#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v96 s LEU 3 N 0.00 4.49 0.79 1.53 1.43 -1.26 -5.03 118.68 120.63 1v96 s LEU 3 Ca 0.00 2.35 -0.11 0.00 -1.03 0.00 0.00 54.13 55.33 1v96 s LEU 3 Cb 0.00 -3.68 0.07 0.00 0.03 0.00 0.00 46.19 42.60 1v96 s LEU 3 CO 0.00 -0.27 1.09 -2.16 0.23 0.00 0.00 176.35 175.24 1v96 s PRO 4 N -1.62 2.12 0.26 1.29 0.04 -1.26 -4.97 135.00 130.87 1v96 s PRO 4 Ca 0.47 0.80 -0.01 0.00 0.04 0.00 0.00 61.00 62.29 1v96 s PRO 4 Cb -0.33 -1.91 0.34 0.00 0.04 0.00 0.00 34.50 32.64 1v96 s PRO 4 CO 0.43 -1.63 1.75 -1.00 0.04 0.00 0.00 177.00 176.59 1v96 h PRO 5 N -1.10 0.75 -5.16 0.56 0.13 -1.95 -3.43 132.00 121.80 1v96 h PRO 5 Ca -0.46 -0.21 -0.61 0.00 -0.87 0.00 0.00 66.00 63.84 1v96 h PRO 5 Cb 1.25 -0.08 -0.14 0.00 0.13 0.00 0.00 31.00 32.16 1v96 h PRO 5 CO 0.57 0.79 -0.51 -0.51 -0.23 0.00 0.00 178.00 178.10 1v96 s ASP 6 N -6.67 6.05 0.18 1.44 1.11 -1.26 -1.16 116.67 116.35 1v96 s ASP 6 Ca -0.09 0.13 -0.00 0.00 0.18 0.00 0.00 52.55 52.77 1v96 s ASP 6 Cb 0.14 -2.08 -0.04 0.00 1.07 0.00 0.00 42.92 42.02 1v96 s ASP 6 CO 0.81 0.11 0.08 0.27 1.18 0.00 0.00 175.17 177.62 1v96 s ILE 7 N 0.80 0.21 0.23 0.77 -4.36 -0.73 -1.57 121.20 116.54 1v96 s ILE 7 Ca 0.07 -1.97 -0.13 0.00 -0.26 0.00 0.00 60.65 58.37 1v96 s ILE 7 Cb -0.13 -2.32 -0.00 0.00 1.25 0.00 0.00 42.46 41.27 1v96 s ILE 7 CO 0.02 -0.22 0.45 0.28 0.24 0.00 0.00 174.94 175.71 1v96 s THR 8 N -3.99 0.01 0.09 8.37 -1.32 -0.11 -1.10 115.64 117.60 1v96 s THR 8 Ca 0.32 -1.32 0.02 0.00 -1.21 0.00 0.00 61.69 59.50 1v96 s THR 8 Cb 0.07 -2.05 -0.04 0.00 -1.51 0.00 0.00 72.50 68.97 1v96 s THR 8 CO 0.08 -0.07 -0.08 -0.36 -2.21 0.00 0.00 174.62 171.98 1v96 s PHE 9 N -3.99 0.92 0.61 9.09 0.40 -1.26 -0.86 117.98 122.90 1v96 s PHE 9 Ca 0.20 -0.80 0.01 0.00 -0.60 0.00 0.00 56.93 55.74 1v96 s PHE 9 Cb -0.00 -0.52 0.07 0.00 0.51 0.00 0.00 43.02 43.07 1v96 s PHE 9 CO 0.06 -0.09 0.86 0.16 0.70 0.00 0.00 175.22 176.90 1v96 s ASP 10 N -2.74 4.94 0.20 1.36 3.84 -1.22 -4.84 116.67 118.21 1v96 s ASP 10 Ca 0.08 -0.14 -0.11 0.00 -0.00 0.00 0.00 52.55 52.38 1v96 s ASP 10 Cb 0.01 -0.56 0.21 0.00 -1.38 0.00 0.00 42.92 41.21 1v96 s ASP 10 CO -0.03 -1.41 1.77 0.77 -0.00 0.00 0.00 175.17 176.28 1v96 h SER 11 N -0.15 0.33 -0.68 2.11 4.64 -1.95 -1.16 113.55 116.68 1v96 h SER 11 Ca -0.40 0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 60.97 1v96 h SER 11 Cb 1.29 -0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.34 1v96 h SER 11 CO 0.48 0.21 0.40 -0.07 -0.87 0.00 0.00 176.83 176.99 1v96 h LEU 12 N 0.48 0.83 -0.73 5.97 3.38 -1.95 -1.19 115.31 122.11 1v96 h LEU 12 Ca 0.27 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 58.05 1v96 h LEU 12 Cb 0.25 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1v96 h LEU 12 CO -0.23 0.66 -0.37 0.00 0.09 0.00 0.00 178.44 178.60 1v96 h ALA 13 N 1.21 0.90 -0.40 1.53 0.00 -1.81 -2.43 119.26 118.26 1v96 h ALA 13 Ca 0.24 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1v96 h ALA 13 Cb -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1v96 h ALA 13 CO -0.04 0.63 -0.09 1.25 0.00 0.00 0.00 179.25 180.99 1v96 h LEU 14 N 0.46 0.69 -0.60 0.00 5.85 -0.81 -0.23 115.31 120.66 1v96 h LEU 14 Ca 0.05 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 1v96 h LEU 14 Cb 0.85 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 1v96 h LEU 14 CO 0.07 0.82 0.27 0.40 -0.34 0.00 0.00 178.44 179.66 1v96 h ILE 15 N 0.64 1.22 -0.53 4.05 2.04 -0.96 -2.46 117.51 121.52 1v96 h ILE 15 Ca 0.12 -0.66 -0.10 0.00 1.00 0.00 0.00 64.86 65.22 1v96 h ILE 15 Cb 0.54 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1v96 h ILE 15 CO 0.03 0.26 -0.07 0.11 0.00 0.00 0.00 178.15 178.49 1v96 h LYS 16 N 0.83 0.96 0.00 2.37 1.57 -0.96 -2.54 116.57 118.81 1v96 h LYS 16 Ca 0.20 -0.32 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1v96 h LYS 16 Cb 0.16 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1v96 h LYS 16 CO -0.02 0.99 -0.03 0.52 -0.57 0.00 0.00 179.45 180.34 1v96 h MET 17 N 0.87 0.00 -0.43 3.15 2.86 -0.68 -1.46 114.93 119.24 1v96 h MET 17 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1v96 h MET 17 Cb 0.60 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.26 1v96 h MET 17 CO 0.04 0.03 0.00 0.72 1.06 0.00 0.00 176.91 178.75 1v96 n HIS 18 N -3.38 0.56 -1.33 -0.22 8.25 -0.96 -4.59 115.22 113.55 1v96 n HIS 18 Ca -0.02 -0.28 -0.32 0.00 -0.26 0.00 0.00 57.72 56.84 1v96 n HIS 18 Cb 0.14 0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.34 1v96 n HIS 18 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1v96 s SER 19 N -1.42 4.46 0.38 0.41 1.04 -0.55 -4.93 113.70 113.10 1v96 s SER 19 Ca 0.40 1.94 0.06 0.00 0.48 0.00 0.00 55.95 58.83 1v96 s SER 19 Cb 0.23 -2.54 0.77 0.00 0.10 0.00 0.00 66.02 64.58 1v96 s SER 19 CO 0.32 -2.06 1.98 0.06 0.98 0.00 0.00 173.24 174.51 1v96 h GLN 20 N -0.87 0.50 -0.00 4.02 3.07 -1.93 -2.20 115.11 117.70 1v96 h GLN 20 Ca -0.44 -0.06 0.00 0.00 0.09 0.00 0.00 58.65 58.23 1v96 h GLN 20 Cb 1.24 -0.10 0.00 0.00 0.08 0.00 0.00 27.48 28.71 1v96 h GLN 20 CO 0.51 0.42 -0.02 0.27 0.09 0.00 0.00 178.83 180.10 1v96 n ASN 21 N -4.39 