#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yst n VAL 2 N 0.00 0.00 0.00 3.17 0.24 -1.26 -5.02 118.33 115.46 1yst n VAL 2 Ca 0.00 -1.10 0.00 0.00 -2.04 0.00 0.00 64.34 61.20 1yst n VAL 2 Cb 0.00 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.23 1yst n VAL 2 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1yst n GLY 3 N -0.70 0.71 3.37 7.63 0.00 -1.26 -5.08 105.19 109.86 1yst n GLY 3 Ca -0.12 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 1yst n GLY 3 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1yst n VAL 4 N 0.00 1.22 -3.91 1.61 0.31 -1.26 -4.94 118.33 111.36 1yst n VAL 4 Ca 0.00 -0.50 -0.11 0.00 -0.01 0.00 0.00 64.34 63.72 1yst n VAL 4 Cb 0.00 -0.23 -0.11 0.00 -0.91 0.00 0.00 33.84 32.58 1yst n VAL 4 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1yst s THR 5 N -1.55 0.07 0.00 2.52 2.01 -1.26 -4.01 115.64 113.41 1yst s THR 5 Ca 0.61 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 62.04 1yst s THR 5 Cb -0.64 -0.27 0.00 0.00 0.01 0.00 0.00 72.50 71.60 1yst s THR 5 CO 0.60 -0.32 0.00 0.00 -0.69 0.00 0.00 174.62 174.22 1yst n ALA 6 N 1.97 0.00 -1.14 7.40 0.00 -1.07 -4.95 120.51 122.72 1yst n ALA 6 Ca -0.20 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 52.79 1yst n ALA 6 Cb 0.56 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.95 1yst n ALA 6 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1yst n PHE 7 N -0.62 0.58 -1.99 0.00 -0.00 -1.26 -3.69 117.46 110.47 1yst n PHE 7 Ca 0.00 0.80 -0.13 0.00 -0.00 0.00 0.00 57.45 58.11 1yst n PHE 7 Cb 0.00 -1.57 0.01 0.00 -0.00 0.00 0.00 39.48 37.92 1yst n PHE 7 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yst n GLY 8 N 1.34 0.02 2.69 7.13 0.00 -1.26 -1.86 105.19 113.25 1yst n GLY 8 Ca 0.16 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.57 1yst n GLY 8 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1yst n ASN 9 N 0.47 -3.68 -4.41 1.61 6.94 -1.24 -4.89 115.26 110.06 1yst n ASN 9 Ca -0.04 0.00 -0.45 0.00 -0.02 0.00 0.00 54.58 54.07 1yst n ASN 9 Cb 0.24 -2.41 -0.02 0.00 -2.36 0.00 0.00 39.78 35.23 1yst n ASN 9 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1yst s PHE 10 N -0.65 3.44 1.28 -2.53 0.08 -0.78 -4.94 117.98 113.88 1yst s PHE 10 Ca 0.00 -1.75 -0.20 0.00 0.12 0.00 0.00 56.93 55.10 1yst s PHE 10 Cb 0.00 -4.12 0.31 0.00 -0.57 0.00 0.00 43.02 38.64 1yst s PHE 10 CO 0.00 -1.29 1.03 -0.51 -0.10 0.00 0.00 175.22 174.35 1yst s ASP 11 N 2.94 0.20 0.22 1.36 1.11 -1.26 -2.60 116.67 118.64 1yst s ASP 11 Ca 0.30 0.80 0.00 0.00 0.18 0.00 0.00 52.55 53.83 1yst s ASP 11 Cb -0.06 -1.15 0.21 0.00 1.07 0.00 0.00 42.92 42.99 1yst s ASP 11 CO -0.08 -4.59 1.56 0.25 1.18 0.00 0.00 175.17 173.50 1yst h LEU 12 N -2.89 0.49 -0.56 1.23 5.85 -1.95 -0.22 115.31 117.26 1yst h LEU 12 Ca -0.46 -0.25 -0.09 0.00 0.84 0.00 0.00 57.88 57.92 1yst h LEU 12 Cb 1.32 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 1yst h LEU 12 CO 0.34 0.91 -0.01 0.00 -0.34 0.00 0.00 178.44 179.35 1yst h ALA 13 N 1.10 0.76 -0.78 1.25 0.00 -1.94 -1.91 119.26 117.75 1yst h ALA 13 Ca 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1yst h ALA 13 Cb 1.01 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1yst h ALA 13 CO 0.09 0.60 0.43 0.77 0.00 0.00 0.00 179.25 181.14 1yst h SER 14 N 0.88 0.96 -0.31 0.00 0.02 -1.72 -2.53 113.55 110.86 1yst h SER 14 Ca 0.16 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1yst h SER 14 Cb 0.55 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 1yst h SER 14 CO 0.03 0.77 0.20 0.25 -1.14 0.00 0.00 176.83 176.94 1yst h LEU 15 N 1.09 0.35 -0.04 5.07 5.85 -0.65 -2.71 115.31 124.27 1yst h LEU 15 Ca 0.28 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.02 1yst h LEU 15 Cb 0.01 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 1yst h LEU 15 CO -0.05 0.25 -0.36 0.00 -0.34 0.00 0.00 178.44 177.95 1yst h ALA 16 N 1.11 -0.52 -0.69 1.25 0.00 -0.93 -2.24 119.26 117.25 1yst h ALA 16 Ca 0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1yst h ALA 16 Cb -0.05 0.65 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 1yst h ALA 16 CO -0.02 -0.87 0.30 -0.84 0.00 0.00 0.00 179.25 177.81 1yst h ILE 17 N -0.49 1.24 -0.85 0.00 -0.00 -1.49 -1.02 117.51 114.90 1yst h ILE 17 Ca 0.07 -0.72 -0.01 0.00 -0.00 0.00 0.00 64.86 64.19 1yst h ILE 17 Cb 0.59 0.43 -0.04 0.00 -0.00 0.00 0.00 36.82 37.80 1yst h ILE 17 CO -0.31 0.29 0.48 0.22 -0.00 0.00 0.00 178.15 178.83 1yst h TYR 18 N 0.97 1.15 -0.66 0.16 3.20 -1.35 -1.94 116.97 118.50 1yst h TYR 18 Ca 0.23 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 1yst h TYR 18 Cb 0.18 -0.37 -0.03 0.00 1.54 0.00 0.00 36.73 38.04 1yst h TYR 18 CO 0.01 0.79 0.30 1.03 -1.64 0.00 0.00 178.16 178.64 1yst h SER 19 N 1.18 0.89 0.45 -2.11 0.87 -1.19 -1.61 113.55 112.03 1yst h SER 19 Ca 0.30 -0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 1yst h SER 19 Cb 0.01 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 1yst h SER 19 CO -0.05 0.79 -0.41 0.15 -0.53 0.00 0.00 176.83 176.78 1yst h PHE 20 N 0.93 -1.12 0.00 2.24 3.57 -0.43 -1.68 116.94 120.45 1yst h PHE 20 Ca 0.23 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.73 1yst h PHE 20 Cb 0.16 0.43 0.00 0.00 2.79 0.00 0.00 35.95 39.33 1yst h PHE 20 CO 0.01 -0.58 0.00 0.91 -2.23 0.00 0.00 178.31 176.42 1yst n TRP 21 N -5.51 0.56 -0.02 0.41 7.02 -0.94 -1.03 117.44 117.93 1yst n TRP 21 Ca -0.11 0.24 -0.17 0.00 -1.02 0.00 0.00 57.50 56.44 1yst n TRP 21 Cb 0.41 -0.88 -0.08 0.00 -2.42 0.00 0.00 31.31 28.34 1yst n TRP 21 CO 0.00 0.00 0.00 0.97 -2.02 0.00 0.00 177.69 176.64 1yst h ILE 22 N 0.00 1.30 0.00 -0.99 -0.00 -0.36 -3.28 117.51 114.18 1yst h ILE 22 Ca 0.00 -1.94 -0.31 0.00 -0.00 0.00 0.00 64.86 62.61 1yst h ILE 22 Cb 0.24 2.05 -0.06 0.00 -0.00 0.00 0.00 36.82 39.05 1yst h ILE 22 CO 0.00 0.61 -2.17 0.33 -0.00 0.00 0.00 178.15 176.92 1yst n PHE 23 N -4.01 0.00 -0.30 2.19 7.35 -0.96 -4.32 117.46 117.40 1yst n PHE 23 Ca -0.08 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.58 1yst n PHE 23 Cb 0.71 -0.84 0.08 0.00 0.35 0.00 0.00 39.48 39.79 1yst n PHE 23 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1yst h LEU 24 N 0.00 0.93 -1.99 -2.13 6.46 -1.29 0.86 115.31 118.15 1yst h LEU 24 Ca -0.46 -0.02 0.19 0.00 -0.12 0.00 0.00 57.88 57.47 1yst h LEU 24 Cb 2.01 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 41.68 1yst h LEU 24 CO 0.01 0.67 0.50 0.00 -0.62 0.00 0.00 178.44 179.00 1yst h ALA 25 N 1.31 2.57 0.07 1.25 0.00 -1.77 0.78 119.26 123.46 1yst h ALA 25 Ca 0.31 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.94 1yst h ALA 25 Cb -0.11 0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.74 1yst h ALA 25 CO -0.07 -0.83 -1.09 0.78 0.00 0.00 0.00 179.25 178.03 1yst h GLY 26 N 0.00 0.42 0.64 0.00 0.00 -1.09 -3.29 103.07 99.74 1yst h GLY 26 Ca 0.31 -0.86 0.03 0.00 0.00 0.00 0.00 47.33 46.81 1yst h GLY 26 CO -0.00 0.76 -0.09 -2.00 0.00 0.00 0.00 176.54 175.20 1yst h LEU 27 N 0.17 -0.29 -0.39 3.11 5.85 0.21 -1.58 115.31 122.40 1yst h LEU 27 Ca -0.11 0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.75 1yst h LEU 27 Cb 1.77 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 42.85 1yst h LEU 27 CO 0.19 -0.13 -0.26 0.40 -0.34 0.00 0.00 178.44 178.30 1yst h ILE 28 N -0.11 0.32 -0.72 4.05 2.04 -1.55 -1.35 117.51 120.18 1yst h ILE 28 Ca 0.07 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.09 1yst h ILE 28 Cb 0.21 0.32 -0.12 0.00 -0.74 0.00 0.00 36.82 36.49 1yst h ILE 28 CO -0.17 0.00 0.07 0.22 0.00 0.00 0.00 178.15 178.28 1yst h TYR 29 N -0.20 0.08 0.63 1.37 3.20 -1.47 0.98 116.97 121.56 1yst h TYR 29 Ca 0.18 0.05 -0.03 0.00 3.14 0.00 0.00 58.73 62.07 1yst h TYR 29 Cb 0.49 0.08 0.01 0.00 1.54 0.00 0.00 36.73 38.84 1yst h TYR 29 CO -0.48 -0.17 -0.30 -0.92 -1.64 0.00 0.00 178.16 174.65 1yst h TYR 30 N 0.16 -0.78 -0.00 -3.82 3.20 -0.33 -1.82 116.97 113.58 1yst h TYR 30 Ca 0.40 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.25 1yst h TYR 30 Cb 0.70 0.26 -0.00 0.00 1.54 0.00 0.00 36.73 39.23 1yst h TYR 30 CO -0.35 -0.48 0.00 1.37 -1.64 0.00 0.00 178.16 177.06 1yst h LEU 31 N -1.06 0.00 -0.30 2.82 8.10 -1.07 0.11 115.31 123.91 1yst h LEU 31 Ca -0.09 0.00 -0.10 0.00 0.11 0.00 0.00 57.88 57.81 1yst h LEU 31 Cb 0.64 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.86 1yst h LEU 31 CO 0.14 0.00 -0.18 -0.61 -4.11 0.00 0.00 178.44 173.68 1yst h GLN 32 N 0.00 0.66 0.10 0.17 5.75 -0.84 0.42 115.11 121.37 1yst h GLN 32 Ca 0.00 -0.30 -0.00 0.00 -0.15 0.00 0.00 58.65 58.19 1yst h GLN 32 Cb 0.01 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1yst h GLN 32 CO -0.00 0.90 -0.05 1.79 -2.65 0.00 0.00 178.83 178.82 1yst h THR 33 N 0.41 0.99 -0.11 2.39 1.35 -0.35 -2.29 112.91 115.31 1yst h THR 33 Ca 0.06 -0.30 0.03 0.00 -0.55 0.00 0.00 66.41 65.65 