#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 8ica n THR 10 N 0.00 0.00 0.05 2.62 5.66 -1.26 -4.63 114.28 116.72 8ica n THR 10 Ca 0.00 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.80 8ica n THR 10 Cb 0.00 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 68.66 8ica n THR 10 CO 0.00 0.00 0.00 0.17 -3.05 0.00 0.00 175.07 172.19 8ica h LEU 11 N 0.00 0.75 -0.62 1.09 -0.00 -1.97 -3.27 115.31 111.28 8ica h LEU 11 Ca 0.00 -0.81 0.00 0.00 -0.00 0.00 0.00 57.88 57.07 8ica h LEU 11 Cb 0.00 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.43 8ica h LEU 11 CO 0.00 1.47 -0.21 0.59 -0.00 0.00 0.00 178.44 180.29 8ica n ASN 12 N -3.96 1.18 0.00 0.17 5.03 -1.26 -4.73 115.26 111.68 8ica n ASN 12 Ca -0.12 -1.05 0.00 0.00 0.87 0.00 0.00 54.58 54.28 8ica n ASN 12 Cb 0.86 0.11 0.00 0.00 -1.02 0.00 0.00 39.78 39.74 8ica n ASN 12 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 8ica n GLY 13 N 1.31 -0.44 0.33 7.41 0.00 -1.24 -1.92 105.19 110.64 8ica n GLY 13 Ca 0.14 0.09 0.29 0.00 0.00 0.00 0.00 46.02 46.54 8ica n GLY 13 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 8ica h GLY 14 N 0.00 2.19 0.87 -0.02 0.00 -1.86 0.31 103.07 104.57 8ica h GLY 14 Ca 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 8ica h GLY 14 CO 0.00 -0.68 -0.47 -2.22 0.00 0.00 0.00 176.54 173.17 8ica h ILE 15 N 0.13 0.00 -0.75 2.60 2.04 -1.73 0.31 117.51 120.12 8ica h ILE 15 Ca 0.80 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.71 8ica h ILE 15 Cb 2.01 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 8ica h ILE 15 CO -0.70 0.00 0.45 0.71 0.00 0.00 0.00 178.15 178.61 8ica h THR 16 N -1.24 1.03 -0.44 -0.27 1.35 -0.55 -1.21 112.91 111.58 8ica h THR 16 Ca -0.12 -0.29 0.03 0.00 -0.55 0.00 0.00 66.41 65.49 8ica h THR 16 Cb 0.97 0.12 -0.04 0.00 -1.73 0.00 0.00 68.15 67.48 8ica h THR 16 CO 0.16 0.15 0.23 0.44 -0.25 0.00 0.00 175.52 176.25 8ica h ASP 17 N 0.84 0.34 -0.21 5.36 3.32 -0.17 0.35 116.42 126.25 8ica h ASP 17 Ca 0.32 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.30 8ica h ASP 17 Cb 0.13 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 8ica h ASP 17 CO -0.16 0.24 -0.17 -0.03 -1.72 0.00 0.00 179.24 177.41 8ica h MET 18 N 0.46 0.63 -0.33 3.56 1.85 0.01 -1.10 114.93 120.01 8ica h MET 18 Ca 0.19 -0.22 0.00 0.00 -0.61 0.00 0.00 59.70 59.07 8ica h MET 18 Cb 0.08 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.05 8ica h MET 18 CO -0.13 0.77 0.22 -0.07 -0.40 0.00 0.00 176.91 177.30 8ica h LEU 19 N 0.57 0.37 -0.03 3.39 4.07 -0.14 -1.50 115.31 122.05 8ica h LEU 19 Ca 0.09 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.04 8ica h LEU 19 Cb 0.61 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.26 8ica h LEU 19 CO 0.04 0.27 0.00 0.71 -1.08 0.00 0.00 178.44 178.38 8ica h THR 20 N 0.44 1.24 -0.77 0.22 1.35 -0.17 -0.37 112.91 114.86 8ica h THR 20 Ca 0.12 -0.73 0.16 0.00 -0.55 0.00 0.00 66.41 65.42 8ica h THR 20 Cb -0.04 1.69 -0.14 0.00 -1.73 0.00 0.00 68.15 67.92 8ica h THR 20 CO -0.03 0.19 -0.13 -0.33 -0.25 0.00 0.00 175.52 174.97 8ica h GLU 21 N -0.25 0.02 0.42 4.72 5.08 -1.03 0.19 114.58 123.72 8ica h GLU 21 Ca 0.01 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 8ica h GLU 21 Cb 0.31 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 8ica h GLU 21 CO 0.00 0.02 -0.29 -0.07 -1.00 0.00 0.00 179.01 177.67 8ica h LEU 22 N 0.02 -0.75 -0.07 1.33 -0.00 -1.16 -1.02 115.31 113.66 8ica h LEU 22 Ca 0.39 0.05 0.02 0.00 -0.00 0.00 0.00 57.88 58.34 8ica h LEU 22 Cb 0.63 0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 41.51 8ica h LEU 22 CO -0.76 -0.45 -0.05 0.00 -0.00 0.00 0.00 178.44 177.18 8ica h ALA 23 N -0.18 0.02 -0.62 1.53 0.00 -0.02 -1.43 119.26 118.56 8ica h ALA 23 Ca -0.04 0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.99 8ica h ALA 23 Cb 0.59 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 8ica h ALA 23 CO 0.02 -0.52 0.26 -0.91 0.00 0.00 0.00 179.25 178.11 8ica h ASN 24 N -0.05 0.31 -0.77 0.00 2.35 -0.64 0.86 115.58 117.64 8ica h ASN 24 Ca 0.04 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 8ica h ASN 24 Cb 0.11 0.02 -0.04 0.00 0.05 0.00 0.00 38.32 38.47 8ica h ASN 24 CO -0.10 0.18 0.43 0.15 -1.65 0.00 0.00 177.43 176.44 8ica h PHE 25 N 0.47 1.06 0.33 1.19 3.04 -0.65 -1.27 116.94 121.11 8ica h PHE 25 Ca 0.31 -0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.22 8ica h PHE 25 Cb 0.34 -0.34 0.00 0.00 2.56 0.00 0.00 35.95 38.51 8ica h PHE 25 CO -0.14 0.73 -0.16 0.93 -2.02 0.00 0.00 178.31 177.65 8ica h GLU 26 N 1.09 -0.42 -0.25 1.11 4.39 0.20 -2.48 114.58 118.22 8ica h GLU 26 Ca 0.28 0.03 -0.01 0.00 0.34 0.00 0.00 59.36 60.00 8ica h GLU 26 Cb 0.02 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 8ica h GLU 26 CO -0.04 -0.20 0.13 1.57 -1.16 0.00 0.00 179.01 179.31 8ica h LYS 27 N -0.58 0.34 0.00 2.33 5.09 -1.16 -2.19 116.57 120.39 8ica h LYS 27 Ca -0.05 -0.03 0.00 0.00 0.09 0.00 0.00 60.65 60.67 8ica h LYS 27 Cb 0.42 -0.07 0.00 0.00 0.10 0.00 0.00 32.23 32.68 8ica h LYS 27 CO 0.07 0.26 0.00 0.09 -2.09 0.00 0.00 179.45 177.78 8ica n ASN 28 N -4.46 0.00 -0.10 7.07 5.03 -0.49 -4.52 115.26 117.78 8ica n ASN 28 Ca 0.01 0.02 -0.06 0.00 0.87 0.00 0.00 54.58 55.42 8ica n ASN 28 Cb 0.10 0.00 0.01 0.00 -1.02 0.00 0.00 39.78 38.88 8ica n ASN 28 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 8ica h VAL 29 N 0.00 0.87 -3.31 2.41 2.07 -1.62 -3.42 116.25 113.25 8ica h VAL 29 Ca 0.00 -0.08 -0.54 0.00 0.82 0.00 0.00 66.70 66.90 8ica h VAL 29 Cb 0.00 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 8ica h VAL 29 CO 0.00 0.04 -0.16 -0.94 0.02 0.00 0.00 177.57 176.54 8ica s SER 30 N -5.33 6.53 -0.45 0.57 1.04 -0.83 -4.96 113.70 110.27 8ica s SER 30 Ca -0.13 0.79 0.01 0.00 0.48 0.00 0.00 55.95 57.10 8ica s SER 30 Cb 0.12 -2.17 0.46 0.00 0.10 0.00 0.00 66.02 64.53 8ica s SER 30 CO 0.71 -0.10 1.88 1.67 0.98 0.00 0.00 173.24 178.38 8ica n GLN 31 N -0.41 2.18 -2.34 4.02 7.27 -1.25 -3.93 117.38 122.92 8ica n GLN 31 Ca -0.01 -2.54 -0.43 0.00 0.07 0.00 0.00 57.00 54.09 8ica n GLN 31 Cb 0.53 -2.00 0.00 0.00 2.41 0.00 0.00 30.24 31.18 8ica n GLN 31 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 8ica n ALA 32 N -0.66 4.37 -0.19 1.69 0.00 -1.18 -4.85 120.51 119.69 8ica n ALA 32 Ca 0.50 -3.95 0.00 0.00 0.00 0.00 0.00 53.44 49.99 8ica n ALA 32 Cb 1.07 -3.47 0.10 0.00 0.00 0.00 0.00 19.45 17.15 8ica n ALA 32 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 8ica h ILE 33 N 4.81 0.65 0.80 0.00 6.09 -1.86 0.20 117.51 128.20 8ica h ILE 33 Ca 0.47 -0.09 -0.04 0.00 -1.37 0.00 0.00 64.86 63.83 8ica h ILE 33 Cb 0.78 0.38 0.01 0.00 0.47 0.00 0.00 36.82 38.45 8ica h ILE 33 CO 1.58 0.05 -0.39 0.45 -3.07 0.00 0.00 178.15 176.77 8ica h HIS 34 N 0.25 -1.00 -0.75 2.19 3.86 -1.97 0.25 115.15 117.98 8ica h HIS 34 Ca 0.30 -0.02 0.11 0.00 -1.16 0.00 0.00 60.37 59.60 8ica h HIS 34 Cb 0.44 0.33 -0.05 0.00 1.06 0.00 0.00 27.41 29.19 8ica h HIS 34 CO -0.25 -0.62 0.49 0.87 0.86 0.00 0.00 177.93 179.28 8ica h LYS 35 N -1.08 0.58 -0.08 2.45 1.57 -1.98 1.67 116.57 119.71 8ica h LYS 35 Ca -0.11 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.65 8ica h LYS 35 Cb 0.83 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 8ica h LYS 35 CO 0.18 0.39 -0.01 -0.92 -0.57 0.00 0.00 179.45 178.52 8ica h TYR 36 N 0.60 -0.02 -0.33 -1.35 3.20 -0.67 -0.91 116.97 117.49 8ica h TYR 36 Ca 0.35 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.16 8ica h TYR 36 Cb 0.55 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 8ica h TYR 36 CO -0.00 -0.02 -0.08 -0.91 -1.64 0.00 0.00 178.16 175.50 8ica h ASN 37 N 0.01 0.52 0.05 -2.11 -0.26 0.30 -3.13 115.58 110.97 8ica h ASN 37 Ca 0.04 -0.13 -0.00 0.00 -0.56 0.00 0.00 56.30 55.65 8ica h ASN 37 Cb 0.05 -0.14 -0.00 0.00 -1.06 0.00 0.00 38.32 37.16 8ica h ASN 37 CO -0.07 0.65 -0.08 0.00 -1.06 0.00 0.00 177.43 176.88 8ica h ALA 38 N 1.41 -0.72 -1.61 -0.83 0.00 0.36 -2.48 119.26 115.39 8ica h ALA 38 Ca 0.10 -0.02 0.47 0.00 0.00 0.00 0.00 54.91 55.45 8ica h ALA 38 Cb 0.46 0.41 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 8ica h ALA 38 CO 0.02 -0.73 1.31 1.88 0.00 0.00 0.00 179.25 181.73 8ica h TYR 39 N -0.13 0.00 0.18 0.00 0.05 -1.34 -0.90 116.97 114.83 8ica h TYR 39 Ca -0.01 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 58.43 8ica h TYR 39 Cb 0.12 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.87 8ica h TYR 39 CO -0.20 0.00 -1.71 0.07 -1.05 0.00 0.00 178.16 175.27 8ica h ARG 40 N 0.00 0.38 -0.45 4.88 0.11 -1.40 -1.90 114.38 116.01 8ica h ARG 40 Ca 0.76 -0.66 -0.14 0.00 0.10 0.00 0.00 59.98 60.05 8ica h ARG 40 Cb 3.37 0.24 -0.01 0.00 1.11 0.00 0.00 29.97 34.68 8ica h ARG 40 CO -0.01 1.30 -0.25 1.57 0.10 0.00 0.00 179.97 182.68 8ica h LYS 41 N 0.10 0.96 0.03 0.08 -0.00 -0.87 -0.91 116.57 115.97 8ica h LYS 41 Ca -0.33 -0.44 0.02 0.00 -0.00 0.00 0.00 60.65 59.91 8ica h LYS 41 Cb 2.09 -0.02 -0.04 0.00 -0.00 0.00 0.00 32.23 34.27 8ica h LYS 41 CO 0.18 1.10 -0.20 0.00 -0.00 0.00 0.00 179.45 180.53 8ica h ALA 42 N 0.84 -0.29 -0.60 0.07 0.00 -1.63 0.43 119.26 118.09 8ica h ALA 42 Ca 0.10 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.04 8ica h ALA 42 Cb 0.83 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 8ica h ALA 42 CO 0.07 -0.71 0.39 0.00 0.00 0.00 0.00 179.25 179.01 8ica h ALA 43 N 0.52 1.75 -0.53 0.00 0.00 -1.27 0.82 119.26 120.54 8ica h ALA 43 Ca 0.05 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 8ica h ALA 43 Cb 0.41 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 8ica h ALA 43 CO -0.17 0.17 -0.08 1.03 0.00 0.00 0.00 179.25 180.21 8ica h SER 44 N 0.64 0.95 0.05 0.00 0.87 0.32 -2.67 113.55 113.71 8ica h SER 44 Ca 0.25 -0.29 -0.00 0.00 -1.23 0.00 0.00 61.79 60.51 8ica h SER 44 Cb 0.18 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 8ica h SER 44 CO -0.07 1.05 -0.02 -0.37 -0.53 0.00 0.00 176.83 176.88 8ica h VAL 45 N 0.86 0.93 -0.01 2.23 -1.51 0.14 -3.25 116.25 115.64 8ica h VAL 45 Ca 0.14 -1.56 0.00 0.00 -1.23 0.00 0.00 66.70 64.06 8ica h VAL 45 Cb 0.61 1.70 -0.00 0.00 -2.13 0.00 0.00 31.29 31.47 8ica h VAL 45 CO 0.04 0.30 0.23 0.16 -1.23 0.00 0.00 177.57 177.06 8ica h ILE 46 N -0.96 0.03 -0.27 7.19 3.07 -1.04 0.19 117.51 125.71 8ica h ILE 46 Ca -0.01 0.00 -0.04 0.00 1.55 0.00 0.00 64.86 66.36 8ica h ILE 46 Cb 0.53 0.78 -0.01 0.00 -0.27 0.00 0.00 36.82 37.85 8ica h ILE 46 CO 0.01 0.00 0.01 0.00 -1.05 0.00 0.00 178.15 177.12 8ica h ALA 47 N 1.56 0.37 -0.18 0.16 0.00 -1.52 -3.21 119.26 116.44 8ica h ALA 47 Ca 0.01 -0.22 -0.18 0.00 0.00 0.00 0.00 54.91 54.52 8ica h ALA 47 Cb 0.46 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 8ica h ALA 47 CO -0.00 0.10 -0.62 0.87 0.00 0.00 0.00 179.25 179.60 8ica h LYS 48 N 0.27 0.63 -6.12 0.00 1.57 -0.67 -3.38 116.57 108.87 8ica h LYS 48 Ca 0.08 -0.44 -0.74 0.00 -1.87 0.00 0.00 60.65 57.68 8ica h LYS 48 Cb 0.41 0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.79 8ica h LYS 48 CO 0.01 1.06 0.97 0.98 -0.57 0.00 0.00 179.45 181.90 8ica n TYR 49 N -3.94 1.97 0.56 -1.35 9.36 -0.98 -4.83 117.16 117.94 8ica n TYR 49 Ca -0.04 0.54 0.00 0.00 3.32 0.00 0.00 57.90 61.71 8ica n TYR 49 Cb 0.65 -2.45 0.00 0.00 -0.63 0.00 0.00 39.34 36.91 8ica n TYR 49 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 8ica