#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d87 h SER 2 N 0.00 -0.42 -3.82 1.61 4.64 -2.14 -3.43 113.55 109.99 2d87 h SER 2 Ca 0.00 0.03 -0.56 0.00 -0.47 0.00 0.00 61.79 60.79 2d87 h SER 2 Cb 0.00 0.13 0.17 0.00 -0.31 0.00 0.00 62.40 62.39 2d87 h SER 2 CO 0.00 -0.27 0.19 -0.24 -0.87 0.00 0.00 176.83 175.64 2d87 n SER 3 N -5.29 0.83 -3.24 4.97 2.88 -1.26 -5.02 113.62 107.49 2d87 n SER 3 Ca -0.09 0.71 0.04 0.00 -1.33 0.00 0.00 58.87 58.20 2d87 n SER 3 Cb 0.20 -1.44 -0.03 0.00 -0.75 0.00 0.00 64.21 62.20 2d87 n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2d87 s GLY 4 N -1.55 -0.28 0.02 0.46 0.00 -1.26 -5.17 107.32 99.53 2d87 s GLY 4 Ca 0.76 2.88 0.05 0.00 0.00 0.00 0.00 44.72 48.41 2d87 s GLY 4 CO 0.48 3.54 -0.15 -0.56 0.00 0.00 0.00 173.10 176.40 2d87 s SER 5 N 2.69 1.79 0.72 1.64 0.01 -1.26 -5.15 113.70 114.14 2d87 s SER 5 Ca 0.00 -0.38 -0.09 0.00 1.31 0.00 0.00 55.95 56.80 2d87 s SER 5 Cb -0.08 -0.16 0.06 0.00 0.21 0.00 0.00 66.02 66.05 2d87 s SER 5 CO -0.14 0.11 1.06 -0.94 0.41 0.00 0.00 173.24 173.74 2d87 s SER 6 N -0.79 4.87 0.43 2.44 1.04 -1.26 -4.92 113.70 115.52 2d87 s SER 6 Ca 0.04 0.65 0.00 0.00 0.48 0.00 0.00 55.95 57.12 2d87 s SER 6 Cb -0.07 -1.31 0.00 0.00 0.10 0.00 0.00 66.02 64.74 2d87 s SER 6 CO 0.01 -1.61 0.00 0.61 0.98 0.00 0.00 173.24 173.23 2d87 n GLY 7 N -3.01 -1.76 0.04 7.32 0.00 -1.26 -4.57 105.19 101.95 2d87 n GLY 7 Ca 0.07 -1.13 -0.04 0.00 0.00 0.00 0.00 46.02 44.92 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 -3.91 0.55 0.17 -0.61 5.41 -1.26 -4.52 119.36 115.18 2d87 n ILE 8 Ca 0.01 -0.33 0.16 0.00 1.00 0.00 0.00 62.75 63.59 2d87 n ILE 8 Cb 0.56 -0.80 0.55 0.00 -0.71 0.00 0.00 39.64 39.25 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 -1.31 116.57 117.27 2d87 h LYS 9 Ca -0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2d87 h LYS 9 Cb 1.48 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.30 2d87 h LYS 9 CO 0.01 0.00 0.00 0.94 -2.27 0.00 0.00 179.45 178.13 2d87 n GLN 10 N -3.08 0.00 -0.45 1.90 -0.06 -1.26 -3.73 117.38 110.70 2d87 n GLN 10 Ca 0.05 0.21 0.37 0.00 -2.00 0.00 0.00 57.00 55.63 2d87 n GLN 10 Cb 0.79 -0.65 0.61 0.00 -4.06 0.00 0.00 30.24 26.92 2d87 n GLN 10 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2d87 n MET 11 N -1.67 -0.02 0.21 3.69 0.00 -1.06 0.10 117.12 118.37 2d87 n MET 11 Ca 0.00 1.04 -0.15 0.00 0.00 0.00 0.00 57.70 58.59 2d87 n MET 11 Cb 0.00 -2.12 -0.08 0.00 0.00 0.00 0.00 33.22 31.02 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 -0.41 -0.95 3.17 3.38 -1.42 0.64 115.31 119.72 2d87 h LEU 12 Ca 0.76 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.68 2d87 h LEU 12 Cb 2.60 0.11 -0.04 0.00 0.09 0.00 0.00 40.66 43.41 2d87 h LEU 12 CO -0.32 -0.23 0.45 0.25 0.09 0.00 0.00 178.44 178.69 2d87 h LEU 13 N -0.56 1.07 -0.77 1.67 5.85 0.63 0.13 115.31 123.33 2d87 h LEU 13 Ca -0.05 -0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.48 2d87 h LEU 13 Cb 0.42 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2d87 h LEU 13 CO 0.08 0.87 -0.45 0.44 -0.34 0.00 0.00 178.44 179.04 2d87 h ASP 14 N 1.19 0.00 0.05 1.25 3.32 -1.13 -3.05 116.42 118.05 2d87 h ASP 14 Ca 0.30 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.35 2d87 h ASP 14 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 2d87 h ASP 14 CO -0.05 0.45 -0.02 -0.25 -1.72 0.00 0.00 179.24 177.66 2d87 h TRP 15 N 0.00 -0.06 -0.71 4.55 7.01 0.11 -3.19 115.95 123.66 2d87 h TRP 15 Ca -0.00 -0.00 0.15 0.00 2.11 0.00 0.00 58.89 61.15 2d87 h TRP 15 Cb 1.02 0.02 -0.13 0.00 -2.10 0.00 0.00 29.16 27.97 2d87 h TRP 15 CO 0.00 0.31 -0.06 0.00 -2.79 0.00 0.00 178.44 175.90 2d87 h ARG 17 N 0.07 0.07 -0.54 0.00 3.08 -1.67 0.23 114.38 115.63 2d87 h ARG 17 Ca 0.37 -0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.53 2d87 h ARG 17 Cb 0.62 -0.02 -0.10 0.00 0.08 0.00 0.00 29.97 30.56 2d87 h ARG 17 CO -0.66 0.05 -0.07 0.00 -1.07 0.00 0.00 179.97 178.21 2d87 h ALA 18 N 1.30 0.43 -0.34 0.04 0.00 -0.96 0.34 119.26 120.07 2d87 h ALA 18 Ca 0.16 0.19 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 2d87 h ALA 18 Cb 