#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pl4 s HIS 2 N 0.00 3.35 0.11 2.13 3.76 -1.26 -5.07 115.29 118.31 1pl4 s HIS 2 Ca 0.00 1.67 0.08 0.00 -0.15 0.00 0.00 55.06 56.65 1pl4 s HIS 2 Cb 0.00 -3.04 -0.04 0.00 1.11 0.00 0.00 32.58 30.62 1pl4 s HIS 2 CO 0.00 -0.38 -0.20 -1.12 -0.85 0.00 0.00 174.74 172.19 1pl4 s SER 3 N -1.69 2.45 -0.07 1.40 0.01 -1.26 -4.93 113.70 109.61 1pl4 s SER 3 Ca 0.57 -0.71 -0.30 0.00 1.31 0.00 0.00 55.95 56.83 1pl4 s SER 3 Cb -0.19 -0.13 -0.06 0.00 0.21 0.00 0.00 66.02 65.85 1pl4 s SER 3 CO 0.24 0.02 1.75 -0.22 0.41 0.00 0.00 173.24 175.45 1pl4 s LEU 4 N -2.03 4.23 0.59 2.44 2.96 -1.26 -4.97 118.68 120.64 1pl4 s LEU 4 Ca 0.07 2.22 -0.18 0.00 -0.22 0.00 0.00 54.13 56.02 1pl4 s LEU 4 Cb -0.09 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.03 1pl4 s LEU 4 CO 0.04 -1.07 1.15 -2.16 -1.32 0.00 0.00 176.35 172.99 1pl4 s PRO 5 N 4.37 3.05 0.47 0.98 0.04 -1.26 -5.00 135.00 137.66 1pl4 s PRO 5 Ca 0.78 1.62 -0.22 0.00 0.04 0.00 0.00 61.00 63.22 1pl4 s PRO 5 Cb -0.34 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.16 1pl4 s PRO 5 CO 0.32 -1.10 1.12 -0.51 0.04 0.00 0.00 177.00 176.88 1pl4 s ASP 6 N -1.93 6.22 0.54 6.66 1.01 -1.26 -5.03 116.67 122.87 1pl4 s ASP 6 Ca 0.73 2.18 -0.19 0.00 0.71 0.00 0.00 52.55 55.97 1pl4 s ASP 6 Cb -0.25 -2.59 -0.06 0.00 1.01 0.00 0.00 42.92 41.03 1pl4 s ASP 6 CO 0.33 -0.88 1.10 -0.76 0.21 0.00 0.00 175.17 175.17 1pl4 s LEU 7 N -3.16 3.74 0.00 1.23 1.43 -1.26 -4.95 118.68 115.71 1pl4 s LEU 7 Ca 0.65 2.07 0.22 0.00 -1.03 0.00 0.00 54.13 56.03 1pl4 s LEU 7 Cb -0.25 -4.57 1.11 0.00 0.03 0.00 0.00 46.19 42.51 1pl4 s LEU 7 CO 0.30 -1.11 1.69 -2.65 0.23 0.00 0.00 176.35 174.81 1pl4 n PRO 8 N -1.31 0.35 -4.05 1.29 -0.02 -1.26 -4.86 135.00 125.13 1pl4 n PRO 8 Ca 0.11 0.07 -0.12 0.00 -2.02 0.00 0.00 63.50 61.54 1pl4 n PRO 8 Cb 0.52 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.45 1pl4 n PRO 8 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1pl4 s TYR 9 N -2.51 0.77 0.66 6.00 -0.85 -1.26 -5.08 117.35 115.07 1pl4 s TYR 9 Ca 0.22 -1.07 -0.11 0.00 -0.52 0.00 0.00 57.07 55.58 1pl4 s TYR 9 Cb 0.14 0.03 -0.01 0.00 0.38 0.00 0.00 41.96 42.50 1pl4 s TYR 9 CO 0.32 -1.07 1.05 -0.51 -1.52 0.00 0.00 175.55 173.82 1pl4 s ASP 10 N -3.14 5.74 0.62 -0.18 -0.00 -1.26 -4.94 116.67 113.50 1pl4 s ASP 10 Ca 0.27 1.56 0.31 0.00 -0.00 0.00 0.00 52.55 54.70 1pl4 s ASP 10 Cb -0.00 -2.49 1.75 0.00 -0.00 0.00 0.00 42.92 42.18 1pl4 s ASP 10 CO 0.15 -1.20 2.08 1.88 -0.00 0.00 0.00 175.17 178.07 1pl4 h TYR 11 N -0.44 0.00 -0.49 4.23 0.05 -1.96 -0.95 116.97 117.41 1pl4 h TYR 11 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.34 1pl4 h TYR 11 Cb 1.20 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.94 1pl4 h TYR 11 CO 0.63 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 178.15 1pl4 n GLY 12 N -1.32 1.96 0.25 3.88 0.00 -1.26 -4.03 105.19 104.66 1pl4 n GLY 12 Ca 0.01 -0.75 0.14 0.00 0.00 0.00 0.00 46.02 45.41 1pl4 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pl4 h ALA 13 N 4.41 1.02 -0.61 4.61 0.00 -1.52 -2.78 119.26 124.38 1pl4 h ALA 13 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1pl4 h ALA 13 Cb 0.99 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1pl4 h ALA 13 CO 0.00 0.14 0.00 1.28 0.00 0.00 0.00 179.25 180.67 1pl4 n LEU 14 N -3.25 3.66 -4.75 0.00 4.77 -1.26 -4.44 117.00 111.72 1pl4 n LEU 14 Ca 0.00 -1.76 -0.38 0.00 -0.03 0.00 0.00 56.01 53.84 1pl4 n LEU 14 Cb 0.37 -0.41 0.05 0.00 -2.33 0.00 0.00 43.42 41.10 1pl4 n LEU 14 CO 0.30 0.88 0.99 -1.61 -1.33 0.00 0.00 177.39 176.62 1pl4 s GLU 15 N -1.19 3.05 -0.03 3.23 0.41 -1.05 -1.30 118.70 121.81 1pl4 s GLU 15 Ca 0.45 2.24 0.11 0.00 -0.41 0.00 0.00 54.97 57.36 1pl4 s GLU 15 Cb 0.24 -2.21 0.36 0.00 -1.78 0.00 0.00 34.13 30.74 1pl4 s GLU 15 CO 0.32 -1.27 1.25 -0.35 -0.49 0.00 0.00 175.26 174.72 1pl4 n PRO 16 N -1.15 2.16 0.02 0.39 -0.04 -1.26 -4.88 135.00 130.23 1pl4 n PRO 16 Ca 0.11 -1.43 -0.18 0.00 -0.04 0.00 0.00 63.50 61.96 1pl4 n PRO 16 Cb 0.45 -1.44 -0.13 0.00 -0.04 0.00 0.00 33.50 32.34 1pl4 n PRO 16 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1pl4 h HIS 17 N 2.19 0.56 -3.16 0.54 3.86 -1.56 -3.41 115.15 114.17 1pl4 h HIS 17 Ca 0.00 -0.35 -0.56 0.00 -1.16 0.00 0.00 60.37 58.30 1pl4 h HIS 17 Cb 0.69 -0.05 -0.37 0.00 1.06 0.00 0.00 27.41 28.75 1pl4 h HIS 17 CO 0.33 1.20 -0.82 0.42 0.86 0.00 0.00 177.93 179.93 1pl4 s ILE 18 N -2.87 1.27 0.95 2.45 1.01 -0.70 -4.81 121.20 118.51 1pl4 s ILE 18 Ca -0.14 -0.46 -0.13 0.00 0.00 0.00 0.00 60.65 59.92 1pl4 s ILE 18 Cb 0.02 -1.25 0.16 0.00 0.01 0.00 0.00 42.46 41.40 1pl4 s ILE 18 CO 0.82 0.39 1.15 0.54 0.00 0.00 0.00 174.94 177.85 1pl4 s ASN 19 N 1.61 3.18 0.23 3.58 2.20 -1.26 -3.37 114.94 121.11 1pl4 s ASN 19 Ca 0.05 0.86 -0.03 0.00 -0.94 0.00 0.00 52.86 52.79 1pl4 s ASN 19 Cb -0.13 -1.34 0.24 0.00 -2.00 0.00 0.00 41.25 38.02 1pl4 s ASN 19 CO -0.09 -2.74 1.68 0.00 -2.94 0.00 0.00 177.10 173.00 1pl4 h ALA 20 N -1.63 0.97 -0.43 3.54 0.00 -1.91 -2.43 119.26 117.37 1pl4 h ALA 20 Ca -0.49 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.03 1pl4 h ALA 20 Cb 1.32 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1pl4 h ALA 20 CO 0.56 0.61 0.04 0.37 0.00 0.00 0.00 179.25 180.83 1pl4 h GLN 21 N 0.71 0.73 -0.02 0.00 4.15 -1.92 0.14 115.11 118.89 1pl4 h GLN 21 Ca 0.12 -0.21 0.01 0.00 0.77 0.00 0.00 58.65 59.33 1pl4 h GLN 21 Cb 0.62 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.22 1pl4 h GLN 21 CO 0.04 0.78 -0.03 0.82 -1.93 0.00 0.00 178.83 178.51 1pl4 h ILE 22 N 0.58 0.92 -0.54 2.39 2.04 -1.90 -1.76 117.51 119.24 1pl4 h ILE 22 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.99 1pl4 h ILE 22 Cb 0.42 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 1pl4 h ILE 22 CO 0.01 0.00 0.35 0.24 0.00 0.00 0.00 178.15 178.75 1pl4 h MET 23 N -0.04 0.72 -0.19 2.37 2.86 -1.17 0.17 114.93 119.64 1pl4 h MET 23 Ca 0.02 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1pl4 h MET 23 Cb 0.07 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1pl4 h MET 23 CO -0.05 0.49 0.11 0.37 1.06 0.00 0.00 176.91 178.89 1pl4 h GLN 24 N 0.73 0.26 -0.50 1.72 4.15 -0.58 -1.52 115.11 119.37 1pl4 h GLN 24 Ca 0.20 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.54 1pl4 h GLN 24 Cb -0.06 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.56 1pl4 h GLN 24 CO -0.04 0.24 0.13 -0.07 -1.93 0.00 0.00 178.83 177.16 1pl4 h LEU 25 N 0.21 0.76 -0.58 -2.39 3.38 -1.12 0.20 115.31 115.77 1pl4 h LEU 25 Ca 0.07 -0.23 0.03 0.00 0.09 0.00 0.00 57.88 57.84 1pl4 h LEU 25 Cb 0.06 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 1pl4 h LEU 25 CO -0.01 0.79 0.34 -0.74 0.09 0.00 0.00 178.44 178.91 1pl4 h HIS 26 