#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 8icy n THR 10 N 0.00 0.00 0.15 2.62 -1.04 -1.26 -4.66 114.28 110.09 8icy n THR 10 Ca 0.00 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.04 8icy n THR 10 Cb 0.00 0.00 0.11 0.00 -1.82 0.00 0.00 70.33 68.62 8icy n THR 10 CO 0.00 0.00 0.00 0.17 -0.64 0.00 0.00 175.07 174.60 8icy h LEU 11 N 0.00 0.00 -2.77 -4.42 -0.00 -1.96 -3.28 115.31 102.87 8icy h LEU 11 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.87 8icy h LEU 11 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.64 8icy h LEU 11 CO 0.00 0.49 -0.22 0.59 -0.00 0.00 0.00 178.44 179.30 8icy n ASN 12 N -3.32 1.68 0.00 0.17 5.03 -1.26 -4.57 115.26 112.99 8icy n ASN 12 Ca 0.01 -2.90 0.00 0.00 0.87 0.00 0.00 54.58 52.57 8icy n ASN 12 Cb 0.68 -0.38 0.00 0.00 -1.02 0.00 0.00 39.78 39.05 8icy n ASN 12 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 8icy n GLY 13 N -0.98 -0.65 0.36 7.41 0.00 -1.24 -2.04 105.19 108.05 8icy n GLY 13 Ca 0.12 0.14 -0.04 0.00 0.00 0.00 0.00 46.02 46.24 8icy n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 8icy n GLY 14 N -0.23 -2.04 0.39 -0.02 0.00 -1.26 -0.32 105.19 101.71 8icy n GLY 14 Ca 0.00 1.04 -0.05 0.00 0.00 0.00 0.00 46.02 47.01 8icy n GLY 14 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 8icy h ILE 15 N 0.00 0.03 -0.47 -0.61 2.04 -1.91 5.14 117.51 121.73 8icy h ILE 15 Ca 0.26 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.98 8icy h ILE 15 Cb 0.49 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 8icy h ILE 15 CO -0.89 0.00 -0.24 0.71 0.00 0.00 0.00 178.15 177.73 8icy h THR 16 N -0.07 1.27 -0.39 -0.27 1.35 -0.49 -2.49 112.91 111.82 8icy h THR 16 Ca 0.25 -1.41 -0.04 0.00 -0.55 0.00 0.00 66.41 64.67 8icy h THR 16 Cb 0.54 1.15 -0.02 0.00 -1.73 0.00 0.00 68.15 68.10 8icy h THR 16 CO -0.88 0.49 0.09 0.44 -0.25 0.00 0.00 175.52 175.41 8icy h ASP 17 N 0.85 0.58 -0.79 5.36 3.32 0.28 0.16 116.42 126.19 8icy h ASP 17 Ca 0.10 -0.23 -0.04 0.00 0.02 0.00 0.00 57.03 56.89 8icy h ASP 17 Cb 0.83 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.19 8icy h ASP 17 CO 0.07 0.66 0.35 -0.03 -1.72 0.00 0.00 179.24 178.57 8icy h MET 18 N 0.48 1.15 -0.23 3.56 1.85 1.01 -2.11 114.93 120.64 8icy h MET 18 Ca 0.12 -0.19 0.05 0.00 -0.61 0.00 0.00 59.70 59.07 8icy h MET 18 Cb 0.31 -0.20 -0.05 0.00 0.43 0.00 0.00 31.60 32.09 8icy h MET 18 CO 0.00 0.91 -0.12 -0.07 -0.40 0.00 0.00 176.91 177.24 8icy h LEU 19 N 1.13 -0.40 -0.98 3.39 4.07 -1.25 -0.22 115.31 121.04 8icy h LEU 19 Ca 0.27 0.09 -0.08 0.00 0.08 0.00 0.00 57.88 58.24 8icy h LEU 19 Cb 0.17 0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.11 8icy h LEU 19 CO -0.03 -0.15 -0.13 0.71 -1.08 0.00 0.00 178.44 177.76 8icy h THR 20 N -0.10 1.24 0.30 0.22 1.35 -0.38 0.85 112.91 116.40 8icy h THR 20 Ca 0.13 -1.09 0.00 0.00 -0.55 0.00 0.00 66.41 64.89 8icy h THR 20 Cb 0.28 1.13 -0.03 0.00 -1.73 0.00 0.00 68.15 67.80 8icy h THR 20 CO -0.29 0.36 -0.46 -0.33 -0.25 0.00 0.00 175.52 174.55 8icy h GLU 21 N 0.54 -0.79 -0.36 4.72 5.08 -0.55 0.12 114.58 123.33 8icy h GLU 21 Ca 0.09 0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.59 8icy h GLU 21 Cb 0.54 0.18 -0.08 0.00 0.50 0.00 0.00 28.75 29.89 8icy h GLU 21 CO 0.03 -0.53 -0.18 -0.07 -1.00 0.00 0.00 179.01 177.26 8icy h LEU 22 N -0.82 -0.61 -0.02 1.33 -0.00 -0.96 0.24 115.31 114.46 8icy h LEU 22 Ca -0.02 0.14 -0.00 0.00 -0.00 0.00 0.00 57.88 58.00 8icy h LEU 22 Cb 0.77 0.33 -0.00 0.00 -0.00 0.00 0.00 40.66 41.76 8icy h LEU 22 CO -0.16 -0.22 0.01 0.00 -0.00 0.00 0.00 178.44 178.08 8icy h ALA 23 N 1.14 0.02 -0.11 1.53 0.00 -0.43 -0.66 119.26 120.74 8icy h ALA 23 Ca 0.18 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 8icy h ALA 23 Cb 0.40 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 8icy h ALA 23 CO -0.44 -0.43 0.00 -0.91 0.00 0.00 0.00 179.25 177.47 8icy h ASN 24 N -0.07 0.13 0.69 0.00 2.35 -0.52 0.38 115.58 118.55 8icy h ASN 24 Ca 0.01 -0.01 -0.13 0.00 -0.55 0.00 0.00 56.30 55.61 8icy h ASN 24 Cb 0.09 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 8icy h ASN 24 CO -0.00 0.17 -0.64 0.15 -1.65 0.00 0.00 177.43 175.46 8icy h PHE 25 N 0.15 0.00 -0.06 1.19 3.57 -0.01 -2.67 116.94 119.10 8icy h PHE 25 Ca 0.04 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.40 8icy h PHE 25 Cb 0.11 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 8icy h PHE 25 CO 0.00 0.64 -0.59 0.93 -2.23 0.00 0.00 178.31 177.06 8icy h GLU 26 N 0.00 0.20 0.20 1.11 4.39 0.12 -3.04 114.58 117.56 8icy h GLU 26 Ca -0.01 -0.13 -0.32 0.00 0.34 0.00 0.00 59.36 59.24 8icy h GLU 26 Cb 1.15 0.02 0.03 0.00 -0.10 0.00 0.00 28.75 29.85 8icy h GLU 26 CO 0.08 0.73 -1.37 1.57 -1.16 0.00 0.00 179.01 178.86 8icy h LYS 27 N 0.15 0.53 0.00 2.33 5.09 -0.93 -2.74 116.57 121.01 8icy h LYS 27 Ca -0.00 -0.84 0.00 0.00 0.09 0.00 0.00 60.65 59.90 8icy h LYS 27 Cb 1.07 0.30 0.00 0.00 0.10 0.00 0.00 32.23 33.70 8icy h LYS 27 CO 0.09 1.39 0.00 0.09 -2.09 0.00 0.00 179.45 178.93 8icy n ASN 28 N -3.72 0.00 -0.34 7.07 5.03 -1.02 -4.35 115.26 117.94 8icy n ASN 28 Ca -0.15 0.08 0.09 0.00 0.87 0.00 0.00 54.58 55.48 8icy n ASN 28 Cb 1.06 -0.09 0.29 0.00 -1.02 0.00 0.00 39.78 40.02 8icy n ASN 28 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 8icy h VAL 29 N 0.00 0.85 -3.62 2.41 2.07 -1.75 -3.40 116.25 112.81 8icy h VAL 29 Ca 0.00 -0.30 -0.67 0.00 0.82 0.00 0.00 66.70 66.54 8icy h VAL 29 Cb 0.00 -0.11 -0.17 0.00 -1.52 0.00 0.00 31.29 29.49 8icy h VAL 29 CO 0.00 0.16 -0.71 -0.94 0.02 0.00 0.00 177.57 176.10 8icy s SER 30 N -5.64 4.57 -0.56 0.57 1.04 -1.19 -5.01 113.70 107.47 8icy s SER 30 Ca -0.11 -0.18 -0.02 0.00 0.48 0.00 0.00 55.95 56.12 8icy s SER 30 Cb 0.23 -1.04 0.27 0.00 0.10 0.00 0.00 66.02 65.58 8icy s SER 30 CO 0.80 0.27 2.23 1.67 0.98 0.00 0.00 173.24 179.19 8icy n GLN 31 N 1.48 2.40 -2.44 4.02 7.27 -1.25 -3.69 117.38 125.17 8icy n GLN 31 Ca -0.15 -2.66 -0.40 0.00 0.07 0.00 0.00 57.00 53.86 8icy n GLN 31 Cb 0.52 -2.08 0.01 0.00 2.41 0.00 0.00 30.24 31.11 8icy n GLN 31 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 8icy n ALA 32 N -0.04 6.26 -0.59 1.69 0.00 -1.03 -4.88 120.51 121.92 8icy n ALA 32 Ca 0.49 -4.45 0.46 0.00 0.00 0.00 0.00 53.44 49.94 8icy n ALA 32 Cb 0.52 -2.30 0.73 0.00 0.00 0.00 0.00 19.45 18.40 8icy n ALA 32 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 8icy n ILE 33 N 0.30 -0.09 0.08 0.00 0.13 -1.26 -0.57 119.36 117.94 8icy n ILE 33 Ca 0.51 1.53 -0.10 0.00 -1.10 0.00 0.00 62.75 63.59 8icy n ILE 33 Cb 0.26 -2.54 -0.07 0.00 -0.84 0.00 0.00 39.64 36.46 8icy n ILE 33 CO 0.00 0.00 0.00 0.45 2.80 0.00 0.00 176.55 179.80 8icy h HIS 34 N 0.00 -0.26 -0.89 9.51 3.86 -1.94 0.16 115.15 125.59 8icy h HIS 34 Ca 0.87 -0.01 0.07 0.00 -1.16 0.00 0.00 60.37 60.15 8icy h HIS 34 Cb 3.25 0.09 -0.06 0.00 1.06 0.00 0.00 27.41 31.74 8icy h HIS 34 CO -0.00 0.12 0.58 0.87 0.86 0.00 0.00 177.93 180.36 8icy h LYS 35 N -0.91 0.96 -0.67 2.45 1.57 -1.62 1.50 116.57 119.86 8icy h LYS 35 Ca -0.03 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 8icy h LYS 35 Cb 0.50 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 8icy h LYS 35 CO 0.05 0.64 0.42 -0.92 -0.57 0.00 0.00 179.45 179.06 8icy h TYR 36 N 0.99 0.85 -0.01 -1.35 3.20 -0.79 0.26 116.97 120.13 8icy h TYR 36 Ca 0.39 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 62.12 8icy h TYR 36 Cb 0.23 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 8icy h TYR 36 CO -0.00 0.56 -0.72 -0.91 -1.64 0.00 0.00 178.16 175.45 8icy h ASN 37 N 0.91 0.06 0.09 -2.11 -0.26 0.44 -3.18 115.58 111.54 8icy h ASN 37 Ca 0.24 -0.04 -0.00 0.00 -0.56 0.00 0.00 56.30 55.94 8icy h ASN 37 Cb -0.07 -0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 37.17 8icy h ASN 37 CO -0.05 0.75 -0.13 0.00 -1.06 0.00 0.00 177.43 176.94 8icy h ALA 38 N 1.24 -0.79 -1.03 -0.83 0.00 0.50 -2.91 119.26 115.45 8icy h ALA 38 Ca -0.01 -0.04 0.29 0.00 0.00 0.00 0.00 54.91 55.15 8icy h ALA 38 Cb 1.26 0.44 -0.13 0.00 0.00 0.00 0.00 17.79 19.37 8icy h ALA 38 CO 0.10 -0.80 0.61 1.88 0.00 0.00 0.00 179.25 181.03 8icy h TYR 39 N -0.24 0.90 -0.05 0.00 0.05 -1.46 -2.62 116.97 113.55 8icy h TYR 39 Ca -0.01 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 8icy h TYR 39 Cb 0.21 -0.25 -0.00 0.00 1.01 0.00 0.00 36.73 37.70 8icy h TYR 39 CO -0.19 -0.06 -0.03 0.07 -1.05 0.00 0.00 178.16 176.90 8icy h ARG 40 N 0.41 0.11 -0.73 4.88 0.11 -1.49 0.17 114.38 117.85 8icy h ARG 40 Ca 0.69 -0.05 -0.05 0.00 0.10 0.00 0.00 59.98 60.67 8icy h ARG 40 Cb 1.55 -0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.60 8icy h ARG 40 CO -0.50 0.50 0.25 1.57 0.10 0.00 0.00 179.97 181.89 8icy h LYS 41 N -0.27 1.12 0.29 0.08 -0.00 -1.33 0.95 116.57 117.41 8icy h LYS 41 Ca 0.01 -0.23 0.00 0.00 -0.00 0.00 0.00 60.65 60.44 8icy h LYS 41 Cb 0.46 -0.17 -0.04 0.00 -0.00 0.00 0.00 32.23 32.49 8icy h LYS 41 CO 0.01 0.95 -0.47 0.00 -0.00 0.00 0.00 179.45 179.94 8icy h ALA 42 N 1.12 -0.94 0.00 0.07 0.00 -1.50 0.58 119.26 118.60 8icy h ALA 42 Ca 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.02 8icy h ALA 42 Cb 0.27 0.73 0.00 0.00 0.00 0.00 0.00 17.79 18.80 8icy h ALA 42 CO -0.01 -1.09 0.00 0.00 0.00 0.00 0.00 179.25 178.15 8icy h ALA 43 N -0.51 1.00 0.10 0.00 0.00 -0.57 0.24 119.26 119.52 8icy h ALA 43 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.59 8icy h ALA 43 Cb 0.77 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 8icy h ALA 43 CO -0.17 0.00 -1.55 1.03 0.00 0.00 0.00 179.25 178.56 8icy h SER 44 N 0.00 0.33 0.13 0.00 0.87 0.18 -3.29 113.55 111.77 8icy h SER 44 Ca 0.00 -0.49 -0.22 0.00 -1.23 0.00 0.00 61.79 59.86 8icy h SER 44 Cb 0.11 -0.11 0.01 0.00 -0.44 0.00 0.00 62.40 61.97 8icy h SER 44 CO 0.00 1.41 -1.03 -0.37 -0.53 0.00 0.00 176.83 176.31 8icy h VAL 45 N 0.06 1.33 0.00 2.23 -1.51 0.22 -3.08 116.25 115.49 8icy h VAL 45 Ca -0.25 -2.48 -0.01 0.00 -1.23 0.00 0.00 66.70 62.74 8icy h VAL 45 Cb 2.00 3.01 -0.00 0.00 -2.13 0.00 0.00 31.29 34.17 8icy h VAL 45 CO 0.15 0.70 -0.03 0.16 -1.23 0.00 0.00 177.57 177.32 8icy h ILE 46 N -0.37 0.38 -0.51 7.19 3.07 -0.85 -0.10 117.51 126.32 8icy h ILE 46 Ca -0.20 -0.16 -0.09 0.00 1.55 0.00 0.00 64.86 65.96 8icy h ILE 46 Cb 1.67 1.11 -0.02 0.00 -0.27 0.00 0.00 36.82 39.31 8icy h ILE 46 CO 0.11 0.03 -0.03 0.00 -1.05 0.00 0.00 178.15 177.21 8icy h ALA 47 N 1.97 0.69 0.00 0.16 0.00 -1.63 -2.64 119.26 117.81 8icy h ALA 47 Ca -0.00 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 8icy h ALA 47 Cb 0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 8icy h ALA 47 CO 0.00 0.53 -0.28 0.87 0.00 0.00 0.00 179.25 180.37 8icy h LYS 48 N 0.78 0.00 -5.74 0.00 1.57 -0.97 -3.41 116.57 108.80 8icy h LYS 48 Ca 0.14 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.32 8icy h LYS 48 Cb 0.56 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.85 8icy h LYS 48 CO 0.03 0.28 1.52 0.98 -0.57 0.00 0.00 179.45 181.69 8icy n TYR 49 N -3.22 1.37 0.28 -1.35 4.19 -0.50 -4.81 117.16 113.12 8icy n TYR 49 Ca 0.02 0.28 0.02 0.00 3.31 0.00 0.00 57.90 61.53 8icy n TYR 49 Cb 0.60 -2.52 0.12 0.00 0.49 0.00 0.00 39.34 38.03 8icy n TYR 49 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 8icy n PRO 50 N 8.39 0.14 -4.01 2.98 -0.04 -1.26 -4.80 135.00 136.40 8icy n PRO 50 Ca 0.45 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.82 