#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 3.42 0.09 2.13 3.76 -1.26 -5.08 115.29 118.36 1pl4 s HIS 2 Ca 0.00 1.27 0.04 0.00 -0.15 0.00 0.00 55.06 56.22 1pl4 s HIS 2 Cb 0.00 -2.61 -0.03 0.00 1.11 0.00 0.00 32.58 31.05 1pl4 s HIS 2 CO 0.00 -0.12 -0.11 -1.54 -0.85 0.00 0.00 174.74 172.12 1pl4 s SER 3 N -2.79 1.49 -0.17 1.40 1.04 -1.26 -4.95 113.70 108.46 1pl4 s SER 3 Ca 0.55 -0.78 -0.29 0.00 0.48 0.00 0.00 55.95 55.91 1pl4 s SER 3 Cb -0.10 -0.00 -0.01 0.00 0.10 0.00 0.00 66.02 66.01 1pl4 s SER 3 CO 0.25 -0.23 1.26 -0.22 0.98 0.00 0.00 173.24 175.28 1pl4 s LEU 4 N -2.33 4.17 0.23 2.42 2.96 -1.26 -4.99 118.68 119.88 1pl4 s LEU 4 Ca 0.04 1.66 -0.30 0.00 -0.22 0.00 0.00 54.13 55.32 1pl4 s LEU 4 Cb -0.04 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 43.02 1pl4 s LEU 4 CO 0.01 -0.77 1.04 -2.16 -1.32 0.00 0.00 176.35 173.14 1pl4 s PRO 5 N 3.52 4.70 0.66 0.98 0.04 -1.26 -5.02 135.00 138.63 1pl4 s PRO 5 Ca 0.54 1.66 -0.18 0.00 0.04 0.00 0.00 61.00 63.07 1pl4 s PRO 5 Cb -0.21 -3.25 -0.01 0.00 0.04 0.00 0.00 34.50 31.07 1pl4 s PRO 5 CO 0.15 0.28 1.19 -0.25 0.04 0.00 0.00 177.00 178.40 1pl4 n ASP 6 N 1.66 1.58 -4.73 6.66 8.00 -1.26 -4.97 116.55 123.48 1pl4 n ASP 6 Ca -0.00 0.79 -0.34 0.00 0.71 0.00 0.00 54.79 55.95 1pl4 n ASP 6 Cb 0.46 -1.50 0.09 0.00 -0.02 0.00 0.00 41.12 40.14 1pl4 n ASP 6 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1pl4 s LEU 7 N -3.85 3.32 0.00 0.64 1.43 -1.26 -4.91 118.68 114.05 1pl4 s LEU 7 Ca 0.80 2.29 0.24 0.00 -1.03 0.00 0.00 54.13 56.43 1pl4 s LEU 7 Cb -0.38 -4.58 1.30 0.00 0.03 0.00 0.00 46.19 42.56 1pl4 s LEU 7 CO 0.43 -2.17 1.78 -2.65 0.23 0.00 0.00 176.35 173.97 1pl4 n PRO 8 N -2.70 0.52 -3.99 1.29 -0.02 -1.26 -4.87 135.00 123.97 1pl4 n PRO 8 Ca 0.13 0.04 -0.09 0.00 -2.02 0.00 0.00 63.50 61.55 1pl4 n PRO 8 Cb 0.51 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.43 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 -2.31 0.39 0.73 6.00 1.13 -1.26 -5.09 117.35 116.94 1pl4 s TYR 9 Ca 0.28 -0.74 -0.11 0.00 -1.41 0.00 0.00 57.07 55.10 1pl4 s TYR 9 Cb 0.16 0.12 0.03 0.00 -1.10 0.00 0.00 41.96 41.17 1pl4 s TYR 9 CO 0.32 -0.93 1.08 -0.51 -2.51 0.00 0.00 175.55 172.99 1pl4 s ASP 10 N -3.01 4.97 0.59 -0.18 1.01 -1.26 -4.93 116.67 113.86 1pl4 s ASP 10 Ca 0.22 1.72 0.30 0.00 0.71 0.00 0.00 52.55 55.50 1pl4 s ASP 10 Cb 0.00 -2.51 1.76 0.00 1.01 0.00 0.00 42.92 43.18 1pl4 s ASP 10 CO 0.07 -1.72 2.18 1.88 0.21 0.00 0.00 175.17 177.80 1pl4 h TYR 11 N -0.88 0.00 -0.57 4.23 0.05 -1.96 -1.32 116.97 116.51 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 0.60 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 178.12 1pl4 n GLY 12 N -1.35 2.83 0.30 3.88 0.00 -1.26 -3.93 105.19 105.65 1pl4 n GLY 12 Ca -0.01 -0.77 0.19 0.00 0.00 0.00 0.00 46.02 45.43 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 3.52 1.03 -0.63 4.61 0.00 -1.59 -2.89 119.26 123.31 1pl4 h ALA 13 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1pl4 h ALA 13 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1pl4 h ALA 13 CO 0.13 0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.69 1pl4 n LEU 14 N -3.16 3.76 -4.75 0.00 4.77 -1.26 -4.40 117.00 111.96 1pl4 n LEU 14 Ca -0.01 -1.89 -0.37 0.00 -0.03 0.00 0.00 56.01 53.71 1pl4 n LEU 14 Cb 0.22 -0.42 0.03 0.00 -2.33 0.00 0.00 43.42 40.92 1pl4 n LEU 14 CO 0.25 0.92 0.90 -1.61 -1.33 0.00 0.00 177.39 176.51 1pl4 s GLU 15 N -1.09 3.21 0.00 3.23 0.41 -1.10 -1.17 118.70 122.19 1pl4 s GLU 15 Ca 0.45 1.98 0.16 0.00 -0.41 0.00 0.00 54.97 57.15 1pl4 s GLU 15 Cb 0.24 -2.17 0.47 0.00 -1.78 0.00 0.00 34.13 30.89 1pl4 s GLU 15 CO 0.31 -1.06 1.38 -0.35 -0.49 0.00 0.00 175.26 175.05 1pl4 n PRO 16 N -1.12 2.02 -0.07 0.39 -0.04 -1.26 -4.90 135.00 130.02 1pl4 n PRO 16 Ca 0.11 -1.57 -0.14 0.00 -0.04 0.00 0.00 63.50 61.86 1pl4 n PRO 16 Cb 0.47 -1.37 -0.06 0.00 -0.04 0.00 0.00 33.50 32.50 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 2.69 0.73 -3.25 0.54 3.86 -1.48 -3.40 115.15 114.83 1pl4 h HIS 17 Ca 0.00 -0.24 -0.51 0.00 -1.16 0.00 0.00 60.37 58.46 1pl4 h HIS 17 Cb 0.61 -0.14 -0.38 0.00 1.06 0.00 0.00 27.41 28.56 1pl4 h HIS 17 CO 0.26 0.97 -0.79 0.42 0.86 0.00 0.00 177.93 179.65 1pl4 s ILE 18 N -4.19 0.85 0.71 2.45 1.01 -0.93 -4.78 121.20 116.32 1pl4 s ILE 18 Ca -0.13 -0.31 -0.11 0.00 0.00 0.00 0.00 60.65 60.10 1pl4 s ILE 18 Cb 0.07 -0.99 0.02 0.00 0.01 0.00 0.00 42.46 41.57 1pl4 s ILE 18 CO 0.81 0.22 1.08 0.54 0.00 0.00 0.00 174.94 177.59 1pl4 s ASN 19 N 1.76 5.33 0.35 3.58 2.20 -1.26 -3.45 114.94 123.45 1pl4 s ASN 19 Ca 0.03 1.34 0.07 0.00 -0.94 0.00 0.00 52.86 53.37 1pl4 s ASN 19 Cb -0.14 -2.19 0.65 0.00 -2.00 0.00 0.00 41.25 37.58 1pl4 s ASN 19 CO -0.07 -1.44 1.85 0.00 -2.94 0.00 0.00 177.10 174.50 1pl4 h ALA 20 N -0.72 1.37 -0.25 3.54 0.00 -1.90 -2.18 119.26 119.12 1pl4 h ALA 20 Ca -0.45 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.15 1pl4 h ALA 20 Cb 1.24 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1pl4 h ALA 20 CO 0.61 0.43 -0.06 0.37 0.00 0.00 0.00 179.25 180.60 1pl4 h GLN 21 N 0.29 0.48 -0.22 0.00 4.15 -1.93 0.15 115.11 118.04 1pl4 h GLN 21 Ca 0.05 -0.19 0.05 0.00 0.77 0.00 0.00 58.65 59.34 1pl4 h GLN 21 Cb 0.48 -0.03 -0.05 0.00 0.21 0.00 0.00 27.48 28.09 1pl4 h GLN 21 CO 0.03 0.71 -0.11 0.82 -1.93 0.00 0.00 178.83 178.35 1pl4 h ILE 22 N 0.23 0.66 -0.27 2.39 2.04 -1.87 -2.00 117.51 118.68 1pl4 h ILE 22 Ca 0.06 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.92 1pl4 h ILE 22 Cb 0.53 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 1pl4 h ILE 22 CO 0.03 0.00 0.15 0.24 0.00 0.00 0.00 178.15 178.57 1pl4 h MET 23 N -0.08 0.38 -0.65 2.37 2.86 -1.25 0.78 114.93 119.33 1pl4 h MET 23 Ca 0.12 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.66 1pl4 h MET 23 Cb 0.26 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.82 1pl4 h MET 23 CO -0.28 0.32 0.17 0.37 1.06 0.00 0.00 176.91 178.56 1pl4 h GLN 24 N 0.33 1.04 -0.37 1.72 4.15 -0.84 -1.86 115.11 119.28 1pl4 h GLN 24 Ca 0.10 -0.24 -0.09 0.00 0.77 0.00 0.00 58.65 59.19 1pl4 h GLN 24 Cb 0.05 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 1pl4 h GLN 24 CO -0.02 0.92 -0.11 -0.07 -1.93 0.00 0.00 178.83 177.63 1pl4 h LEU 25 N 0.96 0.75 -0.47 -2.39 3.38 -1.19 -0.21 115.31 116.13 1pl4 h LEU 25 Ca 0.21 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1pl4 h LEU 25 Cb 0.35 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1pl4 h LEU 25 CO 0.00 0.95 0.30 -0.74 0.09 0.00 0.00 178.44 179.03 1pl4 h HIS 26 N 0.53 0.62 0.00 1.13 2.76 -0.48 -0.99 115.15 118.72 