N 0.70 0.63 0.00 1.13 2.76 -0.70 -0.50 115.15 119.17 1pl4 h HIS 26 Ca 0.16 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 1pl4 h HIS 26 Cb 0.32 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 29.08 1pl4 h HIS 26 CO 0.02 0.35 -0.22 1.25 -1.30 0.00 0.00 177.93 178.04 1pl4 h HIS 27 N 0.67 0.00 0.00 5.26 -0.00 -1.24 -0.17 115.15 119.67 1pl4 h HIS 27 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.61 1pl4 h HIS 27 Cb 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.46 1pl4 h HIS 27 CO -0.07 0.64 -0.38 0.66 -0.00 0.00 0.00 177.93 178.79 1pl4 h SER 28 N -1.00 0.00 0.00 3.26 4.64 -0.96 -3.06 113.55 116.42 1pl4 h SER 28 Ca -0.05 -0.11 -0.08 0.00 -0.47 0.00 0.00 61.79 61.08 1pl4 h SER 28 Cb 0.66 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.74 1pl4 h SER 28 CO -0.03 0.05 -1.01 0.29 -0.87 0.00 0.00 176.83 175.26 1pl4 n LYS 29 N -2.27 0.16 0.12 4.77 4.76 -0.31 -4.50 118.16 120.89 1pl4 n LYS 29 Ca 0.04 0.07 -0.13 0.00 -2.87 0.00 0.00 58.31 55.42 1pl4 n LYS 29 Cb 0.45 -0.78 -0.08 0.00 -1.84 0.00 0.00 35.03 32.78 1pl4 n LYS 29 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1pl4 h HIS 30 N -0.29 -0.32 -0.20 2.13 2.76 -1.17 -2.21 115.15 115.86 1pl4 h HIS 30 Ca -0.13 -0.01 -0.15 0.00 -2.20 0.00 0.00 60.37 57.88 1pl4 h HIS 30 Cb 0.85 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.90 1pl4 h HIS 30 CO -0.06 0.04 -0.51 1.25 -1.30 0.00 0.00 177.93 177.35 1pl4 h HIS 31 N -0.76 0.67 -0.94 5.26 -0.00 -1.10 -2.66 115.15 115.62 1pl4 h HIS 31 Ca -0.04 -0.23 0.13 0.00 -0.00 0.00 0.00 60.37 60.24 1pl4 h HIS 31 Cb 0.50 -0.13 -0.09 0.00 -0.00 0.00 0.00 27.41 27.69 1pl4 h HIS 31 CO 0.04 0.94 0.56 0.00 -0.00 0.00 0.00 177.93 179.47 1pl4 h ALA 32 N 1.02 1.44 -0.44 5.26 0.00 -1.52 -1.39 119.26 123.63 1pl4 h ALA 32 Ca 0.02 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1pl4 h ALA 32 Cb 1.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1pl4 h ALA 32 CO 0.10 0.10 -0.15 0.00 0.00 0.00 0.00 179.25 179.30 1pl4 h ALA 33 N 1.55 0.91 -0.47 0.00 0.00 -1.06 -0.82 119.26 119.36 1pl4 h ALA 33 Ca 0.49 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1pl4 h ALA 33 Cb 0.56 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1pl4 h ALA 33 CO -0.30 0.63 0.29 1.88 0.00 0.00 0.00 179.25 181.75 1pl4 h TYR 34 N 0.73 0.55 -0.00 0.00 0.05 -1.00 0.01 116.97 117.31 1pl4 h TYR 34 Ca 0.11 0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.92 1pl4 h TYR 34 Cb 0.66 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 38.21 1pl4 h TYR 34 CO 0.04 0.32 -0.04 0.28 -1.05 0.00 0.00 178.16 177.71 1pl4 h VAL 35 N 0.59 0.90 -0.34 -2.88 2.07 -0.95 0.25 116.25 115.89 1pl4 h VAL 35 Ca 0.18 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.71 1pl4 h VAL 35 Cb -0.01 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 1pl4 h VAL 35 CO -0.07 0.00 0.22 0.78 0.02 0.00 0.00 177.57 178.52 1pl4 h ASN 36 N -0.07 0.40 0.62 0.57 2.35 -1.00 -1.04 115.58 117.40 1pl4 h ASN 36 Ca 0.02 -0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.64 1pl4 h ASN 36 Cb 0.09 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1pl4 h ASN 36 CO -0.04 0.31 -0.48 0.78 -1.65 0.00 0.00 177.43 176.35 1pl4 h ASN 37 N 0.45 0.00 -0.23 5.81 -0.26 -0.83 -2.76 115.58 117.76 1pl4 h ASN 37 Ca 0.12 0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.76 1pl4 h ASN 37 Cb -0.03 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.22 1pl4 h ASN 37 CO -0.03 0.48 -0.20 0.25 -1.06 0.00 0.00 177.43 176.87 1pl4 h LEU 38 N 0.00 0.68 -0.49 1.61 5.85 0.07 -1.35 115.31 121.68 1pl4 h LEU 38 Ca -0.00 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 1pl4 h LEU 38 Cb 0.91 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 1pl4 h LEU 38 CO 0.06 0.88 0.20 0.78 -0.34 0.00 0.00 178.44 180.02 1pl4 h ASN 39 N 0.60 0.67 -0.20 1.25 2.35 -0.99 0.75 115.58 120.00 1pl4 h ASN 39 Ca 0.09 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 1pl4 h ASN 39 Cb 0.67 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1pl4 h ASN 39 CO 0.05 0.64 0.10 0.58 -1.65 0.00 0.00 177.43 177.15 1pl4 h VAL 40 N 0.65 1.13 -0.36 2.81 2.07 -1.36 -2.47 116.25 118.72 1pl4 h VAL 40 Ca 0.16 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1pl4 h VAL 40 Cb 0.18 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1pl4 h VAL 40 CO -0.01 0.12 0.22 0.74 0.02 0.00 0.00 177.57 178.66 1pl4 h THR 41 N 0.20 1.11 -0.95 2.57 2.02 -0.99 -1.20 112.91 115.68 1pl4 h THR 41 Ca 0.07 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 67.02 1pl4 h THR 41 Cb 0.10 0.64 -0.05 0.00 -1.74 0.00 0.00 68.15 67.10 1pl4 h THR 41 CO -0.01 0.11 0.63 -0.33 0.37 0.00 0.00 175.52 176.29 1pl4 h GLU 42 N 0.47 1.21 -0.28 6.66 5.08 -0.81 -0.21 114.58 126.70 1pl4 h GLU 42 Ca 0.13 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1pl4 h GLU 42 Cb -0.01 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 28.96 1pl4 h GLU 42 CO -0.02 0.80 0.16 1.49 -1.00 0.00 0.00 179.01 180.44 1pl4 h GLU 43 N 1.25 0.39 -0.18 2.33 4.81 -0.99 -0.24 114.58 121.96 1pl4 h GLU 43 Ca 0.36 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.48 1pl4 h GLU 43 Cb -0.08 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1pl4 h GLU 43 CO -0.10 0.32 -0.21 0.87 -0.73 0.00 0.00 179.01 179.17 1pl4 h LYS 44 N 0.34 0.31 -0.21 1.92 1.79 -0.82 -2.19 116.57 117.71 1pl4 h LYS 44 Ca 0.10 -0.10 -0.19 0.00 -2.18 0.00 0.00 60.65 58.28 1pl4 h LYS 44 Cb 0.04 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 1pl4 h LYS 44 CO -0.02 0.51 -0.64 -0.92 -1.08 0.00 0.00 179.45 177.31 1pl4 h TYR 45 N 0.28 0.97 -0.81 -1.35 5.03 -0.63 -1.21 116.97 119.25 1pl4 h TYR 45 Ca 0.05 -0.38 0.12 0.00 2.58 0.00 0.00 58.73 61.09 1pl4 h TYR 45 Cb 0.54 -0.17 -0.08 0.00 1.55 0.00 0.00 36.73 38.57 1pl4 h TYR 45 CO 0.01 1.19 0.43 0.37 -1.32 0.00 0.00 178.16 178.83 1pl4 h GLN 46 N 0.55 0.65 -0.60 1.82 5.75 -0.72 0.21 115.11 122.77 1pl4 h GLN 46 Ca -0.01 -0.04 -0.06 0.00 -0.15 0.00 0.00 58.65 58.39 1pl4 h GLN 46 Cb 1.24 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 29.62 1pl4 h GLN 46 CO 0.13 0.43 0.14 0.93 -2.65 0.00 0.00 178.83 177.81 1pl4 h GLU 47 N 0.67 0.96 -0.39 1.69 5.08 -0.99 -1.79 114.58 119.80 1pl4 h GLU 47 Ca 0.41 -0.23 -0.06 0.00 -1.00 0.00 0.00 59.36 58.48 1pl4 h GLU 47 Cb 0.48 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1pl4 h GLU 47 CO -0.30 0.88 -0.00 0.00 -1.00 0.00 0.00 179.01 178.59 1pl4 h ALA 48 N 1.03 0.53 -0.73 3.43 0.00 -0.17 -2.75 119.26 120.61 1pl4 h ALA 48 Ca 0.19 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1pl4 h ALA 48 Cb 0.36 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1pl4 h ALA 48 CO 0.00 0.31 0.25 1.25 0.00 0.00 0.00 179.25 181.06 1pl4 h LEU 49 N 0.52 1.03 -1.29 0.00 5.85 -0.41 0.98 115.31 122.00 1pl4 h LEU 49 Ca 0.11 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 1pl4 h LEU 49 Cb 0.48 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 1pl4 h LEU 49 CO 0.02 0.94 0.09 0.00 -0.34 0.00 0.00 178.44 179.16 1pl4 h ALA 50 N 1.20 1.43 -0.01 1.25 0.00 -1.19 0.29 119.26 122.23 1pl4 h ALA 50 Ca 0.24 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1pl4 h ALA 50 Cb 0.27 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1pl4 h ALA 50 CO -0.01 0.41 -0.06 1.63 0.00 0.00 0.00 179.25 181.22 1pl4 n LYS 51 N -4.33 1.24 -3.05 0.00 5.02 -0.90 -4.93 118.16 111.21 1pl4 n LYS 51 Ca 0.02 -0.58 -0.22 0.00 -2.02 0.00 0.00 58.31 55.51 1pl4 n LYS 51 Cb 0.19 -1.49 0.02 0.00 -0.02 0.00 0.00 35.03 33.73 1pl4 n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pl4 n GLY 52 N 1.19 -0.51 3.49 0.72 0.00 0.09 -4.90 105.19 105.26 1pl4 n GLY 52 Ca 0.18 0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 1pl4 n GLY 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1pl4 s ASP 53 N -2.63 6.34 0.15 1.61 -1.08 0.21 -4.85 116.67 116.41 1pl4 s ASP 53 Ca 0.30 -1.23 -0.05 0.00 -0.52 0.00 0.00 52.55 51.05 1pl4 s ASP 53 Cb -0.14 -2.46 -0.03 0.00 -1.46 0.00 0.00 42.92 38.82 1pl4 s ASP 53 CO 0.37 -1.43 1.37 0.58 0.52 0.00 0.00 175.17 176.57 1pl4 h VAL 54 N 6.09 1.35 -0.37 1.11 2.07 -1.91 -2.24 116.25 122.35 1pl4 h VAL 54 Ca -0.10 -2.15 0.03 0.00 0.82 0.00 0.00 66.70 65.30 1pl4 h VAL 54 Cb 1.05 2.14 -0.03 0.00 -1.52 0.00 0.00 31.29 32.92 1pl4 h VAL 54 CO 1.22 0.66 0.16 0.74 0.02 0.00 0.00 177.57 180.37 1pl4 h THR 55 N 0.34 0.95 -0.53 2.57 2.02 -1.99 -0.69 112.91 115.58 1pl4 h THR 55 Ca -0.05 -0.12 -0.08 0.00 0.77 0.00 0.00 66.41 66.93 1pl4 h THR 55 Cb 1.39 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.36 1pl4 h THR 55 CO 0.14 0.06 0.01 0.00 0.37 0.00 0.00 175.52 176.11 1pl4 h ALA 56 N 1.21 1.01 -0.17 6.16 0.00 -1.93 -0.59 119.26 124.95 1pl4 h ALA 56 Ca 0.16 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1pl4 h ALA 56 Cb 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1pl4 h ALA 56 CO -0.13 0.61 0.10 1.96 0.00 0.00 0.00 179.25 181.79 1pl4 h GLN 57 N 0.83 0.24 -0.49 0.00 4.20 -1.05 -1.97 115.11 116.87 1pl4 h GLN 57 Ca 0.16 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.79 1pl4 h GLN 57 Cb 0.48 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 1pl4 h GLN 57 CO 0.02 0.20 0.06 0.82 -0.67 0.00 0.00 178.83 179.26 1pl4 h ILE 58 N 0.20 1.23 0.00 2.54 2.04 -0.82 -2.24 117.51 120.46 1pl4 h ILE 58 Ca 0.06 -0.89 -0.04 0.00 1.00 0.00 0.00 64.86 64.99 1pl4 h ILE 58 Cb 0.03 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1pl4 h ILE 58 CO -0.01 0.32 -0.20 0.00 0.00 0.00 0.00 178.15 178.26 1pl4 h ALA 59 N 1.33 1.14 0.00 1.87 0.00 -0.78 -1.94 119.26 120.88 1pl4 h ALA 59 Ca 0.15 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1pl4 h ALA 59 Cb 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1pl4 h ALA 59 CO 0.01 0.25 -0.25 1.28 0.00 0.00 0.00 179.25 180.53 1pl4 n LEU 60 N -3.53 0.44 -0.20 0.00 4.77 -0.77 -4.29 117.00 113.43 1pl4 n LEU 60 Ca -0.01 0.34 -0.07 0.00 -0.03 0.00 0.00 56.01 56.24 1pl4 n LEU 60 Cb 0.35 -0.33 0.03 0.00 -2.33 0.00 0.00 43.42 41.14 1pl4 n LEU 60 CO 0.32 -0.02 1.08 1.56 -1.33 0.00 0.00 177.39 179.01 1pl4 h GLN 61 N 0.00 0.78 -0.84 3.23 4.20 -1.06 -1.77 115.11 119.65 1pl4 h GLN 61 Ca 0.00 -0.07 0.06 0.00 0.06 0.00 0.00 58.65 58.70 1pl4 h GLN 61 Cb 0.60 -0.16 -0.06 0.00 0.30 0.00 0.00 27.48 28.16 1pl4 h GLN 61 CO 0.00 0.55 0.52 -1.35 -0.67 0.00 0.00 178.83 177.88 1pl4 h PRO 62 N 0.78 0.91 -0.09 1.46 0.11 -1.79 -0.11 132.00 133.27 1pl4 h PRO 62 Ca 0.21 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.14 1pl4 h PRO 62 Cb -0.03 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 30.87 1pl4 h PRO 62 CO -0.04 0.60 -0.49 0.00 -0.21 0.00 0.00 178.00 177.86 1pl4 h ALA 63 N 1.40 1.00 -0.05 -0.75 0.00 -1.76 -0.93 119.26 118.17 1pl4 h ALA 63 Ca 0.37 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1pl4 h ALA 63 Cb 0.17 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1pl4 h ALA 63 CO -0.17 0.65 -0.05 1.25 0.00 0.00 0.00 179.25 180.93 1pl4 h LEU 64 N 0.19 0.12 -0.60 0.00 7.12 -0.68 -1.53 115.31 119.93 1pl4 h LEU 64 Ca 0.01 -0.48 -0.04 0.00 0.13 0.00 0.00 57.88 57.50 1pl4 h LEU 64 Cb 0.94 -0.03 -0.03 0.00 -0.53 0.00 0.00 40.66 41.01 1pl4 h LEU 64 CO 0.08 0.58 0.23 0.50 -0.13 0.00 0.00 178.44 179.69 1pl4 h LYS 65 N -0.34 0.90 0.08 1.25 3.64 -0.97 0.17 116.57 121.30 1pl4 h LYS 65 Ca 0.01 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1pl4 h LYS 65 Cb 0.55 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1pl4 h LYS 65 CO 0.01 0.77 -0.04 0.35 -2.27 0.00 0.00 179.45 178.28 1pl4 h PHE 66 N 0.83 -0.10 -0.09 1.91 3.57 -1.18 0.24 116.94 122.12 1pl4 h PHE 66 Ca 0.20 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.59 1pl4 h PHE 66 Cb 0.22 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.00 1pl4 h PHE 66 CO 0.01 0.31 -0.36 -0.91 -2.23 0.00 0.00 178.31 175.13 1pl4 h ASN 67 N -0.54 0.47 -0.45 0.41 2.35 -1.32 -0.37 115.58 116.13 1pl4 h ASN 67 Ca -0.01 -0.63 -0.04 0.00 -0.55 0.00 0.00 56.30 55.06 1pl4 h ASN 67 Cb 0.45 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.67 1pl4 h ASN 67 CO 0.02 1.02 0.11 1.23 -1.65 0.00 0.00 177.43 178.16 1pl4 h GLY 68 N -0.05 0.78 0.53 2.83 0.00 -0.77 -0.40 103.07 105.98 1pl4 h GLY 68 Ca -0.02 -0.49 0.07 0.00 0.00 0.00 0.00 47.33 46.89 1pl4 h GLY 68 CO 0.08 0.45 0.15 -1.33 0.00 0.00 0.00 176.54 175.89 1pl4 h GLY 69 N 0.60 0.61 0.89 4.60 0.00 -0.56 -0.51 103.07 108.70 1pl4 h GLY 69 Ca 0.14 -0.08 0.02 0.00 0.00 0.00 0.00 47.33 47.42 1pl4 h GLY 69 CO 0.00 0.00 0.34 -1.33 0.00 0.00 0.00 176.54 175.55 1pl4 h GLY 70 N 0.32 0.79 0.98 4.60 0.00 -0.77 0.32 103.07 109.31 1pl4 h GLY 70 Ca 0.23 -0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 1pl4 h GLY 70 CO -0.24 0.22 0.13 0.84 0.00 0.00 0.00 176.54 177.49 1pl4 h HIS 71 N 0.68 0.28 -0.07 5.60 2.76 -0.70 -0.95 115.15 122.75 1pl4 h HIS 71 Ca 0.22 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.39 1pl4 h HIS 71 Cb 0.01 -0.09 -0.00 0.00 1.55 0.00 0.00 27.41 28.87 1pl4 h HIS 71 CO -0.06 0.21 0.04 0.82 -1.30 0.00 0.00 177.93 177.64 1pl4 h ILE 72 N 0.27 1.05 -0.36 6.26 2.04 -0.49 -1.65 117.51 124.62 1pl4 h ILE 72 Ca 0.08 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 1pl4 h ILE 72 Cb 0.01 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1pl4 h ILE 72 CO -0.01 0.04 -0.01 0.78 0.00 0.00 0.00 178.15 178.95 1pl4 h ASN 73 N 0.06 0.64 -0.16 1.72 2.35 -0.30 -2.45 115.58 117.44 1pl4 h ASN 73 Ca 0.02 -0.31 -0.15 0.00 -0.55 0.00 0.00 56.30 55.31 1pl4 h ASN 73 Cb 0.03 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 