#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ocy n SER 19 N 0.00 -7.74 -0.41 -2.24 2.88 -1.26 -4.61 113.62 100.24 2ocy n SER 19 Ca 0.00 0.40 0.00 0.00 -1.33 0.00 0.00 58.87 57.94 2ocy n SER 19 Cb 0.00 -5.24 0.00 0.00 -0.75 0.00 0.00 64.21 58.22 2ocy n SER 19 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2ocy n ILE 20 N -0.61 0.00 -3.15 2.46 5.41 -1.26 -1.72 119.36 120.48 2ocy n ILE 20 Ca 0.09 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.89 2ocy n ILE 20 Cb 0.46 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.38 2ocy n ILE 20 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 2ocy s LYS 22 N 0.37 0.31 0.70 0.38 -2.85 -1.26 -4.88 119.74 112.51 2ocy s LYS 22 Ca 0.00 0.45 0.02 0.00 -1.00 0.00 0.00 55.97 55.44 2ocy s LYS 22 Cb 0.00 0.24 0.13 0.00 -2.06 0.00 0.00 37.83 36.14 2ocy s LYS 22 CO 0.00 -0.43 0.97 0.42 0.10 0.00 0.00 175.35 176.41 2ocy s ILE 23 N 2.92 2.04 -0.29 3.79 1.01 0.28 -3.68 121.20 127.26 2ocy s ILE 23 Ca 0.12 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 60.08 2ocy s ILE 23 Cb -0.09 -2.33 0.19 0.00 0.01 0.00 0.00 42.46 40.24 2ocy s ILE 23 CO -0.18 0.00 0.59 -0.22 0.00 0.00 0.00 174.94 175.12 2ocy s LEU 24 N -5.06 -1.46 0.27 2.97 2.96 -1.20 -3.21 118.68 113.95 2ocy s LEU 24 Ca 0.66 0.54 -0.12 0.00 -0.22 0.00 0.00 54.13 55.00 2ocy s LEU 24 Cb -0.05 2.06 -0.08 0.00 0.50 0.00 0.00 46.19 48.63 2ocy s LEU 24 CO 0.44 -0.28 0.63 -0.76 -1.32 0.00 0.00 176.35 175.05 2ocy s LEU 25 N 2.83 4.11 -0.00 -0.68 1.02 -1.00 -2.92 118.68 122.04 2ocy s LEU 25 Ca 0.16 1.06 -0.07 0.00 0.02 0.00 0.00 54.13 55.30 2ocy s LEU 25 Cb -0.13 -3.85 0.00 0.00 0.02 0.00 0.00 46.19 42.24 2ocy s LEU 25 CO -0.23 -0.14 0.13 -0.51 0.02 0.00 0.00 176.35 175.62 2ocy s ILE 26 N -1.90 0.08 -0.00 -0.59 1.10 -0.95 -1.19 121.20 117.74 2ocy s ILE 26 Ca 0.50 -0.65 0.00 0.00 -0.51 0.00 0.00 60.65 59.99 2ocy s ILE 26 Cb -0.11 -0.41 0.00 0.00 0.15 0.00 0.00 42.46 42.09 2ocy s ILE 26 CO 0.20 -0.36 0.00 0.61 -2.11 0.00 0.00 174.94 173.28 2ocy n GLY 27 N 1.57 0.38 3.72 1.50 0.00 0.60 -1.67 105.19 111.29 2ocy n GLY 27 Ca -0.22 -1.09 -0.40 0.00 0.00 0.00 0.00 46.02 44.31 2ocy n GLY 27 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ocy n ASP 28 N 1.99 2.61 -4.12 1.61 9.92 -0.47 -4.21 116.55 123.88 2ocy n ASP 28 Ca -0.00 1.05 -0.37 0.00 -0.53 0.00 0.00 54.79 54.94 2ocy n ASP 28 Cb 0.02 -1.53 -0.10 0.00 -0.64 0.00 0.00 41.12 38.86 2ocy n ASP 28 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2ocy s SER 29 N -0.68 5.29 0.24 -2.24 0.01 -1.26 -4.55 113.70 110.50 2ocy s SER 29 Ca 0.65 -2.39 0.00 0.00 1.31 0.00 0.00 55.95 55.52 2ocy s SER 29 Cb -0.46 -1.85 0.00 0.00 0.21 0.00 0.00 66.02 63.91 2ocy s SER 29 CO 0.54 -0.48 0.00 0.61 0.41 0.00 0.00 173.24 174.33 2ocy n GLY 30 N 4.13 -0.74 0.00 3.44 0.00 -1.26 -1.50 105.19 109.26 2ocy n GLY 30 Ca 0.02 -0.50 0.02 0.00 0.00 0.00 0.00 46.02 45.55 2ocy n GLY 30 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ocy n VAL 31 N -1.85 0.00 -0.00 1.61 0.31 -1.26 0.24 118.33 117.38 2ocy n VAL 31 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.12 2ocy n VAL 31 Cb 0.22 -0.54 -0.14 0.00 -0.91 0.00 0.00 33.84 32.47 2ocy n VAL 31 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ocy n GLY 32 N -0.29 -0.55 0.03 2.92 0.00 -1.21 -4.34 105.19 101.74 2ocy n GLY 32 Ca 0.03 -0.27 -0.03 0.00 0.00 0.00 0.00 46.02 45.74 2ocy n GLY 32 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ocy n LYS 33 N -3.50 1.05 -0.07 1.61 4.76 -0.56 -4.58 118.16 116.88 2ocy n LYS 33 Ca -0.32 0.02 0.24 0.00 -2.87 0.00 0.00 58.31 55.38 2ocy n LYS 33 Cb 1.04 -1.11 0.72 0.00 -1.84 0.00 0.00 35.03 33.84 2ocy n LYS 33 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2ocy h SER 34 N 0.00 0.00 0.00 4.39 4.64 -0.23 1.80 113.55 124.14 2ocy h SER 34 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 2ocy h SER 34 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2ocy h SER 34 CO -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.95 2ocy h LEU 36 N 0.00 0.48 0.00 0.00 5.85 0.25 3.00 115.31 124.88 2ocy h LEU 36 Ca 0.00 0.06 -0.24 0.00 0.84 0.00 0.00 57.88 58.54 2ocy h LEU 36 Cb 0.00 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 2ocy h LEU 36 CO 0.00 0.17 -1.32 -0.07 -0.34 0.00 0.00 178.44 176.88 2ocy h LEU 37 N 0.46 0.00 -1.45 2.25 -0.00 -1.77 0.24 115.31 115.05 2ocy h LEU 37 Ca 0.51 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 58.33 2ocy h LEU 37 Cb 1.19 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.84 2ocy h LEU 37 CO -0.23 0.95 -0.28 0.58 -0.00 0.00 0.00 178.44 179.47 2ocy h VAL 38 N 0.00 1.15 0.09 1.22 2.07 0.39 1.11 116.25 122.28 2ocy h VAL 38 Ca -0.14 -0.97 -0.12 0.00 0.82 0.00 0.00 66.70 66.29 2ocy h VAL 38 Cb 1.85 1.53 0.01 0.00 -1.52 0.00 0.00 31.29 33.17 2ocy h VAL 38 CO 0.10 0.27 -0.52 0.03 0.02 0.00 0.00 177.57 177.47 2ocy h ARG 39 N 0.00 0.20 -0.14 1.57 3.08 0.52 -3.32 114.38 116.29 2ocy h ARG 39 Ca -0.00 -0.33 -0.10 0.00 0.07 0.00 0.00 59.98 59.62 2ocy h ARG 39 Cb 0.51 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 2ocy h ARG 39 CO 0.04 1.15 -0.35 0.35 -1.07 0.00 0.00 179.97 180.09 2ocy h PHE 40 N -0.58 0.31 -2.89 3.04 3.57 -0.07 -3.42 116.94 116.89 2ocy h PHE 40 Ca -0.09 -0.07 -0.67 0.00 3.53 0.00 0.00 57.97 60.67 2ocy h PHE 40 Cb 1.40 -0.07 -0.10 0.00 2.79 0.00 0.00 35.95 39.97 2ocy h PHE 40 CO 0.22 0.59 -0.53 0.08 -2.23 0.00 0.00 178.31 176.45 2ocy s VAL 41 N -4.28 5.10 -0.00 1.41 1.01 0.38 -5.01 120.40 119.01 2ocy s VAL 41 Ca -0.05 0.