#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 3.92 0.40 4.03 1.43 -1.26 -5.06 118.68 122.14 2x17 s LEU 2 Ca 0.00 1.77 -0.22 0.00 -1.03 0.00 0.00 54.13 54.65 2x17 s LEU 2 Cb 0.00 -4.54 -0.11 0.00 0.03 0.00 0.00 46.19 41.58 2x17 s LEU 2 CO 0.00 -0.49 0.94 -0.94 0.23 0.00 0.00 176.35 176.09 2x17 s SER 3 N -2.10 7.04 0.30 2.29 1.04 -1.26 -4.89 113.70 116.11 2x17 s SER 3 Ca 0.63 1.71 0.05 0.00 0.48 0.00 0.00 55.95 58.82 2x17 s SER 3 Cb -0.12 -2.54 0.70 0.00 0.10 0.00 0.00 66.02 64.16 2x17 s SER 3 CO 0.15 -0.27 1.79 -0.08 0.98 0.00 0.00 173.24 175.81 2x17 h GLU 4 N 2.27 0.79 -0.52 4.02 4.81 -1.99 0.60 114.58 124.57 2x17 h GLU 4 Ca -0.48 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 58.59 2x17 h GLU 4 Cb 1.18 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 2x17 h GLU 4 CO 0.62 0.52 -0.09 -0.09 -0.73 0.00 0.00 179.01 179.24 2x17 h ARG 5 N 0.81 0.95 -0.19 1.92 2.43 -2.00 -2.56 114.38 115.74 2x17 h ARG 5 Ca 0.56 -0.33 -0.11 0.00 -0.81 0.00 0.00 59.98 59.29 2x17 h ARG 5 Cb 0.81 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 2x17 h ARG 5 CO -0.35 0.99 -0.32 1.98 -1.51 0.00 0.00 179.97 180.76 2x17 h MET 6 N 0.85 0.55 -1.00 0.20 4.05 -1.52 -2.63 114.93 115.44 2x17 h MET 6 Ca 0.14 -0.34 0.04 0.00 -0.28 0.00 0.00 59.70 59.26 2x17 h MET 6 Cb 0.63 0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 31.41 2x17 h MET 6 CO 0.04 0.95 0.65 1.25 0.23 0.00 0.00 176.91 180.03 2x17 h LEU 7 N 0.21 1.09 -0.61 3.39 5.85 -0.93 0.80 115.31 125.10 2x17 h LEU 7 Ca 0.01 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 2x17 h LEU 7 Cb 0.91 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 2x17 h LEU 7 CO 0.07 0.74 -0.13 0.50 -0.34 0.00 0.00 178.44 179.29 2x17 h LYS 8 N 1.26 0.96 -0.25 1.25 3.64 -1.48 -1.05 116.57 120.91 2x17 h LYS 8 Ca 0.40 -0.36 -0.13 0.00 -1.27 0.00 0.00 60.65 59.29 2x17 h LYS 8 Cb 0.00 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 2x17 h LYS 8 CO -0.12 1.02 -0.38 0.00 -2.27 0.00 0.00 179.45 177.70 2x17 h ALA 9 N 0.99 0.88 -0.19 5.00 0.00 -0.97 -0.67 119.26 124.30 2x17 h ALA 9 Ca 0.13 -0.43 -0.21 0.00 0.00 0.00 0.00 54.91 54.41 2x17 h ALA 9 Cb 0.68 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.36 2x17 h ALA 9 CO 0.05 0.64 -0.70 -0.07 0.00 0.00 0.00 179.25 179.17 2x17 h LEU 10 N 0.47 0.91 -1.20 0.00 3.38 -0.80 -2.11 115.31 115.96 2x17 h LEU 10 Ca 0.04 -0.56 -0.07 0.00 0.09 0.00 0.00 57.88 57.38 2x17 h LEU 10 Cb 0.87 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2x17 h LEU 10 CO 0.07 1.35 -0.26 0.78 0.09 0.00 0.00 178.44 180.48 2x17 h ASN 11 N 0.56 0.23 -0.22 -0.43 2.35 -1.12 -1.86 115.58 115.08 2x17 h ASN 11 Ca -0.03 -0.07 -0.10 0.00 -0.55 0.00 0.00 56.30 55.56 2x17 h ASN 11 Cb 1.31 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 39.62 2x17 h ASN 11 CO 0.14 0.49 -0.25 0.44 -1.65 0.00 0.00 177.43 176.61 2x17 h ASP 12 N 0.21 0.59 -0.66 5.81 3.45 -1.04 -2.49 116.42 122.29 2x17 h ASP 12 Ca 0.03 -0.49 -0.08 0.00 0.43 0.00 0.00 57.03 56.92 2x17 h ASP 12 Cb 0.57 -0.17 -0.03 0.00 -0.56 0.00 0.00 39.33 39.15 2x17 h ASP 12 CO 0.04 0.97 0.09 -0.61 -1.57 0.00 0.00 179.24 178.16 2x17 h GLN 13 N 0.24 1.11 -0.92 3.56 5.75 -1.31 0.10 115.11 123.63 2x17 h GLN 13 Ca 0.03 -0.30 0.12 0.00 -0.15 0.00 0.00 58.65 58.34 2x17 h GLN 13 Cb 0.81 -0.13 -0.08 0.00 1.07 0.00 0.00 27.48 29.15 2x17 h GLN 13 CO 0.06 1.02 0.55 1.25 -2.65 0.00 0.00 178.83 179.06 2x17 h LEU 14 N 1.03 0.78 -0.57 -2.39 6.46 -1.35 0.24 115.31 119.50 2x17 h LEU 14 Ca 0.20 0.06 -0.13 0.00 -0.12 0.00 0.00 57.88 57.89 2x17 h LEU 14 Cb 0.46 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 40.28 2x17 h LEU 14 CO 0.02 0.41 -0.61 -1.13 -0.62 0.00 0.00 178.44 176.50 2x17 h ASN 15 N 0.86 0.00 -0.15 1.25 -0.73 -0.91 -2.22 115.58 113.68 2x17 h ASN 15 Ca 0.46 0.00 -0.19 0.00 1.87 0.00 0.00 56.30 58.44 2x17 h ASN 15 Cb 0.48 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.07 2x17 h ASN 15 CO -0.28 0.61 -0.61 0.03 -0.37 0.00 0.00 177.43 176.81 2x17 h ARG 16 N 0.00 0.76 -0.49 6.67 3.08 0.41 -2.45 114.38 122.37 2x17 h ARG 16 Ca -0.01 -0.52 -0.11 0.00 0.07 0.00 0.00 59.98 59.41 2x17 h ARG 16 Cb 1.21 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.32 2x17 h ARG 16 CO 0.08 1.15 -0.13 0.93 -1.07 0.00 0.00 179.97 180.93 2x17 h GLU 17 N 0.57 0.92 -0.28 0.04 4.39 -0.54 -1.68 114.58 118.00 2x17 h GLU 17 Ca -0.01 -0.34 -0.08 0.00 0.34 0.00 0.00 59.36 59.28 2x17 h GLU 17 Cb 1.21 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.79 2x17 h GLU 17 CO 0.13 0.99 -0.17 -0.07 -1.16 0.00 0.00 179.01 178.73 2x17 h LEU 18 N 0.81 0.48 -0.40 1.33 3.38 -1.41 -2.60 115.31 116.91 2x17 h LEU 18 Ca 0.13 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2x17 h LEU 18 Cb 0.67 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2x17 h LEU 18 CO 0.05 0.67 -0.25 0.22 0.09 0.00 0.00 178.44 179.21 2x17 h TYR 19 N 0.44 1.02 -0.66 1.13 3.20 -1.23 -2.64 116.97 118.23 2x17 h TYR 19 Ca 0.08 -0.27 0.10 0.00 3.14 0.00 0.00 58.73 61.78 2x17 h TYR 19 Cb 0.55 -0.23 -0.08 0.00 1.54 0.00 0.00 36.73 38.52 2x17 h TYR 19 CO 0.02 1.06 0.28 0.77 -1.64 0.00 0.00 178.16 178.64 2x17 h SER 20 N 0.68 0.30 -0.59 -2.11 0.02 -1.06 0.67 113.55 111.47 2x17 h SER 20 Ca 0.08 0.08 0.03 0.00 -0.84 0.00 0.00 61.79 61.14 2x17 h SER 20 Cb 0.83 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.37 2x17 h SER 20 CO 0.07 0.17 0.35 0.00 -1.14 0.00 0.00 176.83 176.28 2x17 h ALA 21 N 1.44 0.76 -0.03 3.77 0.00 -1.43 -0.98 119.26 122.80 2x17 h ALA 21 Ca 0.34 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.11 2x17 h ALA 21 Cb 0.41 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2x17 h ALA 21 CO -0.31 0.08 -0.57 -0.92 0.00 0.00 0.00 179.25 177.53 2x17 h TYR 22 N 0.70 0.13 -0.20 0.00 -0.00 -0.75 -1.25 116.97 115.59 2x17 h TYR 22 Ca 0.24 -0.05 -0.11 0.00 -0.00 0.00 0.00 58.73 58.81 2x17 h TYR 22 Cb 0.03 -0.02 -0.00 0.00 -0.00 0.00 0.00 36.73 36.74 2x17 h TYR 22 CO -0.06 