#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 2.72 0.09 5.55 0.02 -1.26 -5.05 135.00 137.06 1ouw s PRO 4 Ca 0.00 1.60 0.05 0.00 0.02 0.00 0.00 61.00 62.67 1ouw s PRO 4 Cb 0.00 -1.92 -0.03 0.00 0.02 0.00 0.00 34.50 32.57 1ouw s PRO 4 CO 0.00 -1.35 -0.14 -1.64 -0.33 0.00 0.00 177.00 173.54 1ouw s MET 5 N -3.80 0.87 0.45 5.54 -1.94 -1.26 -5.13 119.30 114.03 1ouw s MET 5 Ca 0.71 -1.05 -0.23 0.00 -1.71 0.00 0.00 55.69 53.41 1ouw s MET 5 Cb -0.25 -0.80 -0.07 0.00 2.01 0.00 0.00 34.83 35.71 1ouw s MET 5 CO 0.39 0.17 1.20 -0.51 -0.01 0.00 0.00 175.02 176.26 1ouw s ASP 6 N -2.02 6.14 0.25 3.03 1.01 -1.26 -4.95 116.67 118.87 1ouw s ASP 6 Ca 0.02 2.41 -0.30 0.00 0.71 0.00 0.00 52.55 55.39 1ouw s ASP 6 Cb -0.08 -2.61 -0.09 0.00 1.01 0.00 0.00 42.92 41.15 1ouw s ASP 6 CO 0.02 -0.95 1.26 0.42 0.21 0.00 0.00 175.17 176.14 1ouw s THR 7 N -1.46 3.13 -0.13 -1.27 -4.23 -1.20 -4.72 115.64 105.76 1ouw s THR 7 Ca 0.63 1.03 -0.14 0.00 -1.18 0.00 0.00 61.69 62.02 1ouw s THR 7 Cb -0.31 -3.65 -0.05 0.00 1.34 0.00 0.00 72.50 69.83 1ouw s THR 7 CO 0.38 0.20 0.32 -0.63 -0.54 0.00 0.00 174.62 174.36 1ouw s ILE 8 N -0.53 5.26 -0.03 2.99 1.01 -1.26 -0.83 121.20 127.82 1ouw s ILE 8 Ca 0.52 0.62 0.01 0.00 0.00 0.00 0.00 60.65 61.80 1ouw s ILE 8 Cb -0.36 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.42 1ouw s ILE 8 CO 0.43 0.42 -0.00 -0.44 0.00 0.00 0.00 174.94 175.35 1ouw s SER 9 N 0.18 5.11 0.60 3.58 0.01 -0.30 -4.98 113.70 117.89 1ouw s SER 9 Ca 0.19 0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.47 1ouw s SER 9 Cb -0.14 -1.35 0.00 0.00 0.21 0.00 0.00 66.02 64.74 1ouw s SER 9 CO 0.06 0.31 0.00 0.61 0.41 0.00 0.00 173.24 174.63 1ouw n GLY 10 N 1.63 1.04 3.72 3.44 0.00 -1.26 -1.41 105.19 112.36 1ouw n GLY 10 Ca -0.16 -0.72 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 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 2.08 0.03 1.61 0.02 -1.26 -4.93 135.00 132.55 1ouw s PRO 11 Ca 0.00 1.75 -0.02 0.00 0.02 0.00 0.00 61.00 62.75 1ouw s PRO 11 Cb 0.00 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.65 1ouw s PRO 11 CO 0.00 -1.88 0.21 -1.58 -0.33 0.00 0.00 177.00 173.42 1ouw s TRP 12 N -2.02 3.53 0.00 6.54 0.51 -0.01 -4.89 118.94 122.61 1ouw s TRP 12 Ca 0.74 0.33 0.00 0.00 -2.12 0.00 0.00 56.10 55.05 1ouw s TRP 12 Cb -0.29 -1.82 0.00 0.00 -0.81 0.00 0.00 33.47 30.56 1ouw s TRP 12 CO 0.46 0.61 0.00 0.41 -0.51 0.00 0.00 176.95 177.92 1ouw n GLY 13 N 0.60 0.09 3.13 0.98 0.00 -1.26 -0.92 105.19 107.79 1ouw n GLY 13 Ca -0.08 -1.88 -0.21 0.00 0.00 0.00 0.00 46.02 43.85 1ouw n GLY 13 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ouw n ASN 14 N 0.00 0.13 -0.83 1.61 0.23 -0.16 -4.97 115.26 111.26 1ouw n ASN 14 Ca 0.00 -3.09 0.09 0.00 -0.53 0.00 0.00 54.58 51.05 1ouw n ASN 14 Cb 0.00 1.34 0.24 0.00 -2.08 0.00 0.00 39.78 39.28 1ouw n ASN 14 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1ouw n ASN 15 N -1.66 2.43 -4.43 0.53 6.94 -1.26 -4.39 115.26 113.41 1ouw n ASN 15 Ca 0.02 -1.94 -0.29 0.00 -0.02 0.00 0.00 54.58 52.35 1ouw n ASN 15 Cb 0.58 -0.27 0.21 0.00 -2.36 0.00 0.00 39.78 37.95 1ouw n ASN 15 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1ouw s GLY 16 N -1.16 1.55 0.00 4.83 0.00 -1.26 -4.88 107.32 106.40 1ouw s GLY 16 Ca 0.32 -0.46 0.00 0.00 0.00 0.00 0.00 44.72 44.58 1ouw s GLY 16 CO 0.23 0.25 0.00 0.61 0.00 0.00 0.00 173.10 174.19 1ouw n GLY 17 N -0.56 0.64 3.29 0.20 0.00 -1.26 -4.41 105.19 103.10 1ouw n GLY 17 Ca 0.06 -0.83 -0.16 0.00 0.00 0.00 0.00 46.02 45.09 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 2.18 0.47 1.61 0.01 0.06 -4.80 114.94 110.47 1ouw s ASN 18 Ca 0.00 -1.00 -0.23 0.00 -0.71 0.00 0.00 52.86 50.92 1ouw s ASN 18 Cb 0.00 -0.07 -0.07 0.00 0.41 0.00 0.00 41.25 41.52 1ouw s ASN 18 CO 0.00 -0.24 1.20 0.12 -1.51 0.00 0.00 177.10 176.67 1ouw s PHE 19 N -3.07 2.78 0.05 2.20 5.36 -1.26 -0.63 117.98 123.40 1ouw s PHE 19 Ca 0.19 1.51 -0.02 0.00 -0.96 0.00 0.00 56.93 57.65 1ouw s PHE 19 Cb 0.00 -3.45 -0.03 0.00 -0.34 0.00 0.00 43.02 39.21 1ouw s PHE 19 CO 0.04 -1.73 0.01 1.67 -1.46 0.00 0.00 175.22 173.75 1ouw s TRP 20 N -1.51 0.41 -0.18 10.12 1.48 -0.26 -4.87 118.94 124.13 1ouw s TRP 20 Ca 0.65 -0.88 -0.20 0.00 -1.06 0.00 0.00 56.10 54.62 1ouw s TRP 20 Cb -0.30 -0.30 0.05 0.00 -1.16 0.00 0.00 33.47 31.76 1ouw s TRP 20 CO 0.37 -0.37 0.54 0.45 -4.06 0.00 0.00 176.95 173.88 1ouw s SER 21 N -2.61 -0.55 -0.26 -2.66 0.15 -1.26 -1.12 113.70 105.38 1ouw s SER 21 Ca 0.02 0.99 -0.01 0.00 0.70 0.00 0.00 55.95 57.65 1ouw s SER 21 Cb 0.04 1.00 0.15 0.00 -1.71 0.00 0.00 66.02 65.50 1ouw s SER 21 CO -0.08 -0.24 0.43 0.12 1.20 0.00 0.00 173.24 174.66 1ouw s PHE 22 N 0.04 -1.02 -0.38 3.44 5.36 0.35 -4.99 117.98 120.77 1ouw s PHE 22 Ca -0.02 0.86 0.01 0.00 -0.96 0.00 