#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hlr h GLN 3 N 0.00 -0.19 0.00 5.56 5.75 -2.03 -3.46 115.11 120.74 3hlr h GLN 3 Ca 0.00 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 3hlr h GLN 3 Cb 0.00 0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.59 3hlr h GLN 3 CO 0.00 -0.13 0.00 1.63 -2.65 0.00 0.00 178.83 177.68 3hlr n LYS 4 N -5.22 0.00 -3.74 1.69 4.76 -1.26 -4.92 118.16 109.47 3hlr n LYS 4 Ca -0.06 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.15 3hlr n LYS 4 Cb 0.15 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.30 3hlr n LYS 4 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 3hlr s TRP 5 N 0.00 2.60 -0.19 2.13 0.52 -1.26 0.45 118.94 123.19 3hlr s TRP 5 Ca 0.00 -0.54 -0.14 0.00 0.02 0.00 0.00 56.10 55.44 3hlr s TRP 5 Cb 0.00 -2.10 0.06 0.00 -1.15 0.00 0.00 33.47 30.28 3hlr s TRP 5 CO 0.00 -0.06 0.49 -1.21 0.02 0.00 0.00 176.95 176.18 3hlr s GLU 6 N -4.08 0.52 0.14 4.98 2.02 -0.10 -4.56 118.70 117.62 3hlr s GLU 6 Ca 0.45 0.81 0.04 0.00 0.02 0.00 0.00 54.97 56.29 3hlr s GLU 6 Cb -0.01 0.13 -0.04 0.00 0.10 0.00 0.00 34.13 34.31 3hlr s GLU 6 CO 0.26 -0.12 -0.10 -1.58 0.02 0.00 0.00 175.26 173.75 3hlr s TRP 7 N 0.93 1.23 -0.15 1.61 0.52 -1.26 -1.62 118.94 120.20 3hlr s TRP 7 Ca -0.05 -0.78 -0.25 0.00 0.02 0.00 0.00 56.10 55.04 3hlr s TRP 7 Cb -0.06 -0.63 0.06 0.00 -1.15 0.00 0.00 33.47 31.69 3hlr s TRP 7 CO -0.08 0.06 0.63 0.21 0.02 0.00 0.00 176.95 177.79 3hlr s LYS 8 N -3.76 0.86 0.14 4.98 2.20 -0.61 -0.84 119.74 122.70 3hlr s LYS 8 Ca 0.16 0.58 0.05 0.00 -0.36 0.00 0.00 55.97 56.40 3hlr s LYS 8 Cb 0.03 0.41 -0.04 0.00 -1.51 0.00 0.00 37.83 36.72 3hlr s LYS 8 CO 0.00 -0.18 0.10 0.14 -0.36 0.00 0.00 175.35 175.05 3hlr s VAL 9 N -0.35 4.42 0.68 4.02 -7.23 -1.26 -0.95 120.40 119.73 3hlr s VAL 9 Ca -0.05 -1.01 -0.12 0.00 -1.81 0.00 0.00 61.98 58.98 3hlr s VAL 9 Cb -0.03 -3.21 0.01 0.00 0.56 0.00 0.00 36.38 33.71 3hlr s VAL 9 CO 0.04 -0.03 1.07 -0.83 -0.31 0.00 0.00 175.10 175.04 3hlr s GLY 10 N -2.85 1.82 0.00 2.32 0.00 -0.14 -4.95 107.32 103.53 3hlr s GLY 10 Ca 0.30 0.24 0.00 0.00 0.00 0.00 0.00 44.72 45.25 3hlr s GLY 10 CO 0.22 0.56 0.36 -1.30 0.00 0.00 0.00 173.10 172.94 3hlr n THR 11 N -2.87 0.11 -1.33 0.90 -2.24 -1.26 -4.65 114.28 102.94 3hlr n THR 11 Ca 0.08 -0.31 -0.20 0.00 -2.27 0.00 0.00 64.05 61.36 3hlr n THR 11 Cb 0.53 1.33 0.17 0.00 -2.10 0.00 0.00 70.33 70.26 3hlr n THR 11 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hlr n GLY 12 N -0.06 4.83 0.24 3.38 0.00 -1.26 -4.49 105.19 107.84 3hlr n GLY 12 Ca 0.00 -1.31 0.02 0.00 0.00 0.00 0.00 46.02 44.73 3hlr n GLY 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hlr n LEU 13 N -1.11 2.35 -0.06 0.99 4.77 -1.26 -4.62 117.00 118.07 3hlr n LEU 13 Ca 0.52 -2.02 0.06 0.00 -0.03 0.00 0.00 56.01 54.54 3hlr n LEU 13 Cb 1.36 -0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 42.31 3hlr n LEU 13 CO 0.50 0.59 0.03 -0.46 -1.33 0.00 0.00 177.39 176.72 3hlr n ASN 14 N -0.15 0.73 -1.79 -1.43 0.23 -1.20 -1.16 115.26 110.49 3hlr n ASN 14 Ca 0.05 -0.86 -0.19 0.00 -0.53 0.00 0.00 54.58 53.04 3hlr n ASN 14 Cb 0.32 0.89 0.13 0.00 -2.08 0.00 0.00 39.78 39.04 3hlr n ASN 14 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3hlr n GLY 15 N 1.22 5.44 3.76 4.83 0.00 -1.23 -3.73 105.19 115.48 3hlr n GLY 15 Ca 0.03 -1.81 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 3hlr n GLY 15 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hlr s PHE 16 N -3.48 3.38 0.13 1.61 0.08 -1.02 -4.94 117.98 113.73 3hlr s PHE 16 Ca 0.53 1.55 0.09 0.00 0.12 0.00 0.00 56.93 59.21 3hlr s PHE 16 Cb 0.44 -3.44 -0.04 0.00 -0.57 0.00 0.00 43.02 39.41 3hlr s PHE 16 CO 0.02 -1.12 -0.18 0.20 -0.10 0.00 0.00 175.22 174.04 3hlr s GLY 17 N -0.54 1.69 -0.17 4.36 0.00 -1.26 -1.96 107.32 109.44 3hlr s GLY 17 Ca 0.48 -1.39 -0.34 0.00 0.00 0.00 0.00 44.72 43.47 3hlr s GLY 17 CO 0.44 -1.38 1.16 -1.35 0.00 0.00 0.00 173.10 171.97 3hlr s SER 18 N -2.24 -0.18 0.27 1.64 1.04 -1.15 -4.98 113.70 108.11 3hlr s SER 18 Ca 0.19 0.02 0.10 0.00 0.48 0.00 0.00 55.95 56.74 3hlr s SER 18 Cb -0.10 0.18 -0.05 0.00 0.10 0.00 0.00 66.02 66.15 3hlr s SER 18 CO 0.10 -0.29 -0.16 0.68 0.98 0.00 0.00 173.24 174.55 3hlr s VAL 19 N -2.37 2.21 0.28 5.02 -7.23 -1.26 -1.39 120.40 115.65 3hlr s VAL 19 Ca 0.08 -2.31 0.02 0.00 -1.81 0.00 0.00 61.98 57.95 3hlr s VAL 19 Cb -0.01 -2.29 0.27 0.00 0.56 0.00 0.00 36.38 34.90 3hlr s VAL 19 CO -0.05 -0.41 1.78 -0.07 -0.31 0.00 0.00 175.10 176.03 3hlr h LEU 20 N 2.31 0.69 -2.00 1.32 3.38 -1.91 0.14 115.31 119.23 3hlr h LEU 20 Ca -0.40 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3hlr h LEU 20 Cb 1.25 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3hlr h LEU 20 CO 0.62 0.29 0.00 -1.13 0.09 0.00 0.00 178.44 178.31 3hlr h ASN 21 N 0.73 0.00 0.34 -0.43 -1.24 -1.97 -1.85 115.58 111.17 3hlr h ASN 21 Ca 0.51 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 57.46 3hlr h ASN 21 Cb 0.71 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.75 3hlr h ASN 21 CO -0.35 0.00 -0.29 0.44 -1.29 0.00 0.00 177.43 175.93 3hlr h ASP 22 N 0.00 0.00 -3.83 1.15 3.32 -1.13 -3.45 116.42 112.48 3hlr h ASP 22 Ca 0.00 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.55 3hlr h ASP 22 Cb 0.19 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.76 3hlr h ASP 22 CO 0.00 0.29 0.47 -0.76 -1.72 0.00 0.00 179.24 177.52 3hlr s LEU 23 N -8.18 4.49 0.00 1.55 1.02 -0.70 -4.78 118.68 112.09 3hlr s LEU 23 Ca -0.03 2.24 0.02 0.00 0.02 0.00 0.00 54.13 56.38 3hlr s LEU 23 Cb 0.15 -3.71 0.02 0.00 0.02 0.00 0.00 46.19 42.67 3hlr s LEU 23 CO 0.70 -0.20 0.19 0.35 0.02 0.00 0.00 176.35 177.41 3hlr n THR 24 N 0.99 0.00 -3.76 5.49 -2.24 0.90 -4.44 114.28 111.22 3hlr n THR 24 Ca -0.00 -1.99 -0.23 0.00 -2.27 0.00 0.00 64.05 59.56 3hlr n THR 24 Cb 0.45 0.15 0.02 0.00 -2.10 0.00 0.00 70.33 68.86 3hlr n THR 24 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3hlr n ASN 25 N -1.58 -1.26 -2.51 3.42 5.03 -1.26 -0.88 115.26 116.22 3hlr n ASN 25 Ca -0.10 -0.85 -0.14 0.00 0.87 0.00 0.00 54.58 54.36 3hlr n ASN 25 Cb 0.55 -3.87 0.05 0.00 -1.02 0.00 0.00 39.78 35.49 3hlr n ASN 25 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3hlr n GLY 26 N -1.65 -0.02 2.79 7.41 0.00 -1.26 -3.40 105.19 109.06 3hlr n GLY 26 Ca -0.28 -0.09 -0.18 0.00 0.00 0.00 0.00 46.02 45.47 3hlr n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hlr n GLY 27 N -1.37 -0.29 0.01 -0.02 0.00 -1.00 -4.62 105.19 97.90 3hlr n GLY 27 Ca -0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 46.02 45.93 3hlr n GLY 27 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hlr n THR 28 N -4.29 0.12 -4.09 2.61 -2.24 -0.37 0.08 114.28 106.09 3hlr n THR 28 Ca -0.09 -0.07 -0.35 0.00 -2.27 0.00 0.00 64.05 61.27 3hlr n THR 28 Cb 0.60 -0.94 -0.09 0.00 -2.10 0.00 0.00 70.33 67.79 3hlr n THR 28 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3hlr s LYS 29 N -2.04 3.68 -0.11 -0.78 2.47 -0.06 -0.54 119.74 122.35 3hlr s LYS 29 Ca -0.01 -0.34 -0.02 0.00 -1.56 0.00 0.00 55.97 54.04 3hlr s LYS 29 Cb 0.01 -3.10 0.04 0.00 -1.46 0.00 0.00 37.83 33.31 3hlr s LYS 29 CO 0.07 0.44 0.03 -1.17 0.16 0.00 0.00 175.35 174.88 3hlr s LEU 30 N -0.10 0.65 -0.26 5.43 2.96 0.22 -0.07 118.68 127.51 3hlr s LEU 30 Ca 0.06 -0.33 -0.07 0.00 -0.22 0.00 0.00 54.13 53.57 3hlr s LEU 30 Cb -0.12 -0.41 -0.02 0.00 0.50 0.00 0.00 46.19 46.13 3hlr s LEU 30 CO 0.01 -0.25 0.08 -0.89 -1.32 0.00 0.00 176.35 173.98 3hlr s THR 31 N 1.99 4.29 -0.24 3.68 2.01 -1.26 -0.38 115.64 125.73 3hlr s THR 31 Ca 0.03 -0.26 -0.10 0.00 0.31 0.00 0.00 61.69 61.67 3hlr s THR 31 Cb -0.14 -3.05 -0.05 0.00 0.01 0.00 0.00 72.50 69.27 3hlr s THR 31 CO -0.06 0.28 0.14 -0.63 -0.69 0.00 0.00 174.62 173.66 3hlr s ILE 32 N 1.60 5.10 -0.34 1.82 1.01 0.16 -4.96 121.20 125.59 3hlr s ILE 32 Ca 0.06 0.09 -0.19 0.00 0.00 0.00 0.00 60.65 60.61 3hlr s ILE 32 Cb -0.16 -3.38 -0.00 0.00 0.01 0.00 0.00 42.46 38.93 3hlr s ILE 32 CO 0.04 0.34 0.57 -0.89 0.00 0.00 0.00 174.94 175.00 3hlr s THR 33 N 1.21 4.97 0.01 2.92 2.01 -1.26 -0.43 115.64 125.06 3hlr s THR 33 Ca 0.07 0.53 -0.30 0.00 0.31 0.00 0.00 61.69 62.29 3hlr s THR 33 Cb -0.14 -4.00 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 3hlr s THR 33 CO 0.05 -0.22 1.08 -0.69 -0.69 0.00 0.00 174.62 174.15 3hlr s VAL 34 N 2.52 4.51 -0.11 3.82 1.01 0.09 -4.90 120.40 127.35 3hlr s VAL 34 Ca 0.22 1.80 -0.03 0.00 0.00 0.00 0.00 61.98 63.96 3hlr s VAL 34 Cb -0.15 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 3hlr s VAL 34 CO 0.13 0.13 0.02 0.42 0.00 0.00 0.00 175.10 175.80 3hlr s THR 35 N 1.15 4.50 0.00 3.92 -4.23 -1.26 0.32 115.64 120.04 3hlr s THR 35 Ca 0.55 -0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.89 