#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 3.20 0.08 5.64 3.76 -1.26 -5.09 115.29 121.62 1pl4 s HIS 2 Ca 0.00 1.52 -0.07 0.00 -0.15 0.00 0.00 55.06 56.36 1pl4 s HIS 2 Cb 0.00 -2.92 -0.01 0.00 1.11 0.00 0.00 32.58 30.76 1pl4 s HIS 2 CO 0.00 -0.66 0.15 -1.54 -0.85 0.00 0.00 174.74 171.84 1pl4 s SER 3 N -2.65 0.19 -0.11 1.40 1.04 -1.26 -4.96 113.70 107.35 1pl4 s SER 3 Ca 0.62 -0.72 -0.30 0.00 0.48 0.00 0.00 55.95 56.04 1pl4 s SER 3 Cb -0.13 0.31 -0.03 0.00 0.10 0.00 0.00 66.02 66.28 1pl4 s SER 3 CO 0.28 -0.70 1.29 -0.22 0.98 0.00 0.00 173.24 174.87 1pl4 s LEU 4 N -2.86 4.23 0.53 2.42 2.96 -1.26 -5.00 118.68 119.70 1pl4 s LEU 4 Ca 0.05 1.81 -0.19 0.00 -0.22 0.00 0.00 54.13 55.58 1pl4 s LEU 4 Cb 0.05 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 43.14 1pl4 s LEU 4 CO -0.11 -0.72 1.09 -2.16 -1.32 0.00 0.00 176.35 173.13 1pl4 s PRO 5 N 3.09 3.47 0.50 0.98 0.04 -1.26 -5.02 135.00 136.80 1pl4 s PRO 5 Ca 0.57 1.49 -0.21 0.00 0.04 0.00 0.00 61.00 62.89 1pl4 s PRO 5 Cb -0.24 -2.03 -0.07 0.00 0.04 0.00 0.00 34.50 32.19 1pl4 s PRO 5 CO 0.19 -0.73 1.10 -0.51 0.04 0.00 0.00 177.00 177.09 1pl4 s ASP 6 N -1.96 6.08 0.49 6.66 1.01 -1.26 -5.03 116.67 122.66 1pl4 s ASP 6 Ca 0.70 2.11 -0.22 0.00 0.71 0.00 0.00 52.55 55.85 1pl4 s ASP 6 Cb -0.21 -2.58 -0.07 0.00 1.01 0.00 0.00 42.92 41.08 1pl4 s ASP 6 CO 0.26 -0.97 1.18 -0.76 0.21 0.00 0.00 175.17 175.09 1pl4 s LEU 7 N -3.48 3.92 0.00 1.23 1.43 -1.26 -4.93 118.68 115.60 1pl4 s LEU 7 Ca 0.68 2.33 0.16 0.00 -1.03 0.00 0.00 54.13 56.27 1pl4 s LEU 7 Cb -0.22 -4.34 0.82 0.00 0.03 0.00 0.00 46.19 42.48 1pl4 s LEU 7 CO 0.26 -1.08 1.45 -2.65 0.23 0.00 0.00 176.35 174.56 1pl4 n PRO 8 N -0.77 0.25 -3.96 1.29 -0.02 -1.26 -4.83 135.00 125.70 1pl4 n PRO 8 Ca 0.09 0.12 -0.10 0.00 -2.02 0.00 0.00 63.50 61.60 1pl4 n PRO 8 Cb 0.48 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.40 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 -2.52 0.38 0.74 6.00 -0.85 -1.26 -5.10 117.35 114.73 1pl4 s TYR 9 Ca 0.16 -0.73 -0.11 0.00 -0.52 0.00 0.00 57.07 55.87 1pl4 s TYR 9 Cb 0.11 0.04 0.04 0.00 0.38 0.00 0.00 41.96 42.52 1pl4 s TYR 9 CO 0.24 -0.82 1.08 -0.51 -1.52 0.00 0.00 175.55 174.02 1pl4 s ASP 10 N -2.98 4.84 0.55 -0.18 1.01 -1.26 -4.93 116.67 113.72 1pl4 s ASP 10 Ca 0.19 1.75 0.24 0.00 0.71 0.00 0.00 52.55 55.44 1pl4 s ASP 10 Cb 0.02 -2.51 1.47 0.00 1.01 0.00 0.00 42.92 42.90 1pl4 s ASP 10 CO 0.03 -1.81 2.10 1.88 0.21 0.00 0.00 175.17 177.58 1pl4 h TYR 11 N -0.94 0.00 -0.20 4.23 0.05 -1.97 -1.51 116.97 116.63 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 1.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.96 1pl4 h TYR 11 CO 0.59 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 178.11 1pl4 n GLY 12 N -1.51 0.64 0.15 3.88 0.00 -1.26 -4.17 105.19 102.91 1pl4 n GLY 12 Ca 0.02 -0.51 0.13 0.00 0.00 0.00 0.00 46.02 45.66 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 4.21 1.00 -0.35 4.61 0.00 -1.62 -2.64 119.26 124.46 1pl4 h ALA 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pl4 h ALA 13 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1pl4 h ALA 13 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1pl4 n LEU 14 N -2.40 3.12 -4.70 0.00 4.77 -1.26 -4.39 117.00 112.14 1pl4 n LEU 14 Ca 0.03 -1.60 -0.39 0.00 -0.03 0.00 0.00 56.01 54.02 1pl4 n LEU 14 Cb 0.30 -0.23 0.04 0.00 -2.33 0.00 0.00 43.42 41.20 1pl4 n LEU 14 CO 0.24 0.70 0.84 -0.62 -1.33 0.00 0.00 177.39 177.22 1pl4 n GLU 15 N 1.10 1.48 -0.44 3.23 -0.58 -1.00 -0.39 120.64 124.05 1pl4 n GLU 15 Ca 0.16 0.55 0.07 0.00 -0.42 0.00 0.00 57.16 57.52 1pl4 n GLU 15 Cb 0.50 -2.42 0.27 0.00 -0.57 0.00 0.00 31.44 29.22 1pl4 n GLU 15 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 1pl4 n PRO 16 N -0.86 2.93 0.14 3.49 -0.04 -1.26 -4.88 135.00 134.51 1pl4 n PRO 16 Ca 0.11 -2.12 -0.23 0.00 -0.04 0.00 0.00 63.50 61.22 1pl4 n PRO 16 Cb 0.44 -1.69 -0.16 0.00 -0.04 0.00 0.00 33.50 32.06 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 3.11 0.89 -3.37 0.54 3.86 -1.07 -3.41 115.15 115.70 1pl4 h HIS 17 Ca 0.00 -0.65 -0.54 0.00 -1.16 0.00 0.00 60.37 58.02 1pl4 h HIS 17 Cb 1.09 -0.04 -0.39 0.00 1.06 0.00 0.00 27.41 29.13 1pl4 h HIS 17 CO 0.55 1.52 -0.77 0.42 0.86 0.00 0.00 177.93 180.51 1pl4 s ILE 18 N -2.61 0.82 1.00 2.45 1.01 -1.00 -4.82 121.20 118.05 1pl4 s ILE 18 Ca -0.08 -0.70 -0.12 0.00 0.00 0.00 0.00 60.65 59.74 1pl4 s ILE 18 Cb 0.05 -1.23 0.19 0.00 0.01 0.00 0.00 42.46 41.48 1pl4 s ILE 18 CO 0.93 -0.14 1.09 0.54 0.00 0.00 0.00 174.94 177.36 1pl4 s ASN 19 N 1.73 2.60 0.12 3.58 2.20 -1.26 -3.54 114.94 120.37 1pl4 s ASN 19 Ca -0.02 1.29 -0.16 0.00 -0.94 0.00 0.00 52.86 53.03 1pl4 s ASN 19 Cb -0.17 -1.97 -0.02 0.00 -2.00 0.00 0.00 41.25 37.09 1pl4 s ASN 19 CO -0.07 -3.16 1.66 0.00 -2.94 0.00 0.00 177.10 172.58 1pl4 h ALA 20 N -1.91 0.48 -0.81 3.54 0.00 -1.89 -2.28 119.26 116.38 1pl4 h ALA 20 Ca -0.54 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.19 1pl4 h ALA 20 Cb 1.32 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 1pl4 h ALA 20 CO 0.56 0.11 0.41 0.37 0.00 0.00 0.00 179.25 180.70 1pl4 h GLN 21 N 0.45 1.16 -0.11 0.00 4.15 -1.92 0.85 115.11 119.68 1pl4 h GLN 21 Ca 0.12 -0.16 -0.00 0.00 0.77 0.00 0.00 58.65 59.38 1pl4 h GLN 21 Cb 0.23 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 1pl4 h GLN 21 CO -0.01 0.88 0.06 0.82 -1.93 0.00 0.00 178.83 178.65 1pl4 h ILE 22 N 1.14 1.08 -0.41 2.39 2.04 -1.90 -1.33 117.51 120.52 1pl4 h ILE 22 Ca 0.28 -0.23 0.01 0.00 1.00 0.00 0.00 64.86 65.92 1pl4 h ILE 22 Cb 0.08 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1pl4 h ILE 22 CO -0.04 0.07 0.26 0.24 0.00 0.00 0.00 178.15 178.69 1pl4 h MET 23 N 0.09 0.52 -0.50 2.37 2.86 -0.91 -1.03 114.93 118.32 1pl4 h MET 23 Ca 0.04 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.61 1pl4 h MET 23 Cb 0.07 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 1pl4 h MET 23 CO -0.01 0.34 0.18 0.37 1.06 0.00 0.00 176.91 178.85 1pl4 h GLN 24 N 0.53 0.77 -0.52 1.72 4.15 -0.64 -1.11 115.11 120.02 1pl4 h GLN 24 Ca 0.16 -0.16 -0.08 0.00 0.77 0.00 0.00 58.65 59.34 1pl4 h GLN 24 Cb -0.04 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.52 1pl4 h GLN 24 CO -0.05 0.71 0.01 -0.07 -1.93 0.00 0.00 178.83 177.50 1pl4 h LEU 25 N 0.68 0.88 -0.48 -2.39 3.38 -1.17 -0.01 115.31 116.20 1pl4 h LEU 25 Ca 0.16 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1pl4 h LEU 25 Cb 0.24 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1pl4 h LEU 25 CO -0.01 0.97 0.24 -0.74 0.09 0.00 0.00 178.44 178.99 1pl4 h HIS 26 N 0.77 0.69 