#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rli s ILE 3 N 0.00 3.16 -0.03 3.15 1.01 -1.26 -0.20 121.20 127.03 1rli s ILE 3 Ca 0.00 -0.84 0.04 0.00 0.00 0.00 0.00 60.65 59.85 1rli s ILE 3 Cb 0.00 -2.30 -0.00 0.00 0.01 0.00 0.00 42.46 40.17 1rli s ILE 3 CO 0.00 0.48 -0.13 0.00 0.00 0.00 0.00 174.94 175.29 1rli s ALA 4 N -0.85 1.18 -0.24 9.38 0.00 0.06 -0.36 121.76 130.93 1rli s ALA 4 Ca 0.14 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.54 1rli s ALA 4 Cb -0.11 -0.37 0.03 0.00 0.00 0.00 0.00 23.12 22.67 1rli s ALA 4 CO 0.03 0.24 -0.07 0.08 0.00 0.00 0.00 175.76 176.04 1rli s VAL 5 N -0.05 2.82 -0.45 0.00 1.01 -0.42 -0.03 120.40 123.27 1rli s VAL 5 Ca -0.00 -1.03 -0.16 0.00 0.00 0.00 0.00 61.98 60.79 1rli s VAL 5 Cb -0.08 -2.42 0.04 0.00 0.00 0.00 0.00 36.38 33.92 1rli s VAL 5 CO 0.01 0.21 0.42 -0.63 0.00 0.00 0.00 175.10 175.11 1rli s ILE 6 N 1.32 5.15 -0.36 2.22 1.01 0.11 -1.10 121.20 129.54 1rli s ILE 6 Ca 0.00 -0.69 -0.14 0.00 0.00 0.00 0.00 60.65 59.83 1rli s ILE 6 Cb -0.16 -4.08 -0.01 0.00 0.01 0.00 0.00 42.46 38.22 1rli s ILE 6 CO -0.05 -0.50 0.27 0.21 0.00 0.00 0.00 174.94 174.86 1rli s ASN 7 N 2.17 6.08 -0.15 3.58 3.84 0.27 -0.80 114.94 129.94 1rli s ASN 7 Ca 0.08 -0.55 0.17 0.00 0.21 0.00 0.00 52.86 52.77 1rli s ASN 7 Cb -0.20 -2.15 0.73 0.00 -0.55 0.00 0.00 41.25 39.08 1rli s ASN 7 CO 0.10 -0.30 1.64 0.61 -2.79 0.00 0.00 177.10 176.36 1rli n GLY 8 N 5.11 2.92 0.00 1.21 0.00 0.26 -2.19 105.19 112.51 1rli n GLY 8 Ca -0.12 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1rli n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rli n GLY 9 N 0.86 2.58 3.53 -0.02 0.00 -1.26 -4.62 105.19 106.25 1rli n GLY 9 Ca 0.26 -1.86 -0.34 0.00 0.00 0.00 0.00 46.02 44.08 1rli n GLY 9 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rli s THR 10 N 3.06 3.85 0.97 2.61 2.01 -1.26 -4.92 115.64 121.97 1rli s THR 10 Ca 0.00 -0.39 -0.15 0.00 0.31 0.00 0.00 61.69 61.46 1rli s THR 10 Cb 0.00 -2.65 0.19 0.00 0.01 0.00 0.00 72.50 70.04 1rli s THR 10 CO 0.00 0.53 1.25 -0.13 -0.69 0.00 0.00 174.62 175.57 1rli s ARG 11 N -0.02 0.60 0.00 4.92 0.52 -1.26 -4.15 118.95 119.56 1rli s ARG 11 Ca 0.01 -0.19 0.00 0.00 -0.52 0.00 0.00 55.73 55.03 1rli s ARG 11 Cb -0.13 -1.82 0.00 0.00 0.52 0.00 0.00 34.95 33.52 1rli s ARG 11 CO 0.03 -2.47 0.00 0.43 0.02 0.00 0.00 175.30 173.30 1rli n SER 12 N -3.86 -3.54 0.00 0.23 7.64 -1.26 -3.78 113.62 109.04 1rli n SER 12 Ca 0.13 0.82 0.00 0.00 1.01 0.00 0.00 58.87 60.83 1rli n SER 12 Cb 0.60 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 62.52 1rli n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rli n GLY 13 N 2.12 3.36 3.76 0.23 0.00 -1.26 -5.04 105.19 108.37 1rli n GLY 13 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1rli n GLY 13 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rli s GLY 14 N -2.47 2.85 0.39 -0.02 0.00 -1.25 -3.48 107.32 103.34 1rli s GLY 14 Ca 0.00 1.11 0.08 0.00 0.00 0.00 0.00 44.72 45.91 1rli s GLY 14 CO 0.00 1.62 2.00 3.43 0.00 0.00 0.00 173.10 180.14 1rli h ASN 15 N 2.11 0.54 -0.27 1.64 2.35 -1.88 -0.94 115.58 119.13 1rli h ASN 15 Ca -0.50 -0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.18 1rli h ASN 15 Cb 1.26 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.50 1rli h ASN 15 CO 0.60 0.36 -0.12 0.74 -1.65 0.00 0.00 177.43 177.35 1rli h THR 16 N 0.62 1.30 -0.61 2.81 2.02 -1.91 -2.56 112.91 114.58 1rli h THR 16 Ca 0.25 -1.21 0.00 0.00 0.77 0.00 0.00 66.41 66.23 1rli h THR 16 Cb 0.22 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 1rli h THR 16 CO -0.07 0.38 0.39 0.44 0.37 0.00 0.00 175.52 177.03 1rli h ASP 17 N 0.30 0.71 0.06 4.18 5.19 -1.54 -2.34 116.42 122.98 1rli h ASP 17 Ca 0.06 -0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1rli h ASP 17 Cb 0.63 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.97 1rli h ASP 17 CO 0.04 0.54 -0.03 0.58 -3.12 0.00 0.00 179.24 177.25 1rli h VAL 18 N 0.83 0.99 -0.54 -1.35 2.07 -1.18 0.24 116.25 117.30 1rli h VAL 18 Ca 0.22 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 1rli h VAL 18 Cb -0.06 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1rli h VAL 18 CO -0.05 0.04 0.30 -0.07 0.02 0.00 0.00 177.57 177.81 1rli h LEU 19 N -0.15 0.68 -0.66 2.57 3.38 -1.41 -1.80 115.31 117.92 1rli h LEU 19 Ca -0.01 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1rli h LEU 19 Cb 0.13 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1rli h LEU 19 CO 0.01 0.58 0.29 0.00 0.09 0.00 0.00 178.44 179.41 1rli h ALA 20 N 1.13 0.85 -0.40 1.53 0.00 -1.36 -1.88 119.26 119.13 1rli h ALA 20 Ca 0.19 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.02 1rli h ALA 20 Cb 0.05 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 17.51 1rli h ALA 20 CO -0.03 0.45 -0.05 1.49 0.00 0.00 0.00 179.25 181.11 1rli h GLU 21 N 0.92 0.05 -0.81 0.00 4.57 -0.47 -1.42 114.58 117.43 1rli h GLU 21 Ca 0.22 -0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.37 1rli h GLU 21 Cb 0.17 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.71 1rli h GLU 21 CO -0.02 0.03 0.38 0.87 -1.18 0.00 0.00 179.01 179.09 1rli h LYS 22 N 0.05 1.17 -0.96 1.92 1.57 -1.01 0.43 116.57 119.73 1rli h LYS 22 Ca 0.19 -0.18 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1rli h LYS 22 Cb 0.29 -0.21 -0.06 0.00 0.08 0.00 0.00 32.23 32.34 1rli h LYS 22 CO -0.37 0.91 0.63 0.00 -0.57 0.00 0.00 179.45 180.05 1rli h ALA 23 N 1.20 1.38 -0.29 3.86 0.00 -0.46 -2.74 119.26 122.21 1rli h ALA 23 Ca 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1rli h ALA 23 Cb 0.13 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1rli