#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x17 n LEU 2 N 0.00 5.66 -4.82 3.17 4.77 -1.26 -5.02 117.00 119.50 2x17 n LEU 2 Ca 0.00 0.88 -0.30 0.00 -0.03 0.00 0.00 56.01 56.56 2x17 n LEU 2 Cb 0.00 -1.55 0.08 0.00 -2.33 0.00 0.00 43.42 39.62 2x17 n LEU 2 CO 0.00 -0.93 0.72 -0.94 -1.33 0.00 0.00 177.39 174.91 2x17 s SER 3 N -1.20 4.79 0.34 -1.43 1.04 -1.26 -4.89 113.70 111.08 2x17 s SER 3 Ca 0.78 1.33 0.04 0.00 0.48 0.00 0.00 55.95 58.59 2x17 s SER 3 Cb -0.40 -2.10 0.61 0.00 0.10 0.00 0.00 66.02 64.23 2x17 s SER 3 CO 0.44 -1.78 1.88 -0.08 0.98 0.00 0.00 173.24 174.68 2x17 h GLU 4 N -0.96 0.54 -0.28 4.02 4.81 -2.00 -1.78 114.58 118.94 2x17 h GLU 4 Ca -0.46 -0.11 -0.19 0.00 -0.13 0.00 0.00 59.36 58.47 2x17 h GLU 4 Cb 1.26 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2x17 h GLU 4 CO 0.60 0.55 -0.56 -0.09 -0.73 0.00 0.00 179.01 178.78 2x17 h ARG 5 N 0.52 0.87 -0.42 1.92 2.43 -2.00 -2.87 114.38 114.84 2x17 h ARG 5 Ca 0.11 -0.56 -0.07 0.00 -0.81 0.00 0.00 59.98 58.65 2x17 h ARG 5 Cb 0.30 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2x17 h ARG 5 CO 0.01 1.19 -0.03 1.98 -1.51 0.00 0.00 179.97 181.61 2x17 h MET 6 N 0.65 0.76 -0.80 0.20 4.05 -1.87 -2.01 114.93 115.90 2x17 h MET 6 Ca 0.01 -0.26 -0.01 0.00 -0.28 0.00 0.00 59.70 59.16 2x17 h MET 6 Cb 1.17 -0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 31.87 2x17 h MET 6 CO 0.12 0.85 0.44 1.25 0.23 0.00 0.00 176.91 179.81 2x17 h LEU 7 N 0.58 0.99 -0.62 3.39 5.85 -1.39 -0.23 115.31 123.88 2x17 h LEU 7 Ca 0.11 -0.08 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 2x17 h LEU 7 Cb 0.53 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 2x17 h LEU 7 CO 0.03 0.80 -0.07 0.50 -0.34 0.00 0.00 178.44 179.35 2x17 h LYS 8 N 1.12 1.01 -0.11 1.25 3.64 -1.37 -1.41 116.57 120.70 2x17 h LYS 8 Ca 0.28 -0.35 -0.17 0.00 -1.27 0.00 0.00 60.65 59.14 2x17 h LYS 8 Cb 0.02 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 2x17 h LYS 8 CO -0.05 1.03 -0.65 0.00 -2.27 0.00 0.00 179.45 177.51 2x17 h ALA 9 N 1.00 0.66 -0.34 5.00 0.00 -0.96 -1.84 119.26 122.78 2x17 h ALA 9 Ca 0.15 -0.57 -0.16 0.00 0.00 0.00 0.00 54.91 54.34 2x17 h ALA 9 Cb 0.62 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2x17 h ALA 9 CO 0.04 0.73 -0.40 -0.07 0.00 0.00 0.00 179.25 179.55 2x17 h LEU 10 N 0.31 0.94 -1.29 0.00 3.38 -1.00 -2.42 115.31 115.23 2x17 h LEU 10 Ca -0.02 -0.48 -0.06 0.00 0.09 0.00 0.00 57.88 57.41 2x17 h LEU 10 Cb 1.21 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 2x17 h LEU 10 CO 0.11 1.24 -0.11 0.78 0.09 0.00 0.00 178.44 180.55 2x17 h ASN 11 N 0.67 0.33 0.48 -0.43 2.35 -1.23 -1.93 115.58 115.81 2x17 h ASN 11 Ca 0.05 -0.07 -0.17 0.00 -0.55 0.00 0.00 56.30 55.55 2x17 h ASN 11 Cb 1.00 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.27 2x17 h ASN 11 CO 0.10 0.48 -0.76 0.44 -1.65 0.00 0.00 177.43 176.04 2x17 h ASP 12 N 0.33 0.27 0.19 5.81 3.45 -1.25 -2.39 116.42 122.83 2x17 h ASP 12 Ca 0.07 -0.19 -0.20 0.00 0.43 0.00 0.00 57.03 57.14 2x17 h ASP 12 Cb 0.40 -0.08 -0.00 0.00 -0.56 0.00 0.00 39.33 39.09 2x17 h ASP 12 CO 0.02 0.92 -0.78 -0.61 -1.57 0.00 0.00 179.24 177.22 2x17 h GLN 13 N 0.14 0.48 -0.96 3.56 5.75 -1.29 -0.03 115.11 122.76 2x17 h GLN 13 Ca -0.03 -0.42 0.10 0.00 -0.15 0.00 0.00 58.65 58.15 2x17 h GLN 13 Cb 1.33 0.09 -0.08 0.00 1.07 0.00 0.00 27.48 29.90 2x17 h GLN 13 CO 0.12 1.06 0.60 1.25 -2.65 0.00 0.00 178.83 179.20 2x17 h LEU 14 N 0.32 0.90 -0.60 -2.39 6.46 -1.32 0.15 115.31 118.82 2x17 h LEU 14 Ca -0.05 0.03 -0.15 0.00 -0.12 0.00 0.00 57.88 57.60 2x17 h LEU 14 Cb 1.38 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 41.15 2x17 h LEU 14 CO 0.14 0.52 -0.56 -1.13 -0.62 0.00 0.00 178.44 176.79 2x17 h ASN 15 N 1.01 0.45 0.07 1.25 -0.73 -1.18 -2.73 115.58 113.70 2x17 h ASN 15 Ca 0.45 -0.24 -0.13 0.00 1.87 0.00 0.00 56.30 58.25 2x17 h ASN 15 Cb 0.35 -0.13 -0.01 0.00 0.27 0.00 0.00 38.32 38.80 2x17 h ASN 15 CO -0.23 0.92 -0.42 0.03 -0.37 0.00 0.00 177.43 177.36 2x17 h ARG 16 N 0.31 0.45 -0.25 6.67 3.08 -0.04 -2.52 114.38 122.07 2x17 h ARG 16 Ca 0.00 -0.23 -0.17 0.00 0.07 0.00 0.00 59.98 59.66 2x17 h ARG 16 Cb 1.08 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.13 2x17 h ARG 16 CO 0.10 0.79 -0.53 0.93 -1.07 0.00 0.00 179.97 180.19 2x17 h GLU 17 N 0.37 0.72 -0.11 0.04 4.39 -0.72 -2.52 114.58 116.74 2x17 h GLU 17 Ca 0.03 -0.44 -0.10 0.00 0.34 0.00 0.00 59.36 59.18 2x17 h GLU 17 Cb 0.89 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.58 2x17 h GLU 17 CO 0.08 1.07 -0.39 -0.07 -1.16 0.00 0.00 179.01 178.53 2x17 h LEU 18 N 0.56 0.25 -0.60 1.33 3.38 -1.44 -2.67 115.31 116.12 2x17 h LEU 18 Ca 0.02 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 2x17 h LEU 18 Cb 1.10 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 2x17 h LEU 18 CO 0.11 0.62 -0.55 0.22 0.09 0.00 0.00 178.44 178.93 2x17 h TYR 19 N 0.20 0.54 -0.44 1.13 3.20 -1.40 -2.36 116.97 117.83 2x17 h TYR 19 Ca 0.02 -0.19 0.03 0.00 3.14 0.00 0.00 58.73 61.73 2x17 h TYR 19 Cb 0.79 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.92 2x17 h TYR 19 CO 0.01 0.88 0.23 0.77 -1.64 0.00 0.00 178.16 178.42 2x17 h SER 20 N 0.33 0.35 -0.38 -2.11 0.02 -1.20 0.38 113.55 110.94 2x17 h SER 20 Ca 0.01 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.03 2x17 h SER 20 Cb 1.07 -0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.51 2x17 h SER 20 CO 0.10 0.25 0.11 0.00 -1.14 0.00 0.00 176.83 176.14 2x17 h ALA 21 N 1.23 0.43 -0.12 3.77 0.00 -1.39 -0.42 119.26 122.76 2x17 h ALA 21 Ca 0.19 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 2x17 h ALA 21 Cb 0.08 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2x17 h ALA 21 CO -0.12 -0.29 -0.43 -0.92 0.00 0.00 0.00 179.25 177.49 2x17 h TYR 22 N 0.25 0.32 -0.36 0.00 -0.00 -0.87 0.07 116.97 116.37 2x17 h TYR 22 Ca 0.18 -0.09 -0.16 0.00 -0.00 0.00 0.00 58.73 58.66 2x17 h TYR 22 Cb 0.18 -0.07 -0.01 0.00 -0.00 0.00 0.00 36.73 36.84 2x17 h TYR 22 CO -0.17 0.66 -0.41 