#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ruk s VAL 2 N 0.00 3.99 -0.16 2.53 1.01 -1.26 -5.01 120.40 121.49 1ruk s VAL 2 Ca 0.00 1.42 -0.15 0.00 0.00 0.00 0.00 61.98 63.25 1ruk s VAL 2 Cb 0.00 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1ruk s VAL 2 CO 0.00 0.10 0.35 -0.69 0.00 0.00 0.00 175.10 174.85 1ruk s VAL 3 N 1.18 5.27 -0.26 2.92 1.01 -1.26 -4.79 120.40 124.48 1ruk s VAL 3 Ca 0.59 0.65 -0.04 0.00 0.00 0.00 0.00 61.98 63.18 1ruk s VAL 3 Cb -0.30 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.41 1ruk s VAL 3 CO 0.29 0.36 -0.00 -0.04 0.00 0.00 0.00 175.10 175.70 1ruk s MET 4 N 0.63 3.11 -0.24 2.72 -1.94 -1.26 -0.91 119.30 121.41 1ruk s MET 4 Ca 0.19 -0.81 -0.03 0.00 -1.71 0.00 0.00 55.69 53.32 1ruk s MET 4 Cb -0.14 -3.14 0.01 0.00 2.01 0.00 0.00 34.83 33.57 1ruk s MET 4 CO 0.06 -0.35 -0.04 0.99 -0.01 0.00 0.00 175.02 175.67 1ruk s THR 5 N 1.44 3.24 -0.10 2.05 2.01 0.05 -4.01 115.64 120.32 1ruk s THR 5 Ca 0.03 -0.72 -0.05 0.00 0.31 0.00 0.00 61.69 61.26 1ruk s THR 5 Cb -0.16 -2.56 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 1ruk s THR 5 CO -0.01 0.30 0.11 -1.10 -0.69 0.00 0.00 174.62 173.23 1ruk s GLN 6 N 1.42 3.33 0.03 4.92 -0.21 -1.26 -0.93 119.66 126.97 1ruk s GLN 6 Ca 0.03 -0.22 -0.01 0.00 0.02 0.00 0.00 55.36 55.19 1ruk s GLN 6 Cb -0.15 -3.09 -0.03 0.00 1.00 0.00 0.00 33.01 30.74 1ruk s GLN 6 CO -0.03 0.75 -0.03 -1.54 -2.12 0.00 0.00 175.29 172.32 1ruk s SER 7 N -1.11 0.35 0.99 5.90 1.04 -0.29 -4.48 113.70 116.10 1ruk s SER 7 Ca 0.16 -0.73 -0.15 0.00 0.48 0.00 0.00 55.95 55.72 1ruk s SER 7 Cb -0.12 0.15 0.19 0.00 0.10 0.00 0.00 66.02 66.33 1ruk s SER 7 CO 0.05 -0.44 1.17 -2.16 0.98 0.00 0.00 173.24 172.84 1ruk s PRO 8 N -2.58 0.47 0.23 4.02 0.04 -1.26 -1.09 135.00 134.83 1ruk s PRO 8 Ca -0.05 0.08 -0.05 0.00 0.04 0.00 0.00 61.00 61.01 1ruk s PRO 8 Cb -0.02 -1.78 0.22 0.00 0.04 0.00 0.00 34.50 32.97 1ruk s PRO 8 CO -0.05 -2.61 1.74 -0.22 0.04 0.00 0.00 177.00 175.90 1ruk h LYS 9 N -1.79 0.98 -3.82 4.56 3.64 -1.86 -3.42 116.57 114.86 1ruk h LYS 9 Ca -0.48 -0.24 -0.14 0.00 -1.27 0.00 0.00 60.65 58.51 1ruk h LYS 9 Cb 1.30 -0.13 -0.19 0.00 -0.41 0.00 0.00 32.23 32.81 1ruk h LYS 9 CO 0.51 0.91 -0.58 0.95 -2.27 0.00 0.00 179.45 178.96 1ruk s THR 10 N -5.17 0.12 -0.08 1.00 -4.23 -1.26 -1.34 115.64 104.67 1ruk s THR 10 Ca -0.11 -1.00 -0.07 0.00 -1.18 0.00 0.00 61.69 59.33 1ruk s THR 10 Cb 0.15 -0.64 0.02 0.00 1.34 0.00 0.00 72.50 73.37 1ruk s THR 10 CO 0.83 -0.55 0.21 -0.51 -0.54 0.00 0.00 174.62 174.06 1ruk s ILE 11 N -2.07 -0.00 -0.17 2.99 2.07 -0.27 -4.92 121.20 118.84 1ruk s ILE 11 Ca -0.10 0.01 0.01 0.00 -1.41 0.00 0.00 60.65 59.16 1ruk s ILE 11 Cb -0.05 -0.30 0.02 0.00 0.13 0.00 0.00 42.46 42.26 1ruk s ILE 11 CO -0.02 0.00 -0.20 -0.55 -1.91 0.00 0.00 174.94 172.26 1ruk s SER 12 N 0.18 3.07 -0.02 4.50 0.15 -1.26 -0.39 113.70 119.93 1ruk s SER 12 Ca -0.01 -0.62 0.02 0.00 0.70 0.00 0.00 55.95 56.05 1ruk s SER 12 Cb -0.02 -1.43 0.00 0.00 -1.71 0.00 0.00 66.02 62.86 1ruk s SER 12 CO -0.00 0.02 -0.09 -0.69 1.20 0.00 0.00 173.24 173.68 1ruk s VAL 13 N 1.18 0.72 0.26 4.45 1.01 -0.26 -4.82 120.40 122.94 1ruk s VAL 13 Ca 0.02 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.35 1ruk s VAL 13 Cb -0.14 -0.63 -0.09 0.00 0.00 0.00 0.00 36.38 35.52 1ruk s VAL 13 CO -0.10 0.22 1.00 -0.89 0.00 0.00 0.00 175.10 175.34 1ruk s THR 14 N 0.07 3.84 0.16 3.92 2.01 -1.26 -0.86 115.64 123.52 1ruk s THR 14 Ca -0.01 1.84 -0.34 0.00 0.31 0.00 0.00 61.69 63.50 1ruk s THR 14 Cb -0.07 -4.17 -0.15 0.00 0.01 0.00 0.00 72.50 68.12 1ruk s THR 14 CO 0.00 0.43 1.33 -0.38 -0.69 0.00 0.00 174.62 175.31 1ruk n ILE 15 N 1.33 0.54 0.00 1.82 5.41 -1.26 -1.32 119.36 125.88 1ruk n ILE 15 Ca -0.01 -0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.60 1ruk n ILE 15 Cb 0.46 -1.09 0.00 0.00 -0.71 0.00 0.00 39.64 38.31 1ruk n ILE 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ruk n GLY 16 N 2.39 1.88 3.93 7.39 0.00 0.38 -4.93 105.19 116.24 1ruk n GLY 16 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1ruk n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ruk s GLN 17 N -0.82 3.33 0.63 1.61 -1.52 -0.44 -4.46 119.66 117.99 1ruk s GLN 17 Ca 0.00 -0.19 -0.11 0.00 -1.95 0.00 0.00 55.36 53.11 1ruk s GLN 17 Cb 0.00 -2.51 -0.03 0.00 -0.22 0.00 0.00 33.01 30.24 1ruk s GLN 17 CO 0.00 -0.15 1.03 -1.25 -0.25 0.00 0.00 175.29 174.67 1ruk s PRO 18 N -4.57 3.52 0.03 2.91 0.04 -1.24 -0.62 135.00 135.06 1ruk s PRO 18 Ca 0.46 0.77 0.03 0.00 0.04 0.00 0.00 61.00 62.30 1ruk s PRO 18 Cb -0.10 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.35 1ruk s PRO 18 CO 0.40 -0.63 -0.09 0.00 0.04 0.00 0.00 177.00 176.72 1ruk s ALA 19 N -3.16 0.69 -0.02 8.56 0.00 -0.59 -4.90 121.76 122.34 1ruk s ALA 19 Ca 0.55 -0.60 -0.01 0.00 0.00 0.00 0.00 51.96 51.91 1ruk s ALA 19 Cb -0.11 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 22.96 1ruk s ALA 19 CO 0.54 0.09 0.04 0.45 0.00 0.00 0.00 175.76 176.88 1ruk s SER 20 N -0.96 0.01 0.04 0.00 0.15 -1.26 -0.64 113.70 111.04 1ruk s SER 20 Ca -0.03 0.08 0.02 0.00 0.70 0.00 0.00 55.95 56.72 1ruk s SER 20 Cb -0.07 0.01 -0.02 0.00 -1.71 0.00 0.00 66.02 64.23 1ruk s SER 20 CO 0.00 -0.09 -0.07 0.27 1.20 0.00 0.00 173.24 174.55 1ruk s ILE 21 N 0.73 0.50 -0.01 6.45 -4.36 -0.14 -4.83 121.20 119.54 1ruk s ILE 21 Ca -0.06 -1.09 0.04 0.00 -0.26 0.00 0.00 60.65 59.29 1ruk s ILE 21 Cb -0.08 -0.60 -0.03 0.00 1.25 0.00 0.00 42.46 43.00 1ruk s ILE 21 CO -0.02 -0.41 -0.14 -0.55 0.24 0.00 0.00 174.94 174.06 1ruk s SER 22 N -1.61 4.10 -0.08 4.36 0.15 -0.25 -0.90 113.70 119.46 1ruk s SER 22 Ca -0.10 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.31 1ruk s SER 22 Cb -0.10 -0.83 0.02 0.00 -1.71 0.00 0.00 66.02 63.40 1ruk s SER 22 CO 0.00 0.31 -0.07 0.00 1.20 0.00 0.00 173.24 174.68 1ruk s LYS 24 N 1.38 3.05 0.15 0.00 1.02 -0.11 -0.40 119.74 124.84 1ruk s LYS 24 Ca -0.02 -0.86 -0.04 0.00 0.02 0.00 0.00 55.97 55.07 1ruk s LYS 24 Cb -0.14 -2.36 -0.05 0.00 -0.52 0.00 0.00 37.83 34.76 1ruk s LYS 24 CO -0.04 0.11 0.37 0.45 -0.92 0.00 0.00 175.35 175.33 1ruk s SER 25 N 0.51 6.46 0.22 2.83 0.15 -0.00 -0.77 113.70 123.09 1ruk s SER 25 Ca -0.15 0.54 0.25 0.00 0.70 0.00 0.00 55.95 57.30 1ruk s SER 25 Cb -0.17 -2.07 0.87 0.00 -1.71 0.00 0.00 66.02 62.94 1ruk s SER 25 CO 0.05 0.03 1.76 -1.54 1.20 0.00 0.00 173.24 174.75 1ruk n SER 26 N -0.07 0.74 -4.09 5.45 3.41 -0.08 -4.79 113.62 114.20 1ruk n SER 26 Ca -0.03 0.60 -0.11 0.00 -0.26 0.00 0.00 58.87 59.07 1ruk n SER 26 Cb 0.52 -0.79 -0.11 0.00 -0.26 0.00 0.00 64.21 63.58 1ruk n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1ruk s GLN 27 N -3.16 0.60 0.00 4.33 -0.21 -1.26 -4.96 119.66 114.99 1ruk s GLN 27 Ca 0.09 -0.97 0.00 0.00 0.02 0.00 0.00 55.36 54.49 1ruk s GLN 27 Cb 0.12 -0.13 0.00 0.00 1.00 0.00 0.00 33.01 33.99 1ruk s GLN 27 CO 0.53 -0.01 0.00 0.54 -2.12 0.00 0.00 175.29 174.23 1ruk n ARG 27 N 0.84 -0.08 -1.33 2.91 1.74 -1.26 -4.72 116.66 114.75 