1pl4 h HIS 26 Ca 0.09 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.26 1pl4 h HIS 26 Cb 0.63 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 29.39 1pl4 h HIS 26 CO 0.05 0.42 -0.02 1.25 -1.30 0.00 0.00 177.93 178.33 1pl4 h HIS 27 N 0.63 0.00 0.00 5.26 -0.00 -1.38 0.02 115.15 119.68 1pl4 h HIS 27 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.54 1pl4 h HIS 27 Cb -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.38 1pl4 h HIS 27 CO -0.03 0.51 0.00 0.66 -0.00 0.00 0.00 177.93 179.06 1pl4 h SER 28 N -1.00 0.00 0.00 3.26 4.64 -1.05 -2.65 113.55 116.76 1pl4 h SER 28 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pl4 h SER 28 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1pl4 h SER 28 CO -0.00 0.00 -0.42 0.29 -0.87 0.00 0.00 176.83 175.83 1pl4 n LYS 29 N -2.96 0.22 0.43 4.77 4.76 -0.45 -4.49 118.16 120.44 1pl4 n LYS 29 Ca 0.04 0.09 -0.17 0.00 -2.87 0.00 0.00 58.31 55.40 1pl4 n LYS 29 Cb 0.51 -0.84 -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 -0.42 -1.03 -0.58 2.13 2.76 -1.21 -0.43 115.15 116.37 1pl4 h HIS 30 Ca 0.00 -0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.12 1pl4 h HIS 30 Cb 0.42 0.34 -0.03 0.00 1.55 0.00 0.00 27.41 29.69 1pl4 h HIS 30 CO -0.18 -0.64 0.27 1.25 -1.30 0.00 0.00 177.93 177.32 1pl4 h HIS 31 N -1.29 0.85 -0.74 5.26 -0.00 -1.04 -2.31 115.15 115.88 1pl4 h HIS 31 Ca -0.11 -0.05 0.16 0.00 -0.00 0.00 0.00 60.37 60.37 1pl4 h HIS 31 Cb 0.86 -0.26 -0.11 0.00 -0.00 0.00 0.00 27.41 27.90 1pl4 h HIS 31 CO 0.00 0.66 0.19 0.00 -0.00 0.00 0.00 177.93 178.79 1pl4 h ALA 32 N 1.10 0.97 -0.99 5.26 0.00 -1.43 0.45 119.26 124.62 1pl4 h ALA 32 Ca 0.20 0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.28 1pl4 h ALA 32 Cb 0.14 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1pl4 h ALA 32 CO -0.02 -0.33 0.65 0.00 0.00 0.00 0.00 179.25 179.54 1pl4 h ALA 33 N 1.61 1.27 -0.58 0.00 0.00 -0.53 -2.70 119.26 118.33 1pl4 h ALA 33 Ca 0.42 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 1pl4 h ALA 33 Cb 0.71 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1pl4 h ALA 33 CO -0.50 0.67 -0.06 1.88 0.00 0.00 0.00 179.25 181.24 1pl4 h TYR 34 N 1.35 1.16 0.02 0.00 0.05 -0.58 -2.14 116.97 116.83 1pl4 h TYR 34 Ca 0.36 -0.22 0.01 0.00 0.05 0.00 0.00 58.73 58.93 1pl4 h TYR 34 Cb -0.14 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.30 1pl4 h TYR 34 CO 0.00 1.05 -0.06 0.28 -1.05 0.00 0.00 178.16 178.38 1pl4 h VAL 35 N 0.95 0.86 -0.55 -2.88 2.07 -1.03 0.40 116.25 116.06 1pl4 h VAL 35 Ca 0.16 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.61 1pl4 h VAL 35 Cb 0.62 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1pl4 h VAL 35 CO 0.04 0.00 0.10 -1.13 0.02 0.00 0.00 177.57 176.60 1pl4 h ASN 36 N -0.11 0.86 0.31 0.57 -0.00 -1.39 -1.50 115.58 114.33 1pl4 h ASN 36 Ca 0.02 -0.25 -0.08 0.00 -0.00 0.00 0.00 56.30 55.99 1pl4 h ASN 36 Cb 0.13 -0.23 -0.01 0.00 -0.00 0.00 0.00 38.32 38.20 1pl4 h ASN 36 CO -0.05 0.90 -0.35 0.78 -0.00 0.00 0.00 177.43 178.70 1pl4 h ASN 37 N 0.80 0.07 0.09 1.15 -0.26 -1.23 -1.39 115.58 114.80 1pl4 h ASN 37 Ca 0.17 -0.02 -0.00 0.00 -0.56 0.00 0.00 56.30 55.88 1pl4 h ASN 37 Cb 0.39 -0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.63 1pl4 h ASN 37 CO 0.01 0.42 -0.04 0.25 -1.06 0.00 0.00 177.43 177.01 1pl4 h LEU 38 N 0.06 -0.10 -0.34 1.61 5.85 -0.48 -0.15 115.31 121.75 1pl4 h LEU 38 Ca 0.01 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1pl4 h LEU 38 Cb 0.66 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 1pl4 h LEU 38 CO 0.05 0.00 0.18 0.78 -0.34 0.00 0.00 178.44 179.11 1pl4 h ASN 39 N -0.19 0.27 -0.47 1.25 2.35 -0.91 0.56 115.58 118.44 1pl4 h ASN 39 Ca -0.01 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1pl4 h ASN 39 Cb 0.16 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 1pl4 h ASN 39 CO 0.02 0.20 0.18 0.58 -1.65 0.00 0.00 177.43 176.75 1pl4 h VAL 40 N 0.36 1.21 -0.60 2.81 2.07 -1.25 -1.62 116.25 119.24 1pl4 h VAL 40 Ca 0.14 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1pl4 h VAL 40 Cb 0.04 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 1pl4 h VAL 40 CO -0.09 0.25 0.35 0.74 0.02 0.00 0.00 177.57 178.84 1pl4 h THR 41 N 0.62 1.18 -0.96 2.57 2.02 -0.66 -0.29 112.91 117.40 1pl4 h THR 41 Ca 0.16 -0.42 0.06 0.00 0.77 0.00 0.00 66.41 66.98 1pl4 h THR 41 Cb 0.21 0.37 -0.06 0.00 -1.74 0.00 0.00 68.15 66.93 1pl4 h THR 41 CO -0.01 0.19 0.62 -0.33 0.37 0.00 0.00 175.52 176.36 1pl4 h GLU 42 N 0.81 1.08 -0.03 6.66 5.08 -0.70 0.50 114.58 127.98 1pl4 h GLU 42 Ca 0.21 -0.06 -0.17 0.00 -1.00 0.00 0.00 59.36 58.34 1pl4 h GLU 42 Cb -0.00 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 1pl4 h GLU 42 CO -0.04 0.71 -0.72 0.93 -1.00 0.00 0.00 179.01 178.89 1pl4 h GLU 43 N 1.11 0.20 -0.30 2.33 5.08 -0.49 -1.13 114.58 121.38 1pl4 h GLU 43 Ca 0.41 -0.17 -0.09 0.00 -1.00 0.00 0.00 59.36 58.51 1pl4 h GLU 43 Cb 0.18 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1pl4 h GLU 43 CO -0.16 0.84 -0.19 0.87 -1.00 0.00 0.00 179.01 179.37 1pl4 h LYS 44 N 0.13 0.55 -0.23 2.33 1.57 -0.52 -2.79 116.57 117.62 1pl4 h LYS 44 Ca -0.02 -0.19 -0.13 0.00 -1.87 0.00 0.00 60.65 58.44 1pl4 h LYS 44 Cb 1.28 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 1pl4 h LYS 44 CO 0.11 0.71 -0.40 -0.92 -0.57 0.00 0.00 179.45 178.38 1pl4 h TYR 45 N 0.49 0.62 -0.49 -1.35 5.03 -0.22 -1.94 116.97 119.12 1pl4 h TYR 45 Ca 0.08 -0.18 -0.04 0.00 2.58 0.00 0.00 58.73 61.17 1pl4 h TYR 45 Cb 0.61 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.73 1pl4 h TYR 45 CO 0.02 0.85 0.14 0.37 -1.32 0.00 0.00 178.16 178.22 1pl4 h GLN 46 N 0.43 0.74 -0.21 1.82 5.75 -0.98 0.13 115.11 122.79 1pl4 h GLN 46 Ca 0.04 -0.13 -0.04 0.00 -0.15 0.00 0.00 58.65 58.37 1pl4 h GLN 46 Cb 0.89 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 29.32 1pl4 h GLN 46 CO 0.08 0.66 -0.01 0.93 -2.65 0.00 0.00 178.83 177.83 1pl4 h GLU 47 N 0.72 0.38 -0.91 1.69 5.08 -1.20 -2.07 114.58 118.27 1pl4 h GLU 47 Ca 0.16 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1pl4 h GLU 47 Cb 0.24 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 1pl4 h GLU 47 CO -0.01 0.59 0.56 0.00 -1.00 0.00 0.00 179.01 179.16 1pl4 h ALA 48 N 0.78 1.16 0.06 3.43 0.00 -0.92 -2.69 119.26 121.07 1pl4 h ALA 48 Ca 0.06 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1pl4 h ALA 48 Cb 0.42 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1pl4 h ALA 48 CO 0.01 0.60 -0.03 1.25 0.00 0.00 0.00 179.25 181.09 1pl4 h LEU 49 N 1.25 -0.06 -1.68 0.00 5.85 -0.70 -0.14 115.31 119.83 