#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nly h SER 7 N 0.00 0.63 -0.60 -1.43 0.87 -2.05 0.68 113.55 111.65 1nly h SER 7 Ca 0.00 0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.53 1nly h SER 7 Cb 0.00 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.80 1nly h SER 7 CO 0.00 0.40 0.24 0.00 -0.53 0.00 0.00 176.83 176.94 1nly h ALA 8 N 1.62 1.22 0.16 6.23 0.00 -2.05 -0.57 119.26 125.87 1nly h ALA 8 Ca 0.31 -0.17 -0.33 0.00 0.00 0.00 0.00 54.91 54.72 1nly h ALA 8 Cb 0.30 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.84 1nly h ALA 8 CO -0.10 0.56 -1.61 0.93 0.00 0.00 0.00 179.25 179.03 1nly h GLU 9 N 0.92 0.34 -0.96 0.00 3.07 -1.67 -3.16 114.58 113.13 1nly h GLU 9 Ca 0.21 -0.59 0.09 0.00 -0.50 0.00 0.00 59.36 58.57 1nly h GLU 9 Cb 0.20 0.22 -0.07 0.00 -0.84 0.00 0.00 28.75 28.26 1nly h GLU 9 CO -0.02 1.24 0.62 -0.44 -1.40 0.00 0.00 179.01 179.01 1nly h ASP 10 N 0.09 0.93 0.15 1.42 3.32 0.51 0.38 116.42 123.22 1nly h ASP 10 Ca -0.28 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 1nly h ASP 10 Cb 2.07 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 41.45 1nly h ASP 10 CO 0.18 0.56 -0.07 0.11 -1.72 0.00 0.00 179.24 178.30 1nly h LYS 11 N 1.04 -0.19 0.00 3.56 1.57 -1.20 0.12 116.57 121.46 1nly h LYS 11 Ca 0.44 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.21 1nly h LYS 11 Cb 0.31 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 1nly h LYS 11 CO -0.19 0.05 -0.10 0.87 -0.57 0.00 0.00 179.45 179.51 1nly h LYS 12 N -0.41 0.00 0.03 3.15 1.57 -1.36 0.44 116.57 119.98 1nly h LYS 12 Ca -0.02 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.53 1nly h LYS 12 Cb 0.33 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 1nly h LYS 12 CO 0.03 0.10 -1.13 0.35 -0.57 0.00 0.00 179.45 178.24 1nly h PHE 13 N 0.00 0.12 0.00 -1.35 3.57 0.15 -3.30 116.94 116.14 1nly h PHE 13 Ca -0.00 -0.09 -0.22 0.00 3.53 0.00 0.00 57.97 61.19 1nly h PHE 13 Cb 0.30 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 1nly h PHE 13 CO 0.00 1.07 -1.20 -0.07 -2.23 0.00 0.00 178.31 175.89 1nly h LEU 14 N 0.02 0.00 -0.47 0.59 3.38 0.02 -3.40 115.31 115.45 1nly h LEU 14 Ca -0.07 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.97 1nly h LEU 14 Cb 1.84 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.52 1nly h LEU 14 CO 0.14 0.89 -0.19 1.21 0.09 0.00 0.00 178.44 180.58 1nly n GLU 15 N -3.19 -0.12 -0.08 1.13 2.13 0.15 -0.68 120.64 119.98 1nly n GLU 15 Ca -0.06 0.73 -0.11 0.00 0.66 0.00 0.00 57.16 58.38 1nly n GLU 15 Cb 0.94 -1.08 -0.04 0.00 0.27 0.00 0.00 31.44 31.53 1nly n GLU 15 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1nly h VAL 16 N 0.00 1.20 -0.11 6.31 2.07 -1.80 -0.92 116.25 123.00 1nly h VAL 16 Ca 0.16 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 1nly h VAL 16 Cb 0.28 1.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1nly h VAL 16 CO -0.47 0.21 -0.06 -0.33 0.02 0.00 0.00 177.57 176.94 1nly h GLU 17 N 0.22 0.24 -0.23 1.57 4.39 -1.29 -2.84 114.58 116.63 1nly h GLU 17 Ca 0.08 -0.10 0.06 0.00 0.34 0.00 0.00 59.36 59.73 1nly h GLU 17 Cb 0.26 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.84 1nly h GLU 17 CO -0.00 0.59 -0.16 0.00 -1.16 0.00 0.00 179.01 178.28 1nly h ARG 18 N -0.12 -0.14 -0.23 2.33 3.08 -0.88 0.89 114.38 119.31 1nly h ARG 18 Ca 0.02 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.13 1nly h ARG 18 Cb 0.52 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.53 1nly h ARG 18 CO 0.02 -0.09 -0.46 0.00 -1.07 0.00 0.00 179.97 178.37 1nly h ALA 19 N 1.01 -0.61 0.17 0.04 0.00 -1.20 0.62 119.26 119.29 1nly h ALA 19 Ca 0.13 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1nly h ALA 19 Cb 0.34 0.89 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 1nly h ALA 19 CO -0.32 -0.95 -0.49 -0.07 0.00 0.00 0.00 179.25 177.42 1nly h LEU 20 N -0.45 -1.43 0.19 0.00 3.38 -1.19 -1.11 115.31 114.69 1nly h LEU 20 Ca 0.09 0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.22 1nly h LEU 20 Cb 0.62 0.53 -0.03 0.00 0.09 0.00 0.00 40.66 41.87 1nly h LEU 20 CO -0.47 -0.55 -0.28 0.11 0.09 0.00 0.00 178.44 177.34 1nly h LYS 21 N -0.75 -0.52 0.00 1.13 1.79 -0.49 -1.82 116.57 115.91 1nly h LYS 21 Ca -0.00 0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1nly h LYS 21 Cb 0.75 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.52 1nly h LYS 21 CO -0.24 -0.34 0.00 -1.91 -1.08 0.00 0.00 179.45 175.87 1nly n GLU 22 N -5.39 0.41 0.00 3.15 0.00 0.21 -1.01 120.64 118.01 1nly n GLU 22 Ca -0.08 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.17 1nly n GLU 22 Cb 0.30 -1.21 0.03 0.00 0.00 0.00 0.00 31.44 30.56 1nly n GLU 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1nly n ALA 23 N -0.71 2.98 0.00 4.31 0.00 -0.43 -3.68 120.51 122.98 1nly n ALA 23 Ca 0.04 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1nly n ALA 23 Cb 0.02 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1nly n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nly n ALA 24 N 0.32 1.51 0.04 0.00 0.00 -0.19 -4.69 120.51 117.50 1nly n ALA 24 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1nly n ALA 24 Cb 0.41 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.78 1nly n ALA 24 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1nly h LEU 25 N 0.00 0.00 -0.06 0.00 5.85 -1.25 -3.31 115.31 116.54 1nly h LEU 25 Ca 0.00 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1nly h LEU 25 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1nly h LEU 25 CO 0.00 0.57 -0.22 -1.13 -0.34 0.00 0.00 178.44 177.32 1nly h ASN 26 N 0.00 0.30 -0.91 1.25 -0.00 -1.81 -0.12 115.58 114.29 1nly h ASN 26 Ca -0.15 -0.62 0.10 0.00 -0.00 0.00 0.00 56.30 55.63 1nly h ASN 26 Cb 1.56 -0.09 -0.07 0.00 -0.00 0.00 0.00 38.32 39.73 1nly h ASN 26 CO 0.05 0.87 0.59 -0.65 -0.00 0.00 0.00 177.43 178.29 1nly h PRO 27 N -0.25 0.89 -0.16 6.67 0.11 -1.84 -1.14 132.00 136.28 1nly h PRO 27 Ca -0.01 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.90 1nly h PRO 27 Cb 0.85 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.75 1nly h PRO 27 CO 0.05 0.59 -0.54 1.25 -0.21 0.00 0.00 178.00 179.14 1nly h LEU 28 N 0.92 0.52 -0.46 2.35 5.85 -1.63 -2.61 115.31 120.26 1nly h LEU 28 Ca 0.42 -0.27 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1nly h LEU 28 Cb 0.40 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1nly h LEU 28 CO -0.19 0.96 0.12 0.03 -0.34 0.00 0.00 178.44 179.03 1nly h ARG 29 N 0.36 0.73 -0.41 1.25 3.08 0.21 0.15 114.38 119.75 1nly h ARG 29 Ca 0.01 -0.17 -0.13 0.00 0.07 0.00 0.00 59.98 59.76 1nly h ARG 29 Cb 1.06 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.00 1nly h ARG 29 CO 0.10 0.71 -0.24 0.45 -1.07 0.00 0.00 179.97 179.92 1nly h HIS 30 N 0.61 1.04 0.24 3.04 3.86 -1.38 0.23 115.15 122.78 1nly h HIS 30 Ca 0.15 -0.27 -0.01 0.00 -1.16 0.00 0.00 60.37 59.07 1nly h HIS 30 Cb 0.30 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.54 1nly h HIS 30 CO 0.02 1.07 -0.12 0.00 0.86 0.00 0.00 177.93 179.76 1nly h ALA 31 N 0.81 -0.32 0.00 2.45 0.00 -1.36 0.89 119.26 121.74 1nly h ALA 31 Ca 0.09 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1nly h ALA 31 Cb 0.81 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 1nly h ALA 31 CO 0.07 -0.62 -0.34 1.15 0.00 0.00 0.00 179.25 179.51 1nly h THR 32 N -0.45 0.00 -0.66 0.00 2.02 -0.90 0.10 112.91 113.01 1nly h THR 32 Ca -0.03 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.27 1nly h THR 32 Cb 0.34 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.63 1nly h THR 32 CO 0.05 0.00 -0.28 -0.08 0.37 0.00 0.00 175.52 175.59 1nly h GLU 33 N -0.44 -0.09 -0.66 6.66 4.57 -0.42 -0.85 114.58 123.35 1nly h GLU 33 Ca 0.01 0.01 0.09 0.00 -1.18 0.00 0.00 59.36 58.29 1nly h GLU 33 Cb 0.47 0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 29.00 1nly h GLU 33 CO -0.23 -0.06 0.29 1.49 -1.18 0.00 0.00 179.01 179.33 1nly h GLU 34 N -0.09 0.49 0.00 1.92 4.81 0.16 -1.84 114.58 120.03 1nly h GLU 34 Ca 0.28 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1nly h GLU 34 Cb 0.55 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1nly h GLU 34 CO -0.72 0.32 0.00 1.28 -0.73 0.00 0.00 179.01 179.16 1nly n LEU 35 N -4.93 0.92 -1.35 1.64 4.32 0.28 -4.60 117.00 113.27 1nly n LEU 35 Ca 0.10 0.11 -0.02 0.00 -0.02 0.00 0.00 56.01 56.19 1nly n LEU 35 Cb 0.28 -0.21 0.17 0.00 -1.62 0.00 0.00 43.42 42.03 1nly n LEU 35 CO 0.23 -0.21 0.68 0.49 -1.22 0.00 0.00 177.39 177.36 1nly n PHE 36 N -1.51 1.24 0.15 -1.77 3.01 -0.42 -4.45 117.46 113.71 1nly n PHE 36 Ca 0.00 -0.64 -0.14 0.00 1.01 0.00 0.00 57.45 57.69 1nly n PHE 36 Cb 0.00 -0.41 -0.06 0.00 -0.01 0.00 0.00 39.48 39.00 1nly n PHE 36 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1nly h GLY 37 N 3.84 -0.47 0.51 1.37 0.00 -1.00 -1.39 103.07 105.93 1nly h GLY 37 Ca 0.11 0.25 0.06 0.00 0.00 0.00 0.00 47.33 47.75 1nly h GLY 37 CO 0.36 -0.21 0.04 -0.55 0.00 0.00 0.00 176.54 176.18 1nly h ASP 38 N -0.47 -0.05 -0.66 0.19 3.32 -1.79 -2.85 116.42 114.12 1nly h ASP 38 Ca 0.00 0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 1nly h ASP 38 Cb 0.44 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 1nly h ASP 38 CO -0.06 0.01 0.11 -0.26 -1.72 0.00 0.00 179.24 177.32 1nly h PHE 39 N 0.15 1.16 0.00 4.55 -1.00 -1.85 -2.53 116.94 117.42 1nly h PHE 39 Ca 0.17 -0.16 -0.00 0.00 2.81 0.00 0.00 57.97 60.79 1nly h PHE 39 Cb 0.22 -0.32 -0.00 0.00 3.61 0.00 0.00 35.95 39.46 1nly h PHE 39 CO -0.21 0.98 -0.02 -0.07 -1.61 0.00 0.00 178.31 177.38 1nly h LEU 40 N 1.01 0.00 -7.04 1.54 3.38 -1.03 -3.45 115.31 109.72 1nly h LEU 40 Ca 0.20 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.58 1nly h LEU 40 Cb 0.44 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1nly h LEU 40 CO 0.01 0.02 2.16 0.29 0.09 0.00 0.00 178.44 181.01 1nly n LYS 41 N -4.18 2.19 -4.20 1.13 5.02 -0.96 -5.09 118.16 112.07 1nly n LYS 41 Ca -0.03 -2.48 -0.15 0.00 -2.02 0.00 0.00 58.31 53.63 1nly n LYS 41 Cb 0.10 -3.33 -0.11 0.00 -0.02 0.00 0.00 35.03 31.68 1nly n LYS 41 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1nly s GLU 43 N 4.80 0.90 -1.65 1.97 2.02 -1.26 -5.12 118.70 120.37 1nly s GLU 43 Ca 0.57 -1.20 -0.17 0.00 0.02 0.00 0.00 54.97 54.19 1nly s GLU 43 Cb 0.08 -0.61 0.13 0.00 0.10 0.00 0.00 34.13 33.83 1nly s GLU 43 CO 0.07 0.10 0.84 0.09 0.02 0.00 0.00 175.26 176.38 1nly n ASN 44 N 0.48 -3.68 -4.83 -0.19 3.02 -1.26 -4.92 115.26 103.88 1nly n ASN 44 Ca -0.15 -0.94 -0.22 0.00 -0.03 0.00 0.00 54.58 53.24 1nly n ASN 44 Cb 0.58 -3.11 -0.04 0.00 -0.61 0.00 0.00 39.78 36.59 1nly n ASN 44 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1nly s ILE 45 N -3.31 4.34 0.00 2.41 -4.36 -1.26 0.63 121.20 119.65 1nly s ILE 45 Ca 0.70 -1.40 0.00 0.00 -0.26 0.00 0.00 