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.86 2ocy s VAL 41 Cb 0.14 -3.20 -0.33 0.00 0.00 0.00 0.00 36.38 32.98 2ocy s VAL 41 CO 0.77 0.61 0.87 -0.08 0.00 0.00 0.00 175.10 177.26 2ocy h GLU 42 N 5.13 0.46 -4.35 2.72 4.57 -1.82 -3.42 114.58 117.89 2ocy h GLU 42 Ca -0.53 -0.79 -0.59 0.00 -1.18 0.00 0.00 59.36 56.27 2ocy h GLU 42 Cb 1.21 0.30 -0.01 0.00 -0.16 0.00 0.00 28.75 30.08 2ocy h GLU 42 CO 0.58 1.37 0.78 -0.25 -1.18 0.00 0.00 179.01 180.31 2ocy n ASP 43 N -3.65 0.67 -0.04 1.04 8.00 -1.26 -4.80 116.55 116.51 2ocy n ASP 43 Ca -0.20 0.64 0.12 0.00 0.71 0.00 0.00 54.79 56.06 2ocy n ASP 43 Cb 1.09 -0.65 0.25 0.00 -0.02 0.00 0.00 41.12 41.79 2ocy n ASP 43 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2ocy n LYS 44 N 4.43 0.15 0.00 -1.24 5.02 -1.26 -3.73 118.16 121.52 2ocy n LYS 44 Ca 0.33 -0.09 0.13 0.00 -2.02 0.00 0.00 58.31 56.66 2ocy n LYS 44 Cb -0.03 -1.50 0.39 0.00 -0.02 0.00 0.00 35.03 33.87 2ocy n LYS 44 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2ocy n PHE 45 N -1.35 0.00 -2.72 2.13 3.72 -1.26 -4.85 117.46 113.13 2ocy n PHE 45 Ca 0.07 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.04 2ocy n PHE 45 Cb 0.34 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.82 2ocy n PHE 45 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2ocy s ASN 46 N -2.15 6.90 0.87 4.37 0.01 -1.24 -5.02 114.94 118.67 2ocy s ASN 46 Ca 0.32 1.03 -0.11 0.00 -0.71 0.00 0.00 52.86 53.39 2ocy s ASN 46 Cb 0.20 -2.51 0.12 0.00 0.41 0.00 0.00 41.25 39.47 2ocy s ASN 46 CO 0.39 -0.77 1.10 -2.16 -1.51 0.00 0.00 177.10 174.15 2ocy s PRO 47 N 3.39 1.43 -0.24 -0.60 0.04 -1.26 -5.01 135.00 132.74 2ocy s PRO 47 Ca 0.42 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.58 2ocy s PRO 47 Cb -0.13 -1.81 0.07 0.00 0.04 0.00 0.00 34.50 32.67 2ocy s PRO 47 CO 0.13 -2.21 -0.02 0.45 0.04 0.00 0.00 177.00 175.38 2ocy s SER 48 N -3.18 3.80 0.21 6.66 0.15 -1.26 -4.98 113.70 115.10 2ocy s SER 48 Ca 0.64 -1.23 0.23 0.00 0.70 0.00 0.00 55.95 56.28 2ocy s SER 48 Cb -0.19 -1.10 0.08 0.00 -1.71 0.00 0.00 66.02 63.09 2ocy s SER 48 CO 0.57 -0.27 1.13 -0.26 1.20 0.00 0.00 173.24 175.61 2ocy h PHE 49 N 7.98 0.00 -0.82 3.44 0.04 -1.89 -3.35 116.94 122.34 2ocy h PHE 49 Ca -0.16 0.00 0.24 0.00 2.80 0.00 0.00 57.97 60.84 2ocy h PHE 49 Cb 1.07 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.19 2ocy h PHE 49 CO 0.46 0.00 0.68 -0.84 -0.60 0.00 0.00 178.31 178.01 2ocy h ILE 50 N 0.00 0.40 0.01 -0.55 3.07 -1.42 0.28 117.51 119.30 2ocy h ILE 50 Ca 0.00 0.00 -0.00 0.00 1.55 0.00 0.00 64.86 66.41 2ocy h ILE 50 Cb 0.96 0.50 0.00 0.00 -0.27 0.00 0.00 36.82 38.01 2ocy h ILE 50 CO 0.00 0.00 -0.00 0.74 -1.05 0.00 0.00 178.15 177.84 2ocy h THR 51 N 0.00 0.00 0.05 0.16 2.02 -1.87 -3.37 112.91 109.90 2ocy h THR 51 Ca 0.39 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.57 2ocy h THR 51 Cb 1.75 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.16 2ocy h THR 51 CO -0.00 0.00 -0.02 0.71 0.37 0.00 0.00 175.52 176.57 2ocy h THR 52 N -0.01 0.00 -4.01 3.16 1.35 -1.65 -3.43 112.91 108.31 2ocy h THR 52 Ca -0.00 -0.06 -0.49 0.00 -0.55 0.00 0.00 66.41 65.31 2ocy h THR 52 Cb 0.01 0.00 0.04 0.00 -1.73 0.00 0.00 68.15 66.47 2ocy h THR 52 CO 0.00 0.00 0.43 -0.63 -0.25 0.00 0.00 175.52 175.07 2ocy s ILE 53 N -2.12 3.48 -0.87 6.82 1.01 0.92 -4.92 121.20 125.53 2ocy s ILE 53 Ca -0.01 1.06 0.17 0.00 0.00 0.00 0.00 60.65 61.87 2ocy s ILE 53 Cb 0.00 -3.51 0.15 0.00 0.01 0.00 0.00 42.46 39.11 2ocy s ILE 53 CO 0.03 -0.06 1.53 0.61 0.00 0.00 0.00 174.94 177.05 2ocy n GLY 54 N 0.25 -1.08 3.50 6.18 0.00 -1.26 -3.22 105.19 109.56 2ocy n GLY 54 Ca 0.07 -0.02 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 2ocy n GLY 54 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2ocy s ILE 55 N -3.08 0.60 0.08 -0.61 -4.36 -1.26 -3.37 121.20 109.20 2ocy s ILE 55 Ca 0.06 -2.00 -0.24 0.00 -0.26 0.00 0.00 60.65 58.21 2ocy s ILE 55 Cb 0.10 -2.37 0.06 0.00 1.25 0.00 0.00 42.46 41.50 2ocy s ILE 55 CO 0.30 0.00 0.59 -0.62 0.24 0.00 0.00 174.94 175.45 2ocy s ASP 56 N -3.59 -0.54 -0.35 4.36 2.15 -0.91 -2.26 116.67 115.53 2ocy s ASP 56 Ca 0.25 0.20 -0.00 0.00 0.43 0.00 0.00 52.55 53.43 2ocy s ASP 56 Cb 0.03 0.55 0.11 0.00 -0.30 0.00 0.00 42.92 43.31 2ocy s ASP 56 CO 0.15 -0.81 0.15 0.12 -0.17 0.00 0.00 175.17 174.61 2ocy s PHE 57 N -2.79 1.52 0.39 -5.34 