1yst h THR 33 Cb 0.72 1.19 -0.00 0.00 -1.73 0.00 0.00 68.15 68.32 1yst h THR 33 CO 0.05 0.08 0.14 -0.08 -0.25 0.00 0.00 175.52 175.46 1yst h GLU 34 N -0.27 0.00 0.00 4.72 4.57 -0.72 -1.62 114.58 121.27 1yst h GLU 34 Ca -0.01 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.07 1yst h GLU 34 Cb 0.22 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 1yst h GLU 34 CO 0.02 0.00 -0.45 -0.97 -1.18 0.00 0.00 179.01 176.43 1yst h ASN 35 N 0.00 0.00 -0.84 1.04 -1.24 0.43 -3.30 115.58 111.67 1yst h ASN 35 Ca 0.05 0.00 -0.43 0.00 0.71 0.00 0.00 56.30 56.63 1yst h ASN 35 Cb 0.33 0.00 -0.26 0.00 0.73 0.00 0.00 38.32 39.13 1yst h ASN 35 CO -0.00 0.45 0.54 1.15 -1.29 0.00 0.00 177.43 178.28 1yst n MET 36 N -3.27 2.14 -0.34 6.67 0.00 -0.61 -4.65 117.12 117.07 1yst n MET 36 Ca 0.02 -2.57 0.18 0.00 0.00 0.00 0.00 57.70 55.32 1yst n MET 36 Cb 0.68 -2.01 0.39 0.00 0.00 0.00 0.00 33.22 32.28 1yst n MET 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1yst h ARG 37 N 0.94 0.50 0.00 3.17 2.47 -1.69 -3.40 114.38 116.37 1yst h ARG 37 Ca 0.53 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 59.22 1yst h ARG 37 Cb 2.58 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 30.78 1yst h ARG 37 CO 0.93 0.33 0.00 0.39 0.56 0.00 0.00 179.97 182.18 1yst n GLU 38 N -4.94 1.26 0.00 0.04 1.02 -1.26 -3.28 120.64 113.49 1yst n GLU 38 Ca 0.27 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 1yst n GLU 38 Cb 0.77 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.19 1yst n GLU 38 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yst n GLY 39 N 5.00 0.06 0.60 0.62 0.00 -1.26 -4.12 105.19 106.09 1yst n GLY 39 Ca 0.00 0.33 0.40 0.00 0.00 0.00 0.00 46.02 46.76 1yst n GLY 39 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1yst n TYR 40 N 0.00 0.00 0.14 1.61 4.02 -1.26 -3.28 117.16 118.38 1yst n TYR 40 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.75 1yst n TYR 40 Cb 0.00 -0.37 -0.07 0.00 -0.02 0.00 0.00 39.34 38.88 1yst n TYR 40 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1yst h PRO 41 N 0.00 -0.59 -3.29 -0.72 0.13 -1.85 -3.43 132.00 122.25 1yst h PRO 41 Ca 0.71 0.04 -0.60 0.00 -0.87 0.00 0.00 66.00 65.27 1yst h PRO 41 Cb 3.23 0.13 -0.40 0.00 0.13 0.00 0.00 31.00 34.10 1yst h PRO 41 CO -0.01 -0.39 -0.74 -1.17 -0.23 0.00 0.00 178.00 175.46 1yst s LEU 42 N -10.27 2.65 0.00 1.56 0.20 -1.21 -4.82 118.68 106.79 1yst s LEU 42 Ca -0.16 -2.24 0.06 0.00 0.69 0.00 0.00 54.13 52.47 1yst s LEU 42 Cb 0.07 -1.01 0.12 0.00 -0.43 0.00 0.00 46.19 44.95 1yst s LEU 42 CO 0.64 -0.33 0.96 -1.84 -0.29 0.00 0.00 176.35 175.49 1yst n GLU 43 N 4.06 1.73 -4.60 1.98 0.00 -1.26 -4.99 120.64 117.55 1yst n GLU 43 Ca 0.05 -1.43 -0.33 0.00 0.00 0.00 0.00 57.16 55.45 1yst n GLU 43 Cb 0.38 -1.13 -0.11 0.00 0.00 0.00 0.00 31.44 30.57 1yst n GLU 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1yst s ASN 44 N -0.80 4.46 -0.03 -1.84 4.22 -1.26 -5.03 114.94 114.64 1yst s ASN 44 Ca 0.10 -0.14 0.05 0.00 -2.14 0.00 0.00 52.86 50.73 1yst s ASN 44 Cb 0.06 -1.02 -0.01 0.00 1.28 0.00 0.00 41.25 41.56 1yst s ASN 44 CO 0.08 0.31 -0.18 -1.83 -2.04 0.00 0.00 177.10 173.45 1yst s GLU 45 N -1.12 1.72 0.00 3.55 1.03 -1.26 -5.03 118.70 117.58 1yst s GLU 45 Ca 0.15 -0.64 0.00 0.00 0.03 0.00 0.00 54.97 54.51 1yst s GLU 45 Cb -0.11 -1.54 0.00 0.00 -0.80 0.00 0.00 34.13 31.68 1yst s GLU 45 CO 0.04 0.30 0.28 -0.25 -1.33 0.00 0.00 175.26 174.30 1yst n ASP 46 N 2.97 0.61 0.27 0.83 8.00 -1.26 -3.30 116.55 124.66 1yst n ASP 46 Ca -0.17 -1.04 0.12 0.00 0.71 0.00 0.00 54.79 54.41 1yst n ASP 46 Cb 0.53 -0.26 0.74 0.00 -0.02 0.00 0.00 41.12 42.12 1yst n ASP 46 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1yst h GLY 47 N 3.07 0.00 -5.19 0.44 0.00 -2.06 -3.43 103.07 95.90 1yst h GLY 47 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1yst h GLY 47 CO 0.00 0.00 -0.12 -1.59 0.00 0.00 0.00 176.54 174.83 1yst s THR 48 N -4.45 -0.00 0.00 4.70 2.01 -1.21 -5.20 115.64 111.49 1yst s THR 48 Ca -0.04 0.01 0.00 0.00 0.31 0.00 0.00 61.69 61.97 1yst s THR 48 Cb 0.14 -0.72 0.00 0.00 0.01 0.00 0.00 72.50 71.94 1yst s THR 48 CO 0.60 0.00 0.00 -2.65 -0.69 0.00 0.00 174.62 171.88 1yst n PRO 49 N 2.98 2.25 -4.24 4.92 -0.02 -1.26 -4.72 135.00 134.92 1yst n PRO 49 Ca -0.14 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 60.99 1yst n PRO 49 Cb 0.56 0.00 -0.14 0.00 -0.02 0.00 0.00 33.50 33.90 1yst n PRO 49 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yst s ALA 50 N -2.39 2.75 0.00 3.55 0.00 -1.26 -4.66 121.76 119.75 1yst s ALA 50 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.91 1yst s ALA 50 Cb 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.61 1yst s ALA 50 CO 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 175.76 175.61 1yst n ALA 51 N 4.26 0.00 -1.00 0.00 0.00 -1.26 -5.02 120.51 117.49 1yst n ALA 51 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1yst n ALA 51 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1yst n ALA 51 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1yst n ASN 52 N -0.54 0.00 -2.36 0.00 2.85 -1.26 -5.14 115.26 108.81 1yst n ASN 52 Ca 0.00 0.00 -0.07 0.00 -0.11 0.00 0.00 54.58 54.40 1yst n ASN 52 Cb 0.00 0.00 0.02 0.00 1.24 0.00 0.00 39.78 41.04 1yst n ASN 52 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1yst n GLN 53 N 0.00 0.84 -3.27 1.20 -0.00 -1.26 -5.11 117.38 109.78 1yst n GLN 53 Ca 0.00 -1.72 -0.05 0.00 -0.00 0.00 0.00 57.00 55.23 1yst n GLN 53 Cb 0.00 2.11 -0.05 0.00 -0.00 0.00 0.00 30.24 32.30 1yst n GLN 53 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1yst s GLY 54 N -2.58 -0.68 0.49 2.61 0.00 -1.26 -4.66 107.32 101.24 1yst s GLY 54 Ca 0.13 0.88 -0.22 0.00 0.00 0.00 0.00 44.72 45.50 1yst s GLY 54 CO 0.10 3.04 1.03 -1.05 0.00 0.00 0.00 173.10 176.22 1yst n PRO 55 N 5.38 1.28 -1.84 2.90 -0.02 -1.26 -4.99 135.00 136.45 1yst n PRO 55 Ca -0.01 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1yst n PRO 55 Cb 0.50 -2.14 0.02 0.00 -0.02 0.00 0.00 33.50 31.86 1yst n PRO 55 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1yst n PHE 56 N -0.91 0.09 0.49 6.00 1.16 -1.26 -4.79 117.46 118.25 1yst n PHE 56 Ca 0.10 -1.01 0.02 0.00 -1.87 0.00 0.00 57.45 54.69 1yst n PHE 56 Cb 0.42 0.13 0.09 0.00 -1.61 0.00 0.00 39.48 38.51 1yst n PHE 56 CO 0.00 0.00 0.00 -2.30 -1.87 0.00 0.00 176.76 172.59 1yst n PRO 57 N -0.06 0.25 -1.60 3.97 -0.02 -1.26 -4.86 135.00 131.41 1yst n PRO 57 Ca -0.03 0.00 -0.48 0.00 -2.02 0.00 0.00 63.50 60.98 1yst n PRO 57 Cb 0.95 -1.20 -0.04 0.00 -0.02 0.00 0.00 33.50 33.20 1yst n PRO 57 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1yst n LEU 58 N -0.70 1.90 -4.73 2.45 4.77 -1.26 -4.90 117.00 114.53 1yst n LEU 58 Ca 0.02 1.14 -0.29 0.00 -0.03 0.00 0.00 56.01 56.86 1yst n LEU 58 Cb 0.01 -1.27 0.15 0.00 -2.33 0.00 0.00 43.42 39.99 1yst n LEU 58 CO 0.02 -1.12 0.68 -2.84 -1.33 0.00 0.00 177.39 172.79 1yst s PRO 59 N -0.45 0.82 -0.25 3.23 0.02 -1.26 -5.09 135.00 132.02 1yst s PRO 59 Ca 0.71 0.44 -0.14 0.00 0.02 0.00 0.00 61.00 62.03 1yst s PRO 59 Cb -0.80 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 31.89 1yst s PRO 59 CO 0.52 -2.44 0.32 -1.59 -0.33 0.00 0.00 177.00 173.48 1yst s LYS 60 N -5.10 4.05 1.07 5.54 -2.85 -1.26 -5.08 119.74 116.10 1yst s LYS 60 Ca 0.64 -0.03 -0.14 0.00 -1.00 0.00 0.00 55.97 55.45 1yst s LYS 60 Cb -0.17 -3.62 0.22 0.00 -2.06 0.00 0.00 37.83 32.21 1yst s LYS 60 CO 0.56 -0.17 1.09 -2.14 0.10 0.00 0.00 175.35 174.79 1yst s PRO 61 N 1.72 -0.16 0.29 1.78 0.02 -1.26 -5.12 135.00 132.27 1yst s PRO 61 Ca 0.14 0.36 0.05 0.00 0.02 0.00 0.00 61.00 61.56 1yst s PRO 61 Cb -0.15 -1.68 -0.02 0.00 0.02 0.00 0.00 34.50 32.67 1yst s PRO 61 CO 0.09 -3.09 0.28 1.17 -0.33 0.00 0.00 177.00 175.12 1yst n LYS 62 N -4.40 0.41 -4.11 5.54 4.81 -1.26 -5.17 118.16 113.98 1yst n LYS 62 Ca 0.07 -2.74 -0.22 0.00 -0.87 0.00 0.00 58.31 54.55 1yst n LYS 62 Cb 0.58 2.32 -0.17 0.00 0.02 0.00 0.00 35.03 37.79 1yst n LYS 62 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1yst s THR 63 N -3.06 0.63 -0.50 3.15 2.01 -1.26 -4.52 115.64 112.08 1yst s THR 63 Ca 0.32 -0.13 -0.29 0.00 0.31 0.00 0.00 61.69 61.90 1yst s THR 63 Cb 0.01 -0.66 0.03 0.00 0.01 0.00 0.00 72.50 71.89 1yst s THR 63 CO 0.23 0.26 1.17 -0.36 -0.69 0.00 0.00 174.62 175.23 1yst s PHE 64 N 1.18 2.74 -0.35 4.92 0.08 -0.17 -4.86 117.98 121.52 1yst s PHE 64 Ca -0.07 0.64 -0.25 0.00 0.12 0.00 0.00 56.93 57.37 1yst s PHE 64 Cb -0.14 -4.46 0.01 0.00 -0.57 0.00 0.00 43.02 37.87 1yst s PHE 64 CO -0.01 -1.39 0.90 0.96 -0.10 0.00 0.00 175.22 175.57 1yst s ILE 65 N 4.65 4.63 -0.36 0.64 -0.00 -1.26 -1.70 121.20 127.80 1yst s ILE 65 Ca 0.48 1.20 -0.29 0.00 -0.00 0.00 0.00 60.65 62.04 1yst s ILE 65 Cb -0.07 -4.30 0.01 0.00 -0.00 0.00 0.00 42.46 38.10 1yst s ILE 65 CO 0.31 -0.47 