#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xsr s LEU 3 N 0.00 2.01 0.27 -0.35 2.96 -0.55 -4.88 118.68 118.13 1xsr s LEU 3 Ca 0.00 -1.26 -0.30 0.00 -0.22 0.00 0.00 54.13 52.35 1xsr s LEU 3 Cb 0.00 -0.86 -0.10 0.00 0.50 0.00 0.00 46.19 45.73 1xsr s LEU 3 CO 0.00 -0.34 1.44 -1.10 -1.32 0.00 0.00 176.35 175.03 1xsr s GLN 4 N 1.63 4.25 -0.32 1.98 -1.52 -1.26 -1.53 119.66 122.90 1xsr s GLN 4 Ca 0.03 2.33 -0.16 0.00 -1.95 0.00 0.00 55.36 55.61 1xsr s GLN 4 Cb -0.18 -3.09 -0.02 0.00 -0.22 0.00 0.00 33.01 29.51 1xsr s GLN 4 CO -0.14 -0.42 0.40 0.08 -0.25 0.00 0.00 175.29 174.96 1xsr s VAL 5 N -0.21 5.13 0.23 1.09 1.01 0.50 -4.34 120.40 123.81 1xsr s VAL 5 Ca 0.58 0.29 0.05 0.00 0.00 0.00 0.00 61.98 62.90 1xsr s VAL 5 Cb -0.42 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.11 1xsr s VAL 5 CO 0.46 -0.04 0.35 -0.76 0.00 0.00 0.00 175.10 175.11 1xsr s LEU 6 N 2.13 4.32 0.53 3.92 1.02 -0.72 -4.65 118.68 125.24 1xsr s LEU 6 Ca 0.15 0.09 -0.21 0.00 0.02 0.00 0.00 54.13 54.17 1xsr s LEU 6 Cb -0.16 -2.87 -0.05 0.00 0.02 0.00 0.00 46.19 43.12 1xsr s LEU 6 CO 0.11 -0.05 1.25 -2.84 0.02 0.00 0.00 176.35 174.85 1xsr s PRO 7 N -3.87 3.28 0.08 1.29 0.02 -1.26 -1.91 135.00 132.63 1xsr s PRO 7 Ca 0.34 1.98 -0.30 0.00 0.02 0.00 0.00 61.00 63.04 1xsr s PRO 7 Cb -0.09 -2.21 -0.05 0.00 0.02 0.00 0.00 34.50 32.17 1xsr s PRO 7 CO 0.29 -1.00 0.96 -1.17 -0.33 0.00 0.00 177.00 175.75 1xsr s LEU 8 N -3.52 4.47 0.06 -5.54 2.96 -0.83 -4.78 118.68 111.48 1xsr s LEU 8 Ca 0.71 1.75 -0.12 0.00 -0.22 0.00 0.00 54.13 56.25 1xsr s LEU 8 Cb -0.34 -3.57 0.01 0.00 0.50 0.00 0.00 46.19 42.79 1xsr s LEU 8 CO 0.39 -0.11 0.26 -0.94 -1.32 0.00 0.00 176.35 174.63 1xsr s SER 9 N 0.25 -0.04 0.22 3.68 1.04 -1.26 -4.88 113.70 112.71 1xsr s SER 9 Ca 0.48 -0.34 -0.07 0.00 0.48 0.00 0.00 55.95 56.50 1xsr s SER 9 Cb -0.23 0.34 0.20 0.00 0.10 0.00 0.00 66.02 66.44 1xsr s SER 9 CO 0.29 -0.64 1.78 -0.61 0.98 0.00 0.00 173.24 175.04 1xsr h GLN 10 N 3.13 1.13 0.30 4.02 5.75 -1.96 -2.32 115.11 125.17 1xsr h GLN 10 Ca -0.32 -0.22 -0.01 0.00 -0.15 0.00 0.00 58.65 57.94 1xsr h GLN 10 Cb 1.20 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 29.58 1xsr h GLN 10 CO 0.49 0.94 -0.15 0.93 -2.65 0.00 0.00 178.83 178.39 1xsr h GLU 11 N 1.09 -0.39 0.00 1.69 5.08 -1.98 -0.47 114.58 119.59 1xsr h GLU 11 Ca 0.24 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.62 1xsr h GLU 11 Cb 0.26 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1xsr h GLU 11 CO -0.01 -0.22 -0.07 0.00 -1.00 0.00 0.00 179.01 177.71 1xsr h ALA 12 N 0.21 1.04 -0.02 3.43 0.00 -1.95 -2.96 119.26 119.01 1xsr h ALA 12 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xsr h ALA 12 Cb 0.36 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1xsr h ALA 12 CO 0.07 0.09 -0.25 0.34 0.00 0.00 0.00 179.25 179.50 1xsr n PHE 13 N -3.23 0.00 -0.34 0.00 7.35 -0.88 -4.62 117.46 115.75 1xsr n PHE 13 Ca -0.00 0.00 0.20 0.00 -0.76 0.00 0.00 57.45 56.89 1xsr n PHE 13 Cb 0.31 0.00 0.44 0.00 0.35 0.00 0.00 39.48 40.58 1xsr n PHE 13 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 1xsr h SER 14 N 3.34 0.58 1.56 -2.13 4.64 -0.90 -1.16 113.55 119.48 1xsr h SER 14 Ca 0.00 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1xsr h SER 14 Cb 0.83 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1xsr h SER 14 CO 0.00 0.11 0.00 0.00 -0.87 0.00 0.00 176.83 176.07 1xsr h ALA 15 N 1.68 1.00 0.00 5.18 0.00 -1.83 -3.33 119.26 121.96 1xsr h ALA 15 Ca 0.62 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.40 1xsr h ALA 15 Cb 1.34 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 1xsr h ALA 15 CO -0.39 0.00 -1.83 0.66 0.00 0.00 0.00 179.25 177.69 1xsr n TYR 16 N -2.67 0.00 -3.60 0.00 4.01 -0.58 -4.99 117.16 109.33 1xsr n TYR 16 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 1xsr n TYR 16 Cb 0.44 -0.52 0.00 0.00 -0.31 0.00 0.00 39.34 38.95 1xsr n TYR 16 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1xsr n GLY 17 N 1.90 -0.51 3.65 2.72 0.00 -0.54 -0.83 105.19 111.57 1xsr n GLY 17 Ca -0.13 -0.95 -0.30 0.00 0.00 0.00 0.00 46.02 44.64 1xsr n GLY 17 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xsr s ASP 18 N -4.00 4.80 -0.24 1.61 1.01 -0.37 -4.10 116.67 115.38 1xsr s ASP 18 Ca 0.00 -0.26 -0.08 0.00 0.71 0.00 0.00 52.55 52.92 1xsr s ASP 18 Cb 0.00 -1.06 -0.04 0.00 1.01 0.00 0.00 42.92 42.83 1xsr s ASP 18 CO 0.00 0.17 0.09 -0.69 0.21 0.00 0.00 175.17 174.95 1xsr s VAL 19 N -1.29 4.60 -0.57 -1.27 1.01 -1.26 -0.53 120.40 121.09 1xsr s VAL 19 Ca 0.24 -0.