#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 181l s ASN 2 N 0.00 0.27 0.29 6.12 2.20 -1.26 -5.04 114.94 117.52 181l s ASN 2 Ca 0.00 -1.15 0.04 0.00 -0.94 0.00 0.00 52.86 50.81 181l s ASN 2 Cb 0.00 0.65 0.70 0.00 -2.00 0.00 0.00 41.25 40.59 181l s ASN 2 CO 0.00 -1.26 1.74 -0.29 -2.94 0.00 0.00 177.10 174.35 181l h ILE 3 N 2.18 0.62 -0.03 0.54 6.09 -1.97 -0.27 117.51 124.67 181l h ILE 3 Ca -0.28 -0.20 -0.00 0.00 -1.37 0.00 0.00 64.86 63.01 181l h ILE 3 Cb 1.25 -0.02 -0.00 0.00 0.47 0.00 0.00 36.82 38.52 181l h ILE 3 CO 0.37 0.11 0.00 -0.26 -3.07 0.00 0.00 178.15 175.30 181l h PHE 4 N 0.59 0.05 -0.24 2.19 0.04 -1.99 0.55 116.94 118.13 181l h PHE 4 Ca 0.55 -0.01 -0.07 0.00 2.80 0.00 0.00 57.97 61.24 181l h PHE 4 Cb 0.93 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 181l h PHE 4 CO -0.07 0.29 -0.18 0.93 -0.60 0.00 0.00 178.31 178.68 181l h GLU 5 N -0.21 0.42 0.03 1.51 5.08 -1.86 -0.69 114.58 118.85 181l h GLU 5 Ca 0.01 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 181l h GLU 5 Cb 0.27 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.48 181l h GLU 5 CO 0.00 0.58 -0.01 1.98 -1.00 0.00 0.00 179.01 180.56 181l h MET 6 N 0.38 -0.03 -0.04 2.33 4.05 -0.68 -2.69 114.93 118.25 181l h MET 6 Ca 0.07 0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 59.39 181l h MET 6 Cb 0.53 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.33 181l h MET 6 CO 0.03 0.16 -0.43 -0.07 0.23 0.00 0.00 176.91 176.83 181l h LEU 7 N -0.22 0.09 -1.45 3.39 3.38 -0.78 -1.73 115.31 117.99 181l h LEU 7 Ca -0.00 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 181l h LEU 7 Cb 0.21 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 181l h LEU 7 CO 0.01 0.51 -0.01 -0.09 0.09 0.00 0.00 178.44 178.95 181l h ARG 8 N 0.07 0.35 0.05 1.13 9.65 -1.03 0.14 114.38 124.74 181l h ARG 8 Ca 0.00 -0.06 -0.26 0.00 -1.10 0.00 0.00 59.98 58.56 181l h ARG 8 Cb 0.79 -0.06 0.02 0.00 -1.39 0.00 0.00 29.97 29.34 181l h ARG 8 CO 0.06 0.38 -1.04 0.82 2.80 0.00 0.00 179.97 182.99 181l h ILE 9 N 0.34 1.31 -0.01 1.20 2.04 -1.11 -2.16 117.51 119.12 181l h ILE 9 Ca 0.08 -2.30 -0.16 0.00 1.00 0.00 0.00 64.86 63.47 181l h ILE 9 Cb 0.24 2.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.85 181l h ILE 9 CO 0.01 0.70 -0.75 0.44 0.00 0.00 0.00 178.15 178.55 181l h ASP 10 N 0.26 0.08 0.00 1.72 3.32 -0.79 -3.36 116.42 117.65 181l h ASP 10 Ca -0.14 -0.06 -0.08 0.00 0.02 0.00 0.00 57.03 56.77 181l h ASP 10 Cb 1.72 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 41.23 181l h ASP 10 CO 0.20 0.80 -2.00 -0.62 -1.72 0.00 0.00 179.24 175.90 181l n GLU 11 N -3.69 0.69 -0.24 3.56 -0.58 0.45 -5.08 120.64 115.76 181l n GLU 11 Ca -0.01 -0.14 0.03 0.00 -0.42 0.00 0.00 57.16 56.62 181l n GLU 11 Cb 0.72 -1.47 -0.01 0.00 -0.57 0.00 0.00 31.44 30.11 181l n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 181l n GLY 12 N 1.49 -1.95 2.81 0.62 0.00 -0.81 -4.50 105.19 102.85 181l n GLY 12 Ca -0.10 -1.35 -0.21 0.00 0.00 0.00 0.00 46.02 44.36 181l n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 181l s LEU 13 N 0.00 0.89 -0.06 0.99 2.96 -1.26 -4.27 118.68 117.94 181l s LEU 13 Ca 0.00 -0.08 0.01 0.00 -0.22 0.00 0.00 54.13 53.84 181l s LEU 13 Cb 0.00 -0.39 0.02 0.00 0.50 0.00 0.00 46.19 46.32 181l s LEU 13 CO 0.00 -0.14 -0.05 -0.13 -1.32 0.00 0.00 176.35 174.71 181l s ARG 14 N 1.50 0.98 0.00 1.98 0.52 -0.31 -4.98 118.95 118.65 181l s ARG 14 Ca -0.02 -0.13 0.26 0.00 -0.52 0.00 0.00 55.73 55.32 181l s ARG 14 Cb -0.13 -0.99 0.77 0.00 0.52 0.00 0.00 34.95 35.12 181l s ARG 14 CO -0.03 -0.11 1.59 1.28 0.02 0.00 0.00 175.30 178.05 181l n LEU 15 N 4.22 1.99 -4.21 2.53 4.77 -1.26 0.72 117.00 125.75 181l n LEU 15 Ca -0.21 -0.68 -0.24 0.00 -0.03 0.00 0.00 56.01 54.85 181l n LEU 15 Cb 0.51 -0.01 -0.14 0.00 -2.33 0.00 0.00 43.42 41.45 181l n LEU 15 CO 0.21 0.34 -0.50 -0.75 -1.33 0.00 0.00 177.39 175.36 181l s LYS 16 N -1.97 1.24 0.21 3.23 2.47 -1.26 -2.35 119.74 121.30 181l s LYS 16 Ca 0.35 -0.85 -0.30 0.00 -1.56 0.00 0.00 55.97 53.60 181l s LYS 16 Cb 0.21 -1.31 -0.16 0.00 -1.46 0.00 0.00 37.83 35.11 181l s LYS 16 CO 0.32 0.33 0.97 -0.89 0.16 0.00 0.00 175.35 176.24 181l n ILE 17 N 1.93 1.51 -4.12 5.43 5.41 -0.95 -4.78 119.36 123.79 181l n ILE 17 Ca -0.17 -0.38 -0.11 0.00 1.00 0.00 0.00 62.75 63.09 181l n ILE 17 Cb 0.54 -0.69 -0.08 0.00 -0.71 0.00 0.00 39.64 38.70 181l n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 181l s TYR 18 N -0.68 0.87 -0.13 1.39 1.13 0.59 -4.95 117.35 115.57 181l s TYR 18 Ca 0.66 -1.14 -0.08 0.00 -1.41 0.00 0.00 57.07 55.11 181l s TYR 18 Cb -0.83 -0.27 -0.04 0.00 -1.10 0.00 0.00 41.96 39.72 181l s TYR 18 CO 0.56 -0.79 0.15 0.15 -2.51 0.00 0.00 175.55 173.11 181l s LYS 19 N -4.07 3.58 0.28 -3.49 1.02 -1.26 0.34 119.74 116.15 181l s LYS 19 Ca 0.33 -0.12 -0.05 0.00 0.02 0.00 0.00 55.97 56.15 181l s LYS 19 Cb 0.04 -3.23 0.07 0.00 -0.52 0.00 0.00 37.83 34.18 181l s LYS 19 CO 0.11 0.70 0.38 -0.40 -0.92 0.00 0.00 175.35 175.22 181l n ASP 20 N 2.23 0.02 0.29 2.83 5.75 0.13 -4.82 116.55 122.98 181l n ASP 20 Ca -0.19 -1.13 0.19 0.00 -0.01 0.00 0.00 54.79 53.64 181l n ASP 20 Cb 0.54 -0.29 0.86 0.00 -1.03 0.00 0.00 41.12 41.20 181l n ASP 20 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 181l h THR 21 N -1.23 0.00 -0.01 2.12 1.35 -1.99 -0.49 112.91 112.67 181l h THR 21 Ca -0.12 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 181l h THR 21 Cb 0.34 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 68.03 181l h THR 21 CO 0.09 0.00 -0.40 -0.62 -0.25 0.00 0.00 175.52 174.34 181l n GLU 22 N -3.01 0.98 -0.32 4.72 -0.58 -1.26 -4.95 120.64 