#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sk6 h GLU 6 N 0.00 0.02 -0.34 -0.78 4.81 -2.06 -3.36 114.58 112.87 1sk6 h GLU 6 Ca 0.00 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1sk6 h GLU 6 Cb 0.00 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1sk6 h GLU 6 CO 0.00 1.02 0.19 0.93 -0.73 0.00 0.00 179.01 180.42 1sk6 h GLU 7 N -0.94 0.46 -1.76 1.92 4.39 -2.05 -0.44 114.58 116.16 1sk6 h GLU 7 Ca -0.25 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.41 1sk6 h GLU 7 Cb 1.26 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 1sk6 h GLU 7 CO -0.13 0.34 0.00 1.04 -1.16 0.00 0.00 179.01 179.10 1sk6 n GLN 8 N -4.45 0.70 0.07 2.33 6.02 -1.26 -2.87 117.38 117.92 1sk6 n GLN 8 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 1sk6 n GLN 8 Cb 0.09 -1.15 0.00 0.00 1.02 0.00 0.00 30.24 30.20 1sk6 n GLN 8 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1sk6 n ILE 9 N 1.30 0.00 -0.25 5.09 5.41 -0.31 -4.80 119.36 125.80 1sk6 n ILE 9 Ca 0.00 0.00 0.15 0.00 1.00 0.00 0.00 62.75 63.90 1sk6 n ILE 9 Cb 0.35 -0.13 0.44 0.00 -0.71 0.00 0.00 39.64 39.59 1sk6 n ILE 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1sk6 h ALA 10 N 0.00 1.99 0.05 -1.39 0.00 -1.06 -2.76 119.26 116.10 1sk6 h ALA 10 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1sk6 h ALA 10 Cb 0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1sk6 h ALA 10 CO 0.00 -0.25 -0.05 0.93 0.00 0.00 0.00 179.25 179.88 1sk6 h GLU 11 N 0.55 -0.09 -0.13 0.00 5.08 -1.80 -3.24 114.58 114.95 1sk6 h GLU 11 Ca 0.45 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.83 1sk6 h GLU 11 Cb 0.91 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 1sk6 h GLU 11 CO -0.19 -0.06 -0.07 1.19 -1.00 0.00 0.00 179.01 178.87 1sk6 n PHE 12 N -2.54 -0.04 -0.33 4.33 3.72 -1.04 -0.24 117.46 121.32 1sk6 n PHE 12 Ca -0.01 0.16 0.14 0.00 -0.05 0.00 0.00 57.45 57.69 1sk6 n PHE 12 Cb 0.04 -0.52 0.27 0.00 -0.94 0.00 0.00 39.48 38.34 1sk6 n PHE 12 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1sk6 n LYS 13 N -4.17 -0.08 -0.37 -1.08 4.81 -1.22 0.08 118.16 116.13 1sk6 n LYS 13 Ca 0.01 1.44 0.30 0.00 -0.87 0.00 0.00 58.31 59.18 1sk6 n LYS 13 Cb 0.04 -2.28 0.60 0.00 0.02 0.00 0.00 35.03 33.41 1sk6 n LYS 13 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1sk6 h GLU 14 N 0.00 0.22 -0.48 1.64 4.39 -0.80 0.45 114.58 120.00 1sk6 h GLU 14 Ca 0.58 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 60.25 1sk6 h GLU 14 Cb 1.17 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.75 1sk6 h GLU 14 CO -0.91 0.14 0.23 0.00 -1.16 0.00 0.00 179.01 177.31 1sk6 h ALA 15 N 1.56 1.50 0.00 3.43 0.00 -0.53 -3.24 119.26 121.97 1sk6 h ALA 15 Ca 0.66 -0.10 -0.31 0.00 0.00 0.00 0.00 54.91 55.16 1sk6 h ALA 15 Cb 2.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 1sk6 h ALA 15 CO -0.27 0.40 1.53 1.19 0.00 0.00 0.00 179.25 182.11 1sk6 n PHE 16 N -4.38 0.89 -1.12 0.00 3.01 0.16 -2.17 117.46 113.84 1sk6 n PHE 16 Ca 0.04 -1.70 0.00 0.00 1.01 0.00 0.00 57.45 56.80 1sk6 n PHE 16 Cb 0.12 -1.59 0.00 0.00 -0.01 0.00 0.00 39.48 38.01 1sk6 n PHE 16 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1sk6 n SER 17 N 3.39 0.00 -0.02 4.37 7.64 -1.22 -4.91 113.62 122.86 1sk6 n SER 17 Ca 0.43 -0.30 -0.01 0.00 1.01 0.00 0.00 58.87 59.99 1sk6 n SER 17 Cb 0.38 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.57 1sk6 n SER 17 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1sk6 h LEU 18 N 0.00 0.00 -6.13 -3.43 3.38 -1.65 -3.48 115.31 104.01 1sk6 h LEU 18 Ca 0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 1sk6 h LEU 18 Cb 0.30 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 40.76 1sk6 h LEU 18 CO 0.00 0.25 -0.69 0.12 0.09 0.00 0.00 178.44 178.21 1sk6 s PHE 19 N -1.40 -0.38 -0.29 1.13 2.19 -1.26 -5.07 117.98 112.89 1sk6 s PHE 19 Ca -0.05 -0.95 0.03 0.00 0.33 0.00 0.00 56.93 56.29 1sk6 s PHE 19 Cb 0.01 -0.32 0.20 0.00 -1.31 0.00 0.00 43.02 41.59 1sk6 s PHE 19 CO 0.07 -1.01 0.65 0.34 1.83 0.00 0.00 175.22 177.10 1sk6 s ASP 20 N 1.14 -1.45 0.00 6.13 3.68 -1.26 -5.01 116.67 119.91 1sk6 s ASP 20 Ca 0.21 0.26 0.00 0.00 2.13 0.00 0.00 52.55 55.15 1sk6 s ASP 20 Cb -0.09 1.96 0.00 0.00 -1.45 0.00 0.00 42.92 43.33 1sk6 s ASP 20 CO -0.06 -0.27 0.30 0.29 0.13 0.00 0.00 175.17 175.56 1sk6 n LYS 21 N 5.39 0.58 0.20 4.34 4.76 -1.26 -3.19 118.16 128.97 1sk6 n LYS 21 Ca 0.05 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.56 1sk6 n LYS 21 Cb 0.54 -1.28 0.37 0.00 -1.84 0.00 0.00 35.03 32.82 1sk6 n LYS 21 CO 0.00 0.00 0.00 0.38 -1.37 0.00 0.00 177.40 176.41 1sk6 h ASP 22 N 0.41 0.00 0.00 4.39 2.03 -1.95 -3.48 116.42 117.82 1sk6 h ASP 22 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1sk6 h ASP 22 Cb 0.28 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.78 1sk6 h ASP 22 CO 0.00 0.32 0.00 0.61 -1.03 0.00 0.00 179.24 179.14 1sk6 n GLY 23 N 0.24 2.07 2.34 7.15 0.00 -1.19 -4.60 105.19 111.20 1sk6 n GLY 23 Ca 0.00 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 1sk6 n GLY 23 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sk6 n ASP 24 N 5.12 7.07 -3.01 1.61 8.00 -1.26 -4.78 116.55 129.29 1sk6 n ASP 24 Ca 0.00 -2.47 0.00 0.00 0.71 0.00 0.00 54.79 53.03 1sk6 n ASP 24 Cb 0.00 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 39.71 1sk6 n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1sk6 n GLY 25 N 3.44 0.00 2.97 0.44 0.00 -1.26 -5.00 105.19 105.77 1sk6 n GLY 25 Ca 0.63 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.67 1sk6 n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sk6 s THR 26 N -0.07 -0.54 0.00 2.61 2.01 -1.26 -4.66 115.64 113.75 1sk6 s THR 26 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1sk6 s THR 26 Cb 0.00 -0.06 0.00 0.00 0.01 0.00 0.00 72.50 72.45 1sk6 s THR 26 CO 0.00 0.00 0.00 2.30 -0.69 0.00 0.00 174.62 176.23 1sk6 n ILE 27 N 4.12 0.00 -3.69 1.82 -5.35 -1.25 -4.53 119.36 110.48 1sk6 n ILE 27 Ca 0.08 0.00 -0.06 0.00 -0.27 0.00 0.00 62.75 62.50 1sk6 n ILE 27 Cb 0.60 0.00 -0.01 0.00 -1.74 0.00 0.00 39.64 38.49 1sk6 n ILE 27 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1sk6 n THR 28 N 0.00 0.00 1.34 7.28 -2.24 -1.26 -4.52 114.28 114.87 1sk6 n THR 28 Ca 0.00 -0.69 0.09 0.00 -2.27 0.00 0.00 64.05 61.18 1sk6 n THR 28 Cb 0.00 0.46 0.36 0.00 -2.10 0.00 0.00 70.33 69.04 1sk6 n THR 28 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1sk6 n THR 29 N -0.24 0.21 -0.15 4.28 -1.04 -1.26 -2.02 114.28 114.05 1sk6 n THR 29 Ca -0.01 -0.29 0.07 0.00 -2.04 0.00 0.00 64.05 61.78 1sk6 n THR 29 Cb 0.25 0.22 0.19 0.00 -1.82 0.00 0.00 70.33 69.17 1sk6 n THR 29 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1sk6 n LYS 30 N 0.13 2.67 -2.19 -2.82 5.02 -1.26 -4.54 118.16 115.17 1sk6 n LYS 30 Ca 0.14 -2.14 -0.02 0.00 -2.02 0.00 0.00 58.31 54.28 1sk6 n LYS 30 Cb 0.27 -1.34 0.05 0.00 -0.02 0.00 0.00 35.03 33.98 1sk6 n LYS 30 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1sk6 n GLU 31 N 0.82 0.54 -0.09 1.97 0.28 -1.17 -5.00 120.64 117.99 1sk6 n GLU 31 Ca 0.14 -0.67 -0.14 0.00 -0.16 0.00 0.00 57.16 56.34 1sk6 n GLU 31 Cb 0.47 0.12 -0.07 0.00 1.43 0.00 0.00 31.44 33.38 1sk6 n GLU 31 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 1sk6 h LEU 32 N 0.72 0.00 -1.92 -1.84 5.85 -1.64 -3.37 115.31 113.10 1sk6 h LEU 32 Ca -0.28 -0.33 0.08 0.00 0.84 0.00 0.00 57.88 58.19 1sk6 h LEU 32 Cb 1.17 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 1sk6 h LEU 32 CO -0.11 1.16 0.23 1.23 -0.34 0.00 0.00 178.44 180.61 1sk6 h GLY 33 N -1.00 0.12 0.92 3.75 0.00 -1.91 -0.04 103.07 104.91 1sk6 h GLY 33 Ca -0.19 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1sk6 h GLY 33 CO -0.11 0.03 0.46 -0.84 0.00 0.00 0.00 176.54 176.07 1sk6 h THR 34 N 0.09 0.00 0.01 4.70 2.02 -1.95 1.00 112.91 118.77 1sk6 h THR 34 Ca 0.15 0.00 -0.40 0.00 0.77 0.00 0.00 66.41 66.93 1sk6 h THR 34 Cb 0.50 0.33 -0.06 0.00 -1.74 0.00 0.00 68.15 67.19 1sk6 h THR 34 CO -0.01 0.00 -2.25 0.52 0.37 0.00 0.00 175.52 174.15 1sk6 n VAL 35 N -2.34 1.54 -0.31 3.16 0.31 -0.03 -3.82 118.33 116.83 1sk6 n VAL 35 Ca -0.01 -0.36 -0.05 0.00 -0.01 0.00 0.00 64.34 63.92 1sk6 n VAL 35 Cb 0.49 -1.84 0.08 0.00 -0.91 0.00 0.00 33.84 31.66 1sk6 n VAL 35 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1sk6 h MET 36 N -0.79 1.21 0.51 5.55 2.86 -0.34 -0.19 114.93 123.74 1sk6 h MET 36 Ca -0.60 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 56.85 1sk6 h MET 36 Cb 1.62 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 33.05 1sk6 h MET 36 CO -0.31 0.91 -0.33 0.00 1.06 0.00 0.00 176.91 178.25 1sk6 h ARG 37 N 1.20 -0.76 0.00 1.72 3.08 0.63 -0.64 114.38 119.61 1sk6 h ARG 37 Ca 0.30 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.40 1sk6 h ARG 37 Cb 0.08 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1sk6 h ARG 37 CO -0.04 -0.51 0.18 0.45 -1.07 0.00 0.00 179.97 178.98 1sk6 n SER 38 N -4.43 0.34 0.00 7.04 2.88 -1.13 -4.11 113.62 114.22 1sk6 n SER 38 Ca -0.10 0.58 0.00 0.00 -1.33 0.00 0.00 58.87 58.02 1sk6 n SER 38 Cb 0.33 -0.57 0.00 0.00 -0.75 0.00 0.00 64.21 63.22 1sk6 n SER 38 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1sk6 n LEU 39 N -1.98 0.00 0.00 2.46 7.94 -0.10 -5.07 117.00 120.25 1sk6 n LEU 39 Ca -0.01 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.89 1sk6 n LEU 39 Cb 0.20 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.15 1sk6 n LEU 39 CO 0.06 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 176.95 1sk6 n GLY 40 N 4.72 0.94 2.57 -3.96 0.00 -0.72 -5.05 105.19 103.69 1sk6 n GLY 40 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1sk6 n GLY 40 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1sk6 n GLN 41 N 0.00 0.00 -3.46 1.61 6.02 -1.26 -4.71 117.38 115.58 1sk6 n GLN 41 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.70 1sk6 n GLN 41 