#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oc3 n ALA 1 N 0.00 -0.04 -1.80 7.33 0.00 -1.26 -4.46 120.51 120.28 1oc3 n ALA 1 Ca 0.00 0.41 -0.41 0.00 0.00 0.00 0.00 53.44 53.44 1oc3 n ALA 1 Cb 0.00 -2.08 -0.01 0.00 0.00 0.00 0.00 19.45 17.35 1oc3 n ALA 1 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1oc3 s PRO 2 N -1.04 4.20 0.70 0.00 0.02 -1.26 -4.14 135.00 133.48 1oc3 s PRO 2 Ca 0.64 2.43 -0.15 0.00 0.02 0.00 0.00 61.00 63.94 1oc3 s PRO 2 Cb -0.73 -3.04 0.02 0.00 0.02 0.00 0.00 34.50 30.78 1oc3 s PRO 2 CO 0.56 -0.47 1.19 -1.50 -0.33 0.00 0.00 177.00 176.45 1oc3 s ILE 3 N -0.50 2.53 0.05 2.83 2.07 -0.54 -4.98 121.20 122.67 1oc3 s ILE 3 Ca 0.57 0.26 -0.08 0.00 -1.41 0.00 0.00 60.65 59.99 1oc3 s ILE 3 Cb -0.44 -2.84 -0.00 0.00 0.13 0.00 0.00 42.46 39.31 1oc3 s ILE 3 CO 0.51 -0.14 0.17 -0.54 -1.91 0.00 0.00 174.94 173.04 1oc3 s LYS 4 N -3.89 0.72 0.14 3.50 1.02 -1.26 -5.08 119.74 114.89 1oc3 s LYS 4 Ca 0.73 -0.76 -0.33 0.00 0.02 0.00 0.00 55.97 55.63 1oc3 s LYS 4 Cb -0.27 0.29 -0.17 0.00 -0.52 0.00 0.00 37.83 37.16 1oc3 s LYS 4 CO 0.43 -0.21 1.03 0.28 -0.92 0.00 0.00 175.35 175.96 1oc3 n VAL 5 N 0.46 0.92 0.00 3.17 0.31 -1.26 -1.15 118.33 120.78 1oc3 n VAL 5 Ca -0.18 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 1oc3 n VAL 5 Cb 0.60 -0.52 0.00 0.00 -0.91 0.00 0.00 33.84 33.00 1oc3 n VAL 5 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1oc3 n GLY 6 N 1.89 3.11 3.86 2.92 0.00 0.25 -4.98 105.19 112.24 1oc3 n GLY 6 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1oc3 n GLY 6 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1oc3 s ASP 7 N -1.13 5.49 0.02 1.61 1.01 -0.30 -4.68 116.67 118.69 1oc3 s ASP 7 Ca 0.00 1.29 -0.15 0.00 0.71 0.00 0.00 52.55 54.41 1oc3 s ASP 7 Cb 0.00 -2.16 -0.06 0.00 1.01 0.00 0.00 42.92 41.71 1oc3 s ASP 7 CO 0.00 -1.33 0.42 0.00 0.21 0.00 0.00 175.17 174.47 1oc3 s ALA 8 N -3.24 3.69 0.13 5.23 0.00 -1.26 -0.04 121.76 126.26 1oc3 s ALA 8 Ca 0.58 -0.21 -0.33 0.00 0.00 0.00 0.00 51.96 51.99 1oc3 s ALA 8 Cb -0.12 -2.40 -0.13 0.00 0.00 0.00 0.00 23.12 20.48 1oc3 s ALA 8 CO 0.53 0.48 1.69 -0.89 0.00 0.00 0.00 175.76 177.58 1oc3 n ILE 9 N 1.68 0.15 -2.53 0.00 2.08 -0.29 -4.92 119.36 115.53 1oc3 n ILE 9 Ca -0.13 -0.03 -0.34 0.00 0.56 0.00 0.00 62.75 62.81 1oc3 n ILE 9 Cb 0.52 -1.77 -0.03 0.00 -0.75 0.00 0.00 39.64 37.61 1oc3 n ILE 9 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1oc3 s PRO 10 N 1.74 3.83 -0.67 0.38 0.04 -1.26 -4.70 135.00 134.35 1oc3 s PRO 10 Ca 0.81 1.40 -0.06 0.00 0.04 0.00 0.00 61.00 63.18 1oc3 s PRO 10 Cb -0.61 -2.15 -0.12 0.00 0.04 0.00 0.00 34.50 31.65 1oc3 s PRO 10 CO 0.39 -0.41 2.57 0.00 0.04 0.00 0.00 177.00 179.58 1oc3 n ALA 11 N -0.86 5.38 -2.58 8.56 0.00 -1.26 -4.09 120.51 125.67 1oc3 n ALA 11 Ca 0.09 -2.02 -0.38 0.00 0.00 0.00 0.00 53.44 51.12 1oc3 n ALA 11 Cb 0.52 -2.78 -0.06 0.00 0.00 0.00 0.00 19.45 17.14 1oc3 n ALA 11 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1oc3 s VAL 12 N 2.35 5.02 -0.07 0.00 1.01 -1.26 -4.83 120.40 122.62 1oc3 s VAL 12 Ca 0.50 1.12 -0.30 0.00 0.00 0.00 0.00 61.98 63.29 1oc3 s VAL 12 Cb 0.17 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 1oc3 s VAL 12 CO -0.02 0.40 1.03 -1.61 0.00 0.00 0.00 175.10 174.89 1oc3 s GLU 13 N 0.03 4.44 0.41 2.72 0.41 -1.26 -1.35 118.70 124.10 1oc3 s GLU 13 Ca 0.29 1.44 0.05 0.00 -0.41 0.00 0.00 54.97 56.34 1oc3 s GLU 13 Cb -0.17 -3.52 -0.02 0.00 -1.78 0.00 0.00 34.13 28.64 1oc3 s GLU 13 CO 0.15 -0.28 0.18 0.14 -0.49 0.00 0.00 175.26 174.96 1oc3 s VAL 14 N 1.82 0.37 0.13 2.63 -7.23 0.12 -4.96 120.40 113.29 1oc3 s VAL 14 Ca 0.50 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.72 1oc3 s VAL 14 Cb -0.20 -2.32 -0.04 0.00 0.56 0.00 0.00 36.38 34.38 1oc3 s VAL 14 CO 0.21 0.00 -0.12 -0.36 -0.31 0.00 0.00 175.10 174.51 1oc3 s PHE 15 N -3.22 1.33 -0.14 2.82 0.40 -0.32 -0.72 117.98 118.14 1oc3 s PHE 15 Ca 0.26 -0.64 -0.03 0.00 -0.60 0.00 0.00 56.93 55.92 1oc3 s PHE 15 Cb 0.01 -0.68 0.05 0.00 0.51 0.00 0.00 43.02 42.91 1oc3 s PHE 15 CO 0.18 0.12 0.06 -2.00 0.70 0.00 0.00 175.22 174.28 1oc3 s GLU 16 N -3.15 0.25 0.00 0.44 2.12 -0.33 0.33 118.70 118.36 1oc3 s GLU 16 Ca 0.12 -0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.41 1oc3 s GLU 16 Cb -0.02 -1.51 0.00 0.00 0.26 0.00 0.00 34.13 32.87 1oc3 s GLU 16 CO 0.02 -0.54 0.00 0.41 -0.54 0.00 0.00 175.26 174.61 1oc3 n GLY 17 N 5.21 2.44 3.51 -1.50 0.00 -1.26 -4.49 105.19 109.11 1oc3 n GLY 17 Ca -0.07 -0.57 -0.11 0.00 0.00 0.00 0.00 46.02 45.28 1oc3 n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oc3 s GLU 18 N 0.00 1.37 0.55 1.61 2.02 -1.26 -4.30 118.70 118.70 1oc3 s GLU 18 Ca 0.00 -0.57 0.36 0.00 0.02 0.00 0.00 54.97 54.78 1oc3 s GLU 18 Cb 0.00 0.59 1.75 0.00 0.10 0.00 0.00 34.13 36.57 1oc3 s GLU 18 CO 0.00 -0.61 2.09 -1.35 0.02 0.00 0.00 175.26 175.41 1oc3 h PRO 19 N 2.00 0.00 0.00 0.39 0.11 -1.89 -1.95 132.00 130.66 1oc3 h PRO 19 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1oc3 h PRO 19 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1oc3 h PRO 19 CO 0.35 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.55 1oc3 n GLY 20 N -0.53 -1.35 3.23 -0.55 0.00 -1.26 -4.59 105.19 100.14 1oc3 n GLY 20 Ca -0.01 0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1oc3 n GLY 20 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1oc3 s ASN 21 N -3.99 5.45 0.09 1.61 