#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 -0.20 -1.74 1.61 1.04 -1.26 -4.96 113.70 108.19 2d87 s SER 2 Ca 0.00 -0.61 -0.15 0.00 0.48 0.00 0.00 55.95 55.67 2d87 s SER 2 Cb 0.00 0.67 0.14 0.00 0.10 0.00 0.00 66.02 66.94 2d87 s SER 2 CO 0.00 -1.26 0.42 -1.54 0.98 0.00 0.00 173.24 171.84 2d87 n SER 3 N -0.58 -1.02 0.00 7.02 3.41 -1.26 -4.73 113.62 116.46 2d87 n SER 3 Ca -0.05 -1.22 0.00 0.00 -0.26 0.00 0.00 58.87 57.34 2d87 n SER 3 Cb 0.60 -1.78 0.00 0.00 -0.26 0.00 0.00 64.21 62.77 2d87 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d87 n GLY 4 N -1.63 -0.28 3.56 5.00 0.00 -1.26 -5.05 105.19 105.54 2d87 n GLY 4 Ca -0.05 -1.42 -0.22 0.00 0.00 0.00 0.00 46.02 44.33 2d87 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d87 n SER 5 N 0.00 -4.46 -3.70 1.61 7.64 -1.26 -5.00 113.62 108.44 2d87 n SER 5 Ca 0.00 -0.60 -0.14 0.00 1.01 0.00 0.00 58.87 59.14 2d87 n SER 5 Cb 0.00 -4.95 -0.08 0.00 -1.01 0.00 0.00 64.21 58.16 2d87 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2d87 s SER 6 N -3.75 -0.37 0.33 6.43 0.15 -1.26 -5.04 113.70 110.19 2d87 s SER 6 Ca 0.35 0.48 0.00 0.00 0.70 0.00 0.00 55.95 57.48 2d87 s SER 6 Cb -0.16 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 64.71 2d87 s SER 6 CO 0.74 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 175.41 2d87 n GLY 7 N 1.74 -1.97 0.03 9.45 0.00 -1.26 -4.10 105.19 109.08 2d87 n GLY 7 Ca -0.18 -1.18 0.08 0.00 0.00 0.00 0.00 46.02 44.73 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 -3.96 0.26 0.31 -0.61 -0.00 -1.26 -4.18 119.36 109.91 2d87 n ILE 8 Ca 0.00 -0.56 0.16 0.00 -0.00 0.00 0.00 62.75 62.35 2d87 n ILE 8 Cb 0.60 -0.10 0.71 0.00 -0.00 0.00 0.00 39.64 40.85 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 3.64 -2.01 -2.84 116.57 115.75 2d87 h LYS 9 Ca -0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2d87 h LYS 9 Cb 1.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2d87 h LYS 9 CO 0.01 0.00 -0.20 0.37 -2.27 0.00 0.00 179.45 177.36 2d87 h GLN 10 N 0.00 0.00 -1.19 1.90 5.75 -1.73 -3.32 115.11 116.52 2d87 h GLN 10 Ca 0.00 0.00 0.40 0.00 -0.15 0.00 0.00 58.65 58.90 2d87 h GLN 10 Cb 0.29 0.00 -0.14 0.00 1.07 0.00 0.00 27.48 28.70 2d87 h GLN 10 CO 0.00 0.00 0.74 0.00 -2.65 0.00 0.00 178.83 176.92 2d87 h MET 11 N -0.54 0.14 0.77 1.69 -0.00 -1.73 0.19 114.93 115.45 2d87 h MET 11 Ca 0.00 -0.01 -0.03 0.00 -0.00 0.00 0.00 59.70 59.66 2d87 h MET 11 Cb 0.20 -0.03 -0.00 0.00 -0.00 0.00 0.00 31.60 31.77 2d87 h MET 11 CO 0.00 0.09 -0.45 -0.07 -0.00 0.00 0.00 176.91 176.48 2d87 h LEU 12 N 0.14 -1.12 -0.19 -0.10 3.38 -1.67 0.30 115.31 116.06 2d87 h LEU 12 Ca 0.79 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.87 2d87 h LEU 12 Cb 2.28 0.32 -0.07 0.00 0.09 0.00 0.00 40.66 43.28 2d87 h LEU 12 CO -0.49 -0.70 -0.41 0.25 0.09 0.00 0.00 178.44 177.17 2d87 h LEU 13 N -1.13 -1.30 -0.71 1.67 5.85 -1.07 0.12 115.31 118.73 2d87 h LEU 13 Ca -0.10 0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.88 2d87 h LEU 13 Cb 0.90 0.54 -0.07 0.00 0.37 0.00 0.00 40.66 42.40 2d87 h LEU 13 CO 0.12 -0.41 0.37 0.44 -0.34 0.00 0.00 178.44 178.63 2d87 h ASP 14 N -0.45 0.51 -0.81 1.25 5.19 -1.39 -1.52 116.42 119.20 2d87 h ASP 14 Ca 0.09 0.05 0.02 0.00 -0.62 0.00 0.00 57.03 56.58 2d87 h ASP 14 Cb 0.61 -0.04 -0.05 0.00 0.18 0.00 0.00 39.33 40.03 2d87 h ASP 14 CO -0.43 0.30 0.52 -0.25 -3.12 0.00 0.00 179.24 176.27 2d87 h TRP 15 N 0.65 0.99 -0.78 4.55 7.01 0.84 -2.29 115.95 126.92 2d87 h TRP 15 Ca 0.34 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.41 2d87 h TRP 15 Cb 0.32 -0.33 -0.05 0.00 -2.10 0.00 0.00 29.16 27.00 2d87 h TRP 15 CO -0.09 0.58 0.48 0.00 -2.79 0.00 0.00 178.44 176.62 2d87 h ARG 17 N 0.92 0.67 0.67 0.00 3.08 -0.99 0.22 114.38 118.95 2d87 h ARG 17 Ca 0.32 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.30 2d87 h ARG 17 Cb 0.07 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 29.98 2d87 h ARG 17 CO -0.13 0.44 -0.32 0.00 -1.07 0.00 0.00 179.97 178.89 2d87 h ALA 18 N 1.64 -0.90 -0.64 0.04 0.00 -1.09 -2.45 119.26 115.86 2d87 h ALA 18 Ca 0.27 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2d87 