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.93 1xsr s VAL 19 Cb -0.11 -3.14 0.06 0.00 0.00 0.00 0.00 36.38 33.19 1xsr s VAL 19 CO 0.17 0.35 0.79 -0.63 0.00 0.00 0.00 175.10 175.78 1xsr s ILE 20 N 1.34 4.62 0.29 2.22 1.01 -0.93 -4.91 121.20 124.85 1xsr s ILE 20 Ca 0.05 -0.35 -0.15 0.00 0.00 0.00 0.00 60.65 60.20 1xsr s ILE 20 Cb -0.15 -4.48 0.01 0.00 0.01 0.00 0.00 42.46 37.86 1xsr s ILE 20 CO 0.04 -1.08 0.60 -1.83 0.00 0.00 0.00 174.94 172.68 1xsr s GLU 21 N 3.29 1.76 -0.12 2.79 -1.05 -1.26 0.96 118.70 125.06 1xsr s GLU 21 Ca 0.20 -1.23 0.08 0.00 -0.15 0.00 0.00 54.97 53.87 1xsr s GLU 21 Cb -0.18 0.54 -0.13 0.00 -0.44 0.00 0.00 34.13 33.92 1xsr s GLU 21 CO 0.12 -0.77 0.00 0.25 0.95 0.00 0.00 175.26 175.81 1xsr n THR 22 N -0.44 0.78 -1.68 1.83 -2.24 -1.26 -4.88 114.28 106.38 1xsr n THR 22 Ca -0.03 -0.44 -0.61 0.00 -2.27 0.00 0.00 64.05 60.70 1xsr n THR 22 Cb 0.61 -0.77 -0.08 0.00 -2.10 0.00 0.00 70.33 67.98 1xsr n THR 22 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1xsr n GLN 23 N -2.53 0.57 -2.40 -0.78 7.27 -1.26 -0.58 117.38 117.67 1xsr n GLN 23 Ca -0.20 0.21 -0.20 0.00 0.07 0.00 0.00 57.00 56.88 1xsr n GLN 23 Cb 0.84 -1.79 -0.01 0.00 2.41 0.00 0.00 30.24 31.69 1xsr n GLN 23 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 1xsr n GLN 24 N 3.91 -1.73 -4.27 3.69 1.13 -1.26 -4.99 117.38 113.85 1xsr n GLN 24 Ca 0.26 0.98 -0.30 0.00 -1.94 0.00 0.00 57.00 56.00 1xsr n GLN 24 Cb 0.06 -5.64 -0.10 0.00 0.11 0.00 0.00 30.24 24.67 1xsr n GLN 24 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1xsr s ARG 25 N -5.04 2.25 0.34 -1.09 1.81 0.25 -5.11 118.95 112.35 1xsr s ARG 25 Ca 0.00 -0.95 -0.26 0.00 -1.72 0.00 0.00 55.73 52.80 1xsr s ARG 25 Cb 0.00 -2.36 -0.09 0.00 -0.45 0.00 0.00 34.95 32.05 1xsr s ARG 25 CO 0.00 0.53 1.02 -0.51 -0.68 0.00 0.00 175.30 175.66 1xsr s ASP 26 N -2.06 7.11 0.11 0.23 -0.00 -1.26 -5.05 116.67 115.75 1xsr s ASP 26 Ca 0.21 2.03 -0.06 0.00 -0.00 0.00 0.00 52.55 54.73 1xsr s ASP 26 Cb -0.11 -2.60 -0.02 0.00 -0.00 0.00 0.00 42.92 40.20 1xsr s ASP 26 CO 0.13 -0.24 0.15 0.72 -0.00 0.00 0.00 175.17 175.93 1xsr s PHE 27 N -1.49 0.40 -0.03 4.23 -0.12 -1.26 -4.12 117.98 115.58 1xsr s PHE 27 Ca 0.51 -0.83 0.01 0.00 -0.05 0.00 0.00 56.93 56.57 1xsr s PHE 27 Cb -0.24 -0.19 -0.03 0.00 -0.63 0.00 0.00 43.02 41.93 1xsr s PHE 27 CO 0.30 -0.55 -0.02 -0.06 -0.05 0.00 0.00 175.22 174.84 1xsr s PHE 28 N -3.93 3.06 0.03 3.49 0.08 0.13 -4.88 117.98 115.96 1xsr s PHE 28 Ca 0.12 0.09 -0.25 0.00 0.12 0.00 0.00 56.93 57.00 1xsr s PHE 28 Cb 0.06 -1.70 -0.05 0.00 -0.57 0.00 0.00 43.02 40.75 1xsr s PHE 28 CO -0.06 0.43 0.79 -1.01 -0.10 0.00 0.00 175.22 175.27 1xsr s HIS 29 N -0.98 3.71 0.01 0.36 3.76 -1.26 -0.48 115.29 120.42 1xsr s HIS 29 Ca 0.16 1.48 0.08 0.00 -0.15 0.00 0.00 55.06 56.64 1xsr s HIS 29 Cb -0.11 -2.86 -0.02 0.00 1.11 0.00 0.00 32.58 30.70 1xsr s HIS 29 CO 0.06 0.22 -0.25 0.42 -0.85 0.00 0.00 174.74 174.34 1xsr s ILE 30 N 0.14 2.03 0.00 0.60 -1.09 0.15 -4.95 121.20 118.08 1xsr s ILE 30 Ca 0.40 -1.20 0.00 0.00 -2.23 0.00 0.00 60.65 57.62 1xsr s ILE 30 Cb -0.20 -1.70 0.00 0.00 -1.58 0.00 0.00 42.46 38.97 1xsr s ILE 30 CO 0.23 0.47 0.00 0.59 -1.23 0.00 0.00 174.94 175.00 1xsr n ASN 31 N 2.18 -3.38 0.19 3.58 4.13 -1.26 -2.33 115.26 118.36 1xsr n ASN 31 Ca -0.16 0.00 0.16 0.00 1.68 0.00 0.00 54.58 56.25 1xsr n ASN 31 Cb 0.52 0.00 0.59 0.00 -1.54 0.00 0.00 39.78 39.34 1xsr n ASN 31 CO 0.00 0.00 0.00 -1.13 0.28 0.00 0.00 177.26 176.41 1xsr h ASN 32 N 0.00 0.00 0.00 6.41 -1.24 -1.96 -3.39 115.58 115.39 1xsr h ASN 32 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1xsr h ASN 32 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 1xsr h ASN 32 CO 0.00 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.75 1xsr n GLY 33 N -1.42 -0.53 0.30 1.57 0.00 -1.16 -5.03 105.19 98.93 1xsr n GLY 33 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.10 1xsr n GLY 33 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xsr h LEU 34 N 0.00 0.46 -8.45 0.99 -0.00 -1.73 -3.43 115.31 103.15 1xsr h LEU 34 Ca 0.00 -0.02 -0.56 0.00 -0.00 0.00 0.00 57.88 57.29 1xsr h LEU 34 Cb 0.00 -0.12 -0.27 0.00 -0.00 0.00 0.00 40.66 40.27 1xsr h LEU 34 CO 0.00 0.37 -0.84 -0.69 -0.00 0.00 0.00 178.44 177.28 1xsr s VAL 35 N -5.40 1.54 -0.17 1.22 1.01 -0.99 -5.03 120.40 112.58 1xsr s VAL 35 Ca -0.08 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 60.87 1xsr s VAL 35 Cb 0.17 -1.32 -0.00 0.00 0.00 0.00 0.00 36.38 35.23 1xsr s VAL 35 CO 0.73 0.28 -0.13 -1.61 0.00 0.00 0.00 175.10 174.37 1xsr s GLU 36 N -0.87 3.23 -0.30 2.72 2.02 -1.26 -0.68 118.70 123.57 1xsr s GLU 36 Ca 0.07 -0.72 -0.07 0.00 0.02 0.00 0.00 54.97 54.27 1xsr s GLU 36 Cb -0.08 -2.72 0.01 0.00 0.10 0.00 0.00 34.13 31.44 1xsr s GLU 36 CO 0.01 -0.06 0.08 0.50 0.02 0.00 0.00 175.26 175.80 1xsr s ARG 37 N 1.03 3.08 -0.86 1.61 3.52 0.37 -4.92 118.95 122.79 1xsr s ARG 37 Ca -0.01 -0.87 -0.16 0.00 -0.13 0.00 0.00 55.73 54.56 1xsr s ARG 37 Cb -0.15 -3.37 0.17 0.00 -1.56 0.00 0.00 34.95 30.04 1xsr s ARG 37 CO -0.03 -0.45 0.92 0.71 -0.81 0.00 0.00 175.30 175.64 1xsr s TYR 38 N 1.50 3.44 0.86 5.12 1.51 -1.26 -0.69 117.35 127.83 1xsr s TYR 38 Ca 0.02 -1.68 -0.11 0.00 -1.01 0.00 0.00 57.07 54.30 1xsr s TYR 38 Cb -0.17 -4.03 0.11 0.00 -0.11 0.00 0.00 41.96 37.76 1xsr s TYR 38 CO 0.02 -1.22 1.10 -3.38 -1.11 0.00 0.00 175.55 170.96 1xsr s HIS 39 N 1.38 2.28 -0.06 2.71 -3.43 -1.26 -4.61 115.29 112.31 1xsr s HIS 39 Ca 0.24 1.45 -0.05 0.00 -0.80 0.00 0.00 55.06 55.89 1xsr s HIS 39 Cb -0.09 -3.14 0.01 0.00 -1.43 0.00 0.00 32.58 27.93 1xsr s HIS 39 CO -0.08 -2.29 0.09 -3.47 -2.00 0.00 0.00 174.74 166.99 1xsr n ASP 40 N -3.84 -2.00 -0.03 7.38 -0.08 -1.26 -4.92 116.55 111.80 1xsr n ASP 40 Ca 0.08 0.06 0.05 0.00 -1.51 0.00 0.00 54.79 53.46 1xsr n ASP 40 Cb 0.54 -0.52 -0.15 0.00 2.34 0.00 0.00 41.12 43.33 1xsr n ASP 40 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1xsr