#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x17 s LEU 2 N 0.00 3.96 0.54 3.17 1.43 -1.26 -5.07 118.68 121.46 2x17 s LEU 2 Ca 0.00 1.39 -0.16 0.00 -1.03 0.00 0.00 54.13 54.32 2x17 s LEU 2 Cb 0.00 -4.23 -0.06 0.00 0.03 0.00 0.00 46.19 41.93 2x17 s LEU 2 CO 0.00 -0.31 1.02 -0.94 0.23 0.00 0.00 176.35 176.35 2x17 s SER 3 N -2.45 6.27 0.26 2.29 1.04 -1.26 -4.86 113.70 114.99 2x17 s SER 3 Ca 0.56 1.69 -0.01 0.00 0.48 0.00 0.00 55.95 58.67 2x17 s SER 3 Cb -0.10 -2.52 0.57 0.00 0.10 0.00 0.00 66.02 64.07 2x17 s SER 3 CO 0.19 -0.83 1.71 -0.08 0.98 0.00 0.00 173.24 175.22 2x17 h GLU 4 N 0.77 0.41 -0.30 4.02 4.81 -1.99 -0.30 114.58 121.99 2x17 h GLU 4 Ca -0.47 -0.02 -0.18 0.00 -0.13 0.00 0.00 59.36 58.56 2x17 h GLU 4 Cb 1.20 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 2x17 h GLU 4 CO 0.60 0.27 -0.51 -0.09 -0.73 0.00 0.00 179.01 178.54 2x17 h ARG 5 N 0.42 0.87 -0.44 1.92 2.43 -1.99 -2.78 114.38 114.80 2x17 h ARG 5 Ca 0.47 -0.53 -0.06 0.00 -0.81 0.00 0.00 59.98 59.05 2x17 h ARG 5 Cb 0.80 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.39 2x17 h ARG 5 CO -0.47 1.17 0.03 1.98 -1.51 0.00 0.00 179.97 181.17 2x17 h MET 6 N 0.67 0.76 -0.83 0.20 4.05 -1.68 -1.64 114.93 116.47 2x17 h MET 6 Ca 0.02 -0.23 -0.00 0.00 -0.28 0.00 0.00 59.70 59.21 2x17 h MET 6 Cb 1.11 -0.08 -0.04 0.00 -0.80 0.00 0.00 31.60 31.80 2x17 h MET 6 CO 0.12 0.81 0.51 1.25 0.23 0.00 0.00 176.91 179.82 2x17 h LEU 7 N 0.61 0.99 -0.65 3.39 5.85 -1.12 -1.18 115.31 123.20 2x17 h LEU 7 Ca 0.13 -0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.68 2x17 h LEU 7 Cb 0.45 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 2x17 h LEU 7 CO 0.02 0.75 -0.19 0.50 -0.34 0.00 0.00 178.44 179.18 2x17 h LYS 8 N 1.14 0.86 -0.20 1.25 3.64 -1.28 -1.67 116.57 120.31 2x17 h LYS 8 Ca 0.30 -0.33 -0.15 0.00 -1.27 0.00 0.00 60.65 59.20 2x17 h LYS 8 Cb -0.06 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2x17 h LYS 8 CO -0.06 0.97 -0.48 0.00 -2.27 0.00 0.00 179.45 177.61 2x17 h ALA 9 N 1.03 0.79 -0.13 5.00 0.00 -0.83 -0.74 119.26 124.38 2x17 h ALA 9 Ca 0.11 -0.48 -0.18 0.00 0.00 0.00 0.00 54.91 54.36 2x17 h ALA 9 Cb 0.71 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2x17 h ALA 9 CO 0.05 0.67 -0.67 -0.07 0.00 0.00 0.00 179.25 179.23 2x17 h LEU 10 N 0.42 0.62 -0.86 0.00 3.38 -1.18 -2.08 115.31 115.61 2x17 h LEU 10 Ca 0.02 -0.38 -0.11 0.00 0.09 0.00 0.00 57.88 57.51 2x17 h LEU 10 Cb 1.00 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 2x17 h LEU 10 CO 0.09 1.12 -0.30 0.78 0.09 0.00 0.00 178.44 180.22 2x17 h ASN 11 N 0.38 0.51 -0.29 -0.43 2.35 -1.21 -1.76 115.58 115.13 2x17 h ASN 11 Ca -0.02 -0.19 -0.13 0.00 -0.55 0.00 0.00 56.30 55.41 2x17 h ASN 11 Cb 1.25 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 39.48 2x17 h ASN 11 CO 0.12 0.79 -0.34 0.44 -1.65 0.00 0.00 177.43 176.80 2x17 h ASP 12 N 0.43 0.80 0.18 5.81 3.45 -1.07 -2.51 116.42 123.51 2x17 h ASP 12 Ca 0.06 -0.49 -0.11 0.00 0.43 0.00 0.00 57.03 56.92 2x17 h ASP 12 Cb 0.74 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 39.28 2x17 h ASP 12 CO 0.06 1.12 -0.40 -0.61 -1.57 0.00 0.00 179.24 177.84 2x17 h GLN 13 N 0.49 0.29 -0.92 3.56 5.75 -1.37 -0.86 115.11 122.04 2x17 h GLN 13 Ca 0.04 -0.14 0.02 0.00 -0.15 0.00 0.00 58.65 58.43 2x17 h GLN 13 Cb 0.92 -0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.42 2x17 h GLN 13 CO 0.08 0.65 0.60 1.25 -2.65 0.00 0.00 178.83 178.76 2x17 h LEU 14 N 0.24 1.03 -0.61 -2.39 6.46 -1.26 0.73 115.31 119.50 2x17 h LEU 14 Ca 0.02 -0.02 -0.12 0.00 -0.12 0.00 0.00 57.88 57.64 2x17 h LEU 14 Cb 0.81 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.49 2x17 h LEU 14 CO 0.06 0.72 -0.25 -1.13 -0.62 0.00 0.00 178.44 177.23 2x17 h ASN 15 N 1.20 0.85 -0.56 1.25 -0.73 -1.00 -2.54 115.58 114.05 2x17 h ASN 15 Ca 0.35 -0.32 -0.04 0.00 1.87 0.00 0.00 56.30 58.16 2x17 h ASN 15 Cb -0.07 -0.23 -0.02 0.00 0.27 0.00 0.00 38.32 38.26 2x17 h ASN 15 CO -0.10 1.06 0.19 0.03 -0.37 0.00 0.00 177.43 178.24 2x17 h ARG 16 N 0.71 0.86 -0.41 6.67 3.08 -0.57 -0.82 114.38 123.91 2x17 h ARG 16 Ca 0.09 -0.18 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 2x17 h ARG 16 Cb 0.79 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 2x17 h ARG 16 CO 0.06 0.78 -0.02 0.93 -1.07 0.00 0.00 179.97 180.65 2x17 h GLU 17 N 0.78 0.66 -0.09 0.04 4.39 -0.84 0.20 114.58 119.72 2x17 h GLU 17 Ca 0.18 -0.17 -0.14 0.00 0.34 0.00 0.00 59.36 59.57 2x17 h GLU 17 Cb 0.26 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 2x17 h GLU 17 CO -0.01 0.69 -0.57 -0.07 -1.16 0.00 0.00 179.01 177.90 2x17 h LEU 18 N 0.62 0.31 -0.45 1.33 3.38 -1.22 -2.71 115.31 116.58 2x17 h LEU 18 Ca 0.13 -0.17 -0.17 0.00 0.09 0.00 0.00 57.88 57.76 2x17 h LEU 18 Cb 0.42 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2x17 h LEU 18 CO 0.02 0.81 -0.54 0.22 0.09 0.00 0.00 178.44 179.04 2x17 h TYR 19 N 0.21 0.84 -0.55 1.13 3.20 -0.73 -2.37 116.97 118.70 2x17 h TYR 19 Ca -0.00 -0.29 0.07 0.00 3.14 0.00 0.00 58.73 61.65 2x17 h TYR 19 Cb 1.06 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 39.11 2x17 h TYR 19 CO 0.02 1.06 0.22 0.77 -1.64 0.00 0.00 178.16 178.60 2x17 h SER 20 N 0.52 0.26 -0.80 -2.11 0.02 -0.87 0.53 113.55 111.09 2x17 h SER 20 Ca 0.01 0.06 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 2x17 h SER 20 Cb 1.10 0.03 -0.05 0.00 0.14 0.00 0.00 62.40 63.62 2x17 h SER 20 CO 0.11 0.17 0.51 0.00 -1.14 0.00 0.00 176.83 176.48 2x17 h ALA 21 N 1.36 1.06 -0.05 3.77 0.00 -1.43 -1.81 119.26 122.16 2x17 h ALA 21 Ca 0.27 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 2x17 h ALA 21 Cb 0.28 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2x17 h ALA 21 CO -0.25 0.33 -0.61 -0.92 0.00 0.00 0.00 179.25 177.80 2x17 h TYR 22 N 1.00 0.23 -0.34 0.00 -0.00 -0.63 -1.23 116.97 116.00 2x17 h TYR 22 Ca 0.32 -0.09 -0.17 0.00 -0.00 0.00 0.00 58.73 58.79 2x17 h TYR 22 Cb 0.01 -0.04 -0.00 0.00 -0.00 0.00 0.00 36.73 36.70 2x17 h TYR 22 CO -0.03 0.75 -0.46 1.25 -0.00 0.00 0.00 178.16 179.67 2x17 h LEU 23 N 0.13 0.98 -0.60 2.82 