#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ap5 s HIS 2 N 0.00 3.20 0.05 5.64 3.76 -1.26 -5.11 115.29 121.56 1ap5 s HIS 2 Ca 0.00 0.12 0.08 0.00 -0.15 0.00 0.00 55.06 55.12 1ap5 s HIS 2 Cb 0.00 -1.89 -0.03 0.00 1.11 0.00 0.00 32.58 31.78 1ap5 s HIS 2 CO 0.00 0.35 -0.23 -1.12 -0.85 0.00 0.00 174.74 172.89 1ap5 s SER 3 N -0.45 2.78 -0.24 1.40 0.01 -1.26 -4.94 113.70 111.01 1ap5 s SER 3 Ca 0.09 -0.56 -0.29 0.00 1.31 0.00 0.00 55.95 56.50 1ap5 s SER 3 Cb -0.12 -0.24 -0.02 0.00 0.21 0.00 0.00 66.02 65.85 1ap5 s SER 3 CO 0.02 0.20 1.53 -0.22 0.41 0.00 0.00 173.24 175.18 1ap5 s LEU 4 N -1.24 3.91 0.47 2.44 2.96 -1.26 -4.96 118.68 120.99 1ap5 s LEU 4 Ca 0.09 1.53 -0.23 0.00 -0.22 0.00 0.00 54.13 55.30 1ap5 s LEU 4 Cb -0.09 -3.53 -0.07 0.00 0.50 0.00 0.00 46.19 42.99 1ap5 s LEU 4 CO 0.02 -1.19 1.21 -2.16 -1.32 0.00 0.00 176.35 172.91 1ap5 s PRO 5 N 4.50 3.67 0.26 0.98 0.04 -1.26 -5.01 135.00 138.18 1ap5 s PRO 5 Ca 0.67 1.90 -0.25 0.00 0.04 0.00 0.00 61.00 63.35 1ap5 s PRO 5 Cb -0.23 -2.42 -0.09 0.00 0.04 0.00 0.00 34.50 31.80 1ap5 s PRO 5 CO 0.27 -0.66 0.87 -0.51 0.04 0.00 0.00 177.00 177.01 1ap5 s ASP 6 N -1.22 7.35 0.33 6.66 1.01 -1.26 -5.02 116.67 124.52 1ap5 s ASP 6 Ca 0.64 1.74 -0.29 0.00 0.71 0.00 0.00 52.55 55.35 1ap5 s ASP 6 Cb -0.32 -2.54 -0.11 0.00 1.01 0.00 0.00 42.92 40.97 1ap5 s ASP 6 CO 0.38 0.05 1.41 -0.76 0.21 0.00 0.00 175.17 176.46 1ap5 s LEU 7 N -1.69 4.38 -0.00 1.23 1.43 -1.26 -4.87 118.68 117.89 1ap5 s LEU 7 Ca 0.44 2.83 0.01 0.00 -1.03 0.00 0.00 54.13 56.37 1ap5 s LEU 7 Cb -0.21 -3.65 0.02 0.00 0.03 0.00 0.00 46.19 42.39 1ap5 s LEU 7 CO 0.25 -0.70 0.75 -0.81 0.23 0.00 0.00 176.35 176.07 1ap5 n PRO 8 N 1.00 1.10 -3.87 1.29 -0.04 -1.26 -4.82 135.00 128.39 1ap5 n PRO 8 Ca 0.02 -0.10 -0.08 0.00 -0.04 0.00 0.00 63.50 63.30 1ap5 n PRO 8 Cb 0.40 -1.30 -0.01 0.00 -0.04 0.00 0.00 33.50 32.55 1ap5 n PRO 8 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1ap5 s TYR 9 N -1.46 0.03 0.44 0.54 -0.85 -1.26 -5.09 117.35 109.71 1ap5 s TYR 9 Ca 0.02 -0.54 -0.20 0.00 -0.52 0.00 0.00 57.07 55.82 1ap5 s TYR 9 Cb 0.01 0.66 -0.10 0.00 0.38 0.00 0.00 41.96 42.91 1ap5 s TYR 9 CO 0.01 -1.32 0.96 0.34 -1.52 0.00 0.00 175.55 174.02 1ap5 s ASP 10 N -2.99 6.85 0.43 -0.18 2.15 -1.26 -4.93 116.67 116.73 1ap5 s ASP 10 Ca 0.15 1.70 0.20 0.00 0.43 0.00 0.00 52.55 55.03 1ap5 s ASP 10 Cb -0.05 -2.54 1.08 0.00 -0.30 0.00 0.00 42.92 41.12 1ap5 s ASP 10 CO 0.09 -0.43 1.55 1.88 -0.17 0.00 0.00 175.17 178.10 1ap5 h TYR 11 N 1.78 0.00 -0.06 -5.34 0.05 -1.97 -1.00 116.97 110.43 1ap5 h TYR 11 Ca -0.49 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.29 1ap5 h TYR 11 Cb 1.18 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.92 1ap5 h TYR 11 CO 0.62 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 178.14 1ap5 n GLY 12 N -1.26 3.65 0.21 3.88 0.00 -1.26 -3.94 105.19 106.47 1ap5 n GLY 12 Ca -0.01 -0.48 0.15 0.00 0.00 0.00 0.00 46.02 45.67 1ap5 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ap5 h ALA 13 N 0.39 1.00 -0.03 4.61 0.00 -1.54 -3.06 119.26 120.63 1ap5 h ALA 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ap5 h ALA 13 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1ap5 h ALA 13 CO 0.02 0.00 -0.07 1.28 0.00 0.00 0.00 179.25 180.48 1ap5 n LEU 14 N -2.73 2.81 -4.71 0.00 4.77 -1.26 -4.48 117.00 111.41 1ap5 n LEU 14 Ca 0.02 -0.95 -0.38 0.00 -0.03 0.00 0.00 56.01 54.67 1ap5 n LEU 14 Cb 0.30 -0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.44 1ap5 n LEU 14 CO 0.25 0.47 0.86 1.21 -1.33 0.00 0.00 177.39 178.86 1ap5 n GLU 15 N 1.11 1.42 0.00 3.23 4.07 -1.16 -2.60 120.64 126.71 1ap5 n GLU 15 Ca 0.13 0.53 0.13 0.00 -0.06 0.00 0.00 57.16 57.89 1ap5 n GLU 15 Cb 0.57 -2.46 0.41 0.00 -0.06 0.00 0.00 31.44 29.91 1ap5 n GLU 15 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1ap5 n PRO 16 N -1.10 0.24 0.03 5.31 -0.04 -1.26 -4.88 135.00 133.30 1ap5 n PRO 16 Ca 0.12 -0.11 0.01 0.00 -0.04 0.00 0.00 63.50 63.48 1ap5 n PRO 16 Cb 0.45 -1.50 0.33 0.00 -0.04 0.00 0.00 33.50 32.75 1ap5 n PRO 16 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ap5 h HIS 17 N 0.27 0.46 -3.19 0.54 3.86 -1.84 -3.38 115.15 111.87 1ap5 h HIS 17 Ca 0.00 -0.04 -0.50 0.00 -1.16 0.00 0.00 60.37 58.67 1ap5 h HIS 17 Cb 0.47 -0.13 -0.40 0.00 1.06 0.00 0.00 27.41 28.41 1ap5 h HIS 17 CO 0.00 0.47 -0.76 0.42 0.86 0.00 0.00 177.93 178.92 1ap5 s ILE 18 N -4.94 0.32 0.42 2.45 1.01 -1.18 -4.83 121.20 114.45 1ap5 s ILE 18 Ca -0.07 -0.45 -0.24 0.00 0.00 0.00 0.00 60.65 59.89 1ap5 s ILE 18 Cb 0.16 -0.89 -0.08 0.00 0.01 0.00 0.00 42.46 41.65 1ap5 s ILE 18 CO 0.75 -0.25 1.16 0.54 0.00 0.00 0.00 174.94 177.14 1ap5 s ASN 19 N 1.95 6.41 0.58 3.58 2.20 -1.26 -3.39 114.94 125.01 1ap5 s ASN 19 Ca 0.00 2.32 0.39 0.00 -0.94 0.00 0.00 52.86 54.64 1ap5 s ASN 19 Cb -0.17 -2.61 1.42 0.00 -2.00 0.00 0.00 41.25 37.90 1ap5 s ASN 19 CO -0.09 -0.75 1.55 0.00 -2.94 0.00 0.00 177.10 174.86 1ap5 h ALA 20 N 2.43 3.34 -0.04 3.54 0.00 -1.90 -0.44 119.26 126.19 1ap5 h ALA 20 Ca -0.49 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 1ap5 h ALA 20 Cb 1.24 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1ap5 h ALA 20 CO 0.62 -1.94 -0.04 0.37 0.00 0.00 0.00 179.25 178.26 1ap5 h GLN 21 N 0.00 0.09 -0.59 0.00 4.15 -1.91 -2.44 115.11 114.41 1ap5 h GLN 21 Ca 0.68 -0.05 0.05 0.00 0.77 0.00 0.00 58.65 60.10 1ap5 h GLN 21 Cb 3.07 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 30.71 1ap5 h GLN 21 CO -0.01 0.55 0.31 0.82 -1.93 0.00 0.00 178.83 178.58 1ap5 h ILE 22 N -0.36 0.96 -0.53 2.39 2.04 -1.45 -0.66 117.51 119.90 1ap5 h ILE 22 Ca 0.01 -0.20 -0.09 0.00 1.00 0.00 0.00 64.86 65.58 1ap5 h ILE 22 Cb 0.53 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1ap5 h ILE 22 CO 0.01 0.11 -0.00 0.24 0.00 0.00 0.00 178.15 178.51 1ap5 h MET 23 N 0.59 0.94 0.02 2.37 2.86 -1.58 0.18 114.93 120.31 1ap5 h MET 23 Ca 0.26 -0.30 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1ap5 h MET 23 Cb 0.16 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.74 1ap5 h MET 23 CO -0.17 0.96 -0.01 0.37 1.06 0.00 0.00 176.91 179.11 1ap5 h GLN 24 N 0.82 -0.02 -0.66 1.72 4.15 -0.98 -0.95 115.11 119.18 1ap5 h GLN 24 Ca 0.15 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.49 1ap5 h GLN 24 Cb 0.53 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.20 1ap5 h GLN 24 CO 0.03 0.05 0.08 -0.07 -1.93 0.00 0.00 178.83 176.99 1ap5 h LEU 25 N -0.09 1.06 0.80 -2.39 4.07 -1.03 0.95 115.31 118.68 1ap5 h LEU 25 Ca -0.00 -0.27 -0.04 0.00 0.08 0.00 0.00 57.88 57.65 1ap5 h LEU 25 Cb 0.08 -0.28 0.01 0.00 1.08 0.00 0.00 40.66 41.55 1ap5 h LEU 25 CO 0.00 1.06 -0.38 -0.74 -1.08 0.00 0.00 178.44 177.30 1ap5 h HIS 26 N 1.02 -1.00 0.56 1.13 2.76 -0.53 -2.01 115.15 117.09 1ap5 