0.23 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2d87 h ALA 18 CO -0.29 -0.42 -0.22 0.87 0.00 0.00 0.00 179.25 179.19 2d87 h LYS 19 N 0.05 0.76 0.00 0.00 1.79 -0.95 -2.86 116.57 115.36 2d87 h LYS 19 Ca 0.27 -0.36 -0.02 0.00 -2.18 0.00 0.00 60.65 58.37 2d87 h LYS 19 Cb 0.42 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.05 2d87 h LYS 19 CO -0.51 0.97 -0.07 1.15 -1.08 0.00 0.00 179.45 179.91 2d87 h THR 20 N 0.54 0.56 -1.37 -0.16 2.02 0.52 -3.45 112.91 111.57 2d87 h THR 20 Ca 0.07 -0.33 -0.70 0.00 0.77 0.00 0.00 66.41 66.22 2d87 h THR 20 Cb 0.78 1.21 0.08 0.00 -1.74 0.00 0.00 68.15 68.47 2d87 h THR 20 CO 0.06 0.07 -0.01 0.54 0.37 0.00 0.00 175.52 176.56 2d87 n ARG 21 N -3.73 0.46 0.00 6.66 1.74 0.11 -2.09 116.66 119.81 2d87 n ARG 21 Ca -0.02 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 2d87 n ARG 21 Cb 0.18 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 2d87 n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2d87 n GLY 22 N 1.84 3.12 3.65 -0.13 0.00 -1.26 -5.05 105.19 107.36 2d87 n GLY 22 Ca 0.18 -1.00 -0.43 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.31 2.87 0.63 1.61 2.02 -0.89 -5.01 117.35 118.27 2d87 s TYR 23 Ca 0.00 1.03 -0.13 0.00 -0.37 0.00 0.00 57.07 57.60 2d87 s TYR 23 Cb 0.00 -3.62 -0.02 0.00 -0.40 0.00 0.00 41.96 37.92 2d87 s TYR 23 CO 0.00 -1.50 1.04 -2.00 -1.57 0.00 0.00 175.55 171.52 2d87 s GLU 24 N 3.69 3.31 -0.78 -0.62 2.12 -1.26 -4.00 118.70 121.16 2d87 s GLU 24 Ca 0.53 0.96 -0.04 0.00 0.36 0.00 0.00 54.97 56.78 2d87 s GLU 24 Cb -0.19 -2.04 0.00 0.00 0.26 0.00 0.00 34.13 32.17 2d87 s GLU 24 CO 0.16 -0.80 0.53 0.72 -0.54 0.00 0.00 175.26 175.33 2d87 n HIS 25 N -2.60 -1.39 -3.85 5.30 8.25 -1.26 -5.03 115.22 114.64 2d87 n HIS 25 Ca 0.07 0.45 -0.12 0.00 -0.26 0.00 0.00 57.72 57.87 2d87 n HIS 25 Cb 0.54 -3.10 -0.12 0.00 1.12 0.00 0.00 29.99 28.43 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 -3.06 0.04 -0.30 1.59 1.01 -1.26 -4.93 120.40 113.49 2d87 s VAL 26 Ca 0.26 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.97 2d87 s VAL 26 Cb -0.12 -0.27 0.19 0.00 0.00 0.00 0.00 36.38 36.19 2d87 s VAL 26 CO 0.32 -0.16 0.60 -1.81 0.00 0.00 0.00 175.10 174.05 2d87 s ASP 27 N -0.51 -1.49 -0.78 3.32 1.01 -1.26 -5.07 116.67 111.88 2d87 s ASP 27 Ca -0.06 0.57 -0.20 0.00 0.71 0.00 0.00 52.55 53.57 2d87 s ASP 27 Cb -0.04 2.11 0.11 0.00 1.01 0.00 0.00 42.92 46.11 2d87 s ASP 27 CO 0.01 -0.28 0.98 -0.63 0.21 0.00 0.00 175.17 175.46 2d87 s ILE 28 N 2.85 4.65 -0.18 0.77 1.01 -1.26 -4.79 121.20 124.24 2d87 s ILE 28 Ca 0.16 -1.11 0.15 0.00 0.00 0.00 0.00 60.65 59.85 2d87 s ILE 28 Cb -0.13 -4.69 -0.24 0.00 0.01 0.00 0.00 42.46 37.42 2d87 s ILE 28 CO -0.23 -1.41 0.14 0.00 0.00 0.00 0.00 174.94 173.44 2d87 n GLN 29 N 6.79 0.68 -3.50 2.79 6.02 -1.26 -4.93 117.38 123.96 2d87 n GLN 29 Ca 0.08 0.06 -0.12 0.00 -0.01 0.00 0.00 57.00 57.01 2d87 n GLN 29 Cb 0.47 -1.57 -0.04 0.00 1.02 0.00 0.00 30.24 30.12 2d87 n GLN 29 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2d87 s ASN 30 N -5.71 -0.49 -0.28 1.08 2.20 -1.26 -5.04 114.94 105.43 2d87 s ASN 30 Ca -0.12 0.26 -0.04 0.00 -0.94 0.00 0.00 52.86 52.02 2d87 s ASN 30 Cb 0.07 0.46 -0.04 0.00 -2.00 0.00 0.00 41.25 39.74 2d87 s ASN 30 CO 0.81 -0.65 3.00 0.49 -2.94 0.00 0.00 177.10 177.80 2d87 n PHE 31 N 0.19 1.02 0.03 1.54 3.72 -1.26 -3.86 117.46 118.84 2d87 n PHE 31 Ca -0.14 -1.77 -0.00 0.00 -0.05 0.00 0.00 57.45 55.49 2d87 n PHE 31 Cb 0.61 -1.41 -0.00 0.00 -0.94 0.00 0.00 39.48 37.74 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 1.40 0.60 -0.01 4.37 7.64 -1.26 -2.77 113.62 123.59 2d87 n SER 32 Ca 0.45 0.07 -0.02 0.00 1.01 0.00 0.00 58.87 60.38 2d87 n SER 32 Cb 0.67 -0.18 -0.01 0.00 -1.01 0.00 0.00 64.21 63.68 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 -3.04 2.67 -0.42 6.43 2.88 -1.26 -2.92 113.62 117.96 2d87 n SER 33 Ca -0.00 0.00 0.34 0.00 -1.33 0.00 0.00 58.87 57.88 2d87 n SER 33 Cb 0.00 -0.04 0.54 0.00 -0.75 0.00 0.00 64.21 63.96 2d87 n SER 33 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2d87 n SER 34 N -2.73 0.08 -0.01 -3.46 7.64 -1.25 0.21 