0.01 -0.73 -5.07 114.94 112.31 1oc3 s ASN 21 Ca 0.07 -1.57 -0.02 0.00 -0.71 0.00 0.00 52.86 50.63 1oc3 s ASN 21 Cb 0.11 -1.91 -0.05 0.00 0.41 0.00 0.00 41.25 39.81 1oc3 s ASN 21 CO 0.43 -0.49 0.28 -0.54 -1.51 0.00 0.00 177.10 175.27 1oc3 s LYS 22 N 1.34 3.52 -0.04 -0.60 1.02 -1.26 -1.19 119.74 122.53 1oc3 s LYS 22 Ca 0.03 -0.27 0.01 0.00 0.02 0.00 0.00 55.97 55.76 1oc3 s LYS 22 Cb -0.22 -2.96 0.02 0.00 -0.52 0.00 0.00 37.83 34.15 1oc3 s LYS 22 CO 0.00 0.55 -0.03 0.08 -0.92 0.00 0.00 175.35 175.04 1oc3 s VAL 23 N -1.56 0.42 -0.33 3.17 1.01 0.10 -4.92 120.40 118.29 1oc3 s VAL 23 Ca 0.37 -0.03 -0.22 0.00 0.00 0.00 0.00 61.98 62.10 1oc3 s VAL 23 Cb -0.13 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.78 1oc3 s VAL 23 CO 0.26 0.21 0.74 0.21 0.00 0.00 0.00 175.10 176.52 1oc3 s ASN 24 N 1.10 6.57 0.39 3.32 3.84 -1.26 -0.71 114.94 128.20 1oc3 s ASN 24 Ca -0.08 0.46 0.09 0.00 0.21 0.00 0.00 52.86 53.54 1oc3 s ASN 24 Cb -0.14 -2.38 0.87 0.00 -0.55 0.00 0.00 41.25 39.05 1oc3 s ASN 24 CO -0.01 -0.63 1.96 -0.07 -2.79 0.00 0.00 177.10 175.56 1oc3 h LEU 25 N 9.49 0.54 -0.41 3.21 3.38 -1.48 -0.70 115.31 129.34 1oc3 h LEU 25 Ca -0.25 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 1oc3 h LEU 25 Cb 1.10 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1oc3 h LEU 25 CO 0.87 0.33 0.06 0.00 0.09 0.00 0.00 178.44 179.80 1oc3 h ALA 26 N 1.64 0.54 -0.66 1.53 0.00 -1.81 -3.04 119.26 117.47 1oc3 h ALA 26 Ca 0.31 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1oc3 h ALA 26 Cb 0.43 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1oc3 h ALA 26 CO -0.10 0.26 0.29 0.93 0.00 0.00 0.00 179.25 180.63 1oc3 h GLU 27 N 0.52 0.96 -0.88 0.00 5.08 -1.68 -2.87 114.58 115.72 1oc3 h GLU 27 Ca 0.12 -0.16 0.17 0.00 -1.00 0.00 0.00 59.36 58.50 1oc3 h GLU 27 Cb 0.38 -0.17 -0.10 0.00 0.50 0.00 0.00 28.75 29.36 1oc3 h GLU 27 CO 0.01 0.78 0.45 1.25 -1.00 0.00 0.00 179.01 180.50 1oc3 h LEU 28 N 0.92 0.51 -2.65 1.33 5.85 -1.06 -2.44 115.31 117.76 1oc3 h LEU 28 Ca 0.22 0.11 0.00 0.00 0.84 0.00 0.00 57.88 59.05 1oc3 h LEU 28 Cb 0.15 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1oc3 h LEU 28 CO -0.02 0.17 0.00 0.49 -0.34 0.00 0.00 178.44 178.73 1oc3 n PHE 29 N -4.90 0.84 -2.35 1.25 3.72 -1.19 -4.95 117.46 109.88 1oc3 n PHE 29 Ca 0.19 -0.44 -0.41 0.00 -0.05 0.00 0.00 57.45 56.74 1oc3 n PHE 29 Cb 0.51 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.02 1oc3 n PHE 29 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1oc3 s LYS 30 N -1.11 4.47 -0.21 -1.08 2.20 -0.92 -3.08 119.74 120.01 1oc3 s LYS 30 Ca 0.45 1.90 0.00 0.00 -0.36 0.00 0.00 55.97 57.96 1oc3 s LYS 30 Cb 0.24 -3.24 0.00 0.00 -1.51 0.00 0.00 37.83 33.32 1oc3 s LYS 30 CO 0.32 -0.12 0.00 0.41 -0.36 0.00 0.00 175.35 175.60 1oc3 n GLY 31 N 2.27 0.55 3.17 5.54 0.00 -1.26 -4.95 105.19 110.51 1oc3 n GLY 31 Ca 0.05 -0.51 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 1oc3 n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oc3 s LYS 32 N -1.42 0.83 -0.18 1.61 1.02 -1.21 -4.92 119.74 115.47 1oc3 s LYS 32 Ca 0.00 -1.22 -0.08 0.00 0.02 0.00 0.00 55.97 54.70 1oc3 s LYS 32 Cb 0.00 0.27 -0.04 0.00 -0.52 0.00 0.00 37.83 37.54 1oc3 s LYS 32 CO 0.00 -0.23 0.07 0.21 -0.92 0.00 0.00 175.35 174.48 1oc3 s LYS 33 N -3.95 4.01 0.23 1.68 2.20 -1.26 0.32 119.74 122.96 1oc3 s LYS 33 Ca 0.13 -0.32 -0.02 0.00 -0.36 0.00 0.00 55.97 55.39 1oc3 s LYS 33 Cb 0.06 -3.24 -0.03 0.00 -1.51 0.00 0.00 37.83 33.11 1oc3 s LYS 33 CO -0.05 0.28 0.22 0.20 -0.36 0.00 0.00 175.35 175.64 1oc3 s GLY 34 N 0.35 1.39 -0.05 5.54 0.00 0.74 -0.78 107.32 114.50 1oc3 s GLY 34 Ca 0.04 -1.60 0.04 0.00 0.00 0.00 0.00 44.72 43.19 1oc3 s GLY 34 CO -0.00 -1.27 -0.16 0.14 0.00 0.00 0.00 173.10 171.81 1oc3 s VAL 35 N -4.02 1.37 -0.08 1.40 1.01 -0.30 -0.42 120.40 119.36 1oc3 s VAL 35 Ca 0.36 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.72 1oc3 s VAL 35 Cb 0.05 -1.20 0.00 0.00 0.00 0.00 0.00 36.38 35.23 1oc3 s VAL 35 CO 0.14 0.40 -0.21 -0.22 0.00 0.00 0.00 175.10 175.20 1oc3 s LEU 36 N 0.27 1.99 0.07 3.92 2.96 -0.74 -1.36 118.68 125.79 1oc3 s LEU 36 Ca -0.09 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.37 1oc3 s LEU 36 Cb -0.13 -1.26 -0.03 0.00 0.50 0.00 0.00 46.19 45.26 1oc3 s LEU 36 CO 0.03 0.14 -0.12 0.72 -1.32 0.00 0.00 176.35 175.81 1oc3 s PHE 37 N 0.33 1.02 0.10 5.38 -0.71 0.42 0.01 117.98 124.53 1oc3 s PHE 37 Ca -0.15 -0.51 0.10 0.00 -1.04 0.00 0.00 56.93 55.33 1oc3 s PHE 37 Cb -0.17 -0.58 -0.04 0.00 -1.21 0.00 0.00 43.02 41.03 1oc3 s PHE 37 CO 0.07 0.00 -0.25 0.20 -1.34 0.00 0.00 175.22 173.91 1oc3 s GLY 38 N -1.81 1.55 0.05 1.99 0.00 -0.14 -0.29 107.32 108.66 1oc3 s GLY 38 Ca -0.03 -1.37 0.04 0.00 0.00 0.00 0.00 44.72 43.36 1oc3 s GLY 38 CO 0.01 -1.32 -0.13 -1.34 0.00 0.00 0.00 173.10 170.32 1oc3 s VAL 39 N -0.99 1.01 0.38 1.40 -7.23 -0.06 -2.85 120.40 112.05 1oc3 s VAL 39 Ca 0.14 -1.05 0.09 0.00 -1.81 0.00 0.00 61.98 59.35 1oc3 s VAL 39 Cb -0.10 -0.95 0.31 0.00 0.56 0.00 0.00 36.38 36.20 1oc3 s VAL 39 CO 0.06 -0.10 1.94 -0.65 -0.31 0.00 0.00 175.10 176.04 1oc3 h PRO 40 N 4.76 0.62 -1.28 4.82 0.11 -1.82 -3.40 132.00 135.80 1oc3 h PRO 40 Ca -0.38 -0.04 0.16 0.00 0.11 0.00 0.00 66.00 65.85 1oc3 h PRO 40 Cb 1.19 -0.14 -0.28 0.00 0.11 0.00 0.00 31.00 31.88 1oc3 h PRO 40 CO 0.43 0.41 0.74 0.20 -0.21 0.00 0.00 178.00 179.57 1oc3 s GLY 41 N -3.66 0.03 0.68 -0.55 