0.15 -0.77 0.06 6.94 -1.26 -3.14 115.26 112.85 1v96 n ASN 21 Ca 0.02 -0.62 0.08 0.00 -0.02 0.00 0.00 54.58 54.04 1v96 n ASN 21 Cb 0.14 -0.12 0.15 0.00 -2.36 0.00 0.00 39.78 37.59 1v96 n ASN 21 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 1v96 n MET 22 N -1.05 2.13 -0.17 -3.83 2.81 -0.83 -4.70 117.12 111.48 1v96 n MET 22 Ca 0.18 -1.92 -0.02 0.00 -1.81 0.00 0.00 57.70 54.14 1v96 n MET 22 Cb 0.20 -1.34 0.05 0.00 -0.71 0.00 0.00 33.22 31.42 1v96 n MET 22 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1v96 h LYS 23 N 2.89 0.04 -0.40 0.03 3.64 -1.53 0.11 116.57 121.36 1v96 h LYS 23 Ca 0.00 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 1v96 h LYS 23 Cb 0.75 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 1v96 h LYS 23 CO 0.00 0.03 -0.05 -0.09 -2.27 0.00 0.00 179.45 177.07 1v96 h ARG 24 N 0.04 0.73 -0.48 1.90 9.65 -1.87 -1.59 114.38 122.76 1v96 h ARG 24 Ca 0.26 -0.26 -0.07 0.00 -1.10 0.00 0.00 59.98 58.81 1v96 h ARG 24 Cb 0.40 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.91 1v96 h ARG 24 CO -0.51 0.85 0.00 0.82 2.80 0.00 0.00 179.97 183.93 1v96 h ILE 25 N 0.55 1.24 -0.43 1.20 1.08 -1.76 -1.18 117.51 118.21 1v96 h ILE 25 Ca 0.11 -1.00 -0.07 0.00 -0.39 0.00 0.00 64.86 63.51 1v96 h ILE 25 Cb 0.55 0.87 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 1v96 h ILE 25 CO 0.03 0.35 -0.01 0.25 -0.69 0.00 0.00 178.15 178.08 1v96 h LEU 26 N 0.75 0.76 -0.43 1.44 5.85 -0.68 -0.19 115.31 122.80 1v96 h LEU 26 Ca 0.15 -0.31 0.02 0.00 0.84 0.00 0.00 57.88 58.57 1v96 h LEU 26 Cb 0.45 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1v96 h LEU 26 CO 0.02 0.89 0.25 -0.08 -0.34 0.00 0.00 178.44 179.18 1v96 h GLU 27 N 0.61 0.48 -0.50 1.25 4.81 -0.89 -0.79 114.58 119.56 1v96 h GLU 27 Ca 0.12 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 1v96 h GLU 27 Cb 0.51 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 1v96 h GLU 27 CO 0.02 0.32 0.14 0.28 -0.73 0.00 0.00 179.01 179.04 1v96 h VAL 28 N 0.49 1.23 -0.64 0.32 2.07 -1.07 -2.21 116.25 116.44 1v96 h VAL 28 Ca 0.18 -0.80 0.03 0.00 0.82 0.00 0.00 66.70 66.92 1v96 h VAL 28 Cb 0.03 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 1v96 h VAL 28 CO -0.09 0.29 0.40 0.74 0.02 0.00 0.00 177.57 178.93 1v96 h THR 29 N 0.68 1.09 0.00 2.57 2.02 -0.55 -0.65 112.91 118.07 1v96 h THR 29 Ca 0.16 -0.27 -0.08 0.00 0.77 0.00 0.00 66.41 66.99 1v96 h THR 29 Cb 0.30 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 66.92 1v96 h THR 29 CO -0.00 0.14 -0.37 -0.07 0.37 0.00 0.00 175.52 175.59 1v96 h LEU 30 N 0.79 0.00 -0.20 2.58 3.38 -1.04 -0.03 115.31 120.80 1v96 h LEU 30 Ca 0.26 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.03 1v96 h LEU 30 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1v96 h LEU 30 CO -0.10 0.37 -0.92 0.00 0.09 0.00 0.00 178.44 177.88 1v96 h ALA 31 N 1.63 0.48 0.00 1.53 0.00 -0.71 -3.37 119.26 118.82 1v96 h ALA 31 Ca -0.00 -0.79 -0.08 0.00 0.00 0.00 0.00 54.91 54.04 1v96 h ALA 31 Cb 0.67 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1v96 h ALA 31 CO 0.05 1.03 -2.01 1.63 0.00 0.00 0.00 179.25 179.95 1v96 n LYS 32 N -3.55 0.68 -4.45 0.00 5.02 -0.33 -5.03 118.16 110.51 1v96 n LYS 32 Ca -0.02 -0.15 -0.22 0.00 -2.02 0.00 0.00 58.31 55.90 1v96 n LYS 32 Cb 0.85 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 34.27 1v96 n LYS 32 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1v96 s PHE 33 N -3.20 2.01 -0.31 2.13 0.40 -0.04 -4.95 117.98 114.01 1v96 s PHE 33 Ca -0.08 -0.72 -0.10 0.00 -0.60 0.00 0.00 56.93 55.43 1v96 s PHE 33 Cb 0.11 -1.19 -0.01 0.00 0.51 0.00 0.00 43.02 42.45 1v96 s PHE 33 CO 0.83 0.27 0.16 0.99 0.70 0.00 0.00 175.22 178.17 1v96 s THR 34 N -3.01 4.64 -0.31 0.64 2.01 -0.31 -4.65 115.64 114.65 1v96 s THR 34 Ca 0.31 -0.41 -0.12 0.00 0.31 0.00 0.00 61.69 61.78 1v96 s THR 34 Cb 0.05 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 69.16 1v96 s THR 34 CO 0.13 0.06 0.21 -0.69 -0.69 0.00 0.00 174.62 173.64 1v96 s VAL 35 N 1.62 5.26 -0.47 3.82 1.01 -1.26 -1.78 120.40 128.60 1v96 s VAL 35 Ca 0.05 -0.05 -0.10 0.00 0.00 0.00 0.00 61.98 61.88 1v96 s VAL 35 Cb -0.17 -3.61 0.11 0.00 0.00 0.00 0.00 36.38 32.71 1v96 s VAL 35 CO 0.06 0.11 0.35 0.20 0.00 0.00 0.00 175.10 175.83 1v96 s ASN 36 N 1.73 5.75 -0.16 3.32 0.01 -0.26 -1.60 114.94 123.73 1v96 s ASN 36 Ca 0.06 -1.84 -0.11 0.00 -0.71 0.00 0.00 52.86 50.27 1v96 s ASN 36 Cb -0.17 -2.03 -0.05 0.00 0.41 0.00 0.00 41.25 39.42 1v96 s ASN 36 CO 0.10 -0.69 0.21 -0.76 -1.51 0.00 0.00 177.10 174.45 1v96 s LEU 37 N 1.40 4.27 0.45 0.60 1.43 -0.31 -4.57 118.68 121.96 1v96 s LEU 37 Ca 0.05 0.42 -0.24 0.00 -1.03 0.00 0.00 54.13 53.34 1v96 s LEU 37 Cb -0.26 -2.22 -0.07 0.00 0.03 0.00 0.00 46.19 43.67 1v96 s LEU 37 CO 0.00 0.21 1.22 -0.55 0.23 0.00 0.00 176.35 177.46 1v96 s SER 38 N 0.03 6.11 0.55 2.29 0.15 -1.26 -0.13 113.70 121.44 1v96 s SER 38 Ca 0.13 2.45 0.24 0.00 0.70 0.00 0.00 55.95 59.47 1v96 s SER 38 Cb -0.12 -2.62 1.49 0.00 -1.71 0.00 0.00 66.02 63.07 1v96 s SER 38 CO 0.02 -0.97 2.12 -0.29 1.20 0.00 0.00 173.24 175.32 1v96 h ILE 39 N 1.98 0.72 -0.24 6.45 6.09 -1.35 -0.15 117.51 131.00 