5.85 0.25 -1.59 115.31 123.16 2x17 h LEU 23 Ca -0.01 -0.48 -0.13 0.00 0.84 0.00 0.00 57.88 58.10 2x17 h LEU 23 Cb 1.11 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 2x17 h LEU 23 CO 0.09 1.28 -0.60 1.88 -0.34 0.00 0.00 178.44 180.75 2x17 h TYR 24 N 0.72 0.00 0.00 1.25 0.05 -1.26 -0.24 116.97 117.49 2x17 h TYR 24 Ca 0.04 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.74 2x17 h TYR 24 Cb 1.06 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.79 2x17 h TYR 24 CO 0.07 0.60 -0.37 0.35 -1.05 0.00 0.00 178.16 177.75 2x17 h PHE 25 N 0.00 0.00 0.04 4.88 -0.00 -1.17 0.12 116.94 120.80 2x17 h PHE 25 Ca -0.01 0.00 -0.24 0.00 -0.00 0.00 0.00 57.97 57.72 2x17 h PHE 25 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.14 2x17 h PHE 25 CO 0.00 0.37 -1.03 0.00 -0.00 0.00 0.00 178.31 177.65 2x17 h ALA 26 N 1.63 0.28 -0.17 2.41 0.00 -0.86 -2.75 119.26 119.80 2x17 h ALA 26 Ca -0.00 -0.76 -0.15 0.00 0.00 0.00 0.00 54.91 54.00 2x17 h ALA 26 Cb 0.87 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2x17 h ALA 26 CO 0.05 0.85 -0.52 0.52 0.00 0.00 0.00 179.25 180.14 2x17 h MET 27 N 0.19 0.50 -0.87 0.00 2.86 -0.85 -2.13 114.93 114.63 2x17 h MET 27 Ca -0.10 -0.30 -0.00 0.00 -2.06 0.00 0.00 59.70 57.24 2x17 h MET 27 Cb 1.69 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 33.34 2x17 h MET 27 CO 0.18 0.90 0.53 0.00 1.06 0.00 0.00 176.91 179.58 2x17 h ALA 28 N 1.04 1.31 -0.32 6.32 0.00 -0.81 -1.25 119.26 125.54 2x17 h ALA 28 Ca 0.01 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2x17 h ALA 28 Cb 1.05 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2x17 h ALA 28 CO 0.10 0.61 -0.19 0.00 0.00 0.00 0.00 179.25 179.76 2x17 h ALA 29 N 1.40 1.07 -0.02 0.00 0.00 -1.30 -1.62 119.26 118.79 2x17 h ALA 29 Ca 0.31 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2x17 h ALA 29 Cb -0.07 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2x17 h ALA 29 CO -0.06 0.57 -0.00 -0.92 0.00 0.00 0.00 179.25 178.84 2x17 h TYR 30 N 0.54 0.04 -0.26 0.00 3.20 -0.78 -2.88 116.97 116.83 2x17 h TYR 30 Ca 0.09 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.85 2x17 h TYR 30 Cb 0.62 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.87 2x17 h TYR 30 CO 0.02 0.35 -0.26 0.74 -1.64 0.00 0.00 178.16 177.37 2x17 h PHE 31 N -0.27 0.58 -0.49 -3.82 0.04 -1.25 -2.93 116.94 108.79 2x17 h PHE 31 Ca 0.01 -0.13 -0.03 0.00 2.80 0.00 0.00 57.97 60.62 2x17 h PHE 31 Cb 0.33 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.32 2x17 h PHE 31 CO 0.04 0.73 0.17 1.49 -0.60 0.00 0.00 178.31 180.14 2x17 h GLU 32 N 0.45 0.72 -0.48 1.51 4.57 -1.32 -1.19 114.58 118.84 2x17 h GLU 32 Ca 0.06 -0.11 -0.07 0.00 -1.18 0.00 0.00 59.36 58.06 2x17 h GLU 32 Cb 0.69 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.14 2x17 h GLU 32 CO 0.05 0.61 -0.00 0.22 -1.18 0.00 0.00 179.01 178.71 2x17 h ASP 33 N 0.71 0.77 0.43 1.04 3.58 -1.32 -2.34 116.42 119.28 2x17 h ASP 33 Ca 0.17 -0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.43 2x17 h ASP 33 Cb 0.18 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.03 2x17 h ASP 33 CO -0.01 0.84 0.00 0.18 -2.88 0.00 0.00 179.24 177.37 2x17 n LEU 34 N -4.21 0.00 0.00 2.28 4.77 -0.95 -4.88 117.00 114.01 2x17 n LEU 34 Ca 0.02 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 2x17 n LEU 34 Cb 0.30 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2x17 n LEU 34 CO 0.42 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2x17 n GLY 35 N 0.87 0.70 3.49 -0.72 0.00 -0.88 -4.99 105.19 103.66 2x17 n GLY 35 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 2x17 n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x17 s LEU 36 N 0.00 4.65 0.32 0.99 1.43 -0.49 -4.83 118.68 120.75 2x17 s LEU 36 Ca 0.00 -2.37 0.13 0.00 -1.03 0.00 0.00 54.13 50.86 2x17 s LEU 36 Cb 0.00 -2.45 0.53 0.00 0.03 0.00 0.00 46.19 44.30 2x17 s LEU 36 CO 0.00 -1.03 1.70 -0.33 0.23 0.00 0.00 176.35 176.92 2x17 h GLU 37 N 8.17 0.00 -0.21 1.70 5.08 -1.90 -2.33 114.58 125.09 2x17 h GLU 37 Ca 0.27 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.54 2x17 h GLU 37 Cb 0.94 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 2x17 h GLU 37 CO 1.26 0.50 -0.19 0.78 -1.00 0.00 0.00 179.01 180.35 2x17 h GLY 38 N 1.68 0.55 1.04 -3.84 0.00 -1.88 -1.02 103.07 99.60 2x17 h GLY 38 Ca -0.01 -0.55 -0.04 0.00 0.00 0.00 0.00 47.33 46.73 2x17 h GLY 38 CO 0.07 0.50 0.32 0.74 0.00 0.00 0.00 176.54 178.16 2x17 h PHE 39 N 0.19 1.18 -0.28 5.60 -1.00 -1.74 -1.88 116.94 119.00 2x17 h PHE 39 Ca 0.04 -0.09 -0.02 0.00 2.81 0.00 0.00 57.97 60.71 2x17 h PHE 39 Cb 0.73 -0.35 -0.01 0.00 3.61 0.00 0.00 35.95 39.93 2x17 h PHE 39 CO 0.08 0.89 0.10 0.00 -1.61 0.00 0.00 178.31 177.77 2x17 h ALA 40 N 1.16 0.36 0.00 2.45 0.00 -1.34 -2.04 119.26 119.86 2x17 h ALA 40 Ca 0.26 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2x17 h ALA 40 Cb 0.21 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2x17 h ALA 40 CO -0.02 -0.03 -0.38 -0.91 0.00 0.00 0.00 179.25 177.91 2x17 h ASN 41 N 0.30 0.00 -0.40 0.00 2.35 -1.15 -1.55 115.58 115.13 2x17 h ASN 41 Ca 0.09 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.79 2x17 h ASN 41 Cb 0.20 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 2x17 h ASN 41 CO -0.01 0.38 0.03 -0.25 -1.65 0.00 0.00 177.43 175.94 2x17 h TRP 42 N 0.00 0.74 -0.28 1.19 7.01 -1.16 -2.00 115.95 121.45 2x17 h TRP 42 Ca -0.00 -0.12 -0.13 0.00 2.11 0.00 0.00 58.89 60.75 2x17 h TRP 42 Cb 0.79 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 27.64 2x17 h TRP 42 CO 0.00 0.74 -0.36 0.52 -2.79 0.00 0.00 178.44 176.55 2x17 h MET 43 N 0.52 0.63 -0.49 2.65 2.86 -1.07 -1.15 114.93 118.88 2x17 h MET 43 Ca 0.12 -0.30 -0.04 0.00 -2.06 0.00 0.00 59.70 57.42 2x17 h MET 43 Cb 0.43 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 2x17 h MET 43 CO 0.01 0.90 0.16 0.87 1.06 0.00 0.00 176.91 179.91 2x17 h LYS 44 N 0.53 0.76 -0.17 1.72 1.57 -1.28 0.32 116.57 120.02 2x17 h LYS 44 Ca 0.05 -0.16 -0.07 0.00 -1.87 0.00 0.00 60.65 58.60 2x17 h LYS 44 Cb 0.86 