#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d87 s SER 2 N 0.00 6.64 -0.92 1.61 1.04 -1.26 -5.04 113.70 115.77 2d87 s SER 2 Ca 0.00 0.84 -0.15 0.00 0.48 0.00 0.00 55.95 57.12 2d87 s SER 2 Cb 0.00 -2.19 0.20 0.00 0.10 0.00 0.00 66.02 64.13 2d87 s SER 2 CO 0.00 0.06 0.96 -0.55 0.98 0.00 0.00 173.24 174.69 2d87 s SER 3 N -2.07 6.83 -0.67 7.02 0.15 -1.26 -4.91 113.70 118.80 2d87 s SER 3 Ca 0.40 -2.66 0.04 0.00 0.70 0.00 0.00 55.95 54.43 2d87 s SER 3 Cb -0.13 -2.28 0.32 0.00 -1.71 0.00 0.00 66.02 62.22 2d87 s SER 3 CO 0.20 -0.68 1.04 0.61 1.20 0.00 0.00 173.24 175.61 2d87 n GLY 4 N 4.22 5.51 3.57 9.45 0.00 -1.26 -5.03 105.19 121.65 2d87 n GLY 4 Ca 0.20 -2.76 -0.39 0.00 0.00 0.00 0.00 46.02 43.07 2d87 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d87 s SER 5 N -2.95 5.05 -0.09 1.61 0.15 -1.26 -4.89 113.70 111.31 2d87 s SER 5 Ca 0.45 1.19 -0.30 0.00 0.70 0.00 0.00 55.95 57.98 2d87 s SER 5 Cb 0.23 -2.51 0.10 0.00 -1.71 0.00 0.00 66.02 62.13 2d87 s SER 5 CO -0.10 -2.39 0.83 -0.44 1.20 0.00 0.00 173.24 172.33 2d87 s SER 6 N 9.61 -0.52 0.00 5.45 0.01 -1.26 -5.16 113.70 121.83 2d87 s SER 6 Ca 0.90 0.54 0.00 0.00 1.31 0.00 0.00 55.95 58.70 2d87 s SER 6 Cb -0.21 0.43 0.00 0.00 0.21 0.00 0.00 66.02 66.45 2d87 s SER 6 CO 0.28 -0.50 0.00 0.61 0.41 0.00 0.00 173.24 174.05 2d87 n GLY 7 N 0.77 4.03 0.10 3.44 0.00 -1.26 -4.95 105.19 107.32 2d87 n GLY 7 Ca -0.15 -1.18 -0.12 0.00 0.00 0.00 0.00 46.02 44.57 2d87 n GLY 7 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2d87 n ILE 8 N -0.13 1.62 0.27 -0.61 -0.00 -1.26 -3.43 119.36 115.82 2d87 n ILE 8 Ca 0.00 -0.76 0.11 0.00 -0.00 0.00 0.00 62.75 62.10 2d87 n ILE 8 Cb 0.00 -1.16 0.74 0.00 -0.00 0.00 0.00 39.64 39.22 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 0.02 0.00 0.00 0.38 3.64 -2.00 -1.80 116.57 116.81 2d87 h LYS 9 Ca -0.37 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.97 2d87 h LYS 9 Cb 2.04 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.86 2d87 h LYS 9 CO 0.07 0.01 -0.38 1.96 -2.27 0.00 0.00 179.45 178.84 2d87 h GLN 10 N 0.00 0.00 -1.06 1.90 1.08 -1.93 -3.22 115.11 111.87 2d87 h GLN 10 Ca -0.00 0.00 0.29 0.00 -1.45 0.00 0.00 58.65 57.49 2d87 h GLN 10 Cb 0.02 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 27.33 2d87 h GLN 10 CO 0.00 0.38 0.66 0.00 -0.95 0.00 0.00 178.83 178.92 2d87 h MET 11 N -1.00 0.38 -0.08 1.46 -0.00 -1.56 0.11 114.93 114.24 2d87 h MET 11 Ca -0.06 -0.02 -0.01 0.00 -0.00 0.00 0.00 59.70 59.60 2d87 h MET 11 Cb 0.58 -0.09 -0.00 0.00 -0.00 0.00 0.00 31.60 32.10 2d87 h MET 11 CO -0.04 0.25 0.00 -0.07 -0.00 0.00 0.00 176.91 177.06 2d87 h LEU 12 N 0.39 0.14 -0.94 -0.10 3.38 -1.47 -0.57 115.31 116.12 2d87 h LEU 12 Ca 0.66 -0.29 0.07 0.00 0.09 0.00 0.00 57.88 58.41 2d87 h LEU 12 Cb 1.61 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 42.25 2d87 h LEU 12 CO -0.41 0.40 0.60 0.25 0.09 0.00 0.00 178.44 179.37 2d87 h LEU 13 N -0.13 0.94 -0.63 1.67 5.85 -0.84 0.16 115.31 122.33 2d87 h LEU 13 Ca 0.02 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.62 2d87 h LEU 13 Cb 0.32 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2d87 h LEU 13 CO 0.00 0.59 -0.54 -0.78 -0.34 0.00 0.00 178.44 177.37 2d87 h ASP 14 N 1.07 0.44 -0.03 1.25 1.82 -1.13 -3.19 116.42 116.64 2d87 h ASP 14 Ca 0.42 -0.23 -0.01 0.00 -0.39 0.00 0.00 57.03 56.81 2d87 h ASP 14 Cb 0.21 -0.13 -0.00 0.00 0.68 0.00 0.00 39.33 40.10 2d87 h ASP 14 CO -0.19 0.89 -0.03 -0.25 -1.61 0.00 0.00 179.24 178.05 2d87 h TRP 15 N 0.31 0.09 -0.69 0.28 7.01 0.02 -3.02 115.95 119.95 2d87 h TRP 15 Ca 0.01 -0.03 0.13 0.00 2.11 0.00 0.00 58.89 61.11 2d87 h TRP 15 Cb 1.05 -0.02 -0.13 0.00 -2.10 0.00 0.00 29.16 27.96 2d87 h TRP 15 CO 0.03 0.55 -0.22 0.00 -2.79 0.00 0.00 178.44 176.02 2d87 h ARG 17 N -0.04 -1.08 -0.85 0.00 3.08 -1.59 0.37 114.38 114.28 2d87 h ARG 17 Ca 0.32 0.07 0.11 0.00 0.07 0.00 0.00 59.98 60.56 2d87 h ARG 17 Cb 0.53 0.24 -0.12 0.00 0.08 0.00 0.00 29.97 30.70 2d87 h ARG 17 CO -0.73 -0.72 -0.39 0.00 -1.07 0.00 0.00 179.97 177.07 2d87 n ALA 18 N -2.78 -0.25 -0.13 0.04 0.00 -0.72 0.67 120.51 117.35 2d87 n ALA 18 Ca -0.14 0.80 -0.12 0.00 