#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 -0.63 -0.05 1.61 0.15 -1.25 -5.07 113.70 108.46 2d87 s SER 2 Ca 0.00 1.12 -0.15 0.00 0.70 0.00 0.00 55.95 57.62 2d87 s SER 2 Cb 0.00 1.19 -0.10 0.00 -1.71 0.00 0.00 66.02 65.40 2d87 s SER 2 CO 0.00 -0.19 0.61 -1.28 1.20 0.00 0.00 173.24 173.58 2d87 h SER 3 N 5.32 -0.29 -2.21 5.45 0.87 -1.94 -3.40 113.55 117.35 2d87 h SER 3 Ca -0.29 -0.12 -0.62 0.00 -1.23 0.00 0.00 61.79 59.53 2d87 h SER 3 Cb 1.19 0.08 0.11 0.00 -0.44 0.00 0.00 62.40 63.33 2d87 h SER 3 CO 0.12 0.20 0.04 0.61 -0.53 0.00 0.00 176.83 177.27 2d87 n GLY 4 N 0.71 -0.47 3.24 5.77 0.00 -1.26 -4.98 105.19 108.20 2d87 n GLY 4 Ca -0.06 0.34 -0.09 0.00 0.00 0.00 0.00 46.02 46.21 2d87 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d87 s SER 5 N -0.59 0.01 -1.05 1.61 0.15 -1.26 -4.73 113.70 107.84 2d87 s SER 5 Ca 0.60 -0.55 -0.23 0.00 0.70 0.00 0.00 55.95 56.47 2d87 s SER 5 Cb -0.75 0.38 -0.05 0.00 -1.71 0.00 0.00 66.02 63.89 2d87 s SER 5 CO 0.59 -0.77 1.91 -0.44 1.20 0.00 0.00 173.24 175.73 2d87 s SER 6 N -2.84 5.23 0.00 5.45 0.01 -1.26 -4.23 113.70 116.06 2d87 s SER 6 Ca 0.04 -1.22 0.00 0.00 1.31 0.00 0.00 55.95 56.08 2d87 s SER 6 Cb 0.04 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.70 2d87 s SER 6 CO -0.11 -2.76 0.00 0.61 0.41 0.00 0.00 173.24 171.38 2d87 n GLY 7 N 6.34 1.76 0.12 3.44 0.00 -1.26 -5.08 105.19 110.51 2d87 n GLY 7 Ca 0.42 -0.59 -0.16 0.00 0.00 0.00 0.00 46.02 45.69 2d87 n GLY 7 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2d87 n ILE 8 N 0.00 1.49 0.19 -0.61 5.41 -1.26 -4.22 119.36 120.35 2d87 n ILE 8 Ca 0.00 -0.64 0.16 0.00 1.00 0.00 0.00 62.75 63.27 2d87 n ILE 8 Cb 0.00 -1.22 0.62 0.00 -0.71 0.00 0.00 39.64 38.32 2d87 n ILE 8 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2d87 h LYS 9 N 0.00 0.00 0.00 0.38 1.63 -1.98 -2.14 116.57 114.47 2d87 h LYS 9 Ca -0.56 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.24 2d87 h LYS 9 Cb 1.99 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.62 2d87 h LYS 9 CO -0.05 0.00 -0.04 1.96 -3.45 0.00 0.00 179.45 177.87 2d87 h GLN 10 N 0.00 0.00 -1.53 1.90 1.08 -1.99 -3.22 115.11 111.34 2d87 h GLN 10 Ca 0.13 0.00 0.49 0.00 -1.45 0.00 0.00 58.65 57.81 2d87 h GLN 10 Cb 1.31 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 28.63 2d87 h GLN 10 CO -0.00 0.00 1.04 0.00 -0.95 0.00 0.00 178.83 178.92 2d87 n MET 11 N -2.74 -0.02 -0.05 1.46 0.00 -0.93 0.16 117.12 115.00 2d87 n MET 11 Ca -0.01 1.12 -0.13 0.00 0.00 0.00 0.00 57.70 58.69 2d87 n MET 11 Cb 0.02 -2.35 -0.07 0.00 0.00 0.00 0.00 33.22 30.82 2d87 n MET 11 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 2d87 h LEU 12 N 0.00 0.30 -1.47 3.17 3.38 -1.54 -0.68 115.31 118.45 2d87 h LEU 12 Ca 0.86 -0.43 -0.06 0.00 0.09 0.00 0.00 57.88 58.34 2d87 h LEU 12 Cb 3.04 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 43.70 2d87 h LEU 12 CO -0.27 0.66 -0.27 0.25 0.09 0.00 0.00 178.44 178.91 2d87 h LEU 13 N -0.07 0.00 0.00 1.67 5.85 0.15 -0.54 115.31 122.37 2d87 h LEU 13 Ca 0.03 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.61 2d87 h LEU 13 Cb 0.56 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 2d87 h LEU 13 CO 0.02 0.27 -0.65 -0.78 -0.34 0.00 0.00 178.44 176.96 2d87 h ASP 14 N 0.00 0.00 0.00 1.25 3.58 -1.02 -3.29 116.42 116.94 2d87 h ASP 14 Ca -0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 2d87 h ASP 14 Cb 0.49 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.54 2d87 h ASP 14 CO 0.03 0.65 -0.05 -0.25 -2.88 0.00 0.00 179.24 176.75 2d87 h TRP 15 N 0.00 0.00 -0.91 0.28 7.01 -0.54 -3.21 115.95 118.58 2d87 h TRP 15 Ca -0.01 0.00 0.20 0.00 2.11 0.00 0.00 58.89 61.19 2d87 h TRP 15 Cb 1.50 0.00 -0.17 0.00 -2.10 0.00 0.00 29.16 28.39 2d87 h TRP 15 CO 0.00 0.58 -0.15 0.00 -2.79 0.00 0.00 178.44 176.09 2d87 h ARG 17 N 0.01 -0.39 -0.81 0.00 3.08 -1.70 0.89 114.38 115.46 2d87 h ARG 17 Ca 0.47 0.03 0.23 0.00 0.07 0.00 0.00 59.98 60.78 2d87 h ARG 17 Cb 0.80 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.91 2d87 h ARG 17 CO -0.91 -0.26 0.72 0.00 -1.07 0.00 0.00 179.97 178.45 2d87 h ALA 18 N 0.34 2.65 0.00 