60.65 59.69 1nly s ILE 45 Cb -0.37 -3.38 0.00 0.00 1.25 0.00 0.00 42.46 39.96 1nly s ILE 45 CO 0.90 -0.33 0.00 1.07 0.24 0.00 0.00 174.94 176.82 1nly n THR 46 N -1.20 0.00 -3.51 8.37 5.66 0.15 -4.73 114.28 119.03 1nly n THR 46 Ca -0.07 -0.16 -0.16 0.00 -3.05 0.00 0.00 64.05 60.61 1nly n THR 46 Cb 0.58 0.64 -0.05 0.00 -1.55 0.00 0.00 70.33 69.95 1nly n THR 46 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1nly s GLU 47 N -1.08 1.06 -0.20 1.09 2.56 -1.21 -2.35 118.70 118.58 1nly s GLU 47 Ca 0.00 0.12 -0.02 0.00 0.00 0.00 0.00 54.97 55.07 1nly s GLU 47 Cb 0.00 0.50 0.06 0.00 2.00 0.00 0.00 34.13 36.69 1nly s GLU 47 CO 0.00 -0.36 0.00 0.42 -0.56 0.00 0.00 175.26 174.76 1nly s ILE 48 N -1.65 0.82 0.17 -3.70 1.01 0.20 -1.67 121.20 116.39 1nly s ILE 48 Ca -0.08 -0.71 0.08 0.00 0.00 0.00 0.00 60.65 59.94 1nly s ILE 48 Cb -0.00 -1.23 -0.04 0.00 0.01 0.00 0.00 42.46 41.20 1nly s ILE 48 CO 0.05 -0.14 -0.04 0.00 0.00 0.00 0.00 174.94 174.82 1nly s TYR 50 N -1.70 0.46 -0.40 0.00 5.04 0.16 -1.65 117.35 119.26 1nly s TYR 50 Ca 0.26 -0.05 0.05 0.00 -2.44 0.00 0.00 57.07 54.90 1nly s TYR 50 Cb -0.09 -0.60 0.53 0.00 0.35 0.00 0.00 41.96 42.15 1nly s TYR 50 CO 0.17 -0.22 1.65 0.09 -1.34 0.00 0.00 175.55 175.91 1nly n ASN 51 N 4.68 4.04 -4.32 4.32 5.03 -1.26 -1.07 115.26 126.68 1nly n ASN 51 Ca -0.15 -3.74 -0.38 0.00 0.87 0.00 0.00 54.58 51.17 1nly n ASN 51 Cb 0.50 -0.72 -0.05 0.00 -1.02 0.00 0.00 39.78 38.49 1nly n ASN 51 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1nly n GLY 52 N -1.05 -0.43 1.35 7.41 0.00 -1.15 -4.73 105.19 106.60 1nly n GLY 52 Ca 0.47 0.09 0.03 0.00 0.00 0.00 0.00 46.02 46.62 1nly n GLY 52 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1nly n ASN 53 N -2.49 1.38 -0.49 1.61 5.15 -1.26 -4.39 115.26 114.76 1nly n ASN 53 Ca 0.10 -2.62 -0.06 0.00 -0.60 0.00 0.00 54.58 51.40 1nly n ASN 53 Cb 0.47 -0.38 -0.03 0.00 -0.53 0.00 0.00 39.78 39.31 1nly n ASN 53 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1nly n LYS 54 N -0.09 -1.41 -4.59 1.20 4.76 -1.26 -4.99 118.16 111.78 1nly n LYS 54 Ca 0.11 0.66 -0.23 0.00 -2.87 0.00 0.00 58.31 55.98 1nly n LYS 54 Cb 0.99 -4.85 -0.16 0.00 -1.84 0.00 0.00 35.03 29.17 1nly n LYS 54 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1nly s VAL 55 N -1.75 1.09 -0.26 -0.18 1.01 -1.26 -1.71 120.40 117.33 1nly s VAL 55 Ca 0.00 -0.51 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 1nly s VAL 55 Cb 0.00 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 1nly s VAL 55 CO 0.00 0.33 0.10 -0.69 0.00 0.00 0.00 175.10 174.84 1nly s VAL 56 N 0.23 4.55 -0.21 2.92 1.01 0.75 -4.11 120.40 125.55 1nly s VAL 56 Ca -0.06 -0.10 -0.14 0.00 0.00 0.00 0.00 61.98 61.69 1nly s VAL 56 Cb -0.11 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1nly s VAL 56 CO 0.02 0.31 0.31 0.26 0.00 0.00 0.00 175.10 175.99 1nly s TRP 57 N 1.65 3.37 -0.09 5.22 0.52 -0.66 -0.27 118.94 128.69 1nly s TRP 57 Ca 0.06 0.49 0.04 0.00 0.02 0.00 0.00 56.10 56.72 1nly s TRP 57 Cb -0.15 -2.41 -0.01 0.00 -1.15 0.00 0.00 33.47 29.75 1nly s TRP 57 CO 0.05 0.06 -0.23 0.08 0.02 0.00 0.00 176.95 176.93 1nly s VAL 58 N 1.08 2.18 -0.24 4.03 1.01 -0.26 -0.19 120.40 128.01 1nly s VAL 58 Ca 0.15 -0.99 -0.12 0.00 0.00 0.00 0.00 61.98 61.02 1nly s VAL 58 Cb -0.14 -1.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 1nly s VAL 58 CO 0.06 0.56 0.22 -0.22 0.00 0.00 0.00 175.10 175.72 1nly s LEU 59 N 0.17 4.11 0.36 3.92 2.96 -0.67 -0.17 118.68 129.36 1nly s LEU 59 Ca -0.13 0.18 0.00 0.00 -0.22 0.00 0.00 54.13 53.96 1nly s LEU 59 Cb -0.16 -2.20 -0.03 0.00 0.50 0.00 0.00 46.19 44.29 1nly s LEU 59 CO 0.07 0.01 0.56 -0.54 -1.32 0.00 0.00 176.35 175.13 1nly s LYS 60 N 1.24 3.47 0.41 1.98 1.02 -0.26 0.34 119.74 127.94 1nly s LYS 60 Ca 0.10 -0.32 0.17 0.00 0.02 0.00 0.00 55.97 55.94 1nly s LYS 60 Cb -0.14 -2.65 1.08 0.00 -0.52 0.00 0.00 37.83 35.60 1nly s LYS 60 CO 0.06 0.12 1.83 -0.91 -0.92 0.00 0.00 175.35 175.53 1nly h ASN 61 N 0.72 0.43 0.00 2.83 2.35 -0.09 0.23 115.58 122.05 1nly h ASN 61 Ca -0.49 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 1nly h ASN 61 Cb 1.22 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.57 1nly h ASN 61 CO 0.61 0.15 0.00 -0.46 -1.65 0.00 0.00 177.43 176.08 1nly n ASN 62 N -4.54 0.13 -0.18 5.81 6.94 -1.26 -4.83 115.26 117.34 1nly n ASN 62 Ca 0.21 -1.56 -0.02 0.00 -0.02 0.00 0.00 54.58 53.19 1nly n ASN 62 Cb 0.74 -0.07 -0.01 0.00 -2.36 0.00 0.00 39.78 38.08 1nly n ASN 62 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1nly n GLY 63 N 0.25 0.55 3.79 4.83 0.00 0.81 -5.03 105.19 110.41 1nly n GLY 63 Ca 0.00 -0.35 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 1nly n GLY 63 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nly s GLU 64 N -1.35 3.89 -0.16 1.61 2.12 -1.24 -4.85 118.70 118.72 1nly s GLU 64 Ca 0.00 -0.12 -0.18 0.00 0.36 0.00 0.00 54.97 55.03 1nly s GLU 64 Cb 0.00 -3.32 -0.04 0.00 0.26 0.00 0.00 34.13 31.03 1nly s GLU 64 CO 0.00 0.50 0.49 -1.58 -0.54 0.00 0.00 175.26 174.13 1nly s TRP 65 N -0.24 3.43 -0.19 5.30 0.52 -1.26 -1.10 118.94 125.41 1nly s TRP 65 Ca 0.12 0.81 0.01 0.00 0.02 0.00 0.00 56.10 57.07 1nly s TRP 65 Cb -0.12 -2.60 0.02 0.00 -1.15 0.00 0.00 33.47 29.62 1nly s TRP 65 CO 0.02 0.03 -0.19 -1.14 0.02 0.00 0.00 176.95 175.69 1nly s GLN 66 N 1.16 2.90 0.19 4.98 0.74 0.76 -4.95 119.66 125.44 1nly s GLN 66 Ca 0.24 -0.89 -0.22 0.00 0.05 0.00 0.00 55.36 54.55 1nly s GLN 66 Cb -0.15 -2.61 -0.08 0.00 1.10 0.00 0.00 33.01 31.27 1nly s GLN 66 CO 0.10 -0.25 0.73 -1.25 -0.55 0.00 0.00 175.29 174.06 1nly s PRO 67 N 1.27 4.35 -0.04 1.67 0.04 -1.26 -1.10 135.00 139.93 1nly s PRO 67 Ca 0.03 0.96 0.02 0.00 0.04 0.00 0.00 61.00 62.04 1nly s PRO 67 Cb -0.14 -3.04 0.02 0.00 0.04 0.00 0.00 34.50 31.37 1nly s PRO 67 CO -0.12 0.48 -0.06 -0.06 0.04 0.00 0.00 177.00 177.27 1nly s PHE 68 N -1.36 0.86 0.05 0.56 0.40 0.63 -4.95 117.98 114.17 1nly s PHE 68 Ca 0.39 -0.24 -0.27 0.00 -0.60 0.00 0.00 56.93 56.20 1nly s PHE 68 Cb -0.19 -0.69 -0.05 0.00 0.51 0.00 0.00 43.02 42.60 1nly s PHE 68 CO 0.22 -0.17 0.87 0.34 0.70 0.00 0.00 175.22 177.18 1nly s ASP 69 N 0.66 7.32 -0.04 1.36 -1.08 -1.26 -0.18 116.67 123.46 1nly s ASP 69 Ca -0.10 1.59 0.10 0.00 -0.52 0.00 0.00 52.55 53.61 1nly s ASP 69 Cb -0.13 -2.52 0.17 0.00 -1.46 0.00 0.00 42.92 38.98 1nly s ASP 69 CO 0.01 -0.07 1.08 1.33 0.52 0.00 0.00 175.17 178.03 1nly n VAL 70 N 3.07 0.50 -0.34 1.11 0.24 -0.69 -4.86 118.33 117.35 1nly n VAL 70 Ca 0.01 -0.85 0.18 0.00 -2.04 0.00 0.00 64.34 61.64 1nly n VAL 70 Cb 0.50 0.42 0.40 0.00 -1.47 0.00 0.00 33.84 33.69 1nly n VAL 70 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1nly h ARG 71 N 0.28 0.56 -2.48 7.34 2.43 -1.92 -2.85 114.38 117.73 1nly h ARG 71 Ca -0.05 -0.03 -0.71 0.00 -0.81 0.00 0.00 59.98 58.38 1nly h ARG 71 Cb 1.40 -0.13 -0.34 0.00 -0.42 0.00 0.00 29.97 30.48 1nly h ARG 71 CO 0.02 0.37 0.19 -0.25 -1.51 0.00 0.00 179.97 178.79 1nly n ASP 72 N -4.81 5.48 -3.77 -3.80 8.00 -1.26 -4.96 116.55 111.43 1nly n ASP 72 Ca 0.26 -3.51 -0.13 0.00 0.71 0.00 0.00 54.79 52.12 1nly n ASP 72 Cb 0.74 -0.96 -0.12 0.00 -0.02 0.00 0.00 41.12 40.76 1nly n ASP 72 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1nly s ARG 73 N -3.07 0.27 0.16 -1.24 0.52 -1.08 -5.05 118.95 109.46 1nly s ARG 73 Ca 0.38 0.42 -0.06 0.00 -0.52 0.00 0.00 55.73 55.95 1nly s ARG 73 Cb 0.14 0.06 0.03 0.00 0.52 0.00 0.00 34.95 35.69 1nly s ARG 73 CO -0.01 -0.08 1.44 -0.22 0.02 0.00 0.00 175.30 176.46 1nly h LYS 74 N 6.24 0.61 0.00 3.54 1.63 -1.93 -3.09 116.57 123.58 1nly h LYS 74 Ca -0.31 -0.43 0.00 0.00 -0.85 0.00 0.00 60.65 59.06 1nly h LYS 74 Cb 1.18 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.88 1nly h LYS 74 CO 0.36 1.05 0.09 0.00 -3.45 0.00 0.00 179.45 177.50 1nly n ALA 75 N -2.54 0.82 -2.46 5.00 0.00 -1.26 -1.82 120.51 118.25 1nly n ALA 75 Ca -0.04 0.01 -0.28 0.00 0.00 0.00 0.00 53.44 53.12 1nly n ALA 75 Cb 0.65 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.28 1nly n ALA 75 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1nly n PHE 76 N -1.45 3.42 -4.20 0.00 3.01 -1.17 -4.27 117.46 112.80 1nly n PHE 76 Ca -0.00 -3.10 -0.36 0.00 1.01 0.00 0.00 57.45 55.00 1nly n PHE 76 Cb 0.10 -0.21 -0.08 0.00 -0.01 0.00 0.00 39.48 39.27 1nly n PHE 76 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1nly s SER 77 N -3.30 5.63 0.35 4.37 0.01 -0.76 -4.93 113.70 115.07 1nly s SER 77 Ca 0.48 0.25 0.14 0.00 1.31 0.00 0.00 55.95 58.14 1nly s SER 77 Cb 0.39 -1.68 1.14 0.00 0.21 0.00 0.00 66.02 66.09 1nly s SER 77 CO -0.21 0.39 1.59 -0.07 0.41 0.00 0.00 173.24 175.35 1nly h LEU 78 N 5.09 0.10 0.28 2.44 3.38 -1.95 0.31 115.31 124.96 1nly h LEU 78 Ca -0.52 0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1nly h LEU 78 Cb 1.20 0.32 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1nly h LEU 78 CO 0.56 -0.38 -0.13 0.77 0.09 0.00 0.00 178.44 179.34 1nly h SER 79 N 0.04 -0.32 -0.91 -0.43 4.64 -1.95 -3.15 113.55 111.47 1nly h SER 79 Ca 0.76 -0.22 0.21 0.00 -0.47 0.00 0.00 61.79 62.07 1nly h SER 79 Cb 1.87 0.08 -0.07 0.00 -0.31 0.00 0.00 62.40 63.97 1nly h SER 79 CO -0.79 0.12 0.60 0.03 -0.87 0.00 0.00 176.83 175.92 1nly h ARG 80 N -0.85 0.40 -0.87 4.77 2.47 -1.37 0.08 114.38 119.01 1nly h ARG 80 Ca -0.04 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1nly h ARG 80 Cb 0.51 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.74 1nly h ARG 80 CO 0.06 0.26 0.00 1.28 0.56 0.00 0.00 179.97 182.14 1nly n LEU 81 N -4.52 1.06 0.00 3.04 4.77 0.93 -2.92 117.00 119.35 1nly n LEU 81 Ca 0.20 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 1nly n LEU 81 Cb 0.70 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1nly n LEU 81 CO 0.30 0.21 0.00 1.57 -1.33 0.00 0.00 177.39 178.15 1nly n HIS 83 N 0.34 0.00 -0.08 -1.77 -0.00 0.02 -0.67 115.22 113.06 1nly n HIS 83 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.61 1nly n HIS 83 Cb 0.21 0.00 0.03 0.00 -0.00 0.00 0.00 29.99 30.23 1nly n HIS 83 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.34 176.69 1nly h PHE 84 N 0.00 0.95 0.38 1.57 3.57 -1.79 -1.78 116.94 119.85 1nly h PHE 84 Ca 0.00 -0.28 -0.01 0.00 3.53 0.00 0.00 57.97 61.20 1nly h PHE 84 Cb 0.00 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.53 1nly h PHE 84 CO 0.00 1.06 -0.23 0.00 -2.23 0.00 0.00 178.31 176.91 1nly h ALA 85 N 0.90 -0.58 -0.97 2.41 0.00 -1.19 -1.82 119.26 118.01 1nly h ALA 85 Ca 0.05 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 54.95 1nly h ALA 85 Cb 0.95 0.28 -0.07 0.00 0.00 0.00 0.00 17.79 18.95 1nly h ALA 85 CO 0.09 -0.84 0.62 0.00 0.00 0.00 0.00 179.25 179.12 1nly h ARG 86 N -0.58 0.98 -0.38 0.00 3.08 -1.82 0.12 114.38 115.77 1nly h ARG 86 Ca -0.04 -0.06 0.04 0.00 0.07 0.00 0.00 