#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 5.51 -4.69 1.61 3.41 -1.26 -5.04 113.62 113.17 2d87 n SER 2 Ca 0.00 -3.76 -0.42 0.00 -0.26 0.00 0.00 58.87 54.43 2d87 n SER 2 Cb 0.00 -0.51 -0.03 0.00 -0.26 0.00 0.00 64.21 63.41 2d87 n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2d87 s SER 3 N -3.15 6.88 -0.13 4.04 0.15 -1.26 -4.41 113.70 115.81 2d87 s SER 3 Ca 0.53 2.08 -0.08 0.00 0.70 0.00 0.00 55.95 59.19 2d87 s SER 3 Cb 0.43 -2.56 0.03 0.00 -1.71 0.00 0.00 66.02 62.21 2d87 s SER 3 CO -0.03 -0.70 0.15 0.61 1.20 0.00 0.00 173.24 174.48 2d87 n GLY 4 N 3.60 -4.46 0.08 9.45 0.00 -1.26 -5.00 105.19 107.59 2d87 n GLY 4 Ca 0.13 1.02 -0.11 0.00 0.00 0.00 0.00 46.02 47.05 2d87 n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2d87 h SER 5 N 2.65 0.00 -7.07 1.61 4.64 -2.02 -3.48 113.55 109.88 2d87 h SER 5 Ca -0.35 -0.44 -0.61 0.00 -0.47 0.00 0.00 61.79 59.93 2d87 h SER 5 Cb 0.79 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.54 2d87 h SER 5 CO 0.01 0.97 -0.88 -1.20 -0.87 0.00 0.00 176.83 174.86 2d87 n SER 6 N -4.60 -2.23 0.00 4.97 7.64 -1.26 -4.68 113.62 113.45 2d87 n SER 6 Ca -0.13 -1.18 0.00 0.00 1.01 0.00 0.00 58.87 58.57 2d87 n SER 6 Cb 0.38 -1.90 0.00 0.00 -1.01 0.00 0.00 64.21 61.68 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 -1.14 4.54 0.13 0.23 0.00 -1.26 -4.92 105.19 102.76 2d87 n GLY 7 Ca 0.11 -1.31 0.12 0.00 0.00 0.00 0.00 46.02 44.94 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 3.99 0.00 0.00 -0.61 2.04 -2.01 -3.29 117.51 117.63 2d87 h ILE 8 Ca 0.00 -0.79 -0.07 0.00 1.00 0.00 0.00 64.86 65.00 2d87 h ILE 8 Cb 0.00 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2d87 h ILE 8 CO 0.00 0.00 -0.32 0.50 0.00 0.00 0.00 178.15 178.33 2d87 h LYS 9 N 0.00 0.00 0.07 2.37 3.11 -1.92 -2.68 116.57 117.52 2d87 h LYS 9 Ca 0.00 0.00 -0.12 0.00 -2.81 0.00 0.00 60.65 57.72 2d87 h LYS 9 Cb 0.90 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.13 2d87 h LYS 9 CO 0.00 0.32 -0.57 0.37 -2.81 0.00 0.00 179.45 176.76 2d87 h GLN 10 N 0.00 0.14 -0.59 1.90 5.75 -1.83 -3.20 115.11 117.28 2d87 h GLN 10 Ca -0.00 -0.24 0.06 0.00 -0.15 0.00 0.00 58.65 58.32 2d87 h GLN 10 Cb 0.79 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.39 2d87 h GLN 10 CO 0.04 1.11 0.39 0.00 -2.65 0.00 0.00 178.83 177.72 2d87 h MET 11 N -0.69 0.55 0.11 1.69 -0.00 -1.63 -1.40 114.93 113.56 2d87 h MET 11 Ca -0.12 -0.03 -0.01 0.00 -0.00 0.00 0.00 59.70 59.54 2d87 h MET 11 Cb 1.35 -0.13 0.00 0.00 -0.00 0.00 0.00 31.60 32.83 2d87 h MET 11 CO 0.04 0.37 -0.05 -0.07 -0.00 0.00 0.00 176.91 177.20 2d87 h LEU 12 N 0.57 -0.12 -0.82 -0.10 3.38 -1.58 0.57 115.31 117.21 2d87 h LEU 12 Ca 0.25 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2d87 h LEU 12 Cb 0.27 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 2d87 h LEU 12 CO -0.07 0.13 0.53 0.25 0.09 0.00 0.00 178.44 179.37 2d87 h LEU 13 N -0.39 0.90 -0.46 1.67 5.85 -1.43 0.89 115.31 122.34 2d87 h LEU 13 Ca -0.01 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 2d87 h LEU 13 Cb 0.32 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 2d87 h LEU 13 CO 0.02 0.63 -0.02 -0.78 -0.34 0.00 0.00 178.44 177.96 2d87 h ASP 14 N 1.06 0.81 0.24 1.25 1.82 -1.19 -3.13 116.42 117.28 2d87 h ASP 14 Ca 0.31 -0.32 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 2d87 h ASP 14 Cb -0.05 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 39.74 2d87 h ASP 14 CO -0.09 0.93 -0.12 -0.25 -1.61 0.00 0.00 179.24 178.10 2d87 h TRP 15 N 0.66 -0.30 -0.98 0.28 7.01 -0.42 -2.87 115.95 119.34 2d87 h TRP 15 Ca 0.13 -0.01 0.23 0.00 2.11 0.00 0.00 58.89 61.35 2d87 h TRP 15 Cb 0.53 0.10 -0.18 0.00 -2.10 0.00 0.00 29.16 27.50 2d87 h TRP 15 CO 0.04 -0.02 -0.13 0.00 -2.79 0.00 0.00 178.44 175.54 2d87 h ARG 17 N 0.01 0.28 -0.95 0.00 3.08 -1.48 0.37 114.38 115.68 2d87 h ARG 17 Ca 0.52 -0.03 0.26 0.00 0.07 0.00 0.00 59.98 60.80 2d87 h ARG 17 Cb 0.93 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.88 2d87 h ARG 17 CO -0.97 0.25 0.66 0.00 -1.07 0.00 0.00 179.97 178.84 2d87 h ALA 18 N 1.02 2.69 0.00 0.04 