#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 3.48 0.11 5.64 3.76 -1.26 -5.09 115.29 121.92 1pl4 s HIS 2 Ca 0.00 1.30 0.03 0.00 -0.15 0.00 0.00 55.06 56.25 1pl4 s HIS 2 Cb 0.00 -2.58 -0.04 0.00 1.11 0.00 0.00 32.58 31.07 1pl4 s HIS 2 CO 0.00 0.18 -0.09 -1.54 -0.85 0.00 0.00 174.74 172.44 1pl4 s SER 3 N -2.03 1.45 -0.27 1.40 1.04 -1.26 -4.93 113.70 109.11 1pl4 s SER 3 Ca 0.50 -0.88 -0.29 0.00 0.48 0.00 0.00 55.95 55.76 1pl4 s SER 3 Cb -0.13 0.02 -0.00 0.00 0.10 0.00 0.00 66.02 66.01 1pl4 s SER 3 CO 0.19 -0.31 1.27 -0.22 0.98 0.00 0.00 173.24 175.14 1pl4 s LEU 4 N -2.68 3.96 0.31 2.42 2.96 -1.26 -5.00 118.68 119.40 1pl4 s LEU 4 Ca 0.08 1.32 -0.28 0.00 -0.22 0.00 0.00 54.13 55.03 1pl4 s LEU 4 Cb -0.00 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 43.05 1pl4 s LEU 4 CO -0.01 -0.98 1.15 -2.16 -1.32 0.00 0.00 176.35 173.04 1pl4 s PRO 5 N 3.94 4.47 0.63 0.98 0.04 -1.26 -4.98 135.00 138.82 1pl4 s PRO 5 Ca 0.55 1.88 -0.18 0.00 0.04 0.00 0.00 61.00 63.28 1pl4 s PRO 5 Cb -0.18 -3.06 -0.02 0.00 0.04 0.00 0.00 34.50 31.29 1pl4 s PRO 5 CO 0.20 0.04 1.26 -0.51 0.04 0.00 0.00 177.00 178.03 1pl4 s ASP 6 N -0.87 4.81 0.57 6.66 1.01 -1.26 -4.98 116.67 122.61 1pl4 s ASP 6 Ca 0.48 2.54 -0.18 0.00 0.71 0.00 0.00 52.55 56.10 1pl4 s ASP 6 Cb -0.33 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 40.95 1pl4 s ASP 6 CO 0.42 -1.86 1.12 -0.76 0.21 0.00 0.00 175.17 174.30 1pl4 s LEU 7 N -4.25 3.65 0.00 1.23 1.43 -1.26 -4.94 118.68 114.53 1pl4 s LEU 7 Ca 0.81 2.10 0.26 0.00 -1.03 0.00 0.00 54.13 56.27 1pl4 s LEU 7 Cb -0.35 -4.57 1.49 0.00 0.03 0.00 0.00 46.19 42.79 1pl4 s LEU 7 CO 0.37 -1.31 1.88 -2.65 0.23 0.00 0.00 176.35 174.87 1pl4 n PRO 8 N -1.62 0.73 -3.98 1.29 -0.02 -1.26 -4.88 135.00 125.26 1pl4 n PRO 8 Ca 0.11 0.01 -0.09 0.00 -2.02 0.00 0.00 63.50 61.51 1pl4 n PRO 8 Cb 0.51 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.44 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 -2.10 0.34 0.78 6.00 -0.85 -1.26 -5.08 117.35 115.18 1pl4 s TYR 9 Ca 0.36 -0.70 -0.11 0.00 -0.52 0.00 0.00 57.07 56.10 1pl4 s TYR 9 Cb 0.18 0.19 0.06 0.00 0.38 0.00 0.00 41.96 42.77 1pl4 s TYR 9 CO 0.31 -0.98 1.09 -0.51 -1.52 0.00 0.00 175.55 173.94 1pl4 s ASP 10 N -3.01 4.67 0.42 -0.18 1.01 -1.26 -4.92 116.67 113.41 1pl4 s ASP 10 Ca 0.21 1.33 0.10 0.00 0.71 0.00 0.00 52.55 54.90 1pl4 s ASP 10 Cb -0.01 -2.08 0.92 0.00 1.01 0.00 0.00 42.92 42.75 1pl4 s ASP 10 CO 0.08 -1.86 2.03 1.88 0.21 0.00 0.00 175.17 177.51 1pl4 h TYR 11 N -1.01 0.33 -0.43 4.23 0.05 -1.97 -0.51 116.97 117.66 1pl4 h TYR 11 Ca -0.46 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.31 1pl4 h TYR 11 Cb 1.26 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.89 1pl4 h TYR 11 CO 0.49 0.28 0.00 0.41 -1.05 0.00 0.00 178.16 178.28 1pl4 n GLY 12 N -1.29 1.59 0.31 3.88 0.00 -1.26 -4.11 105.19 104.30 1pl4 n GLY 12 Ca 0.01 -0.53 0.20 0.00 0.00 0.00 0.00 46.02 45.70 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 3.66 1.01 -0.55 4.61 0.00 -1.43 -3.04 119.26 123.52 1pl4 h ALA 13 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pl4 h ALA 13 Cb 0.89 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1pl4 h ALA 13 CO 0.10 0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.64 1pl4 n LEU 14 N -3.11 3.73 -4.74 0.00 4.77 -1.26 -4.46 117.00 111.93 1pl4 n LEU 14 Ca -0.01 -2.15 -0.40 0.00 -0.03 0.00 0.00 56.01 53.42 1pl4 n LEU 14 Cb 0.19 -0.42 0.02 0.00 -2.33 0.00 0.00 43.42 40.89 1pl4 n LEU 14 CO 0.24 0.84 0.99 -0.62 -1.33 0.00 0.00 177.39 177.51 1pl4 n GLU 15 N 0.99 2.04 -0.23 3.23 -0.58 -1.15 -0.32 120.64 124.62 1pl4 n GLU 15 Ca 0.20 0.73 0.07 0.00 -0.42 0.00 0.00 57.16 57.74 1pl4 n GLU 15 Cb 0.62 -2.54 0.20 0.00 -0.57 0.00 0.00 31.44 29.15 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 -0.27 2.05 -0.03 3.49 -0.04 -1.26 -4.89 135.00 134.05 1pl4 n PRO 16 Ca 0.07 -1.63 -0.13 0.00 -0.04 0.00 0.00 63.50 61.76 1pl4 n PRO 16 Cb 0.41 -1.35 -0.09 0.00 -0.04 0.00 0.00 33.50 32.43 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 2.64 0.20 -3.27 0.54 3.86 -1.01 -3.40 115.15 114.71 1pl4 h HIS 17 Ca 0.00 -0.07 -0.54 0.00 -1.16 0.00 0.00 60.37 58.59 1pl4 h HIS 17 Cb 0.61 -0.04 -0.37 0.00 1.06 0.00 0.00 27.41 28.66 1pl4 h HIS 17 CO 0.30 0.69 -0.80 0.42 0.86 0.00 0.00 177.93 179.40 1pl4 s ILE 18 N -3.97 1.08 0.80 2.45 1.01 -0.70 -4.80 121.20 117.07 1pl4 s ILE 18 Ca -0.15 -0.51 -0.11 0.00 0.00 0.00 0.00 60.65 59.87 1pl4 s ILE 18 Cb 0.03 -1.20 0.07 0.00 0.01 0.00 0.00 42.46 41.36 1pl4 s ILE 18 CO 0.72 0.22 1.10 0.54 0.00 0.00 0.00 174.94 177.51 1pl4 s ASN 19 N 1.66 4.48 0.35 3.58 2.20 -1.26 -3.52 114.94 122.43 1pl4 s ASN 19 Ca 0.02 1.29 0.11 0.00 -0.94 0.00 0.00 52.86 53.34 1pl4 s ASN 19 Cb -0.14 -2.02 0.65 0.00 -2.00 0.00 0.00 41.25 37.74 1pl4 s ASN 19 CO -0.08 -1.97 1.80 0.00 -2.94 0.00 0.00 177.10 173.91 1pl4 h ALA 20 N -1.09 1.32 -0.41 3.54 0.00 -1.91 -2.18 119.26 118.53 1pl4 h ALA 20 Ca -0.47 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 53.95 1pl4 h ALA 20 Cb 1.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1pl4 h ALA 20 CO 0.59 0.49 -0.29 0.37 0.00 0.00 0.00 179.25 180.41 1pl4 h GLN 21 N 0.07 0.90 -0.33 0.00 4.15 -1.91 0.45 115.11 118.43 1pl4 h GLN 21 Ca 0.01 -0.41 -0.03 0.00 0.77 0.00 0.00 58.65 58.98 1pl4 h GLN 21 Cb 0.68 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.34 1pl4 h GLN 21 CO 0.05 1.06 0.09 0.82 -1.93 0.00 0.00 178.83 178.92 1pl4 h ILE 22 N 0.76 1.22 -0.09 2.39 2.04 -1.78 -2.32 117.51 119.73 1pl4 h ILE 22 Ca 0.08 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.22 1pl4 h ILE 22 Cb 0.86 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1pl4 h ILE 22 CO 0.08 0.25 0.04 0.24 0.00 0.00 0.00 178.15 178.75 1pl4 h MET 23 N 0.38 0.09 -0.40 2.37 2.86 -1.19 -0.10 114.93 118.94 1pl4 h MET 23 Ca 0.11 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1pl4 h MET 23 Cb 0.29 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 1pl4 h MET 23 CO 0.00 0.06 0.19 0.37 1.06 0.00 0.00 176.91 178.59 1pl4 h GLN 24 N 0.09 0.57 -0.51 1.72 4.15 -0.86 -1.05 115.11 119.23 1pl4 h GLN 24 Ca 0.04 -0.08 -0.06 0.00 0.77 0.00 0.00 58.65 59.31 1pl4 h GLN 24 Cb 0.01 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.58 1pl4 h GLN 24 CO -0.03 0.50 0.07 -0.07 -1.93 0.00 0.00 178.83 177.37 1pl4 h LEU 25 N 0.50 0.82 -0.95 -2.39 3.38 -1.31 0.92 115.31 116.29 1pl4 h LEU 25 Ca 0.14 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1pl4 h LEU 25 Cb 0.12 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1pl4 h LEU 25 CO -0.02 0.88 0.47 -0.74 0.09 0.00 0.00 