1.25 -0.00 0.00 0.00 178.16 179.49 2x17 h LEU 23 N 0.22 0.97 -0.84 2.82 5.85 0.03 -1.13 115.31 123.23 2x17 h LEU 23 Ca 0.02 -0.45 -0.10 0.00 0.84 0.00 0.00 57.88 58.18 2x17 h LEU 23 Cb 0.85 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2x17 h LEU 23 CO 0.07 1.25 -0.49 1.88 -0.34 0.00 0.00 178.44 180.80 2x17 h TYR 24 N 0.73 0.00 0.00 1.25 0.05 -0.83 -0.59 116.97 117.58 2x17 h TYR 24 Ca 0.05 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.72 2x17 h TYR 24 Cb 1.00 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.72 2x17 h TYR 24 CO 0.06 0.49 -0.52 0.35 -1.05 0.00 0.00 178.16 177.49 2x17 h PHE 25 N 0.00 0.00 -0.10 4.88 -0.00 -0.88 -0.49 116.94 120.34 2x17 h PHE 25 Ca -0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 57.97 57.75 2x17 h PHE 25 Cb 1.00 0.00 0.01 0.00 -0.00 0.00 0.00 35.95 36.95 2x17 h PHE 25 CO 0.00 0.52 -0.80 0.00 -0.00 0.00 0.00 178.31 178.03 2x17 h ALA 26 N 1.48 0.39 -0.18 2.41 0.00 -0.71 -2.75 119.26 119.90 2x17 h ALA 26 Ca -0.01 -0.62 -0.13 0.00 0.00 0.00 0.00 54.91 54.15 2x17 h ALA 26 Cb 1.05 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2x17 h ALA 26 CO 0.07 0.72 -0.44 0.52 0.00 0.00 0.00 179.25 180.11 2x17 h MET 27 N 0.42 0.44 -0.87 0.00 2.86 -1.02 -2.26 114.93 114.50 2x17 h MET 27 Ca -0.05 -0.23 0.02 0.00 -2.06 0.00 0.00 59.70 57.37 2x17 h MET 27 Cb 1.42 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 33.04 2x17 h MET 27 CO 0.15 0.80 0.57 0.00 1.06 0.00 0.00 176.91 179.50 2x17 h ALA 28 N 1.16 1.13 -0.58 6.32 0.00 -1.08 -1.42 119.26 124.80 2x17 h ALA 28 Ca 0.03 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 2x17 h ALA 28 Cb 0.93 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2x17 h ALA 28 CO 0.08 0.46 0.04 0.00 0.00 0.00 0.00 179.25 179.83 2x17 h ALA 29 N 1.34 0.97 -0.45 0.00 0.00 -1.29 -1.76 119.26 118.07 2x17 h ALA 29 Ca 0.33 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2x17 h ALA 29 Cb -0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2x17 h ALA 29 CO -0.09 0.63 0.15 -0.92 0.00 0.00 0.00 179.25 179.02 2x17 h TYR 30 N 0.90 0.72 -0.15 0.00 3.20 -0.82 -2.28 116.97 118.54 2x17 h TYR 30 Ca 0.17 -0.07 -0.17 0.00 3.14 0.00 0.00 58.73 61.80 2x17 h TYR 30 Cb 0.48 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.53 2x17 h TYR 30 CO 0.03 0.64 -0.62 0.74 -1.64 0.00 0.00 178.16 177.31 2x17 h PHE 31 N 0.59 0.65 -0.45 -3.82 0.04 -1.25 -3.09 116.94 109.61 2x17 h PHE 31 Ca 0.15 -0.25 -0.03 0.00 2.80 0.00 0.00 57.97 60.63 2x17 h PHE 31 Cb 0.25 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 38.26 2x17 h PHE 31 CO 0.01 0.99 0.16 1.49 -0.60 0.00 0.00 178.31 180.36 2x17 h GLU 32 N 0.38 0.66 -0.48 1.51 4.57 -1.23 0.35 114.58 120.34 2x17 h GLU 32 Ca -0.01 -0.10 -0.08 0.00 -1.18 0.00 0.00 59.36 58.00 2x17 h GLU 32 Cb 1.17 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.62 2x17 h GLU 32 CO 0.11 0.57 -0.01 0.22 -1.18 0.00 0.00 179.01 178.72 2x17 h ASP 33 N 0.65 0.77 0.13 1.04 3.58 -1.35 -2.49 116.42 118.75 2x17 h ASP 33 Ca 0.16 -0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.41 2x17 h ASP 33 Cb 0.17 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.02 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 -0.41 2.28 4.77 -0.84 -4.87 117.00 113.71 2x17 n LEU 34 Ca 0.02 0.07 -0.05 0.00 -0.03 0.00 0.00 56.01 56.03 2x17 n LEU 34 Cb 0.31 -0.07 -0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2x17 n LEU 34 CO 0.42 -0.00 -0.05 0.61 -1.33 0.00 0.00 177.39 177.03 2x17 n GLY 35 N 0.94 0.58 3.32 -0.72 0.00 -0.94 -4.98 105.19 103.39 2x17 n GLY 35 Ca 0.20 -0.81 -0.45 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.15 6.36 0.36 0.99 1.43 0.06 -4.89 118.68 121.84 2x17 s LEU 36 Ca 0.00 -3.40 0.15 0.00 -1.03 0.00 0.00 54.13 49.84 2x17 s LEU 36 Cb 0.00 -2.18 0.70 0.00 0.03 0.00 0.00 46.19 44.74 2x17 s LEU 36 CO 0.00 -0.34 1.78 -0.33 0.23 0.00 0.00 176.35 177.69 2x17 h GLU 37 N 6.86 0.00 -0.12 1.70 5.08 -1.91 -2.37 114.58 123.82 2x17 h GLU 37 Ca 0.16 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2x17 h GLU 37 Cb 0.91 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 2x17 h GLU 37 CO 0.94 0.41 -0.05 0.78 -1.00 0.00 0.00 179.01 180.08 2x17 h GLY 38 N 1.46 0.27 1.02 -3.84 0.00 -1.90 -1.08 103.07 98.99 2x17 h GLY 38 Ca -0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 2x17 h GLY 38 CO 0.05 0.21 0.37 0.74 0.00 0.00 0.00 176.54 177.91 2x17 h PHE 39 N -0.10 1.11 -0.18 5.60 -1.00 -1.76 -1.88 116.94 118.74 2x17 h PHE 39 Ca 0.03 -0.06 -0.01 0.00 2.81 0.00 0.00 57.97 60.75 2x17 h PHE 39 Cb 0.50 -0.34 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 2x17 h PHE 39 CO 0.06 0.82 0.09 0.00 -1.61 0.00 0.00 178.31 177.67 2x17 h ALA 40 N 1.19 0.23 -0.43 2.45 0.00 -1.36 -1.43 119.26 119.90 2x17 h ALA 40 Ca 0.26 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2x17 h ALA 40 Cb 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2x17 h ALA 40 CO -0.03 -0.21 -0.05 -0.91 0.00 0.00 0.00 179.25 178.05 2x17 h ASN 41 N 0.16 0.71 -0.77 0.00 4.21 -1.17 -1.56 115.58 117.17 2x17 h ASN 41 Ca 0.06 -0.18 -0.00 0.00 1.21 0.00 0.00 56.30 57.39 2x17 h ASN 41 Cb 0.12 -0.19 -0.04 0.00 -1.12 0.00 0.00 38.32 37.09 2x17 h ASN 41 CO -0.01 0.81 0.48 -0.25 -1.29 0.00 0.00 177.43 177.17 2x17 h TRP 42 N 0.68 1.00 -0.28 1.19 7.01 -1.16 -1.05 115.95 123.34 2x17 h TRP 42 Ca 0.13 0.01 -0.14 0.00 2.11 0.00 0.00 58.89 60.99 2x17 h TRP 42 Cb 0.49 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 27.21 2x17 h TRP 42 CO 0.02 0.66 -0.40 0.52 -2.79 0.00 0.00 178.44 176.45 2x17 h MET 43 N 1.04 0.66 -0.52 2.65 2.86 -0.95 -1.19 114.93 119.49 2x17 h MET 43 Ca 0.28 -0.34 -0.06 0.00 -2.06 0.00 0.00 59.70 57.51 2x17 h MET 43 Cb -0.06 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 2x17 h MET 43 CO -0.05 0.95 0.09 0.87 1.06 0.00 0.00 176.91 179.82 2x17 h LYS 44 N 0.54 0.86 -0.23 1.72 1.57 -1.06 0.91 116.57 120.87 2x17 h LYS 44 Ca 0.04 -0.23 -0.09 0.00 -1.87 0.00 0.00 60.65 58.51 2x17 h LYS 