0.00 0.11 1.97 119.26 125.08 2d87 h ALA 18 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2d87 h ALA 18 Cb 0.04 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2d87 h ALA 18 CO -0.01 -0.98 -1.26 1.63 0.00 0.00 0.00 179.25 178.63 2d87 n LYS 19 N -4.35 0.23 -0.19 0.00 4.76 -0.78 -4.20 118.16 113.63 2d87 n LYS 19 Ca 0.20 -0.05 0.09 0.00 -2.87 0.00 0.00 58.31 55.67 2d87 n LYS 19 Cb 0.94 -1.52 0.17 0.00 -1.84 0.00 0.00 35.03 32.77 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 -1.79 1.92 -3.34 -0.18 -1.04 0.15 -4.62 114.28 105.39 2d87 n THR 20 Ca 0.02 -2.00 -0.39 0.00 -2.04 0.00 0.00 64.05 59.63 2d87 n THR 20 Cb 0.41 -0.16 -0.08 0.00 -1.82 0.00 0.00 70.33 68.68 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 -2.65 4.05 0.00 -2.82 1.70 0.62 -4.15 118.95 115.69 2d87 s ARG 21 Ca 0.33 0.15 0.00 0.00 -0.47 0.00 0.00 55.73 55.74 2d87 s ARG 21 Cb 0.27 -3.65 0.00 0.00 -0.57 0.00 0.00 34.95 31.01 2d87 s ARG 21 CO 0.05 -0.29 0.00 0.41 -1.08 0.00 0.00 175.30 174.39 2d87 n GLY 22 N 4.53 1.18 3.73 3.88 0.00 -1.26 -5.01 105.19 112.24 2d87 n GLY 22 Ca -0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.72 1.34 0.14 1.61 2.02 -1.26 -5.07 117.35 115.41 2d87 s TYR 23 Ca 0.00 0.57 0.08 0.00 -0.37 0.00 0.00 57.07 57.34 2d87 s TYR 23 Cb 0.00 -3.59 -0.04 0.00 -0.40 0.00 0.00 41.96 37.93 2d87 s TYR 23 CO 0.00 -3.16 -0.07 -2.00 -1.57 0.00 0.00 175.55 168.75 2d87 s GLU 24 N -5.46 2.20 -1.43 -0.62 2.56 -1.26 -4.58 118.70 110.11 2d87 s GLU 24 Ca 0.70 -1.10 -0.03 0.00 0.00 0.00 0.00 54.97 54.54 2d87 s GLU 24 Cb -0.10 -2.29 0.01 0.00 2.00 0.00 0.00 34.13 33.75 2d87 s GLU 24 CO 0.55 0.47 0.23 0.72 -0.56 0.00 0.00 175.26 176.68 2d87 n HIS 25 N 0.29 -1.50 -3.90 5.30 8.25 -1.26 -4.96 115.22 117.44 2d87 n HIS 25 Ca -0.12 0.21 -0.18 0.00 -0.26 0.00 0.00 57.72 57.37 2d87 n HIS 25 Cb 0.54 -3.58 -0.17 0.00 1.12 0.00 0.00 29.99 27.90 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 0.20 -0.22 1.59 1.01 -1.26 -4.87 120.40 113.92 2d87 s VAL 26 Ca 0.14 0.11 -0.04 0.00 0.00 0.00 0.00 61.98 62.19 2d87 s VAL 26 Cb -0.07 -0.32 0.11 0.00 0.00 0.00 0.00 36.38 36.11 2d87 s VAL 26 CO 0.17 0.17 0.33 1.51 0.00 0.00 0.00 175.10 177.28 2d87 s ASP 27 N 1.24 0.55 -0.88 3.32 1.47 -1.26 -4.92 116.67 116.19 2d87 s ASP 27 Ca -0.07 0.18 -0.16 0.00 1.18 0.00 0.00 52.55 53.68 2d87 s ASP 27 Cb -0.13 0.89 0.18 0.00 -0.34 0.00 0.00 42.92 43.51 2d87 s ASP 27 CO -0.02 -0.30 0.94 -0.63 0.68 0.00 0.00 175.17 175.84 2d87 s ILE 28 N 2.48 5.21 -0.09 2.11 1.01 -1.26 -4.76 121.20 125.91 2d87 s ILE 28 Ca 0.09 -2.08 0.17 0.00 0.00 0.00 0.00 60.65 58.83 2d87 s ILE 28 Cb -0.15 -4.62 -0.25 0.00 0.01 0.00 0.00 42.46 37.45 2d87 s ILE 28 CO -0.14 -1.26 0.26 1.67 0.00 0.00 0.00 174.94 175.47 2d87 n GLN 29 N 5.14 0.83 -3.65 2.79 7.27 -1.26 -4.78 117.38 123.73 2d87 n GLN 29 Ca 0.19 -0.10 -0.07 0.00 0.07 0.00 0.00 57.00 57.08 2d87 n GLN 29 Cb 0.48 -1.44 -0.02 0.00 2.41 0.00 0.00 30.24 31.67 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 -4.53 -0.33 -0.69 1.69 4.22 -1.26 -5.05 114.94 108.98 2d87 s ASN 30 Ca -0.07 -0.27 -0.01 0.00 -2.14 0.00 0.00 52.86 50.37 2d87 s ASN 30 Cb 0.09 0.55 0.41 0.00 1.28 0.00 0.00 41.25 43.58 2d87 s ASN 30 CO 0.74 -0.97 1.91 0.49 -2.04 0.00 0.00 177.10 177.23 2d87 n PHE 31 N -0.40 3.11 -0.02 1.54 3.72 -1.26 -4.20 117.46 119.96 2d87 n PHE 31 Ca -0.09 -2.71 -0.03 0.00 -0.05 0.00 0.00 57.45 54.57 2d87 n PHE 31 Cb 0.62 -1.18 -0.01 0.00 -0.94 0.00 0.00 39.48 37.96 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 -0.73 0.83 0.00 4.37 7.64 -1.26 -3.84 113.62 120.62 2d87 n SER 32 Ca 0.57 0.13 0.00 0.00 1.01 0.00 0.00 58.87 60.58 2d87 n SER 32 Cb 0.52 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 2d87 n SER 32 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2d87 n SER 33 N -3.32 4.71 -0.30 6.43 2.88 -1.26 -3.79 113.62 118.97 2d87 n SER 33 Ca -0.05 0.00 0.29 0.00 -1.33 0.00 0.00 58.87 57.78 2d87 n SER 33 Cb 0.18 0.45 0.52 0.00 -0.75 0.00 0.00 64.21 64.61 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 -1.95 0.28 0.01 -3.46 2.88 -1.26 