178.44 179.12 1pl4 h HIS 26 N 0.73 1.19 0.00 1.13 2.76 -0.73 -1.11 115.15 119.12 1pl4 h HIS 26 Ca 0.15 -0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.23 1pl4 h HIS 26 Cb 0.42 -0.38 -0.01 0.00 1.55 0.00 0.00 27.41 28.99 1pl4 h HIS 26 CO 0.03 0.83 -0.53 1.25 -1.30 0.00 0.00 177.93 178.21 1pl4 h HIS 27 N 1.21 0.00 0.00 5.26 -0.00 -1.10 0.03 115.15 120.56 1pl4 h HIS 27 Ca 0.30 0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.62 1pl4 h HIS 27 Cb 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.44 1pl4 h HIS 27 CO 0.01 0.58 -0.25 0.66 -0.00 0.00 0.00 177.93 178.93 1pl4 h SER 28 N -1.00 0.00 0.00 3.26 4.64 -0.88 -2.89 113.55 116.67 1pl4 h SER 28 Ca -0.10 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.13 1pl4 h SER 28 Cb 0.70 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.78 1pl4 h SER 28 CO -0.06 0.25 -1.05 0.29 -0.87 0.00 0.00 176.83 175.39 1pl4 n LYS 29 N -3.25 0.16 0.14 4.77 4.76 -0.63 -4.38 118.16 119.72 1pl4 n LYS 29 Ca 0.02 0.07 -0.12 0.00 -2.87 0.00 0.00 58.31 55.41 1pl4 n LYS 29 Cb 0.54 -0.77 -0.07 0.00 -1.84 0.00 0.00 35.03 32.88 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 -0.28 -0.37 -0.48 2.13 2.76 -1.25 -2.10 115.15 115.56 1pl4 h HIS 30 Ca -0.13 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.00 1pl4 h HIS 30 Cb 0.87 0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.93 1pl4 h HIS 30 CO -0.06 -0.02 0.19 1.25 -1.30 0.00 0.00 177.93 177.99 1pl4 h HIS 31 N -0.88 0.73 -0.81 5.26 -0.00 -1.04 -2.70 115.15 115.71 1pl4 h HIS 31 Ca -0.04 -0.06 0.15 0.00 -0.00 0.00 0.00 60.37 60.42 1pl4 h HIS 31 Cb 0.52 -0.22 -0.06 0.00 -0.00 0.00 0.00 27.41 27.65 1pl4 h HIS 31 CO 0.04 0.62 0.53 0.00 -0.00 0.00 0.00 177.93 179.12 1pl4 h ALA 32 N 1.04 2.03 -0.38 5.26 0.00 -1.46 -1.25 119.26 124.50 1pl4 h ALA 32 Ca 0.16 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 1pl4 h ALA 32 Cb 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1pl4 h ALA 32 CO -0.01 -0.25 -0.26 0.00 0.00 0.00 0.00 179.25 178.73 1pl4 h ALA 33 N 1.63 0.82 -0.66 0.00 0.00 -1.06 -1.94 119.26 118.04 1pl4 h ALA 33 Ca 0.40 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1pl4 h ALA 33 Cb 0.83 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1pl4 h ALA 33 CO -0.15 0.64 0.16 1.88 0.00 0.00 0.00 179.25 181.78 1pl4 h TYR 34 N 0.68 1.10 -0.36 0.00 0.05 -1.06 -0.84 116.97 116.54 1pl4 h TYR 34 Ca 0.09 -0.12 0.01 0.00 0.05 0.00 0.00 58.73 58.75 1pl4 h TYR 34 Cb 0.79 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 38.19 1pl4 h TYR 34 CO 0.04 0.90 0.24 0.28 -1.05 0.00 0.00 178.16 178.57 1pl4 h VAL 35 N 1.00 1.08 -0.14 -2.88 2.07 -1.04 0.91 116.25 117.25 1pl4 h VAL 35 Ca 0.21 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 1pl4 h VAL 35 Cb 0.36 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1pl4 h VAL 35 CO 0.00 0.09 0.03 -1.13 0.02 0.00 0.00 177.57 176.58 1pl4 h ASN 36 N 0.48 0.21 0.46 0.57 -1.24 -1.07 -1.95 115.58 113.04 1pl4 h ASN 36 Ca 0.14 -0.24 -0.10 0.00 0.71 0.00 0.00 56.30 56.81 1pl4 h ASN 36 Cb -0.05 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 38.93 1pl4 h ASN 36 CO -0.04 0.39 -0.46 0.78 -1.29 0.00 0.00 177.43 176.82 1pl4 h ASN 37 N 0.02 0.00 -0.33 1.15 2.35 -1.02 -1.95 115.58 115.80 1pl4 h ASN 37 Ca 0.04 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.76 1pl4 h ASN 37 Cb 0.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1pl4 h ASN 37 CO 0.00 0.46 0.06 0.25 -1.65 0.00 0.00 177.43 176.55 1pl4 h LEU 38 N 0.00 0.53 -0.54 1.61 5.85 -0.58 -0.38 115.31 121.79 1pl4 h LEU 38 Ca -0.00 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.51 1pl4 h LEU 38 Cb 0.82 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.66 1pl4 h LEU 38 CO 0.06 0.65 0.26 0.78 -0.34 0.00 0.00 178.44 179.85 1pl4 h ASN 39 N 0.38 0.37 -0.37 1.25 2.35 -0.85 0.83 115.58 119.54 1pl4 h ASN 39 Ca 0.10 0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.85 1pl4 h ASN 39 Cb 0.34 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.67 1pl4 h ASN 39 CO 0.01 0.25 0.10 0.58 -1.65 0.00 0.00 177.43 176.71 1pl4 h VAL 40 N 0.51 1.22 -0.48 2.81 2.07 -1.30 -1.60 116.25 119.48 1pl4 h VAL 40 Ca 0.24 -0.74 -0.13 0.00 0.82 0.00 0.00 66.70 66.89 1pl4 h VAL 40 Cb 0.17 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1pl4 h VAL 40 CO -0.18 0.25 -0.21 0.74 0.02 0.00 0.00 177.57 178.20 1pl4 h THR 41 N 0.44 1.27 -0.65 2.57 2.02 -0.69 -0.74 112.91 117.13 1pl4 h THR 41 Ca 0.12 -1.37 -0.00 0.00 0.77 0.00 0.00 66.41 65.93 1pl4 h THR 41 Cb 0.29 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 1pl4 h THR 41 CO -0.00 0.47 0.40 -0.33 0.37 0.00 0.00 175.52 176.43 1pl4 h GLU 42 N 0.85 0.89 -0.36 6.66 5.08 -0.69 0.20 114.58 127.22 1pl4 h GLU 42 Ca 0.11 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 1pl4 h GLU 42 Cb 0.78 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 1pl4 h GLU 42 CO 0.06 0.63 -0.18 1.49 -1.00 0.00 0.00 179.01 180.02 1pl4 h GLU 43 N 0.89 0.66 -0.16 2.33 4.81 -0.95 0.13 114.58 122.28 1pl4 h GLU 43 Ca 0.24 -0.23 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 1pl4 h GLU 43 Cb -0.03 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 1pl4 h GLU 43 CO -0.04 0.80 -0.38 0.87 -0.73 0.00 0.00 179.01 179.52 1pl4 h LYS 44 N 0.59 0.35 -0.18 1.92 1.57 -0.60 -2.04 116.57 118.18 1pl4 h LYS 44 Ca 0.09 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 1pl4 h LYS 44 Cb 0.63 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 1pl4 h LYS 44 CO 0.04 0.68 -0.21 -0.92 -0.57 0.00 0.00 179.45 178.48 1pl4 h TYR 45 N 0.30 0.56 -0.97 -1.35 5.03 -0.03 -1.18 116.97 119.33 1pl4 h TYR 45 Ca 0.03 -0.17 0.04 0.00 2.58 0.00 0.00 58.73 61.21 1pl4 h TYR 45 Cb 0.81 -0.12 -0.06 0.00 1.55 0.00 0.00 36.73 38.92 1pl4 h TYR 45 CO 0.02 0.84 0.63 0.37 -1.32 0.00 0.00 178.16 178.71 1pl4 h GLN 46 N 0.12 1.16 -0.55 1.82 5.75 -0.60 0.12 115.11 122.93 1pl4 h GLN 46 Ca 0.03 -0.07 -0.03 0.00 -0.15 0.00 0.00 58.65 58.42 1pl4 h GLN 46 Cb 0.76 -0.26 -0.02 0.00 1.07 0.00 0.00 27.48 29.02 1pl4 h GLN 46 CO 0.05 0.77 0.21 0.93 -2.65 0.00 0.00 178.83 178.13 1pl4 h GLU 47 N 1.19 0.83 -0.19 1.69 5.08 -1.09 -1.49 114.58 120.60 1pl4 h GLU 47 Ca 0.39 -0.16 0.01 0.00 -1.00 0.00 0.00 59.36 58.61 1pl4 h GLU 47 Cb 0.06 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1pl4 h GLU 47 CO -0.13 0.73 0.09 0.00 -1.00 0.00 0.00 179.01 178.70 1pl4 h ALA 48 N 1.06 0.23 -0.56 3.43 0.00 -0.69 -2.56 119.26 120.17 1pl4 h ALA 48 Ca 0.18 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1pl4 h ALA 48 Cb 0.22 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1pl4 