#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y5l h PHE 3 N 0.00 -0.03 -0.28 3.69 3.04 -2.05 -2.25 116.94 119.06 1y5l h PHE 3 Ca 0.00 -0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.95 1y5l h PHE 3 Cb 0.00 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 38.51 1y5l h PHE 3 CO 0.00 0.33 0.16 -0.07 -2.02 0.00 0.00 178.31 176.71 1y5l h LEU 4 N -0.40 0.33 -0.41 0.59 3.38 -2.05 -1.56 115.31 115.18 1y5l h LEU 4 Ca -0.00 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1y5l h LEU 4 Cb 0.37 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1y5l h LEU 4 CO 0.01 0.26 0.19 -1.13 0.09 0.00 0.00 178.44 177.85 1y5l h ASN 5 N 0.38 0.56 0.34 -0.43 -1.24 -1.94 -1.45 115.58 111.80 1y5l h ASN 5 Ca 0.10 -0.14 -0.18 0.00 0.71 0.00 0.00 56.30 56.79 1y5l h ASN 5 Cb -0.00 -0.14 -0.01 0.00 0.73 0.00 0.00 38.32 38.90 1y5l h ASN 5 CO -0.02 0.55 -0.73 0.24 -1.29 0.00 0.00 177.43 176.18 1y5l h MET 6 N 0.53 0.33 0.75 6.67 2.86 -0.89 -2.59 114.93 122.59 1y5l h MET 6 Ca 0.14 -0.27 -0.04 0.00 -2.06 0.00 0.00 59.70 57.47 1y5l h MET 6 Cb 0.15 0.06 0.01 0.00 0.06 0.00 0.00 31.60 31.87 1y5l h MET 6 CO -0.02 0.92 -0.36 0.35 1.06 0.00 0.00 176.91 178.87 1y5l h PHE 7 N 0.22 -0.93 0.00 -0.22 3.57 -1.15 0.10 116.94 118.53 1y5l h PHE 7 Ca -0.03 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.44 1y5l h PHE 7 Cb 1.30 0.31 -0.00 0.00 2.79 0.00 0.00 35.95 40.34 1y5l h PHE 7 CO 0.04 -0.58 -0.04 0.74 -2.23 0.00 0.00 178.31 176.24 1y5l h PHE 8 N -1.14 0.00 0.00 0.41 -1.00 -1.35 0.44 116.94 114.30 1y5l h PHE 8 Ca -0.10 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.68 1y5l h PHE 8 Cb 0.77 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.33 1y5l h PHE 8 CO 0.03 0.04 0.00 1.19 -1.61 0.00 0.00 178.31 177.96 1y5l n PHE 9 N -3.60 0.00 0.00 -0.55 3.72 -0.97 -4.21 117.46 111.85 1y5l n PHE 9 Ca -0.02 -0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1y5l n PHE 9 Cb 0.14 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 1y5l n PHE 9 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1y5l n ASP 10 N -0.00 3.58 -0.07 4.37 10.43 0.30 -3.89 116.55 131.26 1y5l n ASP 10 Ca 0.00 0.00 -0.08 0.00 2.57 0.00 0.00 54.79 57.28 1y5l n ASP 10 Cb 0.03 0.14 -0.03 0.00 1.84 0.00 0.00 41.12 43.10 1y5l n ASP 10 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 1y5l n ILE 11 N -2.12 1.47 -0.25 0.53 5.41 -0.84 -4.63 119.36 118.92 1y5l n ILE 11 Ca 0.00 0.17 -0.00 0.00 1.00 0.00 0.00 62.75 63.91 1y5l n ILE 11 Cb 0.41 -2.26 0.07 0.00 -0.71 0.00 0.00 39.64 37.15 1y5l n ILE 11 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 176.55 176.77 1y5l h TYR 12 N -0.89 -0.56 -0.43 1.39 3.20 -0.37 0.15 116.97 119.46 1y5l h TYR 12 Ca -0.00 0.07 0.12 0.00 3.14 0.00 0.00 58.73 62.06 1y5l h TYR 12 Cb 0.89 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.50 1y5l h TYR 12 CO -0.38 -0.34 0.51 -1.00 -1.64 0.00 0.00 178.16 175.31 1y5l h PRO 13 N -0.04 0.00 0.00 1.82 0.13 -1.79 0.37 132.00 132.48 1y5l h PRO 13 Ca 0.33 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.35 1y5l h PRO 13 Cb 0.55 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.66 1y5l h PRO 13 CO -0.76 0.00 -1.18 1.88 -0.23 0.00 0.00 178.00 177.71 1y5l h TYR 14 N 0.00 0.00 0.08 1.56 0.05 -0.98 -2.69 116.97 114.99 1y5l h TYR 14 Ca 0.20 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.98 1y5l h TYR 14 Cb 1.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.96 1y5l h TYR 14 CO 0.00 0.40 -0.04 0.82 -1.05 0.00 0.00 178.16 178.30 1y5l h ILE 15 N 0.00 1.20 -0.61 -2.88 2.04 0.01 -1.73 117.51 115.55 1y5l h ILE 15 Ca -0.10 -1.22 0.03 0.00 1.00 0.00 0.00 64.86 64.58 1y5l h ILE 15 Cb 1.40 1.96 -0.03 0.00 -0.74 0.00 0.00 36.82 39.40 1y5l h ILE 15 CO 0.03 0.29 0.40 0.00 0.00 0.00 0.00 178.15 178.88 1y5l h ALA 16 N 0.14 1.68 -0.17 1.87 0.00 -1.18 -0.89 119.26 120.72 1y5l h ALA 16 Ca -0.01 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.68 1y5l h ALA 16 Cb 0.55 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1y5l h ALA 16 CO 0.02 0.25 -0.67 0.78 0.00 0.00 0.00 179.25 179.62 1y5l h GLY 17 N 0.71 0.74 0.96 0.00 0.00 -1.46 -0.74 103.07 103.27 1y5l h GLY 17 Ca 0.24 -0.97 -0.10 0.00 0.00 0.00 0.00 47.33 46.50 1y5l h GLY 17 CO -0.07 0.87 -0.19 0.00 0.00 0.00 0.00 176.54 177.15 1y5l h ALA 18 N 0.75 0.46 -0.55 3.60 0.00 -0.77 -2.17 119.26 120.58 1y5l h ALA 18 Ca -0.02 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 1y5l h ALA 18 Cb 1.27 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1y5l h ALA 18 CO 0.13 0.40 0.01 0.28 0.00 0.00 0.00 179.25 180.07 1y5l h VAL 19 N 0.46 1.26 -0.13 0.00 2.07 -1.19 -1.80 116.25 116.93 1y5l h VAL 19 Ca 0.07 -1.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.50 1y5l h VAL 19 Cb 0.73 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1y5l h VAL 19 CO 0.05 0.39 0.04 0.15 0.02 0.00 0.00 177.57 178.22 1y5l h PHE 20 N 0.86 0.21 0.11 1.57 3.57 -1.04 -0.50 116.94 121.72 1y5l h PHE 20 Ca 0.16 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 1y5l h PHE 20 Cb 0.50 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.18 1y5l h PHE 20 CO 0.03 0.34 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.33 1y5l h LEU 21 N 0.01 -0.12 -1.05 0.59 3.38 -1.37 -2.52 115.31 114.22 1y5l h LEU 21 Ca 0.04 -0.45 -0.04 0.00 0.09 0.00 0.00 57.88 57.52 1y5l h LEU 21 Cb 0.24 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1y5l h LEU 21 CO -0.00 0.48 -0.19 -0.29 0.09 0.00 0.00 178.44 178.53 1y5l h ILE 22 N -0.82 0.45 -0.14 1.22 2.10 -1.45 -2.37 117.51 116.50 1y5l h ILE 22 Ca -0.01 -1.07 -0.20 0.00 1.08 0.00 0.00 64.86 64.65 1y5l h ILE 22 Cb 0.57 1.77 0.00 0.00 -1.09 0.00 0.00 36.82 38.07 1y5l h ILE 22 CO 0.02 0.19 -0.73 1.23 -1.08 0.00 0.00 178.15 177.78 1y5l h GLY 23 N 2.25 0.72 0.83 8.18 0.00 -1.16 -1.75 103.07 112.13 1y5l h GLY 23 Ca -0.00 -0.99 -0.04 0.00 0.00 0.00 0.00 47.33 46.30 1y5l h GLY 23 CO 0.02 0.88 -0.02 1.76 0.00 0.00 0.00 176.54 179.18 1y5l h SER 24 N 0.45 0.41 -0.24 0.19 0.02 -1.18 -1.22 113.55 111.99 1y5l h SER 24 Ca -0.04 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.57 1y5l h SER 24 Cb 1.33 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 1y5l h SER 24 CO 0.14 0.65 0.12 -0.25 -1.14 0.00 0.00 176.83 176.35 1y5l h TRP 25 N 0.16 0.34 -0.73 3.45 2.91 -1.47 0.49 115.95 121.10 1y5l h TRP 25 Ca 0.06 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 60.03 1y5l h TRP 25 Cb 0.45 -0.11 -0.03 0.00 -0.51 0.00 0.00 29.16 28.96 1y5l h TRP 25 CO 0.04 0.32 0.31 -0.07 -1.03 0.00 0.00 178.44 178.01 1y5l h LEU 26 N 0.26 0.98 -0.76 0.65 3.38 -1.28 -1.06 115.31 117.48 1y5l h LEU 26 Ca 0.08 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1y5l h LEU 26 Cb 0.10 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1y5l h LEU 26 CO -0.01 0.87 -0.39 -0.09 0.09 0.00 0.00 178.44 178.91 1y5l h ARG 27 N 1.03 0.00 -0.07 1.13 2.43 -1.08 -1.65 114.38 116.18 1y5l h ARG 27 Ca 0.24 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.34 1y5l h ARG 27 Cb 0.