#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ouw s PRO 4 N 0.00 2.47 0.06 5.55 0.02 -1.26 -5.05 135.00 136.79 1ouw s PRO 4 Ca 0.00 1.62 0.00 0.00 0.02 0.00 0.00 61.00 62.64 1ouw s PRO 4 Cb 0.00 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.60 1ouw s PRO 4 CO 0.00 -1.55 -0.05 -1.64 -0.33 0.00 0.00 177.00 173.43 1ouw s MET 5 N -3.93 0.64 0.41 5.54 -1.94 -1.26 -5.14 119.30 113.63 1ouw s MET 5 Ca 0.72 -1.14 -0.25 0.00 -1.71 0.00 0.00 55.69 53.31 1ouw s MET 5 Cb -0.26 0.01 -0.08 0.00 2.01 0.00 0.00 34.83 36.51 1ouw s MET 5 CO 0.42 -0.06 1.19 -0.51 -0.01 0.00 0.00 175.02 176.06 1ouw s ASP 6 N -2.66 6.42 0.19 3.03 1.01 -1.26 -4.94 116.67 118.45 1ouw s ASP 6 Ca 0.04 2.39 -0.31 0.00 0.71 0.00 0.00 52.55 55.39 1ouw s ASP 6 Cb 0.03 -2.62 -0.09 0.00 1.01 0.00 0.00 42.92 41.25 1ouw s ASP 6 CO -0.06 -0.75 1.42 -0.89 0.21 0.00 0.00 175.17 175.10 1ouw s THR 7 N -1.41 2.93 -0.07 -1.27 2.01 -1.13 -4.68 115.64 112.03 1ouw s THR 7 Ca 0.58 0.73 -0.18 0.00 0.31 0.00 0.00 61.69 63.14 1ouw s THR 7 Cb -0.32 -3.47 -0.05 0.00 0.01 0.00 0.00 72.50 68.68 1ouw s THR 7 CO 0.40 0.09 0.47 -0.63 -0.69 0.00 0.00 174.62 174.26 1ouw s ILE 8 N 0.48 5.11 -0.04 1.82 1.01 -1.26 -0.67 121.20 127.65 1ouw s ILE 8 Ca 0.62 0.96 0.03 0.00 0.00 0.00 0.00 60.65 62.25 1ouw s ILE 8 Cb -0.40 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.24 1ouw s ILE 8 CO 0.37 0.40 -0.11 -0.44 0.00 0.00 0.00 174.94 175.16 1ouw s SER 9 N 0.09 4.32 0.41 3.58 0.01 -0.19 -4.98 113.70 116.93 1ouw s SER 9 Ca 0.26 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.36 1ouw s SER 9 Cb -0.16 -0.97 0.00 0.00 0.21 0.00 0.00 66.02 65.10 1ouw s SER 9 CO 0.12 0.33 0.00 0.61 0.41 0.00 0.00 173.24 174.71 1ouw n GLY 10 N 2.06 1.00 3.72 3.44 0.00 -1.26 -1.21 105.19 112.94 1ouw n GLY 10 Ca -0.17 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.74 1ouw n GLY 10 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ouw s PRO 11 N 0.00 2.09 -0.08 1.61 0.02 -1.26 -4.94 135.00 132.44 1ouw s PRO 11 Ca 0.00 1.65 -0.07 0.00 0.02 0.00 0.00 61.00 62.60 1ouw s PRO 11 Cb 0.00 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.64 1ouw s PRO 11 CO 0.00 -1.85 0.19 -1.58 -0.33 0.00 0.00 177.00 173.42 1ouw s TRP 12 N -2.16 3.60 -0.01 6.54 0.51 0.89 -4.88 118.94 123.42 1ouw s TRP 12 Ca 0.72 0.55 0.00 0.00 -2.12 0.00 0.00 56.10 55.25 1ouw s TRP 12 Cb -0.27 -1.96 0.00 0.00 -0.81 0.00 0.00 33.47 30.43 1ouw s TRP 12 CO 0.47 0.70 0.00 0.41 -0.51 0.00 0.00 176.95 178.02 1ouw n GLY 13 N 1.71 0.17 3.49 0.98 0.00 -1.26 -0.79 105.19 109.49 1ouw n GLY 13 Ca -0.17 -1.65 -0.24 0.00 0.00 0.00 0.00 46.02 43.95 1ouw n GLY 13 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ouw s ASN 14 N -4.00 2.60 0.00 1.61 0.02 -0.08 -4.98 114.94 110.12 1ouw s ASN 14 Ca 0.00 -1.60 0.25 0.00 -1.02 0.00 0.00 52.86 50.49 1ouw s ASN 14 Cb 0.00 0.37 0.65 0.00 0.02 0.00 0.00 41.25 42.29 1ouw s ASN 14 CO 0.00 -0.86 1.52 0.59 0.02 0.00 0.00 177.10 178.37 1ouw n ASN 15 N -1.13 2.23 -4.35 -1.22 3.02 -1.26 -4.42 115.26 108.13 1ouw n ASN 15 Ca -0.05 -1.75 -0.29 0.00 -0.03 0.00 0.00 54.58 52.46 1ouw n ASN 15 Cb 0.65 -0.04 0.21 0.00 -0.61 0.00 0.00 39.78 39.99 1ouw n ASN 15 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ouw s GLY 16 N -1.90 1.57 0.00 7.41 0.00 -1.26 -4.90 107.32 108.24 1ouw s GLY 16 Ca 0.34 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.47 1ouw s GLY 16 CO 0.31 0.13 0.00 0.61 0.00 0.00 0.00 173.10 174.16 1ouw n GLY 17 N -0.96 -0.08 3.47 0.20 0.00 -1.26 -4.41 105.19 102.14 1ouw n GLY 17 Ca 0.08 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.78 1ouw n GLY 17 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ouw s ASN 18 N -4.00 3.85 0.46 1.61 0.01 0.42 -4.79 114.94 112.51 1ouw s ASN 18 Ca 0.00 -0.46 -0.24 0.00 -0.71 0.00 0.00 52.86 51.45 1ouw s ASN 18 Cb 0.00 -0.60 -0.07 0.00 0.41 0.00 0.00 41.25 40.98 1ouw s ASN 18 CO 0.00 0.23 1.32 0.12 -1.51 0.00 0.00 177.10 177.26 1ouw s PHE 19 N -0.99 2.61 0.05 2.20 5.36 -1.26 -0.54 117.98 125.40 1ouw s PHE 19 Ca 0.16 1.39 -0.01 0.00 -0.96 0.00 0.00 56.93 57.50 1ouw s PHE 19 Cb -0.11 -3.71 -0.03 0.00 -0.34 0.00 0.00 43.02 38.83 1ouw s PHE 19 CO 0.07 -2.39 -0.01 1.67 -1.46 0.00 0.00 175.22 173.09 1ouw s TRP 20 N -1.31 0.45 -0.22 10.12 1.48 -0.30 -4.87 118.94 124.29 1ouw s TRP 20 Ca 0.63 -0.95 -0.19 0.00 -1.06 0.00 0.00 56.10 54.53 1ouw s TRP 20 Cb -0.38 -0.34 0.06 0.00 -1.16 0.00 0.00 33.47 31.65 1ouw s TRP 20 CO 0.48 -0.36 0.58 0.45 -4.06 0.00 0.00 176.95 174.03 1ouw s SER 21 N -2.69 -0.63 -0.26 -2.66 0.15 -1.26 -1.24 113.70 105.11 1ouw s SER 21 Ca 0.03 1.18 -0.02 0.00 0.70 0.00 0.00 55.95 57.85 1ouw s SER 21 Cb 0.05 1.17 0.14 0.00 -1.71 0.00 0.00 66.02 65.67 1ouw s SER 21 CO -0.09 -0.20 0.37 0.12 1.20 0.00 0.00 173.24 174.64 1ouw s PHE 22 N 0.53 -0.79 -0.37 3.44 5.36 0.23 -5.00 117.98 121.36 1ouw s PHE 22 Ca -0.02 0.58 0.01 0.00 -0.96 0.00 0.00 