#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oco h PHE 2 N 0.00 0.71 0.64 2.03 3.04 -2.03 -3.07 116.94 118.26 1oco h PHE 2 Ca 0.00 -0.43 -0.02 0.00 3.98 0.00 0.00 57.97 61.50 1oco h PHE 2 Cb 0.00 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 38.44 1oco h PHE 2 CO 0.00 1.28 -0.45 0.82 -2.02 0.00 0.00 178.31 177.94 1oco h ILE 3 N -0.06 0.10 -0.82 1.41 1.08 -2.00 0.99 117.51 118.21 1oco h ILE 3 Ca -0.12 0.00 0.22 0.00 -0.39 0.00 0.00 64.86 64.57 1oco h ILE 3 Cb 1.55 0.10 -0.04 0.00 -3.07 0.00 0.00 36.82 35.36 1oco h ILE 3 CO 0.16 0.00 0.57 0.78 -0.69 0.00 0.00 178.15 178.97 1oco h ASN 4 N -1.04 0.15 0.00 1.72 4.21 -1.94 0.51 115.58 119.19 1oco h ASN 4 Ca -0.08 0.02 -0.14 0.00 1.21 0.00 0.00 56.30 57.30 1oco h ASN 4 Cb 0.86 -0.01 -0.02 0.00 -1.12 0.00 0.00 38.32 38.03 1oco h ASN 4 CO 0.05 0.06 -0.77 -0.09 -1.29 0.00 0.00 177.43 175.39 1oco h ARG 5 N 0.15 0.00 0.00 0.81 2.43 -1.40 -3.30 114.38 113.08 1oco h ARG 5 Ca 0.41 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 1oco h ARG 5 Cb 1.36 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.91 1oco h ARG 5 CO -0.07 1.00 -1.34 0.91 -1.51 0.00 0.00 179.97 178.95 1oco n TRP 6 N -4.50 0.54 -0.06 2.20 7.02 0.32 -3.74 117.44 119.22 1oco n TRP 6 Ca -0.24 0.16 -0.05 0.00 -1.02 0.00 0.00 57.50 56.35 1oco n TRP 6 Cb 0.60 -0.73 -0.10 0.00 -2.42 0.00 0.00 31.31 28.67 1oco n TRP 6 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1oco n LEU 7 N -2.43 0.00 -1.19 -0.99 4.77 0.17 -4.66 117.00 112.68 1oco n LEU 7 Ca -0.01 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.93 1oco n LEU 7 Cb 0.54 0.29 0.20 0.00 -2.33 0.00 0.00 43.42 42.12 1oco n LEU 7 CO 0.42 0.29 0.72 0.49 -1.33 0.00 0.00 177.39 177.98 1oco n PHE 8 N -2.43 1.17 -1.23 -1.77 3.72 -0.61 -5.01 117.46 111.30 1oco n PHE 8 Ca -0.19 -1.54 -0.34 0.00 -0.05 0.00 0.00 57.45 55.32 1oco n PHE 8 Cb 0.87 -0.50 0.11 0.00 -0.94 0.00 0.00 39.48 39.03 1oco n PHE 8 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1oco n SER 9 N -1.07 0.85 -2.05 4.37 2.88 -1.24 -4.86 113.62 112.50 1oco n SER 9 Ca 0.33 0.62 -0.01 0.00 -1.33 0.00 0.00 58.87 58.49 1oco n SER 9 Cb 1.05 -1.47 0.03 0.00 -0.75 0.00 0.00 64.21 63.08 1oco n SER 9 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1oco n THR 10 N -2.95 0.37 -4.01 2.46 -2.24 -1.26 -4.73 114.28 101.91 1oco n THR 10 Ca 0.13 -1.34 -0.31 0.00 -2.27 0.00 0.00 64.05 60.26 1oco n THR 10 Cb 0.50 0.98 -0.16 0.00 -2.10 0.00 0.00 70.33 69.55 1oco n THR 10 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1oco s ASN 11 N -2.11 3.23 0.40 3.42 3.84 -1.26 -4.89 114.94 117.57 1oco s ASN 11 Ca 0.19 -0.78 0.18 0.00 0.21 0.00 0.00 52.86 52.66 1oco s ASN 11 Cb 0.30 -1.25 1.09 0.00 -0.55 0.00 0.00 41.25 40.84 1oco s ASN 11 CO -0.09 -0.11 1.80 1.12 -2.79 0.00 0.00 177.10 177.03 1oco h HIS 12 N 7.98 0.63 0.39 0.43 2.07 -1.93 0.71 115.15 125.44 1oco h HIS 12 Ca -0.32 0.02 -0.02 0.00 -2.85 0.00 0.00 60.37 57.21 1oco h HIS 12 Cb 1.11 -0.19 0.00 0.00 2.57 0.00 0.00 27.41 30.91 1oco h HIS 12 CO 0.50 0.10 -0.19 0.87 -3.07 0.00 0.00 177.93 176.14 1oco h LYS 13 N 0.41 -0.51 -0.89 5.12 1.57 -1.90 -0.62 116.57 119.76 1oco h LYS 13 Ca 0.56 0.03 0.26 0.00 -1.87 0.00 0.00 60.65 59.63 1oco h LYS 13 Cb 1.39 0.12 -0.04 0.00 0.08 0.00 0.00 32.23 33.78 1oco h LYS 13 CO -0.26 -0.34 0.69 -0.44 -0.57 0.00 0.00 179.45 178.54 1oco h ASP 14 N -1.03 0.00 0.06 0.86 3.32 -1.74 0.18 116.42 118.07 1oco h ASP 14 Ca -0.05 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 1oco h ASP 14 Cb 0.40 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.96 1oco h ASP 14 CO 0.09 0.00 -0.42 0.40 -1.72 0.00 0.00 179.24 177.59 1oco h ILE 15 N 0.00 1.62 -0.90 0.35 2.04 -0.87 -2.63 117.51 117.12 1oco h ILE 15 Ca 0.42 -2.35 0.13 0.00 1.00 0.00 0.00 64.86 64.06 1oco h ILE 15 Cb 1.80 3.18 -0.07 0.00 -0.74 0.00 0.00 36.82 40.99 1oco h ILE 15 CO -0.00 0.64 0.58 1.23 0.00 0.00 0.00 178.15 180.60 1oco h GLY 16 N -0.61 1.28 1.07 5.37 0.00 0.92 0.15 103.07 111.25 1oco h GLY 16 Ca -0.07 -0.33 -0.12 0.00 0.00 0.00 0.00 47.33 46.82 1oco h GLY 16 CO 0.08 0.12 -0.15 -0.84 0.00 0.00 0.00 176.54 175.75 1oco h THR 17 N 0.77 1.27 -0.43 4.70 2.02 -1.16 -1.98 112.91 118.09 1oco h THR 17 Ca 0.45 -1.30 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 1oco h THR 17 Cb 0.63 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 1oco h THR 17 CO -0.21 0.45 0.20 0.25 0.37 0.00 0.00 175.52 176.58 1oco h LEU 18 N 0.80 0.54 0.36 2.58 5.85 -0.62 -1.53 115.31 123.28 1oco h LEU 18 Ca 0.12 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1oco h LEU 18 Cb 0.71 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1oco h LEU 18 CO 0.05 0.47 -0.17 1.88 -0.34 0.00 0.00 178.44 180.34 1oco h TYR 19 N 0.61 -0.44 -1.02 1.25 0.05 -0.92 -1.81 116.97 114.68 1oco h TYR 19 Ca 0.15 -0.01 0.25 0.00 0.05 0.00 0.00 58.73 59.17 1oco h TYR 19 Cb 0.08 0.15 -0.11 0.00 1.01 0.00 0.00 36.73 37.86 1oco h TYR 19 CO 0.00 -0.11 0.63 -0.07 -1.05 0.00 0.00 178.16 177.57 1oco h LEU 20 N -0.94 0.58 -0.14 3.88 3.38 -1.13 0.62 115.31 121.55 1oco h LEU 20 Ca -0.05 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1oco h LEU 20 Cb 0.53 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1oco h LEU 20 CO 0.08 0.12 0.00 -0.07 0.09 0.00 0.00 178.44 178.66 1oco h LEU 21 N 0.52 0.25 0.16 1.67 3.38 -1.18 0.20 115.31 120.30 1oco h LEU 21 Ca 0.61 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 1oco h LEU 21 Cb 1.31 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1oco h LEU 21 CO -0.37 0.50 -0.08 0.15 0.09 0.00 0.00 178.44 178.73 1oco h PHE 22 N -0.00 -0.20 -0.36 1.13 3.04 -0.00 -2.06 116.94 118.48 1oco h PHE 22 Ca 0.04 -0.00 0.08 0.00 3.98 0.00 0.00 57.97 62.07 1oco h PHE 22 Cb 0.37 0.07 -0.08 0.00 2.56 0.00 0.00 35.95 38.86 1oco h PHE 22 CO 0.03 -0.08 -0.21 0.78 -2.02 0.00 0.00 178.31 176.82 1oco h GLY 23 N -0.26 0.03 0.84 2.40 0.00 0.24 0.09 103.07 106.42 1oco h GLY 23 Ca -0.02 0.26 0.06 0.00 0.00 0.00 0.00 47.33 47.63 1oco h GLY 23 CO 0.04 -0.19 0.62 0.00 0.00 0.00 0.00 176.54 177.00 1oco h ALA 24 N 1.07 1.45 0.11 3.60 0.00 -0.43 0.90 119.26 125.96 1oco h ALA 24 Ca 0.18 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1oco h ALA 24 Cb 0.43 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1oco h ALA 24 CO -0.46 0.42 -0.05 2.35 0.00 0.00 0.00 179.25 181.51 1oco h TRP 25 N 1.12 -0.14 -0.21 0.00 7.01 -0.63 -1.90 115.95 121.20 1oco h TRP 25 Ca 0.40 -0.00 0.06 0.00 2.11 0.00 0.00 58.89 61.46 1oco h TRP 25 Cb 0.14 0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.24 1oco h TRP 25 CO -0.00 0.23 0.15 0.00 -2.79 0.00 0.00 178.44 176.03 1oco h ALA 26 N 0.28 2.19 -0.66 2.65 0.00 -0.74 0.17 119.26 123.15 1oco h ALA 26 Ca -0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1oco h ALA 26 Cb 0.43 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1oco h ALA 26 CO 0.03 -0.26 0.25 0.78 0.00 0.00 0.00 179.25 180.04 1oco h GLY 27 N 0.00 1.05 0.88 0.00 0.00 -0.31 -0.99 103.07 103.71 1oco h GLY 27 Ca 0.10 -0.56 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 1oco h GLY 27 CO -0.00 0.53 0.04 -0.33 0.00 0.00 0.00 176.54 176.78 1oco h MET 28 N 0.96 0.50 -0.02 4.80 2.07 0.10 -2.28 114.93 121.06 1oco h MET 28 Ca 0.22 -0.14 0.01 0.00 -2.07 0.00 0.00 59.70 57.72 1oco h MET 28 Cb 0.20 -0.06 -0.01 0.00 -1.87 0.00 0.00 31.60 29.87 1oco h MET 28 CO -0.02 0.61 -0.02 0.28 1.07 0.00 0.00 176.91 178.83 1oco h VAL 29 N 0.31 0.94 -0.13 -2.22 2.07 -1.09 -2.54 116.25 113.59 1oco h VAL 29 Ca 0.09 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 1oco h VAL 29 Cb 0.36 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1oco h VAL 29 CO 0.01 0.00 -0.01 1.23 0.02 0.00 0.00 177.57 178.82 1oco h GLY 30 N -0.03 0.20 0.98 2.17 0.00 -1.16 -1.95 103.07 103.28 1oco h GLY 30 Ca 0.02 -0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.17 1oco h GLY 30 CO -0.04 0.09 -0.04 -0.84 0.00 0.00 0.00 176.54 175.71 1oco h THR 31 N 0.19 1.27 -0.27 4.70 2.02 -1.14 -0.97 112.91 118.70 1oco h THR 31 Ca 0.05 -1.10 0.03 0.00 0.77 0.00 0.00 66.41 66.16 1oco h THR 31 Cb 0.15 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.65 1oco h THR 31 CO 0.00 0.37 0.07 0.00 0.37 0.00 0.00 175.52 176.34 1oco h ALA 32 N 0.88 0.30 -0.70 6.16 0.00 -0.97 -0.96 119.26 123.97 1oco h ALA 32 Ca 0.12 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1oco h ALA 32 Cb 0.54 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1oco h ALA 32 CO 0.03 -0.34 0.29 -0.07 0.00 0.00 0.00 179.25 179.16 1oco h LEU 33 N 0.19 0.94 -1.61 0.00 3.38 -1.26 -0.25 115.31 116.70 1oco h LEU 33 Ca 0.12 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1oco h LEU 33 Cb 0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1oco h LEU 33 CO -0.14 0.83 -0.21 0.77 0.09 0.00 0.00 178.44 179.77 1oco h SER 34 N 1.01 0.00 0.25 -0.43 4.64 -0.41 -1.13 113.55 117.48 1oco h SER 34 Ca 0.24 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.26 1oco h SER 34 Cb 0.18 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.29 1oco h SER 34 CO -0.02 0.21 -1.28 -0.07 -0.87 0.00 0.00 176.83 174.80 1oco h LEU 35 N 0.00 0.78 -0.57 5.97 3.38 -0.05 -2.75 115.31 122.07 1oco h LEU 35 Ca -0.00 -0.76 -0.01 0.00 0.09 0.00 0.00 57.88 57.20 1oco h LEU 35 Cb 0.43 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1oco h LEU 35 CO 0.03 1.57 0.32 -0.07 0.09 0.00 0.00 178.44 180.38 1oco h LEU 36 N 0.21 0.71 -0.16 1.67 3.38 -0.76 0.31 115.31 120.69 1oco h LEU 36 Ca -0.19 -0.09 0.05 0.00 0.09 0.00 0.00 57.88 57.74 1oco h LEU 36 Cb 1.96 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 42.47 1oco h LEU 36 CO 0.24 0.60 -0.26 0.40 0.09 0.00 0.00 178.44 179.50 1oco h ILE 37 N 0.77 0.38 0.00 1.22 2.04 -1.23 -0.96 117.51 119.73 1oco h ILE 37 Ca 0.20 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.99 1oco h ILE 37 Cb 0.04 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 1oco h ILE 37 CO -0.03 0.00 -0.36 0.03 0.00 0.00 0.00 178.15 177.79 1oco h ARG 38 N -0.32 0.00 -0.53 2.37 2.47 -1.17 -2.94 114.38 114.26 1oco h ARG 38 Ca 0.11 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.81 1oco h ARG 38 Cb 0.48 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.78 1oco h ARG 38 CO -0.34 0.36 0.24 0.00 0.56 0.00 0.00 179.97 180.79 1oco h ALA 39 N 1.64 0.69 -0.05 0.04 0.00 0.85 0.31 119.26 122.75 1oco h ALA 39 Ca -0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1oco h ALA 39 Cb 0.83 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1oco h ALA 39 CO 0.05 0.27 -0.15 1.49 0.00 0.00 0.00 179.25 180.91 1oco h GLU 40 N 0.72 0.07 -0.02 0.00 4.57 -1.11 -3.03 114.58 115.78 1oco h GLU 40 Ca 0.18 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1oco h GLU 40 Cb 0.15 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1oco h GLU 40 CO -0.02 0.22 -0.38 1.28 -1.18 0.00 0.00 179.01 178.93 1oco n LEU 41 N -4.33 2.00 0.00 1.64 4.77 -0.74 -4.50 117.00 115.85 1oco n LEU 41 Ca -0.02 -0.79 0.07 0.00 -0.03 0.00 0.00 56.01 55.24 1oco n LEU 41 Cb 0.24 0.00 0.32 0.00 -2.33 0.00 0.00 43.42 41.65 1oco n LEU 41 CO 0.37 0.37 0.70 0.61 -1.33 0.00 0.00 177.39 178.11 1oco n GLY 42 N 1.31 -0.88 3.39 -0.72 0.00 0.10 -4.61 105.19 103.79 1oco n GLY 42 Ca 0.09 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1oco n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1oco s GLN 43 N -2.83 0.57 0.23 1.61 0.74 -1.26 -4.53 119.66 114.19 1oco s GLN 43 Ca 0.09 0.73 -0.31 0.00 0.05 0.00 0.00 55.36 55.92 1oco s GLN 43 Cb 0.09 0.25 -0.13 0.00 1.10 0.00 0.00 33.01 34.31 1oco s GLN 43 CO 0.24 -0.08 1.43 -2.30 -0.55 0.00 0.00 175.29 174.02 1oco n PRO 44 N 3.03 2.07 0.00 1.67 -0.02 -1.26 -4.71 135.00 135.77 1oco n PRO 44 Ca -0.15 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1oco n PRO 44 Cb 0.56 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1oco n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oco n GLY 45 N 2.27 0.56 3.16 -1.23 0.00 -1.26 -5.04 105.19 103.65 1oco n GLY 45 Ca 0.12 -2.26 -0.28 0.00 0.00 0.00 0.00 46.02 43.60 1oco n GLY 45 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1oco s THR 46 N -0.22 1.64 -0.18 2.61 -4.23 -1.26 -4.65 115.64 109.34 1oco s THR 46 Ca 0.00 -0.81 -0.09 0.00 -1.18 0.00 0.00 61.69 59.60 1oco s THR 46 Cb 0.00 -1.41 -0.08 0.00 1.34 0.00 0.00 72.50 72.35 1oco s THR 46 CO 0.00 0.47 -0.24 -0.11 -0.54 0.00 0.00 174.62 174.20 1oco n LEU 47 N 3.26 1.32 0.00 4.79 7.94 -1.26 -4.61 117.00 128.44 1oco n LEU 47 Ca -0.19 0.23 0.08 0.00 -1.11 0.00 0.00 56.01 55.02 1oco n LEU 47 Cb 0.53 -0.54 0.50 0.00 0.53 0.00 0.00 43.42 44.43 1oco n LEU 47 CO 0.26 0.33 0.71 0.18 -1.11 0.00 0.00 177.39 177.75 1oco n LEU 48 N -3.85 0.00 0.00 -1.96 4.77 -1.26 -4.92 117.00 109.78 1oco n LEU 48 Ca -0.34 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 1oco n LEU 48 Cb 0.73 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 1oco n LEU 48 CO 0.03 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.69 1oco n GLY 49 N 0.07 2.37 3.72 -0.72 0.00 -1.26 -4.88 105.19 104.49 1oco n GLY 49 Ca 0.12 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 1oco n GLY 49 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1oco s ASP 50 N -3.90 5.45 0.45 1.61 -4.77 -1.26 -5.02 116.67 109.23 1oco s ASP 50 Ca 0.00 0.18 0.12 0.00 -3.30 0.00 0.00 52.55 49.55 1oco s ASP 50 Cb 0.00 -1.57 1.02 0.00 -1.09 0.00 0.00 42.92 41.28 1oco s ASP 50 CO 0.00 0.36 2.07 0.44 0.70 0.00 0.00 175.17 178.74 1oco h ASP 51 N 4.96 0.21 -0.70 2.11 5.19 -2.01 -2.21 116.42 123.97 1oco h ASP 51 Ca -0.51 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 55.87 1oco h ASP 51 Cb 1.20 -0.05 -0.03 0.00 0.18 0.00 0.00 39.33 40.62 1oco h ASP 51 CO 0.56 0.20 0.39 -0.61 -3.12 0.00 0.00 179.24 176.66 1oco h GLN 52 N 0.24 0.99 -0.38 3.56 5.75 -1.96 -1.51 115.11 121.80 1oco h GLN 52 Ca 0.06 -0.11 -0.04 0.00 -0.15 0.00 0.00 58.65 58.41 1oco h GLN 52 Cb 0.07 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.40 1oco h GLN 52 CO -0.01 0.73 0.05 0.82 -2.65 0.00 0.00 178.83 177.77 1oco h ILE 53 N 1.00 1.19 -0.07 2.39 1.08 -1.72 0.29 117.51 121.68 1oco h ILE 53 Ca 0.25 -0.73 -0.01 0.00 -0.39 0.00 0.00 64.86 63.98 1oco h ILE 53 Cb 0.03 0.86 -0.00 0.00 -3.07 0.00 0.00 36.82 34.63 1oco h ILE 53 CO -0.04 0.26 -0.00 0.22 -0.69 0.00 0.00 178.15 177.90 1oco h TYR 54 N 0.56 0.14 -0.47 1.37 3.20 -1.33 -0.84 116.97 119.58 1oco h TYR 54 Ca 0.12 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 1oco h TYR 54 Cb 0.29 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 1oco h TYR 54 CO 0.01 0.39 0.20 -0.91 -1.64 0.00 0.00 178.16 176.22 1oco h ASN 55 N -0.16 0.61 -0.63 -2.11 2.35 -0.84 0.22 115.58 115.02 1oco h ASN 55 Ca 0.02 -0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.63 1oco h ASN 55 Cb 0.34 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.53 1oco h ASN 55 CO 0.00 0.54 0.11 0.58 -1.65 0.00 0.00 177.43 177.02 1oco h VAL 56 N 0.67 1.26 -0.04 2.81 2.07 -0.84 -1.73 116.25 120.45 1oco h VAL 56 Ca 0.16 -1.01 -0.01 0.00 0.82 0.00 0.00 66.70 66.67 1oco h VAL 56 Cb 0.12 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1oco h VAL 56 CO -0.02 0.38 -0.02 0.58 0.02 0.00 0.00 177.57 178.51 1oco h VAL 57 N 0.99 1.32 -0.92 2.57 2.07 0.37 -2.18 116.25 120.47 1oco h VAL 57 Ca 0.20 -0.98 0.06 0.00 0.82 0.00 0.00 66.70 66.80 1oco h VAL 57 Cb 0.42 1.89 -0.06 0.00 -1.52 0.00 0.00 31.29 32.01 1oco h VAL 57 CO 0.01 0.26 0.58 0.58 0.02 0.00 0.00 177.57 179.03 1oco h VAL 58 N -0.29 1.07 -0.04 2.57 2.07 -0.56 -1.68 116.25 119.39 1oco h VAL 58 Ca 0.01 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 1oco h VAL 58 Cb 0.43 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1oco h VAL 58 CO 0.01 0.19 0.00 0.74 0.02 0.00 0.00 177.57 178.53 1oco h THR 59 N 1.07 1.24 -0.20 2.57 2.02 -1.24 -2.84 112.91 115.53 1oco h THR 59 Ca 0.40 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 1oco h THR 59 Cb 0.15 1.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1oco h THR 59 CO -0.17 0.20 0.05 0.00 0.37 0.00 0.00 175.52 175.96 1oco h ALA 60 N 0.72 1.71 0.16 6.16 0.00 -1.16 -2.48 119.26 124.37 1oco h ALA 60 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1oco h ALA 60 Cb 0.