#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d87 s SER 2 N 0.00 6.14 0.71 1.61 0.01 -1.26 -5.12 113.70 115.79 2d87 s SER 2 Ca 0.00 0.08 -0.01 0.00 1.31 0.00 0.00 55.95 57.32 2d87 s SER 2 Cb 0.00 -1.79 0.12 0.00 0.21 0.00 0.00 66.02 64.56 2d87 s SER 2 CO 0.00 0.04 0.99 -0.44 0.41 0.00 0.00 173.24 174.23 2d87 s SER 3 N -3.33 4.40 -0.02 2.44 0.01 -1.26 -4.94 113.70 111.01 2d87 s SER 3 Ca 0.34 -0.27 -0.02 0.00 1.31 0.00 0.00 55.95 57.31 2d87 s SER 3 Cb -0.10 -0.16 0.01 0.00 0.21 0.00 0.00 66.02 65.97 2d87 s SER 3 CO 0.27 -1.82 0.03 0.61 0.41 0.00 0.00 173.24 172.74 2d87 n GLY 4 N -2.83 -3.60 0.31 3.44 0.00 -1.26 -4.95 105.19 96.29 2d87 n GLY 4 Ca 0.14 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 2d87 n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2d87 h SER 5 N 1.12 -0.61 -2.28 1.61 0.87 -2.08 -3.44 113.55 108.74 2d87 h SER 5 Ca -0.07 -0.03 -0.54 0.00 -1.23 0.00 0.00 61.79 59.92 2d87 h SER 5 Cb 0.16 0.16 -0.07 0.00 -0.44 0.00 0.00 62.40 62.20 2d87 h SER 5 CO 0.00 -0.34 -0.59 -0.55 -0.53 0.00 0.00 176.83 174.82 2d87 s SER 6 N -4.65 5.03 -0.22 6.23 0.15 -1.26 -5.12 113.70 113.86 2d87 s SER 6 Ca -0.16 -0.43 -0.04 0.00 0.70 0.00 0.00 55.95 56.02 2d87 s SER 6 Cb 0.03 -1.13 0.11 0.00 -1.71 0.00 0.00 66.02 63.33 2d87 s SER 6 CO 0.57 -0.01 0.35 -0.83 1.20 0.00 0.00 173.24 174.53 2d87 s GLY 7 N -3.66 -0.32 0.40 9.45 0.00 -1.26 -5.01 107.32 106.92 2d87 s GLY 7 Ca 0.32 0.94 0.10 0.00 0.00 0.00 0.00 44.72 46.07 2d87 s GLY 7 CO 0.22 2.47 1.96 -2.22 0.00 0.00 0.00 173.10 175.54 2d87 h ILE 8 N 6.21 1.15 0.00 0.90 2.04 -2.00 -1.70 117.51 124.11 2d87 h ILE 8 Ca -0.18 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.08 2d87 h ILE 8 Cb 1.14 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2d87 h ILE 8 CO 0.23 0.19 0.10 0.50 0.00 0.00 0.00 178.15 179.17 2d87 h LYS 9 N 0.26 0.00 0.00 2.37 1.63 -2.00 -1.47 116.57 117.36 2d87 h LYS 9 Ca 0.06 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 2d87 h LYS 9 Cb 0.26 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.89 2d87 h LYS 9 CO 0.01 0.00 -0.25 0.37 -3.45 0.00 0.00 179.45 176.13 2d87 h GLN 10 N 0.00 0.00 -0.91 1.90 5.75 -1.74 -3.28 115.11 116.83 2d87 h GLN 10 Ca 0.00 0.00 0.26 0.00 -0.15 0.00 0.00 58.65 58.76 2d87 h GLN 10 Cb 0.19 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.71 2d87 h GLN 10 CO 0.00 0.00 0.67 0.00 -2.65 0.00 0.00 178.83 176.85 2d87 h MET 11 N -0.82 0.00 -0.17 1.69 -0.00 -1.52 0.69 114.93 114.80 2d87 h MET 11 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 59.68 2d87 h MET 11 Cb 0.25 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.84 2d87 h MET 11 CO 0.00 0.00 0.01 -0.07 -0.00 0.00 0.00 176.91 176.85 2d87 h LEU 12 N 0.00 0.28 -0.29 -0.10 3.38 -1.42 0.39 115.31 117.54 2d87 h LEU 12 Ca 0.43 -0.29 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 2d87 h LEU 12 Cb 1.76 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.43 2d87 h LEU 12 CO -0.00 0.50 -0.12 0.25 0.09 0.00 0.00 178.44 179.15 2d87 h LEU 13 N 0.05 0.61 -1.53 1.67 5.85 -0.98 -1.80 115.31 119.18 2d87 h LEU 13 Ca 0.05 -0.40 -0.05 0.00 0.84 0.00 0.00 57.88 58.32 2d87 h LEU 13 Cb 0.35 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 2d87 h LEU 13 CO 0.01 0.87 -0.24 -0.78 -0.34 0.00 0.00 178.44 177.96 2d87 h ASP 14 N 0.35 0.00 0.26 1.25 1.82 -1.18 -3.13 116.42 115.79 2d87 h ASP 14 Ca 0.07 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.69 2d87 h ASP 14 Cb 0.63 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.64 2d87 h ASP 14 CO 0.04 0.24 -0.12 -0.25 -1.61 0.00 0.00 179.24 177.53 2d87 h TRP 15 N 0.00 -0.32 -0.95 0.28 7.01 -0.73 -3.09 115.95 118.14 2d87 h TRP 15 Ca -0.00 -0.01 0.24 0.00 2.11 0.00 0.00 58.89 61.23 2d87 h TRP 15 Cb 0.43 0.11 -0.18 0.00 -2.10 0.00 0.00 29.16 27.41 2d87 h TRP 15 CO 0.00 -0.03 -0.05 0.00 -2.79 0.00 0.00 178.44 175.57 2d87 h ARG 17 N 0.00 -0.01 -1.18 0.00 3.08 -1.62 0.19 114.38 114.84 2d87 h ARG 17 Ca 0.55 0.00 0.34 0.00 0.07 0.00 0.00 59.98 60.93 2d87 h ARG 17 Cb 1.06 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 31.03 2d87 h ARG 17 CO -0.92 -0.00 0.80 0.00 -1.07 0.00 0.00 179.97 178.77 2d87 h ALA 18 N 1.00 