0.22 113.62 110.34 2d87 n SER 34 Ca 0.00 1.38 -0.11 0.00 -1.33 0.00 0.00 58.87 58.81 2d87 n SER 34 Cb 0.47 -0.68 -0.14 0.00 -0.75 0.00 0.00 64.21 63.12 2d87 n SER 34 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 2d87 h TRP 35 N 0.00 0.15 -1.56 0.66 4.06 -1.84 -3.34 115.95 114.07 2d87 h TRP 35 Ca 0.73 -0.11 0.45 0.00 2.06 0.00 0.00 58.89 62.03 2d87 h TRP 35 Cb 2.02 -0.01 -0.06 0.00 -1.00 0.00 0.00 29.16 30.11 2d87 h TRP 35 CO -0.01 1.17 1.12 1.03 -3.56 0.00 0.00 178.44 178.20 2d87 h SER 36 N 0.02 0.00 0.63 -3.49 0.87 0.25 -0.45 113.55 111.38 2d87 h SER 36 Ca -0.25 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.28 2d87 h SER 36 Cb 1.98 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.95 2d87 h SER 36 CO 0.10 -0.00 -0.30 0.44 -0.53 0.00 0.00 176.83 176.54 2d87 h ASP 37 N 0.00 -0.72 0.00 6.23 5.19 -1.63 -3.49 116.42 122.01 2d87 h ASP 37 Ca 0.74 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 57.18 2d87 h ASP 37 Cb 2.98 0.18 0.00 0.00 0.18 0.00 0.00 39.33 42.68 2d87 h ASP 37 CO -0.01 -0.47 0.00 0.61 -3.12 0.00 0.00 179.24 176.25 2d87 n GLY 38 N -1.09 2.44 0.30 2.75 0.00 -0.18 -4.62 105.19 104.80 2d87 n GLY 38 Ca -0.10 -0.46 0.10 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.07 0.00 1.61 2.81 -1.26 -1.41 117.12 118.80 2d87 n MET 39 Ca 0.00 1.30 0.00 0.00 -1.81 0.00 0.00 57.70 57.19 2d87 n MET 39 Cb 0.00 -2.02 0.00 0.00 -0.71 0.00 0.00 33.22 30.49 2d87 n MET 39 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2d87 n ALA 40 N -3.40 0.00 -0.28 3.04 0.00 -1.26 -0.55 120.51 118.06 2d87 n ALA 40 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.58 2d87 n ALA 40 Cb 0.57 0.39 0.02 0.00 0.00 0.00 0.00 19.45 20.43 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 -0.97 -0.12 0.00 0.04 -1.54 -1.71 116.94 112.64 2d87 h PHE 41 Ca 0.00 0.09 0.02 0.00 2.80 0.00 0.00 57.97 60.87 2d87 h PHE 41 Cb 0.00 0.54 -0.03 0.00 2.20 0.00 0.00 35.95 38.66 2d87 h PHE 41 CO -0.69 -0.39 -0.20 0.00 -0.60 0.00 0.00 178.31 176.43 2d87 h ALA 43 N -0.89 -0.30 -1.01 0.00 0.00 -0.31 0.55 119.26 117.30 2d87 h ALA 43 Ca 0.02 0.14 0.34 0.00 0.00 0.00 0.00 54.91 55.42 2d87 h ALA 43 Cb 0.22 1.10 -0.15 0.00 0.00 0.00 0.00 17.79 18.96 2d87 h ALA 43 CO -0.20 -0.83 0.57 1.25 0.00 0.00 0.00 179.25 180.04 2d87 h LEU 44 N -0.13 0.48 0.10 0.00 5.85 -0.78 -1.20 115.31 119.62 2d87 h LEU 44 Ca 0.21 0.20 -0.00 0.00 0.84 0.00 0.00 57.88 59.12 2d87 h LEU 44 Cb 0.53 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.72 2d87 h LEU 44 CO -0.82 -0.19 -0.05 0.58 -0.34 0.00 0.00 178.44 177.63 2d87 h VAL 45 N 0.26 0.37 -1.09 1.05 2.07 0.65 -3.31 116.25 116.25 2d87 h VAL 45 Ca 0.76 -1.13 0.41 0.00 0.82 0.00 0.00 66.70 67.55 2d87 h VAL 45 Cb 1.80 0.67 -0.15 0.00 -1.52 0.00 0.00 31.29 32.10 2d87 h VAL 45 CO -0.63 0.12 0.65 1.57 0.02 0.00 0.00 177.57 179.30 2d87 n HIS 46 N -4.84 0.86 -0.17 1.57 -0.00 0.56 0.15 115.22 113.34 2d87 n HIS 46 Ca -0.04 0.86 -0.02 0.00 -0.00 0.00 0.00 57.72 58.52 2d87 n HIS 46 Cb 0.14 -1.28 0.07 0.00 -0.00 0.00 0.00 29.99 28.93 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 0.19 0.10 0.26 -1.24 -1.35 0.61 115.58 114.15 2d87 h ASN 47 Ca 0.79 0.07 -0.00 0.00 0.71 0.00 0.00 56.30 57.86 2d87 h ASN 47 Cb 2.33 0.05 0.00 0.00 0.73 0.00 0.00 38.32 41.43 2d87 h ASN 47 CO -0.57 0.13 -0.05 -0.26 -1.29 0.00 0.00 177.43 175.40 2d87 h PHE 48 N 0.37 -0.12 -3.01 0.67 0.04 0.12 -3.41 116.94 111.59 2d87 h PHE 48 Ca 0.26 -0.00 -0.62 0.00 2.80 0.00 0.00 57.97 60.41 2d87 h PHE 48 Cb 0.29 0.04 -0.40 0.00 2.20 0.00 0.00 35.95 38.07 2d87 h PHE 48 CO -0.17 0.40 -0.71 -0.06 -0.60 0.00 0.00 178.31 177.18 2d87 s PHE 49 N -3.13 2.45 0.22 -0.55 0.08 -0.64 -4.95 117.98 111.47 2d87 s PHE 49 Ca -0.13 -2.76 -0.01 0.00 0.12 0.00 0.00 56.93 54.15 2d87 s PHE 49 Cb -0.00 -2.13 0.21 0.00 -0.57 0.00 0.00 43.02 40.53 2d87 s PHE 49 CO 0.50 -0.73 1.59 -1.00 -0.10 0.00 0.00 175.22 175.48 2d87 h PRO 50 N 6.27 0.55 -0.31 0.24 0.13 -1.11 -3.20 132.00 134.57 2d87 h PRO 50 Ca 0.04 -0.29 -0.11 0.00 -0.87 0.00 0.00 66.00 64.78 2d87 h PRO 50 Cb 0.88 