#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r1n s ILE 2 N 0.00 4.13 -0.25 0.53 -4.36 -1.13 -4.92 121.20 115.20 1r1n s ILE 2 Ca 0.00 -1.17 -0.05 0.00 -0.26 0.00 0.00 60.65 59.17 1r1n s ILE 2 Cb 0.00 -3.07 0.00 0.00 1.25 0.00 0.00 42.46 40.64 1r1n s ILE 2 CO 0.00 -0.06 -0.00 -0.89 0.24 0.00 0.00 174.94 174.23 1r1n s THR 3 N -1.65 3.53 -0.15 8.37 2.01 -1.26 -2.43 115.64 124.06 1r1n s THR 3 Ca 0.29 -0.60 -0.05 0.00 0.31 0.00 0.00 61.69 61.64 1r1n s THR 3 Cb -0.10 -2.70 -0.03 0.00 0.01 0.00 0.00 72.50 69.68 1r1n s THR 3 CO 0.21 0.29 0.01 -0.69 -0.69 0.00 0.00 174.62 173.74 1r1n s VAL 4 N 1.47 4.31 -1.12 3.82 1.01 -0.82 -1.55 120.40 127.52 1r1n s VAL 4 Ca 0.04 -0.22 -0.17 0.00 0.00 0.00 0.00 61.98 61.64 1r1n s VAL 4 Cb -0.15 -2.89 0.13 0.00 0.00 0.00 0.00 36.38 33.47 1r1n s VAL 4 CO -0.01 0.51 1.39 -0.31 0.00 0.00 0.00 175.10 176.67 1r1n s TYR 5 N 0.08 3.20 0.06 5.22 1.51 -0.22 -1.84 117.35 125.35 1r1n s TYR 5 Ca 0.02 -1.73 -0.31 0.00 -1.01 0.00 0.00 57.07 54.05 1r1n s TYR 5 Cb -0.13 -4.40 -0.06 0.00 -0.11 0.00 0.00 41.96 37.26 1r1n s TYR 5 CO 0.02 -1.53 1.26 1.21 -1.11 0.00 0.00 175.55 175.40 1r1n s ASN 6 N 3.46 7.00 -0.02 2.29 2.47 0.66 -2.58 114.94 128.22 1r1n s ASN 6 Ca 0.42 2.08 0.04 0.00 0.42 0.00 0.00 52.86 55.81 1r1n s ASN 6 Cb -0.02 -2.58 -0.06 0.00 -1.45 0.00 0.00 41.25 37.15 1r1n s ASN 6 CO -0.03 -0.55 0.05 0.61 -3.72 0.00 0.00 177.10 173.47 1r1n n GLY 7 N 3.34 -0.19 0.00 1.21 0.00 0.16 -2.70 105.19 107.02 1r1n n GLY 7 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1r1n n GLY 7 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1r1n n GLN 8 N -1.87 -0.90 -1.88 1.61 6.02 -1.24 -4.39 117.38 114.73 1r1n n GLN 8 Ca -0.03 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.55 1r1n n GLN 8 Cb 0.34 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.60 1r1n n GLN 8 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1r1n s HIS 9 N -0.89 2.67 0.46 1.08 5.04 -1.26 -4.91 115.29 117.48 1r1n s HIS 9 Ca 0.00 1.24 0.31 0.00 -1.54 0.00 0.00 55.06 55.07 1r1n s HIS 9 Cb 0.00 -3.92 1.67 0.00 0.04 0.00 0.00 32.58 30.37 1r1n s HIS 9 CO 0.00 -2.71 2.15 0.87 -2.34 0.00 0.00 174.74 172.70 1r1n h LYS 10 N 2.97 0.00 0.08 2.88 1.57 -1.99 -1.49 116.57 120.58 1r1n h LYS 10 Ca -0.50 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1r1n h LYS 10 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1r1n h LYS 10 CO 0.64 0.07 -0.04 0.93 -0.57 0.00 0.00 179.45 180.48 1r1n h GLU 11 N 0.00 -0.10 -0.98 3.15 5.08 -1.99 -3.16 114.58 116.59 1r1n h GLU 11 Ca -0.00 0.01 0.28 0.00 -1.00 0.00 0.00 59.36 58.65 1r1n h GLU 11 Cb 0.23 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 1r1n h GLU 11 CO 0.01 -0.06 0.92 0.00 -1.00 0.00 0.00 179.01 178.88 1r1n h ALA 12 N -1.52 2.84 -1.87 3.43 0.00 -1.89 0.26 119.26 120.50 1r1n h ALA 12 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1r1n h ALA 12 Cb 0.08 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1r1n h ALA 12 CO 0.02 -1.43 0.00 0.00 0.00 0.00 0.00 179.25 177.84 1r1n n ALA 13 N -2.46 -0.12 0.19 0.00 0.00 -0.57 -2.56 120.51 115.00 1r1n n ALA 13 Ca 0.21 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.82 1r1n n ALA 13 Cb 1.24 0.00 0.80 0.00 0.00 0.00 0.00 19.45 21.49 1r1n n ALA 13 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1r1n h GLN 14 N 0.00 0.00 0.53 0.00 5.75 -1.38 -0.93 115.11 119.08 1r1n h GLN 14 Ca 0.00 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 1r1n h GLN 14 Cb 0.00 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.55 1r1n h GLN 14 CO 0.00 0.00 -0.32 0.00 -2.65 0.00 0.00 178.83 175.86 1r1n h ALA 15 N 1.79 -1.15 0.00 3.38 0.00 -0.56 0.11 119.26 122.82 1r1n h ALA 15 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1r1n h ALA 15 Cb 0.49 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1r1n h ALA 15 CO -0.00 -1.12 0.00 0.28 0.00 0.00 0.00 179.25 178.41 1r1n h VAL 16 N -0.80 0.00 0.45 0.00 2.07 -1.22 -2.32 116.25 114.43 1r1n h VAL 16 Ca -0.07 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 1r1n h VAL 16 Cb 0.64 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1r1n h VAL 16 CO 0.07 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 177.45 1r1n h ALA 17 N 2.16 -0.61 -0.07 1.67 0.00 -0.71 -2.44 119.26 119.25 1r1n h ALA 17 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1r1n h ALA 17 Cb 0.47 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1r1n h ALA 17 CO 0.00 -0.67 -0.17 -0.44 0.00 0.00 0.00 179.25 177.97 1r1n h ASP 18 N -0.95 0.11 0.00 0.00 3.32 -0.90 0.59 116.42 118.59 1r1n h ASP 18 Ca -0.06 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1r1n h ASP 18 Cb 0.58 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1r1n h ASP 18 CO 0.10 0.29 0.00 0.00 -1.72 0.00 0.00 179.24 177.92 1r1n n ALA 19 N -2.49 2.13 0.00 3.45 0.00 -0.88 -2.02 120.51 120.70 1r1n n ALA 19 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1r1n n ALA 19 Cb 0.27 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1r1n n ALA 19 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1r1n n PHE 20 N -0.79 0.00 0.01 0.00 7.35 0.16 -4.52 117.46 119.67 1r1n n PHE 20 Ca 0.08 0.00 -0.18 0.00 -0.76 0.00 0.00 57.45 56.59 1r1n n PHE 20 Cb 0.04 0.00 -0.13 0.00 0.35 0.00 0.00 39.48 39.74 1r1n n PHE 20 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 1r1n h THR 21 N 0.00 1.53 0.20 -2.13 2.02 0.24 -2.90 112.91 111.86 1r1n h THR 21 Ca 0.00 -2.28 -0.34 0.00 0.77 0.00 0.00 66.41 64.57 1r1n h THR 21 Cb 0.72 2.98 0.02 0.00 -1.74 0.00 0.00 68.15 70.13 1r1n h THR 21 CO 0.00 0.64 -1.60 0.08 0.37 0.00 0.00 175.52 175.00 1r1n h ARG 22 N -0.40 0.41 0.00 6.66 0.11 -1.67 0.89 114.38 120.38 1r1n h ARG 22 Ca -0.09 -0.71 0.00 0.00 0.10 0.00 0.00 59.98 59.29 1r1n h ARG 22 Cb 1.35 0.26 0.00 0.00 1.11 0.00 0.00 29.97 32.70 1r1n h ARG 22 CO 0.10 1.32 0.00 0.00 0.10 0.00 0.00 179.97 181.50 1r1n h ALA 23 N 0.22 1.00 0.00 0.08 0.00 -1.72 -3.31 119.26 115.53 1r1n h ALA 23 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1r1n h ALA 23 Cb 2.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.90 1r1n h ALA 23 CO 0.21 0.00 -0.45 0.25 0.00 0.00 0.00 179.25 179.26 1r1n n THR 24 N -2.55 0.00 -0.13 0.00 -2.24 -1.10 -5.02 114.28 103.25 1r1n n THR 24 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1r1n n THR 24 Cb 0.20 -0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 1r1n n THR 24 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r1n n GLY 25 N 1.68 0.93 3.53 3.38 0.00 0.31 -5.04 105.19 109.98 1r1n n GLY 25 Ca 0.00 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 1r1n n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r1n s ILE 26 N -2.00 4.79 0.74 -0.61 1.01 -1.02 -4.96 121.20 119.14 1r1n s ILE 26 Ca 0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.53 1r1n s ILE 26 Cb 0.00 -3.25 0.04 0.00 0.01 0.00 0.00 42.46 39.26 1r1n s ILE 26 CO 0.00 0.32 1.08 -0.54 0.00 0.00 0.00 174.94 175.80 1r1n s LYS 27 N 1.48 2.54 -0.13 2.79 1.02 -1.26 -3.31 119.74 122.87 1r1n s LYS 27 Ca 0.06 1.10 -0.04 0.00 0.02 0.00 0.00 55.97 57.12 1r1n s LYS 27 Cb -0.15 -1.93 0.05 0.00 -0.52 0.00 0.00 37.83 35.27 1r1n s LYS 27 CO 0.06 -1.42 0.07 0.08 -0.92 0.00 0.00 175.35 173.21 1r1n s VAL 28 N -2.93 0.04 -0.45 3.17 1.01 -1.26 -2.83 120.40 117.15 1r1n s VAL 28 Ca 0.60 -0.03 -0.20 0.00 0.00 0.00 0.00 61.98 62.35 1r1n s VAL 28 Cb -0.16 -0.52 0.03 0.00 0.00 0.00 0.00 36.38 35.73 1r1n s VAL 28 CO 0.55 -0.09 0.62 -0.75 0.00 0.00 0.00 175.10 175.42 1r1n s LYS 29 N 2.09 3.22 0.30 2.72 2.20 -1.02 -4.97 119.74 124.28 1r1n s LYS 29 Ca 0.03 -0.52 -0.25 0.00 -0.36 0.00 0.00 55.97 54.87 1r1n s LYS 29 Cb -0.15 -3.98 -0.09 0.00 -1.51 0.00 0.00 37.83 32.10 1r1n s LYS 29 CO -0.07 -1.04 0.89 -0.51 -0.36 0.00 0.00 175.35 174.27 1r1n s LEU 30 N 2.72 4.34 -0.29 5.43 1.43 -1.26 -1.95 118.68 129.10 1r1n s LEU 30 Ca 0.20 1.74 -0.02 0.00 -1.03 0.00 0.00 54.13 55.02 1r1n s LEU 30 Cb -0.15 -3.91 0.09 0.00 0.03 0.00 0.00 46.19 42.25 1r1n s LEU 30 CO 0.17 -0.04 0.10 0.21 0.23 0.00 0.00 176.35 177.01 1r1n s ASN 31 N -1.62 3.78 -0.15 2.29 3.04 -0.77 -4.97 114.94 116.54 1r1n s ASN 31 Ca 0.48 -1.45 -0.08 0.00 0.04 0.00 0.00 52.86 51.85 1r1n s ASN 31 Cb -0.18 -0.72 -0.04 0.00 -1.54 0.00 0.00 41.25 38.77 1r1n s ASN 31 CO 0.23 -0.41 0.14 -0.44 -3.04 0.00 0.00 177.10 173.59 1r1n s SER 32 N 1.76 6.33 0.18 -4.21 0.01 -1.25 -0.24 113.70 116.27 1r1n s SER 32 Ca 0.08 0.39 -0.22 0.00 1.31 0.00 0.00 55.95 57.50 1r1n s SER 32 Cb -0.17 -2.08 0.07 0.00 0.21 0.00 0.00 66.02 64.05 1r1n s SER 32 CO -0.26 0.31 1.02 0.00 0.41 0.00 0.00 173.24 174.73 1r1n s ALA 33 N -0.45 -1.58 0.57 1.44 0.00 -1.10 -5.02 121.76 115.62 1r1n s ALA 33 Ca 0.12 -0.27 -0.20 0.00 0.00 0.00 0.00 51.96 51.62 1r1n s ALA 33 Cb -0.12 0.73 -0.04 0.00 0.00 0.00 0.00 23.12 23.70 1r1n s ALA 33 CO 0.02 -1.06 1.24 0.21 0.00 0.00 0.00 175.76 176.17 1r1n s LYS 34 N -2.34 3.08 0.28 0.00 2.20 -1.26 -4.37 119.74 117.32 1r1n s LYS 34 Ca 0.20 1.92 0.02 0.00 -0.36 0.00 0.00 55.97 57.75 1r1n s LYS 34 Cb -0.02 -2.05 0.63 0.00 -1.51 0.00 0.00 37.83 34.88 1r1n s LYS 34 CO 0.05 -1.15 1.75 0.78 -0.36 0.00 0.00 175.35 176.43 1r1n h GLY 35 N 1.12 1.53 0.61 5.54 0.00 -1.92 -2.81 103.07 107.15 1r1n h GLY 35 Ca -0.50 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 46.54 1r1n h GLY 35 CO 0.56 -0.09 -0.15 -0.55 0.00 0.00 0.00 176.54 176.31 1r1n h ASP 36 N 0.62 -0.35 0.00 0.19 3.32 -1.97 -3.13 116.42 115.10 1r1n h ASP 36 Ca 0.52 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1r1n h ASP 36 Cb 0.80 0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1r1n h ASP 36 CO -0.40 0.05 0.00 0.00 -1.72 0.00 0.00 179.24 177.17 1r1n n GLN 37 N -5.11 0.69 0.00 3.56 10.64 -1.07 -2.03 117.38 124.06 1r1n n GLN 37 Ca -0.09 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.08 1r1n n GLN 37 Cb 0.27 -1.15 0.00 0.00 -0.86 0.00 0.00 30.24 28.49 1r1n n GLN 37 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1r1n n LEU 38 N 0.93 1.08 0.13 2.61 4.77 -1.18 -4.37 117.00 120.97 1r1n n LEU 38 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.96 1r1n n LEU 38 Cb 0.35 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.58 1r1n n LEU 38 CO 0.00 0.18 0.46 0.00 -1.33 0.00 0.00 177.39 176.69 1r1n h ALA 39 N 0.00 0.91 0.00 -1.18 0.00 -1.41 -1.01 119.26 116.57 1r1n h ALA 39 Ca 0.00 -0.60 -0.22 0.00 0.00 0.00 0.00 54.91 54.09 1r1n h ALA 39 Cb 0.37 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1r1n h ALA 39 CO 0.00 0.82 -1.11 0.78 0.00 0.00 0.00 179.25 179.74 1r1n h GLY 40 N 1.98 0.00 2.00 0.00 0.00 -1.70 -3.02 103.07 102.34 1r1n h GLY 40 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.28 1r1n h GLY 40 CO 0.09 0.01 -0.16 -1.61 0.00 0.00 0.00 176.54 174.86 1r1n h GLN 41 N 0.00 0.00 0.00 4.80 4.15 -1.70 -2.47 115.11 119.89 1r1n h GLN 41 Ca -0.05 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.29 1r1n h GLN 41 Cb 1.81 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.49 1r1n h GLN 41 CO 0.12 0.16 -0.36 0.82 -1.93 0.00 0.00 178.83 177.64 1r1n h ILE 42 N 0.00 0.65 0.05 2.39 2.04 -1.07 -3.10 117.51 118.47 1r1n h ILE 42 Ca -0.00 -1.81 -0.27 0.00 1.00 0.00 0.00 64.86 63.78 1r1n h ILE 42 Cb 0.79 2.24 -0.03 0.00 -0.74 0.00 0.00 36.82 39.08 1r1n h ILE 42 CO 0.02 0.36 -1.36 0.11 0.00 0.00 0.00 178.15 177.27 1r1n h LYS 43 N 0.00 0.10 -0.87 2.37 1.57 -1.35 1.00 116.57 119.39 1r1n h LYS 43 Ca -0.00 -0.17 -0.11 0.00 -1.87 0.00 0.00 60.65 58.49 1r1n h LYS 43 Cb 1.21 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 33.51 1r1n h LYS 43 CO 0.05 0.93 0.14 0.39 -0.57 0.00 0.00 179.45 180.39 1r1n n GLU 44 N -3.32 2.45 0.00 3.15 1.02 -0.96 -3.50 120.64 119.48 1r1n n GLU 44 Ca -0.10 -1.61 0.00 0.00 -0.02 0.00 0.00 57.16 55.43 1r1n n GLU 44 Cb 1.01 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 30.65 1r1n n GLU 44 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1r1n n GLU 45 N 0.04 0.00 0.00 3.49 1.02 -1.17 -5.02 120.64 118.99 1r1n n GLU 45 Ca 0.21 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 1r1n n GLU 45 Cb 0.90 -0.39 0.00 0.00 -0.02 0.00 0.00 31.44 31.93 1r1n n GLU 45 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1r1n n GLY 46 N 0.93 0.54 0.08 0.62 0.00 0.35 -0.16 105.19 107.53 1r1n n GLY 46 Ca 0.00 0.39 -0.12 0.00 0.00 0.00 0.00 46.02 46.29 1r1n n GLY 46 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1r1n h SER 47 N 0.00 0.11 -0.63 1.61 0.02 -1.92 -3.14 113.55 109.60 1r1n h SER 47 Ca 0.00 -0.33 -0.36 0.00 -0.84 0.00 0.00 61.79 60.26 1r1n h SER 47 Cb 0.00 -0.03 -0.14 0.00 0.14 0.00 0.00 62.40 62.37 1r1n h SER 47 CO 0.00 0.41 0.30 -1.14 -1.14 0.00 0.00 176.83 175.26 1r1n n ARG 48 N -4.85 2.01 -3.51 3.45 3.00 0.77 -4.83 116.66 112.70 1r1n n ARG 48 Ca -0.07 -1.72 -0.42 0.00 -0.00 0.00 0.00 57.85 55.64 1r1n n ARG 48 Cb 0.20 -1.82 -0.10 0.00 0.00 0.00 0.00 32.46 30.73 1r1n n ARG 48 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1r1n s SER 49 N 0.53 5.99 0.00 6.15 0.15 -1.19 -4.88 113.70 120.45 1r1n s SER 49 Ca 0.44 -0.87 0.00 0.00 0.70 0.00 0.00 55.95 56.22 1r1n s SER 49 Cb 0.29 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.48 1r1n s SER 49 CO -0.09 -0.40 0.83 -0.81 1.20 0.00 0.00 173.24 173.96 1r1n n PRO 50 N 5.11 0.00 -2.23 5.44 -0.04 -1.26 -4.69 135.00 137.32 1r1n n PRO 50 Ca -0.11 0.34 -0.42 0.00 -0.04 0.00 0.00 63.50 63.26 1r1n n PRO 50 Cb 0.47 -1.52 -0.03 0.00 -0.04 0.00 0.00 33.50 32.38 1r1n n PRO 50 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r1n s ALA 51 N -2.65 3.55 -0.18 0.55 0.00 -1.26 -4.52 121.76 117.26 1r1n s ALA 51 Ca 0.00 0.99 0.05 0.00 0.00 0.00 0.00 51.96 53.00 1r1n s ALA 51 Cb 0.00 -3.54 -0.14 0.00 0.00 0.00 0.00 23.12 19.43 1r1n s ALA 51 CO 0.00 -0.70 -0.10 -0.25 0.00 0.00 0.00 175.76 174.71 1r1n n ASP 52 N 4.47 2.17 -4.09 0.00 9.92 -0.59 -4.44 116.55 123.99 1r1n n ASP 52 Ca 0.12 -0.07 -0.15 0.00 -0.53 0.00 0.00 54.79 54.16 1r1n n ASP 52 Cb 0.43 0.05 -0.12 0.00 -0.64 0.00 0.00 41.12 40.85 1r1n n ASP 52 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1r1n s VAL 53 N -2.37 0.70 -0.25 2.53 1.01 -1.22 -1.26 120.40 119.53 1r1n s VAL 53 Ca -0.20 -1.09 0.02 0.00 0.00 0.00 0.00 61.98 60.71 1r1n s VAL 53 Cb 0.06 -0.73 0.06 0.00 0.00 0.00 0.00 36.38 35.77 1r1n s VAL 53 CO 0.49 -0.30 -0.08 0.12 0.00 0.00 0.00 175.10 175.33 1r1n s PHE 54 N -1.26 2.92 -0.30 5.22 5.36 0.30 -1.06 117.98 129.16 1r1n s PHE 54 Ca -0.07 -2.11 -0.13 0.00 -0.96 0.00 0.00 56.93 53.66 1r1n s PHE 54 Cb -0.09 -1.81 -0.03 0.00 -0.34 0.00 0.00 43.02 40.74 1r1n s PHE 54 CO 0.01 -0.84 0.28 -0.47 -1.46 0.00 0.00 175.22 172.74 1r1n s TYR 55 N 1.22 3.23 0.07 10.12 5.04 -1.06 -0.33 117.35 135.64 1r1n s TYR 55 Ca -0.07 0.10 0.06 0.00 -2.44 0.00 0.00 57.07 54.72 1r1n s TYR 55 Cb -0.20 -2.50 -0.03 0.00 0.35 0.00 0.00 41.96 39.59 1r1n s TYR 55 CO -0.06 -0.26 -0.15 -1.54 -1.34 0.00 0.00 175.55 172.20 1r1n s SER 56 N 1.72 1.79 -0.01 4.32 1.04 -0.09 0.39 113.70 122.87 1r1n s SER 56 Ca 0.10 -0.61 0.02 0.00 0.48 0.00 0.00 55.95 55.93 1r1n s SER 56 Cb -0.16 -0.07 0.07 0.00 0.10 0.00 0.00 66.02 65.96 1r1n s SER 56 CO 0.11 -0.05 0.95 -1.84 0.98 0.00 0.00 173.24 173.38 1r1n n GLU 57 N 1.31 1.23 -3.54 4.02 0.00 -1.26 -1.88 120.64 120.51 1r1n n GLU 57 Ca -0.21 -0.28 -0.15 0.00 0.00 0.00 0.00 57.16 56.53 1r1n n GLU 57 Cb 0.54 -1.19 -0.05 0.00 0.00 0.00 0.00 31.44 30.74 1r1n n GLU 57 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.13 178.27 1r1n s GLN 58 N -1.72 0.86 0.08 3.44 -2.07 -1.25 -4.63 119.66 114.37 1r1n s GLN 58 Ca 0.05 0.19 -0.12 0.00 -1.82 0.00 0.00 55.36 53.66 1r1n s GLN 58 Cb 0.03 0.41 -0.21 0.00 -1.09 0.00 0.00 33.01 32.14 1r1n s GLN 58 CO 0.03 -0.27 1.21 0.82 -1.32 0.00 0.00 175.29 175.75 1r1n h ILE 59 N 2.78 1.30 -0.85 3.63 2.04 -1.88 -3.35 117.51 121.18 1r1n h ILE 59 Ca -0.23 -2.29 0.22 0.00 1.00 0.00 0.00 64.86 63.55 1r1n h ILE 59 Cb 1.15 2.40 -0.14 0.00 -0.74 0.00 0.00 36.82 39.49 1r1n h ILE 59 CO 0.35 0.70 0.12 -0.65 0.00 0.00 0.00 178.15 178.68 1r1n h PRO 60 N 0.36 0.13 0.00 2.37 0.11 -1.95 0.31 132.00 133.35 1r1n h PRO 60 Ca -0.12 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.93 1r1n h PRO 60 Cb 1.69 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.76 1r1n h PRO 60 CO 0.20 0.09 -0.22 0.00 -0.21 0.00 0.00 178.00 177.86 1r1n h ALA 61 N 1.78 0.93 -0.30 -0.75 0.00 -1.91 -2.01 119.26 117.00 1r1n h ALA 61 Ca 0.51 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 1r1n h ALA 61 Cb 0.98 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1r1n h ALA 61 CO -0.70 0.28 -0.29 -0.07 0.00 0.00 0.00 179.25 178.47 1r1n h LEU 62 N 0.00 0.64 0.00 0.00 3.38 -0.55 -2.70 115.31 116.07 1r1n h LEU 62 Ca -0.00 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 1r1n h LEU 62 Cb 0.91 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1r1n h LEU 62 CO 0.03 0.90 -0.31 0.00 0.09 0.00 0.00 178.44 179.14 1r1n h ALA 63 N 1.15 0.82 -0.89 1.53 0.00 -1.05 -2.68 119.26 118.14 1r1n h ALA 63 Ca 0.07 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1r1n h ALA 63 Cb 0.77 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 1r1n h ALA 63 CO 0.06 0.32 0.55 1.15 0.00 0.00 0.00 179.25 181.33 1r1n h THR 64 N 0.00 1.24 0.09 0.00 2.02 -1.03 0.99 112.91 116.23 1r1n h THR 64 Ca -0.01 -0.50 -0.30 0.00 0.77 0.00 0.00 66.41 66.37 1r1n h THR 64 Cb 1.20 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1r1n h THR 64 CO 0.03 0.25 -1.54 -0.07 0.37 0.00 0.00 175.52 174.56 1r1n h LEU 65 N 1.22 0.31 0.39 2.58 3.38 -1.59 -3.33 115.31 118.27 1r1n h LEU 65 Ca 0.32 -0.46 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1r1n h LEU 65 Cb -0.08 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1r1n h LEU 65 CO -0.06 1.38 -0.19 -1.28 0.09 0.00 0.00 178.44 178.38 1r1n h SER 66 N 0.05 -0.45 0.00 -0.43 0.87 -1.20 -0.92 113.55 111.47 1r1n h SER 66 Ca -0.24 -0.09 -0.10 0.00 -1.23 0.00 0.00 61.79 60.13 1r1n h SER 66 Cb 2.00 0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 64.03 1r1n h SER 66 CO 0.15 -0.17 -0.08 0.00 -0.53 0.00 0.00 176.83 176.20 1r1n n ALA 67 N -2.43 4.32 -1.02 6.23 0.00 0.34 0.97 120.51 128.92 1r1n n ALA 67 Ca -0.11 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.35 1r1n n ALA 67 Cb 0.27 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1r1n n ALA 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r1n n ALA 68 N 2.48 0.55 -3.79 0.00 0.00 -0.76 -4.88 120.51 114.10 1r1n n ALA 68 Ca 0.23 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.41 1r1n n ALA 68 Cb 0.56 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.94 1r1n n ALA 68 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1r1n n ASN 69 N 0.00 -0.11 -0.76 0.00 5.03 0.27 -4.80 115.26 114.89 1r1n n ASN 69 Ca 0.00 -0.93 0.09 0.00 0.87 0.00 0.00 54.58 54.61 1r1n n ASN 69 Cb 0.21 -1.17 0.10 0.00 -1.02 0.00 0.00 39.78 37.90 1r1n n ASN 69 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1r1n n LEU 70 N -3.42 2.65 -4.85 3.41 4.77 -0.45 -4.99 117.00 114.12 1r1n n LEU 70 Ca -0.11 -1.16 -0.26 0.00 -0.03 0.00 0.00 56.01 54.46 1r1n n LEU 70 Cb 0.44 -0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 41.43 1r1n n LEU 70 CO 0.66 0.51 -0.17 -0.76 -1.33 0.00 0.00 177.39 176.29 1r1n s LEU 71 N -1.41 3.96 -0.00 2.23 1.43 -1.26 -2.59 118.68 121.04 1r1n s LEU 71 Ca 0.23 -0.06 -0.07 0.00 -1.03 0.00 0.00 54.13 53.21 1r1n s LEU 71 Cb 0.16 -2.55 -0.05 0.00 0.03 0.00 0.00 46.19 43.78 1r1n s LEU 71 CO 0.23 0.05 0.26 -0.70 0.23 0.00 0.00 176.35 176.42 1r1n s GLU 72 N -3.25 3.58 0.51 1.70 2.56 0.22 -4.59 118.70 119.43 1r1n s GLU 72 Ca 0.32 -0.07 -0.20 0.00 0.00 0.00 0.00 54.97 55.02 1r1n s GLU 72 Cb -0.10 -3.09 -0.07 0.00 2.00 0.00 0.00 34.13 32.87 1r1n s GLU 72 CO 0.25 0.66 1.12 -1.25 -0.56 0.00 0.00 175.26 175.48 1r1n s PRO 73 N -1.68 3.52 -0.02 4.30 0.04 -1.26 -4.47 135.00 135.44 1r1n s PRO 73 Ca 0.26 1.61 0.07 0.00 0.04 0.00 0.00 61.00 62.98 1r1n s PRO 73 Cb -0.13 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 1r1n s PRO 73 CO 0.15 -0.71 -0.21 -0.51 0.04 0.00 0.00 177.00 175.76 1r1n s LEU 74 N -3.56 2.35 0.42 -3.56 1.43 -1.18 -5.02 118.68 109.56 1r1n s LEU 74 Ca 0.70 -0.38 -0.26 0.00 -1.03 0.00 0.00 54.13 53.16 1r1n s LEU 74 Cb -0.24 -1.43 -0.09 0.00 0.03 0.00 0.00 46.19 44.47 1r1n s LEU 74 CO 0.28 0.32 1.35 -2.16 0.23 0.00 0.00 176.35 176.36 1r1n s PRO 75 N -0.80 3.89 0.49 1.29 0.04 -1.26 -4.89 135.00 133.76 1r1n s PRO 75 Ca 0.11 2.25 0.29 0.00 0.04 0.00 0.00 61.00 63.69 1r1n s PRO 75 Cb -0.10 -2.73 1.38 0.00 0.04 0.00 0.00 34.50 33.08 1r1n s PRO 75 CO 0.00 -0.59 1.80 0.00 0.04 0.00 0.00 177.00 178.25 1r1n h ALA 76 N 2.58 2.76 -0.61 8.56 0.00 -1.99 0.98 119.26 131.54 1r1n h ALA 76 Ca -0.50 0.00 0.13 0.00 0.00 0.00 0.00 54.91 54.54 1r1n h ALA 76 Cb 1.25 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.07 1r1n h ALA 76 CO 0.62 -1.12 0.42 0.66 0.00 0.00 0.00 179.25 179.83 1r1n h SER 77 N 0.15 0.24 0.04 0.00 4.64 -1.98 0.88 113.55 117.51 1r1n h SER 77 Ca 0.57 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.90 1r1n h SER 77 Cb 1.94 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.99 1r1n h SER 77 CO -0.12 0.13 -0.02 0.74 -0.87 0.00 0.00 176.83 176.69 1r1n h THR 78 N 0.26 1.34 -0.46 2.95 2.02 -1.15 -3.19 112.91 114.68 1r1n h THR 78 Ca 0.29 -1.64 -0.11 0.00 0.77 0.00 0.00 66.41 65.72 1r1n h THR 78 Cb 0.80 2.37 -0.02 0.00 -1.74 0.00 0.00 68.15 69.57 1r1n h THR 78 CO -0.06 0.39 -0.15 0.40 0.37 0.00 0.00 175.52 176.47 1r1n h ILE 79 N -0.83 1.27 -0.86 3.11 2.04 -1.44 -2.50 117.51 118.30 1r1n h ILE 79 Ca -0.01 -1.27 0.21 0.00 1.00 0.00 0.00 64.86 64.79 