2.71 0.00 0.04 0.00 0.15 0.84 119.26 124.01 2d87 h ALA 18 Ca 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2d87 h ALA 18 Cb 0.01 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2d87 h ALA 18 CO -0.01 -1.14 -1.38 1.63 0.00 0.00 0.00 179.25 178.35 2d87 n LYS 19 N -4.44 0.62 -0.90 0.00 4.76 -0.83 -4.03 118.16 113.34 2d87 n LYS 19 Ca 0.28 0.08 -0.05 0.00 -2.87 0.00 0.00 58.31 55.75 2d87 n LYS 19 Cb 1.15 -1.75 0.26 0.00 -1.84 0.00 0.00 35.03 32.85 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 -2.66 2.78 -2.43 -0.18 -1.04 0.24 -4.78 114.28 106.21 2d87 n THR 20 Ca -0.05 -1.97 -0.42 0.00 -2.04 0.00 0.00 64.05 59.56 2d87 n THR 20 Cb 0.66 -0.35 -0.03 0.00 -1.82 0.00 0.00 70.33 68.80 2d87 n THR 20 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2d87 s ARG 21 N -3.07 4.38 0.00 -2.82 0.52 0.17 -3.36 118.95 114.78 2d87 s ARG 21 Ca 0.51 1.73 0.00 0.00 -0.52 0.00 0.00 55.73 57.45 2d87 s ARG 21 Cb 0.42 -3.47 0.00 0.00 0.52 0.00 0.00 34.95 32.42 2d87 s ARG 21 CO 0.09 -0.37 0.00 0.41 0.02 0.00 0.00 175.30 175.45 2d87 n GLY 22 N 3.32 3.08 2.95 -3.53 0.00 -1.26 -5.03 105.19 104.72 2d87 n GLY 22 Ca 0.10 -0.86 -0.50 0.00 0.00 0.00 0.00 46.02 44.76 2d87 n GLY 22 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2d87 n TYR 23 N 0.00 0.62 -2.05 1.61 4.02 -1.21 -4.90 117.16 115.25 2d87 n TYR 23 Ca 0.00 0.90 -0.30 0.00 -0.01 0.00 0.00 57.90 58.49 2d87 n TYR 23 Cb 0.00 -1.76 0.03 0.00 -0.02 0.00 0.00 39.34 37.58 2d87 n TYR 23 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 2d87 s GLU 24 N 0.22 3.20 -0.59 -0.72 2.12 -1.26 -3.84 118.70 117.83 2d87 s GLU 24 Ca 0.77 0.46 -0.01 0.00 0.36 0.00 0.00 54.97 56.54 2d87 s GLU 24 Cb -1.08 -2.12 0.01 0.00 0.26 0.00 0.00 34.13 31.20 2d87 s GLU 24 CO 0.50 -0.73 0.06 -2.39 -0.54 0.00 0.00 175.26 172.15 2d87 n HIS 25 N -2.77 -1.72 -3.92 5.30 1.44 -1.26 -4.89 115.22 107.40 2d87 n HIS 25 Ca 0.05 0.06 -0.10 0.00 -2.01 0.00 0.00 57.72 55.72 2d87 n HIS 25 Cb 0.56 -1.90 -0.12 0.00 0.12 0.00 0.00 29.99 28.65 2d87 n HIS 25 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2d87 s VAL 26 N -2.36 0.07 -0.30 0.61 1.01 -1.25 -4.93 120.40 113.25 2d87 s VAL 26 Ca 0.06 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 2d87 s VAL 26 Cb -0.03 -0.22 0.18 0.00 0.00 0.00 0.00 36.38 36.31 2d87 s VAL 26 CO 0.07 -0.32 0.90 -0.62 0.00 0.00 0.00 175.10 175.13 2d87 s ASP 27 N -0.97 -0.77 -0.40 3.32 2.15 -1.26 -4.91 116.67 113.84 2d87 s ASP 27 Ca -0.11 0.45 -0.25 0.00 0.43 0.00 0.00 52.55 53.07 2d87 s ASP 27 Cb -0.06 1.63 0.02 0.00 -0.30 0.00 0.00 42.92 44.20 2d87 s ASP 27 CO -0.00 -0.14 0.91 -0.63 -0.17 0.00 0.00 175.17 175.13 2d87 s ILE 28 N 2.92 4.57 0.00 4.11 1.01 -1.26 -4.80 121.20 127.74 2d87 s ILE 28 Ca 0.07 1.02 0.00 0.00 0.00 0.00 0.00 60.65 61.75 2d87 s ILE 28 Cb -0.11 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 38.01 2d87 s ILE 28 CO -0.15 -0.62 0.00 1.67 0.00 0.00 0.00 174.94 175.84 2d87 n GLN 29 N 6.86 2.70 -3.57 2.79 7.27 -1.26 -4.91 117.38 127.26 2d87 n GLN 29 Ca 0.06 0.00 -0.09 0.00 0.07 0.00 0.00 57.00 57.05 2d87 n GLN 29 Cb 0.48 -0.87 -0.04 0.00 2.41 0.00 0.00 30.24 32.22 2d87 n GLN 29 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2d87 s ASN 30 N -2.30 -0.31 -0.17 1.69 6.03 -1.26 -5.03 114.94 113.59 2d87 s ASN 30 Ca 0.00 0.25 -0.01 0.00 -1.03 0.00 0.00 52.86 52.07 2d87 s ASN 30 Cb 0.00 0.28 0.10 0.00 -3.03 0.00 0.00 41.25 38.59 2d87 s ASN 30 CO 0.00 -0.36 2.10 0.49 -2.03 0.00 0.00 177.10 177.30 2d87 n PHE 31 N 0.43 0.80 -0.03 1.54 3.72 -1.26 -3.40 117.46 119.26 2d87 n PHE 31 Ca -0.08 -1.52 -0.04 0.00 -0.05 0.00 0.00 57.45 55.77 2d87 n PHE 31 Cb 0.59 -0.79 -0.01 0.00 -0.94 0.00 0.00 39.48 38.32 2d87 n PHE 31 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2d87 n SER 32 N 0.96 0.88 0.00 4.37 7.64 -1.26 -3.25 113.62 122.96 2d87 n SER 32 Ca 0.18 0.14 0.00 0.00 1.01 0.00 0.00 58.87 60.20 2d87 n SER 32 Cb 0.55 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 2d87 n SER 32 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2d87 n SER 33 N -3.38 0.28 0.18 6.43 3.41 -1.26 -3.54 113.62 115.73 2d87 n SER 33 Ca -0.06 -0.40 0.12 0.00 -0.26 0.00 0.00 58.87 58.28 2d87 n