59.98 59.98 1nly h ARG 86 Cb 0.48 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1nly h ARG 86 CO 0.05 0.65 0.26 0.00 -1.07 0.00 0.00 179.97 179.85 1nly h ALA 89 N 0.50 -0.96 -1.02 0.00 0.00 -0.53 -2.88 119.26 114.36 1nly h ALA 89 Ca -0.02 -0.04 0.32 0.00 0.00 0.00 0.00 54.91 55.17 1nly h ALA 89 Cb 1.07 0.16 -0.14 0.00 0.00 0.00 0.00 17.79 18.87 1nly h ALA 89 CO 0.09 -0.96 0.59 0.66 0.00 0.00 0.00 179.25 179.64 1nly h SER 90 N -0.17 0.51 -0.09 0.00 4.64 -0.91 -0.22 113.55 117.32 1nly h SER 90 Ca -0.02 0.18 0.04 0.00 -0.47 0.00 0.00 61.79 61.53 1nly h SER 90 Cb 0.13 0.12 -0.05 0.00 -0.31 0.00 0.00 62.40 62.29 1nly h SER 90 CO 0.02 -0.11 -0.25 0.15 -0.87 0.00 0.00 176.83 175.77 1nly h PHE 91 N 0.33 -0.66 -0.27 4.77 3.57 -1.21 0.73 116.94 124.20 1nly h PHE 91 Ca 0.73 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 62.25 1nly h PHE 91 Cb 1.69 0.31 -0.01 0.00 2.79 0.00 0.00 35.95 40.73 1nly h PHE 91 CO -0.01 -0.33 0.01 1.63 -2.23 0.00 0.00 178.31 177.38 1nly n LYS 92 N -5.37 2.75 -3.51 1.11 4.76 -0.48 -4.90 118.16 112.52 1nly n LYS 92 Ca -0.03 -1.44 -0.22 0.00 -2.87 0.00 0.00 58.31 53.74 1nly n LYS 92 Cb 0.28 -1.84 0.04 0.00 -1.84 0.00 0.00 35.03 31.67 1nly n LYS 92 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1nly n LYS 93 N 0.27 -1.45 -4.21 1.97 5.02 0.25 -5.02 118.16 114.99 1nly n LYS 93 Ca 0.13 0.74 -0.15 0.00 -2.02 0.00 0.00 58.31 57.02 1nly n LYS 93 Cb 0.70 -4.50 -0.08 0.00 -0.02 0.00 0.00 35.03 31.12 1nly n LYS 93 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1nly s LYS 94 N -5.06 1.52 0.07 1.97 1.02 -0.22 -4.95 119.74 114.10 1nly s LYS 94 Ca 0.34 -1.78 0.08 0.00 0.02 0.00 0.00 55.97 54.62 1nly s LYS 94 Cb -0.10 0.32 -0.03 0.00 -0.52 0.00 0.00 37.83 37.50 1nly s LYS 94 CO 0.82 -0.55 -0.21 -0.08 -0.92 0.00 0.00 175.35 174.41 1nly s THR 95 N -3.75 1.74 -0.07 2.17 -1.32 -1.26 -2.52 115.64 110.63 1nly s THR 95 Ca 0.38 -1.39 -0.01 0.00 -1.21 0.00 0.00 61.69 59.46 1nly s THR 95 Cb 0.04 -1.54 0.03 0.00 -1.51 0.00 0.00 72.50 69.51 1nly s THR 95 CO 0.19 0.09 -0.00 -0.51 -2.21 0.00 0.00 174.62 172.18 1nly s ILE 96 N -0.97 0.38 0.17 5.08 2.07 -1.26 -4.82 121.20 121.86 1nly s ILE 96 Ca 0.08 0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.43 1nly s ILE 96 Cb -0.09 -0.53 -0.00 0.00 0.13 0.00 0.00 42.46 41.96 1nly s ILE 96 CO 0.03 0.26 0.21 -0.90 -1.91 0.00 0.00 174.94 172.63 1nly n ASP 97 N 5.08 -0.59 -1.81 4.50 5.75 0.17 -4.89 116.55 124.76 1nly n ASP 97 Ca -0.08 -1.98 -0.00 0.00 -0.01 0.00 0.00 54.79 52.71 1nly n ASP 97 Cb 0.50 1.14 0.31 0.00 -1.03 0.00 0.00 41.12 42.05 1nly n ASP 97 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1nly n ASN 98 N -2.01 4.85 0.00 -1.12 4.13 -1.26 -2.41 115.26 117.42 1nly n ASN 98 Ca 0.01 -2.96 0.00 0.00 1.68 0.00 0.00 54.58 53.32 1nly n ASN 98 Cb 0.29 -0.70 0.00 0.00 -1.54 0.00 0.00 39.78 37.84 1nly n ASN 98 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1nly n TYR 99 N 0.21 0.00 0.10 3.10 4.02 -1.26 -4.30 117.16 119.03 1nly n TYR 99 Ca 0.31 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 58.17 1nly n TYR 99 Cb 1.19 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 40.50 1nly n TYR 99 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1nly h GLU 100 N 0.00 0.00 -2.26 -0.72 4.39 -2.00 -3.38 114.58 110.62 1nly h GLU 100 Ca 0.00 0.00 -0.61 0.00 0.34 0.00 0.00 59.36 59.09 1nly h GLU 100 Cb 0.00 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 28.24 1nly h GLU 100 CO 0.00 0.79 -0.50 0.09 -1.16 0.00 0.00 179.01 178.23 1nly n ASN 101 N -3.41 4.21 0.07 1.42 3.02 -1.26 -4.84 115.26 114.46 1nly n ASN 101 Ca 0.00 -3.52 -0.13 0.00 -0.03 0.00 0.00 54.58 50.90 1nly n ASN 101 Cb 0.81 -0.68 -0.13 0.00 -0.61 0.00 0.00 39.78 39.17 1nly n ASN 101 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1nly h PRO 102 N 3.88 0.16 -6.23 3.52 0.13 -1.66 0.48 132.00 132.28 1nly h PRO 102 Ca 0.19 -0.28 -0.57 0.00 -0.87 0.00 0.00 66.00 64.47 1nly h PRO 102 Cb 0.60 0.10 -0.04 0.00 0.13 0.00 0.00 31.00 31.80 1nly h PRO 102 CO 0.87 1.06 -0.18 0.42 -0.23 0.00 0.00 178.00 179.94 1nly s ILE 103 N -2.66 5.00 0.01 -3.56 1.01 -1.26 -1.62 121.20 118.13 1nly s ILE 103 Ca -0.04 0.53 -0.07 0.00 0.00 0.00 0.00 60.65 61.07 1nly s ILE 103 Cb 0.08 -3.67 -0.00 0.00 0.01 0.00 0.00 42.46 38.88 1nly s ILE 103 CO 0.85 0.19 0.13 -0.22 0.00 0.00 0.00 174.94 175.89 1nly s LEU 104 N -2.14 1.60 -0.06 2.97 2.96 0.88 -4.95 118.68 119.93 1nly s LEU 104 Ca 0.37 -0.25 -0.02 0.00 -0.22 0.00 0.00 54.13 54.02 1nly s LEU 104 Cb -0.14 0.65 0.04 0.00 0.50 0.00 0.00 46.19 47.24 1nly s LEU 104 CO 0.19 -0.38 0.11 -0.44 -1.32 0.00 0.00 176.35 174.51 1nly s SER 105 N -1.45 0.45 0.00 3.68 0.01 -1.26 -1.77 113.70 113.37 1nly s SER 105 Ca -0.14 0.21 0.00 0.00 1.31 0.00 0.00 55.95 57.33 1nly s SER 105 Cb -0.07 0.09 0.00 0.00 0.21 0.00 0.00 66.02 66.25 1nly s SER 105 CO 0.01 -0.20 0.00 -0.24 0.41 0.00 0.00 173.24 173.22 1nly n SER 106 N 4.78 0.00 -4.12 2.44 2.88 -0.50 -5.00 113.62 114.10 1nly n SER 106 Ca -0.15 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.28 1nly n SER 106 Cb 0.50 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.88 1nly n SER 106 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1nly s ASN 107 N 1.93 0.12 0.49 -3.46 -0.87 -1.26 -0.72 114.94 111.17 1nly s ASN 107 Ca 0.00 -1.19 0.04 0.00 -1.57 0.00 0.00 52.86 50.14 1nly s ASN 107 Cb 0.00 0.41 0.02 0.00 -0.02 0.00 0.00 41.25 41.66 1nly s ASN 107 CO 0.00 -0.88 0.68 -0.76 -2.57 0.00 0.00 177.10 173.57 1nly s LEU 108 N -3.08 3.45 0.38 0.60 1.43 -0.67 -4.86 118.68 115.92 1nly s LEU 108 Ca 0.30 -0.20 0.20 0.00 -1.03 0.00 0.00 54.13 53.40 1nly s LEU 108 Cb 0.05 -2.77 1.21 0.00 0.03 0.00 0.00 46.19 44.71 1nly s LEU 108 CO 0.08 -0.97 1.66 0.00 0.23 0.00 0.00 176.35 177.34 1nly h ALA 109 N 0.33 2.22 -0.01 4.21 0.00 -1.91 -0.34 119.26 123.76 1nly h ALA 109 Ca -0.41 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1nly h ALA 109 Cb 1.29 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1nly h ALA 109 CO 0.49 -0.83 -0.30 0.09 0.00 0.00 0.00 179.25 178.69 1nly n ASN 110 N -4.92 1.66 0.00 0.00 3.02 -1.26 -4.99 115.26 108.78 1nly n ASN 110 Ca 0.33 -1.31 0.00 0.00 -0.03 0.00 0.00 54.58 53.57 1nly n ASN 110 Cb 1.12 0.26 0.00 0.00 -0.61 0.00 0.00 39.78 40.55 1nly n ASN 110 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nly n GLY 111 N 1.36 1.18 3.75 7.41 0.00 -0.14 -4.95 105.19 113.80 1nly n GLY 111 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1nly n GLY 111 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1nly s GLU 112 N -0.21 4.39 0.34 1.61 1.03 -1.26 -4.67 118.70 119.92 1nly s GLU 112 Ca 0.00 2.10 -0.29 0.00 0.03 0.00 0.00 54.97 56.82 1nly s GLU 112 Cb 0.00 -3.15 -0.10 0.00 -0.80 0.00 0.00 34.13 30.07 1nly s GLU 112 CO 0.00 -0.22 1.35 1.03 -1.33 0.00 0.00 175.26 176.09 1nly s ARG 113 N -0.66 4.30 -0.05 -4.83 0.52 -1.24 -1.67 118.95 115.32 1nly s ARG 113 Ca 0.54 2.30 0.02 0.00 -0.52 0.00 0.00 55.73 58.07 1nly s ARG 113 Cb -0.38 -3.05 0.01 0.00 0.52 0.00 0.00 34.95 32.05 1nly s ARG 113 CO 0.43 -0.27 -0.11 0.08 0.02 0.00 0.00 175.30 175.44 1nly s VAL 114 N -1.09 1.03 -0.26 3.52 1.01 0.10 -2.15 120.40 122.56 1nly s VAL 114 Ca 0.50 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 62.04 1nly s VAL 114 Cb -0.41 -0.94 0.05 0.00 0.00 0.00 0.00 36.38 35.08 1nly s VAL 114 CO 0.55 0.32 -0.08 -1.58 0.00 0.00 0.00 175.10 174.31 1nly s GLN 115 N 0.50 2.47 -0.11 2.72 2.00 -0.67 -1.41 119.66 125.16 1nly s GLN 115 Ca -0.10 -1.21 0.01 0.00 -2.00 0.00 0.00 55.36 52.06 1nly s GLN 115 Cb -0.14 -2.95 -0.02 0.00 0.80 0.00 0.00 33.01 30.71 1nly s GLN 115 CO 0.02 -0.52 -0.15 0.42 -0.50 0.00 0.00 175.29 174.57 1nly s ILE 116 N 1.20 2.93 -0.04 -2.34 1.01 -0.73 -0.59 121.20 122.64 1nly s ILE 116 Ca -0.05 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.92 1nly s ILE 116 Cb -0.19 -2.21 -0.00 0.00 0.01 0.00 0.00 42.46 40.08 1nly s ILE 116 CO -0.05 0.54 -0.15 -0.69 0.00 0.00 0.00 174.94 174.59 1nly s VAL 117 N 0.17 1.29 0.40 2.92 1.01 0.99 -0.09 120.40 127.10 1nly s VAL 117 Ca -0.08 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.30 1nly s VAL 117 Cb -0.15 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 1nly s VAL 117 CO 0.05 0.38 0.06 -0.76 0.00 0.00 0.00 175.10 174.83 1nly s LEU 118 N 0.09 2.23 0.56 3.92 1.43 -0.64 -1.80 118.68 124.48 1nly s LEU 118 Ca -0.04 -1.53 -0.18 0.00 -1.03 0.00 0.00 54.13 51.34 1nly s LEU 118 Cb -0.11 -0.43 -0.05 0.00 0.03 0.00 0.00 46.19 45.63 1nly s LEU 118 CO 0.02 -0.74 1.09 -0.55 0.23 0.00 0.00 176.35 176.40 1nly s SER 119 N -3.64 5.78 0.00 2.29 0.15 -1.26 -1.00 113.70 116.02 1nly s SER 119 Ca 0.26 2.02 0.22 0.00 0.70 0.00 0.00 55.95 59.15 1nly s SER 119 Cb 0.05 -2.56 1.28 0.00 -1.71 0.00 0.00 66.02 63.08 1nly s SER 119 CO 0.13 -1.17 1.70 -0.81 1.20 0.00 0.00 173.24 174.28 1nly n PRO 120 N -1.54 0.62 0.08 5.44 -0.04 -1.26 -4.44 135.00 133.87 1nly n PRO 120 Ca 0.10 0.02 -0.06 0.00 -0.04 0.00 0.00 63.50 63.52 1nly n PRO 120 Cb 0.52 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.55 1nly n PRO 120 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1nly h VAL 121 N 0.00 1.43 -4.08 0.52 2.07 -1.45 -3.44 116.25 111.30 1nly h VAL 121 Ca 0.00 -2.22 -0.50 0.00 0.82 0.00 0.00 66.70 64.80 1nly h VAL 121 Cb 0.04 2.17 0.05 0.00 -1.52 0.00 0.00 31.29 32.04 1nly h VAL 121 CO 0.00 0.65 0.31 0.42 0.02 0.00 0.00 177.57 178.97 1nly s THR 122 N -3.55 4.56 0.35 2.57 -4.23 -0.92 -4.96 115.64 109.45 1nly s THR 122 Ca -0.04 0.57 0.13 0.00 -1.18 0.00 0.00 61.69 61.17 1nly s THR 122 Cb 0.11 -3.80 0.34 0.00 1.34 0.00 0.00 72.50 70.50 1nly s THR 122 CO 0.81 -0.95 1.73 1.62 -0.54 0.00 0.00 174.62 177.29 1nly h VAL 123 N -0.18 0.49 -3.73 2.29 3.04 -1.89 -3.43 116.25 112.85 1nly h VAL 123 Ca -0.45 -0.17 -0.26 0.00 -1.01 0.00 0.00 66.70 64.82 1nly h VAL 123 Cb 1.21 -0.04 -0.06 0.00 -2.01 0.00 0.00 31.29 30.38 1nly h VAL 123 CO 0.62 0.09 -0.18 -0.46 -1.01 0.00 0.00 177.57 176.63 1nly n ASN 124 N -4.83 -0.93 -0.08 3.17 0.23 -1.26 -5.04 115.26 106.52 1nly n ASN 124 Ca 0.27 -2.53 0.07 0.00 -0.53 0.00 0.00 54.58 51.86 1nly n ASN 124 Cb 0.83 1.81 0.39 0.00 -2.08 0.00 0.00 39.78 40.73 1nly n ASN 124 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1nly n ASP 125 N -1.80 0.23 -0.19 0.53 5.68 -1.26 -3.03 116.55 116.70 1nly n ASP 125 Ca 0.02 -1.60 0.02 0.00 -0.50 0.00 0.00 54.79 52.73 1nly n ASP 125 Cb 0.46 -0.02 0.03 0.00 -1.14 0.00 0.00 41.12 40.45 1nly n ASP 125 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1nly n GLU 126 N -0.57 0.44 -3.68 0.11 1.02 -1.26 -4.95 120.64 111.76 1nly n GLU 126 Ca 0.11 -1.00 -0.38 0.00 -0.02 0.00 0.00 57.16 55.87 1nly n GLU 126 Cb 0.08 -1.09 -0.12 0.00 -0.02 0.00 0.00 31.44 30.30 1nly n GLU 126 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1nly s THR 127 N -0.52 4.66 -0.29 2.62 2.01 -1.17 -4.80 115.64 118.15 1nly s THR 127 Ca 0.06 -0.18 0.02 0.00 0.31 0.00 0.00 61.69 61.90 1nly s THR 127 Cb 0.04 -3.26 0.08 0.00 0.01 0.00 0.00 72.50 69.37 1nly s THR 127 CO 0.06 0.22 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.57 1nly s ILE 128 N 1.65 1.86 -0.24 1.82 1.01 -1.26 -4.27 121.20 121.77 1nly s ILE 128 Ca 0.06 -1.77 -0.21 0.00 0.00 0.00 0.00 60.65 58.73 1nly s ILE 128 Cb -0.16 -2.