0.00 56.93 56.82 1ouw s PHE 22 Cb -0.04 0.08 0.13 0.00 -0.34 0.00 0.00 43.02 42.85 1ouw s PHE 22 CO 0.02 -0.82 0.19 0.50 -1.46 0.00 0.00 175.22 173.65 1ouw s ARG 23 N 2.60 0.92 0.64 10.12 3.00 -1.26 -1.00 118.95 133.97 1ouw s ARG 23 Ca 0.13 -1.55 -0.11 0.00 -1.00 0.00 0.00 55.73 53.20 1ouw s ARG 23 Cb -0.14 -1.95 -0.02 0.00 0.00 0.00 0.00 34.95 32.83 1ouw s ARG 23 CO -0.20 -1.12 1.05 -1.25 0.00 0.00 0.00 175.30 173.77 1ouw s PRO 24 N 0.92 3.39 0.21 5.12 0.04 -1.26 -4.98 135.00 138.44 1ouw s PRO 24 Ca 0.15 0.67 -0.02 0.00 0.04 0.00 0.00 61.00 61.84 1ouw s PRO 24 Cb -0.22 -2.06 0.18 0.00 0.04 0.00 0.00 34.50 32.44 1ouw s PRO 24 CO -0.07 -0.70 1.57 -0.39 0.04 0.00 0.00 177.00 177.45 1ouw h VAL 25 N -0.41 1.30 -0.78 -0.36 -1.51 -2.00 -3.45 116.25 109.04 1ouw h VAL 25 Ca -0.44 -1.60 -0.49 0.00 -1.23 0.00 0.00 66.70 62.94 1ouw h VAL 25 Cb 1.21 1.57 0.03 0.00 -2.13 0.00 0.00 31.29 31.96 1ouw h VAL 25 CO 0.62 0.50 -0.10 0.20 -1.23 0.00 0.00 177.57 177.57 1ouw s ASN 26 N -6.86 5.09 0.28 4.19 0.01 -1.26 -5.06 114.94 111.33 1ouw s ASN 26 Ca -0.08 -0.86 -0.29 0.00 -0.71 0.00 0.00 52.86 50.92 1ouw s ASN 26 Cb 0.12 0.30 -0.10 0.00 0.41 0.00 0.00 41.25 41.99 1ouw s ASN 26 CO 0.83 -1.34 1.16 -0.75 -1.51 0.00 0.00 177.10 175.49 1ouw s LYS 27 N -4.66 4.56 -0.22 -0.60 2.20 -1.26 -4.94 119.74 114.81 1ouw s LYS 27 Ca 0.61 1.91 -0.29 0.00 -0.36 0.00 0.00 55.97 57.84 1ouw s LYS 27 Cb -0.06 -3.17 -0.02 0.00 -1.51 0.00 0.00 37.83 33.07 1ouw s LYS 27 CO 0.39 0.08 1.55 0.42 -0.36 0.00 0.00 175.35 177.42 1ouw s ILE 28 N -0.99 3.79 -0.59 5.43 1.01 -1.26 -4.32 121.20 124.26 1ouw s ILE 28 Ca 0.47 0.90 0.06 0.00 0.00 0.00 0.00 60.65 62.08 1ouw s ILE 28 Cb -0.34 -3.79 0.02 0.00 0.01 0.00 0.00 42.46 38.36 1ouw s ILE 28 CO 0.43 -0.31 0.54 -0.46 0.00 0.00 0.00 174.94 175.15 1ouw n ASN 29 N 8.15 1.11 -3.79 3.58 6.94 -0.64 -4.82 115.26 125.80 1ouw n ASN 29 Ca 0.18 -1.06 -0.13 0.00 -0.02 0.00 0.00 54.58 53.56 1ouw n ASN 29 Cb 0.45 0.31 -0.12 0.00 -2.36 0.00 0.00 39.78 38.06 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 -0.80 0.28 -0.05 -3.83 0.74 -1.08 -0.92 119.66 113.99 1ouw s GLN 30 Ca 0.05 0.35 0.02 0.00 0.05 0.00 0.00 55.36 55.84 1ouw s GLN 30 Cb 0.05 0.12 0.01 0.00 1.10 0.00 0.00 33.01 34.29 1ouw s GLN 30 CO 0.12 -0.04 -0.11 0.42 -0.55 0.00 0.00 175.29 175.12 1ouw s ILE 31 N 0.19 1.04 -0.17 -2.34 1.01 -0.50 -1.42 121.20 119.01 1ouw s ILE 31 Ca -0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 60.65 60.18 1ouw s ILE 31 Cb -0.02 -0.95 -0.01 0.00 0.01 0.00 0.00 42.46 41.49 1ouw s ILE 31 CO -0.00 0.33 -0.09 -0.69 0.00 0.00 0.00 174.94 174.48 1ouw s VAL 32 N 0.54 3.18 -0.26 2.92 1.01 0.11 -0.50 120.40 127.41 1ouw s VAL 32 Ca -0.11 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.18 1ouw s VAL 32 Cb -0.14 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.81 1ouw s VAL 32 CO 0.03 0.49 0.15 -0.63 0.00 0.00 0.00 175.10 175.13 1ouw s ILE 33 N 0.82 5.13 -0.13 2.22 1.09 0.63 -0.72 121.20 130.25 1ouw s ILE 33 Ca -0.03 0.11 -0.10 0.00 -1.10 0.00 0.00 60.65 59.52 1ouw s ILE 33 Cb -0.15 -3.41 -0.05 0.00 -1.06 0.00 0.00 42.46 37.79 1ouw s ILE 33 CO 0.01 0.31 0.21 -0.44 -0.10 0.00 0.00 174.94 174.93 1ouw s SER 34 N 1.41 6.43 0.15 3.58 0.01 -0.28 -1.38 113.70 123.62 1ouw s SER 34 Ca 0.07 0.50 0.08 0.00 1.31 0.00 0.00 55.95 57.91 1ouw s SER 34 Cb -0.15 -2.13 -0.04 0.00 0.21 0.00 0.00 66.02 63.91 1ouw s SER 34 CO 0.07 0.28 -0.07 -0.31 0.41 0.00 0.00 173.24 173.62 1ouw s TYR 35 N -0.41 2.72 0.37 2.43 2.02 0.36 -0.49 117.35 124.34 1ouw s TYR 35 Ca 0.15 -0.18 0.04 0.00 -0.37 0.00 0.00 57.07 56.71 1ouw s TYR 35 Cb -0.13 -1.36 -0.05 0.00 -0.40 0.00 0.00 41.96 40.02 1ouw s TYR 35 CO 0.04 0.49 0.07 0.20 -1.57 0.00 0.00 175.55 174.77 1ouw s GLY 36 N -2.66 2.31 0.00 0.71 0.00 -0.48 -0.80 107.32 106.41 1ouw s GLY 36 Ca 0.24 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 43.21 1ouw s GLY 36 CO 0.16 -1.87 0.00 0.61 0.00 0.00 0.00 173.10 171.99 1ouw n GLY 37 N -0.81 0.54 2.41 0.20 0.00 -1.26 -2.97 105.19 103.31 1ouw n GLY 37 Ca -0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.91 0.80 0.00 -0.02 0.00 -1.26 -4.95 105.19 96.85 1ouw n GLY 38 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.29 5.19 1.94 -0.02 0.00 -1.16 -5.05 105.19 104.81 1ouw n GLY 39 Ca -0.06 -1.39 -0.14 0.00 0.00 0.00 0.00 46.02 44.42 1ouw n GLY 39 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ouw n ASN 40 N 0.00 6.03 -4.19 1.61 2.85 -1.26 -4.37 115.26 115.93 1ouw n ASN 40 Ca 0.00 -2.86 -0.39 0.00 -0.11 0.00 0.00 54.58 51.22 1ouw n ASN 40 Cb 0.00 -1.16 -0.10 0.00 1.24 0.00 0.00 39.78 39.75 1ouw n ASN 40 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 1ouw s ASN 41 N 0.90 5.49 0.18 1.20 0.01 -1.26 -3.90 114.94 117.56 1ouw s ASN 41 