SER 33 Cb 0.21 0.85 0.63 0.00 -0.26 0.00 0.00 64.21 65.64 2d87 n SER 33 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2d87 h SER 34 N 0.00 0.00 0.00 4.04 0.87 -1.89 -0.79 113.55 115.78 2d87 h SER 34 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2d87 h SER 34 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2d87 h SER 34 CO 0.00 0.00 -0.25 0.79 -0.53 0.00 0.00 176.83 176.84 2d87 n TRP 35 N -2.34 0.00 0.09 2.24 7.02 -1.26 -4.53 117.44 118.66 2d87 n TRP 35 Ca -0.01 -0.99 0.11 0.00 -1.02 0.00 0.00 57.50 55.59 2d87 n TRP 35 Cb 0.07 -0.17 -0.05 0.00 -2.42 0.00 0.00 31.31 28.74 2d87 n TRP 35 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2d87 n SER 36 N -1.08 0.56 0.12 -0.99 3.41 -0.30 -4.22 113.62 111.13 2d87 n SER 36 Ca 0.14 0.19 -0.24 0.00 -0.26 0.00 0.00 58.87 58.71 2d87 n SER 36 Cb 0.69 0.96 -0.16 0.00 -0.26 0.00 0.00 64.21 65.45 2d87 n SER 36 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2d87 h ASP 37 N 0.00 0.74 0.00 4.04 3.58 -1.83 -3.48 116.42 119.47 2d87 h ASP 37 Ca 0.00 -0.93 0.00 0.00 0.42 0.00 0.00 57.03 56.52 2d87 h ASP 37 Cb 0.98 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.79 2d87 h ASP 37 CO 0.00 1.63 0.00 0.61 -2.88 0.00 0.00 179.24 178.60 2d87 n GLY 38 N 1.71 3.35 0.27 -0.78 0.00 -1.26 -4.59 105.19 103.89 2d87 n GLY 38 Ca -0.16 -0.99 0.04 0.00 0.00 0.00 0.00 46.02 44.91 2d87 n GLY 38 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2d87 h MET 39 N 0.00 0.09 0.00 1.61 2.86 -1.89 -2.61 114.93 114.99 2d87 h MET 39 Ca 0.00 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2d87 h MET 39 Cb 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2d87 h MET 39 CO 0.00 0.06 0.00 0.00 1.06 0.00 0.00 176.91 178.03 2d87 n ALA 40 N -2.95 0.00 -0.32 6.32 0.00 -1.26 -0.75 120.51 121.55 2d87 n ALA 40 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.45 2d87 n ALA 40 Cb 0.45 0.42 -0.10 0.00 0.00 0.00 0.00 19.45 20.22 2d87 n ALA 40 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2d87 h PHE 41 N 0.00 -1.83 -0.30 0.00 0.04 -1.78 -1.80 116.94 111.28 2d87 h PHE 41 Ca 0.00 0.11 0.03 0.00 2.80 0.00 0.00 57.97 60.91 2d87 h PHE 41 Cb 0.00 0.90 -0.05 0.00 2.20 0.00 0.00 35.95 39.00 2d87 h PHE 41 CO -0.76 -0.42 -0.30 0.00 -0.60 0.00 0.00 178.31 176.24 2d87 n ALA 43 N -2.96 -0.29 -0.34 0.00 0.00 0.07 0.20 120.51 117.19 2d87 n ALA 43 Ca -0.01 0.39 0.15 0.00 0.00 0.00 0.00 53.44 53.97 2d87 n ALA 43 Cb 0.17 0.18 0.30 0.00 0.00 0.00 0.00 19.45 20.10 2d87 n ALA 43 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2d87 n LEU 44 N -4.02 -0.09 0.18 0.00 7.94 -0.86 -1.37 117.00 118.79 2d87 n LEU 44 Ca 0.01 1.66 -0.08 0.00 -1.11 0.00 0.00 56.01 56.49 2d87 n LEU 44 Cb 0.12 -0.61 -0.04 0.00 0.53 0.00 0.00 43.42 43.42 2d87 n LEU 44 CO -0.07 -1.69 0.26 0.58 -1.11 0.00 0.00 177.39 175.36 2d87 h VAL 45 N 0.00 0.00 -0.74 1.96 2.07 0.31 -3.25 116.25 116.60 2d87 h VAL 45 Ca 0.60 -0.38 0.27 0.00 0.82 0.00 0.00 66.70 68.01 2d87 h VAL 45 Cb 1.27 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.90 2d87 h VAL 45 CO -0.91 0.00 0.24 1.57 0.02 0.00 0.00 177.57 178.49 2d87 n HIS 46 N -4.44 0.70 -0.19 1.57 -0.00 0.11 0.16 115.22 113.13 2d87 n HIS 46 Ca -0.06 0.88 -0.01 0.00 -0.00 0.00 0.00 57.72 58.52 2d87 n HIS 46 Cb 0.20 -1.20 0.07 0.00 -0.00 0.00 0.00 29.99 29.07 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 -0.38 0.51 0.26 -1.24 -1.25 0.13 115.58 113.61 2d87 h ASN 47 Ca 0.55 0.15 -0.03 0.00 0.71 0.00 0.00 56.30 57.69 2d87 h ASN 47 Cb 1.35 0.30 0.01 0.00 0.73 0.00 0.00 38.32 40.71 2d87 h ASN 47 CO -0.62 -0.14 -0.25 -0.26 -1.29 0.00 0.00 177.43 174.87 2d87 h PHE 48 N 0.06 -0.64 -3.22 0.67 0.04 0.14 -3.40 116.94 110.60 2d87 h PHE 48 Ca 0.29 -0.02 -0.63 0.00 2.80 0.00 0.00 57.97 60.41 2d87 h PHE 48 Cb 0.45 0.21 -0.41 0.00 2.20 0.00 0.00 35.95 38.40 2d87 h PHE 48 CO -0.40 -0.38 -0.63 -0.06 -0.60 0.00 0.00 178.31 176.24 2d87 s PHE 49 N -3.88 3.14 0.15 -0.55 0.40 -0.93 -4.94 117.98 111.37 2d87 s PHE 49 Ca -0.11 -3.14 -0.10 0.00 -0.60 0.00 0.00 56.93 52.98 2d87 s PHE 49 Cb 0.01 -2.64 -0.03 0.00 0.51 0.00 0.00 43.02 40.87 2d87 s PHE 49 CO 0.33 -0.68 1.48 -1.00 0.70 0.00 0.00 175.22 176.04 2d87 h PRO 