#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 3.81 0.57 3.17 1.43 -1.26 -5.07 118.68 121.33 2x17 s LEU 2 Ca 0.00 1.25 -0.17 0.00 -1.03 0.00 0.00 54.13 54.18 2x17 s LEU 2 Cb 0.00 -4.13 -0.05 0.00 0.03 0.00 0.00 46.19 42.04 2x17 s LEU 2 CO 0.00 -0.42 1.07 -0.94 0.23 0.00 0.00 176.35 176.30 2x17 s SER 3 N -3.02 5.81 0.35 2.29 1.04 -1.26 -4.87 113.70 114.04 2x17 s SER 3 Ca 0.53 1.93 0.12 0.00 0.48 0.00 0.00 55.95 59.01 2x17 s SER 3 Cb -0.10 -2.55 0.92 0.00 0.10 0.00 0.00 66.02 64.39 2x17 s SER 3 CO 0.29 -1.15 1.79 -0.08 0.98 0.00 0.00 173.24 175.07 2x17 h GLU 4 N 0.76 0.56 -0.20 4.02 4.81 -2.00 -1.33 114.58 121.20 2x17 h GLU 4 Ca -0.48 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 58.58 2x17 h GLU 4 Cb 1.23 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2x17 h GLU 4 CO 0.57 0.37 -0.42 -0.09 -0.73 0.00 0.00 179.01 178.71 2x17 h ARG 5 N 0.58 0.64 -0.47 1.92 2.43 -2.00 -2.95 114.38 114.53 2x17 h ARG 5 Ca 0.57 -0.42 -0.06 0.00 -0.81 0.00 0.00 59.98 59.26 2x17 h ARG 5 Cb 1.15 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 2x17 h ARG 5 CO -0.33 1.04 0.05 1.98 -1.51 0.00 0.00 179.97 181.20 2x17 h MET 6 N 0.32 0.80 -0.81 0.20 4.05 -1.69 -1.26 114.93 116.55 2x17 h MET 6 Ca 0.00 -0.23 0.02 0.00 -0.28 0.00 0.00 59.70 59.21 2x17 h MET 6 Cb 1.02 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.69 2x17 h MET 6 CO 0.09 0.83 0.53 1.25 0.23 0.00 0.00 176.91 179.84 2x17 h LEU 7 N 0.66 0.90 -0.73 3.39 5.85 -1.34 0.15 115.31 124.19 2x17 h LEU 7 Ca 0.14 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 2x17 h LEU 7 Cb 0.43 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2x17 h LEU 7 CO 0.01 0.64 -0.26 0.50 -0.34 0.00 0.00 178.44 178.99 2x17 h LYS 8 N 1.06 0.68 -0.28 1.25 3.64 -1.38 -0.87 116.57 120.67 2x17 h LYS 8 Ca 0.31 -0.28 -0.14 0.00 -1.27 0.00 0.00 60.65 59.27 2x17 h LYS 8 Cb -0.06 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2x17 h LYS 8 CO -0.09 0.87 -0.39 0.00 -2.27 0.00 0.00 179.45 177.57 2x17 h ALA 9 N 1.12 0.79 -0.07 5.00 0.00 -0.54 -1.65 119.26 123.90 2x17 h ALA 9 Ca 0.08 -0.44 -0.22 0.00 0.00 0.00 0.00 54.91 54.33 2x17 h ALA 9 Cb 0.75 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2x17 h ALA 9 CO 0.06 0.65 -0.83 -0.07 0.00 0.00 0.00 179.25 179.06 2x17 h LEU 10 N 0.54 0.69 -0.91 0.00 3.38 -0.64 -2.82 115.31 115.55 2x17 h LEU 10 Ca 0.05 -0.48 -0.08 0.00 0.09 0.00 0.00 57.88 57.46 2x17 h LEU 10 Cb 0.92 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 2x17 h LEU 10 CO 0.08 1.26 -0.03 0.78 0.09 0.00 0.00 178.44 180.63 2x17 h ASN 11 N 0.36 0.74 -0.57 -0.43 2.35 -1.12 -1.65 115.58 115.27 2x17 h ASN 11 Ca -0.06 -0.19 -0.10 0.00 -0.55 0.00 0.00 56.30 55.41 2x17 h ASN 11 Cb 1.45 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.60 2x17 h ASN 11 CO 0.15 0.83 -0.02 0.44 -1.65 0.00 0.00 177.43 177.18 2x17 h ASP 12 N 0.72 1.00 -0.02 5.81 3.45 -1.30 -2.05 116.42 124.02 2x17 h ASP 12 Ca 0.14 -0.31 -0.15 0.00 0.43 0.00 0.00 57.03 57.13 2x17 h ASP 12 Cb 0.48 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.97 2x17 h ASP 12 CO 0.02 1.07 -0.48 -0.61 -1.57 0.00 0.00 179.24 177.68 2x17 h GLN 13 N 0.90 0.58 -0.92 3.56 5.75 -1.41 0.49 115.11 124.06 2x17 h GLN 13 Ca 0.16 -0.33 0.08 0.00 -0.15 0.00 0.00 58.65 58.41 2x17 h GLN 13 Cb 0.57 0.02 -0.07 0.00 1.07 0.00 0.00 27.48 29.08 2x17 h GLN 13 CO 0.03 0.93 0.57 1.25 -2.65 0.00 0.00 178.83 178.96 2x17 h LEU 14 N 0.46 0.89 -0.56 -2.39 6.46 -1.18 0.46 115.31 119.45 2x17 h LEU 14 Ca 0.02 0.02 -0.15 0.00 -0.12 0.00 0.00 57.88 57.66 2x17 h LEU 14 Cb 1.00 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.77 2x17 h LEU 14 CO 0.09 0.54 -0.51 -1.13 -0.62 0.00 0.00 178.44 176.82 2x17 h ASN 15 N 1.01 0.61 -0.63 1.25 -0.73 -0.93 -2.53 115.58 113.63 2x17 h ASN 15 Ca 0.41 -0.31 -0.06 0.00 1.87 0.00 0.00 56.30 58.22 2x17 h ASN 15 Cb 0.25 -0.17 -0.03 0.00 0.27 0.00 0.00 38.32 38.64 2x17 h ASN 15 CO -0.20 1.01 0.17 0.03 -0.37 0.00 0.00 177.43 178.08 2x17 h ARG 16 N 0.44 1.00 -0.16 6.67 3.08 -0.05 -1.04 114.38 124.31 2x17 h ARG 16 Ca 0.02 -0.23 -0.11 0.00 0.07 0.00 0.00 59.98 59.73 2x17 h ARG 16 Cb 1.04 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.94 2x17 h ARG 16 CO 0.10 0.89 -0.39 0.93 -1.07 0.00 0.00 179.97 180.42 2x17 h GLU 17 N 0.92 0.36 -0.27 0.04 4.39 -0.93 -0.36 114.58 118.72 2x17 h GLU 17 Ca 0.20 -0.17 -0.13 0.00 0.34 0.00 0.00 59.36 59.60 2x17 h GLU 17 Cb 0.33 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 2x17 h GLU 17 CO -0.00 0.70 -0.37 -0.07 -1.16 0.00 0.00 179.01 178.11 2x17 h LEU 18 N 0.30 0.65 -0.56 1.33 3.38 -1.23 -2.34 115.31 116.85 2x17 h LEU 18 Ca 0.03 -0.28 -0.15 0.00 0.09 0.00 0.00 57.88 57.57 2x17 h LEU 18 Cb 0.83 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 2x17 h LEU 18 CO 0.07 0.96 -0.46 0.22 0.09 0.00 0.00 178.44 179.32 2x17 h TYR 19 N 0.52 0.77 -0.42 1.13 3.20 -0.96 -2.28 116.97 118.93 2x17 h TYR 19 Ca 0.05 -0.24 0.08 0.00 3.14 0.00 0.00 58.73 61.75 2x17 h TYR 19 Cb 0.88 -0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.93 2x17 h TYR 19 CO 0.04 0.97 0.01 0.77 -1.64 0.00 0.00 178.16 178.32 2x17 h SER 20 N 0.51 -0.14 -0.96 -2.11 0.02 -0.91 0.50 113.55 110.45 2x17 h SER 20 Ca 0.03 0.09 0.06 0.00 -0.84 0.00 0.00 61.79 61.14 2x17 h SER 20 Cb 0.99 0.16 -0.07 0.00 0.14 0.00 0.00 62.40 63.63 2x17 h SER 20 CO 0.09 -0.04 0.62 0.00 -1.14 0.00 0.00 176.83 176.36 2x17 h ALA 21 N 1.36 1.33 -0.01 3.77 0.00 -1.31 -1.61 119.26 122.79 2x17 h ALA 21 Ca 0.21 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.93 2x17 h ALA 21 Cb 0.29 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2x17 h ALA 21 CO -0.33 0.40 -0.76 -0.92 0.00 0.00 0.00 179.25 177.64 2x17 h TYR 22 N 1.12 0.12 -0.25 0.00 -0.00 -0.59 -2.30 116.97 115.08 2x17 h TYR 22 Ca 0.42 -0.06 -0.12 0.00 -0.00 0.00 0.00 58.73 58.97 2x17 h TYR 22 Cb 0.17 -0.02 -0.00 0.00 -0.00 0.00 0.00 36.73 36.88 2x17 h TYR 22 CO -0.01 0.81 -0.31 1.25 -0.00 0.00 0.00 178.16 179.90 2x17 h LEU 23 N 0.05 0.70 -1.25 