Ca 0.35 -1.84 -0.31 0.00 -0.71 0.00 0.00 52.86 50.35 1ouw s ASN 41 Cb 0.23 -1.92 -0.10 0.00 0.41 0.00 0.00 41.25 39.86 1ouw s ASN 41 CO -0.05 -0.58 1.55 -2.16 -1.51 0.00 0.00 177.10 174.35 1ouw s PRO 42 N 1.29 4.22 -0.01 -0.60 0.04 -1.26 -1.38 135.00 137.30 1ouw s PRO 42 Ca 0.05 2.36 0.02 0.00 0.04 0.00 0.00 61.00 63.47 1ouw s PRO 42 Cb -0.24 -3.15 -0.03 0.00 0.04 0.00 0.00 34.50 31.12 1ouw s PRO 42 CO -0.01 -0.58 0.03 0.44 0.04 0.00 0.00 177.00 176.91 1ouw n ILE 43 N 3.73 0.05 -3.67 0.56 -5.35 0.36 -4.77 119.36 110.27 1ouw n ILE 43 Ca 0.13 -0.06 -0.12 0.00 -0.27 0.00 0.00 62.75 62.42 1ouw n ILE 43 Cb 0.39 -0.08 -0.06 0.00 -1.74 0.00 0.00 39.64 38.14 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 -2.11 -0.96 -0.05 -1.28 0.00 -1.14 -1.55 121.76 114.67 1ouw s ALA 44 Ca -0.01 0.24 0.03 0.00 0.00 0.00 0.00 51.96 52.23 1ouw s ALA 44 Cb 0.01 0.37 0.00 0.00 0.00 0.00 0.00 23.12 23.50 1ouw s ALA 44 CO 0.08 -0.47 -0.14 -0.51 0.00 0.00 0.00 175.76 174.72 1ouw s LEU 45 N -2.07 1.82 -0.19 0.00 1.43 -0.12 -1.13 118.68 118.42 1ouw s LEU 45 Ca -0.05 -0.31 -0.00 0.00 -1.03 0.00 0.00 54.13 52.75 1ouw s LEU 45 Cb -0.01 -0.85 0.01 0.00 0.03 0.00 0.00 46.19 45.37 1ouw s LEU 45 CO -0.03 0.10 -0.16 -0.89 0.23 0.00 0.00 176.35 175.60 1ouw s THR 46 N 0.25 2.39 -0.11 5.49 2.01 0.11 -0.91 115.64 124.86 1ouw s THR 46 Ca -0.07 -0.83 -0.03 0.00 0.31 0.00 0.00 61.69 61.07 1ouw s THR 46 Cb -0.12 -2.03 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 1ouw s THR 46 CO 0.02 0.51 0.01 -0.36 -0.69 0.00 0.00 174.62 174.12 1ouw s PHE 47 N 1.32 3.17 0.04 4.92 0.08 -0.44 -0.71 117.98 126.36 1ouw s PHE 47 Ca 0.05 0.11 -0.05 0.00 0.12 0.00 0.00 56.93 57.16 1ouw s PHE 47 Cb -0.13 -1.87 -0.02 0.00 -0.57 0.00 0.00 43.02 40.43 1ouw s PHE 47 CO -0.10 0.35 0.07 -1.54 -0.10 0.00 0.00 175.22 173.90 1ouw s SER 48 N -0.49 0.22 -0.15 1.36 1.04 -0.51 -1.64 113.70 113.53 1ouw s SER 48 Ca 0.09 -0.59 -0.01 0.00 0.48 0.00 0.00 55.95 55.91 1ouw s SER 48 Cb -0.12 0.22 0.04 0.00 0.10 0.00 0.00 66.02 66.26 1ouw s SER 48 CO 0.02 -0.51 -0.03 -0.55 0.98 0.00 0.00 173.24 173.15 1ouw s SER 49 N -2.19 2.62 -0.17 7.02 0.15 -0.20 -1.62 113.70 119.31 1ouw s SER 49 Ca -0.04 -0.58 -0.12 0.00 0.70 0.00 0.00 55.95 55.90 1ouw s SER 49 Cb -0.01 -0.78 -0.05 0.00 -1.71 0.00 0.00 66.02 63.48 1ouw s SER 49 CO -0.05 -0.20 0.23 -0.89 1.20 0.00 0.00 173.24 173.53 1ouw s THR 50 N 1.73 5.34 0.34 6.45 2.01 -1.26 -1.20 115.64 129.06 1ouw s THR 50 Ca 0.01 0.42 0.05 0.00 0.31 0.00 0.00 61.69 62.48 1ouw s THR 50 Cb -0.15 -3.57 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 1ouw s THR 50 CO -0.07 0.43 0.49 -0.54 -0.69 0.00 0.00 174.62 174.24 1ouw s LYS 51 N 0.28 3.17 0.44 4.92 1.02 -0.33 -4.88 119.74 124.37 1ouw s LYS 51 Ca 0.14 -0.85 0.17 0.00 0.02 0.00 0.00 55.97 55.45 1ouw s LYS 51 Cb -0.12 -2.78 1.11 0.00 -0.52 0.00 0.00 37.83 35.52 1ouw s LYS 51 CO 0.02 0.06 1.93 0.00 -0.92 0.00 0.00 175.35 176.44 1ouw h ALA 52 N 0.83 2.18 -0.02 5.17 0.00 -1.98 -0.93 119.26 124.52 1ouw h ALA 52 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1ouw h ALA 52 Cb 1.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1ouw h ALA 52 CO 0.55 -0.38 0.00 -0.40 0.00 0.00 0.00 179.25 179.02 1ouw n ASP 53 N -4.46 0.24 0.00 0.00 5.68 -1.26 -4.91 116.55 111.84 1ouw n ASP 53 Ca 0.14 -1.40 0.00 0.00 -0.50 0.00 0.00 54.79 53.03 1ouw n ASP 53 Cb 0.55 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 1ouw n ASP 53 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ouw n GLY 54 N 0.87 1.28 3.85 6.12 0.00 -0.35 -5.04 105.19 111.91 1ouw n GLY 54 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1ouw n GLY 54 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ouw s SER 55 N -3.02 6.06 -0.09 1.61 1.04 -1.26 -4.78 113.70 113.26 1ouw s SER 55 Ca 0.00 1.50 0.00 0.00 0.48 0.00 0.00 55.95 57.94 1ouw s SER 55 Cb 0.00 -2.48 0.02 0.00 0.10 0.00 0.00 66.02 63.66 1ouw s SER 55 CO 0.00 -0.98 -0.08 -0.75 0.98 0.00 0.00 173.24 172.41 1ouw s LYS 56 N -4.95 1.46 0.22 4.02 2.20 -1.26 -1.19 119.74 120.24 1ouw s LYS 56 Ca 0.57 -0.27 -0.25 0.00 -0.36 0.00 0.00 55.97 55.66 1ouw s LYS 56 Cb -0.12 -1.43 -0.09 0.00 -1.51 0.00 0.00 37.83 34.69 1ouw s LYS 56 CO 0.50 -0.17 0.83 -0.51 -0.36 0.00 0.00 175.35 175.65 1ouw s ASP 57 N 1.34 7.37 -0.08 1.43 1.01 -0.34 -4.93 116.67 122.47 1ouw s ASP 57 Ca -0.02 1.70 -0.25 0.00 0.71 0.00 0.00 52.55 54.68 1ouw s ASP 57 Cb -0.14 -2.52 0.06 0.00 1.01 0.00 0.00 42.92 41.33 1ouw s ASP 57 CO -0.04 0.11 0.58 0.28 0.21 0.00 0.00 175.17 176.32 1ouw s THR 58 N -1.32 0.01 -0.00 -1.27 -1.32 -1.26 -1.03 115.64 109.45 1ouw s THR 58 Ca 0.41 -0.11 -0.02 0.00 -1.21 0.00 0.00 61.69 60.76 1ouw s THR 58 Cb -0.22 -0.88 -0.00 0.00 -1.51 0.00 0.00 72.50 69.89 1ouw s THR 58 CO 0.26 -0.06 