3hlr s THR 35 Cb -0.24 -2.93 0.00 0.00 1.34 0.00 0.00 72.50 70.67 3hlr s THR 35 CO 0.28 0.58 0.00 0.61 -0.54 0.00 0.00 174.62 175.55 3hlr n GLY 36 N 2.38 -0.26 3.10 3.99 0.00 -1.26 -4.87 105.19 108.27 3hlr n GLY 36 Ca -0.18 -1.85 -0.34 0.00 0.00 0.00 0.00 46.02 43.64 3hlr n GLY 36 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hlr s ASN 37 N -1.18 5.03 -0.26 1.61 0.01 -1.26 -1.12 114.94 117.78 3hlr s ASN 37 Ca 0.00 -1.88 -0.10 0.00 -0.71 0.00 0.00 52.86 50.17 3hlr s ASN 37 Cb 0.00 -1.75 -0.04 0.00 0.41 0.00 0.00 41.25 39.87 3hlr s ASN 37 CO 0.00 -0.43 0.14 -0.54 -1.51 0.00 0.00 177.10 174.76 3hlr s LYS 38 N 1.10 3.86 0.41 -0.60 1.02 -0.27 -4.90 119.74 120.37 3hlr s LYS 38 Ca 0.05 -0.37 -0.25 0.00 0.02 0.00 0.00 55.97 55.42 3hlr s LYS 38 Cb -0.21 -3.52 -0.08 0.00 -0.52 0.00 0.00 37.83 33.49 3hlr s LYS 38 CO -0.04 -0.15 1.21 -1.25 -0.92 0.00 0.00 175.35 174.20 3hlr s PRO 39 N 1.61 3.97 -0.17 -1.68 0.04 -1.26 0.27 135.00 137.78 3hlr s PRO 39 Ca 0.07 1.93 -0.09 0.00 0.04 0.00 0.00 61.00 62.95 3hlr s PRO 39 Cb -0.15 -2.66 -0.07 0.00 0.04 0.00 0.00 34.50 31.65 3hlr s PRO 39 CO 0.08 -0.42 -0.22 -0.89 0.04 0.00 0.00 177.00 175.59 3hlr n ILE 40 N -0.00 0.97 -3.75 0.56 5.41 0.31 -3.71 119.36 119.14 3hlr n ILE 40 Ca 0.05 -0.23 -0.15 0.00 1.00 0.00 0.00 62.75 63.42 3hlr n ILE 40 Cb 0.46 -1.75 -0.15 0.00 -0.71 0.00 0.00 39.64 37.49 3hlr n ILE 40 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 3hlr s LEU 41 N -6.96 0.84 -0.03 1.39 2.96 -0.63 -0.96 118.68 115.28 3hlr s LEU 41 Ca -0.24 0.17 0.05 0.00 -0.22 0.00 0.00 54.13 53.89 3hlr s LEU 41 Cb 0.09 0.13 -0.01 0.00 0.50 0.00 0.00 46.19 46.91 3hlr s LEU 41 CO 0.31 -0.15 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.23 3hlr s LEU 42 N 1.21 2.00 0.04 -0.68 1.43 -0.12 -1.17 118.68 121.38 3hlr s LEU 42 Ca -0.08 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 52.66 3hlr s LEU 42 Cb -0.12 -1.08 -0.02 0.00 0.03 0.00 0.00 46.19 44.99 3hlr s LEU 42 CO -0.04 0.21 -0.09 -0.83 0.23 0.00 0.00 176.35 175.83 3hlr s GLY 43 N -0.22 0.56 0.01 -3.19 0.00 0.21 -1.58 107.32 103.11 3hlr s GLY 43 Ca 0.01 -0.74 -0.28 0.00 0.00 0.00 0.00 44.72 43.70 3hlr s GLY 43 CO 0.01 -0.78 0.69 1.09 0.00 0.00 0.00 173.10 174.11 3hlr s ARG 44 N -1.40 1.08 0.11 2.90 1.70 -0.64 0.05 118.95 122.75 3hlr s ARG 44 Ca -0.06 0.01 -0.30 0.00 -0.47 0.00 0.00 55.73 54.91 3hlr s ARG 44 Cb -0.09 0.51 -0.06 0.00 -0.57 0.00 0.00 34.95 34.74 3hlr s ARG 44 CO 0.01 -0.39 1.02 0.95 -1.08 0.00 0.00 175.30 175.81 3hlr s THR 45 N -2.03 4.34 0.11 4.99 -4.23 -0.60 -0.93 115.64 117.29 3hlr s THR 45 Ca -0.06 1.89 -0.26 0.00 -1.18 0.00 0.00 61.69 62.08 3hlr s THR 45 Cb -0.00 -4.21 -0.07 0.00 1.34 0.00 0.00 72.50 69.55 3hlr s THR 45 CO 0.02 0.27 1.65 0.07 -0.54 0.00 0.00 174.62 176.08 3hlr h LYS 46 N 5.73 -0.38 -4.88 3.99 -0.00 -0.24 -3.45 116.57 117.33 3hlr h LYS 46 Ca -0.43 0.03 -0.41 0.00 -0.00 0.00 0.00 60.65 59.84 3hlr h LYS 46 Cb 1.21 0.09 -0.14 0.00 -0.00 0.00 0.00 32.23 33.39 3hlr h LYS 46 CO 0.73 -0.26 -0.57 -2.00 -0.00 0.00 0.00 179.45 177.36 3hlr s GLU 47 N -6.08 1.57 0.62 0.07 -6.30 -1.26 -5.07 118.70 102.26 3hlr s GLU 47 Ca -0.15 -1.89 -0.16 0.00 -2.50 0.00 0.00 54.97 50.27 3hlr s GLU 47 Cb 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 34.13 34.07 3hlr s GLU 47 CO 0.66 -0.43 1.09 0.00 0.02 0.00 0.00 175.26 176.59 3hlr s ALA 48 N -3.62 2.60 0.16 6.30 0.00 -1.26 -4.87 121.76 121.07 3hlr s ALA 48 Ca 0.36 0.49 -0.12 0.00 0.00 0.00 0.00 51.96 52.69 3hlr s ALA 48 Cb 0.05 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.90 3hlr s ALA 48 CO 0.17 -1.04 0.35 -0.59 0.00 0.00 0.00 175.76 174.64 3hlr s PHE 49 N -2.36 0.16 1.27 0.00 -0.12 -0.86 -4.91 117.98 111.15 3hlr s PHE 49 Ca 0.66 -0.52 -0.19 0.00 -0.05 0.00 0.00 56.93 56.83 3hlr s PHE 49 Cb -0.19 0.10 0.28 0.00 -0.63 0.00 0.00 43.02 42.58 3hlr s PHE 49 CO 0.39 -0.74 0.66 0.00 -0.05 0.00 0.00 175.22 175.47 3hlr n ALA 50 N -0.23 -3.52 -3.27 1.99 0.00 -1.26 -2.24 120.51 111.98 3hlr n ALA 50 Ca -0.10 -1.52 -0.06 0.00 0.00 0.00 0.00 53.44 51.76 3hlr n ALA 50 Cb 0.63 -1.46 -0.05 0.00 0.00 0.00 0.00 19.45 18.58 3hlr n ALA 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3hlr s THR 51 N -2.16 -0.71 0.19 0.00 2.01 -1.25 -4.61 115.64 109.12 3hlr s THR 51 Ca 0.58 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.36 3hlr s THR 51 Cb -0.13 -0.97 0.03 0.00 0.01 0.00 0.00 72.50 71.44 3hlr s THR 51 CO 0.53 -0.23 0.21 -0.81 -0.69 0.00 0.00 174.62 173.64 3hlr n PRO 52 N 5.33 1.02 0.00 4.92 -0.05 -1.26 0.09 135.00 145.04 3hlr n PRO 52 Ca 0.02 -1.10 0.00 0.00 -0.05 0.00 0.00 63.50 62.37 3hlr n PRO 52 Cb 0.50 0.01 0.00 0.00 -0.05 0.00 0.00 33.50 33.96 3hlr n PRO 52 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 175.50 176.78 3hlr n VAL 53 N -1.22 0.00 0.00 0.52 0.24 -1.26 -5.00 118.33 111.61 3hlr n VAL 53 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.33 3hlr n VAL 53 Cb 0.21 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.58 3hlr n VAL 53 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3hlr n ASP 58 N -1.12 0.00 0.00 -1.34 4.64 -1.26 -5.15 116.55 112.32 3hlr n ASP 58 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 3hlr n ASP 58 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 3hlr n ASP 58 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3hlr n GLY 59 N 0.00 0.17 3.57 0.27 0.00 -1.26 -4.49 105.19 103.45 3hlr n GLY 59 Ca 0.00 -1.26 -0.43 0.00 0.00 0.00 0.00 46.02 44.33 3hlr n GLY 59 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hlr s ILE 60 N 0.00 4.49 0.22 -0.61 -1.09 -1.23 -4.87 121.20 118.11 3hlr s ILE 60 Ca 0.00 0.85 -0.30 0.00 -2.23 0.00 0.00 60.65 58.97 3hlr s ILE 60 Cb 0.00 -4.41 -0.09 0.00 -1.58 0.00 0.00 42.46 36.37 3hlr s ILE 60 CO 0.00 -0.77 1.39 -2.84 -1.23 0.00 0.00 174.94 171.49 3hlr s PRO 61 N 3.70 4.32 -0.12 2.79 0.02 -1.26 -0.94 135.00 143.51 3hlr s PRO 61 Ca 0.37 2.19 0.03 0.00 0.02 0.00 0.00 61.00 63.62 3hlr s PRO 61 Cb -0.10 -3.15 0.00 0.00 0.02 0.00 0.00 34.50 31.27 3hlr s PRO 61 CO 0.25 -0.36 -0.23 -1.01 -0.33 0.00 0.00 177.00 175.32 3hlr s HIS 62 N 0.14 2.60 -0.20 6.54 3.76 0.16 -0.80 115.29 127.50 3hlr s HIS 62 Ca 0.59 -1.18 -0.07 0.00 -0.15 0.00 0.00 55.06 54.25 3hlr s HIS 62 Cb -0.40 -1.75 -0.04 0.00 1.11 0.00 0.00 32.58 31.50 3hlr s HIS 62 CO 0.40 -0.50 0.07 0.42 -0.85 0.00 0.00 174.74 174.27 3hlr s ILE 63 N 0.55 4.70 -0.04 0.60 1.01 -0.57 -1.42 121.20 126.02 3hlr s ILE 63 Ca -0.14 -0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.46 3hlr s ILE 63 Cb -0.17 -3.13 0.02 0.00 0.01 0.00 0.00 42.46 39.19 3hlr s ILE 63 CO 0.04 0.43 -0.02 0.00 0.00 0.00 0.00 174.94 175.40 3hlr s ALA 64 N 0.63 0.54 0.04 9.38 0.00 -0.89 -4.32 121.76 127.14 3hlr s ALA 64 Ca 0.03 0.01 0.03 0.00 0.00 0.00 0.00 51.96 52.04 3hlr s ALA 64 Cb -0.13 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 3hlr s ALA 64 CO 0.01 -0.13 -0.00 -0.06 0.00 0.00 0.00 175.76 175.58 3hlr s PHE 65 N 1.17 3.03 0.13 0.00 0.08 -1.26 -0.89 117.98 120.23 3hlr s PHE 65 Ca -0.07 0.03 -0.01 0.00 0.12 0.00 0.00 56.93 56.99 3hlr s PHE 65 Cb -0.14 -1.61 -0.04 0.00 -0.57 0.00 0.00 43.02 40.67 3hlr s PHE 65 CO -0.02 0.46 0.05 0.95 -0.10 0.00 0.00 175.22 176.57 3hlr s THR 66 N -1.18 0.11 0.50 0.64 -4.23 -0.40 -1.15 115.64 109.94 3hlr s THR 66 Ca 0.22 -1.90 0.03 0.00 -1.18 0.00 0.00 61.69 58.86 3hlr s THR 66 Cb -0.12 -2.01 0.09 0.00 1.34 0.00 0.00 72.50 71.80 3hlr s THR 66 CO 0.14 -0.49 0.69 -0.90 -0.54 0.00 0.00 174.62 173.52 3hlr n ASP 67 N -0.08 1.25 0.11 3.99 5.68 0.01 -0.75 116.55 126.76 3hlr n ASP 67 Ca -0.06 -1.98 0.10 0.00 -0.50 0.00 0.00 54.79 52.35 3hlr n ASP 67 Cb 0.64 -0.42 0.46 0.00 -1.14 0.00 0.00 41.12 40.65 3hlr n ASP 67 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hlr n TYR 68 N -2.27 0.62 -0.40 2.11 4.11 -1.24 -1.42 117.16 118.66 3hlr n TYR 68 Ca 0.12 0.27 0.12 0.00 -0.00 0.00 0.00 57.90 58.41 3hlr n TYR 68 Cb 0.45 -0.94 0.33 0.00 -0.00 0.00 0.00 39.34 39.19 3hlr n TYR 68 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 3hlr n GLU 69 N -2.09 2.83 -0.97 -3.48 1.02 -1.26 -4.94 120.64 111.75 3hlr n GLU 69 Ca 0.01 -2.71 0.00 0.00 -0.02 0.00 0.00 57.16 54.44 3hlr n GLU 69 Cb 0.15 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.96 3hlr n GLU 69 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hlr n GLY 70 N 1.64 0.83 3.83 0.62 0.00 -0.51 -5.01 105.19 106.58 3hlr n GLY 70 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 3hlr n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hlr s ALA 71 N -3.38 3.15 0.62 4.61 0.00 -1.26 -4.73 121.76 120.76 3hlr s ALA 71 Ca 0.00 0.26 -0.18 0.00 0.00 0.00 0.00 51.96 52.05 3hlr s ALA 71 Cb 0.00 -3.00 -0.02 0.00 0.00 0.00 0.00 23.12 20.10 3hlr s