n LEU 41 N 0.43 0.00 -3.79 -2.67 4.32 -1.26 -4.98 117.00 109.05 1xsr n LEU 41 Ca -0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.85 1xsr n LEU 41 Cb 0.19 0.13 -0.14 0.00 -1.62 0.00 0.00 43.42 41.98 1xsr n LEU 41 CO 0.07 0.13 -0.23 0.00 -1.22 0.00 0.00 177.39 176.14 1xsr s ALA 42 N -3.12 -0.27 -0.77 -1.18 0.00 -1.26 -4.53 121.76 110.64 1xsr s ALA 42 Ca -0.08 0.51 -0.24 0.00 0.00 0.00 0.00 51.96 52.14 1xsr s ALA 42 Cb 0.11 -0.33 0.05 0.00 0.00 0.00 0.00 23.12 22.95 1xsr s ALA 42 CO 0.81 -0.11 1.20 -0.51 0.00 0.00 0.00 175.76 177.15 1xsr s LEU 43 N 0.65 3.72 0.16 0.00 1.02 -1.26 -5.00 118.68 117.97 1xsr s LEU 43 Ca -0.05 -0.88 -0.30 0.00 0.02 0.00 0.00 54.13 52.92 1xsr s LEU 43 Cb -0.07 -2.51 -0.07 0.00 0.02 0.00 0.00 46.19 43.57 1xsr s LEU 43 CO -0.03 -1.61 0.99 -0.69 0.02 0.00 0.00 176.35 175.02 1xsr s VAL 44 N 4.89 4.25 -0.12 -1.59 1.01 -1.26 -4.91 120.40 122.67 1xsr s VAL 44 Ca 0.32 1.97 -0.05 0.00 0.00 0.00 0.00 61.98 64.23 1xsr s VAL 44 Cb -0.09 -4.26 0.06 0.00 0.00 0.00 0.00 36.38 32.09 1xsr s VAL 44 CO 0.08 0.35 0.26 -0.70 0.00 0.00 0.00 175.10 175.09 1xsr s GLU 45 N -0.38 0.16 -0.06 2.72 2.12 -1.26 -5.02 118.70 116.98 1xsr s GLU 45 Ca 0.46 0.68 0.02 0.00 0.36 0.00 0.00 54.97 56.50 1xsr s GLU 45 Cb -0.25 -0.06 0.01 0.00 0.26 0.00 0.00 34.13 34.08 1xsr s GLU 45 CO 0.32 -0.25 -0.13 0.42 -0.54 0.00 0.00 175.26 175.08 1xsr s ILE 46 N 2.07 1.15 0.04 -3.70 -1.09 -1.26 -1.41 121.20 117.01 1xsr s ILE 46 Ca -0.02 -0.50 0.04 0.00 -2.23 0.00 0.00 60.65 57.94 1xsr s ILE 46 Cb -0.11 -1.04 -0.04 0.00 -1.58 0.00 0.00 42.46 39.68 1xsr s ILE 46 CO -0.09 0.36 -0.06 -0.76 -1.23 0.00 0.00 174.94 173.16 1xsr s LEU 47 N 0.58 3.20 -1.34 2.97 2.01 -0.70 -4.69 118.68 120.71 1xsr s LEU 47 Ca -0.13 -0.20 -0.01 0.00 0.01 0.00 0.00 54.13 53.80 1xsr s LEU 47 Cb -0.15 -1.89 -0.00 0.00 0.01 0.00 0.00 46.19 44.16 1xsr s LEU 47 CO 0.04 0.24 0.58 -0.62 1.01 0.00 0.00 176.35 177.60 1xsr n GLU 48 N 1.19 -4.11 0.00 1.70 1.02 -1.26 -4.90 120.64 114.28 1xsr n GLU 48 Ca -0.14 0.53 0.00 0.00 -0.02 0.00 0.00 57.16 57.53 1xsr n GLU 48 Cb 0.52 -4.88 0.00 0.00 -0.02 0.00 0.00 31.44 27.06 1xsr n GLU 48 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1xsr n GLN 49 N -4.31 0.00 0.21 3.49 7.27 -1.26 -5.04 117.38 117.73 1xsr n GLN 49 Ca -0.30 0.00 0.06 0.00 0.07 0.00 0.00 57.00 56.83 1xsr n GLN 49 Cb 0.68 0.00 0.45 0.00 2.41 0.00 0.00 30.24 33.78 1xsr n GLN 49 CO 0.00 0.00 0.00 0.22 0.07 0.00 0.00 177.06 177.35 1xsr h ASP 50 N 0.00 0.00 -2.93 1.69 1.82 -1.92 -3.44 116.42 111.63 1xsr h ASP 50 Ca 0.00 0.00 -0.65 0.00 -0.39 0.00 0.00 57.03 55.99 1xsr h ASP 50 Cb 0.00 0.00 -0.10 0.00 0.68 0.00 0.00 39.33 39.91 1xsr h ASP 50 CO 0.00 0.30 -0.51 0.00 -1.61 0.00 0.00 179.24 177.42 1xsr s ARG 51 N -4.13 3.59 0.48 0.28 3.03 -1.26 -5.10 118.95 115.84 1xsr s ARG 51 Ca -0.02 -0.21 -0.09 0.00 2.03 0.00 0.00 55.73 57.44 1xsr s ARG 51 Cb 0.14 -3.18 -0.05 0.00 -1.03 0.00 0.00 34.95 30.82 1xsr s ARG 51 CO 0.68 0.61 0.83 0.99 -1.13 0.00 0.00 175.30 177.29 1xsr s THR 52 N -0.57 4.81 -0.03 4.99 2.01 -1.26 -4.93 115.64 120.66 1xsr s THR 52 Ca 0.12 0.53 0.08 0.00 0.31 0.00 0.00 61.69 62.72 1xsr s THR 52 Cb -0.12 -3.81 -0.02 0.00 0.01 0.00 0.00 72.50 68.57 1xsr s THR 52 CO 0.02 -0.77 -0.26 -0.76 -0.69 0.00 0.00 174.62 172.17 1xsr s LEU 53 N -4.44 2.05 -0.19 4.42 1.02 -0.61 -5.02 118.68 115.92 1xsr s LEU 53 Ca 0.51 -0.48 0.00 0.00 0.02 0.00 0.00 54.13 54.18 1xsr s LEU 53 Cb -0.10 -1.35 0.01 0.00 0.02 0.00 0.00 46.19 44.77 1xsr s LEU 53 CO 0.40 0.30 -0.17 -0.63 0.02 0.00 0.00 176.35 176.28 1xsr s ILE 54 N -0.50 2.36 0.34 -0.59 -1.09 -1.26 -2.50 121.20 117.95 1xsr s ILE 54 Ca 0.07 -0.84 0.08 0.00 -2.23 0.00 0.00 60.65 57.72 1xsr s ILE 54 Cb -0.11 -2.01 -0.03 0.00 -1.58 0.00 0.00 42.46 38.73 1xsr s ILE 54 CO 0.00 0.51 0.29 -0.94 -1.23 0.00 0.00 174.94 173.57 1xsr s SER 55 N 1.29 1.78 -0.14 3.58 1.04 -0.76 -4.98 113.70 115.50 1xsr s SER 55 Ca 0.04 -1.78 -0.00 0.00 0.48 0.00 0.00 55.95 54.69 1xsr s SER 55 Cb -0.13 0.57 0.03 0.00 0.10 0.00 0.00 66.02 66.58 1xsr s SER 55 CO -0.10 -1.07 -0.07 -0.63 0.98 0.00 0.00 173.24 172.35 1xsr s ILE 56 N -3.40 1.11 -0.38 -1.02 1.01 -1.26 -0.50 121.20 116.75 1xsr s ILE 56 Ca 0.41 -0.48 -0.13 0.00 0.00 0.00 0.00 60.65 60.45 1xsr s ILE 56 Cb 0.02 -1.20 0.02 0.00 0.01 0.00 0.00 42.46 41.31 1xsr s ILE 56 CO 0.29 0.26 0.25 0.20 0.00 0.00 0.00 174.94 175.93 1xsr s ASN 57 N 1.65 5.92 -0.61 3.58 -0.87 0.21 -4.90 114.94 119.91 1xsr s ASN 57 Ca 0.03 -0.87 -0.20 0.00 -1.57 0.00 0.00 52.86 50.25 1xsr s ASN 57 Cb -0.14 -2.09 0.09 0.00 -0.02 0.00 0.00 41.25 39.09 1xsr s ASN 57 CO -0.08 -0.39 0.81 -0.60 -2.57 0.00 0.00 177.10 174.27 1xsr s ARG 58 N 1.63 3.08 -0.15 -0.60 3.52 -1.26 -1.38 118.95 123.78 1xsr s ARG 58 Ca 0.04 -1.09 -0.09 0.00 -0.13 0.00 0.00 55.73 54.46 1xsr s ARG 58 Cb -0.19 -4.24 -0.04 0.00 -1.56 0.00 0.00 34.95 28.92 1xsr s ARG 58 CO 0.08 -1.64 0.15 0.00 -0.81 0.00 0.00 175.30 173.09 1xsr s ALA 59 N 3.26 3.78 0.63 6.12 0.00 -0.57 -4.95 121.76 130.03 1xsr s ALA 59 Ca 0.16 -0.64 -0.13 0.00 0.00 0.00 0.00 51.96 51.36 1xsr s ALA 59 Cb -0.21 -2.09 -0.02 0.00 0.00 0.00 0.00 23.12 20.80 1xsr s ALA 59 CO 0.08 0.40 1.04 -0.65 0.00 0.00 0.00 175.76 176.64 