#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mby h LEU 11 N 0.00 0.99 -3.97 -4.42 3.38 -1.92 -3.14 115.31 106.22 3mby h LEU 11 Ca 0.00 -0.02 -0.48 0.00 0.09 0.00 0.00 57.88 57.47 3mby h LEU 11 Cb 0.00 -0.24 -0.41 0.00 0.09 0.00 0.00 40.66 40.10 3mby h LEU 11 CO 0.00 0.71 -0.86 0.59 0.09 0.00 0.00 178.44 178.97 3mby n ASN 12 N -4.41 4.29 -0.35 -0.43 3.02 -1.26 -4.76 115.26 111.35 3mby n ASN 12 Ca 0.10 -3.48 0.07 0.00 -0.03 0.00 0.00 54.58 51.24 3mby n ASN 12 Cb 0.04 -0.37 0.23 0.00 -0.61 0.00 0.00 39.78 39.07 3mby n ASN 12 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3mby h GLY 13 N 2.20 1.59 0.89 7.41 0.00 -1.96 -1.36 103.07 111.85 3mby h GLY 13 Ca 0.28 -0.40 0.02 0.00 0.00 0.00 0.00 47.33 47.23 3mby h GLY 13 CO 0.64 0.14 0.33 -1.33 0.00 0.00 0.00 176.54 176.32 3mby h GLY 14 N 0.95 0.76 0.72 4.60 0.00 -1.89 -0.80 103.07 107.41 3mby h GLY 14 Ca 0.49 -0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.52 3mby h GLY 14 CO -0.27 0.21 -0.11 -2.22 0.00 0.00 0.00 176.54 174.16 3mby h ILE 15 N 0.65 1.34 -0.41 2.60 2.04 -1.79 -2.46 117.51 119.47 3mby h ILE 15 Ca 0.21 -1.23 -0.05 0.00 1.00 0.00 0.00 64.86 64.80 3mby h ILE 15 Cb 0.01 1.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 3mby h ILE 15 CO -0.09 0.36 0.06 0.71 0.00 0.00 0.00 178.15 179.19 3mby h THR 16 N -0.06 1.20 -0.53 -0.27 1.35 -1.16 -1.24 112.91 112.19 3mby h THR 16 Ca 0.02 -0.76 -0.10 0.00 -0.55 0.00 0.00 66.41 65.02 3mby h THR 16 Cb 0.61 0.83 -0.02 0.00 -1.73 0.00 0.00 68.15 67.84 3mby h THR 16 CO 0.03 0.27 -0.06 0.44 -0.25 0.00 0.00 175.52 175.95 3mby h ASP 17 N 0.61 0.97 -0.50 5.36 3.32 -1.15 -0.70 116.42 124.32 3mby h ASP 17 Ca 0.13 -0.33 0.01 0.00 0.02 0.00 0.00 57.03 56.86 3mby h ASP 17 Cb 0.29 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 3mby h ASP 17 CO 0.00 1.07 0.33 -0.03 -1.72 0.00 0.00 179.24 178.90 3mby h MET 18 N 0.85 0.66 -0.30 3.56 1.85 -0.92 -0.14 114.93 120.49 3mby h MET 18 Ca 0.14 -0.04 -0.12 0.00 -0.61 0.00 0.00 59.70 59.08 3mby h MET 18 Cb 0.61 -0.15 -0.01 0.00 0.43 0.00 0.00 31.60 32.48 3mby h MET 18 CO 0.04 0.44 -0.30 -0.07 -0.40 0.00 0.00 176.91 176.61 3mby h LEU 19 N 0.68 0.66 -0.46 3.39 3.38 -1.10 -1.81 115.31 120.04 3mby h LEU 19 Ca 0.19 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 3mby h LEU 19 Cb -0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3mby h LEU 19 CO -0.04 0.92 -0.02 0.74 0.09 0.00 0.00 178.44 180.12 3mby h THR 20 N 0.54 1.26 -0.55 0.22 2.02 -0.68 0.20 112.91 115.92 3mby h THR 20 Ca 0.07 -1.09 -0.02 0.00 0.77 0.00 0.00 66.41 66.14 3mby h THR 20 Cb 0.79 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 68.23 3mby h THR 20 CO 0.06 0.38 0.28 -0.08 0.37 0.00 0.00 175.52 176.53 3mby h GLU 21 N 0.67 0.79 -0.46 6.66 4.81 -0.87 0.14 114.58 126.33 3mby h GLU 21 Ca 0.13 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3mby h GLU 21 Cb 0.53 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 3mby h GLU 21 CO 0.03 0.64 0.23 -0.07 -0.73 0.00 0.00 179.01 179.11 3mby h LEU 22 N 0.74 0.59 -0.27 1.64 3.38 -1.11 -0.31 115.31 119.98 3mby h LEU 22 Ca 0.19 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.09 3mby h LEU 22 Cb 0.10 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 3mby h LEU 22 CO -0.03 0.53 0.03 0.00 0.09 0.00 0.00 178.44 179.07 3mby h ALA 23 N 1.08 0.26 -0.72 1.53 0.00 -0.05 -1.06 119.26 120.30 3mby h ALA 23 Ca 0.16 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3mby h ALA 23 Cb 0.09 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 3mby h ALA 23 CO -0.02 -0.38 0.45 -0.91 0.00 0.00 0.00 179.25 178.38 3mby h ASN 24 N 0.13 0.85 -0.12 0.00 2.35 -0.32 -1.76 115.58 116.69 3mby h ASN 24 Ca 0.12 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 3mby h ASN 24 Cb 0.14 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 3mby h ASN 24 CO -0.18 0.64 0.05 0.15 -1.65 0.00 0.00 177.43 176.43 3mby h PHE 25 N 0.98 0.19 -0.91 1.19 3.04 -0.31 -0.37 116.94 120.75 3mby h PHE 25 Ca 0.26 -0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.19 3mby h PHE 25 Cb -0.06 -0.06 -0.04 0.00 2.56 0.00 0.00 35.95 38.35 3mby h PHE 25 CO 0.00 0.29 0.55 0.93 -2.02 0.00 0.00 178.31 178.05 3mby h GLU 26 N 0.04 1.23 0.22 1.11 4.39 -0.86 0.48 114.58 121.18 3mby h GLU 26 Ca 0.04 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 3mby h GLU 26 Cb 0.18 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 28.57 3mby h GLU 26 CO -0.00 0.86 -0.11 -0.22 -1.16 0.00 0.00 179.01 178.38 3mby h LYS 27 N 1.25 -0.29 -0.06 2.33 3.64 -1.20 0.32 116.57 122.56 3mby h LYS 27 Ca 0.33 0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.58 3mby h LYS 27 Cb -0.06 0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3mby h LYS 27 CO -0.06 0.09 -0.55 -0.91 -2.27 0.00 0.00 179.45 175.76 3mby h ASN 28 N -0.85 0.58 0.00 4.20 2.35 -1.06 -3.13 115.58 117.67 3mby h ASN 28 Ca -0.03 -0.69 -0.19 0.00 -0.55 0.00 0.00 56.30 54.84 3mby h ASN 28 Cb 0.51 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.68 3mby h ASN 28 CO 0.05 1.19 -1.24 0.52 -1.65 0.00 0.00 177.43 176.29 3mby n VAL 29 N -4.23 1.50 0.21 2.81 0.31 0.13 -4.48 118.33 114.57 3mby n VAL 29 Ca -0.09 -0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.34 3mby n VAL 29 Cb 0.63 -2.13 0.22 0.00 -0.91 0.00 0.00 33.84 31.65 3mby n VAL 29 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3mby h SER 30 N -1.00 0.00 -5.86 4.52 0.02 -1.37 -3.48 113.55 106.39 3mby h SER 30 Ca -0.29 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.28 3mby h SER 30 Cb 1.12 0.00 0.12 0.00 0.14 0.00 0.00 62.40 63.78 3mby h SER 30 CO -0.17 0.14 -0.76 0.00 -1.14 0.00 0.00 176.83 174.89 3mby n GLN 31 N -3.15 -6.44 -3.91 3.45 6.02 0.87 -4.95 117.38 109.27 3mby n GLN 31 Ca 0.03 0.77 -0.30 0.00 -0.01 0.00 0.00 57.00 57.49 3mby n GLN 31 Cb 0.54 -5.68 -0.13 0.00 1.02 0.00 0.00 30.24 26.00 3mby n GLN 31 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3mby s ALA 32 N -3.42 3.52 0.41 -1.58 0.00 0.32 -4.98 121.76 116.04 3mby s ALA 32 Ca 0.20 -3.48 0.21 0.00 0.00 0.00 0.00 51.96 48.89 3mby s ALA 32 Cb -0.09 -2.22 1.18 0.00 0.00 0.00 0.00 23.12 21.99 3mby s ALA 32 CO 0.76 -2.06 2.00 0.97 0.00 0.00 0.00 175.76 177.43 3mby h ILE 33 N 5.08 0.85 0.00 0.00 6.09 -1.90 -1.73 117.51 125.91 3mby h ILE 33 Ca 0.00 -0.69 -0.16 0.00 -1.37 0.00 0.00 64.86 62.64 3mby h ILE 33 Cb 0.85 1.41 -0.02 0.00 0.47 0.00 0.00 36.82 39.52 3mby h ILE 33 CO 0.71 0.18 -0.77 0.45 -3.07 0.00 0.00 178.15 175.64 3mby h HIS 34 N 0.00 0.00 -0.04 2.19 3.86 -1.96 -1.09 115.15 118.10 3mby h HIS 34 Ca -0.00 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.02 3mby h HIS 34 Cb 0.39 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 3mby h HIS 34 CO 0.00 0.77 -0.78 0.87 0.86 0.00 0.00 177.93 179.65 3mby h LYS 35 N 0.00 0.32 0.31 2.45 1.57 -1.84 -1.09 116.57 118.29 3mby h LYS 35 Ca -0.01 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.47 3mby h LYS 35 Cb 1.36 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.74 3mby h LYS 35 CO 0.10 0.95 -0.15 -0.92 -0.57 0.00 0.00 179.45 178.87 3mby h TYR 36 N 0.21 -0.38 -0.57 -1.35 3.20 -1.07 -1.31 116.97 115.70 3mby h TYR 36 Ca -0.04 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 3mby h TYR 36 Cb 1.36 0.13 -0.03 0.00 1.54 0.00 0.00 36.73 39.73 3mby h TYR 36 CO 0.04 -0.21 0.23 -0.91 -1.64 0.00 0.00 178.16 175.67 3mby h ASN 37 N -0.45 0.75 0.17 -2.11 2.35 -1.17 -1.78 115.58 113.33 3mby h ASN 37 Ca -0.04 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.61 3mby h ASN 37 Cb 0.34 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.52 3mby h ASN 37 CO 0.07 0.67 -0.10 0.00 -1.65 0.00 0.00 177.43 176.42 3mby h ALA 38 N 1.44 -0.24 -0.85 -0.83 0.00 -0.90 -0.23 119.26 117.65 3mby h ALA 38 Ca 0.19 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3mby h ALA 38 Cb 0.15 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 3mby h ALA 38 CO -0.02 -0.64 0.49 1.88 0.00 0.00 0.00 179.25 180.96 3mby h TYR 39 N -0.25 1.13 -0.46 0.00 0.05 -0.98 -1.67 116.97 114.79 3mby h TYR 39 Ca -0.02 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.65 3mby h TYR 39 Cb 0.21 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 37.56 3mby h TYR 39 CO -0.08 0.76 -0.14 0.00 -1.05 0.00 0.00 178.16 177.65 3mby h ARG 40 N 1.18 0.86 -0.50 4.88 3.08 -1.05 -0.58 114.38 122.24 3mby h ARG 40 Ca 0.30 -0.31 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 3mby h ARG 40 Cb -0.02 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 3mby h ARG 40 CO -0.05 0.95 0.12 -0.22 -1.07 0.00 0.00 179.97 179.70 3mby h LYS 41 N 0.76 0.80 -0.42 0.04 3.64 -0.63 0.59 116.57 121.35 3mby h LYS 41 Ca 0.12 -0.19 -0.04 0.00 -1.27 0.00 0.00 60.65 59.27 3mby h LYS 41 Cb 0.66 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 3mby h LYS 41 CO 0.05 0.77 0.11 0.00 -2.27 0.00 0.00 179.45 178.11 3mby h ALA 42 N 1.00 0.56 -0.52 5.00 0.00 -1.14 -0.79 119.26 123.37 3mby h ALA 42 Ca 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3mby h ALA 42 Cb 0.33 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3mby h ALA 42 CO 0.00 0.23 0.34 0.00 0.00 0.00 0.00 179.25 179.82 3mby h ALA 43 N 0.97 0.66 0.03 0.00 0.00 -0.89 -1.03 119.26 118.98 3mby h ALA 43 Ca 0.13 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3mby h ALA 43 Cb 0.30 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3mby h ALA 43 CO -0.00 0.12 -0.01 1.03 0.00 0.00 0.00 179.25 180.38 3mby h SER 44 N 0.70 -0.03 0.03 0.00 0.87 -0.58 0.11 113.55 114.65 3mby h SER 44 Ca 0.19 -0.08 -0.06 0.00 -1.23 0.00 0.00 61.79 60.62 3mby h SER 44 Cb -0.06 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 3mby h SER 44 CO -0.04 0.06 -0.16 1.62 -0.53 0.00 0.00 176.83 177.78 3mby h VAL 45 N -0.11 1.20 -0.11 2.23 3.04 -1.00 -2.27 116.25 119.22 3mby h VAL 45 Ca -0.00 -0.88 -0.19 0.00 -1.01 0.00 0.00 66.70 64.61 3mby h VAL 45 Cb 0.10 1.26 -0.00 0.00 -2.01 0.00 0.00 31.29 30.64 3mby h VAL 45 CO 0.01 0.27 -0.71 0.40 -1.01 0.00 0.00 177.57 176.53 3mby h ILE 46 N 0.24 1.34 -0.20 3.17 2.04 -0.97 -2.96 117.51 120.19 3mby h ILE 46 Ca 0.05 -2.04 -0.01 0.00 1.00 0.00 0.00 64.86 63.85 3mby h ILE 46 Cb 0.43 2.