1pl4 h ASN 73 CO -0.00 0.80 -0.45 0.45 -1.65 0.00 0.00 177.43 176.57 1pl4 h HIS 74 N 0.46 0.87 -0.97 1.19 3.86 -1.17 -1.58 115.15 117.81 1pl4 h HIS 74 Ca 0.10 -0.27 0.07 0.00 -1.16 0.00 0.00 60.37 59.11 1pl4 h HIS 74 Cb 0.48 -0.18 -0.07 0.00 1.06 0.00 0.00 27.41 28.70 1pl4 h HIS 74 CO 0.04 1.03 0.62 0.77 0.86 0.00 0.00 177.93 181.25 1pl4 h SER 75 N 0.57 0.98 -0.05 2.45 0.02 -1.22 -2.10 113.55 114.20 1pl4 h SER 75 Ca 0.04 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1pl4 h SER 75 Cb 1.00 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.35 1pl4 h SER 75 CO 0.09 0.61 -0.03 0.40 -1.14 0.00 0.00 176.83 176.76 1pl4 h ILE 76 N 1.11 1.34 -0.69 3.27 2.04 -1.27 -3.28 117.51 120.03 1pl4 h ILE 76 Ca 0.43 -1.08 0.13 0.00 1.00 0.00 0.00 64.86 65.33 1pl4 h ILE 76 Cb 0.21 1.96 -0.09 0.00 -0.74 0.00 0.00 36.82 38.15 1pl4 h ILE 76 CO -0.18 0.30 0.24 0.15 0.00 0.00 0.00 178.15 178.65 1pl4 h PHE 77 N -0.29 0.40 -0.71 1.37 3.57 -0.95 -1.30 116.94 119.03 1pl4 h PHE 77 Ca 0.01 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 1pl4 h PHE 77 Cb 0.49 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 1pl4 h PHE 77 CO 0.08 0.04 0.29 -1.49 -2.23 0.00 0.00 178.31 175.00 1pl4 h TRP 78 N 0.39 1.06 0.00 0.41 -0.00 -1.46 -0.59 115.95 115.76 1pl4 h TRP 78 Ca 0.37 -0.07 0.00 0.00 -0.00 0.00 0.00 58.89 59.19 1pl4 h TRP 78 Cb 0.54 -0.32 0.00 0.00 -0.00 0.00 0.00 29.16 29.38 1pl4 h TRP 78 CO -0.19 0.80 0.00 1.79 -0.00 0.00 0.00 178.44 180.84 1pl4 h THR 79 N 1.03 0.00 -0.00 1.49 1.35 -1.34 -2.91 112.91 112.53 1pl4 h THR 79 Ca 0.24 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.73 1pl4 h THR 79 Cb 0.19 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.88 1pl4 h THR 79 CO -0.02 0.00 -0.05 0.59 -0.25 0.00 0.00 175.52 175.79 1pl4 n ASN 80 N -2.80 0.25 -4.38 5.36 5.03 -0.24 -4.71 115.26 113.76 1pl4 n ASN 80 Ca 0.01 -0.47 -0.23 0.00 0.87 0.00 0.00 54.58 54.75 1pl4 n ASN 80 Cb 0.26 -0.14 -0.11 0.00 -1.02 0.00 0.00 39.78 38.76 1pl4 n ASN 80 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1pl4 s LEU 81 N -2.45 2.48 -0.26 3.41 1.43 -1.10 0.62 118.68 122.82 1pl4 s LEU 81 Ca 0.31 -0.91 -0.26 0.00 -1.03 0.00 0.00 54.13 52.24 1pl4 s LEU 81 Cb 0.20 -0.95 0.10 0.00 0.03 0.00 0.00 46.19 45.57 1pl4 s LEU 81 CO 0.45 0.01 0.87 -0.55 0.23 0.00 0.00 176.35 177.36 1pl4 s SER 82 N -2.89 -0.60 0.57 2.29 0.15 0.69 -4.60 113.70 109.31 1pl4 s SER 82 Ca 0.20 1.10 0.36 0.00 0.70 0.00 0.00 55.95 58.31 1pl4 s SER 82 Cb -0.06 1.10 1.62 0.00 -1.71 0.00 0.00 66.02 66.97 1pl4 s SER 82 CO 0.09 -0.24 2.08 1.55 1.20 0.00 0.00 173.24 177.93 1pl4 h PRO 83 N 4.40 0.00 -0.67 5.44 0.13 -1.85 -1.59 132.00 137.86 1pl4 h PRO 83 Ca -0.28 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.77 1pl4 h PRO 83 Cb 1.17 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 1pl4 h PRO 83 CO 0.11 0.02 0.10 0.09 -0.23 0.00 0.00 178.00 178.09 1pl4 n ASN 84 N -3.14 5.22 0.00 1.44 3.02 -1.26 -4.99 115.26 115.55 1pl4 n ASN 84 Ca -0.00 -2.98 0.00 0.00 -0.03 0.00 0.00 54.58 51.56 1pl4 n ASN 84 Cb 0.25 -0.70 0.00 0.00 -0.61 0.00 0.00 39.78 38.72 1pl4 n ASN 84 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pl4 n GLY 85 N 0.33 1.91 3.43 7.41 0.00 -0.60 -5.00 105.19 112.67 1pl4 n GLY 85 Ca 0.31 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.34 1pl4 n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pl4 n GLY 86 N 5.00 -1.87 7.00 -0.02 0.00 0.67 -4.68 105.19 111.30 1pl4 n GLY 86 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1pl4 n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pl4 n GLY 87 N 0.00 -0.25 3.38 -0.02 0.00 -1.26 -4.76 105.19 102.29 1pl4 n GLY 87 Ca 0.00 -1.04 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 1pl4 n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pl4 s GLU 88 N 0.00 1.42 1.03 1.61 2.02 -1.26 -5.02 118.70 118.50 1pl4 s GLU 88 Ca 0.00 -1.49 -0.16 0.00 0.02 0.00 0.00 54.97 53.34 1pl4 s GLU 88 Cb 0.00 -1.60 0.21 0.00 0.10 0.00 0.00 34.13 32.84 1pl4 s GLU 88 CO 0.00 0.33 1.19 -1.25 0.02 0.00 0.00 175.26 175.55 1pl4 s PRO 89 N -2.79 0.16 0.39 0.39 0.04 -1.26 -5.00 135.00 126.93 1pl4 s PRO 89 Ca 0.19 -0.07 0.05 0.00 0.04 0.00 0.00 61.00 61.21 1pl4 s PRO 89 Cb -0.07 -1.76 -0.02 0.00 0.04 0.00 0.00 34.50 32.69 1pl4 s PRO 89 CO 0.09 -2.79 0.16 0.15 0.04 0.00 0.00 177.00 174.65 1pl4 s LYS 90 N -5.53 1.90 4.67 4.56 3.01 -1.26 -4.69 119.74 122.40 1pl4 s LYS 90 Ca 0.70 -2.15 0.00 0.00 -1.01 0.00 0.00 55.97 53.51 1pl4 s LYS 90 Cb -0.09 -0.39 0.00 0.00 -1.01 0.00 0.00 37.83 36.34 1pl4 s LYS 90 CO 0.54 -0.53 0.00 0.41 0.51 0.00 0.00 175.35 176.28 1pl4 n GLY 91 N -0.85 1.53 0.25 -3.33 0.00 -1.26 -2.98 105.19 98.54 1pl4 n GLY 91 Ca -0.03 -0.62 -0.00 0.00 0.00 0.00 0.00 46.02 45.36 1pl4 n GLY 91 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1pl4 h GLU 92 N 0.00 0.39 -0.50 1.61 5.08 -1.99 -1.46 114.58 117.72 1pl4 h GLU 92 Ca 0.00 -0.11 -0.11 0.00 -1.00 0.00 0.00 59.36 58.14 1pl4 h GLU 92 Cb 0.00 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1pl4 h GLU 92 CO 0.00 0.53 -0.15 1.25 -1.00 0.00 0.00 179.01 179.65 1pl4 h LEU 93 N 0.37 0.96 -0.59 1.33 5.85 -1.94 0.13 115.31 121.42 1pl4 h LEU 93 Ca 0.07 -0.33 -0.12 0.00 0.84 0.00 0.00 57.88 58.34 1pl4 h LEU 93 Cb 0.47 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1pl4 h LEU 93 CO 0.03 1.09 -0.19 0.25 -0.34 0.00 0.00 178.44 179.28 1pl4 h LEU 94 N 0.84 0.94 -0.83 2.25 5.85 -1.32 -1.21 115.31 121.84 1pl4 h LEU 94 Ca 0.13 -0.34 -0.12 0.00 0.84 0.00 0.00 57.88 58.39 1pl4 h LEU 94 Cb 0.70 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1pl4 h LEU 94 CO 0.05 1.10 -0.44 -0.33 -0.34 0.00 0.00 178.44 178.49 1pl4 h GLU 95 N 0.81 0.33 -0.75 1.25 4.39 -0.96 -1.98 114.58 117.66 1pl4 h GLU 95 Ca 0.11 -0.17 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 1pl4 h GLU 95 Cb 0.74 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.36 1pl4 h GLU 95 CO 0.06 0.71 0.33 0.00 -1.16 0.00 0.00 179.01 178.94 1pl4 h ALA 96 N 1.27 0.98 -0.62 3.43 0.00 -0.31 0.51 119.26 124.53 1pl4 h ALA 96 Ca 0.02 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1pl4 h ALA 96 Cb 0.88 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1pl4 h ALA 96 CO 0.07 0.57 0.13 0.82 0.00 0.00 0.00 179.25 180.85 1pl4 h ILE 97 N 1.07 1.26 -0.53 0.00 2.04 -1.00 0.04 117.51 120.38 1pl4 h ILE 97 Ca 0.25 -0.96 -0.08 0.00 1.00 0.00 0.00 64.86 65.08 1pl4 h ILE 97 Cb 0.18 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1pl4 h ILE 97 CO -0.03 0.36 0.02 0.11 0.00 0.00 0.00 178.15 178.61 1pl4 h LYS 98 N 0.92 0.89 -0.21 2.37 1.57 -1.09 0.33 116.57 121.35 1pl4 h LYS 98 Ca 0.19 -0.25 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1pl4 h LYS 98 Cb 0.39 