1xsr s GLN 60 N -0.39 3.29 0.51 0.00 -1.52 -1.26 -1.98 119.66 118.30 1xsr s GLN 60 Ca 0.13 0.99 -0.19 0.00 -1.95 0.00 0.00 55.36 54.33 1xsr s GLN 60 Cb -0.12 -2.04 -0.08 0.00 -0.22 0.00 0.00 33.01 30.56 1xsr s GLN 60 CO 0.02 -0.82 1.03 -1.25 -0.25 0.00 0.00 175.29 174.02 1xsr s PRO 61 N -4.67 3.74 0.43 2.91 0.04 -1.26 -1.19 135.00 134.99 1xsr s PRO 61 Ca 0.59 1.29 -0.07 0.00 0.04 0.00 0.00 61.00 62.85 1xsr s PRO 61 Cb -0.13 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 32.27 1xsr s PRO 61 CO 0.47 -0.47 0.75 0.00 0.04 0.00 0.00 177.00 177.79 1xsr s ALA 62 N -2.12 3.40 0.06 8.56 0.00 -1.08 -4.84 121.76 125.74 1xsr s ALA 62 Ca 0.66 -0.38 -0.31 0.00 0.00 0.00 0.00 51.96 51.93 1xsr s ALA 62 Cb -0.15 -2.61 -0.06 0.00 0.00 0.00 0.00 23.12 20.30 1xsr s ALA 62 CO 0.23 -0.14 1.20 -0.80 0.00 0.00 0.00 175.76 176.26 1xsr s ASN 63 N -3.59 7.07 -0.02 0.00 0.02 -1.26 -4.80 114.94 112.36 1xsr s ASN 63 Ca 0.49 2.01 -0.14 0.00 -1.02 0.00 0.00 52.86 54.20 1xsr s ASN 63 Cb -0.10 -2.58 -0.05 0.00 0.02 0.00 0.00 41.25 38.53 1xsr s ASN 63 CO 0.37 -0.48 0.38 -0.76 0.02 0.00 0.00 177.10 176.63 1xsr s LEU 64 N 1.10 4.45 0.32 0.60 1.43 -1.26 -3.34 118.68 121.99 1xsr s LEU 64 Ca 0.59 0.89 -0.28 0.00 -1.03 0.00 0.00 54.13 54.30 1xsr s LEU 64 Cb -0.29 -2.53 -0.09 0.00 0.03 0.00 0.00 46.19 43.31 1xsr s LEU 64 CO 0.29 0.31 1.11 -2.16 0.23 0.00 0.00 176.35 176.13 1xsr s PRO 65 N -0.93 4.45 0.31 1.29 0.04 -1.26 -5.13 135.00 133.77 1xsr s PRO 65 Ca 0.23 1.77 -0.29 0.00 0.04 0.00 0.00 61.00 62.75 1xsr s PRO 65 Cb -0.16 -2.98 -0.10 0.00 0.04 0.00 0.00 34.50 31.30 1xsr s PRO 65 CO 0.12 0.05 1.30 -1.17 0.04 0.00 0.00 177.00 177.33 1xsr s LEU 66 N -1.85 4.44 -0.34 -3.56 1.98 -1.21 -4.98 118.68 113.15 1xsr s LEU 66 Ca 0.49 2.63 0.05 0.00 -2.89 0.00 0.00 54.13 54.42 1xsr s LEU 66 Cb -0.30 -3.64 0.18 0.00 0.66 0.00 0.00 46.19 43.08 1xsr s LEU 66 CO 0.39 -0.51 0.54 0.28 -1.89 0.00 0.00 176.35 175.15 1xsr s THR 67 N -0.98 -0.83 0.58 3.68 -1.32 -1.26 -2.14 115.64 113.36 1xsr s THR 67 Ca 0.50 -0.19 -0.09 0.00 -1.21 0.00 0.00 61.69 60.70 1xsr s THR 67 Cb -0.39 -0.63 -0.03 0.00 -1.51 0.00 0.00 72.50 69.94 1xsr s THR 67 CO 0.50 -0.14 0.94 0.27 -2.21 0.00 0.00 174.62 173.99 1xsr s ILE 68 N 2.26 4.63 0.00 5.08 -4.36 -0.88 -4.83 121.20 123.10 1xsr s ILE 68 Ca 0.13 0.56 0.00 0.00 -0.26 0.00 0.00 60.65 61.08 1xsr s ILE 68 Cb -0.09 -3.82 0.00 0.00 1.25 0.00 0.00 42.46 39.80 1xsr s ILE 68 CO -0.18 -0.97 0.00 0.00 0.24 0.00 0.00 174.94 174.04 1xsr n HIS 69 N -2.59 0.00 -4.28 1.37 1.44 -1.26 -1.47 115.22 108.44 1xsr n HIS 69 Ca 0.04 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.60 1xsr n HIS 69 Cb 0.55 0.02 -0.10 0.00 0.12 0.00 0.00 29.99 30.58 1xsr n HIS 69 CO 0.00 0.00 0.00 -1.83 -2.81 0.00 0.00 176.34 171.70 1xsr s GLU 70 N 0.00 1.16 -0.11 -1.40 -1.05 -1.26 -1.43 118.70 114.61 1xsr s GLU 70 Ca 0.00 -1.53 -0.12 0.00 -0.15 0.00 0.00 54.97 53.17 1xsr s GLU 70 Cb 0.00 -0.63 0.03 0.00 -0.44 0.00 0.00 34.13 33.09 1xsr s GLU 70 CO 0.00 0.02 0.33 -1.17 0.95 0.00 0.00 175.26 175.39 1xsr s LEU 71 N -3.22 0.75 0.28 1.83 2.96 -0.36 -4.67 118.68 116.25 1xsr s LEU 71 Ca 0.21 0.62 0.11 0.00 -0.22 0.00 0.00 54.13 54.84 1xsr s LEU 71 Cb 0.03 1.14 -0.05 0.00 0.50 0.00 0.00 46.19 47.82 1xsr s LEU 71 CO 0.03 -0.14 -0.12 -1.83 -1.32 0.00 0.00 176.35 172.98 1xsr s GLU 72 N 0.05 1.93 -0.10 1.98 -1.05 0.19 -0.79 118.70 120.92 1xsr s GLU 72 Ca -0.01 -1.64 -0.08 0.00 -0.15 0.00 0.00 54.97 53.09 1xsr s GLU 72 Cb -0.03 -1.92 0.03 0.00 -0.44 0.00 0.00 34.13 31.77 1xsr s GLU 72 CO 0.01 0.33 0.26 -0.98 0.95 0.00 0.00 175.26 175.83 1xsr s ARG 73 N -3.58 0.28 -0.64 -4.83 1.04 -0.55 -0.49 118.95 110.17 1xsr s ARG 73 Ca 0.31 0.40 -0.07 0.00 -1.04 0.00 0.00 55.73 55.33 1xsr s ARG 73 Cb -0.05 0.09 0.17 0.00 -2.04 0.00 0.00 34.95 33.12 1xsr s ARG 73 CO 0.17 -0.06 0.50 -1.01 -0.04 0.00 0.00 175.30 174.85 1xsr s HIS 74 N 0.38 3.51 0.48 5.89 3.76 -1.26 -2.20 115.29 125.84 1xsr s HIS 74 Ca -0.02 -2.39 0.27 0.00 -0.15 0.00 0.00 55.06 52.77 1xsr s HIS 74 Cb -0.04 -3.40 1.55 0.00 1.11 0.00 0.00 32.58 31.80 1xsr s HIS 74 CO -0.02 -0.91 2.14 -1.00 -0.85 0.00 0.00 174.74 174.10 1xsr h PRO 75 N 7.48 0.00 -0.00 8.40 0.13 -1.93 -2.93 132.00 143.14 1xsr h PRO 75 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1xsr h PRO 75 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1xsr h PRO 75 CO 0.75 0.08 -0.26 1.28 -0.23 0.00 0.00 178.00 179.62 1xsr n LEU 76 N -3.78 0.67 -3.60 1.56 4.77 -1.26 -4.59 117.00 110.77 1xsr n LEU 76 Ca -0.02 -0.07 -0.04 0.00 -0.03 0.00 0.00 56.01 55.85 1xsr n LEU 76 Cb 0.18 -0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.05 1xsr n LEU 76 CO 0.30 0.13 1.02 -0.83 -1.33 0.00 0.00 177.39 176.68 1xsr s GLY 77 N -2.65 -0.28 0.86 -0.72 0.00 -1.16 -1.72 107.32 101.65 1xsr s GLY 77 Ca 0.22 1.65 -0.12 0.00 0.00 0.00 0.00 44.72 46.46 1xsr s GLY 77 CO 0.55 0.56 1.13 -0.51 0.00 0.00 0.00 173.10 174.82 1xsr s THR 78 N -2.36 2.39 -0.19 0.90 -4.23 -0.50 -4.57 115.64 107.09 1xsr s THR 78 Ca 0.09 0.13 -0.05 0.00 -1.18 0.00 0.00 61.69 60.68 1xsr s THR 78 Cb -0.01 -2.91 0.09 0.00 1.34 0.00 0.00 72.50 71.01 1xsr s THR 78 CO -0.04 -0.16 0.36 -1.58 -0.54 0.00 0.00 174.62 172.65 1xsr s GLN 79 N -5.27 0.27 0.12 