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.52 3mby h ILE 46 CO 0.03 0.63 0.05 0.00 0.00 0.00 0.00 178.15 178.86 3mby h ALA 47 N 0.85 1.73 -0.02 1.87 0.00 -0.20 -2.27 119.26 121.23 3mby h ALA 47 Ca -0.03 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3mby h ALA 47 Cb 1.30 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3mby h ALA 47 CO 0.13 0.21 -0.22 0.36 0.00 0.00 0.00 179.25 179.73 3mby n LYS 48 N -4.43 1.36 -1.99 0.00 2.85 -1.07 -4.87 118.16 110.00 3mby n LYS 48 Ca -0.00 -0.97 -0.42 0.00 -1.05 0.00 0.00 58.31 55.87 3mby n LYS 48 Cb 0.14 -1.48 -0.03 0.00 -0.65 0.00 0.00 35.03 33.01 3mby n LYS 48 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 177.40 176.88 3mby s TYR 49 N -2.31 2.12 -1.80 5.58 5.04 -0.86 -4.88 117.35 120.24 3mby s TYR 49 Ca 0.26 0.25 0.00 0.00 -2.44 0.00 0.00 57.07 55.14 3mby s TYR 49 Cb 0.19 -3.92 0.00 0.00 0.35 0.00 0.00 41.96 38.59 3mby s TYR 49 CO 0.46 -3.81 0.56 -0.35 -1.34 0.00 0.00 175.55 171.07 3mby n PRO 50 N 6.66 0.62 -4.24 4.97 -0.04 -1.26 -4.80 135.00 136.91 3mby n PRO 50 Ca 0.17 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.44 3mby n PRO 50 Cb 0.42 -1.06 -0.13 0.00 -0.04 0.00 0.00 33.50 32.69 3mby n PRO 50 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3mby s HIS 51 N -1.80 1.17 -0.42 0.54 3.76 -1.26 -5.09 115.29 112.19 3mby s HIS 51 Ca 0.00 -0.41 -0.29 0.00 -0.15 0.00 0.00 55.06 54.22 3mby s HIS 51 Cb 0.00 -0.68 0.01 0.00 1.11 0.00 0.00 32.58 33.02 3mby s HIS 51 CO 0.00 0.04 1.43 0.21 -0.85 0.00 0.00 174.74 175.56 3mby s LYS 52 N -1.42 3.54 0.14 1.40 2.20 -1.26 -4.82 119.74 119.52 3mby s LYS 52 Ca -0.01 0.91 -0.33 0.00 -0.36 0.00 0.00 55.97 56.18 3mby s LYS 52 Cb -0.09 -4.04 -0.13 0.00 -1.51 0.00 0.00 37.83 32.06 3mby s LYS 52 CO 0.02 -1.61 1.68 -0.89 -0.36 0.00 0.00 175.35 174.18 3mby n ILE 53 N 7.09 0.10 0.51 5.43 5.41 -1.26 -4.92 119.36 131.72 3mby n ILE 53 Ca 0.16 -0.02 0.10 0.00 1.00 0.00 0.00 62.75 63.99 3mby n ILE 53 Cb 0.48 -1.76 -0.13 0.00 -0.71 0.00 0.00 39.64 37.52 3mby n ILE 53 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 3mby n LYS 54 N 4.15 0.51 -3.58 0.38 5.02 -1.26 -5.04 118.16 118.34 3mby n LYS 54 Ca 0.17 -0.08 -0.08 0.00 -2.02 0.00 0.00 58.31 56.30 3mby n LYS 54 Cb 0.31 -1.46 -0.02 0.00 -0.02 0.00 0.00 35.03 33.84 3mby n LYS 54 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3mby s SER 55 N -3.55 -0.37 0.25 4.39 1.04 -1.26 -5.02 113.70 109.18 3mby s SER 55 Ca 0.01 -0.16 -0.04 0.00 0.48 0.00 0.00 55.95 56.24 3mby s SER 55 Cb 0.14 0.51 0.31 0.00 0.10 0.00 0.00 66.02 67.08 3mby s SER 55 CO 0.84 -0.87 1.82 1.23 0.98 0.00 0.00 173.24 177.24 3mby h GLY 56 N 2.00 1.08 0.82 7.32 0.00 -1.86 -2.00 103.07 110.43 3mby h GLY 56 Ca -0.25 -0.59 0.04 0.00 0.00 0.00 0.00 47.33 46.53 3mby h GLY 56 CO 0.31 0.55 0.38 0.00 0.00 0.00 0.00 176.54 177.78 3mby h ALA 57 N 1.29 0.84 -0.26 3.60 0.00 -1.96 0.26 119.26 123.03 3mby h ALA 57 Ca 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3mby h ALA 57 Cb 0.22 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3mby h ALA 57 CO -0.02 0.11 0.14 1.49 0.00 0.00 0.00 179.25 180.98 3mby h GLU 58 N 0.74 0.36 -0.78 0.00 4.81 -1.85 -2.78 114.58 115.08 3mby h GLU 58 Ca 0.27 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.40 3mby h GLU 58 Cb 0.07 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 3mby h GLU 58 CO -0.12 0.33 0.30 0.00 -0.73 0.00 0.00 179.01 178.78 3mby h ALA 59 N 1.01 1.05 0.00 2.92 0.00 -0.78 -2.58 119.26 120.89 3mby h ALA 59 Ca 0.09 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3mby h ALA 59 Cb 0.07 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3mby h ALA 59 CO -0.01 0.66 0.04 -0.22 0.00 0.00 0.00 179.25 179.71 3mby h LYS 60 N 1.14 0.00 0.00 0.00 3.64 -0.22 -0.27 116.57 120.86 3mby h LYS 60 Ca 0.26 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 3mby h LYS 60 Cb 0.23 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 3mby h LYS 60 CO -0.02 0.00 -0.03 0.87 -2.27 0.00 0.00 179.45 178.00 3mby h LYS 61 N 0.00 0.00 -6.77 1.90 1.57 -1.41 -3.44 116.57 108.41 3mby h LYS 61 Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 3mby h LYS 61 Cb 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 3mby h LYS 61 CO 0.00 0.03 0.32 -0.51 -0.57 0.00 0.00 179.45 178.73 3mby s LEU 62 N -6.27 4.52 -0.13 2.94 1.43 -0.11 -4.99 118.68 116.07 3mby s LEU 62 Ca 0.02 1.86 -0.29 0.00 -1.03 0.00 0.00 54.13 54.69 3mby s LEU 62 Cb 0.08 -3.74 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 3mby s LEU 62 CO 0.58 0.07 1.66 -2.16 0.23 0.00 0.00 176.35 176.73 3mby s PRO 63 N -1.54 3.99 0.00 1.29 0.04 -1.26 -2.12 135.00 135.40 3mby s PRO 63 Ca 0.44 1.97 0.00 0.00 0.04 0.00 0.00 61.00 63.45 3mby s PRO 63 Cb -0.23 -4.02 0.00 0.00 0.04 0.00 0.00 34.50 30.30 3mby s PRO 63 CO 0.28 -1.07 0.00 0.41 0.04 0.00 0.00 177.00 176.66 3mby n GLY 64 N 4.40 2.24 3.53 0.56 0.00 -1.26 -4.86 105.19 109.80 3mby n GLY 64 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 3mby n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mby s VAL 65 N -2.06 5.03 0.00 1.61 1.01 -0.90 -4.41 120.40 120.69 3mby s VAL 65 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 61.89 3mby s VAL 65 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.91 3mby s VAL 65 CO 0.00 0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.87 3mby n GLY 66 N 5.04 4.43 0.17 4.51 0.00 -1.26 -4.60 105.19 113.48 3mby n GLY 66 Ca -0.14 -2.06 -0.14 0.00 0.00 0.00 0.00 46.02 43.68 3mby n GLY 66 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3mby h THR 67 N 0.09 0.73 -0.04 2.61 2.02 -1.97 -1.59 112.91 114.75 3mby h THR 67 Ca 0.00 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 3mby h THR 67 Cb 0.00 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 3mby h THR 67 CO 0.00 0.00 -0.14 0.11 0.37 0.00 0.00 175.52 175.86 3mby h LYS 68 N -0.34 -0.20 -0.22 6.66 1.79 -1.99 -0.59 116.57 121.67 3mby h LYS 68 Ca -0.03 0.01 -0.06 0.00 -2.18 0.00 0.00 60.65 58.39 3mby h LYS 68 Cb 0.27 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.96 3mby h LYS 68 CO 0.04 -0.13 -0.15 0.82 -1.08 0.00 0.00 179.45 178.95 3mby h ILE 69 N -0.21 1.22 -0.61 1.86 2.04 -1.95 -1.66 117.51 118.20 3mby h ILE 69 Ca 0.06 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 64.93 3mby h ILE 69 Cb 0.29 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 3mby h ILE 69 CO -0.16 0.31 0.26 0.00 0.00 0.00 0.00 178.15 178.56 3mby h ALA 70 N 1.51 0.79 -0.76 1.87 0.00 -0.69 0.65 119.26 122.63 3mby h ALA 70 Ca 0.07 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3mby h ALA 70 Cb 0.47 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3mby h ALA 70 CO 0.03 0.38 0.29 0.93 0.00 0.00 0.00 179.25 180.88 3mby h GLU 71 N 0.84 1.14 -0.49 0.00 5.08 -0.53 -2.06 114.58 118.56 3mby h GLU 71 Ca 0.21 -0.21 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 3mby h GLU 71 Cb 0.17 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 3mby h GLU 71 CO -0.02 0.93 -0.12 0.87 -1.00 0.00 0.00 179.01 179.67 3mby h LYS 72 N 1.11 0.91 -0.84 2.33 1.57 -0.80 -2.34 116.57 118.50 3mby h LYS 72 Ca 0.25 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 3mby h LYS 72 Cb 0.23 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 3mby h LYS 72 CO -0.02 0.98 0.41 0.82 -0.57 0.00 0.00 179.45 181.07 3mby h ILE 73 N 0.81 1.26 -0.55 1.86 2.04 -0.53 -0.44 117.51 121.96 3mby h ILE 73 Ca 0.13 -0.72 -0.05 0.00 1.00 0.00 0.00 64.86 65.22 3mby h ILE 73 Cb 0.65 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3mby h ILE 73 CO 0.05 0.31 0.14 0.44 0.00 0.00 0.00 178.15 179.08 3mby h ASP 74 N 1.20 0.83 -0.42 1.72 3.32 -1.12 0.37 116.42 122.32 3mby h ASP 74 Ca 0.29 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3mby h ASP 74 Cb 0.11 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 3mby h ASP 74 CO -0.04 0.84 0.24 -0.08 -1.72 0.00 0.00 179.24 178.49 3mby h GLU 75 N 0.77 0.58 -0.59 3.56 4.81 -1.01 -1.00 114.58 121.70 3mby h GLU 75 Ca 0.17 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 3mby h GLU 75 Cb 0.33 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 3mby h GLU 75 CO 0.00 0.45 0.31 0.35 -0.73 0.00 0.00 179.01 179.38 3mby h PHE 76 N 0.55 0.83 -0.49 0.92 3.57 -0.82 -0.26 116.94 121.23 3mby h PHE 76 Ca 0.15 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 3mby h PHE 76 Cb 0.03 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.48 3mby h PHE 76 CO -0.03 0.62 0.01 -0.07 -2.23 0.00 0.00 178.31 176.61 3mby h LEU 77 N 0.80 0.78 -0.10 0.59 3.38 -0.66 0.80 115.31 120.90 3mby h LEU 77 Ca 0.21 -0.18 -0.23 0.00 0.09 0.00 0.00 57.88 57.76 3mby h LEU 77 Cb 0.08 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 3mby h LEU 77 CO -0.03 0.84 -1.02 0.00 0.09 0.00 0.00 178.44 178.32 3mby h ALA 78 N 1.25 0.33 0.00 1.53 0.00 -0.89 -3.39 119.26 118.09 3mby h ALA 78 Ca 0.15 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3mby h ALA 78 Cb 0.44 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3mby h ALA 78 CO 0.02 0.92 -0.29 0.25 0.00 0.00 0.00 179.25 180.15 3mby n THR 79 N -3.62 0.00 -1.00 0.00 -2.24 -0.13 -5.00 114.28 102.28 3mby n THR 79 Ca -0.06 -0.37 -0.00 0.00 -2.27 0.00 0.00 64.05 61.35 3mby n THR 79 Cb 0.89 0.89 -0.00 0.00 -2.10 0.00 0.00 70.33 70.01 3mby n THR 79 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mby n GLY 80 N 1.32 0.40 3.44 3.38 0.00 0.28 -4.97 105.19 109.03 3mby n GLY 80 Ca 0.00 -0.02 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 3mby n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mby s LYS 81 N -0.49 1.49 -0.19 1.61 1.02 -1.25 -5.02 119.74 116.90 3mby s LYS 81 Ca 0.00 -1.46 -0.03 0.00 0.02 0.00 0.00 55.97 54.50 3mby s LYS 81 Cb 0.00 0.40 0.06 0.00 -0.52 0.00 0.00 37.83 37.77 3mby s LYS 81 CO 0.00 -0.58 0.05 -1.17 -0.92 0.00 0.00 175.35 172.73 3mby s LEU 82 N -3.10 1.02 0.26 3.17 2.96 -1.26 -3.52 118.68 118.21 3mby s LEU 82 Ca 0.29 -0.78 -0.01 0.00 -0.22 0.00 0.00 54.13 53.41 3mby s LEU 82 Cb 0.02 -0.52 0.54 0.00 0.50 0.00 0.00 46.19 46.72 3mby s LEU 82 CO 0.12 -0.32 1.76 0.03 -1.32 0.00 0.00 176.35 176.62 3mby h ARG 83 N 8.28 0.58 -0.85 1.98 3.08 -1.98 0.49 114.38 125.97 3mby h ARG 83 Ca -0.16 -0.04 0.12 0.00 0.07 0.00 0.00 59.98 59.97 3mby h ARG 83 Cb 1.13 -0.13 -0.06 0.00 0.08 0.00 0.00 29.97 30.98 3mby h ARG 83 CO 0.33 0.39 0.55 -0.22 -1.07 0.00 0.00 179.97 179.94 3mby h LYS 84 N 0.60 0.70 0.14 0.04 3.64 -2.00 -0.28 116.57 119.41 3mby h LYS 84 Ca 0.46 -0.04 -0.28 0.00 -1.27 0.00 0.00 60.65 59.52 3mby h LYS 84 Cb 0.67 -0.16 0.01 0.00 -0.41 0.00 0.00 32.23 32.34 3mby h LYS 84 CO -0.37 0.46 -1.28 -0.07 -2.27 0.00 0.00 179.45 175.92 3mby h LEU 85 N 0.72 0.46 -1.21 5.20 3.38 -1.42 -2.86 115.31 119.58 3mby h LEU 85 Ca 0.41 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3mby h LEU 85 Cb 0.57 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 3mby h LEU 85 CO -0.17 1.40 0.48 -0.33 0.09 0.00 0.00 178.44 179.91 3mby h GLU 86 N 0.08 1.01 0.01 1.13 4.39 0.18 0.10 114.58 121.49 3mby h GLU 86 Ca -0.15 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.47 3mby h GLU 86 Cb 2.00 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 30.42 3mby h GLU 86 CO 0.21 0.69 -0.00 -0.22 -1.16 0.00 0.00 179.01 178.52 3mby h LYS 87 N 1.04 -0.01 -0.70 2.33 3.11 -1.14 -3.00 116.57 118.19 3mby h LYS 87 Ca 0.28 0.00 0.09 0.00 -2.81 0.00 0.00 60.65 58.21 3mby h LYS 87 Cb -0.08 0.00 -0.07 0.00 -1.00 0.00 0.00 32.23 31.08 3mby h LYS 87 CO -0.06 0.33 0.35 0.82 -2.81 0.00 0.00 179.45 178.08 3mby h ILE 88 N -0.35 0.86 -0.07 2.00 2.04 -1.21 0.02 117.51 120.80 3mby h ILE 88 Ca -0.00 -0.21 0.02 0.00 1.00 0.00 0.00 64.86 65.67 3mby h ILE 88 Cb 0.35 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.62 3mby h ILE 88 CO 0.00 0.11 0.09 0.03 0.00 0.00 0.00 178.15 178.38 3mby h ARG 89 N 0.61 0.00 0.00 2.37 3.08 -0.89 -1.76 114.38 117.78 3mby h ARG 89 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 3mby h ARG 89 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.40 3mby h ARG 89 CO -0.26 0.00 -1.17 1.04 -1.07 0.00 0.00 179.97 178.51 3mby n GLN 90 N -3.70 0.51 -2.30 0.04 1.13 -0.06 -4.84 117.38 108.16 3mby n GLN 90 Ca -0.01 0.03 -0.43 0.00 -1.94 0.00 0.00 57.00 54.65 3mby n GLN 90 Cb 0.18 -1.70 -0.02 0.00 0.11 0.00 0.00 30.24 28.81 3mby n GLN 90 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3mby s ASP 91 N -4.74 6.53 0.24 1.08 2.15 -0.66 -4.91 116.67 116.37 3mby s ASP 91 Ca -0.00 1.32 -0.06 0.00 0.43 0.00 0.00 52.55 54.24 3mby s ASP 91 Cb 0.12 -2.54 0.25 0.00 -0.30 0.00 0.00 42.92 40.45 3mby s ASP 91 CO 0.81 -1.18 1.88 0.44 -0.17 0.00 0.00 175.17 176.95 3mby h ASP 92 N 9.98 1.11 -0.34 -0.34 3.32 -1.88 -0.52 116.42 127.75 3mby h ASP 92 Ca -0.29 -0.08 -0.04 0.00 0.02 0.00 0.00 57.03 56.65 3mby h ASP 92 Cb 1.12 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 3mby h ASP 92 CO 1.03 0.87 0.07 0.74 -1.72 0.00 0.00 179.24 180.22 3mby h THR 93 N 1.27 1.23 -0.45 0.35 2.02 -1.95 0.15 112.91 115.52 3mby h THR 93 Ca 0.33 -0.79 -0.08 0.00 0.77 0.00 0.00 66.41 66.64 3mby h THR 93 Cb -0.03 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 3mby h THR 93 CO -0.06 0.26 -0.04 0.28 0.37 0.00 0.00 175.52 176.33 3mby h SER 94 N 0.39 0.74 -0.52 4.18 0.02 -1.83 -1.19 113.55 115.34 3mby h SER 94 Ca 0.10 -0.19 -0.12 0.00 -0.84 0.00 0.00 61.79 60.74 3mby h SER 94 Cb 0.33 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 3mby h SER 94 CO 0.00 0.84 -0.15 0.28 -1.14 0.00 0.00 176.83 176.66 3mby h SER 95 N 0.71 1.03 -0.23 3.07 0.02 -0.80 -0.81 113.55 116.54 3mby h SER 95 Ca 0.13 -0.36 -0.05 0.00 -0.84 0.00 0.00 61.79 60.67 3mby h SER 95 Cb 0.50 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 3mby h SER 95 CO 0.03 1.16 -0.05 0.28 -1.14 0.00 0.00 176.83 177.10 3mby h SER 96 N 0.90 0.44 -0.37 3.07 0.02 -0.46 -1.87 113.55 115.28 3mby h SER 96 Ca 0.13 -0.36 -0.02 0.00 -0.84 0.00 0.00 61.79 60.70 3mby h SER 96 Cb 0.72 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 3mby h SER 96 CO 0.06 0.70 0.16 0.40 -1.14 0.00 0.00 176.83 177.01 3mby h ILE 97 N 0.17 1.18 -0.84 3.27 2.04 -1.17 -1.09 117.51 121.06 3mby h ILE 97 Ca 0.06 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 3mby h ILE 97 Cb 0.51 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 3mby h ILE 97 CO 0.02 0.19 0.48 0.78 0.00 0.00 0.00 178.15 179.62 3mby h ASN 98 N 0.45 1.02 0.20 1.72 2.35 -1.11 -2.25 115.58 117.97 3mby h ASN 98 Ca 0.12 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 3mby h ASN 98 Cb 0.15 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.26 3mby h ASN 98 CO -0.01 0.80 -0.10 0.15 -1.65 0.00 0.00 177.43 176.63 3mby h PHE 99 N 1.16 -0.25 -0.72 1.19 3.57 -0.97 -3.15 116.94 117.78 3mby h PHE 99 Ca 0.30 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.90 3mby h PHE 99 Cb -0.01 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 38.76 3mby h PHE 99 CO 0.01 0.05 0.47 -0.07 -2.23 0.00 0.00 178.31 176.54 3mby h LEU 100 N -0.54 0.51 0.00 0.59 3.38 -1.07 -0.51 115.31 117.67 3mby h LEU 100 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3mby h LEU 100 Cb 0.40 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3mby h LEU 100 CO 0.04 0.30 0.00 0.35 0.09 0.00 0.00 178.44 179.23 3mby n THR 101 N -4.49 0.94 0.69 0.22 -2.24 -0.86 -1.96 114.28 106.59 3mby n THR 101 Ca 0.12 0.24 0.12 0.00 -2.27 0.00 0.00 64.05 62.26 3mby n THR 101 Cb 0.37 -1.02 0.47 0.00 -2.10 0.00 0.00 70.33 68.06 3mby n THR 101 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3mby n ARG 102 N -1.42 0.13 -2.94 -0.78 1.74 -0.20 -4.68 116.66 108.51 3mby n ARG 102 Ca 0.04 0.19 -0.41 0.00 -0.77 0.00 0.00 57.85 56.90 3mby n ARG 102 Cb 0.13 -1.67 -0.04 0.00 -1.02 0.00 0.00 32.46 29.86 3mby n ARG 102 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3mby s VAL 103 N -3.09 4.95 0.17 1.55 1.01 -0.83 -5.00 120.40 119.16 3mby s VAL 103 Ca 0.10 1.59 -0.32 0.00 0.00 0.00 0.00 61.98 63.35 3mby s VAL 103 Cb 0.13 -4.11 -0.11 0.00 0.00 0.00 0.00 36.38 32.30 3mby s VAL 103 CO 0.49 0.13 1.65 -0.55 0.00 0.00 0.00 175.10 176.82 3mby s SER 104 N 1.01 6.50 0.00 3.32 0.15 -1.26 -1.65 113.70 121.77 3mby s SER 104 Ca 0.39 2.71 0.00 0.00 0.70 0.00 0.00 55.95 59.75 3mby s SER 104 Cb -0.17 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 3mby s SER 104 CO 0.16 -0.90 0.00 0.61 1.20 0.00 0.00 173.24 174.32 3mby n GLY 105 N 3.88 2.76 3.48 9.45 0.00 -1.26 -3.96 105.19 119.54 3mby n GLY 105 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 3mby n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mby s ILE 106 N -2.63 5.09 0.00 -0.61 1.01 -0.66 -4.75 121.20 118.65 3mby s ILE 106 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.30 3mby s ILE 106 Cb 0.00 -4.04 0.00 0.00 0.01 0.00 0.00 42.46 38.43 3mby s ILE 106 CO 0.00 -0.43 0.00 0.61 0.00 0.00 0.00 174.94 175.12 3mby n GLY 107 N 5.11 1.99 0.29 6.18 0.00 -1.26 -4.32 105.19 113.18 3mby n GLY 107 Ca -0.07 -2.13 0.04 0.00 0.00 0.00 0.00 46.02 43.86 3mby n GLY 107 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3mby h PRO 108 N 0.00 0.56 0.18 1.61 0.11 -1.87 -0.03 132.00 132.56 3mby h PRO 108 Ca 0.00 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 3mby h PRO 108 Cb 0.00 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 30.98 3mby h PRO 108 CO 0.00 0.37 -0.09 1.03 -0.21 0.00 0.00 178.00 179.11 3mby h SER 109 N 0.58 -0.21 -0.71 -2.05 0.87 -1.95 -2.78 113.55 107.31 3mby h SER 109 Ca 0.41 -0.30 -0.00 0.00 -1.23 0.00 0.00 61.79 60.67 3mby h SER 109 Cb 0.53 0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.51 3mby h SER 109 CO -0.33 0.23 0.43 0.00 -0.53 0.00 0.00 176.83 176.62 3mby h ALA 110 N -0.01 1.41 0.13 6.23 0.00 -1.90 -1.51 119.26 123.60 3mby h ALA 110 Ca -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3mby h ALA 110 Cb 0.49 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3mby h ALA 110 CO 0.04 0.51 -0.06 0.00 0.00 0.00 0.00 179.25 179.74 3mby h ALA 111 N 1.49 -0.17 -0.77 0.00 0.00 -1.02 0.99 119.26 119.77 3mby h ALA 111 Ca 0.26 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 3mby h ALA 111 Cb -0.04 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3mby h ALA 111 CO -0.05 -0.59 0.42 -0.09 0.00 0.00 0.00 179.25 178.93 3mby h ARG 112 N -0.17 1.07 -0.04 0.00 2.43 -1.26 -0.58 114.38 115.82 3mby h ARG 112 Ca -0.02 -0.13 0.02 0.00 -0.81 0.00 0.00 59.98 59.04 3mby h ARG 112 Cb 0.13 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3mby h ARG 112 CO 0.03 0.80 -0.05 -0.22 -1.51 0.00 0.00 179.97 179.02 3mby h LYS 113 N 1.06 -0.06 -0.79 0.20 1.63 -0.97 0.29 116.57 117.93 3mby h LYS 113 Ca 0.27 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.08 3mby h LYS 113 Cb 0.04 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.65 3mby h LYS 113 CO -0.04 -0.04 0.50 0.74 -3.45 0.00 0.00 179.45 177.16 3mby h PHE 114 N -0.06 1.02 -0.68 1.91 0.04 -0.43 -1.44 116.94 117.29 3mby h PHE 114 Ca 0.04 0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.83 3mby h PHE 114 Cb 0.11 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 37.89 3mby h PHE 114 CO -0.14 0.66 0.45 0.28 -0.60 0.00 0.00 178.31 178.96 3mby h VAL 115 N 1.08 1.17 -1.00 -0.55 2.07 -0.72 0.13 116.25 118.44 3mby h VAL 115 Ca 0.29 -0.32 0.07 0.00 0.82 0.00 0.00 66.70 67.56 3mby h VAL 115 Cb -0.09 0.17 -0.07 0.00 -1.52 0.00 0.00 31.29 29.79 3mby h VAL 115 CO -0.06 0.17 0.64 0.44 0.02 0.00 0.00 177.57 178.78 3mby h ASP 116 N 0.92 1.03 -0.10 0.57 3.32 -0.11 -1.82 116.42 120.23 3mby h ASP 116 Ca 0.25 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3mby h ASP 116 Cb -0.10 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.24 3mby h ASP 116 CO -0.06 0.65 0.00 -0.62 -1.72 0.00 0.00 179.24 177.50 3mby n GLU 117 N -4.51 1.26 -0.78 3.56 1.02 -0.62 -4.88 120.64 115.69 3mby n GLU 117 Ca 0.15 -0.41 0.00 0.00 -0.02 0.00 0.00 57.16 56.89 3mby n GLU 117 Cb 0.19 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 3mby n GLU 117 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3mby n GLY 118 N 0.77 0.65 3.38 0.62 0.00 -0.68 -5.02 105.19 104.90 3mby n GLY 118 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 3mby n GLY 118 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mby s ILE 119 N -2.20 4.92 0.00 -0.61 1.01 0.37 -4.88 121.20 119.80 3mby s ILE 119 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 60.65 59.66 3mby s ILE 119 Cb 0.00 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.61 3mby s ILE 119 CO 0.00 -0.43 0.31 2.29 0.00 0.00 0.00 174.94 177.11 3mby n LYS 120 N 5.10 0.00 -4.40 2.79 2.85 -1.26 -2.86 118.16 120.38 3mby n LYS 120 Ca -0.12 -0.31 -0.20 0.00 -1.05 0.00 0.00 58.31 56.64 3mby n LYS 120 Cb 0.45 -0.42 -0.10 0.00 -0.65 0.00 0.00 35.03 34.30 3mby n LYS 120 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 3mby s THR 121 N 0.00 1.04 0.26 0.58 -4.23 -1.26 -4.83 115.64 107.20 3mby s THR 121 Ca 0.00 -2.01 -0.05 0.00 -1.18 0.00 0.00 61.69 58.46 3mby s THR 121 Cb 0.00 -2.69 0.20 0.00 1.34 0.00 0.00 72.50 71.35 3mby s THR 121 CO 0.00 -0.05 1.86 0.25 -0.54 0.00 0.00 174.62 176.14 3mby h LEU 122 N 2.23 1.01 -0.60 4.79 5.85 -1.99 -1.71 115.31 124.88 3mby h LEU 122 Ca -0.40 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.20 3mby h LEU 122 Cb 1.24 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 3mby h LEU 122 CO 0.67 0.84 0.32 -0.33 -0.34 0.00 0.00 178.44 179.60 3mby h GLU 123 N 1.12 0.84 -0.65 1.25 3.07 -1.99 -1.44 114.58 116.76 3mby h GLU 123 Ca 0.27 -0.10 -0.03 0.00 -0.50 0.00 0.00 59.36 59.00 3mby h GLU 123 Cb 0.08 -0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 27.80 3mby h GLU 123 CO -0.04 0.65 0.29 -0.44 -1.40 0.00 0.00 179.01 178.07 3mby h ASP 124 N 0.81 0.87 -0.23 1.42 3.32 -1.82 -2.40 116.42 118.39 3mby h ASP 124 Ca 0.21 -0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 3mby h ASP 124 Cb 0.06 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 3mby h ASP 124 CO -0.03 0.78 0.14 -0.07 -1.72 0.00 0.00 179.24 178.33 3mby h LEU 125 N 0.91 0.27 -1.66 1.55 3.38 -1.03 -2.10 115.31 116.63 3mby h LEU 125 Ca 0.22 -0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.20 3mby h LEU 125 Cb 0.16 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 3mby h LEU 125 CO -0.02 0.24 0.32 0.03 0.09 0.00 0.00 178.44 179.10 3mby h ARG 126 N 0.28 0.41 -0.01 1.13 3.08 -1.00 -0.97 114.38 117.30 3mby h ARG 126 Ca 0.08 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3mby h ARG 126 Cb 0.02 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 29.98 3mby h ARG 126 CO -0.02 0.27 -0.23 0.36 -1.07 0.00 0.00 179.97 179.29 3mby n LYS 127 N -4.48 0.80 -1.07 0.04 2.85 -0.93 -4.05 118.16 111.32 3mby n LYS 127 Ca 0.06 -0.44 -0.01 0.00 -1.05 0.00 0.00 58.31 56.88 3mby n LYS 127 Cb 0.23 -1.49 0.14 0.00 -0.65 0.00 0.00 35.03 33.27 3mby n LYS 127 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3mby n ASN 128 N -0.72 2.36 -0.31 -5.58 4.13 -0.39 -4.84 115.26 109.90 3mby n ASN 128 Ca 0.12 -3.63 0.20 0.00 1.68 0.00 0.00 54.58 52.95 3mby n ASN 128 Cb 0.33 -0.46 0.48 0.00 -1.54 0.00 0.00 39.78 38.59 3mby n ASN 128 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 3mby h GLU 129 N 1.32 0.45 0.00 3.52 5.08 -1.64 0.25 114.58 123.56 3mby h GLU 129 Ca 0.06 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3mby h GLU 129 Cb 1.21 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3mby h GLU 129 CO 0.19 0.30 0.00 -0.40 -1.00 0.00 0.00 179.01 178.09 3mby n ASP 130 N -4.62 0.00 -0.88 1.42 5.75 -1.26 -0.90 116.55 116.07 3mby n ASP 130 Ca 0.23 0.06 0.12 0.00 -0.01 0.00 0.00 54.79 55.20 3mby n ASP 130 Cb 0.77 -0.22 0.11 0.00 -1.03 0.00 0.00 41.12 40.75 3mby n ASP 130 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3mby n LYS 131 N -1.22 2.17 -4.20 0.11 4.76 0.89 -4.95 118.16 115.72 3mby n LYS 131 Ca 0.05 -1.77 -0.31 0.00 -2.87 0.00 0.00 58.31 53.41 3mby n LYS 131 Cb 0.06 -1.46 -0.09 0.00 -1.84 0.00 0.00 35.03 31.70 3mby n LYS 131 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3mby s LEU 132 N -2.06 3.38 0.95 -0.35 1.43 -0.07 -5.13 118.68 116.84 3mby s LEU 132 Ca 0.27 -0.18 -0.16 0.00 -1.03 0.00 0.00 54.13 53.04 3mby s LEU 132 Cb 0.20 -2.08 0.19 0.00 0.03 0.00 0.00 46.19 44.53 3mby s LEU 132 CO 0.33 0.20 1.32 0.54 0.23 0.00 0.00 176.35 178.97 3mby s ASN 133 N -2.10 3.19 0.12 2.29 2.20 -1.26 -4.76 114.94 114.62 3mby s ASN 133 Ca 0.23 0.29 -0.23 0.00 -0.94 0.00 0.00 52.86 52.22 3mby s ASN 133 Cb -0.12 -0.36 -0.04 0.00 -2.00 0.00 0.00 41.25 38.73 3mby s ASN 133 CO 0.16 -2.69 1.67 -0.74 -2.94 0.00 0.00 177.10 172.56 3mby h HIS 134 N -1.61 -0.38 -0.19 1.54 -0.00 -1.97 -1.30 115.15 111.24 3mby h HIS 134 Ca -0.44 0.02 0.05 0.00 -0.00 0.00 0.00 60.37 59.99 3mby h HIS 134 Cb 1.24 0.18 -0.05 0.00 -0.00 0.00 0.00 27.41 28.78 3mby h HIS 134 CO -1.07 -0.22 -0.10 1.25 -0.00 0.00 0.00 177.93 177.79 3mby h HIS 135 N -0.21 -0.24 -1.00 5.26 -0.00 -1.90 -2.10 115.15 114.97 3mby h HIS 135 Ca 0.08 0.02 0.04 0.00 -0.00 0.00 0.00 60.37 60.51 3mby h HIS 135 Cb 0.32 0.13 -0.06 0.00 -0.00 0.00 0.00 27.41 27.80 3mby h HIS 135 CO -0.24 -0.15 0.66 1.96 -0.00 0.00 0.00 177.93 180.15 3mby h GLN 136 N -0.08 1.23 -0.52 5.26 4.20 -1.63 -0.63 115.11 122.93 3mby h GLN 136 Ca 0.11 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.77 3mby h GLN 136 Cb 0.24 -0.28 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 3mby h GLN 136 CO -0.25 0.81 0.32 -0.09 -0.67 0.00 0.00 178.83 178.95 3mby h ARG 137 N 1.26 0.62 -0.15 1.46 2.43 -0.63 -0.96 114.38 118.41 3mby h ARG 137 Ca 0.40 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.38 3mby h ARG 137 Cb 0.01 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 3mby h ARG 137 CO -0.13 0.41 -0.55 0.82 -1.51 0.00 0.00 179.97 179.01 3mby h ILE 138 N 0.63 1.34 -0.62 1.20 1.08 -0.85 -1.72 117.51 118.58 3mby h ILE 138 Ca 0.21 -1.82 -0.03 0.00 -0.39 0.00 0.00 64.86 62.83 3mby h ILE 138 Cb 0.01 1.82 -0.03 0.00 -3.07 0.00 0.00 36.82 35.55 3mby h ILE 138 CO -0.09 0.56 0.27 1.23 -0.69 0.00 0.00 178.15 179.44 3mby h GLY 139 N 1.17 0.95 0.75 5.37 0.00 -0.60 -1.93 103.07 108.77 3mby h GLY 139 Ca 0.01 -0.46 -0.10 0.00 0.00 0.00 0.00 47.33 46.77 3mby h GLY 139 CO 0.10 0.44 -0.35 -2.00 0.00 0.00 0.00 176.54 174.73 3mby h LEU 140 N 0.88 0.47 -0.75 3.11 5.85 -1.06 -1.95 115.31 121.85 3mby h LEU 140 Ca 0.21 -0.63 0.14 0.00 0.84 0.00 0.00 57.88 58.45 3mby h LEU 140 Cb 0.13 -0.14 -0.09 0.00 0.37 0.00 0.00 40.66 40.93 3mby h LEU 140 CO -0.02 1.01 0.30 0.50 -0.34 0.00 0.00 178.44 179.89 3mby h LYS 141 N -0.05 0.43 -0.55 1.25 3.64 -1.00 -1.87 116.57 118.42 3mby h LYS 141 Ca -0.02 -0.03 -0.24 0.00 -1.27 0.00 0.00 60.65 59.10 3mby h LYS 141 Cb 0.99 -0.10 -0.14 0.00 -0.41 0.00 0.00 32.23 32.57 3mby h LYS 141 CO 0.07 0.28 0.16 0.66 -2.27 0.00 0.00 179.45 178.36 3mby n TYR 142 N -5.00 1.74 -0.15 1.91 4.01 -0.76 -4.78 117.16 114.13 3mby n TYR 142 Ca 0.14 -1.50 -0.08 0.00 -0.16 0.00 0.00 57.90 56.30 3mby n TYR 142 Cb 0.41 -0.60 -0.03 0.00 -0.31 0.00 0.00 39.34 38.81 3mby n TYR 142 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 3mby h PHE 143 N 1.36 -1.15 -0.22 -0.72 3.57 -0.51 -0.10 116.94 119.17 3mby h PHE 143 Ca 0.30 0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.86 3mby h PHE 143 Cb 2.02 0.57 -0.01 0.00 2.79 0.00 0.00 35.95 41.32 3mby h PHE 143 CO 1.13 -0.42 0.12 0.78 -2.23 0.00 0.00 178.31 177.69 3mby h GLY 144 N -0.27 0.32 0.95 2.40 0.00 -1.86 -3.11 103.07 101.51 3mby h GLY 144 Ca 0.17 -0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.36 3mby h GLY 144 CO -0.61 0.14 0.16 -0.55 0.00 0.00 0.00 176.54 175.68 3mby h ASP 145 N 0.24 0.26 0.12 0.19 3.32 -1.75 -2.19 116.42 116.63 3mby h ASP 145 Ca 0.08 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3mby h ASP 145 Cb 0.07 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3mby h ASP 145 CO -0.01 0.19 0.00 0.49 -1.72 0.00 0.00 179.24 178.19 3mby n PHE 146 N -4.93 0.00 0.06 4.55 3.72 -0.10 -0.92 117.46 119.84 3mby n PHE 146 Ca -0.02 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.35 3mby n PHE 146 Cb 0.04 -0.47 -0.08 0.00 -0.94 0.00 0.00 39.48 38.03 3mby n PHE 146 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3mby h GLU 147 N 0.00 0.00 -7.00 -1.08 4.39 -1.32 -3.47 114.58 106.10 3mby h GLU 147 Ca 0.00 0.00 -0.48 0.00 0.34 0.00 0.00 59.36 59.22 3mby h GLU 147 Cb 0.06 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.73 3mby h GLU 147 CO 0.00 0.61 0.40 0.15 -1.16 0.00 0.00 179.01 179.01 3mby s LYS 148 N -2.80 4.06 0.60 2.33 1.02 -0.09 -5.06 119.74 119.80 3mby s LYS 148 Ca -0.00 1.44 -0.08 0.00 0.02 0.00 0.00 55.97 57.35 3mby s LYS 148 Cb 0.09 -2.38 -0.00 0.00 -0.52 0.00 0.00 37.83 35.01 3mby s LYS 148 CO 0.80 -0.22 0.94 1.03 -0.92 0.00 0.00 175.35 176.98 3mby s ARG 149 N -2.76 3.11 -0.26 1.68 1.81 -1.26 -4.91 118.95 116.35 3mby s ARG 149 Ca 0.61 0.22 -0.04 0.00 -1.72 0.00 0.00 55.73 54.80 3mby s ARG 149 Cb -0.19 -2.22 0.01 0.00 -0.45 0.00 0.00 34.95 32.10 3mby s ARG 149 CO 0.24 -0.66 -0.00 0.42 -0.68 0.00 0.00 175.30 174.62 3mby s ILE 150 N -3.04 3.41 0.48 1.52 1.01 0.16 -4.93 121.20 119.80 3mby s ILE 150 Ca 0.54 -0.76 -0.24 0.00 0.00 0.00 0.00 60.65 60.18 3mby s ILE 150 Cb -0.11 -2.70 -0.07 0.00 0.01 0.00 0.00 42.46 39.59 3mby s ILE 150 CO 0.48 0.21 1.39 -2.84 0.00 0.00 0.00 174.94 174.18 3mby s PRO 151 N 1.43 3.53 0.48 2.79 0.02 -1.26 -0.35 135.00 141.64 3mby s PRO 151 Ca 0.02 2.33 0.16 0.00 0.02 0.00 0.00 61.00 63.54 3mby s PRO 151 Cb -0.16 -2.53 1.17 0.00 0.02 0.00 0.00 34.50 32.99 3mby s PRO 151 CO -0.02 -0.91 2.06 -0.09 -0.33 0.00 0.00 177.00 177.71 3mby h ARG 152 N 2.07 0.19 -0.84 5.54 2.43 -1.28 -0.33 114.38 122.16 3mby h ARG 152 Ca -0.51 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.65 3mby h ARG 152 Cb 1.27 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.74 3mby h ARG 152 CO 0.60 0.13 0.52 0.93 -1.51 0.00 0.00 179.97 180.63 3mby h GLU 153 N 0.20 1.12 -0.09 0.20 4.39 -1.90 -0.57 114.58 117.93 3mby h GLU 153 Ca 0.15 -0.09 -0.16 0.00 0.34 0.00 0.00 59.36 59.59 3mby h GLU 153 Cb 0.34 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 3mby h GLU 153 CO -0.02 0.78 -0.64 0.93 -1.16 0.00 0.00 179.01 178.89 3mby h GLU 154 N 1.15 0.35 -0.41 2.33 5.08 -1.44 -2.92 114.58 118.71 3mby h GLU 154 Ca 0.30 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 3mby h GLU 154 Cb -0.07 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 3mby h GLU 154 CO -0.06 0.87 0.10 0.52 -1.00 0.00 0.00 179.01 179.44 3mby h MET 155 N 0.25 0.60 -0.31 2.33 2.86 -0.41 -0.52 114.93 119.74 3mby h MET 155 Ca -0.01 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.49 3mby h MET 155 Cb 1.17 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.72 3mby h MET 155 CO 0.11 0.55 0.04 -0.07 1.06 0.00 0.00 176.91 178.59 3mby h LEU 156 N 0.59 0.50 -0.92 1.22 3.38 -0.99 0.80 115.31 119.89 3mby h LEU 156 Ca 0.14 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 3mby h LEU 156 Cb 0.22 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 3mby h LEU 156 CO -0.00 0.64 0.12 1.56 0.09 0.00 0.00 178.44 180.85 3mby h GLN 157 N 0.34 0.92 -0.48 1.13 4.20 -1.29 -1.01 115.11 118.92 3mby h GLN 157 Ca 0.09 -0.21 -0.12 0.00 0.06 0.00 0.00 58.65 58.48 3mby h GLN 157 Cb 0.36 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 3mby h GLN 157 CO 0.01 0.83 -0.18 0.52 -0.67 0.00 0.00 178.83 179.34 3mby h MET 158 N 0.88 0.94 -0.41 1.46 2.86 -0.82 -2.54 114.93 117.29 3mby h MET 158 Ca 0.19 -0.37 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 3mby h MET 158 Cb 0.34 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 3mby h MET 158 CO 0.00 1.04 0.20 0.37 1.06 0.00 0.00 176.91 179.58 3mby h GLN 159 N 0.82 0.59 -0.17 1.72 4.15 -0.43 -1.90 115.11 119.90 3mby h GLN 159 Ca 0.12 -0.08 0.04 0.00 0.77 0.00 0.00 58.65 59.50 3mby h GLN 159 Cb 0.73 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 28.27 3mby h GLN 159 CO 0.06 0.51 -0.11 -0.44 -1.93 0.00 0.00 178.83 176.92 3mby h ASP 160 N 0.53 -0.34 0.46 -0.69 3.32 -1.04 -0.67 116.42 117.99 3mby h ASP 160 Ca 0.14 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 3mby h ASP 160 Cb 0.11 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 3mby h ASP 160 CO -0.02 -0.14 -0.29 0.40 -1.72 0.00 0.00 179.24 177.47 3mby h ILE 161 N -0.10 0.40 -0.10 0.35 2.04 -1.33 -1.40 117.51 117.37 3mby h ILE 161 Ca 0.10 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.99 3mby h ILE 161 Cb 0.25 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 3mby h ILE 161 CO -0.23 0.00 -0.08 0.58 0.00 0.00 0.00 178.15 178.42 3mby h VAL 162 N -0.72 0.77 -0.78 1.67 2.07 -1.15 0.72 116.25 118.83 3mby h VAL 162 Ca -0.05 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 3mby h VAL 162 Cb 0.59 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 3mby h VAL 162 CO 0.05 0.00 0.29 -0.07 0.02 0.00 0.00 177.57 177.86 3mby h LEU 163 N -0.09 1.09 -0.53 2.57 4.07 -1.13 -0.55 115.31 120.75 3mby h LEU 163 Ca 0.07 -0.18 -0.15 0.00 0.08 0.00 0.00 57.88 57.70 3mby h LEU 163 Cb 0.19 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.64 3mby h LEU 163 CO -0.16 0.97 -0.47 0.78 -1.08 0.00 0.00 178.44 178.49 3mby h ASN 164 N 1.14 0.72 -0.01 -0.43 2.35 -0.98 -1.02 115.58 117.34 3mby h ASN 164 Ca 0.26 -0.35 -0.19 0.00 -0.55 0.00 0.00 56.30 55.47 3mby h ASN 164 Cb 0.24 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.40 3mby h ASN 164 CO -0.02 1.07 -0.65 -0.33 -1.65 0.00 0.00 177.43 175.85 3mby h GLU 165 N 0.53 0.64 -0.44 0.81 4.39 -0.71 -2.15 114.58 117.64 3mby h GLU 165 Ca 0.03 -0.46 -0.02 0.00 0.34 0.00 0.00 59.36 59.25 3mby h GLU 165 Cb 1.01 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.72 3mby h GLU 165 CO 0.10 1.08 0.19 0.28 -1.16 0.00 0.00 179.01 179.49 3mby h VAL 166 N 0.46 1.20 -0.93 3.13 2.07 -1.04 -2.36 116.25 118.78 3mby h VAL 166 Ca -0.02 -0.60 0.04 0.00 0.82 0.00 0.00 66.70 66.94 3mby h VAL 166 Cb 1.24 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 3mby h VAL 166 CO 0.13 0.22 0.61 0.50 0.02 0.00 0.00 177.57 179.05 3mby h LYS 167 N 0.57 1.13 -0.00 1.57 3.64 -1.07 -1.78 116.57 120.64 3mby h LYS 167 Ca 0.15 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 3mby h LYS 167 Cb 0.18 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3mby h LYS 167 CO -0.01 0.75 -0.18 0.87 -2.27 0.00 0.00 179.45 178.60 3mby h LYS 168 N 1.16 0.01 -0.02 1.90 1.57 -0.88 -2.87 116.57 117.44 3mby h LYS 168 Ca 0.37 -0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.07 3mby h LYS 168 Cb 0.03 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.34 3mby h LYS 168 CO -0.12 0.19 -0.32 0.28 -0.57 0.00 0.00 179.45 178.92 3mby h VAL 169 N 0.01 1.49 -1.55 0.50 2.07 -0.95 -3.45 116.25 114.36 3mby h VAL 169 Ca -0.00 -1.88 0.11 0.00 0.82 0.00 0.00 66.70 65.75 3mby h VAL 169 Cb 0.33 2.59 -0.21 0.00 -1.52 0.00 0.00 31.29 32.48 3mby h VAL 169 CO 0.02 0.53 -0.08 -0.62 0.02 0.00 0.00 177.57 177.44 3mby s ASP 170 N -6.38 -1.06 0.00 0.57 -1.08 -1.00 -5.03 116.67 102.68 3mby s ASP 170 Ca -0.15 1.24 0.04 0.00 -0.52 0.00 0.00 52.55 53.17 3mby s ASP 170 