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1y5l h ARG 27 CO -0.02 0.39 -0.24 -0.92 -1.51 0.00 0.00 179.97 177.67 1y5l h TYR 28 N 0.00 0.38 0.00 2.20 5.03 -0.43 0.25 116.97 124.40 1y5l h TYR 28 Ca -0.00 -0.16 -0.11 0.00 2.58 0.00 0.00 58.73 61.04 1y5l h TYR 28 Cb 0.99 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 39.19 1y5l h TYR 28 CO 0.00 0.86 -0.51 -0.44 -1.32 0.00 0.00 178.16 176.75 1y5l h ASP 29 N -0.21 0.00 -0.00 -2.11 3.45 -1.17 -3.28 116.42 113.10 1y5l h ASP 29 Ca -0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.45 1y5l h ASP 29 Cb 0.87 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.64 1y5l h ASP 29 CO 0.05 0.51 0.00 -1.22 -1.57 0.00 0.00 179.24 177.02 1y5l n TYR 30 N -3.78 0.00 -2.26 4.55 4.01 -0.63 -4.76 117.16 114.30 1y5l n TYR 30 Ca -0.01 -0.03 0.04 0.00 -0.16 0.00 0.00 57.90 57.74 1y5l n TYR 30 Cb 0.55 -0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.65 1y5l n TYR 30 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1y5l n GLY 31 N 0.07 2.29 0.31 2.72 0.00 0.89 -4.91 105.19 106.55 1y5l n GLY 31 Ca 0.01 -1.03 0.06 0.00 0.00 0.00 0.00 46.02 45.07 1y5l n GLY 31 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1y5l h GLN 32 N 1.11 0.04 0.00 1.61 1.08 -1.61 0.32 115.11 117.65 1y5l h GLN 32 Ca -0.15 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.04 1y5l h GLN 32 Cb 1.61 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 29.03 1y5l h GLN 32 CO 0.09 0.03 -0.01 -0.92 -0.95 0.00 0.00 178.83 177.06 1y5l h TYR 33 N 0.04 0.00 -0.02 2.96 5.03 -1.92 -0.89 116.97 122.17 1y5l h TYR 33 Ca 0.45 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.76 1y5l h TYR 33 Cb 0.80 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.08 1y5l h TYR 33 CO -0.54 0.01 -0.12 0.25 -1.32 0.00 0.00 178.16 176.45 1y5l n THR 34 N -3.20 0.00 -2.98 1.81 -2.24 0.11 -4.73 114.28 103.04 1y5l n THR 34 Ca -0.02 -0.31 -0.44 0.00 -2.27 0.00 0.00 64.05 61.00 1y5l n THR 34 Cb 0.15 0.94 -0.01 0.00 -2.10 0.00 0.00 70.33 69.30 1y5l n THR 34 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1y5l s TRP 35 N -2.16 3.42 0.13 4.78 -0.11 -0.34 -4.97 118.94 119.70 1y5l s TRP 35 Ca 0.29 -1.88 -0.06 0.00 1.22 0.00 0.00 56.10 55.67 1y5l s TRP 35 Cb 0.20 -4.25 -0.02 0.00 -1.50 0.00 0.00 33.47 27.91 1y5l s TRP 35 CO 0.39 -1.38 0.19 -0.98 -4.62 0.00 0.00 176.95 170.55 1y5l s ARG 36 N 1.75 1.00 0.36 5.86 3.03 -1.26 -5.03 118.95 124.66 1y5l s ARG 36 Ca 0.37 -1.20 0.27 0.00 2.03 0.00 0.00 55.73 57.20 1y5l s ARG 36 Cb -0.04 0.33 0.91 0.00 -1.03 0.00 0.00 34.95 35.12 1y5l s ARG 36 CO -0.05 -0.33 1.78 0.00 -1.13 0.00 0.00 175.30 175.57 1y5l h ALA 37 N 2.70 1.00 -5.80 7.88 0.00 -1.93 -3.42 119.26 119.69 1y5l h ALA 37 Ca -0.33 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.22 1y5l h ALA 37 Cb 1.21 0.00 0.13 0.00 0.00 0.00 0.00 17.79 19.13 1y5l h ALA 37 CO 0.54 0.00 -0.79 0.00 0.00 0.00 0.00 179.25 179.00 1y5l n ALA 38 N -1.93 -2.01 -1.74 0.00 0.00 -1.26 -4.92 120.51 108.66 1y5l n ALA 38 Ca 0.03 -0.09 -0.39 0.00 0.00 0.00 0.00 53.44 52.99 1y5l n ALA 38 Cb 0.36 -2.29 0.03 0.00 0.00 0.00 0.00 19.45 17.55 1y5l n ALA 38 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1y5l n SER 39 N -3.10 2.81 0.00 0.00 2.88 -1.26 -4.89 113.62 110.05 1y5l n SER 39 Ca -0.29 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.28 1y5l n SER 39 Cb 0.67 -1.57 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 1y5l n SER 39 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1y5l n SER 40 N -0.62 1.06 -0.10 -3.46 3.41 -1.26 -4.83 113.62 107.82 1y5l n SER 40 Ca 0.09 -1.41 -0.05 0.00 -0.26 0.00 0.00 58.87 57.23 1y5l n SER 40 Cb 0.43 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.39 1y5l n SER 40 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1y5l h GLN 41 N 0.00 0.03 -0.81 4.33 4.15 -1.90 -2.66 115.11 118.24 1y5l h GLN 41 Ca 0.00 -0.00 0.13 0.00 0.77 0.00 0.00 58.65 59.55 1y5l h GLN 41 Cb 0.49 -0.01 -0.09 0.00 0.21 0.00 0.00 27.48 28.08 1y5l h GLN 41 CO 0.00 0.02 0.40 1.98 -1.93 0.00 0.00 178.83 179.30 1y5l h MET 42 N 0.03 0.59 0.00 1.69 4.05 -2.00 -1.15 114.93 118.14 1y5l h MET 42 Ca 0.17 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.53 1y5l h MET 42 Cb 0.26 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 30.92 1y5l h MET 42 CO -0.35 0.39 -0.12 -0.07 0.23 0.00 0.00 176.91 177.00 1y5l h LEU 43 N 0.61 0.00 -5.99 3.39 3.38 -1.85 -3.40 115.31 111.45 1y5l h LEU 43 Ca 0.43 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.45 1y5l h LEU 43 Cb 0.58 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.12 1y5l h LEU 43 CO -0.34 0.12 -0.33 -0.62 0.09 0.00 0.00 178.44 177.35 1y5l s ASP 44 N -6.31 -1.44 0.20 -0.43 2.15 -0.46 -4.86 116.67 105.51 1y5l s ASP 44 Ca -0.03 0.09 0.04 0.00 0.43 0.00 0.00 52.55 53.08 1y5l s ASP 44 Cb 0.14 1.90 0.11 0.00 -0.30 0.00 0.00 42.92 44.78 1y5l s ASP 44 CO 0.60 -0.26 1.46 0.03 -0.17 0.00 0.00 175.17 176.84 1y5l h ARG 45 N 7.79 0.20 -6.05 4.34 3.08 -1.72 -3.43 114.38 118.58 1y5l h ARG 45 Ca -0.02 -0.18 -0.82 0.00 0.07 0.00 0.00 59.98 59.03 1y5l h ARG 45 Cb 1.19 0.04 0.02 0.00 0.08 0.00 0.00 29.97 31.30 1y5l h ARG 45 CO 0.11 0.86 0.67 1.63 -1.07 0.00 0.00 179.97 182.17 1y5l n LYS 46 N -3.75 0.36 -0.50 0.04 4.76 -1.26 -1.58 118.16 116.24 1y5l n LYS 46 Ca -0.03 0.13 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 1y5l n LYS 46 Cb 0.72 -1.69 0.00 0.00 -1.84 0.00 0.00 35.03 32.22 1y5l n LYS 46 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1y5l n GLY 47 N 3.72 0.56 0.25 0.72 0.00 -1.26 -4.84 105.19 104.34 1y5l n GLY 47 Ca 0.28 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.23 1y5l n GLY 47 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1y5l h MET 48 N 0.98 0.70 0.10 1.61 2.86 -1.58 -1.05 114.93 118.56 1y5l h MET 48 Ca 0.00 -0.29 0.02 0.00 -2.06 0.00 0.00 59.70 57.37 1y5l h MET 48 Cb 0.00 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 1y5l h MET 48 CO 0.00 0.88 -0.23 -0.97 1.06 0.00 0.00 176.91 177.65 1y5l h ASN 49 N 0.60 -0.66 0.47 1.22 -0.00 -1.89 -0.00 115.58 115.33 1y5l h ASN 49 Ca 0.08 0.08 -0.02 0.00 -0.00 0.00 0.00 56.30 56.43 1y5l h ASN 49 Cb 0.75 0.25 0.00 0.00 -0.00 0.00 0.00 38.32 39.33 1y5l h ASN 49 CO 0.06 -0.32 -0.23 0.25 -0.00 0.00 0.00 177.43 177.19 1y5l h LEU 50 N -0.42 -0.54 -0.08 0.34 7.12 -1.94 -2.92 115.31 116.87 1y5l h LEU 50 Ca 0.03 -0.07 0.02 0.00 0.13 0.00 0.00 57.88 58.00 1y5l h LEU 50 Cb 0.45 0.14 -0.06 0.00 -0.53 0.00 0.00 40.66 40.66 1y5l h LEU 50 CO -0.14 -0.13 -0.51 0.00 -0.13 0.00 0.00 178.44 177.53 1y5l h ALA 51 N -0.85 -0.89 -0.70 1.25 0.00 -1.18 -0.25 119.26 116.62 1y5l h ALA 51 Ca -0.07 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.83 1y5l h ALA 51 Cb 0.57 0.97 -0.05 0.00 0.00 0.00 0.00 17.79 19.27 1y5l h ALA 51 CO 0.11 -1.07 0.42 1.03 0.00 0.00 0.00 179.25 179.74 1y5l h SER 52 N -0.58 0.64 -0.53 0.00 0.87 -1.13 -1.17 113.55 111.65 1y5l h SER 52 Ca 0.02 0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.51 1y5l h SER 52 Cb 0.66 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 1y5l h SER 52 CO -0.38 0.42 -0.00 0.78 -0.53 0.00 0.00 176.83 177.12 1y5l h ASN 53 N 0.78 0.95 0.10 6.23 4.21 -1.29 0.28 115.58 126.83 1y5l h ASN 53 Ca 0.30 -0.26 -0.00 0.00 1.21 0.00 0.00 56.30 57.55 1y5l h ASN 53 Cb 0.13 -0.25 0.00 0.00 -1.12 0.00 0.00 38.32 37.08 1y5l h ASN 53 CO -0.16 1.00 -0.05 -0.07 -1.29 0.00 0.00 177.43 176.87 1y5l h LEU 54 N 0.89 -0.11 0.41 1.61 