0.00 1.13 2.76 -0.82 -1.42 115.15 118.26 1pl4 h HIS 26 Ca 0.15 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.28 1pl4 h HIS 26 Cb 0.51 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 29.25 1pl4 h HIS 26 CO 0.04 0.54 -0.07 1.25 -1.30 0.00 0.00 177.93 178.38 1pl4 h HIS 27 N 0.64 0.00 0.00 5.26 -0.00 -1.23 -0.82 115.15 119.00 1pl4 h HIS 27 Ca 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.52 1pl4 h HIS 27 Cb 0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.51 1pl4 h HIS 27 CO -0.01 0.36 -0.08 0.66 -0.00 0.00 0.00 177.93 178.86 1pl4 h SER 28 N -1.00 0.00 0.00 3.26 4.64 -1.06 -2.95 113.55 116.44 1pl4 h SER 28 Ca -0.01 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1pl4 h SER 28 Cb 0.39 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1pl4 h SER 28 CO -0.01 0.08 -0.55 0.29 -0.87 0.00 0.00 176.83 175.78 1pl4 n LYS 29 N -3.14 0.25 0.31 4.77 4.76 -0.63 -4.45 118.16 120.04 1pl4 n LYS 29 Ca 0.02 0.10 -0.14 0.00 -2.87 0.00 0.00 58.31 55.42 1pl4 n LYS 29 Cb 0.49 -0.94 -0.07 0.00 -1.84 0.00 0.00 35.03 32.66 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 -0.47 -0.77 -0.68 2.13 2.76 -1.30 -1.88 115.15 114.93 1pl4 h HIS 30 Ca -0.02 -0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.12 1pl4 h HIS 30 Cb 0.52 0.25 -0.03 0.00 1.55 0.00 0.00 27.41 29.71 1pl4 h HIS 30 CO -0.19 -0.44 0.36 1.25 -1.30 0.00 0.00 177.93 177.60 1pl4 h HIS 31 N -1.15 0.94 -0.76 5.26 -0.00 -1.23 -2.04 115.15 116.17 1pl4 h HIS 31 Ca -0.08 -0.03 0.17 0.00 -0.00 0.00 0.00 60.37 60.43 1pl4 h HIS 31 Cb 0.67 -0.30 -0.11 0.00 -0.00 0.00 0.00 27.41 27.67 1pl4 h HIS 31 CO 0.00 0.68 0.19 0.00 -0.00 0.00 0.00 177.93 178.80 1pl4 h ALA 32 N 1.17 1.00 -0.42 5.26 0.00 -1.52 -1.42 119.26 123.33 1pl4 h ALA 32 Ca 0.24 0.18 -0.08 0.00 0.00 0.00 0.00 54.91 55.24 1pl4 h ALA 32 Cb 0.06 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1pl4 h ALA 32 CO -0.04 -0.35 -0.06 0.00 0.00 0.00 0.00 179.25 178.80 1pl4 h ALA 33 N 1.64 1.10 -0.27 0.00 0.00 -0.63 -1.21 119.26 119.89 1pl4 h ALA 33 Ca 0.44 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1pl4 h ALA 33 Cb 0.76 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1pl4 h ALA 33 CO -0.53 0.56 0.15 1.88 0.00 0.00 0.00 179.25 181.31 1pl4 h TYR 34 N 0.66 0.37 -0.34 0.00 0.05 -0.86 -1.21 116.97 115.64 1pl4 h TYR 34 Ca 0.12 -0.01 0.03 0.00 0.05 0.00 0.00 58.73 58.92 1pl4 h TYR 34 Cb 0.50 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 38.09 1pl4 h TYR 34 CO 0.02 0.31 0.14 0.28 -1.05 0.00 0.00 178.16 177.87 1pl4 h VAL 35 N 0.32 0.94 -0.39 -2.88 2.07 -0.88 0.20 116.25 115.64 1pl4 h VAL 35 Ca 0.09 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1pl4 h VAL 35 Cb 0.07 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1pl4 h VAL 35 CO -0.02 0.06 0.21 0.78 0.02 0.00 0.00 177.57 178.62 1pl4 h ASN 36 N 0.30 0.49 0.75 0.57 2.35 -1.07 -1.68 115.58 117.30 1pl4 h ASN 36 Ca 0.15 -0.10 -0.12 0.00 -0.55 0.00 0.00 56.30 55.68 1pl4 h ASN 36 Cb 0.09 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 1pl4 h ASN 36 CO -0.13 0.45 -0.57 0.78 -1.65 0.00 0.00 177.43 176.31 1pl4 h ASN 37 N 0.50 0.00 -0.08 5.81 2.35 -1.15 -2.58 115.58 120.43 1pl4 h ASN 37 Ca 0.14 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1pl4 h ASN 37 Cb 0.07 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.44 1pl4 h ASN 37 CO -0.02 0.57 0.05 0.25 -1.65 0.00 0.00 177.43 176.63 1pl4 h LEU 38 N 0.00 0.10 -0.73 1.61 5.85 -0.64 -0.25 115.31 121.25 1pl4 h LEU 38 Ca -0.01 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1pl4 h LEU 38 Cb 1.10 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.07 1pl4 h LEU 38 CO 0.07 0.12 0.43 0.78 -0.34 0.00 0.00 178.44 179.51 1pl4 h ASN 39 N 0.06 0.89 -0.44 1.25 2.35 -1.19 -0.52 115.58 117.98 1pl4 h ASN 39 Ca 0.03 -0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1pl4 h ASN 39 Cb 0.05 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1pl4 h ASN 39 CO -0.01 0.71 0.26 0.58 -1.65 0.00 0.00 177.43 177.32 1pl4 h VAL 40 N 1.01 1.15 -0.18 2.81 2.07 -1.35 -2.25 116.25 119.49 1pl4 h VAL 40 Ca 0.26 -0.34 -0.17 0.00 0.82 0.00 0.00 66.70 67.27 1pl4 h VAL 40 Cb -0.01 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1pl4 h VAL 40 CO -0.05 0.15 -0.57 0.74 0.02 0.00 0.00 177.57 177.86 1pl4 h THR 41 N 0.59 1.32 -0.84 2.57 2.02 -0.63 -2.16 112.91 115.79 1pl4 h THR 41 Ca 0.16 -1.82 -0.04 0.00 0.77 0.00 0.00 66.41 65.48 1pl4 h THR 41 Cb 0.01 1.80 -0.04 0.00 -1.74 0.00 0.00 68.15 68.18 1pl4 h THR 41 CO -0.03 0.57 0.38 -0.33 0.37 0.00 0.00 175.52 176.48 1pl4 h GLU 42 N 0.43 1.22 -0.37 6.66 5.08 -0.94 0.12 114.58 126.78 1pl4 h GLU 42 Ca 0.00 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.15 1pl4 h GLU 42 Cb 1.12 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 1pl4 h GLU 42 CO 0.11 0.95 0.15 1.49 -1.00 0.00 0.00 179.01 180.71 1pl4 h GLU 43 N 1.20 0.56 -0.71 2.33 4.81 -1.27 -0.19 114.58 121.31 1pl4 h GLU 43 Ca 0.29 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 1pl4 h GLU 43 Cb 0.15 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 1pl4 h GLU 43 CO -0.03 0.53 0.34 0.87 -0.73 0.00 0.00 179.01 179.99 1pl4 h LYS 44 N 0.46 1.02 -0.18 1.92 1.57 -1.05 -2.97 116.57 117.35 1pl4 h LYS 44 Ca 0.13 -0.15 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 1pl4 h LYS 44 Cb 0.18 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1pl4 h LYS 44 CO -0.01 0.81 -0.29 -0.92 -0.57 0.00 0.00 179.45 178.46 1pl4 h TYR 45 N 0.99 0.39 -0.37 -1.35 5.03 -0.22 -1.89 116.97 119.56 1pl4 h TYR 45 Ca 0.24 -0.08 -0.09 0.00 2.58 0.00 0.00 58.73 61.38 1pl4 h TYR 45 Cb 0.12 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.29 1pl4 h TYR 45 CO 0.01 0.61 -0.14 0.37 -1.32 0.00 0.00 178.16 177.69 1pl4 h GLN 46 N 0.31 0.66 -0.36 1.82 5.75 -0.90 0.26 115.11 122.65 1pl4 h GLN 46 Ca 0.04 -0.22 -0.02 0.00 -0.15 0.00 0.00 58.65 58.30 1pl4 h GLN 46 Cb 0.68 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.15 1pl4 h GLN 46 CO 0.05 0.77 0.13 0.93 -2.65 0.00 0.00 178.83 178.06 1pl4 h GLU 47 N 0.60 0.55 -0.92 1.69 5.08 -1.34 -0.46 114.58 119.78 1pl4 h GLU 47 Ca 0.10 -0.11 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1pl4 h GLU 47 Cb 0.58 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.69 1pl4 h GLU 47 CO 0.04 0.55 0.60 0.00 -1.00 0.00 0.00 179.01 179.20 1pl4 h ALA 48 N 0.98 1.19 0.01 3.43 0.00 -1.08 -2.39 119.26 121.38 1pl4 h ALA 48 Ca 0.12 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1pl4 h ALA 48 Cb 0.21 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1pl4 h ALA 48 CO -0.01 