5.36 -1.26 -1.60 117.98 114.25 2ocy s PHE 57 Ca -0.03 -1.83 0.08 0.00 -0.96 0.00 0.00 56.93 54.19 2ocy s PHE 57 Cb -0.00 -1.58 -0.04 0.00 -0.34 0.00 0.00 43.02 41.06 2ocy s PHE 57 CO -0.04 -0.84 0.21 0.15 -1.46 0.00 0.00 175.22 173.23 2ocy s LYS 58 N 1.25 2.35 -0.15 10.12 1.02 -1.08 -4.98 119.74 128.26 2ocy s LYS 58 Ca 0.13 -1.67 -0.09 0.00 0.02 0.00 0.00 55.97 54.36 2ocy s LYS 58 Cb -0.20 -2.14 0.05 0.00 -0.52 0.00 0.00 37.83 35.03 2ocy s LYS 58 CO -0.16 -0.05 0.37 0.42 -0.92 0.00 0.00 175.35 175.01 2ocy s ILE 59 N -2.51 -0.03 0.33 2.17 1.01 -1.26 -1.50 121.20 119.41 2ocy s ILE 59 Ca 0.41 0.09 0.03 0.00 0.00 0.00 0.00 60.65 61.19 2ocy s ILE 59 Cb -0.00 -0.55 -0.05 0.00 0.01 0.00 0.00 42.46 41.87 2ocy s ILE 59 CO 0.24 0.04 0.08 -0.75 0.00 0.00 0.00 174.94 174.54 2ocy s LYS 60 N 1.24 1.66 -0.06 2.79 2.20 -1.23 -4.99 119.74 121.35 2ocy s LYS 60 Ca -0.08 -1.94 0.05 0.00 -0.36 0.00 0.00 55.97 53.64 2ocy s LYS 60 Cb -0.08 -0.72 -0.00 0.00 -1.51 0.00 0.00 37.83 35.52 2ocy s LYS 60 CO -0.10 -0.26 -0.21 0.99 -0.36 0.00 0.00 175.35 175.41 2ocy s THR 61 N -3.36 1.75 0.19 3.43 2.01 -1.26 -2.13 115.64 116.27 2ocy s THR 61 Ca 0.34 -0.89 -0.13 0.00 0.31 0.00 0.00 61.69 61.33 2ocy s THR 61 Cb 0.07 -1.50 0.01 0.00 0.01 0.00 0.00 72.50 71.09 2ocy s THR 61 CO 0.15 0.49 0.42 -0.69 -0.69 0.00 0.00 174.62 174.30 2ocy s VAL 62 N 0.04 0.04 -0.46 3.82 1.01 -1.26 -5.00 120.40 118.59 2ocy s VAL 62 Ca -0.07 -1.16 0.06 0.00 0.00 0.00 0.00 61.98 60.81 2ocy s VAL 62 Cb -0.14 -1.82 0.19 0.00 0.00 0.00 0.00 36.38 34.61 2ocy s VAL 62 CO 0.04 -0.17 0.73 -0.62 0.00 0.00 0.00 175.10 175.08 2ocy s ASP 63 N -2.94 -1.37 0.79 3.32 -1.08 -1.26 -5.01 116.67 109.12 2ocy s ASP 63 Ca 0.15 -1.20 -0.11 0.00 -0.52 0.00 0.00 52.55 50.87 2ocy s ASP 63 Cb 0.01 1.77 0.06 0.00 -1.46 0.00 0.00 42.92 43.30 2ocy s ASP 63 CO 0.01 -0.10 1.09 -0.75 0.52 0.00 0.00 175.17 175.94 2ocy s LYS 70 N 1.32 2.16 -0.34 4.34 2.20 -0.70 -5.08 119.74 123.64 2ocy s LYS 70 Ca 0.23 0.79 0.03 0.00 -0.36 0.00 0.00 55.97 56.67 2ocy s LYS 70 Cb -0.01 -1.91 0.16 0.00 -1.51 0.00 0.00 37.83 34.56 2ocy s LYS 70 CO -0.07 -1.61 0.41 -0.51 -0.36 0.00 0.00 175.35 173.22 2ocy s LEU 71 N -5.81 -0.55 -0.01 5.43 1.02 -0.91 -4.37 118.68 113.48 2ocy s LEU 71 Ca 0.61 -0.93 -0.30 0.00 0.02 0.00 0.00 54.13 53.52 2ocy s LEU 71 Cb -0.15 0.95 -0.06 0.00 0.02 0.00 0.00 46.19 46.95 2ocy s LEU 71 CO 0.55 -0.30 1.53 -1.10 0.02 0.00 0.00 176.35 177.05 2ocy s GLN 72 N 2.01 4.23 -0.32 1.70 -0.21 -1.26 -3.55 119.66 122.26 2ocy s GLN 72 Ca 0.13 2.10 0.01 0.00 0.02 0.00 0.00 55.36 57.63 2ocy s GLN 72 Cb -0.13 -3.72 0.10 0.00 1.00 0.00 0.00 33.01 30.26 2ocy s GLN 72 CO -0.17 -0.71 0.07 -0.51 -2.12 0.00 0.00 175.29 171.85 2ocy s LEU 73 N 3.03 3.40 -0.60 2.90 1.43 -0.57 0.99 118.68 129.27 2ocy s LEU 73 Ca 0.68 -1.86 -0.24 0.00 -1.03 0.00 0.00 54.13 51.69 2ocy s LEU 73 Cb -0.33 -1.22 0.05 0.00 0.03 0.00 0.00 46.19 44.71 2ocy s LEU 73 CO 0.28 -0.39 0.95 0.26 0.23 0.00 0.00 176.35 177.68 2ocy s TRP 74 N 1.28 2.73 -0.05 0.29 0.23 -1.20 -2.64 118.94 119.59 2ocy s TRP 74 Ca 0.10 -0.23 -0.21 0.00 -2.03 0.00 0.00 56.10 53.73 2ocy s TRP 74 Cb -0.18 -4.16 -0.05 0.00 0.03 0.00 0.00 33.47 29.12 2ocy s TRP 74 CO -0.17 -1.48 0.60 0.34 0.96 0.00 0.00 176.95 177.20 2ocy s ASP 75 N 3.18 6.91 0.03 2.95 -1.08 -0.63 -2.37 116.67 125.67 2ocy s ASP 75 Ca 0.27 1.09 0.03 0.00 -0.52 0.00 0.00 52.55 53.43 2ocy s ASP 75 Cb -0.14 -2.36 -0.02 0.00 -1.46 0.00 0.00 42.92 38.94 2ocy s ASP 75 CO 0.15 0.01 -0.10 -0.89 0.52 0.00 0.00 175.17 174.86 2ocy s THR 76 N 0.30 0.80 -0.73 1.71 2.01 -0.33 -2.14 115.64 117.25 2ocy s THR 76 Ca 0.32 -0.91 0.14 0.00 0.31 0.00 0.00 61.69 61.55 2ocy s THR 76 Cb -0.17 -0.76 0.42 0.00 0.01 0.00 0.00 72.50 72.00 2ocy s THR 76 CO 0.16 -0.12 1.35 0.00 -0.69 0.00 0.00 174.62 175.32 2ocy n ALA 77 N 1.90 2.53 0.00 7.40 0.00 -1.22 -0.29 120.51 130.83 2ocy n ALA 77 Ca -0.19 -1.56 0.00 0.00 0.00 0.00 0.00 53.44 51.69 2ocy n ALA 77 Cb 0.55 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.41 2ocy n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ocy n GLY 78 N 0.28 0.48 3.57 0.00 0.00 -1.26 -4.55 105.19 103.71 2ocy n GLY 78 Ca 0.16 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2ocy n GLY 78 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ocy s GLN 79 N 0.00 3.82 -0.29 1.61 -0.21 -1.26 -4.80 119.66 118.53 2ocy s GLN 79 Ca 0.00 -1.68 -0.16 0.00 0.02 0.00 0.00 55.36 53.55 2ocy s GLN 79 Cb 0.00 -5.47 0.15 0.00 1.00 0.00 0.00 33.01 28.69 2ocy s GLN 79 CO 0.00 -2.28 1.00 -2.00 -2.12 0.00 0.00 175.29 169.88 2ocy s GLU 80 N 4.55 0.33 0.00 2.91 2.56 -1.26 -4.95 118.70 122.83 2ocy s GLU 80 Ca 0.52 0.64 0.00 0.00 0.00 0.00 0.00 54.97 56.13 2ocy s GLU 80 Cb 0.02 0.17 0.00 0.00 2.00 0.00 0.00 34.13 36.33 2ocy s GLU 80 CO 0.02 -0.08 0.00 2.89 -0.56 0.00 0.00 175.26 177.53 2ocy n ARG 81 N 4.02 0.00 -0.35 4.30 1.85 -1.26 -1.69 116.66 123.52 2ocy n ARG 81 Ca -0.16 