116.22 181l n GLU 22 Ca -0.01 -0.72 0.00 0.00 -0.42 0.00 0.00 57.16 56.01 181l n GLU 22 Cb 0.21 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.59 181l n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 181l n GLY 23 N 1.39 0.81 3.89 0.62 0.00 -0.19 -5.08 105.19 106.63 181l n GLY 23 Ca 0.10 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 181l n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 181l s TYR 24 N -2.00 3.57 -0.03 1.61 2.02 -1.26 -4.62 117.35 116.64 181l s TYR 24 Ca 0.00 0.45 -0.31 0.00 -0.37 0.00 0.00 57.07 56.84 181l s TYR 24 Cb 0.00 -1.90 -0.09 0.00 -0.40 0.00 0.00 41.96 39.57 181l s TYR 24 CO 0.00 0.65 1.98 0.66 -1.57 0.00 0.00 175.55 177.27 181l n TYR 25 N 1.15 2.40 -4.22 2.71 4.01 -1.23 0.18 117.16 122.16 181l n TYR 25 Ca -0.12 -0.26 -0.13 0.00 -0.16 0.00 0.00 57.90 57.23 181l n TYR 25 Cb 0.53 -2.76 -0.10 0.00 -0.31 0.00 0.00 39.34 36.70 181l n TYR 25 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 181l s THR 26 N 4.82 0.62 0.13 -0.72 2.01 0.15 -0.64 115.64 122.02 181l s THR 26 Ca 0.92 -1.97 -0.13 0.00 0.31 0.00 0.00 61.69 60.82 181l s THR 26 Cb -0.49 -2.06 0.01 0.00 0.01 0.00 0.00 72.50 69.97 181l s THR 26 CO 0.44 -0.52 0.32 -0.51 -0.69 0.00 0.00 174.62 173.66 181l s ILE 27 N -3.69 0.09 0.00 1.82 2.07 -0.95 -0.30 121.20 120.24 181l s ILE 27 Ca 0.22 -0.94 0.00 0.00 -1.41 0.00 0.00 60.65 58.53 181l s ILE 27 Cb 0.06 -1.39 0.00 0.00 0.13 0.00 0.00 42.46 41.27 181l s ILE 27 CO 0.03 -0.40 0.00 0.61 -1.91 0.00 0.00 174.94 173.26 181l n GLY 28 N -0.18 2.37 2.94 1.50 0.00 0.22 -1.86 105.19 110.18 181l n GLY 28 Ca -0.14 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 181l n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 181l n ILE 29 N 0.00 4.92 -1.81 -0.61 5.41 -1.26 -1.16 119.36 124.85 181l n ILE 29 Ca 0.00 -5.83 -0.07 0.00 1.00 0.00 0.00 62.75 57.85 181l n ILE 29 Cb 0.00 -2.09 -0.01 0.00 -0.71 0.00 0.00 39.64 36.82 181l n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 181l n GLY 30 N 1.30 0.37 3.51 7.39 0.00 -1.25 -4.90 105.19 111.60 181l n GLY 30 Ca 0.26 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 45.21 181l n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 181l s HIS 31 N -2.31 2.69 0.19 1.61 5.04 -0.78 -4.94 115.29 116.79 181l s HIS 31 Ca 0.00 -0.17 -0.32 0.00 -1.54 0.00 0.00 55.06 53.03 181l s HIS 31 Cb 0.00 -4.23 -0.11 0.00 0.04 0.00 0.00 32.58 28.28 181l s HIS 31 CO 0.00 -1.54 1.68 -1.17 -2.34 0.00 0.00 174.74 171.37 181l s LEU 32 N 4.23 4.37 -0.22 8.88 2.96 -1.26 -2.23 118.68 135.40 181l s LEU 32 Ca 0.29 2.78 -0.11 0.00 -0.22 0.00 0.00 54.13 56.86 181l s LEU 32 Cb -0.13 -3.60 -0.18 0.00 0.50 0.00 0.00 46.19 42.79 181l s LEU 32 CO 0.16 -0.93 -0.03 0.18 -1.32 0.00 0.00 176.35 174.41 181l n LEU 33 N 4.11 2.28 -3.55 -0.68 4.77 0.19 -4.96 117.00 119.16 181l n LEU 33 Ca 0.15 0.24 -0.12 0.00 -0.03 0.00 0.00 56.01 56.25 181l n LEU 33 Cb 0.36 -0.94 -0.05 0.00 -2.33 0.00 0.00 43.42 40.47 181l n LEU 33 CO 0.63 0.62 0.67 0.28 -1.33 0.00 0.00 177.39 178.26 181l s THR 34 N -2.48 0.00 -2.25 -5.08 -1.32 -1.19 -4.93 115.64 98.39 181l s THR 34 Ca -0.32 0.00 0.27 0.00 -1.21 0.00 0.00 61.69 60.43 181l s THR 34 Cb 0.10 -1.00 0.41 0.00 -1.51 0.00 0.00 72.50 70.50 181l s THR 34 CO 0.60 0.00 1.63 0.29 -2.21 0.00 0.00 174.62 174.93 181l n LYS 35 N 0.62 1.39 -2.45 7.08 5.02 -1.26 -3.51 118.16 125.06 181l n LYS 35 Ca -0.12 -0.85 -0.36 0.00 -2.02 0.00 0.00 58.31 54.96 181l n LYS 35 Cb 0.58 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 34.08 181l n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 181l s SER 36 N -2.20 6.38 0.00 4.39 0.15 -1.26 -4.94 113.70 116.23 181l s SER 36 Ca 0.32 2.08 0.21 0.00 0.70 0.00 0.00 55.95 59.26 181l s SER 36 Cb 0.20 -2.58 1.03 0.00 -1.71 0.00 0.00 66.02 62.96 181l s SER 36 CO 0.41 -0.76 1.68 -2.65 1.20 0.00 0.00 173.24 173.12 181l n PRO 37 N -0.57 0.22 -2.99 5.44 -0.02 -1.26 -4.74 135.00 131.08 181l n PRO 37 Ca 0.08 0.10 -0.41 0.00 -2.02 0.00 0.00 63.50 61.25 181l n PRO 37 Cb 0.50 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.43 181l n PRO 37 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 181l s SER 38 N -2.69 6.79 0.57 2.55 0.15 -1.26 -4.90 113.70 114.90 181l s SER 38 Ca 0.17 0.97 0.34 0.00 0.70 0.00 0.00 55.95 58.14 181l s SER 38 Cb 0.14 -2.40 1.62 0.00 -1.71 0.00 0.00 66.02 63.67 181l s SER 38 CO 0.34 -0.39 2.09 0.25 1.20 0.00 0.00 173.24 176.73 181l h LEU 39 N 8.62 0.00 0.23 3.45 5.85 -1.99 -0.98 115.31 130.48 181l h LEU 39 Ca -0.28 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.12 181l h LEU 39 Cb 1.12 0.00 0.03 0.00 0.37 0.00 0.00 40.66 42.18 181l h LEU 39 CO 0.82 0.05 -1.44 0.78 -0.34 0.00 0.00 178.44 178.30 181l h ASN 40 N 0.00 0.75 -0.91 1.25 2.35 -1.97 0.15 115.58 117.19 181l h ASN 40 Ca -0.00 -0.81 0.01 0.00 -0.55 0.00 0.00 56.30 54.95 181l h ASN 40 Cb 0.36 -0.24 -0.05 0.00 0.05 0.00 0.00 38.32 38.44 181l h ASN 40 CO 0.01 1.64 0.60 0.00 -1.65 0.00 0.00 177.43 178.02 181l h ALA 41 N 0.25 1.36 -0.52 -0.83 0.00 -1.74 0.15 119.26 117.94 181l h ALA 41 Ca -0.23 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 181l h ALA 41 Cb 2.13 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 19.53 181l h ALA 41 CO 0.26 0.59 0.10 0.00 0.00 0.00 0.00 179.25 180.19 181l h ALA 42 N 1.44 0.69 -0.68 0.00 0.00 -1.15 -1.58 119.26 117.98 181l h ALA 42 Ca 0.34 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 181l h ALA 42 Cb -0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 181l h ALA 42 CO -0.08 0.41 0.24 0.87 0.00 0.00 0.00 179.25 180.69 181l h LYS 43 N 0.73 1.03 -0.46 0.00 1.57 0.27 -1.47 116.57 