n PRO 50 N 5.75 0.52 -3.52 2.98 -0.04 -1.26 -4.83 135.00 134.60 8ica n PRO 50 Ca 0.29 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.59 8ica n PRO 50 Cb 0.12 -1.24 -0.06 0.00 -0.04 0.00 0.00 33.50 32.29 8ica n PRO 50 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 8ica s HIS 51 N -1.08 -0.62 -0.22 0.54 3.76 -1.26 -5.10 115.29 111.31 8ica s HIS 51 Ca 0.00 1.02 -0.40 0.00 -0.15 0.00 0.00 55.06 55.53 8ica s HIS 51 Cb 0.00 0.42 -0.16 0.00 1.11 0.00 0.00 32.58 33.95 8ica s HIS 51 CO 0.00 -0.60 1.66 1.63 -0.85 0.00 0.00 174.74 176.58 8ica n LYS 52 N 0.80 1.09 -2.62 1.40 5.02 -1.26 -4.86 118.16 117.73 8ica n LYS 52 Ca -0.18 0.40 -0.42 0.00 -2.02 0.00 0.00 58.31 56.09 8ica n LYS 52 Cb 0.58 -2.07 -0.03 0.00 -0.02 0.00 0.00 35.03 33.49 8ica n LYS 52 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 8ica s ILE 53 N 2.93 4.63 -1.07 -0.18 1.01 -1.26 -4.90 121.20 122.36 8ica s ILE 53 Ca 0.96 1.89 0.21 0.00 0.00 0.00 0.00 60.65 63.71 8ica s ILE 53 Cb -1.07 -4.21 -0.21 0.00 0.01 0.00 0.00 42.46 36.98 8ica s ILE 53 CO 0.63 0.12 0.91 0.29 0.00 0.00 0.00 174.94 176.89 8ica n LYS 54 N 4.11 0.11 -3.59 2.79 4.01 -1.26 -5.04 118.16 119.28 8ica n LYS 54 Ca 0.07 -0.07 0.02 0.00 -0.51 0.00 0.00 58.31 57.83 8ica n LYS 54 Cb 0.49 -1.50 -0.00 0.00 -0.51 0.00 0.00 35.03 33.51 8ica n LYS 54 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 8ica s SER 55 N -2.96 -0.04 0.09 4.39 1.04 -1.26 -4.99 113.70 109.98 8ica s SER 55 Ca 0.09 -0.07 -0.25 0.00 0.48 0.00 0.00 55.95 56.19 8ica s SER 55 Cb 0.16 0.09 -0.15 0.00 0.10 0.00 0.00 66.02 66.22 8ica s SER 55 CO 0.85 -0.17 1.71 1.23 0.98 0.00 0.00 173.24 177.84 8ica h GLY 56 N 2.00 -0.23 -0.51 7.32 0.00 -1.88 -2.30 103.07 107.46 8ica h GLY 56 Ca -0.30 0.10 0.24 0.00 0.00 0.00 0.00 47.33 47.36 8ica h GLY 56 CO 0.29 -0.09 0.19 0.00 0.00 0.00 0.00 176.54 176.92 8ica h ALA 57 N 0.61 1.22 -0.04 3.60 0.00 -1.96 2.46 119.26 125.16 8ica h ALA 57 Ca -0.02 0.24 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 8ica h ALA 57 Cb 0.19 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 8ica h ALA 57 CO 0.02 -0.49 0.03 1.49 0.00 0.00 0.00 179.25 180.30 8ica h GLU 58 N 0.16 0.06 0.09 0.00 4.81 -1.83 -2.82 114.58 115.05 8ica h GLU 58 Ca 0.55 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.77 8ica h GLU 58 Cb 1.11 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.47 8ica h GLU 58 CO -0.69 0.08 -0.04 0.00 -0.73 0.00 0.00 179.01 177.62 8ica h ALA 59 N 0.98 -0.12 -1.93 2.92 0.00 -0.41 -3.09 119.26 117.61 8ica h ALA 59 Ca 0.02 -0.12 0.56 0.00 0.00 0.00 0.00 54.91 55.36 8ica h ALA 59 Cb 0.03 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.79 8ica h ALA 59 CO -0.00 -0.46 1.42 1.17 0.00 0.00 0.00 179.25 181.37 8ica n LYS 60 N -5.04 0.00 0.24 0.00 4.81 0.81 0.20 118.16 119.18 8ica n LYS 60 Ca -0.08 1.08 0.17 0.00 -0.87 0.00 0.00 58.31 58.60 8ica n LYS 60 Cb 0.16 -2.51 0.84 0.00 0.02 0.00 0.00 35.03 33.55 8ica n LYS 60 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 8ica h LYS 61 N 0.00 0.00 -7.08 1.64 1.57 -1.42 -3.43 116.57 107.85 8ica h LYS 61 Ca 0.91 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 59.21 8ica h LYS 61 Cb 3.74 0.00 0.02 0.00 0.08 0.00 0.00 32.23 36.07 8ica h LYS 61 CO -0.01 0.00 0.28 -0.51 -0.57 0.00 0.00 179.45 178.64 8ica s LEU 62 N -5.35 3.66 0.13 2.94 1.02 0.55 -5.00 118.68 116.63 8ica s LEU 62 Ca -0.02 1.39 -0.30 0.00 0.02 0.00 0.00 54.13 55.21 8ica s LEU 62 Cb 0.10 -4.32 -0.07 0.00 0.02 0.00 0.00 46.19 41.92 8ica s LEU 62 CO 0.34 -0.55 1.22 -2.16 0.02 0.00 0.00 176.35 175.22 8ica s PRO 63 N -4.12 4.45 0.00 1.29 0.04 -1.26 -0.85 135.00 134.55 8ica s PRO 63 Ca 0.56 1.86 0.00 0.00 0.04 0.00 0.00 61.00 63.45 8ica s PRO 63 Cb -0.10 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.16 8ica s PRO 63 CO 0.34 -0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.60 8ica n GLY 64 N 2.72 1.14 3.38 0.56 0.00 -1.26 -4.66 105.19 107.07 8ica n GLY 64 Ca 0.07 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.64 8ica n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 8ica s VAL 65 N -3.75 5.22 0.00 1.61 1.01 -0.03 -4.64 120.40 119.82 8ica s VAL 65 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 61.98 60.87 8ica s VAL 65 Cb 0.00 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.24 8ica s VAL 65 CO 0.00 -0.61 0.00 0.61 0.00 0.00 0.00 175.10 175.10 8ica n GLY 66 N 5.20 0.93 0.13 4.51 0.00 -1.26 -4.61 105.19 110.09 8ica n GLY 66 Ca -0.13 -1.93 -0.17 0.00 0.00 0.00 0.00 46.02 43.79 8ica n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 8ica h THR 67 N -0.16 1.44 0.68 2.61 1.03 -1.93 -2.77 112.91 113.80 8ica h THR 67 Ca 0.00 -2.84 -0.03 0.00 -0.01 0.00 0.00 66.41 63.53 8ica h THR 67 Cb 0.00 2.83 0.00 0.00 -1.07 0.00 0.00 68.15 69.91 8ica h THR 67 CO 0.00 0.84 -0.35 0.11 -0.01 0.00 0.00 175.52 176.10 8ica h LYS 68 N 0.13 -0.92 0.28 0.00 1.57 -1.98 -1.26 116.57 114.39 8ica h LYS 68 Ca -0.14 0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 8ica h LYS 68 Cb 1.91 0.21 0.00 0.00 0.08 0.00 0.00 32.23 34.43 8ica h LYS 68 CO 0.21 -0.61 -0.14 0.82 -0.57 0.00 0.00 179.45 179.16 8ica h ILE 69 N -0.95 0.76 -0.99 1.86 2.04 -1.95 -3.04 117.51 115.23 8ica h ILE 69 Ca -0.09 -0.35 0.34 0.00 1.00 0.00 0.00 64.86 65.75 8ica h ILE 69 Cb 0.74 0.95 -0.16 0.00 -0.74 0.00 0.00 36.82 37.62 8ica h ILE 69 CO 0.13 0.08 0.52 0.00 0.00 0.00 0.00 178.15 178.88 8ica h ALA 70 N 0.09 1.93 0.00 1.87 0.00 -1.51 1.96 119.26 123.60 8ica h ALA 70 Ca -0.04 0.22 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 8ica h ALA 70 Cb 0.41 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 8ica h ALA 70 CO 0.06 -0.65 -0.35 1.49 0.00 0.00 0.00 179.25 179.80 8ica h GLU 71 N 0.23 0.00 0.02 0.00 4.81 -1.12 -1.66 114.58 116.86 8ica h GLU 71 Ca 0.74 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 59.71 8ica h GLU 71 Cb 1.75 0.00 0.02 0.00 0.63 0.00 0.00 28.75 31.15 8ica h GLU 71 CO -0.66 0.35 -1.03 0.87 -0.73 0.00 0.00 179.01 177.81 8ica h LYS 72 N 0.00 0.67 -0.65 1.92 1.57 0.31 -3.09 116.57 117.29 8ica h LYS 72 Ca -0.00 -0.74 0.13 0.00 -1.87 0.00 0.00 60.65 58.16 8ica h LYS 72 Cb 0.67 0.22 -0.09 0.00 0.08 0.00 0.00 32.23 33.11 8ica h LYS 72 CO 0.05 1.32 0.15 0.82 -0.57 0.00 0.00 179.45 181.22 8ica h ILE 73 N 0.33 0.60 0.45 1.86 2.04 -0.27 0.40 117.51 122.92 8ica h ILE 73 Ca -0.13 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 8ica h ILE 73 Cb 1.70 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 8ica h ILE 73 CO 0.20 0.05 -0.51 0.44 0.00 0.00 0.00 178.15 178.33 8ica h ASP 74 N 0.27 -1.41 -0.83 1.72 3.32 -1.29 0.59 116.42 118.79 8ica h ASP 74 Ca 0.35 0.12 0.13 0.00 0.02 0.00 0.00 57.03 57.65 8ica h ASP 74 Cb 0.55 0.47 -0.09 0.00 0.22 0.00 0.00 39.33 40.48 8ica h ASP 74 CO -0.44 -0.65 0.44 -0.08 -1.72 0.00 0.00 179.24 176.79 8ica h GLU 75 N -0.97 0.64 -0.39 3.56 4.81 -1.36 1.10 114.58 121.97 8ica h GLU 75 Ca -0.06 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.01 8ica h GLU 75 Cb 0.86 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 8ica h GLU 75 CO -0.09 0.42 -0.24 0.35 -0.73 0.00 0.00 179.01 178.72 8ica h PHE 76 N 0.66 0.92 0.20 0.92 3.04 -0.57 0.01 116.94 122.11 8ica h PHE 76 Ca 0.44 -0.22 -0.01 0.00 3.98 0.00 0.00 57.97 62.16 8ica h PHE 76 Cb 0.56 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 38.86 8ica h PHE 76 CO -0.09 0.96 -0.10 -0.07 -2.02 0.00 0.00 178.31 177.00 8ica h LEU 77 N 0.69 -0.23 -0.13 0.59 4.07 0.54 -3.32 115.31 117.52 8ica h LEU 77 Ca 0.09 -0.26 0.02 0.00 0.08 0.00 0.00 57.88 57.81 8ica h LEU 77 Cb 0.77 0.06 -0.04 0.00 1.08 0.00 0.00 40.66 42.53 8ica h LEU 77 CO 0.06 0.18 -0.28 0.00 -1.08 0.00 0.00 178.44 177.32 8ica h ALA 78 N -0.00 -0.62 -3.18 1.53 0.00 0.10 -3.39 119.26 113.70 8ica h ALA 78 Ca -0.03 -0.02 -0.63 0.00 0.00 0.00 0.00 54.91 54.23 8ica h ALA 78 Cb 0.48 0.86 -0.19 0.00 0.00 0.00 0.00 17.79 18.93 8ica h ALA 78 CO 0.04 -0.73 -0.60 0.95 0.00 0.00 0.00 179.25 178.91 8ica s THR 79 N -4.38 4.46 -0.11 0.00 -4.23 -0.02 -4.97 115.64 106.40 8ica s THR 79 Ca -0.08 -0.14 0.00 0.00 -1.18 0.00 0.00 61.69 60.29 8ica s THR 79 Cb 0.04 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 70.86 8ica s THR 79 CO 0.31 0.43 0.00 0.61 -0.54 0.00 0.00 174.62 175.43 8ica n GLY 80 N 3.96 0.00 0.00 3.99 0.00 -1.25 -4.18 105.19 107.71 8ica n GLY 80 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 8ica n GLY 80 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 8ica n LYS 81 N 0.82 0.10 -3.56 1.61 4.76 -1.26 -5.06 118.16 115.58 8ica n LYS 81 Ca 0.00 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.45 8ica n LYS 81 Cb 0.00 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.13 8ica n LYS 81 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 8ica s LEU 82 N 0.00 -0.28 0.07 -0.35 2.96 -1.26 -3.67 118.68 116.14 8ica s LEU 82 Ca 0.00 0.43 -0.36 0.00 -0.22 0.00 0.00 54.13 53.97 8ica s LEU 82 Cb 0.00 1.38 -0.20 0.00 0.50 0.00 0.00 46.19 47.87 8ica s LEU 82 CO 0.00 -0.07 1.59 -0.09 -1.32 0.00 0.00 176.35 176.46 8ica h ARG 83 N 6.00 -1.15 -1.07 1.98 2.43 -1.99 -1.00 114.38 119.59 8ica h ARG 83 Ca -0.24 0.08 0.29 0.00 -0.81 0.00 0.00 59.98 59.30 8ica h ARG 83 Cb 1.16 0.26 -0.08 0.00 -0.42 0.00 0.00 29.97 30.89 8ica h ARG 83 CO 0.18 -0.76 0.71 -0.22 -1.51 0.00 0.00 179.97 178.37 8ica h LYS 84 N -1.19 0.26 -0.08 0.20 3.64 -1.98 1.71 116.57 119.12 8ica h LYS 84 Ca -0.12 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.10 8ica h LYS 84 Cb 0.92 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 8ica h LYS 84 CO 0.18 0.17 -0.58 1.25 -2.27 0.00 0.00 179.45 178.19 8ica h LEU 85 N 0.27 0.30 0.24 5.20 5.85 -1.88 -1.21 115.31 124.08 8ica h LEU 85 Ca 0.58 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 59.12 8ica h LEU 85 Cb 1.72 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.67 8ica h LEU 85 CO -0.21 0.82 -0.12 1.05 -0.34 0.00 0.00 178.44 179.64 8ica h GLU 86 N 0.20 -0.32 -0.28 1.25 4.11 0.37 -2.50 114.58 117.41 8ica h GLU 86 Ca -0.00 0.02 0.05 0.00 0.07 0.00 0.00 59.36 59.49 8ica h GLU 86 Cb 1.08 0.07 -0.08 0.00 0.50 0.00 0.00 28.75 30.33 8ica h GLU 86 CO 0.09 0.05 -0.52 -0.22 0.07 0.00 0.00 179.01 178.48 8ica h LYS 87 N -0.84 -0.45 -0.72 1.06 3.64 -0.23 -1.85 116.57 117.18 8ica h LYS 87 Ca -0.03 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.48 8ica h LYS 87 Cb 0.51 0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 32.36 8ica h LYS 87 CO 0.06 -0.30 0.35 0.82 -2.27 0.00 0.00 179.45 178.11 8ica h ILE 88 N -0.47 0.82 -0.33 2.00 2.04 -1.31 0.15 117.51 120.42 8ica h ILE 88 Ca 0.07 -0.20 0.03 0.00 1.00 0.00 0.00 64.86 65.75 8ica h ILE 88 Cb 0.63 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 8ica h ILE 88 CO -0.51 0.11 0.22 -0.09 0.00 0.00 0.00 178.15 177.87 8ica h ARG 89 N 0.59 0.33 0.09 2.37 1.12 -1.03 -2.59 114.38 115.25 8ica h ARG 89 Ca 0.36 -0.02 -0.17 0.00 -1.11 0.00 0.00 59.98 59.04 8ica h ARG 89 Cb 0.41 -0.08 0.01 0.00 -0.01 0.00 0.00 29.97 30.30 8ica h ARG 89 CO -0.29 0.22 -0.80 1.96 -3.11 0.00 0.00 179.97 177.95 8ica h GLN 90 N 0.34 0.19 -5.20 0.20 4.20 -0.36 -3.47 115.11 111.02 8ica h GLN 90 Ca 0.13 -0.32 -0.65 0.00 0.06 0.00 0.00 58.65 57.86 8ica h GLN 90 Cb 0.11 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 8ica h GLN 