113.62 114.10 2d87 n SER 34 Ca -0.04 0.87 -0.22 0.00 1.01 0.00 0.00 58.87 60.50 2d87 n SER 34 Cb 0.54 -0.43 -0.13 0.00 -1.01 0.00 0.00 64.21 63.17 2d87 n SER 34 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 2d87 h TRP 35 N 0.00 0.38 -1.24 1.43 4.06 -1.84 -3.36 115.95 115.39 2d87 h TRP 35 Ca 0.66 -0.28 0.39 0.00 2.06 0.00 0.00 58.89 61.72 2d87 h TRP 35 Cb 2.37 -0.02 -0.08 0.00 -1.00 0.00 0.00 29.16 30.43 2d87 h TRP 35 CO -0.00 1.62 0.85 0.45 -3.56 0.00 0.00 178.44 177.80 2d87 n SER 36 N -3.87 0.08 -0.18 -3.49 2.88 0.57 0.90 113.62 110.50 2d87 n SER 36 Ca -0.29 0.90 -0.03 0.00 -1.33 0.00 0.00 58.87 58.13 2d87 n SER 36 Cb 0.91 -0.45 0.04 0.00 -0.75 0.00 0.00 64.21 63.96 2d87 n SER 36 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 2d87 h ASP 37 N 0.00 -0.65 0.00 -3.46 2.03 -1.67 -3.47 116.42 109.19 2d87 h ASP 37 Ca 0.68 0.18 0.00 0.00 -0.73 0.00 0.00 57.03 57.16 2d87 h ASP 37 Cb 2.45 0.39 0.00 0.00 -0.83 0.00 0.00 39.33 41.34 2d87 h ASP 37 CO -0.19 -0.22 0.00 0.61 -1.03 0.00 0.00 179.24 178.41 2d87 n GLY 38 N -1.41 2.45 0.32 7.15 0.00 0.26 -4.72 105.19 109.24 2d87 n GLY 38 Ca 0.05 -0.75 0.18 0.00 0.00 0.00 0.00 46.02 45.50 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 0.10 -0.17 1.61 2.86 -1.85 -2.01 114.93 115.47 2d87 h MET 39 Ca 0.00 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.65 2d87 h MET 39 Cb 0.00 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 2d87 h MET 39 CO 0.00 0.06 -0.10 0.00 1.06 0.00 0.00 176.91 177.94 2d87 n ALA 40 N -2.76 -0.11 -0.09 6.32 0.00 -1.26 -0.03 120.51 122.58 2d87 n ALA 40 Ca 0.26 0.14 -0.06 0.00 0.00 0.00 0.00 53.44 53.78 2d87 n ALA 40 Cb 0.84 0.25 0.00 0.00 0.00 0.00 0.00 19.45 20.54 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 -0.38 -0.27 0.00 0.04 -1.65 -1.30 116.94 113.38 2d87 h PHE 41 Ca 0.03 0.04 0.05 0.00 2.80 0.00 0.00 57.97 60.88 2d87 h PHE 41 Cb 0.07 0.22 -0.08 0.00 2.20 0.00 0.00 35.95 38.36 2d87 h PHE 41 CO -0.68 -0.23 -0.47 0.00 -0.60 0.00 0.00 178.31 176.33 2d87 h ALA 43 N 0.11 0.91 -0.73 0.00 0.00 -0.08 0.32 119.26 119.79 2d87 h ALA 43 Ca 0.09 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.11 2d87 h ALA 43 Cb 0.62 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 2d87 h ALA 43 CO -0.50 -0.16 0.47 1.25 0.00 0.00 0.00 179.25 180.31 2d87 h LEU 44 N 0.47 0.79 0.41 0.00 5.85 -0.03 -2.43 115.31 120.36 2d87 h LEU 44 Ca 0.35 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.04 2d87 h LEU 44 Cb 0.45 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.30 2d87 h LEU 44 CO -0.33 0.55 -0.20 0.58 -0.34 0.00 0.00 178.44 178.71 2d87 h VAL 45 N 0.93 0.00 -0.90 1.05 2.07 0.41 -3.26 116.25 116.55 2d87 h VAL 45 Ca 0.28 -0.51 0.32 0.00 0.82 0.00 0.00 66.70 67.62 2d87 h VAL 45 Cb -0.03 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.58 2d87 h VAL 45 CO -0.09 0.00 0.29 1.57 0.02 0.00 0.00 177.57 179.36 2d87 n HIS 46 N -4.90 0.85 -0.26 1.57 -0.00 0.10 0.14 115.22 112.72 2d87 n HIS 46 Ca -0.07 1.07 0.06 0.00 -0.00 0.00 0.00 57.72 58.78 2d87 n HIS 46 Cb 0.22 -1.35 0.20 0.00 -0.00 0.00 0.00 29.99 29.06 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 0.14 0.18 0.26 -0.73 -1.48 -1.49 115.58 112.45 2d87 h ASN 47 Ca 0.67 0.13 -0.01 0.00 1.87 0.00 0.00 56.30 58.97 2d87 h ASN 47 Cb 1.64 0.15 0.00 0.00 0.27 0.00 0.00 38.32 40.39 2d87 h ASN 47 CO -0.75 0.01 -0.08 -0.26 -0.37 0.00 0.00 177.43 175.97 2d87 h PHE 48 N 0.34 -0.22 -3.53 0.67 0.04 0.12 -3.41 116.94 110.95 2d87 h PHE 48 Ca 0.43 -0.01 -0.70 0.00 2.80 0.00 0.00 57.97 60.50 2d87 h PHE 48 Cb 0.72 0.07 -0.35 0.00 2.20 0.00 0.00 35.95 38.59 2d87 h PHE 48 CO -0.22 -0.14 -0.33 -0.06 -0.60 0.00 0.00 178.31 176.97 2d87 s PHE 49 N -2.29 3.45 0.12 -0.55 0.08 -0.81 -4.92 117.98 113.05 2d87 s PHE 49 Ca -0.03 -2.75 -0.13 0.00 0.12 0.00 0.00 56.93 54.13 2d87 s PHE 49 Cb 0.00 -3.20 -0.06 0.00 -0.57 0.00 0.00 43.02 39.19 2d87 s PHE 49 CO 0.10 -0.83 1.45 -1.00 -0.10 0.00 0.00 175.22 174.85 2d87 h PRO 50 N 6.89 0.83 -0.46 0.24 0.13 -1.52 -3.23 132.00 134.88 2d87 h PRO 50 Ca 0.01 -0.43 -0.08 0.00 -0.87 0.00 0.00 66.00 64.63 2d87 h PRO 50 