#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xtu s LEU 3 N 0.00 2.91 -0.22 2.45 2.96 -1.26 -0.33 118.68 125.20 1xtu s LEU 3 Ca 0.00 -0.31 0.01 0.00 -0.22 0.00 0.00 54.13 53.61 1xtu s LEU 3 Cb 0.00 -1.70 0.05 0.00 0.50 0.00 0.00 46.19 45.03 1xtu s LEU 3 CO 0.00 0.09 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.69 1xtu s TYR 4 N 0.85 2.70 -0.46 5.38 1.51 0.20 -4.95 117.35 122.58 1xtu s TYR 4 Ca -0.02 -1.82 -0.09 0.00 -1.01 0.00 0.00 57.07 54.13 1xtu s TYR 4 Cb -0.15 -1.75 0.11 0.00 -0.11 0.00 0.00 41.96 40.06 1xtu s TYR 4 CO 0.01 -0.79 0.33 0.08 -1.11 0.00 0.00 175.55 174.07 1xtu s VAL 5 N 1.30 4.24 -0.91 0.71 1.01 -1.26 -0.57 120.40 124.92 1xtu s VAL 5 Ca -0.03 -1.69 -0.22 0.00 0.00 0.00 0.00 61.98 60.04 1xtu s VAL 5 Cb -0.17 -3.75 0.08 0.00 0.00 0.00 0.00 36.38 32.55 1xtu s VAL 5 CO -0.08 -0.72 1.24 -0.63 0.00 0.00 0.00 175.10 174.92 1xtu s ILE 6 N 1.38 4.26 -0.61 2.22 -1.09 0.07 -4.85 121.20 122.59 1xtu s ILE 6 Ca 0.05 -0.90 0.02 0.00 -2.23 0.00 0.00 60.65 57.59 1xtu s ILE 6 Cb -0.26 -4.89 0.39 0.00 -1.58 0.00 0.00 42.46 36.13 1xtu s ILE 6 CO 0.00 -1.70 1.50 -0.90 -1.23 0.00 0.00 174.94 172.61 1xtu n ASP 7 N 7.89 5.91 -4.89 3.58 5.68 -1.26 -4.49 116.55 128.97 1xtu n ASP 7 Ca 0.22 -3.77 -0.29 0.00 -0.50 0.00 0.00 54.79 50.45 1xtu n ASP 7 Cb 0.49 -0.71 -0.01 0.00 -1.14 0.00 0.00 41.12 39.75 1xtu n ASP 7 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1xtu s LYS 8 N -3.77 3.62 0.18 0.11 1.02 -1.26 -4.84 119.74 114.81 1xtu s LYS 8 Ca 0.50 0.39 -0.27 0.00 0.02 0.00 0.00 55.97 56.61 1xtu s LYS 8 Cb 0.42 -2.32 0.03 0.00 -0.52 0.00 0.00 37.83 35.44 1xtu s LYS 8 CO -0.28 -0.23 1.54 -1.35 -0.92 0.00 0.00 175.35 174.11 1xtu h PRO 9 N 0.40 -0.00 -0.96 -1.68 0.11 -1.99 -0.92 132.00 126.96 1xtu h PRO 9 Ca -0.46 0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.72 1xtu h PRO 9 Cb 1.20 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 1xtu h PRO 9 CO 0.62 -0.00 0.62 0.97 -0.21 0.00 0.00 178.00 180.00 1xtu h ILE 10 N -0.00 1.06 0.00 4.15 6.09 -1.99 0.39 117.51 127.21 1xtu h ILE 10 Ca 0.22 -0.37 -0.14 0.00 -1.37 0.00 0.00 64.86 63.19 1xtu h ILE 10 Cb 0.47 -0.12 -0.02 0.00 0.47 0.00 0.00 36.82 37.62 1xtu h ILE 10 CO -0.95 0.20 -0.69 0.71 -3.07 0.00 0.00 178.15 174.35 1xtu h THR 11 N 1.08 1.43 -0.11 2.19 1.35 -1.54 -1.91 112.91 115.40 1xtu h THR 11 Ca 0.42 -2.41 -0.23 0.00 -0.55 0.00 0.00 66.41 63.64 1xtu h THR 11 Cb 0.22 2.32 0.01 0.00 -1.73 0.00 0.00 68.15 68.98 1xtu h THR 11 CO -0.17 0.67 -0.83 -0.07 -0.25 0.00 0.00 175.52 174.88 1xtu h LEU 12 N 0.00 0.92 -0.30 3.87 3.38 -0.34 -0.43 115.31 122.41 1xtu h LEU 12 Ca -0.01 -0.66 0.06 0.00 0.09 0.00 0.00 57.88 57.36 1xtu h LEU 12 Cb 1.27 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 1xtu h LEU 12 CO 0.09 1.44 -0.03 -0.74 0.09 0.00 0.00 178.44 179.29 1xtu h HIS 13 N 0.48 -0.07 -0.50 1.13 2.76 -0.08 0.31 115.15 119.18 1xtu h HIS 13 Ca -0.07 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.05 1xtu h HIS 13 Cb 1.47 0.08 -0.02 0.00 1.55 0.00 0.00 27.41 30.49 1xtu h HIS 13 CO 0.09 -0.08 0.05 0.82 -1.30 0.00 0.00 177.93 177.51 1xtu h ILE 14 N 0.05 1.26 -0.87 6.26 2.04 -1.31 -2.50 117.51 122.44 1xtu h ILE 14 Ca 0.15 -1.00 0.03 0.00 1.00 0.00 0.00 64.86 65.04 1xtu h ILE 14 Cb 0.21 0.92 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 1xtu h ILE 14 CO -0.27 0.35 0.57 0.25 0.00 0.00 0.00 178.15 179.06 1xtu h LEU 15 N 0.73 0.94 -0.28 1.44 5.85 -0.23 -0.86 115.31 122.90 1xtu h LEU 15 Ca 0.15 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.88 1xtu h LEU 15 Cb 0.45 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1xtu h LEU 15 CO 0.02 0.65 0.12 0.74 -0.34 0.00 0.00 178.44 179.62 1xtu h THR 16 N 1.09 0.96 -0.99 1.05 2.02 0.01 0.12 112.91 117.17 1xtu h THR 16 Ca 0.34 -0.09 0.02 0.00 0.77 0.00 0.00 66.41 67.46 1xtu h THR 16 Cb 0.02 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.06 1xtu h THR 16 CO -0.10 0.05 0.65 1.56 0.37 0.00 0.00 175.52 178.05 1xtu h GLN 17 N 0.25 1.26 -0.58 6.66 4.20 -0.95 -0.09 115.11 125.87 1xtu h GLN 17 Ca 0.12 -0.08 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 1xtu h GLN 17 Cb 0.06 -0.28 -0.02 0.00 0.30 0.00 0.00 27.48 27.54 1xtu h GLN 17 CO -0.10 0.83 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.77 1xtu h LEU 18 N 1.30 1.05 -0.38 1.46 3.38 -0.35 -3.11 115.31 118.65 1xtu h LEU 18 Ca 0.38 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 1xtu h LEU 18 Cb -0.08 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.37 1xtu h LEU 18 CO -0.10 1.12 0.01 0.03 0.09 0.00 0.00 178.44 179.59 1xtu h ARG 19 N 0.95 0.67 -6.09 1.13 3.08 -0.05 -3.43 114.38 110.63 1xtu h ARG 19 Ca 0.16 -0.21 -0.69 0.00 0.07 0.00 0.00 59.98 59.31 1xtu h ARG 19 Cb 0.62 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 1xtu h ARG 19 CO 0.04 0.76 1.18 -3.47 -1.07 0.00 0.00 179.97 177.41 1xtu n ASP 20 N -4.48 2.41 0.21 7.04 -0.08 -0.11 -4.77 116.55 116.77 1xtu n ASP 20 Ca -0.01 0.75 0.15 0.00 -1.51 0.00 0.00 54.79 54.17 1xtu n ASP 20 Cb 0.27 -1.23 0.72 0.00 2.34 0.00 0.00 41.12 43.22 1xtu n ASP 20 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 1xtu h LYS 21 N 9.94 0.00 -0.71 -0.67 2.10 -1.87 -2.52 116.57 122.84 1xtu h LYS 21 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 1xtu h LYS 21 Cb 1.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.64 1xtu h LYS 21 CO 0.99 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 179.10 1xtu n TYR 22 N -2.56 0.40 -3.59 0.07 4.02 -1.26 -4.81 117.16 109.43 1xtu n TYR 22 Ca -0.01 -0.15 -0.38 0.00 -0.01 0.00 0.00 57.90 57.36 1xtu n TYR 22 Cb 0.13 -0.14 -0.11 0.00 -0.02 0.00 0.00 39.34 39.20 1xtu n TYR 22 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1xtu s THR 23 N -1.49 5.26 0.90 -0.72 2.01 -0.95 -5.07 115.64 115.58 1xtu s THR 23 Ca 0.12 0.11 -0.10 0.00 0.31 0.00 0.00 61.69 62.13 1xtu s THR 23 Cb 0.08 -3.53 0.14 0.00 0.01 0.00 0.00 72.50 69.20 1xtu s THR 23 CO 0.05 0.23 1.12 1.51 -0.69 0.00 0.00 174.62 176.83 1xtu s ASP 24 N 1.75 3.15 0.35 3.53 3.84 -1.26 -4.69 116.67 123.34 1xtu s ASP 24 Ca 0.07 1.99 0.05 0.00 -0.00 0.00 0.00 52.55 54.66 1xtu s ASP 24 Cb -0.16 -2.51 0.71 0.00 -1.38 0.00 0.00 42.92 39.58 1xtu s ASP 24 CO 0.11 -2.92 1.93 0.06 -0.00 0.00 0.00 175.17 174.34 1xtu h GLN 25 N -1.74 0.78 0.49 2.11 3.07 -1.83 0.10 115.11 118.09 1xtu h GLN 25 Ca -0.45 -0.05 -0.02 0.00 0.09 0.00 0.00 58.65 58.22 1xtu h GLN 25 Cb 1.27 -0.18 0.00 0.00 0.08 0.00 0.00 27.48 28.65 1xtu h GLN 25 CO 0.46 0.52 -0.23 0.82 0.09 0.00 0.00 178.83 180.48 1xtu h ILE 26 N 0.81 0.52 0.00 1.86 2.04 -1.86 -0.08 117.51 120.80 1xtu h ILE 26 Ca 0.36 -0.06 -0.04 0.00 1.00 0.00 0.00 64.86 66.12 1xtu h ILE 26 Cb 0.34 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1xtu h ILE 26 CO -0.13 0.01 -0.20 0.78 0.00 0.00 0.00 178.15 178.61 1xtu h ASN 27 N -0.69 0.00 0.18 1.72 2.35 -1.86 -1.03 115.58 116.25 1xtu h ASN 27 Ca -0.07 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 1xtu h ASN 27 Cb 0.