#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 4.22 0.37 3.17 1.43 -1.25 -4.98 118.68 121.64 2x17 s LEU 2 Ca 0.00 2.40 -0.28 0.00 -1.03 0.00 0.00 54.13 55.23 2x17 s LEU 2 Cb 0.00 -3.98 -0.11 0.00 0.03 0.00 0.00 46.19 42.13 2x17 s LEU 2 CO 0.00 -0.68 1.38 -1.54 0.23 0.00 0.00 176.35 175.74 2x17 n SER 3 N 0.15 3.21 -4.67 2.29 3.41 -1.26 -4.87 113.62 111.87 2x17 n SER 3 Ca 0.04 1.20 -0.46 0.00 -0.26 0.00 0.00 58.87 59.39 2x17 n SER 3 Cb 0.46 -1.55 -0.04 0.00 -0.26 0.00 0.00 64.21 62.81 2x17 n SER 3 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2x17 n GLU 4 N 0.40 2.17 0.00 4.33 0.00 -1.26 -1.27 120.64 125.02 2x17 n GLU 4 Ca 0.03 0.79 0.00 0.00 0.00 0.00 0.00 57.16 57.98 2x17 n GLU 4 Cb 0.38 -2.57 0.00 0.00 0.00 0.00 0.00 31.44 29.25 2x17 n GLU 4 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2x17 n ARG 5 N 4.07 0.00 -0.31 3.44 0.63 -1.26 -4.78 116.66 118.45 2x17 n ARG 5 Ca 0.18 0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 57.09 2x17 n ARG 5 Cb 0.29 -0.14 0.15 0.00 0.45 0.00 0.00 32.46 33.21 2x17 n ARG 5 CO 0.00 0.00 0.00 1.98 -2.51 0.00 0.00 177.63 177.10 2x17 h MET 6 N 1.18 1.20 -0.45 -0.14 4.05 -1.54 0.56 114.93 119.78 2x17 h MET 6 Ca 0.00 -0.09 -0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2x17 h MET 6 Cb 0.00 -0.26 -0.02 0.00 -0.80 0.00 0.00 31.60 30.52 2x17 h MET 6 CO 0.00 0.81 0.27 1.25 0.23 0.00 0.00 176.91 179.47 2x17 h LEU 7 N 1.23 0.54 -0.71 3.39 5.85 -1.86 0.20 115.31 123.94 2x17 h LEU 7 Ca 0.33 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.92 2x17 h LEU 7 Cb -0.10 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 2x17 h LEU 7 CO -0.07 0.44 0.17 0.50 -0.34 0.00 0.00 178.44 179.14 2x17 h LYS 8 N 0.60 1.14 -0.62 1.25 3.64 -1.80 0.70 116.57 121.47 2x17 h LYS 8 Ca 0.16 -0.28 -0.05 0.00 -1.27 0.00 0.00 60.65 59.22 2x17 h LYS 8 Cb -0.00 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.64 2x17 h LYS 8 CO -0.03 1.01 0.20 0.00 -2.27 0.00 0.00 179.45 178.35 2x17 h ALA 9 N 1.09 1.17 -0.13 5.00 0.00 -0.61 0.11 119.26 125.88 2x17 h ALA 9 Ca 0.22 -0.20 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 2x17 h ALA 9 Cb 0.38 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2x17 h ALA 9 CO 0.00 0.58 -0.62 -0.07 0.00 0.00 0.00 179.25 179.14 2x17 h LEU 10 N 0.91 0.51 -0.44 0.00 3.38 0.01 -2.67 115.31 117.02 2x17 h LEU 10 Ca 0.21 -0.30 -0.18 0.00 0.09 0.00 0.00 57.88 57.70 2x17 h LEU 10 Cb 0.26 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2x17 h LEU 10 CO -0.01 1.01 -0.74 0.78 0.09 0.00 0.00 178.44 179.57 2x17 h ASN 11 N 0.33 0.36 -0.08 -0.43 2.35 0.67 -2.48 115.58 116.31 2x17 h ASN 11 Ca -0.01 -0.24 -0.15 0.00 -0.55 0.00 0.00 56.30 55.35 2x17 h ASN 11 Cb 1.17 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.43 2x17 h ASN 11 CO 0.11 0.98 -0.44 0.44 -1.65 0.00 0.00 177.43 176.86 2x17 h ASP 12 N 0.20 0.67 -0.18 5.81 3.45 -0.82 -2.43 116.42 123.11 2x17 h ASP 12 Ca -0.03 -0.31 -0.17 0.00 0.43 0.00 0.00 57.03 56.95 2x17 h ASP 12 Cb 1.31 -0.19 -0.00 0.00 -0.56 0.00 0.00 39.33 39.89 2x17 h ASP 12 CO 0.12 1.02 -0.50 -0.61 -1.57 0.00 0.00 179.24 177.70 2x17 h GLN 13 N 0.50 0.75 -0.85 3.56 5.75 -1.48 0.09 115.11 123.43 2x17 h GLN 13 Ca 0.03 -0.45 0.07 0.00 -0.15 0.00 0.00 58.65 58.16 2x17 h GLN 13 Cb 0.97 0.04 -0.06 0.00 1.07 0.00 0.00 27.48 29.50 2x17 h GLN 13 CO 0.09 1.07 0.52 1.25 -2.65 0.00 0.00 178.83 179.11 2x17 h LEU 14 N 0.59 0.79 -0.81 -2.39 6.46 -1.41 0.43 115.31 118.97 2x17 h LEU 14 Ca 0.03 0.03 -0.12 0.00 -0.12 0.00 0.00 57.88 57.69 2x17 h LEU 14 Cb 1.07 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.85 2x17 h LEU 14 CO 0.11 0.49 -0.42 -1.13 -0.62 0.00 0.00 178.44 176.87 2x17 h ASN 15 N 0.92 0.39 0.19 1.25 -0.73 -1.13 -2.44 115.58 114.04 2x17 h ASN 15 Ca 0.38 -0.17 -0.13 0.00 1.87 0.00 0.00 56.30 58.25 2x17 h ASN 15 Cb 0.23 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 38.70 2x17 h ASN 15 CO -0.19 0.77 -0.47 0.03 -0.37 0.00 0.00 177.43 177.20 2x17 h ARG 16 N 0.31 0.33 -0.16 6.67 3.08 -0.17 -2.17 114.38 122.27 2x17 h ARG 16 Ca 0.03 -0.18 -0.17 0.00 0.07 0.00 0.00 59.98 59.73 2x17 h ARG 16 Cb 0.87 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 2x17 h ARG 16 CO 0.07 0.73 -0.60 0.93 -1.07 0.00 0.00 179.97 180.04 2x17 h GLU 17 N 0.27 0.52 -0.07 0.04 4.39 -0.82 -2.08 114.58 116.82 2x17 h GLU 17 Ca 0.02 -0.35 -0.14 0.00 0.34 0.00 0.00 59.36 59.23 2x17 h GLU 17 Cb 0.93 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.62 2x17 h GLU 17 CO 0.08 0.96 -0.56 -0.07 -1.16 0.00 0.00 179.01 178.25 2x17 h LEU 18 N 0.39 0.23 -0.52 1.33 3.38 -1.34 -2.42 115.31 116.36 2x17 h LEU 18 Ca -0.00 -0.12 -0.16 0.00 0.09 0.00 0.00 57.88 57.68 2x17 h LEU 18 Cb 1.15 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2x17 h LEU 18 CO 0.11 0.75 -0.58 0.22 0.09 0.00 0.00 178.44 179.02 2x17 h TYR 19 N 0.16 0.63 -0.81 1.13 3.20 -1.36 -2.30 116.97 117.62 2x17 h TYR 19 Ca -0.00 -0.23 0.04 0.00 3.14 0.00 0.00 58.73 61.67 2x17 h TYR 19 Cb 1.04 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 39.14 2x17 h TYR 19 CO 0.02 0.96 0.51 0.77 -1.64 0.00 0.00 178.16 178.78 2x17 h SER 20 N 0.38 0.83 -0.85 -2.11 0.02 -1.19 0.56 113.55 111.20 2x17 h SER 20 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 2x17 h SER 20 Cb 1.12 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 63.45 2x17 h SER 20 CO 0.11 0.56 0.51 0.00 -1.14 0.00 0.00 176.83 176.87 2x17 h ALA 21 N 1.35 1.08 0.00 3.77 0.00 -1.36 -2.20 119.26 121.90 2x17 h ALA 21 Ca 0.33 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 55.00 2x17 h ALA 21 Cb 0.06 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2x17 h ALA 21 CO -0.13 0.54 -0.72 -0.92 0.00 0.00 0.00 179.25 178.03 2x17 h TYR 22 N 1.16 0.00 -0.25 0.00 -0.00 -0.64 -1.89 116.97 115.35 2x17 h TYR 22 Ca 0.30 0.00 -0.16 0.00 -0.00 0.00 0.00 58.73 58.87 2x17 h TYR 22 Cb -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.69 2x17 h TYR 22 CO -0.00 0.72 -0.48 1.25 -0.00 0.00 