0.04 0.00 -0.77 1.06 119.26 122.57 2d87 h ALA 18 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2d87 h ALA 18 Cb 0.36 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2d87 h ALA 18 CO -0.01 -1.14 -1.74 1.63 0.00 0.00 0.00 179.25 177.99 2d87 n LYS 19 N -3.84 0.58 -1.06 0.00 4.76 -0.64 -4.38 118.16 113.58 2d87 n LYS 19 Ca 0.17 -0.15 -0.05 0.00 -2.87 0.00 0.00 58.31 55.41 2d87 n LYS 19 Cb 1.00 -1.48 0.15 0.00 -1.84 0.00 0.00 35.03 32.86 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 -2.07 2.37 -3.44 -0.18 -1.04 0.30 -4.67 114.28 105.56 2d87 n THR 20 Ca -0.02 -3.47 -0.29 0.00 -2.04 0.00 0.00 64.05 58.23 2d87 n THR 20 Cb 0.49 -0.53 -0.03 0.00 -1.82 0.00 0.00 70.33 68.44 2d87 n THR 20 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2d87 s ARG 21 N -3.36 3.62 0.00 -2.82 1.70 0.31 -4.24 118.95 114.16 2d87 s ARG 21 Ca 0.43 -0.04 0.00 0.00 -0.47 0.00 0.00 55.73 55.65 2d87 s ARG 21 Cb 0.39 -2.70 0.00 0.00 -0.57 0.00 0.00 34.95 32.07 2d87 s ARG 21 CO -0.03 0.28 0.00 0.41 -1.08 0.00 0.00 175.30 174.88 2d87 n GLY 22 N -0.74 1.93 3.67 3.88 0.00 -1.26 -4.96 105.19 107.70 2d87 n GLY 22 Ca -0.02 -0.06 -0.51 0.00 0.00 0.00 0.00 46.02 45.43 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 2.08 -2.06 1.61 4.02 -1.26 -4.93 117.16 116.63 2d87 n TYR 23 Ca 0.00 0.32 -0.33 0.00 -0.01 0.00 0.00 57.90 57.88 2d87 n TYR 23 Cb 0.00 -2.52 0.01 0.00 -0.02 0.00 0.00 39.34 36.81 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 2.50 3.27 -1.72 -0.72 2.56 -1.26 -3.33 118.70 119.99 2d87 s GLU 24 Ca 0.89 1.29 0.00 0.00 0.00 0.00 0.00 54.97 57.16 2d87 s GLU 24 Cb -0.84 -2.02 0.00 0.00 2.00 0.00 0.00 34.13 33.27 2d87 s GLU 24 CO 0.51 -0.86 0.00 0.72 -0.56 0.00 0.00 175.26 175.07 2d87 n HIS 25 N -1.93 -0.95 -3.88 5.30 8.25 -1.26 -4.96 115.22 115.79 2d87 n HIS 25 Ca 0.09 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.44 2d87 n HIS 25 Cb 0.52 -3.72 -0.14 0.00 1.12 0.00 0.00 29.99 27.78 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 -2.93 0.01 -0.30 1.59 1.01 -1.21 -4.72 120.40 113.85 2d87 s VAL 26 Ca 0.00 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 61.80 2d87 s VAL 26 Cb 0.00 -0.04 0.17 0.00 0.00 0.00 0.00 36.38 36.51 2d87 s VAL 26 CO 0.00 -0.05 0.81 -0.62 0.00 0.00 0.00 175.10 175.24 2d87 s ASP 27 N -0.14 -0.93 -0.54 3.32 2.15 -1.26 -4.89 116.67 114.38 2d87 s ASP 27 Ca -0.02 0.84 -0.16 0.00 0.43 0.00 0.00 52.55 53.64 2d87 s ASP 27 Cb -0.01 1.88 0.13 0.00 -0.30 0.00 0.00 42.92 44.62 2d87 s ASP 27 CO -0.00 -0.17 0.51 -0.63 -0.17 0.00 0.00 175.17 174.71 2d87 s ILE 28 N 2.79 5.19 -0.18 4.11 1.01 -1.26 -4.85 121.20 128.01 2d87 s ILE 28 Ca 0.05 -1.46 0.15 0.00 0.00 0.00 0.00 60.65 59.39 2d87 s ILE 28 Cb -0.11 -4.35 -0.22 0.00 0.01 0.00 0.00 42.46 37.80 2d87 s ILE 28 CO -0.17 -0.88 0.04 1.67 0.00 0.00 0.00 174.94 175.60 2d87 n GLN 29 N 5.31 1.04 -3.54 2.79 -0.06 -1.26 -4.91 117.38 116.75 2d87 n GLN 29 Ca -0.14 0.00 -0.07 0.00 -2.00 0.00 0.00 57.00 54.79 2d87 n GLN 29 Cb 0.40 -1.46 -0.02 0.00 -4.06 0.00 0.00 30.24 25.10 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 -5.27 -0.29 -0.33 1.69 6.03 -1.26 -5.04 114.94 110.47 2d87 s ASN 30 Ca -0.10 0.04 -0.05 0.00 -1.03 0.00 0.00 52.86 51.72 2d87 s ASN 30 Cb 0.05 0.30 -0.08 0.00 -3.03 0.00 0.00 41.25 38.50 2d87 s ASN 30 CO 0.72 -0.47 3.12 0.49 -2.03 0.00 0.00 177.10 178.93 2d87 n PHE 31 N -0.09 0.99 0.00 1.54 3.72 -1.26 -3.91 117.46 118.45 2d87 n PHE 31 Ca -0.06 -1.82 0.00 0.00 -0.05 0.00 0.00 57.45 55.52 2d87 n PHE 31 Cb 0.60 -1.52 0.00 0.00 -0.94 0.00 0.00 39.48 37.62 2d87 n PHE 31 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2d87 n SER 32 N 1.67 0.00 -0.88 4.37 3.41 -1.26 -2.79 113.62 118.14 2d87 n SER 32 Ca 0.48 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 59.13 2d87 n SER 32 Cb 0.69 -0.12 0.06 0.00 -0.26 0.00 0.00 64.21 64.58 2d87 n SER 32 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2d87 n SER 33 N -1.99 0.96 0.09 4.04 2.88 -1.26 -2.99 113.62 115.36 2d87 n SER 33 Ca 0.00 -2.43 0.12 0.00 -1.33 0.00 0.00 58.87 55.23 2d87 n SER 33 Cb 0.00 -0.32 0.08 0.00 -0.75 0.00 0.00 64.21 63.22 