1.22 -0.76 -0.00 0.00 0.00 174.94 175.23 1yst s LEU 66 N 3.36 3.80 -0.54 0.37 1.43 0.56 -4.97 118.68 122.70 1yst s LEU 66 Ca 0.37 0.94 -0.28 0.00 -1.03 0.00 0.00 54.13 54.13 1yst s LEU 66 Cb -0.12 -3.54 0.01 0.00 0.03 0.00 0.00 46.19 42.56 1yst s LEU 66 CO 0.17 -1.12 1.44 -2.84 0.23 0.00 0.00 176.35 174.24 1yst s PRO 67 N 4.20 3.31 0.00 1.29 0.02 -1.26 -3.07 135.00 139.50 1yst s PRO 67 Ca 0.52 0.56 0.00 0.00 0.02 0.00 0.00 61.00 62.10 1yst s PRO 67 Cb -0.13 -4.12 0.00 0.00 0.02 0.00 0.00 34.50 30.27 1yst s PRO 67 CO 0.24 -1.91 0.00 0.72 -0.33 0.00 0.00 177.00 175.72 1yst n HIS 68 N 9.62 0.00 -0.29 6.54 8.25 -1.26 -4.83 115.22 133.24 1yst n HIS 68 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 1yst n HIS 68 Cb 0.49 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.60 1yst n HIS 68 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1yst n GLY 69 N 0.00 0.85 0.50 -1.41 0.00 -1.25 -5.01 105.19 98.87 1yst n GLY 69 Ca 0.00 -0.02 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 1yst n GLY 69 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1yst h ARG 70 N 2.96 -1.21 0.00 1.61 2.47 -1.86 -3.50 114.38 114.86 1yst h ARG 70 Ca 0.00 0.08 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 1yst h ARG 70 Cb 0.00 0.27 0.00 0.00 -1.65 0.00 0.00 29.97 28.59 1yst h ARG 70 CO 0.00 -0.80 0.00 0.41 0.56 0.00 0.00 179.97 180.14 1yst n GLY 71 N -1.57 0.64 3.26 0.04 0.00 -1.22 -4.94 105.19 101.40 1yst n GLY 71 Ca -0.16 -2.07 -0.31 0.00 0.00 0.00 0.00 46.02 43.48 1yst n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yst s THR 72 N -1.25 2.01 -0.07 2.61 -4.23 -1.26 -0.32 115.64 113.13 1yst s THR 72 Ca 0.00 -1.04 0.03 0.00 -1.18 0.00 0.00 61.69 59.50 1yst s THR 72 Cb 0.00 -1.70 0.01 0.00 1.34 0.00 0.00 72.50 72.14 1yst s THR 72 CO 0.00 0.56 -0.16 -0.22 -0.54 0.00 0.00 174.62 174.26 1yst s LEU 73 N -0.14 1.82 -0.40 4.79 2.96 -0.69 -4.99 118.68 122.03 1yst s LEU 73 Ca -0.04 -0.37 -0.07 0.00 -0.22 0.00 0.00 54.13 53.43 1yst s LEU 73 Cb -0.14 -0.99 0.08 0.00 0.50 0.00 0.00 46.19 45.64 1yst s LEU 73 CO 0.04 0.10 0.22 -0.89 -1.32 0.00 0.00 176.35 174.49 1yst s THR 74 N 0.40 3.85 -0.56 3.68 2.01 -1.26 -1.00 115.64 122.76 1yst s THR 74 Ca -0.12 -1.56 0.25 0.00 0.31 0.00 0.00 61.69 60.56 1yst s THR 74 Cb -0.15 -3.40 0.27 0.00 0.01 0.00 0.00 72.50 69.22 1yst s THR 74 CO 0.04 -0.51 1.74 0.52 -0.69 0.00 0.00 174.62 175.73 1yst n VAL 75 N 4.80 0.74 -0.36 3.82 0.31 -1.26 -4.61 118.33 121.77 1yst n VAL 75 Ca -0.09 0.02 -0.24 0.00 -0.01 0.00 0.00 64.34 64.02 1yst n VAL 75 Cb 0.43 -0.94 -0.06 0.00 -0.91 0.00 0.00 33.84 32.35 1yst n VAL 75 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1yst n PRO 76 N -2.27 0.00 0.00 5.55 -0.02 -1.23 -4.12 135.00 132.90 1yst n PRO 76 Ca 0.03 -0.71 0.00 0.00 -2.02 0.00 0.00 63.50 60.80 1yst n PRO 76 Cb 0.31 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1yst n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yst n GLY 77 N 4.44 0.00 0.70 -1.23 0.00 -1.20 -4.82 105.19 103.07 1yst n GLY 77 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1yst n GLY 77 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1yst n PRO 78 N 0.00 0.43 -1.69 1.61 -0.02 -1.26 -4.70 135.00 129.37 1yst n PRO 78 Ca 0.00 0.00 -0.59 0.00 -2.02 0.00 0.00 63.50 60.89 1yst n PRO 78 Cb 0.00 -1.24 -0.08 0.00 -0.02 0.00 0.00 33.50 32.16 1yst n PRO 78 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1yst n GLU 79 N 0.49 0.89 -3.60 -0.52 2.13 -1.26 -4.94 120.64 113.82 1yst n GLU 79 Ca 0.00 0.32 -0.29 0.00 0.66 0.00 0.00 57.16 57.85 1yst n GLU 79 Cb 0.15 -1.99 -0.15 0.00 0.27 0.00 0.00 31.44 29.72 1yst n GLU 79 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1yst s SER 80 N 3.79 3.65 -0.42 4.31 0.15 -1.26 -4.98 113.70 118.95 1yst s SER 80 Ca 1.01 -1.53 -0.27 0.00 0.70 0.00 0.00 55.95 55.86 1yst s SER 80 Cb -1.16 -0.54 -0.05 0.00 -1.71 0.00 0.00 66.02 62.56 1yst s SER 80 CO 0.68 -0.41 2.14 -1.61 1.20 0.00 0.00 173.24 175.23 1yst s GLU 81 N 1.79 2.69 -0.83 5.44 0.41 -1.26 -4.88 118.70 122.06 1yst s GLU 81 Ca 0.10 1.41 -0.05 0.00 -0.41 0.00 0.00 54.97 56.02 1yst s GLU 81 Cb -0.17 -4.42 0.21 0.00 -1.78 0.00 0.00 34.13 27.97 1yst s GLU 81 CO -0.29 -2.61 0.72 0.16 -0.49 0.00 0.00 175.26 172.75 1yst s ASP 82 N 9.27 6.09 0.39 -0.19 -4.77 -1.26 -4.92 116.67 121.28 1yst s ASP 82 Ca 0.89 -3.26 -0.11 0.00 -3.30 0.00 0.00 52.55 46.76 1yst s ASP 82 Cb -0.21 -1.99 0.05 0.00 -1.09 0.00 0.00 42.92 39.67 1yst s ASP 82 CO 0.29 -0.32 0.72 0.00 0.70 0.00 0.00 175.17 176.55 1yst s ARG 83 N -0.69 2.22 0.32 2.11 1.70 -1.26 -5.08 118.95 118.27 1yst s ARG 83 Ca 0.23 -1.59 0.10 0.00 -0.47 0.00 0.00 55.73 54.00 1yst s ARG 83 Cb -0.12 0.58 -0.06 0.00 -0.57 0.00 0.00 34.95 34.78 1yst s ARG 83 CO -0.08 -1.01 -0.11 -1.25 -1.08 0.00 0.00 175.30 171.76 1yst s PRO 84 N -2.31 1.76 0.03 3.89 0.04 -1.26 -5.14 135.00 132.01 1yst s PRO 84 Ca 0.20 -1.89 0.03 0.00 0.04 0.00 0.00 61.00 59.38 1yst s PRO 84 Cb -0.04 -1.65 -0.02 0.00 0.04 0.00 0.00 34.50 32.83 1yst s PRO 84 CO 0.15 0.17 -0.08 0.96 0.04 0.00 0.00 177.00 178.23 1yst s ILE 85 N -2.64 0.61 -1.09 0.56 -4.36 -1.26 -5.04 121.20 107.98 1yst s ILE 85 Ca 0.32 -0.78 -0.10 0.00 -0.26 0.00 0.00 60.65 59.83 1yst s ILE 85 Cb 0.01 -0.60 0.27 0.00 1.25 0.00 0.00 42.46 43.39 1yst s ILE 85 CO 0.16 -0.14 1.09 0.00 0.24 0.00 0.00 174.94 176.29 1yst s ALA 86 N -0.86 4.68 0.03 2.27 0.00 -1.26 -4.99 121.76 121.62 1yst s ALA 86 Ca -0.04 -3.80 -0.11 0.00 0.00 0.00 0.00 51.96 48.01 1yst s ALA 86 Cb -0.07 -3.58 0.01 0.00 0.00 0.00 0.00 23.12 19.48 1yst s ALA 86 CO 0.00 -2.22 0.24 -0.51 0.00 0.00 0.00 175.76 173.27 1yst s LEU 87 N -1.09 1.15 0.05 0.00 1.43 -1.26 -0.33 118.68 118.65 1yst s LEU 87 Ca 0.30 -0.22 -0.27 0.00 -1.03 0.00 0.00 54.13 52.91 1yst s LEU 87 Cb -0.10 1.10 0.07 0.00 0.03 0.00 0.00 46.19 47.29 1yst s LEU 87 CO -0.08 -0.53 0.66 0.00 0.23 0.00 0.00 176.35 176.63 1yst s ALA 88 N -2.22 -1.69 0.52 4.21 0.00 -1.13 -4.87 121.76 116.57 1yst s ALA 88 Ca -0.08 0.90 -0.18 0.00 0.00 0.00 0.00 51.96 52.60 1yst s ALA 88 Cb -0.02 0.44 -0.12 0.00 0.00 0.00 0.00 23.12 23.42 1yst s ALA 88 CO -0.02 -0.59 0.24 0.54 0.00 0.00 0.00 175.76 175.94 1yst n ARG 89 N 0.19 0.28 0.00 0.00 3.00 -1.26 -3.87 116.66 115.00 1yst n ARG 89 Ca -0.17 0.11 0.00 0.00 -0.01 0.00 0.00 57.85 57.78 1yst n ARG 89 Cb 0.61 -1.37 0.00 0.00 0.00 0.00 0.00 32.46 31.70 1yst n ARG 89 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1yst n THR 90 N -1.53 0.19 0.00 0.55 -1.04 -1.26 -4.89 114.28 106.30 1yst n THR 90 Ca 0.10 -0.22 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 1yst n THR 90 Cb 0.46 1.09 0.00 0.00 -1.82 0.00 0.00 70.33 70.06 1yst n THR 90 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1yst n ALA 91 N -0.09 0.00 1.38 2.41 0.00 -1.26 -5.05 120.51 117.89 1yst n ALA 91 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1yst n ALA 91 Cb 0.38 0.00 0.60 0.00 0.00 0.00 0.00 19.45 20.42 1yst n ALA 91 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1yst n VAL 92 N -0.99 0.00 -3.30 0.00 0.31 -1.26 -4.75 118.33 108.34 1yst n VAL 92 Ca 0.00 -0.06 -0.46 0.00 -0.01 0.00 0.00 64.34 63.81 1yst n VAL 92 Cb 0.00 -0.10 -0.05 0.00 -0.91 0.00 0.00 33.84 32.79 1yst n VAL 92 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1yst s SER 93 N -2.51 6.22 0.38 4.52 0.01 -1.26 -4.96 113.70 116.10 1yst s SER 93 Ca 0.28 -1.82 0.15 0.00 1.31 0.00 0.00 55.95 55.87 1yst s SER 93 Cb 0.20 -2.22 0.52 0.00 0.21 0.00 0.00 66.02 64.73 1yst s SER 93 CO 0.48 -0.86 0.79 -0.62 0.41 0.00 0.00 173.24 173.44 1yst n GLU 94 N 5.25 0.01 0.26 12.44 -0.58 -1.26 -1.31 120.64 135.45 1yst n GLU 94 Ca -0.12 0.63 0.15 0.00 -0.42 0.00 0.00 57.16 57.40 1yst n GLU 94 Cb 0.41 -1.57 0.54 0.00 -0.57 0.00 0.00 31.44 30.25 1yst n GLU 94 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1yst h GLY 95 N 0.00 0.00 -3.85 0.62 0.00 -1.97 -3.45 103.07 94.42 1yst h GLY 95 Ca 0.28 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 47.10 1yst h GLY 95 CO -0.00 0.00 0.54 -1.36 0.00 0.00 0.00 176.54 175.71 1yst s PHE 96 N -3.55 3.39 0.32 5.60 0.08 -0.43 -4.98 117.98 118.41 1yst s PHE 96 Ca 0.02 1.59 -0.29 0.00 0.12 0.00 0.00 56.93 58.37 1yst s PHE 96 Cb 0.08 -3.43 -0.11 0.00 -0.57 0.00 0.00 43.02 39.00 1yst s PHE 96 CO 0.58 -1.03 1.46 -2.14 -0.10 0.00 0.00 175.22 173.99 1yst s PRO 97 N -1.50 4.20 -0.37 0.24 0.02 -1.26 -4.90 135.00 131.44 1yst s PRO 97 Ca 0.46 2.44 0.01 0.00 0.02 0.00 0.00 61.00 63.94 1yst s PRO 97 Cb -0.35 -3.04 0.11 0.00 0.02 0.00 0.00 34.50 31.25 1yst s PRO 97 CO 0.45 -0.46 0.14 -3.38 -0.33 0.00 0.00 177.00 173.42 1yst s HIS 98 N -0.60 2.37 0.00 6.54 -3.43 -1.26 -4.52 115.29 114.38 1yst s HIS 98 Ca 0.56 -2.33 0.00 0.00 -0.80 0.00 0.00 55.06 52.49 1yst s HIS 98 Cb -0.44 -2.12 0.00 0.00 -1.43 0.00 0.00 32.58 