44 Cb 0.93 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 2x17 h LYS 44 CO 0.08 0.84 -0.25 0.00 -0.57 0.00 0.00 179.45 179.56 2x17 h ALA 45 N 0.98 1.15 -0.28 3.86 0.00 -1.12 -2.12 119.26 121.72 2x17 h ALA 45 Ca 0.16 -0.33 -0.17 0.00 0.00 0.00 0.00 54.91 54.56 2x17 h ALA 45 Cb 0.40 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2x17 h ALA 45 CO 0.01 0.54 -0.51 0.37 0.00 0.00 0.00 179.25 179.66 2x17 h GLN 46 N 0.38 0.80 -0.64 0.00 5.75 -0.99 -2.99 115.11 117.43 2x17 h GLN 46 Ca 0.06 -0.49 -0.02 0.00 -0.15 0.00 0.00 58.65 58.05 2x17 h GLN 46 Cb 0.64 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.21 2x17 h GLN 46 CO 0.05 1.12 0.32 0.00 -2.65 0.00 0.00 178.83 177.67 2x17 h ALA 47 N 0.79 1.36 -0.67 3.38 0.00 -0.56 -2.50 119.26 121.07 2x17 h ALA 47 Ca 0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2x17 h ALA 47 Cb 1.09 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2x17 h ALA 47 CO 0.11 0.51 0.24 0.93 0.00 0.00 0.00 179.25 181.04 2x17 h GLU 48 N 0.90 1.01 -0.71 0.00 5.08 -1.35 -2.46 114.58 117.05 2x17 h GLU 48 Ca 0.22 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2x17 h GLU 48 Cb 0.07 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 2x17 h GLU 48 CO -0.03 0.86 0.41 0.93 -1.00 0.00 0.00 179.01 180.18 2x17 h GLU 49 N 0.95 0.97 -0.50 2.33 4.39 -1.31 -1.91 114.58 119.50 2x17 h GLU 49 Ca 0.22 -0.09 -0.10 0.00 0.34 0.00 0.00 59.36 59.73 2x17 h GLU 49 Cb 0.24 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2x17 h GLU 49 CO -0.01 0.69 -0.08 0.93 -1.16 0.00 0.00 179.01 179.37 2x17 h GLU 50 N 0.98 0.90 -0.59 2.33 4.39 -1.19 -1.42 114.58 119.98 2x17 h GLU 50 Ca 0.26 -0.30 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 2x17 h GLU 50 Cb -0.02 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.53 2x17 h GLU 50 CO -0.05 0.95 0.25 0.82 -1.16 0.00 0.00 179.01 179.82 2x17 h ILE 51 N 0.81 1.21 -0.45 3.13 2.04 -0.98 -1.39 117.51 121.88 2x17 h ILE 51 Ca 0.14 -0.63 -0.06 0.00 1.00 0.00 0.00 64.86 65.31 2x17 h ILE 51 Cb 0.60 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2x17 h ILE 51 CO 0.04 0.25 0.02 1.23 0.00 0.00 0.00 178.15 179.69 2x17 h GLY 52 N 0.95 0.78 1.00 5.37 0.00 -0.87 -1.63 103.07 108.67 2x17 h GLY 52 Ca 0.20 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 2x17 h GLY 52 CO -0.02 0.46 -0.02 0.45 0.00 0.00 0.00 176.54 177.41 2x17 h HIS 53 N 0.69 0.93 -0.28 5.60 3.86 -0.68 -2.54 115.15 122.73 2x17 h HIS 53 Ca 0.14 -0.17 -0.06 0.00 -1.16 0.00 0.00 60.37 59.12 2x17 h HIS 53 Cb 0.40 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.61 2x17 h HIS 53 CO 0.02 0.89 -0.09 0.00 0.86 0.00 0.00 177.93 179.61 2x17 h ALA 54 N 0.91 1.33 0.00 2.45 0.00 -1.07 -2.35 119.26 120.54 2x17 h ALA 54 Ca 0.13 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 2x17 h ALA 54 Cb 0.53 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2x17 h ALA 54 CO 0.03 0.45 -0.29 -0.07 0.00 0.00 0.00 179.25 179.37 2x17 h LEU 55 N 0.43 0.00 -0.35 0.00 3.38 -1.13 -1.85 115.31 115.79 2x17 h LEU 55 Ca 0.09 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.87 2x17 h LEU 55 Cb 0.42 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 2x17 h LEU 55 CO 0.02 0.29 -0.67 0.03 0.09 0.00 0.00 178.44 178.20 2x17 h ARG 56 N 0.00 0.62 -0.35 1.13 3.08 -1.00 -0.55 114.38 117.31 2x17 h ARG 56 Ca -0.00 -0.46 -0.15 0.00 0.07 0.00 0.00 59.98 59.44 2x17 h ARG 56 Cb 0.70 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 2x17 h ARG 56 CO 0.04 1.08 -0.37 0.74 -1.07 0.00 0.00 179.97 180.39 2x17 h PHE 57 N 0.44 0.98 -0.60 3.04 0.04 -1.39 -1.39 116.94 118.06 2x17 h PHE 57 Ca -0.02 -0.28 0.04 0.00 2.80 0.00 0.00 57.97 60.51 2x17 h PHE 57 Cb 1.26 -0.21 -0.05 0.00 2.20 0.00 0.00 35.95 39.15 2x17 h PHE 57 CO 0.06 1.06 0.34 -0.92 -0.60 0.00 0.00 178.31 178.25 2x17 h TYR 58 N 0.68 0.63 -0.32 -0.55 5.03 -1.25 -2.15 116.97 119.04 2x17 h TYR 58 Ca 0.06 0.02 -0.16 0.00 2.58 0.00 0.00 58.73 61.23 2x17 h TYR 58 Cb 0.93 -0.20 -0.01 0.00 1.55 0.00 0.00 36.73 39.01 2x17 h TYR 58 CO 0.05 0.33 -0.44 -0.91 -1.32 0.00 0.00 178.16 175.87 2x17 h ASN 59 N 0.65 0.87 -0.35 -2.11 2.35 -0.96 -3.19 115.58 112.85 2x17 h ASN 59 Ca 0.26 -0.42 -0.09 0.00 -0.55 0.00 0.00 56.30 55.50 2x17 h ASN 59 Cb 0.11 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 2x17 h ASN 59 CO -0.14 1.18 -0.14 0.22 -1.65 0.00 0.00 177.43 176.90 2x17 h TYR 60 N 0.65 0.81 -0.42 1.19 3.20 -1.13 -2.60 116.97 118.67 2x17 h TYR 60 Ca 0.04 -0.19 0.04 0.00 3.14 0.00 0.00 58.73 61.76 2x17 h TYR 60 Cb 1.01 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 39.04 2x17 h TYR 60 CO 0.06 0.90 0.18 0.82 -1.64 0.00 0.00 178.16 178.47 2x17 h ILE 61 N 0.50 0.92 0.00 1.81 2.04 -1.44 -2.03 117.51 119.31 2x17 h ILE 61 Ca 0.08 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 2x17 h ILE 61 Cb 0.67 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2x17 h ILE 61 CO 0.05 0.07 -0.07 1.88 0.00 0.00 0.00 178.15 180.07 2x17 h TYR 62 N 0.37 0.00 0.00 1.37 0.05 -1.58 0.53 116.97 117.70 2x17 h TYR 62 Ca 0.19 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.89 2x17 h TYR 62 Cb 0.14 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 2x17 h TYR 62 CO -0.13 0.07 -0.39 -0.44 -1.05 0.00 0.00 178.16 176.23 2x17 h ASP 63 N 0.00 0.00 -0.60 3.88 3.32 -0.99 -3.10 116.42 118.94 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 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 2x17 h ASP 63 CO 0.01 0.39 0.00 0.54 -1.72 0.00 0.00 179.24 178.46 2x17 n ARG 64 N -3.52 4.70 -2.30 3.56 5.12 -0.82 -4.93 116.66 118.46 2x17 n ARG 64 Ca -0.00 -3.12 -0.16 0.00 -1.93 0.00 0.00 57.85 52.63 2x17 n ARG 64 Cb 0.53 -2.20 -0.01 0.00 -1.16 0.00 0.00 32.46 29.62 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 0.74 -4.80 -1.68 0.55 5.15 -1.17 -4.15 115.26 109.90 2x17 n ASN 65 Ca 0.28 -0.01 0.00 0.00 -0.60 0.00 0.00 54.58 54.24 2x17 n ASN 65 Cb 1.14 -3.92 0.00 0.00 -0.53 0.00 0.00 39.78 36.48 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 