1v96 h ILE 39 Ca -0.50 0.00 -0.11 0.00 -1.37 0.00 0.00 64.86 62.88 1v96 h ILE 39 Cb 1.25 0.90 -0.01 0.00 0.47 0.00 0.00 36.82 39.43 1v96 h ILE 39 CO 0.60 0.00 -0.32 0.58 -3.07 0.00 0.00 178.15 175.95 1v96 h VAL 40 N 0.00 1.28 -0.44 2.19 2.07 -1.90 0.17 116.25 119.63 1v96 h VAL 40 Ca 0.08 -1.41 -0.11 0.00 0.82 0.00 0.00 66.70 66.08 1v96 h VAL 40 Cb 0.35 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1v96 h VAL 40 CO -0.00 0.44 -0.17 0.74 0.02 0.00 0.00 177.57 178.61 1v96 h THR 41 N 0.44 1.27 -0.58 2.57 2.02 -1.40 -1.63 112.91 115.60 1v96 h THR 41 Ca 0.05 -1.31 -0.02 0.00 0.77 0.00 0.00 66.41 65.91 1v96 h THR 41 Cb 0.77 1.19 -0.03 0.00 -1.74 0.00 0.00 68.15 68.34 1v96 h THR 41 CO 0.06 0.45 0.29 0.58 0.37 0.00 0.00 175.52 177.27 1v96 h VAL 42 N 0.72 1.20 0.02 3.16 2.07 -1.03 0.71 116.25 123.11 1v96 h VAL 42 Ca 0.10 -0.55 0.01 0.00 0.82 0.00 0.00 66.70 67.08 1v96 h VAL 42 Cb 0.73 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1v96 h VAL 42 CO 0.06 0.23 -0.06 0.22 0.02 0.00 0.00 177.57 178.03 1v96 h TYR 43 N 0.78 -0.15 -0.60 1.57 3.20 -0.79 -0.25 116.97 120.73 1v96 h TYR 43 Ca 0.20 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.03 1v96 h TYR 43 Cb 0.09 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 1v96 h TYR 43 CO -0.01 -0.09 0.19 0.00 -1.64 0.00 0.00 178.16 176.62 1v96 h ARG 44 N -0.11 0.90 -0.26 1.82 2.47 -1.07 -1.55 114.38 116.59 1v96 h ARG 44 Ca 0.02 -0.17 -0.01 0.00 -1.26 0.00 0.00 59.98 58.56 1v96 h ARG 44 Cb 0.13 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.30 1v96 h ARG 44 CO -0.05 0.78 0.12 -0.92 0.56 0.00 0.00 179.97 180.45 1v96 h TYR 45 N 0.88 0.38 -0.04 3.04 3.20 -0.47 0.29 116.97 124.24 1v96 h TYR 45 Ca 0.20 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.00 1v96 h TYR 45 Cb 0.24 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 1v96 h TYR 45 CO 0.02 0.37 -0.19 -0.07 -1.64 0.00 0.00 178.16 176.65 1v96 h LEU 46 N 0.28 0.06 0.00 2.82 3.38 -0.55 -2.30 115.31 119.00 1v96 h LEU 46 Ca 0.09 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 1v96 h LEU 46 Cb 0.14 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1v96 h LEU 46 CO -0.01 0.26 -0.61 0.71 0.09 0.00 0.00 178.44 178.88 1v96 h THR 47 N 0.06 0.79 0.00 0.22 1.35 -1.05 -3.33 112.91 110.95 1v96 h THR 47 Ca 0.01 -1.78 0.00 0.00 -0.55 0.00 0.00 66.41 64.09 1v96 h THR 47 Cb 0.37 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1v96 h THR 47 CO 0.03 0.27 0.04 0.00 -0.25 0.00 0.00 175.52 175.60 1v96 h ALA 48 N -0.56 1.04 -2.23 6.62 0.00 -1.03 -3.41 119.26 119.68 1v96 h ALA 48 Ca -0.14 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 54.17 1v96 h ALA 48 Cb 0.86 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 18.24 1v96 h ALA 48 CO -0.08 -0.04 -0.57 -2.13 0.00 0.00 0.00 179.25 176.43 1v96 n ARG 49 N -2.94 3.16 0.00 0.00 0.63 -0.87 -5.04 116.66 111.59 1v96 n ARG 49 Ca -0.03 -4.82 0.00 0.00 -0.92 0.00 0.00 57.85 52.09 1v96 n ARG 49 Cb 0.10 -2.25 0.00 0.00 0.45 0.00 0.00 32.46 30.76 1v96 n ARG 49 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1v96 n LEU 52 N 0.03 0.00 0.00 6.15 4.77 -1.26 -4.74 117.00 121.95 1v96 n LEU 52 Ca 0.31 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 1v96 n LEU 52 Cb 0.39 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1v96 n LEU 52 CO 0.37 0.00 0.00 0.29 -1.33 0.00 0.00 177.39 176.72 1v96 n LYS 53 N -1.99 0.00 0.00 3.23 5.02 -1.26 -5.15 118.16 118.00 1v96 n LYS 53 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1v96 n LYS 53 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1v96 n LYS 53 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1v96 n LYS 54 N -1.12 1.66 -4.20 1.97 4.76 -1.26 -5.08 118.16 114.88 1v96 n LYS 54 Ca 0.00 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.09 1v96 n LYS 54 Cb 0.00 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.09 1v96 n LYS 54 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1v96 s ASN 55 N -1.00 5.43 0.01 4.39 2.47 -1.26 -5.08 114.94 119.90 1v96 s ASN 55 Ca 0.00 0.12 -0.08 0.00 0.42 0.00 0.00 52.86 53.32 1v96 s ASN 55 Cb 0.00 -1.75 -0.04 0.00 -1.45 0.00 0.00 41.25 38.00 1v96 s ASN 55 CO 0.00 0.28 0.87 0.40 -3.72 0.00 0.00 177.10 174.94 1v96 h ILE 56 N 4.53 0.00 -0.97 -5.21 1.08 -1.98 -2.16 117.51 112.80 1v96 h ILE 56 Ca -0.44 -0.07 0.16 0.00 -0.39 0.00 0.00 64.86 64.13 1v96 h ILE 56 Cb 1.19 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.85 1v96 h ILE 56 CO 0.62 0.00 0.61 -0.08 -0.69 0.00 0.00 178.15 178.60 1v96 h GLU 57 N -0.35 0.75 -0.32 2.37 4.22 -1.99 0.52 114.58 119.79 1v96 h GLU 57 Ca -0.03 -0.05 -0.06 0.00 0.08 0.00 0.00 59.36 59.30 1v96 h GLU 57 Cb 0.22 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1v96 h GLU 57 CO 0.05 0.50 -0.05 0.00 -2.18 0.00 0.00 179.01 177.33 1v96 h ALA 58 N 1.60 0.43 -0.95 2.92 0.00 -2.01 -2.39 119.26 118.85 1v96 h ALA 58 Ca 0.51 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1v96 h ALA 58 Cb 0.77 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 1v96 h ALA 58 CO -0.28 0.24 0.63 0.93 0.00 0.00 0.00 179.25 180.76 1v96 h GLU 59 N 0.37 1.26 -0.72 0.00 4.39 -0.46 -2.45 114.58 116.98 1v96 h GLU 59 Ca 0.08 -0.08 -0.03 0.00 0.34 0.00 0.00 59.36 59.68 1v96 h GLU 59 Cb 0.52 -0.28 -0.03 0.00 -0.10 0.00 0.00 28.75 28.86 1v96 h GLU 59 CO 0.03 0.84 0.34 0.35 -1.16 0.00 0.00 179.01 179.41 1v96 h PHE 60 N 1.30 1.03 -0.97 4.33 3.57 -0.79 -1.77 116.94 123.64 1v96 h PHE 60 Ca 0.35 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.82 1v96 h PHE 60 Cb -0.14 -0.32 -0.05 0.00 2.79 0.00 0.00 35.95 38.23 1v96 h PHE 60 CO -0.00 0.77 0.64 0.93 -2.23 0.00 0.00 178.31 178.41 1v96 h GLU 61 N 1.00 1.25 -0.20 1.11 5.08 -0.98 0.47 114.58 122.31 1v96 h GLU 61 Ca 0.25 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1v96 h GLU 61 Cb 0.12 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 1v96 h GLU 61 CO -0.03 0.83 0.09 0.82 -1.00 0.00 0.00 179.01 179.72 1v96 h ILE 62 N 1.28 1.14 -0.61 3.13 2.04 -1.06 -2.04 117.51 121.40 1v96 h ILE 62 Ca 0.37 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 1v96 h ILE 62 Cb -0.10 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 1v96 h ILE 62 CO -0.09 0.14 0.27 -0.07 0.00 0.00 0.00 178.15 178.40 1v96 h LEU 63 N 0.18 0.81 -1.97 1.44 3.38 -0.88 -2.16 115.31 116.11 1v96 h LEU 63 Ca 0.07 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1v96 h LEU 63 Cb 0.14 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1v96 h LEU 63 CO -0.01 0.73 -0.08 0.50 0.09 0.00 0.00 178.44 179.68 1v96 h LYS 64 N 0.84 0.00 0.06 1.13 3.64 -0.77 0.07 116.57 121.54 1v96 h LYS 64 Ca 0.21 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.33 1v96 h LYS 64 Cb 0.15 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1v96 h LYS 64 CO -0.02 0.08 -1.27 0.22 -2.27 0.00 0.00 179.45 176.19 1v96 h ASP 65 N 0.00 0.19 0.00 4.20 3.58 -0.74 -3.38 116.42 120.27 1v96 h ASP 65 Ca -0.00 -0.23 0.00 0.00 0.42 0.00 0.00 57.03 57.22 1v96 h ASP 65 Cb 0.33 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.32 1v96 h ASP 65 CO 0.01 1.19 -1.78 2.30 -2.88 0.00 0.00 179.24 178.08 1v96 n ILE 66 N -3.38 0.00 -4.47 2.25 -5.35 -0.98 -4.99 119.36 102.44 1v96 n ILE 66 Ca -0.08 -0.40 -0.24 0.00 -0.27 0.00 0.00 62.75 61.76 1v96 n ILE 66 Cb 1.00 0.18 -0.10 0.00 -1.74 0.00 0.00 39.64 38.98 1v96 n ILE 66 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1v96 s TYR 67 N -3.34 2.31 -0.53 4.28 1.51 -0.02 -4.85 117.35 116.71 1v96 s TYR 67 Ca -0.05 -0.33 -0.20 0.00 -1.01 0.00 0.00 57.07 55.48 1v96 s TYR 67 Cb 0.13 -1.02 0.06 0.00 -0.11 0.00 0.00 41.96 41.03 1v96 s TYR 67 CO 0.85 0.71 0.69 1.21 -1.11 0.00 0.00 175.55 177.90 1v96 s ASN 68 N -3.52 6.23 -0.23 2.29 3.04 -0.63 -4.61 114.94 117.50 1v96 s ASN 68 Ca 0.30 -0.93 -0.23 0.00 0.04 0.00 0.00 52.86 52.04 1v96 s ASN 68 Cb -0.05 -2.32 -0.01 0.00 -1.54 0.00 0.00 41.25 37.34 1v96 s ASN 68 CO 0.15 -0.99 0.76 -0.63 -3.04 0.00 0.00 177.10 173.35 1v96 s ILE 69 N 2.87 4.89 -0.24 -5.21 1.01 -1.26 -1.16 121.20 122.10 1v96 s ILE 69 Ca 0.17 1.43 -0.13 0.00 0.00 0.00 0.00 60.65 62.12 1v96 s ILE 69 Cb -0.19 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 1v96 s ILE 69 CO 0.12 -0.02 0.29 -0.69 0.00 0.00 0.00 174.94 174.64 1v96 s VAL 70 N 2.61 5.25 1.07 2.92 1.01 0.82 -4.91 120.40 129.17 1v96 s VAL 70 Ca 0.33 0.44 -0.13 0.00 0.00 0.00 0.00 61.98 62.62 1v96 s VAL 70 Cb -0.15 -3.63 0.23 0.00 0.00 0.00 0.00 36.38 32.83 1v96 s VAL 70 CO 0.08 0.25 1.07 -2.84 0.00 0.00 0.00 175.10 173.67 1v96 s PRO 71 N 1.51 -0.15 -1.28 2.72 0.02 -1.26 -0.97 135.00 135.59 1v96 s PRO 71 Ca 0.13 0.57 -0.14 0.00 0.02 0.00 0.00 61.00 61.58 1v96 s PRO 71 Cb -0.15 -1.67 0.13 0.00 0.02 0.00 0.00 34.50 32.84 1v96 s PRO 71 CO 0.08 -3.13 1.70 -0.11 -0.33 0.00 0.00 177.00 175.21 1v96 n LEU 72 N -4.47 5.67 -4.71 -5.54 0.00 -1.26 -4.77 117.00 101.93 1v96 n LEU 72 Ca 0.04 -4.33 -0.35 0.00 0.00 0.00 0.00 56.01 51.37 1v96 n LEU 72 Cb 0.57 -1.62 0.11 0.00 0.00 0.00 0.00 43.42 42.47 1v96 n LEU 72 CO 0.58 0.78 0.82 -0.76 0.00 0.00 0.00 177.39 178.80 1v96 s LEU 73 N 1.91 3.29 0.22 -1.96 1.43 -1.26 -4.70 118.68 117.60 1v96 s LEU 73 Ca 0.45 2.47 -0.09 0.00 -1.03 0.00 0.00 54.13 55.94 1v96 s LEU 73 Cb 0.04 -4.60 0.33 0.00 0.03 0.00 0.00 46.19 41.98 1v96 s LEU 73 CO 0.01 -2.47 1.70 0.44 0.23 0.00 0.00 176.35 176.26 1v96 h ASP 74 N -0.41 -0.02 0.13 2.29 3.32 -1.99 0.11 116.42 119.84 1v96 h ASP 74 Ca -0.48 0.12 -0.03 0.00 0.02 0.00 0.00 57.03 56.67 1v96 h ASP 74 Cb 1.31 0.17 -0.00 0.00 0.22 0.00 0.00 39.33 41.03 1v96 h ASP 74 CO 0.48 -0.01 -0.12 0.44 -1.72 0.00 0.00 179.24 178.31 1v96 h ASP 75 N 0.25 0.00 0.11 6.45 3.32 -2.00 -1.23 116.42 123.32 1v96 h ASP 75 Ca 0.34 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.14 1v96 h ASP 75 Cb 0.52 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.08 1v96 h ASP 75 CO -0.43 0.12 -0.98 0.40 -1.72 0.00 0.00 179.24 176.63 1v96 h ILE 76 N 0.00 1.32 -0.62 0.35 2.04 -1.22 -2.00 117.51 117.38 1v96 h ILE 76 Ca -0.00 -2.28 -0.03 0.00 1.00 0.00 0.00 64.86 63.55 1v96 h ILE 76 Cb 0.22 2.34 -0.03 0.00 -0.74 0.00 0.00 36.82 38.61 1v96 h ILE 76 CO 0.02 0.70 0.25 0.00 0.00 0.00 0.00 178.15 179.12 1v96 h ALA 77 N 0.55 0.80 -0.14 1.87 0.00 -0.28 0.13 119.26 122.18 1v96 h ALA 77 Ca -0.10 