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1oco h ALA 60 CO 0.00 0.23 -0.14 1.25 0.00 0.00 0.00 179.25 180.59 1oco h HIS 61 N 0.28 -0.37 -0.56 0.00 6.17 -1.07 -1.55 115.15 118.05 1oco h HIS 61 Ca 0.07 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.16 1oco h HIS 61 Cb 0.12 0.14 -0.03 0.00 2.52 0.00 0.00 27.41 30.17 1oco h HIS 61 CO 0.00 -0.22 0.37 0.00 0.71 0.00 0.00 177.93 178.79 1oco h ALA 62 N 0.49 0.71 -0.34 5.26 0.00 -1.31 -1.75 119.26 122.32 1oco h ALA 62 Ca -0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1oco h ALA 62 Cb 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1oco h ALA 62 CO -0.02 0.16 -0.08 0.74 0.00 0.00 0.00 179.25 180.04 1oco h PHE 63 N 0.76 0.74 -0.05 0.00 0.04 -1.39 -1.83 116.94 115.21 1oco h PHE 63 Ca 0.20 -0.16 -0.00 0.00 2.80 0.00 0.00 57.97 60.81 1oco h PHE 63 Cb -0.08 -0.18 -0.00 0.00 2.20 0.00 0.00 35.95 37.89 1oco h PHE 63 CO -0.03 0.82 0.03 0.28 -0.60 0.00 0.00 178.31 178.81 1oco h VAL 64 N 0.45 1.07 -0.11 -0.55 2.07 -1.11 0.11 116.25 118.19 1oco h VAL 64 Ca 0.09 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 1oco h VAL 64 Cb 0.58 1.12 -0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1oco h VAL 64 CO 0.03 0.06 0.01 0.24 0.02 0.00 0.00 177.57 177.94 1oco h MET 65 N -0.00 0.18 0.24 1.57 2.86 -1.37 -0.42 114.93 117.98 1oco h MET 65 Ca 0.02 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 1oco h MET 65 Cb 0.07 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.72 1oco h MET 65 CO -0.00 0.39 -0.11 0.82 1.06 0.00 0.00 176.91 179.06 1oco h ILE 66 N -0.06 0.00 0.00 -1.22 2.04 -1.27 0.50 117.51 117.50 1oco h ILE 66 Ca 0.03 -0.18 -0.11 0.00 1.00 0.00 0.00 64.86 65.60 1oco h ILE 66 Cb 0.30 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 1oco h ILE 66 CO 0.00 0.00 -0.55 -0.26 0.00 0.00 0.00 178.15 177.35 1oco h PHE 67 N -0.49 0.00 0.00 1.37 -1.00 -0.94 -2.67 116.94 113.21 1oco h PHE 67 Ca -0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.75 1oco h PHE 67 Cb 0.24 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.80 1oco h PHE 67 CO 0.08 0.55 -0.65 1.19 -1.61 0.00 0.00 178.31 177.86 1oco n PHE 68 N -3.48 0.00 0.00 -0.55 3.72 -0.74 -4.27 117.46 112.14 1oco n PHE 68 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1oco n PHE 68 Cb 0.65 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 39.15 1oco n PHE 68 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 1oco n MET 69 N -1.35 0.00 -0.11 -1.08 1.56 -0.24 -4.21 117.12 111.69 1oco n MET 69 Ca 0.01 0.00 -0.10 0.00 -0.27 0.00 0.00 57.70 57.35 1oco n MET 69 Cb 0.18 -0.01 -0.04 0.00 2.15 0.00 0.00 33.22 35.49 1oco n MET 69 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 1oco h VAL 70 N 0.00 0.14 0.40 1.12 2.07 -1.01 -2.35 116.25 116.62 1oco h VAL 70 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1oco h VAL 70 Cb 0.00 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 29.92 1oco h VAL 70 CO 0.00 0.00 -0.19 0.24 0.02 0.00 0.00 177.57 177.64 1oco h MET 71 N -0.33 -0.52 -0.26 1.57 2.07 -1.69 -1.67 114.93 114.11 1oco h MET 71 Ca 0.14 0.04 0.06 0.00 -2.07 0.00 0.00 59.70 57.86 1oco h MET 71 Cb 0.58 0.12 -0.06 0.00 -1.87 0.00 0.00 31.60 30.37 1oco h MET 71 CO -0.55 -0.34 -0.11 -1.35 1.07 0.00 0.00 176.91 175.63 1oco h PRO 72 N -0.55 -0.07 0.29 -0.22 0.11 -1.71 -1.26 132.00 128.59 1oco h PRO 72 Ca -0.05 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 1oco h PRO 72 Cb 0.42 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 1oco h PRO 72 CO 0.09 -0.05 -0.25 0.82 -0.21 0.00 0.00 178.00 178.40 1oco h ILE 73 N -0.08 0.00 -0.70 4.15 2.04 -1.36 0.28 117.51 121.84 1oco h ILE 73 Ca 0.14 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.02 1oco h ILE 73 Cb 0.28 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.32 1oco h ILE 73 CO -0.31 0.00 0.45 0.24 0.00 0.00 0.00 178.15 178.53 1oco h MET 74 N -0.53 0.86 0.00 2.37 2.86 -1.29 -0.69 114.93 118.50 1oco h MET 74 Ca -0.04 -0.05 -0.15 0.00 -2.06 0.00 0.00 59.70 57.40 1oco h MET 74 Cb 0.45 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 1oco h MET 74 CO -0.01 0.57 -1.25 -0.89 1.06 0.00 0.00 176.91 176.40 1oco n ILE 75 N -4.65 1.49 -0.17 -1.22 5.41 -0.48 -2.99 119.36 116.75 1oco n ILE 75 Ca 0.07 0.01 -0.11 0.00 1.00 0.00 0.00 62.75 63.73 1oco n ILE 75 Cb 0.07 -2.19 0.00 0.00 -0.71 0.00 0.00 39.64 36.81 1oco n ILE 75 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1oco h GLY 76 N -1.00 1.08 0.00 7.39 0.00 -0.65 -1.29 103.07 108.60 1oco h GLY 76 Ca -0.23 -0.90 0.00 0.00 0.00 0.00 0.00 47.33 46.19 1oco h GLY 76 CO -0.14 0.82 0.00 0.61 0.00 0.00 0.00 176.54 177.83 1oco n GLY 77 N -0.21 0.32 0.36 4.60 0.00 0.65 -2.72 105.19 108.19 1oco n GLY 77 Ca 0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.15 1oco n GLY 77 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1oco h PHE 78 N 0.00 0.48 0.30 1.61 0.04 -1.30 -1.49 116.94 116.58 1oco h PHE 78 Ca 0.00 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.77 1oco h PHE 78 Cb 0.00 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.00 1oco h PHE 78 CO 0.00 0.22 -0.14 0.78 -0.60 0.00 0.00 178.31 178.56 1oco h GLY 79 N 0.44 -0.42 1.44 -1.45 0.00 -1.13 -0.89 103.07 101.06 1oco h GLY 79 Ca 0.31 0.16 -0.15 0.00 0.00 0.00 0.00 47.33 47.64 1oco h GLY 79 CO -0.09 -0.15 -0.47 3.43 0.00 0.00 0.00 176.54 179.26 1oco h ASN 80 N -0.49 0.66 0.12 0.19 2.35 -1.28 -1.83 115.58 115.29 1oco h ASN 80 Ca -0.04 -0.32 -0.01 0.00 -0.55 0.00 0.00 56.30 55.38 1oco h ASN 80 Cb 0.37 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.55 1oco h ASN 80 CO 0.07 1.02 -0.06 -0.50 -1.65 0.00 0.00 177.43 176.31 1oco h TRP 81 N 0.48 -0.15 0.05 1.19 4.06 -1.24 -3.38 115.95 116.96 1oco h TRP 81 Ca 0.03 -0.00 -0.30 0.00 2.06 0.00 0.00 58.89 60.68 1oco h TRP 81 Cb 1.00 0.05 -0.03 0.00 -1.00 0.00 0.00 29.16 29.18 1oco h TRP 81 CO 0.04 0.18 -1.63 -0.07 -3.56 0.00 0.00 178.44 173.40 1oco h LEU 82 N -0.50 0.15 0.52 -4.49 3.38 -1.26 -3.38 115.31 109.74 1oco h LEU 82 Ca -0.02 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 1oco h LEU 82 Cb 0.40 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1oco h LEU 82 CO 0.03 1.24 -0.38 0.58 0.09 0.00 0.00 178.44 180.00 1oco h VAL 83 N 0.03 0.24 -0.74 1.22 2.07 -1.46 0.21 116.25 117.80 1oco h VAL 83 Ca -0.26 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.33 1oco h VAL 83 Cb 1.99 0.24 -0.05 0.00 -1.52 0.00 0.00 31.29 31.95 1oco h VAL 83 CO 0.11 0.00 0.49 -0.65 0.02 0.00 0.00 177.57 177.53 1oco h PRO 84 N -0.87 0.70 -0.49 1.57 0.11 -1.79 -2.33 132.00 128.90 1oco h PRO 84 Ca -0.06 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.89 1oco h PRO 84 Cb 0.73 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 1oco h PRO 84 CO 0.02 0.46 -0.18 -0.07 -0.21 0.00 0.00 178.00 178.02 1oco h LEU 85 N 0.72 0.98 -0.80 2.35 3.38 -1.61 -0.39 115.31 119.94 1oco h LEU 85 Ca 0.33 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1oco h LEU 85 Cb 0.36 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1oco h LEU 85 CO -0.12 1.13 -0.15 0.24 0.09 0.00 0.00 178.44 179.64 1oco h MET 86 N 0.84 0.00 -0.22 1.13 2.86 -0.41 -3.20 114.93 115.94 1oco h MET 86 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1oco h MET 86 Cb 0.75 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.41 1oco h MET 86 CO 0.06 0.15 0.00 0.44 1.06 0.00 0.00 176.91 178.62 1oco n ILE 87 N -3.22 0.56 -1.52 -1.22 -5.35 -1.12 -4.81 119.36 102.67 1oco n ILE 87 Ca 0.01 -0.78 -0.04 0.00 -0.27 0.00 0.00 62.75 61.68 1oco n ILE 87 Cb 0.46 0.84 -0.01 0.00 -1.74 0.00 0.00 39.64 39.19 1oco n ILE 87 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1oco n GLY 88 N 0.67 0.49 3.87 3.28 0.00 -0.92 -3.92 105.19 108.65 1oco n GLY 88 Ca 0.10 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 1oco n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oco s ALA 89 N -2.17 3.33 0.12 4.61 0.00 -0.20 -4.67 121.76 122.79 1oco s ALA 89 Ca 0.00 -0.14 0.21 0.00 0.00 0.00 0.00 51.96 52.04 1oco s ALA 89 Cb 0.00 -2.73 0.77 0.00 0.00 0.00 0.00 23.12 21.16 1oco s ALA 89 CO 0.00 0.06 1.76 -1.00 0.00 0.00 0.00 175.76 176.59 1oco h PRO 90 N 1.48 0.00 0.00 0.00 0.13 -1.81 -3.42 132.00 128.38 1oco h PRO 90 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1oco h PRO 90 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1oco h PRO 90 CO 0.64 0.30 0.00 -3.47 -0.23 0.00 0.00 178.00 175.24 1oco n ASP 91 N -3.44 0.00 -4.78 1.44 -0.08 -1.26 -4.76 116.55 103.67 1oco n ASP 91 Ca 0.00 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 52.98 1oco n ASP 91 Cb 0.48 0.00 0.09 0.00 2.34 0.00 0.00 41.12 44.03 1oco n ASP 91 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 1oco s MET 92 N -0.67 2.20 0.18 -0.67 -1.94 -1.26 -4.90 119.30 112.24 1oco s MET 92 Ca 0.00 0.92 -0.11 0.00 -1.71 0.00 0.00 55.69 54.78 1oco s MET 92 Cb 0.00 -1.91 0.09 0.00 2.01 0.00 0.00 34.83 35.02 1oco s MET 92 CO 0.00 -1.61 1.74 0.00 -0.01 0.00 0.00 175.02 175.14 1oco h ALA 93 N -1.09 0.81 -3.06 3.03 0.00 -1.92 -3.34 119.26 113.69 1oco h ALA 93 Ca -0.46 -0.16 -0.62 0.00 0.00 0.00 0.00 54.91 53.67 1oco h ALA 93 Cb 1.24 -0.25 -0.42 0.00 0.00 0.00 0.00 17.79 18.37 1oco h ALA 93 CO 0.55 0.42 -0.60 -0.06 0.00 0.00 0.00 179.25 179.56 1oco s PHE 94 N -5.59 3.39 0.14 0.00 0.08 -1.26 -4.97 117.98 109.77 1oco s PHE 94 Ca -0.13 -3.26 -0.24 0.00 0.12 0.00 0.00 56.93 53.42 1oco s PHE 94 Cb 0.13 -2.60 -0.00 0.00 -0.57 0.00 0.00 43.02 39.98 1oco s PHE 94 CO 0.80 -0.58 1.63 -1.35 -0.10 0.00 0.00 175.22 175.62 1oco h PRO 95 N 5.49 -0.29 -0.25 0.24 0.11 -1.91 0.14 132.00 135.54 1oco h PRO 95 Ca 0.14 0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.26 1oco h PRO 95 Cb 0.77 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 1oco h PRO 95 CO 0.69 -0.19 0.15 -0.09 -0.21 0.00 0.00 178.00 178.35 1oco h ARG 96 N -0.30 0.33 -0.81 1.05 2.43 -1.90 -2.71 114.38 112.47 1oco h ARG 96 Ca 0.11 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1oco h ARG 96 Cb 0.46 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 1oco h ARG 96 CO -0.33 0.27 0.50 1.98 -1.51 0.00 0.00 179.97 180.88 1oco h MET 97 N 0.30 1.10 -0.83 0.20 4.05 -1.88 -1.62 114.93 116.26 1oco h MET 97 Ca 0.09 -0.10 0.17 0.00 -0.28 0.00 0.00 59.70 59.58 1oco h MET 97 Cb 0.02 -0.23 -0.06 0.00 -0.80 0.00 0.00 31.60 30.53 1oco h MET 97 CO -0.02 0.77 0.55 -0.97 0.23 0.00 0.00 176.91 177.48 1oco h ASN 98 N 1.12 0.42 -0.40 1.39 -1.24 -0.67 0.15 115.58 116.34 1oco h ASN 98 Ca 0.29 0.03 -0.11 0.00 0.71 0.00 0.00 56.30 57.23 1oco h ASN 98 Cb -0.05 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 38.93 1oco h ASN 98 CO -0.06 0.20 -0.14 -1.13 -1.29 0.00 0.00 177.43 175.01 1oco h ASN 99 N 0.44 0.88 -0.69 1.15 -1.24 -1.04 -2.69 115.58 112.39 1oco h ASN 99 Ca 0.42 -0.29 -0.02 0.00 0.71 0.00 0.00 56.30 57.12 1oco h ASN 99 Cb 0.98 -0.24 -0.03 0.00 0.73 0.00 0.00 38.32 39.76 1oco h ASN 99 CO -0.15 1.02 0.35 -0.03 -1.29 0.00 0.00 177.43 177.33 1oco h MET 100 N 0.78 0.97 -0.87 6.67 4.05 -0.67 -1.57 114.93 124.30 1oco h MET 100 Ca 0.12 -0.13 0.20 0.00 -0.28 0.00 0.00 59.70 59.61 1oco h MET 100 Cb 0.67 -0.18 -0.06 0.00 -0.80 0.00 0.00 31.60 31.22 1oco h MET 100 CO 0.05 0.76 0.58 0.77 0.23 0.00 0.00 176.91 179.29 1oco h SER 101 N 0.95 0.37 0.08 1.39 0.02 -1.07 -1.56 113.55 113.73 1oco h SER 101 Ca 0.24 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1oco h SER 101 Cb 0.09 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1oco h SER 101 CO -0.03 0.16 -0.04 0.15 -1.14 0.00 0.00 176.83 175.93 1oco h PHE 102 N 0.38 -0.10 0.00 3.45 3.57 -1.23 -3.34 116.94 119.67 1oco h PHE 102 Ca 0.45 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.94 1oco h PHE 102 Cb 1.15 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.92 1oco h PHE 102 CO -0.00 0.40 0.08 0.91 -2.23 0.00 0.00 178.31 177.47 1oco n TRP 103 N -4.80 0.37 0.14 0.41 7.02 -0.70 -0.69 117.44 119.19 1oco n TRP 103 Ca -0.07 0.19 0.05 0.00 -1.02 0.00 0.00 57.50 56.65 1oco n TRP 103 Cb 0.27 -0.74 0.04 0.00 -2.42 0.00 0.00 31.31 28.46 1oco n TRP 103 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1oco h LEU 104 N 0.00 0.00 -0.14 -0.99 3.38 -1.43 -3.36 115.31 112.77 1oco h LEU 104 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1oco h LEU 104 Cb 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1oco h LEU 104 CO 0.00 0.38 -0.01 -0.07 0.09 0.00 0.00 178.44 178.83 1oco h LEU 105 N 0.00 0.24 -0.60 1.67 4.07 -1.06 -0.75 115.31 118.88 1oco h LEU 105 Ca -0.02 -0.32 -0.00 0.00 0.08 0.00 0.00 57.88 57.62 1oco h LEU 105 Cb 1.31 -0.07 -0.03 0.00 1.08 0.00 0.00 40.66 42.95 1oco h LEU 105 CO 0.05 0.51 0.37 -0.65 -1.08 0.00 0.00 178.44 177.63 1oco h PRO 106 N -0.03 0.81 -0.40 1.13 0.11 -1.70 0.10 132.00 132.02 1oco h PRO 106 Ca 0.04 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 1oco h PRO 106 Cb 0.39 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 1oco h PRO 106 CO 0.01 0.57 -0.10 -1.35 -0.21 0.00 0.00 178.00 176.92 1oco h PRO 107 N 0.81 0.70 -0.96 1.05 0.11 -1.71 0.03 132.00 132.02 1oco h PRO 107 Ca 0.22 -0.21 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 1oco h PRO 107 Cb -0.04 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 30.96 1oco h PRO 107 CO -0.04 0.78 0.58 1.03 -0.21 0.00 0.00 178.00 180.14 1oco h SER 108 N 0.64 1.14 -0.21 -2.05 0.87 -0.62 -1.81 113.55 111.51 1oco h SER 108 Ca 0.11 -0.06 -0.13 0.00 -1.23 0.00 0.00 61.79 60.48 1oco h SER 108 Cb 0.54 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 1oco h SER 108 CO 0.03 0.87 -0.32 0.15 -0.53 0.00 0.00 176.83 177.03 1oco h PHE 109 N 1.32 0.84 -0.44 2.24 3.57 -0.13 -2.81 116.94 121.52 1oco h PHE 109 Ca 0.34 -0.22 0.02 0.00 3.53 0.00 0.00 57.97 61.65 1oco h PHE 109 Cb -0.07 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.45 1oco h PHE 109 CO 0.00 0.94 0.25 1.25 -2.23 0.00 0.00 178.31 178.53 1oco h LEU 110 N 0.61 0.40 -1.00 0.59 5.85 -0.34 -1.41 115.31 120.00 1oco h LEU 110 Ca 0.07 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1oco h LEU 110 Cb 0.84 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.75 1oco h LEU 110 CO 0.07 0.28 0.52 -0.07 -0.34 0.00 0.00 178.44 178.90 1oco h LEU 111 N 0.51 1.07 -0.69 2.25 3.38 -1.13 0.15 115.31 120.85 1oco h LEU 111 Ca 0.18 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1oco h LEU 111 Cb 0.03 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1oco h LEU 111 CO -0.09 0.83 -0.10 0.25 0.09 0.00 0.00 178.44 179.42 1oco h LEU 112 N 1.22 0.90 -0.34 1.67 5.85 -1.22 -1.53 115.31 121.87 1oco h LEU 112 Ca 0.32 -0.28 -0.14 0.00 0.84 0.00 0.00 57.88 58.62 1oco h LEU 112 Cb -0.03 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 1oco h LEU 112 CO -0.06 1.02 -0.32 -0.07 -0.34 0.00 0.00 178.44 178.68 1oco h LEU 113 N 0.81 0.87 -1.07 2.25 3.38 -0.65 -3.09 115.31 117.81 1oco h LEU 113 Ca 0.13 -0.46 0.04 0.00 0.09 0.00 0.00 57.88 57.68 1oco h LEU 113 Cb 0.63 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 1oco h LEU 113 CO 0.04 1.15 0.63 0.00 0.09 0.00 0.00 178.44 180.35 1oco h ALA 114 N 0.74 1.40 -0.19 1.53 0.00 -0.54 -1.67 119.26 120.53 1oco h ALA 114 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1oco h ALA 114 Cb 0.90 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1oco h ALA 114 CO 0.08 0.50 0.12 0.66 0.00 0.00 0.00 179.25 180.61 1oco h SER 115 N 1.18 0.22 0.45 0.00 4.64 -1.19 -0.56 113.55 118.30 1oco h SER 115 Ca 0.39 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1oco h SER 115 Cb 0.04 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1oco h SER 115 CO -0.12 0.17 -0.22 -1.54 -0.87 0.00 0.00 176.83 174.24 1oco n SER 116 N -4.50 0.54 -0.10 4.97 3.41 -0.65 -3.79 113.62 113.50 1oco n SER 116 Ca -0.00 -0.43 -0.23 0.00 -0.26 0.00 0.00 58.87 57.95 1oco n SER 116 Cb 0.08 -0.01 -0.12 0.00 -0.26 0.00 0.00 64.21 63.91 1oco n SER 116 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1oco n MET 117 N -1.08 0.59 -2.47 4.33 2.81 -0.32 -4.52 117.12 116.45 1oco n MET 117 Ca 0.11 0.50 -0.34 0.00 -1.81 0.00 0.00 57.70 56.17 1oco n MET 117 Cb 0.31 -1.71 -0.03 0.00 -0.71 0.00 0.00 33.22 31.09 1oco n MET 117 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1oco s VAL 118 N -2.40 3.87 0.00 2.03 -7.23 -0.58 -4.84 120.40 111.25 1oco s VAL 118 Ca -0.30 1.10 0.00 0.00 -1.81 0.00 0.00 61.98 60.97 1oco s VAL 118 Cb 0.07 -3.46 0.00 0.00 0.56 0.00 0.00 36.38 33.55 1oco s VAL 118 CO 0.59 -0.31 0.00 -0.62 -0.31 0.00 0.00 175.10 174.45 1oco n GLU 119 N -1.15 0.00 -0.62 4.82 -0.58 -1.26 -2.02 120.64 119.83 1oco n GLU 119 Ca 0.09 0.00 0.07 0.00 -0.42 0.00 0.00 57.16 56.90 1oco n GLU 119 Cb 0.53 0.00 0.32 0.00 -0.57 0.00 0.00 31.44 31.71 1oco n GLU 119 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1oco n ALA 120 N 5.33 3.28 -0.53 0.62 0.00 -1.26 -5.04 120.51 122.90 1oco n ALA 120 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 53.44 52.01 1oco n ALA 120 Cb 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1oco n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oco n GLY 121 N 0.80 -1.43 3.11 0.00 0.00 -0.85 -4.60 105.19 102.21 1oco n GLY 121 Ca 0.22 -1.19 -0.37 0.00 0.00 0.00 0.00 46.02 44.68 1oco n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oco s ALA 122 N -1.53 3.53 -1.19 4.61 0.00 -1.26 -4.78 121.76 121.15 1oco s ALA 122 Ca 0.00 -3.14 -0.12 0.00 0.00 0.00 0.00 51.96 48.70 1oco s ALA 122 Cb 0.00 -2.66 0.20 0.00 0.00 0.00 0.00 23.12 20.67 1oco s ALA 122 CO 0.00 -2.06 1.38 0.41 0.00 0.00 0.00 175.76 175.49 1oco n GLY 123 N 3.69 3.74 0.00 0.00 0.00 -1.26 -4.38 105.19 106.97 1oco n GLY 123 Ca 0.06 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 43.89 1oco n GLY 123 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oco n THR 124 N 3.91 0.00 0.00 2.61 -2.24 -1.26 -4.86 114.28 112.45 1oco n THR 124 Ca 0.33 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1oco n THR 124 Cb 0.41 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.70 1oco n THR 124 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oco n GLY 125 N 0.52 -0.68 0.00 3.38 0.00 -1.26 -4.14 105.19 103.01 1oco n GLY 125 Ca 0.00 -1.61 0.10 0.00 0.00 0.00 0.00 46.02 44.51 1oco n GLY 125 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1oco n TRP 126 N -0.36 0.00 1.28 1.61 4.27 -1.26 -2.43 117.44 120.56 1oco n TRP 126 Ca 0.00 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 53.75 1oco n TRP 126 Cb 0.00 -0.47 0.67 0.00 -1.36 0.00 0.00 31.31 30.15 1oco n TRP 126 CO 0.00 0.00 0.00 0.25 -2.29 0.00 0.00 177.69 175.65 1oco n THR 127 N -1.47 0.00 -3.27 -1.67 -2.24 -1.26 -4.95 114.28 99.42 1oco n THR 127 Ca 0.06 -0.01 -0.15 0.00 -2.27 0.00 0.00 64.05 61.67 1oco n THR 127 Cb 0.23 -0.39 -0.04 0.00 -2.10 0.00 0.00 70.33 68.03 1oco n THR 127 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1oco n VAL 128 N -1.30 -0.39 -2.36 2.28 3.14 -1.02 -4.88 118.33 113.80 1oco n VAL 128 Ca 0.12 -0.19 -0.38 0.00 -2.96 0.00 0.00 64.34 60.93 1oco n VAL 128 Cb 0.28 -0.42 -0.02 0.00 -1.06 0.00 0.00 33.84 32.61 1oco n VAL 128 CO 0.00 0.00 0.00 -0.31 -6.46 0.00 0.00 176.83 170.06 1oco s TYR 129 N -3.39 3.12 0.34 1.45 2.02 -1.26 -4.73 117.35 114.90 1oco s TYR 129 Ca 0.06 1.58 0.00 0.00 -0.37 0.00 0.00 57.07 58.34 1oco s TYR 129 Cb -0.03 -3.31 -0.03 0.00 -0.40 0.00 0.00 41.96 38.18 1oco s TYR 129 CO 0.46 -1.12 0.55 -1.25 -1.57 0.00 0.00 175.55 172.62 1oco s PRO 130 N -2.37 3.49 0.44 -1.71 0.04 -1.26 -1.45 135.00 132.19 1oco s PRO 130 Ca 0.58 -0.31 0.20 0.00 0.04 0.00 0.00 61.00 61.51 1oco s PRO 130 Cb -0.28 -2.66 1.04 0.00 0.04 0.00 0.00 34.50 32.64 1oco s PRO 130 CO 0.35 0.15 1.92 -1.35 0.04 0.00 0.00 177.00 178.11 1oco h PRO 131 N 0.81 0.00 -0.93 0.56 