ALA 71 CO 0.00 0.21 1.17 0.45 0.00 0.00 0.00 175.76 177.59 3hlr s SER 72 N -2.22 5.12 -0.18 0.00 0.15 -1.26 -0.81 113.70 114.50 3hlr s SER 72 Ca 0.59 2.26 -0.01 0.00 0.70 0.00 0.00 55.95 59.49 3hlr s SER 72 Cb -0.09 -2.58 0.05 0.00 -1.71 0.00 0.00 66.02 61.68 3hlr s SER 72 CO 0.15 -1.63 -0.02 -0.69 1.20 0.00 0.00 173.24 172.25 3hlr s VAL 73 N -1.84 0.92 0.06 4.45 1.01 -0.30 -4.74 120.40 119.96 3hlr s VAL 73 Ca 0.74 -0.62 -0.23 0.00 0.00 0.00 0.00 61.98 61.87 3hlr s VAL 73 Cb -0.27 -1.21 -0.06 0.00 0.00 0.00 0.00 36.38 34.84 3hlr s VAL 73 CO 0.35 0.00 0.70 -1.83 0.00 0.00 0.00 175.10 174.32 3hlr s GLU 74 N 1.70 4.42 -0.33 2.72 -1.05 -1.26 -4.29 118.70 120.61 3hlr s GLU 74 Ca -0.00 0.95 -0.18 0.00 -0.15 0.00 0.00 54.97 55.59 3hlr s GLU 74 Cb -0.16 -3.32 -0.01 0.00 -0.44 0.00 0.00 34.13 30.20 3hlr s GLU 74 CO -0.07 0.40 0.51 -1.17 0.95 0.00 0.00 175.26 175.88 3hlr s LEU 75 N -0.43 4.29 -0.02 1.83 2.96 -1.26 -4.48 118.68 121.56 3hlr s LEU 75 Ca 0.35 0.07 0.05 0.00 -0.22 0.00 0.00 54.13 54.38 3hlr s LEU 75 Cb -0.20 -2.60 -0.03 0.00 0.50 0.00 0.00 46.19 43.87 3hlr s LEU 75 CO 0.21 -0.44 -0.18 -0.13 -1.32 0.00 0.00 176.35 174.50 3hlr s ARG 76 N 2.38 2.33 0.33 1.98 0.52 -0.12 -4.64 118.95 121.72 3hlr s ARG 76 Ca 0.19 -0.81 -0.28 0.00 -0.52 0.00 0.00 55.73 54.31 3hlr s ARG 76 Cb -0.15 -2.27 -0.10 0.00 0.52 0.00 0.00 34.95 32.95 3hlr s ARG 76 CO 0.13 0.59 1.19 -0.80 0.02 0.00 0.00 175.30 176.43 3hlr s ASN 77 N -0.86 6.89 0.50 0.23 0.02 -1.26 -0.06 114.94 120.40 3hlr s ASN 77 Ca 0.12 2.44 -0.19 0.00 -1.02 0.00 0.00 52.86 54.21 3hlr s ASN 77 Cb -0.10 -2.63 -0.08 0.00 0.02 0.00 0.00 41.25 38.46 3hlr s ASN 77 CO 0.01 -0.43 1.03 -2.84 0.02 0.00 0.00 177.10 174.90 3hlr s PRO 78 N -1.80 3.76 0.61 -0.60 0.02 -1.26 -4.82 135.00 130.90 3hlr s PRO 78 Ca 0.49 1.28 -0.17 0.00 0.02 0.00 0.00 61.00 62.63 3hlr s PRO 78 Cb -0.34 -2.09 -0.02 0.00 0.02 0.00 0.00 34.50 32.06 3hlr s PRO 78 CO 0.45 -0.46 1.11 -0.51 -0.33 0.00 0.00 177.00 177.26 3hlr s ASP 79 N -2.22 5.38 -0.83 2.53 1.01 -1.26 -3.80 116.67 117.48 3hlr s ASP 79 Ca 0.66 2.05 0.00 0.00 0.71 0.00 0.00 52.55 55.96 3hlr s ASP 79 Cb -0.15 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.22 3hlr s ASP 79 CO 0.23 -1.45 0.00 0.61 0.21 0.00 0.00 175.17 174.78 3hlr n GLY 80 N -0.31 0.92 3.14 0.21 0.00 -1.26 -4.98 105.19 102.91 3hlr n GLY 80 Ca 0.11 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 3hlr n GLY 80 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hlr s GLU 81 N -2.36 2.92 -0.04 1.61 0.41 -1.25 -5.11 118.70 114.87 3hlr s GLU 81 Ca 0.00 -0.89 0.06 0.00 -0.41 0.00 0.00 54.97 53.73 3hlr s GLU 81 Cb 0.00 -2.71 -0.01 0.00 -1.78 0.00 0.00 34.13 29.63 3hlr s GLU 81 CO 0.00 -0.28 -0.22 0.95 -0.49 0.00 0.00 175.26 175.22 3hlr s THR 82 N 1.29 1.82 -1.57 3.63 -4.23 -1.26 -4.55 115.64 110.76 3hlr s THR 82 Ca 0.03 -0.95 0.00 0.00 -1.18 0.00 0.00 61.69 59.59 3hlr s THR 82 Cb -0.14 -1.53 0.00 0.00 1.34 0.00 0.00 72.50 72.16 3hlr s THR 82 CO -0.10 0.51 0.00 -0.62 -0.54 0.00 0.00 174.62 173.87 3hlr n GLU 83 N 2.88 -1.26 0.00 3.99 1.02 0.44 -4.83 120.64 122.88 3hlr n GLU 83 Ca -0.17 0.92 0.04 0.00 -0.02 0.00 0.00 57.16 57.94 3hlr n GLU 83 Cb 0.52 -5.26 -0.03 0.00 -0.02 0.00 0.00 31.44 26.66 3hlr n GLU 83 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3hlr n LYS 84 N -2.57 3.12 -2.97 3.49 5.02 -0.99 -4.42 118.16 118.84 3hlr n LYS 84 Ca -0.18 -0.29 -0.22 0.00 -2.02 0.00 0.00 58.31 55.59 3hlr n LYS 84 Cb 0.61 -0.99 0.03 0.00 -0.02 0.00 0.00 35.03 34.66 3hlr n LYS 84 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hlr n GLY 85 N 1.04 -0.52 3.86 0.72 0.00 0.49 -4.76 105.19 106.02 3hlr n GLY 85 Ca 0.03 0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 3hlr n GLY 85 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hlr s LEU 86 N -6.62 4.16 -0.05 0.99 1.43 -1.26 -1.24 118.68 116.09 3hlr s LEU 86 Ca 0.28 1.06 -0.27 0.00 -1.03 0.00 0.00 54.13 54.17 3hlr s LEU 86 Cb -0.12 -3.76 0.06 0.00 0.03 0.00 0.00 46.19 42.40 3hlr s LEU 86 CO 0.34 -0.09 0.59 0.00 0.23 0.00 0.00 176.35 177.42 3hlr s ALA 87 N -1.82 -1.52 0.20 4.21 0.00 -0.87 -4.35 121.76 117.60 3hlr s ALA 87 Ca 0.48 1.09 0.04 0.00 0.00 0.00 0.00 51.96 53.57 3hlr s ALA 87 Cb -0.11 -0.01 -0.05 0.00 0.00 0.00 0.00 23.12 22.94 3hlr s ALA 87 CO 0.20 -0.34 -0.03 1.52 0.00 0.00 0.00 175.76 177.11 3hlr s TYR 88 N -1.17 1.43 0.02 0.00 -0.85 0.91 0.35 117.35 118.04 3hlr s TYR 88 Ca -0.11 -0.89 -0.10 0.00 -0.52 0.00 0.00 57.07 55.45 3hlr s TYR 88 Cb -0.01 -0.80 0.01 0.00 0.38 0.00 0.00 41.96 41.53 3hlr s TYR 88 CO 0.08 -0.03 0.20 -0.59 -1.52 0.00 0.00 175.55 173.70 3hlr s PHE 89 N -3.42 -0.00 -0.11 -3.49 -0.12 -0.79 -0.94 117.98 109.10 3hlr s PHE 89 Ca 0.24 -0.11 -0.01 0.00 -0.05 0.00 0.00 56.93 57.00 3hlr s PHE 89 Cb 0.05 -0.01 -0.03 0.00 -0.63 0.00 0.00 43.02 42.40 3hlr s PHE 89 CO 0.06 -0.38 -0.05 0.08 -0.05 0.00 0.00 175.22 174.88 3hlr s VAL 90 N -1.91 3.81 -0.03 -2.49 1.01 -1.26 -1.04 120.40 118.49 3hlr s VAL 90 Ca -0.10 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.49 3hlr s VAL 90 Cb -0.04 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.74 3hlr s VAL 90 CO -0.00 0.56 -0.08 -0.76 0.00 0.00 0.00 175.10 174.81 3hlr s LEU 91 N -0.33 1.74 0.45 3.92 2.01 0.14 -4.85 118.68 121.76 3hlr s LEU 91 Ca 0.05 -0.18 -0.24 0.00 0.01 0.00 0.00 54.13 53.77 3hlr s LEU 91 Cb -0.12 -0.53 -0.08 0.00 0.01 0.00 0.00 46.19 45.47 3hlr s LEU 91 CO 0.02 0.05 1.25 -2.16 1.01 0.00 0.00 176.35 176.52 3hlr s PRO 92 N 0.27 3.76 0.27 1.29 0.04 -1.26 0.52 135.00 139.89 3hlr s PRO 92 Ca -0.04 2.00 0.12 0.00 0.04 0.00 0.00 61.00 63.11 3hlr s PRO 92 Cb -0.09 -2.54 -0.05 0.00 0.04 0.00 0.00 34.50 31.86 3hlr s PRO 92 CO 0.00 -0.61 -0.19 0.00 0.04 0.00 0.00 177.00 176.25 3hlr s MET 93 N -2.52 1.72 0.00 4.56 0.23 -0.75 -4.50 119.30 118.04 3hlr s MET 93 Ca 0.62 -1.73 0.00 0.00 -1.03 0.00 0.00 55.69 53.55 3hlr s MET 93 Cb -0.34 -1.81 0.00 0.00 -1.53 0.00 0.00 34.83 31.15 3hlr s MET 93 CO 0.42 0.34 0.00 0.36 -2.03 0.00 0.00 175.02 174.11 3hlr n LYS 94 N -0.59 0.00 0.00 3.16 2.85 0.11 -1.56 118.16 122.12 3hlr n LYS 94 Ca -0.06 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.20 3hlr n LYS 94 Cb 0.60 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.98 3hlr n LYS 94 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 3hlr n ASN 95 N -0.44 0.00 0.00 -5.58 5.15 -0.88 -2.32 115.26 111.19 3hlr n ASN 95 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 3hlr n ASN 95 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 3hlr n ASN 95 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3hlr n ALA 96 N -1.00 0.00 -3.57 5.20 0.00 -1.26 -3.30 120.51 116.58 3hlr n ALA 96 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 3hlr n ALA 96 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 3hlr n ALA 96 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3hlr s GLU 97 N 0.00 3.30 0.00 0.00 -6.30 -1.26 -4.96 118.70 109.48 3hlr s GLU 97 Ca 0.00 -0.67 0.00 0.00 -2.50 0.00 0.00 54.97 51.80 3hlr s GLU 97 Cb 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 34.13 31.15 3hlr s GLU 97 CO 0.00 -0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.47 3hlr n GLY 98 N 4.77 0.00 3.61 -1.50 0.00 -1.25 -4.78 105.19 106.04 3hlr n GLY 98 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 3hlr n GLY 98 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hlr s THR 99 N 0.02 4.88 0.03 2.61 2.01 -1.21 -4.63 115.64 119.35 3hlr s THR 99 Ca 0.00 1.09 -0.35 0.00 0.31 0.00 0.00 61.69 62.75 3hlr s THR 99 Cb 0.00 -4.06 -0.13 0.00 0.01 0.00 0.00 72.50 68.32 3hlr s THR 99 CO 0.00 -0.15 1.68 1.17 -0.69 0.00 0.00 174.62 176.63 3hlr n LYS 100 N 5.99 1.98 0.00 4.92 3.00 -1.26 -2.06 118.16 130.73 3hlr n LYS 100 Ca 0.01 0.72 0.00 0.00 -0.00 0.00 0.00 58.31 59.05 3hlr n LYS 100 Cb 0.48 -2.50 0.00 0.00 0.00 0.00 0.00 35.03 33.02 3hlr n LYS 100 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 3hlr n VAL 101 N 4.05 0.00 0.00 3.15 0.24 -0.60 -4.95 118.33 120.21 3hlr n VAL 101 Ca 0.20 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.25 3hlr n VAL 101 Cb 0.27 1.30 0.00 0.00 -1.47 0.00 0.00 33.84 33.94 3hlr n VAL 101 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hlr n GLY 102 N 0.20 -0.53 3.02 7.63 0.00 -1.20 -0.59 105.19 113.72 3hlr n GLY 102 Ca 0.00 -0.69 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 3hlr n GLY 102 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hlr s SER 103 N -4.00 -0.11 -0.04 1.61 0.15 -0.81 -1.81 113.70 108.70 3hlr s SER 103 Ca 0.00 0.19 0.07 0.00 0.70 0.00 0.00 55.95 56.90 3hlr s SER 103 Cb 0.00 0.26 -0.02 0.00 -1.71 0.00 0.00 66.02 64.55 3hlr s SER 103 CO 0.00 -0.09 -0.24 -0.69 1.20 0.00 0.00 173.24 173.42 