0.00 178.16 179.64 2x17 h LEU 23 N 0.00 0.86 -0.68 2.82 5.85 0.20 -2.10 115.31 122.26 2x17 h LEU 23 Ca -0.01 -0.54 -0.08 0.00 0.84 0.00 0.00 57.88 58.10 2x17 h LEU 23 Cb 1.33 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 2x17 h LEU 23 CO 0.09 1.24 -0.36 1.88 -0.34 0.00 0.00 178.44 180.95 2x17 h TYR 24 N 0.51 0.00 -0.04 1.25 0.05 -1.38 -0.28 116.97 117.07 2x17 h TYR 24 Ca 0.01 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.65 2x17 h TYR 24 Cb 1.09 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.81 2x17 h TYR 24 CO 0.08 0.36 -0.61 0.35 -1.05 0.00 0.00 178.16 177.29 2x17 h PHE 25 N 0.00 0.20 -0.04 4.88 -0.00 -1.33 0.38 116.94 121.02 2x17 h PHE 25 Ca -0.00 -0.08 -0.16 0.00 -0.00 0.00 0.00 57.97 57.73 2x17 h PHE 25 Cb 1.01 -0.03 -0.01 0.00 -0.00 0.00 0.00 35.95 36.91 2x17 h PHE 25 CO 0.00 0.72 -0.69 0.00 -0.00 0.00 0.00 178.31 178.34 2x17 h ALA 26 N 1.26 0.76 -0.09 2.41 0.00 -0.91 -2.45 119.26 120.25 2x17 h ALA 26 Ca -0.01 -0.60 -0.19 0.00 0.00 0.00 0.00 54.91 54.11 2x17 h ALA 26 Cb 1.10 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2x17 h ALA 26 CO 0.09 0.80 -0.74 0.52 0.00 0.00 0.00 179.25 179.92 2x17 h MET 27 N 0.14 0.45 -0.70 0.00 2.86 -0.92 -2.64 114.93 114.12 2x17 h MET 27 Ca -0.02 -0.37 -0.02 0.00 -2.06 0.00 0.00 59.70 57.24 2x17 h MET 27 Cb 1.23 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.94 2x17 h MET 27 CO 0.10 1.00 0.37 0.00 1.06 0.00 0.00 176.91 179.45 2x17 h ALA 28 N 0.89 0.89 -0.43 6.32 0.00 -0.86 -0.87 119.26 125.21 2x17 h ALA 28 Ca -0.03 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2x17 h ALA 28 Cb 1.32 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2x17 h ALA 28 CO 0.13 0.42 -0.04 0.00 0.00 0.00 0.00 179.25 179.76 2x17 h ALA 29 N 1.18 1.13 -0.29 0.00 0.00 -1.45 -0.51 119.26 119.34 2x17 h ALA 29 Ca 0.24 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2x17 h ALA 29 Cb 0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2x17 h ALA 29 CO -0.04 0.55 0.05 -0.92 0.00 0.00 0.00 179.25 178.89 2x17 h TYR 30 N 0.66 0.51 -0.01 0.00 3.20 -1.07 -2.27 116.97 118.00 2x17 h TYR 30 Ca 0.13 -0.07 -0.10 0.00 3.14 0.00 0.00 58.73 61.82 2x17 h TYR 30 Cb 0.47 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 2x17 h TYR 30 CO 0.02 0.57 -0.49 0.74 -1.64 0.00 0.00 178.16 177.36 2x17 h PHE 31 N 0.30 0.02 -0.39 -3.82 0.04 -1.04 -2.89 116.94 109.15 2x17 h PHE 31 Ca 0.09 -0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.75 2x17 h PHE 31 Cb 0.34 -0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.47 2x17 h PHE 31 CO 0.02 0.50 -0.19 1.49 -0.60 0.00 0.00 178.31 179.53 2x17 h GLU 32 N 0.01 0.74 -0.43 1.51 4.57 -0.98 0.21 114.58 120.22 2x17 h GLU 32 Ca -0.00 -0.28 -0.11 0.00 -1.18 0.00 0.00 59.36 57.79 2x17 h GLU 32 Cb 0.88 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.40 2x17 h GLU 32 CO 0.06 0.88 -0.16 0.22 -1.18 0.00 0.00 179.01 178.83 2x17 h ASP 33 N 0.66 0.81 0.61 1.04 3.58 -1.24 -2.39 116.42 119.49 2x17 h ASP 33 Ca 0.10 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 57.28 2x17 h ASP 33 Cb 0.68 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.51 2x17 h ASP 33 CO 0.05 0.97 0.00 0.18 -2.88 0.00 0.00 179.24 177.56 2x17 n LEU 34 N -4.14 0.00 0.00 2.28 4.77 -1.11 -4.88 117.00 113.92 2x17 n LEU 34 Ca 0.01 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 2x17 n LEU 34 Cb 0.40 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 2x17 n LEU 34 CO 0.44 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 2x17 n GLY 35 N 0.58 0.56 3.43 -0.72 0.00 -0.90 -4.99 105.19 103.15 2x17 n GLY 35 Ca 0.06 -0.24 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 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 5.42 0.32 0.99 1.43 0.04 -4.86 118.68 122.02 2x17 s LEU 36 Ca 0.00 -2.66 0.13 0.00 -1.03 0.00 0.00 54.13 50.57 2x17 s LEU 36 Cb 0.00 -2.35 0.53 0.00 0.03 0.00 0.00 46.19 44.40 2x17 s LEU 36 CO 0.00 -0.79 1.70 -0.33 0.23 0.00 0.00 176.35 177.15 2x17 h GLU 37 N 7.82 0.00 -0.09 1.70 5.08 -1.91 -2.26 114.58 124.92 2x17 h GLU 37 Ca 0.21 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 2x17 h GLU 37 Cb 0.95 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.20 2x17 h GLU 37 CO 1.10 0.50 -0.00 0.78 -1.00 0.00 0.00 179.01 180.39 2x17 h GLY 38 N 1.71 0.18 1.08 -3.84 0.00 -1.90 -0.61 103.07 99.70 2x17 h GLY 38 Ca -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 2x17 h GLY 38 CO 0.06 0.13 0.49 0.74 0.00 0.00 0.00 176.54 177.96 2x17 h PHE 39 N -0.12 1.18 -0.28 5.60 -1.00 -1.76 -1.71 116.94 118.85 2x17 h PHE 39 Ca 0.03 -0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.76 2x17 h PHE 39 Cb 0.37 -0.38 -0.01 0.00 3.61 0.00 0.00 35.95 39.54 2x17 h PHE 39 CO 0.04 0.81 0.05 0.00 -1.61 0.00 0.00 178.31 177.60 2x17 h ALA 40 N 1.33 0.37 -0.13 2.45 0.00 -1.29 -1.96 119.26 120.03 2x17 h ALA 40 Ca 0.31 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 2x17 h ALA 40 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2x17 h ALA 40 CO -0.05 0.05 -0.40 -0.91 0.00 0.00 0.00 179.25 177.94 2x17 h ASN 41 N 0.29 0.30 -0.67 0.00 2.35 -1.04 -1.82 115.58 114.99 2x17 h ASN 41 Ca 0.09 -0.13 -0.06 0.00 -0.55 0.00 0.00 56.30 55.65 2x17 h ASN 41 Cb 0.32 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 2x17 h ASN 41 CO 0.00 0.68 0.17 -0.25 -1.65 0.00 0.00 177.43 176.38 2x17 h TRP 42 N 0.25 1.12 -0.24 1.19 7.01 -1.23 -1.47 115.95 122.58 2x17 h TRP 42 Ca 0.02 -0.13 -0.15 0.00 2.11 0.00 0.00 58.89 60.74 2x17 h TRP 42 Cb 0.82 -0.32 -0.01 0.00 -2.10 0.00 0.00 29.16 27.55 2x17 h TRP 42 CO 0.02 0.92 -0.46 0.52 -2.79 0.00 0.00 178.44 176.65 2x17 h MET 43 N 1.00 0.62 -0.62 2.65 2.86 -1.15 -1.08 114.93 119.20 2x17 h MET 43 Ca 0.21 -0.34 -0.09 0.00 -2.06 0.00 0.00 59.70 57.42 2x17 h MET 43 Cb 0.36 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.01 2x17 h MET 43 CO 0.00 0.95 0.05 0.87 1.06 0.00 0.00 176.91 179.84 2x17 h LYS 44 N 0.50 1.07 -0.44 1.72 1.57 -1.24 0.13 116.57 119.88 2x17 h