h ALA 18 Cb 0.19 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2d87 h ALA 18 CO -0.08 -0.91 0.27 0.87 0.00 0.00 0.00 179.25 179.40 2d87 h LYS 19 N -1.09 0.93 -1.07 0.00 1.79 -1.26 -2.13 116.57 113.73 2d87 h LYS 19 Ca -0.09 -0.14 -0.21 0.00 -2.18 0.00 0.00 60.65 58.03 2d87 h LYS 19 Cb 0.72 -0.16 -0.12 0.00 -1.58 0.00 0.00 32.23 31.09 2d87 h LYS 19 CO 0.15 0.75 0.26 2.41 -1.08 0.00 0.00 179.45 181.95 2d87 n THR 20 N -4.32 1.95 -2.59 -0.16 -1.04 0.75 -4.86 114.28 104.01 2d87 n THR 20 Ca 0.06 -0.83 -0.40 0.00 -2.04 0.00 0.00 64.05 60.84 2d87 n THR 20 Cb 0.16 -0.87 -0.05 0.00 -1.82 0.00 0.00 70.33 67.76 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 -1.30 4.71 0.00 -2.82 0.52 -0.80 -3.46 118.95 115.80 2d87 s ARG 21 Ca 0.22 1.66 0.00 0.00 -0.52 0.00 0.00 55.73 57.10 2d87 s ARG 21 Cb 0.19 -3.20 0.00 0.00 0.52 0.00 0.00 34.95 32.46 2d87 s ARG 21 CO 0.04 0.32 0.00 0.41 0.02 0.00 0.00 175.30 176.09 2d87 n GLY 22 N 1.27 2.38 3.49 -3.53 0.00 -1.26 -4.98 105.19 102.56 2d87 n GLY 22 Ca -0.01 -0.18 -0.49 0.00 0.00 0.00 0.00 46.02 45.34 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 1.71 -2.07 1.61 4.02 -1.22 -4.92 117.16 116.29 2d87 n TYR 23 Ca 0.00 0.16 -0.34 0.00 -0.01 0.00 0.00 57.90 57.72 2d87 n TYR 23 Cb 0.00 -2.59 0.02 0.00 -0.02 0.00 0.00 39.34 36.75 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 6.21 3.21 -1.10 -0.72 2.12 -1.26 -3.63 118.70 123.53 2d87 s GLU 24 Ca 1.07 1.41 -0.07 0.00 0.36 0.00 0.00 54.97 57.74 2d87 s GLU 24 Cb -0.71 -2.00 0.01 0.00 0.26 0.00 0.00 34.13 31.68 2d87 s GLU 24 CO 0.45 -0.93 0.96 0.72 -0.54 0.00 0.00 175.26 175.92 2d87 n HIS 25 N -1.81 -2.33 -3.53 5.30 8.25 -1.26 -5.01 115.22 114.82 2d87 n HIS 25 Ca 0.10 0.82 -0.18 0.00 -0.26 0.00 0.00 57.72 58.20 2d87 n HIS 25 Cb 0.52 -4.26 -0.14 0.00 1.12 0.00 0.00 29.99 27.23 2d87 n HIS 25 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2d87 s VAL 26 N -3.26 -0.31 -0.52 1.59 1.01 -1.24 -4.78 120.40 112.90 2d87 s VAL 26 Ca 0.47 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.46 2d87 s VAL 26 Cb -0.21 -0.61 0.16 0.00 0.00 0.00 0.00 36.38 35.72 2d87 s VAL 26 CO 0.59 -0.15 0.37 -1.81 0.00 0.00 0.00 175.10 174.10 2d87 s ASP 27 N 2.31 3.28 -0.90 3.32 1.01 -1.26 -4.99 116.67 119.45 2d87 s ASP 27 Ca 0.06 -3.22 -0.24 0.00 0.71 0.00 0.00 52.55 49.86 2d87 s ASP 27 Cb -0.15 -1.03 -0.02 0.00 1.01 0.00 0.00 42.92 42.73 2d87 s ASP 27 CO -0.11 -0.17 1.79 -0.63 0.21 0.00 0.00 175.17 176.26 2d87 s ILE 28 N -0.39 3.57 -0.23 0.77 1.01 -1.26 -4.68 121.20 119.98 2d87 s ILE 28 Ca 0.26 -0.38 0.08 0.00 0.00 0.00 0.00 60.65 60.60 2d87 s ILE 28 Cb -0.07 -4.30 -0.20 0.00 0.01 0.00 0.00 42.46 37.90 2d87 s ILE 28 CO -0.13 -1.23 -0.12 0.00 0.00 0.00 0.00 174.94 173.47 2d87 n GLN 29 N 8.92 0.68 -3.52 2.79 1.13 -1.26 -4.90 117.38 121.21 2d87 n GLN 29 Ca 0.35 0.09 -0.16 0.00 -1.94 0.00 0.00 57.00 55.34 2d87 n GLN 29 Cb 0.49 -1.51 -0.05 0.00 0.11 0.00 0.00 30.24 29.27 2d87 n GLN 29 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2d87 s ASN 30 N -6.11 -0.58 -0.06 1.08 4.22 -1.26 -5.03 114.94 107.20 2d87 s ASN 30 Ca -0.26 0.45 -0.02 0.00 -2.14 0.00 0.00 52.86 50.90 2d87 s ASN 30 Cb 0.08 0.53 -0.04 0.00 1.28 0.00 0.00 41.25 43.10 2d87 s ASN 30 CO 0.67 -0.69 2.42 0.49 -2.04 0.00 0.00 177.10 177.95 2d87 n PHE 31 N 0.59 0.24 0.00 1.54 3.72 -1.26 -3.60 117.46 118.69 2d87 n PHE 31 Ca -0.19 -1.27 0.00 0.00 -0.05 0.00 0.00 57.45 55.95 2d87 n PHE 31 Cb 0.59 -0.85 0.00 0.00 -0.94 0.00 0.00 39.48 38.28 2d87 n PHE 31 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2d87 n SER 32 N 1.58 0.00 -0.88 4.37 2.88 -1.26 -3.38 113.62 116.93 2d87 n SER 32 Ca 0.16 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.74 2d87 n SER 32 Cb 0.61 -0.35 0.07 0.00 -0.75 0.00 0.00 64.21 63.79 2d87 n SER 32 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2d87 n SER 33 N -2.46 1.03 0.10 -3.46 3.41 -1.26 -3.44 113.62 107.54 2d87 n SER 33 Ca 0.00 -2.50 0.05 0.00 -0.26 0.00 0.00 58.87 56.16 2d87 n SER 33 Cb 0.00 -0.33 -0.00 0.00 -0.26 0.00 0.00 64.21 63.62 2d87 n SER 33 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2d87 