1.45 2.81 8.20 0.00 0.15 -4.97 105.19 111.81 2x17 n GLY 66 Ca -0.19 -2.04 -0.17 0.00 0.00 0.00 0.00 46.02 43.62 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 -1.18 0.26 -0.05 1.61 6.06 -1.26 -4.54 118.95 119.84 2x17 s ARG 67 Ca 0.00 0.10 -0.23 0.00 -2.50 0.00 0.00 55.73 53.10 2x17 s ARG 67 Cb 0.00 -0.47 -0.04 0.00 0.06 0.00 0.00 34.95 34.50 2x17 s ARG 67 CO 0.00 -0.15 0.68 0.08 -2.50 0.00 0.00 175.30 173.41 2x17 s VAL 68 N 1.09 5.01 -0.14 7.11 1.01 -1.26 -5.00 120.40 128.22 2x17 s VAL 68 Ca -0.09 1.40 0.01 0.00 0.00 0.00 0.00 61.98 63.30 2x17 s VAL 68 Cb -0.13 -4.02 0.02 0.00 0.00 0.00 0.00 36.38 32.25 2x17 s VAL 68 CO -0.02 0.29 -0.15 -0.70 0.00 0.00 0.00 175.10 174.52 2x17 s GLU 69 N 0.55 2.38 -0.29 2.72 2.12 -1.26 -5.12 118.70 119.81 2x17 s GLU 69 Ca 0.36 -0.60 -0.18 0.00 0.36 0.00 0.00 54.97 54.91 2x17 s GLU 69 Cb -0.18 -2.11 -0.02 0.00 0.26 0.00 0.00 34.13 32.08 2x17 s GLU 69 CO 0.18 -0.17 0.51 -0.51 -0.54 0.00 0.00 175.26 174.73 2x17 s LEU 70 N 1.29 4.14 0.60 2.70 1.43 -1.26 -4.91 118.68 122.67 2x17 s LEU 70 Ca 0.01 0.33 -0.01 0.00 -1.03 0.00 0.00 54.13 53.42 2x17 s LEU 70 Cb -0.14 -2.63 0.04 0.00 0.03 0.00 0.00 46.19 43.49 2x17 s LEU 70 CO -0.08 -0.36 0.85 -1.81 0.23 0.00 0.00 176.35 175.18 2x17 s ASP 71 N 1.63 5.15 0.51 2.29 1.01 -1.26 -5.06 116.67 120.95 2x17 s ASP 71 Ca 0.20 0.15 -0.22 0.00 0.71 0.00 0.00 52.55 53.39 2x17 s ASP 71 Cb -0.15 -0.97 -0.06 0.00 1.01 0.00 0.00 42.92 42.74 2x17 s ASP 71 CO 0.11 -1.27 1.33 -1.83 0.21 0.00 0.00 175.17 173.72 2x17 s GLU 72 N -4.91 3.34 -0.37 8.23 -1.05 -1.26 -5.00 118.70 117.68 2x17 s GLU 72 Ca 0.58 2.17 -0.13 0.00 -0.15 0.00 0.00 54.97 57.43 2x17 s GLU 72 Cb -0.10 -2.35 0.00 0.00 -0.44 0.00 0.00 34.13 31.24 2x17 s GLU 72 CO 0.40 -1.01 0.26 0.42 0.95 0.00 0.00 175.26 176.28 2x17 s ILE 73 N -1.33 5.20 0.71 1.83 1.01 -1.26 -5.07 121.20 122.28 2x17 s ILE 73 Ca 0.68 -0.44 -0.14 0.00 0.00 0.00 0.00 60.65 60.75 2x17 s ILE 73 Cb -0.39 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 38.34 2x17 s ILE 73 CO 0.46 -0.14 1.14 -2.16 0.00 0.00 0.00 174.94 174.25 2x17 s PRO 74 N 1.69 2.44 0.08 2.79 0.04 -1.26 -4.95 135.00 135.83 2x17 s PRO 74 Ca 0.05 1.49 -0.31 0.00 0.04 0.00 0.00 61.00 62.28 2x17 s PRO 74 Cb -0.18 -1.90 -0.09 0.00 0.04 0.00 0.00 34.50 32.38 2x17 s PRO 74 CO 0.10 -1.55 1.70 0.21 0.04 0.00 0.00 177.00 177.50 2x17 s LYS 75 N -4.15 4.18 0.53 4.56 2.20 -1.26 -5.01 119.74 120.80 2x17 s LYS 75 Ca 0.69 2.39 -0.09 0.00 -0.36 0.00 0.00 55.97 58.60 2x17 s LYS 75 Cb -0.23 -3.63 -0.04 0.00 -1.51 0.00 0.00 37.83 32.42 2x17 s LYS 75 CO 0.45 -0.77 0.90 -1.25 -0.36 0.00 0.00 175.35 174.32 2x17 s PRO 76 N 2.76 3.62 0.45 4.03 0.04 -1.26 -5.03 135.00 139.60 2x17 s PRO 76 Ca 0.76 0.51 -0.25 0.00 0.04 0.00 0.00 61.00 62.06 2x17 s PRO 76 Cb -0.41 -2.24 -0.09 0.00 0.04 0.00 0.00 34.50 31.81 2x17 s PRO 76 CO 0.33 -0.35 1.38 -2.30 0.04 0.00 0.00 177.00 176.10 2x17 n PRO 77 N -2.32 2.12 -0.05 0.56 -0.02 -1.26 -4.97 135.00 129.06 2x17 n PRO 77 Ca 0.03 0.76 -0.17 0.00 -2.02 0.00 0.00 63.50 62.10 2x17 n PRO 77 Cb 0.54 -2.55 -0.13 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 2.18 0.08 -5.77 -0.52 3.64 -1.96 -3.45 116.57 110.77 2x17 h LYS 78 Ca -0.50 -0.13 -0.50 0.00 -1.27 0.00 0.00 60.65 58.25 2x17 h LYS 78 Cb 1.28 0.05 -0.15 0.00 -0.41 0.00 0.00 32.23 33.00 2x17 h LYS 78 CO 0.60 1.06 -0.75 -1.21 -2.27 0.00 0.00 179.45 176.89 2x17 s GLU 79 N -2.31 1.41 0.05 1.90 2.02 -1.26 -4.70 118.70 115.81 2x17 s GLU 79 Ca -0.20 -1.61 0.02 0.00 0.02 0.00 0.00 54.97 53.19 2x17 s GLU 79 Cb 0.00 -1.31 -0.03 0.00 0.10 0.00 0.00 34.13 32.90 2x17 s GLU 79 CO 0.70 0.23 -0.07 -1.58 0.02 0.00 0.00 175.26 174.57 2x17 s TRP 80 N -2.74 0.64 0.25 1.61 0.51 -1.26 -5.07 118.94 112.88 2x17 s TRP 80 Ca 0.23 -0.62 -0.04 0.00 -2.12 0.00 0.00 56.10 53.55 2x17 s TRP 80 Cb -0.02 -0.39 0.28 0.00 -0.81 0.00 0.00 33.47 32.52 2x17 s TRP 80 CO 0.09 -0.13 1.79 0.93 -0.51 0.00 0.00 176.95 179.12 2x17 h GLU 81 N 4.13 1.00 -3.40 4.98 5.08 -2.02 -3.46 114.58 120.90 2x17 h GLU 81 Ca -0.35 -0.20 -0.06 0.00 -1.00 0.00 0.00 59.36 57.75 2x17 h GLU 81 Cb 1.19 -0.15 -0.13 0.00 0.50 0.00 0.00 28.75 30.16 2x17 h GLU 81 CO 0.47 0.86 -0.10 -1.54 -1.00 0.00 0.00 179.01 177.70 2x17 s SER 82 N -6.49 -0.21 0.47 1.42 1.04 -1.26 -5.01 113.70 103.66 2x17 s SER 82 Ca -0.11 -0.32 0.20 0.00 0.48 0.00 0.00 55.95 56.20 2x17 s SER 82 Cb 0.15 0.46 1.20 0.00 0.10 0.00 0.00 66.02 67.93 2x17 s SER 82 CO 0.82 -0.83 1.95 -0.65 0.98 0.00 0.00 173.24 175.51 2x17 h PRO 83 N 2.45 0.24 -0.33 4.02 0.11 -1.99 0.50 132.00 136.99 2x17 h PRO 83 Ca -0.34 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 2x17 h PRO 83 Cb 1.25 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2x17 h PRO 83 CO 0.47 0.16 0.09 1.25 -0.21 0.00 0.00 178.00 179.76 2x17 h LEU 84 N 0.24 0.50 -1.24 2.35 5.85 -1.96 -2.25 115.31 118.81 2x17 h LEU 84 Ca 0.33 -0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 2x17 h LEU 84 Cb 0.93 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 2x17 h LEU 84 CO -0.07 0.59 -0.28 0.11 -0.34 0.00 0.00 178.44 178.44 2x17 h LYS 85 N 0.38 0.00 -0.20 1.25 1.79 -1.62 -1.90 116.57 116.28 2x17 h LYS 85 Ca 0.11 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.41 2x17 h LYS 85 Cb 0.28 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 2x17 h LYS 85 CO -0.00 0.28 -0.51 0.00 -1.08 0.00 0.00 179.45 178.14 2x17 h ALA 86 N 1.72 0.33 0.00 3.86 0.00 -0.77 -2.58 119.26 121.82 2x17 h ALA 86 Ca -0.00 -0.50 -0.12 0.00 0.00 0.00 0.00 54.91 54.29 2x17 h ALA 86 Cb 0.71 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2x17 h ALA 86 CO 0.04 0.52 -0.59 0.74 0.00 0.00 0.00 179.25 179.96 2x17 h PHE 87 N 0.41 0.00 -0.68 0.00 0.04 -1.33 -2.46 116.94 112.91 2x17 h PHE 87 Ca -0.01 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.70 2x17 h PHE 87 Cb 1.12 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.24 2x17 h PHE 87 CO 0.09 0.59 0.19 0.93 -0.60 0.00 0.00 