2d87 n SER 33 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2d87 h SER 34 N 0.58 0.00 0.07 -3.46 0.02 -1.91 -3.34 113.55 105.51 2d87 h SER 34 Ca -0.10 -0.09 -0.19 0.00 -0.84 0.00 0.00 61.79 60.57 2d87 h SER 34 Cb 1.50 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 64.00 2d87 h SER 34 CO 0.04 0.05 -2.12 0.79 -1.14 0.00 0.00 176.83 174.44 2d87 n TRP 35 N -2.47 0.10 -0.40 3.45 7.02 -1.26 -4.35 117.44 119.52 2d87 n TRP 35 Ca 0.02 0.03 0.32 0.00 -1.02 0.00 0.00 57.50 56.85 2d87 n TRP 35 Cb 0.50 -0.80 0.61 0.00 -2.42 0.00 0.00 31.31 29.21 2d87 n TRP 35 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2d87 h SER 36 N 0.00 0.30 -0.26 -0.99 0.87 -1.88 0.16 113.55 111.74 2d87 h SER 36 Ca -0.28 0.11 0.06 0.00 -1.23 0.00 0.00 61.79 60.46 2d87 h SER 36 Cb 1.65 0.08 -0.07 0.00 -0.44 0.00 0.00 62.40 63.62 2d87 h SER 36 CO 0.02 -0.09 -0.22 0.44 -0.53 0.00 0.00 176.83 176.45 2d87 h ASP 37 N 0.18 -0.71 0.00 6.23 5.19 -1.79 -3.48 116.42 122.04 2d87 h ASP 37 Ca 0.74 0.14 0.00 0.00 -0.62 0.00 0.00 57.03 57.29 2d87 h ASP 37 Cb 2.24 0.35 0.00 0.00 0.18 0.00 0.00 39.33 42.09 2d87 h ASP 37 CO -0.36 -0.26 0.00 0.61 -3.12 0.00 0.00 179.24 176.11 2d87 n GLY 38 N -1.37 2.26 0.32 2.75 0.00 0.54 -4.62 105.19 105.08 2d87 n GLY 38 Ca -0.00 -0.70 0.28 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.06 -0.28 1.61 2.81 -1.26 -0.58 117.12 119.35 2d87 n MET 39 Ca 0.00 1.39 -0.11 0.00 -1.81 0.00 0.00 57.70 57.17 2d87 n MET 39 Cb 0.00 -2.42 -0.09 0.00 -0.71 0.00 0.00 33.22 30.00 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 1.97 -0.58 -0.81 3.04 0.00 -1.84 0.23 119.26 121.27 2d87 h ALA 40 Ca 0.78 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.87 2d87 h ALA 40 Cb 1.99 1.22 -0.07 0.00 0.00 0.00 0.00 17.79 20.92 2d87 h ALA 40 CO -0.80 -0.97 0.46 0.74 0.00 0.00 0.00 179.25 178.68 2d87 h PHE 41 N -0.18 0.84 0.04 0.00 0.04 -1.11 -2.80 116.94 113.76 2d87 h PHE 41 Ca 0.14 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.94 2d87 h PHE 41 Cb 0.51 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.41 2d87 h PHE 41 CO -0.87 0.34 -0.02 0.00 -0.60 0.00 0.00 178.31 177.16 2d87 n ALA 43 N -2.10 -0.22 -0.29 0.00 0.00 0.24 0.91 120.51 119.05 2d87 n ALA 43 Ca -0.01 0.30 0.11 0.00 0.00 0.00 0.00 53.44 53.83 2d87 n ALA 43 Cb 0.02 0.14 0.21 0.00 0.00 0.00 0.00 19.45 19.83 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 -3.77 -0.15 0.21 0.00 7.94 -1.06 -0.88 117.00 119.29 2d87 n LEU 44 Ca 0.01 1.43 -0.09 0.00 -1.11 0.00 0.00 56.01 56.24 2d87 n LEU 44 Cb 0.09 -0.50 -0.04 0.00 0.53 0.00 0.00 43.42 43.50 2d87 n LEU 44 CO -0.06 -1.43 0.25 0.58 -1.11 0.00 0.00 177.39 175.63 2d87 h VAL 45 N 0.00 0.00 -0.91 1.96 2.07 0.67 -3.24 116.25 116.80 2d87 h VAL 45 Ca 0.48 -0.51 0.37 0.00 0.82 0.00 0.00 66.70 67.86 2d87 h VAL 45 Cb 0.93 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.54 2d87 h VAL 45 CO -0.81 0.00 0.45 1.57 0.02 0.00 0.00 177.57 178.81 2d87 n HIS 46 N -5.06 1.02 -0.19 1.57 -0.00 0.19 0.13 115.22 112.89 2d87 n HIS 46 Ca -0.08 1.07 0.00 0.00 -0.00 0.00 0.00 57.72 58.72 2d87 n HIS 46 Cb 0.24 -1.46 0.10 0.00 -0.00 0.00 0.00 29.99 28.87 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 -0.04 0.11 0.26 -0.73 -1.03 -0.12 115.58 114.03 2d87 h ASN 47 Ca 0.76 0.11 -0.01 0.00 1.87 0.00 0.00 56.30 59.03 2d87 h ASN 47 Cb 1.97 0.16 0.00 0.00 0.27 0.00 0.00 38.32 40.73 2d87 h ASN 47 CO -0.71 -0.01 -0.05 -0.26 -0.37 0.00 0.00 177.43 176.03 2d87 h PHE 48 N 0.23 -0.14 -3.30 0.67 0.04 0.91 -3.41 116.94 111.95 2d87 h PHE 48 Ca 0.30 -0.00 -0.64 0.00 2.80 0.00 0.00 57.97 60.43 2d87 h PHE 48 Cb 0.45 0.05 -0.41 0.00 2.20 0.00 0.00 35.95 38.24 2d87 h PHE 48 CO -0.26 0.29 -0.58 -0.06 -0.60 0.00 0.00 178.31 177.10 2d87 s PHE 49 N -2.73 3.34 0.08 -0.55 0.40 -0.53 -4.94 117.98 113.06 2d87 s PHE 49 Ca -0.11 -3.20 -0.16 0.00 -0.60 0.00 0.00 56.93 52.86 2d87 s PHE 49 Cb -0.00 -2.83 -0.10 0.00 0.51 0.00 0.00 43.02 40.60 2d87 s PHE 49 CO 0.39 -0.68 1.40 -1.00 0.70 0.00 0.00 175.22 176.02 2d87 h PRO 50 N 6.16 0.60 -0.58 0.24 0.13 -1.26 -3.23 132.00 134.07 2d87 h PRO 50 Ca 0.00 -0.32 -0.09 0.00 -0.87 