#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d87 n SER 2 N 0.00 -4.30 -4.40 1.61 7.64 -1.26 -5.00 113.62 107.90 2d87 n SER 2 Ca 0.00 -0.62 -0.20 0.00 1.01 0.00 0.00 58.87 59.06 2d87 n SER 2 Cb 0.00 -4.87 -0.10 0.00 -1.01 0.00 0.00 64.21 58.23 2d87 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2d87 s SER 3 N -3.76 2.47 -0.43 6.43 0.15 -1.26 -5.11 113.70 112.19 2d87 s SER 3 Ca 0.35 -1.21 0.03 0.00 0.70 0.00 0.00 55.95 55.82 2d87 s SER 3 Cb -0.16 -0.11 0.26 0.00 -1.71 0.00 0.00 66.02 64.30 2d87 s SER 3 CO 0.75 -0.40 1.04 0.61 1.20 0.00 0.00 173.24 176.43 2d87 n GLY 4 N -0.54 -0.63 3.50 9.45 0.00 -1.26 -5.11 105.19 110.60 2d87 n GLY 4 Ca -0.05 0.47 -0.51 0.00 0.00 0.00 0.00 46.02 45.92 2d87 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d87 n SER 5 N 1.51 2.29 -0.10 1.61 7.64 -1.26 -4.83 113.62 120.48 2d87 n SER 5 Ca 0.06 0.54 -0.21 0.00 1.01 0.00 0.00 58.87 60.27 2d87 n SER 5 Cb 0.66 -1.26 -0.11 0.00 -1.01 0.00 0.00 64.21 62.50 2d87 n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2d87 n SER 6 N 9.03 1.86 -3.46 6.43 7.64 -1.26 -5.00 113.62 128.86 2d87 n SER 6 Ca 0.38 0.43 -0.12 0.00 1.01 0.00 0.00 58.87 60.57 2d87 n SER 6 Cb 0.22 -0.96 0.01 0.00 -1.01 0.00 0.00 64.21 62.48 2d87 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d87 n GLY 7 N 1.44 2.58 0.13 0.23 0.00 -1.26 -5.04 105.19 103.27 2d87 n GLY 7 Ca -0.31 -2.22 0.10 0.00 0.00 0.00 0.00 46.02 43.59 2d87 n GLY 7 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2d87 h ILE 8 N 0.41 0.11 0.00 -0.61 2.04 -2.01 -3.33 117.51 114.12 2d87 h ILE 8 Ca -0.16 -1.19 -0.01 0.00 1.00 0.00 0.00 64.86 64.50 2d87 h ILE 8 Cb 0.64 1.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.41 2d87 h ILE 8 CO 0.25 0.06 -0.05 0.50 0.00 0.00 0.00 178.15 178.91 2d87 h LYS 9 N 0.00 0.00 0.00 2.37 3.64 -2.00 -2.46 116.57 118.12 2d87 h LYS 9 Ca -0.02 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2d87 h LYS 9 Cb 1.10 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2d87 h LYS 9 CO 0.01 0.05 -0.12 1.96 -2.27 0.00 0.00 179.45 179.08 2d87 h GLN 10 N 0.00 0.00 -1.25 1.90 7.50 -1.99 -3.23 115.11 118.04 2d87 h GLN 10 Ca -0.00 0.00 0.41 0.00 0.50 0.00 0.00 58.65 59.56 2d87 h GLN 10 Cb 0.10 0.00 -0.13 0.00 0.05 0.00 0.00 27.48 27.50 2d87 h GLN 10 CO 0.01 0.01 0.79 0.00 -1.50 0.00 0.00 178.83 178.14 2d87 h MET 11 N -1.00 0.12 -0.35 1.46 -0.00 -1.66 0.86 114.93 114.36 2d87 h MET 11 Ca -0.00 -0.01 -0.07 0.00 -0.00 0.00 0.00 59.70 59.62 2d87 h MET 11 Cb 0.13 -0.03 -0.01 0.00 -0.00 0.00 0.00 31.60 31.69 2d87 h MET 11 CO -0.00 0.08 -0.06 -0.07 -0.00 0.00 0.00 176.91 176.86 2d87 h LEU 12 N 0.12 0.65 -0.90 -0.10 3.38 -1.57 0.47 115.31 117.37 2d87 h LEU 12 Ca 0.80 -0.35 -0.12 0.00 0.09 0.00 0.00 57.88 58.30 2d87 h LEU 12 Cb 2.39 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 42.95 2d87 h LEU 12 CO -0.45 0.85 -0.51 0.25 0.09 0.00 0.00 178.44 178.67 2d87 h LEU 13 N 0.45 0.11 -0.14 1.67 5.85 0.58 -1.65 115.31 122.17 2d87 h LEU 13 Ca 0.09 -0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.64 2d87 h LEU 13 Cb 0.55 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2d87 h LEU 13 CO 0.03 0.60 -0.58 0.44 -0.34 0.00 0.00 178.44 178.59 2d87 h ASP 14 N 0.08 0.00 0.03 1.25 3.32 -0.60 -3.22 116.42 117.28 2d87 h ASP 14 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2d87 h ASP 14 Cb 0.93 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.48 2d87 h ASP 14 CO 0.07 0.58 -0.01 -0.25 -1.72 0.00 0.00 179.24 177.90 2d87 h TRP 15 N 0.00 -0.03 -0.69 4.55 7.01 -0.67 -3.30 115.95 122.81 2d87 h TRP 15 Ca -0.01 -0.00 0.15 0.00 2.11 0.00 0.00 58.89 61.14 2d87 h TRP 15 Cb 1.38 0.01 -0.13 0.00 -2.10 0.00 0.00 29.16 28.33 2d87 h TRP 15 CO 0.00 0.53 -0.10 0.00 -2.79 0.00 0.00 178.44 176.08 2d87 h ARG 17 N 0.04 -0.06 -0.72 0.00 3.08 -1.69 0.31 114.38 115.35 2d87 h ARG 17 Ca 0.35 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.47 2d87 h ARG 17 Cb 0.57 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.57 2d87 h ARG 17 CO -0.67 -0.04 0.42 0.00 -1.07 0.00 0.00 179.97 178.61 2d87 h ALA 18 N 1.40 0.98 0.00 0.04 0.00 -1.12 0.84 119.26 121.40 2d87 h ALA 18 Ca 0.26 