118.24 181l h LYS 43 Ca 0.16 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 181l h LYS 43 Cb 0.38 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 181l h LYS 43 CO 0.01 0.86 0.20 1.03 -0.57 0.00 0.00 179.45 180.98 181l h SER 44 N 1.00 0.61 -0.66 0.86 0.87 -0.25 -2.36 113.55 113.62 181l h SER 44 Ca 0.23 -0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.58 181l h SER 44 Cb 0.25 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.02 181l h SER 44 CO -0.01 0.59 0.20 -0.33 -0.53 0.00 0.00 176.83 176.75 181l h GLU 45 N 0.59 1.03 -0.42 2.24 4.39 -1.19 -2.13 114.58 119.10 181l h GLU 45 Ca 0.15 -0.22 0.03 0.00 0.34 0.00 0.00 59.36 59.66 181l h GLU 45 Cb 0.15 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 181l h GLU 45 CO -0.02 0.90 0.22 1.25 -1.16 0.00 0.00 179.01 180.20 181l h LEU 46 N 0.97 0.33 -0.83 1.33 5.85 -1.04 0.16 115.31 122.08 181l h LEU 46 Ca 0.21 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.87 181l h LEU 46 Cb 0.30 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 181l h LEU 46 CO -0.01 0.24 -0.04 0.44 -0.34 0.00 0.00 178.44 178.73 181l h ASP 47 N 0.44 0.82 -0.61 1.25 3.32 -1.27 -1.39 116.42 118.97 181l h ASP 47 Ca 0.18 -0.22 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 181l h ASP 47 Cb 0.07 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 181l h ASP 47 CO -0.11 0.90 0.18 0.50 -1.72 0.00 0.00 179.24 178.99 181l h LYS 48 N 0.77 0.96 -0.51 3.56 3.64 -1.02 0.24 116.57 124.21 181l h LYS 48 Ca 0.14 -0.21 -0.12 0.00 -1.27 0.00 0.00 60.65 59.19 181l h LYS 48 Cb 0.52 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 181l h LYS 48 CO 0.03 0.86 -0.15 0.00 -2.27 0.00 0.00 179.45 177.92 181l h ALA 49 N 1.06 0.71 0.00 5.00 0.00 -0.20 -3.29 119.26 122.53 181l h ALA 49 Ca 0.20 -0.37 -0.22 0.00 0.00 0.00 0.00 54.91 54.52 181l h ALA 49 Cb 0.31 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 181l h ALA 49 CO -0.00 0.65 -1.27 0.82 0.00 0.00 0.00 179.25 179.44 181l h ILE 50 N 0.87 1.05 0.00 0.00 1.08 -1.23 -3.48 117.51 115.80 181l h ILE 50 Ca 0.13 -2.73 0.00 0.00 -0.39 0.00 0.00 64.86 61.87 181l h ILE 50 Cb 0.72 2.48 0.00 0.00 -3.07 0.00 0.00 36.82 36.95 181l h ILE 50 CO 0.06 0.60 0.00 0.61 -0.69 0.00 0.00 178.15 178.72 181l n GLY 51 N 1.42 0.85 3.81 5.37 0.00 0.82 -5.03 105.19 112.42 181l n GLY 51 Ca -0.08 -0.61 -0.06 0.00 0.00 0.00 0.00 46.02 45.28 181l n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 181l s ARG 52 N -2.45 1.54 -0.59 1.61 1.70 -1.04 -5.05 118.95 114.66 181l s ARG 52 Ca 0.00 -0.84 -0.27 0.00 -0.47 0.00 0.00 55.73 54.14 181l s ARG 52 Cb 0.00 0.53 0.03 0.00 -0.57 0.00 0.00 34.95 34.94 181l s ARG 52 CO 0.00 -0.70 1.15 1.21 -1.08 0.00 0.00 175.30 175.88 181l s ASN 53 N -2.92 6.39 -0.00 -2.89 2.47 -1.26 -4.37 114.94 112.36 181l s ASN 53 Ca 0.11 -0.06 0.19 0.00 0.42 0.00 0.00 52.86 53.53 181l s ASN 53 Cb -0.04 -2.53 -0.22 0.00 -1.45 0.00 0.00 41.25 37.01 181l s ASN 53 CO 0.05 -1.47 0.81 0.35 -3.72 0.00 0.00 177.10 173.11 181l n THR 54 N 6.54 0.00 -1.96 -5.21 -2.24 -1.26 -4.97 114.28 105.18 181l n THR 54 Ca 0.06 -0.06 -0.17 0.00 -2.27 0.00 0.00 64.05 61.61 181l n THR 54 Cb 0.49 0.95 -0.04 0.00 -2.10 0.00 0.00 70.33 69.62 181l n THR 54 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 181l n ASN 55 N -1.50 -4.68 0.00 3.42 5.15 -1.26 -1.86 115.26 114.53 181l n ASN 55 Ca 0.03 0.25 0.00 0.00 -0.60 0.00 0.00 54.58 54.26 181l n ASN 55 Cb 0.32 -4.07 0.00 0.00 -0.53 0.00 0.00 39.78 35.50 181l n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 181l n GLY 56 N -0.61 0.63 2.95 8.20 0.00 -1.26 -5.03 105.19 110.06 181l n GLY 56 Ca -0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.67 181l n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 181l s VAL 57 N -2.09 0.46 0.30 1.61 1.01 -0.78 -2.23 120.40 118.69 181l s VAL 57 Ca 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 61.98 61.81 181l s VAL 57 Cb 0.00 -0.42 -0.06 0.00 0.00 0.00 0.00 36.38 35.90 181l s VAL 57 CO 0.00 0.15 0.04 0.27 0.00 0.00 0.00 175.10 175.56 181l s ILE 58 N 0.10 1.16 0.52 2.22 -4.36 -0.99 -4.78 121.20 115.07 181l s ILE 58 Ca -0.01 -2.02 0.01 0.00 -0.26 0.00 0.00 60.65 58.38 181l s ILE 58 Cb -0.05 -2.69 0.02 0.00 1.25 0.00 0.00 42.46 40.99 181l s ILE 58 CO -0.00 -0.07 0.74 0.42 0.24 0.00 0.00 174.94 176.27 181l s THR 59 N -3.32 3.10 0.22 8.37 -4.23 -1.26 -4.83 115.64 113.68 181l s THR 59 Ca 0.35 -0.61 -0.08 0.00 -1.18 0.00 0.00 61.69 60.17 181l s THR 59 Cb 0.08 -3.15 0.16 0.00 1.34 0.00 0.00 72.50 70.92 181l s THR 59 CO 0.14 -0.11 1.77 0.50 -0.54 0.00 0.00 174.62 176.39 181l h LYS 60 N 0.18 0.53 -0.62 3.99 3.64 -1.99 -0.49 116.57 121.81 181l h LYS 60 Ca -0.43 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 58.94 181l h LYS 60 Cb 1.28 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.94 181l h LYS 60 CO 0.54 0.35 0.39 -0.44 -2.27 0.00 0.00 179.45 178.02 181l h ASP 61 N 0.55 0.65 -0.89 4.20 3.32 -1.99 0.60 116.42 122.87 181l h ASP 61 Ca 0.33 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.36 181l h ASP 61 Cb 0.34 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.70 181l h ASP 61 CO -0.26 0.46 0.51 -0.33 -1.72 0.00 0.00 179.24 177.90 181l h GLU 62 N 0.78 1.23 -0.36 3.56 5.08 -1.77 0.18 114.58 123.28 181l h GLU 62 Ca 0.25 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 181l h GLU 62 Cb -0.01 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 28.97 181l h GLU 62 CO -0.09 0.88 0.20 0.00 -1.00 0.00 0.00 179.01 178.99 181l h ALA 63 N 1.28 0.46 -0.29 3.43 0.00 -0.39 -1.42 119.26 122.33 181l h ALA 63 Ca 0.32 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 