0.00 -1.26 -4.44 107.32 98.12 1oc3 s GLY 41 Ca -0.09 2.81 -0.16 0.00 0.00 0.00 0.00 44.72 47.28 1oc3 s GLY 41 CO 0.77 1.46 1.19 0.00 0.00 0.00 0.00 173.10 176.52 1oc3 s ALA 42 N -0.51 2.31 0.00 3.20 0.00 -1.26 -2.73 121.76 122.77 1oc3 s ALA 42 Ca 0.05 0.85 0.00 0.00 0.00 0.00 0.00 51.96 52.86 1oc3 s ALA 42 Cb -0.03 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.66 1oc3 s ALA 42 CO -0.07 -1.54 0.00 1.19 0.00 0.00 0.00 175.76 175.33 1oc3 n PHE 43 N -2.32 0.00 -2.78 0.00 3.72 -1.26 -5.00 117.46 109.82 1oc3 n PHE 43 Ca 0.13 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.23 1oc3 n PHE 43 Cb 0.50 -1.59 -0.03 0.00 -0.94 0.00 0.00 39.48 37.43 1oc3 n PHE 43 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1oc3 s THR 44 N -1.23 4.77 0.10 4.37 -4.23 -1.11 -4.94 115.64 113.38 1oc3 s THR 44 Ca 0.00 0.64 -0.31 0.00 -1.18 0.00 0.00 61.69 60.83 1oc3 s THR 44 Cb 0.00 -3.75 -0.12 0.00 1.34 0.00 0.00 72.50 69.97 1oc3 s THR 44 CO 0.00 -0.58 1.60 -0.65 -0.54 0.00 0.00 174.62 174.46 1oc3 h PRO 45 N 1.11 -0.70 -0.23 3.99 0.11 -1.94 -0.70 132.00 133.63 1oc3 h PRO 45 Ca -0.47 0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.66 1oc3 h PRO 45 Cb 1.19 0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.45 1oc3 h PRO 45 CO 0.63 -0.47 0.03 0.78 -0.21 0.00 0.00 178.00 178.76 1oc3 h GLY 46 N -0.73 0.42 0.95 -0.55 0.00 -1.95 -0.64 103.07 100.57 1oc3 h GLY 46 Ca -0.01 -0.29 0.10 0.00 0.00 0.00 0.00 47.33 47.13 1oc3 h GLY 46 CO -0.11 0.27 0.45 0.00 0.00 0.00 0.00 176.54 177.14 1oc3 n SER 48 N -4.48 0.31 -0.10 0.00 7.64 -0.27 -1.11 113.62 115.60 1oc3 n SER 48 Ca 0.11 0.14 -0.09 0.00 1.01 0.00 0.00 58.87 60.04 1oc3 n SER 48 Cb 0.37 0.78 -0.16 0.00 -1.01 0.00 0.00 64.21 64.20 1oc3 n SER 48 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1oc3 n LYS 49 N -2.77 0.69 0.03 1.43 5.02 -0.32 -4.58 118.16 117.67 1oc3 n LYS 49 Ca -0.22 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.05 1oc3 n LYS 49 Cb 1.01 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 34.50 1oc3 n LYS 49 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1oc3 n THR 50 N -2.73 0.51 0.35 -0.18 -1.04 -0.72 -4.80 114.28 105.67 1oc3 n THR 50 Ca -0.32 0.17 -0.15 0.00 -2.04 0.00 0.00 64.05 61.71 1oc3 n THR 50 Cb 1.13 -1.38 -0.08 0.00 -1.82 0.00 0.00 70.33 68.19 1oc3 n THR 50 CO 0.00 0.00 0.00 -0.74 -0.64 0.00 0.00 175.07 173.69 1oc3 h HIS 51 N 0.00 -0.85 -0.04 -1.42 2.76 -1.22 -2.04 115.15 112.34 1oc3 h HIS 51 Ca 0.00 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.15 1oc3 h HIS 51 Cb 0.43 0.28 -0.00 0.00 1.55 0.00 0.00 27.41 29.67 1oc3 h HIS 51 CO 0.00 -0.50 0.02 1.25 -1.30 0.00 0.00 177.93 177.40 1oc3 h LEU 52 N -1.17 0.05 -1.36 0.26 5.85 -1.38 -3.10 115.31 114.46 1oc3 h LEU 52 Ca -0.09 -0.11 0.06 0.00 0.84 0.00 0.00 57.88 58.57 1oc3 h LEU 52 Cb 0.73 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1oc3 h LEU 52 CO 0.15 0.15 0.48 -0.65 -0.34 0.00 0.00 178.44 178.23 1oc3 h PRO 53 N -0.05 0.76 -0.63 5.25 0.11 -1.79 -0.12 132.00 135.53 1oc3 h PRO 53 Ca 0.01 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 1oc3 h PRO 53 Cb 0.11 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.02 1oc3 h PRO 53 CO -0.00 0.50 0.38 0.78 -0.21 0.00 0.00 178.00 179.45 1oc3 h GLY 54 N 0.78 0.92 1.59 -0.55 0.00 -1.29 0.13 103.07 104.64 1oc3 h GLY 54 Ca 0.31 -0.37 -0.24 0.00 0.00 0.00 0.00 47.33 47.02 1oc3 h GLY 54 CO -0.10 0.36 -1.05 0.74 0.00 0.00 0.00 176.54 176.49 1oc3 h PHE 55 N 0.87 0.55 0.21 5.60 0.04 -1.13 -2.34 116.94 120.73 1oc3 h PHE 55 Ca 0.23 -0.33 -0.00 0.00 2.80 0.00 0.00 57.97 60.66 1oc3 h PHE 55 Cb -0.03 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 1oc3 h PHE 55 CO 0.00 1.19 -0.15 0.28 -0.60 0.00 0.00 178.31 179.03 1oc3 h VAL 56 N 0.16 0.68 -0.43 -0.55 2.07 -0.67 -2.68 116.25 114.83 1oc3 h VAL 56 Ca -0.10 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1oc3 h VAL 56 Cb 1.72 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 1oc3 h VAL 56 CO 0.18 0.00 0.20 -0.08 0.02 0.00 0.00 177.57 177.88 1oc3 h GLU 57 N -0.36 0.61 -0.25 1.57 4.57 -0.81 -2.48 114.58 117.44 1oc3 h GLU 57 Ca -0.01 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1oc3 h GLU 57 Cb 0.31 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 1oc3 h GLU 57 CO 0.00 0.49 0.00 1.04 -1.18 0.00 0.00 179.01 179.36 1oc3 n GLN 58 N -4.39 1.74 -0.36 1.92 1.13 -0.88 -4.50 117.38 112.04 1oc3 n GLN 58 Ca 0.03 -1.13 0.01 0.00 -1.94 0.00 0.00 57.00 53.98 1oc3 n GLN 58 Cb 0.13 -1.33 0.15 0.00 0.11 0.00 0.00 30.24 29.31 1oc3 n GLN 58 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1oc3 h ALA 59 N 3.82 1.33 -0.08 -1.58 0.00 -1.09 0.12 119.26 121.78 1oc3 h ALA 59 Ca 0.00 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 1oc3 h ALA 59 Cb 0.46 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1oc3 h ALA 59 CO 0.00 0.45 -0.75 0.93 0.00 0.00 0.00 179.25 179.88 1oc3 h GLU 60 N 1.17 0.44 -0.55 0.00 3.07 -1.84 -2.23 114.58 114.64 1oc3 h GLU 60 Ca 0.41 -0.37 -0.09 0.00 -0.50 0.00 0.00 59.36 58.81 1oc3 h GLU 60 Cb 0.11 0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.07 1oc3 h GLU 60 CO -0.15 1.01 -0.01 0.00 -1.40 0.00 0.00 179.01 178.45 1oc3 h ALA 61 N 0.89 0.93 -0.43 3.43 0.00 -1.60 0.23 119.26 122.71 1oc3 h ALA 61 Ca -0.04 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 1oc3 h ALA 61 Cb 1.33 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1oc3 