h ALA 48 CO -0.01 -0.33 0.36 1.25 0.00 0.00 0.00 179.25 180.52 1pl4 h LEU 49 N 0.20 0.65 -2.57 0.00 5.85 -0.59 -1.43 115.31 117.42 1pl4 h LEU 49 Ca 0.08 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1pl4 h LEU 49 Cb 0.02 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 1pl4 h LEU 49 CO -0.06 0.49 -0.01 0.00 -0.34 0.00 0.00 178.44 178.53 1pl4 h ALA 50 N 1.19 1.39 -0.01 1.25 0.00 -1.14 -2.27 119.26 119.67 1pl4 h ALA 50 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1pl4 h ALA 50 Cb -0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1pl4 h ALA 50 CO -0.04 0.01 -0.42 1.63 0.00 0.00 0.00 179.25 180.43 1pl4 n LYS 51 N -3.65 1.17 -1.59 0.00 5.02 -0.63 -4.95 118.16 113.54 1pl4 n LYS 51 Ca -0.03 -0.93 -0.08 0.00 -2.02 0.00 0.00 58.31 55.25 1pl4 n LYS 51 Cb 0.09 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.59 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 1.40 0.63 3.46 0.72 0.00 -0.79 -4.95 105.19 105.66 1pl4 n GLY 52 Ca 0.10 -0.63 -0.44 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.81 6.65 0.20 1.61 -1.08 -0.66 -4.83 116.67 115.75 1pl4 s ASP 53 Ca 0.00 -2.07 0.01 0.00 -0.52 0.00 0.00 52.55 49.97 1pl4 s ASP 53 Cb 0.00 -2.41 0.13 0.00 -1.46 0.00 0.00 42.92 39.18 1pl4 s ASP 53 CO 0.00 -1.07 1.49 0.58 0.52 0.00 0.00 175.17 176.69 1pl4 h VAL 54 N 5.82 1.38 -0.36 1.11 2.07 -1.92 -1.62 116.25 122.72 1pl4 h VAL 54 Ca 0.17 -2.05 0.01 0.00 0.82 0.00 0.00 66.70 65.65 1pl4 h VAL 54 Cb 1.01 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 1pl4 h VAL 54 CO 1.14 0.61 0.22 0.74 0.02 0.00 0.00 177.57 180.30 1pl4 h THR 55 N 0.26 1.07 -0.41 2.57 2.02 -1.99 0.06 112.91 116.49 1pl4 h THR 55 Ca -0.02 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 66.99 1pl4 h THR 55 Cb 1.21 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 68.17 1pl4 h THR 55 CO 0.11 0.08 0.19 0.00 0.37 0.00 0.00 175.52 176.28 1pl4 h ALA 56 N 1.14 0.53 -0.26 6.16 0.00 -1.90 -0.17 119.26 124.77 1pl4 h ALA 56 Ca 0.14 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1pl4 h ALA 56 Cb -0.03 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1pl4 h ALA 56 CO -0.05 0.09 0.03 1.96 0.00 0.00 0.00 179.25 181.29 1pl4 h GLN 57 N 0.52 0.11 -0.54 0.00 4.20 -1.03 -1.85 115.11 116.52 1pl4 h GLN 57 Ca 0.14 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.76 1pl4 h GLN 57 Cb 0.13 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 1pl4 h GLN 57 CO -0.02 0.08 0.01 0.82 -0.67 0.00 0.00 178.83 179.05 1pl4 h ILE 58 N 0.12 1.25 0.00 2.54 2.04 -0.68 -1.97 117.51 120.81 1pl4 h ILE 58 Ca 0.12 -1.07 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 1pl4 h ILE 58 Cb 0.14 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1pl4 h ILE 58 CO -0.18 0.38 -0.07 0.00 0.00 0.00 0.00 178.15 178.28 1pl4 h ALA 59 N 1.15 1.47 0.00 1.87 0.00 -0.67 -2.34 119.26 120.73 1pl4 h ALA 59 Ca 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1pl4 h ALA 59 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1pl4 h ALA 59 CO 0.02 0.09 -0.33 1.28 0.00 0.00 0.00 179.25 180.32 1pl4 n LEU 60 N -3.86 0.40 -0.10 0.00 4.77 -0.73 -4.36 117.00 113.13 1pl4 n LEU 60 Ca -0.02 0.24 -0.07 0.00 -0.03 0.00 0.00 56.01 56.12 1pl4 n LEU 60 Cb 0.17 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 40.94 1pl4 n LEU 60 CO 0.30 0.03 0.96 1.56 -1.33 0.00 0.00 177.39 178.92 1pl4 h GLN 61 N 0.00 0.32 -0.87 3.23 4.20 -1.20 -1.00 115.11 119.80 1pl4 h GLN 61 Ca 0.00 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.73 1pl4 h GLN 61 Cb 0.56 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.21 1pl4 h GLN 61 CO 0.00 0.21 0.55 -1.35 -0.67 0.00 0.00 178.83 177.58 1pl4 h PRO 62 N 0.33 1.02 -0.07 1.46 0.11 -1.78 -0.07 132.00 133.00 1pl4 h PRO 62 Ca 0.15 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 66.07 1pl4 h PRO 62 Cb 0.07 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.94 1pl4 h PRO 62 CO -0.11 0.67 -0.52 0.00 -0.21 0.00 0.00 178.00 177.84 1pl4 h ALA 63 N 1.38 1.01 -0.16 -0.75 0.00 -1.72 -0.12 119.26 118.90 1pl4 h ALA 63 Ca 0.36 -0.48 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1pl4 h ALA 63 Cb 0.07 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1pl4 h ALA 63 CO -0.14 0.66 -0.19 1.25 0.00 0.00 0.00 179.25 180.84 1pl4 h LEU 64 N 0.14 0.44 -0.32 0.00 7.12 -0.55 -1.47 115.31 120.67 1pl4 h LEU 64 Ca 0.00 -0.50 -0.03 0.00 0.13 0.00 0.00 57.88 57.48 1pl4 h LEU 64 Cb 0.96 -0.12 -0.01 0.00 -0.53 0.00 0.00 40.66 40.95 1pl4 h LEU 64 CO 0.08 0.85 0.07 0.50 -0.13 0.00 0.00 178.44 179.81 1pl4 h LYS 65 N 0.03 0.52 0.29 1.25 3.64 -0.99 0.13 116.57 121.44 1pl4 h LYS 65 Ca 0.02 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 1pl4 h LYS 65 Cb 0.74 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1pl4 h LYS 65 CO 0.05 0.59 -0.14 0.35 -2.27 0.00 0.00 179.45 178.02 1pl4 h PHE 66 N 0.36 -0.36 -0.04 1.91 3.57 -1.03 0.29 116.94 121.64 1pl4 h PHE 66 Ca 0.10 -0.01 -0.25 0.00 3.53 0.00 0.00 57.97 61.34 1pl4 h PHE 66 Cb 0.31 0.12 0.02 0.00 2.79 0.00 0.00 35.95 39.18 1pl4 h PHE 66 CO 0.02 -0.08 -0.96 -0.91 -2.23 0.00 0.00 178.31 174.15 1pl4 h ASN 67 N -0.63 0.85 -0.04 0.41 2.35 -1.34 0.17 115.58 117.34 1pl4 h ASN 67 Ca -0.04 -0.65 -0.00 0.00 -0.55 0.00 0.00 56.30 55.06 1pl4 h ASN 67 Cb 0.45 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 1pl4 h ASN 67 CO 0.07 1.45 0.02 1.23 -1.65 0.00 0.00 177.43 178.54 1pl4 h GLY 68 N 0.60 0.07 0.73 2.83 0.00 -0.81 -0.59 103.07 105.90 1pl4 h GLY 68 Ca -0.10 -0.04 0.05 0.00 0.00 0.00 0.00 47.33 47.23 1pl4 h GLY 68 CO 0.19 0.04 0.28 -1.33 0.00 0.00 0.00 176.54 175.71 1pl4 h GLY 69 N -0.09 0.75 0.85 4.60 0.00 -0.44 -1.07 103.07 107.67 1pl4 h GLY 69 Ca 0.01 -0.19 0.05 0.00 0.00 0.00 0.00 47.33 47.20 1pl4 h GLY 69 CO -0.00 0.12 0.63 -1.33 0.00 0.00 0.00 176.54 175.97 1pl4 h GLY 70 N 0.54 1.44 0.85 4.60 0.00 -0.40 0.18 103.07 110.28 1pl4 h GLY 70 Ca 0.23 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 1pl4 h GLY 70 CO -0.16 0.37 0.04 0.84 0.00 0.00 0.00 176.54 177.64 1pl4 h HIS 71 N 1.18 0.33 -0.01 5.60 6.17 -0.33 -1.54 115.15 126.55 1pl4 h HIS 71 Ca 0.40 -0.04 0.02 0.00 0.71 0.00 0.00 60.37 61.46 1pl4 h HIS 71 Cb 0.09 -0.09 -0.03 0.00 2.52 0.00 0.00 27.41 29.90 1pl4 h HIS 71 CO -0.00 0.44 -0.14 0.82 0.71 0.00 0.00 177.93 179.77 1pl4 h ILE 72 N 0.13 0.66 -0.20 6.26 2.04 -0.75 -1.49 117.51 124.16 1pl4 h ILE 72 Ca 0.06 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.89 1pl4 h ILE 72 Cb 0.28 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1pl4 h ILE 72 CO 0.00 0.00 0.01 0.78 0.00 0.00 0.00 178.15 178.94 