h HIS 26 Ca 0.20 -0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 1ap5 h HIS 26 Cb 0.47 0.33 0.01 0.00 1.55 0.00 0.00 27.41 29.77 1ap5 h HIS 26 CO 0.03 -0.61 -0.27 1.25 -1.30 0.00 0.00 177.93 177.03 1ap5 h HIS 27 N -1.25 -0.70 0.04 5.26 -0.00 -1.20 -1.46 115.15 115.83 1ap5 h HIS 27 Ca -0.11 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.24 1ap5 h HIS 27 Cb 0.83 0.23 0.00 0.00 -0.00 0.00 0.00 27.41 28.48 1ap5 h HIS 27 CO -0.00 -0.38 -0.02 0.77 -0.00 0.00 0.00 177.93 178.30 1ap5 h SER 28 N -0.94 -0.04 0.00 3.26 0.02 -0.94 -3.11 113.55 111.80 1ap5 h SER 28 Ca -0.08 -0.32 -0.11 0.00 -0.84 0.00 0.00 61.79 60.44 1ap5 h SER 28 Cb 0.64 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 1ap5 h SER 28 CO 0.13 0.30 -0.64 0.11 -1.14 0.00 0.00 176.83 175.59 1ap5 h LYS 29 N -0.39 0.00 0.27 3.45 1.79 -1.50 -3.35 116.57 116.84 1ap5 h LYS 29 Ca -0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 1ap5 h LYS 29 Cb 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1ap5 h LYS 29 CO 0.01 0.84 -0.13 0.45 -1.08 0.00 0.00 179.45 179.53 1ap5 h HIS 30 N -1.00 -0.34 -1.00 -1.35 3.86 -1.27 -2.68 115.15 111.38 1ap5 h HIS 30 Ca -0.17 -0.01 0.10 0.00 -1.16 0.00 0.00 60.37 59.14 1ap5 h HIS 30 Cb 1.03 0.11 -0.08 0.00 1.06 0.00 0.00 27.41 29.53 1ap5 h HIS 30 CO 0.13 -0.21 0.63 1.25 0.86 0.00 0.00 177.93 180.59 1ap5 h HIS 31 N -0.95 1.15 -0.47 2.45 -0.00 -1.34 -1.56 115.15 114.44 1ap5 h HIS 31 Ca -0.04 0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.32 1ap5 h HIS 31 Cb 0.28 -0.37 -0.02 0.00 -0.00 0.00 0.00 27.41 27.30 1ap5 h HIS 31 CO 0.01 0.50 0.10 0.00 -0.00 0.00 0.00 177.93 178.55 1ap5 h ALA 32 N 1.51 0.61 -0.54 5.26 0.00 -1.67 -2.47 119.26 121.96 1ap5 h ALA 32 Ca 0.47 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 55.25 1ap5 h ALA 32 Cb 0.38 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1ap5 h ALA 32 CO -0.24 0.31 0.36 0.00 0.00 0.00 0.00 179.25 179.69 1ap5 h ALA 33 N 0.97 1.93 -0.31 0.00 0.00 -0.93 -2.03 119.26 118.90 1ap5 h ALA 33 Ca 0.14 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1ap5 h ALA 33 Cb 0.34 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ap5 h ALA 33 CO 0.00 -0.03 -0.14 0.74 0.00 0.00 0.00 179.25 179.82 1ap5 h PHE 34 N 0.44 0.73 0.25 0.00 0.04 -1.10 -2.37 116.94 114.94 1ap5 h PHE 34 Ca 0.24 -0.18 -0.01 0.00 2.80 0.00 0.00 57.97 60.82 1ap5 h PHE 34 Cb 0.37 -0.17 -0.00 0.00 2.20 0.00 0.00 35.95 38.35 1ap5 h PHE 34 CO -0.00 0.86 -0.14 0.28 -0.60 0.00 0.00 178.31 178.71 1ap5 h VAL 35 N 0.40 0.71 -0.91 -0.55 2.07 -1.11 0.10 116.25 116.96 1ap5 h VAL 35 Ca 0.07 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.65 1ap5 h VAL 35 Cb 0.66 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 1ap5 h VAL 35 CO 0.04 0.00 0.58 0.78 0.02 0.00 0.00 177.57 178.99 1ap5 h ASN 36 N -0.36 0.92 1.36 0.57 2.35 -1.43 -0.75 115.58 118.24 1ap5 h ASN 36 Ca -0.03 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1ap5 h ASN 36 Cb 0.29 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1ap5 h ASN 36 CO 0.04 0.60 -0.35 0.78 -1.65 0.00 0.00 177.43 176.85 1ap5 h ASN 37 N 1.07 0.00 0.13 5.81 -0.26 -1.35 -3.10 115.58 117.87 1ap5 h ASN 37 Ca 0.39 -0.06 -0.29 0.00 -0.56 0.00 0.00 56.30 55.78 1ap5 h ASN 37 Cb 0.13 0.00 0.03 0.00 -1.06 0.00 0.00 38.32 37.42 1ap5 h ASN 37 CO -0.16 0.03 -1.20 0.25 -1.06 0.00 0.00 177.43 175.28 1ap5 h LEU 38 N 0.00 0.84 -0.49 1.61 6.46 -0.12 -2.74 115.31 120.86 1ap5 h LEU 38 Ca 0.00 -0.84 -0.00 0.00 -0.12 0.00 0.00 57.88 56.92 1ap5 h LEU 38 Cb 0.86 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.50 1ap5 h LEU 38 CO 0.00 1.59 0.29 0.78 -0.62 0.00 0.00 178.44 180.48 1ap5 h ASN 39 N 0.21 0.60 -0.23 1.25 2.35 -1.21 -0.95 115.58 117.60 1ap5 h ASN 39 Ca -0.19 -0.06 -0.08 0.00 -0.55 0.00 0.00 56.30 55.42 1ap5 h ASN 39 Cb 1.89 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 40.09 1ap5 h ASN 39 CO 0.23 0.49 -0.10 0.58 -1.65 0.00 0.00 177.43 176.97 1ap5 h VAL 40 N 0.66 1.24 0.07 2.81 2.07 -1.62 -2.67 116.25 118.81 1ap5 h VAL 40 Ca 0.18 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.63 1ap5 h VAL 40 Cb 0.00 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1ap5 h VAL 40 CO -0.03 0.36 -0.03 0.74 0.02 0.00 0.00 177.57 178.62 1ap5 h THR 41 N 0.57 1.19 -0.32 2.57 2.02 -1.12 -1.73 112.91 116.09 1ap5 h THR 41 Ca 0.10 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.34 1ap5 h THR 41 Cb 0.52 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 68.71 1ap5 h THR 41 CO 0.03 0.23 0.18 -0.33 0.37 0.00 0.00 175.52 176.01 1ap5 h GLU 42 N -0.52 0.43 -0.36 6.66 5.08 -1.19 0.86 114.58 125.54 1ap5 h GLU 42 Ca -0.01 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.20 1ap5 h GLU 42 Cb 0.45 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1ap5 h GLU 42 CO 0.01 0.31 -0.23 1.49 -1.00 0.00 0.00 179.01 179.59 1ap5 h GLU 43 N 0.44 0.79 0.00 2.33 4.81 -1.44 -1.91 114.58 119.61 1ap5 h GLU 43 Ca 0.12 -0.37 -0.07 0.00 -0.13 0.00 0.00 59.36 58.91 1ap5 h GLU 43 Cb -0.00 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1ap5 h GLU 43 CO -0.02 1.00 -0.31 -0.22 -0.73 0.00 0.00 179.01 178.72 1ap5 h LYS 44 N 0.58 0.00 -0.07 1.92 3.64 -0.51 -3.03 116.57 119.10 1ap5 h LYS 44 Ca 0.07 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 1ap5 h LYS 44 Cb 0.79 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1ap5 h LYS 44 CO 0.06 0.31 -0.21 -0.92 -2.27 0.00 0.00 179.45 176.43 1ap5 h TYR 45 N 0.00 0.35 -0.67 1.91 5.03 -0.57 -2.89 116.97 120.14 1ap5 h TYR 45 Ca -0.00 -0.14 0.08 0.00 2.58 0.00 0.00 58.73 61.25 1ap5 h TYR 45 Cb 0.59 -0.06 -0.04 0.00 1.55 0.00 0.00 36.73 38.77 1ap5 h TYR 45 CO 0.00 0.83 0.44 1.96 -1.32 0.00 0.00 178.16 180.07 1ap5 h GLN 46 N -0.22 0.57 -0.47 1.82 4.20 -1.28 -0.90 115.11 118.83 1ap5 h GLN 46 Ca -0.01 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 1ap5 h GLN 46 Cb 0.83 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 1ap5 h GLN 46 CO 0.05 0.38 0.16 1.49 -0.67 0.00 0.00 178.83 180.23 1ap5 h GLU 47 N 0.59 0.72 0.11 1.46 4.81 -1.49 -0.56 114.58 120.22 1ap5 h GLU 47 Ca 0.30 -0.15 -0.29 0.00 -0.13 0.00 0.00 59.36 59.09 1ap5 h GLU 47 Cb 0.40 -0.11 0.03 0.00 0.63 0.00 0.00 28.75 29.70 1ap5 h GLU 47 CO -0.10 0.68 -1.22 0.00 -0.73 0.00 0.00 179.01 177.64 1ap5 h ALA 48 N 1.01 0.04 -0.47 2.92 0.00 -1.19 -2.77 119.26 118.79 1ap5 h ALA 48 Ca 0.15 -0.78 -0.03 0.00 0.00 0.00 0.00 54.91 54.26 1ap5 h ALA 48 Cb 0.25 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1ap5 h ALA 48 CO -0.01 0.72 0.19 1.25 0.00 0.00 0.00 179.25 181.41 1ap5 h LEU 49 N 0.26 0.65 -0.41 0.00 5.85 -1.20 0.11 115.31 120.57 1ap5 h LEU 49 Ca -0.17 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.41 1ap5 h LEU 49 Cb 1.89 