0.11 -1.93 -3.45 132.00 127.16 1oco h PRO 131 Ca -0.50 0.00 0.20 0.00 0.11 0.00 0.00 66.00 65.81 1oco h PRO 131 Cb 1.22 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.25 1oco h PRO 131 CO 0.62 0.25 0.60 1.25 -0.21 0.00 0.00 178.00 180.51 1oco h LEU 132 N 0.00 0.52 0.00 2.35 5.85 -1.95 0.27 115.31 122.35 1oco h LEU 132 Ca -0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1oco h LEU 132 Cb 0.55 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.54 1oco h LEU 132 CO 0.03 0.20 -0.10 0.00 -0.34 0.00 0.00 178.44 178.24 1oco n ALA 133 N -2.47 2.55 -0.97 1.25 0.00 -0.53 -3.53 120.51 116.81 1oco n ALA 133 Ca 0.20 -0.14 -0.01 0.00 0.00 0.00 0.00 53.44 53.49 1oco n ALA 133 Cb 0.66 -1.40 0.02 0.00 0.00 0.00 0.00 19.45 18.72 1oco n ALA 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oco n GLY 134 N 1.48 -3.21 0.39 0.00 0.00 0.96 -4.74 105.19 100.08 1oco n GLY 134 Ca 0.07 -1.32 0.14 0.00 0.00 0.00 0.00 46.02 44.90 1oco n GLY 134 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1oco n ASN 135 N -3.15 1.29 -0.03 1.61 0.23 -1.26 -2.22 115.26 111.73 1oco n ASN 135 Ca 0.01 -1.31 -0.02 0.00 -0.53 0.00 0.00 54.58 52.73 1oco n ASN 135 Cb 0.04 0.03 -0.01 0.00 -2.08 0.00 0.00 39.78 37.76 1oco n ASN 135 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 1oco n LEU 136 N -0.10 0.67 0.29 -4.53 -0.00 -1.26 -3.21 117.00 108.86 1oco n LEU 136 Ca 0.18 0.27 0.17 0.00 -0.00 0.00 0.00 56.01 56.63 1oco n LEU 136 Cb 0.34 -0.61 0.89 0.00 -0.00 0.00 0.00 43.42 44.03 1oco n LEU 136 CO 0.19 -0.46 1.06 0.00 -0.00 0.00 0.00 177.39 178.18 1oco h ALA 137 N -1.64 1.12 -0.90 1.96 0.00 -1.77 -3.08 119.26 114.94 1oco h ALA 137 Ca 0.00 -0.04 -0.34 0.00 0.00 0.00 0.00 54.91 54.53 1oco h ALA 137 Cb 0.26 -0.01 -0.40 0.00 0.00 0.00 0.00 17.79 17.64 1oco h ALA 137 CO 0.00 0.05 -1.17 0.72 0.00 0.00 0.00 179.25 178.85 1oco n HIS 138 N -3.31 1.23 -1.62 0.00 8.25 -0.94 -4.95 115.22 113.88 1oco n HIS 138 Ca -0.02 -2.67 -0.40 0.00 -0.26 0.00 0.00 57.72 54.37 1oco n HIS 138 Cb 0.20 -0.35 0.02 0.00 1.12 0.00 0.00 29.99 30.98 1oco n HIS 138 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1oco n ALA 139 N -0.17 0.25 0.00 -1.41 0.00 -1.17 -4.61 120.51 113.40 1oco n ALA 139 Ca 0.09 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1oco n ALA 139 Cb 0.81 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 18.16 1oco n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oco n GLY 140 N 1.20 2.69 0.00 0.00 0.00 -1.26 -4.82 105.19 103.00 1oco n GLY 140 Ca 0.10 -2.00 0.04 0.00 0.00 0.00 0.00 46.02 44.16 1oco n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oco n ALA 141 N -0.04 1.54 0.34 4.61 0.00 -1.26 -4.10 120.51 121.60 1oco n ALA 141 Ca 0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 53.44 53.24 1oco n ALA 141 Cb 0.00 -1.13 -0.08 0.00 0.00 0.00 0.00 19.45 18.24 1oco n ALA 141 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1oco h SER 142 N 0.00 -0.75 -0.71 0.00 0.02 -1.86 -1.29 113.55 108.97 1oco h SER 142 Ca 0.00 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1oco h SER 142 Cb 0.08 0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 1oco h SER 142 CO 0.00 -0.42 0.43 0.58 -1.14 0.00 0.00 176.83 176.29 1oco h VAL 143 N -1.08 1.20 -0.98 2.27 2.07 -1.85 -1.26 116.25 116.62 1oco h VAL 143 Ca -0.09 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 67.01 1oco h VAL 143 Cb 0.72 0.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 1oco h VAL 143 CO 0.15 0.21 0.65 0.44 0.02 0.00 0.00 177.57 179.04 1oco h ASP 144 N 0.99 1.09 -0.56 0.57 3.32 -1.74 0.13 116.42 120.22 1oco h ASP 144 Ca 0.26 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.19 1oco h ASP 144 Cb -0.04 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.23 1oco h ASP 144 CO -0.05 0.76 -0.06 -0.07 -1.72 0.00 0.00 179.24 178.10 1oco h LEU 145 N 1.27 1.02 -0.89 1.55 3.38 -0.38 -2.04 115.31 119.22 1oco h LEU 145 Ca 0.38 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1oco h LEU 145 Cb -0.05 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.38 1oco h LEU 145 CO -0.11 1.11 0.45 0.74 0.09 0.00 0.00 178.44 180.73 1oco h THR 146 N 0.91 1.26 -0.26 0.22 2.02 -0.09 -0.90 112.91 116.07 1oco h THR 146 Ca 0.15 -0.69 -0.06 0.00 0.77 0.00 0.00 66.41 66.58 1oco h THR 146 Cb 0.62 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 1oco h THR 146 CO 0.04 0.30 -0.11 0.40 0.37 0.00 0.00 175.52 176.53 1oco h ILE 147 N 1.24 1.21 0.00 3.11 2.04 -0.54 -2.72 117.51 121.86 1oco h ILE 147 Ca 0.31 -0.93 -0.20 0.00 1.00 0.00 0.00 64.86 65.04 1oco h ILE 147 Cb 0.07 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 1oco h ILE 147 CO -0.04 0.30 -0.98 -0.26 0.00 0.00 0.00 178.15 177.17 1oco h PHE 148 N 0.41 0.00 -0.82 1.37 0.04 -0.91 -2.64 116.94 114.38 1oco h PHE 148 Ca 0.08 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.83 1oco h PHE 148 Cb 0.44 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.55 1oco h PHE 148 CO 0.01 0.92 0.43 1.03 -0.60 0.00 0.00 178.31 180.09 1oco h SER 149 N 0.00 1.03 0.67 2.17 0.87 -0.90 -2.11 113.55 115.29 1oco h SER 149 Ca -0.03 -0.10 -0.18 0.00 -1.23 0.00 0.00 61.79 60.25 1oco h SER 149 Cb 1.72 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 63.40 1oco h SER 149 CO 0.12 0.85 -0.82 -0.07 -0.53 0.00 0.00 176.83 176.37 1oco h LEU 150 N 1.15 0.14 -0.32 2.23 4.07 -1.49 -1.71 115.31 119.37 1oco h LEU 150 Ca 0.29 -0.11 -0.01 0.00 0.08 0.00 0.00 57.88 58.13 1oco h LEU 150 Cb 0.06 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 41.74 1oco h LEU 150 CO -0.04 0.90 0.18 0.45 -1.08 0.00 0.00 178.44 178.84 1oco h HIS 151 N 0.06 0.45 -0.22 1.13 3.86 -1.07 -0.16 115.15 119.19 1oco h HIS 151 Ca -0.03 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.13 1oco h HIS 151 Cb 1.43 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.75 1oco h HIS 151 CO 0.01 0.36 -0.04 -0.07 0.86 0.00 0.00 177.93 179.06 1oco h LEU 152 N 0.40 0.42 -1.31 2.43 3.38 -1.37 -1.28 115.31 117.99 1oco h LEU 152 Ca 0.11 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 57.78 1oco h LEU 152 Cb 0.07 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 1oco h LEU 152 CO -0.02 0.68 0.50 0.00 0.09 0.00 0.00 178.44 179.69 1oco h ALA 153 N 0.76 1.60 -0.16 1.53 0.00 -1.23 -0.65 119.26 121.12 1oco h ALA 153 Ca 0.06 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 1oco h ALA 153 Cb 0.48 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1oco h ALA 153 CO 0.02 0.30 -0.66 0.78 0.00 0.00 0.00 179.25 179.70 1oco h GLY 154 N 0.88 0.67 0.87 0.00 0.00 -0.81 -2.60 103.07 102.08 1oco h GLY 154 Ca 0.31 -0.86 -0.04 0.00 0.00 0.00 0.00 47.33 46.74 1oco h GLY 154 CO -0.10 0.77 0.02 -2.08 0.00 0.00 0.00 176.54 175.15 1oco h VAL 155 N 0.44 1.25 -0.57 4.60 2.07 -0.18 -0.98 116.25 122.88 1oco h VAL 155 Ca -0.02 -0.88 0.11 0.00 0.82 0.00 0.00 66.70 66.74 1oco h VAL 155 Cb 1.24 1.28 -0.09 0.00 -1.52 0.00 0.00 31.29 32.20 1oco h VAL 155 CO 0.13 0.28 0.03 -1.28 0.02 0.00 0.00 177.57 176.74 1oco h SER 156 N 0.27 -0.20 -0.13 0.57 0.87 -1.10 -0.60 113.55 113.24 1oco h SER 156 Ca 0.08 0.13 -0.07 0.00 -1.23 0.00 0.00 61.79 60.70 1oco h SER 156 Cb 0.39 0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.58 1oco h SER 156 CO 0.01 -0.07 -0.18 0.28 -0.53 0.00 0.00 176.83 176.33 1oco h SER 157 N 0.14 0.38 -0.95 6.23 0.02 -1.23 -1.20 113.55 116.94 1oco h SER 157 Ca 0.29 -0.52 0.06 0.00 -0.84 0.00 0.00 61.79 60.77 1oco h SER 157 Cb 0.46 -0.11 -0.06 0.00 0.14 0.00 0.00 62.40 62.83 1oco h SER 157 CO -0.46 0.83 0.61 0.40 -1.14 0.00 0.00 176.83 177.07 1oco h ILE 158 N -0.06 1.10 0.69 3.27 2.04 -1.00 0.63 117.51 124.17 1oco h ILE 158 Ca 0.01 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1oco h ILE 158 Cb 0.75 -0.13 0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1oco h ILE 158 CO 0.04 0.21 -0.33 -0.07 0.00 0.00 0.00 178.15 178.00 1oco h LEU 159 N 1.13 -0.78 -1.93 1.44 4.07 -0.99 -2.27 115.31 115.99 1oco h LEU 159 Ca 0.40 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 58.35 1oco h LEU 159 Cb 0.12 0.20 -0.00 0.00 1.08 0.00 0.00 40.66 42.05 1oco h LEU 159 CO -0.16 -0.53 -0.10 1.23 -1.08 0.00 0.00 178.44 177.81 1oco h GLY 160 N -0.97 0.00 1.39 0.83 0.00 -0.74 -0.90 103.07 102.68 1oco h GLY 160 Ca -0.09 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.15 1oco h GLY 160 CO 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 176.54 176.60 1oco h ALA 161 N 1.90 1.06 -0.55 3.60 0.00 0.66 -1.63 119.26 124.31 1oco h ALA 161 Ca -0.00 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 1oco h ALA 161 Cb 0.35 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1oco h ALA 161 CO 0.01 0.58 -0.05 0.82 0.00 0.00 0.00 179.25 180.61 1oco h ILE 162 N 0.67 1.26 -0.31 0.00 2.04 -0.61 -2.46 117.51 118.10 1oco h ILE 162 Ca 0.12 -1.18 -0.01 0.00 1.00 0.00 0.00 64.86 64.79 1oco h ILE 162 Cb 0.54 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1oco h ILE 162 CO 0.03 0.42 0.14 -1.13 0.00 0.00 0.00 178.15 177.61 1oco h ASN 163 N 0.89 0.41 -0.55 1.72 -0.73 -1.13 -2.22 115.58 113.97 1oco h ASN 163 Ca 0.15 -0.14 -0.11 0.00 1.87 0.00 0.00 56.30 58.08 1oco h ASN 163 Cb 0.59 -0.11 -0.02 0.00 0.27 0.00 0.00 38.32 39.05 1oco h ASN 163 CO 0.04 0.44 -0.09 -0.26 -0.37 0.00 0.00 177.43 177.18 1oco h PHE 164 N 0.37 1.15 -0.05 0.67 0.04 -1.25 0.11 116.94 117.97 1oco h PHE 164 Ca 0.11 -0.23 -0.01 0.00 2.80 0.00 0.00 57.97 60.63 1oco h PHE 164 Cb 0.14 -0.29 -0.00 0.00 2.20 0.00 0.00 35.95 38.00 1oco h PHE 164 CO -0.01 1.06 -0.02 0.82 -0.60 0.00 0.00 178.31 179.55 1oco h ILE 165 N 0.91 1.32 -0.63 -0.55 2.04 -1.44 0.14 117.51 119.31 1oco h ILE 165 Ca 0.14 -1.01 0.01 0.00 1.00 0.00 0.00 64.86 65.01 1oco h ILE 165 Cb 0.66 1.89 -0.03 0.00 -0.74 0.00 0.00 36.82 38.59 1oco h ILE 165 CO 0.05 0.27 0.41 0.74 0.00 0.00 0.00 178.15 179.62 1oco h THR 166 N -0.27 1.14 0.57 -0.27 2.02 -1.39 -0.94 112.91 113.77 1oco h THR 166 Ca 0.01 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 1oco h THR 166 Cb 0.45 0.24 0.01 0.00 -1.74 0.00 0.00 68.15 67.11 1oco h THR 166 CO 0.01 0.15 -0.27 0.74 0.37 0.00 0.00 175.52 176.51 1oco h THR 167 N 0.82 0.00 -0.35 3.16 2.02 -0.72 0.20 112.91 118.03 1oco h THR 167 Ca 0.24 -0.05 0.10 0.00 0.77 0.00 0.00 66.41 67.46 1oco h THR 167 Cb -0.07 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.33 1oco h THR 167 CO -0.06 0.00 0.36 0.40 0.37 0.00 0.00 175.52 176.59 1oco h ILE 168 N -0.82 0.45 0.04 3.11 2.04 -0.97 -1.06 117.51 120.29 1oco h ILE 168 Ca -0.08 0.00 -0.38 0.00 1.00 0.00 0.00 64.86 65.40 1oco h ILE 168 Cb 0.59 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 37.33 1oco h ILE 168 CO 0.13 0.00 -2.27 -0.38 0.00 0.00 0.00 178.15 175.63 1oco n ILE 169 N -3.82 1.60 0.94 -0.67 5.41 -0.36 -4.65 119.36 117.81 1oco n ILE 169 Ca 0.06 -0.56 0.11 0.00 1.00 0.00 0.00 62.75 63.35 1oco n ILE 169 Cb 0.53 -1.59 0.01 0.00 -0.71 0.00 0.00 39.64 37.88 1oco n ILE 169 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1oco n ASN 170 N -3.46 0.79 -1.81 4.38 5.15 0.68 -4.59 115.26 116.40 1oco n ASN 170 Ca -0.41 -0.68 -0.19 0.00 -0.60 0.00 0.00 54.58 52.70 1oco n ASN 170 Cb 0.99 0.76 0.05 0.00 -0.53 0.00 0.00 39.78 41.05 1oco n ASN 170 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 1oco n MET 171 N -1.55 3.28 -3.54 1.20 2.81 -0.42 -5.04 117.12 113.86 1oco n MET 171 Ca 0.04 -4.03 -0.22 0.00 -1.81 0.00 0.00 57.70 51.68 1oco n MET 171 Cb 0.35 -2.17 -0.01 0.00 -0.71 0.00 0.00 33.22 30.68 1oco n MET 171 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1oco s LYS 172 N -3.54 3.37 0.14 0.03 1.02 -1.26 -4.38 119.74 115.13 1oco s LYS 172 Ca 0.49 -0.58 -0.33 0.00 0.02 0.00 0.00 55.97 55.57 1oco s LYS 172 Cb 0.40 -2.75 -0.12 0.00 -0.52 0.00 0.00 37.83 34.84 1oco s LYS 172 CO 0.02 0.18 1.72 -2.30 -0.92 0.00 0.00 175.35 174.06 1oco n PRO 173 N -1.67 2.53 -0.28 -1.68 -0.02 -1.25 -4.79 135.00 127.82 1oco n PRO 173 Ca -0.05 0.92 0.32 0.00 -2.02 0.00 0.00 63.50 62.67 1oco n PRO 173 Cb 0.57 -2.75 0.54 0.00 -0.02 0.00 0.00 33.50 31.84 1oco n PRO 173 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1oco h PRO 174 N 7.22 0.00 0.00 0.52 0.11 -1.95 0.37 132.00 138.27 1oco h PRO 174 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1oco h PRO 174 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1oco h PRO 174 CO 0.93 0.00 -0.73 0.00 -0.21 0.00 0.00 178.00 177.99 1oco n ALA 175 N -2.39 3.93 -2.64 -0.75 0.00 -1.26 -4.90 120.51 112.50 1oco n ALA 175 Ca 0.26 -0.44 -0.41 0.00 0.00 0.00 0.00 53.44 52.85 1oco n ALA 175 Cb 1.54 -0.98 -0.05 0.00 0.00 0.00 0.00 19.45 19.95 1oco n ALA 175 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1oco s MET 176 N -3.03 4.18 0.60 0.00 0.00 0.13 -4.96 119.30 116.22 1oco s MET 176 Ca 0.09 0.74 -0.03 0.00 0.00 0.00 0.00 55.69 56.48 1oco s MET 176 Cb 0.17 -3.62 0.03 0.00 0.00 0.00 0.00 34.83 31.40 1oco s MET 176 CO 0.77 -0.39 0.87 -1.54 0.00 0.00 0.00 175.02 174.73 1oco s SER 177 N 1.33 5.29 0.53 1.11 1.04 -1.26 -4.78 113.70 116.96 1oco s SER 177 Ca 0.31 0.38 0.25 0.00 0.48 0.00 0.00 55.95 57.37 1oco s SER 177 Cb -0.16 -1.27 1.48 0.00 0.10 0.00 0.00 66.02 66.17 1oco s SER 177 CO 0.09 -1.20 2.12 -0.61 0.98 0.00 0.00 173.24 174.62 1oco h GLN 178 N -0.17 0.00 -0.76 4.02 5.75 -1.97 -0.33 115.11 121.65 1oco h GLN 178 Ca -0.44 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.06 1oco h GLN 178 Cb 1.29 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.84 1oco h GLN 178 CO 0.58 0.08 0.00 0.66 -2.65 0.00 0.00 178.83 177.50 1oco n TYR 179 N -3.89 0.03 -0.25 3.99 4.01 -1.26 -2.25 117.16 117.54 1oco n TYR 179 Ca -0.02 -0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 1oco n TYR 179 Cb 0.18 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 1oco n TYR 179 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1oco n GLN 180 N -0.10 -0.18 -2.98 -0.72 6.02 -0.14 -5.06 117.38 114.22 1oco n GLN 180 Ca 0.01 -0.33 -0.31 0.00 -0.01 0.00 0.00 57.00 56.36 1oco n GLN 180 Cb 0.21 -0.81 -0.04 0.00 1.02 0.00 0.00 30.24 30.61 1oco n GLN 180 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1oco s THR 181 N -0.07 4.80 0.69 5.09 -4.23 -0.95 -4.93 115.64 116.03 1oco s THR 181 Ca 0.00 0.61 -0.15 0.00 -1.18 0.00 0.00 61.69 60.97 1oco s THR 181 Cb 0.00 -3.71 0.02 0.00 1.34 0.00 0.00 72.50 70.15 1oco s THR 181 CO 0.00 -0.42 1.15 -2.84 -0.54 0.00 0.00 174.62 171.97 1oco s PRO 182 N -3.62 2.53 0.37 3.99 0.02 -1.26 -4.85 135.00 132.19 1oco s PRO 182 Ca 0.51 1.55 0.05 0.00 0.02 0.00 0.00 61.00 63.12 1oco s PRO 182 Cb -0.10 -1.90 0.73 0.00 0.02 0.00 0.00 34.50 33.24 1oco s PRO 182 CO 0.28 -1.49 2.01 -0.07 -0.33 0.00 0.00 177.00 177.40 1oco h LEU 183 N -0.08 0.58 -0.48 -5.54 3.38 -1.97 -1.60 115.31 109.60 1oco h LEU 183 Ca -0.47 -0.03 0.05 0.00 0.09 0.00 0.00 57.88 57.52 1oco h LEU 183 Cb 1.27 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.83 1oco h LEU 183 CO 0.52 0.45 0.22 0.15 0.09 0.00 0.00 178.44 179.88 1oco h PHE 184 N 0.67 0.40 -0.41 1.13 3.57 -1.92 0.33 116.94 120.70 1oco h PHE 184 Ca 0.18 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.74 1oco h PHE 184 Cb -0.01 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.58 1oco h PHE 184 CO 0.00 0.18 0.17 0.28 -2.23 0.00 0.00 178.31 176.72 1oco h VAL 185 N 0.44 0.92 -0.45 1.41 2.07 -1.68 0.13 116.25 119.09 1oco h VAL 185 Ca 0.22 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.64 1oco h VAL 185 Cb 0.16 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1oco h VAL 185 CO -0.17 0.06 0.25 -0.50 0.02 0.00 0.00 177.57 177.23 1oco h TRP 186 N 0.36 0.45 -0.84 1.57 4.06 -0.66 0.18 115.95 121.07 1oco h TRP 186 Ca 0.18 0.02 0.04 0.00 2.06 0.00 0.00 58.89 61.19 1oco h TRP 186 Cb 0.14 -0.14 -0.05 0.00 -1.00 0.00 0.00 29.16 28.10 1oco h TRP 186 CO -0.13 0.25 0.53 0.66 -3.56 0.00 0.00 178.44 176.19 1oco h SER 187 N 0.49 0.87 1.86 -3.49 4.64 0.91 -0.30 113.55 118.53 1oco h SER 187 Ca 0.19 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.50 1oco h SER 187 Cb 0.06 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 61.96 1oco h SER 187 CO -0.11 0.58 -0.14 -0.37 -0.87 0.00 0.00 176.83 175.92 1oco h VAL 188 N 1.02 0.09 -0.03 0.95 -1.51 -0.12 -2.20 116.25 114.44 1oco h VAL 188 Ca 0.35 -1.13 -0.01 0.00 -1.23 0.00 0.00 66.70 64.67 1oco h VAL 188 Cb 0.06 2.00 -0.00 0.00 -2.13 0.00 0.00 31.29 31.23 1oco h VAL 188 CO -0.13 0.05 -0.03 -0.03 -1.23 0.00 0.00 177.57 176.20 1oco h MET 189 N 0.00 0.08 -0.43 5.19 -1.53 0.32 -1.86 114.93 116.70 1oco h MET 189 Ca -0.00 -0.04 0.03 0.00 -3.44 0.00 0.00 59.70 56.24 1oco h MET 189 Cb 1.05 0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 32.06 1oco h MET 189 CO 0.01 0.53 0.23 0.82 0.14 0.00 0.00 176.91 178.64 1oco h ILE 190 N -0.38 1.01 -0.47 1.77 2.04 -1.14 -1.58 117.51 118.76 1oco h ILE 190 Ca 0.01 -0.16 0.07 0.00 1.00 0.00 0.00 64.86 65.77 1oco h ILE 190 Cb 0.52 0.50 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 1oco h ILE 190 CO 0.01 0.09 0.14 0.74 0.00 0.00 0.00 178.15 179.12 1oco h THR 191 N 0.47 0.81 -1.01 -0.27 2.02 -1.43 -1.04 112.91 112.47 1oco h THR 191 Ca 0.18 -0.10 0.07 0.00 0.77 0.00 0.00 66.41 67.33 1oco h THR 191 Cb 0.05 0.49 -0.07 0.00 -1.74 0.00 0.00 68.15 66.87 1oco h THR 191 CO -0.10 0.05 0.65 0.00 0.37 0.00 0.00 175.52 176.49 1oco h ALA 192 N 1.33 1.42 -0.48 6.16 0.00 -0.53 -1.89 119.26 125.27 1oco h ALA 192 Ca 0.23 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1oco h ALA 192 Cb 0.26 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1oco h ALA 192 CO -0.25 0.42 0.14 0.28 0.00 0.00 0.00 179.25 179.84 1oco h VAL 193 N 1.16 1.23 -0.83 0.00 2.07 -0.31 -1.10 116.25 118.47 1oco h VAL 193 Ca 0.44 -0.79 0.02 0.00 0.82 0.00 0.00 66.70 67.19 1oco h VAL 193 Cb 0.20 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 1oco h VAL 193 CO -0.18 0.29 0.55 -0.07 0.02 0.00 0.00 177.57 178.17 1oco h LEU 194 N 0.65 0.93 -0.33 2.57 4.07 -0.68 -2.02 115.31 120.50 1oco h LEU 194 Ca 0.15 -0.02 -0.08 0.00 0.08 0.00 0.00 57.88 58.01 1oco h LEU 194 Cb 0.29 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.80 1oco h LEU 194 CO -0.00 0.66 -0.11 -0.07 -1.08 0.00 0.00 178.44 177.84 1oco h LEU 195 N 1.09 0.66 -1.12 1.67 3.38 -1.11 -1.47 115.31 118.40 1oco h LEU 195 Ca 0.31 -0.38 0.08 0.00 0.09 0.00 0.00 57.88 57.99 1oco h LEU 195 Cb -0.07 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.43 1oco h LEU 195 CO -0.08 0.89 0.60 0.25 0.09 0.00 0.00 178.44 180.20 1oco h LEU 196 N 0.42 0.89 0.14 1.67 5.85 -0.51 -2.77 115.31 121.01 1oco h LEU 196 Ca 0.08 0.02 -0.33 0.00 0.84 0.00 0.00 57.88 58.48 1oco h LEU 196 Cb 0.62 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.48 1oco h LEU 196 CO 0.04 0.54 -1.73 -0.07 -0.34 0.00 0.00 178.44 176.89 1oco h LEU 197 N 1.00 0.48 0.10 2.25 3.38 -1.41 -3.41 115.31 117.70 1oco h LEU 197 Ca 0.42 -0.91 -0.19 0.00 0.09 0.00 0.00 57.88 57.29 1oco h LEU 197 Cb 0.31 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1oco h LEU 197 CO -0.18 1.76 -0.91 0.77 0.09 0.00 0.00 178.44 179.97 1oco h SER 198 N -0.05 0.33 -0.90 -0.43 4.64 -1.29 -3.38 113.55 112.47 1oco h SER 198 Ca -0.36 -0.89 0.19 0.00 -0.47 0.00 0.00 61.79 60.25 1oco h SER 198 Cb 1.97 -0.11 -0.07 0.00 -0.31 0.00 0.00 62.40 63.88 1oco h SER 198 CO 0.11 1.41 0.59 -0.07 -0.87 0.00 0.00 176.83 177.99 1oco h LEU 199 N -0.50 0.48 -1.08 5.97 4.07 -1.68 -0.66 115.31 121.91 1oco h LEU 199 Ca -0.19 0.05 -0.09 0.00 0.08 0.00 0.00 57.88 57.73 1oco h LEU 199 Cb 1.55 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 43.24 1oco h LEU 199 CO 0.07 0.20 -0.37 -0.65 -1.08 0.00 0.00 178.44 176.62 1oco h PRO 200 N 0.48 0.17 -0.57 1.13 0.11 -1.78 -1.84 132.00 129.71 1oco h PRO 200 Ca 0.47 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 66.45 1oco h PRO 200 Cb 1.05 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1oco h PRO 200 CO -0.20 0.52 0.11 0.28 -0.21 0.00 0.00 178.00 178.51 1oco h VAL 201 N 0.15 1.25 -0.46 3.15 2.07 -1.32 -1.17 116.25 119.92 1oco h VAL 201 Ca 0.02 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.60 1oco h VAL 201 Cb 0.72 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1oco h VAL 201 CO 0.05 0.34 0.28 0.25 0.02 0.00 0.00 177.57 178.51 1oco h LEU 202 N 0.82 0.55 -1.76 2.57 5.85 -1.33 -0.02 115.31 121.98 1oco h LEU 202 Ca 0.17 -0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.94 1oco h LEU 202 Cb 0.38 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1oco h LEU 202 CO 0.01 0.44 0.36 0.00 -0.34 0.00 0.00 178.44 178.91 1oco h ALA 203 N 1.13 2.14 0.08 1.25 0.00 -0.86 0.15 119.26 123.15 1oco h ALA 203 Ca 0.16 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1oco h ALA 203 Cb -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1oco h ALA 203 CO -0.03 -0.26 -0.04 0.00 0.00 0.00 0.00 179.25 178.92 1oco h ALA 204 N 1.74 -0.11 -0.24 0.00 0.00 -0.42 -2.79 119.26 117.44 1oco h ALA 204 Ca 0.24 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.93 1oco h ALA 204 Cb 0.61 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 1oco h ALA 204 CO -0.05 -0.20 -0.19 0.78 0.00 0.00 0.00 179.25 179.59 1oco h GLY 205 N -0.82 -0.05 2.00 0.00 0.00 -0.11 0.26 103.07 104.35 1oco h GLY 205 Ca -0.01 0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1oco h GLY 205 CO 0.02 -0.18 0.00 0.16 0.00 0.00 0.00 176.54 176.54 1oco h ILE 206 N -0.19 0.00 0.02 2.60 3.07 -0.87 -2.14 117.51 120.00 1oco h ILE 206 Ca 0.14 -0.35 -0.23 0.00 1.55 0.00 0.00 64.86 65.96 1oco h ILE 206 Cb 0.39 1.20 0.00 0.00 -0.27 0.00 0.00 36.82 38.15 1oco h ILE 206 CO -0.35 0.00 -0.98 0.74 -1.05 0.00 0.00 178.15 176.51 1oco h THR 207 N 0.00 1.40 -0.59 0.16 2.02 -0.69 -2.48 112.91 112.73 1oco h THR 207 Ca 0.00 -2.51 -0.09 0.00 0.77 0.00 0.00 66.41 64.58 1oco h THR 207 Cb 0.42 2.48 -0.02 0.00 -1.74 0.00 0.00 68.15 69.29 1oco h THR 207 CO 0.00 0.75 0.00 0.24 0.37 0.00 0.00 175.52 176.88 1oco h MET 208 N 0.22 1.04 -0.61 6.66 2.86 -0.69 -1.38 114.93 123.03 1oco h MET 208 Ca -0.09 -0.33 -0.09 0.00 -2.06 0.00 0.00 59.70 57.13 1oco h MET 208 Cb 1.63 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 33.17 1oco h MET 208 CO 0.17 1.02 0.02 1.25 1.06 0.00 0.00 176.91 180.43 1oco h LEU 209 N 0.94 1.05 -1.30 1.22 5.85 -1.40 -0.72 115.31 120.95 1oco h LEU 209 Ca 0.17 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.54 1oco h LEU 209 Cb 0.55 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1oco h LEU 209 CO 0.03 1.09 -0.09 0.25 -0.34 0.00 0.00 178.44 179.38 1oco h LEU 210 N 0.98 0.34 -0.13 2.25 5.85 -1.07 0.05 115.31 123.58 1oco h LEU 210 Ca 0.18 -0.07 -0.22 0.00 0.84 0.00 0.00 57.88 58.61 1oco h LEU 210 Cb 0.54 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1oco h LEU 210 CO 0.03 0.47 -0.99 0.71 -0.34 0.00 0.00 178.44 178.32 1oco h THR 211 N 0.34 1.53 0.00 1.05 1.35 -0.93 -1.90 112.91 114.35 1oco h THR 211 Ca 0.07 -2.86 -0.04 0.00 -0.55 0.00 0.00 66.41 63.03 1oco h THR 211 Cb 0.38 2.65 -0.01 0.00 -1.73 0.00 0.00 68.15 69.45 1oco h THR 211 CO 0.02 0.83 -0.17 0.44 -0.25 0.00 0.00 175.52 176.39 1oco h ASP 212 N 0.09 0.00 0.94 5.36 5.19 -0.33 0.44 116.42 128.11 1oco h ASP 212 Ca -0.06 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1oco h ASP 212 Cb 1.67 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.18 1oco h ASP 212 CO 0.15 0.17 -1.01 0.54 -3.12 0.00 0.00 179.24 175.98 1oco n ARG 213 N -3.90 0.58 0.00 3.56 1.74 -0.07 -4.56 116.66 114.01 1oco n ARG 213 Ca -0.02 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 1oco n ARG 213 Cb 0.26 -1.80 0.00 0.00 -1.02 0.00 0.00 32.46 29.90 1oco n ARG 213 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1oco n ASN 214 N -2.61 1.06 -0.40 0.55 3.02 -0.73 -4.81 115.26 111.33 1oco n ASN 214 Ca 0.00 -0.03 0.08 0.00 -0.03 0.00 0.00 54.58 54.60 1oco n ASN 214 Cb 0.54 0.28 0.17 0.00 -0.61 0.00 0.00 39.78 40.16 1oco n ASN 214 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1oco n LEU 215 N -0.39 2.92 -3.08 3.41 4.32 0.15 -5.00 117.00 119.34 1oco n LEU 215 Ca 0.00 -2.90 -0.22 0.00 -0.02 0.00 0.00 56.01 52.87 1oco n LEU 215 Cb 0.00 -0.42 0.02 0.00 -1.62 0.00 0.00 43.42 41.40 1oco n LEU 215 CO 0.00 0.68 -0.04 0.59 -1.22 0.00 0.00 177.39 177.40 1oco n ASN 216 N -0.89 -5.11 -4.70 -1.43 3.02 -1.13 -4.95 115.26 100.07 1oco n ASN 216 Ca 0.16 -0.28 -0.25 0.00 -0.03 0.00 0.00 54.58 54.18 1oco n ASN 216 Cb 0.69 -4.17 0.10 0.00 -0.61 0.00 0.00 39.78 35.78 1oco n ASN 216 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1oco s THR 217 N -3.05 2.23 -0.31 3.41 -4.23 -1.22 -5.03 115.64 107.44 1oco s THR 217 Ca 0.31 -0.39 0.18 0.00 -1.18 0.00 0.00 61.69 60.61 1oco s THR 217 Cb -0.15 -2.84 0.46 0.00 1.34 0.00 0.00 72.50 71.32 1oco s THR 217 CO 0.38 0.00 1.17 0.35 -0.54 0.00 0.00 174.62 175.97 1oco n THR 218 N -2.97 0.82 -0.25 3.99 -2.24 -1.26 -4.52 114.28 107.86 1oco n THR 218 Ca 0.12 -2.46 0.03 0.00 -2.27 0.00 0.00 64.05 59.46 1oco n THR 218 Cb 0.60 1.03 0.16 0.00 -2.10 0.00 0.00 70.33 70.02 1oco n THR 218 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1oco h PHE 219 N 2.38 0.61 -0.34 4.78 0.04 -1.95 -2.92 116.94 119.54 1oco h PHE 219 Ca -0.20 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.60 1oco h PHE 219 Cb 1.25 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 39.24 1oco h PHE 219 CO 0.36 0.18 0.00 1.19 -0.60 0.00 0.00 178.31 179.44 1oco n PHE 220 N -4.90 0.45 -3.57 -0.55 3.72 -1.26 -1.30 117.46 110.05 1oco n PHE 220 Ca 0.12 -0.45 -0.39 0.00 -0.05 0.00 0.00 57.45 56.69 1oco n PHE 220 Cb 0.32 -0.02 -0.11 0.00 -0.94 0.00 0.00 39.48 38.73 1oco n PHE 220 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1oco s ASP 221 N -1.00 5.98 0.52 4.37 -1.08 -1.11 -2.34 116.67 122.01 1oco s ASP 221 Ca 0.24 -0.21 0.16 0.00 -0.52 0.00 0.00 52.55 52.22 1oco s ASP 221 Cb 0.13 -2.12 1.27 0.00 -1.46 0.00 0.00 42.92 40.74 1oco s ASP 221 CO 0.17 -0.13 2.14 -0.65 0.52 0.00 0.00 175.17 177.22 1oco h PRO 222 N 8.41 0.00 -0.41 4.34 0.11 -1.86 0.43 132.00 143.02 1oco h PRO 222 Ca -0.33 0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.86 1oco h PRO 222 Cb 1.17 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.20 1oco h PRO 222 CO 0.59 0.01 -0.17 0.00 -0.21 0.00 0.00 178.00 178.22 1oco h ALA 223 N 1.99 0.15 -0.08 -0.75 0.00 -1.93 0.93 119.26 119.57 1oco h ALA 223 Ca -0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1oco h ALA 223 Cb 0.01 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1oco h ALA 223 CO 0.00 -0.53 0.00 0.41 0.00 0.00 0.00 179.25 179.13 1oco n GLY 224 N -1.36 -0.58 1.30 0.00 0.00 -0.69 -4.82 105.19 99.03 1oco n GLY 224 Ca 0.02 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1oco n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oco n GLY 225 N 0.72 0.64 0.00 -0.02 0.00 0.32 -4.96 105.19 101.89 1oco n GLY 225 Ca 0.06 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1oco n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oco n GLY 226 N -2.65 -1.82 3.06 -0.02 0.00 0.14 -4.87 105.19 99.03 1oco n GLY 226 Ca 0.00 -1.54 -0.01 0.00 0.00 0.00 0.00 46.02 44.47 1oco n GLY 226 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1oco s ASP 227 N -1.28 -0.82 0.66 1.61 -1.08 -0.42 -3.94 116.67 111.39 1oco s ASP 227 Ca 0.00 0.45 0.29 0.00 -0.52 0.00 0.00 52.55 52.77 1oco s ASP 227 Cb 0.00 1.76 1.60 0.00 -1.46 0.00 0.00 42.92 44.82 1oco s ASP 227 CO 0.00 -0.29 1.91 -0.65 0.52 0.00 0.00 175.17 176.66 1oco h PRO 228 N 8.06 0.00 0.00 4.34 0.11 -1.75 0.11 132.00 142.87 1oco h PRO 228 Ca -0.16 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.81 1oco h PRO 228 Cb 1.16 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1oco h PRO 228 CO 0.24 0.00 -0.64 0.82 -0.21 0.00 0.00 178.00 178.22 1oco h ILE 229 N 0.00 1.15 -0.88 4.15 1.08 -1.91 -3.20 117.51 117.91 1oco h ILE 229 Ca 0.02 -2.47 0.00 0.00 -0.39 0.00 0.00 64.86 62.02 1oco h ILE 229 Cb 0.72 2.46 -0.04 0.00 -3.07 0.00 0.00 36.82 36.89 1oco h ILE 229 CO -0.00 0.62 0.55 0.25 -0.69 0.00 0.00 178.15 178.88 1oco h LEU 230 N 0.00 1.04 -0.99 1.44 5.85 -1.13 -1.38 115.31 120.13 1oco h LEU 230 Ca -0.01 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1oco h LEU 230 Cb 1.41 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 42.13 1oco h LEU 230 CO 0.08 0.78 0.65 0.22 -0.34 0.00 0.00 178.44 179.84 1oco h TYR 231 N 1.20 1.23 -0.01 1.25 3.20 -1.64 -1.15 116.97 121.05 1oco h TYR 231 Ca 0.32 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.21 1oco h TYR 231 Cb -0.08 -0.42 -0.00 0.00 1.54 0.00 0.00 36.73 37.77 1oco h TYR 231 CO -0.00 0.76 0.00 1.96 -1.64 0.00 0.00 178.16 179.24 1oco h GLN 232 N 1.32 0.02 0.24 1.82 4.20 -1.31 -1.14 115.11 120.25 1oco h GLN 232 Ca 0.37 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.07 1oco h GLN 232 Cb -0.12 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.66 1oco h GLN 232 CO -0.09 0.02 -0.11 0.45 -0.67 0.00 0.00 178.83 178.43 1oco h HIS 233 N 0.02 -0.29 0.06 2.96 3.86 -0.75 -2.26 115.15 118.74 1oco h HIS 233 Ca 0.01 -0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.23 1oco h HIS 233 Cb 0.01 0.10 -0.04 0.00 1.06 0.00 0.00 27.41 28.53 1oco h HIS 233 CO 0.00 0.04 -0.32 -0.07 0.86 0.00 0.00 177.93 178.44 1oco h LEU 234 N -0.96 -0.94 0.25 2.43 3.38 -1.30 0.01 115.31 118.18 1oco h LEU 234 Ca -0.03 0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1oco h LEU 234 Cb 0.47 0.37 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 1oco h LEU 234 CO 0.05 -0.40 -0.44 0.15 0.09 0.00 0.00 178.44 177.89 1oco h PHE 235 N -0.51 -1.24 0.00 1.13 3.04 -1.33 -2.10 116.94 115.93 1oco h PHE 235 Ca 0.05 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.02 1oco h PHE 235 Cb 0.57 0.51 -0.00 0.00 2.56 0.00 0.00 35.95 39.59 1oco h PHE 235 CO -0.32 -0.56 -0.00 -1.49 -2.02 0.00 0.00 178.31 173.92 1oco h TRP 236 N -0.77 0.00 -0.07 0.41 4.06 -1.11 0.50 115.95 118.97 1oco h TRP 236 Ca -0.01 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.86 1oco h TRP 236 Cb 0.74 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.89 1oco h TRP 236 CO -0.33 0.00 -0.34 0.35 -3.56 0.00 0.00 178.44 174.56 1oco h PHE 237 N 0.00 0.15 0.11 0.49 3.57 -0.28 -1.87 116.94 119.11 1oco h PHE 237 Ca -0.00 -0.03 -0.35 0.00 3.53 0.00 0.00 57.97 61.12 1oco h PHE 237 Cb 0.04 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 1oco h PHE 237 CO 0.00 0.46 -1.93 0.34 -2.23 0.00 0.00 178.31 174.95 1oco n PHE 238 N -4.10 1.21 -0.35 0.41 7.35 -0.03 -4.35 117.46 117.60 1oco n PHE 238 Ca -0.01 0.28 0.16 0.00 -0.76 0.00 0.00 57.45 57.12 1oco n PHE 238 Cb 0.41 -1.15 0.37 0.00 0.35 0.00 0.00 39.48 39.45 1oco n PHE 238 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 1oco h GLY 239 N 0.88 1.88 0.19 7.13 0.00 0.21 -1.10 103.07 112.26 1oco h GLY 239 Ca -0.42 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 46.58 1oco h GLY 239 CO 0.05 -0.19 -0.02 0.84 0.00 0.00 0.00 176.54 177.22 1oco h HIS 240 N 0.63 -0.04 -0.79 5.60 -0.00 -1.56 -2.85 115.15 116.14 1oco h HIS 240 Ca 0.63 -0.00 0.22 0.00 -0.00 0.00 0.00 60.37 61.22 1oco h HIS 240 Cb 1.14 0.01 -0.04 0.00 -0.00 0.00 0.00 27.41 28.52 1oco h HIS 240 CO -0.01 0.65 0.56 -1.35 -0.00 0.00 0.00 177.93 177.78 1oco h PRO 241 N -0.85 0.07 -0.59 5.26 0.11 -1.59 -0.02 132.00 134.39 1oco h PRO 241 Ca -0.00 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.03 1oco h PRO 241 Cb 0.71 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.78 1oco h PRO 241 CO 0.01 0.05 0.10 1.49 -0.21 0.00 0.00 178.00 179.43 1oco h GLU 242 N 0.07 0.98 0.00 1.05 4.57 -1.17 0.17 114.58 120.25 1oco h GLU 242 Ca 0.38 -0.26 -0.03 0.00 -1.18 0.00 0.00 59.36 58.27 1oco h GLU 242 Cb 1.41 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.89 1oco h GLU 242 CO -0.03 0.93 -0.14 -0.39 -1.18 0.00 0.00 179.01 178.19 1oco h VAL 243 N 0.88 0.96 0.00 0.32 -1.51 -0.75 -1.58 116.25 114.57 1oco h VAL 243 Ca 0.18 -0.50 -0.20 0.00 -1.23 0.00 0.00 66.70 64.95 1oco h VAL 243 Cb 0.42 1.28 -0.03 0.00 -2.13 0.00 0.00 31.29 30.83 1oco h VAL 243 CO 0.01 0.14 -1.00 1.88 -1.23 0.00 0.00 177.57 177.37 1oco h TYR 244 N 0.00 0.00 0.00 5.19 0.05 -1.29 -3.04 116.97 117.88 1oco h TYR 244 Ca -0.00 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 1oco h TYR 244 Cb 0.27 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.00 1oco h TYR 244 CO 0.00 0.91 -0.16 0.82 -1.05 0.00 0.00 178.16 178.68 1oco h ILE 245 N 0.00 0.59 0.00 -2.88 2.04 -0.04 -0.52 117.51 116.71 1oco h ILE 245 Ca -0.04 -0.70 -0.05 0.00 1.00 0.00 0.00 64.86 65.07 1oco h ILE 245 Cb 1.73 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 39.26 1oco h ILE 245 CO 0.11 0.15 -0.55 -0.07 0.00 0.00 0.00 178.15 177.79 1oco h LEU 246 N 0.00 0.00 0.00 1.44 3.38 -1.25 -3.39 115.31 115.49 1oco h LEU 246 Ca -0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 1oco h LEU 246 Cb 0.45 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1oco h LEU 246 CO 0.02 0.20 -2.02 0.00 0.09 0.00 0.00 178.44 176.73 1oco n ILE 247 N -3.00 0.84 0.07 1.22 0.13 -0.80 -4.58 119.36 113.24 1oco n ILE 247 Ca 0.01 -0.61 -0.12 0.00 -1.10 0.00 0.00 62.75 60.93 1oco n ILE 247 Cb 0.63 -0.42 -0.05 0.00 -0.84 0.00 0.00 39.64 38.96 1oco n ILE 247 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 176.55 179.28 1oco h LEU 248 N 0.00 -0.77 -2.06 9.51 3.38 -1.31 0.23 115.31 124.29 1oco h LEU 248 Ca -0.33 0.10 0.06 0.00 0.09 0.00 0.00 57.88 57.80 1oco h LEU 248 Cb 1.70 0.31 -0.01 0.00 0.09 0.00 0.00 40.66 42.75 1oco h LEU 248 CO 0.02 -0.34 0.16 -0.65 0.09 0.00 0.00 178.44 177.72 1oco h PRO 249 N -0.42 0.00 -0.20 1.13 0.11 -1.79 0.36 132.00 131.19 1oco h PRO 249 Ca 0.05 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.00 1oco h PRO 249 Cb 0.49 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.60 1oco h PRO 249 CO -0.21 0.00 -0.55 0.78 -0.21 0.00 0.00 178.00 177.81 1oco h GLY 250 N 0.00 0.66 0.93 -0.55 0.00 -1.38 -0.35 103.07 102.37 1oco h GLY 250 Ca 0.10 -0.77 0.01 0.00 0.00 0.00 0.00 47.33 46.67 1oco h GLY 250 CO -0.00 0.69 0.06 0.74 0.00 0.00 0.00 176.54 178.03 1oco h PHE 251 N 0.46 0.12 0.28 5.60 0.04 0.28 -1.08 116.94 122.65 1oco h PHE 251 Ca 0.01 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.77 1oco h PHE 251 Cb 1.10 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.22 1oco h PHE 251 CO 0.05 0.07 -0.15 0.78 -0.60 0.00 0.00 178.31 178.46 1oco h GLY 252 N 0.14 -0.41 0.55 -1.45 0.00 -0.76 -1.69 103.07 99.44 1oco h GLY 252 Ca 0.06 0.16 0.08 0.00 0.00 0.00 0.00 47.33 47.62 1oco h GLY 252 CO -0.04 -0.15 0.33 -0.33 0.00 0.00 0.00 176.54 176.34 1oco h MET 253 N -0.40 0.57 -0.90 4.80 2.86 -0.93 -0.92 114.93 120.01 1oco h MET 253 Ca -0.04 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1oco h MET 253 Cb 0.31 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 31.80 1oco h MET 253 CO 0.06 0.38 0.59 0.82 1.06 0.00 0.00 176.91 179.82 1oco h ILE 254 N 0.59 1.23 -0.55 -1.22 1.08 -0.97 0.80 117.51 118.47 1oco h ILE 254 Ca 0.32 -0.43 -0.00 0.00 -0.39 0.00 0.00 64.86 64.36 1oco h ILE 254 Cb 0.29 -0.09 -0.03 0.00 -3.07 0.00 0.00 36.82 33.93 1oco h ILE 254 CO -0.24 0.23 0.33 0.28 -0.69 0.00 0.00 178.15 178.06 1oco h SER 255 N 1.22 0.66 -0.64 1.72 0.02 -0.24 0.23 113.55 116.52 1oco h SER 255 Ca 0.33 -0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 61.13 1oco h SER 255 Cb -0.13 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.22 1oco h SER 255 CO -0.07 0.52 0.05 0.45 -1.14 0.00 0.00 176.83 176.63 1oco h HIS 256 N 0.74 1.19 -0.08 3.45 3.86 -0.61 -2.68 115.15 121.03 1oco h HIS 256 Ca 0.20 -0.19 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 1oco h HIS 256 Cb -0.02 -0.32 -0.00 0.00 1.06 0.00 0.00 27.41 28.13 1oco h HIS 256 CO -0.03 1.02 -0.04 0.82 0.86 0.00 0.00 177.93 180.57 1oco h ILE 257 N 1.02 1.33 -0.38 2.45 2.04 -0.53 -1.84 117.51 121.59 1oco h ILE 257 Ca 0.19 -1.07 -0.05 0.00 1.00 0.00 0.00 64.86 64.93 1oco h ILE 257 Cb 0.52 1.