1pl4 h ASN 73 N -0.22 0.34 -0.25 1.72 2.35 -0.59 -2.19 115.58 116.73 1pl4 h ASN 73 Ca 0.05 -0.30 -0.12 0.00 -0.55 0.00 0.00 56.30 55.38 1pl4 h ASN 73 Cb 0.29 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1pl4 h ASN 73 CO -0.14 0.55 -0.27 0.45 -1.65 0.00 0.00 177.43 176.38 1pl4 h HIS 74 N 0.12 0.85 -0.55 1.19 3.86 -1.26 -1.29 115.15 118.06 1pl4 h HIS 74 Ca 0.06 -0.21 0.06 0.00 -1.16 0.00 0.00 60.37 59.12 1pl4 h HIS 74 Cb 0.37 -0.20 -0.05 0.00 1.06 0.00 0.00 27.41 28.59 1pl4 h HIS 74 CO 0.03 0.93 0.27 0.77 0.86 0.00 0.00 177.93 180.79 1pl4 h SER 75 N 0.64 0.37 -0.32 2.45 0.02 -1.12 -1.60 113.55 113.98 1pl4 h SER 75 Ca 0.08 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 1pl4 h SER 75 Cb 0.78 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 1pl4 h SER 75 CO 0.06 0.25 0.13 0.40 -1.14 0.00 0.00 176.83 176.53 1pl4 h ILE 76 N 0.51 1.18 -0.46 3.27 2.04 -1.12 -3.25 117.51 119.69 1pl4 h ILE 76 Ca 0.25 -0.57 0.06 0.00 1.00 0.00 0.00 64.86 65.60 1pl4 h ILE 76 Cb 0.19 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 37.18 1pl4 h ILE 76 CO -0.19 0.20 0.17 0.15 0.00 0.00 0.00 178.15 178.48 1pl4 h PHE 77 N 0.37 0.31 -0.72 1.37 3.57 -0.63 -1.19 116.94 120.01 1pl4 h PHE 77 Ca 0.11 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 1pl4 h PHE 77 Cb 0.19 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.82 1pl4 h PHE 77 CO -0.00 0.12 0.46 -1.49 -2.23 0.00 0.00 178.31 175.17 1pl4 h TRP 78 N 0.35 0.92 0.00 0.41 -0.00 -1.36 -0.54 115.95 115.74 1pl4 h TRP 78 Ca 0.22 0.02 0.00 0.00 -0.00 0.00 0.00 58.89 59.12 1pl4 h TRP 78 Cb 0.20 -0.31 0.00 0.00 -0.00 0.00 0.00 29.16 29.06 1pl4 h TRP 78 CO -0.15 0.59 0.00 1.79 -0.00 0.00 0.00 178.44 180.67 1pl4 h THR 79 N 0.98 0.00 -0.00 1.49 1.35 -1.30 -3.05 112.91 112.38 1pl4 h THR 79 Ca 0.26 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 1pl4 h THR 79 Cb -0.09 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1pl4 h THR 79 CO -0.05 0.00 -0.03 0.59 -0.25 0.00 0.00 175.52 175.77 1pl4 n ASN 80 N -2.91 0.14 -4.44 5.36 5.03 -0.22 -4.69 115.26 113.53 1pl4 n ASN 80 Ca 0.02 -0.33 -0.26 0.00 0.87 0.00 0.00 54.58 54.88 1pl4 n ASN 80 Cb 0.37 -0.20 -0.11 0.00 -1.02 0.00 0.00 39.78 38.82 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 -2.50 2.50 -0.19 3.41 1.43 -1.16 -0.62 118.68 121.56 1pl4 s LEU 81 Ca 0.30 -0.94 -0.28 0.00 -1.03 0.00 0.00 54.13 52.19 1pl4 s LEU 81 Cb 0.20 -1.14 0.09 0.00 0.03 0.00 0.00 46.19 45.37 1pl4 s LEU 81 CO 0.46 0.09 0.81 -0.55 0.23 0.00 0.00 176.35 177.39 1pl4 s SER 82 N -3.03 -0.60 0.45 2.29 0.15 0.20 -4.59 113.70 108.57 1pl4 s SER 82 Ca 0.25 0.94 0.24 0.00 0.70 0.00 0.00 55.95 58.08 1pl4 s SER 82 Cb -0.07 0.88 1.00 0.00 -1.71 0.00 0.00 66.02 66.12 1pl4 s SER 82 CO 0.12 -0.36 1.87 1.55 1.20 0.00 0.00 173.24 177.62 1pl4 h PRO 83 N 3.83 0.00 -0.86 5.44 0.13 -1.86 -2.95 132.00 135.72 1pl4 h PRO 83 Ca -0.27 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.71 1pl4 h PRO 83 Cb 1.16 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.20 1pl4 h PRO 83 CO 0.21 0.23 0.20 0.09 -0.23 0.00 0.00 178.00 178.49 1pl4 n ASN 84 N -3.48 3.73 0.00 1.44 3.02 -1.26 -4.98 115.26 113.72 1pl4 n ASN 84 Ca -0.00 -2.78 0.00 0.00 -0.03 0.00 0.00 54.58 51.76 1pl4 n ASN 84 Cb 0.40 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.91 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 -0.05 4.05 2.91 7.41 0.00 -1.12 -5.00 105.19 113.39 1pl4 n GLY 85 Ca 0.27 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.37 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 -2.34 7.00 -0.02 0.00 0.19 -4.66 105.19 110.36 1pl4 n GLY 86 Ca 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.34 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 -0.24 -0.01 3.80 -0.02 0.00 -1.26 -4.78 105.19 102.69 1pl4 n GLY 87 Ca 0.00 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 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 2.96 0.53 1.61 2.02 -1.26 -5.02 118.70 119.54 1pl4 s GLU 88 Ca 0.00 -0.72 -0.21 0.00 0.02 0.00 0.00 54.97 54.06 1pl4 s GLU 88 Cb 0.00 -2.74 -0.05 0.00 0.10 0.00 0.00 34.13 31.44 1pl4 s GLU 88 CO 0.00 0.54 1.19 -1.25 0.02 0.00 0.00 175.26 175.76 1pl4 s PRO 89 N -2.67 3.33 0.31 0.39 0.04 -1.26 -5.02 135.00 130.12 1pl4 s PRO 89 Ca 0.30 1.81 -0.05 0.00 0.04 0.00 0.00 61.00 63.10 1pl4 s PRO 89 Cb -0.11 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.24 1pl4 s PRO 89 CO 0.23 -0.91 0.59 0.15 0.04 0.00 0.00 177.00 177.09 1pl4 s LYS 90 N -3.08 3.64 0.51 4.56 1.02 -1.26 -4.49 119.74 120.65 1pl4 s LYS 90 Ca 0.71 0.04 0.00 0.00 0.02 0.00 0.00 55.97 56.75 1pl4 s LYS 90 Cb -0.29 -2.61 0.00 0.00 -0.52 0.00 0.00 37.83 34.41 1pl4 s LYS 90 CO 0.34 0.17 0.00 0.41 -0.92 0.00 0.00 175.35 175.34 1pl4 n GLY 91 N -1.08 -2.04 0.33 -3.33 0.00 -1.26 -4.27 105.19 93.54 1pl4 n GLY 91 Ca -0.01 -1.71 0.24 0.00 0.00 0.00 0.00 46.02 44.53 1pl4 n GLY 91 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1pl4 h GLU 92 N 0.00 0.06 -0.93 1.61 4.81 -1.99 -2.42 114.58 115.73 1pl4 h GLU 92 Ca 0.00 -0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.35 1pl4 h GLU 92 Cb 0.00 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.29 1pl4 h GLU 92 CO 0.00 0.04 0.59 1.25 -0.73 0.00 0.00 179.01 180.16 1pl4 h LEU 93 N 0.06 0.78 -0.66 1.64 5.85 -1.94 0.18 115.31 121.23 1pl4 h LEU 93 Ca 0.73 0.04 -0.13 0.00 0.84 0.00 0.00 57.88 59.35 1pl4 h LEU 93 Cb 1.75 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.65 1pl4 h LEU 93 CO -0.79 0.42 -0.41 0.25 -0.34 0.00 0.00 178.44 177.57 1pl4 h LEU 94 N 0.84 0.62 -0.96 2.25 5.85 -1.66 -0.04 115.31 122.21 1pl4 h LEU 94 Ca 0.45 -0.28 -0.09 0.00 0.84 0.00 0.00 57.88 58.81 1pl4 h LEU 94 Cb 0.56 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1pl4 h LEU 94 CO -0.22 0.95 -0.16 -0.33 -0.34 0.00 0.00 178.44 178.35 1pl4 h GLU 95 N 0.48 0.58 -0.44 1.25 4.39 -1.11 0.27 114.58 120.00 1pl4 h GLU 95 Ca 0.04 -0.19 -0.12 0.00 0.34 0.00 0.00 59.36 59.43 1pl4 h GLU 95 Cb 0.91 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 1pl4 h GLU 95 CO 0.08 0.71 -0.20 0.00 -1.16 0.00 0.00 179.01 178.45 1pl4 h ALA 96 N 1.31 0.62 -0.62 3.43 0.00 -0.48 -1.31 119.26 122.20 1pl4 h ALA 96 Ca 0.09 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 1pl4 h ALA 96 Cb 0.57 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1pl4 h ALA 96 CO 0.04 0.58 0.29 0.82 0.00 0.00 0.00 179.25 180.98 1pl4 h ILE 97 N 0.75 1.22 -0.74 0.00 2.04 -0.49 -0.26 117.51 120.02 1pl4 h ILE 97 Ca 0.10 -0.63 -0.06 0.00 1.00 0.00 0.00 64.86 65.27 1pl4 h ILE 97 Cb 0.76 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 