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 42.71 1ap5 h LEU 49 CO 0.23 0.64 0.20 0.00 -0.34 0.00 0.00 178.44 179.17 1ap5 h ALA 50 N 1.04 0.51 -1.00 1.25 0.00 -1.13 -2.39 119.26 117.54 1ap5 h ALA 50 Ca 0.16 0.02 -0.73 0.00 0.00 0.00 0.00 54.91 54.35 1ap5 h ALA 50 Cb 0.19 -0.06 -0.28 0.00 0.00 0.00 0.00 17.79 17.65 1ap5 h ALA 50 CO -0.01 -0.16 0.98 0.36 0.00 0.00 0.00 179.25 180.42 1ap5 n LYS 51 N -4.92 2.73 -1.82 0.00 2.85 -1.05 -4.92 118.16 111.03 1ap5 n LYS 51 Ca 0.02 -3.43 0.00 0.00 -1.05 0.00 0.00 58.31 53.85 1ap5 n LYS 51 Cb 0.10 -2.28 0.00 0.00 -0.65 0.00 0.00 35.03 32.21 1ap5 n LYS 51 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ap5 n GLY 52 N -0.70 -0.32 3.54 2.58 0.00 -0.90 -4.88 105.19 104.51 1ap5 n GLY 52 Ca 0.58 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.17 1ap5 n GLY 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ap5 s ASP 53 N -1.43 6.34 0.10 1.61 -1.08 0.35 -4.89 116.67 117.68 1ap5 s ASP 53 Ca 0.00 -0.27 0.09 0.00 -0.52 0.00 0.00 52.55 51.85 1ap5 s ASP 53 Cb 0.00 -2.49 -0.19 0.00 -1.46 0.00 0.00 42.92 38.78 1ap5 s ASP 53 CO 0.00 -1.42 1.17 0.58 0.52 0.00 0.00 175.17 176.02 1ap5 h VAL 54 N 6.06 1.44 -0.68 1.11 2.07 -1.90 -2.98 116.25 121.38 1ap5 h VAL 54 Ca -0.26 -3.13 -0.07 0.00 0.82 0.00 0.00 66.70 64.06 1ap5 h VAL 54 Cb 1.06 2.70 -0.03 0.00 -1.52 0.00 0.00 31.29 33.51 1ap5 h VAL 54 CO 1.16 0.82 0.17 0.74 0.02 0.00 0.00 177.57 180.47 1ap5 h THR 55 N 0.00 1.26 -0.16 2.57 2.02 -1.98 -1.96 112.91 114.66 1ap5 h THR 55 Ca -0.07 -0.95 -0.15 0.00 0.77 0.00 0.00 66.41 66.01 1ap5 h THR 55 Cb 1.77 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 1ap5 h THR 55 CO 0.11 0.36 -0.54 0.00 0.37 0.00 0.00 175.52 175.83 1ap5 h ALA 56 N 1.07 0.78 -0.58 6.16 0.00 -1.96 -0.92 119.26 123.81 1ap5 h ALA 56 Ca 0.21 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 1ap5 h ALA 56 Cb 0.37 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1ap5 h ALA 56 CO 0.00 0.69 0.26 1.96 0.00 0.00 0.00 179.25 182.16 1ap5 h GLN 57 N 0.35 0.84 -0.20 0.00 4.20 -1.35 -1.29 115.11 117.67 1ap5 h GLN 57 Ca 0.01 -0.13 -0.07 0.00 0.06 0.00 0.00 58.65 58.51 1ap5 h GLN 57 Cb 1.06 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.69 1ap5 h GLN 57 CO 0.10 0.70 -0.16 0.82 -0.67 0.00 0.00 178.83 179.62 1ap5 h ILE 58 N 0.79 1.32 0.00 2.54 2.04 -1.25 -3.03 117.51 119.92 1ap5 h ILE 58 Ca 0.20 -1.28 -0.03 0.00 1.00 0.00 0.00 64.86 64.74 1ap5 h ILE 58 Cb 0.14 1.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.93 1ap5 h ILE 58 CO -0.02 0.39 -0.15 0.00 0.00 0.00 0.00 178.15 178.37 1ap5 h ALA 59 N 0.67 1.69 0.00 1.87 0.00 -1.06 -2.34 119.26 120.09 1ap5 h ALA 59 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ap5 h ALA 59 Cb 0.68 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1ap5 h ALA 59 CO 0.04 0.19 0.00 -0.07 0.00 0.00 0.00 179.25 179.41 1ap5 h LEU 60 N 0.00 0.00 -0.32 0.00 4.07 -1.18 -3.39 115.31 114.49 1ap5 h LEU 60 Ca -0.00 0.00 0.07 0.00 0.08 0.00 0.00 57.88 58.02 1ap5 h LEU 60 Cb 0.27 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.95 1ap5 h LEU 60 CO 0.02 0.00 -0.09 1.56 -1.08 0.00 0.00 178.44 178.85 1ap5 h GLN 61 N 0.00 -0.02 -0.86 1.13 4.20 -1.30 -2.73 115.11 115.54 1ap5 h GLN 61 Ca 0.00 0.00 0.15 0.00 0.06 0.00 0.00 58.65 58.86 1ap5 h GLN 61 Cb 0.75 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.44 1ap5 h GLN 61 CO 0.00 -0.01 0.44 -1.35 -0.67 0.00 0.00 178.83 177.24 1ap5 h PRO 62 N -0.02 0.60 -0.35 1.46 0.11 -1.79 -1.52 132.00 130.49 1ap5 h PRO 62 Ca 0.16 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.10 1ap5 h PRO 62 Cb 0.26 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 1ap5 h PRO 62 CO -0.34 0.40 -0.29 0.00 -0.21 0.00 0.00 178.00 177.56 1ap5 h ALA 63 N 1.57 0.50 -0.34 -0.75 0.00 -1.81 -1.81 119.26 116.63 1ap5 h ALA 63 Ca 0.47 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1ap5 h ALA 63 Cb 0.69 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1ap5 h ALA 63 CO -0.37 0.53 0.11 1.25 0.00 0.00 0.00 179.25 180.76 1ap5 h LEU 64 N 0.59 0.48 -0.75 0.00 5.85 -1.08 0.69 115.31 121.10 1ap5 h LEU 64 Ca 0.06 -0.20 -0.11 0.00 0.84 0.00 0.00 57.88 58.48 1ap5 h LEU 64 Cb 0.86 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1ap5 h LEU 64 CO 0.07 0.55 -0.19 0.50 -0.34 0.00 0.00 178.44 179.04 1ap5 h LYS 65 N 0.39 0.75 0.28 1.25 3.64 -1.34 0.50 116.57 122.03 1ap5 h LYS 65 Ca 0.11 -0.28 -0.01 0.00 -1.27 0.00 0.00 60.65 59.19 1ap5 h LYS 65 Cb 0.24 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1ap5 h LYS 65 CO -0.00 0.88 -0.13 0.35 -2.27 0.00 0.00 179.45 178.27 1ap5 h PHE 66 N 0.66 -0.34 -0.05 1.91 3.57 -1.11 -0.33 116.94 121.25 1ap5 h PHE 66 Ca 0.10 -0.01 -0.25 0.00 3.53 0.00 0.00 57.97 61.34 1ap5 h PHE 66 Cb 0.68 0.11 0.01 0.00 2.79 0.00 0.00 35.95 39.55 1ap5 h PHE 66 CO 0.03 0.01 -0.95 -0.91 -2.23 0.00 0.00 178.31 174.27 1ap5 h ASN 67 N -0.81 0.86 -0.13 0.41 4.21 -0.92 -0.79 115.58 118.41 1ap5 h ASN 67 Ca -0.04 -0.64 0.02 0.00 1.21 0.00 0.00 56.30 56.84 1ap5 h ASN 67 Cb 0.51 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.44 1ap5 h ASN 67 CO 0.06 1.44 0.01 1.23 -1.29 0.00 0.00 177.43 178.89 1ap5 h GLY 68 N 0.60 0.13 2.00 2.83 0.00 -0.09 -1.68 103.07 106.86 1ap5 h GLY 68 Ca -0.10 -0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.15 1ap5 h GLY 68 CO 0.18 -0.01 -0.40 -1.33 0.00 0.00 0.00 176.54 174.99 1ap5 h GLY 69 N 0.06 0.00 1.19 4.60 0.00 -1.09 -2.26 103.07 105.57 1ap5 h GLY 69 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 1ap5 h GLY 69 CO -0.08 0.00 0.02 -1.33 0.00 0.00 0.00 176.54 175.15 1ap5 h GLY 70 N 1.68 1.06 0.90 4.60 0.00 -0.45 0.18 103.07 111.03 1ap5 h GLY 70 Ca -0.00 -0.74 -0.13 0.00 0.00 0.00 0.00 47.33 46.46 1ap5 h GLY 70 CO 0.05 0.68 -0.40 0.84 0.00 0.00 0.00 176.54 177.71 1ap5 h HIS 71 N 0.91 0.72 -0.07 5.60 6.17 -1.16 -2.66 115.15 124.66 1ap5 h HIS 71 Ca 0.17 -0.27 -0.00 0.00 0.71 0.00 0.00 60.37 60.97 1ap5 h HIS 71 Cb 0.50 -0.13 -0.00 0.00 2.52 0.00 0.00 27.41 30.30 1ap5 h HIS 71 CO 0.03 1.03 0.02 0.82 0.71 0.00 0.00 177.93 180.54 1ap5 h ILE 72 N 0.22 1.15 -0.52 6.26 2.04 -1.24 -2.58 117.51 122.84 1ap5 h ILE 72 Ca -0.00 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.42 1ap5 h ILE 72 Cb 1.01 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 38.39 1ap5 h ILE 72 CO 0.09 0.13 0.34 0.78 0.00 0.00 0.00 178.15 179.49 1ap5 h ASN 73 N -0.06 0.59 -0.02 1.72 2.35 -0.68 -2.89 115.58 116.59 1ap5 h ASN 73 Ca 0.02 -0.01 -0.20 0.00 -0.55 0.00 0.00 56.30 55.56 1ap5 h ASN 73 Cb 0.18 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.40 1ap5 h ASN 73 CO -0.00 0.43 -0.71 0.45 -1.65 0.00 0.00 177.43 175.95 1ap5 h HIS 74 N 0.70 0.87 -0.69 1.19 3.86 -1.51 -2.62 115.15 116.95 1ap5 h HIS 74 Ca 0.19 -0.37 0.01 0.00 -1.16 0.00 0.00 60.37 59.05 1ap5 h HIS 74 Cb -0.08 -0.14 -0.04 0.00 1.06 0.00 0.00 27.41 28.21 1ap5 h HIS 74 CO -0.04 1.16 0.46 0.77 0.86 0.00 0.00 177.93 181.14 1ap5 h SER 75 N 0.46 0.77 0.46 2.45 0.02 -1.41 -1.63 113.55 114.67 1ap5 h SER 75 Ca -0.03 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 1ap5 h SER 75 Cb 1.31 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.67 1ap5 h SER 75 CO 0.14 0.55 -0.22 0.40 -1.14 0.00 0.00 176.83 176.56 1ap5 h ILE 76 N 0.91 0.43 -0.91 3.27 1.08 -1.48 -3.24 117.51 117.57 1ap5 h ILE 76 Ca 0.26 -0.47 0.19 0.00 -0.39 0.00 0.00 64.86 64.45 1ap5 h ILE 76 Cb -0.06 0.60 -0.17 0.00 -3.07 0.00 0.00 36.82 34.12 1ap5 h ILE 76 CO -0.06 0.07 -0.19 0.15 -0.69 0.00 0.00 178.15 177.43 1ap5 h PHE 77 N -0.94 -0.41 -1.00 1.37 3.57 -1.03 0.20 116.94 118.71 1ap5 h PHE 77 Ca -0.06 0.08 0.05 0.00 3.53 0.00 0.00 57.97 61.57 1ap5 h PHE 77 Cb 0.58 0.33 -0.06 0.00 2.79 0.00 0.00 35.95 39.58 1ap5 h PHE 77 CO 0.01 -0.39 0.65 -1.49 -2.23 0.00 0.00 178.31 174.87 1ap5 h TRP 78 N 0.01 1.21 0.00 0.41 -0.00 -1.37 -1.63 115.95 114.58 1ap5 h TRP 78 Ca 0.45 0.03 0.00 0.00 -0.00 0.00 0.00 58.89 59.37 1ap5 h TRP 78 Cb 0.73 -0.40 0.00 0.00 -0.00 0.00 0.00 29.16 29.48 1ap5 h TRP 78 CO -0.67 0.67 0.00 1.79 -0.00 0.00 0.00 178.44 180.23 1ap5 h THR 79 N 1.22 0.00 0.00 1.49 1.35 -0.65 -3.04 112.91 113.28 1ap5 h THR 79 Ca 0.41 -0.53 -0.01 0.00 -0.55 0.00 0.00 66.41 65.73 1ap5 h THR 79 Cb 0.07 1.48 -0.00 0.00 -1.73 0.00 0.00 68.15 67.97 1ap5 h THR 79 CO -0.14 0.00 -0.66 0.78 -0.25 0.00 0.00 175.52 175.24 1ap5 h ASN 80 N 0.00 0.00 -3.08 5.36 2.35 -0.55 -3.44 115.58 116.22 1ap5 h ASN 80 Ca 0.00 0.00 -0.58 0.00 -0.55 0.00 0.00 56.30 55.17 1ap5 h ASN 80 Cb 0.69 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.03 1ap5 h ASN 80 CO 0.00 0.02 -0.33 -0.76 -1.65 0.00 0.00 177.43 174.71 1ap5 s LEU 81 N -5.68 4.26 -0.22 1.61 1.43 -0.87 0.56 118.68 119.78 1ap5 s LEU 81 Ca 0.02 0.52 -0.28 0.00 -1.03 0.00 0.00 54.13 53.36 1ap5 s LEU 81 Cb 0.08 -3.25 0.13 0.00 0.03 0.00 0.00 46.19 43.18 1ap5 s LEU 81 CO 0.75 0.04 1.03 -0.55 0.23 0.00 0.00 176.35 177.86 1ap5 s SER 82 N -2.59 -0.38 0.22 2.29 0.15 0.21 -4.63 113.70 108.97 1ap5 s SER 82 Ca 0.40 0.57 -0.07 0.00 0.70 0.00 0.00 55.95 57.55 1ap5 s SER 82 Cb -0.12 0.52 0.33 0.00 -1.71 0.00 0.00 66.02 65.04 1ap5 s SER 82 CO 0.26 -0.25 1.78 -0.65 1.20 0.00 0.00 173.24 175.58 1ap5 h PRO 83 N 3.24 0.58 -3.03 5.44 0.11 -1.81 -3.29 132.00 133.24 1ap5 h PRO 83 Ca -0.22 -0.04 -0.68 0.00 0.11 0.00 0.00 66.00 65.17 1ap5 h PRO 83 Cb 1.17 -0.13 -0.37 0.00 0.11 0.00 0.00 31.00 31.77 1ap5 h PRO 83 CO 0.22 0.39 -0.21 0.27 -0.21 0.00 0.00 178.00 178.46 1ap5 n ASN 84 N -4.86 4.06 0.00 -2.05 6.94 -1.26 -4.95 115.26 113.14 1ap5 n ASN 84 Ca 0.11 -3.23 0.00 0.00 -0.02 0.00 0.00 54.58 51.44 1ap5 n ASN 84 Cb 0.27 -0.94 0.00 0.00 -2.36 0.00 0.00 39.78 36.75 1ap5 n ASN 84 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ap5 n GLY 85 N 1.88 5.33 0.00 4.83 0.00 -1.24 -4.89 105.19 111.11 1ap5 n GLY 85 Ca 0.23 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1ap5 n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ap5 n GLY 86 N 0.15 -0.62 5.87 -0.02 0.00 0.72 -4.74 105.19 106.55 1ap5 n GLY 86 Ca 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1ap5 n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ap5 n GLY 87 N -0.67 1.62 3.20 -0.02 0.00 -1.26 -4.85 105.19 103.21 1ap5 n GLY 87 Ca 0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 46.02 45.52 1ap5 n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ap5 s GLU 88 N 0.00 0.87 0.00 1.61 0.41 -1.26 -5.09 118.70 115.24 1ap5 s GLU 88 Ca 0.00 -1.14 0.00 0.00 -0.41 0.00 0.00 54.97 53.42 1ap5 s GLU 88 Cb 0.00 0.30 0.00 0.00 -1.78 0.00 0.00 34.13 32.65 1ap5 s GLU 88 CO 0.00 -0.26 0.00 -2.30 -0.49 0.00 0.00 175.26 172.21 1ap5 n PRO 89 N -0.06 0.42 -4.68 0.39 -0.02 -1.26 -4.98 135.00 124.81 1ap5 n PRO 89 Ca -0.12 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.05 1ap5 n PRO 89 Cb 0.62 0.00 -0.13 0.00 -0.02 0.00 0.00 33.50 33.98 1ap5 n PRO 89 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1ap5 s LYS 90 N -2.21 2.12 -0.12 -0.52 -0.14 -1.26 -4.85 119.74 112.76 1ap5 s LYS 90 Ca 0.00 -0.95 -0.39 0.00 -1.36 0.00 0.00 55.97 53.27 1ap5 s LYS 90 Cb 0.00 -2.21 -0.19 0.00 -1.68 0.00 0.00 37.83 33.75 1ap5 s LYS 90 CO 0.00 0.55 1.13 0.41 -0.76 0.00 0.00 175.35 176.67 1ap5 n GLY 91 N 1.62 -0.15 0.00 -3.33 0.00 -1.26 -3.27 105.19 98.80 1ap5 n GLY 91 Ca -0.16 0.77 0.00 0.00 0.00 0.00 0.00 46.02 46.63 1ap5 n GLY 91 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ap5 n GLU 92 N 2.00 0.00 0.01 1.61 4.07 -1.26 -4.76 120.64 122.31 1ap5 n GLU 92 Ca 0.21 0.00 -0.20 0.00 -0.06 0.00 0.00 57.16 57.11 1ap5 n GLU 92 Cb 0.04 0.00 -0.14 0.00 -0.06 0.00 0.00 31.44 31.28 1ap5 n GLU 92 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1ap5 h LEU 93 N 0.00 0.36 -0.71 4.31 5.85 -1.96 -2.95 115.31 120.22 1ap5 h LEU 93 Ca 0.00 -0.89 -0.06 0.00 0.84 0.00 0.00 57.88 57.76 1ap5 h LEU 93 Cb 0.00 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1ap5 h LEU 93 CO 0.00 1.45 0.19 0.25 -0.34 0.00 0.00 178.44 180.00 1ap5 h LEU 94 N -0.44 1.06 -1.88 2.25 6.46 -1.85 0.50 115.31 121.41 1ap5 h LEU 94 Ca -0.21 -0.22 0.11 0.00 -0.12 0.00 0.00 57.88 57.44 1ap5 h LEU 94 Cb 1.61 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 41.24 1ap5 h LEU 94 CO 0.08 1.00 0.32 -0.08 -0.62 0.00 0.00 178.44 179.15 1ap5 h GLU 95 N 1.06 0.13 0.06 1.25 4.22 -1.83 0.65 114.58 120.12 1ap5 h GLU 95 Ca 0.22 -0.01 -0.15 0.00 0.08 0.00 0.00 59.36 59.51 1ap5 h GLU 95 Cb 0.35 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1ap5 h GLU 95 CO -0.00 0.08 -0.73 0.00 -2.18 0.00 0.00 179.01 176.18 1ap5 h ALA 96 N 1.77 0.05 -0.58 2.92 0.00 -1.00 -2.85 119.26 119.57 1ap5 h ALA 96 Ca 0.22 -0.79 0.11 0.00 0.00 0.00 0.00 54.91 54.45 1ap5 h ALA 96 Cb 0.69 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1ap5 h ALA 96 CO -0.03 0.39 0.40 0.82 0.00 0.00 0.00 179.25 180.83 1ap5 h ILE 97 N -0.68 0.86 0.25 0.00 2.04 -0.49 -0.97 117.51 118.52 1ap5 h ILE 97 Ca -0.16 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 1ap5 h ILE 97 Cb 1.39 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 1ap5 h ILE 97 CO 0.02 0.06 -0.12 0.11 0.00 0.00 0.00 178.15 178.22 1ap5 h LYS 98 N 0.32 -0.33 -0.72 2.37 1.57 -0.93 -2.37 116.57 116.47 1ap5 h LYS 98 Ca 0.27 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 59.16 1ap5 h LYS 98 Cb 0.65 0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.97 1ap5 h LYS 98 CO -0.07 -0.22 0.38 0.07 -0.57 0.00 0.00 179.45 179.04 1ap5 h ARG 99 N -0.37 0.63 0.00 3.15 0.11 -1.21 -0.81 114.38 115.87 1ap5 h ARG 99 Ca -0.03 -0.04 -0.14 0.00 0.10 0.00 0.00 59.98 