90 CO -0.03 1.15 1.20 -3.47 -0.67 0.00 0.00 178.83 177.02 8ica n ASP 91 N -4.22 0.62 0.10 1.46 2.03 0.39 -4.82 116.55 112.11 8ica n ASP 91 Ca -0.17 0.55 -0.16 0.00 0.52 0.00 0.00 54.79 55.53 8ica n ASP 91 Cb 0.75 -0.79 -0.10 0.00 -0.72 0.00 0.00 41.12 40.26 8ica n ASP 91 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 8ica h ASP 92 N 8.20 -1.59 -0.60 1.67 1.82 -1.90 1.71 116.42 125.72 8ica h ASP 92 Ca -0.08 0.17 0.11 0.00 -0.39 0.00 0.00 57.03 56.84 8ica h ASP 92 Cb 1.24 0.59 -0.09 0.00 0.68 0.00 0.00 39.33 41.76 8ica h ASP 92 CO 0.99 -0.54 0.13 0.74 -1.61 0.00 0.00 179.24 178.95 8ica h THR 93 N -0.73 0.64 -0.25 2.25 2.02 -1.96 1.00 112.91 115.88 8ica h THR 93 Ca -0.00 -0.09 -0.15 0.00 0.77 0.00 0.00 66.41 66.94 8ica h THR 93 Cb 0.74 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 8ica h THR 93 CO -0.30 0.05 -0.45 -1.28 0.37 0.00 0.00 175.52 173.90 8ica h SER 94 N 0.27 0.69 -1.00 4.18 0.87 -1.69 -2.82 113.55 114.04 8ica h SER 94 Ca 0.32 -0.33 0.05 0.00 -1.23 0.00 0.00 61.79 60.59 8ica h SER 94 Cb 0.47 -0.20 -0.06 0.00 -0.44 0.00 0.00 62.40 62.17 8ica h SER 94 CO -0.40 1.04 0.65 0.28 -0.53 0.00 0.00 176.83 177.88 8ica h SER 95 N 0.51 1.08 -0.23 6.23 0.02 0.48 -2.51 113.55 119.13 8ica h SER 95 Ca 0.03 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 8ica h SER 95 Cb 0.99 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 8ica h SER 95 CO 0.09 0.72 0.13 0.28 -1.14 0.00 0.00 176.83 176.91 8ica h SER 96 N 1.24 0.28 -0.41 3.07 0.02 -0.89 -2.79 113.55 114.06 8ica h SER 96 Ca 0.41 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.29 8ica h SER 96 Cb 0.06 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 8ica h SER 96 CO -0.14 0.25 0.19 0.40 -1.14 0.00 0.00 176.83 176.39 8ica h ILE 97 N 0.27 1.18 -0.98 3.27 2.04 -1.28 -1.32 117.51 120.69 8ica h ILE 97 Ca 0.08 -0.53 0.20 0.00 1.00 0.00 0.00 64.86 65.61 8ica h ILE 97 Cb 0.03 0.77 -0.09 0.00 -0.74 0.00 0.00 36.82 36.79 8ica h ILE 97 CO -0.01 0.20 0.61 0.78 0.00 0.00 0.00 178.15 179.73 8ica h ASN 98 N 0.52 0.67 0.11 1.72 -0.26 -1.24 -3.11 115.58 113.99 8ica h ASN 98 Ca 0.14 0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 55.95 8ica h ASN 98 Cb 0.14 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.36 8ica h ASN 98 CO -0.02 0.24 -0.05 0.15 -1.06 0.00 0.00 177.43 176.69 8ica h PHE 99 N 0.65 -0.14 -0.98 1.19 3.57 -1.24 -3.38 116.94 116.61 8ica h PHE 99 Ca 0.55 -0.00 0.21 0.00 3.53 0.00 0.00 57.97 62.26 8ica h PHE 99 Cb 1.00 0.04 -0.09 0.00 2.79 0.00 0.00 35.95 39.70 8ica h PHE 99 CO -0.00 0.19 0.62 -0.07 -2.23 0.00 0.00 178.31 176.82 8ica h LEU 100 N -0.99 0.56 -1.99 0.59 4.07 -1.22 0.19 115.31 116.52 8ica h LEU 100 Ca -0.01 0.07 0.09 0.00 0.08 0.00 0.00 57.88 58.11 8ica h LEU 100 Cb 0.39 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 8ica h LEU 100 CO 0.02 0.19 0.41 0.74 -1.08 0.00 0.00 178.44 178.72 8ica h THR 101 N 0.53 0.31 0.00 0.22 2.02 -1.72 -0.96 112.91 113.31 8ica h THR 101 Ca 0.54 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.72 8ica h THR 101 Cb 1.16 0.66 -0.00 0.00 -1.74 0.00 0.00 68.15 68.23 8ica h THR 101 CO -0.28 0.00 -0.00 0.03 0.37 0.00 0.00 175.52 175.64 8ica h ARG 102 N 0.00 0.00 -6.64 6.66 3.08 -0.81 -3.41 114.38 113.26 8ica h ARG 102 Ca 0.15 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.67 8ica h ARG 102 Cb 0.96 0.00 0.03 0.00 0.08 0.00 0.00 29.97 31.04 8ica h ARG 102 CO -0.00 0.00 0.63 0.08 -1.07 0.00 0.00 179.97 179.61 8ica s VAL 103 N -3.81 3.39 0.02 2.04 1.01 -0.37 -4.92 120.40 117.77 8ica s VAL 103 Ca -0.01 1.11 -0.30 0.00 0.00 0.00 0.00 61.98 62.78 8ica s VAL 103 Cb 0.10 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.71 8ica s VAL 103 CO 0.50 0.15 1.46 -0.55 0.00 0.00 0.00 175.10 176.67 8ica s SER 104 N 0.46 6.79 0.00 3.32 0.15 -1.26 -1.61 113.70 121.55 8ica s SER 104 Ca 0.57 2.21 0.00 0.00 0.70 0.00 0.00 55.95 59.43 8ica s SER 104 Cb -0.35 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.40 8ica s SER 104 CO 0.36 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.65 8ica n GLY 105 N 3.72 0.50 3.43 9.45 0.00 -1.26 -3.91 105.19 117.11 8ica n GLY 105 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 8ica n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 8ica s ILE 106 N -2.00 4.80 0.47 -0.61 1.01 -0.63 -4.74 121.20 119.49 8ica s ILE 106 Ca 0.00 -0.64 0.04 0.00 0.00 0.00 0.00 60.65 60.06 8ica s ILE 106 Cb 0.00 -3.60 0.08 0.00 0.01 0.00 0.00 42.46 38.96 8ica s ILE 106 CO 0.00 -0.15 0.65 0.61 0.00 0.00 0.00 174.94 176.05 8ica n GLY 107 N 5.04 1.48 0.24 6.18 0.00 -1.26 -4.39 105.19 112.48 8ica n GLY 107 Ca -0.12 -2.13 -0.08 0.00 0.00 0.00 0.00 46.02 43.69 8ica n GLY 107 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 8ica h PRO 108 N 0.00 0.78 -0.22 1.61 0.10 -1.94 -0.58 132.00 131.75 8ica h PRO 108 Ca -0.22 -0.13 0.06 0.00 0.10 0.00 0.00 66.00 65.81 8ica h PRO 108 Cb 0.92 -0.13 -0.06 0.00 0.10 0.00 0.00 31.00 31.82 8ica h PRO 108 CO 0.28 0.67 -0.19 1.03 0.10 0.00 0.00 178.00 179.88 8ica h SER 109 N 0.71 -0.62 0.06 -2.05 0.87 -1.95 0.28 113.55 110.85 8ica h SER 109 Ca 0.18 0.12 -0.12 0.00 -1.23 0.00 0.00 61.79 60.73 8ica h SER 109 Cb 0.16 0.30 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 8ica h SER 109 CO -0.02 -0.24 -0.41 0.00 -0.53 0.00 0.00 176.83 175.64 8ica h ALA 110 N 0.89 0.94 -0.59 6.23 0.00 -1.94 -2.48 119.26 122.31 8ica h ALA 110 Ca 0.13 -0.43 0.04 0.00 0.00 0.00 0.00 54.91 54.64 8ica h ALA 110 Cb 0.40 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 8ica h ALA 110 CO -0.34 0.63 0.39 0.00 0.00 0.00 0.00 179.25 179.93 8ica h ALA 111 N 1.19 1.71 -0.06 0.00 0.00 0.66 0.03 119.26 122.79 8ica h ALA 111 Ca 0.03 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 8ica h ALA 111 Cb 0.88 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.48 8ica h ALA 111 CO 0.07 0.22 -0.33 0.00 0.00 0.00 0.00 179.25 179.21 8ica h ARG 112 N 0.68 0.33 -0.93 0.00 3.08 -0.18 -3.05 114.38 114.31 8ica h ARG 112 Ca 0.24 -0.28 0.14 0.00 0.07 0.00 0.00 59.98 60.15 8ica h ARG 112 Cb 0.11 0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.13 8ica h ARG 112 CO -0.07 0.93 0.54 -0.22 -1.07 0.00 0.00 179.97 180.08 8ica h LYS 113 N -0.18 0.78 -0.37 0.04 3.64 -0.99 0.28 116.57 119.77 8ica h LYS 113 Ca -0.03 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 8ica h LYS 113 Cb 1.00 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.63 8ica h LYS 113 CO 0.07 0.52 0.10 0.74 -2.27 0.00 0.00 179.45 178.60 8ica h PHE 114 N 0.81 0.61 -0.56 1.91 0.04 -1.04 -2.26 116.94 116.45 8ica h PHE 114 Ca 0.49 -0.07 -0.00 0.00 2.80 0.00 0.00 57.97 61.18 8ica h PHE 114 Cb 0.60 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 38.54 8ica h PHE 114 CO -0.04 0.60 0.34 0.28 -0.60 0.00 0.00 178.31 178.90 8ica h VAL 115 N 0.44 1.16 0.54 -0.55 2.07 -1.27 2.11 116.25 120.76 8ica h VAL 115 Ca 0.12 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 8ica h VAL 115 Cb 0.29 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 8ica h VAL 115 CO 0.00 0.16 -0.48 0.44 0.02 0.00 0.00 177.57 177.72 8ica h ASP 116 N 0.75 -1.29 0.00 0.57 3.32 -0.30 0.44 116.42 119.91 8ica h ASP 116 Ca 0.20 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.35 8ica h ASP 116 Cb -0.03 0.42 0.00 0.00 0.22 0.00 0.00 39.33 39.93 8ica h ASP 116 CO -0.04 -0.65 0.17 -0.33 -1.72 0.00 0.00 179.24 176.67 8ica h GLU 117 N -1.00 0.00 0.00 3.56 5.08 -1.18 -3.45 114.58 117.59 8ica h GLU 117 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 8ica h GLU 117 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 8ica h GLU 117 CO -0.02 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.40 8ica n GLY 118 N -1.16 1.99 3.38 -3.84 0.00 0.15 -5.04 105.19 100.68 8ica n GLY 118 Ca -0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.54 8ica n GLY 118 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 8ica s ILE 119 N -2.00 5.48 -0.13 -0.61 -1.09 0.69 -4.78 121.20 118.75 8ica s ILE 119 Ca 0.00 -2.65 -0.13 0.00 -2.23 0.00 0.00 60.65 55.64 8ica s ILE 119 Cb 0.00 -4.65 -0.26 0.00 -1.58 0.00 0.00 42.46 35.97 8ica s ILE 119 CO 0.00 -1.28 0.42 0.11 -1.23 0.00 0.00 174.94 172.96 8ica h LYS 120 N 7.49 0.22 -6.43 2.79 1.57 -1.87 -3.34 116.57 116.99 8ica h LYS 120 Ca 0.18 -0.38 -0.42 0.00 -1.87 0.00 0.00 60.65 58.16 8ica h LYS 120 Cb 0.95 0.14 0.02 0.00 0.08 0.00 0.00 32.23 33.42 8ica h LYS 120 CO 0.99 1.18 -0.27 -0.08 -0.57 0.00 0.00 179.45 180.71 8ica s THR 121 N -2.50 3.17 0.30 -0.16 -1.32 -1.26 -4.76 115.64 109.12 8ica s THR 121 Ca -0.22 -0.99 -0.01 0.00 -1.21 0.00 0.00 61.69 59.25 8ica s THR 121 Cb 0.06 -3.07 0.27 0.00 -1.51 0.00 0.00 72.50 68.24 8ica s THR 121 CO 0.74 -0.03 1.96 0.25 -2.21 0.00 0.00 174.62 175.33 8ica h LEU 122 N 0.67 0.93 -0.62 9.08 6.46 -1.98 0.20 115.31 130.04 8ica h LEU 122 Ca -0.41 -0.02 -0.15 0.00 -0.12 0.00 0.00 57.88 57.19 8ica h LEU 122 Cb 1.28 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.97 8ica h LEU 122 CO 0.46 0.66 -0.51 -0.33 -0.62 0.00 0.00 178.44 178.11 8ica h GLU 123 N 1.09 0.47 -0.67 1.25 5.08 -1.99 -1.48 114.58 118.33 8ica h GLU 123 Ca 0.32 -0.28 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 8ica h GLU 123 Cb -0.05 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 8ica h GLU 123 CO -0.08 0.87 0.41 -0.44 -1.00 0.00 0.00 179.01 178.76 8ica h ASP 124 N 0.37 0.66 -0.76 1.42 5.19 -1.16 0.37 116.42 122.50 8ica h ASP 124 Ca 0.01 0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.44 8ica h ASP 124 Cb 1.02 -0.13 -0.04 0.00 0.18 0.00 0.00 39.33 40.36 8ica h ASP 124 CO 0.09 0.45 0.50 -0.07 -3.12 0.00 0.00 179.24 177.09 8ica h LEU 125 N 0.79 0.88 0.45 1.55 3.38 -0.33 -2.12 115.31 119.92 8ica h LEU 125 Ca 0.27 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 8ica h LEU 125 Cb 0.05 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.59 8ica h LEU 125 CO -0.12 0.65 -0.21 0.03 0.09 0.00 0.00 178.44 178.87 8ica h ARG 126 N 1.04 -0.58 -0.04 1.13 3.08 0.75 -2.54 114.38 117.21 8ica h ARG 126 Ca 0.28 0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.38 8ica h ARG 126 Cb -0.11 0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 8ica h ARG 126 CO -0.06 -0.34 0.04 0.87 -1.07 0.00 0.00 179.97 179.42 8ica h LYS 127 N -0.69 0.00 -0.73 0.04 1.79 -1.20 -1.49 116.57 114.29 8ica h LYS 127 Ca -0.06 0.00 -0.38 0.00 -2.18 0.00 0.00 60.65 58.03 8ica h LYS 127 Cb 0.51 0.00 -0.23 0.00 -1.58 0.00 0.00 32.23 30.93 8ica h LYS 127 CO 0.10 0.00 0.34 0.09 -1.08 0.00 0.00 179.45 178.90 8ica n ASN 128 N -3.95 3.28 -0.23 0.86 5.03 -0.80 -4.72 115.26 114.72 8ica n ASN 128 Ca -0.02 -3.70 0.32 0.00 0.87 0.00 0.00 54.58 52.05 8ica n ASN 128 Cb 0.14 -0.76 0.67 0.00 -1.02 0.00 0.00 39.78 38.81 8ica n ASN 128 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.26 175.35 8ica h GLU 129 N 1.03 0.00 -0.12 3.52 4.81 -0.86 -0.65 114.58 122.30 8ica h GLU 129 Ca 0.46 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.63 8ica h GLU 129 Cb 2.33 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.69 8ica h GLU 129 CO 0.82 0.00 -0.23 0.38 -0.73 0.00 0.00 179.01 179.25 8ica h ASP 130 N 0.00 0.20 0.96 1.04 2.03 -1.87 -2.77 116.42 116.01 8ica h ASP 130 Ca 0.50 -0.05 0.00 0.00 -0.73 0.00 0.00 57.03 56.74 8ica h ASP 130 Cb 2.37 