0.04 -0.51 -2.21 0.00 0.00 174.62 172.14 1ouw s ILE 59 N -0.93 0.05 -0.10 5.08 2.07 -0.65 -5.01 121.20 121.71 1ouw s ILE 59 Ca -0.09 -0.42 0.04 0.00 -1.41 0.00 0.00 60.65 58.76 1ouw s ILE 59 Cb -0.02 -0.20 0.00 0.00 0.13 0.00 0.00 42.46 42.37 1ouw s ILE 59 CO 0.07 -0.23 -0.23 -0.89 -1.91 0.00 0.00 174.94 171.74 1ouw s THR 60 N -0.71 2.03 0.00 4.00 2.01 -1.26 -1.33 115.64 120.39 1ouw s THR 60 Ca -0.08 -1.00 0.06 0.00 0.31 0.00 0.00 61.69 60.98 1ouw s THR 60 Cb -0.05 -1.76 -0.02 0.00 0.01 0.00 0.00 72.50 70.68 1ouw s THR 60 CO -0.00 0.55 -0.17 0.68 -0.69 0.00 0.00 174.62 174.99 1ouw s VAL 61 N 0.39 1.36 0.00 3.82 -7.23 -0.09 -4.99 120.40 113.67 1ouw s VAL 61 Ca -0.18 -0.84 0.00 0.00 -1.81 0.00 0.00 61.98 59.15 1ouw s VAL 61 Cb -0.18 -1.15 0.00 0.00 0.56 0.00 0.00 36.38 35.61 1ouw s VAL 61 CO 0.08 0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.78 1ouw n GLY 62 N 2.42 -1.32 2.19 2.32 0.00 -1.26 -0.94 105.19 108.61 1ouw n GLY 62 Ca -0.15 -1.53 -0.05 0.00 0.00 0.00 0.00 46.02 44.28 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 -1.13 0.76 0.00 -0.02 0.00 -0.11 -4.78 105.19 99.90 1ouw n GLY 63 Ca 0.00 -0.65 0.13 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.18 -1.32 1.91 -0.02 0.00 -0.74 -4.88 105.19 97.95 1ouw n GLY 64 Ca -0.05 -0.11 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 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 1.18 2.20 0.00 -0.02 0.00 -1.26 -4.82 105.19 102.47 1ouw n GLY 65 Ca 0.10 -2.19 0.11 0.00 0.00 0.00 0.00 46.02 44.03 1ouw n GLY 65 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ouw n PRO 66 N -1.49 0.14 -1.67 1.61 -0.04 -1.26 -4.90 135.00 127.40 1ouw n PRO 66 Ca 0.06 0.09 -0.59 0.00 -0.04 0.00 0.00 63.50 63.02 1ouw n PRO 66 Cb 0.30 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.18 1ouw n PRO 66 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1ouw n ASP 67 N -1.41 1.65 -4.77 3.54 9.92 -1.26 -4.95 116.55 119.28 1ouw n ASP 67 Ca 0.08 1.12 -0.40 0.00 -0.53 0.00 0.00 54.79 55.06 1ouw n ASP 67 Cb 0.23 -1.07 -0.02 0.00 -0.64 0.00 0.00 41.12 39.62 1ouw n ASP 67 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1ouw s SER 68 N 2.27 6.78 -0.34 -2.24 0.01 -1.26 -4.97 113.70 113.95 1ouw s SER 68 Ca 0.96 2.48 -0.28 0.00 1.31 0.00 0.00 55.95 60.42 1ouw s SER 68 Cb -1.16 -2.63 0.02 0.00 0.21 0.00 0.00 66.02 62.45 1ouw s SER 68 CO 0.64 -0.51 1.04 -0.63 0.41 0.00 0.00 173.24 174.19 1ouw s ILE 69 N -1.24 4.51 -2.38 1.44 1.01 -1.26 -4.35 121.20 118.93 1ouw s ILE 69 Ca 0.51 1.57 0.22 0.00 0.00 0.00 0.00 60.65 62.94 1ouw s ILE 69 Cb -0.35 -4.40 0.09 0.00 0.01 0.00 0.00 42.46 37.81 1ouw s ILE 69 CO 0.45 -0.52 1.12 0.35 0.00 0.00 0.00 174.94 176.34 1ouw n THR 70 N 5.96 0.00 -3.60 2.92 -2.24 0.02 -5.00 114.28 112.33 1ouw n THR 70 Ca 0.11 -0.40 -0.03 0.00 -2.27 0.00 0.00 64.05 61.45 1ouw n THR 70 Cb 0.47 1.36 -0.02 0.00 -2.10 0.00 0.00 70.33 70.05 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 -2.06 -0.33 0.03 3.38 0.00 -1.20 -4.87 107.32 102.27 1ouw s GLY 71 Ca 0.22 1.34 -0.04 0.00 0.00 0.00 0.00 44.72 46.24 1ouw s GLY 71 CO 0.39 0.42 0.05 -0.51 0.00 0.00 0.00 173.10 173.45 1ouw s THR 72 N -2.44 0.13 0.10 0.90 -4.23 -1.26 -0.49 115.64 108.34 1ouw s THR 72 Ca 0.11 -1.06 0.05 0.00 -1.18 0.00 0.00 61.69 59.61 1ouw s THR 72 Cb 0.00 -0.71 -0.03 0.00 1.34 0.00 0.00 72.50 73.10 1ouw s THR 72 CO -0.04 -0.58 -0.13 -1.61 -0.54 0.00 0.00 174.62 171.72 1ouw s GLU 73 N -2.23 0.90 -0.03 3.99 2.02 -0.48 -4.99 118.70 117.89 1ouw s GLU 73 Ca -0.08 -1.12 0.04 0.00 0.02 0.00 0.00 54.97 53.82 1ouw s GLU 73 Cb -0.04 -0.75 -0.00 0.00 0.10 0.00 0.00 34.13 33.43 1ouw s GLU 73 CO -0.03 0.15 -0.13 -1.64 0.02 0.00 0.00 175.26 173.62 1ouw s MET 74 N -2.40 1.29 -0.25 1.61 -1.94 -1.26 -0.27 119.30 116.07 1ouw s MET 74 Ca 0.04 -0.47 -0.08 0.00 -1.71 0.00 0.00 55.69 53.47 1ouw s MET 74 Cb -0.06 -1.18 -0.03 0.00 2.01 0.00 0.00 34.83 35.57 1ouw s MET 74 CO 0.02 0.22 0.10 0.08 -0.01 0.00 0.00 175.02 175.42 1ouw s VAL 75 N -0.03 4.56 -0.28 -6.03 1.01 0.35 -4.99 120.40 114.99 1ouw s VAL 75 Ca -0.01 -0.09 -0.06 0.00 0.00 0.00 0.00 61.98 61.83 1ouw s VAL 75 Cb -0.09 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 33.17 1ouw s VAL 75 CO 0.01 0.32 0.04 0.20 0.00 0.00 0.00 175.10 175.67 1ouw s ASN 76 N 1.59 4.91 -0.18 3.32 0.01 -1.26 -1.41 114.94 121.93 1ouw s ASN 76 Ca 0.06 -0.70 -0.20 0.00 -0.71 0.00 0.00 52.86 51.31 1ouw s ASN 76 Cb -0.15 -1.83 -0.03 0.00 0.41 0.00 0.00 41.25 39.65 1ouw s ASN 76 CO 0.05 -0.16 0.59 -0.63 -1.51 0.00 0.00 177.10 175.44 1ouw s ILE 77 N 1.47 5.06 0.93 0.60 1.01 -0.10 -5.02 121.20 125.15 1ouw s ILE 77 Ca 0.02 1.13 -0.13 0.00 0.00 0.00 0.00 60.65 61.67 1ouw s ILE 77 Cb -0.17 -3.91 0.15 0.00 0.01 0.00 0.00 42.46 38.54 1ouw s ILE 77 CO 