0.00 0.00 0.00 53.44 53.98 2d87 n ALA 18 Cb 0.49 -0.29 -0.01 0.00 0.00 0.00 0.00 19.45 19.64 2d87 n ALA 18 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2d87 h LYS 19 N 0.00 0.94 -1.31 0.00 1.79 -1.27 -3.02 116.57 113.71 2d87 h LYS 19 Ca 0.24 -0.46 -0.31 0.00 -2.18 0.00 0.00 60.65 57.93 2d87 h LYS 19 Cb 0.45 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 30.95 2d87 h LYS 19 CO -0.83 1.12 0.40 2.41 -1.08 0.00 0.00 179.45 181.48 2d87 n THR 20 N -4.07 2.57 -2.89 -0.16 -1.04 0.21 -4.86 114.28 104.04 2d87 n THR 20 Ca -0.01 -1.45 -0.33 0.00 -2.04 0.00 0.00 64.05 60.22 2d87 n THR 20 Cb 0.52 -1.11 -0.06 0.00 -1.82 0.00 0.00 70.33 67.85 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 -1.84 4.14 0.00 -2.82 0.52 0.12 -4.05 118.95 115.02 2d87 s ARG 21 Ca 0.31 0.96 0.00 0.00 -0.52 0.00 0.00 55.73 56.49 2d87 s ARG 21 Cb 0.25 -2.26 0.00 0.00 0.52 0.00 0.00 34.95 33.47 2d87 s ARG 21 CO 0.02 0.01 0.00 0.41 0.02 0.00 0.00 175.30 175.76 2d87 n GLY 22 N -0.63 1.73 2.86 -3.53 0.00 -1.26 -4.96 105.19 99.41 2d87 n GLY 22 Ca 0.06 -0.13 -0.51 0.00 0.00 0.00 0.00 46.02 45.43 2d87 n GLY 22 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2d87 n TYR 23 N 0.00 1.23 -2.56 1.61 4.01 -1.26 -4.87 117.16 115.32 2d87 n TYR 23 Ca 0.00 0.88 -0.32 0.00 -0.16 0.00 0.00 57.90 58.29 2d87 n TYR 23 Cb 0.00 -1.70 -0.05 0.00 -0.31 0.00 0.00 39.34 37.28 2d87 n TYR 23 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2d87 s GLU 24 N 1.98 4.05 -1.80 -0.72 2.56 -1.26 -3.66 118.70 119.86 2d87 s GLU 24 Ca 0.79 1.03 0.00 0.00 0.00 0.00 0.00 54.97 56.79 2d87 s GLU 24 Cb -1.13 -2.15 0.00 0.00 2.00 0.00 0.00 34.13 32.85 2d87 s GLU 24 CO 0.60 -0.19 0.00 0.72 -0.56 0.00 0.00 175.26 175.84 2d87 n HIS 25 N -1.21 -0.72 -3.73 5.30 8.25 -1.26 -4.97 115.22 116.89 2d87 n HIS 25 Ca 0.07 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.27 2d87 n HIS 25 Cb 0.54 -3.71 -0.17 0.00 1.12 0.00 0.00 29.99 27.77 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 0.39 -0.31 1.59 1.01 -1.24 -4.91 120.40 114.00 2d87 s VAL 26 Ca 0.00 -0.30 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 2d87 s VAL 26 Cb 0.00 -0.82 0.10 0.00 0.00 0.00 0.00 36.38 35.66 2d87 s VAL 26 CO 0.00 -0.09 0.09 -1.81 0.00 0.00 0.00 175.10 173.29 2d87 s ASP 27 N 1.93 4.05 -0.51 3.32 1.01 -1.26 -4.91 116.67 120.30 2d87 s ASP 27 Ca 0.01 -1.64 -0.26 0.00 0.71 0.00 0.00 52.55 51.38 2d87 s ASP 27 Cb -0.16 -0.93 0.03 0.00 1.01 0.00 0.00 42.92 42.87 2d87 s ASP 27 CO -0.07 -0.40 0.99 -0.63 0.21 0.00 0.00 175.17 175.27 2d87 s ILE 28 N 1.56 4.35 0.00 0.77 1.01 -1.26 -4.76 121.20 122.87 2d87 s ILE 28 Ca 0.09 0.69 0.00 0.00 0.00 0.00 0.00 60.65 61.43 2d87 s ILE 28 Cb -0.17 -4.53 0.00 0.00 0.01 0.00 0.00 42.46 37.77 2d87 s ILE 28 CO -0.22 -1.01 0.00 1.67 0.00 0.00 0.00 174.94 175.38 2d87 n GLN 29 N 7.51 2.53 -3.59 2.79 7.27 -1.26 -4.87 117.38 127.75 2d87 n GLN 29 Ca 0.06 0.00 -0.13 0.00 0.07 0.00 0.00 57.00 57.00 2d87 n GLN 29 Cb 0.48 -0.85 -0.06 0.00 2.41 0.00 0.00 30.24 32.22 2d87 n GLN 29 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2d87 s ASN 30 N -2.49 -0.60 -0.84 1.69 4.22 -1.26 -5.04 114.94 110.61 2d87 s ASN 30 Ca 0.00 0.96 -0.07 0.00 -2.14 0.00 0.00 52.86 51.61 2d87 s ASN 30 Cb 0.00 0.90 -0.14 0.00 1.28 0.00 0.00 41.25 43.30 2d87 s ASN 30 CO 0.00 -0.34 2.88 0.49 -2.04 0.00 0.00 177.10 178.09 2d87 n PHE 31 N 1.80 1.25 0.05 1.54 3.72 -1.26 -3.53 117.46 121.03 2d87 n PHE 31 Ca -0.14 -2.15 0.00 0.00 -0.05 0.00 0.00 57.45 55.10 2d87 n PHE 31 Cb 0.56 -1.91 0.00 0.00 -0.94 0.00 0.00 39.48 37.19 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 3.30 0.89 0.00 4.37 7.64 -1.26 -4.18 113.62 124.39 2d87 n SER 32 Ca 0.55 0.15 0.00 0.00 1.01 0.00 0.00 58.87 60.58 2d87 n SER 32 Cb 0.43 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 2d87 n SER 32 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2d87 n SER 33 N -3.43 4.63 0.32 6.43 3.41 -1.25 -4.03 113.62 119.70 2d87 n SER 33 Ca 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.79 2d87 n SER 33 Cb 0.06 0.82 0.92 0.00 -0.26 0.00 0.00 64.21 65.75 2d87 n SER 33 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2d87 