0.65 -0.29 1.25 -0.00 0.00 0.00 178.16 179.71 2x17 h LEU 23 N 0.08 0.61 -1.08 2.82 5.85 0.57 -1.62 115.31 122.54 2x17 h LEU 23 Ca -0.00 -0.51 -0.05 0.00 0.84 0.00 0.00 57.88 58.15 2x17 h LEU 23 Cb 1.03 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 2x17 h LEU 23 CO 0.08 1.01 -0.24 1.88 -0.34 0.00 0.00 178.44 180.83 2x17 h TYR 24 N 0.23 0.00 0.00 1.25 0.05 -1.14 -1.03 116.97 116.34 2x17 h TYR 24 Ca 0.02 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.69 2x17 h TYR 24 Cb 0.87 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.59 2x17 h TYR 24 CO 0.09 0.24 -0.55 0.35 -1.05 0.00 0.00 178.16 177.24 2x17 h PHE 25 N 0.00 0.00 -0.08 4.88 -0.00 -1.15 -1.43 116.94 119.16 2x17 h PHE 25 Ca -0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.97 57.72 2x17 h PHE 25 Cb 0.77 0.00 0.02 0.00 -0.00 0.00 0.00 35.95 36.73 2x17 h PHE 25 CO 0.00 0.55 -0.91 0.00 -0.00 0.00 0.00 178.31 177.95 2x17 h ALA 26 N 1.45 0.23 -0.63 2.41 0.00 -0.53 -2.69 119.26 119.51 2x17 h ALA 26 Ca -0.01 -0.65 -0.08 0.00 0.00 0.00 0.00 54.91 54.18 2x17 h ALA 26 Cb 1.10 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 2x17 h ALA 26 CO 0.07 0.69 0.08 0.52 0.00 0.00 0.00 179.25 180.61 2x17 h MET 27 N 0.47 1.04 -0.85 0.00 2.86 -1.20 -2.31 114.93 114.94 2x17 h MET 27 Ca -0.09 -0.28 0.06 0.00 -2.06 0.00 0.00 59.70 57.33 2x17 h MET 27 Cb 1.55 -0.12 -0.06 0.00 0.06 0.00 0.00 31.60 33.03 2x17 h MET 27 CO 0.18 0.97 0.53 0.00 1.06 0.00 0.00 176.91 179.65 2x17 h ALA 28 N 1.11 1.16 -0.71 6.32 0.00 -1.26 -0.08 119.26 125.80 2x17 h ALA 28 Ca 0.19 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 2x17 h ALA 28 Cb 0.44 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2x17 h ALA 28 CO 0.01 0.29 0.20 0.00 0.00 0.00 0.00 179.25 179.75 2x17 h ALA 29 N 1.39 1.01 -0.28 0.00 0.00 -1.22 -1.16 119.26 119.00 2x17 h ALA 29 Ca 0.37 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 2x17 h ALA 29 Cb 0.14 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2x17 h ALA 29 CO -0.16 0.65 0.03 -0.92 0.00 0.00 0.00 179.25 178.85 2x17 h TYR 30 N 1.06 0.51 -0.33 0.00 3.20 -0.80 -2.47 116.97 118.14 2x17 h TYR 30 Ca 0.23 -0.08 -0.11 0.00 3.14 0.00 0.00 58.73 61.91 2x17 h TYR 30 Cb 0.33 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 2x17 h TYR 30 CO 0.03 0.59 -0.23 0.74 -1.64 0.00 0.00 178.16 177.65 2x17 h PHE 31 N 0.28 0.74 -0.39 -3.82 0.04 -0.97 -2.79 116.94 110.03 2x17 h PHE 31 Ca 0.08 -0.16 -0.02 0.00 2.80 0.00 0.00 57.97 60.67 2x17 h PHE 31 Cb 0.37 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.32 2x17 h PHE 31 CO 0.03 0.83 0.14 1.49 -0.60 0.00 0.00 178.31 180.19 2x17 h GLU 32 N 0.57 0.56 -0.52 1.51 4.57 -1.15 -1.02 114.58 119.10 2x17 h GLU 32 Ca 0.08 -0.08 -0.08 0.00 -1.18 0.00 0.00 59.36 58.10 2x17 h GLU 32 Cb 0.70 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 2x17 h GLU 32 CO 0.05 0.48 -0.01 0.22 -1.18 0.00 0.00 179.01 178.57 2x17 h ASP 33 N 0.55 0.86 0.50 1.04 3.58 -1.17 -2.59 116.42 119.19 2x17 h ASP 33 Ca 0.13 -0.23 0.00 0.00 0.42 0.00 0.00 57.03 57.36 2x17 h ASP 33 Cb 0.14 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 40.97 2x17 h ASP 33 CO -0.01 0.93 0.00 0.18 -2.88 0.00 0.00 179.24 177.46 2x17 n LEU 34 N -4.19 0.00 0.00 2.28 4.77 -0.99 -4.89 117.00 113.97 2x17 n LEU 34 Ca 0.03 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 2x17 n LEU 34 Cb 0.32 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2x17 n LEU 34 CO 0.43 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 2x17 n GLY 35 N 1.10 0.47 3.28 -0.72 0.00 -0.97 -5.00 105.19 103.34 2x17 n GLY 35 Ca 0.14 -0.95 -0.44 0.00 0.00 0.00 0.00 46.02 44.77 2x17 n GLY 35 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x17 n LEU 36 N 0.00 5.57 0.19 0.99 4.77 -0.42 -4.87 117.00 123.22 2x17 n LEU 36 Ca 0.00 -5.07 0.03 0.00 -0.03 0.00 0.00 56.01 50.94 2x17 n LEU 36 Cb 0.06 -1.43 0.40 0.00 -2.33 0.00 0.00 43.42 40.12 2x17 n LEU 36 CO 0.00 1.41 0.80 -0.33 -1.33 0.00 0.00 177.39 177.93 2x17 h GLU 37 N 6.45 0.04 -0.42 3.23 5.08 -1.90 -1.92 114.58 125.13 2x17 h GLU 37 Ca 0.18 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.48 2x17 h GLU 37 Cb 0.83 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 2x17 h GLU 37 CO 1.05 0.32 0.07 0.78 -1.00 0.00 0.00 179.01 180.23 2x17 h GLY 38 N 0.89 0.76 1.04 -3.84 0.00 -1.90 0.17 103.07 100.19 2x17 h GLY 38 Ca 0.00 -0.50 -0.07 0.00 0.00 0.00 0.00 47.33 46.76 2x17 h GLY 38 CO 0.04 0.47 0.09 0.74 0.00 0.00 0.00 176.54 177.88 2x17 h PHE 39 N 0.56 1.09 -0.42 5.60 -1.00 -1.71 -1.54 116.94 119.52 2x17 h PHE 39 Ca 0.13 -0.15 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 2x17 h PHE 39 Cb 0.38 -0.30 -0.02 0.00 3.61 0.00 0.00 35.95 39.62 2x17 h PHE 39 CO 0.03 0.93 0.16 0.00 -1.61 0.00 0.00 178.31 177.82 2x17 h ALA 40 N 1.02 0.54 -0.15 2.45 0.00 -1.11 -1.16 119.26 120.86 2x17 h ALA 40 Ca 0.19 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2x17 h ALA 40 Cb 0.44 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2x17 h ALA 40 CO 0.01 0.15 -0.37 -0.91 0.00 0.00 0.00 179.25 178.14 2x17 h ASN 41 N 0.53 0.33 -0.51 0.00 2.35 -0.66 -1.62 115.58 116.00 2x17 h ASN 41 Ca 0.14 -0.13 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 2x17 h ASN 41 Cb 0.20 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 2x17 h ASN 41 CO -0.01 0.67 0.18 -0.25 -1.65 0.00 0.00 177.43 176.37 2x17 h TRP 42 N 0.27 0.80 -0.28 1.19 7.01 -1.03 -2.26 115.95 121.64 2x17 h TRP 42 Ca 0.03 -0.07 -0.15 0.00 2.11 0.00 0.00 58.89 60.81 2x17 h TRP 42 Cb 0.78 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 27.60 2x17 h TRP 42 CO 0.02 0.68 -0.43 0.52 -2.79 0.00 0.00 178.44 176.43 2x17 h MET 43 N 0.68 0.71 -0.53 2.65 2.86 -1.02 -1.57 114.93 118.71 2x17 h MET 43 Ca 0.17 -0.39 -0.04 0.00 -2.06 0.00 0.00 59.70 57.38 2x17 h MET 43 Cb 0.24 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 2x17 h MET 43 CO -0.01 1.00 0.19 0.87 1.06 0.00 0.00 176.91 180.02 