Cb 0.94 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.06 2d87 h PRO 50 CO 0.72 1.07 -0.01 0.93 -0.23 0.00 0.00 178.00 180.48 2d87 h GLU 51 N 0.61 0.81 -0.89 0.86 5.08 -1.91 -3.10 114.58 116.04 2d87 h GLU 51 Ca 0.06 -0.26 0.26 0.00 -1.00 0.00 0.00 59.36 58.41 2d87 h GLU 51 Cb 0.91 -0.07 -0.17 0.00 0.50 0.00 0.00 28.75 29.93 2d87 h GLU 51 CO 0.08 0.88 0.08 0.00 -1.00 0.00 0.00 179.01 179.05 2d87 n ALA 52 N -2.43 0.52 -3.40 3.43 0.00 -1.22 -4.64 120.51 112.77 2d87 n ALA 52 Ca 0.00 0.95 -0.10 0.00 0.00 0.00 0.00 53.44 54.29 2d87 n ALA 52 Cb 0.31 -0.73 -0.03 0.00 0.00 0.00 0.00 19.45 19.00 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 -5.79 -0.24 -0.24 0.00 -0.71 -1.17 -4.98 117.98 104.85 2d87 s PHE 53 Ca -0.11 -0.08 -0.10 0.00 -1.04 0.00 0.00 56.93 55.59 2d87 s PHE 53 Cb 0.27 0.48 -0.05 0.00 -1.21 0.00 0.00 43.02 42.50 2d87 s PHE 53 CO 0.69 -0.94 0.16 -0.51 -1.34 0.00 0.00 175.22 173.29 2d87 s ASP 54 N -2.84 6.10 -0.03 1.98 1.11 -1.26 -4.70 116.67 117.03 2d87 s ASP 54 Ca 0.07 0.11 -0.08 0.00 0.18 0.00 0.00 52.55 52.83 2d87 s ASP 54 Cb -0.02 -2.10 -0.04 0.00 1.07 0.00 0.00 42.92 41.83 2d87 s ASP 54 CO -0.04 0.07 0.46 0.22 1.18 0.00 0.00 175.17 177.05 2d87 h TYR 55 N 7.51 -0.26 -1.31 4.23 3.20 -1.95 -3.28 116.97 125.10 2d87 h TYR 55 Ca -0.38 -0.01 0.44 0.00 3.14 0.00 0.00 58.73 61.92 2d87 h TYR 55 Cb 1.17 0.09 -0.13 0.00 1.54 0.00 0.00 36.73 39.40 2d87 h TYR 55 CO 0.67 -0.16 0.84 0.78 -1.64 0.00 0.00 178.16 178.64 2d87 h GLY 56 N -0.69 1.35 0.88 1.82 0.00 -2.02 0.91 103.07 105.33 2d87 h GLY 56 Ca -0.03 -0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.23 2d87 h GLY 56 CO 0.05 -0.42 0.64 1.46 0.00 0.00 0.00 176.54 178.26 2d87 h GLN 57 N 0.08 1.17 -7.28 4.80 4.20 -1.99 -3.43 115.11 112.66 2d87 h GLN 57 Ca 0.82 -0.07 -0.46 0.00 0.06 0.00 0.00 58.65 59.00 2d87 h GLN 57 Cb 2.56 -0.26 0.17 0.00 0.30 0.00 0.00 27.48 30.26 2d87 h GLN 57 CO -0.44 0.77 0.15 -0.51 -0.67 0.00 0.00 178.83 178.14 2d87 s LEU 58 N -10.10 1.60 0.06 1.46 1.43 0.32 -5.07 118.68 108.37 2d87 s LEU 58 Ca -0.12 1.43 0.01 0.00 -1.03 0.00 0.00 54.13 54.41 2d87 s LEU 58 Cb 0.19 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.78 2d87 s LEU 58 CO 0.81 -3.35 -0.05 -0.44 0.23 0.00 0.00 176.35 173.56 2d87 s SER 59 N -3.11 0.69 0.02 2.29 0.01 -1.26 -5.03 113.70 107.29 2d87 s SER 59 Ca 0.66 -0.82 -0.22 0.00 1.31 0.00 0.00 55.95 56.87 2d87 s SER 59 Cb -0.21 0.12 -0.17 0.00 0.21 0.00 0.00 66.02 65.98 2d87 s SER 59 CO 0.60 -0.43 1.31 1.55 0.41 0.00 0.00 173.24 176.68 2d87 h PRO 60 N 3.64 0.22 -0.94 12.44 0.13 -1.97 -3.07 132.00 142.45 2d87 h PRO 60 Ca -0.34 -0.12 0.27 0.00 -0.87 0.00 0.00 66.00 64.94 2d87 h PRO 60 Cb 1.17 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.27 2d87 h PRO 60 CO 0.56 0.64 0.89 1.96 -0.23 0.00 0.00 178.00 181.82 2d87 h GLN 61 N -0.20 0.00 -6.13 0.86 7.50 -1.97 -3.33 115.11 111.84 2d87 h GLN 61 Ca 0.01 0.00 -0.57 0.00 0.50 0.00 0.00 58.65 58.60 2d87 h GLN 61 Cb 0.60 0.00 -0.10 0.00 0.05 0.00 0.00 27.48 28.04 2d87 h GLN 61 CO 0.02 0.00 0.99 -0.80 -1.50 0.00 0.00 178.83 177.54 2d87 s ASN 62 N -4.51 6.20 -0.03 1.46 0.01 -1.16 -4.86 114.94 112.05 2d87 s ASN 62 Ca -0.04 -0.68 -0.23 0.00 -0.71 0.00 0.00 52.86 51.20 2d87 s ASN 62 Cb 0.18 -2.53 -0.22 0.00 0.41 0.00 0.00 41.25 39.08 2d87 s ASN 62 CO 0.61 -1.72 1.08 0.03 -1.51 0.00 0.00 177.10 175.59 2d87 h ARG 63 N 9.89 0.23 0.49 -0.60 -0.00 -1.85 -2.92 114.38 119.62 2d87 h ARG 63 Ca -0.23 -0.22 -0.02 0.00 -0.50 0.00 0.00 59.98 59.00 2d87 h ARG 63 Cb 1.05 0.06 0.00 0.00 0.00 0.00 0.00 29.97 31.08 2d87 h ARG 63 CO 1.27 0.92 -0.23 0.00 0.00 0.00 0.00 179.97 181.93 2d87 h ARG 64 N -0.39 -0.63 -0.68 0.04 3.08 -1.94 -3.22 114.38 110.64 2d87 h ARG 64 Ca -0.03 0.04 0.09 0.00 0.07 0.00 0.00 59.98 60.15 2d87 h ARG 64 Cb 1.01 0.14 -0.11 0.00 0.08 0.00 0.00 29.97 31.09 2d87 h ARG 64 CO 0.06 -0.42 -0.48 0.37 -1.07 0.00 0.00 179.97 178.43 2d87 h GLN 65 N -1.02 -0.18 -0.96 0.04 4.15 -1.97 0.30 115.11 115.48 2d87 h GLN 65 Ca -0.07 0.01 0.26 0.00 0.77 0.00 0.00 58.65 59.62 2d87 h GLN 65 Cb 0.50 0.04 -0.18 0.00 0.21 0.00 0.00 27.48 