3hlr s VAL 104 N -0.15 2.19 -0.16 4.45 1.01 0.18 -1.45 120.40 126.47 3hlr s VAL 104 Ca -0.02 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 3hlr s VAL 104 Cb -0.02 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 3hlr s VAL 104 CO 0.00 0.58 -0.11 -0.75 0.00 0.00 0.00 175.10 174.82 3hlr s LYS 105 N -0.44 3.38 -0.23 2.72 2.20 -0.07 0.29 119.74 127.58 3hlr s LYS 105 Ca 0.05 -0.67 -0.04 0.00 -0.36 0.00 0.00 55.97 54.95 3hlr s LYS 105 Cb -0.12 -2.74 -0.01 0.00 -1.51 0.00 0.00 37.83 33.46 3hlr s LYS 105 CO 0.01 0.09 -0.04 0.08 -0.36 0.00 0.00 175.35 175.14 3hlr s VAL 106 N 0.68 3.39 -0.03 4.02 1.01 -0.21 -1.27 120.40 128.00 3hlr s VAL 106 Ca -0.06 -0.53 -0.20 0.00 0.00 0.00 0.00 61.98 61.20 3hlr s VAL 106 Cb -0.15 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 3hlr s VAL 106 CO 0.02 0.39 0.56 0.20 0.00 0.00 0.00 175.10 176.27 3hlr s ASN 107 N 1.47 6.91 0.04 3.32 0.01 -0.96 -1.89 114.94 123.85 3hlr s ASN 107 Ca 0.05 1.08 -0.00 0.00 -0.71 0.00 0.00 52.86 53.28 3hlr s ASN 107 Cb -0.15 -2.34 0.00 0.00 0.41 0.00 0.00 41.25 39.17 3hlr s ASN 107 CO -0.03 0.10 0.05 0.00 -1.51 0.00 0.00 177.10 175.72 3hlr n ALA 108 N 2.83 -0.02 -3.02 0.60 0.00 0.16 -4.57 120.51 116.48 3hlr n ALA 108 Ca -0.07 -0.20 -0.10 0.00 0.00 0.00 0.00 53.44 53.07 3hlr n ALA 108 Cb 0.51 0.16 -0.11 0.00 0.00 0.00 0.00 19.45 20.01 3hlr n ALA 108 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3hlr s SER 109 N -1.26 0.13 0.13 0.00 0.01 0.76 -2.04 113.70 111.42 3hlr s SER 109 Ca 0.04 -0.32 -0.06 0.00 1.31 0.00 0.00 55.95 56.91 3hlr s SER 109 Cb -0.00 0.14 -0.02 0.00 0.21 0.00 0.00 66.02 66.36 3hlr s SER 109 CO 0.03 -0.30 0.18 -0.72 0.41 0.00 0.00 173.24 172.84 3hlr s TYR 110 N -1.27 0.45 -0.19 2.43 -0.85 -0.37 -1.08 117.35 116.46 3hlr s TYR 110 Ca -0.14 -0.85 -0.29 0.00 -0.52 0.00 0.00 57.07 55.27 3hlr s TYR 110 Cb -0.08 -0.18 0.14 0.00 0.38 0.00 0.00 41.96 42.22 3hlr s TYR 110 CO 0.00 -0.60 1.07 0.00 -1.52 0.00 0.00 175.55 174.50 3hlr s ALA 111 N -3.95 -1.97 -0.07 9.51 0.00 -0.28 -4.75 121.76 120.24 3hlr s ALA 111 Ca 0.15 1.66 0.05 0.00 0.00 0.00 0.00 51.96 53.82 3hlr s ALA 111 Cb 0.05 -0.93 -0.00 0.00 0.00 0.00 0.00 23.12 22.24 3hlr s ALA 111 CO -0.03 -0.29 -0.22 0.20 0.00 0.00 0.00 175.76 175.42 3hlr s GLY 112 N -0.97 1.20 -0.14 0.00 0.00 -1.26 -1.30 107.32 104.85 3hlr s GLY 112 Ca 0.01 -0.90 0.02 0.00 0.00 0.00 0.00 44.72 43.84 3hlr s GLY 112 CO -0.01 -0.41 -0.18 0.00 0.00 0.00 0.00 173.10 172.50 3hlr s ALA 113 N 0.14 2.02 -0.14 3.20 0.00 0.04 -1.29 121.76 125.74 3hlr s ALA 113 Ca -0.11 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 50.91 3hlr s ALA 113 Cb -0.15 -0.99 0.01 0.00 0.00 0.00 0.00 23.12 21.98 3hlr s ALA 113 CO 0.05 -0.16 -0.21 -1.17 0.00 0.00 0.00 175.76 174.27 3hlr s LEU 114 N 1.07 2.18 0.00 0.00 0.20 -0.41 -0.82 118.68 120.91 3hlr s LEU 114 Ca -0.03 -0.57 -0.04 0.00 0.69 0.00 0.00 54.13 54.18 3hlr s LEU 114 Cb -0.14 -1.46 -0.04 0.00 -0.43 0.00 0.00 46.19 44.11 3hlr s LEU 114 CO -0.05 0.10 0.22 -0.83 -0.29 0.00 0.00 176.35 175.49 3hlr s GLY 115 N 0.73 2.21 -0.03 7.98 0.00 0.13 -0.89 107.32 117.44 3hlr s GLY 115 Ca -0.09 -0.69 -0.02 0.00 0.00 0.00 0.00 44.72 43.93 3hlr s GLY 115 CO 0.00 -0.55 0.06 -1.60 0.00 0.00 0.00 173.10 171.02 3hlr s ARG 116 N -1.88 0.05 -0.13 2.90 3.52 -0.23 -1.75 118.95 121.43 3hlr s ARG 116 Ca 0.28 0.13 -0.06 0.00 -0.13 0.00 0.00 55.73 55.95 3hlr s ARG 116 Cb -0.13 -0.04 0.06 0.00 -1.56 0.00 0.00 34.95 33.28 3hlr s ARG 116 CO 0.18 -0.05 0.28 0.20 -0.81 0.00 0.00 175.30 175.10 3hlr s GLY 117 N 0.33 -0.17 0.00 8.12 0.00 -0.18 -0.37 107.32 115.06 3hlr s GLY 117 Ca -0.03 1.08 0.00 0.00 0.00 0.00 0.00 44.72 45.78 3hlr s GLY 117 CO -0.01 1.62 0.00 0.61 0.00 0.00 0.00 173.10 175.32 3hlr n GLY 118 N 4.67 -0.19 0.24 0.20 0.00 -1.26 -0.70 105.19 108.15 3hlr n GLY 118 Ca -0.18 -1.77 0.06 0.00 0.00 0.00 0.00 46.02 44.13 3hlr n GLY 118 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hlr n VAL 119 N -1.05 0.00 0.00 1.61 0.24 -1.26 -4.80 118.33 113.07 3hlr n VAL 119 Ca 0.00 -0.36 0.00 0.00 -2.04 0.00 0.00 64.34 61.94 3hlr n VAL 119 Cb 0.00 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.49 3hlr n VAL 119 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 3hlr n THR 120 N -0.35 0.00 -1.48 3.34 -1.04 -1.26 -4.93 114.28 108.56 3hlr n THR 120 Ca 0.05 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.75 3hlr n THR 120 Cb 0.24 -0.40 0.08 0.00 -1.82 0.00 0.00 70.33 68.43 3hlr n THR 120 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3hlr s SER 121 N -1.00 4.82 0.00 8.00 0.15 -1.26 -4.94 113.70 119.47 3hlr s SER 121 Ca 0.00 1.56 0.09 0.00 0.70 0.00 0.00 55.95 58.29 3hlr s SER 121 Cb 0.00 -2.35 0.27 0.00 -1.71 0.00 0.00 66.02 62.24 3hlr s SER 121 CO 0.00 -1.79 1.22 0.00 1.20 0.00 0.00 173.24 173.86 3hlr n ALA 122 N -3.35 2.47 -3.28 5.45 0.00 -1.25 -4.50 120.51 116.04 3hlr n ALA 122 Ca 0.08 -0.42 -0.33 0.00 0.00 0.00 0.00 53.44 52.77 3hlr n ALA 122 Cb 0.54 -1.00 -0.15 0.00 0.00 0.00 0.00 19.45 18.85 3hlr n ALA 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hlr s ASP 123 N -1.05 3.78 0.02 0.00 1.11 -1.26 -1.59 116.67 117.68 3hlr s ASP 123 Ca 0.17 -0.42 0.00 0.00 0.18 0.00 0.00 52.55 52.49 3hlr s ASP 123 Cb 0.09 -1.58 0.00 0.00 1.07 0.00 0.00 42.92 42.50 3hlr s ASP 123 CO 0.12 0.12 0.00 0.61 1.18 0.00 0.00 175.17 177.20 3hlr n GLY 124 N 3.83 1.81 2.89 0.21 0.00 0.43 -4.70 105.19 109.67 3hlr n GLY 124 Ca -0.19 -2.07 -0.16 0.00 0.00 0.00 0.00 46.02 43.60 3hlr n GLY 124 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hlr s GLU 125 N 0.43 0.39 -0.18 1.61 2.02 0.51 -2.15 118.70 121.33 3hlr s GLU 125 Ca 0.00 -0.07 -0.02 0.00 0.02 0.00 0.00 54.97 54.90 3hlr s GLU 125 Cb 0.00 -0.44 -0.01 0.00 0.10 0.00 0.00 34.13 33.78 3hlr s GLU 125 CO 0.00 -0.00 -0.08 -1.17 0.02 0.00 0.00 175.26 174.02 3hlr s LEU 126 N 0.39 2.83 0.08 1.80 2.96 0.08 -1.06 118.68 125.76 3hlr s LEU 126 Ca -0.04 -0.35 0.04 0.00 -0.22 0.00 0.00 54.13 53.56 3hlr s LEU 126 Cb -0.07 -1.68 -0.03 0.00 0.50 0.00 0.00 46.19 44.90 3hlr s LEU 126 CO -0.01 0.08 -0.11 -0.04 -1.32 0.00 0.00 176.35 174.95 3hlr s MET 127 N 0.89 0.79 -0.14 1.98 -1.94 -0.07 -1.25 119.30 119.56 3hlr s MET 127 Ca -0.02 -1.04 -0.11 0.00 -1.71 0.00 0.00 55.69 52.82 3hlr s MET 127 Cb -0.15 -0.59 -0.05 0.00 2.01 0.00 0.00 34.83 36.06 3hlr s MET 127 CO 0.00 0.11 0.21 0.45 -0.01 0.00 0.00 175.02 175.78 3hlr s SER 128 N -2.11 6.40 0.08 3.03 0.15 -1.26 -1.29 113.70 118.70 3hlr s SER 128 Ca 0.01 0.46 0.02 0.00 0.70 0.00 0.00 55.95 57.14 3hlr s SER 128 Cb -0.06 -2.13 -0.04 0.00 -1.71 0.00 0.00 66.02 62.08 3hlr s SER 128 CO 0.01 0.25 0.12 -0.76 1.20 0.00 0.00 173.24 174.06 3hlr s LEU 129 N -0.22 3.96 0.08 3.45 1.43 -0.41 -0.34 118.68 126.64 3hlr s LEU 129 Ca 0.14 0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.32 3hlr s LEU 129 Cb -0.12 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.44 3hlr s LEU 129 CO 0.03 0.17 -0.06 0.72 0.23 0.00 0.00 176.35 177.44 3hlr s PHE 130 N -1.43 0.79 -0.18 0.29 -0.12 0.01 -4.42 117.98 112.92 3hlr s PHE 130 Ca 0.31 -0.93 -0.04 0.00 -0.05 0.00 0.00 56.93 56.23 3hlr s PHE 130 Cb -0.12 -0.48 0.06 0.00 -0.63 0.00 0.00 43.02 41.85 3hlr s PHE 130 CO 0.24 -0.20 0.06 0.00 -0.05 0.00 0.00 175.22 175.27 3hlr s ALA 131 N -3.56 0.75 -0.08 1.99 0.00 -1.23 -4.16 121.76 115.47 3hlr s ALA 131 Ca 0.09 -0.51 0.18 0.00 0.00 0.00 0.00 51.96 51.73 3hlr s ALA 131 Cb 0.05 -1.10 -0.27 0.00 0.00 0.00 0.00 23.12 21.80 3hlr s ALA 131 CO -0.06 -1.15 0.29 -0.85 0.00 0.00 0.00 175.76 174.00 3hlr n GLU 132 N 5.15 0.76 -4.49 0.00 0.00 -1.26 -4.62 120.64 116.18 3hlr n GLU 132 Ca -0.08 -0.12 -0.24 0.00 0.00 0.00 0.00 57.16 56.73 3hlr n GLU 132 Cb 0.48 -1.46 -0.09 0.00 0.00 0.00 0.00 31.44 30.37 3hlr n GLU 132 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 3hlr s GLY 133 N -4.60 2.39 0.34 -1.84 0.00 -1.26 -5.03 107.32 97.32 3hlr s GLY 133 Ca -0.08 -1.52 0.27 0.00 0.00 0.00 0.00 44.72 43.39 3hlr s GLY 133 CO 0.78 -1.82 1.78 1.48 0.00 0.00 0.00 173.10 175.33 3hlr h SER 134 N 1.92 0.00 1.09 1.64 4.64 -1.98 -1.62 113.55 119.24 3hlr h SER 134 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3hlr h SER 134 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3hlr h SER 134 CO 0.61 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.57 3hlr n HIS 135 N -2.55 0.90 -3.30 4.77 -0.00 -1.26 -4.80 115.22 108.98 3hlr n HIS 135 Ca 0.03 0.31 -0.38 0.00 -0.00 0.00 0.00 57.72 57.67 3hlr n HIS 135 Cb 0.32 -1.00 -0.06 0.00 -0.00 0.00 0.00 29.99 29.26 3hlr n HIS 135 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3hlr s ALA 136 N -3.22 3.48 0.36 1.59 0.00 -0.61 -4.32 121.76 119.04 3hlr s ALA 136 Ca 0.07 -0.15 -0.28 0.00 0.00 0.00 0.00 