28.58 1yst s HIS 98 CO 0.53 -0.86 0.00 0.00 -2.00 0.00 0.00 174.74 172.41 1yst n ALA 99 N 4.22 -1.00 -2.52 -1.38 0.00 -1.25 -3.92 120.51 114.66 1yst n ALA 99 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.09 1yst n ALA 99 Cb 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.78 1yst n ALA 99 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1yst s PRO 100 N 0.00 4.17 -1.43 0.00 0.02 -1.26 -2.86 135.00 133.64 1yst s PRO 100 Ca 0.00 0.54 -0.11 0.00 0.02 0.00 0.00 61.00 61.45 1yst s PRO 100 Cb 0.00 -3.31 0.06 0.00 0.02 0.00 0.00 34.50 31.27 1yst s PRO 100 CO 0.00 0.47 2.27 2.41 -0.33 0.00 0.00 177.00 181.82 1yst n THR 101 N 2.50 4.00 0.00 0.99 -1.04 0.56 -4.68 114.28 116.60 1yst n THR 101 Ca -0.10 -3.43 0.00 0.00 -2.04 0.00 0.00 64.05 58.48 1yst n THR 101 Cb 0.52 -2.50 0.00 0.00 -1.82 0.00 0.00 70.33 66.53 1yst n THR 101 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1yst n GLY 102 N 3.45 0.07 0.00 3.41 0.00 -1.26 -4.92 105.19 105.93 1yst n GLY 102 Ca 0.54 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1yst n GLY 102 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1yst n ASP 103 N -0.23 0.00 0.00 1.61 2.03 -1.26 -4.98 116.55 113.71 1yst n ASP 103 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1yst n ASP 103 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1yst n ASP 103 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1yst n PRO 104 N 0.00 0.00 0.00 -0.67 -0.04 -1.26 -4.45 135.00 128.58 1yst n PRO 104 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1yst n PRO 104 Cb 0.00 -0.36 0.00 0.00 -0.04 0.00 0.00 33.50 33.10 1yst n PRO 104 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1yst n MET 105 N -0.11 0.00 0.04 0.54 2.81 -1.26 0.15 117.12 119.29 1yst n MET 105 Ca 0.00 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.85 1yst n MET 105 Cb 0.00 0.00 0.19 0.00 -0.71 0.00 0.00 33.22 32.70 1yst n MET 105 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1yst h LYS 106 N 0.00 0.40 0.00 0.03 6.56 -1.97 -3.31 116.57 118.27 1yst h LYS 106 Ca 0.00 -0.18 0.00 0.00 -1.06 0.00 0.00 60.65 59.41 1yst h LYS 106 Cb 0.00 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.65 1yst h LYS 106 CO 0.00 0.70 0.00 -0.40 -2.06 0.00 0.00 179.45 177.69 1yst n ASP 107 N -4.06 1.22 -2.40 0.86 5.68 0.38 -5.12 116.55 113.12 1yst n ASP 107 Ca -0.01 -1.45 -0.01 0.00 -0.50 0.00 0.00 54.79 52.82 1yst n ASP 107 Cb 0.46 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.43 1yst n ASP 107 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1yst n GLY 108 N -0.22 -3.83 3.54 6.12 0.00 0.20 -4.86 105.19 106.14 1yst n GLY 108 Ca 0.00 0.41 -0.13 0.00 0.00 0.00 0.00 46.02 46.30 1yst n GLY 108 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yst s VAL 109 N -0.42 -0.00 0.00 1.61 -7.23 -1.26 -4.76 120.40 108.34 1yst s VAL 109 Ca -0.06 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.11 1yst s VAL 109 Cb 0.00 -0.88 0.00 0.00 0.56 0.00 0.00 36.38 36.06 1yst s VAL 109 CO 0.16 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.56 1yst n GLY 110 N 2.95 -1.79 3.58 2.32 0.00 -1.26 -4.65 105.19 106.33 1yst n GLY 110 Ca -0.15 -1.87 -0.28 0.00 0.00 0.00 0.00 46.02 43.72 1yst n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1yst n PRO 111 N 0.00 1.58 0.00 1.61 -0.04 -1.26 -2.83 135.00 134.05 1yst n PRO 111 Ca 0.00 -2.45 0.00 0.00 -0.04 0.00 0.00 63.50 61.01 1yst n PRO 111 Cb 0.00 -3.73 0.00 0.00 -0.04 0.00 0.00 33.50 29.73 1yst n PRO 111 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yst n ALA 112 N 14.45 0.00 -2.87 0.55 0.00 -1.26 -4.18 120.51 127.20 1yst n ALA 112 Ca 0.45 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.55 1yst n ALA 112 Cb 0.46 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.86 1yst n ALA 112 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1yst s SER 113 N 0.00 6.21 0.00 0.00 0.15 -1.13 -4.17 113.70 114.76 1yst s SER 113 Ca 0.00 0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.97 1yst s SER 113 Cb 0.00 -1.93 0.00 0.00 -1.71 0.00 0.00 66.02 62.38 1yst s SER 113 CO 0.00 0.29 0.00 -2.67 1.20 0.00 0.00 173.24 172.06 1yst n TRP 114 N 1.17 -1.66 -3.61 3.44 4.27 -1.26 -4.74 117.44 115.05 1yst n TRP 114 Ca -0.13 -0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.36 1yst n TRP 114 Cb 0.53 -0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.41 1yst n TRP 114 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 1yst s VAL 115 N 0.10 0.00 0.44 -1.67 0.11 -1.26 -5.08 120.40 113.05 1yst s VAL 115 Ca 0.00 0.00 -0.23 0.00 -2.93 0.00 0.00 61.98 58.82 1yst s VAL 115 Cb -0.00 -1.00 -0.11 0.00 -1.53 0.00 0.00 36.38 33.74 1yst s VAL 115 CO 0.00 0.00 0.76 0.00 -3.33 0.00 0.00 175.10 172.53 1yst n ALA 116 N 2.03 -0.69 -3.15 1.54 0.00 -1.26 -4.78 120.51 114.20 1yst n ALA 116 Ca -0.13 0.17 0.05 0.00 0.00 0.00 0.00 53.44 53.53 1yst n ALA 116 Cb 0.56 -1.92 -0.00 0.00 0.00 0.00 0.00 19.45 18.08 1yst n ALA 116 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1yst s ARG 117 N -1.87 0.31 0.00 0.00 3.52 -1.26 -5.04 118.95 114.61 1yst s ARG 117 Ca 0.64 0.32 0.00 0.00 -0.13 0.00 0.00 55.73 56.56 1yst s ARG 117 Cb -0.57 0.15 0.00 0.00 -1.56 0.00 0.00 34.95 32.97 1yst s ARG 117 CO 0.56 -0.56 0.00 0.54 -0.81 0.00 0.00 175.30 175.03 1yst n ARG 118 N 5.24 0.00 -0.28 5.12 1.74 -1.26 -4.10 116.66 123.12 1yst n ARG 118 Ca 0.07 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.15 1yst n ARG 118 Cb 0.56 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.00 1yst n ARG 118 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1yst n ASP 119 N 0.00 0.00 -3.73 0.55 2.03 -1.26 -4.75 116.55 109.39 1yst n ASP 119 Ca 0.00 -1.06 -0.12 0.00 0.52 0.00 0.00 54.79 54.12 1yst n ASP 119 Cb 0.00 -0.19 -0.11 0.00 -0.72 0.00 0.00 41.12 40.11 1yst n ASP 119 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1yst s LEU 120 N 0.00 0.35 0.43 -2.67 2.01 -1.26 -5.00 118.68 112.53 1yst s LEU 120 Ca 0.00 0.80 -0.21 0.00 0.01 0.00 0.00 54.13 54.73 1yst s LEU 120 Cb 0.00 1.30 -0.15 0.00 0.01 0.00 0.00 46.19 47.35 1yst s LEU 120 CO 0.00 -0.15 0.14 -2.65 1.01 0.00 0.00 176.35 174.70 1yst n PRO 121 N 3.33 0.11 -1.97 1.29 -0.02 -1.26 -4.72 135.00 131.75 1yst n PRO 121 Ca -0.17 0.04 -0.39 0.00 -2.02 0.00 0.00 63.50 60.97 1yst n PRO 121 Cb 0.56 -1.11 0.01 0.00 -0.02 0.00 0.00 33.50 32.95 1yst n PRO 121 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1yst s GLU 122 N -1.14 3.58 0.13 -0.52 2.56 -1.26 -4.94 118.70 117.11 1yst s GLU 122 Ca 0.60 2.12 -0.32 0.00 0.00 0.00 0.00 54.97 57.37 1yst s GLU 122 Cb -0.60 -2.48 -0.12 0.00 2.00 0.00 0.00 34.13 32.93 1yst s GLU 122 CO 0.62 -0.80 1.74 1.28 -0.56 0.00 0.00 175.26 177.54 1yst n LEU 123 N -0.48 3.71 -4.93 2.70 4.32 -1.26 -3.70 117.00 117.35 1yst n LEU 123 Ca 0.07 1.03 -0.20 0.00 -0.02 0.00 0.00 56.01 56.89 1yst n LEU 123 Cb 0.45 -1.50 -0.01 0.00 -1.62 0.00 0.00 43.42 40.74 1yst n LEU 123 CO 0.53 0.02 0.07 -0.62 -1.22 0.00 0.00 177.39 176.17 1yst s ASP 124 N 2.00 5.24 0.08 -1.43 2.15 -1.26 -4.82 116.67 118.63 1yst s ASP 124 Ca 0.81 -0.66 -0.22 0.00 0.43 0.00 0.00 52.55 52.91 1yst s ASP 124 Cb -0.56 -0.53 -0.13 0.00 -0.30 0.00 0.00 42.92 41.39 1yst s ASP 124 CO 0.38 -0.73 1.66 1.23 -0.17 0.00 0.00 175.17 177.54 1yst h GLY 125 N 0.85 0.10 -2.05 2.66 0.00 -1.96 -3.43 103.07 99.25 1yst h GLY 125 Ca -0.40 -0.05 -0.49 0.00 0.00 0.00 0.00 47.33 46.38 1yst h GLY 125 CO 0.53 0.05 0.16 0.30 0.00 0.00 0.00 176.54 177.57 1yst s HIS 126 N -5.82 3.54 -0.22 5.60 3.76 -1.26 -4.95 115.29 115.94 1yst s HIS 126 Ca -0.13 0.96 0.14 0.00 -0.15 0.00 0.00 55.06 55.87 1yst s HIS 126 Cb 0.06 -2.41 0.74 0.00 1.11 0.00 0.00 32.58 32.08 1yst s HIS 126 CO 0.68 -0.29 1.35 0.41 -0.85 0.00 0.00 174.74 176.04 1yst n GLY 127 N -2.04 -0.66 3.16 -2.22 0.00 -1.26 -4.72 105.19 97.45 1yst n GLY 127 Ca 0.02 0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 1yst n GLY 127 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1yst n HIS 128 N -1.99 -2.44 -2.70 1.61 8.25 -1.26 -4.86 115.22 111.82 1yst n HIS 128 Ca -0.01 -0.20 -0.27 0.00 -0.26 0.00 0.00 57.72 56.98 1yst n HIS 128 Cb 0.17 -1.44 -0.00 0.00 1.12 0.00 0.00 29.99 29.84 1yst n HIS 128 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1yst s ASN 129 N -2.27 6.25 0.00 0.41 -0.87 -1.26 -4.02 114.94 113.18 1yst s ASN 129 Ca 0.51 0.87 0.00 0.00 -1.57 0.00 0.00 52.86 52.68 1yst s ASN 129 Cb -0.11 -2.21 0.00 0.00 -0.02 0.00 0.00 41.25 38.91 1yst s ASN 129 CO 0.49 -0.56 0.00 1.17 -2.57 0.00 0.00 177.10 175.63 1yst n LYS 130 N -2.22 0.00 -1.68 -0.60 4.81 -1.24 -4.84 118.16 112.39 1yst n LYS 130 Ca 0.00 0.00 -0.49 0.00 -0.87 0.00 0.00 58.31 56.95 1yst n LYS 130 Cb 0.55 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.55 1yst n LYS 130 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1yst