181l h ALA 63 Cb -0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 181l h ALA 63 CO -0.06 -0.01 -0.09 0.93 0.00 0.00 0.00 179.25 180.02 181l h GLU 64 N 0.46 0.48 -0.22 0.00 5.08 -0.38 -0.51 114.58 119.49 181l h GLU 64 Ca 0.13 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 181l h GLU 64 Cb 0.06 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 181l h GLU 64 CO -0.02 0.58 0.05 -0.22 -1.00 0.00 0.00 179.01 178.41 181l h LYS 65 N 0.45 0.35 -0.60 2.33 3.64 -0.25 0.79 116.57 123.28 181l h LYS 65 Ca 0.09 -0.08 0.05 0.00 -1.27 0.00 0.00 60.65 59.44 181l h LYS 65 Cb 0.44 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.17 181l h LYS 65 CO 0.02 0.46 0.32 -0.07 -2.27 0.00 0.00 179.45 177.92 181l h LEU 66 N 0.17 0.48 -0.28 5.20 3.38 -0.91 -1.60 115.31 121.75 181l h LEU 66 Ca 0.07 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.10 181l h LEU 66 Cb 0.27 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 181l h LEU 66 CO 0.00 0.32 0.06 0.15 0.09 0.00 0.00 178.44 179.05 181l h PHE 67 N 0.61 0.09 -0.76 1.13 3.57 -0.81 0.59 116.94 121.36 181l h PHE 67 Ca 0.27 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.82 181l h PHE 67 Cb 0.16 -0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.85 181l h PHE 67 CO -0.09 0.02 0.47 -0.91 -2.23 0.00 0.00 178.31 175.58 181l h ASN 68 N 0.16 0.77 -0.58 0.41 2.35 -0.28 -1.37 115.58 117.04 181l h ASN 68 Ca 0.13 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.84 181l h ASN 68 Cb 0.13 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 181l h ASN 68 CO -0.17 0.52 0.19 1.56 -1.65 0.00 0.00 177.43 177.88 181l h GLN 69 N 0.91 0.89 -0.25 0.81 4.20 -0.72 -2.47 115.11 118.47 181l h GLN 69 Ca 0.32 -0.19 -0.09 0.00 0.06 0.00 0.00 58.65 58.75 181l h GLN 69 Cb 0.07 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 181l h GLN 69 CO -0.13 0.79 -0.23 -0.44 -0.67 0.00 0.00 178.83 178.16 181l h ASP 70 N 0.81 0.47 -0.14 1.46 3.32 -0.24 -0.93 116.42 121.17 181l h ASP 70 Ca 0.19 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 181l h ASP 70 Cb 0.27 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 181l h ASP 70 CO -0.01 0.70 -0.09 0.58 -1.72 0.00 0.00 179.24 178.71 181l h VAL 71 N 0.42 1.33 -0.24 -1.35 2.07 -1.22 -1.29 116.25 115.97 181l h VAL 71 Ca 0.07 -1.17 0.06 0.00 0.82 0.00 0.00 66.70 66.48 181l h VAL 71 Cb 0.63 1.79 -0.06 0.00 -1.52 0.00 0.00 31.29 32.13 181l h VAL 71 CO 0.04 0.34 -0.16 -0.78 0.02 0.00 0.00 177.57 177.04 181l h ASP 72 N -0.04 -0.51 -1.00 0.57 3.58 -1.32 -1.01 116.42 116.70 181l h ASP 72 Ca 0.03 0.11 0.03 0.00 0.42 0.00 0.00 57.03 57.61 181l h ASP 72 Cb 0.58 0.26 -0.05 0.00 1.72 0.00 0.00 39.33 41.83 181l h ASP 72 CO 0.02 -0.19 0.66 0.00 -2.88 0.00 0.00 179.24 176.85 181l h ALA 73 N 1.02 1.32 -0.14 -0.78 0.00 -1.15 -1.06 119.26 118.47 181l h ALA 73 Ca 0.13 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 181l h ALA 73 Cb 0.34 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 181l h ALA 73 CO -0.33 0.60 0.09 0.00 0.00 0.00 0.00 179.25 179.61 181l h ALA 74 N 1.40 0.18 -0.14 0.00 0.00 -0.06 0.11 119.26 120.75 181l h ALA 74 Ca 0.39 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.29 181l h ALA 74 Cb -0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 181l h ALA 74 CO -0.11 -0.32 0.03 0.28 0.00 0.00 0.00 179.25 179.14 181l h VAL 75 N 0.17 0.94 -0.83 0.00 2.07 -0.75 -1.51 116.25 116.35 181l h VAL 75 Ca 0.05 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.55 181l h VAL 75 Cb 0.01 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 181l h VAL 75 CO -0.01 0.02 0.55 0.03 0.02 0.00 0.00 177.57 178.18 181l h ARG 76 N 0.09 1.09 -0.62 1.57 3.08 -1.03 0.18 114.38 118.74 181l h ARG 76 Ca 0.06 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 181l h ARG 76 Cb 0.05 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 29.83 181l h ARG 76 CO -0.08 0.72 0.35 0.78 -1.07 0.00 0.00 179.97 180.68 181l h GLY 77 N 1.12 0.91 0.92 0.04 0.00 -0.32 -0.20 103.07 105.54 181l h GLY 77 Ca 0.31 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 181l h GLY 77 CO -0.07 0.38 0.11 -2.22 0.00 0.00 0.00 176.54 174.74 181l h ILE 78 N 0.84 1.14 0.00 2.60 2.04 -0.18 -2.48 117.51 121.47 181l h ILE 78 Ca 0.22 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 181l h ILE 78 Cb 0.01 0.98 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 181l h ILE 78 CO -0.04 0.14 -0.04 -0.07 0.00 0.00 0.00 178.15 178.15 181l h LEU 79 N 0.25 0.00 0.00 1.44 3.38 0.12 -2.14 115.31 118.36 181l h LEU 79 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 181l h LEU 79 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 181l h LEU 79 CO -0.01 0.04 -0.69 0.54 0.09 0.00 0.00 178.44 178.41 181l n ARG 80 N -3.27 0.19 -3.03 1.13 1.74 -0.16 -4.81 116.66 108.45 181l n ARG 80 Ca -0.02 0.03 -0.41 0.00 -0.77 0.00 0.00 57.85 56.69 181l n ARG 80 Cb 0.19 -1.60 -0.06 0.00 -1.02 0.00 0.00 32.46 29.97 181l n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 181l s ASN 81 N -3.73 6.62 0.51 0.55 3.84 -0.81 -4.95 114.94 116.96 181l s ASN 81 Ca 0.07 0.67 0.17 0.00 0.21 0.00 0.00 52.86 53.99 181l s ASN 81 Cb 0.15 -2.37 1.24 0.00 -0.55 0.00 0.00 41.25 39.72 181l s ASN 81 CO 0.74 -0.50 2.10 0.00 -2.79 0.00 0.00 177.10 176.65 181l h ALA 82 N 8.00 2.08 0.00 1.71 0.00 -1.89 -0.08 119.26 129.08 181l h ALA 82 Ca -0.25 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.45 181l h ALA 82 Cb 1.11 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 181l h ALA 82 CO 0.83 -0.13 -1.20 0.87 0.00 0.00 0.00 179.25 179.62 181l h LYS 83 N 0.08 0.00 0.11 0.00 6.56 -1.93 -3.40 116.57 