51.96 51.60 3hlr s ALA 136 Cb 0.11 -2.66 -0.10 0.00 0.00 0.00 0.00 23.12 20.47 3hlr s ALA 136 CO 0.49 0.04 1.36 0.96 0.00 0.00 0.00 175.76 178.61 3hlr s ILE 137 N 0.47 2.49 -1.25 0.00 -4.36 -1.01 -2.15 121.20 115.38 3hlr s ILE 137 Ca 0.27 0.48 0.00 0.00 -0.26 0.00 0.00 60.65 61.14 3hlr s ILE 137 Cb -0.16 -3.30 0.00 0.00 1.25 0.00 0.00 42.46 40.26 3hlr s ILE 137 CO 0.11 0.10 0.00 0.49 0.24 0.00 0.00 174.94 175.89 3hlr n PHE 138 N 0.53 -0.03 -1.68 1.37 3.72 0.02 -4.74 117.46 116.65 3hlr n PHE 138 Ca 0.01 0.00 -0.46 0.00 -0.05 0.00 0.00 57.45 56.95 3hlr n PHE 138 Cb 0.41 -2.23 -0.04 0.00 -0.94 0.00 0.00 39.48 36.68 3hlr n PHE 138 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 3hlr n TYR 139 N -2.74 2.35 0.00 1.38 9.36 -0.92 -0.58 117.16 126.02 3hlr n TYR 139 Ca -0.12 0.10 0.00 0.00 3.32 0.00 0.00 57.90 61.20 3hlr n TYR 139 Cb 0.40 -2.62 0.00 0.00 -0.63 0.00 0.00 39.34 36.50 3hlr n TYR 139 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3hlr n GLY 140 N 3.91 2.79 0.00 2.98 0.00 -1.26 -1.52 105.19 112.09 3hlr n GLY 140 Ca 0.19 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.28 3hlr n GLY 140 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hlr n GLY 141 N -0.81 -0.44 2.89 -0.02 0.00 0.25 -4.69 105.19 102.36 3hlr n GLY 141 Ca 0.00 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 3hlr n GLY 141 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hlr s LEU 142 N -2.80 4.32 0.48 0.99 1.43 -1.08 -4.84 118.68 117.18 3hlr s LEU 142 Ca 0.05 -3.39 -0.23 0.00 -1.03 0.00 0.00 54.13 49.53 3hlr s LEU 142 Cb 0.11 -1.54 -0.07 0.00 0.03 0.00 0.00 46.19 44.72 3hlr s LEU 142 CO 0.62 -0.16 1.20 -2.84 0.23 0.00 0.00 176.35 175.40 3hlr s PRO 143 N -0.79 3.61 -0.05 1.29 0.02 -1.26 -3.55 135.00 134.27 3hlr s PRO 143 Ca 0.21 1.87 0.07 0.00 0.02 0.00 0.00 61.00 63.17 3hlr s PRO 143 Cb -0.14 -2.36 0.10 0.00 0.02 0.00 0.00 34.50 32.12 3hlr s PRO 143 CO -0.09 -0.70 1.00 0.25 -0.33 0.00 0.00 177.00 177.13 3hlr n THR 144 N -0.63 0.74 0.27 0.99 -2.24 -1.26 -4.79 114.28 107.36 3hlr n THR 144 Ca 0.08 -0.87 0.16 0.00 -2.27 0.00 0.00 64.05 61.15 3hlr n THR 144 Cb 0.47 0.29 0.84 0.00 -2.10 0.00 0.00 70.33 69.84 3hlr n THR 144 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3hlr h ASN 145 N 0.00 0.00 -3.18 3.42 -1.07 -1.93 -3.37 115.58 109.46 3hlr h ASN 145 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 56.30 55.76 3hlr h ASN 145 Cb 1.15 0.00 -0.35 0.00 -2.07 0.00 0.00 38.32 37.04 3hlr h ASN 145 CO 0.00 0.00 -0.84 -0.69 0.07 0.00 0.00 177.43 175.97 3hlr s VAL 146 N -3.77 1.60 0.32 6.14 1.01 -1.26 -5.00 120.40 119.44 3hlr s VAL 146 Ca -0.02 -0.68 -0.29 0.00 0.00 0.00 0.00 61.98 60.99 3hlr s VAL 146 Cb 0.09 -1.48 -0.11 0.00 0.00 0.00 0.00 36.38 34.89 3hlr s VAL 146 CO 0.34 0.46 1.47 -0.75 0.00 0.00 0.00 175.10 176.62 3hlr s LYS 147 N 1.24 4.19 -1.23 2.72 2.47 -1.26 -2.90 119.74 124.98 3hlr s LYS 147 Ca -0.00 2.45 -0.04 0.00 -1.56 0.00 0.00 55.97 56.82 3hlr s LYS 147 Cb -0.14 -3.03 0.00 0.00 -1.46 0.00 0.00 37.83 33.21 3hlr s LYS 147 CO -0.07 -0.47 0.51 0.09 0.16 0.00 0.00 175.35 175.58 3hlr n ASN 148 N 1.30 -5.23 0.08 1.43 5.03 -1.26 -4.91 115.26 111.71 3hlr n ASN 148 Ca 0.04 -0.24 -0.10 0.00 0.87 0.00 0.00 54.58 55.15 3hlr n ASN 148 Cb 0.39 -4.06 -0.09 0.00 -1.02 0.00 0.00 39.78 35.01 3hlr n ASN 148 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 3hlr h SER 149 N -1.17 0.19 -4.12 6.41 4.64 -1.77 0.13 113.55 117.85 3hlr h SER 149 Ca -0.43 -0.19 -0.49 0.00 -0.47 0.00 0.00 61.79 60.22 3hlr h SER 149 Cb 1.29 -0.06 0.15 0.00 -0.31 0.00 0.00 62.40 63.47 3hlr h SER 149 CO 0.45 1.10 0.26 -1.83 -0.87 0.00 0.00 176.83 175.94 3hlr s GLU 150 N -2.85 1.44 0.62 4.77 1.03 -1.26 -0.38 118.70 122.07 3hlr s GLU 150 Ca -0.02 0.97 -0.19 0.00 0.03 0.00 0.00 54.97 55.77 3hlr s GLU 150 Cb 0.09 -1.82 -0.02 0.00 -0.80 0.00 0.00 34.13 31.58 3hlr s GLU 150 CO 0.84 -2.16 1.28 -0.51 -1.33 0.00 0.00 175.26 173.38 3hlr s LEU 151 N -6.20 3.62 -0.03 1.83 1.43 -1.26 -3.30 118.68 114.77 3hlr s LEU 151 Ca 0.63 2.59 0.04 0.00 -1.03 0.00 0.00 54.13 56.36 3hlr s LEU 151 Cb -0.18 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.43 3hlr s LEU 151 CO 0.57 -1.87 -0.13 -0.54 0.23 0.00 0.00 176.35 174.61 3hlr s LYS 152 N -3.32 2.48 0.00 1.70 -0.14 -1.26 -4.72 119.74 114.48 3hlr s LYS 152 Ca 0.80 -0.72 0.00 0.00 -1.36 0.00 0.00 55.97 54.70 3hlr s LYS 152 Cb -0.36 -2.40 0.00 0.00 -1.68 0.00 0.00 37.83 33.39 3hlr s LYS 152 CO 0.39 0.62 0.00 0.41 -0.76 0.00 0.00 175.35 176.00 3hlr n GLY 153 N 2.07 0.06 0.35 -3.33 0.00 -0.46 -4.45 105.19 99.43 3hlr n GLY 153 Ca -0.17 -1.17 0.10 0.00 0.00 0.00 0.00 46.02 44.79 3hlr n GLY 153 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3hlr h GLY 154 N 0.00 0.72 1.12 -0.02 0.00 -1.23 -2.11 103.07 101.56 3hlr h GLY 154 Ca 0.00 -0.21 -0.17 0.00 0.00 0.00 0.00 47.33 46.95 3hlr h GLY 154 CO 0.00 0.13 -0.43 0.23 0.00 0.00 0.00 176.54 176.47 3hlr h SER 155 N 0.52 0.98 -0.46 0.19 0.87 -1.85 -0.95 113.55 112.85 3hlr h SER 155 Ca 0.30 -0.49 0.02 0.00 -1.23 0.00 0.00 61.79 60.39 3hlr h SER 155 Cb 0.48 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 62.13 3hlr h SER 155 CO -0.09 1.27 0.27 0.00 -0.53 0.00 0.00 176.83 177.75 3hlr h ALA 156 N 0.73 0.58 -0.03 6.23 0.00 -1.61 -1.17 119.26 123.98 3hlr h ALA 156 Ca 0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3hlr h ALA 156 Cb 1.03 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 3hlr h ALA 156 CO 0.10 -0.05 0.02 0.00 0.00 0.00 0.00 179.25 179.32 3hlr h ALA 157 N 1.21 0.04 -0.90 0.00 0.00 -1.35 -2.76 119.26 115.50 3hlr h ALA 157 Ca 0.18 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.12 3hlr h ALA 157 Cb 0.02 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 3hlr h ALA 157 CO -0.09 -0.40 0.58 0.00 0.00 0.00 0.00 179.25 179.35 3hlr h ALA 158 N 0.90 1.58 -0.03 0.00 0.00 -0.97 -1.48 119.26 119.27 3hlr h ALA 158 Ca 0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 3hlr h ALA 158 Cb 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3hlr h ALA 158 CO -0.00 0.26 -0.40 0.00 0.00 0.00 0.00 179.25 179.10 3hlr h ALA 159 N 1.54 1.28 0.12 0.00 0.00 -1.07 -1.89 119.26 119.24 3hlr h ALA 159 Ca 0.41 -0.38 -0.29 0.00 0.00 0.00 0.00 54.91 54.64 3hlr h ALA 159 Cb 0.32 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.07 3hlr h ALA 159 CO -0.17 0.53 -1.23 -0.09 0.00 0.00 0.00 179.25 178.28 3hlr h ARG 160 N 0.05 0.59 -0.67 0.00 2.43 -1.01 -2.31 114.38 113.45 3hlr h ARG 160 Ca 0.00 -0.79 -0.04 0.00 -0.81 0.00 0.00 59.98 58.34 3hlr h ARG 160 Cb 0.74 0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 30.52 3hlr h ARG 160 CO 0.05 1.35 0.25 1.79 -1.51 0.00 0.00 179.97 181.91 3hlr h THR 161 N 0.26 1.24 -0.12 0.20 1.35 -1.22 -2.59 112.91 112.04 3hlr h THR 161 Ca -0.18 -0.79 -0.01 0.00 -0.55 0.00 0.00 66.41 64.89 3hlr h THR 161 Cb 1.91 0.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.82 3hlr h THR 161 CO 0.23 0.31 0.05 -0.08 -0.25 0.00 0.00 175.52 175.78 3hlr h GLU 162 N 0.96 0.17 -0.64 4.72 4.81 -1.15 0.54 114.58 123.98 3hlr h GLU 162 Ca 0.22 -0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.53 3hlr h GLU 162 Cb 0.23 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.54 3hlr h GLU 162 CO -0.02 0.28 0.43 1.25 -0.73 0.00 0.00 179.01 180.22 3hlr h LEU 163 N 0.03 0.39 0.00 1.64 5.85 -1.26 -1.32 115.31 120.64 3hlr h LEU 163 Ca 0.04 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3hlr h LEU 163 Cb 0.17 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.13 3hlr h LEU 163 CO -0.00 0.23 -0.65 0.49 -0.34 0.00 0.00 178.44 178.17 3hlr n PHE 164 N -4.47 0.06 0.00 1.25 3.72 -0.99 -4.95 117.46 112.08 3hlr n PHE 164 Ca 0.11 0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 3hlr n PHE 164 Cb 0.40 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.69 3hlr n PHE 164 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hlr n GLY 165 N 1.48 1.53 0.00 1.37 0.00 -0.50 -4.53 105.19 104.54 3hlr n GLY 165 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3hlr n GLY 165 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3hlr n SER 166 N 0.00 0.00 -4.77 1.61 2.88 0.18 -4.98 113.62 108.55 3hlr n SER 166 Ca 0.00 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.15 3hlr n SER 166 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 3hlr n SER 166 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3hlr s LEU 167 N 0.00 4.40 0.57 2.46 1.43 -1.26 -4.29 118.68 121.99 3hlr s LEU 167 Ca 0.00 2.19 0.02 0.00 -1.03 0.00 0.00 54.13 55.31 3hlr s LEU 167 Cb 0.00 -3.84 0.05 0.00 0.03 0.00 0.00 46.19 42.44 3hlr s LEU 167 CO 0.00 -0.28 0.80 -0.94 0.23 0.00 0.00 176.35 176.16 3hlr s SER 168 N -1.13 5.12 0.24 2.29 1.04 -1.26 -2.75 113.70 