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 2x17 h LYS 44 CO 0.07 0.71 -0.21 0.00 -0.57 0.00 0.00 179.45 179.45 2x17 h ALA 45 N 1.01 1.32 -0.15 3.86 0.00 -1.21 -2.28 119.26 121.81 2x17 h ALA 45 Ca 0.16 -0.28 -0.19 0.00 0.00 0.00 0.00 54.91 54.60 2x17 h ALA 45 Cb 0.26 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2x17 h ALA 45 CO -0.01 0.46 -0.67 0.37 0.00 0.00 0.00 179.25 179.40 2x17 h GLN 46 N 0.27 0.60 -0.81 0.00 5.75 -0.96 -3.05 115.11 116.91 2x17 h GLN 46 Ca 0.05 -0.44 -0.03 0.00 -0.15 0.00 0.00 58.65 58.08 2x17 h GLN 46 Cb 0.54 0.08 -0.04 0.00 1.07 0.00 0.00 27.48 29.13 2x17 h GLN 46 CO 0.04 1.06 0.40 0.00 -2.65 0.00 0.00 178.83 177.68 2x17 h ALA 47 N 0.82 1.17 -0.40 3.38 0.00 -0.57 -2.47 119.26 121.19 2x17 h ALA 47 Ca -0.02 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 2x17 h ALA 47 Cb 1.25 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2x17 h ALA 47 CO 0.13 0.64 -0.01 0.93 0.00 0.00 0.00 179.25 180.93 2x17 h GLU 48 N 1.16 0.64 -0.49 0.00 5.08 -1.42 -2.14 114.58 117.41 2x17 h GLU 48 Ca 0.28 -0.16 -0.07 0.00 -1.00 0.00 0.00 59.36 58.41 2x17 h GLU 48 Cb 0.10 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2x17 h GLU 48 CO -0.04 0.67 0.00 0.93 -1.00 0.00 0.00 179.01 179.57 2x17 h GLU 49 N 0.60 0.80 -0.24 2.33 4.39 -1.35 -1.68 114.58 119.43 2x17 h GLU 49 Ca 0.12 -0.22 -0.15 0.00 0.34 0.00 0.00 59.36 59.46 2x17 h GLU 49 Cb 0.40 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 2x17 h GLU 49 CO 0.02 0.81 -0.46 0.93 -1.16 0.00 0.00 179.01 179.14 2x17 h GLU 50 N 0.75 0.62 -0.68 2.33 4.39 -1.10 0.14 114.58 121.04 2x17 h GLU 50 Ca 0.15 -0.35 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 2x17 h GLU 50 Cb 0.45 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.09 2x17 h GLU 50 CO 0.02 0.95 0.28 0.82 -1.16 0.00 0.00 179.01 179.92 2x17 h ILE 51 N 0.50 1.23 -0.48 3.13 2.04 -1.25 -0.74 117.51 121.93 2x17 h ILE 51 Ca 0.03 -0.70 -0.06 0.00 1.00 0.00 0.00 64.86 65.12 2x17 h ILE 51 Cb 1.00 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 2x17 h ILE 51 CO 0.09 0.29 0.03 1.23 0.00 0.00 0.00 178.15 179.79 2x17 h GLY 52 N 1.05 0.83 1.36 5.37 0.00 -0.87 -1.79 103.07 109.01 2x17 h GLY 52 Ca 0.23 -0.53 -0.09 0.00 0.00 0.00 0.00 47.33 46.94 2x17 h GLY 52 CO -0.02 0.49 -0.11 0.45 0.00 0.00 0.00 176.54 177.35 2x17 h HIS 53 N 0.73 0.84 -0.35 5.60 3.86 -0.40 -2.71 115.15 122.72 2x17 h HIS 53 Ca 0.15 -0.15 -0.12 0.00 -1.16 0.00 0.00 60.37 59.09 2x17 h HIS 53 Cb 0.40 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 2x17 h HIS 53 CO 0.02 0.83 -0.27 0.00 0.86 0.00 0.00 177.93 179.37 2x17 h ALA 54 N 1.18 0.87 0.00 2.45 0.00 -0.83 -2.96 119.26 119.97 2x17 h ALA 54 Ca 0.12 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 2x17 h ALA 54 Cb 0.58 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2x17 h ALA 54 CO 0.04 0.63 -0.29 -0.07 0.00 0.00 0.00 179.25 179.56 2x17 h LEU 55 N 0.62 0.00 -0.57 0.00 3.38 -1.23 -1.52 115.31 115.99 2x17 h LEU 55 Ca 0.08 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.90 2x17 h LEU 55 Cb 0.78 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2x17 h LEU 55 CO 0.06 0.29 -0.52 0.03 0.09 0.00 0.00 178.44 178.40 2x17 h ARG 56 N 0.00 0.52 -0.32 1.13 3.08 -1.32 -0.00 114.38 117.46 2x17 h ARG 56 Ca -0.00 -0.31 -0.13 0.00 0.07 0.00 0.00 59.98 59.60 2x17 h ARG 56 Cb 0.74 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 2x17 h ARG 56 CO 0.04 0.91 -0.31 0.74 -1.07 0.00 0.00 179.97 180.29 2x17 h PHE 57 N 0.41 0.93 -0.09 3.04 0.04 -1.40 -2.40 116.94 117.48 2x17 h PHE 57 Ca 0.01 -0.28 0.04 0.00 2.80 0.00 0.00 57.97 60.54 2x17 h PHE 57 Cb 1.04 -0.20 -0.04 0.00 2.20 0.00 0.00 35.95 38.95 2x17 h PHE 57 CO 0.04 1.05 -0.15 -0.92 -0.60 0.00 0.00 178.31 177.72 2x17 h TYR 58 N 0.55 -0.39 -0.72 -0.55 5.03 -1.15 -1.95 116.97 117.79 2x17 h TYR 58 Ca 0.05 0.02 -0.06 0.00 2.58 0.00 0.00 58.73 61.32 2x17 h TYR 58 Cb 0.88 0.19 -0.03 0.00 1.55 0.00 0.00 36.73 39.32 2x17 h TYR 58 CO 0.07 -0.22 0.20 -0.91 -1.32 0.00 0.00 178.16 175.98 2x17 h ASN 59 N -0.21 1.06 -0.33 -2.11 2.35 -1.02 -3.00 115.58 112.32 2x17 h ASN 59 Ca 0.08 -0.21 -0.04 0.00 -0.55 0.00 0.00 56.30 55.58 2x17 h ASN 59 Cb 0.32 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 2x17 h ASN 59 CO -0.21 0.99 0.04 0.22 -1.65 0.00 0.00 177.43 176.82 2x17 h TYR 60 N 1.07 0.59 -0.55 1.19 3.20 -1.29 -2.07 116.97 119.12 2x17 h TYR 60 Ca 0.23 -0.09 0.09 0.00 3.14 0.00 0.00 58.73 62.10 2x17 h TYR 60 Cb 0.33 -0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.37 2x17 h TYR 60 CO 0.03 0.64 0.17 0.82 -1.64 0.00 0.00 178.16 178.18 2x17 h ILE 61 N 0.37 0.77 0.00 1.81 2.04 -1.27 -1.35 117.51 119.88 2x17 h ILE 61 Ca 0.10 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.84 2x17 h ILE 61 Cb 0.38 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 2x17 h ILE 61 CO 0.01 0.06 0.00 1.88 0.00 0.00 0.00 178.15 180.10 2x17 h TYR 62 N 0.34 0.00 0.00 1.37 0.05 -1.48 0.97 116.97 118.22 2x17 h TYR 62 Ca 0.27 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.95 2x17 h TYR 62 Cb 0.34 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 2x17 h TYR 62 CO -0.19 0.00 -0.48 -0.44 -1.05 0.00 0.00 178.16 176.00 2x17 h ASP 63 N 0.00 0.00 -0.60 3.88 3.32 -0.54 -3.13 116.42 119.35 2x17 h ASP 63 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2x17 h ASP 63 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 2x17 h ASP 63 CO 0.00 0.48 0.00 0.54 -1.72 0.00 0.00 179.24 178.54 2x17 n ARG 64 N -3.46 3.26 -2.26 3.56 5.12 -0.70 -4.93 116.66 117.25 2x17 n ARG 64 Ca 0.00 -2.51 -0.16 0.00 -1.93 0.00 0.00 57.85 53.25 2x17 n ARG 64 Cb 0.61 -1.77 -0.01 0.00 -1.16 0.00 0.00 32.46 30.13 2x17 n ARG 64 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2x17 n ASN 65 N 1.08 -4.71 -1.87 0.55 5.15 -1.13 -4.16 115.26 110.17 2x17 n ASN 65 Ca 0.23 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.21 2x17 n ASN 65 Cb 0.76 -3.83 0.00 0.00 -0.53 0.00 0.00 39.78 36.18 2x17 n ASN 65 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2x17 n GLY 66 N -1.02 0.87 2.84 8.20 