h ALA 23 CO -0.03 0.52 0.00 1.33 0.00 0.00 0.00 179.25 181.07 1rli n VAL 24 N -4.44 2.13 -1.71 0.00 0.24 -0.86 -4.71 118.33 108.98 1rli n VAL 24 Ca 0.13 -1.73 -0.43 0.00 -2.04 0.00 0.00 64.34 60.27 1rli n VAL 24 Cb 0.10 -0.15 -0.02 0.00 -1.47 0.00 0.00 33.84 32.30 1rli n VAL 24 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1rli n GLN 25 N -0.30 2.46 0.00 7.34 7.27 0.13 -1.53 117.38 132.74 1rli n GLN 25 Ca 0.20 0.88 0.00 0.00 0.07 0.00 0.00 57.00 58.15 1rli n GLN 25 Cb 0.84 -2.63 0.00 0.00 2.41 0.00 0.00 30.24 30.86 1rli n GLN 25 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1rli n GLY 26 N 2.55 2.80 3.89 1.69 0.00 -1.26 -5.03 105.19 109.83 1rli n GLY 26 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1rli n GLY 26 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rli s PHE 27 N -1.76 3.58 -1.10 1.61 0.40 -0.58 -4.99 117.98 115.13 1rli s PHE 27 Ca 0.00 1.00 -0.06 0.00 -0.60 0.00 0.00 56.93 57.27 1rli s PHE 27 Cb 0.00 -2.45 0.30 0.00 0.51 0.00 0.00 43.02 41.37 1rli s PHE 27 CO 0.00 -0.40 1.39 -3.47 0.70 0.00 0.00 175.22 173.44 1rli n ASP 28 N -2.33 6.12 -4.81 1.36 2.03 -1.26 -5.02 116.55 112.64 1rli n ASP 28 Ca 0.03 -3.29 -0.37 0.00 0.52 0.00 0.00 54.79 51.67 1rli n ASP 28 Cb 0.55 -1.31 -0.06 0.00 -0.72 0.00 0.00 41.12 39.57 1rli n ASP 28 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rli s ALA 29 N -2.22 3.46 -0.35 -1.67 0.00 -1.26 -4.66 121.76 115.05 1rli s ALA 29 Ca 0.31 0.14 -0.29 0.00 0.00 0.00 0.00 51.96 52.13 1rli s ALA 29 Cb 0.01 -2.78 -0.00 0.00 0.00 0.00 0.00 23.12 20.34 1rli s ALA 29 CO 0.05 0.35 1.56 -1.21 0.00 0.00 0.00 175.76 176.51 1rli s GLU 30 N -1.74 3.55 -0.35 0.00 0.41 0.51 -4.90 118.70 116.19 1rli s GLU 30 Ca 0.39 1.22 -0.20 0.00 -0.41 0.00 0.00 54.97 55.97 1rli s GLU 30 Cb -0.18 -4.08 -0.00 0.00 -1.78 0.00 0.00 34.13 28.10 1rli s GLU 30 CO 0.21 -1.60 0.63 -1.01 -0.49 0.00 0.00 175.26 173.01 1rli s HIS 31 N 5.82 3.16 -0.16 1.61 3.76 -1.26 -1.30 115.29 126.92 1rli s HIS 31 Ca 0.69 0.39 -0.03 0.00 -0.15 0.00 0.00 55.06 55.96 1rli s HIS 31 Cb -0.18 -3.10 -0.02 0.00 1.11 0.00 0.00 32.58 30.39 1rli s HIS 31 CO 0.32 -0.59 -0.06 0.42 -0.85 0.00 0.00 174.74 173.97 1rli s ILE 32 N 2.68 3.54 -0.11 0.60 1.01 -0.26 -4.99 121.20 123.67 1rli s ILE 32 Ca 0.24 -0.47 0.03 0.00 0.00 0.00 0.00 60.65 60.45 1rli s ILE 32 Cb -0.15 -2.55 -0.00 0.00 0.01 0.00 0.00 42.46 39.77 1rli s ILE 32 CO 0.14 0.48 -0.21 -0.31 0.00 0.00 0.00 174.94 175.04 1rli s TYR 33 N 0.62 2.63 -0.12 3.97 1.51 -1.26 -0.56 117.35 124.13 1rli s TYR 33 Ca -0.04 -0.99 -0.28 0.00 -1.01 0.00 0.00 57.07 54.75 1rli s TYR 33 Cb -0.15 -1.76 -0.01 0.00 -0.11 0.00 0.00 41.96 39.93 1rli s TYR 33 CO 0.03 -0.40 0.92 -0.51 -1.11 0.00 0.00 175.55 174.48 1rli s LEU 34 N 0.41 4.23 0.49 -1.29 1.43 -0.93 -4.97 118.68 118.04 1rli s LEU 34 Ca -0.16 1.38 -0.21 0.00 -1.03 0.00 0.00 54.13 54.12 1rli s LEU 34 Cb -0.17 -3.41 -0.08 0.00 0.03 0.00 0.00 46.19 42.56 1rli s LEU 34 CO 0.07 -0.40 1.07 -1.58 0.23 0.00 0.00 176.35 175.73 1rli s GLN 35 N 1.95 3.74 -0.21 1.70 0.74 -1.26 -4.93 119.66 121.39 1rli s GLN 35 Ca 0.44 1.46 -0.27 0.00 0.05 0.00 0.00 55.36 57.05 1rli s GLN 35 Cb -0.18 -2.15 0.08 0.00 1.10 0.00 0.00 33.01 31.87 1rli s GLN 35 CO 0.16 -0.50 0.78 -1.59 -0.55 0.00 0.00 175.29 173.60 1rli s LYS 36 N -3.12 0.82 0.12 1.67 -2.85 -1.26 -1.65 119.74 113.47 1rli s LYS 36 Ca 0.67 0.69 0.05 0.00 -1.00 0.00 0.00 55.97 56.39 1rli s LYS 36 Cb -0.19 0.40 -0.04 0.00 -2.06 0.00 0.00 37.83 35.93 1rli s LYS 36 CO 0.23 -0.16 -0.13 0.71 0.10 0.00 0.00 175.35 176.11 1rli s TYR 37 N -0.13 1.30 0.79 1.78 2.02 -0.90 -4.89 117.35 117.31 1rli s TYR 37 Ca -0.02 -0.60 -0.13 0.00 -0.37 0.00 0.00 57.07 55.95 1rli s TYR 37 Cb -0.03 -0.68 0.07 0.00 -0.40 0.00 0.00 41.96 40.92 1rli s TYR 37 CO 0.02 0.10 1.17 -1.25 -1.57 0.00 0.00 175.55 174.02 1rli s PRO 38 N -2.83 1.82 0.00 -1.71 0.04 -1.26 -0.74 135.00 130.33 1rli s PRO 38 Ca 0.09 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.73 1rli s PRO 38 Cb -0.04 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.69 1rli s PRO 38 CO 0.02 -2.04 0.00 0.00 0.04 0.00 0.00 177.00 175.02 1rli n ALA 48 N -3.29 0.78 -1.64 8.56 0.00 -1.26 -4.46 120.51 119.20 1rli n ALA 48 Ca 0.12 0.00 -0.50 0.00 0.00 0.00 0.00 53.44 53.06 1rli n ALA 48 Cb 0.51 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.91 1rli n ALA 48 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1rli n GLN 49 N -0.56 1.66 -0.64 0.00 6.02 -1.26 -0.28 117.38 122.32 1rli n GLN 49 Ca 0.00 0.60 0.00 0.00 -0.01 0.00 0.00 57.00 57.59 1rli n GLN 49 Cb 0.00 -2.32 0.00 0.00 1.02 0.00 0.00 30.24 28.94 1rli n GLN 49 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1rli n GLY 50 N 3.27 0.80 1.17 1.08 0.00 -1.26 -4.91 105.19 105.34 1rli n GLY 50 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 1rli n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rli n GLY 51 N -2.10 1.84 3.74 -0.02 0.00 0.61 -4.96 105.19 104.29 1rli n GLY 51 Ca 0.00 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 1rli n GLY 51 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rli s PHE 52 N -1.36 2.11 -0.04 1.61 0.40 -1.26 -4.28 117.98 115.17 1rli s PHE 52 Ca 0.41 -0.82 -0.01 0.00 -0.60 0.00 0.00 56.93 55.91 1rli s PHE 52 Cb 0.23 -1.73 0.03 0.00 0.51 0.00 0.00 43.02 42.06 1rli s PHE 52 CO 0.31 0.21 0.04 0.50 0.70 0.00 0.00 175.22 176.98 1rli s ARG 53 N -3.88 0.10 0.61 0.44 3.52 0.08 -4.93 118.95 114.89 1rli s ARG 53 Ca 0.21 0.25 -0.18 0.00 -0.13 0.00 0.00 55.73 55.88 1rli s ARG 53 Cb 0.04 -0.54 -0.03 0.00 -1.56 0.00 0.00 34.95 32.86 