h SER 34 N 0.00 0.00 0.00 4.04 0.87 -1.86 0.20 113.55 116.80 2d87 h SER 34 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2d87 h SER 34 Cb 0.21 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2d87 h SER 34 CO 0.00 0.00 -0.29 0.79 -0.53 0.00 0.00 176.83 176.80 2d87 n TRP 35 N -3.03 0.00 0.64 2.24 7.02 -1.26 -4.61 117.44 118.44 2d87 n TRP 35 Ca -0.02 -1.20 0.11 0.00 -1.02 0.00 0.00 57.50 55.37 2d87 n TRP 35 Cb 0.31 -0.20 -0.08 0.00 -2.42 0.00 0.00 31.31 28.92 2d87 n TRP 35 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 2d87 n SER 36 N -1.18 0.63 -0.07 -0.99 7.64 0.71 -4.49 113.62 115.88 2d87 n SER 36 Ca 0.17 -0.52 -0.07 0.00 1.01 0.00 0.00 58.87 59.46 2d87 n SER 36 Cb 0.68 1.16 -0.04 0.00 -1.01 0.00 0.00 64.21 65.00 2d87 n SER 36 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 2d87 h ASP 37 N 0.00 0.00 0.00 6.43 2.03 -1.82 -3.48 116.42 119.58 2d87 h ASP 37 Ca 0.00 -0.21 0.00 0.00 -0.73 0.00 0.00 57.03 56.09 2d87 h ASP 37 Cb 0.68 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.18 2d87 h ASP 37 CO 0.00 0.81 0.00 0.61 -1.03 0.00 0.00 179.24 179.63 2d87 n GLY 38 N 1.64 3.25 0.33 7.15 0.00 -1.26 -4.63 105.19 111.67 2d87 n GLY 38 Ca -0.09 -0.63 0.24 0.00 0.00 0.00 0.00 46.02 45.54 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 0.08 0.00 1.61 2.86 -1.87 -2.13 114.93 115.48 2d87 h MET 39 Ca 0.00 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2d87 h MET 39 Cb 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2d87 h MET 39 CO 0.00 0.06 0.00 0.00 1.06 0.00 0.00 176.91 178.03 2d87 n ALA 40 N -2.53 0.00 -0.35 6.32 0.00 -1.26 -0.35 120.51 122.34 2d87 n ALA 40 Ca 0.31 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.82 2d87 n ALA 40 Cb 1.04 0.42 0.15 0.00 0.00 0.00 0.00 19.45 21.05 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 -0.49 -0.86 0.00 0.04 -1.71 0.96 116.94 114.88 2d87 h PHE 41 Ca 0.00 0.09 0.09 0.00 2.80 0.00 0.00 57.97 60.95 2d87 h PHE 41 Cb 0.00 0.37 -0.07 0.00 2.20 0.00 0.00 35.95 38.45 2d87 h PHE 41 CO -0.66 -0.43 0.51 0.00 -0.60 0.00 0.00 178.31 177.14 2d87 h ALA 43 N 1.45 0.62 -0.61 0.00 0.00 0.39 0.54 119.26 121.65 2d87 h ALA 43 Ca 0.40 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 2d87 h ALA 43 Cb 0.32 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2d87 h ALA 43 CO -0.23 0.26 0.02 1.25 0.00 0.00 0.00 179.25 180.55 2d87 h LEU 44 N 0.64 1.03 0.14 0.00 5.85 -0.37 -2.91 115.31 119.69 2d87 h LEU 44 Ca 0.16 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 2d87 h LEU 44 Cb 0.23 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.99 2d87 h LEU 44 CO -0.01 1.08 -0.07 0.58 -0.34 0.00 0.00 178.44 179.68 2d87 h VAL 45 N 0.96 0.00 -0.75 1.05 2.07 -0.67 -3.32 116.25 115.58 2d87 h VAL 45 Ca 0.17 -0.43 0.27 0.00 0.82 0.00 0.00 66.70 67.53 2d87 h VAL 45 Cb 0.53 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.17 2d87 h VAL 45 CO 0.03 0.00 0.24 1.57 0.02 0.00 0.00 177.57 179.43 2d87 n HIS 46 N -3.70 0.71 -0.20 1.57 -0.00 0.19 0.15 115.22 113.94 2d87 n HIS 46 Ca -0.02 0.90 0.00 0.00 -0.00 0.00 0.00 57.72 58.59 2d87 n HIS 46 Cb 0.07 -1.21 0.08 0.00 -0.00 0.00 0.00 29.99 28.94 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 -0.36 0.26 0.26 -1.24 -1.61 -1.21 115.58 111.68 2d87 h ASN 47 Ca 0.56 0.16 -0.01 0.00 0.71 0.00 0.00 56.30 57.72 2d87 h ASN 47 Cb 1.38 0.30 0.00 0.00 0.73 0.00 0.00 38.32 40.73 2d87 h ASN 47 CO -0.63 -0.14 -0.12 -0.26 -1.29 0.00 0.00 177.43 174.98 2d87 h PHE 48 N 0.08 -0.32 -3.56 0.67 0.04 0.13 -3.39 116.94 110.58 2d87 h PHE 48 Ca 0.31 -0.01 -0.72 0.00 2.80 0.00 0.00 57.97 60.34 2d87 h PHE 48 Cb 0.49 0.11 -0.33 0.00 2.20 0.00 0.00 35.95 38.41 2d87 h PHE 48 CO -0.40 -0.20 -0.16 -0.06 -0.60 0.00 0.00 178.31 176.89 2d87 s PHE 49 N -2.97 3.63 0.23 -0.55 0.08 -1.02 -4.89 117.98 112.49 2d87 s PHE 49 Ca -0.05 -2.64 0.22 0.00 0.12 0.00 0.00 56.93 54.58 2d87 s PHE 49 Cb 0.01 -3.37 0.95 0.00 -0.57 0.00 0.00 43.02 40.03 2d87 s PHE 49 CO 0.15 -0.85 1.85 -1.00 -0.10 0.00 0.00 175.22 175.27 2d87 h PRO 50 N 6.92 0.00 0.00 0.24 0.13 -1.44 -2.93 132.00 134.92 2d87 h PRO 50 Ca 0.06 