0.00 0.30 -4.94 105.19 111.44 2x17 n GLY 66 Ca -0.19 -1.96 -0.18 0.00 0.00 0.00 0.00 46.02 43.69 2x17 n GLY 66 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2x17 s ARG 67 N -1.77 0.51 -0.13 1.61 6.06 -1.26 -4.55 118.95 119.42 2x17 s ARG 67 Ca 0.00 0.01 -0.22 0.00 -2.50 0.00 0.00 55.73 53.02 2x17 s ARG 67 Cb 0.00 -0.63 -0.03 0.00 0.06 0.00 0.00 34.95 34.35 2x17 s ARG 67 CO 0.00 -0.12 0.68 0.08 -2.50 0.00 0.00 175.30 173.44 2x17 s VAL 68 N 1.02 5.02 -0.20 7.11 1.01 -1.26 -4.99 120.40 128.12 2x17 s VAL 68 Ca -0.10 1.34 -0.00 0.00 0.00 0.00 0.00 61.98 63.23 2x17 s VAL 68 Cb -0.14 -4.00 0.02 0.00 0.00 0.00 0.00 36.38 32.26 2x17 s VAL 68 CO -0.01 0.17 -0.15 -0.70 0.00 0.00 0.00 175.10 174.41 2x17 s GLU 69 N 1.40 3.00 -0.25 2.72 2.12 -1.26 -5.10 118.70 121.33 2x17 s GLU 69 Ca 0.34 -0.83 -0.23 0.00 0.36 0.00 0.00 54.97 54.60 2x17 s GLU 69 Cb -0.17 -2.71 -0.01 0.00 0.26 0.00 0.00 34.13 31.51 2x17 s GLU 69 CO 0.14 -0.25 0.76 -0.51 -0.54 0.00 0.00 175.26 174.86 2x17 s LEU 70 N 1.32 4.07 0.61 2.70 1.43 -1.26 -4.90 118.68 122.65 2x17 s LEU 70 Ca 0.04 0.90 -0.03 0.00 -1.03 0.00 0.00 54.13 54.02 2x17 s LEU 70 Cb -0.14 -3.06 0.04 0.00 0.03 0.00 0.00 46.19 43.06 2x17 s LEU 70 CO -0.10 -0.47 0.88 -1.81 0.23 0.00 0.00 176.35 175.08 2x17 s ASP 71 N 1.40 5.14 0.61 2.29 1.01 -1.26 -5.07 116.67 120.79 2x17 s ASP 71 Ca 0.32 0.25 -0.18 0.00 0.71 0.00 0.00 52.55 53.65 2x17 s ASP 71 Cb -0.15 -1.06 -0.02 0.00 1.01 0.00 0.00 42.92 42.69 2x17 s ASP 71 CO 0.08 -1.30 1.20 -1.83 0.21 0.00 0.00 175.17 173.53 2x17 s GLU 72 N -4.97 2.85 -0.31 8.23 -1.05 -1.26 -5.02 118.70 117.17 2x17 s GLU 72 Ca 0.58 1.80 -0.09 0.00 -0.15 0.00 0.00 54.97 57.10 2x17 s GLU 72 Cb -0.10 -1.92 -0.00 0.00 -0.44 0.00 0.00 34.13 31.66 2x17 s GLU 72 CO 0.41 -1.29 0.15 0.42 0.95 0.00 0.00 175.26 175.90 2x17 s ILE 73 N -1.68 4.53 0.79 1.83 1.01 -1.26 -5.08 121.20 121.35 2x17 s ILE 73 Ca 0.77 -0.48 -0.11 0.00 0.00 0.00 0.00 60.65 60.83 2x17 s ILE 73 Cb -0.30 -3.33 0.07 0.00 0.01 0.00 0.00 42.46 38.92 2x17 s ILE 73 CO 0.35 0.05 1.11 -2.16 0.00 0.00 0.00 174.94 174.29 2x17 s PRO 74 N 1.60 2.00 0.02 2.79 0.04 -1.26 -4.97 135.00 135.22 2x17 s PRO 74 Ca 0.04 1.31 -0.30 0.00 0.04 0.00 0.00 61.00 62.09 2x17 s PRO 74 Cb -0.17 -1.86 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 2x17 s PRO 74 CO 0.06 -1.86 1.45 0.21 0.04 0.00 0.00 177.00 176.90 2x17 s LYS 75 N -4.72 4.27 0.59 4.56 2.20 -1.26 -5.03 119.74 120.36 2x17 s LYS 75 Ca 0.64 2.05 -0.09 0.00 -0.36 0.00 0.00 55.97 58.20 2x17 s LYS 75 Cb -0.19 -3.55 -0.03 0.00 -1.51 0.00 0.00 37.83 32.54 2x17 s LYS 75 CO 0.55 -0.60 0.97 -1.25 -0.36 0.00 0.00 175.35 174.66 2x17 s PRO 76 N 2.34 3.49 0.34 4.03 0.04 -1.26 -5.03 135.00 138.95 2x17 s PRO 76 Ca 0.66 0.55 -0.29 0.00 0.04 0.00 0.00 61.00 61.96 2x17 s PRO 76 Cb -0.34 -2.16 -0.12 0.00 0.04 0.00 0.00 34.50 31.93 2x17 s PRO 76 CO 0.28 -0.52 1.41 -2.30 0.04 0.00 0.00 177.00 175.91 2x17 n PRO 77 N -2.64 2.40 -0.03 0.56 -0.02 -1.26 -4.96 135.00 129.05 2x17 n PRO 77 Ca 0.05 0.84 -0.16 0.00 -2.02 0.00 0.00 63.50 62.21 2x17 n PRO 77 Cb 0.55 -2.51 -0.13 0.00 -0.02 0.00 0.00 33.50 31.38 2x17 n PRO 77 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2x17 h LYS 78 N 3.12 0.10 -5.42 -0.52 3.64 -1.95 -3.45 116.57 112.08 2x17 h LYS 78 Ca -0.48 -0.17 -0.42 0.00 -1.27 0.00 0.00 60.65 58.32 2x17 h LYS 78 Cb 1.26 0.06 -0.14 0.00 -0.41 0.00 0.00 32.23 33.00 2x17 h LYS 78 CO 0.66 1.08 -0.72 -1.21 -2.27 0.00 0.00 179.45 176.99 2x17 s GLU 79 N -2.29 1.27 0.10 1.90 2.02 -1.26 -4.67 118.70 115.76 2x17 s GLU 79 Ca -0.17 -1.56 0.03 0.00 0.02 0.00 0.00 54.97 53.28 2x17 s GLU 79 Cb -0.02 -0.98 -0.04 0.00 0.10 0.00 0.00 34.13 33.19 2x17 s GLU 79 CO 0.73 0.15 -0.08 -1.58 0.02 0.00 0.00 175.26 174.50 2x17 s TRP 80 N -3.08 0.96 0.21 1.61 0.51 -1.26 -5.07 118.94 112.82 2x17 s TRP 80 Ca 0.21 -0.79 -0.07 0.00 -2.12 0.00 0.00 56.10 53.33 2x17 s TRP 80 Cb 0.00 -0.53 0.17 0.00 -0.81 0.00 0.00 33.47 32.30 2x17 s TRP 80 CO 0.05 -0.08 1.73 0.93 -0.51 0.00 0.00 176.95 179.08 2x17 h GLU 81 N 3.23 1.08 -3.51 4.98 5.08 -2.01 -3.46 114.58 119.96 2x17 h GLU 81 Ca -0.36 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 57.69 2x17 h GLU 81 Cb 1.18 -0.14 -0.12 0.00 0.50 0.00 0.00 28.75 30.17 2x17 h GLU 81 CO 0.60 0.96 -0.11 -1.54 -1.00 0.00 0.00 179.01 177.91 2x17 s SER 82 N -6.50 -0.15 0.47 1.42 1.04 -1.26 -5.00 113.70 103.73 2x17 s SER 82 Ca -0.12 -0.55 0.23 0.00 0.48 0.00 0.00 55.95 55.99 2x17 s SER 82 Cb 0.15 0.50 1.25 0.00 0.10 0.00 0.00 66.02 68.02 2x17 s SER 82 CO 0.84 -0.94 1.90 -0.65 0.98 0.00 0.00 173.24 175.36 2x17 h PRO 83 N 2.36 0.21 -0.14 4.02 0.11 -1.99 -0.74 132.00 135.83 2x17 h PRO 83 Ca -0.31 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.75 2x17 h PRO 83 Cb 1.25 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 2x17 h PRO 83 CO 0.44 0.14 -0.06 1.25 -0.21 0.00 0.00 178.00 179.55 2x17 h LEU 84 N 0.22 0.29 -1.49 2.35 5.85 -1.96 -2.82 115.31 117.76 2x17 h LEU 84 Ca 0.41 -0.41 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2x17 h LEU 84 Cb 1.26 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 2x17 h LEU 84 CO -0.09 0.63 -0.26 0.11 -0.34 0.00 0.00 178.44 178.49 2x17 h LYS 85 N -0.05 0.00 -0.27 1.25 1.79 -1.78 -0.49 116.57 117.01 2x17 h LYS 85 Ca 0.03 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.37 2x17 h LYS 85 Cb 0.52 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.16 2x17 h LYS 85 CO 0.02 0.26 -0.36 0.00 -1.08 0.00 0.00 179.45 178.29 2x17 h ALA 86 N 1.74 0.86 0.00 3.86 0.00 -1.15 -2.01 119.26 122.56 2x17 h ALA 86 Ca -0.00 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.36 2x17 h ALA 86 Cb 0.47 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2x17 h ALA 86 CO 0.03 0.64 -0.69 0.74 0.00 0.00 0.00 179.25 179.97 2x17 h PHE 87 N 0.51 0.00 -0.40 0.00 0.04 -1.19 -2.38 116.94 113.53 2x17 h PHE 87 Ca 0.05 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.72 2x17 h PHE 87 Cb 0.86 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.00 2x17 h PHE 87 CO 0.04 0.58 -0.15 