2.82 5.85 0.30 -2.26 115.31 121.53 2x17 h LEU 23 Ca -0.02 -0.50 -0.02 0.00 0.84 0.00 0.00 57.88 58.19 2x17 h LEU 23 Cb 1.34 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.17 2x17 h LEU 23 CO 0.11 1.06 -0.08 1.88 -0.34 0.00 0.00 178.44 181.07 2x17 h TYR 24 N 0.36 0.00 0.00 1.25 0.05 -1.31 -1.52 116.97 115.81 2x17 h TYR 24 Ca 0.03 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.65 2x17 h TYR 24 Cb 0.89 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.61 2x17 h TYR 24 CO 0.08 0.08 -0.78 0.35 -1.05 0.00 0.00 178.16 176.84 2x17 h PHE 25 N 0.00 0.00 -0.08 4.88 -0.00 -1.32 -2.18 116.94 118.23 2x17 h PHE 25 Ca -0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 57.97 57.79 2x17 h PHE 25 Cb 0.62 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.57 2x17 h PHE 25 CO 0.00 0.78 -0.73 0.00 -0.00 0.00 0.00 178.31 178.37 2x17 h ALA 26 N 1.22 0.60 -0.13 2.41 0.00 -0.70 -2.57 119.26 120.09 2x17 h ALA 26 Ca -0.01 -0.61 -0.18 0.00 0.00 0.00 0.00 54.91 54.12 2x17 h ALA 26 Cb 1.40 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 2x17 h ALA 26 CO 0.10 0.76 -0.67 0.52 0.00 0.00 0.00 179.25 179.96 2x17 h MET 27 N 0.28 0.51 -0.86 0.00 2.86 -1.34 -2.30 114.93 114.07 2x17 h MET 27 Ca -0.03 -0.38 0.04 0.00 -2.06 0.00 0.00 59.70 57.27 2x17 h MET 27 Cb 1.30 0.07 -0.05 0.00 0.06 0.00 0.00 31.60 32.97 2x17 h MET 27 CO 0.12 1.01 0.55 0.00 1.06 0.00 0.00 176.91 179.65 2x17 h ALA 28 N 0.90 1.15 -0.62 6.32 0.00 -1.35 0.35 119.26 126.00 2x17 h ALA 28 Ca -0.02 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 2x17 h ALA 28 Cb 1.24 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2x17 h ALA 28 CO 0.12 0.37 0.03 0.00 0.00 0.00 0.00 179.25 179.77 2x17 h ALA 29 N 1.37 0.83 -0.41 0.00 0.00 -1.37 -1.31 119.26 118.38 2x17 h ALA 29 Ca 0.35 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2x17 h ALA 29 Cb 0.05 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2x17 h ALA 29 CO -0.13 0.66 0.15 -0.92 0.00 0.00 0.00 179.25 179.00 2x17 h TYR 30 N 0.98 0.64 -0.04 0.00 3.20 -0.81 -2.27 116.97 118.67 2x17 h TYR 30 Ca 0.18 -0.06 -0.11 0.00 3.14 0.00 0.00 58.73 61.88 2x17 h TYR 30 Cb 0.53 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 2x17 h TYR 30 CO 0.04 0.57 -0.48 0.74 -1.64 0.00 0.00 178.16 177.39 2x17 h PHE 31 N 0.51 0.13 -0.26 -3.82 0.04 -0.91 -2.92 116.94 109.72 2x17 h PHE 31 Ca 0.13 -0.04 -0.09 0.00 2.80 0.00 0.00 57.97 60.78 2x17 h PHE 31 Cb 0.22 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 2x17 h PHE 31 CO 0.00 0.57 -0.21 1.49 -0.60 0.00 0.00 178.31 179.57 2x17 h GLU 32 N 0.09 0.47 -0.24 1.51 4.57 -1.06 0.70 114.58 120.62 2x17 h GLU 32 Ca 0.00 -0.16 -0.11 0.00 -1.18 0.00 0.00 59.36 57.91 2x17 h GLU 32 Cb 0.89 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.43 2x17 h GLU 32 CO 0.07 0.66 -0.33 0.22 -1.18 0.00 0.00 179.01 178.44 2x17 h ASP 33 N 0.42 0.53 0.71 1.04 3.58 -1.22 -2.46 116.42 119.01 2x17 h ASP 33 Ca 0.07 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.31 2x17 h ASP 33 Cb 0.60 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.51 2x17 h ASP 33 CO 0.04 0.83 0.00 0.18 -2.88 0.00 0.00 179.24 177.41 2x17 n LEU 34 N -4.07 0.00 0.00 2.28 4.77 -1.11 -4.90 117.00 113.98 2x17 n LEU 34 Ca -0.01 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2x17 n LEU 34 Cb 0.46 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2x17 n LEU 34 CO 0.43 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2x17 n GLY 35 N 1.10 0.48 3.37 -0.72 0.00 -0.93 -5.00 105.19 103.49 2x17 n GLY 35 Ca 0.09 -0.91 -0.45 0.00 0.00 0.00 0.00 46.02 44.76 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 6.10 0.34 0.99 1.43 0.22 -4.87 118.68 122.89 2x17 s LEU 36 Ca 0.00 -3.35 0.08 0.00 -1.03 0.00 0.00 54.13 49.83 2x17 s LEU 36 Cb 0.00 -2.25 0.63 0.00 0.03 0.00 0.00 46.19 44.60 2x17 s LEU 36 CO 0.00 -0.43 1.82 -0.33 0.23 0.00 0.00 176.35 177.64 2x17 h GLU 37 N 6.93 0.25 0.18 1.70 5.08 -1.91 -1.85 114.58 124.96 2x17 h GLU 37 Ca 0.20 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2x17 h GLU 37 Cb 0.89 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2x17 h GLU 37 CO 1.04 0.49 -0.09 0.78 -1.00 0.00 0.00 179.01 180.23 2x17 h GLY 38 N 0.96 -0.25 0.85 -3.84 0.00 -1.90 -0.28 103.07 98.61 2x17 h GLY 38 Ca 0.04 0.09 0.03 0.00 0.00 0.00 0.00 47.33 47.49 2x17 h GLY 38 CO 0.04 -0.09 0.37 0.74 0.00 0.00 0.00 176.54 177.60 2x17 h PHE 39 N -0.40 0.69 -0.19 5.60 -1.00 -1.74 -0.35 116.94 119.54 2x17 h PHE 39 Ca -0.02 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2x17 h PHE 39 Cb 0.31 -0.22 -0.01 0.00 3.61 0.00 0.00 35.95 39.64 2x17 h PHE 39 CO -0.02 0.39 0.13 0.00 -1.61 0.00 0.00 178.31 177.19 2x17 h ALA 40 N 1.27 0.24 -0.48 2.45 0.00 -1.22 -0.44 119.26 121.09 2x17 h ALA 40 Ca 0.25 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 2x17 h ALA 40 Cb 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2x17 h ALA 40 CO -0.11 -0.27 -0.13 -0.91 0.00 0.00 0.00 179.25 177.83 2x17 h ASN 41 N 0.25 0.89 -0.76 0.00 2.35 -0.93 -1.42 115.58 115.96 2x17 h ASN 41 Ca 0.07 -0.29 0.05 0.00 -0.55 0.00 0.00 56.30 55.58 2x17 h ASN 41 Cb -0.02 -0.24 -0.05 0.00 0.05 0.00 0.00 38.32 38.06 2x17 h ASN 41 CO -0.01 1.03 0.47 -0.25 -1.65 0.00 0.00 177.43 177.01 2x17 h TRP 42 N 0.79 0.87 -0.31 1.19 7.01 -0.79 -1.36 115.95 123.35 2x17 h TRP 42 Ca 0.12 0.03 -0.14 0.00 2.11 0.00 0.00 58.89 61.01 2x17 h TRP 42 Cb 0.66 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 27.43 2x17 h TRP 42 CO 0.04 0.46 -0.38 0.52 -2.79 0.00 0.00 178.44 176.29 2x17 h MET 43 N 0.88 0.74 -0.59 2.65 2.86 -0.82 -2.15 114.93 118.50 2x17 h MET 43 Ca 0.32 -0.37 -0.06 0.00 -2.06 0.00 0.00 59.70 57.53 2x17 h MET 43 Cb 0.10 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 2x17 h MET 43 CO -0.15 0.99 0.15 0.87 1.06 0.00 0.00 176.91 179.84 2x17 h LYS 44 N 0.61 0.95 -0.43 1.72 1.57 -0.93 0.20 116.57 120.26 2x17 h LYS 44 Ca 0.05 -0.23 -0.08 0.00 -1.87 0.00 0.00 60.65 58.53 2x17 h LYS 44 Cb 0.93 