2x17 h LYS 44 N 0.58 0.82 -0.21 1.72 1.57 -1.28 0.28 116.57 120.05 2x17 h LYS 44 Ca 0.04 -0.16 -0.07 0.00 -1.87 0.00 0.00 60.65 58.58 2x17 h LYS 44 Cb 0.98 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 2x17 h LYS 44 CO 0.09 0.74 -0.19 0.00 -0.57 0.00 0.00 179.45 179.52 2x17 h ALA 45 N 1.04 1.29 -0.10 3.86 0.00 -1.34 -1.21 119.26 122.81 2x17 h ALA 45 Ca 0.17 -0.28 -0.19 0.00 0.00 0.00 0.00 54.91 54.61 2x17 h ALA 45 Cb 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2x17 h ALA 45 CO -0.01 0.47 -0.73 0.37 0.00 0.00 0.00 179.25 179.36 2x17 h GLN 46 N 0.33 0.50 -0.73 0.00 5.75 -0.96 -2.97 115.11 117.03 2x17 h GLN 46 Ca 0.06 -0.40 -0.04 0.00 -0.15 0.00 0.00 58.65 58.12 2x17 h GLN 46 Cb 0.53 0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.13 2x17 h GLN 46 CO 0.04 1.03 0.32 0.00 -2.65 0.00 0.00 178.83 177.57 2x17 h ALA 47 N 0.85 0.95 -0.89 3.38 0.00 0.00 -2.66 119.26 120.90 2x17 h ALA 47 Ca -0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2x17 h ALA 47 Cb 1.31 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 2x17 h ALA 47 CO 0.13 0.55 0.50 0.93 0.00 0.00 0.00 179.25 181.36 2x17 h GLU 48 N 1.04 1.23 -0.67 0.00 5.08 -1.24 -2.77 114.58 117.25 2x17 h GLU 48 Ca 0.25 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2x17 h GLU 48 Cb 0.17 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 2x17 h GLU 48 CO -0.02 0.89 0.33 0.93 -1.00 0.00 0.00 179.01 180.14 2x17 h GLU 49 N 1.24 0.95 -0.40 2.33 4.39 -1.31 -2.31 114.58 119.46 2x17 h GLU 49 Ca 0.31 -0.12 -0.11 0.00 0.34 0.00 0.00 59.36 59.78 2x17 h GLU 49 Cb 0.01 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.47 2x17 h GLU 49 CO -0.05 0.73 -0.21 0.93 -1.16 0.00 0.00 179.01 179.25 2x17 h GLU 50 N 0.95 0.79 -0.90 2.33 4.39 -1.22 -1.61 114.58 119.31 2x17 h GLU 50 Ca 0.23 -0.31 0.01 0.00 0.34 0.00 0.00 59.36 59.63 2x17 h GLU 50 Cb 0.09 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.65 2x17 h GLU 50 CO -0.03 0.93 0.58 0.82 -1.16 0.00 0.00 179.01 180.15 2x17 h ILE 51 N 0.70 1.23 -0.77 3.13 2.04 -1.29 -0.62 117.51 121.93 2x17 h ILE 51 Ca 0.10 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 2x17 h ILE 51 Cb 0.72 -0.08 -0.04 0.00 -0.74 0.00 0.00 36.82 36.69 2x17 h ILE 51 CO 0.06 0.23 0.45 1.23 0.00 0.00 0.00 178.15 180.11 2x17 h GLY 52 N 1.22 1.13 1.50 5.37 0.00 -0.85 -0.43 103.07 111.00 2x17 h GLY 52 Ca 0.33 -0.48 -0.11 0.00 0.00 0.00 0.00 47.33 47.07 2x17 h GLY 52 CO -0.07 0.47 -0.26 0.45 0.00 0.00 0.00 176.54 177.13 2x17 h HIS 53 N 1.05 0.65 -0.59 5.60 3.86 -0.85 -2.61 115.15 122.26 2x17 h HIS 53 Ca 0.27 -0.15 -0.10 0.00 -1.16 0.00 0.00 60.37 59.24 2x17 h HIS 53 Cb -0.01 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.28 2x17 h HIS 53 CO -0.00 0.78 -0.01 0.00 0.86 0.00 0.00 177.93 179.56 2x17 h ALA 54 N 1.22 0.86 0.00 2.45 0.00 -0.70 -2.68 119.26 120.41 2x17 h ALA 54 Ca 0.07 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2x17 h ALA 54 Cb 0.71 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2x17 h ALA 54 CO 0.05 0.66 -0.15 -0.07 0.00 0.00 0.00 179.25 179.75 2x17 h LEU 55 N 0.95 0.00 -0.46 0.00 3.38 -0.93 -2.47 115.31 115.78 2x17 h LEU 55 Ca 0.17 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.96 2x17 h LEU 55 Cb 0.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2x17 h LEU 55 CO 0.03 0.15 -0.67 0.03 0.09 0.00 0.00 178.44 178.07 2x17 h ARG 56 N 0.00 0.42 -0.27 1.13 3.08 -1.12 -0.42 114.38 117.20 2x17 h ARG 56 Ca -0.00 -0.31 -0.14 0.00 0.07 0.00 0.00 59.98 59.59 2x17 h ARG 56 Cb 0.49 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 2x17 h ARG 56 CO 0.02 0.94 -0.39 0.74 -1.07 0.00 0.00 179.97 180.21 2x17 h PHE 57 N 0.30 0.92 -0.43 3.04 0.04 -1.42 -1.86 116.94 117.53 2x17 h PHE 57 Ca -0.02 -0.31 0.07 0.00 2.80 0.00 0.00 57.97 60.52 2x17 h PHE 57 Cb 1.23 -0.18 -0.06 0.00 2.20 0.00 0.00 35.95 39.14 2x17 h PHE 57 CO 0.04 1.09 0.04 -0.92 -0.60 0.00 0.00 178.31 177.96 2x17 h TYR 58 N 0.49 0.05 -0.57 -0.55 5.03 -1.36 0.22 116.97 120.29 2x17 h TYR 58 Ca 0.03 0.03 -0.08 0.00 2.58 0.00 0.00 58.73 61.29 2x17 h TYR 58 Cb 0.99 0.04 -0.02 0.00 1.55 0.00 0.00 36.73 39.28 2x17 h TYR 58 CO 0.08 -0.04 0.04 -0.91 -1.32 0.00 0.00 178.16 176.00 2x17 h ASN 59 N 0.16 0.91 -0.16 -2.11 2.35 -1.05 -3.12 115.58 112.55 2x17 h ASN 59 Ca 0.21 -0.23 -0.13 0.00 -0.55 0.00 0.00 56.30 55.60 2x17 h ASN 59 Cb 0.29 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.42 2x17 h ASN 59 CO -0.31 0.95 -0.41 0.22 -1.65 0.00 0.00 177.43 176.22 2x17 h TYR 60 N 0.88 0.73 -0.44 1.19 3.20 -0.88 -2.49 116.97 119.17 2x17 h TYR 60 Ca 0.17 -0.28 0.06 0.00 3.14 0.00 0.00 58.73 61.82 2x17 h TYR 60 Cb 0.47 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.55 2x17 h TYR 60 CO 0.03 1.03 0.12 0.82 -1.64 0.00 0.00 178.16 178.52 2x17 h ILE 61 N 0.21 0.80 0.00 1.81 2.04 -1.00 -1.56 117.51 119.82 2x17 h ILE 61 Ca -0.01 -0.09 -0.06 0.00 1.00 0.00 0.00 64.86 65.70 2x17 h ILE 61 Cb 1.02 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 2x17 h ILE 61 CO 0.09 0.05 -0.29 1.88 0.00 0.00 0.00 178.15 179.88 2x17 h TYR 62 N 0.26 0.00 0.00 1.37 0.05 -1.59 0.80 116.97 117.86 2x17 h TYR 62 Ca 0.21 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.94 2x17 h TYR 62 Cb 0.24 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 2x17 h TYR 62 CO -0.19 0.29 -0.27 -0.44 -1.05 0.00 0.00 178.16 176.51 2x17 h ASP 63 N 0.00 0.00 -0.58 3.88 3.32 -0.83 -2.73 116.42 119.48 2x17 h ASP 63 Ca -0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.91 2x17 h ASP 63 Cb 0.78 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.25 2x17 h ASP 63 CO 0.04 0.27 0.14 0.54 -1.72 0.00 0.00 179.24 178.51 2x17 n ARG 64 N -3.68 3.61 -2.24 3.56 5.12 -0.78 -4.94 116.66 117.30 2x17 n ARG 64 Ca -0.01 -3.07 -0.18 0.00 -1.93 0.00 0.00 57.85 52.66 2x17 n ARG 64 Cb 0.38 -2.12 -0.02 0.00 -1.16 0.00 0.00 32.46 29.55 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 -0.18 -5.19 -2.74 0.55 5.15 -1.03 -4.06 115.26 107.76 2x17 n ASN 65 Ca 0.34 0.04 -0.06 0.00 -0.60 0.00 0.00 54.58 54.30 2x17 n ASN 65 Cb 1.23 -4.27 0.03 0.00 -0.53 0.00 0.00 39.78 36.24 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 -0.99 1.04 2.94 8.20 0.00 0.24 -4.94 105.19 111.68 2x17 n GLY 66 Ca -0.21 -2.02 -0.22 0.00 0.00 0.00 0.00 46.02 43.57 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 -3.04 1.16 -0.15 1.61 6.06 -1.26 -4.46 118.95 118.87 2x17 s ARG 67 Ca 0.18 -0.22 -0.23 0.00 -2.50 0.00 0.00 55.73 52.96 2x17 s ARG 67 Cb -0.01 -1.06 -0.02 0.00 0.06 0.00 0.00 34.95 33.92 2x17 s ARG 67 CO 0.12 -0.04 0.72 0.08 -2.50 0.00 0.00 175.30 173.68 2x17 s VAL 68 N 0.83 4.98 -0.17 7.11 1.01 -1.26 -5.01 120.40 127.89 2x17 s VAL 68 Ca -0.12 1.41 0.00 0.00 0.00 0.00 0.00 61.98 63.27 2x17 s VAL 68 Cb -0.15 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.20 2x17 s VAL 68 CO 0.01 0.12 -0.16 -0.70 0.00 0.00 0.00 175.10 174.37 2x17 s GLU 69 N 1.71 3.16 -0.25 2.72 2.12 -1.26 -5.11 118.70 121.79 2x17 s GLU 69 Ca 0.34 -0.77 -0.18 0.00 0.36 0.00 0.00 54.97 54.73 2x17 s GLU 69 Cb -0.17 -2.64 -0.03 0.00 0.26 0.00 0.00 34.13 31.55 2x17 s GLU 69 CO 0.13 -0.08 0.52 -0.51 -0.54 0.00 0.00 175.26 174.78 2x17 s LEU 70 N 1.04 4.07 0.44 2.70 1.43 -1.26 -4.93 118.68 122.16 2x17 s LEU 70 Ca -0.01 0.55 0.01 0.00 -1.03 0.00 0.00 54.13 53.66 2x17 s LEU 70 Cb -0.15 -2.68 -0.00 0.00 0.03 0.00 0.00 46.19 43.40 2x17 s LEU 70 CO -0.04 -0.27 0.64 -1.81 0.23 0.00 0.00 176.35 175.10 2x17 s ASP 71 N 1.47 5.82 0.71 2.29 1.01 -1.26 -5.08 116.67 121.63 2x17 s ASP 71 Ca 0.22 0.19 -0.16 0.00 0.71 0.00 0.00 52.55 53.50 2x17 s ASP 71 Cb -0.16 -1.43 0.02 0.00 1.01 0.00 0.00 42.92 42.36 2x17 s ASP 71 CO 0.09 -0.69 1.22 -1.84 0.21 0.00 0.00 175.17 174.16 2x17 n GLU 72 N -2.03 0.71 -3.75 8.23 0.28 -1.26 -5.01 120.64 117.81 2x17 n GLU 72 Ca 0.02 0.30 -0.37 0.00 -0.16 0.00 0.00 57.16 56.95 2x17 n GLU 72 Cb 0.58 -2.46 -0.12 0.00 1.43 0.00 0.00 31.44 30.87 2x17 n GLU 72 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2x17 s ILE 73 N -1.70 4.07 0.65 3.84 1.01 -1.26 -5.07 121.20 122.74 2x17 s ILE 73 Ca 0.78 -0.59 -0.17 0.00 0.00 0.00 0.00 60.65 60.68 2x17 s ILE 73 Cb -0.35 -3.07 -0.01 0.00 0.01 0.00 0.00 42.46 39.05 2x17 s ILE 73 CO 0.45 0.12 1.18 -2.16 0.00 0.00 0.00 174.94 174.53 2x17 s PRO 74 N 1.53 2.70 0.03 2.79 0.04 -1.26 -4.95 135.00 135.88 2x17 s PRO 74 Ca 0.03 1.69 -0.30 0.00 0.04 0.00 0.00 61.00 62.46 2x17 s PRO 74 Cb -0.17 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.39 2x17 s PRO 74 CO 0.03 -1.39 1.70 0.21 0.04 0.00 0.00 177.00 177.59 2x17 s LYS 75 N -3.68 4.18 0.58 4.56 2.20 -1.26 -5.01 119.74 121.32 2x17 s LYS 75 Ca 0.74 2.33 -0.08 0.00 -0.36 0.00 0.00 55.97 58.59 2x17 s LYS 75 Cb -0.27 -3.79 -0.02 0.00 -1.51 0.00 0.00 37.83 32.23 2x17 s LYS 75 CO 0.38 -0.80 0.94 -1.25 -0.36 0.00 0.00 175.35 174.26 2x17 s PRO 76 N 3.30 3.36 0.28 4.03 0.04 -1.26 -5.02 135.00 139.73 2x17 s PRO 76 Ca 0.76 0.40 -0.30 0.00 0.04 0.00 0.00 61.00 61.89 2x17 s PRO 76 Cb -0.38 -2.20 -0.13 0.00 0.04 0.00 0.00 34.50 31.83 2x17 s PRO 76 CO 0.33 -0.54 1.45 -2.30 0.04 0.00 0.00 177.00 175.98 2x17 n PRO 77 N -2.60 2.29 0.05 0.56 -0.02 -1.26 -4.94 135.00 129.08 2x17 n PRO 77 Ca 0.04 0.81 -0.21 0.00 -2.02 0.00 0.00 63.50 62.12 2x17 n PRO 77 Cb 0.55 -2.50 -0.15 0.00 -0.02 0.00 0.00 33.50 31.39 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 4.03 0.31 -5.27 -0.52 3.64 -1.95 -3.44 116.57 113.37 2x17 h LYS 78 Ca -0.46 -0.53 -0.38 0.00 -1.27 0.00 0.00 60.65 58.02 2x17 h LYS 78 Cb 1.26 0.20 -0.15 0.00 -0.41 0.00 0.00 32.23 33.13 2x17 h LYS 78 CO 0.74 1.25 -0.72 -1.21 -2.27 0.00 0.00 179.45 177.24 2x17 s GLU 79 N -2.46 1.16 0.05 1.90 2.02 -1.26 -4.66 118.70 115.45 2x17 s GLU 79 Ca -0.15 -1.50 0.01 0.00 0.02 0.00 0.00 54.97 53.36 2x17 s GLU 79 Cb 0.02 -0.82 -0.03 0.00 0.10 0.00 0.00 34.13 33.40 2x17 s GLU 79 CO 0.82 0.12 -0.06 -1.58 0.02 0.00 0.00 175.26 174.58 2x17 s TRP 80 N -3.15 0.63 0.22 1.61 0.51 -1.26 -5.08 118.94 112.43 2x17 s TRP 80 Ca 0.19 -0.66 -0.08 0.00 -2.12 0.00 0.00 56.10 53.42 2x17 s TRP 80 Cb 0.01 -0.39 0.19 0.00 -0.81 0.00 0.00 33.47 32.47 2x17 s TRP 80 CO 0.03 -0.15 1.86 0.93 -0.51 0.00 0.00 176.95 179.11 2x17 h GLU 81 N 4.02 1.17 -3.59 4.98 5.08 -2.01 -3.46 114.58 120.77 2x17 h GLU 81 Ca -0.35 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 57.83 2x17 h GLU 81 Cb 1.19 -0.24 -0.13 0.00 0.50 0.00 0.00 28.75 30.07 2x17 h GLU 81 CO 0.49 0.84 -0.19 -1.54 -1.00 0.00 0.00 179.01 177.61 2x17 s SER 82 N -6.12 -0.08 0.40 1.42 1.04 -1.26 -5.00 113.70 104.10 2x17 s SER 82 Ca -0.13 -0.53 0.16 0.00 0.48 0.00 0.00 55.95 55.92 2x17 s SER 82 Cb 0.16 0.44 1.03 0.00 0.10 0.00 0.00 66.02 67.75 2x17 s SER 82 CO 0.81 -0.85 1.85 -0.65 0.98 0.00 0.00 173.24 175.39 2x17 h PRO 83 N 2.49 0.45 -0.16 4.02 0.11 -1.99 0.43 132.00 137.35 2x17 h PRO 83 Ca -0.33 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.75 2x17 h PRO 83 Cb 1.23 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2x17 h PRO 83 CO 0.49 0.30 0.09 1.25 -0.21 0.00 0.00 178.00 179.92 2x17 h LEU 84 N 0.47 0.20 -1.43 2.35 5.85 -1.96 -2.82 115.31 117.97 2x17 h LEU 84 Ca 0.47 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 59.08 2x17 h LEU 84 Cb 1.09 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 2x17 h LEU 84 CO -0.20 0.20 -0.23 0.11 -0.34 0.00 0.00 178.44 177.99 2x17 h LYS 85 N 0.17 0.00 -0.43 1.25 1.79 -1.60 -2.48 116.57 115.28 2x17 h LYS 85 Ca 0.06 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.38 2x17 h LYS 85 Cb 0.04 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.68 2x17 h LYS 85 CO -0.01 0.23 -0.30 0.00 -1.08 0.00 0.00 179.45 178.29 2x17 h ALA 86 N 1.77 0.62 0.00 3.86 0.00 -0.78 -2.78 119.26 121.94 2x17 h ALA 86 Ca -0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 2x17 h ALA 86 Cb 0.59 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2x17 h ALA 86 CO 0.03 0.66 -0.10 0.74 0.00 