LYS 44 Ca 0.03 -0.32 -0.08 0.00 -1.87 0.00 0.00 60.65 58.42 2x17 h LYS 44 Cb 0.99 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.17 2x17 h LYS 44 CO 0.09 1.02 -0.05 0.00 -0.57 0.00 0.00 179.45 179.94 2x17 h ALA 45 N 1.01 1.09 -0.29 3.86 0.00 -1.15 -2.23 119.26 121.54 2x17 h ALA 45 Ca 0.18 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 2x17 h ALA 45 Cb 0.50 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2x17 h ALA 45 CO 0.02 0.57 -0.46 0.37 0.00 0.00 0.00 179.25 179.76 2x17 h GLN 46 N 0.69 0.76 -0.16 0.00 5.75 -0.94 -3.02 115.11 118.18 2x17 h GLN 46 Ca 0.13 -0.43 -0.03 0.00 -0.15 0.00 0.00 58.65 58.17 2x17 h GLN 46 Cb 0.50 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.07 2x17 h GLN 46 CO 0.03 1.05 -0.04 0.00 -2.65 0.00 0.00 178.83 177.22 2x17 h ALA 47 N 0.88 1.64 -0.30 3.38 0.00 -0.49 -2.27 119.26 122.10 2x17 h ALA 47 Ca 0.04 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 2x17 h ALA 47 Cb 1.02 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2x17 h ALA 47 CO 0.10 0.27 -0.37 0.93 0.00 0.00 0.00 179.25 180.17 2x17 h GLU 48 N 0.24 0.70 -0.44 0.00 5.08 -1.32 -2.98 114.58 115.85 2x17 h GLU 48 Ca 0.05 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 58.02 2x17 h GLU 48 Cb 0.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2x17 h GLU 48 CO 0.01 0.96 0.08 0.93 -1.00 0.00 0.00 179.01 179.99 2x17 h GLU 49 N 0.58 0.67 -0.16 2.33 4.39 -1.29 -2.09 114.58 119.01 2x17 h GLU 49 Ca 0.05 -0.13 -0.14 0.00 0.34 0.00 0.00 59.36 59.48 2x17 h GLU 49 Cb 0.90 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.44 2x17 h GLU 49 CO 0.08 0.63 -0.51 0.93 -1.16 0.00 0.00 179.01 178.98 2x17 h GLU 50 N 0.65 0.43 -0.31 2.33 4.39 -1.42 -1.43 114.58 119.22 2x17 h GLU 50 Ca 0.14 -0.26 -0.07 0.00 0.34 0.00 0.00 59.36 59.52 2x17 h GLU 50 Cb 0.28 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 2x17 h GLU 50 CO 0.00 0.84 -0.10 0.82 -1.16 0.00 0.00 179.01 179.41 2x17 h ILE 51 N 0.34 1.23 -0.81 3.13 2.04 -1.35 -1.99 117.51 120.10 2x17 h ILE 51 Ca 0.01 -0.99 -0.04 0.00 1.00 0.00 0.00 64.86 64.84 2x17 h ILE 51 Cb 1.01 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 38.16 2x17 h ILE 51 CO 0.09 0.33 0.35 1.23 0.00 0.00 0.00 178.15 180.15 2x17 h GLY 52 N 0.92 1.28 1.16 5.37 0.00 -0.80 -1.71 103.07 109.29 2x17 h GLY 52 Ca 0.09 -0.67 -0.11 0.00 0.00 0.00 0.00 47.33 46.65 2x17 h GLY 52 CO 0.03 0.63 -0.09 0.45 0.00 0.00 0.00 176.54 177.56 2x17 h HIS 53 N 1.16 1.09 -0.46 5.60 3.86 -0.99 -2.57 115.15 122.85 2x17 h HIS 53 Ca 0.27 -0.21 -0.05 0.00 -1.16 0.00 0.00 60.37 59.22 2x17 h HIS 53 Cb 0.18 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.35 2x17 h HIS 53 CO 0.02 1.01 0.07 0.00 0.86 0.00 0.00 177.93 179.89 2x17 h ALA 54 N 1.01 1.27 0.00 2.45 0.00 -1.15 -2.33 119.26 120.51 2x17 h ALA 54 Ca 0.14 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2x17 h ALA 54 Cb 0.64 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2x17 h ALA 54 CO 0.04 0.50 -0.44 -0.07 0.00 0.00 0.00 179.25 179.28 2x17 h LEU 55 N 0.68 0.00 -0.36 0.00 3.38 -1.14 -1.51 115.31 116.35 2x17 h LEU 55 Ca 0.15 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.98 2x17 h LEU 55 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2x17 h LEU 55 CO 0.00 0.44 -0.32 0.03 0.09 0.00 0.00 178.44 178.68 2x17 h ARG 56 N 0.00 0.86 -0.54 1.13 3.08 -1.02 0.11 114.38 118.00 2x17 h ARG 56 Ca -0.00 -0.44 -0.10 0.00 0.07 0.00 0.00 59.98 59.51 2x17 h ARG 56 Cb 0.80 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 2x17 h ARG 56 CO 0.06 1.08 -0.05 0.74 -1.07 0.00 0.00 179.97 180.73 2x17 h PHE 57 N 0.66 1.04 -0.27 3.04 0.04 -1.38 -1.48 116.94 118.58 2x17 h PHE 57 Ca 0.06 -0.18 0.02 0.00 2.80 0.00 0.00 57.97 60.67 2x17 h PHE 57 Cb 0.91 -0.27 -0.03 0.00 2.20 0.00 0.00 35.95 38.76 2x17 h PHE 57 CO 0.06 0.95 0.12 -0.92 -0.60 0.00 0.00 178.31 177.93 2x17 h TYR 58 N 0.87 0.22 -0.38 -0.55 5.03 -1.13 -2.06 116.97 118.97 2x17 h TYR 58 Ca 0.15 0.01 -0.12 0.00 2.58 0.00 0.00 58.73 61.35 2x17 h TYR 58 Cb 0.57 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.78 2x17 h TYR 58 CO 0.04 0.12 -0.25 -0.91 -1.32 0.00 0.00 178.16 175.83 2x17 h ASN 59 N 0.26 0.79 -0.29 -2.11 2.35 -0.82 -3.07 115.58 112.69 2x17 h ASN 59 Ca 0.12 -0.29 -0.10 0.00 -0.55 0.00 0.00 56.30 55.47 2x17 h ASN 59 Cb 0.06 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 2x17 h ASN 59 CO -0.10 1.00 -0.22 0.22 -1.65 0.00 0.00 177.43 176.68 2x17 h TYR 60 N 0.67 0.77 -0.72 1.19 3.20 -1.21 -2.17 116.97 118.70 2x17 h TYR 60 Ca 0.09 -0.22 0.08 0.00 3.14 0.00 0.00 58.73 61.82 2x17 h TYR 60 Cb 0.76 -0.17 -0.07 0.00 1.54 0.00 0.00 36.73 38.80 2x17 h TYR 60 CO 0.04 0.93 0.38 0.82 -1.64 0.00 0.00 178.16 178.70 2x17 h ILE 61 N 0.39 0.90 0.00 1.81 2.04 -1.37 -1.32 117.51 119.97 2x17 h ILE 61 Ca 0.05 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 2x17 h ILE 61 Cb 0.77 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 2x17 h ILE 61 CO 0.06 0.12 -0.08 1.88 0.00 0.00 0.00 178.15 180.13 2x17 h TYR 62 N 0.67 0.00 0.00 1.37 0.05 -1.54 0.12 116.97 117.64 2x17 h TYR 62 Ca 0.34 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 59.04 2x17 h TYR 62 Cb 0.30 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.03 2x17 h TYR 62 CO -0.09 0.08 -0.39 -0.44 -1.05 0.00 0.00 178.16 176.27 2x17 h ASP 63 N 0.00 0.00 -0.56 3.88 3.32 -0.61 -3.02 116.42 119.42 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 0.95 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.50 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 -3.57 4.80 -2.91 3.56 5.12 -0.60 -4.93 116.66 118.14 2x17 n ARG 64 Ca -0.00 -3.06 -0.22 0.00 -1.93 0.00 0.00 57.85 52.63 2x17 n ARG 64 Cb 0.51 -2.25 0.03 0.00 -1.16 0.00 0.00 32.46 29.59 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 0.61 -6.03 -0.77 0.55 5.15 -1.14 -3.84 115.26 109.77 2x17 n ASN 65 Ca 0.27 -0.23 0.00 0.00 -0.60 0.00 0.00 54.58 54.02 2x17 n ASN 65 Cb 1.17 -4.90 0.00 0.00 -0.53 0.00 0.00 39.78 