3.38 -0.55 0.05 115.31 120.99 1y5l h LEU 54 Ca 0.16 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1y5l h LEU 54 Cb 0.52 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1y5l h LEU 54 CO 0.03 0.04 -0.25 0.15 0.09 0.00 0.00 178.44 178.50 1y5l h PHE 55 N -0.26 -0.66 -0.05 1.13 3.04 -1.08 0.12 116.94 119.17 1y5l h PHE 55 Ca -0.01 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.92 1y5l h PHE 55 Cb 0.21 0.24 -0.00 0.00 2.56 0.00 0.00 35.95 38.96 1y5l h PHE 55 CO -0.03 -0.39 0.01 0.45 -2.02 0.00 0.00 178.31 176.33 1y5l h HIS 56 N -0.63 0.09 -0.25 0.41 3.86 -0.95 0.16 115.15 117.84 1y5l h HIS 56 Ca -0.04 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 1y5l h HIS 56 Cb 0.52 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 1y5l h HIS 56 CO -0.10 0.30 0.06 0.82 0.86 0.00 0.00 177.93 179.87 1y5l h ILE 57 N -0.14 1.13 0.35 2.45 2.04 -1.01 0.91 117.51 123.23 1y5l h ILE 57 Ca 0.02 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 1y5l h ILE 57 Cb 0.26 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 1y5l h ILE 57 CO 0.00 0.16 -0.17 1.23 0.00 0.00 0.00 178.15 179.37 1y5l h GLY 58 N 0.57 -0.49 0.89 5.37 0.00 -0.46 -2.60 103.07 106.36 1y5l h GLY 58 Ca 0.09 0.18 0.08 0.00 0.00 0.00 0.00 47.33 47.68 1y5l h GLY 58 CO -0.00 -0.18 0.52 1.19 0.00 0.00 0.00 176.54 178.07 1y5l h ILE 59 N -0.82 0.98 -0.23 2.60 6.09 -0.64 -1.70 117.51 123.79 1y5l h ILE 59 Ca -0.05 -0.27 -0.11 0.00 -1.37 0.00 0.00 64.86 63.06 1y5l h ILE 59 Cb 0.36 0.14 -0.01 0.00 0.47 0.00 0.00 36.82 37.77 1y5l h ILE 59 CO 0.08 0.14 -0.33 -0.07 -3.07 0.00 0.00 178.15 174.90 1y5l h LEU 60 N 0.78 0.51 -0.81 2.19 3.38 -0.91 -2.04 115.31 118.42 1y5l h LEU 60 Ca 0.36 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 1y5l h LEU 60 Cb 0.37 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1y5l h LEU 60 CO -0.13 0.82 -0.20 1.23 0.09 0.00 0.00 178.44 180.24 1y5l h GLY 61 N 1.06 0.73 0.89 0.83 0.00 -0.91 -1.60 103.07 104.07 1y5l h GLY 61 Ca 0.05 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 46.77 1y5l h GLY 61 CO 0.06 0.54 0.09 -2.22 0.00 0.00 0.00 176.54 175.02 1y5l h ILE 62 N 0.60 1.18 -0.15 2.60 1.08 -1.09 -2.90 117.51 118.82 1y5l h ILE 62 Ca 0.09 -0.56 -0.08 0.00 -0.39 0.00 0.00 64.86 63.92 1y5l h ILE 62 Cb 0.67 1.10 -0.01 0.00 -3.07 0.00 0.00 36.82 35.51 1y5l h ILE 62 CO 0.05 0.18 -0.25 -0.26 -0.69 0.00 0.00 178.15 177.18 1y5l h PHE 63 N 0.23 0.30 0.00 1.37 0.04 -1.16 -0.25 116.94 117.47 1y5l h PHE 63 Ca 0.08 -0.05 -0.03 0.00 2.80 0.00 0.00 57.97 60.77 1y5l h PHE 63 Cb 0.20 -0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.27 1y5l h PHE 63 CO -0.00 0.51 -0.12 0.28 -0.60 0.00 0.00 178.31 178.37 1y5l h VAL 64 N 0.25 0.74 0.01 -0.55 2.07 -1.20 -2.80 116.25 114.77 1y5l h VAL 64 Ca 0.04 -0.49 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 1y5l h VAL 64 Cb 0.58 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1y5l h VAL 64 CO 0.04 0.12 -0.11 1.23 0.02 0.00 0.00 177.57 178.87 1y5l h GLY 65 N 0.64 0.06 -6.96 2.17 0.00 -0.90 -3.52 103.07 94.56 1y5l h GLY 65 Ca -0.00 -0.13 -0.59 0.00 0.00 0.00 0.00 47.33 46.61 1y5l h GLY 65 CO 0.02 0.11 1.43 -1.72 0.00 0.00 0.00 176.54 176.38 1y5l n TYR 66 N -4.58 0.15 -1.82 5.60 0.53 -0.47 -5.12 117.16 111.45 1y5l n TYR 66 Ca -0.10 -0.60 -0.01 0.00 -1.02 0.00 0.00 57.90 56.17 1y5l n TYR 66 Cb 0.49 -0.83 0.00 0.00 -1.03 0.00 0.00 39.34 37.97 1y5l n TYR 66 CO 0.00 0.00 0.00 1.47 -1.02 0.00 0.00 176.86 177.31 1y5l n LEU 81 N 8.95 -3.51 -4.68 7.72 -0.00 -1.26 -5.01 117.00 119.22 1y5l n LEU 81 Ca 0.47 0.26 -0.31 0.00 -0.00 0.00 0.00 56.01 56.44 1y5l n LEU 81 Cb 0.42 -1.60 0.15 0.00 -0.00 0.00 0.00 43.42 42.40 1y5l n LEU 81 CO 1.18 -0.72 0.67 -2.16 -0.00 0.00 0.00 177.39 176.37 1y5l s PRO 82 N -0.84 1.16 0.31 1.47 0.04 -1.26 -4.81 135.00 131.06 1y5l s PRO 82 Ca 0.03 1.34 0.08 0.00 0.04 0.00 0.00 61.00 62.49 1y5l s PRO 82 Cb -0.01 -1.76 0.82 0.00 0.04 0.00 0.00 34.50 33.59 1y5l s PRO 82 CO 0.20 -2.47 1.74 0.97 0.04 0.00 0.00 177.00 177.48 1y5l h ILE 83 N -1.74 0.59 0.00 0.56 -0.00 -1.98 -1.22 117.51 113.72 1y5l h ILE 83 Ca -0.45 -0.21 -0.04 0.00 -0.00 0.00 0.00 64.86 64.15 1y5l h ILE 83 Cb 1.27 -0.09 -0.01 0.00 -0.00 0.00 0.00 36.82 37.99 1y5l h ILE 83 CO 0.46 0.11 -0.18 1.05 -0.00 0.00 0.00 178.15 179.59 1y5l h GLU 84 N 0.63 0.00 -0.10 2.19 4.11 -1.86 -2.02 114.58 117.52 1y5l h GLU 84 Ca 0.61 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.86 1y5l h GLU 84 Cb 1.09 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.35 1y5l h GLU 84 CO -0.45 0.18 -0.65 0.28 0.07 0.00 0.00 179.01 178.44 1y5l h VAL 85 N 0.00 1.33 -0.81 -1.06 2.07 -1.57 -2.73 116.25 113.49 1y5l h VAL 85 Ca -0.00 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.58 1y5l h VAL 85 Cb 0.66 2.17 -0.04 0.00 -1.52 0.00 0.00 31.29 32.56 1y5l h VAL 85 CO 0.02 0.59 0.48 0.11 0.02 0.00 0.00 177.57 178.79 1y5l h LYS 86 N 0.27 1.10 -0.60 1.57 1.57 -1.23 -1.07 116.57 118.18 1y5l h LYS 86 Ca -0.05 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.59 1y5l h LYS 86 Cb 1.30 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 33.36 1y5l h LYS 86 CO 0.13 0.78 0.24 0.37 -0.57 0.00 0.00 179.45 180.41 1y5l h GLN 87 N 1.12 0.90 0.32 3.15 4.15 -1.29 0.15 115.11 123.60 1y5l h GLN 87 Ca 0.29 -0.16 -0.02 0.00 0.77 0.00 0.00 58.65 59.53 1y5l h GLN 87 Cb -0.03 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.52 1y5l h GLN 87 CO -0.05 0.76 -0.15 0.87 -1.93 0.00 0.00 178.83 178.33 1y5l h LYS 88 N 0.83 -0.41 -0.48 1.69 1.57 -1.07 -0.10 116.57 118.60 1y5l h LYS 88 Ca 0.20 0.03 0.08 0.00 -1.87 0.00 0.00 60.65 59.09 1y5l h LYS 88 Cb 0.20 0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.53 1y5l h LYS 88 CO -0.02 -0.23 0.10 0.52 -0.57 0.00 0.00 179.45 179.25 1y5l h MET 89 N -0.48 0.23 0.00 3.15 2.86 -1.04 -1.39 114.93 118.25 1y5l h MET 89 Ca -0.04 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 1y5l h MET 89 Cb 0.36 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.97 1y5l h MET 89 CO 0.07 0.15 -0.15 0.00 1.06 0.00 0.00 176.91 178.05 1y5l h ALA 90 N 1.37 1.41 0.05 6.32 0.00 -0.47 0.41 119.26 128.37 1y5l h ALA 90 Ca 0.24 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.79 1y5l h ALA 90 Cb 0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1y5l h ALA 90 CO -0.31 0.18 -1.07 0.52 0.00 0.00 0.00 179.25 178.57 1y5l h MET 91 N 0.00 0.15 0.04 0.00 2.07 0.07 -1.58 114.93 115.68 1y5l h MET 91 Ca -0.00 -0.23 -0.38 0.00 -2.07 0.00 0.00 59.70 57.02 1y5l h MET 91 Cb 0.34 0.08 -0.05 0.00 -1.87 0.00 0.00 31.60 30.10 1y5l h MET 91 CO 0.02 1.08 -2.20 1.19 1.07 0.00 0.00 176.91 178.07 1y5l n PHE 92 N -3.50 0.49 -0.02 -0.22 3.01 -0.89 -2.51 117.46 113.83 1y5l n PHE 92 Ca -0.04 0.13 -0.13 0.00 1.01 0.00 0.00 57.45 58.42 1y5l n PHE 92 Cb 0.94 -1.06 -0.10 0.00 -0.01 0.00 0.00 39.48 39.25 1y5l n PHE 92 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1y5l h ALA 93 N -0.25 0.00 0.00 4.37 0.00 -0.35 -1.62 119.26 121.42 1y5l h ALA 93 Ca -0.53 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.07 1y5l h ALA 93 Cb 1.80 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 1y5l h ALA 93 CO -0.12 -0.24 -0.22 0.78 0.00 0.00 0.00 179.25 179.45 1y5l h GLY 94 N -0.51 0.00 0.59 