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1xtu h ASN 27 CO 0.11 0.20 -0.09 0.15 -1.65 0.00 0.00 177.43 176.15 1xtu h PHE 28 N 0.00 -0.23 -0.18 1.19 3.57 -0.34 -1.69 116.94 119.26 1xtu h PHE 28 Ca -0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1xtu h PHE 28 Cb 0.62 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 1xtu h PHE 28 CO 0.00 0.03 0.11 0.00 -2.23 0.00 0.00 178.31 176.22 1xtu h ARG 29 N -0.46 0.23 -0.72 1.11 3.08 -0.72 -1.78 114.38 115.12 1xtu h ARG 29 Ca -0.03 -0.02 0.11 0.00 0.07 0.00 0.00 59.98 60.11 1xtu h ARG 29 Cb 0.36 -0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.28 1xtu h ARG 29 CO 0.04 0.17 0.34 0.87 -1.07 0.00 0.00 179.97 180.33 1xtu h LYS 30 N 0.22 0.55 -0.37 0.04 1.57 -1.17 -0.15 116.57 117.26 1xtu h LYS 30 Ca 0.06 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1xtu h LYS 30 Cb -0.01 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 1xtu h LYS 30 CO -0.01 0.36 -0.04 -0.91 -0.57 0.00 0.00 179.45 178.28 1xtu h ASN 31 N 0.57 0.58 -0.37 0.86 2.35 -0.94 -1.16 115.58 117.46 1xtu h ASN 31 Ca 0.37 -0.13 -0.08 0.00 -0.55 0.00 0.00 56.30 55.90 1xtu h ASN 31 Cb 0.43 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.63 1xtu h ASN 31 CO -0.30 0.68 -0.05 0.25 -1.65 0.00 0.00 177.43 176.35 1xtu h LEU 32 N 0.57 0.76 -0.13 1.61 5.85 -0.22 -0.39 115.31 123.37 1xtu h LEU 32 Ca 0.11 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.57 1xtu h LEU 32 Cb 0.42 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 1xtu h LEU 32 CO 0.02 0.86 -0.14 0.58 -0.34 0.00 0.00 178.44 179.42 1xtu h VAL 33 N 0.72 1.36 -0.71 1.05 2.07 -0.67 -1.47 116.25 118.60 1xtu h VAL 33 Ca 0.13 -1.31 0.07 0.00 0.82 0.00 0.00 66.70 66.41 1xtu h VAL 33 Cb 0.52 1.93 -0.06 0.00 -1.52 0.00 0.00 31.29 32.16 1xtu h VAL 33 CO 0.03 0.38 0.39 -0.09 0.02 0.00 0.00 177.57 178.30 1xtu h ARG 34 N -0.07 0.68 -0.26 1.57 2.43 -1.01 -1.34 114.38 116.38 1xtu h ARG 34 Ca 0.02 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1xtu h ARG 34 Cb 0.67 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 1xtu h ARG 34 CO 0.03 0.45 0.08 -0.07 -1.51 0.00 0.00 179.97 178.95 1xtu h LEU 35 N 0.70 0.38 -0.75 3.80 3.38 -1.00 -2.45 115.31 119.36 1xtu h LEU 35 Ca 0.32 -0.21 0.17 0.00 0.09 0.00 0.00 57.88 58.26 1xtu h LEU 35 Cb 0.24 -0.10 -0.12 0.00 0.09 0.00 0.00 40.66 40.77 1xtu h LEU 35 CO -0.21 0.49 0.11 1.23 0.09 0.00 0.00 178.44 180.15 1xtu h GLY 36 N 0.25 0.97 0.72 0.83 0.00 -0.23 0.35 103.07 105.95 1xtu h GLY 36 Ca 0.08 0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.41 1xtu h GLY 36 CO -0.00 -0.25 -0.48 3.21 0.00 0.00 0.00 176.54 179.02 1xtu h ARG 37 N 0.19 -1.06 -0.25 4.80 3.08 -1.02 -0.30 114.38 119.81 1xtu h ARG 37 Ca 0.42 0.07 0.06 0.00 0.07 0.00 0.00 59.98 60.61 1xtu h ARG 37 Cb 0.75 0.24 -0.07 0.00 0.08 0.00 0.00 29.97 30.97 1xtu h ARG 37 CO -0.59 -0.71 -0.27 0.82 -1.07 0.00 0.00 179.97 178.16 1xtu h ILE 38 N -1.10 0.35 -0.41 2.04 2.04 -0.70 0.27 117.51 120.00 1xtu h ILE 38 Ca -0.09 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.84 1xtu h ILE 38 Cb 0.91 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1xtu h ILE 38 CO 0.05 0.00 0.28 -0.07 0.00 0.00 0.00 178.15 178.40 1xtu h LEU 39 N -0.27 0.25 0.10 1.44 3.38 -0.31 0.09 115.31 119.99 1xtu h LEU 39 Ca 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1xtu h LEU 39 Cb 0.49 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1xtu h LEU 39 CO -0.41 0.16 -0.05 1.23 0.09 0.00 0.00 178.44 179.47 1xtu h GLY 40 N 0.29 -0.14 -0.01 0.83 0.00 0.13 0.10 103.07 104.26 1xtu h GLY 40 Ca 0.18 0.05 0.10 0.00 0.00 0.00 0.00 47.33 47.66 1xtu h GLY 40 CO -0.04 -0.05 -0.15 -1.82 0.00 0.00 0.00 176.54 174.48 1xtu h TYR 41 N -0.30 -0.34 -0.47 5.60 3.20 0.52 0.15 116.97 125.34 1xtu h TYR 41 Ca -0.01 0.05 0.05 0.00 3.14 0.00 0.00 58.73 61.96 1xtu h TYR 41 Cb 0.25 0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.69 1xtu h TYR 41 CO -0.02 -0.24 0.19 0.93 -1.64 0.00 0.00 178.16 177.38 1xtu h GLU 42 N -0.04 0.37 -0.71 1.82 4.39 -0.69 -1.49 114.58 118.23 1xtu h GLU 42 Ca 0.23 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.88 1xtu h GLU 42 Cb 0.39 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.92 1xtu h GLU 42 CO -0.51 0.24 0.34 0.82 -1.16 0.00 0.00 179.01 178.74 1xtu h ILE 43 N 0.38 1.23 -0.73 3.13 2.04 0.01 -2.78 117.51 120.79 1xtu h ILE 43 Ca 0.22 -0.66 0.16 0.00 1.00 0.00 0.00 64.86 65.57 1xtu h ILE 43 Cb 0.19 0.36 -0.13 0.00 -0.74 0.00 0.00 36.82 36.50 1xtu h ILE 43 CO -0.20 0.28 -0.08 0.28 0.00 0.00 0.00 178.15 178.43 1xtu h SER 44 N 0.99 -0.49 0.25 1.72 0.02 0.33 0.34 113.55 116.71 1xtu h SER 44 Ca 0.24 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.40 1xtu h SER 44 Cb 0.12 0.39 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1xtu h SER 44 CO -0.03 -0.21 0.00 0.59 -1.14 0.00 0.00 176.83 176.04 1xtu n ASN 45 N -5.41 0.00 -0.00 3.07 3.02 -1.05 -1.30 115.26 113.59 1xtu n ASN 45 Ca 0.11 0.20 0.10 0.00 -0.03 0.00 0.00 54.58 54.97 1xtu n ASN 45 Cb 0.42 -0.33 -0.13 0.00 -0.61 0.00 0.00 39.78 39.13 1xtu n ASN 45 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1xtu n THR 46 N -1.33 0.00 -1.64 3.41 -2.24 0.11 -4.98 114.28 107.62 1xtu n THR 46 Ca 0.05 -0.17 -0.37 0.00 -2.27 0.00 0.00 64.05 61.30 1xtu n THR 46 Cb 0.10 0.70 0.08 0.00 -2.10 0.00 0.00 70.33 69.11 1xtu n THR 46 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1xtu n LEU 47 N -1.70 5.71 -4.74 3.22 4.77 -0.42 -4.95 117.00 118.90 1xtu n LEU 47 Ca 0.01 0.79 -0.41 0.00 -0.03 0.00 0.00 56.01 56.38 1xtu n LEU 47 Cb 0.38 -1.54 -0.03 0.00 -2.33 0.00 0.00 43.42 39.90 1xtu n LEU 47 CO 0.41 -1.14 0.92 -0.62 -1.33 0.00 0.00 177.39 175.63 1xtu s ASP 48 N -1.48 7.02 0.21 -1.43 -1.08 -1.26 -5.02 116.67 113.64 1xtu s ASP 48 Ca 0.81 2.28 -0.01 0.00 -0.52 0.00 0.00 52.55 55.11 1xtu s ASP 48 Cb -0.37 -2.61 -0.04 0.00 -1.46 0.00 0.00 42.92 38.45 1xtu s ASP 48 CO 0.42 -0.42 0.16 -0.72 0.52 0.00 0.00 175.17 175.13 1xtu s TYR 49 N 0.02 1.16 0.18 -5.34 -0.85 -1.26 -4.25 117.35 107.01 1xtu s TYR 49 Ca 0.54 -1.36 0.10 0.00 -0.52 0.00 0.00 57.07 55.83 1xtu s TYR 49 Cb -0.34 -0.53 -0.04 0.00 0.38 0.00 0.00 41.96 41.43 1xtu s TYR 49 CO 0.37 -0.68 -0.21 -1.83 -1.52 0.00 0.00 175.55 171.68 1xtu s GLU 50 N -4.10 1.41 -0.04 -3.49 -1.05 -0.92 -5.00 118.70 105.51 1xtu s GLU 50 Ca 0.38 -1.48 -0.15 0.00 -0.15 0.00 0.00 54.97 53.57 1xtu s GLU 50 Cb 0.06 -1.59 -0.05 0.00 -0.44 0.00 0.00 34.13 32.11 1xtu s GLU 50 CO 0.13 0.33 0.39 0.42 0.95 0.00 0.00 175.26 177.49 1xtu s ILE 51 N -1.89 5.10 0.30 1.83 1.01 -1.26 -1.81 121.20 124.48 1xtu s ILE 51 Ca 0.19 0.80 0.05 0.00 0.00 0.00 0.00 60.65 61.69 1xtu s ILE 51 Cb -0.07 -3.71 -0.02 0.00 0.01 0.00 0.00 42.46 38.68 1xtu s ILE 51 CO 0.09 0.52 0.20 1.33 0.00 0.00 0.00 174.94 177.08 1xtu n VAL 52 N 2.28 0.00 -4.11 2.92 0.24 0.67 -4.95 118.33 115.38 1xtu n VAL 52 Ca -0.13 -2.03 -0.15 0.00 -2.04 0.00 0.00 64.34 59.99 1xtu n VAL 52 Cb 0.52 0.92 -0.12 0.00 -1.47 0.00 0.00 33.84 33.69 1xtu n VAL 52 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1xtu s GLU 53 N -3.20 0.62 0.01 7.34 2.12 -1.26 0.20 118.70 124.53 1xtu s GLU 53 Ca 0.28 -0.78 -0.14 0.00 0.36 0.00 0.00 54.97 54.68 1xtu s GLU 53 Cb 0.01 -0.47 0.02 0.00 0.26 0.00 0.00 34.13 33.95 1xtu s GLU 53 CO 0.20 0.10 0.31 0.54 -0.54 0.00 0.00 175.26 175.86 1xtu s VAL 54 N -1.27 0.07 -0.29 3.70 0.11 0.34 -4.89 120.40 118.18 1xtu s VAL 54 Ca -0.07 -0.55 -0.11 0.00 -2.93 0.00 0.00 61.98 58.32 1xtu s VAL 54 Cb -0.10 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 33.97 1xtu s VAL 54 CO 0.01 -0.30 0.18 -0.70 -3.33 0.00 0.00 175.10 170.96 1xtu s GLU 55 N -1.80 3.84 0.72 1.54 2.12 -1.26 -0.79 118.70 123.08 1xtu s GLU 55 Ca -0.10 -0.39 -0.11 0.00 0.36 0.00 0.00 54.97 54.72 1xtu s GLU 55 Cb -0.04 -3.64 0.02 0.00 0.26 0.00 0.00 34.13 30.74 1xtu s GLU 55 CO 0.01 -0.22 1.10 