56.93 56.54 1ouw s PHE 22 Cb -0.04 -0.09 0.12 0.00 -0.34 0.00 0.00 43.02 42.66 1ouw s PHE 22 CO -0.02 -0.79 0.17 0.50 -1.46 0.00 0.00 175.22 173.61 1ouw s ARG 23 N 2.51 0.97 0.59 10.12 3.00 -1.26 -1.04 118.95 133.84 1ouw s ARG 23 Ca 0.11 -1.53 -0.10 0.00 -1.00 0.00 0.00 55.73 53.21 1ouw s ARG 23 Cb -0.15 -2.11 -0.04 0.00 0.00 0.00 0.00 34.95 32.65 1ouw s ARG 23 CO -0.20 -1.08 0.98 -1.25 0.00 0.00 0.00 175.30 173.75 1ouw s PRO 24 N 0.99 3.58 0.17 5.12 0.04 -1.26 -4.98 135.00 138.66 1ouw s PRO 24 Ca 0.14 0.64 -0.09 0.00 0.04 0.00 0.00 61.00 61.73 1ouw s PRO 24 Cb -0.21 -2.14 0.03 0.00 0.04 0.00 0.00 34.50 32.22 1ouw s PRO 24 CO -0.11 -0.50 1.56 0.28 0.04 0.00 0.00 177.00 178.27 1ouw h VAL 25 N -0.22 1.27 -1.01 -0.36 2.07 -2.00 -3.44 116.25 112.56 1ouw h VAL 25 Ca -0.45 -1.38 -0.48 0.00 0.82 0.00 0.00 66.70 65.22 1ouw h VAL 25 Cb 1.19 1.13 0.02 0.00 -1.52 0.00 0.00 31.29 32.11 1ouw h VAL 25 CO 0.62 0.48 -0.18 0.20 0.02 0.00 0.00 177.57 178.71 1ouw s ASN 26 N -6.73 5.23 0.29 0.57 0.01 -1.26 -5.06 114.94 107.99 1ouw s ASN 26 Ca -0.11 -0.74 -0.29 0.00 -0.71 0.00 0.00 52.86 51.00 1ouw s ASN 26 Cb 0.12 -0.03 -0.10 0.00 0.41 0.00 0.00 41.25 41.66 1ouw s ASN 26 CO 0.87 -1.11 1.32 -0.75 -1.51 0.00 0.00 177.10 175.91 1ouw s LYS 27 N -4.51 4.37 -0.14 -0.60 2.20 -1.26 -4.95 119.74 114.85 1ouw s LYS 27 Ca 0.57 2.17 -0.29 0.00 -0.36 0.00 0.00 55.97 58.05 1ouw s LYS 27 Cb -0.07 -3.11 -0.04 0.00 -1.51 0.00 0.00 37.83 33.10 1ouw s LYS 27 CO 0.35 -0.21 1.62 0.42 -0.36 0.00 0.00 175.35 177.17 1ouw s ILE 28 N -0.69 3.67 -0.51 5.43 1.01 -1.26 -4.45 121.20 124.41 1ouw s ILE 28 Ca 0.52 0.79 0.05 0.00 0.00 0.00 0.00 60.65 62.01 1ouw s ILE 28 Cb -0.39 -3.59 0.02 0.00 0.01 0.00 0.00 42.46 38.51 1ouw s ILE 28 CO 0.47 -0.16 0.55 -0.46 0.00 0.00 0.00 174.94 175.34 1ouw n ASN 29 N 7.76 1.14 -3.79 3.58 6.94 -0.45 -4.86 115.26 125.58 1ouw n ASN 29 Ca 0.18 -1.07 -0.13 0.00 -0.02 0.00 0.00 54.58 53.54 1ouw n ASN 29 Cb 0.44 0.21 -0.11 0.00 -2.36 0.00 0.00 39.78 37.96 1ouw n ASN 29 CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 1ouw s GLN 30 N -0.61 0.32 -0.04 -3.83 0.74 -1.03 -1.15 119.66 114.06 1ouw s GLN 30 Ca 0.05 0.29 0.03 0.00 0.05 0.00 0.00 55.36 55.77 1ouw s GLN 30 Cb 0.04 0.15 0.01 0.00 1.10 0.00 0.00 33.01 34.31 1ouw s GLN 30 CO 0.08 -0.05 -0.11 0.42 -0.55 0.00 0.00 175.29 175.08 1ouw s ILE 31 N -0.01 1.01 -0.15 -2.34 1.01 -0.38 -1.43 121.20 118.92 1ouw s ILE 31 Ca -0.01 -0.45 0.01 0.00 0.00 0.00 0.00 60.65 60.19 1ouw s ILE 31 Cb -0.02 -0.91 -0.00 0.00 0.01 0.00 0.00 42.46 41.54 1ouw s ILE 31 CO 0.01 0.31 -0.17 -0.69 0.00 0.00 0.00 174.94 174.40 1ouw s VAL 32 N 0.38 2.58 -0.25 2.92 1.01 -0.16 -0.56 120.40 126.32 1ouw s VAL 32 Ca -0.08 -0.81 -0.09 0.00 0.00 0.00 0.00 61.98 61.00 1ouw s VAL 32 Cb -0.12 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 1ouw s VAL 32 CO 0.02 0.52 0.13 -0.63 0.00 0.00 0.00 175.10 175.14 1ouw s ILE 33 N 0.72 4.91 -0.12 2.22 1.09 0.25 -0.83 121.20 129.44 1ouw s ILE 33 Ca -0.07 0.03 -0.04 0.00 -1.10 0.00 0.00 60.65 59.46 1ouw s ILE 33 Cb -0.16 -3.30 -0.04 0.00 -1.06 0.00 0.00 42.46 37.90 1ouw s ILE 33 CO 0.01 0.32 0.04 -0.44 -0.10 0.00 0.00 174.94 174.78 1ouw s SER 34 N 1.45 5.56 0.21 3.58 0.01 -0.04 -1.41 113.70 123.06 1ouw s SER 34 Ca 0.06 0.19 0.10 0.00 1.31 0.00 0.00 55.95 57.61 1ouw s SER 34 Cb -0.15 -1.73 -0.04 0.00 0.21 0.00 0.00 66.02 64.31 1ouw s SER 34 CO 0.06 0.33 -0.10 -0.31 0.41 0.00 0.00 173.24 173.63 1ouw s TYR 35 N -0.59 2.57 0.37 2.43 2.02 0.36 -0.37 117.35 124.15 1ouw s TYR 35 Ca 0.11 -0.25 0.04 0.00 -0.37 0.00 0.00 57.07 56.59 1ouw s TYR 35 Cb -0.12 -1.22 -0.04 0.00 -0.40 0.00 0.00 41.96 40.19 1ouw s TYR 35 CO 0.02 0.56 0.11 0.20 -1.57 0.00 0.00 175.55 174.87 1ouw s GLY 36 N -3.06 2.39 0.00 0.71 0.00 -0.26 -0.73 107.32 106.37 1ouw s GLY 36 Ca 0.26 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.48 1ouw s GLY 36 CO 0.16 -1.80 0.00 0.61 0.00 0.00 0.00 173.10 172.06 1ouw n GLY 37 N -0.81 0.56 2.34 0.20 0.00 -1.26 -3.12 105.19 103.09 1ouw n GLY 37 Ca -0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.93 1ouw n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ouw n GLY 38 N -2.70 0.69 0.00 -0.02 0.00 -1.26 -4.97 105.19 96.93 1ouw n GLY 38 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1ouw n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ouw n GLY 39 N -1.62 4.67 2.40 -0.02 0.00 -1.18 -5.05 105.19 104.38 1ouw n GLY 39 Ca -0.05 -1.56 -0.31 0.00 0.00 0.00 0.00 46.02 44.11 1ouw n GLY 39 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ouw n ASN 40 N -1.45 7.06 -4.20 1.61 0.23 -1.26 -4.37 115.26 112.88 1ouw n ASN 40 Ca 0.00 -3.02 -0.39 0.00 -0.53 0.00 0.00 54.58 50.64 1ouw n ASN 40 Cb 0.00 -1.33 -0.10 0.00 -2.08 0.00 0.00 39.78 36.26 1ouw n ASN 40 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 1ouw s ASN 41 N 0.76 5.49 0.19 0.53 0.01 -1.26 -3.84 114.94 