8icy n PRO 50 Cb 0.25 -1.46 -0.08 0.00 -0.04 0.00 0.00 33.50 32.16 8icy n PRO 50 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 8icy s HIS 51 N -2.00 0.49 -0.20 0.54 3.76 -1.26 -5.11 115.29 111.51 8icy s HIS 51 Ca 0.06 -0.90 -0.29 0.00 -0.15 0.00 0.00 55.06 53.78 8icy s HIS 51 Cb 0.03 -0.22 -0.04 0.00 1.11 0.00 0.00 32.58 33.45 8icy s HIS 51 CO 0.05 -0.57 1.85 0.15 -0.85 0.00 0.00 174.74 175.36 8icy s LYS 52 N -3.96 3.61 -0.00 1.40 1.02 -1.26 -4.86 119.74 115.68 8icy s LYS 52 Ca 0.15 1.86 -0.30 0.00 0.02 0.00 0.00 55.97 57.70 8icy s LYS 52 Cb 0.05 -4.17 -0.07 0.00 -0.52 0.00 0.00 37.83 33.12 8icy s LYS 52 CO -0.03 -1.54 1.83 0.42 -0.92 0.00 0.00 175.35 175.11 8icy s ILE 53 N 6.14 3.26 -0.41 2.17 1.01 -1.26 -4.81 121.20 127.29 8icy s ILE 53 Ca 0.83 0.32 0.23 0.00 0.00 0.00 0.00 60.65 62.02 8icy s ILE 53 Cb -0.29 -3.20 -0.13 0.00 0.01 0.00 0.00 42.46 38.84 8icy s ILE 53 CO 0.33 -0.03 0.92 0.29 0.00 0.00 0.00 174.94 176.45 8icy n LYS 54 N 7.36 0.43 -3.85 2.79 4.01 -1.26 -5.03 118.16 122.61 8icy n LYS 54 Ca 0.19 -0.01 -0.04 0.00 -0.51 0.00 0.00 58.31 57.94 8icy n LYS 54 Cb 0.42 -1.63 0.01 0.00 -0.51 0.00 0.00 35.03 33.32 8icy n LYS 54 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 8icy s SER 55 N -4.37 -0.02 0.04 4.39 1.04 -1.26 -5.02 113.70 108.49 8icy s SER 55 Ca 0.00 -0.70 -0.29 0.00 0.48 0.00 0.00 55.95 55.44 8icy s SER 55 Cb 0.13 0.54 -0.17 0.00 0.10 0.00 0.00 66.02 66.62 8icy s SER 55 CO 0.82 -1.07 1.40 1.23 0.98 0.00 0.00 173.24 176.60 8icy h GLY 56 N 2.00 -0.84 -0.16 7.32 0.00 -1.92 -2.89 103.07 106.58 8icy h GLY 56 Ca -0.28 0.31 0.25 0.00 0.00 0.00 0.00 47.33 47.62 8icy h GLY 56 CO 0.35 -0.31 0.61 0.00 0.00 0.00 0.00 176.54 177.19 8icy h ALA 57 N -0.67 1.87 -0.34 3.60 0.00 -1.96 0.45 119.26 122.20 8icy h ALA 57 Ca -0.08 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 8icy h ALA 57 Cb 0.66 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 8icy h ALA 57 CO 0.13 -0.34 0.20 1.49 0.00 0.00 0.00 179.25 180.74 8icy h GLU 58 N 0.55 0.47 -0.24 0.00 4.81 -1.93 -2.39 114.58 115.86 8icy h GLU 58 Ca 0.64 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.80 8icy h GLU 58 Cb 1.28 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 8icy h GLU 58 CO -0.45 0.37 0.05 0.00 -0.73 0.00 0.00 179.01 178.25 8icy h ALA 59 N 1.07 0.31 -1.21 2.92 0.00 -1.05 -2.91 119.26 118.40 8icy h ALA 59 Ca 0.12 -0.17 0.35 0.00 0.00 0.00 0.00 54.91 55.22 8icy h ALA 59 Cb 0.03 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 8icy h ALA 59 CO -0.02 -0.03 1.15 -0.22 0.00 0.00 0.00 179.25 180.13 8icy h LYS 60 N 0.20 0.00 -0.28 0.00 3.64 0.36 0.11 116.57 120.61 8icy h LYS 60 Ca 0.07 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 8icy h LYS 60 Cb 0.29 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 8icy h LYS 60 CO 0.00 0.00 0.18 0.87 -2.27 0.00 0.00 179.45 178.23 8icy h LYS 61 N 0.00 0.36 -6.85 1.90 1.57 -1.30 -3.43 116.57 108.82 8icy h LYS 61 Ca 0.57 -0.02 -0.49 0.00 -1.87 0.00 0.00 60.65 58.85 8icy h LYS 61 Cb 2.87 -0.08 0.22 0.00 0.08 0.00 0.00 32.23 35.32 8icy h LYS 61 CO -0.01 0.24 -0.60 1.28 -0.57 0.00 0.00 179.45 179.79 8icy n LEU 62 N -4.90 -0.88 -4.81 2.94 4.32 0.40 -4.95 117.00 109.12 8icy n LEU 62 Ca -0.02 0.08 -0.38 0.00 -0.02 0.00 0.00 56.01 55.67 8icy n LEU 62 Cb 0.03 -1.15 -0.06 0.00 -1.62 0.00 0.00 43.42 40.62 8icy n LEU 62 CO 0.34 -3.21 0.27 -2.16 -1.22 0.00 0.00 177.39 171.42 8icy s PRO 63 N -3.79 4.20 0.00 3.23 0.04 -1.26 -3.27 135.00 134.15 8icy s PRO 63 Ca 0.60 0.74 0.00 0.00 0.04 0.00 0.00 61.00 62.37 8icy s PRO 63 Cb -0.18 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.13 8icy s PRO 63 CO 0.66 0.63 0.00 0.41 0.04 0.00 0.00 177.00 178.74 8icy n GLY 64 N 1.67 2.97 3.51 0.56 0.00 -1.26 -4.80 105.19 107.84 8icy n GLY 64 Ca -0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 8icy n GLY 64 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 8icy s VAL 65 N -2.67 5.21 0.00 1.61 -7.23 -1.20 -4.69 120.40 111.43 8icy s VAL 65 Ca 0.00 -0.25 0.00 0.00 -1.81 0.00 0.00 61.98 59.92 8icy s VAL 65 Cb 0.00 -3.85 0.00 0.00 0.56 0.00 0.00 36.38 33.09 8icy s VAL 65 CO 0.00 -0.17 0.00 0.61 -0.31 0.00 0.00 175.10 175.23 8icy n GLY 66 N 5.07 2.50 0.21 2.32 0.00 -1.26 -4.74 105.19 109.29 8icy n GLY 66 Ca -0.10 -2.08 -0.17 0.00 0.00 0.00 0.00 46.02 43.67 8icy n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 8icy h THR 67 N 0.05 1.29 -0.37 2.61 1.03 -1.95 -1.03 112.91 114.55 8icy h THR 67 Ca 0.00 -2.07 -0.05 0.00 -0.01 0.00 0.00 66.41 64.29 8icy h THR 67 Cb 0.00 2.10 -0.01 0.00 -1.07 0.00 0.00 68.15 69.16 8icy h THR 67 CO 0.00 0.65 0.05 0.11 -0.01 0.00 0.00 175.52 176.32 8icy h LYS 68 N 0.47 0.62 -0.07 0.00 1.57 -1.98 0.12 116.57 117.29 8icy h LYS 68 Ca -0.07 -0.17 -0.17 0.00 -1.87 0.00 0.00 60.65 58.37 8icy h LYS 68 Cb 1.47 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.70 8icy h LYS 68 CO 0.17 0.69 -0.68 0.82 -0.57 0.00 0.00 179.45 179.87 8icy h ILE 69 N 0.45 1.39 -0.83 1.86 2.04 -1.95 -2.27 117.51 118.20 8icy h ILE 69 Ca 0.11 -2.11 -0.02 0.00 1.00 0.00 0.00 64.86 63.84 8icy h ILE 69 Cb 0.38 2.09 -0.04 0.00 -0.74 0.00 0.00 36.82 38.51 8icy h ILE 69 CO 0.01 0.63 0.46 0.00 0.00 0.00 0.00 178.15 179.25 8icy h ALA 70 N 1.05 1.07 -0.91 1.87 0.00 -0.77 -1.08 119.26 120.50 8icy h ALA 70 Ca -0.02 -0.12 0.09 0.00 0.00 0.00 0.00 54.91 54.86 8icy h ALA 70 Cb 1.23 -0.33 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 8icy h ALA 70 CO 0.11 0.58 0.55 1.49 0.00 0.00 0.00 179.25 181.98 8icy h GLU 71 N 1.16 0.92 -0.07 0.00 4.81 -0.58 -0.68 114.58 120.14 8icy h GLU 71 Ca 0.29 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.38 8icy h GLU 71 Cb 0.03 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 8icy h GLU 71 CO -0.05 0.61 -0.38 0.87 -0.73 0.00 0.00 179.01 179.33 8icy h LYS 72 N 0.94 0.14 0.75 1.92 1.57 -0.63 -3.23 116.57 118.03 8icy h LYS 72 Ca 0.42 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 59.11 8icy h LYS 72 Cb 0.32 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.64 8icy h LYS 72 CO -0.22 0.50 -0.36 0.82 -0.57 0.00 0.00 179.45 179.62 8icy h ILE 73 N 0.12 0.00 -0.80 1.86 2.04 -0.40 -2.42 117.51 117.91 8icy h ILE 73 Ca 0.01 -0.07 0.10 0.00 1.00 0.00 0.00 64.86 65.90 8icy h ILE 73 Cb 0.73 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.70 8icy h ILE 73 CO 0.05 0.00 -0.39 0.47 0.00 0.00 0.00 178.15 178.28 8icy n ASP 74 N -4.89 -0.68 -0.35 1.72 8.00 -1.11 0.18 116.55 119.42 8icy n ASP 74 Ca -0.12 1.40 -0.00 0.00 0.71 0.00 0.00 54.79 56.77 8icy n ASP 74 Cb 0.40 -0.25 0.15 0.00 -0.02 0.00 0.00 41.12 41.40 8icy n ASP 74 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 8icy h GLU 75 N 0.00 1.22 -0.31 -1.24 4.81 -1.61 2.10 114.58 119.55 8icy h GLU 75 Ca 0.20 -0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.19 8icy h GLU 75 Cb 0.40 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 8icy h GLU 75 CO -0.77 0.81 -0.46 0.35 -0.73 0.00 0.00 179.01 178.21 8icy h PHE 76 N 1.25 0.98 0.45 0.92 3.04 0.25 0.20 116.94 124.04 8icy h PHE 76 Ca 0.37 -0.31 -0.02 0.00 3.98 0.00 0.00 57.97 61.98 8icy h PHE 76 Cb -0.07 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 38.25 8icy h PHE 76 CO -0.00 1.11 -0.22 -0.07 -2.02 0.00 0.00 178.31 177.11 8icy h LEU 77 N 0.64 -0.52 0.00 0.59 4.07 0.20 -3.33 115.31 116.96 8icy h LEU 77 Ca 0.04 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.93 8icy h LEU 77 Cb 1.03 0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.91 8icy h LEU 77 CO 0.10 -0.10 0.00 0.00 -1.08 0.00 0.00 178.44 177.36 8icy n ALA 78 N -2.64 0.00 -2.65 1.53 0.00 0.70 -4.11 120.51 113.34 8icy n ALA 78 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.93 8icy n ALA 78 Cb 0.29 0.17 -0.04 0.00 0.00 0.00 0.00 19.45 19.87 8icy n ALA 78 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 8icy s THR 79 N -0.80 4.79 -0.29 0.00 -4.23 0.05 -4.89 115.64 110.29 8icy s THR 79 Ca 0.00 1.68 0.00 0.00 -1.18 0.00 0.00 61.69 62.19 8icy s THR 79 Cb 0.00 -4.17 0.00 0.00 1.34 0.00 0.00 72.50 69.67 8icy s THR 79 CO 0.00 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 8icy n GLY 80 N 3.65 0.00 0.00 3.99 0.00 -1.25 -4.22 105.19 107.36 8icy n GLY 80 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 8icy n GLY 80 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 8icy n LYS 81 N 0.54 0.00 -3.65 1.61 0.00 -1.26 -5.04 118.16 110.37 8icy n LYS 81 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 58.31 58.21 8icy n LYS 81 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 34.95 8icy n LYS 81 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 8icy s LEU 82 N 0.00 -0.66 0.06 3.14 2.96 -1.26 -3.76 118.68 119.16 8icy s LEU 82 Ca 0.00 1.35 -0.32 0.00 -0.22 0.00 0.00 54.13 54.94 8icy s LEU 82 Cb 0.00 2.18 -0.19 0.00 0.50 0.00 0.00 46.19 48.69 8icy s LEU 82 CO 0.00 -0.23 1.53 -0.09 -1.32 0.00 0.00 176.35 176.24 8icy h ARG 83 N 6.34 -0.89 -0.45 1.98 2.43 -1.97 -1.66 114.38 120.16 8icy h ARG 83 Ca -0.30 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.02 8icy h ARG 83 Cb 1.20 0.20 -0.09 0.00 -0.42 0.00 0.00 29.97 30.86 8icy h ARG 83 CO 0.16 -0.57 -0.14 -0.22 -1.51 0.00 0.00 179.97 177.69 8icy h LYS 84 N -0.98 -0.03 0.00 0.20 3.64 -1.98 1.36 116.57 118.77 8icy h LYS 84 Ca -0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 8icy h LYS 84 Cb 0.72 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 8icy h LYS 84 CO 0.15 -0.02 0.00 -0.07 -2.27 0.00 0.00 179.45 177.24 8icy h LEU 85 N -0.04 0.00 0.05 5.20 4.07 -1.98 0.39 115.31 123.00 8icy h LEU 85 Ca 0.22 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.17 8icy h LEU 85 Cb 0.37 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.11 8icy h LEU 85 CO -0.48 0.00 -0.02 1.05 -1.08 0.00 0.00 178.44 177.91 8icy h GLU 86 N 0.00 -0.06 -0.29 1.13 4.11 0.25 -2.60 114.58 117.11 8icy h GLU 86 Ca 0.00 0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.47 8icy h GLU 86 Cb 0.11 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.30 8icy h GLU 86 CO 0.00 -0.04 -0.52 -0.22 0.07 0.00 0.00 179.01 178.30 8icy h LYS 87 N -0.95 -0.42 -0.55 1.06 3.64 0.60 -2.19 116.57 117.77 8icy h LYS 87 Ca -0.01 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.50 8icy h LYS 87 Cb 0.05 0.09 -0.11 0.00 -0.41 0.00 0.00 32.23 31.85 8icy h LYS 87 CO 0.01 -0.28 -0.33 0.82 -2.27 0.00 0.00 179.45 177.41 8icy h ILE 88 N -0.43 0.19 -0.98 2.00 2.04 -0.40 -0.35 117.51 119.58 8icy h ILE 88 Ca 0.05 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.17 8icy h ILE 88 Cb 0.58 0.19 -0.06 0.00 -0.74 0.00 0.00 36.82 36.79 8icy h ILE 88 CO -0.50 0.00 0.67 -0.09 0.00 0.00 0.00 178.15 178.22 8icy h ARG 89 N -0.18 0.21 0.18 2.37 1.12 -1.00 -2.62 114.38 114.46 8icy h ARG 89 Ca 0.22 -0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 59.07 8icy h ARG 89 Cb 0.54 -0.05 0.00 0.00 -0.01 0.00 0.00 29.97 30.46 8icy h ARG 89 CO -0.65 0.14 -0.09 1.96 -3.11 0.00 0.00 179.97 178.22 8icy h GLN 90 N 0.21 -0.23 -5.69 0.20 4.20 -0.50 -3.48 115.11 109.82 8icy h GLN 90 Ca 0.50 0.02 -0.74 0.00 0.06 0.00 0.00 58.65 58.49 8icy h GLN 90 Cb 1.59 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 29.39 8icy h GLN 90 CO -0.13 -0.16 1.20 -3.47 -0.67 0.00 0.00 178.83 175.61 