0.00 0.00 -1.35 -1.46 103.07 100.33 1y5l h GLY 94 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1y5l h GLY 94 CO 0.00 0.00 -0.08 -1.33 0.00 0.00 0.00 176.54 175.13 1y5l h GLY 95 N 1.56 -0.23 0.96 4.60 0.00 -1.34 -1.24 103.07 107.38 1y5l h GLY 95 Ca -0.00 0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 1y5l h GLY 95 CO 0.03 -0.08 -0.22 0.00 0.00 0.00 0.00 176.54 176.26 1y5l h ALA 96 N 0.11 -0.59 -1.00 3.60 0.00 -1.14 -1.36 119.26 118.88 1y5l h ALA 96 Ca -0.02 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 54.87 1y5l h ALA 96 Cb 0.47 0.26 -0.08 0.00 0.00 0.00 0.00 17.79 18.43 1y5l h ALA 96 CO 0.04 -0.84 0.63 0.77 0.00 0.00 0.00 179.25 179.85 1y5l h SER 97 N -0.59 0.95 0.45 0.00 0.02 -1.35 0.39 113.55 113.42 1y5l h SER 97 Ca -0.05 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 1y5l h SER 97 Cb 0.47 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1y5l h SER 97 CO 0.07 0.53 -0.27 1.23 -1.14 0.00 0.00 176.83 177.26 1y5l h GLY 98 N 1.04 0.00 1.20 -3.77 0.00 -0.91 0.26 103.07 100.89 1y5l h GLY 98 Ca 0.48 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.51 1y5l h GLY 98 CO -0.24 0.00 -1.24 -2.08 0.00 0.00 0.00 176.54 172.97 1y5l h VAL 99 N 0.00 1.29 -0.27 4.60 2.07 0.15 -0.73 116.25 123.36 1y5l h VAL 99 Ca -0.00 -2.48 -0.03 0.00 0.82 0.00 0.00 66.70 65.01 1y5l h VAL 99 Cb 0.57 2.75 -0.01 0.00 -1.52 0.00 0.00 31.29 33.08 1y5l h VAL 99 CO 0.03 0.75 0.06 -0.07 0.02 0.00 0.00 177.57 178.37 1y5l h LEU 100 N 0.23 0.41 -0.20 2.57 4.07 -0.79 -2.04 115.31 119.56 1y5l h LEU 100 Ca -0.19 -0.23 0.00 0.00 0.08 0.00 0.00 57.88 57.54 1y5l h LEU 100 Cb 1.92 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 43.55 1y5l h LEU 100 CO 0.24 0.54 0.13 0.00 -1.08 0.00 0.00 178.44 178.26 1y5l h LEU 102 N 0.26 0.58 -0.08 0.00 5.85 -1.05 0.16 115.31 121.03 1y5l h LEU 102 Ca 0.08 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1y5l h LEU 102 Cb -0.02 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 40.86 1y5l h LEU 102 CO -0.02 0.55 -0.02 0.40 -0.34 0.00 0.00 178.44 179.01 1y5l h ILE 103 N 0.63 1.29 0.09 4.05 1.08 -1.09 -0.86 117.51 122.69 1y5l h ILE 103 Ca 0.15 -0.92 -0.00 0.00 -0.39 0.00 0.00 64.86 63.70 1y5l h ILE 103 Cb 0.18 1.73 -0.00 0.00 -3.07 0.00 0.00 36.82 35.66 1y5l h ILE 103 CO -0.01 0.26 -0.06 1.23 -0.69 0.00 0.00 178.15 178.88 1y5l h GLY 104 N -0.17 -0.14 0.58 5.37 0.00 -0.84 -0.85 103.07 107.02 1y5l h GLY 104 Ca 0.02 0.06 0.04 0.00 0.00 0.00 0.00 47.33 47.45 1y5l h GLY 104 CO 0.01 -0.06 -0.09 -1.33 0.00 0.00 0.00 176.54 175.07 1y5l h GLY 105 N -0.14 0.03 0.71 4.60 0.00 -0.71 0.22 103.07 107.79 1y5l h GLY 105 Ca -0.01 0.11 0.05 0.00 0.00 0.00 0.00 47.33 47.49 1y5l h GLY 105 CO 0.00 -0.11 0.40 -2.08 0.00 0.00 0.00 176.54 174.76 1y5l h VAL 106 N -0.09 1.00 -0.68 4.60 2.07 -0.99 0.00 116.25 122.17 1y5l h VAL 106 Ca 0.09 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 1y5l h VAL 106 Cb 0.22 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 1y5l h VAL 106 CO -0.20 0.14 0.23 -0.07 0.02 0.00 0.00 177.57 177.68 1y5l h LEU 107 N 0.75 0.97 -1.24 2.57 3.38 -0.44 -1.10 115.31 120.20 1y5l h LEU 107 Ca 0.31 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1y5l h LEU 107 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1y5l h LEU 107 CO -0.17 0.91 -0.26 -0.07 0.09 0.00 0.00 178.44 178.94 1y5l h LEU 108 N 0.98 0.18 -0.09 1.67 3.38 0.20 -2.24 115.31 119.40 1y5l h LEU 108 Ca 0.22 -0.05 -0.25 0.00 0.09 0.00 0.00 57.88 57.89 1y5l h LEU 108 Cb 0.27 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.98 1y5l h LEU 108 CO -0.01 0.45 -1.01 0.25 0.09 0.00 0.00 178.44 178.21 1y5l h LEU 109 N 0.17 0.66 -0.84 1.67 5.85 -0.60 -1.68 115.31 120.54 1y5l h LEU 109 Ca 0.03 -0.54 -0.06 0.00 0.84 0.00 0.00 57.88 58.15 1y5l h LEU 109 Cb 0.56 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 1y5l h LEU 109 CO 0.04 1.35 0.19 0.50 -0.34 0.00 0.00 178.44 180.17 1y5l h LYS 110 N 0.27 1.05 -0.19 1.25 3.64 -1.06 -0.91 116.57 120.62 1y5l h LYS 110 Ca -0.11 -0.23 -0.06 0.00 -1.27 0.00 0.00 60.65 58.99 1y5l h LYS 110 Cb 1.66 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 33.33 1y5l h LYS 110 CO 0.18 0.91 -0.12 -0.09 -2.27 0.00 0.00 179.45 178.07 1y5l h ARG 111 N 1.01 0.41 -0.86 1.90 2.43 -1.39 -0.82 114.38 117.07 1y5l h ARG 111 Ca 0.22 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 1y5l h ARG 111 Cb 0.32 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.82 1y5l h ARG 111 CO -0.00 0.73 0.42 -0.09 -1.51 0.00 0.00 179.97 179.51 1y5l h ARG 112 N 0.09 1.23 0.09 0.20 2.43 -1.07 0.86 114.38 118.20 1y5l h ARG 112 Ca 0.04 -0.18 -0.26 0.00 -0.81 0.00 0.00 59.98 58.77 1y5l h ARG 112 Cb 0.62 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 1y5l h ARG 112 CO 0.03 0.94 -1.25 -0.07 -1.51 0.00 0.00 179.97 178.11 1y5l h LEU 113 N 1.22 0.28 -0.35 3.80 3.38 -1.17 -3.05 115.31 119.43 1y5l h LEU 113 Ca 0.29 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1y5l h LEU 113 Cb 0.11 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1y5l h LEU 113 CO -0.04 1.26 -0.23 0.49 0.09 0.00 0.00 178.44 180.02 1y5l n PHE 114 N -3.45 0.00 -2.79 1.13 3.72 -0.32 -4.82 117.46 110.93 1y5l n PHE 114 Ca -0.08 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.90 1y5l n PHE 114 Cb 1.01 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.51 1y5l n PHE 114 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1y5l s SER 115 N -1.35 6.18 0.09 4.37 0.15 0.29 -4.93 113.70 118.50 1y5l s SER 115 Ca 0.04 -0.90 -0.07 0.00 0.70 0.00 0.00 55.95 55.72 1y5l s SER 115 Cb 0.05 -2.45 0.09 0.00 -1.71 0.00 0.00 66.02 62.00 1y5l s SER 115 CO 0.22 -1.52 0.63 -0.81 1.20 0.00 0.00 173.24 172.96 1y5l n PRO 116 N 8.05 -0.10 -0.20 5.44 -0.04 -1.26 0.16 135.00 147.05 1y5l n PRO 116 Ca -0.02 0.62 -0.06 0.00 -0.04 0.00 0.00 63.50 64.00 1y5l n PRO 116 Cb 0.46 -0.92 0.10 0.00 -0.04 0.00 0.00 33.50 33.10 1y5l n PRO 116 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y5l h ARG 117 N 0.00 1.01 -0.06 0.54 3.08 -1.92 -0.39 114.38 116.65 1y5l h ARG 117 Ca 0.13 -0.25 -0.14 0.00 0.07 0.00 0.00 59.98 59.80 1y5l h ARG 117 Cb 0.24 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 30.16 1y5l h ARG 117 CO -0.40 0.92 -0.51 0.28 -1.07 0.00 0.00 179.97 179.19 1y5l h VAL 118 N 0.95 1.40 -0.71 2.04 2.07 -0.58 -3.06 116.25 118.37 1y5l h VAL 118 Ca 0.20 -1.91 -0.05 0.00 0.82 0.00 0.00 66.70 65.75 1y5l h VAL 118 Cb 0.39 2.38 -0.03 0.00 -1.52 0.00 0.00 31.29 32.51 1y5l h VAL 118 CO 0.01 0.56 0.23 -0.09 0.02 0.00 0.00 177.57 178.30 1y5l h ARG 119 N -0.02 1.08 0.00 1.57 9.65 -0.94 -2.08 114.38 123.65 1y5l h ARG 119 Ca -0.05 -0.22 -0.04 0.00 -1.10 0.00 0.00 59.98 58.57 1y5l h ARG 119 Cb 1.18 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 29.60 1y5l h ARG 119 CO 0.10 0.92 -0.20 0.00 2.80 0.00 0.00 179.97 183.59 1y5l h ALA 120 N 1.20 1.11 -0.21 2.80 0.00 -1.12 -3.14 119.26 119.89 1y5l h ALA 120 Ca 0.23 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1y5l h ALA 120 Cb 0.