0.93 -0.60 0.00 0.00 178.31 179.11 2x17 h GLU 88 N 0.00 0.74 -0.01 1.51 5.08 -1.02 -1.11 114.58 119.77 2x17 h GLU 88 Ca -0.03 -0.26 -0.13 0.00 -1.00 0.00 0.00 59.36 57.94 2x17 h GLU 88 Cb 1.47 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.64 2x17 h GLU 88 CO 0.07 0.85 -0.63 0.00 -1.00 0.00 0.00 179.01 178.30 2x17 h ALA 89 N 1.17 0.95 -0.20 3.43 0.00 -1.35 -2.40 119.26 120.86 2x17 h ALA 89 Ca 0.11 -0.57 -0.18 0.00 0.00 0.00 0.00 54.91 54.27 2x17 h ALA 89 Cb 0.63 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2x17 h ALA 89 CO 0.04 0.78 -0.58 0.00 0.00 0.00 0.00 179.25 179.50 2x17 h ALA 90 N 1.35 0.34 -0.08 0.00 0.00 -1.18 -2.01 119.26 117.69 2x17 h ALA 90 Ca -0.01 -0.53 -0.13 0.00 0.00 0.00 0.00 54.91 54.25 2x17 h ALA 90 Cb 1.11 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2x17 h ALA 90 CO 0.08 0.58 -0.51 -0.92 0.00 0.00 0.00 179.25 178.48 2x17 h TYR 91 N 0.47 0.27 -0.49 0.00 3.20 -1.23 -0.05 116.97 119.15 2x17 h TYR 91 Ca -0.01 -0.09 -0.12 0.00 3.14 0.00 0.00 58.73 61.65 2x17 h TYR 91 Cb 1.20 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 39.40 2x17 h TYR 91 CO 0.09 0.69 -0.16 1.49 -1.64 0.00 0.00 178.16 178.63 2x17 h GLU 92 N 0.18 0.96 -0.01 1.82 4.81 -1.43 -2.35 114.58 118.54 2x17 h GLU 92 Ca 0.00 -0.37 -0.14 0.00 -0.13 0.00 0.00 59.36 58.72 2x17 h GLU 92 Cb 0.97 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 2x17 h GLU 92 CO 0.08 1.04 -0.65 1.25 -0.73 0.00 0.00 179.01 180.00 2x17 h HIS 93 N 0.84 0.08 -0.02 0.92 2.76 -1.12 -2.21 115.15 116.40 2x17 h HIS 93 Ca 0.12 -0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 58.15 2x17 h HIS 93 Cb 0.71 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.65 2x17 h HIS 93 CO 0.05 0.69 -0.50 0.93 -1.30 0.00 0.00 177.93 177.79 2x17 h GLU 94 N 0.04 0.05 0.00 5.26 4.39 -0.89 -1.44 114.58 121.99 2x17 h GLU 94 Ca -0.01 -0.03 -0.15 0.00 0.34 0.00 0.00 59.36 59.51 2x17 h GLU 94 Cb 1.15 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.78 2x17 h GLU 94 CO 0.09 0.54 -0.73 0.87 -1.16 0.00 0.00 179.01 178.62 2x17 h LYS 95 N 0.04 0.00 -0.38 2.33 1.57 -1.31 -2.49 116.57 116.33 2x17 h LYS 95 Ca -0.00 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 2x17 h LYS 95 Cb 0.90 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 2x17 h LYS 95 CO 0.07 0.73 -0.03 0.35 -0.57 0.00 0.00 179.45 180.00 2x17 h PHE 96 N 0.00 0.77 -0.30 -1.35 3.57 -0.96 -1.80 116.94 116.86 2x17 h PHE 96 Ca -0.01 -0.14 -0.07 0.00 3.53 0.00 0.00 57.97 61.28 2x17 h PHE 96 Cb 1.31 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.84 2x17 h PHE 96 CO 0.00 0.80 -0.07 0.82 -2.23 0.00 0.00 178.31 177.63 2x17 h ILE 97 N 0.51 1.28 -0.87 1.41 1.08 -1.31 -2.71 117.51 116.90 2x17 h ILE 97 Ca 0.11 -1.10 0.05 0.00 -0.39 0.00 0.00 64.86 63.53 2x17 h ILE 97 Cb 0.51 1.37 -0.06 0.00 -3.07 0.00 0.00 36.82 35.58 2x17 h ILE 97 CO 0.02 0.35 0.55 0.28 -0.69 0.00 0.00 178.15 178.67 2x17 h SER 98 N 0.35 0.89 -0.71 1.72 0.02 -1.44 -1.44 113.55 112.94 2x17 h SER 98 Ca 0.08 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 2x17 h SER 98 Cb 0.55 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 2x17 h SER 98 CO 0.03 0.58 0.31 0.50 -1.14 0.00 0.00 176.83 177.12 2x17 h LYS 99 N 1.03 1.04 0.00 3.45 3.64 -1.24 -1.04 116.57 123.44 2x17 h LYS 99 Ca 0.37 -0.17 -0.05 0.00 -1.27 0.00 0.00 60.65 59.53 2x17 h LYS 99 Cb 0.11 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2x17 h LYS 99 CO -0.15 0.84 -0.23 0.66 -2.27 0.00 0.00 179.45 178.29 2x17 h SER 100 N 1.00 0.00 -0.15 4.20 4.64 -1.13 -0.40 113.55 121.72 2x17 h SER 100 Ca 0.24 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.35 2x17 h SER 100 Cb 0.16 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.26 2x17 h SER 100 CO -0.03 0.23 -0.73 0.40 -0.87 0.00 0.00 176.83 175.84 2x17 h ILE 101 N 0.00 1.28 -0.57 0.95 1.08 -0.86 -2.22 117.51 117.17 2x17 h ILE 101 Ca -0.00 -1.93 -0.06 0.00 -0.39 0.00 0.00 64.86 62.48 2x17 h ILE 101 Cb 0.81 1.91 -0.02 0.00 -3.07 0.00 0.00 36.82 36.45 2x17 h ILE 101 CO 0.03 0.62 0.13 1.88 -0.69 0.00 0.00 178.15 180.12 2x17 h TYR 102 N 0.55 0.97 -0.09 1.37 0.05 -0.78 -0.59 116.97 118.45 2x17 h TYR 102 Ca -0.04 -0.12 -0.07 0.00 0.05 0.00 0.00 58.73 58.55 2x17 h TYR 102 Cb 1.35 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.81 2x17 h TYR 102 CO 0.08 0.83 -0.27 0.93 -1.05 0.00 0.00 178.16 178.69 2x17 h GLU 103 N 0.83 0.17 -0.25 4.88 5.08 -1.11 0.14 114.58 124.32 2x17 h GLU 103 Ca 0.18 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.30 2x17 h GLU 103 Cb 0.36 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2x17 h GLU 103 CO 0.00 0.43 -0.58 -0.07 -1.00 0.00 0.00 179.01 177.79 2x17 h LEU 104 N 0.15 0.89 -0.62 1.33 3.38 -1.21 -2.06 115.31 117.17 2x17 h LEU 104 Ca 0.02 -0.49 -0.09 0.00 0.09 0.00 0.00 57.88 57.41 2x17 h LEU 104 Cb 0.56 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2x17 h LEU 104 CO 0.04 1.28 0.04 0.00 0.09 0.00 0.00 178.44 179.88 2x17 h ALA 105 N 0.73 0.83 -0.25 1.53 0.00 -0.57 -0.79 119.26 120.74 2x17 h ALA 105 Ca 0.00 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 2x17 h ALA 105 Cb 1.18 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2x17 h ALA 105 CO 0.12 0.64 -0.26 0.00 0.00 0.00 0.00 179.25 179.75 2x17 h ALA 106 N 1.00 1.07 -0.15 0.00 0.00 -0.77 -1.75 119.26 118.67 2x17 h ALA 106 Ca 0.18 -0.35 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 2x17 h ALA 106 Cb 0.51 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2x17 h ALA 106 CO 0.02 0.57 -0.58 1.25 0.00 0.00 0.00 179.25 180.52 2x17 h LEU 107 N 0.43 0.52 -0.55 0.00 5.85 -1.16 -1.35 115.31 119.05 2x17 h LEU 107 Ca 0.06 -0.29 -0.15 0.00 0.84 0.00 0.00 57.88 58.34 2x17 h LEU 107 Cb 0.69 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 2x17 h LEU 107 CO 0.05 0.98 -0.48 0.00 -0.34 0.00 0.00 178.44 178.66 2x17 h ALA 108 N 1.02 0.73 0.00 1.25 0.00 -0.98 -1.63 119.26 119.66 2x17 h ALA 108 Ca 0.00 -0.48 -0.15 0.00 0.00 0.00 0.00 54.91 54.28 2x17 h ALA 108 Cb 1.11 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2x17 