1pl4 h ILE 97 CO 0.06 0.26 0.23 0.11 0.00 0.00 0.00 178.15 178.81 1pl4 h LYS 98 N 0.86 1.15 -0.43 2.37 1.57 -0.84 0.87 116.57 122.12 1pl4 h LYS 98 Ca 0.21 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1pl4 h LYS 98 Cb 0.14 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1pl4 h LYS 98 CO -0.03 0.98 0.13 -0.09 -0.57 0.00 0.00 179.45 179.87 1pl4 h ARG 99 N 1.11 0.68 0.00 3.15 2.43 -0.83 0.15 114.38 121.06 1pl4 h ARG 99 Ca 0.24 -0.15 -0.07 0.00 -0.81 0.00 0.00 59.98 59.19 1pl4 h ARG 99 Cb 0.30 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1pl4 h ARG 99 CO -0.01 0.67 -1.15 -0.44 -1.51 0.00 0.00 179.97 177.53 1pl4 h ASP 100 N 0.56 0.00 0.00 -3.80 3.32 -0.87 -3.38 116.42 112.25 1pl4 h ASP 100 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1pl4 h ASP 100 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1pl4 h ASP 100 CO -0.00 0.24 0.00 0.49 -1.72 0.00 0.00 179.24 178.25 1pl4 n PHE 101 N -2.78 0.00 0.00 4.55 3.72 0.28 -5.04 117.46 118.19 1pl4 n PHE 101 Ca -0.04 -0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1pl4 n PHE 101 Cb 0.67 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.20 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 -0.04 2.85 3.60 1.37 0.00 0.53 -4.40 105.19 109.10 1pl4 n GLY 102 Ca 0.00 -0.72 -0.08 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.37 0.22 1.61 1.04 -1.25 -4.75 113.70 110.19 1pl4 s SER 103 Ca 0.00 -0.21 -0.09 0.00 0.48 0.00 0.00 55.95 56.13 1pl4 s SER 103 Cb 0.00 0.55 0.21 0.00 0.10 0.00 0.00 66.02 66.88 1pl4 s SER 103 CO 0.00 -0.94 1.87 0.15 0.98 0.00 0.00 173.24 175.30 1pl4 h PHE 104 N 2.00 0.96 -0.25 5.02 3.57 -1.91 -1.94 116.94 124.39 1pl4 h PHE 104 Ca -0.26 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.22 1pl4 h PHE 104 Cb 1.26 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.67 1pl4 h PHE 104 CO 0.31 0.56 -0.05 -0.44 -2.23 0.00 0.00 178.31 176.46 1pl4 h ASP 105 N 1.01 0.37 -0.05 0.41 5.19 -1.96 -0.67 116.42 120.71 1pl4 h ASP 105 Ca 0.31 -0.07 -0.20 0.00 -0.62 0.00 0.00 57.03 56.45 1pl4 h ASP 105 Cb -0.02 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.39 1pl4 h ASP 105 CO -0.10 0.47 -0.69 0.50 -3.12 0.00 0.00 179.24 176.31 1pl4 h LYS 106 N 0.38 0.68 -0.27 3.56 3.64 -1.76 -1.69 116.57 121.10 1pl4 h LYS 106 Ca 0.08 -0.51 0.02 0.00 -1.27 0.00 0.00 60.65 58.97 1pl4 h LYS 106 Cb 0.34 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 1pl4 h LYS 106 CO 0.01 1.13 0.12 0.35 -2.27 0.00 0.00 179.45 178.79 1pl4 h PHE 107 N 0.49 0.22 -0.70 1.91 3.57 -0.88 -0.23 116.94 121.32 1pl4 h PHE 107 Ca -0.03 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 1pl4 h PHE 107 Cb 1.29 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.94 1pl4 h PHE 107 CO 0.07 0.11 0.32 0.87 -2.23 0.00 0.00 178.31 177.46 1pl4 h LYS 108 N 0.26 0.99 -0.75 1.11 1.57 -0.93 -0.03 116.57 118.79 1pl4 h LYS 108 Ca 0.11 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1pl4 h LYS 108 Cb 0.05 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 1pl4 h LYS 108 CO -0.09 0.77 0.45 0.93 -0.57 0.00 0.00 179.45 180.94 1pl4 h GLU 109 N 0.99 1.03 -0.12 3.15 5.08 -0.85 -0.16 114.58 123.69 1pl4 h GLU 109 Ca 0.24 -0.10 -0.14 0.00 -1.00 0.00 0.00 59.36 58.37 1pl4 h GLU 109 Cb 0.11 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 29.16 1pl4 h GLU 109 CO -0.03 0.73 -0.46 0.87 -1.00 0.00 0.00 179.01 179.13 1pl4 h LYS 110 N 1.03 0.52 -0.12 2.33 1.79 -0.34 -0.11 116.57 121.68 1pl4 h LYS 110 Ca 0.27 -0.40 -0.16 0.00 -2.18 0.00 0.00 60.65 58.18 1pl4 h LYS 110 Cb -0.03 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.69 1pl4 h LYS 110 CO -0.05 1.03 -0.59 1.25 -1.08 0.00 0.00 179.45 180.01 1pl4 h LEU 111 N 0.13 0.44 -0.24 2.94 5.85 -0.99 -0.99 115.31 122.44 1pl4 h LEU 111 Ca -0.02 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.47 1pl4 h LEU 111 Cb 1.09 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 1pl4 h LEU 111 CO 0.10 0.93 0.11 0.74 -0.34 0.00 0.00 178.44 179.98 1pl4 h THR 112 N 0.30 0.97 -0.77 1.05 2.02 -0.98 -0.85 112.91 114.64 1pl4 h THR 112 Ca -0.00 -0.08 -0.05 0.00 0.77 0.00 0.00 66.41 67.04 1pl4 h THR 112 Cb 1.11 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 68.21 1pl4 h THR 112 CO 0.10 0.04 0.27 0.00 0.37 0.00 0.00 175.52 176.30 1pl4 h ALA 113 N 1.13 1.01 -0.63 6.16 0.00 -0.80 0.21 119.26 126.36 1pl4 h ALA 113 Ca 0.10 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1pl4 h ALA 113 Cb 0.04 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1pl4 h ALA 113 CO -0.08 0.67 0.17 0.00 0.00 0.00 0.00 179.25 180.01 1pl4 h ALA 114 N 1.15 1.12 -0.14 0.00 0.00 -1.05 -0.16 119.26 120.17 1pl4 h ALA 114 Ca 0.25 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 1pl4 h ALA 114 Cb 0.27 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.82 1pl4 h ALA 114 CO -0.01 0.60 -0.53 0.77 0.00 0.00 0.00 179.25 180.07 1pl4 h SER 115 N 0.93 0.72 0.61 0.00 0.02 -0.52 -3.10 113.55 112.22 1pl4 h SER 115 Ca 0.20 -0.61 -0.07 0.00 -0.84 0.00 0.00 61.79 60.47 1pl4 h SER 115 Cb 0.30 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1pl4 h SER 115 CO -0.00 1.21 -0.34 0.58 -1.14 0.00 0.00 176.83 177.13 1pl4 h VAL 116 N 0.27 0.96 0.00 2.27 2.07 -0.55 -3.08 116.25 118.18 1pl4 h VAL 116 Ca -0.03 -1.30 0.00 0.00 0.82 0.00 0.00 66.70 66.19 1pl4 h VAL 116 Cb 1.16 1.77 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 1pl4 h VAL 116 CO 0.11 0.33 0.00 0.61 0.02 0.00 0.00 177.57 178.64 1pl4 n GLY 117 N -0.13 -1.24 3.68 2.17 0.00 -0.08 -4.75 105.19 104.85 1pl4 n GLY 117 Ca -0.01 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.69 3.65 -0.36 1.61 1.01 -1.17 -4.96 120.40 117.49 1pl4 s VAL 118 Ca 0.22 1.02 -0.14 0.00 0.00 0.00 0.00 61.98 63.08 1pl4 s VAL 118 Cb 0.18 -3.65 -0.00 0.00 0.00 0.00 0.00 36.38 32.90 1pl4 s VAL 118 CO 0.43 -0.01 0.26 -1.10 0.00 0.00 0.00 175.10 174.68 1pl4 s GLN 119 N 2.59 3.31 2.04 2.72 -0.21 -1.26 -4.85 119.66 124.00 1pl4 s GLN 119 Ca 0.65 -0.78 0.00 0.00 0.02 0.00 0.00 55.36 55.25 1pl4 s GLN 119 Cb -0.32 -3.87 0.00 0.00 1.00 0.00 0.00 33.01 29.82 1pl4 s GLN 119 CO 0.27 -0.55 0.00 0.41 -2.12 0.00 0.00 175.29 173.29 1pl4 n GLY 120 N 5.12 0.42 3.89 3.09 0.00 -1.26 -4.96 105.19 111.49 1pl4 n GLY 120 Ca -0.12 -1.30 -0.33 0.00 0.00 0.00 0.00 46.02 44.27 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 6.50 0.00 1.61 0.01 -1.26 -4.83 113.70 111.74 1pl4 s SER 121 Ca 0.00 0.58 0.00 0.00 1.31 0.00 0.00 55.95 57.84 1pl4 s SER 121 Cb 0.00 -2.09 0.00 0.00 0.21 0.00 0.00 66.02 64.14 1pl4 s SER 121 CO 0.00 