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1y5l h ALA 120 CO -0.01 0.25 0.00 0.25 0.00 0.00 0.00 179.25 179.74 1y5l n THR 121 N -3.49 1.40 -2.54 0.00 -2.24 -1.10 -5.03 114.28 101.29 1y5l n THR 121 Ca -0.01 -1.35 -0.27 0.00 -2.27 0.00 0.00 64.05 60.15 1y5l n THR 121 Cb 0.37 0.24 0.01 0.00 -2.10 0.00 0.00 70.33 68.84 1y5l n THR 121 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1y5l s THR 122 N -1.64 4.63 0.34 4.28 -1.32 -0.80 -5.06 115.64 116.06 1y5l s THR 122 Ca 0.23 0.19 0.08 0.00 -1.21 0.00 0.00 61.69 60.98 1y5l s THR 122 Cb 0.16 -3.78 -0.03 0.00 -1.51 0.00 0.00 72.50 67.34 1y5l s THR 122 CO 0.09 -0.78 0.23 0.42 -2.21 0.00 0.00 174.62 172.37 1y5l s THR 123 N -2.82 3.34 0.14 5.08 -4.23 -1.26 -5.04 115.64 110.85 1y5l s THR 123 Ca 0.49 -1.50 -0.16 0.00 -1.18 0.00 0.00 61.69 59.34 1y5l s THR 123 Cb -0.10 -3.10 0.00 0.00 1.34 0.00 0.00 72.50 70.64 1y5l s THR 123 CO 0.45 -0.18 1.71 1.23 -0.54 0.00 0.00 174.62 177.29 1y5l h GLY 124 N 1.38 0.64 1.06 3.99 0.00 -2.00 -2.81 103.07 105.33 1y5l h GLY 124 Ca -0.44 -0.33 0.12 0.00 0.00 0.00 0.00 47.33 46.69 1y5l h GLY 124 CO 0.60 0.31 0.35 0.00 0.00 0.00 0.00 176.54 177.80 1y5l h ALA 125 N 1.04 2.29 -0.14 3.60 0.00 -1.96 0.12 119.26 124.21 1y5l h ALA 125 Ca 0.14 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1y5l h ALA 125 Cb 0.14 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1y5l h ALA 125 CO -0.02 -0.57 -0.54 -0.44 0.00 0.00 0.00 179.25 177.68 1y5l h ASP 126 N 0.00 0.46 0.14 0.00 3.32 -1.91 0.32 116.42 118.75 1y5l h ASP 126 Ca 0.20 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1y5l h ASP 126 Cb 0.90 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1y5l h ASP 126 CO -0.00 0.91 -0.07 0.40 -1.72 0.00 0.00 179.24 178.76 1y5l h ILE 127 N 0.32 0.99 0.10 0.35 1.08 -0.85 -2.86 117.51 116.64 1y5l h ILE 127 Ca 0.01 -1.12 0.02 0.00 -0.39 0.00 0.00 64.86 63.38 1y5l h ILE 127 Cb 1.05 1.63 -0.03 0.00 -3.07 0.00 0.00 36.82 36.39 1y5l h ILE 127 CO 0.09 0.24 -0.25 0.25 -0.69 0.00 0.00 178.15 177.80 1y5l h LEU 128 N -0.77 -0.71 -0.91 1.44 5.85 -1.17 0.60 115.31 119.64 1y5l h LEU 128 Ca -0.02 0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 1y5l h LEU 128 Cb 0.54 0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 1y5l h LEU 128 CO 0.03 -0.33 0.29 -0.29 -0.34 0.00 0.00 178.44 177.80 1y5l h ILE 129 N -0.44 1.25 -0.03 4.05 -0.00 -1.06 -1.24 117.51 120.04 1y5l h ILE 129 Ca 0.03 -0.78 -0.15 0.00 -0.00 0.00 0.00 64.86 63.96 1y5l h ILE 129 Cb 0.48 0.37 -0.02 0.00 -0.00 0.00 0.00 36.82 37.65 1y5l h ILE 129 CO -0.15 0.32 -0.68 0.25 -0.00 0.00 0.00 178.15 177.89 1y5l h LEU 130 N 1.07 0.16 -0.20 2.19 5.85 -1.32 -2.57 115.31 120.48 1y5l h LEU 130 Ca 0.25 -0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 1y5l h LEU 130 Cb 0.20 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 1y5l h LEU 130 CO -0.02 0.78 -0.18 0.28 -0.34 0.00 0.00 178.44 178.96 1y5l h SER 131 N 0.09 0.51 -0.05 1.25 0.02 -0.55 -2.24 113.55 112.57 1y5l h SER 131 Ca -0.01 -0.47 -0.02 0.00 -0.84 0.00 0.00 61.79 60.45 1y5l h SER 131 Cb 1.20 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 1y5l h SER 131 CO 0.10 0.87 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.57 1y5l h LEU 132 N 0.16 0.18 -0.30 5.07 3.38 -1.22 -0.94 115.31 121.64 1y5l h LEU 132 Ca 0.03 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.78 1y5l h LEU 132 Cb 0.72 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1y5l h LEU 132 CO 0.05 0.24 -0.78 -0.07 0.09 0.00 0.00 178.44 177.96 1y5l h LEU 133 N 0.20 0.62 -0.59 1.67 3.38 -1.36 0.13 115.31 119.36 1y5l h LEU 133 Ca 0.05 -0.42 -0.13 0.00 0.09 0.00 0.00 57.88 57.46 1y5l h LEU 133 Cb 0.17 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1y5l h LEU 133 CO 0.00 1.19 -0.33 0.58 0.09 0.00 0.00 178.44 179.97 1y5l h VAL 134 N 0.34 1.28 -0.16 1.22 2.07 -0.82 0.17 116.25 120.35 1y5l h VAL 134 Ca -0.05 -1.48 -0.04 0.00 0.82 0.00 0.00 66.70 65.95 1y5l h VAL 134 Cb 1.38 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 32.52 1y5l h VAL 134 CO 0.14 0.49 -0.05 0.40 0.02 0.00 0.00 177.57 178.57 1y5l h ILE 135 N 0.64 1.29 -0.16 4.57 1.08 -1.13 -0.76 117.51 123.04 1y5l h ILE 135 Ca 0.07 -1.03 0.02 0.00 -0.39 0.00 0.00 64.86 63.53 1y5l h ILE 135 Cb 0.87 1.64 -0.01 0.00 -3.07 0.00 0.00 36.82 36.25 1y5l h ILE 135 CO 0.08 0.30 0.11 -0.61 -0.69 0.00 0.00 178.15 177.34 1y5l h GLN 136 N 0.01 0.15 0.15 2.37 5.75 -0.53 0.10 115.11 123.12 1y5l h GLN 136 Ca 0.04 -0.01 -0.29 0.00 -0.15 0.00 0.00 58.65 58.24 1y5l h GLN 136 Cb 0.49 -0.03 0.02 0.00 1.07 0.00 0.00 27.48 29.02 1y5l h GLN 136 CO 0.02 0.10 -1.29 0.00 -2.65 0.00 0.00 178.83 175.01 1y5l h ALA 138 N 0.46 0.47 0.30 0.00 0.00 -0.34 -2.32 119.26 117.84 1y5l h ALA 138 Ca -0.17 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1y5l h ALA 138 Cb 2.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.65 1y5l h ALA 138 CO 0.22 0.25 -0.22 -0.07 0.00 0.00 0.00 179.25 179.43 1y5l h LEU 139 N 0.43 -0.57 -0.89 0.00 3.38 -0.88 -1.20 115.31 115.58 1y5l h LEU 139 Ca 0.10 0.04 0.25 0.00 0.09 0.00 0.00 57.88 58.36 1y5l h LEU 139 Cb 0.47 0.18 -0.15 0.00 0.09 0.00 0.00 40.66 41.26 1y5l h LEU 139 CO 0.02 -0.34 0.23 1.23 0.09 0.00 0.00 178.44 179.67 1y5l h GLY 140 N -0.52 1.39 1.17 0.83 0.00 -1.28 0.34 103.07 104.99 1y5l h GLY 140 Ca -0.02 -0.02 -0.14 0.00 0.00 0.00 0.00 47.33 47.15 1y5l h GLY 140 CO 0.00 -0.40 -0.30 1.41 0.00 0.00 0.00 176.54 177.25 1y5l h LEU 141 N 0.18 0.97 -2.50 3.11 3.38 -1.01 -2.93 115.31 116.51 1y5l h LEU 141 Ca 0.57 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1y5l h LEU 141 Cb 1.17 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 1y5l h LEU 141 CO -0.69 1.19 -0.02 -0.07 0.09 0.00 0.00 178.44 178.94 1y5l h LEU 142 N 0.78 0.00 -0.61 1.67 4.07 0.87 -1.52 115.31 120.57 1y5l h LEU 142 Ca 0.09 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.04 1y5l h LEU 142 Cb 0.87 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.61 1y5l h LEU 142 CO 0.08 0.02 -0.02 0.71 -1.08 0.00 0.00 178.44 178.15 1y5l h THR 143 N 0.00 0.04 -0.04 0.22 1.35 -1.12 -3.33 112.91 110.03 1y5l h THR 143 Ca -0.00 -0.85 0.03 0.00 -0.55 0.00 0.00 66.41 65.04 1y5l h THR 143 Cb 0.14 1.81 -0.06 0.00 -1.73 0.00 0.00 68.15 68.31 1y5l h THR 143 CO 0.00 0.02 -0.46 0.40 -0.25 0.00 0.00 175.52 175.23 1y5l h ILE 144 N 0.00 0.10 -0.09 6.82 1.08 -1.37 -0.22 117.51 123.82 1y5l h ILE 144 Ca -0.00 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.50 1y5l h ILE 144 Cb 0.81 0.10 -0.00 0.00 -3.07 0.00 0.00 36.82 34.65 1y5l h ILE 144 CO 0.00 0.00 0.14 1.55 -0.69 0.00 0.00 178.15 179.15 1y5l h PRO 145 N -0.59 0.00 0.20 2.37 0.13 -1.77 -1.50 132.00 130.85 1y5l h PRO 145 Ca 0.04 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.86 1y5l h PRO 145 Cb 0.67 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.83 1y5l h PRO 145 CO -0.35 0.00 -1.39 0.74 -0.23 0.00 0.00 178.00 176.77 1y5l h PHE 146 N 0.00 0.78 0.00 1.56 0.04 -1.31 -3.19 116.94 114.82 1y5l h PHE 146 Ca 0.04 -0.57 0.00 0.00 2.80 0.00 0.00 57.97 60.24 1y5l h PHE 146 Cb 0.31 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.43 1y5l h PHE 146 CO 0.00 1.45 0.00 0.43 -0.60 0.00 0.00 178.31 179.59 1y5l n SER 147 N -3.64 0.45 0.20 2.17 7.64 -0.25 -2.83 113.62 117.36 1y5l n SER 147 Ca -0.13 0.56 0.14 0.00 1.01 0.00 0.00 58.87 60.45 1y5l n SER 147 Cb 1.07 -0.67 0.49 0.00 -1.01 0.00 0.00 64.21 64.09 1y5l n SER 147 