1pl4 h LEU 49 Ca 0.33 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.97 1pl4 h LEU 49 Cb -0.08 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1pl4 h LEU 49 CO -0.06 0.05 0.24 0.00 -0.34 0.00 0.00 178.44 178.33 1pl4 h ALA 50 N 0.77 1.81 -0.17 1.25 0.00 -1.24 -1.38 119.26 120.29 1pl4 h ALA 50 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1pl4 h ALA 50 Cb 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1pl4 h ALA 50 CO 0.01 0.16 0.00 1.63 0.00 0.00 0.00 179.25 181.05 1pl4 n LYS 51 N -4.48 1.88 -3.27 0.00 5.02 -1.03 -4.93 118.16 111.34 1pl4 n LYS 51 Ca 0.03 -1.31 -0.23 0.00 -2.02 0.00 0.00 58.31 54.78 1pl4 n LYS 51 Cb 0.11 -1.43 0.01 0.00 -0.02 0.00 0.00 35.03 33.70 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 1.21 -0.50 3.48 0.72 0.00 -0.52 -4.93 105.19 104.64 1pl4 n GLY 52 Ca 0.17 0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.72 6.46 0.14 1.61 -1.08 -0.10 -4.85 116.67 116.13 1pl4 s ASP 53 Ca 0.37 -1.57 -0.09 0.00 -0.52 0.00 0.00 52.55 50.75 1pl4 s ASP 53 Cb -0.19 -2.44 -0.03 0.00 -1.46 0.00 0.00 42.92 38.79 1pl4 s ASP 53 CO 0.46 -1.29 1.44 0.58 0.52 0.00 0.00 175.17 176.88 1pl4 h VAL 54 N 6.06 1.28 -0.68 1.11 2.07 -1.92 -1.82 116.25 122.35 1pl4 h VAL 54 Ca 0.02 -1.74 0.04 0.00 0.82 0.00 0.00 66.70 65.84 1pl4 h VAL 54 Cb 1.04 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 32.41 1pl4 h VAL 54 CO 1.20 0.56 0.42 0.74 0.02 0.00 0.00 177.57 180.51 1pl4 h THR 55 N 0.62 1.06 -0.38 2.57 2.02 -1.98 -0.67 112.91 116.16 1pl4 h THR 55 Ca 0.02 -0.28 -0.12 0.00 0.77 0.00 0.00 66.41 66.80 1pl4 h THR 55 Cb 1.13 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1pl4 h THR 55 CO 0.12 0.15 -0.26 0.00 0.37 0.00 0.00 175.52 175.89 1pl4 h ALA 56 N 1.31 0.83 -0.49 6.16 0.00 -1.92 -0.45 119.26 124.70 1pl4 h ALA 56 Ca 0.28 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1pl4 h ALA 56 Cb 0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1pl4 h ALA 56 CO -0.12 0.64 0.29 1.96 0.00 0.00 0.00 179.25 182.02 1pl4 h GLN 57 N 0.67 0.57 -0.34 0.00 4.20 -0.87 -2.07 115.11 117.27 1pl4 h GLN 57 Ca 0.08 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.63 1pl4 h GLN 57 Cb 0.78 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 1pl4 h GLN 57 CO 0.06 0.38 -0.31 0.82 -0.67 0.00 0.00 178.83 179.11 1pl4 h ILE 58 N 0.58 1.28 0.00 2.54 2.04 -0.91 -3.03 117.51 120.01 1pl4 h ILE 58 Ca 0.20 -1.45 -0.03 0.00 1.00 0.00 0.00 64.86 64.58 1pl4 h ILE 58 Cb 0.02 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1pl4 h ILE 58 CO -0.09 0.48 -0.14 0.00 0.00 0.00 0.00 178.15 178.39 1pl4 h ALA 59 N 1.02 1.22 0.00 1.87 0.00 -0.82 -2.01 119.26 120.55 1pl4 h ALA 59 Ca 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1pl4 h ALA 59 Cb 0.83 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1pl4 h ALA 59 CO 0.07 0.18 -0.28 1.28 0.00 0.00 0.00 179.25 180.50 1pl4 n LEU 60 N -3.58 0.44 -0.27 0.00 4.77 -0.80 -4.34 117.00 113.22 1pl4 n LEU 60 Ca -0.01 0.31 -0.05 0.00 -0.03 0.00 0.00 56.01 56.23 1pl4 n LEU 60 Cb 0.28 -0.33 0.06 0.00 -2.33 0.00 0.00 43.42 41.10 1pl4 n LEU 60 CO 0.31 -0.01 1.17 1.56 -1.33 0.00 0.00 177.39 179.09 1pl4 h GLN 61 N 0.00 0.98 -0.67 3.23 4.20 -1.28 -1.74 115.11 119.82 1pl4 h GLN 61 Ca 0.00 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.67 1pl4 h GLN 61 Cb 0.59 -0.22 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 1pl4 h GLN 61 CO 0.00 0.66 0.42 -1.35 -0.67 0.00 0.00 178.83 177.88 1pl4 h PRO 62 N 1.00 0.79 -0.47 1.46 0.11 -1.78 -0.62 132.00 132.49 1pl4 h PRO 62 Ca 0.27 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.22 1pl4 h PRO 62 Cb -0.10 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 30.82 1pl4 h PRO 62 CO -0.06 0.52 -0.14 0.00 -0.21 0.00 0.00 178.00 178.12 1pl4 h ALA 63 N 1.29 0.87 -0.29 -0.75 0.00 -1.74 -0.76 119.26 117.88 1pl4 h ALA 63 Ca 0.27 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1pl4 h ALA 63 Cb 0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1pl4 h ALA 63 CO -0.11 0.64 -0.08 1.25 0.00 0.00 0.00 179.25 180.96 1pl4 h LEU 64 N 0.79 0.58 -0.52 0.00 7.12 -1.02 -0.19 115.31 122.06 1pl4 h LEU 64 Ca 0.12 -0.37 -0.10 0.00 0.13 0.00 0.00 57.88 57.66 1pl4 h LEU 64 Cb 0.67 -0.16 -0.02 0.00 -0.53 0.00 0.00 40.66 40.62 1pl4 h LEU 64 CO 0.05 0.81 -0.08 0.50 -0.13 0.00 0.00 178.44 179.59 1pl4 h LYS 65 N 0.33 0.98 0.19 1.25 3.64 -1.00 0.23 116.57 122.19 1pl4 h LYS 65 Ca 0.07 -0.35 -0.01 0.00 -1.27 0.00 0.00 60.65 59.09 1pl4 h LYS 65 Cb 0.56 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1pl4 h LYS 65 CO 0.03 1.02 -0.09 0.35 -2.27 0.00 0.00 179.45 178.49 1pl4 h PHE 66 N 0.85 -0.23 0.24 1.91 3.57 -1.09 0.26 116.94 122.44 1pl4 h PHE 66 Ca 0.14 -0.01 -0.34 0.00 3.53 0.00 0.00 57.97 61.30 1pl4 h PHE 66 Cb 0.63 0.08 0.03 0.00 2.79 0.00 0.00 35.95 39.48 1pl4 h PHE 66 CO 0.05 0.06 -1.52 -0.91 -2.23 0.00 0.00 178.31 173.76 1pl4 h ASN 67 N -0.53 0.79 0.03 0.41 2.35 -1.06 -0.28 115.58 117.28 1pl4 h ASN 67 Ca -0.03 -0.89 0.00 0.00 -0.55 0.00 0.00 56.30 54.83 1pl4 h ASN 67 Cb 0.40 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.51 1pl4 h ASN 67 CO 0.04 1.71 -0.02 1.23 -1.65 0.00 0.00 177.43 178.74 1pl4 h GLY 68 N 0.33 -0.05 0.86 2.83 0.00 -0.63 -1.00 103.07 105.41 1pl4 h GLY 68 Ca -0.27 0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.11 1pl4 h GLY 68 CO 0.26 -0.03 0.29 -1.33 0.00 0.00 0.00 176.54 175.73 1pl4 h GLY 69 N -0.06 0.70 0.82 4.60 0.00 -0.53 -0.70 103.07 107.90 1pl4 h GLY 69 Ca 0.00 -0.21 0.05 0.00 0.00 0.00 0.00 47.33 47.17 1pl4 h GLY 69 CO -0.00 0.18 0.65 -1.33 0.00 0.00 0.00 176.54 176.03 1pl4 h GLY 70 N 0.57 1.48 0.84 4.60 0.00 -0.86 0.20 103.07 109.89 1pl4 h GLY 70 Ca 0.20 -0.48 -0.05 0.00 0.00 0.00 0.00 47.33 47.00 1pl4 h GLY 70 CO -0.10 0.38 -0.04 0.84 0.00 0.00 0.00 176.54 177.62 1pl4 h HIS 71 N 1.21 0.49 0.02 5.60 6.17 -0.52 -1.46 115.15 126.66 1pl4 h HIS 71 Ca 0.41 -0.10 -0.00 0.00 0.71 0.00 0.00 60.37 61.39 1pl4 h HIS 71 Cb 0.08 -0.12 0.00 0.00 2.52 0.00 0.00 27.41 29.89 1pl4 h HIS 71 CO -0.00 0.66 -0.01 0.82 0.71 0.00 0.00 177.93 180.11 1pl4 h ILE 72 N 0.19 1.02 -0.19 6.26 2.04 -0.63 -1.40 117.51 124.79 1pl4 h ILE 72 Ca 0.06 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 1pl4 h ILE 72 Cb 0.49 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 1pl4 h ILE 72 CO 0.02 0.03 0.11 0.78 0.00 0.00 0.00 178.15 179.09 1pl4 h ASN 73 N -0.07 0.24 0.05 1.72 2.35 -0.60 -1.90 115.58 117.38 1pl4 h ASN 73 Ca -0.00 -0.08 -0.15 0.00 -0.55 0.00 0.00 56.30 55.52 1pl4 h ASN 73 Cb 0.07 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1pl4 