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.99 2d87 h PRO 50 Cb 0.93 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.03 2d87 h PRO 50 CO 0.77 0.26 -1.10 1.05 -0.23 0.00 0.00 178.00 178.74 2d87 h GLU 51 N 0.00 0.00 -0.66 0.86 4.11 -1.90 -3.34 114.58 113.65 2d87 h GLU 51 Ca -0.00 0.00 0.14 0.00 0.07 0.00 0.00 59.36 59.56 2d87 h GLU 51 Cb 0.69 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.84 2d87 h GLU 51 CO 0.03 0.70 0.11 0.00 0.07 0.00 0.00 179.01 179.93 2d87 h ALA 52 N 1.15 0.78 -2.81 1.06 0.00 -1.89 -3.44 119.26 114.10 2d87 h ALA 52 Ca -0.09 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2d87 h ALA 52 Cb 1.72 0.24 -0.11 0.00 0.00 0.00 0.00 17.79 19.64 2d87 h ALA 52 CO 0.10 -0.34 -0.05 -0.59 0.00 0.00 0.00 179.25 178.36 2d87 s PHE 53 N -6.09 -0.04 -0.10 0.00 -0.71 -1.25 -4.99 117.98 104.78 2d87 s PHE 53 Ca -0.13 -0.30 -0.15 0.00 -1.04 0.00 0.00 56.93 55.31 2d87 s PHE 53 Cb 0.19 0.29 -0.05 0.00 -1.21 0.00 0.00 43.02 42.25 2d87 s PHE 53 CO 0.75 -0.84 0.36 -0.51 -1.34 0.00 0.00 175.22 173.63 2d87 s ASP 54 N -2.88 6.59 -0.21 1.98 1.01 -1.26 -4.76 116.67 117.14 2d87 s ASP 54 Ca 0.09 0.70 -0.20 0.00 0.71 0.00 0.00 52.55 53.85 2d87 s ASP 54 Cb 0.00 -2.22 -0.18 0.00 1.01 0.00 0.00 42.92 41.54 2d87 s ASP 54 CO -0.04 0.16 0.16 0.00 0.21 0.00 0.00 175.17 175.65 2d87 n TYR 55 N 3.01 0.95 0.27 4.23 9.36 -1.26 -4.03 117.16 129.69 2d87 n TYR 55 Ca -0.12 0.41 0.16 0.00 3.32 0.00 0.00 57.90 61.67 2d87 n TYR 55 Cb 0.52 -1.07 0.89 0.00 -0.63 0.00 0.00 39.34 39.04 2d87 n TYR 55 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 2d87 h GLY 56 N -1.00 0.00 1.84 2.98 0.00 -2.01 -0.85 103.07 104.03 2d87 h GLY 56 Ca -0.35 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 46.85 2d87 h GLY 56 CO -0.21 0.00 -0.54 1.46 0.00 0.00 0.00 176.54 177.25 2d87 h GLN 57 N 0.00 0.16 -7.25 4.80 1.08 -2.00 -3.45 115.11 108.46 2d87 h GLN 57 Ca 0.03 -0.10 -0.44 0.00 -1.45 0.00 0.00 58.65 56.69 2d87 h GLN 57 Cb 0.16 0.01 0.19 0.00 -0.05 0.00 0.00 27.48 27.79 2d87 h GLN 57 CO -0.00 0.67 0.08 -0.51 -0.95 0.00 0.00 178.83 178.12 2d87 s LEU 58 N -7.95 0.93 0.03 1.46 1.43 -0.33 -5.07 118.68 109.19 2d87 s LEU 58 Ca -0.03 1.22 0.01 0.00 -1.03 0.00 0.00 54.13 54.30 2d87 s LEU 58 Cb 0.13 -3.18 -0.02 0.00 0.03 0.00 0.00 46.19 43.15 2d87 s LEU 58 CO 0.78 -3.87 -0.06 -0.44 0.23 0.00 0.00 176.35 172.99 2d87 s SER 59 N -3.08 0.57 0.43 2.29 0.01 -1.26 -5.04 113.70 107.62 2d87 s SER 59 Ca 0.67 -0.48 0.22 0.00 1.31 0.00 0.00 55.95 57.67 2d87 s SER 59 Cb -0.20 0.05 0.96 0.00 0.21 0.00 0.00 66.02 67.04 2d87 s SER 59 CO 0.61 -0.22 1.86 1.55 0.41 0.00 0.00 173.24 177.44 2d87 h PRO 60 N 4.71 0.00 0.00 12.44 0.13 -1.98 -2.71 132.00 144.59 2d87 h PRO 60 Ca -0.33 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.79 2d87 h PRO 60 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 2d87 h PRO 60 CO 0.42 0.26 -0.03 0.37 -0.23 0.00 0.00 178.00 178.78 2d87 h GLN 61 N 0.00 0.00 -6.04 0.86 4.15 -1.96 -3.42 115.11 108.70 2d87 h GLN 61 Ca -0.00 0.00 -0.59 0.00 0.77 0.00 0.00 58.65 58.83 2d87 h GLN 61 Cb 0.69 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 28.29 2d87 h GLN 61 CO 0.03 0.03 0.62 -0.80 -1.93 0.00 0.00 178.83 176.78 2d87 s ASN 62 N -5.73 6.78 -0.09 -0.69 0.01 -1.02 -4.91 114.94 109.29 2d87 s ASN 62 Ca 0.00 0.82 0.03 0.00 -0.71 0.00 0.00 52.86 53.00 2d87 s ASN 62 Cb 0.10 -2.47 -0.24 0.00 0.41 0.00 0.00 41.25 39.04 2d87 s ASN 62 CO 0.55 -0.76 0.48 0.54 -1.51 0.00 0.00 177.10 176.39 2d87 n ARG 63 N 6.56 0.70 -0.04 -0.60 3.00 -1.26 -3.92 116.66 121.09 2d87 n ARG 63 Ca 0.08 0.27 -0.01 0.00 -0.01 0.00 0.00 57.85 58.17 2d87 n ARG 63 Cb 0.48 -1.74 -0.00 0.00 0.00 0.00 0.00 32.46 31.19 2d87 n ARG 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2d87 h ARG 64 N 0.03 0.00 -1.00 5.56 3.08 -1.90 -3.33 114.38 116.82 2d87 h ARG 64 Ca -0.37 0.00 0.18 0.00 0.07 0.00 0.00 59.98 59.86 2d87 h ARG 64 Cb 2.03 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 31.90 2d87 h ARG 64 CO 0.08 0.00 -0.30 0.94 -1.07 0.00 0.00 179.97 179.62 2d87 n GLN 65 N -3.83 -0.14 -0.19 0.04 7.27 -1.26 -0.02 117.38 119.25 2d87 n GLN 65 Ca -0.02 1.55 -0.04 0.00 0.07 