178.31 179.50 2x17 h GLU 88 N 0.00 1.07 0.00 1.51 5.08 -1.34 -0.06 114.58 120.83 2x17 h GLU 88 Ca -0.01 -0.23 -0.12 0.00 -1.00 0.00 0.00 59.36 58.00 2x17 h GLU 88 Cb 1.22 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 2x17 h GLU 88 CO 0.08 0.93 -0.59 0.00 -1.00 0.00 0.00 179.01 178.43 2x17 h ALA 89 N 1.18 1.01 -0.15 3.43 0.00 -1.38 -1.95 119.26 121.40 2x17 h ALA 89 Ca 0.22 -0.53 -0.18 0.00 0.00 0.00 0.00 54.91 54.42 2x17 h ALA 89 Cb 0.32 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.03 2x17 h ALA 89 CO -0.00 0.73 -0.61 0.00 0.00 0.00 0.00 179.25 179.37 2x17 h ALA 90 N 1.41 0.28 -0.37 0.00 0.00 -1.11 -1.69 119.26 117.79 2x17 h ALA 90 Ca -0.01 -0.54 -0.10 0.00 0.00 0.00 0.00 54.91 54.26 2x17 h ALA 90 Cb 1.05 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2x17 h ALA 90 CO 0.08 0.54 -0.18 -0.92 0.00 0.00 0.00 179.25 178.76 2x17 h TYR 91 N 0.37 0.77 -0.51 0.00 3.20 -1.01 0.43 116.97 120.22 2x17 h TYR 91 Ca -0.03 -0.16 -0.09 0.00 3.14 0.00 0.00 58.73 61.59 2x17 h TYR 91 Cb 1.24 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.30 2x17 h TYR 91 CO 0.10 0.82 -0.04 1.49 -1.64 0.00 0.00 178.16 178.89 2x17 h GLU 92 N 0.61 0.89 -0.05 1.82 4.81 -1.36 -2.35 114.58 118.95 2x17 h GLU 92 Ca 0.10 -0.27 -0.15 0.00 -0.13 0.00 0.00 59.36 58.90 2x17 h GLU 92 Cb 0.65 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 2x17 h GLU 92 CO 0.05 0.90 -0.66 1.25 -0.73 0.00 0.00 179.01 179.82 2x17 h HIS 93 N 0.81 0.27 -0.26 0.92 2.76 -0.99 -2.54 115.15 116.12 2x17 h HIS 93 Ca 0.15 -0.11 -0.09 0.00 -2.20 0.00 0.00 60.37 58.12 2x17 h HIS 93 Cb 0.53 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.44 2x17 h HIS 93 CO 0.03 0.80 -0.21 0.93 -1.30 0.00 0.00 177.93 178.18 2x17 h GLU 94 N 0.14 0.47 -0.06 5.26 4.39 -0.71 -0.59 114.58 123.48 2x17 h GLU 94 Ca -0.01 -0.16 -0.14 0.00 0.34 0.00 0.00 59.36 59.39 2x17 h GLU 94 Cb 1.19 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 2x17 h GLU 94 CO 0.10 0.66 -0.58 0.87 -1.16 0.00 0.00 179.01 178.90 2x17 h LYS 95 N 0.42 0.20 -0.56 2.33 1.57 -1.38 -1.59 116.57 117.57 2x17 h LYS 95 Ca 0.07 -0.13 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 2x17 h LYS 95 Cb 0.61 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 2x17 h LYS 95 CO 0.04 0.73 0.03 0.35 -0.57 0.00 0.00 179.45 180.03 2x17 h PHE 96 N 0.15 1.05 -0.31 -1.35 3.57 -0.99 -0.03 116.94 119.04 2x17 h PHE 96 Ca -0.00 -0.17 -0.10 0.00 3.53 0.00 0.00 57.97 61.22 2x17 h PHE 96 Cb 1.07 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.53 2x17 h PHE 96 CO 0.02 0.94 -0.21 0.82 -2.23 0.00 0.00 178.31 177.65 2x17 h ILE 97 N 0.85 1.30 -0.92 1.41 1.08 -1.08 -2.39 117.51 117.75 2x17 h ILE 97 Ca 0.16 -1.34 -0.00 0.00 -0.39 0.00 0.00 64.86 63.29 2x17 h ILE 97 Cb 0.50 1.48 -0.04 0.00 -3.07 0.00 0.00 36.82 35.69 2x17 h ILE 97 CO 0.02 0.43 0.56 0.28 -0.69 0.00 0.00 178.15 178.76 2x17 h SER 98 N 0.45 1.10 -0.63 1.72 0.02 -1.21 -1.73 113.55 113.27 2x17 h SER 98 Ca 0.06 -0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 2x17 h SER 98 Cb 0.75 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.99 2x17 h SER 98 CO 0.06 0.84 0.14 0.50 -1.14 0.00 0.00 176.83 177.23 2x17 h LYS 99 N 1.26 1.01 0.00 3.45 3.64 -0.95 -1.50 116.57 123.48 2x17 h LYS 99 Ca 0.33 -0.25 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 2x17 h LYS 99 Cb -0.07 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 2x17 h LYS 99 CO -0.06 0.92 -0.33 0.66 -2.27 0.00 0.00 179.45 178.37 2x17 h SER 100 N 0.93 0.00 -0.28 4.20 4.64 -1.15 -1.67 113.55 120.22 2x17 h SER 100 Ca 0.20 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.34 2x17 h SER 100 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2x17 h SER 100 CO 0.00 0.33 -0.50 0.40 -0.87 0.00 0.00 176.83 176.19 2x17 h ILE 101 N 0.00 1.28 -0.70 0.95 1.08 -0.99 -2.51 117.51 116.63 2x17 h ILE 101 Ca -0.00 -1.69 -0.01 0.00 -0.39 0.00 0.00 64.86 62.77 2x17 h ILE 101 Cb 0.67 1.65 -0.03 0.00 -3.07 0.00 0.00 36.82 36.04 2x17 h ILE 101 CO 0.04 0.55 0.38 1.88 -0.69 0.00 0.00 178.15 180.31 2x17 h TYR 102 N 0.61 0.95 -0.37 1.37 0.05 -0.88 -0.89 116.97 117.81 2x17 h TYR 102 Ca 0.02 -0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 2x17 h TYR 102 Cb 1.11 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 38.52 2x17 h TYR 102 CO 0.08 0.68 -0.07 0.93 -1.05 0.00 0.00 178.16 178.72 2x17 h GLU 103 N 0.96 0.63 -0.31 4.88 5.08 -1.32 -0.91 114.58 123.58 2x17 h GLU 103 Ca 0.25 -0.18 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 2x17 h GLU 103 Cb 0.04 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2x17 h GLU 103 CO -0.04 0.70 -0.34 -0.07 -1.00 0.00 0.00 179.01 178.26 2x17 h LEU 104 N 0.58 0.73 -0.77 1.33 3.38 -1.17 -1.61 115.31 117.78 2x17 h LEU 104 Ca 0.11 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 2x17 h LEU 104 Cb 0.48 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2x17 h LEU 104 CO 0.03 1.01 -0.08 0.00 0.09 0.00 0.00 178.44 179.48 2x17 h ALA 105 N 1.03 0.96 -0.34 1.53 0.00 -0.71 -1.46 119.26 120.27 2x17 h ALA 105 Ca 0.06 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.51 2x17 h ALA 105 Cb 0.86 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2x17 h ALA 105 CO 0.07 0.62 -0.35 0.00 0.00 0.00 0.00 179.25 179.59 2x17 h ALA 106 N 1.14 0.50 -0.15 0.00 0.00 -1.12 -2.29 119.26 117.34 2x17 h ALA 106 Ca 0.13 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 2x17 h ALA 106 Cb 0.58 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2x17 h ALA 106 CO 0.04 0.58 -0.19 1.25 0.00 0.00 0.00 179.25 180.92 2x17 h LEU 107 N 0.63 0.24 -0.28 0.00 5.85 -1.16 -0.41 115.31 120.17 2x17 h LEU 107 Ca 0.05 -0.06 -0.20 0.00 0.84 0.00 0.00 57.88 58.51 2x17 h LEU 107 Cb 0.94 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.91 2x17 h LEU 107 CO 0.09 0.46 -0.74 0.00 -0.34 0.00 0.00 178.44 177.90 2x17 h ALA 108 N 1.57 0.45 -0.18 1.25 0.00 -1.22 -2.80 119.26 118.33 2x17 h ALA 108 Ca 0.04 -0.60 -0.16 0.00 0.00 0.00 0.00 54.91 