#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 9icy n THR 10 N 0.00 0.00 0.10 2.62 5.66 -1.26 -4.76 114.28 116.64 9icy n THR 10 Ca 0.00 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.99 9icy n THR 10 Cb 0.00 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 68.74 9icy n THR 10 CO 0.00 0.00 0.00 0.17 -3.05 0.00 0.00 175.07 172.19 9icy h LEU 11 N 0.00 0.00 0.00 1.09 -0.00 -1.96 -3.34 115.31 111.11 9icy h LEU 11 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 9icy h LEU 11 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 9icy h LEU 11 CO 0.00 0.66 -1.02 0.59 -0.00 0.00 0.00 178.44 178.67 9icy n ASN 12 N -3.21 0.86 -0.01 0.17 4.13 -1.26 -4.58 115.26 111.37 9icy n ASN 12 Ca -0.01 -0.67 -0.00 0.00 1.68 0.00 0.00 54.58 55.58 9icy n ASN 12 Cb 0.82 1.19 -0.00 0.00 -1.54 0.00 0.00 39.78 40.25 9icy n ASN 12 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 9icy n GLY 13 N 1.42 -0.69 0.39 7.41 0.00 -1.25 -1.95 105.19 110.52 9icy n GLY 13 Ca 0.02 0.15 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 9icy n GLY 13 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 9icy h GLY 14 N 0.00 -0.73 -0.28 -0.02 0.00 -1.90 1.16 103.07 101.30 9icy h GLY 14 Ca 0.00 0.48 0.21 0.00 0.00 0.00 0.00 47.33 48.02 9icy h GLY 14 CO -0.02 -0.25 0.24 -2.22 0.00 0.00 0.00 176.54 174.29 9icy h ILE 15 N -0.56 0.41 -0.04 2.60 2.04 -1.80 2.84 117.51 122.99 9icy h ILE 15 Ca 0.05 -0.09 -0.05 0.00 1.00 0.00 0.00 64.86 65.77 9icy h ILE 15 Cb 0.64 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 9icy h ILE 15 CO -0.30 0.05 -0.18 0.71 0.00 0.00 0.00 178.15 178.43 9icy h THR 16 N 0.26 1.47 -0.88 -0.27 1.35 -0.82 -2.52 112.91 111.51 9icy h THR 16 Ca 0.51 -1.66 0.04 0.00 -0.55 0.00 0.00 66.41 64.75 9icy h THR 16 Cb 0.96 2.45 -0.05 0.00 -1.73 0.00 0.00 68.15 69.78 9icy h THR 16 CO -0.59 0.46 0.58 0.44 -0.25 0.00 0.00 175.52 176.16 9icy h ASP 17 N -0.38 0.94 -0.39 5.36 3.32 0.73 0.73 116.42 126.74 9icy h ASP 17 Ca -0.01 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 9icy h ASP 17 Cb 0.84 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 9icy h ASP 17 CO 0.04 0.65 0.06 -0.03 -1.72 0.00 0.00 179.24 178.24 9icy h MET 18 N 1.09 0.64 -0.61 3.56 1.85 0.46 -2.30 114.93 119.63 9icy h MET 18 Ca 0.35 -0.17 0.11 0.00 -0.61 0.00 0.00 59.70 59.37 9icy h MET 18 Cb 0.03 -0.08 -0.08 0.00 0.43 0.00 0.00 31.60 31.90 9icy h MET 18 CO -0.11 0.70 0.19 -0.07 -0.40 0.00 0.00 176.91 177.22 9icy h LEU 19 N 0.49 0.13 -0.84 3.39 4.07 -0.83 -0.34 115.31 121.39 9icy h LEU 19 Ca 0.12 0.10 -0.12 0.00 0.08 0.00 0.00 57.88 58.05 9icy h LEU 19 Cb 0.37 0.10 -0.02 0.00 1.08 0.00 0.00 40.66 42.19 9icy h LEU 19 CO 0.01 0.07 -0.58 0.71 -1.08 0.00 0.00 178.44 177.57 9icy h THR 20 N 0.34 1.41 0.22 0.22 1.35 -0.87 -0.11 112.91 115.47 9icy h THR 20 Ca 0.32 -1.99 -0.01 0.00 -0.55 0.00 0.00 66.41 64.18 9icy h THR 20 Cb 0.44 2.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 9icy h THR 20 CO -0.36 0.57 -0.11 -0.33 -0.25 0.00 0.00 175.52 175.04 9icy h GLU 21 N 0.00 -0.29 0.02 4.72 5.08 -0.55 0.13 114.58 123.69 9icy h GLU 21 Ca -0.01 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 9icy h GLU 21 Cb 1.03 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 9icy h GLU 21 CO 0.08 -0.09 -0.17 -0.07 -1.00 0.00 0.00 179.01 177.76 9icy h LEU 22 N -0.45 -0.49 0.38 1.33 -0.00 -1.05 -2.56 115.31 112.47 9icy h LEU 22 Ca -0.03 0.07 -0.01 0.00 -0.00 0.00 0.00 57.88 57.91 9icy h LEU 22 Cb 0.34 0.20 -0.02 0.00 -0.00 0.00 0.00 40.66 41.18 9icy h LEU 22 CO 0.05 -0.23 -0.39 0.00 -0.00 0.00 0.00 178.44 177.87 9icy h ALA 23 N 0.62 -1.06 0.00 1.53 0.00 -0.89 -1.86 119.26 117.61 9icy h ALA 23 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.81 9icy h ALA 23 Cb 0.35 0.63 0.00 0.00 0.00 0.00 0.00 17.79 18.77 9icy h ALA 23 CO -0.15 -1.08 0.56 -0.91 0.00 0.00 0.00 179.25 177.67 9icy h ASN 24 N -0.77 0.00 0.00 0.00 2.35 -0.64 -1.37 115.58 115.15 9icy h ASN 24 Ca -0.05 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.68 9icy h ASN 24 Cb 0.67 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.04 9icy h ASN 24 CO -0.05 0.00 -0.10 0.15 -1.65 0.00 0.00 177.43 175.78 9icy h PHE 25 N 0.00 0.00 -0.85 1.19 3.57 -0.92 -3.11 116.94 116.83 9icy h PHE 25 Ca 0.00 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.53 9icy h PHE 25 Cb 1.13 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.82 9icy h PHE 25 CO 0.00 1.00 0.54 0.93 -2.23 0.00 0.00 178.31 178.55 9icy h GLU 26 N -1.00 1.03 0.71 1.11 4.39 -1.02 0.56 114.58 120.37 9icy h GLU 26 Ca -0.03 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 9icy h GLU 26 Cb 0.98 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 29.39 9icy h GLU 26 CO -0.02 0.68 -0.47 -0.22 -1.16 0.00 0.00 179.01 177.83 9icy h LYS 27 N 1.06 -1.08 0.07 2.33 1.63 -1.62 -2.76 116.57 116.21 9icy h LYS 27 Ca 0.34 0.07 -0.00 0.00 -0.85 0.00 0.00 60.65 60.21 9icy h LYS 27 Cb -0.00 0.25 0.00 0.00 -0.60 0.00 0.00 32.23 31.88 9icy h LYS 27 CO -0.11 -0.72 -0.03 -0.91 -3.45 0.00 0.00 179.45 174.22 9icy h ASN 28 N -1.12 -0.08 -0.22 4.20 -0.26 -1.44 -3.40 115.58 113.26 9icy h ASN 28 Ca -0.09 -0.26 -0.03 0.00 -0.56 0.00 0.00 56.30 55.36 9icy h ASN 28 Cb 0.91 0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 38.18 9icy h ASN 28 CO 0.07 0.52 0.01 0.58 -1.06 0.00 0.00 177.43 177.55 9icy h VAL 29 N -1.00 1.25 -6.29 2.81 2.07 -1.06 -3.44 116.25 110.59 9icy h VAL 29 Ca -0.01 -0.87 -0.49 0.00 0.82 0.00 0.00 66.70 66.15 9icy h VAL 29 Cb 0.33 1.39 0.01 0.00 -1.52 0.00 0.00 31.29 31.50 9icy h VAL 29 CO 0.02 0.27 -0.12 -1.54 0.02 0.00 0.00 177.57 176.21 9icy n SER 30 N -4.67 2.22 -2.97 0.57 3.41 -1.05 -5.03 113.62 106.09 9icy n SER 30 Ca -0.04 -2.58 -0.24 0.00 -0.26 0.00 0.00 58.87 55.75 9icy n SER 30 Cb 0.23 -0.30 -0.03 0.00 -0.26 0.00 0.00 64.21 63.84 9icy n SER 30 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 9icy n GLN 31 N -2.08 2.64 -3.11 4.33 7.27 -1.20 -4.25 117.38 120.99 9icy n GLN 31 Ca 0.11 -4.44 -0.33 0.00 0.07 0.00 0.00 57.00 52.40 9icy n GLN 31 Cb 0.58 -2.09 -0.03 0.00 2.41 0.00 0.00 30.24 31.11 9icy n GLN 31 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 9icy n ALA 32 N -0.13 4.76 -0.32 1.69 0.00 -1.13 -4.88 120.51 120.51 9icy n ALA 32 Ca 0.29 -4.75 0.30 0.00 0.00 0.00 0.00 53.44 49.28 9icy n ALA 32 Cb 0.48 -1.43 0.56 0.00 0.00 0.00 0.00 19.45 19.06 9icy n ALA 32 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 9icy h ILE 33 N 3.08 0.05 0.34 0.00 6.09 -1.90 0.49 117.51 125.65 9icy h ILE 33 Ca 0.23 -0.02 -0.01 0.00 -1.37 0.00 0.00 64.86 63.69 9icy h ILE 33 Cb 0.57 -0.01 -0.00 0.00 0.47 0.00 0.00 36.82 37.85 9icy h ILE 33 CO 1.02 0.01 -0.22 0.45 -3.07 0.00 0.00 178.15 176.34 9icy h HIS 34 N 0.05 -0.58 -0.38 2.19 3.86 -1.97 1.98 115.15 120.30 9icy h HIS 34 Ca 0.82 -0.00 0.04 0.00 -1.16 0.00 0.00 60.37 60.06 9icy h HIS 34 Cb 2.13 0.21 -0.04 0.00 1.06 0.00 0.00 27.41 30.77 9icy h HIS 34 CO -0.03 -0.32 0.16 0.87 0.86 0.00 0.00 177.93 179.47 9icy h LYS 35 N -0.52 0.33 -0.99 2.45 1.57 -1.82 0.89 116.57 118.47 9icy h LYS 35 Ca -0.05 -0.02 0.19 0.00 -1.87 0.00 0.00 60.65 58.91 9icy h LYS 35 Cb 0.42 -0.07 -0.10 0.00 0.08 0.00 0.00 32.23 32.56 9icy h LYS 35 CO 0.04 0.22 0.61 -0.92 -0.57 0.00 0.00 179.45 178.83 9icy h TYR 36 N 0.34 1.00 0.00 -1.35 3.20 0.20 1.36 116.97 121.71 9icy h TYR 36 Ca 0.17 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.93 9icy h TYR 36 Cb 0.11 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.06 9icy h TYR 36 CO -0.12 0.23 -0.65 -0.91 -1.64 0.00 0.00 178.16 175.07 9icy h ASN 37 N 0.72 0.00 0.70 -2.11 -0.26 0.71 -3.11 115.58 112.23 9icy h ASN 37 Ca 0.57 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 56.27 9icy h ASN 37 Cb 0.94 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 38.21 9icy h ASN 37 CO -0.35 0.65 -0.34 0.00 -1.06 0.00 0.00 177.43 176.33 9icy h ALA 38 N 1.35 -0.94 -0.63 -0.83 0.00 0.86 -2.71 119.26 116.36 9icy h ALA 38 Ca -0.01 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 54.82 9icy h ALA 38 Cb 1.23 0.36 -0.10 0.00 0.00 0.00 0.00 17.79 19.28 9icy h ALA 38 CO 0.08 -0.96 0.04 1.88 0.00 0.00 0.00 179.25 180.30 9icy h TYR 39 N -1.07 0.04 -0.54 0.00 0.05 -1.04 -1.75 116.97 112.66 9icy h TYR 39 Ca -0.10 0.04 0.02 0.00 0.05 0.00 0.00 58.73 58.75 9icy h TYR 39 Cb 0.75 0.08 -0.03 0.00 1.01 0.00 0.00 36.73 38.54 9icy h TYR 39 CO -0.01 -0.14 0.33 0.07 -1.05 0.00 0.00 178.16 177.37 9icy h ARG 40 N 0.16 0.65 -0.11 4.88 0.11 -1.49 0.84 114.38 119.42 9icy h ARG 40 Ca 0.34 -0.04 -0.17 0.00 0.10 0.00 0.00 59.98 60.21 9icy h ARG 40 Cb 0.54 -0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.47 9icy h ARG 40 CO -0.51 0.43 -0.64 1.57 0.10 0.00 0.00 179.97 180.93 9icy h LYS 41 N 0.67 0.42 -0.40 0.08 -0.00 -1.11 0.32 116.57 116.55 9icy h LYS 41 Ca 0.21 -0.30 -0.06 0.00 -0.00 0.00 0.00 60.65 60.50 9icy h LYS 41 Cb -0.02 0.05 -0.01 0.00 -0.00 0.00 0.00 32.23 32.25 9icy h LYS 41 CO -0.08 0.92 0.00 0.00 -0.00 0.00 0.00 179.45 180.29 9icy h ALA 42 N 1.01 0.54 -0.72 0.07 0.00 -1.17 -1.18 119.26 117.82 9icy h ALA 42 Ca -0.01 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 9icy h ALA 42 Cb 1.18 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 9icy h ALA 42 CO 0.11 0.32 0.31 0.00 0.00 0.00 0.00 179.25 179.99 9icy h ALA 43 N 0.89 1.19 -0.78 0.00 0.00 0.93 -1.42 119.26 120.07 9icy h ALA 43 Ca 0.12 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 9icy h ALA 43 Cb 0.47 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 9icy h ALA 43 CO 0.02 0.60 0.29 1.03 0.00 0.00 0.00 179.25 181.19 9icy h SER 44 N 1.03 1.09 0.01 0.00 0.87 0.25 -2.96 113.55 113.85 9icy h SER 44 Ca 0.25 -0.18 -0.11 0.00 -1.23 0.00 0.00 61.79 60.51 9icy h SER 44 Cb 0.16 -0.28 0.01 0.00 -0.44 0.00 0.00 62.40 61.85 9icy h SER 44 CO -0.03 0.98 -0.45 -0.37 -0.53 0.00 0.00 176.83 176.43 9icy h VAL 45 N 1.14 1.50 -0.40 2.23 -1.51 -0.94 -3.15 116.25 115.12 9icy h VAL 45 Ca 0.26 -2.07 -0.01 0.00 -1.23 0.00 0.00 66.70 63.65 9icy h VAL 45 Cb 0.25 2.74 -0.02 0.00 -2.13 0.00 0.00 31.29 32.13 9icy h VAL 45 CO -0.02 0.58 0.20 0.16 -1.23 0.00 0.00 177.57 177.27 9icy h ILE 46 N -0.32 1.14 -0.94 7.19 3.07 -1.36 -1.21 117.51 125.08 9icy h ILE 46 Ca -0.06 -0.37 0.14 0.00 1.55 0.00 0.00 64.86 66.12 9icy h ILE 46 Cb 1.20 0.62 -0.08 0.00 -0.27 0.00 0.00 36.82 38.29 9icy h ILE 46 CO 0.09 0.15 0.60 0.00 -1.05 0.00 0.00 178.15 177.94 9icy h ALA 47 N 1.67 1.74 0.01 0.16 0.00 -1.56 -2.27 119.26 119.01 9icy h ALA 47 Ca 0.14 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 9icy h ALA 47 Cb 0.05 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.71 9icy h ALA 47 CO -0.02 0.00 -0.53 0.87 0.00 0.00 0.00 179.25 179.57 9icy h LYS 48 N 0.78 0.33 -6.01 0.00 1.57 -1.20 -3.37 116.57 108.67 9icy h LYS 48 Ca 0.48 -0.38 -0.81 0.00 -1.87 0.00 0.00 60.65 58.07 9icy h LYS 48 Cb 0.69 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.10 9icy h LYS 48 CO -0.24 1.07 1.06 0.98 -0.57 0.00 0.00 179.45 181.75 9icy n TYR 49 N -4.28 1.46 0.00 -1.35 9.36 -0.85 -4.81 117.16 116.69 9icy n TYR 49 Ca -0.11 0.88 0.00 0.00 3.32 0.00 0.00 57.90 62.00 9icy n TYR 49 Cb 0.65 -2.29 0.00 0.00 -0.63 0.00 0.00 39.34 37.07 9icy n TYR 49 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 9icy n PRO 