h SER 34 N 0.60 0.00 0.00 4.04 0.02 -1.90 -3.35 113.55 112.96 2d87 h SER 34 Ca -0.09 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.63 2d87 h SER 34 Cb 1.48 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.98 2d87 h SER 34 CO 0.04 0.36 -2.21 0.79 -1.14 0.00 0.00 176.83 174.67 2d87 n TRP 35 N -2.97 0.00 -0.55 3.45 7.02 -1.26 -4.41 117.44 118.72 2d87 n TRP 35 Ca -0.02 0.00 0.43 0.00 -1.02 0.00 0.00 57.50 56.89 2d87 n TRP 35 Cb 0.71 -0.79 0.69 0.00 -2.42 0.00 0.00 31.31 29.49 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 -2.55 0.09 0.07 -0.99 3.41 -1.26 0.77 113.62 113.15 2d87 n SER 36 Ca -0.22 1.07 -0.11 0.00 -0.26 0.00 0.00 58.87 59.35 2d87 n SER 36 Cb 0.93 -0.53 -0.05 0.00 -0.26 0.00 0.00 64.21 64.30 2d87 n SER 36 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2d87 h ASP 37 N 0.00 -0.59 0.00 4.04 2.03 -1.80 -3.48 116.42 116.62 2d87 h ASP 37 Ca 0.83 0.08 0.00 0.00 -0.73 0.00 0.00 57.03 57.21 2d87 h ASP 37 Cb 3.05 0.24 0.00 0.00 -0.83 0.00 0.00 39.33 41.79 2d87 h ASP 37 CO -0.20 -0.27 0.00 0.61 -1.03 0.00 0.00 179.24 178.35 2d87 n GLY 38 N -1.33 2.40 0.33 7.15 0.00 0.23 -4.67 105.19 109.30 2d87 n GLY 38 Ca -0.05 -0.67 0.13 0.00 0.00 0.00 0.00 46.02 45.43 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 0.03 -0.08 1.61 2.86 -1.84 -1.91 114.93 115.60 2d87 h MET 39 Ca 0.00 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2d87 h MET 39 Cb 0.00 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 2d87 h MET 39 CO 0.00 0.02 -0.05 0.00 1.06 0.00 0.00 176.91 177.94 2d87 n ALA 40 N -3.09 -0.05 -0.22 6.32 0.00 -1.26 -0.46 120.51 121.75 2d87 n ALA 40 Ca 0.22 0.07 -0.10 0.00 0.00 0.00 0.00 53.44 53.63 2d87 n ALA 40 Cb 0.72 0.32 -0.06 0.00 0.00 0.00 0.00 19.45 20.44 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 -1.48 -0.12 0.00 0.04 -1.63 -2.25 116.94 111.50 2d87 h PHE 41 Ca 0.01 0.09 0.02 0.00 2.80 0.00 0.00 57.97 60.89 2d87 h PHE 41 Cb 0.03 0.73 -0.03 0.00 2.20 0.00 0.00 35.95 38.87 2d87 h PHE 41 CO -0.71 -0.44 -0.27 0.00 -0.60 0.00 0.00 178.31 176.30 2d87 n ALA 43 N -2.83 -0.24 -0.32 0.00 0.00 0.39 0.91 120.51 118.42 2d87 n ALA 43 Ca -0.02 0.32 0.07 0.00 0.00 0.00 0.00 53.44 53.81 2d87 n ALA 43 Cb 0.18 0.11 0.17 0.00 0.00 0.00 0.00 19.45 19.91 2d87 n ALA 43 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2d87 h LEU 44 N 0.00 -0.68 0.68 0.00 5.85 -1.13 -1.04 115.31 118.99 2d87 h LEU 44 Ca 0.06 0.26 -0.03 0.00 0.84 0.00 0.00 57.88 59.01 2d87 h LEU 44 Cb 0.15 0.51 0.01 0.00 0.37 0.00 0.00 40.66 41.70 2d87 h LEU 44 CO -0.35 -0.29 -0.33 0.58 -0.34 0.00 0.00 178.44 177.70 2d87 h VAL 45 N 0.02 0.00 -0.87 1.05 2.07 0.92 -3.10 116.25 116.33 2d87 h VAL 45 Ca 0.47 -0.26 0.36 0.00 0.82 0.00 0.00 66.70 68.08 2d87 h VAL 45 Cb 0.81 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.42 2d87 h VAL 45 CO -0.89 0.00 0.43 1.57 0.02 0.00 0.00 177.57 178.70 2d87 n HIS 46 N -5.19 0.98 -0.16 1.57 -0.00 0.92 0.15 115.22 113.48 2d87 n HIS 46 Ca -0.11 1.03 -0.02 0.00 -0.00 0.00 0.00 57.72 58.61 2d87 n HIS 46 Cb 0.36 -1.42 0.07 0.00 -0.00 0.00 0.00 29.99 29.00 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 0.01 0.33 0.26 -1.24 -1.15 -1.04 115.58 112.75 2d87 h ASN 47 Ca 0.72 0.09 -0.02 0.00 0.71 0.00 0.00 56.30 57.81 2d87 h ASN 47 Cb 1.89 0.12 0.00 0.00 0.73 0.00 0.00 38.32 41.06 2d87 h ASN 47 CO -0.68 0.03 -0.16 -0.26 -1.29 0.00 0.00 177.43 175.07 2d87 h PHE 48 N 0.24 -0.41 -3.42 0.67 0.04 0.13 -3.40 116.94 110.78 2d87 h PHE 48 Ca 0.26 -0.01 -0.67 0.00 2.80 0.00 0.00 57.97 60.35 2d87 h PHE 48 Cb 0.34 0.14 -0.38 0.00 2.20 0.00 0.00 35.95 38.25 2d87 h PHE 48 CO -0.23 -0.26 -0.44 -0.06 -0.60 0.00 0.00 178.31 176.72 2d87 s PHE 49 N -3.22 3.40 0.21 -0.55 0.40 -0.91 -4.92 117.98 112.39 2d87 s PHE 49 Ca -0.07 -2.97 -0.02 0.00 -0.60 0.00 0.00 56.93 53.27 2d87 s PHE 49 Cb 0.01 -3.03 0.19 0.00 0.51 0.00 0.00 43.02 40.70 2d87 s PHE 49 CO 0.20 -0.76 1.57 -1.00 0.70 0.00 0.00 175.22 175.93 2d87 h PRO 50 N 6.55 0.59 0.00 0.24 0.13 -1.41 -3.00 132.00 135.10 2d87 h PRO 50 Ca 0.00 -0.31 -0.09 0.00 -0.87 0.00 0.00 66.00 64.74 2d87 h PRO 50 Cb 