1rli s ARG 53 CO 0.11 -0.27 1.21 -1.25 -0.81 0.00 0.00 175.30 174.29 1rli s PRO 54 N 1.77 2.90 -0.05 5.12 0.04 -1.26 -2.12 135.00 141.38 1rli s PRO 54 Ca 0.00 1.81 0.06 0.00 0.04 0.00 0.00 61.00 62.91 1rli s PRO 54 Cb -0.12 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 1rli s PRO 54 CO -0.03 -1.26 -0.23 0.08 0.04 0.00 0.00 177.00 175.59 1rli s VAL 55 N -1.65 1.93 -0.18 -0.36 1.01 -0.66 -4.91 120.40 115.58 1rli s VAL 55 Ca 0.77 -1.00 0.14 0.00 0.00 0.00 0.00 61.98 61.89 1rli s VAL 55 Cb -0.30 -1.63 0.43 0.00 0.00 0.00 0.00 36.38 34.88 1rli s VAL 55 CO 0.34 0.54 1.20 0.00 0.00 0.00 0.00 175.10 177.19 1rli n GLN 56 N 2.97 1.56 0.18 2.72 6.02 -1.26 -4.19 117.38 125.38 1rli n GLN 56 Ca -0.17 -3.19 0.07 0.00 -0.01 0.00 0.00 57.00 53.70 1rli n GLN 56 Cb 0.52 -1.41 0.59 0.00 1.02 0.00 0.00 30.24 30.95 1rli n GLN 56 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1rli h ASP 57 N 1.20 0.12 -0.57 1.08 3.32 -1.99 -1.50 116.42 118.09 1rli h ASP 57 Ca 0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1rli h ASP 57 Cb 1.24 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1rli h ASP 57 CO 0.12 0.09 0.00 -0.90 -1.72 0.00 0.00 179.24 176.83 1rli n ASP 58 N -4.52 5.38 -0.13 6.45 5.75 -1.26 -4.57 116.55 123.65 1rli n ASP 58 Ca -0.01 -2.80 -0.04 0.00 -0.01 0.00 0.00 54.79 51.93 1rli n ASP 58 Cb 0.10 -0.66 0.04 0.00 -1.03 0.00 0.00 41.12 39.57 1rli n ASP 58 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 1rli h TYR 59 N 3.87 -0.03 -0.67 2.11 3.20 -1.63 -1.77 116.97 122.06 1rli h TYR 59 Ca 0.00 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1rli h TYR 59 Cb 1.83 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 40.14 1rli h TYR 59 CO 1.00 -0.09 0.34 -0.44 -1.64 0.00 0.00 178.16 177.33 1rli h ASP 60 N 0.11 0.84 0.66 -2.11 3.32 -1.83 -1.03 116.42 116.38 1rli h ASP 60 Ca 0.21 -0.08 -0.10 0.00 0.02 0.00 0.00 57.03 57.09 1rli h ASP 60 Cb 0.31 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1rli h ASP 60 CO -0.35 0.70 -0.47 0.77 -1.72 0.00 0.00 179.24 178.16 1rli h SER 61 N 0.94 0.00 -0.19 6.45 4.64 -1.77 -1.20 113.55 122.42 1rli h SER 61 Ca 0.24 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.42 1rli h SER 61 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1rli h SER 61 CO -0.03 0.47 -0.40 0.40 -0.87 0.00 0.00 176.83 176.40 1rli h ILE 62 N 0.00 1.33 -0.08 0.95 2.04 -0.56 -2.51 117.51 118.68 1rli h ILE 62 Ca -0.00 -1.63 0.00 0.00 1.00 0.00 0.00 64.86 64.22 1rli h ILE 62 Cb 0.93 1.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.88 1rli h ILE 62 CO 0.06 0.51 0.05 0.40 0.00 0.00 0.00 178.15 179.17 1rli h ILE 63 N 0.29 1.04 -0.96 -0.67 1.08 -1.01 -1.40 117.51 115.88 1rli h ILE 63 Ca 0.01 -0.09 0.20 0.00 -0.39 0.00 0.00 64.86 64.58 1rli h ILE 63 Cb 1.00 0.95 -0.09 0.00 -3.07 0.00 0.00 36.82 35.61 1rli h ILE 63 CO 0.09 0.03 0.61 -0.33 -0.69 0.00 0.00 178.15 177.87 1rli h GLU 64 N 0.10 0.59 -0.03 2.37 5.08 -1.17 -0.89 114.58 120.63 1rli h GLU 64 Ca 0.03 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 58.18 1rli h GLU 64 Cb 0.01 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.14 1rli h GLU 64 CO -0.01 0.39 -0.66 0.00 -1.00 0.00 0.00 179.01 177.73 1rli h ARG 65 N 0.61 0.49 -0.14 2.33 3.08 -0.93 -3.27 114.38 116.55 1rli h ARG 65 Ca 0.53 -0.50 -0.09 0.00 0.07 0.00 0.00 59.98 59.99 1rli h ARG 65 Cb 1.03 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.20 1rli h ARG 65 CO -0.28 1.14 -0.33 -0.84 -1.07 0.00 0.00 179.97 178.59 1rli h ILE 66 N 0.04 1.27 0.00 2.04 3.07 -0.78 -2.33 117.51 120.82 1rli h ILE 66 Ca -0.08 -1.32 0.00 0.00 1.55 0.00 0.00 64.86 65.01 1rli h ILE 66 Cb 1.35 1.53 0.00 0.00 -0.27 0.00 0.00 36.82 39.43 1rli h ILE 66 CO 0.13 0.40 0.00 -0.07 -1.05 0.00 0.00 178.15 177.56 1rli h LEU 67 N 0.24 0.00 -1.03 0.16 3.38 -1.23 -0.12 115.31 116.71 1rli h LEU 67 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1rli h LEU 67 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1rli h LEU 67 CO 0.05 0.00 -0.35 0.00 0.09 0.00 0.00 178.44 178.23 1rli n GLN 68 N -2.46 1.31 -4.37 1.13 1.13 -0.88 -4.92 117.38 108.33 1rli n GLN 68 Ca -0.01 -1.03 -0.34 0.00 -1.94 0.00 0.00 57.00 53.67 1rli n GLN 68 Cb 0.08 -1.48 -0.11 0.00 0.11 0.00 0.00 30.24 28.85 1rli n GLN 68 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1rli h HIS 70 N 5.83 0.47 -3.37 0.00 2.76 -0.86 -3.44 115.15 116.54 1rli h HIS 70 Ca -0.43 -0.32 -0.65 0.00 -2.20 0.00 0.00 60.37 56.78 1rli h HIS 70 Cb 1.19 -0.03 -0.22 0.00 1.55 0.00 0.00 27.41 29.90 1rli h HIS 70 CO 0.58 1.21 -0.69 0.42 -1.30 0.00 0.00 177.93 178.15 1rli s ILE 71 N -2.84 3.70 -0.13 6.26 1.01 -1.03 -0.58 121.20 127.59 1rli s ILE 71 Ca -0.04 -0.44 0.02 0.00 0.00 0.00 0.00 60.65 60.20 1rli s ILE 71 Cb 0.08 -2.59 0.01 0.00 0.01 0.00 0.00 42.46 39.97 1rli s ILE 71 CO 0.87 0.52 -0.20 -0.76 0.00 0.00 0.00 174.94 175.37 1rli s LEU 72 N 0.13 1.97 -0.20 2.97 1.43 0.18 -0.76 118.68 124.40 1rli s LEU 72 Ca -0.02 -0.54 -0.04 0.00 -1.03 0.00 0.00 54.13 52.50 1rli s LEU 72 Cb -0.14 -1.32 -0.02 0.00 0.03 0.00 0.00 46.19 44.74 1rli s LEU 72 CO 0.03 0.06 -0.04 -0.63 0.23 0.00 0.00 176.35 176.00 1rli s ILE 73 N 0.86 3.56 -0.32 -0.59 1.01 0.95 -1.26 121.20 125.42 1rli s ILE 73 Ca -0.07 -0.44 -0.11 0.00 0.00 0.00 0.00 60.65 60.03 1rli s ILE 73 Cb -0.15 -2.60 -0.01 0.00 0.01 0.00 0.00 42.46 39.71 1rli s ILE 73 CO -0.02 0.44 0.18 -0.36 0.00 0.00 0.00 174.94 175.18 1rli s PHE 74 N 1.15 3.20 -0.17 3.97 0.08 0.01 0.07 117.98 126.29 1rli s PHE 74 Ca 0.02 -0.45 -0.03 0.00 0.12 0.00 0.00 56.93 56.60 1rli s PHE 74 Cb -0.15 -2.39 -0.02 0.00 -0.57 0.00 0.00 