0.00 0.00 57.00 58.55 2d87 n GLN 65 Cb 0.08 -2.30 0.02 0.00 2.41 0.00 0.00 30.24 30.44 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 -1.03 0.39 1.69 2.35 -1.75 0.21 115.58 117.45 2d87 h ASN 66 Ca 0.43 0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 56.38 2d87 h ASN 66 Cb 0.68 0.53 0.00 0.00 0.05 0.00 0.00 38.32 39.58 2d87 h ASN 66 CO -1.01 -0.29 -0.19 -0.26 -1.65 0.00 0.00 177.43 174.03 2d87 h PHE 67 N -0.14 -0.48 -0.81 1.19 -1.00 -0.55 -2.70 116.94 112.44 2d87 h PHE 67 Ca 0.24 -0.01 0.07 0.00 2.81 0.00 0.00 57.97 61.08 2d87 h PHE 67 Cb 0.54 0.16 -0.10 0.00 3.61 0.00 0.00 35.95 40.16 2d87 h PHE 67 CO -0.60 -0.30 -0.48 0.39 -1.61 0.00 0.00 178.31 175.71 2d87 n GLU 68 N -4.14 -0.36 -0.16 1.51 1.02 0.27 -0.41 120.64 118.39 2d87 n GLU 68 Ca -0.06 1.39 -0.06 0.00 -0.02 0.00 0.00 57.16 58.40 2d87 n GLU 68 Cb 0.21 -2.04 0.00 0.00 -0.02 0.00 0.00 31.44 29.59 2d87 n GLU 68 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2d87 h VAL 69 N 0.00 0.24 -0.03 2.62 2.07 -0.69 0.99 116.25 121.45 2d87 h VAL 69 Ca 0.13 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.68 2d87 h VAL 69 Cb 0.33 0.24 -0.05 0.00 -1.52 0.00 0.00 31.29 30.30 2d87 h VAL 69 CO -0.76 0.00 -0.26 0.00 0.02 0.00 0.00 177.57 176.57 2d87 h ALA 70 N 0.98 -0.33 0.06 1.67 0.00 -0.50 0.22 119.26 121.37 2d87 h ALA 70 Ca 0.21 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2d87 h ALA 70 Cb 0.52 0.47 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 2d87 h ALA 70 CO -0.59 -0.75 -0.05 0.74 0.00 0.00 0.00 179.25 178.59 2d87 h PHE 71 N -0.38 -0.14 -0.59 0.00 0.04 0.21 -3.03 116.94 113.05 2d87 h PHE 71 Ca 0.07 0.00 0.09 0.00 2.80 0.00 0.00 57.97 60.94 2d87 h PHE 71 Cb 0.48 0.05 -0.11 0.00 2.20 0.00 0.00 35.95 38.57 2d87 h PHE 71 CO -0.31 -0.07 -0.40 0.77 -0.60 0.00 0.00 178.31 177.70 2d87 h SER 72 N -0.11 -1.38 -1.65 2.17 0.02 -0.83 0.38 113.55 112.16 2d87 h SER 72 Ca -0.01 0.24 0.50 0.00 -0.84 0.00 0.00 61.79 61.68 2d87 h SER 72 Cb 0.09 0.64 -0.09 0.00 0.14 0.00 0.00 62.40 63.19 2d87 h SER 72 CO -0.00 -0.32 1.16 -1.20 -1.14 0.00 0.00 176.83 175.33 2d87 n SER 73 N -5.42 0.05 -0.02 3.07 7.64 0.77 -0.71 113.62 119.00 2d87 n SER 73 Ca 0.03 0.99 -0.00 0.00 1.01 0.00 0.00 58.87 60.90 2d87 n SER 73 Cb 0.35 -0.49 -0.00 0.00 -1.01 0.00 0.00 64.21 63.06 2d87 n SER 73 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d87 h ALA 74 N 1.04 -0.02 -1.14 -0.43 0.00 -0.11 -3.32 119.26 115.28 2d87 h ALA 74 Ca 0.84 -0.00 0.33 0.00 0.00 0.00 0.00 54.91 56.08 2d87 h ALA 74 Cb 3.21 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 20.96 2d87 h ALA 74 CO -0.12 -0.02 1.08 1.49 0.00 0.00 0.00 179.25 181.68 2d87 h GLU 75 N -0.58 0.00 -0.01 0.00 4.81 -0.67 0.54 114.58 118.68 2d87 h GLU 75 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2d87 h GLU 75 Cb 0.01 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 2d87 h GLU 75 CO 0.00 0.00 -0.01 1.15 -0.73 0.00 0.00 179.01 179.43 2d87 h THR 76 N 0.00 0.00 0.00 0.32 2.02 -1.22 -1.50 112.91 112.53 2d87 h THR 76 Ca 0.54 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.72 2d87 h THR 76 Cb 2.70 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 69.10 2d87 h THR 76 CO -0.01 0.00 -1.42 0.00 0.37 0.00 0.00 175.52 174.46 2d87 n HIS 77 N -2.82 0.00 0.13 3.16 1.44 -0.84 -4.52 115.22 111.77 2d87 n HIS 77 Ca -0.00 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.81 2d87 n HIS 77 Cb 0.00 -0.21 0.04 0.00 0.12 0.00 0.00 29.99 29.94 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 0.83 0.65 -5.46 1.59 0.00 -0.06 -3.48 119.26 113.34 2d87 h ALA 78 Ca -0.00 -0.11 -0.39 0.00 0.00 0.00 0.00 54.91 54.40 2d87 h ALA 78 Cb 0.44 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 2d87 h ALA 78 CO 0.00 0.13 -0.58 -3.47 0.00 0.00 0.00 179.25 175.33 2d87 n ASP 79 N -2.84 -3.95 -4.76 0.00 -0.08 -0.57 -4.81 116.55 99.54 2d87 n ASP 79 Ca 0.00 -0.43 -0.41 0.00 -1.51 0.00 0.00 54.79 52.45 2d87 n ASP 79 Cb 0.59 -3.25 -0.04 0.00 2.34 0.00 0.00 41.12 40.76 2d87 n ASP 79 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2d87 s PRO 81 N -1.37 4.34 -1.08 0.00 0.04 -1.26 -4.37 135.00 131.31 2d87 s PRO 