0.00 0.00 179.25 180.58 2x17 h PHE 87 N 0.80 0.00 -0.35 0.00 0.04 -1.33 -2.79 116.94 113.31 2x17 h PHE 87 Ca 0.08 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.73 2x17 h PHE 87 Cb 0.88 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.02 2x17 h PHE 87 CO 0.06 0.10 -0.29 0.93 -0.60 0.00 0.00 178.31 178.52 2x17 h GLU 88 N 0.00 0.74 0.00 1.51 5.08 -1.35 -1.64 114.58 118.92 2x17 h GLU 88 Ca -0.00 -0.32 -0.13 0.00 -1.00 0.00 0.00 59.36 57.91 2x17 h GLU 88 Cb 1.02 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 2x17 h GLU 88 CO 0.01 0.93 -0.61 0.00 -1.00 0.00 0.00 179.01 178.35 2x17 h ALA 89 N 1.05 0.82 -0.24 3.43 0.00 -1.45 -2.61 119.26 120.25 2x17 h ALA 89 Ca 0.08 -0.55 -0.15 0.00 0.00 0.00 0.00 54.91 54.28 2x17 h ALA 89 Cb 0.80 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2x17 h ALA 89 CO 0.07 0.76 -0.44 0.00 0.00 0.00 0.00 179.25 179.64 2x17 h ALA 90 N 1.39 0.38 -0.23 0.00 0.00 -1.32 -1.34 119.26 118.13 2x17 h ALA 90 Ca -0.01 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 2x17 h ALA 90 Cb 1.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2x17 h ALA 90 CO 0.08 0.51 -0.28 -0.92 0.00 0.00 0.00 179.25 178.64 2x17 h TYR 91 N 0.45 0.52 -0.51 0.00 3.20 -1.32 0.92 116.97 120.23 2x17 h TYR 91 Ca 0.01 -0.12 -0.11 0.00 3.14 0.00 0.00 58.73 61.65 2x17 h TYR 91 Cb 1.04 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 2x17 h TYR 91 CO 0.08 0.70 -0.12 1.49 -1.64 0.00 0.00 178.16 178.67 2x17 h GLU 92 N 0.40 0.99 -0.28 1.82 4.81 -1.44 -2.15 114.58 118.73 2x17 h GLU 92 Ca 0.06 -0.38 -0.14 0.00 -0.13 0.00 0.00 59.36 58.77 2x17 h GLU 92 Cb 0.70 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 2x17 h GLU 92 CO 0.05 1.06 -0.39 1.25 -0.73 0.00 0.00 179.01 180.25 2x17 h HIS 93 N 0.86 0.78 -0.10 0.92 2.76 -0.90 -1.55 115.15 117.93 2x17 h HIS 93 Ca 0.13 -0.23 -0.09 0.00 -2.20 0.00 0.00 60.37 57.99 2x17 h HIS 93 Cb 0.69 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.47 2x17 h HIS 93 CO 0.05 0.95 -0.33 0.93 -1.30 0.00 0.00 177.93 178.23 2x17 h GLU 94 N 0.54 0.19 -0.01 5.26 4.39 -0.76 -0.08 114.58 124.12 2x17 h GLU 94 Ca 0.05 -0.07 -0.15 0.00 0.34 0.00 0.00 59.36 59.53 2x17 h GLU 94 Cb 0.91 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.53 2x17 h GLU 94 CO 0.08 0.50 -0.70 0.87 -1.16 0.00 0.00 179.01 178.60 2x17 h LYS 95 N 0.16 0.05 -0.40 2.33 1.57 -1.24 -1.70 116.57 117.33 2x17 h LYS 95 Ca 0.02 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 2x17 h LYS 95 Cb 0.66 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 2x17 h LYS 95 CO 0.05 0.73 -0.12 0.35 -0.57 0.00 0.00 179.45 179.88 2x17 h PHE 96 N 0.03 0.89 -0.21 -1.35 3.57 -0.63 -1.82 116.94 117.43 2x17 h PHE 96 Ca -0.01 -0.20 -0.05 0.00 3.53 0.00 0.00 57.97 61.24 2x17 h PHE 96 Cb 1.24 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.76 2x17 h PHE 96 CO 0.01 0.92 -0.08 0.82 -2.23 0.00 0.00 178.31 177.75 2x17 h ILE 97 N 0.59 1.30 -1.00 1.41 1.08 -1.03 -2.50 117.51 117.35 2x17 h ILE 97 Ca 0.10 -1.11 0.07 0.00 -0.39 0.00 0.00 64.86 63.53 2x17 h ILE 97 Cb 0.65 1.59 -0.07 0.00 -3.07 0.00 0.00 36.82 35.93 2x17 h ILE 97 CO 0.04 0.34 0.65 0.28 -0.69 0.00 0.00 178.15 178.77 2x17 h SER 98 N 0.13 1.02 -0.54 1.72 0.02 -1.32 -1.21 113.55 113.37 2x17 h SER 98 Ca 0.05 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.90 2x17 h SER 98 Cb 0.55 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 2x17 h SER 98 CO 0.03 0.64 -0.11 0.50 -1.14 0.00 0.00 176.83 176.74 2x17 h LYS 99 N 1.15 1.03 0.00 3.45 3.64 -1.27 -1.24 116.57 123.33 2x17 h LYS 99 Ca 0.44 -0.39 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 2x17 h LYS 99 Cb 0.21 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2x17 h LYS 99 CO -0.18 1.08 -0.14 0.66 -2.27 0.00 0.00 179.45 178.60 2x17 h SER 100 N 0.92 0.00 -0.04 4.20 4.64 -0.95 -1.83 113.55 120.49 2x17 h SER 100 Ca 0.14 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.29 2x17 h SER 100 Cb 0.69 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.79 2x17 h SER 100 CO 0.05 0.14 -0.63 0.40 -0.87 0.00 0.00 176.83 175.91 2x17 h ILE 101 N 0.00 1.39 -0.94 0.95 1.08 -0.89 -2.91 117.51 116.19 2x17 h ILE 101 Ca -0.00 -2.02 0.04 0.00 -0.39 0.00 0.00 64.86 62.49 2x17 h ILE 101 Cb 0.61 2.43 -0.06 0.00 -3.07 0.00 0.00 36.82 36.73 2x17 h ILE 101 CO 0.02 0.60 0.60 1.88 -0.69 0.00 0.00 178.15 180.56 2x17 h TYR 102 N 0.04 1.13 -0.41 1.37 0.05 -0.84 -1.29 116.97 117.03 2x17 h TYR 102 Ca -0.07 0.03 -0.15 0.00 0.05 0.00 0.00 58.73 58.59 2x17 h TYR 102 Cb 1.32 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 38.68 2x17 h TYR 102 CO 0.13 0.63 -0.34 0.93 -1.05 0.00 0.00 178.16 178.46 2x17 h GLU 103 N 1.15 0.95 -0.74 4.88 5.08 -1.43 -0.67 114.58 123.80 2x17 h GLU 103 Ca 0.38 -0.47 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 2x17 h GLU 103 Cb 0.05 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2x17 h GLU 103 CO -0.14 1.13 0.34 -0.07 -1.00 0.00 0.00 179.01 179.28 2x17 h LEU 104 N 0.77 0.97 -0.73 1.33 3.38 -1.28 0.38 115.31 120.12 2x17 h LEU 104 Ca 0.07 -0.12 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 2x17 h LEU 104 Cb 0.93 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2x17 h LEU 104 CO 0.09 0.83 -0.34 0.00 0.09 0.00 0.00 178.44 179.11 2x17 h ALA 105 N 1.32 0.91 -0.17 1.53 0.00 -1.06 -1.99 119.26 119.80 2x17 h ALA 105 Ca 0.26 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.62 2x17 h ALA 105 Cb 0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2x17 h ALA 105 CO -0.03 0.62 -0.49 0.00 0.00 0.00 0.00 179.25 179.36 2x17 h ALA 106 N 1.14 0.85 -0.24 0.00 0.00 -0.76 -2.28 119.26 117.96 2x17 h ALA 106 Ca 0.05 -0.48 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 2x17 h ALA 106 Cb 0.82 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2x17 h ALA 106 CO 0.07 0.66 -0.34 1.25 0.00 0.00 0.00 179.25 180.90 2x17 h LEU 107 N 0.36 0.54 -0.33 0.00 5.85 -0.78 -2.49 115.31 118.45 2x17 h LEU 