35.52 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 -1.42 1.77 2.77 8.20 0.00 0.40 -4.88 105.19 112.03 2x17 n GLY 66 Ca -0.14 -2.05 -0.17 0.00 0.00 0.00 0.00 46.02 43.67 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 1.20 -0.02 -0.02 1.61 6.06 -1.26 -4.60 118.95 121.92 2x17 s ARG 67 Ca 0.00 0.35 -0.27 0.00 -2.50 0.00 0.00 55.73 53.31 2x17 s ARG 67 Cb 0.00 -0.33 -0.04 0.00 0.06 0.00 0.00 34.95 34.64 2x17 s ARG 67 CO 0.00 -0.25 0.85 0.08 -2.50 0.00 0.00 175.30 173.48 2x17 s VAL 68 N 1.67 4.92 -0.12 7.11 1.01 -1.26 -5.01 120.40 128.71 2x17 s VAL 68 Ca -0.02 1.77 0.01 0.00 0.00 0.00 0.00 61.98 63.74 2x17 s VAL 68 Cb -0.12 -4.19 0.02 0.00 0.00 0.00 0.00 36.38 32.08 2x17 s VAL 68 CO -0.04 0.22 -0.16 -0.70 0.00 0.00 0.00 175.10 174.42 2x17 s GLU 69 N 0.80 2.38 -0.26 2.72 2.12 -1.26 -5.12 118.70 120.08 2x17 s GLU 69 Ca 0.45 -0.61 -0.17 0.00 0.36 0.00 0.00 54.97 54.99 2x17 s GLU 69 Cb -0.20 -2.04 -0.03 0.00 0.26 0.00 0.00 34.13 32.12 2x17 s GLU 69 CO 0.24 -0.10 0.48 -0.51 -0.54 0.00 0.00 175.26 174.83 2x17 s LEU 70 N 1.09 4.05 0.65 2.70 1.43 -1.26 -4.93 118.68 122.41 2x17 s LEU 70 Ca -0.04 0.46 -0.01 0.00 -1.03 0.00 0.00 54.13 53.51 2x17 s LEU 70 Cb -0.14 -2.60 0.08 0.00 0.03 0.00 0.00 46.19 43.55 2x17 s LEU 70 CO -0.04 -0.26 0.91 -1.81 0.23 0.00 0.00 176.35 175.37 2x17 s ASP 71 N 1.57 4.80 0.29 2.29 1.01 -1.26 -5.06 116.67 120.31 2x17 s ASP 71 Ca 0.20 -0.06 -0.29 0.00 0.71 0.00 0.00 52.55 53.11 2x17 s ASP 71 Cb -0.16 -0.58 -0.10 0.00 1.01 0.00 0.00 42.92 43.10 2x17 s ASP 71 CO 0.09 -1.53 1.15 -1.83 0.21 0.00 0.00 175.17 173.26 2x17 s GLU 72 N -5.01 4.57 -0.35 8.23 4.04 -1.26 -5.02 118.70 123.90 2x17 s GLU 72 Ca 0.62 1.90 -0.16 0.00 0.04 0.00 0.00 54.97 57.36 2x17 s GLU 72 Cb -0.08 -3.15 -0.01 0.00 0.02 0.00 0.00 34.13 30.91 2x17 s GLU 72 CO 0.42 0.11 0.41 0.42 -1.84 0.00 0.00 175.26 174.78 2x17 s ILE 73 N -1.17 5.12 0.82 1.83 1.01 -1.26 -5.07 121.20 122.49 2x17 s ILE 73 Ca 0.46 0.10 -0.11 0.00 0.00 0.00 0.00 60.65 61.09 2x17 s ILE 73 Cb -0.34 -3.88 0.09 0.00 0.01 0.00 0.00 42.46 38.35 2x17 s ILE 73 CO 0.44 -0.15 1.13 -2.16 0.00 0.00 0.00 174.94 174.20 2x17 s PRO 74 N 2.13 1.71 0.06 2.79 0.04 -1.26 -4.96 135.00 135.51 2x17 s PRO 74 Ca 0.14 1.44 -0.31 0.00 0.04 0.00 0.00 61.00 62.31 2x17 s PRO 74 Cb -0.16 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.49 2x17 s PRO 74 CO 0.12 -2.10 1.47 0.21 0.04 0.00 0.00 177.00 176.75 2x17 s LYS 75 N -4.61 4.27 0.53 4.56 2.20 -1.26 -5.02 119.74 120.40 2x17 s LYS 75 Ca 0.66 2.12 -0.08 0.00 -0.36 0.00 0.00 55.97 58.31 2x17 s LYS 75 Cb -0.21 -3.46 -0.04 0.00 -1.51 0.00 0.00 37.83 32.61 2x17 s LYS 75 CO 0.55 -0.58 0.87 -1.25 -0.36 0.00 0.00 175.35 174.58 2x17 s PRO 76 N 2.00 3.58 0.35 4.03 0.04 -1.26 -5.03 135.00 138.70 2x17 s PRO 76 Ca 0.67 0.41 -0.28 0.00 0.04 0.00 0.00 61.00 61.84 2x17 s PRO 76 Cb -0.36 -2.27 -0.12 0.00 0.04 0.00 0.00 34.50 31.79 2x17 s PRO 76 CO 0.29 -0.32 1.38 -2.30 0.04 0.00 0.00 177.00 176.09 2x17 n PRO 77 N -2.38 2.36 0.06 0.56 -0.02 -1.26 -4.95 135.00 129.37 2x17 n PRO 77 Ca 0.03 0.83 -0.22 0.00 -2.02 0.00 0.00 63.50 62.11 2x17 n PRO 77 Cb 0.55 -2.48 -0.15 0.00 -0.02 0.00 0.00 33.50 31.40 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 2.86 0.35 -5.43 -0.52 3.64 -1.96 -3.45 116.57 112.06 2x17 h LYS 78 Ca -0.48 -0.60 -0.42 0.00 -1.27 0.00 0.00 60.65 57.89 2x17 h LYS 78 Cb 1.26 0.22 -0.16 0.00 -0.41 0.00 0.00 32.23 33.15 2x17 h LYS 78 CO 0.64 1.29 -0.74 -1.21 -2.27 0.00 0.00 179.45 177.16 2x17 s GLU 79 N -2.53 1.16 0.03 1.90 2.02 -1.26 -4.69 118.70 115.32 2x17 s GLU 79 Ca -0.17 -1.42 0.01 0.00 0.02 0.00 0.00 54.97 53.42 2x17 s GLU 79 Cb 0.04 -0.95 -0.02 0.00 0.10 0.00 0.00 34.13 33.30 2x17 s GLU 79 CO 0.83 0.16 -0.05 -1.58 0.02 0.00 0.00 175.26 174.64 2x17 s TRP 80 N -2.68 0.47 0.17 1.61 0.51 -1.26 -5.08 118.94 112.69 2x17 s TRP 80 Ca 0.16 -0.48 -0.14 0.00 -2.12 0.00 0.00 56.10 53.52 2x17 s TRP 80 Cb -0.02 -0.30 0.13 0.00 -0.81 0.00 0.00 33.47 32.47 2x17 s TRP 80 CO 0.04 -0.12 1.74 0.93 -0.51 0.00 0.00 176.95 179.03 2x17 h GLU 81 N 4.67 0.29 -4.28 4.98 5.08 -2.01 -3.45 114.58 119.86 2x17 h GLU 81 Ca -0.34 -0.02 -0.17 0.00 -1.00 0.00 0.00 59.36 57.84 2x17 h GLU 81 Cb 1.21 -0.07 -0.14 0.00 0.50 0.00 0.00 28.75 30.25 2x17 h GLU 81 CO 0.41 0.19 -0.53 -1.54 -1.00 0.00 0.00 179.01 176.55 2x17 s SER 82 N -5.36 0.18 0.47 1.42 1.04 -1.26 -5.01 113.70 105.18 2x17 s SER 82 Ca -0.13 -1.14 0.15 0.00 0.48 0.00 0.00 55.95 55.31 2x17 s SER 82 Cb 0.14 0.37 1.14 0.00 0.10 0.00 0.00 66.02 67.77 2x17 s SER 82 CO 0.72 -0.82 2.05 -0.65 0.98 0.00 0.00 173.24 175.52 2x17 h PRO 83 N 2.70 0.23 -0.39 4.02 0.11 -2.00 -1.93 132.00 134.73 2x17 h PRO 83 Ca -0.34 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.71 2x17 h PRO 83 Cb 1.22 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2x17 h PRO 83 CO 0.54 0.15 0.04 1.25 -0.21 0.00 0.00 178.00 179.77 2x17 h LEU 84 N 0.23 0.63 -1.27 2.35 5.85 -1.96 -2.79 115.31 118.36 2x17 h LEU 84 Ca 0.16 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.56 2x17 h LEU 84 Cb 0.36 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2x17 h LEU 84 CO -0.03 0.75 -0.24 0.11 -0.34 0.00 0.00 178.44 178.69 2x17 h LYS 85 N 0.49 0.00 -0.27 1.25 1.79 -1.85 -1.84 116.57 116.15 2x17 h LYS 85 Ca 0.12 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.47 2x17 h LYS 85 Cb 0.40 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.04 2x17 h LYS 85 CO 0.01 0.24 -0.29 0.00 -1.08 0.00 0.00 179.45 178.33 2x17 h ALA 86 N 1.76 0.39 0.00 3.86 0.00 -1.24 -2.15 119.26 121.88 2x17 h ALA 86 Ca -0.00 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.40 2x17 h ALA 86 Cb 0.68 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2x17 h ALA 86 CO 0.03 0.41 -0.49 0.74 0.00 0.00 0.00 179.25 179.94 2x17 h PHE 87 N 0.39 0.00 -0.41 0.00 0.04 -1.33 -1.21 116.94 114.43 2x17 h PHE 87 Ca 0.04 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.72 2x17 h PHE 87 Cb 0.86 