n ILE 131 N 0.00 0.55 -3.78 3.15 5.41 -1.26 -3.78 119.36 119.65 1yst n ILE 131 Ca 0.00 -0.11 -0.13 0.00 1.00 0.00 0.00 62.75 63.51 1yst n ILE 131 Cb 0.00 -1.84 -0.14 0.00 -0.71 0.00 0.00 39.64 36.95 1yst n ILE 131 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1yst s LYS 132 N 4.19 0.11 -0.11 0.38 2.20 -0.04 -4.61 119.74 121.87 1yst s LYS 132 Ca 0.94 0.28 -0.36 0.00 -0.36 0.00 0.00 55.97 56.46 1yst s LYS 132 Cb -0.72 -0.07 -0.14 0.00 -1.51 0.00 0.00 37.83 35.40 1yst s LYS 132 CO 0.52 -0.10 1.75 -2.30 -0.36 0.00 0.00 175.35 174.87 1yst n PRO 133 N 3.66 1.74 -0.43 4.03 -0.02 -1.26 -2.54 135.00 140.18 1yst n PRO 133 Ca -0.20 0.64 0.36 0.00 -2.02 0.00 0.00 63.50 62.28 1yst n PRO 133 Cb 0.55 -2.40 0.64 0.00 -0.02 0.00 0.00 33.50 32.27 1yst n PRO 133 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1yst h MET 134 N 7.76 0.10 -0.45 -0.52 1.85 -1.64 0.82 114.93 122.84 1yst h MET 134 Ca -0.47 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 58.61 1yst h MET 134 Cb 1.29 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 33.30 1yst h MET 134 CO 0.93 0.07 0.00 1.17 -0.40 0.00 0.00 176.91 178.68 1yst n LYS 135 N -4.70 0.54 -2.70 0.39 4.81 -1.26 -3.52 118.16 111.72 1yst n LYS 135 Ca 0.36 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.74 1yst n LYS 135 Cb 1.39 -1.22 0.12 0.00 0.02 0.00 0.00 35.03 35.34 1yst n LYS 135 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1yst n ALA 136 N 0.11 1.35 -3.59 3.14 0.00 0.28 -5.14 120.51 116.66 1yst n ALA 136 Ca 0.00 -1.32 -0.13 0.00 0.00 0.00 0.00 53.44 51.99 1yst n ALA 136 Cb 0.11 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.51 1yst n ALA 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yst s ALA 137 N 0.13 -1.86 0.00 0.00 0.00 -1.23 -4.82 121.76 113.98 1yst s ALA 137 Ca 0.22 1.69 0.00 0.00 0.00 0.00 0.00 51.96 53.86 1yst s ALA 137 Cb 0.40 -0.80 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1yst s ALA 137 CO -0.09 -0.32 0.00 0.00 0.00 0.00 0.00 175.76 175.36 1yst n ALA 138 N 1.62 0.00 -0.12 0.00 0.00 -1.26 -3.68 120.51 117.07 1yst n ALA 138 Ca -0.14 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1yst n ALA 138 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1yst n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yst n GLY 139 N 2.41 0.55 3.64 0.00 0.00 -1.26 -5.04 105.19 105.49 1yst n GLY 139 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.54 1yst n GLY 139 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1yst n PHE 140 N -2.00 1.94 -3.31 1.61 3.72 -1.24 -4.92 117.46 113.25 1yst n PHE 140 Ca 0.00 0.44 -0.07 0.00 -0.05 0.00 0.00 57.45 57.77 1yst n PHE 140 Cb 0.00 -2.45 -0.07 0.00 -0.94 0.00 0.00 39.48 36.03 1yst n PHE 140 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 1yst s HIS 141 N 0.60 -0.98 -0.05 1.38 -3.43 -1.26 -5.04 115.29 106.50 1yst s HIS 141 Ca 0.79 0.90 -0.30 0.00 -0.80 0.00 0.00 55.06 55.66 1yst s HIS 141 Cb -0.78 0.08 -0.06 0.00 -1.43 0.00 0.00 32.58 30.39 1yst s HIS 141 CO 0.43 -0.78 1.70 0.54 -2.00 0.00 0.00 174.74 174.63 1yst s VAL 142 N 2.59 3.51 0.00 -5.38 0.11 -1.26 -4.99 120.40 114.98 1yst s VAL 142 Ca 0.13 0.61 0.00 0.00 -2.93 0.00 0.00 61.98 59.79 1yst s VAL 142 Cb -0.15 -3.40 0.00 0.00 -1.53 0.00 0.00 36.38 31.30 1yst s VAL 142 CO -0.19 -0.06 0.00 -1.20 -3.33 0.00 0.00 175.10 170.32 1yst n SER 143 N 7.29 0.00 0.00 3.54 7.64 -1.26 -4.81 113.62 126.03 1yst n SER 143 Ca 0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1yst n SER 143 Cb 0.43 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.63 1yst n SER 143 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1yst n ALA 144 N -3.00 1.27 -2.78 -0.43 0.00 -1.26 -4.77 120.51 109.54 1yst n ALA 144 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1yst n ALA 144 Cb 0.00 -0.92 -0.08 0.00 0.00 0.00 0.00 19.45 18.45 1yst n ALA 144 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1yst s GLY 145 N -2.15 2.05 0.00 0.00 0.00 -1.26 -4.92 107.32 101.03 1yst s GLY 145 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 44.72 44.03 1yst s GLY 145 CO 0.00 -0.04 0.00 0.58 0.00 0.00 0.00 173.10 173.64 1yst n LYS 146 N 3.05 0.00 -2.78 2.90 -0.00 -1.26 -4.86 118.16 115.21 1yst n LYS 146 Ca -0.17 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.71 1yst n LYS 146 Cb 0.53 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.53 1yst n LYS 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1yst s ASN 147 N 0.00 6.95 0.00 -5.58 4.22 -1.26 -4.92 114.94 114.35 1yst s ASN 147 Ca 0.00 1.18 0.00 0.00 -2.14 0.00 0.00 52.86 51.90 1yst s ASN 147 Cb 0.00 -2.49 0.00 0.00 1.28 0.00 0.00 41.25 40.04 1yst s ASN 147 CO 0.00 -0.61 0.05 -0.81 -2.04 0.00 0.00 177.10 173.70 1yst n PRO 148 N 6.20 0.06 -0.26 3.55 -0.04 -1.26 -4.35 135.00 138.89 1yst n PRO 148 Ca 0.09 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.60 1yst n PRO 148 Cb 0.47 -1.01 0.19 0.00 -0.04 0.00 0.00 33.50 33.11 1yst n PRO 148 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1yst h ILE 149 N 0.00 0.69 -0.55 0.52 2.04 -1.91 -2.89 117.51 115.40 1yst h ILE 149 Ca 0.00 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1yst h ILE 149 Cb 0.01 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.24 1yst h ILE 149 CO 0.00 0.09 0.00 0.61 0.00 0.00 0.00 178.15 178.85 1yst n GLY 150 N -1.32 2.90 3.28 5.37 0.00 -1.26 -4.26 105.19 109.90 1yst n GLY 150 Ca 0.15 -0.88 -0.27 0.00 0.00 0.00 0.00 46.02 45.02 1yst n GLY 150 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1yst s LEU 151 N -2.59 2.18 -0.05 0.99 0.05 -1.09 -4.98 118.68 113.20 1yst s LEU 151 Ca 0.52 -0.56 -0.30 0.00 0.05 0.00 0.00 54.13 53.84 1yst s LEU 151 Cb 0.39 -1.05 -0.05 0.00 -2.05 0.00 0.00 46.19 43.43 1yst s LEU 151 CO 0.16 0.18 1.58 -2.84 -0.55 0.00 0.00 176.35 174.88 1yst s PRO 152 N -1.29 4.20 0.32 1.48 0.02 -1.25 -4.07 135.00 134.41 1yst s PRO 152 Ca 0.09 2.12 -0.27 0.00 0.02 0.00 0.00 61.00 62.96 1yst s PRO 152 Cb -0.09 -3.88 -0.09 0.00 0.02 0.00 0.00 34.50 30.45 1yst s PRO 152 CO 0.02 -0.79 1.06 0.14 -0.33 0.00 0.00 177.00 177.10 1yst s VAL 153 N 3.67 3.67 -0.10 3.83 -7.23 -1.23 -2.76 120.40 120.25 1yst s VAL 153 Ca 0.70 1.51 -0.05 0.00 -1.81 0.00 0.00 61.98 62.34 1yst s VAL 153 Cb -0.32 -3.90 0.04 0.00 0.56 0.00 0.00 36.38 32.76 1yst s VAL 153 CO 0.28 0.24 0.23 -0.60 -0.31 0.00 0.00 175.10 174.93 1yst s ARG 154 N -1.82 0.19 0.00 4.82 3.00 0.58 -3.69 118.95 122.02 1yst s ARG 154 Ca 0.49 0.50 0.00 0.00 -1.00 0.00 0.00 55.73 55.72 1yst s ARG 154 Cb -0.27 -0.12 0.00 0.00 0.00 0.00 0.00 34.95 34.55 1yst s ARG 154 CO 0.34 -0.16 0.00 0.41 0.00 0.00 0.00 175.30 175.89 1yst n GLY 155 N 4.19 0.96 0.33 8.12 0.00 -1.26 0.13 105.19 117.66 1yst n GLY 155 Ca -0.25 -1.79 -0.12 0.00 0.00 0.00 0.00 46.02 43.86 1yst n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yst n ASP 157 N -4.51 0.00 -4.57 0.00 9.92 -1.26 -4.91 116.55 111.22 1yst n ASP 157 Ca -0.07 0.00 -0.26 0.00 -0.53 0.00 0.00 54.79 53.94 1yst n ASP 157 Cb 0.29 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.67 1yst n ASP 157 CO 0.00 0.00 0.00 -1.48 0.13 0.00 0.00 177.20 175.85 1yst s LEU 158 N 0.00 2.80 -0.69 0.64 0.05 -1.26 -4.97 118.68 115.25 1yst s LEU 158 Ca 0.00 -1.17 -0.03 0.00 0.05 0.00 0.00 54.13 52.98 1yst s LEU 158 Cb 0.00 -1.07 0.19 0.00 -2.05 0.00 0.00 46.19 43.26 1yst s LEU 158 CO 0.00 -0.23 2.42 -1.84 -0.55 0.00 0.00 176.35 176.15 1yst n GLU 159 N -0.84 2.82 -2.18 1.48 0.28 -1.26 -4.15 120.64 116.77 1yst n GLU 159 Ca -0.05 -2.98 -0.25 0.00 -0.16 0.00 0.00 57.16 53.73 1yst n GLU 159 Cb 0.63 -2.24 0.01 0.00 1.43 0.00 0.00 31.44 31.28 1yst n GLU 159 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 1yst n ILE 160 N 0.34 2.45 -2.70 3.84 2.08 -1.26 -4.52 119.36 119.58 1yst n ILE 160 Ca 0.52 -4.43 -0.07 0.00 0.56 0.00 0.00 62.75 59.33 1yst n ILE 160 Cb 0.40 -1.14 0.09 0.00 -0.75 0.00 0.00 39.64 38.24 1yst n ILE 160 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1yst n ALA 161 N -0.63 -1.85 -2.84 -1.39 0.00 -1.26 -4.82 120.51 107.72 1yst n ALA 161 Ca 0.42 -1.01 -0.11 0.00 0.00 0.00 0.00 53.44 52.74 1yst n ALA 161 Cb 0.87 -2.00 0.04 0.00 0.00 0.00 0.00 19.45 18.35 1yst n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yst n GLY 162 N 0.58 0.83 3.41 0.00 0.00 -1.24 -4.64 105.19 104.12 1yst n GLY 162 Ca 0.02 -0.26 -0.44 0.00 0.00 0.00 0.00 46.02 45.33 1yst n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yst s LYS 163 N 0.10 3.07 0.29 1.61 -0.14 -1.04 -3.47 119.74 120.16 1yst s LYS 163 Ca 0.31 -1.15 -0.28 0.00 -1.36 0.00 0.00 55.97 53.49 1yst s LYS 163 Cb 0.24 -4.17 -0.10 0.00 -1.68 0.00 0.00 37.83 32.13 1yst s LYS 163 CO -0.17 -1.29 0.95 0.14 -0.76 0.00 0.00 175.35 174.22 1yst s VAL 164 N 2.42 4.13 0.09 3.17 -7.23 -1.26 0.15 120.40 121.87 1yst s VAL 164 Ca 0.11 1.90 0.00 