50 N 6.06 0.00 -3.89 2.98 -0.04 -1.26 -4.81 135.00 134.04 9icy n PRO 50 Ca 0.44 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.80 9icy n PRO 50 Cb -0.03 -1.28 -0.06 0.00 -0.04 0.00 0.00 33.50 32.09 9icy n PRO 50 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 9icy s HIS 51 N -1.94 0.24 -0.23 0.54 3.76 -1.26 -5.11 115.29 111.29 9icy s HIS 51 Ca 0.00 -0.60 -0.29 0.00 -0.15 0.00 0.00 55.06 54.02 9icy s HIS 51 Cb 0.00 0.05 -0.04 0.00 1.11 0.00 0.00 32.58 33.70 9icy s HIS 51 CO 0.00 -0.74 1.94 0.15 -0.85 0.00 0.00 174.74 175.24 9icy s LYS 52 N -3.93 3.42 -0.15 1.40 1.02 -1.26 -4.84 119.74 115.41 9icy s LYS 52 Ca 0.14 1.83 -0.29 0.00 0.02 0.00 0.00 55.97 57.66 9icy s LYS 52 Cb 0.03 -4.23 -0.05 0.00 -0.52 0.00 0.00 37.83 33.05 9icy s LYS 52 CO -0.02 -1.76 1.90 0.42 -0.92 0.00 0.00 175.35 174.97 9icy s ILE 53 N 6.87 3.29 -0.98 2.17 1.01 -1.26 -4.84 121.20 127.47 9icy s ILE 53 Ca 0.87 0.33 0.24 0.00 0.00 0.00 0.00 60.65 62.09 9icy s ILE 53 Cb -0.29 -3.30 -0.07 0.00 0.01 0.00 0.00 42.46 38.81 9icy s ILE 53 CO 0.34 -0.12 1.24 0.29 0.00 0.00 0.00 174.94 176.69 9icy n LYS 54 N 7.97 0.02 -3.76 2.79 4.01 -1.26 -5.01 118.16 122.92 9icy n LYS 54 Ca 0.23 0.00 -0.02 0.00 -0.51 0.00 0.00 58.31 58.01 9icy n LYS 54 Cb 0.44 -1.51 -0.00 0.00 -0.51 0.00 0.00 35.03 33.45 9icy n LYS 54 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 9icy s SER 55 N -3.06 -0.10 0.01 4.39 1.04 -1.26 -5.03 113.70 109.69 9icy s SER 55 Ca 0.10 -0.40 -0.25 0.00 0.48 0.00 0.00 55.95 55.88 9icy s SER 55 Cb 0.17 0.40 -0.17 0.00 0.10 0.00 0.00 66.02 66.52 9icy s SER 55 CO 0.76 -0.76 1.25 1.23 0.98 0.00 0.00 173.24 176.69 9icy h GLY 56 N 2.00 -0.34 -0.93 7.32 0.00 -1.89 -2.19 103.07 107.03 9icy h GLY 56 Ca -0.26 0.13 0.28 0.00 0.00 0.00 0.00 47.33 47.47 9icy h GLY 56 CO 0.29 -0.12 0.08 0.00 0.00 0.00 0.00 176.54 176.78 9icy h ALA 57 N -0.06 1.25 -0.43 3.60 0.00 -1.96 1.73 119.26 123.39 9icy h ALA 57 Ca -0.03 0.33 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 9icy h ALA 57 Cb 0.48 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 9icy h ALA 57 CO 0.06 -0.60 0.23 1.49 0.00 0.00 0.00 179.25 180.43 9icy h GLU 58 N 0.02 0.61 0.53 0.00 4.81 -1.95 -2.64 114.58 115.95 9icy h GLU 58 Ca 0.61 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.74 9icy h GLU 58 Cb 1.30 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 30.57 9icy h GLU 58 CO -0.89 0.49 -0.26 0.00 -0.73 0.00 0.00 179.01 177.62 9icy h ALA 59 N 1.08 -0.71 -1.08 2.92 0.00 0.75 -3.29 119.26 118.92 9icy h ALA 59 Ca 0.15 -0.19 0.40 0.00 0.00 0.00 0.00 54.91 55.26 9icy h ALA 59 Cb 0.07 0.28 -0.13 0.00 0.00 0.00 0.00 17.79 18.00 9icy h ALA 59 CO -0.02 -0.78 0.66 1.17 0.00 0.00 0.00 179.25 180.28 9icy n LYS 60 N -5.31 -0.04 0.18 0.00 4.81 0.54 0.87 118.16 119.21 9icy n LYS 60 Ca -0.11 1.12 0.18 0.00 -0.87 0.00 0.00 58.31 58.64 9icy n LYS 60 Cb 0.32 -2.14 0.77 0.00 0.02 0.00 0.00 35.03 34.00 9icy n LYS 60 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 9icy h LYS 61 N 0.00 0.00 -7.21 1.64 1.57 -1.54 -3.43 116.57 107.59 9icy h LYS 61 Ca 0.75 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 59.03 9icy h LYS 61 Cb 2.28 0.00 0.09 0.00 0.08 0.00 0.00 32.23 34.69 9icy h LYS 61 CO -0.49 0.00 0.37 -0.51 -0.57 0.00 0.00 179.45 178.25 9icy s LEU 62 N -6.88 3.38 -0.20 2.94 1.02 0.25 -5.00 118.68 114.20 9icy s LEU 62 Ca -0.04 1.91 -0.29 0.00 0.02 0.00 0.00 54.13 55.73 9icy s LEU 62 Cb 0.13 -4.54 0.00 0.00 0.02 0.00 0.00 46.19 41.80 9icy s LEU 62 CO 0.46 -1.52 1.05 -2.84 0.02 0.00 0.00 176.35 173.52 9icy s PRO 63 N -4.20 4.29 0.00 1.29 0.02 -1.26 -1.99 135.00 133.15 9icy s PRO 63 Ca 0.65 1.39 0.00 0.00 0.02 0.00 0.00 61.00 63.06 9icy s PRO 63 Cb -0.19 -3.63 0.00 0.00 0.02 0.00 0.00 34.50 30.71 9icy s PRO 63 CO 0.42 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.93 9icy n GLY 64 N 3.29 1.03 3.45 0.52 0.00 -1.26 -4.68 105.19 107.54 9icy n GLY 64 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 9icy n GLY 64 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 9icy s VAL 65 N -2.68 4.37 0.92 1.61 -7.23 -0.84 -4.67 120.40 111.87 9icy s VAL 65 Ca 0.00 -0.37 -0.14 0.00 -1.81 0.00 0.00 61.98 59.66 9icy s VAL 65 Cb 0.00 -4.66 0.18 0.00 0.56 0.00 0.00 36.38 32.46 9icy s VAL 65 CO 0.00 -1.41 1.27 -0.83 -0.31 0.00 0.00 175.10 173.82 9icy s GLY 66 N 3.62 1.76 0.15 2.32 0.00 -1.26 -4.66 107.32 109.24 9icy s GLY 66 Ca 0.22 -1.18 0.04 0.00 0.00 0.00 0.00 44.72 43.79 9icy s GLY 66 CO 0.10 -0.47 1.34 0.00 0.00 0.00 0.00 173.10 174.07 9icy h THR 67 N -1.46 1.56 -0.30 0.90 1.03 -1.95 -2.19 112.91 110.50 9icy h THR 67 Ca -0.44 -2.88 -0.11 0.00 -0.01 0.00 0.00 66.41 62.98 9icy h THR 67 Cb 1.25 2.62 -0.01 0.00 -1.07 0.00 0.00 68.15 70.94 9icy h THR 67 CO 0.42 0.83 -0.22 0.11 -0.01 0.00 0.00 175.52 176.65 9icy h LYS 68 N 0.06 0.69 0.00 0.00 1.57 -2.00 -2.86 116.57 114.03 9icy h LYS 68 Ca -0.04 -0.33 -0.14 0.00 -1.87 0.00 0.00 60.65 58.27 9icy h LYS 68 Cb 1.61 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.90 9icy h LYS 68 CO 0.14 0.94 -0.65 0.82 -0.57 0.00 0.00 179.45 180.12 9icy h ILE 69 N 0.44 1.27 -0.59 1.86 2.04 -1.96 -2.89 117.51 117.67 9icy h ILE 69 Ca 0.06 -2.40 -0.01 0.00 1.00 0.00 0.00 64.86 63.51 9icy h ILE 69 Cb 0.77 2.37 -0.03 0.00 -0.74 0.00 0.00 36.82 39.19 9icy h ILE 69 CO 0.06 0.64 0.34 0.00 0.00 0.00 0.00 178.15 179.18 9icy h ALA 70 N 1.35 0.76 -0.26 1.87 0.00 -1.29 -0.84 119.26 120.85 9icy h ALA 70 Ca -0.01 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.86 9icy h ALA 70 Cb 1.31 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 9icy h ALA 70 CO 0.08 0.27 -0.01 1.49 0.00 0.00 0.00 179.25 181.08 9icy h GLU 71 N 0.80 0.06 -0.51 0.00 4.81 -1.48 0.23 114.58 118.50 9icy h GLU 71 Ca 0.21 -0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.34 9icy h GLU 71 Cb 0.03 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 9icy h GLU 71 CO -0.04 0.04 -0.05 0.87 -0.73 0.00 0.00 179.01 179.11 9icy h LYS 72 N 0.06 0.90 -0.17 1.92 1.57 -1.29 -2.43 116.57 117.12 9icy h LYS 72 Ca 0.12 -0.28 0.02 0.00 -1.87 0.00 0.00 60.65 58.63 9icy h LYS 72 Cb 0.16 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 9icy h LYS 72 CO -0.21 0.93 0.06 0.82 -0.57 0.00 0.00 179.45 180.47 9icy h ILE 73 N 0.82 0.97 -0.00 1.86 2.04 -0.02 -0.50 117.51 122.67 9icy h ILE 73 Ca 0.14 -0.05 0.01 0.00 1.00 0.00 0.00 64.86 65.96 9icy h ILE 73 Cb 0.56 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 9icy h ILE 73 CO 0.03 0.03 -0.05 0.44 0.00 0.00 0.00 178.15 178.60 9icy h ASP 74 N 0.15 -0.15 -0.71 1.72 3.32 -0.70 0.72 116.42 120.78 9icy h ASP 74 Ca 0.07 0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.21 9icy h ASP 74 Cb 0.04 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.61 9icy h ASP 74 CO -0.07 -0.08 0.47 -0.08 -1.72 0.00 0.00 179.24 177.76 9icy h GLU 75 N -0.09 0.70 -0.00 3.56 4.81 -1.27 0.87 114.58 123.16 9icy h GLU 75 Ca 0.02 -0.04 -0.21 0.00 -0.13 0.00 0.00 59.36 59.00 9icy h GLU 75 Cb 0.12 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 9icy h GLU 75 CO -0.05 0.47 -0.89 0.35 -0.73 0.00 0.00 179.01 178.15 9icy h PHE 76 N 0.73 0.43 -0.38 0.92 3.04 -0.34 -1.50 116.94 119.84 9icy h PHE 76 Ca 0.31 -0.23 -0.16 0.00 3.98 0.00 0.00 57.97 61.87 9icy h PHE 76 Cb 0.28 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 38.74 9icy h PHE 76 CO -0.00 1.04 -0.40 -0.07 -2.02 0.00 0.00 178.31 176.86 9icy h LEU 77 N 0.17 1.00 0.06 0.59 4.07 0.39 -3.32 115.31 118.26 9icy h LEU 77 Ca -0.06 -0.47 -0.00 0.00 0.08 0.00 0.00 57.88 57.43 9icy h LEU 77 Cb 1.51 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.97 9icy h LEU 77 CO 0.14 1.27 -0.03 0.00 -1.08 0.00 0.00 178.44 178.75 9icy h ALA 78 N 0.77 -0.75 -3.09 1.53 0.00 0.58 -3.43 119.26 114.87 9icy h ALA 78 Ca 0.06 -0.02 -0.59 0.00 0.00 0.00 0.00 54.91 54.36 9icy h ALA 78 Cb 1.00 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.71 9icy h ALA 78 CO 0.10 -0.75 -0.33 0.95 0.00 0.00 0.00 179.25 179.22 9icy s THR 79 N -2.64 5.30 -0.14 0.00 -4.23 -0.57 -4.95 115.64 108.41 9icy s THR 79 Ca -0.01 0.53 0.00 0.00 -1.18 0.00 0.00 61.69 61.03 9icy s THR 79 Cb 0.00 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.21 9icy s THR 79 CO 0.03 0.37 0.00 0.61 -0.54 0.00 0.00 174.62 175.10 9icy n GLY 80 N 3.51 0.00 1.63 3.99 0.00 -1.26 -4.24 105.19 108.82 9icy n GLY 80 Ca -0.12 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.84 9icy n GLY 80 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 9icy n LYS 81 N 0.79 0.40 -3.85 1.61 4.76 -1.26 -5.08 118.16 115.53 9icy n LYS 81 Ca 0.00 -1.21 -0.12 0.00 -2.87 0.00 0.00 58.31 54.11 9icy n LYS 81 Cb 0.00 1.27 -0.13 0.00 -1.84 0.00 0.00 35.03 34.32 9icy n LYS 81 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 9icy s LEU 82 N 0.00 1.74 -0.02 -0.35 2.96 -1.26 -3.80 118.68 117.95 9icy s LEU 82 Ca 0.11 0.13 -0.24 0.00 -0.22 0.00 0.00 54.13 53.91 9icy s LEU 82 Cb -0.01 0.22 -0.18 0.00 0.50 0.00 0.00 46.19 46.72 9icy s LEU 82 CO 0.08 -0.02 1.15 -0.09 -1.32 0.00 0.00 176.35 176.15 9icy h ARG 83 N 6.05 -0.14 -0.51 1.98 2.43 -1.98 -0.59 114.38 121.62 9icy h ARG 83 Ca -0.25 0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.07 9icy h ARG 83 Cb 1.20 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.76 9icy h ARG 83 CO 0.47 0.30 0.36 -0.22 -1.51 0.00 0.00 179.97 179.37 9icy h LYS 84 N -0.65 0.08 0.25 0.20 3.64 -1.97 1.10 116.57 119.21 9icy h LYS 84 Ca -0.02 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 9icy h LYS 84 Cb 0.51 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 9icy h LYS 84 CO 0.02 0.05 -0.12 1.25 -2.27 0.00 0.00 179.45 178.39 9icy h LEU 85 N 0.08 -0.28 0.03 5.20 5.85 -1.92 -2.17 115.31 122.10 9icy h LEU 85 Ca 0.24 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.75 9icy h LEU 85 Cb 0.85 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 9icy h LEU 85 CO -0.02 0.13 -0.19 1.05 -0.34 0.00 0.00 178.44 179.07 9icy h GLU 86 N -0.75 -0.31 -0.87 1.25 4.11 0.11 -1.04 114.58 117.08 9icy h GLU 86 Ca -0.03 0.02 0.22 0.00 0.07 0.00 0.00 59.36 59.64 9icy h GLU 86 Cb 0.50 0.07 -0.13 0.00 0.50 0.00 0.00 28.75 29.69 9icy h GLU 86 CO 0.06 -0.20 0.32 -0.22 0.07 0.00 0.00 179.01 179.03 9icy h LYS 87 N -0.32 0.30 -0.24 1.06 3.64 0.10 -2.02 116.57 119.10 9icy h LYS 87 Ca 0.05 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.34 9icy h LYS 87 Cb 0.37 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 9icy h LYS 87 CO -0.15 0.20 -0.11 0.82 -2.27 0.00 0.00 179.45 177.94 9icy h ILE 88 N 0.31 1.30 -0.81 2.00 2.04 -0.70 -1.89 117.51 119.76 9icy h ILE 88 Ca 0.55 -1.18 0.04 0.00 1.00 0.00 0.00 64.86 65.27 9icy h ILE 88 Cb 1.06 1.57 -0.05 0.00 -0.74 0.00 0.00 36.82 38.66 9icy h ILE 88 CO -0.58 0.37 0.53 -0.09 0.00 0.00 0.00 178.15 178.38 9icy h ARG 89 N 0.22 0.94 0.35 2.37 1.12 -0.55 -2.92 114.38 115.90 9icy h ARG 89 Ca 0.05 -0.06 -0.02 0.00 -1.11 0.00 0.00 59.98 58.85 9icy h ARG 89 Cb 0.61 -0.21 0.00 0.00 -0.01 0.00 0.00 29.97 30.36 9icy h ARG 89 CO 0.03 0.62 -0.17 1.96 -3.11 0.00 0.00 179.97 179.31 9icy h GLN 90 N 0.96 -0.45 -0.74 0.20 4.20 -1.38 -3.46 115.11 114.45 9icy h GLN 90 Ca 0.33 0.03 -0.10 0.00 0.06 0.00 0.00 58.65 58.97 9icy h GLN 90 Cb 0.10 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.98 9icy h GLN 90 