h ALA 61 CO 0.13 0.64 -0.09 -0.07 0.00 0.00 0.00 179.25 179.86 1oc3 h LEU 62 N 0.88 0.82 -1.36 0.00 3.38 -0.75 -2.86 115.31 115.42 1oc3 h LEU 62 Ca 0.16 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 1oc3 h LEU 62 Cb 0.53 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1oc3 h LEU 62 CO 0.03 0.98 0.14 0.11 0.09 0.00 0.00 178.44 179.79 1oc3 h LYS 63 N 0.64 0.57 0.00 1.13 1.57 -1.03 -0.82 116.57 118.64 1oc3 h LYS 63 Ca 0.11 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1oc3 h LYS 63 Cb 0.61 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 1oc3 h LYS 63 CO 0.04 0.50 -0.09 0.00 -0.57 0.00 0.00 179.45 179.33 1oc3 h ALA 64 N 1.59 1.31 -0.51 3.86 0.00 -0.33 -0.09 119.26 125.09 1oc3 h ALA 64 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1oc3 h ALA 64 Cb 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1oc3 h ALA 64 CO -0.01 0.11 0.00 1.63 0.00 0.00 0.00 179.25 180.98 1oc3 n LYS 65 N -3.64 2.19 -0.43 0.00 4.76 -0.41 -4.93 118.16 115.70 1oc3 n LYS 65 Ca -0.02 -1.85 0.00 0.00 -2.87 0.00 0.00 58.31 53.57 1oc3 n LYS 65 Cb 0.20 -1.40 0.00 0.00 -1.84 0.00 0.00 35.03 31.99 1oc3 n LYS 65 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1oc3 n GLY 66 N 1.32 0.76 3.60 0.72 0.00 -0.05 -5.01 105.19 106.53 1oc3 n GLY 66 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 1oc3 n GLY 66 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oc3 s VAL 67 N -2.27 3.93 -0.20 1.61 1.01 -0.60 -4.41 120.40 119.47 1oc3 s VAL 67 Ca 0.00 0.92 0.19 0.00 0.00 0.00 0.00 61.98 63.09 1oc3 s VAL 67 Cb 0.00 -4.32 -0.01 0.00 0.00 0.00 0.00 36.38 32.04 1oc3 s VAL 67 CO 0.00 -0.89 1.06 1.56 0.00 0.00 0.00 175.10 176.83 1oc3 h GLN 68 N 10.53 0.00 -3.83 2.72 4.20 -1.27 -3.32 115.11 124.14 1oc3 h GLN 68 Ca -0.27 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.13 1oc3 h GLN 68 Cb 1.09 0.00 -0.32 0.00 0.30 0.00 0.00 27.48 28.56 1oc3 h GLN 68 CO 1.11 0.17 -0.74 0.54 -0.67 0.00 0.00 178.83 179.24 1oc3 s VAL 69 N -3.13 0.19 -0.12 -0.54 0.11 -1.23 -5.04 120.40 110.64 1oc3 s VAL 69 Ca -0.00 0.01 -0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1oc3 s VAL 69 Cb 0.09 -0.24 0.03 0.00 -1.53 0.00 0.00 36.38 34.73 1oc3 s VAL 69 CO 0.78 0.11 -0.07 -0.69 -3.33 0.00 0.00 175.10 171.90 1oc3 s VAL 70 N 0.61 1.03 -0.03 2.04 1.01 -1.26 -1.16 120.40 122.64 1oc3 s VAL 70 Ca -0.06 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1oc3 s VAL 70 Cb -0.09 -1.07 -0.00 0.00 0.00 0.00 0.00 36.38 35.21 1oc3 s VAL 70 CO -0.01 0.33 -0.15 0.00 0.00 0.00 0.00 175.10 175.27 1oc3 s ALA 71 N 1.70 1.30 -0.22 5.51 0.00 -0.46 -0.69 121.76 128.90 1oc3 s ALA 71 Ca 0.04 -0.58 -0.05 0.00 0.00 0.00 0.00 51.96 51.37 1oc3 s ALA 71 Cb -0.13 -0.43 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 1oc3 s ALA 71 CO -0.08 0.24 0.00 0.00 0.00 0.00 0.00 175.76 175.92 1oc3 s LEU 73 N 1.38 3.54 0.05 0.00 2.96 0.60 -0.72 118.68 126.50 1oc3 s LEU 73 Ca 0.05 0.12 -0.08 0.00 -0.22 0.00 0.00 54.13 54.00 1oc3 s LEU 73 Cb -0.15 -1.81 -0.00 0.00 0.50 0.00 0.00 46.19 44.73 1oc3 s LEU 73 CO 0.00 0.37 0.16 -0.94 -1.32 0.00 0.00 176.35 174.62 1oc3 s SER 74 N -0.82 0.11 -0.77 3.68 1.04 -0.97 -0.88 113.70 115.09 1oc3 s SER 74 Ca 0.12 -0.48 -0.19 0.00 0.48 0.00 0.00 55.95 55.88 1oc3 s SER 74 Cb -0.11 0.27 0.12 0.00 0.10 0.00 0.00 66.02 66.40 1oc3 s SER 74 CO 0.02 -0.57 0.94 -0.69 0.98 0.00 0.00 173.24 173.93 1oc3 s VAL 75 N -2.80 4.75 0.11 5.02 1.01 -1.26 -0.91 120.40 126.32 1oc3 s VAL 75 Ca -0.03 -1.23 -0.25 0.00 0.00 0.00 0.00 61.98 60.47 1oc3 s VAL 75 Cb 0.00 -4.65 0.08 0.00 0.00 0.00 0.00 36.38 31.81 1oc3 s VAL 75 CO -0.05 -1.35 0.67 0.20 0.00 0.00 0.00 175.10 174.57 1oc3 s ASN 76 N 3.50 -0.53 0.70 3.32 -0.87 -1.26 -4.89 114.94 114.90 1oc3 s ASN 76 Ca 0.23 0.07 -0.12 0.00 -1.57 0.00 0.00 52.86 51.47 1oc3 s ASN 76 Cb -0.13 0.55 0.02 0.00 -0.02 0.00 0.00 41.25 41.66 1oc3 s ASN 76 CO -0.01 -0.86 1.07 1.51 -2.57 0.00 0.00 177.10 176.25 1oc3 s ASP 77 N -2.54 5.13 0.48 -1.22 1.47 -1.26 -3.11 116.67 115.62 1oc3 s ASP 77 Ca 0.01 1.75 0.22 0.00 1.18 0.00 0.00 52.55 55.70 1oc3 s ASP 77 Cb -0.01 -2.51 1.21 0.00 -0.34 0.00 0.00 42.92 41.26 1oc3 s ASP 77 CO -0.10 -1.61 2.00 0.00 0.68 0.00 0.00 175.17 176.14 1oc3 h ALA 78 N -0.61 1.39 -0.33 2.11 0.00 -1.90 -2.22 119.26 117.69 1oc3 h ALA 78 Ca -0.44 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 1oc3 h ALA 78 Cb 1.22 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1oc3 h ALA 78 CO 0.55 0.22 0.18 0.74 0.00 0.00 0.00 179.25 180.94 1oc3 h PHE 79 N 0.00 0.45 -0.18 0.00 0.04 -1.92 -1.61 116.94 113.73 1oc3 h PHE 79 Ca -0.00 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.72 1oc3 h PHE 79 Cb 0.40 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.40 1oc3 h PHE 79 CO 0.00 0.37 -0.05 0.28 -0.60 0.00 0.00 178.31 178.31 1oc3 h VAL 80 N 0.41 1.29 -0.60 -0.55 2.07 -1.84 -2.45 116.25 114.58 1oc3 h VAL 80 Ca 0.12 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 1oc3 h VAL 80 Cb 0.07 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1oc3 h VAL 80 CO -0.02 0.31 0.29 0.71 0.02 0.00 0.00 177.57 178.88 1oc3 h THR 81 N 0.05 1.20 -0.30 2.57 1.35 -1.36 0.64 112.91 117.05 1oc3 h THR 81 Ca 0.04 -0.54 -0.15 0.00 -0.55 0.00 0.00 66.41 65.21 1oc3 h THR 81 Cb 0.50 0.42 -0.01 0.00 -1.73 0.00 0.00 68.15 67.33 1oc3 h THR 81 CO 0.02 0.23 -0.41 1.23 -0.25 0.00 0.00 