0.95 -0.54 0.00 0.00 175.26 176.56 1xtu s THR 56 N 1.73 3.43 0.66 -1.70 -4.23 0.20 -4.90 115.64 110.83 1xtu s THR 56 Ca 0.07 0.46 0.31 0.00 -1.18 0.00 0.00 61.69 61.35 1xtu s THR 56 Cb -0.16 -3.40 0.32 0.00 1.34 0.00 0.00 72.50 70.59 1xtu s THR 56 CO 0.10 -0.61 1.95 -0.65 -0.54 0.00 0.00 174.62 174.88 1xtu h PRO 57 N -0.74 0.00 -0.42 3.99 0.11 -1.98 0.19 132.00 133.15 1xtu h PRO 57 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1xtu h PRO 57 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1xtu h PRO 57 CO 0.63 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.70 1xtu n LEU 58 N -2.98 0.66 -1.52 2.35 4.77 -1.26 -4.85 117.00 114.18 1xtu n LEU 58 Ca -0.01 -0.33 -0.17 0.00 -0.03 0.00 0.00 56.01 55.47 1xtu n LEU 58 Cb 0.38 -0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1xtu n LEU 58 CO 0.15 0.15 -0.18 0.61 -1.33 0.00 0.00 177.39 176.79 1xtu n GLY 59 N 0.35 0.86 3.50 -0.72 0.00 0.66 -5.00 105.19 104.85 1xtu n GLY 59 Ca 0.02 -0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 1xtu n GLY 59 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xtu s VAL 60 N -2.70 2.77 -0.03 1.61 -7.23 -1.24 -4.93 120.40 108.65 1xtu s VAL 60 Ca 0.00 -1.96 0.01 0.00 -1.81 0.00 0.00 61.98 58.22 1xtu s VAL 60 Cb 0.00 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 1xtu s VAL 60 CO 0.00 -0.19 -0.01 -0.54 -0.31 0.00 0.00 175.10 174.06 1xtu s LYS 61 N -2.96 2.82 0.05 4.82 1.02 -1.26 -0.63 119.74 123.59 1xtu s LYS 61 Ca 0.25 -0.56 -0.07 0.00 0.02 0.00 0.00 55.97 55.60 1xtu s LYS 61 Cb -0.08 -2.68 -0.01 0.00 -0.52 0.00 0.00 37.83 34.54 1xtu s LYS 61 CO 0.13 0.64 0.14 -0.08 -0.92 0.00 0.00 175.35 175.27 1xtu s THR 62 N -1.02 0.13 0.41 2.17 -1.32 0.03 -4.95 115.64 111.10 1xtu s THR 62 Ca 0.17 -1.07 -0.16 0.00 -1.21 0.00 0.00 61.69 59.43 1xtu s THR 62 Cb -0.11 -0.99 -0.09 0.00 -1.51 0.00 0.00 72.50 69.80 1xtu s THR 62 CO 0.08 -0.59 0.85 -0.54 -2.21 0.00 0.00 174.62 172.21 1xtu s LYS 63 N -2.82 3.99 0.27 7.08 1.02 -1.26 -0.50 119.74 127.52 1xtu s LYS 63 Ca -0.03 0.79 -0.01 0.00 0.02 0.00 0.00 55.97 56.74 1xtu s LYS 63 Cb 0.00 -2.30 0.01 0.00 -0.52 0.00 0.00 37.83 35.02 1xtu s LYS 63 CO -0.05 -0.03 0.37 0.41 -0.92 0.00 0.00 175.35 175.13 1xtu n GLY 64 N -0.91 2.34 3.51 -3.33 0.00 0.13 -4.88 105.19 102.04 1xtu n GLY 64 Ca 0.05 -1.56 -0.28 0.00 0.00 0.00 0.00 46.02 44.23 1xtu n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xtu s VAL 65 N -2.72 2.87 -0.23 1.61 1.01 -1.26 -0.24 120.40 121.43 1xtu s VAL 65 Ca 0.22 -1.68 -0.03 0.00 0.00 0.00 0.00 61.98 60.49 1xtu s VAL 65 Cb -0.01 -2.37 0.11 0.00 0.00 0.00 0.00 36.38 34.11 1xtu s VAL 65 CO 0.16 -0.03 0.26 -0.62 0.00 0.00 0.00 175.10 174.87 1xtu s ASP 66 N -2.52 1.34 -1.25 3.32 3.68 -0.75 -4.88 116.67 115.61 1xtu s ASP 66 Ca 0.21 -0.31 -0.14 0.00 2.13 0.00 0.00 52.55 54.44 1xtu s ASP 66 Cb -0.09 0.49 0.14 0.00 -1.45 0.00 0.00 42.92 42.01 1xtu s ASP 66 CO 0.12 -0.34 1.58 -0.38 0.13 0.00 0.00 175.17 176.28 1xtu n ILE 67 N 5.32 4.16 0.02 4.11 5.41 -1.26 -2.16 119.36 134.96 1xtu n ILE 67 Ca -0.04 -4.49 0.13 0.00 1.00 0.00 0.00 62.75 59.34 1xtu n ILE 67 Cb 0.49 -2.43 0.57 0.00 -0.71 0.00 0.00 39.64 37.56 1xtu n ILE 67 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 1xtu h THR 68 N 4.79 0.89 0.00 1.39 1.35 -1.94 -0.84 112.91 118.56 1xtu h THR 68 Ca 0.37 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 66.15 1xtu h THR 68 Cb 0.84 0.64 0.00 0.00 -1.73 0.00 0.00 68.15 67.91 1xtu h THR 68 CO 1.35 0.04 0.16 0.47 -0.25 0.00 0.00 175.52 177.30 1xtu n ASP 69 N -4.46 0.34 0.00 5.36 8.00 -1.26 -1.28 116.55 123.25 1xtu n ASP 69 Ca 0.07 0.59 0.02 0.00 0.71 0.00 0.00 54.79 56.18 1xtu n ASP 69 Cb 0.35 -0.59 0.12 0.00 -0.02 0.00 0.00 41.12 40.98 1xtu n ASP 69 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1xtu n LEU 70 N -1.98 0.00 -0.32 0.64 4.77 -0.32 0.27 117.00 120.06 1xtu n LEU 70 Ca -0.01 0.33 0.08 0.00 -0.03 0.00 0.00 56.01 56.38 1xtu n LEU 70 Cb 0.18 -0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 40.93 1xtu n LEU 70 CO 0.06 -0.27 0.21 0.59 -1.33 0.00 0.00 177.39 176.65 1xtu n ASN 71 N -1.33 1.51 -2.86 -1.43 3.02 -0.40 -4.54 115.26 109.23 1xtu n ASN 71 Ca 0.02 -1.26 -0.29 0.00 -0.03 0.00 0.00 54.58 53.03 1xtu n ASN 71 Cb 0.04 0.56 -0.02 0.00 -0.61 0.00 0.00 39.78 39.75 1xtu n ASN 71 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1xtu n ASN 72 N -0.32 4.95 -4.17 6.41 3.02 0.14 -4.96 115.26 120.33 1xtu n ASN 72 Ca 0.06 -3.71 -0.28 0.00 -0.03 0.00 0.00 54.58 50.62 1xtu n ASN 72 Cb 0.33 -0.61 -0.16 0.00 -0.61 0.00 0.00 39.78 38.73 1xtu n ASN 72 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1xtu s ILE 73 N -4.82 1.67 -0.14 2.41 1.01 -1.25 0.31 121.20 120.38 1xtu s ILE 73 Ca 0.48 -0.83 -0.00 0.00 0.00 0.00 0.00 60.65 60.30 1xtu s ILE 73 Cb 0.32 -1.44 0.03 0.00 0.01 0.00 0.00 42.46 41.38 1xtu s ILE 73 CO -0.17 0.47 -0.08 -0.69 0.00 0.00 0.00 174.94 174.48 1xtu s VAL 74 N 0.16 1.16 -0.21 2.92 1.01 -0.86 -1.14 120.40 123.43 1xtu s VAL 74 Ca -0.09 -0.49 -0.10 0.00 0.00 0.00 0.00 61.98 61.30 1xtu s VAL 74 Cb -0.14 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 1xtu s VAL 74 CO 0.04 0.29 0.14 -0.63 0.00 0.00 0.00 175.10 174.94 1xtu s ILE 75 N 1.64 5.39 -0.25 2.22 1.01 0.26 -0.84 121.20 130.62 1xtu s ILE 75 Ca 0.03 0.20 -0.09 0.00 0.00 0.00 0.00 60.65 60.79 1xtu s ILE 75 Cb -0.14 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 1xtu s ILE 75 CO -0.08 0.41 0.12 -0.63 0.00 0.00 0.00 174.94 174.76 1xtu s ILE 76 N 0.57 4.79 -0.37 2.92 1.01 0.10 -1.55 121.20 128.66 1xtu s ILE 76 Ca 0.08 -0.01 -0.18 0.00 0.00 0.00 0.00 60.65 60.54 1xtu s ILE 76 Cb -0.12 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.11 1xtu s ILE 76 CO -0.00 0.32 0.52 0.21 0.00 0.00 0.00 174.94 175.99 1xtu s ASN 77 N 1.50 6.30 0.11 3.58 3.84 -0.02 -3.19 114.94 127.07 1xtu s ASN 77 Ca 0.06 -0.13 0.23 0.00 0.21 0.00 0.00 52.86 53.23 1xtu s ASN 77 Cb -0.15 -2.27 0.92 0.00 -0.55 0.00 0.00 41.25 39.20 1xtu s ASN 77 CO 0.06 -0.52 1.72 -0.38 -2.79 0.00 0.00 177.10 175.19 1xtu n ILE 78 N 5.48 0.59 -1.46 -5.21 5.41 -1.26 -1.58 119.36 121.33 1xtu n ILE 78 Ca -0.05 0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.76 1xtu n ILE 78 Cb 0.49 -0.81 -0.00 0.00 -0.71 0.00 0.00 39.64 38.61 1xtu n ILE 78 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1xtu n LEU 79 N -1.85 0.00 0.00 1.39 4.77 -1.26 -3.63 117.00 116.42 1xtu n LEU 79 Ca 0.05 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1xtu n LEU 79 Cb 0.29 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1xtu n LEU 79 CO 0.23 -0.09 0.00 0.54 -1.33 0.00 0.00 177.39 176.74 1xtu n ARG 80 N -0.75 0.00 0.28 3.23 1.74 -1.26 -1.81 116.66 118.09 1xtu n ARG 80 Ca 0.00 0.00 0.18 0.00 -0.77 0.00 0.00 57.85 57.26 1xtu n ARG 80 Cb 0.02 0.00 0.95 0.00 -1.02 0.00 0.00 32.46 32.41 1xtu n ARG 80 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xtu h ALA 81 N -0.86 1.46 0.00 7.54 0.00 -1.92 -2.16 119.26 123.32 1xtu h ALA 81 Ca 0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1xtu h ALA 81 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1xtu h ALA 81 CO 0.00 -0.17 -0.35 0.00 0.00 0.00 0.00 179.25 178.73 1xtu h ALA 82 N 1.80 1.34 -0.79 0.00 0.00 -1.69 -3.32 119.26 116.61 1xtu h ALA 82 Ca 0.03 -0.32 0.09 0.00 0.00 0.00 0.00 54.91 54.72 1xtu h ALA 82 Cb 0.30 -0.06 -0.11 0.00 0.00 0.00 0.00 17.79 17.92 1xtu h ALA 82 CO -0.00 0.43 -0.53 0.28 0.00 0.00 0.00 179.25 