0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.41 1pl4 n GLY 122 N 0.56 -0.94 2.91 3.44 0.00 -1.26 -0.86 105.19 109.04 1pl4 n GLY 122 Ca -0.06 -1.08 -0.14 0.00 0.00 0.00 0.00 46.02 44.74 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 0.25 -0.08 1.61 0.52 0.10 -1.09 118.94 117.25 1pl4 s TRP 123 Ca 0.00 -0.05 -0.10 0.00 0.02 0.00 0.00 56.10 55.97 1pl4 s TRP 123 Cb 0.00 -0.17 -0.05 0.00 -1.15 0.00 0.00 33.47 32.10 1pl4 s TRP 123 CO 0.00 -0.01 0.25 0.20 0.02 0.00 0.00 176.95 177.41 1pl4 s GLY 124 N -0.03 2.28 -0.02 0.98 0.00 -0.44 -1.06 107.32 109.03 1pl4 s GLY 124 Ca 0.01 -0.47 0.03 0.00 0.00 0.00 0.00 44.72 44.29 1pl4 s GLY 124 CO -0.00 -0.14 -0.12 -0.98 0.00 0.00 0.00 173.10 171.86 1pl4 s TRP 125 N -0.97 1.11 -0.32 1.90 0.52 0.59 -0.56 118.94 121.21 1pl4 s TRP 125 Ca 0.18 -0.24 -0.19 0.00 0.02 0.00 0.00 56.10 55.87 1pl4 s TRP 125 Cb -0.14 -0.74 -0.01 0.00 -1.15 0.00 0.00 33.47 31.44 1pl4 s TRP 125 CO 0.07 -0.05 0.57 -1.17 0.02 0.00 0.00 176.95 176.39 1pl4 s LEU 126 N -0.13 4.19 0.41 2.99 2.96 -0.03 -1.20 118.68 127.88 1pl4 s LEU 126 Ca 0.02 0.28 0.05 0.00 -0.22 0.00 0.00 54.13 54.26 1pl4 s LEU 126 Cb -0.06 -2.71 -0.06 0.00 0.50 0.00 0.00 46.19 43.86 1pl4 s LEU 126 CO -0.00 -0.45 0.03 -0.83 -1.32 0.00 0.00 176.35 173.77 1pl4 s GLY 127 N 1.68 2.53 -0.12 7.98 0.00 0.48 -0.69 107.32 119.19 1pl4 s GLY 127 Ca 0.22 -1.77 0.02 0.00 0.00 0.00 0.00 44.72 43.19 1pl4 s GLY 127 CO 0.12 -2.04 -0.17 -0.12 0.00 0.00 0.00 173.10 170.89 1pl4 s PHE 128 N -2.91 2.71 -0.47 1.90 5.36 0.73 -1.03 117.98 124.27 1pl4 s PHE 128 Ca 0.28 -0.79 -0.21 0.00 -0.96 0.00 0.00 56.93 55.25 1pl4 s PHE 128 Cb 0.07 -1.79 0.03 0.00 -0.34 0.00 0.00 43.02 41.00 1pl4 s PHE 128 CO 0.14 -0.28 0.69 1.21 -1.46 0.00 0.00 175.22 175.52 1pl4 s ASN 129 N 0.32 6.31 0.24 6.13 3.84 0.91 -1.39 114.94 131.30 1pl4 s ASN 129 Ca -0.14 -0.45 0.05 0.00 0.21 0.00 0.00 52.86 52.54 1pl4 s ASN 129 Cb -0.17 -2.33 0.26 0.00 -0.55 0.00 0.00 41.25 38.46 1pl4 s ASN 129 CO 0.07 -0.88 1.56 0.11 -2.79 0.00 0.00 177.10 175.17 1pl4 h LYS 130 N 8.97 0.19 -0.39 0.43 1.57 -1.87 0.61 116.57 126.08 1pl4 h LYS 130 Ca -0.26 -0.14 -0.05 0.00 -1.87 0.00 0.00 60.65 58.33 1pl4 h LYS 130 Cb 1.09 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 1pl4 h LYS 130 CO 0.94 0.75 0.03 0.93 -0.57 0.00 0.00 179.45 181.53 1pl4 h GLU 131 N 0.14 0.66 0.00 3.15 3.07 -1.96 -3.14 114.58 116.51 1pl4 h GLU 131 Ca -0.01 -0.20 0.00 0.00 -0.50 0.00 0.00 59.36 58.65 1pl4 h GLU 131 Cb 1.12 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.96 1pl4 h GLU 131 CO 0.09 0.74 -0.88 0.54 -1.40 0.00 0.00 179.01 178.11 1pl4 n ARG 132 N -4.49 0.29 -3.56 2.33 5.12 -1.15 -4.99 116.66 110.21 1pl4 n ARG 132 Ca -0.01 0.03 -0.21 0.00 -1.93 0.00 0.00 57.85 55.73 1pl4 n ARG 132 Cb 0.26 -1.63 0.07 0.00 -1.16 0.00 0.00 32.46 30.01 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 1.36 -0.43 3.50 -0.13 0.00 0.21 -5.03 105.19 104.66 1pl4 n GLY 133 Ca 0.02 0.17 -0.11 0.00 0.00 0.00 0.00 46.02 46.10 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 -3.38 0.70 0.55 1.61 -3.43 -0.89 -4.99 115.29 105.46 1pl4 s HIS 134 Ca 0.26 -1.00 -0.17 0.00 -0.80 0.00 0.00 55.06 53.35 1pl4 s HIS 134 Cb -0.12 -0.01 -0.06 0.00 -1.43 0.00 0.00 32.58 30.96 1pl4 s HIS 134 CO 0.75 -0.98 1.03 -0.51 -2.00 0.00 0.00 174.74 173.03 1pl4 s LEU 135 N -3.11 3.60 -0.17 5.38 1.43 -1.26 -0.07 118.68 124.49 1pl4 s LEU 135 Ca 0.28 1.74 -0.13 0.00 -1.03 0.00 0.00 54.13 54.99 1pl4 s LEU 135 Cb 0.01 -4.53 0.05 0.00 0.03 0.00 0.00 46.19 41.75 1pl4 s LEU 135 CO 0.13 -0.89 0.43 -1.58 0.23 0.00 0.00 176.35 174.67 1pl4 s GLN 136 N -3.94 0.47 -0.09 1.70 0.74 -0.20 -4.77 119.66 113.57 1pl4 s GLN 136 Ca 0.62 0.69 -0.12 0.00 0.05 0.00 0.00 55.36 56.61 1pl4 s GLN 136 Cb -0.14 0.14 -0.05 0.00 1.10 0.00 0.00 33.01 34.06 1pl4 s GLN 136 CO 0.32 -0.10 0.27 0.42 -0.55 0.00 0.00 175.29 175.65 1pl4 s ILE 137 N 0.72 5.28 -0.01 -2.34 1.01 -1.26 -0.38 121.20 124.22 1pl4 s ILE 137 Ca -0.04 0.52 -0.12 0.00 0.00 0.00 0.00 60.65 61.01 1pl4 s ILE 137 Cb -0.05 -3.57 0.02 0.00 0.01 0.00 0.00 42.46 38.86 1pl4 s ILE 137 CO -0.05 0.54 0.25 0.00 0.00 0.00 0.00 174.94 175.69 1pl4 s ALA 138 N -0.64 -0.64 -0.01 9.38 0.00 -0.34 -4.99 121.76 124.53 1pl4 s ALA 138 Ca 0.18 0.18 0.03 0.00 0.00 0.00 0.00 51.96 52.35 1pl4 s ALA 138 Cb -0.14 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.04 1pl4 s ALA 138 CO 0.07 -0.24 -0.08 0.00 0.00 0.00 0.00 175.76 175.50 1pl4 s ALA 139 N -1.35 2.94 -0.02 0.00 0.00 -1.26 -0.30 121.76 121.76 1pl4 s ALA 139 Ca -0.14 -1.01 0.05 0.00 0.00 0.00 0.00 51.96 50.86 1pl4 s ALA 139 Cb -0.06 -1.10 -0.01 0.00 0.00 0.00 0.00 23.12 21.95 1pl4 s ALA 139 CO 0.03 0.60 -0.19 0.00 0.00 0.00 0.00 175.76 176.21 1pl4 s PRO 141 N -0.34 4.33 7.45 0.00 0.04 -1.26 -0.72 135.00 144.50 1pl4 s PRO 141 Ca 0.05 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.09 1pl4 s PRO 141 Cb -0.08 -2.78 0.00 0.00 0.04 0.00 0.00 34.50 31.68 1pl4 s PRO 141 CO -0.00 0.32 0.00 0.09 0.04 0.00 0.00 177.00 177.45 1pl4 n ASN 142 N 0.51 0.00 -1.12 6.66 5.03 -0.04 -1.00 115.26 125.30 1pl4 n ASN 142 Ca -0.00 0.00 0.08 0.00 0.87 0.00 0.00 54.58 55.53 1pl4 n ASN 142 Cb 0.51 0.00 0.28 0.00 -1.02 0.00 0.00 39.78 39.55 1pl4 n ASN 142 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1pl4 n GLN 143 N 14.00 3.35 -1.65 3.52 1.13 -1.26 -3.99 117.38 132.48 1pl4 n GLN 143 Ca 0.00 -2.73 -0.46 0.00 -1.94 0.00 0.00 57.00 51.88 1pl4 n GLN 143 Cb 0.00 -1.79 -0.04 0.00 0.11 0.00 0.00 30.24 28.52 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 0.21 3.65 -4.83 1.08 9.92 -0.17 -3.89 116.55 122.51 1pl4 n ASP 144 Ca 0.21 0.84 -0.32 0.00 -0.53 0.00 0.00 54.79 54.98 1pl4 n ASP 144 Cb 0.83 -1.44 -0.05 0.00 -0.64 0.00 0.00 41.12 39.82 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 4.58 4.05 0.04 -0.24 0.04 -1.26 -4.62 135.00 137.59 1pl4 s PRO 145 Ca 0.93 1.02 -0.25 0.00 0.04 0.00 0.00 61.00 62.74 1pl4 s PRO 145 Cb -0.57 -2.15 -0.17 0.00 0.04 0.00 0.00 34.50 31.65 1pl4 s PRO 145 CO 0.46 -0.18 1.48 1.25 0.04 0.00 0.00 177.00 180.06 1pl4 h LEU 146 N 1.29 -0.14 -0.20 -3.56 5.85 -1.91 -2.55 115.31 114.09 1pl4 h LEU 146 Ca -0.48 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 57.99 1pl4 h LEU 146 Cb 1.18 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 1pl4 h LEU 146 CO 0.61 0.10 -0.19 -0.61 -0.34 0.00 0.00 178.44 178.01 1pl4 h GLN 147 N -0.38 0.49 0.00 1.25 4.15 -1.88 0.44 115.11 119.17 1pl4 h GLN 147 Ca -0.02 -0.25 -0.05 0.00 0.77 0.00 0.00 58.65 59.10 1pl4 h GLN 147 Cb 0.31 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1pl4 h