175.52 176.34 1oc3 h GLY 82 N 0.93 0.81 1.54 5.82 0.00 -1.18 -0.74 103.07 110.25 1oc3 h GLY 82 Ca 0.21 -0.82 -0.19 0.00 0.00 0.00 0.00 47.33 46.53 1oc3 h GLY 82 CO -0.03 0.74 -0.73 0.83 0.00 0.00 0.00 176.54 177.36 1oc3 h GLU 83 N 0.60 0.45 -0.49 4.80 4.39 -1.04 -2.29 114.58 121.00 1oc3 h GLU 83 Ca 0.05 -0.36 0.00 0.00 0.34 0.00 0.00 59.36 59.39 1oc3 h GLU 83 Cb 0.96 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.66 1oc3 h GLU 83 CO 0.09 1.00 0.32 2.35 -1.16 0.00 0.00 179.01 181.61 1oc3 h TRP 84 N 0.31 0.62 -0.11 4.33 7.01 -0.58 -0.93 115.95 126.61 1oc3 h TRP 84 Ca -0.03 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.00 1oc3 h TRP 84 Cb 1.30 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 28.13 1oc3 h TRP 84 CO 0.05 0.40 -0.02 0.78 -2.79 0.00 0.00 178.44 176.85 1oc3 h GLY 85 N 0.67 0.08 0.98 2.65 0.00 -0.95 -2.11 103.07 104.39 1oc3 h GLY 85 Ca 0.18 0.03 0.04 0.00 0.00 0.00 0.00 47.33 47.58 1oc3 h GLY 85 CO -0.04 -0.04 0.58 3.21 0.00 0.00 0.00 176.54 180.25 1oc3 h ARG 86 N 0.01 1.05 0.00 4.80 3.08 -1.34 -1.51 114.38 120.47 1oc3 h ARG 86 Ca 0.05 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1oc3 h ARG 86 Cb 0.08 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 1oc3 h ARG 86 CO -0.11 0.70 -0.06 0.00 -1.07 0.00 0.00 179.97 179.42 1oc3 h ALA 87 N 1.49 1.45 -0.23 0.04 0.00 -0.50 -2.59 119.26 118.91 1oc3 h ALA 87 Ca 0.36 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1oc3 h ALA 87 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1oc3 h ALA 87 CO -0.11 0.08 0.00 0.72 0.00 0.00 0.00 179.25 179.94 1oc3 n HIS 88 N -3.81 0.77 -3.94 0.00 8.25 -0.77 -5.00 115.22 110.72 1oc3 n HIS 88 Ca -0.02 -0.86 -0.26 0.00 -0.26 0.00 0.00 57.72 56.31 1oc3 n HIS 88 Cb 0.16 -0.27 -0.02 0.00 1.12 0.00 0.00 29.99 30.98 1oc3 n HIS 88 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1oc3 n LYS 89 N -0.57 -3.07 0.19 -0.41 5.02 -0.65 -4.89 118.16 113.78 1oc3 n LYS 89 Ca 0.20 0.40 0.11 0.00 -2.02 0.00 0.00 58.31 57.00 1oc3 n LYS 89 Cb 0.82 -4.46 0.13 0.00 -0.02 0.00 0.00 35.03 31.50 1oc3 n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1oc3 h ALA 90 N 0.85 0.89 -1.74 7.82 0.00 -1.63 -3.47 119.26 121.99 1oc3 h ALA 90 Ca -0.64 -0.04 -0.67 0.00 0.00 0.00 0.00 54.91 53.56 1oc3 h ALA 90 Cb 1.37 -0.00 0.05 0.00 0.00 0.00 0.00 17.79 19.22 1oc3 h ALA 90 CO 0.61 0.05 0.49 -1.91 0.00 0.00 0.00 179.25 178.49 1oc3 n GLU 91 N -3.04 1.25 -0.96 0.00 2.13 -1.26 -0.41 120.64 118.35 1oc3 n GLU 91 Ca 0.03 0.45 0.00 0.00 0.66 0.00 0.00 57.16 58.30 1oc3 n GLU 91 Cb 0.55 -2.11 0.00 0.00 0.27 0.00 0.00 31.44 30.16 1oc3 n GLU 91 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1oc3 n GLY 92 N 2.61 0.24 0.41 8.31 0.00 -1.26 -4.81 105.19 110.69 1oc3 n GLY 92 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1oc3 n GLY 92 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1oc3 n LYS 93 N -0.88 0.00 -3.75 1.61 5.02 0.45 -5.05 118.16 115.56 1oc3 n LYS 93 Ca 0.00 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.14 1oc3 n LYS 93 Cb 0.25 -0.68 -0.15 0.00 -0.02 0.00 0.00 35.03 34.42 1oc3 n LYS 93 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1oc3 s VAL 94 N -1.78 -0.07 0.15 -0.18 1.01 -0.75 -4.61 120.40 114.17 1oc3 s VAL 94 Ca 0.00 0.22 -0.30 0.00 0.00 0.00 0.00 61.98 61.90 1oc3 s VAL 94 Cb 0.00 -0.17 -0.07 0.00 0.00 0.00 0.00 36.38 36.14 1oc3 s VAL 94 CO 0.00 0.09 0.95 -0.13 0.00 0.00 0.00 175.10 176.01 1oc3 s ARG 95 N 1.25 4.73 -0.30 2.72 1.81 0.14 -4.55 118.95 124.75 1oc3 s ARG 95 Ca -0.08 1.44 -0.11 0.00 -1.72 0.00 0.00 55.73 55.27 1oc3 s ARG 95 Cb -0.12 -3.35 -0.03 0.00 -0.45 0.00 0.00 34.95 31.00 1oc3 s ARG 95 CO -0.05 0.31 0.18 -0.51 -0.68 0.00 0.00 175.30 174.55 1oc3 s LEU 96 N -0.36 4.07 -0.10 2.53 2.01 -1.26 -1.07 118.68 124.50 1oc3 s LEU 96 Ca 0.45 -0.25 0.04 0.00 0.01 0.00 0.00 54.13 54.37 1oc3 s LEU 96 Cb -0.24 -2.07 0.00 0.00 0.01 0.00 0.00 46.19 43.89 1oc3 s LEU 96 CO 0.30 -0.12 -0.24 -0.76 1.01 0.00 0.00 176.35 176.54 1oc3 s LEU 97 N 1.70 2.08 -0.13 1.79 1.43 0.11 -4.43 118.68 121.23 1oc3 s LEU 97 Ca 0.06 -0.56 -0.05 0.00 -1.03 0.00 0.00 54.13 52.55 1oc3 s LEU 97 Cb -0.16 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 1oc3 s LEU 97 CO 0.09 0.16 0.05 0.00 0.23 0.00 0.00 176.35 176.87 1oc3 s ALA 98 N 0.35 3.42 -0.59 4.21 0.00 0.15 -2.30 121.76 127.01 1oc3 s ALA 98 Ca -0.19 -0.75 0.05 0.00 0.00 0.00 0.00 51.96 51.07 1oc3 s ALA 98 Cb -0.18 -1.75 0.17 0.00 0.00 0.00 0.00 23.12 21.37 1oc3 s ALA 98 CO 0.09 0.41 0.44 -3.47 0.00 0.00 0.00 175.76 173.23 1oc3 n ASP 99 N 2.74 1.61 0.26 0.00 2.03 -0.09 -1.17 116.55 121.94 1oc3 n ASP 99 Ca -0.18 -2.88 0.11 0.00 0.52 0.00 0.00 54.79 52.36 1oc3 n ASP 99 Cb 0.53 -0.67 0.71 0.00 -0.72 0.00 0.00 41.12 40.97 1oc3 n ASP 99 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1oc3 h PRO 100 N 5.46 0.00 -0.02 -0.67 0.13 -1.77 -2.59 132.00 132.53 1oc3 h PRO 100 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1oc3 h PRO 100 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1oc3 h PRO 100 CO 0.58 0.09 -0.11 0.25 -0.23 0.00 0.00 178.00 178.58 1oc3 n THR 101 N -3.96 0.00 -1.87 1.56 -2.24 -1.26 -4.65 114.28 101.87 1oc3 n THR 101 Ca -0.02 -0.30 -0.12 0.00 -2.27 0.00 0.00 64.05 61.33 1oc3 n THR 101 Cb 0.18 0.88 -0.03 0.00 -2.10 0.00 0.00 70.33 69.27 1oc3 n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oc3 n GLY 102 N 