0.00 -0.01 0.00 -1.00 0.00 0.00 57.85 56.68 2ocy n ARG 81 Cb 0.56 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.96 2ocy n ARG 81 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2ocy n PHE 82 N -2.51 0.00 0.03 2.89 3.72 -1.26 -4.09 117.46 116.25 2ocy n PHE 82 Ca 0.00 -0.66 -0.07 0.00 -0.05 0.00 0.00 57.45 56.67 2ocy n PHE 82 Cb 0.00 -0.50 0.10 0.00 -0.94 0.00 0.00 39.48 38.14 2ocy n PHE 82 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2ocy h ARG 83 N 2.38 0.44 0.00 -1.08 3.08 -1.64 0.12 114.38 117.69 2ocy h ARG 83 Ca 0.01 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.80 2ocy h ARG 83 Cb 0.66 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.74 2ocy h ARG 83 CO 0.04 0.86 0.00 2.41 -1.07 0.00 0.00 179.97 182.21 2ocy n THR 84 N -3.96 0.94 -0.13 2.04 -1.04 -1.26 -1.81 114.28 109.08 2ocy n THR 84 Ca -0.03 0.29 -0.24 0.00 -2.04 0.00 0.00 64.05 62.03 2ocy n THR 84 Cb 0.58 -1.19 -0.10 0.00 -1.82 0.00 0.00 70.33 67.81 2ocy n THR 84 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2ocy n ILE 85 N -2.01 1.41 -0.27 12.58 5.41 -0.84 -3.71 119.36 131.93 2ocy n ILE 85 Ca 0.02 -0.42 0.19 0.00 1.00 0.00 0.00 62.75 63.54 2ocy n ILE 85 Cb 0.19 -1.69 0.49 0.00 -0.71 0.00 0.00 39.64 37.91 2ocy n ILE 85 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 2ocy h THR 86 N -0.63 0.67 -0.39 1.39 1.35 -0.68 0.60 112.91 115.22 2ocy h THR 86 Ca -0.62 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 2ocy h THR 86 Cb 1.66 0.17 -0.02 0.00 -1.73 0.00 0.00 68.15 68.23 2ocy h THR 86 CO -0.30 0.08 0.25 0.71 -0.25 0.00 0.00 175.52 176.02 2ocy h THR 87 N 0.46 1.11 -0.10 6.82 1.35 -1.53 0.24 112.91 121.25 2ocy h THR 87 Ca 0.50 -0.21 0.03 0.00 -0.55 0.00 0.00 66.41 66.18 2ocy h THR 87 Cb 1.17 0.55 -0.00 0.00 -1.73 0.00 0.00 68.15 68.13 2ocy h THR 87 CO -0.21 0.10 0.17 0.00 -0.25 0.00 0.00 175.52 175.33 2ocy h ALA 88 N 1.13 1.54 -0.36 6.62 0.00 0.09 0.11 119.26 128.39 2ocy h ALA 88 Ca 0.14 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2ocy h ALA 88 Cb -0.05 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2ocy h ALA 88 CO -0.03 -0.23 -0.18 1.88 0.00 0.00 0.00 179.25 180.69 2ocy h TYR 89 N 0.00 0.89 -0.69 0.00 0.05 -0.04 -3.18 116.97 114.00 2ocy h TYR 89 Ca 0.05 -0.22 0.14 0.00 0.05 0.00 0.00 58.73 58.74 2ocy h TYR 89 Cb 0.39 -0.20 -0.10 0.00 1.01 0.00 0.00 36.73 37.83 2ocy h TYR 89 CO 0.00 0.96 0.19 1.88 -1.05 0.00 0.00 178.16 180.14 2ocy h TYR 90 N 0.56 0.30 0.00 4.88 0.05 -0.68 -2.80 116.97 119.28 2ocy h TYR 90 Ca 0.08 0.04 -0.13 0.00 0.05 0.00 0.00 58.73 58.77 2ocy h TYR 90 Cb 0.73 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.43 2ocy h TYR 90 CO 0.06 -0.03 0.94 -2.13 -1.05 0.00 0.00 178.16 175.95 2ocy n ARG 91 N -5.11 0.91 0.00 4.88 3.00 -1.20 -2.56 116.66 116.57 2ocy n ARG 91 Ca 0.12 -0.64 0.00 0.00 -0.00 0.00 0.00 57.85 57.33 2ocy n ARG 91 Cb 0.40 -1.92 0.00 0.00 0.00 0.00 0.00 32.46 30.94 2ocy n ARG 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2ocy n GLY 92 N 3.27 0.04 1.17 5.14 0.00 -1.14 -5.08 105.19 108.59 2ocy n GLY 92 Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 2ocy n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ocy n ALA 93 N 0.00 -1.27 -0.78 4.61 0.00 -1.06 -4.96 120.51 117.06 2ocy n ALA 93 Ca 0.00 -0.37 -0.29 0.00 0.00 0.00 0.00 53.44 52.78 2ocy n ALA 93 Cb 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 19.45 19.44 2ocy n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ocy n GLY 95 N -0.95 -2.29 3.64 0.00 0.00 -1.24 -4.92 105.19 99.43 2ocy n GLY 95 Ca 0.03 -0.08 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 2ocy n GLY 95 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ocy s ILE 96 N -1.57 -0.06 -0.09 -0.61 1.01 -0.57 -3.28 121.20 116.03 2ocy s ILE 96 Ca 0.27 0.00 0.04 0.00 0.00 0.00 0.00 60.65 60.96 2ocy s ILE 96 Cb 0.08 -1.00 -0.01 0.00 0.01 0.00 0.00 42.46 41.54 2ocy s ILE 96 CO 0.50 0.00 -0.20 -0.63 0.00 0.00 0.00 174.94 174.61 2ocy s ILE 97 N 1.64 2.50 -0.18 2.92 1.01 -1.15 0.69 121.20 128.63 2ocy s ILE 97 Ca -0.09 -0.89 -0.08 0.00 0.00 0.00 0.00 60.65 59.58 2ocy s ILE 97 Cb -0.05 -1.97 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 2ocy s ILE 97 CO -0.19 0.56 0.10 -0.76 0.00 0.00 0.00 174.94 174.65 2ocy s LEU 98 N -0.01 4.05 0.19 2.97 1.43 0.27 -2.25 118.68 125.33 2ocy s LEU 98 Ca -0.06 0.20 0.06 0.00 -1.03 0.00 0.00 54.13 53.29 2ocy s LEU 98 Cb -0.15 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 44.00 2ocy s LEU 98 CO 0.05 0.21 -0.10 -0.69 0.23 0.00 0.00 176.35 176.06 2ocy s VAL 99 N 0.14 1.39 0.09 -1.59 1.01 -0.67 0.01 120.40 120.79 2ocy s VAL 99 Ca 0.07 -2.12 -0.16 0.00 0.00 0.00 0.00 61.98 59.78 2ocy s VAL 99 Cb -0.12 -2.06 0.03 0.00 0.00 0.00 0.00 36.38 34.24 2ocy s VAL 99 CO -0.00 -0.58 0.37 -0.72 0.00 0.00 0.00 175.10 174.17 2ocy s TYR 100 N -3.19 -0.17 0.13 5.22 -0.85 -1.20 -4.56 117.35 112.73 2ocy s TYR 100 Ca 0.22 -0.07 -0.13 0.00 -0.52 