Cb 0.00 -0.83 -0.12 0.00 1.02 0.00 0.00 30.24 30.31 1sk6 n GLN 41 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1sk6 s ASN 42 N -0.83 2.88 0.65 1.08 0.01 -1.26 -4.26 114.94 113.21 1sk6 s ASN 42 Ca 0.38 -2.23 -0.02 0.00 -0.71 0.00 0.00 52.86 50.28 1sk6 s ASN 42 Cb -0.24 -0.40 0.07 0.00 0.41 0.00 0.00 41.25 41.09 1sk6 s ASN 42 CO 0.64 -0.30 0.92 -2.16 -1.51 0.00 0.00 177.10 174.69 1sk6 s PRO 43 N 1.02 2.14 0.45 -0.60 0.04 -1.26 -4.92 135.00 131.87 1sk6 s PRO 43 Ca 0.19 -0.71 0.05 0.00 0.04 0.00 0.00 61.00 60.57 1sk6 s PRO 43 Cb -0.22 -2.33 0.01 0.00 0.04 0.00 0.00 34.50 32.01 1sk6 s PRO 43 CO -0.00 -1.12 0.63 -0.08 0.04 0.00 0.00 177.00 176.46 1sk6 s THR 44 N -3.04 3.09 0.45 1.26 -1.32 -1.26 -4.96 115.64 109.86 1sk6 s THR 44 Ca 0.61 -0.87 0.29 0.00 -1.21 0.00 0.00 61.69 60.52 1sk6 s THR 44 Cb -0.09 -3.08 0.29 0.00 -1.51 0.00 0.00 72.50 68.12 1sk6 s THR 44 CO 0.42 -0.04 1.88 -0.33 -2.21 0.00 0.00 174.62 174.35 1sk6 h GLU 45 N 0.49 0.00 0.07 7.08 4.39 -1.99 0.10 114.58 124.71 1sk6 h GLU 45 Ca -0.42 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.02 1sk6 h GLU 45 Cb 1.28 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.92 1sk6 h GLU 45 CO 0.49 0.00 -1.28 0.00 -1.16 0.00 0.00 179.01 177.06 1sk6 h ALA 46 N 1.53 0.29 -0.37 3.43 0.00 -2.02 -3.20 119.26 118.93 1sk6 h ALA 46 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 54.91 53.90 1sk6 h ALA 46 Cb 0.43 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1sk6 h ALA 46 CO 0.00 1.17 0.00 0.39 0.00 0.00 0.00 179.25 180.81 1sk6 n GLU 47 N -3.40 2.21 -0.00 0.00 1.02 0.00 -3.79 120.64 116.67 1sk6 n GLU 47 Ca -0.08 -1.49 0.01 0.00 -0.02 0.00 0.00 57.16 55.57 1sk6 n GLU 47 Cb 1.00 -1.46 -0.01 0.00 -0.02 0.00 0.00 31.44 30.96 1sk6 n GLU 47 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1sk6 n LEU 48 N 0.58 0.04 0.03 -4.62 4.77 -1.10 -4.41 117.00 112.28 1sk6 n LEU 48 Ca 0.14 -0.30 -0.11 0.00 -0.03 0.00 0.00 56.01 55.70 1sk6 n LEU 48 Cb 0.44 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.39 1sk6 n LEU 48 CO 0.11 0.01 -0.28 1.56 -1.33 0.00 0.00 177.39 177.46 1sk6 h GLN 49 N 0.00 0.08 0.00 3.23 1.08 -1.65 -3.32 115.11 114.53 1sk6 h GLN 49 Ca 0.00 -0.14 -0.08 0.00 -1.45 0.00 0.00 58.65 56.98 1sk6 h GLN 49 Cb 0.05 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 1sk6 h GLN 49 CO 0.00 0.85 -1.84 -0.40 -0.95 0.00 0.00 178.83 176.49 1sk6 n ASP 50 N -3.27 0.23 0.05 1.46 5.68 -1.26 -3.36 116.55 116.07 1sk6 n ASP 50 Ca -0.12 0.09 -0.12 0.00 -0.50 0.00 0.00 54.79 54.14 1sk6 n ASP 50 Cb 1.02 1.40 -0.09 0.00 -1.14 0.00 0.00 41.12 42.31 1sk6 n ASP 50 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 1sk6 h MET 51 N 0.00 -0.16 -0.58 0.11 2.86 -1.77 -3.29 114.93 112.11 1sk6 h MET 51 Ca -0.10 0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 1sk6 h MET 51 Cb 1.26 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.93 1sk6 h MET 51 CO 0.01 0.29 0.19 0.97 1.06 0.00 0.00 176.91 179.43 1sk6 h ILE 52 N -0.69 1.24 -0.51 -1.22 6.09 -1.77 -3.34 117.51 117.31 1sk6 h ILE 52 Ca -0.02 -0.78 -0.57 0.00 -1.37 0.00 0.00 64.86 62.12 1sk6 h ILE 52 Cb 0.52 0.66 -0.05 0.00 0.47 0.00 0.00 36.82 38.42 1sk6 h ILE 52 CO 0.03 0.30 2.00 -3.20 -3.07 0.00 0.00 178.15 174.21 1sk6 n ASN 53 N -4.44 3.92 0.14 2.19 5.15 -1.21 -3.70 115.26 117.30 1sk6 n ASN 53 Ca 0.03 -2.81 0.00 0.00 -0.60 0.00 0.00 54.58 51.20 1sk6 n ASN 53 Cb 0.19 -1.66 0.00 0.00 -0.53 0.00 0.00 39.78 37.78 1sk6 n ASN 53 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1sk6 n GLU 54 N 7.86 0.00 0.06 1.20 2.13 -1.25 -4.84 120.64 125.79 1sk6 n GLU 54 Ca 0.48 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 58.24 1sk6 n GLU 54 Cb 0.44 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.12 1sk6 n GLU 54 CO 0.00 0.00 0.00 -0.24 -0.41 0.00 0.00 177.13 176.48 1sk6 h VAL 55 N 0.00 0.30 -3.44 6.31 3.04 -1.78 -3.42 116.25 117.25 1sk6 h VAL 55 Ca 0.00 -0.97 -0.65 0.00 -1.01 0.00 0.00 66.70 64.07 1sk6 h VAL 55 Cb 0.00 0.52 -0.41 0.00 -2.01 0.00 0.00 31.29 29.40 1sk6 h VAL 55 CO 0.00 0.09 -0.64 -0.62 -1.01 0.00 0.00 177.57 175.38 1sk6 s ASP 56 N -5.35 4.42 -0.51 3.17 -1.08 -1.26 -5.00 116.67 111.06 1sk6 s ASP 56 Ca -0.07 -2.84 0.05 0.00 -0.52 0.00 0.00 52.55 49.17 1sk6 s ASP 56 Cb 0.00 -1.64 0.19 0.00 -1.46 0.00 0.00 42.92 40.01 1sk6 s ASP 56 CO 0.23 -0.26 0.44 0.00 0.52 0.00 0.00 175.17 176.10 1sk6 n ALA 57 N 3.34 3.05 -1.55 3.66 0.00 -1.26 -4.40 120.51 123.35 1sk6 n ALA 57 Ca 0.05 -3.67 0.00 0.00 0.00 0.00 0.00 53.44 49.82 1sk6 n ALA 57 Cb 0.34 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1sk6 n ALA 57 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1sk6 n ASP 58 N 2.23 0.00 0.00 0.00 9.92 -1.26 -4.97 116.55 122.48 1sk6 n ASP 58 Ca 0.26 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.52 1sk6 n ASP 58 Cb 0.45 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.93 1sk6 n ASP 58 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1sk6 n GLY 59 N 3.23 0.00 0.66 0.44 0.00 -1.26 -4.81 105.19 103.45 1sk6 n GLY 59 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1sk6 n GLY 59 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sk6 n ASN 60 N -2.89 3.32 -3.13 1.61 4.13 -1.26 -5.03 115.26 112.00 1sk6 n ASN 60 Ca 0.00 -2.72 -0.19 0.00 1.68 0.00 0.00 54.58 53.35 1sk6 n ASN 60 Cb 0.44 -0.42 0.02 0.00 -1.54 0.00 0.00 39.78 38.29 1sk6 n ASN 60 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1sk6 n GLY 61 N -0.40 -0.92 3.70 7.41 0.00 -1.26 -4.84 105.19 108.88 1sk6 n GLY 61 Ca 0.17 1.