0.89 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 2d87 h PRO 50 CO 0.72 0.90 -0.42 1.05 -0.23 0.00 0.00 178.00 180.02 2d87 h GLU 51 N 0.48 0.00 -0.92 0.86 4.11 -1.91 -3.06 114.58 114.14 2d87 h GLU 51 Ca 0.04 0.00 0.14 0.00 0.07 0.00 0.00 59.36 59.60 2d87 h GLU 51 Cb 0.93 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.10 2d87 h GLU 51 CO 0.08 0.42 0.59 0.00 0.07 0.00 0.00 179.01 180.17 2d87 h ALA 52 N 1.58 1.74 -1.67 1.06 0.00 -1.91 -3.43 119.26 116.63 2d87 h ALA 52 Ca -0.00 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2d87 h ALA 52 Cb 0.87 -0.15 -0.23 0.00 0.00 0.00 0.00 17.79 18.28 2d87 h ALA 52 CO 0.05 0.01 0.43 -0.59 0.00 0.00 0.00 179.25 179.15 2d87 s PHE 53 N -5.76 -0.48 0.17 0.00 -0.71 -1.16 -4.99 117.98 105.06 2d87 s PHE 53 Ca -0.10 1.00 -0.30 0.00 -1.04 0.00 0.00 56.93 56.49 2d87 s PHE 53 Cb 0.22 0.40 -0.07 0.00 -1.21 0.00 0.00 43.02 42.36 2d87 s PHE 53 CO 0.79 -0.34 0.98 -0.51 -1.34 0.00 0.00 175.22 174.80 2d87 s ASP 54 N -0.52 7.51 -0.10 1.98 1.11 -1.26 -4.74 116.67 120.65 2d87 s ASP 54 Ca -0.01 1.90 -0.06 0.00 0.18 0.00 0.00 52.55 54.57 2d87 s ASP 54 Cb -0.02 -2.60 -0.02 0.00 1.07 0.00 0.00 42.92 41.35 2d87 s ASP 54 CO -0.00 -0.02 -0.11 0.22 1.18 0.00 0.00 175.17 176.44 2d87 h TYR 55 N 4.98 0.00 -1.27 4.23 3.20 -1.96 -3.37 116.97 122.77 2d87 h TYR 55 Ca -0.44 0.00 0.42 0.00 3.14 0.00 0.00 58.73 61.85 2d87 h TYR 55 Cb 1.21 0.00 -0.13 0.00 1.54 0.00 0.00 36.73 39.35 2d87 h TYR 55 CO 0.63 0.00 0.81 0.78 -1.64 0.00 0.00 178.16 178.74 2d87 h GLY 56 N -0.74 1.39 0.75 1.82 0.00 -2.02 0.81 103.07 105.08 2d87 h GLY 56 Ca 0.00 -0.13 0.07 0.00 0.00 0.00 0.00 47.33 47.27 2d87 h GLY 56 CO 0.00 -0.41 0.63 1.46 0.00 0.00 0.00 176.54 178.23 2d87 h GLN 57 N 0.11 1.09 -7.15 4.80 1.08 -2.00 -3.42 115.11 109.62 2d87 h GLN 57 Ca 0.80 -0.07 -0.53 0.00 -1.45 0.00 0.00 58.65 57.40 2d87 h GLN 57 Cb 2.44 -0.25 0.14 0.00 -0.05 0.00 0.00 27.48 29.76 2d87 h GLN 57 CO -0.44 0.72 0.42 -0.51 -0.95 0.00 0.00 178.83 178.07 2d87 s LEU 58 N -10.12 3.43 0.12 1.46 1.43 0.28 -5.04 118.68 110.24 2d87 s LEU 58 Ca -0.12 2.35 0.08 0.00 -1.03 0.00 0.00 54.13 55.41 2d87 s LEU 58 Cb 0.20 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.79 2d87 s LEU 58 CO 0.81 -2.02 -0.14 -0.44 0.23 0.00 0.00 176.35 174.79 2d87 s SER 59 N -1.94 4.10 0.23 2.29 0.01 -1.26 -5.04 113.70 112.10 2d87 s SER 59 Ca 0.75 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 57.50 2d87 s SER 59 Cb -0.29 -0.66 0.25 0.00 0.21 0.00 0.00 66.02 65.53 2d87 s SER 59 CO 0.41 0.16 1.60 1.55 0.41 0.00 0.00 173.24 177.38 2d87 h PRO 60 N 3.55 0.47 -0.26 12.44 0.13 -1.96 -3.01 132.00 143.36 2d87 h PRO 60 Ca -0.49 -0.25 -0.00 0.00 -0.87 0.00 0.00 66.00 64.39 2d87 h PRO 60 Cb 1.17 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2d87 h PRO 60 CO 0.49 0.82 0.14 0.37 -0.23 0.00 0.00 178.00 179.60 2d87 h GLN 61 N 0.38 0.34 -6.26 0.86 4.15 -1.96 -3.41 115.11 109.21 2d87 h GLN 61 Ca 0.03 -0.03 -0.56 0.00 0.77 0.00 0.00 58.65 58.86 2d87 h GLN 61 Cb 0.93 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.52 2d87 h GLN 61 CO 0.08 0.25 1.17 -0.80 -1.93 0.00 0.00 178.83 177.61 2d87 s ASN 62 N -6.82 6.29 -0.16 -0.69 0.01 -1.14 -4.87 114.94 107.55 2d87 s ASN 62 Ca -0.07 1.72 -0.12 0.00 -0.71 0.00 0.00 52.86 53.68 2d87 s ASN 62 Cb 0.17 -2.53 -0.23 0.00 0.41 0.00 0.00 41.25 39.07 2d87 s ASN 62 CO 0.71 -1.32 0.28 0.54 -1.51 0.00 0.00 177.10 175.80 2d87 n ARG 63 N 7.77 0.68 0.10 -0.60 5.12 -1.26 -3.90 116.66 124.57 2d87 n ARG 63 Ca 0.20 0.37 -0.04 0.00 -1.93 0.00 0.00 57.85 56.45 2d87 n ARG 63 Cb 0.45 -1.71 -0.02 0.00 -1.16 0.00 0.00 32.46 30.02 2d87 n ARG 63 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2d87 h ARG 64 N -0.35 -0.27 -0.60 5.56 3.08 -1.93 -3.22 114.38 116.66 2d87 h ARG 64 Ca -0.41 0.02 0.05 0.00 0.07 0.00 0.00 59.98 59.71 2d87 h ARG 64 Cb 1.76 0.06 -0.07 0.00 0.08 0.00 0.00 29.97 31.80 2d87 h ARG 64 CO -0.04 -0.18 -0.35 0.94 -1.07 0.00 0.00 179.97 179.27 2d87 n GLN 65 N -3.38 -0.26 -0.29 0.04 7.27 -1.26 0.11 117.38 119.60 2d87 n GLN 65 Ca -0.03 1.30 0.14 0.00 0.07 0.00 0.00 57.00 58.48 2d87 n GLN 