0.52 -0.00 1.25 0.00 0.00 0.00 179.25 181.01 1pl4 h LEU 49 N 1.21 -0.01 -1.89 0.00 5.85 -0.78 0.14 115.31 119.82 1pl4 h LEU 49 Ca 0.35 -0.12 0.10 0.00 0.84 0.00 0.00 57.88 59.04 1pl4 h LEU 49 Cb -0.08 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1pl4 h LEU 49 CO -0.09 0.12 0.29 0.00 -0.34 0.00 0.00 178.44 178.41 1pl4 h ALA 50 N 0.86 2.23 -0.18 1.25 0.00 -0.78 -1.28 119.26 121.35 1pl4 h ALA 50 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pl4 h ALA 50 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1pl4 h ALA 50 CO 0.00 -0.33 0.00 1.63 0.00 0.00 0.00 179.25 180.55 1pl4 n LYS 51 N -4.45 2.02 -2.86 0.00 5.02 -0.93 -4.94 118.16 112.03 1pl4 n LYS 51 Ca 0.06 -1.52 -0.20 0.00 -2.02 0.00 0.00 58.31 54.63 1pl4 n LYS 51 Cb 0.40 -1.45 0.01 0.00 -0.02 0.00 0.00 35.03 33.97 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 1.27 -0.51 3.47 0.72 0.00 -0.49 -4.91 105.19 104.75 1pl4 n GLY 52 Ca 0.17 0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.45 6.49 0.18 1.61 -1.08 0.45 -4.85 116.67 117.02 1pl4 s ASP 53 Ca 0.21 -1.66 -0.06 0.00 -0.52 0.00 0.00 52.55 50.51 1pl4 s ASP 53 Cb -0.10 -2.43 0.09 0.00 -1.46 0.00 0.00 42.92 39.02 1pl4 s ASP 53 CO 0.25 -1.24 1.54 0.58 0.52 0.00 0.00 175.17 176.83 1pl4 h VAL 54 N 6.03 1.28 -0.41 1.11 2.07 -1.91 -1.64 116.25 122.78 1pl4 h VAL 54 Ca 0.05 -1.53 0.01 0.00 0.82 0.00 0.00 66.70 66.05 1pl4 h VAL 54 Cb 1.03 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 32.20 1pl4 h VAL 54 CO 1.18 0.50 0.25 0.74 0.02 0.00 0.00 177.57 180.26 1pl4 h THR 55 N 0.64 1.06 -0.49 2.57 2.02 -1.98 -0.16 112.91 116.58 1pl4 h THR 55 Ca 0.06 -0.17 -0.07 0.00 0.77 0.00 0.00 66.41 67.00 1pl4 h THR 55 Cb 0.92 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 1pl4 h THR 55 CO 0.08 0.09 0.02 0.00 0.37 0.00 0.00 175.52 176.09 1pl4 h ALA 56 N 1.17 1.13 -0.50 6.16 0.00 -1.91 -0.52 119.26 124.79 1pl4 h ALA 56 Ca 0.16 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1pl4 h ALA 56 Cb -0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1pl4 h ALA 56 CO -0.06 0.56 0.30 1.96 0.00 0.00 0.00 179.25 182.01 1pl4 h GLN 57 N 0.75 0.58 -0.18 0.00 4.20 -0.81 -1.89 115.11 117.76 1pl4 h GLN 57 Ca 0.15 -0.03 -0.15 0.00 0.06 0.00 0.00 58.65 58.67 1pl4 h GLN 57 Cb 0.42 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1pl4 h GLN 57 CO 0.02 0.38 -0.53 0.82 -0.67 0.00 0.00 178.83 178.85 1pl4 h ILE 58 N 0.60 1.32 0.00 2.54 2.04 -0.63 -2.71 117.51 120.66 1pl4 h ILE 58 Ca 0.20 -1.77 -0.04 0.00 1.00 0.00 0.00 64.86 64.25 1pl4 h ILE 58 Cb 0.01 1.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1pl4 h ILE 58 CO -0.09 0.55 -0.18 0.00 0.00 0.00 0.00 178.15 178.44 1pl4 h ALA 59 N 1.02 1.35 0.00 1.87 0.00 -0.77 -1.54 119.26 121.19 1pl4 h ALA 59 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1pl4 h ALA 59 Cb 1.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1pl4 h ALA 59 CO 0.10 0.22 -0.07 1.28 0.00 0.00 0.00 179.25 180.77 1pl4 n LEU 60 N -3.81 0.24 -0.13 0.00 4.77 -0.74 -4.38 117.00 112.96 1pl4 n LEU 60 Ca -0.02 0.45 -0.08 0.00 -0.03 0.00 0.00 56.01 56.34 1pl4 n LEU 60 Cb 0.28 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1pl4 n LEU 60 CO 0.33 -0.03 1.04 1.56 -1.33 0.00 0.00 177.39 178.96 1pl4 h GLN 61 N 0.00 0.54 -0.69 3.23 4.20 -1.16 -1.74 115.11 119.48 1pl4 h GLN 61 Ca 0.00 -0.03 0.09 0.00 0.06 0.00 0.00 58.65 58.77 1pl4 h GLN 61 Cb 0.56 -0.12 -0.07 0.00 0.30 0.00 0.00 27.48 28.15 1pl4 h GLN 61 CO 0.00 0.36 0.33 -1.35 -0.67 0.00 0.00 178.83 177.50 1pl4 h PRO 62 N 0.55 0.54 -0.29 1.46 0.11 -1.78 -0.04 132.00 132.56 1pl4 h PRO 62 Ca 0.15 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 66.12 1pl4 h PRO 62 Cb -0.06 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 30.91 1pl4 h PRO 62 CO -0.03 0.36 -0.28 0.00 -0.21 0.00 0.00 178.00 177.83 1pl4 h ALA 63 N 1.43 0.97 -0.19 -0.75 0.00 -1.76 -0.42 119.26 118.55 1pl4 h ALA 63 Ca 0.34 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1pl4 h ALA 63 Cb 0.37 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1pl4 h ALA 63 CO -0.28 0.60 -0.32 1.25 0.00 0.00 0.00 179.25 180.50 1pl4 h LEU 64 N 0.50 0.61 -0.37 0.00 7.12 -0.71 -1.13 115.31 121.33 1pl4 h LEU 64 Ca 0.07 -0.54 -0.04 0.00 0.13 0.00 0.00 57.88 57.50 1pl4 h LEU 64 Cb 0.75 -0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 40.69 1pl4 h LEU 64 CO 0.06 1.03 0.08 0.50 -0.13 0.00 0.00 178.44 179.98 1pl4 h LYS 65 N 0.21 0.60 0.06 1.25 3.64 -0.95 0.12 116.57 121.51 1pl4 h LYS 65 Ca 0.01 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1pl4 h LYS 65 Cb 0.91 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1pl4 h LYS 65 CO 0.07 0.65 -0.03 0.35 -2.27 0.00 0.00 179.45 178.22 1pl4 h PHE 66 N 0.45 -0.08 0.22 1.91 3.57 -1.08 0.17 116.94 122.11 1pl4 h PHE 66 Ca 0.11 -0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.29 1pl4 h PHE 66 Cb 0.33 0.03 0.03 0.00 2.79 0.00 0.00 35.95 39.13 1pl4 h PHE 66 CO 0.02 0.20 -1.42 -0.91 -2.23 0.00 0.00 178.31 173.97 1pl4 h ASN 67 N -0.36 0.73 0.09 0.41 4.21 -1.28 -0.31 115.58 119.08 1pl4 h ASN 67 Ca -0.01 -0.78 0.01 0.00 1.21 0.00 0.00 56.30 56.73 1pl4 h ASN 67 Cb 0.31 -0.24 -0.02 0.00 -1.12 0.00 0.00 38.32 37.26 1pl4 h ASN 67 CO 0.01 1.61 -0.13 1.23 -1.29 0.00 0.00 177.43 178.87 1pl4 h GLY 68 N 0.58 -0.24 1.00 2.83 0.00 -0.83 -1.04 103.07 105.37 1pl4 h GLY 68 Ca -0.22 0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 1pl4 h GLY 68 CO 0.26 -0.13 0.42 -1.33 0.00 0.00 0.00 176.54 175.75 1pl4 h GLY 69 N -0.27 0.97 0.69 4.60 0.00 -0.71 -0.86 103.07 107.49 1pl4 h GLY 69 Ca 0.02 -0.39 0.06 0.00 0.00 0.00 0.00 47.33 47.01 1pl4 h GLY 69 CO -0.06 0.38 0.35 -1.33 0.00 0.00 0.00 176.54 175.88 1pl4 h GLY 70 N 0.91 0.93 0.83 4.60 0.00 -0.81 0.20 103.07 109.73 1pl4 h GLY 70 Ca 0.24 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1pl4 h GLY 70 CO -0.05 0.15 0.00 0.84 0.00 0.00 0.00 176.54 177.49 1pl4 h HIS 71 N 0.65 0.40 -0.21 5.60 6.17 -0.73 -1.65 115.15 125.38 1pl4 h HIS 71 Ca 0.28 -0.07 0.05 0.00 0.71 0.00 0.00 60.37 61.35 1pl4 h HIS 71 Cb 0.17 -0.10 -0.05 0.00 2.52 0.00 0.00 27.41 29.95 1pl4 h HIS 71 CO -0.08 0.55 -0.10 0.82 0.71 0.00 0.00 177.93 179.83 1pl4 h ILE 72 N 0.13 0.69 -0.22 6.26 2.04 -0.86 -1.17 117.51 124.38 1pl4 h ILE 72 Ca 0.06 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.87 1pl4 h ILE 72 Cb 0.39 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1pl4 h ILE 72 CO 0.01 0.00 -0.05 0.78 0.00 0.00 0.00 178.15 178.89 1pl4 h ASN 73 N -0.07 0.42 -0.55 1.72 2.35 -0.51 -2.24 115.58 116.71 1pl4 h ASN 73 Ca 0.11 -0.37 -0.09 0.00 -0.55 0.00 0.00 56.30 55.40 1pl4 h ASN 73 Cb 0.24 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 1pl4 h ASN 73 CO -0.26 0.69 -0.01 0.45 -1.65 0.00 0.00 177.43 176.65 1pl4 h HIS 74 N 0.15 1.09 -0.51 1.19 3.86 -1.29 -0.63 115.15 119.01 1pl4 h HIS 74 Ca 0.06 -0.18 0.02 0.00 -1.16 0.00 0.00 60.37 59.10 1pl4 h HIS 74 Cb 0.51 -0.29 -0.03 0.00 1.06 0.00 0.00 27.41 28.66 1pl4 h HIS 74 CO 0.05 0.97 0.30 0.77 0.86 0.00 0.00 177.93 180.89 1pl4 h SER 75 N 0.92 0.49 -0.30 2.45 0.02 -1.03 -1.39 113.55 114.72 1pl4 h SER 75 Ca 0.16 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.07 1pl4 h SER 75 Cb 0.55 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1pl4 h SER 75 CO 0.03 0.35 0.01 0.40 -1.14 0.00 0.00 176.83 176.48 1pl4 h ILE 76 N 0.61 1.25 -0.75 3.27 2.04 -1.18 -3.25 117.51 119.50 1pl4 h ILE 76 Ca 0.20 -0.92 0.12 0.00 1.00 0.00 0.00 64.86 65.27 1pl4 h ILE 76 Cb 0.02 1.26 -0.09 0.00 -0.74 0.00 0.00 36.82 37.27 1pl4 h ILE 76 CO -0.09 0.30 0.34 0.15 0.00 0.00 0.00 178.15 178.84 1pl4 h PHE 77 N 0.33 0.59 -0.48 1.37 3.57 -0.60 -1.19 116.94 120.53 1pl4 h PHE 77 Ca 0.09 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 1pl4 h PHE 77 Cb 0.42 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 1pl4 h PHE 77 CO 0.03 0.14 0.09 -1.49 -2.23 0.00 0.00 178.31 174.86 1pl4 h TRP 78 N 0.53 0.75 0.00 0.41 -0.00 -1.30 -1.15 115.95 115.19 1pl4 h TRP 78 Ca 0.39 -0.07 0.00 0.00 -0.00 0.00 0.00 58.89 59.21 1pl4 h TRP 78 Cb 0.53 -0.22 0.00 0.00 -0.00 0.00 0.00 29.16 29.47 1pl4 h TRP 78 CO -0.13 0.65 0.00 1.79 -0.00 0.00 0.00 178.44 180.75 1pl4 h THR 79 N 0.70 0.00 -0.00 1.49 1.35 -1.33 -2.78 112.91 112.34 1pl4 h THR 79 Ca 0.15 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 1pl4 h THR 79 Cb 0.30 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 1pl4 h THR 79 CO 0.00 0.00 -0.14 0.59 -0.25 0.00 0.00 175.52 175.72 1pl4 n ASN 80 N -2.55 0.38 -4.59 5.36 5.03 -0.44 -4.72 115.26 113.73 1pl4 n ASN 80 Ca 0.02 -0.34 -0.25 0.00 0.87 0.00 0.00 54.58 54.88 1pl4 n ASN 80 Cb 0.31 -0.11 -0.08 0.00 -1.02 0.00 0.00 39.78 38.88 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 -2.63 3.00 -0.19 3.41 1.43 -1.05 -0.46 118.68 122.20 1pl4 s LEU 81 Ca 0.24 -0.68 -0.27 0.00 -1.03 0.00 0.00 54.13 52.39 1pl4 s LEU 81 Cb 0.20 -1.59 0.09 0.00 0.03 0.00 0.00 46.19 44.91 1pl4 s LEU 81 CO 0.51 0.05 0.79 -0.55 0.23 0.00 0.00 176.35 177.38 1pl4 s SER 82 N -3.31 -0.63 0.34 2.29 0.15 0.91 -4.60 113.70 108.85 1pl4 s SER 82 Ca 0.29 1.00 0.07 0.00 0.70 0.00 0.00 55.95 58.01 1pl4 s SER 82 Cb -0.07 0.94 0.62 0.00 -1.71 0.00 0.00 66.02 65.80 1pl4 s SER 82 CO 0.17 -0.35 1.82 1.55 1.20 0.00 0.00 173.24 177.63 1pl4 h PRO 83 N 3.96 0.30 -0.97 5.44 0.13 -1.85 -1.48 132.00 137.54 1pl4 h PRO 83 Ca -0.27 -0.09 -0.04 0.00 -0.87 0.00 0.00 66.00 64.73 1pl4 h PRO 83 Cb 1.16 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 1pl4 h PRO 83 CO 0.19 0.51 0.05 0.09 -0.23 0.00 0.00 178.00 178.61 1pl4 n ASN 84 N -4.18 2.41 -0.96 1.44 5.03 -1.26 -4.97 115.26 112.77 1pl4 n ASN 84 Ca -0.01 -2.20 0.00 0.00 0.87 0.00 0.00 54.58 53.24 1pl4 n ASN 84 Cb 0.34 -0.54 0.00 0.00 -1.02 0.00 0.00 39.78 38.56 1pl4 n ASN 84 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1pl4 n GLY 85 N 0.17 1.60 2.08 7.41 0.00 -0.56 -4.99 105.19 110.90 1pl4 n GLY 85 Ca 0.07 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 -1.80 7.00 -0.02 0.00 0.49 -4.65 105.19 111.21 1pl4 n GLY 86 Ca 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.15 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 1.52 3.12 -0.02 0.00 -1.26 -4.75 105.19 103.80 1pl4 n GLY 87 Ca 0.00 -0.59 -0.09 0.00 0.00 0.00 0.00 46.02 45.34 1pl4 n GLY 87 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1pl4 s GLU 88 N 0.00 0.75 1.04 1.61 -1.05 -1.26 -5.03 118.70 114.77 1pl4 s GLU 88 Ca 0.00 -1.31 -0.18 0.00 -0.15 0.00 0.00 54.97 53.33 1pl4 s GLU 88 Cb 0.00 0.15 0.25 0.00 -0.44 0.00 0.00 34.13 34.09 1pl4 s GLU 88 CO 0.00 -0.15 1.29 -0.35 0.95 0.00 0.00 175.26 177.00 1pl4 n PRO 89 N 0.02 -1.73 -4.49 -4.83 -0.04 -1.26 -5.03 135.00 117.64 1pl4 n PRO 89 Ca -0.11 -2.00 -0.23 0.00 -0.04 0.00 0.00 63.50 61.12 1pl4 n PRO 89 Cb 0.62 -1.44 -0.10 0.00 -0.04 0.00 0.00 33.50 32.54 1pl4 n PRO 89 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1pl4 s LYS 90 N -5.83 1.76 5.47 0.54 2.47 -1.26 -4.65 119.74 118.24 1pl4 s LYS 90 Ca 0.75 -2.02 0.00 0.00 -1.56 0.00 0.00 55.97 53.14 1pl4 s LYS 90 Cb -0.03 -0.84 0.00 0.00 -1.46 0.00 0.00 37.83 35.50 1pl4 s LYS 90 CO 0.54 -0.28 0.00 0.41 0.16 0.00 0.00 175.35 176.18 1pl4 n GLY 91 N -0.78 2.45 0.31 5.54 0.00 -1.26 -2.53 105.19 108.92 1pl4 n GLY 91 Ca -0.04 -0.45 -0.01 0.00 0.00 0.00 0.00 46.02 45.52 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 0.93 -0.53 1.61 5.08 -1.99 -0.76 114.58 118.92 1pl4 h GLU 92 Ca 0.00 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1pl4 h GLU 92 Cb 0.00 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.01 1pl4 h GLU 92 CO 0.00 0.62 0.30 1.25 -1.00 0.00 0.00 179.01 180.18 1pl4 h LEU 93 N 0.96 0.66 -1.01 1.33 5.85 -1.92 0.03 115.31 121.20 1pl4 h LEU 93 Ca 0.33 -0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.89 1pl4 h LEU 93 Cb 0.07 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1pl4 h LEU 93 CO -0.13 0.55 -0.15 0.25 -0.34 0.00 0.00 178.44 178.61 1pl4 h LEU 94 N 0.72 0.53 -0.71 2.25 5.85 -1.05 -0.59 115.31 122.30 1pl4 h LEU 94 Ca 0.19 -0.15 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 1pl4 h LEU 94 Cb 0.03 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 1pl4 h LEU 94 CO -0.03 0.70 -0.13 -0.33 -0.34 0.00 0.00 178.44 178.31 1pl4 h GLU 95 N 0.49 0.86 -0.58 1.25 5.08 -0.58 -1.37 114.58 119.73 1pl4 h GLU 95 Ca 0.09 -0.30 -0.09 0.00 -1.00 0.00 0.00 59.36 58.05 1pl4 h GLU 95 Cb 0.55 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 1pl4 h GLU 95 CO 0.03 0.94 0.02 0.00 -1.00 0.00 0.00 179.01 179.00 1pl4 h ALA 96 N 1.09 0.78 -0.86 3.43 0.00 -0.59 0.54 119.26 123.64 1pl4 h ALA 96 Ca 0.12 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1pl4 h ALA 96 Cb 0.64 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1pl4 h ALA 96 CO 0.04 0.60 0.41 0.82 0.00 0.00 0.00 179.25 181.12 1pl4 h ILE 97 N 0.90 1.26 -0.54 0.00 2.04 -0.78 0.55 117.51 120.94 1pl4 h ILE 97 Ca 0.17 -0.73 -0.11 0.00 1.00 0.00 0.00 64.86 65.19 1pl4 h ILE 97 Cb 0.53 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1pl4 h ILE 97 CO 0.03 0.32 -0.09 0.11 0.00 0.00 0.00 178.15 178.52 1pl4 h LYS 98 N 1.22 1.00 -0.09 2.37 1.57 -0.98 0.51 116.57 122.17 1pl4 h LYS 98 Ca 0.29 