0.00 0.00 66.00 64.73 2d87 h PRO 50 Cb 0.85 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.97 2d87 h PRO 50 CO 0.71 0.91 0.00 1.05 -0.23 0.00 0.00 178.00 180.44 2d87 h GLU 51 N 0.31 1.02 -0.97 0.86 4.11 -1.92 -3.01 114.58 114.97 2d87 h GLU 51 Ca 0.04 -0.32 0.40 0.00 0.07 0.00 0.00 59.36 59.55 2d87 h GLU 51 Cb 0.80 -0.09 -0.17 0.00 0.50 0.00 0.00 28.75 29.79 2d87 h GLU 51 CO 0.06 1.00 0.53 0.00 0.07 0.00 0.00 179.01 180.68 2d87 n ALA 52 N -2.47 1.00 -3.48 1.06 0.00 -1.22 -4.57 120.51 110.83 2d87 n ALA 52 Ca 0.02 0.95 -0.15 0.00 0.00 0.00 0.00 53.44 54.27 2d87 n ALA 52 Cb 0.34 -0.97 -0.04 0.00 0.00 0.00 0.00 19.45 18.78 2d87 n ALA 52 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2d87 s PHE 53 N -5.41 -0.59 -0.11 0.00 -0.71 -1.14 -4.97 117.98 105.05 2d87 s PHE 53 Ca -0.08 0.73 -0.23 0.00 -1.04 0.00 0.00 56.93 56.30 2d87 s PHE 53 Cb 0.32 0.48 -0.03 0.00 -1.21 0.00 0.00 43.02 42.58 2d87 s PHE 53 CO 0.74 -0.71 0.71 -0.51 -1.34 0.00 0.00 175.22 174.11 2d87 s ASP 54 N -1.93 6.92 -0.01 1.98 1.01 -1.26 -4.73 116.67 118.65 2d87 s ASP 54 Ca -0.05 1.11 0.11 0.00 0.71 0.00 0.00 52.55 54.43 2d87 s ASP 54 Cb -0.00 -2.41 -0.23 0.00 1.01 0.00 0.00 42.92 41.29 2d87 s ASP 54 CO -0.01 -0.19 0.78 0.22 0.21 0.00 0.00 175.17 176.17 2d87 h TYR 55 N 6.99 0.02 -0.00 4.23 3.20 -1.97 -3.32 116.97 126.12 2d87 h TYR 55 Ca -0.37 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.48 2d87 h TYR 55 Cb 1.17 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.44 2d87 h TYR 55 CO 0.67 1.03 -0.01 0.41 -1.64 0.00 0.00 178.16 178.62 2d87 n GLY 56 N 1.53 -1.23 0.08 1.82 0.00 -1.26 -3.27 105.19 102.86 2d87 n GLY 56 Ca -0.14 -0.16 -0.07 0.00 0.00 0.00 0.00 46.02 45.66 2d87 n GLY 56 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2d87 h GLN 57 N 0.03 0.00 -7.39 1.61 1.08 -1.99 -3.47 115.11 104.98 2d87 h GLN 57 Ca 0.00 0.00 -0.47 0.00 -1.45 0.00 0.00 58.65 56.73 2d87 h GLN 57 Cb 0.25 0.00 0.14 0.00 -0.05 0.00 0.00 27.48 27.82 2d87 h GLN 57 CO 0.00 0.50 0.27 -0.51 -0.95 0.00 0.00 178.83 178.14 2d87 s LEU 58 N -6.10 2.12 0.09 1.46 1.43 -1.20 -5.08 118.68 111.39 2d87 s LEU 58 Ca -0.04 1.25 0.06 0.00 -1.03 0.00 0.00 54.13 54.37 2d87 s LEU 58 Cb 0.08 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.63 2d87 s LEU 58 CO 0.82 -2.58 -0.15 -0.44 0.23 0.00 0.00 176.35 174.22 2d87 s SER 59 N -3.68 1.91 0.43 2.29 0.01 -1.26 -5.04 113.70 108.36 2d87 s SER 59 Ca 0.63 -0.69 0.22 0.00 1.31 0.00 0.00 55.95 57.43 2d87 s SER 59 Cb -0.17 -0.07 0.95 0.00 0.21 0.00 0.00 66.02 66.94 2d87 s SER 59 CO 0.56 -0.07 1.85 1.55 0.41 0.00 0.00 173.24 177.54 2d87 h PRO 60 N 4.03 0.00 0.00 12.44 0.13 -1.98 -2.76 132.00 143.86 2d87 h PRO 60 Ca -0.41 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.68 2d87 h PRO 60 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2d87 h PRO 60 CO 0.43 0.26 -0.17 0.37 -0.23 0.00 0.00 178.00 178.67 2d87 h GLN 61 N 0.00 0.00 -6.34 0.86 4.15 -1.96 -3.41 115.11 108.41 2d87 h GLN 61 Ca -0.00 0.00 -0.58 0.00 0.77 0.00 0.00 58.65 58.84 2d87 h GLN 61 Cb 0.69 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.30 2d87 h GLN 61 CO 0.03 0.17 0.73 -0.80 -1.93 0.00 0.00 178.83 177.03 2d87 s ASN 62 N -6.10 6.64 -0.04 -0.69 0.01 -1.04 -4.89 114.94 108.83 2d87 s ASN 62 Ca -0.01 0.46 0.03 0.00 -0.71 0.00 0.00 52.86 52.63 2d87 s ASN 62 Cb 0.11 -2.50 -0.25 0.00 0.41 0.00 0.00 41.25 39.02 2d87 s ASN 62 CO 0.60 -1.05 0.67 0.03 -1.51 0.00 0.00 177.10 175.84 2d87 h ARG 63 N 8.87 0.14 0.02 -0.60 -0.00 -1.82 -3.32 114.38 117.67 2d87 h ARG 63 Ca -0.23 -0.24 -0.00 0.00 -0.50 0.00 0.00 59.98 59.01 2d87 h ARG 63 Cb 1.07 0.09 0.00 0.00 0.00 0.00 0.00 29.97 31.13 2d87 h ARG 63 CO 1.05 0.88 -0.01 0.00 0.00 0.00 0.00 179.97 181.89 2d87 h ARG 64 N 0.04 -0.02 -0.94 0.04 3.08 -1.92 -3.30 114.38 111.36 2d87 h ARG 64 Ca -0.30 0.00 0.11 0.00 0.07 0.00 0.00 59.98 59.86 2d87 h ARG 64 Cb 2.01 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.94 2d87 h ARG 64 CO 0.11 -0.01 -0.49 0.94 -1.07 0.00 0.00 179.97 179.44 2d87 n GLN 65 N -3.24 -0.35 -0.32 0.04 -0.06 -1.26 0.86 117.38 113.05 2d87 n GLN 65 Ca -0.00 1.43 