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.77 1sk6 n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sk6 s THR 62 N -1.87 3.10 -0.19 2.61 -4.23 -1.26 -4.80 115.64 109.00 1sk6 s THR 62 Ca 0.25 0.67 -0.00 0.00 -1.18 0.00 0.00 61.69 61.43 1sk6 s THR 62 Cb -0.04 -3.43 0.01 0.00 1.34 0.00 0.00 72.50 70.37 1sk6 s THR 62 CO 0.73 0.02 -0.15 -0.63 -0.54 0.00 0.00 174.62 174.05 1sk6 s ILE 63 N 1.88 2.50 0.00 2.99 1.01 -1.26 -4.89 121.20 123.43 1sk6 s ILE 63 Ca 0.69 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 60.55 1sk6 s ILE 63 Cb -0.39 -2.08 0.00 0.00 0.01 0.00 0.00 42.46 40.00 1sk6 s ILE 63 CO 0.31 0.50 0.00 0.47 0.00 0.00 0.00 174.94 176.22 1sk6 n ASP 64 N 4.61 0.00 -0.05 3.58 9.92 -1.26 -3.90 116.55 129.45 1sk6 n ASP 64 Ca -0.20 0.00 -0.05 0.00 -0.53 0.00 0.00 54.79 54.01 1sk6 n ASP 64 Cb 0.50 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.97 1sk6 n ASP 64 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1sk6 n PHE 65 N 0.00 0.00 0.00 1.24 3.01 -1.26 -4.13 117.46 116.32 1sk6 n PHE 65 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1sk6 n PHE 65 Cb 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.19 1sk6 n PHE 65 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 1sk6 n PRO 66 N -3.69 0.00 0.00 -1.08 -0.02 -1.26 -1.91 135.00 127.04 1sk6 n PRO 66 Ca -0.08 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 1sk6 n PRO 66 Cb 0.30 -1.54 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 1sk6 n PRO 66 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1sk6 n GLU 67 N -1.03 0.00 -0.23 -0.52 1.02 -1.26 -4.20 120.64 114.42 1sk6 n GLU 67 Ca 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.13 1sk6 n GLU 67 Cb 0.04 -0.10 0.05 0.00 -0.02 0.00 0.00 31.44 31.41 1sk6 n GLU 67 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1sk6 h PHE 68 N 0.00 -0.60 0.00 -0.32 3.57 -1.70 1.46 116.94 119.34 1sk6 h PHE 68 Ca 0.00 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1sk6 h PHE 68 Cb 0.00 0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.11 1sk6 h PHE 68 CO 0.00 -0.34 0.20 1.28 -2.23 0.00 0.00 178.31 177.22 1sk6 n LEU 69 N -5.46 0.02 -0.07 0.59 4.77 -0.81 -0.46 117.00 115.59 1sk6 n LEU 69 Ca 0.07 0.32 -0.09 0.00 -0.03 0.00 0.00 56.01 56.29 1sk6 n LEU 69 Cb 0.36 -0.32 -0.09 0.00 -2.33 0.00 0.00 43.42 41.04 1sk6 n LEU 69 CO 0.01 -0.33 -0.99 0.41 -1.33 0.00 0.00 177.39 175.15 1sk6 n THR 70 N -1.35 0.93 -0.14 -5.08 -1.04 0.49 -4.47 114.28 103.61 1sk6 n THR 70 Ca -0.00 -0.45 -0.06 0.00 -2.04 0.00 0.00 64.05 61.50 1sk6 n THR 70 Cb 0.20 -0.89 0.03 0.00 -1.82 0.00 0.00 70.33 67.85 1sk6 n THR 70 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 1sk6 h MET 71 N 0.00 0.43 0.00 -2.82 2.86 0.61 -1.42 114.93 114.59 1sk6 h MET 71 Ca -0.36 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.24 1sk6 h MET 71 Cb 1.68 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 33.24 1sk6 h MET 71 CO -0.02 0.29 -0.04 0.52 1.06 0.00 0.00 176.91 178.71 1sk6 h MET 72 N 0.45 0.00 0.00 1.72 2.86 -1.76 -2.85 114.93 115.34 1sk6 h MET 72 Ca 0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1sk6 h MET 72 Cb 0.09 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1sk6 h MET 72 CO -0.13 0.04 0.02 0.00 1.06 0.00 0.00 176.91 177.90 1sk6 n ALA 73 N -2.30 1.16 0.00 6.32 0.00 -0.54 0.40 120.51 125.56 1sk6 n ALA 73 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1sk6 n ALA 73 Cb 0.13 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.73 1sk6 n ALA 73 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1sk6 n ARG 74 N -1.07 1.82 -0.02 0.00 3.00 -1.08 -4.65 116.66 114.66 1sk6 n ARG 74 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.85 57.64 1sk6 n ARG 74 Cb 0.02 -0.66 -0.13 0.00 0.00 0.00 0.00 32.46 31.68 1sk6 n ARG 74 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 1sk6 h LYS 75 N 0.00 0.18 -1.64 -0.14 3.11 -1.45 -3.34 116.57 113.28 1sk6 h LYS 75 Ca 0.00 -0.30 -0.54 0.00 -2.81 0.00 0.00 60.65 57.00 1sk6 h LYS 75 Cb 0.27 0.11 -0.21 0.00 -1.00 0.00 0.00 32.23 31.40 1sk6 h LYS 75 CO 0.00 1.15 0.63 -0.12 -2.81 0.00 0.00 179.45 178.29 1sk6 n MET 76 N -4.04 2.35 0.02 1.90 1.56 0.16 -4.22 117.12 114.86 1sk6 n MET 76 Ca -0.26 -2.54 -0.01 0.00 -0.27 0.00 0.00 57.70 54.63 1sk6 n MET 76 Cb 0.84 -2.04 -0.00 0.00 2.15 0.00 0.00 33.22 34.16 1sk6 n MET 76 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 175.97 176.41 1sk6 n LYS 77 N 0.07 0.03 0.18 2.12 3.00 -1.24 -4.56 118.16 117.76 1sk6 n LYS 77 Ca 0.47 0.01 0.02 0.00 -0.00 0.00 0.00 58.31 58.82 1sk6 n LYS 77 Cb 0.53 -0.36 0.34 0.00 0.00 0.00 0.00 35.03 35.54 1sk6 n LYS 77 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 1sk6 h ASP 78 N -0.06 0.00 -0.61 3.14 1.82 -1.76 -2.18 116.42 116.76 1sk6 h ASP 78 Ca 0.00 0.00 -0.36 0.00 -0.39 0.00 0.00 57.03 56.28 1sk6 h ASP 78 Cb 0.06 0.00 -0.18 0.00 0.68 0.00 0.00 39.33 39.89 1sk6 h ASP 78 CO 0.00 0.39 0.46 1.07 -1.61 0.00 0.00 179.24 179.56 1sk6 n THR 79 N -4.05 2.65 0.39 2.25 5.66 -1.26 -4.59 114.28 115.33 1sk6 n THR 79 Ca -0.02 -1.54 0.00 0.00 -3.05 0.00 0.00 64.05 59.44 1sk6 n THR 79 Cb 0.43 -0.96 0.00 0.00 -1.55 0.00 0.00 70.33 68.25 1sk6 n THR 79 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1sk6 n ASP 80 N -0.26 0.95 0.00 1.09 -0.08 -0.82 -4.60 116.55 112.82 1sk6 n ASP 80 Ca 0.37 -0.78 0.00 0.00 -1.51 0.00 0.00 54.79 52.88 1sk6 n ASP 80 Cb 0.93 -0.19 0.00 0.00 2.34 0.00 0.00 41.12 44.20 1sk6 n ASP 80 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1sk6 n SER 81 N 0.67 0.00 0.00 1.67 7.64 -1.26 -4.57 113.62 117.77 1sk6 n SER 81 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1sk6 n SER 81 Cb 0.17 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 1sk6 n SER 81 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1sk6 n GLU 82 N 0.00 0.00 -0.11 1.43 2.13 -1.26 -3.85 120.64 118.97 1sk6 n GLU 82 Ca 0.00 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.57 1sk6 n GLU 82 Cb 0.00 -0.17 -0.11 0.00 0.27 0.00 0.00 31.44 31.43 1sk6 n GLU 82 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1sk6 n GLU 83 N 0.00 0.58 0.07 5.31 -0.58 -1.26 -1.93 120.64 122.83 1sk6 n GLU 83 Ca 0.00 0.45 0.04 0.00 -0.42 0.00 0.00 57.16 57.23 1sk6 n GLU 83 Cb 0.00 -1.65 0.22 0.00 -0.57 0.00 0.00 31.44 29.44 1sk6 n GLU 83 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1sk6 n GLU 84 N -4.31 0.05 -0.07 3.49 1.02 -1.25 -2.84 120.64 116.74 1sk6 n GLU 84 Ca -0.40 0.50 -0.12 0.00 -0.02 0.00 0.00 57.16 57.12 1sk6 n GLU 84 Cb 0.77 -1.78 -0.04 0.00 -0.02 0.00 0.00 31.44 30.37 1sk6 n GLU 84 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1sk6 n ILE 85 N -1.76 1.26 0.09 -3.67 5.41 -1.25 -4.31 119.36 115.14 1sk6 n ILE 85 Ca -0.01 0.03 0.02 0.00 1.00 0.00 0.00 62.75 63.79 1sk6 n ILE 85 Cb 0.12 -1.96 0.12 0.00 -0.71 0.00 0.00 39.64 37.20 1sk6 n ILE 85 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1sk6 n ARG 86 N -4.03 0.03 -0.03 0.38 0.63 -0.82 0.27 116.66 113.11 1sk6 n ARG 86 Ca -0.21 0.37 0.03 0.00 -0.92 0.00 0.00 57.85 57.13 1sk6 n ARG 86 Cb 0.52 -2.01 -0.15 0.00 0.45 0.00 0.00 32.46 31.28 1sk6 n ARG 86 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1sk6 n GLU 87 N -1.60 0.66 -0.18 -0.14 1.02 -1.17 -3.59 120.64 115.65 1sk6 n GLU 87 Ca -0.00 -0.07 -0.10 0.00 -0.02 0.00 0.00 57.16 56.97 1sk6 n GLU 87 Cb 0.41 -1.57 0.01 0.00 -0.02 0.00 0.00 31.44 30.26 1sk6 n GLU 87 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sk6 h ALA 88 N 1.61 0.71 0.52 0.62 0.00 0.37 -2.88 119.26 120.21 1sk6 h ALA 88 Ca -0.19 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1sk6 h ALA 88 Cb 1.47 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1sk6 h ALA 88 CO 0.02 0.57 -0.51 0.35 0.00 0.00 0.00 179.25 179.68 1sk6 h PHE 89 N 0.83 -1.41 0.00 0.00 3.57 -1.47 -1.22 116.94 117.24 1sk6 h PHE 89 Ca 0.14 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.65 1sk6 h PHE 89 Cb 0.59 0.55 0.00 0.00 2.79 0.00 0.00 35.95 39.88 1sk6 h PHE 89 CO 0.04 -0.68 0.42 0.00 -2.23 0.00 0.00 178.31 175.87 1sk6 h ARG 90 N -1.02 0.00 0.01 1.11 3.08 -1.59 -0.47 114.38 115.50 1sk6 h ARG 90 Ca -0.06 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 1sk6 h ARG 90 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.93 1sk6 h ARG 90 CO -0.06 0.00 -0.00 0.28 -1.07 0.00 0.00 179.97 179.12 1sk6 h VAL 91 N 0.00 1.62 0.00 2.04 2.07 -1.01 -3.29 116.25 117.68 1sk6 h VAL 91 Ca 0.00 -2.07 -0.04 0.00 0.82 0.00 0.00 66.70 65.40 1sk6 h VAL 91 Cb 0.84 2.99 -0.01 0.00 -1.52 0.00 0.00 31.29 33.60 1sk6 h VAL 91 CO 0.00 0.52 -0.20 -0.26 0.02 0.00 0.00 177.57 177.66 1sk6 h PHE 92 N -0.93 0.00 -0.81 1.57 -1.00 -0.92 -3.30 116.94 111.55 1sk6 h PHE 92 Ca -0.00 0.00 -0.62 0.00 2.81 0.00 0.00 57.97 60.16 1sk6 h PHE 92 Cb 0.86 0.00 -0.10 0.00 3.61 0.00 0.00 35.95 40.32 1sk6 h PHE 92 CO 0.23 0.20 1.90 -3.47 -1.61 0.00 0.00 178.31 175.56 1sk6 n ASP 93 N -3.96 7.52 0.16 2.17 2.03 -0.66 -4.63 116.55 119.18 1sk6 n ASP 93 Ca -0.02 -2.99 0.11 0.00 0.52 0.00 0.00 54.79 52.41 1sk6 n ASP 93 Cb 0.28 -1.37 0.57 0.00 -0.72 0.00 0.00 41.12 39.88 1sk6 n ASP 93 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1sk6 n LYS 94 N 1.92 0.14 0.06 -0.67 2.85 -1.25 -2.20 