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 1oco h ILE 257 CO 0.02 0.30 0.04 0.58 0.00 0.00 0.00 178.15 179.09 1oco h VAL 258 N -0.22 1.20 -0.08 1.67 2.07 -0.99 -2.42 116.25 117.49 1oco h VAL 258 Ca 0.02 -0.77 -0.13 0.00 0.82 0.00 0.00 66.70 66.63 1oco h VAL 258 Cb 0.50 0.87 0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1oco h VAL 258 CO 0.01 0.27 -0.48 0.74 0.02 0.00 0.00 177.57 178.13 1oco h THR 259 N 0.57 1.39 -0.74 2.57 2.02 -1.51 -3.09 112.91 114.11 1oco h THR 259 Ca 0.12 -1.85 0.02 0.00 0.77 0.00 0.00 66.41 65.47 1oco h THR 259 Cb 0.31 2.30 -0.04 0.00 -1.74 0.00 0.00 68.15 68.98 1oco h THR 259 CO 0.01 0.55 0.48 0.22 0.37 0.00 0.00 175.52 177.14 1oco h TYR 260 N 0.01 0.90 -0.32 3.16 3.20 -1.04 -2.34 116.97 120.54 1oco h TYR 260 Ca -0.04 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1oco h TYR 260 Cb 1.14 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.11 1oco h TYR 260 CO 0.12 0.53 0.00 0.66 -1.64 0.00 0.00 178.16 177.83 1oco n TYR 261 N -4.61 0.49 0.37 -3.82 4.01 -0.94 -2.71 117.16 109.95 1oco n TYR 261 Ca 0.08 -0.23 0.04 0.00 -0.16 0.00 0.00 57.90 57.63 1oco n TYR 261 Cb 0.06 -0.04 0.03 0.00 -0.31 0.00 0.00 39.34 39.09 1oco n TYR 261 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1oco n SER 262 N 0.43 1.58 -2.21 7.72 7.64 -1.06 -1.35 113.62 126.37 1oco n SER 262 Ca 0.11 -1.29 -0.17 0.00 1.01 0.00 0.00 58.87 58.53 1oco n SER 262 Cb 0.32 0.11 0.01 0.00 -1.01 0.00 0.00 64.21 63.64 1oco n SER 262 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1oco n GLY 263 N 0.57 -0.29 3.94 0.23 0.00 -1.10 0.21 105.19 108.75 1oco n GLY 263 Ca 0.05 -0.11 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 1oco n GLY 263 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oco s LYS 264 N -5.20 3.50 0.19 1.61 -0.14 -0.90 -4.77 119.74 114.02 1oco s LYS 264 Ca 0.14 -0.41 0.24 0.00 -1.36 0.00 0.00 55.97 54.58 1oco s LYS 264 Cb -0.06 -2.82 0.41 0.00 -1.68 0.00 0.00 37.83 33.68 1oco s LYS 264 CO 0.18 0.36 1.42 1.57 -0.76 0.00 0.00 175.35 178.12 1oco h LYS 265 N 1.63 0.00 -2.35 1.68 2.10 -1.95 -3.43 116.57 114.25 1oco h LYS 265 Ca -0.49 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.17 1oco h LYS 265 Cb 1.20 0.00 -0.16 0.00 -0.90 0.00 0.00 32.23 32.37 1oco h LYS 265 CO 0.66 0.00 0.31 -1.83 -2.00 0.00 0.00 179.45 176.59 1oco s GLU 266 N -3.18 1.02 0.56 0.07 -1.05 -1.26 -4.90 118.70 109.96 1oco s GLU 266 Ca 0.06 -0.13 -0.18 0.00 -0.15 0.00 0.00 54.97 54.57 1oco s GLU 266 Cb 0.12 0.48 -0.05 0.00 -0.44 0.00 0.00 34.13 34.23 1oco s GLU 266 CO 0.70 -0.40 1.08 -1.25 0.95 0.00 0.00 175.26 176.34 1oco s PRO 267 N -2.50 3.39 0.52 -4.83 0.04 -1.26 -4.98 135.00 125.38 1oco s PRO 267 Ca -0.02 1.40 -0.22 0.00 0.04 0.00 0.00 61.00 62.19 1oco s PRO 267 Cb -0.01 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.45 1oco s PRO 267 CO -0.03 -0.78 1.32 0.12 0.04 0.00 0.00 177.00 177.67 1oco s PHE 268 N -2.10 2.41 -1.21 0.56 2.19 -1.26 -3.80 117.98 114.76 1oco s PHE 268 Ca 0.68 1.40 -0.27 0.00 0.33 0.00 0.00 56.93 59.07 1oco s PHE 268 Cb -0.19 -3.72 0.02 0.00 -1.31 0.00 0.00 43.02 37.82 1oco s PHE 268 CO 0.30 -2.63 0.68 0.41 1.83 0.00 0.00 175.22 175.82 1oco n GLY 269 N 0.66 -0.83 0.25 13.12 0.00 -1.26 -4.82 105.19 112.31 1oco n GLY 269 Ca 0.10 0.37 -0.08 0.00 0.00 0.00 0.00 46.02 46.40 1oco n GLY 269 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1oco h TYR 270 N -2.29 -0.55 0.00 1.61 5.03 -1.98 -0.54 116.97 118.24 1oco h TYR 270 Ca -0.69 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 60.60 1oco h TYR 270 Cb 1.39 0.27 -0.01 0.00 1.55 0.00 0.00 36.73 39.93 1oco h TYR 270 CO 0.37 -0.29 -0.23 0.52 -1.32 0.00 0.00 178.16 177.21 1oco h MET 271 N -0.23 0.00 -0.00 1.82 2.86 -1.94 -1.52 114.93 115.92 1oco h MET 271 Ca 0.12 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.58 1oco h MET 271 Cb 0.42 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1oco h MET 271 CO -0.34 0.23 -0.83 0.78 1.06 0.00 0.00 176.91 177.81 1oco h GLY 272 N 1.34 0.16 1.92 8.32 0.00 -1.67 -1.19 103.07 111.94 1oco h GLY 272 Ca -0.00 -0.27 -0.10 0.00 0.00 0.00 0.00 47.33 46.95 1oco h GLY 272 CO 0.03 0.24 -0.46 1.98 0.00 0.00 0.00 176.54 178.33 1oco h MET 273 N 0.08 0.09 -0.01 4.80 -1.53 -0.75 0.20 114.93 117.81 1oco h MET 273 Ca -0.03 -0.05 -0.12 0.00 -3.44 0.00 0.00 59.70 56.07 1oco h MET 273 Cb 1.45 0.00 0.01 0.00 -0.55 0.00 0.00 31.60 32.51 1oco h MET 273 CO 0.12 0.53 -0.45 0.28 0.14 0.00 0.00 176.91 177.53 1oco h VAL 274 N 0.08 1.47 -0.58 -5.77 2.07 -1.05 -2.96 116.25 109.50 1oco h VAL 274 Ca 0.00 -2.01 0.04 0.00 0.82 0.00 0.00 66.70 65.55 1oco h VAL 274 Cb 0.84 2.64 -0.04 0.00 -1.52 0.00 0.00 31.29 33.21 1oco h VAL 274 CO 0.06 0.57 0.33 -0.25 0.02 0.00 0.00 177.57 178.31 1oco h TRP 275 N -0.25 0.62 0.08 1.57 7.01 -1.03 -2.12 115.95 121.82 1oco h TRP 275 Ca -0.05 0.02 0.02 0.00 2.11 0.00 0.00 58.89 60.99 1oco h TRP 275 Cb 1.18 -0.19 -0.03 0.00 -2.10 0.00 0.00 29.16 28.01 1oco h TRP 275 CO 0.16 0.33 -0.22 0.00 -2.79 0.00 0.00 178.44 175.92 1oco h ALA 276 N 1.28 -0.34 -0.67 2.65 0.00 -0.65 -0.25 119.26 121.28 1oco h ALA 276 Ca 0.24 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1oco h ALA 276 Cb 0.08 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1oco h ALA 276 CO -0.13 -0.74 0.39 0.52 0.00 0.00 0.00 179.25 179.29 1oco h MET 277 N -0.39 0.92 -0.79 0.00 2.86 -1.36 -1.24 114.93 114.92 1oco h MET 277 Ca 0.04 -0.09 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1oco h MET 277 Cb 0.43 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 31.87 1oco h MET 277 CO -0.15 0.67 0.49 0.52 1.06 0.00 0.00 176.91 179.50 1oco h MET 278 N 0.91 1.07 0.43 1.72 2.07 -0.92 -0.43 114.93 119.78 1oco h MET 278 Ca 0.24 -0.09 -0.02 0.00 -2.07 0.00 0.00 59.70 57.76 1oco h MET 278 Cb -0.00 -0.23 0.00 0.00 -1.87 0.00 0.00 31.60 29.50 1oco h MET 278 CO -0.04 0.74 -0.21 0.77 1.07 0.00 0.00 176.91 179.24 1oco h SER 279 N 1.09 -0.49 -1.01 1.22 0.02 -0.68 -1.80 113.55 111.90 1oco h SER 279 Ca 0.29 -0.10 0.23 0.00 -0.84 0.00 0.00 61.79 61.37 1oco h SER 279 Cb -0.06 0.13 -0.10 0.00 0.14 0.00 0.00 62.40 62.50 1oco h SER 279 CO -0.06 -0.16 0.63 0.40 -1.14 0.00 0.00 176.83 176.51 1oco h ILE 280 N -0.86 0.59 -0.35 3.27 2.04 -0.97 -0.15 117.51 121.09 1oco h ILE 280 Ca -0.06 -0.18 -0.09 0.00 1.00 0.00 0.00 64.86 65.53 1oco h ILE 280 Cb 0.56 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1oco h ILE 280 CO 0.10 0.10 -0.13 1.23 0.00 0.00 0.00 178.15 179.45 1oco h GLY 281 N 0.54 0.77 0.56 5.37 0.00 -0.84 -2.41 103.07 107.05 1oco h GLY 281 Ca 0.59 -0.66 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 1oco h GLY 281 CO -0.34 0.61 -0.02 -2.75 0.00 0.00 0.00 176.54 174.03 1oco h PHE 282 N 0.49 0.06 -0.35 5.60 3.57 -0.21 -3.21 116.94 122.89 1oco h PHE 282 Ca 0.08 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 1oco h PHE 282 Cb 0.65 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.36 1oco h PHE 282 CO 0.06 0.51 0.09 -0.07 -2.23 0.00 0.00 178.31 176.67 1oco h LEU 283 N -0.40 0.46 0.00 0.59 3.38 -1.21 -2.52 115.31 115.60 1oco h LEU 283 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1oco h LEU 283 Cb 0.50 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1oco h LEU 283 CO 0.00 0.46 0.00 0.61 0.09 0.00 0.00 178.44 179.60 1oco n GLY 284 N -1.11 -0.09 0.45 0.83 0.00 -0.91 -0.93 105.19 103.43 1oco n GLY 284 Ca 0.02 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.09 1oco n GLY 284 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1oco n PHE 285 N -0.92 0.00 -2.08 1.61 3.72 -0.95 -3.66 117.46 115.18 1oco n PHE 285 Ca 0.02 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.45 1oco n PHE 285 Cb 0.01 0.00 0.11 0.00 -0.94 0.00 0.00 39.48 38.66 1oco n PHE 285 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 1oco n ILE 286 N 0.49 1.20 -0.36 4.37 -5.35 -0.10 -4.81 119.36 114.80 1oco n ILE 286 Ca 0.07 -2.29 0.00 0.00 -0.27 0.00 0.00 62.75 60.26 1oco n ILE 286 Cb 0.30 0.34 0.00 0.00 -1.74 0.00 0.00 39.64 38.54 1oco n ILE 286 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 1oco n VAL 287 N -0.36 0.00 -0.29 7.28 0.24 -1.25 -4.83 118.33 119.12 1oco n VAL 287 Ca 0.14 -0.16 0.29 0.00 -2.04 0.00 0.00 64.34 62.57 1oco n VAL 287 Cb 0.91 1.36 0.54 0.00 -1.47 0.00 0.00 33.84 35.18 1oco n VAL 287 CO 0.00 0.00 0.00 -2.67 -2.14 0.00 0.00 176.83 172.02 1oco n TRP 288 N -0.15 1.06 0.31 6.34 2.14 -1.26 -2.28 117.44 123.60 1oco n TRP 288 Ca 0.00 1.07 0.03 0.00 2.07 0.00 0.00 57.50 60.68 1oco n TRP 288 Cb 0.09 -1.48 0.17 0.00 -0.81 0.00 0.00 31.31 29.27 1oco n TRP 288 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1oco n ALA 289 N -2.33 1.47 0.42 -1.67 0.00 -1.26 -2.16 120.51 114.98 1oco n ALA 289 Ca 0.35 -0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.81 1oco n ALA 289 Cb 1.17 -1.11 0.26 0.00 0.00 0.00 0.00 19.45 19.77 1oco n ALA 289 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1oco n HIS 290 N -1.31 0.00 1.07 0.00 1.44 -0.96 -0.53 115.22 114.92 1oco n HIS 290 Ca 0.03 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.80 1oco n HIS 290 Cb 0.06 -0.50 0.18 0.00 0.12 0.00 0.00 29.99 29.84 1oco n HIS 290 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1oco n HIS 291 N -1.50 0.38 -2.79 -1.40 8.25 -0.92 -4.01 115.22 113.23 1oco n HIS 291 Ca 0.03 -0.19 -0.01 0.00 -0.26 0.00 0.00 57.72 57.30 1oco n HIS 291 Cb 0.14 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.32 1oco n HIS 291 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1oco n MET 292 N 0.36 1.60 0.10 -0.41 2.00 0.31 -4.94 117.12 116.15 1oco n MET 292 Ca 0.11 -2.85 0.12 0.00 0.00 0.00 0.00 57.70 55.08 1oco n MET 292 Cb 0.26 -1.02 0.45 0.00 0.00 0.00 0.00 33.22 32.91 1oco n MET 292 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 1oco n PHE 293 N -0.84 0.76 -1.52 2.03 3.72 -1.25 -3.42 117.46 116.94 1oco n PHE 293 Ca 0.00 0.25 0.00 0.00 -0.05 0.00 0.00 57.45 57.66 1oco n PHE 293 Cb 0.83 -0.91 0.20 0.00 -0.94 0.00 0.00 39.48 38.66 1oco n PHE 293 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1oco n THR 294 N -2.15 2.40 0.49 4.37 -2.24 -1.26 -4.70 114.28 111.19 1oco n THR 294 Ca 0.04 -2.97 0.09 0.00 -2.27 0.00 0.00 64.05 58.94 1oco n THR 294 Cb 0.33 -0.28 -0.12 0.00 -2.10 0.00 0.00 70.33 68.15 1oco n THR 294 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1oco n VAL 295 N -1.12 0.00 0.00 2.28 3.14 -1.22 -5.00 118.33 116.40 1oco n VAL 295 Ca 0.27 -0.22 0.00 0.00 -2.96 0.00 0.00 64.34 61.43 1oco n VAL 295 Cb 0.88 0.62 0.00 0.00 -1.06 0.00 0.00 33.84 34.29 1oco n VAL 295 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1oco n GLY 296 N 1.44 1.60 3.83 7.55 0.00 -1.26 -5.13 105.19 113.21 1oco n GLY 296 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1oco n GLY 296 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1oco s MET 297 N -0.10 2.95 0.30 1.61 1.00 -1.26 -4.97 119.30 118.82 1oco s MET 297 Ca 0.00 0.82 -0.29 0.00 0.00 0.00 0.00 55.69 56.22 1oco s MET 297 Cb 0.00 -2.00 -0.10 0.00 0.00 0.00 0.00 34.83 32.73 1oco s MET 297 CO 0.00 -1.06 1.41 -0.51 0.00 0.00 0.00 175.02 174.87 1oco s ASP 298 N -3.94 6.63 0.21 3.03 1.01 -1.26 -4.83 116.67 117.52 1oco s ASP 298 Ca 0.58 2.75 -0.10 0.00 0.71 0.00 0.00 52.55 56.49 1oco s ASP 298 Cb -0.13 -2.64 0.30 0.00 1.01 0.00 0.00 42.92 41.46 1oco s ASP 298 CO 0.54 -0.69 1.70 1.62 0.21 0.00 0.00 175.17 178.56 1oco h VAL 299 N 3.28 0.62 -0.94 -1.27 3.04 -1.98 -0.57 116.25 118.44 1oco h VAL 299 Ca -0.48 -0.08 0.13 0.00 -1.01 0.00 0.00 66.70 65.26 1oco h VAL 299 Cb 1.22 0.36 -0.09 0.00 -2.01 0.00 0.00 31.29 30.78 1oco h VAL 299 CO 0.72 0.04 0.56 0.44 -1.01 0.00 0.00 177.57 178.32 1oco h ASP 300 N 0.24 0.79 0.53 3.17 3.32 -1.99 0.63 116.42 123.10 1oco h ASP 300 Ca 0.32 0.06 -0.18 0.00 0.02 0.00 0.00 57.03 57.25 1oco h ASP 300 Cb 0.48 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1oco h ASP 300 CO -0.42 0.39 -0.80 0.00 -1.72 0.00 0.00 179.24 176.69 1oco h THR 301 N 0.86 1.47 0.00 0.35 1.03 -1.77 -1.73 112.91 113.11 1oco h THR 301 Ca 0.48 -2.45 -0.04 0.00 -0.01 0.00 0.00 66.41 64.39 1oco h THR 301 Cb 0.54 2.34 -0.01 0.00 -1.07 0.00 0.00 68.15 69.96 1oco h THR 301 CO -0.29 0.72 -0.19 0.03 -0.01 0.00 0.00 175.52 175.77 1oco h ARG 302 N 0.12 0.00 -0.07 0.00 3.08 0.14 -1.56 114.38 116.10 1oco h ARG 302 Ca -0.03 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.83 1oco h ARG 302 Cb 1.40 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.46 1oco h ARG 302 CO 0.12 0.19 -0.69 0.00 -1.07 0.00 0.00 179.97 178.52 1oco h ALA 303 N 1.81 0.18 -0.27 0.04 0.00 0.37 -3.15 119.26 118.24 1oco h ALA 303 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1oco h ALA 303 Cb 0.48 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1oco h ALA 303 CO 0.02 0.50 0.18 -0.92 0.00 0.00 0.00 179.25 179.03 1oco h TYR 304 N 0.21 0.34 0.00 0.00 3.20 -0.76 -2.58 116.97 117.39 1oco h TYR 304 Ca -0.07 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.80 1oco h TYR 304 Cb 1.35 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.50 1oco h TYR 304 CO 0.11 0.22 -0.05 0.74 -1.64 0.00 0.00 178.16 177.54 1oco h PHE 305 N 0.36 0.00 0.09 -3.82 0.04 -1.33 -0.48 116.94 111.79 1oco h PHE 305 Ca 0.10 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.57 1oco h PHE 305 Cb -0.03 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 1oco h PHE 305 CO -0.06 0.05 -1.57 1.79 -0.60 0.00 0.00 178.31 177.93 1oco h THR 306 N 0.00 1.09 -0.04 -1.55 1.35 -1.47 -2.72 112.91 109.56 1oco h THR 306 Ca -0.00 -2.78 -0.00 0.00 -0.55 0.00 0.00 66.41 63.07 1oco h THR 306 Cb 0.21 2.67 -0.00 0.00 -1.73 0.00 0.00 68.15 69.30 1oco h THR 306 CO 0.01 0.78 0.01 0.28 -0.25 0.00 0.00 175.52 176.34 1oco h SER 307 N 0.05 0.06 -0.93 5.36 0.02 -0.94 -2.61 113.55 114.56 1oco h SER 307 Ca -0.25 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 60.46 1oco h SER 307 Cb 2.00 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 64.47 1oco h SER 307 CO 0.14 0.28 0.55 0.00 -1.14 0.00 0.00 176.83 176.66 1oco h ALA 308 N 0.78 1.19 0.00 3.77 0.00 -1.23 -1.52 119.26 122.25 1oco h ALA 308 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1oco h ALA 308 Cb 0.24 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1oco h ALA 308 CO 0.00 0.65 0.00 1.15 0.00 0.00 0.00 179.25 181.05 1oco h THR 309 N 1.29 0.00 0.00 0.00 2.02 -1.40 -2.86 112.91 111.95 1oco h THR 309 Ca 0.33 -0.27 -0.26 0.00 0.77 0.00 0.00 66.41 66.99 1oco h THR 309 Cb -0.04 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 67.47 1oco h THR 309 CO -0.06 0.00 -1.43 0.24 0.37 0.00 0.00 175.52 174.64 1oco h MET 310 N 0.00 0.00 0.00 6.66 2.86 -0.88 -3.31 114.93 120.26 1oco h MET 310 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1oco h MET 310 Cb 0.30 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1oco h MET 310 CO 0.00 0.66 0.00 -0.84 1.06 0.00 0.00 176.91 177.79 1oco h ILE 311 N 0.00 0.00 0.00 -1.22 3.07 -1.37 -0.42 117.51 117.56 1oco h ILE 311 Ca -0.18 -0.25 -0.01 0.00 1.55 0.00 0.00 64.86 65.96 1oco h ILE 311 Cb 1.90 1.19 -0.00 0.00 -0.27 0.00 0.00 36.82 39.64 1oco h ILE 311 CO 0.10 0.00 -0.07 0.40 -1.05 0.00 0.00 178.15 177.53 1oco h ILE 312 N 0.00 0.84 -0.08 0.16 2.04 -1.68 -1.90 117.51 116.89 1oco h ILE 312 Ca 0.00 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 1oco h ILE 312 Cb 0.26 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1oco h ILE 312 CO 0.00 0.07 -0.12 0.00 0.00 0.00 0.00 178.15 178.10 1oco h ALA 313 N 1.93 1.65 0.45 1.87 0.00 -1.29 -2.76 119.26 121.10 1oco h ALA 313 Ca -0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1oco h ALA 313 Cb 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1oco h ALA 313 CO 0.01 0.26 -0.25 0.82 0.00 0.00 0.00 179.25 180.09 1oco h ILE 314 N 0.12 0.00 -0.64 0.00 2.04 -1.52 0.42 117.51 117.94 1oco h ILE 314 Ca 0.03 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.95 1oco h ILE 314 Cb 0.30 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.32 1oco h ILE 314 CO 0.02 0.00 0.33 1.55 0.00 0.00 0.00 178.15 180.05 1oco h PRO 315 N -0.65 0.59 -0.96 2.37 0.13 -1.71 -0.60 132.00 131.17 1oco h PRO 315 Ca -0.06 -0.04 0.09 0.00 -0.87 0.00 0.00 66.00 65.12 1oco h PRO 315 Cb 0.51 -0.13 -0.07 0.00 0.13 0.00 0.00 31.00 31.43 1oco h PRO 315 CO 0.08 0.39 0.60 1.15 -0.23 0.00 0.00 178.00 179.99 1oco h THR 316 N 0.60 1.00 -0.92 1.56 2.02 -1.44 -1.05 112.91 114.69 1oco h THR 316 Ca 0.29 -0.35 0.02 0.00 0.77 0.00 0.00 66.41 67.14 1oco h THR 316 Cb 0.23 -0.12 -0.05 0.00 -1.74 0.00 0.00 68.15 66.47 1oco h THR 316 CO -0.21 0.19 0.60 1.23 0.37 0.00 0.00 175.52 177.71 1oco h GLY 317 N 1.03 1.30 2.00 2.16 0.00 0.14 -2.29 103.07 107.42 1oco h GLY 317 Ca 0.44 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 1oco h GLY 317 CO -0.22 0.45 -0.05 -0.39 0.00 0.00 0.00 176.54 176.33 1oco h VAL 318 N 1.21 0.30 0.07 4.60 -1.51 -0.38 -1.86 116.25 118.68 1oco h VAL 318 Ca 0.34 -0.32 -0.11 0.00 -1.23 0.00 0.00 66.70 65.39 1oco h VAL 318 Cb -0.10 1.24 0.01 0.00 -2.13 0.00 0.00 31.29 30.31 1oco h VAL 318 CO -0.09 0.05 -0.46 0.11 -1.23 0.00 0.00 177.57 175.95 1oco h LYS 319 N 0.00 0.20 -0.56 5.19 1.57 -1.33 -1.46 116.57 120.18 1oco h LYS 319 Ca -0.00 -0.30 0.05 0.00 -1.87 0.00 0.00 60.65 58.53 1oco h LYS 319 Cb 0.23 0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.60 1oco h LYS 319 CO 0.01 1.11 0.29 0.28 -0.57 0.00 0.00 179.45 180.56 1oco h VAL 320 N -0.56 0.95 0.00 0.50 2.07 -1.07 -1.08 116.25 117.06 1oco h VAL 320 Ca -0.08 -0.19 -0.10 0.00 0.82 0.00 0.00 66.70 67.15 1oco h VAL 320 Cb 1.32 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1oco h VAL 320 CO 0.09 0.10 -0.49 -0.26 0.02 0.00 0.00 177.57 177.03 1oco h PHE 321 N 0.55 0.00 -0.38 1.57 0.04 -1.45 -2.85 116.94 114.43 1oco h PHE 321 Ca 0.25 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.87 1oco h PHE 321 Cb 0.16 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.31 1oco h PHE 321 CO -0.10 0.49 -0.34 0.77 -0.60 0.00 0.00 178.31 178.54 1oco h SER 322 N 0.00 0.96 -0.69 2.17 0.02 -0.30 -1.27 113.55 114.44 1oco h SER 322 Ca -0.00 -0.45 -0.02 0.00 -0.84 0.00 0.00 61.79 60.47 1oco h SER 322 Cb 1.05 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 63.29 1oco h SER 322 CO 0.06 1.21 0.36 -0.50 -1.14 0.00 0.00 176.83 176.82 1oco h TRP 323 N 0.72 0.99 -0.35 3.45 6.55 -1.19 0.13 115.95 126.25 1oco h TRP 323 Ca 0.07 -0.03 -0.06 0.00 0.95 0.00 0.00 58.89 59.81 1oco h TRP 323 Cb 0.93 -0.31 -0.01 0.00 -0.86 0.00 0.00 29.16 28.90 1oco h TRP 323 CO 0.06 0.71 -0.02 -0.07 -1.05 0.00 0.00 178.44 178.08 1oco h LEU 324 N 1.00 0.63 -1.64 -4.49 4.07 -1.33 -2.47 115.31 111.09 1oco h LEU 324 Ca 0.25 -0.32 -0.01 0.00 0.08 0.00 0.00 57.88 57.88 1oco h LEU 324 Cb 0.08 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.63 1oco h LEU 324 CO -0.03 0.80 0.16 0.00 -1.08 0.00 0.00 178.44 178.29 1oco h ALA 325 N 0.85 1.73 -0.24 1.53 0.00 -0.56 -2.10 119.26 120.47 1oco h ALA 325 Ca 0.10 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1oco h ALA 325 Cb 0.49 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1oco h ALA 325 CO 0.02 0.23 -0.17 1.15 0.00 0.00 0.00 179.25 180.48 1oco h THR 326 N 0.41 1.23 0.00 0.00 2.02 -0.31 -2.37 112.91 113.89 1oco h THR 326 Ca 0.11 -1.07 -0.13 0.00 0.77 0.00 0.00 66.41 66.09 1oco h THR 326 Cb 0.01 1.