81 Ca 0.47 2.01 -0.14 0.00 0.04 0.00 0.00 61.00 63.38 2d87 s PRO 81 Cb -0.34 -2.99 0.19 0.00 0.04 0.00 0.00 34.50 31.39 2d87 s PRO 81 CO 0.44 -0.12 1.22 -0.65 0.04 0.00 0.00 177.00 177.92 2d87 s GLN 82 N -1.84 3.94 -0.05 4.56 -1.52 -1.26 -4.84 119.66 118.65 2d87 s GLN 82 Ca 0.50 -2.51 -0.17 0.00 -1.95 0.00 0.00 55.36 51.22 2d87 s GLN 82 Cb -0.35 -4.85 -0.12 0.00 -0.22 0.00 0.00 33.01 27.47 2d87 s GLN 82 CO 0.46 -1.60 0.70 -0.07 -0.25 0.00 0.00 175.29 174.53 2d87 h LEU 83 N 9.00 -0.25 -9.97 2.90 3.38 -2.01 -3.45 115.31 114.91 2d87 h LEU 83 Ca 0.23 -0.22 -0.56 0.00 0.09 0.00 0.00 57.88 57.42 2d87 h LEU 83 Cb 0.93 0.06 0.15 0.00 0.09 0.00 0.00 40.66 41.90 2d87 h LEU 83 CO 1.10 0.27 0.41 0.18 0.09 0.00 0.00 178.44 180.49 2d87 n LEU 84 N -4.97 4.92 -4.15 1.67 4.77 -1.26 -4.96 117.00 113.02 2d87 n LEU 84 Ca -0.07 0.89 -0.39 0.00 -0.03 0.00 0.00 56.01 56.42 2d87 n LEU 84 Cb 0.23 -1.50 -0.07 0.00 -2.33 0.00 0.00 43.42 39.74 2d87 n LEU 84 CO 0.20 -1.12 0.16 -1.81 -1.33 0.00 0.00 177.39 173.49 2d87 s ASP 85 N -1.11 5.65 0.26 -1.43 1.01 -1.26 -4.95 116.67 114.84 2d87 s ASP 85 Ca 0.75 -2.89 -0.04 0.00 0.71 0.00 0.00 52.55 51.08 2d87 s ASP 85 Cb -0.42 -1.95 0.50 0.00 1.01 0.00 0.00 42.92 42.07 2d87 s ASP 85 CO 0.47 -0.40 1.41 0.41 0.21 0.00 0.00 175.17 177.26 2d87 n THR 86 N 3.51 -0.38 -0.28 -1.27 -1.04 -1.26 0.14 114.28 113.70 2d87 n THR 86 Ca 0.10 2.04 0.09 0.00 -2.04 0.00 0.00 64.05 64.24 2d87 n THR 86 Cb 0.40 -2.87 0.24 0.00 -1.82 0.00 0.00 70.33 66.27 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 0.33 0.02 -2.82 5.08 -2.00 0.15 114.58 115.33 2d87 h GLU 87 Ca 0.47 -0.02 -0.22 0.00 -1.00 0.00 0.00 59.36 58.59 2d87 h GLU 87 Cb 0.81 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 2d87 h GLU 87 CO -0.90 0.22 -1.02 -0.44 -1.00 0.00 0.00 179.01 175.86 2d87 h ASP 88 N 0.34 0.09 -0.47 1.42 3.32 0.73 -3.31 116.42 118.54 2d87 h ASP 88 Ca 0.48 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.43 2d87 h ASP 88 Cb 0.86 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.35 2d87 h ASP 88 CO -0.52 1.05 0.27 0.24 -1.72 0.00 0.00 179.24 178.56 2d87 h MET 89 N 0.02 0.65 0.00 3.56 2.86 0.19 -1.70 114.93 120.51 2d87 h MET 89 Ca -0.03 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2d87 h MET 89 Cb 1.76 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 33.29 2d87 h MET 89 CO 0.14 0.50 0.00 0.28 1.06 0.00 0.00 176.91 178.89 2d87 n VAL 90 N -4.69 0.00 -0.29 -2.22 0.31 0.09 -2.66 118.33 108.86 2d87 n VAL 90 Ca 0.02 1.49 0.11 0.00 -0.01 0.00 0.00 64.34 65.95 2d87 n VAL 90 Cb 0.07 -2.36 0.26 0.00 -0.91 0.00 0.00 33.84 30.91 2d87 n VAL 90 CO 0.00 0.00 0.00 0.08 -1.32 0.00 0.00 176.83 175.59 2d87 h ARG 91 N 0.00 0.21 -6.38 5.55 0.11 -1.65 -3.36 114.38 108.86 2d87 h ARG 91 Ca 0.00 -0.01 -0.57 0.00 0.10 0.00 0.00 59.98 59.50 2d87 h ARG 91 Cb 0.00 -0.05 -0.04 0.00 1.11 0.00 0.00 29.97 31.00 2d87 h ARG 91 CO 0.00 0.14 1.17 -0.51 0.10 0.00 0.00 179.97 180.87 2d87 s LEU 92 N -10.66 3.59 0.46 0.08 1.43 -0.64 -4.86 118.68 108.08 2d87 s LEU 92 Ca -0.12 1.16 0.29 0.00 -1.03 0.00 0.00 54.13 54.43 2d87 s LEU 92 Cb 0.25 -3.53 1.36 0.00 0.03 0.00 0.00 46.19 44.30 2d87 s LEU 92 CO 0.77 -1.53 1.71 -0.09 0.23 0.00 0.00 176.35 177.45 2d87 h ARG 93 N 11.66 0.17 -3.70 1.70 9.65 -1.78 -3.40 114.38 128.68 2d87 h ARG 93 Ca -0.31 -0.01 -0.21 0.00 -1.10 0.00 0.00 59.98 58.35 2d87 h ARG 93 Cb 1.14 -0.04 -0.26 0.00 -1.39 0.00 0.00 29.97 29.42 2d87 h ARG 93 CO 1.05 0.11 -0.68 -1.21 2.80 0.00 0.00 179.97 182.04 2d87 s GLU 94 N -5.25 0.10 1.08 0.20 8.01 -1.26 -4.83 118.70 116.75 2d87 s GLU 94 Ca -0.07 -0.09 -0.15 0.00 0.01 0.00 0.00 54.97 54.67 2d87 s GLU 94 Cb 0.26 0.04 0.23 0.00 -4.31 0.00 0.00 34.13 30.35 2d87 s GLU 94 CO 0.82 -0.02 1.10 -1.25 0.01 0.00 0.00 175.26 175.92 2d87 s PRO 95 N -0.29 -0.24 -0.55 0.39 0.04 -1.26 -4.99 135.00 128.10 2d87 s PRO 95 Ca -0.03 0.28 -0.18 0.00 0.04 0.00 0.00 61.00 61.11 2d87 s PRO 95 Cb -0.02 -1.68 0.09 0.00 0.04 0.00 0.00 34.50 32.93 2d87 s PRO 95 CO -0.00 -3.13 0.63 -0.51 0.04 0.00 0.00 177.00 174.03 2d87 s ASP 96 N -3.61 6.19 0.18 6.66 1.01 -1.26 -4.91 116.67 120.93 2d87 s ASP 96 Ca 