1.29 0.48 0.33 3.38 0.00 -0.98 -4.92 105.19 104.78 1oc3 n GLY 102 Ca 0.15 -0.40 0.06 0.00 0.00 0.00 0.00 46.02 45.83 1oc3 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oc3 h ALA 103 N 0.34 1.36 -0.15 4.61 0.00 -1.93 -1.86 119.26 121.62 1oc3 h ALA 103 Ca -0.28 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1oc3 h ALA 103 Cb 1.05 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1oc3 h ALA 103 CO 0.36 0.11 -0.08 0.35 0.00 0.00 0.00 179.25 179.99 1oc3 h PHE 104 N 0.84 0.37 -0.72 0.00 3.57 -1.93 -2.58 116.94 116.50 1oc3 h PHE 104 Ca 0.46 -0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.86 1oc3 h PHE 104 Cb 0.50 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.12 1oc3 h PHE 104 CO -0.04 0.65 0.45 0.78 -2.23 0.00 0.00 178.31 177.92 1oc3 h GLY 105 N -0.02 1.03 1.30 2.40 0.00 -1.86 -2.33 103.07 103.59 1oc3 h GLY 105 Ca 0.03 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 1oc3 h GLY 105 CO 0.02 0.40 -0.14 0.50 0.00 0.00 0.00 176.54 177.32 1oc3 h LYS 106 N 0.98 0.82 0.00 4.80 1.57 -1.24 0.72 116.57 124.22 1oc3 h LYS 106 Ca 0.26 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1oc3 h LYS 106 Cb -0.07 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.19 1oc3 h LYS 106 CO -0.05 0.91 0.00 -1.91 -0.57 0.00 0.00 179.45 177.83 1oc3 n GLU 107 N -4.15 0.24 0.00 3.15 2.13 -0.93 -3.84 120.64 117.25 1oc3 n GLU 107 Ca 0.01 0.27 0.00 0.00 0.66 0.00 0.00 57.16 58.10 1oc3 n GLU 107 Cb 0.39 -1.82 0.00 0.00 0.27 0.00 0.00 31.44 30.28 1oc3 n GLU 107 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1oc3 n THR 108 N -2.26 0.00 -3.14 6.31 -2.24 -0.92 -4.60 114.28 107.44 1oc3 n THR 108 Ca 0.05 -0.43 -0.22 0.00 -2.27 0.00 0.00 64.05 61.18 1oc3 n THR 108 Cb 0.38 1.15 0.05 0.00 -2.10 0.00 0.00 70.33 69.80 1oc3 n THR 108 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1oc3 n ASP 109 N -0.02 -6.11 -1.20 3.42 2.03 0.08 -1.47 116.55 113.28 1oc3 n ASP 109 Ca 0.00 -0.34 0.09 0.00 0.52 0.00 0.00 54.79 55.06 1oc3 n ASP 109 Cb 0.04 -4.88 0.28 0.00 -0.72 0.00 0.00 41.12 35.84 1oc3 n ASP 109 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1oc3 n LEU 110 N -4.18 3.97 -4.77 -2.67 4.77 -0.23 -4.89 117.00 109.01 1oc3 n LEU 110 Ca -0.08 -2.27 -0.39 0.00 -0.03 0.00 0.00 56.01 53.23 1oc3 n LEU 110 Cb 0.60 -0.46 -0.06 0.00 -2.33 0.00 0.00 43.42 41.18 1oc3 n LEU 110 CO 0.50 0.82 0.39 -0.76 -1.33 0.00 0.00 177.39 177.02 1oc3 s LEU 111 N -1.51 4.49 1.14 2.23 1.43 -1.22 -0.26 118.68 124.98 1oc3 s LEU 111 Ca 0.42 1.39 -0.12 0.00 -1.03 0.00 0.00 54.13 54.79 1oc3 s LEU 111 Cb 0.26 -3.11 0.27 0.00 0.03 0.00 0.00 46.19 43.64 1oc3 s LEU 111 CO 0.23 0.13 1.04 -0.76 0.23 0.00 0.00 176.35 177.22 1oc3 s LEU 112 N -0.55 1.04 0.00 1.79 1.43 0.27 -4.72 118.68 117.94 1oc3 s LEU 112 Ca 0.34 1.60 0.00 0.00 -1.03 0.00 0.00 54.13 55.05 1oc3 s LEU 112 Cb -0.20 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.46 1oc3 s LEU 112 CO 0.22 -4.12 0.00 -0.90 0.23 0.00 0.00 176.35 171.77 1oc3 n ASP 113 N -4.87 0.00 -0.36 2.29 5.68 -1.26 -4.72 116.55 113.32 1oc3 n ASP 113 Ca 0.04 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.45 1oc3 n ASP 113 Cb 0.54 0.00 0.51 0.00 -1.14 0.00 0.00 41.12 41.03 1oc3 n ASP 113 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1oc3 n ASP 114 N 0.00 1.08 -0.21 -1.12 8.00 -1.26 -4.46 116.55 118.59 1oc3 n ASP 114 Ca 0.00 -1.52 0.08 0.00 0.71 0.00 0.00 54.79 54.06 1oc3 n ASP 114 Cb 0.00 -0.05 0.35 0.00 -0.02 0.00 0.00 41.12 41.41 1oc3 n ASP 114 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1oc3 h SER 115 N 1.52 0.67 -0.59 -2.24 0.02 -1.96 -2.38 113.55 108.59 1oc3 h SER 115 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1oc3 h SER 115 Cb 0.33 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.74 1oc3 h SER 115 CO 0.00 0.41 0.00 0.18 -1.14 0.00 0.00 176.83 176.28 1oc3 n LEU 116 N -4.49 3.58 -0.14 5.07 4.77 -1.26 -4.53 117.00 120.00 1oc3 n LEU 116 Ca 0.12 -1.97 0.16 0.00 -0.03 0.00 0.00 56.01 54.29 1oc3 n LEU 116 Cb 0.28 -0.39 0.54 0.00 -2.33 0.00 0.00 43.42 41.52 1oc3 n LEU 116 CO 0.33 0.89 1.21 0.58 -1.33 0.00 0.00 177.39 179.06 1oc3 h VAL 117 N 3.53 0.78 0.00 4.08 2.07 -1.59 -0.59 116.25 124.53 1oc3 h VAL 117 Ca 0.00 -0.12 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 1oc3 h VAL 117 Cb 0.90 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1oc3 h VAL 117 CO 0.00 0.06 -0.27 0.77 0.02 0.00 0.00 177.57 178.15 1oc3 h SER 118 N 0.34 0.00 0.00 0.57 4.64 -1.80 0.12 113.55 117.42 1oc3 h SER 118 Ca 0.35 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.53 1oc3 h SER 118 Cb 0.88 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.95 1oc3 h SER 118 CO -0.10 0.27 -1.92 2.30 -0.87 0.00 0.00 176.83 176.51 1oc3 n ILE 119 N -3.87 0.51 -0.03 0.95 -5.35 -0.67 -4.66 119.36 106.24 1oc3 n ILE 119 Ca -0.02 -0.52 0.05 0.00 -0.27 0.00 0.00 62.75 61.99 1oc3 n ILE 119 Cb 0.36 -0.21 -0.15 0.00 -1.74 0.00 0.00 39.64 37.89 1oc3 n ILE 119 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1oc3 n PHE 120 N -2.33 0.00 0.00 4.28 3.72 -0.32 -4.99 117.46 117.83 1oc3 n PHE 120 Ca -0.14 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.26 1oc3 n PHE 120 Cb 0.71 -0.55 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 1oc3 n PHE 120 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1oc3 n GLY 121 N 1.52 2.34 2.20 1.37 0.00 0.41 -4.98 105.19 108.06 1oc3 n GLY 