CO -0.11 -0.30 0.14 -3.47 -0.67 0.00 0.00 178.83 174.43 9icy n ASP 91 N -4.53 0.11 -0.04 1.46 2.03 -0.71 -4.75 116.55 110.11 9icy n ASP 91 Ca -0.06 0.10 -0.10 0.00 0.52 0.00 0.00 54.79 55.25 9icy n ASP 91 Cb 0.18 -0.11 0.04 0.00 -0.72 0.00 0.00 41.12 40.52 9icy n ASP 91 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 9icy h ASP 92 N 0.97 0.75 -0.17 1.67 2.03 -1.90 0.14 116.42 119.90 9icy h ASP 92 Ca -0.02 -0.36 -0.01 0.00 -0.73 0.00 0.00 57.03 55.91 9icy h ASP 92 Cb 0.17 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.45 9icy h ASP 92 CO 0.13 1.09 0.08 0.74 -1.03 0.00 0.00 179.24 180.25 9icy h THR 93 N 0.55 1.13 0.27 1.15 2.02 -1.96 0.14 112.91 116.21 9icy h THR 93 Ca 0.03 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.84 9icy h THR 93 Cb 1.00 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 9icy h THR 93 CO 0.09 0.12 -0.18 -1.28 0.37 0.00 0.00 175.52 174.64 9icy h SER 94 N 0.15 -0.46 -0.89 4.18 0.87 -1.85 -1.50 113.55 114.05 9icy h SER 94 Ca 0.06 0.03 0.22 0.00 -1.23 0.00 0.00 61.79 60.87 9icy h SER 94 Cb 0.12 0.14 -0.13 0.00 -0.44 0.00 0.00 62.40 62.10 9icy h SER 94 CO -0.01 -0.29 0.37 0.28 -0.53 0.00 0.00 176.83 176.65 9icy h SER 95 N -0.45 0.28 -0.68 6.23 0.02 -0.40 -0.20 113.55 118.36 9icy h SER 95 Ca -0.02 0.16 -0.06 0.00 -0.84 0.00 0.00 61.79 61.02 9icy h SER 95 Cb 0.38 0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.04 9icy h SER 95 CO 0.01 -0.02 0.18 0.28 -1.14 0.00 0.00 176.83 176.15 9icy h SER 96 N 0.37 1.02 -0.14 3.07 0.02 -0.22 -2.68 113.55 114.99 9icy h SER 96 Ca 0.55 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 61.27 9icy h SER 96 Cb 1.05 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.32 9icy h SER 96 CO -0.54 0.98 0.05 0.40 -1.14 0.00 0.00 176.83 176.58 9icy h ILE 97 N 1.01 1.17 -0.84 3.27 2.04 -0.02 -1.26 117.51 122.88 9icy h ILE 97 Ca 0.22 -0.52 0.19 0.00 1.00 0.00 0.00 64.86 65.74 9icy h ILE 97 Cb 0.34 1.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.62 9icy h ILE 97 CO -0.00 0.16 0.56 0.78 0.00 0.00 0.00 178.15 179.65 9icy h ASN 98 N 0.06 0.35 0.00 1.72 4.21 -1.30 -2.80 115.58 117.82 9icy h ASN 98 Ca 0.05 0.03 -0.01 0.00 1.21 0.00 0.00 56.30 57.58 9icy h ASN 98 Cb 0.20 -0.04 -0.00 0.00 -1.12 0.00 0.00 38.32 37.37 9icy h ASN 98 CO -0.00 0.15 -0.04 0.15 -1.29 0.00 0.00 177.43 176.40 9icy h PHE 99 N 0.36 0.00 -1.00 1.19 3.04 -1.21 -3.37 116.94 115.95 9icy h PHE 99 Ca 0.43 0.00 0.15 0.00 3.98 0.00 0.00 57.97 62.53 9icy h PHE 99 Cb 1.11 0.00 -0.09 0.00 2.56 0.00 0.00 35.95 39.53 9icy h PHE 99 CO -0.00 0.82 0.62 -0.07 -2.02 0.00 0.00 178.31 177.66 9icy h LEU 100 N -1.00 0.85 -0.15 0.59 4.07 -1.04 0.82 115.31 119.45 9icy h LEU 100 Ca -0.01 0.07 0.00 0.00 0.08 0.00 0.00 57.88 58.02 9icy h LEU 100 Cb 0.81 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.46 9icy h LEU 100 CO -0.01 0.39 0.30 0.41 -1.08 0.00 0.00 178.44 178.45 9icy n THR 101 N -4.68 0.83 0.19 0.22 -1.04 -1.07 -0.93 114.28 107.80 9icy n THR 101 Ca 0.21 0.55 0.08 0.00 -2.04 0.00 0.00 64.05 62.85 9icy n THR 101 Cb 0.46 -1.55 0.26 0.00 -1.82 0.00 0.00 70.33 67.67 9icy n THR 101 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 9icy h ARG 102 N 0.00 0.00 -6.61 -2.82 3.08 -1.03 -3.43 114.38 103.57 9icy h ARG 102 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 9icy h ARG 102 Cb 0.59 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.66 9icy h ARG 102 CO 0.00 0.29 0.59 0.08 -1.07 0.00 0.00 179.97 179.86 9icy s VAL 103 N -3.32 3.61 -0.08 2.04 1.01 -0.11 -4.90 120.40 118.65 9icy s VAL 103 Ca 0.03 1.27 -0.29 0.00 0.00 0.00 0.00 61.98 62.99 9icy s VAL 103 Cb 0.08 -3.81 -0.06 0.00 0.00 0.00 0.00 36.38 32.59 9icy s VAL 103 CO 0.68 0.17 1.79 -0.55 0.00 0.00 0.00 175.10 177.18 9icy s SER 104 N 0.48 6.42 0.00 3.32 0.15 -1.26 -0.82 113.70 121.99 9icy s SER 104 Ca 0.56 2.18 0.00 0.00 0.70 0.00 0.00 55.95 59.39 9icy s SER 104 Cb -0.33 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.45 9icy s SER 104 CO 0.34 -1.14 0.00 0.61 1.20 0.00 0.00 173.24 174.25 9icy n GLY 105 N 4.52 1.62 3.65 9.45 0.00 -1.26 -3.73 105.19 119.44 9icy n GLY 105 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 9icy n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 9icy s ILE 106 N -2.09 4.57 0.29 -0.61 1.01 0.00 -4.76 121.20 119.62 9icy s ILE 106 Ca 0.00 -0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.54 9icy s ILE 106 Cb 0.00 -3.00 -0.01 0.00 0.01 0.00 0.00 42.46 39.46 9icy s ILE 106 CO 0.00 0.53 0.06 0.61 0.00 0.00 0.00 174.94 176.14 9icy n GLY 107 N 2.93 3.62 0.37 6.18 0.00 -1.26 -4.62 105.19 112.41 9icy n GLY 107 Ca -0.18 -2.14 0.04 0.00 0.00 0.00 0.00 46.02 43.74 9icy n GLY 107 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 9icy h PRO 108 N 0.00 1.08 0.79 1.61 0.11 -1.94 0.22 132.00 133.87 9icy h PRO 108 Ca -0.23 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.77 9icy h PRO 108 Cb 0.82 -0.24 0.01 0.00 0.11 0.00 0.00 31.00 31.69 9icy h PRO 108 CO 0.38 0.71 -0.38 1.03 -0.21 0.00 0.00 178.00 179.53 9icy h SER 109 N 1.11 -0.90 -0.37 -2.05 0.87 -1.96 0.13 113.55 110.39 9icy h SER 109 Ca 0.46 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 61.01 9icy h SER 109 Cb 0.29 0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.46 9icy h SER 109 CO -0.21 -0.63 0.13 0.00 -0.53 0.00 0.00 176.83 175.59 9icy h ALA 110 N -0.87 1.42 0.28 6.23 0.00 -1.91 -1.64 119.26 122.77 9icy h ALA 110 Ca -0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 9icy h ALA 110 Cb 0.82 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.43 9icy h ALA 110 CO 0.18 0.43 -0.13 0.00 0.00 0.00 0.00 179.25 179.72 9icy h ALA 111 N 1.53 -0.37 -0.46 0.00 0.00 -0.28 -0.39 119.26 119.29 9icy h ALA 111 Ca 0.15 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.99 9icy h ALA 111 Cb 0.19 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 9icy h ALA 111 CO -0.01 -0.68 0.24 0.00 0.00 0.00 0.00 179.25 178.81 9icy h ARG 112 N -0.43 0.47 -0.71 0.00 3.08 -0.49 -2.48 114.38 113.82 9icy h ARG 112 Ca -0.04 -0.03 0.14 0.00 0.07 0.00 0.00 59.98 60.12 9icy h ARG 112 Cb 0.33 -0.11 -0.09 0.00 0.08 0.00 0.00 29.97 30.18 9icy h ARG 112 CO 0.06 0.31 0.24 -0.22 -1.07 0.00 0.00 179.97 179.29 9icy h LYS 113 N 0.49 0.36 -0.83 0.04 3.64 -1.02 -1.44 116.57 117.81 9icy h LYS 113 Ca 0.20 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.57 9icy h LYS 113 Cb 0.08 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 9icy h LYS 113 CO -0.13 0.24 0.55 0.74 -2.27 0.00 0.00 179.45 178.58 9icy h PHE 114 N 0.37 1.03 -0.00 1.91 0.04 -0.62 -2.29 116.94 117.38 9icy h PHE 114 Ca 0.39 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 61.18 9icy h PHE 114 Cb 0.60 -0.35 -0.00 0.00 2.20 0.00 0.00 35.95 38.40 9icy h PHE 114 CO -0.20 0.63 -0.00 0.28 -0.60 0.00 0.00 178.31 178.42 9icy h VAL 115 N 1.09 1.33 -0.42 -0.55 2.07 -1.13 1.04 116.25 119.68 9icy h VAL 115 Ca 0.31 -0.97 0.12 0.00 0.82 0.00 0.00 66.70 66.98 9icy h VAL 115 Cb -0.08 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 9icy h VAL 115 CO -0.08 0.25 0.38 0.44 0.02 0.00 0.00 177.57 178.59 9icy h ASP 116 N -0.41 0.00 0.97 0.57 3.32 -1.09 2.58 116.42 122.36 9icy h ASP 116 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 9icy h ASP 116 Cb 0.42 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 9icy h ASP 116 CO 0.00 0.00 -1.08 -0.33 -1.72 0.00 0.00 179.24 176.11 9icy h GLU 117 N 0.00 0.00 0.00 3.56 5.08 -0.99 -3.48 114.58 118.74 9icy h GLU 117 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 9icy h GLU 117 Cb 0.95 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.20 9icy h GLU 117 CO -0.00 0.17 0.00 0.41 -1.00 0.00 0.00 179.01 178.59 9icy n GLY 118 N 1.28 0.84 3.55 -3.84 0.00 0.87 -5.05 105.19 102.84 9icy n GLY 118 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 9icy n GLY 118 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 9icy s ILE 119 N -2.00 3.75 -0.15 -0.61 1.01 0.31 -4.68 121.20 118.83 9icy s ILE 119 Ca 0.00 0.13 0.17 0.00 0.00 0.00 0.00 60.65 60.96 9icy s ILE 119 Cb 0.00 -4.91 -0.26 0.00 0.01 0.00 0.00 42.46 37.30 9icy s ILE 119 CO 0.00 -1.84 0.44 0.29 0.00 0.00 0.00 174.94 173.83 9icy n LYS 120 N 9.26 0.67 -4.38 2.79 5.02 -1.26 -4.07 118.16 126.20 9icy n LYS 120 Ca 0.11 -0.13 -0.25 0.00 -2.02 0.00 0.00 58.31 56.01 9icy n LYS 120 Cb 0.50 -1.40 -0.09 0.00 -0.02 0.00 0.00 35.03 34.02 9icy n LYS 120 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 9icy s THR 121 N -3.12 2.46 0.43 -0.18 -1.32 -1.26 -4.80 115.64 107.85 9icy s THR 121 Ca -0.04 -1.98 0.11 0.00 -1.21 0.00 0.00 61.69 58.57 9icy s THR 121 Cb 0.11 -2.82 0.30 0.00 -1.51 0.00 0.00 72.50 68.58 9icy s THR 121 CO 0.72 -0.15 2.02 0.25 -2.21 0.00 0.00 174.62 175.25 9icy h LEU 122 N 1.79 0.39 -0.28 9.08 6.46 -1.97 0.64 115.31 131.41 9icy h LEU 122 Ca -0.43 -0.00 -0.19 0.00 -0.12 0.00 0.00 57.88 57.15 9icy h LEU 122 Cb 1.25 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 41.10 9icy h LEU 122 CO 0.69 0.26 -0.55 -0.33 -0.62 0.00 0.00 178.44 177.89 9icy h GLU 123 N 0.45 0.87 -0.65 1.25 5.08 -1.99 -1.56 114.58 118.03 9icy h GLU 123 Ca 0.21 -0.56 0.06 0.00 -1.00 0.00 0.00 59.36 58.07 9icy h GLU 123 Cb 0.28 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 9icy h GLU 123 CO -0.06 1.19 0.43 -0.44 -1.00 0.00 0.00 179.01 179.14 9icy h ASP 124 N 0.65 0.59 -0.05 1.42 5.19 -1.39 0.36 116.42 123.19 9icy h ASP 124 Ca 0.01 0.00 0.03 0.00 -0.62 0.00 0.00 57.03 56.46 9icy h ASP 124 Cb 1.16 -0.13 -0.04 0.00 0.18 0.00 0.00 39.33 40.50 9icy h ASP 124 CO 0.12 0.39 -0.19 -0.07 -3.12 0.00 0.00 179.24 176.37 9icy h LEU 125 N 0.67 -0.57 -0.50 1.55 3.38 0.11 -2.55 115.31 117.39 9icy h LEU 125 Ca 0.28 0.09 -0.09 0.00 0.09 0.00 0.00 57.88 58.25 9icy h LEU 125 Cb 0.23 0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 9icy h LEU 125 CO -0.08 -0.25 -0.02 0.03 0.09 0.00 0.00 178.44 178.20 9icy h ARG 126 N -0.28 0.90 -0.37 1.13 3.08 0.47 -2.98 114.38 116.33 9icy h ARG 126 Ca 0.07 -0.30 0.10 0.00 0.07 0.00 0.00 59.98 59.92 9icy h ARG 126 Cb 0.38 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 9icy h ARG 126 CO -0.21 0.95 0.26 0.87 -1.07 0.00 0.00 179.97 180.76 9icy h LYS 127 N 0.77 0.02 -1.31 0.04 1.79 -0.46 -2.04 116.57 115.39 9icy h LYS 127 Ca 0.14 -0.00 -0.65 0.00 -2.18 0.00 0.00 60.65 57.96 9icy h LYS 127 Cb 0.55 -0.01 -0.35 0.00 -1.58 0.00 0.00 32.23 30.85 9icy h LYS 127 CO 0.03 0.02 0.10 0.09 -1.08 0.00 0.00 179.45 178.61 9icy n ASN 128 N -4.44 6.24 0.19 0.86 3.02 -0.98 -4.75 115.26 115.41 9icy n ASN 128 Ca 0.06 -3.78 0.04 0.00 -0.03 0.00 0.00 54.58 50.87 9icy n ASN 128 Cb 0.43 -0.71 0.37 0.00 -0.61 0.00 0.00 39.78 39.25 9icy n ASN 128 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 9icy h GLU 129 N 2.43 0.00 -0.62 3.52 5.08 -1.32 -2.80 114.58 120.87 9icy h GLU 129 Ca 0.46 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.89 9icy h GLU 129 Cb 0.83 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.04 9icy h GLU 129 CO 1.17 0.38 0.41 0.38 -1.00 0.00 0.00 179.01 180.34 9icy h ASP 130 N 0.00 0.54 0.00 1.42 2.03 -1.87 -1.43 116.42 117.11 9icy h ASP 130 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 9icy h ASP 130 Cb 0.72 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 39.10 9icy h ASP 130 CO 0.05 0.35 0.00 