116.82 1ouw s ASN 41 Ca 0.59 -1.78 -0.31 0.00 -0.71 0.00 0.00 52.86 50.65 1ouw s ASN 41 Cb 0.29 -1.93 -0.10 0.00 0.41 0.00 0.00 41.25 39.92 1ouw s ASN 41 CO -0.13 -0.57 1.57 -2.84 -1.51 0.00 0.00 177.10 173.62 1ouw s PRO 42 N 1.30 4.20 0.00 -0.60 0.02 -1.26 -1.10 135.00 137.56 1ouw s PRO 42 Ca 0.05 2.40 0.00 0.00 0.02 0.00 0.00 61.00 63.47 1ouw s PRO 42 Cb -0.24 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.15 1ouw s PRO 42 CO -0.01 -0.60 0.00 0.44 -0.33 0.00 0.00 177.00 176.50 1ouw n ILE 43 N 3.60 0.00 -3.76 2.83 -5.35 0.51 -4.71 119.36 112.48 1ouw n ILE 43 Ca 0.13 -0.12 -0.11 0.00 -0.27 0.00 0.00 62.75 62.39 1ouw n ILE 43 Cb 0.38 0.57 -0.07 0.00 -1.74 0.00 0.00 39.64 38.79 1ouw n ILE 43 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ouw s ALA 44 N -1.37 -0.61 -0.03 -1.28 0.00 -1.05 -1.54 121.76 115.88 1ouw s ALA 44 Ca 0.00 -0.18 0.03 0.00 0.00 0.00 0.00 51.96 51.81 1ouw s ALA 44 Cb 0.00 0.44 0.00 0.00 0.00 0.00 0.00 23.12 23.56 1ouw s ALA 44 CO 0.00 -0.49 -0.12 -0.51 0.00 0.00 0.00 175.76 174.65 1ouw s LEU 45 N -2.43 1.85 -0.11 0.00 1.43 -0.19 -0.86 118.68 118.36 1ouw s LEU 45 Ca -0.01 -0.24 0.03 0.00 -1.03 0.00 0.00 54.13 52.89 1ouw s LEU 45 Cb 0.01 -0.67 -0.00 0.00 0.03 0.00 0.00 46.19 45.56 1ouw s LEU 45 CO -0.07 0.10 -0.21 -0.89 0.23 0.00 0.00 176.35 175.51 1ouw s THR 46 N 0.10 2.37 -0.09 5.49 2.01 -0.01 -1.07 115.64 124.44 1ouw s THR 46 Ca -0.02 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.10 1ouw s THR 46 Cb -0.09 -1.94 -0.01 0.00 0.01 0.00 0.00 72.50 70.47 1ouw s THR 46 CO 0.01 0.55 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.92 1ouw s PHE 47 N 0.34 2.61 0.03 4.92 0.08 -0.46 -0.99 117.98 124.51 1ouw s PHE 47 Ca -0.16 -0.79 0.01 0.00 0.12 0.00 0.00 56.93 56.11 1ouw s PHE 47 Cb -0.17 -1.71 -0.02 0.00 -0.57 0.00 0.00 43.02 40.55 1ouw s PHE 47 CO 0.08 -0.27 -0.06 -1.54 -0.10 0.00 0.00 175.22 173.33 1ouw s SER 48 N 0.13 0.64 -0.27 1.36 1.04 -0.52 -1.65 113.70 114.44 1ouw s SER 48 Ca -0.11 -0.48 0.01 0.00 0.48 0.00 0.00 55.95 55.86 1ouw s SER 48 Cb -0.16 0.04 0.07 0.00 0.10 0.00 0.00 66.02 66.08 1ouw s SER 48 CO 0.06 -0.20 -0.03 -0.55 0.98 0.00 0.00 173.24 173.51 1ouw s SER 49 N -1.36 4.12 -0.21 7.02 0.15 0.08 -1.34 113.70 122.16 1ouw s SER 49 Ca -0.10 -1.43 -0.01 0.00 0.70 0.00 0.00 55.95 55.11 1ouw s SER 49 Cb -0.09 -1.27 0.02 0.00 -1.71 0.00 0.00 66.02 62.96 1ouw s SER 49 CO -0.00 -0.27 -0.11 -0.89 1.20 0.00 0.00 173.24 173.16 1ouw s THR 50 N 1.29 2.64 -0.20 6.45 2.01 -1.26 -1.33 115.64 125.25 1ouw s THR 50 Ca -0.02 -0.88 0.18 0.00 0.31 0.00 0.00 61.69 61.28 1ouw s THR 50 Cb -0.19 -2.23 -0.25 0.00 0.01 0.00 0.00 72.50 69.84 1ouw s THR 50 CO -0.08 0.38 0.08 0.29 -0.69 0.00 0.00 174.62 174.60 1ouw n LYS 51 N 4.67 0.69 0.17 4.92 4.76 -1.26 -4.98 118.16 127.13 1ouw n LYS 51 Ca -0.19 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.37 1ouw n LYS 51 Cb 0.49 -1.53 0.60 0.00 -1.84 0.00 0.00 35.03 32.76 1ouw n LYS 51 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1ouw h GLY 54 N 3.95 0.00 -2.52 0.72 0.00 -2.08 -3.51 103.07 99.62 1ouw h GLY 54 Ca -0.54 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.25 1ouw h GLY 54 CO 0.03 0.00 0.53 -1.35 0.00 0.00 0.00 176.54 175.75 1ouw s SER 55 N -4.13 5.42 -0.12 0.19 1.04 -1.26 -5.01 113.70 109.83 1ouw s SER 55 Ca -0.02 2.54 -0.10 0.00 0.48 0.00 0.00 55.95 58.85 1ouw s SER 55 Cb 0.07 -2.62 0.03 0.00 0.10 0.00 0.00 66.02 63.61 1ouw s SER 55 CO 0.24 -1.45 0.31 -0.75 0.98 0.00 0.00 173.24 172.57 1ouw s LYS 56 N -3.01 0.35 -0.09 4.02 2.20 -1.26 -4.38 119.74 117.57 1ouw s LYS 56 Ca 0.72 0.45 -0.01 0.00 -0.36 0.00 0.00 55.97 56.76 1ouw s LYS 56 Cb -0.34 0.16 -0.03 0.00 -1.51 0.00 0.00 37.83 36.10 1ouw s LYS 56 CO 0.40 -0.05 -0.02 -0.51 -0.36 0.00 0.00 175.35 174.81 1ouw s ASP 57 N 0.26 5.08 -0.11 1.43 1.01 -0.44 -4.99 116.67 118.91 1ouw s ASP 57 Ca -0.01 0.09 -0.28 0.00 0.71 0.00 0.00 52.55 53.06 1ouw s ASP 57 Cb -0.03 -1.43 0.07 0.00 1.01 0.00 0.00 42.92 42.54 1ouw s ASP 57 CO -0.00 0.36 0.67 0.28 0.21 0.00 0.00 175.17 176.68 1ouw s THR 58 N -0.77 0.00 0.01 -1.27 -1.32 -1.26 -0.74 115.64 110.30 1ouw s THR 58 Ca 0.12 -0.02 -0.00 0.00 -1.21 0.00 0.00 61.69 60.57 1ouw s THR 58 Cb -0.11 -0.97 -0.01 0.00 -1.51 0.00 0.00 72.50 69.89 1ouw s THR 58 CO 0.02 -0.01 -0.02 -0.51 -2.21 0.00 0.00 174.62 171.89 1ouw s ILE 59 N -0.77 0.08 -0.07 5.08 2.07 -0.66 -5.01 121.20 121.92 1ouw s ILE 59 Ca -0.08 -0.67 0.03 0.00 -1.41 0.00 0.00 60.65 58.52 1ouw s ILE 59 Cb -0.02 -0.20 0.00 0.00 0.13 0.00 0.00 42.46 42.38 1ouw s ILE 59 CO 0.07 -0.37 -0.17 -0.89 -1.91 0.00 0.00 174.94 171.67 1ouw s THR 60 N -1.08 1.52 0.05 4.00 2.01 -1.26 -1.35 115.64 119.53 1ouw s THR 60 Ca -0.12 -0.72 0.07 0.00 0.31 0.00 0.00 61.69 61.23 1ouw s THR 60 Cb -0.07 -1.34 -0.03 0.00 0.01 0.00 0.00 72.50 71.07 1ouw s THR 60 CO -0.01 0.44 -0.20 0.68 -0.69 0.00 0.00 174.62 174.85 1ouw