121 Ca -0.10 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 1oc3 n GLY 121 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1oc3 n ASN 122 N 0.00 -1.17 -4.57 1.61 0.23 -1.26 -4.92 115.26 105.19 1oc3 n ASN 122 Ca 0.00 -1.72 -0.42 0.00 -0.53 0.00 0.00 54.58 51.90 1oc3 n ASN 122 Cb 0.00 1.93 -0.06 0.00 -2.08 0.00 0.00 39.78 39.57 1oc3 n ASN 122 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1oc3 s ARG 123 N -2.04 3.62 0.69 -3.83 0.52 -1.26 -4.16 118.95 112.49 1oc3 s ARG 123 Ca 0.11 0.08 -0.04 0.00 -0.52 0.00 0.00 55.73 55.36 1oc3 s ARG 123 Cb -0.02 -3.85 0.08 0.00 0.52 0.00 0.00 34.95 31.68 1oc3 s ARG 123 CO 0.05 -0.88 0.98 1.03 0.02 0.00 0.00 175.30 176.50 1oc3 s ARG 124 N 2.98 2.01 0.32 3.54 1.81 -1.26 -4.82 118.95 123.53 1oc3 s ARG 124 Ca 0.28 -0.60 -0.27 0.00 -1.72 0.00 0.00 55.73 53.42 1oc3 s ARG 124 Cb -0.13 -2.26 -0.09 0.00 -0.45 0.00 0.00 34.95 32.02 1oc3 s ARG 124 CO 0.17 -1.27 1.01 -0.51 -0.68 0.00 0.00 175.30 174.03 1oc3 s LEU 125 N -5.16 4.40 0.64 2.53 1.43 -1.26 -0.57 118.68 120.69 1oc3 s LEU 125 Ca 0.62 2.03 -0.17 0.00 -1.03 0.00 0.00 54.13 55.58 1oc3 s LEU 125 Cb -0.09 -3.88 -0.01 0.00 0.03 0.00 0.00 46.19 42.24 1oc3 s LEU 125 CO 0.44 -0.16 1.18 -0.54 0.23 0.00 0.00 176.35 177.50 1oc3 s LYS 126 N -1.85 2.74 -0.03 1.70 1.02 0.64 -3.39 119.74 120.57 1oc3 s LYS 126 Ca 0.49 1.71 -0.30 0.00 0.02 0.00 0.00 55.97 57.89 1oc3 s LYS 126 Cb -0.24 -1.91 -0.04 0.00 -0.52 0.00 0.00 37.83 35.11 1oc3 s LYS 126 CO 0.31 -1.36 1.27 0.50 -0.92 0.00 0.00 175.35 175.15 1oc3 s ARG 127 N -3.63 4.33 0.16 1.68 3.52 -0.13 -4.45 118.95 120.43 1oc3 s ARG 127 Ca 0.74 1.78 -0.16 0.00 -0.13 0.00 0.00 55.73 57.96 1oc3 s ARG 127 Cb -0.28 -3.56 0.03 0.00 -1.56 0.00 0.00 34.95 29.59 1oc3 s ARG 127 CO 0.37 -0.49 0.44 -0.59 -0.81 0.00 0.00 175.30 174.23 1oc3 s PHE 128 N 2.24 -0.13 0.05 5.12 -0.12 -1.13 -1.10 117.98 122.91 1oc3 s PHE 128 Ca 0.59 -0.20 0.01 0.00 -0.05 0.00 0.00 56.93 57.28 1oc3 s PHE 128 Cb -0.27 0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 42.38 1oc3 s PHE 128 CO 0.24 -0.79 -0.06 -1.54 -0.05 0.00 0.00 175.22 173.02 1oc3 s SER 129 N -2.84 0.74 -0.02 1.98 1.04 0.13 -0.97 113.70 113.76 1oc3 s SER 129 Ca 0.06 -0.71 -0.14 0.00 0.48 0.00 0.00 55.95 55.64 1oc3 s SER 129 Cb 0.01 0.09 0.02 0.00 0.10 0.00 0.00 66.02 66.24 1oc3 s SER 129 CO -0.08 -0.35 0.29 0.00 0.98 0.00 0.00 173.24 174.09 1oc3 s MET 130 N -2.44 0.63 -0.16 4.02 0.23 0.10 -0.85 119.30 120.84 1oc3 s MET 130 Ca -0.04 -0.18 -0.14 0.00 -1.03 0.00 0.00 55.69 54.31 1oc3 s MET 130 Cb -0.04 0.28 -0.05 0.00 -1.53 0.00 0.00 34.83 33.50 1oc3 s MET 130 CO -0.03 -0.17 0.31 0.08 -2.03 0.00 0.00 175.02 173.18 1oc3 s VAL 131 N -1.24 5.29 -0.10 5.16 1.01 -0.49 -1.79 120.40 128.23 1oc3 s VAL 131 Ca -0.13 0.58 0.02 0.00 0.00 0.00 0.00 61.98 62.46 1oc3 s VAL 131 Cb -0.05 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.69 1oc3 s VAL 131 CO 0.04 0.39 -0.17 -0.69 0.00 0.00 0.00 175.10 174.67 1oc3 s VAL 132 N 0.46 1.57 -0.24 2.92 1.01 0.44 -0.81 120.40 125.75 1oc3 s VAL 132 Ca 0.17 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.46 1oc3 s VAL 132 Cb -0.13 -1.42 0.04 0.00 0.00 0.00 0.00 36.38 34.87 1oc3 s VAL 132 CO 0.04 0.45 -0.10 -1.58 0.00 0.00 0.00 175.10 173.91 1oc3 s GLN 133 N 0.84 2.60 -1.59 2.72 2.00 -0.75 -0.19 119.66 125.30 1oc3 s GLN 133 Ca -0.09 -1.12 -0.09 0.00 -2.00 0.00 0.00 55.36 52.06 1oc3 s GLN 133 Cb -0.15 -2.88 0.08 0.00 0.80 0.00 0.00 33.01 30.86 1oc3 s GLN 133 CO 0.00 -0.45 0.46 -3.47 -0.50 0.00 0.00 175.29 171.34 1oc3 n ASP 134 N 4.56 -1.14 0.00 6.67 2.03 0.15 -0.57 116.55 128.25 1oc3 n ASP 134 Ca -0.16 -1.10 0.00 0.00 0.52 0.00 0.00 54.79 54.05 1oc3 n ASP 134 Cb 0.45 -2.48 0.00 0.00 -0.72 0.00 0.00 41.12 38.38 1oc3 n ASP 134 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1oc3 n GLY 135 N -1.83 1.21 3.59 0.27 0.00 -1.18 -4.68 105.19 102.58 1oc3 n GLY 135 Ca -0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 1oc3 n GLY 135 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oc3 s ILE 136 N -3.30 4.39 -0.13 -0.61 -1.09 0.26 -1.13 121.20 119.59 1oc3 s ILE 136 Ca 0.00 -0.18 -0.29 0.00 -2.23 0.00 0.00 60.65 57.95 1oc3 s ILE 136 Cb 0.00 -2.95 -0.04 0.00 -1.58 0.00 0.00 42.46 37.89 1oc3 s ILE 136 CO 0.00 0.49 1.67 -0.69 -1.23 0.00 0.00 174.94 175.18 1oc3 s VAL 137 N 0.21 3.59 -0.19 2.92 1.01 0.94 -1.81 120.40 127.08 1oc3 s VAL 137 Ca 0.01 0.69 0.13 0.00 0.00 0.00 0.00 61.98 62.81 1oc3 s VAL 137 Cb -0.13 -3.53 -0.20 0.00 0.00 0.00 0.00 36.38 32.52 1oc3 s VAL 137 CO 0.01 -0.15 0.01 0.29 0.00 0.00 0.00 175.10 175.26 1oc3 n LYS 138 N 7.44 1.00 -3.84 2.72 4.76 0.01 0.84 118.16 131.09 1oc3 n LYS 138 Ca 0.19 0.02 -0.12 0.00 -2.87 0.00 0.00 58.31 55.53 1oc3 n LYS 138 Cb 0.44 -1.45 -0.12 0.00 -1.84 0.00 0.00 35.03 32.05 1oc3 n LYS 138 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1oc3 s ALA 139 N -2.43 -0.29 -0.05 7.82 0.00 -1.19 -4.88 121.76 120.74 1oc3 s ALA 139 Ca -0.13 0.23 0.01 0.00 0.00 0.00 0.00 51.96 52.07 1oc3 s ALA 139 Cb 0.06 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.06 1oc3 s ALA 139 CO 0.68 -0.09 -0.07 -1.17 0.00 0.00 0.00 175.76 175.12 1oc3 s LEU 140 N -0.23 1.40 -0.28 0.00 2.96 -1.26 -1.40 118.68 119.87 1oc3 s LEU 140 Ca -0.03 -0.18 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 1oc3 s LEU 140 Cb -0.02 -0.57 0.08 0.00 0.50 0.00 0.00 46.19 46.18 1oc3 s