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1v96 h ALA 77 Cb 1.62 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1v96 h ALA 77 CO 0.18 0.41 0.01 0.82 0.00 0.00 0.00 179.25 180.67 1v96 h ILE 78 N 0.86 1.24 -0.51 0.00 2.04 -1.26 -1.90 117.51 117.98 1v96 h ILE 78 Ca 0.21 -0.79 -0.08 0.00 1.00 0.00 0.00 64.86 65.19 1v96 h ILE 78 Cb 0.19 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 1v96 h ILE 78 CO -0.02 0.23 -0.01 0.50 0.00 0.00 0.00 178.15 178.85 1v96 h LYS 79 N -0.01 0.87 -0.79 2.37 3.64 -1.26 -2.18 116.57 119.22 1v96 h LYS 79 Ca 0.04 -0.25 -0.05 0.00 -1.27 0.00 0.00 60.65 59.12 1v96 h LYS 79 Cb 0.35 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.04 1v96 h LYS 79 CO 0.01 0.87 0.31 0.00 -2.27 0.00 0.00 179.45 178.38 1v96 h ALA 80 N 1.18 1.06 -0.48 5.00 0.00 -0.90 0.19 119.26 125.30 1v96 h ALA 80 Ca 0.15 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1v96 h ALA 80 Cb 0.50 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1v96 h ALA 80 CO 0.02 0.66 -0.03 0.00 0.00 0.00 0.00 179.25 179.91 1v96 h ALA 81 N 1.19 1.05 -0.22 0.00 0.00 -1.06 -0.16 119.26 120.05 1v96 h ALA 81 Ca 0.26 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1v96 h ALA 81 Cb 0.22 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1v96 h ALA 81 CO -0.02 0.59 -0.08 1.96 0.00 0.00 0.00 179.25 181.70 1v96 h GLN 82 N 0.76 0.45 -0.20 0.00 4.20 -0.83 -1.65 115.11 117.85 1v96 h GLN 82 Ca 0.14 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1v96 h GLN 82 Cb 0.49 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1v96 h GLN 82 CO 0.02 0.71 0.06 0.82 -0.67 0.00 0.00 178.83 179.78 1v96 h ILE 83 N 0.17 1.18 -0.41 2.54 2.04 -0.82 -2.18 117.51 120.02 1v96 h ILE 83 Ca 0.05 -0.58 -0.06 0.00 1.00 0.00 0.00 64.86 65.27 1v96 h ILE 83 Cb 0.56 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 1v96 h ILE 83 CO 0.03 0.18 -0.02 -0.08 0.00 0.00 0.00 178.15 178.26 1v96 h GLU 84 N 0.14 0.67 -0.42 2.37 4.57 -1.04 -1.17 114.58 119.70 1v96 h GLU 84 Ca 0.06 -0.17 -0.06 0.00 -1.18 0.00 0.00 59.36 58.01 1v96 h GLU 84 Cb 0.22 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 1v96 h GLU 84 CO -0.00 0.69 0.01 0.00 -1.18 0.00 0.00 179.01 178.53 1v96 h ALA 85 N 1.36 1.23 -0.26 2.92 0.00 -1.17 0.89 119.26 124.24 1v96 h ALA 85 Ca 0.13 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 1v96 h ALA 85 Cb 0.42 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1v96 h ALA 85 CO 0.02 0.51 -0.41 -0.97 0.00 0.00 0.00 179.25 178.40 1v96 h ASN 86 N 0.64 0.66 0.09 0.00 -0.73 -0.75 -2.97 115.58 112.52 1v96 h ASN 86 Ca 0.13 -0.30 -0.20 0.00 1.87 0.00 0.00 56.30 57.81 1v96 h ASN 86 Cb 0.38 -0.18 0.00 0.00 0.27 0.00 0.00 38.32 38.79 1v96 h ASN 86 CO 0.01 0.99 -0.74 -0.07 -0.37 0.00 0.00 177.43 177.25 1v96 h LEU 87 N 0.51 0.67 -1.09 0.34 3.38 -0.66 -3.06 115.31 115.39 1v96 h LEU 87 Ca 0.04 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1v96 h LEU 87 Cb 0.93 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.44 1v96 h LEU 87 CO 0.08 1.20 0.57 0.40 0.09 0.00 0.00 178.44 180.78 1v96 h ILE 88 N 0.38 1.23 -0.24 1.22 2.04 -0.80 -0.73 117.51 120.62 1v96 h ILE 88 Ca -0.04 -0.46 -0.06 0.00 1.00 0.00 0.00 64.86 65.30 1v96 h ILE 88 Cb 1.34 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1v96 h ILE 88 CO 0.14 0.23 -0.12 0.50 0.00 0.00 0.00 178.15 178.90 1v96 h LYS 89 N 1.21 0.40 -0.10 2.37 1.63 -1.49 -0.97 116.57 119.63 1v96 h LYS 89 Ca 0.32 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 60.02 1v96 h LYS 89 Cb -0.11 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.47 1v96 h LYS 89 CO -0.07 0.53 0.00 1.63 -3.45 0.00 0.00 179.45 178.09 1v96 n LYS 90 N -4.23 1.38 -3.21 1.90 5.02 -0.40 -4.92 118.16 113.69 1v96 n LYS 90 Ca 0.00 -0.57 -0.16 0.00 -2.02 0.00 0.00 58.31 55.57 1v96 n LYS 90 Cb 0.30 -1.32 0.06 0.00 -0.02 0.00 0.00 35.03 34.06 1v96 n LYS 90 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1v96 n GLU 91 N -0.19 -5.48 -4.59 1.97 1.02 -0.37 -5.03 120.64 107.96 1v96 n GLU 91 Ca 0.14 0.61 -0.34 0.00 -0.02 0.00 0.00 57.16 57.55 1v96 n GLU 91 Cb 0.19 -4.97 -0.11 0.00 -0.02 0.00 0.00 31.44 26.52 1v96 n GLU 91 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1v96 s ILE 92 N -3.25 3.72 -1.08 -3.67 1.01 -0.47 -5.01 121.20 112.46 1v96 s ILE 92 Ca 0.27 -0.46 -0.03 0.00 0.00 0.00 0.00 60.65 60.43 1v96 s ILE 92 Cb -0.12 -2.54 0.29 0.00 0.01 0.00 0.00 42.46 40.11 1v96 s ILE 92 CO 0.53 0.58 1.73 0.35 0.00 0.00 0.00 174.94 178.14 1v96 n THR 93 N 2.44 5.66 -3.43 2.92 -2.24 -1.26 -4.41 114.28 113.96 1v96 n THR 93 Ca -0.18 -5.77 -0.37 0.00 -2.27 0.00 0.00 64.05 55.46 1v96 n THR 93 Cb 0.53 -1.84 -0.07 0.00 -2.10 0.00 0.00 70.33 66.85 1v96 n THR 93 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1v96 s LEU 94 N -3.35 4.26 1.00 3.22 1.43 -1.26 -5.07 118.68 118.90 1v96 s LEU 94 Ca 0.37 0.65 -0.14 0.00 -1.03 0.00 0.00 54.13 53.97 1v96 s LEU 94 Cb 0.13 -2.52 0.19 0.00 0.03 0.00 0.00 46.19 44.01 1v96 s LEU 94 CO -0.02 0.05 1.15 1.51 0.23 0.00 0.00 176.35 179.27 1v96 s ASP 95 N 0.55 2.73 0.15 2.29 1.47 -1.26 -4.78 116.67 117.82 1v96 s ASP 95 Ca 0.21 0.82 -0.17 0.00 1.18 0.00 