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1pl4 h LYS 98 Cb 0.12 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 1pl4 h LYS 98 CO -0.04 1.03 0.01 -0.09 -0.57 0.00 0.00 179.45 179.79 1pl4 h ARG 99 N 0.90 0.15 0.00 3.15 2.43 -0.02 0.41 114.38 121.39 1pl4 h ARG 99 Ca 0.14 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.15 1pl4 h ARG 99 Cb 0.64 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 1pl4 h ARG 99 CO 0.04 0.38 -0.84 -0.44 -1.51 0.00 0.00 179.97 177.60 1pl4 h ASP 100 N -0.11 0.00 0.00 -3.80 3.32 0.10 -3.37 116.42 112.56 1pl4 h ASP 100 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1pl4 h ASP 100 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1pl4 h ASP 100 CO 0.00 0.48 0.00 0.49 -1.72 0.00 0.00 179.24 178.49 1pl4 n PHE 101 N -3.07 0.00 0.00 4.55 3.72 0.16 -5.02 117.46 117.80 1pl4 n PHE 101 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1pl4 n PHE 101 Cb 0.75 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.29 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 0.09 2.94 3.70 1.37 0.00 0.13 -4.35 105.19 109.08 1pl4 n GLY 102 Ca 0.00 -0.77 -0.01 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.12 0.23 1.61 1.04 -1.26 -4.67 113.70 110.53 1pl4 s SER 103 Ca 0.00 -0.29 -0.05 0.00 0.48 0.00 0.00 55.95 56.08 1pl4 s SER 103 Cb 0.00 0.35 0.23 0.00 0.10 0.00 0.00 66.02 66.70 1pl4 s SER 103 CO 0.00 -0.65 1.75 0.15 0.98 0.00 0.00 173.24 175.47 1pl4 h PHE 104 N 2.00 1.03 -0.46 5.02 3.57 -1.92 -1.45 116.94 124.72 1pl4 h PHE 104 Ca -0.27 -0.13 -0.06 0.00 3.53 0.00 0.00 57.97 61.05 1pl4 h PHE 104 Cb 1.22 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 1pl4 h PHE 104 CO 0.36 0.87 0.05 -0.44 -2.23 0.00 0.00 178.31 176.92 1pl4 h ASP 105 N 0.92 0.69 -0.16 0.41 3.32 -1.96 -0.52 116.42 119.12 1pl4 h ASP 105 Ca 0.19 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 57.03 1pl4 h ASP 105 Cb 0.40 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 1pl4 h ASP 105 CO 0.01 0.73 -0.16 0.11 -1.72 0.00 0.00 179.24 178.20 1pl4 h LYS 106 N 0.70 0.40 -0.39 3.56 1.57 -1.78 -0.76 116.57 119.87 1pl4 h LYS 106 Ca 0.15 -0.21 0.08 0.00 -1.87 0.00 0.00 60.65 58.79 1pl4 h LYS 106 Cb 0.36 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.61 1pl4 h LYS 106 CO 0.01 0.77 -0.05 0.35 -0.57 0.00 0.00 179.45 179.96 1pl4 h PHE 107 N 0.04 -0.11 -0.79 -1.35 3.57 -0.98 0.13 116.94 117.45 1pl4 h PHE 107 Ca 0.03 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 1pl4 h PHE 107 Cb 0.70 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.51 1pl4 h PHE 107 CO 0.08 -0.12 0.42 0.87 -2.23 0.00 0.00 178.31 177.33 1pl4 h LYS 108 N 0.05 1.11 -0.67 1.11 1.57 -0.80 0.47 116.57 119.41 1pl4 h LYS 108 Ca 0.19 -0.14 0.04 0.00 -1.87 0.00 0.00 60.65 58.87 1pl4 h LYS 108 Cb 0.28 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 1pl4 h LYS 108 CO -0.36 0.83 0.41 1.49 -0.57 0.00 0.00 179.45 181.25 1pl4 h GLU 109 N 1.10 0.77 -0.20 3.15 4.81 -0.37 0.75 114.58 124.59 1pl4 h GLU 109 Ca 0.28 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.39 1pl4 h GLU 109 Cb 0.06 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.26 1pl4 h GLU 109 CO -0.04 0.51 -0.16 0.87 -0.73 0.00 0.00 179.01 179.45 1pl4 h LYS 110 N 0.79 0.47 -0.28 1.92 1.57 0.11 -0.74 116.57 120.41 1pl4 h LYS 110 Ca 0.28 -0.23 -0.14 0.00 -1.87 0.00 0.00 60.65 58.68 1pl4 h LYS 110 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1pl4 h LYS 110 CO -0.12 0.80 -0.40 1.25 -0.57 0.00 0.00 179.45 180.40 1pl4 h LEU 111 N 0.15 0.69 -0.48 2.94 5.85 -0.80 -1.56 115.31 122.10 1pl4 h LEU 111 Ca 0.04 -0.31 0.05 0.00 0.84 0.00 0.00 57.88 58.49 1pl4 h LEU 111 Cb 0.69 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 1pl4 h LEU 111 CO 0.04 1.01 0.23 0.74 -0.34 0.00 0.00 178.44 180.13 1pl4 h THR 112 N 0.54 0.94 -0.32 1.05 2.02 -0.80 -1.43 112.91 114.91 1pl4 h THR 112 Ca 0.05 -0.16 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 1pl4 h THR 112 Cb 0.92 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1pl4 h THR 112 CO 0.08 0.08 0.03 0.00 0.37 0.00 0.00 175.52 176.08 1pl4 h ALA 113 N 1.27 0.43 -0.49 6.16 0.00 -0.86 0.20 119.26 125.96 1pl4 h ALA 113 Ca 0.22 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pl4 h ALA 113 Cb 0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1pl4 h ALA 113 CO -0.16 0.15 0.30 0.00 0.00 0.00 0.00 179.25 179.54 1pl4 h ALA 114 N 0.87 1.60 -0.05 0.00 0.00 -1.16 0.24 119.26 120.77 1pl4 h ALA 114 Ca 0.09 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1pl4 h ALA 114 Cb 0.39 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1pl4 h ALA 114 CO 0.01 0.35 -0.56 0.77 0.00 0.00 0.00 179.25 179.82 1pl4 h SER 115 N 0.68 0.57 0.25 0.00 0.02 -0.67 -3.13 113.55 111.27 1pl4 h SER 115 Ca 0.18 -0.71 -0.04 0.00 -0.84 0.00 0.00 61.79 60.39 1pl4 h SER 115 Cb -0.04 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1pl4 h SER 115 CO -0.04 1.19 -0.18 0.58 -1.14 0.00 0.00 176.83 177.25 1pl4 h VAL 116 N -0.01 0.96 0.00 2.27 2.07 -0.47 -2.89 116.25 118.18 1pl4 h VAL 116 Ca -0.06 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1pl4 h VAL 116 Cb 1.24 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1pl4 h VAL 116 CO 0.11 0.17 0.00 0.61 0.02 0.00 0.00 177.57 178.48 1pl4 n GLY 117 N -0.88 -1.43 3.68 2.17 0.00 0.06 -4.80 105.19 104.00 1pl4 n GLY 117 Ca -0.02 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.07 3.68 -0.37 1.61 1.01 -1.09 -4.96 120.40 117.21 1pl4 s VAL 118 Ca 0.10 1.03 -0.17 0.00 0.00 0.00 0.00 61.98 62.95 1pl4 s VAL 118 Cb 0.14 -3.67 -0.00 0.00 0.00 0.00 0.00 36.38 32.85 1pl4 s VAL 118 CO 0.48 -0.02 0.43 -1.10 0.00 0.00 0.00 175.10 174.88 1pl4 s GLN 119 N 2.65 3.44 1.25 2.72 -0.21 -1.26 -4.83 119.66 123.42 1pl4 s GLN 119 Ca 0.65 -0.45 0.00 0.00 0.02 0.00 0.00 55.36 55.58 1pl4 s GLN 119 Cb -0.32 -3.85 0.00 0.00 1.00 0.00 0.00 33.01 29.84 1pl4 s GLN 119 CO 0.26 -0.65 0.00 0.41 -2.12 0.00 0.00 175.29 173.19 1pl4 n GLY 120 N 4.96 0.21 3.88 3.09 0.00 -1.26 -4.95 105.19 111.12 1pl4 n GLY 120 Ca -0.07 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 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 6.61 0.00 1.61 0.01 -1.26 -4.85 113.70 111.82 1pl4 s SER 121 Ca 0.00 0.82 0.00 0.00 1.31 0.00 0.00 55.95 58.08 1pl4 s SER 121 Cb 0.00 -2.18 0.00 0.00 0.21 0.00 0.00 66.02 64.05 1pl4 s SER 121 CO 0.00 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.29 1pl4 n GLY 122 N 0.25 -0.51 2.95 3.44 0.00 -1.26 -0.45 105.19 109.62 1pl4 n GLY 122 Ca -0.03 -0.98 -0.11 0.00 0.00 0.00 0.00 46.02 44.89 