Cb 0.02 2.12 0.21 0.00 -1.46 0.00 0.00 42.92 43.82 3mby s ASP 170 CO 0.76 -0.20 1.06 -1.54 0.52 0.00 0.00 175.17 175.77 3mby n SER 171 N 5.36 0.00 -0.22 -0.34 3.41 -1.10 -1.59 113.62 119.14 3mby n SER 171 Ca -0.09 0.35 0.13 0.00 -0.26 0.00 0.00 58.87 59.00 3mby n SER 171 Cb 0.50 -0.39 0.35 0.00 -0.26 0.00 0.00 64.21 64.41 3mby n SER 171 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3mby n GLU 172 N -1.39 0.75 -2.45 4.33 1.02 -1.26 -4.88 120.64 116.76 3mby n GLU 172 Ca 0.02 -0.45 -0.35 0.00 -0.02 0.00 0.00 57.16 56.36 3mby n GLU 172 Cb 0.04 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 29.95 3mby n GLU 172 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3mby s TYR 173 N -2.56 2.94 -0.15 -0.32 2.02 -0.62 -4.34 117.35 114.31 3mby s TYR 173 Ca 0.23 1.57 -0.02 0.00 -0.37 0.00 0.00 57.07 58.48 3mby s TYR 173 Cb 0.19 -3.16 0.05 0.00 -0.40 0.00 0.00 41.96 38.64 3mby s TYR 173 CO 0.54 -1.05 0.00 0.42 -1.57 0.00 0.00 175.55 173.90 3mby s ILE 174 N -1.84 0.63 -0.14 2.71 1.01 -0.57 -4.88 121.20 118.11 3mby s ILE 174 Ca 0.67 -0.37 -0.03 0.00 0.00 0.00 0.00 60.65 60.91 3mby s ILE 174 Cb -0.20 -0.95 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 3mby s ILE 174 CO 0.24 0.02 -0.03 0.00 0.00 0.00 0.00 174.94 175.16 3mby s ALA 175 N 1.84 3.03 -0.08 9.38 0.00 -1.26 -1.52 121.76 133.14 3mby s ALA 175 Ca 0.01 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.18 3mby s ALA 175 Cb -0.15 -1.53 0.01 0.00 0.00 0.00 0.00 23.12 21.44 3mby s ALA 175 CO -0.07 0.27 -0.17 0.99 0.00 0.00 0.00 175.76 176.78 3mby s THR 176 N 0.18 1.53 -0.23 0.00 2.01 0.48 -4.95 115.64 114.67 3mby s THR 176 Ca -0.02 -0.71 -0.22 0.00 0.31 0.00 0.00 61.69 61.06 3mby s THR 176 Cb -0.14 -1.36 -0.02 0.00 0.01 0.00 0.00 72.50 71.00 3mby s THR 176 CO 0.03 0.44 0.69 -0.69 -0.69 0.00 0.00 174.62 174.40 3mby s VAL 177 N 0.53 4.95 0.00 3.82 1.01 -1.26 0.41 120.40 129.86 3mby s VAL 177 Ca -0.16 1.28 0.00 0.00 0.00 0.00 0.00 61.98 63.10 3mby s VAL 177 Cb -0.17 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.22 3mby s VAL 177 CO 0.06 0.03 0.00 0.00 0.00 0.00 0.00 175.10 175.19 3mby n GLY 179 N 5.00 0.94 0.33 0.00 0.00 0.12 -2.56 105.19 109.03 3mby n GLY 179 Ca 0.00 -0.76 0.16 0.00 0.00 0.00 0.00 46.02 45.42 3mby n GLY 179 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3mby h SER 180 N 2.73 0.00 -0.07 1.61 4.64 -1.87 -2.04 113.55 118.55 3mby h SER 180 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mby h SER 180 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3mby h SER 180 CO 0.00 0.00 0.04 0.15 -0.87 0.00 0.00 176.83 176.15 3mby h PHE 181 N 0.00 0.10 0.00 4.77 3.57 -1.84 -1.69 116.94 121.85 3mby h PHE 181 Ca 0.14 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 3mby h PHE 181 Cb 0.59 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.29 3mby h PHE 181 CO 0.00 0.13 -0.09 -0.09 -2.23 0.00 0.00 178.31 176.03 3mby h ARG 182 N 0.04 0.00 -0.01 1.11 2.43 -1.09 0.65 114.38 117.50 3mby h ARG 182 Ca 0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3mby h ARG 182 Cb 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3mby h ARG 182 CO -0.00 0.09 0.00 0.54 -1.51 0.00 0.00 179.97 179.09 3mby n ARG 183 N -3.98 1.08 -1.00 0.20 1.74 -0.83 -4.56 116.66 109.30 3mby n ARG 183 Ca -0.02 -0.12 -0.00 0.00 -0.77 0.00 0.00 57.85 56.94 3mby n ARG 183 Cb 0.18 -1.40 -0.00 0.00 -1.02 0.00 0.00 32.46 30.22 3mby n ARG 183 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3mby n GLY 184 N 0.93 0.41 3.76 -0.13 0.00 0.22 -3.88 105.19 106.50 3mby n GLY 184 Ca 0.19 -0.89 -0.38 0.00 0.00 0.00 0.00 46.02 44.93 3mby n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mby s ALA 185 N -2.00 3.01 -1.11 4.61 0.00 -0.70 -4.91 121.76 120.66 3mby s ALA 185 Ca 0.00 1.21 0.28 0.00 0.00 0.00 0.00 51.96 53.45 3mby s ALA 185 Cb 0.00 -3.50 1.26 0.00 0.00 0.00 0.00 23.12 20.89 3mby s ALA 185 CO 0.00 -1.02 1.92 0.39 0.00 0.00 0.00 175.76 177.05 3mby n GLU 186 N -0.52 0.11 -3.70 0.00 -0.58 -1.26 -4.74 120.64 109.95 3mby n GLU 186 Ca 0.07 0.02 -0.14 0.00 -0.42 0.00 0.00 57.16 56.69 3mby n GLU 186 Cb 0.45 -1.50 -0.09 0.00 -0.57 0.00 0.00 31.44 29.74 3mby n GLU 186 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3mby s SER 187 N -2.89 -0.40 0.15 1.62 1.04 -1.26 -0.84 113.70 111.12 3mby s SER 187 Ca 0.17 0.59 0.08 0.00 0.48 0.00 0.00 55.95 57.27 3mby s SER 187 Cb 0.19 0.65 -0.04 0.00 0.10 0.00 0.00 66.02 66.91 3mby s SER 187 CO 0.49 -0.33 -0.17 -0.44 0.98 0.00 0.00 173.24 173.77 3mby s SER 188 N -0.55 2.50 0.27 7.02 0.01 0.52 -4.89 113.70 118.59 3mby s SER 188 Ca -0.07 -0.85 0.17 0.00 1.31 0.00 0.00 55.95 56.51 3mby s SER 188 Cb -0.03 -0.13 0.08 0.00 0.21 0.00 0.00 66.02 66.14 3mby s SER 188 CO 0.03 -0.07 1.37 1.23 0.41 0.00 0.00 173.24 176.22 3mby h GLY 189 N 3.32 0.00 -0.32 3.44 0.00 -1.91 0.46 103.07 108.05 3mby h GLY 189 Ca -0.42 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.94 3mby h GLY 189 CO 0.51 0.00 0.12 2.09 0.00 0.00 0.00 176.54 179.26 3mby n ASP 190 N -3.13 -0.51 -4.31 0.19 5.68 -1.26 -4.69 116.55 108.52 3mby n ASP 190 Ca 0.01 -1.31 -0.32 0.00 -0.50 0.00 0.00 54.79 52.67 3mby n ASP 190 Cb 0.70 0.84 -0.15 0.00 -1.14 0.00 0.00 41.12 41.37 3mby n ASP 190 CO 0.00 0.00 0.00 -0.32 -1.33 0.00 0.00 177.20 175.55 3mby s MET 191 N -2.02 3.20 -0.22 0.11 -2.45 -0.78 -4.90 119.30 112.25 3mby s MET 191 Ca 0.05 -0.77 0.01 0.00 -1.25 0.00 0.00 55.69 53.73 3mby s MET 191 Cb -0.01 -2.48 0.03 0.00 1.25 0.00 0.00 34.83 33.62 3mby s MET 191 CO 0.02 0.22 -0.14 -0.51 1.05 0.00 0.00 175.02 175.66 3mby s ASP 192 N 0.29 3.75 -0.17 1.11 1.01 -1.26 -1.54 116.67 119.86 3mby s ASP 192 Ca -0.13 -0.86 -0.02 0.00 0.71 0.00 0.00 52.55 52.25 3mby s ASP 192 Cb -0.17 -1.55 -0.01 0.00 1.01 0.00 0.00 42.92 42.21 3mby s ASP 192 CO 0.07 -0.07 -0.09 -0.69 0.21 0.00 0.00 175.17 174.59 3mby s VAL 193 N 1.26 3.15 -0.15 -1.27 1.01 0.16 0.21 120.40 124.76 3mby s VAL 193 Ca 0.01 -0.60 -0.10 0.00 0.00 0.00 0.00 61.98 61.29 3mby s VAL 193 Cb -0.15 -2.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.80 3mby s VAL 193 CO -0.09 0.48 0.18 -0.22 0.00 0.00 0.00 175.10 175.46 3mby s LEU 194 N 0.91 4.29 -0.05 3.92 2.96 0.17 -0.70 118.68 130.18 3mby s LEU 194 Ca -0.02 0.41 0.05 0.00 -0.22 0.00 0.00 54.13 54.34 3mby s LEU 194 Cb -0.15 -2.17 -0.00 0.00 0.50 0.00 0.00 46.19 44.37 3mby s LEU 194 CO 0.00 0.25 -0.18 -0.22 -1.32 0.00 0.00 176.35 174.87 3mby s LEU 195 N -0.16 1.94 0.10 -0.68 2.96 0.11 -0.39 118.68 122.56 3mby s LEU 195 Ca 0.13 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 53.70 3mby s LEU 195 Cb -0.12 -1.03 -0.04 0.00 0.50 0.00 0.00 46.19 45.50 3mby s LEU 195 CO 0.02 0.17 -0.10 0.42 -1.32 0.00 0.00 176.35 175.54 3mby s THR 196 N 0.01 0.92 -0.17 3.68 -4.23 -0.58 -1.31 115.64 113.97 3mby s THR 196 Ca -0.04 -1.68 -0.11 0.00 -1.18 0.00 0.00 61.69 58.67 3mby s THR 196 Cb -0.12 -1.41 0.05 0.00 1.34 0.00 0.00 72.50 72.37 3mby s THR 196 CO 0.02 -0.60 0.42 -2.28 -0.54 0.00 0.00 174.62 171.65 3mby s HIS 197 N -2.60 -0.57 0.57 3.99 2.46 -1.26 -1.51 115.29 116.36 3mby s HIS 197 Ca 0.06 1.27 0.33 0.00 0.47 0.00 0.00 55.06 57.19 3mby s HIS 197 Cb -0.02 0.24 1.45 0.00 -0.13 0.00 0.00 32.58 34.13 3mby s HIS 197 CO -0.00 -0.31 1.78 -1.00 -2.47 0.00 0.00 174.74 172.74 3mby h PRO 198 N 6.60 0.00 0.00 2.88 0.13 -2.00 -1.06 132.00 138.55 3mby h PRO 198 Ca -0.34 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.74 3mby h PRO 198 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 3mby h PRO 198 CO 0.27 0.00 -0.25 0.77 -0.23 0.00 0.00 178.00 178.56 3mby h SER 199 N 0.00 0.00 -3.61 1.44 0.02 -1.96 -3.41 113.55 106.03 3mby h SER 199 Ca 0.43 0.00 -0.70 0.00 -0.84 0.00 0.00 61.79 60.68 3mby h SER 199 Cb 1.95 0.00 -0.26 0.00 0.14 0.00 0.00 62.40 64.23 3mby h SER 199 CO -0.00 0.25 -0.55 0.12 -1.14 0.00 0.00 176.83 175.51 3mby s PHE 200 N -3.78 3.24 0.33 3.45 5.36 -0.40 -1.83 117.98 124.34 3mby s PHE 200 Ca -0.00 -1.10 0.03 0.00 -0.96 0.00 0.00 56.93 54.90 3mby s PHE 200 Cb 0.11 -2.38 -0.04 0.00 -0.34 0.00 0.00 43.02 40.37 3mby s PHE 200 CO 0.64 -0.67 0.14 0.95 -1.46 0.00 0.00 175.22 174.83 3mby s THR 201 N 1.51 0.47 0.23 0.12 -4.23 -0.36 -1.58 115.64 111.80 3mby s THR 201 Ca 0.01 -2.00 0.36 0.00 -1.18 0.00 0.00 61.69 58.88 3mby s THR 201 Cb -0.19 -2.51 0.39 0.00 1.34 0.00 0.00 72.50 71.53 3mby s THR 201 CO 0.05 0.00 2.08 0.77 -0.54 0.00 0.00 174.62 176.98 3mby h SER 202 N 2.12 0.00 0.14 3.99 4.64 -1.97 -2.96 113.55 119.52 3mby h SER 202 Ca -0.35 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.74 3mby h SER 202 Cb 1.25 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.36 3mby h SER 202 CO 0.55 0.00 -1.08 -0.08 -0.87 0.00 0.00 176.83 175.34 3mby h GLU 203 N 0.00 0.30 -2.91 4.77 4.57 -1.98 -3.49 114.58 115.84 3mby h GLU 203 Ca 0.00 -0.52 0.01 0.00 -1.18 0.00 0.00 59.36 57.67 3mby h GLU 203 Cb 0.30 0.19 -0.11 0.00 -0.16 0.00 0.00 28.75 28.97 3mby h GLU 203 CO 0.00 1.25 0.25 -1.54 -1.18 0.00 0.00 179.01 177.78 3mby s SER 204 N -7.05 -0.51 -0.63 1.04 1.04 -1.12 -5.09 113.70 101.38 3mby s SER 204 Ca -0.15 -0.08 0.02 0.00 0.48 0.00 0.00 55.95 56.22 3mby s SER 204 Cb 0.02 0.59 0.16 0.00 0.10 0.00 0.00 66.02 66.89 3mby s SER 204 CO 0.82 -0.98 0.42 -0.89 0.98 0.00 0.00 173.24 173.59 3mby s THR 205 N -3.70 3.09 -0.98 2.02 2.01 -1.26 -1.22 115.64 115.60 3mby s THR 205 Ca 0.03 -3.58 0.22 0.00 0.31 0.00 0.00 61.69 58.67 3mby s THR 205 Cb -0.02 -3.05 0.18 0.00 0.01 0.00 0.00 72.50 69.63 3mby s THR 205 CO -0.10 -0.90 1.70 0.29 -0.69 0.00 0.00 174.62 174.92 3mby n LYS 206 N 2.78 0.01 -3.75 4.92 5.02 -0.76 -4.72 118.16 121.66 3mby n LYS 206 Ca 0.11 0.14 -0.14 0.00 -2.02 0.00 0.00 58.31 56.40 3mby n LYS 206 Cb 0.34 -1.52 -0.15 0.00 -0.02 0.00 0.00 35.03 33.69 3mby n LYS 206 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3mby s GLN 207 N -3.01 0.07 0.75 1.97 -0.21 -1.26 -5.08 119.66 112.88 3mby s GLN 207 Ca 0.10 0.34 -0.05 0.00 0.02 0.00 0.00 55.36 55.77 3mby s GLN 207 Cb 0.14 -0.20 0.11 0.00 1.00 0.00 0.00 33.01 34.07 3mby s GLN 207 CO 0.40 -0.17 1.05 -1.25 -2.12 0.00 0.00 175.29 173.20 3mby s PRO 208 N 1.19 1.69 -1.45 2.91 0.04 -1.26 -4.37 135.00 133.75 3mby s PRO 208 Ca -0.09 -0.70 0.00 0.00 0.04 0.00 0.00 61.00 60.25 3mby s PRO 208 Cb -0.12 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.22 3mby s PRO 208 CO -0.05 -1.52 0.00 1.63 0.04 0.00 0.00 177.00 177.10 3mby n LYS 209 N -3.00 -1.47 -0.31 4.56 5.02 -1.26 -4.85 118.16 116.85 3mby n LYS 209 Ca 0.12 0.81 -0.02 0.00 -2.02 0.00 0.00 58.31 57.20 3mby n LYS 209 Cb 0.60 -5.14 0.11 0.00 -0.02 0.00 0.00 35.03 30.58 3mby n LYS 209 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3mby h LEU 210 N 0.00 0.91 0.12 -0.35 3.38 -1.91 0.39 115.31 117.84 3mby h LEU 210 Ca -0.30 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.44 3mby h LEU 210 Cb 0.99 -0.20 0.02 0.00 0.09 0.00 0.00 40.66 41.56 3mby h LEU 210 CO 0.42 0.63 -0.93 0.25 0.09 0.00 0.00 178.44 178.89 3mby h LEU 211 N 1.07 0.61 -0.23 1.67 5.85 -1.89 -3.32 115.31 119.08 3mby h LEU 211 Ca 0.34 -0.88 0.05 0.00 0.84 0.00 0.00 57.88 58.24 3mby h LEU 211 Cb 0.00 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.78 3mby h LEU 211 CO -0.11 1.44 -0.14 -0.74 -0.34 0.00 0.00 178.44 178.54 3mby h HIS 212 N -0.12 -0.34 -0.62 1.25 2.76 -1.84 -1.50 115.15 114.75 3mby h HIS 212 Ca -0.15 0.03 0.13 0.00 -2.20 0.00 0.00 60.37 58.17 3mby h HIS 212 Cb 1.68 0.19 -0.11 0.00 1.55 0.00 0.00 27.41 30.72 3mby h HIS 212 CO 0.16 -0.21 -0.10 1.96 -1.30 0.00 0.00 177.93 178.45 3mby h GLN 213 N -0.12 0.04 -0.16 5.26 4.20 -1.04 0.33 115.11 123.61 3mby h GLN 213 Ca 0.13 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.82 3mby h GLN 213 Cb 0.31 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 3mby h GLN 213 CO -0.30 0.02 0.03 0.28 -0.67 0.00 0.00 178.83 178.19 3mby h VAL 214 N 0.04 1.21 -0.65 -0.54 2.07 -1.56 -1.34 116.25 115.48 3mby h VAL 214 Ca 0.31 -0.67 0.05 0.00 0.82 0.00 0.00 66.70 67.21 3mby h VAL 214 Cb 0.49 1.35 -0.05 0.00 -1.52 0.00 0.00 31.29 31.55 3mby h VAL 214 CO -0.60 0.20 0.36 0.58 0.02 0.00 0.00 177.57 178.14 3mby h VAL 215 N 0.06 0.98 -0.12 2.57 2.07 -0.33 -1.08 116.25 120.40 3mby h VAL 215 Ca 0.05 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.36 3mby h VAL 215 Cb 0.28 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 3mby h VAL 215 CO 0.00 0.12 -0.03 -0.08 0.02 0.00 0.00 177.57 177.60 3mby h GLU 216 N 0.68 -0.00 -0.67 1.57 4.81 -0.21 -1.44 114.58 119.31 3mby h GLU 216 Ca 0.29 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.53 3mby h GLU 216 Cb 0.16 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.51 3mby h GLU 216 CO -0.17 -0.00 0.44 0.37 -0.73 0.00 0.00 179.01 178.91 3mby h GLN 217 N -0.00 0.85 -0.01 1.92 5.75 -0.78 0.63 115.11 123.47 3mby h GLN 217 Ca 0.06 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.44 3mby h GLN 217 Cb 0.09 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 3mby h GLN 217 CO -0.13 0.56 -0.30 -0.07 -2.65 0.00 0.00 178.83 176.24 3mby h LEU 218 N 0.88 0.02 0.05 -2.39 3.38 -0.83 -2.33 115.31 114.08 3mby h LEU 218 Ca 0.26 -0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.94 3mby h LEU 218 Cb -0.05 -0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.72 3mby h LEU 218 CO -0.07 0.32 -1.14 1.56 0.09 0.00 0.00 178.44 179.20 3mby h GLN 219 N 0.01 0.66 -0.67 1.13 4.20 -0.79 0.24 115.11 119.89 3mby h GLN 219 Ca -0.00 -0.79 0.11 0.00 0.06 0.00 0.00 58.65 58.03 3mby h GLN 219 Cb 0.55 0.24 -0.08 0.00 0.30 0.00 0.00 27.48 28.49 3mby h GLN 219 CO 0.04 1.35 0.27 -0.22 -0.67 0.00 0.00 178.83 179.59 3mby h LYS 220 N 0.34 0.43 -0.38 1.46 3.64 -0.40 0.12 116.57 121.78 3mby h LYS 220 Ca -0.16 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 3mby h LYS 220 Cb 1.80 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.52 3mby h LYS 220 CO 0.22 0.29 0.00 1.33 -2.27 0.00 0.00 179.45 179.02 3mby n VAL 221 N -4.98 0.45 -2.01 2.00 0.24 -0.92 -4.90 118.33 108.19 3mby n VAL 221 Ca 0.11 -0.35 -0.18 0.00 -2.04 0.00 0.00 64.34 61.88 3mby n VAL 221 Cb 0.32 0.03 -0.03 0.00 -1.47 0.00 0.00 33.84 32.69 3mby n VAL 221 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 3mby n HIS 222 N 0.20 -0.51 -0.05 6.34 8.25 0.41 -4.91 115.22 124.95 3mby n HIS 222 Ca 0.08 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.36 3mby n HIS 222 Cb 0.28 -3.32 -0.13 0.00 1.12 0.00 0.00 29.99 27.94 3mby n HIS 222 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3mby h PHE 223 N 0.00 0.13 -3.36 4.41 3.57 -0.75 -3.43 116.94 117.50 3mby h PHE 223 Ca -0.40 -0.09 -0.57 0.00 3.53 0.00 0.00 57.97 60.44 3mby h PHE 223 Cb 1.25 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 39.91 3mby h PHE 223 CO 0.48 1.25 0.11 0.42 -2.23 0.00 0.00 178.31 178.34 3mby s ILE 224 N -2.32 5.03 -0.06 1.41 1.01 -0.77 -0.78 121.20 124.72 3mby s ILE 224 Ca -0.21 1.36 0.09 0.00 0.00 0.00 0.00 60.65 61.88 3mby s ILE 224 Cb 0.01 -4.01 -0.13 0.00 0.01 0.00 0.00 42.46 38.34 3mby s ILE 224 CO 0.69 0.19 0.11 0.35 0.00 0.00 0.00 174.94 176.28 3mby n THR 225 N 4.12 0.36 -3.83 2.92 -2.24 0.36 -4.39 114.28 111.58 3mby n THR 225 Ca -0.01 -0.32 -0.09 0.00 -2.27 0.00 0.00 64.05 61.36 3mby n THR 225 Cb 0.51 -0.33 -0.07 0.00 -2.10 0.00 0.00 70.33 68.34 3mby n THR 225 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3mby s ASP 226 N -3.70 0.09 -0.10 3.42 1.11 -1.17 -4.99 116.67 111.32 3mby s ASP 226 Ca -0.04 -0.62 0.02 0.00 0.18 0.00 0.00 52.55 52.09 3mby s ASP 226 Cb 0.04 0.35 0.01 0.00 1.07 0.00 0.00 42.92 44.40 3mby s ASP 226 CO 0.38 -0.74 -0.15 -0.89 1.18 0.00 0.00 175.17 174.95 3mby s THR 227 N -3.85 1.47 -0.16 -1.27 2.01 -1.26 -0.92 115.64 111.65 3mby s THR 227 Ca 0.05 -0.63 -0.18 0.00 0.31 0.00 0.00 61.69 61.24 3mby s THR 227 Cb 0.05 -1.34 -0.23 0.00 0.01 0.00 0.00 72.50 70.98 3mby s THR 227 CO -0.11 0.43 0.37 -0.07 -0.69 0.00 0.00 174.62 174.55 3mby h LEU 228 N 7.37 0.18 -7.09 4.42 3.38 -0.38 -3.46 115.31 119.72 3mby h LEU 228 Ca -0.31 -0.71 -0.07 0.00 0.09 0.00 0.00 57.88 56.88 3mby h LEU 228 Cb 1.18 -0.06 -0.20 0.00 0.09 0.00 0.00 40.66 41.67 3mby h LEU 228 CO 0.49 1.56 0.08 -0.94 0.09 0.00 0.00 178.44 179.72 3mby s SER 229 N -6.90 -0.60 -0.14 -0.43 1.04 -0.74 -4.42 113.70 101.52 3mby s SER 229 Ca -0.25 0.81 -0.07 0.00 0.48 0.00 0.00 55.95 56.93 3mby s SER 229 Cb 0.05 0.75 0.06 0.00 0.10 0.00 0.00 66.02 66.98 3mby s SER 229 CO 0.68 -0.47 0.32 -0.75 0.98 0.00 0.00 173.24 174.00 3mby s LYS 230 N -0.73 0.27 0.00 4.02 2.20 -1.26 -1.12 119.74 123.12 3mby s LYS 230 Ca -0.08 0.69 0.00 0.00 -0.36 0.00 0.00 55.97 56.22 3mby s LYS 230 Cb -0.02 -0.04 0.00 0.00 -1.51 0.00 0.00 37.83 36.26 3mby s LYS 230 CO 0.06 -0.18 0.00 0.41 -0.36 0.00 0.00 175.35 175.28 3mby n GLY 231 N 4.48 4.48 0.21 5.54 0.00 -0.24 -5.02 105.19 114.64 3mby n GLY 231 Ca -0.21 -1.80 0.04 0.00 0.00 0.00 0.00 46.02 44.05 3mby n GLY 231 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3mby h GLU 232 N 0.00 0.04 0.00 1.61 4.39 -2.02 -3.35 114.58 115.25 3mby h GLU 232 Ca 0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3mby h GLU 232 Cb 0.00 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3mby h GLU 232 CO 0.00 0.29 -0.54 0.25 -1.16 0.00 0.00 179.01 177.85 3mby n THR 233 N -4.23 0.00 -4.71 1.13 -2.24 -1.26 -4.53 114.28 98.44 3mby n THR 233 Ca -0.02 -0.12 -0.27 0.00 -2.27 0.00 0.00 64.05 61.37 3mby n THR 233 Cb 0.31 0.58 -0.17 0.00 -2.10 0.00 0.00 70.33 68.95 3mby n THR 233 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3mby s LYS 234 N -1.32 2.04 -0.06 -0.78 2.20 -1.26 -0.77 119.74 119.79 3mby s LYS 234 Ca 0.00 -0.53 0.05 0.00 -0.36 0.00 0.00 55.97 55.14 3mby s LYS 234 Cb 0.00 -1.64 -0.01 0.00 -1.51 0.00 0.00 37.83 34.67 3mby s LYS 234 CO 0.00 0.05 -0.24 0.12 -0.36 0.00 0.00 175.35 174.93 3mby s PHE 235 N 0.63 2.35 -0.12 4.03 5.36 0.06 -1.08 117.98 129.20 3mby s PHE 235 Ca -0.15 -0.75 -0.01 0.00 -0.96 0.00 0.00 56.93 55.06 3mby s PHE 235 Cb -0.16 -1.55 0.04 0.00 -0.34 0.00 0.00 43.02 41.00 3mby s PHE 235 CO 0.04 -0.25 -0.03 -1.64 -1.46 0.00 0.00 175.22 171.89 3mby s MET 236 N -0.02 1.05 0.00 10.12 -1.94 -0.27 -0.89 119.30 127.34 3mby s MET 236 Ca -0.07 -0.21 0.00 0.00 -1.71 0.00 0.00 55.69 53.70 3mby s MET 236 Cb -0.14 -1.55 0.00 0.00 2.01 0.00 0.00 34.83 35.15 3mby s MET 236 CO 0.05 -0.38 0.00 0.41 -0.01 0.00 0.00 175.02 175.09 3mby n GLY 237 N 5.02 3.99 3.13 -0.03 0.00 0.43 0.40 105.19 118.13 3mby n GLY 237 Ca -0.10 -0.73 -0.21 0.00 0.00 0.00 0.00 46.02 44.98 3mby n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mby s VAL 238 N -0.71 1.10 0.16 1.61 1.01 -0.10 -1.24 120.40 122.24 3mby s VAL 238 Ca 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 3mby s VAL 238 Cb 0.00 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 3mby s VAL 238 CO 0.00 0.09 0.10 0.00 0.00 0.00 0.00 175.10 175.29 3mby s GLN 240 N -4.09 0.54 0.45 0.00 0.74 0.04 0.04 119.66 117.39 3mby s GLN 240 Ca 0.29 0.87 -0.23 0.00 0.05 0.00 0.00 55.36 56.35 3mby s GLN 240 Cb 0.07 0.12 -0.08 0.00 1.10 0.00 0.00 33.01 34.22 3mby s GLN 240 CO 0.06 -0.13 1.10 -0.51 -0.55 0.00 0.00 175.29 175.26 3mby s LEU 241 N 1.07 4.02 0.39 3.68 1.43 -1.26 -4.62 118.68 123.38 3mby s LEU 241 Ca -0.06 2.15 -0.24 0.00 -1.03 0.00 0.00 54.13 54.94 3mby s LEU 241 Cb -0.06 -4.29 -0.09 0.00 0.03 0.00 0.00 46.19 41.78 3mby s LEU 241 CO -0.10 -0.76 1.01 -2.16 0.23 0.00 0.00 176.35 174.57 3mby s PRO 242 N -2.73 4.26 0.28 1.29 0.04 -1.26 -4.51 135.00 132.37 3mby s PRO 242 Ca 0.63 1.41 0.08 0.00 0.04 0.00 0.00 61.00 63.16 3mby s PRO 242 Cb -0.24 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 31.72 3mby s PRO 242 CO 0.29 -0.04 0.12 -1.54 0.04 0.00 0.00 177.00 175.88 3mby s SER 243 N -1.67 4.98 0.83 6.66 1.04 -1.26 -4.96 113.70 119.33 3mby s SER 243 Ca 0.57 -0.52 -0.10 0.00 0.48 0.00 0.00 55.95 56.38 3mby s SER 243 Cb -0.19 -1.02 0.14 0.00 0.10 0.00 0.00 66.02 65.04 3mby s SER 243 CO 0.24 -0.11 1.16 -0.54 0.98 0.00 0.00 173.24 174.98 3mby s LYS 244 N -3.80 1.36 0.34 4.02 1.02 -1.26 -4.95 119.74 116.46 3mby s LYS 244 Ca 0.34 -0.51 -0.29 0.00 0.02 0.00 0.00 55.97 55.54 3mby s LYS 244 Cb -0.06 -2.05 -0.12 0.00 -0.52 0.00 0.00 37.83 35.08 3mby s LYS 244 CO 0.23 -1.84 1.46 0.09 -0.92 0.00 0.00 175.35 174.36 3mby n ASN 245 N -3.31 3.48 -0.03 2.83 3.02 -1.26 -1.54 115.26 118.45 3mby n ASN 245 Ca 0.13 1.20 -0.00 0.00 -0.03 0.00 0.00 54.58 55.88 3mby n ASN 245 Cb 0.60 -1.57 -0.00 0.00 -0.61 0.00 0.00 39.78 38.20 3mby n ASN 245 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3mby n ASP 246 N 1.01 -5.99 -4.84 6.41 9.92 -1.26 -4.94 116.55 116.85 3mby n ASP 246 Ca 0.04 0.01 -0.38 0.00 -0.53 0.00 0.00 54.79 53.94 3mby n ASP 246 Cb 0.37 -3.53 -0.06 0.00 -0.64 0.00 0.00 41.12 37.27 3mby n ASP 246 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 3mby s GLU 247 N -2.03 3.82 0.52 -1.24 2.12 -0.59 -5.06 118.70 116.23 3mby s GLU 247 Ca 0.00 0.28 -0.22 0.00 0.36 0.00 0.00 54.97 55.39 3mby s GLU 247 Cb 0.00 -3.22 -0.06 0.00 0.26 0.00 0.00 34.13 31.11 3mby s GLU 247 CO 0.00 0.70 1.30 0.21 -0.54 0.00 0.00 175.26 176.93 3mby s LYS 248 N -1.01 3.32 0.55 4.30 2.20 -1.26 -4.74 119.74 123.10 3mby s LYS 248 Ca 0.22 2.11 -0.19 0.00 -0.36 0.00 0.00 55.97 57.74 3mby s LYS 248 Cb -0.15 -2.30 -0.06 0.00 -1.51 0.00 0.00 37.83 33.81 3mby s LYS 248 CO 0.11 -1.01 1.08 -1.21 -0.36 0.00 0.00 175.35 173.97 3mby s GLU 249 N -2.85 3.43 0.59 4.03 2.02 -1.26 -4.85 118.70 119.81 3mby s GLU 249 Ca 0.69 1.43 -0.14 0.00 0.02 0.00 0.00 54.97 56.97 3mby s GLU 249 Cb -0.37 -2.03 -0.04 0.00 0.10 0.00 0.00 34.13 31.78 3mby s GLU 249 CO 0.44 -0.75 1.03 0.71 0.02 0.00 0.00 175.26 176.71 3mby s TYR 250 N -2.02 3.28 0.64 1.61 2.02 -1.26 -5.02 117.35 116.60 3mby s TYR 250 Ca 0.69 1.44 -0.15 0.00 -0.37 0.00 0.00 57.07 58.67 3mby s TYR 250 Cb -0.20 -2.86 -0.01 0.00 -0.40 0.00 0.00 41.96 38.49 3mby s TYR 250 CO 0.28 -0.82 1.11 -2.14 -1.57 0.00 0.00 175.55 172.40 3mby s PRO 251 N -4.46 2.90 0.42 -1.71 0.02 -1.26 -4.87 135.00 126.04 3mby s PRO 251 Ca 0.59 1.39 -0.23 0.00 0.02 0.00 0.00 61.00 62.77 3mby s PRO 251 Cb -0.13 -1.96 -0.09 0.00 0.02 0.00 0.00 34.50 32.34 3mby s PRO 251 CO 0.42 -1.17 1.01 -1.01 -0.33 0.00 0.00 177.00 175.92 3mby s HIS 252 N -2.31 3.24 0.12 6.54 3.76 -1.26 -4.67 115.29 120.71 3mby s HIS 252 Ca 0.67 1.63 0.07 0.00 -0.15 0.00 0.00 55.06 57.28 3mby s HIS 252 Cb -0.20 -3.03 -0.04 0.00 1.11 0.00 0.00 32.58 30.42 3mby s HIS 252 CO 0.40 -0.49 -0.17 1.03 -0.85 0.00 0.00 174.74 174.66 3mby s ARG 253 N -2.80 1.10 0.19 1.40 1.81 0.11 -4.37 118.95 116.39 3mby s ARG 253 Ca 0.61 -1.24 -0.29 0.00 -1.72 0.00 0.00 