0.17 0.00 -2.00 0.00 0.00 57.00 56.60 2d87 n GLN 65 Cb 0.01 -2.11 0.35 0.00 -4.06 0.00 0.00 30.24 24.43 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 -0.05 0.25 1.69 2.35 -1.74 0.18 115.58 118.27 2d87 h ASN 66 Ca 0.21 0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 56.18 2d87 h ASN 66 Cb 0.45 0.32 0.00 0.00 0.05 0.00 0.00 38.32 39.14 2d87 h ASN 66 CO -0.90 -0.25 -0.12 -0.26 -1.65 0.00 0.00 177.43 174.25 2d87 h PHE 67 N 0.13 -0.31 -0.84 1.19 -1.00 0.39 -3.06 116.94 113.44 2d87 h PHE 67 Ca 0.62 -0.01 0.09 0.00 2.81 0.00 0.00 57.97 61.49 2d87 h PHE 67 Cb 1.35 0.10 -0.12 0.00 3.61 0.00 0.00 35.95 40.90 2d87 h PHE 67 CO -0.27 -0.19 -0.53 0.93 -1.61 0.00 0.00 178.31 176.63 2d87 h GLU 68 N -0.88 -0.10 -0.09 1.51 5.08 -0.09 -1.99 114.58 118.02 2d87 h GLU 68 Ca -0.03 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 2d87 h GLU 68 Cb 0.26 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2d87 h GLU 68 CO 0.06 -0.07 -0.17 0.28 -1.00 0.00 0.00 179.01 178.11 2d87 h VAL 69 N -0.10 0.00 -0.80 3.13 2.07 -0.81 0.17 116.25 119.91 2d87 h VAL 69 Ca 0.18 0.00 0.29 0.00 0.82 0.00 0.00 66.70 67.99 2d87 h VAL 69 Cb 0.49 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.12 2d87 h VAL 69 CO -0.85 0.00 0.27 0.00 0.02 0.00 0.00 177.57 177.01 2d87 n ALA 70 N -2.77 0.66 0.08 1.67 0.00 -0.80 0.57 120.51 119.92 2d87 n ALA 70 Ca -0.01 0.83 -0.04 0.00 0.00 0.00 0.00 53.44 54.22 2d87 n ALA 70 Cb 0.11 -0.74 -0.02 0.00 0.00 0.00 0.00 19.45 18.80 2d87 n ALA 70 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2d87 h PHE 71 N 0.00 -0.22 -0.07 0.00 0.04 -0.51 -3.23 116.94 112.94 2d87 h PHE 71 Ca 0.60 -0.01 0.03 0.00 2.80 0.00 0.00 57.97 61.40 2d87 h PHE 71 Cb 1.49 0.07 -0.06 0.00 2.20 0.00 0.00 35.95 39.66 2d87 h PHE 71 CO -0.16 -0.14 -0.52 1.03 -0.60 0.00 0.00 178.31 177.93 2d87 h SER 72 N -0.55 -1.62 -1.45 2.17 0.87 0.11 0.62 113.55 113.70 2d87 h SER 72 Ca -0.02 0.19 0.48 0.00 -1.23 0.00 0.00 61.79 61.20 2d87 h SER 72 Cb 0.19 0.63 -0.12 0.00 -0.44 0.00 0.00 62.40 62.65 2d87 h SER 72 CO 0.04 -0.49 0.97 -1.54 -0.53 0.00 0.00 176.83 175.27 2d87 n SER 73 N -5.45 0.15 0.01 6.23 3.41 0.19 -0.58 113.62 117.59 2d87 n SER 73 Ca -0.06 1.22 -0.02 0.00 -0.26 0.00 0.00 58.87 59.75 2d87 n SER 73 Cb 0.39 -0.60 -0.01 0.00 -0.26 0.00 0.00 64.21 63.72 2d87 n SER 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2d87 h ALA 74 N 1.37 -0.15 -1.72 7.33 0.00 -0.93 -3.30 119.26 121.86 2d87 h ALA 74 Ca 0.85 -0.03 0.50 0.00 0.00 0.00 0.00 54.91 56.23 2d87 h ALA 74 Cb 2.92 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 20.69 2d87 h ALA 74 CO -0.33 -0.14 1.28 1.49 0.00 0.00 0.00 179.25 181.55 2d87 h GLU 75 N -0.96 0.00 -0.12 0.00 4.81 0.13 0.30 114.58 118.74 2d87 h GLU 75 Ca -0.01 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 2d87 h GLU 75 Cb 0.11 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 2d87 h GLU 75 CO 0.02 0.00 -0.07 2.41 -0.73 0.00 0.00 179.01 180.64 2d87 n THR 76 N -3.93 -0.08 -0.01 0.32 -1.04 -0.50 -1.18 114.28 107.86 2d87 n THR 76 Ca 0.38 1.54 0.01 0.00 -2.04 0.00 0.00 64.05 63.95 2d87 n THR 76 Cb 1.80 -2.03 -0.05 0.00 -1.82 0.00 0.00 70.33 68.23 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 -3.23 0.00 0.21 -1.42 1.44 -0.83 -4.55 115.22 106.84 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 0.03 -0.22 0.14 0.00 0.12 0.00 0.00 29.99 30.06 2d87 n HIS 77 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2d87 h ALA 78 N 0.55 0.89 -6.97 1.59 0.00 -0.52 -3.48 119.26 111.31 2d87 h ALA 78 Ca -0.06 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 54.25 2d87 h ALA 78 Cb 0.68 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.33 2d87 h ALA 78 CO 0.00 0.00 -0.97 -3.47 0.00 0.00 0.00 179.25 174.81 2d87 n ASP 79 N -2.97 -0.53 -4.73 0.00 -0.08 -0.33 -4.82 116.55 103.09 2d87 n ASP 79 Ca 0.03 -1.25 -0.41 0.00 -1.51 0.00 0.00 54.79 51.65 2d87 n ASP 79 Cb 0.53 -1.80 -0.05 0.00 2.34 0.00 0.00 41.12 42.14 2d87 n ASP 79 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2d87 s PRO 81 N -0.01 2.52 -0.80 0.00 0.04 -1.26 -4.66 135.00 130.83 2d87 s PRO 81 Ca 0.44 -0.83 -0.34 0.00 0.04 0.00 0.00 61.00 60.30 2d87 s PRO 81 Cb -0.22 -5.17 -0.20 0.00 0.04 0.00 0.00 34.50 28.94 2d87 s PRO 81 CO 0.27 -3.75 2.51 1.04 0.04 0.00 0.00 177.00 177.11 2d87 n GLN 82 N 8.50 0.11 -0.05 4.56 3.00 -1.26 -4.79 117.38 127.44 2d87 n GLN 82 Ca 0.43 0.01 -0.03 0.00 -0.01 0.00 0.00 57.00 57.40 2d87 n GLN 82 Cb 0.47 -1.65 -0.01 0.00 0.00 0.00 0.00 30.24 29.04 2d87 n GLN 82 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2d87 h LEU 83 N 11.62 0.00 -9.54 1.08 3.38 -2.00 -3.47 115.31 116.38 2d87 h LEU 83 Ca -0.08 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.29 2d87 h LEU 83 Cb 1.34 0.00 0.14 0.00 0.09 0.00 0.00 40.66 42.22 2d87 h LEU 83 CO 1.28 0.56 -0.03 0.18 0.09 0.00 0.00 178.44 180.51 2d87 n LEU 84 N -4.14 1.74 -4.24 1.67 4.77 -1.26 -4.92 117.00 110.62 2d87 n LEU 84 Ca -0.04 0.99 -0.42 0.00 -0.03 0.00 0.00 56.01 56.50 2d87 n LEU 84 Cb 0.17 -1.27 -0.04 0.00 -2.33 0.00 0.00 43.42 39.95 2d87 n LEU 84 CO 0.07 -1.96 0.41 1.51 -1.33 0.00 0.00 177.39 176.09 2d87 s ASP 85 N -0.83 6.43 0.26 -1.43 1.47 -1.26 -4.93 116.67 116.38 2d87 s ASP 85 Ca 0.64 -3.11 -0.01 0.00 1.18 0.00 0.00 52.55 51.25 2d87 s ASP 85 Cb -0.58 -2.08 0.57 0.00 -0.34 0.00 0.00 42.92 40.49 2d87 s ASP 85 CO 0.57 -0.40 1.33 0.41 0.68 0.00 0.00 175.17 177.76 2d87 n THR 86 N 3.30 -0.36 -0.29 2.11 -1.04 -1.26 0.13 114.28 116.87 2d87 n THR 86 Ca 0.16 1.89 0.11 0.00 -2.04 0.00 0.00 64.05 64.18 2d87 n THR 86 Cb 0.42 -2.72 0.26 0.00 -1.82 0.00 0.00 70.33 66.47 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 0.16 0.02 -2.82 3.07 -1.99 0.29 114.58 113.31 2d87 h GLU 87 Ca 0.48 -0.01 -0.24 0.00 -0.50 0.00 0.00 59.36 59.09 2d87 h GLU 87 Cb 0.93 -0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.77 2d87 h GLU 87 CO -0.82 0.11 -1.23 0.22 -1.40 0.00 0.00 179.01 175.88 2d87 h ASP 88 N 0.17 0.07 0.21 1.42 3.58 0.63 -3.27 116.42 119.22 2d87 h ASP 88 Ca 0.53 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.87 2d87 h ASP 88 Cb 1.04 -0.02 -0.00 0.00 1.72 0.00 0.00 39.33 42.06 2d87 h ASP 88 CO -0.68 1.07 -0.10 0.24 -2.88 0.00 0.00 179.24 176.89 2d87 h MET 89 N 0.01 0.00 0.13 0.28 2.86 0.16 0.16 114.93 118.53 2d87 h MET 89 Ca -0.10 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 2d87 h MET 89 Cb 1.86 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.53 2d87 h MET 89 CO 0.13 0.10 -0.06 0.28 1.06 0.00 0.00 176.91 178.41 2d87 h VAL 90 N 0.00 0.00 -1.00 -2.22 2.07 -0.81 -3.34 116.25 110.95 2d87 h VAL 90 Ca -0.00 -0.24 0.08 0.00 0.82 0.00 0.00 66.70 67.36 2d87 h VAL 90 Cb 0.23 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.93 2d87 h VAL 90 CO 0.01 0.00 0.64 0.08 0.02 0.00 0.00 177.57 178.32 2d87 h ARG 91 N -0.41 1.10 -6.26 1.57 0.11 -1.64 -3.41 114.38 105.43 2d87 h ARG 91 Ca -0.02 -0.07 -0.59 0.00 0.10 0.00 0.00 59.98 59.40 2d87 h ARG 91 Cb 0.14 -0.25 0.02 0.00 1.11 0.00 0.00 29.97 30.98 2d87 h ARG 91 CO 0.03 0.73 1.19 1.28 0.10 0.00 0.00 179.97 183.30 2d87 n LEU 92 N -4.52 3.59 -0.32 0.08 4.77 0.04 -4.81 117.00 115.83 2d87 n LEU 92 Ca 0.16 0.86 0.32 0.00 -0.03 0.00 0.00 56.01 57.31 2d87 n LEU 92 Cb 0.22 -1.43 0.58 0.00 -2.33 0.00 0.00 43.42 40.46 2d87 n LEU 92 CO 0.31 -0.06 1.04 0.54 -1.33 0.00 0.00 177.39 177.89 2d87 n ARG 93 N 7.18 -0.06 -3.56 3.23 5.12 -1.26 -4.54 116.66 122.78 2d87 n ARG 93 Ca 0.23 1.33 -0.15 0.00 -1.93 0.00 0.00 57.85 57.33 2d87 n ARG 93 Cb 0.34 -2.41 -0.06 0.00 -1.16 0.00 0.00 32.46 29.17 2d87 n ARG 93 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 2d87 s GLU 94 N -5.46 0.90 0.20 5.56 -1.05 -1.26 -5.01 118.70 112.58 2d87 s GLU 94 Ca -0.09 0.37 -0.30 0.00 -0.15 0.00 0.00 54.97 54.81 2d87 s GLU 94 Cb 0.33 0.43 -0.09 0.00 -0.44 0.00 0.00 34.13 34.36 2d87 s GLU 94 CO 0.76 -0.25 1.30 -1.25 0.95 0.00 0.00 175.26 176.77 2d87 s PRO 95 N -0.84 4.40 0.14 -4.83 0.04 -1.16 -4.99 135.00 127.75 2d87 s PRO 95 Ca -0.07 2.05 -0.30 0.00 0.04 0.00 0.00 61.00 62.72 2d87 s PRO 95 Cb -0.01 -3.19 -0.07 0.00 0.04 0.00 0.00 34.50 31.27 2d87 s PRO 95 CO 0.06 -0.23 1.16 0.34 0.04 0.00 0.00 177.00 178.36 2d87 s ASP 96 N 0.28 7.15 0.21 6.66 2.15 -1.26 -4.43 116.67 127.43 