0.00 -1.81 0.00 0.00 61.98 62.19 1yst s VAL 164 Cb -0.22 -4.12 0.00 0.00 0.56 0.00 0.00 36.38 32.60 1yst s VAL 164 CO 0.09 0.28 0.00 0.52 -0.31 0.00 0.00 175.10 175.67 1yst n VAL 165 N 0.90 0.90 -3.79 1.32 0.31 -0.65 -4.73 118.33 112.60 1yst n VAL 165 Ca 0.00 0.30 -0.13 0.00 -0.01 0.00 0.00 64.34 64.50 1yst n VAL 165 Cb 0.49 -1.51 -0.09 0.00 -0.91 0.00 0.00 33.84 31.82 1yst n VAL 165 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1yst s ASP 166 N -5.72 -0.16 0.61 4.52 2.15 -1.26 -4.80 116.67 112.01 1yst s ASP 166 Ca 0.00 0.10 -0.15 0.00 0.43 0.00 0.00 52.55 52.94 1yst s ASP 166 Cb 0.00 0.34 -0.03 0.00 -0.30 0.00 0.00 42.92 42.93 1yst s ASP 166 CO 0.00 -0.38 1.05 -0.63 -0.17 0.00 0.00 175.17 175.05 1yst s ILE 167 N -1.11 3.89 -0.25 4.11 1.01 -1.26 -1.72 121.20 125.87 1yst s ILE 167 Ca -0.12 0.83 -0.01 0.00 0.00 0.00 0.00 60.65 61.35 1yst s ILE 167 Cb -0.05 -3.40 0.08 0.00 0.01 0.00 0.00 42.46 39.09 1yst s ILE 167 CO 0.03 -0.59 0.04 0.86 0.00 0.00 0.00 174.94 175.28 1yst s TRP 168 N -2.59 1.71 0.14 3.97 -0.11 0.10 -1.65 118.94 120.51 1yst s TRP 168 Ca 0.62 -1.48 0.05 0.00 1.22 0.00 0.00 56.10 56.52 1yst s TRP 168 Cb -0.15 -1.48 -0.04 0.00 -1.50 0.00 0.00 33.47 30.30 1yst s TRP 168 CO 0.41 -0.76 0.08 0.14 -4.62 0.00 0.00 176.95 172.20 1yst s VAL 169 N 1.62 4.28 -0.31 5.86 -7.23 -1.05 -1.04 120.40 122.53 1yst s VAL 169 Ca 0.02 -1.08 -0.28 0.00 -1.81 0.00 0.00 61.98 58.84 1yst s VAL 169 Cb -0.18 -3.14 0.01 0.00 0.56 0.00 0.00 36.38 33.64 1yst s VAL 169 CO -0.14 -0.04 1.00 -0.62 -0.31 0.00 0.00 175.10 174.99 1yst s ASP 170 N -2.84 6.87 0.03 4.85 -1.08 -0.65 -0.86 116.67 122.99 1yst s ASP 170 Ca 0.29 0.97 -0.26 0.00 -0.52 0.00 0.00 52.55 53.04 1yst s ASP 170 Cb -0.10 -2.51 -0.17 0.00 -1.46 0.00 0.00 42.92 38.68 1yst s ASP 170 CO 0.22 -0.79 1.42 0.40 0.52 0.00 0.00 175.17 176.93 1yst h ILE 171 N 5.68 0.89 0.00 4.11 5.03 -1.88 -3.30 117.51 128.03 1yst h ILE 171 Ca -0.21 -0.49 0.00 0.00 -0.12 0.00 0.00 64.86 64.03 1yst h ILE 171 Cb 1.07 1.18 0.00 0.00 -3.03 0.00 0.00 36.82 36.04 1yst h ILE 171 CO 0.99 0.11 0.00 -2.65 -0.68 0.00 0.00 178.15 175.92 1yst n PRO 172 N -5.10 0.00 -1.79 2.37 -0.02 -1.26 -4.33 135.00 124.87 1yst n PRO 172 Ca -0.09 0.28 -0.41 0.00 -2.02 0.00 0.00 63.50 61.26 1yst n PRO 172 Cb 0.21 -1.08 -0.03 0.00 -0.02 0.00 0.00 33.50 32.58 1yst n PRO 172 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1yst s GLU 173 N -1.50 2.97 -1.14 -0.52 2.02 -1.26 -4.91 118.70 114.36 1yst s GLU 173 Ca 0.00 1.55 -0.21 0.00 0.02 0.00 0.00 54.97 56.32 1yst s GLU 173 Cb 0.00 -4.35 0.01 0.00 0.10 0.00 0.00 34.13 29.90 1yst s GLU 173 CO 0.00 -2.29 1.73 -0.65 0.02 0.00 0.00 175.26 174.07 1yst s GLN 174 N 6.51 3.35 -0.00 1.61 -0.21 -1.26 -4.45 119.66 125.20 1yst s GLN 174 Ca 0.89 -1.32 0.01 0.00 0.02 0.00 0.00 55.36 54.96 1yst s GLN 174 Cb -0.24 -5.36 -0.00 0.00 1.00 0.00 0.00 33.01 28.41 1yst s GLN 174 CO 0.31 -2.77 -0.03 -1.64 -2.12 0.00 0.00 175.29 169.04 1yst s MET 175 N 5.33 0.24 -0.94 2.91 -1.94 -1.24 -5.04 119.30 118.61 1yst s MET 175 Ca 0.57 -0.13 -0.22 0.00 -1.71 0.00 0.00 55.69 54.20 1yst s MET 175 Cb 0.00 -0.22 0.07 0.00 2.01 0.00 0.00 34.83 36.70 1yst s MET 175 CO 0.03 0.06 1.32 0.00 -0.01 0.00 0.00 175.02 176.41 1yst s ALA 176 N -0.13 2.91 -2.11 3.03 0.00 -1.26 -1.64 121.76 122.56 1yst s ALA 176 Ca 0.00 -2.27 0.22 0.00 0.00 0.00 0.00 51.96 49.92 1yst s ALA 176 Cb -0.01 -4.33 1.14 0.00 0.00 0.00 0.00 23.12 19.92 1yst s ALA 176 CO -0.00 -3.36 1.76 -2.13 0.00 0.00 0.00 175.76 172.02 1yst n ARG 177 N 8.26 1.24 -3.60 0.00 0.63 -1.04 -4.74 116.66 117.41 1yst n ARG 177 Ca 0.25 -0.36 -0.15 0.00 -0.92 0.00 0.00 57.85 56.67 1yst n ARG 177 Cb 0.50 -1.37 -0.07 0.00 0.45 0.00 0.00 32.46 31.97 1yst n ARG 177 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1yst s PHE 178 N -1.95 -0.72 -0.08 -0.14 0.08 -0.21 -3.05 117.98 111.92 1yst s PHE 178 Ca 0.33 1.61 0.02 0.00 0.12 0.00 0.00 56.93 59.01 1yst s PHE 178 Cb 0.16 0.32 -0.02 0.00 -0.57 0.00 0.00 43.02 42.91 1yst s PHE 178 CO 0.26 -0.43 -0.14 -0.51 -0.10 0.00 0.00 175.22 174.30 1yst s LEU 179 N -0.11 2.73 -0.26 -0.37 1.02 -1.11 0.03 118.68 120.60 1yst s LEU 179 Ca -0.03 -0.25 -0.11 0.00 0.02 0.00 0.00 54.13 53.76 1yst s LEU 179 Cb -0.03 -1.58 -0.05 0.00 0.02 0.00 0.00 46.19 44.55 1yst s LEU 179 CO 0.03 0.28 0.19 -0.70 0.02 0.00 0.00 176.35 176.17 1yst s GLU 180 N -0.32 4.01 -0.43 1.70 2.12 -0.70 -1.21 118.70 123.87 1yst s GLU 180 Ca 0.03 -0.26 -0.10 0.00 0.36 0.00 0.00 54.97 55.00 1yst s GLU 180 Cb -0.13 -3.60 0.08 0.00 0.26 0.00 0.00 34.13 30.74 1yst s GLU 180 CO 0.02 -0.08 0.29 0.14 -0.54 0.00 0.00 175.26 175.09 1yst s VAL 181 N 1.46 4.35 -0.95 3.70 -7.23 0.30 -1.64 120.40 120.39 1yst s VAL 181 Ca 0.08 -1.41 -0.24 0.00 -1.81 0.00 0.00 61.98 58.61 1yst s VAL 181 Cb -0.15 -3.68 0.03 0.00 0.56 0.00 0.00 36.38 33.14 1yst s VAL 181 CO 0.08 -0.55 1.53 -0.70 -0.31 0.00 0.00 175.10 175.15 1yst s GLU 182 N 1.44 3.33 0.36 4.82 2.12 0.41 -0.88 118.70 130.30 1yst s GLU 182 Ca 0.03 -0.81 -0.28 0.00 0.36 0.00 0.00 54.97 54.27 1yst s GLU 182 Cb -0.24 -5.14 -0.11 0.00 0.26 0.00 0.00 34.13 28.91 1yst s GLU 182 CO 0.02 -2.43 1.45 -0.51 -0.54 0.00 0.00 175.26 173.25 1yst s LEU 183 N 6.12 4.35 -0.29 2.70 1.43 0.80 -2.49 118.68 131.30 1yst s LEU 183 Ca 0.50 2.96 -0.11 0.00 -1.03 0.00 0.00 54.13 56.45 1yst s LEU 183 Cb -0.03 -3.66 -0.11 0.00 0.03 0.00 0.00 46.19 42.43 1yst s LEU 183 CO -0.04 -0.79 1.27 1.17 0.23 0.00 0.00 176.35 178.18 1yst n LYS 184 N 0.63 0.02 0.00 1.70 4.81 -1.26 -0.74 118.16 123.32 1yst n LYS 184 Ca 0.01 -0.56 0.00 0.00 -0.87 0.00 0.00 58.31 56.89 1yst n LYS 184 Cb 0.40 -1.95 0.00 0.00 0.02 0.00 0.00 35.03 33.50 1yst n LYS 184 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1yst n ASP 185 N 8.94 0.00 -1.87 3.14 5.75 -1.26 -4.93 116.55 126.31 1yst n ASP 185 Ca 0.16 0.00 -0.14 0.00 -0.01 0.00 0.00 54.79 54.80 1yst n ASP 185 Cb 0.44 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.49 1yst n ASP 185 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1yst n GLY 186 N 0.00 0.49 3.42 6.12 0.00 0.08 -4.93 105.19 110.37 1yst n GLY 186 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1yst n GLY 186 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yst s SER 187 N -2.11 6.19 -0.09 1.61 0.01 -0.91 -4.86 113.70 113.55 1yst s SER 187 Ca 0.00 -1.07 -0.30 0.00 1.31 0.00 0.00 55.95 55.89 1yst s SER 187 Cb 0.00 -2.25 -0.02 0.00 0.21 0.00 0.00 66.02 63.96 1yst s SER 187 CO 0.00 -0.80 1.08 0.42 0.41 0.00 0.00 173.24 174.35 1yst s THR 188 N 2.26 4.59 0.04 1.44 -4.23 -1.26 -0.14 115.64 118.33 1yst s THR 188 Ca 0.11 1.87 0.04 0.00 -1.18 0.00 0.00 61.69 62.53 1yst s THR 188 Cb -0.21 -4.20 -0.02 0.00 1.34 0.00 0.00 72.50 69.41 1yst s THR 188 CO 0.10 0.00 -0.11 -0.13 -0.54 0.00 0.00 174.62 173.94 1yst s ARG 189 N 2.08 0.74 0.27 3.99 3.00 -0.06 -4.84 118.95 124.13 1yst s ARG 189 Ca 0.51 -0.68 0.08 0.00 0.00 0.00 0.00 55.73 55.63 1yst s ARG 189 Cb -0.21 -0.69 -0.04 0.00 0.00 0.00 0.00 34.95 34.02 1yst s ARG 189 CO 0.19 0.16 0.16 -0.48 0.00 0.00 0.00 175.30 175.34 1yst s LEU 190 N -1.14 3.65 -0.02 2.53 2.34 -1.26 0.11 118.68 124.89 1yst s LEU 190 Ca -0.02 -0.37 0.03 0.00 0.06 0.00 0.00 54.13 53.83 1yst s LEU 190 Cb -0.08 -2.19 -0.00 0.00 -0.56 0.00 0.00 46.19 43.37 1yst s LEU 190 CO 0.01 -0.07 -0.10 -0.76 -1.06 0.00 0.00 176.35 174.36 1yst s LEU 191 N -3.82 1.85 -0.29 1.48 1.02 -0.35 -4.93 118.68 113.63 1yst s LEU 191 Ca 0.34 -0.21 -0.28 0.00 0.02 0.00 0.00 54.13 54.00 1yst s LEU 191 Cb -0.07 -0.60 -0.05 0.00 0.02 0.00 0.00 46.19 45.49 1yst s LEU 191 CO 0.24 0.09 2.16 -2.84 0.02 0.00 0.00 176.35 176.02 1yst s PRO 192 N 0.08 2.99 0.06 1.29 0.02 -1.26 -2.77 135.00 135.41 1yst s PRO 192 Ca -0.02 1.78 -0.08 0.00 0.02 0.00 0.00 61.00 62.71 1yst s PRO 192 Cb -0.08 -4.37 0.02 0.00 0.02 0.00 0.00 34.50 30.09 1yst s PRO 192 CO 0.00 -2.26 0.47 -0.12 -0.33 0.00 0.00 177.00 174.76 1yst n MET 193 N 8.76 -0.11 -0.34 5.54 1.56 -1.17 -1.51 117.12 129.84 1yst n MET 193 Ca 0.29 0.46 0.00 0.00 -0.27 0.00 0.00 57.70 58.18 1yst n MET 193 Cb 0.47 -0.68 0.14 0.00 2.15 0.00 0.00 33.22 35.30 1yst n MET 193 CO 0.00 0.00 0.00 1.96 -0.73 0.00 0.00 175.97 177.20 1yst h GLN 194 N 0.00 1.11 0.00 2.12 7.50 -1.89 -3.09 115.11 120.85 1yst h GLN 194 Ca 0.07 -0.07 0.00 0.00 0.50 0.00 0.00 58.65 59.16 1yst h GLN 194 Cb 0.15 -0.25 0.00 0.00 0.05 0.00 0.00 27.48 27.43 1yst h GLN 194 CO -0.29 0.73 0.00 -1.33 -1.50 0.00 0.00 178.83 176.44 1yst n MET 195 N -4.52 0.55 -4.40 1.46 2.81 -0.57 -4.77 117.12 107.68 1yst n MET 195 Ca 0.13 0.00 -0.20 0.00 -1.81 0.00 0.00 57.70 55.82 1yst n MET 195 Cb 0.12 -1.17 -0.14 0.00 -0.71 0.00 0.00 33.22 31.32 1yst n MET 195 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1yst s VAL 196 N -2.00 0.95 -0.19 2.03 -7.23 -1.17 -4.31 