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.07 1nly s ILE 128 CO 0.06 -0.36 0.67 -0.55 0.00 0.00 0.00 174.94 174.76 1nly s SER 129 N 1.18 6.65 -0.01 3.58 0.15 -0.74 -2.91 113.70 121.59 1nly s SER 129 Ca 0.02 0.80 0.07 0.00 0.70 0.00 0.00 55.95 57.54 1nly s SER 129 Cb -0.19 -2.36 -0.02 0.00 -1.71 0.00 0.00 66.02 61.74 1nly s SER 129 CO -0.09 -0.37 -0.23 -0.63 1.20 0.00 0.00 173.24 173.12 1nly s ILE 130 N 2.41 1.82 -0.25 6.45 1.01 -0.23 -0.01 121.20 132.40 1nly s ILE 130 Ca 0.28 -1.01 -0.04 0.00 0.00 0.00 0.00 60.65 59.89 1nly s ILE 130 Cb -0.16 -1.52 0.08 0.00 0.01 0.00 0.00 42.46 40.88 1nly s ILE 130 CO 0.09 0.49 0.10 -0.44 0.00 0.00 0.00 174.94 175.18 1nly s SER 131 N -0.60 3.20 -0.17 3.58 0.01 0.24 0.39 113.70 120.35 1nly s SER 131 Ca 0.09 -1.09 -0.07 0.00 1.31 0.00 0.00 55.95 56.19 1nly s SER 131 Cb -0.09 -0.45 -0.04 0.00 0.21 0.00 0.00 66.02 65.65 1nly s SER 131 CO -0.01 -0.39 0.08 -0.63 0.41 0.00 0.00 173.24 172.71 1nly s ILE 132 N 1.99 4.98 -0.29 1.44 1.01 0.18 -1.66 121.20 128.85 1nly s ILE 132 Ca 0.06 0.03 -0.07 0.00 0.00 0.00 0.00 60.65 60.66 1nly s ILE 132 Cb -0.16 -3.23 -0.00 0.00 0.01 0.00 0.00 42.46 39.07 1nly s ILE 132 CO -0.23 0.49 0.09 -0.60 0.00 0.00 0.00 174.94 174.69 1nly s ARG 133 N 0.08 3.23 -0.30 2.79 3.52 -0.91 0.62 118.95 127.98 1nly s ARG 133 Ca 0.06 -0.77 -0.29 0.00 -0.13 0.00 0.00 55.73 54.61 1nly s ARG 133 Cb -0.12 -3.40 0.02 0.00 -1.56 0.00 0.00 34.95 29.89 1nly s ARG 133 CO 0.00 -0.39 1.06 0.42 -0.81 0.00 0.00 175.30 175.58 1nly s ILE 134 N 1.54 4.55 1.25 4.11 -1.09 -0.99 -3.71 121.20 126.85 1nly s ILE 134 Ca 0.04 1.80 -0.21 0.00 -2.23 0.00 0.00 60.65 60.04 1nly s ILE 134 Cb -0.17 -4.39 0.32 0.00 -1.58 0.00 0.00 42.46 36.64 1nly s ILE 134 CO 0.03 -0.41 0.91 -0.81 -1.23 0.00 0.00 174.94 173.43 1nly n PRO 135 N 6.74 -3.82 -2.54 2.79 -0.04 -1.26 -4.81 135.00 132.06 1nly n PRO 135 Ca 0.12 -1.49 -0.41 0.00 -0.04 0.00 0.00 63.50 61.68 1nly n PRO 135 Cb 0.47 -1.63 -0.03 0.00 -0.04 0.00 0.00 33.50 32.27 1nly n PRO 135 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1nly s SER 136 N -3.64 6.22 -0.47 3.54 0.15 -1.26 -4.88 113.70 113.36 1nly s SER 136 Ca 0.64 -0.69 0.03 0.00 0.70 0.00 0.00 55.95 56.64 1nly s SER 136 Cb -0.09 -2.56 0.55 0.00 -1.71 0.00 0.00 66.02 62.22 1nly s SER 136 CO 0.51 -1.77 1.80 2.29 1.20 0.00 0.00 173.24 177.27 1nly n LYS 137 N 9.25 2.40 -3.65 5.44 2.85 -1.26 -4.81 118.16 128.37 1nly n LYS 137 Ca 0.11 -3.23 -0.11 0.00 -1.05 0.00 0.00 58.31 54.03 1nly n LYS 137 Cb 0.50 -2.15 -0.05 0.00 -0.65 0.00 0.00 35.03 32.68 1nly n LYS 137 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1nly s THR 138 N -3.85 0.07 -0.19 0.58 2.01 -1.26 -5.15 115.64 107.85 1nly s THR 138 Ca 0.56 -0.56 -0.02 0.00 0.31 0.00 0.00 61.69 61.98 1nly s THR 138 Cb 0.47 -1.09 0.06 0.00 0.01 0.00 0.00 72.50 71.94 1nly s THR 138 CO 0.04 -0.31 0.02 -0.89 -0.69 0.00 0.00 174.62 172.80 1nly s THR 139 N -3.30 0.64 -0.12 -0.82 2.01 -1.26 -4.99 115.64 107.79 1nly s THR 139 Ca -0.00 -0.59 -0.07 0.00 0.31 0.00 0.00 61.69 61.35 1nly s THR 139 Cb 0.01 -1.09 -0.04 0.00 0.01 0.00 0.00 72.50 71.39 1nly s THR 139 CO -0.08 -0.16 0.12 -0.31 -0.69 0.00 0.00 174.62 173.50 1nly s TYR 140 N 1.81 3.53 0.93 4.92 1.51 -1.26 -5.08 117.35 123.72 1nly s TYR 140 Ca -0.01 0.47 -0.11 0.00 -1.01 0.00 0.00 57.07 56.41 1nly s TYR 140 Cb -0.17 -1.94 0.15 0.00 -0.11 0.00 0.00 41.96 39.89 1nly s TYR 140 CO -0.08 0.66 1.11 -1.25 -1.11 0.00 0.00 175.55 174.88 1nly s PRO 141 N -0.87 0.89 0.11 -1.71 0.04 -1.26 -4.47 135.00 127.73 1nly s PRO 141 Ca 0.14 1.23 -0.21 0.00 0.04 0.00 0.00 61.00 62.21 1nly s PRO 141 Cb -0.12 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.61 1nly s PRO 141 CO 0.03 -2.61 1.74 1.25 0.04 0.00 0.00 177.00 177.45 1nly h HIS 142 N -1.84 0.03 -1.03 0.56 -0.00 -1.96 -1.61 115.15 109.30 1nly h HIS 142 Ca -0.48 0.01 0.36 0.00 -0.00 0.00 0.00 60.37 60.26 1nly h HIS 142 Cb 1.28 0.01 -0.16 0.00 -0.00 0.00 0.00 27.41 28.54 1nly h HIS 142 CO 0.46 0.01 0.59 0.66 -0.00 0.00 0.00 177.93 179.64 1nly h SER 143 N 0.07 0.43 -0.80 3.26 4.64 -1.95 1.14 113.55 120.34 1nly h SER 143 Ca 0.06 0.21 0.03 0.00 -0.47 0.00 0.00 61.79 61.61 1nly h SER 143 Cb 0.05 0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.27 1nly h SER 143 CO -0.08 -0.23 0.53 0.15 -0.87 0.00 0.00 176.83 176.32 1nly h PHE 144 N 0.20 0.96 -0.39 4.77 3.57 -1.63 0.04 116.94 124.47 1nly h PHE 144 Ca 0.78 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 62.20 1nly h PHE 144 Cb 1.94 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 40.34 1nly h PHE 144 CO -0.01 0.57 -0.16 0.74 -2.23 0.00 0.00 178.31 177.22 1nly h PHE 145 N 1.00 0.90 -0.60 0.41 -1.00 0.14 -2.22 116.94 115.57 1nly h PHE 145 Ca 0.31 -0.22 -0.03 0.00 2.81 0.00 0.00 57.97 60.85 1nly h PHE 145 Cb 0.02 -0.21 -0.03 0.00 3.61 0.00 0.00 35.95 39.34 1nly h PHE 145 CO -0.00 0.96 0.26 0.93 -1.61 0.00 0.00 178.31 178.84 1nly h GLU 146 N 0.59 0.88 -0.25 1.51 5.08 -0.88 -1.29 114.58 120.22 1nly h GLU 146 Ca 0.09 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1nly h GLU 146 Cb 0.70 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 1nly h GLU 146 CO 0.05 0.74 0.13 0.93 -1.00 0.00 0.00 179.01 179.86 1nly h GLU 147 N 0.82 0.26 0.00 2.33 5.08 -0.96 -0.68 114.58 121.44 1nly h GLU 147 Ca 0.20 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1nly h GLU 147 Cb 0.17 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1nly h GLU 147 CO -0.02 0.17 0.00 1.04 -1.00 0.00 0.00 179.01 179.20 1nly n GLN 148 N -4.97 0.62 -3.04 2.33 1.13 -0.84 -4.87 117.38 107.73 1nly n GLN 148 Ca -0.02 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.96 1nly n GLN 148 Cb 0.06 -1.18 0.04 0.00 0.11 0.00 0.00 30.24 29.27 1nly n GLN 148 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1nly n GLY 149 N 0.16 -1.06 0.09 1.08 0.00 -0.26 -4.95 105.19 100.24 1nly n GLY 149 Ca 0.05 0.48 -0.13 0.00 0.00 0.00 0.00 46.02 46.42 1nly n GLY 149 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1nly h PHE 150 N -0.47 0.33 -0.53 1.61 3.57 -1.40 -3.27 116.94 116.78 1nly h PHE 150 Ca -0.35 -0.24 -0.13 0.00 3.53 0.00 0.00 57.97 60.77 1nly h PHE 150 Cb 1.18 -0.01 -0.08 0.00 2.79 0.00 0.00 35.95 39.83 1nly h PHE 150 CO 0.24 1.20 0.12 0.66 -2.23 0.00 0.00 178.31 178.31 1nly n TYR 151 N -3.45 1.78 0.14 0.41 4.02 -1.26 -1.29 117.16 117.51 1nly n TYR 151 Ca -0.07 -1.14 0.01 0.00 -0.01 0.00 0.00 57.90 56.68 1nly n TYR 151 Cb 1.00 -0.54 0.16 0.00 -0.02 0.00 0.00 39.34 39.95 1nly n TYR 151 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1nly h ASN 152 N 2.24 0.00 1.16 7.72 4.21 -1.85 -3.13 115.58 125.92 1nly h ASN 152 Ca 0.16 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.67 1nly h ASN 152 Cb 1.95 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 39.15 1nly h ASN 152 CO 0.52 0.58 -0.04 0.18 -1.29 0.00 0.00 177.43 177.39 1nly n LEU 153 N -3.55 0.34 -4.83 1.61 4.77 -1.26 -4.83 117.00 109.25 1nly n LEU 153 Ca -0.00 0.50 -0.34 0.00 -0.03 0.00 0.00 56.01 56.14 1nly n LEU 153 Cb 0.65 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 41.26 1nly n LEU 153 CO 0.41 -0.07 0.50 -0.76 -1.33 0.00 0.00 177.39 176.15 1nly s LEU 154 N -3.61 4.11 0.01 2.23 1.43 -1.18 -4.95 118.68 116.72 1nly s LEU 154 Ca 0.12 1.47 0.16 0.00 -1.03 0.00 0.00 54.13 54.86 1nly s LEU 154 Cb 0.16 -4.10 -0.17 0.00 0.03 0.00 0.00 46.19 42.11 1nly s LEU 154 CO 0.57 -0.19 0.72 -0.90 0.23 0.00 0.00 176.35 176.77 1nly n ASP 155 N -0.14 0.77 -2.84 2.29 3.85 -1.26 -3.88 116.55 115.33 1nly n ASP 155 Ca 0.03 0.35 -0.34 0.00 -0.71 0.00 0.00 54.79 54.11 1nly n ASP 155 Cb 0.53 0.24 -0.01 0.00 -1.35 0.00 0.00 41.12 40.52 1nly n ASP 155 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 1nly n ASN 156 N -2.89 7.10 0.08 -1.12 2.04 -1.26 -4.77 115.26 114.44 1nly n ASN 156 Ca -0.13 -3.49 -0.12 0.00 -0.44 0.00 0.00 54.58 50.40 1nly n ASN 156 Cb 0.90 -1.18 -0.05 0.00 -2.53 0.00 0.00 39.78 36.93 1nly n ASN 156 CO 0.00 0.00 0.00 0.50 -0.44 0.00 0.00 177.26 177.32 1nly h LYS 157 N 3.24 -0.40 -0.13 -3.83 3.64 -1.83 0.19 116.57 117.45 1nly h LYS 157 Ca 0.50 0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.71 1nly h LYS 157 Cb 0.38 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1nly h LYS 157 CO 1.17 -0.27 -0.73 0.93 -2.27 0.00 0.00 179.45 178.29 1nly h GLU 158 N -0.42 0.62 -0.73 1.90 5.08 -1.93 -2.03 114.58 117.07 1nly h GLU 158 Ca 0.05 -0.49 0.03 0.00 -1.00 0.00 0.00 59.36 57.94 1nly h GLU 158 Cb 0.48 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 1nly h GLU 158 CO -0.19 1.11 0.48 0.37 -1.00 0.00 0.00 179.01 179.79 1nly h GLN 159 N 0.43 0.89 0.04 2.33 4.15 -1.90 -0.73 115.11 120.32 1nly h GLN 159 Ca -0.04 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.33 1nly h GLN 159 Cb 1.33 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.82 1nly h GLN 159 CO 0.14 0.59 -0.02 0.00 -1.93 0.00 0.00 178.83 177.61 1nly h ALA 160 N 1.56 -0.06 -0.03 3.38 0.00 -0.49 -0.12 119.26 123.51 1nly h ALA 160 Ca 0.29 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1nly h ALA 160 Cb 0.01 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1nly h ALA 160 CO -0.08 -0.20 0.02 0.82 0.00 0.00 0.00 179.25 179.81 1nly h ILE 161 N -0.72 1.00 0.01 0.00 2.04 -1.20 -1.58 117.51 117.06 1nly h ILE 161 Ca -0.01 -0.01 -0.27 0.00 1.00 0.00 0.00 64.86 65.57 1nly h ILE 161 Cb 0.62 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 1nly h ILE 161 CO 0.01 0.00 -1.52 0.28 0.00 0.00 0.00 178.15 176.92 1nly h SER 162 N 0.02 0.04 0.42 1.72 0.02 -1.15 -3.17 113.55 111.45 1nly h SER 162 Ca 0.01 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1nly h SER 162 Cb 0.03 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1nly h SER 162 CO -0.00 1.06 -0.20 0.00 -1.14 0.00 0.00 176.83 176.55 1nly h ALA 163 N 0.93 -0.57 -0.04 3.77 0.00 -0.36 0.22 119.26 123.22 1nly h ALA 163 Ca -0.21 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.59 1nly h ALA 163 Cb 1.95 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 19.91 1nly h ALA 163 CO 0.10 -0.78 -0.26 0.97 0.00 0.00 0.00 179.25 179.28 1nly h ILE 164 N -0.65 0.40 0.42 0.00 6.09 -1.47 1.45 117.51 123.75 1nly h ILE 164 Ca -0.06 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.42 1nly h