h ASN 73 CO 0.00 0.25 -0.51 0.45 -1.65 0.00 0.00 177.43 175.97 1pl4 h HIS 74 N 0.21 0.63 -0.49 1.19 3.86 -1.26 -0.41 115.15 118.88 1pl4 h HIS 74 Ca 0.07 -0.21 0.02 0.00 -1.16 0.00 0.00 60.37 59.09 1pl4 h HIS 74 Cb 0.06 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.38 1pl4 h HIS 74 CO -0.04 0.92 0.29 0.77 0.86 0.00 0.00 177.93 180.73 1pl4 h SER 75 N 0.40 0.47 -0.30 2.45 0.02 -1.05 -1.58 113.55 113.96 1pl4 h SER 75 Ca 0.01 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 1pl4 h SER 75 Cb 1.04 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 1pl4 h SER 75 CO 0.09 0.33 0.04 0.40 -1.14 0.00 0.00 176.83 176.56 1pl4 h ILE 76 N 0.58 1.24 -0.63 3.27 2.04 -1.12 -3.24 117.51 119.65 1pl4 h ILE 76 Ca 0.20 -0.84 0.11 0.00 1.00 0.00 0.00 64.86 65.34 1pl4 h ILE 76 Cb 0.02 1.20 -0.08 0.00 -0.74 0.00 0.00 36.82 37.22 1pl4 h ILE 76 CO -0.09 0.27 0.20 0.15 0.00 0.00 0.00 178.15 178.67 1pl4 h PHE 77 N 0.33 0.33 -0.27 1.37 3.57 -0.56 -0.97 116.94 120.73 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 0.36 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1pl4 h PHE 77 CO 0.03 0.03 -0.06 -1.49 -2.23 0.00 0.00 178.31 174.59 1pl4 h TRP 78 N 0.34 0.45 0.00 0.41 -0.00 -1.33 -1.32 115.95 114.50 1pl4 h TRP 78 Ca 0.33 -0.05 0.00 0.00 -0.00 0.00 0.00 58.89 59.17 1pl4 h TRP 78 Cb 0.47 -0.13 0.00 0.00 -0.00 0.00 0.00 29.16 29.50 1pl4 h TRP 78 CO -0.20 0.49 0.00 1.79 -0.00 0.00 0.00 178.44 180.52 1pl4 h THR 79 N 0.41 0.00 -0.00 1.49 1.35 -1.27 -2.98 112.91 111.91 1pl4 h THR 79 Ca 0.09 -0.65 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1pl4 h THR 79 Cb 0.37 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 1pl4 h THR 79 CO 0.02 0.00 -0.03 0.59 -0.25 0.00 0.00 175.52 175.85 1pl4 n ASN 80 N -3.00 0.15 -4.43 5.36 5.03 -0.50 -4.69 115.26 113.16 1pl4 n ASN 80 Ca 0.02 -0.41 -0.26 0.00 0.87 0.00 0.00 54.58 54.80 1pl4 n ASN 80 Cb 0.38 -0.18 -0.11 0.00 -1.02 0.00 0.00 39.78 38.85 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 -0.17 3.41 1.43 -1.13 0.18 118.68 122.44 1pl4 s LEU 81 Ca 0.32 -0.92 -0.28 0.00 -1.03 0.00 0.00 54.13 52.22 1pl4 s LEU 81 Cb 0.20 -1.14 0.09 0.00 0.03 0.00 0.00 46.19 45.38 1pl4 s LEU 81 CO 0.45 0.09 0.79 -0.55 0.23 0.00 0.00 176.35 177.36 1pl4 s SER 82 N -2.93 -0.61 0.54 2.29 0.15 0.11 -4.56 113.70 108.70 1pl4 s SER 82 Ca 0.23 0.91 0.31 0.00 0.70 0.00 0.00 55.95 58.11 1pl4 s SER 82 Cb -0.07 0.83 1.54 0.00 -1.71 0.00 0.00 66.02 66.61 1pl4 s SER 82 CO 0.11 -0.39 2.08 1.55 1.20 0.00 0.00 173.24 177.79 1pl4 h PRO 83 N 3.71 0.00 -0.59 5.44 0.13 -1.85 -2.03 132.00 136.81 1pl4 h PRO 83 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1pl4 h PRO 83 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1pl4 h PRO 83 CO 0.23 0.08 0.00 0.09 -0.23 0.00 0.00 178.00 178.18 1pl4 n ASN 84 N -3.40 3.20 -1.24 1.44 3.02 -1.26 -4.97 115.26 112.05 1pl4 n ASN 84 Ca -0.01 -2.26 0.00 0.00 -0.03 0.00 0.00 54.58 52.28 1pl4 n ASN 84 Cb 0.25 -0.45 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 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 0.88 0.91 2.65 7.41 0.00 -0.76 -4.99 105.19 111.29 1pl4 n GLY 85 Ca 0.17 -1.85 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 -1.99 7.00 -0.02 0.00 0.75 -4.65 105.19 111.28 1pl4 n GLY 86 Ca 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.21 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 -0.03 1.13 3.24 -0.02 0.00 -1.26 -4.75 105.19 103.50 1pl4 n GLY 87 Ca 0.00 -0.68 -0.21 0.00 0.00 0.00 0.00 46.02 45.13 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 1.02 0.95 1.61 2.02 -1.26 -5.03 118.70 118.00 1pl4 s GLU 88 Ca 0.00 -1.12 -0.12 0.00 0.02 0.00 0.00 54.97 53.75 1pl4 s GLU 88 Cb 0.00 -1.13 0.16 0.00 0.10 0.00 0.00 34.13 33.26 1pl4 s GLU 88 CO 0.00 0.25 1.11 -1.25 0.02 0.00 0.00 175.26 175.39 1pl4 s PRO 89 N -2.02 0.86 0.33 0.39 0.04 -1.26 -5.01 135.00 128.33 1pl4 s PRO 89 Ca 0.05 0.48 0.00 0.00 0.04 0.00 0.00 61.00 61.57 1pl4 s PRO 89 Cb -0.09 -1.79 -0.00 0.00 0.04 0.00 0.00 34.50 32.66 1pl4 s PRO 89 CO 0.04 -2.43 0.02 1.63 0.04 0.00 0.00 177.00 176.29 1pl4 n LYS 90 N -3.96 1.10 0.00 4.56 5.02 -1.26 -4.66 118.16 118.96 1pl4 n LYS 90 Ca 0.06 -2.46 0.00 0.00 -2.02 0.00 0.00 58.31 53.89 1pl4 n LYS 90 Cb 0.58 0.76 0.00 0.00 -0.02 0.00 0.00 35.03 36.34 1pl4 n LYS 90 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pl4 n GLY 91 N 0.82 0.66 0.36 0.72 0.00 -1.26 -2.81 105.19 103.68 1pl4 n GLY 91 Ca -0.13 -0.74 0.06 0.00 0.00 0.00 0.00 46.02 45.21 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 0.88 -0.48 1.61 5.08 -1.99 -0.81 114.58 118.87 1pl4 h GLU 92 Ca 0.00 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1pl4 h GLU 92 Cb 0.00 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 1pl4 h GLU 92 CO 0.00 0.58 0.01 1.25 -1.00 0.00 0.00 179.01 179.85 1pl4 h LEU 93 N 0.91 0.82 -0.81 1.33 5.85 -1.95 0.13 115.31 121.59 1pl4 h LEU 93 Ca 0.38 -0.30 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 1pl4 h LEU 93 Cb 0.29 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1pl4 h LEU 93 CO -0.15 0.93 0.00 0.25 -0.34 0.00 0.00 178.44 179.13 1pl4 h LEU 94 N 0.70 0.87 -1.13 2.25 5.85 -1.16 -1.20 115.31 121.49 1pl4 h LEU 94 Ca 0.14 -0.22 -0.09 0.00 0.84 0.00 0.00 57.88 58.54 1pl4 h LEU 94 Cb 0.50 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1pl4 h LEU 94 CO 0.02 0.93 -0.40 -0.33 -0.34 0.00 0.00 178.44 178.32 1pl4 h GLU 95 N 0.83 0.07 -0.50 1.25 4.39 -0.69 -0.98 114.58 118.95 1pl4 h GLU 95 Ca 0.16 -0.03 -0.12 0.00 0.34 0.00 0.00 59.36 59.70 1pl4 h GLU 95 Cb 0.49 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 1pl4 h GLU 95 CO 0.02 0.46 -0.17 0.00 -1.16 0.00 0.00 179.01 178.17 1pl4 h ALA 96 N 1.54 0.69 -0.96 3.43 0.00 -0.36 -0.41 119.26 123.19 1pl4 h ALA 96 Ca 0.00 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1pl4 h ALA 96 Cb 0.74 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1pl4 h ALA 96 CO 0.05 0.65 0.59 0.82 0.00 0.00 0.00 179.25 181.36 1pl4 h ILE 97 N 0.85 1.26 -0.10 0.00 2.04 -0.82 0.14 117.51 120.88 1pl4 h ILE 97 Ca 0.12 -0.54 -0.03 0.00 1.00 0.00 0.00 64.86 65.41 1pl4 h ILE 97 Cb 0.74 -0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.70 1pl4 h ILE 97 CO 0.06 0.27 -0.05 0.11 0.00 0.00 0.00 178.15 178.53 1pl4 h LYS 98 N 1.32 0.22 -0.80 2.37 1.57 -0.98 0.14 116.57 120.41 1pl4 h LYS 98 Ca 0.35 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.99 1pl4 h LYS 98 Cb -0.08 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 1pl4 h LYS 98 CO -0.07 0.58 0.36 