h ALA 108 CO 0.10 0.67 -0.70 0.93 0.00 0.00 0.00 179.25 180.26 2x17 h GLU 109 N 0.49 0.00 -0.15 0.00 5.08 -1.27 0.12 114.58 118.84 2x17 h GLU 109 Ca 0.03 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.20 2x17 h GLU 109 Cb 1.02 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.27 2x17 h GLU 109 CO 0.09 0.70 -0.64 1.49 -1.00 0.00 0.00 179.01 179.66 2x17 h GLU 110 N 0.00 0.70 -0.47 2.33 4.81 -1.16 -3.14 114.58 117.64 2x17 h GLU 110 Ca -0.01 -0.55 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 2x17 h GLU 110 Cb 1.27 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.76 2x17 h GLU 110 CO 0.09 1.16 0.00 0.39 -0.73 0.00 0.00 179.01 179.93 2x17 n GLU 111 N -4.07 2.11 -3.35 1.92 1.02 -0.62 -4.92 120.64 112.73 2x17 n GLU 111 Ca -0.07 -1.38 -0.21 0.00 -0.02 0.00 0.00 57.16 55.48 2x17 n GLU 111 Cb 0.67 -1.43 -0.02 0.00 -0.02 0.00 0.00 31.44 30.64 2x17 n GLU 111 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2x17 n LYS 112 N 0.52 -2.53 -2.82 3.49 5.02 -0.68 -4.86 118.16 116.29 2x17 n LYS 112 Ca 0.13 0.26 -0.43 0.00 -2.02 0.00 0.00 58.31 56.24 2x17 n LYS 112 Cb 0.41 -4.86 -0.02 0.00 -0.02 0.00 0.00 35.03 30.54 2x17 n LYS 112 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2x17 s ASP 113 N -2.60 6.77 0.42 4.39 -1.08 0.32 -4.86 116.67 120.04 2x17 s ASP 113 Ca 0.37 -2.29 0.12 0.00 -0.52 0.00 0.00 52.55 50.23 2x17 s ASP 113 Cb -0.21 -2.45 0.91 0.00 -1.46 0.00 0.00 42.92 39.72 2x17 s ASP 113 CO 0.45 -1.05 1.96 1.88 0.52 0.00 0.00 175.17 178.93 2x17 h TYR 114 N 8.31 0.10 -0.42 -5.34 -1.99 -1.89 -2.03 116.97 113.71 2x17 h TYR 114 Ca 0.25 -0.01 -0.09 0.00 2.00 0.00 0.00 58.73 60.88 2x17 h TYR 114 Cb 0.95 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 39.64 2x17 h TYR 114 CO 1.20 0.26 -0.09 0.77 -0.00 0.00 0.00 178.16 180.30 2x17 h SER 115 N 0.09 0.80 0.16 3.88 0.02 -1.96 -0.99 113.55 115.55 2x17 h SER 115 Ca 0.02 -0.35 -0.20 0.00 -0.84 0.00 0.00 61.79 60.42 2x17 h SER 115 Cb 0.34 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 2x17 h SER 115 CO 0.02 0.97 -0.76 0.74 -1.14 0.00 0.00 176.83 176.66 2x17 h THR 116 N 0.62 1.35 -0.63 -2.27 2.02 -1.90 -1.40 112.91 110.70 2x17 h THR 116 Ca 0.11 -2.11 -0.06 0.00 0.77 0.00 0.00 66.41 65.11 2x17 h THR 116 Cb 0.61 2.10 -0.03 0.00 -1.74 0.00 0.00 68.15 69.09 2x17 h THR 116 CO 0.04 0.64 0.14 -0.09 0.37 0.00 0.00 175.52 176.62 2x17 h ARG 117 N 0.34 1.00 -0.09 6.66 9.65 -1.35 -0.72 114.38 129.88 2x17 h ARG 117 Ca -0.04 -0.23 -0.14 0.00 -1.10 0.00 0.00 59.98 58.47 2x17 h ARG 117 Cb 1.35 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.78 2x17 h ARG 117 CO 0.14 0.90 -0.56 0.00 2.80 0.00 0.00 179.97 183.25 2x17 h ALA 118 N 1.20 0.90 -0.41 2.80 0.00 -1.11 -3.03 119.26 119.60 2x17 h ALA 118 Ca 0.20 -0.51 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 2x17 h ALA 118 Cb 0.36 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2x17 h ALA 118 CO 0.00 0.70 -0.19 0.35 0.00 0.00 0.00 179.25 180.11 2x17 h PHE 119 N 0.20 0.97 0.00 0.00 3.57 -0.96 -3.15 116.94 117.58 2x17 h PHE 119 Ca 0.00 -0.24 0.00 0.00 3.53 0.00 0.00 57.97 61.26 2x17 h PHE 119 Cb 1.04 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.56 2x17 h PHE 119 CO 0.02 1.00 0.00 1.28 -2.23 0.00 0.00 178.31 178.39 2x17 n LEU 120 N -4.23 0.66 -0.27 0.59 4.77 -0.30 -3.10 117.00 115.11 2x17 n LEU 120 Ca -0.01 0.65 0.02 0.00 -0.03 0.00 0.00 56.01 56.64 2x17 n LEU 120 Cb 0.43 -0.55 0.24 0.00 -2.33 0.00 0.00 43.42 41.20 2x17 n LEU 120 CO 0.45 -0.52 1.25 -0.08 -1.33 0.00 0.00 177.39 177.16 2x17 h GLU 121 N 0.00 1.01 -0.95 3.23 4.57 -1.48 -1.48 114.58 119.48 2x17 h GLU 121 Ca 0.00 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.13 2x17 h GLU 121 Cb 0.39 -0.23 -0.05 0.00 -0.16 0.00 0.00 28.75 28.71 2x17 h GLU 121 CO 0.00 0.67 0.63 2.35 -1.18 0.00 0.00 179.01 181.48 2x17 h TRP 122 N 1.04 1.20 0.01 0.92 7.01 -1.74 -2.68 115.95 121.71 2x17 h TRP 122 Ca 0.34 0.02 -0.19 0.00 2.11 0.00 0.00 58.89 61.17 2x17 h TRP 122 Cb 0.05 -0.41 -0.02 0.00 -2.10 0.00 0.00 29.16 26.69 2x17 h TRP 122 CO -0.00 0.76 -0.88 0.74 -2.79 0.00 0.00 178.44 176.27 2x17 h PHE 123 N 1.29 0.19 -0.14 2.65 0.04 -1.52 -1.29 116.94 118.15 2x17 h PHE 123 Ca 0.35 -0.11 -0.01 0.00 2.80 0.00 0.00 57.97 61.01 2x17 h PHE 123 Cb -0.14 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 2x17 h PHE 123 CO -0.00 0.93 0.07 0.82 -0.60 0.00 0.00 178.31 179.53 2x17 h ILE 124 N 0.06 1.13 -0.66 -0.55 2.04 -1.18 -0.82 117.51 117.54 2x17 h ILE 124 Ca -0.03 -0.39 -0.08 0.00 1.00 0.00 0.00 64.86 65.35 2x17 h ILE 124 Cb 1.52 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 38.70 2x17 h ILE 124 CO 0.13 0.12 0.09 0.78 0.00 0.00 0.00 178.15 179.27 2x17 h ASN 125 N 0.10 1.07 -0.60 1.72 2.35 -1.49 -3.06 115.58 115.66 2x17 h ASN 125 Ca 0.05 -0.27 -0.07 0.00 -0.55 0.00 0.00 56.30 55.46 2x17 h ASN 125 Cb 0.14 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 2x17 h ASN 125 CO -0.01 1.07 0.11 -0.08 -1.65 0.00 0.00 177.43 176.87 2x17 h GLU 126 N 1.03 1.02 0.00 0.81 4.22 -1.12 -2.94 114.58 117.59 2x17 h GLU 126 Ca 0.20 -0.25 -0.01 0.00 0.08 0.00 0.00 59.36 59.38 2x17 h GLU 126 Cb 0.47 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 2x17 h GLU 126 CO 0.02 0.93 -0.04 1.96 -2.18 0.00 0.00 179.01 179.70 2x17 h GLN 127 N 0.96 0.00 -0.35 1.92 1.08 -1.10 -1.81 115.11 115.82 2x17 h GLN 127 Ca 0.20 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.33 2x17 h GLN 127 Cb 0.40 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.82 2x17 h GLN 127 CO 0.01 0.04 -0.04 0.28 -0.95 0.00 0.00 178.83 178.16 2x17 h VAL 128 N 0.00 1.27 -0.34 -0.54 2.07 -1.41 -2.05 116.25 115.25 2x17 h VAL 128 Ca -0.00 -1.07 -0.07 0.00 0.82 0.00 0.00 66.70 66.38 2x17 h VAL 128 Cb 0.65 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 2x17 h VAL 128 CO 0.01 0.35 -0.07 -0.33 0.02 0.00 0.00 177.57 177.55 2x17 h GLU 129 N 0.44 0.64 -0.51 1.57 5.08 -1.51 -2.63 114.58 117.67 2x17 h GLU 129 Ca 0.09 -0.24 0.01 0.00 -1.00 0.00 0.00 59.36 58.23 2x17 h GLU 129 Cb 0.53 