1r1n h ILE 79 Cb 0.68 1.08 -0.06 0.00 -0.74 0.00 0.00 36.82 37.78 1r1n h ILE 79 CO 0.01 0.44 0.58 0.78 0.00 0.00 0.00 178.15 179.95 1r1n h ASN 80 N 0.77 0.29 0.06 1.72 2.35 0.68 -0.70 115.58 120.75 1r1n h ASN 80 Ca 0.12 0.03 0.03 0.00 -0.55 0.00 0.00 56.30 55.92 1r1n h ASN 80 Cb 0.68 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.98 1r1n h ASN 80 CO 0.05 0.12 -0.31 -0.33 -1.65 0.00 0.00 177.43 175.31 1r1n h GLU 81 N 0.29 -0.48 -0.69 0.81 4.39 -1.42 -2.40 114.58 115.09 1r1n h GLU 81 Ca 0.43 0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.17 1r1n h GLU 81 Cb 1.24 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.99 1r1n h GLU 81 CO -0.12 -0.32 0.00 0.25 -1.16 0.00 0.00 179.01 177.66 1r1n n THR 82 N -5.41 1.25 -1.66 1.13 -2.24 -0.34 -4.51 114.28 102.51 1r1n n THR 82 Ca -0.06 -0.69 -0.52 0.00 -2.27 0.00 0.00 64.05 60.51 1r1n n THR 82 Cb 0.32 -0.23 -0.06 0.00 -2.10 0.00 0.00 70.33 68.26 1r1n n THR 82 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1r1n n ARG 83 N 0.41 1.49 -3.64 -0.78 5.12 -0.79 -4.85 116.66 113.62 1r1n n ARG 83 Ca 0.14 0.54 -0.07 0.00 -1.93 0.00 0.00 57.85 56.54 1r1n n ARG 83 Cb 0.66 -2.25 -0.07 0.00 -1.16 0.00 0.00 32.46 29.63 1r1n n ARG 83 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1r1n s GLY 84 N 2.17 -0.59 0.00 -0.13 0.00 -1.26 -4.98 107.32 102.54 1r1n s GLY 84 Ca 0.90 2.49 0.00 0.00 0.00 0.00 0.00 44.72 48.11 1r1n s GLY 84 CO 0.52 2.43 0.12 1.17 0.00 0.00 0.00 173.10 177.34 1r1n n LYS 85 N 4.28 0.00 0.00 2.90 3.00 -1.26 0.00 118.16 127.08 1r1n n LYS 85 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.11 1r1n n LYS 85 Cb 0.59 -1.12 0.00 0.00 0.00 0.00 0.00 35.03 34.50 1r1n n LYS 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1r1n n GLY 86 N -0.61 0.09 3.71 3.14 0.00 -1.26 -5.06 105.19 105.21 1r1n n GLY 86 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1r1n n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r1n s VAL 87 N -0.66 3.36 0.05 1.61 1.01 0.10 -4.97 120.40 120.90 1r1n s VAL 87 Ca 0.00 0.97 -0.30 0.00 0.00 0.00 0.00 61.98 62.65 1r1n s VAL 87 Cb 0.00 -3.62 -0.08 0.00 0.00 0.00 0.00 36.38 32.68 1r1n s VAL 87 CO 0.00 0.07 1.66 -2.84 0.00 0.00 0.00 175.10 173.99 1r1n s PRO 88 N 1.12 4.20 0.04 2.72 0.02 -1.26 -4.73 135.00 137.11 1r1n s PRO 88 Ca 0.64 2.31 0.02 0.00 0.02 0.00 0.00 61.00 64.00 1r1n s PRO 88 Cb -0.36 -3.68 -0.04 0.00 0.02 0.00 0.00 34.50 30.44 1r1n s PRO 88 CO 0.30 -0.75 0.04 0.08 -0.33 0.00 0.00 177.00 176.33 1r1n s VAL 89 N 2.91 4.35 -0.25 3.83 1.01 -1.26 -4.43 120.40 126.56 1r1n s VAL 89 Ca 0.74 -0.69 -0.25 0.00 0.00 0.00 0.00 61.98 61.78 1r1n s VAL 89 Cb -0.39 -3.02 -0.00 0.00 0.00 0.00 0.00 36.38 32.97 1r1n s VAL 89 CO 0.32 0.24 0.83 0.00 0.00 0.00 0.00 175.10 176.50 1r1n s ALA 90 N -1.24 3.64 0.31 5.51 0.00 -1.26 -4.94 121.76 123.77 1r1n s ALA 90 Ca 0.24 -0.16 0.03 0.00 0.00 0.00 0.00 51.96 52.08 1r1n s ALA 90 Cb -0.12 -3.30 0.63 0.00 0.00 0.00 0.00 23.12 20.33 1r1n s ALA 90 CO 0.16 -0.97 1.86 0.00 0.00 0.00 0.00 175.76 176.81 1r1n h ALA 91 N 7.73 1.61 -0.42 0.00 0.00 -1.98 0.01 119.26 126.20 1r1n h ALA 91 Ca -0.23 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1r1n h ALA 91 Cb 1.09 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1r1n h ALA 91 CO 0.88 0.16 0.00 1.63 0.00 0.00 0.00 179.25 181.92 1r1n n LYS 92 N -4.58 3.79 -3.70 0.00 5.02 -1.26 -4.99 118.16 112.43 1r1n n LYS 92 Ca 0.18 -2.95 -0.25 0.00 -2.02 0.00 0.00 58.31 53.27 1r1n n LYS 92 Cb 0.37 -2.00 0.00 0.00 -0.02 0.00 0.00 35.03 33.38 1r1n n LYS 92 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1r1n n LYS 93 N 0.12 -1.16 -0.01 1.97 5.02 -0.01 -4.87 118.16 119.23 1r1n n LYS 93 Ca 0.24 0.52 0.04 0.00 -2.02 0.00 0.00 58.31 57.09 1r1n n LYS 93 Cb 1.00 -1.92 -0.07 0.00 -0.02 0.00 0.00 35.03 34.02 1r1n n LYS 93 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1r1n n ASP 94 N -2.13 3.01 -4.19 4.39 9.92 -1.26 -3.11 116.55 123.18 1r1n n ASP 94 Ca -0.25 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 53.89 1r1n n ASP 94 Cb 0.58 1.37 -0.10 0.00 -0.64 0.00 0.00 41.12 42.33 1r1n n ASP 94 CO 0.00 0.00 0.00 -1.66 0.13 0.00 0.00 177.20 175.67 1r1n s TRP 95 N -2.59 1.10 -0.01 1.24 1.48 -1.26 -3.98 118.94 114.92 1r1n s TRP 95 Ca -0.03 -1.35 0.01 0.00 -1.06 0.00 0.00 56.10 53.67 1r1n s TRP 95 Cb 0.05 -0.54 0.01 0.00 -1.16 0.00 0.00 33.47 31.83 1r1n s TRP 95 CO 0.36 -0.61 -0.03 0.08 -4.06 0.00 0.00 176.95 172.69 1r1n s VAL 96 N -4.14 0.26 0.49 -0.66 1.01 -1.09 -4.46 120.40 111.82 1r1n s VAL 96 Ca 0.36 -0.09 -0.22 0.00 0.00 0.00 0.00 61.98 62.03 1r1n s VAL 96 Cb 0.07 -0.26 -0.06 0.00 0.00 0.00 0.00 36.38 36.13 1r1n s VAL 96 CO 0.10 0.10 1.22 0.00 0.00 0.00 0.00 175.10 176.52 1r1n s ALA 97 N 0.24 2.91 0.00 5.51 0.00 -1.26 -2.23 121.76 126.92 1r1n s ALA 97 Ca -0.02 1.05 0.00 0.00 0.00 0.00 0.00 51.96 52.99 1r1n s ALA 97 Cb -0.05 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1r1n s ALA 97 CO -0.01 -0.89 0.02 1.28 0.00 0.00 0.00 175.76 176.17 1r1n n LEU 98 N -0.71 0.05 0.00 0.00 4.77 0.17 -4.82 117.00 116.47 1r1n n LEU 98 Ca 0.08 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 1r1n n LEU 98 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1r1n n LEU 98 CO 0.49 0.01 0.00 -1.54 -1.33 0.00 0.00 177.39 175.02 1r1n n SER 99 N -0.60 0.00 -3.98 -1.43 3.41 -1.23 -4.36 113.62 105.43 1r1n n SER 99 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 1r1n n SER 99 Cb 0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 1r1n n SER 99 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1r1n s GLY 100 N 0.00 0.31 -0.07 5.00 0.00 -0.37 -1.58 107.32 110.62 1r1n s GLY 100 Ca 0.00 -0.38 0.01 0.00 0.00 0.00 0.00 44.72 44.36 1r1n s GLY 100 CO 0.00 -0.37 -0.09 0.50 0.00 0.00 0.00 173.10 173.14 1r1n s ARG 101 N -0.57 2.73 0.07 2.90 0.52 -0.38 -1.48 118.95 122.75 1r1n s ARG 101 Ca -0.02 -0.59 0.05 0.00 -0.52 0.00 0.00 55.73 54.65 1r1n s ARG 101 Cb -0.04 -2.54 -0.04 0.00 0.52 0.00 0.00 34.95 32.84 1r1n s ARG 101 CO -0.00 0.63 -0.06 0.45 0.02 0.00 0.00 175.30 176.34 1r1n s SER 102 N -0.71 4.67 0.02 0.23 0.15 -1.26 -1.02 113.70 115.77 1r1n s SER 102 Ca 0.11 -0.25 -0.20 0.00 0.70 0.00 0.00 55.95 56.30 1r1n s SER 102 Cb -0.11 -1.02 -0.06 0.00 -1.71 0.00 0.00 66.02 63.12 1r1n s SER 102 CO 0.01 0.20 0.59 -0.13 1.20 0.00 0.00 173.24 175.12 1r1n s ARG 103 N -2.05 4.29 0.31 5.44 1.81 -0.90 -0.77 118.95 127.08 1r1n s ARG 103 Ca 0.22 0.74 0.02 0.00 -1.72 0.00 0.00 55.73 54.99 1r1n s ARG 103 Cb -0.11 -3.32 -0.02 0.00 -0.45 0.00 0.00 34.95 31.05 1r1n s ARG 103 CO 0.14 0.43 0.31 0.14 -0.68 0.00 0.00 175.30 175.64 1r1n s VAL 104 N -0.42 0.00 -0.28 3.52 -7.23 -0.58 -4.67 120.40 110.75 1r1n s VAL 104 Ca 0.31 -1.86 0.02 0.00 -1.81 0.00 0.00 61.98 58.63 1r1n s VAL 104 Cb -0.19 -2.53 0.07 0.00 0.56 0.00 0.00 36.38 34.30 1r1n s VAL 104 CO 0.18 0.00 -0.03 -0.69 -0.31 0.00 0.00 175.10 174.25 1r1n s VAL 105 N -3.50 1.81 -0.42 1.32 1.01 -1.10 -1.75 120.40 117.76 1r1n s VAL 105 Ca 0.37 -1.63 -0.27 0.00 0.00 0.00 0.00 61.98 60.45 1r1n s VAL 105 Cb 0.02 -2.13 0.02 0.00 0.00 0.00 0.00 36.38 34.30 1r1n s VAL 105 CO 0.22 -0.27 1.01 0.54 0.00 0.00 0.00 175.10 176.60 1r1n s VAL 106 N 1.22 4.43 0.20 2.92 0.11 0.00 -1.50 120.40 127.78 1r1n s VAL 106 Ca -0.01 1.15 0.09 0.00 -2.93 0.00 0.00 61.98 60.28 1r1n s VAL 106 Cb -0.19 -4.45 -0.04 0.00 -1.53 0.00 0.00 36.38 30.17 1r1n s VAL 106 CO -0.08 -0.75 -0.08 -0.72 -3.33 0.00 0.00 175.10 170.14 1r1n s TYR 107 N 3.86 2.64 -0.69 1.54 1.13 -1.05 -2.10 117.35 122.68 1r1n s TYR 107 Ca 0.42 -0.22 -0.21 0.00 -1.41 0.00 0.00 57.07 55.65 1r1n s TYR 107 Cb -0.10 -1.26 0.09 0.00 -1.10 0.00 0.00 41.96 39.59 1r1n s TYR 107 CO 0.24 0.54 0.91 0.34 -2.51 0.00 0.00 175.55 175.07 1r1n s ASP 108 N -3.00 6.26 0.63 -0.18 3.68 -0.64 -0.64 116.67 122.78 1r1n s ASP 108 Ca 0.26 -1.33 0.28 0.00 2.13 0.00 0.00 52.55 53.89 1r1n s ASP 108 Cb -0.08 -2.38 1.47 0.00 -1.45 0.00 0.00 42.92 40.48 1r1n s ASP 108 CO 0.16 -1.27 1.85 0.71 0.13 0.00 0.00 175.17 176.75 1r1n h THR 109 N 5.92 0.15 0.00 1.71 1.35 -1.27 0.29 112.91 121.06 1r1n h THR 109 Ca -0.21 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 1r1n h THR 109 Cb 1.07 0.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.09 1r1n h THR 109 CO 1.14 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 176.95 1r1n n ARG 110 N -3.22 0.06 -0.16 4.72 1.74 -1.26 -3.14 116.66 115.40 1r1n n ARG 110 Ca 0.03 0.49 0.00 0.00 -0.77 0.00 0.00 57.85 57.59 1r1n n ARG 110 Cb 0.55 -1.66 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 1r1n n ARG 110 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1r1n n LYS 111 N -1.78 0.00 -3.75 5.56 2.85 0.79 -5.12 118.16 116.71 1r1n n LYS 111 Ca 0.00 -0.23 -0.13 0.00 -1.05 0.00 0.00 58.31 56.91 1r1n n LYS 111 Cb 0.06 -0.17 -0.10 0.00 -0.65 0.00 0.00 35.03 34.17 1r1n n LYS 111 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1r1n s LEU 112 N 0.00 0.65 0.29 -5.58 1.43 0.10 -5.00 118.68 110.57 1r1n s LEU 112 Ca 0.00 0.54 0.03 0.00 -1.03 0.00 0.00 54.13 53.67 1r1n s LEU 112 Cb 0.00 1.29 -0.06 0.00 0.03 0.00 0.00 46.19 47.45 1r1n s LEU 112 CO 0.00 -0.23 0.06 -0.55 0.23 0.00 0.00 176.35 175.86 1r1n s SER 113 N -0.29 1.93 0.11 2.29 0.15 -1.26 -3.87 113.70 112.77 1r1n s SER 113 Ca -0.04 -1.35 -0.33 0.00 0.70 0.00 0.00 55.95 54.93 1r1n s SER 113 Cb -0.03 0.00 -0.12 0.00 -1.71 0.00 0.00 66.02 64.16 1r1n s SER 113 CO 0.02 -0.62 1.57 -0.33 1.20 0.00 0.00 173.24 175.07 1r1n h GLU 114 N 2.26 -0.69 -0.22 5.44 4.39 -1.97 -1.68 114.58 122.12 1r1n h GLU 114 Ca -0.40 0.05 0.06 0.00 0.34 0.00 0.00 59.36 59.41 1r1n h GLU 114 Cb 1.24 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 30.04 1r1n h GLU 114 CO 0.66 -0.46 0.52 1.57 -1.16 0.00 0.00 179.01 180.14 1r1n h LYS 115 N -0.72 0.00 -0.06 2.33 5.09 -1.98 0.36 116.57 121.59 1r1n h LYS 115 Ca 0.01 0.00 -0.21 0.00 0.09 0.00 0.00 60.65 60.54 1r1n h LYS 115 Cb 0.73 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.06 1r1n h LYS 115 CO -0.27 0.00 -0.82 -0.44 -2.09 0.00 0.00 179.45 175.84 1r1n h ASP 116 N 0.00 0.60 -3.44 7.07 3.32 -1.71 -3.46 116.42 118.80 1r1n h ASP 116 Ca 0.10 -0.42 -0.41 0.00 0.02 0.00 0.00 57.03 56.32 1r1n h ASP 116 Cb 1.15 -0.18 0.19 0.00 0.22 0.00 0.00 39.33 40.72 1r1n h ASP 116 CO -0.00 1.19 0.09 -0.76 -1.72 0.00 0.00 179.24 178.04 1r1n s LEU 117 N -7.97 0.47 0.44 1.55 1.02 0.12 -5.01 118.68 109.30 1r1n s LEU 117 Ca -0.07 0.75 -0.04 0.00 0.02 0.00 0.00 54.13 54.79 1r1n s LEU 117 Cb 0.09 -2.47 -0.04 0.00 0.02 0.00 0.00 46.19 43.79 1r1n s LEU 117 CO 0.86 -4.26 0.72 -1.61 0.02 0.00 0.00 176.35 172.08 1r1n s GLU 118 N -5.27 3.54 0.00 1.70 0.41 -1.26 -4.99 118.70 112.82 1r1n s GLU 118 Ca 0.70 0.07 0.22 0.00 -0.41 0.00 0.00 54.97 55.55 1r1n s GLU 118 Cb -0.12 -2.45 0.56 