50 N 6.13 0.93 0.00 0.24 0.13 -0.97 -3.03 132.00 135.43 2d87 h PRO 50 Ca 0.01 -0.49 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 2d87 h PRO 50 Cb 0.85 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 2d87 h PRO 50 CO 0.67 1.14 -0.24 1.05 -0.23 0.00 0.00 178.00 180.40 2d87 h GLU 51 N 0.76 0.00 -0.96 0.86 4.11 -1.92 -2.76 114.58 114.67 2d87 h GLU 51 Ca 0.06 0.00 0.14 0.00 0.07 0.00 0.00 59.36 59.63 2d87 h GLU 51 Cb 0.98 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.15 2d87 h GLU 51 CO 0.10 0.24 0.61 0.00 0.07 0.00 0.00 179.01 180.02 2d87 h ALA 52 N 1.76 1.67 -2.80 1.06 0.00 -1.91 -3.44 119.26 115.60 2d87 h ALA 52 Ca -0.00 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2d87 h ALA 52 Cb 0.48 -0.16 -0.13 0.00 0.00 0.00 0.00 17.79 17.97 2d87 h ALA 52 CO 0.03 0.07 0.20 -0.59 0.00 0.00 0.00 179.25 178.96 2d87 s PHE 53 N -5.83 -0.55 -0.07 0.00 -0.71 -1.04 -4.95 117.98 104.83 2d87 s PHE 53 Ca -0.11 0.47 -0.20 0.00 -1.04 0.00 0.00 56.93 56.05 2d87 s PHE 53 Cb 0.22 0.52 -0.04 0.00 -1.21 0.00 0.00 43.02 42.51 2d87 s PHE 53 CO 0.80 -0.80 0.57 -0.51 -1.34 0.00 0.00 175.22 173.94 2d87 s ASP 54 N -2.45 6.85 -0.09 1.98 1.11 -1.26 -4.73 116.67 118.09 2d87 s ASP 54 Ca -0.01 1.02 -0.03 0.00 0.18 0.00 0.00 52.55 53.70 2d87 s ASP 54 Cb -0.01 -2.34 -0.01 0.00 1.07 0.00 0.00 42.92 41.63 2d87 s ASP 54 CO -0.09 0.00 -0.06 0.22 1.18 0.00 0.00 175.17 176.43 2d87 h TYR 55 N 6.39 0.00 0.00 4.23 3.20 -1.97 -3.35 116.97 125.47 2d87 h TYR 55 Ca -0.42 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.45 2d87 h TYR 55 Cb 1.19 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.46 2d87 h TYR 55 CO 0.64 0.00 0.17 0.78 -1.64 0.00 0.00 178.16 178.11 2d87 h GLY 56 N -0.72 0.00 1.42 1.82 0.00 -2.02 0.02 103.07 103.59 2d87 h GLY 56 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 2d87 h GLY 56 CO 0.00 0.00 -0.59 1.46 0.00 0.00 0.00 176.54 177.41 2d87 h GLN 57 N 0.00 0.61 -7.39 4.80 1.08 -1.99 -3.45 115.11 108.77 2d87 h GLN 57 Ca 0.00 -0.40 -0.46 0.00 -1.45 0.00 0.00 58.65 56.34 2d87 h GLN 57 Cb 0.34 0.06 0.15 0.00 -0.05 0.00 0.00 27.48 27.97 2d87 h GLN 57 CO 0.00 1.02 0.23 -0.51 -0.95 0.00 0.00 178.83 178.62 2d87 s LEU 58 N -8.35 1.78 0.11 1.46 1.43 -0.01 -5.08 118.68 110.01 2d87 s LEU 58 Ca -0.08 1.15 0.06 0.00 -1.03 0.00 0.00 54.13 54.24 2d87 s LEU 58 Cb 0.11 -3.40 -0.03 0.00 0.03 0.00 0.00 46.19 42.89 2d87 s LEU 58 CO 0.85 -2.92 -0.16 -0.44 0.23 0.00 0.00 176.35 173.92 2d87 s SER 59 N -3.62 2.06 0.34 2.29 0.01 -1.26 -5.04 113.70 108.48 2d87 s SER 59 Ca 0.65 -0.73 0.13 0.00 1.31 0.00 0.00 55.95 57.30 2d87 s SER 59 Cb -0.17 -0.08 0.59 0.00 0.21 0.00 0.00 66.02 66.56 2d87 s SER 59 CO 0.56 -0.08 1.74 1.55 0.41 0.00 0.00 173.24 177.43 2d87 h PRO 60 N 3.83 0.00 -0.06 12.44 0.13 -1.98 -2.93 132.00 143.43 2d87 h PRO 60 Ca -0.42 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.66 2d87 h PRO 60 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2d87 h PRO 60 CO 0.45 0.46 -0.20 0.37 -0.23 0.00 0.00 178.00 178.86 2d87 h GLN 61 N 0.00 0.10 -6.54 0.86 4.15 -1.96 -3.41 115.11 108.30 2d87 h GLN 61 Ca -0.00 -0.02 -0.57 0.00 0.77 0.00 0.00 58.65 58.83 2d87 h GLN 61 Cb 0.84 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.47 2d87 h GLN 61 CO 0.06 0.30 1.04 -0.80 -1.93 0.00 0.00 178.83 177.50 2d87 s ASN 62 N -6.94 6.42 0.06 -0.69 0.01 -1.11 -4.87 114.94 107.82 2d87 s ASN 62 Ca -0.04 0.81 0.09 0.00 -0.71 0.00 0.00 52.86 53.00 2d87 s ASN 62 Cb 0.15 -2.54 -0.22 0.00 0.41 0.00 0.00 41.25 39.05 2d87 s ASN 62 CO 0.72 -1.37 1.04 0.03 -1.51 0.00 0.00 177.10 176.01 2d87 h ARG 63 N 10.31 0.01 0.00 -0.60 3.08 -1.81 -3.30 114.38 122.08 2d87 h ARG 63 Ca -0.27 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.76 2d87 h ARG 63 Cb 1.10 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.15 2d87 h ARG 63 CO 1.09 0.83 -0.16 0.00 -1.07 0.00 0.00 179.97 180.65 2d87 h ARG 64 N 0.00 0.00 -0.87 0.04 3.08 -1.92 -3.30 114.38 111.42 2d87 h ARG 64 Ca -0.12 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.06 2d87 h ARG 64 Cb 1.87 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.78 2d87 h ARG 64 CO 0.11 0.00 -0.37 0.94 -1.07 0.00 0.00 179.97 