0.01 0.16 1.17 -0.83 0.00 0.00 0.00 174.94 175.45 1ouw s GLY 78 N 1.09 1.61 0.20 6.18 0.00 -1.26 -4.87 107.32 110.27 1ouw s GLY 78 Ca 0.28 -0.68 -0.11 0.00 0.00 0.00 0.00 44.72 44.20 1ouw s GLY 78 CO 0.11 -0.07 1.71 -0.84 0.00 0.00 0.00 173.10 174.01 1ouw h THR 79 N -1.57 0.69 -0.50 0.90 2.02 -2.00 -1.17 112.91 111.28 1ouw h THR 79 Ca -0.48 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1ouw h THR 79 Cb 1.31 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1ouw h THR 79 CO 0.56 0.05 0.00 0.47 0.37 0.00 0.00 175.52 176.97 1ouw n ASP 80 N -5.11 3.97 -4.59 4.18 8.00 -1.26 -4.91 116.55 116.83 1ouw n ASP 80 Ca 0.07 -2.41 -0.32 0.00 0.71 0.00 0.00 54.79 52.84 1ouw n ASP 80 Cb 0.28 -0.53 -0.11 0.00 -0.02 0.00 0.00 41.12 40.74 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 -1.88 2.55 -0.03 -1.24 2.12 -0.44 -4.96 118.70 114.82 1ouw s GLU 81 Ca 0.40 -0.72 -0.17 0.00 0.36 0.00 0.00 54.97 54.85 1ouw s GLU 81 Cb 0.27 -2.49 0.03 0.00 0.26 0.00 0.00 34.13 32.19 1ouw s GLU 81 CO 0.18 0.60 0.36 1.52 -0.54 0.00 0.00 175.26 177.39 1ouw s TYR 82 N -0.98 -0.26 0.28 5.30 1.13 -1.26 -4.57 117.35 116.99 1ouw s TYR 82 Ca 0.17 0.44 -0.30 0.00 -1.41 0.00 0.00 57.07 55.96 1ouw s TYR 82 Cb -0.11 0.14 -0.11 0.00 -1.10 0.00 0.00 41.96 40.78 1ouw s TYR 82 CO 0.07 -0.40 1.54 -0.51 -2.51 0.00 0.00 175.55 173.73 1ouw s LEU 83 N -1.18 4.36 0.00 -3.49 1.43 -1.26 -1.50 118.68 117.04 1ouw s LEU 83 Ca -0.12 2.86 0.00 0.00 -1.03 0.00 0.00 54.13 55.84 1ouw s LEU 83 Cb -0.04 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.54 1ouw s LEU 83 CO 0.05 -0.84 0.00 0.35 0.23 0.00 0.00 176.35 176.14 1ouw n THR 84 N 2.13 0.00 -3.59 5.49 -2.24 0.32 -0.85 114.28 115.54 1ouw n THR 84 Ca 0.07 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.75 1ouw n THR 84 Cb 0.38 -0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.46 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 -1.82 -0.35 0.10 3.38 0.00 -0.77 -4.54 107.32 103.32 1ouw s GLY 85 Ca 0.00 0.10 0.03 0.00 0.00 0.00 0.00 44.72 44.85 1ouw s GLY 85 CO 0.00 -0.11 -0.09 -0.26 0.00 0.00 0.00 173.10 172.65 1ouw s ILE 86 N -3.81 0.84 0.25 0.90 -4.36 -1.26 -0.67 121.20 113.09 1ouw s ILE 86 Ca 0.04 -1.75 -0.17 0.00 -0.26 0.00 0.00 60.65 58.51 1ouw s ILE 86 Cb -0.00 -1.47 0.01 0.00 1.25 0.00 0.00 42.46 42.25 1ouw s ILE 86 CO -0.09 -0.68 0.58 -0.94 0.24 0.00 0.00 174.94 174.05 1ouw s SER 87 N -2.68 -0.20 0.00 4.36 1.04 -0.92 -0.74 113.70 114.56 1ouw s SER 87 Ca 0.08 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.80 1ouw s SER 87 Cb 0.00 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.76 1ouw s SER 87 CO -0.02 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.61 1ouw n GLY 88 N -0.40 -0.54 3.07 7.32 0.00 -0.42 -0.52 105.19 113.70 1ouw n GLY 88 Ca -0.04 -0.83 -0.09 0.00 0.00 0.00 0.00 46.02 45.06 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 -3.31 0.15 -0.04 2.61 -4.23 -0.47 -0.96 115.64 109.39 1ouw s THR 89 Ca 0.00 -1.23 0.07 0.00 -1.18 0.00 0.00 61.69 59.35 1ouw s THR 89 Cb 0.00 -0.89 -0.02 0.00 1.34 0.00 0.00 72.50 72.93 1ouw s THR 89 CO 0.00 -0.68 -0.25 -0.36 -0.54 0.00 0.00 174.62 172.79 1ouw s PHE 90 N -2.65 2.41 0.00 3.99 0.40 -0.43 -0.42 117.98 121.28 1ouw s PHE 90 Ca -0.05 -0.59 -0.00 0.00 -0.60 0.00 0.00 56.93 55.69 1ouw s PHE 90 Cb -0.01 -1.56 0.00 0.00 0.51 0.00 0.00 43.02 41.96 1ouw s PHE 90 CO -0.05 -0.13 0.01 0.41 0.70 0.00 0.00 175.22 176.16 1ouw n GLY 91 N 2.72 0.82 3.71 4.36 0.00 -0.18 -0.51 105.19 116.11 1ouw n GLY 91 Ca -0.17 -0.86 -0.40 0.00 0.00 0.00 0.00 46.02 44.59 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 -2.27 4.99 -0.08 -0.61 1.01 -1.26 -1.05 121.20 121.94 1ouw s ILE 92 Ca 0.00 1.62 -0.01 0.00 0.00 0.00 0.00 60.65 62.26 1ouw s ILE 92 Cb -0.00 -4.12 0.03 0.00 0.01 0.00 0.00 42.46 38.38 1ouw s ILE 92 CO 0.00 0.22 -0.01 -0.47 0.00 0.00 0.00 174.94 174.69 1ouw s TYR 93 N 0.89 0.76 -1.51 3.97 5.04 -0.17 -4.86 117.35 121.48 1ouw s TYR 93 Ca 0.42 -0.25 -0.11 0.00 -2.44 0.00 0.00 57.07 54.69 1ouw s TYR 93 Cb -0.19 -0.85 0.07 0.00 0.35 0.00 0.00 41.96 41.34 1ouw s TYR 93 CO 0.21 -0.36 0.83 1.28 -1.34 0.00 0.00 175.55 176.18 1ouw n LEU 94 N 5.12 -2.46 -0.95 6.97 4.77 -1.26 -1.22 117.00 127.98 1ouw n LEU 94 Ca -0.08 -0.85 -0.12 0.00 -0.03 0.00 0.00 56.01 54.92 1ouw n LEU 94 Cb 0.50 -2.45 -0.05 0.00 -2.33 0.00 0.00 43.42 39.08 1ouw n LEU 94 CO 0.11 0.42 -0.12 0.47 -1.33 0.00 0.00 177.39 176.95 1ouw n ASP 95 N -2.86 -4.91 -4.46 -1.43 8.00 -1.26 -5.01 116.55 104.61 1ouw n ASP 95 Ca -0.05 0.31 -0.33 0.00 0.71 0.00 0.00 54.79 55.43 1ouw n ASP 95 Cb 0.57 -3.51 -0.13 0.00 -0.02 0.00 0.00 41.12 38.03 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 -2.68 4.01 -0.52 -2.24 0.01 -0.35 -5.08 114.94 108.08 1ouw s ASN 96 Ca 