43.02 39.90 1rli s PHE 74 CO -0.00 -0.42 -0.07 0.00 -0.10 0.00 0.00 175.22 174.63 1rli s ALA 75 N 1.65 2.81 -0.10 5.36 0.00 0.02 -0.83 121.76 130.67 1rli s ALA 75 Ca 0.05 -0.98 -0.19 0.00 0.00 0.00 0.00 51.96 50.85 1rli s ALA 75 Cb -0.17 -1.51 0.04 0.00 0.00 0.00 0.00 23.12 21.48 1rli s ALA 75 CO 0.08 -0.03 0.46 -0.08 0.00 0.00 0.00 175.76 176.18 1rli s THR 76 N 0.80 0.02 0.64 0.00 -1.32 0.61 -0.57 115.64 115.81 1rli s THR 76 Ca -0.02 -0.16 -0.13 0.00 -1.21 0.00 0.00 61.69 60.16 1rli s THR 76 Cb -0.15 -0.71 -0.02 0.00 -1.51 0.00 0.00 72.50 70.11 1rli s THR 76 CO 0.01 -0.09 1.05 -2.16 -2.21 0.00 0.00 174.62 171.22 1rli s PRO 77 N -0.56 3.25 -0.43 7.08 0.04 -1.26 -1.93 135.00 141.18 1rli s PRO 77 Ca -0.07 0.99 -0.18 0.00 0.04 0.00 0.00 61.00 61.79 1rli s PRO 77 Cb -0.03 -2.03 0.03 0.00 0.04 0.00 0.00 34.50 32.50 1rli s PRO 77 CO 0.04 -0.85 0.46 0.42 0.04 0.00 0.00 177.00 177.11 1rli s ILE 78 N -2.86 5.06 -0.22 0.56 1.01 0.14 -3.55 121.20 121.35 1rli s ILE 78 Ca 0.59 -0.39 -0.05 0.00 0.00 0.00 0.00 60.65 60.80 1rli s ILE 78 Cb -0.14 -4.08 -0.02 0.00 0.01 0.00 0.00 42.46 38.23 1rli s ILE 78 CO 0.47 -0.48 -0.00 -0.31 0.00 0.00 0.00 174.94 174.62 1rli s TYR 79 N 2.19 3.02 -1.46 3.97 2.02 -0.51 -4.60 117.35 121.98 1rli s TYR 79 Ca 0.12 -0.63 -0.07 0.00 -0.37 0.00 0.00 57.07 56.12 1rli s TYR 79 Cb -0.18 -2.13 0.05 0.00 -0.40 0.00 0.00 41.96 39.31 1rli s TYR 79 CO 0.13 -0.39 0.75 0.91 -1.57 0.00 0.00 175.55 175.39 1rli n TRP 80 N 4.62 -1.97 -1.39 2.71 7.02 -1.26 -1.33 117.44 125.83 1rli n TRP 80 Ca -0.17 0.84 -0.13 0.00 -1.02 0.00 0.00 57.50 57.01 1rli n TRP 80 Cb 0.51 -3.91 -0.06 0.00 -2.42 0.00 0.00 31.31 25.44 1rli n TRP 80 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1rli n PHE 81 N -4.46 0.00 -3.88 -5.99 3.72 -1.26 -4.94 117.46 100.64 1rli n PHE 81 Ca -0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 1rli n PHE 81 Cb 0.60 -2.68 0.00 0.00 -0.94 0.00 0.00 39.48 36.46 1rli n PHE 81 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rli n GLY 82 N -0.55 4.31 3.66 1.37 0.00 -0.45 -4.40 105.19 109.12 1rli n GLY 82 Ca -0.13 -1.80 -0.27 0.00 0.00 0.00 0.00 46.02 43.82 1rli n GLY 82 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1rli n MET 83 N 0.00 -1.03 -1.38 1.61 0.00 -1.26 -1.42 117.12 113.64 1rli n MET 83 Ca 0.00 -2.06 -0.30 0.00 0.00 0.00 0.00 57.70 55.34 1rli n MET 83 Cb 0.00 -1.18 0.10 0.00 0.00 0.00 0.00 33.22 32.14 1rli n MET 83 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1rli s SER 84 N -5.47 4.22 0.22 3.17 1.04 -1.23 -4.21 113.70 111.43 1rli s SER 84 Ca 0.70 1.49 -0.07 0.00 0.48 0.00 0.00 55.95 58.55 1rli s SER 84 Cb -0.02 -2.22 0.17 0.00 0.10 0.00 0.00 66.02 64.05 1rli s SER 84 CO 0.49 -2.17 1.78 1.23 0.98 0.00 0.00 173.24 175.55 1rli h GLY 85 N -1.22 1.27 0.95 7.32 0.00 -1.95 -0.97 103.07 108.47 1rli h GLY 85 Ca -0.47 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.14 1rli h GLY 85 CO 0.56 0.65 0.16 -0.91 0.00 0.00 0.00 176.54 177.00 1rli h THR 86 N 1.16 1.21 -0.40 4.70 1.35 -1.93 -1.16 112.91 117.84 1rli h THR 86 Ca 0.27 -0.66 -0.13 0.00 -0.55 0.00 0.00 66.41 65.34 1rli h THR 86 Cb 0.22 0.84 -0.01 0.00 -1.73 0.00 0.00 68.15 67.47 1rli h THR 86 CO -0.02 0.24 -0.27 0.25 -0.25 0.00 0.00 175.52 175.47 1rli h LEU 87 N 0.55 0.86 -0.38 3.87 5.85 -1.78 -1.73 115.31 122.55 1rli h LEU 87 Ca 0.14 -0.34 0.01 0.00 0.84 0.00 0.00 57.88 58.53 1rli h LEU 87 Cb 0.22 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1rli h LEU 87 CO -0.01 1.08 0.24 0.50 -0.34 0.00 0.00 178.44 179.91 1rli h LYS 88 N 0.71 0.46 -0.05 1.25 1.63 -1.04 -0.22 116.57 119.32 1rli h LYS 88 Ca 0.09 -0.03 -0.09 0.00 -0.85 0.00 0.00 60.65 59.76 1rli h LYS 88 Cb 0.81 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 32.33 1rli h LYS 88 CO 0.07 0.31 -0.40 -0.07 -3.45 0.00 0.00 179.45 175.90 1rli h LEU 89 N 0.48 0.11 0.20 5.20 4.07 -1.08 -0.58 115.31 123.70 1rli h LEU 89 Ca 0.15 -0.04 -0.01 0.00 0.08 0.00 0.00 57.88 58.05 1rli h LEU 89 Cb -0.02 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 41.69 1rli h LEU 89 CO -0.05 0.50 -0.09 0.15 -1.08 0.00 0.00 178.44 177.86 1rli h PHE 90 N 0.09 -0.24 -0.59 1.13 3.57 -0.93 -2.71 116.94 117.26 1rli h PHE 90 Ca 0.01 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 1rli h PHE 90 Cb 0.75 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.55 1rli h PHE 90 CO 0.01 0.07 0.13 0.82 -2.23 0.00 0.00 178.31 177.11 1rli h ILE 91 N -0.57 1.25 -0.80 1.41 2.04 -0.95 -2.64 117.51 117.26 1rli h ILE 91 Ca -0.03 -0.92 0.13 0.00 1.00 0.00 0.00 64.86 65.04 1rli h ILE 91 Cb 0.42 0.72 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 1rli h ILE 91 CO 0.04 0.34 0.52 0.44 0.00 0.00 0.00 178.15 179.50 1rli h ASP 92 N 0.85 0.54 0.63 1.72 3.32 -1.12 -0.16 116.42 122.21 1rli h ASP 92 Ca 0.18 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1rli h ASP 92 Cb 0.36 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1rli h ASP 92 CO 0.00 0.30 0.00 -0.09 -1.72 0.00 0.00 179.24 177.73 1rli h ARG 93 N 0.59 0.00 -0.22 3.56 2.43 -1.12 -2.71 114.38 116.90 1rli h ARG 93 Ca 0.39 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.62 1rli h ARG 93 Cb 0.67 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1rli h ARG 93 CO -0.15 0.00 0.22 -1.49 -1.51 0.00 0.00 179.97 177.04 1rli h TRP 94 N 0.00 0.00 -0.84 2.20 6.55 -1.06 -0.35 115.95 122.46 1rli h TRP 94 Ca 0.00 0.00 -0.03 0.00 0.95 0.00 0.00 58.89 59.81 1rli h TRP 94 Cb 0.32 0.00 -0.04 0.00 -0.86 0.00 0.00 29.16 28.58 1rli h TRP 94 CO 0.00 0.00 0.41 0.77 -1.05 0.00 0.00 178.44 178.57 1rli h SER 95 N 0.00 1.09 -0.24 -3.49 0.02 -1.67 0.83 113.55 110.09 1rli h SER 95 Ca 0.11 -0.13 -0.17 0.00 -0.84 0.00 0.00 61.79 60.76 1rli h SER 95 Cb 0.55 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1rli h SER 95 CO -0.00 0.92 -0.50 -0.61 -1.14 0.00 0.00 176.83 175.49 1rli h GLN 96 N 1.19 0.76 -0.35 3.45 4.15 -1.30 -3.19 115.11 119.81 1rli h GLN 96 Ca 0.29 -0.50 -0.05 0.00 0.77 0.00 0.00 58.65 59.16 1rli h GLN 96 Cb 0.11 0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.85 1rli h GLN 96 CO -0.04 1.13 -0.00 1.15 -1.93 0.00 0.00 178.83 179.14 1rli h THR 97 N 0.50 1.20 0.00 2.39 2.02 -0.97 -1.92 112.91 116.12 1rli h THR 97 Ca 0.00 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.38 1rli h THR 97 Cb 1.11 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 1rli h THR 97 CO 0.11 0.28 0.00 0.18 0.37 0.00 0.00 175.52 176.46 1rli n LEU 98 N -4.27 0.12 -0.10 2.58 4.77 0.25 -1.76 117.00 118.59 1rli n LEU 98 Ca 0.02 0.54 0.02 0.00 -0.03 0.00 0.00 56.01 56.56 1rli n LEU 98 Cb 0.25 -0.54 0.03 0.00 -2.33 0.00 0.00 43.42 40.83 1rli n LEU 98 CO 0.39 -0.47 0.41 -2.11 -1.33 0.00 0.00 177.39 174.28 1rli n ARG 99 N -1.64 1.38 -2.82 3.23 1.85 -0.78 -4.91 116.66 112.96 1rli n ARG 99 Ca 0.01 -1.42 -0.42 0.00 -1.00 0.00 0.00 57.85 55.02 1rli n ARG 99 Cb 0.08 -0.91 -0.04 0.00 -1.05 0.00 0.00 32.46 30.54 1rli n ARG 99 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1rli s ASP 100 N -1.19 6.85 0.56 2.89 -1.08 -0.72 -4.93 116.67 119.05 1rli s ASP 100 Ca 0.07 0.99 0.26 0.00 -0.52 0.00 0.00 52.55 53.36 1rli s ASP 100 Cb 0.06 -2.47 1.52 0.00 -1.46 0.00 0.00 42.92 40.58 1rli s ASP 100 CO 0.01 -0.64 2.07 -0.65 0.52 0.00 0.00 175.17 176.48 1rli h PRO 101 N 7.84 0.00 0.00 4.34 0.11 -1.91 -1.49 132.00 140.89 1rli h PRO 101 Ca -0.22 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.85 1rli h PRO 101 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1rli h PRO 101 CO 0.93 0.00 -0.20 -0.09 -0.21 0.00 0.00 178.00 178.43 1rli h ARG 102 N 0.00 0.00 -2.15 1.05 2.43 -1.94 -3.27 114.38 110.51 1rli h ARG 102 Ca 0.12 0.00 -0.58 0.00 -0.81 0.00 0.00 59.98 58.71 1rli h ARG 102 Cb 0.59 0.00 -0.41 0.00 -0.42 0.00 0.00 29.97 29.73 1rli h ARG 102 CO -0.00 0.20 -0.77 1.19 -1.51 0.00 0.00 179.97 179.08 1rli n PHE 103 N -4.08 2.49 -0.37 2.20 3.72 -0.56 -4.97 117.46 115.89 1rli n PHE 103 Ca -0.02 -3.96 0.31 0.00 -0.05 0.00 0.00 57.45 53.72 1rli n PHE 103 Cb 0.27 -0.49 0.62 0.00 -0.94 0.00 0.00 39.48 38.95 1rli n PHE 103 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1rli h PRO 104 N 3.86 0.19 -0.42 -1.08 0.11 -1.64 -2.23 132.00 130.78 1rli h PRO 104 Ca 0.15 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1rli h PRO 104 Cb 0.71 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.78 1rli h PRO 104 CO 0.72 0.13 0.00 -0.25 -0.21 0.00 0.00 178.00 178.38 1rli n ASP 105 N -4.48 3.58 -0.38 -2.05 9.92 -1.26 -4.78 116.55 117.10 1rli n ASP 105 Ca 0.29 -2.31 -0.08 0.00 -0.53 0.00 0.00 54.79 52.16 1rli n ASP 105 Cb 1.15 -0.39 -0.06 0.00 -0.64 0.00 0.00 41.12 41.19 1rli n ASP 105 CO 0.00 0.00 0.00 0.15 0.13 0.00 0.00 177.20 177.48 1rli h PHE 106 N 2.57 -1.62 -0.15 1.24 3.57 -1.73 0.12 116.94 120.94 1rli h PHE 106 Ca 0.00 0.12 0.04 0.00 3.53 0.00 0.00 57.97 61.66 1rli h PHE 106 Cb 1.05 0.83 -0.07 0.00 2.79 0.00 0.00 35.95 40.55 1rli h PHE 106 CO 0.41 -0.39 -0.42 -0.22 -2.23 0.00 0.00 178.31 175.46 1rli h LYS 107 N -0.04 -0.46 -0.47 1.11 1.63 -1.86 0.47 116.57 116.95 1rli h LYS 107 Ca 0.21 0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 60.02 1rli h LYS 107 Cb 0.49 0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.20 1rli h LYS 107 CO -0.92 -0.31 0.20 0.37 -3.45 0.00 0.00 179.45 175.35 1rli h GLN 108 N -0.48 0.69 -0.52 1.90 -0.00 -1.71 -1.54 115.11 113.45 1rli h GLN 108 Ca 0.08 -0.12 0.02 0.00 -0.00 0.00 0.00 58.65 58.63 1rli h GLN 108 Cb 0.62 -0.12 -0.03 0.00 0.00 0.00 0.00 27.48 27.95 1rli h GLN 108 CO -0.41 0.61 0.32 1.96 0.00 0.00 0.00 178.83 181.32 1rli h GLN 109 N 0.61 0.63 -0.17 1.69 4.20 -0.42 -2.49 115.11 119.16 1rli h GLN 109 Ca 0.16 -0.04 -0.11 0.00 0.06 0.00 0.00 58.65 58.72 1rli h GLN 109 Cb 0.16 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1rli h GLN 109 CO -0.02 0.42 -0.36 0.52 -0.67 0.00 0.00 178.83 178.72 1rli h MET 110 N 0.65 0.36 0.00 1.46 2.86 -0.75 -3.15 114.93 116.36 1rli h MET 110 Ca 0.21 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1rli h MET 110 Cb -0.01 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1rli h MET 110 CO -0.08 0.67 0.00 -1.13 1.06 0.00 0.00 176.91 177.43 1rli n SER 111 N -4.06 0.40 -0.72 1.22 3.41 -0.59 -1.89 113.62 111.39 1rli n SER 111 Ca -0.01 0.68 0.09 0.00 -0.26 0.00 0.00 58.87 59.36 1rli n SER 111 Cb 0.46 -0.73 0.07 0.00 -0.26 0.00 0.00 64.21 63.75 1rli n SER 111 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1rli n VAL 112 N -2.02 0.00 -2.61 -3.33 0.24 -1.19 -4.25 118.33 105.17 1rli n VAL 112 Ca -0.01 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.34 61.49 1rli n VAL 112 Cb 0.04 1.37 -0.02 0.00 -1.47 0.00 0.00 33.84 33.76 1rli n VAL 112 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1rli s LYS 113 N -1.49 3.72 -0.15 7.34 1.02 -0.79 -4.95 119.74 124.44 1rli s LYS 113 Ca 0.21 0.50 -0.07 0.00 0.02 0.00 0.00 55.97 56.63 1rli s LYS 113 Cb 0.15 -2.31 -0.04 0.00 -0.52 0.00 0.00 37.83 35.10 1rli s LYS 113 CO 0.22 -0.18 0.09 -0.65 -0.92 0.00 0.00 175.35 173.91 1rli s GLN 114 N -4.28 3.64 0.05 1.68 -0.21 0.25 -2.78 119.66 118.02 1rli s GLN 114 Ca 0.52 -0.27 0.09 0.00 0.02 0.00 0.00 55.36 55.72 1rli s GLN 114 Cb -0.10 -3.15 -0.03 0.00 1.00 0.00 0.00 33.01 30.72 