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 2d87 h PRO 50 CO 0.56 0.87 -0.23 0.93 -0.23 0.00 0.00 178.00 179.90 2d87 h GLU 51 N 0.45 0.70 -1.18 0.86 5.08 -1.92 -3.10 114.58 115.46 2d87 h GLU 51 Ca 0.04 -0.34 0.44 0.00 -1.00 0.00 0.00 59.36 58.49 2d87 h GLU 51 Cb 0.92 -0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.02 2d87 h GLU 51 CO 0.08 0.95 0.71 0.00 -1.00 0.00 0.00 179.01 179.75 2d87 h ALA 52 N 0.73 2.47 -1.95 3.43 0.00 -1.94 -3.40 119.26 118.61 2d87 h ALA 52 Ca 0.06 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2d87 h ALA 52 Cb 0.79 0.27 -0.21 0.00 0.00 0.00 0.00 17.79 18.64 2d87 h ALA 52 CO 0.06 -1.19 0.19 -0.59 0.00 0.00 0.00 179.25 177.72 2d87 s PHE 53 N -5.41 -0.70 0.00 0.00 -0.71 -1.17 -4.96 117.98 105.03 2d87 s PHE 53 Ca -0.08 1.54 -0.30 0.00 -1.04 0.00 0.00 56.93 57.05 2d87 s PHE 53 Cb 0.32 0.33 -0.03 0.00 -1.21 0.00 0.00 43.02 42.43 2d87 s PHE 53 CO 0.80 -0.44 0.99 -0.51 -1.34 0.00 0.00 175.22 174.72 2d87 s ASP 54 N -0.23 7.36 -0.10 1.98 1.11 -1.26 -4.70 116.67 120.83 2d87 s ASP 54 Ca -0.04 1.67 -0.02 0.00 0.18 0.00 0.00 52.55 54.35 2d87 s ASP 54 Cb -0.03 -2.57 -0.01 0.00 1.07 0.00 0.00 42.92 41.38 2d87 s ASP 54 CO 0.04 -0.27 -0.04 0.22 1.18 0.00 0.00 175.17 176.30 2d87 h TYR 55 N 6.80 0.00 -0.21 4.23 3.20 -1.97 -3.33 116.97 125.69 2d87 h TYR 55 Ca -0.41 0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.52 2d87 h TYR 55 Cb 1.22 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 2d87 h TYR 55 CO 0.68 0.00 0.61 0.78 -1.64 0.00 0.00 178.16 178.59 2d87 h GLY 56 N -0.89 0.00 1.43 1.82 0.00 -2.00 0.48 103.07 103.91 2d87 h GLY 56 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 2d87 h GLY 56 CO 0.00 0.00 -0.45 1.46 0.00 0.00 0.00 176.54 177.55 2d87 h GLN 57 N 0.00 0.62 -7.18 4.80 1.08 -1.98 -3.45 115.11 109.00 2d87 h GLN 57 Ca 0.10 -0.34 -0.42 0.00 -1.45 0.00 0.00 58.65 56.54 2d87 h GLN 57 Cb 1.33 0.02 0.20 0.00 -0.05 0.00 0.00 27.48 28.98 2d87 h GLN 57 CO -0.00 0.94 0.01 -0.51 -0.95 0.00 0.00 178.83 178.33 2d87 s LEU 58 N -8.51 0.33 0.04 1.46 1.43 0.17 -5.07 118.68 108.53 2d87 s LEU 58 Ca -0.08 1.14 0.01 0.00 -1.03 0.00 0.00 54.13 54.17 2d87 s LEU 58 Cb 0.12 -2.92 -0.03 0.00 0.03 0.00 0.00 46.19 43.39 2d87 s LEU 58 CO 0.84 -4.39 -0.06 -0.44 0.23 0.00 0.00 176.35 172.53 2d87 s SER 59 N -3.02 0.65 0.36 2.29 0.01 -1.26 -5.05 113.70 107.69 2d87 s SER 59 Ca 0.68 -0.64 0.15 0.00 1.31 0.00 0.00 55.95 57.46 2d87 s SER 59 Cb -0.19 0.08 0.69 0.00 0.21 0.00 0.00 66.02 66.81 2d87 s SER 59 CO 0.61 -0.31 1.77 1.55 0.41 0.00 0.00 173.24 177.27 2d87 h PRO 60 N 4.22 0.00 0.00 12.44 0.13 -1.98 -2.90 132.00 143.91 2d87 h PRO 60 Ca -0.34 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.72 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 0.46 0.41 -0.34 0.37 -0.23 0.00 0.00 178.00 178.67 2d87 h GLN 61 N 0.00 0.00 -6.27 0.86 5.75 -1.96 -3.42 115.11 110.07 2d87 h GLN 61 Ca -0.00 0.00 -0.57 0.00 -0.15 0.00 0.00 58.65 57.92 2d87 h GLN 61 Cb 0.80 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.32 2d87 h GLN 61 CO 0.05 0.34 1.27 -0.80 -2.65 0.00 0.00 178.83 177.04 2d87 s ASN 62 N -6.90 5.89 -0.06 -0.69 0.01 -1.10 -4.85 114.94 107.25 2d87 s ASN 62 Ca -0.03 1.23 -0.10 0.00 -0.71 0.00 0.00 52.86 53.25 2d87 s ASN 62 Cb 0.14 -2.53 -0.30 0.00 0.41 0.00 0.00 41.25 38.98 2d87 s ASN 62 CO 0.72 -1.72 0.63 0.03 -1.51 0.00 0.00 177.10 175.24 2d87 h ARG 63 N 12.84 0.37 0.00 -0.60 2.47 -1.82 -3.32 114.38 124.33 2d87 h ARG 63 Ca -0.33 -0.63 0.00 0.00 -1.26 0.00 0.00 59.98 57.76 2d87 h ARG 63 Cb 1.16 0.24 0.00 0.00 -1.65 0.00 0.00 29.97 29.72 2d87 h ARG 63 CO 1.04 1.29 -0.22 0.00 0.56 0.00 0.00 179.97 182.65 2d87 h ARG 64 N 0.10 0.00 -0.91 0.04 3.08 -1.90 -3.34 114.38 111.46 2d87 h ARG 64 Ca -0.35 0.00 0.17 0.00 0.07 0.00 0.00 59.98 59.87 2d87 h ARG 64 Cb 2.09 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 31.97 2d87 h ARG 64 CO 0.16 0.00 -0.27 0.94 -1.07 0.00 0.00 179.97 179.74 2d87 n GLN 65 N -3.93 -0.12 -0.23 0.04 7.27 -1.26 0.10 117.38 119.25 2d87 n GLN 65 Ca -0.03 1.41 0.03 0.00 0.07 0.00 0.00 57.00 58.48 