0.00 -1.78 0.00 0.00 34.13 30.34 1r1n s GLU 118 CO 0.57 -0.10 1.48 1.63 -0.49 0.00 0.00 175.26 178.35 1r1n n LYS 119 N -2.07 2.57 -3.41 1.61 4.76 -1.26 -4.82 118.16 115.53 1r1n n LYS 119 Ca -0.01 -2.42 0.02 0.00 -2.87 0.00 0.00 58.31 53.03 1r1n n LYS 119 Cb 0.55 -1.53 -0.03 0.00 -1.84 0.00 0.00 35.03 32.18 1r1n n LYS 119 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1r1n s SER 120 N -1.20 -0.87 0.53 4.39 0.15 -1.26 -5.00 113.70 110.43 1r1n s SER 120 Ca 0.44 0.99 0.44 0.00 0.70 0.00 0.00 55.95 58.52 1r1n s SER 120 Cb 0.24 1.91 1.65 0.00 -1.71 0.00 0.00 66.02 68.11 1r1n s SER 120 CO 0.32 -0.17 1.62 1.62 1.20 0.00 0.00 173.24 177.83 1r1n h VAL 121 N 5.72 0.09 0.00 4.45 3.04 -1.94 0.89 116.25 128.50 1r1n h VAL 121 Ca -0.17 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.51 1r1n h VAL 121 Cb 1.12 0.07 0.00 0.00 -2.01 0.00 0.00 31.29 30.48 1r1n h VAL 121 CO 0.09 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.66 1r1n n LEU 122 N -4.14 0.00 -0.11 3.16 -0.00 -1.26 -2.65 117.00 111.99 1r1n n LEU 122 Ca 0.40 0.21 0.14 0.00 -0.00 0.00 0.00 56.01 56.76 1r1n n LEU 122 Cb 1.78 -0.21 0.58 0.00 -0.00 0.00 0.00 43.42 45.57 1r1n n LEU 122 CO 0.39 -0.04 0.84 0.59 -0.00 0.00 0.00 177.39 179.17 1r1n n ASN 123 N -1.21 0.48 -0.02 1.45 4.13 0.31 -3.31 115.26 117.08 1r1n n ASN 123 Ca 0.14 -0.52 0.13 0.00 1.68 0.00 0.00 54.58 56.01 1r1n n ASN 123 Cb 0.17 -0.07 0.51 0.00 -1.54 0.00 0.00 39.78 38.85 1r1n n ASN 123 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1r1n n TYR 124 N -0.99 0.00 -1.76 3.10 4.01 -1.09 -4.16 117.16 116.28 1r1n n TYR 124 Ca 0.13 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.51 1r1n n TYR 124 Cb 0.29 -0.35 -0.02 0.00 -0.31 0.00 0.00 39.34 38.94 1r1n n TYR 124 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r1n n ALA 125 N -1.38 6.86 -2.59 -0.72 0.00 -1.21 -4.64 120.51 116.83 1r1n n ALA 125 Ca 0.08 -3.72 -0.09 0.00 0.00 0.00 0.00 53.44 49.71 1r1n n ALA 125 Cb 0.32 -2.74 -0.09 0.00 0.00 0.00 0.00 19.45 16.93 1r1n n ALA 125 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1r1n s THR 126 N -0.72 0.15 0.60 0.00 -4.23 -1.26 -4.73 115.64 105.46 1r1n s THR 126 Ca 0.58 -1.25 0.29 0.00 -1.18 0.00 0.00 61.69 60.13 1r1n s THR 126 Cb 0.22 -1.01 0.37 0.00 1.34 0.00 0.00 72.50 73.42 1r1n s THR 126 CO -0.11 -0.69 1.90 -0.65 -0.54 0.00 0.00 174.62 174.53 1r1n h PRO 127 N 3.57 0.00 -0.58 3.99 0.11 -1.94 -0.85 132.00 136.29 1r1n h PRO 127 Ca -0.33 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.82 1r1n h PRO 127 Cb 1.18 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1r1n h PRO 127 CO 0.54 0.00 0.38 -0.22 -0.21 0.00 0.00 178.00 178.49 1r1n h LYS 128 N 0.00 0.63 -1.00 1.05 3.64 -1.95 -2.31 116.57 116.63 1r1n h LYS 128 Ca 0.18 -0.04 -0.53 0.00 -1.27 0.00 0.00 60.65 58.99 1r1n h LYS 128 Cb 1.10 -0.14 -0.30 0.00 -0.41 0.00 0.00 32.23 32.47 1r1n h LYS 128 CO -0.00 0.42 0.68 0.91 -2.27 0.00 0.00 179.45 179.18 1r1n n TRP 129 N -4.47 3.06 -1.83 1.91 7.02 -0.33 -4.90 117.44 117.91 1r1n n TRP 129 Ca 0.07 -1.97 -0.43 0.00 -1.02 0.00 0.00 57.50 54.15 1r1n n TRP 129 Cb 0.16 -1.00 -0.03 0.00 -2.42 0.00 0.00 31.31 28.02 1r1n n TRP 129 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1r1n s LYS 130 N -3.32 3.61 -1.82 -0.99 2.47 -0.87 -1.99 119.74 116.83 1r1n s LYS 130 Ca 0.57 1.98 0.00 0.00 -1.56 0.00 0.00 55.97 56.97 1r1n s LYS 130 Cb 0.48 -4.19 0.00 0.00 -1.46 0.00 0.00 37.83 32.66 1r1n s LYS 130 CO 0.10 -1.54 0.00 0.09 0.16 0.00 0.00 175.35 174.16 1r1n n ASN 131 N 9.49 -5.17 -0.04 1.43 3.02 -0.89 -4.84 115.26 118.27 1r1n n ASN 131 Ca 0.23 0.34 -0.04 0.00 -0.03 0.00 0.00 54.58 55.08 1r1n n ASN 131 Cb 0.44 -4.25 -0.06 0.00 -0.61 0.00 0.00 39.78 35.31 1r1n n ASN 131 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1r1n n ARG 132 N -2.53 2.77 -4.56 3.52 1.74 -0.84 -4.62 116.66 112.14 1r1n n ARG 132 Ca -0.19 -0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.57 1r1n n ARG 132 Cb 0.60 -1.19 -0.11 0.00 -1.02 0.00 0.00 32.46 30.75 1r1n n ARG 132 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1r1n s ILE 133 N -2.17 3.48 -0.01 0.55 1.10 -1.22 -0.02 121.20 122.90 1r1n s ILE 133 Ca -0.04 -0.78 0.06 0.00 -0.51 0.00 0.00 60.65 59.37 1r1n s ILE 133 Cb 0.02 -2.48 -0.01 0.00 0.15 0.00 0.00 42.46 40.14 1r1n s ILE 133 CO 0.29 0.44 -0.18 -0.83 -2.11 0.00 0.00 174.94 172.55 1r1n s GLY 134 N -1.26 0.88 0.41 1.50 0.00 -0.48 -2.07 107.32 106.29 1r1n s GLY 134 Ca 0.15 -0.78 0.05 0.00 0.00 0.00 0.00 44.72 44.14 1r1n s GLY 134 CO 0.06 -0.64 0.03 -2.52 0.00 0.00 0.00 173.10 170.02 1r1n s TYR 135 N -0.42 2.18 -0.62 1.90 1.13 -0.87 0.50 117.35 121.16 1r1n s TYR 135 Ca 0.07 -0.86 0.04 0.00 -1.41 0.00 0.00 57.07 54.92 1r1n s TYR 135 Cb -0.07 -1.57 0.15 0.00 -1.10 0.00 0.00 41.96 39.38 1r1n s TYR 135 CO -0.01 0.23 0.40 0.08 -2.51 0.00 0.00 175.55 173.74 1r1n s VAL 136 N -2.93 2.61 0.66 -3.49 1.01 -1.26 -1.28 120.40 115.73 1r1n s VAL 136 Ca 0.28 -3.82 0.33 0.00 0.00 0.00 0.00 61.98 58.77 1r1n s VAL 136 Cb 0.07 -2.75 0.34 0.00 0.00 0.00 0.00 36.38 34.04 1r1n s VAL 136 CO 0.14 -0.94 2.03 1.55 0.00 0.00 0.00 175.10 177.88 1r1n h PRO 137 N 5.82 0.00 0.00 2.72 0.13 -1.93 -0.86 132.00 137.89 1r1n h PRO 137 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1r1n h PRO 137 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1r1n h PRO 137 CO 0.68 0.00 -0.67 0.25 -0.23 0.00 0.00 178.00 178.03 1r1n n THR 138 N -2.97 0.09 -2.98 1.56 -2.24 -1.26 -4.96 114.28 101.52 1r1n n THR 138 Ca -0.02 -0.09 -0.35 0.00 -2.27 0.00 0.00 64.05 61.32 1r1n n THR 138 Cb 0.31 0.25 -0.06 0.00 -2.10 0.00 0.00 70.33 68.73 1r1n n THR 138 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1r1n s SER 139 N -3.37 7.08 0.27 3.42 0.15 -0.33 -4.99 113.70 115.93 1r1n s SER 139 Ca 0.09 1.55 0.12 0.00 0.70 0.00 0.00 55.95 58.41 1r1n s SER 139 Cb 0.16 -2.47 0.30 0.00 -1.71 0.00 0.00 66.02 62.30 1r1n s SER 139 CO 0.74 -0.08 1.57 1.23 1.20 0.00 0.00 173.24 177.90 1r1n h GLY 140 N 3.00 0.00 1.76 9.45 0.00 -1.93 -2.99 103.07 112.36 1r1n h GLY 140 Ca -0.48 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 1r1n h GLY 140 CO 0.65 0.00 -0.24 0.00 0.00 0.00 0.00 176.54 176.94 1r1n h ALA 141 N 1.37 1.30 -0.42 3.60 0.00 -1.94 -1.02 119.26 122.15 1r1n h ALA 141 Ca -0.01 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 1r1n h ALA 141 Cb 1.20 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1r1n h ALA 141 CO 0.08 0.47 -0.19 0.35 0.00 0.00 0.00 179.25 179.96 1r1n h PHE 142 N 0.26 0.93 -0.42 0.00 3.57 -1.81 -2.11 116.94 117.36 1r1n h PHE 142 Ca 0.04 -0.21 -0.02 0.00 3.53 0.00 0.00 57.97 61.32 1r1n h PHE 142 Cb 0.58 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 1r1n h PHE 142 CO 0.01 0.95 0.19 1.25 -2.23 0.00 0.00 178.31 178.48 1r1n h LEU 143 N 0.73 0.56 -1.63 0.59 5.85 -1.21 -1.78 115.31 118.42 1r1n h LEU 143 Ca 0.10 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1r1n h LEU 143 Cb 0.71 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 1r1n h LEU 143 CO 0.05 0.54 0.27 -0.33 -0.34 0.00 0.00 178.44 178.63 1r1n h GLU 144 N 0.54 0.49 0.15 1.25 4.39 -0.91 -1.32 114.58 119.17 1r1n h GLU 144 Ca 0.14 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 1r1n h GLU 144 Cb 0.14 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1r1n h GLU 144 CO -0.02 0.32 -0.07 0.37 -1.16 0.00 0.00 179.01 178.45 1r1n h GLN 145 N 0.50 -0.20 -0.44 2.33 5.75 -0.72 -2.57 115.11 119.75 1r1n h GLN 145 Ca 0.15 0.01 0.09 0.00 -0.15 0.00 0.00 58.65 58.76 1r1n h GLN 145 Cb 0.01 0.05 -0.09 0.00 1.07 0.00 0.00 27.48 28.51 1r1n h GLN 145 CO -0.04 0.09 -0.21 0.82 -2.65 0.00 0.00 178.83 176.84 1r1n h ILE 146 N -0.48 0.38 -0.80 2.39 2.04 -0.61 -1.32 117.51 119.10 1r1n h ILE 146 Ca -0.02 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.93 1r1n h ILE 146 Cb 0.38 0.38 -0.07 0.00 -0.74 0.00 0.00 36.82 36.77 1r1n h ILE 146 CO 0.03 0.00 0.46 0.58 0.00 0.00 0.00 178.15 179.22 1r1n h VAL 147 N -0.12 0.92 -0.49 1.67 2.07 -1.22 -2.29 116.25 116.80 1r1n h VAL 147 Ca 0.21 -0.27 -0.10 0.00 0.82 0.00 0.00 66.70 67.37 1r1n h VAL 147 Cb 0.45 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1r1n h VAL 147 CO -0.52 0.14 -0.07 0.00 0.02 0.00 0.00 177.57 177.14 1r1n h ALA 148 N 1.44 0.66 -0.04 1.67 0.00 -0.90 -1.57 119.26 120.52 1r1n h ALA 148 Ca 0.38 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1r1n h ALA 148 Cb 0.33 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1r1n h ALA 148 CO -0.24 0.53 0.03 0.82 0.00 0.00 0.00 179.25 180.40 1r1n h ILE 149 N 0.76 0.99 -0.00 0.00 2.04 -0.74 0.75 117.51 121.31 1r1n h ILE 149 Ca 0.13 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.94 1r1n h ILE 149 Cb 0.61 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 1r1n h ILE 149 CO 0.04 0.00 -0.16 0.58 0.00 0.00 0.00 178.15 178.61 1r1n h VAL 150 N 0.02 1.58 -0.18 1.67 2.07 -1.08 0.59 116.25 120.92 1r1n h VAL 150 Ca 0.02 -1.91 -0.05 0.00 0.82 0.00 0.00 66.70 65.58 1r1n h VAL 150 Cb 0.05 2.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.62 1r1n h VAL 150 CO -0.00 0.51 -0.12 0.11 0.02 0.00 0.00 177.57 178.09 1r1n h LYS 151 N -0.60 0.29 0.00 1.57 1.57 -0.65 0.71 116.57 119.46 1r1n h LYS 151 Ca -0.02 -0.07 -0.26 0.00 -1.87 0.00 0.00 60.65 58.43 1r1n h LYS 151 Cb 0.93 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.15 1r1n h LYS 151 CO 0.03 0.42 -1.79 1.28 -0.57 0.00 0.00 179.45 178.82 1r1n n LEU 152 N -4.27 0.63 0.00 2.94 4.77 0.26 -4.67 117.00 116.65 1r1n n LEU 152 Ca -0.00 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1r1n n LEU 152 Cb 0.27 0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1r1n n LEU 152 CO 0.38 0.32 0.13 0.29 -1.33 0.00 0.00 177.39 177.19 1r1n n LYS 153 N -2.89 0.06 0.00 3.23 5.02 0.20 -5.04 118.16 118.74 1r1n n LYS 153 Ca -0.18 -0.30 0.00 0.00 -2.02 0.00 0.00 58.31 55.82 1r1n n LYS 153 Cb 0.99 -0.60 0.00 0.00 -0.02 0.00 0.00 35.03 35.40 1r1n n LYS 153 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r1n n GLY 154 N -0.03 0.46 0.10 0.72 0.00 0.25 -4.33 105.19 102.36 1r1n n GLY 154 Ca 0.00 -1.95 -0.11 0.00 0.00 0.00 0.00 46.02 43.96 1r1n n GLY 154 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1r1n h GLU 155 N 0.00 0.16 -0.08 1.61 4.81 -1.88 -3.12 114.58 116.09 1r1n h GLU 155 Ca 0.00 -0.24 -0.05 0.00 -0.13 0.00 0.00 59.36 58.94 1r1n h GLU 155 Cb 0.00 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1r1n h GLU 155 CO 0.00 1.07 -0.20 0.00 -0.73 0.00 0.00 179.01 179.14 1r1n h ALA 156 N 0.84 1.52 0.00 2.92 0.00 -1.97 -2.21 119.26 120.36 1r1n h ALA 156 Ca -0.07 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1r1n h ALA 156 Cb 1.76 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.48 1r1n h ALA 156 CO 0.16 0.35 -0.01 0.00 0.00 0.00 0.00 179.25 179.75 1r1n h