0.00 0.00 57.07 56.57 2ocy s TYR 100 Cb 0.02 0.20 -0.07 0.00 0.38 0.00 0.00 41.96 42.50 2ocy s TYR 100 CO 0.05 -0.64 0.50 0.34 -1.52 0.00 0.00 175.55 174.29 2ocy s ASP 101 N -2.56 6.76 -0.13 -0.18 -1.08 -1.26 -4.42 116.67 113.80 2ocy s ASP 101 Ca 0.01 0.98 -0.24 0.00 -0.52 0.00 0.00 52.55 52.77 2ocy s ASP 101 Cb 0.01 -2.25 -0.22 0.00 -1.46 0.00 0.00 42.92 39.01 2ocy s ASP 101 CO -0.09 0.11 0.66 0.58 0.52 0.00 0.00 175.17 176.96 2ocy h VAL 102 N 2.76 1.50 0.00 1.11 2.07 -1.99 -3.31 116.25 118.40 2ocy h VAL 102 Ca -0.49 -2.10 0.00 0.00 0.82 0.00 0.00 66.70 64.94 2ocy h VAL 102 Cb 1.19 2.82 0.00 0.00 -1.52 0.00 0.00 31.29 33.78 2ocy h VAL 102 CO 0.66 0.50 0.00 1.07 0.02 0.00 0.00 177.57 179.83 2ocy n THR 103 N -4.65 0.00 -3.45 2.57 5.66 -1.26 -4.22 114.28 108.94 2ocy n THR 103 Ca -0.08 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.78 2ocy n THR 103 Cb 0.40 -0.25 -0.11 0.00 -1.55 0.00 0.00 70.33 68.82 2ocy n THR 103 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2ocy s ASP 104 N -1.47 0.77 0.00 1.09 1.01 -1.24 -4.99 116.67 111.83 2ocy s ASP 104 Ca 0.00 0.07 0.21 0.00 0.71 0.00 0.00 52.55 53.54 2ocy s ASP 104 Cb 0.00 0.74 1.09 0.00 1.01 0.00 0.00 42.92 45.76 2ocy s ASP 104 CO 0.00 -0.31 1.66 -0.62 0.21 0.00 0.00 175.17 176.12 2ocy n GLU 105 N 5.34 0.35 -0.04 8.23 1.02 -1.26 -3.04 120.64 131.25 2ocy n GLU 105 Ca -0.05 0.08 -0.13 0.00 -0.02 0.00 0.00 57.16 57.04 2ocy n GLU 105 Cb 0.50 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.31 2ocy n GLU 105 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2ocy h ARG 106 N 0.00 -0.02 -0.23 3.49 2.43 -1.93 -3.01 114.38 115.10 2ocy h ARG 106 Ca 0.00 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 2ocy h ARG 106 Cb 0.17 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.67 2ocy h ARG 106 CO 0.00 0.70 -0.11 1.79 -1.51 0.00 0.00 179.97 180.84 2ocy h THR 107 N -0.80 0.66 -0.68 0.20 1.35 -1.82 -1.60 112.91 110.22 2ocy h THR 107 Ca -0.00 0.00 0.14 0.00 -0.55 0.00 0.00 66.41 65.99 2ocy h THR 107 Cb 0.73 0.66 -0.13 0.00 -1.73 0.00 0.00 68.15 67.68 2ocy h THR 107 CO 0.00 0.00 -0.17 0.15 -0.25 0.00 0.00 175.52 175.26 2ocy h PHE 108 N -0.08 -0.36 -0.90 4.73 3.04 -1.65 0.27 116.94 122.00 2ocy h PHE 108 Ca 0.12 0.06 0.16 0.00 3.98 0.00 0.00 57.97 62.29 2ocy h PHE 108 Cb 0.26 0.26 -0.10 0.00 2.56 0.00 0.00 35.95 38.94 2ocy h PHE 108 CO -0.28 -0.29 0.49 1.15 -2.02 0.00 0.00 178.31 177.36 2ocy h THR 109 N 0.00 0.72 -0.35 4.41 2.02 -1.15 -0.66 112.91 117.90 2ocy h THR 109 Ca 0.33 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 67.26 2ocy h THR 109 Cb 0.50 -0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 2ocy h THR 109 CO -0.70 0.12 0.15 0.78 0.37 0.00 0.00 175.52 176.24 2ocy h ASN 110 N 0.67 0.47 -0.61 4.18 4.21 -0.20 -3.12 115.58 121.19 2ocy h ASN 110 Ca 0.50 -0.15 0.10 0.00 1.21 0.00 0.00 56.30 57.95 2ocy h ASN 110 Cb 0.72 -0.12 -0.10 0.00 -1.12 0.00 0.00 38.32 37.70 2ocy h ASN 110 CO -0.37 0.50 -0.23 -0.38 -1.29 0.00 0.00 177.43 175.66 2ocy n ILE 111 N -4.71 -0.31 -0.11 2.81 2.08 -0.25 0.21 119.36 119.08 2ocy n ILE 111 Ca -0.01 1.41 -0.08 0.00 0.56 0.00 0.00 62.75 64.63 2ocy n ILE 111 Cb 0.13 -1.88 -0.02 0.00 -0.75 0.00 0.00 39.64 37.12 2ocy n ILE 111 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 2ocy h LYS 112 N 0.00 -0.27 -0.35 0.38 3.64 -1.60 -0.65 116.57 117.71 2ocy h LYS 112 Ca 0.22 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.65 2ocy h LYS 112 Cb 0.37 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.22 2ocy h LYS 112 CO -0.60 -0.18 0.15 1.96 -2.27 0.00 0.00 179.45 178.51 2ocy h GLN 113 N -0.28 0.31 -0.60 1.90 1.08 0.24 -3.12 115.11 114.64 2ocy h GLN 113 Ca 0.16 -0.02 0.07 0.00 -1.45 0.00 0.00 58.65 57.42 2ocy h GLN 113 Cb 0.55 -0.07 -0.10 0.00 -0.05 0.00 0.00 27.48 27.81 2ocy h GLN 113 CO -0.53 0.20 -0.52 -1.49 -0.95 0.00 0.00 178.83 175.54 2ocy h TRP 114 N 0.31 -1.59 -0.84 2.96 -0.00 0.78 0.19 115.95 117.76 2ocy h TRP 114 Ca 0.16 0.09 0.15 0.00 -0.00 0.00 0.00 58.89 59.29 2ocy h TRP 114 Cb 0.10 0.78 -0.06 0.00 -0.00 0.00 0.00 29.16 29.98 2ocy h TRP 114 CO -0.12 -0.44 0.55 0.35 -0.00 0.00 0.00 178.44 178.77 2ocy h PHE 115 N -0.25 0.68 -0.80 0.49 3.57 -1.37 0.35 116.94 119.60 2ocy h PHE 115 Ca 0.13 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 2ocy h PHE 115 Cb 0.55 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 2ocy h PHE 115 CO -0.79 0.25 0.49 0.87 -2.23 0.00 0.00 178.31 176.90 2ocy h LYS 116 N 0.57 1.09 0.18 1.11 1.79 -0.61 -2.64 116.57 118.07 2ocy h LYS 116 Ca 0.42 -0.10 -0.01 0.00 -2.18 0.00 0.00 60.65 58.78 2ocy h LYS 116 Cb 0.79 -0.23 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 2ocy h LYS 116 CO -0.17 0.76 -0.09 1.15 -1.08 0.00 0.00 179.45 180.02 2ocy h THR 117 N 1.10 0.90 -0.52 -0.16 2.02 -0.14 -2.76 112.91 113.35 2ocy h THR 117 Ca 0.29 -0.46 0.15 0.00 0.77 0.00 0.00 66.41 67.16 2ocy h THR 117 Cb -0.05 