GLN 147 CO 0.03 0.83 -0.24 0.78 -1.93 0.00 0.00 178.83 178.30 1pl4 h GLY 148 N 0.16 0.00 0.00 2.39 0.00 -1.87 -0.73 103.07 103.02 1pl4 h GLY 148 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 1pl4 h GLY 148 CO 0.05 0.00 -1.68 -1.30 0.00 0.00 0.00 176.54 173.61 1pl4 n THR 149 N -4.24 0.03 0.00 4.70 -2.24 -0.96 -4.77 114.28 106.80 1pl4 n THR 149 Ca -0.02 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1pl4 n THR 149 Cb 0.29 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 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 -2.03 0.00 0.00 4.28 -2.24 0.14 -5.04 114.28 109.39 1pl4 n THR 150 Ca -0.03 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1pl4 n THR 150 Cb 0.40 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 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 1.63 2.75 3.76 3.38 0.00 -0.28 -5.00 105.19 111.43 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 4.35 -0.17 0.99 1.43 -1.26 -4.82 118.68 119.20 1pl4 s LEU 152 Ca 0.00 2.90 -0.21 0.00 -1.03 0.00 0.00 54.13 55.80 1pl4 s LEU 152 Cb 0.00 -3.65 -0.03 0.00 0.03 0.00 0.00 46.19 42.55 1pl4 s LEU 152 CO 0.00 -0.82 0.62 -0.63 0.23 0.00 0.00 176.35 175.75 1pl4 s ILE 153 N -0.51 5.05 0.17 -0.59 -1.09 -0.49 -3.04 121.20 120.70 1pl4 s ILE 153 Ca 0.57 1.18 -0.31 0.00 -2.23 0.00 0.00 60.65 59.87 1pl4 s ILE 153 Cb -0.45 -3.94 -0.09 0.00 -1.58 0.00 0.00 42.46 36.40 1pl4 s ILE 153 CO 0.53 0.15 1.37 -2.16 -1.23 0.00 0.00 174.94 173.60 1pl4 s PRO 154 N 1.62 4.34 -0.13 2.79 0.04 -1.26 -0.19 135.00 142.21 1pl4 s PRO 154 Ca 0.29 2.10 -0.06 0.00 0.04 0.00 0.00 61.00 63.38 1pl4 s PRO 154 Cb -0.16 -3.20 -0.06 0.00 0.04 0.00 0.00 34.50 31.12 1pl4 s PRO 154 CO 0.11 -0.36 -0.16 1.28 0.04 0.00 0.00 177.00 177.91 1pl4 n LEU 155 N 3.14 1.03 -3.71 -3.56 4.77 0.13 -4.90 117.00 113.90 1pl4 n LEU 155 Ca 0.08 0.15 -0.17 0.00 -0.03 0.00 0.00 56.01 56.04 1pl4 n LEU 155 Cb 0.42 -0.38 -0.17 0.00 -2.33 0.00 0.00 43.42 40.96 1pl4 n LEU 155 CO 0.59 0.30 -0.32 -0.22 -1.33 0.00 0.00 177.39 176.40 1pl4 s LEU 156 N -6.65 0.50 -0.06 2.23 2.96 -0.79 -4.51 118.68 112.38 1pl4 s LEU 156 Ca -0.18 0.11 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 1pl4 s LEU 156 Cb 0.07 -0.02 -0.03 0.00 0.50 0.00 0.00 46.19 46.71 1pl4 s LEU 156 CO 0.23 -0.20 -0.11 -0.83 -1.32 0.00 0.00 176.35 174.12 1pl4 s GLY 157 N 1.70 1.60 -0.26 7.98 0.00 -1.26 -0.85 107.32 116.23 1pl4 s GLY 157 Ca -0.02 -0.94 0.02 0.00 0.00 0.00 0.00 44.72 43.79 1pl4 s GLY 157 CO -0.04 -0.71 -0.08 -0.42 0.00 0.00 0.00 173.10 171.85 1pl4 s ILE 158 N -0.74 1.99 -0.19 0.90 -1.09 0.28 -4.90 121.20 117.45 1pl4 s ILE 158 Ca 0.11 -1.58 -0.29 0.00 -2.23 0.00 0.00 60.65 56.66 1pl4 s ILE 158 Cb -0.11 -2.18 -0.02 0.00 -1.58 0.00 0.00 42.46 38.58 1pl4 s ILE 158 CO 0.01 -0.10 1.35 -0.62 -1.23 0.00 0.00 174.94 174.35 1pl4 s ASP 159 N 1.17 6.79 -0.14 3.58 2.15 -1.26 -1.33 116.67 127.63 1pl4 s ASP 159 Ca -0.06 1.63 0.16 0.00 0.43 0.00 0.00 52.55 54.71 1pl4 s ASP 159 Cb -0.20 -2.54 0.38 0.00 -0.30 0.00 0.00 42.92 40.27 1pl4 s ASP 159 CO -0.06 -0.90 1.27 1.33 -0.17 0.00 0.00 175.17 176.64 1pl4 n VAL 160 N 5.68 1.96 -1.70 1.11 0.24 -0.25 -4.84 118.33 120.54 1pl4 n VAL 160 Ca 0.15 -1.93 -0.39 0.00 -2.04 0.00 0.00 64.34 60.13 1pl4 n VAL 160 Cb 0.45 -0.15 0.04 0.00 -1.47 0.00 0.00 33.84 32.70 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 -0.82 1.90 0.01 6.34 7.02 -1.15 -4.54 117.44 126.19 1pl4 n TRP 161 Ca 0.17 0.45 0.03 0.00 -1.02 0.00 0.00 57.50 57.14 1pl4 n TRP 161 Cb 0.72 -2.31 0.41 0.00 -2.42 0.00 0.00 31.31 27.70 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 1.38 0.52 -0.08 -0.99 5.08 -1.94 -0.64 114.58 117.91 1pl4 h GLU 162 Ca -0.49 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 57.85 1pl4 h GLU 162 Cb 1.32 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 1pl4 h GLU 162 CO 0.56 0.38 0.12 1.12 -1.00 0.00 0.00 179.01 180.20 1pl4 h HIS 163 N 0.53 0.00 0.00 4.33 2.07 -1.99 0.15 115.15 120.25 1pl4 h HIS 163 Ca 0.14 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.66 1pl4 h HIS 163 Cb 0.01 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.99 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 -2.25 2.03 -0.09 6.11 0.00 -0.25 -4.47 120.51 121.59 1pl4 n ALA 164 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1pl4 n ALA 164 Cb 0.21 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.24 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 -2.16 0.00 -0.37 0.00 0.18 -0.73 -4.99 117.16 109.09 1pl4 n TYR 165 Ca 0.04 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.82 1pl4 n TYR 165 Cb 0.34 0.00 0.14 0.00 -0.38 0.00 0.00 39.34 39.44 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 1.23 -0.75 -3.48 3.57 -0.92 -0.04 116.94 116.56 1pl4 h PHE 166 Ca 0.00 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.61 1pl4 h PHE 166 Cb 0.00 -0.41 -0.05 0.00 2.79 0.00 0.00 35.95 38.28 1pl4 h PHE 166 CO 0.00 0.72 0.49 -0.07 -2.23 0.00 0.00 178.31 177.22 1pl4 h LEU 167 N 1.28 0.63 0.02 0.59 3.38 -1.87 0.61 115.31 119.94 1pl4 h LEU 167 Ca 0.39 0.01 -0.40 0.00 0.09 0.00 0.00 57.88 57.98 1pl4 h LEU 167 Cb -0.01 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 1pl4 h LEU 167 CO -0.12 0.39 -2.33 1.67 0.09 0.00 0.00 178.44 178.14 1pl4 n GLN 168 N -4.49 0.64 0.00 1.13 7.27 -0.89 -4.65 117.38 116.39 1pl4 n GLN 168 Ca 0.12 0.24 0.07 0.00 0.07 0.00 0.00 57.00 57.50 1pl4 n GLN 168 Cb 0.29 -1.56 0.02 0.00 2.41 0.00 0.00 30.24 31.41 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 -3.73 0.00 -1.78 3.69 4.01 -0.08 -5.07 117.16 114.21 1pl4 n TYR 169 Ca -0.46 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.28 1pl4 n TYR 169 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.97 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 0.15 0.00 0.00 -0.72 4.01 0.20 -1.08 118.16 120.73 1pl4 n LYS 170 Ca 0.07 0.00 0.15 0.00 -0.51 0.00 0.00 58.31 58.02 1pl4 n LYS 170 Cb 0.33 0.00 0.71 0.00 -0.51 0.00 0.00 35.03 35.56 1pl4 n LYS 170 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1pl4 n ASN 171 N 1.95 0.19 -3.86 4.39 3.02 -1.26 -4.32 115.26 115.37 1pl4 n ASN 171 Ca 0.00 -0.37 -0.42 0.00 -0.03 0.00 0.00 54.58 53.76 1pl4 n ASN 171 Cb 0.00 -0.18 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 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 -1.14 3.93 -0.35 2.41 0.31 -0.24 -4.78 118.33 118.48 1pl4 n VAL 172 Ca 0.15 -3.79 0.08 0.00 -0.01 0.00 0.00 64.34 60.77 1pl4 n VAL 172 Cb 0.25 -2.47 0.26 0.00 -0.91 0.00 0.00 33.84 30.97 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 5.99 0.93 -0.23 