65 Cb 0.11 -1.92 0.27 0.00 2.41 0.00 0.00 30.24 31.11 2d87 n GLN 65 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2d87 n ASN 66 N -4.35 -0.06 0.18 1.69 3.02 -1.25 -0.32 115.26 114.16 2d87 n ASN 66 Ca 0.01 1.43 -0.11 0.00 -0.03 0.00 0.00 54.58 55.88 2d87 n ASN 66 Cb 0.16 -0.54 -0.06 0.00 -0.61 0.00 0.00 39.78 38.73 2d87 n ASN 66 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 2d87 h PHE 67 N 0.00 -0.47 0.00 3.10 -1.00 -0.33 -2.93 116.94 115.31 2d87 h PHE 67 Ca 0.53 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 61.30 2d87 h PHE 67 Cb 1.13 0.16 0.00 0.00 3.61 0.00 0.00 35.95 40.85 2d87 h PHE 67 CO -0.39 -0.18 0.00 0.39 -1.61 0.00 0.00 178.31 176.52 2d87 n GLU 68 N -5.13 0.00 -0.30 1.51 -0.58 0.43 -1.44 120.64 115.13 2d87 n GLU 68 Ca -0.08 0.56 0.01 0.00 -0.42 0.00 0.00 57.16 57.24 2d87 n GLU 68 Cb 0.26 -1.35 0.06 0.00 -0.57 0.00 0.00 31.44 29.84 2d87 n GLU 68 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2d87 n VAL 69 N -1.92 -0.38 -0.27 2.62 0.31 0.56 0.19 118.33 119.44 2d87 n VAL 69 Ca 0.00 1.83 0.05 0.00 -0.01 0.00 0.00 64.34 66.20 2d87 n VAL 69 Cb 0.00 -2.46 0.19 0.00 -0.91 0.00 0.00 33.84 30.66 2d87 n VAL 69 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2d87 h ALA 70 N 1.28 1.12 -0.12 3.52 0.00 -1.29 0.23 119.26 124.00 2d87 h ALA 70 Ca 0.31 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2d87 h ALA 70 Cb 0.51 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2d87 h ALA 70 CO -0.79 -0.12 0.00 1.19 0.00 0.00 0.00 179.25 179.53 2d87 n PHE 71 N -4.91 0.00 -0.26 0.00 3.72 0.49 -3.57 117.46 112.93 2d87 n PHE 71 Ca 0.14 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.47 2d87 n PHE 71 Cb 0.38 -0.48 -0.03 0.00 -0.94 0.00 0.00 39.48 38.40 2d87 n PHE 71 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2d87 h SER 72 N 0.00 -1.59 -0.73 4.37 0.87 -1.03 0.17 113.55 115.61 2d87 h SER 72 Ca 0.00 0.27 0.25 0.00 -1.23 0.00 0.00 61.79 61.07 2d87 h SER 72 Cb 0.00 0.73 -0.14 0.00 -0.44 0.00 0.00 62.40 62.56 2d87 h SER 72 CO 0.00 -0.32 0.17 -1.54 -0.53 0.00 0.00 176.83 174.62 2d87 n SER 73 N -5.39 0.06 0.01 6.23 3.41 0.81 0.82 113.62 119.56 2d87 n SER 73 Ca 0.03 1.24 -0.12 0.00 -0.26 0.00 0.00 58.87 59.75 2d87 n SER 73 Cb 0.34 -0.51 -0.09 0.00 -0.26 0.00 0.00 64.21 63.69 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 1.47 -0.10 0.00 7.33 0.00 -0.73 -3.09 119.26 124.15 2d87 h ALA 74 Ca 0.52 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2d87 h ALA 74 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2d87 h ALA 74 CO -0.64 -0.24 0.23 1.49 0.00 0.00 0.00 179.25 180.10 2d87 h GLU 75 N -0.73 0.00 0.08 0.00 4.81 0.94 0.51 114.58 120.18 2d87 h GLU 75 Ca -0.01 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 2d87 h GLU 75 Cb 0.59 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.92 2d87 h GLU 75 CO 0.02 0.00 -0.40 1.15 -0.73 0.00 0.00 179.01 179.05 2d87 h THR 76 N 0.00 0.19 0.00 0.32 2.02 -0.74 -2.39 112.91 112.30 2d87 h THR 76 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2d87 h THR 76 Cb 0.47 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 2d87 h THR 76 CO 0.00 0.00 -0.97 0.00 0.37 0.00 0.00 175.52 174.92 2d87 n HIS 77 N -5.45 0.00 0.69 3.16 1.44 -0.94 -4.63 115.22 109.48 2d87 n HIS 77 Ca -0.07 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.76 2d87 n HIS 77 Cb 0.37 0.00 0.14 0.00 0.12 0.00 0.00 29.99 30.62 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 -1.47 3.25 -4.05 1.59 0.00 0.18 -4.96 120.51 115.04 2d87 n ALA 78 Ca 0.00 -0.33 -0.27 0.00 0.00 0.00 0.00 53.44 52.85 2d87 n ALA 78 Cb 0.00 -1.09 -0.08 0.00 0.00 0.00 0.00 19.45 18.27 2d87 n ALA 78 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2d87 n ASP 79 N -1.90 0.74 -4.75 0.00 2.03 -0.90 -4.82 116.55 106.95 2d87 n ASP 79 Ca 0.03 -1.09 -0.41 0.00 0.52 0.00 0.00 54.79 53.84 2d87 n ASP 79 Cb 0.41 -1.36 -0.04 0.00 -0.72 0.00 0.00 41.12 39.41 2d87 n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2d87 s PRO 81 N -0.83 2.83 -0.35 0.00 0.04 -1.26 -4.70 135.00 130.73 2d87 s PRO 81 Ca 0.47 0.80 -0.34 0.00 0.04 0.00 0.00 61.00 61.97 2d87 