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 2ocy h THR 117 CO -0.05 0.10 0.69 0.58 0.37 0.00 0.00 175.52 177.21 2ocy h VAL 118 N -0.47 0.19 0.00 3.16 2.07 -1.08 -3.22 116.25 116.89 2ocy h VAL 118 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2ocy h VAL 118 Cb 0.36 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 2ocy h VAL 118 CO 0.04 0.00 0.00 0.59 0.02 0.00 0.00 177.57 178.22 2ocy n ASN 119 N -3.39 0.00 -0.30 0.57 5.03 -1.02 -2.82 115.26 113.33 2ocy n ASN 119 Ca 0.10 0.25 0.03 0.00 0.87 0.00 0.00 54.58 55.84 2ocy n ASN 119 Cb 0.88 0.00 0.17 0.00 -1.02 0.00 0.00 39.78 39.81 2ocy n ASN 119 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 2ocy h GLU 120 N 0.00 0.79 0.04 3.52 5.08 -1.69 -3.32 114.58 119.00 2ocy h GLU 120 Ca 0.00 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2ocy h GLU 120 Cb 0.00 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2ocy h GLU 120 CO 0.00 0.53 -0.02 0.45 -1.00 0.00 0.00 179.01 178.97 2ocy h HIS 121 N 0.82 -0.05 -0.29 4.33 3.86 -1.75 -3.47 115.15 118.59 2ocy h HIS 121 Ca 0.41 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.62 2ocy h HIS 121 Cb 0.37 0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.86 2ocy h HIS 121 CO -0.05 -0.03 0.00 0.00 0.86 0.00 0.00 177.93 178.71 2ocy n ALA 122 N -2.13 0.00 -3.03 2.45 0.00 -1.13 -4.64 120.51 112.04 2ocy n ALA 122 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 2ocy n ALA 122 Cb 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.32 2ocy n ALA 122 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2ocy s ASN 123 N -1.76 3.82 0.00 0.00 0.02 -1.26 -4.84 114.94 110.92 2ocy s ASN 123 Ca 0.00 -0.36 0.30 0.00 -1.02 0.00 0.00 52.86 51.78 2ocy s ASN 123 Cb 0.00 -1.47 1.48 0.00 0.02 0.00 0.00 41.25 41.28 2ocy s ASN 123 CO 0.00 0.19 2.00 0.47 0.02 0.00 0.00 177.10 179.77 2ocy n ASP 124 N 3.38 0.39 0.07 -1.22 8.00 -1.26 -3.36 116.55 122.55 2ocy n ASP 124 Ca -0.18 -0.79 0.05 0.00 0.71 0.00 0.00 54.79 54.58 2ocy n ASP 124 Cb 0.53 -0.07 -0.04 0.00 -0.02 0.00 0.00 41.12 41.52 2ocy n ASP 124 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2ocy h GLU 125 N 0.55 0.00 -6.44 -1.24 9.09 -1.99 -3.47 114.58 111.08 2ocy h GLU 125 Ca 0.00 0.00 -0.54 0.00 0.05 0.00 0.00 59.36 58.87 2ocy h GLU 125 Cb 0.24 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.31 2ocy h GLU 125 CO 0.00 0.17 0.11 0.00 0.05 0.00 0.00 179.01 179.34 2ocy s ALA 126 N -3.12 3.49 -0.28 1.06 0.00 -1.21 -4.97 121.76 116.73 2ocy s ALA 126 Ca -0.01 0.26 -0.36 0.00 0.00 0.00 0.00 51.96 51.84 2ocy s ALA 126 Cb 0.09 -2.85 -0.12 0.00 0.00 0.00 0.00 23.12 20.23 2ocy s ALA 126 CO 0.80 0.33 2.03 0.94 0.00 0.00 0.00 175.76 179.85 2ocy n GLN 127 N 1.58 1.35 -2.94 0.00 -0.06 -1.26 -4.88 117.38 111.17 2ocy n GLN 127 Ca -0.07 0.43 -0.20 0.00 -2.00 0.00 0.00 57.00 55.17 2ocy n GLN 127 Cb 0.49 -2.44 0.06 0.00 -4.06 0.00 0.00 30.24 24.29 2ocy n GLN 127 CO 0.00 0.00 0.00 -1.17 -0.20 0.00 0.00 177.06 175.69 2ocy s LEU 128 N 5.82 3.20 -0.24 1.69 0.20 -1.26 -1.51 118.68 126.58 2ocy s LEU 128 Ca 1.03 -0.64 -0.28 0.00 0.69 0.00 0.00 54.13 54.94 2ocy s LEU 128 Cb -0.86 -1.96 0.15 0.00 -0.43 0.00 0.00 46.19 43.09 2ocy s LEU 128 CO 0.53 -1.30 1.15 -0.22 -0.29 0.00 0.00 176.35 176.22 2ocy s LEU 129 N -4.69 -0.28 -0.03 -0.68 0.20 0.22 -4.76 118.68 108.67 2ocy s LEU 129 Ca 0.61 0.41 0.06 0.00 0.69 0.00 0.00 54.13 55.90 2ocy s LEU 129 Cb -0.07 1.59 -0.01 0.00 -0.43 0.00 0.00 46.19 47.27 2ocy s LEU 129 CO 0.39 -0.18 -0.22 -0.22 -0.29 0.00 0.00 176.35 175.83 2ocy s LEU 130 N -0.52 2.02 -0.24 -0.68 0.20 -1.25 0.96 118.68 119.17 2ocy s LEU 130 Ca 0.03 -0.41 -0.11 0.00 0.69 0.00 0.00 54.13 54.33 2ocy s LEU 130 Cb -0.03 -1.15 0.09 0.00 -0.43 0.00 0.00 46.19 44.67 2ocy s LEU 130 CO -0.05 0.24 0.54 -0.69 -0.29 0.00 0.00 176.35 176.10 2ocy s VAL 131 N -0.31 -0.37 0.00 1.68 1.01 0.10 -3.87 120.40 118.65 2ocy s VAL 131 Ca 0.03 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.07 2ocy s VAL 131 Cb -0.10 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.46 2ocy s VAL 131 CO 0.01 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.75 2ocy n GLY 132 N 4.79 1.30 1.43 4.51 0.00 -1.26 -3.25 105.19 112.71 2ocy n GLY 132 Ca -0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 2ocy n GLY 132 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ocy n ASP 145 N 0.00 3.41 -0.08 1.61 2.03 -1.26 -3.28 116.55 118.98 2ocy n ASP 145 Ca 0.00 -2.55 -0.11 0.00 0.52 0.00 0.00 54.79 52.65 2ocy n ASP 145 Cb 0.00 -0.64 -0.04 0.00 -0.72 0.00 0.00 41.12 39.72 2ocy n ASP 145 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 2ocy n GLN 146 N -0.01 0.48 -0.01 -0.67 7.27 -1.26 -4.45 117.38 118.74 2ocy n GLN 146 Ca 0.20 0.19 0.23 0.00 0.07 0.00 0.00 57.00 57.70 2ocy n GLN 146 Cb 0.87 -1.34 0.65 0.00 2.41 0.00 0.00 30.24 32.84 2ocy n GLN 146 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 2ocy h GLY 147 N -0.89 0.00 -0.11 1.69 0.00 -2.01 0.71 