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 2x17 h LYS 44 CO 0.08 0.87 -0.06 0.00 -0.57 0.00 0.00 179.45 179.77 2x17 h ALA 45 N 1.04 1.09 -0.29 3.86 0.00 -1.21 -2.28 119.26 121.46 2x17 h ALA 45 Ca 0.19 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 2x17 h ALA 45 Cb 0.34 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2x17 h ALA 45 CO 0.00 0.57 -0.35 0.37 0.00 0.00 0.00 179.25 179.84 2x17 h GLN 46 N 0.67 0.66 -0.28 0.00 5.75 -1.13 -3.02 115.11 117.77 2x17 h GLN 46 Ca 0.12 -0.31 -0.05 0.00 -0.15 0.00 0.00 58.65 58.26 2x17 h GLN 46 Cb 0.51 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.04 2x17 h GLN 46 CO 0.03 0.91 -0.04 0.00 -2.65 0.00 0.00 178.83 177.07 2x17 h ALA 47 N 1.06 1.41 -0.51 3.38 0.00 -0.60 -2.68 119.26 121.32 2x17 h ALA 47 Ca 0.06 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2x17 h ALA 47 Cb 0.86 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2x17 h ALA 47 CO 0.07 0.41 0.08 0.93 0.00 0.00 0.00 179.25 180.74 2x17 h GLU 48 N 0.41 0.84 -0.90 0.00 5.08 -1.30 -3.01 114.58 115.71 2x17 h GLU 48 Ca 0.09 -0.23 0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2x17 h GLU 48 Cb 0.34 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 2x17 h GLU 48 CO 0.01 0.84 0.59 0.93 -1.00 0.00 0.00 179.01 180.38 2x17 h GLU 49 N 0.72 1.06 -0.43 2.33 4.39 -1.37 -2.03 114.58 119.26 2x17 h GLU 49 Ca 0.15 -0.06 -0.10 0.00 0.34 0.00 0.00 59.36 59.69 2x17 h GLU 49 Cb 0.40 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 2x17 h GLU 49 CO 0.01 0.70 -0.14 0.93 -1.16 0.00 0.00 179.01 179.36 2x17 h GLU 50 N 1.09 0.78 -0.54 2.33 4.39 -1.42 -0.40 114.58 120.82 2x17 h GLU 50 Ca 0.36 -0.27 -0.04 0.00 0.34 0.00 0.00 59.36 59.75 2x17 h GLU 50 Cb 0.07 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 2x17 h GLU 50 CO -0.12 0.88 0.17 0.82 -1.16 0.00 0.00 179.01 179.60 2x17 h ILE 51 N 0.70 1.21 -0.77 3.13 2.04 -1.30 -0.64 117.51 121.88 2x17 h ILE 51 Ca 0.11 -0.71 -0.05 0.00 1.00 0.00 0.00 64.86 65.21 2x17 h ILE 51 Cb 0.63 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 2x17 h ILE 51 CO 0.04 0.27 0.27 1.23 0.00 0.00 0.00 178.15 179.96 2x17 h GLY 52 N 0.94 1.27 1.34 5.37 0.00 -0.67 -0.87 103.07 110.46 2x17 h GLY 52 Ca 0.18 -0.73 -0.08 0.00 0.00 0.00 0.00 47.33 46.70 2x17 h GLY 52 CO -0.01 0.68 -0.02 0.45 0.00 0.00 0.00 176.54 177.65 2x17 h HIS 53 N 1.14 0.85 -0.43 5.60 3.86 -0.57 -1.77 115.15 123.83 2x17 h HIS 53 Ca 0.25 -0.13 -0.11 0.00 -1.16 0.00 0.00 60.37 59.23 2x17 h HIS 53 Cb 0.27 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.50 2x17 h HIS 53 CO 0.02 0.80 -0.16 0.00 0.86 0.00 0.00 177.93 179.45 2x17 h ALA 54 N 1.24 0.90 -0.04 2.45 0.00 -0.83 -2.79 119.26 120.20 2x17 h ALA 54 Ca 0.14 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 2x17 h ALA 54 Cb 0.48 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2x17 h ALA 54 CO 0.02 0.63 -0.42 -0.07 0.00 0.00 0.00 179.25 179.41 2x17 h LEU 55 N 0.73 0.08 -0.78 0.00 3.38 -0.92 -1.29 115.31 116.52 2x17 h LEU 55 Ca 0.11 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.94 2x17 h LEU 55 Cb 0.67 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2x17 h LEU 55 CO 0.05 0.50 -0.22 0.03 0.09 0.00 0.00 178.44 178.88 2x17 h ARG 56 N 0.07 0.68 -0.34 1.13 3.08 -1.10 0.19 114.38 118.09 2x17 h ARG 56 Ca 0.00 -0.26 -0.16 0.00 0.07 0.00 0.00 59.98 59.63 2x17 h ARG 56 Cb 0.77 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.78 2x17 h ARG 56 CO 0.06 0.85 -0.40 0.74 -1.07 0.00 0.00 179.97 180.14 2x17 h PHE 57 N 0.59 1.06 -0.57 3.04 0.04 -1.31 -1.87 116.94 117.92 2x17 h PHE 57 Ca 0.09 -0.33 0.05 0.00 2.80 0.00 0.00 57.97 60.58 2x17 h PHE 57 Cb 0.70 -0.22 -0.05 0.00 2.20 0.00 0.00 35.95 38.59 2x17 h PHE 57 CO 0.03 1.15 0.29 -0.92 -0.60 0.00 0.00 178.31 178.26 2x17 h TYR 58 N 0.66 0.52 -0.37 -0.55 5.03 -0.94 -1.41 116.97 119.92 2x17 h TYR 58 Ca 0.05 0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.26 2x17 h TYR 58 Cb 1.00 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 39.11 2x17 h TYR 58 CO 0.07 0.24 -0.26 -0.91 -1.32 0.00 0.00 178.16 175.98 2x17 h ASN 59 N 0.54 0.77 -0.18 -2.11 2.35 -0.58 -3.12 115.58 113.25 2x17 h ASN 59 Ca 0.26 -0.29 -0.09 0.00 -0.55 0.00 0.00 56.30 55.63 2x17 h ASN 59 Cb 0.18 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.33 2x17 h ASN 59 CO -0.18 1.00 -0.22 0.22 -1.65 0.00 0.00 177.43 176.59 2x17 h TYR 60 N 0.65 0.57 -0.47 1.19 3.20 -1.06 -2.53 116.97 118.52 2x17 h TYR 60 Ca 0.08 -0.18 0.07 0.00 3.14 0.00 0.00 58.73 61.84 2x17 h TYR 60 Cb 0.78 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.87 2x17 h TYR 60 CO 0.04 0.86 0.14 0.82 -1.64 0.00 0.00 178.16 178.37 2x17 h ILE 61 N 0.12 0.80 0.00 1.81 2.04 -1.31 -1.50 117.51 119.47 2x17 h ILE 61 Ca 0.02 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2x17 h ILE 61 Cb 0.78 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2x17 h ILE 61 CO 0.05 0.05 0.00 1.88 0.00 0.00 0.00 178.15 180.14 2x17 h TYR 62 N 0.29 0.00 0.00 1.37 0.05 -1.59 0.08 116.97 117.17 2x17 h TYR 62 Ca 0.23 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.00 2x17 h TYR 62 Cb 0.26 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.00 2x17 h TYR 62 CO -0.18 0.00 -0.02 -0.44 -1.05 0.00 0.00 178.16 176.47 2x17 h ASP 63 N 0.00 0.00 -0.45 3.88 3.32 -0.83 -3.13 116.42 119.21 2x17 h ASP 63 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2x17 h ASP 63 Cb 0.67 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.21 2x17 h ASP 63 CO 0.00 0.02 0.01 0.54 -1.72 0.00 0.00 179.24 178.08 2x17 n ARG 64 N -3.11 4.08 -2.50 3.56 5.12 -0.90 -4.94 116.66 117.97 2x17 n ARG 64 Ca 0.02 -3.04 -0.20 0.00 -1.93 0.00 0.00 57.85 52.70 2x17 n ARG 64 Cb 0.43 -2.10 -0.00 0.00 -1.16 0.00 0.00 32.46 29.63 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 0.13 -5.67 -4.63 0.55 5.15 -1.18 -4.16 115.26 105.46 2x17 n ASN 65 Ca 0.26 -0.07 -0.21 0.00 -0.60 0.00 0.00 54.58 53.95 2x17 n ASN 65 Cb 1.08 -4.66 0.10 0.00 -0.53 0.00 0.00 39.78 35.77 