0.67 -1.30 -0.14 0.00 0.71 0.00 0.00 52.55 52.50 2d87 s ASP 96 Cb -0.15 -2.28 0.18 0.00 1.01 0.00 0.00 42.92 41.68 2d87 s ASP 96 CO 0.57 -0.97 1.22 -2.67 0.21 0.00 0.00 175.17 173.53 2d87 n TRP 97 N 6.06 0.01 -0.32 4.23 4.27 -1.26 0.10 117.44 130.53 2d87 n TRP 97 Ca -0.09 0.97 0.11 0.00 -3.89 0.00 0.00 57.50 54.60 2d87 n TRP 97 Cb 0.43 -0.79 0.23 0.00 -1.36 0.00 0.00 31.31 29.83 2d87 n TRP 97 CO 0.00 0.00 0.00 1.63 -2.29 0.00 0.00 177.69 177.03 2d87 n LYS 98 N -5.15 -0.08 0.13 -2.67 5.02 -1.26 -1.34 118.16 112.81 2d87 n LYS 98 Ca 0.08 1.39 -0.06 0.00 -2.02 0.00 0.00 58.31 57.70 2d87 n LYS 98 Cb 0.31 -2.18 -0.03 0.00 -0.02 0.00 0.00 35.03 33.11 2d87 n LYS 98 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2d87 n VAL 100 N -5.05 -0.31 -0.34 0.00 0.31 -0.45 0.21 118.33 112.71 2d87 n VAL 100 Ca -0.05 1.48 0.22 0.00 -0.01 0.00 0.00 64.34 65.98 2d87 n VAL 100 Cb 0.16 -1.87 0.45 0.00 -0.91 0.00 0.00 33.84 31.67 2d87 n VAL 100 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 2d87 h TYR 101 N 0.00 0.87 0.45 3.52 5.03 -1.36 -0.42 116.97 125.06 2d87 h TYR 101 Ca 0.07 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.40 2d87 h TYR 101 Cb 0.18 -0.24 -0.00 0.00 1.55 0.00 0.00 36.73 38.22 2d87 h TYR 101 CO -0.71 -0.00 -0.27 1.15 -1.32 0.00 0.00 178.16 177.00 2d87 h THR 102 N 0.45 0.44 -0.33 1.81 2.02 0.25 -1.43 112.91 116.11 2d87 h THR 102 Ca 0.66 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.88 2d87 h THR 102 Cb 1.48 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 68.29 2d87 h THR 102 CO -0.45 0.00 0.11 0.22 0.37 0.00 0.00 175.52 175.77 2d87 h TYR 103 N -0.68 0.20 -0.95 3.16 5.03 -0.35 -0.12 116.97 123.25 2d87 h TYR 103 Ca -0.05 0.02 0.14 0.00 2.58 0.00 0.00 58.73 61.41 2d87 h TYR 103 Cb 0.56 -0.04 -0.08 0.00 1.55 0.00 0.00 36.73 38.72 2d87 h TYR 103 CO -0.09 0.08 0.60 0.82 -1.32 0.00 0.00 178.16 178.25 2d87 h ILE 104 N 0.25 0.86 -0.18 1.81 1.08 -1.11 -0.77 117.51 119.45 2d87 h ILE 104 Ca 0.15 -0.29 -0.22 0.00 -0.39 0.00 0.00 64.86 64.12 2d87 h ILE 104 Cb 0.13 -0.04 0.01 0.00 -3.07 0.00 0.00 36.82 33.84 2d87 h ILE 104 CO -0.16 0.15 -0.74 -0.61 -0.69 0.00 0.00 178.15 176.10 2d87 h GLN 105 N 0.83 0.82 0.94 2.37 4.15 -0.41 -2.81 115.11 121.00 2d87 h GLN 105 Ca 0.48 -0.64 -0.04 0.00 0.77 0.00 0.00 58.65 59.21 2d87 h GLN 105 Cb 0.63 0.13 0.01 0.00 0.21 0.00 0.00 27.48 28.45 2d87 h GLN 105 CO -0.24 1.25 -0.47 1.49 -1.93 0.00 0.00 178.83 178.93 2d87 h GLU 106 N 0.57 -1.24 -0.70 1.69 4.22 0.16 -2.96 114.58 116.31 2d87 h GLU 106 Ca -0.04 0.08 0.13 0.00 0.08 0.00 0.00 59.36 59.61 2d87 h GLU 106 Cb 1.37 0.28 -0.09 0.00 0.50 0.00 0.00 28.75 30.81 2d87 h GLU 106 CO 0.16 -0.82 0.25 0.35 -2.18 0.00 0.00 179.01 176.76 2d87 h PHE 107 N -1.28 0.43 -0.24 0.92 3.57 -1.30 0.27 116.94 119.30 2d87 h PHE 107 Ca -0.13 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.48 2d87 h PHE 107 Cb 0.99 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 2d87 h PHE 107 CO -0.02 0.05 0.49 -0.92 -2.23 0.00 0.00 178.31 175.67 2d87 h TYR 108 N 0.40 0.00 0.00 0.41 3.20 -1.34 0.69 116.97 120.33 2d87 h TYR 108 Ca 0.38 0.00 -0.24 0.00 3.14 0.00 0.00 58.73 62.01 2d87 h TYR 108 Cb 0.56 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.79 2d87 h TYR 108 CO -0.19 0.00 -1.27 -0.09 -1.64 0.00 0.00 178.16 174.97 2d87 h ARG 109 N 0.00 0.00 0.06 1.82 2.43 -0.34 -3.21 114.38 115.14 2d87 h ARG 109 Ca 0.12 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.13 2d87 h ARG 109 Cb 1.10 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.66 2d87 h ARG 109 CO -0.00 0.79 -0.66 0.00 -1.51 0.00 0.00 179.97 178.59 2d87 h LEU 111 N -0.25 0.42 -0.63 0.00 3.38 -1.30 -2.32 115.31 114.61 2d87 h LEU 111 Ca -0.10 0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.01 2d87 h LEU 111 Cb 1.43 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 42.03 2d87 h LEU 111 CO 0.13 0.29 0.18 0.58 0.09 0.00 0.00 178.44 179.71 2d87 h VAL 112 N 0.55 0.67 0.50 1.22 2.07 -1.65 -0.41 116.25 119.20 2d87 h VAL 112 Ca 0.22 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 2d87 h VAL 112 Cb 0.10 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 