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 1oco h THR 326 CO -0.02 0.34 -0.61 -0.07 0.37 0.00 0.00 175.52 175.53 1oco h LEU 327 N 0.39 0.00 -8.79 2.58 3.38 -1.13 -3.42 115.31 108.32 1oco h LEU 327 Ca 0.07 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.35 1oco h LEU 327 Cb 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 1oco h LEU 327 CO 0.03 0.61 1.21 1.57 0.09 0.00 0.00 178.44 181.96 1oco n HIS 328 N -3.59 1.81 -1.24 1.13 -0.00 -0.89 -0.81 115.22 111.62 1oco n HIS 328 Ca -0.00 0.35 -0.08 0.00 0.46 0.00 0.00 57.72 58.45 1oco n HIS 328 Cb 0.66 -2.51 -0.04 0.00 -0.12 0.00 0.00 29.99 27.98 1oco n HIS 328 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1oco n GLY 329 N 5.59 1.01 3.92 1.57 0.00 -1.26 -5.00 105.19 111.01 1oco n GLY 329 Ca 0.35 -0.48 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 1oco n GLY 329 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1oco s GLY 330 N -2.75 1.62 -0.97 -0.02 0.00 0.01 -4.99 107.32 100.22 1oco s GLY 330 Ca 0.00 -0.72 -0.13 0.00 0.00 0.00 0.00 44.72 43.86 1oco s GLY 330 CO 0.00 -0.43 1.00 0.21 0.00 0.00 0.00 173.10 173.88 1oco s ASN 331 N -4.32 6.93 0.00 1.64 2.47 0.13 -4.98 114.94 116.81 1oco s ASN 331 Ca 0.54 -2.86 -0.30 0.00 0.42 0.00 0.00 52.86 50.67 1oco s ASN 331 Cb -0.11 -2.27 -0.07 0.00 -1.45 0.00 0.00 41.25 37.35 1oco s ASN 331 CO 0.45 -0.60 1.81 -0.63 -3.72 0.00 0.00 177.10 174.41 1oco s ILE 332 N 0.38 3.25 -0.45 -5.21 1.09 -1.26 -3.87 121.20 115.15 1oco s ILE 332 Ca 0.27 0.35 -0.13 0.00 -1.10 0.00 0.00 60.65 60.03 1oco s ILE 332 Cb -0.08 -3.22 0.07 0.00 -1.06 0.00 0.00 42.46 38.16 1oco s ILE 332 CO -0.08 -0.03 0.33 -0.75 -0.10 0.00 0.00 174.94 174.32 1oco s LYS 333 N 4.12 2.85 -0.60 2.79 2.36 -0.46 -4.97 119.74 125.83 1oco s LYS 333 Ca 0.81 -1.35 -0.04 0.00 -2.55 0.00 0.00 55.97 52.84 1oco s LYS 333 Cb -0.39 -3.99 -0.05 0.00 -1.05 0.00 0.00 37.83 32.36 1oco s LYS 333 CO 0.36 -0.97 1.87 0.91 1.55 0.00 0.00 175.35 179.07 1oco n TRP 334 N 5.10 0.89 -2.82 4.03 7.02 -1.26 -4.76 117.44 125.64 1oco n TRP 334 Ca -0.12 -1.48 -0.30 0.00 -1.02 0.00 0.00 57.50 54.58 1oco n TRP 334 Cb 0.44 -1.35 -0.03 0.00 -2.42 0.00 0.00 31.31 27.95 1oco n TRP 334 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 1oco s SER 335 N 3.56 6.48 0.20 -0.99 1.04 -1.26 -4.93 113.70 117.79 1oco s SER 335 Ca 0.31 1.10 -0.18 0.00 0.48 0.00 0.00 55.95 57.65 1oco s SER 335 Cb 0.09 -2.31 0.18 0.00 0.10 0.00 0.00 66.02 64.08 1oco s SER 335 CO -0.02 -0.43 1.42 -2.65 0.98 0.00 0.00 173.24 172.54 1oco n PRO 336 N -1.46 -0.24 0.24 4.02 -0.02 -1.26 0.16 135.00 136.44 1oco n PRO 336 Ca 0.02 1.41 0.07 0.00 -2.02 0.00 0.00 63.50 62.98 1oco n PRO 336 Cb 0.54 -2.09 0.61 0.00 -0.02 0.00 0.00 33.50 32.55 1oco n PRO 336 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oco h ALA 337 N 1.15 1.95 0.00 3.55 0.00 -1.91 0.11 119.26 124.11 1oco h ALA 337 Ca 0.29 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 1oco h ALA 337 Cb 0.52 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1oco h ALA 337 CO -0.90 0.04 -0.40 1.98 0.00 0.00 0.00 179.25 179.97 1oco h MET 338 N 0.04 0.00 -0.16 0.00 -1.53 -0.58 -0.07 114.93 112.63 1oco h MET 338 Ca 0.01 0.00 -0.11 0.00 -3.44 0.00 0.00 59.70 56.16 1oco h MET 338 Cb 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.08 1oco h MET 338 CO -0.00 0.40 -0.33 0.52 0.14 0.00 0.00 176.91 177.64 1oco h MET 339 N 0.00 0.51 -0.90 0.39 2.86 -0.59 -0.03 114.93 117.17 1oco h MET 339 Ca -0.00 -0.33 0.01 0.00 -2.06 0.00 0.00 59.70 57.31 1oco h MET 339 Cb 0.72 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.38 1oco h MET 339 CO 0.05 0.94 0.60 -1.49 1.06 0.00 0.00 176.91 178.07 1oco h TRP 340 N 0.15 1.14 -0.46 -0.22 4.06 -0.92 -0.88 115.95 118.81 1oco h TRP 340 Ca 0.00 0.03 -0.06 0.00 2.06 0.00 0.00 58.89 60.92 1oco h TRP 340 Cb 0.93 -0.39 -0.02 0.00 -1.00 0.00 0.00 29.16 28.68 1oco h TRP 340 CO 0.10 0.72 0.05 0.00 -3.56 0.00 0.00 178.44 175.75 1oco h ALA 341 N 1.43 0.61 -0.37 1.49 0.00 -0.80 -0.59 119.26 121.04 1oco h ALA 341 Ca 0.33 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1oco h ALA 341 Cb -0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1oco h ALA 341 CO -0.07 0.36 -0.23 -0.07 0.00 0.00 0.00 179.25 179.24 1oco h LEU 342 N 0.64 0.74 0.60 0.00 3.38 -0.60 -1.34 115.31 118.73 1oco h LEU 342 Ca 0.14 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1oco h LEU 342 Cb 0.42 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.98 1oco h LEU 342 CO 0.01 0.95 -0.29 1.23 0.09 0.00 0.00 178.44 180.44 1oco h GLY 343 N 0.97 -0.84 -0.26 0.83 0.00 -0.93 -2.82 103.07 100.02 1oco h GLY 343 Ca 0.09 0.31 0.09 0.00 0.00 0.00 0.00 47.33 47.82 1oco h GLY 343 CO 0.06 -0.31 -0.32 -2.75 0.00 0.00 0.00 176.54 173.22 1oco h PHE 344 N -0.91 -0.87 -1.00 5.60 3.04 -1.04 0.33 116.94 122.09 1oco h PHE 344 Ca -0.08 0.06 0.23 0.00 3.98 0.00 0.00 57.97 62.16 1oco h PHE 344 Cb 0.65 0.45 -0.09 0.00 2.56 0.00 0.00 35.95 39.52 1oco h PHE 344 CO -0.01 -0.37 0.63 0.82 -2.02 0.00 0.00 178.31 177.35 1oco h ILE 345 N -0.20 0.62 0.04 1.41 2.04 -1.09 0.19 117.51 120.51 1oco h ILE 345 Ca 0.20 -0.18 -0.24 0.00 1.00 0.00 0.00 64.86 65.63 1oco h ILE 345 Cb 0.54 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 1oco h ILE 345 CO -0.59 0.10 -1.31 0.15 0.00 0.00 0.00 178.15 176.50 1oco h PHE 346 N 0.53 0.16 -0.46 1.37 3.57 -0.94 -3.26 116.94 117.92 1oco h PHE 346 Ca 0.57 -0.12 -0.02 0.00 3.53 0.00 0.00 57.97 61.93 1oco h PHE 346 Cb 1.21 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.92 1oco h PHE 346 CO -0.00 1.51 0.19 -0.07 -2.23 0.00 0.00 178.31 177.71 1oco h LEU 347 N -0.70 0.62 -1.17 0.59 4.07 -0.78 -1.36 115.31 116.59 1oco h LEU 347 Ca -0.33 -0.16 -0.02 0.00 0.08 0.00 0.00 57.88 57.46 1oco h LEU 347 Cb 1.48 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 43.03 1oco h LEU 347 CO -0.10 0.61 0.34 0.15 -1.08 0.00 0.00 178.44 178.37 1oco h PHE 348 N 0.60 0.90 0.29 1.13 3.04 -0.78 -1.76 116.94 120.36 1oco h PHE 348 Ca 0.15 -0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.07 1oco h PHE 348 Cb 0.18 -0.29 0.00 0.00 2.56 0.00 0.00 35.95 38.40 1oco h PHE 348 CO -0.00 0.64 -0.15 1.15 -2.02 0.00 0.00 178.31 177.93 1oco h THR 349 N 0.92 0.69 -0.25 4.41 2.02 -1.47 -0.44 112.91 118.78 1oco h THR 349 Ca 0.23 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.47 1oco h THR 349 Cb 0.05 0.69 -0.06 0.00 -1.74 0.00 0.00 68.15 67.09 1oco h THR 349 CO -0.03 0.00 -0.13 0.58 0.37 0.00 0.00 175.52 176.31 1oco h VAL 350 N -0.41 0.60 0.00 3.16 2.07 -1.03 -1.06 116.25 119.59 1oco h VAL 350 Ca -0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1oco h VAL 350 Cb 0.32 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1oco h VAL 350 CO 0.05 0.00 -0.09 1.23 0.02 0.00 0.00 177.57 178.78 1oco h GLY 351 N -0.10 0.00 1.36 2.17 0.00 -1.11 -0.61 103.07 104.78 1oco h GLY 351 Ca 0.13 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.29 1oco h GLY 351 CO -0.31 0.00 -1.19 -1.33 0.00 0.00 0.00 176.54 173.71 1oco h GLY 352 N 0.61 0.00 1.32 4.60 0.00 -0.47 -3.06 103.07 106.07 1oco h GLY 352 Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.13 1oco h GLY 352 CO 0.01 0.00 -0.67 -2.00 0.00 0.00 0.00 176.54 173.88 1oco h LEU 353 N 0.00 0.79 -1.38 3.11 5.85 -0.55 -2.44 115.31 120.69 1oco h LEU 353 Ca -0.12 -0.48 -0.06 0.00 0.84 0.00 0.00 57.88 58.06 1oco h LEU 353 Cb 1.63 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.42 1oco h LEU 353 CO 0.07 1.25 -0.27 0.00 -0.34 0.00 0.00 178.44 179.14 1oco h THR 354 N 0.49 0.86 -0.00 1.05 1.03 -1.21 -1.57 112.91 113.56 1oco h THR 354 Ca -0.02 -1.07 0.00 0.00 -0.01 0.00 0.00 66.41 65.31 1oco h THR 354 Cb 1.27 1.64 0.00 0.00 -1.07 0.00 0.00 68.15 69.99 1oco h THR 354 CO 0.13 0.27 -0.06 0.61 -0.01 0.00 0.00 175.52 176.46 1oco n GLY 355 N -0.30 -1.30 0.10 2.99 0.00 -0.94 -2.89 105.19 102.84 1oco n GLY 355 Ca -0.01 -0.16 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 1oco n GLY 355 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1oco h ILE 356 N 0.09 1.27 -0.16 -0.61 1.08 -1.01 -2.93 117.51 115.24 1oco h ILE 356 Ca 0.00 -2.92 0.03 0.00 -0.39 0.00 0.00 64.86 61.58 1oco h ILE 356 Cb 0.39 2.79 -0.03 0.00 -3.07 0.00 0.00 36.82 36.90 1oco h ILE 356 CO 0.00 0.83 -0.02 0.58 -0.69 0.00 0.00 178.15 178.85 1oco h VAL 357 N 0.06 0.86 0.00 1.67 2.07 -1.42 -2.01 116.25 117.48 1oco h VAL 357 Ca -0.20 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1oco h VAL 357 Cb 1.98 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 32.57 1oco h VAL 357 CO 0.16 0.01 -0.15 -0.07 0.02 0.00 0.00 177.57 177.54 1oco h LEU 358 N 0.03 0.00 -2.14 2.57 3.38 -1.63 -2.16 115.31 115.36 1oco h LEU 358 Ca 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1oco h LEU 358 Cb 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1oco h LEU 358 CO -0.15 0.15 -0.03 0.00 0.09 0.00 0.00 178.44 178.50 1oco h ALA 359 N 1.85 1.72 -1.53 1.53 0.00 -1.16 -3.38 119.26 118.28 1oco h ALA 359 Ca -0.00 -0.03 -0.50 0.00 0.00 0.00 0.00 54.91 54.38 1oco h ALA 359 Cb 0.54 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1oco h ALA 359 CO 0.02 0.04 1.36 -0.80 0.00 0.00 0.00 179.25 179.87 1oco s ASN 360 N -6.63 5.29 0.29 0.00 0.01 -0.81 -4.41 114.94 108.68 1oco s ASN 360 Ca -0.05 0.47 0.03 0.00 -0.71 0.00 0.00 52.86 52.60 1oco s ASN 360 Cb 0.16 -2.53 0.62 0.00 0.41 0.00 0.00 41.25 39.91 1oco s ASN 360 CO 0.62 -2.34 1.82 0.77 -1.51 0.00 0.00 177.10 176.46 1oco h SER 361 N 14.98 0.88 0.40 -1.22 4.64 -1.87 0.84 113.55 132.20 1oco h SER 361 Ca -0.27 0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.11 1oco h SER 361 Cb 1.17 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 1oco h SER 361 CO 1.20 0.42 -0.27 0.77 -0.87 0.00 0.00 176.83 178.08 1oco h SER 362 N 0.91 -0.68 0.51 4.97 4.64 -1.94 -1.95 113.55 120.02 1oco h SER 362 Ca 0.52 0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 61.79 1oco h SER 362 Cb 0.63 0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 1oco h SER 362 CO -0.30 -0.42 -0.44 0.25 -0.87 0.00 0.00 176.83 175.06 1oco h LEU 363 N -0.65 0.00 -2.31 5.97 5.85 -1.80 -2.57 115.31 119.80 1oco h LEU 363 Ca -0.04 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1oco h LEU 363 Cb 0.54 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 1oco h LEU 363 CO 0.03 0.44 -0.04 -0.78 -0.34 0.00 0.00 178.44 177.74 1oco h ASP 364 N 0.00 0.00 -0.79 1.25 3.58 0.14 -2.25 116.42 118.35 1oco h ASP 364 Ca -0.00 0.00 0.15 0.00 0.42 0.00 0.00 57.03 57.59 1oco h ASP 364 Cb 0.81 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 41.76 1oco h ASP 364 CO 0.06 0.04 0.34 0.40 -2.88 0.00 0.00 179.24 177.20 1oco h ILE 365 N 0.00 0.66 0.00 2.25 1.08 -0.95 0.30 117.51 120.85 1oco h ILE 365 Ca -0.00 -0.16 0.00 0.00 -0.39 0.00 0.00 64.86 64.31 1oco h ILE 365 Cb 0.17 0.14 0.00 0.00 -3.07 0.00 0.00 36.82 34.05 1oco h ILE 365 CO 0.01 0.09 -0.98 1.33 -0.69 0.00 0.00 178.15 177.90 1oco n VAL 366 N -4.98 0.02 -0.05 1.67 0.24 -0.88 -4.35 118.33 110.00 1oco n VAL 366 Ca 0.15 -0.06 0.01 0.00 -2.04 0.00 0.00 64.34 62.41 1oco n VAL 366 Cb 0.44 0.73 -0.16 0.00 -1.47 0.00 0.00 33.84 33.39 1oco n VAL 366 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1oco n LEU 367 N -1.59 0.08 -4.63 1.34 4.77 -0.92 -4.92 117.00 111.12 1oco n LEU 367 Ca 0.04 0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.63 1oco n LEU 367 Cb 0.36 0.23 0.01 0.00 -2.33 0.00 0.00 43.42 41.68 1oco n LEU 367 CO 0.42 0.24 0.67 1.57 -1.33 0.00 0.00 177.39 178.95 1oco n HIS 368 N -2.54 1.47 -3.01 -1.77 -0.00 0.10 -2.38 115.22 107.09 1oco n HIS 368 Ca -0.18 0.56 -0.21 0.00 0.46 0.00 0.00 57.72 58.36 1oco n HIS 368 Cb 0.86 -2.28 0.01 0.00 -0.12 0.00 0.00 29.99 28.46 1oco n HIS 368 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 1oco n ASP 369 N 0.56 -4.99 -4.33 0.26 8.00 -1.26 -4.98 116.55 109.80 1oco n ASP 369 Ca 0.08 -0.24 -0.30 0.00 0.71 0.00 0.00 54.79 55.05 1oco n ASP 369 Cb 0.38 -4.09 -0.07 0.00 -0.02 0.00 0.00 41.12 37.32 1oco n ASP 369 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1oco n THR 370 N -4.13 0.00 1.30 -3.53 -2.24 -1.00 -2.85 114.28 101.83 1oco n THR 370 Ca -0.09 -2.46 0.12 0.00 -2.27 0.00 0.00 64.05 59.34 1oco n THR 370 Cb 0.60 0.70 0.65 0.00 -2.10 0.00 0.00 70.33 70.18 1oco n THR 370 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1oco n TYR 371 N -1.12 0.00 -0.17 4.78 4.02 -0.86 -2.80 117.16 121.01 1oco n TYR 371 Ca -0.13 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.66 1oco n TYR 371 Cb 0.65 -0.17 0.04 0.00 -0.02 0.00 0.00 39.34 39.83 1oco n TYR 371 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 1oco h TYR 372 N 0.00 1.10 0.00 -0.72 3.20 -1.83 -1.31 116.97 117.42 1oco h TYR 372 Ca 0.00 -0.23 -0.14 0.00 3.14 0.00 0.00 58.73 61.51 1oco h TYR 372 Cb 0.13 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 1oco h TYR 372 CO 0.00 1.03 -0.65 -0.24 -1.64 0.00 0.00 178.16 176.66 1oco h VAL 373 N 0.88 1.37 -0.04 1.81 3.04 -1.75 -0.98 116.25 120.58 1oco h VAL 373 Ca 0.14 -2.29 -0.08 0.00 -1.01 0.00 0.00 66.70 63.46 1oco h VAL 373 Cb 0.67 2.27 -0.01 0.00 -2.01 0.00 0.00 31.29 32.20 1oco h VAL 373 CO 0.05 0.63 -0.34 0.58 -1.01 0.00 0.00 177.57 177.48 1oco h VAL 374 N 0.00 1.26 -0.02 1.51 2.07 -1.56 -0.82 116.25 118.69 1oco h VAL 374 Ca -0.01 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.28 1oco h VAL 374 Cb 1.22 1.61 -0.00 0.00 -1.52 0.00 0.00 31.29 32.60 1oco h VAL 374 CO 0.08 0.36 -0.02 0.00 0.02 0.00 0.00 177.57 178.01 1oco h ALA 375 N 1.60 0.03 -0.29 1.67 0.00 -0.83 -2.69 119.26 118.75 1oco h ALA 375 Ca 0.01 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.72 1oco h ALA 375 Cb 0.63 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.34 1oco h ALA 375 CO 0.05 -0.20 -0.28 1.25 0.00 0.00 0.00 179.25 180.07 1oco h HIS 376 N -0.45 -0.76 0.00 0.00 6.17 -0.56 -1.77 115.15 117.79 1oco h HIS 376 Ca 0.00 0.05 0.00 0.00 0.71 0.00 0.00 60.37 61.13 1oco h HIS 376 Cb 0.53 0.38 0.00 0.00 2.52 0.00 0.00 27.41 30.84 1oco h HIS 376 CO 0.10 -0.35 0.00 1.97 0.71 0.00 0.00 177.93 180.36 1oco n PHE 377 N -5.40 0.83 0.10 5.26 1.16 -0.37 -3.16 117.46 115.89 1oco n PHE 377 Ca -0.00 0.25 0.03 0.00 -1.87 0.00 0.00 57.45 55.86 1oco n PHE 377 Cb 0.31 -0.91 -0.01 0.00 -1.61 0.00 0.00 39.48 37.26 1oco n PHE 377 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1oco h HIS 378 N 0.00 0.00 0.04 2.97 3.86 -1.04 -2.15 115.15 118.83 1oco h HIS 378 Ca 0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1oco h HIS 378 Cb 0.66 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.13 1oco h HIS 378 CO 0.00 0.47 -0.02 1.88 0.86 0.00 0.00 177.93 181.12 1oco h TYR 379 N 0.00 -0.05 -0.14 2.45 -1.99 -1.30 0.25 116.97 116.20 1oco h TYR 379 Ca -0.06 -0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.54 1oco h TYR 379 Cb 1.41 0.02 -0.01 0.00 2.00 0.00 0.00 36.73 40.15 1oco h TYR 379 CO 0.00 0.35 -0.49 -0.39 -0.00 0.00 0.00 178.16 177.63 1oco h VAL 380 N -0.47 1.33 0.06 -2.88 -1.51 -1.65 -0.69 116.25 110.45 1oco h VAL 380 Ca -0.01 -1.72 -0.23 0.00 -1.23 0.00 0.00 66.70 63.52 1oco h VAL 380 Cb 0.43 1.77 -0.01 0.00 -2.13 0.00 0.00 31.29 31.34 1oco h VAL 380 CO 0.01 0.52 -1.19 -0.07 -1.23 0.00 0.00 177.57 175.61 1oco h LEU 381 N 0.29 0.19 0.00 4.19 3.38 -1.43 0.73 115.31 122.66 1oco h LEU 381 Ca 0.01 -0.76 -0.11 0.00 0.09 0.00 0.00 57.88 57.12 1oco h LEU 381 Cb 0.97 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 1oco h LEU 381 CO 0.08 1.50 -0.74 -1.28 0.09 0.00 0.00 178.44 178.10 1oco h SER 382 N -0.63 0.00 0.00 -0.43 0.87 -0.62 -1.67 113.55 111.07 1oco h SER 382 Ca -0.28 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 1oco h SER 382 Cb 1.51 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.47 1oco h SER 382 CO -0.04 0.47 -0.03 0.23 -0.53 0.00 0.00 176.83 176.93 1oco n MET 383 N -3.10 1.68 0.00 2.24 2.81 -0.29 -4.26 117.12 116.20 1oco n MET 383 Ca -0.01 -2.15 0.00 0.00 -1.81 0.00 0.00 57.70 53.73 1oco n MET 383 Cb 0.74 -1.28 0.00 0.00 -0.71 0.00 0.00 33.22 31.97 1oco n MET 383 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1oco n GLY 384 N -1.07 0.02 0.24 3.03 0.00 -0.93 -4.08 105.19 102.40 1oco n GLY 384 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 1oco n GLY 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oco h ALA 385 N 0.00 0.80 -0.44 4.61 0.00 -0.79 -0.70 119.26 122.75 1oco h ALA 385 Ca 0.00 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1oco h ALA 385 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1oco h ALA 385 CO 0.00 -0.14 -0.10 0.28 0.00 0.00 0.00 179.25 179.29 1oco h VAL 386 N 0.47 1.27 -0.43 0.00 2.07 -1.51 -1.32 116.25 116.81 1oco h VAL 386 Ca 0.30 -1.21 -0.06 0.00 0.82 0.00 0.00 66.70 66.55 1oco h VAL 386 Cb 0.32 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1oco h VAL 386 CO -0.27 0.41 0.03 -0.26 0.02 0.00 0.00 177.57 177.50 1oco h PHE 387 N 0.67 0.71 -0.45 1.57 -1.00 -1.64 -0.88 116.94 115.92 1oco h PHE 387 Ca 0.11 -0.08 -0.13 0.00 2.81 0.00 0.00 57.97 60.68 1oco h PHE 387 Cb 0.64 -0.20 -0.01 0.00 3.61 0.00 0.00 35.95 39.99 1oco h PHE 387 CO 0.05 0.65 -0.23 0.00 -1.61 0.00 0.00 178.31 177.17 1oco h ALA 388 N 1.39 0.73 -0.82 2.45 0.00 -0.87 -1.10 119.26 121.04 1oco h ALA 388 Ca 0.14 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1oco h ALA 388 Cb 0.36 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1oco h ALA 388 CO 0.01 0.67 0.36 0.82 0.00 0.00 0.00 179.25 181.11 1oco h ILE 389 N 0.80 1.26 -0.18 0.00 2.04 -0.71 -0.75 117.51 119.97 1oco h ILE 389 Ca 0.10 -0.78 -0.09 0.00 1.00 0.00 0.00 64.86 65.09 1oco h ILE 389 Cb 0.80 0.24 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1oco h ILE 389 CO 0.07 0.33 -0.24 0.24 0.00 0.00 0.00 178.15 178.54 1oco h MET 390 N 1.19 0.48 -0.47 2.37 2.86 -0.99 -0.43 114.93 119.94 1oco h MET 390 Ca 0.28 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 1oco h MET 390 Cb 0.17 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 1oco h MET 390 CO -0.03 0.87 0.21 0.78 1.06 0.00 0.00 176.91 179.79 1oco h GLY 391 N 0.13 0.73 1.09 8.32 0.00 -1.15 0.02 103.07 112.21 1oco h GLY 391 Ca 0.02 -0.38 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 1oco h GLY 391 CO 0.06 0.36 0.09 -1.33 0.00 0.00 0.00 176.54 175.71 1oco h GLY 392 N 0.61 1.20 0.75 4.60 0.00 -1.14 -0.63 103.07 108.46 1oco h GLY 392 Ca 0.16 -0.81 -0.00 0.00 0.00 0.00 0.00 47.33 46.68 1oco h GLY 392 CO -0.02 0.75 0.00 -2.75 0.00 0.00 0.00 176.54 174.52 1oco h PHE 393 N 1.03 0.00 -0.04 5.60 3.57 -0.81 0.59 116.94 126.88 1oco h PHE 393 Ca 0.20 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.63 1oco h PHE 393 Cb 0.47 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 1oco h PHE 393 CO 0.03 0.25 -0.29 -0.39 -2.23 0.00 0.00 178.31 175.69 1oco h VAL 394 N -0.25 1.23 -0.30 1.41 -1.51 -0.90 0.23 116.25 116.16 1oco h VAL 394 Ca 0.00 -1.07 -0.17 0.00 -1.23 0.00 0.00 66.70 64.23 1oco h VAL 394 Cb 0.25 1.52 -0.00 0.00 -2.13 0.00 0.00 31.29 30.93 1oco h VAL 394 CO 0.00 0.31 -0.49 -0.74 -1.23 0.00 0.00 177.57 175.42 1oco h HIS 395 N 0.07 1.08 -0.19 5.19 -0.00 -0.93 -3.29 115.15 117.08 1oco h HIS 395 Ca 0.01 -0.37 0.00 0.00 -0.00 0.00 0.00 60.37 60.01 1oco h HIS 395 Cb 0.55 -0.21 0.00 0.00 -0.00 0.00 0.00 27.41 27.75 1oco h HIS 395 CO 0.00 1.19 0.00 0.91 -0.00 0.00 0.00 177.93 180.04 1oco n TRP 396 N -4.05 0.23 -0.09 5.26 8.01 0.18 -4.60 117.44 122.39 1oco n TRP 396 Ca -0.04 -0.14 -0.06 0.00 -1.31 0.00 0.00 57.50 55.95 1oco n TRP 396 Cb 0.60 -0.00 -0.00 0.00 -2.01 0.00 0.00 31.31 29.90 1oco n TRP 396 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.69 177.03 1oco h PHE 397 N 3.89 -0.27 -0.69 -5.99 3.57 -0.62 -1.91 116.94 114.93 1oco h PHE 397 Ca 0.00 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.69 1oco h PHE 397 Cb 0.86 0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.73 1oco h PHE 397 CO 0.12 -0.18 0.47 -1.35 -2.23 0.00 0.00 178.31 175.13 1oco h PRO 398 N -0.05 0.27 -0.10 6.41 0.11 -1.81 -0.16 132.00 136.67 1oco h PRO 398 Ca 0.16 -0.02 -0.20 0.00 0.11 0.00 0.00 66.00 66.05 1oco h PRO 398 Cb 0.30 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.35 1oco h PRO 398 CO -0.36 0.18 -0.78 1.25 -0.21 0.00 0.00 178.00 178.08 1oco h LEU 399 N 0.28 0.66 -0.07 2.35 5.85 -1.66 0.44 115.31 123.16 1oco h LEU 399 Ca 0.34 -0.45 -0.19 0.00 0.84 0.00 0.00 57.88 58.42 1oco h LEU 399 Cb 0.92 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 41.77 1oco h LEU 399 CO -0.08 1.21 -0.68 -0.26 -0.34 0.00 0.00 178.44 178.29 1oco h PHE 400 N 0.37 0.83 0.03 1.25 0.04 -0.63 -3.36 116.94 115.47 1oco h PHE 400 Ca -0.05 -0.40 -0.38 0.00 2.80 0.00 0.00 57.97 59.94 1oco h PHE 400 Cb 1.38 -0.12 -0.05 0.00 2.20 0.00 0.00 35.95 39.36 1oco h PHE 400 CO 0.06 1.21 -2.32 -1.13 -0.60 0.00 0.00 178.31 175.53 1oco n SER 401 N -4.10 2.01 0.00 2.17 3.41 -0.23 -4.71 113.62 112.18 1oco n SER 401 Ca -0.09 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 1oco n SER 401 Cb 0.70 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1oco n SER 401 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oco n GLY 402 N 2.09 0.20 3.70 5.00 0.00 0.15 -4.24 105.19 112.10 1oco n GLY 402 Ca -0.43 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.35 1oco n GLY 402 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oco s TYR 403 N -2.00 2.88 0.13 1.61 2.02 -1.25 -1.36 117.35 119.38 1oco s TYR 403 Ca 0.00 -0.15 0.06 0.00 -0.37 0.00 0.00 57.07 56.61 1oco s TYR 403 Cb 0.00 -1.34 -0.04 0.00 -0.40 0.00 0.00 41.96 40.18 1oco s TYR 403 CO 0.00 0.55 0.02 0.95 -1.57 0.00 0.00 175.55 175.50 1oco s THR 404 N -2.00 3.96 0.38 -0.71 -4.23 -0.60 -3.62 115.64 108.82 1oco s THR 404 Ca 0.30 -1.17 -0.04 0.00 -1.18 0.00 0.00 61.69 59.60 1oco s THR 404 Cb -0.08 -2.95 -0.04 0.00 1.34 0.00 0.00 72.50 70.77 1oco s THR 404 CO 0.21 -0.00 0.65 -0.76 -0.54 0.00 0.00 174.62 174.17 1oco s LEU 405 N -2.66 3.89 -0.54 4.79 1.43 -1.26 -4.69 118.68 119.64 1oco s LEU 405 Ca 0.27 0.74 -0.28 0.00 -1.03 0.00 0.00 54.13 53.83 1oco s LEU 405 Cb -0.11 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.52 1oco s LEU 405 CO 0.19 -0.37 1.27 0.21 0.23 0.00 0.00 176.35 177.88 1oco s ASN 406 N -3.72 6.39 0.45 2.29 3.84 -1.26 -4.89 114.94 118.03 1oco s ASN 406 Ca 0.44 0.31 0.21 0.00 0.21 0.00 0.00 52.86 54.03 1oco s ASN 406 Cb -0.10 -2.55 1.18 0.00 -0.55 0.00 0.00 41.25 39.23 1oco s ASN 406 CO 0.37 -1.49 1.86 0.44 -2.79 0.00 0.00 177.10 175.49 1oco h ASP 407 N 10.01 0.31 -0.03 -4.21 5.19 -1.98 -0.10 116.42 125.60 1oco h ASP 407 Ca -0.25 0.03 -0.23 0.00 -0.62 0.00 0.00 57.03 55.96 1oco h ASP 407 Cb 1.07 -0.02 0.02 0.00 0.18 0.00 0.00 39.33 40.58 1oco h ASP 407 CO 1.16 0.12 -0.90 0.74 -3.12 0.00 0.00 179.24 177.24 1oco h THR 408 N 0.31 1.31 -0.50 0.35 2.02 -2.00 -2.27 112.91 112.12 1oco h THR 408 Ca 0.46 -2.15 -0.06 0.00 0.77 0.00 0.00 66.41 65.43 1oco h THR 408 Cb 1.30 2.34 -0.02 0.00 -1.74 0.00 0.00 68.15 70.03 1oco h THR 408 CO -0.14 0.66 0.05 -0.50 0.37 0.00 0.00 175.52 175.96 1oco h TRP 409 N 0.32 0.85 -0.42 3.16 -0.00 -1.76 -2.42 115.95 115.67 1oco h TRP 409 Ca -0.10 -0.10 0.03 0.00 -0.00 0.00 0.00 58.89 58.72 1oco h TRP 409 Cb 1.55 -0.24 -0.02 0.00 -0.00 0.00 0.00 29.16 30.45 1oco h TRP 409 CO 0.11 0.75 0.28 0.00 -0.00 0.00 0.00 178.44 179.58 1oco h ALA 410 N 1.29 1.83 0.00 1.49 0.00 -0.89 -1.70 119.26 121.28 1oco h ALA 410 Ca 0.16 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.83 1oco h ALA 410 Cb 0.39 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1oco h ALA 410 CO 0.01 0.12 -1.10 0.87 0.00 0.00 0.00 179.25 179.15 1oco h LYS 411 N 0.45 0.00 -0.24 0.00 1.57 -0.95 -2.79 116.57 114.62 1oco h LYS 411 Ca 0.17 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.91 1oco h LYS 411 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1oco h LYS 411 CO -0.04 0.85 -0.02 0.82 -0.57 0.00 0.00 179.45 180.49 1oco h ILE 412 N 0.00 1.26 -0.60 1.86 2.04 -0.94 -0.07 117.51 121.06 1oco h ILE 412 Ca -0.06 -0.95 0.10 0.00 1.00 0.00 0.00 64.86 64.96 1oco h ILE 412 Cb 1.78 1.41 -0.08 0.00 -0.74 0.00 0.00 36.82 39.20 1oco h ILE 412 CO 0.11 0.29 0.18 -0.74 0.00 0.00 0.00 178.15 177.99 1oco h HIS 413 N 0.19 0.29 0.49 1.37 2.76 -1.37 0.27 115.15 119.15 1oco h HIS 413 Ca 0.06 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.24 1oco h HIS 413 Cb 0.44 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.37 1oco h HIS 413 CO 0.04 0.03 -0.24 0.35 -1.30 0.00 0.00 177.93 176.81 1oco h PHE 414 N 0.33 -0.61 -1.00 5.26 3.57 -1.20 -1.88 116.94 121.41 1oco h PHE 414 Ca 0.31 -0.01 0.20 0.00 3.53 0.00 0.00 57.97 62.00 1oco h PHE 414 Cb 0.43 0.20 -0.11 0.00 2.79 0.00 0.00 35.95 39.27 1oco h PHE 414 CO -0.21 -0.34 0.61 0.00 -2.23 0.00 0.00 178.31 176.15 1oco h ALA 415 N -0.28 1.77 0.30 2.41 0.00 0.47 0.44 119.26 124.38 1oco h ALA 415 Ca -0.07 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1oco h ALA 415 Cb 0.55 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1oco h ALA 415 CO 0.11 -0.16 -0.14 0.82 0.00 0.00 0.00 179.25 179.88 1oco h ILE 416 N 0.68 0.57 -0.01 0.00 2.04 -0.44 -3.18 117.51 117.18 1oco h ILE 416 Ca 0.58 -0.79 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 1oco h ILE 416 Cb 1.01 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 1oco h ILE 416 CO -0.37 0.13 -0.01 -0.03 0.00 0.00 0.00 178.15 177.86 1oco h MET 417 N -0.91 0.01 -0.44 2.37 4.05 -0.92 -0.95 114.93 118.14 1oco h MET 417 Ca -0.04 -0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.36 1oco h MET 417 Cb 0.51 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.29 1oco h MET 417 CO 0.07 0.02 0.20 0.35 0.23 0.00 0.00 176.91 177.78 1oco h PHE 418 N 0.01 0.65 0.51 1.39 3.57 -0.96 -1.15 116.94 120.96 1oco h PHE 418 Ca 0.00 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1oco h PHE 418 Cb 0.03 -0.20 0.01 0.00 2.79 0.00 0.00 35.95 38.57 1oco h PHE 418 CO 0.00 0.54 -0.25 0.28 -2.23 0.00 0.00 178.31 176.65 1oco h VAL 419 N 0.58 0.32 -0.32 1.41 2.07 -1.43 -3.10 116.25 115.76 1oco h VAL 419 Ca 0.15 -0.44 0.03 0.00 0.82 0.00 0.00 66.70 67.26 1oco h VAL 419 Cb 0.14 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 1oco h VAL 419 CO -0.02 0.05 -0.24 1.23 0.02 0.00 0.00 177.57 178.61 1oco h GLY 420 N -1.02 -1.80 0.87 2.17 0.00 -1.06 -0.67 103.07 101.56 1oco h GLY 420 Ca -0.07 0.93 0.08 0.00 0.00 0.00 0.00 47.33 48.27 1oco h GLY 420 CO 0.12 -0.55 0.53 -0.39 0.00 0.00 0.00 176.54 176.25 1oco h VAL 421 N -0.06 1.00 -0.38 4.60 -1.51 -1.34 -1.03 116.25 117.53 1oco h VAL 421 Ca 0.05 -0.29 -0.13 0.00 -1.23 0.00 0.00 66.70 65.11 1oco h VAL 421 Cb 0.20 0.09 -0.01 0.00 -2.13 0.00 0.00 31.29 29.44 1oco h VAL 421 CO -0.34 0.15 -0.29 0.78 -1.23 0.00 0.00 177.57 176.65 1oco h ASN 422 N 0.83 0.85 0.25 4.19 2.35 -1.37 -1.82 115.58 120.86 1oco h ASN 422 Ca 0.37 -0.34 -0.13 0.00 -0.55 0.00 0.00 56.30 55.64 1oco h ASN 422 Cb 0.34 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 1oco h ASN 422 CO -0.14 1.08 -0.51 -0.03 -1.65 0.00 0.00 177.43 176.18 1oco h MET 423 N 0.70 0.29 -0.04 0.81 4.05 0.09 -1.19 114.93 119.65 1oco h MET 423 Ca 0.08 -0.17 -0.03 0.00 -0.28 0.00 0.00 59.70 59.30 1oco h MET 423 Cb 0.83 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.65 1oco h MET 423 CO 0.07 0.74 -0.09 1.15 0.23 0.00 0.00 176.91 179.02 1oco h THR 424 N 0.23 1.43 0.00 -0.77 2.02 -1.22 -3.37 112.91 111.23 1oco h THR 424 Ca 0.01 -1.41 -0.10 0.00 0.77 0.00 0.00 66.41 65.68 1oco h THR 424 Cb 0.98 2.27 -0.02 0.00 -1.74 0.00 0.00 68.15 69.65 1oco h THR 424 CO 0.08 0.38 -1.44 0.49 0.37 0.00 0.00 175.52 175.41 1oco n PHE 425 N -4.69 0.75 0.24 3.16 3.72 -0.69 -4.48 117.46 115.46 1oco n PHE 425 Ca -0.08 0.23 -0.16 0.00 -0.05 0.00 0.00 57.45 57.40 1oco n PHE 425 Cb 0.34 -0.94 -0.08 0.00 -0.94 0.00 0.00 39.48 37.86 1oco n PHE 425 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 1oco h PHE 426 N 0.00 -0.84 -1.00 1.38 3.57 -1.39 -2.78 116.94 115.88 1oco h PHE 426 Ca -0.11 0.00 0.19 0.00 3.53 0.00 0.00 57.97 61.58 1oco h PHE 426 Cb 1.33 0.32 -0.10 0.00 2.79 0.00 0.00 35.95 40.29 1oco h PHE 426 CO 0.00 -0.46 0.61 -1.35 -2.23 0.00 0.00 178.31 174.88 1oco h PRO 427 N -0.71 0.74 0.00 6.41 0.11 -1.80 -1.36 132.00 135.39 1oco h PRO 427 Ca -0.03 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1oco h PRO 427 Cb 0.62 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.56 1oco h PRO 427 CO -0.01 0.49 0.40 1.96 -0.21 0.00 0.00 178.00 180.62 1oco h GLN 428 N 0.76 0.00 -0.25 1.05 4.20 -1.71 0.44 115.11 119.59 1oco h GLN 428 Ca 0.57 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 59.15 1oco h GLN 428 Cb 0.90 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.67 1oco h GLN 428 CO -0.37 0.00 -0.38 0.45 -0.67 0.00 0.00 178.83 177.87 1oco h HIS 429 N 0.00 0.67 0.13 2.96 3.86 -1.36 -2.79 115.15 118.62 1oco h HIS 429 Ca 0.00 -0.18 -0.01 0.00 -1.16 0.00 0.00 60.37 59.02 1oco h HIS 429 Cb 0.80 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 29.12 1oco h HIS 429 CO 0.00 0.86 -0.06 0.74 0.86 0.00 0.00 177.93 180.33 1oco h PHE 430 N 0.47 -0.17 -1.07 2.45 0.04 -0.32 -2.36 116.94 115.99 1oco h PHE 430 Ca 0.05 -0.00 0.29 0.00 2.80 0.00 0.00 57.97 61.10 1oco h PHE 430 Cb 0.87 0.05 -0.11 0.00 2.20 0.00 0.00 35.95 38.96 1oco h PHE 430 CO 0.03 0.27 0.67 -0.07 -0.60 0.00 0.00 178.31 178.62 1oco h LEU 431 N -0.69 0.47 0.21 1.54 3.38 -1.46 0.25 115.31 119.01 1oco h LEU 431 Ca -0.02 0.11 -0.33 0.00 0.09 0.00 0.00 57.88 57.73 1oco h LEU 431 Cb 0.51 0.04 0.02 0.00 0.09 0.00 0.00 40.66 41.33 1oco h LEU 431 CO 0.03 0.04 -1.56 1.23 0.09 0.00 0.00 178.44 178.27 1oco h GLY 432 N 0.39 0.51 1.08 0.83 0.00 -1.49 0.18 103.07 104.57 1oco h GLY 432 Ca 0.65 -1.29 -0.03 0.00 0.00 0.00 0.00 47.33 46.65 1oco h GLY 432 CO -0.38 1.13 0.38 1.41 0.00 0.00 0.00 176.54 179.09 1oco h LEU 433 N 0.12 1.07 0.00 3.11 3.38 -0.59 -1.74 115.31 120.67 1oco h LEU 433 Ca -0.27 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1oco h LEU 433 Cb 2.12 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.59 1oco h LEU 433 CO 0.23 0.91 0.00 -1.54 0.09 0.00 0.00 178.44 178.13 1oco n SER 434 N -4.30 0.00 0.00 -0.43 3.41 0.72 -4.92 113.62 108.10 1oco n SER 434 Ca 0.08 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.23 1oco n SER 434 Cb 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 1oco n SER 434 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oco n GLY 435 N 0.70 0.46 3.68 5.00 0.00 -0.65 -5.03 105.19 109.34 1oco n GLY 435 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1oco n GLY 435 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1oco s MET 436 N -0.87 4.19 0.88 1.61 -2.45 0.62 -4.95 119.30 118.34 1oco s MET 436 Ca 0.00 2.29 -0.11 0.00 -1.25 0.00 0.00 55.69 56.61 1oco s MET 436 Cb 0.00 -3.79 0.12 0.00 1.25 0.00 0.00 34.83 32.42 1oco s MET 436 CO 0.00 -0.78 1.09 -2.14 1.05 0.00 0.00 175.02 174.24 1oco s PRO 437 N 3.28 1.37 0.62 4.11 0.02 -1.26 -2.04 135.00 141.10 1oco s PRO 437 Ca 0.74 0.83 -0.01 0.00 0.02 0.00 0.00 61.00 62.58 1oco s PRO 437 Cb -0.37 -1.82 0.05 0.00 0.02 0.00 0.00 34.50 32.38 1oco s PRO 437 CO 0.32 -2.17 0.87 1.03 -0.33 0.00 0.00 177.00 176.72 1oco s ARG 438 N -4.94 2.34 -1.55 5.54 0.52 -1.13 -4.38 118.95 115.34 1oco s ARG 438 Ca 0.63 -0.65 0.00 0.00 -0.52 0.00 0.00 55.73 55.19 1oco s ARG 438 Cb -0.18 -2.37 0.00 0.00 0.52 0.00 0.00 34.95 32.92 1oco s ARG 438 CO 0.57 -0.96 0.00 0.54 0.02 0.00 0.00 175.30 175.47 1oco n ARG 439 N -2.58 -1.82 -4.39 3.54 1.74 -1.26 -4.98 116.66 106.91 1oco n ARG 439 Ca 0.09 0.88 -0.35 0.00 -0.77 0.00 0.00 57.85 57.70 1oco n ARG 439 Cb 0.60 -5.47 -0.10 0.00 -1.02 0.00 0.00 32.46 26.47 1oco n ARG 439 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1oco s TYR 440 N -2.81 3.11 -1.69 -1.55 1.51 -1.26 -4.98 117.35 109.68 1oco s TYR 440 Ca 0.00 0.08 0.24 0.00 -1.01 0.00 0.00 57.07 56.38 1oco s TYR 440 Cb 0.00 -1.82 0.30 0.00 -0.11 0.00 0.00 41.96 40.33 1oco s TYR 440 CO 0.00 0.34 1.28 -1.13 -1.11 0.00 0.00 175.55 174.93 1oco n SER 441 N 2.48 1.36 -3.58 2.29 3.41 -1.26 -4.93 113.62 113.39 1oco n SER 441 Ca -0.18 -1.08 -0.11 0.00 -0.26 0.00 0.00 58.87 57.24 1oco n SER 441 Cb 0.53 0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 64.84 1oco n SER 441 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1oco s ASP 442 N -2.61 -0.36 0.07 4.04 -1.08 -1.26 -4.70 116.67 110.77 1oco s ASP 442 Ca 0.19 -0.24 -0.05 0.00 -0.52 0.00 0.00 52.55 51.92 1oco s ASP 442 Cb 0.18 0.54 -0.02 0.00 -1.46 0.00 0.00 42.92 42.17 1oco s ASP 442 CO 0.61 -0.94 0.09 -0.72 0.52 0.00 0.00 175.17 174.73 1oco s TYR 443 N -3.80 0.31 0.56 -5.34 1.13 -1.26 -5.05 117.35 103.90 1oco s TYR 443 Ca 0.04 -0.78 -0.21 0.00 -1.41 0.00 0.00 57.07 54.71 1oco s TYR 443 Cb 0.00 -0.20 -0.05 0.00 -1.10 0.00 0.00 41.96 40.61 1oco s TYR 443 CO -0.10 -0.46 1.22 -2.30 -2.51 0.00 0.00 175.55 171.39 1oco n PRO 444 N 0.07 1.38 -0.34 -3.49 -0.02 -1.26 -4.85 135.00 126.48 1oco n PRO 444 Ca -0.15 0.51 0.23 0.00 -2.02 0.00 0.00 63.50 62.08 1oco n PRO 444 Cb 0.62 -2.41 0.47 0.00 -0.02 0.00 0.00 33.50 32.15 1oco n PRO 444 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1oco h ASP 445 N 1.08 0.53 -0.89 2.55 3.32 -2.03 -2.27 116.42 118.70 1oco h ASP 445 Ca -0.50 0.18 0.24 0.00 0.02 0.00 0.00 57.03 56.97 1oco h ASP 445 Cb 1.33 0.12 -0.05 0.00 0.22 0.00 0.00 39.33 40.95 1oco h ASP 445 CO 0.55 -0.10 0.62 0.00 -1.72 0.00 0.00 179.24 178.58 1oco h ALA 446 N 1.83 2.59 -0.07 3.45 0.00 -2.05 -1.21 119.26 123.80 1oco h ALA 446 Ca 0.72 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.63 1oco h ALA 446 Cb 1.64 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1oco h ALA 446 CO -0.58 -0.86 0.00 0.66 0.00 0.00 0.00 179.25 178.47 1oco n TYR 447 N -4.37 0.14 -0.13 0.00 4.01 -0.85 -4.38 117.16 111.58 1oco n TYR 447 Ca 0.19 -0.06 -0.11 0.00 -0.16 0.00 0.00 57.90 57.76 1oco n TYR 447 Cb 0.86 -0.05 0.02 0.00 -0.31 0.00 0.00 39.34 39.85 1oco n TYR 447 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1oco h THR 448 N 0.43 1.27 0.60 -0.72 2.02 -1.41 -3.18 112.91 111.92 1oco h THR 448 Ca 0.00 -1.43 -0.03 0.00 0.77 0.00 0.00 66.41 65.72 1oco h THR 448 Cb 0.30 1.23 0.01 0.00 -1.74 0.00 0.00 68.15 67.94 1oco h THR 448 CO 0.02 0.49 -0.29 -0.03 0.37 0.00 0.00 175.52 176.07 1oco h MET 449 N 0.78 -0.78 -0.60 6.66 1.85 -1.85 -1.54 114.93 119.46 1oco h MET 449 Ca 0.09 0.05 0.03 0.00 -0.61 0.00 0.00 59.70 59.27 1oco h MET 449 Cb 0.84 0.18 -0.03 0.00 0.43 0.00 0.00 31.60 33.01 1oco h MET 449 CO 0.07 -0.47 0.40 -1.49 -0.40 0.00 0.00 176.91 175.02 1oco h TRP 450 N -1.04 0.68 0.00 1.39 -0.00 -1.91 0.37 115.95 115.44 1oco h TRP 450 Ca -0.08 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 58.82 1oco h TRP 450 Cb 0.67 -0.23 -0.00 0.00 -0.00 0.00 0.00 29.16 29.61 1oco h TRP 450 CO 0.00 0.40 -0.03 -0.91 -0.00 0.00 0.00 178.44 177.90 1oco h ASN 451 N 0.71 0.00 0.17 -3.49 2.35 -1.56 -1.02 115.58 112.74 1oco h ASN 451 Ca 0.24 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.76 1oco h ASN 451 Cb 0.07 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.47 1oco h ASN 451 CO -0.06 0.03 -1.02 0.74 -1.65 0.00 0.00 177.43 175.46 1oco h THR 452 N 0.00 1.43 -0.03 2.81 2.02 0.60 -2.63 112.91 117.10 1oco h THR 452 Ca -0.00 -2.57 -0.01 0.00 0.77 0.00 0.00 66.41 64.60 1oco h THR 452 Cb 0.87 3.14 -0.00 0.00 -1.74 0.00 0.00 68.15 70.42 1oco h THR 452 CO 0.00 0.74 -0.00 0.40 0.37 0.00 0.00 175.52 177.03 1oco h ILE 453 N -0.23 1.25 -0.52 3.11 2.04 -0.50 -2.83 117.51 119.84 1oco h ILE 453 Ca -0.18 -0.77 0.10 0.00 1.00 0.00 0.00 64.86 65.01 1oco h ILE 453 Cb 1.79 1.70 -0.08 0.00 -0.74 0.00 0.00 36.82 39.49 1oco h ILE 453 CO 0.18 0.21 0.05 -1.28 0.00 0.00 0.00 178.15 177.31 1oco h SER 454 N -0.24 -0.11 -0.08 1.72 0.87 -1.29 -0.42 113.55 114.00 1oco h SER 454 Ca 0.01 0.11 -0.06 0.00 -1.23 0.00 0.00 61.79 60.62 1oco h SER 454 Cb 0.33 0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 1oco h SER 454 CO 0.00 -0.03 -0.11 0.28 -0.53 0.00 0.00 176.83 176.45 1oco h SER 455 N 0.17 0.37 -0.49 6.23 0.02 -1.44 -2.09 113.55 116.33 1oco h SER 455 Ca 0.26 -0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1oco h SER 455 Cb 0.38 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 1oco h SER 455 CO -0.39 0.52 0.14 0.24 -1.14 0.00 0.00 176.83 176.20 1oco h MET 456 N 0.37 0.76 -0.50 3.45 2.07 -0.90 -1.79 114.93 118.39 1oco h MET 456 Ca 0.07 -0.17 0.09 0.00 -2.07 0.00 0.00 59.70 57.62 1oco h MET 456 Cb 0.42 -0.11 -0.08 0.00 -1.87 0.00 0.00 31.60 29.96 1oco h MET 456 CO 0.02 0.73 0.05 0.78 1.07 0.00 0.00 176.91 179.56 1oco h GLY 457 N 0.66 0.57 1.41 8.32 0.00 -0.48 -0.43 103.07 113.12 1oco h GLY 457 Ca 0.15 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1oco h GLY 457 CO -0.00 -0.11 0.29 1.48 0.00 0.00 0.00 176.54 178.20 1oco h SER 458 N 0.17 0.00 0.73 0.19 4.64 -0.84 0.54 113.55 118.98 1oco h SER 458 Ca 0.26 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.32 1oco h SER 458 Cb 0.37 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 1oco h SER 458 CO -0.38 0.00 -1.25 -0.26 -0.87 0.00 0.00 176.83 174.07 1oco h PHE 459 N 0.00 0.23 -0.50 4.77 -1.00 -1.03 -3.15 116.94 116.26 1oco h PHE 459 Ca 0.00 -0.17 -0.04 0.00 2.81 0.00 0.00 57.97 60.58 1oco h PHE 459 Cb 0.59 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 40.12 1oco h PHE 459 CO 0.00 1.16 0.17 0.82 -1.61 0.00 0.00 178.31 178.85 1oco h ILE 460 N 0.03 1.22 -0.53 -0.55 2.04 0.13 -2.42 117.51 117.44 1oco h ILE 460 Ca -0.12 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.02 1oco h ILE 460 Cb 1.90 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 38.71 1oco h ILE 460 CO 0.15 0.27 0.34 0.28 0.00 0.00 0.00 178.15 179.19 1oco h SER 461 N 0.68 0.58 -0.69 1.72 0.02 -1.62 -0.30 113.55 113.94 1oco h SER 461 Ca 0.16 -0.01 0.13 0.00 -0.84 0.00 0.00 61.79 61.23 1oco h SER 461 Cb 0.25 -0.13 -0.09 0.00 0.14 0.00 0.00 62.40 62.57 1oco h SER 461 CO -0.01 0.41 0.23 0.25 -1.14 0.00 0.00 176.83 176.58 1oco h LEU 462 N 0.69 0.18 -0.60 5.07 5.85 -1.45 0.12 115.31 125.18 1oco h LEU 462 Ca 0.20 0.11 0.02 0.00 0.84 0.00 0.00 57.88 59.05 1oco h LEU 462 Cb -0.04 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 1oco h LEU 462 CO -0.06 0.08 0.37 0.74 -0.34 0.00 0.00 178.44 179.23 1oco h THR 463 N 0.38 1.10 -0.26 1.05 2.02 -0.62 0.49 112.91 117.07 1oco h THR 463 Ca 0.37 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 67.27 1oco h THR 463 Cb 0.54 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1oco h THR 463 CO -0.39 0.14 0.06 0.00 0.37 0.00 0.00 175.52 175.70 1oco h ALA 464 N 1.25 1.62 0.00 6.16 0.00 0.46 -0.97 119.26 127.78 1oco h ALA 464 Ca 0.23 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1oco h ALA 464 Cb -0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1oco h ALA 464 CO -0.08 0.29 -0.19 -0.39 0.00 0.00 0.00 179.25 178.88 1oco h VAL 465 N 0.37 0.13 0.02 0.00 -1.51 0.71 -2.62 116.25 113.35 1oco h VAL 465 Ca 0.09 -1.19 -0.00 0.00 -1.23 0.00 0.00 66.70 64.37 1oco h VAL 465 Cb 0.15 2.01 0.00 0.00 -2.13 0.00 0.00 31.29 31.32 1oco h VAL 465 CO -0.00 0.07 -0.01 0.24 -1.23 0.00 0.00 177.57 176.64 1oco h MET 466 N 0.00 -0.02 -0.98 5.19 2.86 -0.08 -3.17 114.93 118.72 1oco h MET 466 Ca -0.00 0.00 0.21 0.00 -2.06 0.00 0.00 59.70 57.85 1oco h MET 466 Cb 1.06 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 32.64 1oco h MET 466 CO 0.01 0.68 0.62 -0.07 1.06 0.00 0.00 176.91 179.21 1oco h LEU 467 N -0.76 0.62 -0.68 1.22 3.38 -1.25 -0.81 115.31 117.03 1oco h LEU 467 Ca -0.00 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1oco h LEU 467 Cb 0.71 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1oco h LEU 467 CO 0.00 0.21 0.34 -0.03 0.09 0.00 0.00 178.44 179.05 1oco h MET 468 N 0.60 0.96 -0.55 1.13 4.05 -1.44 0.24 114.93 119.91 1oco h MET 468 Ca 0.55 -0.13 0.04 0.00 -0.28 0.00 0.00 59.70 59.88 1oco h MET 468 Cb 1.09 -0.18 -0.04 0.00 -0.80 0.00 0.00 31.60 31.67 1oco h MET 468 CO -0.31 0.75 0.30 0.28 0.23 0.00 0.00 176.91 178.16 1oco h VAL 469 N 0.93 0.99 -0.08 -5.77 2.07 -1.13 -1.76 116.25 111.51 1oco h VAL 469 Ca 0.23 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.57 1oco h VAL 469 Cb 0.09 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 1oco h VAL 469 CO -0.03 0.11 -0.05 0.15 0.02 0.00 0.00 177.57 177.77 1oco h PHE 470 N 0.59 -0.11 -0.83 1.57 3.57 -1.04 -1.45 116.94 119.24 1oco h PHE 470 Ca 0.24 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.87 1oco h PHE 470 Cb 0.11 0.06 -0.08 0.00 2.79 0.00 0.00 35.95 38.83 1oco h PHE 470 CO -0.08 -0.08 0.44 0.82 -2.23 0.00 0.00 178.31 177.18 1oco h ILE 471 N -0.05 0.81 -0.26 1.41 2.04 -0.50 0.25 117.51 121.22 1oco h ILE 471 Ca 0.05 -0.24 -0.05 0.00 1.00 0.00 0.00 64.86 65.62 1oco h ILE 471 Cb 0.12 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.25 1oco h ILE 471 CO -0.11 0.13 -0.03 0.40 0.00 0.00 0.00 178.15 178.54 1oco h ILE 472 N 0.69 1.27 0.32 -0.67 2.04 -1.16 -2.40 117.51 117.60 1oco h ILE 472 Ca 0.43 -0.99 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 1oco h ILE 472 Cb 0.51 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 1oco h ILE 472 CO -0.31 0.31 -0.29 -0.25 0.00 0.00 0.00 178.15 177.61 1oco h TRP 473 N 0.23 -0.79 0.00 1.37 7.01 0.02 -1.88 115.95 121.91 1oco h TRP 473 Ca 0.07 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.07 1oco h TRP 473 Cb 0.47 0.30 -0.00 0.00 -2.10 0.00 0.00 29.16 27.83 1oco h TRP 473 CO 0.04 -0.43 -0.01 1.05 -2.79 0.00 0.00 178.44 176.30 1oco h GLU 474 N -0.63 0.00 -0.38 2.65 -0.00 -0.63 0.33 114.58 115.92 1oco h GLU 474 Ca -0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.32 1oco h GLU 474 Cb 0.57 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.31 1oco h GLU 474 CO -0.05 0.01 0.14 0.00 -0.00 0.00 0.00 179.01 179.11 1oco h ALA 475 N 1.99 0.49 0.00 1.06 0.00 -0.83 0.27 119.26 122.24 1oco h ALA 475 Ca -0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 1oco h ALA 475 Cb 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1oco h ALA 475 CO 0.00 0.11 -0.40 0.74 0.00 0.00 0.00 179.25 179.70 1oco h PHE 476 N 0.46 0.00 -0.01 0.00 0.04 -0.51 -3.15 116.94 113.76 1oco h PHE 476 Ca 0.12 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.74 1oco h PHE 476 Cb 0.21 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.38 1oco h PHE 476 CO 0.00 0.40 -0.57 0.00 -0.60 0.00 0.00 178.31 177.53 1oco h ALA 477 N 1.60 0.09 -0.00 2.45 0.00 0.33 -3.34 119.26 120.39 1oco h ALA 477 Ca -0.00 -0.56 -0.17 0.00 0.00 0.00 0.00 54.91 54.18 1oco h ALA 477 Cb 1.11 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1oco h ALA 477 CO 0.05 0.34 -0.79 0.77 0.00 0.00 0.00 179.25 179.63 1oco h SER 478 N -0.10 0.06 -4.87 0.00 0.02 -1.07 -3.49 113.55 104.11 1oco h SER 478 Ca -0.07 -0.04 -0.22 0.00 -0.84 0.00 0.00 61.79 60.62 1oco h SER 478 Cb 1.28 -0.02 0.14 0.00 0.14 0.00 0.00 62.40 63.95 1oco h SER 478 CO 0.11 0.82 -0.64 0.29 -1.14 0.00 0.00 176.83 176.28 1oco n LYS 479 N -3.63 -3.21 -2.87 3.45 5.02 -1.19 -4.97 118.16 110.76 1oco n LYS 479 Ca -0.01 0.67 -0.43 0.00 -2.02 0.00 0.00 58.31 56.51 1oco n LYS 479 Cb 0.75 -4.97 -0.03 0.00 -0.02 0.00 0.00 35.03 30.77 1oco n LYS 479 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1oco s ARG 480 N -4.50 3.55 0.34 1.97 0.52 -1.26 -5.01 118.95 114.56 1oco s ARG 480 Ca 0.20 -1.57 -0.28 0.00 -0.52 0.00 0.00 55.73 53.56 1oco s ARG 480 Cb -0.03 -4.90 -0.10 0.00 0.52 0.00 0.00 34.95 30.44 1oco s ARG 480 CO 0.57 -1.84 1.26 -1.21 0.02 0.00 0.00 175.30 174.10 1oco s GLU 481 N 3.15 4.30 0.34 3.54 2.02 -1.26 -1.55 118.70 129.23 1oco s GLU 481 Ca 0.33 2.10 -0.28 0.00 0.02 0.00 0.00 54.97 57.14 1oco s GLU 481 Cb -0.05 -2.99 -0.10 0.00 0.10 0.00 0.00 34.13 31.09 1oco s GLU 481 CO -0.07 -0.19 1.24 0.08 0.02 0.00 0.00 175.26 176.33 1oco s VAL 482 N -1.20 2.93 -0.06 2.63 1.01 -0.46 -4.90 120.40 120.35 1oco s VAL 482 Ca 0.50 0.91 -0.07 0.00 0.00 0.00 0.00 61.98 63.32 1oco s VAL 482 Cb -0.37 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 1oco s VAL 482 CO 0.49 0.19 -0.15 0.18 0.00 0.00 0.00 175.10 175.81 1oco n LEU 483 N 0.71 1.19 -4.03 3.92 4.77 -1.26 -4.95 117.00 117.35 1oco n LEU 483 Ca 0.01 0.19 -0.21 0.00 -0.03 0.00 0.00 56.01 55.96 1oco n LEU 483 Cb 0.43 -0.44 -0.15 0.00 -2.33 0.00 0.00 43.42 40.93 1oco n LEU 483 CO 0.56 -0.20 -0.45 -0.89 -1.33 0.00 0.00 177.39 175.09 1oco s THR 484 N -2.31 0.88 -0.04 -5.08 2.01 -1.26 -5.11 115.64 104.73 1oco s THR 484 Ca -0.14 -0.43 0.06 0.00 0.31 0.00 0.00 61.69 61.49 1oco s THR 484 Cb 0.04 -0.76 -0.02 0.00 0.01 0.00 0.00 72.50 71.76 1oco s THR 484 CO 0.19 0.26 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.49 1oco s VAL 485 N 0.07 2.48 0.65 3.82 1.01 -1.26 -5.14 120.40 122.03 1oco s VAL 485 Ca -0.01 -0.94 -0.08 0.00 0.00 0.00 0.00 61.98 60.94 1oco s VAL 485 Cb -0.08 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.40 1oco s VAL 485 CO 0.00 0.58 1.00 -1.81 0.00 0.00 0.00 175.10 174.88 1oco s ASP 486 N -0.60 5.44 -1.17 3.32 1.11 -1.26 -4.48 116.67 119.02 1oco s ASP 486 Ca 0.09 0.87 -0.13 0.00 0.18 0.00 0.00 52.55 53.56 1oco s ASP 486 Cb -0.11 -1.74 0.12 0.00 1.07 0.00 0.00 42.92 42.26 1oco s ASP 486 CO 0.00 -1.25 0.40 0.18 1.18 0.00 0.00 175.17 175.69 1oco n LEU 487 N -2.81 -0.85 0.24 1.23 4.77 -1.26 -4.85 117.00 113.47 1oco n LEU 487 Ca 0.06 -0.49 0.11 0.00 -0.03 0.00 0.00 56.01 55.66 1oco n LEU 487 Cb 0.58 -1.61 0.59 0.00 -2.33 0.00 0.00 43.42 40.65 1oco n LEU 487 CO 0.55 0.10 0.88 0.71 -1.33 0.00 0.00 177.39 178.30 1oco h THR 488 N -0.68 0.60 -0.99 -5.08 1.35 -1.86 -2.82 112.91 103.44 1oco h THR 488 Ca -0.38 -0.84 0.19 0.00 -0.55 0.00 0.00 66.41 64.83 1oco h THR 488 Cb 1.25 1.55 -0.11 0.00 -1.73 0.00 0.00 68.15 69.11 1oco h THR 488 CO 0.53 0.18 0.59 0.71 -0.25 0.00 0.00 175.52 177.29 1oco h THR 489 N 0.00 0.69 -0.01 6.82 1.35 -1.97 0.15 112.91 119.94 1oco h THR 489 Ca -0.00 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1oco h THR 489 Cb 0.54 -0.11 0.00 0.00 -1.73 0.00 0.00 68.15 66.85 1oco h THR 489 CO 0.02 0.13 -0.82 0.35 -0.25 0.00 0.00 175.52 174.96 1oco n THR 490 N -4.79 0.00 -3.44 6.82 -2.24 -1.18 -4.67 114.28 104.77 1oco n THR 490 Ca 0.23 -0.09 -0.30 0.00 -2.27 0.00 0.00 64.05 61.62 1oco n THR 490 Cb 0.58 1.09 -0.07 0.00 -2.10 0.00 0.00 70.33 69.83 1oco n THR 490 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1oco n ASN 491 N -1.00 4.10 0.00 3.42 3.02 0.51 -4.96 115.26 120.35 1oco n ASN 491 Ca 0.06 -3.39 0.22 0.00 -0.03 0.00 0.00 54.58 51.43 1oco n ASN 491 Cb 0.37 -0.80 0.56 0.00 -0.61 0.00 0.00 39.78 39.31 1oco n ASN 491 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1oco h LEU 492 N 4.65 0.00 -1.71 3.41 6.46 -1.83 -1.59 115.31 124.69 1oco h LEU 492 Ca 0.19 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.95 1oco h LEU 492 Cb 0.68 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.61 1oco h LEU 492 CO 0.90 0.00 -0.02 1.05 -0.62 0.00 0.00 178.44 179.74 1oco h GLU 493 N 0.00 0.00 -0.00 1.25 9.09 -1.91 -2.97 114.58 120.04 1oco h GLU 493 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.70 1oco h GLU 493 Cb 1.92 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 29.02 1oco h GLU 493 CO -0.00 0.02 -0.38 0.91 0.05 0.00 0.00 179.01 179.61 1oco n TRP 494 N -3.14 0.00 0.30 2.06 7.02 -0.60 -4.43 117.44 118.65 1oco n TRP 494 Ca -0.00 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.62 1oco n TRP 494 Cb 0.27 -0.26 0.65 0.00 -2.42 0.00 0.00 31.31 29.56 1oco n TRP 494 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1oco h LEU 495 N 0.21 0.00 -2.87 -0.99 3.38 -1.71 -2.99 115.31 110.33 1oco h LEU 495 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1oco h LEU 495 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1oco h LEU 495 CO 0.00 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.12 1oco n ASN 496 N -2.51 3.99 0.00 -0.43 3.02 -1.26 -5.08 115.26 112.99 1oco n ASN 496 Ca 0.00 -2.13 0.00 0.00 -0.03 0.00 0.00 54.58 52.43 1oco n ASN 496 Cb 0.16 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 1oco n ASN 496 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1oco n GLY 497 N 1.31 -1.56 3.22 7.41 0.00 -1.13 -4.32 105.19 110.11 1oco n GLY 497 Ca 0.23 -1.56 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 1oco n GLY 497 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oco s PRO 499 N 1.34 3.65 0.62 0.00 0.04 -1.26 -4.13 135.00 135.27 1oco s PRO 499 Ca -0.01 0.11 -0.19 0.00 0.04 0.00 0.00 61.00 60.95 1oco s PRO 499 Cb -0.17 -2.57 -0.02 0.00 0.04 0.00 0.00 34.50 31.77 1oco s PRO 499 CO -0.02 0.13 1.32 -1.25 0.04 0.00 0.00 177.00 177.21 1oco s PRO 500 N -3.72 2.71 0.83 0.56 0.04 -0.44 -4.95 135.00 130.03 1oco s PRO 500 Ca 0.46 2.12 -0.11 0.00 0.04 0.00 0.00 61.00 63.50 1oco s PRO 500 Cb -0.11 -1.96 0.10 0.00 0.04 0.00 0.00 34.50 32.57 1oco s PRO 500 CO 0.31 -1.49 1.14 -1.25 0.04 0.00 0.00 177.00 175.75 1oco s PRO 501 N -3.25 1.63 0.29 0.56 0.04 -1.26 -4.87 135.00 128.14 1oco s PRO 501 Ca 0.80 1.46 0.01 0.00 0.04 0.00 0.00 61.00 63.31 1oco s PRO 501 Cb -0.39 -1.80 0.68 0.00 0.04 0.00 0.00 34.50 33.03 1oco s PRO 501 CO 0.42 -2.16 1.63 -0.92 0.04 0.00 0.00 177.00 176.01 1oco h TYR 502 N -1.33 0.23 -3.81 0.56 3.20 -2.01 -3.28 116.97 110.54 1oco h TYR 502 Ca -0.44 0.05 -0.67 0.00 3.14 0.00 0.00 58.73 60.81 1oco h TYR 502 Cb 1.26 0.04 -0.36 0.00 1.54 0.00 0.00 36.73 39.21 1oco h TYR 502 CO 0.52 -0.26 -0.75 -1.01 -1.64 0.00 0.00 178.16 175.02 1oco s HIS 503 N -5.97 3.34 0.14 -3.82 3.76 -1.26 -4.95 115.29 106.53 1oco s HIS 503 Ca -0.12 -2.29 0.02 0.00 -0.15 0.00 0.00 55.06 52.52 1oco s HIS 503 Cb 0.26 -2.15 -0.04 0.00 1.11 0.00 0.00 32.58 31.76 1oco s HIS 503 CO 0.77 -0.87 0.26 0.95 -0.85 0.00 0.00 174.74 175.00 1oco s THR 504 N 1.12 5.28 -1.46 1.30 -4.23 -1.24 -4.61 115.64 111.80 1oco s THR 504 Ca -0.05 -0.67 -0.04 0.00 -1.18 0.00 0.00 61.69 59.75 1oco s THR 504 Cb -0.20 -3.70 0.02 0.00 1.34 0.00 0.00 72.50 69.96 1oco s THR 504 CO -0.04 -0.06 0.36 0.49 -0.54 0.00 0.00 174.62 174.83 1oco n PHE 505 N -0.41 -1.65 0.26 3.99 3.72 -1.26 -4.60 117.46 117.51 1oco n PHE 505 Ca -0.07 0.32 0.10 0.00 -0.05 0.00 0.00 57.45 57.75 1oco n PHE 505 Cb 0.54 -3.77 0.70 0.00 -0.94 0.00 0.00 39.48 36.00 1oco n PHE 505 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1oco h GLU 506 N -0.79 0.00 -4.99 -1.08 5.08 -1.95 -3.29 114.58 107.55 1oco h GLU 506 Ca -0.46 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.23 1oco h GLU 506 Cb 1.32 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.24 1oco h GLU 506 CO 0.53 0.04 -0.81 -2.00 -1.00 0.00 0.00 179.01 175.78 1oco s GLU 507 N -4.79 2.92 1.03 2.33 2.12 -1.26 -5.12 118.70 115.94 1oco s GLU 507 Ca -0.05 -0.89 -0.19 0.00 0.36 0.00 0.00 54.97 54.20 1oco s GLU 507 Cb 0.16 -2.77 -0.01 0.00 0.26 0.00 0.00 34.13 31.77 1oco s GLU 507 CO 0.63 -0.29 -0.33 -2.30 -0.54 0.00 0.00 175.26 172.43 1oco n PRO 508 N 4.63 -0.69 -1.97 4.30 -0.02 -1.24 -5.02 135.00 135.00 1oco n PRO 508 Ca -0.19 -0.18 -0.29 0.00 -2.02 0.00 0.00 63.50 60.82 1oco n PRO 508 Cb 0.48 -1.49 0.15 0.00 -0.02 0.00 0.00 33.50 32.62 1oco n PRO 508 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1oco s THR 509 N -2.19 2.02 -0.18 3.45 -4.23 -1.26 -5.05 115.64 108.19 1oco s THR 509 Ca 0.50 -0.05 0.01 0.00 -1.18 0.00 0.00 61.69 60.97 1oco s THR 509 Cb -0.11 -2.98 0.02 0.00 1.34 0.00 0.00 72.50 70.78 1oco s THR 509 CO 0.69 0.00 -0.19 -0.47 -0.54 0.00 0.00 174.62 174.11 1oco s TYR 510 N -3.72 2.81 -0.07 3.99 5.04 -1.26 -5.07 117.35 119.06 1oco s TYR 510 Ca 0.69 -1.63 -0.01 0.00 -2.44 0.00 0.00 57.07 53.68 1oco s TYR 510 Cb -0.07 -1.93 0.03 0.00 0.35 0.00 0.00 41.96 40.34 1oco s TYR 510 CO 0.51 -0.80 -0.01 0.08 -1.34 0.00 0.00 175.55 174.00 1oco s VAL 511 N 1.30 0.43 0.53 3.14 1.01 -1.26 -5.14 120.40 120.41 1oco s VAL 511 Ca 0.05 0.08 -0.19 0.00 0.00 0.00 0.00 61.98 61.92 1oco s VAL 511 Cb -0.13 -0.57 -0.07 0.00 0.00 0.00 0.00 36.38 35.61 1oco s VAL 511 CO -0.12 0.27 1.06 0.20 0.00 0.00 0.00 175.10 176.51 1oco s ASN 512 N 1.90 6.06 -0.80 3.32 0.02 -1.26 -4.57 114.94 119.60 1oco s ASN 512 Ca 0.04 1.95 -0.11 0.00 -1.02 0.00 0.00 52.86 53.72 1oco s ASN 512 Cb -0.12 -2.56 0.21 0.00 0.02 0.00 0.00 41.25 38.80 1oco s ASN 512 CO -0.05 -0.98 0.72 -0.22 0.02 0.00 0.00 177.10 176.59 1oco s LEU 513 N -3.83 6.33 0.00 0.60 2.96 -1.26 -4.89 118.68 118.59 1oco s LEU 513 Ca 0.67 -2.84 0.00 0.00 -0.22 0.00 0.00 54.13 51.74 1oco s LEU 513 Cb -0.18 -2.11 0.00 0.00 0.50 0.00 0.00 46.19 44.40 1oco s LEU 513 CO 0.26 -0.49 0.20 0.29 -1.32 0.00 0.00 176.35 175.29