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2d87 h ALA 18 Cb 0.46 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2d87 h ALA 18 CO -0.60 0.11 0.00 1.63 0.00 0.00 0.00 179.25 180.39 2d87 n LYS 19 N -4.74 0.26 -1.48 0.00 4.76 0.00 -3.18 118.16 113.78 2d87 n LYS 19 Ca 0.10 0.06 0.03 0.00 -2.87 0.00 0.00 58.31 55.62 2d87 n LYS 19 Cb 0.18 -1.50 0.07 0.00 -1.84 0.00 0.00 35.03 31.94 2d87 n LYS 19 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 2d87 n THR 20 N -1.34 0.82 0.14 -0.18 -1.04 0.88 -4.64 114.28 108.92 2d87 n THR 20 Ca 0.10 -1.95 0.11 0.00 -2.04 0.00 0.00 64.05 60.28 2d87 n THR 20 Cb 0.22 0.63 0.27 0.00 -1.82 0.00 0.00 70.33 69.63 2d87 n THR 20 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2d87 n ARG 21 N -0.09 2.51 -0.15 -2.82 1.85 0.27 -4.14 116.66 114.09 2d87 n ARG 21 Ca 0.11 -2.31 0.09 0.00 -1.00 0.00 0.00 57.85 54.75 2d87 n ARG 21 Cb 0.99 -1.52 0.16 0.00 -1.05 0.00 0.00 32.46 31.03 2d87 n ARG 21 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2d87 n GLY 22 N 1.53 4.83 3.83 2.89 0.00 -1.26 -5.04 105.19 111.98 2d87 n GLY 22 Ca 0.21 -1.14 -0.27 0.00 0.00 0.00 0.00 46.02 44.82 2d87 n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2d87 s TYR 23 N -2.90 2.01 0.16 1.61 1.51 -1.26 -5.15 117.35 113.33 2d87 s TYR 23 Ca 0.33 -0.77 0.11 0.00 -1.01 0.00 0.00 57.07 55.74 2d87 s TYR 23 Cb 0.29 -1.90 -0.04 0.00 -0.11 0.00 0.00 41.96 40.21 2d87 s TYR 23 CO 0.03 -0.15 -0.24 -2.00 -1.11 0.00 0.00 175.55 172.07 2d87 s GLU 24 N -4.10 1.52 -1.48 -0.62 2.12 -1.26 -4.70 118.70 110.18 2d87 s GLU 24 Ca 0.32 -1.42 -0.12 0.00 0.36 0.00 0.00 54.97 54.11 2d87 s GLU 24 Cb 0.00 -1.90 0.06 0.00 0.26 0.00 0.00 34.13 32.55 2d87 s GLU 24 CO 0.19 0.43 1.00 0.72 -0.54 0.00 0.00 175.26 177.06 2d87 n HIS 25 N 0.53 -2.43 -3.86 5.30 8.25 -1.26 -4.98 115.22 116.78 2d87 n HIS 25 Ca -0.15 0.90 -0.14 0.00 -0.26 0.00 0.00 57.72 58.08 2d87 n HIS 25 Cb 0.55 -4.24 -0.15 0.00 1.12 0.00 0.00 29.99 27.27 2d87 n HIS 25 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2d87 s VAL 26 N -3.28 0.03 -0.17 1.59 1.01 -1.26 -4.95 120.40 113.36 2d87 s VAL 26 Ca 0.62 0.07 -0.05 0.00 0.00 0.00 0.00 61.98 62.63 2d87 s VAL 26 Cb -0.30 -0.09 0.08 0.00 0.00 0.00 0.00 36.38 36.07 2d87 s VAL 26 CO 0.77 0.06 0.31 1.51 0.00 0.00 0.00 175.10 177.75 2d87 s ASP 27 N 0.51 0.32 -0.58 3.32 1.47 -1.26 -5.01 116.67 115.44 2d87 s ASP 27 Ca -0.04 0.53 -0.17 0.00 1.18 0.00 0.00 52.55 54.05 2d87 s ASP 27 Cb -0.07 0.87 0.13 0.00 -0.34 0.00 0.00 42.92 43.52 2d87 s ASP 27 CO -0.01 -0.26 0.58 -0.63 0.68 0.00 0.00 175.17 175.53 2d87 s ILE 28 N 2.47 5.13 -0.12 2.11 1.01 -1.26 -4.82 121.20 125.72 2d87 s ILE 28 Ca 0.03 -1.44 0.10 0.00 0.00 0.00 0.00 60.65 59.35 2d87 s ILE 28 Cb -0.13 -4.40 -0.15 0.00 0.01 0.00 0.00 42.46 37.80 2d87 s ILE 28 CO -0.11 -0.96 0.04 1.67 0.00 0.00 0.00 174.94 175.58 2d87 n GLN 29 N 5.47 2.02 -3.84 2.79 -0.06 -1.26 -4.93 117.38 117.57 2d87 n GLN 29 Ca -0.10 -0.00 -0.07 0.00 -2.00 0.00 0.00 57.00 54.82 2d87 n GLN 29 Cb 0.41 -1.31 -0.00 0.00 -4.06 0.00 0.00 30.24 25.28 2d87 n GLN 29 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2d87 s ASN 30 N -4.49 -0.15 -0.64 1.69 2.20 -1.26 -5.05 114.94 107.25 2d87 s ASN 30 Ca -0.06 -0.81 -0.01 0.00 -0.94 0.00 0.00 52.86 51.04 2d87 s ASN 30 Cb 0.04 0.76 0.44 0.00 -2.00 0.00 0.00 41.25 40.49 2d87 s ASN 30 CO 0.49 -1.46 1.91 0.49 -2.94 0.00 0.00 177.10 175.59 2d87 n PHE 31 N -0.49 3.15 0.00 1.54 3.72 -1.26 -4.18 117.46 119.94 2d87 n PHE 31 Ca -0.06 -2.86 0.00 0.00 -0.05 0.00 0.00 57.45 54.49 2d87 n PHE 31 Cb 0.59 -1.26 0.00 0.00 -0.94 0.00 0.00 39.48 37.88 2d87 n PHE 31 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2d87 n SER 32 N -0.84 0.00 -0.06 4.37 2.88 -1.26 -3.71 113.62 115.00 2d87 n SER 32 Ca 0.59 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 58.05 2d87 n SER 32 Cb 0.65 -0.23 -0.07 0.00 -0.75 0.00 0.00 64.21 63.81 2d87 n SER 32 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2d87 n SER 33 N -2.38 2.64 -0.45 -3.46 2.88 -1.26 -3.50 113.62 108.09 2d87 n SER 33 Ca 0.00 -0.04 0.35 0.00 -1.33 0.00 0.00 58.87 57.85 2d87 n SER 33 Cb 0.00 0.23 0.56 0.00 -0.75 0.00 0.00 64.21 64.25 2d87 n SER 33 