s PRO 81 Cb -0.30 -4.33 -0.11 0.00 0.04 0.00 0.00 34.50 29.81 2d87 s PRO 81 CO 0.37 -2.48 2.22 1.04 0.04 0.00 0.00 177.00 178.18 2d87 n GLN 82 N 8.96 1.15 -0.12 4.56 1.13 -1.26 -4.81 117.38 126.99 2d87 n GLN 82 Ca 0.21 0.30 -0.26 0.00 -1.94 0.00 0.00 57.00 55.31 2d87 n GLN 82 Cb 0.51 -2.57 -0.11 0.00 0.11 0.00 0.00 30.24 28.18 2d87 n GLN 82 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2d87 n LEU 83 N 10.34 1.93 -4.73 1.08 4.77 -1.26 -4.93 117.00 124.20 2d87 n LEU 83 Ca 0.40 0.37 -0.41 0.00 -0.03 0.00 0.00 56.01 56.34 2d87 n LEU 83 Cb 0.26 -0.89 -0.03 0.00 -2.33 0.00 0.00 43.42 40.43 2d87 n LEU 83 CO 0.75 0.45 0.88 -0.76 -1.33 0.00 0.00 177.39 177.38 2d87 s LEU 84 N -7.66 4.44 -0.83 2.23 1.43 -1.26 -4.98 118.68 112.04 2d87 s LEU 84 Ca -0.34 2.19 -0.17 0.00 -1.03 0.00 0.00 54.13 54.78 2d87 s LEU 84 Cb 0.11 -3.60 0.17 0.00 0.03 0.00 0.00 46.19 42.89 2d87 s LEU 84 CO 0.54 -0.39 0.90 -0.62 0.23 0.00 0.00 176.35 177.02 2d87 s ASP 85 N 0.29 6.62 0.22 2.29 -1.08 -1.26 -4.92 116.67 118.82 2d87 s ASP 85 Ca 0.54 -2.23 -0.11 0.00 -0.52 0.00 0.00 52.55 50.23 2d87 s ASP 85 Cb -0.32 -2.30 0.29 0.00 -1.46 0.00 0.00 42.92 39.13 2d87 s ASP 85 CO 0.35 -0.86 1.32 0.41 0.52 0.00 0.00 175.17 176.91 2d87 n THR 86 N 4.84 -0.40 -0.28 1.71 -1.04 -1.26 0.99 114.28 118.84 2d87 n THR 86 Ca 0.14 1.96 0.06 0.00 -2.04 0.00 0.00 64.05 64.17 2d87 n THR 86 Cb 0.47 -2.65 0.16 0.00 -1.82 0.00 0.00 70.33 66.49 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 0.06 0.00 -2.82 4.39 -2.00 0.39 114.58 114.60 2d87 h GLU 87 Ca 0.35 -0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.85 2d87 h GLU 87 Cb 0.56 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.17 2d87 h GLU 87 CO -0.86 0.04 -0.91 -0.44 -1.16 0.00 0.00 179.01 175.69 2d87 h ASP 88 N 0.06 0.00 -0.58 1.42 3.32 0.22 -3.29 116.42 117.58 2d87 h ASP 88 Ca 0.43 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.45 2d87 h ASP 88 Cb 0.75 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.27 2d87 h ASP 88 CO -0.75 0.91 0.24 0.24 -1.72 0.00 0.00 179.24 178.16 2d87 h MET 89 N 0.00 0.85 0.31 3.56 2.86 0.35 0.14 114.93 123.00 2d87 h MET 89 Ca -0.01 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.47 2d87 h MET 89 Cb 1.64 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 33.15 2d87 h MET 89 CO 0.12 0.72 -0.26 0.28 1.06 0.00 0.00 176.91 178.83 2d87 h VAL 90 N 0.79 0.00 -0.68 -2.22 2.07 -0.60 -3.04 116.25 112.57 2d87 h VAL 90 Ca 0.19 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.74 2d87 h VAL 90 Cb 0.18 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.91 2d87 h VAL 90 CO -0.02 0.00 0.43 0.08 0.02 0.00 0.00 177.57 178.08 2d87 h ARG 91 N -0.55 0.81 -6.08 1.57 0.11 -1.64 -3.42 114.38 105.18 2d87 h ARG 91 Ca -0.04 -0.05 -0.67 0.00 0.10 0.00 0.00 59.98 59.33 2d87 h ARG 91 Cb 0.47 -0.18 -0.00 0.00 1.11 0.00 0.00 29.97 31.36 2d87 h ARG 91 CO -0.00 0.54 1.26 1.28 0.10 0.00 0.00 179.97 183.15 2d87 n LEU 92 N -4.67 2.56 -0.59 0.08 4.77 0.49 -4.76 117.00 114.87 2d87 n LEU 92 Ca 0.07 0.64 0.47 0.00 -0.03 0.00 0.00 56.01 57.16 2d87 n LEU 92 Cb 0.07 -1.29 0.75 0.00 -2.33 0.00 0.00 43.42 40.63 2d87 n LEU 92 CO 0.33 -0.52 1.36 0.54 -1.33 0.00 0.00 177.39 177.78 2d87 n ARG 93 N 7.40 -0.02 -3.58 3.23 1.74 -1.26 -4.50 116.66 119.67 2d87 n ARG 93 Ca 0.34 1.17 -0.12 0.00 -0.77 0.00 0.00 57.85 58.46 2d87 n ARG 93 Cb 0.24 -2.49 -0.06 0.00 -1.02 0.00 0.00 32.46 29.13 2d87 n ARG 93 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2d87 s GLU 94 N -5.05 0.72 -0.17 5.56 -1.05 -1.26 -5.02 118.70 112.43 2d87 s GLU 94 Ca -0.06 0.31 -0.29 0.00 -0.15 0.00 0.00 54.97 54.78 2d87 s GLU 94 Cb 0.29 0.34 -0.03 0.00 -0.44 0.00 0.00 34.13 34.29 2d87 s GLU 94 CO 0.86 -0.20 1.58 -1.25 0.95 0.00 0.00 175.26 177.20 2d87 s PRO 95 N -0.80 3.96 -0.02 -4.83 0.04 -1.22 -4.93 135.00 127.19 2d87 s PRO 95 Ca -0.03 1.80 -0.36 0.00 0.04 0.00 0.00 61.00 62.45 2d87 s PRO 95 Cb -0.01 -3.98 -0.14 0.00 0.04 0.00 0.00 34.50 30.40 2d87 s PRO 95 CO 0.02 -1.09 1.68 -0.25 0.04 0.00 0.00 177.00 177.41 2d87 n ASP 96 N 7.83 2.86 -0.01 6.66 8.00 -1.26 -4.56 116.55 136.08 2d87 