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1pl4 h LYS 98 CO 0.01 0.88 0.04 -0.09 -0.57 0.00 0.00 179.45 179.71 1pl4 h ARG 99 N 0.83 0.34 0.05 3.15 2.43 -0.48 -1.33 114.38 119.37 1pl4 h ARG 99 Ca 0.16 -0.09 -0.30 0.00 -0.81 0.00 0.00 59.98 58.95 1pl4 h ARG 99 Cb 0.47 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 1pl4 h ARG 99 CO 0.02 0.48 -1.61 -0.44 -1.51 0.00 0.00 179.97 176.91 1pl4 h ASP 100 N 0.14 0.18 -0.00 -3.80 3.32 -0.93 -3.39 116.42 111.94 1pl4 h ASP 100 Ca 0.06 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.81 1pl4 h ASP 100 Cb 0.30 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1pl4 h ASP 100 CO 0.00 1.27 -0.00 0.49 -1.72 0.00 0.00 179.24 179.28 1pl4 n PHE 101 N -3.27 0.00 0.00 4.55 3.72 0.12 -5.02 117.46 117.55 1pl4 n PHE 101 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1pl4 n PHE 101 Cb 1.03 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.57 1pl4 n PHE 101 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pl4 n GLY 102 N 0.08 2.72 3.55 1.37 0.00 -0.50 -4.38 105.19 108.04 1pl4 n GLY 102 Ca 0.01 -0.69 -0.08 0.00 0.00 0.00 0.00 46.02 45.26 1pl4 n GLY 102 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pl4 s SER 103 N 0.00 -0.36 0.24 1.61 1.04 -1.26 -4.73 113.70 110.24 1pl4 s SER 103 Ca 0.00 -0.10 -0.06 0.00 0.48 0.00 0.00 55.95 56.27 1pl4 s SER 103 Cb 0.00 0.45 0.34 0.00 0.10 0.00 0.00 66.02 66.91 1pl4 s SER 103 CO 0.00 -0.76 1.82 0.15 0.98 0.00 0.00 173.24 175.43 1pl4 h PHE 104 N 2.00 0.85 -0.07 5.02 3.57 -1.91 -1.85 116.94 124.55 1pl4 h PHE 104 Ca -0.24 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.15 1pl4 h PHE 104 Cb 1.25 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 1pl4 h PHE 104 CO 0.28 0.39 -0.55 -0.44 -2.23 0.00 0.00 178.31 175.76 1pl4 h ASP 105 N 0.82 0.23 -0.13 0.41 3.32 -1.96 -1.19 116.42 117.92 1pl4 h ASP 105 Ca 0.37 -0.12 -0.14 0.00 0.02 0.00 0.00 57.03 57.15 1pl4 h ASP 105 Cb 0.26 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1pl4 h ASP 105 CO -0.21 0.74 -0.42 0.11 -1.72 0.00 0.00 179.24 177.74 1pl4 h LYS 106 N 0.16 0.67 -0.37 3.56 1.57 -1.80 -1.75 116.57 118.62 1pl4 h LYS 106 Ca 0.00 -0.36 0.03 0.00 -1.87 0.00 0.00 60.65 58.45 1pl4 h LYS 106 Cb 1.02 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.31 1pl4 h LYS 106 CO 0.08 0.97 0.17 0.35 -0.57 0.00 0.00 179.45 180.45 1pl4 h PHE 107 N 0.55 0.30 -0.73 -1.35 3.57 -1.02 0.64 116.94 118.89 1pl4 h PHE 107 Ca 0.04 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 1pl4 h PHE 107 Cb 0.95 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.58 1pl4 h PHE 107 CO 0.05 0.15 0.27 0.87 -2.23 0.00 0.00 178.31 177.42 1pl4 h LYS 108 N 0.35 1.10 -0.65 1.11 1.57 -0.97 0.03 116.57 119.10 1pl4 h LYS 108 Ca 0.16 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.70 1pl4 h LYS 108 Cb 0.09 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 1pl4 h LYS 108 CO -0.13 0.90 0.26 1.49 -0.57 0.00 0.00 179.45 181.40 1pl4 h GLU 109 N 1.07 0.98 -0.35 3.15 4.81 -0.85 0.39 114.58 123.78 1pl4 h GLU 109 Ca 0.24 -0.18 -0.16 0.00 -0.13 0.00 0.00 59.36 59.13 1pl4 h GLU 109 Cb 0.23 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1pl4 h GLU 109 CO -0.02 0.83 -0.41 0.87 -0.73 0.00 0.00 179.01 179.55 1pl4 h LYS 110 N 0.92 0.87 -0.23 1.92 1.57 -0.29 -1.09 116.57 120.25 1pl4 h LYS 110 Ca 0.22 -0.47 -0.16 0.00 -1.87 0.00 0.00 60.65 58.37 1pl4 h LYS 110 Cb 0.21 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1pl4 h LYS 110 CO -0.02 1.11 -0.49 1.25 -0.57 0.00 0.00 179.45 180.73 1pl4 h LEU 111 N 0.71 0.68 -0.54 2.94 5.85 -0.91 -1.73 115.31 122.30 1pl4 h LEU 111 Ca 0.05 -0.34 0.04 0.00 0.84 0.00 0.00 57.88 58.47 1pl4 h LEU 111 Cb 0.99 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 1pl4 h LEU 111 CO 0.10 1.06 0.30 0.74 -0.34 0.00 0.00 178.44 180.29 1pl4 h THR 112 N 0.49 0.99 -0.49 1.05 2.02 -0.84 -1.26 112.91 114.88 1pl4 h THR 112 Ca 0.02 -0.20 -0.10 0.00 0.77 0.00 0.00 66.41 66.91 1pl4 h THR 112 Cb 1.04 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 1pl4 h THR 112 CO 0.10 0.11 -0.08 0.00 0.37 0.00 0.00 175.52 176.01 1pl4 h ALA 113 N 1.27 0.94 -0.60 6.16 0.00 -0.92 0.26 119.26 126.37 1pl4 h ALA 113 Ca 0.23 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1pl4 h ALA 113 Cb 0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1pl4 h ALA 113 CO -0.14 0.62 -0.03 0.00 0.00 0.00 0.00 179.25 179.71 1pl4 h ALA 114 N 1.11 0.82 -0.25 0.00 0.00 -1.10 -0.38 119.26 119.46 1pl4 h ALA 114 Ca 0.14 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1pl4 h ALA 114 Cb 0.59 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1pl4 h ALA 114 CO 0.04 0.67 -0.25 0.77 0.00 0.00 0.00 179.25 180.48 1pl4 h SER 115 N 0.97 0.65 0.43 0.00 0.02 -0.67 -3.02 113.55 111.92 1pl4 h SER 115 Ca 0.17 -0.47 -0.07 0.00 -0.84 0.00 0.00 61.79 60.57 1pl4 h SER 115 Cb 0.59 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 1pl4 h SER 115 CO 0.04 0.99 -0.33 0.58 -1.14 0.00 0.00 176.83 176.96 1pl4 h VAL 116 N 0.31 1.11 0.00 2.27 2.07 -0.44 -3.15 116.25 118.42 1pl4 h VAL 116 Ca 0.04 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.37 1pl4 h VAL 116 Cb 0.80 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.24 1pl4 h VAL 116 CO 0.06 0.32 0.00 0.61 0.02 0.00 0.00 177.57 178.59 1pl4 n GLY 117 N -0.41 -1.42 3.66 2.17 0.00 -0.16 -4.78 105.19 104.25 1pl4 n GLY 117 Ca -0.02 0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1pl4 n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pl4 s VAL 118 N -3.24 3.48 -0.34 1.61 1.01 -1.19 -4.95 120.40 116.77 1pl4 s VAL 118 Ca 0.06 0.57 -0.15 0.00 0.00 0.00 0.00 61.98 62.47 1pl4 s VAL 118 Cb 0.10 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.09 1pl4 s VAL 118 CO 0.46 -0.06 0.35 -1.10 0.00 0.00 0.00 175.10 174.74 1pl4 s GLN 119 N 4.20 3.55 0.93 2.72 -0.21 -1.26 -4.85 119.66 124.73 1pl4 s GLN 119 Ca 0.76 -0.45 0.00 0.00 0.02 0.00 0.00 55.36 55.69 1pl4 s GLN 119 Cb -0.34 -3.81 0.00 0.00 1.00 0.00 0.00 33.01 29.86 1pl4 s GLN 119 CO 0.32 -0.52 0.00 0.41 -2.12 0.00 0.00 175.29 173.38 1pl4 n GLY 120 N 4.98 0.19 3.88 3.09 0.00 -1.26 -4.96 105.19 111.10 1pl4 n GLY 120 Ca -0.10 -1.57 -0.33 0.00 0.00 0.00 0.00 46.02 44.03 1pl4 n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pl4 s SER 121 N -4.00 6.60 0.00 1.61 0.01 -1.26 -4.82 113.70 111.84 1pl4 s SER 121 Ca 0.00 0.78 0.00 0.00 1.31 0.00 0.00 55.95 58.04 1pl4 s SER 121 Cb 0.00 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 64.06 1pl4 s SER 121 CO 0.00 0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.32 1pl4 n GLY 122 N 0.35 -0.52 2.94 3.44 0.00 -1.26 -1.24 105.19 108.90 1pl4 n GLY 122 Ca -0.04 -0.99 -0.11 0.00 0.00 0.00 0.00 46.02 44.88 1pl4 n GLY 122 