59.86 1ap5 h ARG 99 Cb 0.26 -0.14 -0.02 0.00 1.11 0.00 0.00 29.97 31.17 1ap5 h ARG 99 CO 0.06 0.42 -0.90 -0.44 0.10 0.00 0.00 179.97 179.21 1ap5 h ASP 100 N 0.65 0.00 0.00 0.08 3.32 -1.30 -3.38 116.42 115.80 1ap5 h ASP 100 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1ap5 h ASP 100 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1ap5 h ASP 100 CO -0.25 0.60 -0.01 0.49 -1.72 0.00 0.00 179.24 178.35 1ap5 n PHE 101 N -3.12 0.00 0.00 4.55 3.72 -0.89 -5.04 117.46 116.67 1ap5 n PHE 101 Ca -0.03 -0.49 0.00 0.00 -0.05 0.00 0.00 57.45 56.88 1ap5 n PHE 101 Cb 0.80 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 39.29 1ap5 n PHE 101 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ap5 n GLY 102 N -0.55 2.04 3.74 1.37 0.00 -0.31 -4.17 105.19 107.31 1ap5 n GLY 102 Ca 0.02 -0.48 -0.08 0.00 0.00 0.00 0.00 46.02 45.48 1ap5 n GLY 102 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ap5 s SER 103 N -3.00 -0.12 0.52 1.61 0.15 -1.25 -4.43 113.70 107.18 1ap5 s SER 103 Ca 0.00 -0.82 0.25 0.00 0.70 0.00 0.00 55.95 56.08 1ap5 s SER 103 Cb 0.00 0.69 1.37 0.00 -1.71 0.00 0.00 66.02 66.37 1ap5 s SER 103 CO 0.00 -1.30 1.99 0.15 1.20 0.00 0.00 173.24 175.28 1ap5 h PHE 104 N 2.10 0.03 0.09 3.44 3.57 -1.90 0.12 116.94 124.39 1ap5 h PHE 104 Ca -0.23 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.27 1ap5 h PHE 104 Cb 1.25 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 1ap5 h PHE 104 CO 0.56 0.01 -0.27 -0.44 -2.23 0.00 0.00 178.31 175.93 1ap5 h ASP 105 N 0.03 -0.82 1.06 0.41 5.19 -1.95 -1.00 116.42 119.34 1ap5 h ASP 105 Ca 0.26 0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.75 1ap5 h ASP 105 Cb 0.99 0.30 0.00 0.00 0.18 0.00 0.00 39.33 40.80 1ap5 h ASP 105 CO -0.01 -0.30 0.00 0.11 -3.12 0.00 0.00 179.24 175.92 1ap5 h LYS 106 N -0.41 0.00 -0.03 3.56 1.57 -1.58 -2.92 116.57 116.76 1ap5 h LYS 106 Ca -0.01 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.60 1ap5 h LYS 106 Cb 0.40 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.73 1ap5 h LYS 106 CO -0.13 0.00 -0.63 0.35 -0.57 0.00 0.00 179.45 178.46 1ap5 h PHE 107 N 0.00 0.70 0.33 -1.35 3.57 -0.66 -1.15 116.94 118.37 1ap5 h PHE 107 Ca 0.00 -0.36 -0.01 0.00 3.53 0.00 0.00 57.97 61.13 1ap5 h PHE 107 Cb 0.53 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 1ap5 h PHE 107 CO 0.00 1.17 -0.18 0.87 -2.23 0.00 0.00 178.31 177.93 1ap5 h LYS 108 N 0.03 -0.46 -0.67 1.11 1.57 -1.12 -1.27 116.57 115.76 1ap5 h LYS 108 Ca -0.07 0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.85 1ap5 h LYS 108 Cb 1.32 0.11 -0.08 0.00 0.08 0.00 0.00 32.23 33.66 1ap5 h LYS 108 CO 0.13 -0.31 0.28 1.49 -0.57 0.00 0.00 179.45 180.47 1ap5 h GLU 109 N -0.48 0.46 0.19 3.15 4.81 -1.59 0.30 114.58 121.41 1ap5 h GLU 109 Ca -0.04 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1ap5 h GLU 109 Cb 0.39 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1ap5 h GLU 109 CO 0.05 0.31 -0.09 0.87 -0.73 0.00 0.00 179.01 179.42 1ap5 h LYS 110 N 0.48 -0.24 -0.62 1.92 6.56 -1.00 0.09 116.57 123.76 1ap5 h LYS 110 Ca 0.34 0.02 -0.09 0.00 -1.06 0.00 0.00 60.65 59.86 1ap5 h LYS 110 Cb 0.43 0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 32.12 1ap5 h LYS 110 CO -0.32 -0.08 0.04 1.25 -2.06 0.00 0.00 179.45 178.28 1ap5 h LEU 111 N -0.35 1.02 -0.36 2.94 6.46 -0.83 -1.39 115.31 122.80 1ap5 h LEU 111 Ca -0.03 -0.27 -0.00 0.00 -0.12 0.00 0.00 57.88 57.47 1ap5 h LEU 111 Cb 0.27 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 39.91 1ap5 h LEU 111 CO 0.04 1.05 0.22 0.74 -0.62 0.00 0.00 178.44 179.86 1ap5 h THR 112 N 0.97 1.12 -0.08 1.05 2.02 -0.34 -1.35 112.91 116.30 1ap5 h THR 112 Ca 0.18 -0.30 -0.08 0.00 0.77 0.00 0.00 66.41 66.99 1ap5 h THR 112 Cb 0.50 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 1ap5 h THR 112 CO 0.02 0.13 -0.30 0.00 0.37 0.00 0.00 175.52 175.74 1ap5 h ALA 113 N 1.09 1.36 -0.15 6.16 0.00 -0.75 0.13 119.26 127.09 1ap5 h ALA 113 Ca 0.13 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.59 1ap5 h ALA 113 Cb 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ap5 h ALA 113 CO -0.02 0.46 -0.46 0.00 0.00 0.00 0.00 179.25 179.22 1ap5 h ALA 114 N 1.57 0.26 -0.05 0.00 0.00 -1.00 -2.64 119.26 117.40 1ap5 h ALA 114 Ca 0.02 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1ap5 h ALA 114 Cb 0.60 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ap5 h ALA 114 CO 0.04 0.41 -0.01 0.77 0.00 0.00 0.00 179.25 180.47 1ap5 h SER 115 N 0.23 0.09 -0.43 0.00 0.02 -0.92 -3.06 113.55 109.49 1ap5 h SER 115 Ca -0.01 -0.37 -0.01 0.00 -0.84 0.00 0.00 61.79 60.56 1ap5 h SER 115 Cb 1.08 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.58 1ap5 h SER 115 CO 0.10 0.44 0.26 0.58 -1.14 0.00 0.00 176.83 177.06 1ap5 h VAL 116 N -0.26 1.14 0.00 2.27 2.07 -0.86 -3.04 116.25 117.57 1ap5 h VAL 116 Ca 0.01 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1ap5 h VAL 116 Cb 0.40 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1ap5 h VAL 116 CO 0.00 0.15 0.00 1.23 0.02 0.00 0.00 177.57 178.97 1ap5 h GLY 117 N 0.69 0.00 -4.58 2.17 0.00 -1.36 -3.45 103.07 96.53 1ap5 h GLY 117 Ca 0.16 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.93 1ap5 h GLY 117 CO -0.03 0.00 0.75 -0.62 0.00 0.00 0.00 176.54 176.65 1ap5 n VAL 118 N -3.02 0.77 -3.40 4.60 0.31 -1.15 -4.95 118.33 111.49 1ap5 n VAL 118 Ca 0.00 -0.19 -0.43 0.00 -0.01 0.00 0.00 64.34 63.71 1ap5 n VAL 118 Cb 0.27 -1.68 -0.09 0.00 -0.91 0.00 0.00 33.84 31.42 1ap5 n VAL 118 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1ap5 s GLN 119 N -0.14 3.01 1.50 5.55 -0.21 -1.26 -4.93 119.66 123.18 1ap5 s GLN 119 Ca 0.69 -0.99 0.00 0.00 0.02 0.00 0.00 55.36 55.08 1ap5 s GLN 119 Cb -0.59 -4.00 0.00 0.00 1.00 0.00 0.00 33.01 29.42 1ap5 s GLN 119 CO 0.46 -0.83 0.00 0.41 -2.12 0.00 0.00 175.29 173.21 1ap5 n GLY 120 N 5.15 -0.16 3.77 3.09 0.00 -1.26 -4.90 105.19 110.88 1ap5 n GLY 120 Ca -0.10 -1.47 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 1ap5 n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ap5 s SER 121 N -4.00 7.46 0.00 1.61 0.01 -1.26 -4.78 113.70 112.74 1ap5 s SER 121 Ca 0.00 1.73 0.00 0.00 1.31 0.00 0.00 55.95 58.99 1ap5 s SER 121 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1ap5 s SER 121 CO 0.00 0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.44 1ap5 n GLY 122 N 1.62 -0.82 3.15 3.44 0.00 -1.26 -0.83 105.19 110.48 1ap5 n GLY 122 Ca -0.04 -0.69 -0.12 0.00 0.00 0.00 0.00 46.02 45.17 1ap5 n GLY 122 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ap5 s TRP 123 N -3.00 -0.01 -0.08 1.61 0.52 0.19 -1.57 118.94 116.60 1ap5 s TRP 123 Ca 0.00 -0.05 -0.00 0.00 0.02 0.00 0.00 56.10 56.06 1ap5 s TRP 123 Cb 0.00 -0.01 -0.03 0.00 -1.15 0.00 0.00 33.47 32.28 1ap5 s