n ASP 96 Ca 0.18 1.05 -0.09 0.00 0.71 0.00 0.00 54.79 56.63 2d87 n ASP 96 Cb 0.44 -1.31 -0.03 0.00 -0.02 0.00 0.00 41.12 40.20 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 7.16 -0.62 -0.93 1.24 5.08 -1.88 -0.99 115.95 125.01 2d87 h TRP 97 Ca -0.47 0.03 0.38 0.00 1.08 0.00 0.00 58.89 59.92 2d87 h TRP 97 Cb 1.29 0.30 -0.17 0.00 -3.00 0.00 0.00 29.16 27.57 2d87 h TRP 97 CO 0.74 -0.31 0.48 1.63 -1.28 0.00 0.00 178.44 179.70 2d87 n LYS 98 N -5.36 -0.06 -0.01 0.12 4.01 -1.26 -0.58 118.16 115.02 2d87 n LYS 98 Ca -0.02 1.30 -0.01 0.00 -0.51 0.00 0.00 58.31 59.06 2d87 n LYS 98 Cb 0.28 -2.31 -0.00 0.00 -0.51 0.00 0.00 35.03 32.48 2d87 n LYS 98 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2d87 h VAL 100 N -0.86 0.01 -0.99 0.00 2.07 -0.12 0.55 116.25 116.91 2d87 h VAL 100 Ca -0.01 0.00 0.35 0.00 0.82 0.00 0.00 66.70 67.87 2d87 h VAL 100 Cb 0.05 0.01 -0.17 0.00 -1.52 0.00 0.00 31.29 29.66 2d87 h VAL 100 CO 0.01 0.00 0.47 0.22 0.02 0.00 0.00 177.57 178.29 2d87 h TYR 101 N -0.05 0.74 0.81 1.57 3.20 -1.01 0.68 116.97 122.90 2d87 h TYR 101 Ca 0.18 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 62.06 2d87 h TYR 101 Cb 0.47 -0.16 0.01 0.00 1.54 0.00 0.00 36.73 38.59 2d87 h TYR 101 CO -0.96 -0.34 -0.39 1.15 -1.64 0.00 0.00 178.16 175.99 2d87 h THR 102 N 0.14 0.21 -0.42 1.81 2.02 0.02 -2.73 112.91 113.96 2d87 h THR 102 Ca 0.76 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.99 2d87 h THR 102 Cb 1.83 0.21 -0.09 0.00 -1.74 0.00 0.00 68.15 68.36 2d87 h THR 102 CO -0.71 0.00 -0.51 0.22 0.37 0.00 0.00 175.52 174.88 2d87 h TYR 103 N -1.09 -1.55 -1.03 3.16 3.20 -0.58 0.35 116.97 119.43 2d87 h TYR 103 Ca -0.11 0.08 0.32 0.00 3.14 0.00 0.00 58.73 62.16 2d87 h TYR 103 Cb 0.83 0.73 -0.14 0.00 1.54 0.00 0.00 36.73 39.69 2d87 h TYR 103 CO -0.02 -0.47 0.60 0.82 -1.64 0.00 0.00 178.16 177.45 2d87 h ILE 104 N -0.37 0.33 -0.05 1.81 1.08 -1.42 0.30 117.51 119.19 2d87 h ILE 104 Ca 0.10 -0.12 -0.18 0.00 -0.39 0.00 0.00 64.86 64.27 2d87 h ILE 104 Cb 0.59 -0.04 0.01 0.00 -3.07 0.00 0.00 36.82 34.32 2d87 h ILE 104 CO -0.60 0.06 -0.67 -0.61 -0.69 0.00 0.00 178.15 175.64 2d87 h GLN 105 N 0.34 0.54 -0.33 2.37 5.75 -0.35 -1.46 115.11 121.98 2d87 h GLN 105 Ca 0.72 -0.52 0.03 0.00 -0.15 0.00 0.00 58.65 58.73 2d87 h GLN 105 Cb 1.69 0.13 -0.03 0.00 1.07 0.00 0.00 27.48 30.34 2d87 h GLN 105 CO -0.55 1.15 0.14 1.49 -2.65 0.00 0.00 178.83 178.41 2d87 h GLU 106 N 0.13 0.30 0.01 1.69 4.57 0.30 -2.50 114.58 119.08 2d87 h GLU 106 Ca -0.07 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 2d87 h GLU 106 Cb 1.34 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 2d87 h GLU 106 CO 0.13 0.20 -0.01 0.35 -1.18 0.00 0.00 179.01 178.50 2d87 h PHE 107 N 0.31 -0.02 0.00 0.92 3.57 -0.93 -2.91 116.94 117.87 2d87 h PHE 107 Ca 0.14 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.64 2d87 h PHE 107 Cb 0.08 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.82 2d87 h PHE 107 CO -0.11 0.45 0.54 -0.92 -2.23 0.00 0.00 178.31 176.04 2d87 h TYR 108 N -0.49 0.00 0.01 0.41 5.03 -1.13 1.08 116.97 121.87 2d87 h TYR 108 Ca -0.00 0.00 -0.26 0.00 2.58 0.00 0.00 58.73 61.05 2d87 h TYR 108 Cb 0.48 0.00 -0.04 0.00 1.55 0.00 0.00 36.73 38.72 2d87 h TYR 108 CO 0.09 0.00 -1.41 -0.09 -1.32 0.00 0.00 178.16 175.43 2d87 h ARG 109 N 0.00 0.03 0.18 1.82 2.43 -1.25 -3.29 114.38 114.31 2d87 h ARG 109 Ca 0.00 -0.05 -0.30 0.00 -0.81 0.00 0.00 59.98 58.81 2d87 h ARG 109 Cb 1.08 0.02 0.02 0.00 -0.42 0.00 0.00 29.97 30.67 2d87 h ARG 109 CO 0.00 0.77 -1.34 0.00 -1.51 0.00 0.00 179.97 177.90 2d87 h LEU 111 N 0.14 0.03 -0.43 0.00 3.38 -1.33 -2.69 115.31 114.42 2d87 h LEU 111 Ca -0.19 0.03 0.09 0.00 0.09 0.00 0.00 57.88 57.90 2d87 h LEU 111 Cb 2.04 0.03 -0.09 0.00 0.09 0.00 0.00 40.66 42.73 2d87 h LEU 111 CO 0.24 0.05 -0.18 0.58 0.09 0.00 0.00 178.44 179.22 2d87 h VAL 112 N 0.14 0.43 -0.27 1.22 2.07 -1.67 -0.76 116.25 117.42 2d87 h VAL 112 Ca 0.10 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.68 2d87 h VAL 112 Cb 0.09 0.43 -0.07 0.00 -1.52 0.00 0.00 31.29 30.22 2d87 h VAL 112 CO -0.12 0.00 -0.23 1.56 0.02 0.00 0.00 177.57 