0.00 -0.22 -0.23 0.00 -0.71 0.00 0.00 52.86 51.70 1ouw s ASN 96 Cb 0.00 -0.96 0.04 0.00 0.41 0.00 0.00 41.25 40.74 1ouw s ASN 96 CO 0.00 0.32 0.84 0.21 -1.51 0.00 0.00 177.10 176.96 1ouw s ASN 97 N -0.56 6.32 0.27 -1.22 3.84 -1.26 -1.00 114.94 121.34 1ouw s ASN 97 Ca 0.08 -0.45 0.00 0.00 0.21 0.00 0.00 52.86 52.71 1ouw s ASN 97 Cb -0.11 -2.39 -0.03 0.00 -0.55 0.00 0.00 41.25 38.17 1ouw s ASN 97 CO 0.01 -1.09 0.28 0.68 -2.79 0.00 0.00 177.10 174.18 1ouw s VAL 98 N 3.52 0.00 0.14 -5.21 -7.23 -0.21 -4.82 120.40 106.58 1ouw s VAL 98 Ca 0.27 -1.87 -0.31 0.00 -1.81 0.00 0.00 61.98 58.25 1ouw s VAL 98 Cb -0.14 -2.49 -0.10 0.00 0.56 0.00 0.00 36.38 34.20 1ouw s VAL 98 CO 0.18 0.00 1.74 -0.22 -0.31 0.00 0.00 175.10 176.49 1ouw s LEU 99 N -3.23 4.38 -0.09 1.32 2.96 0.76 -1.01 118.68 123.77 1ouw s LEU 99 Ca 0.36 2.72 0.12 0.00 -0.22 0.00 0.00 54.13 57.11 1ouw s LEU 99 Cb 0.03 -3.58 -0.17 0.00 0.50 0.00 0.00 46.19 42.98 1ouw s LEU 99 CO 0.18 -0.96 0.11 0.54 -1.32 0.00 0.00 176.35 174.91 1ouw n ARG 100 N 5.09 1.54 -3.67 1.98 5.12 0.44 -4.64 116.66 122.52 1ouw n ARG 100 Ca 0.17 -0.04 -0.13 0.00 -1.93 0.00 0.00 57.85 55.92 1ouw n ARG 100 Cb 0.38 -1.31 -0.07 0.00 -1.16 0.00 0.00 32.46 30.30 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 -4.22 -0.29 -0.09 0.55 1.04 -1.08 -3.37 113.70 106.24 1ouw s SER 101 Ca -0.06 0.04 -0.16 0.00 0.48 0.00 0.00 55.95 56.26 1ouw s SER 101 Cb 0.05 0.42 0.04 0.00 0.10 0.00 0.00 66.02 66.62 1ouw s SER 101 CO 0.52 -0.64 0.39 -0.51 0.98 0.00 0.00 173.24 173.98 1ouw s ILE 102 N -2.30 0.02 -0.03 -1.02 2.07 -0.60 -1.37 121.20 117.97 1ouw s ILE 102 Ca -0.06 -0.18 0.06 0.00 -1.41 0.00 0.00 60.65 59.05 1ouw s ILE 102 Cb -0.01 -0.62 -0.01 0.00 0.13 0.00 0.00 42.46 41.95 1ouw s ILE 102 CO -0.01 -0.10 -0.21 -0.89 -1.91 0.00 0.00 174.94 171.82 1ouw s THR 103 N -0.49 1.71 -0.31 4.00 2.01 0.33 -0.59 115.64 122.29 1ouw s THR 103 Ca -0.06 -0.90 -0.05 0.00 0.31 0.00 0.00 61.69 60.99 1ouw s THR 103 Cb -0.04 -1.44 0.03 0.00 0.01 0.00 0.00 72.50 71.07 1ouw s THR 103 CO 0.03 0.48 0.07 -0.36 -0.69 0.00 0.00 174.62 174.15 1ouw s PHE 104 N -0.28 3.21 -0.10 4.92 0.08 -0.31 -2.16 117.98 123.35 1ouw s PHE 104 Ca 0.02 -1.38 -0.11 0.00 0.12 0.00 0.00 56.93 55.58 1ouw s PHE 104 Cb -0.10 -2.23 -0.05 0.00 -0.57 0.00 0.00 43.02 40.07 1ouw s PHE 104 CO 0.01 -0.70 0.24 0.99 -0.10 0.00 0.00 175.22 175.66 1ouw s THR 105 N 1.40 5.33 0.53 0.64 2.01 0.15 -0.80 115.64 124.90 1ouw s THR 105 Ca -0.01 0.45 0.02 0.00 0.31 0.00 0.00 61.69 62.46 1ouw s THR 105 Cb -0.19 -3.54 0.01 0.00 0.01 0.00 0.00 72.50 68.80 1ouw s THR 105 CO 0.02 0.55 0.14 0.42 -0.69 0.00 0.00 174.62 175.06 1ouw s THR 106 N -0.65 1.29 0.51 -0.82 -4.23 0.06 -0.52 115.64 111.28 1ouw s THR 106 Ca 0.17 -1.82 0.39 0.00 -1.18 0.00 0.00 61.69 59.25 1ouw s THR 106 Cb -0.13 -2.11 0.39 0.00 1.34 0.00 0.00 72.50 71.98 1ouw s THR 106 CO 0.06 0.00 2.20 -0.55 -0.54 0.00 0.00 174.62 175.79 1ouw h ASN 107 N 1.12 0.00 0.00 3.99 -1.07 -1.58 -3.18 115.58 114.85 1ouw h ASN 107 Ca -0.41 0.00 -0.34 0.00 0.07 0.00 0.00 56.30 55.62 1ouw h ASN 107 Cb 1.31 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 37.50 1ouw h ASN 107 CO 0.68 0.00 -2.28 0.18 0.07 0.00 0.00 177.43 176.08 1ouw n LEU 108 N -2.90 2.25 -3.63 6.14 4.77 -1.26 -5.05 117.00 117.32 1ouw n LEU 108 Ca -0.03 -0.09 -0.03 0.00 -0.03 0.00 0.00 56.01 55.83 1ouw n LEU 108 Cb 0.10 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 40.68 1ouw n LEU 108 CO 0.17 0.78 0.86 -1.59 -1.33 0.00 0.00 177.39 176.28 1ouw s LYS 109 N -2.45 0.71 -0.02 3.23 -2.85 -1.20 -5.14 119.74 112.03 1ouw s LYS 109 Ca -0.25 -0.35 -0.23 0.00 -1.00 0.00 0.00 55.97 54.14 1ouw s LYS 109 Cb 0.07 0.27 -0.05 0.00 -2.06 0.00 0.00 37.83 36.07 1ouw s LYS 109 CO 0.58 -0.32 0.68 0.00 0.10 0.00 0.00 175.35 176.39 1ouw s ALA 110 N -2.84 3.40 -0.19 0.59 0.00 -1.26 -0.76 121.76 120.70 1ouw s ALA 110 Ca 0.11 0.14 -0.04 0.00 0.00 0.00 0.00 51.96 52.16 1ouw s ALA 110 Cb 0.01 -2.89 -0.02 0.00 0.00 0.00 0.00 23.12 20.21 1ouw s ALA 110 CO -0.03 0.03 -0.03 -1.01 0.00 0.00 0.00 175.76 174.72 1ouw s HIS 111 N 0.23 2.99 -1.71 0.00 3.76 0.02 -4.98 115.29 115.59 1ouw s HIS 111 Ca 0.35 -0.56 0.00 0.00 -0.15 0.00 0.00 55.06 54.70 1ouw s HIS 111 Cb -0.19 -2.03 0.00 0.00 1.11 0.00 0.00 32.58 31.47 1ouw s HIS 111 CO 0.19 -0.27 0.00 0.41 -0.85 0.00 0.00 174.74 174.22 1ouw n GLY 112 N 4.14 0.64 3.77 -2.22 0.00 -1.26 -1.16 105.19 109.10 1ouw n GLY 112 Ca -0.18 -2.10 -0.37 0.00 0.00 0.00 0.00 46.02 43.38 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 -0.69 3.83 -0.42 1.61 0.04 -1.26 -5.06 135.00 133.05 1ouw s PRO 113 Ca 0.00 1.74 -0.12 0.00 0.04 0.00 0.00 61.00 62.65 1ouw s PRO 113 Cb 0.00 -2.44 0.06 0.00 0.04 0.00 0.00 34.50 32.16 1ouw s PRO 113 CO 0.00 -0.48 