1ruk n ARG 27 Ca -0.19 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 1ruk n ARG 27 Cb 0.57 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.01 1ruk n ARG 27 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1ruk n LEU 27 N 0.00 -1.06 0.00 0.55 7.94 -1.26 -4.96 117.00 118.21 1ruk n LEU 27 Ca 0.00 1.49 0.00 0.00 -1.11 0.00 0.00 56.01 56.39 1ruk n LEU 27 Cb 0.00 -2.33 0.00 0.00 0.53 0.00 0.00 43.42 41.62 1ruk n LEU 27 CO 0.00 0.21 0.00 -0.46 -1.11 0.00 0.00 177.39 176.03 1ruk n ASN 27 N -0.94 0.86 -0.05 1.96 6.94 0.55 -4.98 115.26 119.59 1ruk n ASN 27 Ca 0.00 -0.90 0.15 0.00 -0.02 0.00 0.00 54.58 53.81 1ruk n ASN 27 Cb 0.00 0.00 0.79 0.00 -2.36 0.00 0.00 39.78 38.21 1ruk n ASN 27 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1ruk n SER 27 N -1.93 0.19 -0.24 0.53 7.64 -1.26 -3.16 113.62 115.39 1ruk n SER 27 Ca 0.00 -0.66 0.04 0.00 1.01 0.00 0.00 58.87 59.26 1ruk n SER 27 Cb 0.00 -0.11 0.09 0.00 -1.01 0.00 0.00 64.21 63.18 1ruk n SER 27 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1ruk n ASN 28 N -1.01 2.46 0.00 6.43 5.03 -1.26 -4.99 115.26 121.93 1ruk n ASN 28 Ca 0.19 -2.33 0.00 0.00 0.87 0.00 0.00 54.58 53.30 1ruk n ASN 28 Cb 0.20 -0.20 0.00 0.00 -1.02 0.00 0.00 39.78 38.77 1ruk n ASN 28 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ruk n GLY 29 N -0.48 0.69 3.86 7.41 0.00 -1.19 -5.05 105.19 110.44 1ruk n GLY 29 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1ruk n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ruk s LYS 30 N -0.06 3.78 -0.33 1.61 1.02 -1.26 -4.82 119.74 119.68 1ruk s LYS 30 Ca 0.00 0.20 -0.01 0.00 0.02 0.00 0.00 55.97 56.18 1ruk s LYS 30 Cb 0.00 -3.00 0.07 0.00 -0.52 0.00 0.00 37.83 34.38 1ruk s LYS 30 CO 0.00 0.56 0.04 0.99 -0.92 0.00 0.00 175.35 176.03 1ruk s THR 31 N -1.39 2.88 -1.37 2.17 2.01 -1.26 -0.33 115.64 118.35 1ruk s THR 31 Ca 0.33 -1.70 -0.16 0.00 0.31 0.00 0.00 61.69 60.47 1ruk s THR 31 Cb -0.14 -2.80 0.06 0.00 0.01 0.00 0.00 72.50 69.63 1ruk s THR 31 CO 0.18 -0.31 1.95 0.49 -0.69 0.00 0.00 174.62 176.24 1ruk n PHE 32 N 4.55 4.13 -4.06 4.92 3.72 -1.26 -2.86 117.46 126.60 1ruk n PHE 32 Ca -0.08 -2.92 -0.31 0.00 -0.05 0.00 0.00 57.45 54.09 1ruk n PHE 32 Cb 0.43 -2.57 -0.16 0.00 -0.94 0.00 0.00 39.48 36.24 1ruk n PHE 32 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1ruk s LEU 33 N 3.11 1.99 0.14 4.37 1.98 -1.26 -0.65 118.68 128.36 1ruk s LEU 33 Ca 0.50 -0.63 0.09 0.00 -2.89 0.00 0.00 54.13 51.21 1ruk s LEU 33 Cb 0.08 -1.31 -0.04 0.00 0.66 0.00 0.00 46.19 45.58 1ruk s LEU 33 CO 0.00 -0.05 -0.17 0.20 -1.89 0.00 0.00 176.35 174.44 1ruk s ASN 34 N 1.39 3.88 -0.02 3.68 -0.87 -0.37 -0.93 114.94 121.69 1ruk s ASN 34 Ca 0.04 -0.62 0.04 0.00 -1.57 0.00 0.00 52.86 50.75 1ruk s ASN 34 Cb -0.14 -0.53 -0.03 0.00 -0.02 0.00 0.00 41.25 40.54 1ruk s ASN 34 CO -0.11 0.15 -0.13 0.26 -2.57 0.00 0.00 177.10 174.70 1ruk s TRP 35 N -1.35 2.72 0.08 2.20 0.52 -0.47 -0.94 118.94 121.71 1ruk s TRP 35 Ca 0.20 -0.14 0.03 0.00 0.02 0.00 0.00 56.10 56.21 1ruk s TRP 35 Cb -0.10 -1.59 -0.03 0.00 -1.15 0.00 0.00 33.47 30.60 1ruk s TRP 35 CO 0.11 0.26 -0.10 -0.51 0.02 0.00 0.00 176.95 176.73 1ruk s LEU 36 N -1.07 2.36 -0.07 2.99 1.02 0.22 -1.69 118.68 122.44 1ruk s LEU 36 Ca 0.14 -0.74 0.04 0.00 0.02 0.00 0.00 54.13 53.59 1ruk s LEU 36 Cb -0.11 -0.29 -0.01 0.00 0.02 0.00 0.00 46.19 45.80 1ruk s LEU 36 CO 0.03 -0.24 -0.20 -0.22 0.02 0.00 0.00 176.35 175.74 1ruk s LEU 37 N -2.20 2.34 -0.33 1.79 2.96 -0.16 -0.73 118.68 122.35 1ruk s LEU 37 Ca 0.02 -0.41 -0.04 0.00 -0.22 0.00 0.00 54.13 53.48 1ruk s LEU 37 Cb -0.05 -1.46 0.06 0.00 0.50 0.00 0.00 46.19 45.24 1ruk s LEU 37 CO 0.00 0.25 0.08 -1.58 -1.32 0.00 0.00 176.35 173.77 1ruk s GLN 38 N -0.15 2.43 0.57 1.98 0.74 0.65 -0.57 119.66 125.30 1ruk s GLN 38 Ca -0.03 -1.34 -0.14 0.00 0.05 0.00 0.00 55.36 53.90 1ruk s GLN 38 Cb -0.14 -3.36 -0.06 0.00 1.10 0.00 0.00 33.01 30.56 1ruk s GLN 38 CO 0.04 -0.72 1.01 1.03 -0.55 0.00 0.00 175.29 176.10 1ruk s ARG 39 N 1.29 3.72 0.16 1.67 0.52 -1.26 -0.92 118.95 124.13 1ruk s ARG 39 Ca -0.02 0.91 -0.34 0.00 -0.52 0.00 0.00 55.73 55.77 1ruk s ARG 39 Cb -0.20 -2.10 -0.14 0.00 0.52 0.00 0.00 34.95 33.03 1ruk s ARG 39 CO -0.00 -0.47 1.58 -2.30 0.02 0.00 0.00 175.30 174.13 1ruk n PRO 40 N -2.09 2.16 -1.09 3.54 -0.02 -1.26 -1.64 135.00 134.60 1ruk n PRO 40 Ca 0.07 0.78 -0.03 0.00 -2.02 0.00 0.00 63.50 62.29 1ruk n PRO 40 Cb 0.54 -2.55 -0.01 0.00 -0.02 0.00 0.00 33.50 31.46 1ruk n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ruk n GLY 41 N 3.41 0.54 3.62 -1.23 0.00 -1.26 -5.00 105.19 105.27 1ruk n GLY 41 Ca 0.17 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 1ruk n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ruk s GLN 42 N -1.55 2.01 0.67 1.61 -0.21 -0.65 -5.13 119.66 116.40 1ruk s GLN 42 Ca 0.00 -1.91 -0.13 0.00 0.02 0.00 0.00 55.36 53.35 1ruk s GLN 42 Cb 0.00 -1.81 -0.00 0.00 1.00 0.00 0.00 33.01 32.20 1ruk s GLN 42 CO 0.00 0.05 1.07 -1.12 -2.12 0.00 0.00 175.29 173.17 1ruk s SER 43 N -3.72 5.39 0.53 5.90 0.01 -1.26 -4.62 113.70 115.94 1ruk s SER 43 Ca 0.35 1.75 -0.22 0.00 1.31 0.00 0.00 55.95 59.14 1ruk s SER 43 Cb 0.04 -2.52 -0.06 0.00 0.21 0.00 0.00 66.02 63.69 1ruk s SER 43 CO 0.19 -1.43 1.25 -2.65 0.41 0.00 0.00 173.24 171.00 1ruk n PRO 44 N -2.73 1.53 -4.11 12.44 -0.02 -1.26 -4.48 135.00 136.37 1ruk n PRO 44 Ca 0.08 0.56 -0.14 0.00 -2.02 0.00 0.00 63.50 61.99 1ruk n PRO 44 Cb 0.53 -2.43 -0.11 0.00 -0.02 0.00 0.00 33.50 31.47 1ruk n PRO 44 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1ruk s LYS 45 N -2.72 0.67 0.59 -0.52 1.02 0.27 -4.95 119.74 114.10 1ruk s LYS 45 Ca 0.71 -0.91 -0.19 0.00 0.02 0.00 0.00 55.97 55.60 1ruk s LYS 45 Cb -0.44 -0.45 -0.03 0.00 -0.52 0.00 0.00 37.83 36.39 1ruk s LYS 45 CO 0.50 0.08 1.25 -0.98 -0.92 0.00 0.00 175.35 175.28 1ruk s ARG 46 N -1.97 2.95 0.19 1.68 1.70 -1.26 -0.98 118.95 121.25 1ruk s ARG 46 Ca -0.04 1.94 0.00 0.00 -0.47 0.00 0.00 55.73 57.16 1ruk s ARG 46 Cb -0.08 -1.99 0.00 0.00 -0.57 0.00 0.00 34.95 32.31 1ruk s ARG 46 CO 0.00 -1.26 0.00 1.28 -1.08 0.00 0.00 175.30 174.25 1ruk n LEU 47 N -1.51 0.12 -4.17 -1.89 4.77 -0.68 -4.73 117.00 108.91 1ruk n LEU 47 Ca 0.13 0.31 -0.23 0.00 -0.03 0.00 0.00 56.01 56.19 1ruk n LEU 47 Cb 0.48 0.17 -0.14 0.00 -2.33 0.00 0.00 43.42 41.60 1ruk n LEU 47 CO 0.46 -0.72 -0.49 -0.63 -1.33 0.00 0.00 177.39 174.69 1ruk s ILE 48 N -1.75 1.33 0.20 -0.08 -1.09 -0.99 -0.67 121.20 118.14 1ruk s ILE 48 Ca 0.00 -0.92 -0.01 0.00 -2.23 0.00 0.00 60.65 57.50 1ruk s ILE 48 Cb 0.00 -1.15 -0.04 0.00 -1.58 0.00 0.00 42.46 39.69 1ruk s ILE 48 CO 0.00 0.21 0.11 -0.72 -1.23 0.00 0.00 174.94 173.32 1ruk s TYR 49 N -0.63 1.20 -1.46 3.97 1.13 0.01 -1.37 117.35 120.20 1ruk s TYR 49 Ca 0.05 -1.33 -0.01 0.00 -1.41 0.00 0.00 57.07 54.37 1ruk s TYR 49 Cb -0.07 -0.61 0.01 0.00 -1.10 0.00 0.00 41.96 40.18 1ruk s TYR 49 CO 0.01 -0.57 0.10 1.28 -2.51 0.00 0.00 175.55 173.86 1ruk n LEU 50 N -0.28 -1.72 0.00 -3.49 4.77 -1.13 -1.03 117.00 114.11 1ruk n LEU 50 Ca 0.01 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1ruk n LEU 50 Cb 0.66 -2.61 0.00 0.00 -2.33 0.00 0.00 43.42 39.14 1ruk n LEU 50 CO 0.34 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1ruk n GLY 51 N -1.01 1.10 0.00 -0.72 0.00 -0.11 -4.33 105.19 100.11 1ruk n GLY 51 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1ruk n GLY 51 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ruk n THR 52 N 0.00 0.16 -4.31 2.61 -2.24 -1.15 -3.95 114.28 105.39 1ruk n THR 52 Ca 0.00 -0.28 -0.35 0.00 -2.27 0.00 0.00 64.05 61.16 1ruk n THR 52 Cb 0.00 1.27 -0.10 0.00 -2.10 0.00 0.00 70.33 69.40 1ruk n THR 52 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1ruk s LYS 53 N -0.16 3.30 0.07 -0.78 2.20 -0.20 -4.54 119.74 119.63 1ruk s LYS 53 Ca 0.00 -0.42 -0.31 0.00 -0.36 0.00 0.00 55.97 54.89 1ruk s LYS 53 Cb 0.00 -2.89 -0.07 0.00 -1.51 0.00 0.00 37.83 33.36 1ruk s LYS 53 CO 0.00 0.54 1.46 -1.17 -0.36 0.00 0.00 175.35 175.81 1ruk s LEU 54 N -0.42 4.35 0.87 5.43 2.96 -1.26 -0.81 118.68 129.80 1ruk s LEU 54 Ca 0.08 2.29 -0.13 0.00 -0.22 0.00 0.00 54.13 56.15 1ruk s LEU 54 Cb -0.12 -3.57 0.12 0.00 0.50 0.00 0.00 46.19 43.12 1ruk s LEU 54 CO 0.02 -0.73 1.19 -0.62 -1.32 0.00 0.00 176.35 174.89 1ruk s ASP 55 N 1.65 3.95 0.12 3.68 -1.08 0.15 -4.83 116.67 120.31 1ruk s ASP 55 Ca 0.66 0.73 -0.31 0.00 -0.52 0.00 0.00 52.55 53.11 1ruk s ASP 55 Cb -0.36 -1.15 -0.10 0.00 -1.46 0.00 0.00 42.92 39.86 1ruk s ASP 55 CO 0.29 -2.25 1.72 -0.55 0.52 0.00 0.00 175.17 174.90 1ruk s SER 56 N -4.50 6.51 0.00 -0.34 0.15 -1.26 -2.12 113.70 112.14 1ruk s SER 56 Ca 0.65 2.65 0.00 0.00 0.70 0.00 0.00 55.95 59.95 1ruk s SER 56 Cb -0.11 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1ruk s SER 56 CO 0.51 -0.93 0.00 0.61 1.20 0.00 0.00 173.24 174.62 1ruk n GLY 57 N 4.06 1.36 3.73 9.45 0.00 -1.26 -5.01 105.19 117.52 1ruk n GLY 57 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1ruk n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ruk s VAL 58 N -3.61 4.21 0.41 1.61 1.01 -0.90 -4.98 120.40 118.14 1ruk s VAL 58 Ca 0.00 1.83 -0.25 0.00 0.00 0.00 0.00 61.98 63.56 1ruk s VAL 58 Cb 0.00 -4.17 -0.11 0.00 0.00 0.00 0.00 36.38 32.11 1ruk s VAL 58 CO 0.00 0.28 1.16 -2.65 0.00 0.00 0.00 175.10 173.88 1ruk n PRO 59 N 2.74 1.68 0.00 2.72 -0.02 -1.26 -4.86 135.00 136.00 1ruk n PRO 59 Ca 0.03 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1ruk n PRO 59 Cb 0.48 -2.21 0.01 0.00 -0.02 0.00 0.00 33.50 31.75 1ruk n PRO 59 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1ruk n ASP 60 N 0.43 0.00 0.09 2.55 5.68 -1.26 -2.77 116.55 121.27 1ruk n ASP 60 Ca 0.08 -1.64 0.11 0.00 -0.50 0.00 0.00 54.79 52.84 1ruk n ASP 60 Cb 0.39 0.00 0.45 0.00 -1.14 0.00 0.00 41.12 40.82 1ruk n ASP 60 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1ruk n ARG 61 N -0.50 0.16 -3.54 0.11 1.74 -1.26 -4.67 116.66 108.69 1ruk n ARG 61 Ca 0.00 0.31 -0.36 0.00 -0.77 0.00 0.00 57.85 57.02 1ruk n ARG 61 Cb 0.00 -1.75 -0.07 0.00 -1.02 0.00 0.00 32.46 29.61 1ruk n ARG 61 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1ruk s PHE 62 N -3.18 3.43 -0.05 -1.55 0.08 -1.11 -1.16 117.98 114.44 1ruk s PHE 62 Ca 0.07 0.55 0.04 0.00 0.12 0.00 0.00 56.93 57.70 1ruk s PHE 62 Cb 0.11 -2.34 0.00 0.00 -0.57 0.00 0.00 43.02 40.22 1ruk s PHE 62 CO 0.43 0.20 -0.16 0.99 -0.10 0.00 0.00 175.22 176.58 1ruk s THR 63 N 0.61 1.33 -0.08 0.64 2.01 -0.27 -4.92 115.64 114.96 1ruk s THR 63 Ca 0.15 -0.64 -0.00 0.00 0.31 0.00 0.00 61.69 61.51 1ruk s THR 63 Cb -0.13 -1.16 -0.03 0.00 0.01 0.00 0.00 72.50 71.19 1ruk s THR 63 CO 0.04 0.39 -0.06 -0.83 -0.69 0.00 0.00 174.62 173.47 1ruk s GLY 64 N 0.22 1.72 0.19 4.40 0.00 -1.26 -0.73 107.32 111.86 1ruk s GLY 64 Ca -0.07 -0.87 -0.01 0.00 0.00 0.00 0.00 44.72 43.77 1ruk s GLY 64 CO 0.03 -0.59 0.10 -1.35 0.00 0.00 0.00 173.10 171.29 1ruk s SER 65 N -0.68 0.35 0.00 1.64 1.04 0.05 -4.36 113.70 111.75 1ruk s SER 65 Ca 0.10 -1.33 0.00 0.00 0.48 0.00 0.00 55.95 55.21 1ruk s SER 65 Cb -0.11 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.33 1ruk s SER 65 CO 0.02 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.06 1ruk n GLY 66 N -0.24 -0.58 3.64 7.32 0.00 -1.26 -0.73 105.19 113.33 1ruk n GLY 66 Ca -0.01 -2.26 -0.03 0.00 0.00 0.00 0.00 46.02 43.73 1ruk n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ruk s SER 67 N -1.34 -0.16 1.03 1.61 1.04 -1.09 -4.91 113.70 109.88 1ruk s SER 67 Ca 0.00 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.26 1ruk s SER 67 Cb 0.00 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.42 1ruk s SER 67 CO 0.00 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.31 1ruk n GLY 68 N -0.37 1.16 0.04 7.32 0.00 -1.26 -2.43 105.19 109.64 1ruk n GLY 68 Ca -0.06 0.28 0.01 0.00 0.00 0.00 0.00 46.02 46.25 1ruk n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ruk n THR 69 N 0.00 0.00 -4.06 2.61 -2.24 -1.26 -4.45 114.28 104.87 1ruk n THR 69 Ca 0.00 -0.48 -0.32 0.00 -2.27 0.00 0.00 64.05 60.98 1ruk n THR 69 Cb 0.00 1.02 -0.16 0.00 -2.10 0.00 0.00 70.33 69.09 1ruk n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ruk s ASP 70 N -0.59 3.52 0.10 3.42 1.11 -1.02 -0.82 116.67 122.39 1ruk s ASP 70 Ca 0.01 -0.90 0.08 0.00 0.18 0.00 0.00 52.55 51.92 1ruk s ASP 70 Cb 0.01 -1.41 -0.03 0.00 1.07 0.00 0.00 42.92 42.56 1ruk s ASP 70 CO 0.04 -0.10 -0.21 -0.36 1.18 0.00 0.00 175.17 175.73 1ruk s PHE 71 N 1.28 1.78 -0.01 4.23 0.08 0.46 -2.68 117.98 123.12 1ruk s PHE 71 Ca -0.00 -0.42 0.02 0.00 0.12 0.00 0.00 56.93 56.65 1ruk s PHE 71 Cb -0.16 -0.98 -0.00 0.00 -0.57 0.00 0.00 43.02 41.31 1ruk s PHE 71 CO -0.09 0.20 -0.07 0.99 -0.10 0.00 0.00 175.22 176.14 1ruk s THR 72 N -1.14 0.61 -0.16 0.64 2.01 0.09 -0.87 115.64 116.81 1ruk s THR 72 Ca 0.06 -0.30 -0.04 0.00 0.31 0.00 0.00 61.69 61.72 1ruk s THR 72 Cb -0.10 -0.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.85 1ruk s THR 72 CO 0.04 0.18 -0.03 -0.22 -0.69 0.00 0.00 174.62 173.91 1ruk s LEU 73 N -0.01 3.26 0.00 4.42 2.96 -0.08 -0.77 118.68 128.46 1ruk s LEU 73 Ca 0.01 -0.14 0.08 0.00 -0.22 0.00 0.00 54.13 53.86 1ruk s LEU 73 Cb -0.05 -1.79 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1ruk s LEU 73 CO -0.00 0.15 -0.25 -0.54 -1.32 0.00 0.00 176.35 174.39 1ruk s LYS 74 N 0.49 1.91 -0.22 1.98 1.02 0.10 -0.96 119.74 124.05 1ruk s LYS 74 Ca -0.03 -0.94 -0.02 0.00 0.02 0.00 0.00 55.97 55.00 1ruk s LYS 74 Cb -0.14 -1.91 0.01 0.00 -0.52 0.00 0.00 37.83 35.26 1ruk s LYS 74 CO 0.03 0.52 -0.09 0.42 -0.92 0.00 0.00 175.35 175.30 1ruk s ILE 75 N -0.65 2.94 0.15 2.17 1.01 0.19 -1.11 121.20 125.89 1ruk s ILE 75 Ca 0.10 -0.71 -0.14 0.00 0.00 0.00 0.00 60.65 59.90 1ruk s ILE 75 Cb -0.10 -2.35 0.02 0.00 0.01 0.00 0.00 42.46 40.05 1ruk s ILE 75 CO -0.00 0.41 1.67 0.77 0.00 0.00 0.00 174.94 177.79 1ruk h SER 76 N 8.05 0.71 -2.56 3.58 4.64 -1.43 -1.56 113.55 124.99 1ruk h SER 76 Ca -0.41 -0.21 -0.22 0.00 -0.47 0.00 0.00 61.79 60.48 1ruk h