ALA 157 N 1.67 0.00 -0.46 0.00 0.00 -1.75 -2.57 119.26 116.15 1r1n h ALA 157 Ca 0.02 -0.42 0.07 0.00 0.00 0.00 0.00 54.91 54.59 1r1n h ALA 157 Cb 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1r1n h ALA 157 CO 0.03 -0.08 0.31 0.00 0.00 0.00 0.00 179.25 179.51 1r1n h ALA 158 N 0.17 2.03 0.00 0.00 0.00 -1.48 -0.65 119.26 119.33 1r1n h ALA 158 Ca -0.00 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 1r1n h ALA 158 Cb 0.84 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1r1n h ALA 158 CO 0.00 -0.13 -0.91 1.25 0.00 0.00 0.00 179.25 179.46 1r1n h LEU 159 N 0.31 0.00 -0.34 0.00 5.85 -1.47 -2.86 115.31 116.80 1r1n h LEU 159 Ca 0.21 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 1r1n h LEU 159 Cb 0.42 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1r1n h LEU 159 CO -0.05 0.84 0.11 0.50 -0.34 0.00 0.00 178.44 179.51 1r1n h LYS 160 N 0.00 0.53 0.88 1.25 3.64 -0.72 -2.28 116.57 119.87 1r1n h LYS 160 Ca -0.03 -0.11 -0.04 0.00 -1.27 0.00 0.00 60.65 59.20 1r1n h LYS 160 Cb 1.67 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.41 1r1n h LYS 160 CO 0.11 0.55 -0.46 2.35 -2.27 0.00 0.00 179.45 179.73 1r1n h TRP 161 N 0.40 -1.19 -0.99 1.91 7.01 -1.37 -1.50 115.95 120.22 1r1n h TRP 161 Ca 0.11 -0.02 0.11 0.00 2.11 0.00 0.00 58.89 61.20 1r1n h TRP 161 Cb 0.24 0.40 -0.08 0.00 -2.10 0.00 0.00 29.16 27.62 1r1n h TRP 161 CO 0.01 -0.72 0.62 -0.07 -2.79 0.00 0.00 178.44 175.49 1r1n h LEU 162 N -1.22 0.92 -1.04 0.65 3.38 -1.53 0.27 115.31 116.73 1r1n h LEU 162 Ca -0.12 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 1r1n h LEU 162 Cb 0.95 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1r1n h LEU 162 CO 0.18 0.50 -0.24 0.11 0.09 0.00 0.00 178.44 179.08 1r1n h LYS 163 N 1.00 0.40 0.16 1.13 1.57 -1.34 0.65 116.57 120.14 1r1n h LYS 163 Ca 0.48 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 59.12 1r1n h LYS 163 Cb 0.45 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1r1n h LYS 163 CO -0.26 0.62 -0.08 0.78 -0.57 0.00 0.00 179.45 179.94 1r1n h GLY 164 N 1.00 -0.23 0.51 3.86 0.00 0.18 -2.61 103.07 105.78 1r1n h GLY 164 Ca 0.06 0.08 0.16 0.00 0.00 0.00 0.00 47.33 47.63 1r1n h GLY 164 CO 0.04 -0.08 0.56 1.41 0.00 0.00 0.00 176.54 178.47 1r1n h LEU 165 N -0.66 0.54 -0.57 3.11 3.38 -0.40 -1.24 115.31 119.46 1r1n h LEU 165 Ca -0.02 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1r1n h LEU 165 Cb 0.48 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1r1n h LEU 165 CO 0.04 0.26 0.16 0.50 0.09 0.00 0.00 178.44 179.49 1r1n h LYS 166 N 0.56 0.90 -0.01 1.13 1.63 -0.72 -2.08 116.57 117.98 1r1n h LYS 166 Ca 0.44 -0.20 0.00 0.00 -0.85 0.00 0.00 60.65 60.03 1r1n h LYS 166 Cb 0.85 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.35 1r1n h LYS 166 CO -0.18 0.82 -0.10 -1.91 -3.45 0.00 0.00 179.45 174.63 1r1n n GLU 167 N -4.41 1.32 0.02 1.90 4.07 -0.63 -4.71 120.64 118.20 1r1n n GLU 167 Ca 0.03 -0.76 0.00 0.00 -0.06 0.00 0.00 57.16 56.36 1r1n n GLU 167 Cb 0.22 -1.48 0.00 0.00 -0.06 0.00 0.00 31.44 30.12 1r1n n GLU 167 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1r1n n TYR 168 N -0.17 -0.23 0.00 4.31 0.53 -0.57 -4.99 117.16 116.05 1r1n n TYR 168 Ca 0.16 0.04 0.00 0.00 -1.02 0.00 0.00 57.90 57.08 1r1n n TYR 168 Cb 0.35 0.15 0.00 0.00 -1.03 0.00 0.00 39.34 38.81 1r1n n TYR 168 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1r1n n GLY 169 N 2.94 -3.21 2.78 2.72 0.00 -0.79 -2.09 105.19 107.53 1r1n n GLY 169 Ca 0.00 -1.07 -0.17 0.00 0.00 0.00 0.00 46.02 44.77 1r1n n GLY 169 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1r1n s LYS 170 N -1.57 0.17 0.09 1.61 2.20 -0.88 -4.61 119.74 116.75 1r1n s LYS 170 Ca 0.00 0.16 -0.30 0.00 -0.36 0.00 0.00 55.97 55.47 1r1n s LYS 170 Cb 0.00 -0.46 -0.05 0.00 -1.51 0.00 0.00 37.83 35.80 1r1n s LYS 170 CO 0.00 -0.19 1.01 -1.25 -0.36 0.00 0.00 175.35 174.56 1r1n s PRO 171 N 1.30 4.62 0.04 4.03 0.04 -1.26 -2.04 135.00 141.73 1r1n s PRO 171 Ca -0.06 1.52 0.08 0.00 0.04 0.00 0.00 61.00 62.59 1r1n s PRO 171 Cb -0.13 -3.38 -0.03 0.00 0.04 0.00 0.00 34.50 31.01 1r1n s PRO 171 CO -0.03 0.08 -0.24 0.71 0.04 0.00 0.00 177.00 177.56 1r1n s TYR 172 N 0.30 2.12 0.13 0.56 2.02 -0.40 -4.97 117.35 117.11 1r1n s TYR 172 Ca 0.50 -0.40 -0.21 0.00 -0.37 0.00 0.00 57.07 56.59 1r1n s TYR 172 Cb -0.24 -1.28 -0.02 0.00 -0.40 0.00 0.00 41.96 40.02 1r1n s TYR 172 CO 0.30 0.09 1.69 0.00 -1.57 0.00 0.00 175.55 176.06 1r1n h ALA 173 N 4.92 0.07 -4.53 3.71 0.00 -1.97 -3.38 119.26 118.08 1r1n h ALA 173 Ca -0.44 0.07 -0.39 0.00 0.00 0.00 0.00 54.91 54.14 1r1n h ALA 173 Cb 1.15 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 19.06 1r1n h ALA 173 CO 0.44 -0.52 -0.32 1.63 0.00 0.00 0.00 179.25 180.49 1r1n n LYS 174 N -5.24 0.84 0.01 0.00 4.76 -1.26 -4.66 118.16 112.61 1r1n n LYS 174 Ca -0.02 -2.37 -0.18 0.00 -2.87 0.00 0.00 58.31 52.87 1r1n n LYS 174 Cb 0.16 1.09 -0.12 0.00 -1.84 0.00 0.00 35.03 34.32 1r1n n LYS 174 CO 0.00 0.00 0.00 -0.91 -1.37 0.00 0.00 177.40 175.12 1r1n h ASN 175 N 1.01 0.49 -0.27 4.39 2.35 -1.98 -3.29 115.58 118.29 1r1n h ASN 175 Ca -0.23 -0.80 -0.08 0.00 -0.55 0.00 0.00 56.30 54.64 1r1n h ASN 175 Cb 0.83 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 39.03 1r1n h ASN 175 CO 0.38 1.23 -0.08 0.77 -1.65 0.00 0.00 177.43 178.08 1r1n h SER 176 N -0.19 0.63 -0.65 5.81 4.64 -1.98 -2.91 113.55 118.91 1r1n h SER 176 Ca -0.08 -0.17 0.05 0.00 -0.47 0.00 0.00 61.79 61.12 1r1n h SER 176 Cb 1.35 -0.17 -0.05 0.00 -0.31 0.00 0.00 62.40 63.22 1r1n h SER 176 CO 0.12 0.76 0.37 0.58 -0.87 0.00 0.00 176.83 177.78 1r1n h VAL 177 N 0.60 1.00 -0.05 0.95 2.07 -1.99 -1.79 116.25 117.05 1r1n h VAL 177 Ca 0.11 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1r1n h VAL 177 Cb 0.50 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1r1n h VAL 177 CO 0.03 0.13 -0.06 0.00 0.02 0.00 0.00 177.57 177.69 1r1n h ALA 178 N 1.32 0.08 -0.80 1.67 0.00 -1.60 -1.90 119.26 118.02 1r1n h ALA 178 Ca 0.28 -0.28 0.15 0.00 0.00 0.00 0.00 54.91 55.06 1r1n h ALA 178 Cb 0.13 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.81 1r1n h ALA 178 CO -0.15 -0.12 0.37 1.25 0.00 0.00 0.00 179.25 180.60 1r1n h LEU 179 N -0.32 0.41 -0.97 0.00 5.85 -1.37 0.42 115.31 119.33 1r1n h LEU 179 Ca 0.01 0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.72 1r1n h LEU 179 Cb 0.57 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1r1n h LEU 179 CO 0.01 0.16 -0.49 -0.61 -0.34 0.00 0.00 178.44 177.17 1r1n h GLN 180 N 0.54 0.05 0.00 1.25 5.75 -1.32 0.20 115.11 121.59 1r1n h GLN 180 Ca 0.44 -0.03 -0.08 0.00 -0.15 0.00 0.00 58.65 58.83 1r1n h GLN 180 Cb 0.65 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.19 1r1n h GLN 180 CO -0.38 0.54 -0.38 0.00 -2.65 0.00 0.00 178.83 175.96 1r1n h ALA 181 N 1.46 1.13 0.05 3.38 0.00 0.54 0.41 119.26 126.22 1r1n h ALA 181 Ca -0.00 -0.34 -0.27 0.00 0.00 0.00 0.00 54.91 54.29 1r1n h ALA 181 Cb 0.89 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1r1n h ALA 181 CO 0.07 0.47 -1.41 0.28 0.00 0.00 0.00 179.25 178.66 1r1n h VAL 182 N 0.00 1.25 0.00 0.00 2.07 -0.16 -0.06 116.25 119.35 1r1n h VAL 182 Ca -0.00 -2.97 -0.05 0.00 0.82 0.00 0.00 66.70 64.50 1r1n h VAL 182 Cb 0.80 2.70 -0.01 0.00 -1.52 0.00 0.00 31.29 33.26 1r1n h VAL 182 CO 0.05 0.78 -0.24 -0.08 0.02 0.00 0.00 177.57 178.11 1r1n h GLU 183 N 0.03 0.00 -0.00 1.57 4.57 -0.09 -2.66 114.58 118.00 1r1n h GLU 183 Ca -0.18 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 1r1n h GLU 183 Cb 1.94 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.53 1r1n h GLU 183 CO 0.13 0.24 -0.27 0.09 -1.18 0.00 0.00 179.01 178.02 1r1n n ASN 184 N -3.26 0.41 -1.10 1.04 3.02 0.14 -4.92 115.26 110.58 1r1n n ASN 184 Ca 0.01 -0.18 -0.05 0.00 -0.03 0.00 0.00 54.58 54.33 1r1n n ASN 184 Cb 0.52 -0.02 0.02 0.00 -0.61 0.00 0.00 39.78 39.68 1r1n n ASN 184 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r1n n GLY 185 N 1.44 0.66 0.00 7.41 0.00 -1.00 -4.96 105.19 108.74 1r1n n GLY 185 Ca 0.08 -0.50 0.08 0.00 0.00 0.00 0.00 46.02 45.68 1r1n n GLY 185 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1r1n n GLU 186 N -1.38 1.51 -3.49 1.61 1.02 -0.04 -4.93 120.64 114.94 1r1n n GLU 186 Ca 0.00 -0.04 0.01 0.00 -0.02 0.00 0.00 57.16 57.11 1r1n n GLU 186 Cb 0.51 -1.27 -0.03 0.00 -0.02 0.00 0.00 31.44 30.62 1r1n n GLU 186 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1r1n s ILE 187 N -2.63 -0.82 0.08 -3.67 -5.25 -1.19 -5.00 121.20 102.72 1r1n s ILE 187 Ca 0.03 0.00 -0.16 0.00 -0.99 0.00 0.00 60.65 59.53 1r1n s ILE 187 Cb 0.11 -1.00 -0.04 0.00 2.95 0.00 0.00 42.46 44.49 1r1n s ILE 187 CO 0.65 0.00 0.85 0.47 -1.79 0.00 0.00 174.94 175.11 1r1n n ASP 188 N 5.31 -0.55 -2.73 4.36 9.92 -0.96 -4.36 116.55 127.54 1r1n n ASP 188 Ca -0.09 0.97 -0.15 0.00 -0.53 0.00 0.00 54.79 54.99 1r1n n ASP 188 Cb 0.51 -0.14 -0.06 0.00 -0.64 0.00 0.00 41.12 40.79 1r1n n ASP 188 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1r1n n ALA 189 N -3.50 0.53 -3.55 2.24 0.00 0.97 -1.63 120.51 115.56 1r1n n ALA 189 Ca 0.01 -1.46 -0.13 0.00 0.00 0.00 0.00 53.44 51.86 1r1n n ALA 189 Cb 0.14 1.16 -0.05 0.00 0.00 0.00 0.00 19.45 20.70 1r1n n ALA 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r1n s ALA 190 N -2.99 -1.87 -0.39 0.00 0.00 -0.89 -1.38 121.76 114.23 1r1n s ALA 190 Ca 0.28 1.46 -0.20 0.00 0.00 0.00 0.00 51.96 53.51 1r1n s ALA 190 Cb 0.01 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.72 1r1n s ALA 190 CO 0.20 -0.35 0.59 -0.51 0.00 0.00 0.00 175.76 175.69 1r1n s LEU 191 N -1.23 4.41 0.00 0.00 2.01 0.18 -0.82 118.68 123.24 1r1n s LEU 191 Ca -0.04 -0.14 0.00 0.00 0.01 0.00 0.00 54.13 53.96 1r1n s LEU 191 Cb -0.00 -2.68 0.00 0.00 0.01 0.00 0.00 46.19 43.52 1r1n s LEU 191 CO 0.03 -0.63 0.00 2.30 1.01 0.00 0.00 176.35 179.07 1r1n n ILE 192 N 5.63 0.00 -4.78 -0.59 -5.35 -0.72 -4.37 119.36 109.19 1r1n n ILE 192 Ca -0.03 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 62.12 1r1n n ILE 192 Cb 0.48 0.00 -0.13 0.00 -1.74 0.00 0.00 39.64 38.26 1r1n n ILE 192 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1r1n s ASN 193 N 1.02 4.23 0.18 7.28 0.01 -1.26 -1.53 114.94 124.87 1r1n s ASN 193 Ca 0.00 -0.17 -0.24 0.00 -0.71 0.00 0.00 52.86 51.74 1r1n s ASN 193 Cb 0.00 -1.12 0.08 0.00 0.41 0.00 0.00 41.25 40.63 1r1n s ASN 193 CO 0.00 0.31 1.56 -0.55 -1.51 0.00 0.00 177.10 176.91 1r1n h ASN 194 N 5.64 -1.49 -0.34 -1.22 -1.07 -1.27 -2.38 115.58 113.45 1r1n h ASN 194 Ca -0.42 0.26 0.10 0.00 0.07 0.00 0.00 56.30 56.31 1r1n h ASN 194 Cb 1.17 0.70 -0.01 0.00 -2.07 0.00 0.00 38.32 38.11 1r1n h ASN 194 CO 0.52 -0.31 0.41 0.10 0.07 0.00 0.00 177.43 178.23 1r1n h TYR 195 N -0.15 0.00 0.00 4.14 -0.00 -1.83 -1.97 116.97 117.16 1r1n h TYR 195 Ca 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 