0.29 0.71 0.04 0.00 0.00 177.00 177.56 1ouw s TYR 114 N -1.56 3.27 0.00 0.56 1.51 0.24 -4.94 117.35 116.43 1ouw s TYR 114 Ca 0.62 -1.07 0.00 0.00 -1.01 0.00 0.00 57.07 55.61 1ouw s TYR 114 Cb -0.28 -2.84 0.00 0.00 -0.11 0.00 0.00 41.96 38.74 1ouw s TYR 114 CO 0.34 -0.75 0.00 0.41 -1.11 0.00 0.00 175.55 174.44 1ouw n GLY 115 N 5.06 1.73 3.90 0.71 0.00 -1.26 -1.55 105.19 113.77 1ouw n GLY 115 Ca -0.11 -2.02 -0.31 0.00 0.00 0.00 0.00 46.02 43.57 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 -2.11 3.65 -1.21 1.61 -0.21 -1.22 -4.81 119.66 115.37 1ouw s GLN 116 Ca 0.00 -0.02 -0.21 0.00 0.02 0.00 0.00 55.36 55.16 1ouw s GLN 116 Cb 0.00 -2.77 0.01 0.00 1.00 0.00 0.00 33.01 31.24 1ouw s GLN 116 CO 0.00 0.39 1.78 0.21 -2.12 0.00 0.00 175.29 175.56 1ouw s LYS 117 N -2.87 3.36 0.02 2.91 2.47 -1.26 -4.27 119.74 120.10 1ouw s LYS 117 Ca 0.43 -1.52 0.01 0.00 -1.56 0.00 0.00 55.97 53.32 1ouw s LYS 117 Cb -0.12 -5.39 -0.01 0.00 -1.46 0.00 0.00 37.83 30.85 1ouw s LYS 117 CO 0.25 -2.89 -0.03 0.14 0.16 0.00 0.00 175.35 172.97 1ouw s VAL 118 N 6.92 0.20 0.00 4.02 -7.23 -1.26 -5.11 120.40 117.94 1ouw s VAL 118 Ca 0.59 -0.66 0.00 0.00 -1.81 0.00 0.00 61.98 60.10 1ouw s VAL 118 Cb 0.01 -0.28 0.00 0.00 0.56 0.00 0.00 36.38 36.68 1ouw s VAL 118 CO 0.07 -0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 1ouw n GLY 119 N 2.06 -1.71 3.69 2.32 0.00 -1.26 -4.43 105.19 105.86 1ouw n GLY 119 Ca -0.20 -1.77 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 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 5.26 0.51 2.61 2.01 0.33 -4.81 115.64 121.55 1ouw s THR 120 Ca 0.00 0.59 -0.19 0.00 0.31 0.00 0.00 61.69 62.41 1ouw s THR 120 Cb 0.00 -3.67 -0.07 0.00 0.01 0.00 0.00 72.50 68.77 1ouw s THR 120 CO 0.00 0.31 1.03 -2.16 -0.69 0.00 0.00 174.62 173.11 1ouw s PRO 121 N 0.98 3.73 0.07 4.92 0.04 -1.26 -1.31 135.00 142.17 1ouw s PRO 121 Ca 0.17 1.25 0.01 0.00 0.04 0.00 0.00 61.00 62.47 1ouw s PRO 121 Cb -0.14 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 1ouw s PRO 121 CO 0.06 -0.48 -0.06 -0.59 0.04 0.00 0.00 177.00 175.98 1ouw s PHE 122 N -2.19 0.71 -0.18 0.56 -0.71 -0.13 -4.94 117.98 111.10 1ouw s PHE 122 Ca 0.65 -0.85 -0.16 0.00 -1.04 0.00 0.00 56.93 55.53 1ouw s PHE 122 Cb -0.15 -0.44 0.05 0.00 -1.21 0.00 0.00 43.02 41.27 1ouw s PHE 122 CO 0.25 -0.20 0.47 0.45 -1.34 0.00 0.00 175.22 174.85 1ouw s SER 123 N -2.63 -0.49 0.95 1.98 0.15 -1.26 -1.30 113.70 111.10 1ouw s SER 123 Ca 0.05 0.95 -0.12 0.00 0.70 0.00 0.00 55.95 57.52 1ouw s SER 123 Cb 0.02 0.96 0.16 0.00 -1.71 0.00 0.00 66.02 65.46 1ouw s SER 123 CO -0.05 -0.16 1.11 -0.94 1.20 0.00 0.00 173.24 174.40 1ouw s SER 124 N 0.26 3.06 -0.34 5.45 1.04 0.08 -5.00 113.70 118.25 1ouw s SER 124 Ca -0.00 1.08 -0.18 0.00 0.48 0.00 0.00 55.95 57.32 1ouw s SER 124 Cb -0.03 -1.70 -0.01 0.00 0.10 0.00 0.00 66.02 64.38 1ouw s SER 124 CO 0.01 -2.84 0.53 0.00 0.98 0.00 0.00 173.24 171.92 1ouw s ALA 125 N -3.12 3.49 -0.35 5.32 0.00 -1.26 -4.85 121.76 120.99 1ouw s ALA 125 Ca 0.64 -0.93 -0.27 0.00 0.00 0.00 0.00 51.96 51.40 1ouw s ALA 125 Cb -0.17 -3.03 0.02 0.00 0.00 0.00 0.00 23.12 19.94 1ouw s ALA 125 CO 0.55 -1.18 0.98 -0.80 0.00 0.00 0.00 175.76 175.31 1ouw s ASN 126 N 1.74 6.77 0.00 0.00 0.01 -1.26 -4.93 114.94 117.26 1ouw s ASN 126 Ca 0.20 0.75 0.00 0.00 -0.71 0.00 0.00 52.86 53.10 1ouw s ASN 126 Cb -0.15 -2.49 0.00 0.00 0.41 0.00 0.00 41.25 39.01 1ouw s ASN 126 CO 0.13 -0.87 0.00 0.55 -1.51 0.00 0.00 177.10 175.40 1ouw n VAL 127 N 5.95 0.00 0.00 1.60 3.14 -1.26 -5.11 118.33 122.64 1ouw n VAL 127 Ca 0.09 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.47 1ouw n VAL 127 Cb 0.48 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.26 1ouw n VAL 127 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1ouw n ASN 130 N 0.00 -0.34 -4.09 6.55 2.85 -1.26 -5.00 115.26 113.97 1ouw n ASN 130 Ca 0.00 0.00 -0.25 0.00 -0.11 0.00 0.00 54.58 54.22 1ouw n ASN 130 Cb 0.00 0.73 -0.16 0.00 1.24 0.00 0.00 39.78 41.59 1ouw n ASN 130 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 1ouw s GLU 131 N -4.81 1.70 -0.16 1.20 2.12 -0.46 -4.71 118.70 113.58 1ouw s GLU 131 Ca 0.00 -0.53 -0.29 0.00 0.36 0.00 0.00 54.97 54.51 1ouw s GLU 131 Cb 0.00 -1.45 -0.01 0.00 0.26 0.00 0.00 34.13 32.93 1ouw s GLU 131 CO 0.00 0.17 1.11 0.42 -0.54 0.00 0.00 175.26 176.42 1ouw s ILE 132 N 0.24 4.54 -0.77 -3.70 1.01 -0.03 -1.59 121.20 120.89 1ouw s ILE 132 Ca -0.07 1.85 0.06 0.00 0.00 0.00 0.00 60.65 62.49 1ouw s ILE 132 Cb -0.12 -4.19 0.07 0.00 0.01 0.00 0.00 42.46 38.22 1ouw s ILE 132 CO 0.03 -0.11 0.78 1.33 0.00 0.00 0.00 174.94 176.97 1ouw n VAL 133 N 5.07 0.16 -3.82 2.92 0.24 -0.10 -4.50 118.33 118.30 1ouw n VAL 133 Ca 0.12 -0.58 0.04 0.00 -2.04 0.00 0.00 64.34 61.88 1ouw n VAL 133 Cb 