8icy n ASP 91 N -4.65 0.75 0.22 1.46 2.03 -0.92 -4.85 116.55 110.60 8icy n ASP 91 Ca -0.03 0.69 -0.15 0.00 0.52 0.00 0.00 54.79 55.82 8icy n ASP 91 Cb 0.10 -0.85 -0.07 0.00 -0.72 0.00 0.00 41.12 39.57 8icy n ASP 91 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 8icy h ASP 92 N 8.20 -0.70 -1.30 1.67 2.03 -1.92 0.78 116.42 125.18 8icy h ASP 92 Ca -0.12 0.05 0.46 0.00 -0.73 0.00 0.00 57.03 56.69 8icy h ASP 92 Cb 1.34 0.22 -0.15 0.00 -0.83 0.00 0.00 39.33 39.92 8icy h ASP 92 CO 1.02 -0.41 0.81 0.74 -1.03 0.00 0.00 179.24 180.38 8icy h THR 93 N -0.63 0.02 0.11 1.15 2.02 -1.97 2.41 112.91 116.02 8icy h THR 93 Ca -0.03 -0.01 -0.35 0.00 0.77 0.00 0.00 66.41 66.80 8icy h THR 93 Cb 0.54 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 8icy h THR 93 CO 0.00 0.00 -1.91 -1.28 0.37 0.00 0.00 175.52 172.71 8icy h SER 94 N 0.02 0.35 -0.85 4.18 0.87 -1.72 -2.79 113.55 113.60 8icy h SER 94 Ca 0.87 -0.76 0.16 0.00 -1.23 0.00 0.00 61.79 60.83 8icy h SER 94 Cb 2.69 -0.11 -0.06 0.00 -0.44 0.00 0.00 62.40 64.47 8icy h SER 94 CO -0.53 1.68 0.56 0.28 -0.53 0.00 0.00 176.83 178.29 8icy h SER 95 N 0.06 0.51 -0.12 6.23 0.02 1.01 0.59 113.55 121.86 8icy h SER 95 Ca -0.39 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.57 8icy h SER 95 Cb 2.04 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 64.51 8icy h SER 95 CO 0.10 0.25 -0.06 0.28 -1.14 0.00 0.00 176.83 176.25 8icy h SER 96 N 0.54 0.27 0.33 3.07 0.02 0.19 -2.24 113.55 115.73 8icy h SER 96 Ca 0.43 -0.42 -0.06 0.00 -0.84 0.00 0.00 61.79 60.90 8icy h SER 96 Cb 0.87 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 8icy h SER 96 CO -0.18 0.63 -0.28 0.40 -1.14 0.00 0.00 176.83 176.26 8icy h ILE 97 N -0.09 1.11 -0.47 3.27 2.04 -0.79 -2.15 117.51 120.44 8icy h ILE 97 Ca 0.03 -0.98 -0.09 0.00 1.00 0.00 0.00 64.86 64.81 8icy h ILE 97 Cb 0.53 1.54 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 8icy h ILE 97 CO 0.02 0.27 -0.07 0.78 0.00 0.00 0.00 178.15 179.15 8icy h ASN 98 N 0.00 0.81 0.32 1.72 4.21 -0.68 -3.32 115.58 118.63 8icy h ASN 98 Ca -0.00 -0.23 -0.02 0.00 1.21 0.00 0.00 56.30 57.26 8icy h ASN 98 Cb 0.52 -0.22 0.00 0.00 -1.12 0.00 0.00 38.32 37.51 8icy h ASN 98 CO 0.04 0.92 -0.15 0.15 -1.29 0.00 0.00 177.43 177.09 8icy h PHE 99 N 0.75 -0.40 -0.98 1.19 3.04 -0.85 -3.38 116.94 116.32 8icy h PHE 99 Ca 0.13 -0.01 0.27 0.00 3.98 0.00 0.00 57.97 62.34 8icy h PHE 99 Cb 0.56 0.13 -0.05 0.00 2.56 0.00 0.00 35.95 39.14 8icy h PHE 99 CO 0.03 -0.25 0.68 -0.07 -2.02 0.00 0.00 178.31 176.68 8icy h LEU 100 N -0.84 0.16 -1.08 0.59 -0.00 -1.57 0.20 115.31 112.76 8icy h LEU 100 Ca -0.04 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.86 8icy h LEU 100 Cb 0.33 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.98 8icy h LEU 100 CO 0.07 0.05 0.00 1.07 -0.00 0.00 0.00 178.44 179.63 8icy n THR 101 N -4.36 1.00 1.35 0.22 5.66 -1.25 -2.10 114.28 114.79 8icy n THR 101 Ca 0.21 0.53 0.14 0.00 -3.05 0.00 0.00 64.05 61.89 8icy n THR 101 Cb 0.95 -1.50 0.73 0.00 -1.55 0.00 0.00 70.33 68.96 8icy n THR 101 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 8icy n ARG 102 N -2.21 0.37 -2.85 1.09 1.74 0.70 -4.61 116.66 110.88 8icy n ARG 102 Ca 0.00 0.01 -0.41 0.00 -0.77 0.00 0.00 57.85 56.68 8icy n ARG 102 Cb 0.11 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.01 8icy n ARG 102 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 8icy s VAL 103 N -2.62 4.92 0.14 1.55 1.01 -0.89 -4.97 120.40 119.53 8icy s VAL 103 Ca 0.26 1.78 -0.33 0.00 0.00 0.00 0.00 61.98 63.69 8icy s VAL 103 Cb 0.20 -4.19 -0.12 0.00 0.00 0.00 0.00 36.38 32.26 8icy s VAL 103 CO 0.46 0.15 1.71 -0.24 0.00 0.00 0.00 175.10 177.18 8icy n SER 104 N 4.23 3.62 0.00 3.32 2.88 -1.26 -1.38 113.62 125.03 8icy n SER 104 Ca 0.04 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.62 8icy n SER 104 Cb 0.50 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.47 8icy n SER 104 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 8icy n GLY 105 N 3.87 1.63 3.59 0.46 0.00 -1.26 -3.87 105.19 109.61 8icy n GLY 105 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 8icy n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 8icy s ILE 106 N -1.92 4.93 0.56 -0.61 1.01 -0.48 -4.87 121.20 119.82 8icy s ILE 106 Ca 0.00 0.76 0.07 0.00 0.00 0.00 0.00 60.65 61.49 8icy s ILE 106 Cb 0.00 -4.02 0.10 0.00 0.01 0.00 0.00 42.46 38.55 8icy s ILE 106 CO 0.00 -0.19 0.77 0.61 0.00 0.00 0.00 174.94 176.13 8icy n GLY 107 N 4.51 1.75 0.18 6.18 0.00 -1.26 -4.47 105.19 112.07 8icy n GLY 107 Ca -0.01 -2.19 -0.06 0.00 0.00 0.00 0.00 46.02 43.76 8icy n GLY 107 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 8icy h PRO 108 N 0.00 0.39 -0.41 1.61 0.11 -1.94 0.21 132.00 131.97 8icy h PRO 108 Ca -0.26 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.89 8icy h PRO 108 Cb 1.14 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.11 8icy h PRO 108 CO 0.35 0.25 0.09 1.03 -0.21 0.00 0.00 178.00 179.51 8icy h SER 109 N 0.40 0.03 -0.17 -2.05 0.87 -1.94 0.48 113.55 111.16 8icy h SER 109 Ca 0.19 0.07 -0.13 0.00 -1.23 0.00 0.00 61.79 60.68 8icy h SER 109 Cb 0.11 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 8icy h SER 109 CO -0.15 0.05 -0.35 0.00 -0.53 0.00 0.00 176.83 175.86 8icy h ALA 110 N 1.30 0.82 -0.77 6.23 0.00 -1.85 -2.57 119.26 122.42 8icy h ALA 110 Ca 0.20 -0.42 0.16 0.00 0.00 0.00 0.00 54.91 54.84 8icy h ALA 110 Cb 0.23 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 17.80 8icy h ALA 110 CO -0.25 0.64 0.29 0.00 0.00 0.00 0.00 179.25 179.93 8icy h ALA 111 N 1.04 1.10 0.62 0.00 0.00 0.21 0.15 119.26 122.38 8icy h ALA 111 Ca 0.06 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 8icy h ALA 111 Cb 0.87 0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.80 8icy h ALA 111 CO 0.08 -0.26 -0.30 0.00 0.00 0.00 0.00 179.25 178.77 8icy h ARG 112 N 0.39 -0.81 -0.57 0.00 3.08 0.05 -2.72 114.38 113.81 8icy h ARG 112 Ca 0.44 0.05 0.11 0.00 0.07 0.00 0.00 59.98 60.66 8icy h ARG 112 Cb 0.72 0.18 -0.10 0.00 0.08 0.00 0.00 29.97 30.85 8icy h ARG 112 CO -0.45 -0.49 -0.02 -0.22 -1.07 0.00 0.00 179.97 177.72 8icy h LYS 113 N -1.03 0.10 -0.45 0.04 3.64 -1.01 -0.15 116.57 117.70 8icy h LYS 113 Ca -0.09 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.38 8icy h LYS 113 Cb 0.69 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.41 8icy h LYS 113 CO 0.14 0.06 -0.05 0.74 -2.27 0.00 0.00 179.45 178.08 8icy h PHE 114 N 0.10 -0.11 -0.94 1.91 0.04 -0.70 0.08 116.94 117.31 8icy h PHE 114 Ca 0.29 0.04 0.00 0.00 2.80 0.00 0.00 57.97 61.10 8icy h PHE 114 Cb 0.46 0.12 -0.05 0.00 2.20 0.00 0.00 35.95 38.68 8icy h PHE 114 CO -0.36 -0.14 0.60 0.28 -0.60 0.00 0.00 178.31 178.09 8icy h VAL 115 N 0.06 1.25 -0.32 -0.55 2.07 -0.96 1.33 116.25 119.13 8icy h VAL 115 Ca 0.22 -0.49 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 8icy h VAL 115 Cb 0.33 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 8icy h VAL 115 CO -0.41 0.25 0.19 0.44 0.02 0.00 0.00 177.57 178.07 8icy h ASP 116 N 1.29 0.39 0.29 0.57 3.32 0.47 1.25 116.42 124.00 8icy h ASP 116 Ca 0.34 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.34 8icy h ASP 116 Cb -0.11 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.34 8icy h ASP 116 CO -0.07 0.33 0.00 -0.62 -1.72 0.00 0.00 179.24 177.16 8icy n GLU 117 N -4.82 0.07 -0.79 3.56 1.02 -0.14 -4.78 120.64 114.76 8icy n GLU 117 Ca -0.01 0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 8icy n GLU 117 Cb 0.05 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 8icy n GLU 117 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 8icy n GLY 118 N -0.40 1.19 3.25 0.62 0.00 0.43 -5.02 105.19 105.26 8icy n GLY 118 Ca 0.04 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 8icy n GLY 118 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 8icy s ILE 119 N -2.19 5.37 -0.18 -0.61 1.01 0.45 -4.81 121.20 120.24 8icy s ILE 119 Ca 0.00 -3.50 -0.18 0.00 0.00 0.00 0.00 60.65 56.97 8icy s ILE 119 Cb 0.00 -4.26 -0.15 0.00 0.01 0.00 0.00 42.46 38.06 8icy s ILE 119 CO 0.00 -1.13 0.17 0.11 0.00 0.00 0.00 174.94 174.09 8icy h LYS 120 N 6.53 0.00 -7.20 2.79 1.57 -1.86 -3.30 116.57 115.11 8icy h LYS 120 Ca 0.16 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.49 8icy h LYS 120 Cb 0.87 0.00 0.07 0.00 0.08 0.00 0.00 32.23 33.25 8icy h LYS 120 CO 0.93 0.69 0.17 0.95 -0.57 0.00 0.00 179.45 181.62 8icy s THR 121 N -2.26 2.36 0.16 -0.16 -4.23 -1.26 -4.75 115.64 105.50 8icy s THR 121 Ca -0.22 -0.36 -0.13 0.00 -1.18 0.00 0.00 61.69 59.79 8icy s THR 121 Cb 0.03 -3.00 0.05 0.00 1.34 0.00 0.00 72.50 70.93 8icy s THR 121 CO 0.47 0.00 1.74 0.25 -0.54 0.00 0.00 174.62 176.54 8icy h LEU 122 N -0.45 0.71 -1.26 4.79 6.46 -1.98 -0.08 115.31 123.50 8icy h LEU 122 Ca -0.44 -0.14 0.05 0.00 -0.12 0.00 0.00 57.88 57.24 8icy h LEU 122 Cb 1.31 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 41.01 8icy h LEU 122 CO 0.58 0.65 0.53 -0.33 -0.62 0.00 0.00 178.44 179.25 8icy h GLU 123 N 0.72 0.90 0.10 1.25 5.08 -1.99 0.97 114.58 121.60 8icy h GLU 123 Ca 0.18 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.50 8icy h GLU 123 Cb 0.14 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 8icy h GLU 123 CO -0.02 0.59 -0.22 -0.44 -1.00 0.00 0.00 179.01 177.93 8icy h ASP 124 N 0.92 -0.61 -0.71 1.42 5.19 -1.51 -0.00 116.42 121.11 8icy h ASP 124 Ca 0.34 0.07 0.16 0.00 -0.62 0.00 0.00 57.03 56.98 8icy h ASP 124 Cb 0.16 0.23 -0.12 0.00 0.18 0.00 0.00 39.33 39.79 8icy h ASP 124 CO -0.11 -0.30 0.07 -0.07 -3.12 0.00 0.00 179.24 175.71 8icy h LEU 125 N -0.40 -0.19 0.33 1.55 3.38 0.46 -1.72 115.31 118.71 8icy h LEU 125 Ca 0.03 0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 8icy h LEU 125 Cb 0.43 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.45 8icy h LEU 125 CO -0.13 -0.11 -0.16 0.03 0.09 0.00 0.00 178.44 178.16 8icy h ARG 126 N 0.16 -0.42 0.00 1.13 3.08 0.98 -2.41 114.38 116.90 8icy h ARG 126 Ca 0.39 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.47 8icy h ARG 126 Cb 0.68 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.83 8icy h ARG 126 CO -0.57 -0.24 0.25 1.63 -1.07 0.00 0.00 179.97 179.96 8icy n LYS 127 N -5.25 0.06 -2.56 0.04 4.76 -0.57 -0.18 118.16 114.46 8icy n LYS 127 Ca -0.10 0.47 -0.18 0.00 -2.87 0.00 0.00 58.31 55.63 8icy n LYS 127 Cb 0.21 -1.94 0.02 0.00 -1.84 0.00 0.00 35.03 31.48 8icy n LYS 127 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 8icy n ASN 128 N -1.78 3.15 0.29 4.39 3.02 -0.91 -4.73 115.26 118.69 8icy n ASN 128 Ca -0.01 -3.21 0.19 0.00 -0.03 0.00 0.00 54.58 51.52 8icy n ASN 128 Cb 0.26 -0.49 0.82 0.00 -0.61 0.00 0.00 39.78 39.77 8icy n ASN 128 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 8icy h GLU 129 N 2.75 0.00 -0.94 3.52 4.81 -0.47 -2.03 114.58 122.23 8icy h GLU 129 Ca 0.11 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 8icy h GLU 129 Cb 1.07 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.40 8icy h GLU 129 CO 0.67 0.00 0.62 0.38 -0.73 0.00 0.00 179.01 179.95 8icy h ASP 130 N 0.00 1.07 0.90 1.04 2.03 -1.85 -2.85 116.42 116.77 8icy h ASP 130 Ca -0.00 -0.03 0.00 0.00 -0.73 0.00 0.00 57.03 56.27 8icy h ASP 130 Cb 0.38 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 38.62 8icy h ASP 130 CO 0.00 0.77 0.00 0.11 -1.03 0.00 0.00 179.24 179.09 8icy h LYS 131 N 1.26 0.00 -6.74 4.15 1.57 -1.75 -3.45 116.57 111.61 8icy h LYS 131 Ca 0.35 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.63 8icy h LYS 131 Cb -0.