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2d87 n SER 34 N -2.68 0.08 -0.09 -3.46 2.88 -1.26 0.23 113.62 109.32 2d87 n SER 34 Ca -0.22 0.89 -0.13 0.00 -1.33 0.00 0.00 58.87 58.09 2d87 n SER 34 Cb 0.81 -0.44 -0.15 0.00 -0.75 0.00 0.00 64.21 63.68 2d87 n SER 34 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 2d87 n TRP 35 N -3.81 0.17 -0.51 0.66 7.02 -1.26 -4.34 117.44 115.37 2d87 n TRP 35 Ca 0.32 0.05 0.42 0.00 -1.02 0.00 0.00 57.50 57.27 2d87 n TRP 35 Cb 1.35 -1.03 0.71 0.00 -2.42 0.00 0.00 31.31 29.92 2d87 n TRP 35 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 2d87 h SER 36 N 0.00 0.16 0.51 -0.99 4.64 0.28 0.17 113.55 118.31 2d87 h SER 36 Ca -0.52 0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 60.87 2d87 h SER 36 Cb 2.12 0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 64.30 2d87 h SER 36 CO 0.01 -0.13 -0.31 0.44 -0.87 0.00 0.00 176.83 175.97 2d87 h ASP 37 N 0.05 -0.78 0.00 4.97 3.32 -1.69 -3.49 116.42 118.79 2d87 h ASP 37 Ca 0.85 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.94 2d87 h ASP 37 Cb 2.92 0.22 0.00 0.00 0.22 0.00 0.00 39.33 42.69 2d87 h ASP 37 CO -0.29 -0.48 0.00 0.61 -1.72 0.00 0.00 179.24 177.36 2d87 n GLY 38 N -1.39 1.95 0.25 2.75 0.00 0.05 -4.43 105.19 104.37 2d87 n GLY 38 Ca -0.09 -0.35 0.22 0.00 0.00 0.00 0.00 46.02 45.80 2d87 n GLY 38 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2d87 n MET 39 N 0.00 -0.05 -0.00 1.61 2.81 -1.26 -0.98 117.12 119.24 2d87 n MET 39 Ca 0.00 1.08 -0.00 0.00 -1.81 0.00 0.00 57.70 56.97 2d87 n MET 39 Cb 0.00 -1.90 -0.00 0.00 -0.71 0.00 0.00 33.22 30.61 2d87 n MET 39 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2d87 h ALA 40 N 1.55 -0.11 -0.63 3.04 0.00 -1.85 0.20 119.26 121.46 2d87 h ALA 40 Ca 0.62 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.66 2d87 h ALA 40 Cb 1.60 0.89 -0.11 0.00 0.00 0.00 0.00 17.79 20.17 2d87 h ALA 40 CO -0.62 -0.12 -0.07 0.74 0.00 0.00 0.00 179.25 179.19 2d87 h PHE 41 N -0.00 -0.17 0.01 0.00 0.04 -1.35 -2.17 116.94 113.31 2d87 h PHE 41 Ca 0.00 0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.83 2d87 h PHE 41 Cb 0.00 0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.31 2d87 h PHE 41 CO -0.81 -0.22 -0.12 0.00 -0.60 0.00 0.00 178.31 176.56 2d87 h ALA 43 N -1.30 -0.14 -0.92 0.00 0.00 -0.30 0.64 119.26 117.25 2d87 h ALA 43 Ca 0.00 0.21 0.26 0.00 0.00 0.00 0.00 54.91 55.38 2d87 h ALA 43 Cb 0.16 1.14 -0.15 0.00 0.00 0.00 0.00 17.79 18.95 2d87 h ALA 43 CO -0.07 -0.77 0.33 1.25 0.00 0.00 0.00 179.25 179.99 2d87 h LEU 44 N -0.02 0.14 0.30 0.00 5.85 -1.10 -0.58 115.31 119.89 2d87 h LEU 44 Ca 0.27 0.20 -0.01 0.00 0.84 0.00 0.00 57.88 59.17 2d87 h LEU 44 Cb 0.53 0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.79 2d87 h LEU 44 CO -0.95 -0.16 -0.14 0.58 -0.34 0.00 0.00 178.44 177.43 2d87 h VAL 45 N 0.24 0.00 -1.05 1.05 2.07 0.79 -3.28 116.25 116.08 2d87 h VAL 45 Ca 0.61 -0.59 0.41 0.00 0.82 0.00 0.00 66.70 67.95 2d87 h VAL 45 Cb 1.29 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.90 2d87 h VAL 45 CO -0.65 0.00 0.61 1.57 0.02 0.00 0.00 177.57 179.12 2d87 n HIS 46 N -4.71 0.94 -0.15 1.57 -0.00 0.35 0.11 115.22 113.32 2d87 n HIS 46 Ca -0.05 0.94 -0.02 0.00 -0.00 0.00 0.00 57.72 58.59 2d87 n HIS 46 Cb 0.16 -1.36 0.06 0.00 -0.00 0.00 0.00 29.99 28.85 2d87 n HIS 46 CO 0.00 0.00 0.00 -0.97 -0.00 0.00 0.00 176.34 175.37 2d87 h ASN 47 N 0.00 -0.12 -0.00 0.26 -1.24 -1.18 0.22 115.58 113.52 2d87 h ASN 47 Ca 0.80 0.10 -0.00 0.00 0.71 0.00 0.00 56.30 57.91 2d87 h ASN 47 Cb 2.28 0.17 0.00 0.00 0.73 0.00 0.00 38.32 41.50 2d87 h ASN 47 CO -0.62 -0.03 -0.00 -0.26 -1.29 0.00 0.00 177.43 175.23 2d87 h PHE 48 N 0.16 0.00 -2.93 0.67 0.04 0.69 -3.40 116.94 112.17 2d87 h PHE 48 Ca 0.25 -0.00 -0.61 0.00 2.80 0.00 0.00 57.97 60.40 2d87 h PHE 48 Cb 0.35 -0.00 -0.40 0.00 2.20 0.00 0.00 35.95 38.10 2d87 h PHE 48 CO -0.27 0.63 -0.74 -0.06 -0.60 0.00 0.00 178.31 177.27 2d87 s PHE 49 N -3.69 2.21 0.22 -0.55 0.40 -0.72 -4.96 117.98 110.89 2d87 s PHE 49 Ca -0.17 -2.62 -0.02 0.00 -0.60 0.00 0.00 56.93 53.52 2d87 s PHE 49 Cb 0.00 -1.94 0.20 0.00 0.51 0.00 0.00 43.02 41.79 2d87 s PHE 49 CO 0.68 -0.74 1.58 -1.00 0.70 0.00 0.00 175.22 