0.29 -1.03 0.00 0.00 179.24 178.90 9icy n LYS 131 N -4.48 0.72 -5.06 4.15 5.02 -1.05 -4.78 118.16 112.68 9icy n LYS 131 Ca 0.09 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.06 9icy n LYS 131 Cb 0.24 -1.32 -0.15 0.00 -0.02 0.00 0.00 35.03 33.78 9icy n LYS 131 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 9icy s LEU 132 N -1.63 2.41 0.49 -0.35 1.43 -0.54 -5.15 118.68 115.35 9icy s LEU 132 Ca 0.22 -0.36 -0.15 0.00 -1.03 0.00 0.00 54.13 52.81 9icy s LEU 132 Cb 0.10 -1.47 -0.08 0.00 0.03 0.00 0.00 46.19 44.77 9icy s LEU 132 CO 0.17 0.28 0.94 0.54 0.23 0.00 0.00 176.35 178.51 9icy s ASN 133 N -0.37 6.60 0.30 2.29 6.03 -1.26 -4.75 114.94 123.78 9icy s ASN 133 Ca 0.03 1.48 0.08 0.00 -1.03 0.00 0.00 52.86 53.42 9icy s ASN 133 Cb -0.12 -2.47 0.87 0.00 -3.03 0.00 0.00 41.25 36.50 9icy s ASN 133 CO 0.02 -0.55 1.41 1.57 -2.03 0.00 0.00 177.10 177.52 9icy n HIS 134 N -1.54 0.74 0.45 1.54 -0.00 -1.26 -0.36 115.22 114.79 9icy n HIS 134 Ca 0.06 1.08 -0.20 0.00 -0.00 0.00 0.00 57.72 58.66 9icy n HIS 134 Cb 0.54 -1.28 -0.10 0.00 -0.00 0.00 0.00 29.99 29.15 9icy n HIS 134 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 9icy h HIS 135 N 0.00 -1.23 -0.66 1.57 6.17 -1.91 -1.96 115.15 117.13 9icy h HIS 135 Ca 0.62 -0.02 0.13 0.00 0.71 0.00 0.00 60.37 61.82 9icy h HIS 135 Cb 1.43 0.43 -0.04 0.00 2.52 0.00 0.00 27.41 31.75 9icy h HIS 135 CO -0.30 -0.72 0.45 1.96 0.71 0.00 0.00 177.93 180.03 9icy h GLN 136 N -1.20 0.33 -0.24 5.26 4.20 -1.24 0.12 115.11 122.35 9icy h GLN 136 Ca -0.11 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.55 9icy h GLN 136 Cb 0.95 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 9icy h GLN 136 CO 0.14 0.22 0.03 0.00 -0.67 0.00 0.00 178.83 178.55 9icy h ARG 137 N 0.34 0.40 -0.08 1.46 3.08 -0.34 -2.00 114.38 117.24 9icy h ARG 137 Ca 0.32 -0.11 -0.14 0.00 0.07 0.00 0.00 59.98 60.11 9icy h ARG 137 Cb 0.77 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 9icy h ARG 137 CO -0.08 0.55 -0.57 0.82 -1.07 0.00 0.00 179.97 179.62 9icy h ILE 138 N 0.19 1.37 -0.56 2.04 2.04 -0.44 0.15 117.51 122.31 9icy h ILE 138 Ca 0.07 -1.90 0.10 0.00 1.00 0.00 0.00 64.86 64.13 9icy h ILE 138 Cb 0.35 1.94 -0.08 0.00 -0.74 0.00 0.00 36.82 38.29 9icy h ILE 138 CO 0.01 0.56 0.13 1.23 0.00 0.00 0.00 178.15 180.08 9icy h GLY 139 N 1.41 0.71 0.62 5.37 0.00 -0.50 0.79 103.07 111.48 9icy h GLY 139 Ca -0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 47.33 47.22 9icy h GLY 139 CO 0.09 -0.08 -0.20 -2.00 0.00 0.00 0.00 176.54 174.36 9icy h LEU 140 N 0.28 0.30 -0.85 3.11 5.85 -1.32 -1.80 115.31 120.87 9icy h LEU 140 Ca 0.29 -0.60 0.13 0.00 0.84 0.00 0.00 57.88 58.54 9icy h LEU 140 Cb 0.39 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.25 9icy h LEU 140 CO -0.35 0.84 0.46 0.50 -0.34 0.00 0.00 178.44 179.55 9icy h LYS 141 N -0.24 0.68 -0.32 1.25 3.64 0.25 -2.29 116.57 119.54 9icy h LYS 141 Ca -0.00 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 9icy h LYS 141 Cb 0.81 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 9icy h LYS 141 CO 0.04 0.45 0.01 0.66 -2.27 0.00 0.00 179.45 178.34 9icy n TYR 142 N -4.81 1.14 -0.29 1.91 4.01 0.18 -4.79 117.16 114.51 9icy n TYR 142 Ca 0.16 -0.93 0.03 0.00 -0.16 0.00 0.00 57.90 57.01 9icy n TYR 142 Cb 0.39 -0.37 0.09 0.00 -0.31 0.00 0.00 39.34 39.14 9icy n TYR 142 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 9icy n PHE 143 N -0.43 0.22 0.00 -0.72 -0.00 -0.68 0.21 117.46 116.07 9icy n PHE 143 Ca 0.24 0.97 0.00 0.00 -0.00 0.00 0.00 57.45 58.66 9icy n PHE 143 Cb 0.96 -0.92 0.00 0.00 -0.00 0.00 0.00 39.48 39.52 9icy n PHE 143 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 9icy n GLY 144 N -1.47 -2.39 0.39 7.13 0.00 -1.26 -2.23 105.19 105.36 9icy n GLY 144 Ca 0.12 0.00 0.35 0.00 0.00 0.00 0.00 46.02 46.49 9icy n GLY 144 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 9icy h ASP 145 N 0.00 0.28 0.26 1.61 5.19 -1.59 0.13 116.42 122.31 9icy h ASP 145 Ca 0.00 0.20 -0.11 0.00 -0.62 0.00 0.00 57.03 56.51 9icy h ASP 145 Cb 0.00 0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.70 9icy h ASP 145 CO 0.00 -0.32 -0.43 -0.26 -3.12 0.00 0.00 179.24 175.11 9icy h PHE 146 N 0.04 0.26 -0.00 4.55 0.04 -0.13 -2.93 116.94 118.76 9icy h PHE 146 Ca 0.85 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 61.55 9icy h PHE 146 Cb 2.46 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 40.55 9icy h PHE 146 CO -0.01 0.61 -0.10 0.39 -0.60 0.00 0.00 178.31 178.61 9icy n GLU 147 N -4.01 0.73 -3.08 1.51 1.02 0.46 -4.89 120.64 112.37 9icy n GLU 147 Ca -0.02 -0.25 -0.39 0.00 -0.02 0.00 0.00 57.16 56.49 9icy n GLU 147 Cb 0.49 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.36 9icy n GLU 147 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 9icy s LYS 148 N -2.44 4.43 0.78 3.49 1.02 -1.11 -5.09 119.74 120.82 9icy s LYS 148 Ca 0.30 0.96 -0.11 0.00 0.02 0.00 0.00 55.97 57.14 9icy s LYS 148 Cb 0.20 -3.32 0.07 0.00 -0.52 0.00 0.00 37.83 34.26 9icy s LYS 148 CO 0.46 0.42 1.10 1.03 -0.92 0.00 0.00 175.35 177.44 9icy s ARG 149 N -0.47 2.11 -0.28 1.68 1.81 -1.26 -4.91 118.95 117.64 9icy s ARG 149 Ca 0.35 1.25 -0.07 0.00 -1.72 0.00 0.00 55.73 55.54 9icy s ARG 149 Cb -0.20 -1.87 -0.00 0.00 -0.45 0.00 0.00 34.95 32.42 9icy s ARG 149 CO 0.22 -1.76 0.08 0.42 -0.68 0.00 0.00 175.30 173.57 9icy s ILE 150 N -2.81 4.07 0.07 1.52 1.01 0.81 -4.87 121.20 121.00 9icy s ILE 150 Ca 0.63 -0.52 -0.31 0.00 0.00 0.00 0.00 60.65 60.45 9icy s ILE 150 Cb -0.18 -3.03 -0.07 0.00 0.01 0.00 0.00 42.46 39.19 9icy s ILE 150 CO 0.55 0.17 1.40 -2.16 0.00 0.00 0.00 174.94 174.90 9icy s PRO 151 N 1.54 4.31 0.44 2.79 0.04 -1.26 0.22 135.00 143.07 9icy s PRO 151 Ca 0.04 2.03 0.26 0.00 0.04 0.00 0.00 61.00 63.37 9icy s PRO 151 Cb -0.16 -3.39 1.30 0.00 0.04 0.00 0.00 34.50 32.28 9icy s PRO 151 CO 0.03 -0.49 1.72 -0.09 0.04 0.00 0.00 177.00 178.20 9icy h ARG 152 N 7.26 0.21 -0.92 4.56 2.43 -1.31 1.25 114.38 127.86 9icy h ARG 152 Ca -0.41 -0.01 0.19 0.00 -0.81 0.00 0.00 59.98 58.94 9icy h ARG 152 Cb 1.20 -0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 30.63 9icy h ARG 152 CO 0.88 0.14 0.59 0.93 -1.51 0.00 0.00 179.97 181.00 9icy h GLU 153 N 0.22 0.51 0.00 0.20 4.39 -1.88 -0.13 114.58 117.88 9icy h GLU 153 Ca 0.68 -0.03 -0.17 0.00 0.34 0.00 0.00 59.36 60.18 9icy h GLU 153 Cb 2.05 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 30.56 9icy h GLU 153 CO -0.29 0.34 -1.36 0.93 -1.16 0.00 0.00 179.01 177.46 9icy h GLU 154 N 0.52 0.00 0.18 2.33 5.08 0.12 -3.32 114.58 119.49 9icy h GLU 154 Ca 0.48 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.84 9icy h GLU 154 Cb 1.03 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 9icy h GLU 154 CO -0.22 0.32 -0.11 0.52 -1.00 0.00 0.00 179.01 178.53 9icy h MET 155 N 0.00 -0.27 -1.00 2.33 2.86 -0.22 -0.36 114.93 118.26 9icy h MET 155 Ca -0.16 0.02 0.13 0.00 -2.06 0.00 0.00 59.70 57.63 9icy h MET 155 Cb 1.60 0.06 -0.09 0.00 0.06 0.00 0.00 31.60 33.24 9icy h MET 155 CO 0.05 -0.18 0.63 -0.07 1.06 0.00 0.00 176.91 178.40 9icy h LEU 156 N -0.28 0.90 -0.26 1.22 3.38 -1.34 0.28 115.31 119.21 9icy h LEU 156 Ca -0.01 0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 9icy h LEU 156 Cb 0.24 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.87 9icy h LEU 156 CO 0.01 0.46 -0.53 0.06 0.09 0.00 0.00 178.44 178.53 9icy h GLN 157 N 0.96 0.81 -0.03 1.13 3.07 -1.54 -2.03 115.11 117.47 9icy h GLN 157 Ca 0.51 -0.53 -0.00 0.00 0.09 0.00 0.00 58.65 58.72 9icy h GLN 157 Cb 0.56 0.07 -0.00 0.00 0.08 0.00 0.00 27.48 28.18 9icy h GLN 157 CO -0.28 1.16 0.02 0.52 0.09 0.00 0.00 178.83 180.34 9icy h MET 158 N 0.57 0.04 -0.33 0.06 2.86 0.17 -2.05 114.93 116.26 9icy h MET 158 Ca 0.01 -0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.71 9icy h MET 158 Cb 1.14 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.73 9icy h MET 158 CO 0.12 0.11 -0.10 0.37 1.06 0.00 0.00 176.91 178.47 9icy h GLN 159 N -0.03 -0.02 -0.63 1.72 4.15 -0.57 0.18 115.11 119.91 9icy h GLN 159 Ca 0.01 0.00 0.12 0.00 0.77 0.00 0.00 58.65 59.55 9icy h GLN 159 Cb 0.08 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 27.68 9icy h GLN 159 CO -0.00 -0.01 0.15 0.22 -1.93 0.00 0.00 178.83 177.25 9icy h ASP 160 N -0.02 0.03 0.03 -0.69 3.58 -1.23 -1.87 116.42 116.25 9icy h ASP 160 Ca 0.16 0.11 -0.00 0.00 0.42 0.00 0.00 57.03 57.72 9icy h ASP 160 Cb 0.27 0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.47 9icy h ASP 160 CO -0.35 0.02 -0.01 0.40 -2.88 0.00 0.00 179.24 176.41 9icy h ILE 161 N 0.28 1.11 -0.61 2.25 2.04 -0.03 -2.62 117.51 119.92 9icy h ILE 161 Ca 0.33 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.80 9icy h ILE 161 Cb 0.50 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 9icy h ILE 161 CO -0.41 0.10 0.40 0.58 0.00 0.00 0.00 178.15 178.82 9icy h VAL 162 N -0.21 1.14 -0.65 1.67 2.07 -0.36 -1.78 116.25 118.12 9icy h VAL 162 Ca -0.00 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.30 9icy h VAL 162 Cb 0.20 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 9icy h VAL 162 CO 0.01 0.15 0.43 -0.07 0.02 0.00 0.00 177.57 178.10 9icy h LEU 163 N 0.81 0.57 -0.28 2.57 3.38 -1.38 -0.65 115.31 120.33 9icy h LEU 163 Ca 0.23 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.09 9icy h LEU 163 Cb -0.07 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 9icy h LEU 163 CO -0.06 0.37 -0.25 0.78 0.09 0.00 0.00 178.44 179.37 9icy h ASN 164 N 0.65 0.70 -0.11 -0.43 2.35 -0.93 -2.96 115.58 114.84 9icy h ASN 164 Ca 0.28 -0.46 -0.06 0.00 -0.55 0.00 0.00 56.30 55.50 9icy h ASN 164 Cb 0.27 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.45 9icy h ASN 164 CO -0.09 1.02 -0.17 -0.33 -1.65 0.00 0.00 177.43 176.21 9icy h GLU 165 N 0.39 0.31 -0.84 0.81 4.39 -1.14 -1.40 114.58 117.10 9icy h GLU 165 Ca 0.05 -0.19 0.15 0.00 0.34 0.00 0.00 59.36 59.71 9icy h GLU 165 Cb 0.81 0.02 -0.15 0.00 -0.10 0.00 0.00 28.75 29.33 9icy h GLU 165 CO 0.06 0.76 -0.26 0.28 -1.16 0.00 0.00 179.01 178.70 9icy n VAL 166 N -4.55 -0.39 0.26 3.13 0.31 -0.31 0.74 118.33 117.52 9icy n VAL 166 Ca -0.07 1.94 -0.15 0.00 -0.01 0.00 0.00 64.34 66.06 9icy n VAL 166 Cb 0.39 -2.64 -0.08 0.00 -0.91 0.00 0.00 33.84 30.60 9icy n VAL 166 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 9icy h LYS 167 N 0.00 -0.63 -1.07 5.55 3.64 -1.50 -3.12 116.57 119.44 9icy h LYS 167 Ca 0.36 0.04 0.29 0.00 -1.27 0.00 0.00 60.65 60.08 9icy h LYS 167 Cb 0.57 0.14 -0.11 0.00 -0.41 0.00 0.00 32.23 32.42 9icy h LYS 167 CO -0.85 -0.33 0.66 1.57 -2.27 0.00 0.00 179.45 178.23 9icy h LYS 168 N -0.90 0.37 0.42 1.90 2.10 0.15 -2.55 116.57 118.05 9icy h LYS 168 Ca -0.07 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.54 9icy h LYS 168 Cb 0.59 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 9icy h LYS 168 CO 0.11 0.24 -0.20 -0.24 -2.00 0.00 0.00 179.45 177.36 9icy h VAL 169 N 0.38 0.03 -3.93 0.07 3.04 -0.86 -3.45 116.25 111.54 9icy h VAL 169 Ca 0.66 -0.60 -0.33 0.00 -1.01 0.00 0.00 66.70 65.42 9icy h VAL 169 Cb 1.62 0.06 -0.28 0.00 -2.01 0.00 0.00 31.29 30.68 9icy h VAL 169 CO -0.40 0.01 -0.76 -0.62 -1.01 0.00 0.00 177.57 174.79 9icy s ASP 170 N -4.92 0.71 0.00 3.17 2.15 -0.97 -4.99 116.67 111.82 9icy s ASP 170 Ca -0.09 -0.15 0.28 0.00 0.43 0.00 0.00 52.55 53.02 