2d87 s ASP 96 Ca 0.56 2.10 -0.09 0.00 0.43 0.00 0.00 52.55 55.55 2d87 s ASP 96 Cb -0.36 -2.60 0.26 0.00 -0.30 0.00 0.00 42.92 39.92 2d87 s ASP 96 CO 0.39 -0.35 1.81 4.11 -0.17 0.00 0.00 175.17 180.95 2d87 h TRP 97 N 5.77 0.69 -0.86 -5.34 5.08 -1.82 -1.16 115.95 118.32 2d87 h TRP 97 Ca -0.43 0.03 0.22 0.00 1.08 0.00 0.00 58.89 59.78 2d87 h TRP 97 Cb 1.21 -0.21 -0.13 0.00 -3.00 0.00 0.00 29.16 27.03 2d87 h TRP 97 CO 0.64 0.32 0.27 0.87 -1.28 0.00 0.00 178.44 179.26 2d87 h LYS 98 N 0.69 0.27 0.05 0.12 1.57 -1.92 0.32 116.57 117.67 2d87 h LYS 98 Ca 0.31 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.07 2d87 h LYS 98 Cb 0.21 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2d87 h LYS 98 CO -0.19 0.18 -0.03 0.00 -0.57 0.00 0.00 179.45 178.84 2d87 n VAL 100 N -3.15 -0.41 -0.32 0.00 0.31 -0.51 0.10 118.33 114.37 2d87 n VAL 100 Ca -0.01 1.85 0.27 0.00 -0.01 0.00 0.00 64.34 66.45 2d87 n VAL 100 Cb 0.03 -2.33 0.51 0.00 -0.91 0.00 0.00 33.84 31.13 2d87 n VAL 100 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2d87 n TYR 101 N -4.39 1.02 -0.05 3.52 4.19 0.09 0.86 117.16 122.40 2d87 n TYR 101 Ca 0.01 1.15 -0.08 0.00 3.31 0.00 0.00 57.90 62.29 2d87 n TYR 101 Cb 0.16 -1.47 -0.02 0.00 0.49 0.00 0.00 39.34 38.49 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 0.87 -0.14 2.97 2.02 0.62 -2.01 112.91 117.24 2d87 h THR 102 Ca 0.77 -0.03 0.04 0.00 0.77 0.00 0.00 66.41 67.96 2d87 h THR 102 Cb 1.96 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 69.10 2d87 h THR 102 CO -0.78 0.02 -0.10 0.22 0.37 0.00 0.00 175.52 175.24 2d87 h TYR 103 N 0.09 -0.25 -0.73 3.16 3.20 0.66 0.93 116.97 124.03 2d87 h TYR 103 Ca 0.10 0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.11 2d87 h TYR 103 Cb 0.12 0.13 -0.09 0.00 1.54 0.00 0.00 36.73 38.43 2d87 h TYR 103 CO -0.17 -0.15 0.30 0.82 -1.64 0.00 0.00 178.16 177.32 2d87 h ILE 104 N -0.11 0.71 -0.06 1.81 1.08 -1.17 0.14 117.51 119.91 2d87 h ILE 104 Ca 0.09 -0.16 -0.01 0.00 -0.39 0.00 0.00 64.86 64.38 2d87 h ILE 104 Cb 0.23 0.19 -0.00 0.00 -3.07 0.00 0.00 36.82 34.18 2d87 h ILE 104 CO -0.20 0.09 -0.01 -0.61 -0.69 0.00 0.00 178.15 176.72 2d87 h GLN 105 N 0.47 0.11 0.57 2.37 4.15 -0.72 -0.36 115.11 121.70 2d87 h GLN 105 Ca 0.39 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.75 2d87 h GLN 105 Cb 0.55 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.21 2d87 h GLN 105 CO -0.36 0.42 -0.47 1.49 -1.93 0.00 0.00 178.83 177.98 2d87 h GLU 106 N -0.22 -0.98 0.40 1.69 4.57 -0.14 -1.78 114.58 118.14 2d87 h GLU 106 Ca 0.02 0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 2d87 h GLU 106 Cb 0.37 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 2d87 h GLU 106 CO 0.00 -0.65 -0.36 0.35 -1.18 0.00 0.00 179.01 177.17 2d87 h PHE 107 N -1.01 -0.98 -0.94 0.92 3.57 -0.83 -2.57 116.94 115.10 2d87 h PHE 107 Ca -0.07 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.67 2d87 h PHE 107 Cb 0.86 0.37 -0.17 0.00 2.79 0.00 0.00 35.95 39.80 2d87 h PHE 107 CO -0.19 -0.52 -0.05 -0.92 -2.23 0.00 0.00 178.31 174.40 2d87 h TYR 108 N -0.78 -0.17 -0.81 0.41 3.20 -1.01 0.78 116.97 118.60 2d87 h TYR 108 Ca -0.03 0.07 0.08 0.00 3.14 0.00 0.00 58.73 61.99 2d87 h TYR 108 Cb 0.68 0.22 -0.07 0.00 1.54 0.00 0.00 36.73 39.11 2d87 h TYR 108 CO -0.19 -0.39 0.47 -0.09 -1.64 0.00 0.00 178.16 176.32 2d87 h ARG 109 N 0.03 0.78 -0.79 1.82 2.43 -0.92 -1.47 114.38 116.25 2d87 h ARG 109 Ca 0.53 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.66 2d87 h ARG 109 Cb 1.00 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 30.33 2d87 h ARG 109 CO -0.89 0.52 0.51 0.00 -1.51 0.00 0.00 179.97 178.59 2d87 h LEU 111 N 1.08 -0.47 -1.18 0.00 3.38 -0.59 -0.06 115.31 117.47 2d87 h LEU 111 Ca 0.29 -0.01 0.31 0.00 0.09 0.00 0.00 57.88 58.55 2d87 h LEU 111 Cb -0.10 0.12 -0.12 0.00 0.09 0.00 0.00 40.66 40.65 2d87 h LEU 111 CO -0.06 -0.29 0.65 0.58 0.09 0.00 0.00 178.44 179.41 2d87 h VAL 112 N -0.60 0.39 0.08 1.22 2.07 -1.21 0.41 116.25 118.60 2d87 h VAL 112 Ca -0.06 -0.12 -0.27 0.00 0.82 0.00 0.00 66.70 67.07 2d87 h VAL 112 Cb 0.45 -0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.23 