176.44 2d87 h PRO 50 N 6.30 0.56 -0.39 0.24 0.13 -0.80 -3.18 132.00 134.85 2d87 h PRO 50 Ca 0.06 -0.30 -0.10 0.00 -0.87 0.00 0.00 66.00 64.79 2d87 h PRO 50 Cb 0.89 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 2d87 h PRO 50 CO 0.52 0.88 -0.15 0.93 -0.23 0.00 0.00 178.00 179.96 2d87 h GLU 51 N 0.46 0.79 -0.97 0.86 5.08 -1.93 -3.13 114.58 115.74 2d87 h GLU 51 Ca 0.03 -0.33 0.29 0.00 -1.00 0.00 0.00 59.36 58.36 2d87 h GLU 51 Cb 0.93 -0.03 -0.18 0.00 0.50 0.00 0.00 28.75 29.98 2d87 h GLU 51 CO 0.08 0.95 0.16 0.00 -1.00 0.00 0.00 179.01 179.20 2d87 h ALA 52 N 0.82 1.37 -2.63 3.43 0.00 -1.94 -3.42 119.26 116.90 2d87 h ALA 52 Ca 0.09 0.31 -0.07 0.00 0.00 0.00 0.00 54.91 55.24 2d87 h ALA 52 Cb 0.69 0.50 -0.15 0.00 0.00 0.00 0.00 17.79 18.83 2d87 h ALA 52 CO 0.05 -0.63 -0.11 -0.59 0.00 0.00 0.00 179.25 177.97 2d87 s PHE 53 N -5.90 -0.21 0.29 0.00 -0.71 -1.18 -5.00 117.98 105.26 2d87 s PHE 53 Ca -0.12 0.02 -0.13 0.00 -1.04 0.00 0.00 56.93 55.67 2d87 s PHE 53 Cb 0.29 0.22 -0.08 0.00 -1.21 0.00 0.00 43.02 42.24 2d87 s PHE 53 CO 0.78 -0.63 0.66 -0.51 -1.34 0.00 0.00 175.22 174.18 2d87 s ASP 54 N -2.41 6.70 -0.04 1.98 1.11 -1.26 -4.69 116.67 118.06 2d87 s ASP 54 Ca -0.01 1.13 -0.04 0.00 0.18 0.00 0.00 52.55 53.80 2d87 s ASP 54 Cb 0.01 -2.31 -0.01 0.00 1.07 0.00 0.00 42.92 41.67 2d87 s ASP 54 CO -0.07 -0.16 -0.08 0.00 1.18 0.00 0.00 175.17 176.04 2d87 n TYR 55 N -0.30 0.02 0.26 4.23 9.36 -1.26 -4.40 117.16 125.07 2d87 n TYR 55 Ca 0.02 0.01 0.16 0.00 3.32 0.00 0.00 57.90 61.41 2d87 n TYR 55 Cb 0.53 -0.15 0.75 0.00 -0.63 0.00 0.00 39.34 39.84 2d87 n TYR 55 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 2d87 h GLY 56 N -0.25 0.00 1.59 2.98 0.00 -2.02 0.18 103.07 105.56 2d87 h GLY 56 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2d87 h GLY 56 CO 0.00 0.00 -0.17 1.46 0.00 0.00 0.00 176.54 177.83 2d87 h GLN 57 N 0.00 0.49 -7.40 4.80 1.08 -2.00 -3.44 115.11 108.64 2d87 h GLN 57 Ca 0.06 -0.16 -0.47 0.00 -1.45 0.00 0.00 58.65 56.63 2d87 h GLN 57 Cb 0.89 -0.04 0.14 0.00 -0.05 0.00 0.00 27.48 28.41 2d87 h GLN 57 CO -0.00 0.65 0.27 -0.51 -0.95 0.00 0.00 178.83 178.29 2d87 s LEU 58 N -8.79 2.14 0.13 1.46 1.43 0.64 -5.08 118.68 110.61 2d87 s LEU 58 Ca -0.07 1.23 0.08 0.00 -1.03 0.00 0.00 54.13 54.34 2d87 s LEU 58 Cb 0.14 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.70 2d87 s LEU 58 CO 0.78 -2.54 -0.18 -0.44 0.23 0.00 0.00 176.35 174.20 2d87 s SER 59 N -3.72 2.44 0.36 2.29 0.01 -1.26 -5.04 113.70 108.77 2d87 s SER 59 Ca 0.63 -0.79 0.15 0.00 1.31 0.00 0.00 55.95 57.25 2d87 s SER 59 Cb -0.16 -0.13 0.66 0.00 0.21 0.00 0.00 66.02 66.60 2d87 s SER 59 CO 0.55 -0.03 1.76 1.55 0.41 0.00 0.00 173.24 177.48 2d87 h PRO 60 N 3.60 0.00 0.00 12.44 0.13 -1.98 -2.57 132.00 143.62 2d87 h PRO 60 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2d87 h PRO 60 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2d87 h PRO 60 CO 0.47 0.42 0.00 1.04 -0.23 0.00 0.00 178.00 179.70 2d87 n GLN 61 N -3.84 0.37 -1.78 0.86 1.13 -1.26 -3.71 117.38 109.14 2d87 n GLN 61 Ca -0.01 0.07 -0.34 0.00 -1.94 0.00 0.00 57.00 54.77 2d87 n GLN 61 Cb 0.48 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 29.32 2d87 n GLN 61 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2d87 n ASN 62 N -1.25 7.08 -0.49 1.08 3.02 -0.97 -4.73 115.26 119.01 2d87 n ASN 62 Ca 0.11 -3.49 0.42 0.00 -0.03 0.00 0.00 54.58 51.59 2d87 n ASN 62 Cb 0.16 -1.17 0.75 0.00 -0.61 0.00 0.00 39.78 38.91 2d87 n ASN 62 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2d87 h ARG 63 N 3.21 0.03 0.02 3.52 3.08 -1.77 0.47 114.38 122.94 2d87 h ARG 63 Ca 0.50 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.54 2d87 h ARG 63 Cb 0.38 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.42 2d87 h ARG 63 CO 1.17 0.02 -0.01 -0.09 -1.07 0.00 0.00 179.97 179.99 2d87 h ARG 64 N 0.03 -0.03 -0.72 0.04 2.43 -1.87 -3.31 114.38 110.95 2d87 h ARG 64 Ca 0.74 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 60.04 2d87 h ARG 64 Cb 2.84 0.01 -0.13 0.00 -0.42 0.00 0.00 29.97 32.27 2d87 h ARG 64 CO -0.08 -0.02 -0.33 0.37 -1.51 0.00 0.00 179.97 178.41 2d87 h GLN 65 N -0.44 -0.09 -0.98 0.20 4.15 -1.73 0.13 115.11 