58.73 58.88 1r1n h TYR 195 Cb 0.56 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.27 1r1n h TYR 195 CO -0.76 0.00 -0.34 1.88 -0.00 0.00 0.00 178.16 178.94 1r1n h TYR 196 N 0.00 0.00 0.05 0.10 -1.99 -1.81 -3.17 116.97 110.16 1r1n h TYR 196 Ca 0.16 0.00 -0.30 0.00 2.00 0.00 0.00 58.73 60.59 1r1n h TYR 196 Cb 0.99 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.69 1r1n h TYR 196 CO 0.00 0.34 -1.62 2.35 -0.00 0.00 0.00 178.16 179.23 1r1n h TRP 197 N 0.00 0.20 -0.21 4.88 7.01 -1.51 -3.31 115.95 123.02 1r1n h TRP 197 Ca -0.00 -0.15 -0.06 0.00 2.11 0.00 0.00 58.89 60.79 1r1n h TRP 197 Cb 0.89 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.93 1r1n h TRP 197 CO 0.00 1.23 -0.12 0.45 -2.79 0.00 0.00 178.44 177.22 1r1n h HIS 198 N 0.03 0.35 0.00 2.65 3.86 -1.54 -1.45 115.15 119.04 1r1n h HIS 198 Ca -0.26 -0.04 -0.08 0.00 -1.16 0.00 0.00 60.37 58.83 1r1n h HIS 198 Cb 1.99 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 30.35 1r1n h HIS 198 CO 0.03 0.45 -0.38 0.00 0.86 0.00 0.00 177.93 178.88 1r1n h ALA 199 N 1.57 0.89 0.52 2.45 0.00 -1.69 -2.85 119.26 120.14 1r1n h ALA 199 Ca 0.06 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 1r1n h ALA 199 Cb 0.40 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.14 1r1n h ALA 199 CO 0.02 0.48 -0.25 0.35 0.00 0.00 0.00 179.25 179.85 1r1n h PHE 200 N 0.00 -0.64 0.03 0.00 -0.00 -1.37 -2.80 116.94 112.16 1r1n h PHE 200 Ca -0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.96 1r1n h PHE 200 Cb 1.03 0.21 -0.02 0.00 -0.00 0.00 0.00 35.95 37.18 1r1n h PHE 200 CO 0.00 -0.34 -0.17 0.00 -0.00 0.00 0.00 178.31 177.80 1r1n h ALA 201 N -0.96 -0.69 -0.93 2.41 0.00 -1.44 -1.95 119.26 115.69 1r1n h ALA 201 Ca -0.07 -0.04 0.15 0.00 0.00 0.00 0.00 54.91 54.95 1r1n h ALA 201 Cb 0.59 0.60 -0.15 0.00 0.00 0.00 0.00 17.79 18.83 1r1n h ALA 201 CO 0.12 -0.74 -0.38 -0.09 0.00 0.00 0.00 179.25 178.16 1r1n h ARG 202 N -0.24 -0.02 0.37 0.00 2.43 -1.64 1.63 114.38 116.90 1r1n h ARG 202 Ca -0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1r1n h ARG 202 Cb 0.24 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1r1n h ARG 202 CO -0.10 -0.02 -0.19 1.49 -1.51 0.00 0.00 179.97 179.65 1r1n h GLU 203 N -0.03 -0.50 0.00 0.20 4.22 -1.36 -3.30 114.58 113.82 1r1n h GLU 203 Ca 0.33 0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.80 1r1n h GLU 203 Cb 0.59 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1r1n h GLU 203 CO -0.94 -0.33 -1.01 1.17 -2.18 0.00 0.00 179.01 175.72 1r1n n LYS 204 N -5.32 0.58 0.00 1.92 4.81 -0.74 -5.05 118.16 114.37 1r1n n LYS 204 Ca -0.10 0.11 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 1r1n n LYS 204 Cb 0.23 -1.81 0.00 0.00 0.02 0.00 0.00 35.03 33.47 1r1n n LYS 204 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1r1n n GLY 205 N 1.19 0.62 0.46 3.14 0.00 0.55 -4.71 105.19 106.44 1r1n n GLY 205 Ca 0.00 -0.88 0.39 0.00 0.00 0.00 0.00 46.02 45.53 1r1n n GLY 205 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1r1n h VAL 206 N 0.00 0.03 0.00 1.61 3.04 -1.85 1.16 116.25 120.24 1r1n h VAL 206 Ca 0.00 -0.01 -0.00 0.00 -1.01 0.00 0.00 66.70 65.68 1r1n h VAL 206 Cb 0.00 0.00 -0.00 0.00 -2.01 0.00 0.00 31.29 29.28 1r1n h VAL 206 CO 0.00 0.00 -0.01 -0.61 -1.01 0.00 0.00 177.57 175.94 1r1n h GLN 207 N 0.02 0.00 -0.71 4.17 5.75 -1.91 0.16 115.11 122.59 1r1n h GLN 207 Ca 0.87 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 59.35 1r1n h GLN 207 Cb 2.73 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 31.27 1r1n h GLN 207 CO -0.49 0.01 0.03 0.09 -2.65 0.00 0.00 178.83 175.82 1r1n n ASN 208 N -3.85 4.43 -4.35 -0.69 5.03 0.40 -4.89 115.26 111.34 1r1n n ASN 208 Ca -0.03 -2.71 -0.29 0.00 0.87 0.00 0.00 54.58 52.42 1r1n n ASN 208 Cb 0.09 -0.64 -0.14 0.00 -1.02 0.00 0.00 39.78 38.07 1r1n n ASN 208 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1r1n s VAL 209 N -2.30 2.09 -0.03 2.41 1.01 0.04 -4.98 120.40 118.65 1r1n s VAL 209 Ca 0.40 -1.52 0.00 0.00 0.00 0.00 0.00 61.98 60.86 1r1n s VAL 209 Cb 0.31 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.86 1r1n s VAL 209 CO 0.11 0.21 0.12 1.41 0.00 0.00 0.00 175.10 176.95 1r1n n HIS 210 N 1.40 0.00 -4.08 5.22 8.25 -1.26 -5.01 115.22 119.74 1r1n n HIS 210 Ca -0.18 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 56.94 1r1n n HIS 210 Cb 0.53 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.54 1r1n n HIS 210 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1r1n s THR 211 N -0.84 4.76 0.00 1.59 -1.32 -1.26 -1.22 115.64 117.35 1r1n s THR 211 Ca 0.00 -0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.43 1r1n s THR 211 Cb 0.00 -3.10 0.00 0.00 -1.51 0.00 0.00 72.50 67.89 1r1n s THR 211 CO 0.01 0.51 0.00 0.54 -2.21 0.00 0.00 174.62 173.48 1r1n n ARG 212 N 3.03 3.82 -4.20 7.08 5.12 0.18 -4.92 116.66 126.78 1r1n n ARG 212 Ca -0.17 0.00 -0.17 0.00 -1.93 0.00 0.00 57.85 55.57 1r1n n ARG 212 Cb 0.53 0.00 -0.11 0.00 -1.16 0.00 0.00 32.46 31.72 1r1n n ARG 212 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1r1n s LEU 213 N 0.00 2.36 -0.05 0.55 1.43 -1.26 -2.53 118.68 119.17 1r1n s LEU 213 Ca 0.00 -0.74 0.05 0.00 -1.03 0.00 0.00 54.13 52.41 1r1n s LEU 213 Cb 0.00 -0.47 -0.00 0.00 0.03 0.00 0.00 46.19 45.74 1r1n s LEU 213 CO 0.00 -0.15 -0.19 0.21 0.23 0.00 0.00 176.35 176.45 1r1n s ASN 214 N -2.18 2.38 -0.18 2.29 3.04 -0.56 -4.93 114.94 114.80 1r1n s ASN 214 Ca 0.04 -0.40 0.01 0.00 0.04 0.00 0.00 52.86 52.55 1r1n s ASN 214 Cb -0.06 -0.71 0.03 0.00 -1.54 0.00 0.00 41.25 38.97 1r1n s ASN 214 CO 0.02 0.17 -0.15 -0.36 -3.04 0.00 0.00 177.10 173.73 1r1n s PHE 215 N 0.05 2.58 0.17 0.43 0.40 -1.26 -2.71 117.98 117.63 1r1n s PHE 215 Ca -0.05 -1.59 -0.14 0.00 -0.60 0.00 0.00 56.93 54.55 1r1n s PHE 215 Cb -0.13 -1.77 0.05 0.00 0.51 0.00 0.00 43.02 41.69 1r1n s PHE 215 CO 0.03 -0.76 1.79 -0.39 0.70 0.00 0.00 175.22 176.59 1r1n h VAL 216 N 6.16 1.16 -1.39 -0.44 -1.51 -1.86 -3.48 116.25 114.88 1r1n h VAL 216 Ca -0.37 -0.37 0.00 0.00 -1.23 0.00 0.00 66.70 64.73 1r1n h VAL 216 Cb 1.12 0.48 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 1r1n h VAL 216 CO 0.55 0.17 0.00 0.54 -1.23 0.00 0.00 177.57 177.60 1r1n n ARG 217 N -4.68 0.00 -2.51 5.19 1.74 -1.24 -4.87 116.66 110.29 1r1n n ARG 217 Ca 0.02 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.93 1r1n n ARG 217 Cb 0.06 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.51 1r1n n ARG 217 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1r1n n HIS 218 N -1.28 -1.07 -1.92 -1.55 8.25 -1.24 -2.99 115.22 113.43 1r1n n HIS 218 Ca 0.00 0.15 -0.12 0.00 -0.26 0.00 0.00 57.72 57.49 1r1n n HIS 218 Cb 0.00 -3.53 -0.03 0.00 1.12 0.00 0.00 29.99 27.55 1r1n n HIS 218 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1r1n n ARG 219 N -2.87 -1.79 -1.32 -0.41 3.00 0.45 -4.94 116.66 108.77 1r1n n ARG 219 Ca -0.16 0.62 -0.30 0.00 -0.01 0.00 0.00 57.85 57.99 1r1n n ARG 219 Cb 0.63 -5.03 0.10 0.00 0.00 0.00 0.00 32.46 28.16 1r1n n ARG 219 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1r1n s ASP 220 N -2.00 4.28 0.52 0.55 2.15 -1.16 -4.29 116.67 116.72 1r1n s ASP 220 Ca 0.00 1.61 0.30 0.00 0.43 0.00 0.00 52.55 54.89 1r1n s ASP 220 Cb 0.00 -2.33 1.35 0.00 -0.30 0.00 0.00 42.92 41.64 1r1n s ASP 220 CO 0.00 -2.15 1.99 -0.65 -0.17 0.00 0.00 175.17 174.20 1r1n h PRO 221 N -1.21 0.00 0.00 4.34 0.11 -1.92 -2.30 132.00 131.02 1r1n h PRO 221 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1r1n h PRO 221 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1r1n h PRO 221 CO 0.54 0.10 0.00 0.41 -0.21 0.00 0.00 178.00 178.84 1r1n n GLY 222 N -0.22 -1.16 1.40 -0.55 0.00 -1.26 -2.07 105.19 101.34 1r1n n GLY 222 Ca -0.00 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.07 1r1n n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r1n n ALA 223 N -1.58 3.05 -1.54 4.61 0.00 -0.87 -4.35 120.51 119.84 1r1n n ALA 223 Ca 0.04 -1.34 -0.49 0.00 0.00 0.00 0.00 53.44 51.65 1r1n n ALA 223 Cb 0.22 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 18.60 1r1n n ALA 223 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1r1n n LEU 224 N 0.89 0.85 -3.98 0.00 7.94 -0.88 -4.27 117.00 117.55 1r1n n LEU 224 Ca 0.22 1.15 -0.30 0.00 -1.11 0.00 0.00 56.01 55.97 1r1n n LEU 224 Cb 0.79 -1.15 -0.16 0.00 0.53 0.00 0.00 43.42 43.43 1r1n n LEU 224 CO 0.21 -1.73 -0.47 -0.69 -1.11 0.00 0.00 177.39 173.60 1r1n s VAL 225 N -0.52 1.47 -0.47 1.96 1.01 -1.25 -2.12 120.40 120.48 1r1n s VAL 225 Ca 0.70 -0.69 -0.17 0.00 0.00 0.00 0.00 61.98 61.82 1r1n s VAL 225 Cb -0.88 -1.47 0.05 0.00 0.00 0.00 0.00 36.38 34.09 1r1n s VAL 225 CO 0.55 0.33 0.49 0.42 0.00 0.00 0.00 175.10 176.89 1r1n s THR 226 N 1.51 5.06 0.50 3.92 -4.23 -0.19 -4.79 115.64 117.42 1r1n s THR 226 Ca 0.03 -0.65 -0.06 0.00 -1.18 0.00 0.00 61.69 59.83 1r1n s THR 226 Cb -0.14 -4.17 -0.04 0.00 1.34 0.00 0.00 72.50 69.50 1r1n s THR 226 CO -0.09 -0.62 0.83 -0.31 -0.54 0.00 0.00 174.62 173.88 1r1n s TYR 227 N 2.15 3.57 0.35 3.99 1.51 -1.26 -1.25 117.35 126.42 1r1n s TYR 227 Ca 0.10 0.89 0.08 0.00 -1.01 0.00 0.00 57.07 57.14 1r1n s TYR 227 Cb -0.20 -2.37 -0.05 0.00 -0.11 0.00 0.00 41.96 39.23 1r1n s TYR 227 CO 0.11 -0.34 0.08 -1.12 -1.11 0.00 0.00 175.55 173.16 1r1n s SER 228 N -4.12 4.40 0.36 2.29 0.01 -0.61 -3.85 113.70 112.17 1r1n s SER 228 Ca 0.49 -0.93 -0.15 0.00 1.31 0.00 0.00 55.95 56.67 1r1n s SER 228 Cb -0.10 -0.60 0.06 0.00 0.21 0.00 0.00 66.02 65.59 1r1n s SER 228 CO 0.46 -0.30 0.80 0.61 0.41 0.00 0.00 173.24 175.22 1r1n n GLY 229 N -1.07 0.95 3.31 3.44 0.00 -0.79 -0.65 105.19 110.39 1r1n n GLY 229 Ca -0.03 -1.24 -0.14 0.00 0.00 0.00 0.00 46.02 44.61 1r1n n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r1n s ALA 230 N -2.05 -1.02 0.11 4.61 0.00 -0.95 -0.91 121.76 121.55 1r1n s ALA 230 Ca 0.16 0.98 0.04 0.00 0.00 0.00 0.00 51.96 53.14 1r1n s ALA 230 Cb -0.05 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 1r1n s ALA 230 CO 0.11 -0.23 -0.11 0.00 0.00 0.00 0.00 175.76 175.54 1r1n s ALA 231 N -0.26 1.21 -0.08 0.00 0.00 0.56 -2.66 121.76 120.53 1r1n s ALA 231 Ca -0.04 -1.25 -0.04 0.00 0.00 0.00 0.00 51.96 50.63 1r1n s ALA 231 Cb -0.03 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 1r1n s ALA 231 CO 0.02 -0.03 0.11 0.08 0.00 0.00 0.00 175.76 175.94 1r1n s VAL 232 N -2.54 5.15 0.24 0.00 1.01 -1.26 0.11 120.40 123.11 1r1n s VAL 232 Ca 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.02 1r1n s VAL 232 Cb -0.02 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 1r1n s VAL 232 CO 0.00 0.54 0.45 -0.76 0.00 0.00 0.00 175.10 175.34 1r1n s LEU 233 N -1.21 4.16 0.10 3.92 1.02 -0.39 0.69 118.68 126.97 1r1n s LEU 233 Ca 0.17 0.47 -0.13 0.00 0.02 0.00 0.00 54.13 54.66 1r1n s LEU 233 Cb -0.12 -3.27 -0.12 0.00 0.02 