ILE 164 Cb 0.48 0.40 -0.02 0.00 0.47 0.00 0.00 36.82 38.15 1nly h ILE 164 CO 0.10 0.00 -0.38 0.11 -3.07 0.00 0.00 178.15 174.91 1nly h LYS 165 N -0.38 -0.78 -0.05 2.19 1.57 -1.49 -2.11 116.57 115.53 1nly h LYS 165 Ca 0.07 0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1nly h LYS 165 Cb 0.48 0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.97 1nly h LYS 165 CO -0.25 -0.52 -0.01 -0.44 -0.57 0.00 0.00 179.45 177.66 1nly h ASP 166 N -0.80 0.09 -0.16 0.86 5.19 -0.37 -2.83 116.42 118.39 1nly h ASP 166 Ca -0.04 -0.34 0.04 0.00 -0.62 0.00 0.00 57.03 56.07 1nly h ASP 166 Cb 0.71 -0.02 -0.07 0.00 0.18 0.00 0.00 39.33 40.12 1nly h ASP 166 CO -0.04 0.41 -0.49 1.23 -3.12 0.00 0.00 179.24 177.23 1nly h GLY 167 N -0.23 -0.88 1.12 2.75 0.00 0.20 -0.91 103.07 105.11 1nly h GLY 167 Ca 0.01 0.61 0.08 0.00 0.00 0.00 0.00 47.33 48.03 1nly h GLY 167 CO 0.00 -0.21 0.39 -2.22 0.00 0.00 0.00 176.54 174.51 1nly h ILE 168 N -0.52 0.94 0.00 2.60 2.04 -1.46 0.12 117.51 121.22 1nly h ILE 168 Ca 0.06 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 1nly h ILE 168 Cb 0.65 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1nly h ILE 168 CO -0.44 0.09 -0.13 0.00 0.00 0.00 0.00 178.15 177.66 1nly h ALA 169 N 1.69 1.21 -0.00 1.87 0.00 -0.93 -1.93 119.26 121.18 1nly h ALA 169 Ca 0.26 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1nly h ALA 169 Cb 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1nly h ALA 169 CO -0.07 0.17 -0.77 -0.89 0.00 0.00 0.00 179.25 177.68 1nly n ILE 170 N -3.55 0.00 -1.51 0.00 2.08 0.34 -4.71 119.36 112.01 1nly n ILE 170 Ca -0.01 -0.02 0.00 0.00 0.56 0.00 0.00 62.75 63.27 1nly n ILE 170 Cb 0.27 0.74 0.00 0.00 -0.75 0.00 0.00 39.64 39.90 1nly n ILE 170 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1nly n GLY 171 N 1.49 0.58 3.89 7.39 0.00 -0.73 -4.89 105.19 112.93 1nly n GLY 171 Ca 0.05 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.41 1nly n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nly s LYS 172 N -2.80 3.32 -0.21 1.61 1.02 -1.12 -3.24 119.74 118.32 1nly s LYS 172 Ca 0.00 0.37 -0.22 0.00 0.02 0.00 0.00 55.97 56.13 1nly s LYS 172 Cb 0.00 -2.21 -0.02 0.00 -0.52 0.00 0.00 37.83 35.09 1nly s LYS 172 CO 0.00 -0.56 0.71 -0.80 -0.92 0.00 0.00 175.35 173.78 1nly s ASN 173 N -4.21 6.75 -0.03 2.83 0.01 -1.26 -3.46 114.94 115.57 1nly s ASN 173 Ca 0.53 0.92 0.04 0.00 -0.71 0.00 0.00 52.86 53.64 1nly s ASN 173 Cb -0.11 -2.39 -0.00 0.00 0.41 0.00 0.00 41.25 39.16 1nly s ASN 173 CO 0.49 -0.36 -0.14 0.54 -1.51 0.00 0.00 177.10 176.12 1nly s VAL 174 N 2.24 1.14 -0.06 1.60 0.11 0.24 -1.65 120.40 124.01 1nly s VAL 174 Ca 0.32 -0.57 0.06 0.00 -2.93 0.00 0.00 61.98 58.85 1nly s VAL 174 Cb -0.16 -0.98 -0.01 0.00 -1.53 0.00 0.00 36.38 33.70 1nly s VAL 174 CO 0.10 0.33 -0.25 -0.63 -3.33 0.00 0.00 175.10 171.33 1nly s ILE 175 N -0.03 2.09 -0.25 7.04 1.01 -1.26 -1.56 121.20 128.25 1nly s ILE 175 Ca -0.01 -1.05 -0.03 0.00 0.00 0.00 0.00 60.65 59.56 1nly s ILE 175 Cb -0.09 -1.76 0.01 0.00 0.01 0.00 0.00 42.46 40.64 1nly s ILE 175 CO 0.01 0.57 -0.03 -0.69 0.00 0.00 0.00 174.94 174.79 1nly s VAL 176 N -0.12 3.19 0.35 2.92 1.01 -0.17 -0.92 120.40 126.67 1nly s VAL 176 Ca -0.05 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.16 1nly s VAL 176 Cb -0.14 -2.57 -0.06 0.00 0.00 0.00 0.00 36.38 33.61 1nly s VAL 176 CO 0.04 0.25 0.05 0.00 0.00 0.00 0.00 175.10 175.44 1nly n GLY 178 N -0.78 -0.36 3.86 0.00 0.00 -0.50 -1.89 105.19 105.53 1nly n GLY 178 Ca -0.04 -1.60 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 1nly n GLY 178 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nly s GLY 179 N 0.00 1.64 0.23 -0.02 0.00 -1.26 -3.49 107.32 104.42 1nly s GLY 179 Ca 0.00 -0.81 -0.32 0.00 0.00 0.00 0.00 44.72 43.59 1nly s GLY 179 CO 0.00 -0.19 1.68 2.41 0.00 0.00 0.00 173.10 177.01 1nly n THR 180 N -3.68 0.29 -1.07 0.90 -1.04 -1.26 -1.67 114.28 106.75 1nly n THR 180 Ca 0.10 -0.07 -0.03 0.00 -2.04 0.00 0.00 64.05 62.01 1nly n THR 180 Cb 0.60 -1.97 -0.01 0.00 -1.82 0.00 0.00 70.33 67.13 1nly n THR 180 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nly n GLY 181 N 3.43 0.46 0.00 3.41 0.00 -1.26 -4.86 105.19 106.38 1nly n GLY 181 Ca 0.14 -0.11 0.06 0.00 0.00 0.00 0.00 46.02 46.10 1nly n GLY 181 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1nly n SER 182 N -0.38 0.00 0.00 1.61 3.41 -0.67 -4.84 113.62 112.75 1nly n SER 182 Ca -0.03 0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.88 1nly n SER 182 Cb 0.29 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 1nly n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nly n GLY 183 N -0.30 1.01 0.18 5.00 0.00 -1.26 -4.41 105.19 105.41 1nly n GLY 183 Ca 0.04 -0.26 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 1nly n GLY 183 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nly h LYS 184 N 0.00 -0.35 -0.82 1.61 1.57 -1.90 -0.94 116.57 115.73 1nly h LYS 184 Ca 0.00 0.02 0.17 0.00 -1.87 0.00 0.00 60.65 58.97 1nly h LYS 184 Cb 0.05 0.08 -0.11 0.00 0.08 0.00 0.00 32.23 32.34 1nly h LYS 184 CO 0.00 -0.00 0.35 1.15 -0.57 0.00 0.00 179.45 180.38 1nly h THR 185 N -0.81 0.60 0.18 -0.16 2.02 -1.94 -0.63 112.91 112.17 1nly h THR 185 Ca -0.04 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 66.98 1nly h THR 185 Cb 0.51 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1nly h THR 185 CO 0.06 0.08 -0.09 0.74 0.37 0.00 0.00 175.52 176.69 1nly h THR 186 N 0.46 0.89 -0.08 3.16 2.02 -1.94 -2.77 112.91 114.64 1nly h THR 186 Ca 0.48 -0.30 0.04 0.00 0.77 0.00 0.00 66.41 67.39 1nly h THR 186 Cb 0.79 1.07 -0.04 0.00 -1.74 0.00 0.00 68.15 68.23 1nly h THR 186 CO -0.45 0.07 -0.16 0.22 0.37 0.00 0.00 175.52 175.58 1nly h TYR 187 N -0.39 -0.40 -0.61 3.16 3.20 0.21 -2.04 116.97 120.11 1nly h TYR 187 Ca -0.02 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.87 1nly h TYR 187 Cb 0.30 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.73 1nly h TYR 187 CO -0.02 -0.23 0.40 -0.84 -1.64 0.00 0.00 178.16 175.83 1nly h ILE 188 N -0.22 1.15 -0.46 1.81 3.07 -1.22 -2.31 117.51 119.33 1nly h ILE 188 Ca 0.08 -0.28 -0.00 0.00 1.55 0.00 0.00 64.86 66.21 1nly h ILE 188 Cb 0.33 0.27 -0.02 0.00 -0.27 0.00 0.00 36.82 37.12 1nly h ILE 188 CO -0.21 0.15 0.27 0.11 -1.05 0.00 0.00 178.15 177.42 1nly h LYS 189 N 0.81 0.62 0.22 0.16 1.57 -1.08 -2.94 116.57 115.93 1nly h LYS 189 Ca 0.22 -0.05 -0.29 0.00 -1.87 0.00 0.00 60.65 58.66 1nly h LYS 189 Cb -0.08 -0.13 0.03 0.00 0.08 0.00 0.00 32.23 32.13 1nly h LYS 189 CO -0.05 0.44 -1.28 0.66 -0.57 0.00 0.00 179.45 178.66 1nly h SER 190 N 0.63 0.73 0.00 0.86 4.64 -1.08 -3.41 113.55 115.92 1nly h SER 190 Ca 0.17 -0.93 -0.59 0.00 -0.47 0.00 0.00 61.79 59.97 1nly h SER 190 Cb -0.01 -0.24 0.05 0.00 -0.31 0.00 0.00 62.40 61.89 1nly h SER 190 CO -0.03 1.62 2.20 2.30 -0.87 0.00 0.00 176.83 182.05 1nly n ILE 191 N -3.85 1.65 0.00 0.95 -5.35 -0.98 -4.30 119.36 107.48 1nly n ILE 191 Ca -0.16 -1.34 0.00 0.00 -0.27 0.00 0.00 62.75 60.98 1nly n ILE 191 Cb 1.02 -2.23 0.00 0.00 -1.74 0.00 0.00 39.64 36.68 1nly n ILE 191 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1nly n GLU 193 N 6.65 0.00 -0.67 6.28 1.02 -1.26 -4.54 120.64 128.11 1nly n GLU 193 Ca 0.47 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.54 1nly n GLU 193 Cb 0.35 -1.84 0.17 0.00 -0.02 0.00 0.00 31.44 30.10 1nly n GLU 193 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1nly n PHE 194 N -0.10 1.65 -3.86 -0.32 3.01 -1.26 -4.82 117.46 111.77 1nly n PHE 194 Ca 0.00 -0.97 -0.36 0.00 1.01 0.00 0.00 57.45 57.13 1nly n PHE 194 Cb 0.00 -0.55 -0.13 0.00 -0.01 0.00 0.00 39.48 38.79 1nly n PHE 194 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1nly s ILE 195 N -2.05 3.57 -0.22 4.37 1.01 -1.26 -2.94 121.20 123.67 1nly s ILE 195 Ca 0.34 -0.60 -0.40 0.00 0.00 0.00 0.00 60.65 59.99 1nly s ILE 195 Cb 0.28 -2.72 -0.19 0.00 0.01 0.00 0.00 42.46 39.84 1nly s ILE 195 CO 0.08 0.28 1.23 -2.65 0.00 0.00 0.00 174.94 173.88 1nly n PRO 196 N 4.81 0.00 0.00 2.79 -0.02 -1.26 -4.71 135.00 136.61 1nly n PRO 196 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 1nly n PRO 196 Cb 0.49 -1.40 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 1nly n PRO 196 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1nly n LYS 197 N 2.50 0.00 0.01 -0.52 2.85 -1.26 -1.16 118.16 120.58 1nly n LYS 197 Ca 0.24 0.35 0.12 0.00 -1.05 0.00 0.00 58.31 57.97 1nly n LYS 197 Cb 0.01 -1.62 0.32 0.00 -0.65 0.00 0.00 35.03 33.09 1nly n LYS 197 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1nly n GLU 198 N -1.34 0.02 -2.39 -1.58 4.71 -1.26 -4.41 120.64 114.39 1nly n GLU 198 Ca 0.00 0.01 -0.42 0.00 -0.01 0.00 0.00 57.16 56.74 1nly n GLU 198 Cb 0.12 -1.52 -0.03 0.00 -1.01 0.00 0.00 31.44 29.00 1nly n GLU 198 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1nly s GLU 199 N -3.01 4.45 -0.17 3.49 0.41 -0.31 -4.97 118.70 118.60 1nly s GLU 199 Ca 0.11 1.83 -0.26 0.00 -0.41 0.00 0.00 54.97 56.24 1nly s GLU 199 Cb 0.17 -3.30 -0.01 0.00 -1.78 0.00 0.00 34.13 29.22 1nly s GLU 199 CO 0.67 -0.20 0.89 0.50 -0.49 0.00 0.00 175.26 176.62 1nly s ARG 200 N 0.56 4.31 -0.08 1.61 3.52 -1.26 -4.67 118.95 122.94 1nly s ARG 200 Ca 0.57 1.12 0.02 0.00 -0.13 0.00 0.00 55.73 57.31 1nly s ARG 200 Cb -0.31 -3.58 -0.02 0.00 -1.56 0.00 0.00 34.95 29.48 1nly s ARG 200 CO 0.32 -0.36 -0.14 0.42 -0.81 0.00 0.00 175.30 174.73 1nly s ILE 201 N 2.26 3.07 -0.07 4.11 1.01 -1.01 0.49 121.20 131.06 1nly s ILE 201 Ca 0.41 -0.70 0.03 0.00 0.00 0.00 0.00 60.65 60.39 1nly s ILE 201 Cb -0.17 -2.23 0.00 0.00 0.01 0.00 0.00 42.46 40.08 1nly s ILE 201 CO 0.13 0.57 -0.17 -0.63 0.00 0.00 0.00 174.94 174.84 1nly s ILE 202 N -0.39 1.49 0.00 2.92 1.01 -0.55 -1.25 121.20 124.44 1nly s ILE 202 Ca 0.04 -0.70 0.07 0.00 0.00 0.00 0.00 60.65 60.06 1nly s ILE 202 Cb -0.12 -1.31 -0.03 0.00 0.01 0.00 0.00 42.46 41.01 1nly s ILE 202 CO 0.02 0.43 -0.21 -0.94 0.00 0.00 0.00 174.94 174.24 1nly s SER 203 N 0.40 3.49 -0.31 3.58 1.04 -0.94 -0.58 113.70 120.38 1nly s SER 203 Ca -0.13 -0.42 -0.01 0.00 0.48 0.00 0.00 55.95 55.87 1nly s SER 203 Cb -0.15 -0.52 0.06 0.00 0.10 0.00 0.00 66.02 65.51 1nly s SER 203 CO 0.05 0.30 0.01 -0.63 0.98 0.00 0.00 173.24 173.94 1nly s ILE 204 N -0.76 2.88 0.39 -1.02 1.01 0.05 0.31 121.20 124.06 1nly s ILE 204 Ca 0.12 -1.54 0.06 0.00 0.00 0.00 0.00 60.65 59.29 1nly s ILE 204 Cb -0.10 -2.72 -0.07 0.00 0.01 0.00 0.00 42.46 39.58 1nly s ILE 204 CO 0.02 -0.18 0.03 -1.61 0.00 0.00 0.00 174.94 173.19 1nly s GLU 205 N 1.20 1.88 -0.13 2.79 2.02 0.78 0.72 118.70 127.97 1nly s GLU 205 Ca -0.03 -2.06 0.07 0.00 0.02 0.00 0.00 54.97 52.96 1nly s GLU 205 Cb -0.20 -1.39 -0.13 0.00 0.10 0.00 0.00 34.13 32.52 1nly s GLU 205 CO -0.02 -0.11 -0.02 -3.47 0.02 0.00 0.00 