116.36 2d87 h GLN 65 Ca -0.00 0.01 0.23 0.00 0.77 0.00 0.00 58.65 59.65 2d87 h GLN 65 Cb 0.02 0.02 -0.18 0.00 0.21 0.00 0.00 27.48 27.55 2d87 h GLN 65 CO 0.00 -0.06 -0.12 -0.91 -1.93 0.00 0.00 178.83 175.82 2d87 h ASN 66 N -0.10 -0.70 0.45 -0.69 2.35 -1.11 0.36 115.58 116.14 2d87 h ASN 66 Ca 0.28 0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 56.30 2d87 h ASN 66 Cb 0.57 0.55 0.00 0.00 0.05 0.00 0.00 38.32 39.49 2d87 h ASN 66 CO -0.78 -0.33 -0.21 -0.26 -1.65 0.00 0.00 177.43 174.20 2d87 h PHE 67 N 0.01 -0.56 -0.06 1.19 -1.00 -0.87 -2.36 116.94 113.29 2d87 h PHE 67 Ca 0.53 -0.01 0.01 0.00 2.81 0.00 0.00 57.97 61.31 2d87 h PHE 67 Cb 0.95 0.18 -0.03 0.00 3.61 0.00 0.00 35.95 40.66 2d87 h PHE 67 CO -0.63 -0.24 -0.27 0.93 -1.61 0.00 0.00 178.31 176.49 2d87 h GLU 68 N -1.02 -0.28 -1.01 1.51 5.08 -0.09 -0.07 114.58 118.70 2d87 h GLU 68 Ca -0.06 0.02 0.27 0.00 -1.00 0.00 0.00 59.36 58.59 2d87 h GLU 68 Cb 0.56 0.06 -0.13 0.00 0.50 0.00 0.00 28.75 29.75 2d87 h GLU 68 CO 0.10 -0.19 0.60 0.28 -1.00 0.00 0.00 179.01 178.80 2d87 h VAL 69 N -0.29 0.46 -0.24 3.13 2.07 -0.48 0.73 116.25 121.63 2d87 h VAL 69 Ca 0.01 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.32 2d87 h VAL 69 Cb 0.34 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 2d87 h VAL 69 CO -0.21 0.09 -0.04 0.00 0.02 0.00 0.00 177.57 177.42 2d87 h ALA 70 N 1.76 1.49 0.13 1.67 0.00 -0.61 0.22 119.26 123.92 2d87 h ALA 70 Ca 0.67 -0.18 -0.19 0.00 0.00 0.00 0.00 54.91 55.21 2d87 h ALA 70 Cb 1.39 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 19.08 2d87 h ALA 70 CO -0.50 0.36 -0.85 0.74 0.00 0.00 0.00 179.25 179.00 2d87 h PHE 71 N 0.35 0.51 0.02 0.00 0.04 0.21 -3.29 116.94 114.77 2d87 h PHE 71 Ca 0.08 -0.37 -0.00 0.00 2.80 0.00 0.00 57.97 60.47 2d87 h PHE 71 Cb 0.31 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.44 2d87 h PHE 71 CO 0.01 1.33 -0.01 0.66 -0.60 0.00 0.00 178.31 179.70 2d87 h SER 72 N -0.39 -0.02 -0.64 2.17 4.64 -0.58 -1.87 113.55 116.85 2d87 h SER 72 Ca -0.16 -0.28 0.19 0.00 -0.47 0.00 0.00 61.79 61.07 2d87 h SER 72 Cb 1.63 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.70 2d87 h SER 72 CO 0.13 0.27 0.65 0.77 -0.87 0.00 0.00 176.83 177.79 2d87 h SER 73 N -0.31 0.00 0.00 4.97 4.64 -0.72 0.01 113.55 122.15 2d87 h SER 73 Ca -0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2d87 h SER 73 Cb 0.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 2d87 h SER 73 CO 0.00 0.00 -0.52 0.00 -0.87 0.00 0.00 176.83 175.44 2d87 h ALA 74 N 1.30 0.10 0.00 5.18 0.00 -1.55 -3.33 119.26 120.96 2d87 h ALA 74 Ca 0.30 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2d87 h ALA 74 Cb 1.61 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.72 2d87 h ALA 74 CO -0.00 0.31 0.07 1.49 0.00 0.00 0.00 179.25 181.11 2d87 h GLU 75 N -1.00 0.00 0.10 0.00 4.81 -0.36 0.80 114.58 118.93 2d87 h GLU 75 Ca -0.13 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2d87 h GLU 75 Cb 0.98 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 2d87 h GLU 75 CO -0.08 0.00 -0.13 1.15 -0.73 0.00 0.00 179.01 179.22 2d87 h THR 76 N 0.00 0.00 0.00 0.32 2.02 -1.16 -2.85 112.91 111.24 2d87 h THR 76 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2d87 h THR 76 Cb 0.14 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.55 2d87 h THR 76 CO 0.00 0.00 -0.39 0.00 0.37 0.00 0.00 175.52 175.50 2d87 n HIS 77 N -3.14 0.00 1.02 3.16 1.44 -1.15 -4.53 115.22 112.02 2d87 n HIS 77 Ca -0.03 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.79 2d87 n HIS 77 Cb 0.12 -0.02 0.04 0.00 0.12 0.00 0.00 29.99 30.25 2d87 n HIS 77 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2d87 n ALA 78 N -1.20 4.15 -3.91 1.59 0.00 0.27 -4.96 120.51 116.45 2d87 n ALA 78 Ca 0.01 -0.51 -0.28 0.00 0.00 0.00 0.00 53.44 52.65 2d87 n ALA 78 Cb 0.08 -0.91 -0.07 0.00 0.00 0.00 0.00 19.45 18.56 2d87 n ALA 78 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2d87 n ASP 79 N -1.29 -0.19 -4.74 0.00 2.03 -0.92 -4.80 116.55 106.64 2d87 n ASP 79 Ca 0.06 -0.99 -0.40 0.00 0.52 0.00 0.00 54.79 53.97 2d87 n ASP 79 Cb 0.35 -1.25 -0.05 0.00 -0.72 0.00 0.00 41.12 39.44 2d87 n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2d87 