5.55 2.43 -1.82 -1.11 114.38 126.12 1pl4 h ARG 173 Ca 0.47 -0.06 0.07 0.00 -0.81 0.00 0.00 59.98 59.65 1pl4 h ARG 173 Cb 0.65 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1pl4 h ARG 173 CO 1.72 0.62 0.20 -1.35 -1.51 0.00 0.00 179.97 179.65 1pl4 h PRO 174 N 0.96 0.00 -0.33 0.20 0.11 -1.97 -1.26 132.00 129.71 1pl4 h PRO 174 Ca 0.49 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.45 1pl4 h PRO 174 Cb 0.52 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 1pl4 h PRO 174 CO -0.26 0.00 -0.41 -0.44 -0.21 0.00 0.00 178.00 176.68 1pl4 h ASP 175 N 0.00 0.87 -0.21 -2.05 5.19 -1.59 -0.64 116.42 117.99 1pl4 h ASP 175 Ca 0.11 -0.41 -0.01 0.00 -0.62 0.00 0.00 57.03 56.10 1pl4 h ASP 175 Cb 0.51 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.76 1pl4 h ASP 175 CO -0.00 1.17 0.09 0.22 -3.12 0.00 0.00 179.24 177.60 1pl4 h TYR 176 N 0.66 0.32 -0.75 4.55 3.20 -1.34 -1.67 116.97 121.95 1pl4 h TYR 176 Ca 0.05 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.92 1pl4 h TYR 176 Cb 0.98 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.11 1pl4 h TYR 176 CO 0.06 0.34 0.48 -0.07 -1.64 0.00 0.00 178.16 177.33 1pl4 h LEU 177 N 0.20 0.81 -0.65 2.82 -0.00 -1.10 -0.85 115.31 116.54 1pl4 h LEU 177 Ca 0.07 -0.01 -0.03 0.00 -0.00 0.00 0.00 57.88 57.92 1pl4 h LEU 177 Cb 0.16 -0.19 -0.03 0.00 -0.00 0.00 0.00 40.66 40.60 1pl4 h LEU 177 CO -0.01 0.57 0.30 0.50 -0.00 0.00 0.00 178.44 179.81 1pl4 h LYS 178 N 0.96 0.94 -0.34 1.13 3.64 -0.90 -2.94 116.57 119.06 1pl4 h LYS 178 Ca 0.29 -0.14 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 1pl4 h LYS 178 Cb -0.04 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 1pl4 h LYS 178 CO -0.09 0.76 -0.14 0.00 -2.27 0.00 0.00 179.45 177.71 1pl4 h ALA 179 N 1.14 1.13 0.00 5.00 0.00 -0.67 -3.21 119.26 122.65 1pl4 h ALA 179 Ca 0.22 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1pl4 h ALA 179 Cb 0.13 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1pl4 h ALA 179 CO -0.03 0.54 -0.11 0.97 0.00 0.00 0.00 179.25 180.63 1pl4 h ILE 180 N 0.54 0.32 0.00 0.00 2.10 -0.98 -2.22 117.51 117.27 1pl4 h ILE 180 Ca 0.09 -0.74 -0.00 0.00 1.08 0.00 0.00 64.86 65.29 1pl4 h ILE 180 Cb 0.56 1.56 -0.00 0.00 -1.09 0.00 0.00 36.82 37.85 1pl4 h ILE 180 CO 0.04 0.11 -0.01 -0.50 -1.08 0.00 0.00 178.15 176.71 1pl4 h TRP 181 N 0.00 0.00 0.00 2.19 4.06 -1.63 -1.37 115.95 119.20 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 0.55 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.71 1pl4 h TRP 181 CO 0.00 0.01 0.00 0.09 -3.56 0.00 0.00 178.44 174.98 1pl4 n ASN 182 N -3.40 0.37 -0.16 -3.49 4.13 -0.83 -3.57 115.26 108.31 1pl4 n ASN 182 Ca -0.03 0.56 0.06 0.00 1.68 0.00 0.00 54.58 56.85 1pl4 n ASN 182 Cb 0.09 -0.65 0.08 0.00 -1.54 0.00 0.00 39.78 37.76 1pl4 n ASN 182 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 1pl4 n VAL 183 N -1.88 1.23 -2.33 2.41 0.24 -0.52 -2.93 118.33 114.56 1pl4 n VAL 183 Ca 0.04 -1.46 -0.42 0.00 -2.04 0.00 0.00 64.34 60.47 1pl4 n VAL 183 Cb 0.28 0.09 -0.03 0.00 -1.47 0.00 0.00 33.84 32.72 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 -1.81 3.59 -1.23 1.34 -1.09 -1.20 -0.63 121.20 120.16 1pl4 s ILE 184 Ca 0.19 1.24 -0.15 0.00 -2.23 0.00 0.00 60.65 59.70 1pl4 s ILE 184 Cb 0.16 -3.79 0.14 0.00 -1.58 0.00 0.00 42.46 37.39 1pl4 s ILE 184 CO 0.02 0.15 1.53 0.21 -1.23 0.00 0.00 174.94 175.62 1pl4 s ASN 185 N 0.57 7.00 0.56 3.58 3.84 0.21 -0.63 114.94 130.06 1pl4 s ASN 185 Ca 0.57 -2.83 0.28 0.00 0.21 0.00 0.00 52.86 51.09 1pl4 s ASN 185 Cb -0.33 -2.46 1.64 0.00 -0.55 0.00 0.00 41.25 39.55 1pl4 s ASN 185 CO 0.34 -0.88 2.18 -0.50 -2.79 0.00 0.00 177.10 175.45 1pl4 h TRP 186 N 7.29 0.00 -0.77 0.43 4.06 -1.90 0.16 115.95 125.22 1pl4 h TRP 186 Ca 0.36 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.29 1pl4 h TRP 186 Cb 0.87 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.00 1pl4 h TRP 186 CO 1.20 0.05 0.40 1.49 -3.56 0.00 0.00 178.44 178.02 1pl4 h GLU 187 N 0.00 1.08 0.05 0.49 4.81 -1.96 0.02 114.58 119.06 1pl4 h GLU 187 Ca -0.00 -0.13 -0.27 0.00 -0.13 0.00 0.00 59.36 58.83 1pl4 h GLU 187 Cb 0.12 -0.21 0.02 0.00 0.63 0.00 0.00 28.75 29.31 1pl4 h GLU 187 CO 0.01 0.81 -1.10 -0.97 -0.73 0.00 0.00 179.01 177.02 1pl4 h ASN 188 N 1.08 0.80 -0.55 1.04 -1.24 -1.27 -1.71 115.58 113.72 1pl4 h ASN 188 Ca 0.27 -0.68 0.00 0.00 0.71 0.00 0.00 56.30 56.60 1pl4 h ASN 188 Cb 0.06 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 38.84 1pl4 h ASN 188 CO -0.04 1.49 0.36 0.58 -1.29 0.00 0.00 177.43 178.53 1pl4 h VAL 189 N 0.31 1.15 -0.50 2.57 2.07 -1.15 -1.63 116.25 119.07 1pl4 h VAL 189 Ca -0.14 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.09 1pl4 h VAL 189 Cb 1.76 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1pl4 h VAL 189 CO 0.21 0.15 0.33 0.74 0.02 0.00 0.00 177.57 179.01 1pl4 h THR 190 N 0.75 1.12 -0.81 2.57 2.02 -1.01 -0.11 112.91 117.45 1pl4 h THR 190 Ca 0.20 -0.23 0.10 0.00 0.77 0.00 0.00 66.41 67.25 1pl4 h THR 190 Cb -0.07 0.40 -0.07 0.00 -1.74 0.00 0.00 68.15 66.67 1pl4 h THR 190 CO -0.04 0.12 0.45 -0.33 0.37 0.00 0.00 175.52 176.09 1pl4 h GLU 191 N 0.67 0.73 -0.25 6.66 5.08 -0.81 0.15 114.58 126.81 1pl4 h GLU 191 Ca 0.18 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.38 1pl4 h GLU 191 Cb -0.07 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 1pl4 h GLU 191 CO -0.04 0.48 -0.34 0.00 -1.00 0.00 0.00 179.01 178.11 1pl4 h ARG 192 N 0.75 0.53 -0.04 2.33 3.08 -0.59 -2.59 114.38 117.85 1pl4 h ARG 192 Ca 0.39 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 1pl4 h ARG 192 Cb 0.38 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 1pl4 h ARG 192 CO -0.26 0.80 0.01 -0.92 -1.07 0.00 0.00 179.97 178.53 1pl4 h TYR 193 N 0.45 0.06 0.00 3.04 3.20 -0.34 -3.02 116.97 120.36 1pl4 h TYR 193 Ca 0.05 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1pl4 h TYR 193 Cb 0.81 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.06 1pl4 h TYR 193 CO 0.03 0.26 -0.12 0.52 -1.64 0.00 0.00 178.16 177.22 1pl4 h MET 194 N -0.16 0.00 0.00 1.82 2.86 -0.57 -0.95 114.93 117.92 1pl4 h MET 194 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1pl4 h MET 194 Cb 0.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.89 1pl4 h MET 194 CO 0.00 0.12 0.00 0.00 1.06 0.00 0.00 176.91 178.09 1pl4 n ALA 195 N -2.38 1.59 0.67 6.32 0.00 -0.99 -2.73 120.51 122.99 1pl4 n ALA 195 Ca -0.02 0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.58 1pl4 n ALA 195 Cb 0.21 -1.32 0.11 0.00 0.00 0.00 0.00 19.45 18.45 1pl4 n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50