9icy s ASP 170 Cb 0.01 -0.07 1.09 0.00 -0.30 0.00 0.00 42.92 43.65 9icy s ASP 170 CO 0.26 0.04 1.82 -0.24 -0.17 0.00 0.00 175.17 176.89 9icy n SER 171 N 2.78 0.11 -0.10 -0.34 2.88 -1.17 -3.72 113.62 114.07 9icy n SER 171 Ca -0.14 0.31 -0.13 0.00 -1.33 0.00 0.00 58.87 57.58 9icy n SER 171 Cb 0.58 -0.33 -0.04 0.00 -0.75 0.00 0.00 64.21 63.67 9icy n SER 171 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 9icy h GLU 172 N 0.01 0.79 -6.20 -1.46 4.57 -1.91 -3.46 114.58 106.91 9icy h GLU 172 Ca 0.00 -0.43 -0.70 0.00 -1.18 0.00 0.00 59.36 57.05 9icy h GLU 172 Cb 0.49 0.02 0.07 0.00 -0.16 0.00 0.00 28.75 29.17 9icy h GLU 172 CO 0.00 1.06 0.21 0.66 -1.18 0.00 0.00 179.01 179.76 9icy n TYR 173 N -4.18 1.05 -4.09 0.92 4.01 -1.24 -4.70 117.16 108.94 9icy n TYR 173 Ca -0.04 0.79 -0.35 0.00 -0.16 0.00 0.00 57.90 58.15 9icy n TYR 173 Cb 0.51 -2.22 -0.14 0.00 -0.31 0.00 0.00 39.34 37.18 9icy n TYR 173 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 9icy s ILE 174 N -0.00 3.32 -0.01 -0.72 1.01 -0.66 -4.84 121.20 119.30 9icy s ILE 174 Ca 0.80 -0.52 0.04 0.00 0.00 0.00 0.00 60.65 60.97 9icy s ILE 174 Cb -1.00 -2.49 -0.01 0.00 0.01 0.00 0.00 42.46 38.98 9icy s ILE 174 CO 0.52 0.45 -0.12 0.00 0.00 0.00 0.00 174.94 175.78 9icy s ALA 175 N 1.21 1.05 -0.01 9.38 0.00 -1.26 -1.84 121.76 130.28 9icy s ALA 175 Ca 0.02 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.46 9icy s ALA 175 Cb -0.14 -0.28 0.01 0.00 0.00 0.00 0.00 23.12 22.71 9icy s ALA 175 CO -0.02 0.25 0.00 0.99 0.00 0.00 0.00 175.76 176.98 9icy s THR 176 N -0.24 0.08 -0.38 0.00 2.01 -0.80 -4.98 115.64 111.33 9icy s THR 176 Ca 0.04 0.04 -0.15 0.00 0.31 0.00 0.00 61.69 61.93 9icy s THR 176 Cb -0.05 -0.13 0.00 0.00 0.01 0.00 0.00 72.50 72.33 9icy s THR 176 CO -0.00 0.07 0.34 -0.69 -0.69 0.00 0.00 174.62 173.65 9icy s VAL 177 N 0.48 5.20 0.00 3.82 1.01 -1.26 0.14 120.40 129.78 9icy s VAL 177 Ca -0.04 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.66 9icy s VAL 177 Cb -0.07 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.44 9icy s VAL 177 CO -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 175.10 174.88 9icy n GLY 179 N 5.00 -2.53 0.38 0.00 0.00 -1.23 -4.21 105.19 102.59 9icy n GLY 179 Ca 0.00 -1.77 0.17 0.00 0.00 0.00 0.00 46.02 44.42 9icy n GLY 179 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 9icy h SER 180 N 0.00 0.25 -0.61 1.61 4.64 -1.87 0.87 113.55 118.44 9icy h SER 180 Ca 0.00 0.01 0.13 0.00 -0.47 0.00 0.00 61.79 61.46 9icy h SER 180 Cb 0.00 -0.04 -0.10 0.00 -0.31 0.00 0.00 62.40 61.95 9icy h SER 180 CO 0.00 0.13 -0.00 0.15 -0.87 0.00 0.00 176.83 176.24 9icy h PHE 181 N 0.27 -0.04 -0.16 4.77 3.57 -1.83 0.54 116.94 124.05 9icy h PHE 181 Ca 0.33 0.05 -0.14 0.00 3.53 0.00 0.00 57.97 61.73 9icy h PHE 181 Cb 0.90 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.75 9icy h PHE 181 CO -0.00 -0.16 -0.50 -0.09 -2.23 0.00 0.00 178.31 175.32 9icy h ARG 182 N 0.12 0.44 -0.16 1.11 2.43 -1.03 -2.90 114.38 114.39 9icy h ARG 182 Ca 0.32 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 9icy h ARG 182 Cb 0.51 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 9icy h ARG 182 CO -0.52 0.84 0.00 0.54 -1.51 0.00 0.00 179.97 179.32 9icy n ARG 183 N -3.97 0.90 0.00 0.20 1.74 0.10 -4.36 116.66 111.28 9icy n ARG 183 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 9icy n ARG 183 Cb 0.56 -1.08 0.00 0.00 -1.02 0.00 0.00 32.46 30.93 9icy n ARG 183 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 9icy n GLY 184 N 0.34 2.87 0.81 -0.13 0.00 -0.80 -4.30 105.19 103.97 9icy n GLY 184 Ca 0.00 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 9icy n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 9icy n ALA 185 N 0.00 -1.37 0.07 4.61 0.00 -0.74 -4.90 120.51 118.19 9icy n ALA 185 Ca 0.00 0.12 0.01 0.00 0.00 0.00 0.00 53.44 53.56 9icy n ALA 185 Cb 0.00 -0.39 0.33 0.00 0.00 0.00 0.00 19.45 19.39 9icy n ALA 185 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 9icy h GLU 186 N 0.41 0.34 -4.40 0.00 4.39 -1.94 -3.43 114.58 109.95 9icy h GLU 186 Ca -0.09 -0.09 -0.20 0.00 0.34 0.00 0.00 59.36 59.33 9icy h GLU 186 Cb 0.34 -0.04 -0.14 0.00 -0.10 0.00 0.00 28.75 28.80 9icy h GLU 186 CO 0.14 0.48 -0.54 -1.54 -1.16 0.00 0.00 179.01 176.39 9icy s SER 187 N -6.83 0.14 0.13 1.42 1.04 -1.25 -0.88 113.70 107.47 9icy s SER 187 Ca -0.06 -1.27 -0.12 0.00 0.48 0.00 0.00 55.95 54.99 9icy s SER 187 Cb 0.15 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.67 9icy s SER 187 CO 0.75 -0.86 0.31 -0.44 0.98 0.00 0.00 173.24 173.98 9icy s SER 188 N -3.11 -0.03 -0.15 7.02 0.01 0.13 -4.75 113.70 112.82 9icy s SER 188 Ca 0.33 -0.63 -0.21 0.00 1.31 0.00 0.00 55.95 56.75 9icy s SER 188 Cb 0.06 0.43 -0.19 0.00 0.21 0.00 0.00 66.02 66.53 9icy s SER 188 CO 0.09 -0.85 0.45 1.23 0.41 0.00 0.00 173.24 174.57 9icy h GLY 189 N 2.53 0.00 -2.81 3.44 0.00 -1.90 2.40 103.07 106.73 9icy h GLY 189 Ca -0.33 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.91 9icy h GLY 189 CO 0.49 0.00 -0.29 0.51 0.00 0.00 0.00 176.54 177.25 9icy s ASP 190 N -6.25 0.02 -0.19 0.19 1.47 -1.26 -4.60 116.67 106.05 9icy s ASP 190 Ca -0.18 -0.79 -0.13 0.00 1.18 0.00 0.00 52.55 52.63 9icy s ASP 190 Cb 0.00 0.43 -0.05 0.00 -0.34 0.00 0.00 42.92 42.97 9icy s ASP 190 CO 0.53 -0.88 0.25 0.00 0.68 0.00 0.00 175.17 175.75 9icy s MET 191 N -3.94 4.19 -0.45 2.11 0.23 -0.73 -5.01 119.30 115.70 9icy s MET 191 Ca 0.14 -0.03 -0.09 0.00 -1.03 0.00 0.00 55.69 54.68 9icy s MET 191 Cb 0.03 -3.47 0.10 0.00 -1.53 0.00 0.00 34.83 29.97 9icy s MET 191 CO -0.02 0.17 0.31 0.34 -2.03 0.00 0.00 175.02 173.78 9icy s ASP 192 N 0.67 5.68 -0.35 -1.18 -1.08 -1.26 -1.32 116.67 117.83 9icy s ASP 192 Ca 0.13 -1.74 -0.13 0.00 -0.52 0.00 0.00 52.55 50.29 9icy s ASP 192 Cb -0.13 -2.00 -0.01 0.00 -1.46 0.00 0.00 42.92 39.32 9icy s ASP 192 CO 0.03 -0.63 0.24 -0.69 0.52 0.00 0.00 175.17 174.64 9icy s VAL 193 N 1.39 5.17 -0.35 1.11 1.01 0.15 -0.76 120.40 128.13 9icy s VAL 193 Ca 0.05 -0.33 -0.28 0.00 0.00 0.00 0.00 61.98 61.41 9icy s VAL 193 Cb -0.25 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.45 9icy s VAL 193 CO 0.00 -0.05 1.06 -0.76 0.00 0.00 0.00 175.10 175.35 9icy s LEU 194 N 1.70 3.90 -0.06 3.92 1.02 0.36 -2.29 118.68 127.24 9icy s LEU 194 Ca 0.06 0.91 0.05 0.00 0.02 0.00 0.00 54.13 55.17 9icy s LEU 194 Cb -0.18 -3.50 -0.01 0.00 0.02 0.00 0.00 46.19 42.53 9icy s LEU 194 CO 0.10 -0.92 -0.21 -0.22 0.02 0.00 0.00 176.35 175.12 9icy s LEU 195 N 3.72 1.98 0.17 1.79 2.96 0.21 -1.90 118.68 127.61 9icy s LEU 195 Ca 0.45 -0.44 -0.04 0.00 -0.22 0.00 0.00 54.13 53.88 9icy s LEU 195 Cb -0.11 -1.18 -0.03 0.00 0.50 0.00 0.00 46.19 45.37 9icy s LEU 195 CO 0.18 0.19 0.18 0.28 -1.32 0.00 0.00 176.35 175.85 9icy s THR 196 N 0.02 0.06 0.05 3.68 -1.32 -0.77 0.39 115.64 117.74 9icy s THR 196 Ca -0.06 -1.74 -0.05 0.00 -1.21 0.00 0.00 61.69 58.63 9icy s THR 196 Cb -0.13 -2.12 -0.02 0.00 -1.51 0.00 0.00 72.50 68.72 9icy s THR 196 CO 0.04 -0.25 0.09 -2.28 -2.21 0.00 0.00 174.62 170.00 9icy s HIS 197 N -4.05 0.25 0.00 9.09 2.46 -1.23 -1.65 115.29 120.16 9icy s HIS 197 Ca 0.26 -0.63 -0.23 0.00 0.47 0.00 0.00 55.06 54.93 9icy s HIS 197 Cb 0.05 -0.18 -0.18 0.00 -0.13 0.00 0.00 32.58 32.15 9icy s HIS 197 CO 0.05 -0.40 1.24 -1.35 -2.47 0.00 0.00 174.74 171.81 9icy h PRO 198 N 3.41 0.23 -0.05 2.88 0.11 -1.93 -2.98 132.00 133.68 9icy h PRO 198 Ca -0.33 -0.15 0.00 0.00 0.11 0.00 0.00 66.00 65.63 9icy h PRO 198 Cb 1.18 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 9icy h PRO 198 CO 0.54 0.74 0.00 0.45 -0.21 0.00 0.00 178.00 179.52 9icy n SER 199 N -4.60 0.05 -3.67 -2.05 2.88 -1.26 -4.37 113.62 100.61 9icy n SER 199 Ca -0.08 -0.23 -0.12 0.00 -1.33 0.00 0.00 58.87 57.12 9icy n SER 199 Cb 0.38 -0.02 -0.12 0.00 -0.75 0.00 0.00 64.21 63.70 9icy n SER 199 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 9icy s PHE 200 N -1.57 -0.55 0.16 0.66 5.36 -1.13 -4.93 117.98 115.98 9icy s PHE 200 Ca 0.00 1.16 -0.24 0.00 -0.96 0.00 0.00 56.93 56.90 9icy s PHE 200 Cb 0.00 0.09 0.06 0.00 -0.34 0.00 0.00 43.02 42.83 9icy s PHE 200 CO 0.00 -0.39 0.70 -0.08 -1.46 0.00 0.00 175.22 173.99 9icy s THR 201 N 2.41 0.00 0.00 0.12 -1.32 -1.26 0.95 115.64 116.54 9icy s THR 201 Ca -0.01 -0.29 0.00 0.00 -1.21 0.00 0.00 61.69 60.18 9icy s THR 201 Cb -0.12 -1.32 0.00 0.00 -1.51 0.00 0.00 72.50 69.56 9icy s THR 201 CO -0.10 0.00 0.00 -1.20 -2.21 0.00 0.00 174.62 171.11 9icy n SER 202 N -0.39 0.00 0.00 8.08 7.64 -1.26 -2.57 113.62 125.12 9icy n SER 202 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.76 9icy n SER 202 Cb 0.63 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.83 9icy n SER 202 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 9icy n GLU 203 N -1.19 0.00 0.00 1.43 4.71 -1.26 -4.91 120.64 119.42 9icy n GLU 203 Ca 0.00 0.05 0.00 0.00 -0.01 0.00 0.00 57.16 57.20 9icy n GLU 203 Cb 0.00 -0.35 0.00 0.00 -1.01 0.00 0.00 31.44 30.08 9icy n GLU 203 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 9icy n SER 204 N -1.23 0.00 -2.25 1.62 3.41 -1.06 -4.31 113.62 109.80 9icy n SER 204 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 9icy n SER 204 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 9icy n SER 204 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 9icy n THR 205 N 0.00 0.00 -4.18 6.66 5.66 -1.26 -4.55 114.28 116.61 9icy n THR 205 Ca 0.00 -0.23 0.02 0.00 -3.05 0.00 0.00 64.05 60.80 9icy n THR 205 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 9icy n THR 205 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 9icy n LYS 206 N 1.90 -0.35 0.00 1.09 4.76 -1.26 -4.91 118.16 119.38 9icy n LYS 206 Ca 0.00 0.23 0.00 0.00 -2.87 0.00 0.00 58.31 55.67 9icy n LYS 206 Cb 0.11 -0.43 0.00 0.00 -1.84 0.00 0.00 35.03 32.88 9icy n LYS 206 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 9icy n GLN 207 N -2.12 0.00 -0.32 1.97 7.27 -1.26 -4.98 117.38 117.94 9icy n GLN 207 Ca 0.00 0.00 0.01 0.00 0.07 0.00 0.00 57.00 57.09 9icy n GLN 207 Cb 0.08 0.00 0.15 0.00 2.41 0.00 0.00 30.24 32.88 9icy n GLN 207 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 9icy h PRO 208 N 0.00 0.95 -0.21 3.69 0.13 -1.91 -0.58 132.00 134.07 9icy h PRO 208 Ca 0.00 -0.06 0.06 0.00 -0.87 0.00 0.00 66.00 65.13 9icy h PRO 208 Cb 0.00 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 30.91 9icy h PRO 208 CO 0.00 0.63 0.28 0.87 -0.23 0.00 0.00 178.00 179.55 9icy h LYS 209 N 0.98 0.00 -0.76 0.86 1.79 -1.96 -0.53 116.57 116.95 9icy h LYS 209 Ca 0.39 0.00 0.14 0.00 -2.18 0.00 0.00 60.65 59.00 9icy h LYS 209 Cb 0.20 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.80 9icy h LYS 209 CO -0.18 0.00 0.51 -0.07 -1.08 0.00 0.00 179.45 178.62 9icy h LEU 210 N 0.00 0.43 0.04 2.94 3.38 -1.48 0.15 115.31 120.76 9icy h LEU 210 Ca 0.10 0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.89 9icy h LEU 210 Cb 0.67 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 9icy h LEU 210 CO -0.00 0.22 -1.08 0.25 0.09 0.00 0.00 178.44 177.92 9icy h LEU 211 N 0.46 0.13 -1.82 1.67 5.85 -1.26 -3.38 115.31 116.94 9icy h LEU 211 Ca 0.37 -0.72 0.21 0.00 0.84 0.00 0.00 57.88 58.58 9icy h LEU 211 Cb 0.80 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.75 9icy h LEU 211 CO -0.13 1.44 0.57 0.45 -0.34 0.00 0.00 