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 -1.11 1.13 2.96 8.20 0.00 -0.02 -4.93 105.19 111.41 2x17 n GLY 66 Ca -0.21 -2.10 -0.26 0.00 0.00 0.00 0.00 46.02 43.45 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 -4.87 1.65 -0.06 1.61 6.06 -1.26 -4.41 118.95 117.67 2x17 s ARG 67 Ca 0.63 -0.34 -0.30 0.00 -2.50 0.00 0.00 55.73 53.22 2x17 s ARG 67 Cb -0.04 -1.55 -0.02 0.00 0.06 0.00 0.00 34.95 33.39 2x17 s ARG 67 CO 0.41 -0.15 1.01 0.08 -2.50 0.00 0.00 175.30 174.15 2x17 s VAL 68 N 1.29 4.76 -0.15 7.11 1.01 -1.26 -5.03 120.40 128.13 2x17 s VAL 68 Ca -0.02 2.00 0.02 0.00 0.00 0.00 0.00 61.98 63.98 2x17 s VAL 68 Cb -0.14 -4.29 0.01 0.00 0.00 0.00 0.00 36.38 31.96 2x17 s VAL 68 CO -0.04 0.07 -0.20 -0.70 0.00 0.00 0.00 175.10 174.23 2x17 s GLU 69 N 1.61 3.05 -0.25 2.72 2.12 -1.26 -5.11 118.70 121.58 2x17 s GLU 69 Ca 0.51 -0.83 -0.19 0.00 0.36 0.00 0.00 54.97 54.82 2x17 s GLU 69 Cb -0.20 -2.50 -0.03 0.00 0.26 0.00 0.00 34.13 31.67 2x17 s GLU 69 CO 0.22 -0.04 0.55 -0.51 -0.54 0.00 0.00 175.26 174.94 2x17 s LEU 70 N 0.90 4.06 0.59 2.70 1.43 -1.26 -4.92 118.68 122.19 2x17 s LEU 70 Ca -0.05 0.59 -0.04 0.00 -1.03 0.00 0.00 54.13 53.60 2x17 s LEU 70 Cb -0.15 -2.72 0.02 0.00 0.03 0.00 0.00 46.19 43.37 2x17 s LEU 70 CO -0.03 -0.30 0.88 -1.81 0.23 0.00 0.00 176.35 175.32 2x17 s ASP 71 N 1.48 5.39 0.62 2.29 1.01 -1.26 -5.07 116.67 121.12 2x17 s ASP 71 Ca 0.23 0.49 -0.17 0.00 0.71 0.00 0.00 52.55 53.81 2x17 s ASP 71 Cb -0.16 -1.41 -0.02 0.00 1.01 0.00 0.00 42.92 42.34 2x17 s ASP 71 CO 0.09 -1.16 1.13 -1.83 0.21 0.00 0.00 175.17 173.61 2x17 s GLU 72 N -4.96 2.98 -0.30 8.23 -1.05 -1.26 -5.03 118.70 117.31 2x17 s GLU 72 Ca 0.55 1.52 -0.10 0.00 -0.15 0.00 0.00 54.97 56.80 2x17 s GLU 72 Cb -0.10 -1.96 -0.01 0.00 -0.44 0.00 0.00 34.13 31.61 2x17 s GLU 72 CO 0.43 -1.13 0.15 0.42 0.95 0.00 0.00 175.26 176.08 2x17 s ILE 73 N -2.06 4.67 0.66 1.83 1.01 -1.26 -5.07 121.20 120.99 2x17 s ILE 73 Ca 0.70 -0.32 -0.16 0.00 0.00 0.00 0.00 60.65 60.88 2x17 s ILE 73 Cb -0.23 -3.34 0.00 0.00 0.01 0.00 0.00 42.46 38.90 2x17 s ILE 73 CO 0.36 0.11 1.14 -2.16 0.00 0.00 0.00 174.94 174.39 2x17 s PRO 74 N 1.63 2.69 0.04 2.79 0.04 -1.26 -4.95 135.00 135.98 2x17 s PRO 74 Ca 0.05 1.53 -0.30 0.00 0.04 0.00 0.00 61.00 62.32 2x17 s PRO 74 Cb -0.17 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.37 2x17 s PRO 74 CO 0.07 -1.36 1.74 0.21 0.04 0.00 0.00 177.00 177.70 2x17 s LYS 75 N -3.92 4.17 0.62 4.56 2.20 -1.26 -5.00 119.74 121.11 2x17 s LYS 75 Ca 0.70 2.39 -0.11 0.00 -0.36 0.00 0.00 55.97 58.59 2x17 s LYS 75 Cb -0.24 -3.81 -0.04 0.00 -1.51 0.00 0.00 37.83 32.23 2x17 s LYS 75 CO 0.40 -0.82 1.03 -1.25 -0.36 0.00 0.00 175.35 174.35 2x17 s PRO 76 N 3.38 3.57 0.38 4.03 0.04 -1.26 -5.02 135.00 140.11 2x17 s PRO 76 Ca 0.78 0.78 -0.28 0.00 0.04 0.00 0.00 61.00 62.32 2x17 s PRO 76 Cb -0.40 -2.08 -0.11 0.00 0.04 0.00 0.00 34.50 31.96 2x17 s PRO 76 CO 0.34 -0.60 1.40 -2.30 0.04 0.00 0.00 177.00 175.88 2x17 n PRO 77 N -2.71 2.39 0.01 0.56 -0.02 -1.26 -4.96 135.00 129.01 2x17 n PRO 77 Ca 0.06 0.84 -0.20 0.00 -2.02 0.00 0.00 63.50 62.19 2x17 n PRO 77 Cb 0.54 -2.53 -0.14 0.00 -0.02 0.00 0.00 33.50 31.35 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 2.67 0.21 -5.44 -0.52 3.64 -1.95 -3.45 116.57 111.74 2x17 h LYS 78 Ca -0.49 -0.37 -0.42 0.00 -1.27 0.00 0.00 60.65 58.11 2x17 h LYS 78 Cb 1.26 0.14 -0.17 0.00 -0.41 0.00 0.00 32.23 33.05 2x17 h LYS 78 CO 0.63 1.17 -0.75 -1.21 -2.27 0.00 0.00 179.45 177.02 2x17 s GLU 79 N -2.40 1.10 0.05 1.90 2.02 -1.26 -4.69 118.70 115.42 2x17 s GLU 79 Ca -0.17 -1.34 0.03 0.00 0.02 0.00 0.00 54.97 53.51 2x17 s GLU 79 Cb 0.02 -0.93 -0.03 0.00 0.10 0.00 0.00 34.13 33.29 2x17 s GLU 79 CO 0.77 0.17 -0.10 -1.58 0.02 0.00 0.00 175.26 174.54 2x17 s TRP 80 N -2.44 0.87 0.25 1.61 0.51 -1.26 -5.07 118.94 113.41 2x17 s TRP 80 Ca 0.13 -0.50 -0.05 0.00 -2.12 0.00 0.00 56.10 53.56 2x17 s TRP 80 Cb -0.03 -0.50 0.34 0.00 -0.81 0.00 0.00 33.47 32.47 2x17 s TRP 80 CO 0.04 -0.03 1.86 0.93 -0.51 0.00 0.00 176.95 179.23 2x17 h GLU 81 N 4.38 1.00 -3.65 4.98 5.08 -2.01 -3.46 114.58 120.91 2x17 h GLU 81 Ca -0.38 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 57.86 2x17 h GLU 81 Cb 1.20 -0.23 -0.12 0.00 0.50 0.00 0.00 28.75 30.11 2x17 h GLU 81 CO 0.41 0.66 -0.18 -1.54 -1.00 0.00 0.00 179.01 177.36 2x17 s SER 82 N -5.81 -0.08 0.49 1.42 1.04 -1.26 -5.00 113.70 104.50 2x17 s SER 82 Ca -0.13 -0.70 0.23 0.00 0.48 0.00 0.00 55.95 55.83 2x17 s SER 82 Cb 0.19 0.49 1.28 0.00 0.10 0.00 0.00 66.02 68.07 2x17 s SER 82 CO 0.80 -0.95 1.94 -0.65 0.98 0.00 0.00 173.24 175.37 2x17 h PRO 83 N 2.42 0.16 -0.23 4.02 0.11 -1.99 -0.19 132.00 136.30 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 1.24 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2x17 h PRO 83 CO 0.44 0.11 -0.01 1.25 -0.21 0.00 0.00 178.00 179.58 2x17 h LEU 84 N 0.16 0.41 -1.16 2.35 5.85 -1.96 -2.61 115.31 118.36 2x17 h LEU 84 Ca 0.33 -0.32 -0.08 0.00 0.84 0.00 0.00 57.88 58.66 2x17 h LEU 84 Cb 1.08 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.99 2x17 h LEU 84 CO -0.05 0.63 -0.38 0.11 -0.34 0.00 0.00 178.44 178.40 2x17 h LYS 85 N 0.18 0.00 -0.36 1.25 1.79 -1.73 -1.05 116.57 116.65 2x17 h LYS 85 Ca 0.06 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.41 2x17 h LYS 85 Cb 0.42 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.06 2x17 h LYS 85 CO 0.01 0.38 -0.30 0.00 -1.08 0.00 0.00 179.45 178.47 2x17 h ALA 86 N 1.62 0.80 0.00 3.86 0.00 -1.00 -1.75 119.26 122.79 2x17 h ALA 86 Ca -0.00 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.38 2x17 h ALA 86 Cb 0.77 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2x17 h ALA 86 CO 0.05 0.65 -0.58 0.74 0.00 0.00 0.00 179.25 180.10 2x17 h PHE 87 N 0.65 0.00 -0.35 0.00 0.04 -1.23 -2.03 116.94 114.02 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 0.83 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.96 2x17 h PHE 87 CO 0.04 0.57 -0.26 0.93 -0.60 0.00 0.00 178.31 178.99 2x17 h GLU 88 