103.07 102.46 2ocy h GLY 147 Ca -0.10 0.00 0.30 0.00 0.00 0.00 0.00 47.33 47.53 2ocy h GLY 147 CO -0.06 0.00 0.75 -2.09 0.00 0.00 0.00 176.54 175.14 2ocy h GLU 148 N 0.00 0.04 0.00 4.80 4.57 -1.97 0.18 114.58 122.20 2ocy h GLU 148 Ca 0.30 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.47 2ocy h GLU 148 Cb 1.70 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 30.28 2ocy h GLU 148 CO -0.00 0.02 0.00 0.00 -1.18 0.00 0.00 179.01 177.85 2ocy n ALA 149 N -2.72 -0.10 0.00 2.92 0.00 0.25 -1.33 120.51 119.53 2ocy n ALA 149 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2ocy n ALA 149 Cb 1.10 0.08 0.00 0.00 0.00 0.00 0.00 19.45 20.63 2ocy n ALA 149 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ocy n LEU 150 N -1.05 0.00 0.04 0.00 4.77 -0.89 -1.12 117.00 118.75 2ocy n LEU 150 Ca 0.00 0.43 -0.12 0.00 -0.03 0.00 0.00 56.01 56.29 2ocy n LEU 150 Cb 0.00 -0.43 -0.09 0.00 -2.33 0.00 0.00 43.42 40.57 2ocy n LEU 150 CO 0.00 -0.43 0.54 0.00 -1.33 0.00 0.00 177.39 176.17 2ocy h ALA 151 N 1.82 -0.15 -0.00 -1.18 0.00 -0.20 -3.13 119.26 116.43 2ocy h ALA 151 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2ocy h ALA 151 Cb 0.08 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2ocy h ALA 151 CO 0.00 -0.32 -0.00 1.63 0.00 0.00 0.00 179.25 180.56 2ocy n LYS 152 N -4.92 1.04 -0.07 0.00 5.02 -0.28 -3.19 118.16 115.76 2ocy n LYS 152 Ca -0.08 -0.10 0.10 0.00 -2.02 0.00 0.00 58.31 56.21 2ocy n LYS 152 Cb 0.26 -1.50 0.39 0.00 -0.02 0.00 0.00 35.03 34.16 2ocy n LYS 152 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2ocy n GLU 153 N -0.89 1.66 0.00 1.97 1.02 -1.02 -3.84 120.64 119.54 2ocy n GLU 153 Ca 0.23 -1.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.37 2ocy n GLU 153 Cb 0.14 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 2ocy n GLU 153 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2ocy n LEU 154 N 0.22 0.30 -3.22 -4.62 4.77 -1.19 -5.04 117.00 108.22 2ocy n LEU 154 Ca 0.16 -0.36 -0.13 0.00 -0.03 0.00 0.00 56.01 55.65 2ocy n LEU 154 Cb 0.31 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.46 2ocy n LEU 154 CO 0.13 0.07 0.07 0.61 -1.33 0.00 0.00 177.39 176.94 2ocy n GLY 155 N 0.13 -1.17 3.37 -0.72 0.00 -1.25 -5.04 105.19 100.51 2ocy n GLY 155 Ca 0.00 0.57 -0.15 0.00 0.00 0.00 0.00 46.02 46.44 2ocy n GLY 155 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ocy s ILE 156 N -3.34 0.03 1.23 -0.61 1.01 -1.26 -5.07 121.20 113.19 2ocy s ILE 156 Ca 0.40 -0.22 -0.20 0.00 0.00 0.00 0.00 60.65 60.64 2ocy s ILE 156 Cb -0.05 -0.77 0.31 0.00 0.01 0.00 0.00 42.46 41.96 2ocy s ILE 156 CO 0.74 -0.12 0.70 -0.81 0.00 0.00 0.00 174.94 175.45 2ocy n PRO 157 N 1.46 -4.00 -3.60 2.79 -0.04 -1.26 -4.67 135.00 125.68 2ocy n PRO 157 Ca -0.19 -1.17 -0.09 0.00 -0.04 0.00 0.00 63.50 62.01 2ocy n PRO 157 Cb 0.56 -1.61 -0.05 0.00 -0.04 0.00 0.00 33.50 32.36 2ocy n PRO 157 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2ocy s PHE 158 N -1.95 -0.33 0.00 0.54 5.36 -1.25 -3.75 117.98 116.60 2ocy s PHE 158 Ca 0.54 0.61 0.00 0.00 -0.96 0.00 0.00 56.93 57.12 2ocy s PHE 158 Cb -0.10 0.44 0.00 0.00 -0.34 0.00 0.00 43.02 43.03 2ocy s PHE 158 CO 0.45 -0.27 0.00 -0.89 -1.46 0.00 0.00 175.22 173.05 2ocy n ILE 159 N 0.96 0.00 -4.36 3.12 5.41 -1.26 -5.05 119.36 118.19 2ocy n ILE 159 Ca -0.09 0.00 -0.19 0.00 1.00 0.00 0.00 62.75 63.46 2ocy n ILE 159 Cb 0.58 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 39.41 2ocy n ILE 159 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 2ocy s GLU 160 N 1.17 1.62 -1.44 0.38 2.02 -1.26 -4.09 118.70 117.09 2ocy s GLU 160 Ca 0.00 -1.92 -0.09 0.00 0.02 0.00 0.00 54.97 52.98 2ocy s GLU 160 Cb 0.00 -0.20 -0.08 0.00 0.10 0.00 0.00 34.13 33.95 2ocy s GLU 160 CO 0.00 -0.43 2.74 0.43 0.02 0.00 0.00 175.26 178.02 2ocy n SER 161 N -0.92 7.76 0.00 -0.19 7.64 -1.21 -4.76 113.62 121.96 2ocy n SER 161 Ca 0.00 -2.51 0.00 0.00 1.01 0.00 0.00 58.87 57.38 2ocy n SER 161 Cb 0.65 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 2ocy n SER 161 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2ocy n SER 162 N 3.75 0.00 -1.41 6.43 7.64 -1.26 -5.10 113.62 123.68 2ocy n SER 162 Ca 0.70 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.58 2ocy n SER 162 Cb 0.20 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 2ocy n SER 162 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ocy n ALA 163 N -3.00 -0.76 0.00 -0.43 0.00 -1.26 -5.12 120.51 109.95 2ocy n ALA 163 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ocy n ALA 163 Cb 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.12 2ocy n ALA 163 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2ocy n ASN 168 N -1.26 0.00 -0.12 0.00 2.85 -1.26 -5.08 115.26 110.39 2ocy n ASN 168 Ca 0.00 0.00 -0.12 0.00 -0.11 0.00 0.00 54.58 54.35 2ocy n ASN 168 Cb 0.47 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.46 2ocy n ASN 168 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 