178.80 2d87 h GLN 113 N -0.09 -0.21 -0.05 1.57 4.20 -1.57 0.15 115.11 119.10 2d87 h GLN 113 Ca 0.21 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.95 2d87 h GLN 113 Cb 0.41 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.24 2d87 h GLN 113 CO -0.49 -0.14 0.05 0.87 -0.67 0.00 0.00 178.83 178.45 2d87 h LYS 114 N -0.21 0.00 0.00 1.46 6.56 -1.04 -3.45 116.57 119.88 2d87 h LYS 114 Ca 0.15 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.74 2d87 h LYS 114 Cb 0.44 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 2d87 h LYS 114 CO -0.40 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.40 2d87 n GLY 115 N -1.41 1.19 0.10 3.86 0.00 0.51 -5.00 105.19 104.45 2d87 n GLY 115 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 2d87 n GLY 115 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2d87 h LEU 116 N 0.00 0.24 -8.26 0.99 3.38 -1.46 -3.46 115.31 106.74 2d87 h LEU 116 Ca 0.00 -0.38 -0.64 0.00 0.09 0.00 0.00 57.88 56.96 2d87 h LEU 116 Cb 0.00 -0.08 -0.33 0.00 0.09 0.00 0.00 40.66 40.34 2d87 h LEU 116 CO 0.00 1.32 -0.86 -0.69 0.09 0.00 0.00 178.44 178.30 2d87 s VAL 117 N -2.61 1.82 0.56 1.22 1.01 -1.25 -4.96 120.40 116.19 2d87 s VAL 117 Ca -0.08 -0.88 -0.18 0.00 0.00 0.00 0.00 61.98 60.84 2d87 s VAL 117 Cb 0.07 -1.58 -0.05 0.00 0.00 0.00 0.00 36.38 34.82 2d87 s VAL 117 CO 0.83 0.51 1.08 -0.75 0.00 0.00 0.00 175.10 176.76 2d87 s LYS 118 N 0.39 3.37 -0.29 2.72 2.47 -1.26 -4.22 119.74 122.92 2d87 s LYS 118 Ca -0.17 1.37 -0.27 0.00 -1.56 0.00 0.00 55.97 55.34 2d87 s LYS 118 Cb -0.17 -2.03 0.01 0.00 -1.46 0.00 0.00 37.83 34.18 2d87 s LYS 118 CO 0.07 -0.79 0.99 0.95 0.16 0.00 0.00 175.35 176.73 2d87 s THR 119 N -2.15 4.63 -0.29 3.43 -4.23 -1.26 -5.01 115.64 110.76 2d87 s THR 119 Ca 0.67 1.66 -0.22 0.00 -1.18 0.00 0.00 61.69 62.62 2d87 s THR 119 Cb -0.19 -4.32 -0.01 0.00 1.34 0.00 0.00 72.50 69.33 2d87 s THR 119 CO 0.31 -0.35 0.70 -0.75 -0.54 0.00 0.00 174.62 173.99 2d87 s LYS 120 N 3.36 3.99 0.10 3.99 2.20 -1.26 -5.01 119.74 127.11 2d87 s LYS 120 Ca 0.42 0.50 -0.31 0.00 -0.36 0.00 0.00 55.97 56.22 2d87 s LYS 120 Cb -0.13 -3.70 -0.10 0.00 -1.51 0.00 0.00 37.83 32.39 2d87 s LYS 120 CO 0.12 -0.56 1.84 0.15 -0.36 0.00 0.00 175.35 176.54 2d87 s LYS 121 N 2.71 4.14 -0.10 4.03 1.02 -1.26 -4.99 119.74 125.30 2d87 s LYS 121 Ca 0.28 2.57 0.02 0.00 0.02 0.00 0.00 55.97 58.86 2d87 s LYS 121 Cb -0.15 -3.72 0.01 0.00 -0.52 0.00 0.00 37.83 33.46 2d87 s LYS 121 CO 0.11 -0.86 -0.14 -1.12 -0.92 0.00 0.00 175.35 172.42 2d87 s SER 122 N 3.05 2.27 -0.06 2.83 0.01 -1.26 -5.09 113.70 115.45 2d87 s SER 122 Ca 0.82 -0.39 -0.39 0.00 1.31 0.00 0.00 55.95 57.29 2d87 s SER 122 Cb -0.45 -1.02 -0.18 0.00 0.21 0.00 0.00 66.02 64.59 2d87 s SER 122 CO 0.37 0.02 1.32 -1.20 0.41 0.00 0.00 173.24 174.16 2d87 n SER 123 N 4.10 1.09 -3.96 2.44 7.64 -1.26 -4.96 113.62 118.72 2d87 n SER 123 Ca -0.20 1.14 -0.09 0.00 1.01 0.00 0.00 58.87 60.73 2d87 n SER 123 Cb 0.51 -1.05 -0.09 0.00 -1.01 0.00 0.00 64.21 62.57 2d87 n SER 123 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2d87 s GLY 124 N 0.98 0.23 1.20 0.23 0.00 -1.26 -5.17 107.32 103.53 2d87 s GLY 124 Ca 0.91 -0.69 -0.19 0.00 0.00 0.00 0.00 44.72 44.75 2d87 s GLY 124 CO 0.57 -0.82 1.11 2.56 0.00 0.00 0.00 173.10 176.52 2d87 s PRO 125 N -2.90 -1.18 -0.19 2.90 0.04 -1.26 -5.04 135.00 127.37 2d87 s PRO 125 Ca -0.02 -0.05 -0.16 0.00 0.04 0.00 0.00 61.00 60.81 2d87 s PRO 125 Cb 0.01 -1.60 -0.07 0.00 0.04 0.00 0.00 34.50 32.88 2d87 s PRO 125 CO -0.06 -3.68 -0.31 0.45 0.04 0.00 0.00 177.00 173.44 2d87 n SER 126 N -4.74 1.92 -4.55 6.66 2.88 -1.26 -4.73 113.62 109.79 2d87 n SER 126 Ca 0.13 0.38 -0.43 0.00 -1.33 0.00 0.00 58.87 57.62 2d87 n SER 126 Cb 0.59 -0.78 -0.00 0.00 -0.75 0.00 0.00 64.21 63.27 2d87 n SER 126 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2d87 s SER 127 N -6.16 6.83 0.00 -3.46 0.15 -1.26 -5.37 113.70 104.44 2d87 s SER 127 Ca -0.28 -2.40 0.00 0.00 0.70 0.00 0.00 55.95 53.96 2d87 s SER 127 Cb 0.05 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 2d87 s SER 127 CO 0.41 -1.14 0.00 0.61 1.20 0.00 0.00 173.24 174.33