SER 76 Cb 1.14 -0.19 -0.32 0.00 -0.31 0.00 0.00 62.40 62.73 1ruk h SER 76 CO 0.61 0.73 -0.53 0.00 -0.87 0.00 0.00 176.83 176.77 1ruk s ARG 77 N -5.39 0.21 0.25 4.77 1.70 -1.26 -3.62 118.95 115.61 1ruk s ARG 77 Ca -0.13 0.60 -0.30 0.00 -0.47 0.00 0.00 55.73 55.43 1ruk s ARG 77 Cb 0.11 -0.38 -0.09 0.00 -0.57 0.00 0.00 34.95 34.02 1ruk s ARG 77 CO 0.78 -0.44 1.17 0.08 -1.08 0.00 0.00 175.30 175.81 1ruk s VAL 78 N 2.44 3.42 0.18 4.99 1.01 0.20 -4.77 120.40 127.86 1ruk s VAL 78 Ca 0.05 1.32 0.09 0.00 0.00 0.00 0.00 61.98 63.43 1ruk s VAL 78 Cb -0.14 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 1ruk s VAL 78 CO -0.11 0.27 -0.08 -1.61 0.00 0.00 0.00 175.10 173.57 1ruk s GLU 79 N -0.98 2.12 0.47 2.72 2.02 -1.26 -0.47 118.70 123.33 1ruk s GLU 79 Ca 0.49 -1.24 0.17 0.00 0.02 0.00 0.00 54.97 54.40 1ruk s GLU 79 Cb -0.33 -2.19 1.15 0.00 0.10 0.00 0.00 34.13 32.85 1ruk s GLU 79 CO 0.41 0.44 2.01 0.00 0.02 0.00 0.00 175.26 178.14 1ruk h ALA 80 N 2.86 2.12 0.00 5.21 0.00 -1.97 -0.28 119.26 127.20 1ruk h ALA 80 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1ruk h ALA 80 Cb 1.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ruk h ALA 80 CO 0.55 -0.23 0.00 0.39 0.00 0.00 0.00 179.25 179.96 1ruk n GLU 81 N -4.46 0.62 0.00 0.00 1.02 -1.26 -2.04 120.64 114.51 1ruk n GLU 81 Ca 0.07 0.02 0.14 0.00 -0.02 0.00 0.00 57.16 57.38 1ruk n GLU 81 Cb 0.37 -1.50 0.66 0.00 -0.02 0.00 0.00 31.44 30.95 1ruk n GLU 81 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1ruk n ASP 82 N -1.11 0.07 -4.75 1.62 8.00 -0.11 -4.91 116.55 115.36 1ruk n ASP 82 Ca 0.16 0.08 -0.33 0.00 0.71 0.00 0.00 54.79 55.41 1ruk n ASP 82 Cb 0.13 -0.33 0.07 0.00 -0.02 0.00 0.00 41.12 40.97 1ruk n ASP 82 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 1ruk s LEU 83 N -2.77 3.33 0.00 0.64 0.05 -0.87 -4.88 118.68 114.19 1ruk s LEU 83 Ca 0.22 2.15 0.00 0.00 0.05 0.00 0.00 54.13 56.54 1ruk s LEU 83 Cb 0.20 -4.57 0.00 0.00 -2.05 0.00 0.00 46.19 39.77 1ruk s LEU 83 CO 0.50 -1.95 0.00 0.61 -0.55 0.00 0.00 176.35 174.96 1ruk n GLY 84 N -0.13 0.85 3.37 -3.48 0.00 -1.01 -4.60 105.19 100.19 1ruk n GLY 84 Ca 0.12 -1.82 -0.34 0.00 0.00 0.00 0.00 46.02 43.98 1ruk n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ruk s VAL 85 N -2.87 3.31 -0.13 1.61 1.01 -0.10 -0.61 120.40 122.64 1ruk s VAL 85 Ca 0.00 -0.55 -0.14 0.00 0.00 0.00 0.00 61.98 61.29 1ruk s VAL 85 Cb 0.00 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.89 1ruk s VAL 85 CO 0.00 0.49 0.33 -0.31 0.00 0.00 0.00 175.10 175.61 1ruk s TYR 86 N 0.72 3.52 0.10 5.22 1.51 0.00 -0.26 117.35 128.17 1ruk s TYR 86 Ca -0.04 0.70 0.10 0.00 -1.01 0.00 0.00 57.07 56.82 1ruk s TYR 86 Cb -0.15 -2.34 -0.04 0.00 -0.11 0.00 0.00 41.96 39.32 1ruk s TYR 86 CO 0.02 0.32 -0.25 0.71 -1.11 0.00 0.00 175.55 175.24 1ruk s TYR 87 N 0.15 2.20 0.21 2.71 2.02 0.09 -0.92 117.35 123.80 1ruk s TYR 87 Ca 0.19 -0.39 0.05 0.00 -0.37 0.00 0.00 57.07 56.55 1ruk s TYR 87 Cb -0.14 -1.22 -0.04 0.00 -0.40 0.00 0.00 41.96 40.16 1ruk s TYR 87 CO 0.06 0.26 0.23 0.00 -1.57 0.00 0.00 175.55 174.53 1ruk s TRP 89 N -1.92 -0.18 -0.04 0.00 -0.00 -0.11 -0.80 118.94 115.88 1ruk s TRP 89 Ca 0.33 0.44 0.05 0.00 -0.00 0.00 0.00 56.10 56.92 1ruk s TRP 89 Cb -0.09 0.06 -0.02 0.00 -0.00 0.00 0.00 33.47 33.42 1ruk s TRP 89 CO 0.26 -0.09 -0.18 1.14 -0.00 0.00 0.00 176.95 178.08 1ruk s GLN 90 N 0.08 2.41 -0.02 5.86 1.03 -0.01 -1.24 119.66 127.76 1ruk s GLN 90 Ca -0.00 -0.76 0.06 0.00 0.04 0.00 0.00 55.36 54.70 1ruk s GLN 90 Cb -0.01 -2.28 0.17 0.00 0.03 0.00 0.00 33.01 30.92 1ruk s GLN 90 CO 0.00 0.60 1.14 0.41 -2.54 0.00 0.00 175.29 174.90 1ruk n GLY 91 N 2.37 3.08 0.11 2.60 0.00 0.17 -2.94 105.19 110.58 1ruk n GLY 91 Ca -0.17 -0.28 -0.16 0.00 0.00 0.00 0.00 46.02 45.41 1ruk n GLY 91 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ruk h THR 92 N 0.92 1.05 -3.14 2.61 2.02 -1.96 -3.46 112.91 110.96 1ruk h THR 92 Ca 0.00 -2.74 -0.67 0.00 0.77 0.00 0.00 66.41 63.77 1ruk h THR 92 Cb 0.68 2.67 -0.34 0.00 -1.74 0.00 0.00 68.15 69.42 1ruk h THR 92 CO 0.01 0.78 -0.84 -1.00 0.37 0.00 0.00 175.52 174.84 1ruk s HIS 93 N -2.61 2.79 0.44 3.16 3.76 -1.26 -5.06 115.29 116.51 1ruk s HIS 93 Ca -0.10 -1.48 -0.23 0.00 -0.15 0.00 0.00 55.06 53.10 1ruk s HIS 93 Cb 0.07 -1.93 -0.08 0.00 1.11 0.00 0.00 32.58 31.75 1ruk s HIS 93 CO 0.83 -0.73 1.15 0.12 -0.85 0.00 0.00 174.74 175.26 1ruk s PHE 94 N 1.23 2.95 0.48 1.40 2.19 -1.26 -3.54 117.98 121.43 1ruk s PHE 94 Ca 0.03 1.55 -0.20 0.00 0.33 0.00 0.00 56.93 58.64 1ruk s PHE 94 Cb -0.14 -3.35 -0.09 0.00 -1.31 0.00 0.00 43.02 38.14 1ruk s PHE 94 CO -0.10 -1.36 1.02 -1.25 1.83 0.00 0.00 175.22 175.37 1ruk s PRO 95 N -2.62 3.88 0.36 10.12 0.04 -1.26 -4.87 135.00 140.66 1ruk s PRO 95 Ca 0.62 1.30 -0.27 0.00 0.04 0.00 0.00 61.00 62.70 1ruk s PRO 95 Cb -0.28 -2.11 -0.09 0.00 0.04 0.00 0.00 34.50 32.06 1ruk s PRO 95 CO 0.34 -0.35 1.20 0.71 0.04 0.00 0.00 177.00 178.94 1ruk s TYR 96 N -2.04 3.13 0.06 0.56 2.02 -1.23 -4.66 117.35 115.18 1ruk s TYR 96 Ca 0.66 1.53 0.01 0.00 -0.37 0.00 0.00 57.07 58.91 1ruk s TYR 96 Cb -0.15 -3.46 -0.03 0.00 -0.40 0.00 0.00 41.96 37.92 1ruk s TYR 96 CO 0.19 -1.38 -0.06 0.95 -1.57 0.00 0.00 175.55 173.69 1ruk s THR 97 N -1.30 0.44 0.04 -0.71 -4.23 -1.15 -4.99 115.64 103.74 1ruk s THR 97 Ca 0.53 -1.43 0.03 0.00 -1.18 0.00 0.00 61.69 59.64 1ruk s THR 97 Cb -0.34 -1.02 -0.04 0.00 1.34 0.00 0.00 72.50 72.45 1ruk s THR 97 CO 0.43 -0.66 -0.02 -0.36 -0.54 0.00 0.00 174.62 173.47 1ruk s PHE 98 N -2.52 2.99 1.00 3.99 0.40 -1.26 -0.83 117.98 121.74 1ruk s PHE 98 Ca -0.02 0.00 -0.12 0.00 -0.60 0.00 0.00 56.93 56.20 1ruk s PHE 98 Cb -0.02 -1.59 0.19 0.00 0.51 0.00 0.00 43.02 42.11 1ruk s PHE 98 CO -0.03 0.45 1.08 0.20 0.70 0.00 0.00 175.22 177.62 1ruk s GLY 99 N -1.87 1.61 0.00 4.36 0.00 0.02 -4.57 107.32 106.88 1ruk s GLY 99 Ca 0.22 0.06 0.30 0.00 0.00 0.00 0.00 44.72 45.29 1ruk s GLY 99 CO 0.13 0.62 2.00 0.61 0.00 0.00 0.00 173.10 176.46 1ruk n GLY 100 N -0.13 -0.71 0.00 0.20 0.00 -1.26 -4.75 105.19 98.54 1ruk n GLY 100 Ca 0.07 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1ruk n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ruk n GLY 101 N 1.12 1.10 3.03 -0.02 0.00 -1.26 -5.04 105.19 104.12 1ruk n GLY 101 Ca 0.20 -1.60 -0.28 0.00 0.00 0.00 0.00 46.02 44.34 1ruk n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ruk s THR 102 N -2.09 1.44 -0.23 2.61 2.01 -0.10 -4.77 115.64 114.50 1ruk s THR 102 Ca 0.00 -0.59 -0.15 0.00 0.31 0.00 0.00 61.69 61.26 1ruk s THR 102 Cb 0.00 -1.33 -0.04 0.00 0.01 0.00 0.00 72.50 71.14 1ruk s THR 102 CO 0.00 0.43 0.38 -0.75 -0.69 0.00 0.00 174.62 173.99 1ruk s LYS 103 N 1.15 4.12 -0.23 4.92 2.20 -0.45 -0.82 119.74 130.63 1ruk s LYS 103 Ca -0.03 0.14 -0.16 0.00 -0.36 0.00 0.00 55.97 55.55 1ruk s LYS 103 Cb -0.14 -3.58 -0.04 0.00 -1.51 0.00 0.00 37.83 32.57 1ruk s LYS 103 CO -0.04 -0.12 0.40 -1.17 -0.36 0.00 0.00 175.35 174.07 1ruk s LEU 104 N 1.56 4.10 -0.06 5.43 2.96 0.22 -1.11 118.68 131.78 1ruk s LEU 104 Ca 0.17 0.43 0.02 0.00 -0.22 0.00 0.00 54.13 54.53 1ruk s LEU 104 Cb -0.15 -2.50 -0.03 0.00 0.50 0.00 0.00 46.19 44.02 1ruk s LEU 104 CO 0.08 -0.14 -0.09 -1.61 -1.32 0.00 0.00 176.35 173.28 1ruk s GLU 105 N 1.69 2.67 -0.12 1.98 2.02 0.48 -2.41 118.70 125.01 1ruk s GLU 105 Ca 0.18 -0.60 -0.18 0.00 0.02 0.00 0.00 54.97 54.38 1ruk s GLU 105 Cb -0.15 -2.53 -0.04 0.00 0.10 0.00 0.00 34.13 31.50 1ruk s GLU 105 CO 0.09 0.65 0.49 0.42 0.02 0.00 0.00 175.26 176.93 1ruk s ILE 106 N -0.81 5.18 -0.00 -1.63 -1.09 -1.26 -1.10 121.20 120.48 1ruk s ILE 106 Ca 0.13 0.98 -0.24 0.00 -2.23 0.00 0.00 60.65 59.29 1ruk s ILE 106 Cb -0.11 -3.83 -0.05 0.00 -1.58 0.00 0.00 42.46 36.89 1ruk s ILE 106 CO 0.02 0.31 0.73 -0.75 -1.23 0.00 0.00 174.94 174.02 1ruk s LYS 107 N 0.71 4.46 0.33 2.79 2.20 -0.04 -4.83 119.74 125.35 1ruk s LYS 107 Ca 0.26 0.98 0.03 0.00 -0.36 0.00 0.00 55.97 56.88 1ruk s LYS 107 Cb -0.15 -3.40 -0.02 0.00 -1.51 0.00 0.00 37.83 32.75 1ruk s LYS 107 CO 0.11 0.19 0.36 -0.98 -0.36 0.00 0.00 175.35 174.67 1ruk s ARG 108 N 0.30 1.81 0.46 4.03 1.70 -1.26 -4.39 118.95 121.61 1ruk s ARG 108 Ca 0.38 -1.90 -0.23 0.00 -0.47 0.00 0.00 55.73 53.51 1ruk s ARG 108 Cb -0.19 0.37 -0.07 0.00 -0.57 0.00 0.00 34.95 34.49 1ruk s ARG 108 CO 0.21 -0.71 1.19 0.00 -1.08 0.00 0.00 175.30 174.91 1ruk s ALA 109 N -3.29 2.97 0.45 7.88 0.00 -1.26 -4.95 121.76 123.56 1ruk s ALA 109 Ca 0.36 0.99 -0.24 0.00 0.00 0.00 0.00 51.96 53.07 1ruk s ALA 109 Cb 0.01 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.63 1ruk s ALA 109 CO 0.24 -0.73 1.08 -0.25 0.00 0.00 0.00 175.76 176.10 1ruk n ASP 110 N -0.50 1.59 -3.90 0.00 9.92 -1.26 -4.78 116.55 117.61 1ruk n ASP 110 Ca 0.07 1.03 -0.16 0.00 -0.53 0.00 0.00 54.79 55.20 1ruk n ASP 110 Cb 0.47 -1.40 -0.15 0.00 -0.64 0.00 0.00 41.12 39.40 1ruk n ASP 110 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ruk s ALA 111 N -1.28 0.39 0.49 2.24 0.00 0.83 -4.90 121.76 119.53 1ruk s ALA 111 Ca 0.64 -0.07 -0.20 0.00 0.00 0.00 0.00 51.96 52.34 1ruk s ALA 111 Cb -0.52 -0.20 -0.08 0.00 0.00 0.00 0.00 23.12 22.32 1ruk s ALA 111 CO 0.56 0.03 1.02 0.00 0.00 0.00 0.00 175.76 177.37 1ruk s ALA 112 N 0.34 2.90 0.52 0.00 0.00 -1.26 -1.67 121.76 122.59 1ruk s ALA 112 Ca -0.03 0.52 -0.20 0.00 0.00 0.00 0.00 51.96 52.24 1ruk s ALA 112 Cb -0.07 -3.22 -0.06 0.00 0.00 0.00 0.00 23.12 19.76 1ruk s ALA 112 CO -0.01 -0.29 1.12 -1.25 0.00 0.00 0.00 175.76 175.33 1ruk s PRO 113 N -3.39 3.48 -0.29 0.00 0.04 -1.26 -4.51 135.00 129.06 1ruk s PRO 113 Ca 0.65 1.59 -0.16 0.00 0.04 0.00 0.00 61.00 63.12 1ruk s PRO 113 Cb -0.15 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.30 1ruk s PRO 113 CO 0.22 -0.74 0.43 0.99 0.04 0.00 0.00 177.00 177.93 1ruk s THR 114 N -1.78 5.12 -0.15 1.26 2.01 0.03 -4.83 115.64 117.31 1ruk s THR 114 Ca 0.71 0.51 -0.04 0.00 0.31 0.00 0.00 61.69 63.18 1ruk s THR 114 Cb -0.23 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.45 1ruk s THR 114 CO 0.27 0.03 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.53 1ruk s VAL 115 N 2.18 4.16 -0.04 3.82 1.01 -1.26 -0.69 120.40 129.58 1ruk s VAL 115 Ca 0.16 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.89 1ruk s VAL 115 Cb -0.16 -2.82 0.02 0.00 0.00 0.00 0.00 36.38 33.42 1ruk s VAL 115 CO 0.11 0.51 -0.04 -0.44 0.00 0.00 0.00 175.10 175.24 1ruk s SER 116 N 0.13 0.79 0.05 3.32 0.01 -0.40 -4.97 113.70 112.63 1ruk s SER 116 Ca 0.01 -0.11 0.06 0.00 1.31 0.00 0.00 55.95 57.22 1ruk s SER 116 Cb -0.13 -0.37 -0.03 0.00 0.21 0.00 0.00 66.02 65.70 1ruk s SER 116 CO 0.02 -0.05 -0.14 -0.51 0.41 0.00 0.00 173.24 172.97 1ruk s ILE 117 N 0.81 3.09 -0.07 1.44 2.07 -1.26 -0.92 121.20 126.36 1ruk s ILE 117 Ca -0.10 -1.11 -0.00 0.00 -1.41 0.00 0.00 60.65 58.02 1ruk s ILE 117 Cb -0.13 -2.34 0.02 0.00 0.13 0.00 0.00 42.46 40.14 1ruk s ILE 117 CO -0.00 0.30 -0.03 -0.36 -1.91 0.00 0.00 174.94 172.94 1ruk s PHE 118 N -1.00 0.87 0.97 3.50 0.40 0.64 -5.00 117.98 118.37 1ruk s PHE 118 Ca 0.16 -0.29 -0.11 0.00 -0.60 0.00 0.00 56.93 56.09 1ruk s PHE 118 Cb -0.11 -0.83 0.17 0.00 0.51 0.00 0.00 43.02 42.77 1ruk s PHE 118 CO 0.07 -0.30 1.09 -2.14 0.70 0.00 0.00 175.22 174.64 1ruk s PRO 119 N 1.47 0.61 0.48 0.24 0.02 -1.26 -2.02 135.00 134.54 1ruk s PRO 119 Ca -0.02 1.04 -0.24 0.00 0.02 0.00 0.00 61.00 61.80 1ruk s PRO 119 Cb -0.13 -1.72 -0.07 0.00 0.02 0.00 0.00 34.50 32.60 1ruk s PRO 119 CO -0.03 -2.75 1.42 -2.14 -0.33 0.00 0.00 177.00 173.17 1ruk s PRO 120 N -4.72 3.49 0.64 5.54 0.02 -1.15 -4.81 135.00 134.01 1ruk s PRO 120 Ca 0.66 2.39 -0.16 0.00 0.02 0.00 0.00 61.00 63.91 1ruk s PRO 120 Cb -0.21 -2.53 -0.01 0.00 0.02 0.00 0.00 34.50 31.77 1ruk s PRO 120 CO 0.59 -0.97 1.12 -1.54 -0.33 0.00 0.00 177.00 175.88 1ruk s SER 121 N -0.61 5.16 0.38 2.53 1.04 -1.26 -4.91 113.70 116.02 1ruk s SER 121 Ca 0.65 2.06 0.07 0.00 0.48 0.00 0.00 55.95 59.20 1ruk s SER 121 Cb -0.43 -2.56 0.79 0.00 0.10 0.00 0.00 66.02 63.92 1ruk s SER 121 CO 0.55 -1.60 1.99 0.77 0.98 0.00 0.00 173.24 175.93 1ruk h SER 122 N 0.23 0.59 -0.49 7.02 4.64 -1.99 -1.76 113.55 121.79 1ruk h SER 122 Ca -0.47 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.81 1ruk h SER 122 Cb 1.25 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 63.19 1ruk h SER 122 CO 0.54 0.40 0.19 -0.33 -0.87 0.00 0.00 176.83 176.76 1ruk h GLU 123 N 0.68 0.73 -0.41 4.77 3.07 -2.01 -2.43 114.58 118.99 1ruk h GLU 123 Ca 0.26 -0.13 -0.09 0.00 -0.50 0.00 0.00 59.36 58.90 1ruk h GLU 123 Cb 0.18 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.96 1ruk h GLU 123 CO -0.08 0.66 -0.09 0.37 -1.40 0.00 0.00 179.01 178.47 1ruk h GLN 124 N 0.65 0.72 0.00 2.33 4.15 -1.78 -2.37 115.11 118.82 1ruk h GLN 124 Ca 0.16 -0.23 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 1ruk h GLN 124 Cb 0.20 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.82 1ruk h GLN 124 CO -0.01 0.80 -0.12 -0.07 -1.93 0.00 0.00 178.83 177.50 1ruk h LEU 125 N 0.66 0.00 -0.23 -2.39 3.38 -0.99 0.14 115.31 115.88 1ruk h LEU 125 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1ruk h LEU 125 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1ruk h LEU 125 CO 0.03 0.12 0.00 0.35 0.09 0.00 0.00 178.44 179.03 1ruk n THR 126 N -3.69 0.72 0.26 0.22 -2.24 -0.89 -3.39 114.28 105.26 1ruk n THR 126 Ca -0.02 0.12 0.12 0.00 -2.27 0.00 0.00 64.05 62.00 1ruk n THR 126 Cb 0.23 -0.91 0.14 0.00 -2.10 0.00 0.00 70.33 67.69 1ruk n THR 126 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1ruk h SER 127 N 0.00 0.00 0.00 3.42 4.64 -0.77 -3.48 113.55 117.36 1ruk h SER 127 Ca 0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1ruk h SER 127 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1ruk h SER 127 CO 0.00 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1ruk n GLY 128 N 1.17 2.66 3.66 -0.77 0.00 -1.22 -5.06 105.19 105.64 1ruk n GLY 128 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1ruk n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ruk