179.43 1xtu h VAL 83 N 0.00 0.01 -0.61 0.00 2.07 -1.54 0.38 116.25 116.56 1xtu h VAL 83 Ca -0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1xtu h VAL 83 Cb 0.65 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 1xtu h VAL 83 CO 0.05 0.00 0.40 -0.65 0.02 0.00 0.00 177.57 177.39 1xtu h PRO 84 N -0.13 0.72 -0.24 1.57 0.11 -1.80 0.97 132.00 133.19 1xtu h PRO 84 Ca 0.17 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.16 1xtu h PRO 84 Cb 0.50 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 1xtu h PRO 84 CO -0.82 0.48 -0.13 1.25 -0.21 0.00 0.00 178.00 178.56 1xtu h LEU 85 N 0.74 0.53 -0.98 2.35 5.85 -1.15 -2.45 115.31 120.20 1xtu h LEU 85 Ca 0.24 -0.42 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 1xtu h LEU 85 Cb 0.05 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1xtu h LEU 85 CO -0.06 0.83 0.27 0.58 -0.34 0.00 0.00 178.44 179.72 1xtu h VAL 86 N 0.22 1.24 -0.81 1.05 2.07 0.25 -1.53 116.25 118.73 1xtu h VAL 86 Ca 0.05 -0.74 0.06 0.00 0.82 0.00 0.00 66.70 66.89 1xtu h VAL 86 Cb 0.64 0.42 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 1xtu h VAL 86 CO 0.04 0.30 0.50 -0.08 0.02 0.00 0.00 177.57 178.34 1xtu h GLU 87 N 0.99 0.89 -0.41 1.57 4.57 -0.64 0.34 114.58 121.88 1xtu h GLU 87 Ca 0.23 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 58.30 1xtu h GLU 87 Cb 0.19 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 1xtu h GLU 87 CO -0.02 0.59 0.04 0.78 -1.18 0.00 0.00 179.01 179.22 1xtu h GLY 88 N 0.91 0.75 0.99 1.92 0.00 -0.90 -2.30 103.07 104.45 1xtu h GLY 88 Ca 0.35 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 1xtu h GLY 88 CO -0.17 0.48 0.26 1.41 0.00 0.00 0.00 176.54 178.52 1xtu h LEU 89 N 0.54 0.51 -1.06 3.11 3.38 -0.31 -2.42 115.31 119.06 1xtu h LEU 89 Ca 0.12 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.08 1xtu h LEU 89 Cb 0.41 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 1xtu h LEU 89 CO 0.01 0.41 0.63 -0.07 0.09 0.00 0.00 178.44 179.52 1xtu h LEU 90 N 0.57 1.03 -1.86 1.67 3.38 -0.23 0.84 115.31 120.71 1xtu h LEU 90 Ca 0.15 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1xtu h LEU 90 Cb -0.01 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1xtu h LEU 90 CO -0.03 0.70 -0.13 0.11 0.09 0.00 0.00 178.44 179.17 1xtu h LYS 91 N 1.19 0.00 0.11 1.13 1.79 -0.95 -2.24 116.57 117.60 1xtu h LYS 91 Ca 0.39 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.58 1xtu h LYS 91 Cb 0.05 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 30.73 1xtu h LYS 91 CO -0.13 0.13 -1.21 0.00 -1.08 0.00 0.00 179.45 177.16 1xtu h ALA 92 N 1.87 0.07 -2.66 3.86 0.00 -0.46 -3.38 119.26 118.55 1xtu h ALA 92 Ca -0.00 -0.79 -0.66 0.00 0.00 0.00 0.00 54.91 53.46 1xtu h ALA 92 Cb 0.29 0.08 -0.39 0.00 0.00 0.00 0.00 17.79 17.76 1xtu h ALA 92 CO 0.02 0.76 -0.31 1.19 0.00 0.00 0.00 179.25 180.91 1xtu n PHE 93 N -3.73 3.60 -0.36 0.00 3.01 -0.31 -4.93 117.46 114.75 1xtu n PHE 93 Ca -0.12 -4.07 0.26 0.00 1.01 0.00 0.00 57.45 54.53 1xtu n PHE 93 Cb 0.98 -0.82 0.51 0.00 -0.01 0.00 0.00 39.48 40.13 1xtu n PHE 93 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1xtu h PRO 94 N 5.24 0.31 -0.66 -1.08 0.11 -1.73 0.23 132.00 134.41 1xtu h PRO 94 Ca 0.17 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1xtu h PRO 94 Cb 0.73 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.77 1xtu h PRO 94 CO 0.85 0.20 0.00 1.63 -0.21 0.00 0.00 178.00 180.47 1xtu n LYS 95 N -4.86 3.72 -3.00 1.05 5.02 -1.26 -4.96 118.16 113.87 1xtu n LYS 95 Ca 0.31 -2.35 -0.38 0.00 -2.02 0.00 0.00 58.31 53.86 1xtu n LYS 95 Cb 1.03 -1.98 -0.06 0.00 -0.02 0.00 0.00 35.03 34.00 1xtu n LYS 95 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xtu s ALA 96 N -2.17 3.41 0.47 7.82 0.00 0.07 -4.74 121.76 126.63 1xtu s ALA 96 Ca 0.41 0.31 -0.03 0.00 0.00 0.00 0.00 51.96 52.65 1xtu s ALA 96 Cb 0.30 -2.93 -0.02 0.00 0.00 0.00 0.00 23.12 20.46 1xtu s ALA 96 CO 0.14 0.29 0.74 1.03 0.00 0.00 0.00 175.76 177.97 1xtu s ARG 97 N -1.51 3.37 -0.01 0.00 0.52 -0.29 -4.91 118.95 116.12 1xtu s ARG 97 Ca 0.39 -0.03 0.01 0.00 -0.52 0.00 0.00 55.73 55.59 1xtu s ARG 97 Cb -0.21 -2.44 0.01 0.00 0.52 0.00 0.00 34.95 32.83 1xtu s ARG 97 CO 0.24 -0.22 -0.03 -1.14 0.02 0.00 0.00 175.30 174.17 1xtu s GLN 98 N -4.67 0.38 0.27 3.54 0.74 -1.26 -0.58 119.66 118.07 1xtu s GLN 98 Ca 0.47 -0.10 0.06 0.00 0.05 0.00 0.00 55.36 55.84 1xtu s GLN 98 Cb -0.10 -0.40 -0.06 0.00 1.10 0.00 0.00 33.01 33.55 1xtu s GLN 98 CO 0.42 0.03 -0.04 0.20 -0.55 0.00 0.00 175.29 175.36 1xtu s GLY 99 N 0.21 1.78 -0.02 2.59 0.00 -0.59 -4.57 107.32 106.73 1xtu s GLY 99 Ca -0.02 -1.88 0.02 0.00 0.00 0.00 0.00 44.72 42.84 1xtu s GLY 99 CO -0.00 -1.80 -0.06 -1.34 0.00 0.00 0.00 173.10 169.89 1xtu s VAL 100 N -3.13 0.57 -0.44 1.40 -7.23 0.40 -0.84 120.40 111.13 1xtu s VAL 100 Ca 0.30 -0.25 0.02 0.00 -1.81 0.00 0.00 61.98 60.24 1xtu s VAL 100 Cb 0.05 -0.52 0.14 0.00 0.56 0.00 0.00 36.38 36.61 1xtu s VAL 100 CO 0.11 0.19 0.24 -0.63 -0.31 0.00 0.00 175.10 174.70 1xtu s ILE 101 N 0.21 1.40 -0.45 -0.62 1.01 -0.62 -1.13 121.20 121.01 1xtu s ILE 101 Ca -0.03 -2.58 -0.28 0.00 0.00 0.00 0.00 60.65 57.77 1xtu s ILE 101 Cb -0.07 -1.98 -0.02 0.00 0.01 0.00 0.00 42.46 40.40 1xtu s ILE 101 CO -0.00 -0.90 1.83 -0.83 0.00 0.00 0.00 174.94 175.03 1xtu s GLY 102 N 0.32 0.54 -0.00 6.18 0.00 0.16 -4.31 107.32 110.20 1xtu s GLY 102 Ca 0.18 -0.11 0.07 0.00 0.00 0.00 0.00 44.72 44.86 1xtu s GLY 102 CO -0.00 3.33 -0.22 0.00 0.00 0.00 0.00 173.10 176.21 1xtu s ALA 103 N 7.85 1.81 -0.06 3.20 0.00 -1.24 0.30 121.76 133.63 1xtu s ALA 103 Ca 0.75 -0.97 -0.03 0.00 0.00 0.00 0.00 51.96 51.71 1xtu s ALA 103 Cb -0.18 -0.44 0.04 0.00 0.00 0.00 0.00 23.12 22.54 1xtu s ALA 103 CO 0.28 0.44 0.10 -1.12 0.00 0.00 0.00 175.76 175.46 1xtu s SER 104 N -0.66 1.10 0.65 0.00 0.01 -0.45 -4.94 113.70 109.41 1xtu s SER 104 Ca 0.08 0.11 -0.13 0.00 1.31 0.00 0.00 55.95 57.32 1xtu s SER 104 Cb -0.08 -0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.13 1xtu s SER 104 CO -0.00 -0.26 1.06 0.00 0.41 0.00 0.00 173.24 174.46 1xtu s ARG 105 N 2.21 3.05 -0.31 12.44 1.70 -1.26 -2.50 118.95 134.29 1xtu s ARG 105 Ca 0.04 1.11 -0.21 0.00 -0.47 0.00 0.00 55.73 56.21 1xtu s ARG 105 Cb -0.12 -2.00 -0.01 0.00 -0.57 0.00 0.00 34.95 32.25 1xtu s ARG 105 CO -0.04 -1.02 0.65 0.08 -1.08 0.00 0.00 175.30 173.89 1xtu s VAL 106 N -2.72 4.92 -0.07 4.99 1.01 0.13 -4.93 120.40 123.74 1xtu s VAL 106 Ca 0.61 0.88 -0.30 0.00 0.00 0.00 0.00 61.98 63.17 1xtu s VAL 106 Cb -0.16 -4.02 -0.05 0.00 0.00 0.00 0.00 36.38 32.16 1xtu s VAL 106 CO 0.46 -0.17 1.51 -1.61 0.00 0.00 0.00 175.10 175.29 1xtu s GLU 107 N 2.66 4.21 0.02 2.72 0.41 -1.26 -4.57 118.70 122.89 1xtu s GLU 107 Ca 0.26 2.02 -0.01 0.00 -0.41 0.00 0.00 54.97 56.83 1xtu s GLU 107 Cb -0.15 -3.84 -0.02 0.00 -1.78 0.00 0.00 34.13 28.34 1xtu s GLU 107 CO 0.12 -0.76 0.00 0.14 -0.49 0.00 0.00 175.26 174.27 1xtu s VAL 108 N 3.55 0.11 -0.41 2.63 -7.23 -1.26 -5.13 120.40 112.66 1xtu s VAL 108 Ca 0.67 -0.91 -0.10 0.00 -1.81 0.00 0.00 61.98 59.83 1xtu s VAL 108 Cb -0.30 -0.34 0.07 0.00 0.56 0.00 0.00 36.38 36.36 1xtu s VAL 108 CO 0.25 -0.50 0.25 -0.62 -0.31 0.00 0.00 175.10 174.18 1xtu s ASP 109 N -1.51 5.68 0.47 4.85 -1.08 -1.26 -4.46 116.67 119.36 1xtu s ASP 109 Ca -0.15 -1.38 0.08 0.00 -0.52 0.00 0.00 52.55 50.58 1xtu s ASP 109 Cb -0.09 -2.00 0.03 0.00 -1.46 0.00 0.00 42.92 39.40 1xtu s ASP 109 CO -0.01 -0.51 0.59 -0.83 0.52 0.00 0.00 175.17 174.93 1xtu s GLY 110 N 2.02 1.95 0.02 2.66 0.00 -0.93 -5.00 107.32 108.04 1xtu s GLY 110 Ca 0.03 -1.82 -0.22 0.00 0.00 0.00 0.00 44.72 42.71 1xtu s GLY 110 CO 0.03 -1.61 1.33 0.50 0.00 0.00 0.00 173.10 173.35 1xtu h LYS 111 N 0.58 0.27 0.00 2.90 1.57 -1.99 -3.44 116.57 116.47 1xtu h LYS 111 Ca -0.37 -0.14 -0.39 0.00 -1.87 0.00 0.00 60.65 57.88 1xtu h LYS 111 Cb 1.28 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.59 1xtu h LYS 111 CO 0.47 0.67 -0.12 0.39 -0.57 0.00 0.00 179.45 180.30 1xtu n GLU 112 N -4.63 0.78 -2.43 3.15 1.02 -1.26 -4.89 120.64 112.39 1xtu n GLU 112 Ca -0.07 -2.41 -0.42 0.00 -0.02 0.00 0.00 57.16 54.23 1xtu n GLU 112 Cb 0.33 0.01 -0.03 0.00 -0.02 0.00 0.00 31.44 31.74 1xtu n GLU 112 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1xtu s VAL 113 N -1.82 4.21 0.73 2.62 1.01 -1.26 -4.38 120.40 121.51 1xtu s VAL 113 Ca 0.36 1.52 -0.16 0.00 0.00 0.00 0.00 61.98 63.70 1xtu s VAL 113 Cb -0.03 -3.98 0.03 0.00 0.00 0.00 0.00 36.38 32.40 1xtu s VAL 113 CO 0.23 -0.04 1.22 -2.65 0.00 0.00 0.00 175.10 173.86 1xtu n PRO 114 N 5.60 0.65 -0.00 2.72 -0.02 -1.26 -4.94 135.00 137.75 1xtu n PRO 114 Ca 0.12 0.29 0.01 0.00 -2.02 0.00 0.00 63.50 61.90 1xtu n PRO 114 Cb 0.46 -2.46 -0.02 0.00 -0.02 0.00 0.00 33.50 31.46 1xtu n PRO 114 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1xtu n LYS 115 N -2.48 2.41 -3.57 -0.52 5.02 -1.26 -4.94 118.16 112.82 1xtu n LYS 115 Ca 0.15 -0.02 -0.14 0.00 -2.02 0.00 0.00 58.31 56.28 1xtu n LYS 115 Cb 0.49 -0.90 -0.06 0.00 -0.02 0.00 0.00 35.03 34.54 1xtu n LYS 115 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1xtu s ASP 116 N -1.93 -0.54 0.38 4.39 -4.77 -1.26 -4.90 116.67 108.05 1xtu s ASP 116 Ca -0.00 0.72 0.08 0.00 -3.30 0.00 0.00 52.55 50.04 1xtu s ASP 116 Cb 0.02 0.62 -0.07 0.00 -1.09 0.00 0.00 42.92 42.39 1xtu s ASP 116 CO 0.12 -0.40 -0.03 -0.04 0.70 0.00 0.00 175.17 175.51 1xtu s MET 117 N -0.77 1.88 -0.23 2.11 -1.94 -1.26 -5.09 119.30 114.00 1xtu s MET 117 Ca -0.04 -2.02 -0.09 0.00 -1.71 0.00 0.00 55.69 51.82 1xtu s MET 117 Cb -0.01 -1.63 -0.05 0.00 2.01 0.00 0.00 34.83 35.15 1xtu s MET 117 CO 0.04 0.03 0.13 0.34 -0.01 0.00 0.00 175.02 175.54 1xtu s ASP 118 N -3.65 5.90 -0.04 3.03 -1.08 -1.26 -4.89 116.67 114.68 1xtu s ASP 118 Ca 0.34 0.07 0.04 0.00 -0.52 0.00 0.00 52.55 52.47 1xtu s ASP 118 Cb 0.07 -2.06 -0.03 0.00 -1.46 0.00 0.00 42.92 39.44 1xtu s ASP 118 CO 0.17 0.08 -0.13 -0.69 0.52 0.00 0.00 175.17 175.11 1xtu s VAL 119 N 0.99 3.14 0.06 1.11 1.01 -1.26 0.20 120.40 125.65 1xtu s VAL 119 Ca 0.06 -0.76 0.05 0.00 0.00 0.00 0.00 61.98 61.34 1xtu s VAL 119 Cb -0.13 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 1xtu s VAL 119 CO 0.04 0.55 -0.15 -0.47 0.00 0.00 0.00 175.10 175.06 1xtu s TYR 120 N -0.78 1.29 -0.42 5.22 5.04 -1.04 -4.92 117.35 121.73 1xtu s TYR 120 Ca 0.12 -0.42 -0.18 0.00 -2.44 0.00 0.00 57.07 54.16 1xtu s TYR 120 Cb -0.11 -0.74 0.02 0.00 0.35 0.00 0.00 41.96 41.49 1xtu s TYR 120 CO 0.02 0.07 0.48 0.42 -1.34 0.00 0.00 175.55 175.19 1xtu s ILE 121 N -1.10 5.03 -0.06 3.14 -1.09 -1.26 -1.34 121.20 124.52 1xtu s ILE 121 Ca 0.00 -0.24 0.13 0.00 -2.23 0.00 0.00 60.65 58.32 1xtu s ILE 121 Cb -0.09 -4.07 -0.18 0.00 -1.58 0.00 0.00 42.46 36.53 1xtu s ILE 121 CO 0.02 -0.46 0.83 0.10 -1.23 0.00 0.00 174.94 174.20 1xtu h TYR 122 N 8.76 0.00 -3.16 3.97 -0.00 -0.53 -3.47 116.97 122.53 1xtu h TYR 122 Ca -0.26 0.00 -0.19 0.00 0.00 0.00 0.00 58.73 58.27 1xtu h TYR 122 Cb 1.11 0.00 -0.28 0.00 0.00 0.00 0.00 36.73 37.56 1xtu h TYR 122 CO 0.64 0.83 -0.50 -0.47 -0.00 0.00 0.00 178.16 178.67 1xtu s TYR 123 N -2.74 -0.25 -0.03 0.10 5.04 -1.18 -4.99 117.35 113.30 1xtu s TYR 123 Ca -0.03 0.62 -0.01 0.00 -2.44 0.00 0.00 57.07 55.22 1xtu s TYR 123 Cb 0.08 0.04 0.03 0.00 0.35 0.00 0.00 41.96 42.47 1xtu s TYR 123 CO 0.82 -0.16 0.03 0.21 -1.34 0.00 0.00 175.55 175.11 1xtu s LYS 124 N 0.68 0.07 -0.29 4.97 2.20 -1.26 0.36 119.74 126.49 1xtu s LYS 124 Ca -0.05 0.22 0.02 0.00 -0.36 0.00 0.00 55.97 55.81 1xtu s LYS 124 Cb -0.06 -0.45 0.18 0.00 -1.51 0.00 0.00 37.83 35.99 1xtu s LYS 124 CO -0.04 -0.23 0.53 0.21 -0.36 0.00 0.00 175.35 175.46 1xtu s LYS 125 N 1.52 0.50 0.14 4.03 2.47 -0.28 -5.01 119.74 123.11 1xtu s LYS 125 Ca -0.03 0.57 0.08 0.00 -1.56 0.00 0.00 55.97 55.03 1xtu s LYS 125 Cb -0.13 0.11 -0.04 0.00 -1.46 0.00 0.00 37.83 36.32 1xtu s LYS 125 CO -0.03 -0.88 -0.19 0.96 0.16 0.00 0.00 175.35 175.37 1xtu s ILE 126 N 2.74 1.74 0.00 5.43 -4.36 -1.26 -0.46 121.20 125.03 1xtu s ILE 126 Ca 0.13 -1.77 0.00 0.00 -0.26 0.00 0.00 60.65 58.75 1xtu s ILE 126 Cb -0.13 -1.71 0.00 0.00 1.25 0.00 0.00 42.46 41.87 1xtu s ILE 126 CO -0.24 -0.24 0.00 -2.65 0.24 0.00 0.00 174.94 172.05 1xtu n PRO 127 N 0.58 -0.22 -2.77 0.37 -0.02 -1.26 -4.95 135.00 126.74 1xtu n PRO 127 Ca -0.16 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 60.90 1xtu n PRO 127 Cb 0.56 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 34.00 1xtu n PRO 127 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1xtu s ASP 128 N -1.33 6.42 -0.65 2.55 -1.08 -1.26 -4.98 116.67 116.34 1xtu s ASP 128 Ca 0.00 -0.09 -0.22 0.00 -0.52 0.00 0.00 52.55 51.72 1xtu s ASP 128 Cb 0.00 -2.47 0.07 0.00 -1.46 0.00 0.00 42.92 39.06 1xtu s ASP 128 CO 0.00 -1.23 0.95 -0.63 0.52 0.00 0.00 175.17 174.78 1xtu s ILE 129 N 4.11 4.35 -0.48 4.11 1.01 -1.26 -4.97 121.20 128.08 1xtu s ILE 129 Ca 0.36 -0.34 -0.28 0.00 0.00 0.00 0.00 60.65 60.39 1xtu s ILE 129 Cb -0.11 -4.66 -0.01 0.00 0.01 0.00 0.00 42.46 37.69 1xtu s ILE 129 CO 0.23 -1.41 1.76 -0.13 0.00 0.00 0.00 174.94 175.39 1xtu s ARG 130 N 3.99 3.05 0.43 2.79 0.52 -1.26 -4.89 118.95 123.58 1xtu s ARG 130 Ca 0.22 0.96 -0.23 0.00 -0.52 0.00 0.00 55.73 56.16 1xtu s ARG 130 Cb -0.17 -4.26 -0.12 0.00 0.52 0.00 0.00 34.95 30.93 1xtu s ARG 130 CO 0.11 -2.21 0.67 0.00 0.02 0.00 0.00 175.30 173.88 1xtu n ALA 131 N 11.16 -1.04 -0.28 2.13 0.00 -1.25 -0.83 120.51 130.40 1xtu n ALA 131 Ca 0.20 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1xtu n ALA 131 Cb 0.49 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 18.08 1xtu n ALA 131 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xtu n LYS 132 N 0.40 0.00 -0.02 0.00 5.02 -0.23 -4.59 118.16 118.74 1xtu n LYS 132 Ca 0.11 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.37 1xtu n LYS 132 Cb 0.40 -4.17 -0.01 0.00 -0.02 0.00 0.00 35.03 31.22 1xtu n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1xtu n VAL 133 N -2.00 0.20 -2.94 -0.18 0.31 -0.11 -4.43 118.33 109.18 1xtu n VAL 133 Ca 0.00 -0.07 -0.40 0.00 -0.01 0.00 0.00 64.34 63.87 1xtu n VAL 133 Cb 0.00 -0.92 -0.06 0.00 -0.91 0.00 0.00 33.84 31.95 1xtu n VAL 133 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1xtu s ASP 134 N -4.65 7.42 -0.47 4.52 1.01 -0.01 -4.61 116.67 119.88 1xtu s ASP 134 Ca -0.05 1.68 -0.17 0.00 0.71 0.00 0.00 52.55 54.73 1xtu s ASP 134 Cb 0.01 -2.51 0.06 0.00 1.01 0.00 0.00 42.92 41.49 1xtu s ASP 134 CO 0.07 0.18 0.45 0.20 0.21 0.00 0.00 175.17 176.28 1xtu s ASN 135 N -1.05 6.17 -0.06 0.27 0.01 0.15 0.00 114.94 120.43 1xtu s ASN 135 Ca 0.37 -1.11 -0.19 0.00 -0.71 0.00 0.00 52.86 51.22 1xtu s ASN 135 Cb -0.23 -2.21 -0.05 0.00 0.41 0.00 0.00 41.25 39.17 1xtu s ASN 135 CO 0.27 -0.68 0.54 -0.69 -1.51 0.00 0.00 177.10 175.03 1xtu s VAL 136 N 1.94 5.05 -0.22 1.60 1.01 -0.41 -2.04 120.40 127.33 1xtu s VAL 136 Ca 0.08 1.11 0.02 0.00 0.00 0.00 0.00 