117.24 3hlr s SER 168 Ca 0.50 -0.16 -0.04 0.00 0.48 0.00 0.00 55.95 56.72 3hlr s SER 168 Cb -0.28 -0.62 0.42 0.00 0.10 0.00 0.00 66.02 65.63 3hlr s SER 168 CO 0.36 -1.26 1.77 0.50 0.98 0.00 0.00 173.24 175.59 3hlr h LYS 169 N 0.01 0.59 -0.15 4.02 3.64 -1.96 -0.55 116.57 122.17 3hlr h LYS 169 Ca -0.40 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 58.78 3hlr h LYS 169 Cb 1.29 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.97 3hlr h LYS 169 CO 0.49 0.39 -0.58 -0.91 -2.27 0.00 0.00 179.45 176.56 3hlr h ASN 170 N 0.61 0.54 -0.57 4.20 2.35 -1.98 -1.44 115.58 119.28 3hlr h ASN 170 Ca 0.40 -0.30 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 3hlr h ASN 170 Cb 0.49 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.68 3hlr h ASN 170 CO -0.31 1.00 0.25 0.44 -1.65 0.00 0.00 177.43 177.16 3hlr h ASP 171 N 0.36 0.76 -0.19 5.81 3.32 -1.80 -0.33 116.42 124.34 3hlr h ASP 171 Ca -0.00 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 3hlr h ASP 171 Cb 1.12 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.47 3hlr h ASP 171 CO 0.10 0.70 0.10 0.40 -1.72 0.00 0.00 179.24 178.82 3hlr h ILE 172 N 0.77 1.13 -0.27 0.35 2.04 -0.91 -2.47 117.51 118.15 3hlr h ILE 172 Ca 0.19 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 3hlr h ILE 172 Cb 0.16 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 3hlr h ILE 172 CO -0.02 0.12 0.16 0.25 0.00 0.00 0.00 178.15 178.67 3hlr h LEU 173 N 0.19 0.32 -0.60 1.44 5.85 -1.15 -2.84 115.31 118.52 3hlr h LEU 173 Ca 0.07 -0.05 0.12 0.00 0.84 0.00 0.00 57.88 58.86 3hlr h LEU 173 Cb 0.11 -0.08 -0.11 0.00 0.37 0.00 0.00 40.66 40.95 3hlr h LEU 173 CO -0.01 0.28 -0.09 1.23 -0.34 0.00 0.00 178.44 179.52 3hlr h GLY 174 N 0.34 0.52 0.86 3.75 0.00 -0.89 0.43 103.07 108.09 3hlr h GLY 174 Ca 0.10 0.15 0.03 0.00 0.00 0.00 0.00 47.33 47.60 3hlr h GLY 174 CO -0.02 -0.22 0.28 1.46 0.00 0.00 0.00 176.54 178.04 3hlr h GLN 175 N 0.05 0.54 -0.37 4.80 4.20 -1.31 -2.33 115.11 120.68 3hlr h GLN 175 Ca 0.30 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.95 3hlr h GLN 175 Cb 0.47 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 3hlr h GLN 175 CO -0.57 0.35 0.09 0.82 -0.67 0.00 0.00 178.83 178.85 3hlr h ILE 176 N 0.55 1.17 0.00 2.54 2.04 -0.92 -2.61 117.51 120.28 3hlr h ILE 176 Ca 0.19 -0.61 -0.06 0.00 1.00 0.00 0.00 64.86 65.39 3hlr h ILE 176 Cb 0.03 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 3hlr h ILE 176 CO -0.10 0.22 -0.27 1.56 0.00 0.00 0.00 178.15 179.56 3hlr h GLN 177 N 0.53 0.00 0.00 2.37 4.20 -0.44 -2.09 115.11 119.68 3hlr h GLN 177 Ca 0.12 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.78 3hlr h GLN 177 Cb 0.21 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 3hlr h GLN 177 CO -0.00 0.27 -0.24 0.00 -0.67 0.00 0.00 178.83 178.19 3hlr h ARG 178 N 0.00 0.00 0.00 1.46 -0.00 -1.13 -3.28 114.38 111.43 3hlr h ARG 178 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 3hlr h ARG 178 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.71 3hlr h ARG 178 CO 0.04 0.24 -0.32 0.28 0.00 0.00 0.00 179.97 180.21 3hlr n VAL 179 N -3.64 0.54 -3.20 2.04 0.31 -1.10 -4.84 118.33 108.44 3hlr n VAL 179 Ca -0.01 0.38 -0.45 0.00 -0.01 0.00 0.00 64.34 64.25 3hlr n VAL 179 Cb 0.36 -1.81 -0.05 0.00 -0.91 0.00 0.00 33.84 31.43 3hlr n VAL 179 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3hlr s ASN 180 N -4.60 6.19 0.05 4.52 0.02 -0.80 -4.92 114.94 115.40 3hlr s ASN 180 Ca -0.09 -1.35 0.19 0.00 -1.02 0.00 0.00 52.86 50.58 3hlr s ASN 180 Cb 0.01 -2.26 0.78 0.00 0.02 0.00 0.00 41.25 39.80 3hlr s ASN 180 CO 0.14 -0.94 1.59 0.00 0.02 0.00 0.00 177.10 177.90 3hlr n ALA 181 N 5.91 1.79 0.31 0.60 0.00 -1.24 -2.81 120.51 125.07 3hlr n ALA 181 Ca -0.10 -0.04 0.16 0.00 0.00 0.00 0.00 53.44 53.47 3hlr n ALA 181 Cb 0.43 -1.30 0.67 0.00 0.00 0.00 0.00 19.45 19.24 3hlr n ALA 181 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 3hlr h ASN 182 N 0.00 0.00 -3.23 0.00 -1.07 -1.90 -3.44 115.58 105.95 3hlr h ASN 182 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 56.30 55.81 3hlr h ASN 182 Cb 0.33 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.53 3hlr h ASN 182 CO 0.00 0.00 0.60 -0.63 0.07 0.00 0.00 177.43 177.47 3hlr s ILE 183 N -3.61 4.75 -0.12 6.14 -1.09 -1.12 -3.96 121.20 122.17 3hlr s ILE 183 Ca 0.02 2.02 0.05 0.00 -2.23 0.00 0.00 60.65 60.51 3hlr s ILE 183 Cb 0.09 -4.30 -0.07 0.00 -1.58 0.00 0.00 42.46 36.60 3hlr s ILE 183 CO 0.50 -0.02 0.16 0.35 -1.23 0.00 0.00 174.94 174.71 3hlr n THR 184 N 4.65 0.00 -3.74 2.92 -2.24 -0.62 -4.79 114.28 110.46 3hlr n THR 184 Ca 0.09 -0.25 -0.07 0.00 -2.27 0.00 0.00 64.05 61.55 3hlr n THR 184 Cb 0.48 0.70 -0.02 0.00 -2.10 0.00 0.00 70.33 69.40 3hlr n THR 184 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3hlr s SER 185 N -2.01 -0.30 -0.14 3.42 1.04 -1.23 -5.08 113.70 109.40 3hlr s SER 185 Ca 0.00 -0.42 0.01 0.00 0.48 0.00 0.00 55.95 56.03 3hlr s SER 185 Cb 0.03 0.63 0.02 0.00 0.10 0.00 0.00 66.02 66.80 3hlr s SER 185 CO 0.21 -1.14 -0.17 -0.76 0.98 0.00 0.00 173.24 172.36 3hlr s LEU 186 N -2.87 1.85 0.26 2.42 1.43 -1.26 -0.42 118.68 120.08 3hlr s LEU 186 Ca 0.09 -0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 52.37 3hlr s LEU 186 Cb -0.04 -1.25 -0.10 0.00 0.03 0.00 0.00 46.19 44.83 3hlr s LEU 186 CO 0.01 0.00 1.46 -0.69 0.23 0.00 0.00 176.35 177.37 3hlr s VAL 187 N 1.17 2.57 -0.80 -1.59 1.01 -0.91 -4.66 120.40 117.18 3hlr s VAL 187 Ca -0.01 0.48 -0.25 0.00 0.00 0.00 0.00 61.98 62.19 3hlr s VAL 187 Cb -0.14 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 32.94 3hlr s VAL 187 CO -0.06 0.08 1.64 0.21 0.00 0.00 0.00 175.10 176.97 3hlr s ASN 188 N 0.38 5.73 -0.14 3.32 2.47 -1.26 -0.74 114.94 124.70 3hlr s ASN 188 Ca 0.60 -0.49 -0.28 0.00 0.42 0.00 0.00 52.86 53.10 3hlr s ASN 188 Cb -0.43 -2.55 -0.01 0.00 -1.45 0.00 0.00 41.25 36.81 3hlr s ASN 188 CO 0.44 -2.14 0.97 -0.69 -3.72 0.00 0.00 177.10 171.96 3hlr s VAL 189 N 7.58 4.79 0.92 -5.21 1.01 -0.38 -4.77 120.40 124.34 3hlr s VAL 189 Ca 0.55 1.94 -0.12 0.00 0.00 0.00 0.00 61.98 64.35 3hlr s VAL 189 Cb -0.07 -4.27 0.14 0.00 0.00 0.00 0.00 36.38 32.18 3hlr s VAL 189 CO 0.07 -0.02 1.09 -2.84 0.00 0.00 0.00 175.10 173.41 3hlr s PRO 190 N 2.23 1.05 3.76 2.72 0.02 -1.26 -1.17 135.00 142.36 3hlr s PRO 190 Ca 0.45 0.83 0.00 0.00 0.02 0.00 0.00 61.00 62.30 3hlr s PRO 190 Cb -0.17 -1.78 0.00 0.00 0.02 0.00 0.00 34.50 32.56 3hlr s PRO 190 CO 0.15 -2.39 0.00 0.41 -0.33 0.00 0.00 177.00 174.84 3hlr n GLY 191 N -0.95 0.57 3.24 0.52 0.00 -1.26 -4.60 105.19 102.72 3hlr n GLY 191 Ca 0.07 -0.81 -0.09 0.00 0.00 0.00 0.00 46.02 45.19 3hlr n GLY 191 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hlr s SER 192 N -4.00 0.01 0.07 1.61 1.04 -1.26 -1.35 113.70 109.81 3hlr s SER 192 Ca 0.00 -0.55 0.01 0.00 0.48 0.00 0.00 55.95 55.90 3hlr s SER 192 Cb 0.00 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.47 3hlr s SER 192 CO 0.00 -0.77 -0.06 -0.36 0.98 0.00 0.00 173.24 173.03 3hlr s PHE 193 N -3.84 0.72 -0.87 5.02 0.08 0.54 -4.95 117.98 114.67 3hlr s PHE 193 Ca 0.04 -0.76 -0.02 0.00 0.12 0.00 0.00 56.93 56.32 3hlr s PHE 193 Cb 0.04 -0.44 0.22 0.00 -0.57 0.00 0.00 43.02 42.27 3hlr s PHE 193 CO -0.11 -0.16 0.75 1.21 -0.10 0.00 0.00 175.22 176.81 3hlr s ASN 194 N -2.39 5.96 -0.08 1.36 3.84 -1.26 -0.81 114.94 121.56 3hlr s ASN 194 Ca 0.01 -3.63 -0.30 0.00 0.21 0.00 0.00 52.86 49.16 3hlr s ASN 194 Cb -0.01 -1.91 -0.02 0.00 -0.55 0.00 0.00 41.25 38.76 3hlr s ASN 194 CO -0.03 -0.21 1.12 -0.70 -2.79 0.00 0.00 177.10 174.49 3hlr s GLU 195 N -1.22 4.38 -0.31 0.43 2.56 -1.26 -4.93 118.70 118.34 3hlr s GLU 195 Ca 0.26 1.55 0.08 0.00 0.00 0.00 0.00 54.97 56.86 3hlr s GLU 195 Cb -0.08 -3.56 0.50 0.00 2.00 0.00 0.00 34.13 32.99 3hlr s GLU 195 CO -0.12 -0.40 1.47 0.27 -0.56 0.00 0.00 175.26 175.92 3hlr n ASN 196 N 5.17 2.90 -0.23 -1.70 6.94 -1.26 -2.41 115.26 124.66 3hlr n ASN 196 Ca 0.10 -3.80 0.00 0.00 -0.02 0.00 0.00 54.58 50.86 3hlr n ASN 196 Cb 0.47 -0.63 0.00 0.00 -2.36 0.00 0.00 39.78 37.26 3hlr n ASN 196 CO 0.00 0.00 0.00 0.80 -1.03 0.00 0.00 177.26 177.03 3hlr n MET 197 N -1.08 0.00 -2.77 -3.83 1.56 -1.26 -4.95 117.12 104.78 3hlr n MET 197 Ca 0.36 0.00 -0.11 0.00 -0.27 0.00 0.00 57.70 57.68 3hlr n MET 197 Cb 1.01 0.00 0.05 0.00 2.15 0.00 0.00 33.22 36.44 3hlr n MET 197 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3hlr n ALA 198 N 1.17 -1.72 -3.29 -5.12 0.00 -1.26 -4.93 120.51 105.36 3hlr n ALA 198 Ca 0.00 0.06 -0.46 0.00 0.00 0.00 0.00 53.44 53.04 3hlr n ALA 198 Cb 0.00 -3.46 -0.01 0.00 0.00 0.00 0.00 19.45 15.98 3hlr n ALA 198 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3hlr s TYR 199 N -3.26 3.97 -0.31 0.00 2.02 0.11 -4.59 117.35 115.29 3hlr s