55.73 53.09 3mby s ARG 253 Cb -0.17 -1.14 -0.08 0.00 -0.45 0.00 0.00 34.95 33.11 3mby s ARG 253 CO 0.22 0.24 0.91 1.03 -0.68 0.00 0.00 175.30 177.02 3mby s ARG 254 N -2.42 4.76 -0.02 3.54 1.81 -1.26 -0.27 118.95 125.09 3mby s ARG 254 Ca 0.09 1.41 0.01 0.00 -1.72 0.00 0.00 55.73 55.51 3mby s ARG 254 Cb -0.07 -3.31 0.01 0.00 -0.45 0.00 0.00 34.95 31.14 3mby s ARG 254 CO 0.04 0.44 -0.01 -1.50 -0.68 0.00 0.00 175.30 173.59 3mby s ILE 255 N -0.83 0.19 -0.06 1.52 2.07 -0.37 -1.86 121.20 121.85 3mby s ILE 255 Ca 0.41 -0.01 0.06 0.00 -1.41 0.00 0.00 60.65 59.70 3mby s ILE 255 Cb -0.25 -0.22 -0.01 0.00 0.13 0.00 0.00 42.46 42.11 3mby s ILE 255 CO 0.30 0.10 -0.24 -1.81 -1.91 0.00 0.00 174.94 171.38 3mby s ASP 256 N 0.49 2.97 -0.08 4.50 1.11 -0.59 -0.43 116.67 124.64 3mby s ASP 256 Ca -0.05 -0.50 0.02 0.00 0.18 0.00 0.00 52.55 52.20 3mby s ASP 256 Cb -0.08 -0.92 0.01 0.00 1.07 0.00 0.00 42.92 43.01 3mby s ASP 256 CO -0.01 0.22 -0.16 -0.63 1.18 0.00 0.00 175.17 175.77 3mby s ILE 257 N -0.05 1.43 -0.18 0.77 1.01 -0.07 -0.66 121.20 123.45 3mby s ILE 257 Ca -0.06 -0.64 0.00 0.00 0.00 0.00 0.00 60.65 59.95 3mby s ILE 257 Cb -0.14 -1.29 0.04 0.00 0.01 0.00 0.00 42.46 41.08 3mby s ILE 257 CO 0.04 0.42 -0.09 -0.60 0.00 0.00 0.00 174.94 174.72 3mby s ARG 258 N 0.68 1.85 -0.41 2.79 6.06 0.12 -0.76 118.95 129.29 3mby s ARG 258 Ca -0.13 -0.71 -0.22 0.00 -2.50 0.00 0.00 55.73 52.16 3mby s ARG 258 Cb -0.16 -2.25 0.02 0.00 0.06 0.00 0.00 34.95 32.61 3mby s ARG 258 CO 0.03 -0.41 0.73 -1.17 -2.50 0.00 0.00 175.30 171.98 3mby s LEU 259 N 1.48 4.27 0.01 -0.88 2.96 0.05 0.04 118.68 126.61 3mby s LEU 259 Ca -0.00 -0.01 0.06 0.00 -0.22 0.00 0.00 54.13 53.96 3mby s LEU 259 Cb -0.16 -2.90 -0.03 0.00 0.50 0.00 0.00 46.19 43.60 3mby s LEU 259 CO -0.08 -0.79 -0.17 -0.63 -1.32 0.00 0.00 176.35 173.36 3mby s ILE 260 N 3.06 2.87 -0.01 6.68 1.01 -0.43 -4.81 121.20 129.57 3mby s ILE 260 Ca 0.28 -1.02 -0.38 0.00 0.00 0.00 0.00 60.65 59.53 3mby s ILE 260 Cb -0.13 -2.17 -0.16 0.00 0.01 0.00 0.00 42.46 40.00 3mby s ILE 260 CO 0.19 0.43 1.45 -2.65 0.00 0.00 0.00 174.94 174.36 3mby n PRO 261 N 1.83 1.15 -0.20 2.79 -0.02 -1.26 -4.56 135.00 134.73 3mby n PRO 261 Ca -0.16 0.42 0.22 0.00 -2.02 0.00 0.00 63.50 61.95 3mby n PRO 261 Cb 0.52 -2.07 0.59 0.00 -0.02 0.00 0.00 33.50 32.52 3mby n PRO 261 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3mby h LYS 262 N 5.27 0.24 0.00 -0.52 3.64 -1.53 0.20 116.57 123.86 3mby h LYS 262 Ca -0.47 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 3mby h LYS 262 Cb 1.33 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 3mby h LYS 262 CO 0.83 0.16 0.00 -0.40 -2.27 0.00 0.00 179.45 177.77 3mby n ASP 263 N -4.43 0.00 -0.68 4.20 3.85 -1.26 -3.12 116.55 115.11 3mby n ASP 263 Ca 0.18 -0.40 0.06 0.00 -0.71 0.00 0.00 54.79 53.92 3mby n ASP 263 Cb 0.76 -0.20 0.21 0.00 -1.35 0.00 0.00 41.12 40.54 3mby n ASP 263 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3mby n GLN 264 N -1.20 2.10 -0.22 0.11 6.02 0.69 -4.77 117.38 120.11 3mby n GLN 264 Ca 0.17 -2.88 -0.02 0.00 -0.01 0.00 0.00 57.00 54.27 3mby n GLN 264 Cb 0.20 -1.72 0.10 0.00 1.02 0.00 0.00 30.24 29.83 3mby n GLN 264 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 3mby h TYR 265 N 1.03 0.64 -0.39 1.08 3.20 -1.50 -1.74 116.97 119.29 3mby h TYR 265 Ca 0.05 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.90 3mby h TYR 265 Cb 1.33 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.39 3mby h TYR 265 CO 0.48 0.30 0.07 1.88 -1.64 0.00 0.00 178.16 179.25 3mby h TYR 266 N 0.65 0.69 -0.28 -3.82 0.05 -1.88 0.43 116.97 112.81 3mby h TYR 266 Ca 0.29 -0.09 -0.07 0.00 0.05 0.00 0.00 58.73 58.91 3mby h TYR 266 Cb 0.20 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 3mby h TYR 266 CO -0.09 0.68 -0.12 0.00 -1.05 0.00 0.00 178.16 177.59 3mby h GLY 268 N 0.90 0.12 2.00 0.00 0.00 -0.69 -2.24 103.07 103.16 3mby h GLY 268 Ca 0.08 -0.11 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 3mby h GLY 268 CO 0.03 0.10 -0.33 -0.24 0.00 0.00 0.00 176.54 176.10 3mby h VAL 269 N -0.28 1.14 -0.01 4.60 3.04 -0.08 -0.80 116.25 123.86 3mby h VAL 269 Ca 0.01 -1.17 -0.00 0.00 -1.01 0.00 0.00 66.70 64.53 3mby h VAL 269 Cb 0.47 1.65 -0.00 0.00 -2.01 0.00 0.00 31.29 31.40 3mby h VAL 269 CO 0.01 0.33 0.00 0.25 -1.01 0.00 0.00 177.57 177.14 3mby h LEU 270 N 0.00 0.02 0.15 3.16 5.85 -1.27 -1.51 115.31 121.72 3mby h LEU 270 Ca -0.00 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 3mby h LEU 270 Cb 0.62 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.65 3mby h LEU 270 CO 0.04 0.32 -0.08 0.22 -0.34 0.00 0.00 178.44 178.61 3mby h TYR 271 N -0.28 -0.20 0.00 1.25 3.20 -1.13 -2.94 116.97 116.86 3mby h TYR 271 Ca 0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3mby h TYR 271 Cb 0.31 0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.65 3mby h TYR 271 CO 0.03 -0.13 0.00 0.35 -1.64 0.00 0.00 178.16 176.78 3mby h PHE 272 N -0.21 0.00 0.04 -3.82 3.57 -1.15 -2.91 116.94 112.46 3mby h PHE 272 Ca -0.02 0.00 -0.26 0.00 3.53 0.00 0.00 57.97 61.22 3mby h PHE 272 Cb 0.17 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 3mby h PHE 272 CO -0.07 0.00 -1.33 1.15 -2.23 0.00 0.00 178.31 175.83 3mby h THR 273 N 0.00 1.34 -0.17 4.41 2.02 -1.10 0.35 112.91 119.76 3mby h THR 273 Ca 0.00 -3.06 0.00 0.00 0.77 0.00 0.00 66.41 64.12 3mby h THR 273 Cb 0.36 2.73 0.00 0.00 -1.74 0.00 0.00 68.15 69.50 3mby h THR 273 CO 0.00 0.81 0.00 0.61 0.37 0.00 0.00 175.52 177.31 3mby n GLY 274 N 1.50 0.75 3.44 2.16 0.00 -1.10 -4.15 105.19 107.79 3mby n GLY 274 Ca -0.09 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.90 3mby n GLY 274 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mby s SER 275 N -4.00 -0.12 0.12 1.61 1.04 -0.12 -4.77 113.70 107.47 3mby s SER 275 Ca 0.00 0.78 -0.17 0.00 0.48 0.00 0.00 55.95 57.04 3mby s SER 275 Cb 0.00 -1.11 -0.03 0.00 0.10 0.00 0.00 66.02 64.98 3mby s SER 275 CO 0.00 -4.78 1.65 -2.24 0.98 0.00 0.00 173.24 168.86 3mby h ASP 276 N -3.02 0.48 -0.13 7.02 2.03 -1.90 0.10 116.42 121.00 3mby h ASP 276 Ca -0.45 -0.18 -0.10 0.00 -0.73 0.00 0.00 57.03 55.57 3mby h ASP 276 Cb 1.32 -0.13 -0.01 0.00 -0.83 0.00 0.00 39.33 39.68 3mby h ASP 276 CO 0.32 0.53 -0.23 0.40 -1.03 0.00 0.00 179.24 179.23 3mby h ILE 277 N 0.40 1.27 -0.51 4.15 2.04 -1.93 -1.97 117.51 120.96 3mby h ILE 277 Ca 0.11 -1.27 -0.02 0.00 1.00 0.00 0.00 64.86 64.68 3mby h ILE 277 Cb 0.21 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 3mby h ILE 277 CO -0.01 0.41 0.22 0.15 0.00 0.00 0.00 178.15 178.93 3mby h PHE 278 N 0.50 0.75 -0.51 1.37 3.04 -1.68 -0.88 116.94 119.53 3mby h PHE 278 Ca 0.07 -0.05 -0.01 0.00 3.98 0.00 0.00 57.97 61.97 3mby h PHE 278 Cb 0.67 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.93 3mby h PHE 278 CO 0.03 0.61 0.30 -0.91 -2.02 0.00 0.00 178.31 176.32 3mby h ASN 279 N 0.68 0.62 -0.37 0.41 4.21 -0.50 0.45 115.58 121.07 3mby h ASN 279 Ca 0.17 -0.07 -0.01 0.00 1.21 0.00 0.00 56.30 57.60 3mby h ASN 279 Cb 0.16 -0.16 -0.02 0.00 -1.12 0.00 0.00 38.32 37.19 3mby h ASN 279 CO -0.02 0.51 0.18 0.11 -1.29 0.00 0.00 177.43 176.92 3mby h LYS 280 N 0.69 0.54 -0.38 0.81 1.57 -1.09 0.86 116.57 119.57 3mby h LYS 280 Ca 0.18 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 3mby h LYS 280 Cb 0.01 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 3mby h LYS 280 CO -0.03 0.49 0.19 -0.91 -0.57 0.00 0.00 179.45 178.61 3mby h ASN 281 N 0.46 0.48 -0.54 0.86 2.35 -0.94 -1.15 115.58 117.11 3mby h ASN 281 Ca 0.13 -0.11 -0.06 0.00 -0.55 0.00 0.00 56.30 55.70 3mby h ASN 281 Cb 0.13 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 3mby h ASN 281 CO -0.02 0.46 0.09 -0.03 -1.65 0.00 0.00 177.43 176.28 3mby h MET 282 N 0.47 0.89 -0.11 0.81 4.05 -0.66 -0.81 114.93 119.56 3mby h MET 282 Ca 0.13 -0.24 -0.09 0.00 -0.28 0.00 0.00 59.70 59.22 3mby h MET 282 Cb 0.10 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.78 3mby h MET 282 CO -0.02 0.86 -0.32 0.00 0.23 0.00 0.00 176.91 177.66 3mby h ARG 283 N 0.78 0.22 -0.27 0.39 3.08 -0.73 -0.65 114.38 117.20 3mby h ARG 283 Ca 0.16 -0.09 -0.19 0.00 0.07 0.00 0.00 59.98 59.94 3mby h ARG 283 Cb 0.40 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.44 3mby h ARG 283 CO 0.01 0.53 -0.57 0.00 -1.07 0.00 0.00 179.97 178.87 3mby h ALA 284 N 1.47 0.48 -0.62 0.04 0.00 -0.94 -2.68 119.26 117.01 3mby h ALA 284 Ca 0.03 -0.52 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 3mby h ALA 284 Cb 0.67 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3mby h ALA 284 CO 0.05 0.68 0.05 1.25 0.00 0.00 0.00 179.25 181.28 3mby h HIS 285 N 0.64 1.14 -0.50 0.00 -0.00 -0.82 -2.35 115.15 113.27 3mby h HIS 285 Ca 0.01 -0.17 0.05 0.00 -0.00 0.00 0.00 60.37 60.25 3mby h HIS 285 Cb 1.17 -0.31 -0.05 0.00 -0.00 0.00 0.00 27.41 28.23 3mby h HIS 285 CO 0.07 0.98 0.24 0.00 -0.00 0.00 0.00 177.93 179.22 3mby h ALA 286 N 1.06 0.63 -0.14 5.26 0.00 -1.05 -0.73 119.26 124.30 3mby h ALA 286 Ca 0.18 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.15 3mby h ALA 286 Cb 0.49 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3mby h ALA 286 CO 0.02 -0.12 -0.04 -0.07 0.00 0.00 0.00 179.25 179.04 3mby h LEU 287 N 0.46 -0.14 -2.18 0.00 3.38 -1.04 0.21 115.31 116.00 3mby h LEU 287 Ca 0.22 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.28 3mby h LEU 287 Cb 0.15 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3mby h LEU 287 CO -0.17 -0.05 0.14 -0.33 0.09 0.00 0.00 178.44 178.12 3mby h GLU 288 N -0.01 0.00 -0.15 1.13 5.08 -0.91 0.12 114.58 119.83 3mby h GLU 288 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3mby h GLU 288 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3mby h GLU 288 CO -0.15 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.49 3mby n LYS 289 N -4.09 1.87 -1.71 2.33 4.76 -0.12 -4.94 118.16 116.27 3mby n LYS 289 Ca 0.01 -1.30 0.00 0.00 -2.87 0.00 0.00 58.31 54.15 3mby n LYS 289 Cb 0.27 -1.44 0.00 0.00 -1.84 0.00 0.00 35.03 32.02 3mby n LYS 289 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3mby n GLY 290 N 1.21 0.74 3.18 0.72 0.00 0.40 -5.00 105.19 106.43 3mby n GLY 290 Ca 0.17 -0.69 -0.11 0.00 0.00 0.00 0.00 46.02 45.40 3mby n GLY 290 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3mby s PHE 291 N -2.18 0.98 -0.02 1.61 0.40 0.55 -0.96 117.98 118.36 3mby s PHE 291 Ca 0.00 -1.21 0.01 0.00 -0.60 0.00 0.00 56.93 55.13 3mby s PHE 291 Cb 0.00 -0.54 0.01 0.00 0.51 0.00 0.00 43.02 43.00 3mby s PHE 291 CO 0.00 -0.47 -0.04 -0.08 0.70 0.00 0.00 175.22 175.33 3mby s THR 292 N -3.98 0.40 -0.06 0.64 -1.32 0.41 -2.06 115.64 109.67 3mby s THR 292 Ca 0.26 -0.12 0.05 0.00 -1.21 0.00 0.00 61.69 60.67 3mby s THR 292 Cb 0.07 -0.40 -0.01 0.00 -1.51 0.00 0.00 72.50 70.65 3mby s THR 292 CO 0.04 0.16 -0.21 -0.63 -2.21 0.00 0.00 174.62 171.76 3mby s ILE 293 N 0.47 1.77 0.25 5.08 1.01 -1.26 -1.39 121.20 127.12 3mby s ILE 293 Ca -0.05 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.73 3mby s ILE 293 Cb -0.09 -1.51 -0.01 0.00 0.01 0.00 0.00 42.46 40.86 3mby s ILE 293 CO -0.00 0.50 0.12 -0.46 0.00 0.00 0.00 174.94 175.09 3mby n ASN 294 N 3.12 0.64 0.00 3.58 0.23 -0.61 -4.94 115.26 117.28 3mby n ASN 294 Ca -0.18 -2.41 0.09 0.00 -0.53 0.00 0.00 54.58 51.55 3mby n ASN 294 Cb 0.52 0.79 0.49 0.00 -2.08 