s VAL 61 N 0.41 1.59 0.00 3.82 -7.23 -0.23 -4.99 120.40 113.76 1ouw s VAL 61 Ca -0.14 -1.22 0.00 0.00 -1.81 0.00 0.00 61.98 58.82 1ouw s VAL 61 Cb -0.16 -1.40 0.00 0.00 0.56 0.00 0.00 36.38 35.39 1ouw s VAL 61 CO 0.05 0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.59 1ouw n GLY 62 N 1.75 -2.43 2.19 2.32 0.00 -1.26 -1.02 105.19 106.74 1ouw n GLY 62 Ca -0.18 -1.58 -0.07 0.00 0.00 0.00 0.00 46.02 44.19 1ouw n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ouw n GLY 63 N -0.78 0.67 0.04 -0.02 0.00 -0.40 -4.80 105.19 99.90 1ouw n GLY 63 Ca 0.00 -0.67 0.14 0.00 0.00 0.00 0.00 46.02 45.49 1ouw n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ouw n GLY 64 N -1.74 -1.23 0.80 -0.02 0.00 -0.73 -4.89 105.19 97.38 1ouw n GLY 64 Ca -0.08 -0.22 -0.04 0.00 0.00 0.00 0.00 46.02 45.68 1ouw n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ouw n GLY 65 N 1.40 2.21 0.21 -0.02 0.00 -1.26 -4.82 105.19 102.92 1ouw n GLY 65 Ca 0.10 -2.16 0.13 0.00 0.00 0.00 0.00 46.02 44.09 1ouw n GLY 65 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ouw h PRO 66 N 0.00 0.00 -6.58 1.61 0.13 -1.97 -3.46 132.00 121.73 1ouw h PRO 66 Ca -0.06 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.54 1ouw h PRO 66 Cb 0.26 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.42 1ouw h PRO 66 CO 0.09 0.00 0.75 -0.51 -0.23 0.00 0.00 178.00 178.10 1ouw s ASP 67 N -5.80 6.78 0.48 1.44 1.01 -1.26 -4.94 116.67 114.38 1ouw s ASP 67 Ca 0.06 2.41 -0.23 0.00 0.71 0.00 0.00 52.55 55.50 1ouw s ASP 67 Cb 0.07 -2.59 -0.07 0.00 1.01 0.00 0.00 42.92 41.34 1ouw s ASP 67 CO 0.62 -0.68 1.26 -0.94 0.21 0.00 0.00 175.17 175.65 1ouw s SER 68 N 0.99 5.88 -0.19 0.27 1.04 -1.26 -4.97 113.70 115.46 1ouw s SER 68 Ca 0.64 2.53 -0.29 0.00 0.48 0.00 0.00 55.95 59.31 1ouw s SER 68 Cb -0.38 -2.62 -0.00 0.00 0.10 0.00 0.00 66.02 63.11 1ouw s SER 68 CO 0.32 -1.13 1.11 -0.63 0.98 0.00 0.00 173.24 173.88 1ouw s ILE 69 N -1.41 4.55 -1.48 -1.02 1.01 -1.26 -4.32 121.20 117.27 1ouw s ILE 69 Ca 0.65 1.87 0.16 0.00 0.00 0.00 0.00 60.65 63.33 1ouw s ILE 69 Cb -0.34 -4.21 0.00 0.00 0.01 0.00 0.00 42.46 37.92 1ouw s ILE 69 CO 0.42 -0.14 0.86 0.35 0.00 0.00 0.00 174.94 176.43 1ouw n THR 70 N 5.21 0.00 -3.61 2.92 -2.24 0.09 -4.99 114.28 111.67 1ouw n THR 70 Ca 0.12 -0.34 -0.03 0.00 -2.27 0.00 0.00 64.05 61.53 1ouw n THR 70 Cb 0.46 1.19 -0.01 0.00 -2.10 0.00 0.00 70.33 69.87 1ouw n THR 70 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ouw s GLY 71 N -1.86 -0.35 0.08 3.38 0.00 -1.20 -4.89 107.32 102.49 1ouw s GLY 71 Ca 0.13 1.09 -0.05 0.00 0.00 0.00 0.00 44.72 45.90 1ouw s GLY 71 CO 0.39 0.32 0.09 -0.51 0.00 0.00 0.00 173.10 173.39 1ouw s THR 72 N -2.57 0.17 0.09 0.90 -4.23 -1.26 -0.49 115.64 108.26 1ouw s THR 72 Ca 0.11 -1.54 0.04 0.00 -1.18 0.00 0.00 61.69 59.12 1ouw s THR 72 Cb 0.01 -1.52 -0.03 0.00 1.34 0.00 0.00 72.50 72.29 1ouw s THR 72 CO -0.04 -0.76 -0.11 -1.61 -0.54 0.00 0.00 174.62 171.57 1ouw s GLU 73 N -3.91 0.84 -0.02 3.99 2.02 -0.50 -4.99 118.70 116.13 1ouw s GLU 73 Ca 0.09 -1.13 0.03 0.00 0.02 0.00 0.00 54.97 53.98 1ouw s GLU 73 Cb 0.06 -0.57 -0.00 0.00 0.10 0.00 0.00 34.13 33.72 1ouw s GLU 73 CO -0.09 0.09 -0.11 1.41 0.02 0.00 0.00 175.26 176.59 1ouw s MET 74 N -2.65 1.02 -0.24 1.61 -2.45 -1.26 -0.58 119.30 114.74 1ouw s MET 74 Ca 0.04 -0.38 -0.06 0.00 -1.25 0.00 0.00 55.69 54.04 1ouw s MET 74 Cb -0.04 -0.96 -0.02 0.00 1.25 0.00 0.00 34.83 35.06 1ouw s MET 74 CO 0.00 0.19 0.04 0.08 1.05 0.00 0.00 175.02 176.38 1ouw s VAL 75 N -0.03 4.01 -0.32 10.11 1.01 0.27 -4.99 120.40 130.46 1ouw s VAL 75 Ca 0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 61.98 61.61 1ouw s VAL 75 Cb -0.07 -2.88 0.02 0.00 0.00 0.00 0.00 36.38 33.46 1ouw s VAL 75 CO 0.00 0.34 0.11 0.20 0.00 0.00 0.00 175.10 175.75 1ouw s ASN 76 N 1.57 5.29 -0.16 3.32 0.01 -1.26 -1.25 114.94 122.45 1ouw s ASN 76 Ca 0.06 -0.91 -0.22 0.00 -0.71 0.00 0.00 52.86 51.08 1ouw s ASN 76 Cb -0.15 -1.90 -0.03 0.00 0.41 0.00 0.00 41.25 39.59 1ouw s ASN 76 CO 0.01 -0.27 0.66 -0.63 -1.51 0.00 0.00 177.10 175.37 1ouw s ILE 77 N 1.47 5.01 0.93 0.60 1.01 -0.30 -5.02 121.20 124.90 1ouw s ILE 77 Ca 0.01 1.29 -0.12 0.00 0.00 0.00 0.00 60.65 61.83 1ouw s ILE 77 Cb -0.18 -3.98 0.15 0.00 0.01 0.00 0.00 42.46 38.45 1ouw s ILE 77 CO 0.03 0.14 1.09 -0.83 0.00 0.00 0.00 174.94 175.37 1ouw s GLY 78 N 1.08 1.60 0.26 6.18 0.00 -1.26 -4.87 107.32 110.31 1ouw s GLY 78 Ca 0.32 -0.20 -0.04 0.00 0.00 0.00 0.00 44.72 44.80 1ouw s GLY 78 CO 0.12 0.34 1.89 -0.84 0.00 0.00 0.00 173.10 174.61 1ouw h THR 79 N -1.65 1.13 -0.56 0.90 2.02 -2.00 -0.98 112.91 111.77 1ouw h THR 79 Ca -0.51 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.25 1ouw h THR 79 Cb 1.30 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1ouw h THR 79 CO 0.56 0.22 0.00 0.47 0.37 0.00 0.00 175.52 177.14 1ouw n ASP 80 N -4.48 4.05 -4.64 4.18 8.00 -1.26 -4.92 