TYR 199 Ca 0.22 -2.32 -0.13 0.00 -0.37 0.00 0.00 57.07 54.47 3hlr s TYR 199 Cb -0.03 -3.88 -0.03 0.00 -0.40 0.00 0.00 41.96 37.62 3hlr s TYR 199 CO 0.50 -1.02 0.25 0.95 -1.57 0.00 0.00 175.55 174.66 3hlr s THR 200 N -0.34 5.27 0.15 -0.71 -4.23 -0.82 -3.06 115.64 111.89 3hlr s THR 200 Ca 0.27 0.04 -0.24 0.00 -1.18 0.00 0.00 61.69 60.58 3hlr s THR 200 Cb -0.09 -3.66 0.08 0.00 1.34 0.00 0.00 72.50 70.17 3hlr s THR 200 CO -0.08 0.09 1.05 -0.62 -0.54 0.00 0.00 174.62 174.53 3hlr s ASP 201 N 1.73 -0.04 -0.78 3.99 2.15 -1.26 -4.97 116.67 117.49 3hlr s ASP 201 Ca 0.08 -0.54 -0.01 0.00 0.43 0.00 0.00 52.55 52.51 3hlr s ASP 201 Cb -0.17 0.45 0.36 0.00 -0.30 0.00 0.00 42.92 43.27 3hlr s ASP 201 CO 0.11 -0.88 1.86 0.61 -0.17 0.00 0.00 175.17 176.70 3hlr n GLY 202 N -0.64 5.61 3.69 2.66 0.00 -1.26 -4.89 105.19 110.37 3hlr n GLY 202 Ca -0.04 -2.53 -0.44 0.00 0.00 0.00 0.00 46.02 43.01 3hlr n GLY 202 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hlr n SER 203 N -0.53 3.42 -4.56 1.61 7.64 -1.17 -4.51 113.62 115.52 3hlr n SER 203 Ca 0.51 1.09 -0.30 0.00 1.01 0.00 0.00 58.87 61.18 3hlr n SER 203 Cb 0.31 -1.49 -0.10 0.00 -1.01 0.00 0.00 64.21 61.91 3hlr n SER 203 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3hlr s VAL 204 N 0.71 3.31 0.04 0.44 1.01 0.13 -3.76 120.40 122.28 3hlr s VAL 204 Ca 0.74 -1.17 0.05 0.00 0.00 0.00 0.00 61.98 61.60 3hlr s VAL 204 Cb -0.60 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.26 3hlr s VAL 204 CO 0.39 0.20 -0.14 0.68 0.00 0.00 0.00 175.10 176.24 3hlr s VAL 205 N -1.12 1.11 -0.02 2.92 -7.23 -0.95 -1.01 120.40 114.10 3hlr s VAL 205 Ca 0.19 -0.98 0.05 0.00 -1.81 0.00 0.00 61.98 59.43 3hlr s VAL 205 Cb -0.11 -1.00 -0.01 0.00 0.56 0.00 0.00 36.38 35.82 3hlr s VAL 205 CO 0.11 0.02 -0.17 -0.55 -0.31 0.00 0.00 175.10 174.19 3hlr s SER 206 N -1.10 2.07 -0.03 4.85 0.15 -0.72 -2.04 113.70 116.89 3hlr s SER 206 Ca 0.02 -0.32 -0.06 0.00 0.70 0.00 0.00 55.95 56.29 3hlr s SER 206 Cb -0.08 -0.29 0.01 0.00 -1.71 0.00 0.00 66.02 63.95 3hlr s SER 206 CO 0.01 0.21 0.13 -0.69 1.20 0.00 0.00 173.24 174.10 3hlr s VAL 207 N -0.34 0.04 0.04 4.45 1.01 -1.26 0.18 120.40 124.52 3hlr s VAL 207 Ca 0.05 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.72 3hlr s VAL 207 Cb -0.08 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 3hlr s VAL 207 CO -0.00 -0.20 -0.15 0.00 0.00 0.00 0.00 175.10 174.75 3hlr s ALA 208 N -0.67 1.25 0.03 5.51 0.00 0.00 -1.55 121.76 126.33 3hlr s ALA 208 Ca -0.08 -0.88 0.06 0.00 0.00 0.00 0.00 51.96 51.06 3hlr s ALA 208 Cb -0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 3hlr s ALA 208 CO 0.01 0.24 -0.17 -0.47 0.00 0.00 0.00 175.76 175.36 3hlr s TYR 209 N -0.89 1.49 -0.15 0.00 5.04 0.11 -0.78 117.35 122.17 3hlr s TYR 209 Ca 0.02 -0.35 -0.09 0.00 -2.44 0.00 0.00 57.07 54.21 3hlr s TYR 209 Cb -0.08 -0.90 0.05 0.00 0.35 0.00 0.00 41.96 41.38 3hlr s TYR 209 CO 0.01 0.05 0.37 0.00 -1.34 0.00 0.00 175.55 174.64 3hlr s ALA 210 N -0.75 -0.92 -0.06 3.97 0.00 -0.42 -0.62 121.76 122.96 3hlr s ALA 210 Ca 0.05 1.30 0.03 0.00 0.00 0.00 0.00 51.96 53.34 3hlr s ALA 210 Cb -0.08 -0.79 0.01 0.00 0.00 0.00 0.00 23.12 22.26 3hlr s ALA 210 CO 0.01 -0.23 -0.15 -1.17 0.00 0.00 0.00 175.76 174.23 3hlr s LEU 211 N 1.07 1.79 0.00 0.00 2.96 -0.32 -1.12 118.68 123.05 3hlr s LEU 211 Ca -0.07 -0.33 -0.13 0.00 -0.22 0.00 0.00 54.13 53.38 3hlr s LEU 211 Cb -0.07 -0.89 0.05 0.00 0.50 0.00 0.00 46.19 45.77 3hlr s LEU 211 CO -0.09 0.09 0.64 0.61 -1.32 0.00 0.00 176.35 176.28 3hlr n GLY 212 N 3.50 0.88 3.35 7.98 0.00 -0.24 -0.53 105.19 120.13 3hlr n GLY 212 Ca -0.20 -1.07 -0.38 0.00 0.00 0.00 0.00 46.02 44.37 3hlr n GLY 212 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hlr s ILE 213 N -2.26 4.18 0.40 -0.61 1.01 0.14 -0.17 121.20 123.89 3hlr s ILE 213 Ca 0.14 -0.80 -0.25 0.00 0.00 0.00 0.00 60.65 59.75 3hlr s ILE 213 Cb -0.02 -3.25 -0.09 0.00 0.01 0.00 0.00 42.46 39.11 3hlr s ILE 213 CO 0.04 -0.07 1.10 0.00 0.00 0.00 0.00 174.94 176.01 3hlr s ALA 214 N 1.51 3.12 0.06 9.38 0.00 -1.26 -1.11 121.76 133.45 3hlr s ALA 214 Ca 0.02 0.82 -0.38 0.00 0.00 0.00 0.00 51.96 52.42 3hlr s ALA 214 Cb -0.18 -3.32 -0.18 0.00 0.00 0.00 0.00 23.12 19.44 3hlr s ALA 214 CO 0.04 -0.35 1.19 -1.71 0.00 0.00 0.00 175.76 174.94 3hlr n ASN 215 N 0.03 0.84 0.00 0.00 2.85 -0.27 -1.21 115.26 117.50 3hlr n ASN 215 Ca 0.05 1.14 0.00 0.00 -0.11 0.00 0.00 54.58 55.65 3hlr n ASN 215 Cb 0.48 -1.07 0.00 0.00 1.24 0.00 0.00 39.78 40.43 3hlr n ASN 215 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3hlr n GLY 216 N 2.04 2.92 3.67 8.20 0.00 0.15 -4.95 105.19 117.21 3hlr n GLY 216 Ca 0.19 -0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3hlr n GLY 216 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hlr n GLN 217 N 0.00 -0.03 -4.34 1.61 6.02 -0.35 -4.47 117.38 115.82 3hlr n GLN 217 Ca 0.00 0.07 -0.28 0.00 -0.01 0.00 0.00 57.00 56.78 3hlr n GLN 217 Cb 0.00 -2.38 -0.11 0.00 1.02 0.00 0.00 30.24 28.77 3hlr n GLN 217 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3hlr s THR 218 N -2.29 2.79 -0.17 5.09 -4.23 -1.26 -0.73 115.64 114.84 3hlr s THR 218 Ca 0.71 -1.70 -0.04 0.00 -1.18 0.00 0.00 61.69 59.48 3hlr s THR 218 Cb -0.27 -2.32 -0.02 0.00 1.34 0.00 0.00 72.50 71.22 3hlr s THR 218 CO 0.54 -0.02 -0.04 -0.63 -0.54 0.00 0.00 174.62 173.93 3hlr s ILE 219 N -1.45 3.78 -0.20 2.99 1.01 0.42 -2.27 121.20 125.50 3hlr s ILE 219 Ca 0.21 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.48 3hlr s ILE 219 Cb -0.09 -2.67 0.03 0.00 0.01 0.00 0.00 42.46 39.74 3hlr s ILE 219 CO 0.11 0.48 -0.17 -1.83 0.00 0.00 0.00 174.94 173.53 3hlr s GLU 220 N 0.59 2.75 -0.04 2.79 -1.05 -0.40 0.37 118.70 123.71 3hlr s GLU 220 Ca -0.03 -0.92 -0.02 0.00 -0.15 0.00 0.00 54.97 53.85 3hlr s GLU 220 Cb -0.14 -2.60 -0.04 0.00 -0.44 0.00 0.00 34.13 30.91 3hlr s GLU 220 CO 0.03 -0.30 0.07 0.00 0.95 0.00 0.00 175.26 176.01 3hlr s ALA 221 N 1.27 3.55 -0.07 -0.84 0.00 0.49 -0.90 121.76 125.26 3hlr s ALA 221 Ca 0.02 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.16 3hlr s ALA 221 Cb -0.15 -1.61 0.02 0.00 0.00 0.00 0.00 23.12 21.39 3hlr s ALA 221 CO -0.11 0.66 -0.06 0.95 0.00 0.00 0.00 175.76 177.20 3hlr s THR 222 N -1.10 0.76 0.11 0.00 -4.23 -0.53 -0.61 115.64 110.04 3hlr s THR 222 Ca 0.19 -0.20 -0.08 0.00 -1.18 0.00 0.00 61.69 60.43 3hlr s THR 222 Cb -0.12 -0.78 -0.06 0.00 1.34 0.00 0.00 72.50 72.89 3hlr s THR 222 CO 0.10 0.29 0.41 -0.36 -0.54 0.00 0.00 174.62 174.52 3hlr s PHE 223 N 1.24 3.54 0.01 3.99 0.08 0.30 -1.92 117.98 125.22 3hlr s PHE 223 Ca -0.05 0.73 0.31 0.00 0.12 0.00 0.00 56.93 58.04 3hlr s PHE 223 Cb -0.14 -2.12 1.16 0.00 -0.57 0.00 0.00 43.02 41.35 3hlr s PHE 223 CO -0.02 0.47 1.91 -0.91 -0.10 0.00 0.00 175.22 176.57 3hlr h ASN 224 N 3.34 0.00 -4.85 1.36 2.35 -1.19 -3.45 115.58 113.14 3hlr h ASN 224 Ca -0.48 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.05 3hlr h ASN 224 Cb 1.18 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 39.36 3hlr h ASN 224 CO 0.68 0.02 -0.71 -1.10 -1.65 0.00 0.00 177.43 174.67 3hlr s GLN 225 N -3.59 0.52 0.20 0.81 -1.52 -1.26 -5.09 119.66 109.73 3hlr s GLN 225 Ca 0.02 -0.85 -0.32 0.00 -1.95 0.00 0.00 55.36 52.26 3hlr s GLN 225 Cb 0.08 -0.11 -0.14 0.00 -0.22 0.00 0.00 33.01 32.62 3hlr s GLN 225 CO 0.57 -0.01 1.32 0.00 -0.25 0.00 0.00 175.29 176.92 3hlr n ALA 226 N 1.13 0.28 -2.52 6.09 0.00 -1.26 -4.79 120.51 119.44 3hlr n ALA 226 Ca -0.21 0.44 -0.42 0.00 0.00 0.00 0.00 53.44 53.25 3hlr n ALA 226 Cb 0.56 -2.17 -0.08 0.00 0.00 0.00 0.00 19.45 17.76 3hlr n ALA 226 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3hlr s VAL 227 N -0.04 5.04 0.00 0.00 1.01 0.11 -4.87 120.40 121.66 3hlr s VAL 227 Ca 0.71 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.64 3hlr s VAL 227 Cb -0.74 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 31.62 3hlr s VAL 227 CO 0.50 -0.35 0.27 0.35 0.00 0.00 0.00 175.10 175.87 3hlr n THR 228 N 5.47 0.00 -4.48 3.92 -2.24 -1.26 -4.80 114.28 110.88 3hlr n THR 228 Ca -0.06 -0.37 -0.25 0.00 -2.27 0.00 0.00 64.05 61.09 3hlr n THR 228 Cb 0.48 1.18 -0.08 0.00 -2.10 0.00 0.00 70.33 69.82 3hlr n THR 228 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3hlr s THR 229 N -0.21 0.46 0.17 4.28 -4.23 -1.26 -5.02 115.64 109.83 3hlr s THR 229 Ca 0.00 -2.00 -0.32 0.00 -1.18 0.00 0.00 61.69 58.19 3hlr s THR 229 Cb 0.00 -2.33 -0.12 0.00 1.34 0.00 0.00 72.50 71.39 3hlr s THR 229 CO 0.00 0.00 1.77 -1.20 -0.54 0.00 0.00 174.62 174.65 3hlr n SER 230 N -1.42 4.00 -3.65 3.99 7.64 -1.26 -4.71 113.62 118.20 3hlr n SER 230 Ca -0.04 1.03 -0.15 0.00 1.01 0.00 0.00 58.87 60.72 3hlr n SER 230 Cb 0.64 -1.56 -0.08 0.00 -1.01 0.00 0.00 64.21 62.21 3hlr n SER 230 