2d87 n GLN 65 Cb 0.11 -2.10 0.14 0.00 2.41 0.00 0.00 30.24 30.80 2d87 n GLN 65 CO 0.00 0.00 0.00 -0.91 0.07 0.00 0.00 177.06 176.22 2d87 h ASN 66 N 0.00 -0.16 0.32 1.69 2.35 -1.75 0.24 115.58 118.27 2d87 h ASN 66 Ca 0.40 0.15 -0.02 0.00 -0.55 0.00 0.00 56.30 56.29 2d87 h ASN 66 Cb 0.63 0.25 0.00 0.00 0.05 0.00 0.00 38.32 39.24 2d87 h ASN 66 CO -0.92 -0.09 -0.15 -0.26 -1.65 0.00 0.00 177.43 174.35 2d87 h PHE 67 N 0.18 -0.40 -0.02 1.19 -1.00 0.57 -2.71 116.94 114.76 2d87 h PHE 67 Ca 0.37 -0.01 0.01 0.00 2.81 0.00 0.00 57.97 61.15 2d87 h PHE 67 Cb 0.62 0.13 -0.02 0.00 3.61 0.00 0.00 35.95 40.30 2d87 h PHE 67 CO -0.33 -0.06 -0.17 0.93 -1.61 0.00 0.00 178.31 177.07 2d87 h GLU 68 N -0.94 -0.19 -0.84 1.51 5.08 -0.43 -1.03 114.58 117.74 2d87 h GLU 68 Ca -0.04 0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.51 2d87 h GLU 68 Cb 0.51 0.04 -0.16 0.00 0.50 0.00 0.00 28.75 29.65 2d87 h GLU 68 CO 0.07 -0.13 -0.15 0.28 -1.00 0.00 0.00 179.01 178.09 2d87 h VAL 69 N -0.20 0.17 -0.87 3.13 2.07 -0.68 0.80 116.25 120.67 2d87 h VAL 69 Ca 0.01 -0.01 0.14 0.00 0.82 0.00 0.00 66.70 67.66 2d87 h VAL 69 Cb 0.22 0.15 -0.07 0.00 -1.52 0.00 0.00 31.29 30.07 2d87 h VAL 69 CO -0.12 0.00 0.56 0.00 0.02 0.00 0.00 177.57 178.04 2d87 h ALA 70 N 1.84 1.84 0.01 1.67 0.00 -1.05 -1.05 119.26 122.51 2d87 h ALA 70 Ca 0.43 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 2d87 h ALA 70 Cb 0.70 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2d87 h ALA 70 CO -0.84 -0.07 -0.01 0.74 0.00 0.00 0.00 179.25 179.07 2d87 h PHE 71 N 0.68 -0.01 -0.92 0.00 0.04 0.18 -3.31 116.94 113.60 2d87 h PHE 71 Ca 0.43 -0.00 0.08 0.00 2.80 0.00 0.00 57.97 61.28 2d87 h PHE 71 Cb 0.69 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 38.73 2d87 h PHE 71 CO -0.00 -0.01 -0.54 0.43 -0.60 0.00 0.00 178.31 177.59 2d87 n SER 72 N -2.17 -0.97 -0.42 2.17 7.64 -0.09 0.11 113.62 119.89 2d87 n SER 72 Ca -0.00 1.68 0.36 0.00 1.01 0.00 0.00 58.87 61.92 2d87 n SER 72 Cb 0.01 -0.24 0.62 0.00 -1.01 0.00 0.00 64.21 63.59 2d87 n SER 72 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2d87 n SER 73 N -5.09 0.21 0.09 6.43 3.41 -0.40 -0.45 113.62 117.81 2d87 n SER 73 Ca 0.02 1.31 -0.05 0.00 -0.26 0.00 0.00 58.87 59.89 2d87 n SER 73 Cb 0.24 -0.65 -0.02 0.00 -0.26 0.00 0.00 64.21 63.52 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 1.52 -0.32 -0.42 7.33 0.00 0.73 -3.25 119.26 124.85 2d87 h ALA 74 Ca 0.81 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.77 2d87 h ALA 74 Cb 2.55 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 20.45 2d87 h ALA 74 CO -0.47 -0.30 0.68 1.49 0.00 0.00 0.00 179.25 180.65 2d87 h GLU 75 N -1.05 0.00 0.00 0.00 4.81 -0.07 0.52 114.58 118.78 2d87 h GLU 75 Ca -0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2d87 h GLU 75 Cb 0.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.62 2d87 h GLU 75 CO 0.05 0.00 0.00 2.41 -0.73 0.00 0.00 179.01 180.74 2d87 n THR 76 N -3.26 0.00 0.24 0.32 -1.04 0.09 -1.59 114.28 109.05 2d87 n THR 76 Ca 0.08 1.43 0.05 0.00 -2.04 0.00 0.00 64.05 63.57 2d87 n THR 76 Cb 0.83 -2.08 -0.07 0.00 -1.82 0.00 0.00 70.33 67.19 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 -2.42 0.00 0.06 -1.42 1.44 -1.03 -4.49 115.22 107.36 2d87 n HIS 77 Ca 0.00 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.74 2d87 n HIS 77 Cb 0.00 -0.13 -0.05 0.00 0.12 0.00 0.00 29.99 29.93 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 1.25 0.62 -6.72 1.59 0.00 -0.09 -3.48 119.26 112.43 2d87 h ALA 78 Ca 0.00 -0.59 -0.54 0.00 0.00 0.00 0.00 54.91 53.77 2d87 h ALA 78 Cb 0.38 0.19 -0.10 0.00 0.00 0.00 0.00 17.79 18.26 2d87 h ALA 78 CO 0.00 0.65 -0.93 -3.47 0.00 0.00 0.00 179.25 175.50 2d87 n ASP 79 N -2.85 -0.37 -4.76 0.00 2.03 -0.62 -4.84 116.55 105.14 2d87 n ASP 79 Ca -0.06 -1.12 -0.40 0.00 0.52 0.00 0.00 54.79 53.72 2d87 n ASP 79 Cb 0.75 -2.47 -0.05 0.00 -0.72 0.00 0.00 41.12 38.63 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 -1.36 2.53 -0.93 0.00 0.04 -1.26 -4.72 135.00 129.29 2d87 s PRO 81 Ca 0.43 -0.63 -0.29 0.00 0.04 0.00 0.00 