179.59 2d87 n GLN 65 N -3.60 -0.23 -0.18 0.04 -0.06 -1.26 0.81 117.38 112.90 2d87 n GLN 65 Ca -0.02 1.33 -0.01 0.00 -2.00 0.00 0.00 57.00 56.30 2d87 n GLN 65 Cb 0.08 -1.97 0.07 0.00 -4.06 0.00 0.00 30.24 24.36 2d87 n GLN 65 CO 0.00 0.00 0.00 -0.91 -0.20 0.00 0.00 177.06 175.95 2d87 h ASN 66 N 0.00 -0.29 0.13 1.69 2.35 -1.76 0.50 115.58 118.20 2d87 h ASN 66 Ca 0.28 0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 56.16 2d87 h ASN 66 Cb 0.49 0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.12 2d87 h ASN 66 CO -0.85 -0.11 -0.06 -0.26 -1.65 0.00 0.00 177.43 174.49 2d87 h PHE 67 N 0.09 -0.17 -0.18 1.19 -1.00 0.32 -2.51 116.94 114.69 2d87 h PHE 67 Ca 0.28 -0.00 0.02 0.00 2.81 0.00 0.00 57.97 61.07 2d87 h PHE 67 Cb 0.43 0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.03 2d87 h PHE 67 CO -0.36 -0.10 -0.11 0.93 -1.61 0.00 0.00 178.31 177.06 2d87 h GLU 68 N -0.26 -0.01 -0.88 1.51 4.39 -0.42 0.10 114.58 119.01 2d87 h GLU 68 Ca -0.02 0.00 0.19 0.00 0.34 0.00 0.00 59.36 59.87 2d87 h GLU 68 Cb 0.14 0.00 -0.17 0.00 -0.10 0.00 0.00 28.75 28.62 2d87 h GLU 68 CO 0.03 -0.00 -0.17 0.28 -1.16 0.00 0.00 179.01 177.98 2d87 h VAL 69 N -0.01 0.13 -0.90 3.13 2.07 -1.04 0.89 116.25 120.53 2d87 h VAL 69 Ca 0.03 -0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.65 2d87 h VAL 69 Cb 0.08 0.12 -0.07 0.00 -1.52 0.00 0.00 31.29 29.90 2d87 h VAL 69 CO -0.17 0.00 0.58 0.00 0.02 0.00 0.00 177.57 178.00 2d87 h ALA 70 N 1.88 1.66 0.09 1.67 0.00 -0.42 0.35 119.26 124.49 2d87 h ALA 70 Ca 0.44 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 2d87 h ALA 70 Cb 0.71 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2d87 h ALA 70 CO -0.89 0.15 -0.04 0.74 0.00 0.00 0.00 179.25 179.21 2d87 h PHE 71 N 0.86 -0.11 0.50 0.00 0.04 0.26 -3.30 116.94 115.18 2d87 h PHE 71 Ca 0.42 -0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.17 2d87 h PHE 71 Cb 0.45 0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.63 2d87 h PHE 71 CO -0.00 0.42 -0.35 0.66 -0.60 0.00 0.00 178.31 178.43 2d87 h SER 72 N -0.85 -0.91 -1.21 2.17 4.64 -0.30 -2.08 113.55 115.01 2d87 h SER 72 Ca -0.01 0.06 0.41 0.00 -0.47 0.00 0.00 61.79 61.78 2d87 h SER 72 Cb 0.58 0.28 -0.12 0.00 -0.31 0.00 0.00 62.40 62.84 2d87 h SER 72 CO 0.02 -0.53 0.78 -1.20 -0.87 0.00 0.00 176.83 175.03 2d87 n SER 73 N -5.48 0.17 0.01 4.97 7.64 0.12 -0.33 113.62 120.72 2d87 n SER 73 Ca -0.11 1.17 -0.02 0.00 1.01 0.00 0.00 58.87 60.92 2d87 n SER 73 Cb 0.37 -0.58 -0.01 0.00 -1.01 0.00 0.00 64.21 62.99 2d87 n SER 73 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d87 h ALA 74 N 1.34 -0.13 -0.93 -0.43 0.00 -1.48 -3.29 119.26 114.34 2d87 h ALA 74 Ca 0.76 -0.03 0.27 0.00 0.00 0.00 0.00 54.91 55.91 2d87 h ALA 74 Cb 2.48 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 20.28 2d87 h ALA 74 CO -0.38 -0.12 0.99 1.49 0.00 0.00 0.00 179.25 181.23 2d87 h GLU 75 N -0.99 0.00 0.00 0.00 4.81 -0.10 0.42 114.58 118.72 2d87 h GLU 75 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2d87 h GLU 75 Cb 0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.47 2d87 h GLU 75 CO 0.02 0.00 0.00 2.41 -0.73 0.00 0.00 179.01 180.71 2d87 n THR 76 N -3.48 0.00 0.18 0.32 -1.04 -0.23 -1.92 114.28 108.11 2d87 n THR 76 Ca 0.20 1.34 0.04 0.00 -2.04 0.00 0.00 64.05 63.59 2d87 n THR 76 Cb 1.28 -1.92 -0.06 0.00 -1.82 0.00 0.00 70.33 67.81 2d87 n THR 76 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2d87 n HIS 77 N -2.20 0.00 0.59 -1.42 1.44 -0.97 -4.49 115.22 108.17 2d87 n HIS 77 Ca 0.00 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.83 2d87 n HIS 77 Cb 0.00 -0.10 0.18 0.00 0.12 0.00 0.00 29.99 30.19 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 -1.51 2.92 -4.20 1.59 0.00 0.14 -4.95 120.51 114.50 2d87 n ALA 78 Ca -0.00 -0.24 -0.32 0.00 0.00 0.00 0.00 53.44 52.88 2d87 n ALA 78 Cb 0.18 -1.18 -0.09 0.00 0.00 0.00 0.00 19.45 18.36 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 -2.09 0.09 -4.77 0.00 2.03 -0.81 -4.82 116.55 106.18 2d87 n ASP 79 Ca 0.03 -1.16 -0.39 0.00 0.52 0.00 0.00 54.79 53.79 2d87 n ASP 79 Cb 0.44 -1.46 -0.06 0.00 -0.72 0.00 0.00 41.12 39.32 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 -1.27 4.36 -0.72 0.00 0.04 -1.26 -4.54 135.00 131.61 2d87 s PRO 81 Ca 0.38 2.04 -0.23 0.00 0.04 0.00 0.00 61.00 63.23 2d87 s PRO 81 Cb -0.23 -3.23 0.06 0.00 0.04 0.00 0.00 34.50 31.14 2d87 s PRO 81 CO 0.27 -0.33 1.09 -0.65 0.04 0.00 0.00 177.00 177.42 2d87 s GLN 82 N 0.49 3.20 -0.14 4.56 -0.21 -1.26 -4.86 119.66 121.44 2d87 s GLN 82 Ca 0.60 -0.77 -0.09 0.00 0.02 0.00 0.00 55.36 55.13 2d87 s GLN 82 Cb -0.36 -4.34 -0.05 0.00 1.00 0.00 0.00 33.01 29.27 2d87 s GLN 82 CO 0.34 -1.92 -0.06 -0.07 -2.12 0.00 0.00 175.29 171.46 2d87 h LEU 83 N 11.80 0.00 -9.62 2.90 3.38 -2.01 -3.47 115.31 118.29 2d87 h LEU 83 Ca -0.22 -0.09 -0.58 0.00 0.09 0.00 0.00 57.88 57.09 2d87 h LEU 83 Cb 1.06 0.00 0.17 0.00 0.09 0.00 0.00 40.66 41.98 2d87 h LEU 83 CO 1.22 0.76 -0.25 0.18 0.09 0.00 0.00 178.44 180.44 2d87 n LEU 84 N -4.64 1.61 -4.16 1.67 4.77 -1.26 -4.93 117.00 110.05 2d87 n LEU 84 Ca -0.08 0.73 -0.38 0.00 -0.03 0.00 0.00 56.01 56.25 2d87 n LEU 84 Cb 0.24 -1.24 -0.06 0.00 -2.33 0.00 0.00 43.42 40.03 2d87 n LEU 84 CO 0.09 -2.74 0.35 -1.81 -1.33 0.00 0.00 177.39 171.95 2d87 s ASP 85 N -1.25 6.08 0.19 -1.43 1.01 -1.26 -4.94 116.67 115.07 2d87 s ASP 85 Ca 0.70 -3.42 -0.07 0.00 0.71 0.00 0.00 52.55 50.48 2d87 s ASP 85 Cb -0.42 -1.97 0.29 0.00 1.01 0.00 0.00 42.92 41.83 2d87 s ASP 85 CO 0.53 -0.28 1.09 0.41 0.21 0.00 0.00 175.17 177.13 2d87 n THR 86 N 2.79 -0.31 -0.19 -1.27 -1.04 -1.26 0.17 114.28 113.18 2d87 n THR 86 Ca 0.18 1.61 -0.00 0.00 -2.04 0.00 0.00 64.05 63.80 2d87 n THR 86 Cb 0.38 -2.21 0.08 0.00 -1.82 0.00 0.00 70.33 66.77 2d87 n THR 86 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2d87 h GLU 87 N 0.00 0.11 -0.02 -2.82 5.08 -1.98 0.12 114.58 115.06 2d87 h GLU 87 Ca 0.31 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.51 2d87 h GLU 87 Cb 0.49 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2d87 h GLU 87 CO -0.71 0.07 -0.72 -0.44 -1.00 0.00 0.00 179.01 176.20 2d87 h ASP 88 N 0.11 0.18 -0.70 1.42 3.32 0.14 -3.17 116.42 117.72 2d87 h ASP 88 Ca 0.30 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 2d87 h ASP 88 Cb 0.47 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 2d87 h ASP 88 CO -0.49 0.84 0.30 0.24 -1.72 0.00 0.00 179.24 178.41 2d87 h MET 89 N 0.10 1.06 0.06 3.56 2.86 0.15 -1.41 114.93 121.31 2d87 h MET 89 Ca -0.02 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.44 2d87 h MET 89 Cb 1.28 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.76 2d87 h MET 89 CO 0.11 0.85 -0.03 0.28 1.06 0.00 0.00 176.91 179.18 2d87 h VAL 90 N 1.04 0.00 -0.65 -2.22 2.07 -0.82 -3.19 116.25 112.47 2d87 h VAL 90 Ca 0.24 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.90 2d87 h VAL 90 Cb 0.18 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.85 2d87 h VAL 90 CO -0.02 0.00 0.06 0.08 0.02 0.00 0.00 177.57 177.71 2d87 h ARG 91 N -0.08 0.16 -6.13 1.57 0.11 -1.61 -3.40 114.38 105.01 2d87 h ARG 91 Ca -0.01 -0.01 -0.62 0.00 0.10 0.00 0.00 59.98 59.44 2d87 h ARG 91 Cb 0.06 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.11 2d87 h ARG 91 CO 0.01 0.11 1.28 1.28 0.10 0.00 0.00 179.97 182.75 2d87 n LEU 92 N -5.24 3.06 -0.35 0.08 4.77 -0.53 -4.81 117.00 113.97 2d87 n LEU 92 Ca 0.11 0.64 0.25 0.00 -0.03 0.00 0.00 56.01 56.97 2d87 n LEU 92 Cb 0.38 -1.39 0.51 0.00 -2.33 0.00 0.00 43.42 40.60 2d87 n LEU 92 CO 0.11 -0.38 1.20 0.03 -1.33 0.00 0.00 177.39 177.02 2d87 h ARG 93 N 11.46 0.35 -3.65 3.23 3.08 -1.83 -3.40 114.38 123.62 2d87 h ARG 93 Ca -0.41 -0.02 -0.21 0.00 0.07 0.00 0.00 59.98 59.41 2d87 h ARG 93 Cb 1.28 -0.08 -0.26 0.00 0.08 0.00 0.00 29.97 30.98 2d87 h ARG 93 CO 0.97 0.23 -0.66 -1.21 -1.07 0.00 0.00 179.97 178.23 2d87 s GLU 94 N -5.53 0.11 -0.32 0.04 0.41 -1.26 -4.93 118.70 107.22 2d87 s GLU 94 Ca -0.09 -0.03 -0.29 0.00 -0.41 0.00 0.00 54.97 54.16 2d87 s GLU 94 Cb 0.27 0.05 -0.01 0.00 -1.78 0.00 0.00 34.13 32.65 2d87 s GLU 94 CO 0.80 -0.02 1.68 -1.25 -0.49 0.00 0.00 175.26 175.98 2d87 s PRO 95 N -0.21 3.48 -0.50 0.39 0.04 -1.23 -4.89 135.00 132.09 2d87 s PRO 95 Ca -0.02 1.38 -0.38 0.00 0.04 0.00 0.00 61.00 62.02 2d87 s PRO 95 Cb -0.02 -4.13 -0.16 0.00 0.04 0.00 0.00 34.50 30.24 2d87 s PRO 95 CO 0.00 -1.67 2.24 -0.25 0.04 0.00 0.00 177.00 177.36 2d87 n ASP 96 N 9.58 1.36 -0.30 6.66 8.00 -1.26 -4.62 116.55 135.97 2d87 n ASP 96 Ca 0.21 0.44 0.11 0.00 0.71 0.00 0.00 54.79 56.27 2d87 n ASP 96 Cb 0.47 -1.09 0.28 0.00 -0.02 0.00 0.00 41.12 40.76 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 11.34 0.61 -1.21 1.24 5.08 -1.88 0.38 115.95 131.52 2d87 h TRP 97 Ca -0.17 0.04 0.35 0.00 1.08 0.00 0.00 58.89 60.19 2d87 h TRP 97 Cb 1.36 -0.13 -0.05 0.00 -3.00 0.00 0.00 29.16 27.33 2d87 h TRP 97 CO 0.98 -0.02 0.87 0.87 -1.28 0.00 0.00 178.44 179.86 2d87 h LYS 98 N 0.41 0.01 0.00 0.12 1.57 -1.87 -0.13 116.57 116.67 2d87 h LYS 98 Ca 0.53 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.28 2d87 h LYS 98 Cb 0.96 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.27 2d87 h LYS 98 CO -0.51 0.01 -0.58 0.00 -0.57 0.00 0.00 179.45 177.80 2d87 h VAL 100 N -1.00 0.12 -0.81 0.00 2.07 -0.85 0.67 116.25 116.45 2d87 h VAL 100 Ca -0.04 -0.02 0.11 0.00 0.82 0.00 0.00 66.70 67.57 2d87 h VAL 100 Cb 0.59 0.06 -0.08 0.00 -1.52 0.00 0.00 31.29 30.33 2d87 h VAL 100 CO -0.03 0.01 0.44 0.22 0.02 0.00 0.00 177.57 178.23 2d87 h TYR 101 N 0.06 0.78 -0.13 1.57 5.03 -1.23 -2.01 116.97 121.04 2d87 h TYR 101 Ca 0.57 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.95 2d87 h TYR 101 Cb 1.18 -0.23 -0.04 0.00 1.55 0.00 0.00 36.73 39.20 2d87 h TYR 101 CO -0.42 0.27 -0.09 1.15 -1.32 0.00 0.00 178.16 177.75 2d87 h THR 102 N 0.70 0.73 0.36 1.81 2.02 0.21 -2.27 112.91 116.48 2d87 h THR 102 Ca 0.41 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.59 2d87 h THR 102 Cb 0.45 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 2d87 h THR 102 CO -0.29 0.00 -0.50 0.22 0.37 0.00 0.00 175.52 175.32 2d87 h TYR 103 N -0.09 -1.41 -0.88 3.16 3.20 -1.15 0.49 116.97 120.30 2d87 h TYR 103 Ca 0.08 0.02 0.23 0.00 3.14 0.00 0.00 58.73 62.20 2d87 h TYR 103 Cb 0.21 0.57 -0.15 0.00 1.54 0.00 0.00 36.73 38.90 2d87 h TYR 103 CO -0.22 -0.63 0.11 0.82 -1.64 0.00 0.00 178.16 176.60 2d87 h ILE 104 N -0.90 0.23 -0.37 1.81 1.08 -1.31 0.70 117.51 118.75 2d87 h ILE 104 Ca -0.04 -0.04 -0.10 0.00 -0.39 0.00 0.00 64.86 64.29 2d87 h ILE 104 Cb 0.82 0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 34.66 2d87 h ILE 104 CO -0.14 0.02 -0.17 -0.61 -0.69 0.00 0.00 178.15 176.55 2d87 h GLN 105 N 0.12 0.70 0.48 2.37 5.75 -0.81 -1.95 115.11 121.76 2d87 h GLN 105 Ca 0.53 -0.25 -0.02 0.00 -0.15 0.00 0.00 58.65 58.76 2d87 h GLN 105 Cb 1.05 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.56 2d87 h GLN 105 CO -0.74 0.83 -0.23 1.49 -2.65 0.00 0.00 178.83 177.53 2d87 h GLU 106 N 0.62 -0.62 -0.77 1.69 4.57 0.25 -3.23 114.58 117.09 2d87 h GLU 106 Ca 0.10 0.04 0.13 0.00 -1.18 0.00 0.00 59.36 58.45 2d87 h GLU 106 Cb 0.64 0.14 -0.09 0.00 -0.16 0.00 0.00 28.75 29.29 2d87 h GLU 106 CO 0.05 -0.32 0.36 0.35 -1.18 0.00 0.00 179.01 178.26 2d87 h PHE 107 N -1.03 0.63 0.00 0.92 3.57 -0.58 0.30 116.94 120.75 2d87 h PHE 107 Ca -0.07 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.47 2d87 h PHE 107 Cb 0.58 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.16 2d87 h PHE 107 CO 0.01 0.15 0.23 -0.92 -2.23 0.00 0.00 178.31 175.55 2d87 h TYR 108 N 0.55 0.00 0.13 0.41 5.03 -1.37 0.25 116.97 121.97 2d87 h TYR 108 Ca 0.41 0.00 -0.32 0.00 2.58 0.00 0.00 58.73 61.40 2d87 h TYR 108 Cb 0.55 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.82 2d87 h TYR 108 CO -0.12 0.00 -1.60 -0.09 -1.32 0.00 0.00 178.16 175.03 2d87 h ARG 109 N 0.00 0.28 -0.08 1.82 2.43 -0.42 -3.24 114.38 115.17 2d87 h ARG 109 Ca 0.00 -0.47 -0.13 0.00 -0.81 0.00 0.00 59.98 58.57 2d87 h ARG 109 Cb 0.45 0.18 0.01 0.00 -0.42 0.00 0.00 29.97 30.18 2d87 h ARG 109 CO 0.00 1.14 -0.44 0.00 -1.51 0.00 0.00 179.97 179.16 2d87 h LEU 111 N -0.01 -0.33 -0.76 0.00 3.38 -1.52 0.20 115.31 116.28 2d87 h LEU 111 Ca -0.03 0.08 0.17 0.00 0.09 0.00 0.00 57.88 58.18 2d87 h LEU 111 Cb 1.10 0.18 -0.12 0.00 0.09 0.00 0.00 40.66 41.91 2d87 h LEU 111 CO 0.09 -0.14 0.14 0.58 0.09 0.00 0.00 178.44 179.21 2d87 h VAL 112 N -0.10 0.45 -0.01 1.22 2.07 -1.64 0.27 116.25 118.51 2d87 h VAL 112 Ca 0.10 -0.07 -0.16 0.00 0.82 0.00 0.00 66.70 67.38 2d87 h VAL 112 Cb 0.24 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 2d87 h VAL 112 CO -0.23 0.04 -0.73 1.56 0.02 0.00 0.00 177.57 178.23 2d87 h GLN 113 N 0.22 0.05 0.00 1.57 1.08 -1.42 -3.08 115.11 113.53 2d87 h GLN 113 Ca 0.43 -0.05 -0.07 0.00 -1.45 0.00 0.00 58.65 57.51 2d87 h GLN 113 Cb 0.77 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.20 2d87 h GLN 113 CO -0.57 0.76 -0.35 0.87 -0.95 0.00 0.00 178.83 178.59 2d87 h LYS 114 N 0.03 0.00 0.00 1.46 1.79 0.26 -3.47 116.57 116.65 2d87 h LYS 114 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2d87 h LYS 114 Cb 1.