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3hlr s THR 231 N 1.86 0.02 -0.03 0.44 -1.32 -0.87 -5.00 115.64 110.74 3hlr s THR 231 Ca 0.78 -0.18 0.04 0.00 -1.21 0.00 0.00 61.69 61.13 3hlr s THR 231 Cb -0.50 -0.79 -0.03 0.00 -1.51 0.00 0.00 72.50 69.68 3hlr s THR 231 CO 0.35 -0.10 -0.14 -1.10 -2.21 0.00 0.00 174.62 171.42 3hlr s GLN 232 N -0.85 2.43 0.05 7.08 1.11 -1.26 -0.54 119.66 127.67 3hlr s GLN 232 Ca -0.09 -0.75 0.08 0.00 0.01 0.00 0.00 55.36 54.61 3hlr s GLN 232 Cb -0.03 -2.36 -0.03 0.00 -1.01 0.00 0.00 33.01 29.59 3hlr s GLN 232 CO 0.05 0.61 -0.21 1.67 0.01 0.00 0.00 175.29 177.42 3hlr s TRP 233 N -0.80 1.87 -0.07 0.91 1.48 -0.33 -4.57 118.94 117.43 3hlr s TRP 233 Ca 0.13 -0.38 -0.04 0.00 -1.06 0.00 0.00 56.10 54.75 3hlr s TRP 233 Cb -0.11 -1.11 0.03 0.00 -1.16 0.00 0.00 33.47 31.13 3hlr s TRP 233 CO 0.02 0.10 0.16 0.45 -4.06 0.00 0.00 176.95 173.62 3hlr s SER 234 N -1.23 -0.14 -0.47 -2.66 0.15 -0.98 -2.35 113.70 106.02 3hlr s SER 234 Ca 0.08 0.32 0.05 0.00 0.70 0.00 0.00 55.95 57.10 3hlr s SER 234 Cb -0.09 0.24 0.19 0.00 -1.71 0.00 0.00 66.02 64.65 3hlr s SER 234 CO 0.02 -0.12 0.42 0.00 1.20 0.00 0.00 173.24 174.76 3hlr n ALA 235 N 3.87 2.94 -1.71 5.45 0.00 -0.01 0.06 120.51 131.12 3hlr n ALA 235 Ca -0.22 -3.49 -0.43 0.00 0.00 0.00 0.00 53.44 49.30 3hlr n ALA 235 Cb 0.54 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 19.16 3hlr n ALA 235 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3hlr n PRO 236 N 2.31 2.22 -4.05 0.00 -0.02 -1.26 -4.11 135.00 130.08 3hlr n PRO 236 Ca 0.27 0.78 -0.33 0.00 -2.02 0.00 0.00 63.50 62.20 3hlr n PRO 236 Cb 0.46 -2.40 -0.15 0.00 -0.02 0.00 0.00 33.50 31.40 3hlr n PRO 236 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3hlr s LEU 237 N -1.00 3.20 0.04 2.45 2.96 -0.70 -3.66 118.68 121.97 3hlr s LEU 237 Ca 0.57 -1.19 -0.14 0.00 -0.22 0.00 0.00 54.13 53.15 3hlr s LEU 237 Cb -0.56 -1.56 -0.06 0.00 0.50 0.00 0.00 46.19 44.51 3hlr s LEU 237 CO 0.60 -0.15 0.43 0.20 -1.32 0.00 0.00 176.35 176.12 3hlr s ASN 238 N 1.17 6.80 -0.05 3.68 0.02 0.07 0.18 114.94 126.82 3hlr s ASN 238 Ca -0.05 0.97 0.05 0.00 -1.02 0.00 0.00 52.86 52.81 3hlr s ASN 238 Cb -0.18 -2.25 -0.01 0.00 0.02 0.00 0.00 41.25 38.83 3hlr s ASN 238 CO -0.06 0.27 -0.21 -0.69 0.02 0.00 0.00 177.10 176.42 3hlr s VAL 239 N -1.19 1.76 -0.13 1.60 1.01 -0.36 -1.27 120.40 121.82 3hlr s VAL 239 Ca 0.27 -0.90 -0.00 0.00 0.00 0.00 0.00 61.98 61.35 3hlr s VAL 239 Cb -0.16 -1.50 0.03 0.00 0.00 0.00 0.00 36.38 34.75 3hlr s VAL 239 CO 0.15 0.50 -0.07 0.00 0.00 0.00 0.00 175.10 175.68 3hlr s ALA 240 N -0.05 1.38 -0.15 5.51 0.00 -0.07 -1.42 121.76 126.97 3hlr s ALA 240 Ca -0.04 -0.65 -0.14 0.00 0.00 0.00 0.00 51.96 51.13 3hlr s ALA 240 Cb -0.13 -0.99 -0.05 0.00 0.00 0.00 0.00 23.12 21.95 3hlr s ALA 240 CO 0.03 -0.56 0.30 0.42 0.00 0.00 0.00 175.76 175.95 3hlr s ILE 241 N 1.68 5.30 0.31 0.00 -1.09 -0.39 -2.10 121.20 124.91 3hlr s ILE 241 Ca 0.03 0.56 0.03 0.00 -2.23 0.00 0.00 60.65 59.04 3hlr s ILE 241 Cb -0.14 -3.63 -0.05 0.00 -1.58 0.00 0.00 42.46 37.07 3hlr s ILE 241 CO -0.08 0.41 0.11 0.42 -1.23 0.00 0.00 174.94 174.57 3hlr s THR 242 N 0.29 0.65 -0.15 2.92 -4.23 -0.50 -4.07 115.64 110.53 3hlr s THR 242 Ca 0.17 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.66 3hlr s THR 242 Cb -0.13 -2.60 0.05 0.00 1.34 0.00 0.00 72.50 71.16 3hlr s THR 242 CO 0.05 0.00 0.02 -0.31 -0.54 0.00 0.00 174.62 173.84 3hlr s TYR 243 N -3.53 0.95 -1.60 3.99 2.02 -1.26 0.40 117.35 118.32 3hlr s TYR 243 Ca 0.35 -0.65 0.00 0.00 -0.37 0.00 0.00 57.07 56.39 3hlr s TYR 243 Cb 0.06 -0.97 0.00 0.00 -0.40 0.00 0.00 41.96 40.65 3hlr s TYR 243 CO 0.15 -0.52 0.48 0.98 -1.57 0.00 0.00 175.55 175.07 3hlr n TYR 244 N 5.07 0.00 0.00 2.71 9.36 -0.12 -4.80 117.16 129.39 3hlr n TYR 244 Ca -0.09 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.13 3hlr n TYR 244 Cb 0.48 -0.05 0.00 0.00 -0.63 0.00 0.00 39.34 39.14 3hlr n TYR 244 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3hlr n GLY 254 N -0.98 0.00 3.62 2.98 0.00 -1.26 -3.57 105.19 105.98 3hlr n GLY 254 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3hlr n GLY 254 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3hlr s TRP 255 N 0.00 3.26 -0.14 1.61 0.52 -1.26 -4.69 118.94 118.23 3hlr s TRP 255 Ca 0.00 0.08 -0.13 0.00 0.02 0.00 0.00 56.10 56.07 3hlr s TRP 255 Cb 0.00 -2.22 -0.06 0.00 -1.15 0.00 0.00 33.47 30.04 3hlr s TRP 255 CO 0.00 0.01 -0.27 -0.12 0.02 0.00 0.00 176.95 176.60 3hlr n MET 256 N 4.22 0.41 0.00 4.98 1.56 -0.02 -4.84 117.12 123.43 3hlr n MET 256 Ca -0.16 0.17 0.00 0.00 -0.27 0.00 0.00 57.70 57.44 3hlr n MET 256 Cb 0.52 -1.22 0.00 0.00 2.15 0.00 0.00 33.22 34.67 3hlr n MET 256 CO 0.00 0.00 0.00 -2.37 -0.73 0.00 0.00 175.97 172.87 3hlr n THR 257 N -4.14 0.00 -1.57 1.12 5.66 -1.24 -4.72 114.28 109.38 3hlr n THR 257 Ca -0.20 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.40 3hlr n THR 257 Cb 0.52 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.32 3hlr n THR 257 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3hlr n GLY 258 N -1.95 -0.58 3.53 1.09 0.00 -1.26 -2.20 105.19 103.82 3hlr n GLY 258 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3hlr n GLY 258 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hlr n ASP 259 N 0.22 4.63 -4.67 1.61 9.92 -1.26 -5.01 116.55 121.99 3hlr n ASP 259 Ca 0.11 -2.89 -0.45 0.00 -0.53 0.00 0.00 54.79 51.03 3hlr n ASP 259 Cb 0.43 -1.74 -0.03 0.00 -0.64 0.00 0.00 41.12 39.14 3hlr n ASP 259 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 3hlr n PHE 260 N 9.03 2.17 -4.65 1.24 7.35 -0.94 -4.78 117.46 126.88 3hlr n PHE 260 Ca 0.49 0.39 -0.25 0.00 -0.76 0.00 0.00 57.45 57.32 3hlr n PHE 260 Cb 0.46 -2.48 -0.16 0.00 0.35 0.00 0.00 39.48 37.64 3hlr n PHE 260 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 3hlr s ASN 261 N 0.49 1.89 0.35 -2.13 0.02 -1.26 -1.27 114.94 113.03 3hlr s ASN 261 Ca 0.72 -0.32 -0.01 0.00 -1.02 0.00 0.00 52.86 52.23 3hlr s ASN 261 Cb -0.67 -0.81 0.00 0.00 0.02 0.00 0.00 41.25 39.79 3hlr s ASN 261 CO 0.46 0.06 0.47 -0.83 0.02 0.00 0.00 177.10 177.28 3hlr s GLY 262 N 0.53 1.63 -0.13 0.66 0.00 -0.51 -5.01 107.32 104.50 3hlr s GLY 262 Ca -0.13 -1.60 -0.09 0.00 0.00 0.00 0.00 44.72 42.90 3hlr s GLY 262 CO 0.04 -1.05 0.31 -0.45 0.00 0.00 0.00 173.10 171.95 3hlr s SER 263 N -3.27 -0.35 -0.38 1.64 0.15 -1.26 -1.22 113.70 109.01 3hlr s SER 263 Ca 0.32 0.65 -0.12 0.00 0.70 0.00 0.00 55.95 57.50 3hlr s SER 263 Cb -0.00 0.59 0.03 0.00 -1.71 0.00 0.00 66.02 64.92 3hlr s SER 263 CO 0.22 -0.15 0.22 -0.69 1.20 0.00 0.00 173.24 174.04 3hlr s VAL 264 N 0.82 4.69 -0.22 4.45 1.01 0.13 -4.91 120.40 126.37 3hlr s VAL 264 Ca -0.05 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 60.81 3hlr s VAL 264 Cb -0.06 -3.62 -0.00 0.00 0.00 0.00 0.00 36.38 32.70 3hlr s VAL 264 CO -0.06 -0.25 1.21 -0.62 0.00 0.00 0.00 175.10 175.39 3hlr s ASP 265 N 1.57 6.92 -0.12 3.32 2.15 -1.26 -1.73 116.67 127.53 3hlr s ASP 265 Ca 0.03 1.48 0.03 0.00 0.43 0.00 0.00 52.55 54.52 3hlr s ASP 265 Cb -0.19 -2.54 0.01 0.00 -0.30 0.00 0.00 42.92 39.90 3hlr s ASP 265 CO 0.07 -0.81 -0.21 -0.63 -0.17 0.00 0.00 175.17 173.42 3hlr s ILE 266 N 3.62 1.92 -3.12 4.11 1.01 -1.26 -3.27 121.20 124.22 3hlr s ILE 266 Ca 0.52 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 60.26 3hlr s ILE 266 Cb -0.19 -1.70 0.00 0.00 0.01 0.00 0.00 42.46 40.59 3hlr s ILE 266 CO 0.14 0.53 0.00 0.61 0.00 0.00 0.00 174.94 176.22 3hlr n GLY 267 N 3.95 -0.86 0.00 6.18 0.00 -0.31 -0.83 105.19 113.33 3hlr n GLY 267 Ca -0.20 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.84 3hlr n GLY 267 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hlr n GLY 268 N 0.00 -1.10 3.08 -0.02 0.00 -0.99 -2.44 105.19 103.72 3hlr n GLY 268 Ca 0.00 -0.85 -0.26 0.00 0.00 0.00 0.00 46.02 44.91 3hlr n GLY 268 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hlr s SER 269 N -4.00 2.07 -0.39 1.61 1.04 -0.83 -1.18 113.70 112.01 3hlr s SER 269 Ca 0.00 -0.35 -0.19 0.00 0.48 0.00 0.00 55.95 55.89 3hlr s SER 269 Cb 0.00 -0.84 0.01 0.00 0.10 0.00 0.00 66.02 65.29 3hlr s SER 269 CO 0.00 0.09 0.53 -0.63 0.98 0.00 0.00 173.24 174.20 3hlr s ILE 270 N 0.43 4.98 -0.11 -1.02 1.01 0.30 -2.92 121.20 123.88 3hlr s ILE 270 Ca -0.12 0.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.52 3hlr s ILE 270 Cb -0.15 -4.05 -0.05 0.00 0.01 0.00 0.00 42.46 38.23 3hlr s ILE 270 CO 0.04 -0.37 0.25 0.28 0.00 0.00 0.00 174.94 175.14 3hlr s THR 271 N 2.44 5.32 -1.04 2.92 -1.32 -0.49 -2.05 115.64 121.43 3hlr s THR 271 Ca 0.18 0.47 0.08 0.00 -1.21 0.00 0.00 61.69 61.21 3hlr s THR 271 Cb -0.15 -3.56 0.07 0.00 -1.51 0.00 0.00 72.50 67.35 3hlr s THR 271 CO 0.15 0.52 0.76 0.00 -2.21 0.00 0.00 174.62 173.84