61.00 60.55 2d87 s PRO 81 Cb -0.29 -5.13 -0.20 0.00 0.04 0.00 0.00 34.50 28.92 2d87 s PRO 81 CO 0.36 -3.62 2.64 1.04 0.04 0.00 0.00 177.00 177.46 2d87 n GLN 82 N 8.63 0.14 -0.07 4.56 6.02 -1.26 -4.76 117.38 130.64 2d87 n GLN 82 Ca 0.42 -0.01 -0.04 0.00 -0.01 0.00 0.00 57.00 57.36 2d87 n GLN 82 Cb 0.47 -1.75 -0.02 0.00 1.02 0.00 0.00 30.24 29.96 2d87 n GLN 82 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2d87 h LEU 83 N 13.03 0.00 -9.87 1.08 3.38 -2.01 -3.48 115.31 117.45 2d87 h LEU 83 Ca -0.07 -0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.36 2d87 h LEU 83 Cb 1.30 0.00 0.21 0.00 0.09 0.00 0.00 40.66 42.25 2d87 h LEU 83 CO 1.37 0.75 -0.35 0.18 0.09 0.00 0.00 178.44 180.47 2d87 n LEU 84 N -4.62 0.85 -3.89 1.67 4.77 -1.26 -4.97 117.00 109.54 2d87 n LEU 84 Ca -0.07 0.41 -0.29 0.00 -0.03 0.00 0.00 56.01 56.03 2d87 n LEU 84 Cb 0.26 -1.27 -0.13 0.00 -2.33 0.00 0.00 43.42 39.94 2d87 n LEU 84 CO 0.10 -3.18 -0.13 1.51 -1.33 0.00 0.00 177.39 174.37 2d87 s ASP 85 N -2.02 4.39 0.25 -1.43 1.47 -1.26 -4.97 116.67 113.09 2d87 s ASP 85 Ca 0.61 -3.33 0.00 0.00 1.18 0.00 0.00 52.55 51.01 2d87 s ASP 85 Cb -0.24 -1.56 0.58 0.00 -0.34 0.00 0.00 42.92 41.36 2d87 s ASP 85 CO 0.63 -0.17 1.28 0.41 0.68 0.00 0.00 175.17 178.00 2d87 n THR 86 N 2.66 -0.34 -0.26 2.11 -1.04 -1.26 0.17 114.28 116.33 2d87 n THR 86 Ca 0.12 1.81 0.06 0.00 -2.04 0.00 0.00 64.05 64.00 2d87 n THR 86 Cb 0.34 -2.61 0.20 0.00 -1.82 0.00 0.00 70.33 66.44 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 0.35 0.07 -2.82 4.39 -2.00 0.17 114.58 114.73 2d87 h GLU 87 Ca 0.48 -0.02 -0.25 0.00 0.34 0.00 0.00 59.36 59.90 2d87 h GLU 87 Cb 0.94 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 2d87 h GLU 87 CO -0.78 0.23 -1.19 0.22 -1.16 0.00 0.00 179.01 176.33 2d87 h ASP 88 N 0.36 0.22 -0.35 1.42 3.58 0.14 -3.32 116.42 118.46 2d87 h ASP 88 Ca 0.43 -0.25 0.00 0.00 0.42 0.00 0.00 57.03 57.64 2d87 h ASP 88 Cb 0.72 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.68 2d87 h ASP 88 CO -0.47 1.20 0.22 0.24 -2.88 0.00 0.00 179.24 177.55 2d87 h MET 89 N 0.04 0.47 0.02 0.28 2.86 0.10 -0.87 114.93 117.83 2d87 h MET 89 Ca -0.10 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 2d87 h MET 89 Cb 1.89 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 33.45 2d87 h MET 89 CO 0.16 0.34 -0.03 0.28 1.06 0.00 0.00 176.91 178.72 2d87 h VAL 90 N 0.47 0.00 -0.73 -2.22 2.07 -0.85 -2.83 116.25 112.17 2d87 h VAL 90 Ca 0.13 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.80 2d87 h VAL 90 Cb -0.02 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.64 2d87 h VAL 90 CO -0.03 0.00 0.17 0.08 0.02 0.00 0.00 177.57 177.82 2d87 h ARG 91 N -0.05 0.26 -6.28 1.57 0.11 -1.66 -3.40 114.38 104.94 2d87 h ARG 91 Ca -0.00 -0.02 -0.55 0.00 0.10 0.00 0.00 59.98 59.52 2d87 h ARG 91 Cb 0.05 -0.06 0.02 0.00 1.11 0.00 0.00 29.97 31.08 2d87 h ARG 91 CO -0.01 0.17 1.28 1.28 0.10 0.00 0.00 179.97 182.80 2d87 n LEU 92 N -5.15 3.96 -0.32 0.08 4.77 -0.33 -4.83 117.00 115.16 2d87 n LEU 92 Ca 0.14 0.76 0.27 0.00 -0.03 0.00 0.00 56.01 57.15 2d87 n LEU 92 Cb 0.45 -1.53 0.50 0.00 -2.33 0.00 0.00 43.42 40.51 2d87 n LEU 92 CO 0.13 0.01 0.98 0.54 -1.33 0.00 0.00 177.39 177.72 2d87 n ARG 93 N 7.76 -0.06 -3.69 3.23 5.12 -1.26 -4.49 116.66 123.26 2d87 n ARG 93 Ca 0.22 1.40 -0.14 0.00 -1.93 0.00 0.00 57.85 57.40 2d87 n ARG 93 Cb 0.41 -2.43 -0.08 0.00 -1.16 0.00 0.00 32.46 29.19 2d87 n ARG 93 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 2d87 s GLU 94 N -5.64 0.68 0.02 5.56 2.02 -1.26 -4.98 118.70 115.10 2d87 s GLU 94 Ca -0.10 0.41 -0.30 0.00 0.02 0.00 0.00 54.97 54.99 2d87 s GLU 94 Cb 0.32 0.32 -0.06 0.00 0.10 0.00 0.00 34.13 34.82 2d87 s GLU 94 CO 0.77 -0.14 1.44 -1.25 0.02 0.00 0.00 175.26 176.10 2d87 s PRO 95 N -0.37 4.27 -0.31 0.39 0.04 -1.25 -4.91 135.00 132.87 2d87 s PRO 95 Ca -0.05 2.02 -0.36 0.00 0.04 0.00 0.00 61.00 62.66 2d87 s PRO 95 Cb -0.03 -3.56 -0.12 0.00 0.04 0.00 0.00 34.50 30.83 2d87 s PRO 95 CO 0.03 -0.59 2.11 -0.25 0.04 0.00 0.00 177.00 178.34 2d87 n ASP 96 N 5.34 2.32 -0.33 6.66 9.92 -1.26 -4.71 116.55 134.49 2d87 n ASP 96 Ca 0.13 0.54 0.27 0.00 -0.53 0.00 0.00 54.79 55.20 2d87 n ASP 96 Cb 0.43 -1.27 0.52 0.00 -0.64 0.00 0.00 41.12 40.16 2d87 n ASP 96 CO 0.00 0.00 0.00 4.11 0.13 0.00 0.00 177.20 181.44 2d87 h TRP 97 N 11.57 0.84 -0.84 1.24 5.08 -1.90 0.81 115.95 132.76 2d87 h TRP 97 Ca -0.32 0.04 0.11 0.00 1.08 0.00 0.00 58.89 59.81 2d87 h TRP 97 Cb 1.31 -0.20 -0.08 0.00 -3.00 0.00 0.00 29.16 27.19 2d87 h TRP 97 CO 0.93 -0.33 0.47 0.87 -1.28 0.00 0.00 178.44 179.10 2d87 h LYS 98 N 0.16 0.73 0.23 0.12 1.57 -1.88 -0.70 116.57 116.80 2d87 h LYS 98 Ca 0.78 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.51 2d87 h LYS 98 Cb 1.92 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 34.07 2d87 h LYS 98 CO -0.69 0.48 -0.11 0.00 -0.57 0.00 0.00 179.45 178.56 2d87 h VAL 100 N -0.54 0.00 -0.73 0.00 2.07 -1.38 0.31 116.25 115.99 2d87 h VAL 100 Ca -0.03 0.00 0.29 0.00 0.82 0.00 0.00 66.70 67.77 2d87 h VAL 100 Cb 0.24 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.88 2d87 h VAL 100 CO 0.05 0.00 0.32 0.00 0.02 0.00 0.00 177.57 177.97 2d87 n TYR 101 N -4.71 0.78 0.28 1.57 4.19 -0.28 0.85 117.16 119.84 2d87 n TYR 101 Ca 0.00 0.86 -0.15 0.00 3.31 0.00 0.00 57.90 61.92 2d87 n TYR 101 Cb 0.22 -1.24 -0.08 0.00 0.49 0.00 0.00 39.34 38.72 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 0.40 -0.12 2.97 2.02 -0.45 -2.55 112.91 115.19 2d87 h THR 102 Ca 0.59 -0.32 0.04 0.00 0.77 0.00 0.00 66.41 67.48 2d87 h THR 102 Cb 1.50 0.52 -0.00 0.00 -1.74 0.00 0.00 68.15 68.43 2d87 h THR 102 CO -0.58 0.05 0.60 0.22 0.37 0.00 0.00 175.52 176.17 2d87 h TYR 103 N -0.92 0.00 0.14 3.16 3.20 0.68 0.42 116.97 123.65 2d87 h TYR 103 Ca -0.07 0.00 -0.20 0.00 3.14 0.00 0.00 58.73 61.60 2d87 h TYR 103 Cb 0.61 0.00 0.02 0.00 1.54 0.00 0.00 36.73 38.90 2d87 h TYR 103 CO -0.00 0.00 -0.92 0.82 -1.64 0.00 0.00 178.16 176.42 2d87 h ILE 104 N 0.00 1.43 -0.11 1.81 1.08 -1.02 -2.71 117.51 118.00 2d87 h ILE 104 Ca 0.06 -2.52 -0.22 0.00 -0.39 0.00 0.00 64.86 61.79 2d87 h ILE 104 Cb 1.26 3.12 0.01 0.00 -3.07 0.00 0.00 36.82 38.14 2d87 h ILE 104 CO -0.00 0.72 -0.80 0.06 -0.69 0.00 0.00 178.15 177.43 2d87 h GLN 105 N -0.36 0.73 -0.59 2.37 3.07 -0.03 0.11 115.11 120.42 2d87 h GLN 105 Ca -0.17 -0.64 -0.08 0.00 0.09 0.00 0.00 58.65 57.84 2d87 h GLN 105 Cb 1.67 0.15 -0.02 0.00 0.08 0.00 0.00 27.48 29.36 2d87 h GLN 105 CO 0.14 1.25 0.04 1.49 0.09 0.00 0.00 178.83 181.83 2d87 h GLU 106 N 0.44 1.00 0.01 0.06 4.57 -0.80 -1.55 114.58 118.30 2d87 h GLU 106 Ca -0.07 -0.28 -0.00 0.00 -1.18 0.00 0.00 59.36 57.83 2d87 h GLU 106 Cb 1.44 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.92 2d87 h GLU 106 CO 0.16 0.96 -0.01 0.35 -1.18 0.00 0.00 179.01 179.30 2d87 h PHE 107 N 0.92 -0.01 -0.46 0.92 3.57 -1.51 -3.20 116.94 117.18 2d87 h PHE 107 Ca 0.17 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.80 2d87 h PHE 107 Cb 0.49 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 2d87 h PHE 107 CO 0.03 0.77 0.33 -0.92 -2.23 0.00 0.00 178.31 176.29 2d87 h TYR 108 N -0.84 0.02 -0.34 0.41 3.20 -0.98 0.12 116.97 118.54 2d87 h TYR 108 Ca -0.00 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.75 2d87 h TYR 108 Cb 0.79 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 2d87 h TYR 108 CO 0.21 0.01 -0.27 -0.09 -1.64 0.00 0.00 178.16 176.37 2d87 h ARG 109 N 0.02 0.71 0.01 1.82 2.43 -1.32 -3.18 114.38 114.86 2d87 h ARG 109 Ca 0.22 -0.31 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 2d87 h ARG 109 Cb 0.84 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 2d87 h ARG 109 CO -0.01 0.91 -0.00 0.00 -1.51 0.00 0.00 179.97 179.36 2d87 h LEU 111 N -0.22 -0.96 -0.84 0.00 3.38 -1.48 0.20 115.31 115.40 2d87 h LEU 111 Ca -0.00 0.24 0.20 0.00 0.09 0.00 0.00 57.88 58.41 2d87 h LEU 111 Cb 0.22 0.54 -0.15 0.00 0.09 0.00 0.00 40.66 41.36 2d87 h LEU 111 CO 0.00 -0.28 0.03 0.58 0.09 0.00 0.00 178.44 178.87 2d87 h VAL 112 N -0.06 0.25 -0.09 1.22 2.07 -1.54 0.21 116.25 118.31 2d87 h VAL 112 Ca 0.31 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.76 2d87 h VAL 112 