120.40 108.48 1yst s VAL 196 Ca 0.09 -0.72 -0.07 0.00 -1.81 0.00 0.00 61.98 59.46 1yst s VAL 196 Cb 0.04 -0.84 -0.04 0.00 0.56 0.00 0.00 36.38 36.11 1yst s VAL 196 CO 0.07 0.11 0.06 -0.75 -0.31 0.00 0.00 175.10 174.27 1yst s LYS 197 N -0.70 3.90 -1.01 4.82 2.20 -0.10 -4.99 119.74 123.85 1yst s LYS 197 Ca 0.02 -0.38 -0.05 0.00 -0.36 0.00 0.00 55.97 55.20 1yst s LYS 197 Cb -0.06 -3.21 0.26 0.00 -1.51 0.00 0.00 37.83 33.31 1yst s LYS 197 CO 0.00 0.19 1.02 1.33 -0.36 0.00 0.00 175.35 177.54 1yst n VAL 198 N 3.77 4.00 -2.31 4.02 0.24 -1.26 -0.51 118.33 126.27 1yst n VAL 198 Ca -0.16 -5.35 -0.41 0.00 -2.04 0.00 0.00 64.34 56.38 1yst n VAL 198 Cb 0.52 -2.43 -0.03 0.00 -1.47 0.00 0.00 33.84 30.43 1yst n VAL 198 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1yst s GLN 199 N -1.57 4.50 -0.50 7.34 -0.44 -0.19 -4.84 119.66 123.96 1yst s GLN 199 Ca 0.30 1.99 -0.04 0.00 -2.50 0.00 0.00 55.36 55.11 1yst s GLN 199 Cb -0.06 -3.15 -0.08 0.00 -1.64 0.00 0.00 33.01 28.09 1yst s GLN 199 CO -0.07 0.01 2.01 0.43 0.50 0.00 0.00 175.29 178.17 1yst n SER 200 N 1.20 3.71 0.00 6.67 7.64 -1.26 -0.29 113.62 131.29 1yst n SER 200 Ca 0.00 -2.17 0.00 0.00 1.01 0.00 0.00 58.87 57.71 1yst n SER 200 Cb 0.43 -0.91 0.00 0.00 -1.01 0.00 0.00 64.21 62.73 1yst n SER 200 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1yst n ASN 201 N 3.70 0.00 0.00 6.43 5.15 -1.26 -5.15 115.26 124.12 1yst n ASN 201 Ca 0.33 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.31 1yst n ASN 201 Cb 0.25 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.50 1yst n ASN 201 CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 1yst n ARG 202 N -0.08 0.00 -3.67 1.20 1.85 0.60 -4.92 116.66 111.64 1yst n ARG 202 Ca 0.00 0.00 -0.39 0.00 -1.00 0.00 0.00 57.85 56.46 1yst n ARG 202 Cb 0.00 0.00 -0.12 0.00 -1.05 0.00 0.00 32.46 31.29 1yst n ARG 202 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1yst s VAL 203 N -2.00 4.17 -0.22 8.89 1.01 -1.11 -1.02 120.40 130.11 1yst s VAL 203 Ca 0.00 -1.03 -0.18 0.00 0.00 0.00 0.00 61.98 60.77 1yst s VAL 203 Cb 0.00 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 1yst s VAL 203 CO 0.00 -0.23 0.49 -2.28 0.00 0.00 0.00 175.10 173.08 1yst s HIS 204 N 1.47 3.33 -0.92 5.22 2.46 0.33 -0.31 115.29 126.88 1yst s HIS 204 Ca 0.00 0.68 -0.00 0.00 0.47 0.00 0.00 55.06 56.21 1yst s HIS 204 Cb -0.20 -2.65 0.30 0.00 -0.13 0.00 0.00 32.58 29.90 1yst s HIS 204 CO 0.05 -0.15 1.29 0.28 -2.47 0.00 0.00 174.74 173.73 1yst n VAL 205 N 4.75 4.47 0.00 0.89 0.31 0.34 -0.92 118.33 128.17 1yst n VAL 205 Ca -0.05 -5.73 0.00 0.00 -0.01 0.00 0.00 64.34 58.55 1yst n VAL 205 Cb 0.50 -1.97 0.00 0.00 -0.91 0.00 0.00 33.84 31.46 1yst n VAL 205 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1yst n ASN 206 N 0.90 0.00 -0.00 4.52 5.15 -1.26 -2.13 115.26 122.43 1yst n ASN 206 Ca 0.30 0.11 -0.12 0.00 -0.60 0.00 0.00 54.58 54.27 1yst n ASN 206 Cb 0.35 -0.11 -0.09 0.00 -0.53 0.00 0.00 39.78 39.40 1yst n ASN 206 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1yst h ALA 207 N 1.65 -0.09 -3.08 5.20 0.00 -1.88 -3.45 119.26 117.60 1yst h ALA 207 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1yst h ALA 207 Cb 0.05 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1yst h ALA 207 CO 0.00 -0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.35 1yst n LEU 208 N -4.81 0.00 -4.44 0.00 4.32 -0.90 -2.72 117.00 108.45 1yst n LEU 208 Ca -0.08 0.00 -0.24 0.00 -0.02 0.00 0.00 56.01 55.67 1yst n LEU 208 Cb 0.31 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.00 1yst n LEU 208 CO 0.28 -0.01 -0.48 -0.94 -1.22 0.00 0.00 177.39 175.02 1yst s SER 209 N 0.52 3.36 0.31 -1.43 1.04 -1.26 -1.52 113.70 114.72 1yst s SER 209 Ca 0.00 -0.99 0.07 0.00 0.48 0.00 0.00 55.95 55.51 1yst s SER 209 Cb 0.00 -0.26 0.87 0.00 0.10 0.00 0.00 66.02 66.73 1yst s SER 209 CO 0.00 0.02 1.48 -1.54 0.98 0.00 0.00 173.24 174.18 1yst n SER 210 N -0.37 0.01 -4.97 7.02 3.41 -1.26 -4.16 113.62 113.30 1yst n SER 210 Ca -0.07 1.59 -0.21 0.00 -0.26 0.00 0.00 58.87 59.91 1yst n SER 210 Cb 0.59 -0.63 0.03 0.00 -0.26 0.00 0.00 64.21 63.94 1yst n SER 210 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1yst s ASP 211 N -4.88 5.38 0.00 4.04 -4.77 -1.26 -4.20 116.67 110.98 1yst s ASP 211 Ca -0.11 0.03 0.00 0.00 -3.30 0.00 0.00 52.55 49.17 1yst s ASP 211 Cb 0.29 -0.98 0.00 0.00 -1.09 0.00 0.00 42.92 41.14 1yst s ASP 211 CO 0.73 -1.05 0.00 0.18 0.70 0.00 0.00 175.17 175.73 1yst n LEU 212 N -2.28 0.00 0.09 2.11 7.99 -1.26 -4.87 117.00 118.78 1yst n LEU 212 Ca 0.07 0.00 -0.12 0.00 -0.01 0.00 0.00 56.01 55.95 1yst n LEU 212 Cb 0.59 0.00 -0.08 0.00 -0.11 0.00 0.00 43.42 43.82 1yst n LEU 212 CO 0.45 0.00 0.46 -0.26 -1.51 0.00 0.00 177.39 176.53 1yst h PHE 213 N 0.00 -0.26 0.00 -1.77 0.04 -1.73 -3.29 116.94 109.93 1yst h PHE 213 Ca 0.00 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 1yst h PHE 213 Cb 0.00 0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.22 1yst h PHE 213 CO 0.00 0.14 0.03 0.00 -0.60 0.00 0.00 178.31 177.87 1yst n ALA 214 N -2.53 2.97 0.00 2.45 0.00 -1.26 -2.32 120.51 119.82 1yst n ALA 214 Ca -0.08 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1yst n ALA 214 Cb 0.26 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 17.93 1yst n ALA 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yst n GLY 215 N 2.10 0.00 3.55 0.00 0.00 -1.24 -5.05 105.19 104.55 1yst n GLY 215 Ca 0.07 0.00 -0.64 0.00 0.00 0.00 0.00 46.02 45.45 1yst n GLY 215 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1yst n ILE 216 N -0.56 0.02 -1.69 -0.61 2.08 -0.98 -4.57 119.36 113.05 1yst n ILE 216 Ca 0.00 -0.01 -0.52 0.00 0.56 0.00 0.00 62.75 62.78 1yst n ILE 216 Cb 0.03 -0.58 -0.06 0.00 -0.75 0.00 0.00 39.64 38.28 1yst n ILE 216 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 1yst n PRO 217 N 5.53 1.77 -1.58 0.38 -0.02 -1.26 -4.83 135.00 134.99 1yst n PRO 217 Ca 0.40 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 62.11 1yst n PRO 217 Cb -0.03 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.02 1yst n PRO 217 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1yst n THR 218 N 4.81 2.23 0.56 3.45 -1.04 -1.26 -4.70 114.28 118.33 1yst n THR 218 Ca 0.24 -0.50 -0.01 0.00 -2.04 0.00 0.00 64.05 61.74 1yst n THR 218 Cb 0.23 -1.04 0.07 0.00 -1.82 0.00 0.00 70.33 67.78 1yst n THR 218 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1yst n ILE 219 N -0.33 0.88 0.00 12.58 3.06 -1.26 -4.91 119.36 129.38 1yst n ILE 219 Ca 0.10 -0.34 0.00 0.00 -2.50 0.00 0.00 62.75 60.00 1yst n ILE 219 Cb 0.37 -0.59 0.00 0.00 0.54 0.00 0.00 39.64 39.97 1yst n ILE 219 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1yst n LYS 220 N 0.14 0.00 0.00 9.51 5.02 -1.26 -4.52 118.16 127.05 1yst n LYS 220 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 1yst n LYS 220 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.56 1yst n LYS 220 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1yst n SER 221 N 0.00 0.00 0.06 4.39 2.88 -1.26 -5.12 113.62 114.57 1yst n SER 221 Ca 0.00 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 1yst n SER 221 Cb 0.00 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.37 1yst n SER 221 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1yst h PRO 222 N 0.00 -0.17 0.00 -1.46 0.11 -2.04 -3.43 132.00 125.01 1yst h PRO 222 Ca 0.00 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1yst h PRO 222 Cb 0.00 0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.15 1yst h PRO 222 CO 0.00 0.20 -0.24 2.41 -0.21 0.00 0.00 178.00 180.16 1yst n THR 223 N -4.99 0.55 -1.56 -1.15 -1.04 -1.26 -4.91 114.28 99.93 1yst n THR 223 Ca -0.09 0.38 -0.45 0.00 -2.04 0.00 0.00 64.05 61.86 1yst n THR 223 Cb 0.24 -1.84 -0.04 0.00 -1.82 0.00 0.00 70.33 66.87 1yst n THR 223 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1yst n GLU 224 N -3.18 1.72 -3.99 -2.82 1.02 -1.26 -4.70 120.64 107.42 1yst n GLU 224 Ca -0.03 0.46 -0.31 0.00 -0.02 0.00 0.00 57.16 57.25 1yst n GLU 224 Cb 0.13 -3.05 -0.05 0.00 -0.02 0.00 0.00 31.44 28.44 1yst n GLU 224 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1yst s VAL 225 N 8.17 5.00 -0.28 2.62 0.11 -1.26 -4.77 120.40 129.99 1yst s VAL 225 Ca 1.03 -0.51 -0.24 0.00 -2.93 0.00 0.00 61.98 59.33 1yst s VAL 225 Cb -0.46 -3.40 0.13 0.00 -1.53 0.00 0.00 36.38 31.11 1yst s VAL 225 CO 0.38 0.18 1.03 0.28 -3.33 0.00 0.00 175.10 173.64 1yst s THR 226 N -1.41 0.00 0.00 5.04 -1.32 -1.26 -4.65 115.64 112.04 1yst s THR 226 Ca 0.31 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.79 1yst s THR 226 Cb -0.13 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.86 1yst s THR 226 CO 0.23 0.00 0.00 0.18 -2.21 0.00 0.00 174.62 172.82 1yst n LEU 227 N 2.37 0.00 -0.43 9.08 7.99 -1.26 0.28 117.00 135.02 1yst n LEU 