0.00 52.55 54.59 1v96 s ASP 95 Cb -0.14 -1.26 0.04 0.00 -0.34 0.00 0.00 42.92 41.22 1v96 s ASP 95 CO 0.07 -3.02 1.74 -0.03 0.68 0.00 0.00 175.17 174.61 1v96 h MET 96 N -1.82 0.22 -0.37 2.11 1.85 -1.99 -1.62 114.93 113.30 1v96 h MET 96 Ca -0.49 -0.01 0.06 0.00 -0.61 0.00 0.00 59.70 58.64 1v96 h MET 96 Cb 1.31 -0.05 -0.05 0.00 0.43 0.00 0.00 31.60 33.24 1v96 h MET 96 CO 0.52 0.15 0.07 1.49 -0.40 0.00 0.00 176.91 178.73 1v96 h GLU 97 N 0.23 0.19 -0.50 0.39 4.81 -1.97 -0.60 114.58 117.13 1v96 h GLU 97 Ca 0.15 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1v96 h GLU 97 Cb 0.13 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1v96 h GLU 97 CO -0.17 0.12 0.19 -0.44 -0.73 0.00 0.00 179.01 177.99 1v96 h ASP 98 N 0.19 0.69 -0.42 1.04 3.32 -1.86 -0.15 116.42 119.23 1v96 h ASP 98 Ca 0.18 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 57.02 1v96 h ASP 98 Cb 0.21 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1v96 h ASP 98 CO -0.23 0.67 0.12 0.40 -1.72 0.00 0.00 179.24 178.48 1v96 h ILE 99 N 0.66 1.22 -0.27 0.35 1.08 -0.91 -0.75 117.51 118.90 1v96 h ILE 99 Ca 0.16 -0.75 -0.16 0.00 -0.39 0.00 0.00 64.86 63.73 1v96 h ILE 99 Cb 0.20 0.92 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 1v96 h ILE 99 CO -0.01 0.26 -0.46 0.40 -0.69 0.00 0.00 178.15 177.65 1v96 h ILE 100 N 0.53 1.29 -0.09 -0.67 1.08 -1.03 -0.93 117.51 117.70 1v96 h ILE 100 Ca 0.13 -1.66 -0.00 0.00 -0.39 0.00 0.00 64.86 62.94 1v96 h ILE 100 Cb 0.28 1.59 -0.00 0.00 -3.07 0.00 0.00 36.82 35.61 1v96 h ILE 100 CO -0.00 0.53 0.04 0.74 -0.69 0.00 0.00 178.15 178.77 1v96 h THR 101 N 0.56 1.11 -0.54 -0.27 2.02 -0.87 0.21 112.91 115.13 1v96 h THR 101 Ca 0.03 -0.33 -0.06 0.00 0.77 0.00 0.00 66.41 66.82 1v96 h THR 101 Cb 1.02 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 1v96 h THR 101 CO 0.10 0.10 0.10 0.00 0.37 0.00 0.00 175.52 176.18 1v96 h ALA 102 N 0.92 0.72 -0.61 6.16 0.00 -1.10 -1.54 119.26 123.81 1v96 h ALA 102 Ca 0.03 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 1v96 h ALA 102 Cb 0.12 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1v96 h ALA 102 CO -0.00 0.46 0.06 1.15 0.00 0.00 0.00 179.25 180.91 1v96 h THR 103 N 0.79 1.26 -0.57 0.00 2.02 -1.03 -1.81 112.91 113.58 1v96 h THR 103 Ca 0.17 -1.05 -0.08 0.00 0.77 0.00 0.00 66.41 66.22 1v96 h THR 103 Cb 0.40 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.51 1v96 h THR 103 CO 0.01 0.39 0.03 0.74 0.37 0.00 0.00 175.52 177.05 1v96 h THR 104 N 0.94 1.26 -0.50 3.16 2.02 -0.79 -0.61 112.91 118.38 1v96 h THR 104 Ca 0.18 -1.06 0.00 0.00 0.77 0.00 0.00 66.41 66.30 1v96 h THR 104 Cb 0.46 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 1v96 h THR 104 CO 0.02 0.38 0.32 0.00 0.37 0.00 0.00 175.52 176.61 1v96 h ALA 105 N 1.14 0.64 -0.26 6.16 0.00 -0.86 -0.04 119.26 126.05 1v96 h ALA 105 Ca 0.17 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1v96 h ALA 105 Cb 0.48 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1v96 h ALA 105 CO 0.02 0.11 0.14 0.82 0.00 0.00 0.00 179.25 180.35 1v96 h ILE 106 N 0.68 1.11 -0.88 0.00 2.04 -0.95 0.39 117.51 119.90 1v96 h ILE 106 Ca 0.18 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.78 1v96 h ILE 106 Cb -0.04 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 36.84 1v96 h ILE 106 CO -0.04 0.11 0.58 0.22 0.00 0.00 0.00 178.15 179.02 1v96 h TYR 107 N 0.31 1.08 -0.12 1.37 5.03 -0.65 -2.05 116.97 121.94 1v96 h TYR 107 Ca 0.09 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.43 1v96 h TYR 107 Cb 0.05 -0.36 0.00 0.00 1.55 0.00 0.00 36.73 37.97 1v96 h TYR 107 CO -0.04 0.65 0.00 0.25 -1.32 0.00 0.00 178.16 177.71 1v96 n THR 108 N -4.42 0.14 -3.70 1.81 -2.24 -0.07 -4.94 114.28 100.85 1v96 n THR 108 Ca 0.11 -0.41 -0.25 0.00 -2.27 0.00 0.00 64.05 61.23 1v96 n THR 108 Cb 0.06 0.75 0.06 0.00 -2.10 0.00 0.00 70.33 69.10 1v96 n THR 108 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1v96 n ASN 109 N 0.67 -5.08 -4.74 3.42 4.05 -0.10 -4.98 115.26 108.51 1v96 n ASN 109 Ca 0.17 -0.65 -0.36 0.00 0.45 0.00 0.00 54.58 54.19 1v96 n ASN 109 Cb 0.44 -4.57 -0.08 0.00 1.23 0.00 0.00 39.78 36.80 1v96 n ASN 109 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 177.26 173.77 1v96 s SER 110 N -3.48 5.56 -0.07 1.20 0.01 -0.07 -4.70 113.70 112.15 1v96 s SER 110 Ca 0.52 0.24 -0.30 0.00 1.31 0.00 0.00 55.95 57.72 1v96 s SER 110 Cb -0.24 -1.65 -0.03 0.00 0.21 0.00 0.00 66.02 64.30 1v96 s SER 110 CO 0.77 0.39 1.29 -0.22 0.41 0.00 0.00 173.24 175.87 1v96 s LEU 111 N -0.91 4.27 -0.45 2.44 2.96 -0.61 -4.63 118.68 121.75 1v96 s LEU 111 Ca 0.14 1.88 -0.25 0.00 -0.22 0.00 0.00 54.13 55.67 1v96 s LEU 111 Cb -0.12 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.05 1v96 s LEU 111 CO 0.03 -0.68 0.91 -0.22 -1.32 0.00 0.00 176.35 175.07 1v96 s LEU 112 N 2.65 4.03 -0.19 -0.68 2.96 -0.40 -0.94 118.68 126.12 1v96 s LEU 112 Ca 0.58 0.14 -0.16 0.00 -0.22 0.00 0.00 54.13 54.47 1v96 s LEU 112 Cb -0.26 -3.17 -0.04 0.00 0.50 0.00 0.00 46.19 43.22 1v96 s LEU 112 CO 0.22 -1.01 0.42 -0.69 -1.32 0.00 0.00 176.35 173.97 1v96 s VAL 113 N 3.66 5.18 0.08 1.68 1.01 -0.04 -1.49 120.40 130.48 