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 40.82 8ica h ASP 130 CO -0.01 0.44 0.00 0.29 -1.03 0.00 0.00 179.24 178.93 8ica n LYS 131 N -4.19 0.01 -3.45 4.15 5.02 -0.25 -4.80 118.16 114.64 8ica n LYS 131 Ca -0.01 0.01 -0.35 0.00 -2.02 0.00 0.00 58.31 55.94 8ica n LYS 131 Cb 0.34 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.79 8ica n LYS 131 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 8ica s LEU 132 N -2.99 4.34 0.39 -0.35 1.43 -1.05 -5.10 118.68 115.35 8ica s LEU 132 Ca 0.14 0.95 0.05 0.00 -1.03 0.00 0.00 54.13 54.24 8ica s LEU 132 Cb 0.18 -3.15 -0.00 0.00 0.03 0.00 0.00 46.19 43.25 8ica s LEU 132 CO 0.51 0.13 0.55 0.54 0.23 0.00 0.00 176.35 178.32 8ica s ASN 133 N -1.75 5.86 0.28 2.29 4.22 -1.26 -4.86 114.94 119.72 8ica s ASN 133 Ca 0.36 -0.07 -0.04 0.00 -2.14 0.00 0.00 52.86 50.97 8ica s ASN 133 Cb -0.14 -1.23 0.57 0.00 1.28 0.00 0.00 41.25 41.72 8ica s ASN 133 CO 0.19 -0.58 1.58 -0.74 -2.04 0.00 0.00 177.10 175.50 8ica h HIS 134 N 0.68 -0.26 0.25 1.54 -0.00 -1.98 -1.06 115.15 114.32 8ica h HIS 134 Ca -0.45 0.08 0.00 0.00 -0.00 0.00 0.00 60.37 60.00 8ica h HIS 134 Cb 1.26 0.27 -0.04 0.00 -0.00 0.00 0.00 27.41 28.90 8ica h HIS 134 CO 0.43 -0.40 -0.49 1.25 -0.00 0.00 0.00 177.93 178.71 8ica h HIS 135 N 0.02 -1.40 0.00 5.26 6.17 -1.92 -0.53 115.15 122.74 8ica h HIS 135 Ca 0.51 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.62 8ica h HIS 135 Cb 0.92 0.58 0.00 0.00 2.52 0.00 0.00 27.41 31.43 8ica h HIS 135 CO -0.60 -0.59 0.00 1.96 0.71 0.00 0.00 177.93 179.41 8ica h GLN 136 N -0.80 0.00 0.06 5.26 4.20 -1.53 0.47 115.11 122.78 8ica h GLN 136 Ca -0.03 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.58 8ica h GLN 136 Cb 0.76 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.54 8ica h GLN 136 CO -0.19 0.00 -0.48 0.00 -0.67 0.00 0.00 178.83 177.49 8ica h ARG 137 N 0.00 0.14 -0.25 1.46 3.08 -0.38 -1.39 114.38 117.04 8ica h ARG 137 Ca 0.00 -0.23 -0.12 0.00 0.07 0.00 0.00 59.98 59.69 8ica h ARG 137 Cb 0.12 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 8ica h ARG 137 CO 0.00 1.11 -0.36 0.82 -1.07 0.00 0.00 179.97 180.47 8ica h ILE 138 N -0.70 1.29 -0.09 2.04 2.04 -0.04 -0.39 117.51 121.67 8ica h ILE 138 Ca -0.09 -1.50 0.04 0.00 1.00 0.00 0.00 64.86 64.30 8ica h ILE 138 Cb 1.32 1.50 -0.05 0.00 -0.74 0.00 0.00 36.82 38.85 8ica h ILE 138 CO 0.05 0.48 -0.23 1.23 0.00 0.00 0.00 178.15 179.68 8ica h GLY 139 N 1.05 -0.26 1.01 5.37 0.00 -0.11 0.22 103.07 110.36 8ica h GLY 139 Ca 0.05 0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.65 8ica h GLY 139 CO 0.07 -0.19 0.58 -2.00 0.00 0.00 0.00 176.54 175.00 8ica h LEU 140 N -0.31 1.07 0.29 3.11 5.85 -1.07 -2.16 115.31 122.09 8ica h LEU 140 Ca 0.09 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 8ica h LEU 140 Cb 0.44 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.20 8ica h LEU 140 CO -0.26 0.80 -0.14 0.50 -0.34 0.00 0.00 178.44 178.99 8ica h LYS 141 N 1.24 -0.38 -0.91 1.25 3.64 -0.25 -3.11 116.57 118.05 8ica h LYS 141 Ca 0.33 0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.54 8ica h LYS 141 Cb -0.10 0.09 -0.12 0.00 -0.41 0.00 0.00 32.23 31.68 8ica h LYS 141 CO -0.07 -0.19 0.25 0.66 -2.27 0.00 0.00 179.45 177.84 8ica n TYR 142 N -5.22 1.62 -0.30 1.91 4.01 -0.01 -4.60 117.16 114.57 8ica n TYR 142 Ca -0.10 -0.99 0.12 0.00 -0.16 0.00 0.00 57.90 56.77 8ica n TYR 142 Cb 0.20 -0.55 0.27 0.00 -0.31 0.00 0.00 39.34 38.96 8ica n TYR 142 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 8ica h PHE 143 N 1.22 0.18 0.00 -0.72 3.04 -1.32 0.33 116.94 119.67 8ica h PHE 143 Ca 0.25 0.06 0.00 0.00 3.98 0.00 0.00 57.97 62.25 8ica h PHE 143 Cb 1.86 0.06 0.00 0.00 2.56 0.00 0.00 35.95 40.43 8ica h PHE 143 CO 0.84 -0.28 0.00 0.41 -2.02 0.00 0.00 178.31 177.26 8ica n GLY 144 N -1.41 -1.70 0.34 2.40 0.00 -1.26 -3.02 105.19 100.54 8ica n GLY 144 Ca 0.21 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.31 8ica n GLY 144 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 8ica h ASP 145 N 0.00 0.00 0.70 1.61 5.19 -1.76 0.53 116.42 122.69 8ica h ASP 145 Ca 0.00 0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 56.15 8ica h ASP 145 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 8ica h ASP 145 CO 0.00 0.00 -1.26 -0.26 -3.12 0.00 0.00 179.24 174.60 8ica h PHE 146 N 0.00 0.29 0.00 4.55 0.04 -0.29 -3.26 116.94 118.27 8ica h PHE 146 Ca 0.03 -0.21 0.00 0.00 2.80 0.00 0.00 57.97 60.58 8ica h PHE 146 Cb 1.41 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.55 8ica h PHE 146 CO 0.00 1.19 0.00 0.39 -0.60 0.00 0.00 178.31 179.29 8ica n GLU 147 N -3.42 0.11 -3.01 1.51 1.02 0.17 -4.84 120.64 112.17 8ica n GLU 147 Ca -0.08 0.25 -0.40 0.00 -0.02 0.00 0.00 57.16 56.91 8ica n GLU 147 Cb 1.00 -1.67 -0.05 0.00 -0.02 0.00 0.00 31.44 30.70 8ica n GLU 147 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 8ica s LYS 148 N -3.12 4.49 0.44 3.49 1.02 -1.21 -5.09 119.74 119.77 8ica s LYS 148 Ca 0.08 1.06 -0.23 0.00 0.02 0.00 0.00 55.97 56.91 8ica s LYS 148 Cb 0.12 -3.31 -0.08 0.00 -0.52 0.00 0.00 37.83 34.03 8ica s LYS 148 CO 0.42 0.42 1.09 1.03 -0.92 0.00 0.00 175.35 177.39 8ica s ARG 149 N -0.55 3.92 -0.49 1.68 1.81 -1.26 -4.92 118.95 119.13 8ica s ARG 149 Ca 0.36 1.58 -0.19 0.00 -1.72 0.00 0.00 55.73 55.76 8ica s ARG 149 Cb -0.21 -2.38 0.05 0.00 -0.45 0.00 0.00 34.95 31.95 8ica s ARG 149 CO 0.24 -0.37 0.61 0.42 -0.68 0.00 0.00 175.30 175.51 8ica s ILE 150 N -1.69 4.89 0.24 1.52 1.01 1.05 -4.88 121.20 123.35 8ica s ILE 150 Ca 0.62 -0.40 -0.31 0.00 0.00 0.00 0.00 60.65 60.56 8ica s ILE 150 Cb -0.23 -4.26 -0.13 0.00 0.01 0.00 0.00 42.46 37.84 8ica s ILE 150 CO 0.28 -0.74 1.41 -2.65 0.00 0.00 0.00 174.94 173.24 8ica n PRO 151 N 6.12 2.05 -0.22 2.79 -0.02 -1.26 -0.36 135.00 144.10 8ica n PRO 151 Ca -0.06 0.73 0.02 0.00 -2.02 0.00 0.00 63.50 62.17 8ica n PRO 151 Cb 0.46 -2.38 0.13 0.00 -0.02 0.00 0.00 33.50 31.69 8ica n PRO 151 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 8ica h ARG 152 N 4.15 0.38 -1.33 -0.52 2.43 -1.66 0.26 114.38 118.09 8ica h ARG 152 Ca -0.45 -0.02 0.42 0.00 -0.81 0.00 0.00 59.98 59.11 8ica h ARG 152 Cb 1.28 -0.09 -0.11 0.00 -0.42 0.00 0.00 29.97 30.63 8ica h ARG 152 CO 0.75 0.25 0.88 0.93 -1.51 0.00 0.00 179.97 181.27 8ica h GLU 153 N 0.40 0.11 0.07 0.20 4.39 -1.89 0.92 114.58 118.79 8ica h GLU 153 Ca 0.35 -0.01 -0.35 0.00 0.34 0.00 0.00 59.36 59.69 8ica h GLU 153 Cb 0.48 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 8ica h GLU 153 CO -0.36 0.07 -1.99 0.39 -1.16 0.00 0.00 179.01 175.97 8ica n GLU 154 N -4.57 0.71 -0.31 2.33 1.02 0.59 -3.82 120.64 116.59 8ica n GLU 154 Ca 0.35 0.25 0.04 0.00 -0.02 0.00 0.00 57.16 57.78 8ica n GLU 154 Cb 1.39 -1.70 0.19 0.00 -0.02 0.00 0.00 31.44 31.30 8ica n GLU 154 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 8ica h MET 155 N 0.04 0.80 -0.66 3.49 2.86 0.36 0.10 114.93 121.92 8ica h MET 155 Ca -0.41 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.10 8ica h MET 155 Cb 2.03 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 33.48 8ica h MET 155 CO 0.07 0.53 0.07 -0.07 1.06 0.00 0.00 176.91 178.56 8ica h LEU 156 N 0.82 1.07 -0.30 1.22 3.38 -0.41 0.30 115.31 121.40 8ica h LEU 156 Ca 0.43 -0.28 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 8ica h LEU 156 Cb 0.43 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 8ica h LEU 156 CO -0.27 1.08 -0.23 0.06 0.09 0.00 0.00 178.44 179.17 8ica h GLN 157 N 1.03 0.69 0.41 1.13 3.07 -1.34 -1.90 115.11 118.20 8ica h GLN 157 Ca 0.19 -0.34 -0.02 0.00 0.09 0.00 0.00 58.65 58.57 8ica h GLN 157 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.05 8ica h GLN 157 CO 0.02 0.95 -0.20 0.52 0.09 0.00 0.00 178.83 180.21 8ica h MET 158 N 0.44 -0.54 -0.86 0.06 2.86 -0.94 -2.37 114.93 113.59 8ica h MET 158 Ca 0.06 0.04 0.17 0.00 -2.06 0.00 0.00 59.70 57.90 8ica h MET 158 Cb 0.79 0.12 -0.10 0.00 0.06 0.00 0.00 31.60 32.47 8ica h MET 158 CO 0.06 -0.32 0.41 0.37 1.06 0.00 0.00 176.91 178.50 8ica h GLN 159 N -0.63 0.52 0.03 1.72 4.15 -1.00 0.31 115.11 120.21 8ica h GLN 159 Ca -0.06 -0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.36 8ica h GLN 159 Cb 0.47 -0.12 -0.05 0.00 0.21 0.00 0.00 27.48 27.99 8ica h GLN 159 CO 0.09 0.34 -0.34 0.22 -1.93 0.00 0.00 178.83 177.22 8ica h ASP 160 N 0.53 -1.01 -0.27 -0.69 3.58 -1.05 -2.02 116.42 115.50 8ica h ASP 160 Ca 0.49 0.13 -0.01 0.00 0.42 0.00 0.00 57.03 58.06 8ica h ASP 160 Cb 0.79 0.40 -0.01 0.00 1.72 0.00 0.00 39.33 42.22 8ica h ASP 160 CO -0.42 -0.41 0.14 0.40 -2.88 0.00 0.00 179.24 176.07 8ica h ILE 161 N -0.51 1.14 -0.60 2.25 2.04 -0.57 -2.86 117.51 118.40 8ica h ILE 161 Ca 0.05 -0.38 0.08 0.00 1.00 0.00 0.00 64.86 65.61 8ica h ILE 161 Cb 0.58 0.90 -0.06 0.00 -0.74 0.00 0.00 36.82 37.50 8ica h ILE 161 CO -0.26 0.14 0.27 0.58 0.00 0.00 0.00 178.15 178.88 8ica h VAL 162 N 0.31 0.85 0.00 1.67 2.07 -0.81 0.11 116.25 120.45 8ica h VAL 162 Ca 0.09 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 8ica h VAL 162 Cb 0.10 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.19 8ica h VAL 162 CO -0.01 0.09 -0.01 -0.07 0.02 0.00 0.00 177.57 177.59 8ica h LEU 163 N 0.49 0.00 0.17 2.57 3.38 -1.25 -2.41 115.31 118.25 8ica h LEU 163 Ca 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 8ica h LEU 163 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 8ica h LEU 163 CO -0.25 0.01 -0.08 0.78 0.09 0.00 0.00 178.44 178.99 8ica h ASN 164 N 0.00 -0.19 -0.00 -0.43 2.35 -0.56 -2.68 115.58 114.07 8ica h ASN 164 Ca -0.00 -0.34 0.02 0.00 -0.55 0.00 0.00 56.30 55.42 8ica h ASN 164 Cb 0.01 0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 8ica h ASN 164 CO 0.00 0.31 -0.08 -0.33 -1.65 0.00 0.00 177.43 175.68 8ica h GLU 165 N -0.77 -0.14 -0.85 0.81 4.39 -1.27 0.75 114.58 117.50 8ica h GLU 165 Ca -0.02 0.01 0.18 0.00 0.34 0.00 0.00 59.36 59.87 8ica h GLU 165 Cb 0.52 0.03 -0.16 0.00 -0.10 0.00 0.00 28.75 29.04 8ica h GLU 165 CO 0.04 -0.09 -0.17 0.28 -1.16 0.00 0.00 179.01 177.91 8ica h VAL 166 N -0.14 0.16 -0.31 3.13 2.07 -1.54 0.89 116.25 120.50 8ica h VAL 166 Ca 0.03 -0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.41 8ica h VAL 166 Cb 0.19 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.10 8ica h VAL 166 CO -0.09 0.00 -0.36 0.50 0.02 0.00 0.00 177.57 177.65 8ica h LYS 167 N 0.01 0.80 -0.40 1.57 3.64 -1.05 -2.59 116.57 118.55 8ica h LYS 167 Ca 0.43 -0.44 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 8ica h LYS 167 Cb 0.69 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.50 8ica h LYS 167 CO -0.85 1.07 0.23 1.57 -2.27 0.00 0.00 179.45 179.19 8ica h LYS 168 N 0.57 0.45 0.75 1.90 2.10 0.68 -3.09 116.57 119.93 8ica h LYS 168 Ca 0.04 -0.03 -0.03 0.00 -2.00 0.00 0.00 60.65 58.64 8ica h LYS 168 Cb 0.94 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 32.17 8ica h LYS 168 CO 0.09 0.30 -0.50 -0.24 -2.00 0.00 0.00 179.45 177.10 8ica h VAL 169 N 0.46 0.01 -3.25 0.07 3.04 0.44 -3.43 116.25 113.60 8ica h VAL 169 Ca 0.16 0.00 -0.18 0.00 -1.01 0.00 0.00 66.70 65.67 8ica h VAL 169 Cb 0.02 0.01 -0.27 0.00 -2.01 0.00 0.00 31.29 29.05 8ica h VAL 169 CO -0.08 0.00 -0.49 -0.62 -1.01 0.00 0.00 177.57 175.37 8ica s ASP 170 N -4.20 -0.20 0.11 3.17 -1.08 -0.98 -5.01 116.67 108.47 8ica s ASP 170 Ca -0.19 0.39 0.27 0.00 -0.52 