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 8icy h LYS 131 CO -0.08 0.00 0.07 -0.51 -0.57 0.00 0.00 179.45 178.36 8icy s LEU 132 N -5.87 3.95 0.28 2.94 1.43 -1.08 -5.11 118.68 115.23 8icy s LEU 132 Ca 0.01 1.12 0.07 0.00 -1.03 0.00 0.00 54.13 54.31 8icy s LEU 132 Cb 0.09 -3.96 -0.03 0.00 0.03 0.00 0.00 46.19 42.32 8icy s LEU 132 CO 0.51 -0.29 0.21 0.54 0.23 0.00 0.00 176.35 177.54 8icy s ASN 133 N -2.82 5.33 0.13 2.29 4.22 -1.26 -4.84 114.94 118.00 8icy s ASN 133 Ca 0.51 -0.38 -0.05 0.00 -2.14 0.00 0.00 52.86 50.80 8icy s ASN 133 Cb -0.10 -1.20 0.20 0.00 1.28 0.00 0.00 41.25 41.43 8icy s ASN 133 CO 0.26 -0.14 0.79 1.57 -2.04 0.00 0.00 177.10 177.54 8icy n HIS 134 N -1.21 0.13 0.36 1.54 -0.00 -1.26 -0.84 115.22 113.95 8icy n HIS 134 Ca -0.06 0.62 -0.19 0.00 -0.00 0.00 0.00 57.72 58.09 8icy n HIS 134 Cb 0.59 -0.76 -0.10 0.00 -0.00 0.00 0.00 29.99 29.71 8icy n HIS 134 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 8icy h HIS 135 N 0.00 -1.34 0.00 1.57 6.17 -1.90 -0.12 115.15 119.53 8icy h HIS 135 Ca 0.22 -0.00 -0.01 0.00 0.71 0.00 0.00 60.37 61.30 8icy h HIS 135 Cb 0.35 0.50 -0.00 0.00 2.52 0.00 0.00 27.41 30.78 8icy h HIS 135 CO -0.41 -0.70 -0.04 1.96 0.71 0.00 0.00 177.93 179.46 8icy h GLN 136 N -1.10 0.00 0.00 5.26 4.20 -1.34 1.11 115.11 123.24 8icy h GLN 136 Ca -0.08 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 8icy h GLN 136 Cb 0.91 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.70 8icy h GLN 136 CO 0.02 0.04 -0.07 0.00 -0.67 0.00 0.00 178.83 178.15 8icy h ARG 137 N 0.00 0.05 0.00 1.46 3.08 -0.60 -0.46 114.38 117.91 8icy h ARG 137 Ca -0.00 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 8icy h ARG 137 Cb 0.16 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 8icy h ARG 137 CO 0.00 0.83 -0.31 0.82 -1.07 0.00 0.00 179.97 180.25 8icy h ILE 138 N -0.72 1.11 0.22 2.04 2.04 -0.44 -1.17 117.51 120.59 8icy h ILE 138 Ca -0.01 -1.10 0.01 0.00 1.00 0.00 0.00 64.86 64.76 8icy h ILE 138 Cb 0.86 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.53 8icy h ILE 138 CO 0.01 0.30 -0.27 1.23 0.00 0.00 0.00 178.15 179.43 8icy h GLY 139 N 1.09 -0.57 1.15 5.37 0.00 0.15 -2.43 103.07 107.83 8icy h GLY 139 Ca -0.00 0.31 -0.16 0.00 0.00 0.00 0.00 47.33 47.48 8icy h GLY 139 CO 0.04 -0.24 -0.39 -2.00 0.00 0.00 0.00 176.54 173.95 8icy h LEU 140 N -0.54 0.99 -2.01 3.11 5.85 -0.87 -2.88 115.31 118.97 8icy h LEU 140 Ca 0.00 -0.46 0.13 0.00 0.84 0.00 0.00 57.88 58.40 8icy h LEU 140 Cb 0.52 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 8icy h LEU 140 CO -0.09 1.25 0.42 0.50 -0.34 0.00 0.00 178.44 180.19 8icy h LYS 141 N 0.75 0.00 -0.22 1.25 3.64 -1.06 -2.45 116.57 118.48 8icy h LYS 141 Ca 0.06 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.24 8icy h LYS 141 Cb 0.99 0.00 -0.23 0.00 -0.41 0.00 0.00 32.23 32.57 8icy h LYS 141 CO 0.10 0.00 -0.77 0.66 -2.27 0.00 0.00 179.45 177.17 8icy n TYR 142 N -3.92 0.79 -0.20 1.91 4.01 -0.93 -4.85 117.16 113.96 8icy n TYR 142 Ca 0.08 -1.52 0.00 0.00 -0.16 0.00 0.00 57.90 56.31 8icy n TYR 142 Cb 0.62 -0.25 0.11 0.00 -0.31 0.00 0.00 39.34 39.51 8icy n TYR 142 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 8icy h PHE 143 N 1.47 0.25 0.00 -0.72 3.04 -1.22 0.10 116.94 119.86 8icy h PHE 143 Ca 0.02 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.00 8icy h PHE 143 Cb 1.36 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 39.85 8icy h PHE 143 CO 0.62 0.01 0.00 0.41 -2.02 0.00 0.00 178.31 177.32 8icy n GLY 144 N -1.31 -2.28 0.34 2.40 0.00 -1.26 -2.61 105.19 100.47 8icy n GLY 144 Ca 0.09 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.28 8icy n GLY 144 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 8icy h ASP 145 N 0.00 -0.34 0.48 1.61 5.19 -1.81 2.22 116.42 123.76 8icy h ASP 145 Ca 0.00 0.27 0.00 0.00 -0.62 0.00 0.00 57.03 56.68 8icy h ASP 145 Cb 0.00 0.45 0.00 0.00 0.18 0.00 0.00 39.33 39.96 8icy h ASP 145 CO 0.00 -0.36 0.00 0.49 -3.12 0.00 0.00 179.24 176.25 8icy n PHE 146 N -5.44 0.61 1.00 4.55 3.72 0.35 -2.12 117.46 120.13 8icy n PHE 146 Ca 0.25 0.26 0.11 0.00 -0.05 0.00 0.00 57.45 58.02 8icy n PHE 146 Cb 0.83 -0.92 0.00 0.00 -0.94 0.00 0.00 39.48 38.46 8icy n PHE 146 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 8icy n GLU 147 N -2.08 0.06 -1.87 -1.08 1.02 0.75 -4.95 120.64 112.50 8icy n GLU 147 Ca 0.01 -0.05 -0.30 0.00 -0.02 0.00 0.00 57.16 56.81 8icy n GLU 147 Cb 0.16 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.13 8icy n GLU 147 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 8icy s LYS 148 N -2.97 2.72 0.17 3.49 1.02 -0.90 -5.09 119.74 118.19 8icy s LYS 148 Ca 0.10 0.43 -0.02 0.00 0.02 0.00 0.00 55.97 56.50 8icy s LYS 148 Cb 0.17 -2.01 -0.05 0.00 -0.52 0.00 0.00 37.83 35.42 8icy s LYS 148 CO 0.80 -1.13 0.37 1.03 -0.92 0.00 0.00 175.35 175.51 8icy s ARG 149 N -5.37 3.55 -0.53 1.68 1.81 -1.26 -4.86 118.95 113.97 8icy s ARG 149 Ca 0.59 -0.24 -0.19 0.00 -1.72 0.00 0.00 55.73 54.17 8icy s ARG 149 Cb -0.11 -2.85 0.07 0.00 -0.45 0.00 0.00 34.95 31.60 8icy s ARG 149 CO 0.52 0.44 0.65 0.42 -0.68 0.00 0.00 175.30 176.64 8icy s ILE 150 N -1.76 4.85 0.27 1.52 1.01 1.38 -4.91 121.20 123.56 8icy s ILE 150 Ca 0.39 -0.59 -0.30 0.00 0.00 0.00 0.00 60.65 60.15 8icy s ILE 150 Cb -0.12 -4.35 -0.13 0.00 0.01 0.00 0.00 42.46 37.88 8icy s ILE 150 CO 0.27 -0.88 1.40 -0.81 0.00 0.00 0.00 174.94 174.91 8icy n PRO 151 N 6.24 2.12 -0.30 2.79 -0.04 -1.26 -0.55 135.00 143.99 8icy n PRO 151 Ca -0.07 0.75 0.06 0.00 -0.04 0.00 0.00 63.50 64.20 8icy n PRO 151 Cb 0.45 -2.40 0.27 0.00 -0.04 0.00 0.00 33.50 31.77 8icy n PRO 151 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 8icy h ARG 152 N 3.87 0.93 -1.10 0.54 2.43 -1.61 0.56 114.38 120.00 8icy h ARG 152 Ca -0.45 -0.06 0.32 0.00 -0.81 0.00 0.00 59.98 58.98 8icy h ARG 152 Cb 1.27 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 30.57 8icy h ARG 152 CO 0.73 0.62 0.79 0.93 -1.51 0.00 0.00 179.97 181.52 8icy h GLU 153 N 0.96 0.01 0.03 0.20 4.39 -1.89 1.82 114.58 120.10 8icy h GLU 153 Ca 0.42 -0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.80 8icy h GLU 153 Cb 0.34 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.94 8icy h GLU 153 CO -0.18 0.01 -1.82 0.39 -1.16 0.00 0.00 179.01 176.25 8icy n GLU 154 N -4.22 0.66 -0.25 2.33 1.02 -0.01 -3.56 120.64 116.61 8icy n GLU 154 Ca 0.23 0.27 0.02 0.00 -0.02 0.00 0.00 57.16 57.66 8icy n GLU 154 Cb 1.15 -1.76 0.15 0.00 -0.02 0.00 0.00 31.44 30.97 8icy n GLU 154 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 8icy h MET 155 N 0.02 0.59 -0.31 3.49 2.86 0.46 -1.44 114.93 120.59 8icy h MET 155 Ca -0.34 -0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.15 8icy h MET 155 Cb 2.03 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 33.55 8icy h MET 155 CO 0.08 0.39 -0.31 -0.07 1.06 0.00 0.00 176.91 178.06 8icy h LEU 156 N 0.61 0.68 -0.52 1.22 3.38 -0.92 -0.55 115.31 119.21 8icy h LEU 156 Ca 0.37 -0.27 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 8icy h LEU 156 Cb 0.40 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 8icy h LEU 156 CO -0.28 0.95 -0.02 0.06 0.09 0.00 0.00 178.44 179.23 8icy h GLN 157 N 0.56 0.94 1.00 1.13 3.07 -1.35 -0.51 115.11 119.96 8icy h GLN 157 Ca 0.07 -0.31 -0.05 0.00 0.09 0.00 0.00 58.65 58.45 8icy h GLN 157 Cb 0.81 -0.08 0.01 0.00 0.08 0.00 0.00 27.48 28.30 8icy h GLN 157 CO 0.07 0.97 -0.48 0.52 0.09 0.00 0.00 178.83 179.99 8icy h MET 158 N 0.81 -1.30 -0.79 0.06 2.86 -1.27 -2.47 114.93 112.82 8icy h MET 158 Ca 0.14 0.09 0.19 0.00 -2.06 0.00 0.00 59.70 58.06 8icy h MET 158 Cb 0.56 0.30 -0.12 0.00 0.06 0.00 0.00 31.60 32.39 8icy h MET 158 CO 0.03 -0.87 0.20 0.37 1.06 0.00 0.00 176.91 177.71 8icy h GLN 159 N -1.35 0.25 -0.34 1.72 4.15 -1.11 0.47 115.11 118.91 8icy h GLN 159 Ca -0.14 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.33 8icy h GLN 159 Cb 1.03 -0.06 -0.08 0.00 0.21 0.00 0.00 27.48 28.58 8icy h GLN 159 CO 0.23 0.17 -0.41 0.22 -1.93 0.00 0.00 178.83 177.10 8icy h ASP 160 N 0.26 -1.34 -0.30 -0.69 3.58 -0.74 -2.16 116.42 115.02 8icy h ASP 160 Ca 0.47 0.20 -0.04 0.00 0.42 0.00 0.00 57.03 58.08 8icy h ASP 160 Cb 0.85 0.58 -0.01 0.00 1.72 0.00 0.00 39.33 42.47 8icy h ASP 160 CO -0.56 -0.37 0.05 0.40 -2.88 0.00 0.00 179.24 175.87 8icy h ILE 161 N -0.36 1.23 -0.39 2.25 2.04 -0.66 -2.99 117.51 118.64 8icy h ILE 161 Ca 0.13 -0.80 0.06 0.00 1.00 0.00 0.00 64.86 65.25 8icy h ILE 161 Cb 0.59 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 8icy h ILE 161 CO -0.52 0.26 0.08 0.58 0.00 0.00 0.00 178.15 178.55 8icy h VAL 162 N 0.32 0.80 -0.58 1.67 2.07 -0.68 -1.11 116.25 118.74 8icy h VAL 162 Ca 0.09 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 8icy h VAL 162 Cb 0.34 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 8icy h VAL 162 CO 0.01 0.04 0.36 -0.07 0.02 0.00 0.00 177.57 177.92 8icy h LEU 163 N 0.21 0.69 -0.36 2.57 3.38 -1.43 -2.66 115.31 117.71 8icy h LEU 163 Ca 0.19 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 8icy h LEU 163 Cb 0.22 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 8icy h LEU 163 CO -0.25 0.52 0.03 0.78 0.09 0.00 0.00 178.44 179.61 8icy h ASN 164 N 0.80 0.59 0.17 -0.43 2.35 -1.08 -1.79 115.58 116.18 8icy h ASN 164 Ca 0.21 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 8icy h ASN 164 Cb -0.05 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.17 8icy h ASN 164 CO -0.04 0.73 -0.08 -0.33 -1.65 0.00 0.00 177.43 176.05 8icy h GLU 165 N 0.43 -0.22 -0.75 0.81 4.39 -1.21 0.37 114.58 118.40 8icy h GLU 165 Ca 0.10 0.02 0.25 0.00 0.34 0.00 0.00 59.36 60.07 8icy h GLU 165 Cb 0.41 0.05 -0.14 0.00 -0.10 0.00 0.00 28.75 28.97 8icy h GLU 165 CO 0.01 0.19 0.17 0.28 -1.16 0.00 0.00 179.01 178.51 8icy n VAL 166 N -4.97 -0.32 -0.02 3.13 0.31 -1.01 0.29 118.33 115.74 8icy n VAL 166 Ca -0.08 1.60 -0.15 0.00 -0.01 0.00 0.00 64.34 65.70 8icy n VAL 166 Cb 0.26 -2.44 -0.11 0.00 -0.91 0.00 0.00 33.84 30.65 8icy n VAL 166 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 8icy h LYS 167 N 0.00 0.23 -0.45 5.55 3.64 -1.23 -2.96 116.57 121.35 8icy h LYS 167 Ca 0.53 -0.22 0.04 0.00 -1.27 0.00 0.00 60.65 59.73 8icy h LYS 167 Cb 1.24 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 33.09 8icy h LYS 167 CO -0.66 0.92 0.30 1.57 -2.27 0.00 0.00 179.45 179.31 8icy h LYS 168 N -0.37 0.42 0.60 1.90 2.10 0.67 -2.79 116.57 119.10 8icy h LYS 168 Ca -0.03 -0.03 -0.03 0.00 -2.00 0.00 0.00 60.65 58.56 8icy h LYS 168 Cb 1.00 -0.10 0.01 0.00 -0.90 0.00 0.00 32.23 32.24 8icy h LYS 168 CO 0.06 0.28 -0.29 -0.24 -2.00 0.00 0.00 179.45 177.26 8icy h VAL 169 N 0.43 0.00 -3.41 0.07 3.04 0.58 -3.44 116.25 113.52 8icy h VAL 169 Ca 0.19 -0.07 -0.18 0.00 -1.01 0.00 0.00 66.70 65.63 8icy h VAL 169 Cb 0.20 0.00 -0.26 0.00 -2.01 0.00 0.00 31.29 29.22 8icy h VAL 169 CO -0.05 0.00 -0.54 -0.62 -1.01 0.00 0.00 177.57 175.35 8icy s ASP 170 N -3.45 -0.12 0.14 3.17 -1.08 -1.05 -5.03 116.67 109.25 8icy s ASP 170 Ca -0.12 0.21 0.13 0.00 -0.52 0.00 0.00 52.55 52.25 8icy s ASP 170 Cb 0.01 0.28 -0.10 0.00 -1.46 0.00 0.00 42.92 41.66 8icy s ASP 170 CO 0.35 -0.10 1.14 -1.28 0.52 0.00 0.00 175.17 175.81 8icy h SER 171 N 5.66 0.00 0.00 -0.34 0.87 -1.82 -3.32 113.55 114.60 8icy h SER 171 Ca -0.26 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 8icy h SER 171 Cb 1.