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.99 2x17 h PHE 87 CO 0.08 0.49 -0.09 0.93 -0.60 0.00 0.00 178.31 179.12 2x17 h GLU 88 N 0.00 0.72 -0.02 1.51 5.08 -1.31 -0.17 114.58 120.39 2x17 h GLU 88 Ca -0.00 -0.23 -0.16 0.00 -1.00 0.00 0.00 59.36 57.97 2x17 h GLU 88 Cb 1.08 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.24 2x17 h GLU 88 CO 0.06 0.80 -0.70 0.00 -1.00 0.00 0.00 179.01 178.18 2x17 h ALA 89 N 1.24 0.79 -0.19 3.43 0.00 -1.08 -2.23 119.26 121.22 2x17 h ALA 89 Ca 0.12 -0.62 -0.17 0.00 0.00 0.00 0.00 54.91 54.24 2x17 h ALA 89 Cb 0.55 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2x17 h ALA 89 CO 0.03 0.82 -0.56 0.00 0.00 0.00 0.00 179.25 179.54 2x17 h ALA 90 N 1.20 0.32 -0.28 0.00 0.00 -1.02 -2.47 119.26 117.01 2x17 h ALA 90 Ca -0.01 -0.52 -0.12 0.00 0.00 0.00 0.00 54.91 54.25 2x17 h ALA 90 Cb 1.24 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2x17 h ALA 90 CO 0.10 0.54 -0.33 -0.92 0.00 0.00 0.00 179.25 178.64 2x17 h TYR 91 N 0.41 0.70 -0.18 0.00 3.20 -1.05 0.53 116.97 120.59 2x17 h TYR 91 Ca -0.02 -0.18 -0.10 0.00 3.14 0.00 0.00 58.73 61.57 2x17 h TYR 91 Cb 1.19 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 2x17 h TYR 91 CO 0.09 0.86 -0.32 1.49 -1.64 0.00 0.00 178.16 178.63 2x17 h GLU 92 N 0.51 0.37 0.00 1.82 4.81 -1.45 -2.28 114.58 118.36 2x17 h GLU 92 Ca 0.06 -0.15 -0.19 0.00 -0.13 0.00 0.00 59.36 58.94 2x17 h GLU 92 Cb 0.82 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 2x17 h GLU 92 CO 0.07 0.65 -0.86 1.25 -0.73 0.00 0.00 179.01 179.39 2x17 h HIS 93 N 0.32 0.23 0.00 0.92 2.76 -1.07 -2.40 115.15 115.91 2x17 h HIS 93 Ca 0.04 -0.13 -0.10 0.00 -2.20 0.00 0.00 60.37 57.99 2x17 h HIS 93 Cb 0.73 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.65 2x17 h HIS 93 CO 0.02 0.94 -0.45 0.93 -1.30 0.00 0.00 177.93 178.07 2x17 h GLU 94 N 0.09 0.00 -0.01 5.26 4.39 -0.73 -0.63 114.58 122.95 2x17 h GLU 94 Ca -0.04 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.50 2x17 h GLU 94 Cb 1.49 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.12 2x17 h GLU 94 CO 0.13 0.45 -0.74 0.87 -1.16 0.00 0.00 179.01 178.56 2x17 h LYS 95 N 0.00 0.06 -0.42 2.33 1.57 -1.37 -2.11 116.57 116.64 2x17 h LYS 95 Ca -0.00 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 2x17 h LYS 95 Cb 0.81 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 2x17 h LYS 95 CO 0.06 0.78 -0.15 0.35 -0.57 0.00 0.00 179.45 179.91 2x17 h PHE 96 N 0.04 0.96 -0.34 -1.35 3.57 -0.94 -1.65 116.94 117.22 2x17 h PHE 96 Ca -0.01 -0.22 -0.07 0.00 3.53 0.00 0.00 57.97 61.19 2x17 h PHE 96 Cb 1.31 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.81 2x17 h PHE 96 CO 0.01 0.98 -0.07 0.82 -2.23 0.00 0.00 178.31 177.82 2x17 h ILE 97 N 0.66 1.28 -0.91 1.41 1.08 -1.14 -2.42 117.51 117.47 2x17 h ILE 97 Ca 0.10 -1.11 0.01 0.00 -0.39 0.00 0.00 64.86 63.46 2x17 h ILE 97 Cb 0.70 1.31 -0.04 0.00 -3.07 0.00 0.00 36.82 35.72 2x17 h ILE 97 CO 0.05 0.36 0.59 0.28 -0.69 0.00 0.00 178.15 178.74 2x17 h SER 98 N 0.43 1.05 -0.67 1.72 0.02 -1.37 -1.36 113.55 113.37 2x17 h SER 98 Ca 0.09 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.94 2x17 h SER 98 Cb 0.56 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 2x17 h SER 98 CO 0.03 0.77 0.16 0.50 -1.14 0.00 0.00 176.83 177.16 2x17 h LYS 99 N 1.23 1.07 0.00 3.45 3.64 -1.23 -0.34 116.57 124.39 2x17 h LYS 99 Ca 0.33 -0.26 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 2x17 h LYS 99 Cb -0.12 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.55 2x17 h LYS 99 CO -0.07 0.95 -0.23 0.66 -2.27 0.00 0.00 179.45 178.49 2x17 h SER 100 N 0.99 0.00 -0.03 4.20 4.64 -1.13 -0.93 113.55 121.29 2x17 h SER 100 Ca 0.21 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.29 2x17 h SER 100 Cb 0.36 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.47 2x17 h SER 100 CO 0.00 0.23 -0.89 0.40 -0.87 0.00 0.00 176.83 175.71 2x17 h ILE 101 N 0.00 1.29 -0.73 0.95 1.08 -0.86 -2.82 117.51 116.43 2x17 h ILE 101 Ca -0.00 -2.12 -0.02 0.00 -0.39 0.00 0.00 64.86 62.33 2x17 h ILE 101 Cb 0.74 2.16 -0.03 0.00 -3.07 0.00 0.00 36.82 36.62 2x17 h ILE 101 CO 0.03 0.66 0.39 1.88 -0.69 0.00 0.00 178.15 180.42 2x17 h TYR 102 N 0.45 1.01 0.00 1.37 0.05 -0.64 -1.57 116.97 117.65 2x17 h TYR 102 Ca -0.08 -0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.60 2x17 h TYR 102 Cb 1.52 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 38.93 2x17 h TYR 102 CO 0.09 0.72 -0.33 0.93 -1.05 0.00 0.00 178.16 178.52 2x17 h GLU 103 N 1.01 0.00 -0.00 4.88 5.08 -1.23 0.40 114.58 124.71 2x17 h GLU 103 Ca 0.25 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.40 2x17 h GLU 103 Cb 0.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2x17 h GLU 103 CO -0.04 0.33 -0.91 -0.07 -1.00 0.00 0.00 179.01 177.32 2x17 h LEU 104 N 0.00 0.46 -0.59 1.33 3.38 -1.27 -1.97 115.31 116.65 2x17 h LEU 104 Ca -0.00 -0.36 -0.13 0.00 0.09 0.00 0.00 57.88 57.47 2x17 h LEU 104 Cb 0.73 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2x17 h LEU 104 CO 0.04 1.16 -0.31 0.00 0.09 0.00 0.00 178.44 179.43 2x17 h ALA 105 N 0.81 0.77 -0.21 1.53 0.00 -0.74 -1.46 119.26 119.96 2x17 h ALA 105 Ca -0.07 -0.41 -0.13 0.00 0.00 0.00 0.00 54.91 54.31 2x17 h ALA 105 Cb 1.54 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2x17 h ALA 105 CO 0.15 0.65 -0.40 0.00 0.00 0.00 0.00 179.25 179.65 2x17 h ALA 106 N 0.98 0.92 -0.29 0.00 0.00 -0.98 -2.18 119.26 117.71 2x17 h ALA 106 Ca 0.08 -0.43 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 2x17 h ALA 106 Cb 0.84 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2x17 h ALA 106 CO 0.07 0.63 -0.32 1.25 0.00 0.00 0.00 179.25 180.89 2x17 h LEU 107 N 0.40 0.63 -0.27 0.00 5.85 -1.19 -2.37 115.31 118.37 2x17 h LEU 107 Ca 0.04 -0.25 -0.21 0.00 0.84 0.00 0.00 57.88 58.30 2x17 h LEU 107 Cb 0.88 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2x17 h LEU 107 CO 0.07 0.91 -0.83 0.00 -0.34 0.00 0.00 178.44 178.26 2x17 h ALA 108 N 1.13 0.46 -0.21 1.25 0.00 -1.19 -2.56 119.26 118.14 2x17 h ALA 108 Ca 0.06 -0.65 -0.13 0.00 0.00 0.00 0.00 54.91 54.19 2x17 h ALA 108 Cb 0.81 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2x17 h ALA 108 CO 0.07 0.77 -0.41 0.93 0.00 0.00 0.00 179.25 180.61 2x17 h GLU 109 N 0.30 0.50 -0.01 0.00 5.08 -1.35 -0.72 114.58 118.37 2x17 h GLU 109 Ca -0.05 -0.25 -0.16 0.00 -1.00 0.00 0.00 59.36 57.89 2x17 h GLU 109 Cb 1.43 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.67 2x17 h GLU 109 CO 0.15 0.83 -0.74 1.49 -1.00 0.00 0.00 179.01 179.73 2x17 h GLU 110 N 0.41 0.11 -0.01 2.33 4.81 -1.45 -3.24 114.58 117.54 2x17 h GLU 110 Ca 0.04 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2x17 h GLU 110 Cb 0.89 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.30 2x17 h GLU 110 CO 0.08 0.80 -0.20 0.39 -0.73 0.00 0.00 179.01 179.34 2x17 n GLU 111 N -3.71 1.09 -1.17 1.92 1.02 -0.96 -4.94 120.64 113.89 2x17 n GLU 111 Ca -0.02 -0.67 -0.06 0.00 -0.02 0.00 0.00 57.16 56.39 2x17 n GLU 111 Cb 0.72 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.63 2x17 n GLU 111 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2x17 n LYS 112 N -0.37 -0.83 -2.58 3.49 4.81 -0.72 -4.94 118.16 117.02 2x17 n LYS 112 Ca 0.14 0.60 -0.42 0.00 -0.87 0.00 0.00 58.31 57.76 2x17 n LYS 112 Cb 0.36 -4.45 -0.02 0.00 0.02 0.00 0.00 35.03 30.94 2x17 n LYS 112 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2x17 s ASP 113 N -2.51 6.59 0.29 3.14 -1.08 -0.36 -4.80 116.67 117.95 2x17 s ASP 113 Ca 0.00 -1.73 0.07 0.00 -0.52 0.00 0.00 52.55 50.37 2x17 s ASP 113 Cb 0.00 -2.57 0.43 0.00 -1.46 0.00 0.00 42.92 39.33 2x17 s ASP 113 CO 0.00 -1.41 1.68 1.88 0.52 0.00 0.00 175.17 177.84 2x17 h TYR 114 N 9.20 0.22 -0.53 -5.34 -1.99 -1.92 -2.12 116.97 114.49 2x17 h TYR 114 Ca 0.26 -0.07 -0.06 0.00 2.00 0.00 0.00 58.73 60.86 2x17 h TYR 114 Cb 0.97 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 39.64 2x17 h TYR 114 CO 1.31 0.62 0.09 0.77 -0.00 0.00 0.00 178.16 180.95 2x17 h SER 115 N 0.15 0.84 0.20 3.88 0.02 -1.97 0.90 113.55 117.58 2x17 h SER 115 Ca 0.01 -0.26 -0.20 0.00 -0.84 0.00 0.00 61.79 60.50 2x17 h SER 115 Cb 0.88 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 63.20 2x17 h SER 115 CO 0.07 0.89 -0.79 0.74 -1.14 0.00 0.00 176.83 176.60 2x17 h THR 116 N 0.76 1.36 -0.48 -2.27 2.02 -1.96 -1.72 112.91 110.64 2x17 h THR 116 Ca 0.16 -2.18 -0.08 0.00 0.77 0.00 0.00 66.41 65.08 2x17 h THR 116 Cb 0.41 2.16 -0.02 0.00 -1.74 0.00 0.00 68.15 68.96 2x17 h THR 116 CO 0.01 0.66 -0.01 -0.09 0.37 0.00 0.00 175.52 176.46 2x17 h ARG 117 N 0.31 0.80 -0.02 6.66 9.65 -1.23 -0.29 114.38 130.26 2x17 h ARG 117 Ca -0.05 -0.22 -0.17 0.00 -1.10 0.00 0.00 59.98 58.44 2x17 h ARG 117 Cb 1.39 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.86 2x17 h ARG 117 CO 0.14 0.81 -0.75 0.00 2.80 0.00 0.00 179.97 182.97 2x17 h ALA 118 N 1.24 0.70 -0.30 2.80 0.00 -0.79 -3.07 119.26 119.84 2x17 h ALA 118 Ca 0.14 -0.65 -0.09 0.00 0.00 0.00 0.00 54.91 54.31 2x17 h ALA 118 Cb 0.47 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2x17 h ALA 118 CO 0.02 0.86 -0.15 0.35 0.00 0.00 0.00 179.25 180.33 2x17 h PHE 119 N 0.09 0.72 0.00 0.00 3.57 -1.01 -3.14 116.94 117.18 2x17 h PHE 119 Ca -0.02 -0.18 0.00 0.00 3.53 0.00 0.00 57.97 61.30 2x17 h PHE 119 Cb 1.33 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.90 2x17 h PHE 119 CO 0.02 0.86 0.00 1.28 -2.23 0.00 0.00 178.31 178.24 2x17 n LEU 120 N -4.40 0.61 -0.11 0.59 4.77 -0.15 -2.99 117.00 115.32 2x17 n LEU 120 Ca -0.03 0.65 0.01 0.00 -0.03 0.00 0.00 56.01 56.61 2x17 n LEU 120 Cb 0.38 -0.58 0.30 0.00 -2.33 0.00 0.00 43.42 41.19 2x17 n LEU 120 CO 0.42 -0.55 1.14 -0.08 -1.33 0.00 0.00 177.39 177.00 2x17 h GLU 121 N 0.00 0.77 -0.86 3.23 4.57 -1.48 -1.94 114.58 118.87 2x17 h GLU 121 Ca 0.00 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2x17 h GLU 121 Cb 0.34 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 28.73 2x17 h GLU 121 CO 0.00 0.56 0.54 2.35 -1.18 0.00 0.00 179.01 181.29 2x17 h TRP 122 N 0.78 1.11 -0.00 0.92 7.01 -1.72 -2.93 115.95 121.12 2x17 h TRP 122 Ca 0.20 0.01 -0.16 0.00 2.11 0.00 0.00 58.89 61.05 2x17 h TRP 122 Cb 0.01 -0.37 -0.02 0.00 -2.10 0.00 0.00 29.16 26.68 2x17 h TRP 122 CO 0.00 0.72 -0.74 0.74 -2.79 0.00 0.00 178.44 176.38 2x17 h PHE 123 N 1.18 0.05 -0.35 2.65 0.04 -1.56 -1.73 116.94 117.21 2x17 h PHE 123 Ca 0.31 -0.02 -0.05 0.00 2.80 0.00 0.00 57.97 61.01 2x17 h PHE 123 Cb -0.09 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.04 2x17 h PHE 123 CO -0.01 0.76 0.03 0.82 -0.60 0.00 0.00 178.31 179.31 2x17 h ILE 124 N 0.02 1.25 -0.14 -0.55 2.04 -1.32 -0.55 117.51 118.25 2x17 h ILE 124 Ca -0.01 -0.90 -0.12 0.00 1.00 0.00 0.00 64.86 64.82 2x17 h ILE 124 Cb 1.31 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 2x17 h ILE 124 CO 0.10 0.30 -0.45 0.78 0.00 0.00 0.00 178.15 178.88 2x17 h ASN 125 N 0.43 0.36 -0.36 1.72 2.35 -1.51 -3.10 115.58 115.46 2x17 h ASN 125 Ca 0.10 -0.17 -0.14 0.00 -0.55 0.00 0.00 56.30 55.55 2x17 h ASN 125 Cb 0.40 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 2x17 h ASN 125 CO 0.01 0.77 -0.32 -0.08 -1.65 0.00 0.00 177.43 176.16 2x17 h GLU 126 N 0.28 0.86 0.00 0.81 4.22 -1.18 -3.14 114.58 116.42 2x17 h GLU 126 Ca 0.02 -0.44 0.00 0.00 0.08 0.00 0.00 59.36 59.02 2x17 h GLU 126 Cb 0.91 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.17 2x17 h GLU 126 CO 0.08 1.08 0.00 1.96 -2.18 0.00 0.00 179.01 179.94 2x17 h GLN 127 N 0.65 0.00 -0.37 1.92 1.08 -1.09 -2.16 115.11 115.14 2x17 h GLN 127 Ca 0.06 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.15 2x17 h GLN 127 Cb 0.90 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.32 2x17 h GLN 127 CO 0.08 0.00 -0.21 0.28 -0.95 0.00 0.00 178.83 178.03 2x17 h VAL 128 N 0.00 1.28 -0.20 -0.54 2.07 -1.49 -2.29 116.25 115.09 2x17 h VAL 128 Ca 0.00 -1.35 -0.02 0.00 0.82 0.00 0.00 66.70 66.15 2x17 h VAL 128 Cb 0.47 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2x17 h VAL 128 CO 