2d87 h VAL 112 CO -0.14 0.06 -0.33 1.56 0.02 0.00 0.00 177.57 178.74 2d87 h GLN 113 N 0.32 -0.78 0.00 1.57 4.20 -1.47 -1.34 115.11 117.62 2d87 h GLN 113 Ca 0.33 0.05 0.00 0.00 0.06 0.00 0.00 58.65 59.10 2d87 h GLN 113 Cb 0.48 0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.44 2d87 h GLN 113 CO -0.38 -0.52 0.10 0.87 -0.67 0.00 0.00 178.83 178.23 2d87 h LYS 114 N -0.80 0.00 -0.07 1.46 6.56 -1.08 -3.45 116.57 119.18 2d87 h LYS 114 Ca -0.06 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.53 2d87 h LYS 114 Cb 0.67 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.33 2d87 h LYS 114 CO 0.04 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.84 2d87 n GLY 115 N -1.19 0.94 0.13 3.86 0.00 -0.39 -4.99 105.19 103.55 2d87 n GLY 115 Ca -0.02 -0.57 -0.21 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.04 2.64 -4.14 0.99 4.77 -0.30 -4.73 117.00 116.19 2d87 n LEU 116 Ca 0.00 0.14 -0.38 0.00 -0.03 0.00 0.00 56.01 55.74 2d87 n LEU 116 Cb 0.33 -1.04 -0.09 0.00 -2.33 0.00 0.00 43.42 40.29 2d87 n LEU 116 CO 0.00 0.82 0.07 -0.69 -1.33 0.00 0.00 177.39 176.25 2d87 s VAL 117 N -2.53 3.99 0.12 4.08 1.01 -1.24 -4.98 120.40 120.85 2d87 s VAL 117 Ca -0.27 -2.67 -0.30 0.00 0.00 0.00 0.00 61.98 58.73 2d87 s VAL 117 Cb 0.08 -3.59 -0.07 0.00 0.00 0.00 0.00 36.38 32.80 2d87 s VAL 117 CO 0.70 -0.87 1.22 -0.54 0.00 0.00 0.00 175.10 175.61 2d87 s LYS 118 N 0.25 4.45 0.04 2.72 -0.14 -1.26 -4.38 119.74 121.42 2d87 s LYS 118 Ca 0.15 1.84 0.03 0.00 -1.36 0.00 0.00 55.97 56.63 2d87 s LYS 118 Cb -0.20 -3.29 -0.02 0.00 -1.68 0.00 0.00 37.83 32.64 2d87 s LYS 118 CO -0.04 -0.20 -0.10 -0.08 -0.76 0.00 0.00 175.35 174.17 2d87 s THR 119 N 0.60 0.71 -0.48 2.17 -1.32 -1.26 -5.08 115.64 110.99 2d87 s THR 119 Ca 0.57 -1.04 -0.39 0.00 -1.21 0.00 0.00 61.69 59.62 2d87 s THR 119 Cb -0.31 -0.73 -0.16 0.00 -1.51 0.00 0.00 72.50 69.79 2d87 s THR 119 CO 0.32 -0.26 2.21 1.17 -2.21 0.00 0.00 174.62 175.85 2d87 n LYS 120 N 1.61 0.45 -3.78 7.08 0.00 -1.26 -4.89 118.16 117.36 2d87 n LYS 120 Ca -0.21 0.11 -0.12 0.00 0.00 0.00 0.00 58.31 58.10 2d87 n LYS 120 Cb 0.55 -1.92 -0.08 0.00 0.00 0.00 0.00 35.03 33.58 2d87 n LYS 120 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2d87 s LYS 121 N 6.35 0.74 -0.03 1.64 2.47 -1.26 -5.16 119.74 124.49 2d87 s LYS 121 Ca 1.17 -0.48 -0.04 0.00 -1.56 0.00 0.00 55.97 55.05 2d87 s LYS 121 Cb -1.20 0.32 -0.04 0.00 -1.46 0.00 0.00 37.83 35.45 2d87 s LYS 121 CO 0.57 -0.22 0.19 -1.54 0.16 0.00 0.00 175.35 174.51 2d87 s SER 122 N -1.92 6.40 -0.16 1.43 1.04 -1.26 -5.04 113.70 114.19 2d87 s SER 122 Ca -0.07 0.41 -0.13 0.00 0.48 0.00 0.00 55.95 56.64 2d87 s SER 122 Cb -0.02 -2.03 -0.08 0.00 0.10 0.00 0.00 66.02 63.99 2d87 s SER 122 CO -0.02 0.29 -0.02 0.28 0.98 0.00 0.00 173.24 174.75 2d87 h SER 123 N 4.07 0.00 0.00 7.02 0.02 -2.02 -3.51 113.55 119.13 2d87 h SER 123 Ca -0.50 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.27 2d87 h SER 123 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2d87 h SER 123 CO 0.66 0.98 0.00 0.61 -1.14 0.00 0.00 176.83 177.94 2d87 n GLY 124 N 1.57 0.67 3.75 -3.77 0.00 -1.26 -5.09 105.19 101.05 2d87 n GLY 124 Ca -0.15 -2.06 -0.30 0.00 0.00 0.00 0.00 46.02 43.51 2d87 n GLY 124 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d87 s PRO 125 N -0.84 1.81 -0.29 1.61 0.04 -1.26 -4.92 135.00 131.15 2d87 s PRO 125 Ca 0.00 1.02 -0.28 0.00 0.04 0.00 0.00 61.00 61.77 2d87 s PRO 125 Cb 0.00 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.66 2d87 s PRO 125 CO 0.00 -1.91 1.86 0.45 0.04 0.00 0.00 177.00 177.44 2d87 s SER 126 N -3.40 5.87 -0.18 6.66 0.15 -1.26 -4.95 113.70 116.59 2d87 s SER 126 Ca 0.62 1.48 -0.28 0.00 0.70 0.00 0.00 55.95 58.47 2d87 s SER 126 Cb -0.18 -2.52 -0.00 0.00 -1.71 0.00 0.00 66.02 61.61 2d87 s SER 126 CO 0.56 -1.69 0.98 -0.94 1.20 0.00 0.00 173.24 173.35 2d87 s SER 127 N 6.27 7.11 0.00 5.45 1.04 -1.26 -5.33 113.70 126.98 2d87 s SER 127 Ca 0.83 1.38 0.00 0.00 0.48 0.00 0.00 55.95 58.64 2d87 s SER 127 Cb -0.25 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.34 2d87 s SER 127 CO 0.34 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.63