s PRO 81 N -0.87 4.36 -1.23 0.00 0.04 -1.26 -4.51 135.00 131.54 2d87 s PRO 81 Ca 0.43 2.04 -0.16 0.00 0.04 0.00 0.00 61.00 63.35 2d87 s PRO 81 Cb -0.26 -3.23 0.12 0.00 0.04 0.00 0.00 34.50 31.17 2d87 s PRO 81 CO 0.32 -0.33 1.56 -0.65 0.04 0.00 0.00 177.00 177.94 2d87 s GLN 82 N 0.48 4.00 -0.01 4.56 -0.21 -1.26 -4.81 119.66 122.41 2d87 s GLN 82 Ca 0.60 -2.22 -0.16 0.00 0.02 0.00 0.00 55.36 53.60 2d87 s GLN 82 Cb -0.36 -5.28 -0.09 0.00 1.00 0.00 0.00 33.01 28.28 2d87 s GLN 82 CO 0.34 -2.01 0.78 -0.07 -2.12 0.00 0.00 175.29 172.21 2d87 h LEU 83 N 11.17 -0.49 -9.89 2.90 3.38 -2.02 -3.44 115.31 116.92 2d87 h LEU 83 Ca 0.36 0.02 -0.55 0.00 0.09 0.00 0.00 57.88 57.80 2d87 h LEU 83 Cb 0.88 0.13 0.12 0.00 0.09 0.00 0.00 40.66 41.88 2d87 h LEU 83 CO 1.34 -0.17 0.62 0.18 0.09 0.00 0.00 178.44 180.51 2d87 n LEU 84 N -4.54 4.46 -4.34 1.67 4.77 -1.26 -4.94 117.00 112.82 2d87 n LEU 84 Ca -0.07 1.15 -0.47 0.00 -0.03 0.00 0.00 56.01 56.59 2d87 n LEU 84 Cb 0.23 -1.56 -0.02 0.00 -2.33 0.00 0.00 43.42 39.74 2d87 n LEU 84 CO 0.17 -0.30 0.47 -1.81 -1.33 0.00 0.00 177.39 174.59 2d87 s ASP 85 N -0.39 6.77 0.12 -1.43 1.11 -1.26 -4.94 116.67 116.64 2d87 s ASP 85 Ca 0.58 -2.67 -0.21 0.00 0.18 0.00 0.00 52.55 50.44 2d87 s ASP 85 Cb -0.49 -2.22 -0.03 0.00 1.07 0.00 0.00 42.92 41.25 2d87 s ASP 85 CO 0.60 -0.60 1.10 0.41 1.18 0.00 0.00 175.17 177.86 2d87 n THR 86 N 4.04 -0.47 -0.35 -1.27 -1.04 -1.26 0.12 114.28 114.05 2d87 n THR 86 Ca 0.15 1.72 0.11 0.00 -2.04 0.00 0.00 64.05 63.98 2d87 n THR 86 Cb 0.47 -2.14 0.22 0.00 -1.82 0.00 0.00 70.33 67.06 2d87 n THR 86 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 2d87 n GLU 87 N -4.91 -0.08 0.15 -2.82 0.28 -1.26 0.21 120.64 112.21 2d87 n GLU 87 Ca 0.02 1.52 0.02 0.00 -0.16 0.00 0.00 57.16 58.56 2d87 n GLU 87 Cb 0.20 -2.34 0.15 0.00 1.43 0.00 0.00 31.44 30.87 2d87 n GLU 87 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 2d87 h ASP 88 N 0.00 0.00 -0.07 -1.84 3.32 0.53 -3.27 116.42 115.08 2d87 h ASP 88 Ca 0.55 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.58 2d87 h ASP 88 Cb 1.01 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.56 2d87 h ASP 88 CO -0.97 0.54 -0.02 0.24 -1.72 0.00 0.00 179.24 177.30 2d87 h MET 89 N 0.00 0.13 0.02 3.56 2.86 0.53 -1.68 114.93 120.36 2d87 h MET 89 Ca -0.01 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2d87 h MET 89 Cb 1.21 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.85 2d87 h MET 89 CO 0.07 0.48 -0.15 0.28 1.06 0.00 0.00 176.91 178.65 2d87 h VAL 90 N -0.22 0.00 -0.87 -2.22 2.07 -0.65 -2.38 116.25 111.98 2d87 h VAL 90 Ca 0.02 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.68 2d87 h VAL 90 Cb 0.43 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.11 2d87 h VAL 90 CO 0.01 0.00 0.48 0.08 0.02 0.00 0.00 177.57 178.16 2d87 h ARG 91 N -0.20 0.68 -6.43 1.57 0.11 -1.67 -3.41 114.38 105.03 2d87 h ARG 91 Ca 0.00 -0.04 -0.56 0.00 0.10 0.00 0.00 59.98 59.48 2d87 h ARG 91 Cb 0.21 -0.15 0.04 0.00 1.11 0.00 0.00 29.97 31.17 2d87 h ARG 91 CO -0.09 0.45 1.06 1.28 0.10 0.00 0.00 179.97 182.77 2d87 n LEU 92 N -4.81 3.72 -0.31 0.08 4.77 -0.63 -4.84 117.00 114.97 2d87 n LEU 92 Ca 0.17 0.99 0.24 0.00 -0.03 0.00 0.00 56.01 57.38 2d87 n LEU 92 Cb 0.41 -1.47 0.53 0.00 -2.33 0.00 0.00 43.42 40.56 2d87 n LEU 92 CO 0.23 0.03 1.23 -0.09 -1.33 0.00 0.00 177.39 177.45 2d87 h ARG 93 N 8.41 0.34 -1.71 3.23 9.65 -1.81 -3.42 114.38 129.07 2d87 h ARG 93 Ca -0.47 -0.02 0.03 0.00 -1.10 0.00 0.00 59.98 58.42 2d87 h ARG 93 Cb 1.24 -0.08 -0.24 0.00 -1.39 0.00 0.00 29.97 29.50 2d87 h ARG 93 CO 0.94 0.23 0.38 -1.83 2.80 0.00 0.00 179.97 182.48 2d87 s GLU 94 N -5.43 0.63 -0.01 0.20 -1.05 -1.26 -4.97 118.70 106.80 2d87 s GLU 94 Ca -0.08 0.60 -0.30 0.00 -0.15 0.00 0.00 54.97 55.04 2d87 s GLU 94 Cb 0.25 0.30 -0.05 0.00 -0.44 0.00 0.00 34.13 34.19 2d87 s GLU 94 CO 0.80 -0.10 1.46 -1.25 0.95 0.00 0.00 175.26 177.11 2d87 s PRO 95 N -0.01 4.25 0.13 -4.83 0.04 -1.23 -4.95 135.00 128.41 2d87 s PRO 95 Ca 0.01 2.02 -0.34 0.00 0.04 0.00 0.00 61.00 62.73 2d87 s PRO 95 Cb -0.04 -3.66 -0.14 0.00 0.04 0.00 0.00 34.50 30.71 2d87 s PRO 95 CO -0.03 -0.65 1.59 -0.25 0.04 0.00 0.00 