N 0.00 0.72 -0.01 1.51 5.08 -1.08 0.63 114.58 121.43 2x17 h GLU 88 Ca -0.01 -0.30 -0.17 0.00 -1.00 0.00 0.00 59.36 57.88 2x17 h GLU 88 Cb 1.44 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.64 2x17 h GLU 88 CO 0.07 0.90 -0.76 0.00 -1.00 0.00 0.00 179.01 178.22 2x17 h ALA 89 N 1.09 0.70 -0.25 3.43 0.00 -1.31 -1.85 119.26 121.05 2x17 h ALA 89 Ca 0.08 -0.67 -0.11 0.00 0.00 0.00 0.00 54.91 54.21 2x17 h ALA 89 Cb 0.76 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2x17 h ALA 89 CO 0.06 0.88 -0.28 0.00 0.00 0.00 0.00 179.25 179.91 2x17 h ALA 90 N 1.14 0.38 -0.14 0.00 0.00 -1.20 -2.12 119.26 117.31 2x17 h ALA 90 Ca -0.02 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 2x17 h ALA 90 Cb 1.34 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2x17 h ALA 90 CO 0.11 0.38 -0.50 -0.92 0.00 0.00 0.00 179.25 178.32 2x17 h TYR 91 N 0.36 0.46 -0.49 0.00 3.20 -0.89 -0.73 116.97 118.88 2x17 h TYR 91 Ca 0.04 -0.15 -0.11 0.00 3.14 0.00 0.00 58.73 61.65 2x17 h TYR 91 Cb 0.85 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 39.01 2x17 h TYR 91 CO 0.08 0.81 -0.13 1.49 -1.64 0.00 0.00 178.16 178.77 2x17 h GLU 92 N 0.30 0.91 -0.03 1.82 4.81 -1.37 -2.59 114.58 118.44 2x17 h GLU 92 Ca 0.01 -0.33 -0.13 0.00 -0.13 0.00 0.00 59.36 58.78 2x17 h GLU 92 Cb 0.99 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 2x17 h GLU 92 CO 0.09 0.98 -0.58 1.25 -0.73 0.00 0.00 179.01 180.02 2x17 h HIS 93 N 0.81 0.12 -0.37 0.92 2.76 -1.16 -2.31 115.15 115.92 2x17 h HIS 93 Ca 0.13 -0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 58.18 2x17 h HIS 93 Cb 0.66 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.58 2x17 h HIS 93 CO 0.04 0.65 -0.08 0.93 -1.30 0.00 0.00 177.93 178.17 2x17 h GLU 94 N 0.07 0.63 0.00 5.26 4.39 -0.99 -1.37 114.58 122.57 2x17 h GLU 94 Ca -0.00 -0.18 -0.11 0.00 0.34 0.00 0.00 59.36 59.41 2x17 h GLU 94 Cb 1.04 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.61 2x17 h GLU 94 CO 0.08 0.70 -0.51 0.87 -1.16 0.00 0.00 179.01 178.99 2x17 h LYS 95 N 0.58 0.00 -0.37 2.33 1.57 -1.25 -2.20 116.57 117.23 2x17 h LYS 95 Ca 0.11 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.75 2x17 h LYS 95 Cb 0.49 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 2x17 h LYS 95 CO 0.03 0.51 -0.34 0.35 -0.57 0.00 0.00 179.45 179.42 2x17 h PHE 96 N 0.00 0.99 -0.24 -1.35 3.57 -0.90 -2.10 116.94 116.92 2x17 h PHE 96 Ca -0.01 -0.28 -0.07 0.00 3.53 0.00 0.00 57.97 61.15 2x17 h PHE 96 Cb 0.95 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 2x17 h PHE 96 CO 0.00 1.06 -0.11 0.82 -2.23 0.00 0.00 178.31 177.84 2x17 h ILE 97 N 0.70 1.30 -0.94 1.41 1.08 -1.14 -2.50 117.51 117.42 2x17 h ILE 97 Ca 0.07 -1.19 0.03 0.00 -0.39 0.00 0.00 64.86 63.38 2x17 h ILE 97 Cb 0.90 1.57 -0.05 0.00 -3.07 0.00 0.00 36.82 36.17 2x17 h ILE 97 CO 0.08 0.37 0.62 0.28 -0.69 0.00 0.00 178.15 178.81 2x17 h SER 98 N 0.21 1.04 -0.47 1.72 0.02 -1.42 -1.56 113.55 113.09 2x17 h SER 98 Ca 0.05 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2x17 h SER 98 Cb 0.61 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 2x17 h SER 98 CO 0.03 0.73 0.30 0.50 -1.14 0.00 0.00 176.83 177.25 2x17 h LYS 99 N 1.21 0.63 0.00 3.45 1.63 -1.29 0.96 116.57 123.17 2x17 h LYS 99 Ca 0.36 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 60.09 2x17 h LYS 99 Cb -0.04 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 31.45 2x17 h LYS 99 CO -0.10 0.44 -0.13 0.66 -3.45 0.00 0.00 179.45 176.87 2x17 h SER 100 N 0.64 0.00 0.04 4.20 4.64 -1.03 -0.71 113.55 121.33 2x17 h SER 100 Ca 0.17 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.28 2x17 h SER 100 Cb -0.04 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2x17 h SER 100 CO -0.03 0.13 -0.87 0.40 -0.87 0.00 0.00 176.83 175.59 2x17 h ILE 101 N 0.00 1.37 -0.90 0.95 1.08 -0.90 -2.80 117.51 116.31 2x17 h ILE 101 Ca -0.00 -2.24 0.03 0.00 -0.39 0.00 0.00 64.86 62.25 2x17 h ILE 101 Cb 0.71 2.62 -0.05 0.00 -3.07 0.00 0.00 36.82 37.02 2x17 h ILE 101 CO 0.02 0.67 0.59 1.88 -0.69 0.00 0.00 178.15 180.61 2x17 h TYR 102 N 0.08 1.11 -0.05 1.37 0.05 -0.42 -0.55 116.97 118.56 2x17 h TYR 102 Ca -0.12 0.03 -0.11 0.00 0.05 0.00 0.00 58.73 58.57 2x17 h TYR 102 Cb 1.57 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 38.92 2x17 h TYR 102 CO 0.13 0.65 -0.50 0.93 -1.05 0.00 0.00 178.16 178.33 2x17 h GLU 103 N 1.16 0.12 -0.27 4.88 5.08 -1.22 -1.53 114.58 122.80 2x17 h GLU 103 Ca 0.35 -0.07 -0.15 0.00 -1.00 0.00 0.00 59.36 58.50 2x17 h GLU 103 Cb -0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2x17 h GLU 103 CO -0.11 0.59 -0.43 -0.07 -1.00 0.00 0.00 179.01 178.00 2x17 h LEU 104 N 0.10 0.72 -0.74 1.33 3.38 -1.15 -1.80 115.31 117.14 2x17 h LEU 104 Ca 0.00 -0.33 -0.10 0.00 0.09 0.00 0.00 57.88 57.53 2x17 h LEU 104 Cb 0.91 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 2x17 h LEU 104 CO 0.07 1.05 -0.16 0.00 0.09 0.00 0.00 178.44 179.49 2x17 h ALA 105 N 0.98 0.93 -0.06 1.53 0.00 -0.85 -1.77 119.26 120.02 2x17 h ALA 105 Ca 0.04 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.47 2x17 h ALA 105 Cb 0.96 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2x17 h ALA 105 CO 0.09 0.62 -0.57 0.00 0.00 0.00 0.00 179.25 179.39 2x17 h ALA 106 N 1.11 0.93 -0.06 0.00 0.00 -1.24 -2.19 119.26 117.82 2x17 h ALA 106 Ca 0.11 -0.52 -0.15 0.00 0.00 0.00 0.00 54.91 54.35 2x17 h ALA 106 Cb 0.66 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2x17 h ALA 106 CO 0.05 0.71 -0.62 1.25 0.00 0.00 0.00 179.25 180.63 2x17 h LEU 107 N 0.14 0.25 -0.17 0.00 5.85 -1.15 -2.40 115.31 117.83 2x17 h LEU 107 Ca -0.00 -0.15 -0.21 0.00 0.84 0.00 0.00 57.88 58.36 2x17 h LEU 107 Cb 1.05 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 42.01 2x17 h LEU 107 CO 0.09 0.81 -0.72 0.00 -0.34 0.00 0.00 178.44 178.27 2x17 h ALA 108 N 1.19 0.32 -0.14 1.25 0.00 -1.20 -2.54 119.26 118.14 2x17 h ALA 108 Ca -0.01 -0.58 -0.13 0.00 0.00 0.00 0.00 54.91 54.19 2x17 h ALA 108 Cb 1.13 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2x17 