3.99 0.74 -1.03 -4.02 119.66 114.46 1xsr s GLN 79 Ca 0.62 0.83 0.05 0.00 0.05 0.00 0.00 55.36 56.92 1xsr s GLN 79 Cb -0.14 0.02 -0.04 0.00 1.10 0.00 0.00 33.01 33.95 1xsr s GLN 79 CO 0.53 -0.35 0.03 0.00 -0.55 0.00 0.00 175.29 174.96 1xsr s ALA 80 N 2.53 3.35 -0.04 1.58 0.00 -0.97 -0.95 121.76 127.26 1xsr s ALA 80 Ca 0.02 -1.18 -0.01 0.00 0.00 0.00 0.00 51.96 50.79 1xsr s ALA 80 Cb -0.13 -1.20 0.03 0.00 0.00 0.00 0.00 23.12 21.82 1xsr s ALA 80 CO -0.12 0.62 0.02 -0.06 0.00 0.00 0.00 175.76 176.22 1xsr s PHE 81 N -1.49 0.28 -0.13 0.00 0.40 0.75 -2.57 117.98 115.22 1xsr s PHE 81 Ca 0.27 0.05 -0.01 0.00 -0.60 0.00 0.00 56.93 56.65 1xsr s PHE 81 Cb -0.11 -0.49 0.03 0.00 0.51 0.00 0.00 43.02 42.97 1xsr s PHE 81 CO 0.20 -0.18 -0.04 0.42 0.70 0.00 0.00 175.22 176.32 1xsr s ILE 82 N 1.53 0.85 0.00 0.64 1.09 -0.77 -0.70 121.20 123.84 1xsr s ILE 82 Ca -0.03 -0.34 0.00 0.00 -1.10 0.00 0.00 60.65 59.19 1xsr s ILE 82 Cb -0.13 -1.01 0.00 0.00 -1.06 0.00 0.00 42.46 40.27 1xsr s ILE 82 CO -0.03 0.20 0.00 -2.65 -0.10 0.00 0.00 174.94 172.36 1xsr n PRO 83 N 4.98 1.33 0.00 2.79 -0.02 -1.26 -1.16 135.00 141.66 1xsr n PRO 83 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 1xsr n PRO 83 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.97 1xsr n PRO 83 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1xsr n LYS 85 N -0.21 0.00 -2.26 -0.52 5.02 -1.26 -4.82 118.16 114.11 1xsr n LYS 85 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 1xsr n LYS 85 Cb 0.00 -0.19 -0.00 0.00 -0.02 0.00 0.00 35.03 34.82 1xsr n LYS 85 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xsr n GLY 86 N 0.11 0.01 3.88 0.72 0.00 -1.26 -5.03 105.19 103.62 1xsr n GLY 86 Ca 0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 1xsr n GLY 86 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1xsr s GLU 87 N -4.58 3.75 0.42 1.61 1.03 -1.26 -4.58 118.70 115.10 1xsr s GLU 87 Ca 0.03 0.31 -0.23 0.00 0.03 0.00 0.00 54.97 55.11 1xsr s GLU 87 Cb -0.01 -2.51 -0.09 0.00 -0.80 0.00 0.00 34.13 30.72 1xsr s GLU 87 CO 0.03 0.11 1.04 0.08 -1.33 0.00 0.00 175.26 175.20 1xsr s VAL 88 N -2.17 3.76 0.16 1.83 1.01 -1.26 -4.45 120.40 119.28 1xsr s VAL 88 Ca 0.49 1.27 -0.12 0.00 0.00 0.00 0.00 61.98 63.61 1xsr s VAL 88 Cb -0.11 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 32.67 1xsr s VAL 88 CO 0.28 -0.07 0.35 0.72 0.00 0.00 0.00 175.10 176.38 1xsr s PHE 89 N -1.76 0.16 0.08 5.22 -0.12 -1.26 -4.47 117.98 115.83 1xsr s PHE 89 Ca 0.61 -0.53 0.07 0.00 -0.05 0.00 0.00 56.93 57.03 1xsr s PHE 89 Cb -0.20 0.10 -0.04 0.00 -0.63 0.00 0.00 43.02 42.25 1xsr s PHE 89 CO 0.25 -0.75 -0.11 0.08 -0.05 0.00 0.00 175.22 174.64 1xsr s VAL 90 N -3.91 3.29 0.02 -2.49 1.01 -1.26 -1.43 120.40 115.63 1xsr s VAL 90 Ca 0.12 -1.20 0.03 0.00 0.00 0.00 0.00 61.98 60.92 1xsr s VAL 90 Cb 0.02 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 1xsr s VAL 90 CO -0.03 0.18 -0.08 0.68 0.00 0.00 0.00 175.10 175.85 1xsr s VAL 91 N -1.14 0.61 -0.10 2.92 -7.23 0.40 -4.87 120.40 110.99 1xsr s VAL 91 Ca 0.20 -0.69 0.02 0.00 -1.81 0.00 0.00 61.98 59.69 1xsr s VAL 91 Cb -0.11 -0.58 0.01 0.00 0.56 0.00 0.00 36.38 36.26 1xsr s VAL 91 CO 0.11 -0.08 -0.14 -0.69 -0.31 0.00 0.00 175.10 173.99 1xsr s VAL 92 N -0.72 1.39 0.25 1.32 1.01 -1.26 -0.31 120.40 122.08 1xsr s VAL 92 Ca -0.02 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.42 1xsr s VAL 92 Cb -0.06 -1.28 -0.05 0.00 0.00 0.00 0.00 36.38 34.99 1xsr s VAL 92 CO 0.00 0.42 -0.04 0.68 0.00 0.00 0.00 175.10 176.17 1xsr s VAL 93 N 0.97 1.34 -0.20 2.92 -7.23 0.86 -1.94 120.40 117.12 1xsr s VAL 93 Ca -0.08 -2.08 -0.29 0.00 -1.81 0.00 0.00 61.98 57.72 1xsr s VAL 93 Cb -0.15 -2.37 0.14 0.00 0.56 0.00 0.00 36.38 34.56 1xsr s VAL 93 CO -0.01 -0.33 1.06 0.00 -0.31 0.00 0.00 175.10 175.51 1xsr s ALA 94 N -3.21 -1.97 0.25 1.32 0.00 -0.02 -0.01 121.76 118.12 1xsr s ALA 94 Ca 0.28 1.67 0.00 0.00 0.00 0.00 0.00 51.96 53.92 1xsr s ALA 94 Cb 0.05 -0.97 0.00 0.00 0.00 0.00 0.00 23.12 22.20 1xsr s ALA 94 CO 0.10 -0.28 0.00 1.28 0.00 0.00 0.00 175.76 176.86 1xsr n LEU 95 N 0.99 0.00 0.00 0.00 4.77 -1.26 -0.95 117.00 120.55 1xsr n LEU 95 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1xsr n LEU 95 Cb 0.58 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1xsr n LEU 95 CO 0.12 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 1xsr n GLY 96 N 5.00 2.81 0.24 -0.72 0.00 -1.26 -1.45 105.19 109.81 1xsr n GLY 96 Ca 0.00 -1.27 -0.15 0.00 0.00 0.00 0.00 46.02 44.60 1xsr n GLY 96 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xsr h ASP 97 N 0.00 0.94 0.00 1.61 3.32 -1.99 -3.41 116.42 116.89 1xsr h ASP 97 Ca 0.00 -0.53 0.00 0.00 0.02 0.00 0.00 57.03 56.52 1xsr h ASP 97 Cb 0.00 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.28 1xsr h ASP 97 CO 0.00 1.29 -0.64 -0.67 -1.72 0.00 0.00 179.24 177.51 1xsr n ASP 98 N -4.05 1.25 -4.50 6.45 4.64 -1.26 -5.05 116.55 114.03 1xsr n ASP 98 Ca -0.04 0.22 -0.24 0.00 -1.38 0.00 0.00 54.79 53.35 1xsr n ASP 98 Cb 0.61 -0.66 -0.11 0.00 -1.04 0.00 0.00 41.12 39.93 1xsr n ASP 98 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1xsr s LYS 99 N -2.22 1.72 -0.06 -0.67 1.02 -1.26 -5.08 119.74 113.18 1xsr s LYS 99 Ca -0.19 -1.91 -0.29 0.00 