0.00 0.00 52.55 52.51 8ica s ASP 170 Cb 0.03 0.39 1.01 0.00 -1.46 0.00 0.00 42.92 42.90 8ica s ASP 170 CO 0.60 -0.08 1.84 -0.24 0.52 0.00 0.00 175.17 177.82 8ica n SER 171 N 3.09 0.41 0.18 -0.34 2.88 -1.18 -3.71 113.62 114.95 8ica n SER 171 Ca -0.14 0.54 0.05 0.00 -1.33 0.00 0.00 58.87 57.99 8ica n SER 171 Cb 0.58 -0.65 0.27 0.00 -0.75 0.00 0.00 64.21 63.66 8ica n SER 171 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 8ica h GLU 172 N 0.00 0.00 -6.82 -1.46 4.57 -1.89 -3.46 114.58 105.53 8ica h GLU 172 Ca 0.00 0.00 -0.56 0.00 -1.18 0.00 0.00 59.36 57.62 8ica h GLU 172 Cb 0.61 0.00 0.12 0.00 -0.16 0.00 0.00 28.75 29.32 8ica h GLU 172 CO 0.00 0.42 0.47 0.66 -1.18 0.00 0.00 179.01 179.38 8ica n TYR 173 N -3.48 2.06 -4.13 0.92 4.01 -1.24 -4.61 117.16 110.68 8ica n TYR 173 Ca 0.00 0.51 -0.34 0.00 -0.16 0.00 0.00 57.90 57.91 8ica n TYR 173 Cb 0.56 -2.36 -0.15 0.00 -0.31 0.00 0.00 39.34 37.08 8ica n TYR 173 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 8ica s ILE 174 N -1.20 2.82 0.04 -0.72 -1.09 -1.08 -4.89 121.20 115.08 8ica s ILE 174 Ca 0.61 -0.69 0.06 0.00 -2.23 0.00 0.00 60.65 58.40 8ica s ILE 174 Cb -0.51 -2.24 -0.02 0.00 -1.58 0.00 0.00 42.46 38.11 8ica s ILE 174 CO 0.58 0.48 -0.17 0.00 -1.23 0.00 0.00 174.94 174.59 8ica s ALA 175 N 1.23 1.47 -0.03 9.38 0.00 -1.26 -2.69 121.76 129.88 8ica s ALA 175 Ca 0.03 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.04 8ica s ALA 175 Cb -0.14 -0.26 0.02 0.00 0.00 0.00 0.00 23.12 22.74 8ica s ALA 175 CO -0.05 0.31 -0.01 0.99 0.00 0.00 0.00 175.76 177.00 8ica s THR 176 N -0.84 0.22 -0.35 0.00 2.01 -0.90 -4.97 115.64 110.81 8ica s THR 176 Ca 0.05 0.03 -0.21 0.00 0.31 0.00 0.00 61.69 61.86 8ica s THR 176 Cb -0.08 -0.28 0.00 0.00 0.01 0.00 0.00 72.50 72.14 8ica s THR 176 CO 0.02 0.14 0.66 -0.69 -0.69 0.00 0.00 174.62 174.05 8ica s VAL 177 N 0.80 4.87 0.00 3.82 1.01 -1.26 -0.66 120.40 128.98 8ica s VAL 177 Ca -0.08 0.66 0.00 0.00 0.00 0.00 0.00 61.98 62.56 8ica s VAL 177 Cb -0.11 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.18 8ica s VAL 177 CO -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 175.10 174.78 8ica n GLY 179 N 5.00 -1.30 0.32 0.00 0.00 -0.98 -3.76 105.19 104.47 8ica n GLY 179 Ca 0.00 -1.24 0.13 0.00 0.00 0.00 0.00 46.02 44.91 8ica n GLY 179 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 8ica h SER 180 N 0.00 0.42 -0.51 1.61 4.64 -1.86 0.91 113.55 118.76 8ica h SER 180 Ca 0.00 0.14 0.02 0.00 -0.47 0.00 0.00 61.79 61.48 8ica h SER 180 Cb 0.00 0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.15 8ica h SER 180 CO 0.00 0.05 0.31 0.15 -0.87 0.00 0.00 176.83 176.47 8ica h PHE 181 N 0.47 0.57 -0.67 4.77 3.57 -1.81 0.08 116.94 123.92 8ica h PHE 181 Ca 0.56 0.02 0.13 0.00 3.53 0.00 0.00 57.97 62.21 8ica h PHE 181 Cb 1.02 -0.18 -0.10 0.00 2.79 0.00 0.00 35.95 39.48 8ica h PHE 181 CO -0.11 0.33 0.17 -0.09 -2.23 0.00 0.00 178.31 176.38 8ica h ARG 182 N 0.61 0.28 -1.34 1.11 9.65 -0.92 -2.06 114.38 121.72 8ica h ARG 182 Ca 0.20 -0.02 -0.10 0.00 -1.10 0.00 0.00 59.98 58.97 8ica h ARG 182 Cb 0.01 -0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 28.48 8ica h ARG 182 CO -0.09 0.19 0.12 0.54 2.80 0.00 0.00 179.97 183.53 8ica n ARG 183 N -5.12 1.23 0.00 0.20 1.74 -0.50 -4.59 116.66 109.62 8ica n ARG 183 Ca 0.11 -0.51 0.00 0.00 -0.77 0.00 0.00 57.85 56.69 8ica n ARG 183 Cb 0.38 -1.20 0.00 0.00 -1.02 0.00 0.00 32.46 30.62 8ica n ARG 183 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 8ica n GLY 184 N 0.58 1.31 0.00 -0.13 0.00 -0.77 -4.55 105.19 101.63 8ica n GLY 184 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.09 8ica n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 8ica n ALA 185 N 0.00 -0.16 0.29 4.61 0.00 -0.10 -4.84 120.51 120.31 8ica n ALA 185 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 8ica n ALA 185 Cb 0.00 0.00 0.85 0.00 0.00 0.00 0.00 19.45 20.30 8ica n ALA 185 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 8ica h GLU 186 N 0.00 0.00 -2.31 0.00 4.39 -1.93 -3.42 114.58 111.31 8ica h GLU 186 Ca 0.00 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 8ica h GLU 186 Cb 0.00 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 28.45 8ica h GLU 186 CO 0.00 0.04 0.03 -1.54 -1.16 0.00 0.00 179.01 176.38 8ica s SER 187 N -5.65 -0.54 0.39 1.42 1.04 -1.26 -1.85 113.70 107.24 8ica s SER 187 Ca -0.02 0.70 0.05 0.00 0.48 0.00 0.00 55.95 57.17 8ica s SER 187 Cb 0.11 0.67 -0.06 0.00 0.10 0.00 0.00 66.02 66.83 8ica s SER 187 CO 0.52 -0.47 0.03 -0.44 0.98 0.00 0.00 173.24 173.86 8ica s SER 188 N -0.83 3.36 -0.17 7.02 0.01 0.52 -4.82 113.70 118.79 8ica s SER 188 Ca -0.09 -1.42 -0.04 0.00 1.31 0.00 0.00 55.95 55.71 8ica s SER 188 Cb -0.02 -0.15 -0.23 0.00 0.21 0.00 0.00 66.02 65.82 8ica s SER 188 CO 0.06 -0.57 0.17 0.61 0.41 0.00 0.00 173.24 173.92 8ica n GLY 189 N -0.91 -0.49 3.49 3.44 0.00 -1.26 0.34 105.19 109.81 8ica n GLY 189 Ca -0.06 -0.24 -0.11 0.00 0.00 0.00 0.00 46.02 45.61 8ica n GLY 189 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 8ica s ASP 190 N -6.87 -0.50 -0.15 1.61 -4.77 -1.26 -4.57 116.67 100.15 8ica s ASP 190 Ca -0.27 -0.08 -0.19 0.00 -3.30 0.00 0.00 52.55 48.71 8ica s ASP 190 Cb 0.07 0.59 -0.04 0.00 -1.09 0.00 0.00 42.92 42.46 8ica s ASP 190 CO 0.71 -0.98 0.55 -0.32 0.70 0.00 0.00 175.17 175.83 8ica s MET 191 N -3.69 4.29 -0.43 2.11 -2.45 -0.89 -5.02 119.30 113.22 8ica s MET 191 Ca 0.03 0.53 -0.06 0.00 -1.25 0.00 0.00 55.69 54.94 8ica s MET 191 Cb -0.02 -3.50 0.11 0.00 1.25 0.00 0.00 34.83 32.67 8ica s MET 191 CO -0.10 -0.02 0.25 -0.51 1.05 0.00 0.00 175.02 175.70 8ica s ASP 192 N 0.91 5.45 -0.32 1.11 1.11 -1.26 -1.94 116.67 121.74 8ica s ASP 192 Ca 0.27 -1.89 -0.16 0.00 0.18 0.00 0.00 52.55 50.96 8ica s ASP 192 Cb -0.16 -1.91 -0.02 0.00 1.07 0.00 0.00 42.92 41.91 8ica s ASP 192 CO 0.11 -0.59 0.43 -0.69 1.18 0.00 0.00 175.17 175.62 8ica s VAL 193 N 1.26 5.11 0.27 -1.27 1.01 -0.37 -0.45 120.40 125.96 8ica s VAL 193 Ca 0.06 0.34 -0.14 0.00 0.00 0.00 0.00 61.98 62.24 8ica s VAL 193 Cb -0.24 -3.84 -0.08 0.00 0.00 0.00 0.00 36.38 32.22 8ica s VAL 193 CO -0.02 -0.06 0.67 -0.76 0.00 0.00 0.00 175.10 174.93 8ica s LEU 194 N 2.19 4.15 -0.16 3.92 1.02 0.16 -2.26 118.68 127.70 8ica s LEU 194 Ca 0.16 1.18 -0.10 0.00 0.02 0.00 0.00 54.13 55.39 8ica s LEU 194 Cb -0.16 -3.84 0.05 0.00 0.02 0.00 0.00 46.19 42.26 8ica s LEU 194 CO 0.12 -0.11 0.39 -0.22 0.02 0.00 0.00 176.35 176.55 8ica s LEU 195 N -2.72 0.12 0.35 1.79 2.96 -0.04 -2.11 118.68 119.03 8ica s LEU 195 Ca 0.49 0.84 0.06 0.00 -0.22 0.00 0.00 54.13 55.30 8ica s LEU 195 Cb -0.12 1.31 -0.03 0.00 0.50 0.00 0.00 46.19 47.85 8ica s LEU 195 CO 0.19 -0.17 0.22 0.28 -1.32 0.00 0.00 176.35 175.55 8ica s THR 196 N 1.04 0.19 0.04 3.68 -1.32 -1.09 0.18 115.64 118.36 8ica s THR 196 Ca -0.07 -2.00 -0.26 0.00 -1.21 0.00 0.00 61.69 58.15 8ica s THR 196 Cb -0.07 -2.44 0.07 0.00 -1.51 0.00 0.00 72.50 68.55 8ica s THR 196 CO -0.09 0.00 0.62 -2.28 -2.21 0.00 0.00 174.62 170.67 8ica s HIS 197 N -3.39 -0.57 0.30 9.09 2.46 -1.24 -2.64 115.29 119.31 8ica s HIS 197 Ca 0.35 0.72 0.02 0.00 0.47 0.00 0.00 55.06 56.61 8ica s HIS 197 Cb 0.02 0.45 0.48 0.00 -0.13 0.00 0.00 32.58 33.41 8ica s HIS 197 CO 0.23 -0.70 1.81 -1.35 -2.47 0.00 0.00 174.74 172.26 8ica h PRO 198 N 2.59 0.60 0.00 2.88 0.11 -1.93 -2.75 132.00 133.51 8ica h PRO 198 Ca -0.30 -0.15 0.00 0.00 0.11 0.00 0.00 66.00 65.65 8ica h PRO 198 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 8ica h PRO 198 CO 0.39 0.66 0.00 -1.13 -0.21 0.00 0.00 178.00 177.71 8ica n SER 199 N -4.23 0.00 -3.96 -2.05 3.41 -1.26 -4.65 113.62 100.88 8ica n SER 199 Ca 0.02 -1.26 -0.24 0.00 -0.26 0.00 0.00 58.87 57.13 8ica n SER 199 Cb 0.29 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.07 8ica n SER 199 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 8ica s PHE 200 N -2.00 1.29 0.28 7.33 5.36 -1.04 -4.94 117.98 124.26 8ica s PHE 200 Ca 0.25 -0.50 -0.08 0.00 -0.96 0.00 0.00 56.93 55.63 8ica s PHE 200 Cb 0.11 -1.01 0.03 0.00 -0.34 0.00 0.00 43.02 41.81 8ica s PHE 200 CO 0.19 -0.32 0.51 -2.37 -1.46 0.00 0.00 175.22 171.78 8ica n THR 201 N 4.18 0.00 -0.27 0.12 5.66 -1.26 -0.04 114.28 122.67 8ica n THR 201 Ca -0.20 -0.86 -0.07 0.00 -3.05 0.00 0.00 64.05 59.86 8ica n THR 201 Cb 0.51 0.73 -0.06 0.00 -1.55 0.00 0.00 70.33 69.96 8ica n THR 201 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 8ica n SER 202 N -1.48 -0.67 0.00 1.09 7.64 -1.26 -3.89 113.62 115.04 8ica n SER 202 Ca -0.05 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.00 8ica n SER 202 Cb 0.43 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 8ica n SER 202 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 8ica n GLU 203 N -4.73 0.00 0.00 1.43 4.71 -1.26 -4.81 120.64 115.98 8ica n GLU 203 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.16 8ica n GLU 203 Cb 0.17 -0.45 0.00 0.00 -1.01 0.00 0.00 31.44 30.14 8ica n GLU 203 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 8ica n SER 204 N -0.46 0.00 0.00 1.62 3.41 -1.25 -4.47 113.62 112.46 8ica n SER 204 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 8ica n SER 204 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 8ica n SER 204 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 8ica n THR 205 N 0.00 0.00 0.00 6.66 5.66 -1.26 -4.65 114.28 120.68 8ica n THR 205 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 8ica n THR 205 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 8ica n THR 205 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 8ica n LYS 206 N 0.00 0.00 0.00 1.09 4.76 -1.26 -4.97 118.16 117.77 8ica n LYS 206 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 8ica n LYS 206 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 8ica n LYS 206 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 8ica n GLN 207 N -0.13 0.00 -0.22 1.97 7.27 -1.26 -5.03 117.38 119.98 8ica n GLN 207 Ca 0.00 0.00 0.15 0.00 0.07 0.00 0.00 57.00 57.22 8ica n GLN 207 Cb 0.00 0.00 0.47 0.00 2.41 0.00 0.00 30.24 33.12 8ica n GLN 207 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 8ica h PRO 208 N 0.00 0.48 -0.21 3.69 0.13 -1.94 0.47 132.00 134.63 8ica h PRO 208 Ca 0.00 -0.03 0.06 0.00 -0.87 0.00 0.00 66.00 65.16 8ica h PRO 208 Cb 0.00 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.01 8ica h PRO 208 CO 0.00 0.32 0.23 0.87 -0.23 0.00 0.00 178.00 179.19 8ica h LYS 209 N 0.49 0.00 -0.62 0.86 1.79 -1.97 0.38 116.57 117.50 8ica h LYS 209 Ca 0.42 0.00 0.11 0.00 -2.18 0.00 0.00 60.65 59.00 8ica h LYS 209 Cb 0.90 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.46 8ica h LYS 209 CO -0.16 0.00 0.17 -0.07 -1.08 0.00 0.00 179.45 178.31 8ica h LEU 210 N 0.00 0.08 0.07 2.94 3.38 -0.43 0.53 115.31 121.87 8ica h LEU 210 Ca 0.10 0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 8ica h LEU 210 Cb 0.56 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.44 8ica h LEU 210 CO -0.00 0.04 -0.03 0.25 0.09 0.00 0.00 178.44 178.79 8ica h LEU 211 N 0.31 -0.08 -0.53 1.67 5.85 -1.09 -3.36 115.31 118.09 8ica h LEU 211 Ca 0.33 -0.47 0.08 0.00 0.84 0.00 0.00 57.88 58.66 8ica h LEU 211 Cb 0.48 0.02 -0.10 0.00 0.37 0.00 0.00 40.66 41.43 8ica h LEU 211 CO -0.39 0.46 -0.46 0.45 -0.34 0.00 0.00 178.44 178.16 8ica h