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 -3.15 0.02 -0.08 1.61 0.52 -0.25 -0.96 118.94 116.64 1pl4 s TRP 123 Ca 0.00 -0.02 -0.04 0.00 0.02 0.00 0.00 56.10 56.05 1pl4 s TRP 123 Cb 0.00 -0.03 -0.04 0.00 -1.15 0.00 0.00 33.47 32.25 1pl4 s TRP 123 CO 0.00 -0.08 0.12 0.20 0.02 0.00 0.00 176.95 177.21 1pl4 s GLY 124 N -0.41 2.10 -0.02 0.98 0.00 -0.27 -1.04 107.32 108.66 1pl4 s GLY 124 Ca -0.05 -0.72 0.03 0.00 0.00 0.00 0.00 44.72 43.98 1pl4 s GLY 124 CO -0.00 -0.51 -0.09 -0.98 0.00 0.00 0.00 173.10 171.52 1pl4 s TRP 125 N -1.09 0.89 -0.22 1.90 0.52 0.14 -0.38 118.94 120.71 1pl4 s TRP 125 Ca 0.18 -0.20 -0.19 0.00 0.02 0.00 0.00 56.10 55.91 1pl4 s TRP 125 Cb -0.12 -0.62 -0.03 0.00 -1.15 0.00 0.00 33.47 31.55 1pl4 s TRP 125 CO 0.08 -0.07 0.55 -1.17 0.02 0.00 0.00 176.95 176.36 1pl4 s LEU 126 N 0.06 4.11 0.41 2.99 2.96 0.15 -1.27 118.68 128.09 1pl4 s LEU 126 Ca -0.01 0.67 0.03 0.00 -0.22 0.00 0.00 54.13 54.61 1pl4 s LEU 126 Cb -0.07 -2.75 -0.03 0.00 0.50 0.00 0.00 46.19 43.84 1pl4 s LEU 126 CO 0.00 -0.25 0.09 -0.83 -1.32 0.00 0.00 176.35 174.04 1pl4 s GLY 127 N 1.29 2.59 -0.18 7.98 0.00 0.80 -0.78 107.32 119.03 1pl4 s GLY 127 Ca 0.24 -1.25 -0.03 0.00 0.00 0.00 0.00 44.72 43.68 1pl4 s GLY 127 CO 0.09 -1.91 -0.06 -0.12 0.00 0.00 0.00 173.10 171.11 1pl4 s PHE 128 N -3.15 2.95 -0.50 1.90 5.36 0.17 -0.92 117.98 123.79 1pl4 s PHE 128 Ca 0.23 -0.63 -0.20 0.00 -0.96 0.00 0.00 56.93 55.37 1pl4 s PHE 128 Cb 0.04 -2.00 0.05 0.00 -0.34 0.00 0.00 43.02 40.77 1pl4 s PHE 128 CO 0.13 -0.28 0.68 1.21 -1.46 0.00 0.00 175.22 175.49 1pl4 s ASN 129 N 0.83 6.26 0.31 6.13 3.84 0.62 -1.46 114.94 131.47 1pl4 s ASN 129 Ca -0.02 -0.72 0.03 0.00 0.21 0.00 0.00 52.86 52.35 1pl4 s ASN 129 Cb -0.15 -2.32 0.52 0.00 -0.55 0.00 0.00 41.25 38.76 1pl4 s ASN 129 CO 0.01 -0.92 1.84 0.11 -2.79 0.00 0.00 177.10 175.35 1pl4 h LYS 130 N 9.02 0.60 -0.15 0.43 1.57 -1.86 0.13 116.57 126.31 1pl4 h LYS 130 Ca -0.27 -0.14 -0.17 0.00 -1.87 0.00 0.00 60.65 58.20 1pl4 h LYS 130 Cb 1.09 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 33.33 1pl4 h LYS 130 CO 0.97 0.63 -0.56 1.49 -0.57 0.00 0.00 179.45 181.40 1pl4 h GLU 131 N 0.57 0.65 0.00 3.15 4.81 -1.96 -3.25 114.58 118.55 1pl4 h GLU 131 Ca 0.12 -0.50 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1pl4 h GLU 131 Cb 0.37 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1pl4 h GLU 131 CO 0.01 1.12 -0.56 0.54 -0.73 0.00 0.00 179.01 179.39 1pl4 n ARG 132 N -4.13 0.29 -3.16 1.92 5.12 -1.18 -4.97 116.66 110.55 1pl4 n ARG 132 Ca -0.07 0.10 -0.15 0.00 -1.93 0.00 0.00 57.85 55.80 1pl4 n ARG 132 Cb 0.63 -1.70 0.05 0.00 -1.16 0.00 0.00 32.46 30.28 1pl4 n ARG 132 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1pl4 n GLY 133 N 1.33 -0.02 3.65 -0.13 0.00 0.40 -5.02 105.19 105.40 1pl4 n GLY 133 Ca 0.03 -0.08 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.21 0.25 0.63 1.61 -3.43 -0.98 -4.98 115.29 105.19 1pl4 s HIS 134 Ca 0.33 -0.64 -0.15 0.00 -0.80 0.00 0.00 55.06 53.80 1pl4 s HIS 134 Cb -0.14 0.31 -0.01 0.00 -1.43 0.00 0.00 32.58 31.30 1pl4 s HIS 134 CO 0.47 -1.06 1.08 -0.51 -2.00 0.00 0.00 174.74 172.72 1pl4 s LEU 135 N -3.00 3.42 -0.22 5.38 1.43 -1.26 -0.27 118.68 124.14 1pl4 s LEU 135 Ca 0.20 1.89 -0.16 0.00 -1.03 0.00 0.00 54.13 55.03 1pl4 s LEU 135 Cb -0.02 -4.54 0.06 0.00 0.03 0.00 0.00 46.19 41.73 1pl4 s LEU 135 CO 0.09 -1.42 0.57 -1.58 0.23 0.00 0.00 176.35 174.24 1pl4 s GLN 136 N -4.16 0.61 -0.13 1.70 0.74 -0.10 -4.76 119.66 113.56 1pl4 s GLN 136 Ca 0.65 0.93 -0.08 0.00 0.05 0.00 0.00 55.36 56.90 1pl4 s GLN 136 Cb -0.18 0.18 -0.04 0.00 1.10 0.00 0.00 33.01 34.07 1pl4 s GLN 136 CO 0.40 -0.12 0.16 0.42 -0.55 0.00 0.00 175.29 175.60 1pl4 s ILE 137 N 0.99 5.45 0.02 -2.34 1.01 -1.26 -0.14 121.20 124.94 1pl4 s ILE 137 Ca -0.05 0.25 -0.10 0.00 0.00 0.00 0.00 60.65 60.75 1pl4 s ILE 137 Cb -0.05 -3.44 0.01 0.00 0.01 0.00 0.00 42.46 38.98 1pl4 s ILE 137 CO -0.09 0.57 0.20 0.00 0.00 0.00 0.00 174.94 175.62 1pl4 s ALA 138 N -0.66 -0.42 0.03 9.38 0.00 -0.40 -4.99 121.76 124.69 1pl4 s ALA 138 Ca 0.14 -0.15 0.05 0.00 0.00 0.00 0.00 51.96 52.00 1pl4 s ALA 138 Cb -0.12 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 1pl4 s ALA 138 CO 0.03 -0.31 -0.12 0.00 0.00 0.00 0.00 175.76 175.36 1pl4 s ALA 139 N -2.07 2.80 -0.02 0.00 0.00 -1.26 0.25 121.76 121.47 1pl4 s ALA 139 Ca -0.09 -1.11 0.05 0.00 0.00 0.00 0.00 51.96 50.81 1pl4 s ALA 139 Cb -0.03 -0.93 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 1pl4 s ALA 139 CO -0.01 0.59 -0.17 0.00 0.00 0.00 0.00 175.76 176.18 1pl4 s PRO 141 N -0.32 4.21 4.94 0.00 0.04 -1.26 -1.09 135.00 141.51 1pl4 s PRO 141 Ca 0.05 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.24 1pl4 s PRO 141 Cb -0.07 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1pl4 s PRO 141 CO -0.00 -0.05 0.00 0.09 0.04 0.00 0.00 177.00 177.07 1pl4 n ASN 142 N -0.62 0.00 -0.70 6.66 3.02 0.40 -1.25 115.26 122.77 1pl4 n ASN 142 Ca 0.07 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.69 1pl4 n ASN 142 Cb 0.54 0.00 0.19 0.00 -0.61 0.00 0.00 39.78 39.90 1pl4 n ASN 142 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pl4 n GLN 143 N 14.00 2.88 -1.64 3.52 1.13 -1.26 -4.07 117.38 131.93 1pl4 n GLN 143 Ca 0.00 -2.34 -0.48 0.00 -1.94 0.00 0.00 57.00 52.23 1pl4 n GLN 143 Cb 0.00 -1.48 -0.05 0.00 0.11 0.00 0.00 30.24 28.82 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 0.05 3.24 -4.82 1.08 9.92 -0.38 -3.82 116.55 121.82 1pl4 n ASP 144 Ca 0.15 0.82 -0.33 0.00 -0.53 0.00 0.00 54.79 54.89 1pl4 n ASP 144 Cb 0.60 -1.37 -0.07 0.00 -0.64 0.00 0.00 41.12 39.64 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 4.63 4.22 0.06 -0.24 0.04 -1.26 -4.66 135.00 137.78 1pl4 s PRO 145 Ca 0.96 1.09 -0.30 0.00 0.04 0.00 0.00 61.00 62.79 1pl4 s PRO 145 Cb -0.68 -2.22 -0.18 0.00 0.04 0.00 0.00 34.50 31.46 1pl4 s PRO 145 CO 0.50 -0.01 1.57 1.25 0.04 0.00 0.00 177.00 180.35 1pl4 h LEU 146 N 1.97 -0.59 -0.27 -3.56 5.85 -1.91 -2.14 115.31 114.66 1pl4 h LEU 146 Ca -0.49 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.12 1pl4 h LEU 146 Cb 1.18 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.36 1pl4 h LEU 146 CO 0.61 -0.38 -0.25 -0.61 -0.34 0.00 0.00 178.44 177.48 1pl4 h GLN 147 N -0.76 0.65 0.00 1.25 4.15 -1.88 -0.09 115.11 118.43 1pl4 h GLN 147 Ca -0.07 -0.33 -0.03 0.00 0.77 0.00 0.00 58.65 58.98 1pl4 h GLN 147 Cb 0.56 0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.26 1pl4 h GLN 147 CO 0.12 0.94 -0.16 0.78 -1.93 0.00 0.00 178.83 178.57 1pl4 h GLY 148 N 0.38 0.00 0.00 2.39 0.00 -1.87 -0.32 103.07 