0.07 -0.57 0.00 0.00 179.45 179.82 1pl4 h ARG 99 N -0.14 1.16 0.01 3.15 0.11 -0.75 0.65 114.38 118.58 1pl4 h ARG 99 Ca 0.02 -0.18 -0.26 0.00 0.10 0.00 0.00 59.98 59.66 1pl4 h ARG 99 Cb 0.51 -0.20 -0.04 0.00 1.11 0.00 0.00 29.97 31.35 1pl4 h ARG 99 CO 0.02 0.91 -1.42 -0.44 0.10 0.00 0.00 179.97 179.13 1pl4 h ASP 100 N 1.14 0.04 0.00 0.08 3.32 -0.68 -3.39 116.42 116.92 1pl4 h ASP 100 Ca 0.27 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1pl4 h ASP 100 Cb 0.15 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1pl4 h ASP 100 CO -0.03 1.06 0.00 0.49 -1.72 0.00 0.00 179.24 179.04 1pl4 n PHE 101 N -3.21 0.00 0.00 4.55 3.72 0.03 -5.04 117.46 117.51 1pl4 n PHE 101 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1pl4 n PHE 101 Cb 1.01 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.55 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 0.35 2.86 3.80 1.37 0.00 0.22 -4.31 105.19 109.48 1pl4 n GLY 102 Ca 0.00 -0.75 -0.06 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.25 0.17 1.61 1.04 -1.26 -4.70 113.70 110.30 1pl4 s SER 103 Ca 0.00 -0.50 -0.13 0.00 0.48 0.00 0.00 55.95 55.80 1pl4 s SER 103 Cb 0.00 0.64 0.07 0.00 0.10 0.00 0.00 66.02 66.83 1pl4 s SER 103 CO 0.00 -1.18 1.75 0.15 0.98 0.00 0.00 173.24 174.94 1pl4 h PHE 104 N 2.00 0.84 -0.34 5.02 3.57 -1.91 -1.33 116.94 124.79 1pl4 h PHE 104 Ca -0.21 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.18 1pl4 h PHE 104 Cb 1.25 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.71 1pl4 h PHE 104 CO 0.40 0.65 -0.03 -0.44 -2.23 0.00 0.00 178.31 176.66 1pl4 h ASP 105 N 0.78 0.51 -0.32 0.41 3.32 -1.96 -0.70 116.42 118.46 1pl4 h ASP 105 Ca 0.20 -0.11 -0.18 0.00 0.02 0.00 0.00 57.03 56.96 1pl4 h ASP 105 Cb 0.13 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1pl4 h ASP 105 CO -0.02 0.60 -0.50 0.11 -1.72 0.00 0.00 179.24 177.71 1pl4 h LYS 106 N 0.51 0.90 -0.63 3.56 1.57 -1.78 -1.37 116.57 119.33 1pl4 h LYS 106 Ca 0.11 -0.54 0.06 0.00 -1.87 0.00 0.00 60.65 58.40 1pl4 h LYS 106 Cb 0.38 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.68 1pl4 h LYS 106 CO 0.02 1.18 0.34 0.35 -0.57 0.00 0.00 179.45 180.77 1pl4 h PHE 107 N 0.71 0.61 -0.66 -1.35 3.57 -0.84 -0.48 116.94 118.50 1pl4 h PHE 107 Ca 0.03 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 1pl4 h PHE 107 Cb 1.10 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.63 1pl4 h PHE 107 CO 0.07 0.28 0.21 0.87 -2.23 0.00 0.00 178.31 177.51 1pl4 h LYS 108 N 0.62 1.03 -0.79 1.11 1.57 -0.79 -0.13 116.57 119.18 1pl4 h LYS 108 Ca 0.29 -0.22 0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1pl4 h LYS 108 Cb 0.20 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 1pl4 h LYS 108 CO -0.19 0.89 0.51 0.93 -0.57 0.00 0.00 179.45 181.02 1pl4 h GLU 109 N 0.96 0.97 -0.16 3.15 5.08 -0.53 0.09 114.58 124.14 1pl4 h GLU 109 Ca 0.22 -0.06 -0.21 0.00 -1.00 0.00 0.00 59.36 58.31 1pl4 h GLU 109 Cb 0.29 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.33 1pl4 h GLU 109 CO -0.01 0.64 -0.70 0.87 -1.00 0.00 0.00 179.01 178.81 1pl4 h LYS 110 N 1.00 0.76 -0.15 2.33 1.57 -0.55 -0.30 116.57 121.22 1pl4 h LYS 110 Ca 0.31 -0.60 -0.17 0.00 -1.87 0.00 0.00 60.65 58.32 1pl4 h LYS 110 Cb -0.01 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1pl4 h LYS 110 CO -0.10 1.21 -0.60 1.25 -0.57 0.00 0.00 179.45 180.65 1pl4 h LEU 111 N 0.48 0.57 -0.29 2.94 5.85 -0.96 -1.96 115.31 121.94 1pl4 h LEU 111 Ca -0.04 -0.32 0.06 0.00 0.84 0.00 0.00 57.88 58.41 1pl4 h LEU 111 Cb 1.33 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.15 1pl4 h LEU 111 CO 0.15 1.04 -0.05 0.74 -0.34 0.00 0.00 178.44 179.97 1pl4 h THR 112 N 0.38 0.73 -0.78 1.05 2.02 -0.94 -0.82 112.91 114.55 1pl4 h THR 112 Ca -0.00 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1pl4 h THR 112 Cb 1.14 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 68.22 1pl4 h THR 112 CO 0.11 0.00 0.47 0.00 0.37 0.00 0.00 175.52 176.47 1pl4 h ALA 113 N 1.28 1.00 -0.64 6.16 0.00 -0.89 0.22 119.26 126.39 1pl4 h ALA 113 Ca 0.14 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1pl4 h ALA 113 Cb 0.20 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1pl4 h ALA 113 CO -0.28 0.47 0.15 0.00 0.00 0.00 0.00 179.25 179.59 1pl4 h ALA 114 N 1.25 1.06 -0.10 0.00 0.00 -1.10 -0.84 119.26 119.53 1pl4 h ALA 114 Ca 0.28 -0.23 -0.22 0.00 0.00 0.00 0.00 54.91 54.74 1pl4 h ALA 114 Cb -0.03 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.52 1pl4 h ALA 114 CO -0.05 0.62 -0.79 0.77 0.00 0.00 0.00 179.25 179.80 1pl4 h SER 115 N 0.96 0.87 0.61 0.00 0.02 -0.55 -3.05 113.55 112.41 1pl4 h SER 115 Ca 0.20 -0.67 -0.07 0.00 -0.84 0.00 0.00 61.79 60.42 1pl4 h SER 115 Cb 0.35 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1pl4 h SER 115 CO 0.00 1.40 -0.32 0.58 -1.14 0.00 0.00 176.83 177.35 1pl4 h VAL 116 N 0.40 0.92 0.00 2.27 2.07 -0.46 -3.05 116.25 118.40 1pl4 h VAL 116 Ca -0.07 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.21 1pl4 h VAL 116 Cb 1.43 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.94 1pl4 h VAL 116 CO 0.16 0.31 0.00 1.23 0.02 0.00 0.00 177.57 179.29 1pl4 h GLY 117 N 1.54 0.00 -5.29 2.17 0.00 -1.06 -3.44 103.07 96.98 1pl4 h GLY 117 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 1pl4 h GLY 117 CO 0.04 0.00 1.21 0.14 0.00 0.00 0.00 176.54 177.94 1pl4 s VAL 118 N -3.35 2.92 -0.30 4.60 1.01 -1.16 -4.95 120.40 119.16 1pl4 s VAL 118 Ca 0.05 0.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.93 1pl4 s VAL 118 Cb 0.08 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 1pl4 s VAL 118 CO 0.59 -0.00 0.25 -1.10 0.00 0.00 0.00 175.10 174.84 1pl4 s GLN 119 N 4.14 3.81 1.58 2.72 -0.21 -1.26 -4.85 119.66 125.59 1pl4 s GLN 119 Ca 0.87 -0.35 0.00 0.00 0.02 0.00 0.00 55.36 55.90 1pl4 s GLN 119 Cb -0.43 -3.71 0.00 0.00 1.00 0.00 0.00 33.01 29.87 1pl4 s GLN 119 CO 0.41 -0.30 0.00 0.41 -2.12 0.00 0.00 175.29 173.69 1pl4 n GLY 120 N 5.00 0.09 3.87 3.09 0.00 -1.26 -4.94 105.19 111.03 1pl4 n GLY 120 Ca -0.12 -1.43 -0.34 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 6.67 0.00 1.61 0.01 -1.26 -4.84 113.70 111.89 1pl4 s SER 121 Ca 0.00 0.88 0.00 0.00 1.31 0.00 0.00 55.95 58.14 1pl4 s SER 121 Cb 0.00 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 64.02 1pl4 s SER 121 CO 0.00 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.34 1pl4 n GLY 122 N 0.55 -1.05 2.93 3.44 0.00 -1.26 -0.31 105.19 109.50 1pl4 n GLY 122 Ca -0.05 -1.05 -0.15 0.00 0.00 0.00 0.00 46.02 44.77 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 0.31 -0.11 