0.00 0.00 46.19 42.70 1r1n s LEU 233 CO 0.07 -0.11 1.35 0.11 0.02 0.00 0.00 176.35 177.79 1r1n h LYS 234 N 1.73 0.79 -0.00 1.70 1.57 -1.75 -3.06 116.57 117.55 1r1n h LYS 234 Ca -0.48 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 57.75 1r1n h LYS 234 Cb 1.20 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.59 1r1n h LYS 234 CO 0.66 1.17 0.00 -1.13 -0.57 0.00 0.00 179.45 179.58 1r1n n SER 235 N -4.05 0.00 -4.70 0.86 3.41 -1.26 -4.78 113.62 103.09 1r1n n SER 235 Ca -0.06 -0.42 -0.30 0.00 -0.26 0.00 0.00 58.87 57.84 1r1n n SER 235 Cb 0.64 -0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.74 1r1n n SER 235 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1r1n s SER 236 N -1.78 3.28 0.00 4.04 0.15 -1.16 -4.89 113.70 113.35 1r1n s SER 236 Ca 0.00 1.47 0.00 0.00 0.70 0.00 0.00 55.95 58.12 1r1n s SER 236 Cb 0.00 -2.15 0.00 0.00 -1.71 0.00 0.00 66.02 62.16 1r1n s SER 236 CO 0.00 -2.75 0.00 0.00 1.20 0.00 0.00 173.24 171.69 1r1n n GLN 237 N -3.96 2.22 -3.19 5.44 1.13 -1.26 -4.86 117.38 112.90 1r1n n GLN 237 Ca 0.07 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.80 1r1n n GLN 237 Cb 0.55 -0.74 -0.04 0.00 0.11 0.00 0.00 30.24 30.12 1r1n n GLN 237 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1r1n n ASN 238 N -1.11 4.92 0.15 1.08 4.13 -1.26 -4.82 115.26 118.35 1r1n n ASN 238 Ca 0.00 -3.48 0.04 0.00 1.68 0.00 0.00 54.58 52.83 1r1n n ASN 238 Cb 0.18 -0.88 0.05 0.00 -1.54 0.00 0.00 39.78 37.59 1r1n n ASN 238 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1r1n h LYS 239 N 4.45 0.00 -0.55 3.52 1.57 -1.96 -0.64 116.57 122.96 1r1n h LYS 239 Ca 0.21 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.90 1r1n h LYS 239 Cb 0.61 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 1r1n h LYS 239 CO 1.02 0.37 -0.04 0.22 -0.57 0.00 0.00 179.45 180.46 1r1n h ASP 240 N 0.00 0.98 0.57 0.86 -0.00 -1.99 -1.92 116.42 114.92 1r1n h ASP 240 Ca -0.01 -0.32 -0.22 0.00 -0.00 0.00 0.00 57.03 56.47 1r1n h ASP 240 Cb 1.31 -0.27 -0.04 0.00 -0.00 0.00 0.00 39.33 40.34 1r1n h ASP 240 CO 0.05 1.07 -1.59 -1.84 -0.00 0.00 0.00 179.24 176.93 1r1n n GLU 241 N -4.22 0.63 -0.07 0.28 0.28 -1.23 -2.89 120.64 113.42 1r1n n GLU 241 Ca 0.02 0.23 -0.14 0.00 -0.16 0.00 0.00 57.16 57.11 1r1n n GLU 241 Cb 0.36 -1.78 -0.05 0.00 1.43 0.00 0.00 31.44 31.39 1r1n n GLU 241 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1r1n h ALA 242 N 1.25 0.37 -0.18 -1.84 0.00 -1.13 0.55 119.26 118.28 1r1n h ALA 242 Ca -0.23 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.11 1r1n h ALA 242 Cb 1.77 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 1r1n h ALA 242 CO 0.06 0.46 -0.41 0.87 0.00 0.00 0.00 179.25 180.23 1r1n h LYS 243 N 0.40 0.41 0.00 0.00 1.57 -1.50 0.24 116.57 117.68 1r1n h LYS 243 Ca 0.02 -0.20 -0.10 0.00 -1.87 0.00 0.00 60.65 58.50 1r1n h LYS 243 Cb 0.98 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 1r1n h LYS 243 CO 0.09 0.75 -0.47 -0.22 -0.57 0.00 0.00 179.45 179.03 1r1n h LYS 244 N 0.34 0.00 0.12 3.15 3.64 -1.38 0.98 116.57 123.42 1r1n h LYS 244 Ca 0.03 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1r1n h LYS 244 Cb 0.87 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1r1n h LYS 244 CO 0.07 0.47 -0.06 0.35 -2.27 0.00 0.00 179.45 178.01 1r1n h PHE 245 N 0.00 -0.15 0.00 1.91 3.57 0.93 0.34 116.94 123.54 1r1n h PHE 245 Ca -0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1r1n h PHE 245 Cb 1.03 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.82 1r1n h PHE 245 CO 0.00 0.35 0.00 0.28 -2.23 0.00 0.00 178.31 176.71 1r1n h VAL 246 N -0.84 0.00 0.00 1.41 2.07 -0.49 0.61 116.25 119.01 1r1n h VAL 246 Ca -0.02 -0.14 -0.23 0.00 0.82 0.00 0.00 66.70 67.13 1r1n h VAL 246 Cb 0.56 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.36 1r1n h VAL 246 CO 0.03 0.00 -1.22 0.00 0.02 0.00 0.00 177.57 176.40 1r1n h ALA 247 N 2.01 0.52 -0.07 1.67 0.00 -0.66 -3.07 119.26 119.65 1r1n h ALA 247 Ca 0.00 -1.07 -0.04 0.00 0.00 0.00 0.00 54.91 53.80 1r1n h ALA 247 Cb 0.15 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1r1n h ALA 247 CO 0.00 1.32 -0.13 0.35 0.00 0.00 0.00 179.25 180.79 1r1n h PHE 248 N 0.00 0.27 0.00 0.00 3.57 0.41 -0.51 116.94 120.68 1r1n h PHE 248 Ca -0.10 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.30 1r1n h PHE 248 Cb 1.82 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.51 1r1n h PHE 248 CO 0.00 0.72 0.00 -0.07 -2.23 0.00 0.00 178.31 176.73 1r1n h LEU 249 N -0.25 0.00 0.00 0.59 3.38 -0.25 -1.15 115.31 117.62 1r1n h LEU 249 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1r1n h LEU 249 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1r1n h LEU 249 CO 0.03 0.00 -1.25 0.00 0.09 0.00 0.00 178.44 177.31 1r1n n ALA 250 N -1.85 3.73 -1.95 1.53 0.00 -1.11 -4.27 120.51 116.59 1r1n n ALA 250 Ca -0.01 -0.49 -0.29 0.00 0.00 0.00 0.00 53.44 52.66 1r1n n ALA 250 Cb 0.11 -0.66 0.18 0.00 0.00 0.00 0.00 19.45 19.09 1r1n n ALA 250 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1r1n s GLY 251 N -3.28 1.79 0.19 0.00 0.00 -0.21 -4.60 107.32 101.21 1r1n s GLY 251 Ca 0.02 -1.39 -0.10 0.00 0.00 0.00 0.00 44.72 43.25 1r1n s GLY 251 CO 0.76 -0.63 1.71 0.50 0.00 0.00 0.00 173.10 175.45 1r1n h LYS 252 N -1.47 1.05 0.00 2.90 1.57 -1.90 -2.12 116.57 116.60 1r1n h LYS 252 Ca -0.42 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.12 1r1n h LYS 252 Cb 1.23 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1r1n h LYS 252 CO 0.35 0.93 0.00 0.93 -0.57 0.00 0.00 179.45 181.09 1r1n h GLU 253 N 0.98 0.00 0.18 3.15 4.39 -1.94 -2.85 114.58 118.49 1r1n h GLU 253 Ca 0.21 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.58 1r1n h GLU 253 Cb 0.33 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1r1n h GLU 253 CO -0.00 0.00 -1.60 0.78 -1.16 0.00 0.00 179.01 177.03 1r1n h GLY 254 N 4.14 0.44 0.85 -3.84 0.00 -1.53 -3.08 103.07 100.06 1r1n h GLY 254 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 47.33 46.20 1r1n h GLY 254 CO 0.00 0.99 -0.11 1.46 0.00 0.00 0.00 176.54 178.88 1r1n h GLN 255 N 0.01 -0.24 -0.42 4.80 1.08 -1.43 -2.98 115.11 115.93 1r1n h GLN 255 Ca -0.31 0.02 0.05 0.00 -1.45 0.00 0.00 58.65 56.96 1r1n h GLN 255 Cb 2.02 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 29.46 1r1n h GLN 255 CO 0.17 -0.16 0.14 0.00 -0.95 0.00 0.00 178.83 178.03 1r1n h ARG 256 N -0.25 0.29 -0.22 1.46 3.08 -1.64 0.11 114.38 117.21 1r1n h ARG 256 Ca 0.01 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.10 1r1n h ARG 256 Cb 0.24 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 1r1n h ARG 256 CO -0.04 0.19 0.31 0.00 -1.07 0.00 0.00 179.97 179.37 1r1n h ALA 257 N 1.28 1.78 0.00 0.04 0.00 -1.42 -2.01 119.26 118.92 1r1n h ALA 257 Ca 0.20 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.88 1r1n h ALA 257 Cb 0.19 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1r1n h ALA 257 CO -0.21 -0.42 -1.31 -0.11 0.00 0.00 0.00 179.25 177.20 1r1n n LEU 258 N -3.54 1.87 -0.23 0.00 7.94 -0.40 -4.27 117.00 118.38 1r1n n LEU 258 Ca 0.03 0.44 0.00 0.00 -1.11 0.00 0.00 56.01 55.37 1r1n n LEU 258 Cb 0.43 -0.93 0.00 0.00 0.53 0.00 0.00 43.42 43.46 1r1n n LEU 258 CO 0.24 0.18 0.22 1.07 -1.11 0.00 0.00 177.39 177.99 1r1n n THR 259 N -4.44 0.00 0.08 1.96 5.66 0.26 -0.23 114.28 117.57 1r1n n THR 259 Ca -0.31 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 60.70 1r1n n THR 259 Cb 0.64 -0.25 0.00 0.00 -1.55 0.00 0.00 70.33 69.18 1r1n n THR 259 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1r1n n ALA 260 N -0.18 2.45 0.00 1.79 0.00 -0.80 0.19 120.51 123.96 1r1n n ALA 260 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1r1n n ALA 260 Cb 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1r1n n ALA 260 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1r1n n VAL 261 N -0.08 0.00 -4.42 0.00 0.31 -0.51 -4.89 118.33 108.74 1r1n n VAL 261 Ca 0.01 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.08 1r1n n VAL 261 Cb 0.04 0.07 -0.17 0.00 -0.91 0.00 0.00 33.84 32.88 1r1n n VAL 261 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1r1n s ARG 262 N -0.72 1.77 0.00 5.55 6.06 0.68 -4.90 118.95 127.39 1r1n s ARG 262 Ca 0.00 -0.41 -0.01 0.00 -2.50 0.00 0.00 55.73 52.81 1r1n s ARG 262 Cb 0.00 -1.54 -0.03 0.00 0.06 0.00 0.00 34.95 33.44 1r1n s ARG 262 CO 0.00 -0.05 1.29 0.00 -2.50 0.00 0.00 175.30 174.04 1r1n n ALA 263 N 4.13 3.06 -2.64 6.12 0.00 -1.26 -4.22 120.51 125.69 1r1n n ALA 263 Ca -0.20 -0.18 -0.39 0.00 0.00 0.00 0.00 53.44 52.67 1r1n n ALA 263 Cb 0.51 -1.60 -0.08 0.00 0.00 0.00 0.00 19.45 18.28 1r1n n ALA 263 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1r1n s GLU 264 N 1.09 4.12 0.27 0.00 2.56 -1.26 -4.39 118.70 121.08 1r1n s GLU 264 Ca 0.07 0.21 -0.30 0.00 0.00 0.00 0.00 54.97 54.95 1r1n s GLU 264 Cb 0.03 -3.59 -0.11 0.00 2.00 0.00 0.00 34.13 32.46 1r1n s GLU 264 CO 0.00 -0.17 1.60 0.71 -0.56 0.00 0.00 175.26 176.83 1r1n s TYR 265 N 1.73 2.81 0.22 5.30 1.51 -0.55 -4.67 117.35 123.71 1r1n s TYR 265 Ca 0.19 0.74 -0.28 0.00 -1.01 0.00 0.00 57.07 56.71 1r1n s TYR 265 Cb -0.15 -4.05 -0.09 0.00 -0.11 0.00 0.00 41.96 37.56 1r1n s TYR 265 CO 0.09 -3.59 0.87 -2.14 -1.11 0.00 0.00 175.55 169.67 1r1n s PRO 266 N -0.18 4.71 0.09 -1.71 0.02 -1.26 -1.24 135.00 135.43 1r1n s PRO 266 Ca 0.65 1.33 0.21 0.00 0.02 0.00 0.00 61.00 63.21 1r1n s PRO 266 Cb -0.47 -3.22 -0.15 0.00 0.02 0.00 0.00 34.50 30.68 1r1n s PRO 266 CO 0.44 0.51 0.78 1.28 -0.33 0.00 0.00 177.00 179.68 1r1n n LEU 267 N 1.42 0.52 -4.60 -5.54 4.77 -1.26 -4.60 117.00 107.70 1r1n n LEU 267 Ca -0.03 0.21 -0.43 0.00 -0.03 0.00 0.00 56.01 55.73 1r1n n LEU 267 Cb 0.48 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1r1n n LEU 267 CO 0.48 -0.05 0.90 0.21 -1.33 0.00 0.00 177.39 177.60 1r1n s ASN 268 N -5.12 6.66 0.00 -1.43 2.47 -1.26 -4.61 114.94 111.64 1r1n s ASN 268 Ca -0.04 0.50 0.02 0.00 0.42 0.00 0.00 52.86 53.77 1r1n s ASN 268 Cb 0.11 -2.51 0.12 0.00 -1.45 0.00 0.00 41.25 37.52 1r1n s ASN 268 CO 0.84 -1.07 0.84 -0.81 -3.72 0.00 0.00 177.10 173.17 1r1n n PRO 269 N 7.33 0.04 -1.20 0.43 -0.04 -1.26 -2.76 135.00 137.54 1r1n n PRO 269 Ca 0.10 0.22 -0.23 0.00 -0.04 0.00 0.00 63.50 63.55 1r1n n PRO 269 Cb 0.48 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.61 1r1n n PRO 269 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1r1n n HIS 270 N -1.23 2.76 -4.30 0.54 8.25 -1.26 -4.95 115.22 115.02 1r1n n HIS 270 Ca 0.01 -2.03 -0.18 0.00 -0.26 0.00 0.00 57.72 55.26 1r1n n HIS 270 Cb 0.02 -0.94 -0.15 0.00 1.12 0.00 0.00 29.99 30.03 1r1n n HIS 270 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1r1n s VAL 271 N -3.60 0.63 -0.27 1.59 1.01 -1.11 -4.91 120.40 113.74 1r1n s VAL 271 Ca 0.56 -0.30 -0.08 0.00 0.00 0.00 0.00 61.98 62.16 1r1n s VAL 271 