175.26 171.66 1nly n ASP 206 N -0.90 2.38 -3.77 -0.19 2.03 -1.26 -2.18 116.55 112.65 1nly n ASP 206 Ca -0.05 -0.03 -0.15 0.00 0.52 0.00 0.00 54.79 55.09 1nly n ASP 206 Cb 0.67 0.45 -0.16 0.00 -0.72 0.00 0.00 41.12 41.36 1nly n ASP 206 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1nly s THR 207 N -2.28 -0.06 -0.11 5.18 2.01 -1.26 -4.78 115.64 114.34 1nly s THR 207 Ca -0.10 0.20 -0.34 0.00 0.31 0.00 0.00 61.69 61.76 1nly s THR 207 Cb 0.04 -0.10 -0.11 0.00 0.01 0.00 0.00 72.50 72.33 1nly s THR 207 CO 0.43 0.08 1.93 1.21 -0.69 0.00 0.00 174.62 177.58 1nly n GLU 208 N 4.14 2.12 0.00 4.92 2.13 -1.26 -4.62 120.64 128.06 1nly n GLU 208 Ca -0.27 0.76 0.00 0.00 0.66 0.00 0.00 57.16 58.31 1nly n GLU 208 Cb 0.51 -2.68 0.00 0.00 0.27 0.00 0.00 31.44 29.53 1nly n GLU 208 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1nly n GLU 209 N 6.95 0.00 -2.27 5.31 1.02 -1.26 -4.90 120.64 125.49 1nly n GLU 209 Ca 0.24 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 57.00 1nly n GLU 209 Cb 0.30 -0.46 -0.02 0.00 -0.02 0.00 0.00 31.44 31.25 1nly n GLU 209 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1nly s ILE 210 N -1.00 3.09 -0.01 -3.67 1.01 -1.26 -4.87 121.20 114.48 1nly s ILE 210 Ca 0.00 0.93 0.05 0.00 0.00 0.00 0.00 60.65 61.63 1nly s ILE 210 Cb 0.00 -3.53 -0.01 0.00 0.01 0.00 0.00 42.46 38.92 1nly s ILE 210 CO 0.00 0.10 -0.16 -0.69 0.00 0.00 0.00 174.94 174.19 1nly s VAL 211 N -1.37 1.29 -0.55 2.92 1.01 -1.26 -5.10 120.40 117.34 1nly s VAL 211 Ca 0.56 -0.73 -0.10 0.00 0.00 0.00 0.00 61.98 61.71 1nly s VAL 211 Cb -0.32 -1.08 0.14 0.00 0.00 0.00 0.00 36.38 35.12 1nly s VAL 211 CO 0.40 0.33 0.43 -0.36 0.00 0.00 0.00 175.10 175.91 1nly s PHE 212 N -0.43 3.45 -0.17 5.22 0.40 -1.26 -4.87 117.98 120.33 1nly s PHE 212 Ca 0.06 -1.95 0.22 0.00 -0.60 0.00 0.00 56.93 54.66 1nly s PHE 212 Cb -0.06 -3.53 -0.10 0.00 0.51 0.00 0.00 43.02 39.83 1nly s PHE 212 CO -0.00 -0.98 0.87 1.63 0.70 0.00 0.00 175.22 177.44 1nly n LYS 213 N 4.62 0.62 -0.21 0.44 5.02 -1.26 -4.35 118.16 123.04 1nly n LYS 213 Ca -0.03 0.05 0.07 0.00 -2.02 0.00 0.00 58.31 56.38 1nly n LYS 213 Cb 0.41 -1.74 0.11 0.00 -0.02 0.00 0.00 35.03 33.78 1nly n LYS 213 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1nly n HIS 214 N -2.59 0.00 -3.64 2.13 8.25 -1.26 -5.00 115.22 113.11 1nly n HIS 214 Ca -0.02 -0.76 -0.25 0.00 -0.26 0.00 0.00 57.72 56.42 1nly n HIS 214 Cb 0.59 -0.13 -0.17 0.00 1.12 0.00 0.00 29.99 31.40 1nly n HIS 214 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1nly s HIS 215 N -2.13 0.32 0.02 4.41 3.76 -1.26 -4.48 115.29 115.92 1nly s HIS 215 Ca 0.24 -0.32 -0.19 0.00 -0.15 0.00 0.00 55.06 54.65 1nly s HIS 215 Cb 0.21 -0.72 -0.25 0.00 1.11 0.00 0.00 32.58 32.93 1nly s HIS 215 CO 0.02 -0.48 1.09 0.87 -0.85 0.00 0.00 174.74 175.39 1nly h LYS 216 N 8.39 0.47 -5.72 1.40 1.57 -1.91 -3.42 116.57 117.35 1nly h LYS 216 Ca -0.15 -0.55 -0.63 0.00 -1.87 0.00 0.00 60.65 57.46 1nly h LYS 216 Cb 1.14 0.16 -0.13 0.00 0.08 0.00 0.00 32.23 33.48 1nly h LYS 216 CO 0.28 1.19 0.40 1.21 -0.57 0.00 0.00 179.45 181.96 1nly s ASN 217 N -6.94 6.36 0.23 0.86 2.47 -1.26 -4.97 114.94 111.70 1nly s ASN 217 Ca -0.12 -0.29 -0.19 0.00 0.42 0.00 0.00 52.86 52.68 1nly s ASN 217 Cb 0.04 -2.39 0.07 0.00 -1.45 0.00 0.00 41.25 37.51 1nly s ASN 217 CO 0.85 -1.03 0.93 0.00 -3.72 0.00 0.00 177.10 174.13 1nly n TYR 218 N 6.95 -1.59 -3.64 0.43 0.18 -1.26 -2.41 117.16 115.81 1nly n TYR 218 Ca 0.01 -1.37 -0.07 0.00 1.88 0.00 0.00 57.90 58.35 1nly n TYR 218 Cb 0.48 0.68 -0.07 0.00 -0.38 0.00 0.00 39.34 40.04 1nly n TYR 218 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 1nly s THR 219 N -2.09 0.00 -0.08 -3.48 2.01 -0.38 -4.93 115.64 106.69 1nly s THR 219 Ca 0.20 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.17 1nly s THR 219 Cb -0.03 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.44 1nly s THR 219 CO 0.07 0.00 0.06 -1.10 -0.69 0.00 0.00 174.62 172.96 1nly s GLN 220 N 0.92 3.14 -0.03 4.92 -0.21 -1.26 -2.21 119.66 124.92 1nly s GLN 220 Ca -0.04 -0.33 0.07 0.00 0.02 0.00 0.00 55.36 55.08 1nly s GLN 220 Cb -0.04 -2.93 -0.02 0.00 1.00 0.00 0.00 33.01 31.02 1nly s GLN 220 CO -0.11 0.72 -0.24 -0.51 -2.12 0.00 0.00 175.29 173.03 1nly s LEU 221 N -1.06 2.04 -0.05 2.90 1.43 0.15 -4.94 118.68 119.16 1nly s LEU 221 Ca 0.15 -0.45 0.03 0.00 -1.03 0.00 0.00 54.13 52.84 1nly s LEU 221 Cb -0.12 -1.25 0.00 0.00 0.03 0.00 0.00 46.19 44.86 1nly s LEU 221 CO 0.05 0.27 -0.14 -0.36 0.23 0.00 0.00 176.35 176.40 1nly s PHE 222 N -0.44 1.47 0.22 0.29 0.40 -1.26 -0.15 117.98 118.51 1nly s PHE 222 Ca 0.06 -0.46 0.07 0.00 -0.60 0.00 0.00 56.93 56.00 1nly s PHE 222 Cb -0.10 -1.03 -0.04 0.00 0.51 0.00 0.00 43.02 42.36 1nly s PHE 222 CO 0.00 -0.19 0.12 -0.59 0.70 0.00 0.00 175.22 175.26 1nly s PHE 223 N 0.29 3.01 0.00 0.36 -0.71 -0.93 -4.98 117.98 115.02 1nly s PHE 223 Ca -0.08 -0.11 0.00 0.00 -1.04 0.00 0.00 56.93 55.71 1nly s PHE 223 Cb -0.12 -1.40 0.00 0.00 -1.21 0.00 0.00 43.02 40.29 1nly s PHE 223 CO 0.02 0.54 0.00 0.41 -1.34 0.00 0.00 175.22 174.85 1nly n GLY 224 N -0.73 3.41 4.45 1.99 0.00 0.69 -4.73 105.19 110.28 1nly n GLY 224 Ca -0.08 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1nly n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nly n GLY 225 N 0.00 1.04 0.25 -0.02 0.00 -1.26 -3.75 105.19 101.45 1nly n GLY 225 Ca 0.00 -0.85 -0.07 0.00 0.00 0.00 0.00 46.02 45.09 1nly n GLY 225 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1nly h ASN 226 N 0.00 0.74 -3.27 1.61 -0.00 -1.99 -3.42 115.58 109.25 1nly h ASN 226 Ca 0.00 -0.13 -0.56 0.00 -0.00 0.00 0.00 56.30 55.61 1nly h ASN 226 Cb 0.00 -0.19 -0.04 0.00 -0.00 0.00 0.00 38.32 38.09 1nly h ASN 226 CO 0.00 0.67 0.53 -0.63 -0.00 0.00 0.00 177.43 178.00 1nly s ILE 227 N -5.69 4.80 0.29 2.57 -1.09 -1.25 -5.04 121.20 115.79 1nly s ILE 227 Ca -0.13 2.01 0.04 0.00 -2.23 0.00 0.00 60.65 60.35 1nly s ILE 227 Cb 0.12 -4.30 -0.02 0.00 -1.58 0.00 0.00 42.46 36.68 1nly s ILE 227 CO 0.78 0.02 0.44 0.42 -1.23 0.00 0.00 174.94 175.37 1nly s THR 228 N 1.93 4.90 0.25 2.92 -4.23 -1.26 -0.22 115.64 119.93 1nly s THR 228 Ca 0.48 -0.86 -0.04 0.00 -1.18 0.00 0.00 61.69 60.09 1nly s THR 228 Cb -0.18 -3.74 0.21 0.00 1.34 0.00 0.00 72.50 70.13 1nly s THR 228 CO 0.18 -0.34 1.80 -1.28 -0.54 0.00 0.00 174.62 174.44 1nly h SER 229 N 0.98 0.61 -0.45 3.99 0.87 -1.96 0.12 113.55 117.72 1nly h SER 229 Ca -0.50 0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.07 1nly h SER 229 Cb 1.23 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 63.12 1nly h SER 229 CO 0.59 0.33 0.11 0.00 -0.53 0.00 0.00 176.83 177.33 1nly h ALA 230 N 1.47 1.23 -0.62 6.23 0.00 -1.95 -1.94 119.26 123.69 1nly h ALA 230 Ca 0.40 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1nly h ALA 230 Cb 0.42 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1nly h ALA 230 CO -0.27 0.53 0.41 -0.44 0.00 0.00 0.00 179.25 179.47 1nly h ASP 231 N 0.76 0.72 0.10 0.00 3.32 -1.17 0.23 116.42 120.38 1nly h ASP 231 Ca 0.17 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1nly h ASP 231 Cb 0.30 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1nly h ASP 231 CO 0.00 0.53 -0.05 0.00 -1.72 0.00 0.00 179.24 178.00 1nly h LEU 233 N -0.36 0.59 -0.52 0.00 5.85 -1.04 0.71 115.31 120.54 1nly h LEU 233 Ca -0.01 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.56 1nly h LEU 233 Cb 0.30 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1nly h LEU 233 CO 0.02 0.40 -0.35 0.50 -0.34 0.00 0.00 178.44 178.67 1nly h LYS 234 N 0.68 0.82 -0.23 1.25 3.64 -0.37 -1.74 116.57 120.63 1nly h LYS 234 Ca 0.25 -0.41 -0.19 0.00 -1.27 0.00 0.00 60.65 59.03 1nly h LYS 234 Cb 0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1nly h LYS 234 CO -0.07 1.04 -0.61 1.03 -2.27 0.00 0.00 179.45 178.57 1nly h SER 235 N 0.68 0.88 -0.36 4.20 0.87 0.03 -3.11 113.55 116.75 1nly h SER 235 Ca 0.06 -0.50 0.08 0.00 -1.23 0.00 0.00 61.79 60.20 1nly h SER 235 Cb 0.91 -0.26 -0.08 0.00 -0.44 0.00 0.00 62.40 62.53 1nly h SER 235 CO 0.08 1.29 -0.24 0.00 -0.53 0.00 0.00 176.83 177.43 1nly n LEU 237 N -5.39 0.00 -2.94 0.00 4.77 -0.68 -3.95 117.00 108.81 1nly n LEU 237 Ca 0.01 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.70 1nly n LEU 237 Cb 0.30 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 1nly n LEU 237 CO 0.11 0.00 0.32 0.54 -1.33 0.00 0.00 177.39 177.03 1nly n ARG 238 N -0.91 3.49 -2.87 3.23 1.74 1.00 -4.94 116.66 117.40 1nly n ARG 238 Ca 0.03 -4.76 -0.12 0.00 -0.77 0.00 0.00 57.85 52.23 1nly n ARG 238 Cb 0.01 -2.27 0.05 0.00 -1.02 0.00 0.00 32.46 29.24 1nly n ARG 238 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1nly n ARG 240 N -0.27 1.01 -2.96 5.56 3.00 -1.25 -5.09 116.66 116.65 1nly n ARG 240 Ca 0.34 -2.39 -0.35 0.00 -0.00 0.00 0.00 57.85 55.45 1nly n ARG 240 Cb 0.42 -1.22 -0.06 0.00 0.00 0.00 0.00 32.46 31.59 1nly n ARG 240 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1nly s PRO 241 N -0.61 4.27 -0.15 -0.14 0.04 -1.26 -4.90 135.00 132.25 1nly s PRO 241 Ca 0.28 1.00 0.10 0.00 0.04 0.00 0.00 61.00 62.41 1nly s PRO 241 Cb 0.31 -2.58 -0.23 0.00 0.04 0.00 0.00 34.50 32.04 1nly s PRO 241 CO -0.06 0.20 0.25 -0.25 0.04 0.00 0.00 177.00 177.19 1nly n ASP 242 N 0.08 0.96 -3.96 6.66 8.00 0.18 -4.92 116.55 123.57 1nly n ASP 242 Ca 0.02 0.14 -0.15 0.00 0.71 0.00 0.00 54.79 55.52 1nly n ASP 242 Cb 0.52 0.12 -0.14 0.00 -0.02 0.00 0.00 41.12 41.60 1nly n ASP 242 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1nly s ARG 243 N -2.54 0.37 -0.19 -1.24 1.81 -0.94 -3.61 118.95 112.61 1nly s ARG 243 Ca -0.15 -0.22 0.01 0.00 -1.72 0.00 0.00 55.73 53.65 1nly s ARG 243 Cb 0.07 -0.33 0.03 0.00 -0.45 0.00 0.00 34.95 34.27 1nly s ARG 243 CO 0.78 0.09 -0.17 0.42 -0.68 0.00 0.00 175.30 175.73 1nly s ILE 244 N -0.25 2.01 -0.41 1.52 1.01 -0.71 -1.48 121.20 122.90 1nly s ILE 244 Ca 0.00 -1.04 -0.10 0.00 0.00 0.00 0.00 60.65 59.51 1nly s ILE 244 Cb -0.03 -1.89 0.06 0.00 0.01 0.00 0.00 42.46 40.61 1nly s ILE 244 CO -0.00 0.41 0.25 -0.63 0.00 0.00 0.00 174.94 174.97 1nly s ILE 245 N 1.28 4.45 -0.45 2.92 1.01 0.25 -2.39 121.20 128.27 1nly s ILE 245 Ca 0.02 -1.15 -0.22 0.00 0.00 0.00 0.00 60.65 59.30 1nly s ILE 245 Cb -0.14 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 38.73 1nly s ILE 245 CO -0.11 -0.40 0.71 -0.76 0.00 0.00 0.00 174.94 174.38 1nly s LEU 246 N 1.50 4.40 0.11 2.97 1.02 -0.76 -0.77 118.68 127.15 1nly s LEU 246 Ca 0.02 -0.27 -0.19 0.00 0.02 0.00 0.00 54.13 53.72 1nly s LEU 246 Cb -0.22 -2.82 -0.01 0.00 0.02 0.00 0.00 46.19 43.16 1nly s LEU 246 CO 0.04 -0.86 1.01 0.61 0.02 0.00 0.00 176.35 177.18 1nly n GLY 247 N 5.02 -1.65 3.51 -3.19 0.00 0.22 -3.59 105.19 105.51 1nly n GLY 247 Ca 0.00 0.78 -0.00 0.00 0.00 0.00 0.00 46.02 