177.00 177.71 2d87 n ASP 96 N 5.77 3.04 -0.18 6.66 8.00 -1.26 -4.54 116.55 134.04 2d87 n ASP 96 Ca 0.14 1.07 -0.00 0.00 0.71 0.00 0.00 54.79 56.71 2d87 n ASP 96 Cb 0.43 -1.41 0.09 0.00 -0.02 0.00 0.00 41.12 40.21 2d87 n ASP 96 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 2d87 h TRP 97 N 6.15 0.04 -0.90 1.24 5.08 -1.92 -0.36 115.95 125.28 2d87 h TRP 97 Ca -0.45 0.04 0.25 0.00 1.08 0.00 0.00 58.89 59.80 2d87 h TRP 97 Cb 1.26 0.07 -0.14 0.00 -3.00 0.00 0.00 29.16 27.35 2d87 h TRP 97 CO 0.65 -0.10 0.32 0.87 -1.28 0.00 0.00 178.44 178.89 2d87 h LYS 98 N 0.16 0.25 0.22 0.12 1.57 -1.89 0.12 116.57 117.12 2d87 h LYS 98 Ca 0.29 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 2d87 h LYS 98 Cb 0.45 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2d87 h LYS 98 CO -0.44 0.16 -0.11 0.00 -0.57 0.00 0.00 179.45 178.49 2d87 h VAL 100 N -0.66 0.00 -0.93 0.00 2.07 -0.88 0.40 116.25 116.25 2d87 h VAL 100 Ca -0.03 0.00 0.39 0.00 0.82 0.00 0.00 66.70 67.88 2d87 h VAL 100 Cb 0.23 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 29.83 2d87 h VAL 100 CO 0.05 0.00 0.50 0.00 0.02 0.00 0.00 177.57 178.14 2d87 n TYR 101 N -4.92 1.08 0.42 1.57 4.19 0.37 -0.27 117.16 119.61 2d87 n TYR 101 Ca 0.00 1.10 -0.18 0.00 3.31 0.00 0.00 57.90 62.13 2d87 n TYR 101 Cb 0.24 -1.50 -0.09 0.00 0.49 0.00 0.00 39.34 38.48 2d87 n TYR 101 CO 0.00 0.00 0.00 1.15 0.91 0.00 0.00 176.86 178.92 2d87 h THR 102 N 0.00 0.00 -0.45 2.97 2.02 -0.23 -2.38 112.91 114.85 2d87 h THR 102 Ca 0.79 0.00 0.07 0.00 0.77 0.00 0.00 66.41 68.04 2d87 h THR 102 Cb 2.08 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 68.40 2d87 h THR 102 CO -0.72 0.00 -0.47 0.22 0.37 0.00 0.00 175.52 174.92 2d87 h TYR 103 N -1.14 -1.38 -0.73 3.16 3.20 -0.50 0.81 116.97 120.39 2d87 h TYR 103 Ca -0.10 0.08 0.13 0.00 3.14 0.00 0.00 58.73 61.97 2d87 h TYR 103 Cb 0.91 0.67 -0.13 0.00 1.54 0.00 0.00 36.73 39.71 2d87 h TYR 103 CO -0.07 -0.45 -0.30 0.82 -1.64 0.00 0.00 178.16 176.52 2d87 h ILE 104 N -0.32 0.16 -0.61 1.81 1.08 -1.41 0.28 117.51 118.49 2d87 h ILE 104 Ca 0.13 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.60 2d87 h ILE 104 Cb 0.58 0.16 -0.03 0.00 -3.07 0.00 0.00 36.82 34.46 2d87 h ILE 104 CO -0.61 0.00 0.39 -0.61 -0.69 0.00 0.00 178.15 176.63 2d87 h GLN 105 N -0.08 0.82 0.56 2.37 4.15 -0.66 -0.50 115.11 121.77 2d87 h GLN 105 Ca 0.30 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.64 2d87 h GLN 105 Cb 0.57 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 28.08 2d87 h GLN 105 CO -0.78 0.56 -0.32 1.49 -1.93 0.00 0.00 178.83 177.86 2d87 h GLU 106 N 0.83 -0.79 -0.78 1.69 4.57 0.16 -2.56 114.58 117.69 2d87 h GLU 106 Ca 0.22 0.05 0.07 0.00 -1.18 0.00 0.00 59.36 58.53 2d87 h GLU 106 Cb -0.07 0.18 -0.06 0.00 -0.16 0.00 0.00 28.75 28.64 2d87 h GLU 106 CO -0.05 -0.53 0.46 0.35 -1.18 0.00 0.00 179.01 178.06 2d87 h PHE 107 N -0.82 0.84 -0.61 0.92 3.57 -0.49 -2.13 116.94 118.21 2d87 h PHE 107 Ca -0.07 0.03 0.12 0.00 3.53 0.00 0.00 57.97 61.58 2d87 h PHE 107 Cb 0.66 -0.26 -0.10 0.00 2.79 0.00 0.00 35.95 39.04 2d87 h PHE 107 CO -0.08 0.39 0.07 -0.92 -2.23 0.00 0.00 178.31 175.54 2d87 h TYR 108 N 0.81 0.09 -0.60 0.41 5.03 -0.85 0.14 116.97 122.00 2d87 h TYR 108 Ca 0.36 0.04 0.03 0.00 2.58 0.00 0.00 58.73 61.74 2d87 h TYR 108 Cb 0.24 0.06 -0.03 0.00 1.55 0.00 0.00 36.73 38.54 2d87 h TYR 108 CO -0.06 -0.10 0.40 -0.09 -1.32 0.00 0.00 178.16 176.99 2d87 h ARG 109 N 0.19 0.68 -0.37 1.82 2.43 -0.98 -2.13 114.38 116.03 2d87 h ARG 109 Ca 0.32 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.40 2d87 h ARG 109 Cb 0.51 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 2d87 h ARG 109 CO -0.47 0.45 0.04 0.00 -1.51 0.00 0.00 179.97 178.48 2d87 h LEU 111 N 0.45 -0.67 -0.83 0.00 3.38 -0.69 -2.32 115.31 114.64 2d87 h LEU 111 Ca 0.11 0.04 0.20 0.00 0.09 0.00 0.00 57.88 58.32 2d87 h LEU 111 Cb 0.39 0.19 -0.14 0.00 0.09 0.00 0.00 40.66 41.19 2d87 h LEU 111 CO 0.01 -0.44 0.05 0.58 0.09 0.00 0.00 178.44 178.73 2d87 h VAL 112 N -0.70 0.27 0.32 1.22 2.07 -1.44 0.65 116.25 118.65 2d87 h VAL 112 Ca -0.06 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2d87 h VAL 112 Cb 0.56 