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 8icy h SER 171 CO 0.41 0.72 0.01 1.21 -0.53 0.00 0.00 176.83 178.66 8icy n GLU 172 N -3.15 0.09 -2.45 2.24 4.07 -1.26 -4.76 120.64 115.41 8icy n GLU 172 Ca -0.04 0.59 -0.38 0.00 -0.06 0.00 0.00 57.16 57.27 8icy n GLU 172 Cb 0.86 -1.80 -0.04 0.00 -0.06 0.00 0.00 31.44 30.40 8icy n GLU 172 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 8icy s TYR 173 N -3.34 3.30 -0.10 4.31 2.02 -1.25 -4.30 117.35 117.99 8icy s TYR 173 Ca -0.02 1.63 0.04 0.00 -0.37 0.00 0.00 57.07 58.36 8icy s TYR 173 Cb 0.04 -3.24 -0.00 0.00 -0.40 0.00 0.00 41.96 38.35 8icy s TYR 173 CO 0.12 -0.80 -0.22 0.42 -1.57 0.00 0.00 175.55 173.50 8icy s ILE 174 N -1.45 2.22 0.04 2.71 -1.09 -1.19 -4.92 121.20 117.52 8icy s ILE 174 Ca 0.54 -0.97 0.05 0.00 -2.23 0.00 0.00 60.65 58.04 8icy s ILE 174 Cb -0.27 -1.86 -0.02 0.00 -1.58 0.00 0.00 42.46 38.73 8icy s ILE 174 CO 0.34 0.56 -0.14 0.00 -1.23 0.00 0.00 174.94 174.47 8icy s ALA 175 N 0.26 1.16 -0.10 9.38 0.00 -1.26 -2.42 121.76 128.78 8icy s ALA 175 Ca -0.15 -0.85 -0.04 0.00 0.00 0.00 0.00 51.96 50.91 8icy s ALA 175 Cb -0.17 -0.17 0.05 0.00 0.00 0.00 0.00 23.12 22.83 8icy s ALA 175 CO 0.08 0.21 0.22 0.99 0.00 0.00 0.00 175.76 177.25 8icy s THR 176 N -0.91 -0.20 -0.39 0.00 2.01 -0.25 -4.94 115.64 110.96 8icy s THR 176 Ca 0.01 0.24 -0.28 0.00 0.31 0.00 0.00 61.69 61.97 8icy s THR 176 Cb -0.08 -0.36 0.02 0.00 0.01 0.00 0.00 72.50 72.09 8icy s THR 176 CO 0.01 0.10 1.03 -0.69 -0.69 0.00 0.00 174.62 174.38 8icy s VAL 177 N 1.81 4.44 0.00 3.82 1.01 -1.26 0.44 120.40 130.66 8icy s VAL 177 Ca -0.04 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.27 8icy s VAL 177 Cb -0.11 -4.45 0.00 0.00 0.00 0.00 0.00 36.38 31.82 8icy s VAL 177 CO -0.08 -0.69 0.00 0.00 0.00 0.00 0.00 175.10 174.34 8icy n GLY 179 N 5.00 -0.70 0.39 0.00 0.00 -0.58 -3.97 105.19 105.32 8icy n GLY 179 Ca 0.00 -1.13 0.17 0.00 0.00 0.00 0.00 46.02 45.05 8icy n GLY 179 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 8icy h SER 180 N 0.00 0.37 -0.28 1.61 4.64 -1.86 -0.85 113.55 117.18 8icy h SER 180 Ca 0.00 0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 8icy h SER 180 Cb 0.00 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 8icy h SER 180 CO 0.00 0.18 0.09 0.15 -0.87 0.00 0.00 176.83 176.38 8icy h PHE 181 N 0.39 0.52 -0.06 4.77 3.57 -1.82 -1.02 116.94 123.28 8icy h PHE 181 Ca 0.39 -0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.71 8icy h PHE 181 Cb 0.94 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.51 8icy h PHE 181 CO -0.00 0.46 -0.61 -0.09 -2.23 0.00 0.00 178.31 175.84 8icy h ARG 182 N 0.51 0.22 -1.30 1.11 2.43 -1.28 -3.21 114.38 112.86 8icy h ARG 182 Ca 0.12 -0.16 -0.41 0.00 -0.81 0.00 0.00 59.98 58.73 8icy h ARG 182 Cb 0.19 0.02 -0.19 0.00 -0.42 0.00 0.00 29.97 29.58 8icy h ARG 182 CO -0.00 0.76 0.53 0.54 -1.51 0.00 0.00 179.97 180.28 8icy n ARG 183 N -3.87 2.01 0.00 0.20 1.74 -0.84 -4.20 116.66 111.70 8icy n ARG 183 Ca -0.02 -2.04 0.00 0.00 -0.77 0.00 0.00 57.85 55.02 8icy n ARG 183 Cb 0.62 -1.80 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 8icy n ARG 183 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 8icy n GLY 184 N -0.12 1.21 0.00 -0.13 0.00 -1.19 -4.51 105.19 100.45 8icy n GLY 184 Ca 0.39 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.40 8icy n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 8icy n ALA 185 N 0.00 0.00 0.26 4.61 0.00 -0.45 -4.76 120.51 120.18 8icy n ALA 185 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 8icy n ALA 185 Cb 0.00 0.00 0.67 0.00 0.00 0.00 0.00 19.45 20.12 8icy n ALA 185 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 8icy h GLU 186 N 0.00 0.00 -3.28 0.00 4.39 -1.93 -3.41 114.58 110.35 8icy h GLU 186 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 8icy h GLU 186 Cb 0.00 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 28.53 8icy h GLU 186 CO 0.00 0.00 0.02 -1.54 -1.16 0.00 0.00 179.01 176.33 8icy s SER 187 N -4.35 -0.32 0.04 1.42 1.04 -1.26 -1.68 113.70 108.60 8icy s SER 187 Ca -0.03 -0.30 -0.01 0.00 0.48 0.00 0.00 55.95 56.09 8icy s SER 187 Cb 0.09 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.71 8icy s SER 187 CO 0.30 -0.95 -0.03 -0.44 0.98 0.00 0.00 173.24 173.10 8icy s SER 188 N -2.82 0.45 -0.22 7.02 0.01 0.29 -4.75 113.70 113.68 8icy s SER 188 Ca 0.05 -0.86 -0.20 0.00 1.31 0.00 0.00 55.95 56.25 8icy s SER 188 Cb 0.00 0.17 -0.18 0.00 0.21 0.00 0.00 66.02 66.22 8icy s SER 188 CO -0.09 -0.51 0.10 0.61 0.41 0.00 0.00 173.24 173.75 8icy n GLY 189 N 0.52 -0.76 3.22 3.44 0.00 -1.26 0.41 105.19 110.76 8icy n GLY 189 Ca -0.17 0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.69 8icy n GLY 189 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 8icy s ASP 190 N -6.99 2.15 -0.04 1.61 -4.77 -1.26 -4.52 116.67 102.84 8icy s ASP 190 Ca -0.31 -0.55 -0.14 0.00 -3.30 0.00 0.00 52.55 48.25 8icy s ASP 190 Cb 0.08 -0.14 -0.05 0.00 -1.09 0.00 0.00 42.92 41.72 8icy s ASP 190 CO 0.57 0.07 0.37 0.00 0.70 0.00 0.00 175.17 176.89 8icy s MET 191 N -1.42 3.95 -0.96 2.11 0.23 0.07 -5.00 119.30 118.28 8icy s MET 191 Ca 0.04 0.33 -0.03 0.00 -1.03 0.00 0.00 55.69 54.99 8icy s MET 191 Cb -0.09 -3.26 0.24 0.00 -1.53 0.00 0.00 34.83 30.19 8icy s MET 191 CO 0.02 0.60 0.91 -0.25 -2.03 0.00 0.00 175.02 174.27 8icy n ASP 192 N 2.21 4.64 -4.56 -1.18 8.00 -1.26 -1.20 116.55 123.21 8icy n ASP 192 Ca -0.14 -3.13 -0.40 0.00 0.71 0.00 0.00 54.79 51.83 8icy n ASP 192 Cb 0.52 -1.14 -0.03 0.00 -0.02 0.00 0.00 41.12 40.46 8icy n ASP 192 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 8icy s VAL 193 N -1.46 3.62 -0.05 2.53 1.01 0.62 -1.19 120.40 125.48 8icy s VAL 193 Ca 0.29 0.42 -0.30 0.00 0.00 0.00 0.00 61.98 62.40 8icy s VAL 193 Cb -0.07 -4.44 -0.03 0.00 0.00 0.00 0.00 36.38 31.84 8icy s VAL 193 CO -0.10 -1.33 1.15 -0.76 0.00 0.00 0.00 175.10 174.06 8icy s LEU 194 N 6.92 4.28 -0.00 3.92 1.02 0.17 -2.93 118.68 132.05 8icy s LEU 194 Ca 0.51 1.77 0.04 0.00 0.02 0.00 0.00 54.13 56.47 8icy s LEU 194 Cb -0.11 -3.56 -0.01 0.00 0.02 0.00 0.00 46.19 42.53 8icy s LEU 194 CO 0.20 -0.54 -0.13 -0.22 0.02 0.00 0.00 176.35 175.69 8icy s LEU 195 N 2.04 2.04 0.00 1.79 2.96 -0.47 -1.09 118.68 125.95 8icy s LEU 195 Ca 0.54 -0.26 0.04 0.00 -0.22 0.00 0.00 54.13 54.23 8icy s LEU 195 Cb -0.24 -0.66 -0.01 0.00 0.50 0.00 0.00 46.19 45.79 8icy s LEU 195 CO 0.22 0.14 0.15 1.07 -1.32 0.00 0.00 176.35 176.61 8icy n THR 196 N 2.67 0.00 -3.57 3.68 5.66 -1.02 0.92 114.28 122.62 8icy n THR 196 Ca -0.14 -1.20 -0.09 0.00 -3.05 0.00 0.00 64.05 59.57 8icy n THR 196 Cb 0.55 0.60 -0.04 0.00 -1.55 0.00 0.00 70.33 69.90 8icy n THR 196 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 175.07 169.74 8icy s HIS 197 N -2.76 -0.33 0.11 1.09 2.46 -1.22 -3.19 115.29 111.46 8icy s HIS 197 Ca 0.20 0.49 -0.30 0.00 0.47 0.00 0.00 55.06 55.92 8icy s HIS 197 Cb 0.01 0.47 -0.09 0.00 -0.13 0.00 0.00 32.58 32.83 8icy s HIS 197 CO 0.14 -0.34 1.61 -1.35 -2.47 0.00 0.00 174.74 172.33 8icy h PRO 198 N 2.41 -0.59 -1.26 2.88 0.11 -1.94 -2.23 132.00 131.38 8icy h PRO 198 Ca -0.17 0.04 0.37 0.00 0.11 0.00 0.00 66.00 66.34 8icy h PRO 198 Cb 1.18 0.13 -0.08 0.00 0.11 0.00 0.00 31.00 32.34 8icy h PRO 198 CO 0.30 -0.39 0.86 1.03 -0.21 0.00 0.00 178.00 179.59 8icy h SER 199 N -0.61 0.19 -3.59 -2.05 0.87 -1.97 -3.37 113.55 103.02 8icy h SER 199 Ca 0.02 0.06 -0.70 0.00 -1.23 0.00 0.00 61.79 59.94 8icy h SER 199 Cb 0.63 0.03 -0.23 0.00 -0.44 0.00 0.00 62.40 62.39 8icy h SER 199 CO -0.19 -0.02 -0.50 0.12 -0.53 0.00 0.00 176.83 175.71 8icy s PHE 200 N -5.18 3.23 0.13 2.24 5.36 -0.84 -4.84 117.98 118.09 8icy s PHE 200 Ca -0.07 -0.77 -0.00 0.00 -0.96 0.00 0.00 56.93 55.13 8icy s PHE 200 Cb 0.26 -2.46 -0.04 0.00 -0.34 0.00 0.00 43.02 40.44 8icy s PHE 200 CO 0.82 -0.58 0.03 -0.08 -1.46 0.00 0.00 175.22 173.94 8icy s THR 201 N 1.60 0.28 0.11 0.12 -1.32 -1.26 0.29 115.64 115.45 8icy s THR 201 Ca 0.03 -1.92 0.05 0.00 -1.21 0.00 0.00 61.69 58.65 8icy s THR 201 Cb -0.19 -2.00 0.11 0.00 -1.51 0.00 0.00 72.50 68.92 8icy s THR 201 CO 0.07 -0.54 0.48 -1.20 -2.21 0.00 0.00 174.62 171.23 8icy n SER 202 N -0.11 0.07 0.00 8.08 7.64 -1.26 -3.38 113.62 124.67 8icy n SER 202 Ca -0.07 0.51 0.00 0.00 1.01 0.00 0.00 58.87 60.32 8icy n SER 202 Cb 0.63 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 8icy n SER 202 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 8icy n GLU 203 N -3.82 0.00 0.00 1.43 4.71 -1.26 -4.94 120.64 116.76 8icy n GLU 203 Ca 0.11 0.07 0.00 0.00 -0.01 0.00 0.00 57.16 57.33 8icy n GLU 203 Cb 0.36 -0.39 0.00 0.00 -1.01 0.00 0.00 31.44 30.40 8icy n GLU 203 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 8icy n SER 204 N -1.64 0.00 -1.00 1.62 3.41 -1.22 -4.34 113.62 110.46 8icy n SER 204 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 8icy n SER 204 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 8icy n SER 204 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 8icy n THR 205 N 0.00 0.00 -2.51 6.66 5.66 -1.26 -4.61 114.28 118.22 8icy n THR 205 Ca 0.00 0.00 0.07 0.00 -3.05 0.00 0.00 64.05 61.07 8icy n THR 205 Cb 0.00 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.76 8icy n THR 205 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 8icy n LYS 206 N 0.46 -1.04 0.00 1.09 5.02 -1.26 -4.95 118.16 117.48 8icy n LYS 206 Ca 0.00 0.69 0.00 0.00 -2.02 0.00 0.00 58.31 56.98 8icy n LYS 206 Cb 0.00 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 8icy n LYS 206 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 8icy n GLN 207 N -2.26 0.00 -0.33 1.97 7.27 -1.26 -5.02 117.38 117.75 8icy n GLN 207 Ca 0.00 0.00 0.25 0.00 0.07 0.00 0.00 57.00 57.33 8icy n GLN 207 Cb 0.24 0.00 0.55 0.00 2.41 0.00 0.00 30.24 33.44 8icy n GLN 207 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 8icy h PRO 208 N 0.00 0.30 -0.35 3.69 0.14 -1.92 0.37 132.00 134.23 8icy h PRO 208 Ca 0.00 -0.02 0.10 0.00 0.14 0.00 0.00 66.00 66.22 8icy h PRO 208 Cb 0.00 -0.07 -0.01 0.00 0.14 0.00 0.00 31.00 31.06 8icy h PRO 208 CO 0.00 0.20 0.30 0.87 0.14 0.00 0.00 178.00 179.51 8icy h LYS 209 N 0.31 0.00 -0.04 0.86 1.79 -1.96 0.30 116.57 117.83 8icy h LYS 209 Ca 0.60 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 59.11 8icy h LYS 209 Cb 1.68 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 32.28 8icy h LYS 209 CO -0.26 0.00 -0.26 -0.07 -1.08 0.00 0.00 179.45 177.78 8icy h LEU 210 N 0.00 -0.79 0.16 2.94 3.38 -0.65 1.85 115.31 122.20 8icy h LEU 210 Ca 0.17 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 8icy h LEU 210 Cb 0.76 0.33 0.00 0.00 0.09 0.00 0.00 40.66 41.84 8icy h LEU 210 CO -0.00 -0.32 -0.09 0.25 0.09 0.00 0.00 178.44 178.37 8icy h LEU 211 N -0.38 -0.21 -0.19 1.67 5.85 -1.13 -3.27 115.31 117.65 8icy h LEU 211 Ca 0.07 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.85 8icy h LEU 211 Cb 0.48 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.50 8icy h LEU 211 CO -0.26 -0.14 -0.39 0.45 -0.34 0.00 0.00 178.44 177.76 8icy h HIS 