107 Ca 0.02 -0.21 -0.20 0.00 0.84 0.00 0.00 57.88 58.33 2x17 h LEU 107 Cb 0.99 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.86 2x17 h LEU 107 CO 0.09 0.84 -0.77 0.00 -0.34 0.00 0.00 178.44 178.25 2x17 h ALA 108 N 1.20 0.52 -0.16 1.25 0.00 -1.27 -1.88 119.26 118.92 2x17 h ALA 108 Ca 0.05 -0.62 -0.12 0.00 0.00 0.00 0.00 54.91 54.22 2x17 h ALA 108 Cb 0.80 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2x17 h ALA 108 CO 0.07 0.76 -0.43 0.93 0.00 0.00 0.00 179.25 180.58 2x17 h GLU 109 N 0.31 0.36 -0.07 0.00 5.08 -1.38 0.51 114.58 119.40 2x17 h GLU 109 Ca -0.04 -0.18 -0.14 0.00 -1.00 0.00 0.00 59.36 57.99 2x17 h GLU 109 Cb 1.36 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.63 2x17 h GLU 109 CO 0.14 0.73 -0.52 1.49 -1.00 0.00 0.00 179.01 179.85 2x17 h GLU 110 N 0.30 0.47 0.00 2.33 4.81 -1.42 -3.16 114.58 117.91 2x17 h GLU 110 Ca 0.02 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 2x17 h GLU 110 Cb 0.88 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.35 2x17 h GLU 110 CO 0.07 1.06 0.00 0.39 -0.73 0.00 0.00 179.01 179.80 2x17 n GLU 111 N -4.24 0.55 -3.08 1.92 1.02 -0.71 -4.90 120.64 111.20 2x17 n GLU 111 Ca -0.09 0.03 -0.23 0.00 -0.02 0.00 0.00 57.16 56.86 2x17 n GLU 111 Cb 0.61 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.56 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 -1.17 -4.68 -3.17 3.49 5.02 -0.77 -4.94 118.16 111.93 2x17 n LYS 112 Ca 0.15 0.84 -0.45 0.00 -2.02 0.00 0.00 58.31 56.83 2x17 n LYS 112 Cb 0.15 -5.68 -0.01 0.00 -0.02 0.00 0.00 35.03 29.47 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 -2.71 7.02 0.36 4.39 2.15 0.10 -4.89 116.67 123.10 2x17 s ASP 113 Ca 0.32 -2.98 0.04 0.00 0.43 0.00 0.00 52.55 50.36 2x17 s ASP 113 Cb -0.15 -2.29 0.68 0.00 -0.30 0.00 0.00 42.92 40.86 2x17 s ASP 113 CO 0.40 -0.59 1.98 1.88 -0.17 0.00 0.00 175.17 178.66 2x17 h TYR 114 N 7.40 0.65 -0.53 -5.34 -1.99 -1.92 -2.53 116.97 112.71 2x17 h TYR 114 Ca 0.19 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.91 2x17 h TYR 114 Cb 0.94 -0.21 -0.03 0.00 2.00 0.00 0.00 36.73 39.43 2x17 h TYR 114 CO 0.98 0.47 0.33 0.77 -0.00 0.00 0.00 178.16 180.71 2x17 h SER 115 N 0.67 0.62 0.11 3.88 0.02 -1.96 0.19 113.55 117.08 2x17 h SER 115 Ca 0.17 -0.04 -0.18 0.00 -0.84 0.00 0.00 61.79 60.90 2x17 h SER 115 Cb 0.05 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 2x17 h SER 115 CO -0.03 0.48 -0.66 0.74 -1.14 0.00 0.00 176.83 176.23 2x17 h THR 116 N 0.71 1.34 -0.67 -2.27 2.02 -1.92 -1.87 112.91 110.24 2x17 h THR 116 Ca 0.19 -1.97 -0.08 0.00 0.77 0.00 0.00 66.41 65.32 2x17 h THR 116 Cb -0.04 1.94 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 2x17 h THR 116 CO -0.04 0.60 0.10 -0.09 0.37 0.00 0.00 175.52 176.46 2x17 h ARG 117 N 0.37 1.12 -0.09 6.66 9.65 -1.18 -0.91 114.38 130.02 2x17 h ARG 117 Ca -0.02 -0.31 -0.11 0.00 -1.10 0.00 0.00 59.98 58.45 2x17 h ARG 117 Cb 1.22 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.66 2x17 h ARG 117 CO 0.12 1.03 -0.44 0.00 2.80 0.00 0.00 179.97 183.48 2x17 h ALA 118 N 1.05 1.10 -0.36 2.80 0.00 -0.59 -2.85 119.26 120.40 2x17 h ALA 118 Ca 0.20 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.52 2x17 h ALA 118 Cb 0.46 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2x17 h ALA 118 CO 0.02 0.60 -0.40 0.35 0.00 0.00 0.00 179.25 179.82 2x17 h PHE 119 N 0.16 1.06 0.00 0.00 3.57 -1.01 -3.18 116.94 117.54 2x17 h PHE 119 Ca 0.01 -0.32 -0.00 0.00 3.53 0.00 0.00 57.97 61.19 2x17 h PHE 119 Cb 0.85 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.37 2x17 h PHE 119 CO 0.01 1.14 -0.01 -0.07 -2.23 0.00 0.00 178.31 177.15 2x17 h LEU 120 N 0.72 0.00 -1.67 0.59 3.38 -1.10 -3.16 115.31 114.08 2x17 h LEU 120 Ca 0.05 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.18 2x17 h LEU 120 Cb 0.99 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 2x17 h LEU 120 CO 0.10 0.01 0.50 -0.08 0.09 0.00 0.00 178.44 179.06 2x17 h GLU 121 N 0.00 0.31 -0.60 1.13 4.57 -1.48 0.19 114.58 118.70 2x17 h GLU 121 Ca -0.00 -0.02 -0.07 0.00 -1.18 0.00 0.00 59.36 58.10 2x17 h GLU 121 Cb 0.71 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.21 2x17 h GLU 121 CO 0.00 0.21 0.11 2.35 -1.18 0.00 0.00 179.01 180.50 2x17 h TRP 122 N 0.32 1.00 0.02 0.92 7.01 -1.73 -2.93 115.95 120.57 2x17 h TRP 122 Ca 0.36 -0.12 -0.21 0.00 2.11 0.00 0.00 58.89 61.03 2x17 h TRP 122 Cb 0.95 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 27.71 2x17 h TRP 122 CO -0.00 0.85 -0.96 0.74 -2.79 0.00 0.00 178.44 176.28 2x17 h PHE 123 N 0.91 0.21 -0.27 2.65 0.04 -1.18 -1.62 116.94 117.68 2x17 h PHE 123 Ca 0.19 -0.13 -0.00 0.00 2.80 0.00 0.00 57.97 60.82 2x17 h PHE 123 Cb 0.38 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 2x17 h PHE 123 CO 0.02 1.01 0.15 0.82 -0.60 0.00 0.00 178.31 179.72 2x17 h ILE 124 N 0.06 1.12 -0.14 -0.55 2.04 -1.35 -0.32 117.51 118.37 2x17 h ILE 124 Ca -0.05 -0.32 -0.10 0.00 1.00 0.00 0.00 64.86 65.40 2x17 h ILE 124 Cb 1.64 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 38.54 2x17 h ILE 124 CO 0.14 0.12 -0.34 0.78 0.00 0.00 0.00 178.15 178.85 2x17 h ASN 125 N 0.33 0.29 -0.20 1.72 2.35 -1.52 -3.15 115.58 115.39 2x17 h ASN 125 Ca 0.10 -0.11 -0.21 0.00 -0.55 0.00 0.00 56.30 55.53 2x17 h ASN 125 Cb 0.06 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 38.36 2x17 h ASN 125 CO -0.02 0.62 -0.70 -0.08 -1.65 0.00 0.00 177.43 175.60 2x17 h GLU 126 N 0.24 0.83 0.00 0.81 4.22 -1.05 -3.24 114.58 116.40 2x17 h GLU 126 Ca 0.03 -0.62 -0.06 0.00 0.08 0.00 0.00 59.36 58.79 2x17 h GLU 126 Cb 0.72 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 2x17 h GLU 126 CO 0.05 1.24 -0.28 1.96 -2.18 0.00 0.00 179.01 179.81 2x17 h GLN 127 N 0.59 0.00 -0.62 1.92 1.08 -1.06 -1.84 115.11 115.19 2x17 h GLN 127 Ca -0.03 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.15 2x17 h GLN 127 Cb 1.32 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.73 2x17 h GLN 127 CO 0.15 