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y5l h ALA 148 N 2.62 1.00 -0.03 -0.43 0.00 -1.29 -2.58 119.26 118.56 1y5l h ALA 148 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1y5l h ALA 148 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1y5l h ALA 148 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.29 1y5l n GLN 149 N -2.70 1.63 -3.09 0.00 6.02 -1.13 -4.13 117.38 113.99 1y5l n GLN 149 Ca 0.02 -0.93 -0.16 0.00 -0.01 0.00 0.00 57.00 55.93 1y5l n GLN 149 Cb 0.35 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 30.12 1y5l n GLN 149 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1y5l n HIS 150 N 0.13 0.26 0.07 1.08 8.25 -0.97 -4.93 115.22 119.10 1y5l n HIS 150 Ca 0.19 -3.60 0.04 0.00 -0.26 0.00 0.00 57.72 54.09 1y5l n HIS 150 Cb 0.34 -0.36 0.19 0.00 1.12 0.00 0.00 29.99 31.28 1y5l n HIS 150 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1y5l n MET 151 N 0.22 0.04 0.00 -0.41 2.81 -1.24 -0.69 117.12 117.85 1y5l n MET 151 Ca 0.22 0.53 0.12 0.00 -1.81 0.00 0.00 57.70 56.76 1y5l n MET 151 Cb 0.69 -1.64 0.73 0.00 -0.71 0.00 0.00 33.22 32.29 1y5l n MET 151 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1y5l n ASP 152 N -1.73 0.00 -0.28 7.83 5.75 -1.26 -4.77 116.55 122.09 1y5l n ASP 152 Ca -0.00 -1.10 -0.04 0.00 -0.01 0.00 0.00 54.79 53.64 1y5l n ASP 152 Cb 0.02 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.09 1y5l n ASP 152 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1y5l n GLY 153 N 0.79 0.65 0.30 6.12 0.00 0.13 -4.44 105.19 108.74 1y5l n GLY 153 Ca 0.18 -0.43 -0.04 0.00 0.00 0.00 0.00 46.02 45.73 1y5l n GLY 153 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1y5l h SER 154 N 0.00 0.90 0.64 1.61 4.64 -1.89 -0.17 113.55 119.27 1y5l h SER 154 Ca -0.08 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.18 1y5l h SER 154 Cb 0.38 -0.23 0.01 0.00 -0.31 0.00 0.00 62.40 62.25 1y5l h SER 154 CO 0.11 0.66 -0.31 -0.33 -0.87 0.00 0.00 176.83 176.10 1y5l h GLU 155 N 1.05 -0.82 -0.99 4.77 4.39 -1.92 -2.81 114.58 118.25 1y5l h GLU 155 Ca 0.28 0.06 0.21 0.00 0.34 0.00 0.00 59.36 60.25 1y5l h GLU 155 Cb -0.10 0.19 -0.09 0.00 -0.10 0.00 0.00 28.75 28.64 1y5l h GLU 155 CO -0.06 -0.52 0.62 1.98 -1.16 0.00 0.00 179.01 179.87 1y5l h MET 156 N -0.96 0.58 -0.36 2.33 4.05 -1.86 -1.39 114.93 117.32 1y5l h MET 156 Ca -0.09 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.30 1y5l h MET 156 Cb 0.69 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 31.34 1y5l h MET 156 CO 0.14 0.38 0.23 1.98 0.23 0.00 0.00 176.91 179.88 1y5l h MET 157 N 0.60 0.48 0.06 0.39 1.85 -0.79 -1.35 114.93 116.17 1y5l h MET 157 Ca 0.56 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 59.61 1y5l h MET 157 Cb 1.10 -0.11 -0.00 0.00 0.43 0.00 0.00 31.60 33.02 1y5l h MET 157 CO -0.32 0.33 -0.05 0.87 -0.40 0.00 0.00 176.91 177.34 1y5l h LYS 158 N 0.48 -0.12 -0.71 0.39 1.57 -1.02 -0.18 116.57 116.98 1y5l h LYS 158 Ca 0.13 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.98 1y5l h LYS 158 Cb -0.04 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.24 1y5l h LYS 158 CO -0.03 -0.08 0.40 -0.07 -0.57 0.00 0.00 179.45 179.10 1y5l h LEU 159 N -0.12 0.60 -0.77 2.94 -0.00 -1.37 -0.83 115.31 115.76 1y5l h LEU 159 Ca -0.00 0.03 -0.07 0.00 -0.00 0.00 0.00 57.88 57.84 1y5l h LEU 159 Cb 0.11 -0.09 -0.03 0.00 -0.00 0.00 0.00 40.66 40.66 1y5l h LEU 159 CO -0.01 0.38 0.11 0.58 -0.00 0.00 0.00 178.44 179.50 1y5l h VAL 160 N 0.73 1.26 -0.40 1.22 2.07 -0.95 -1.80 116.25 118.37 1y5l h VAL 160 Ca 0.32 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.85 1y5l h VAL 160 Cb 0.21 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1y5l h VAL 160 CO -0.19 0.37 0.25 1.23 0.02 0.00 0.00 177.57 179.25 1y5l h GLY 161 N 1.05 0.58 0.82 2.17 0.00 -0.05 -0.87 103.07 106.76 1y5l h GLY 161 Ca 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 1y5l h GLY 161 CO 0.01 0.22 -0.38 -0.25 0.00 0.00 0.00 176.54 176.14 1y5l h TRP 162 N 0.54 -1.01 -0.58 5.60 7.01 -0.97 -1.66 115.95 124.86 1y5l h TRP 162 Ca 0.15 -0.01 0.12 0.00 2.11 0.00 0.00 58.89 61.26 1y5l h TRP 162 Cb -0.02 0.36 -0.10 0.00 -2.10 0.00 0.00 29.16 27.30 1y5l h TRP 162 CO -0.04 -0.57 -0.01 0.00 -2.79 0.00 0.00 178.44 175.03 1y5l h ALA 163 N -0.62 0.55 -0.56 2.65 0.00 -1.19 -0.30 119.26 119.80 1y5l h ALA 163 Ca -0.07 0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1y5l h ALA 163 Cb 0.76 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1y5l h ALA 163 CO 0.06 -0.39 0.14 1.96 0.00 0.00 0.00 179.25 181.02 1y5l h GLN 164 N 0.11 0.86 -0.57 0.00 4.20 -1.04 -1.48 115.11 117.19 1y5l h GLN 164 Ca 0.30 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 1y5l h GLN 164 Cb 0.48 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 1y5l h GLN 164 CO -0.51 0.77 0.08 0.77 -0.67 0.00 0.00 178.83 179.28 1y5l h SER 165 N 0.83 0.91 -0.16 1.46 0.02 -0.24 -2.27 113.55 114.10 1y5l h SER 165 Ca 0.18 -0.26 -0.02 0.00 -0.84 0.00 0.00 61.79 60.85 1y5l h SER 165 Cb 0.29 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 1y5l h SER 165 CO -0.00 0.95 0.04 0.58 -1.14 0.00 0.00 176.83 177.25 1y5l h VAL 166 N 0.84 1.21 0.00 2.27 2.07 -0.68 0.22 116.25 122.19 1y5l h VAL 166 Ca 0.17 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1y5l h VAL 166 Cb 0.43 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1y5l h VAL 166 CO 0.01 0.20 0.00 -0.37 0.02 0.00 0.00 177.57 177.43 1y5l h VAL 167 N 0.07 0.00 -0.35 2.57 -1.51 -1.28 -2.53 116.25 113.22 1y5l h VAL 167 Ca 0.05 -0.55 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 1y5l h VAL 167 Cb 0.28 1.49 0.00 0.00 -2.13 0.00 0.00 31.29 30.92 1y5l h VAL 167 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.69 1y5l n THR 168 N -2.78 0.44 -3.57 7.19 -2.24 -0.86 -4.96 114.28 107.50 1y5l n THR 168 Ca 0.02 -0.67 -0.19 0.00 -2.27 0.00 0.00 64.05 60.94 1y5l n THR 168 Cb 0.35 0.88 0.06 0.00 -2.10 0.00 0.00 70.33 69.52 1y5l n THR 168 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1y5l n PHE 169 N 1.28 -2.04 -3.73 4.78 3.01 -0.93 -4.98 117.46 114.86 1y5l n PHE 169 Ca 0.19 0.88 -0.38 0.00 1.01 0.00 0.00 57.45 59.15 1y5l n PHE 169 Cb 0.56 -4.69 -0.12 0.00 -0.01 0.00 0.00 39.48 35.22 1y5l n PHE 169 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 1y5l s HIS 170 N -3.53 3.24 0.81 1.38 2.46 0.74 -5.04 115.29 115.36 1y5l s HIS 170 Ca 0.01 -1.31 -0.14 0.00 0.47 0.00 0.00 55.06 54.09 1y5l s HIS 170 Cb -0.00 -2.30 0.02 0.00 -0.13 0.00 0.00 32.58 30.17 1y5l s HIS 170 CO 0.78 -0.70 0.70 0.41 -2.47 0.00 0.00 174.74 173.46 1y5l n GLY 171 N 4.84 -1.19 1.33 1.59 0.00 -1.26 -3.62 105.19 106.88 1y5l n GLY 171 Ca -0.13 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1y5l n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y5l n GLY 172 N 1.27 0.75 0.34 -0.02 0.00 -1.26 -4.97 105.19 101.30 1y5l n GLY 172 Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.25 1y5l n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y5l n ALA 173 N -0.40 0.45 0.33 4.61 0.00 -1.24 -0.22 120.51 124.05 1y5l n ALA 173 Ca 0.00 1.06 0.21 0.00 0.00 0.00 0.00 53.44 54.71 1y5l n ALA 173 Cb 0.00 -0.75 1.11 0.00 0.00 0.00 0.00 19.45 19.82 1y5l n ALA 173 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1y5l