0.02 0.00 0.00 55.97 53.60 1xsr s LYS 99 Cb 0.03 -1.37 -0.07 0.00 -0.52 0.00 0.00 37.83 35.90 1xsr s LYS 99 CO 0.27 0.02 1.89 -1.25 -0.92 0.00 0.00 175.35 175.36 1xsr s PRO 100 N -3.71 3.93 -0.84 -1.68 0.04 -1.26 -4.45 135.00 127.03 1xsr s PRO 100 Ca 0.32 2.28 -0.25 0.00 0.04 0.00 0.00 61.00 63.40 1xsr s PRO 100 Cb 0.05 -4.14 -0.01 0.00 0.04 0.00 0.00 34.50 30.44 1xsr s PRO 100 CO 0.15 -1.17 1.76 0.34 0.04 0.00 0.00 177.00 178.12 1xsr s ASP 101 N 4.80 5.54 0.55 6.66 -1.08 -0.53 -4.85 116.67 127.76 1xsr s ASP 101 Ca 0.85 -0.56 0.43 0.00 -0.52 0.00 0.00 52.55 52.74 1xsr s ASP 101 Cb -0.36 -2.55 1.64 0.00 -1.46 0.00 0.00 42.92 40.18 1xsr s ASP 101 CO 0.36 -2.32 1.69 -0.07 0.52 0.00 0.00 175.17 175.34 1xsr h LEU 102 N 16.05 0.01 -0.95 -1.34 -0.00 -1.90 0.29 115.31 127.47 1xsr h LEU 102 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1xsr h LEU 102 Cb 1.05 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.71 1xsr h LEU 102 CO 1.26 -0.00 0.00 0.77 -0.00 0.00 0.00 178.44 180.47 1xsr h SER 103 N 0.01 0.00 -0.53 -0.43 4.64 -1.98 -2.40 113.55 112.85 1xsr h SER 103 Ca 0.76 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.08 1xsr h SER 103 Cb 3.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 65.10 1xsr h SER 103 CO -0.02 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.29 1xsr n THR 104 N -2.34 0.99 -2.28 2.95 -2.24 0.10 -4.98 114.28 106.47 1xsr n THR 104 Ca 0.01 -1.00 -0.42 0.00 -2.27 0.00 0.00 64.05 60.38 1xsr n THR 104 Cb 0.20 0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.91 1xsr n THR 104 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1xsr s LEU 105 N -1.00 4.39 0.02 3.22 2.96 -0.91 -4.25 118.68 123.11 1xsr s LEU 105 Ca 0.35 2.23 0.00 0.00 -0.22 0.00 0.00 54.13 56.49 1xsr s LEU 105 Cb 0.18 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 43.26 1xsr s LEU 105 CO 0.24 -0.54 -0.03 -0.13 -1.32 0.00 0.00 176.35 174.57 1xsr s ARG 106 N 0.71 0.33 -0.04 1.98 1.81 0.98 -4.98 118.95 119.72 1xsr s ARG 106 Ca 0.60 -0.63 0.06 0.00 -1.72 0.00 0.00 55.73 54.03 1xsr s ARG 106 Cb -0.34 0.10 -0.01 0.00 -0.45 0.00 0.00 34.95 34.26 1xsr s ARG 106 CO 0.32 -0.05 -0.22 0.00 -0.68 0.00 0.00 175.30 174.67 1xsr s ALA 107 N -1.54 1.89 0.00 2.13 0.00 -1.26 -0.10 121.76 122.88 1xsr s ALA 107 Ca -0.15 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 50.91 1xsr s ALA 107 Cb -0.09 -0.57 -0.00 0.00 0.00 0.00 0.00 23.12 22.45 1xsr s ALA 107 CO -0.01 0.38 -0.04 -0.06 0.00 0.00 0.00 175.76 176.03 1xsr s PHE 108 N -0.18 0.31 -0.11 0.00 0.08 0.58 -1.76 117.98 116.91 1xsr s PHE 108 Ca -0.01 -0.11 0.01 0.00 0.12 0.00 0.00 56.93 56.94 1xsr s PHE 108 Cb -0.12 -0.20 -0.02 0.00 -0.57 0.00 0.00 43.02 42.12 1xsr s PHE 108 CO 0.02 -0.02 -0.15 -1.50 -0.10 0.00 0.00 175.22 173.47 1xsr s ILE 109 N -0.24 2.92 0.68 0.64 2.07 -0.80 -0.45 121.20 126.00 1xsr s ILE 109 Ca -0.00 -0.73 -0.10 0.00 -1.41 0.00 0.00 60.65 58.41 1xsr s ILE 109 Cb -0.02 -2.19 0.02 0.00 0.13 0.00 0.00 42.46 40.39 1xsr s ILE 109 CO -0.00 0.54 1.04 0.42 -1.91 0.00 0.00 174.94 175.03 1xsr s THR 110 N 0.13 3.44 -1.89 4.00 -4.23 -0.52 -1.97 115.64 114.61 1xsr s THR 110 Ca -0.07 0.30 0.11 0.00 -1.18 0.00 0.00 61.69 60.84 1xsr s THR 110 Cb -0.15 -3.44 0.32 0.00 1.34 0.00 0.00 72.50 70.57 1xsr s THR 110 CO 0.05 -0.54 1.25 -0.46 -0.54 0.00 0.00 174.62 174.38 1xsr n ASN 111 N -2.89 2.02 0.00 3.99 0.23 -1.26 -4.48 115.26 112.87 1xsr n ASN 111 Ca 0.06 -2.04 0.00 0.00 -0.53 0.00 0.00 54.58 52.08 1xsr n ASN 111 Cb 0.58 -0.27 0.00 0.00 -2.08 0.00 0.00 39.78 38.01 1xsr n ASN 111 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1xsr n GLY 112 N 1.00 1.21 0.13 4.83 0.00 -1.26 -4.83 105.19 106.28 1xsr n GLY 112 Ca 0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.20 1xsr n GLY 112 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xsr n GLU 113 N -2.00 1.26 -3.90 1.61 4.71 -1.26 -4.06 120.64 117.00 1xsr n GLU 113 Ca 0.00 -2.01 -0.11 0.00 -0.01 0.00 0.00 57.16 55.03 1xsr n GLU 113 Cb 0.00 -1.18 -0.13 0.00 -1.01 0.00 0.00 31.44 29.12 1xsr n GLU 113 CO 0.00 0.00 0.00 1.14 0.09 0.00 0.00 177.13 178.36 1xsr s GLN 114 N -1.90 0.11 0.14 3.49 -2.07 -1.26 -4.65 119.66 113.52 1xsr s GLN 114 Ca 0.19 -0.20 0.02 0.00 -1.82 0.00 0.00 55.36 53.56 1xsr s GLN 114 Cb 0.17 0.04 0.02 0.00 -1.09 0.00 0.00 33.01 32.15 1xsr s GLN 114 CO 0.02 -0.02 0.18 0.41 -1.32 0.00 0.00 175.29 174.56 1xsr n GLY 115 N 2.59 2.16 3.09 2.60 0.00 0.27 -4.76 105.19 111.14 1xsr n GLY 115 Ca -0.16 -2.16 -0.11 0.00 0.00 0.00 0.00 46.02 43.59 1xsr n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xsr s VAL 116 N -0.06 0.09 -0.24 1.61 0.11 0.12 -2.18 120.40 119.86 1xsr s VAL 116 Ca 0.14 -0.76 -0.03 0.00 -2.93 0.00 0.00 61.98 58.40 1xsr s VAL 116 Cb -0.01 -0.45 0.08 0.00 -1.53 0.00 0.00 36.38 34.47 1xsr s VAL 116 CO 0.09 -0.42 0.08 0.21 -3.33 0.00 0.00 175.10 171.73 1xsr s ASN 117 N -1.46 3.21 0.21 3.54 2.47 0.31 -0.18 114.94 123.04 1xsr s ASN 117 Ca -0.14 -1.08 -0.30 0.00 0.42 0.00 0.00 52.86 51.76 1xsr s ASN 117 Cb -0.07 -0.52 -0.09 0.00 -1.45 0.00 0.00 41.25 39.12 1xsr s ASN 117 CO 0.01 -0.37 1.19 -0.31 -3.72 0.00 0.00 177.10 173.90 1xsr s TYR 118 N 1.93 3.42 0.58 0.43 2.02 -0.13 -1.24 117.35 124.36 1xsr s TYR 118 Ca 