345 Ca 0.34 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.54 3dfp n SER 345 Cb 1.13 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 64.51 3dfp n SER 345 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3dfp n SER 359 N -0.18 0.37 0.00 -3.46 2.88 -1.26 -5.31 113.62 106.66 3dfp n SER 359 Ca 0.00 0.32 0.10 0.00 -1.33 0.00 0.00 58.87 57.96 3dfp n SER 359 Cb 0.00 -0.56 0.47 0.00 -0.75 0.00 0.00 64.21 63.36 3dfp n SER 359 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3dfp n ASN 360 N 5.27 0.00 0.00 -3.46 6.94 -1.26 -2.31 115.26 120.44 3dfp n ASN 360 Ca 0.36 0.41 0.11 0.00 -0.02 0.00 0.00 54.58 55.44 3dfp n ASN 360 Cb -0.01 -0.46 0.51 0.00 -2.36 0.00 0.00 39.78 37.46 3dfp n ASN 360 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 3dfp n HIS 361 N -1.46 0.00 1.65 -2.53 8.25 -1.26 -2.29 115.22 117.58 3dfp n HIS 361 Ca 0.06 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.67 3dfp n HIS 361 Cb 0.23 -0.40 0.77 0.00 1.12 0.00 0.00 29.99 31.71 3dfp n HIS 361 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dfp n ALA 362 N -1.40 2.65 0.50 -1.41 0.00 -0.98 -5.31 120.51 114.56 3dfp n ALA 362 Ca 0.08 -0.23 0.06 0.00 0.00 0.00 0.00 53.44 53.35 3dfp n ALA 362 Cb 0.22 -1.43 0.05 0.00 0.00 0.00 0.00 19.45 18.29 3dfp n ALA 362 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16