212 N -0.23 -1.12 -0.65 1.25 3.86 -0.58 -1.99 115.15 115.68 8icy h HIS 212 Ca -0.02 0.05 0.13 0.00 -1.16 0.00 0.00 60.37 59.37 8icy h HIS 212 Cb 0.18 0.52 -0.12 0.00 1.06 0.00 0.00 27.41 29.05 8icy h HIS 212 CO -0.07 -0.45 -0.12 1.96 0.86 0.00 0.00 177.93 180.10 8icy h GLN 213 N -0.43 0.02 -0.02 2.45 4.20 0.28 -2.03 115.11 119.58 8icy h GLN 213 Ca 0.10 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 8icy h GLN 213 Cb 0.60 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.37 8icy h GLN 213 CO -0.42 0.01 0.01 -0.24 -0.67 0.00 0.00 178.83 177.52 8icy h VAL 214 N 0.02 1.12 -1.04 -0.54 3.04 -1.60 -2.73 116.25 114.53 8icy h VAL 214 Ca 0.32 -0.36 0.26 0.00 -1.01 0.00 0.00 66.70 65.91 8icy h VAL 214 Cb 0.50 1.33 -0.09 0.00 -2.01 0.00 0.00 31.29 31.02 8icy h VAL 214 CO -0.64 0.10 0.67 0.58 -1.01 0.00 0.00 177.57 177.26 8icy h VAL 215 N -0.12 0.53 -0.16 1.51 2.07 -0.64 -1.00 116.25 118.44 8icy h VAL 215 Ca 0.01 -0.14 -0.09 0.00 0.82 0.00 0.00 66.70 67.31 8icy h VAL 215 Cb 0.15 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.02 8icy h VAL 215 CO -0.00 0.07 -0.24 -0.08 0.02 0.00 0.00 177.57 177.34 8icy h GLU 216 N 0.39 0.44 0.47 1.57 4.81 -1.40 -2.99 114.58 117.87 8icy h GLU 216 Ca 0.59 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.54 8icy h GLU 216 Cb 1.50 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.89 8icy h GLU 216 CO -0.29 0.85 -0.41 0.37 -0.73 0.00 0.00 179.01 178.80 8icy h GLN 217 N 0.07 -0.83 -1.12 1.92 5.75 -0.89 0.43 115.11 120.44 8icy h GLN 217 Ca 0.02 0.06 0.33 0.00 -0.15 0.00 0.00 58.65 58.90 8icy h GLN 217 Cb 0.81 0.19 -0.04 0.00 1.07 0.00 0.00 27.48 29.50 8icy h GLN 217 CO 0.05 -0.55 0.90 -0.07 -2.65 0.00 0.00 178.83 176.51 8icy h LEU 218 N -0.86 0.00 0.17 -2.39 4.07 -1.51 0.63 115.31 115.43 8icy h LEU 218 Ca -0.06 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.62 8icy h LEU 218 Cb 0.73 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.49 8icy h LEU 218 CO -0.02 0.00 -1.30 1.56 -1.08 0.00 0.00 178.44 177.60 8icy h GLN 219 N 0.00 0.37 0.15 1.13 4.20 -1.18 0.15 115.11 119.92 8icy h GLN 219 Ca 0.53 -0.63 0.01 0.00 0.06 0.00 0.00 58.65 58.62 8icy h GLN 219 Cb 2.33 0.23 -0.02 0.00 0.30 0.00 0.00 27.48 30.32 8icy h GLN 219 CO -0.01 1.30 -0.18 -0.22 -0.67 0.00 0.00 178.83 179.06 8icy h LYS 220 N -0.14 -0.36 0.00 1.46 3.64 0.47 -0.49 116.57 121.17 8icy h LYS 220 Ca -0.25 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.13 8icy h LYS 220 Cb 1.89 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 33.79 8icy h LYS 220 CO 0.17 -0.24 -0.11 -0.39 -2.27 0.00 0.00 179.45 176.61 8icy h VAL 221 N -0.37 0.35 -0.08 2.00 -1.51 -1.06 -3.47 116.25 112.11 8icy h VAL 221 Ca 0.01 -0.70 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 8icy h VAL 221 Cb 0.36 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.05 8icy h VAL 221 CO -0.07 0.11 0.00 1.41 -1.23 0.00 0.00 177.57 177.79 8icy n HIS 222 N -3.34 0.00 -0.13 5.19 8.25 -0.19 -5.02 115.22 119.98 8icy n HIS 222 Ca -0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.24 8icy n HIS 222 Cb 0.32 -0.12 -0.11 0.00 1.12 0.00 0.00 29.99 31.19 8icy n HIS 222 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 8icy n PHE 223 N -0.68 0.00 -2.96 4.41 7.35 0.38 -4.76 117.46 121.20 8icy n PHE 223 Ca 0.00 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.28 8icy n PHE 223 Cb 0.06 -0.97 -0.05 0.00 0.35 0.00 0.00 39.48 38.88 8icy n PHE 223 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 8icy s ILE 224 N -2.50 4.88 -0.24 -2.13 1.01 -0.39 -1.47 121.20 120.36 8icy s ILE 224 Ca -0.35 1.43 0.00 0.00 0.00 0.00 0.00 60.65 61.73 8icy s ILE 224 Cb 0.11 -4.06 -0.15 0.00 0.01 0.00 0.00 42.46 38.37 8icy s ILE 224 CO 0.54 -0.05 -0.23 0.35 0.00 0.00 0.00 174.94 175.56 8icy n THR 225 N 5.24 1.38 -4.31 2.92 -2.24 0.13 -4.46 114.28 112.94 8icy n THR 225 Ca 0.04 -0.51 -0.16 0.00 -2.27 0.00 0.00 64.05 61.15 8icy n THR 225 Cb 0.48 -1.41 -0.10 0.00 -2.10 0.00 0.00 70.33 67.20 8icy n THR 225 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 8icy s ASP 226 N -6.44 1.48 -0.10 3.42 1.11 -1.12 -5.02 116.67 110.00 8icy s ASP 226 Ca -0.33 -1.27 0.03 0.00 0.18 0.00 0.00 52.55 51.16 8icy s ASP 226 Cb 0.09 0.08 0.01 0.00 1.07 0.00 0.00 42.92 44.17 8icy s ASP 226 CO 0.54 -0.61 -0.19 -0.89 1.18 0.00 0.00 175.17 175.20 8icy s THR 227 N -3.59 1.75 -0.21 -1.27 2.01 -1.26 -2.43 115.64 110.65 8icy s THR 227 Ca 0.31 -0.82 -0.07 0.00 0.31 0.00 0.00 61.69 61.41 8icy s THR 227 Cb 0.07 -1.55 -0.20 0.00 0.01 0.00 0.00 72.50 70.83 8icy s THR 227 CO 0.09 0.49 0.03 0.18 -0.69 0.00 0.00 174.62 174.72 8icy n LEU 228 N 3.80 2.51 -3.37 4.42 4.32 -0.22 -4.88 117.00 123.58 8icy n LEU 228 Ca -0.20 0.15 0.02 0.00 -0.02 0.00 0.00 56.01 55.96 8icy n LEU 228 Cb 0.52 -0.98 -0.03 0.00 -1.62 0.00 0.00 43.42 41.31 8icy n LEU 228 CO 0.26 0.74 0.49 -0.94 -1.22 0.00 0.00 177.39 176.73 8icy s SER 229 N -6.92 -0.76 -0.11 -1.43 1.04 -0.95 -4.68 113.70 99.89 8icy s SER 229 Ca -0.30 0.86 -0.04 0.00 0.48 0.00 0.00 55.95 56.95 8icy s SER 229 Cb 0.09 1.79 -0.04 0.00 0.10 0.00 0.00 66.02 67.96 8icy s SER 229 CO 0.64 -0.14 0.03 -0.75 0.98 0.00 0.00 173.24 174.00 8icy s LYS 230 N 2.66 3.29 0.00 4.02 2.20 -1.26 0.43 119.74 131.08 8icy s LYS 230 Ca -0.00 -0.36 0.00 0.00 -0.36 0.00 0.00 55.97 55.25 8icy s LYS 230 Cb -0.09 -2.95 0.00 0.00 -1.51 0.00 0.00 37.83 33.29 8icy s LYS 230 CO -0.17 0.60 0.00 0.41 -0.36 0.00 0.00 175.35 175.83 8icy n GLY 231 N 2.47 4.79 0.71 5.54 0.00 -0.73 -4.89 105.19 113.08 8icy n GLY 231 Ca -0.18 -1.63 0.06 0.00 0.00 0.00 0.00 46.02 44.27 8icy n GLY 231 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 8icy n GLU 232 N 0.00 1.89 0.00 1.61 0.28 -1.26 -4.27 120.64 118.89 8icy n GLU 232 Ca 0.00 -1.37 0.00 0.00 -0.16 0.00 0.00 57.16 55.63 8icy n GLU 232 Cb 0.00 -1.30 0.00 0.00 1.43 0.00 0.00 31.44 31.57 8icy n GLU 232 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 8icy n THR 233 N 0.61 0.00 -3.44 3.84 -2.24 -1.26 -4.75 114.28 107.04 8icy n THR 233 Ca 0.13 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.74 8icy n THR 233 Cb 0.33 0.20 -0.11 0.00 -2.10 0.00 0.00 70.33 68.64 8icy n THR 233 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 8icy s LYS 234 N 0.00 0.27 0.24 -0.78 2.20 -1.26 -0.70 119.74 119.70 8icy s LYS 234 Ca 0.00 0.08 -0.03 0.00 -0.36 0.00 0.00 55.97 55.66 8icy s LYS 234 Cb 0.00 -0.89 -0.05 0.00 -1.51 0.00 0.00 37.83 35.38 8icy s LYS 234 CO 0.00 -0.82 0.47 0.12 -0.36 0.00 0.00 175.35 174.76 8icy s PHE 235 N 2.36 3.48 -0.21 4.03 5.36 -0.51 -1.77 117.98 130.72 8icy s PHE 235 Ca 0.09 0.50 -0.04 0.00 -0.96 0.00 0.00 56.93 56.52 8icy s PHE 235 Cb -0.15 -1.99 0.11 0.00 -0.34 0.00 0.00 43.02 40.65 8icy s PHE 235 CO -0.22 0.29 0.31 1.41 -1.46 0.00 0.00 175.22 175.55 8icy s MET 236 N -3.37 0.26 0.00 10.12 -2.45 0.17 -3.05 119.30 120.99 8icy s MET 236 Ca 0.41 0.49 0.00 0.00 -1.25 0.00 0.00 55.69 55.34 8icy s MET 236 Cb -0.11 -0.61 0.00 0.00 1.25 0.00 0.00 34.83 35.36 8icy s MET 236 CO 0.29 -0.57 0.00 0.41 1.05 0.00 0.00 175.02 176.20 8icy n GLY 237 N 5.35 5.51 2.91 2.11 0.00 0.10 -1.06 105.19 120.11 8icy n GLY 237 Ca -0.05 -0.93 -0.16 0.00 0.00 0.00 0.00 46.02 44.88 8icy n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 8icy s VAL 238 N 1.56 0.31 0.36 1.61 1.01 -1.02 -1.78 120.40 122.45 8icy s VAL 238 Ca 0.00 -0.11 0.04 0.00 0.00 0.00 0.00 61.98 61.91 8icy s VAL 238 Cb 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 36.38 36.05 8icy s VAL 238 CO 0.00 0.11 0.13 0.00 0.00 0.00 0.00 175.10 175.35 8icy s GLN 240 N -3.76 0.61 0.11 0.00 0.74 -0.55 -0.63 119.66 116.18 8icy s GLN 240 Ca 0.30 0.74 -0.30 0.00 0.05 0.00 0.00 55.36 56.15 8icy s GLN 240 Cb 0.04 0.29 -0.06 0.00 1.10 0.00 0.00 33.01 34.38 8icy s GLN 240 CO 0.16 -0.08 1.00 -0.51 -0.55 0.00 0.00 175.29 175.31 8icy s LEU 241 N 0.35 4.48 -0.72 3.68 1.43 -1.26 -4.66 118.68 121.98 8icy s LEU 241 Ca 0.01 1.84 -0.28 0.00 -1.03 0.00 0.00 54.13 54.67 8icy s LEU 241 Cb -0.05 -3.59 -0.14 0.00 0.03 0.00 0.00 46.19 42.44 8icy s LEU 241 CO -0.05 -0.12 2.54 -2.65 0.23 0.00 0.00 176.35 176.30 8icy n PRO 242 N 2.85 0.58 -1.52 1.29 -0.02 -1.26 -4.02 135.00 132.90 8icy n PRO 242 Ca 0.03 -0.01 -0.43 0.00 -2.02 0.00 0.00 63.50 61.07 8icy n PRO 242 Cb 0.49 -2.59 -0.06 0.00 -0.02 0.00 0.00 33.50 31.32 8icy n PRO 242 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 8icy n SER 243 N 13.56 2.13 1.40 2.55 7.64 -1.26 -4.87 113.62 134.78 8icy n SER 243 Ca 0.50 0.02 0.00 0.00 1.01 0.00 0.00 58.87 60.40 8icy n SER 243 Cb 0.32 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.14 8icy n SER 243 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 8icy n LYS 244 N 8.63 3.21 -2.00 1.43 4.76 -1.26 -4.41 118.16 128.51 8icy n LYS 244 Ca 0.41 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.45 8icy n LYS 244 Cb 0.35 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.54 8icy n LYS 244 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 8icy n ASN 245 N 0.00 7.38 -0.28 4.39 2.04 -1.26 -4.87 115.26 122.66 8icy n ASN 245 Ca 0.00 -3.08 0.00 0.00 -0.44 0.00 0.00 54.58 51.06 8icy n ASN 245 Cb 0.00 -1.41 0.00 0.00 -2.53 0.00 0.00 39.78 35.84 8icy n ASN 245 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 8icy n ASP 246 N 2.44 0.00 0.00 0.53 8.00 -1.26 -4.93 116.55 121.33 8icy n ASP 246 Ca 0.59 0.00 0.00 0.00 0.71 0.00 0.00 54.79 56.09 8icy n ASP 246 Cb 0.27 -0.86 0.00 0.00 -0.02 0.00 0.00 41.12 40.51 8icy n ASP 246 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 8icy n GLU 247 N -1.14 0.00 -3.65 -1.24 -0.58 -1.26 -5.00 120.64 107.77 8icy n GLU 247 Ca 0.00 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.35 8icy n GLU 247 Cb 0.31 0.00 -0.11 0.00 -0.57 0.00 0.00 31.44 31.08 8icy n GLU 247 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 8icy s LYS 248 N 0.00 2.58 0.62 3.49 0.00 -1.26 -5.09 119.74 120.08 8icy s LYS 248 Ca 0.00 -1.41 -0.03 0.00 0.00 0.00 0.00 55.97 54.53 8icy s LYS 248 Cb 0.00 -3.70 0.05 0.00 0.00 0.00 0.00 37.83 34.18 8icy s LYS 248 CO 0.00 -0.89 0.89 -2.00 0.00 0.00 0.00 175.35 173.35 8icy s GLU 249 N 1.41 2.38 0.01 1.78 2.12 -1.26 -4.17 118.70 120.97 8icy s GLU 249 Ca 0.02 -0.51 -0.01 0.00 0.36 0.00 0.00 54.97 54.83 8icy s GLU 249 Cb -0.22 -2.33 -0.04 0.00 0.26 0.00 0.00 34.13 31.80 8icy s GLU 249 CO 0.02 -0.97 0.13 0.71 -0.54 0.00 0.00 175.26 174.62 8icy s TYR 250 N -3.00 3.39 0.46 5.30 2.02 -1.26 -4.99 117.35 119.28 8icy s TYR 250 Ca 0.59 0.25 -0.22 0.00 -0.37 0.00 0.00 57.07 57.31 8icy s TYR 250 Cb -0.11 -1.76 -0.08 0.00 -0.40 0.00 0.00 41.96 39.62 8icy s TYR 250 CO 0.42 0.59 1.11 -1.25 -1.57 0.00 0.00 175.55 174.84 8icy s PRO 251 N -1.96 3.82 0.00 -1.71 0.04 -1.26 -4.78 135.00 129.15 8icy s PRO 251 Ca 0.26 1.61 -0.30 0.00 0.04 0.00 0.00 61.00 62.61 8icy s PRO 251 Cb -0.12 -2.33 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 8icy s PRO 251 CO 0.18 -0.46 1.06 -1.01 0.04 0.00 0.00 177.00 176.80 8icy s HIS 252 N -1.68 3.55 0.11 0.56 3.76 -1.26 -4.52 115.29 115.81 8icy s HIS 252 Ca 0.64 1.55 0.10 0.00 -0.15 0.00 0.00 55.06 57.19 8icy s HIS 252 Cb -0.24 -3.23 -0.04 0.00 1.11 0.00 0.00 32.58 30.19 8icy s HIS 252 CO 0.29 -0.46 -0.24 1.03 -0.85 0.00 0.00 174.74 174.50 8icy s ARG 253 N 1.21 1.33 -0.18 1.40 3.00 