1.61 0.52 0.11 -1.69 118.94 116.70 1pl4 s TRP 123 Ca 0.00 -0.06 -0.12 0.00 0.02 0.00 0.00 56.10 55.94 1pl4 s TRP 123 Cb 0.00 -0.20 -0.05 0.00 -1.15 0.00 0.00 33.47 32.07 1pl4 s TRP 123 CO 0.00 -0.01 0.27 0.20 0.02 0.00 0.00 176.95 177.44 1pl4 s GLY 124 N -0.07 2.26 0.02 0.98 0.00 -0.56 -0.79 107.32 109.16 1pl4 s GLY 124 Ca 0.01 -0.46 0.05 0.00 0.00 0.00 0.00 44.72 44.33 1pl4 s GLY 124 CO -0.00 0.13 -0.16 -0.98 0.00 0.00 0.00 173.10 172.09 1pl4 s TRP 125 N -0.32 1.39 -0.25 1.90 0.52 0.14 -0.81 118.94 121.50 1pl4 s TRP 125 Ca 0.17 -0.32 -0.16 0.00 0.02 0.00 0.00 56.10 55.81 1pl4 s TRP 125 Cb -0.14 -0.85 -0.03 0.00 -1.15 0.00 0.00 33.47 31.30 1pl4 s TRP 125 CO 0.06 0.02 0.44 -1.17 0.02 0.00 0.00 176.95 176.33 1pl4 s LEU 126 N -0.84 4.06 0.44 2.99 2.96 0.21 -1.69 118.68 126.81 1pl4 s LEU 126 Ca 0.04 0.43 0.03 0.00 -0.22 0.00 0.00 54.13 54.42 1pl4 s LEU 126 Cb -0.07 -2.55 -0.03 0.00 0.50 0.00 0.00 46.19 44.04 1pl4 s LEU 126 CO 0.01 -0.21 0.05 -0.83 -1.32 0.00 0.00 176.35 174.04 1pl4 s GLY 127 N 1.50 2.69 -0.15 7.98 0.00 0.58 -0.64 107.32 119.28 1pl4 s GLY 127 Ca 0.18 -1.18 -0.00 0.00 0.00 0.00 0.00 44.72 43.73 1pl4 s GLY 127 CO 0.09 -2.02 -0.14 -0.12 0.00 0.00 0.00 173.10 170.91 1pl4 s PHE 128 N -3.01 2.80 -0.42 1.90 5.36 0.51 -0.90 117.98 124.21 1pl4 s PHE 128 Ca 0.20 -0.92 -0.22 0.00 -0.96 0.00 0.00 56.93 55.03 1pl4 s PHE 128 Cb 0.04 -1.89 0.02 0.00 -0.34 0.00 0.00 43.02 40.86 1pl4 s PHE 128 CO 0.11 -0.40 0.73 1.21 -1.46 0.00 0.00 175.22 175.41 1pl4 s ASN 129 N 0.71 6.41 0.21 6.13 3.04 0.36 -1.16 114.94 130.65 1pl4 s ASN 129 Ca -0.06 -0.06 -0.01 0.00 0.04 0.00 0.00 52.86 52.76 1pl4 s ASN 129 Cb -0.15 -2.36 0.17 0.00 -1.54 0.00 0.00 41.25 37.37 1pl4 s ASN 129 CO 0.02 -0.81 1.54 0.11 -3.04 0.00 0.00 177.10 174.91 1pl4 h LYS 130 N 8.81 0.50 -0.41 0.43 1.79 -1.86 0.12 116.57 125.96 1pl4 h LYS 130 Ca -0.25 -0.30 -0.06 0.00 -2.18 0.00 0.00 60.65 57.87 1pl4 h LYS 130 Cb 1.09 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.75 1pl4 h LYS 130 CO 0.92 0.89 0.04 1.49 -1.08 0.00 0.00 179.45 181.71 1pl4 h GLU 131 N 0.39 0.70 0.00 3.15 4.81 -1.96 -3.19 114.58 118.48 1pl4 h GLU 131 Ca 0.01 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 1pl4 h GLU 131 Cb 1.03 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.34 1pl4 h GLU 131 CO 0.09 0.76 -0.50 0.54 -0.73 0.00 0.00 179.01 179.17 1pl4 n ARG 132 N -4.48 0.28 -2.82 1.92 5.12 -1.18 -4.96 116.66 110.54 1pl4 n ARG 132 Ca -0.01 0.11 -0.17 0.00 -1.93 0.00 0.00 57.85 55.86 1pl4 n ARG 132 Cb 0.26 -1.71 0.03 0.00 -1.16 0.00 0.00 32.46 29.88 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 -0.21 3.50 -0.13 0.00 0.39 -5.01 105.19 105.07 1pl4 n GLY 133 Ca 0.04 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.01 0.68 0.56 1.61 -3.43 -1.08 -4.99 115.29 105.63 1pl4 s HIS 134 Ca 0.22 -0.99 -0.17 0.00 -0.80 0.00 0.00 55.06 53.32 1pl4 s HIS 134 Cb -0.10 0.00 -0.05 0.00 -1.43 0.00 0.00 32.58 31.00 1pl4 s HIS 134 CO 0.28 -0.98 1.06 -0.51 -2.00 0.00 0.00 174.74 172.58 1pl4 s LEU 135 N -3.10 3.60 -0.16 5.38 1.43 -1.26 -0.48 118.68 124.09 1pl4 s LEU 135 Ca 0.27 1.87 -0.12 0.00 -1.03 0.00 0.00 54.13 55.13 1pl4 s LEU 135 Cb 0.01 -4.54 0.05 0.00 0.03 0.00 0.00 46.19 41.73 1pl4 s LEU 135 CO 0.13 -1.07 0.41 -1.58 0.23 0.00 0.00 176.35 174.46 1pl4 s GLN 136 N -3.80 0.44 0.04 1.70 0.74 -0.08 -4.77 119.66 113.93 1pl4 s GLN 136 Ca 0.65 0.67 -0.11 0.00 0.05 0.00 0.00 55.36 56.62 1pl4 s GLN 136 Cb -0.17 0.11 -0.06 0.00 1.10 0.00 0.00 33.01 34.00 1pl4 s GLN 136 CO 0.32 -0.11 0.38 0.42 -0.55 0.00 0.00 175.29 175.75 1pl4 s ILE 137 N 0.78 5.11 0.02 -2.34 1.01 -1.26 -0.31 121.20 124.21 1pl4 s ILE 137 Ca -0.05 0.53 -0.14 0.00 0.00 0.00 0.00 60.65 60.99 1pl4 s ILE 137 Cb -0.05 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.79 1pl4 s ILE 137 CO -0.06 0.39 0.30 0.00 0.00 0.00 0.00 174.94 175.57 1pl4 s ALA 138 N -1.29 -0.70 0.03 9.38 0.00 -0.68 -4.98 121.76 123.52 1pl4 s ALA 138 Ca 0.29 0.12 0.06 0.00 0.00 0.00 0.00 51.96 52.43 1pl4 s ALA 138 Cb -0.15 0.22 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 1pl4 s ALA 138 CO 0.16 -0.35 -0.15 0.00 0.00 0.00 0.00 175.76 175.42 1pl4 s ALA 139 N -2.07 2.71 -0.04 0.00 0.00 -1.26 0.29 121.76 121.39 1pl4 s ALA 139 Ca -0.08 -1.14 0.04 0.00 0.00 0.00 0.00 51.96 50.77 1pl4 s ALA 139 Cb -0.03 -0.85 -0.00 0.00 0.00 0.00 0.00 23.12 22.24 1pl4 s ALA 139 CO -0.00 0.58 -0.15 0.00 0.00 0.00 0.00 175.76 176.19 1pl4 s PRO 141 N 0.10 4.28 7.35 0.00 0.04 -1.26 -0.71 135.00 144.80 1pl4 s PRO 141 Ca -0.04 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.27 1pl4 s PRO 141 Cb -0.11 -2.42 0.00 0.00 0.04 0.00 0.00 34.50 32.01 1pl4 s PRO 141 CO 0.02 0.01 0.00 0.09 0.04 0.00 0.00 177.00 177.15 1pl4 n ASN 142 N -0.21 0.00 -0.91 6.66 3.02 0.58 -1.35 115.26 123.04 1pl4 n ASN 142 Ca 0.05 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.68 1pl4 n ASN 142 Cb 0.52 0.00 0.23 0.00 -0.61 0.00 0.00 39.78 39.92 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 3.05 -1.60 3.52 1.13 -1.26 -4.08 117.38 132.13 1pl4 n GLN 143 Ca 0.00 -2.47 -0.52 0.00 -1.94 0.00 0.00 57.00 52.07 1pl4 n GLN 143 Cb 0.00 -1.57 -0.06 0.00 0.11 0.00 0.00 30.24 28.72 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 0.35 2.60 -4.85 1.08 9.92 -0.46 -3.84 116.55 121.36 1pl4 n ASP 144 Ca 0.18 0.79 -0.32 0.00 -0.53 0.00 0.00 54.79 54.91 1pl4 n ASP 144 Cb 0.66 -1.25 -0.04 0.00 -0.64 0.00 0.00 41.12 39.85 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 4.73 3.97 0.06 -0.24 0.04 -1.26 -4.66 135.00 137.64 1pl4 s PRO 145 Ca 1.01 0.87 -0.25 0.00 0.04 0.00 0.00 61.00 62.67 1pl4 s PRO 145 Cb -0.88 -2.22 -0.17 0.00 0.04 0.00 0.00 34.50 31.28 1pl4 s PRO 145 CO 0.56 -0.15 1.59 1.25 0.04 0.00 0.00 177.00 180.29 1pl4 h LEU 146 N 1.26 -0.10 -0.06 -3.56 5.85 -1.90 -2.46 115.31 114.34 1pl4 h LEU 146 Ca -0.47 -0.11 -0.20 0.00 0.84 0.00 0.00 57.88 57.93 1pl4 h LEU 146 Cb 1.18 0.03 0.01 0.00 0.37 0.00 0.00 40.66 42.25 1pl4 h LEU 146 CO 0.62 0.05 -0.75 -0.61 -0.34 0.00 0.00 178.44 177.40 1pl4 h GLN 147 N -0.25 0.62 -0.47 1.25 4.15 -1.88 -0.15 115.11 118.37 1pl4 h GLN 147 Ca -0.01 -0.58 0.03 0.00 0.77 0.00 0.00 58.65 58.85 1pl4 h GLN 147 Cb 0.21 0.15 -0.03 0.00 0.21 0.00 0.00 27.48 28.02 1pl4 h GLN 147 CO 0.02 1.20 0.31 0.78 -1.93 0.00 0.00 178.83 179.21 1pl4 h GLY 148 N 0.25 0.60 0.00 2.39 0.00 -1.87 -0.47 103.07 103.97 1pl4 h GLY 148 Ca -0.08 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1pl4 h GLY 148 CO 0.15 0.19 -1.58 -1.30 0.00 0.00 0.00 176.54 174.00 1pl4 n THR 149 N -4.47 0.00 