Cb 0.56 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2d87 h VAL 112 CO -0.77 0.02 -0.12 1.56 0.02 0.00 0.00 177.57 178.28 2d87 h GLN 113 N 0.10 0.24 -0.94 1.57 7.50 -0.75 -3.15 115.11 119.68 2d87 h GLN 113 Ca 0.48 -0.14 0.17 0.00 0.50 0.00 0.00 58.65 59.66 2d87 h GLN 113 Cb 0.89 0.01 -0.08 0.00 0.05 0.00 0.00 27.48 28.35 2d87 h GLN 113 CO -0.73 0.69 0.60 0.87 -1.50 0.00 0.00 178.83 178.75 2d87 h LYS 114 N -0.19 0.68 0.00 1.46 1.79 0.83 -3.45 116.57 117.69 2d87 h LYS 114 Ca 0.01 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 2d87 h LYS 114 Cb 0.65 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 2d87 h LYS 114 CO 0.03 0.45 0.00 0.41 -1.08 0.00 0.00 179.45 179.26 2d87 n GLY 115 N -1.41 1.65 0.13 3.86 0.00 0.56 -5.03 105.19 104.96 2d87 n GLY 115 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.94 -4.94 117.00 114.92 2d87 n LEU 116 Ca 0.00 0.22 -0.30 0.00 -0.03 0.00 0.00 56.01 55.90 2d87 n LEU 116 Cb 0.00 -1.09 -0.11 0.00 -2.33 0.00 0.00 43.42 39.89 2d87 n LEU 116 CO 0.00 0.78 -0.46 -0.69 -1.33 0.00 0.00 177.39 175.69 2d87 s VAL 117 N -2.53 3.03 0.46 4.08 1.01 -1.25 -5.00 120.40 120.21 2d87 s VAL 117 Ca -0.24 -1.31 -0.23 0.00 0.00 0.00 0.00 61.98 60.20 2d87 s VAL 117 Cb 0.07 -2.37 -0.07 0.00 0.00 0.00 0.00 36.38 34.01 2d87 s VAL 117 CO 0.74 0.18 1.22 -0.75 0.00 0.00 0.00 175.10 176.48 2d87 s LYS 118 N -1.94 3.69 0.02 2.72 2.47 -1.26 -4.35 119.74 121.08 2d87 s LYS 118 Ca 0.18 1.91 -0.39 0.00 -1.56 0.00 0.00 55.97 56.11 2d87 s LYS 118 Cb -0.11 -2.44 -0.19 0.00 -1.46 0.00 0.00 37.83 33.63 2d87 s LYS 118 CO 0.10 -0.65 1.11 2.41 0.16 0.00 0.00 175.35 178.48 2d87 n THR 119 N -0.47 0.02 -0.80 3.43 -1.04 -1.26 -4.85 114.28 109.31 2d87 n THR 119 Ca 0.07 -0.01 -0.34 0.00 -2.04 0.00 0.00 64.05 61.74 2d87 n THR 119 Cb 0.47 -0.14 0.12 0.00 -1.82 0.00 0.00 70.33 68.96 2d87 n THR 119 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2d87 n LYS 120 N 1.66 -0.59 -0.68 -2.82 5.02 -1.26 -4.91 118.16 114.58 2d87 n LYS 120 Ca 0.20 -0.15 -0.31 0.00 -2.02 0.00 0.00 58.31 56.03 2d87 n LYS 120 Cb 0.10 -1.65 0.17 0.00 -0.02 0.00 0.00 35.03 33.63 2d87 n LYS 120 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2d87 n LYS 121 N -1.00 -0.66 -1.11 1.97 2.85 -1.26 -4.91 118.16 114.05 2d87 n LYS 121 Ca 0.03 -0.14 -0.36 0.00 -1.05 0.00 0.00 58.31 56.80 2d87 n LYS 121 Cb 0.58 -2.20 0.07 0.00 -0.65 0.00 0.00 35.03 32.82 2d87 n LYS 121 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2d87 n SER 122 N -3.51 -2.62 -3.36 -5.58 3.41 -1.26 -4.97 113.62 95.73 2d87 n SER 122 Ca 0.09 0.46 -0.22 0.00 -0.26 0.00 0.00 58.87 58.95 2d87 n SER 122 Cb 0.53 -1.08 0.16 0.00 -0.26 0.00 0.00 64.21 63.56 2d87 n SER 122 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2d87 n SER 123 N 0.55 -0.60 0.00 4.04 7.64 -1.26 -4.84 113.62 119.15 2d87 n SER 123 Ca 0.07 -1.22 0.00 0.00 1.01 0.00 0.00 58.87 58.72 2d87 n SER 123 Cb 0.51 -0.75 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 2d87 n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d87 n GLY 124 N -1.93 1.44 0.00 0.23 0.00 -1.26 -4.85 105.19 98.82 2d87 n GLY 124 Ca 0.12 -0.41 0.07 0.00 0.00 0.00 0.00 46.02 45.80 2d87 n GLY 124 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d87 n PRO 125 N 0.00 0.06 -1.32 1.61 -0.04 -1.26 -4.31 135.00 129.73 2d87 n PRO 125 Ca 0.00 0.22 -0.41 0.00 -0.04 0.00 0.00 63.50 63.27 2d87 n PRO 125 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2d87 n PRO 125 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2d87 n SER 126 N -1.44 3.39 -0.01 3.54 3.41 -1.26 -4.30 113.62 116.95 2d87 n SER 126 Ca 0.04 -2.70 0.08 0.00 -0.26 0.00 0.00 58.87 56.03 2d87 n SER 126 Cb 0.15 -1.31 -0.11 0.00 -0.26 0.00 0.00 64.21 62.68 2d87 n SER 126 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2d87 n SER 127 N 6.61 1.41 0.00 4.04 3.41 -1.26 -5.14 113.62 122.70 2d87 n SER 127 Ca 0.51 -0.11 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 2d87 n SER 127 Cb 0.37 1.61 0.00 0.00 -0.26 0.00 0.00 64.21 65.93 2d87 n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49