HIS 212 N -0.64 -1.36 -0.60 1.25 3.86 -1.03 -1.58 115.15 115.05 8ica h HIS 212 Ca -0.01 0.08 0.11 0.00 -1.16 0.00 0.00 60.37 59.40 8ica h HIS 212 Cb 0.54 0.67 -0.12 0.00 1.06 0.00 0.00 27.41 29.56 8ica h HIS 212 CO 0.10 -0.44 -0.26 1.96 0.86 0.00 0.00 177.93 180.15 8ica h GLN 213 N -0.27 -0.10 -0.10 2.45 4.20 -0.09 -0.11 115.11 121.09 8ica h GLN 213 Ca 0.15 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 8ica h GLN 213 Cb 0.57 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.37 8ica h GLN 213 CO -0.66 -0.07 0.02 -0.39 -0.67 0.00 0.00 178.83 177.06 8ica h VAL 214 N -0.11 1.21 -0.99 -0.54 -1.51 -1.60 -1.26 116.25 111.46 8ica h VAL 214 Ca 0.26 -0.66 0.17 0.00 -1.23 0.00 0.00 66.70 65.24 8ica h VAL 214 Cb 0.53 1.46 -0.09 0.00 -2.13 0.00 0.00 31.29 31.05 8ica h VAL 214 CO -0.67 0.19 0.62 0.58 -1.23 0.00 0.00 177.57 177.06 8ica h VAL 215 N -0.06 0.77 -0.55 7.19 2.07 -0.69 0.34 116.25 125.32 8ica h VAL 215 Ca 0.03 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 8ica h VAL 215 Cb 0.28 -0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 29.93 8ica h VAL 215 CO 0.00 0.15 0.14 -0.08 0.02 0.00 0.00 177.57 177.79 8ica h GLU 216 N 0.80 0.84 0.22 1.57 4.81 -0.81 -2.10 114.58 119.90 8ica h GLU 216 Ca 0.54 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.58 8ica h GLU 216 Cb 0.79 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.05 8ica h GLU 216 CO -0.32 0.76 -0.10 0.37 -0.73 0.00 0.00 179.01 178.99 8ica h GLN 217 N 0.81 -0.28 -1.13 1.92 5.75 0.83 -1.27 115.11 121.74 8ica h GLN 217 Ca 0.18 0.02 0.32 0.00 -0.15 0.00 0.00 58.65 59.01 8ica h GLN 217 Cb 0.29 0.06 -0.09 0.00 1.07 0.00 0.00 27.48 28.82 8ica h GLN 217 CO -0.00 0.09 0.75 -0.07 -2.65 0.00 0.00 178.83 176.95 8ica h LEU 218 N -0.75 0.30 0.10 -2.39 4.07 -0.95 0.81 115.31 116.51 8ica h LEU 218 Ca -0.03 0.07 -0.30 0.00 0.08 0.00 0.00 57.88 57.71 8ica h LEU 218 Cb 0.50 0.03 0.03 0.00 1.08 0.00 0.00 40.66 42.30 8ica h LEU 218 CO 0.05 0.02 -1.23 1.56 -1.08 0.00 0.00 178.44 177.76 8ica h GLN 219 N 0.25 0.61 -0.48 1.13 4.20 -1.40 0.32 115.11 119.74 8ica h GLN 219 Ca 0.63 -0.81 0.10 0.00 0.06 0.00 0.00 58.65 58.62 8ica h GLN 219 Cb 1.89 0.27 -0.09 0.00 0.30 0.00 0.00 27.48 29.84 8ica h GLN 219 CO -0.25 1.37 -0.14 -0.22 -0.67 0.00 0.00 178.83 178.92 8ica h LYS 220 N 0.28 -0.02 -0.00 1.46 3.64 0.19 -1.38 116.57 120.73 8ica h LYS 220 Ca -0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 8ica h LYS 220 Cb 1.90 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.73 8ica h LYS 220 CO 0.23 -0.01 -0.07 1.33 -2.27 0.00 0.00 179.45 178.66 8ica n VAL 221 N -5.36 0.00 -2.02 2.00 0.24 -0.71 -4.95 118.33 107.52 8ica n VAL 221 Ca 0.04 -0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 8ica n VAL 221 Cb 0.27 -0.39 0.00 0.00 -1.47 0.00 0.00 33.84 32.25 8ica n VAL 221 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 8ica n HIS 222 N -1.46 0.00 -0.09 6.34 8.25 -0.52 -4.99 115.22 122.75 8ica n HIS 222 Ca 0.08 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.31 8ica n HIS 222 Cb 0.33 -0.84 -0.12 0.00 1.12 0.00 0.00 29.99 30.48 8ica n HIS 222 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 8ica n PHE 223 N -2.36 0.58 -3.24 4.41 7.35 0.11 -4.71 117.46 119.59 8ica n PHE 223 Ca 0.00 0.18 -0.39 0.00 -0.76 0.00 0.00 57.45 56.48 8ica n PHE 223 Cb 0.42 -1.07 -0.06 0.00 0.35 0.00 0.00 39.48 39.12 8ica n PHE 223 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 8ica s ILE 224 N -2.49 5.13 -0.20 -2.13 1.01 -0.84 -0.72 121.20 120.96 8ica s ILE 224 Ca -0.31 1.03 0.11 0.00 0.00 0.00 0.00 60.65 61.48 8ica s ILE 224 Cb 0.09 -3.86 -0.20 0.00 0.01 0.00 0.00 42.46 38.50 8ica s ILE 224 CO 0.62 0.25 -0.04 0.35 0.00 0.00 0.00 174.94 176.12 8ica n THR 225 N 4.06 1.29 -4.09 2.92 -2.24 0.20 -4.51 114.28 111.91 8ica n THR 225 Ca -0.05 -0.68 -0.10 0.00 -2.27 0.00 0.00 64.05 60.95 8ica n THR 225 Cb 0.51 -0.82 -0.09 0.00 -2.10 0.00 0.00 70.33 67.83 8ica n THR 225 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 8ica s ASP 226 N -5.64 0.15 -0.18 3.42 1.11 -1.14 -5.01 116.67 109.39 8ica s ASP 226 Ca -0.18 -1.12 0.01 0.00 0.18 0.00 0.00 52.55 51.44 8ica s ASP 226 Cb 0.06 0.39 0.03 0.00 1.07 0.00 0.00 42.92 44.47 8ica s ASP 226 CO 0.67 -0.85 -0.16 -0.89 1.18 0.00 0.00 175.17 175.12 8ica s THR 227 N -4.05 1.91 -0.16 -1.27 2.01 -1.26 -1.92 115.64 110.90 8ica s THR 227 Ca 0.25 -0.96 -0.21 0.00 0.31 0.00 0.00 61.69 61.09 8ica s THR 227 Cb 0.05 -1.80 -0.18 0.00 0.01 0.00 0.00 72.50 70.58 8ica s THR 227 CO 0.04 0.41 0.38 0.25 -0.69 0.00 0.00 174.62 175.02 8ica h LEU 228 N 7.95 0.00 -6.99 4.42 5.85 -1.36 -3.48 115.31 121.69 8ica h LEU 228 Ca -0.39 -0.60 0.04 0.00 0.84 0.00 0.00 57.88 57.77 8ica h LEU 228 Cb 1.12 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 41.94 8ica h LEU 228 CO 0.57 1.07 0.03 -0.94 -0.34 0.00 0.00 178.44 178.84 8ica s SER 229 N -6.29 -0.93 -0.03 1.25 1.04 -0.19 -4.77 113.70 103.78 8ica s SER 229 Ca -0.19 1.46 0.03 0.00 0.48 0.00 0.00 55.95 57.73 8ica s SER 229 Cb 0.01 1.50 -0.00 0.00 0.10 0.00 0.00 66.02 67.62 8ica s SER 229 CO 0.52 -0.23 -0.12 -0.75 0.98 0.00 0.00 173.24 173.63 8ica s LYS 230 N 1.79 1.25 0.13 4.02 2.20 -1.26 0.17 119.74 128.04 8ica s LYS 230 Ca -0.09 -0.43 0.02 0.00 -0.36 0.00 0.00 55.97 55.11 8ica s LYS 230 Cb -0.06 -1.14 -0.01 0.00 -1.51 0.00 0.00 37.83 35.12 8ica s LYS 230 CO -0.19 0.19 0.13 0.41 -0.36 0.00 0.00 175.35 175.52 8ica n GLY 231 N 3.15 3.40 0.00 5.54 0.00 -0.93 -4.98 105.19 111.37 8ica n GLY 231 Ca -0.17 -1.69 0.05 0.00 0.00 0.00 0.00 46.02 44.21 8ica n GLY 231 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 8ica n GLU 232 N -0.25 0.10 0.00 1.61 0.28 -1.26 -3.80 120.64 117.32 8ica n GLU 232 Ca 0.03 0.23 0.00 0.00 -0.16 0.00 0.00 57.16 57.25 8ica n GLU 232 Cb 0.24 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.61 8ica n GLU 232 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 8ica n THR 233 N -1.37 0.00 -3.66 3.84 -2.24 -1.26 -4.70 114.28 104.90 8ica n THR 233 Ca 0.04 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.60 8ica n THR 233 Cb 0.11 0.45 -0.18 0.00 -2.10 0.00 0.00 70.33 68.61 8ica n THR 233 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 8ica s LYS 234 N 0.00 0.04 0.06 -0.78 2.20 -1.25 0.10 119.74 120.10 8ica s LYS 234 Ca 0.00 0.16 -0.02 0.00 -0.36 0.00 0.00 55.97 55.75 8ica s LYS 234 Cb 0.00 -1.09 -0.04 0.00 -1.51 0.00 0.00 37.83 35.19 8ica s LYS 234 CO 0.00 -0.47 0.24 0.12 -0.36 0.00 0.00 175.35 174.89 8ica s PHE 235 N 2.14 3.52 -0.20 4.03 5.36 -0.68 -2.18 117.98 129.96 8ica s PHE 235 Ca 0.04 0.36 -0.04 0.00 -0.96 0.00 0.00 56.93 56.33 8ica s PHE 235 Cb -0.14 -1.85 0.08 0.00 -0.34 0.00 0.00 43.02 40.78 8ica s PHE 235 CO -0.06 0.57 0.17 -1.64 -1.46 0.00 0.00 175.22 172.80 8ica s MET 236 N -2.36 0.15 0.00 10.12 -1.94 0.13 -2.76 119.30 122.64 8ica s MET 236 Ca 0.34 0.01 0.00 0.00 -1.71 0.00 0.00 55.69 54.33 8ica s MET 236 Cb -0.13 -1.40 0.00 0.00 2.01 0.00 0.00 34.83 35.31 8ica s MET 236 CO 0.24 -0.72 0.00 0.41 -0.01 0.00 0.00 175.02 174.95 8ica n GLY 237 N 5.30 5.41 2.98 -0.03 0.00 0.42 -0.97 105.19 118.30 8ica n GLY 237 Ca -0.06 -1.30 -0.19 0.00 0.00 0.00 0.00 46.02 44.48 8ica n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 8ica s VAL 238 N 0.98 0.65 0.27 1.61 1.01 -0.81 -2.22 120.40 121.88 8ica s VAL 238 Ca 0.00 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 61.71 8ica s VAL 238 Cb 0.00 -0.57 -0.06 0.00 0.00 0.00 0.00 36.38 35.75 8ica s VAL 238 CO 0.00 0.20 0.03 0.00 0.00 0.00 0.00 175.10 175.33 8ica s GLN 240 N -3.90 0.70 0.21 0.00 0.74 0.10 -0.19 119.66 117.32 8ica s GLN 240 Ca 0.33 1.07 -0.30 0.00 0.05 0.00 0.00 55.36 56.51 8ica s GLN 240 Cb 0.07 0.21 -0.08 0.00 1.10 0.00 0.00 33.01 34.31 8ica s GLN 240 CO 0.12 -0.12 0.95 -0.51 -0.55 0.00 0.00 175.29 175.18 8ica s LEU 241 N 1.18 4.61 -0.14 3.68 1.43 -1.26 -4.58 118.68 123.60 8ica s LEU 241 Ca -0.06 1.92 -0.34 0.00 -1.03 0.00 0.00 54.13 54.61 8ica s LEU 241 Cb -0.05 -3.61 -0.11 0.00 0.03 0.00 0.00 46.19 42.45 8ica s LEU 241 CO -0.13 0.10 1.93 -2.65 0.23 0.00 0.00 176.35 175.83 8ica n PRO 242 N 1.81 1.98 -2.31 1.29 -0.02 -1.26 -3.95 135.00 132.54 8ica n PRO 242 Ca -0.01 0.70 -0.42 0.00 -2.02 0.00 0.00 63.50 61.76 8ica n PRO 242 Cb 0.47 -2.63 -0.03 0.00 -0.02 0.00 0.00 33.50 31.30 8ica n PRO 242 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 8ica s SER 243 N 4.69 6.05 0.00 2.55 0.01 -1.26 -4.85 113.70 120.88 8ica s SER 243 Ca 0.96 0.45 0.00 0.00 1.31 0.00 0.00 55.95 58.67 8ica s SER 243 Cb -0.71 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 62.98 8ica s SER 243 CO 0.51 -1.74 0.00 0.29 0.41 0.00 0.00 173.24 172.71 8ica n LYS 244 N 8.62 0.00 -3.01 12.44 4.76 -1.24 -4.55 118.16 135.18 8ica n LYS 244 Ca 0.15 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.15 8ica n LYS 244 Cb 0.49 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.69 8ica n LYS 244 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 8ica n ASN 245 N 0.00 6.07 0.00 4.39 5.03 -1.26 -4.98 115.26 124.51 8ica n ASN 245 Ca 0.00 -3.29 0.00 0.00 0.87 0.00 0.00 54.58 52.16 8ica n ASN 245 Cb 0.00 -1.33 0.00 0.00 -1.02 0.00 0.00 39.78 37.43 8ica n ASN 245 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 8ica n ASP 246 N 2.01 0.00 0.00 6.41 9.92 -1.26 -4.69 116.55 128.94 8ica n ASP 246 Ca 0.27 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.53 8ica n ASP 246 Cb 0.35 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.83 8ica n ASP 246 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 8ica n GLU 247 N 0.00 0.00 -3.60 -1.24 -0.58 -1.26 -5.05 120.64 108.91 8ica n GLU 247 Ca 0.00 0.00 -0.28 0.00 -0.42 0.00 0.00 57.16 56.46 8ica n GLU 247 Cb 0.00 0.00 -0.16 0.00 -0.57 0.00 0.00 31.44 30.71 8ica n GLU 247 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 8ica s LYS 248 N 0.00 0.19 0.11 3.49 0.00 -1.26 -5.13 119.74 117.14 8ica s LYS 248 Ca 0.00 -0.33 0.03 0.00 0.00 0.00 0.00 55.97 55.67 8ica s LYS 248 Cb 0.00 -1.59 -0.04 0.00 0.00 0.00 0.00 37.83 36.20 8ica s LYS 248 CO 0.00 -0.82 0.12 -2.00 0.00 0.00 0.00 175.35 172.64 8ica s GLU 249 N 2.08 2.95 0.23 1.78 2.12 -1.26 -3.63 118.70 122.97 8ica s GLU 249 Ca 0.05 -0.72 -0.07 0.00 0.36 0.00 0.00 54.97 54.59 8ica s GLU 249 Cb -0.16 -2.74 -0.06 0.00 0.26 0.00 0.00 34.13 31.43 8ica s GLU 249 CO -0.21 0.54 0.51 0.71 -0.54 0.00 0.00 175.26 176.27 8ica s TYR 250 N -1.52 3.46 0.48 5.30 2.02 -1.25 -4.98 117.35 120.85 8ica s TYR 250 Ca 0.30 0.71 -0.21 0.00 -0.37 0.00 0.00 57.07 57.50 8ica s TYR 250 Cb -0.12 -2.14 -0.08 0.00 -0.40 0.00 0.00 41.96 39.23 8ica s TYR 250 CO 0.23 0.28 1.09 -2.14 -1.57 0.00 0.00 175.55 173.44 8ica s PRO 251 N -3.05 3.75 -0.07 -1.71 0.02 -1.26 -4.80 135.00 127.88 8ica s PRO 251 Ca 0.44 1.55 -0.30 0.00 0.02 0.00 0.00 61.00 62.72 8ica s PRO 251 Cb -0.11 -2.23 -0.03 0.00 0.02 0.00 0.00 34.50 32.15 8ica s PRO 251 CO 0.25 -0.51 1.12 -1.01 -0.33 0.00 0.00 177.00 176.52 8ica s HIS 252 N -1.76 3.35 -0.08 6.54 3.76 -1.26 -4.62 115.29 121.21 8ica s HIS 252 Ca 0.66 1.39 0.03 0.00 -0.15 0.00 0.00 55.06 56.98 8ica s HIS 252 Cb -0.22 -3.32 -0.02 0.00 1.11 0.00 0.00 32.58 30.13 8ica s HIS 252 CO 0.26 -0.83 -0.15 1.03 -0.85 0.00 0.00 174.74 174.20 8ica s ARG 253 N 2.02 2.86 0.08 1.40 3.00 0.74 -4.38 118.95 