h ALA 108 CO 0.09 0.66 -0.47 0.93 0.00 0.00 0.00 179.25 180.46 2x17 h GLU 109 N 0.54 0.36 -0.24 0.00 5.08 -1.40 0.14 114.58 119.05 2x17 h GLU 109 Ca -0.04 -0.19 -0.17 0.00 -1.00 0.00 0.00 59.36 57.95 2x17 h GLU 109 Cb 1.35 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.61 2x17 h GLU 109 CO 0.15 0.75 -0.53 1.49 -1.00 0.00 0.00 179.01 179.88 2x17 h GLU 110 N 0.29 0.78 -0.10 2.33 4.81 -1.47 -3.13 114.58 118.08 2x17 h GLU 110 Ca 0.02 -0.52 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2x17 h GLU 110 Cb 0.94 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.39 2x17 h GLU 110 CO 0.08 1.14 0.00 0.39 -0.73 0.00 0.00 179.01 179.89 2x17 n GLU 111 N -4.08 1.46 -2.81 1.92 1.02 -0.96 -4.91 120.64 112.27 2x17 n GLU 111 Ca -0.05 -0.68 -0.20 0.00 -0.02 0.00 0.00 57.16 56.20 2x17 n GLU 111 Cb 0.61 -1.36 0.01 0.00 -0.02 0.00 0.00 31.44 30.68 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 -0.10 -3.22 -2.89 3.49 5.02 -0.74 -4.92 118.16 114.80 2x17 n LYS 112 Ca 0.15 0.77 -0.44 0.00 -2.02 0.00 0.00 58.31 56.78 2x17 n LYS 112 Cb 0.23 -5.49 -0.02 0.00 -0.02 0.00 0.00 35.03 29.73 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 -2.40 6.78 0.29 4.39 -1.08 0.42 -4.85 116.67 120.22 2x17 s ASP 113 Ca 0.18 -2.34 0.02 0.00 -0.52 0.00 0.00 52.55 49.89 2x17 s ASP 113 Cb -0.09 -2.42 0.45 0.00 -1.46 0.00 0.00 42.92 39.40 2x17 s ASP 113 CO 0.22 -1.00 1.77 1.88 0.52 0.00 0.00 175.17 178.57 2x17 h TYR 114 N 8.27 0.59 -0.47 -5.34 -1.99 -1.91 -2.54 116.97 113.58 2x17 h TYR 114 Ca 0.23 -0.10 -0.01 0.00 2.00 0.00 0.00 58.73 60.85 2x17 h TYR 114 Cb 0.96 -0.15 -0.02 0.00 2.00 0.00 0.00 36.73 39.52 2x17 h TYR 114 CO 1.17 0.66 0.26 0.77 -0.00 0.00 0.00 178.16 181.02 2x17 h SER 115 N 0.50 0.58 -0.03 3.88 0.02 -1.96 -0.52 113.55 116.01 2x17 h SER 115 Ca 0.09 -0.09 -0.19 0.00 -0.84 0.00 0.00 61.79 60.76 2x17 h SER 115 Cb 0.54 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2x17 h SER 115 CO 0.03 0.50 -0.66 0.74 -1.14 0.00 0.00 176.83 176.31 2x17 h THR 116 N 0.62 1.31 -0.76 -2.27 2.02 -1.95 -2.04 112.91 109.85 2x17 h THR 116 Ca 0.17 -1.91 -0.03 0.00 0.77 0.00 0.00 66.41 65.41 2x17 h THR 116 Cb 0.04 1.88 -0.03 0.00 -1.74 0.00 0.00 68.15 68.30 2x17 h THR 116 CO -0.03 0.60 0.37 -0.09 0.37 0.00 0.00 175.52 176.74 2x17 h ARG 117 N 0.48 1.09 -0.07 6.66 9.65 -1.30 -1.09 114.38 129.79 2x17 h ARG 117 Ca -0.02 -0.16 -0.12 0.00 -1.10 0.00 0.00 59.98 58.59 2x17 h ARG 117 Cb 1.25 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 29.62 2x17 h ARG 117 CO 0.13 0.84 -0.50 0.00 2.80 0.00 0.00 179.97 183.24 2x17 h ALA 118 N 1.19 1.03 -0.39 2.80 0.00 -1.06 -3.06 119.26 119.77 2x17 h ALA 118 Ca 0.26 -0.47 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 2x17 h ALA 118 Cb 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2x17 h ALA 118 CO -0.03 0.65 -0.21 0.35 0.00 0.00 0.00 179.25 180.00 2x17 h PHE 119 N 0.14 0.97 0.00 0.00 3.57 -1.01 -3.18 116.94 117.44 2x17 h PHE 119 Ca 0.00 -0.25 0.00 0.00 3.53 0.00 0.00 57.97 61.26 2x17 h PHE 119 Cb 0.94 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.45 2x17 h PHE 119 CO 0.01 1.02 0.00 1.28 -2.23 0.00 0.00 178.31 178.39 2x17 n LEU 120 N -4.22 0.49 0.14 0.59 4.77 -0.44 -3.04 117.00 115.28 2x17 n LEU 120 Ca -0.02 0.60 0.07 0.00 -0.03 0.00 0.00 56.01 56.63 2x17 n LEU 120 Cb 0.44 -0.50 0.56 0.00 -2.33 0.00 0.00 43.42 41.58 2x17 n LEU 120 CO 0.45 -0.37 1.11 -0.08 -1.33 0.00 0.00 177.39 177.17 2x17 h GLU 121 N 0.00 0.21 -0.51 3.23 4.57 -1.51 -1.62 114.58 118.95 2x17 h GLU 121 Ca 0.00 -0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.12 2x17 h GLU 121 Cb 0.42 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 2x17 h GLU 121 CO 0.00 0.14 0.13 2.35 -1.18 0.00 0.00 179.01 180.45 2x17 h TRP 122 N 0.22 0.84 -0.05 0.92 7.01 -1.74 -2.65 115.95 120.50 2x17 h TRP 122 Ca 0.07 -0.10 -0.19 0.00 2.11 0.00 0.00 58.89 60.79 2x17 h TRP 122 Cb 0.03 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 26.84 2x17 h TRP 122 CO -0.00 0.74 -0.77 0.74 -2.79 0.00 0.00 178.44 176.36 2x17 h PHE 123 N 0.70 0.45 -0.29 2.65 0.04 -1.54 -0.29 116.94 118.65 2x17 h PHE 123 Ca 0.16 -0.21 -0.00 0.00 2.80 0.00 0.00 57.97 60.71 2x17 h PHE 123 Cb 0.32 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 2x17 h PHE 123 CO 0.02 0.98 0.17 0.82 -0.60 0.00 0.00 178.31 179.70 2x17 h ILE 124 N 0.21 1.11 -0.18 -0.55 2.04 -1.34 -0.60 117.51 118.20 2x17 h ILE 124 Ca -0.04 -0.28 -0.11 0.00 1.00 0.00 0.00 64.86 65.44 2x17 h ILE 124 Cb 1.36 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 2x17 h ILE 124 CO 0.13 0.11 -0.36 0.78 0.00 0.00 0.00 178.15 178.81 2x17 h ASN 125 N 0.36 0.41 -0.26 1.72 2.35 -1.41 -3.18 115.58 115.57 2x17 h ASN 125 Ca 0.10 -0.16 -0.19 0.00 -0.55 0.00 0.00 56.30 55.50 2x17 h ASN 125 Cb 0.03 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.29 2x17 h ASN 125 CO -0.02 0.74 -0.59 -0.08 -1.65 0.00 0.00 177.43 175.83 2x17 h GLU 126 N 0.33 0.86 0.00 0.81 4.22 -0.86 -3.21 114.58 116.74 2x17 h GLU 126 Ca 0.04 -0.57 -0.03 0.00 0.08 0.00 0.00 59.36 58.87 2x17 h GLU 126 Cb 0.79 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 2x17 h GLU 126 CO 0.06 1.20 -0.16 1.96 -2.18 0.00 0.00 179.01 179.89 2x17 h GLN 127 N 0.65 0.00 -0.52 1.92 1.08 -1.13 -1.16 115.11 115.96 2x17 h GLN 127 Ca 0.00 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.16 2x17 h GLN 127 Cb 1.20 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.61 2x17 h GLN 127 CO 0.13 0.16 0.14 0.28 -0.95 0.00 0.00 178.83 178.59 2x17 h VAL 128 N 0.00 1.24 -0.34 -0.54 2.07 -1.55 0.56 116.25 117.70 2x17 h VAL 128 Ca -0.00 -0.83 -0.12 0.00 0.82 0.00 0.00 66.70 66.57 2x17 h VAL 128 Cb 0.54 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 2x17 h VAL 128 CO 0.02 0.30 -0.25 -0.33 0.02 0.00 0.00 177.57 177.34 2x17 h GLU 129 N 0.72 0.76 -0.24 1.57 5.08 -1.55 -2.85 114.58 118.07 2x17 h GLU 129 Ca 0.16 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2x17 h GLU 129 Cb 0.32 