28.05 2d87 h GLN 65 CO 0.11 -0.12 -0.00 0.09 -1.93 0.00 0.00 178.83 176.98 2d87 n ASN 66 N -5.38 -0.13 0.02 -0.69 3.02 -1.10 0.42 115.26 111.42 2d87 n ASN 66 Ca 0.02 1.63 -0.08 0.00 -0.03 0.00 0.00 54.58 56.12 2d87 n ASN 66 Cb 0.34 -0.59 -0.06 0.00 -0.61 0.00 0.00 39.78 38.86 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 -0.15 -0.20 3.10 -1.00 -0.73 -3.00 116.94 114.97 2d87 h PHE 67 Ca 0.57 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 61.38 2d87 h PHE 67 Cb 1.16 0.05 -0.06 0.00 3.61 0.00 0.00 35.95 40.71 2d87 h PHE 67 CO -0.51 0.23 -0.45 0.93 -1.61 0.00 0.00 178.31 176.90 2d87 h GLU 68 N -0.96 -0.41 -0.74 1.51 5.08 0.99 0.15 114.58 120.20 2d87 h GLU 68 Ca -0.02 0.03 0.17 0.00 -1.00 0.00 0.00 59.36 58.54 2d87 h GLU 68 Cb 0.45 0.09 -0.12 0.00 0.50 0.00 0.00 28.75 29.67 2d87 h GLU 68 CO 0.03 -0.27 0.12 0.28 -1.00 0.00 0.00 179.01 178.16 2d87 h VAL 69 N -0.42 0.45 -0.79 3.13 2.07 -0.20 0.34 116.25 120.84 2d87 h VAL 69 Ca 0.04 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 67.50 2d87 h VAL 69 Cb 0.53 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.49 2d87 h VAL 69 CO -0.41 0.04 0.52 0.00 0.02 0.00 0.00 177.57 177.74 2d87 h ALA 70 N 1.64 1.00 0.53 1.67 0.00 -1.07 0.10 119.26 123.14 2d87 h ALA 70 Ca 0.41 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.25 2d87 h ALA 70 Cb 0.73 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 18.21 2d87 h ALA 70 CO -0.56 0.39 -0.25 0.74 0.00 0.00 0.00 179.25 179.56 2d87 h PHE 71 N 1.05 -0.66 -0.13 0.00 0.04 0.18 -3.20 116.94 114.22 2d87 h PHE 71 Ca 0.29 -0.02 0.05 0.00 2.80 0.00 0.00 57.97 61.10 2d87 h PHE 71 Cb -0.09 0.22 -0.06 0.00 2.20 0.00 0.00 35.95 38.21 2d87 h PHE 71 CO -0.02 -0.40 -0.32 0.77 -0.60 0.00 0.00 178.31 177.74 2d87 h SER 72 N -1.18 -1.00 -0.94 2.17 0.02 -0.44 -1.45 113.55 110.73 2d87 h SER 72 Ca -0.07 0.15 0.25 0.00 -0.84 0.00 0.00 61.79 61.27 2d87 h SER 72 Cb 0.55 0.43 -0.18 0.00 0.14 0.00 0.00 62.40 63.34 2d87 h SER 72 CO 0.12 -0.36 -0.02 -1.54 -1.14 0.00 0.00 176.83 173.89 2d87 n SER 73 N -5.41 -0.14 0.16 3.07 3.41 0.36 -0.29 113.62 114.77 2d87 n SER 73 Ca -0.03 1.59 -0.07 0.00 -0.26 0.00 0.00 58.87 60.11 2d87 n SER 73 Cb 0.33 -0.57 -0.03 0.00 -0.26 0.00 0.00 64.21 63.68 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 1.87 -0.64 -0.43 7.33 0.00 -1.29 -3.10 119.26 123.00 2d87 h ALA 74 Ca 0.55 -0.09 0.12 0.00 0.00 0.00 0.00 54.91 55.49 2d87 h ALA 74 Cb 1.10 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2d87 h ALA 74 CO -0.89 -0.61 0.90 1.49 0.00 0.00 0.00 179.25 180.13 2d87 h GLU 75 N -0.71 0.00 -0.09 0.00 4.81 -0.27 0.13 114.58 118.44 2d87 h GLU 75 Ca -0.04 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.20 2d87 h GLU 75 Cb 0.33 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 2d87 h GLU 75 CO 0.07 0.00 -0.11 1.15 -0.73 0.00 0.00 179.01 179.39 2d87 h THR 76 N 0.00 0.00 0.00 0.32 2.02 -0.56 -2.11 112.91 112.58 2d87 h THR 76 Ca 0.20 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.33 2d87 h THR 76 Cb 2.00 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 2d87 h THR 76 CO -0.00 0.00 -1.43 0.00 0.37 0.00 0.00 175.52 174.46 2d87 n HIS 77 N -3.25 0.00 0.12 3.16 1.44 -0.85 -4.56 115.22 111.28 2d87 n HIS 77 Ca -0.01 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.72 2d87 n HIS 77 Cb 0.06 -0.26 -0.00 0.00 0.12 0.00 0.00 29.99 29.91 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 0.58 0.64 -5.62 1.59 0.00 -0.90 -3.47 119.26 112.08 2d87 h ALA 78 Ca -0.09 -0.54 -0.42 0.00 0.00 0.00 0.00 54.91 53.86 2d87 h ALA 78 Cb 0.83 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 2d87 h ALA 78 CO 0.00 0.71 -0.65 -3.47 0.00 0.00 0.00 179.25 175.85 2d87 n ASP 79 N -3.20 -4.67 -4.77 0.00 2.03 -0.79 -4.86 116.55 100.29 2d87 n ASP 79 Ca 0.01 -0.53 -0.41 0.00 0.52 0.00 0.00 54.79 54.38 2d87 n ASP 79 Cb 0.77 -3.78 -0.01 0.00 -0.72 0.00 0.00 41.12 37.37 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 -1.92 4.26 -1.01 0.00 0.04 -1.26 -4.59 135.00 130.52 2d87 s PRO 81 Ca 0.51 2.02 -0.23 0.00 0.04 0.00 0.00 61.00 63.34 2d87 s PRO 81 Cb -0.41 -3.62 