1v96 s VAL 113 Ca 0.36 0.77 -0.19 0.00 0.00 0.00 0.00 61.98 62.92 1v96 s VAL 113 Cb -0.11 -3.75 0.04 0.00 0.00 0.00 0.00 36.38 32.56 1v96 s VAL 113 CO 0.25 0.25 0.46 0.28 0.00 0.00 0.00 175.10 176.34 1v96 s THR 114 N 1.29 0.05 -0.59 3.92 -1.32 -0.81 -3.39 115.64 114.80 1v96 s THR 114 Ca 0.20 -0.39 0.25 0.00 -1.21 0.00 0.00 61.69 60.54 1v96 s THR 114 Cb -0.15 -1.04 0.27 0.00 -1.51 0.00 0.00 72.50 70.08 1v96 s THR 114 CO 0.08 -0.22 1.64 0.44 -2.21 0.00 0.00 174.62 174.36 1v96 h ASP 115 N 2.63 0.00 -2.16 8.08 3.32 -1.93 0.07 116.42 126.42 1v96 h ASP 115 Ca -0.32 -0.02 -0.58 0.00 0.02 0.00 0.00 57.03 56.13 1v96 h ASP 115 Cb 1.23 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 40.37 1v96 h ASP 115 CO 0.43 0.01 -0.76 -0.67 -1.72 0.00 0.00 179.24 176.53 1v96 n ASP 116 N -2.60 3.03 0.24 6.45 2.03 -1.26 -4.84 116.55 119.61 1v96 n ASP 116 Ca 0.04 -3.34 0.07 0.00 0.52 0.00 0.00 54.79 52.09 1v96 n ASP 116 Cb 0.48 -0.63 0.61 0.00 -0.72 0.00 0.00 41.12 40.85 1v96 n ASP 116 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1v96 h PRO 117 N 3.68 0.03 -0.80 -0.67 0.13 -1.91 -2.84 132.00 129.62 1v96 h PRO 117 Ca 0.15 -0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.36 1v96 h PRO 117 Cb 0.69 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 31.76 1v96 h PRO 117 CO 0.73 0.05 0.53 -0.22 -0.23 0.00 0.00 178.00 178.85 1v96 h LYS 118 N 0.03 0.78 -0.13 0.86 3.64 -1.96 -1.71 116.57 118.08 1v96 h LYS 118 Ca 0.01 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1v96 h LYS 118 Cb 0.04 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 1v96 h LYS 118 CO 0.00 0.51 0.06 -0.09 -2.27 0.00 0.00 179.45 177.66 1v96 h ARG 119 N 0.80 0.18 -0.01 1.90 2.43 -1.93 -2.05 114.38 115.69 1v96 h ARG 119 Ca 0.36 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 1v96 h ARG 119 Cb 0.36 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1v96 h ARG 119 CO -0.14 0.15 -0.26 0.66 -1.51 0.00 0.00 179.97 178.87 1v96 n TYR 120 N -4.48 0.00 -0.31 2.20 4.01 -0.67 -4.52 117.16 113.39 1v96 n TYR 120 Ca -0.01 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.87 1v96 n TYR 120 Cb 0.11 -0.06 0.32 0.00 -0.31 0.00 0.00 39.34 39.40 1v96 n TYR 120 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 1v96 h GLU 121 N 2.01 0.35 0.00 -0.72 4.57 -1.08 0.71 114.58 120.42 1v96 h GLU 121 Ca 0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1v96 h GLU 121 Cb 0.62 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 1v96 h GLU 121 CO 0.00 0.23 0.00 -1.35 -1.18 0.00 0.00 179.01 176.71 1v96 h PRO 122 N 0.36 0.00 0.00 0.92 0.11 -1.80 -1.43 132.00 130.15 1v96 h PRO 122 Ca 0.58 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.69 1v96 h PRO 122 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1v96 h PRO 122 CO -0.56 0.00 -0.69 -0.89 -0.21 0.00 0.00 178.00 175.65 1v96 n ILE 123 N -2.44 0.03 -0.26 4.15 5.41 0.24 -4.31 119.36 122.17 1v96 n ILE 123 Ca -0.02 -0.03 0.05 0.00 1.00 0.00 0.00 62.75 63.75 1v96 n ILE 123 Cb 0.06 0.44 0.18 0.00 -0.71 0.00 0.00 39.64 39.60 1v96 n ILE 123 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1v96 h ARG 124 N 0.00 0.46 0.00 0.38 2.47 -1.29 0.16 114.38 116.55 1v96 h ARG 124 Ca 0.00 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1v96 h ARG 124 Cb 0.53 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.75 1v96 h ARG 124 CO 0.00 0.30 0.00 2.89 0.56 0.00 0.00 179.97 183.72 1v96 n ARG 125 N -4.98 0.15 -0.19 0.04 1.85 -1.26 -1.14 116.66 111.13 1v96 n ARG 125 Ca 0.14 0.62 0.11 0.00 -1.00 0.00 0.00 57.85 57.72 1v96 n ARG 125 Cb 0.40 -1.96 0.27 0.00 -1.05 0.00 0.00 32.46 30.11 1v96 n ARG 125 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1v96 n PHE 126 N -2.28 0.50 0.00 2.89 3.72 0.04 -4.91 117.46 117.42 1v96 n PHE 126 Ca -0.01 -0.25 0.00 0.00 -0.05 0.00 0.00 57.45 57.14 1v96 n PHE 126 Cb 0.05 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 1v96 n PHE 126 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1v96 n GLY 127 N 1.37 0.75 3.72 1.37 0.00 -0.30 -5.05 105.19 107.05 1v96 n GLY 127 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1v96 n GLY 127 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1v96 s LEU 128 N 0.00 4.41 -0.09 0.99 2.96 -1.19 -4.85 118.68 120.91 1v96 s LEU 128 Ca 0.00 1.75 0.03 0.00 -0.22 0.00 0.00 54.13 55.68 1v96 s LEU 128 Cb 0.00 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.10 1v96 s LEU 128 CO 0.00 -0.23 -0.17 -1.81 -1.32 0.00 0.00 176.35 172.82 1v96 s ASP 129 N 0.71 3.69 0.33 3.68 1.01 -1.26 -4.36 116.67 120.46 1v96 s ASP 129 Ca 0.51 -0.37 0.06 0.00 0.71 0.00 0.00 52.55 53.46 1v96 s ASP 129 Cb -0.23 -1.24 -0.06 0.00 1.01 0.00 0.00 42.92 42.40 1v96 s ASP 129 CO 0.29 0.22 -0.00 0.42 0.21 0.00 0.00 175.17 176.31 1v96 s THR 130 N -0.01 1.58 -0.22 -1.27 -4.23 -1.26 -1.28 115.64 108.95 1v96 s THR 130 Ca -0.05 -2.06 -0.15 0.00 -1.18 0.00 0.00 61.69 58.25 1v96 s THR 130 Cb -0.14 -2.70 0.06 0.00 1.34 0.00 0.00 72.50 71.06 1v96 s THR 130 CO 0.04 -0.12 0.56 -0.32 -0.54 0.00 0.00 174.62 174.24 1v96 s MET 131 N -3.78 0.58 0.39 3.99 1.75 -0.56 -4.88 119.30 116.81 1v96 s MET 131 Ca 0.33 