0.00 4.70 -2.24 -0.93 -4.75 114.28 106.59 1pl4 n THR 149 Ca 0.05 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1pl4 n THR 149 Cb 0.14 0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 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 -1.95 0.00 0.00 4.28 -2.24 -0.07 -5.04 114.28 109.26 1pl4 n THR 150 Ca -0.02 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1pl4 n THR 150 Cb 0.38 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 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 1.37 3.18 3.77 3.38 0.00 -0.19 -5.01 105.19 111.69 1pl4 n GLY 151 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 4.36 -0.17 0.99 1.43 -1.26 -4.76 118.68 119.26 1pl4 s LEU 152 Ca 0.00 2.75 -0.22 0.00 -1.03 0.00 0.00 54.13 55.63 1pl4 s LEU 152 Cb 0.00 -3.71 -0.03 0.00 0.03 0.00 0.00 46.19 42.49 1pl4 s LEU 152 CO 0.00 -0.67 0.67 -0.63 0.23 0.00 0.00 176.35 175.95 1pl4 s ILE 153 N -1.16 5.00 0.15 -0.59 -1.09 -0.31 -3.13 121.20 120.07 1pl4 s ILE 153 Ca 0.51 1.29 -0.30 0.00 -2.23 0.00 0.00 60.65 59.92 1pl4 s ILE 153 Cb -0.41 -3.99 -0.08 0.00 -1.58 0.00 0.00 42.46 36.41 1pl4 s ILE 153 CO 0.54 0.12 1.25 -2.16 -1.23 0.00 0.00 174.94 173.46 1pl4 s PRO 154 N 1.77 4.43 -0.07 2.79 0.04 -1.26 -0.37 135.00 142.33 1pl4 s PRO 154 Ca 0.31 1.91 -0.05 0.00 0.04 0.00 0.00 61.00 63.22 1pl4 s PRO 154 Cb -0.16 -3.26 -0.03 0.00 0.04 0.00 0.00 34.50 31.09 1pl4 s PRO 154 CO 0.12 -0.22 -0.11 1.28 0.04 0.00 0.00 177.00 178.11 1pl4 n LEU 155 N 3.11 0.74 -3.73 -3.56 4.77 0.19 -4.92 117.00 113.61 1pl4 n LEU 155 Ca 0.07 0.12 -0.18 0.00 -0.03 0.00 0.00 56.01 55.99 1pl4 n LEU 155 Cb 0.44 -0.29 -0.17 0.00 -2.33 0.00 0.00 43.42 41.07 1pl4 n LEU 155 CO 0.56 0.05 -0.35 -0.22 -1.33 0.00 0.00 177.39 176.11 1pl4 s LEU 156 N -6.61 0.65 -0.05 2.23 2.96 -1.02 -4.51 118.68 112.33 1pl4 s LEU 156 Ca -0.12 0.05 0.03 0.00 -0.22 0.00 0.00 54.13 53.87 1pl4 s LEU 156 Cb 0.04 -0.13 -0.03 0.00 0.50 0.00 0.00 46.19 46.57 1pl4 s LEU 156 CO 0.15 -0.18 -0.13 -0.83 -1.32 0.00 0.00 176.35 174.03 1pl4 s GLY 157 N 1.59 1.55 -0.27 7.98 0.00 -1.26 -0.62 107.32 116.30 1pl4 s GLY 157 Ca -0.02 -0.98 0.03 0.00 0.00 0.00 0.00 44.72 43.75 1pl4 s GLY 157 CO -0.03 -0.77 -0.09 -0.42 0.00 0.00 0.00 173.10 171.79 1pl4 s ILE 158 N -0.75 2.22 -0.15 0.90 -1.09 0.01 -4.88 121.20 117.46 1pl4 s ILE 158 Ca 0.12 -1.68 -0.29 0.00 -2.23 0.00 0.00 60.65 56.56 1pl4 s ILE 158 Cb -0.11 -2.33 -0.02 0.00 -1.58 0.00 0.00 42.46 38.43 1pl4 s ILE 158 CO 0.01 -0.08 1.23 -0.62 -1.23 0.00 0.00 174.94 174.25 1pl4 s ASP 159 N 1.09 6.99 -0.12 3.58 -1.08 -1.26 -1.50 116.67 124.38 1pl4 s ASP 159 Ca -0.07 1.69 0.16 0.00 -0.52 0.00 0.00 52.55 53.80 1pl4 s ASP 159 Cb -0.20 -2.54 0.29 0.00 -1.46 0.00 0.00 42.92 39.01 1pl4 s ASP 159 CO -0.05 -0.71 1.18 1.33 0.52 0.00 0.00 175.17 177.44 1pl4 n VAL 160 N 5.19 1.80 -1.73 1.11 0.24 -0.68 -4.86 118.33 119.40 1pl4 n VAL 160 Ca 0.13 -1.97 -0.39 0.00 -2.04 0.00 0.00 64.34 60.07 1pl4 n VAL 160 Cb 0.45 -0.11 0.03 0.00 -1.47 0.00 0.00 33.84 32.75 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 -1.06 2.25 0.08 6.34 7.02 -1.18 -4.50 117.44 126.39 1pl4 n TRP 161 Ca 0.15 0.44 0.04 0.00 -1.02 0.00 0.00 57.50 57.11 1pl4 n TRP 161 Cb 0.62 -2.37 0.47 0.00 -2.42 0.00 0.00 31.31 27.61 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 1.62 0.37 -0.07 -0.99 5.08 -1.94 -1.09 114.58 117.56 1pl4 h GLU 162 Ca -0.50 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 57.85 1pl4 h GLU 162 Cb 1.30 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.47 1pl4 h GLU 162 CO 0.58 0.28 0.13 1.12 -1.00 0.00 0.00 179.01 180.13 1pl4 h HIS 163 N 0.38 0.00 0.00 4.33 2.07 -1.99 0.28 115.15 120.22 1pl4 h HIS 163 Ca 0.10 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.62 1pl4 h HIS 163 Cb 0.03 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.01 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 -2.17 2.16 0.00 6.11 0.00 -0.41 -4.46 120.51 121.73 1pl4 n ALA 164 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1pl4 n ALA 164 Cb 0.22 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.22 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 -2.11 0.00 -0.20 0.00 0.18 -0.74 -5.00 117.16 109.28 1pl4 n TYR 165 Ca 0.05 0.00 -0.03 0.00 1.88 0.00 0.00 57.90 59.80 1pl4 n TYR 165 Cb 0.37 0.00 0.07 0.00 -0.38 0.00 0.00 39.34 39.40 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 0.61 -0.90 -3.48 3.57 -0.67 0.26 116.94 116.33 1pl4 h PHE 166 Ca 0.00 0.02 0.17 0.00 3.53 0.00 0.00 57.97 61.69 1pl4 h PHE 166 Cb 0.00 -0.19 -0.07 0.00 2.79 0.00 0.00 35.95 38.48 1pl4 h PHE 166 CO 0.00 0.31 0.58 -0.07 -2.23 0.00 0.00 178.31 176.91 1pl4 h LEU 167 N 0.64 0.58 0.02 0.59 3.38 -1.86 0.69 115.31 119.35 1pl4 h LEU 167 Ca 0.26 0.05 -0.38 0.00 0.09 0.00 0.00 57.88 57.89 1pl4 h LEU 167 Cb 0.12 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 1pl4 h LEU 167 CO -0.15 0.27 -2.17 1.67 0.09 0.00 0.00 178.44 178.15 1pl4 n GLN 168 N -4.57 0.63 0.00 1.13 7.27 -0.88 -4.66 117.38 116.31 1pl4 n GLN 168 Ca 0.19 0.30 0.07 0.00 0.07 0.00 0.00 57.00 57.62 1pl4 n GLN 168 Cb 0.55 -1.59 0.01 0.00 2.41 0.00 0.00 30.24 31.62 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 -3.89 0.00 -1.42 3.69 4.01 0.03 -5.07 117.16 114.50 1pl4 n TYR 169 Ca -0.44 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.30 1pl4 n TYR 169 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.93 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 -0.03 0.00 0.01 -0.72 4.01 0.23 -0.97 118.16 120.68 1pl4 n LYS 170 Ca 0.06 0.00 0.09 0.00 -0.51 0.00 0.00 58.31 57.95 1pl4 n LYS 170 Cb 0.31 0.00 0.38 0.00 -0.51 0.00 0.00 35.03 35.21 1pl4 n LYS 170 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1pl4 n ASN 171 N 1.18 0.03 -3.75 4.39 6.94 -1.26 -4.36 115.26 118.43 1pl4 n ASN 171 Ca 0.00 0.51 -0.42 0.00 -0.02 0.00 0.00 54.58 54.65 1pl4 n ASN 171 Cb 0.00 -0.51 0.00 0.00 -2.36 0.00 0.00 39.78 36.91 1pl4 n ASN 171 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1pl4 n VAL 172 N -1.53 4.11 -0.35 3.53 0.31 -0.15 -4.74 118.33 119.52 1pl4 n VAL 172 Ca 0.04 -3.79 0.15 0.00 -0.01 0.00 0.00 64.34 60.73 1pl4 n VAL 172 Cb 0.21 -2.44 0.35 0.00 -0.91 0.00 0.00 33.84 31.05 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 5.68 0.67 0.00 5.55 2.43 -1.81 -1.05 114.38 125.84 1pl4 h ARG 173 Ca 0.51 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.63 1pl4 h ARG 173 Cb 0.58 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1pl4 h ARG 173 CO 1.72 0.44 -0.04 -1.35 -1.51 0.00 0.00 179.97 179.23 1pl4 h PRO 174 N 0.69 