118.00 181l h LYS 83 Ca 0.09 0.00 -0.32 0.00 -1.06 0.00 0.00 60.65 59.36 181l h LYS 83 Cb 0.25 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.90 181l h LYS 83 CO -0.01 0.60 -1.72 -0.07 -2.06 0.00 0.00 179.45 176.19 181l h LEU 84 N 0.00 0.37 -0.65 2.94 3.38 -1.60 -3.40 115.31 116.35 181l h LEU 84 Ca -0.12 -0.86 0.13 0.00 0.09 0.00 0.00 57.88 57.11 181l h LEU 84 Cb 1.72 -0.12 -0.12 0.00 0.09 0.00 0.00 40.66 42.23 181l h LEU 84 CO 0.08 1.74 -0.19 0.50 0.09 0.00 0.00 178.44 180.67 181l h LYS 85 N -0.17 -0.02 -0.88 1.13 3.64 -1.02 -0.62 116.57 118.63 181l h LYS 85 Ca -0.37 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.99 181l h LYS 85 Cb 1.87 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.65 181l h LYS 85 CO 0.05 -0.01 0.47 -1.35 -2.27 0.00 0.00 179.45 176.33 181l h PRO 86 N -0.02 1.24 -0.04 1.90 0.11 -1.79 0.79 132.00 134.19 181l h PRO 86 Ca 0.31 -0.15 -0.01 0.00 0.11 0.00 0.00 66.00 66.26 181l h PRO 86 Cb 0.49 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 31.37 181l h PRO 86 CO -0.68 0.91 0.00 0.28 -0.21 0.00 0.00 178.00 178.30 181l h VAL 87 N 1.24 1.24 -0.89 3.15 2.07 -1.51 -2.42 116.25 119.13 181l h VAL 87 Ca 0.31 -0.72 0.11 0.00 0.82 0.00 0.00 66.70 67.22 181l h VAL 87 Cb 0.05 1.64 -0.08 0.00 -1.52 0.00 0.00 31.29 31.38 181l h VAL 87 CO -0.05 0.20 0.52 0.22 0.02 0.00 0.00 177.57 178.48 181l h TYR 88 N -0.21 0.95 -0.06 1.57 3.20 -0.92 -1.39 116.97 120.11 181l h TYR 88 Ca 0.01 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.83 181l h TYR 88 Cb 0.31 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 181l h TYR 88 CO 0.03 0.37 -0.36 -0.44 -1.64 0.00 0.00 178.16 176.12 181l h ASP 89 N 0.84 0.13 1.14 -2.11 3.32 -0.71 -2.33 116.42 116.70 181l h ASP 89 Ca 0.44 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.44 181l h ASP 89 Cb 0.44 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.95 181l h ASP 89 CO -0.27 0.49 0.00 0.77 -1.72 0.00 0.00 179.24 178.51 181l h SER 90 N 0.11 0.00 -3.65 6.45 4.64 -0.74 -3.46 113.55 116.89 181l h SER 90 Ca 0.01 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.84 181l h SER 90 Cb 0.69 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.82 181l h SER 90 CO 0.05 0.00 0.15 -0.76 -0.87 0.00 0.00 176.83 175.40 181l s LEU 91 N -4.81 3.57 0.87 5.97 1.43 -0.88 -5.07 118.68 119.75 181l s LEU 91 Ca 0.07 0.97 -0.13 0.00 -1.03 0.00 0.00 54.13 54.00 181l s LEU 91 Cb 0.10 -3.93 0.12 0.00 0.03 0.00 0.00 46.19 42.52 181l s LEU 91 CO 0.51 -0.63 1.22 1.51 0.23 0.00 0.00 176.35 179.18 181l s ASP 92 N -4.12 3.96 0.28 2.29 -4.77 -1.26 -4.81 116.67 108.24 181l s ASP 92 Ca 0.48 0.65 -0.03 0.00 -3.30 0.00 0.00 52.55 50.35 181l s ASP 92 Cb -0.10 -1.01 0.37 0.00 -1.09 0.00 0.00 42.92 41.09 181l s ASP 92 CO 0.46 -2.24 1.95 0.00 0.70 0.00 0.00 175.17 176.04 181l h ALA 93 N -1.29 1.36 0.20 2.11 0.00 -1.97 -0.16 119.26 119.50 181l h ALA 93 Ca -0.46 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 181l h ALA 93 Cb 1.30 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.73 181l h ALA 93 CO 0.57 0.59 -0.09 0.28 0.00 0.00 0.00 179.25 180.60 181l h VAL 94 N 1.22 0.90 -0.63 0.00 2.07 -1.94 -3.01 116.25 114.86 181l h VAL 94 Ca 0.33 -0.74 0.10 0.00 0.82 0.00 0.00 66.70 67.22 181l h VAL 94 Cb -0.13 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 181l h VAL 94 CO -0.07 0.16 0.42 0.03 0.02 0.00 0.00 177.57 178.13 181l h ARG 95 N -0.64 0.43 -0.42 1.57 3.08 -1.80 0.13 114.38 116.72 181l h ARG 95 Ca -0.03 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 181l h ARG 95 Cb 0.46 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 181l h ARG 95 CO 0.04 0.28 0.15 0.00 -1.07 0.00 0.00 179.97 179.38 181l h ARG 96 N 0.44 0.60 -0.53 0.04 3.08 -0.93 -1.13 114.38 115.96 181l h ARG 96 Ca 0.29 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 60.18 181l h ARG 96 Cb 0.56 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 181l h ARG 96 CO -0.09 0.52 0.01 0.00 -1.07 0.00 0.00 179.97 179.34 181l h ALA 97 N 1.57 1.02 -0.48 0.04 0.00 -0.62 -1.10 119.26 119.69 181l h ALA 97 Ca 0.14 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 181l h ALA 97 Cb 0.15 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 181l h ALA 97 CO -0.01 0.61 0.15 0.00 0.00 0.00 0.00 179.25 180.00 181l h ALA 98 N 1.18 1.36 -0.54 0.00 0.00 -0.84 -1.36 119.26 119.07 181l h ALA 98 Ca 0.16 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 181l h ALA 98 Cb 0.48 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 181l h ALA 98 CO 0.02 0.47 -0.12 0.00 0.00 0.00 0.00 179.25 179.61 181l h ALA 99 N 1.47 0.77 -0.68 0.00 0.00 -0.59 -2.47 119.26 117.76 181l h ALA 99 Ca 0.16 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 181l h ALA 99 Cb 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 181l h ALA 99 CO -0.01 0.67 0.17 0.82 0.00 0.00 0.00 179.25 180.90 181l h ILE 100 N 0.90 1.26 -0.11 0.00 2.04 -0.73 -2.55 117.51 118.32 181l h ILE 100 Ca 0.14 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 65.05 181l h ILE 100 Cb 0.69 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 181l h ILE 100 CO 0.05 0.36 0.05 -1.13 0.00 0.00 0.00 178.15 177.49 181l h ASN 101 N 1.03 0.08 -0.45 1.72 -0.73 -1.06 0.23 115.58 116.40 181l h ASN 101 Ca 0.22 0.00 0.04 0.00 1.87 0.00 0.00 56.30 58.43 181l h ASN 101 Cb 0.36 -0.01 -0.04 0.00 0.27 0.00 0.00 38.32 38.89 181l h ASN 101 CO 0.00 0.07 0.22 0.24 -0.37 0.00 0.00 177.43 177.59 181l h MET 102 N 0.12 0.43 -0.60 6.67 2.86 -1.26 -1.89 114.93 121.26 181l h MET 102 Ca 0.04 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.58 181l h MET 102 Cb 0.00 