2ocy h VAL 169 N 0.00 1.29 -0.35 3.44 2.07 -1.98 -2.26 116.25 118.45 2ocy h VAL 169 Ca 0.00 -1.32 0.10 0.00 0.82 0.00 0.00 66.70 66.30 2ocy h VAL 169 Cb 0.00 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2ocy h VAL 169 CO 0.00 0.43 0.29 0.78 0.02 0.00 0.00 177.57 179.09 2ocy h ASN 170 N 0.54 0.00 0.58 0.57 2.35 -1.95 0.38 115.58 118.04 2ocy h ASN 170 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2ocy h ASN 170 Cb 0.74 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.11 2ocy h ASN 170 CO 0.06 0.00 -0.51 -0.62 -1.65 0.00 0.00 177.43 174.71 2ocy n GLU 171 N -4.20 0.05 0.17 0.81 4.71 -0.94 -3.83 120.64 117.42 2ocy n GLU 171 Ca 0.06 0.01 0.02 0.00 -0.01 0.00 0.00 57.16 57.23 2ocy n GLU 171 Cb 0.46 -1.53 0.32 0.00 -1.01 0.00 0.00 31.44 29.68 2ocy n GLU 171 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 2ocy h ILE 172 N 0.00 1.30 0.00 -3.67 2.04 0.32 -1.37 117.51 116.13 2ocy h ILE 172 Ca 0.00 -1.45 -0.02 0.00 1.00 0.00 0.00 64.86 64.40 2ocy h ILE 172 Cb 0.54 1.77 -0.00 0.00 -0.74 0.00 0.00 36.82 38.39 2ocy h ILE 172 CO 0.00 0.41 -0.97 -0.26 0.00 0.00 0.00 178.15 177.34 2ocy h PHE 173 N 0.01 0.00 -0.36 1.37 -1.00 -1.68 -3.30 116.94 111.98 2ocy h PHE 173 Ca -0.00 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.75 2ocy h PHE 173 Cb 0.75 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.29 2ocy h PHE 173 CO 0.00 0.06 0.11 0.35 -1.61 0.00 0.00 178.31 177.22 2ocy h PHE 174 N 0.00 0.59 0.00 -0.55 3.57 -1.48 -1.82 116.94 117.25 2ocy h PHE 174 Ca -0.01 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.43 2ocy h PHE 174 Cb 1.06 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.63 2ocy h PHE 174 CO 0.00 0.56 0.00 2.41 -2.23 0.00 0.00 178.31 179.05 2ocy n THR 175 N -4.63 0.00 -0.15 4.41 -1.04 -0.59 -0.41 114.28 111.87 2ocy n THR 175 Ca -0.01 0.99 -0.04 0.00 -2.04 0.00 0.00 64.05 62.95 2ocy n THR 175 Cb 0.17 -1.87 -0.04 0.00 -1.82 0.00 0.00 70.33 66.78 2ocy n THR 175 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2ocy n LEU 176 N -0.61 -0.39 -0.25 -4.42 7.94 -1.24 0.11 117.00 118.14 2ocy n LEU 176 Ca 0.00 0.91 0.05 0.00 -1.11 0.00 0.00 56.01 55.86 2ocy n LEU 176 Cb 0.00 -0.21 0.15 0.00 0.53 0.00 0.00 43.42 43.89 2ocy n LEU 176 CO 0.00 -0.66 0.83 0.00 -1.11 0.00 0.00 177.39 176.44 2ocy h ALA 177 N -0.08 0.77 -0.95 1.96 0.00 -1.35 0.71 119.26 120.33 2ocy h ALA 177 Ca 0.06 0.24 0.11 0.00 0.00 0.00 0.00 54.91 55.32 2ocy h ALA 177 Cb 0.15 0.41 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 2ocy h ALA 177 CO -0.34 -0.42 0.58 -0.22 0.00 0.00 0.00 179.25 178.85 2ocy h LYS 178 N 0.11 0.91 0.01 0.00 3.64 0.37 0.13 116.57 121.74 2ocy h LYS 178 Ca 0.41 -0.05 -0.20 0.00 -1.27 0.00 0.00 60.65 59.53 2ocy h LYS 178 Cb 0.71 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 2ocy h LYS 178 CO -0.65 0.60 -0.91 -0.07 -2.27 0.00 0.00 179.45 176.15 2ocy h LEU 179 N 0.93 0.22 -1.78 5.20 3.38 0.84 -2.19 115.31 121.91 2ocy h LEU 179 Ca 0.47 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 58.26 2ocy h LEU 179 Cb 0.45 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2ocy h LEU 179 CO -0.26 1.01 0.16 0.40 0.09 0.00 0.00 178.44 179.84 2ocy h ILE 180 N 0.08 1.05 0.03 1.22 2.04 0.27 0.48 117.51 122.69 2ocy h ILE 180 Ca -0.04 -0.10 -0.25 0.00 1.00 0.00 0.00 64.86 65.46 2ocy h ILE 180 Cb 1.56 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 38.33 2ocy h ILE 180 CO 0.14 0.06 -1.27 -0.61 0.00 0.00 0.00 178.15 176.46 2ocy h GLN 181 N 0.30 0.07 -1.80 2.37 5.75 -0.87 -3.21 115.11 117.73 2ocy h GLN 181 Ca 0.09 -0.12 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 2ocy h GLN 181 Cb -0.01 0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.58 2ocy h GLN 181 CO -0.02 0.93 0.00 -1.91 -2.65 0.00 0.00 178.83 175.18 2ocy n GLU 182 N -3.32 0.78 0.00 1.69 2.13 0.15 -1.72 120.64 120.36 2ocy n GLU 182 Ca -0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.75 2ocy n GLU 182 Cb 0.99 -1.11 0.00 0.00 0.27 0.00 0.00 31.44 31.59 2ocy n GLU 182 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2ocy n LYS 183 N 1.35 1.49 -0.29 5.31 4.76 -1.16 -4.72 118.16 124.91 2ocy n LYS 183 Ca 0.00 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.46 2ocy n LYS 183 Cb 0.39 -0.69 0.13 0.00 -1.84 0.00 0.00 35.03 33.02 2ocy n LYS 183 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2ocy n ILE 184 N -1.10 0.88 1.12 -0.18 5.41 -0.70 -3.38 119.36 121.41 2ocy n ILE 184 Ca 0.00 -0.45 0.13 0.00 1.00 0.00 0.00 62.75 63.43 2ocy n ILE 184 Cb 0.19 -0.41 0.44 0.00 -0.71 0.00 0.00 39.64 39.16 2ocy n ILE 184 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2ocy n ASP 185 N 0.20 0.42 0.00 4.38 5.75 -1.26 -5.15 116.55 120.90 2ocy n ASP 185 Ca 0.09 -0.20 0.00 0.00 -0.01 0.00 0.00 54.79 54.67 2ocy n ASP 185 Cb 0.55 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.61 2ocy n ASP 185 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55