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2x17 h GLU 129 CO -0.00 0.99 0.16 0.93 -1.00 0.00 0.00 179.01 180.09 2x17 h GLU 130 N 0.54 0.32 -0.23 2.33 4.39 -1.02 0.79 114.58 121.70 2x17 h GLU 130 Ca 0.06 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 2x17 h GLU 130 Cb 0.81 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.38 2x17 h GLU 130 CO 0.07 0.23 0.06 0.93 -1.16 0.00 0.00 179.01 179.14 2x17 h GLU 131 N 0.32 0.36 0.00 2.33 5.08 -0.99 -2.54 114.58 119.14 2x17 h GLU 131 Ca 0.09 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 2x17 h GLU 131 Cb -0.02 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2x17 h GLU 131 CO -0.02 0.46 -0.20 0.00 -1.00 0.00 0.00 179.01 178.25 2x17 h ALA 132 N 0.89 1.56 -0.23 3.43 0.00 -1.35 0.69 119.26 124.24 2x17 h ALA 132 Ca 0.07 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 2x17 h ALA 132 Cb 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2x17 h ALA 132 CO -0.00 0.25 -0.44 1.03 0.00 0.00 0.00 179.25 180.09 2x17 h SER 133 N 0.00 0.79 -0.08 0.00 0.87 -0.70 -2.08 113.55 112.35 2x17 h SER 133 Ca -0.00 -0.54 -0.20 0.00 -1.23 0.00 0.00 61.79 59.82 2x17 h SER 133 Cb 0.37 -0.23 0.01 0.00 -0.44 0.00 0.00 62.40 62.12 2x17 h SER 133 CO 0.03 1.18 -0.72 0.58 -0.53 0.00 0.00 176.83 177.37 2x17 h VAL 134 N 0.43 1.33 -0.87 2.23 2.07 -1.14 -3.29 116.25 117.01 2x17 h VAL 134 Ca 0.01 -2.00 -0.02 0.00 0.82 0.00 0.00 66.70 65.51 2x17 h VAL 134 Cb 1.04 2.22 -0.04 0.00 -1.52 0.00 0.00 31.29 32.99 2x17 h VAL 134 CO 0.10 0.61 0.45 0.50 0.02 0.00 0.00 177.57 179.25 2x17 h LYS 135 N 0.28 1.22 -0.93 1.57 1.63 -0.93 -2.04 116.57 117.37 2x17 h LYS 135 Ca -0.07 -0.16 0.08 0.00 -0.85 0.00 0.00 60.65 59.66 2x17 h LYS 135 Cb 1.37 -0.23 -0.07 0.00 -0.60 0.00 0.00 32.23 32.70 2x17 h LYS 135 CO 0.15 0.91 0.58 -0.22 -3.45 0.00 0.00 179.45 177.42 2x17 h LYS 136 N 1.22 0.99 0.09 1.90 3.64 -1.44 -0.81 116.57 122.16 2x17 h LYS 136 Ca 0.30 -0.06 -0.26 0.00 -1.27 0.00 0.00 60.65 59.36 2x17 h LYS 136 Cb 0.06 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 31.67 2x17 h LYS 136 CO -0.04 0.66 -1.15 0.82 -2.27 0.00 0.00 179.45 177.46 2x17 h ILE 137 N 1.02 1.42 -0.68 2.00 2.04 -1.59 -3.07 117.51 118.65 2x17 h ILE 137 Ca 0.42 -2.72 0.03 0.00 1.00 0.00 0.00 64.86 63.60 2x17 h ILE 137 Cb 0.26 2.72 -0.04 0.00 -0.74 0.00 0.00 36.82 39.02 2x17 h ILE 137 CO -0.20 0.81 0.42 0.25 0.00 0.00 0.00 178.15 179.42 2x17 h LEU 138 N 0.17 0.68 -1.41 1.44 6.46 -0.83 -0.61 115.31 121.21 2x17 h LEU 138 Ca -0.13 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.57 2x17 h LEU 138 Cb 1.83 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 41.61 2x17 h LEU 138 CO 0.20 0.47 -0.28 0.44 -0.62 0.00 0.00 178.44 178.65 2x17 h ASP 139 N 0.82 0.00 1.27 1.25 3.32 -1.22 -0.76 116.42 121.10 2x17 h ASP 139 Ca 0.27 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.23 2x17 h ASP 139 Cb 0.03 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 2x17 h ASP 139 CO -0.11 0.28 -0.46 0.11 -1.72 0.00 0.00 179.24 177.34 2x17 h LYS 140 N 0.00 0.00 0.00 3.56 1.57 -1.26 -2.01 116.57 118.43 2x17 h LYS 140 Ca -0.00 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.58 2x17 h LYS 140 Cb 0.59 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 2x17 h LYS 140 CO 0.04 0.46 -1.00 -0.07 -0.57 0.00 0.00 179.45 178.30 2x17 h LEU 141 N 0.00 0.00 -0.75 2.94 3.38 -0.40 -2.78 115.31 117.70 2x17 h LEU 141 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2x17 h LEU 141 Cb 1.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 2x17 h LEU 141 CO 0.06 0.87 -0.50 0.11 0.09 0.00 0.00 178.44 179.07 2x17 h LYS 142 N 0.00 0.32 0.00 1.13 1.57 -1.17 -3.00 116.57 115.41 2x17 h LYS 142 Ca -0.05 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 2x17 h LYS 142 Cb 1.71 0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.03 2x17 h LYS 142 CO 0.10 0.75 0.00 0.35 -0.57 0.00 0.00 179.45 180.08 2x17 h PHE 143 N 0.25 0.00 -2.21 -1.35 3.57 -1.27 -3.32 116.94 112.62 2x17 h PHE 143 Ca 0.01 0.00 -0.58 0.00 3.53 0.00 0.00 57.97 60.93 2x17 h PHE 143 Cb 0.97 0.00 -0.40 0.00 2.79 0.00 0.00 35.95 39.31 2x17 h PHE 143 CO 0.02 0.00 -0.85 0.00 -2.23 0.00 0.00 178.31 175.25 2x17 n ALA 144 N -1.98 3.18 0.15 2.41 0.00 -1.06 -4.97 120.51 118.24 2x17 n ALA 144 Ca 0.01 -3.98 -0.07 0.00 0.00 0.00 0.00 53.44 49.39 2x17 n ALA 144 Cb 0.25 -0.86 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 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 4.36 -0.44 -0.85 0.00 1.57 -1.67 -3.37 116.57 116.18 2x17 h LYS 145 Ca 0.15 0.03 -0.60 0.00 -1.87 0.00 0.00 60.65 58.36 2x17 h LYS 145 Cb 0.79 0.10 -0.38 0.00 0.08 0.00 0.00 32.23 32.82 2x17 h LYS 145 CO 0.62 -0.29 -0.21 -0.25 -0.57 0.00 0.00 179.45 178.74 2x17 n ASP 146 N -4.61 5.92 -3.89 0.86 8.00 -1.26 -4.92 116.55 116.66 2x17 n ASP 146 Ca -0.06 -3.76 -0.30 0.00 0.71 0.00 0.00 54.79 51.38 2x17 n ASP 146 Cb 0.18 -0.57 -0.15 0.00 -0.02 0.00 0.00 41.12 40.56 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 -2.97 4.43 0.27 -2.24 0.15 -1.26 -4.95 113.70 107.14 2x17 s SER 147 Ca 0.56 -1.95 0.25 0.00 0.70 0.00 0.00 55.95 55.51 2x17 s SER 147 Cb 0.45 -1.29 0.98 0.00 -1.71 0.00 0.00 66.02 64.45 2x17 s SER 147 CO 0.02 -0.39 1.74 -0.65 1.20 0.00 0.00 173.24 175.16 2x17 h PRO 148 N 7.79 0.00 -0.20 5.44 0.11 -1.91 -2.87 132.00 140.36 2x17 h PRO 148 Ca -0.08 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.95 2x17 h PRO 148 Cb 1.01 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 2x17 h PRO 148 CO 0.50 0.00 -0.19 1.96 -0.21 0.00 0.00 178.00 180.06 2x17 h GLN 149 N 0.00 0.48 0.00 1.05 7.50 -2.00 -2.41 115.11 119.73 2x17 h GLN 149 Ca 0.00 -0.25 -0.18 0.00 0.50 0.00 0.00 58.65 58.72 2x17 h GLN 149 Cb 0.43 0.01 -0.03 0.00 0.05 0.00 0.00 27.48 27.94 2x17 h GLN 149 CO 0.00 0.82 -0.87 0.82 -1.50 0.00 0.00 178.83 178.11 2x17 h ILE 150 N 0.15 1.62 -0.26 2.54 2.04 -1.95 -2.81 117.51 118.84 2x17 h ILE 150 Ca 0.03 -2.99 -0.07 0.00 1.00 0.00 0.00 64.86 62.83 2x17 h ILE 150 Cb 0.73 