0.00 0.45 0.05 -0.33 0.02 0.00 0.00 177.57 177.76 2x17 h GLU 129 N 0.60 0.31 -0.48 1.57 5.08 -1.44 -2.53 114.58 117.69 2x17 h GLU 129 Ca 0.08 -0.08 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 2x17 h GLU 129 Cb 0.77 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2x17 h GLU 129 CO 0.06 0.44 -0.17 0.93 -1.00 0.00 0.00 179.01 179.28 2x17 h GLU 130 N 0.13 0.97 -0.65 2.33 5.08 -1.50 0.16 114.58 121.10 2x17 h GLU 130 Ca 0.06 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.01 2x17 h GLU 130 Cb 0.27 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2x17 h GLU 130 CO 0.00 1.06 0.36 0.93 -1.00 0.00 0.00 179.01 180.36 2x17 h GLU 131 N 0.82 0.91 -0.07 2.33 5.08 -1.47 -0.67 114.58 121.51 2x17 h GLU 131 Ca 0.12 -0.11 -0.12 0.00 -1.00 0.00 0.00 59.36 58.25 2x17 h GLU 131 Cb 0.74 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2x17 h GLU 131 CO 0.06 0.69 -0.48 0.00 -1.00 0.00 0.00 179.01 178.27 2x17 h ALA 132 N 1.17 1.06 -0.33 3.43 0.00 -1.27 -1.03 119.26 122.30 2x17 h ALA 132 Ca 0.23 -0.46 -0.14 0.00 0.00 0.00 0.00 54.91 54.54 2x17 h ALA 132 Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2x17 h ALA 132 CO -0.04 0.64 -0.33 1.03 0.00 0.00 0.00 179.25 180.55 2x17 h SER 133 N 0.13 0.87 -0.07 0.00 0.87 -0.33 -2.23 113.55 112.79 2x17 h SER 133 Ca 0.01 -0.47 -0.19 0.00 -1.23 0.00 0.00 61.79 59.90 2x17 h SER 133 Cb 0.91 -0.24 0.01 0.00 -0.44 0.00 0.00 62.40 62.64 2x17 h SER 133 CO 0.07 1.16 -0.71 0.58 -0.53 0.00 0.00 176.83 177.40 2x17 h VAL 134 N 0.59 1.34 -0.58 2.23 2.07 -1.10 -3.27 116.25 117.53 2x17 h VAL 134 Ca 0.05 -2.00 -0.03 0.00 0.82 0.00 0.00 66.70 65.54 2x17 h VAL 134 Cb 0.91 2.27 -0.03 0.00 -1.52 0.00 0.00 31.29 32.92 2x17 h VAL 134 CO 0.08 0.61 0.24 0.50 0.02 0.00 0.00 177.57 179.02 2x17 h LYS 135 N 0.23 0.83 -0.60 1.57 1.63 -1.23 -1.21 116.57 117.79 2x17 h LYS 135 Ca -0.07 -0.12 -0.00 0.00 -0.85 0.00 0.00 60.65 59.61 2x17 h LYS 135 Cb 1.36 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 32.81 2x17 h LYS 135 CO 0.14 0.67 0.37 -0.22 -3.45 0.00 0.00 179.45 176.96 2x17 h LYS 136 N 0.82 0.81 -0.03 1.90 3.64 -1.47 -0.82 116.57 121.42 2x17 h LYS 136 Ca 0.20 -0.07 -0.23 0.00 -1.27 0.00 0.00 60.65 59.28 2x17 h LYS 136 Cb 0.15 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2x17 h LYS 136 CO -0.02 0.57 -0.91 0.82 -2.27 0.00 0.00 179.45 177.64 2x17 h ILE 137 N 0.81 1.35 -0.44 2.00 2.04 -1.56 -2.91 117.51 118.79 2x17 h ILE 137 Ca 0.22 -2.28 0.04 0.00 1.00 0.00 0.00 64.86 63.83 2x17 h ILE 137 Cb -0.04 2.30 -0.04 0.00 -0.74 0.00 0.00 36.82 38.30 2x17 h ILE 137 CO -0.04 0.69 0.21 0.25 0.00 0.00 0.00 178.15 179.26 2x17 h LEU 138 N 0.32 0.29 -1.37 1.44 6.46 -1.04 -1.38 115.31 120.03 2x17 h LEU 138 Ca -0.08 0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 57.67 2x17 h LEU 138 Cb 1.54 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 41.43 2x17 h LEU 138 CO 0.17 0.21 0.06 0.44 -0.62 0.00 0.00 178.44 178.70 2x17 h ASP 139 N 0.42 0.44 1.01 1.25 3.32 -1.16 -1.43 116.42 120.27 2x17 h ASP 139 Ca 0.19 -0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.11 2x17 h ASP 139 Cb 0.11 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2x17 h ASP 139 CO -0.15 0.46 -0.32 0.11 -1.72 0.00 0.00 179.24 177.62 2x17 h LYS 140 N 0.47 0.00 0.03 3.56 1.57 -1.22 -1.85 116.57 119.14 2x17 h LYS 140 Ca 0.11 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.66 2x17 h LYS 140 Cb 0.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2x17 h LYS 140 CO -0.00 0.32 -1.06 -0.07 -0.57 0.00 0.00 179.45 178.08 2x17 h LEU 141 N 0.00 0.10 -1.21 2.94 3.38 -0.51 -2.49 115.31 117.52 2x17 h LEU 141 Ca -0.00 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 2x17 h LEU 141 Cb 0.92 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2x17 h LEU 141 CO 0.04 1.08 -0.39 0.11 0.09 0.00 0.00 178.44 179.38 2x17 h LYS 142 N 0.02 0.00 0.00 1.13 1.57 -1.17 -2.92 116.57 115.20 2x17 h LYS 142 Ca -0.04 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 2x17 h LYS 142 Cb 1.82 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.12 2x17 h LYS 142 CO 0.15 0.39 -0.28 0.35 -0.57 0.00 0.00 179.45 179.48 2x17 h PHE 143 N 0.00 0.00 -2.28 -1.35 3.57 -1.21 -3.33 116.94 112.33 2x17 h PHE 143 Ca -0.00 0.00 -0.60 0.00 3.53 0.00 0.00 57.97 60.90 2x17 h PHE 143 Cb 0.71 0.00 -0.41 0.00 2.79 0.00 0.00 35.95 39.04 2x17 h PHE 143 CO 0.00 0.28 -0.56 0.00 -2.23 0.00 0.00 178.31 175.80 2x17 n ALA 144 N -2.21 4.76 -0.18 2.41 0.00 -0.95 -4.93 120.51 119.41 2x17 n ALA 144 Ca 0.01 -4.70 0.00 0.00 0.00 0.00 0.00 53.44 48.75 2x17 n ALA 144 Cb 0.54 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.19 2x17 n ALA 144 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2x17 n LYS 145 N -0.24 0.00 -1.53 0.00 5.02 -1.23 -4.03 118.16 116.15 2x17 n LYS 145 Ca 0.32 0.41 -0.35 0.00 -2.02 0.00 0.00 58.31 56.66 2x17 n LYS 145 Cb 0.39 -1.26 0.07 0.00 -0.02 0.00 0.00 35.03 34.21 2x17 n LYS 145 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2x17 n ASP 146 N -1.72 7.43 -3.69 4.39 8.00 -1.26 -4.83 116.55 124.85 2x17 n ASP 146 Ca 0.00 -3.80 -0.30 0.00 0.71 0.00 0.00 54.79 51.41 2x17 n ASP 146 Cb 0.00 -0.94 -0.15 0.00 -0.02 0.00 0.00 41.12 40.01 2x17 n ASP 146 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2x17 s SER 147 N -1.83 3.87 0.54 -2.24 0.15 -1.26 -4.97 113.70 107.96 2x17 s SER 147 Ca 0.61 -1.52 0.32 0.00 0.70 0.00 0.00 55.95 56.06 2x17 s SER 147 Cb 0.49 -0.75 1.24 0.00 -1.71 0.00 0.00 66.02 65.29 2x17 s SER 147 CO -0.10 -0.41 1.94 -0.65 1.20 0.00 0.00 173.24 175.22 2x17 h PRO 148 N 8.16 0.00 -0.33 5.44 0.11 -1.88 -3.15 132.00 140.34 2x17 h PRO 148 Ca -0.15 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.94 2x17 h PRO 148 Cb 1.02 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2x17 h PRO 148 CO 0.46 0.01 0.12 1.96 -0.21 0.00 0.00 178.00 180.34 2x17 h GLN 149 N 0.00 0.50 -0.03 1.05 7.50 -1.98 -1.97 115.11 120.19 2x17 h GLN 149 Ca -0.00 -0.10 -0.19 0.00 0.50 0.00 0.00 58.65 58.86 2x17 h GLN 149 Cb 0.58 -0.08 -0.01 0.00 0.05 0.00 0.00 27.48 28.02 2x17 h GLN 149 CO 0.00 0.52 -0.80 0.82 -1.50 0.00 0.00 178.83 177.86 2x17 h ILE 150 N 0.39 1.44 -0.47 2.54 2.04 -1.95 -2.64 117.51 118.85 2x17 h ILE 150 Ca 0.11 -2.37 -0.03 0.00 1.00 0.00 0.00 64.86 63.56 2x17 h ILE 150 Cb 0.21 2.