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.94 2d87 h LYS 114 CO 0.10 0.35 0.00 0.41 -1.08 0.00 0.00 179.45 179.23 2d87 n GLY 115 N -0.48 1.38 0.13 3.86 0.00 0.22 -5.01 105.19 105.29 2d87 n GLY 115 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 2d87 n GLY 115 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d87 n LEU 116 N 0.00 2.55 -4.51 0.99 4.77 -0.99 -4.89 117.00 114.92 2d87 n LEU 116 Ca 0.00 0.09 -0.37 0.00 -0.03 0.00 0.00 56.01 55.70 2d87 n LEU 116 Cb 0.00 -0.92 -0.12 0.00 -2.33 0.00 0.00 43.42 40.05 2d87 n LEU 116 CO 0.00 0.77 -0.23 -0.69 -1.33 0.00 0.00 177.39 175.92 2d87 s VAL 117 N -2.51 4.76 -0.97 4.08 1.01 -1.25 -5.01 120.40 120.51 2d87 s VAL 117 Ca -0.34 -0.05 -0.12 0.00 0.00 0.00 0.00 61.98 61.46 2d87 s VAL 117 Cb 0.10 -3.27 0.23 0.00 0.00 0.00 0.00 36.38 33.45 2d87 s VAL 117 CO 0.59 0.27 0.98 -0.75 0.00 0.00 0.00 175.10 176.19 2d87 s LYS 118 N 1.68 3.87 0.79 2.72 2.47 -1.26 -4.41 119.74 125.60 2d87 s LYS 118 Ca 0.06 -2.71 -0.11 0.00 -1.56 0.00 0.00 55.97 51.65 2d87 s LYS 118 Cb -0.16 -4.56 0.07 0.00 -1.46 0.00 0.00 37.83 31.72 2d87 s LYS 118 CO 0.07 -1.34 1.09 -0.08 0.16 0.00 0.00 175.35 175.24 2d87 s THR 119 N -0.10 3.28 0.43 3.43 -1.32 -1.26 -5.07 115.64 115.03 2d87 s THR 119 Ca 0.26 0.42 0.07 0.00 -1.21 0.00 0.00 61.69 61.23 2d87 s THR 119 Cb -0.09 -3.00 -0.02 0.00 -1.51 0.00 0.00 72.50 67.87 2d87 s THR 119 CO -0.08 -0.54 0.34 -1.59 -2.21 0.00 0.00 174.62 170.54 2d87 s LYS 120 N -4.99 2.42 -0.38 7.08 0.00 -1.26 -5.10 119.74 117.51 2d87 s LYS 120 Ca 0.61 -1.67 0.00 0.00 0.00 0.00 0.00 55.97 54.91 2d87 s LYS 120 Cb -0.16 -2.25 0.11 0.00 0.00 0.00 0.00 37.83 35.52 2d87 s LYS 120 CO 0.56 -0.24 0.14 0.15 0.00 0.00 0.00 175.35 175.96 2d87 s LYS 121 N -4.10 1.78 -0.66 1.78 1.02 -1.26 -5.06 119.74 113.23 2d87 s LYS 121 Ca 0.45 -1.87 -0.23 0.00 0.02 0.00 0.00 55.97 54.34 2d87 s LYS 121 Cb -0.01 -3.42 0.06 0.00 -0.52 0.00 0.00 37.83 33.94 2d87 s LYS 121 CO 0.26 -1.02 1.00 0.45 -0.92 0.00 0.00 175.35 175.13 2d87 s SER 122 N 1.37 6.18 -0.44 2.83 0.15 -1.26 -4.99 113.70 117.55 2d87 s SER 122 Ca 0.10 -0.87 -0.28 0.00 0.70 0.00 0.00 55.95 55.60 2d87 s SER 122 Cb -0.21 -2.44 -0.01 0.00 -1.71 0.00 0.00 66.02 61.65 2d87 s SER 122 CO -0.06 -1.47 1.76 -0.44 1.20 0.00 0.00 173.24 174.23 2d87 s SER 123 N 3.62 5.75 0.00 5.45 0.01 -1.26 -4.90 113.70 122.36 2d87 s SER 123 Ca 0.24 0.89 0.00 0.00 1.31 0.00 0.00 55.95 58.39 2d87 s SER 123 Cb -0.15 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.55 2d87 s SER 123 CO 0.12 -1.90 0.00 0.61 0.41 0.00 0.00 173.24 172.48 2d87 n GLY 124 N 5.46 4.77 3.77 3.44 0.00 -1.26 -5.16 105.19 116.21 2d87 n GLY 124 Ca 0.21 -1.24 -0.31 0.00 0.00 0.00 0.00 46.02 44.67 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 1.14 2.36 -0.39 1.61 0.04 -1.26 -4.97 135.00 133.53 2d87 s PRO 125 Ca 0.00 1.21 -0.28 0.00 0.04 0.00 0.00 61.00 61.97 2d87 s PRO 125 Cb 0.00 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.65 2d87 s PRO 125 CO 0.00 -1.57 1.06 0.45 0.04 0.00 0.00 177.00 176.98 2d87 s SER 126 N -3.23 6.75 -0.27 6.66 0.15 -1.26 -4.88 113.70 117.62 2d87 s SER 126 Ca 0.62 0.69 -0.13 0.00 0.70 0.00 0.00 55.95 57.83 2d87 s SER 126 Cb -0.18 -2.52 -0.12 0.00 -1.71 0.00 0.00 66.02 61.49 2d87 s SER 126 CO 0.53 -1.01 -0.34 -0.24 1.20 0.00 0.00 173.24 173.37 2d87 n SER 127 N 7.20 1.88 0.00 5.45 2.88 -1.26 -5.35 113.62 124.42 2d87 n SER 127 Ca 0.11 0.32 0.00 0.00 -1.33 0.00 0.00 58.87 57.97 2d87 n SER 127 Cb 0.48 -0.78 0.00 0.00 -0.75 0.00 0.00 64.21 63.16 2d87 n SER 127 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42