103.65 1pl4 h GLY 148 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1pl4 h GLY 148 CO 0.06 0.00 -1.30 -1.30 0.00 0.00 0.00 176.54 174.01 1pl4 n THR 149 N -3.81 0.00 0.00 4.70 -2.24 -0.80 -4.75 114.28 107.38 1pl4 n THR 149 Ca -0.02 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1pl4 n THR 149 Cb 0.27 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 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 -1.76 0.00 0.00 4.28 -2.24 -0.05 -5.05 114.28 109.46 1pl4 n THR 150 Ca -0.01 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1pl4 n THR 150 Cb 0.33 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 69.54 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 0.49 2.84 3.74 3.38 0.00 -0.13 -5.01 105.19 110.50 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 4.38 -0.16 0.99 1.43 -1.26 -4.78 118.68 119.29 1pl4 s LEU 152 Ca 0.00 2.67 -0.25 0.00 -1.03 0.00 0.00 54.13 55.52 1pl4 s LEU 152 Cb 0.00 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.58 1pl4 s LEU 152 CO 0.00 -0.72 0.80 -0.63 0.23 0.00 0.00 176.35 176.03 1pl4 s ILE 153 N 0.10 4.91 0.19 -0.59 -1.09 -0.54 -3.03 121.20 121.16 1pl4 s ILE 153 Ca 0.60 1.58 -0.30 0.00 -2.23 0.00 0.00 60.65 60.30 1pl4 s ILE 153 Cb -0.42 -4.11 -0.08 0.00 -1.58 0.00 0.00 42.46 36.26 1pl4 s ILE 153 CO 0.42 0.06 1.24 -2.16 -1.23 0.00 0.00 174.94 173.27 1pl4 s PRO 154 N 1.96 4.45 -0.07 2.79 0.04 -1.26 -0.65 135.00 142.25 1pl4 s PRO 154 Ca 0.38 1.94 -0.02 0.00 0.04 0.00 0.00 61.00 63.33 1pl4 s PRO 154 Cb -0.17 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 31.11 1pl4 s PRO 154 CO 0.13 -0.14 -0.08 1.28 0.04 0.00 0.00 177.00 178.22 1pl4 n LEU 155 N 2.51 1.46 -3.74 -3.56 4.77 0.04 -4.90 117.00 113.58 1pl4 n LEU 155 Ca 0.05 0.04 -0.16 0.00 -0.03 0.00 0.00 56.01 55.92 1pl4 n LEU 155 Cb 0.44 -0.23 -0.16 0.00 -2.33 0.00 0.00 43.42 41.14 1pl4 n LEU 155 CO 0.56 0.33 -0.30 -0.22 -1.33 0.00 0.00 177.39 176.43 1pl4 s LEU 156 N -6.04 0.69 -0.06 2.23 2.96 -0.90 -4.57 118.68 112.98 1pl4 s LEU 156 Ca -0.10 0.15 0.03 0.00 -0.22 0.00 0.00 54.13 53.99 1pl4 s LEU 156 Cb 0.03 0.08 -0.02 0.00 0.50 0.00 0.00 46.19 46.78 1pl4 s LEU 156 CO 0.14 -0.17 -0.15 -0.83 -1.32 0.00 0.00 176.35 174.03 1pl4 s GLY 157 N 1.42 1.52 -0.24 7.98 0.00 -1.26 -0.67 107.32 116.06 1pl4 s GLY 157 Ca -0.05 -0.97 0.02 0.00 0.00 0.00 0.00 44.72 43.72 1pl4 s GLY 157 CO -0.04 -0.65 -0.12 -0.42 0.00 0.00 0.00 173.10 171.86 1pl4 s ILE 158 N -0.49 2.19 -0.15 0.90 -1.09 0.49 -4.88 121.20 118.17 1pl4 s ILE 158 Ca 0.06 -1.47 -0.29 0.00 -2.23 0.00 0.00 60.65 56.72 1pl4 s ILE 158 Cb -0.12 -2.21 -0.02 0.00 -1.58 0.00 0.00 42.46 38.54 1pl4 s ILE 158 CO 0.02 0.09 1.31 -0.62 -1.23 0.00 0.00 174.94 174.51 1pl4 s ASP 159 N 1.15 6.91 -0.20 3.58 -1.08 -1.26 -1.11 116.67 124.66 1pl4 s ASP 159 Ca -0.06 1.76 0.14 0.00 -0.52 0.00 0.00 52.55 53.87 1pl4 s ASP 159 Cb -0.18 -2.54 0.42 0.00 -1.46 0.00 0.00 42.92 39.16 1pl4 s ASP 159 CO -0.07 -0.78 1.30 1.33 0.52 0.00 0.00 175.17 177.48 1pl4 n VAL 160 N 5.36 2.21 -1.81 1.11 0.24 -0.14 -4.85 118.33 120.45 1pl4 n VAL 160 Ca 0.14 -2.55 -0.39 0.00 -2.04 0.00 0.00 64.34 59.50 1pl4 n VAL 160 Cb 0.45 -0.26 0.03 0.00 -1.47 0.00 0.00 33.84 32.58 1pl4 n VAL 160 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1pl4 s TRP 161 N -3.05 2.41 0.43 6.34 0.52 -1.19 -4.49 118.94 119.91 1pl4 s TRP 161 Ca 0.39 1.32 0.13 0.00 0.02 0.00 0.00 56.10 57.96 1pl4 s TRP 161 Cb 0.35 -3.85 1.01 0.00 -1.15 0.00 0.00 33.47 29.83 1pl4 s TRP 161 CO 0.01 -2.86 1.99 0.93 0.02 0.00 0.00 176.95 177.04 1pl4 h GLU 162 N 1.98 0.41 0.00 4.98 5.08 -1.94 -0.27 114.58 124.82 1pl4 h GLU 162 Ca -0.51 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 1pl4 h GLU 162 Cb 1.28 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1pl4 h GLU 162 CO 0.60 0.27 0.00 1.12 -1.00 0.00 0.00 179.01 179.99 1pl4 h HIS 163 N 0.42 0.00 0.00 4.33 2.07 -1.99 0.31 115.15 120.29 1pl4 h HIS 163 Ca 0.26 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.78 1pl4 h HIS 163 Cb 0.46 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.44 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 -2.03 2.24 -0.10 6.11 0.00 -0.11 -4.53 120.51 122.08 1pl4 n ALA 164 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1pl4 n ALA 164 Cb 0.10 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.10 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 -1.79 0.00 -0.28 0.00 0.18 -0.68 -4.98 117.16 109.61 1pl4 n TYR 165 Ca 0.06 0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.79 1pl4 n TYR 165 Cb 0.35 0.00 0.06 0.00 -0.38 0.00 0.00 39.34 39.37 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 1.08 -0.75 -3.48 3.57 -1.15 0.19 116.94 116.40 1pl4 h PHE 166 Ca 0.00 -0.04 0.14 0.00 3.53 0.00 0.00 57.97 61.60 1pl4 h PHE 166 Cb 0.00 -0.34 -0.10 0.00 2.79 0.00 0.00 35.95 38.30 1pl4 h PHE 166 CO 0.00 0.78 0.29 -0.07 -2.23 0.00 0.00 178.31 177.09 1pl4 h LEU 167 N 1.07 0.26 0.03 0.59 3.38 -1.88 0.23 115.31 118.99 1pl4 h LEU 167 Ca 0.26 0.11 -0.29 0.00 0.09 0.00 0.00 57.88 58.06 1pl4 h LEU 167 Cb 0.09 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1pl4 h LEU 167 CO -0.04 0.09 -1.59 1.67 0.09 0.00 0.00 178.44 178.66 1pl4 n GLN 168 N -5.01 0.62 0.00 1.13 7.27 -0.94 -4.58 117.38 115.86 1pl4 n GLN 168 Ca 0.14 0.46 0.08 0.00 0.07 0.00 0.00 57.00 57.75 1pl4 n GLN 168 Cb 0.42 -1.71 0.04 0.00 2.41 0.00 0.00 30.24 31.40 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 -4.15 0.00 -2.83 3.69 4.01 0.63 -5.07 117.16 113.45 1pl4 n TYR 169 Ca -0.35 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.39 1pl4 n TYR 169 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.83 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 0.48 0.00 0.00 -0.72 5.02 0.79 -1.43 118.16 122.30 1pl4 n LYS 170 Ca 0.08 0.00 0.16 0.00 -2.02 0.00 0.00 58.31 56.53 1pl4 n LYS 170 Cb 0.37 0.00 0.91 0.00 -0.02 0.00 0.00 35.03 36.29 1pl4 n LYS 170 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1pl4 n ASN 171 N 1.28 0.00 -3.91 4.39 3.02 -1.26 -4.27 115.26 114.50 1pl4 n ASN 171 Ca 0.00 -0.82 -0.43 0.00 -0.03 0.00 0.00 54.58 53.31 1pl4 n ASN 171 Cb 0.00 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.11 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 -1.06 4.22 -0.24 2.41 0.31 -0.51 -4.79 118.33 118.66 1pl4 n VAL 172 Ca 0.22 -4.25 0.13 0.00 -0.01 0.00 0.00 64.34 60.43 1pl4 n VAL 172 Cb 0.14 -2.40 0.41 0.00 -0.91 0.00 0.00 33.84 31.08 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 5.93 0.59 -0.81 5.55 2.43 -1.83 -1.50 114.38 124.76 1pl4 h ARG 173 Ca 0.41 -0.04 0.11 