h SER 174 N 0.00 0.00 -0.62 0.00 4.64 -1.92 -2.05 113.55 113.60 1y5l h SER 174 Ca 0.57 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.83 1y5l h SER 174 Cb 1.13 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.19 1y5l h SER 174 CO -0.94 0.00 0.17 1.56 -0.87 0.00 0.00 176.83 176.75 1y5l h GLN 175 N 0.00 1.02 -0.39 4.77 4.20 -0.99 -1.85 115.11 121.87 1y5l h GLN 175 Ca 0.00 -0.23 0.10 0.00 0.06 0.00 0.00 58.65 58.59 1y5l h GLN 175 Cb 0.15 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 1y5l h GLN 175 CO 0.00 0.90 0.28 0.45 -0.67 0.00 0.00 178.83 179.78 1y5l h HIS 176 N 0.97 0.05 -0.00 2.96 3.86 -1.51 0.70 115.15 122.17 1y5l h HIS 176 Ca 0.21 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 1y5l h HIS 176 Cb 0.33 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.79 1y5l h HIS 176 CO 0.02 0.02 0.00 1.28 0.86 0.00 0.00 177.93 180.12 1y5l n LEU 177 N -4.43 0.02 -4.70 2.43 4.77 -0.70 -4.63 117.00 109.76 1y5l n LEU 177 Ca 0.06 -0.01 -0.55 0.00 -0.03 0.00 0.00 56.01 55.48 1y5l n LEU 177 Cb 0.43 -0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.46 1y5l n LEU 177 CO 0.36 0.00 1.36 0.47 -1.33 0.00 0.00 177.39 178.26 1y5l n ASP 178 N -0.70 2.66 -3.42 -1.43 8.00 0.23 -2.70 116.55 119.19 1y5l n ASP 178 Ca 0.10 1.05 -0.18 0.00 0.71 0.00 0.00 54.79 56.47 1y5l n ASP 178 Cb 0.05 -1.20 0.07 0.00 -0.02 0.00 0.00 41.12 40.02 1y5l n ASP 178 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1y5l n GLY 179 N 4.23 -0.63 3.58 0.44 0.00 -1.26 -5.03 105.19 106.52 1y5l n GLY 179 Ca 0.25 0.27 -0.29 0.00 0.00 0.00 0.00 46.02 46.25 1y5l n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y5l s VAL 180 N -3.42 3.39 0.17 1.61 0.11 -1.10 -5.06 120.40 116.11 1y5l s VAL 180 Ca 0.16 -1.30 -0.33 0.00 -2.93 0.00 0.00 61.98 57.58 1y5l s VAL 180 Cb -0.03 -2.60 -0.15 0.00 -1.53 0.00 0.00 36.38 32.07 1y5l s VAL 180 CO 0.75 0.08 1.27 0.00 -3.33 0.00 0.00 175.10 173.87 1y5l n ALA 181 N 0.60 -0.23 -0.22 1.54 0.00 -1.26 -4.83 120.51 116.10 1y5l n ALA 181 Ca -0.13 0.46 0.20 0.00 0.00 0.00 0.00 53.44 53.97 1y5l n ALA 181 Cb 0.53 -2.11 0.54 0.00 0.00 0.00 0.00 19.45 18.41 1y5l n ALA 181 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1y5l h PHE 182 N 3.89 0.46 -0.50 0.00 3.57 -2.00 -1.19 116.94 121.16 1y5l h PHE 182 Ca -0.44 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.12 1y5l h PHE 182 Cb 1.32 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.89 1y5l h PHE 182 CO 0.56 0.12 0.34 0.97 -2.23 0.00 0.00 178.31 178.07 1y5l h ILE 183 N 0.35 1.01 0.00 1.41 2.10 -2.00 0.53 117.51 120.90 1y5l h ILE 183 Ca 0.45 -0.17 -0.05 0.00 1.08 0.00 0.00 64.86 66.17 1y5l h ILE 183 Cb 1.21 0.47 -0.01 0.00 -1.09 0.00 0.00 36.82 37.40 1y5l h ILE 183 CO -0.15 0.09 -0.22 -0.26 -1.08 0.00 0.00 178.15 176.53 1y5l h PHE 184 N 0.50 0.00 0.31 2.19 0.04 -1.56 -2.26 116.94 116.16 1y5l h PHE 184 Ca 0.21 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.97 1y5l h PHE 184 Cb 0.21 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.36 1y5l h PHE 184 CO -0.00 0.22 -0.15 0.00 -0.60 0.00 0.00 178.31 177.78 1y5l h ARG 185 N 0.00 -0.40 -0.32 1.51 2.47 -0.96 -2.31 114.38 114.36 1y5l h ARG 185 Ca -0.00 0.03 0.05 0.00 -1.26 0.00 0.00 59.98 58.80 1y5l h ARG 185 Cb 0.58 0.09 -0.05 0.00 -1.65 0.00 0.00 29.97 28.95 1y5l h ARG 185 CO 0.03 -0.09 0.03 -0.07 0.56 0.00 0.00 179.97 180.43 1y5l h LEU 186 N -0.75 -0.06 -0.75 3.04 3.38 -1.33 -1.19 115.31 117.64 1y5l h LEU 186 Ca -0.04 0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.10 1y5l h LEU 186 Cb 0.50 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.27 1y5l h LEU 186 CO 0.07 0.00 0.38 -0.74 0.09 0.00 0.00 178.44 178.24 1y5l h HIS 187 N 0.13 0.67 -0.45 1.13 2.76 -1.44 0.80 115.15 118.75 1y5l h HIS 187 Ca 0.15 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.26 1y5l h HIS 187 Cb 0.19 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 1y5l h HIS 187 CO -0.21 0.22 -0.08 -0.07 -1.30 0.00 0.00 177.93 176.49 1y5l h LEU 188 N 0.61 0.85 -0.12 0.26 3.38 -0.79 -1.43 115.31 118.06 1y5l h LEU 188 Ca 0.38 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1y5l h LEU 188 Cb 0.45 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1y5l h LEU 188 CO -0.30 1.00 0.04 0.58 0.09 0.00 0.00 178.44 179.85 1y5l h VAL 189 N 0.69 1.18 -0.78 1.22 2.07 -0.40 -1.46 116.25 118.77 1y5l h VAL 189 Ca 0.12 -0.55 -0.04 0.00 0.82 0.00 0.00 66.70 67.05 1y5l h VAL 189 Cb 0.62 1.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 1y5l h VAL 189 CO 0.04 0.16 0.32 0.25 0.02 0.00 0.00 177.57 178.36 1y5l h LEU 190 N 0.02 1.06 -1.04 2.57 5.85 -0.89 -0.59 115.31 122.29 1y5l h LEU 190 Ca 0.04 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.52 1y5l h LEU 190 Cb 0.22 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1y5l h LEU 190 CO -0.00 0.93 -0.27 1.23 -0.34 0.00 0.00 178.44 179.99 1y5l h GLY 191 N 1.15 0.39 1.48 3.75 0.00 -1.11 -1.23 103.07 107.51 1y5l h GLY 191 Ca 0.26 -0.32 -0.24 0.00 0.00 0.00 0.00 47.33 47.03 1y5l h GLY 191 CO -0.02 0.29 -1.01 -0.33 0.00 0.00 0.00 176.54 175.46 1y5l h MET 192 N 0.32 0.45 -0.55 4.80 2.86 -0.94 -3.03 114.93 118.85 1y5l h MET 192 Ca 0.05 -0.52 0.01 0.00 -2.06 0.00 0.00 59.70 57.18 1y5l h MET 192 Cb 0.64 0.16 -0.03 0.00 0.06 0.00 0.00 31.60 32.43 1y5l h MET 192 CO 0.05 1.17 0.36 1.15 1.06 0.00 0.00 176.91 180.70 1y5l h THR 193 N 0.24 1.13 -0.62 2.22 2.02 -0.77 -0.38 112.91 116.75 1y5l h THR 193 Ca -0.10 -0.25 -0.06 0.00 0.77 0.00 0.00 66.41 66.77 1y5l h THR 193 Cb 1.66 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 68.38 1y5l h THR 193 CO 0.18 0.13 0.16 -0.07 0.37 0.00 0.00 175.52 176.29 1y5l h LEU 194 N 0.72 0.91 -0.78 2.58 3.38 -1.12 -1.02 115.31 119.99 1y5l h LEU 194 Ca 0.20 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1y5l h LEU 194 Cb -0.05 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1y5l h LEU 194 CO -0.05 0.88 0.05 -0.26 0.09 0.00 0.00 178.44 179.15 1y5l h PHE 195 N 0.93 1.05 -0.60 1.13 -1.00 -1.03 0.45 116.94 117.87 1y5l h PHE 195 Ca 0.20 -0.15 -0.03 0.00 2.81 0.00 0.00 57.97 60.80 1y5l h PHE 195 Cb 0.32 -0.29 -0.03 0.00 3.61 0.00 0.00 35.95 39.57 1y5l h PHE 195 CO 0.02 0.91 0.26 1.25 -1.61 0.00 0.00 178.31 179.14 1y5l h LEU 196 N 0.92 0.81 -0.09 1.54 5.85 -0.66 -2.53 115.31 121.16 1y5l h LEU 196 Ca 0.18 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1y5l h LEU 196 Cb 0.46 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1y5l h LEU 196 CO 0.02 0.74 -0.13 0.18 -0.34 0.00 0.00 178.44 178.91 1y5l n LEU 197 N -4.49 0.26 0.05 2.25 4.77 -0.44 -4.43 117.00 114.97 1y5l n LEU 197 Ca 0.04 0.20 -0.08 0.00 -0.03 0.00 0.00 56.01 56.14 1y5l n LEU 197 Cb 0.15 -0.31 -0.05 0.00 -2.33 0.00 0.00 43.42 40.88 1y5l n LEU 197 CO 0.38 0.05 0.51 0.15 -1.33 0.00 0.00 177.39 177.15 1y5l h PHE 198 N 0.21 -0.75 0.00 -1.77 3.57 -0.45 -2.48 116.94 115.27 1y5l h PHE 198 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1y5l h PHE 198 Cb 0.42 0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.48 1y5l h PHE 198 CO 0.00 -0.29 0.07 -0.35 -2.23 0.00 0.00 178.31 175.51 1y5l n PRO 199 N -3.92 0.01 -0.42 6.41 -0.04 -1.26 -1.52 135.00 134.26 1y5l n PRO 199 Ca -0.04 0.44 0.09 0.00 -0.04 0.00 0.00 