116.55 117.47 1ouw n ASP 80 Ca 0.14 -2.35 -0.33 0.00 0.71 0.00 0.00 54.79 52.97 1ouw n ASP 80 Cb 0.14 -0.52 -0.10 0.00 -0.02 0.00 0.00 41.12 40.62 1ouw n ASP 80 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1ouw s GLU 81 N -1.75 2.74 -0.01 -1.24 2.12 -0.37 -4.95 118.70 115.24 1ouw s GLU 81 Ca 0.43 -0.60 -0.15 0.00 0.36 0.00 0.00 54.97 55.02 1ouw s GLU 81 Cb 0.27 -2.63 0.02 0.00 0.26 0.00 0.00 34.13 32.06 1ouw s GLU 81 CO 0.22 0.64 0.31 1.52 -0.54 0.00 0.00 175.26 177.40 1ouw s TYR 82 N -0.99 -0.17 0.30 5.30 1.13 -1.26 -4.61 117.35 117.05 1ouw s TYR 82 Ca 0.17 0.23 -0.29 0.00 -1.41 0.00 0.00 57.07 55.76 1ouw s TYR 82 Cb -0.11 0.09 -0.11 0.00 -1.10 0.00 0.00 41.96 40.73 1ouw s TYR 82 CO 0.07 -0.40 1.50 -0.51 -2.51 0.00 0.00 175.55 173.70 1ouw s LEU 83 N -1.40 4.36 0.00 -3.49 1.43 -1.26 -1.47 118.68 116.85 1ouw s LEU 83 Ca -0.13 2.85 0.00 0.00 -1.03 0.00 0.00 54.13 55.83 1ouw s LEU 83 Cb -0.05 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.53 1ouw s LEU 83 CO 0.03 -0.80 0.00 0.35 0.23 0.00 0.00 176.35 176.16 1ouw n THR 84 N 1.78 0.00 -3.58 5.49 -2.24 0.15 -0.87 114.28 115.01 1ouw n THR 84 Ca 0.06 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.72 1ouw n THR 84 Cb 0.39 0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.58 1ouw n THR 84 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ouw s GLY 85 N -1.26 -0.37 0.12 3.38 0.00 -0.77 -4.62 107.32 103.78 1ouw s GLY 85 Ca 0.00 0.25 0.04 0.00 0.00 0.00 0.00 44.72 45.01 1ouw s GLY 85 CO 0.00 -0.03 -0.10 -0.26 0.00 0.00 0.00 173.10 172.71 1ouw s ILE 86 N -3.29 1.01 0.24 0.90 -4.36 -1.26 -0.53 121.20 113.91 1ouw s ILE 86 Ca -0.00 -1.84 -0.15 0.00 -0.26 0.00 0.00 60.65 58.40 1ouw s ILE 86 Cb 0.00 -1.59 0.01 0.00 1.25 0.00 0.00 42.46 42.13 1ouw s ILE 86 CO -0.08 -0.67 0.53 -0.94 0.24 0.00 0.00 174.94 174.02 1ouw s SER 87 N -2.79 -0.15 0.00 4.36 1.04 -0.95 -0.59 113.70 114.62 1ouw s SER 87 Ca 0.11 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.75 1ouw s SER 87 Cb 0.00 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1ouw s SER 87 CO -0.00 -1.16 0.00 0.61 0.98 0.00 0.00 173.24 173.67 1ouw n GLY 88 N -0.38 -0.54 3.07 7.32 0.00 -0.28 -0.33 105.19 114.04 1ouw n GLY 88 Ca -0.04 -0.82 -0.08 0.00 0.00 0.00 0.00 46.02 45.09 1ouw n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ouw s THR 89 N -3.19 0.19 0.01 2.61 -4.23 -0.48 -0.91 115.64 109.65 1ouw s THR 89 Ca 0.00 -1.59 0.08 0.00 -1.18 0.00 0.00 61.69 59.00 1ouw s THR 89 Cb 0.00 -1.25 -0.02 0.00 1.34 0.00 0.00 72.50 72.57 1ouw s THR 89 CO 0.00 -0.88 -0.26 -0.36 -0.54 0.00 0.00 174.62 172.58 1ouw s PHE 90 N -3.40 2.27 0.00 3.99 0.40 -0.34 -0.64 117.98 120.26 1ouw s PHE 90 Ca 0.02 -0.42 -0.01 0.00 -0.60 0.00 0.00 56.93 55.92 1ouw s PHE 90 Cb 0.04 -1.41 0.00 0.00 0.51 0.00 0.00 43.02 42.17 1ouw s PHE 90 CO -0.08 0.04 0.06 0.41 0.70 0.00 0.00 175.22 176.35 1ouw n GLY 91 N 2.11 0.69 3.71 4.36 0.00 -0.27 -0.43 105.19 115.36 1ouw n GLY 91 Ca -0.16 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.60 1ouw n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ouw s ILE 92 N -2.19 4.97 -0.06 -0.61 -1.09 -1.26 -1.05 121.20 119.90 1ouw s ILE 92 Ca 0.01 1.70 -0.01 0.00 -2.23 0.00 0.00 60.65 60.12 1ouw s ILE 92 Cb -0.00 -4.16 0.03 0.00 -1.58 0.00 0.00 42.46 36.75 1ouw s ILE 92 CO 0.00 0.20 0.01 -0.47 -1.23 0.00 0.00 174.94 173.45 1ouw s TYR 93 N 0.98 0.52 -1.37 3.97 5.04 -0.12 -4.86 117.35 121.51 1ouw s TYR 93 Ca 0.43 -0.07 -0.02 0.00 -2.44 0.00 0.00 57.07 54.97 1ouw s TYR 93 Cb -0.19 -0.71 0.01 0.00 0.35 0.00 0.00 41.96 41.43 1ouw s TYR 93 CO 0.22 -0.28 0.67 1.28 -1.34 0.00 0.00 175.55 176.10 1ouw n LEU 94 N 5.09 -2.81 0.00 6.97 4.77 -1.26 -1.76 117.00 128.00 1ouw n LEU 94 Ca -0.08 -0.86 0.00 0.00 -0.03 0.00 0.00 56.01 55.04 1ouw n LEU 94 Cb 0.50 -2.54 0.00 0.00 -2.33 0.00 0.00 43.42 39.05 1ouw n LEU 94 CO 0.11 0.42 0.00 0.47 -1.33 0.00 0.00 177.39 177.06 1ouw n ASP 95 N -3.01 -0.89 -4.53 -1.43 8.00 -1.26 -4.98 116.55 108.45 1ouw n ASP 95 Ca -0.25 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 54.92 1ouw n ASP 95 Cb 0.66 -1.59 -0.12 0.00 -0.02 0.00 0.00 41.12 40.05 1ouw n ASP 95 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1ouw s ASN 96 N -2.34 4.33 -0.39 -2.24 -0.87 -0.72 -5.06 114.94 107.65 1ouw s ASN 96 Ca 0.00 -0.15 -0.26 0.00 -1.57 0.00 0.00 52.86 50.88 1ouw s ASN 96 Cb 0.00 -0.98 0.02 0.00 -0.02 0.00 0.00 41.25 40.27 1ouw s ASN 96 CO 0.00 0.33 0.92 0.21 -2.57 0.00 0.00 177.10 175.99 1ouw s ASN 97 N -0.97 6.63 0.29 -1.22 3.84 -1.26 -0.95 114.94 121.30 1ouw s ASN 97 Ca 0.13 0.45 -0.02 0.00 0.21 0.00 0.00 52.86 53.64 1ouw s ASN 97 Cb -0.11 -2.46 -0.02 0.00 -0.55 0.00 0.00 41.25 38.12 1ouw s ASN 97 CO 0.03 -0.91 0.35 0.68 -2.79 0.00 0.00 177.10 174.46 1ouw s VAL 98 N 3.54 0.00 0.15 -5.21 -7.23 -0.22 -4.86 120.40 106.58 1ouw s VAL 98 Ca 0.38 -1.76 -0.31 0.00 -1.81 0.00 0.00 61.98 58.48 