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.54 181l h MET 102 CO -0.03 0.29 0.06 0.28 1.06 0.00 0.00 176.91 178.57 181l h VAL 103 N 0.44 1.26 -0.75 -2.22 2.07 -1.02 0.20 116.25 116.23 181l h VAL 103 Ca 0.19 -1.06 0.03 0.00 0.82 0.00 0.00 66.70 66.69 181l h VAL 103 Cb 0.10 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 181l h VAL 103 CO -0.14 0.39 0.49 0.15 0.02 0.00 0.00 177.57 178.48 181l h PHE 104 N 0.93 0.89 0.10 1.57 3.04 -0.16 0.12 116.94 123.42 181l h PHE 104 Ca 0.18 0.02 -0.13 0.00 3.98 0.00 0.00 57.97 62.02 181l h PHE 104 Cb 0.47 -0.30 0.01 0.00 2.56 0.00 0.00 35.95 38.70 181l h PHE 104 CO 0.03 0.52 -0.60 0.37 -2.02 0.00 0.00 178.31 176.62 181l h GLN 105 N 0.92 0.21 -0.02 1.11 4.15 -0.98 -3.41 115.11 117.09 181l h GLN 105 Ca 0.30 -0.36 0.00 0.00 0.77 0.00 0.00 58.65 59.36 181l h GLN 105 Cb 0.04 0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.87 181l h GLN 105 CO -0.08 1.17 0.00 0.00 -1.93 0.00 0.00 178.83 177.99 181l n MET 106 N -4.26 0.03 0.00 1.69 0.00 0.67 -5.10 117.12 110.16 181l n MET 106 Ca -0.13 -0.91 0.00 0.00 0.00 0.00 0.00 57.70 56.66 181l n MET 106 Cb 0.73 -1.11 0.00 0.00 0.00 0.00 0.00 33.22 32.84 181l n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 181l n GLY 107 N 0.28 -2.11 0.20 3.17 0.00 0.40 -3.70 105.19 103.42 181l n GLY 107 Ca 0.03 -1.43 0.01 0.00 0.00 0.00 0.00 46.02 44.63 181l n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 181l h GLU 108 N 0.00 0.13 0.04 1.61 4.81 -1.92 -1.15 114.58 118.09 181l h GLU 108 Ca 0.00 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 181l h GLU 108 Cb 0.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 181l h GLU 108 CO 0.00 0.47 -0.02 1.15 -0.73 0.00 0.00 179.01 179.88 181l h THR 109 N 0.11 1.27 -0.61 0.32 2.02 -1.97 -1.77 112.91 112.28 181l h THR 109 Ca 0.01 -1.08 0.08 0.00 0.77 0.00 0.00 66.41 66.19 181l h THR 109 Cb 0.68 1.98 -0.11 0.00 -1.74 0.00 0.00 68.15 68.97 181l h THR 109 CO 0.05 0.27 -0.48 1.23 0.37 0.00 0.00 175.52 176.96 181l h GLY 110 N -0.54 -0.60 0.99 2.16 0.00 -1.55 -1.52 103.07 102.01 181l h GLY 110 Ca -0.01 0.63 0.00 0.00 0.00 0.00 0.00 47.33 47.95 181l h GLY 110 CO 0.01 -0.13 0.29 -2.08 0.00 0.00 0.00 176.54 174.63 181l h VAL 111 N -0.23 1.13 -1.14 4.60 2.07 -1.24 -2.57 116.25 118.88 181l h VAL 111 Ca 0.16 -0.28 0.33 0.00 0.82 0.00 0.00 66.70 67.73 181l h VAL 111 Cb 0.55 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 181l h VAL 111 CO -0.72 0.13 0.82 0.00 0.02 0.00 0.00 177.57 177.83 181l h ALA 112 N 1.15 3.08 0.00 1.67 0.00 -0.36 0.25 119.26 125.04 181l h ALA 112 Ca 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.04 181l h ALA 112 Cb -0.03 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.84 181l h ALA 112 CO -0.03 -1.40 0.00 0.41 0.00 0.00 0.00 179.25 178.22 181l n GLY 113 N -1.76 -1.13 2.10 0.00 0.00 -0.91 -3.88 105.19 99.61 181l n GLY 113 Ca 0.24 -0.11 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 181l n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 181l n PHE 114 N -1.32 1.35 -0.31 1.61 3.01 0.87 -4.74 117.46 117.93 181l n PHE 114 Ca 0.11 -1.87 -0.06 0.00 1.01 0.00 0.00 57.45 56.64 181l n PHE 114 Cb 0.21 -1.14 -0.02 0.00 -0.01 0.00 0.00 39.48 38.52 181l n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 181l h THR 115 N 1.44 0.05 -0.62 4.37 2.02 -1.79 -0.41 112.91 117.97 181l h THR 115 Ca 0.30 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.51 181l h THR 115 Cb 0.90 0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 67.32 181l h THR 115 CO 0.72 0.00 0.39 0.78 0.37 0.00 0.00 175.52 177.78 181l h ASN 116 N -0.10 0.64 -0.68 4.18 2.35 -1.95 -1.94 115.58 118.08 181l h ASN 116 Ca 0.24 -0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.92 181l h ASN 116 Cb 0.55 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 181l h ASN 116 CO -0.84 0.45 0.19 0.28 -1.65 0.00 0.00 177.43 175.86 181l h SER 117 N 0.77 1.03 -0.41 5.81 0.02 -1.72 -2.08 113.55 116.97 181l h SER 117 Ca 0.25 -0.21 0.04 0.00 -0.84 0.00 0.00 61.79 61.03 181l h SER 117 Cb -0.00 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.23 181l h SER 117 CO -0.09 0.98 0.17 -0.07 -1.14 0.00 0.00 176.83 176.68 181l h LEU 118 N 1.05 0.22 -0.78 5.07 3.38 -0.73 0.16 115.31 123.68 181l h LEU 118 Ca 0.22 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.21 181l h LEU 118 Cb 0.34 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 181l h LEU 118 CO -0.00 0.16 0.41 -0.09 0.09 0.00 0.00 178.44 179.01 181l h ARG 119 N 0.36 1.10 -0.51 1.13 2.43 -1.19 -0.45 114.38 117.24 181l h ARG 119 Ca 0.19 -0.14 -0.10 0.00 -0.81 0.00 0.00 59.98 59.12 181l h ARG 119 Cb 0.14 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 181l h ARG 119 CO -0.16 0.83 -0.08 0.52 -1.51 0.00 0.00 179.97 179.56 181l h MET 120 N 1.09 0.93 -0.52 0.20 2.86 -0.64 -1.30 114.93 117.55 181l h MET 120 Ca 0.27 -0.32 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 181l h MET 120 Cb 0.06 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 181l h MET 120 CO -0.04 0.97 0.12 -0.07 1.06 0.00 0.00 176.91 178.95 181l h LEU 121 N 0.84 0.80 -1.72 1.22 3.38 -0.18 -1.89 115.31 117.76 181l h LEU 121 Ca 0.14 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.88 181l h LEU 121 Cb 0.61 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 181l h LEU 121 CO 0.04 0.83 0.21 -0.61 0.09 0.00 0.00 178.44 179.00 181l h GLN 122 N 0.73 0.37 -0.01 1.13 4.15 -0.73 0.24 115.11 121.00 181l h GLN 122 Ca 0.16 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.56 181l h GLN 122 Cb 0.35 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.96 181l h GLN 122 CO 0.00 0.25 -0.03 1.04 -1.93 0.00 0.00 178.83 178.16 181l n GLN 123 N -4.49 1.29 -2.39 1.69 6.02 -0.52 -4.92 117.38 114.06 181l n GLN 123 Ca 0.02 -0.57 -0.15 0.00 -0.01 0.00 0.00 57.00 56.29 181l n GLN 123 Cb 0.10 -1.49 -0.00 0.00 1.02 0.00 0.00 30.24 29.87 181l n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 181l n LYS 124 N -0.36 -1.67 -3.10 -1.09 5.02 0.86 -4.94 118.16 112.87 181l n LYS 124 Ca 0.19 0.73 -0.44 0.00 -2.02 0.00 0.00 58.31 56.77 181l n LYS 124 Cb 0.28 -5.08 -0.00 0.00 -0.02 0.00 0.00 35.03 30.21 181l n LYS 124 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 181l s ARG 125 N -4.88 4.12 0.08 1.97 0.52 -0.89 -4.89 118.95 114.98 181l s ARG 125 Ca 0.04 -2.82 -0.29 0.00 -0.52 0.00 0.00 55.73 52.14 181l s ARG 125 Cb -0.02 -4.86 -0.17 0.00 0.52 0.00 0.00 34.95 30.42 181l s ARG 125 CO 0.05 -1.56 1.67 -1.49 0.02 0.00 0.00 175.30 173.99 181l h TRP 126 N 7.00 -0.53 -0.85 -0.53 4.06 -1.90 -1.02 115.95 122.18 181l h TRP 126 Ca 0.26 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.20 181l h TRP 126 Cb 0.88 0.18 -0.04 0.00 -1.00 0.00 0.00 29.16 29.18 181l h TRP 126 CO 0.97 -0.33 0.54 -0.44 -3.56 0.00 0.00 178.44 175.62 181l h ASP 127 N -0.56 0.99 -0.73 -3.49 5.19 -1.90 -1.57 116.42 114.35 181l h ASP 127 Ca -0.05 -0.04 -0.02 0.00 -0.62 0.00 0.00 57.03 56.29 181l h ASP 127 Cb 0.44 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 39.67 181l h ASP 127 CO 0.08 0.74 0.36 -0.33 -3.12 0.00 0.00 179.24 176.97 181l h GLU 128 N 1.16 1.04 -0.67 3.56 5.08 -1.94 -1.99 114.58 120.82 181l h GLU 128 Ca 0.31 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.45 181l h GLU 128 Cb -0.10 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 28.93 181l h GLU 128 CO -0.06 0.81 0.15 0.00 -1.00 0.00 0.00 179.01 178.91 181l h ALA 129 N 1.18 0.99 -0.72 3.43 0.00 -0.92 -1.29 119.26 121.93 181l h ALA 129 Ca 0.25 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.94 181l h ALA 129 Cb 0.10 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 181l h ALA 129 CO -0.03 0.65 0.46 0.00 0.00 0.00 0.00 179.25 180.33 181l h ALA 130 N 1.14 0.93 -0.20 0.00 0.00 -0.78 0.41 119.26 120.75 181l h ALA 130 Ca 0.21 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 181l h ALA 130 Cb 0.37 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 181l h ALA 130 CO 0.00 0.28 0.03 0.28 0.00 0.00 0.00 179.25 179.84 181l h VAL 131 N 0.92 1.23 -0.52 0.00 2.07 -1.04 -2.93 116.25 115.98 181l h VAL 131 Ca 0.28 -0.76 -0.07 0.00 0.82 0.00 0.00 66.70 66.97 181l h VAL 131 Cb -0.04 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 181l h VAL 131 CO -0.09 0.23 0.05 -1.13 0.02 0.00 0.00 177.57 176.66 181l h ASN 132 N 0.12 0.79 -0.14 0.57 -0.73 -0.52 -2.55 115.58 113.12 181l h ASN 132 Ca 0.06 -0.18 -0.03 0.00 1.87 0.00 0.00 56.30 58.03 181l h ASN 132 Cb 0.33 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.69 181l h ASN 132 CO 0.00 0.83 0.02 -0.07 -0.37 0.00 0.00 177.43 177.84 181l h LEU 133 N 0.79 0.30 -1.69 0.34 3.38 -0.12 -2.50 115.31 115.82 181l h LEU 133 Ca 0.16 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 181l h LEU 133 Cb 0.40 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 181l h LEU 133 CO 0.01 0.34 -0.05 0.00 0.09 0.00 0.00 178.44 178.83 181l h ALA 134 N 1.70 1.04 -0.43 1.53 0.00 -1.27 -3.34 119.26 118.49 181l h ALA 134 Ca 0.08 -0.05 -0.73 0.00 0.00 0.00 0.00 54.91 54.21 181l h ALA 134 Cb 0.19 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.88 181l h ALA 134 CO 0.00 0.06 2.67 1.63 0.00 0.00 0.00 179.25 183.61 181l n LYS 135 N -3.21 3.36 -3.61 0.00 5.02 -0.94 -4.64 118.16 114.14 181l n LYS 135 Ca -0.00 -3.03 -0.13 0.00 -2.02 0.00 0.00 58.31 53.13 181l n LYS 135 Cb 0.28 -3.05 -0.06 0.00 -0.02 0.00 0.00 35.03 32.18 181l n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 181l s SER 136 N 1.91 -0.37 0.23 4.39 1.04 -1.25 -5.01 113.70 114.64 181l s SER 136 Ca 0.46 0.08 -0.07 0.00 0.48 0.00 0.00 55.95 56.90 181l s SER 136 Cb 0.13 0.46 0.31 0.00 0.10 0.00 0.00 66.02 67.02 181l s SER 136 CO -0.05 -0.70 1.83 -0.09 0.98 0.00 0.00 173.24 175.21 181l h ARG 137 N 2.85 0.81 -0.59 4.02 2.43 -1.92 -1.40 114.38 120.58 181l h ARG 137 Ca -0.31 -0.05 0.12 0.00 -0.81 0.00 0.00 59.98 58.93 181l h ARG 137 Cb 1.21 -0.18 -0.11 0.00 -0.42 0.00 0.00 29.97 30.46 181l h ARG 137 CO 0.42 0.54 -0.18 2.35 -1.51 0.00 0.00 179.97 181.59 181l h TRP 138 N 0.84 -0.41 -0.39 2.20 7.01 -1.94 0.19 115.95 123.45 181l h TRP 138 Ca 0.35 0.06 -0.08 0.00 2.11 0.00 0.00 58.89 61.33 181l h TRP 138 Cb 0.20 0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 27.52 181l h TRP 138 CO -0.05 -0.28 -0.06 -0.92 -2.79 0.00 0.00 178.44 174.34 181l h TYR 139 N -0.03 0.81 -0.32 2.65 3.20 -1.73 -1.19 116.97 120.36 181l h TYR 139 Ca 0.28 -0.16 -0.08 0.00 3.14 0.00 0.00 58.73 61.91 181l h TYR 139 Cb 0.46 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 181l h TYR 139 CO -0.51 0.85 -0.15 -0.91 -1.64 0.00 0.00 178.16 175.80 181l h ASN 140 N 0.54 0.55 0.15 -2.11 4.21 -0.12 -2.38 115.58 116.43 181l h ASN 140 Ca 0.10 -0.16 -0.24 0.00 1.21 0.00 0.00 56.30 57.22 181l h ASN 140 Cb 0.56 -0.15 0.03 0.00 -1.12 0.00 0.00 38.32 37.64 181l h ASN 140 CO 0.03 0.73 -1.02 1.56 -1.29 0.00 0.00 177.43 177.43 181l h GLN 141 N 0.52 0.42 -2.14 0.81 1.08 -0.59 -3.39 115.11 111.83 181l h GLN 141 Ca 0.09 -0.66 -0.58 0.00 -1.45 0.00 0.00 58.65 56.05 181l h GLN 141 Cb 0.55 0.24 -0.41 0.00 -0.05 0.00 0.00 27.48 27.81 181l h GLN 141 CO 0.04 1.30 -0.79 0.25 -0.95 0.00 0.00 178.83 178.68 181l n THR 142 N -3.99 1.42 -0.20 -0.54 -2.24 -0.46 -4.98 114.28 103.29 181l n THR 142 Ca -0.14 -4.89 -0.05 0.00 -2.27 