1rli s GLN 114 CO 0.38 0.53 -0.24 0.00 -2.12 0.00 0.00 175.29 173.83 1rli s ALA 115 N -0.33 2.37 0.08 6.09 0.00 0.10 -0.64 121.76 129.43 1rli s ALA 115 Ca 0.10 -1.27 0.02 0.00 0.00 0.00 0.00 51.96 50.81 1rli s ALA 115 Cb -0.12 -0.55 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 1rli s ALA 115 CO 0.01 0.55 -0.07 0.71 0.00 0.00 0.00 175.76 176.96 1rli s TYR 116 N -0.87 0.87 -0.03 0.00 2.02 -0.38 -0.40 117.35 118.55 1rli s TYR 116 Ca 0.13 -0.77 0.03 0.00 -0.37 0.00 0.00 57.07 56.09 1rli s TYR 116 Cb -0.10 -0.50 0.00 0.00 -0.40 0.00 0.00 41.96 40.96 1rli s TYR 116 CO 0.03 -0.11 -0.10 0.08 -1.57 0.00 0.00 175.55 173.89 1rli s VAL 117 N -2.86 0.85 -0.17 0.71 1.01 -0.94 -0.81 120.40 118.20 1rli s VAL 117 Ca 0.05 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.64 1rli s VAL 117 Cb 0.00 -0.75 0.03 0.00 0.00 0.00 0.00 36.38 35.66 1rli s VAL 117 CO -0.03 0.26 -0.12 -0.63 0.00 0.00 0.00 175.10 174.58 1rli s ILE 118 N 0.15 1.58 -0.03 2.22 1.01 -0.01 -1.17 121.20 124.93 1rli s ILE 118 Ca -0.03 -0.77 0.02 0.00 0.00 0.00 0.00 60.65 59.88 1rli s ILE 118 Cb -0.08 -1.55 0.01 0.00 0.01 0.00 0.00 42.46 40.84 1rli s ILE 118 CO 0.01 0.34 -0.09 0.00 0.00 0.00 0.00 174.94 175.19 1rli s ALA 119 N 1.46 0.91 -0.09 9.38 0.00 -0.40 -0.28 121.76 132.74 1rli s ALA 119 Ca 0.03 -0.31 0.03 0.00 0.00 0.00 0.00 51.96 51.71 1rli s ALA 119 Cb -0.14 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.61 1rli s ALA 119 CO -0.10 0.12 -0.19 0.08 0.00 0.00 0.00 175.76 175.67 1rli s VAL 120 N 0.36 1.67 0.08 0.00 1.01 -0.81 -0.60 120.40 122.11 1rli s VAL 120 Ca -0.06 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 1rli s VAL 120 Cb -0.11 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 1rli s VAL 120 CO 0.01 0.47 0.03 -0.83 0.00 0.00 0.00 175.10 174.78 1rli s GLY 121 N 0.49 0.62 0.00 4.51 0.00 -0.43 0.27 107.32 112.78 1rli s GLY 121 Ca -0.17 -1.25 0.19 0.00 0.00 0.00 0.00 44.72 43.50 1rli s GLY 121 CO 0.07 -1.28 1.35 0.61 0.00 0.00 0.00 173.10 173.85 1rli n GLY 122 N 0.02 1.99 2.84 0.20 0.00 -0.86 -0.93 105.19 108.45 1rli n GLY 122 Ca -0.11 -0.63 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 1rli n GLY 122 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rli s ASP 123 N -1.19 4.13 -0.86 1.61 -1.08 -1.26 -4.87 116.67 113.15 1rli s ASP 123 Ca 0.36 -3.25 -0.21 0.00 -0.52 0.00 0.00 52.55 48.93 1rli s ASP 123 Cb 0.20 -1.41 0.03 0.00 -1.46 0.00 0.00 42.92 40.27 1rli s ASP 123 CO 0.27 -0.18 0.39 -3.20 0.52 0.00 0.00 175.17 172.97 1rli n ASN 124 N 2.76 -2.23 -0.00 -0.34 5.15 -1.26 -4.50 115.26 114.83 1rli n ASN 124 Ca 0.13 -0.89 0.18 0.00 -0.60 0.00 0.00 54.58 53.40 1rli n ASN 124 Cb 0.35 -1.07 0.64 0.00 -0.53 0.00 0.00 39.78 39.17 1rli n ASN 124 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1rli h PRO 125 N -0.82 0.09 -0.05 1.20 0.13 -1.87 0.16 132.00 130.84 1rli h PRO 125 Ca -0.48 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1rli h PRO 125 Cb 0.95 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.06 1rli h PRO 125 CO 0.37 0.06 0.09 1.57 -0.23 0.00 0.00 178.00 179.86 1rli h LYS 126 N 0.09 0.00 0.00 0.86 2.10 -1.88 -0.16 116.57 117.58 1rli h LYS 126 Ca 0.24 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.72 1rli h LYS 126 Cb 0.84 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.14 1rli h LYS 126 CO -0.02 0.00 -1.52 -0.89 -2.00 0.00 0.00 179.45 175.02 1rli n ILE 127 N -3.45 0.75 0.62 0.07 2.08 -0.62 -4.64 119.36 114.16 1rli n ILE 127 Ca -0.02 -0.11 0.11 0.00 0.56 0.00 0.00 62.75 63.29 1rli n ILE 127 Cb 0.18 -1.70 0.44 0.00 -0.75 0.00 0.00 39.64 37.81 1rli n ILE 127 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1rli n LYS 128 N -3.59 0.09 -0.03 0.38 5.02 -0.05 -2.31 118.16 117.68 1rli n LYS 128 Ca -0.21 0.23 0.13 0.00 -2.02 0.00 0.00 58.31 56.43 1rli n LYS 128 Cb 0.61 -1.64 0.27 0.00 -0.02 0.00 0.00 35.03 34.26 1rli n LYS 128 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1rli n GLY 129 N 0.58 0.69 0.34 0.72 0.00 -0.08 -4.39 105.19 103.05 1rli n GLY 129 Ca 0.04 -0.59 -0.06 0.00 0.00 0.00 0.00 46.02 45.41 1rli n GLY 129 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1rli h LEU 130 N 3.72 1.09 -1.11 0.99 3.38 -1.60 -2.38 115.31 119.40 1rli h LEU 130 Ca 0.00 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 57.84 1rli h LEU 130 Cb 0.79 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.20 1rli h LEU 130 CO 0.00 0.99 0.61 -0.65 0.09 0.00 0.00 178.44 179.47 1rli h PRO 131 N 1.14 1.06 -0.51 1.13 0.11 -1.81 0.35 132.00 133.47 1rli h PRO 131 Ca 0.25 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.28 1rli h PRO 131 Cb 0.26 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 1rli h PRO 131 CO -0.01 0.70 0.24 1.25 -0.21 0.00 0.00 178.00 179.97 1rli h LEU 132 N 1.09 0.67 -1.14 2.35 5.85 -1.68 0.18 115.31 122.63 1rli h LEU 132 Ca 0.39 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.95 1rli h LEU 132 Cb 0.14 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 1rli h LEU 132 CO -0.14 0.61 0.27 0.40 -0.34 0.00 0.00 178.44 179.24 1rli h ILE 133 N 0.68 1.21 -0.05 4.05 1.08 -0.83 -0.12 117.51 123.52 1rli h ILE 133 Ca 0.17 -0.62 -0.12 0.00 -0.39 0.00 0.00 64.86 63.91 1rli h ILE 133 Cb 0.12 0.46 -0.01 0.00 -3.07 0.00 0.00 36.82 34.32 1rli h ILE 133 CO -0.02 0.25 -0.52 1.56 -0.69 0.00 0.00 178.15 178.73 1rli h GLN 134 N 0.86 0.14 -0.27 2.37 4.20 -0.30 -0.17 115.11 121.95 1rli h GLN 134 Ca 0.21 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.79 1rli h GLN 134 Cb 0.13 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1rli h GLN 134 CO -0.02 0.63 -0.02 