1ouw s VAL 98 Cb -0.11 -2.50 -0.11 0.00 0.56 0.00 0.00 36.38 34.21 1ouw s VAL 98 CO 0.21 0.00 1.81 -0.22 -0.31 0.00 0.00 175.10 176.59 1ouw s LEU 99 N -3.21 4.39 -0.07 1.32 2.96 0.12 -1.11 118.68 123.08 1ouw s LEU 99 Ca 0.34 2.81 0.09 0.00 -0.22 0.00 0.00 54.13 57.15 1ouw s LEU 99 Cb 0.02 -3.58 -0.13 0.00 0.50 0.00 0.00 46.19 43.00 1ouw s LEU 99 CO 0.18 -1.01 0.10 0.54 -1.32 0.00 0.00 176.35 174.84 1ouw n ARG 100 N 5.21 1.69 -3.65 1.98 5.12 0.18 -4.54 116.66 122.66 1ouw n ARG 100 Ca 0.17 -0.04 -0.15 0.00 -1.93 0.00 0.00 57.85 55.91 1ouw n ARG 100 Cb 0.37 -1.25 -0.07 0.00 -1.16 0.00 0.00 32.46 30.35 1ouw n ARG 100 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1ouw s SER 101 N -3.84 -0.40 -0.04 0.55 1.04 -1.08 -3.38 113.70 106.54 1ouw s SER 101 Ca -0.04 0.34 -0.11 0.00 0.48 0.00 0.00 55.95 56.62 1ouw s SER 101 Cb 0.04 0.42 0.02 0.00 0.10 0.00 0.00 66.02 66.60 1ouw s SER 101 CO 0.41 -0.54 0.25 -0.51 0.98 0.00 0.00 173.24 173.82 1ouw s ILE 102 N -1.41 0.04 -0.04 -1.02 2.07 -0.39 -1.38 121.20 119.07 1ouw s ILE 102 Ca -0.12 -0.33 0.05 0.00 -1.41 0.00 0.00 60.65 58.84 1ouw s ILE 102 Cb -0.03 -0.47 -0.01 0.00 0.13 0.00 0.00 42.46 42.09 1ouw s ILE 102 CO 0.06 -0.18 -0.18 -0.89 -1.91 0.00 0.00 174.94 171.83 1ouw s THR 103 N -0.73 1.48 -0.33 4.00 2.01 0.55 -0.42 115.64 122.19 1ouw s THR 103 Ca -0.08 -0.76 -0.04 0.00 0.31 0.00 0.00 61.69 61.11 1ouw s THR 103 Cb -0.04 -1.26 0.05 0.00 0.01 0.00 0.00 72.50 71.26 1ouw s THR 103 CO 0.02 0.42 0.08 -0.36 -0.69 0.00 0.00 174.62 174.10 1ouw s PHE 104 N -0.11 3.30 -0.08 4.92 0.08 -0.30 -2.23 117.98 123.55 1ouw s PHE 104 Ca -0.01 -1.71 -0.12 0.00 0.12 0.00 0.00 56.93 55.22 1ouw s PHE 104 Cb -0.10 -2.34 -0.05 0.00 -0.57 0.00 0.00 43.02 39.95 1ouw s PHE 104 CO 0.01 -0.79 0.29 0.99 -0.10 0.00 0.00 175.22 175.62 1ouw s THR 105 N 1.32 5.26 0.48 0.64 2.01 0.32 -0.80 115.64 124.86 1ouw s THR 105 Ca -0.02 0.56 0.01 0.00 0.31 0.00 0.00 61.69 62.55 1ouw s THR 105 Cb -0.20 -3.59 0.01 0.00 0.01 0.00 0.00 72.50 68.73 1ouw s THR 105 CO 0.01 0.55 0.08 0.35 -0.69 0.00 0.00 174.62 174.92 1ouw n THR 106 N 2.31 0.00 0.31 -0.82 -2.24 0.04 -0.67 114.28 113.20 1ouw n THR 106 Ca -0.15 -2.19 0.21 0.00 -2.27 0.00 0.00 64.05 59.65 1ouw n THR 106 Cb 0.53 0.33 1.11 0.00 -2.10 0.00 0.00 70.33 70.20 1ouw n THR 106 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ouw h ASN 107 N 1.02 0.00 0.00 3.42 -1.07 -1.58 -3.18 115.58 114.19 1ouw h ASN 107 Ca -0.38 0.00 -0.33 0.00 0.07 0.00 0.00 56.30 55.66 1ouw h ASN 107 Cb 1.19 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 37.37 1ouw h ASN 107 CO 0.62 0.00 -2.27 0.18 0.07 0.00 0.00 177.43 176.03 1ouw n LEU 108 N -2.94 1.91 -3.63 6.14 4.77 -1.26 -5.05 117.00 116.95 1ouw n LEU 108 Ca -0.03 -0.08 -0.04 0.00 -0.03 0.00 0.00 56.01 55.84 1ouw n LEU 108 Cb 0.08 -0.35 -0.01 0.00 -2.33 0.00 0.00 43.42 40.80 1ouw n LEU 108 CO 0.18 0.72 0.84 -1.59 -1.33 0.00 0.00 177.39 176.21 1ouw s LYS 109 N -2.45 0.76 -0.02 3.23 -2.85 -1.20 -5.14 119.74 112.08 1ouw s LYS 109 Ca -0.23 -0.37 -0.24 0.00 -1.00 0.00 0.00 55.97 54.14 1ouw s LYS 109 Cb 0.07 0.29 -0.04 0.00 -2.06 0.00 0.00 37.83 36.09 1ouw s LYS 109 CO 0.60 -0.34 0.71 0.00 0.10 0.00 0.00 175.35 176.42 1ouw s ALA 110 N -2.90 3.36 -0.16 0.59 0.00 -1.26 -0.78 121.76 120.60 1ouw s ALA 110 Ca 0.10 0.18 -0.03 0.00 0.00 0.00 0.00 51.96 52.21 1ouw s ALA 110 Cb 0.00 -2.95 -0.02 0.00 0.00 0.00 0.00 23.12 20.15 1ouw s ALA 110 CO -0.03 -0.02 -0.07 -1.01 0.00 0.00 0.00 175.76 174.63 1ouw s HIS 111 N 0.41 2.94 -1.58 0.00 0.09 0.02 -4.98 115.29 112.19 1ouw s HIS 111 Ca 0.37 -0.56 0.00 0.00 -0.00 0.00 0.00 55.06 54.88 1ouw s HIS 111 Cb -0.19 -1.96 0.00 0.00 -0.00 0.00 0.00 32.58 30.43 1ouw s HIS 111 CO 0.20 -0.21 0.00 0.41 -0.00 0.00 0.00 174.74 175.13 1ouw n GLY 112 N 3.84 0.67 3.78 -2.22 0.00 -1.26 -1.15 105.19 108.85 1ouw n GLY 112 Ca -0.18 -2.14 -0.36 0.00 0.00 0.00 0.00 46.02 43.34 1ouw n GLY 112 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ouw s PRO 113 N -0.63 4.02 -0.37 1.61 0.04 -1.26 -5.06 135.00 133.35 1ouw s PRO 113 Ca 0.00 1.54 -0.10 0.00 0.04 0.00 0.00 61.00 62.48 1ouw s PRO 113 Cb 0.00 -2.44 0.04 0.00 0.04 0.00 0.00 34.50 32.14 1ouw s PRO 113 CO 0.00 -0.27 0.19 0.71 0.04 0.00 0.00 177.00 177.67 1ouw s TYR 114 N -1.69 3.26 0.00 0.56 1.51 0.44 -4.91 117.35 116.51 1ouw s TYR 114 Ca 0.60 -1.15 0.00 0.00 -1.01 0.00 0.00 57.07 55.52 1ouw s TYR 114 Cb -0.22 -2.46 0.00 0.00 -0.11 0.00 0.00 41.96 39.16 1ouw s TYR 114 CO 0.28 -0.70 0.00 0.41 -1.11 0.00 0.00 175.55 174.43 1ouw n GLY 115 N 4.94 1.74 3.92 0.71 0.00 -1.26 -1.27 105.19 113.99 1ouw n GLY 115 Ca -0.12 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.66 1ouw n GLY 115 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ouw s GLN 116 N -2.36 3.55 -1.13 1.61 -1.52 -1.22 -4.79 119.66 113.80 1ouw s GLN 116 Ca 0.00 -0.22 -0.22 0.00 -1.95 0.00 0.00 55.36 52.97 