0.00 0.00 64.05 56.70 181l n THR 142 Cb 0.90 -1.84 0.05 0.00 -2.10 0.00 0.00 70.33 67.34 181l n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 181l h PRO 143 N 3.89 0.72 -0.51 -0.78 0.13 -1.61 -0.30 132.00 133.53 181l h PRO 143 Ca 0.15 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 65.18 181l h PRO 143 Cb 0.72 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 31.67 181l h PRO 143 CO 0.71 0.47 0.12 -0.91 -0.23 0.00 0.00 178.00 178.16 181l h ASN 144 N 0.74 0.78 -0.26 1.44 2.35 -1.94 0.36 115.58 119.06 181l h ASN 144 Ca 0.23 -0.24 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 181l h ASN 144 Cb -0.01 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 181l h ASN 144 CO -0.09 0.81 -0.11 -0.09 -1.65 0.00 0.00 177.43 176.30 181l h ARG 145 N 0.71 0.53 -0.51 0.81 2.43 -1.95 -2.48 114.38 113.92 181l h ARG 145 Ca 0.16 -0.22 0.08 0.00 -0.81 0.00 0.00 59.98 59.18 181l h ARG 145 Cb 0.34 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.81 181l h ARG 145 CO 0.00 0.77 0.15 0.00 -1.51 0.00 0.00 179.97 179.39 181l h ALA 146 N 0.74 0.61 -0.99 2.80 0.00 -0.94 -1.54 119.26 119.94 181l h ALA 146 Ca 0.06 0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.15 181l h ALA 146 Cb 0.61 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.40 181l h ALA 146 CO 0.03 -0.25 0.63 0.87 0.00 0.00 0.00 179.25 180.54 181l h LYS 147 N 0.32 1.03 -0.11 0.00 1.57 -0.86 0.52 116.57 119.03 181l h LYS 147 Ca 0.25 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 181l h LYS 147 Cb 0.29 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 181l h LYS 147 CO -0.28 0.68 0.04 0.00 -0.57 0.00 0.00 179.45 179.32 181l h ARG 148 N 1.06 0.17 -0.46 3.15 3.08 -0.83 -1.00 114.38 119.54 181l h ARG 148 Ca 0.46 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.46 181l h ARG 148 Cb 0.36 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 181l h ARG 148 CO -0.22 0.29 0.20 0.28 -1.07 0.00 0.00 179.97 179.45 181l h VAL 149 N 0.01 1.20 -0.67 2.04 2.07 -0.95 -2.26 116.25 117.69 181l h VAL 149 Ca 0.04 -0.60 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 181l h VAL 149 Cb 0.18 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 181l h VAL 149 CO -0.00 0.23 0.25 0.40 0.02 0.00 0.00 177.57 178.47 181l h ILE 150 N 0.61 1.24 -0.29 4.57 2.04 -0.89 -1.78 117.51 122.99 181l h ILE 150 Ca 0.16 -0.76 -0.10 0.00 1.00 0.00 0.00 64.86 65.16 181l h ILE 150 Cb 0.17 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 181l h ILE 150 CO -0.02 0.30 -0.22 0.74 0.00 0.00 0.00 178.15 178.96 181l h THR 151 N 0.98 1.26 -0.68 -0.27 2.02 -1.00 0.12 112.91 115.34 181l h THR 151 Ca 0.23 -1.25 -0.05 0.00 0.77 0.00 0.00 66.41 66.11 181l h THR 151 Cb 0.21 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.88 181l h THR 151 CO -0.02 0.40 0.21 0.74 0.37 0.00 0.00 175.52 177.22 181l h THR 152 N 0.49 1.25 -0.14 3.16 2.02 -0.91 0.84 112.91 119.62 181l h THR 152 Ca 0.07 -0.86 -0.18 0.00 0.77 0.00 0.00 66.41 66.22 181l h THR 152 Cb 0.65 0.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.56 181l h THR 152 CO 0.05 0.33 -0.65 -0.26 0.37 0.00 0.00 175.52 175.36 181l h PHE 153 N 1.00 0.71 -0.31 3.16 0.04 -0.79 -0.51 116.94 120.24 181l h PHE 153 Ca 0.22 -0.28 -0.08 0.00 2.80 0.00 0.00 57.97 60.63 181l h PHE 153 Cb 0.28 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 181l h PHE 153 CO 0.02 1.04 -0.12 -0.09 -0.60 0.00 0.00 178.31 178.56 181l h ARG 154 N 0.40 0.63 0.00 1.51 2.43 -0.63 -3.36 114.38 115.35 181l h ARG 154 Ca -0.02 -0.26 -0.30 0.00 -0.81 0.00 0.00 59.98 58.60 181l h ARG 154 Cb 1.22 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.69 181l h ARG 154 CO 0.12 0.84 -2.31 0.25 -1.51 0.00 0.00 179.97 177.36 181l n THR 155 N -4.41 1.11 -1.03 0.20 -2.24 0.26 -4.76 114.28 103.41 181l n THR 155 Ca -0.03 -0.79 -0.01 0.00 -2.27 0.00 0.00 64.05 60.95 181l n THR 155 Cb 0.36 -0.37 -0.00 0.00 -2.10 0.00 0.00 70.33 68.22 181l n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 181l n GLY 156 N 1.65 0.49 3.56 3.38 0.00 -0.20 -5.01 105.19 109.06 181l n GLY 156 Ca -0.27 -0.53 -0.26 0.00 0.00 0.00 0.00 46.02 44.96 181l n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 181l s THR 157 N -1.99 1.24 -0.34 2.61 -4.23 -1.26 -4.77 115.64 106.90 181l s THR 157 Ca 0.00 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.61 181l s THR 157 Cb 0.00 -2.62 0.71 0.00 1.34 0.00 0.00 72.50 71.93 181l s THR 157 CO 0.00 0.00 1.72 0.79 -0.54 0.00 0.00 174.62 176.59 181l n TRP 158 N -0.91 2.22 -0.05 3.99 7.02 -1.26 -4.58 117.44 123.87 181l n TRP 158 Ca -0.07 -1.01 0.14 0.00 -1.02 0.00 0.00 57.50 55.53 181l n TRP 158 Cb 0.66 -0.62 0.55 0.00 -2.42 0.00 0.00 31.31 29.49 181l n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 181l h ASP 159 N 2.79 0.26 0.88 -0.99 3.32 -1.96 -0.91 116.42 119.81 181l h ASP 159 Ca 0.19 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.25 181l h ASP 159 Cb 2.15 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 41.65 181l h ASP 159 CO 0.64 0.15 0.00 0.00 -1.72 0.00 0.00 179.24 178.31 181l h ALA 160 N 1.72 1.00 -0.33 3.45 0.00 -1.87 -2.25 119.26 120.98 181l h ALA 160 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 181l h ALA 160 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 181l h ALA 160 CO -0.06 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.85 181l n TYR 161 N -2.71 0.43 0.60 0.00 4.02 -0.36 -4.98 117.16 114.15 181l n TYR 161 Ca 0.01 -0.28 0.07 0.00 -0.01 0.00 0.00 57.90 57.70 181l n TYR 161 Cb 0.27 -0.01 0.06 0.00 -0.02 0.00 0.00 39.34 39.64 181l n TYR 161 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48