63.50 63.95 1y5l n PRO 199 Cb 0.20 -1.59 0.25 0.00 -0.04 0.00 0.00 33.50 32.32 1y5l n PRO 199 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1y5l n PHE 200 N -1.47 0.88 -4.17 0.54 0.99 -0.94 -4.85 117.46 108.45 1y5l n PHE 200 Ca -0.00 -0.87 -0.11 0.00 -0.00 0.00 0.00 57.45 56.48 1y5l n PHE 200 Cb 0.07 -0.30 -0.04 0.00 -1.00 0.00 0.00 39.48 38.21 1y5l n PHE 200 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1y5l n SER 201 N -0.50 -0.06 0.11 4.37 3.41 -0.58 -5.00 113.62 115.36 1y5l n SER 201 Ca 0.21 -2.13 0.11 0.00 -0.26 0.00 0.00 58.87 56.80 1y5l n SER 201 Cb 0.86 0.80 0.46 0.00 -0.26 0.00 0.00 64.21 66.07 1y5l n SER 201 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1y5l n ARG 202 N -0.36 0.17 0.31 4.33 1.85 -1.26 -3.40 116.66 118.29 1y5l n ARG 202 Ca 0.03 0.39 0.14 0.00 -1.00 0.00 0.00 57.85 57.41 1y5l n ARG 202 Cb 0.31 -1.81 0.76 0.00 -1.05 0.00 0.00 32.46 30.67 1y5l n ARG 202 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 1y5l h LEU 203 N 0.00 0.00 -2.06 2.89 3.38 -1.93 -1.04 115.31 116.55 1y5l h LEU 203 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1y5l h LEU 203 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1y5l h LEU 203 CO 0.00 0.00 0.15 0.16 0.09 0.00 0.00 178.44 178.84 1y5l h ILE 204 N 0.00 0.00 0.00 1.22 -0.00 -1.73 -0.23 117.51 116.76 1y5l h ILE 204 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 64.86 64.84 1y5l h ILE 204 Cb 0.63 0.69 -0.00 0.00 -0.00 0.00 0.00 36.82 38.14 1y5l h ILE 204 CO 0.00 0.00 -0.09 1.12 -0.00 0.00 0.00 178.15 179.18 1y5l h HIS 205 N 0.00 0.00 -0.92 0.16 2.07 -1.45 -1.92 115.15 113.10 1y5l h HIS 205 Ca 0.00 0.00 0.06 0.00 -2.85 0.00 0.00 60.37 57.58 1y5l h HIS 205 Cb 0.29 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 30.21 1y5l h HIS 205 CO 0.00 0.09 0.60 0.82 -3.07 0.00 0.00 177.93 176.37 1y5l h ILE 206 N 0.00 1.07 -0.61 6.12 2.04 -1.28 -0.59 117.51 124.27 1y5l h ILE 206 Ca -0.00 -0.36 0.07 0.00 1.00 0.00 0.00 64.86 65.57 1y5l h ILE 206 Cb 0.17 -0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 36.15 1y5l h ILE 206 CO 0.01 0.19 0.41 -0.50 0.00 0.00 0.00 178.15 178.26 1y5l h TRP 207 N 1.05 0.57 -0.17 1.37 4.06 -1.52 -2.83 115.95 118.47 1y5l h TRP 207 Ca 0.39 0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.36 1y5l h TRP 207 Cb 0.18 -0.19 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1y5l h TRP 207 CO -0.00 0.30 0.00 0.43 -3.56 0.00 0.00 178.44 175.60 1y5l n SER 208 N -4.48 1.07 -4.44 -3.49 7.64 -0.23 -4.93 113.62 104.77 1y5l n SER 208 Ca 0.09 -2.02 -0.56 0.00 1.01 0.00 0.00 58.87 57.39 1y5l n SER 208 Cb 0.27 -0.16 -0.09 0.00 -1.01 0.00 0.00 64.21 63.22 1y5l n SER 208 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1y5l n VAL 209 N 0.03 0.14 -0.12 0.44 3.14 -1.07 -4.73 118.33 116.16 1y5l n VAL 209 Ca 0.06 -0.13 -0.03 0.00 -2.96 0.00 0.00 64.34 61.28 1y5l n VAL 209 Cb 0.18 -1.14 -0.01 0.00 -1.06 0.00 0.00 33.84 31.81 1y5l n VAL 209 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1y5l n PRO 210 N 7.32 0.31 -0.10 1.45 -0.04 -1.26 -4.71 135.00 137.97 1y5l n PRO 210 Ca 0.43 -0.46 -0.10 0.00 -0.04 0.00 0.00 63.50 63.33 1y5l n PRO 210 Cb 0.11 -1.88 -0.02 0.00 -0.04 0.00 0.00 33.50 31.66 1y5l n PRO 210 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 1y5l h VAL 211 N 3.52 1.19 -0.04 0.52 -1.51 -1.99 -2.97 116.25 114.97 1y5l h VAL 211 Ca 0.06 -0.58 0.01 0.00 -1.23 0.00 0.00 66.70 64.96 1y5l h VAL 211 Cb 0.08 0.99 -0.00 0.00 -2.13 0.00 0.00 31.29 30.22 1y5l h VAL 211 CO 0.85 0.20 0.31 1.05 -1.23 0.00 0.00 177.57 178.75 1y5l h GLU 212 N 0.35 0.00 -0.69 5.19 4.11 -1.98 -2.23 114.58 119.33 1y5l h GLU 212 Ca 0.10 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.55 1y5l h GLU 212 Cb 0.20 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 1y5l h GLU 212 CO -0.01 0.00 0.46 -0.92 0.07 0.00 0.00 179.01 178.61 1y5l h TYR 213 N 0.00 0.85 -0.00 2.06 -0.00 -1.92 -2.48 116.97 115.48 1y5l h TYR 213 Ca 0.02 0.02 0.00 0.00 -0.00 0.00 0.00 58.73 58.77 1y5l h TYR 213 Cb 0.63 -0.29 -0.00 0.00 -0.00 0.00 0.00 36.73 37.07 1y5l h TYR 213 CO 0.00 0.53 0.01 -0.07 -0.00 0.00 0.00 178.16 178.63 1y5l h LEU 214 N 0.91 0.00 -2.67 2.82 3.38 -1.61 -2.74 115.31 115.40 1y5l h LEU 214 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1y5l h LEU 214 Cb -0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1y5l h LEU 214 CO -0.06 0.00 -0.01 0.35 0.09 0.00 0.00 178.44 178.81 1y5l n THR 215 N -3.16 0.91 -3.08 0.22 -2.24 -0.97 -5.07 114.28 100.90 1y5l n THR 215 Ca -0.03 -0.95 -0.36 0.00 -2.27 0.00 0.00 64.05 60.45 1y5l n THR 215 Cb 0.08 0.50 -0.06 0.00 -2.10 0.00 0.00 70.33 68.76 1y5l n THR 215 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1y5l s ARG 216 N -1.01 4.24 0.51 -0.78 3.52 -1.02 -5.04 118.95 119.37 1y5l s ARG 216 Ca 0.03 0.88 -0.22 0.00 -0.13 0.00 0.00 55.73 56.29 1y5l s ARG 216 Cb 0.03 -2.80 -0.06 0.00 -1.56 0.00 0.00 34.95 30.56 1y5l s ARG 216 CO 0.00 0.34 1.24 0.15 -0.81 0.00 0.00 175.30 176.22 1y5l s LYS 217 N -2.15 3.44 0.08 5.12 -0.14 -1.26 -4.94 119.74 119.89 1y5l s LYS 217 Ca 0.45 1.94 -0.21 0.00 -1.36 0.00 0.00 55.97 56.80 1y5l s LYS 217 Cb -0.16 -2.29 -0.10 0.00 -1.68 0.00 0.00 37.83 33.61 1y5l s LYS 217 CO 0.21 -0.86 1.61 1.88 -0.76 0.00 0.00 175.35 177.43 1y5l h TYR 218 N 1.68 0.26 -3.20 3.18 0.99 -1.97 -3.43 116.97 114.48 1y5l h TYR 218 Ca -0.50 -0.02 -0.60 0.00 2.00 0.00 0.00 58.73 59.61 1y5l h TYR 218 Cb 1.27 -0.08 -0.09 0.00 1.00 0.00 0.00 36.73 38.84 1y5l h TYR 218 CO 0.50 0.33 -0.29 -0.65 -0.00 0.00 0.00 178.16 178.06 1y5l s GLN 219 N -5.51 4.15 -0.08 4.88 -1.52 -1.26 -5.08 119.66 115.24 1y5l s GLN 219 Ca -0.14 0.19 0.04 0.00 -1.95 0.00 0.00 55.36 53.50 1y5l s GLN 219 Cb 0.07 -3.37 -0.01 0.00 -0.22 0.00 0.00 33.01 29.47 1y5l s GLN 219 CO 0.70 0.35 -0.19 -0.51 -0.25 0.00 0.00 175.29 175.39 1y5l s LEU 220 N 0.11 2.41 -0.06 2.90 1.43 -1.26 -5.11 118.68 119.09 1y5l s LEU 220 Ca 0.19 -0.39 -0.00 0.00 -1.03 0.00 0.00 54.13 52.90 1y5l s LEU 220 Cb -0.14 -1.48 0.03 0.00 0.03 0.00 0.00 46.19 44.62 1y5l s LEU 220 CO 0.06 0.24 -0.02 -0.69 0.23 0.00 0.00 176.35 176.17 1y5l s VAL 221 N -0.13 0.47 -0.22 -1.59 1.01 -1.26 -5.13 120.40 113.54 1y5l s VAL 221 Ca -0.03 -0.01 -0.11 0.00 0.00 0.00 0.00 61.98 61.84 1y5l s VAL 221 Cb -0.14 -0.56 -0.05 0.00 0.00 0.00 0.00 36.38 35.64 1y5l s VAL 221 CO 0.04 0.24 0.16 -0.13 0.00 0.00 0.00 175.10 175.41 1y5l s ARG 222 N 1.45 4.12 1.12 2.72 0.52 -1.26 -5.09 118.95 122.52 1y5l s ARG 222 Ca -0.03 -0.23 -0.17 0.00 -0.52 0.00 0.00 55.73 54.78 1y5l s ARG 222 Cb -0.13 -3.49 0.25 0.00 0.52 0.00 0.00 34.95 32.09 1y5l s ARG 222 CO -0.03 0.15 1.14 0.00 0.02 0.00 0.00 175.30 176.58 1y5l s ALA 223 N 0.80 0.97 0.20 2.13 0.00 -1.26 -4.94 121.76 119.66 1y5l s ALA 223 Ca 0.08 -0.86 -0.31 0.00 0.00 0.00 0.00 51.96 50.87 1y5l s ALA 223 Cb -0.13 -2.92 -0.11 0.00 0.00 0.00 0.00 23.12 19.97 1y5l s ALA 223 CO 0.02 -3.22 1.59 1.03 0.00 0.00 0.00 175.76 175.18 1y5l s ARG 224 N -5.40 4.19 0.00 0.00 0.52 -1.26 -5.36 118.95 111.65 1y5l s ARG 224 Ca 0.70 2.43 0.00 0.00 -0.52 0.00 0.00 55.73 58.34 1y5l s ARG 224 Cb -0.11 -3.11 0.00 0.00 0.52 0.00 0.00 34.95 32.25 1y5l s ARG 224 CO 0.56 -0.61 0.00 1.58 0.02 0.00 0.00 175.30 176.84