1ouw s GLN 116 Cb 0.00 -2.73 -0.04 0.00 -0.22 0.00 0.00 33.01 30.02 1ouw s GLN 116 CO 0.00 0.28 1.86 0.21 -0.25 0.00 0.00 175.29 177.39 1ouw s LYS 117 N -3.60 2.87 0.03 2.91 2.20 -1.26 -4.30 119.74 118.59 1ouw s LYS 117 Ca 0.41 -1.12 0.01 0.00 -0.36 0.00 0.00 55.97 54.91 1ouw s LYS 117 Cb -0.11 -5.27 -0.02 0.00 -1.51 0.00 0.00 37.83 30.93 1ouw s LYS 117 CO 0.31 -3.38 -0.05 0.14 -0.36 0.00 0.00 175.35 172.00 1ouw s VAL 118 N 9.06 0.35 0.00 4.02 -7.23 -1.26 -5.11 120.40 120.22 1ouw s VAL 118 Ca 0.64 -0.82 0.00 0.00 -1.81 0.00 0.00 61.98 60.00 1ouw s VAL 118 Cb -0.01 -0.42 0.00 0.00 0.56 0.00 0.00 36.38 36.51 1ouw s VAL 118 CO 0.07 -0.31 0.00 0.61 -0.31 0.00 0.00 175.10 175.16 1ouw n GLY 119 N 1.85 -1.76 3.72 2.32 0.00 -1.26 -4.44 105.19 105.62 1ouw n GLY 119 Ca -0.21 -1.74 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 1ouw n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ouw s THR 120 N 0.00 5.28 0.52 2.61 2.01 0.43 -4.82 115.64 121.68 1ouw s THR 120 Ca 0.00 0.59 -0.19 0.00 0.31 0.00 0.00 61.69 62.40 1ouw s THR 120 Cb 0.00 -3.66 -0.07 0.00 0.01 0.00 0.00 72.50 68.78 1ouw s THR 120 CO 0.00 0.36 1.05 -2.16 -0.69 0.00 0.00 174.62 173.18 1ouw s PRO 121 N 0.62 3.65 0.05 4.92 0.04 -1.26 -1.20 135.00 141.83 1ouw s PRO 121 Ca 0.17 1.33 0.01 0.00 0.04 0.00 0.00 61.00 62.55 1ouw s PRO 121 Cb -0.13 -2.07 -0.03 0.00 0.04 0.00 0.00 34.50 32.30 1ouw s PRO 121 CO 0.05 -0.56 -0.05 -0.59 0.04 0.00 0.00 177.00 175.89 1ouw s PHE 122 N -2.10 0.59 -0.13 0.56 -0.71 -0.08 -4.93 117.98 111.18 1ouw s PHE 122 Ca 0.67 -0.81 -0.16 0.00 -1.04 0.00 0.00 56.93 55.59 1ouw s PHE 122 Cb -0.17 -0.38 0.04 0.00 -1.21 0.00 0.00 43.02 41.30 1ouw s PHE 122 CO 0.25 -0.22 0.42 0.45 -1.34 0.00 0.00 175.22 174.78 1ouw s SER 123 N -2.39 -0.42 0.91 1.98 0.15 -1.26 -1.13 113.70 111.54 1ouw s SER 123 Ca 0.00 0.73 -0.12 0.00 0.70 0.00 0.00 55.95 57.26 1ouw s SER 123 Cb 0.00 0.77 0.14 0.00 -1.71 0.00 0.00 66.02 65.22 1ouw s SER 123 CO -0.05 -0.22 1.12 -0.94 1.20 0.00 0.00 173.24 174.35 1ouw s SER 124 N -0.11 3.47 -0.36 5.45 1.04 0.24 -4.99 113.70 118.45 1ouw s SER 124 Ca -0.03 1.06 -0.19 0.00 0.48 0.00 0.00 55.95 57.27 1ouw s SER 124 Cb -0.03 -1.68 0.00 0.00 0.10 0.00 0.00 66.02 64.41 1ouw s SER 124 CO 0.02 -2.59 0.58 0.00 0.98 0.00 0.00 173.24 172.23 1ouw s ALA 125 N -3.20 3.46 -0.44 5.32 0.00 -1.26 -4.85 121.76 120.79 1ouw s ALA 125 Ca 0.64 -0.95 -0.29 0.00 0.00 0.00 0.00 51.96 51.36 1ouw s ALA 125 Cb -0.15 -3.11 0.01 0.00 0.00 0.00 0.00 23.12 19.86 1ouw s ALA 125 CO 0.54 -1.32 1.41 -0.80 0.00 0.00 0.00 175.76 175.59 1ouw s ASN 126 N 1.79 6.30 0.14 0.00 -0.87 -1.26 -4.94 114.94 116.10 1ouw s ASN 126 Ca 0.22 0.74 0.11 0.00 -1.57 0.00 0.00 52.86 52.35 1ouw s ASN 126 Cb -0.15 -2.54 -0.04 0.00 -0.02 0.00 0.00 41.25 38.50 1ouw s ASN 126 CO 0.14 -1.48 -0.25 0.68 -2.57 0.00 0.00 177.10 173.62 1ouw s VAL 127 N 5.55 2.17 -0.01 1.60 -7.23 -1.26 -5.09 120.40 116.13 1ouw s VAL 127 Ca 0.60 -1.81 -0.30 0.00 -1.81 0.00 0.00 61.98 58.66 1ouw s VAL 127 Cb -0.13 -1.96 -0.07 0.00 0.56 0.00 0.00 36.38 34.78 1ouw s VAL 127 CO 0.32 -0.01 1.77 0.68 -0.31 0.00 0.00 175.10 177.54 1ouw s VAL 128 N -1.30 3.33 0.00 1.32 -7.23 -1.26 -2.61 120.40 112.66 1ouw s VAL 128 Ca 0.15 0.44 0.00 0.00 -1.81 0.00 0.00 61.98 60.76 1ouw s VAL 128 Cb -0.09 -3.29 0.00 0.00 0.56 0.00 0.00 36.38 33.56 1ouw s VAL 128 CO 0.07 -0.04 0.00 0.61 -0.31 0.00 0.00 175.10 175.43 1ouw n GLY 129 N 4.27 0.81 3.89 2.32 0.00 -1.26 -5.02 105.19 110.19 1ouw n GLY 129 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1ouw n GLY 129 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ouw s ASN 130 N -2.69 6.52 -0.04 1.61 2.47 -1.07 -0.17 114.94 121.57 1ouw s ASN 130 Ca 0.00 0.61 0.04 0.00 0.42 0.00 0.00 52.86 53.93 1ouw s ASN 130 Cb 0.00 -2.10 -0.00 0.00 -1.45 0.00 0.00 41.25 37.69 1ouw s ASN 130 CO 0.00 0.12 -0.15 -0.70 -3.72 0.00 0.00 177.10 172.65 1ouw s GLU 131 N -2.31 1.53 -0.13 0.43 2.12 -0.44 -4.77 118.70 115.14 1ouw s GLU 131 Ca 0.36 -0.53 -0.29 0.00 0.36 0.00 0.00 54.97 54.87 1ouw s GLU 131 Cb -0.13 -1.36 -0.01 0.00 0.26 0.00 0.00 34.13 32.89 1ouw s GLU 131 CO 0.22 0.22 1.01 0.42 -0.54 0.00 0.00 175.26 176.58 1ouw s ILE 132 N 0.05 4.77 -0.43 -3.70 1.01 -0.05 -1.62 121.20 121.23 1ouw s ILE 132 Ca -0.03 2.04 0.03 0.00 0.00 0.00 0.00 60.65 62.69 1ouw s ILE 132 Cb -0.10 -4.31 0.03 0.00 0.01 0.00 0.00 42.46 38.09 1ouw s ILE 132 CO 0.02 -0.02 0.65 1.33 0.00 0.00 0.00 174.94 176.91 1ouw n VAL 133 N 4.67 0.08 -3.98 2.92 0.24 -0.22 -4.48 118.33 117.57 1ouw n VAL 133 Ca 0.09 -0.54 0.05 0.00 -2.04 0.00 0.00 64.34 61.90 1ouw n VAL 133 Cb 0.48 1.03 0.01 0.00 -1.47 0.00 0.00 33.84 33.89 1ouw n VAL 133 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1ouw s GLY 134 N -0.35 -0.24 0.08 7.63 0.00 -1.22 -4.15 107.32 109.07 1ouw s GLY 134 Ca 0.04 0.24 0.02 0.00 0.00 0.00 0.00 44.72 45.03 1ouw s GLY 134 CO 0.04 6.05 -0.08 -1.36 0.00 0.00 0.00 173.10 177.76 1ouw s PHE 135 N -2.01 0.87 0.23 1.90 0.08 -0.21 -1.31 117.98 117.54 1ouw s PHE 135 Ca 0.30 -0.70 -0.06 0.00 0.12 0.00 0.00 56.93 56.59 1ouw s PHE 135 Cb 0.01 -0.50 -0.02 0.00 -0.57 0.00 0.00 43.02 41.94 1ouw s PHE 135 CO -0.03 -0.08 0.30 -0.48 -0.10 0.00 0.00 175.22 174.83 1ouw s LEU 136 N -2.39 0.77 0.00 -0.37 2.34 -0.84 -0.61 118.68 117.58 1ouw s LEU 136 Ca 0.03 -1.18 0.00 0.00 0.06 0.00 0.00 54.13 53.03 1ouw s LEU 136 Cb -0.02 1.06 0.00 0.00 -0.56 0.00 0.00 46.19 46.67 1ouw s LEU 136 CO -0.02 -1.00 0.00 0.61 -1.06 0.00 0.00 176.35 174.89 1ouw n GLY 137 N -0.34 -0.56 3.08 -3.48 0.00 -0.37 -0.14 105.19 103.38 1ouw n GLY 137 Ca 0.00 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 45.12 1ouw n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ouw s ARG 138 N -1.23 0.57 0.16 1.61 0.52 -0.61 -1.15 118.95 118.83 1ouw s ARG 138 Ca 0.00 -0.78 -0.21 0.00 -0.52 0.00 0.00 55.73 54.22 1ouw s ARG 138 Cb 0.00 -0.38 0.06 0.00 0.52 0.00 0.00 34.95 35.15 1ouw s ARG 138 CO 0.00 0.07 0.57 -1.54 0.02 0.00 0.00 175.30 174.42 1ouw s SER 139 N -1.58 -0.48 0.00 0.23 1.04 0.30 -0.92 113.70 112.28 1ouw s SER 139 Ca -0.09 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.24 1ouw s SER 139 Cb -0.10 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1ouw s SER 139 CO 0.01 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.86 1ouw n GLY 140 N -0.36 2.13 0.21 7.32 0.00 -1.26 -0.43 105.19 112.80 1ouw n GLY 140 Ca -0.16 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1ouw n GLY 140 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1ouw h TYR 141 N 0.00 0.22 -3.52 1.61 -1.99 -1.91 -1.94 116.97 109.44 1ouw h TYR 141 Ca 0.00 -0.04 -0.14 0.00 2.00 0.00 0.00 58.73 60.54 1ouw h TYR 141 Cb 0.00 -0.05 -0.03 0.00 2.00 0.00 0.00 36.73 38.64 1ouw h TYR 141 CO 0.00 0.48 -0.12 0.66 -0.00 0.00 0.00 178.16 179.18 1ouw n TYR 142 N -4.13 0.06 -3.51 4.88 4.02 -1.26 -1.27 117.16 115.95 1ouw n TYR 142 Ca -0.01 -0.66 -0.40 0.00 -0.01 0.00 0.00 57.90 56.82 1ouw n TYR 142 Cb 0.39 -0.01 -0.10 0.00 -0.02 0.00 0.00 39.34 39.59 1ouw n TYR 142 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1ouw s VAL 143 N -1.88 5.27 -0.09 -0.72 1.01 -1.25 -4.32 120.40 118.41 1ouw s VAL 143 Ca 0.05 -0.07 0.15 0.00 0.00 0.00 0.00 61.98 62.11 1ouw s VAL 143 Cb 0.00 -3.70 -0.18 0.00 0.00 0.00 0.00 36.38 32.50 1ouw s VAL 143 CO 0.03 0.03 0.73 0.47 0.00 0.00 0.00 175.10 176.36 1ouw n ASP 144 N 5.15 0.83 -3.51 3.32 9.92 -0.10 -0.71 116.55 131.46 1ouw n ASP 144 Ca -0.12 0.38 -0.14 0.00 -0.53 0.00 0.00 54.79 54.37 1ouw n ASP 144 Cb 0.50 0.11 -0.05 0.00 -0.64 0.00 0.00 41.12 41.05 1ouw n ASP 144 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ouw s ALA 145 N -2.78 -1.78 -0.11 2.24 0.00 -0.79 -0.90 121.76 117.64 1ouw s ALA 145 Ca -0.04 1.19 -0.13 0.00 0.00 0.00 0.00 51.96 52.98 1ouw s ALA 145 Cb 0.08 0.07 0.03 0.00 0.00 0.00 0.00 23.12 23.30 1ouw s ALA 145 CO 0.82 -0.47 0.35 -1.50 0.00 0.00 0.00 175.76 174.96 1ouw s ILE 146 N -1.85 0.01 0.21 0.00 2.07 0.03 -1.57 121.20 120.11 1ouw s ILE 146 Ca -0.05 -0.10 0.02 0.00 -1.41 0.00 0.00 60.65 59.12 1ouw s ILE 146 Cb -0.00 -0.53 -0.01 0.00 0.13 0.00 0.00 42.46 42.05 1ouw s ILE 146 CO 0.02 -0.05 0.23 0.61 -1.91 0.00 0.00 174.94 173.84 1ouw n GLY 147 N 2.54 2.99 3.26 1.50 0.00 0.80 -0.08 105.19 116.21 1ouw n GLY 147 Ca -0.15 -1.70 -0.20 0.00 0.00 0.00 0.00 46.02 43.97 1ouw n GLY 147 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ouw s THR 148 N -2.78 1.49 -0.12 2.61 -4.23 -0.35 -1.99 115.64 110.27 1ouw s THR 148 Ca 0.22 -1.68 -0.07 0.00 -1.18 0.00 0.00 61.69 58.99 1ouw s THR 148 Cb 0.00 -1.55 -0.04 0.00 1.34 0.00 0.00 72.50 72.25 1ouw s THR 148 CO 0.16 -0.30 0.13 -0.31 -0.54 0.00 0.00 174.62 173.76 1ouw s TYR 149 N -1.82 3.56 0.02 3.99 2.02 -0.42 -1.02 117.35 123.67 1ouw s TYR 149 Ca 0.09 0.49 0.04 0.00 -0.37 0.00 0.00 57.07 57.32 1ouw s TYR 149 Cb -0.07 -1.93 -0.01 0.00 -0.40 0.00 0.00 41.96 39.55 1ouw s TYR 149 CO 0.04 0.70 -0.11 -0.80 -1.57 0.00 0.00 175.55 173.81 1ouw s ASN 150 N -0.98 1.28 -0.14 2.29 0.01 0.15 -1.06 114.94 116.49 1ouw s ASN 150 Ca 0.15 -0.32 -0.13 0.00 -0.71 0.00 0.00 52.86 51.84 1ouw s ASN 150 Cb -0.12 -0.10 0.04 0.00 0.41 0.00 0.00 41.25 41.48 1ouw s ASN 150 CO 0.04 0.05 0.38 -0.60 -1.51 0.00 0.00 177.10 175.45 1ouw s ARG 151 N -0.73 0.44 0.19 -0.60 3.52 -0.64 -2.83 118.95 118.30 1ouw s ARG 151 Ca 0.01 0.53 -0.32 0.00 -0.13 0.00 0.00 55.73 55.83 1ouw s ARG 151 Cb -0.06 0.21 -0.11 0.00 -1.56 0.00 0.00 34.95 33.43 1ouw s ARG 151 CO 0.00 -0.05 1.62 -1.58 -0.81 0.00 0.00 175.30 174.48 1ouw s HIS 152 N 0.22 3.00 -2.00 5.12 5.65 -1.26 -1.33 115.29 124.69 1ouw s HIS 152 Ca -0.00 0.54 0.03 0.00 0.25 0.00 0.00 55.06 55.88 1ouw s HIS 152 Cb -0.03 -4.00 0.19 0.00 -1.18 0.00 0.00 32.58 27.56 1ouw s HIS 152 CO 0.00 -3.72 0.67 1.17 -0.65 0.00 0.00 174.74 172.21