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.56 2x17 h ILE 150 CO -0.01 0.70 0.16 0.25 0.00 0.00 0.00 178.15 179.25 2x17 h LEU 151 N 0.17 0.63 -0.41 1.44 5.85 -1.50 0.18 115.31 121.67 2x17 h LEU 151 Ca -0.04 -0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.51 2x17 h LEU 151 Cb 1.40 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 2x17 h LEU 151 CO 0.13 0.59 -0.10 0.15 -0.34 0.00 0.00 178.44 178.87 2x17 h PHE 152 N 0.68 0.89 -0.12 1.25 3.57 -1.24 -2.29 116.94 119.67 2x17 h PHE 152 Ca 0.16 -0.19 -0.15 0.00 3.53 0.00 0.00 57.97 61.32 2x17 h PHE 152 Cb 0.18 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 2x17 h PHE 152 CO 0.01 0.91 -0.57 0.52 -2.23 0.00 0.00 178.31 176.95 2x17 h MET 153 N 0.61 0.38 -0.23 1.11 2.86 -1.08 -2.88 114.93 115.69 2x17 h MET 153 Ca 0.10 -0.25 -0.07 0.00 -2.06 0.00 0.00 59.70 57.43 2x17 h MET 153 Cb 0.62 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.30 2x17 h MET 153 CO 0.04 0.85 -0.15 -0.07 1.06 0.00 0.00 176.91 178.63 2x17 h LEU 154 N 0.29 0.38 -0.90 1.22 3.38 -0.65 -2.59 115.31 116.45 2x17 h LEU 154 Ca 0.00 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 2x17 h LEU 154 Cb 1.09 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 2x17 h LEU 154 CO 0.10 0.56 -0.11 -0.78 0.09 0.00 0.00 178.44 178.30 2x17 h ASP 155 N 0.37 0.68 0.25 -0.43 3.58 -1.22 -2.50 116.42 117.14 2x17 h ASP 155 Ca 0.07 -0.19 -0.17 0.00 0.42 0.00 0.00 57.03 57.15 2x17 h ASP 155 Cb 0.49 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.35 2x17 h ASP 155 CO 0.03 0.82 -0.67 0.50 -2.88 0.00 0.00 179.24 177.04 2x17 h LYS 156 N 0.63 0.38 -0.42 0.28 3.64 -1.31 -3.04 116.57 116.73 2x17 h LYS 156 Ca 0.11 -0.29 -0.13 0.00 -1.27 0.00 0.00 60.65 59.07 2x17 h LYS 156 Cb 0.56 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 2x17 h LYS 156 CO 0.03 0.92 -0.24 0.93 -2.27 0.00 0.00 179.45 178.82 2x17 h GLU 157 N 0.27 0.91 0.00 1.90 5.08 -1.33 -3.16 114.58 118.24 2x17 h GLU 157 Ca -0.02 -0.41 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2x17 h GLU 157 Cb 1.23 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2x17 h GLU 157 CO 0.11 1.07 0.00 1.28 -1.00 0.00 0.00 179.01 180.47 2x17 n LEU 158 N -4.16 0.34 0.02 1.33 4.77 -0.95 -3.01 117.00 115.32 2x17 n LEU 158 Ca -0.01 0.54 0.09 0.00 -0.03 0.00 0.00 56.01 56.60 2x17 n LEU 158 Cb 0.47 -0.44 0.41 0.00 -2.33 0.00 0.00 43.42 41.52 2x17 n LEU 158 CO 0.46 -0.12 0.80 -1.54 -1.33 0.00 0.00 177.39 175.66 2x17 n SER 159 N -1.82 0.09 0.22 -1.43 3.41 -1.15 -2.39 113.62 110.55 2x17 n SER 159 Ca 0.06 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.27 2x17 n SER 159 Cb 0.35 -0.54 0.52 0.00 -0.26 0.00 0.00 64.21 64.28 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 2.60 1.28 -2.63 7.33 0.00 -1.70 -3.40 119.26 122.74 2x17 h ALA 160 Ca 0.00 -0.22 -0.63 0.00 0.00 0.00 0.00 54.91 54.06 2x17 h ALA 160 Cb 0.34 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 17.95 2x17 h ALA 160 CO 0.00 0.30 -0.15 0.50 0.00 0.00 0.00 179.25 179.90 2x17 s ARG 161 N -4.10 3.92 0.07 0.00 3.52 -1.01 -5.07 118.95 116.28 2x17 s ARG 161 Ca -0.02 0.03 0.05 0.00 -0.13 0.00 0.00 55.73 55.66 2x17 s ARG 161 Cb 0.13 -3.70 -0.03 0.00 -1.56 0.00 0.00 34.95 29.80 2x17 s ARG 161 CO 0.65 -0.38 -0.14 0.00 -0.81 0.00 0.00 175.30 174.62 2x17 s ALA 162 N 2.18 1.18 0.42 6.12 0.00 -1.26 -3.57 121.76 126.84 2x17 s ALA 162 Ca 0.17 -0.99 -0.26 0.00 0.00 0.00 0.00 51.96 50.88 2x17 s ALA 162 Cb -0.16 -0.10 -0.09 0.00 0.00 0.00 0.00 23.12 22.77 2x17 s ALA 162 CO 0.10 0.17 1.38 -1.25 0.00 0.00 0.00 175.76 176.17 2x17 s PRO 163 N -1.70 3.85 -0.02 0.00 0.04 -1.26 -4.77 135.00 131.14 2x17 s PRO 163 Ca -0.02 2.33 0.21 0.00 0.04 0.00 0.00 61.00 63.57 2x17 s PRO 163 Cb -0.10 -2.74 -0.31 0.00 0.04 0.00 0.00 34.50 31.39 2x17 s PRO 163 CO 0.02 -0.65 0.55 1.63 0.04 0.00 0.00 177.00 178.60 2x17 n LYS 164 N 0.02 0.54 -0.02 4.56 5.02 -1.26 -4.52 118.16 122.51 2x17 n LYS 164 Ca 0.04 -0.16 -0.13 0.00 -2.02 0.00 0.00 58.31 56.04 2x17 n LYS 164 Cb 0.42 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.82 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 -0.99 -0.35 5.85 -1.99 -3.37 115.31 114.45 2x17 h LEU 165 Ca 0.00 -0.54 0.29 0.00 0.84 0.00 0.00 57.88 58.47 2x17 h LEU 165 Cb 0.88 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.77 2x17 h LEU 165 CO 0.00 0.54 0.55 -0.65 -0.34 0.00 0.00 178.44 178.54 2x17 h PRO 166 N -0.56 0.37 0.00 5.25 0.11 -2.00 0.13 132.00 135.30 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 0.55 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.58 2x17 h PRO 166 CO 0.00 0.25 0.00 0.41 -0.21 0.00 0.00 178.00 178.45 2x17 n GLY 167 N -1.30 -0.96 0.01 -0.55 0.00 -1.26 -3.80 105.19 97.33 2x17 n GLY 167 Ca 0.29 -0.17 0.04 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 -0.93 0.00 -4.79 0.99 4.77 0.44 -5.04 117.00 112.44 2x17 n LEU 168 Ca 0.20 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.85 2x17 n LEU 168 Cb 0.09 0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 2x17 n LEU 168 CO 0.15 0.03 0.73 -0.76 -1.33 0.00 0.00 177.39 176.21 2x17 s LEU 169 N -3.86 3.54 -1.06 2.23 2.01 -1.22 -4.26 118.68 116.05 2x17 s LEU 169 Ca -0.04 1.91 -0.11 0.00 0.01 0.00 0.00 54.13 55.89 2x17 s LEU 169 Cb 0.06 -4.54 -0.04 0.00 0.01 0.00 0.00 46.19 41.68 2x17 s LEU 169 CO 0.44 -1.23 0.86 0.23 1.01 0.00 0.00 176.35 177.66 2x17 n MET 170 N -1.92 -1.80 0.00 1.70 2.81 -1.26 -5.11 117.12 111.54 2x17 n MET 170 Ca 0.09 0.75 0.00 0.00 -1.81 0.00 0.00 57.70 56.73 2x17 n MET 170 Cb 0.52 -5.15 0.00 0.00 -0.71 0.00 0.00 33.22 27.89 2x17 n MET 170 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52