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2d87 h VAL 112 CO 0.07 0.02 -0.21 1.56 0.02 0.00 0.00 177.57 179.02 2d87 h GLN 113 N 0.11 -0.50 -0.07 1.57 1.08 -1.32 -1.69 115.11 114.28 2d87 h GLN 113 Ca 0.47 0.03 0.02 0.00 -1.45 0.00 0.00 58.65 57.73 2d87 h GLN 113 Cb 0.88 0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 28.42 2d87 h GLN 113 CO -0.72 -0.34 0.11 0.87 -0.95 0.00 0.00 178.83 177.81 2d87 h LYS 114 N -0.52 0.00 0.00 1.46 6.56 -0.52 -3.45 116.57 120.09 2d87 h LYS 114 Ca -0.03 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 2d87 h LYS 114 Cb 0.44 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 2d87 h LYS 114 CO 0.02 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.82 2d87 n GLY 115 N -1.28 0.89 0.09 3.86 0.00 0.05 -5.00 105.19 103.79 2d87 n GLY 115 Ca -0.01 -0.20 -0.16 0.00 0.00 0.00 0.00 46.02 45.65 2d87 n GLY 115 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2d87 h LEU 116 N 0.00 0.15 -9.11 0.99 3.38 -1.59 -3.46 115.31 105.67 2d87 h LEU 116 Ca 0.00 -0.97 -0.67 0.00 0.09 0.00 0.00 57.88 56.33 2d87 h LEU 116 Cb 0.00 -0.05 -0.18 0.00 0.09 0.00 0.00 40.66 40.52 2d87 h LEU 116 CO 0.00 1.14 -0.65 -0.69 0.09 0.00 0.00 178.44 178.33 2d87 s VAL 117 N -2.29 4.07 0.75 1.22 1.01 -1.25 -4.98 120.40 118.92 2d87 s VAL 117 Ca -0.18 -0.32 -0.16 0.00 0.00 0.00 0.00 61.98 61.32 2d87 s VAL 117 Cb -0.02 -2.73 -0.01 0.00 0.00 0.00 0.00 36.38 33.63 2d87 s VAL 117 CO 0.73 0.57 0.69 0.29 0.00 0.00 0.00 175.10 177.38 2d87 n LYS 118 N 2.60 0.30 -1.74 2.72 5.02 -1.26 -4.24 118.16 121.56 2d87 n LYS 118 Ca -0.18 0.15 -0.39 0.00 -2.02 0.00 0.00 58.31 55.87 2d87 n LYS 118 Cb 0.53 -1.98 0.03 0.00 -0.02 0.00 0.00 35.03 33.59 2d87 n LYS 118 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2d87 n THR 119 N -2.58 3.41 -1.38 -0.18 -2.24 -1.26 -4.77 114.28 105.29 2d87 n THR 119 Ca 0.11 -0.50 -0.54 0.00 -2.27 0.00 0.00 64.05 60.85 2d87 n THR 119 Cb 0.50 -1.69 -0.08 0.00 -2.10 0.00 0.00 70.33 66.96 2d87 n THR 119 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2d87 n LYS 120 N -0.67 0.00 -2.07 -0.78 4.76 -1.26 -4.86 118.16 113.27 2d87 n LYS 120 Ca 0.09 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.20 2d87 n LYS 120 Cb 0.43 -1.19 0.01 0.00 -1.84 0.00 0.00 35.03 32.44 2d87 n LYS 120 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2d87 s LYS 121 N 2.27 3.32 0.62 1.97 2.47 -1.26 -5.05 119.74 124.09 2d87 s LYS 121 Ca 0.83 1.24 -0.07 0.00 -1.56 0.00 0.00 55.97 56.40 2d87 s LYS 121 Cb -1.18 -2.03 0.01 0.00 -1.46 0.00 0.00 37.83 33.17 2d87 s LYS 121 CO 0.64 -0.81 0.95 -1.12 0.16 0.00 0.00 175.35 175.17 2d87 s SER 122 N -2.69 5.50 0.13 1.43 0.01 -1.26 -5.09 113.70 111.73 2d87 s SER 122 Ca 0.64 0.79 0.02 0.00 1.31 0.00 0.00 55.95 58.71 2d87 s SER 122 Cb -0.16 -1.71 -0.04 0.00 0.21 0.00 0.00 66.02 64.32 2d87 s SER 122 CO 0.36 -1.16 0.25 -0.94 0.41 0.00 0.00 173.24 172.15 2d87 s SER 123 N -4.33 6.23 0.00 2.44 1.04 -1.26 -4.96 113.70 112.86 2d87 s SER 123 Ca 0.55 0.15 0.00 0.00 0.48 0.00 0.00 55.95 57.14 2d87 s SER 123 Cb -0.11 -1.86 0.00 0.00 0.10 0.00 0.00 66.02 64.16 2d87 s SER 123 CO 0.47 0.08 0.00 0.61 0.98 0.00 0.00 173.24 175.38 2d87 n GLY 124 N -0.32 -0.02 3.57 7.32 0.00 -1.26 -4.91 105.19 109.57 2d87 n GLY 124 Ca -0.07 -2.27 -0.27 0.00 0.00 0.00 0.00 46.02 43.41 2d87 n GLY 124 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d87 s PRO 125 N 0.00 2.53 -0.46 1.61 0.04 -1.26 -4.93 135.00 132.53 2d87 s PRO 125 Ca 0.00 -0.66 -0.24 0.00 0.04 0.00 0.00 61.00 60.14 2d87 s PRO 125 Cb 0.00 -5.14 0.03 0.00 0.04 0.00 0.00 34.50 29.43 2d87 s PRO 125 CO 0.00 -3.64 0.84 0.45 0.04 0.00 0.00 177.00 174.69 2d87 s SER 126 N 7.39 6.43 -0.73 6.66 0.15 -1.26 -4.95 113.70 127.40 2d87 s SER 126 Ca 0.69 -0.06 -0.37 0.00 0.70 0.00 0.00 55.95 56.92 2d87 s SER 126 Cb -0.04 -2.41 -0.19 0.00 -1.71 0.00 0.00 66.02 61.66 2d87 s SER 126 CO 0.05 -0.98 2.42 -0.24 1.20 0.00 0.00 173.24 175.69 2d87 n SER 127 N 6.92 0.68 0.00 5.45 2.88 -1.26 -5.24 113.62 123.04 2d87 n SER 127 Ca 0.03 0.38 0.00 0.00 -1.33 0.00 0.00 58.87 57.96 2d87 n SER 127 Cb 0.48 -0.96 0.00 0.00 -0.75 0.00 0.00 64.21 62.98 2d87 n SER 127 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42