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 2x17 h GLU 129 CO 0.03 0.81 0.32 0.93 -1.00 0.00 0.00 179.01 180.09 2x17 h GLU 130 N 0.43 0.63 -0.33 2.33 4.39 -1.33 0.76 114.58 121.46 2x17 h GLU 130 Ca 0.09 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.71 2x17 h GLU 130 Cb 0.56 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2x17 h GLU 130 CO 0.03 0.42 0.04 0.93 -1.16 0.00 0.00 179.01 179.27 2x17 h GLU 131 N 0.65 0.56 0.00 2.33 5.08 -1.42 -2.19 114.58 119.59 2x17 h GLU 131 Ca 0.19 -0.16 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 2x17 h GLU 131 Cb -0.03 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2x17 h GLU 131 CO -0.06 0.65 -0.29 0.00 -1.00 0.00 0.00 179.01 178.31 2x17 h ALA 132 N 0.88 1.45 -0.15 3.43 0.00 -1.25 0.39 119.26 124.01 2x17 h ALA 132 Ca 0.10 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2x17 h ALA 132 Cb 0.37 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2x17 h ALA 132 CO 0.01 0.36 -0.13 1.03 0.00 0.00 0.00 179.25 180.52 2x17 h SER 133 N 0.00 0.38 -0.19 0.00 0.87 -0.68 -2.46 113.55 111.46 2x17 h SER 133 Ca -0.00 -0.46 -0.15 0.00 -1.23 0.00 0.00 61.79 59.95 2x17 h SER 133 Cb 0.53 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 2x17 h SER 133 CO 0.04 0.76 -0.46 0.58 -0.53 0.00 0.00 176.83 177.22 2x17 h VAL 134 N -0.00 1.32 -0.76 2.23 2.07 -1.19 -3.22 116.25 116.70 2x17 h VAL 134 Ca 0.03 -1.70 -0.01 0.00 0.82 0.00 0.00 66.70 65.84 2x17 h VAL 134 Cb 0.64 1.89 -0.04 0.00 -1.52 0.00 0.00 31.29 32.27 2x17 h VAL 134 CO 0.03 0.53 0.43 0.50 0.02 0.00 0.00 177.57 179.08 2x17 h LYS 135 N 0.34 1.05 -0.48 1.57 1.63 -1.01 -1.24 116.57 118.43 2x17 h LYS 135 Ca -0.00 -0.11 0.04 0.00 -0.85 0.00 0.00 60.65 59.73 2x17 h LYS 135 Cb 1.07 -0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 32.45 2x17 h LYS 135 CO 0.10 0.76 0.25 -0.22 -3.45 0.00 0.00 179.45 176.89 2x17 h LYS 136 N 1.06 0.47 0.00 1.90 3.64 -1.45 -1.20 116.57 121.00 2x17 h LYS 136 Ca 0.27 -0.03 -0.18 0.00 -1.27 0.00 0.00 60.65 59.44 2x17 h LYS 136 Cb 0.01 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 2x17 h LYS 136 CO -0.05 0.31 -0.85 0.82 -2.27 0.00 0.00 179.45 177.42 2x17 h ILE 137 N 0.49 1.59 -0.39 2.00 2.04 -1.52 -3.04 117.51 118.67 2x17 h ILE 137 Ca 0.21 -2.84 -0.00 0.00 1.00 0.00 0.00 64.86 63.22 2x17 h ILE 137 Cb 0.10 2.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.71 2x17 h ILE 137 CO -0.14 0.81 0.23 0.25 0.00 0.00 0.00 178.15 179.31 2x17 h LEU 138 N 0.02 0.48 -1.35 1.44 6.46 -0.87 -1.92 115.31 119.56 2x17 h LEU 138 Ca -0.02 -0.06 -0.06 0.00 -0.12 0.00 0.00 57.88 57.63 2x17 h LEU 138 Cb 1.50 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 41.29 2x17 h LEU 138 CO 0.11 0.40 -0.17 0.44 -0.62 0.00 0.00 178.44 178.60 2x17 h ASP 139 N 0.52 0.21 0.86 1.25 3.32 -1.24 -1.69 116.42 119.65 2x17 h ASP 139 Ca 0.14 -0.05 -0.10 0.00 0.02 0.00 0.00 57.03 57.04 2x17 h ASP 139 Cb 0.01 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2x17 h ASP 139 CO -0.03 0.40 -0.48 0.11 -1.72 0.00 0.00 179.24 177.53 2x17 h LYS 140 N 0.21 0.00 0.00 3.56 1.57 -1.37 -1.76 116.57 118.77 2x17 h LYS 140 Ca 0.04 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.65 2x17 h LYS 140 Cb 0.43 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 2x17 h LYS 140 CO 0.03 0.48 -0.84 -0.07 -0.57 0.00 0.00 179.45 178.48 2x17 h LEU 141 N 0.00 0.00 -1.11 2.94 3.38 -0.81 -2.88 115.31 116.83 2x17 h LEU 141 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2x17 h LEU 141 Cb 1.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 2x17 h LEU 141 CO 0.06 0.82 -0.38 0.11 0.09 0.00 0.00 178.44 179.14 2x17 h LYS 142 N 0.00 0.00 0.00 1.13 1.57 -1.21 -3.19 116.57 114.87 2x17 h LYS 142 Ca -0.01 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 2x17 h LYS 142 Cb 1.63 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.94 2x17 h LYS 142 CO 0.10 0.38 -0.24 0.35 -0.57 0.00 0.00 179.45 179.47 2x17 h PHE 143 N 0.00 0.00 -2.08 -1.35 3.57 -1.10 -3.35 116.94 112.62 2x17 h PHE 143 Ca -0.00 0.00 -0.57 0.00 3.53 0.00 0.00 57.97 60.93 2x17 h PHE 143 Cb 0.80 0.00 -0.40 0.00 2.79 0.00 0.00 35.95 39.14 2x17 h PHE 143 CO 0.00 0.24 -0.92 0.00 -2.23 0.00 0.00 178.31 175.40 2x17 n ALA 144 N -2.21 3.06 -0.01 2.41 0.00 -1.17 -4.95 120.51 117.65 2x17 n ALA 144 Ca 0.01 -3.93 -0.12 0.00 0.00 0.00 0.00 53.44 49.39 2x17 n ALA 144 Cb 0.47 -0.85 -0.10 0.00 0.00 0.00 0.00 19.45 18.97 2x17 n ALA 144 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2x17 h LYS 145 N 3.87 -0.06 -0.61 0.00 1.57 -1.71 -3.30 116.57 116.32 2x17 h LYS 145 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2x17 h LYS 145 Cb 0.79 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.12 2x17 h LYS 145 CO 0.61 0.53 0.00 -0.25 -0.57 0.00 0.00 179.45 179.77 2x17 n ASP 146 N -4.82 4.42 -4.13 0.86 8.00 -1.26 -4.86 116.55 114.75 2x17 n ASP 146 Ca -0.09 -2.36 -0.37 0.00 0.71 0.00 0.00 54.79 52.69 2x17 n ASP 146 Cb 0.31 -0.53 -0.11 0.00 -0.02 0.00 0.00 41.12 40.76 2x17 n ASP 146 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2x17 s SER 147 N -1.00 5.28 0.21 -2.24 0.15 -1.25 -4.93 113.70 109.92 2x17 s SER 147 Ca 0.48 -1.96 0.25 0.00 0.70 0.00 0.00 55.95 55.42 2x17 s SER 147 Cb 0.30 -1.84 0.90 0.00 -1.71 0.00 0.00 66.02 63.67 2x17 s SER 147 CO 0.24 -0.54 1.75 -2.65 1.20 0.00 0.00 173.24 173.25 2x17 n PRO 148 N 4.63 0.21 -0.11 5.44 -0.02 -1.26 -3.37 135.00 140.51 2x17 n PRO 148 Ca -0.03 0.28 -0.12 0.00 -2.02 0.00 0.00 63.50 61.60 2x17 n PRO 148 Cb 0.41 -1.80 -0.03 0.00 -0.02 0.00 0.00 33.50 32.06 2x17 n PRO 148 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2x17 h GLN 149 N 0.00 0.74 0.01 -0.52 7.50 -1.96 -2.50 115.11 118.37 2x17 h GLN 149 Ca 0.00 -0.34 -0.20 0.00 0.50 0.00 0.00 58.65 58.61 2x17 h GLN 149 Cb 0.56 -0.01 -0.01 0.00 0.05 0.00 0.00 27.48 28.07 2x17 h GLN 149 CO 0.00 0.95 -0.91 0.82 -1.50 0.00 0.00 178.83 178.19 2x17 h ILE 150 N 0.52 1.52 -0.38 2.54 2.04 -1.94 -2.60 117.51 119.20 2x17 h ILE 150 Ca 0.07 -2.74 -0.02 0.00 1.00 0.00 0.00 64.86 63.17 2x17 h ILE 150 Cb 0.75 2.54 -0.02 0.00 -0.74 0.00 0.00 36.82 39.35 2x17 h ILE 150 CO 0.06 0.79 0.14 0.25 0.00 0.00 0.00 178.15 179.39 2x17 h LEU 151 N 0.09 0.49 -0.25 1.44 5.85 -1.56 0.31 115.31 121.68 2x17 h LEU 151 Ca -0.04 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.55 2x17 h LEU 151 Cb 1.56 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.46 2x17 h LEU 151 CO 0.14 0.46 -0.13 0.15 -0.34 0.00 0.00 178.44 178.71 2x17 h PHE 152 N 0.54 0.61 0.00 1.25 3.57 -1.33 -2.12 116.94 119.47 2x17 h PHE 152 Ca 0.13 -0.16 -0.12 0.00 3.53 0.00 0.00 57.97 61.36 2x17 h PHE 152 Cb 0.13 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 2x17 h PHE 152 CO 0.01 0.80 -0.56 0.52 -2.23 0.00 0.00 178.31 176.85 2x17 h MET 153 N 0.25 0.00 -0.08 1.11 2.86 -1.06 -2.87 114.93 115.15 2x17 h MET 153 Ca 0.05 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.53 2x17 h MET 153 Cb 0.65 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.30 2x17 h MET 153 CO 0.04 0.56 -0.66 1.25 1.06 0.00 0.00 176.91 179.15 2x17 h LEU 154 N 0.00 0.37 -0.85 1.22 6.46 -0.40 -2.83 115.31 119.28 2x17 h LEU 154 Ca -0.01 -0.23 -0.07 0.00 -0.12 0.00 0.00 57.88 57.46 2x17 h LEU 154 Cb 0.99 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.79 2x17 h LEU 154 CO 0.07 0.93 0.09 -0.78 -0.62 0.00 0.00 178.44 178.14 2x17 h ASP 155 N 0.23 0.90 0.05 1.25 3.58 -1.19 -2.34 116.42 118.90 2x17 h ASP 155 Ca -0.02 -0.20 -0.14 0.00 0.42 0.00 0.00 57.03 57.10 2x17 h ASP 155 Cb 1.21 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 42.01 2x17 h ASP 155 CO 0.11 0.91 -0.45 0.50 -2.88 0.00 0.00 179.24 177.42 2x17 h LYS 156 N 0.90 0.48 -0.21 0.28 3.64 -1.47 -2.82 116.57 117.37 2x17 h LYS 156 Ca 0.18 -0.26 -0.12 0.00 -1.27 0.00 0.00 60.65 59.18 2x17 h LYS 156 Cb 0.39 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2x17 h LYS 156 CO 0.01 0.84 -0.37 0.93 -2.27 0.00 0.00 179.45 178.59 2x17 h GLU 157 N 0.39 0.47 0.00 1.90 5.08 -1.26 -3.05 114.58 118.11 2x17 h GLU 157 Ca 0.03 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2x17 h GLU 157 Cb 0.95 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.20 2x17 h GLU 157 CO 0.08 0.78 -0.19 -0.07 -1.00 0.00 0.00 179.01 178.62 2x17 h LEU 158 N 0.40 0.00 -0.29 1.33 3.38 -1.40 -3.22 115.31 115.51 2x17 h LEU 158 Ca 0.04 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2x17 h LEU 158 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2x17 h LEU 158 CO 0.07 0.03 0.00 -1.54 0.09 0.00 0.00 178.44 177.08 2x17 n SER 159 N -2.36 0.37 0.12 -0.43 3.41 -1.07 -2.44 113.62 111.23 2x17 n SER 159 Ca 0.05 0.58 0.02 0.00 -0.26 0.00 0.00 58.87 59.26 2x17 n SER 159 Cb 0.45 -0.66 0.39 0.00 -0.26 0.00 0.00 64.21 64.13 2x17 n SER 159 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2x17 h ALA 160 N 2.46 1.51 -2.57 7.33 0.00 -1.67 -3.39 119.26 122.92 2x17 h ALA 160 Ca 0.00 -0.20 -0.61 0.00 0.00 0.00 0.00 54.91 54.10 2x17 h ALA 160 Cb 0.38 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 17.97 2x17 h ALA 160 CO 0.00 0.35 0.05 0.50 0.00 0.00 0.00 179.25 180.15 2x17 s ARG 161 N -4.73 4.11 0.11 0.00 3.52 -1.02 -5.07 118.95 115.87 2x17 s ARG 161 Ca -0.05 0.43 0.06 0.00 -0.13 0.00 0.00 55.73 56.03 2x17 s ARG 161 Cb 0.15 -3.63 -0.04 0.00 -1.56 0.00 0.00 34.95 29.87 2x17 s ARG 161 CO 0.73 -0.34 -0.15 0.00 -0.81 0.00 0.00 175.30 174.74 2x17 s ALA 162 N 2.26 1.48 0.56 6.12 0.00 -1.26 -3.83 121.76 127.08 2x17 s ALA 162 Ca 0.24 -1.25 -0.20 0.00 0.00 0.00 0.00 51.96 50.75 2x17 s ALA 162 Cb -0.16 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 2x17 s ALA 162 CO 0.09 0.13 1.27 -1.25 0.00 0.00 0.00 175.76 176.01 2x17 s PRO 163 N -2.46 3.11 -0.03 0.00 0.04 -1.26 -4.76 135.00 129.64 2x17 s PRO 163 Ca 0.07 2.01 0.18 0.00 0.04 0.00 0.00 61.00 63.30 2x17 s PRO 163 Cb -0.06 -2.12 -0.27 0.00 0.04 0.00 0.00 34.50 32.08 2x17 s PRO 163 CO 0.03 -1.15 0.37 1.63 0.04 0.00 0.00 177.00 177.92 2x17 n LYS 164 N -1.24 0.59 -0.01 4.56 5.02 -1.26 -4.65 118.16 121.17 2x17 n LYS 164 Ca 0.12 -0.15 -0.13 0.00 -2.02 0.00 0.00 58.31 56.12 2x17 n LYS 164 Cb 0.47 -1.43 -0.10 0.00 -0.02 0.00 0.00 35.03 33.96 2x17 n LYS 164 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2x17 h LEU 165 N 0.00 -0.04 -0.98 -0.35 5.85 -1.99 -3.37 115.31 114.43 2x17 h LEU 165 Ca -0.03 -0.55 0.34 0.00 0.84 0.00 0.00 57.88 58.48 2x17 h LEU 165 Cb 0.90 0.01 -0.16 0.00 0.37 0.00 0.00 40.66 41.77 2x17 h LEU 165 CO 0.00 0.54 0.43 -0.65 -0.34 0.00 0.00 178.44 178.43 2x17 h PRO 166 N -0.64 0.14 0.00 5.25 0.11 -1.99 0.21 132.00 135.07 2x17 h PRO 166 Ca -0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2x17 h PRO 166 Cb 0.58 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.66 2x17 h PRO 166 CO 0.01 0.09 0.00 0.41 -0.21 0.00 0.00 178.00 178.30 2x17 n GLY 167 N -1.32 -1.08 0.00 -0.55 0.00 -1.26 -3.65 105.19 97.34 2x17 n GLY 167 Ca 0.31 -0.11 0.07 0.00 0.00 0.00 0.00 46.02 46.29 2x17 n GLY 167 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x17 n LEU 168 N -1.29 0.30 0.00 0.99 4.77 0.74 -5.00 117.00 117.51 2x17 n LEU 168 Ca 0.11 -0.22 -0.11 0.00 -0.03 0.00 0.00 56.01 55.76 2x17 n LEU 168 Cb 0.19 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.36 2x17 n LEU 168 CO 0.18 0.07 0.33 0.18 -1.33 0.00 0.00 177.39 176.82 2x17 n LEU 169 N -1.73 0.00 -4.61 2.23 7.99 -1.23 -4.99 117.00 114.67 2x17 n LEU 169 Ca -0.00 -0.68 -0.50 0.00 -0.01 0.00 0.00 56.01 54.81 2x17 n LEU 169 Cb 0.32 -0.38 -0.05 0.00 -0.11 0.00 0.00 43.42 43.20 2x17 n LEU 169 CO 0.31 -0.84 0.95 0.23 -1.51 0.00 0.00 177.39 176.53 2x17 n MET 170 N -2.05 1.38 -4.13 3.23 2.81 -1.26 -4.98 117.12 112.12 2x17 n MET 170 Ca 0.07 0.50 -0.30 0.00 -1.81 0.00 0.00 57.70 56.16 2x17 n MET 170 Cb 0.24 -2.15 -0.08 0.00 -0.71 0.00 0.00 33.22 30.52 2x17 n MET 170 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 2x17 s GLN 171 N 0.46 2.54 0.00 0.03 2.00 -1.26 -5.08 119.66 118.36 2x17 s GLN 171 Ca 0.82 -0.87 0.00 0.00 -2.00 0.00 0.00 55.36 53.31 2x17 s GLN 171 Cb -0.88 -2.52 0.00 0.00 0.80 0.00 0.00 33.01 30.41 2x17 s GLN 171 CO 0.45 0.53 0.00 0.41 -0.50 0.00 0.00 175.29 176.18