0.06 0.00 0.04 0.00 0.00 34.50 30.56 2d87 s PRO 81 CO 0.55 -0.63 1.42 -0.65 0.04 0.00 0.00 177.00 177.73 2d87 s GLN 82 N 2.64 3.58 -0.11 4.56 -0.21 -1.26 -4.81 119.66 124.06 2d87 s GLN 82 Ca 0.66 -1.16 -0.22 0.00 0.02 0.00 0.00 55.36 54.66 2d87 s GLN 82 Cb -0.32 -5.31 -0.19 0.00 1.00 0.00 0.00 33.01 28.19 2d87 s GLN 82 CO 0.27 -2.17 0.70 -0.07 -2.12 0.00 0.00 175.29 171.89 2d87 h LEU 83 N 12.61 -0.03 -9.87 2.90 3.38 -2.00 -3.45 115.31 118.85 2d87 h LEU 83 Ca 0.19 -0.66 -0.52 0.00 0.09 0.00 0.00 57.88 56.98 2d87 h LEU 83 Cb 1.01 0.01 0.06 0.00 0.09 0.00 0.00 40.66 41.83 2d87 h LEU 83 CO 1.40 0.75 0.63 -0.76 0.09 0.00 0.00 178.44 180.55 2d87 s LEU 84 N -8.51 4.43 -0.93 1.67 1.43 -1.26 -4.97 118.68 110.55 2d87 s LEU 84 Ca -0.14 2.65 -0.14 0.00 -1.03 0.00 0.00 54.13 55.47 2d87 s LEU 84 Cb -0.01 -3.65 0.21 0.00 0.03 0.00 0.00 46.19 42.77 2d87 s LEU 84 CO 0.53 -0.51 0.94 -1.81 0.23 0.00 0.00 176.35 175.73 2d87 s ASP 85 N -0.47 6.88 0.20 2.29 1.11 -1.26 -4.92 116.67 120.50 2d87 s ASP 85 Ca 0.49 -2.79 -0.04 0.00 0.18 0.00 0.00 52.55 50.40 2d87 s ASP 85 Cb -0.39 -2.25 0.38 0.00 1.07 0.00 0.00 42.92 41.72 2d87 s ASP 85 CO 0.52 -0.61 1.10 0.41 1.18 0.00 0.00 175.17 177.76 2d87 n THR 86 N 4.01 -0.29 -0.22 -1.27 -1.04 -1.26 0.20 114.28 114.41 2d87 n THR 86 Ca 0.19 1.59 0.03 0.00 -2.04 0.00 0.00 64.05 63.82 2d87 n THR 86 Cb 0.46 -2.23 0.13 0.00 -1.82 0.00 0.00 70.33 66.87 2d87 n THR 86 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 2d87 h GLU 87 N 0.00 0.23 0.02 -2.82 4.11 -1.99 0.69 114.58 114.82 2d87 h GLU 87 Ca 0.36 -0.01 -0.21 0.00 0.07 0.00 0.00 59.36 59.56 2d87 h GLU 87 Cb 0.60 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2d87 h GLU 87 CO -0.71 0.15 -0.95 0.22 0.07 0.00 0.00 179.01 177.79 2d87 h ASP 88 N 0.23 0.27 -0.53 3.06 3.58 0.19 -3.28 116.42 119.93 2d87 h ASP 88 Ca 0.36 -0.23 0.01 0.00 0.42 0.00 0.00 57.03 57.58 2d87 h ASP 88 Cb 0.57 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.51 2d87 h ASP 88 CO -0.47 1.07 0.34 0.24 -2.88 0.00 0.00 179.24 177.55 2d87 h MET 89 N 0.10 0.67 0.20 0.28 2.86 0.11 0.24 114.93 119.38 2d87 h MET 89 Ca -0.06 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 2d87 h MET 89 Cb 1.61 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 33.11 2d87 h MET 89 CO 0.15 0.45 -0.18 0.28 1.06 0.00 0.00 176.91 178.66 2d87 h VAL 90 N 0.70 0.00 -0.85 -2.22 2.07 -1.00 -2.96 116.25 111.99 2d87 h VAL 90 Ca 0.20 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.79 2d87 h VAL 90 Cb -0.05 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.66 2d87 h VAL 90 CO -0.06 0.00 0.52 0.08 0.02 0.00 0.00 177.57 178.13 2d87 h ARG 91 N -0.37 0.90 -6.28 1.57 0.11 -1.62 -3.41 114.38 105.27 2d87 h ARG 91 Ca -0.03 -0.05 -0.60 0.00 0.10 0.00 0.00 59.98 59.40 2d87 h ARG 91 Cb 0.32 -0.20 0.02 0.00 1.11 0.00 0.00 29.97 31.22 2d87 h ARG 91 CO -0.02 0.60 1.15 1.28 0.10 0.00 0.00 179.97 183.08 2d87 n LEU 92 N -4.65 3.60 -0.34 0.08 4.77 0.83 -4.81 117.00 116.47 2d87 n LEU 92 Ca 0.13 0.92 0.32 0.00 -0.03 0.00 0.00 56.01 57.35 2d87 n LEU 92 Cb 0.20 -1.41 0.59 0.00 -2.33 0.00 0.00 43.42 40.47 2d87 n LEU 92 CO 0.30 -0.02 1.09 -0.09 -1.33 0.00 0.00 177.39 177.35 2d87 h ARG 93 N 9.79 0.04 -1.46 3.23 9.65 -1.82 -3.42 114.38 130.40 2d87 h ARG 93 Ca -0.48 -0.00 0.10 0.00 -1.10 0.00 0.00 59.98 58.49 2d87 h ARG 93 Cb 1.26 -0.01 -0.27 0.00 -1.39 0.00 0.00 29.97 29.56 2d87 h ARG 93 CO 0.95 0.03 0.58 -1.83 2.80 0.00 0.00 179.97 182.50 2d87 s GLU 94 N -5.50 0.41 0.03 0.20 -1.05 -1.26 -5.01 118.70 106.52 2d87 s GLU 94 Ca -0.09 0.39 -0.30 0.00 -0.15 0.00 0.00 54.97 54.82 2d87 s GLU 94 Cb 0.33 0.20 -0.06 0.00 -0.44 0.00 0.00 34.13 34.16 2d87 s GLU 94 CO 0.79 -0.07 1.43 -1.25 0.95 0.00 0.00 175.26 177.11 2d87 s PRO 95 N -0.09 4.28 0.16 -4.83 0.04 -1.15 -4.96 135.00 128.45 2d87 s PRO 95 Ca 0.03 2.03 -0.32 0.00 0.04 0.00 0.00 61.00 62.78 2d87 s PRO 95 Cb -0.04 -3.53 -0.11 0.00 0.04 0.00 0.00 34.50 30.86 2d87 s PRO 95 CO -0.07 -0.57 1.69 -0.51 0.04 0.00 0.00 177.00 177.58 2d87 s ASP 96 N 1.83 6.47 0.26 6.66 1.01 -1.26 -4.28 116.67 127.37 2d87 s ASP 96 Ca 0.65 2.73 -0.03 0.00 0.71 0.00 0.00 52.55 56.61 2d87 s ASP 96 Cb -0.33 -2.59 0.56 0.00 1.01 0.00 0.00 42.92 41.57 2d87 s ASP 96 CO 0.28 -0.93 1.64 4.11 0.21 0.00 0.00 175.17 180.48 2d87 h TRP 97 N 7.29 0.12 -1.08 4.23 5.08 -1.85 0.40 115.95 130.13 2d87 h TRP 97 Ca -0.43 0.05 0.32 0.00 1.08 0.00 0.00 58.89 59.91 2d87 h TRP 97 Cb 1.20 0.08 -0.13 0.00 -3.00 0.00 0.00 29.16 27.32 2d87 h TRP 97 CO 0.69 -0.23 0.66 0.87 -1.28 0.00 0.00 178.44 179.15 2d87 h LYS 98 N 0.15 0.31 0.00 0.12 1.57 -1.90 0.59 116.57 117.41 2d87 h LYS 98 Ca 0.47 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.24 2d87 h LYS 98 Cb 0.89 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.13 2d87 h LYS 98 CO -0.67 0.21 -0.03 0.00 -0.57 0.00 0.00 179.45 178.39 2d87 h VAL 100 N -0.90 0.00 -0.95 0.00 2.07 -0.80 0.23 116.25 115.89 2d87 h VAL 100 Ca 0.00 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.82 2d87 h VAL 100 Cb 0.03 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.64 2d87 h VAL 100 CO 0.00 0.00 0.33 0.22 0.02 0.00 0.00 177.57 178.14 2d87 h TYR 101 N -0.14 0.50 -0.36 1.57 5.03 -1.09 0.38 116.97 122.85 2d87 h TYR 101 Ca 0.09 0.05 0.05 0.00 2.58 0.00 0.00 58.73 61.50 2d87 h TYR 101 Cb 0.38 -0.06 -0.04 0.00 1.55 0.00 0.00 36.73 38.55 2d87 h TYR 101 CO -0.86 -0.30 0.10 1.15 -1.32 0.00 0.00 178.16 176.93 2d87 h THR 102 N 0.16 0.85 0.78 1.81 2.02 -0.62 -2.21 112.91 115.71 2d87 h THR 102 Ca 0.66 -0.08 -0.04 0.00 0.77 0.00 0.00 66.41 67.72 2d87 h THR 102 Cb 1.48 0.60 0.01 0.00 -1.74 0.00 0.00 68.15 68.49 2d87 h THR 102 CO -0.72 0.04 -0.38 0.22 0.37 0.00 0.00 175.52 175.06 2d87 h TYR 103 N 0.24 -0.98 -0.97 3.16 3.20 0.24 -1.44 116.97 120.42 2d87 h TYR 103 Ca 0.17 -0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.14 2d87 h TYR 103 Cb 0.17 0.32 -0.14 0.00 1.54 0.00 0.00 36.73 38.62 2d87 h TYR 103 CO -0.17 -0.61 -0.45 -0.89 -1.64 0.00 0.00 178.16 174.40 2d87 n ILE 104 N -4.90 -0.57 0.09 1.81 2.08 -0.79 -0.23 119.36 116.85 2d87 n ILE 104 Ca -0.13 2.30 -0.12 0.00 0.56 0.00 0.00 62.75 65.36 2d87 n ILE 104 Cb 0.42 -2.97 -0.05 0.00 -0.75 0.00 0.00 39.64 36.29 2d87 n ILE 104 CO 0.00 0.00 0.00 -0.61 0.56 0.00 0.00 176.55 176.50 2d87 h GLN 105 N 0.00 -0.38 -0.19 0.38 5.75 -1.37 0.23 115.11 119.53 2d87 h GLN 105 Ca 0.27 0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.85 2d87 h GLN 105 Cb 0.51 0.09 -0.07 0.00 1.07 0.00 0.00 27.48 29.08 2d87 h GLN 105 CO -0.94 -0.25 -0.29 1.49 -2.65 0.00 0.00 178.83 176.18 2d87 h GLU 106 N -0.39 -0.32 0.80 1.69 4.57 0.33 -1.73 114.58 119.54 2d87 h GLU 106 Ca 0.04 0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.20 2d87 h GLU 106 Cb 0.43 0.07 0.01 0.00 -0.16 0.00 0.00 28.75 29.10 2d87 h GLU 106 CO -0.15 -0.21 -0.40 0.35 -1.18 0.00 0.00 179.01 177.41 2d87 h PHE 107 N -0.33 -1.05 -0.89 0.92 3.57 -0.35 -2.78 116.94 116.03 2d87 h PHE 107 Ca 0.12 -0.02 0.35 0.00 3.53 0.00 0.00 57.97 61.94 2d87 h PHE 107 Cb 0.51 0.35 -0.16 0.00 2.79 0.00 0.00 35.95 39.45 2d87 h PHE 107 CO -0.41 -0.64 0.39 0.98 -2.23 0.00 0.00 178.31 176.39 2d87 n TYR 108 N -5.02 0.94 -0.23 0.41 4.19 0.79 0.19 117.16 118.44 2d87 n TYR 108 Ca -0.14 1.06 -0.02 0.00 3.31 0.00 0.00 57.90 62.11 2d87 n TYR 108 Cb 0.44 -1.40 0.10 0.00 0.49 0.00 0.00 39.34 38.96 2d87 n TYR 108 CO 0.00 0.00 0.00 -0.09 0.91 0.00 0.00 176.86 177.68 2d87 h ARG 109 N 0.00 0.69 -0.64 2.98 2.43 -1.02 -2.07 114.38 116.75 2d87 h ARG 109 Ca 0.71 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.89 2d87 h ARG 109 Cb 1.82 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 31.16 2d87 h ARG 109 CO -0.72 0.46 0.36 0.00 -1.51 0.00 0.00 179.97 178.57 2d87 h LEU 111 N 0.69 0.30 -1.05 0.00 3.38 -1.17 -1.85 115.31 115.61 2d87 h LEU 111 Ca 0.28 0.03 0.23 0.00 0.09 0.00 0.00 57.88 58.51 2d87 h LEU 111 Cb 0.13 -0.03 -0.12 0.00 0.09 0.00 0.00 40.66 40.73 2d87 h LEU 111 CO -0.15 0.22 0.61 0.58 0.09 0.00 0.00 178.44 179.78 2d87 h VAL 112 N 0.43 0.58 0.12 1.22 2.07 -1.01 0.01 116.25 119.67 2d87 h VAL 112 Ca 0.20 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2d87 h VAL 112 Cb 0.12 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.81 