TRP 123 CO 0.00 -0.33 -0.05 0.20 0.02 0.00 0.00 176.95 176.79 1ap5 s GLY 124 N -1.46 1.73 0.08 0.98 0.00 -0.58 -1.03 107.32 107.04 1ap5 s GLY 124 Ca -0.13 -0.86 0.05 0.00 0.00 0.00 0.00 44.72 43.77 1ap5 s GLY 124 CO 0.02 -0.57 -0.14 -0.98 0.00 0.00 0.00 173.10 171.43 1ap5 s TRP 125 N -0.67 1.19 -0.30 1.90 0.52 0.36 -0.89 118.94 121.04 1ap5 s TRP 125 Ca 0.10 -0.49 -0.01 0.00 0.02 0.00 0.00 56.10 55.73 1ap5 s TRP 125 Cb -0.11 -0.67 0.05 0.00 -1.15 0.00 0.00 33.47 31.59 1ap5 s TRP 125 CO 0.02 0.05 -0.01 -1.17 0.02 0.00 0.00 176.95 175.86 1ap5 s LEU 126 N -1.85 3.88 0.00 2.99 2.96 -0.01 -1.09 118.68 125.56 1ap5 s LEU 126 Ca -0.01 -1.31 0.00 0.00 -0.22 0.00 0.00 54.13 52.59 1ap5 s LEU 126 Cb -0.09 -1.69 0.00 0.00 0.50 0.00 0.00 46.19 44.91 1ap5 s LEU 126 CO 0.02 -0.26 0.04 0.61 -1.32 0.00 0.00 176.35 175.44 1ap5 n GLY 127 N 4.60 3.64 3.13 7.98 0.00 0.19 -1.60 105.19 123.13 1ap5 n GLY 127 Ca -0.13 -2.31 -0.30 0.00 0.00 0.00 0.00 46.02 43.29 1ap5 n GLY 127 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ap5 s PHE 128 N -2.11 2.21 -0.50 1.61 5.36 0.72 -1.47 117.98 123.80 1ap5 s PHE 128 Ca 0.03 -0.98 -0.19 0.00 -0.96 0.00 0.00 56.93 54.83 1ap5 s PHE 128 Cb -0.00 -1.53 0.06 0.00 -0.34 0.00 0.00 43.02 41.20 1ap5 s PHE 128 CO 0.02 -0.45 0.63 1.21 -1.46 0.00 0.00 175.22 175.17 1ap5 s ASN 129 N 0.68 6.23 0.38 6.13 3.84 0.25 -0.99 114.94 131.46 1ap5 s ASN 129 Ca -0.12 -0.88 0.28 0.00 0.21 0.00 0.00 52.86 52.34 1ap5 s ASN 129 Cb -0.16 -2.29 1.13 0.00 -0.55 0.00 0.00 41.25 39.38 1ap5 s ASN 129 CO 0.03 -0.89 1.82 0.50 -2.79 0.00 0.00 177.10 175.77 1ap5 h LYS 130 N 8.99 0.00 0.00 0.43 3.64 -1.88 0.16 116.57 127.91 1ap5 h LYS 130 Ca -0.27 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1ap5 h LYS 130 Cb 1.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1ap5 h LYS 130 CO 0.96 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 178.53 1ap5 n GLU 131 N -2.59 0.00 0.33 1.90 1.02 -1.26 -4.11 120.64 115.92 1ap5 n GLU 131 Ca 0.02 0.49 0.22 0.00 -0.02 0.00 0.00 57.16 57.87 1ap5 n GLU 131 Cb 0.27 -1.05 1.16 0.00 -0.02 0.00 0.00 31.44 31.80 1ap5 n GLU 131 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1ap5 h ARG 132 N 0.00 0.00 -0.50 3.49 9.65 -2.00 -3.45 114.38 121.56 1ap5 h ARG 132 Ca 0.00 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.72 1ap5 h ARG 132 Cb 0.00 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 28.52 1ap5 h ARG 132 CO 0.00 0.00 -0.16 0.41 2.80 0.00 0.00 179.97 183.02 1ap5 n GLY 133 N -1.01 0.85 3.55 2.80 0.00 0.51 -5.01 105.19 106.88 1ap5 n GLY 133 Ca -0.03 -0.66 -0.27 0.00 0.00 0.00 0.00 46.02 45.06 1ap5 n GLY 133 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ap5 s HIS 134 N -2.32 2.61 0.36 1.61 3.76 -0.94 -4.90 115.29 115.47 1ap5 s HIS 134 Ca 0.00 -0.23 -0.23 0.00 -0.15 0.00 0.00 55.06 54.45 1ap5 s HIS 134 Cb 0.00 -1.30 -0.10 0.00 1.11 0.00 0.00 32.58 32.29 1ap5 s HIS 134 CO 0.00 0.48 0.91 -0.51 -0.85 0.00 0.00 174.74 174.77 1ap5 s LEU 135 N -2.64 4.16 -0.00 0.89 1.02 -1.26 0.88 118.68 121.72 1ap5 s LEU 135 Ca 0.23 1.70 -0.05 0.00 0.02 0.00 0.00 54.13 56.03 1ap5 s LEU 135 Cb -0.09 -4.19 -0.00 0.00 0.02 0.00 0.00 46.19 41.92 1ap5 s LEU 135 CO 0.14 -0.18 0.09 -1.10 0.02 0.00 0.00 176.35 175.31 1ap5 s GLN 136 N -2.56 0.36 -0.29 1.70 -0.21 -0.54 -4.86 119.66 113.25 1ap5 s GLN 136 Ca 0.55 -0.33 -0.08 0.00 0.02 0.00 0.00 55.36 55.52 1ap5 s GLN 136 Cb -0.14 0.15 0.00 0.00 1.00 0.00 0.00 33.01 34.02 1ap5 s GLN 136 CO 0.19 -0.08 0.10 0.42 -2.12 0.00 0.00 175.29 173.80 1ap5 s ILE 137 N -1.08 4.15 0.00 1.08 1.01 -1.26 0.57 121.20 125.67 1ap5 s ILE 137 Ca -0.12 -0.58 0.04 0.00 0.00 0.00 0.00 60.65 59.99 1ap5 s ILE 137 Cb -0.07 -3.12 -0.01 0.00 0.01 0.00 0.00 42.46 39.27 1ap5 s ILE 137 CO 0.01 0.10 -0.14 0.00 0.00 0.00 0.00 174.94 174.90 1ap5 s ALA 138 N 1.54 1.17 -0.16 9.38 0.00 -0.25 -4.95 121.76 128.49 1ap5 s ALA 138 Ca 0.03 -0.67 -0.02 0.00 0.00 0.00 0.00 51.96 51.31 1ap5 s ALA 138 Cb -0.17 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 1ap5 s ALA 138 CO 0.03 0.27 -0.08 0.00 0.00 0.00 0.00 175.76 175.98 1ap5 s ALA 139 N -0.47 2.79 -0.10 0.00 0.00 -1.26 0.13 121.76 122.84 1ap5 s ALA 139 Ca 0.04 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 51.06 1ap5 s ALA 139 Cb -0.06 -1.43 -0.03 0.00 0.00 0.00 0.00 23.12 21.60 1ap5 s ALA 139 CO 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 175.76 175.81 1ap5 s PRO 141 N -0.43 4.00 1.46 0.00 0.04 -1.26 -0.64 135.00 138.18 1ap5 s PRO 141 Ca 0.07 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.07 1ap5 s PRO 141 Cb -0.12 -2.16 0.00 0.00 0.04 0.00 0.00 34.50 32.26 1ap5 s PRO 141 CO 0.02 -0.20 0.00 0.09 0.04 0.00 0.00 177.00 176.95 1ap5 n ASN 142 N -1.34 0.00 -1.19 6.66 3.02 -0.01 -1.07 115.26 121.34 1ap5 n ASN 142 Ca 0.06 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.69 1ap5 n ASN 142 Cb 0.54 0.00 0.29 0.00 -0.61 0.00 0.00 39.78 40.00 1ap5 n ASN 142 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ap5 n GLN 143 N 14.00 3.49 -1.91 3.52 1.13 -1.26 -4.23 117.38 132.12 1ap5 n GLN 143 Ca 0.00 -2.83 -0.42 0.00 -1.94 0.00 0.00 57.00 51.81 1ap5 n GLN 143 Cb 0.00 -1.88 -0.03 0.00 0.11 0.00 0.00 30.24 28.44 1ap5 n GLN 143 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1ap5 s ASP 144 N -1.42 6.60 0.44 1.08 1.11 -0.23 -4.02 116.67 120.23 1ap5 s ASP 144 Ca 0.44 2.38 -0.19 0.00 0.18 0.00 0.00 52.55 55.37 1ap5 s ASP 144 Cb 0.33 -2.54 -0.10 0.00 1.07 0.00 0.00 42.92 41.69 1ap5 s ASP 144 CO 0.14 -0.96 0.93 -2.16 1.18 0.00 0.00 175.17 174.30 1ap5 s PRO 145 N 4.01 4.10 0.03 8.23 0.04 -1.26 -4.57 135.00 145.57 1ap5 s PRO 145 Ca 0.78 0.99 -0.11 0.00 0.04 0.00 0.00 61.00 62.70 1ap5 s PRO 145 Cb -0.37 -2.20 -0.05 0.00 0.04 0.00 0.00 34.50 31.93 1ap5 s PRO 145 CO 0.33 -0.08 1.17 1.25 0.04 0.00 0.00 177.00 179.71 1ap5 h LEU 146 N 1.61 -0.48 0.34 -3.56 6.46 -1.93 -2.87 115.31 114.88 1ap5 h LEU 146 Ca -0.48 0.05 -0.00 0.00 -0.12 0.00 0.00 57.88 57.32 1ap5 h LEU 146 Cb 1.18 0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 41.25 1ap5 h LEU 146 CO 0.62 -0.18 -0.51 -0.61 -0.62 0.00 0.00 178.44 177.14 1ap5 h GLN 147 N -0.24 -0.86 -0.67 1.25 4.15 -1.87 0.51 115.11 117.38 1ap5 h GLN 147 Ca -0.00 0.06 0.17 0.00 0.77 0.00 0.00 58.65 59.64 1ap5 h GLN 147 Cb 0.24 0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.09 1ap5 h GLN 147 CO -0.08 -0.57 0.47 0.78 -1.93 0.00 0.00 178.83 177.49 1ap5 h GLY 148 N -0.89 0.27 0.00 2.39 0.00 -1.89 1.00 103.07 103.95 1ap5 h GLY 148 Ca -0.04 -0.07 -0.37 0.00 0.00 0.00 0.00 47.33 46.85 1ap5 h GLY 148 CO -0.16 0.02 -2.41 -1.30 0.00 0.00 0.00 176.54 172.69 1ap5 n THR 149 N -4.40 1.42 -0.01 4.70 -2.24 -1.08 -4.75 114.28 107.91 1ap5 n THR 149 Ca 0.13 -0.72 0.03 0.00 -2.27 0.00 