227 Ca -0.13 0.00 0.37 0.00 -0.01 0.00 0.00 56.01 56.24 1yst n LEU 227 Cb 0.56 0.00 0.70 0.00 -0.11 0.00 0.00 43.42 44.57 1yst n LEU 227 CO 0.02 0.00 1.32 0.25 -1.51 0.00 0.00 177.39 177.47 1yst h LEU 228 N 0.00 0.13 0.06 2.23 5.85 -1.87 0.94 115.31 122.66 1yst h LEU 228 Ca 0.00 0.04 -0.36 0.00 0.84 0.00 0.00 57.88 58.40 1yst h LEU 228 Cb 0.00 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1yst h LEU 228 CO 0.00 -0.03 -2.12 -0.62 -0.34 0.00 0.00 178.44 175.33 1yst n GLU 229 N -4.32 0.71 -0.09 1.25 1.02 0.79 -3.63 120.64 116.37 1yst n GLU 229 Ca 0.32 0.21 -0.13 0.00 -0.02 0.00 0.00 57.16 57.54 1yst n GLU 229 Cb 1.39 -1.65 -0.04 0.00 -0.02 0.00 0.00 31.44 31.11 1yst n GLU 229 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1yst h GLU 230 N 0.04 0.70 0.00 3.49 4.81 0.63 0.21 114.58 124.45 1yst h GLU 230 Ca -0.46 -0.38 -0.01 0.00 -0.13 0.00 0.00 59.36 58.39 1yst h GLU 230 Cb 2.01 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 31.41 1yst h GLU 230 CO 0.03 0.99 -0.04 -0.44 -0.73 0.00 0.00 179.01 178.83 1yst h ASP 231 N 0.43 0.00 0.03 1.04 3.32 0.42 -3.20 116.42 118.47 1yst h ASP 231 Ca 0.04 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.02 1yst h ASP 231 Cb 0.88 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.44 1yst h ASP 231 CO 0.07 0.04 -0.28 0.50 -1.72 0.00 0.00 179.24 177.85 1yst h LYS 232 N 0.00 0.13 0.58 3.56 3.64 -1.54 -2.61 116.57 120.32 1yst h LYS 232 Ca -0.00 -0.18 -0.03 0.00 -1.27 0.00 0.00 60.65 59.17 1yst h LYS 232 Cb 0.71 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1yst h LYS 232 CO 0.01 1.02 -0.30 0.82 -2.27 0.00 0.00 179.45 178.73 1yst h ILE 233 N -0.67 0.38 -0.83 2.00 2.04 -1.03 -1.35 117.51 118.05 1yst h ILE 233 Ca -0.04 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.90 1yst h ILE 233 Cb 1.15 0.38 -0.07 0.00 -0.74 0.00 0.00 36.82 37.54 1yst h ILE 233 CO 0.05 0.00 0.49 0.00 0.00 0.00 0.00 178.15 178.69 1yst h GLY 235 N 0.84 -0.84 2.00 0.00 0.00 -1.13 -0.65 103.07 103.30 1yst h GLY 235 Ca 0.39 0.49 0.00 0.00 0.00 0.00 0.00 47.33 48.21 1yst h GLY 235 CO -0.22 -0.27 0.00 -1.82 0.00 0.00 0.00 176.54 174.22 1yst h TYR 236 N -0.66 0.00 0.01 5.60 3.20 -0.81 -2.42 116.97 121.90 1yst h TYR 236 Ca 0.02 0.00 -0.24 0.00 3.14 0.00 0.00 58.73 61.65 1yst h TYR 236 Cb 0.68 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.96 1yst h TYR 236 CO -0.35 0.00 -1.00 -0.24 -1.64 0.00 0.00 178.16 174.93 1yst h VAL 237 N 0.00 1.36 -0.06 1.81 3.04 -0.54 -3.03 116.25 118.83 1yst h VAL 237 Ca 0.00 -2.42 -0.04 0.00 -1.01 0.00 0.00 66.70 63.24 1yst h VAL 237 Cb 0.50 2.44 -0.01 0.00 -2.01 0.00 0.00 31.29 32.21 1yst h VAL 237 CO 0.00 0.73 -0.14 0.00 -1.01 0.00 0.00 177.57 177.15 1yst h ALA 238 N 0.62 1.66 0.00 3.17 0.00 -0.63 -2.65 119.26 121.43 1yst h ALA 238 Ca -0.10 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1yst h ALA 238 Cb 1.64 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1yst h ALA 238 CO 0.18 0.25 0.04 0.41 0.00 0.00 0.00 179.25 180.13 1yst n GLY 239 N -1.02 -0.08 0.00 0.00 0.00 -1.09 -3.11 105.19 99.88 1yst n GLY 239 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1yst n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yst n GLY 240 N -0.96 1.54 0.00 -0.02 0.00 -1.00 -3.33 105.19 101.42 1yst n GLY 240 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1yst n GLY 240 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yst n LEU 241 N 0.00 0.00 0.06 0.99 7.99 -1.10 0.36 117.00 125.29 1yst n LEU 241 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 56.01 55.97 1yst n LEU 241 Cb 0.00 0.00 -0.01 0.00 -0.11 0.00 0.00 43.42 43.30 1yst n LEU 241 CO 0.00 0.00 0.18 -0.03 -1.51 0.00 0.00 177.39 176.03 1yst h MET 242 N 0.00 -0.17 -0.49 3.23 4.05 -1.83 -3.39 114.93 116.34 1yst h MET 242 Ca 0.00 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 1yst h MET 242 Cb 0.00 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 1yst h MET 242 CO 0.00 -0.11 0.00 0.66 0.23 0.00 0.00 176.91 177.69 1yst n TYR 243 N -3.13 0.00 0.00 1.39 4.02 0.14 -4.48 117.16 115.10 1yst n TYR 243 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.87 1yst n TYR 243 Cb 0.07 -0.05 0.00 0.00 -0.02 0.00 0.00 39.34 39.34 1yst n TYR 243 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1yst n ALA 244 N -0.24 0.00 -1.63 -0.72 0.00 0.16 -4.85 120.51 113.22 1yst n ALA 244 Ca 0.00 -0.08 -0.48 0.00 0.00 0.00 0.00 53.44 52.87 1yst n ALA 244 Cb 0.12 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.52 1yst n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yst n ALA 245 N -1.76 0.98 -0.29 0.00 0.00 -1.26 -4.80 120.51 113.39 1yst n ALA 245 Ca 0.00 0.16 0.27 0.00 0.00 0.00 0.00 53.44 53.87 1yst n ALA 245 Cb 0.00 -2.55 0.49 0.00 0.00 0.00 0.00 19.45 17.39 1yst n ALA 245 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1yst n PRO 246 N 7.14 -0.06 -1.56 0.00 -0.04 -1.26 -4.03 135.00 135.19 1yst n PRO 246 Ca 0.27 1.25 -0.13 0.00 -0.04 0.00 0.00 63.50 64.85 1yst n PRO 246 Cb 0.30 -2.22 -0.08 0.00 -0.04 0.00 0.00 33.50 31.47 1yst n PRO 246 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1yst n LYS 247 N -5.07 0.54 0.00 0.54 5.02 -1.26 -4.81 118.16 113.12 1yst n LYS 247 Ca 0.32 -0.85 0.00 0.00 -2.02 0.00 0.00 58.31 55.76 1yst n LYS 247 Cb 1.10 -3.64 0.00 0.00 -0.02 0.00 0.00 35.03 32.46 1yst n LYS 247 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1yst n ARG 248 N 8.72 0.00 -3.59 1.97 3.00 -1.26 -4.67 116.66 120.83 1yst n ARG 248 Ca 0.47 0.00 0.01 0.00 -0.00 0.00 0.00 57.85 58.34 1yst n ARG 248 Cb 0.42 -1.41 -0.01 0.00 0.00 0.00 0.00 32.46 31.46 1yst n ARG 248 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1yst s LYS 249 N -1.66 0.15 0.00 -0.14 -2.85 -1.26 -5.08 119.74 108.89 1yst s LYS 249 Ca 0.00 -0.07 0.00 0.00 -1.00 0.00 0.00 55.97 54.90 1yst s LYS 249 Cb 0.00 0.05 0.00 0.00 -2.06 0.00 0.00 37.83 35.82 1yst s LYS 249 CO 0.00 -0.07 0.00 0.45 0.10 0.00 0.00 175.35 175.83 1yst n SER 250 N -0.36 0.00 -4.46 0.03 2.88 -1.26 -5.14 113.62 105.30 1yst n SER 250 Ca -0.06 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.12 1yst n SER 250 Cb 0.62 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.15 1yst n SER 250 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1yst n VAL 251 N -0.15 1.68 -1.46 2.46 0.31 -1.26 -5.02 118.33 114.89 1yst n VAL 251 Ca 0.00 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1yst n VAL 251 Cb 0.00 -0.73 0.00 0.00 -0.91 0.00 0.00 33.84 32.20 1yst n VAL 251 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1yst n VAL 252 N -2.44 0.00 0.00 2.52 0.24 -1.26 -5.06 118.33 112.34 1yst n VAL 252 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.40 1yst n VAL 252 Cb 0.50 -0.14 0.00 0.00 -1.47 0.00 0.00 33.84 32.73 1yst n VAL 252 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1yst n ALA 253 N -3.00 0.00 -1.00 2.33 0.00 -1.26 -5.08 120.51 112.50 1yst n ALA 253 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1yst n ALA 253 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1yst n ALA 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yst n ALA 254 N -0.88 0.00 -1.00 0.00 0.00 -1.26 -4.82 120.51 112.56 1yst n ALA 254 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1yst n ALA 254 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 1yst n ALA 254 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1yst n MET 255 N 0.00 -0.01 -1.06 0.00 0.00 -1.26 -4.71 117.12 110.07 1yst n MET 255 Ca 0.00 -0.00 -0.41 0.00 -0.00 0.00 0.00 57.70 57.28 1yst n MET 255 Cb 0.00 -1.01 -0.06 0.00 0.00 0.00 0.00 33.22 32.15 1yst n MET 255 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1yst n LEU 256 N 3.44 0.50 -1.17 -0.89 7.99 -1.26 -4.33 117.00 121.28 1yst n LEU 256 Ca -0.02 0.75 -0.06 0.00 -0.01 0.00 0.00 56.01 56.67 1yst n LEU 256 Cb 0.67 -0.57 -0.06 0.00 -0.11 0.00 0.00 43.42 43.36 1yst n LEU 256 CO 0.47 -0.77 0.55 0.00 -1.51 0.00 0.00 177.39 176.13 1yst n ALA 257 N 2.00 0.27 0.00 -1.18 0.00 -1.26 -1.13 120.51 119.21 1yst n ALA 257 Ca 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1yst n ALA 257 Cb -0.01 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 18.82 1yst n ALA 257 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1yst n GLU 258 N 1.54 0.00 0.00 0.00 0.00 -1.26 -4.86 120.64 116.06 1yst n GLU 258 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.34 1yst n GLU 258 Cb 0.03 -2.79 0.00 0.00 0.00 0.00 0.00 31.44 28.68 1yst n GLU 258 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.13 178.11 1yst n TYR 259 N -0.88 0.00 0.00 4.31 9.36 -0.28 -5.18 117.16 124.48 1yst n TYR 259 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1yst n TYR 259 Cb 0.00 0.01 0.00 0.00 -0.63 0.00 0.00 39.34 38.72 1yst n TYR 259 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08