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pl4 s TRP 123 N -3.00 0.08 -0.11 1.61 0.52 -0.17 -1.09 118.94 116.77 1pl4 s TRP 123 Ca 0.00 -0.15 -0.05 0.00 0.02 0.00 0.00 56.10 55.92 1pl4 s TRP 123 Cb 0.00 -0.06 -0.04 0.00 -1.15 0.00 0.00 33.47 32.22 1pl4 s TRP 123 CO 0.00 -0.10 0.09 0.20 0.02 0.00 0.00 176.95 177.17 1pl4 s GLY 124 N -0.60 2.05 0.01 0.98 0.00 -0.02 -0.92 107.32 108.81 1pl4 s GLY 124 Ca -0.07 -0.70 0.03 0.00 0.00 0.00 0.00 44.72 43.99 1pl4 s GLY 124 CO -0.00 -0.42 -0.10 -0.98 0.00 0.00 0.00 173.10 171.60 1pl4 s TRP 125 N -0.91 0.87 -0.25 1.90 0.52 0.43 -0.52 118.94 120.97 1pl4 s TRP 125 Ca 0.14 -0.23 -0.12 0.00 0.02 0.00 0.00 56.10 55.91 1pl4 s TRP 125 Cb -0.12 -0.54 -0.05 0.00 -1.15 0.00 0.00 33.47 31.61 1pl4 s TRP 125 CO 0.03 -0.01 0.26 -1.17 0.02 0.00 0.00 176.95 176.08 1pl4 s LEU 126 N -0.54 4.07 0.37 2.99 2.96 0.37 -1.57 118.68 127.33 1pl4 s LEU 126 Ca 0.02 0.17 0.04 0.00 -0.22 0.00 0.00 54.13 54.13 1pl4 s LEU 126 Cb -0.05 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.35 1pl4 s LEU 126 CO 0.00 -0.05 0.07 -0.83 -1.32 0.00 0.00 176.35 174.22 1pl4 s GLY 127 N 1.43 2.34 -0.16 7.98 0.00 0.46 -1.17 107.32 118.21 1pl4 s GLY 127 Ca 0.11 -1.68 -0.02 0.00 0.00 0.00 0.00 44.72 43.13 1pl4 s GLY 127 CO 0.08 -1.87 -0.09 -0.12 0.00 0.00 0.00 173.10 171.10 1pl4 s PHE 128 N -3.20 2.88 -0.50 1.90 5.36 -0.02 -0.99 117.98 123.40 1pl4 s PHE 128 Ca 0.30 -0.69 -0.21 0.00 -0.96 0.00 0.00 56.93 55.37 1pl4 s PHE 128 Cb 0.06 -1.93 0.04 0.00 -0.34 0.00 0.00 43.02 40.86 1pl4 s PHE 128 CO 0.14 -0.28 0.75 1.21 -1.46 0.00 0.00 175.22 175.58 1pl4 s ASN 129 N 0.66 6.30 0.18 6.13 3.04 0.01 -1.41 114.94 129.84 1pl4 s ASN 129 Ca -0.05 -0.55 -0.10 0.00 0.04 0.00 0.00 52.86 52.20 1pl4 s ASN 129 Cb -0.15 -2.35 0.07 0.00 -1.54 0.00 0.00 41.25 37.28 1pl4 s ASN 129 CO 0.02 -0.98 1.65 0.11 -3.04 0.00 0.00 177.10 174.87 1pl4 h LYS 130 N 9.07 1.05 -0.43 0.43 1.57 -1.87 0.27 116.57 126.67 1pl4 h LYS 130 Ca -0.26 -0.31 -0.12 0.00 -1.87 0.00 0.00 60.65 58.09 1pl4 h LYS 130 Cb 1.09 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 1pl4 h LYS 130 CO 0.99 1.00 -0.20 1.05 -0.57 0.00 0.00 179.45 181.72 1pl4 h GLU 131 N 0.95 0.84 0.00 3.15 4.11 -1.96 -3.01 114.58 118.66 1pl4 h GLU 131 Ca 0.18 -0.34 0.00 0.00 0.07 0.00 0.00 59.36 59.27 1pl4 h GLU 131 Cb 0.50 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1pl4 h GLU 131 CO 0.02 0.97 -0.62 0.00 0.07 0.00 0.00 179.01 179.45 1pl4 h ARG 132 N 0.74 0.00 -4.95 1.06 2.47 -1.96 -3.48 114.38 108.25 1pl4 h ARG 132 Ca 0.10 0.00 -0.33 0.00 -1.26 0.00 0.00 59.98 58.49 1pl4 h ARG 132 Cb 0.73 0.00 0.11 0.00 -1.65 0.00 0.00 29.97 29.16 1pl4 h ARG 132 CO 0.06 0.00 -0.56 0.41 0.56 0.00 0.00 179.97 180.44 1pl4 n GLY 133 N 1.25 -0.29 3.54 0.04 0.00 0.94 -5.02 105.19 105.65 1pl4 n GLY 133 Ca 0.02 0.09 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 1pl4 n GLY 133 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1pl4 s HIS 134 N -3.26 0.59 0.61 1.61 -3.43 -1.10 -5.00 115.29 105.32 1pl4 s HIS 134 Ca 0.48 -0.92 -0.15 0.00 -0.80 0.00 0.00 55.06 53.66 1pl4 s HIS 134 Cb -0.21 0.08 -0.03 0.00 -1.43 0.00 0.00 32.58 30.99 1pl4 s HIS 134 CO 0.59 -1.01 1.06 -0.51 -2.00 0.00 0.00 174.74 172.87 1pl4 s LEU 135 N -3.08 3.43 -0.23 5.38 1.43 -1.26 -0.81 118.68 123.53 1pl4 s LEU 135 Ca 0.26 1.79 -0.15 0.00 -1.03 0.00 0.00 54.13 55.00 1pl4 s LEU 135 Cb 0.00 -4.53 0.07 0.00 0.03 0.00 0.00 46.19 41.76 1pl4 s LEU 135 CO 0.12 -1.23 0.58 -1.58 0.23 0.00 0.00 176.35 174.47 1pl4 s GLN 136 N -4.23 0.61 -0.02 1.70 0.74 -0.17 -4.78 119.66 113.50 1pl4 s GLN 136 Ca 0.63 1.01 -0.12 0.00 0.05 0.00 0.00 55.36 56.93 1pl4 s GLN 136 Cb -0.16 0.13 -0.05 0.00 1.10 0.00 0.00 33.01 34.03 1pl4 s GLN 136 CO 0.40 -0.14 0.33 0.42 -0.55 0.00 0.00 175.29 175.75 1pl4 s ILE 137 N 1.29 5.17 0.01 -2.34 1.01 -1.26 -0.40 121.20 124.68 1pl4 s ILE 137 Ca -0.08 0.61 -0.12 0.00 0.00 0.00 0.00 60.65 61.06 1pl4 s ILE 137 Cb -0.06 -3.62 0.01 0.00 0.01 0.00 0.00 42.46 38.81 1pl4 s ILE 137 CO -0.13 0.56 0.24 0.00 0.00 0.00 0.00 174.94 175.60 1pl4 s ALA 138 N -1.10 -0.55 0.09 9.38 0.00 -0.61 -4.99 121.76 123.98 1pl4 s ALA 138 Ca 0.22 0.00 0.06 0.00 0.00 0.00 0.00 51.96 52.24 1pl4 s ALA 138 Cb -0.15 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 1pl4 s ALA 138 CO 0.11 -0.31 -0.06 0.00 0.00 0.00 0.00 175.76 175.50 1pl4 s ALA 139 N -1.91 3.07 -0.02 0.00 0.00 -1.26 -0.43 121.76 121.21 1pl4 s ALA 139 Ca -0.10 -1.18 0.03 0.00 0.00 0.00 0.00 51.96 50.72 1pl4 s ALA 139 Cb -0.04 -1.02 -0.00 0.00 0.00 0.00 0.00 23.12 22.06 1pl4 s ALA 139 CO 0.00 0.66 -0.11 0.00 0.00 0.00 0.00 175.76 176.31 1pl4 s PRO 141 N 0.03 3.98 4.94 0.00 0.04 -1.26 -1.00 135.00 141.73 1pl4 s PRO 141 Ca -0.01 0.73 0.00 0.00 0.04 0.00 0.00 61.00 61.76 1pl4 s PRO 141 Cb -0.07 -2.35 0.00 0.00 0.04 0.00 0.00 34.50 32.12 1pl4 s PRO 141 CO 0.00 0.04 0.00 0.09 0.04 0.00 0.00 177.00 177.17 1pl4 n ASN 142 N -0.75 0.00 -0.75 6.66 5.03 -0.37 -0.85 115.26 124.22 1pl4 n ASN 142 Ca 0.04 0.00 0.08 0.00 0.87 0.00 0.00 54.58 55.57 1pl4 n ASN 142 Cb 0.54 0.00 0.22 0.00 -1.02 0.00 0.00 39.78 39.51 1pl4 n ASN 142 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1pl4 n GLN 143 N 14.00 2.83 -1.64 3.52 1.13 -1.26 -4.06 117.38 131.90 1pl4 n GLN 143 Ca 0.00 -2.56 -0.43 0.00 -1.94 0.00 0.00 57.00 52.07 1pl4 n GLN 143 Cb 0.00 -1.64 -0.03 0.00 0.11 0.00 0.00 30.24 28.68 1pl4 n GLN 143 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1pl4 n ASP 144 N -0.26 3.78 -4.81 1.08 9.92 -0.03 -3.88 116.55 122.34 1pl4 n ASP 144 Ca 0.18 0.69 -0.33 0.00 -0.53 0.00 0.00 54.79 54.79 1pl4 n ASP 144 Cb 0.73 -1.51 -0.04 0.00 -0.64 0.00 0.00 41.12 39.65 1pl4 n ASP 144 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1pl4 s PRO 145 N 5.04 3.90 0.05 -0.24 0.04 -1.26 -4.63 135.00 137.90 1pl4 s PRO 145 Ca 0.94 1.18 -0.31 0.00 0.04 0.00 0.00 61.00 62.85 1pl4 s PRO 145 Cb -0.44 -2.12 -0.18 0.00 0.04 0.00 0.00 34.50 31.80 1pl4 s PRO 145 CO 0.41 -0.33 1.44 1.25 0.04 0.00 0.00 177.00 179.82 1pl4 h LEU 146 N 1.38 -0.75 -0.35 -3.56 5.85 -1.91 -2.16 115.31 113.82 1pl4 h LEU 146 Ca -0.48 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.16 1pl4 h LEU 146 Cb 1.20 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 1pl4 h LEU 146 CO 0.60 -0.46 -0.04 -0.61 -0.34 0.00 0.00 178.44 177.59 1pl4 h GLN 147 N -1.01 0.64 0.00 1.25 4.15 -1.88 0.22 115.11 118.47 1pl4 h GLN 147 Ca -0.09 -0.22 -0.01 0.00 0.77 0.00 0.00 58.65 59.09 1pl4 h GLN 147 Cb 0.71 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.35 1pl4 h GLN 147 CO 0.15 0.78 -0.07 0.78 -1.93 0.00 0.00 178.83 178.54 1pl4 h GLY 148 N 0.44 0.00 0.00 2.39 0.00 -1.87 -0.28 103.07 103.75 1pl4 h GLY 148 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 