178.44 180.43 9icy h HIS 212 N -0.76 0.20 0.59 1.25 3.86 -1.33 -1.92 115.15 117.03 9icy h HIS 212 Ca -0.27 0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 58.92 9icy h HIS 212 Cb 1.40 -0.06 0.01 0.00 1.06 0.00 0.00 27.41 29.82 9icy h HIS 212 CO 0.14 0.06 -0.28 1.96 0.86 0.00 0.00 177.93 180.67 9icy h GLN 213 N 0.15 -0.76 -0.84 2.45 4.20 -0.90 -2.63 115.11 116.79 9icy h GLN 213 Ca 0.40 0.05 0.02 0.00 0.06 0.00 0.00 58.65 59.18 9icy h GLN 213 Cb 1.34 0.17 -0.04 0.00 0.30 0.00 0.00 27.48 29.25 9icy h GLN 213 CO -0.07 -0.45 0.55 -0.39 -0.67 0.00 0.00 178.83 177.81 9icy h VAL 214 N -1.09 1.19 0.02 -0.54 -1.51 -1.60 -1.27 116.25 111.45 9icy h VAL 214 Ca -0.08 -0.38 -0.00 0.00 -1.23 0.00 0.00 66.70 65.01 9icy h VAL 214 Cb 0.66 -0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.80 9icy h VAL 214 CO 0.13 0.20 -0.01 0.58 -1.23 0.00 0.00 177.57 177.25 9icy h VAL 215 N 1.11 0.99 -0.17 7.19 2.07 -1.42 0.44 116.25 126.46 9icy h VAL 215 Ca 0.31 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 67.87 9icy h VAL 215 Cb -0.09 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 9icy h VAL 215 CO -0.08 0.00 0.15 -0.08 0.02 0.00 0.00 177.57 177.59 9icy h GLU 216 N -0.03 0.00 0.37 1.57 4.81 -1.07 -1.08 114.58 119.15 9icy h GLU 216 Ca -0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 9icy h GLU 216 Cb 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.41 9icy h GLU 216 CO 0.00 0.00 -0.18 0.37 -0.73 0.00 0.00 179.01 178.48 9icy h GLN 217 N 0.00 -0.48 -0.94 1.92 5.75 0.18 -0.89 115.11 120.65 9icy h GLN 217 Ca 0.08 0.03 0.26 0.00 -0.15 0.00 0.00 58.65 58.88 9icy h GLN 217 Cb 0.37 0.11 -0.17 0.00 1.07 0.00 0.00 27.48 28.87 9icy h GLN 217 CO -0.00 -0.32 0.10 -0.07 -2.65 0.00 0.00 178.83 175.89 9icy h LEU 218 N -1.05 -0.31 -0.71 -2.39 4.07 -0.55 2.89 115.31 117.26 9icy h LEU 218 Ca -0.05 0.25 -0.13 0.00 0.08 0.00 0.00 57.88 58.03 9icy h LEU 218 Cb 0.38 0.41 -0.01 0.00 1.08 0.00 0.00 40.66 42.52 9icy h LEU 218 CO 0.08 -0.30 -0.39 1.56 -1.08 0.00 0.00 178.44 178.31 9icy h GLN 219 N 0.06 0.54 -0.64 1.13 4.20 -1.29 0.40 115.11 119.51 9icy h GLN 219 Ca 0.59 -0.27 0.13 0.00 0.06 0.00 0.00 58.65 59.15 9icy h GLN 219 Cb 1.22 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.91 9icy h GLN 219 CO -0.83 0.84 0.14 -0.22 -0.67 0.00 0.00 178.83 178.10 9icy h LYS 220 N 0.45 0.26 -0.01 1.46 3.64 0.66 -1.29 116.57 121.74 9icy h LYS 220 Ca 0.04 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 9icy h LYS 220 Cb 0.88 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 9icy h LYS 220 CO 0.08 0.17 -0.16 1.33 -2.27 0.00 0.00 179.45 178.59 9icy n VAL 221 N -5.13 0.00 -1.64 2.00 0.24 -0.64 -4.96 118.33 108.19 9icy n VAL 221 Ca 0.10 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 9icy n VAL 221 Cb 0.36 0.57 0.00 0.00 -1.47 0.00 0.00 33.84 33.30 9icy n VAL 221 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 9icy n HIS 222 N -0.18 0.00 -0.02 6.34 8.25 -0.49 -4.94 115.22 124.18 9icy n HIS 222 Ca 0.15 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.53 9icy n HIS 222 Cb 0.37 -0.80 -0.14 0.00 1.12 0.00 0.00 29.99 30.55 9icy n HIS 222 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 9icy n PHE 223 N -3.26 0.94 -3.68 4.41 7.35 0.11 -4.58 117.46 118.74 9icy n PHE 223 Ca 0.00 0.34 -0.36 0.00 -0.76 0.00 0.00 57.45 56.67 9icy n PHE 223 Cb 0.40 -1.16 -0.09 0.00 0.35 0.00 0.00 39.48 38.98 9icy n PHE 223 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 9icy s ILE 224 N -2.63 5.37 -0.13 -2.13 1.01 -1.06 -0.90 121.20 120.73 9icy s ILE 224 Ca -0.05 0.21 0.12 0.00 0.00 0.00 0.00 60.65 60.93 9icy s ILE 224 Cb 0.08 -3.50 -0.16 0.00 0.01 0.00 0.00 42.46 38.89 9icy s ILE 224 CO 0.82 0.38 0.05 0.35 0.00 0.00 0.00 174.94 176.54 9icy n THR 225 N 3.98 0.91 -3.92 2.92 -2.24 0.49 -4.47 114.28 111.94 9icy n THR 225 Ca -0.15 -0.56 -0.08 0.00 -2.27 0.00 0.00 64.05 60.98 9icy n THR 225 Cb 0.52 -0.65 -0.08 0.00 -2.10 0.00 0.00 70.33 68.02 9icy n THR 225 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 9icy s ASP 226 N -4.63 0.22 -0.27 3.42 1.11 -1.13 -5.02 116.67 110.37 9icy s ASP 226 Ca -0.07 -0.71 -0.03 0.00 0.18 0.00 0.00 52.55 51.93 9icy s ASP 226 Cb 0.04 0.29 0.03 0.00 1.07 0.00 0.00 42.92 44.35 9icy s ASP 226 CO 0.54 -0.66 -0.02 -0.89 1.18 0.00 0.00 175.17 175.32 9icy s THR 227 N -3.67 3.09 -0.16 -1.27 2.01 -1.26 -0.95 115.64 113.44 9icy s THR 227 Ca 0.04 -1.07 -0.25 0.00 0.31 0.00 0.00 61.69 60.72 9icy s THR 227 Cb 0.05 -2.63 -0.22 0.00 0.01 0.00 0.00 72.50 69.71 9icy s THR 227 CO -0.10 0.09 0.55 -0.07 -0.69 0.00 0.00 174.62 174.40 9icy h LEU 228 N 8.05 0.00 -7.06 4.42 4.07 0.35 -3.48 115.31 121.66 9icy h LEU 228 Ca -0.29 -0.78 -0.01 0.00 0.08 0.00 0.00 57.88 56.88 9icy h LEU 228 Cb 1.10 0.00 -0.23 0.00 1.08 0.00 0.00 40.66 42.61 9icy h LEU 228 CO 0.57 1.09 -0.13 -0.94 -1.08 0.00 0.00 178.44 177.94 9icy s SER 229 N -6.32 -0.82 -0.13 -0.43 1.04 -0.40 -4.75 113.70 101.89 9icy s SER 229 Ca -0.20 1.34 -0.01 0.00 0.48 0.00 0.00 55.95 57.55 9icy s SER 229 Cb -0.00 1.48 0.04 0.00 0.10 0.00 0.00 66.02 67.63 9icy s SER 229 CO 0.60 -0.22 -0.02 -0.75 0.98 0.00 0.00 173.24 173.83 9icy s LYS 230 N 2.02 1.00 0.44 4.02 2.20 -1.26 0.31 119.74 128.47 9icy s LYS 230 Ca -0.08 -0.24 0.04 0.00 -0.36 0.00 0.00 55.97 55.33 9icy s LYS 230 Cb -0.08 -1.61 -0.05 0.00 -1.51 0.00 0.00 37.83 34.59 9icy s LYS 230 CO -0.17 -0.40 0.03 0.20 -0.36 0.00 0.00 175.35 174.64 9icy s GLY 231 N 1.81 2.66 0.00 5.54 0.00 -0.21 -5.00 107.32 112.12 9icy s GLY 231 Ca 0.03 -1.40 0.06 0.00 0.00 0.00 0.00 44.72 43.41 9icy s GLY 231 CO -0.07 -2.07 1.15 -1.84 0.00 0.00 0.00 173.10 170.27 9icy n GLU 232 N -1.04 0.02 0.00 2.90 0.28 -1.26 -3.51 120.64 118.04 9icy n GLU 232 Ca -0.10 0.36 0.00 0.00 -0.16 0.00 0.00 57.16 57.25 9icy n GLU 232 Cb 0.67 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 32.04 9icy n GLU 232 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 9icy n THR 233 N -1.45 0.00 -3.75 3.84 -2.24 -1.26 -4.74 114.28 104.68 9icy n THR 233 Ca 0.02 -0.03 -0.19 0.00 -2.27 0.00 0.00 64.05 61.57 9icy n THR 233 Cb 0.06 0.60 -0.17 0.00 -2.10 0.00 0.00 70.33 68.72 9icy n THR 233 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 9icy s LYS 234 N -0.16 0.11 -0.11 -0.78 2.20 -1.23 0.58 119.74 120.35 9icy s LYS 234 Ca 0.00 0.25 0.01 0.00 -0.36 0.00 0.00 55.97 55.87 9icy s LYS 234 Cb 0.00 -0.54 -0.02 0.00 -1.51 0.00 0.00 37.83 35.76 9icy s LYS 234 CO 0.00 -0.27 -0.14 0.12 -0.36 0.00 0.00 175.35 174.70 9icy s PHE 235 N 1.77 2.78 -0.30 4.03 5.36 -0.60 -1.05 117.98 129.97 9icy s PHE 235 Ca 0.00 -0.55 -0.00 0.00 -0.96 0.00 0.00 56.93 55.42 9icy s PHE 235 Cb -0.12 -1.79 0.06 0.00 -0.34 0.00 0.00 43.02 40.83 9icy s PHE 235 CO -0.03 -0.13 -0.00 -1.64 -1.46 0.00 0.00 175.22 171.95 9icy s MET 236 N 0.11 2.28 0.00 10.12 -1.94 0.90 -2.44 119.30 128.33 9icy s MET 236 Ca -0.06 -1.38 0.00 0.00 -1.71 0.00 0.00 55.69 52.54 9icy s MET 236 Cb -0.15 -3.15 0.00 0.00 2.01 0.00 0.00 34.83 33.54 9icy s MET 236 CO 0.05 -0.67 0.00 0.41 -0.01 0.00 0.00 175.02 174.80 9icy n GLY 237 N 4.55 5.42 2.80 -0.03 0.00 0.56 0.10 105.19 118.59 9icy n GLY 237 Ca -0.11 -1.36 -0.18 0.00 0.00 0.00 0.00 46.02 44.37 9icy n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 9icy s VAL 238 N -0.00 0.19 0.39 1.61 1.01 -0.13 -0.88 120.40 122.59 9icy s VAL 238 Ca 0.00 0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.15 9icy s VAL 238 Cb 0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 36.38 36.00 9icy s VAL 238 CO 0.00 0.17 0.03 0.00 0.00 0.00 0.00 175.10 175.29 9icy s GLN 240 N -3.78 0.66 0.10 0.00 0.74 -0.08 -0.63 119.66 116.67 9icy s GLN 240 Ca 0.34 1.16 -0.31 0.00 0.05 0.00 0.00 55.36 56.61 9icy s GLN 240 Cb 0.09 0.12 -0.07 0.00 1.10 0.00 0.00 33.01 34.25 9icy s GLN 240 CO 0.16 -0.15 1.31 -0.51 -0.55 0.00 0.00 175.29 175.55 9icy s LEU 241 N 1.62 4.38 -0.20 3.68 1.43 -1.26 -4.62 118.68 123.70 9icy s LEU 241 Ca -0.10 2.22 -0.39 0.00 -1.03 0.00 0.00 54.13 54.83 9icy s LEU 241 Cb -0.06 -3.59 -0.15 0.00 0.03 0.00 0.00 46.19 42.43 9icy s LEU 241 CO -0.19 -0.57 1.72 -2.65 0.23 0.00 0.00 176.35 174.89 9icy n PRO 242 N 3.82 1.35 -2.43 1.29 -0.02 -1.26 -4.14 135.00 133.61 9icy n PRO 242 Ca 0.10 0.49 -0.40 0.00 -2.02 0.00 0.00 63.50 61.68 9icy n PRO 242 Cb 0.44 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 9icy n PRO 242 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 9icy s SER 243 N 3.24 5.99 0.00 2.55 0.01 -1.26 -4.86 113.70 119.37 9icy s SER 243 Ca 0.95 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 57.75 9icy s SER 243 Cb -0.99 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 62.69 9icy s SER 243 CO 0.61 -1.94 0.00 0.29 0.41 0.00 0.00 173.24 172.61 9icy n LYS 244 N 9.24 0.78 -2.41 12.44 4.76 -1.26 -4.39 118.16 137.32 9icy n LYS 244 Ca 0.13 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.16 9icy n LYS 244 Cb 0.50 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.70 9icy n LYS 244 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 9icy n ASN 245 N 0.00 7.15 0.00 4.39 2.04 -1.26 -4.95 115.26 122.63 9icy n ASN 245 Ca 0.00 -3.36 0.00 0.00 -0.44 0.00 0.00 54.58 50.78 9icy n ASN 245 Cb 0.00 -1.30 0.00 0.00 -2.53 0.00 0.00 39.78 35.95 9icy n ASN 245 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 9icy n ASP 246 N 1.39 0.00 0.00 0.53 8.00 -1.26 -4.90 116.55 120.31 9icy n ASP 246 Ca 0.49 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.99 9icy n ASP 246 Cb 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 9icy n ASP 246 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 9icy n GLU 247 N 0.00 0.00 -3.83 -1.24 -0.58 -1.26 -4.98 120.64 108.74 9icy n GLU 247 Ca 0.00 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.44 9icy n GLU 247 Cb 0.00 0.00 -0.15 0.00 -0.57 0.00 0.00 31.44 30.72 9icy n GLU 247 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 9icy s LYS 248 N 0.00 1.07 0.27 3.49 0.00 -1.26 -5.09 119.74 118.22 9icy s LYS 248 Ca 0.00 -1.06 -0.05 0.00 0.00 0.00 0.00 55.97 54.86 9icy s LYS 248 Cb 0.00 -2.35 -0.05 0.00 0.00 0.00 0.00 37.83 35.42 9icy s LYS 248 CO 0.00 -0.81 0.53 -2.00 0.00 0.00 0.00 175.35 173.07 9icy s GLU 249 N 1.49 3.64 0.17 1.78 2.12 -1.26 -4.07 118.70 122.57 9icy s GLU 249 Ca 0.04 0.01 -0.08 0.00 0.36 0.00 0.00 54.97 55.30 9icy s GLU 249 Cb -0.18 -2.67 -0.06 0.00 0.26 0.00 0.00 34.13 31.48 9icy s GLU 249 CO -0.15 0.25 0.46 0.71 -0.54 0.00 0.00 175.26 175.99 9icy s TYR 250 N -2.02 3.47 0.55 5.30 2.02 -1.26 -5.01 117.35 120.40 9icy s TYR 250 Ca 0.44 0.74 -0.20 0.00 -0.37 0.00 0.00 57.07 57.68 9icy s TYR 250 Cb -0.11 -2.15 -0.05 0.00 -0.40 0.00 0.00 41.96 39.25 9icy s TYR 250 CO 0.29 0.37 1.15 -2.14 -1.57 0.00 0.00 175.55 173.66 9icy s PRO 251 N -2.60 3.31 -0.08 -1.71 0.02 -1.26 -4.84 135.00 127.84 9icy s PRO 251 Ca 0.43 1.69 -0.30 0.00 0.02 0.00 0.00 61.00 62.84 9icy s PRO 251 Cb -0.12 -2.03 -0.02 0.00 0.02 0.00 0.00 34.50 32.34 9icy s PRO 251 CO 0.22 -0.90 1.10 -1.01 -0.33 0.00 0.00 177.00 176.07 9icy s HIS 252 N -1.70 3.37 0.06 6.54 3.76 -1.26 -4.61 115.29 121.44 9icy s HIS 252 Ca 0.73 1.42 0.07 0.00 -0.15 0.00 0.00 55.06 57.13 9icy s HIS 252 Cb -0.26 -3.30 -0.03 0.00 1.11 0.00 0.00 32.58 30.10 9icy s HIS 252 CO 0.29 -0.73 -0.15 1.03 -0.85 0.00 0.00 174.74 174.34 