0.00 64.05 61.22 1ap5 n THR 149 Cb 0.63 -0.90 -0.06 0.00 -2.10 0.00 0.00 70.33 67.91 1ap5 n THR 149 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ap5 n THR 150 N -2.98 0.05 0.00 4.28 -2.24 0.18 -5.02 114.28 108.55 1ap5 n THR 150 Ca -0.38 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1ap5 n THR 150 Cb 1.07 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 69.51 1ap5 n THR 150 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ap5 n GLY 151 N 2.14 1.28 3.78 3.38 0.00 0.34 -4.98 105.19 111.13 1ap5 n GLY 151 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1ap5 n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ap5 s LEU 152 N 0.00 4.06 -0.19 0.99 1.43 -1.26 -4.82 118.68 118.89 1ap5 s LEU 152 Ca 0.00 2.13 -0.24 0.00 -1.03 0.00 0.00 54.13 54.99 1ap5 s LEU 152 Cb 0.00 -4.24 -0.02 0.00 0.03 0.00 0.00 46.19 41.96 1ap5 s LEU 152 CO 0.00 -0.68 0.76 -0.63 0.23 0.00 0.00 176.35 176.04 1ap5 s ILE 153 N -1.65 4.92 0.08 -0.59 1.09 -0.16 -2.96 121.20 121.93 1ap5 s ILE 153 Ca 0.61 1.48 -0.31 0.00 -1.10 0.00 0.00 60.65 61.33 1ap5 s ILE 153 Cb -0.24 -4.07 -0.06 0.00 -1.06 0.00 0.00 42.46 37.03 1ap5 s ILE 153 CO 0.29 0.04 1.26 -2.16 -0.10 0.00 0.00 174.94 174.28 1ap5 s PRO 154 N 2.15 4.39 -0.10 2.79 0.04 -1.26 -0.20 135.00 142.82 1ap5 s PRO 154 Ca 0.35 1.87 -0.00 0.00 0.04 0.00 0.00 61.00 63.25 1ap5 s PRO 154 Cb -0.16 -3.32 -0.06 0.00 0.04 0.00 0.00 34.50 31.00 1ap5 s PRO 154 CO 0.11 -0.32 -0.09 1.28 0.04 0.00 0.00 177.00 178.02 1ap5 n LEU 155 N 3.96 2.59 -3.68 -3.56 4.77 -0.63 -4.92 117.00 115.53 1ap5 n LEU 155 Ca 0.10 -0.02 -0.09 0.00 -0.03 0.00 0.00 56.01 55.96 1ap5 n LEU 155 Cb 0.45 -0.33 -0.10 0.00 -2.33 0.00 0.00 43.42 41.11 1ap5 n LEU 155 CO 0.57 0.58 0.15 -0.22 -1.33 0.00 0.00 177.39 177.14 1ap5 s LEU 156 N -5.75 -0.34 -0.01 2.23 1.98 -0.99 -4.59 118.68 111.21 1ap5 s LEU 156 Ca -0.13 1.08 0.03 0.00 -2.89 0.00 0.00 54.13 52.22 1ap5 s LEU 156 Cb 0.04 1.67 -0.01 0.00 0.66 0.00 0.00 46.19 48.55 1ap5 s LEU 156 CO 0.22 -0.21 -0.10 -0.83 -1.89 0.00 0.00 176.35 173.54 1ap5 s GLY 157 N 1.43 0.50 -0.24 7.98 0.00 -1.26 -0.83 107.32 114.90 1ap5 s GLY 157 Ca -0.09 -0.43 -0.03 0.00 0.00 0.00 0.00 44.72 44.16 1ap5 s GLY 157 CO -0.14 -0.34 -0.05 -0.42 0.00 0.00 0.00 173.10 172.14 1ap5 s ILE 158 N -0.21 3.14 0.00 0.90 1.01 -0.07 -4.78 121.20 121.19 1ap5 s ILE 158 Ca 0.03 -0.76 -0.30 0.00 0.00 0.00 0.00 60.65 59.62 1ap5 s ILE 158 Cb -0.04 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 1ap5 s ILE 158 CO -0.00 0.31 1.20 -0.62 0.00 0.00 0.00 174.94 175.82 1ap5 s ASP 159 N 1.41 7.07 -0.08 3.58 -1.08 -1.26 -1.53 116.67 124.78 1ap5 s ASP 159 Ca 0.03 1.92 0.11 0.00 -0.52 0.00 0.00 52.55 54.09 1ap5 s ASP 159 Cb -0.15 -2.57 0.19 0.00 -1.46 0.00 0.00 42.92 38.93 1ap5 s ASP 159 CO -0.04 -0.52 1.11 1.33 0.52 0.00 0.00 175.17 177.57 1ap5 n VAL 160 N 4.27 1.54 -2.09 1.11 0.24 -0.61 -4.91 118.33 117.88 1ap5 n VAL 160 Ca 0.10 -1.72 -0.37 0.00 -2.04 0.00 0.00 64.34 60.31 1ap5 n VAL 160 Cb 0.46 0.07 0.01 0.00 -1.47 0.00 0.00 33.84 32.92 1ap5 n VAL 160 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1ap5 s TRP 161 N -2.09 2.61 0.14 6.34 0.52 -1.23 -4.51 118.94 120.71 1ap5 s TRP 161 Ca 0.20 1.49 0.32 0.00 0.02 0.00 0.00 56.10 58.13 1ap5 s TRP 161 Cb 0.17 -3.50 1.66 0.00 -1.15 0.00 0.00 33.47 30.65 1ap5 s TRP 161 CO 0.03 -2.01 1.98 0.93 0.02 0.00 0.00 176.95 177.89 1ap5 h GLU 162 N 1.59 0.00 0.00 4.98 5.08 -1.95 -1.65 114.58 122.63 1ap5 h GLU 162 Ca -0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1ap5 h GLU 162 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1ap5 h GLU 162 CO 0.58 0.00 0.00 -2.39 -1.00 0.00 0.00 179.01 176.20 1ap5 n HIS 163 N -2.67 0.00 0.52 4.33 1.44 -1.26 -1.75 115.22 115.83 1ap5 n HIS 163 Ca -0.01 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.82 1ap5 n HIS 163 Cb 0.10 -0.28 0.15 0.00 0.12 0.00 0.00 29.99 30.08 1ap5 n HIS 163 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1ap5 h ALA 164 N 3.26 0.58 0.00 1.59 0.00 -1.65 -3.42 119.26 119.63 1ap5 h ALA 164 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ap5 h ALA 164 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ap5 h ALA 164 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 179.25 181.73 1ap5 n TYR 165 N -2.18 0.00 -0.34 0.00 0.18 -1.19 -4.98 117.16 108.65 1ap5 n TYR 165 Ca 0.03 0.00 0.03 0.00 1.88 0.00 0.00 57.90 59.84 1ap5 n TYR 165 Cb 0.45 0.00 0.21 0.00 -0.38 0.00 0.00 39.34 39.62 1ap5 n TYR 165 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 1ap5 h TYR 166 N 0.00 1.13 -0.62 -3.48 3.20 -1.53 0.20 116.97 115.86 1ap5 h TYR 166 Ca 0.00 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.81 1ap5 h TYR 166 Cb 0.10 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 37.98 1ap5 h TYR 166 CO 0.00 0.59 0.03 -0.07 -1.64 0.00 0.00 178.16 177.07 1ap5 h LEU 167 N 1.11 1.05 0.00 2.82 3.38 -1.90 -1.34 115.31 120.43 1ap5 h LEU 167 Ca 0.41 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1ap5 h LEU 167 Cb 0.18 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1ap5 h LEU 167 CO -0.16 1.08 0.00 1.67 0.09 0.00 0.00 178.44 181.12 1ap5 n GLN 168 N -4.20 0.00 0.07 1.13 7.27 -1.06 -4.54 117.38 116.04 1ap5 n GLN 168 Ca 0.03 0.06 0.10 0.00 0.07 0.00 0.00 57.00 57.26 1ap5 n GLN 168 Cb 0.33 -0.44 0.42 0.00 2.41 0.00 0.00 30.24 32.96 1ap5 n GLN 168 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1ap5 n TYR 169 N -1.01 0.44 0.00 3.69 4.01 0.64 -4.97 117.16 119.97 1ap5 n TYR 169 Ca 0.00 0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 1ap5 n TYR 169 Cb 0.00 -0.77 0.00 0.00 -0.31 0.00 0.00 39.34 38.26 1ap5 n TYR 169 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1ap5 n LYS 170 N -1.90 0.00 0.16 -0.72 5.02 -0.51 -2.36 118.16 117.87 1ap5 n LYS 170 Ca 0.03 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.45 1ap5 n LYS 170 Cb 0.22 0.00 0.45 0.00 -0.02 0.00 0.00 35.03 35.68 1ap5 n LYS 170 CO 0.00 0.00 0.00 -2.95 -0.52 0.00 0.00 177.40 173.93 1ap5 h ASN 171 N 0.00 0.00 -1.81 4.39 -1.07 -1.91 -3.39 115.58 111.79 1ap5 h ASN 171 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 56.30 55.74 1ap5 h ASN 171 Cb 0.00 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 36.12 1ap5 h ASN 171 CO 0.00 0.00 1.14 -0.69 0.07 0.00 0.00 177.43 177.95 1ap5 s VAL 172 N -3.29 4.22 0.16 6.14 1.01 -0.99 -4.86 120.40 122.79 1ap5 s VAL 172 Ca 0.06 -0.91 -0.13 0.00 0.00 0.00 0.00 61.98 61.00 1ap5 s VAL 172 Cb 0.10 -4.92 0.05 0.00 0.00 0.00 0.00 36.38 31.61 1ap5 s VAL 172 CO 0.53 -1.74 1.70 -0.09 0.00 0.00 0.00 175.10 175.51 1ap5 h ARG 173 N 9.46 0.83 0.00 2.72 2.43 -1.86 -2.86 114.38 125.10 1ap5 h ARG 173 Ca 0.10 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1ap5 h ARG 173 Cb 1.02 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.44 1ap5 h ARG 173 CO 1.28 0.74 -0.05 -1.00 -1.51 0.00 0.00 179.97 179.43 1ap5 h PRO 174 N 0.75 0.00 -0.29 0.20 0.13 -1.96 -1.66 132.00 129.16 1ap5 h PRO 174 Ca 0.18 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.14 1ap5 h PRO 174 Cb 0.