2d87 h VAL 112 CO -0.15 0.11 -0.06 1.56 0.02 0.00 0.00 177.57 179.05 2d87 h GLN 113 N 0.61 -0.16 -0.35 1.57 1.08 -1.24 -2.91 115.11 113.71 2d87 h GLN 113 Ca 0.62 0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.89 2d87 h GLN 113 Cb 1.18 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 28.62 2d87 h GLN 113 CO -0.43 0.12 0.24 0.87 -0.95 0.00 0.00 178.83 178.68 2d87 h LYS 114 N -0.43 0.20 0.00 1.46 6.56 -0.93 -3.46 116.57 119.98 2d87 h LYS 114 Ca -0.02 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 2d87 h LYS 114 Cb 0.35 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 31.96 2d87 h LYS 114 CO 0.03 0.13 0.00 0.41 -2.06 0.00 0.00 179.45 177.96 2d87 n GLY 115 N -1.55 1.63 0.09 3.86 0.00 -0.14 -5.04 105.19 104.03 2d87 n GLY 115 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 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 0.00 -9.18 0.99 3.38 -1.72 -3.46 115.31 105.33 2d87 h LEU 116 Ca 0.00 -0.45 -0.57 0.00 0.09 0.00 0.00 57.88 56.95 2d87 h LEU 116 Cb 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 2d87 h LEU 116 CO 0.00 1.14 0.51 -0.69 0.09 0.00 0.00 178.44 179.49 2d87 s VAL 117 N -2.23 4.82 0.98 1.22 1.01 -1.26 -5.03 120.40 119.91 2d87 s VAL 117 Ca -0.21 1.82 -0.15 0.00 0.00 0.00 0.00 61.98 63.44 2d87 s VAL 117 Cb 0.03 -4.22 0.11 0.00 0.00 0.00 0.00 36.38 32.30 2d87 s VAL 117 CO 0.48 -0.01 0.05 0.29 0.00 0.00 0.00 175.10 175.91 2d87 n LYS 118 N 5.32 -1.73 -3.31 2.72 4.76 -1.26 -3.73 118.16 120.93 2d87 n LYS 118 Ca 0.07 -0.51 -0.24 0.00 -2.87 0.00 0.00 58.31 54.76 2d87 n LYS 118 Cb 0.48 -1.42 0.05 0.00 -1.84 0.00 0.00 35.03 32.30 2d87 n LYS 118 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 2d87 n THR 119 N -4.19 -2.35 -1.63 -0.18 -1.04 -1.26 -4.86 114.28 98.77 2d87 n THR 119 Ca 0.04 0.00 -0.53 0.00 -2.04 0.00 0.00 64.05 61.52 2d87 n THR 119 Cb 0.41 -3.58 -0.06 0.00 -1.82 0.00 0.00 70.33 65.28 2d87 n THR 119 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2d87 n LYS 120 N -4.45 1.28 -3.03 -2.82 0.00 -1.24 -4.90 118.16 103.00 2d87 n LYS 120 Ca -0.05 0.46 -0.43 0.00 0.00 0.00 0.00 58.31 58.29 2d87 n LYS 120 Cb 0.59 -2.13 -0.05 0.00 0.00 0.00 0.00 35.03 33.43 2d87 n LYS 120 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 2d87 s LYS 121 N 1.36 3.21 -0.04 1.64 -2.85 -1.26 -5.04 119.74 116.76 2d87 s LYS 121 Ca 0.87 -0.63 0.02 0.00 -1.00 0.00 0.00 55.97 55.24 2d87 s LYS 121 Cb -0.95 -4.07 -0.03 0.00 -2.06 0.00 0.00 37.83 30.72 2d87 s LYS 121 CO 0.50 -1.31 -0.08 0.45 0.10 0.00 0.00 175.35 175.01 2d87 s SER 122 N 2.72 4.52 0.18 0.03 0.15 -1.26 -4.99 113.70 115.05 2d87 s SER 122 Ca 0.21 -0.10 -0.30 0.00 0.70 0.00 0.00 55.95 56.46 2d87 s SER 122 Cb -0.16 -1.07 -0.07 0.00 -1.71 0.00 0.00 66.02 63.00 2d87 s SER 122 CO 0.15 0.33 0.94 -0.94 1.20 0.00 0.00 173.24 174.91 2d87 s SER 123 N -1.03 7.56 0.00 5.45 1.04 -1.26 -4.99 113.70 120.47 2d87 s SER 123 Ca 0.14 1.86 0.00 0.00 0.48 0.00 0.00 55.95 58.42 2d87 s SER 123 Cb -0.11 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.42 2d87 s SER 123 CO 0.04 0.06 0.00 0.61 0.98 0.00 0.00 173.24 174.93 2d87 n GLY 124 N 1.84 4.22 0.00 7.32 0.00 -1.26 -4.94 105.19 112.37 2d87 n GLY 124 Ca -0.00 -0.72 0.06 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.44 0.49 -1.02 1.61 -0.04 -1.26 -4.88 135.00 128.46 2d87 n PRO 125 Ca 0.00 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.12 2d87 n PRO 125 Cb 0.00 -1.36 0.02 0.00 -0.04 0.00 0.00 33.50 32.13 2d87 n PRO 125 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2d87 n SER 126 N -0.86 -4.49 -0.13 3.54 7.64 -1.26 -4.93 113.62 113.13 2d87 n SER 126 Ca 0.08 0.37 -0.20 0.00 1.01 0.00 0.00 58.87 60.14 2d87 n SER 126 Cb 0.04 -0.73 -0.12 0.00 -1.01 0.00 0.00 64.21 62.39 2d87 n SER 126 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2d87 n SER 127 N 2.76 1.98 0.00 6.43 3.41 -1.26 -5.22 113.62 121.72 2d87 n SER 127 Ca 0.02 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 2d87 n SER 127 Cb 0.47 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2d87 n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49