124.67 8ica s ARG 253 Ca 0.53 -0.72 -0.31 0.00 0.00 0.00 0.00 55.73 55.23 8ica s ARG 253 Cb -0.22 -2.44 -0.08 0.00 0.00 0.00 0.00 34.95 32.20 8ica s ARG 253 CO 0.21 0.43 1.50 1.03 0.00 0.00 0.00 175.30 178.47 8ica s ARG 254 N -0.22 4.26 0.05 3.54 1.81 -1.26 0.24 118.95 127.36 8ica s ARG 254 Ca 0.00 2.18 0.02 0.00 -1.72 0.00 0.00 55.73 56.21 8ica s ARG 254 Cb -0.13 -3.41 -0.03 0.00 -0.45 0.00 0.00 34.95 30.93 8ica s ARG 254 CO 0.03 -0.59 -0.07 -1.50 -0.68 0.00 0.00 175.30 172.49 8ica s ILE 255 N 1.88 0.50 -0.01 1.52 2.07 -0.94 -2.10 121.20 124.12 8ica s ILE 255 Ca 0.68 -1.22 -0.02 0.00 -1.41 0.00 0.00 60.65 58.68 8ica s ILE 255 Cb -0.38 -0.77 -0.00 0.00 0.13 0.00 0.00 42.46 41.45 8ica s ILE 255 CO 0.30 -0.49 0.05 -1.81 -1.91 0.00 0.00 174.94 171.08 8ica s ASP 256 N -1.84 0.02 -0.01 4.50 1.01 -0.82 -0.44 116.67 119.09 8ica s ASP 256 Ca -0.07 -0.06 0.02 0.00 0.71 0.00 0.00 52.55 53.15 8ica s ASP 256 Cb -0.07 0.13 0.00 0.00 1.01 0.00 0.00 42.92 43.99 8ica s ASP 256 CO -0.01 -0.13 -0.05 -0.63 0.21 0.00 0.00 175.17 174.56 8ica s ILE 257 N -0.49 0.43 -0.04 0.77 1.01 -1.11 -1.23 121.20 120.54 8ica s ILE 257 Ca -0.06 -0.21 0.05 0.00 0.00 0.00 0.00 60.65 60.44 8ica s ILE 257 Cb -0.04 -0.38 -0.01 0.00 0.01 0.00 0.00 42.46 42.05 8ica s ILE 257 CO 0.00 0.13 -0.19 0.00 0.00 0.00 0.00 174.94 174.89 8ica s ARG 258 N 0.03 1.83 0.25 2.79 1.70 -0.96 -1.69 118.95 122.90 8ica s ARG 258 Ca 0.00 -0.67 -0.28 0.00 -0.47 0.00 0.00 55.73 54.31 8ica s ARG 258 Cb -0.04 -1.63 -0.09 0.00 -0.57 0.00 0.00 34.95 32.62 8ica s ARG 258 CO -0.00 0.31 0.91 -1.17 -1.08 0.00 0.00 175.30 174.27 8ica s LEU 259 N -0.12 4.57 0.00 -1.89 2.96 0.11 -0.86 118.68 123.45 8ica s LEU 259 Ca -0.01 1.87 0.00 0.00 -0.22 0.00 0.00 54.13 55.77 8ica s LEU 259 Cb -0.11 -3.65 -0.00 0.00 0.50 0.00 0.00 46.19 42.93 8ica s LEU 259 CO 0.02 0.12 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.52 8ica s ILE 260 N -1.27 0.07 -0.13 6.68 -1.09 0.48 -4.87 121.20 121.06 8ica s ILE 260 Ca 0.42 -0.10 -0.29 0.00 -2.23 0.00 0.00 60.65 58.45 8ica s ILE 260 Cb -0.24 -0.08 -0.05 0.00 -1.58 0.00 0.00 42.46 40.52 8ica s ILE 260 CO 0.29 -0.02 1.76 -2.84 -1.23 0.00 0.00 174.94 172.90 8ica s PRO 261 N -0.13 3.86 0.41 2.79 0.02 -1.26 -3.59 135.00 137.10 8ica s PRO 261 Ca -0.01 2.00 0.22 0.00 0.02 0.00 0.00 61.00 63.23 8ica s PRO 261 Cb -0.01 -4.09 1.20 0.00 0.02 0.00 0.00 34.50 31.62 8ica s PRO 261 CO -0.00 -1.23 1.72 -0.22 -0.33 0.00 0.00 177.00 176.94 8ica h LYS 262 N 10.97 0.28 0.00 5.54 1.63 -0.54 1.53 116.57 135.98 8ica h LYS 262 Ca -0.39 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.40 8ica h LYS 262 Cb 1.18 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.75 8ica h LYS 262 CO 0.97 0.19 0.00 -0.40 -3.45 0.00 0.00 179.45 176.76 8ica n ASP 263 N -4.67 0.00 -0.14 4.20 5.75 -1.26 -3.01 116.55 117.42 8ica n ASP 263 Ca 0.29 -0.44 0.02 0.00 -0.01 0.00 0.00 54.79 54.65 8ica n ASP 263 Cb 1.05 0.00 0.03 0.00 -1.03 0.00 0.00 41.12 41.17 8ica n ASP 263 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 8ica n GLN 264 N -0.97 0.98 0.00 0.11 10.64 0.52 -4.84 117.38 123.82 8ica n GLN 264 Ca 0.10 -1.26 0.00 0.00 -1.83 0.00 0.00 57.00 54.01 8ica n GLN 264 Cb 0.04 -0.81 0.00 0.00 -0.86 0.00 0.00 30.24 28.61 8ica n GLN 264 CO 0.00 0.00 0.00 0.98 -1.83 0.00 0.00 177.06 176.21 8ica n TYR 265 N -0.39 0.00 -0.29 2.61 9.36 -1.17 -1.93 117.16 125.35 8ica n TYR 265 Ca 0.03 0.00 0.02 0.00 3.32 0.00 0.00 57.90 61.27 8ica n TYR 265 Cb 0.51 0.00 0.07 0.00 -0.63 0.00 0.00 39.34 39.30 8ica n TYR 265 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 8ica n TYR 266 N -0.53 0.16 -0.05 2.98 4.01 -1.26 0.16 117.16 122.63 8ica n TYR 266 Ca 0.00 0.96 -0.09 0.00 -0.16 0.00 0.00 57.90 58.61 8ica n TYR 266 Cb 0.00 -0.88 -0.02 0.00 -0.31 0.00 0.00 39.34 38.13 8ica n TYR 266 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 8ica h GLY 268 N 0.16 0.57 1.18 0.00 0.00 0.22 0.40 103.07 105.59 8ica h GLY 268 Ca 0.10 -0.04 -0.11 0.00 0.00 0.00 0.00 47.33 47.28 8ica h GLY 268 CO -0.11 -0.04 -0.10 -2.08 0.00 0.00 0.00 176.54 174.21 8ica h VAL 269 N 0.25 1.27 0.11 4.60 2.07 0.18 -1.56 116.25 123.17 8ica h VAL 269 Ca 0.23 -1.23 0.02 0.00 0.82 0.00 0.00 66.70 66.53 8ica h VAL 269 Cb 0.29 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 8ica h VAL 269 CO -0.29 0.43 -0.27 0.25 0.02 0.00 0.00 177.57 177.72 8ica h LEU 270 N 0.86 -0.76 0.00 2.57 5.85 0.56 -2.23 115.31 122.16 8ica h LEU 270 Ca 0.14 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.95 8ica h LEU 270 Cb 0.64 0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.96 8ica h LEU 270 CO 0.04 -0.35 0.00 0.00 -0.34 0.00 0.00 178.44 177.79 8ica n TYR 271 N -5.38 0.00 0.00 1.25 9.36 0.13 -2.72 117.16 119.79 8ica n TYR 271 Ca -0.06 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.16 8ica n TYR 271 Cb 0.29 -0.38 0.00 0.00 -0.63 0.00 0.00 39.34 38.62 8ica n TYR 271 CO 0.00 0.00 0.00 1.19 0.22 0.00 0.00 176.86 178.27 8ica n PHE 272 N -2.01 0.00 0.14 2.98 3.72 -0.61 -0.80 117.46 120.89 8ica n PHE 272 Ca 0.00 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.45 8ica n PHE 272 Cb 0.00 -0.42 0.04 0.00 -0.94 0.00 0.00 39.48 38.16 8ica n PHE 272 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 8ica h THR 273 N 0.00 0.57 -0.49 4.37 2.02 -1.19 -2.59 112.91 115.59 8ica h THR 273 Ca 0.00 -1.84 0.00 0.00 0.77 0.00 0.00 66.41 65.34 8ica h THR 273 Cb 0.09 2.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.73 8ica h THR 273 CO 0.00 0.33 0.00 0.61 0.37 0.00 0.00 175.52 176.83 8ica n GLY 274 N 1.21 -0.02 3.89 2.16 0.00 0.02 -4.56 105.19 107.90 8ica n GLY 274 Ca 0.01 -1.00 -0.30 0.00 0.00 0.00 0.00 46.02 44.73 8ica n GLY 274 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 8ica s SER 275 N -4.00 3.22 0.56 1.61 1.04 -0.24 -4.56 113.70 111.34 8ica s SER 275 Ca 0.00 0.42 0.32 0.00 0.48 0.00 0.00 55.95 57.17 8ica s SER 275 Cb 0.00 -0.58 1.46 0.00 0.10 0.00 0.00 66.02 67.00 8ica s SER 275 CO 0.00 -2.68 1.80 -2.24 0.98 0.00 0.00 173.24 171.10 8ica h ASP 276 N -1.60 0.00 0.03 7.02 2.03 -1.91 -0.15 116.42 121.84 8ica h ASP 276 Ca -0.45 0.00 -0.26 0.00 -0.73 0.00 0.00 57.03 55.59 8ica h ASP 276 Cb 1.26 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.73 8ica h ASP 276 CO 0.44 0.00 -1.39 0.16 -1.03 0.00 0.00 179.24 177.42 8ica h ILE 277 N 0.00 0.87 -0.47 4.15 -2.65 -1.91 -3.19 117.51 114.32 8ica h ILE 277 Ca 0.42 -2.22 0.14 0.00 1.03 0.00 0.00 64.86 64.23 8ica h ILE 277 Cb 1.88 2.29 -0.02 0.00 -2.05 0.00 0.00 36.82 38.92 8ica h ILE 277 CO -0.00 0.43 0.45 0.15 0.03 0.00 0.00 178.15 179.21 8ica h PHE 278 N -0.78 0.00 0.00 0.16 3.57 -1.34 0.67 116.94 119.22 8ica h PHE 278 Ca -0.36 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.14 8ica h PHE 278 Cb 1.45 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.19 8ica h PHE 278 CO 0.10 0.00 0.00 0.09 -2.23 0.00 0.00 178.31 176.27 8ica n ASN 279 N -3.84 0.00 -0.24 0.41 5.03 -0.19 0.39 115.26 116.82 8ica n ASN 279 Ca 0.09 0.80 0.05 0.00 0.87 0.00 0.00 54.58 56.38 8ica n ASN 279 Cb 0.65 -0.50 0.16 0.00 -1.02 0.00 0.00 39.78 39.07 8ica n ASN 279 CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 8ica h LYS 280 N 0.00 0.17 -0.55 3.52 1.57 -1.31 1.98 116.57 121.95 8ica h LYS 280 Ca 0.00 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 8ica h LYS 280 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 8ica h LYS 280 CO 0.00 0.11 0.15 -0.91 -0.57 0.00 0.00 179.45 178.23 8ica h ASN 281 N 0.17 0.82 -0.39 0.86 4.21 0.25 0.61 115.58 122.11 8ica h ASN 281 Ca 0.40 -0.22 -0.01 0.00 1.21 0.00 0.00 56.30 57.68 8ica h ASN 281 Cb 0.69 -0.21 -0.02 0.00 -1.12 0.00 0.00 38.32 37.65 8ica h ASN 281 CO -0.57 0.82 0.21 -0.03 -1.29 0.00 0.00 177.43 176.57 8ica h MET 282 N 0.77 0.54 -0.30 0.81 4.05 0.49 -2.60 114.93 118.69 8ica h MET 282 Ca 0.17 -0.07 0.05 0.00 -0.28 0.00 0.00 59.70 59.58 8ica h MET 282 Cb 0.31 -0.10 -0.05 0.00 -0.80 0.00 0.00 31.60 30.96 8ica h MET 282 CO -0.00 0.45 0.00 0.00 0.23 0.00 0.00 176.91 177.59 8ica h ARG 283 N 0.49 0.09 0.00 0.39 3.08 0.34 -1.07 114.38 117.71 8ica h ARG 283 Ca 0.14 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 8ica h ARG 283 Cb 0.07 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 8ica h ARG 283 CO -0.02 0.06 -0.01 0.00 -1.07 0.00 0.00 179.97 178.93 8ica h ALA 284 N 1.26 1.88 -0.03 0.04 0.00 0.35 -2.95 119.26 119.81 8ica h ALA 284 Ca 0.14 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 8ica h ALA 284 Cb 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 8ica h ALA 284 CO -0.24 0.01 -0.19 1.25 0.00 0.00 0.00 179.25 180.07 8ica h HIS 285 N 0.00 0.26 -0.12 0.00 -0.00 -0.82 -3.17 115.15 111.31 8ica h HIS 285 Ca -0.00 -0.12 0.03 0.00 -0.00 0.00 0.00 60.37 60.29 8ica h HIS 285 Cb 0.01 -0.04 -0.00 0.00 -0.00 0.00 0.00 27.41 27.38 8ica h HIS 285 CO 0.00 0.84 0.35 0.00 -0.00 0.00 0.00 177.93 179.12 8ica h ALA 286 N 0.37 1.56 -0.02 5.26 0.00 -1.28 -1.36 119.26 123.80 8ica h ALA 286 Ca -0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 8ica h ALA 286 Cb 0.86 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 8ica h ALA 286 CO 0.04 -0.41 0.01 1.25 0.00 0.00 0.00 179.25 180.13 8ica h LEU 287 N 0.00 0.03 -0.12 0.00 7.12 -1.54 3.88 115.31 124.67 8ica h LEU 287 Ca 0.06 -0.21 -0.06 0.00 0.13 0.00 0.00 57.88 57.80 8ica h LEU 287 Cb 0.76 -0.01 -0.00 0.00 -0.53 0.00 0.00 40.66 40.88 8ica h LEU 287 CO -0.00 0.23 -0.14 -0.33 -0.13 0.00 0.00 178.44 178.07 8ica h GLU 288 N -0.18 0.31 -0.13 1.25 4.39 -1.37 -2.89 114.58 115.97 8ica h GLU 288 Ca 0.01 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.54 8ica h GLU 288 Cb 0.21 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 8ica h GLU 288 CO -0.00 0.72 0.00 1.63 -1.16 0.00 0.00 179.01 180.20 8ica n LYS 289 N -4.58 0.31 -3.09 2.33 4.76 -0.62 -4.77 118.16 112.49 8ica n LYS 289 Ca -0.07 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.24 8ica n LYS 289 Cb 0.36 -1.07 0.04 0.00 -1.84 0.00 0.00 35.03 32.53 8ica n LYS 289 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 8ica n GLY 290 N 0.03 0.13 0.00 0.72 0.00 -1.02 -4.95 105.19 100.11 8ica n GLY 290 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 8ica n GLY 290 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 8ica n PHE 291 N -3.83 0.00 -3.15 1.61 3.72 1.28 -0.01 117.46 117.08 8ica n PHE 291 Ca -0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.44 8ica n PHE 291 Cb 0.53 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.06 8ica n PHE 291 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 8ica s THR 292 N -0.72 -0.75 -0.03 4.37 -1.32 -0.14 -4.12 115.64 112.92 8ica s THR 292 Ca 0.00 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.45 8ica s THR 292 Cb 0.00 -0.98 -0.04 0.00 -1.51 0.00 0.00 72.50 69.97 8ica s THR 292 CO 0.00 0.00 0.13 -0.63 -2.21 0.00 0.00 174.62 171.91 8ica s ILE 293 N 2.89 5.14 -0.11 5.08 -1.09 -1.26 -0.88 121.20 130.97 8ica s ILE 293 Ca 0.13 -0.18 -0.30 0.00 -2.23 0.00 0.00 60.65 58.07 8ica s ILE 293 Cb -0.13 -3.34 0.09 0.00 -1.58 0.00 0.00 42.46 37.51 8ica s ILE 293 CO -0.18 0.40 0.82 0.54 -1.23 0.00 0.00 174.94 175.29 8ica s ASN 294 N -1.64 -0.54 0.09 3.58 6.03 -0.67 -4.99 114.94 116.79 8ica s ASN 294 Ca 0.23 0.63 0.02 0.00 -1.03 0.00 0.00 52.86 