54.20 2x17 h ALA 108 Cb 0.48 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2x17 h ALA 108 CO 0.03 0.72 -0.55 0.93 0.00 0.00 0.00 179.25 180.38 2x17 h GLU 109 N 0.43 0.54 -0.45 0.00 5.08 -1.10 0.07 114.58 119.16 2x17 h GLU 109 Ca -0.04 -0.34 -0.12 0.00 -1.00 0.00 0.00 59.36 57.86 2x17 h GLU 109 Cb 1.34 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 2x17 h GLU 109 CO 0.14 0.95 -0.19 1.49 -1.00 0.00 0.00 179.01 180.40 2x17 h GLU 110 N 0.42 0.89 -0.03 2.33 4.81 -1.12 -2.90 114.58 118.99 2x17 h GLU 110 Ca 0.01 -0.36 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 2x17 h GLU 110 Cb 1.09 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.43 2x17 h GLU 110 CO 0.10 1.00 0.00 0.39 -0.73 0.00 0.00 179.01 179.78 2x17 n GLU 111 N -4.12 1.45 -2.36 1.92 1.02 -1.06 -4.92 120.64 112.56 2x17 n GLU 111 Ca 0.00 -0.66 -0.20 0.00 -0.02 0.00 0.00 57.16 56.29 2x17 n GLU 111 Cb 0.43 -1.46 -0.01 0.00 -0.02 0.00 0.00 31.44 30.38 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 -0.19 -1.62 -2.91 3.49 5.02 -0.99 -4.95 118.16 116.02 2x17 n LYS 112 Ca 0.20 0.99 -0.44 0.00 -2.02 0.00 0.00 58.31 57.04 2x17 n LYS 112 Cb 0.27 -5.62 -0.03 0.00 -0.02 0.00 0.00 35.03 29.63 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 -2.10 6.40 0.29 4.39 -1.08 -0.02 -4.88 116.67 119.66 2x17 s ASP 113 Ca 0.00 -1.55 0.13 0.00 -0.52 0.00 0.00 52.55 50.62 2x17 s ASP 113 Cb 0.00 -2.40 0.35 0.00 -1.46 0.00 0.00 42.92 39.41 2x17 s ASP 113 CO 0.00 -1.23 1.59 1.88 0.52 0.00 0.00 175.17 177.92 2x17 h TYR 114 N 9.18 0.00 -0.09 -5.34 -1.99 -1.93 -2.76 116.97 114.05 2x17 h TYR 114 Ca -0.07 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 2x17 h TYR 114 Cb 1.05 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.77 2x17 h TYR 114 CO 1.06 0.57 0.03 0.77 -0.00 0.00 0.00 178.16 180.59 2x17 h SER 115 N 0.00 0.13 0.04 3.88 0.02 -1.96 0.03 113.55 115.69 2x17 h SER 115 Ca -0.01 -0.19 -0.10 0.00 -0.84 0.00 0.00 61.79 60.64 2x17 h SER 115 Cb 1.16 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 2x17 h SER 115 CO 0.07 0.29 -0.33 0.74 -1.14 0.00 0.00 176.83 176.47 2x17 h THR 116 N -0.04 1.28 -0.45 -2.27 2.02 -1.95 -0.56 112.91 110.94 2x17 h THR 116 Ca 0.03 -1.39 -0.09 0.00 0.77 0.00 0.00 66.41 65.74 2x17 h THR 116 Cb 0.21 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2x17 h THR 116 CO -0.00 0.43 -0.05 -0.09 0.37 0.00 0.00 175.52 176.18 2x17 h ARG 117 N 0.36 0.83 -0.13 6.66 9.65 -1.39 -1.27 114.38 129.10 2x17 h ARG 117 Ca 0.04 -0.29 -0.12 0.00 -1.10 0.00 0.00 59.98 58.52 2x17 h ARG 117 Cb 0.75 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.26 2x17 h ARG 117 CO 0.06 0.92 -0.43 0.00 2.80 0.00 0.00 179.97 183.31 2x17 h ALA 118 N 0.89 1.03 -0.18 2.80 0.00 -0.78 -2.90 119.26 120.12 2x17 h ALA 118 Ca 0.12 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2x17 h ALA 118 Cb 0.58 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2x17 h ALA 118 CO 0.03 0.62 -0.03 0.35 0.00 0.00 0.00 179.25 180.22 2x17 h PHE 119 N 0.24 0.37 0.00 0.00 3.57 -0.97 -3.15 116.94 117.01 2x17 h PHE 119 Ca 0.02 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.44 2x17 h PHE 119 Cb 0.87 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.51 2x17 h PHE 119 CO 0.02 0.58 0.00 -0.07 -2.23 0.00 0.00 178.31 176.61 2x17 h LEU 120 N 0.06 0.00 -1.43 0.59 3.38 -1.19 -2.99 115.31 113.73 2x17 h LEU 120 Ca 0.05 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.07 2x17 h LEU 120 Cb 0.45 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 2x17 h LEU 120 CO 0.01 0.00 0.44 -0.08 0.09 0.00 0.00 178.44 178.91 2x17 h GLU 121 N 0.00 0.69 -0.82 1.13 4.57 -1.46 -1.08 114.58 117.60 2x17 h GLU 121 Ca 0.00 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2x17 h GLU 121 Cb 0.30 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.69 2x17 h GLU 121 CO 0.00 0.45 0.50 2.35 -1.18 0.00 0.00 179.01 181.14 2x17 h TRP 122 N 0.71 1.07 0.00 0.92 7.01 -1.70 -2.85 115.95 121.11 2x17 h TRP 122 Ca 0.28 0.00 -0.17 0.00 2.11 0.00 0.00 58.89 61.12 2x17 h TRP 122 Cb 0.22 -0.35 -0.02 0.00 -2.10 0.00 0.00 29.16 26.90 2x17 h TRP 122 CO -0.00 0.71 -0.80 0.74 -2.79 0.00 0.00 178.44 176.30 2x17 h PHE 123 N 1.12 0.00 -0.43 2.65 0.04 -1.42 -1.53 116.94 117.38 2x17 h PHE 123 Ca 0.30 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.03 2x17 h PHE 123 Cb -0.06 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.07 2x17 h PHE 123 CO -0.01 0.80 0.13 0.82 -0.60 0.00 0.00 178.31 179.46 2x17 h ILE 124 N 0.00 1.22 -0.33 -0.55 2.04 -1.22 -0.81 117.51 117.86 2x17 h ILE 124 Ca -0.01 -0.72 -0.13 0.00 1.00 0.00 0.00 64.86 64.99 2x17 h ILE 124 Cb 1.43 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 2x17 h ILE 124 CO 0.10 0.26 -0.34 0.78 0.00 0.00 0.00 178.15 178.95 2x17 h ASN 125 N 0.55 0.76 -0.52 1.72 2.35 -1.47 -3.15 115.58 115.82 2x17 h ASN 125 Ca 0.14 -0.32 -0.08 0.00 -0.55 0.00 0.00 56.30 55.48 2x17 h ASN 125 Cb 0.26 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 2x17 h ASN 125 CO -0.00 1.03 -0.01 -0.08 -1.65 0.00 0.00 177.43 176.72 2x17 h GLU 126 N 0.61 0.92 0.00 0.81 4.22 -1.15 -3.06 114.58 116.92 2x17 h GLU 126 Ca 0.06 -0.30 -0.01 0.00 0.08 0.00 0.00 59.36 59.20 2x17 h GLU 126 Cb 0.87 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 2x17 h GLU 126 CO 0.08 0.94 -0.05 1.96 -2.18 0.00 0.00 179.01 179.76 2x17 h GLN 127 N 0.79 0.00 -0.53 1.92 1.08 -1.17 -1.75 115.11 115.45 2x17 h GLN 127 Ca 0.15 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.23 2x17 h GLN 127 Cb 0.53 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.95 2x17 h GLN 127 CO 0.03 0.05 -0.11 0.28 -0.95 0.00 0.00 178.83 178.13 2x17 h VAL 128 N 0.00 1.27 -0.06 -0.54 2.07 -1.49 -2.25 116.25 115.24 2x17 h VAL 128 Ca -0.00 -1.25 -0.21 0.00 0.82 0.00 0.00 66.70 66.05 2x17 h VAL 128 Cb 0.50 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2x17 h VAL 128 CO 0.01 0.44 -0.83 -0.08 0.02 0.00 0.00 177.57 177.12 2x17 h GLU 129 N 0.88 0.52 -0.09 1.57 