61.98 63.19 1xtu s VAL 136 Cb -0.22 -3.88 0.04 0.00 0.00 0.00 0.00 36.38 32.32 1xtu s VAL 136 CO 0.09 0.38 -0.15 -0.63 0.00 0.00 0.00 175.10 174.78 1xtu s ILE 137 N 0.18 2.18 -0.22 2.22 1.01 -0.02 0.48 121.20 127.03 1xtu s ILE 137 Ca 0.29 -1.22 -0.08 0.00 0.00 0.00 0.00 60.65 59.64 1xtu s ILE 137 Cb -0.17 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 1xtu s ILE 137 CO 0.14 0.29 0.09 -0.63 0.00 0.00 0.00 174.94 174.83 1xtu s ILE 138 N 1.22 4.82 -0.05 2.92 1.01 0.27 -0.72 121.20 130.68 1xtu s ILE 138 Ca -0.01 -0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.66 1xtu s ILE 138 Cb -0.16 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.06 1xtu s ILE 138 CO -0.09 0.39 -0.11 0.00 0.00 0.00 0.00 174.94 175.13 1xtu s ALA 139 N 0.89 2.82 -0.30 9.38 0.00 -1.19 -0.86 121.76 132.50 1xtu s ALA 139 Ca 0.05 -0.96 -0.07 0.00 0.00 0.00 0.00 51.96 50.98 1xtu s ALA 139 Cb -0.14 -1.07 0.16 0.00 0.00 0.00 0.00 23.12 22.07 1xtu s ALA 139 CO 0.03 0.57 0.68 0.34 0.00 0.00 0.00 175.76 177.38 1xtu s ASP 140 N -0.85 -1.16 0.28 0.00 2.15 -0.36 -4.22 116.67 112.50 1xtu s ASP 140 Ca 0.12 1.19 0.01 0.00 0.43 0.00 0.00 52.55 54.30 1xtu s ASP 140 Cb -0.11 2.16 0.64 0.00 -0.30 0.00 0.00 42.92 45.31 1xtu s ASP 140 CO 0.02 -0.22 1.69 -0.65 -0.17 0.00 0.00 175.17 175.84 1xtu h PRO 141 N 7.96 0.33 -5.71 4.34 0.11 -1.87 -3.34 132.00 133.83 1xtu h PRO 141 Ca -0.19 -0.02 -0.60 0.00 0.11 0.00 0.00 66.00 65.30 1xtu h PRO 141 Cb 1.13 -0.08 -0.31 0.00 0.11 0.00 0.00 31.00 31.86 1xtu h PRO 141 CO 0.15 0.22 -0.85 -1.64 -0.21 0.00 0.00 178.00 175.67 1xtu s MET 142 N -5.94 1.86 -0.29 1.05 -1.94 -1.26 -0.50 119.30 112.28 1xtu s MET 142 Ca -0.12 -0.71 0.01 0.00 -1.71 0.00 0.00 55.69 53.16 1xtu s MET 142 Cb 0.24 -1.67 0.08 0.00 2.01 0.00 0.00 34.83 35.49 1xtu s MET 142 CO 0.77 0.35 0.02 0.42 -0.01 0.00 0.00 175.02 176.56 1xtu s ILE 143 N -0.21 1.59 0.00 2.53 1.01 -0.89 -5.00 121.20 120.23 1xtu s ILE 143 Ca 0.01 -1.60 0.00 0.00 0.00 0.00 0.00 60.65 59.06 1xtu s ILE 143 Cb -0.10 -2.03 0.00 0.00 0.01 0.00 0.00 42.46 40.34 1xtu s ILE 143 CO 0.01 -0.40 0.00 0.00 0.00 0.00 0.00 174.94 174.56 1xtu n ALA 144 N 4.59 0.00 1.36 9.38 0.00 -1.26 -0.88 120.51 133.70 1xtu n ALA 144 Ca -0.05 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.43 1xtu n ALA 144 Cb 0.43 0.00 0.41 0.00 0.00 0.00 0.00 19.45 20.29 1xtu n ALA 144 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xtu n THR 145 N -1.84 0.00 -0.71 0.00 -2.24 -1.26 -3.31 114.28 104.92 1xtu n THR 145 Ca 0.00 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1xtu n THR 145 Cb 0.00 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 1xtu n THR 145 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xtu n ALA 146 N 0.41 0.00 -0.36 6.98 0.00 -1.26 -4.76 120.51 121.52 1xtu n ALA 146 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.62 1xtu n ALA 146 Cb 0.41 -0.85 0.16 0.00 0.00 0.00 0.00 19.45 19.18 1xtu n ALA 146 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1xtu h SER 147 N 0.00 1.06 0.25 0.00 0.02 -1.90 0.97 113.55 113.95 1xtu h SER 147 Ca 0.00 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1xtu h SER 147 Cb 0.18 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.49 1xtu h SER 147 CO 0.00 0.72 -0.12 0.74 -1.14 0.00 0.00 176.83 177.03 1xtu h THR 148 N 1.22 0.80 -0.63 -2.27 2.02 -1.91 -1.91 112.91 110.24 1xtu h THR 148 Ca 0.40 -0.61 0.07 0.00 0.77 0.00 0.00 66.41 67.04 1xtu h THR 148 Cb 0.04 1.14 -0.06 0.00 -1.74 0.00 0.00 68.15 67.53 1xtu h THR 148 CO -0.13 0.13 0.31 0.24 0.37 0.00 0.00 175.52 176.44 1xtu h MET 149 N -0.66 0.54 -0.91 6.66 2.07 -1.89 -1.87 114.93 118.88 1xtu h MET 149 Ca -0.03 -0.03 0.02 0.00 -2.07 0.00 0.00 59.70 57.58 1xtu h MET 149 Cb 0.46 -0.12 -0.05 0.00 -1.87 0.00 0.00 31.60 30.02 1xtu h MET 149 CO 0.06 0.36 0.60 -0.07 1.07 0.00 0.00 176.91 178.92 1xtu h LEU 150 N 0.56 1.02 -0.79 1.22 3.38 -0.78 0.13 115.31 120.05 1xtu h LEU 150 Ca 0.29 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.22 1xtu h LEU 150 Cb 0.26 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1xtu h LEU 150 CO -0.22 0.73 0.39 0.50 0.09 0.00 0.00 178.44 179.92 1xtu h LYS 151 N 1.20 1.13 0.17 1.13 1.63 -0.55 0.49 116.57 121.77 1xtu h LYS 151 Ca 0.34 -0.16 -0.01 0.00 -0.85 0.00 0.00 60.65 59.97 1xtu h LYS 151 Cb -0.10 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.33 1xtu h LYS 151 CO -0.09 0.87 -0.08 0.28 -3.45 0.00 0.00 179.45 176.98 1xtu h VAL 152 N 1.11 0.95 -0.70 2.00 2.07 -0.90 -2.97 116.25 117.80 1xtu h VAL 152 Ca 0.27 -0.71 0.11 0.00 0.82 0.00 0.00 66.70 67.19 1xtu h VAL 152 Cb 0.11 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.20 1xtu h VAL 152 CO -0.04 0.16 0.47 -0.07 0.02 0.00 0.00 177.57 178.11 1xtu h LEU 153 N -0.59 0.48 -1.02 2.57 3.38 -0.51 -1.41 115.31 118.21 1xtu h LEU 153 Ca -0.02 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1xtu h LEU 153 Cb 0.44 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 1xtu h LEU 153 CO 0.04 0.28 0.72 -0.08 0.09 0.00 0.00 178.44 179.49 1xtu h GLU 154 N 0.53 0.00 0.00 1.13 4.81 0.15 -0.57 114.58 120.63 1xtu h GLU 154 Ca 0.33 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 1xtu h GLU 154 Cb 0.57 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.95 1xtu h GLU 154 CO -0.11 0.00 0.00 -0.85 -0.73 0.00 0.00 179.01 177.32 1xtu n GLU 155 N -2.81 -0.30 0.10 1.92 0.28 -0.56 -4.58 120.64 114.69 1xtu n GLU 155 Ca 0.02 -0.21 -0.17 0.00 -0.16 0.00 0.00 57.16 56.64 1xtu n GLU 155 Cb 0.78 -0.68 -0.14 0.00 1.43 0.00 0.00 31.44 32.82 1xtu n GLU 155 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1xtu h VAL 156 N 0.69 1.42 -0.56 3.84 2.07 -0.77 -3.22 116.25 119.72 1xtu h VAL 156 Ca 0.00 -2.99 -0.00 0.00 0.82 0.00 0.00 66.70 64.53 1xtu h VAL 156 Cb 0.34 2.92 -0.03 0.00 -1.52 0.00 0.00 31.29 33.00 1xtu h VAL 156 CO 0.00 0.87 0.34 0.58 0.02 0.00 0.00 177.57 179.38 1xtu h VAL 157 N 0.08 1.16 -0.73 2.57 2.07 -1.66 -2.36 116.25 117.38 1xtu h VAL 157 Ca -0.16 -0.34 0.16 0.00 0.82 0.00 0.00 66.70 67.18 1xtu h VAL 157 Cb 2.00 0.37 -0.12 0.00 -1.52 0.00 0.00 31.29 32.02 1xtu h VAL 157 CO 0.20 0.16 0.11 0.11 0.02 0.00 0.00 177.57 178.18 1xtu h LYS 158 N 0.76 0.19 0.00 1.57 1.57 -1.80 0.24 116.57 119.11 1xtu h LYS 158 Ca 0.20 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1xtu h LYS 158 Cb -0.04 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1xtu h LYS 158 CO -0.04 0.13 0.00 0.00 -0.57 0.00 0.00 179.45 178.97 1xtu n ALA 159 N -2.75 1.39 -3.57 3.86 0.00 -0.89 -4.91 120.51 113.63 1xtu n ALA 159 Ca 0.14 -0.03 -0.21 0.00 0.00 0.00 0.00 53.44 53.34 1xtu n ALA 159 Cb 0.47 -1.13 0.01 0.00 0.00 0.00 0.00 19.45 18.80 1xtu n ALA 159 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xtu n ASN 160 N -1.49 -5.77 -4.73 0.00 5.15 0.85 -3.81 115.26 105.46 1xtu n ASN 160 Ca 0.02 -0.75 -0.29 0.00 -0.60 0.00 0.00 54.58 52.96 1xtu n ASN 160 Cb 0.09 -3.17 0.15 0.00 -0.53 0.00 0.00 39.78 36.33 1xtu n ASN 160 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1xtu s PRO 161 N -4.84 0.83 0.11 1.20 0.02 -1.26 -1.06 135.00 130.00 1xtu s PRO 161 Ca 0.16 0.35 -0.18 0.00 0.02 0.00 0.00 61.00 61.35 1xtu s PRO 161 Cb -0.06 -1.80 -0.05 0.00 0.02 0.00 0.00 34.50 32.61 1xtu s PRO 161 CO 0.85 -2.42 1.64 -0.22 -0.33 0.00 0.00 177.00 176.52 1xtu h LYS 162 N -1.66 0.45 -3.99 5.54 3.64 -0.64 -3.37 116.57 116.55 1xtu h LYS 162 Ca -0.52 -0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 