52.71 8ica s ASN 294 Cb -0.12 0.50 0.07 0.00 -3.03 0.00 0.00 41.25 38.67 8ica s ASN 294 CO 0.13 -0.48 0.16 -1.84 -2.03 0.00 0.00 177.10 173.05 8ica n GLU 295 N 0.96 0.00 0.00 3.55 0.00 -1.26 -0.49 120.64 123.40 8ica n GLU 295 Ca -0.15 0.14 0.00 0.00 0.00 0.00 0.00 57.16 57.15 8ica n GLU 295 Cb 0.57 -0.35 0.00 0.00 0.00 0.00 0.00 31.44 31.66 8ica n GLU 295 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 8ica n TYR 296 N -1.23 0.00 -3.74 -1.84 4.01 -1.26 -2.04 117.16 111.06 8ica n TYR 296 Ca 0.02 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.67 8ica n TYR 296 Cb 0.18 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.23 8ica n TYR 296 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 8ica n THR 297 N -0.66 0.00 -3.56 -0.72 -2.24 0.35 -4.73 114.28 102.72 8ica n THR 297 Ca 0.00 -0.97 -0.21 0.00 -2.27 0.00 0.00 64.05 60.61 8ica n THR 297 Cb 0.00 0.88 -0.15 0.00 -2.10 0.00 0.00 70.33 68.96 8ica n THR 297 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 8ica s ILE 298 N -2.30 -0.24 -0.08 2.28 2.07 -1.24 -1.67 121.20 120.02 8ica s ILE 298 Ca 0.16 -0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.34 8ica s ILE 298 Cb -0.04 -0.59 -0.03 0.00 0.13 0.00 0.00 42.46 41.94 8ica s ILE 298 CO 0.12 -0.18 -0.06 -0.13 -1.91 0.00 0.00 174.94 172.77 8ica s ARG 299 N 2.26 2.90 0.27 3.50 0.52 -0.06 -2.02 118.95 126.32 8ica s ARG 299 Ca 0.05 -0.54 -0.29 0.00 -0.52 0.00 0.00 55.73 54.42 8ica s ARG 299 Cb -0.15 -2.64 -0.10 0.00 0.52 0.00 0.00 34.95 32.58 8ica s ARG 299 CO -0.10 0.60 1.28 -1.25 0.02 0.00 0.00 175.30 175.85 8ica s PRO 300 N -0.62 4.41 0.10 3.54 0.04 -1.26 -0.97 135.00 140.24 8ica s PRO 300 Ca 0.09 2.10 -0.24 0.00 0.04 0.00 0.00 61.00 62.99 8ica s PRO 300 Cb -0.12 -3.13 -0.07 0.00 0.04 0.00 0.00 34.50 31.22 8ica s PRO 300 CO 0.02 -0.16 0.74 -1.17 0.04 0.00 0.00 177.00 176.47 8ica s LEU 301 N -1.06 4.53 -0.10 -3.56 2.96 0.99 -4.13 118.68 118.30 8ica s LEU 301 Ca 0.52 1.51 -0.02 0.00 -0.22 0.00 0.00 54.13 55.92 8ica s LEU 301 Cb -0.38 -3.22 -0.03 0.00 0.50 0.00 0.00 46.19 43.07 8ica s LEU 301 CO 0.45 0.14 0.00 -0.83 -1.32 0.00 0.00 176.35 174.79 8ica s GLY 302 N -0.70 1.84 0.32 7.98 0.00 -1.26 -4.88 107.32 110.61 8ica s GLY 302 Ca 0.36 -0.80 0.03 0.00 0.00 0.00 0.00 44.72 44.31 8ica s GLY 302 CO 0.24 -0.47 1.89 -0.24 0.00 0.00 0.00 173.10 174.52 8ica h VAL 303 N 4.32 0.97 0.00 1.40 3.04 -1.98 -3.20 116.25 120.79 8ica h VAL 303 Ca -0.48 -0.31 0.00 0.00 -1.01 0.00 0.00 66.70 64.90 8ica h VAL 303 Cb 1.19 -0.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.45 8ica h VAL 303 CO 0.56 0.17 0.25 0.35 -1.01 0.00 0.00 177.57 177.89 8ica n THR 304 N -4.53 0.08 0.00 3.17 -2.24 -1.26 -4.50 114.28 105.00 8ica n THR 304 Ca 0.16 0.27 0.00 0.00 -2.27 0.00 0.00 64.05 62.20 8ica n THR 304 Cb 0.30 -1.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.27 8ica n THR 304 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 8ica n GLY 305 N -0.81 3.09 3.35 3.38 0.00 -1.21 -5.07 105.19 107.92 8ica n GLY 305 Ca 0.00 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.26 8ica n GLY 305 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 8ica s VAL 306 N 0.00 0.35 -0.23 1.61 -7.23 -1.21 -4.86 120.40 108.82 8ica s VAL 306 Ca 0.00 -2.00 -0.36 0.00 -1.81 0.00 0.00 61.98 57.81 8ica s VAL 306 Cb 0.00 -2.50 0.15 0.00 0.56 0.00 0.00 36.38 34.59 8ica s VAL 306 CO 0.00 0.00 1.28 0.00 -0.31 0.00 0.00 175.10 176.07 8ica s ALA 307 N -3.54 -2.12 0.00 1.32 0.00 -1.26 -4.22 121.76 111.93 8ica s ALA 307 Ca 0.35 1.74 0.00 0.00 0.00 0.00 0.00 51.96 54.04 8ica s ALA 307 Cb 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.82 8ica s ALA 307 CO 0.18 -0.54 0.00 0.41 0.00 0.00 0.00 175.76 175.81 8ica n GLY 308 N 0.00 3.78 0.95 0.00 0.00 -1.26 -4.64 105.19 104.03 8ica n GLY 308 Ca 0.02 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.20 8ica n GLY 308 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 8ica n GLU 309 N 0.00 0.00 -0.98 1.61 4.71 -1.26 -4.03 120.64 120.69 8ica n GLU 309 Ca 0.00 0.05 -0.12 0.00 -0.01 0.00 0.00 57.16 57.07 8ica n GLU 309 Cb 0.00 -0.95 -0.13 0.00 -1.01 0.00 0.00 31.44 29.35 8ica n GLU 309 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 8ica n PRO 310 N -0.91 0.00 -1.70 3.49 -0.02 -1.26 -4.41 135.00 130.20 8ica n PRO 310 Ca 0.00 0.00 -0.44 0.00 -2.02 0.00 0.00 63.50 61.04 8ica n PRO 310 Cb 0.32 -0.70 -0.02 0.00 -0.02 0.00 0.00 33.50 33.07 8ica n PRO 310 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 8ica n LEU 311 N 3.72 3.52 -4.66 2.45 4.32 -0.86 -4.93 117.00 120.57 8ica n LEU 311 Ca 0.38 1.14 -0.42 0.00 -0.02 0.00 0.00 56.01 57.09 8ica n LEU 311 Cb 0.15 -1.48 -0.03 0.00 -1.62 0.00 0.00 43.42 40.44 8ica n LEU 311 CO 0.69 -0.27 1.43 -2.84 -1.22 0.00 0.00 177.39 175.17 8ica s PRO 312 N -0.39 4.13 -0.12 3.23 0.02 -1.26 -4.61 135.00 136.00 8ica s PRO 312 Ca 0.67 2.24 -0.01 0.00 0.02 0.00 0.00 61.00 63.92 8ica s PRO 312 Cb -0.60 -4.03 -0.02 0.00 0.02 0.00 0.00 34.50 29.87 8ica s PRO 312 CO 0.49 -0.92 -0.10 0.08 -0.33 0.00 0.00 177.00 176.22 8ica s VAL 313 N 4.29 3.39 0.00 3.83 1.01 -1.26 -4.94 120.40 126.72 8ica s VAL 313 Ca 0.77 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.20 8ica s VAL 313 Cb -0.35 -2.43 0.00 0.00 0.00 0.00 0.00 36.38 33.61 8ica s VAL 313 CO 0.32 0.53 0.10 0.47 0.00 0.00 0.00 175.10 176.52 8ica n ASP 314 N 3.22 0.19 -3.60 3.32 9.92 -1.26 -4.96 116.55 123.38 8ica n ASP 314 Ca -0.18 -0.52 -0.06 0.00 -0.53 0.00 0.00 54.79 53.50 8ica n ASP 314 Cb 0.53 0.47 -0.04 0.00 -0.64 0.00 0.00 41.12 41.44 8ica n ASP 314 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 8ica s SER 315 N -0.47 -0.20 0.42 -2.24 0.15 -1.26 -5.02 113.70 105.08 8ica s SER 315 Ca 0.00 0.15 0.31 0.00 0.70 0.00 0.00 55.95 57.12 8ica s SER 315 Cb 0.00 0.17 1.40 0.00 -1.71 0.00 0.00 66.02 65.88 8ica s SER 315 CO 0.00 -0.22 1.45 -0.62 1.20 0.00 0.00 173.24 175.04 8ica n GLU 316 N 0.40 -0.03 0.06 5.44 1.02 -1.26 -0.90 120.64 125.36 8ica n GLU 316 Ca -0.04 1.15 -0.06 0.00 -0.02 0.00 0.00 57.16 58.19 8ica n GLU 316 Cb 0.59 -2.29 -0.04 0.00 -0.02 0.00 0.00 31.44 29.68 8ica n GLU 316 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 8ica h LYS 317 N 0.00 -0.29 -0.92 3.49 1.63 -1.99 -3.01 116.57 115.48 8ica h LYS 317 Ca 0.82 0.02 0.20 0.00 -0.85 0.00 0.00 60.65 60.84 8ica h LYS 317 Cb 2.69 0.07 -0.17 0.00 -0.60 0.00 0.00 32.23 34.21 8ica h LYS 317 CO -0.40 -0.20 -0.17 -0.25 -3.45 0.00 0.00 179.45 174.98 8ica n ASP 318 N -3.58 -0.28 0.07 4.20 8.00 -0.07 0.17 116.55 125.06 8ica n ASP 318 Ca -0.03 1.57 -0.11 0.00 0.71 0.00 0.00 54.79 56.93 8ica n ASP 318 Cb 0.16 -0.50 -0.05 0.00 -0.02 0.00 0.00 41.12 40.71 8ica n ASP 318 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 8ica h ILE 319 N 0.00 0.61 -0.08 0.53 2.04 -1.62 0.15 117.51 119.14 8ica h ILE 319 Ca 0.47 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.35 8ica h ILE 319 Cb 0.78 0.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 8ica h ILE 319 CO -0.93 0.00 -0.40 -0.26 0.00 0.00 0.00 178.15 176.56 8ica h PHE 320 N -0.29 -1.19 -0.69 1.37 0.04 0.19 -1.62 116.94 114.75 8ica h PHE 320 Ca 0.04 0.04 0.15 0.00 2.80 0.00 0.00 57.97 61.01 8ica h PHE 320 Cb 0.34 0.53 -0.11 0.00 2.20 0.00 0.00 35.95 38.90 8ica h PHE 320 CO -0.20 -0.41 0.07 -0.44 -0.60 0.00 0.00 178.31 176.73 8ica h ASP 321 N -0.44 -0.19 -0.21 2.17 3.32 -0.77 0.31 116.42 120.61 8ica h ASP 321 Ca 0.02 0.16 0.05 0.00 0.02 0.00 0.00 57.03 57.28 8ica h ASP 321 Cb 0.50 0.26 -0.07 0.00 0.22 0.00 0.00 39.33 40.24 8ica h ASP 321 CO -0.31 -0.10 -0.41 1.88 -1.72 0.00 0.00 179.24 178.57 8ica h TYR 322 N 0.17 -1.18 -0.07 4.55 -1.99 -0.17 1.51 116.97 119.79 8ica h TYR 322 Ca 0.38 0.05 0.00 0.00 2.00 0.00 0.00 58.73 61.16 8ica h TYR 322 Cb 0.64 0.55 0.00 0.00 2.00 0.00 0.00 36.73 39.92 8ica h TYR 322 CO -0.34 -0.46 0.00 0.44 -0.00 0.00 0.00 178.16 177.80 8ica n ILE 323 N -5.43 0.09 -3.60 -2.88 -5.35 -0.27 -4.90 119.36 97.02 8ica n ILE 323 Ca -0.03 -0.10 -0.21 0.00 -0.27 0.00 0.00 62.75 62.14 8ica n ILE 323 Cb 0.36 -0.01 0.01 0.00 -1.74 0.00 0.00 39.64 38.26 8ica n ILE 323 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 8ica n GLN 324 N -0.36 -1.32 -2.83 6.28 10.64 0.52 -4.92 117.38 125.39 8ica n GLN 324 Ca 0.06 0.84 -0.10 0.00 -1.83 0.00 0.00 57.00 55.98 8ica n GLN 324 Cb 0.09 -3.61 -0.02 0.00 -0.86 0.00 0.00 30.24 25.84 8ica n GLN 324 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.06 177.10 8ica n TRP 325 N -2.91 0.27 -3.44 2.61 -0.00 -0.37 -4.94 117.44 108.66 8ica n TRP 325 Ca -0.17 -0.81 -0.38 0.00 -0.00 0.00 0.00 57.50 56.13 8ica n TRP 325 Cb 0.61 -0.07 -0.08 0.00 -0.00 0.00 0.00 31.31 31.76 8ica n TRP 325 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 177.69 176.10 8ica s LYS 326 N -2.56 4.10 0.16 5.87 -2.85 -1.26 -4.52 119.74 118.68 8ica s LYS 326 Ca 0.02 0.06 -0.32 0.00 -1.00 0.00 0.00 55.97 54.74 8ica s LYS 326 Cb 0.00 -3.58 -0.11 0.00 -2.06 0.00 0.00 37.83 32.08 8ica s LYS 326 CO 0.01 -0.10 1.78 0.98 0.10 0.00 0.00 175.35 178.12 8ica n TYR 327 N 4.71 2.65 -3.96 1.78 4.19 -1.26 -4.92 117.16 120.35 8ica n TYR 327 Ca -0.10 -0.04 -0.35 0.00 3.31 0.00 0.00 57.90 60.72 8ica n TYR 327 Cb 0.51 -2.70 -0.14 0.00 0.49 0.00 0.00 39.34 37.51 8ica n TYR 327 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 8ica s ARG 328 N 1.98 3.37 0.83 2.98 0.52 -1.26 -5.08 118.95 122.28 8ica s ARG 328 Ca 0.79 -0.63 -0.14 0.00 -0.52 0.00 0.00 55.73 55.23 8ica s ARG 328 Cb -0.51 -2.98 0.05 0.00 0.52 0.00 0.00 34.95 32.04 8ica s ARG 328 CO 0.35 -0.17 0.88 0.39 0.02 0.00 0.00 175.30 176.78 8ica n GLU 329 N 4.71 0.06 -0.23 3.54 1.02 -1.26 -4.78 120.64 123.70 8ica n GLU 329 Ca -0.18 0.09 -0.04 0.00 -0.02 0.00 0.00 57.16 57.00 8ica n GLU 329 Cb 0.51 -2.18 0.06 0.00 -0.02 0.00 0.00 31.44 29.81 8ica n GLU 329 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 8ica h PRO 330 N -0.99 0.78 -0.96 3.49 0.11 -1.97 -2.09 132.00 130.37 8ica h PRO 330 Ca -0.45 -0.05 0.27 0.00 0.11 0.00 0.00 66.00 65.88 8ica h PRO 330 Cb 1.30 -0.18 -0.17 0.00 0.11 0.00 0.00 31.00 32.06 8ica h PRO 330 CO 0.42 0.52 0.10 -0.22 -0.21 0.00 0.00 178.00 178.61 8ica h LYS 331 N 0.81 0.04 -0.61 1.05 3.64 -1.81 0.32 116.57 120.01 8ica h LYS 331 Ca 0.25 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 8ica h LYS 331 Cb -0.01 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 8ica h LYS 331 CO -0.09 0.02 0.00 -0.40 -2.27 0.00 0.00 179.45 176.72 8ica n ASP 332 N -5.43 3.59 -0.13 4.20 5.68 -0.82 -4.24 116.55 119.41 8ica n ASP 332 Ca 0.24 -2.27 0.00 0.00 -0.50 0.00 0.00 54.79 52.26 8ica n ASP 332 Cb 0.78 -0.48 0.00 0.00 -1.14 0.00 0.00 41.12 40.28 8ica n ASP 332 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 8ica n ARG 333 N 0.87 0.84 -0.36 0.11 5.12 0.11 -4.25 116.66 119.11 8ica n ARG 333 Ca 0.19 0.00 0.29 0.00 -1.93 0.00 0.00 57.85 56.41 8ica n ARG 333 Cb 0.66 -1.11 0.60 0.00 -1.16 0.00 0.00 32.46 31.45 8ica n ARG 333 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 8ica h SER 334 N 0.04 0.30 0.00 0.55 0.02 -1.76 -0.62 113.55 112.08 8ica h SER 334 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 8ica h SER 334 Cb 0.11 0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.68 8ica h SER 334 CO 0.00 -0.00 0.00 -1.84 -1.14 0.00 0.00 176.83 173.85