0.37 -0.67 0.00 0.00 178.83 179.11 1rli h GLN 135 N 0.11 0.49 -0.98 1.46 4.15 0.08 -2.23 115.11 118.18 1rli h GLN 135 Ca 0.00 -0.17 0.04 0.00 0.77 0.00 0.00 58.65 59.29 1rli h GLN 135 Cb 0.95 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.55 1rli h GLN 135 CO 0.07 0.67 0.64 0.74 -1.93 0.00 0.00 178.83 179.03 1rli h PHE 136 N 0.26 1.21 -0.57 3.99 0.04 -0.71 -0.12 116.94 121.03 1rli h PHE 136 Ca 0.07 0.03 0.06 0.00 2.80 0.00 0.00 57.97 60.94 1rli h PHE 136 Cb 0.47 -0.40 -0.05 0.00 2.20 0.00 0.00 35.95 38.16 1rli h PHE 136 CO 0.04 0.70 0.27 1.49 -0.60 0.00 0.00 178.31 180.21 1rli h GLU 137 N 1.25 0.49 -0.43 1.51 4.81 -0.75 -0.01 114.58 121.44 1rli h GLU 137 Ca 0.39 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.49 1rli h GLU 137 Cb -0.00 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1rli h GLU 137 CO -0.12 0.33 -0.11 0.45 -0.73 0.00 0.00 179.01 178.82 1rli h HIS 138 N 0.51 0.94 0.07 0.92 3.86 -0.74 -1.12 115.15 119.60 1rli h HIS 138 Ca 0.27 -0.21 0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1rli h HIS 138 Cb 0.22 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 1rli h HIS 138 CO -0.12 0.95 -0.12 0.82 0.86 0.00 0.00 177.93 180.32 1rli h ILE 139 N 0.67 0.72 -0.70 2.45 2.04 -0.49 -0.67 117.51 121.52 1rli h ILE 139 Ca 0.11 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.89 1rli h ILE 139 Cb 0.65 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1rli h ILE 139 CO 0.04 0.00 0.15 -0.26 0.00 0.00 0.00 178.15 178.08 1rli h PHE 140 N -0.24 1.20 -0.74 1.37 0.04 -0.99 -2.55 116.94 115.04 1rli h PHE 140 Ca 0.02 -0.15 -0.03 0.00 2.80 0.00 0.00 57.97 60.61 1rli h PHE 140 Cb 0.25 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 38.03 1rli h PHE 140 CO -0.15 0.98 0.35 1.25 -0.60 0.00 0.00 178.31 180.15 1rli h HIS 141 N 1.07 1.06 -0.56 -0.55 2.76 -0.98 -0.55 115.15 117.40 1rli h HIS 141 Ca 0.22 -0.05 -0.00 0.00 -2.20 0.00 0.00 60.37 58.34 1rli h HIS 141 Cb 0.40 -0.33 -0.03 0.00 1.55 0.00 0.00 27.41 29.01 1rli h HIS 141 CO 0.03 0.77 0.34 0.35 -1.30 0.00 0.00 177.93 178.12 1rli h PHE 142 N 1.05 0.73 -0.00 5.26 3.57 -0.74 -1.89 116.94 124.92 1rli h PHE 142 Ca 0.26 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.76 1rli h PHE 142 Cb 0.12 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.61 1rli h PHE 142 CO 0.01 0.49 -0.18 -1.33 -2.23 0.00 0.00 178.31 175.07 1rli n MET 143 N -4.42 0.50 -1.00 1.11 2.81 -0.53 -4.91 117.12 110.69 1rli n MET 143 Ca 0.05 -0.20 0.00 0.00 -1.81 0.00 0.00 57.70 55.74 1rli n MET 143 Cb 0.07 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.09 1rli n MET 143 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rli n GLY 144 N 1.35 0.61 3.74 3.03 0.00 -0.35 -3.47 105.19 110.10 1rli n GLY 144 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1rli n GLY 144 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rli s MET 145 N -0.06 4.73 -0.13 1.61 -1.94 -0.39 -4.62 119.30 118.50 1rli s MET 145 Ca 0.00 1.41 -0.29 0.00 -1.71 0.00 0.00 55.69 55.10 1rli s MET 145 Cb 0.00 -3.33 -0.01 0.00 2.01 0.00 0.00 34.83 33.50 1rli s MET 145 CO 0.00 0.35 1.11 -1.12 -0.01 0.00 0.00 175.02 175.35 1rli s SER 146 N -0.51 7.11 -0.76 3.03 0.01 -1.12 -4.23 113.70 117.24 1rli s SER 146 Ca 0.43 1.59 -0.21 0.00 1.31 0.00 0.00 55.95 59.07 1rli s SER 146 Cb -0.24 -2.55 0.10 0.00 0.21 0.00 0.00 66.02 63.54 1rli s SER 146 CO 0.30 -0.59 1.00 0.12 0.41 0.00 0.00 173.24 174.48 1rli s PHE 147 N 2.61 2.87 -0.04 2.43 5.36 -1.26 0.01 117.98 129.95 1rli s PHE 147 Ca 0.50 -0.90 0.15 0.00 -0.96 0.00 0.00 56.93 55.72 1rli s PHE 147 Cb -0.20 -4.27 0.18 0.00 -0.34 0.00 0.00 43.02 38.40 1rli s PHE 147 CO 0.15 -1.56 1.50 0.87 -1.46 0.00 0.00 175.22 174.72 1rli h LYS 148 N 9.27 0.00 0.00 10.12 1.79 -1.10 -3.48 116.57 133.16 1rli h LYS 148 Ca -0.12 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.35 1rli h LYS 148 Cb 1.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 1rli h LYS 148 CO 1.15 0.53 0.00 0.41 -1.08 0.00 0.00 179.45 180.47 1rli n GLY 149 N 0.99 0.84 3.73 3.86 0.00 -1.25 -5.05 105.19 108.31 1rli n GLY 149 Ca 0.01 -0.98 -0.08 0.00 0.00 0.00 0.00 46.02 44.97 1rli n GLY 149 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1rli s TYR 150 N -2.00 -0.02 -0.04 1.61 -0.85 -1.26 -2.22 117.35 112.57 1rli s TYR 150 Ca 0.00 -0.39 0.00 0.00 -0.52 0.00 0.00 57.07 56.16 1rli s TYR 150 Cb 0.00 0.52 0.03 0.00 0.38 0.00 0.00 41.96 42.88 1rli s TYR 150 CO 0.00 -1.12 -0.01 0.08 -1.52 0.00 0.00 175.55 172.98 1rli s VAL 151 N -3.94 0.25 -0.32 -3.49 1.01 -0.32 -4.97 120.40 108.62 1rli s VAL 151 Ca 0.14 0.06 -0.05 0.00 0.00 0.00 0.00 61.98 62.13 1rli s VAL 151 Cb -0.04 -0.34 0.04 0.00 0.00 0.00 0.00 36.38 36.04 1rli s VAL 151 CO 0.06 0.17 0.08 -0.76 0.00 0.00 0.00 175.10 174.65 1rli s LEU 152 N 1.12 4.15 0.11 3.92 1.43 -1.26 -1.27 118.68 126.88 1rli s LEU 152 Ca -0.08 -1.11 0.04 0.00 -1.03 0.00 0.00 54.13 51.94 1rli s LEU 152 Cb -0.14 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1rli s LEU 152 CO -0.02 -0.29 0.10 -0.83 0.23 0.00 0.00 176.35 175.54 1rli s GLY 153 N 1.38 1.91 -0.21 -3.19 0.00 0.23 -4.77 107.32 102.67 1rli s GLY 153 Ca -0.02 -1.08 -0.07 0.00 0.00 0.00 0.00 44.72 43.54 1rli s GLY 153 CO 0.02 -1.07 0.07 1.85 0.00 0.00 0.00 173.10 173.96 1rli s GLU 154 N -2.66 3.87 0.00 2.90 2.12 -1.26 -1.32 118.70 122.36 1rli s GLU 154 Ca 0.30 -0.39 0.00 0.00 0.36 0.00 0.00 54.97 55.24 1rli s GLU 154 Cb -0.11 -3.26 0.00 0.00 0.26 0.00 0.00 34.13 31.01 1rli s GLU 154 CO 0.23 0.12 0.00 0.41 -0.54 0.00 0.00 175.26 175.47 1rli n GLY 155 N 4.02 1.12 0.00 -1.50 0.00 -0.11 -4.34 