0.00 -0.81 0.00 0.00 59.98 59.66 1pl4 h ARG 173 Cb 0.66 -0.13 -0.06 0.00 -0.42 0.00 0.00 29.97 30.02 1pl4 h ARG 173 CO 1.62 0.39 0.53 -1.35 -1.51 0.00 0.00 179.97 179.65 1pl4 h PRO 174 N 0.61 0.65 -0.48 0.20 0.11 -1.97 -1.46 132.00 129.66 1pl4 h PRO 174 Ca 0.43 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.41 1pl4 h PRO 174 Cb 0.78 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.72 1pl4 h PRO 174 CO -0.19 0.43 -0.08 -0.44 -0.21 0.00 0.00 178.00 177.51 1pl4 h ASP 175 N 0.67 0.85 -0.42 -2.05 3.32 -1.66 -1.23 116.42 115.90 1pl4 h ASP 175 Ca 0.38 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1pl4 h ASP 175 Cb 0.57 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 1pl4 h ASP 175 CO -0.15 0.96 0.26 0.22 -1.72 0.00 0.00 179.24 178.80 1pl4 h TYR 176 N 0.78 0.55 -0.49 4.55 3.20 -1.32 -1.77 116.97 122.47 1pl4 h TYR 176 Ca 0.13 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 1pl4 h TYR 176 Cb 0.58 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 1pl4 h TYR 176 CO 0.03 0.38 0.19 -0.07 -1.64 0.00 0.00 178.16 177.06 1pl4 h LEU 177 N 0.56 0.69 -1.01 2.82 -0.00 -1.10 -0.38 115.31 116.89 1pl4 h LEU 177 Ca 0.15 -0.17 0.05 0.00 -0.00 0.00 0.00 57.88 57.91 1pl4 h LEU 177 Cb -0.01 -0.18 -0.06 0.00 -0.00 0.00 0.00 40.66 40.41 1pl4 h LEU 177 CO -0.03 0.68 0.66 0.50 -0.00 0.00 0.00 178.44 180.24 1pl4 h LYS 178 N 0.66 1.19 -0.04 1.13 3.64 -1.11 -2.83 116.57 119.20 1pl4 h LYS 178 Ca 0.16 -0.07 -0.21 0.00 -1.27 0.00 0.00 60.65 59.27 1pl4 h LYS 178 Cb 0.21 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.76 1pl4 h LYS 178 CO -0.01 0.79 -0.84 0.00 -2.27 0.00 0.00 179.45 177.12 1pl4 h ALA 179 N 1.44 0.46 0.00 5.00 0.00 -0.45 -3.24 119.26 122.47 1pl4 h ALA 179 Ca 0.42 -0.66 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1pl4 h ALA 179 Cb 0.09 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1pl4 h ALA 179 CO -0.15 0.79 -0.14 0.97 0.00 0.00 0.00 179.25 180.72 1pl4 h ILE 180 N 0.27 0.46 -0.62 0.00 2.10 -0.84 -1.79 117.51 117.09 1pl4 h ILE 180 Ca -0.06 -0.70 0.14 0.00 1.08 0.00 0.00 64.86 65.32 1pl4 h ILE 180 Cb 1.45 1.49 -0.03 0.00 -1.09 0.00 0.00 36.82 38.63 1pl4 h ILE 180 CO 0.15 0.13 0.43 -0.50 -1.08 0.00 0.00 178.15 177.27 1pl4 h TRP 181 N 0.00 0.28 0.00 2.19 4.06 -1.60 -0.56 115.95 120.31 1pl4 h TRP 181 Ca -0.00 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.95 1pl4 h TRP 181 Cb 0.47 -0.09 -0.00 0.00 -1.00 0.00 0.00 29.16 28.55 1pl4 h TRP 181 CO 0.00 0.11 -0.03 -0.91 -3.56 0.00 0.00 178.44 174.05 1pl4 h ASN 182 N 0.24 0.00 -0.08 -3.49 2.35 -1.52 -3.09 115.58 109.99 1pl4 h ASN 182 Ca 0.30 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 1pl4 h ASN 182 Cb 0.83 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.20 1pl4 h ASN 182 CO -0.06 0.03 0.00 1.33 -1.65 0.00 0.00 177.43 177.08 1pl4 n VAL 183 N -3.20 1.49 -2.29 2.81 0.24 -0.23 -2.50 118.33 114.64 1pl4 n VAL 183 Ca -0.01 -1.57 -0.42 0.00 -2.04 0.00 0.00 64.34 60.30 1pl4 n VAL 183 Cb 0.22 0.13 -0.03 0.00 -1.47 0.00 0.00 33.84 32.69 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 -1.92 3.62 -0.93 1.34 -1.09 -1.15 -0.06 121.20 121.01 1pl4 s ILE 184 Ca 0.20 1.19 -0.19 0.00 -2.23 0.00 0.00 60.65 59.62 1pl4 s ILE 184 Cb 0.16 -3.76 0.13 0.00 -1.58 0.00 0.00 42.46 37.41 1pl4 s ILE 184 CO 0.04 0.11 1.13 0.21 -1.23 0.00 0.00 174.94 175.20 1pl4 s ASN 185 N 0.96 6.63 0.54 3.58 3.04 0.39 -0.38 114.94 129.69 1pl4 s ASN 185 Ca 0.61 -2.03 0.32 0.00 0.04 0.00 0.00 52.86 51.80 1pl4 s ASN 185 Cb -0.33 -2.40 1.41 0.00 -1.54 0.00 0.00 41.25 38.38 1pl4 s ASN 185 CO 0.31 -1.07 2.01 -0.50 -3.04 0.00 0.00 177.10 174.80 1pl4 h TRP 186 N 8.85 0.00 -0.38 0.43 4.06 -1.85 -2.01 115.95 125.05 1pl4 h TRP 186 Ca 0.16 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.98 1pl4 h TRP 186 Cb 1.02 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.17 1pl4 h TRP 186 CO 1.17 0.06 -0.27 1.49 -3.56 0.00 0.00 178.44 177.33 1pl4 h GLU 187 N 0.00 0.80 -0.22 0.49 4.81 -1.97 -0.89 114.58 117.60 1pl4 h GLU 187 Ca -0.00 -0.35 -0.09 0.00 -0.13 0.00 0.00 59.36 58.80 1pl4 h GLU 187 Cb 0.48 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 1pl4 h GLU 187 CO 0.01 0.97 -0.20 -0.97 -0.73 0.00 0.00 179.01 178.09 1pl4 h ASN 188 N 0.68 0.56 -0.92 1.04 -0.73 -1.68 -2.11 115.58 112.43 1pl4 h ASN 188 Ca 0.08 -0.47 -0.01 0.00 1.87 0.00 0.00 56.30 57.77 1pl4 h ASN 188 Cb 0.80 -0.16 -0.04 0.00 0.27 0.00 0.00 38.32 39.19 1pl4 h ASN 188 CO 0.07 0.91 0.52 0.58 -0.37 0.00 0.00 177.43 179.13 1pl4 h VAL 189 N 0.21 1.26 -0.69 2.57 2.07 -1.28 -1.29 116.25 119.10 1pl4 h VAL 189 Ca 0.04 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 66.94 1pl4 h VAL 189 Cb 0.74 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 1pl4 h VAL 189 CO 0.05 0.29 0.45 0.74 0.02 0.00 0.00 177.57 179.12 1pl4 h THR 190 N 1.28 1.16 -0.48 2.57 2.02 -1.16 -1.27 112.91 117.04 1pl4 h THR 190 Ca 0.32 -0.31 -0.04 0.00 0.77 0.00 0.00 66.41 67.15 1pl4 h THR 190 Cb 0.01 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.56 1pl4 h THR 190 CO -0.05 0.17 0.15 -0.33 0.37 0.00 0.00 175.52 175.83 1pl4 h GLU 191 N 0.92 0.74 -1.00 6.66 5.08 -0.62 0.17 114.58 126.52 1pl4 h GLU 191 Ca 0.26 -0.16 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1pl4 h GLU 191 Cb -0.09 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.00 1pl4 h GLU 191 CO -0.06 0.70 0.66 0.00 -1.00 0.00 0.00 179.01 179.31 1pl4 h ARG 192 N 0.64 1.31 0.03 2.33 3.08 -1.06 -2.25 114.38 118.45 1pl4 h ARG 192 Ca 0.15 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 1pl4 h ARG 192 Cb 0.26 -0.30 0.00 0.00 0.08 0.00 0.00 29.97 30.02 1pl4 h ARG 192 CO -0.01 0.87 -0.01 -0.92 -1.07 0.00 0.00 179.97 178.83 1pl4 h TYR 193 N 1.35 -0.03 -0.03 3.04 3.20 -0.75 -3.02 116.97 120.73 1pl4 h TYR 193 Ca 0.37 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.25 1pl4 h TYR 193 Cb -0.14 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.14 1pl4 h TYR 193 CO -0.00 0.38 0.03 0.52 -1.64 0.00 0.00 178.16 177.45 1pl4 h MET 194 N -0.46 0.00 0.00 1.82 2.86 -0.52 -0.37 114.93 118.26 1pl4 h MET 194 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1pl4 h MET 194 Cb 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1pl4 h MET 194 CO 0.01 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.98 1pl4 h ALA 195 N 1.96 1.00 0.00 6.32 0.00 -1.29 -2.32 119.26 124.93 1pl4 h ALA 195 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1pl4 h ALA 195 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1pl4 h ALA 195 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25