4.81 -1.36 -2.84 114.58 118.07 2x17 h GLU 129 Ca 0.14 -0.47 -0.23 0.00 -0.13 0.00 0.00 59.36 58.66 2x17 h GLU 129 Cb 0.66 0.11 0.01 0.00 0.63 0.00 0.00 28.75 30.17 2x17 h GLU 129 CO 0.05 1.11 -0.87 0.93 -0.73 0.00 0.00 179.01 179.49 2x17 h GLU 130 N 0.33 0.71 -0.38 1.92 5.08 -1.40 -1.97 114.58 118.87 2x17 h GLU 130 Ca -0.06 -0.64 -0.01 0.00 -1.00 0.00 0.00 59.36 57.65 2x17 h GLU 130 Cb 1.44 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.83 2x17 h GLU 130 CO 0.15 1.25 0.20 0.93 -1.00 0.00 0.00 179.01 180.54 2x17 h GLU 131 N 0.45 0.53 -0.17 2.33 5.08 -1.49 -2.07 114.58 119.24 2x17 h GLU 131 Ca -0.08 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.14 2x17 h GLU 131 Cb 1.51 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 2x17 h GLU 131 CO 0.17 0.44 -0.22 0.00 -1.00 0.00 0.00 179.01 178.41 2x17 h ALA 132 N 1.06 1.31 -0.25 3.43 0.00 -1.53 -0.81 119.26 122.48 2x17 h ALA 132 Ca 0.13 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 2x17 h ALA 132 Cb 0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2x17 h ALA 132 CO -0.02 0.46 -0.14 1.03 0.00 0.00 0.00 179.25 180.58 2x17 h SER 133 N 0.28 0.56 -0.31 0.00 0.87 -1.18 -1.71 113.55 112.06 2x17 h SER 133 Ca 0.05 -0.42 -0.14 0.00 -1.23 0.00 0.00 61.79 60.04 2x17 h SER 133 Cb 0.54 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2x17 h SER 133 CO 0.04 0.86 -0.35 0.58 -0.53 0.00 0.00 176.83 177.42 2x17 h VAL 134 N 0.25 1.29 -0.64 2.23 2.07 -1.26 -3.19 116.25 117.00 2x17 h VAL 134 Ca 0.05 -1.53 -0.06 0.00 0.82 0.00 0.00 66.70 65.98 2x17 h VAL 134 Cb 0.66 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 2x17 h VAL 134 CO 0.04 0.50 0.17 0.50 0.02 0.00 0.00 177.57 178.80 2x17 h LYS 135 N 0.55 1.00 -0.61 1.57 1.63 -1.17 -0.90 116.57 118.64 2x17 h LYS 135 Ca 0.04 -0.21 0.05 0.00 -0.85 0.00 0.00 60.65 59.68 2x17 h LYS 135 Cb 0.94 -0.14 -0.05 0.00 -0.60 0.00 0.00 32.23 32.37 2x17 h LYS 135 CO 0.09 0.87 0.33 -0.22 -3.45 0.00 0.00 179.45 177.07 2x17 h LYS 136 N 0.96 0.60 -0.05 1.90 3.64 -1.32 -0.42 116.57 121.89 2x17 h LYS 136 Ca 0.21 -0.04 -0.23 0.00 -1.27 0.00 0.00 60.65 59.32 2x17 h LYS 136 Cb 0.31 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2x17 h LYS 136 CO -0.00 0.40 -0.89 0.82 -2.27 0.00 0.00 179.45 177.51 2x17 h ILE 137 N 0.62 1.34 -0.36 2.00 2.04 -1.50 -2.90 117.51 118.74 2x17 h ILE 137 Ca 0.27 -2.23 0.05 0.00 1.00 0.00 0.00 64.86 63.95 2x17 h ILE 137 Cb 0.16 2.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 2x17 h ILE 137 CO -0.17 0.68 0.11 0.25 0.00 0.00 0.00 178.15 179.02 2x17 h LEU 138 N 0.35 0.09 -1.40 1.44 6.46 -0.80 -0.61 115.31 120.85 2x17 h LEU 138 Ca -0.08 0.05 -0.04 0.00 -0.12 0.00 0.00 57.88 57.69 2x17 h LEU 138 Cb 1.51 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 41.48 2x17 h LEU 138 CO 0.17 0.09 -0.04 0.44 -0.62 0.00 0.00 178.44 178.47 2x17 h ASP 139 N 0.25 0.32 0.77 1.25 3.32 -1.11 -0.32 116.42 120.90 2x17 h ASP 139 Ca 0.17 -0.05 -0.10 0.00 0.02 0.00 0.00 57.03 57.06 2x17 h ASP 139 Cb 0.16 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 2x17 h ASP 139 CO -0.19 0.41 -0.46 0.11 -1.72 0.00 0.00 179.24 177.40 2x17 h LYS 140 N 0.34 0.00 0.07 3.56 1.57 -1.17 -1.33 116.57 119.61 2x17 h LYS 140 Ca 0.07 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.61 2x17 h LYS 140 Cb 0.29 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2x17 h LYS 140 CO 0.01 0.46 -1.10 -0.07 -0.57 0.00 0.00 179.45 178.18 2x17 h LEU 141 N 0.00 0.26 -1.08 2.94 3.38 -0.33 -3.01 115.31 117.47 2x17 h LEU 141 Ca -0.00 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.63 2x17 h LEU 141 Cb 0.97 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 2x17 h LEU 141 CO 0.06 1.19 -0.08 0.11 0.09 0.00 0.00 178.44 179.80 2x17 h LYS 142 N 0.06 0.55 0.00 1.13 1.57 -0.97 -2.81 116.57 116.10 2x17 h LYS 142 Ca -0.08 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 2x17 h LYS 142 Cb 1.83 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 34.08 2x17 h LYS 142 CO 0.17 0.64 -0.04 0.35 -0.57 0.00 0.00 179.45 180.00 2x17 h PHE 143 N 0.52 0.00 -2.23 -1.35 3.57 -1.20 -3.31 116.94 112.94 2x17 h PHE 143 Ca 0.10 0.00 -0.57 0.00 3.53 0.00 0.00 57.97 61.03 2x17 h PHE 143 Cb 0.46 0.00 -0.42 0.00 2.79 0.00 0.00 35.95 38.78 2x17 h PHE 143 CO 0.02 0.04 -0.73 0.00 -2.23 0.00 0.00 178.31 175.40 2x17 n ALA 144 N -2.12 4.14 0.34 2.41 0.00 -1.06 -4.94 120.51 119.28 2x17 n ALA 144 Ca -0.00 -4.48 -0.13 0.00 0.00 0.00 0.00 53.44 48.83 2x17 n ALA 144 Cb 0.29 -0.78 -0.06 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 3.15 -0.84 -1.45 0.00 1.57 -1.65 -3.32 116.57 114.03 2x17 h LYS 145 Ca 0.13 0.06 -0.65 0.00 -1.87 0.00 0.00 60.65 58.31 2x17 h LYS 145 Cb 0.60 0.19 -0.35 0.00 0.08 0.00 0.00 32.23 32.75 2x17 h LYS 145 CO 0.76 -0.56 0.09 -0.25 -0.57 0.00 0.00 179.45 178.92 2x17 n ASP 146 N -4.69 6.14 -3.65 0.86 8.00 -1.26 -4.91 116.55 117.03 2x17 n ASP 146 Ca -0.11 -3.77 -0.29 0.00 0.71 0.00 0.00 54.79 51.33 2x17 n ASP 146 Cb 0.34 -0.72 -0.15 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 -2.49 3.60 0.50 -2.24 0.15 -1.25 -4.98 113.70 106.99 2x17 s SER 147 Ca 0.53 -1.34 0.29 0.00 0.70 0.00 0.00 55.95 56.13 2x17 s SER 147 Cb 0.43 -0.60 0.94 0.00 -1.71 0.00 0.00 66.02 65.08 2x17 s SER 147 CO -0.19 -0.41 1.83 -0.65 1.20 0.00 0.00 173.24 175.02 2x17 h PRO 148 N 8.25 0.00 -0.77 5.44 0.11 -1.91 -3.14 132.00 139.98 2x17 h PRO 148 Ca -0.16 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.90 2x17 h PRO 148 Cb 1.03 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 2x17 h PRO 148 CO 0.43 0.02 0.31 1.96 -0.21 0.00 0.00 178.00 180.51 2x17 h GLN 149 N 0.00 1.15 0.10 1.05 7.50 -1.98 -1.05 115.11 121.88 2x17 h GLN 149 Ca -0.00 -0.20 -0.26 0.00 0.50 0.00 0.00 58.65 58.69 2x17 h GLN 149 Cb 0.72 -0.19 0.00 0.00 0.05 0.00 0.00 27.48 28.07 2x17 h GLN 149 CO 0.00 0.93 -1.17 0.82 -1.50 0.00 0.00 178.83 177.91 2x17 h ILE 150 N 1.12 1.48 -0.38 2.54 2.04 -1.95 -2.81 117.51 119.54 2x17 h ILE 150 Ca 