0.00 0.00 39.78 39.51 3mby n ASN 294 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 3mby n GLU 295 N -0.54 0.46 -0.07 -3.83 0.00 -1.26 -3.49 120.64 111.92 3mby n GLU 295 Ca -0.01 0.03 -0.10 0.00 0.00 0.00 0.00 57.16 57.08 3mby n GLU 295 Cb 0.39 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.28 3mby n GLU 295 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3mby n TYR 296 N -1.08 0.00 -3.98 -1.84 4.01 -1.26 -2.27 117.16 110.74 3mby n TYR 296 Ca 0.12 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.75 3mby n TYR 296 Cb 0.08 -0.51 -0.03 0.00 -0.31 0.00 0.00 39.34 38.57 3mby n TYR 296 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3mby s THR 297 N -2.26 0.00 -0.12 -0.72 -4.23 -1.23 -4.70 115.64 102.38 3mby s THR 297 Ca -0.18 -1.37 -0.00 0.00 -1.18 0.00 0.00 61.69 58.95 3mby s THR 297 Cb 0.05 -2.48 0.02 0.00 1.34 0.00 0.00 72.50 71.43 3mby s THR 297 CO 0.30 0.00 -0.10 -0.51 -0.54 0.00 0.00 174.62 173.77 3mby s ILE 298 N -3.33 1.19 0.12 2.99 2.07 -1.26 -1.57 121.20 121.42 3mby s ILE 298 Ca 0.23 -0.40 0.08 0.00 -1.41 0.00 0.00 60.65 59.15 3mby s ILE 298 Cb -0.02 -1.17 -0.04 0.00 0.13 0.00 0.00 42.46 41.36 3mby s ILE 298 CO 0.13 0.40 -0.19 -0.13 -1.91 0.00 0.00 174.94 173.24 3mby s ARG 299 N 1.59 1.13 0.67 3.50 0.52 -0.49 -0.96 118.95 124.91 3mby s ARG 299 Ca 0.04 -1.22 -0.11 0.00 -0.52 0.00 0.00 55.73 53.92 3mby s ARG 299 Cb -0.13 -1.27 -0.01 0.00 0.52 0.00 0.00 34.95 34.07 3mby s ARG 299 CO -0.08 0.28 1.06 -1.25 0.02 0.00 0.00 175.30 175.32 3mby s PRO 300 N -2.24 3.13 -0.21 3.54 0.04 -1.26 -0.45 135.00 137.55 3mby s PRO 300 Ca 0.09 0.53 -0.07 0.00 0.04 0.00 0.00 61.00 61.58 3mby s PRO 300 Cb -0.08 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 3mby s PRO 300 CO 0.05 -0.84 0.06 -0.51 0.04 0.00 0.00 177.00 175.80 3mby s LEU 301 N -5.26 3.64 0.94 -3.56 1.43 -0.14 -0.72 118.68 115.01 3mby s LEU 301 Ca 0.57 -0.04 -0.12 0.00 -1.03 0.00 0.00 54.13 53.51 3mby s LEU 301 Cb -0.11 -1.94 0.15 0.00 0.03 0.00 0.00 46.19 44.33 3mby s LEU 301 CO 0.52 0.10 1.09 -0.83 0.23 0.00 0.00 176.35 177.46 3mby s GLY 302 N 0.83 1.60 0.18 -3.19 0.00 0.17 -4.78 107.32 102.13 3mby s GLY 302 Ca 0.03 -0.14 0.09 0.00 0.00 0.00 0.00 44.72 44.70 3mby s GLY 302 CO 0.02 0.39 1.17 -0.62 0.00 0.00 0.00 173.10 174.07 3mby n VAL 303 N -4.03 1.06 0.10 1.40 0.31 -1.26 0.64 118.33 116.55 3mby n VAL 303 Ca 0.06 0.64 0.08 0.00 -0.01 0.00 0.00 64.34 65.11 3mby n VAL 303 Cb 0.56 -1.64 0.16 0.00 -0.91 0.00 0.00 33.84 32.01 3mby n VAL 303 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3mby n THR 304 N -1.79 0.61 -1.02 2.52 -2.24 -1.26 -4.95 114.28 106.15 3mby n THR 304 Ca -0.01 -0.81 -0.01 0.00 -2.27 0.00 0.00 64.05 60.96 3mby n THR 304 Cb 0.19 0.82 -0.00 0.00 -2.10 0.00 0.00 70.33 69.23 3mby n THR 304 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mby n GLY 305 N 0.90 0.46 3.70 3.38 0.00 0.21 -5.03 105.19 108.80 3mby n GLY 305 Ca 0.13 -0.86 -0.36 0.00 0.00 0.00 0.00 46.02 44.93 3mby n GLY 305 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mby s VAL 306 N -2.02 5.33 0.32 1.61 1.01 -1.25 -4.76 120.40 120.65 3mby s VAL 306 Ca 0.00 0.37 -0.29 0.00 0.00 0.00 0.00 61.98 62.06 3mby s VAL 306 Cb 0.00 -3.57 -0.12 0.00 0.00 0.00 0.00 36.38 32.69 3mby s VAL 306 CO 0.00 0.36 1.43 0.00 0.00 0.00 0.00 175.10 176.89 3mby n ALA 307 N 3.95 1.84 -1.83 5.51 0.00 -1.26 -0.65 120.51 128.06 3mby n ALA 307 Ca -0.13 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.67 3mby n ALA 307 Cb 0.52 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.62 3mby n ALA 307 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mby n GLY 308 N 1.21 1.61 3.80 0.00 0.00 0.10 -4.86 105.19 107.06 3mby n GLY 308 Ca 0.06 -1.90 -0.36 0.00 0.00 0.00 0.00 46.02 43.82 3mby n GLY 308 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mby s GLU 309 N 2.94 4.40 0.25 1.61 0.41 -1.26 -4.74 118.70 122.32 3mby s GLU 309 Ca 0.00 1.11 -0.30 0.00 -0.41 0.00 0.00 54.97 55.37 3mby s GLU 309 Cb 0.00 -2.75 -0.14 0.00 -1.78 0.00 0.00 34.13 29.46 3mby s GLU 309 CO 0.00 0.28 1.22 -2.30 -0.49 0.00 0.00 175.26 173.97 3mby n PRO 310 N 0.45 1.65 -2.98 0.39 -0.02 -1.26 -4.40 135.00 128.83 3mby n PRO 310 Ca 0.01 0.59 -0.31 0.00 -2.02 0.00 0.00 63.50 61.77 3mby n PRO 310 Cb 0.51 -2.11 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 3mby n PRO 310 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3mby s LEU 311 N 0.15 3.92 0.25 2.45 1.43 -0.13 -5.00 118.68 121.75 3mby s LEU 311 Ca 0.65 1.14 -0.30 0.00 -1.03 0.00 0.00 54.13 54.59 3mby s LEU 311 Cb -0.70 -3.99 -0.10 0.00 0.03 0.00 0.00 46.19 41.43 3mby s LEU 311 CO 0.55 -0.32 1.39 -2.16 0.23 0.00 0.00 176.35 176.04 3mby s PRO 312 N -3.55 4.31 -0.03 1.29 0.04 -1.26 -4.75 135.00 131.04 3mby s PRO 312 Ca 0.51 2.23 -0.00 0.00 0.04 0.00 0.00 61.00 63.78 3mby s PRO 312 Cb -0.10 -3.13 0.03 0.00 0.04 0.00 0.00 34.50 31.34 3mby s PRO 312 CO 0.27 -0.35 0.02 0.08 0.04 0.00 0.00 177.00 177.06 3mby s VAL 313 N -0.11 0.11 -0.01 -0.36 1.01 -1.26 -4.98 120.40 114.80 3mby s VAL 313 Ca 0.57 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.74 3mby s VAL 313 Cb -0.40 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 35.76 3mby s VAL 313 CO 0.43 0.15 0.90 0.47 0.00 0.00 0.00 175.10 177.05 3mby n ASP 314 N 4.45 1.51 -3.61 3.32 8.00 -1.26 -4.96 116.55 124.00 3mby n ASP 314 Ca -0.21 -1.86 -0.01 0.00 0.71 0.00 0.00 54.79 53.42 3mby n ASP 314 Cb 0.50 -0.04 -0.01 0.00 -0.02 0.00 0.00 41.12 41.55 3mby n ASP 314 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3mby s SER 315 N -0.92 -0.06 0.29 -2.24 1.04 -1.26 -5.00 113.70 105.55 3mby s SER 315 Ca 0.03 -0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.44 3mby s SER 315 Cb 0.02 0.08 0.44 0.00 0.10 0.00 0.00 66.02 66.66 3mby s SER 315 CO 0.00 -0.14 1.79 -0.33 0.98 0.00 0.00 173.24 175.55 3mby h GLU 316 N 2.00 0.65 -0.65 4.02 5.08 -1.98 -2.69 114.58 121.02 3mby h GLU 316 Ca -0.15 -0.17 0.06 0.00 -1.00 0.00 0.00 59.36 58.09 3mby h GLU 316 Cb 1.16 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.30 3mby h GLU 316 CO 0.24 0.70 0.43 -0.22 -1.00 0.00 0.00 179.01 179.16 3mby h LYS 317 N 0.61 0.65 -0.82 2.33 3.64 -1.98 -0.72 116.57 120.29 3mby h LYS 317 Ca 0.12 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 3mby h LYS 317 Cb 0.44 -0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.07 3mby h LYS 317 CO 0.02 0.43 0.54 -0.44 -2.27 0.00 0.00 179.45 177.73 3mby h ASP 318 N 0.67 0.83 -0.25 4.20 3.32 -1.86 0.90 116.42 124.22 3mby h ASP 318 Ca 0.28 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.30 3mby h ASP 318 Cb 0.24 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3mby h ASP 318 CO -0.08 0.55 0.06 0.40 -1.72 0.00 0.00 179.24 178.44 3mby h ILE 319 N 0.95 1.22 -0.67 0.35 2.04 -1.22 -2.16 117.51 118.02 3mby h ILE 319 Ca 0.34 -0.71 0.01 0.00 1.00 0.00 0.00 64.86 65.50 3mby h ILE 319 Cb 0.14 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 3mby h ILE 319 CO -0.11 0.23 0.44 -0.26 0.00 0.00 0.00 178.15 178.45 3mby h PHE 320 N 0.23 0.83 -0.84 1.37 -1.00 -1.11 -2.78 116.94 113.64 3mby h PHE 320 Ca 0.08 0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.92 3mby h PHE 320 Cb 0.29 -0.28 -0.05 0.00 3.61 0.00 0.00 35.95 39.52 3mby h PHE 320 CO 0.01 0.51 0.54 -0.44 -1.61 0.00 0.00 178.31 177.32 3mby h ASP 321 N 0.89 0.88 -0.83 2.17 3.32 -0.64 -1.15 116.42 121.05 3mby h ASP 321 Ca 0.25 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.38 3mby h ASP 321 Cb -0.08 -0.19 -0.07 0.00 0.22 0.00 0.00 39.33 39.21 3mby h ASP 321 CO -0.06 0.59 0.49 1.88 -1.72 0.00 0.00 179.24 180.42 3mby h TYR 322 N 1.03 0.89 -0.51 4.55 0.05 -1.10 -1.65 116.97 120.24 3mby h TYR 322 Ca 0.34 0.03 0.00 0.00 0.05 0.00 0.00 58.73 59.15 3mby h TYR 322 Cb 0.05 -0.28 0.00 0.00 1.01 0.00 0.00 36.73 37.51 3mby h TYR 322 CO -0.03 0.40 0.00 0.44 -1.05 0.00 0.00 178.16 177.92 3mby n ILE 323 N -4.70 1.35 -3.63 -2.88 -5.35 -0.99 -4.95 119.36 98.20 3mby n ILE 323 Ca 0.13 -0.89 -0.23 0.00 -0.27 0.00 0.00 62.75 61.50 3mby n ILE 323 Cb 0.24 0.06 0.06 0.00 -1.74 0.00 0.00 39.64 38.27 3mby n ILE 323 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3mby n GLN 324 N 0.84 -6.67 -4.87 6.28 6.02 -0.62 -4.94 117.38 113.43 3mby n GLN 324 Ca 0.20 0.76 -0.33 0.00 -0.01 0.00 0.00 57.00 57.62 3mby n GLN 324 Cb 0.69 -5.69 -0.14 0.00 1.02 0.00 0.00 30.24 26.12 3mby n GLN 324 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 3mby s TRP 325 N -3.38 2.73 0.57 1.08 0.52 -0.50 -5.02 118.94 114.93 3mby s TRP 325 Ca 0.35 -0.35 -0.19 0.00 0.02 0.00 0.00 56.10 55.94 3mby s TRP 325 Cb -0.16 -1.70 -0.05 0.00 -1.15 0.00 0.00 33.47 30.41 3mby s TRP 325 CO 0.76 0.03 1.15 0.15 0.02 0.00 0.00 176.95 179.07 3mby s LYS 326 N -0.34 3.18 0.45 4.98 1.02 -1.26 -4.08 119.74 123.70 3mby s LYS 326 Ca 0.03 1.65 -0.24 0.00 0.02 0.00 0.00 55.97 57.43 3mby s LYS 326 Cb -0.13 -1.98 -0.08 0.00 -0.52 0.00 0.00 37.83 35.13 3mby s LYS 326 CO 0.02 -1.00 1.30 -0.47 -0.92 0.00 0.00 175.35 174.29 3mby s TYR 327 N -1.78 2.67 -0.10 3.18 5.04 -1.26 -5.01 117.35 120.09 3mby s TYR 327 Ca 0.74 1.41 -0.00 0.00 -2.44 0.00 0.00 57.07 56.77 3mby s TYR 327 Cb -0.25 -3.67 0.02 0.00 0.35 0.00 0.00 41.96 38.41 3mby s TYR 327 CO 0.30 -2.26 -0.06 1.03 -1.34 0.00 0.00 175.55 173.22 3mby s ARG 328 N -2.50 1.35 0.92 4.97 0.52 -1.26 -5.13 118.95 117.82 3mby s ARG 328 Ca 0.62 -0.19 -0.10 0.00 -0.52 0.00 0.00 55.73 55.53 3mby s ARG 328 Cb -0.37 -1.45 0.15 0.00 0.52 0.00 0.00 34.95 33.80 3mby s ARG 328 CO 0.47 -0.25 1.15 -1.21 0.02 0.00 0.00 175.30 175.48 3mby s GLU 329 N 1.67 0.99 0.27 3.54 0.41 -1.26 -4.84 118.70 119.47 3mby s GLU 329 Ca 0.03 1.57 -0.01 0.00 -0.41 0.00 0.00 54.97 56.16 3mby s GLU 329 Cb -0.13 -1.72 0.52 0.00 -1.78 0.00 0.00 34.13 31.02 3mby s GLU 329 CO -0.07 -2.66 1.80 -1.35 -0.49 0.00 0.00 175.26 172.49 3mby h PRO 330 N -1.88 0.76 0.00 0.39 0.11 -1.93 -0.39 132.00 129.06 3mby h PRO 330 Ca -0.43 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3mby h PRO 330 Cb 1.27 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3mby h PRO 330 CO 0.41 0.51 0.07 1.57 -0.21 0.00 0.00 178.00 180.35 3mby h LYS 331 N 0.79 0.00 -0.42 1.05 2.10 -1.80 -0.50 116.57 117.78 3mby h LYS 331 Ca 0.46 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 59.10 3mby h LYS 331 Cb 0.55 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.87 3mby h LYS 331 CO -0.30 0.00 0.01 -0.25 -2.00 0.00 0.00 179.45 176.91 3mby n ASP 332 N -2.80 4.73 -0.57 7.07 8.00 -0.16 -4.35 116.55 128.46 3mby n ASP 332 Ca -0.02 -3.01 0.06 0.00 0.71 0.00 0.00 54.79 52.53 3mby n ASP 332 Cb 0.12 -0.62 0.17 0.00 -0.02 0.00 0.00 41.12 40.78 3mby n ASP 332 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3mby n ARG 333 N -0.02 2.72 -2.74 -1.24 1.74 -0.20 -4.88 116.66 112.05 3mby n ARG 333 Ca 0.25 -2.33 -0.43 0.00 -0.77 0.00 0.00 57.85 54.57 3mby n ARG 333 Cb 1.05 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 31.02 3mby n ARG 333 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3mby n SER 334 N -0.24 5.09 -0.88 0.55 7.64 -1.26 -0.94 113.62 123.59 3mby n SER 334 Ca 0.14 -2.98 0.11 0.00 1.01 0.00 0.00 58.87 57.16 3mby n SER 334 Cb 0.60 -1.60 0.09 0.00 -1.01 0.00 0.00 64.21 62.28 3mby n SER 334 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41