9icy s ARG 253 N 2.07 2.10 0.21 1.40 3.00 0.20 -4.24 118.95 123.70 9icy s ARG 253 Ca 0.52 -0.98 -0.30 0.00 0.00 0.00 0.00 55.73 54.97 9icy s ARG 253 Cb -0.21 -2.24 -0.09 0.00 0.00 0.00 0.00 34.95 32.41 9icy s ARG 253 CO 0.20 0.53 1.29 1.03 0.00 0.00 0.00 175.30 178.36 9icy s ARG 254 N -1.67 4.40 -0.04 3.54 1.81 -1.26 -1.11 118.95 124.62 9icy s ARG 254 Ca 0.17 2.04 -0.03 0.00 -1.72 0.00 0.00 55.73 56.19 9icy s ARG 254 Cb -0.11 -3.19 0.02 0.00 -0.45 0.00 0.00 34.95 31.23 9icy s ARG 254 CO 0.08 -0.22 0.11 -1.50 -0.68 0.00 0.00 175.30 173.09 9icy s ILE 255 N -0.06 -0.03 -0.06 1.52 2.07 -0.05 -1.77 121.20 122.83 9icy s ILE 255 Ca 0.55 0.09 0.02 0.00 -1.41 0.00 0.00 60.65 59.90 9icy s ILE 255 Cb -0.36 -0.17 0.01 0.00 0.13 0.00 0.00 42.46 42.07 9icy s ILE 255 CO 0.39 0.04 -0.10 -1.81 -1.91 0.00 0.00 174.94 171.55 9icy s ASP 256 N 0.58 1.54 -0.06 4.50 1.01 -0.43 0.21 116.67 124.02 9icy s ASP 256 Ca -0.04 -0.25 -0.00 0.00 0.71 0.00 0.00 52.55 52.96 9icy s ASP 256 Cb -0.06 -0.70 0.03 0.00 1.01 0.00 0.00 42.92 43.19 9icy s ASP 256 CO -0.02 0.02 -0.02 -0.63 0.21 0.00 0.00 175.17 174.72 9icy s ILE 257 N 0.67 0.48 -0.10 0.77 1.01 -1.02 0.30 121.20 123.31 9icy s ILE 257 Ca -0.13 0.00 0.02 0.00 0.00 0.00 0.00 60.65 60.54 9icy s ILE 257 Cb -0.15 -0.58 -0.02 0.00 0.01 0.00 0.00 42.46 41.73 9icy s ILE 257 CO 0.03 0.25 -0.16 0.00 0.00 0.00 0.00 174.94 175.06 9icy s ARG 258 N 1.55 3.05 0.30 2.79 1.70 -0.97 -1.55 118.95 125.82 9icy s ARG 258 Ca -0.01 -0.74 -0.24 0.00 -0.47 0.00 0.00 55.73 54.28 9icy s ARG 258 Cb -0.13 -2.48 -0.09 0.00 -0.57 0.00 0.00 34.95 31.67 9icy s ARG 258 CO -0.04 0.32 0.87 -1.17 -1.08 0.00 0.00 175.30 174.21 9icy s LEU 259 N 0.04 4.31 0.03 -1.89 2.96 0.20 0.67 118.68 124.99 9icy s LEU 259 Ca -0.06 1.69 -0.00 0.00 -0.22 0.00 0.00 54.13 55.54 9icy s LEU 259 Cb -0.15 -3.92 -0.03 0.00 0.50 0.00 0.00 46.19 42.59 9icy s LEU 259 CO 0.05 -0.06 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.35 9icy s ILE 260 N -1.63 0.19 -0.23 6.68 -1.09 1.25 -4.84 121.20 121.52 9icy s ILE 260 Ca 0.49 -1.20 -0.29 0.00 -2.23 0.00 0.00 60.65 57.42 9icy s ILE 260 Cb -0.17 -0.67 -0.01 0.00 -1.58 0.00 0.00 42.46 40.03 9icy s ILE 260 CO 0.22 -0.64 1.29 -2.84 -1.23 0.00 0.00 174.94 171.74 9icy s PRO 261 N -2.22 4.08 0.54 2.79 0.02 -1.26 -3.54 135.00 135.41 9icy s PRO 261 Ca -0.08 1.48 0.43 0.00 0.02 0.00 0.00 61.00 62.85 9icy s PRO 261 Cb -0.05 -3.83 1.64 0.00 0.02 0.00 0.00 34.50 32.28 9icy s PRO 261 CO -0.04 -0.91 1.68 -0.22 -0.33 0.00 0.00 177.00 177.19 9icy h LYS 262 N 8.79 0.01 0.00 5.54 1.63 0.55 1.62 116.57 134.71 9icy h LYS 262 Ca -0.27 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.53 9icy h LYS 262 Cb 1.10 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.73 9icy h LYS 262 CO 1.00 0.01 0.00 -0.40 -3.45 0.00 0.00 179.45 176.61 9icy n ASP 263 N -4.09 0.00 -0.45 4.20 5.75 -1.26 -3.42 116.55 117.28 9icy n ASP 263 Ca 0.35 -0.99 0.00 0.00 -0.01 0.00 0.00 54.79 54.14 9icy n ASP 263 Cb 1.63 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.72 9icy n ASP 263 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 9icy n GLN 264 N -0.88 0.00 0.00 0.11 10.64 0.55 -4.90 117.38 122.91 9icy n GLN 264 Ca 0.14 -0.83 0.00 0.00 -1.83 0.00 0.00 57.00 54.49 9icy n GLN 264 Cb 0.07 -0.44 0.00 0.00 -0.86 0.00 0.00 30.24 29.01 9icy n GLN 264 CO 0.00 0.00 0.00 0.98 -1.83 0.00 0.00 177.06 176.21 9icy n TYR 265 N 0.00 0.00 0.10 2.61 9.36 -1.14 -2.24 117.16 125.85 9icy n TYR 265 Ca 0.00 0.00 0.08 0.00 3.32 0.00 0.00 57.90 61.30 9icy n TYR 265 Cb 0.66 0.00 0.13 0.00 -0.63 0.00 0.00 39.34 39.49 9icy n TYR 265 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 9icy n TYR 266 N 0.00 0.00 0.00 2.98 4.01 -1.26 0.21 117.16 123.10 9icy n TYR 266 Ca 0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.61 9icy n TYR 266 Cb 0.00 -0.08 -0.10 0.00 -0.31 0.00 0.00 39.34 38.86 9icy n TYR 266 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 9icy h GLY 268 N -0.65 -0.23 0.92 0.00 0.00 0.28 -1.91 103.07 101.48 9icy h GLY 268 Ca -0.01 0.12 0.02 0.00 0.00 0.00 0.00 47.33 47.47 9icy h GLY 268 CO 0.01 -0.11 0.53 -2.08 0.00 0.00 0.00 176.54 174.89 9icy h VAL 269 N -0.25 1.16 -0.41 4.60 2.07 -0.32 -1.01 116.25 122.09 9icy h VAL 269 Ca -0.00 -0.36 0.07 0.00 0.82 0.00 0.00 66.70 67.23 9icy h VAL 269 Cb 0.23 0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 29.95 9icy h VAL 269 CO -0.02 0.19 0.04 0.25 0.02 0.00 0.00 177.57 178.05 9icy h LEU 270 N 1.05 -0.08 0.95 2.57 5.85 0.11 -2.90 115.31 122.87 9icy h LEU 270 Ca 0.32 0.08 -0.05 0.00 0.84 0.00 0.00 57.88 59.07 9icy h LEU 270 Cb -0.04 0.13 0.01 0.00 0.37 0.00 0.00 40.66 41.13 9icy h LEU 270 CO -0.10 -0.01 -0.47 0.22 -0.34 0.00 0.00 178.44 177.74 9icy h TYR 271 N 0.16 -1.23 -0.45 1.25 3.20 -0.86 -3.13 116.97 115.90 9icy h TYR 271 Ca 0.20 -0.03 0.09 0.00 3.14 0.00 0.00 58.73 62.13 9icy h TYR 271 Cb 0.27 0.41 -0.02 0.00 1.54 0.00 0.00 36.73 38.93 9icy h TYR 271 CO -0.24 -0.76 0.31 0.74 -1.64 0.00 0.00 178.16 176.58 9icy h PHE 272 N -1.30 0.24 0.00 -3.82 0.04 -1.24 0.16 116.94 111.02 9icy h PHE 272 Ca -0.13 0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.61 9icy h PHE 272 Cb 1.00 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 39.07 9icy h PHE 272 CO -0.02 0.12 -0.18 1.15 -0.60 0.00 0.00 178.31 178.78 9icy h THR 273 N 0.23 0.48 0.00 -1.55 2.02 -1.51 -3.26 112.91 109.32 9icy h THR 273 Ca 0.21 -0.97 0.00 0.00 0.77 0.00 0.00 66.41 66.42 9icy h THR 273 Cb 0.52 1.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 9icy h THR 273 CO -0.04 0.18 0.00 0.61 0.37 0.00 0.00 175.52 176.64 9icy n GLY 274 N 0.04 1.50 3.72 2.16 0.00 0.56 -4.62 105.19 108.56 9icy n GLY 274 Ca -0.00 -0.53 -0.29 0.00 0.00 0.00 0.00 46.02 45.19 9icy n GLY 274 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 9icy s SER 275 N -4.00 2.22 0.43 1.61 1.04 0.24 -4.53 113.70 110.70 9icy s SER 275 Ca 0.00 0.71 0.20 0.00 0.48 0.00 0.00 55.95 57.34 9icy s SER 275 Cb 0.00 -1.06 1.14 0.00 0.10 0.00 0.00 66.02 66.21 9icy s SER 275 CO 0.00 -3.33 1.84 0.44 0.98 0.00 0.00 173.24 173.17 9icy h ASP 276 N -2.04 0.36 0.83 7.02 3.32 -1.89 -0.14 116.42 123.88 9icy h ASP 276 Ca -0.48 0.04 -0.24 0.00 0.02 0.00 0.00 57.03 56.38 9icy h ASP 276 Cb 1.30 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.79 9icy h ASP 276 CO 0.45 0.13 -1.22 0.16 -1.72 0.00 0.00 179.24 177.04 9icy h ILE 277 N 0.35 1.46 -0.61 0.35 -2.65 -1.90 -3.16 117.51 111.34 9icy h ILE 277 Ca 0.49 -3.20 -0.07 0.00 1.03 0.00 0.00 64.86 63.11 9icy h ILE 277 Cb 1.32 2.73 -0.02 0.00 -2.05 0.00 0.00 36.82 38.80 9icy h ILE 277 CO -0.17 0.84 0.10 0.15 0.03 0.00 0.00 178.15 179.10 9icy h PHE 278 N 0.01 1.08 0.48 0.16 3.57 -1.15 -1.10 116.94 119.98 9icy h PHE 278 Ca -0.10 -0.15 -0.02 0.00 3.53 0.00 0.00 57.97 61.23 9icy h PHE 278 Cb 1.85 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 40.30 9icy h PHE 278 CO 0.00 0.92 -0.23 -0.91 -2.23 0.00 0.00 178.31 175.86 9icy h ASN 279 N 0.92 -0.55 0.14 0.41 -0.26 -1.34 0.67 115.58 115.57 9icy h ASN 279 Ca 0.19 -0.02 0.01 0.00 -0.56 0.00 0.00 56.30 55.91 9icy h ASN 279 Cb 0.42 0.14 -0.03 0.00 -1.06 0.00 0.00 38.32 37.79 9icy h ASN 279 CO 0.01 -0.34 -0.39 0.11 -1.06 0.00 0.00 177.43 175.77 9icy h LYS 280 N -0.73 -0.57 -0.96 0.81 1.57 -1.50 1.87 116.57 117.05 9icy h LYS 280 Ca -0.07 0.04 0.19 0.00 -1.87 0.00 0.00 60.65 58.95 9icy h LYS 280 Cb 0.54 0.13 -0.11 0.00 0.08 0.00 0.00 32.23 32.87 9icy h LYS 280 CO 0.11 -0.38 0.55 -0.91 -0.57 0.00 0.00 179.45 178.24 9icy h ASN 281 N -0.59 0.66 -0.30 0.86 4.21 -1.17 2.23 115.58 121.48 9icy h ASN 281 Ca -0.01 0.11 -0.08 0.00 1.21 0.00 0.00 56.30 57.52 9icy h ASN 281 Cb 0.58 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.77 9icy h ASN 281 CO -0.18 0.20 -0.14 -0.03 -1.29 0.00 0.00 177.43 175.99 9icy h MET 282 N 0.66 0.62 -0.60 0.81 4.05 0.17 -2.17 114.93 118.46 9icy h MET 282 Ca 0.56 -0.27 0.00 0.00 -0.28 0.00 0.00 59.70 59.72 9icy h MET 282 Cb 0.92 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.68 9icy h MET 282 CO -0.41 0.85 0.38 0.00 0.23 0.00 0.00 176.91 177.96 9icy h ARG 283 N 0.37 0.79 -0.56 0.39 3.08 0.92 -1.94 114.38 117.43 9icy h ARG 283 Ca 0.07 -0.06 0.10 0.00 0.07 0.00 0.00 59.98 60.16 9icy h ARG 283 Cb 0.66 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 9icy h ARG 283 CO 0.04 0.54 0.38 0.00 -1.07 0.00 0.00 179.97 179.86 9icy h ALA 284 N 1.20 2.07 0.15 0.04 0.00 0.34 -2.96 119.26 120.11 9icy h ALA 284 Ca 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 9icy h ALA 284 Cb -0.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.66 9icy h ALA 284 CO -0.04 -0.20 -0.07 1.25 0.00 0.00 0.00 179.25 180.18 9icy h HIS 285 N 0.34 -0.18 -1.36 0.00 -0.00 -0.70 -3.30 115.15 109.95 9icy h HIS 285 Ca 0.26 -0.00 0.40 0.00 -0.00 0.00 0.00 60.37 61.02 9icy h HIS 285 Cb 0.57 0.06 -0.07 0.00 -0.00 0.00 0.00 27.41 27.97 9icy h HIS 285 CO -0.00 0.27 0.97 0.00 -0.00 0.00 0.00 177.93 179.16 9icy h ALA 286 N -0.14 3.18 -0.63 5.26 0.00 -1.29 0.54 119.26 126.18 9icy h ALA 286 Ca -0.02 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 9icy h ALA 286 Cb 0.53 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 9icy h ALA 286 CO 0.03 -1.60 0.12 1.25 0.00 0.00 0.00 179.25 179.05 9icy h LEU 287 N 0.04 1.00 -0.03 0.00 7.12 -1.51 3.83 115.31 125.76 9icy h LEU 287 Ca 0.67 -0.25 -0.09 0.00 0.13 0.00 0.00 57.88 58.33 9icy h LEU 287 Cb 2.56 -0.26 0.01 0.00 -0.53 0.00 0.00 40.66 42.43 9icy h LEU 287 CO -0.07 1.00 -0.35 -0.33 -0.13 0.00 0.00 178.44 178.56 9icy h GLU 288 N 0.96 0.29 -0.54 1.25 4.39 -0.08 -3.00 114.58 117.84 9icy h GLU 288 Ca 0.19 -0.27 0.00 0.00 0.34 0.00 0.00 59.36 59.62 9icy h GLU 288 Cb 0.42 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 9icy h GLU 288 CO 0.01 0.95 0.00 1.63 -1.16 0.00 0.00 179.01 180.44 9icy n LYS 289 N -4.42 0.40 -3.00 2.33 4.76 -0.21 -4.71 118.16 113.31 9icy n LYS 289 Ca -0.09 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.23 9icy n LYS 289 Cb 0.53 -1.21 0.05 0.00 -1.84 0.00 0.00 35.03 32.56 9icy n LYS 289 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 9icy n GLY 290 N 0.36 0.06 3.47 0.72 0.00 -0.81 -4.92 105.19 104.06 9icy n GLY 290 Ca 0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 9icy n GLY 290 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 9icy s PHE 291 N -3.19 1.07 -0.09 1.61 0.08 1.26 -1.49 117.98 117.23 9icy s PHE 291 Ca 0.20 -1.28 -0.05 0.00 0.12 0.00 0.00 56.93 55.92 9icy s PHE 291 Cb -0.09 -0.14 0.04 0.00 -0.57 0.00 0.00 43.02 42.27 9icy s PHE 291 CO 0.41 -1.08 0.21 -0.08 -0.10 0.00 0.00 175.22 174.58 9icy s THR 292 N -3.21 -0.03 0.13 0.64 -1.32 -0.91 -2.55 115.64 108.38 9icy s THR 292 Ca 0.31 0.12 0.07 0.00 -1.21 0.00 0.00 61.69 60.98 9icy s THR 292 Cb 0.00 -0.32 -0.04 0.00 -1.51 0.00 0.00 72.50 70.63 9icy s THR 292 CO 0.20 0.05 -0.16 -0.63 -2.21 0.00 0.00 174.62 171.87 9icy s ILE 293 N 0.97 1.47 -0.13 5.08 -1.09 -1.26 -0.72 121.20 125.51 9icy s ILE 293 Ca -0.07 -1.73 -0.33 0.00 -2.23 0.00 0.00 60.65 56.29 9icy s ILE 293 Cb -0.09 -1.59 0.13 0.00 -1.58 0.00 0.00 42.46 39.34 9icy s ILE 293 CO -0.06 -0.35 1.10 0.54 -1.23 0.00 0.00 174.94 174.94 9icy s ASN 294 N -2.42 -0.21 0.05 3.58 6.03 -0.80 -5.01 114.94 116.16 9icy s ASN 294 Ca 0.10 0.02 0.00 0.00 -1.03 0.00 0.00 52.86 51.94 9icy s ASN 294 Cb -0.06 0.22 0.00 0.00 -3.03 0.00 0.00 41.25 38.39 9icy s ASN 294 CO 0.04 -0.35 0.09 -1.84 -2.03 0.00 0.00 177.10 173.01 9icy n GLU 295 N -0.09 0.00 0.00 3.55 0.00 -1.26 -1.29 120.64 121.55 9icy n GLU 295 Ca -0.03 0.07 0.00 0.00 0.00 0.00 0.00 57.16 57.21 9icy n GLU 295 Cb 0.59 -0.25 0.00 0.00 0.00 0.00 0.00 31.44 31.79 9icy n GLU 295 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 9icy n TYR 296 N -0.57 0.00 -3.39 -1.84 4.01 -1.26 -2.60 117.16 111.51 9icy n TYR 296 Ca 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.71 9icy n TYR 296 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 9icy n TYR 296 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 9icy n THR 297 N -0.31 0.00 -3.50 -0.72 -2.24 -0.41 -4.62 114.28 102.47 9icy n THR 297 Ca 0.00 -0.31 -0.12 0.00 -2.27 0.00 0.00 64.05 61.35 9icy n THR 297 Cb 0.00 0.24 -0.11 0.00 -2.10 0.00 0.00 70.33 68.36 9icy n THR 297 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 9icy s ILE 298 N -2.68 -0.50 -0.02 2.28 2.07 -1.25 -1.90 121.20 119.20 9icy s ILE 298 Ca 0.05 0.03 0.06 0.00 -1.41 0.00 0.00 60.65 59.38 9icy s ILE 298 Cb -0.01 -0.67 -0.02 0.00 0.13 0.00 0.00 42.46 41.88 9icy s ILE 298 CO 0.04 -0.06 -0.20 -0.13 -1.91 0.00 0.00 174.94 172.68 9icy s ARG 299 N 2.47 2.26 0.42 3.50 0.52 0.10 -1.41 118.95 126.81 9icy s ARG 299 Ca 0.07 -0.84 -0.25 0.00 -0.52 0.00 0.00 55.73 54.18 9icy s ARG 299 Cb -0.14 -2.21 -0.08 0.00 0.52 0.00 0.00 34.95 33.04 9icy s ARG 299 CO -0.13 0.58 1.30 -1.25 0.02 0.00 0.00 175.30 175.83 9icy s PRO 300 N -0.82 3.87 -0.06 3.54 0.04 -1.26 -2.14 135.00 138.17 9icy s PRO 300 Ca 0.11 2.15 -0.13 0.00 0.04 0.00 0.00 61.00 63.17 9icy s PRO 300 Cb -0.10 -2.69 -0.05 0.00 0.04 0.00 0.00 34.50 31.70 9icy s PRO 300 CO 0.01 -0.57 0.33 -1.17 0.04 0.00 0.00 177.00 175.64 9icy s LEU 301 N -2.58 4.41 -0.16 -3.56 2.96 -0.55 -4.23 118.68 114.96 9icy s LEU 301 Ca 0.59 0.76 -0.04 0.00 -0.22 0.00 0.00 54.13 55.22 9icy s LEU 301 Cb -0.38 -2.43 -0.03 0.00 0.50 0.00 0.00 46.19 43.85 9icy s LEU 301 CO 0.48 0.29 -0.03 -0.83 -1.32 0.00 0.00 176.35 174.94 9icy s GLY 302 N -0.72 1.73 0.19 7.98 0.00 -1.23 -4.93 107.32 110.35 9icy s GLY 302 Ca 0.20 -0.82 0.10 0.00 0.00 0.00 0.00 44.72 44.21 9icy s GLY 302 CO 0.09 -0.05 1.24 1.55 0.00 0.00 0.00 173.10 175.94 9icy n VAL 303 N 3.56 1.14 0.00 1.40 3.14 -1.26 -2.96 118.33 123.35 9icy n VAL 303 Ca -0.17 0.64 0.00 0.00 -2.96 0.00 0.00 64.34 61.85 9icy n VAL 303 Cb 0.52 -1.64 0.00 0.00 -1.06 0.00 0.00 33.84 31.66 9icy n VAL 303 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 9icy n THR 304 N -1.84 1.34 0.00 1.55 -2.24 -1.26 -4.69 114.28 107.14 9icy n THR 304 Ca -0.01 0.38 0.00 0.00 -2.27 0.00 0.00 64.05 62.16 9icy n THR 304 Cb 0.15 -1.38 0.00 0.00 -2.10 0.00 0.00 70.33 66.99 9icy n THR 304 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 9icy n GLY 305 N -1.32 3.70 0.74 3.38 0.00 -1.15 -5.06 105.19 105.48 9icy n GLY 305 Ca 0.00 -0.80 -0.06 0.00 0.00 0.00 0.00 46.02 45.16 9icy n GLY 305 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 9icy n VAL 306 N 0.00 0.00 0.00 1.61 0.24 -1.17 -4.88 118.33 114.13 9icy n VAL 306 Ca 0.00 -0.52 0.00 0.00 -2.04 0.00 0.00 64.34 61.78 9icy n VAL 306 Cb 0.00 0.19 0.00 0.00 -1.47 0.00 0.00 33.84 32.56 9icy n VAL 306 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 9icy n ALA 307 N -2.57 0.00 -2.25 2.33 0.00 -1.26 -3.50 120.51 113.26 9icy n ALA 307 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 9icy n ALA 307 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 9icy n ALA 307 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 9icy n GLY 308 N -0.43 2.83 0.52 0.00 0.00 -1.26 -4.71 105.19 102.13 9icy n GLY 308 Ca 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.11 9icy n GLY 308 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 9icy n GLU 309 N 0.00 0.00 -1.47 1.61 4.71 -1.26 -4.05 120.64 120.17 9icy n GLU 309 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 57.16 56.93 9icy n GLU 309 Cb 0.00 -0.72 -0.23 0.00 -1.01 0.00 0.00 31.44 29.48 9icy n GLU 309 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 9icy n PRO 310 N -0.52 0.00 -1.15 3.49 -0.02 -1.26 -4.13 135.00 131.41 9icy n PRO 310 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 61.13 9icy n PRO 310 Cb 0.20 -0.98 0.09 0.00 -0.02 0.00 0.00 33.50 32.78 9icy n PRO 310 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 9icy n LEU 311 N 5.42 1.61 -4.66 2.45 4.32 -0.50 -4.93 117.00 120.71 9icy n LEU 311 Ca 0.67 0.54 -0.39 0.00 -0.02 0.00 0.00 56.01 56.81 9icy n LEU 311 Cb 0.14 -1.29 -0.07 0.00 -1.62 0.00 0.00 43.42 40.58 9icy n LEU 311 CO 1.08 -2.83 0.22 -2.84 -1.22 0.00 0.00 177.39 171.80 9icy s PRO 312 N -3.26 4.17 -0.20 3.23 0.01 -1.26 -4.70 135.00 132.99 9icy s PRO 312 Ca 0.66 0.37 -0.03 0.00 0.01 0.00 0.00 61.00 62.01 9icy s PRO 312 Cb -0.31 -3.57 -0.01 0.00 0.01 0.00 0.00 34.50 30.63 9icy s PRO 312 CO 0.58 -0.15 -0.07 0.08 0.01 0.00 0.00 177.00 177.44 9icy s VAL 313 N 1.66 3.19 -1.23 3.83 1.01 -1.26 -4.98 120.40 122.62 9icy s VAL 313 Ca 0.23 -0.57 0.21 0.00 0.00 0.00 0.00 61.98 61.85 9icy s VAL 313 Cb -0.15 -2.42 -0.17 0.00 0.00 0.00 0.00 36.38 33.63 9icy s VAL 313 CO 0.09 0.45 0.92 0.47 0.00 0.00 0.00 175.10 177.04 9icy n ASP 314 N 4.53 1.23 0.00 3.32 9.92 -1.26 -4.94 116.55 129.35 9icy n ASP 314 Ca -0.18 -1.11 0.00 0.00 -0.53 0.00 0.00 54.79 52.96 9icy n ASP 314 Cb 0.51 0.87 0.00 0.00 -0.64 0.00 0.00 41.12 41.86 9icy n ASP 314 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 9icy n SER 315 N -1.12 0.00 -0.53 -2.24 2.88 -1.26 -5.00 113.62 106.35 9icy n SER 315 Ca 0.05 0.00 0.40 0.00 -1.33 0.00 0.00 58.87 57.99 9icy n SER 315 Cb 0.36 0.00 0.62 0.00 -0.75 0.00 0.00 64.21 64.43 9icy n SER 315 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 9icy n GLU 316 N -0.15 -0.00 0.48 -1.46 1.02 -1.26 -0.77 120.64 118.49 9icy n GLU 316 Ca 0.00 0.84 -0.20 0.00 -0.02 0.00 0.00 57.16 57.78 9icy n GLU 316 Cb 0.00 -1.91 -0.09 0.00 -0.02 0.00 0.00 31.44 29.42 9icy n GLU 316 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 9icy h LYS 317 N 0.00 -1.17 -0.87 3.49 1.63 -1.98 -2.98 116.57 114.70 9icy h LYS 317 Ca 0.71 0.08 0.19 0.00 -0.85 0.00 0.00 60.65 60.79 9icy h LYS 317 Cb 2.82 0.26 -0.16 0.00 -0.60 0.00 0.00 32.23 34.56 9icy h LYS 317 CO -0.04 -0.77 -0.11 -0.44 -3.45 0.00 0.00 179.45 174.64 9icy h ASP 318 N -1.24 -0.62 -0.20 4.20 3.32 -1.35 0.84 116.42 121.37 9icy h ASP 318 Ca -0.12 0.25 0.03 0.00 0.02 0.00 0.00 57.03 57.21 9icy h ASP 318 Cb 0.93 0.48 -0.03 0.00 0.22 0.00 0.00 39.33 40.93 9icy h ASP 318 CO 0.20 -0.28 -0.01 0.40 -1.72 0.00 0.00 179.24 177.84 9icy h ILE 319 N 0.03 0.85 0.58 0.35 2.04 -1.61 0.21 117.51 119.97 9icy h ILE 319 Ca 0.46 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 66.28 9icy h ILE 319 Cb 0.79 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 9icy h ILE 319 CO -0.85 0.01 -0.49 -0.26 0.00 0.00 0.00 178.15 176.56 9icy h PHE 320 N 0.05 -1.36 -0.93 1.37 0.04 0.67 -2.17 116.94 114.62 9icy h PHE 320 Ca 0.09 0.00 0.12 0.00 2.80 0.00 0.00 57.97 60.98 9icy h PHE 320 Cb 0.12 0.51 -0.14 0.00 2.20 0.00 0.00 35.95 38.65 9icy h PHE 320 CO -0.18 -0.68 -0.47 -0.44 -0.60 0.00 0.00 178.31 175.94 9icy h ASP 321 N -1.05 -1.73 -0.00 2.17 3.32 -0.35 0.76 116.42 119.54 9icy h ASP 321 Ca -0.08 0.31 0.00 0.00 0.02 0.00 0.00 57.03 57.28 9icy h ASP 321 Cb 0.89 0.82 -0.00 0.00 0.22 0.00 0.00 39.33 41.26 9icy h ASP 321 CO -0.01 -0.28 -0.01 1.88 -1.72 0.00 0.00 179.24 179.11 9icy h TYR 322 N -0.04 -0.02 0.00 4.55 -1.99 -0.38 1.24 116.97 120.34 9icy h TYR 322 Ca 0.25 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.98 9icy h TYR 322 Cb 0.52 0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.26 9icy h TYR 322 CO -0.91 -0.01 0.00 0.44 -0.00 0.00 0.00 178.16 177.69 9icy n ILE 323 N -2.69 0.00 -3.39 -2.88 -5.35 -0.42 -4.84 119.36 99.79 9icy n ILE 323 Ca -0.00 0.00 -0.17 0.00 -0.27 0.00 0.00 62.75 62.31 9icy n ILE 323 Cb 0.00 -0.66 0.01 0.00 -1.74 0.00 0.00 39.64 37.25 9icy n ILE 323 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 9icy n GLN 324 N -0.85 -1.67 -4.45 6.28 10.64 0.43 -4.88 117.38 122.89 9icy n GLN 324 Ca 0.06 1.30 -0.26 0.00 -1.83 0.00 0.00 57.00 56.27 9icy n GLN 324 Cb 0.03 -3.79 -0.07 0.00 -0.86 0.00 0.00 30.24 25.55 9icy n GLN 324 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.06 177.10 9icy n TRP 325 N -1.61 0.22 -3.10 2.61 -0.00 -0.74 -4.95 117.44 109.87 9icy n TRP 325 Ca -0.12 -2.63 -0.40 0.00 -0.00 0.00 0.00 57.50 54.35 9icy n TRP 325 Cb 0.60 -0.03 -0.05 0.00 -0.00 0.00 0.00 31.31 31.83 9icy n TRP 325 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 177.69 176.10 9icy s LYS 326 N -3.59 4.36 0.08 5.87 -2.85 -1.26 -4.55 119.74 117.79 9icy s LYS 326 Ca 0.19 0.74 -0.31 0.00 -1.00 0.00 0.00 55.97 55.60 9icy s LYS 326 Cb 0.01 -3.48 -0.09 0.00 -2.06 0.00 0.00 37.83 32.21 9icy s LYS 326 CO 0.14 -0.01 1.70 -0.47 0.10 0.00 0.00 175.35 176.80 9icy s TYR 327 N 1.11 2.32 -0.23 1.78 6.14 -1.26 -4.92 117.35 122.29 9icy s TYR 327 Ca 0.33 0.22 -0.04 0.00 0.64 0.00 0.00 57.07 58.23 9icy s TYR 327 Cb -0.17 -4.02 -0.00 0.00 0.42 0.00 0.00 41.96 38.19 9icy s TYR 327 CO 0.14 -4.14 -0.04 1.03 0.64 0.00 0.00 175.55 173.19 9icy s ARG 328 N 2.73 3.27 0.52 4.97 0.52 -1.26 -5.08 118.95 124.61 9icy s ARG 328 Ca 0.76 -0.70 -0.22 0.00 -0.52 0.00 0.00 55.73 55.05 9icy s ARG 328 Cb -0.41 -3.03 -0.07 0.00 0.52 0.00 0.00 34.95 31.96 9icy s ARG 328 CO 0.33 -0.25 1.19 0.39 0.02 0.00 0.00 175.30 176.98 9icy n GLU 329 N 4.78 1.47 -0.30 3.54 1.02 -1.26 -4.74 120.64 125.15 9icy n GLU 329 Ca -0.18 0.54 0.26 0.00 -0.02 0.00 0.00 57.16 57.76 9icy n GLU 329 Cb 0.50 -2.35 0.59 0.00 -0.02 0.00 0.00 31.44 30.16 9icy n GLU 329 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 9icy h PRO 330 N 1.30 0.24 -0.40 3.49 0.11 -1.95 0.63 132.00 135.43 9icy h PRO 330 Ca -0.49 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.65 9icy h PRO 330 Cb 1.32 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.34 9icy h PRO 330 CO 0.56 0.16 0.17 -0.22 -0.21 0.00 0.00 178.00 178.46 9icy h LYS 331 N 0.25 0.34 -0.87 1.05 3.64 -1.76 -2.26 116.57 116.95 9icy h LYS 331 Ca 0.55 -0.02 -0.29 0.00 -1.27 0.00 0.00 60.65 59.62 9icy h LYS 331 Cb 1.68 -0.08 -0.17 0.00 -0.41 0.00 0.00 32.23 33.25 9icy h LYS 331 CO -0.18 0.22 0.37 -0.40 -2.27 0.00 0.00 179.45 177.19 9icy n ASP 332 N -4.97 4.15 -1.06 4.20 5.68 0.22 -4.24 116.55 120.53 9icy n ASP 332 Ca 0.02 -3.18 -0.02 0.00 -0.50 0.00 0.00 54.79 51.11 9icy n ASP 332 Cb 0.13 -0.75 0.04 0.00 -1.14 0.00 0.00 41.12 39.40 9icy n ASP 332 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 9icy n ARG 333 N -0.41 1.36 0.02 0.11 5.12 -0.85 -4.30 116.66 117.71 9icy n ARG 333 Ca 0.42 -0.53 -0.04 0.00 -1.93 0.00 0.00 57.85 55.77 9icy n ARG 333 Cb 1.36 -1.34 0.19 0.00 -1.16 0.00 0.00 32.46 31.51 9icy n ARG 333 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 9icy h SER 334 N 0.34 0.49 0.00 0.55 0.02 -1.81 0.69 113.55 113.82 9icy h SER 334 Ca 0.08 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 9icy h SER 334 Cb 1.14 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.55 9icy h SER 334 CO 0.16 0.75 0.00 -1.84 -1.14 0.00 0.00 176.83 174.76