118.16 119.02 1sk6 n LYS 94 Ca 0.60 0.61 -0.21 0.00 -1.05 0.00 0.00 58.31 58.27 1sk6 n LYS 94 Cb 0.38 -1.94 -0.12 0.00 -0.65 0.00 0.00 35.03 32.70 1sk6 n LYS 94 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 177.40 177.73 1sk6 h ASP 95 N 0.00 0.81 0.00 -5.58 3.04 -1.94 -3.48 116.42 109.28 1sk6 h ASP 95 Ca 0.00 -0.79 0.00 0.00 -3.24 0.00 0.00 57.03 53.00 1sk6 h ASP 95 Cb 0.04 -0.25 0.00 0.00 -1.04 0.00 0.00 39.33 38.08 1sk6 h ASP 95 CO 0.00 1.51 0.00 0.61 -2.04 0.00 0.00 179.24 179.32 1sk6 n GLY 96 N 1.25 0.78 0.30 7.15 0.00 -0.93 -4.95 105.19 108.78 1sk6 n GLY 96 Ca -0.12 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.10 1sk6 n GLY 96 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1sk6 h ASN 97 N 0.00 0.00 0.00 1.61 7.08 -1.93 -3.45 115.58 118.89 1sk6 h ASN 97 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1sk6 h ASN 97 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 1sk6 h ASN 97 CO 0.00 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.96 1sk6 n GLY 98 N -0.58 3.45 3.28 9.14 0.00 -1.26 -5.04 105.19 114.18 1sk6 n GLY 98 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 1sk6 n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1sk6 s TYR 99 N -2.98 1.89 0.05 1.61 1.51 -1.26 -4.08 117.35 114.10 1sk6 s TYR 99 Ca 0.00 -0.39 -0.29 0.00 -1.01 0.00 0.00 57.07 55.38 1sk6 s TYR 99 Cb 0.00 -1.09 -0.05 0.00 -0.11 0.00 0.00 41.96 40.72 1sk6 s TYR 99 CO 0.00 0.15 0.91 0.42 -1.11 0.00 0.00 175.55 175.93 1sk6 s ILE 100 N -0.94 4.69 0.20 2.71 1.01 0.47 -4.89 121.20 124.45 1sk6 s ILE 100 Ca 0.08 1.95 0.10 0.00 0.00 0.00 0.00 60.65 62.78 1sk6 s ILE 100 Cb -0.09 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 1sk6 s ILE 100 CO 0.03 0.27 -0.14 -0.94 0.00 0.00 0.00 174.94 174.16 1sk6 s SER 101 N 0.35 3.95 0.09 3.58 1.04 -1.26 -1.81 113.70 119.64 1sk6 s SER 101 Ca 0.46 -0.72 -0.17 0.00 0.48 0.00 0.00 55.95 56.00 1sk6 s SER 101 Cb -0.22 -0.54 -0.04 0.00 0.10 0.00 0.00 66.02 65.32 1sk6 s SER 101 CO 0.27 0.09 1.05 0.00 0.98 0.00 0.00 173.24 175.64 1sk6 n ALA 102 N -0.05 -0.36 -0.01 5.32 0.00 -1.26 0.69 120.51 124.85 1sk6 n ALA 102 Ca -0.10 0.48 -0.12 0.00 0.00 0.00 0.00 53.44 53.69 1sk6 n ALA 102 Cb 0.56 0.02 -0.06 0.00 0.00 0.00 0.00 19.45 19.97 1sk6 n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sk6 h ALA 103 N 0.09 -0.58 -1.00 0.00 0.00 -1.96 -1.06 119.26 114.76 1sk6 h ALA 103 Ca 0.09 -0.01 0.41 0.00 0.00 0.00 0.00 54.91 55.41 1sk6 h ALA 103 Cb 0.23 0.79 -0.18 0.00 0.00 0.00 0.00 17.79 18.63 1sk6 h ALA 103 CO -0.53 -0.92 0.54 0.39 0.00 0.00 0.00 179.25 178.73 1sk6 n GLU 104 N -5.43 -0.06 0.08 0.00 1.02 0.22 0.11 120.64 116.58 1sk6 n GLU 104 Ca -0.04 1.35 -0.10 0.00 -0.02 0.00 0.00 57.16 58.35 1sk6 n GLU 104 Cb 0.36 -2.44 -0.08 0.00 -0.02 0.00 0.00 31.44 29.27 1sk6 n GLU 104 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1sk6 h LEU 105 N 0.00 0.23 0.21 -4.62 6.46 -0.25 -3.19 115.31 114.16 1sk6 h LEU 105 Ca 0.84 -0.22 -0.01 0.00 -0.12 0.00 0.00 57.88 58.37 1sk6 h LEU 105 Cb 2.23 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 42.09 1sk6 h LEU 105 CO -0.75 1.10 -0.10 -0.09 -0.62 0.00 0.00 178.44 177.98 1sk6 h ARG 106 N 0.07 -0.27 -0.79 1.25 2.43 0.13 -1.44 114.38 115.75 1sk6 h ARG 106 Ca -0.06 0.02 0.28 0.00 -0.81 0.00 0.00 59.98 59.41 1sk6 h ARG 106 Cb 1.71 0.06 -0.14 0.00 -0.42 0.00 0.00 29.97 31.18 1sk6 h ARG 106 CO 0.15 -0.18 0.25 0.72 -1.51 0.00 0.00 179.97 179.40 1sk6 n HIS 107 N -2.87 0.74 0.01 2.20 8.25 -0.58 0.13 115.22 123.09 1sk6 n HIS 107 Ca -0.04 0.94 -0.18 0.00 -0.26 0.00 0.00 57.72 58.19 1sk6 n HIS 107 Cb 0.11 -1.24 -0.07 0.00 1.12 0.00 0.00 29.99 29.91 1sk6 n HIS 107 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1sk6 h VAL 108 N 0.00 1.29 -0.11 1.59 2.07 -1.52 -3.27 116.25 116.30 1sk6 h VAL 108 Ca 0.59 -2.08 -0.07 0.00 0.82 0.00 0.00 66.70 65.95 1sk6 h VAL 108 Cb 1.44 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 1sk6 h VAL 108 CO -0.66 0.65 -0.21 0.24 0.02 0.00 0.00 177.57 177.61 1sk6 h MET 109 N 0.47 0.33 0.00 1.57 2.07 0.22 -2.44 114.93 117.15 1sk6 h MET 109 Ca -0.08 -0.21 0.00 0.00 -2.07 0.00 0.00 59.70 57.34 1sk6 h MET 109 Cb 1.50 0.03 0.00 0.00 -1.87 0.00 0.00 31.60 31.25 1sk6 h MET 109 CO 0.17 0.80 0.00 0.25 1.07 0.00 0.00 176.91 179.21 1sk6 n THR 110 N -4.52 0.97 -0.05 2.22 -2.24 1.00 -1.53 114.28 110.13 1sk6 n THR 110 Ca -0.07 0.24 -0.05 0.00 -2.27 0.00 0.00 64.05 61.90 1sk6 n THR 110 Cb 0.42 -1.22 -0.09 0.00 -2.10 0.00 0.00 70.33 67.34 1sk6 n THR 110 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1sk6 n ASN 111 N -1.25 2.32 0.00 3.42 3.02 -1.12 -4.20 115.26 117.44 1sk6 n ASN 111 Ca 0.01 -0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.63 1sk6 n ASN 111 Cb 0.01 0.75 0.37 0.00 -0.61 0.00 0.00 39.78 40.30 1sk6 n ASN 111 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1sk6 n LEU 112 N -2.41 0.00 0.00 3.41 4.77 -0.58 -4.82 117.00 117.37 1sk6 n LEU 112 Ca -0.18 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1sk6 n LEU 112 Cb 0.85 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1sk6 n LEU 112 CO 0.23 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.77 1sk6 n GLY 113 N -0.07 1.68 3.29 -0.72 0.00 -1.10 -5.08 105.19 103.19 1sk6 n GLY 113 Ca 0.07 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 1sk6 n GLY 113 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1sk6 s GLU 114 N -0.32 2.81 -0.45 1.61 2.56 -1.05 -4.99 118.70 118.87 1sk6 s GLU 114 Ca 0.00 -1.65 -0.27 0.00 0.00 0.00 0.00 54.97 53.06 1sk6 s GLU 114 Cb 0.00 -4.12 -0.06 0.00 2.00 0.00 0.00 34.13 31.95 1sk6 s GLU 114 CO 0.00 -1.21 2.26 0.15 -0.56 0.00 0.00 175.26 175.90 1sk6 s LYS 115 N 1.52 2.43 0.06 4.30 -0.14 -1.26 -3.78 119.74 122.88 1sk6 s LYS 115 Ca 0.04 1.42 -0.23 0.00 -1.36 0.00 0.00 55.97 55.84 1sk6 s LYS 115 Cb -0.27 -4.50 -0.06 0.00 -1.68 0.00 0.00 37.83 31.32 1sk6 s LYS 115 CO 0.02 -2.91 0.69 -0.51 -0.76 0.00 0.00 175.35 171.89 1sk6 s LEU 116 N 10.75 4.48 0.27 3.17 1.43 -1.26 -5.04 118.68 132.49 1sk6 s LEU 116 Ca 0.93 1.38 -0.30 0.00 -1.03 0.00 0.00 54.13 55.12 1sk6 s LEU 116 Cb -0.20 -3.11 -0.10 0.00 0.03 0.00 0.00 46.19 42.82 1sk6 s LEU 116 CO 0.27 0.12 1.36 0.42 0.23 0.00 0.00 176.35 178.75 1sk6 s THR 117 N -0.50 2.80 -0.96 5.49 -4.23 -1.26 -4.84 115.64 112.14 1sk6 s THR 117 Ca 0.34 0.72 0.00 0.00 -1.18 0.00 0.00 61.69 61.57 1sk6 s THR 117 Cb -0.20 -3.46 0.00 0.00 1.34 0.00 0.00 72.50 70.18 1sk6 s THR 117 CO 0.21 0.14 0.69 0.47 -0.54 0.00 0.00 174.62 175.59 1sk6 n ASP 118 N 1.78 0.00 -0.07 3.99 10.43 -1.26 -1.39 116.55 130.03 1sk6 n ASP 118 Ca 0.04 0.24 -0.06 0.00 2.57 0.00 0.00 54.79 57.58 1sk6 n ASP 118 Cb 0.41 -0.24 -0.02 0.00 1.84 0.00 0.00 41.12 43.11 1sk6 n ASP 118 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 1sk6 h GLU 119 N 0.00 0.00 -0.04 -1.24 4.39 -1.99 -3.36 114.58 112.33 1sk6 h GLU 119 Ca 0.00 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.73 1sk6 h GLU 119 Cb 0.19 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.78 1sk6 h GLU 119 CO 0.00 0.11 -0.47 0.93 -1.16 0.00 0.00 179.01 178.42 1sk6 h GLU 120 N -1.00 -0.57 -0.95 2.33 5.08 -1.60 -1.54 114.58 116.33 1sk6 h GLU 120 Ca -0.04 0.04 0.18 0.00 -1.00 0.00 0.00 59.36 58.55 1sk6 h GLU 120 Cb 0.53 0.13 -0.18 0.00 0.50 0.00 0.00 28.75 29.74 1sk6 h GLU 120 CO -0.02 -0.38 -0.27 0.28 -1.00 0.00 0.00 179.01 177.62 1sk6 n VAL 121 N -5.45 -0.42 0.43 3.13 0.31 -1.10 0.36 118.33 115.60 1sk6 n VAL 121 Ca -0.06 2.19 0.06 0.00 -0.01 0.00 0.00 64.34 66.53 1sk6 n VAL 121 Cb 0.38 -3.01 0.28 0.00 -0.91 0.00 0.00 33.84 30.58 1sk6 n VAL 121 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1sk6 n ASP 122 N -5.52 0.02 -0.07 4.52 8.00 -0.63 -1.88 116.55 120.99 1sk6 n ASP 122 Ca 0.14 0.51 -0.11 0.00 0.71 0.00 0.00 54.79 56.04 1sk6 n ASP 122 Cb 0.46 -0.51 -0.15 0.00 -0.02 0.00 0.00 41.12 40.90 1sk6 n ASP 122 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1sk6 n GLU 123 N -1.53 0.67 0.16 -1.24 0.00 1.15 -3.41 120.64 116.44 1sk6 n GLU 123 Ca 0.03 0.13 0.02 0.00 0.00 0.00 0.00 57.16 57.34 1sk6 n GLU 123 Cb 0.15 -1.63 0.23 0.00 0.00 0.00 0.00 31.44 30.19 1sk6 n GLU 123 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 1sk6 h MET 124 N 0.01 0.00 -0.02 5.31 2.86 -0.19 -1.73 114.93 121.17 1sk6 h MET 124 Ca -0.45 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.16 1sk6 h MET 124 Cb 2.12 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.78 1sk6 h MET 124 CO 0.04 0.51 -0.11 0.82 1.06 0.00 0.00 176.91 179.23 1sk6 h ILE 125 N 0.00 1.51 -0.02 -1.22 1.08 -1.53 -2.55 117.51 114.79 1sk6 h ILE 125 Ca -0.01 -1.68 0.00 0.00 -0.39 0.00 0.00 64.86 62.79 1sk6 h ILE 125 Cb 1.04 2.57 -0.00 0.00 -3.07 0.00 0.00 36.82 37.36 1sk6 h ILE 125 CO 0.07 0.45 0.01 0.03 -0.69 0.00 0.00 178.15 178.02 1sk6 h ARG 126 N -0.53 0.03 -0.19 2.37 3.08 -1.56 0.31 114.38 117.89 1sk6 h ARG 126 Ca -0.01 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1sk6 h ARG 126 Cb 0.80 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1sk6 h ARG 126 CO 0.02 0.04 0.11 0.93 -1.07 0.00 0.00 179.97 180.00 1sk6 h GLU 127 N 0.01 0.26 0.00 0.04 4.39 -1.43 -2.18 114.58 115.66 1sk6 h GLU 127 Ca 0.01 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 1sk6 h GLU 127 Cb 0.02 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1sk6 h GLU 127 CO -0.00 0.23 -0.15 0.00 -1.16 0.00 0.00 179.01 177.93 1sk6 h ALA 128 N 1.02 1.57 -2.79 3.43 0.00 -1.32 -3.42 119.26 117.74 1sk6 h ALA 128 Ca 0.07 -0.13 -0.52 0.00 0.00 0.00 0.00 54.91 54.33 1sk6 h ALA 128 Cb 0.04 -0.02 0.08 0.00 0.00 0.00 0.00 17.79 17.88 1sk6 h ALA 128 CO -0.01 0.18 0.54 0.34 0.00 0.00 0.00 179.25 180.30 1sk6 s ASP 129 N -6.69 6.15 0.07 0.00 -1.08 0.11 -4.85 116.67 110.38 1sk6 s ASP 129 Ca -0.04 2.46 0.00 0.00 -0.52 0.00 0.00 52.55 54.46 1sk6 s ASP 129 Cb 0.15 -2.62 0.00 0.00 -1.46 0.00 0.00 42.92 38.99 1sk6 s ASP 129 CO 0.65 -0.94 0.00 -0.38 0.52 0.00 0.00 175.17 175.02 1sk6 n ILE 130 N -0.29 0.59 0.54 4.11 5.41 -1.26 -4.69 119.36 123.76 1sk6 n ILE 130 Ca 0.06 0.19 0.09 0.00 1.00 0.00 0.00 62.75 64.10 1sk6 n ILE 130 Cb 0.46 -1.42 0.39 0.00 -0.71 0.00 0.00 39.64 38.37 1sk6 n ILE 130 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1sk6 n ASP 131 N -3.24 0.20 -1.74 4.38 5.75 -1.26 -4.90 116.55 115.74 1sk6 n ASP 131 Ca 0.00 0.54 -0.12 0.00 -0.01 0.00 0.00 54.79 55.20 1sk6 n ASP 131 Cb 0.20 -0.59 0.02 0.00 -1.03 0.00 0.00 41.12 39.72 1sk6 n ASP 131 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1sk6 n GLY 132 N 0.23 0.05 0.03 6.12 0.00 -1.26 -4.93 105.19 105.42 1sk6 n GLY 132 Ca 0.04 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.89 1sk6 n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1sk6 n ASP 133 N -0.54 0.35 0.00 1.61 5.68 -1.26 -4.91 116.55 117.49 1sk6 n ASP 133 Ca -0.06 -0.07 0.00 0.00 -0.50 0.00 0.00 54.79 54.16 1sk6 n ASP 133 Cb 0.56 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.49 1sk6 n ASP 133 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1sk6 n GLY 134 N 1.46 0.52 3.33 6.12 0.00 -1.26 -5.06 105.19 110.30 1sk6 n GLY 134 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 1sk6 n GLY 134 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1sk6 s GLN 135 N -0.83 0.89 -0.21 1.61 -2.07 -1.26 -4.70 119.66 113.09 1sk6 s GLN 135 Ca 0.00 -0.28 -0.19 0.00 -1.82 0.00 0.00 55.36 53.07 1sk6 s GLN 135 Cb 0.00 0.40 -0.03 0.00 -1.09 0.00 0.00 33.01 32.29 1sk6 s GLN 135 CO 0.00 -0.29 0.56 0.08 -1.32 0.00 0.00 175.29 174.32 1sk6 s VAL 136 N -2.16 5.07 0.45 3.63 1.01 -0.75 -4.87 120.40 122.78 1sk6 s VAL 136 Ca -0.07 1.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.93 1sk6 s VAL 136 Cb -0.02 -3.88 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1sk6 s VAL 136 CO -0.00 0.14 0.70 0.54 0.00 0.00 0.00 175.10 176.47 1sk6 s ASN 137 N 1.22 5.98 0.14 3.32 2.20 -1.26 -0.39 114.94 126.14 1sk6 s ASN 137 Ca 0.26 0.49 -0.30 0.00 -0.94 0.00 0.00 52.86 52.37 1sk6 s ASN 137 Cb -0.16 -1.79 -0.08 0.00 -2.00 0.00 0.00 41.25 37.22 1sk6 s ASN 137 CO 0.10 -0.64 1.51 0.22 -2.94 0.00 0.00 177.10 175.35 1sk6 h TYR 138 N 0.37 -1.69 -0.97 1.54 3.20 -1.99 0.11 116.97 117.54 1sk6 h TYR 138 Ca -0.47 0.10 0.27 0.00 3.14 0.00 0.00 58.73 61.77 1sk6 h TYR 138 Cb 1.24 0.83 -0.18 0.00 1.54 0.00 0.00 36.73 40.16 1sk6 h TYR 138 CO 0.49 -0.40 0.06 0.93 -1.64 0.00 0.00 178.16 177.60 1sk6 h GLU 139 N -0.19 0.03 -0.71 1.82 3.07 -1.96 0.59 114.58 117.23 1sk6 h GLU 139 Ca 0.11 -0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.91 1sk6 h GLU 139 Cb 0.47 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.34 1sk6 h GLU 139 CO -0.72 0.02 0.23 0.93 -1.40 0.00 0.00 179.01 178.07 1sk6 h GLU 140 N 0.03 1.10 -0.04 2.33 5.08 -1.37 -1.56 114.58 120.15 1sk6 h GLU 140 Ca 0.60 -0.23 -0.04 0.00 -1.00 0.00 0.00 59.36 58.68 1sk6 h GLU 140 Cb 1.24 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1sk6 h GLU 140 CO -0.88 0.94 -0.16 0.35 -1.00 0.00 0.00 179.01 178.26 1sk6 h PHE 141 N 1.04 0.06 0.29 4.33 3.57 0.81 0.40 116.94 127.44 1sk6 h PHE 141 Ca 0.23 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.71 1sk6 h PHE 141 Cb 0.29 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1sk6 h PHE 141 CO 0.02 0.22 -0.14 0.28 -2.23 0.00 0.00 178.31 176.46 1sk6 h VAL 142 N 0.05 0.00 -0.57 1.41 2.07 -0.34 -2.57 116.25 116.31 1sk6 h VAL 142 Ca 0.01 -0.16 0.06 0.00 0.82 0.00 0.00 66.70 67.42 1sk6 h VAL 142 Cb 0.32 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.00 1sk6 h VAL 142 CO 0.02 0.00 -0.54 1.56 0.02 0.00 0.00 177.57 178.63 1sk6 h GLN 143 N -0.55 -0.25 -0.03 1.57 1.08 -1.03 0.92 115.11 116.83 1sk6 h GLN 143 Ca -0.04 0.02 0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1sk6 h GLN 143 Cb 0.29 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.78 1sk6 h GLN 143 CO 0.06 -0.16 0.51 1.98 -0.95 0.00 0.00 178.83 180.27 1sk6 h MET 144 N -0.26 0.00 -0.16 1.46 4.05 -0.28 -0.06 114.93 119.69 1sk6 h MET 144 Ca 0.10 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.52 1sk6 h MET 144 Cb 0.51 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.31 1sk6 h MET 144 CO -0.67 0.00 0.00 -0.12 0.23 0.00 0.00 176.91 176.35 1sk6 n MET 145 N -2.82 2.40 0.05 0.39 0.00 0.32 -4.83 117.12 112.63 1sk6 n MET 145 Ca -0.01 -2.07 0.00 0.00 -0.00 0.00 0.00 57.70 55.62 1sk6 n MET 145 Cb 0.56 -1.48 0.00 0.00 0.00 0.00 0.00 33.22 32.29 1sk6 n MET 145 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1sk6 n THR 146 N 1.41 0.03 0.00 1.12 -2.24 -0.05 -5.06 114.28 109.49 1sk6 n THR 146 Ca 0.16 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.95 1sk6 n THR 146 Cb 0.61 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 1sk6 n THR 146 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50