46.79 1nly n GLY 247 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1nly s GLU 248 N -5.37 0.36 -0.04 1.61 -1.05 -1.26 -3.40 118.70 109.55 1nly s GLU 248 Ca -0.08 0.80 -0.38 0.00 -0.15 0.00 0.00 54.97 55.16 1nly s GLU 248 Cb 0.08 0.36 -0.16 0.00 -0.44 0.00 0.00 34.13 33.97 1nly s GLU 248 CO 0.42 -0.11 1.50 1.28 0.95 0.00 0.00 175.26 179.30 1nly n LEU 249 N 4.60 1.99 -0.02 1.83 7.99 -0.70 -4.90 117.00 127.79 1nly n LEU 249 Ca -0.13 1.10 -0.03 0.00 -0.01 0.00 0.00 56.01 56.94 1nly n LEU 249 Cb 0.54 -1.18 -0.01 0.00 -0.11 0.00 0.00 43.42 42.65 1nly n LEU 249 CO -0.02 -0.78 -0.24 -1.14 -1.51 0.00 0.00 177.39 173.69 1nly n ARG 250 N 3.65 0.19 0.00 3.23 0.63 -1.26 -4.80 116.66 118.29 1nly n ARG 250 Ca 0.21 0.07 0.00 0.00 -0.92 0.00 0.00 57.85 57.22 1nly n ARG 250 Cb 0.17 -0.75 0.00 0.00 0.45 0.00 0.00 32.46 32.34 1nly n ARG 250 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1nly n SER 251 N -3.37 0.00 0.05 6.15 3.41 -1.26 -4.88 113.62 113.72 1nly n SER 251 Ca -0.05 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.45 1nly n SER 251 Cb 0.18 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.06 1nly n SER 251 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1nly h SER 252 N 0.00 -0.18 -0.04 4.04 0.02 -1.98 -3.21 113.55 112.21 1nly h SER 252 Ca 0.00 -0.36 -0.04 0.00 -0.84 0.00 0.00 61.79 60.55 1nly h SER 252 Cb 0.00 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 1nly h SER 252 CO 0.00 0.37 -0.07 -0.33 -1.14 0.00 0.00 176.83 175.66 1nly h GLU 253 N -0.85 0.26 0.00 3.45 5.08 -1.93 -3.32 114.58 117.27 1nly h GLU 253 Ca -0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1nly h GLU 253 Cb 0.53 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1nly h GLU 253 CO 0.04 0.34 0.00 0.00 -1.00 0.00 0.00 179.01 178.39 1nly n ALA 254 N -2.49 0.00 -0.09 3.43 0.00 -1.21 0.53 120.51 120.67 1nly n ALA 254 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.31 1nly n ALA 254 Cb 0.23 0.11 -0.04 0.00 0.00 0.00 0.00 19.45 19.74 1nly n ALA 254 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1nly h TYR 255 N 0.00 0.67 0.00 0.00 3.20 -1.76 -2.92 116.97 116.17 1nly h TYR 255 Ca 0.00 -0.17 0.00 0.00 3.14 0.00 0.00 58.73 61.70 1nly h TYR 255 Cb 0.00 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.12 1nly h TYR 255 CO -0.20 0.84 0.00 -0.44 -1.64 0.00 0.00 178.16 176.72 1nly h ASP 256 N 0.31 0.00 0.56 -2.11 3.32 -1.09 0.45 116.42 117.86 1nly h ASP 256 Ca 0.06 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.85 1nly h ASP 256 Cb 0.68 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.23 1nly h ASP 256 CO 0.04 0.00 -1.17 0.15 -1.72 0.00 0.00 179.24 176.55 1nly h PHE 257 N 0.00 0.52 -0.31 4.55 3.57 0.28 -2.83 116.94 122.73 1nly h PHE 257 Ca 0.00 -0.35 -0.04 0.00 3.53 0.00 0.00 57.97 61.10 1nly h PHE 257 Cb 0.07 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 1nly h PHE 257 CO 0.00 1.25 0.03 -0.92 -2.23 0.00 0.00 178.31 176.44 1nly h TYR 258 N 0.11 0.56 -0.61 0.41 3.20 -0.88 -1.38 116.97 118.39 1nly h TYR 258 Ca -0.12 -0.08 -0.06 0.00 3.14 0.00 0.00 58.73 61.61 1nly h TYR 258 Cb 1.87 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 39.96 1nly h TYR 258 CO 0.06 0.62 0.15 -0.91 -1.64 0.00 0.00 178.16 176.44 1nly h ASN 259 N 0.33 0.88 0.37 -2.11 2.35 -1.56 0.19 115.58 116.04 1nly h ASN 259 Ca 0.09 -0.17 -0.06 0.00 -0.55 0.00 0.00 56.30 55.62 1nly h ASN 259 Cb 0.37 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1nly h ASN 259 CO 0.01 0.86 -0.27 0.58 -1.65 0.00 0.00 177.43 176.95 1nly h VAL 260 N 0.90 1.04 0.11 2.81 2.07 -1.23 -0.94 116.25 121.02 1nly h VAL 260 Ca 0.20 -0.99 -0.27 0.00 0.82 0.00 0.00 66.70 66.46 1nly h VAL 260 Cb 0.32 1.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1nly h VAL 260 CO -0.00 0.27 -1.24 -0.07 0.02 0.00 0.00 177.57 176.54 1nly h LEU 261 N 0.00 0.37 -1.58 2.57 3.38 -0.28 -2.88 115.31 116.88 1nly h LEU 261 Ca -0.00 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.53 1nly h LEU 261 Cb 0.53 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1nly h LEU 261 CO 0.04 1.32 -0.15 0.00 0.09 0.00 0.00 178.44 179.73 1nly n SER 263 N -3.47 0.95 -2.85 0.00 3.41 -0.46 -4.90 113.62 106.28 1nly n SER 263 Ca -0.01 -1.77 -0.13 0.00 -0.26 0.00 0.00 58.87 56.71 1nly n SER 263 Cb 0.32 -0.09 0.06 0.00 -0.26 0.00 0.00 64.21 64.25 1nly n SER 263 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nly n GLY 264 N 0.89 -0.31 3.76 5.00 0.00 -0.43 -4.98 105.19 109.13 1nly n GLY 264 Ca 0.11 0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1nly n GLY 264 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1nly s HIS 265 N -3.28 3.96 0.00 1.61 5.04 -1.09 -5.05 115.29 116.48 1nly s HIS 265 Ca 0.09 1.81 0.00 0.00 -1.54 0.00 0.00 55.06 55.42 1nly s HIS 265 Cb -0.01 -2.90 0.00 0.00 0.04 0.00 0.00 32.58 29.71 1nly s HIS 265 CO 0.56 0.48 0.00 1.17 -2.34 0.00 0.00 174.74 174.61 1nly n LYS 266 N 1.54 0.00 -3.21 2.88 3.00 -1.26 -4.71 118.16 116.41 1nly n LYS 266 Ca -0.03 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.84 1nly n LYS 266 Cb 0.48 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 35.43 1nly n LYS 266 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1nly s GLY 267 N 0.00 1.80 -0.07 3.14 0.00 -1.20 -4.40 107.32 106.59 1nly s GLY 267 Ca 0.00 -1.49 0.04 0.00 0.00 0.00 0.00 44.72 43.27 1nly s GLY 267 CO 0.00 1.37 -0.19 -1.59 0.00 0.00 0.00 173.10 172.69 1nly s THR 268 N 2.49 2.56 -0.05 0.90 2.01 -1.22 -1.73 115.64 120.59 1nly s THR 268 Ca 0.16 -0.88 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 1nly s THR 268 Cb -0.17 -1.99 0.04 0.00 0.01 0.00 0.00 72.50 70.39 1nly s THR 268 CO 0.15 0.57 0.10 -0.22 -0.69 0.00 0.00 174.62 174.52 1nly s LEU 269 N -0.19 0.43 -0.04 4.42 2.96 -1.00 -0.60 118.68 124.66 1nly s LEU 269 Ca -0.02 0.19 -0.19 0.00 -0.22 0.00 0.00 54.13 53.89 1nly s LEU 269 Cb -0.13 0.11 0.04 0.00 0.50 0.00 0.00 46.19 46.70 1nly s LEU 269 CO 0.03 -0.20 0.43 0.28 -1.32 0.00 0.00 176.35 175.58 1nly s THR 270 N 1.73 0.03 0.12 3.68 -1.32 -0.60 -1.83 115.64 117.46 1nly s THR 270 Ca -0.02 -0.29 -0.03 0.00 -1.21 0.00 0.00 61.69 60.14 1nly s THR 270 Cb -0.12 -0.73 -0.05 0.00 -1.51 0.00 0.00 72.50 70.09 1nly s THR 270 CO -0.04 -0.16 0.33 0.42 -2.21 0.00 0.00 174.62 172.95 1nly s THR 271 N -1.11 5.24 -0.02 5.08 -4.23 -1.22 -1.00 115.64 118.39 1nly s THR 271 Ca -0.11 -0.14 -0.18 0.00 -1.18 0.00 0.00 61.69 60.07 1nly s THR 271 Cb -0.04 -3.64 0.03 0.00 1.34 0.00 0.00 72.50 70.20 1nly s THR 271 CO 0.05 0.04 0.38 -0.22 -0.54 0.00 0.00 174.62 174.34 1nly s LEU 272 N -2.69 0.56 -0.56 4.79 2.96 -0.01 -1.72 118.68 122.00 1nly s LEU 272 Ca 0.39 0.21 -0.26 0.00 -0.22 0.00 0.00 54.13 54.25 1nly s LEU 272 Cb -0.12 1.52 0.04 0.00 0.50 0.00 0.00 46.19 48.12 1nly s LEU 272 CO 0.26 -0.48 1.04 -1.00 -1.32 0.00 0.00 176.35 174.85 1nly s HIS 273 N -1.32 2.73 -0.13 5.38 3.76 -1.26 -2.25 115.29 122.20 1nly s HIS 273 Ca -0.13 0.20 -0.27 0.00 -0.15 0.00 0.00 55.06 54.71 1nly s HIS 273 Cb -0.04 -4.25 0.06 0.00 1.11 0.00 0.00 32.58 29.46 1nly s HIS 273 CO 0.05 -1.43 0.65 0.00 -0.85 0.00 0.00 174.74 173.17 1nly s ALA 274 N 4.35 -1.66 -1.64 -1.40 0.00 -1.23 -4.89 121.76 115.29 1nly s ALA 274 Ca 0.36 1.48 0.28 0.00 0.00 0.00 0.00 51.96 54.08 1nly s ALA 274 Cb -0.10 -0.43 1.01 0.00 0.00 0.00 0.00 23.12 23.60 1nly s ALA 274 CO 0.22 -0.34 1.73 0.41 0.00 0.00 0.00 175.76 177.78 1nly n GLY 275 N 1.65 -0.85 4.02 0.00 0.00 -1.26 -1.40 105.19 107.35 1nly n GLY 275 Ca -0.17 -0.32 0.04 0.00 0.00 0.00 0.00 46.02 45.57 1nly n GLY 275 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nly s SER 276 N -2.53 0.00 0.04 1.61 1.04 -1.26 -4.96 113.70 107.64 1nly s SER 276 Ca 0.26 -0.09 -0.29 0.00 0.48 0.00 0.00 55.95 56.30 1nly s SER 276 Cb 0.20 0.06 -0.16 0.00 0.10 0.00 0.00 66.02 66.22 1nly s SER 276 CO 0.50 -0.13 1.39 -1.28 0.98 0.00 0.00 173.24 174.71 1nly h SER 277 N 2.00 -0.90 -0.75 7.02 0.87 -1.95 0.43 113.55 120.27 1nly h SER 277 Ca -0.20 0.03 0.12 0.00 -1.23 0.00 0.00 61.79 60.51 1nly h SER 277 Cb 1.18 0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 63.32 1nly h SER 277 CO 0.30 -0.62 0.50 -0.08 -0.53 0.00 0.00 176.83 176.39 1nly h GLU 278 N -1.10 0.52 -0.11 2.24 4.57 -2.00 -0.85 114.58 117.85 1nly h GLU 278 Ca -0.11 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.01 1nly h GLU 278 Cb 0.81 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.28 1nly h GLU 278 CO 0.18 0.34 -0.04 0.93 -1.18 0.00 0.00 179.01 179.25 1nly h GLU 279 N 0.54 0.21 -0.90 1.92 5.08 -1.88 -2.98 114.58 116.57 1nly h GLU 279 Ca 0.36 -0.09 0.18 0.00 -1.00 0.00 0.00 59.36 58.81 1nly h GLU 279 Cb 0.66 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.80 1nly h GLU 279 CO -0.13 0.54 0.47 0.00 -1.00 0.00 0.00 179.01 178.89 1nly h ALA 280 N 0.67 1.42 -0.94 3.43 0.00 0.13 0.56 119.26 124.52 1nly h ALA 280 Ca 0.03 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1nly h ALA 280 Cb 0.47 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 1nly h ALA 280 CO 0.01 -0.16 0.59 0.74 0.00 0.00 0.00 179.25 180.43 1nly h PHE 281 N 0.59 1.22 -0.06 0.00 0.05 -1.32 0.31 116.94 117.73 1nly h PHE 281 Ca 0.52 0.01 -0.13 0.00 3.82 0.00 0.00 57.97 62.19 1nly h PHE 281 Cb 0.84 -0.40 0.01 0.00 2.00 0.00 0.00 35.95 38.39 1nly h PHE 281 CO -0.08 0.79 -0.48 0.82 -0.18 0.00 0.00 178.31 179.18 1nly h ILE 282 N 1.29 1.41 -0.81 -0.55 2.04 -0.81 -2.76 117.51 117.31 1nly h ILE 282 Ca 0.34 -1.89 0.17 0.00 1.00 0.00 0.00 64.86 64.48 1nly h ILE 282 Cb -0.09 2.38 -0.11 0.00 -0.74 0.00 0.00 36.82 38.26 1nly h ILE 282 CO -0.07 0.55 0.33 -0.09 0.00 0.00 0.00 178.15 178.88 1nly h ARG 283 N -0.04 0.43 0.18 2.37 9.65 0.51 -1.08 114.38 126.39 1nly h ARG 283 Ca -0.04 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.80 1nly h ARG 283 Cb 1.15 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 1nly h ARG 283 CO 0.10 0.28 -0.09 -0.07 2.80 0.00 0.00 179.97 182.99 1nly h LEU 284 N 0.44 -0.21 -0.67 3.80 3.38 -0.92 -3.16 115.31 117.98 1nly h LEU 284 Ca 0.46 -0.27 0.13 0.00 0.09 0.00 0.00 57.88 58.30 1nly h LEU 284 Cb 0.77 0.05 -0.10 0.00 0.09 0.00 0.00 40.66 41.47 1nly h LEU 284 CO -0.45 0.18 0.15 0.00 0.09 0.00 0.00 178.44 178.42 1nly h ALA 285 N 0.08 0.82 0.00 1.53 0.00 -1.14 -0.79 119.26 119.77 1nly h ALA 285 Ca -0.02 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1nly h ALA 285 Cb 0.46 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1nly h ALA 285 CO 0.04 -0.31 0.00 0.09 0.00 0.00 0.00 179.25 179.07 1nly n ASN 286 N -5.14 0.00 0.00 0.00 5.03 -0.46 -1.33 115.26 113.36 1nly n ASN 286 Ca 0.11 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.56 1nly n ASN 286 Cb 0.38 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.14 1nly n ASN 286 