0.46 1.04 0.01 0.00 -1.47 0.00 0.00 33.84 33.88 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 -0.62 -0.32 0.08 7.63 0.00 -1.21 -4.17 107.32 108.71 1ouw s GLY 134 Ca 0.09 0.47 0.03 0.00 0.00 0.00 0.00 44.72 45.30 1ouw s GLY 134 CO 0.08 3.67 -0.09 -1.36 0.00 0.00 0.00 173.10 175.40 1ouw s PHE 135 N -2.06 0.91 0.21 1.90 0.08 -0.17 -1.29 117.98 117.56 1ouw s PHE 135 Ca 0.24 -0.68 -0.09 0.00 0.12 0.00 0.00 56.93 56.52 1ouw s PHE 135 Cb 0.03 -0.51 -0.01 0.00 -0.57 0.00 0.00 43.02 41.95 1ouw s PHE 135 CO -0.04 -0.07 0.34 -0.48 -0.10 0.00 0.00 175.22 174.88 1ouw s LEU 136 N -2.36 0.69 0.00 -0.37 2.34 -0.91 -0.50 118.68 117.58 1ouw s LEU 136 Ca 0.03 -1.02 0.00 0.00 0.06 0.00 0.00 54.13 53.19 1ouw s LEU 136 Cb -0.03 1.28 0.00 0.00 -0.56 0.00 0.00 46.19 46.88 1ouw s LEU 136 CO -0.01 -1.00 0.00 0.61 -1.06 0.00 0.00 176.35 174.89 1ouw n GLY 137 N -0.31 -0.57 3.12 -3.48 0.00 -0.28 0.07 105.19 103.75 1ouw n GLY 137 Ca -0.02 -0.74 -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 -1.05 0.70 0.16 1.61 0.52 -0.65 -1.11 118.95 119.13 1ouw s ARG 138 Ca 0.00 -0.96 -0.23 0.00 -0.52 0.00 0.00 55.73 54.02 1ouw s ARG 138 Cb 0.00 -0.45 0.06 0.00 0.52 0.00 0.00 34.95 35.08 1ouw s ARG 138 CO 0.00 0.08 0.69 -1.54 0.02 0.00 0.00 175.30 174.55 1ouw s SER 139 N -1.98 -0.45 0.00 0.23 1.04 0.19 -1.06 113.70 111.68 1ouw s SER 139 Ca -0.02 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.24 1ouw s SER 139 Cb -0.07 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.65 1ouw s SER 139 CO 0.00 -1.01 0.00 0.61 0.98 0.00 0.00 173.24 173.83 1ouw n GLY 140 N -0.39 1.89 0.21 7.32 0.00 -1.26 -0.76 105.19 112.20 1ouw n GLY 140 Ca -0.12 0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.02 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 0.01 -3.62 1.61 -1.99 -1.91 -1.96 116.97 109.10 1ouw h TYR 141 Ca 0.00 -0.00 -0.24 0.00 2.00 0.00 0.00 58.73 60.48 1ouw h TYR 141 Cb 0.00 -0.00 -0.06 0.00 2.00 0.00 0.00 36.73 38.67 1ouw h TYR 141 CO 0.00 0.26 -0.22 0.66 -0.00 0.00 0.00 178.16 178.86 1ouw n TYR 142 N -4.25 -0.13 -3.42 4.88 4.01 -1.26 -0.93 117.16 116.06 1ouw n TYR 142 Ca -0.02 -1.26 -0.41 0.00 -0.16 0.00 0.00 57.90 56.05 1ouw n TYR 142 Cb 0.30 0.06 -0.10 0.00 -0.31 0.00 0.00 39.34 39.29 1ouw n TYR 142 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1ouw s VAL 143 N -2.42 5.19 -0.04 -0.72 1.01 -1.26 -4.19 120.40 117.97 1ouw s VAL 143 Ca 0.14 -0.03 0.13 0.00 0.00 0.00 0.00 61.98 62.21 1ouw s VAL 143 Cb 0.01 -3.81 -0.21 0.00 0.00 0.00 0.00 36.38 32.36 1ouw s VAL 143 CO 0.10 -0.10 0.75 0.44 0.00 0.00 0.00 175.10 176.29 1ouw h ASP 144 N 8.48 0.00 -5.00 3.32 5.19 -1.41 0.22 116.42 127.22 1ouw h ASP 144 Ca -0.30 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.05 1ouw h ASP 144 Cb 1.14 0.00 -0.18 0.00 0.18 0.00 0.00 39.33 40.47 1ouw h ASP 144 CO 0.69 0.94 0.15 0.00 -3.12 0.00 0.00 179.24 177.89 1ouw s ALA 145 N -2.65 -1.64 -0.12 3.45 0.00 -0.83 -0.99 121.76 118.98 1ouw s ALA 145 Ca -0.04 1.08 -0.11 0.00 0.00 0.00 0.00 51.96 52.90 1ouw s ALA 145 Cb 0.08 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.38 1ouw s ALA 145 CO 0.82 -0.43 0.31 -1.50 0.00 0.00 0.00 175.76 174.96 1ouw s ILE 146 N -1.64 -0.00 0.13 0.00 2.07 -0.10 -1.64 121.20 120.02 1ouw s ILE 146 Ca -0.09 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.17 1ouw s ILE 146 Cb -0.01 -0.43 -0.01 0.00 0.13 0.00 0.00 42.46 42.15 1ouw s ILE 146 CO 0.06 0.00 0.13 0.61 -1.91 0.00 0.00 174.94 173.83 1ouw n GLY 147 N 2.92 3.30 3.25 1.50 0.00 0.11 -0.83 105.19 115.46 1ouw n GLY 147 Ca -0.13 -1.65 -0.19 0.00 0.00 0.00 0.00 46.02 44.06 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 -2.53 1.41 -0.09 2.61 -4.23 -0.50 -2.13 115.64 110.19 1ouw s THR 148 Ca 0.13 -1.72 -0.05 0.00 -1.18 0.00 0.00 61.69 58.88 1ouw s THR 148 Cb 0.00 -1.56 -0.04 0.00 1.34 0.00 0.00 72.50 72.24 1ouw s THR 148 CO 0.10 -0.38 0.11 -0.31 -0.54 0.00 0.00 174.62 173.60 1ouw s TYR 149 N -2.05 3.47 0.03 3.99 2.02 -0.41 -1.14 117.35 123.25 1ouw s TYR 149 Ca 0.09 0.40 0.04 0.00 -0.37 0.00 0.00 57.07 57.24 1ouw s TYR 149 Cb -0.05 -1.87 -0.02 0.00 -0.40 0.00 0.00 41.96 39.61 1ouw s TYR 149 CO 0.04 0.65 -0.12 -0.80 -1.57 0.00 0.00 175.55 173.75 1ouw s ASN 150 N -1.18 1.38 -0.18 2.29 0.01 -0.01 -0.92 114.94 116.34 1ouw s ASN 150 Ca 0.17 -0.39 -0.17 0.00 -0.71 0.00 0.00 52.86 51.76 1ouw s ASN 150 Cb -0.12 -0.09 0.05 0.00 0.41 0.00 0.00 41.25 41.50 1ouw s ASN 150 CO 0.06 0.02 0.48 -0.60 -1.51 0.00 0.00 177.10 175.55 1ouw s ARG 151 N -0.96 0.57 0.00 -0.60 3.52 -0.62 -3.21 118.95 117.65 1ouw s ARG 151 Ca 0.00 0.65 0.10 0.00 -0.13 0.00 0.00 55.73 56.35 1ouw s ARG 151 Cb -0.07 0.28 0.59 0.00 -1.56 0.00 0.00 34.95 34.18 1ouw s ARG 151 CO 0.01 -0.07 1.03 1.58 -0.81 0.00 0.00 175.30 177.03