0.20 -4.12 118.95 121.79 8icy s ARG 253 Ca 0.54 -1.24 -0.29 0.00 0.00 0.00 0.00 55.73 54.74 8icy s ARG 253 Cb -0.23 -1.70 -0.02 0.00 0.00 0.00 0.00 34.95 33.00 8icy s ARG 253 CO 0.27 0.40 1.42 1.03 0.00 0.00 0.00 175.30 178.43 8icy s ARG 254 N -1.88 4.07 0.21 3.54 1.81 -1.26 0.32 118.95 125.76 8icy s ARG 254 Ca 0.11 1.69 0.10 0.00 -1.72 0.00 0.00 55.73 55.91 8icy s ARG 254 Cb -0.10 -3.89 -0.04 0.00 -0.45 0.00 0.00 34.95 30.47 8icy s ARG 254 CO 0.05 -0.94 -0.13 -1.50 -0.68 0.00 0.00 175.30 172.10 8icy s ILE 255 N 4.13 2.92 -0.09 1.52 2.07 -0.73 -0.75 121.20 130.26 8icy s ILE 255 Ca 0.62 -1.91 -0.04 0.00 -1.41 0.00 0.00 60.65 57.91 8icy s ILE 255 Cb -0.24 -2.47 0.04 0.00 0.13 0.00 0.00 42.46 39.93 8icy s ILE 255 CO 0.22 -0.20 0.20 -1.81 -1.91 0.00 0.00 174.94 171.44 8icy s ASP 256 N -3.03 -0.13 -0.04 4.50 1.01 -0.34 0.03 116.67 118.67 8icy s ASP 256 Ca 0.26 0.42 0.01 0.00 0.71 0.00 0.00 52.55 53.95 8icy s ASP 256 Cb -0.08 0.32 0.03 0.00 1.01 0.00 0.00 42.92 44.20 8icy s ASP 256 CO 0.15 -0.17 -0.01 -0.63 0.21 0.00 0.00 175.17 174.72 8icy s ILE 257 N 1.32 0.30 -0.03 0.77 1.01 -1.17 -0.27 121.20 123.12 8icy s ILE 257 Ca -0.08 0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.61 8icy s ILE 257 Cb -0.11 -0.38 0.01 0.00 0.01 0.00 0.00 42.46 41.99 8icy s ILE 257 CO -0.07 0.18 -0.09 0.00 0.00 0.00 0.00 174.94 174.95 8icy s ARG 258 N 1.02 1.04 0.44 2.79 1.70 -1.15 -1.43 118.95 123.36 8icy s ARG 258 Ca -0.10 -0.30 -0.21 0.00 -0.47 0.00 0.00 55.73 54.65 8icy s ARG 258 Cb -0.14 -0.96 -0.10 0.00 -0.57 0.00 0.00 34.95 33.19 8icy s ARG 258 CO -0.01 0.08 0.99 -1.17 -1.08 0.00 0.00 175.30 174.10 8icy s LEU 259 N 0.34 3.96 -0.02 -1.89 2.96 0.12 -1.37 118.68 122.78 8icy s LEU 259 Ca -0.06 1.81 -0.01 0.00 -0.22 0.00 0.00 54.13 55.65 8icy s LEU 259 Cb -0.10 -4.48 0.01 0.00 0.50 0.00 0.00 46.19 42.12 8icy s LEU 259 CO 0.01 -0.48 0.05 -0.63 -1.32 0.00 0.00 176.35 173.97 8icy s ILE 260 N -2.03 -0.01 -0.24 6.68 -1.09 0.26 -4.87 121.20 119.89 8icy s ILE 260 Ca 0.62 0.05 -0.29 0.00 -2.23 0.00 0.00 60.65 58.81 8icy s ILE 260 Cb -0.13 -0.08 -0.03 0.00 -1.58 0.00 0.00 42.46 40.63 8icy s ILE 260 CO 0.17 0.02 1.85 -2.16 -1.23 0.00 0.00 174.94 173.59 8icy s PRO 261 N 0.30 3.49 0.48 2.79 0.04 -1.26 -3.37 135.00 137.48 8icy s PRO 261 Ca -0.02 1.72 0.44 0.00 0.04 0.00 0.00 61.00 63.17 8icy s PRO 261 Cb -0.03 -4.18 1.51 0.00 0.04 0.00 0.00 34.50 31.83 8icy s PRO 261 CO -0.01 -1.67 1.37 1.17 0.04 0.00 0.00 177.00 177.89 8icy n LYS 262 N 8.21 -0.00 -0.10 4.56 3.00 0.83 -0.76 118.16 133.90 8icy n LYS 262 Ca 0.23 0.95 -0.01 0.00 -0.00 0.00 0.00 58.31 59.48 8icy n LYS 262 Cb 0.45 -2.19 0.03 0.00 0.00 0.00 0.00 35.03 33.32 8icy n LYS 262 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 8icy n ASP 263 N -3.71 2.33 0.00 3.14 5.75 -1.26 -3.57 116.55 119.23 8icy n ASP 263 Ca 0.39 -2.12 0.00 0.00 -0.01 0.00 0.00 54.79 53.05 8icy n ASP 263 Cb 1.76 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 41.32 8icy n ASP 263 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 8icy n GLN 264 N 0.22 0.00 0.00 0.11 6.02 0.06 -4.91 117.38 118.88 8icy n GLN 264 Ca 0.04 -0.08 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 8icy n GLN 264 Cb 0.48 -0.11 0.00 0.00 1.02 0.00 0.00 30.24 31.64 8icy n GLN 264 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 8icy n TYR 265 N 0.00 0.00 -0.27 1.08 9.36 -1.23 -2.03 117.16 124.07 8icy n TYR 265 Ca 0.00 0.00 0.06 0.00 3.32 0.00 0.00 57.90 61.28 8icy n TYR 265 Cb 0.44 -0.15 0.13 0.00 -0.63 0.00 0.00 39.34 39.13 8icy n TYR 265 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 8icy n TYR 266 N -1.09 0.32 0.02 2.98 4.01 -1.26 0.22 117.16 122.36 8icy n TYR 266 Ca 0.00 0.91 -0.12 0.00 -0.16 0.00 0.00 57.90 58.53 8icy n TYR 266 Cb 0.00 -0.96 -0.08 0.00 -0.31 0.00 0.00 39.34 37.98 8icy n TYR 266 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 8icy h GLY 268 N -0.20 -0.20 1.11 0.00 0.00 0.22 0.46 103.07 104.46 8icy h GLY 268 Ca 0.00 0.37 -0.02 0.00 0.00 0.00 0.00 47.33 47.68 8icy h GLY 268 CO -0.00 -0.21 0.43 -2.08 0.00 0.00 0.00 176.54 174.68 8icy h VAL 269 N -0.25 1.25 0.22 4.60 2.07 0.32 0.10 116.25 124.55 8icy h VAL 269 Ca 0.16 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 67.04 8icy h VAL 269 Cb 0.51 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 8icy h VAL 269 CO -0.48 0.28 -0.16 0.25 0.02 0.00 0.00 177.57 177.48 8icy h LEU 270 N 1.16 -0.41 0.00 2.57 5.85 0.46 -1.67 115.31 123.28 8icy h LEU 270 Ca 0.29 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.04 8icy h LEU 270 Cb 0.06 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.22 8icy h LEU 270 CO -0.04 -0.25 0.00 0.00 -0.34 0.00 0.00 178.44 177.81 8icy n TYR 271 N -5.28 0.00 0.08 1.25 9.36 0.15 -1.70 117.16 121.02 8icy n TYR 271 Ca -0.09 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.18 8icy n TYR 271 Cb 0.20 -0.37 0.26 0.00 -0.63 0.00 0.00 39.34 38.79 8icy n TYR 271 CO 0.00 0.00 0.00 1.19 0.22 0.00 0.00 176.86 178.27 8icy n PHE 272 N -2.10 0.32 1.81 2.98 3.01 -0.03 0.33 117.46 123.78 8icy n PHE 272 Ca 0.00 0.17 0.15 0.00 1.01 0.00 0.00 57.45 58.78 8icy n PHE 272 Cb 0.00 -0.69 0.83 0.00 -0.01 0.00 0.00 39.48 39.61 8icy n PHE 272 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 8icy n THR 273 N -1.81 0.00 -1.66 4.37 -1.04 -0.63 -1.53 114.28 111.98 8icy n THR 273 Ca -0.01 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 8icy n THR 273 Cb 0.12 -0.27 0.00 0.00 -1.82 0.00 0.00 70.33 68.35 8icy n THR 273 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 8icy n GLY 274 N 1.08 0.79 1.21 3.41 0.00 0.15 -4.69 105.19 107.13 8icy n GLY 274 Ca 0.21 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.42 8icy n GLY 274 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 8icy n SER 275 N -3.67 -0.16 -0.04 1.61 3.41 -1.21 -4.52 113.62 109.05 8icy n SER 275 Ca 0.00 -1.09 0.02 0.00 -0.26 0.00 0.00 58.87 57.54 8icy n SER 275 Cb 0.00 -0.32 0.36 0.00 -0.26 0.00 0.00 64.21 63.99 8icy n SER 275 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 8icy h ASP 276 N -0.69 0.55 0.00 4.04 3.32 -1.93 -1.61 116.42 120.11 8icy h ASP 276 Ca -0.14 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 8icy h ASP 276 Cb 0.38 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.79 8icy h ASP 276 CO 0.09 0.45 -0.00 0.16 -1.72 0.00 0.00 179.24 178.22 8icy h ILE 277 N 0.63 1.75 -0.06 0.35 -2.65 -1.90 -2.54 117.51 113.08 8icy h ILE 277 Ca 0.16 -2.28 0.02 0.00 1.03 0.00 0.00 64.86 63.79 8icy h ILE 277 Cb 0.02 3.29 -0.00 0.00 -2.05 0.00 0.00 36.82 38.08 8icy h ILE 277 CO -0.03 0.59 0.05 0.15 0.03 0.00 0.00 178.15 178.94 8icy h PHE 278 N -0.98 0.00 0.53 0.16 3.57 -1.52 -0.55 116.94 118.15 8icy h PHE 278 Ca -0.00 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 8icy h PHE 278 Cb 0.96 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.71 8icy h PHE 278 CO 0.27 0.00 -0.26 -0.91 -2.23 0.00 0.00 178.31 175.18 8icy h ASN 279 N 0.00 -0.60 -0.33 0.41 -0.26 -1.35 0.15 115.58 113.59 8icy h ASN 279 Ca 0.03 0.02 0.07 0.00 -0.56 0.00 0.00 56.30 55.86 8icy h ASN 279 Cb 0.13 0.16 -0.07 0.00 -1.06 0.00 0.00 38.32 37.48 8icy h ASN 279 CO -0.00 -0.40 -0.10 0.11 -1.06 0.00 0.00 177.43 175.98 8icy h LYS 280 N -0.78 -0.03 -0.97 0.81 1.57 -1.07 0.52 116.57 116.62 8icy h LYS 280 Ca -0.07 0.00 0.18 0.00 -1.87 0.00 0.00 60.65 58.88 8icy h LYS 280 Cb 0.55 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.77 8icy h LYS 280 CO 0.12 -0.02 0.61 -0.91 -0.57 0.00 0.00 179.45 178.68 8icy h ASN 281 N -0.03 0.72 0.00 0.86 -0.26 -1.14 3.24 115.58 118.97 8icy h ASN 281 Ca 0.16 0.07 -0.14 0.00 -0.56 0.00 0.00 56.30 55.83 8icy h ASN 281 Cb 0.27 -0.06 0.01 0.00 -1.06 0.00 0.00 38.32 37.48 8icy h ASN 281 CO -0.35 0.30 -0.57 -0.03 -1.06 0.00 0.00 177.43 175.72 8icy h MET 282 N 0.73 0.38 -0.33 0.81 4.05 0.21 -3.04 114.93 117.73 8icy h MET 282 Ca 0.53 -0.41 0.03 0.00 -0.28 0.00 0.00 59.70 59.57 8icy h MET 282 Cb 0.86 0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 31.75 8icy h MET 282 CO -0.30 1.09 0.12 0.00 0.23 0.00 0.00 176.91 178.05 8icy h ARG 283 N -0.16 0.26 -0.68 0.39 3.08 0.42 0.74 114.38 118.43 8icy h ARG 283 Ca -0.07 -0.02 0.17 0.00 0.07 0.00 0.00 59.98 60.14 8icy h ARG 283 Cb 1.29 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.24 8icy h ARG 283 CO 0.11 0.17 0.48 0.00 -1.07 0.00 0.00 179.97 179.66 8icy h ALA 284 N 1.20 2.44 0.16 0.04 0.00 0.56 -2.79 119.26 120.88 8icy h ALA 284 Ca 0.15 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.69 8icy h ALA 284 Cb 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 8icy h ALA 284 CO -0.14 -0.64 -1.85 1.25 0.00 0.00 0.00 179.25 177.87 8icy h HIS 285 N 0.14 0.63 -1.05 0.00 -0.00 -1.17 -3.35 115.15 110.34 8icy h HIS 285 Ca 0.33 -0.46 0.31 0.00 -0.00 0.00 0.00 60.37 60.54 8icy h HIS 285 Cb 1.11 -0.03 -0.04 0.00 -0.00 0.00 0.00 27.41 28.45 8icy h HIS 285 CO -0.00 1.72 0.78 0.00 -0.00 0.00 0.00 177.93 180.43 8icy h ALA 286 N 0.10 2.98 -0.74 5.26 0.00 -0.61 0.77 119.26 127.02 8icy h ALA 286 Ca -0.38 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 8icy h ALA 286 Cb 2.08 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.91 8icy h ALA 286 CO 0.14 -1.32 0.39 1.25 0.00 0.00 0.00 179.25 179.72 8icy h LEU 287 N 0.00 0.94 0.01 0.00 7.12 -1.52 0.51 115.31 122.36 8icy h LEU 287 Ca 0.50 -0.11 -0.12 0.00 0.13 0.00 0.00 57.88 58.29 8icy h LEU 287 Cb 2.05 -0.24 0.01 0.00 -0.53 0.00 0.00 40.66 41.96 8icy h LEU 287 CO -0.01 0.77 -0.46 -0.33 -0.13 0.00 0.00 178.44 178.29 8icy h GLU 288 N 1.03 0.29 -0.32 1.25 4.39 0.28 -3.16 114.58 118.33 8icy h GLU 288 Ca 0.26 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.63 8icy h GLU 288 Cb 0.06 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 8icy h GLU 288 CO -0.04 1.04 0.00 1.63 -1.16 0.00 0.00 179.01 180.48 8icy n LYS 289 N -4.34 0.41 -2.88 2.33 4.76 0.42 -4.77 118.16 114.09 8icy n LYS 289 Ca -0.10 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.18 8icy n LYS 289 Cb 0.61 -1.16 0.03 0.00 -1.84 0.00 0.00 35.03 32.67 8icy n LYS 289 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 8icy n GLY 290 N 0.21 -0.12 0.67 0.72 0.00 -1.09 -4.85 105.19 100.73 8icy n GLY 290 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 46.02 45.84 8icy n GLY 290 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 8icy n PHE 291 N -4.13 -0.10 -3.69 1.61 3.72 0.18 -1.11 117.46 113.94 8icy n PHE 291 Ca -0.06 -0.56 -0.10 0.00 -0.05 0.00 0.00 57.45 56.68 8icy n PHE 291 Cb 0.57 0.04 -0.10 0.00 -0.94 0.00 0.00 39.48 39.05 8icy n PHE 291 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 8icy s THR 292 N -2.13 -0.02 -0.03 4.37 -1.32 -0.88 -3.24 115.64 112.39 8icy s THR 292 Ca 0.07 0.07 0.03 0.00 -1.21 0.00 0.00 61.69 60.65 8icy s THR 292 Cb 0.00 -0.68 -0.00 0.00 -1.51 0.00 0.00 72.50 70.31 8icy s THR 292 CO 0.05 0.03 -0.13 -0.63 -2.21 0.00 0.00 174.62 171.73 8icy s ILE 293 N 1.36 1.05 0.33 5.08 -1.09 -1.26 -2.11 121.20 124.56 8icy s ILE 293 Ca -0.09 -0.52 0.02 0.00 -2.23 0.00 0.00 60.65 57.83 8icy s ILE 293 Cb -0.07 -0.90 -0.01 0.00 -1.58 0.00 0.00 42.46 39.90 8icy s ILE 293 CO -0.13 0.31 0.38 -0.46 -1.23 0.00 0.00 174.94 173.81 8icy n ASN 294 N 3.08 -1.04 0.10 3.58 2.04 -1.16 -4.92 115.26 116.95 8icy n ASN 294 Ca -0.17 -2.97 0.04 0.00 -0.44 0.00 0.00 54.58 51.04 8icy n ASN 294 Cb 0.54 2.09 0.19 0.00 -2.53 0.00 0.00 39.78 40.08 8icy n ASN 294 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 8icy n GLU 295 N -0.58 0.05 0.00 -3.83 0.00 -1.26 -3.35 120.64 111.67 8icy n GLU 295 Ca 0.04 0.44 0.00 0.00 0.00 0.00 0.00 57.16 57.64 8icy n GLU 295 Cb 0.58 -1.96 0.00 0.00 0.00 0.00 0.00 31.44 30.05 8icy n GLU 295 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 8icy n TYR 296 N -1.72 0.00 -3.81 -1.84 4.01 -1.26 -2.70 117.16 109.83 8icy n TYR 296 Ca -0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.64 8icy n TYR 296 Cb 0.31 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.34 8icy n TYR 296 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 8icy n THR 297 N -0.04 0.00 -3.32 -0.72 -2.24 -1.21 -4.71 114.28 102.04 8icy n THR 297 Ca 0.00 -1.13 -0.10 0.00 -2.27 0.00 0.00 64.05 60.55 8icy n THR 297 Cb 0.00 0.79 -0.07 0.00 -2.10 0.00 0.00 70.33 68.96 8icy n THR 297 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 8icy s ILE 298 N -2.59 -0.59 -0.12 2.28 2.07 -1.24 -2.96 121.20 118.05 8icy s ILE 298 Ca 0.18 -0.35 -0.05 0.00 -1.41 0.00 0.00 60.65 59.02 8icy s ILE 298 Cb -0.02 -0.97 -0.04 0.00 0.13 0.00 0.00 42.46 41.56 8icy s ILE 298 CO 0.13 -0.32 0.07 -0.13 -1.91 0.00 0.00 174.94 172.78 8icy s ARG 299 N 2.47 3.41 0.22 3.50 0.52 -0.90 -0.80 118.95 127.38 8icy s ARG 299 Ca 0.10 -0.27 -0.30 0.00 -0.52 0.00 0.00 55.73 54.74 8icy s ARG 299 Cb -0.13 -3.06 -0.09 0.00 0.52 0.00 0.00 34.95 32.20 8icy s ARG 299 CO -0.30 0.64 1.27 -2.14 0.02 0.00 0.00 175.30 174.79 8icy s PRO 300 N -0.66 4.43 0.47 3.54 0.02 -1.22 -2.06 135.00 139.51 8icy s PRO 300 Ca 0.12 2.02 -0.06 0.00 0.02 0.00 0.00 61.00 63.09 8icy s PRO 300 Cb -0.12 -3.18 -0.04 0.00 0.02 0.00 0.00 34.50 31.18 8icy s PRO 300 CO 0.02 -0.17 0.78 -1.17 -0.33 0.00 0.00 177.00 176.14 8icy s LEU 301 N -0.53 3.67 -0.06 -5.54 2.96 -0.26 -3.89 118.68 115.03 8icy s LEU 301 Ca 0.54 0.98 -0.07 0.00 -0.22 0.00 0.00 54.13 55.35 8icy s LEU 301 Cb -0.36 -3.92 0.02 0.00 0.50 0.00 0.00 46.19 42.43 8icy s LEU 301 CO 0.40 -0.54 0.19 -0.83 -1.32 0.00 0.00 176.35 174.25 8icy s GLY 302 N -3.89 -0.11 0.58 7.98 0.00 -1.26 -4.89 107.32 105.72 8icy s GLY 302 Ca 0.48 0.41 0.37 0.00 0.00 0.00 0.00 44.72 45.98 8icy s GLY 302 CO 0.42 0.31 1.56 -0.24 0.00 0.00 0.00 173.10 175.16 8icy h VAL 303 N 4.69 0.12 0.00 1.40 3.04 -1.99 -2.71 116.25 120.81 8icy h VAL 303 Ca -0.27 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 8icy h VAL 303 Cb 1.20 0.16 0.00 0.00 -2.01 0.00 0.00 31.29 30.63 8icy h VAL 303 CO 0.39 0.00 0.00 0.35 -1.01 0.00 0.00 177.57 177.30 8icy n THR 304 N -3.71 0.00 0.00 3.17 -2.24 -1.26 -4.67 114.28 105.57 8icy n THR 304 Ca 0.29 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 8icy n THR 304 Cb 1.54 -0.91 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 8icy n THR 304 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 8icy n GLY 305 N -0.70 3.48 3.17 3.38 0.00 -1.04 -5.05 105.19 108.43 8icy n GLY 305 Ca 0.03 -1.00 -0.10 0.00 0.00 0.00 0.00 46.02 44.96 8icy n GLY 305 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 8icy s VAL 306 N 0.00 0.12 0.11 1.61 -7.23 -1.08 -4.75 120.40 109.18 8icy s VAL 306 Ca 0.00 -0.98 0.02 0.00 -1.81 0.00 0.00 61.98 59.21 8icy s VAL 306 Cb 0.00 -0.96 -0.01 0.00 0.56 0.00 0.00 36.38 35.98 8icy s VAL 306 CO 0.00 -0.54 0.11 0.00 -0.31 0.00 0.00 175.10 174.36 8icy n ALA 307 N 0.62 0.14 -3.00 1.32 0.00 -1.26 -4.66 120.51 113.68 8icy n ALA 307 Ca -0.18 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.63 8icy n ALA 307 Cb 0.59 0.50 0.00 0.00 0.00 0.00 0.00 19.45 20.54 8icy n ALA 307 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 8icy n GLY 308 N -0.21 5.48 1.28 0.00 0.00 -1.25 -4.89 105.19 105.60 8icy n GLY 308 Ca 0.02 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.89 8icy n GLY 308 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 8icy n GLU 309 N 0.00 0.00 -1.29 1.61 4.71 -1.26 -3.41 120.64 121.00 8icy n GLU 309 Ca 0.00 0.02 -0.18 0.00 -0.01 0.00 0.00 57.16 56.99 8icy n GLU 309 Cb 0.00 -1.28 -0.19 0.00 -1.01 0.00 0.00 31.44 28.96 8icy n GLU 309 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 8icy n PRO 310 N -1.26 0.00 -1.72 3.49 -0.02 -1.26 -4.16 135.00 130.07 8icy n PRO 310 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.06 8icy n PRO 310 Cb 0.43 -0.88 -0.01 0.00 -0.02 0.00 0.00 33.50 33.02 8icy n PRO 310 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 8icy n LEU 311 N 4.77 3.83 -4.61 2.45 4.32 0.02 -4.93 117.00 122.85 8icy n LEU 311 Ca 0.56 1.20 -0.43 0.00 -0.02 0.00 0.00 56.01 57.32 8icy n LEU 311 Cb 0.14 -1.52 -0.03 0.00 -1.62 0.00 0.00 43.42 40.40 8icy n LEU 311 CO 0.93 -0.30 0.89 -2.16 -1.22 0.00 0.00 177.39 175.53 8icy s PRO 312 N -1.68 3.85 -0.23 3.23 0.04 -1.26 -4.54 135.00 134.41 8icy s PRO 312 Ca 0.57 0.69 -0.09 0.00 0.04 0.00 0.00 61.00 62.20 8icy s PRO 312 Cb -0.55 -3.82 -0.04 0.00 0.04 0.00 0.00 34.50 30.12 8icy s PRO 312 CO 0.60 -1.07 0.12 0.08 0.04 0.00 0.00 177.00 176.78 8icy s VAL 313 N 3.80 5.06 -0.92 -0.36 1.01 -1.26 -5.01 120.40 122.72 8icy s VAL 313 Ca 0.43 0.07 0.11 0.00 0.00 0.00 0.00 61.98 62.60 8icy s VAL 313 Cb -0.11 -3.34 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 8icy s VAL 313 CO 0.22 0.37 0.63 0.47 0.00 0.00 0.00 175.10 176.79 8icy n ASP 314 N 4.23 1.11 -3.61 3.32 9.92 -1.26 -4.92 116.55 125.35 8icy n ASP 314 Ca -0.16 -1.06 -0.05 0.00 -0.53 0.00 0.00 54.79 53.00 8icy n ASP 314 Cb 0.52 0.61 -0.02 0.00 -0.64 0.00 0.00 41.12 41.59 8icy n ASP 314 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 8icy s SER 315 N -1.64 -0.24 0.56 -2.24 0.15 -1.26 -5.01 113.70 104.02 8icy s SER 315 Ca 0.08 -0.14 0.28 0.00 0.70 0.00 0.00 55.95 56.88 8icy s SER 315 Cb 0.09 0.35 1.46 0.00 -1.71 0.00 0.00 66.02 66.22 8icy s SER 315 CO 0.33 -0.61 1.94 -0.33 1.20 0.00 0.00 173.24 175.77 8icy h GLU 316 N 2.00 0.00 0.82 5.44 5.08 -1.97 -1.56 114.58 124.39 8icy h GLU 316 Ca -0.22 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.10 8icy h GLU 316 Cb 1.22 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.48 8icy h GLU 316 CO 0.28 0.00 -0.39 -0.22 -1.00 0.00 0.00 179.01 177.67 8icy h LYS 317 N 0.00 -1.06 -0.92 2.33 1.63 -1.99 -2.51 116.57 114.05 8icy h LYS 317 Ca 0.27 0.07 0.18 0.00 -0.85 0.00 0.00 60.65 60.33 8icy h LYS 317 Cb 1.23 0.24 -0.17 0.00 -0.60 0.00 0.00 32.23 32.92 8icy h LYS 317 CO -0.00 -0.70 -0.24 -0.44 -3.45 0.00 0.00 179.45 174.62 8icy h ASP 318 N -1.12 -0.88 -0.82 4.20 3.32 -1.68 4.27 116.42 123.72 8icy h ASP 318 Ca -0.11 0.28 0.05 0.00 0.02 0.00 0.00 57.03 57.26 8icy h ASP 318 Cb 0.84 0.58 -0.05 0.00 0.22 0.00 0.00 39.33 40.92 8icy h ASP 318 CO 0.18 -0.30 0.54 0.40 -1.72 0.00 0.00 179.24 178.34 8icy h ILE 319 N -0.00 1.10 0.00 0.35 2.04 -1.53 -2.00 117.51 117.47 8icy h ILE 319 Ca 0.44 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.96 8icy h ILE 319 Cb 0.67 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 8icy h ILE 319 CO -0.95 0.18 0.00 0.49 0.00 0.00 0.00 178.15 177.87 8icy n PHE 320 N -4.46 0.00 -0.32 1.37 3.72 1.39 -3.11 117.46 116.04 8icy n PHE 320 Ca 0.11 0.00 0.21 0.00 -0.05 0.00 0.00 57.45 57.72 8icy n PHE 320 Cb 0.15 -0.44 0.40 0.00 -0.94 0.00 0.00 39.48 38.65 8icy n PHE 320 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 8icy h ASP 321 N 0.00 0.06 -0.45 4.37 3.32 -1.04 0.13 116.42 122.81 8icy h ASP 321 Ca 0.00 0.23 0.07 0.00 0.02 0.00 0.00 57.03 57.35 8icy h ASP 321 Cb 0.00 0.30 -0.09 0.00 0.22 0.00 0.00 39.33 39.76 8icy h ASP 321 CO 0.00 -0.28 -0.46 1.88 -1.72 0.00 0.00 179.24 178.66 8icy h TYR 322 N 0.12 -1.37 -0.19 4.55 -1.99 -1.34 1.59 116.97 118.34 8icy h TYR 322 Ca 0.68 0.08 0.00 0.00 2.00 0.00 0.00 58.73 61.48 8icy h TYR 322 Cb 1.55 0.66 0.00 0.00 2.00 0.00 0.00 36.73 40.94 8icy h TYR 322 CO -0.21 -0.45 0.00 0.44 -0.00 0.00 0.00 178.16 177.94 8icy n ILE 323 N -5.40 0.26 -3.00 -2.88 -5.35 0.34 -4.94 119.36 98.38 8icy n ILE 323 Ca -0.01 -0.26 -0.06 0.00 -0.27 0.00 0.00 62.75 62.15 8icy n ILE 323 Cb 0.35 0.13 0.01 0.00 -1.74 0.00 0.00 39.64 38.39 8icy n ILE 323 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 8icy n GLN 324 N 0.07 -2.01 -4.02 6.28 10.64 0.54 -4.79 117.38 124.09 8icy n GLN 324 Ca 0.08 1.82 -0.14 0.00 -1.83 0.00 0.00 57.00 56.93 8icy n GLN 324 Cb 0.18 -3.44 -0.02 0.00 -0.86 0.00 0.00 30.24 26.09 8icy n GLN 324 CO 0.00 0.00 0.00 -0.46 -1.83 0.00 0.00 177.06 174.77 8icy s TRP 325 N -1.51 0.87 0.05 2.61 -0.00 -1.22 -4.96 118.94 114.78 8icy s TRP 325 Ca 0.08 -1.21 -0.24 0.00 -0.00 0.00 0.00 56.10 54.73 8icy s TRP 325 Cb -0.01 0.15 -0.06 0.00 -0.00 0.00 0.00 33.47 33.55 8icy s TRP 325 CO 0.51 -1.28 0.73 -1.59 -0.00 0.00 0.00 176.95 175.32 8icy s LYS 326 N -2.74 4.46 0.60 5.86 -2.85 -1.26 -4.50 119.74 119.31 8icy s LYS 326 Ca 0.27 1.00 -0.20 0.00 -1.00 0.00 0.00 55.97 56.04 8icy s LYS 326 Cb -0.02 -3.35 -0.03 0.00 -2.06 0.00 0.00 37.83 32.38 8icy s LYS 326 CO 0.19 0.33 1.33 -0.47 0.10 0.00 0.00 175.35 176.84 8icy s TYR 327 N -0.19 2.16 -0.12 1.78 6.14 -1.26 -4.97 117.35 120.89 8icy s TYR 327 Ca 0.37 1.42 -0.00 0.00 0.64 0.00 0.00 57.07 59.49 8icy s TYR 327 Cb -0.20 -3.76 0.03 0.00 0.42 0.00 0.00 41.96 38.44 8icy s TYR 327 CO 0.22 -2.96 -0.07 1.03 0.64 0.00 0.00 175.55 174.41 8icy s ARG 328 N -3.15 1.49 0.71 4.97 0.52 -1.26 -5.10 118.95 117.13 8icy s ARG 328 Ca 0.77 -0.28 -0.16 0.00 -0.52 0.00 0.00 55.73 55.55 8icy s ARG 328 Cb -0.39 -1.63 0.03 0.00 0.52 0.00 0.00 34.95 33.48 8icy s ARG 328 CO 0.44 -0.29 1.21 -1.21 0.02 0.00 0.00 175.30 175.47 8icy s GLU 329 N 1.71 2.28 0.07 3.54 0.41 -1.26 -4.82 118.70 120.63 8icy s GLU 329 Ca 0.04 1.79 -0.32 0.00 -0.41 0.00 0.00 54.97 56.07 8icy s GLU 329 Cb -0.13 -1.85 -0.18 0.00 -1.78 0.00 0.00 34.13 30.19 8icy s GLU 329 CO -0.08 -1.74 1.63 -1.35 -0.49 0.00 0.00 175.26 173.24 8icy h PRO 330 N -0.09 -0.80 -0.71 0.39 0.11 -1.96 -1.92 132.00 127.02 8icy h PRO 330 Ca -0.48 0.05 0.24 0.00 0.11 0.00 0.00 66.00 65.92 8icy h PRO 330 Cb 1.30 0.18 -0.13 0.00 0.11 0.00 0.00 31.00 32.46 8icy h PRO 330 CO 0.51 -0.53 0.17 1.17 -0.21 0.00 0.00 178.00 179.10 8icy n LYS 331 N -5.45 -0.05 -0.83 1.05 4.81 -1.26 -0.57 118.16 115.86 8icy n LYS 331 Ca -0.13 1.03 -0.05 0.00 -0.87 0.00 0.00 58.31 58.29 8icy n LYS 331 Cb 0.34 -1.72 0.21 0.00 0.02 0.00 0.00 35.03 33.88 8icy n LYS 331 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 8icy n ASP 332 N -4.82 3.02 -1.17 3.14 5.68 -0.83 -4.65 116.55 116.91 8icy n ASP 332 Ca 0.21 -3.60 0.04 0.00 -0.50 0.00 0.00 54.79 50.94 8icy n ASP 332 Cb 0.70 -0.66 0.22 0.00 -1.14 0.00 0.00 41.12 40.24 8icy n ASP 332 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 8icy n ARG 333 N -0.98 2.92 -0.66 0.11 5.12 0.27 -4.64 116.66 118.80 8icy n ARG 333 Ca 0.36 -1.70 0.50 0.00 -1.93 0.00 0.00 57.85 55.08 8icy n ARG 333 Cb 1.13 -1.80 0.77 0.00 -1.16 0.00 0.00 32.46 31.40 8icy n ARG 333 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 8icy n SER 334 N 0.43 0.00 0.00 0.55 7.64 -1.26 -3.29 113.62 117.68 8icy n SER 334 Ca 0.15 0.95 0.00 0.00 1.01 0.00 0.00 58.87 60.98 8icy n SER 334 Cb 0.69 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.42 8icy n SER 334 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19