0.94 -0.27 0.00 -1.25 0.00 0.00 55.69 55.44 1v96 s MET 131 Cb 0.07 0.14 -0.10 0.00 2.84 0.00 0.00 34.83 37.78 1v96 s MET 131 CO 0.15 -0.13 1.45 -2.14 -0.65 0.00 0.00 175.02 173.69 1v96 s PRO 132 N 1.15 4.03 0.20 4.11 0.02 -1.26 -1.92 135.00 141.33 1v96 s PRO 132 Ca -0.07 2.49 -0.10 0.00 0.02 0.00 0.00 61.00 63.34 1v96 s PRO 132 Cb -0.06 -2.90 0.21 0.00 0.02 0.00 0.00 34.50 31.78 1v96 s PRO 132 CO -0.11 -0.57 1.82 1.25 -0.33 0.00 0.00 177.00 179.06 1v96 h LEU 133 N 2.86 0.58 -0.98 -5.54 5.85 -1.30 -1.15 115.31 115.63 1v96 h LEU 133 Ca -0.51 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.29 1v96 h LEU 133 Cb 1.24 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 42.11 1v96 h LEU 133 CO 0.63 0.39 0.63 -2.24 -0.34 0.00 0.00 178.44 177.51 1v96 h ASP 134 N 0.71 1.02 0.04 1.25 3.04 -1.90 -0.39 116.42 120.19 1v96 h ASP 134 Ca 0.28 0.00 -0.19 0.00 -3.24 0.00 0.00 57.03 53.89 1v96 h ASP 134 Cb 0.13 -0.22 -0.00 0.00 -1.04 0.00 0.00 39.33 38.20 1v96 h ASP 134 CO -0.15 0.67 -0.68 0.11 -2.04 0.00 0.00 179.24 177.14 1v96 h LYS 135 N 1.17 0.59 -0.16 4.15 1.57 -1.82 -2.52 116.57 119.55 1v96 h LYS 135 Ca 0.41 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1v96 h LYS 135 Cb 0.12 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 1v96 h LYS 135 CO -0.16 1.07 0.10 0.35 -0.57 0.00 0.00 179.45 180.24 1v96 h PHE 136 N 0.42 0.19 -0.81 -1.35 3.57 -0.53 -1.08 116.94 117.35 1v96 h PHE 136 Ca -0.02 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.52 1v96 h PHE 136 Cb 1.27 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 39.90 1v96 h PHE 136 CO 0.06 0.11 0.52 0.82 -2.23 0.00 0.00 178.31 177.59 1v96 h ILE 137 N 0.20 1.11 -0.19 1.41 2.04 -1.07 -0.24 117.51 120.78 1v96 h ILE 137 Ca 0.06 -0.34 -0.09 0.00 1.00 0.00 0.00 64.86 65.49 1v96 h ILE 137 Cb -0.01 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.08 1v96 h ILE 137 CO -0.02 0.18 -0.28 0.11 0.00 0.00 0.00 178.15 178.14 1v96 h LYS 138 N 1.00 0.37 -0.27 2.37 1.57 -1.10 -0.76 116.57 119.74 1v96 h LYS 138 Ca 0.33 -0.14 -0.18 0.00 -1.87 0.00 0.00 60.65 58.79 1v96 h LYS 138 Cb 0.03 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 1v96 h LYS 138 CO -0.12 0.62 -0.54 1.49 -0.57 0.00 0.00 179.45 180.33 1v96 h GLU 139 N 0.32 0.82 -0.63 3.15 4.57 -0.55 -1.26 114.58 121.00 1v96 h GLU 139 Ca 0.05 -0.52 -0.05 0.00 -1.18 0.00 0.00 59.36 57.66 1v96 h GLU 139 Cb 0.67 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.29 1v96 h GLU 139 CO 0.05 1.15 0.21 0.28 -1.18 0.00 0.00 179.01 179.52 1v96 h VAL 140 N 0.63 1.24 -0.50 0.32 2.07 -0.77 -0.88 116.25 118.36 1v96 h VAL 140 Ca 0.02 -0.82 0.02 0.00 0.82 0.00 0.00 66.70 66.73 1v96 h VAL 140 Cb 1.14 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 1v96 h VAL 140 CO 0.12 0.32 0.32 -0.33 0.02 0.00 0.00 177.57 178.01 1v96 h GLU 141 N 0.91 0.62 -0.83 1.57 5.08 -0.97 -1.52 114.58 119.44 1v96 h GLU 141 Ca 0.21 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1v96 h GLU 141 Cb 0.27 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1v96 h GLU 141 CO -0.01 0.41 0.48 1.25 -1.00 0.00 0.00 179.01 180.14 1v96 h LEU 142 N 0.64 1.02 -0.40 1.33 5.85 -0.89 -0.64 115.31 122.22 1v96 h LEU 142 Ca 0.20 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1v96 h LEU 142 Cb -0.02 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.73 1v96 h LEU 142 CO -0.07 0.80 0.25 -0.03 -0.34 0.00 0.00 178.44 179.05 1v96 h MET 143 N 1.16 0.54 -0.09 1.25 4.05 -0.50 -1.05 114.93 120.29 1v96 h MET 143 Ca 0.30 -0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.67 1v96 h MET 143 Cb -0.01 -0.12 -0.00 0.00 -0.80 0.00 0.00 31.60 30.67 1v96 h MET 143 CO -0.05 0.38 0.04 0.28 0.23 0.00 0.00 176.91 177.79 1v96 h VAL 144 N 0.53 1.13 -0.70 -5.77 2.07 -0.83 -1.93 116.25 110.74 1v96 h VAL 144 Ca 0.14 -0.38 0.09 0.00 0.82 0.00 0.00 66.70 67.37 1v96 h VAL 144 Cb -0.03 1.22 -0.07 0.00 -1.52 0.00 0.00 31.29 30.90 1v96 h VAL 144 CO -0.03 0.11 0.35 -0.33 0.02 0.00 0.00 177.57 177.69 1v96 h GLU 145 N 0.00 0.58 -0.63 1.57 5.08 -0.94 -1.04 114.58 119.19 1v96 h GLU 145 Ca 0.03 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1v96 h GLU 145 Cb 0.15 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1v96 h GLU 145 CO -0.00 0.38 0.20 0.87 -1.00 0.00 0.00 179.01 179.46 1v96 h LYS 146 N 0.59 0.96 -0.65 2.33 1.57 -1.00 -1.85 116.57 118.53 1v96 h LYS 146 Ca 0.34 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1v96 h LYS 146 Cb 0.36 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 1v96 h LYS 146 CO -0.27 0.83 0.38 0.93 -0.57 0.00 0.00 179.45 180.75 1v96 h GLU 147 N 0.93 0.89 -0.84 3.15 5.08 -0.42 -3.25 114.58 120.12 1v96 h GLU 147 Ca 0.21 -0.09 -0.39 0.00 -1.00 0.00 0.00 59.36 58.09 1v96 h GLU 147 Cb 0.27 -0.18 -0.23 0.00 0.50 0.00 0.00 28.75 29.10 1v96 h GLU 147 CO -0.01 0.65 0.46 1.28 -1.00 0.00 0.00 179.01 180.38 1v96 n LEU 148 N -4.57 6.19 0.00 1.33 4.77 -0.63 -5.12 117.00 118.99 1v96 n LEU 148 Ca 0.05 -3.53 0.00 0.00 -0.03 0.00 0.00 56.01 52.50 1v96 n LEU 148 Cb 0.07 -0.79 0.00 0.00 -2.33 0.00 0.00 43.42 40.37 1v96 n LEU 148 CO 0.37 1.02 0.00 -0.38 -1.33 0.00 0.00 177.39 177.06