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.36 1ap5 h PRO 174 CO -0.01 0.05 -0.50 0.22 -0.23 0.00 0.00 178.00 177.53 1ap5 h ASP 175 N 0.00 0.87 -0.05 1.44 1.82 -1.89 -2.35 116.42 116.27 1ap5 h ASP 175 Ca -0.00 -0.44 -0.07 0.00 -0.39 0.00 0.00 57.03 56.13 1ap5 h ASP 175 Cb 0.19 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 39.94 1ap5 h ASP 175 CO 0.01 1.22 -0.15 0.22 -1.61 0.00 0.00 179.24 178.93 1ap5 h TYR 176 N 0.63 0.40 0.03 0.28 3.20 -1.31 -2.76 116.97 117.44 1ap5 h TYR 176 Ca 0.03 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.84 1ap5 h TYR 176 Cb 1.08 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.24 1ap5 h TYR 176 CO 0.06 0.52 -0.02 -0.07 -1.64 0.00 0.00 178.16 177.01 1ap5 h LEU 177 N 0.35 -0.04 -1.75 2.82 -0.00 -1.18 -1.82 115.31 113.70 1ap5 h LEU 177 Ca 0.07 -0.45 -0.01 0.00 -0.00 0.00 0.00 57.88 57.49 1ap5 h LEU 177 Cb 0.47 0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 41.13 1ap5 h LEU 177 CO 0.03 0.44 0.04 0.11 -0.00 0.00 0.00 178.44 179.06 1ap5 h LYS 178 N -0.52 0.20 0.03 1.13 6.56 -1.40 -2.53 116.57 120.04 1ap5 h LYS 178 Ca -0.00 -0.02 -0.22 0.00 -1.06 0.00 0.00 60.65 59.35 1ap5 h LYS 178 Cb 0.48 -0.04 -0.02 0.00 -0.57 0.00 0.00 32.23 32.09 1ap5 h LYS 178 CO 0.01 0.18 -1.01 0.00 -2.06 0.00 0.00 179.45 176.57 1ap5 h ALA 179 N 1.85 0.36 -0.12 3.86 0.00 -1.51 -3.31 119.26 120.39 1ap5 h ALA 179 Ca 0.05 -0.84 -0.06 0.00 0.00 0.00 0.00 54.91 54.07 1ap5 h ALA 179 Cb 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ap5 h ALA 179 CO -0.00 1.06 -0.18 0.97 0.00 0.00 0.00 179.25 181.10 1ap5 h ILE 180 N 0.05 1.19 0.00 0.00 2.10 -0.87 -2.70 117.51 117.28 1ap5 h ILE 180 Ca -0.05 -0.88 0.00 0.00 1.08 0.00 0.00 64.86 65.01 1ap5 h ILE 180 Cb 1.72 1.31 0.00 0.00 -1.09 0.00 0.00 36.82 38.76 1ap5 h ILE 180 CO 0.15 0.27 0.18 -0.50 -1.08 0.00 0.00 178.15 177.17 1ap5 h TRP 181 N 0.18 0.00 0.09 2.19 4.06 -1.63 -1.93 115.95 118.91 1ap5 h TRP 181 Ca 0.03 0.00 -0.28 0.00 2.06 0.00 0.00 58.89 60.70 1ap5 h TRP 181 Cb 0.44 0.00 0.02 0.00 -1.00 0.00 0.00 29.16 28.62 1ap5 h TRP 181 CO 0.01 0.00 -1.19 -0.91 -3.56 0.00 0.00 178.44 172.79 1ap5 h ASN 182 N 0.00 0.80 0.11 -3.49 2.35 -1.69 -3.34 115.58 110.31 1ap5 h ASN 182 Ca 0.00 -0.72 0.00 0.00 -0.55 0.00 0.00 56.30 55.03 1ap5 h ASN 182 Cb 0.36 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1ap5 h ASN 182 CO 0.00 1.53 -0.09 1.33 -1.65 0.00 0.00 177.43 178.55 1ap5 n VAL 183 N -3.77 0.00 -1.66 2.81 0.24 -0.74 -2.55 118.33 112.67 1ap5 n VAL 183 Ca -0.12 -0.17 -0.44 0.00 -2.04 0.00 0.00 64.34 61.57 1ap5 n VAL 183 Cb 0.96 0.31 -0.04 0.00 -1.47 0.00 0.00 33.84 33.60 1ap5 n VAL 183 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1ap5 n ILE 184 N -0.30 0.66 -2.59 1.34 2.08 -1.16 0.67 119.36 120.05 1ap5 n ILE 184 Ca 0.17 -0.16 -0.42 0.00 0.56 0.00 0.00 62.75 62.90 1ap5 n ILE 184 Cb 0.32 -2.19 -0.02 0.00 -0.75 0.00 0.00 39.64 37.00 1ap5 n ILE 184 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1ap5 s ASN 185 N 4.80 6.60 0.56 4.38 2.47 0.19 -0.20 114.94 133.74 1ap5 s ASN 185 Ca 0.92 -1.75 0.30 0.00 0.42 0.00 0.00 52.86 52.75 1ap5 s ASN 185 Cb -0.51 -2.56 1.69 0.00 -1.45 0.00 0.00 41.25 38.42 1ap5 s ASN 185 CO 0.45 -1.39 2.17 -0.50 -3.72 0.00 0.00 177.10 174.11 1ap5 h TRP 186 N 9.17 0.00 -0.09 0.43 4.06 -1.90 -1.86 115.95 125.77 1ap5 h TRP 186 Ca 0.26 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.20 1ap5 h TRP 186 Cb 0.98 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.13 1ap5 h TRP 186 CO 1.30 0.06 0.03 1.49 -3.56 0.00 0.00 178.44 177.77 1ap5 h GLU 187 N 0.00 0.13 -0.31 0.49 4.22 -1.93 -1.54 114.58 115.64 1ap5 h GLU 187 Ca -0.00 -0.03 -0.16 0.00 0.08 0.00 0.00 59.36 59.25 1ap5 h GLU 187 Cb 0.19 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1ap5 h GLU 187 CO 0.01 0.26 -0.45 -0.97 -2.18 0.00 0.00 179.01 175.68 1ap5 h ASN 188 N -0.03 0.88 -1.01 1.04 -0.73 -1.70 -1.82 115.58 112.21 1ap5 h ASN 188 Ca 0.03 -0.42 0.07 0.00 1.87 0.00 0.00 56.30 57.84 1ap5 h ASN 188 Cb 0.18 -0.25 -0.07 0.00 0.27 0.00 0.00 38.32 38.46 1ap5 h ASN 188 CO -0.00 1.19 0.65 0.58 -0.37 0.00 0.00 177.43 179.48 1ap5 h VAL 189 N 0.65 1.08 -0.45 2.57 2.07 -1.28 -0.89 116.25 120.00 1ap5 h VAL 189 Ca 0.04 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 1ap5 h VAL 189 Cb 1.02 -0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1ap5 h VAL 189 CO 0.10 0.21 0.11 0.74 0.02 0.00 0.00 177.57 178.75 1ap5 h THR 190 N 1.18 1.23 -0.99 2.57 2.02 -0.94 -2.93 112.91 115.05 1ap5 h THR 190 Ca 0.44 -0.81 0.23 0.00 0.77 0.00 0.00 66.41 67.04 1ap5 h THR 190 Cb 0.18 0.91 -0.09 0.00 -1.74 0.00 0.00 68.15 67.41 1ap5 h THR 190 CO -0.18 0.29 0.64 -0.33 0.37 0.00 0.00 175.52 176.31 1ap5 h GLU 191 N 0.59 0.44 0.00 6.66 5.08 -0.31 -0.37 114.58 126.67 1ap5 h GLU 191 Ca 0.14 -0.03 -0.22 0.00 -1.00 0.00 0.00 59.36 58.26 1ap5 h GLU 191 Cb 0.32 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 1ap5 h GLU 191 CO 0.00 0.29 -1.07 0.00 -1.00 0.00 0.00 179.01 177.24 1ap5 h ARG 192 N 0.46 0.00 -0.26 2.33 3.08 -1.33 -3.25 114.38 115.40 1ap5 h ARG 192 Ca 0.55 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.53 1ap5 h ARG 192 Cb 1.30 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.35 1ap5 h ARG 192 CO -0.27 0.93 -0.13 -0.92 -1.07 0.00 0.00 179.97 178.52 1ap5 h TYR 193 N 0.00 0.62 -0.15 3.04 3.20 -0.93 -3.28 116.97 119.47 1ap5 h TYR 193 Ca -0.04 -0.16 0.01 0.00 3.14 0.00 0.00 58.73 61.68 1ap5 h TYR 193 Cb 1.79 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.90 1ap5 h TYR 193 CO 0.00 0.80 0.07 1.98 -1.64 0.00 0.00 178.16 179.37 1ap5 h MET 194 N 0.27 0.15 0.00 1.82 4.05 -1.41 0.30 114.93 120.11 1ap5 h MET 194 Ca 0.06 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.47 1ap5 h MET 194 Cb 0.64 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.40 1ap5 h MET 194 CO 0.04 0.10 0.00 0.00 0.23 0.00 0.00 176.91 177.28 1ap5 n ALA 195 N -2.17 1.38 -0.50 0.39 0.00 -1.23 -2.73 120.51 115.65 1ap5 n ALA 195 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1ap5 n ALA 195 Cb 0.05 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1ap5 n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ap5 n LYS 197 N -0.01 0.41 0.00 0.00 4.81 0.10 -4.97 118.16 118.51 1ap5 n LYS 197 Ca 0.00 0.00 0.16 0.00 -0.87 0.00 0.00 58.31 57.60 1ap5 n LYS 197 Cb 0.13 -1.42 0.89 0.00 0.02 0.00 0.00 35.03 34.64 1ap5 n LYS 197 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74