2.62 -0.01 0.00 -0.74 0.00 0.00 36.82 39.42 2x17 h ILE 150 CO 0.05 0.85 -0.16 0.25 0.00 0.00 0.00 178.15 179.14 2x17 h LEU 151 N 0.00 0.44 -0.33 1.44 5.85 -1.56 -0.76 115.31 120.39 2x17 h LEU 151 Ca -0.01 -0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 2x17 h LEU 151 Cb 1.55 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.45 2x17 h LEU 151 CO 0.11 0.62 -0.09 0.15 -0.34 0.00 0.00 178.44 178.90 2x17 h PHE 152 N 0.41 0.72 0.00 1.25 3.57 -1.35 -2.67 116.94 118.87 2x17 h PHE 152 Ca 0.07 -0.16 -0.06 0.00 3.53 0.00 0.00 57.97 61.35 2x17 h PHE 152 Cb 0.53 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 2x17 h PHE 152 CO 0.02 0.82 -0.30 0.52 -2.23 0.00 0.00 178.31 177.14 2x17 h MET 153 N 0.42 0.00 -0.16 1.11 2.86 -1.29 -2.95 114.93 114.92 2x17 h MET 153 Ca 0.08 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.53 2x17 h MET 153 Cb 0.59 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.25 2x17 h MET 153 CO 0.03 0.30 -0.68 -0.07 1.06 0.00 0.00 176.91 177.55 2x17 h LEU 154 N 0.00 0.75 -1.12 1.22 3.38 -1.13 -3.07 115.31 115.34 2x17 h LEU 154 Ca -0.00 -0.45 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 2x17 h LEU 154 Cb 0.94 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2x17 h LEU 154 CO 0.04 1.22 0.36 -0.78 0.09 0.00 0.00 178.44 179.36 2x17 h ASP 155 N 0.46 0.87 0.20 -0.43 3.58 -1.30 -2.02 116.42 117.77 2x17 h ASP 155 Ca -0.02 -0.08 -0.13 0.00 0.42 0.00 0.00 57.03 57.21 2x17 h ASP 155 Cb 1.27 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 42.08 2x17 h ASP 155 CO 0.13 0.72 -0.50 0.50 -2.88 0.00 0.00 179.24 177.21 2x17 h LYS 156 N 0.98 0.35 -0.23 0.28 3.64 -1.57 -2.82 116.57 117.20 2x17 h LYS 156 Ca 0.24 -0.20 -0.20 0.00 -1.27 0.00 0.00 60.65 59.22 2x17 h LYS 156 Cb 0.06 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2x17 h LYS 156 CO -0.04 0.78 -0.63 0.93 -2.27 0.00 0.00 179.45 178.21 2x17 h GLU 157 N 0.28 0.82 0.00 1.90 5.08 -1.37 -3.18 114.58 118.10 2x17 h GLU 157 Ca 0.01 -0.57 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 2x17 h GLU 157 Cb 0.98 0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.32 2x17 h GLU 157 CO 0.08 1.19 0.00 1.28 -1.00 0.00 0.00 179.01 180.57 2x17 n LEU 158 N -3.97 0.24 0.13 1.33 4.77 -0.80 -2.94 117.00 115.76 2x17 n LEU 158 Ca -0.05 0.52 0.12 0.00 -0.03 0.00 0.00 56.01 56.58 2x17 n LEU 158 Cb 0.67 -0.45 0.47 0.00 -2.33 0.00 0.00 43.42 41.78 2x17 n LEU 158 CO 0.51 -0.07 0.87 0.77 -1.33 0.00 0.00 177.39 178.14 2x17 h SER 159 N 0.00 0.00 -0.12 -1.43 4.64 -1.47 -2.90 113.55 112.28 2x17 h SER 159 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2x17 h SER 159 Cb 0.55 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.63 2x17 h SER 159 CO 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 176.83 175.93 2x17 h ALA 160 N 2.33 1.50 -2.45 5.18 0.00 -1.67 -3.39 119.26 120.76 2x17 h ALA 160 Ca 0.00 -0.17 -0.60 0.00 0.00 0.00 0.00 54.91 54.13 2x17 h ALA 160 Cb 0.49 -0.11 -0.11 0.00 0.00 0.00 0.00 17.79 18.06 2x17 h ALA 160 CO 0.00 0.36 0.21 0.50 0.00 0.00 0.00 179.25 180.32 2x17 s ARG 161 N -4.91 4.14 0.07 0.00 3.52 -1.09 -5.06 118.95 115.61 2x17 s ARG 161 Ca -0.06 0.63 0.04 0.00 -0.13 0.00 0.00 55.73 56.20 2x17 s ARG 161 Cb 0.16 -3.64 -0.03 0.00 -1.56 0.00 0.00 34.95 29.88 2x17 s ARG 161 CO 0.74 -0.41 -0.11 0.00 -0.81 0.00 0.00 175.30 174.71 2x17 s ALA 162 N 2.49 0.96 0.58 6.12 0.00 -1.26 -3.49 121.76 127.15 2x17 s ALA 162 Ca 0.28 -0.97 -0.21 0.00 0.00 0.00 0.00 51.96 51.06 2x17 s ALA 162 Cb -0.15 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 2x17 s ALA 162 CO 0.08 0.05 1.34 -1.25 0.00 0.00 0.00 175.76 175.98 2x17 s PRO 163 N -1.97 2.97 -0.04 0.00 0.04 -1.26 -4.74 135.00 130.00 2x17 s PRO 163 Ca -0.03 2.17 0.17 0.00 0.04 0.00 0.00 61.00 63.36 2x17 s PRO 163 Cb -0.08 -2.13 -0.26 0.00 0.04 0.00 0.00 34.50 32.07 2x17 s PRO 163 CO 0.01 -1.30 0.34 1.63 0.04 0.00 0.00 177.00 177.71 2x17 n LYS 164 N -1.29 0.65 -0.04 4.56 5.02 -1.26 -4.63 118.16 121.16 2x17 n LYS 164 Ca 0.12 -0.14 -0.14 0.00 -2.02 0.00 0.00 58.31 56.13 2x17 n LYS 164 Cb 0.46 -1.42 -0.08 0.00 -0.02 0.00 0.00 35.03 33.97 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 0.40 -0.87 -0.35 5.85 -1.98 -3.37 115.31 114.99 2x17 h LEU 165 Ca -0.06 -0.56 0.22 0.00 0.84 0.00 0.00 57.88 58.32 2x17 h LEU 165 Cb 0.97 -0.12 -0.13 0.00 0.37 0.00 0.00 40.66 41.76 2x17 h LEU 165 CO 0.00 0.89 0.28 -0.65 -0.34 0.00 0.00 178.44 178.63 2x17 h PRO 166 N -0.07 0.26 -0.51 5.25 0.11 -1.99 -0.74 132.00 134.31 2x17 h PRO 166 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2x17 h PRO 166 Cb 0.83 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2x17 h PRO 166 CO 0.05 0.17 0.00 0.41 -0.21 0.00 0.00 178.00 178.43 2x17 n GLY 167 N -1.36 0.43 0.01 -0.55 0.00 -1.26 -3.65 105.19 98.81 2x17 n GLY 167 Ca 0.21 -0.06 -0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.15 0.00 0.00 0.99 4.77 -0.29 -5.05 117.00 117.27 2x17 n LEU 168 Ca 0.02 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.72 2x17 n LEU 168 Cb 0.18 0.03 0.20 0.00 -2.33 0.00 0.00 43.42 41.51 2x17 n LEU 168 CO 0.02 0.03 0.76 0.18 -1.33 0.00 0.00 177.39 177.05 2x17 n LEU 169 N -1.86 0.00 -4.71 2.23 7.99 -1.23 -5.00 117.00 114.42 2x17 n LEU 169 Ca -0.02 -1.30 -0.40 0.00 -0.01 0.00 0.00 56.01 54.27 2x17 n LEU 169 Cb 0.35 -0.96 0.02 0.00 -0.11 0.00 0.00 43.42 42.72 2x17 n LEU 169 CO 0.05 -1.57 0.91 1.15 -1.51 0.00 0.00 177.39 176.41 2x17 n MET 170 N -3.91 1.91 -4.36 3.23 0.00 -1.26 -5.00 117.12 107.72 2x17 n MET 170 Ca 0.15 0.68 -0.23 0.00 0.00 0.00 0.00 57.70 58.31 2x17 n MET 170 Cb 0.55 -2.44 -0.11 0.00 0.00 0.00 0.00 33.22 31.22 2x17 n MET 170 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 175.97 174.83 2x17 s GLN 171 N -2.36 1.36 0.00 3.17 2.00 -1.26 -5.10 119.66 117.48 2x17 s GLN 171 Ca 0.63 -1.47 0.00 0.00 -2.00 0.00 0.00 55.36 52.52 2x17 s GLN 171 Cb -0.48 -1.47 0.00 0.00 0.80 0.00 0.00 33.01 31.86 2x17 s GLN 171 CO 0.56 0.30 0.00 0.41 -0.50 0.00 0.00 175.29 176.06