0.26 -2.93 -0.04 0.00 1.00 0.00 0.00 64.86 63.15 2x17 h ILE 150 Cb 0.21 2.83 -0.02 0.00 -0.74 0.00 0.00 36.82 39.10 2x17 h ILE 150 CO -0.02 0.86 0.08 0.25 0.00 0.00 0.00 178.15 179.31 2x17 h LEU 151 N 0.10 0.53 -0.24 1.44 5.85 -1.47 0.17 115.31 121.69 2x17 h LEU 151 Ca -0.12 -0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.46 2x17 h LEU 151 Cb 1.88 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.77 2x17 h LEU 151 CO 0.19 0.54 -0.09 0.15 -0.34 0.00 0.00 178.44 178.90 2x17 h PHE 152 N 0.56 0.56 0.00 1.25 3.57 -1.20 -2.11 116.94 119.57 2x17 h PHE 152 Ca 0.13 -0.13 -0.09 0.00 3.53 0.00 0.00 57.97 61.40 2x17 h PHE 152 Cb 0.24 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 2x17 h PHE 152 CO 0.01 0.74 -0.45 0.52 -2.23 0.00 0.00 178.31 176.90 2x17 h MET 153 N 0.22 0.00 -0.23 1.11 2.86 -1.22 -2.82 114.93 114.85 2x17 h MET 153 Ca 0.06 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.56 2x17 h MET 153 Cb 0.58 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 2x17 h MET 153 CO 0.03 0.45 -0.43 -0.07 1.06 0.00 0.00 176.91 177.94 2x17 h LEU 154 N 0.00 0.59 -0.86 1.22 3.38 -0.63 -2.73 115.31 116.29 2x17 h LEU 154 Ca -0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2x17 h LEU 154 Cb 0.93 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 2x17 h LEU 154 CO 0.06 0.95 0.48 -0.78 0.09 0.00 0.00 178.44 179.24 2x17 h ASP 155 N 0.45 1.07 -0.37 -0.43 3.58 -1.13 -2.34 116.42 117.24 2x17 h ASP 155 Ca 0.03 -0.10 -0.12 0.00 0.42 0.00 0.00 57.03 57.26 2x17 h ASP 155 Cb 0.94 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.70 2x17 h ASP 155 CO 0.08 0.86 -0.23 0.50 -2.88 0.00 0.00 179.24 177.57 2x17 h LYS 156 N 1.20 0.87 -0.62 0.28 3.64 -1.47 -2.55 116.57 117.93 2x17 h LYS 156 Ca 0.30 -0.37 -0.09 0.00 -1.27 0.00 0.00 60.65 59.22 2x17 h LYS 156 Cb 0.02 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 2x17 h LYS 156 CO -0.05 1.01 0.02 0.93 -2.27 0.00 0.00 179.45 179.09 2x17 h GLU 157 N 0.76 1.08 0.00 1.90 5.08 -1.23 -2.97 114.58 119.20 2x17 h GLU 157 Ca 0.10 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2x17 h GLU 157 Cb 0.77 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.92 2x17 h GLU 157 CO 0.06 1.04 -0.11 1.28 -1.00 0.00 0.00 179.01 180.28 2x17 n LEU 158 N -4.19 0.71 0.02 1.33 4.77 -0.90 -3.25 117.00 115.49 2x17 n LEU 158 Ca 0.03 0.50 0.08 0.00 -0.03 0.00 0.00 56.01 56.59 2x17 n LEU 158 Cb 0.34 -0.31 0.36 0.00 -2.33 0.00 0.00 43.42 41.47 2x17 n LEU 158 CO 0.44 -0.14 0.76 -1.54 -1.33 0.00 0.00 177.39 175.59 2x17 n SER 159 N -2.15 0.13 0.21 -1.43 3.41 -0.96 -2.04 113.62 110.78 2x17 n SER 159 Ca 0.05 0.53 0.06 0.00 -0.26 0.00 0.00 58.87 59.26 2x17 n SER 159 Cb 0.42 -0.56 0.46 0.00 -0.26 0.00 0.00 64.21 64.27 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 2.48 1.24 -2.86 7.33 0.00 -1.67 -3.41 119.26 122.37 2x17 h ALA 160 Ca 0.00 -0.27 -0.58 0.00 0.00 0.00 0.00 54.91 54.06 2x17 h ALA 160 Cb 0.29 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.94 2x17 h ALA 160 CO 0.00 0.37 -0.11 0.50 0.00 0.00 0.00 179.25 180.01 2x17 s ARG 161 N -4.02 4.29 0.03 0.00 3.52 -0.87 -5.08 118.95 116.83 2x17 s ARG 161 Ca -0.02 0.43 0.01 0.00 -0.13 0.00 0.00 55.73 56.02 2x17 s ARG 161 Cb 0.13 -3.47 -0.02 0.00 -1.56 0.00 0.00 34.95 30.02 2x17 s ARG 161 CO 0.67 0.07 -0.05 0.00 -0.81 0.00 0.00 175.30 175.18 2x17 s ALA 162 N 0.93 0.33 0.34 6.12 0.00 -1.26 -3.82 121.76 124.39 2x17 s ALA 162 Ca 0.25 -0.68 -0.29 0.00 0.00 0.00 0.00 51.96 51.24 2x17 s ALA 162 Cb -0.15 0.10 -0.11 0.00 0.00 0.00 0.00 23.12 22.97 2x17 s ALA 162 CO 0.10 -0.10 1.38 -1.25 0.00 0.00 0.00 175.76 175.89 2x17 s PRO 163 N -1.56 4.27 0.01 0.00 0.04 -1.26 -4.73 135.00 131.77 2x17 s PRO 163 Ca -0.13 2.34 0.22 0.00 0.04 0.00 0.00 61.00 63.47 2x17 s PRO 163 Cb -0.10 -3.04 -0.12 0.00 0.04 0.00 0.00 34.50 31.29 2x17 s PRO 163 CO -0.01 -0.32 0.88 1.63 0.04 0.00 0.00 177.00 179.22 2x17 n LYS 164 N 0.82 0.27 -0.04 4.56 5.02 -1.26 -4.48 118.16 123.04 2x17 n LYS 164 Ca 0.01 -0.05 -0.13 0.00 -2.02 0.00 0.00 58.31 56.12 2x17 n LYS 164 Cb 0.41 -1.54 -0.11 0.00 -0.02 0.00 0.00 35.03 33.76 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 -0.97 -0.35 5.85 -1.99 -3.38 115.31 114.47 2x17 h LEU 165 Ca 0.00 -0.73 0.31 0.00 0.84 0.00 0.00 57.88 58.30 2x17 h LEU 165 Cb 0.71 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 41.58 2x17 h LEU 165 CO 0.00 0.73 0.41 -0.65 -0.34 0.00 0.00 178.44 178.60 2x17 h PRO 166 N -0.76 0.19 -0.03 5.25 0.11 -2.01 0.11 132.00 134.86 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 0.74 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.80 2x17 h PRO 166 CO 0.00 0.13 0.00 0.41 -0.21 0.00 0.00 178.00 178.33 2x17 n GLY 167 N -1.33 -0.77 0.00 -0.55 0.00 -1.26 -3.79 105.19 97.50 2x17 n GLY 167 Ca 0.29 -0.16 0.03 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.56 0.16 0.00 0.99 4.77 0.38 -5.03 117.00 117.71 2x17 n LEU 168 Ca 0.13 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 2x17 n LEU 168 Cb 0.10 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2x17 n LEU 168 CO 0.10 0.04 0.00 0.18 -1.33 0.00 0.00 177.39 176.38 2x17 n LEU 169 N -1.40 0.00 -4.71 2.23 7.99 -1.22 -5.02 117.00 114.88 2x17 n LEU 169 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 56.01 55.61 2x17 n LEU 169 Cb 0.13 0.00 0.04 0.00 -0.11 0.00 0.00 43.42 43.48 2x17 n LEU 169 CO 0.13 -0.11 0.87 0.23 -1.51 0.00 0.00 177.39 177.00 2x17 n MET 170 N -0.21 1.51 -4.33 3.23 2.81 -1.26 -5.03 117.12 113.84 2x17 n MET 170 Ca 0.00 0.56 -0.26 0.00 -1.81 0.00 0.00 57.70 56.19 2x17 n MET 170 Cb 0.00 -2.45 -0.09 0.00 -0.71 0.00 0.00 33.22 29.96 2x17 n MET 170 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2x17 s GLN 171 N -2.78 1.97 0.00 0.03 -0.21 -1.26 -5.06 119.66 112.34 2x17 s GLN 171 Ca 0.72 -1.38 0.00 0.00 0.02 0.00 0.00 55.36 54.72 2x17 s GLN 171 Cb -0.43 -2.07 0.00 0.00 1.00 0.00 0.00 33.01 31.51 2x17 s GLN 171 CO 0.49 0.41 0.00 0.41 -2.12 0.00 0.00 175.29 174.48