0.04 1.47 -0.09 0.00 -0.37 0.00 0.00 57.07 58.12 1xsr s TYR 118 Cb -0.17 -3.43 -0.04 0.00 -0.40 0.00 0.00 41.96 37.93 1xsr s TYR 118 CO -0.20 -1.16 0.96 -1.01 -1.57 0.00 0.00 175.55 172.57 1xsr s HIS 119 N -0.34 3.59 0.32 2.71 3.76 -0.01 -2.47 115.29 122.85 1xsr s HIS 119 Ca 0.51 1.12 -0.29 0.00 -0.15 0.00 0.00 55.06 56.26 1xsr s HIS 119 Cb -0.33 -2.61 -0.13 0.00 1.11 0.00 0.00 32.58 30.62 1xsr s HIS 119 CO 0.39 -0.60 1.30 0.54 -0.85 0.00 0.00 174.74 175.52 1xsr n ARG 120 N -2.61 2.08 -0.78 1.40 1.74 -1.26 -2.23 116.66 115.00 1xsr n ARG 120 Ca 0.04 0.73 0.00 0.00 -0.77 0.00 0.00 57.85 57.85 1xsr n ARG 120 Cb 0.55 -2.32 0.00 0.00 -1.02 0.00 0.00 32.46 29.67 1xsr n ARG 120 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1xsr n ASN 121 N 1.08 -0.11 -4.73 0.55 3.02 -1.12 -4.97 115.26 108.97 1xsr n ASN 121 Ca 0.06 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.20 1xsr n ASN 121 Cb 0.35 -1.16 -0.04 0.00 -0.61 0.00 0.00 39.78 38.32 1xsr n ASN 121 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1xsr s VAL 122 N -2.60 3.92 -0.06 2.41 1.01 -0.94 -4.85 120.40 119.28 1xsr s VAL 122 Ca 0.00 1.62 -0.26 0.00 0.00 0.00 0.00 61.98 63.34 1xsr s VAL 122 Cb 0.00 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 1xsr s VAL 122 CO 0.00 0.26 0.82 0.26 0.00 0.00 0.00 175.10 176.44 1xsr s TRP 123 N -0.08 3.58 0.04 5.22 0.52 -0.13 -4.40 118.94 123.68 1xsr s TRP 123 Ca 0.50 1.40 -0.03 0.00 0.02 0.00 0.00 56.10 57.99 1xsr s TRP 123 Cb -0.29 -2.95 -0.02 0.00 -1.15 0.00 0.00 33.47 29.06 1xsr s TRP 123 CO 0.34 -0.00 0.04 -3.38 0.02 0.00 0.00 176.95 173.96 1xsr s HIS 124 N 1.11 0.29 0.42 -1.98 -3.43 0.35 -0.84 115.29 111.21 1xsr s HIS 124 Ca 0.42 -0.64 -0.23 0.00 -0.80 0.00 0.00 55.06 53.82 1xsr s HIS 124 Cb -0.19 -0.21 -0.09 0.00 -1.43 0.00 0.00 32.58 30.66 1xsr s HIS 124 CO 0.20 -0.32 1.04 -1.58 -2.00 0.00 0.00 174.74 172.08 1xsr s HIS 125 N -2.61 3.20 0.60 0.38 2.46 -0.82 -0.63 115.29 117.87 1xsr s HIS 125 Ca -0.05 1.63 -0.20 0.00 0.47 0.00 0.00 55.06 56.91 1xsr s HIS 125 Cb -0.01 -3.09 -0.03 0.00 -0.13 0.00 0.00 32.58 29.31 1xsr s HIS 125 CO -0.05 -0.64 1.27 -2.30 -2.47 0.00 0.00 174.74 170.55 1xsr n PRO 126 N -0.32 1.33 -1.58 2.88 -0.02 -1.26 -4.85 135.00 131.17 1xsr n PRO 126 Ca 0.06 0.50 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 1xsr n PRO 126 Cb 0.51 -2.49 0.01 0.00 -0.02 0.00 0.00 33.50 31.51 1xsr n PRO 126 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1xsr n LEU 127 N -1.32 2.13 -3.59 2.45 0.00 -1.26 -5.02 117.00 110.39 1xsr n LEU 127 Ca 0.13 1.01 -0.13 0.00 0.00 0.00 0.00 56.01 57.03 1xsr n LEU 127 Cb 0.46 -1.31 -0.06 0.00 0.00 0.00 0.00 43.42 42.51 1xsr n LEU 127 CO 0.50 -1.74 0.59 0.72 0.00 0.00 0.00 177.39 177.46 1xsr s PHE 128 N -1.30 -0.57 0.74 1.96 -0.12 -1.26 -4.96 117.98 112.46 1xsr s PHE 128 Ca 0.63 1.22 -0.08 0.00 -0.05 0.00 0.00 56.93 58.65 1xsr s PHE 128 Cb -0.57 0.37 0.08 0.00 -0.63 0.00 0.00 43.02 42.27 1xsr s PHE 128 CO 0.57 -0.39 1.06 0.00 -0.05 0.00 0.00 175.22 176.41 1xsr s ALA 129 N -0.41 3.05 -0.11 1.99 0.00 -0.33 -4.68 121.76 121.26 1xsr s ALA 129 Ca -0.02 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.02 1xsr s ALA 129 Cb -0.03 -2.64 0.01 0.00 0.00 0.00 0.00 23.12 20.47 1xsr s ALA 129 CO 0.02 -1.44 -0.18 -0.46 0.00 0.00 0.00 175.76 173.70 1xsr s TRP 130 N -3.33 2.17 0.00 0.00 -0.11 -1.26 -2.62 118.94 113.78 1xsr s TRP 130 Ca 0.62 -1.01 0.00 0.00 1.22 0.00 0.00 56.10 56.93 1xsr s TRP 130 Cb -0.10 -1.52 0.00 0.00 -1.50 0.00 0.00 33.47 30.35 1xsr s TRP 130 CO 0.46 -0.49 0.00 1.04 -4.62 0.00 0.00 176.95 173.34 1xsr n GLN 131 N 4.06 0.00 -4.12 5.86 1.13 -1.26 -4.80 117.38 118.24 1xsr n GLN 131 Ca -0.20 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.78 1xsr n GLN 131 Cb 0.52 0.00 -0.10 0.00 0.11 0.00 0.00 30.24 30.77 1xsr n GLN 131 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 1xsr s ARG 132 N 0.00 0.75 0.33 -1.09 3.03 -1.26 -4.86 118.95 115.85 1xsr s ARG 132 Ca 0.00 -1.31 -0.26 0.00 2.03 0.00 0.00 55.73 56.19 1xsr s ARG 132 Cb 0.00 0.15 -0.14 0.00 -1.03 0.00 0.00 34.95 33.93 1xsr s ARG 132 CO 0.00 -0.14 0.81 0.28 -1.13 0.00 0.00 175.30 175.12 1xsr n VAL 133 N 0.02 2.00 -3.82 4.99 0.31 -1.26 -4.56 118.33 116.00 1xsr n VAL 133 Ca -0.11 -0.50 -0.12 0.00 -0.01 0.00 0.00 64.34 63.60 1xsr n VAL 133 Cb 0.62 -0.76 -0.12 0.00 -0.91 0.00 0.00 33.84 32.67 1xsr n VAL 133 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1xsr s THR 134 N -1.20 0.00 -0.12 2.52 2.01 -0.84 -5.01 115.64 113.02 1xsr s THR 134 Ca 0.61 -0.02 -0.14 0.00 0.31 0.00 0.00 61.69 62.45 1xsr s THR 134 Cb -0.68 -0.24 -0.05 0.00 0.01 0.00 0.00 72.50 71.54 1xsr s THR 134 CO 0.58 -0.01 0.32 -1.81 -0.69 0.00 0.00 174.62 173.01 1xsr s ASP 135 N 0.04 6.54 -0.10 3.53 -0.00 -1.26 -1.52 116.67 123.90 1xsr s ASP 135 Ca -0.00 0.64 0.02 0.00 -0.00 0.00 0.00 52.55 53.20 1xsr s ASP 135 Cb -0.01 -2.20 0.01 0.00 -0.00 0.00 0.00 42.92 40.72 1xsr s ASP 135 CO 0.00 0.17 -0.17 -0.36 -0.00 0.00 0.00 175.17 174.82 1xsr s PHE 136 N -0.02 2.02 -0.09 4.23 0.08 -0.48 -4.47 117.98 119.24 1xsr s PHE 136 Ca 0.19 -0.91 -0.28 0.00 0.12 0.00 0.00 56.93 56.05 1xsr s PHE 136 Cb -0.14 -1.43 -0.02 0.00 -0.57 0.00 0.00 43.02 40.86 1xsr s PHE 136 CO 0.07 -0.44 0.92 -1.17 -0.10 0.00 0.00 175.22 174.50 1xsr s LEU 137 N 0.82 4.27 0.04 -0.37 2.96 -0.31 -0.62 118.68 125.47 1xsr s LEU 137 Ca -0.10 1.44 0.04 0.00 -0.22 0.00 0.00 54.13 55.29 1xsr s LEU 137 Cb -0.16 -3.43 -0.04 0.00 0.50 0.00 0.00 46.19 43.07 1xsr s LEU 137 CO 0.01 -0.35 -0.05 -0.89 -1.32 0.00 0.00 176.35 173.75 1xsr s THR 138 N 1.67 3.73 -0.33 3.68 2.01 0.34 -1.85 115.64 124.88 1xsr s THR 138 Ca 0.45 -0.91 -0.01 0.00 0.31 0.00 0.00 61.69 61.53 1xsr s THR 138 Cb -0.18 -2.69 0.12 0.00 0.01 0.00 0.00 72.50 69.75 1xsr s THR 138 CO 0.19 0.27 0.16 -0.63 -0.69 0.00 0.00 174.62 173.92 1xsr s ILE 139 N -1.13 0.40 0.04 1.82 1.01 -1.06 -1.83 121.20 120.46 1xsr s ILE 139 Ca 0.20 -1.40 -0.01 0.00 0.00 0.00 0.00 60.65 59.44 1xsr s ILE 139 Cb -0.11 -1.31 0.00 0.00 0.01 0.00 0.00 42.46 41.05 1xsr s ILE 139 CO 0.12 -0.81 0.08 -0.90 0.00 0.00 0.00 174.94 173.43 1xsr n ASP 140 N 4.60 -0.23 0.02 3.58 3.85 -1.04 -2.28 116.55 125.05 1xsr n ASP 140 Ca 0.02 -1.20 -0.20 0.00 -0.71 0.00 0.00 54.79 52.70 1xsr n ASP 140 Cb 0.40 0.40 -0.14 0.00 -1.35 0.00 0.00 41.12 40.42 1xsr n ASP 140 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.20 176.10 1xsr h ARG 141 N 0.00 0.25 -4.93 0.11 2.43 -1.88 -1.62 114.38 108.73 1xsr h ARG 141 Ca -0.04 -0.43 -0.37 0.00 -0.81 0.00 0.00 59.98 58.33 1xsr h ARG 141 Cb 0.14 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1xsr h ARG 141 CO 0.05 1.21 -0.54 0.41 -1.51 0.00 0.00 179.97 179.58 1xsr n GLY 142 N 1.68 -0.50 0.00 2.80 0.00 -1.26 -4.76 105.19 103.15 1xsr n GLY 142 Ca -0.18 0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1xsr n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xsr n GLY 143 N -1.24 1.46 3.60 -0.02 0.00 -1.26 -5.17 105.19 102.56 1xsr n GLY 143 Ca -0.06 -1.65 -0.01 0.00 0.00 0.00 0.00 46.02 44.29 1xsr n GLY 143 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xsr s SER 144 N -1.00 -1.03 0.00 1.61 0.01 -1.26 -5.18 113.70 106.85 1xsr s SER 144 Ca 0.00 1.42 0.00 0.00 1.31 0.00 0.00 55.95 58.68 1xsr s SER 144 Cb 0.00 2.14 0.00 0.00 0.21 0.00 0.00 66.02 68.37 1xsr s SER 144 CO 0.00 -0.20 0.00 0.00 0.41 0.00 0.00 173.24 173.45 1xsr s ASP 148 N 1.38 6.01 -0.09 0.00 -0.00 -0.94 -4.97 116.67 118.06 1xsr s ASP 148 Ca 0.00 -0.97 -0.05 0.00 -0.00 0.00 0.00 52.55 51.53 1xsr s ASP 148 Cb 0.00 -2.12 -0.04 0.00 -0.00 0.00 0.00 42.92 40.76 1xsr s ASP 148 CO 0.00 -0.45 0.11 0.68 -0.00 0.00 0.00 175.17 175.51 1xsr s VAL 149 N 1.64 5.21 -0.01 -1.27 -7.23 -1.26 -1.49 120.40 115.99 1xsr s VAL 149 Ca 0.04 0.04 -0.02 0.00 -1.81 0.00 0.00 61.98 60.23 1xsr s VAL 149 Cb -0.19 -3.28 0.00 0.00 0.56 0.00 0.00 36.38 33.46 1xsr s VAL 149 CO 0.09 0.57 0.04 -1.61 -0.31 0.00 0.00 175.10 173.88 1xsr s GLU 150 N -1.15 0.10 0.42 4.82 0.41 0.03 -4.98 118.70 118.35 1xsr s GLU 150 Ca 0.17 -0.02 -0.14 0.00 -0.41 0.00 0.00 54.97 54.56 1xsr s GLU 150 Cb -0.12 0.04 -0.08 0.00 -1.78 0.00 0.00 34.13 32.20 1xsr s GLU 150 CO 0.06 -0.02 0.85 0.45 -0.49 0.00 0.00 175.26 176.11 1xsr s SER 151 N -0.19 6.65 0.07 -0.19 0.15 -1.26 -1.23 113.70 117.71 1xsr s SER 151 Ca -0.02 1.36 -0.08 0.00 0.70 0.00 0.00 55.95 57.91 1xsr s SER 151 Cb -0.02 -2.42 -0.00 0.00 -1.71 0.00 0.00 66.02 61.87 1xsr s SER 151 CO 0.00 -0.41 0.16 0.27 1.20 0.00 0.00 173.24 174.46 1xsr s ILE 152 N -2.35 0.14 0.03 6.45 -4.36 -0.51 -4.93 121.20 115.68 1xsr s ILE 152 Ca 0.55 -1.16 -0.33 0.00 -0.26 0.00 0.00 60.65 59.45 1xsr s ILE 152 Cb -0.10 -1.22 -0.12 0.00 1.25 0.00 0.00 42.46 42.28 1xsr s ILE 152 CO 0.26 -0.64 1.80 -0.81 0.24 0.00 0.00 174.94 175.79 1xsr n PRO 153 N 0.21 2.37 -1.19 0.37 -0.04 -1.26 -4.71 135.00 130.74 1xsr n PRO 153 Ca -0.16 0.86 -0.46 0.00 -0.04 0.00 0.00 63.50 63.70 1xsr n PRO 153 Cb 0.61 -2.71 -0.06 0.00 -0.04 0.00 0.00 33.50 31.30 1xsr n PRO 153 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1xsr n GLU 154 N 5.66 0.00 -5.01 0.54 2.13 -1.26 -4.91 120.64 117.79 1xsr n GLU 154 Ca 0.20 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.73 1xsr n GLU 154 Cb 0.32 -1.13 -0.16 0.00 0.27 0.00 0.00 31.44 30.73 1xsr n GLU 154 CO 0.00 0.00 0.00 -1.14 -0.41 0.00 0.00 177.13 175.58 1xsr s GLN 155 N -0.15 2.25 -0.32 5.31 2.00 -0.54 -4.87 119.66 123.34 1xsr s GLN 155 Ca 0.69 -0.73 -0.06 0.00 -2.00 0.00 0.00 55.36 53.26 1xsr s GLN 155 Cb -0.97 -1.86 0.03 0.00 0.80 0.00 0.00 33.01 31.01 1xsr s GLN 155 CO 0.46 0.25 0.09 -2.00 -0.50 0.00 0.00 175.29 173.58 1xsr s GLU 156 N 0.11 2.75 0.25 1.67 2.12 -1.26 -2.08 118.70 122.26 1xsr s GLU 156 Ca -0.08 -1.09 -0.30 0.00 0.36 0.00 0.00 54.97 53.87 1xsr s GLU 156 Cb -0.14 -3.41 -0.09 0.00 0.26 0.00 0.00 34.13 30.75 1xsr s GLU 156 CO 0.04 -0.59 1.26 -0.51 -0.54 0.00 0.00 175.26 174.92 1xsr s LEU 157 N 1.42 4.45 0.08 2.70 1.02 -0.91 -1.48 118.68 125.96 1xsr s LEU 157 Ca -0.01 2.44 0.05 0.00 0.02 0.00 0.00 54.13 56.64 1xsr s LEU 157 Cb -0.19 -3.62 -0.03 0.00 0.02 0.00 0.00 46.19 42.37 1xsr s LEU 157 CO 0.02 -0.44 -0.14 0.00 0.02 0.00 0.00 176.35 175.81 1xsr s PHE 159 N -1.55 2.83 0.00 0.00 0.40 -1.26 -0.37 117.98 118.03 1xsr s PHE 159 Ca 0.01 -1.22 0.00 0.00 -0.60 0.00 0.00 56.93 55.12 1xsr s PHE 159 Cb -0.08 -1.97 0.00 0.00 0.51 0.00 0.00 43.02 41.48 1xsr s PHE 159 CO 0.02 -0.61 0.00 0.00 0.70 0.00 0.00 175.22 175.33