Cb 0.47 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 36.28 1r1n s VAL 271 CO 0.07 0.19 0.10 -0.69 0.00 0.00 0.00 175.10 174.77 1r1n s VAL 272 N 0.05 4.40 0.30 2.92 1.01 -1.26 -4.99 120.40 122.84 1r1n s VAL 272 Ca -0.00 -0.30 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 1r1n s VAL 272 Cb -0.06 -3.14 -0.11 0.00 0.00 0.00 0.00 36.38 33.07 1r1n s VAL 272 CO -0.00 0.22 1.51 -0.55 0.00 0.00 0.00 175.10 176.28 1r1n s SER 273 N 1.61 6.46 0.00 3.32 0.15 -1.26 -4.85 113.70 119.13 1r1n s SER 273 Ca 0.05 2.89 0.27 0.00 0.70 0.00 0.00 55.95 59.86 1r1n s SER 273 Cb -0.16 -2.64 1.51 0.00 -1.71 0.00 0.00 66.02 63.02 1r1n s SER 273 CO 0.05 -0.83 1.95 0.41 1.20 0.00 0.00 173.24 176.02 1r1n n THR 274 N 1.75 0.07 -4.23 6.45 -1.04 0.13 -4.60 114.28 112.81 1r1n n THR 274 Ca 0.06 0.02 -0.23 0.00 -2.04 0.00 0.00 64.05 61.86 1r1n n THR 274 Cb 0.39 -0.58 -0.06 0.00 -1.82 0.00 0.00 70.33 68.25 1r1n n THR 274 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1r1n s PHE 275 N -2.26 2.79 -1.21 -1.42 0.40 -1.25 -4.99 117.98 110.04 1r1n s PHE 275 Ca 0.34 -0.21 -0.19 0.00 -0.60 0.00 0.00 56.93 56.27 1r1n s PHE 275 Cb 0.18 -1.29 0.08 0.00 0.51 0.00 0.00 43.02 42.50 1r1n s PHE 275 CO 0.36 0.57 1.61 -0.80 0.70 0.00 0.00 175.22 177.66 1r1n s ASN 276 N -3.73 6.77 -0.14 1.36 0.01 -1.26 -4.92 114.94 113.03 1r1n s ASN 276 Ca 0.32 -2.24 0.01 0.00 -0.71 0.00 0.00 52.86 50.25 1r1n s ASN 276 Cb -0.06 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 39.05 1r1n s ASN 276 CO 0.21 -1.21 -0.18 -0.76 -1.51 0.00 0.00 177.10 173.66 1r1n s LEU 277 N 4.09 2.34 0.79 0.60 1.43 -1.26 -5.13 118.68 121.54 1r1n s LEU 277 Ca 0.50 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 1r1n s LEU 277 Cb 0.02 -1.52 0.06 0.00 0.03 0.00 0.00 46.19 44.79 1r1n s LEU 277 CO 0.02 0.10 1.14 -1.83 0.23 0.00 0.00 176.35 176.01 1r1n s GLU 278 N 0.74 2.16 0.22 1.70 -1.05 -1.26 -4.71 118.70 116.50 1r1n s GLU 278 Ca -0.08 0.27 -0.32 0.00 -0.15 0.00 0.00 54.97 54.70 1r1n s GLU 278 Cb -0.16 -1.96 -0.14 0.00 -0.44 0.00 0.00 34.13 31.44 1r1n s GLU 278 CO 0.01 -1.49 1.44 -2.30 0.95 0.00 0.00 175.26 173.86 1r1n n PRO 279 N -3.28 2.03 -0.31 -4.83 -0.02 -1.26 -4.83 135.00 122.49 1r1n n PRO 279 Ca 0.07 0.72 0.13 0.00 -2.02 0.00 0.00 63.50 62.40 1r1n n PRO 279 Cb 0.59 -2.40 0.30 0.00 -0.02 0.00 0.00 33.50 31.98 1r1n n PRO 279 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1r1n h ILE 280 N 3.16 0.56 -0.81 4.25 2.04 -1.93 0.43 117.51 125.21 1r1n h ILE 280 Ca -0.45 -0.18 0.24 0.00 1.00 0.00 0.00 64.86 65.47 1r1n h ILE 280 Cb 1.27 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 1r1n h ILE 280 CO 0.78 0.09 0.59 0.00 0.00 0.00 0.00 178.15 179.61 1r1n h ALA 281 N 1.67 2.76 0.00 1.87 0.00 -1.94 0.71 119.26 124.34 1r1n h ALA 281 Ca 0.56 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.43 1r1n h ALA 281 Cb 0.99 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1r1n h ALA 281 CO -0.47 -1.01 -0.03 0.87 0.00 0.00 0.00 179.25 178.61 1r1n h LYS 282 N 0.00 0.00 0.00 0.00 1.79 -0.47 -2.82 116.57 115.08 1r1n h LYS 282 Ca 0.39 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.81 1r1n h LYS 282 Cb 1.56 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.20 1r1n h LYS 282 CO -0.00 0.03 -0.22 -0.07 -1.08 0.00 0.00 179.45 178.11 1r1n h LEU 283 N 0.00 0.00 -2.08 2.94 3.38 0.45 -3.47 115.31 116.53 1r1n h LEU 283 Ca -0.00 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.55 1r1n h LEU 283 Cb 0.77 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.58 1r1n h LEU 283 CO 0.00 0.22 -0.86 -0.62 0.09 0.00 0.00 178.44 177.27 1r1n n GLU 284 N -3.69 -3.92 -1.96 1.13 1.02 -1.06 -3.67 120.64 108.48 1r1n n GLU 284 Ca -0.01 0.59 -0.36 0.00 -0.02 0.00 0.00 57.16 57.35 1r1n n GLU 284 Cb 0.34 -4.98 0.04 0.00 -0.02 0.00 0.00 31.44 26.82 1r1n n GLU 284 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1r1n s ALA 285 N -3.65 2.51 -0.11 0.62 0.00 -1.26 -0.41 121.76 119.46 1r1n s ALA 285 Ca 0.11 1.03 -0.30 0.00 0.00 0.00 0.00 51.96 52.80 1r1n s ALA 285 Cb -0.03 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 1r1n s ALA 285 CO 0.82 -1.24 1.04 -1.25 0.00 0.00 0.00 175.76 175.13 1r1n s PRO 286 N -3.36 4.40 -0.71 0.00 0.04 -1.26 -4.59 135.00 129.52 1r1n s PRO 286 Ca 0.78 1.43 -0.26 0.00 0.04 0.00 0.00 61.00 62.99 1r1n s PRO 286 Cb -0.31 -3.55 -0.09 0.00 0.04 0.00 0.00 34.50 30.59 1r1n s PRO 286 CO 0.34 -0.36 2.25 -1.14 0.04 0.00 0.00 177.00 178.13 1r1n s GLN 287 N 2.15 2.05 -0.06 4.56 2.00 -1.26 -4.82 119.66 124.28 1r1n s GLN 287 Ca 0.49 0.61 0.04 0.00 -2.00 0.00 0.00 55.36 54.50 1r1n s GLN 287 Cb -0.19 -4.73 -0.02 0.00 0.80 0.00 0.00 33.01 28.87 1r1n s GLN 287 CO 0.17 -3.71 -0.17 0.08 -0.50 0.00 0.00 175.29 171.17 1r1n s VAL 288 N 12.46 2.79 0.60 1.34 1.01 -1.26 -5.03 120.40 132.30 1r1n s VAL 288 Ca 0.86 -0.81 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 1r1n s VAL 288 Cb -0.13 -2.08 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 1r1n s VAL 288 CO 0.13 0.58 1.02 -0.94 0.00 0.00 0.00 175.10 175.89 1r1n s SER 289 N -0.48 6.30 0.95 3.32 1.04 -1.26 -5.01 113.70 118.56 1r1n s SER 289 Ca 0.06 1.45 -0.15 0.00 0.48 0.00 0.00 55.95 57.79 1r1n s SER 289 Cb -0.12 -2.48 -0.07 0.00 0.10 0.00 0.00 66.02 63.45 1r1n s SER 289 CO 0.01 -0.82 -0.26 0.00 0.98 0.00 0.00 173.24 173.16 1r1n n ALA 290 N -2.52 -4.13 -2.42 5.32 0.00 -1.26 -4.94 120.51 110.56 1r1n n ALA 290 Ca 0.06 -0.61 -0.38 0.00 0.00 0.00 0.00 53.44 52.51 1r1n n ALA 290 Cb 0.54 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.50 1r1n n ALA 290 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1r1n s THR 291 N -2.15 4.91 0.24 0.00 2.01 -1.26 -5.06 115.64 114.34 1r1n s THR 291 Ca 0.48 1.02 0.08 0.00 0.31 0.00 0.00 61.69 63.58 1r1n s THR 291 Cb -0.21 -3.80 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 1r1n s THR 291 CO 0.75 0.55 0.08 0.42 -0.69 0.00 0.00 174.62 175.72 1r1n s THR 292 N -0.94 3.92 0.21 -0.82 -4.23 -1.26 -4.69 115.64 107.83 1r1n s THR 292 Ca 0.26 -1.59 -0.08 0.00 -1.18 0.00 0.00 61.69 59.11 1r1n s THR 292 Cb -0.18 -3.07 0.14 0.00 1.34 0.00 0.00 72.50 70.73 1r1n s THR 292 CO 0.16 -0.30 1.75 0.58 -0.54 0.00 0.00 174.62 176.27 1r1n h VAL 293 N 1.87 1.26 0.00 2.29 2.07 -1.99 -1.24 116.25 120.51 1r1n h VAL 293 Ca -0.46 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.16 1r1n h VAL 293 Cb 1.23 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 1r1n h VAL 293 CO 0.60 0.36 0.00 0.28 0.02 0.00 0.00 177.57 178.83 1r1n h SER 294 N 1.13 0.00 0.50 0.57 0.02 -1.99 -1.49 113.55 112.30 1r1n h SER 294 Ca 0.25 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.98 1r1n h SER 294 Cb 0.29 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 1r1n h SER 294 CO -0.01 0.00 -0.97 -0.33 -1.14 0.00 0.00 176.83 174.38 1r1n h GLU 295 N 0.00 0.29 0.32 3.45 5.08 -1.68 -2.23 114.58 119.81 1r1n h GLU 295 Ca 0.00 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.00 1r1n h GLU 295 Cb 0.54 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1r1n h GLU 295 CO 0.00 1.06 -0.15 0.87 -1.00 0.00 0.00 179.01 179.79 1r1n h LYS 296 N 0.15 -0.41 -1.00 2.33 6.56 -0.40 -1.72 116.57 122.07 1r1n h LYS 296 Ca -0.07 0.03 0.21 0.00 -1.06 0.00 0.00 60.65 59.76 1r1n h LYS 296 Cb 1.62 0.09 -0.11 0.00 -0.57 0.00 0.00 32.23 33.27 1r1n h LYS 296 CO 0.16 -0.09 0.62 1.49 -2.06 0.00 0.00 179.45 179.56 1r1n h GLU 297 N -0.81 0.63 -0.21 3.15 4.57 -1.36 0.24 114.58 120.78 1r1n h GLU 297 Ca -0.04 -0.04 -0.13 0.00 -1.18 0.00 0.00 59.36 57.97 1r1n h GLU 297 Cb 0.52 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 28.97 1r1n h GLU 297 CO 0.07 0.41 -0.36 1.25 -1.18 0.00 0.00 179.01 179.21 1r1n h HIS 298 N 0.65 0.77 0.00 0.92 2.76 -1.33 -2.42 115.15 116.50 1r1n h HIS 298 Ca 0.59 -0.27 -0.07 0.00 -2.20 0.00 0.00 60.37 58.42 1r1n h HIS 298 Cb 1.08 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.88 1r1n h HIS 298 CO -0.00 1.01 -0.33 0.00 -1.30 0.00 0.00 177.93 177.31 1r1n h ALA 299 N 0.62 1.14 -0.00 5.26 0.00 -0.28 -1.76 119.26 124.25 1r1n h ALA 299 Ca 0.02 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.45 1r1n h ALA 299 Cb 0.95 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1r1n h ALA 299 CO 0.08 0.41 -0.80 1.15 0.00 0.00 0.00 179.25 180.09 1r1n h THR 300 N 0.00 1.53 -0.37 0.00 2.02 -0.97 -2.44 112.91 112.68 1r1n h THR 300 Ca -0.00 -2.63 -0.07 0.00 0.77 0.00 0.00 66.41 64.47 1r1n h THR 300 Cb 0.73 2.43 -0.01 0.00 -1.74 0.00 0.00 68.15 69.57 1r1n h THR 300 CO 0.04 0.76 -0.05 -0.09 0.37 0.00 0.00 175.52 176.56 1r1n h ARG 301 N 0.04 0.68 0.00 6.66 9.65 -0.86 -1.38 114.38 129.17 1r1n h ARG 301 Ca -0.02 -0.24 -0.03 0.00 -1.10 0.00 0.00 59.98 58.59 1r1n h ARG 301 Cb 1.41 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 29.94 1r1n h ARG 301 CO 0.11 0.81 -0.14 -0.07 2.80 0.00 0.00 179.97 183.48 1r1n h LEU 302 N 0.48 0.00 0.25 3.80 3.38 -1.23 0.37 115.31 122.36 1r1n h LEU 302 Ca 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1r1n h LEU 302 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1r1n h LEU 302 CO 0.03 0.14 -0.12 -0.07 0.09 0.00 0.00 178.44 178.50 1r1n h LEU 303 N 0.00 -0.29 -0.12 1.67 3.38 -0.96 0.48 115.31 119.47 1r1n h LEU 303 Ca -0.00 -0.19 0.04 0.00 0.09 0.00 0.00 57.88 57.82 1r1n h LEU 303 Cb 0.27 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 1r1n h LEU 303 CO 0.02 0.21 -0.14 -0.33 0.09 0.00 0.00 178.44 178.29 1r1n h GLU 304 N -0.98 -0.17 0.00 1.13 5.08 -1.09 0.12 114.58 118.67 1r1n h GLU 304 Ca -0.03 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1r1n h GLU 304 Cb 0.46 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1r1n h GLU 304 CO 0.06 -0.12 0.11 0.37 -1.00 0.00 0.00 179.01 178.43 1r1n h GLN 305 N -0.18 0.00 0.00 2.33 4.15 -0.31 -0.05 115.11 121.06 1r1n h GLN 305 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1r1n h GLN 305 Cb 0.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.00 1r1n h GLN 305 CO -0.22 0.00 -1.54 0.00 -1.93 0.00 0.00 178.83 175.13 1r1n n ALA 306 N -1.96 3.18 0.00 3.38 0.00 0.21 -4.98 120.51 120.34 1r1n n ALA 306 Ca -0.02 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1r1n n ALA 306 Cb 0.17 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1r1n n ALA 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r1n n GLY 307 N 1.31 0.73 2.05 0.00 0.00 0.03 -4.71 105.19 104.59 1r1n n GLY 307 Ca -0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 1r1n n GLY 307 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1r1n n MET 308 N -1.27 2.14 0.00 1.61 2.81 -0.42 -4.98 117.12 117.01 1r1n n MET 308 Ca 0.00 -2.37 0.00 0.00 -1.81 0.00 0.00 57.70 53.52 1r1n n MET 308 Cb 0.00 -1.93 0.00 0.00 -0.71 0.00 0.00 33.22 30.58 1r1n n MET 308 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65