1pl4 h GLY 148 CO 0.03 0.00 -0.98 -1.30 0.00 0.00 0.00 176.54 174.28 1pl4 n THR 149 N -4.32 0.00 -0.05 4.70 -2.24 -0.81 -4.75 114.28 106.81 1pl4 n THR 149 Ca -0.03 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1pl4 n THR 149 Cb 0.15 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1pl4 n THR 149 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1pl4 n THR 150 N -1.55 0.00 0.00 4.28 -2.24 0.05 -5.04 114.28 109.78 1pl4 n THR 150 Ca 0.00 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1pl4 n THR 150 Cb 0.25 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 1pl4 n THR 150 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pl4 n GLY 151 N 0.36 2.75 3.76 3.38 0.00 -0.12 -5.00 105.19 110.31 1pl4 n GLY 151 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1pl4 n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pl4 s LEU 152 N 0.00 4.45 -0.20 0.99 1.43 -1.26 -4.80 118.68 119.29 1pl4 s LEU 152 Ca 0.00 2.56 -0.24 0.00 -1.03 0.00 0.00 54.13 55.42 1pl4 s LEU 152 Cb 0.00 -3.64 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 1pl4 s LEU 152 CO 0.00 -0.46 0.76 -0.63 0.23 0.00 0.00 176.35 176.26 1pl4 s ILE 153 N -0.91 4.91 0.18 -0.59 -1.09 -0.50 -3.00 121.20 120.20 1pl4 s ILE 153 Ca 0.50 1.47 -0.30 0.00 -2.23 0.00 0.00 60.65 60.08 1pl4 s ILE 153 Cb -0.38 -4.07 -0.08 0.00 -1.58 0.00 0.00 42.46 36.36 1pl4 s ILE 153 CO 0.48 0.02 1.17 -2.16 -1.23 0.00 0.00 174.94 173.22 1pl4 s PRO 154 N 2.27 4.52 -0.10 2.79 0.04 -1.26 -0.84 135.00 142.42 1pl4 s PRO 154 Ca 0.34 1.83 -0.06 0.00 0.04 0.00 0.00 61.00 63.15 1pl4 s PRO 154 Cb -0.16 -3.25 -0.05 0.00 0.04 0.00 0.00 34.50 31.08 1pl4 s PRO 154 CO 0.10 -0.03 -0.14 1.28 0.04 0.00 0.00 177.00 178.25 1pl4 n LEU 155 N 2.43 0.81 -3.71 -3.56 4.77 -0.31 -4.93 117.00 112.50 1pl4 n LEU 155 Ca 0.04 0.14 -0.18 0.00 -0.03 0.00 0.00 56.01 55.97 1pl4 n LEU 155 Cb 0.45 -0.33 -0.17 0.00 -2.33 0.00 0.00 43.42 41.04 1pl4 n LEU 155 CO 0.55 0.18 -0.34 -0.22 -1.33 0.00 0.00 177.39 176.23 1pl4 s LEU 156 N -6.64 0.47 0.02 2.23 2.96 -0.97 -4.56 118.68 112.20 1pl4 s LEU 156 Ca -0.15 0.07 0.05 0.00 -0.22 0.00 0.00 54.13 53.88 1pl4 s LEU 156 Cb 0.06 -0.11 -0.03 0.00 0.50 0.00 0.00 46.19 46.60 1pl4 s LEU 156 CO 0.19 -0.21 -0.12 -0.83 -1.32 0.00 0.00 176.35 174.06 1pl4 s GLY 157 N 1.78 1.66 -0.23 7.98 0.00 -1.26 -0.48 107.32 116.77 1pl4 s GLY 157 Ca -0.00 -1.10 0.02 0.00 0.00 0.00 0.00 44.72 43.64 1pl4 s GLY 157 CO -0.03 -0.97 -0.11 -0.42 0.00 0.00 0.00 173.10 171.57 1pl4 s ILE 158 N -0.96 1.90 -0.14 0.90 1.01 0.32 -4.88 121.20 119.35 1pl4 s ILE 158 Ca 0.16 -1.31 -0.29 0.00 0.00 0.00 0.00 60.65 59.20 1pl4 s ILE 158 Cb -0.11 -1.99 -0.03 0.00 0.01 0.00 0.00 42.46 40.34 1pl4 s ILE 158 CO 0.06 0.07 1.40 -0.62 0.00 0.00 0.00 174.94 175.85 1pl4 s ASP 159 N 1.26 6.82 -0.12 3.58 -1.08 -1.26 -0.84 116.67 125.03 1pl4 s ASP 159 Ca -0.05 1.82 0.18 0.00 -0.52 0.00 0.00 52.55 53.98 1pl4 s ASP 159 Cb -0.18 -2.54 0.27 0.00 -1.46 0.00 0.00 42.92 39.01 1pl4 s ASP 159 CO -0.07 -0.85 1.14 1.33 0.52 0.00 0.00 175.17 177.24 1pl4 n VAL 160 N 5.50 1.75 -1.70 1.11 0.24 -0.25 -4.85 118.33 120.13 1pl4 n VAL 160 Ca 0.15 -2.11 -0.40 0.00 -2.04 0.00 0.00 64.34 59.94 1pl4 n VAL 160 Cb 0.44 -0.18 0.02 0.00 -1.47 0.00 0.00 33.84 32.65 1pl4 n VAL 160 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 1pl4 n TRP 161 N -1.33 2.07 0.06 6.34 7.02 -1.15 -4.49 117.44 125.97 1pl4 n TRP 161 Ca 0.15 0.48 0.10 0.00 -1.02 0.00 0.00 57.50 57.21 1pl4 n TRP 161 Cb 0.64 -2.36 0.57 0.00 -2.42 0.00 0.00 31.31 27.74 1pl4 n TRP 161 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 1pl4 h GLU 162 N 1.86 0.22 0.00 -0.99 5.08 -1.94 -1.30 114.58 117.51 1pl4 h GLU 162 Ca -0.48 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1pl4 h GLU 162 Cb 1.30 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.50 1pl4 h GLU 162 CO 0.59 0.15 -0.00 1.12 -1.00 0.00 0.00 179.01 179.86 1pl4 h HIS 163 N 0.23 0.00 0.00 4.33 2.07 -1.98 0.20 115.15 119.99 1pl4 h HIS 163 Ca 0.15 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.67 1pl4 h HIS 163 Cb 0.32 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.30 1pl4 h HIS 163 CO -0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 1pl4 n ALA 164 N -2.13 2.20 -0.03 6.11 0.00 -0.49 -4.50 120.51 121.67 1pl4 n ALA 164 Ca -0.03 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1pl4 n ALA 164 Cb 0.08 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.08 1pl4 n ALA 164 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1pl4 n TYR 165 N -2.08 0.00 -0.20 0.00 0.18 -0.83 -4.99 117.16 109.25 1pl4 n TYR 165 Ca 0.05 0.00 -0.08 0.00 1.88 0.00 0.00 57.90 59.76 1pl4 n TYR 165 Cb 0.38 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.36 1pl4 n TYR 165 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 1pl4 h PHE 166 N 0.00 0.83 -1.00 -3.48 3.57 -1.17 0.16 116.94 115.84 1pl4 h PHE 166 Ca 0.00 -0.05 0.22 0.00 3.53 0.00 0.00 57.97 61.66 1pl4 h PHE 166 Cb 0.00 -0.25 -0.11 0.00 2.79 0.00 0.00 35.95 38.38 1pl4 h PHE 166 CO 0.00 0.66 0.61 -0.07 -2.23 0.00 0.00 178.31 177.28 1pl4 h LEU 167 N 0.76 0.71 0.01 0.59 3.38 -1.87 0.19 115.31 119.07 1pl4 h LEU 167 Ca 0.19 0.11 -0.41 0.00 0.09 0.00 0.00 57.88 57.85 1pl4 h LEU 167 Cb 0.16 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 1pl4 h LEU 167 CO -0.02 0.20 -2.36 1.67 0.09 0.00 0.00 178.44 178.02 1pl4 n GLN 168 N -4.78 0.62 0.00 1.13 7.27 -0.83 -4.64 117.38 116.15 1pl4 n GLN 168 Ca 0.25 0.26 0.10 0.00 0.07 0.00 0.00 57.00 57.68 1pl4 n GLN 168 Cb 0.66 -1.54 -0.03 0.00 2.41 0.00 0.00 30.24 31.74 1pl4 n GLN 168 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1pl4 n TYR 169 N -3.91 0.00 -2.72 3.69 4.01 0.50 -5.07 117.16 113.66 1pl4 n TYR 169 Ca -0.48 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.26 1pl4 n TYR 169 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.94 1pl4 n TYR 169 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1pl4 n LYS 170 N -0.34 0.00 -0.01 -0.72 4.76 0.67 -1.42 118.16 121.09 1pl4 n LYS 170 Ca 0.08 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.64 1pl4 n LYS 170 Cb 0.42 0.00 0.63 0.00 -1.84 0.00 0.00 35.03 34.24 1pl4 n LYS 170 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1pl4 n ASN 171 N 2.31 0.56 -4.13 4.39 3.02 -1.26 -4.34 115.26 115.81 1pl4 n ASN 171 Ca 0.00 -1.36 -0.43 0.00 -0.03 0.00 0.00 54.58 52.76 1pl4 n ASN 171 Cb 0.00 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 1pl4 n ASN 171 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1pl4 n VAL 172 N -0.49 4.40 -0.28 2.41 0.31 -0.51 -4.79 118.33 119.37 1pl4 n VAL 172 Ca 0.18 -4.69 0.05 0.00 -0.01 0.00 0.00 64.34 59.87 1pl4 n VAL 172 Cb 0.17 -2.39 0.26 0.00 -0.91 0.00 0.00 33.84 30.98 1pl4 n VAL 172 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1pl4 h ARG 173 N 6.29 0.95 -0.18 5.55 2.43 -1.83 -1.98 114.38 125.60 1pl4 h ARG 173 Ca 0.34 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.49 1pl4 h ARG 173 Cb 0.73 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 1pl4 h ARG 173 CO 1.43 0.63 0.13 -1.35 -1.51 0.00 0.00 179.97 179.29 1pl4 h PRO 174 N 0.98 0.08 -0.55 0.20 0.11 -1.98 -1.36 132.00 129.48 1pl4 h PRO 174 Ca 0.38 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.43 1pl4 h PRO 174 Cb 0.23 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.30 1pl4 h PRO 174 CO -0.14 0.06 0.10 -0.44 -0.21 0.00 0.00 178.00 177.37 1pl4 h ASP 175 N 0.09 0.86 -0.53 -2.05 3.32 -1.75 -1.16 116.42 115.20 1pl4 h ASP 175 Ca 0.08 -0.25 0.05 0.00 0.02 0.00 0.00 57.03 56.93 1pl4 h ASP 175 Cb 0.22 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.49 1pl4 h ASP 175 CO -0.01 0.89 0.26 0.22 -1.72 0.00 0.00 179.24 178.88 1pl4 h TYR 176 N 0.80 0.47 -0.67 4.55 3.20 -1.41 -1.94 116.97 121.96 1pl4 h TYR 176 Ca 0.17 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 1pl4 h TYR 176 Cb 0.39 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 1pl4 h TYR 176 CO 0.03 0.21 0.38 -0.07 -1.64 0.00 0.00 178.16 177.07 1pl4 h LEU 177 N 0.49 0.82 -0.66 2.82 -0.00 -0.98 -0.44 115.31 117.38 1pl4 h LEU 177 Ca 0.24 -0.08 -0.04 0.00 -0.00 0.00 0.00 57.88 58.00 1pl4 h LEU 177 Cb 0.17 -0.21 -0.03 0.00 -0.00 0.00 0.00 40.66 40.60 1pl4 h LEU 177 CO -0.18 0.67 0.24 0.50 -0.00 0.00 0.00 178.44 179.67 1pl4 h LYS 178 N 0.91 0.99 -0.18 1.13 3.11 -1.05 -2.94 116.57 118.55 1pl4 h LYS 178 Ca 0.24 -0.19 -0.17 0.00 -2.81 0.00 0.00 60.65 57.71 1pl4 h LYS 178 Cb 0.01 -0.16 -0.00 0.00 -1.00 0.00 0.00 32.23 31.09 1pl4 h LYS 178 CO -0.04 0.84 -0.60 0.00 -2.81 0.00 0.00 179.45 176.85 1pl4 h ALA 179 N 1.10 0.62 0.00 5.00 0.00 -0.90 -3.24 119.26 121.85 1pl4 h ALA 179 Ca 0.22 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1pl4 h ALA 179 Cb 0.23 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1pl4 h ALA 179 CO -0.01 0.70 -0.06 0.97 0.00 0.00 0.00 179.25 180.84 1pl4 h ILE 180 N 0.44 0.44 -0.38 0.00 2.10 -0.90 -1.86 117.51 117.35 1pl4 h ILE 180 Ca -0.00 -0.32 0.11 0.00 1.08 0.00 0.00 64.86 65.73 1pl4 h ILE 180 Cb 1.16 1.22 -0.02 0.00 -1.09 0.00 0.00 36.82 38.09 1pl4 h ILE 180 CO 0.11 0.06 0.31 -0.50 -1.08 0.00 0.00 178.15 177.05 1pl4 h TRP 181 N 0.00 0.00 0.00 2.19 4.06 -1.60 -0.94 115.95 119.66 1pl4 h TRP 181 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1pl4 h TRP 181 Cb 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.37 1pl4 h TRP 181 CO 0.00 0.00 0.00 -0.91 -3.56 0.00 0.00 178.44 173.97 1pl4 h ASN 182 N 0.00 0.00 0.00 -3.49 2.35 -1.55 -3.14 115.58 109.75 1pl4 h ASN 182 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1pl4 h ASN 182 Cb 0.79 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.16 1pl4 h ASN 182 CO -0.00 0.00 -0.02 1.33 -1.65 0.00 0.00 177.43 177.09 1pl4 n VAL 183 N -2.68 1.17 -2.20 2.81 0.24 -0.37 -2.68 118.33 114.63 1pl4 n VAL 183 Ca 0.00 -1.30 -0.41 0.00 -2.04 0.00 0.00 64.34 60.59 1pl4 n VAL 183 Cb 0.19 0.30 -0.03 0.00 -1.47 0.00 0.00 33.84 32.83 1pl4 n VAL 183 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1pl4 s ILE 184 N -1.49 3.08 -1.07 1.34 -1.09 -1.16 -0.23 121.20 120.58 1pl4 s ILE 184 Ca 0.10 0.94 -0.17 0.00 -2.23 0.00 0.00 60.65 59.29 1pl4 s ILE 184 Cb 0.09 -3.60 0.14 0.00 -1.58 0.00 0.00 42.46 37.51 1pl4 s ILE 184 CO 0.01 0.17 1.31 0.21 -1.23 0.00 0.00 174.94 175.41 1pl4 s ASN 185 N 0.06 6.80 0.55 3.58 3.84 0.20 -0.23 114.94 129.75 1pl4 s ASN 185 Ca 0.54 -2.39 0.35 0.00 0.21 0.00 0.00 52.86 51.57 1pl4 s ASN 185 Cb -0.37 -2.43 1.61 0.00 -0.55 0.00 0.00 41.25 39.51 1pl4 s ASN 185 CO 0.42 -0.98 2.05 -0.50 -2.79 0.00 0.00 177.10 175.30 1pl4 h TRP 186 N 8.17 0.00 -0.53 0.43 4.06 -1.85 -1.48 115.95 124.75 1pl4 h TRP 186 Ca 0.24 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 61.11 1pl4 h TRP 186 Cb 0.95 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.10 1pl4 h TRP 186 CO 1.17 0.00 -0.01 1.49 -3.56 0.00 0.00 178.44 177.53 1pl4 h GLU 187 N 0.00 0.93 -0.30 0.49 4.81 -1.97 0.14 114.58 118.69 1pl4 h GLU 187 Ca 0.00 -0.30 -0.07 0.00 -0.13 0.00 0.00 59.36 58.86 1pl4 h GLU 187 Cb 0.35 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1pl4 h GLU 187 CO 0.00 0.96 -0.08 -0.97 -0.73 0.00 0.00 179.01 178.19 1pl4 h ASN 188 N 0.81 0.59 -0.62 1.04 -0.73 -1.58 -1.82 115.58 113.27 1pl4 h ASN 188 Ca 0.15 -0.37 -0.07 0.00 1.87 0.00 0.00 56.30 57.88 1pl4 h ASN 188 Cb 0.54 -0.16 -0.03 0.00 0.27 0.00 0.00 38.32 38.94 1pl4 h ASN 188 CO 0.03 0.82 0.13 0.58 -0.37 0.00 0.00 177.43 178.63 1pl4 h VAL 189 N 0.35 1.25 -0.63 2.57 2.07 -1.20 -1.01 116.25 119.66 1pl4 h VAL 189 Ca 0.08 -0.96 -0.06 0.00 0.82 0.00 0.00 66.70 66.58 1pl4 h VAL 189 Cb 0.57 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 1pl4 h VAL 189 CO 0.03 0.36 0.17 0.74 0.02 0.00 0.00 177.57 178.89 1pl4 h THR 190 N 0.97 1.25 -0.70 2.57 2.02 -0.64 -1.23 112.91 117.16 1pl4 h THR 190 Ca 0.20 -0.90 0.04 0.00 0.77 0.00 0.00 66.41 66.52 1pl4 h THR 190 Cb 0.38 0.63 -0.05 0.00 -1.74 0.00 0.00 68.15 67.37 1pl4 h THR 190 CO 0.00 0.34 0.43 -0.33 0.37 0.00 0.00 175.52 176.34 1pl4 h GLU 191 N 0.92 0.81 -0.78 6.66 5.08 -0.74 0.03 114.58 126.55 1pl4 h GLU 191 Ca 0.20 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.48 1pl4 h GLU 191 Cb 0.34 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 1pl4 h GLU 191 CO -0.00 0.53 0.37 0.00 -1.00 0.00 0.00 179.01 178.91 1pl4 h ARG 192 N 0.83 1.13 -0.24 2.33 3.08 -0.88 -0.44 114.38 120.18 1pl4 h ARG 192 Ca 0.29 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 1pl4 h ARG 192 Cb 0.05 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 1pl4 h ARG 192 CO -0.12 0.87 0.08 -0.92 -1.07 0.00 0.00 179.97 178.81 1pl4 h TYR 193 N 1.12 0.39 0.00 3.04 3.20 -0.63 -2.89 116.97 121.20 1pl4 h TYR 193 Ca 0.27 -0.04 -0.08 0.00 3.14 0.00 0.00 58.73 62.02 1pl4 h TYR 193 Cb 0.12 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 1pl4 h TYR 193 CO 0.01 0.43 -0.38 0.52 -1.64 0.00 0.00 178.16 177.10 1pl4 h MET 194 N 0.23 0.00 0.00 1.82 2.86 -0.67 -1.71 114.93 117.47 1pl4 h MET 194 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1pl4 h MET 194 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1pl4 h MET 194 CO -0.00 0.38 0.00 0.00 1.06 0.00 0.00 176.91 178.35 1pl4 n ALA 195 N -2.44 1.96 -0.36 6.32 0.00 -0.21 -5.10 120.51 120.69 1pl4 n ALA 195 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1pl4 n ALA 195 Cb 0.43 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1pl4 n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50