2d87 h VAL 112 CO 0.09 0.07 -1.14 1.56 0.02 0.00 0.00 177.57 178.17 2d87 h GLN 113 N 0.36 0.45 0.00 1.57 1.08 -1.24 -3.21 115.11 114.13 2d87 h GLN 113 Ca 0.69 -0.60 -0.03 0.00 -1.45 0.00 0.00 58.65 57.26 2d87 h GLN 113 Cb 1.68 0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 29.30 2d87 h GLN 113 CO -0.45 1.24 -0.16 0.87 -0.95 0.00 0.00 178.83 179.37 2d87 h LYS 114 N 0.20 0.00 0.00 1.46 1.79 0.17 -3.46 116.57 116.73 2d87 h LYS 114 Ca -0.14 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 2d87 h LYS 114 Cb 1.81 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.46 2d87 h LYS 114 CO 0.20 0.16 0.00 0.41 -1.08 0.00 0.00 179.45 179.14 2d87 n GLY 115 N -0.79 1.26 0.13 3.86 0.00 0.09 -5.01 105.19 104.73 2d87 n GLY 115 Ca -0.02 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.54 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 2.34 -4.12 0.99 4.77 -1.13 -4.80 117.00 115.05 2d87 n LEU 116 Ca 0.00 0.27 -0.35 0.00 -0.03 0.00 0.00 56.01 55.91 2d87 n LEU 116 Cb 0.07 -1.03 -0.13 0.00 -2.33 0.00 0.00 43.42 39.99 2d87 n LEU 116 CO 0.00 0.63 -0.29 -0.69 -1.33 0.00 0.00 177.39 175.71 2d87 s VAL 117 N -2.48 2.93 -0.09 4.08 1.01 -1.26 -5.04 120.40 119.54 2d87 s VAL 117 Ca -0.27 -1.82 -0.30 0.00 0.00 0.00 0.00 61.98 59.60 2d87 s VAL 117 Cb 0.07 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 2d87 s VAL 117 CO 0.68 -0.40 1.31 -0.75 0.00 0.00 0.00 175.10 175.93 2d87 s LYS 118 N 1.14 4.27 0.91 2.72 2.47 -1.26 -4.41 119.74 125.57 2d87 s LYS 118 Ca 0.02 1.77 -0.13 0.00 -1.56 0.00 0.00 55.97 56.08 2d87 s LYS 118 Cb -0.21 -3.70 0.05 0.00 -1.46 0.00 0.00 37.83 32.51 2d87 s LYS 118 CO -0.04 -0.63 0.60 -2.37 0.16 0.00 0.00 175.35 173.08 2d87 n THR 119 N 5.06 0.37 -4.09 3.43 5.66 -1.26 -5.02 114.28 118.43 2d87 n THR 119 Ca 0.13 -0.19 -0.23 0.00 -3.05 0.00 0.00 64.05 60.72 2d87 n THR 119 Cb 0.45 -0.74 -0.17 0.00 -1.55 0.00 0.00 70.33 68.32 2d87 n THR 119 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 2d87 s LYS 120 N -3.73 1.04 1.10 1.09 2.20 -1.26 -5.14 119.74 115.03 2d87 s LYS 120 Ca 0.61 -0.13 -0.17 0.00 -0.36 0.00 0.00 55.97 55.92 2d87 s LYS 120 Cb -0.24 -1.09 0.11 0.00 -1.51 0.00 0.00 37.83 35.11 2d87 s LYS 120 CO 0.64 -0.15 0.19 0.36 -0.36 0.00 0.00 175.35 176.02 2d87 n LYS 121 N 4.44 -1.47 -3.53 4.03 2.85 -1.26 -4.99 118.16 118.22 2d87 n LYS 121 Ca -0.18 -0.41 -0.15 0.00 -1.05 0.00 0.00 58.31 56.52 2d87 n LYS 121 Cb 0.51 -1.78 -0.05 0.00 -0.65 0.00 0.00 35.03 33.05 2d87 n LYS 121 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2d87 s SER 122 N -1.94 -0.56 -0.18 -5.58 1.04 -1.26 -5.08 113.70 100.14 2d87 s SER 122 Ca 0.58 0.56 -0.02 0.00 0.48 0.00 0.00 55.95 57.54 2d87 s SER 122 Cb -0.15 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 2d87 s SER 122 CO 0.66 -0.55 -0.09 -0.55 0.98 0.00 0.00 173.24 173.70 2d87 s SER 123 N -1.29 4.13 0.00 7.02 0.15 -1.26 -3.84 113.70 118.60 2d87 s SER 123 Ca -0.07 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.20 2d87 s SER 123 Cb -0.00 -1.67 0.00 0.00 -1.71 0.00 0.00 66.02 62.63 2d87 s SER 123 CO 0.06 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.16 2d87 n GLY 124 N 4.27 2.76 3.77 9.45 0.00 -1.26 -5.12 105.19 119.05 2d87 n GLY 124 Ca -0.18 -0.46 -0.37 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.98 3.67 -0.23 1.61 0.04 -1.26 -4.89 135.00 131.95 2d87 s PRO 125 Ca 0.00 1.74 -0.08 0.00 0.04 0.00 0.00 61.00 62.70 2d87 s PRO 125 Cb 0.00 -2.32 -0.11 0.00 0.04 0.00 0.00 34.50 32.11 2d87 s PRO 125 CO 0.00 -0.62 -0.27 -1.13 0.04 0.00 0.00 177.00 175.02 2d87 n SER 126 N -0.67 1.85 -4.66 6.66 3.41 -1.26 -4.21 113.62 114.75 2d87 n SER 126 Ca 0.08 0.16 -0.43 0.00 -0.26 0.00 0.00 58.87 58.42 2d87 n SER 126 Cb 0.49 -0.58 -0.02 0.00 -0.26 0.00 0.00 64.21 63.83 2d87 n SER 126 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2d87 s SER 127 N -6.79 6.92 0.00 4.04 1.04 -1.26 -4.73 113.70 112.91 2d87 s SER 127 Ca -0.32 1.64 0.17 0.00 0.48 0.00 0.00 55.95 57.92 2d87 s SER 127 Cb 0.11 -2.54 0.13 0.00 0.10 0.00 0.00 66.02 63.82 2d87 s SER 127 CO 0.44 -0.79 1.03 0.61 0.98 0.00 0.00 173.24 175.50