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1nly n SER 288 N -0.11 0.00 0.10 6.41 7.64 -0.30 -2.65 113.62 124.71 1nly n SER 288 Ca 0.00 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.95 1nly n SER 288 Cb 0.00 0.00 0.38 0.00 -1.01 0.00 0.00 64.21 63.58 1nly n SER 288 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1nly n SER 289 N 0.00 0.36 0.10 6.43 7.64 -0.45 -0.81 113.62 126.90 1nly n SER 289 Ca 0.00 0.66 -0.04 0.00 1.01 0.00 0.00 58.87 60.50 1nly n SER 289 Cb 0.00 -0.71 0.06 0.00 -1.01 0.00 0.00 64.21 62.55 1nly n SER 289 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1nly h SER 290 N 0.00 0.07 -3.25 6.43 4.64 -1.78 -3.44 113.55 116.22 1nly h SER 290 Ca 0.00 -0.05 -0.54 0.00 -0.47 0.00 0.00 61.79 60.73 1nly h SER 290 Cb 0.02 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1nly h SER 290 CO 0.00 0.80 0.53 0.21 -0.87 0.00 0.00 176.83 177.49 1nly s ASN 291 N -6.83 7.19 0.28 4.97 2.47 0.01 -4.93 114.94 118.10 1nly s ASN 291 Ca -0.01 1.81 0.00 0.00 0.42 0.00 0.00 52.86 55.08 1nly s ASN 291 Cb 0.11 -2.57 0.65 0.00 -1.45 0.00 0.00 41.25 37.99 1nly s ASN 291 CO 0.79 -0.42 1.65 0.28 -3.72 0.00 0.00 177.10 175.69 1nly h SER 292 N 6.96 -0.01 0.00 -4.21 0.02 -1.85 0.33 113.55 114.78 1nly h SER 292 Ca -0.39 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 1nly h SER 292 Cb 1.20 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.99 1nly h SER 292 CO 0.81 -0.13 0.25 0.00 -1.14 0.00 0.00 176.83 176.62 1nly h ALA 293 N 1.74 1.23 0.00 3.77 0.00 -1.91 1.15 119.26 125.24 1nly h ALA 293 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1nly h ALA 293 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1nly h ALA 293 CO -0.63 -0.23 -0.59 0.00 0.00 0.00 0.00 179.25 177.81 1nly n ALA 294 N -1.83 3.62 -0.25 0.00 0.00 0.12 -4.51 120.51 117.66 1nly n ALA 294 Ca -0.02 -0.37 0.06 0.00 0.00 0.00 0.00 53.44 53.11 1nly n ALA 294 Cb 0.29 -1.08 0.13 0.00 0.00 0.00 0.00 19.45 18.79 1nly n ALA 294 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1nly n ARG 295 N -1.57 -0.06 -0.35 0.00 3.00 0.40 0.38 116.66 118.46 1nly n ARG 295 Ca 0.05 1.07 0.06 0.00 -0.01 0.00 0.00 57.85 59.02 1nly n ARG 295 Cb 0.35 -1.62 0.22 0.00 0.00 0.00 0.00 32.46 31.40 1nly n ARG 295 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1nly n ASN 296 N -5.08 2.97 -4.38 0.55 4.13 -1.26 -4.87 115.26 107.32 1nly n ASN 296 Ca 0.13 -2.21 -0.36 0.00 1.68 0.00 0.00 54.58 53.81 1nly n ASN 296 Cb 0.40 -0.42 -0.13 0.00 -1.54 0.00 0.00 39.78 38.09 1nly n ASN 296 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 1nly s ILE 297 N -1.65 3.87 -0.04 2.41 -4.36 0.16 -5.06 121.20 116.53 1nly s ILE 297 Ca 0.31 -0.32 -0.37 0.00 -0.26 0.00 0.00 60.65 60.01 1nly s ILE 297 Cb 0.19 -2.79 -0.15 0.00 1.25 0.00 0.00 42.46 40.97 1nly s ILE 297 CO 0.16 0.38 1.59 0.29 0.24 0.00 0.00 174.94 177.61 1nly n LYS 298 N 4.84 1.49 -0.03 0.37 4.01 -1.26 -4.89 118.16 122.70 1nly n LYS 298 Ca -0.17 0.54 -0.11 0.00 -0.51 0.00 0.00 58.31 58.06 1nly n LYS 298 Cb 0.51 -2.25 -0.05 0.00 -0.51 0.00 0.00 35.03 32.73 1nly n LYS 298 CO 0.00 0.00 0.00 0.35 -1.11 0.00 0.00 177.40 176.64 1nly h PHE 299 N 6.37 -1.09 0.00 2.13 3.57 -1.97 0.43 116.94 126.38 1nly h PHE 299 Ca -0.47 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.08 1nly h PHE 299 Cb 1.31 0.51 0.00 0.00 2.79 0.00 0.00 35.95 40.55 1nly h PHE 299 CO 0.70 -0.44 0.00 0.39 -2.23 0.00 0.00 178.31 176.73 1nly n GLU 300 N -5.42 0.12 0.02 1.11 -0.58 -1.26 -0.71 120.64 113.91 1nly n GLU 300 Ca -0.03 0.09 -0.01 0.00 -0.42 0.00 0.00 57.16 56.80 1nly n GLU 300 Cb 0.35 -1.50 -0.09 0.00 -0.57 0.00 0.00 31.44 29.63 1nly n GLU 300 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1nly n SER 301 N -1.11 0.83 -0.04 1.62 2.88 0.15 -3.61 113.62 114.33 1nly n SER 301 Ca 0.03 0.37 -0.14 0.00 -1.33 0.00 0.00 58.87 57.80 1nly n SER 301 Cb 0.02 0.19 -0.12 0.00 -0.75 0.00 0.00 64.21 63.56 1nly n SER 301 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1nly h LEU 302 N 0.00 0.06 -0.18 2.46 3.38 -0.62 -2.18 115.31 118.23 1nly h LEU 302 Ca -0.18 -0.84 0.05 0.00 0.09 0.00 0.00 57.88 57.00 1nly h LEU 302 Cb 1.62 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 42.29 1nly h LEU 302 CO 0.05 0.90 -0.18 0.40 0.09 0.00 0.00 178.44 179.70 1nly h ILE 303 N -0.77 0.53 -0.91 1.22 2.04 -1.71 0.76 117.51 118.68 1nly h ILE 303 Ca -0.01 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.93 1nly h ILE 303 Cb 0.92 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 37.46 1nly h ILE 303 CO 0.02 0.00 0.59 -0.33 0.00 0.00 0.00 178.15 178.42 1nly h GLU 304 N -0.20 0.94 0.06 2.37 5.08 -1.67 0.31 114.58 121.48 1nly h GLU 304 Ca 0.12 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1nly h GLU 304 Cb 0.37 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1nly h GLU 304 CO -0.30 0.62 -0.08 0.78 -1.00 0.00 0.00 179.01 179.04 1nly h GLY 305 N 0.97 -0.14 2.00 -3.84 0.00 0.57 -1.85 103.07 100.78 1nly h GLY 305 Ca 0.41 0.09 -0.05 0.00 0.00 0.00 0.00 47.33 47.77 1nly h GLY 305 CO -0.17 -0.08 -0.26 0.74 0.00 0.00 0.00 176.54 176.77 1nly h PHE 306 N -0.16 0.00 0.00 5.60 -1.00 0.89 -2.50 116.94 119.77 1nly h PHE 306 Ca 0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.79 1nly h PHE 306 Cb 0.17 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.73 1nly h PHE 306 CO -0.11 0.26 0.00 1.63 -1.61 0.00 0.00 178.31 178.48 1nly n LYS 307 N -3.95 0.10 -0.04 1.51 5.02 0.04 -1.34 118.16 119.51 1nly n LYS 307 Ca -0.02 0.23 -0.17 0.00 -2.02 0.00 0.00 58.31 56.33 1nly n LYS 307 Cb 0.34 -1.66 -0.14 0.00 -0.02 0.00 0.00 35.03 33.55 1nly n LYS 307 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1nly n ASP 308 N -1.84 1.71 0.03 4.39 8.00 -0.86 -4.60 116.55 123.37 1nly n ASP 308 Ca 0.04 0.15 -0.19 0.00 0.71 0.00 0.00 54.79 55.50 1nly n ASP 308 Cb 0.27 -0.47 -0.14 0.00 -0.02 0.00 0.00 41.12 40.76 1nly n ASP 308 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1nly h LEU 309 N 0.04 0.40 -9.09 0.64 3.38 -1.36 -3.45 115.31 105.87 1nly h LEU 309 Ca -0.45 -0.95 -0.56 0.00 0.09 0.00 0.00 57.88 56.01 1nly h LEU 309 Cb 2.02 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 42.61 1nly h LEU 309 CO 0.04 1.32 1.05 -0.63 0.09 0.00 0.00 178.44 180.31 1nly s ILE 310 N -2.43 3.86 -0.13 1.22 1.09 -0.45 -4.70 121.20 119.66 1nly s ILE 310 Ca -0.14 1.00 0.30 0.00 -1.10 0.00 0.00 60.65 60.70 1nly s ILE 310 Cb 0.00 -3.79 0.35 0.00 -1.06 0.00 0.00 42.46 37.96 1nly s ILE 310 CO 0.81 -0.25 1.88 0.44 -0.10 0.00 0.00 174.94 177.72 1nly h ASP 311 N 9.78 0.00 -4.51 3.58 3.32 -1.63 -3.44 116.42 123.53 1nly h ASP 311 Ca -0.32 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.67 1nly h ASP 311 Cb 1.14 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.49 1nly h ASP 311 CO 0.99 0.00 0.13 -0.63 -1.72 0.00 0.00 179.24 178.01 1nly s ILE 313 N -3.52 0.00 -0.10 0.35 1.01 -0.05 -0.17 121.20 118.72 1nly s ILE 313 Ca 0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 60.65 60.66 1nly s ILE 313 Cb 0.09 -0.97 0.02 0.00 0.01 0.00 0.00 42.46 41.62 1nly s ILE 313 CO 0.51 -0.01 -0.07 -0.69 0.00 0.00 0.00 174.94 174.68 1nly s VAL 314 N -0.44 0.93 -0.06 2.92 1.01 -0.09 -1.18 120.40 123.49 1nly s VAL 314 Ca -0.06 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1nly s VAL 314 Cb -0.03 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 1nly s VAL 314 CO 0.05 0.35 -0.05 -2.28 0.00 0.00 0.00 175.10 173.17 1nly s HIS 315 N 1.59 2.98 -0.14 5.22 5.04 -0.83 -1.05 115.29 128.10 1nly s HIS 315 Ca 0.02 0.05 0.02 0.00 -1.54 0.00 0.00 55.06 53.61 1nly s HIS 315 Cb -0.13 -1.71 0.01 0.00 0.04 0.00 0.00 32.58 30.79 1nly s HIS 315 CO -0.06 0.37 -0.21 0.42 -2.34 0.00 0.00 174.74 172.92 1nly s ILE 316 N -0.87 2.18 1.17 0.89 1.01 -0.79 -1.99 121.20 122.81 1nly s ILE 316 Ca 0.14 -0.94 -0.19 0.00 0.00 0.00 0.00 60.65 59.66 1nly s ILE 316 Cb -0.11 -1.88 0.28 0.00 0.01 0.00 0.00 42.46 40.76 1nly s ILE 316 CO 0.03 0.54 1.17 0.54 0.00 0.00 0.00 174.94 177.22 1nly s ASN 317 N 0.83 1.21 0.00 3.58 2.20 -0.44 -4.16 114.94 118.16 1nly s ASN 317 Ca -0.06 0.47 0.10 0.00 -0.94 0.00 0.00 52.86 52.43 1nly s ASN 317 Cb -0.15 -0.61 0.47 0.00 -2.00 0.00 0.00 41.25 38.96 1nly s ASN 317 CO -0.02 -3.93 1.29 1.41 -2.94 0.00 0.00 177.10 172.91 1nly n HIS 318 N -4.60 0.00 -0.87 1.54 8.25 -1.26 -2.14 115.22 116.14 1nly n HIS 318 Ca 0.15 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.68 1nly n HIS 318 Cb 0.60 -0.42 0.40 0.00 1.12 0.00 0.00 29.99 31.68 1nly n HIS 318 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1nly n HIS 319 N -1.42 1.98 -3.65 4.41 8.25 -1.26 -4.96 115.22 118.57 1nly n HIS 319 Ca 0.03 -0.72 -0.29 0.00 -0.26 0.00 0.00 57.72 56.49 1nly n HIS 319 Cb 0.11 -0.47 0.04 0.00 1.12 0.00 0.00 29.99 30.78 1nly n HIS 319 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1nly n LYS 320 N 0.67 -1.23 -3.75 -0.41 5.02 -0.91 -5.01 118.16 112.54 1nly n LYS 320 Ca 0.27 0.55 -0.13 0.00 -2.02 0.00 0.00 58.31 56.98 1nly n LYS 320 Cb 1.15 -4.09 -0.11 0.00 -0.02 0.00 0.00 35.03 31.96 1nly n LYS 320 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1nly s GLN 321 N -5.71 0.39 0.12 1.97 -0.21 -1.26 -4.89 119.66 110.07 1nly s GLN 321 Ca 0.41 0.50 -0.31 0.00 0.02 0.00 0.00 55.36 55.98 1nly s GLN 321 Cb -0.15 0.17 -0.08 0.00 1.00 0.00 0.00 33.01 33.96 1nly s GLN 321 CO 0.86 -0.06 1.39 0.00 -2.12 0.00 0.00 175.29 175.36 1nly n ASP 323 N 3.93 0.66 -3.67 0.00 5.68 -0.84 -4.30 116.55 118.00 1nly n ASP 323 Ca 0.11 -0.94 -0.08 0.00 -0.50 0.00 0.00 54.79 53.38 1nly n ASP 323 Cb 0.42 0.07 -0.09 0.00 -1.14 0.00 0.00 41.12 40.38 1nly n ASP 323 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 1nly s GLU 324 N -0.07 0.45 -0.56 0.11 2.12 -1.24 -4.95 118.70 114.57 1nly s GLU 324 Ca 0.00 1.00 0.06 0.00 0.36 0.00 0.00 54.97 56.39 1nly s GLU 324 Cb 0.00 0.18 0.22 0.00 0.26 0.00 0.00 34.13 34.78 1nly s GLU 324 CO 0.00 -0.18 0.56 0.34 -0.54 0.00 0.00 175.26 175.44 1nly n PHE 325 N 4.67 1.86 -2.04 5.30 7.35 -1.26 -1.96 117.46 131.37 1nly n PHE 325 Ca -0.18 -3.92 -0.41 0.00 -0.76 0.00 0.00 57.45 52.18 1nly n PHE 325 Cb 0.54 -0.39 -0.02 0.00 0.35 0.00 0.00 39.48 39.96 1nly n PHE 325 CO 0.00 0.00 0.00 -0.47 -0.76 0.00 0.00 176.76 175.53 1nly s TYR 326 N -1.50 3.02 0.06 -5.13 5.04 -0.33 -4.91 117.35 113.60 1nly s TYR 326 Ca 0.34 1.15 -0.03 0.00 -2.44 0.00 0.00 57.07 56.10 1nly s TYR 326 Cb 0.09 -3.78 -0.03 0.00 0.35 0.00 0.00 41.96 38.59 1nly s TYR 326 CO -0.11 -2.41 0.02 0.42 -1.34 0.00 0.00 175.55 172.13 1nly s ILE 327 N -0.38 0.20 0.00 3.14 1.01 -1.26 -0.87 121.20 123.04 1nly s ILE 327 Ca 0.56 -1.62 0.00 0.00 0.00 0.00 0.00 60.65 59.59 1nly s ILE 327 Cb -0.41 -1.41 0.00 0.00 0.01 0.00 0.00 42.46 40.65 1nly s ILE 327 CO 0.47 -0.89 0.00 0.29 0.00 0.00 0.00 174.94 174.80