105.19 104.38 1rli n GLY 155 Ca -0.16 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1rli n GLY 155 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1rli n ASN 156 N 0.00 1.56 -4.21 1.61 6.94 -1.26 -2.02 115.26 117.87 1rli n ASN 156 Ca 0.00 0.00 -0.23 0.00 -0.02 0.00 0.00 54.58 54.33 1rli n ASN 156 Cb 0.00 0.29 -0.13 0.00 -2.36 0.00 0.00 39.78 37.58 1rli n ASN 156 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1rli s ARG 157 N -0.72 1.15 0.12 -3.83 1.81 -1.26 -5.02 118.95 111.20 1rli s ARG 157 Ca 0.00 -0.91 -0.35 0.00 -1.72 0.00 0.00 55.73 52.75 1rli s ARG 157 Cb 0.00 -1.25 -0.16 0.00 -0.45 0.00 0.00 34.95 33.09 1rli s ARG 157 CO 0.00 0.31 1.26 -2.30 -0.68 0.00 0.00 175.30 173.89 1rli n PRO 158 N 1.73 1.11 0.00 3.54 -0.02 -1.26 -0.87 135.00 139.23 1rli n PRO 158 Ca -0.18 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1rli n PRO 158 Cb 0.54 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.04 1rli n PRO 158 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rli n GLY 159 N 2.30 2.90 0.33 -1.23 0.00 -1.23 -4.91 105.19 103.35 1rli n GLY 159 Ca 0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.27 1rli n GLY 159 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1rli h ASP 160 N 0.00 0.47 0.18 1.61 3.45 -1.36 -2.14 116.42 118.62 1rli h ASP 160 Ca 0.00 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1rli h ASP 160 Cb 0.00 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 38.67 1rli h ASP 160 CO 0.00 0.31 0.00 0.00 -1.57 0.00 0.00 179.24 177.98 1rli n ILE 161 N -4.47 0.57 0.59 0.35 0.13 -1.26 -1.28 119.36 113.98 1rli n ILE 161 Ca 0.07 0.14 0.13 0.00 -1.10 0.00 0.00 62.75 61.99 1rli n ILE 161 Cb 0.21 -0.95 0.39 0.00 -0.84 0.00 0.00 39.64 38.46 1rli n ILE 161 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 176.55 179.28 1rli h LEU 162 N 0.00 0.00 0.00 9.51 3.38 -1.74 -3.07 115.31 123.39 1rli h LEU 162 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rli h LEU 162 Cb 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1rli h LEU 162 CO 0.00 0.00 -0.61 -0.09 0.09 0.00 0.00 178.44 177.83 1rli h ARG 163 N 0.00 0.00 -3.61 1.13 2.43 -1.38 -3.39 114.38 109.56 1rli h ARG 163 Ca 0.00 0.00 -0.77 0.00 -0.81 0.00 0.00 59.98 58.40 1rli h ARG 163 Cb 0.74 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 30.10 1rli h ARG 163 CO 0.00 0.01 1.57 -3.47 -1.51 0.00 0.00 179.97 176.57 1rli n ASP 164 N -2.85 5.41 0.07 -3.80 -0.08 -1.16 -4.79 116.55 109.35 1rli n ASP 164 Ca 0.01 -3.14 0.16 0.00 -1.51 0.00 0.00 54.79 50.31 1rli n ASP 164 Cb 0.55 -1.45 0.66 0.00 2.34 0.00 0.00 41.12 43.22 1rli n ASP 164 CO 0.00 0.00 0.00 0.45 0.12 0.00 0.00 177.20 177.77 1rli h HIS 165 N 5.97 0.04 -0.17 -0.67 3.86 -1.82 0.22 115.15 122.59 1rli h HIS 165 Ca 0.33 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.46 1rli h HIS 165 Cb 0.68 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.13 1rli h HIS 165 CO 1.15 0.02 -0.24 1.96 0.86 0.00 0.00 177.93 181.67 1rli h GLN 166 N 0.04 0.30 0.01 2.45 4.20 -1.96 -0.77 115.11 119.38 1rli h GLN 166 Ca 0.18 -0.10 -0.14 0.00 0.06 0.00 0.00 58.65 58.65 1rli h GLN 166 Cb 0.67 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.44 1rli h GLN 166 CO -0.01 0.53 -0.53 0.00 -0.67 0.00 0.00 178.83 178.15 1rli h ALA 167 N 1.48 0.05 -0.88 3.87 0.00 -0.95 -2.25 119.26 120.59 1rli h ALA 167 Ca 0.04 -0.56 0.02 0.00 0.00 0.00 0.00 54.91 54.42 1rli h ALA 167 Cb 0.58 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 1rli h ALA 167 CO 0.04 0.29 0.58 -0.07 0.00 0.00 0.00 179.25 180.09 1rli h LEU 168 N -0.22 0.98 0.57 0.00 3.38 -1.19 0.23 115.31 119.06 1rli h LEU 168 Ca -0.07 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1rli h LEU 168 Cb 1.27 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1rli h LEU 168 CO 0.10 0.70 -0.30 0.28 0.09 0.00 0.00 178.44 179.31 1rli h SER 169 N 1.16 -0.73 -0.41 -0.43 0.02 -1.18 -0.64 113.55 111.34 1rli h SER 169 Ca 0.33 0.03 0.08 0.00 -0.84 0.00 0.00 61.79 61.39 1rli h SER 169 Cb -0.09 0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.59 1rli h SER 169 CO -0.09 -0.50 -0.02 0.00 -1.14 0.00 0.00 176.83 175.08 1rli h ALA 170 N -0.39 0.35 -1.01 3.77 0.00 -0.97 0.25 119.26 121.27 1rli h ALA 170 Ca -0.07 0.13 0.11 0.00 0.00 0.00 0.00 54.91 55.07 1rli h ALA 170 Cb 0.63 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 1rli h ALA 170 CO 0.10 -0.41 0.64 0.00 0.00 0.00 0.00 179.25 179.59 1rli h ALA 171 N 1.37 1.49 -0.27 0.00 0.00 -0.33 0.44 119.26 121.96 1rli h ALA 171 Ca 0.20 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 1rli h ALA 171 Cb 0.29 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1rli h ALA 171 CO -0.36 0.29 -0.01 0.77 0.00 0.00 0.00 179.25 179.95 1rli h SER 172 N 1.05 0.47 -0.24 0.00 0.02 0.61 -2.89 113.55 112.58 1rli h SER 172 Ca 0.48 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1rli h SER 172 Cb 0.40 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1rli h SER 172 CO -0.24 0.67 0.00 0.54 -1.14 0.00 0.00 176.83 176.66 1rli n ARG 173 N -4.60 1.83 0.05 3.45 1.74 0.69 -4.33 116.66 115.49 1rli n ARG 173 Ca -0.03 -0.96 -0.12 0.00 -0.77 0.00 0.00 57.85 55.96 1rli n ARG 173 Cb 0.26 -1.38 -0.09 0.00 -1.02 0.00 0.00 32.46 30.23 1rli n ARG 173 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1rli h LEU 174 N 1.44 -0.14 -0.95 0.55 5.85 0.04 -3.49 115.31 118.62 1rli h LEU 174 Ca 0.00 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.36 1rli h LEU 174 Cb 0.56 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1rli h LEU 174 CO 0.05 0.32 0.00 0.18 -0.34 0.00 0.00 178.44 178.66