LEU 140 CO 0.00 -0.03 0.02 0.20 -1.32 0.00 0.00 176.35 175.22 1oc3 s ASN 141 N 0.88 4.09 -0.13 3.68 0.01 -0.03 -5.02 114.94 118.43 1oc3 s ASN 141 Ca -0.11 -1.54 -0.01 0.00 -0.71 0.00 0.00 52.86 50.49 1oc3 s ASN 141 Cb -0.15 -1.17 -0.02 0.00 0.41 0.00 0.00 41.25 40.32 1oc3 s ASN 141 CO 0.01 -0.33 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.47 1oc3 s VAL 142 N 1.36 3.27 0.15 1.60 1.01 -1.26 0.21 120.40 126.73 1oc3 s VAL 142 Ca 0.03 -0.59 -0.31 0.00 0.00 0.00 0.00 61.98 61.11 1oc3 s VAL 142 Cb -0.18 -2.38 -0.11 0.00 0.00 0.00 0.00 36.38 33.71 1oc3 s VAL 142 CO -0.12 0.52 1.74 -1.61 0.00 0.00 0.00 175.10 175.63 1oc3 s GLU 143 N 0.25 4.15 0.56 2.72 0.41 -0.26 -4.85 118.70 121.68 1oc3 s GLU 143 Ca -0.07 2.53 0.38 0.00 -0.41 0.00 0.00 54.97 57.40 1oc3 s GLU 143 Cb -0.15 -3.37 2.04 0.00 -1.78 0.00 0.00 34.13 30.87 1oc3 s GLU 143 CO 0.05 -0.77 2.16 -1.35 -0.49 0.00 0.00 175.26 174.86 1oc3 h PRO 144 N 7.76 0.00 -0.13 0.39 0.11 -1.96 -0.53 132.00 137.63 1oc3 h PRO 144 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1oc3 h PRO 144 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1oc3 h PRO 144 CO 0.94 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.33 1oc3 n ASP 145 N -2.84 2.25 0.00 -2.05 5.68 -1.26 -5.00 116.55 113.33 1oc3 n ASP 145 Ca -0.02 -1.87 0.00 0.00 -0.50 0.00 0.00 54.79 52.40 1oc3 n ASP 145 Cb 0.07 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 1oc3 n ASP 145 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1oc3 n GLY 146 N 0.01 2.67 0.00 6.12 0.00 -0.21 -4.62 105.19 109.16 1oc3 n GLY 146 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1oc3 n GLY 146 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oc3 n THR 147 N -1.93 0.00 -0.70 2.61 -2.24 -1.26 -0.96 114.28 109.80 1oc3 n THR 147 Ca 0.00 -0.06 -0.23 0.00 -2.27 0.00 0.00 64.05 61.48 1oc3 n THR 147 Cb 0.00 0.45 0.21 0.00 -2.10 0.00 0.00 70.33 68.88 1oc3 n THR 147 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oc3 n GLY 148 N 0.92 -3.07 2.60 3.38 0.00 -1.26 -4.94 105.19 102.82 1oc3 n GLY 148 Ca 0.00 -1.42 -0.27 0.00 0.00 0.00 0.00 46.02 44.33 1oc3 n GLY 148 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1oc3 n LEU 149 N 0.00 1.90 0.00 0.99 4.77 -1.26 -4.93 117.00 118.47 1oc3 n LEU 149 Ca 0.12 -4.97 0.00 0.00 -0.03 0.00 0.00 56.01 51.12 1oc3 n LEU 149 Cb 0.46 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1oc3 n LEU 149 CO 0.31 1.87 0.00 0.35 -1.33 0.00 0.00 177.39 178.60 1oc3 n THR 150 N 1.94 0.00 0.29 -5.08 -2.24 -1.26 -4.95 114.28 102.98 1oc3 n THR 150 Ca 0.25 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 62.20 1oc3 n THR 150 Cb 0.42 0.00 0.71 0.00 -2.10 0.00 0.00 70.33 69.36 1oc3 n THR 150 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oc3 n SER 152 N -3.06 1.12 -4.85 0.00 3.41 -1.26 -4.70 113.62 104.29 1oc3 n SER 152 Ca 0.00 -1.36 -0.32 0.00 -0.26 0.00 0.00 58.87 56.94 1oc3 n SER 152 Cb 0.29 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.22 1oc3 n SER 152 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1oc3 s LEU 153 N -2.01 3.50 0.24 1.04 1.43 -1.03 -4.50 118.68 117.35 1oc3 s LEU 153 Ca 0.40 1.55 -0.05 0.00 -1.03 0.00 0.00 54.13 55.00 1oc3 s LEU 153 Cb 0.21 -4.50 0.45 0.00 0.03 0.00 0.00 46.19 42.38 1oc3 s LEU 153 CO 0.35 -0.72 1.71 0.00 0.23 0.00 0.00 176.35 177.92 1oc3 h ALA 154 N 0.51 1.01 0.00 4.21 0.00 -1.87 -1.28 119.26 121.83 1oc3 h ALA 154 Ca -0.46 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1oc3 h ALA 154 Cb 1.19 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 1oc3 h ALA 154 CO 0.61 -0.26 -0.03 -1.35 0.00 0.00 0.00 179.25 178.22 1oc3 h PRO 155 N 0.38 0.00 -0.00 0.00 0.11 -1.93 -1.79 132.00 128.77 1oc3 h PRO 155 Ca 0.41 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 66.33 1oc3 h PRO 155 Cb 0.65 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.74 1oc3 h PRO 155 CO -0.43 0.03 -0.86 -0.97 -0.21 0.00 0.00 178.00 175.56 1oc3 h ASN 156 N 0.00 0.25 0.18 -2.05 -1.24 -1.53 -3.23 115.58 107.96 1oc3 h ASN 156 Ca -0.00 -0.20 -0.12 0.00 0.71 0.00 0.00 56.30 56.70 1oc3 h ASN 156 Cb 0.07 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.03 1oc3 h ASN 156 CO 0.00 0.99 -0.42 -0.29 -1.29 0.00 0.00 177.43 176.42 1oc3 h ILE 157 N 0.11 1.31 -1.03 2.57 2.10 -1.23 -2.90 117.51 118.44 1oc3 h ILE 157 Ca -0.04 -1.57 0.28 0.00 1.08 0.00 0.00 64.86 64.61 1oc3 h ILE 157 Cb 1.48 1.68 -0.12 0.00 -1.09 0.00 0.00 36.82 38.76 1oc3 h ILE 157 CO 0.13 0.47 0.63 0.40 -1.08 0.00 0.00 178.15 178.70 1oc3 h ILE 158 N 0.26 0.45 0.00 2.19 2.04 -1.50 0.61 117.51 121.55 1oc3 h ILE 158 Ca 0.02 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1oc3 h ILE 158 Cb 0.86 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1oc3 h ILE 158 CO 0.07 0.08 0.00 0.77 0.00 0.00 0.00 178.15 179.07 1oc3 h SER 159 N 0.45 0.00 -0.07 1.72 4.64 -1.67 -3.10 113.55 115.51 1oc3 h SER 159 Ca 0.66 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.98 1oc3 h SER 159 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 1oc3 h SER 159 CO -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.50 1oc3 n GLN 160 N -2.57 2.22 0.00 4.77 6.02 0.21 -5.19 117.38 122.85 1oc3 n GLN 160 Ca 0.02 -1.79 0.14 0.00 -0.01 0.00 0.00 57.00 55.36 1oc3 n GLN 160 Cb 0.30 -1.47 0.42 0.00 1.02 0.00 0.00 30.24 30.51 1oc3 n GLN 160 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33