0.28 0.30 0.28 -0.95 0.00 0.00 178.83 178.89 2x17 h VAL 128 N 0.00 1.22 -0.37 -0.54 2.07 -1.57 0.17 116.25 117.22 2x17 h VAL 128 Ca -0.00 -0.61 -0.05 0.00 0.82 0.00 0.00 66.70 66.86 2x17 h VAL 128 Cb 0.65 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 2x17 h VAL 128 CO 0.04 0.25 0.03 -0.33 0.02 0.00 0.00 177.57 177.57 2x17 h GLU 129 N 0.85 0.63 -0.04 1.57 5.08 -1.52 -2.48 114.58 118.67 2x17 h GLU 129 Ca 0.21 -0.19 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2x17 h GLU 129 Cb 0.12 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2x17 h GLU 129 CO -0.03 0.72 -0.02 0.93 -1.00 0.00 0.00 179.01 179.61 2x17 h GLU 130 N 0.46 -0.02 -0.24 2.33 4.39 -1.12 0.17 114.58 120.55 2x17 h GLU 130 Ca 0.11 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 2x17 h GLU 130 Cb 0.42 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2x17 h GLU 130 CO 0.01 -0.01 0.12 0.93 -1.16 0.00 0.00 179.01 178.90 2x17 h GLU 131 N -0.02 0.35 -0.52 2.33 5.08 -1.01 -1.86 114.58 118.93 2x17 h GLU 131 Ca 0.03 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 2x17 h GLU 131 Cb 0.05 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2x17 h GLU 131 CO -0.06 0.34 0.17 0.00 -1.00 0.00 0.00 179.01 178.47 2x17 h ALA 132 N 0.99 1.33 -0.61 3.43 0.00 -1.36 0.90 119.26 123.94 2x17 h ALA 132 Ca 0.08 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2x17 h ALA 132 Cb 0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2x17 h ALA 132 CO -0.01 0.49 0.03 1.03 0.00 0.00 0.00 179.25 180.78 2x17 h SER 133 N 0.75 1.03 0.08 0.00 0.87 -0.72 -1.93 113.55 113.63 2x17 h SER 133 Ca 0.17 -0.29 -0.25 0.00 -1.23 0.00 0.00 61.79 60.19 2x17 h SER 133 Cb 0.21 -0.28 0.02 0.00 -0.44 0.00 0.00 62.40 61.91 2x17 h SER 133 CO -0.01 1.07 -1.03 0.58 -0.53 0.00 0.00 176.83 176.92 2x17 h VAL 134 N 0.96 1.34 -0.45 2.23 2.07 -1.06 -3.29 116.25 118.05 2x17 h VAL 134 Ca 0.18 -2.35 -0.03 0.00 0.82 0.00 0.00 66.70 65.31 2x17 h VAL 134 Cb 0.53 2.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.97 2x17 h VAL 134 CO 0.03 0.71 0.15 0.50 0.02 0.00 0.00 177.57 178.97 2x17 h LYS 135 N 0.13 0.65 -0.48 1.57 1.63 -0.83 -1.27 116.57 117.97 2x17 h LYS 135 Ca -0.15 -0.10 0.00 0.00 -0.85 0.00 0.00 60.65 59.55 2x17 h LYS 135 Cb 1.72 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 33.21 2x17 h LYS 135 CO 0.20 0.56 0.31 -0.22 -3.45 0.00 0.00 179.45 176.85 2x17 h LYS 136 N 0.64 0.64 -0.06 1.90 3.64 -1.43 -1.48 116.57 120.42 2x17 h LYS 136 Ca 0.15 -0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.29 2x17 h LYS 136 Cb 0.17 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2x17 h LYS 136 CO -0.01 0.43 -0.81 0.82 -2.27 0.00 0.00 179.45 177.61 2x17 h ILE 137 N 0.65 1.37 -0.30 2.00 2.04 -1.56 -2.95 117.51 118.75 2x17 h ILE 137 Ca 0.17 -2.22 0.03 0.00 1.00 0.00 0.00 64.86 63.84 2x17 h ILE 137 Cb -0.06 2.20 -0.03 0.00 -0.74 0.00 0.00 36.82 38.19 2x17 h ILE 137 CO -0.04 0.67 0.11 0.25 0.00 0.00 0.00 178.15 179.14 2x17 h LEU 138 N 0.30 0.13 -1.29 1.44 6.46 -1.05 -1.42 115.31 119.88 2x17 h LEU 138 Ca -0.05 0.03 -0.05 0.00 -0.12 0.00 0.00 57.88 57.69 2x17 h LEU 138 Cb 1.42 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 41.34 2x17 h LEU 138 CO 0.14 0.11 -0.01 0.44 -0.62 0.00 0.00 178.44 178.51 2x17 h ASP 139 N 0.24 0.44 0.44 1.25 3.32 -1.30 -1.48 116.42 119.33 2x17 h ASP 139 Ca 0.13 -0.08 -0.10 0.00 0.02 0.00 0.00 57.03 57.01 2x17 h ASP 139 Cb 0.09 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2x17 h ASP 139 CO -0.13 0.51 -0.45 0.11 -1.72 0.00 0.00 179.24 177.56 2x17 h LYS 140 N 0.45 0.02 0.00 3.56 1.57 -1.27 -1.08 116.57 119.82 2x17 h LYS 140 Ca 0.10 -0.01 -0.19 0.00 -1.87 0.00 0.00 60.65 58.68 2x17 h LYS 140 Cb 0.31 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 2x17 h LYS 140 CO 0.01 0.47 -0.86 -0.07 -0.57 0.00 0.00 179.45 178.43 2x17 h LEU 141 N 0.02 0.19 -0.89 2.94 3.38 -0.55 -2.62 115.31 117.78 2x17 h LEU 141 Ca -0.00 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 2x17 h LEU 141 Cb 0.81 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2x17 h LEU 141 CO 0.06 0.96 -0.36 0.11 0.09 0.00 0.00 178.44 179.30 2x17 h LYS 142 N 0.08 0.38 0.00 1.13 1.57 -1.10 -2.88 116.57 115.75 2x17 h LYS 142 Ca -0.03 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2x17 h LYS 142 Cb 1.48 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.78 2x17 h LYS 142 CO 0.13 0.69 0.00 0.35 -0.57 0.00 0.00 179.45 180.04 2x17 h PHE 143 N 0.32 0.00 -2.14 -1.35 3.57 -1.08 -3.32 116.94 112.94 2x17 h PHE 143 Ca 0.04 0.00 -0.59 0.00 3.53 0.00 0.00 57.97 60.95 2x17 h PHE 143 Cb 0.78 0.00 -0.41 0.00 2.79 0.00 0.00 35.95 39.11 2x17 h PHE 143 CO 0.02 0.00 -0.74 0.00 -2.23 0.00 0.00 178.31 175.36 2x17 n ALA 144 N -2.08 3.64 0.03 2.41 0.00 -1.00 -4.97 120.51 118.54 2x17 n ALA 144 Ca 0.01 -4.39 -0.01 0.00 0.00 0.00 0.00 53.44 49.04 2x17 n ALA 144 Cb 0.32 -0.87 -0.01 0.00 0.00 0.00 0.00 19.45 18.90 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 4.04 -0.09 -0.63 0.00 1.57 -1.67 -3.37 116.57 116.43 2x17 h LYS 145 Ca 0.16 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2x17 h LYS 145 Cb 0.72 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.05 2x17 h LYS 145 CO 0.73 -0.06 0.00 -0.25 -0.57 0.00 0.00 179.45 179.30 2x17 n ASP 146 N -2.51 3.53 -4.34 0.86 8.00 -1.26 -4.87 116.55 115.96 2x17 n ASP 146 Ca -0.01 -2.10 -0.39 0.00 0.71 0.00 0.00 54.79 53.00 2x17 n ASP 146 Cb 0.04 -0.45 -0.12 0.00 -0.02 0.00 0.00 41.12 40.57 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 -0.95 5.50 0.11 -2.24 0.15 -1.26 -4.93 113.70 110.07 2x17 s SER 147 Ca 0.42 -0.98 0.27 0.00 0.70 0.00 0.00 55.95 56.36 2x17 s SER 147 Cb 0.23 -1.95 0.97 0.00 -1.71 0.00 0.00 66.02 63.56 2x17 s SER 147 CO 0.26 -0.33 1.81 -2.65 1.20 0.00 0.00 173.24 173.54 2x17 n PRO 148 N 4.92 0.14 -0.14 5.44 -0.02 -1.26 -3.48 135.00 140.60 2x17 n PRO 148 Ca -0.12 0.11 -0.11 0.00 -2.02 0.00 0.00 63.50 61.35 2x17 n PRO 