58.66 1xtu h LYS 162 Cb 1.33 -0.07 -0.14 0.00 -0.41 0.00 0.00 32.23 32.95 1xtu h LYS 162 CO 0.60 0.48 -0.43 1.03 -2.27 0.00 0.00 179.45 178.87 1xtu s ARG 163 N -5.49 0.97 -0.14 1.90 0.52 -1.14 -4.94 118.95 110.62 1xtu s ARG 163 Ca -0.13 -1.16 -0.03 0.00 -0.52 0.00 0.00 55.73 53.89 1xtu s ARG 163 Cb 0.09 0.33 0.05 0.00 0.52 0.00 0.00 34.95 35.93 1xtu s ARG 163 CO 0.73 -0.32 0.05 0.42 0.02 0.00 0.00 175.30 176.20 1xtu s ILE 164 N -3.94 0.25 -0.06 1.52 1.01 -1.26 -1.29 121.20 117.42 1xtu s ILE 164 Ca 0.14 -0.18 -0.03 0.00 0.00 0.00 0.00 60.65 60.58 1xtu s ILE 164 Cb 0.05 -0.69 -0.04 0.00 0.01 0.00 0.00 42.46 41.79 1xtu s ILE 164 CO -0.04 -0.08 0.08 -0.31 0.00 0.00 0.00 174.94 174.60 1xtu s TYR 165 N 2.00 3.36 -0.06 3.97 1.51 0.18 -1.43 117.35 126.88 1xtu s TYR 165 Ca 0.02 0.31 0.05 0.00 -1.01 0.00 0.00 57.07 56.44 1xtu s TYR 165 Cb -0.15 -1.82 -0.01 0.00 -0.11 0.00 0.00 41.96 39.87 1xtu s TYR 165 CO -0.07 0.59 -0.22 0.42 -1.11 0.00 0.00 175.55 175.15 1xtu s ILE 166 N -1.07 2.30 -0.08 2.71 1.01 0.31 -0.56 121.20 125.82 1xtu s ILE 166 Ca 0.18 -0.99 0.02 0.00 0.00 0.00 0.00 60.65 59.87 1xtu s ILE 166 Cb -0.12 -1.85 0.01 0.00 0.01 0.00 0.00 42.46 40.52 1xtu s ILE 166 CO 0.08 0.57 -0.12 -0.69 0.00 0.00 0.00 174.94 174.78 1xtu s VAL 167 N -0.28 1.18 0.16 2.92 1.01 -0.03 0.13 120.40 125.49 1xtu s VAL 167 Ca 0.00 -0.48 -0.09 0.00 0.00 0.00 0.00 61.98 61.41 1xtu s VAL 167 Cb -0.13 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 1xtu s VAL 167 CO 0.03 0.37 0.28 -0.94 0.00 0.00 0.00 175.10 174.84 1xtu s SER 168 N 0.84 0.04 -0.15 3.32 1.04 -0.73 -1.22 113.70 116.85 1xtu s SER 168 Ca -0.11 -0.87 -0.18 0.00 0.48 0.00 0.00 55.95 55.27 1xtu s SER 168 Cb -0.15 0.43 -0.24 0.00 0.10 0.00 0.00 66.02 66.16 1xtu s SER 168 CO 0.02 -0.89 0.42 0.40 0.98 0.00 0.00 173.24 174.17 1xtu h ILE 169 N 2.55 1.00 -3.71 -1.02 1.08 -0.96 -3.19 117.51 113.27 1xtu h ILE 169 Ca -0.32 -2.30 -0.31 0.00 -0.39 0.00 0.00 64.86 61.54 1xtu h ILE 169 Cb 1.23 2.57 -0.30 0.00 -3.07 0.00 0.00 36.82 37.24 1xtu h ILE 169 CO 0.48 0.58 -0.74 -0.63 -0.69 0.00 0.00 178.15 177.15 1xtu s ILE 170 N -2.42 0.22 0.01 -0.67 1.01 -0.94 -1.98 121.20 116.44 1xtu s ILE 170 Ca -0.23 -0.05 0.04 0.00 0.00 0.00 0.00 60.65 60.40 1xtu s ILE 170 Cb 0.05 -0.23 -0.01 0.00 0.01 0.00 0.00 42.46 42.27 1xtu s ILE 170 CO 0.69 0.10 -0.11 -0.44 0.00 0.00 0.00 174.94 175.18 1xtu s SER 171 N 0.32 1.32 0.44 3.58 0.01 -0.71 -2.10 113.70 116.57 1xtu s SER 171 Ca -0.03 -0.31 -0.21 0.00 1.31 0.00 0.00 55.95 56.71 1xtu s SER 171 Cb -0.06 -0.11 -0.11 0.00 0.21 0.00 0.00 66.02 65.96 1xtu s SER 171 CO -0.01 0.06 0.96 -0.94 0.41 0.00 0.00 173.24 173.72 1xtu s SER 172 N -0.68 6.89 0.34 2.44 1.04 -0.06 -1.27 113.70 122.39 1xtu s SER 172 Ca 0.02 1.70 0.08 0.00 0.48 0.00 0.00 55.95 58.22 1xtu s SER 172 Cb -0.06 -2.54 0.77 0.00 0.10 0.00 0.00 66.02 64.30 1xtu s SER 172 CO 0.00 -0.40 1.85 -0.08 0.98 0.00 0.00 173.24 175.60 1xtu h GLU 173 N 1.83 0.72 0.05 4.02 4.81 -1.29 -0.64 114.58 124.07 1xtu h GLU 173 Ca -0.49 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.70 1xtu h GLU 173 Cb 1.18 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1xtu h GLU 173 CO 0.61 0.48 -0.03 -0.92 -0.73 0.00 0.00 179.01 178.42 1xtu h TYR 174 N 0.74 -0.07 0.09 0.92 3.20 -1.84 -2.10 116.97 117.91 1xtu h TYR 174 Ca 0.47 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.33 1xtu h TYR 174 Cb 0.71 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.00 1xtu h TYR 174 CO -0.00 0.07 -0.05 0.78 -1.64 0.00 0.00 178.16 177.32 1xtu h GLY 175 N -0.18 -0.13 0.29 1.82 0.00 -1.26 0.47 103.07 104.08 1xtu h GLY 175 Ca -0.01 0.05 0.12 0.00 0.00 0.00 0.00 47.33 47.49 1xtu h GLY 175 CO 0.01 -0.05 0.31 -2.08 0.00 0.00 0.00 176.54 174.74 1xtu h VAL 176 N -0.12 0.74 -0.33 4.60 2.07 -1.15 0.51 116.25 122.57 1xtu h VAL 176 Ca -0.01 -0.17 -0.14 0.00 0.82 0.00 0.00 66.70 67.20 1xtu h VAL 176 Cb 0.10 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1xtu h VAL 176 CO 0.02 0.09 -0.36 -1.13 0.02 0.00 0.00 177.57 176.21 1xtu h ASN 177 N 0.50 0.79 -0.32 0.57 -1.24 -1.08 -2.04 115.58 112.76 1xtu h ASN 177 Ca 0.38 -0.34 -0.10 0.00 0.71 0.00 0.00 56.30 56.95 1xtu h ASN 177 Cb 0.51 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.32 1xtu h ASN 177 CO -0.34 1.07 -0.13 0.50 -1.29 0.00 0.00 177.43 177.24 1xtu h LYS 178 N 0.62 0.76 0.26 6.67 3.64 0.51 -2.71 116.57 126.32 1xtu h LYS 178 Ca 0.06 -0.26 -0.01 0.00 -1.27 0.00 0.00 60.65 59.17 1xtu h LYS 178 Cb 0.90 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1xtu h LYS 178 CO 0.08 0.86 -0.13 0.82 -2.27 0.00 0.00 179.45 178.81 1xtu h ILE 179 N 0.68 0.20 0.00 2.00 2.04 -0.88 -3.23 117.51 118.33 1xtu h ILE 179 Ca 0.11 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1xtu h ILE 179 Cb 0.61 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 1xtu h ILE 179 CO 0.04 0.06 0.00 -0.07 0.00 0.00 0.00 178.15 178.18 1xtu h LEU 180 N -1.06 0.00 0.00 1.44 3.38 -1.47 0.18 115.31 117.79 1xtu h LEU 180 Ca -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1xtu h LEU 180 Cb 0.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1xtu h LEU 180 CO 0.06 0.00 -0.88 0.77 0.09 0.00 0.00 178.44 178.48 1xtu h SER 181 N 0.00 0.00 0.24 -0.43 4.64 -1.59 -2.47 113.55 113.94 1xtu h SER 181 Ca 0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 1xtu h SER 181 Cb 0.08 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.12 1xtu h SER 181 CO 0.00 0.03 -2.01 1.17 -0.87 0.00 0.00 176.83 175.16 1xtu n LYS 182 N -2.75 0.68 -3.28 4.77 3.00 -0.30 -4.62 118.16 115.66 1xtu n LYS 182 Ca 0.00 0.22 -0.25 0.00 -0.00 0.00 0.00 58.31 58.28 1xtu n LYS 182 Cb 0.56 -1.69 -0.08 0.00 0.00 0.00 0.00 35.03 33.83 1xtu n LYS 182 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1xtu n TYR 183 N -3.15 0.19 0.31 5.64 4.02 0.49 -4.97 117.16 119.69 1xtu n TYR 183 Ca -0.28 -3.62 0.15 0.00 -0.01 0.00 0.00 57.90 54.14 1xtu n TYR 183 Cb 1.06 -0.28 0.78 0.00 -0.02 0.00 0.00 39.34 40.88 1xtu n TYR 183 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1xtu h PRO 184 N 4.34 0.00 0.00 -0.72 0.11 -1.66 -1.34 132.00 132.73 1xtu h PRO 184 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1xtu h PRO 184 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1xtu h PRO 184 CO 0.50 0.00 -0.19 1.97 -0.21 0.00 0.00 178.00 180.08 1xtu n PHE 185 N -2.95 0.00 -2.27 0.65 1.16 -1.26 -3.17 117.46 109.62 1xtu n PHE 185 Ca -0.01 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.17 1xtu n PHE 185 Cb 0.43 -0.41 -0.03 0.00 -1.61 0.00 0.00 39.48 37.86 1xtu n PHE 185 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1xtu s ILE 186 N -3.00 3.05 -0.54 1.97 1.01 -0.51 -4.58 121.20 118.60 1xtu s ILE 186 Ca 0.13 1.02 -0.18 0.00 0.00 0.00 0.00 60.65 61.62 1xtu s ILE 186 Cb 0.18 -3.64 0.09 0.00 0.01 0.00 0.00 42.46 39.11 1xtu s ILE 186 CO 0.59 0.22 0.58 -0.31 0.00 0.00 0.00 174.94 176.03 1xtu s TYR 187 N -1.20 3.11 -0.34 3.97 2.02 -0.52 -1.20 117.35 123.19 1xtu s TYR 187 Ca 0.49 -0.90 -0.15 0.00 -0.37 0.00 0.00 57.07 56.14 1xtu s TYR 187 Cb -0.36 -3.68 -0.01 0.00 -0.40 0.00 0.00 41.96 37.51 1xtu s TYR 187 CO 0.46 -1.07 0.36 -1.17 -1.57 0.00 0.00 175.55 172.56 1xtu s LEU 188 N 2.27 4.42 -0.13 -1.29 2.96 0.55 -0.53 118.68 126.93 1xtu s LEU 188 Ca 0.09 -0.20 -0.05 0.00 -0.22 0.00 0.00 54.13 53.76 1xtu s LEU 188 Cb -0.24 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.07 