0.00 -0.07 0.20 0.11 -1.97 -1.77 132.00 129.19 1pl4 h PRO 174 Ca 0.60 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.55 1pl4 h PRO 174 Cb 1.03 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1pl4 h PRO 174 CO -0.42 0.04 -0.66 -0.44 -0.21 0.00 0.00 178.00 176.32 1pl4 h ASP 175 N 0.00 0.35 -0.30 -2.05 3.32 -1.58 -0.73 116.42 115.43 1pl4 h ASP 175 Ca -0.00 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.83 1pl4 h ASP 175 Cb 0.08 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1pl4 h ASP 175 CO 0.01 0.91 0.16 0.22 -1.72 0.00 0.00 179.24 178.81 1pl4 h TYR 176 N 0.21 0.42 -0.59 4.55 3.20 -1.45 -2.08 116.97 121.23 1pl4 h TYR 176 Ca -0.01 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.76 1pl4 h TYR 176 Cb 1.19 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 39.31 1pl4 h TYR 176 CO 0.03 0.35 0.04 -0.07 -1.64 0.00 0.00 178.16 176.87 1pl4 h LEU 177 N 0.36 0.97 -0.87 2.82 -0.00 -1.11 -0.61 115.31 116.87 1pl4 h LEU 177 Ca 0.10 -0.25 0.05 0.00 -0.00 0.00 0.00 57.88 57.78 1pl4 h LEU 177 Cb 0.08 -0.26 -0.06 0.00 -0.00 0.00 0.00 40.66 40.42 1pl4 h LEU 177 CO -0.02 1.01 0.55 0.50 -0.00 0.00 0.00 178.44 180.48 1pl4 h LYS 178 N 0.93 1.00 -0.18 1.13 3.64 -1.04 -2.99 116.57 119.06 1pl4 h LYS 178 Ca 0.18 -0.06 -0.17 0.00 -1.27 0.00 0.00 60.65 59.32 1pl4 h LYS 178 Cb 0.49 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1pl4 h LYS 178 CO 0.02 0.66 -0.59 0.00 -2.27 0.00 0.00 179.45 177.28 1pl4 h ALA 179 N 1.38 0.63 0.00 5.00 0.00 -0.70 -3.27 119.26 122.30 1pl4 h ALA 179 Ca 0.36 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1pl4 h ALA 179 Cb 0.09 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1pl4 h ALA 179 CO -0.15 0.70 -0.08 0.97 0.00 0.00 0.00 179.25 180.69 1pl4 h ILE 180 N 0.45 0.24 -0.35 0.00 2.10 -0.98 -2.01 117.51 116.97 1pl4 h ILE 180 Ca 0.00 -0.68 0.10 0.00 1.08 0.00 0.00 64.86 65.36 1pl4 h ILE 180 Cb 1.15 1.55 -0.01 0.00 -1.09 0.00 0.00 36.82 38.41 1pl4 h ILE 180 CO 0.11 0.08 0.29 -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 -1.62 -1.48 115.95 119.10 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 0.54 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.70 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 4.21 -1.58 -3.23 115.58 111.49 1pl4 h ASN 182 Ca 0.16 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.67 1pl4 h ASN 182 Cb 0.74 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.94 1pl4 h ASN 182 CO -0.00 0.00 -0.03 1.33 -1.29 0.00 0.00 177.43 177.44 1pl4 n VAL 183 N -2.52 0.90 -1.95 2.81 0.24 -0.57 -2.83 118.33 114.42 1pl4 n VAL 183 Ca 0.01 -0.97 -0.42 0.00 -2.04 0.00 0.00 64.34 60.93 1pl4 n VAL 183 Cb 0.24 0.47 -0.02 0.00 -1.47 0.00 0.00 33.84 33.05 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 -1.07 2.56 -1.15 1.34 -1.09 -1.14 0.07 121.20 120.71 1pl4 s ILE 184 Ca 0.05 0.44 -0.18 0.00 -2.23 0.00 0.00 60.65 58.74 1pl4 s ILE 184 Cb 0.05 -3.28 0.11 0.00 -1.58 0.00 0.00 42.46 37.76 1pl4 s ILE 184 CO 0.01 0.06 1.47 0.21 -1.23 0.00 0.00 174.94 175.45 1pl4 s ASN 185 N 0.70 6.82 0.57 3.58 3.84 0.13 -0.17 114.94 130.40 1pl4 s ASN 185 Ca 0.64 -2.38 0.34 0.00 0.21 0.00 0.00 52.86 51.67 1pl4 s ASN 185 Cb -0.43 -2.49 1.69 0.00 -0.55 0.00 0.00 41.25 39.47 1pl4 s ASN 185 CO 0.39 -1.07 2.13 -0.50 -2.79 0.00 0.00 177.10 175.26 1pl4 h TRP 186 N 8.06 0.00 -0.56 0.43 4.06 -1.85 -1.14 115.95 124.95 1pl4 h TRP 186 Ca 0.31 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 61.19 1pl4 h TRP 186 Cb 0.92 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.06 1pl4 h TRP 186 CO 1.25 0.06 0.10 1.49 -3.56 0.00 0.00 178.44 177.77 1pl4 h GLU 187 N 0.00 0.93 -0.16 0.49 4.81 -1.96 0.17 114.58 118.86 1pl4 h GLU 187 Ca -0.00 -0.25 -0.06 0.00 -0.13 0.00 0.00 59.36 58.92 1pl4 h GLU 187 Cb 0.29 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 1pl4 h GLU 187 CO 0.01 0.89 -0.14 -0.97 -0.73 0.00 0.00 179.01 178.06 1pl4 h ASN 188 N 0.82 0.40 -0.98 1.04 -0.73 -1.52 -0.96 115.58 113.65 1pl4 h ASN 188 Ca 0.17 -0.47 0.04 0.00 1.87 0.00 0.00 56.30 57.92 1pl4 h ASN 188 Cb 0.40 -0.11 -0.06 0.00 0.27 0.00 0.00 38.32 38.82 1pl4 h ASN 188 CO 0.01 0.78 0.64 0.58 -0.37 0.00 0.00 177.43 179.07 1pl4 h VAL 189 N 0.02 1.15 -0.67 2.57 2.07 -1.21 -0.08 116.25 120.10 1pl4 h VAL 189 Ca 0.03 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.10 1pl4 h VAL 189 Cb 0.66 -0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 1pl4 h VAL 189 CO 0.04 0.22 0.29 0.74 0.02 0.00 0.00 177.57 178.88 1pl4 h THR 190 N 1.22 1.24 -0.33 2.57 2.02 -0.89 -0.35 112.91 118.39 1pl4 h THR 190 Ca 0.40 -0.71 0.01 0.00 0.77 0.00 0.00 66.41 66.88 1pl4 h THR 190 Cb 0.03 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 1pl4 h THR 190 CO -0.13 0.29 0.19 -0.33 0.37 0.00 0.00 175.52 175.90 1pl4 h GLU 191 N 0.94 0.38 -0.74 6.66 5.08 -0.22 0.03 114.58 126.72 1pl4 h GLU 191 Ca 0.23 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1pl4 h GLU 191 Cb 0.18 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 1pl4 h GLU 191 CO -0.02 0.25 0.41 0.00 -1.00 0.00 0.00 179.01 178.65 1pl4 h ARG 192 N 0.39 1.01 -0.11 2.33 3.08 -0.70 -2.40 114.38 117.98 1pl4 h ARG 192 Ca 0.13 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1pl4 h ARG 192 Cb -0.00 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.84 1pl4 h ARG 192 CO -0.06 0.74 0.01 -0.92 -1.07 0.00 0.00 179.97 178.67 1pl4 h TYR 193 N 1.02 0.20 0.00 3.04 3.20 -0.72 -3.12 116.97 120.59 1pl4 h TYR 193 Ca 0.26 -0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.05 1pl4 h TYR 193 Cb 0.02 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 1pl4 h TYR 193 CO 0.01 0.42 -0.23 0.52 -1.64 0.00 0.00 178.16 177.23 1pl4 h MET 194 N -0.07 0.00 0.00 1.82 2.86 -0.82 -1.64 114.93 117.08 1pl4 h MET 194 Ca 0.03 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.65 1pl4 h MET 194 Cb 0.33 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 1pl4 h MET 194 CO 0.00 0.23 -0.09 0.00 1.06 0.00 0.00 176.91 178.12 1pl4 h ALA 195 N 1.77 1.20 0.00 6.32 0.00 -1.37 0.11 119.26 127.29 1pl4 h ALA 195 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1pl4 h ALA 195 Cb 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1pl4 h ALA 195 CO 0.03 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.39 1pl4 n LYS 197 N -2.54 2.83 0.00 0.00 5.02 -0.02 -5.07 118.16 118.39 1pl4 n LYS 197 Ca 0.03 -1.57 0.10 0.00 -2.02 0.00 0.00 58.31 54.84 1pl4 n LYS 197 Cb 0.34 -1.05 0.57 0.00 -0.02 0.00 0.00 35.03 34.87 1pl4 n LYS 197 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24