148 Cb 0.46 -1.66 -0.01 0.00 -0.02 0.00 0.00 33.50 32.27 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 0.80 0.00 -0.52 7.50 -1.99 -2.42 115.11 118.48 2x17 h GLN 149 Ca 0.00 -0.30 -0.19 0.00 0.50 0.00 0.00 58.65 58.66 2x17 h GLN 149 Cb 0.63 -0.05 -0.03 0.00 0.05 0.00 0.00 27.48 28.08 2x17 h GLN 149 CO 0.00 0.91 -0.95 0.82 -1.50 0.00 0.00 178.83 178.12 2x17 h ILE 150 N 0.62 1.52 -0.27 2.54 2.04 -1.96 -3.03 117.51 118.96 2x17 h ILE 150 Ca 0.11 -3.17 -0.05 0.00 1.00 0.00 0.00 64.86 62.74 2x17 h ILE 150 Cb 0.61 2.75 -0.02 0.00 -0.74 0.00 0.00 36.82 39.42 2x17 h ILE 150 CO 0.04 0.87 -0.07 0.25 0.00 0.00 0.00 178.15 179.24 2x17 h LEU 151 N 0.00 0.41 -0.23 1.44 5.85 -1.58 -0.16 115.31 121.05 2x17 h LEU 151 Ca -0.02 -0.09 -0.13 0.00 0.84 0.00 0.00 57.88 58.48 2x17 h LEU 151 Cb 1.71 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.63 2x17 h LEU 151 CO 0.12 0.53 -0.37 0.15 -0.34 0.00 0.00 178.44 178.52 2x17 h PHE 152 N 0.41 0.81 0.00 1.25 3.57 -1.43 -2.41 116.94 119.14 2x17 h PHE 152 Ca 0.08 -0.28 -0.04 0.00 3.53 0.00 0.00 57.97 61.26 2x17 h PHE 152 Cb 0.38 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 2x17 h PHE 152 CO 0.01 1.03 -0.21 0.52 -2.23 0.00 0.00 178.31 177.43 2x17 h MET 153 N 0.35 0.00 0.02 1.11 2.86 -1.38 -2.81 114.93 115.09 2x17 h MET 153 Ca 0.02 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.44 2x17 h MET 153 Cb 0.96 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 2x17 h MET 153 CO 0.08 0.21 -0.96 -0.07 1.06 0.00 0.00 176.91 177.24 2x17 h LEU 154 N 0.00 0.35 -0.97 1.22 3.38 -1.04 -2.75 115.31 115.50 2x17 h LEU 154 Ca -0.00 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 2x17 h LEU 154 Cb 0.84 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2x17 h LEU 154 CO 0.03 1.13 0.34 -0.78 0.09 0.00 0.00 178.44 179.24 2x17 h ASP 155 N 0.13 0.98 0.04 -0.43 3.58 -1.18 -1.66 116.42 117.89 2x17 h ASP 155 Ca -0.07 -0.12 -0.20 0.00 0.42 0.00 0.00 57.03 57.06 2x17 h ASP 155 Cb 1.61 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 42.41 2x17 h ASP 155 CO 0.15 0.84 -0.75 0.50 -2.88 0.00 0.00 179.24 177.11 2x17 h LYS 156 N 1.07 0.61 -0.65 0.28 3.64 -1.57 -2.85 116.57 117.10 2x17 h LYS 156 Ca 0.26 -0.49 0.01 0.00 -1.27 0.00 0.00 60.65 59.15 2x17 h LYS 156 Cb 0.14 0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 2x17 h LYS 156 CO -0.03 1.11 0.43 0.93 -2.27 0.00 0.00 179.45 179.62 2x17 h GLU 157 N 0.42 0.84 0.00 1.90 5.08 -1.17 -2.81 114.58 118.84 2x17 h GLU 157 Ca -0.04 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2x17 h GLU 157 Cb 1.35 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2x17 h GLU 157 CO 0.14 0.56 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.60 2x17 h LEU 158 N 0.87 0.00 -1.20 1.33 3.38 -1.36 -3.25 115.31 115.07 2x17 h LEU 158 Ca 0.24 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2x17 h LEU 158 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2x17 h LEU 158 CO -0.06 0.01 0.00 0.77 0.09 0.00 0.00 178.44 179.25 2x17 h SER 159 N 0.00 0.00 -0.54 -0.43 4.64 -1.24 -2.71 113.55 113.26 2x17 h SER 159 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x17 h SER 159 Cb 0.76 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.83 2x17 h SER 159 CO 0.00 0.00 0.36 0.00 -0.87 0.00 0.00 176.83 176.32 2x17 h ALA 160 N 2.13 1.61 -2.35 5.18 0.00 -1.67 -3.39 119.26 120.76 2x17 h ALA 160 Ca 0.00 -0.04 -0.59 0.00 0.00 0.00 0.00 54.91 54.27 2x17 h ALA 160 Cb 0.33 -0.22 -0.09 0.00 0.00 0.00 0.00 17.79 17.80 2x17 h ALA 160 CO 0.00 0.36 0.38 0.50 0.00 0.00 0.00 179.25 180.50 2x17 s ARG 161 N -5.63 4.19 0.11 0.00 3.52 -1.02 -5.06 118.95 115.06 2x17 s ARG 161 Ca -0.09 0.87 0.07 0.00 -0.13 0.00 0.00 55.73 56.45 2x17 s ARG 161 Cb 0.18 -3.63 -0.04 0.00 -1.56 0.00 0.00 34.95 29.90 2x17 s ARG 161 CO 0.75 -0.45 -0.19 0.00 -0.81 0.00 0.00 175.30 174.60 2x17 s ALA 162 N 2.62 1.69 0.35 6.12 0.00 -1.26 -3.82 121.76 127.46 2x17 s ALA 162 Ca 0.33 -1.24 -0.28 0.00 0.00 0.00 0.00 51.96 50.77 2x17 s ALA 162 Cb -0.16 -0.19 -0.10 0.00 0.00 0.00 0.00 23.12 22.67 2x17 s ALA 162 CO 0.08 0.28 1.38 -1.25 0.00 0.00 0.00 175.76 176.25 2x17 s PRO 163 N -2.09 4.24 -0.01 0.00 0.04 -1.26 -4.75 135.00 131.18 2x17 s PRO 163 Ca 0.07 2.36 0.19 0.00 0.04 0.00 0.00 61.00 63.65 2x17 s PRO 163 Cb -0.09 -3.02 -0.20 0.00 0.04 0.00 0.00 34.50 31.24 2x17 s PRO 163 CO 0.04 -0.34 0.59 1.63 0.04 0.00 0.00 177.00 178.96 2x17 n LYS 164 N 0.63 0.64 -0.01 4.56 5.02 -1.26 -4.53 118.16 123.21 2x17 n LYS 164 Ca 0.01 0.06 -0.13 0.00 -2.02 0.00 0.00 58.31 56.23 2x17 n LYS 164 Cb 0.41 -1.67 -0.10 0.00 -0.02 0.00 0.00 35.03 33.65 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 -0.01 -0.88 -0.35 5.85 -1.98 -3.37 115.31 114.56 2x17 h LEU 165 Ca -0.20 -0.48 0.23 0.00 0.84 0.00 0.00 57.88 58.28 2x17 h LEU 165 Cb 1.55 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 42.45 2x17 h LEU 165 CO 0.03 0.47 0.30 -0.65 -0.34 0.00 0.00 178.44 178.24 2x17 h PRO 166 N -0.50 0.26 -0.76 5.25 0.11 -1.99 -0.37 132.00 134.00 2x17 h PRO 166 Ca -0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 2x17 h PRO 166 Cb 0.49 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.54 2x17 h PRO 166 CO 0.00 0.17 0.00 0.41 -0.21 0.00 0.00 178.00 178.37 2x17 n GLY 167 N -1.36 1.05 0.00 -0.55 0.00 -1.26 -3.48 105.19 99.59 2x17 n GLY 167 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.05 0.00 -4.82 0.99 4.77 -0.15 -5.07 117.00 112.67 2x17 n LEU 168 Ca 0.02 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.70 2x17 n LEU 168 Cb 0.25 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.43 2x17 n LEU 168 CO 0.02 0.00 0.72 -0.76 -1.33 0.00 0.00 177.39 176.04 2x17 s LEU 169 N -3.43 2.57 0.00 2.23 2.01 -1.23 -5.17 118.68 115.66 2x17 s LEU 169 Ca 0.00 1.22 0.00 0.00 0.01 0.00 0.00 54.13 55.36 2x17 s LEU 169 Cb 0.00 -3.82 0.00 0.00 0.01 0.00 0.00 46.19 42.38 2x17 s LEU 169 CO 0.00 -1.95 0.00 0.80 1.01 0.00 0.00 176.35 176.21