1xtu s LEU 188 CO 0.07 -0.33 0.03 -0.36 -1.32 0.00 0.00 176.35 174.45 1xtu s PHE 189 N 2.02 3.23 -0.02 5.38 0.40 0.12 0.63 117.98 129.75 1xtu s PHE 189 Ca 0.12 0.14 -0.23 0.00 -0.60 0.00 0.00 56.93 56.36 1xtu s PHE 189 Cb -0.16 -1.92 0.05 0.00 0.51 0.00 0.00 43.02 41.49 1xtu s PHE 189 CO 0.12 0.35 0.50 -0.08 0.70 0.00 0.00 175.22 176.80 1xtu s THR 190 N -0.36 0.03 0.06 0.64 -1.32 0.27 -1.77 115.64 113.18 1xtu s THR 190 Ca 0.08 -0.24 0.06 0.00 -1.21 0.00 0.00 61.69 60.38 1xtu s THR 190 Cb -0.12 -0.85 -0.23 0.00 -1.51 0.00 0.00 72.50 69.79 1xtu s THR 190 CO 0.02 -0.13 1.07 0.58 -2.21 0.00 0.00 174.62 173.94 1xtu h VAL 191 N 3.30 1.42 -2.40 5.08 2.07 -1.39 0.23 116.25 124.56 1xtu h VAL 191 Ca -0.29 -3.15 -0.08 0.00 0.82 0.00 0.00 66.70 64.00 1xtu h VAL 191 Cb 1.17 2.74 -0.19 0.00 -1.52 0.00 0.00 31.29 33.48 1xtu h VAL 191 CO 0.40 0.83 0.01 0.00 0.02 0.00 0.00 177.57 178.83 1xtu s ALA 192 N -2.67 -1.38 -0.29 1.67 0.00 -0.84 -4.37 121.76 113.89 1xtu s ALA 192 Ca -0.02 0.94 -0.01 0.00 0.00 0.00 0.00 51.96 52.87 1xtu s ALA 192 Cb 0.09 0.01 0.05 0.00 0.00 0.00 0.00 23.12 23.27 1xtu s ALA 192 CO 0.83 -0.33 -0.02 0.42 0.00 0.00 0.00 175.76 176.66 1xtu s ILE 193 N -1.21 2.84 0.29 0.00 1.01 -1.26 -1.74 121.20 121.14 1xtu s ILE 193 Ca -0.12 -1.39 -0.14 0.00 0.00 0.00 0.00 60.65 59.00 1xtu s ILE 193 Cb -0.02 -2.62 -0.08 0.00 0.01 0.00 0.00 42.46 39.74 1xtu s ILE 193 CO 0.08 -0.06 0.69 -1.81 0.00 0.00 0.00 174.94 173.83 1xtu s ASP 194 N 1.24 6.77 0.08 3.58 1.01 -0.40 -4.81 116.67 124.13 1xtu s ASP 194 Ca -0.05 1.21 -0.26 0.00 0.71 0.00 0.00 52.55 54.15 1xtu s ASP 194 Cb -0.19 -2.34 -0.16 0.00 1.01 0.00 0.00 42.92 41.23 1xtu s ASP 194 CO -0.02 -0.15 1.67 1.55 0.21 0.00 0.00 175.17 178.44 1xtu h PRO 195 N 2.47 -0.30 -4.92 8.23 0.13 -1.89 -0.59 132.00 135.13 1xtu h PRO 195 Ca -0.48 0.02 -0.37 0.00 -0.87 0.00 0.00 66.00 64.30 1xtu h PRO 195 Cb 1.18 0.07 -0.14 0.00 0.13 0.00 0.00 31.00 32.23 1xtu h PRO 195 CO 0.66 -0.18 -0.61 -1.83 -0.23 0.00 0.00 178.00 175.82 1xtu s GLU 196 N -6.03 1.47 0.20 0.86 -1.05 -1.21 -4.35 118.70 108.58 1xtu s GLU 196 Ca -0.15 -1.80 0.11 0.00 -0.15 0.00 0.00 54.97 52.98 1xtu s GLU 196 Cb 0.05 -0.31 -0.04 0.00 -0.44 0.00 0.00 34.13 33.38 1xtu s GLU 196 CO 0.64 -0.30 -0.22 -0.51 0.95 0.00 0.00 175.26 175.82 1xtu s LEU 197 N -3.34 2.52 0.00 1.83 1.43 -1.26 -0.00 118.68 119.85 1xtu s LEU 197 Ca 0.37 -0.85 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1xtu s LEU 197 Cb 0.08 -1.22 0.04 0.00 0.03 0.00 0.00 46.19 45.12 1xtu s LEU 197 CO 0.14 0.11 0.35 -0.46 0.23 0.00 0.00 176.35 176.72 1xtu n ASN 198 N 0.14 0.82 0.30 2.29 0.23 -0.43 -4.88 115.26 113.73 1xtu n ASN 198 Ca -0.11 -1.61 0.18 0.00 -0.53 0.00 0.00 54.58 52.51 1xtu n ASN 198 Cb 0.56 -0.19 0.90 0.00 -2.08 0.00 0.00 39.78 38.97 1xtu n ASN 198 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 1xtu h ASN 199 N -0.01 0.00 0.40 0.53 2.35 -1.86 -1.43 115.58 115.55 1xtu h ASN 199 Ca -0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.63 1xtu h ASN 199 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1xtu h ASN 199 CO 0.16 0.04 -0.47 0.29 -1.65 0.00 0.00 177.43 175.80 1xtu n LYS 200 N -3.31 0.22 -0.72 0.81 5.02 -1.26 -2.20 118.16 116.73 1xtu n LYS 200 Ca -0.02 -0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 1xtu n LYS 200 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 1xtu n LYS 200 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xtu n GLY 201 N 1.46 1.34 3.71 0.72 0.00 -0.54 -4.52 105.19 107.36 1xtu n GLY 201 Ca 0.07 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 1xtu n GLY 201 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xtu s TYR 202 N -2.08 3.14 0.09 1.61 1.51 -1.26 -4.78 117.35 115.58 1xtu s TYR 202 Ca 0.00 0.13 -0.30 0.00 -1.01 0.00 0.00 57.07 55.88 1xtu s TYR 202 Cb 0.00 -1.70 -0.06 0.00 -0.11 0.00 0.00 41.96 40.09 1xtu s TYR 202 CO 0.00 0.48 1.19 0.42 -1.11 0.00 0.00 175.55 176.54 1xtu s ILE 203 N -1.08 3.94 -0.13 2.71 1.01 -1.26 -1.31 121.20 125.08 1xtu s ILE 203 Ca 0.19 1.45 0.01 0.00 0.00 0.00 0.00 60.65 62.31 1xtu s ILE 203 Cb -0.12 -3.93 -0.00 0.00 0.01 0.00 0.00 42.46 38.42 1xtu s ILE 203 CO 0.10 0.14 -0.18 -0.76 0.00 0.00 0.00 174.94 174.24 1xtu s LEU 204 N 0.74 2.40 0.21 2.97 1.43 1.00 -2.45 118.68 124.97 1xtu s LEU 204 Ca 0.57 -0.47 -0.08 0.00 -1.03 0.00 0.00 54.13 53.12 1xtu s LEU 204 Cb -0.30 -1.52 0.14 0.00 0.03 0.00 0.00 46.19 44.54 1xtu s LEU 204 CO 0.31 0.13 1.72 -0.65 0.23 0.00 0.00 176.35 178.08 1xtu h PRO 205 N 6.99 1.11 0.00 1.29 0.11 -1.95 -3.21 132.00 136.34 1xtu h PRO 205 Ca -0.27 -0.27 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1xtu h PRO 205 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1xtu h PRO 205 CO 0.54 0.99 0.00 0.41 -0.21 0.00 0.00 178.00 179.73 1xtu n GLY 206 N -0.66 1.17 0.61 -0.55 0.00 -1.02 -4.57 105.19 100.17 1xtu n GLY 206 Ca 0.05 -0.60 -0.00 0.00 0.00 0.00 0.00 46.02 45.46 1xtu n GLY 206 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1xtu n LEU 207 N 0.00 -0.04 0.00 0.99 -0.00 -1.26 -4.74 117.00 111.95 1xtu n LEU 207 Ca 0.00 -1.16 0.00 0.00 -0.00 0.00 0.00 56.01 54.85 1xtu n LEU 207 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1xtu n LEU 207 CO 0.00 0.78 0.00 0.61 -0.00 0.00 0.00 177.39 178.78 1xtu n GLY 208 N 0.03 -1.71 3.60 1.47 0.00 -1.26 -4.78 105.19 102.53 1xtu n GLY 208 Ca -0.02 -1.63 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 1xtu n GLY 208 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xtu s ASP 209 N -4.00 6.58 0.21 1.61 2.15 -1.26 -4.92 116.67 117.05 1xtu s ASP 209 Ca 0.00 0.47 -0.10 0.00 0.43 0.00 0.00 52.55 53.35 1xtu s ASP 209 Cb 0.00 -2.39 0.31 0.00 -0.30 0.00 0.00 42.92 40.54 1xtu s ASP 209 CO 0.00 -0.65 1.67 0.00 -0.17 0.00 0.00 175.17 176.02 1xtu h ALA 210 N 8.31 0.65 -0.45 3.66 0.00 -1.98 0.20 119.26 129.65 1xtu h ALA 210 Ca -0.25 0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1xtu h ALA 210 Cb 1.10 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 1xtu h ALA 210 CO 0.88 -0.38 0.20 0.78 0.00 0.00 0.00 179.25 180.74 1xtu h GLY 211 N 0.15 0.61 0.98 0.00 0.00 -1.94 -0.75 103.07 102.12 1xtu h GLY 211 Ca 0.33 -0.13 -0.10 0.00 0.00 0.00 0.00 47.33 47.43 1xtu h GLY 211 CO -0.50 0.07 -0.17 -1.80 0.00 0.00 0.00 176.54 174.13 1xtu h ASP 212 N 0.40 0.77 0.35 0.19 1.82 -1.68 0.13 116.42 118.40 1xtu h ASP 212 Ca 0.20 -0.41 -0.01 0.00 -0.39 0.00 0.00 57.03 56.43 1xtu h ASP 212 Cb 0.15 -0.21 -0.00 0.00 0.68 0.00 0.00 39.33 39.95 1xtu h ASP 212 CO -0.17 1.00 -0.06 0.03 -1.61 0.00 0.00 179.24 178.43 1xtu h ARG 213 N 0.53 0.00 0.01 0.28 2.47 -0.28 0.34 114.38 117.73 1xtu h ARG 213 Ca 0.08 0.00 -0.38 0.00 -1.26 0.00 0.00 59.98 58.42 1xtu h ARG 213 Cb 0.71 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.97 1xtu h ARG 213 CO 0.05 0.06 -2.37 0.00 0.56 0.00 0.00 179.97 178.27 1xtu n ALA 214 N -2.20 1.43 -0.04 0.04 0.00 -0.32 -3.77 120.51 115.64 1xtu n ALA 214 Ca -0.02 -1.14 0.00 0.00 0.00 0.00 0.00 53.44 52.28 1xtu n ALA 214 Cb 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.43 1xtu n ALA 214 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1xtu n PHE 215 N -3.07 0.00 1.90 0.00 3.01 0.44 -4.68 117.46 115.07 1xtu n PHE 215 Ca -0.38 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.23 1xtu n PHE 215 Cb 1.06 0.00 0.90 0.00 -0.01 0.00 0.00 39.48 41.44 1xtu n PHE 215 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18