s GLY 129 N -2.73 2.13 -0.21 -0.02 0.00 -1.25 -0.61 107.32 104.64 1ruk s GLY 129 Ca 0.00 -2.00 -0.05 0.00 0.00 0.00 0.00 44.72 42.68 1ruk s GLY 129 CO 0.00 -1.90 0.37 0.00 0.00 0.00 0.00 173.10 171.58 1ruk s ALA 130 N -2.53 -1.03 -0.15 3.20 0.00 -0.44 -3.89 121.76 116.92 1ruk s ALA 130 Ca 0.36 1.12 -0.02 0.00 0.00 0.00 0.00 51.96 53.42 1ruk s ALA 130 Cb 0.01 -1.45 -0.02 0.00 0.00 0.00 0.00 23.12 21.66 1ruk s ALA 130 CO 0.20 -0.99 -0.08 -1.12 0.00 0.00 0.00 175.76 173.77 1ruk s SER 131 N 2.55 4.44 -0.21 0.00 0.01 -1.26 -0.06 113.70 119.17 1ruk s SER 131 Ca 0.06 -0.22 -0.07 0.00 1.31 0.00 0.00 55.95 57.03 1ruk s SER 131 Cb -0.14 -1.71 -0.03 0.00 0.21 0.00 0.00 66.02 64.35 1ruk s SER 131 CO -0.14 0.16 0.05 -0.69 0.41 0.00 0.00 173.24 173.03 1ruk s VAL 132 N 0.38 4.39 -0.06 3.43 1.01 0.66 -2.94 120.40 127.28 1ruk s VAL 132 Ca -0.07 -0.16 0.05 0.00 0.00 0.00 0.00 61.98 61.79 1ruk s VAL 132 Cb -0.15 -3.00 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 1ruk s VAL 132 CO 0.04 0.41 -0.19 -0.69 0.00 0.00 0.00 175.10 174.67 1ruk s VAL 133 N 0.93 2.64 -0.09 2.92 1.01 -0.85 -0.64 120.40 126.32 1ruk s VAL 133 Ca 0.03 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.15 1ruk s VAL 133 Cb -0.14 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.25 1ruk s VAL 133 CO 0.02 0.58 -0.11 0.00 0.00 0.00 0.00 175.10 175.59 1ruk s PHE 135 N 1.04 3.32 -0.38 0.00 0.08 -0.09 -0.62 117.98 121.32 1ruk s PHE 135 Ca -0.07 0.24 0.03 0.00 0.12 0.00 0.00 56.93 57.24 1ruk s PHE 135 Cb -0.15 -1.95 0.11 0.00 -0.57 0.00 0.00 43.02 40.46 1ruk s PHE 135 CO -0.01 0.41 0.11 -0.51 -0.10 0.00 0.00 175.22 175.12 1ruk s LEU 136 N -0.39 4.80 0.11 -0.37 1.02 0.12 -1.28 118.68 122.69 1ruk s LEU 136 Ca 0.09 -2.26 0.08 0.00 0.02 0.00 0.00 54.13 52.06 1ruk s LEU 136 Cb -0.12 -1.67 -0.04 0.00 0.02 0.00 0.00 46.19 44.38 1ruk s LEU 136 CO 0.02 -0.39 -0.13 0.20 0.02 0.00 0.00 176.35 176.07 1ruk s ASN 137 N 0.90 4.19 -1.19 2.29 0.01 0.13 -0.50 114.94 120.78 1ruk s ASN 137 Ca 0.11 -0.45 -0.02 0.00 -0.71 0.00 0.00 52.86 51.79 1ruk s ASN 137 Cb -0.20 -0.73 -0.01 0.00 0.41 0.00 0.00 41.25 40.71 1ruk s ASN 137 CO -0.06 0.18 0.90 0.59 -1.51 0.00 0.00 177.10 177.20 1ruk n ASN 138 N 0.77 -2.93 -4.72 -1.22 4.13 -0.76 -0.79 115.26 109.74 1ruk n ASN 138 Ca -0.14 -0.71 -0.23 0.00 1.68 0.00 0.00 54.58 55.18 1ruk n ASN 138 Cb 0.52 -4.81 -0.06 0.00 -1.54 0.00 0.00 39.78 33.89 1ruk n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1ruk s PHE 139 N -3.45 2.74 -0.21 3.10 -0.12 0.20 -4.61 117.98 115.63 1ruk s PHE 139 Ca 0.12 -0.33 -0.16 0.00 -0.05 0.00 0.00 56.93 56.51 1ruk s PHE 139 Cb -0.02 -1.53 0.06 0.00 -0.63 0.00 0.00 43.02 40.90 1ruk s PHE 139 CO 0.76 0.41 0.54 -0.47 -0.05 0.00 0.00 175.22 176.41 1ruk s TYR 140 N -2.38 -0.70 1.12 3.49 5.04 -0.67 -0.99 117.35 122.26 1ruk s TYR 140 Ca 0.36 1.57 -0.19 0.00 -2.44 0.00 0.00 57.07 56.37 1ruk s TYR 140 Cb -0.04 0.31 0.26 0.00 0.35 0.00 0.00 41.96 42.85 1ruk s TYR 140 CO 0.22 -0.36 1.21 -1.25 -1.34 0.00 0.00 175.55 174.03 1ruk s PRO 141 N 0.87 -0.63 0.48 4.97 0.04 -1.26 -0.12 135.00 139.34 1ruk s PRO 141 Ca -0.05 -0.28 0.27 0.00 0.04 0.00 0.00 61.00 60.99 1ruk s PRO 141 Cb -0.05 -1.68 1.02 0.00 0.04 0.00 0.00 34.50 33.83 1ruk s PRO 141 CO -0.07 -3.28 1.86 1.57 0.04 0.00 0.00 177.00 177.12 1ruk h LYS 142 N -2.27 0.00 -6.55 4.56 2.10 -1.99 -3.44 116.57 108.98 1ruk h LYS 142 Ca -0.44 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 57.69 1ruk h LYS 142 Cb 1.26 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1ruk h LYS 142 CO 0.33 0.13 0.49 -0.51 -2.00 0.00 0.00 179.45 177.88 1ruk s ASP 143 N -6.01 7.22 0.07 7.07 1.01 -1.26 -5.00 116.67 119.76 1ruk s ASP 143 Ca 0.01 1.98 -0.21 0.00 0.71 0.00 0.00 52.55 55.05 1ruk s ASP 143 Cb 0.09 -2.59 0.05 0.00 1.01 0.00 0.00 42.92 41.48 1ruk s ASP 143 CO 0.61 -0.31 0.50 -0.51 0.21 0.00 0.00 175.17 175.67 1ruk s ILE 144 N 0.44 0.03 -0.04 0.77 2.07 -1.26 -4.69 121.20 118.53 1ruk s ILE 144 Ca 0.53 -0.28 0.05 0.00 -1.41 0.00 0.00 60.65 59.53 1ruk s ILE 144 Cb -0.28 -1.00 -0.00 0.00 0.13 0.00 0.00 42.46 41.31 1ruk s ILE 144 CO 0.31 -0.16 -0.18 0.20 -1.91 0.00 0.00 174.94 173.21 1ruk s ASN 145 N -2.15 2.20 -0.02 4.50 -0.87 -0.44 -4.99 114.94 113.17 1ruk s ASN 145 Ca -0.04 -0.36 0.05 0.00 -1.57 0.00 0.00 52.86 50.95 1ruk s ASN 145 Cb -0.00 -0.57 -0.01 0.00 -0.02 0.00 0.00 41.25 40.65 1ruk s ASN 145 CO -0.04 0.17 -0.17 0.54 -2.57 0.00 0.00 177.10 175.02 1ruk s VAL 146 N -0.03 1.37 -0.06 1.60 0.11 -1.26 -0.04 120.40 122.10 1ruk s VAL 146 Ca -0.02 -0.73 0.03 0.00 -2.93 0.00 0.00 61.98 58.32 1ruk s VAL 146 Cb -0.11 -1.15 0.01 0.00 -1.53 0.00 0.00 36.38 33.60 1ruk s VAL 146 CO 0.02 0.39 -0.14 -0.75 -3.33 0.00 0.00 175.10 171.28 1ruk s LYS 147 N -0.34 1.76 -0.09 1.54 2.20 0.23 -4.97 119.74 120.08 1ruk s LYS 147 Ca 0.05 -0.50 -0.06 0.00 -0.36 0.00 0.00 55.97 55.10 1ruk s LYS 147 Cb -0.07 -1.47 -0.04 0.00 -1.51 0.00 0.00 37.83 34.73 1ruk s LYS 147 CO -0.00 0.12 0.16 -1.58 -0.36 0.00 0.00 175.35 173.69 1ruk s TRP 148 N 0.39 3.59 -0.02 4.03 0.52 -1.26 0.04 118.94 126.23 1ruk s TRP 148 Ca -0.10 0.50 0.02 0.00 0.02 0.00 0.00 56.10 56.53 1ruk s TRP 148 Cb -0.14 -1.92 0.00 0.00 -1.15 0.00 0.00 33.47 30.26 1ruk s TRP 148 CO 0.03 0.71 -0.06 0.15 0.02 0.00 0.00 176.95 177.80 1ruk s LYS 149 N -1.28 0.67 -0.19 4.98 1.02 -0.52 -0.73 119.74 123.68 1ruk s LYS 149 Ca 0.19 -0.20 -0.01 0.00 0.02 0.00 0.00 55.97 55.96 1ruk s LYS 149 Cb -0.12 -0.66 0.00 0.00 -0.52 0.00 0.00 37.83 36.53 1ruk s LYS 149 CO 0.08 0.07 -0.12 0.42 -0.92 0.00 0.00 175.35 174.88 1ruk s ILE 150 N 0.23 2.81 -1.36 2.17 1.01 0.47 -1.12 121.20 125.40 1ruk s ILE 150 Ca -0.03 -0.69 -0.10 0.00 0.00 0.00 0.00 60.65 59.83 1ruk s ILE 150 Cb -0.07 -2.23 0.07 0.00 0.01 0.00 0.00 42.46 40.24 1ruk s ILE 150 CO -0.00 0.48 0.57 0.47 0.00 0.00 0.00 174.94 176.46 1ruk n ASP 151 N 4.55 -4.05 0.00 3.58 8.00 0.40 -1.56 116.55 127.47 1ruk n ASP 151 Ca -0.19 -0.46 0.00 0.00 0.71 0.00 0.00 54.79 54.85 1ruk n ASP 151 Cb 0.51 -3.33 0.00 0.00 -0.02 0.00 0.00 41.12 38.28 1ruk n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ruk n GLY 152 N -1.28 1.41 3.65 0.44 0.00 -1.26 -5.00 105.19 103.15 1ruk n GLY 152 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1ruk n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ruk s SER 153 N -2.69 5.01 0.35 1.61 0.01 -0.60 -4.99 113.70 112.39 1ruk s SER 153 Ca 0.00 0.04 -0.29 0.00 1.31 0.00 0.00 55.95 57.01 1ruk s SER 153 Cb 0.00 -1.33 -0.11 0.00 0.21 0.00 0.00 66.02 64.79 1ruk s SER 153 CO 0.00 0.34 1.52 -0.70 0.41 0.00 0.00 173.24 174.81 1ruk s GLU 154 N -1.10 4.12 -0.15 12.44 2.12 -1.26 -0.39 118.70 134.48 1ruk s GLU 154 Ca 0.15 2.57 0.01 0.00 0.36 0.00 0.00 54.97 58.06 1ruk s GLU 154 Cb -0.11 -2.99 0.02 0.00 0.26 0.00 0.00 34.13 31.31 1ruk s GLU 154 CO 0.05 -0.56 -0.16 0.50 -0.54 0.00 0.00 175.26 174.55 1ruk s ARG 155 N -1.51 2.45 -0.27 4.30 6.06 0.09 -4.84 118.95 125.22 1ruk s ARG 155 Ca 0.56 -0.62 -0.09 0.00 -2.50 0.00 0.00 55.73 53.08 1ruk s ARG 155 Cb -0.47 -2.18 -0.14 0.00 0.06 0.00 0.00 34.95 32.23 1ruk s ARG 155 CO 0.57 -0.20 -0.32 1.04 -2.50 0.00 0.00 175.30 173.90 1ruk n GLN 156 N 4.63 0.61 -2.14 5.12 3.00 -1.26 -4.33 117.38 123.00 1ruk n GLN 156 Ca -0.18 0.23 -0.31 0.00 -0.01 0.00 0.00 57.00 56.73 1ruk n GLN 156 Cb 0.50 -1.50 -0.00 0.00 0.00 0.00 0.00 30.24 29.24 1ruk n GLN 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1ruk s ASN 157 N -7.22 6.35 0.00 1.08 6.03 -1.26 -3.83 114.94 116.10 1ruk s ASN 157 Ca -0.38 1.39 0.00 0.00 -1.03 0.00 0.00 52.86 52.85 1ruk s ASN 157 Cb 0.13 -2.45 0.00 0.00 -3.03 0.00 0.00 41.25 35.90 1ruk s ASN 157 CO 0.52 -0.74 0.00 0.61 -2.03 0.00 0.00 177.10 175.46 1ruk n GLY 158 N -2.32 0.58 3.53 0.45 0.00 -1.26 -4.87 105.19 101.30 1ruk n GLY 158 Ca 0.05 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 1ruk n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ruk s VAL 159 N -2.00 4.72 -0.10 1.61 1.01 -1.25 -1.09 120.40 123.29 1ruk s VAL 159 Ca 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 61.98 61.97 1ruk s VAL 159 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.18 1ruk s VAL 159 CO 0.00 0.34 -0.21 -0.76 0.00 0.00 0.00 175.10 174.47 1ruk s LEU 160 N 1.38 2.00 0.13 3.92 1.43 -0.01 -4.97 118.68 122.57 1ruk s LEU 160 Ca 0.06 -0.52 0.07 0.00 -1.03 0.00 0.00 54.13 52.71 1ruk s LEU 160 Cb -0.15 -1.31 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 1ruk s LEU 160 CO 0.05 0.12 -0.08 0.20 0.23 0.00 0.00 176.35 176.87 1ruk s ASN 161 N 0.53 4.45 -0.03 2.29 0.02 -1.26 -0.73 114.94 120.20 1ruk s ASN 161 Ca -0.15 -0.43 -0.02 0.00 -1.02 0.00 0.00 52.86 51.24 1ruk s ASN 161 Cb -0.17 -0.85 0.01 0.00 0.02 0.00 0.00 41.25 40.26 1ruk s ASN 161 CO 0.05 0.14 0.07 -0.55 0.02 0.00 0.00 177.10 176.84 1ruk s SER 162 N -2.49 -0.06 -0.02 -1.22 0.15 -0.11 -5.00 113.70 104.96 1ruk s SER 162 Ca 0.23 0.14 0.07 0.00 0.70 0.00 0.00 55.95 57.09 1ruk s SER 162 Cb -0.10 0.12 -0.02 0.00 -1.71 0.00 0.00 66.02 64.30 1ruk s SER 162 CO 0.15 -0.04 -0.22 0.26 1.20 0.00 0.00 173.24 174.59 1ruk s TRP 163 N 0.22 2.47 0.57 3.44 0.51 -1.26 -0.80 118.94 124.08 1ruk s TRP 163 Ca -0.02 -0.33 -0.13 0.00 -2.12 0.00 0.00 56.10 53.50 1ruk s TRP 163 Cb -0.02 -1.52 -0.06 0.00 -0.81 0.00 0.00 33.47 31.06 1ruk s TRP 163 CO -0.01 0.08 1.00 0.95 -0.51 0.00 0.00 176.95 178.46 1ruk s THR 164 N -0.70 4.65 0.93 2.01 -4.23 -0.62 -5.01 115.64 112.67 1ruk s THR 164 Ca 0.11 0.98 -0.12 0.00 -1.18 0.00 0.00 61.69 61.49 1ruk s THR 164 Cb -0.10 -3.81 0.15 0.00 1.34 0.00 0.00 72.50 70.08 1ruk s THR 164 CO 0.00 -0.94 1.09 -1.81 -0.54 0.00 0.00 174.62 172.43 1ruk s ASP 165 N -3.70 3.13 0.37 3.99 1.01 -1.26 -4.60 116.67 115.60 1ruk s ASP 165 Ca 0.56 1.51 -0.28 0.00 0.71 0.00 0.00 52.55 55.05 1ruk s ASP 165 Cb -0.11 -2.18 -0.11 0.00 1.01 0.00 0.00 42.92 41.53 1ruk s ASP 165 CO 0.44 -2.86 1.47 1.67 0.21 0.00 0.00 175.17 176.10 1ruk n GLN 166 N -4.03 2.62 -3.33 8.23 7.27 -1.26 -4.72 117.38 122.16 1ruk n GLN 166 Ca 0.07 0.92 -0.39 0.00 0.07 0.00 0.00 57.00 57.67 1ruk n GLN 166 Cb 0.55 -2.64 -0.07 0.00 2.41 0.00 0.00 30.24 30.49 1ruk n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1ruk s ASP 167 N -0.11 6.47 0.41 1.69 -1.08 0.34 -4.95 116.67 119.44 1ruk s ASP 167 Ca 0.54 0.56 0.29 0.00 -0.52 0.00 0.00 52.55 53.42 1ruk s ASP 167 Cb -0.49 -2.26 1.30 0.00 -1.46 0.00 0.00 42.92 40.02 1ruk s ASP 167 CO 0.63 -0.13 1.87 0.77 0.52 0.00 0.00 175.17 178.82 1ruk h SER 168 N 7.49 0.00 0.31 -0.34 4.64 -1.90 0.63 113.55 124.38 1ruk h SER 168 Ca -0.34 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.85 1ruk h SER 168 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 1ruk h SER 168 CO 0.72 0.00 -0.50 0.07 -0.87 0.00 0.00 176.83 176.25 1ruk h LYS 169 N 0.00 0.22 0.00 4.77 5.09 -1.92 -3.36 116.57 121.37 1ruk h LYS 169 Ca 0.00 -0.13 0.00 0.00 0.09 0.00 0.00 60.65 60.61 1ruk h LYS 169 Cb 0.31 0.01 0.00 0.00 0.10 0.00 0.00 32.23 32.65 1ruk h LYS 169 CO 0.00 0.68 0.00 -0.40 -2.09 0.00 0.00 179.45 177.64 1ruk n ASP 170 N -3.95 0.00 -1.85 7.07 5.68 -1.16 -5.03 116.55 117.31 1ruk n ASP 170 Ca -0.02 -1.00 -0.19 0.00 -0.50 0.00 0.00 54.79 53.08 1ruk n ASP 170 Cb 0.54 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.48 1ruk n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1ruk n SER 171 N 0.00 -5.46 -4.97 -1.12 7.64 0.22 -4.98 113.62 104.94 1ruk n SER 171 Ca 0.00 0.23 -0.20 0.00 1.01 0.00 0.00 58.87 59.91 1ruk n SER 171 Cb 0.46 -4.58 0.02 0.00 -1.01 0.00 0.00 64.21 59.10 1ruk n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1ruk s THR 172 N -2.85 2.36 0.25 0.44 -4.23 -1.24 -4.74 115.64 105.63 1ruk s THR 172 Ca 0.00 -1.16 0.11 0.00 -1.18 0.00 0.00 61.69 59.46 1ruk s THR 172 Cb 0.00 -2.52 -0.05 0.00 1.34 0.00 0.00 72.50 71.27 1ruk s THR 172 CO 0.00 0.00 -0.18 -0.31 -0.54 0.00 0.00 174.62 173.59 1ruk s TYR 173 N -2.57 2.36 0.07 3.99 1.51 -0.16 -0.50 117.35 122.05 1ruk s TYR 173 Ca 0.52 -0.32 -0.01 0.00 -1.01 0.00 0.00 57.07 56.26 1ruk s TYR 173 Cb -0.06 -1.06 -0.04 0.00 -0.11 0.00 0.00 41.96 40.69 1ruk s TYR 173 CO 0.32 0.65 -0.02 -1.12 -1.11 0.00 0.00 175.55 174.26 1ruk s SER 174 N -3.32 0.56 -0.05 2.29 0.01 -1.26 -0.63 113.70 111.31 1ruk s SER 174 Ca 0.28 -1.03 -0.07 0.00 1.31 0.00 0.00 55.95 56.45 1ruk s SER 174 Cb -0.06 0.20 0.01 0.00 0.21 0.00 0.00 66.02 66.38 1ruk s SER 174 CO 0.15 -0.60 0.17 -0.32 0.41 0.00 0.00 173.24 173.05 1ruk s MET 175 N -3.92 0.30 -0.04 12.44 0.00 0.35 -1.58 119.30 126.84 1ruk s MET 175 Ca 0.10 0.06 0.06 0.00 0.00 0.00 0.00 55.69 55.90 1ruk s MET 175 Cb 0.08 0.13 -0.02 0.00 0.00 0.00 0.00 34.83 35.02 1ruk s MET 175 CO -0.08 -0.05 -0.22 0.45 0.00 0.00 0.00 175.02 175.12 1ruk s SER 176 N -0.35 3.37 -0.07 1.11 0.15 0.02 -0.70 113.70 117.22 1ruk s SER 176 Ca -0.04 -0.40 0.04 0.00 0.70 0.00 0.00 55.95 56.25 1ruk s SER 176 Cb -0.03 -0.65 0.00 0.00 -1.71 0.00 0.00 66.02 63.62 1ruk s SER 176 CO 0.01 0.30 -0.20 -0.55 1.20 0.00 0.00 173.24 174.00 1ruk s SER 177 N -0.50 2.56 -0.14 5.45 0.15 0.20 -0.93 113.70 120.50 1ruk s SER 177 Ca 0.06 -0.44 0.01 0.00 0.70 0.00 0.00 55.95 56.28 1ruk s SER 177 Cb -0.11 -1.01 0.02 0.00 -1.71 0.00 0.00 66.02 63.20 1ruk s SER 177 CO 0.01 0.14 -0.18 -0.89 1.20 0.00 0.00 173.24 173.52 1ruk s THR 178 N 0.28 1.78 -0.31 6.45 2.01 0.09 -0.39 115.64 125.55 1ruk s THR 178 Ca -0.12 -0.79 -0.14 0.00 0.31 0.00 0.00 61.69 60.95 1ruk s THR 178 Cb -0.15 -1.61 -0.03 0.00 0.01 0.00 0.00 72.50 70.71 1ruk s THR 178 CO 0.05 0.49 0.32 -0.22 -0.69 0.00 0.00 174.62 174.58 1ruk s LEU 179 N 1.13 4.24 -0.15 4.42 2.96 0.19 -0.83 118.68 130.64 1ruk s LEU 179 Ca -0.01 -0.05 -0.01 0.00 -0.22 0.00 0.00 54.13 53.84 1ruk s LEU 179 Cb -0.14 -2.30 -0.01 0.00 0.50 0.00 0.00 46.19 44.24 1ruk s LEU 179 CO -0.06 -0.22 -0.12 -0.89 -1.32 0.00 0.00 176.35 173.73 1ruk s THR 180 N 1.95 3.00 0.39 3.68 2.01 -0.25 -0.24 115.64 126.18 1ruk s THR 180 Ca 0.11 -0.66 0.08 0.00 0.31 0.00 0.00 61.69 61.52 1ruk s THR 180 Cb -0.16 -2.28 -0.07 0.00 0.01 0.00 0.00 72.50 70.00 1ruk s THR 180 CO 0.11 0.51 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.78 1ruk s LEU 181 N 0.60 2.85 0.67 4.42 1.43 0.91 -4.69 118.68 124.87 1ruk s LEU 181 Ca -0.07 -1.30 -0.13 0.00 -1.03 0.00 0.00 54.13 51.60 1ruk s LEU 181 Cb -0.16 -0.96 0.00 0.00 0.03 0.00 0.00 46.19 45.11 1ruk s LEU 181 CO 0.03 -0.38 1.07 0.42 0.23 0.00 0.00 176.35 177.72 1ruk s THR 182 N -2.67 3.73 0.23 5.49 -4.23 -1.26 -1.33 115.64 115.59 1ruk s THR 182 Ca 0.35 0.67 -0.08 0.00 -1.18 0.00 0.00 61.69 61.44 1ruk s THR 182 Cb 0.07 -3.27 0.20 0.00 1.34 0.00 0.00 72.50 70.85 1ruk s THR 182 CO 0.18 -0.63 1.89 0.50 -0.54 0.00 0.00 174.62 176.01 1ruk h LYS 183 N -0.35 1.17 -0.46 3.99 3.11 -1.06 0.80 116.57 123.77 1ruk h LYS 183 Ca -0.45 -0.09 -0.09 0.00 -2.81 0.00 0.00 60.65 57.21 1ruk h LYS 183 Cb 1.22 -0.25 -0.02 0.00 -1.00 0.00 0.00 32.23 32.18 1ruk h LYS 183 CO 0.56 0.80 -0.06 -0.44 -2.81 0.00 0.00 179.45 177.50 1ruk h ASP 184 N 1.20 0.79 -0.16 4.20 3.32 -1.92 0.03 116.42 123.87 1ruk h ASP 184 Ca 0.32 -0.22 -0.15 0.00 0.02 0.00 0.00 57.03 57.00 1ruk h ASP 184 Cb -0.09 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 1ruk h ASP 184 CO -0.06 0.89 -0.41 -0.08 -1.72 0.00 0.00 179.24 177.85 1ruk h GLU 185 N 0.74 0.70 -0.67 3.56 4.81 -1.77 -2.68 114.58 119.27 1ruk h GLU 185 Ca 0.13 -0.37 -0.02 0.00 -0.13 0.00 0.00 59.36 58.97 1ruk h GLU 185 Cb 0.53 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 1ruk h GLU 185 CO 0.03 0.99 0.34 -0.92 -0.73 0.00 0.00 179.01 178.71 1ruk h TYR 186 N 0.57 0.96 0.00 0.92 3.20 -0.32 -2.69 116.97 119.61 1ruk h TYR 186 Ca 0.04 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1ruk h TYR 186 Cb 0.95 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.92 1ruk h TYR 186 CO 0.05 0.71 0.00 0.39 -1.64 0.00 0.00 178.16 177.67 1ruk n GLU 187 N -4.47 0.09 0.14 1.82 -0.58 -0.05 -2.53 120.64 115.05 1ruk n GLU 187 Ca 0.05 0.22 0.04 0.00 -0.42 0.00 0.00 57.16 57.04 1ruk n GLU 187 Cb 0.12 -1.63 0.04 0.00 -0.57 0.00 0.00 31.44 29.39 1ruk n GLU 187 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 1ruk h ARG 188 N 0.00 0.00 -5.97 3.49 2.43 -1.13 -3.47 114.38 109.73 1ruk h ARG 188 Ca 0.00 0.00 -0.56 0.00 -0.81 0.00 0.00 59.98 58.61 1ruk h ARG 188 Cb 0.42 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.89 1ruk h ARG 188 CO 0.00 0.43 -0.50 -1.01 -1.51 0.00 0.00 179.97 177.38 1ruk s HIS 189 N -2.99 2.63 -0.10 2.20 3.76 -1.05 -5.09 115.29 114.66 1ruk s HIS 189 Ca 0.04 -0.53 -0.10 0.00 -0.15 0.00 0.00 55.06 54.32 1ruk s HIS 189 Cb 0.07 -1.89 -0.05 0.00 1.11 0.00 0.00 32.58 31.83 1ruk s HIS 189 CO 0.74 0.20 -0.21 0.09 -0.85 0.00 0.00 174.74 174.71 1ruk n ASN 190 N -1.23 1.47 -4.57 1.40 4.13 -1.26 -4.76 115.26 110.43 1ruk n ASN 190 Ca -0.01 0.24 -0.32 0.00 1.68 0.00 0.00 54.58 56.17 1ruk n ASN 190 Cb 0.63 -0.55 -0.11 0.00 -1.54 0.00 0.00 39.78 38.22 1ruk n ASN 190 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1ruk s SER 191 N -6.12 4.50 -0.07 6.41 0.15 -1.26 -0.45 113.70 116.86 1ruk s SER 191 Ca -0.19 -0.17 0.03 0.00 0.70 0.00 0.00 55.95 56.32 1ruk s SER 191 Cb 0.04 -1.02 0.01 0.00 -1.71 0.00 0.00 66.02 63.34 1ruk s SER 191 CO 0.27 0.29 -0.16 -0.31 1.20 0.00 0.00 173.24 174.53 1ruk s TYR 192 N -0.96 1.79 -0.03 3.44 2.02 -0.30 -0.45 117.35 122.85 1ruk s TYR 192 Ca 0.16 -0.67 0.02 0.00 -0.37 0.00 0.00 57.07 56.21 1ruk s TYR 192 Cb -0.11 -1.25 0.01 0.00 -0.40 0.00 0.00 41.96 40.21 1ruk s TYR 192 CO 0.07 -0.30 -0.06 0.99 -1.57 0.00 0.00 175.55 174.67 1ruk s THR 193 N 0.50 0.60 -0.21 -0.71 2.01 -0.27 -1.44 115.64 116.12 1ruk s THR 193 Ca -0.15 -0.23 -0.05 0.00 0.31 0.00 0.00 61.69 61.58 1ruk s THR 193 Cb -0.16 -0.57 -0.02 0.00 0.01 0.00 0.00 72.50 71.75 1ruk s THR 193 CO 0.05 0.21 -0.00 0.00 -0.69 0.00 0.00 174.62 174.19 1ruk s GLU 195 N 1.12 2.95 -0.20 0.00 2.02 0.11 -1.12 118.70 123.58 1ruk s GLU 195 Ca 0.02 -0.83 -0.06 0.00 0.02 0.00 0.00 54.97 54.12 1ruk s GLU 195 Cb -0.14 -2.37 -0.03 0.00 0.10 0.00 0.00 34.13 31.68 1ruk s GLU 195 CO 0.01 0.00 0.03 0.00 0.02 0.00 0.00 175.26 175.32 1ruk s ALA 196 N 0.78 3.13 -0.15 5.21 0.00 -0.35 -0.60 121.76 129.78 1ruk s ALA 196 Ca -0.08 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 50.93 1ruk s ALA 196 Cb -0.16 -1.85 0.00 0.00 0.00 0.00 0.00 23.12 21.11 1ruk s ALA 196 CO -0.01 -0.12 -0.16 0.95 0.00 0.00 0.00 175.76 176.42 1ruk s THR 197 N 0.95 2.56 0.03 0.00 -4.23 0.95 -0.95 115.64 114.95 1ruk s THR 197 Ca 0.02 -0.81 0.01 0.00 -1.18 0.00 0.00 61.69 59.74 1ruk s THR 197 Cb -0.14 -2.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.60 1ruk s THR 197 CO 0.02 0.52 -0.05 -2.28 -0.54 0.00 0.00 174.62 172.29 1ruk s HIS 198 N 0.80 0.47 -0.20 3.99 2.46 -1.26 -1.33 115.29 120.23 1ruk s HIS 198 Ca -0.06 -0.55 0.25 0.00 0.47 0.00 0.00 55.06 55.17 1ruk s HIS 198 Cb -0.15 -0.30 1.23 0.00 -0.13 0.00 0.00 32.58 33.22 1ruk s HIS 198 CO -0.00 -0.15 1.76 1.57 -2.47 0.00 0.00 174.74 175.45 1ruk h LYS 199 N 4.47 0.00 0.00 2.88 2.10 -1.94 -2.29 116.57 121.78 1ruk h LYS 199 Ca -0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 1ruk h LYS 199 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1ruk h LYS 199 CO 0.43 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.13 1ruk n THR 200 N -2.37 0.93 -3.68 0.07 -2.24 -1.26 -4.74 114.28 100.99 1ruk n THR 200 Ca -0.00 0.34 -0.14 0.00 -2.27 0.00 0.00 64.05 61.98 1ruk n THR 200 Cb 0.11 -1.27 -0.08 0.00 -2.10 0.00 0.00 70.33 66.99 1ruk n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ruk s SER 201 N -4.03 -0.56 0.54 3.42 0.15 -0.86 -5.00 113.70 107.37 1ruk s SER 201 Ca 0.03 1.01 0.33 0.00 0.70 0.00 0.00 55.95 58.02 1ruk s SER 201 Cb 0.08 1.02 1.32 0.00 -1.71 0.00 0.00 66.02 66.74 1ruk s SER 201 CO 0.33 -0.24 1.97 0.00 1.20 0.00 0.00 173.24 176.49 1ruk h THR 202 N 4.14 0.04 -3.67 6.45 1.03 -1.85 -3.41 112.91 115.63 1ruk h THR 202 Ca -0.28 -0.56 -0.68 0.00 -0.01 0.00 0.00 66.41 64.89 1ruk h THR 202 Cb 1.17 1.54 -0.28 0.00 -1.07 0.00 0.00 68.15 69.51 1ruk h THR 202 CO 0.19 0.01 -0.81 -0.94 -0.01 0.00 0.00 175.52 173.97 1ruk s SER 203 N -5.74 3.68 0.52 0.00 1.04 -1.26 -5.09 113.70 106.86 1ruk s SER 203 Ca 0.01 -0.37 -0.20 0.00 0.48 0.00 0.00 55.95 55.87 1ruk s SER 203 Cb 0.09 -1.21 -0.08 0.00 0.10 0.00 0.00 66.02 64.92 1ruk s SER 203 CO 0.55 0.23 0.86 -2.65 0.98 0.00 0.00 173.24 173.21 1ruk n PRO 204 N 3.08 0.95 -3.00 4.02 -0.02 -1.26 -4.92 135.00 133.84 1ruk n PRO 204 Ca -0.18 0.35 -0.41 0.00 -2.02 0.00 0.00 63.50 61.25 1ruk n PRO 204 Cb 0.52 -1.99 -0.05 0.00 -0.02 0.00 0.00 33.50 31.97 1ruk n PRO 204 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ruk s ILE 205 N -1.48 4.94 -0.17 4.25 1.01 -0.12 -4.89 121.20 124.74 1ruk s ILE 205 Ca 0.69 1.39 -0.04 0.00 0.00 0.00 0.00 60.65 62.70 1ruk s ILE 205 Cb -0.48 -4.03 -0.02 0.00 0.01 0.00 0.00 42.46 37.93 1ruk s ILE 205 CO 0.53 0.04 -0.04 -0.69 0.00 0.00 0.00 174.94 174.78 1ruk s VAL 206 N 2.20 3.74 -0.04 2.92 1.01 -1.26 -1.21 120.40 127.76 1ruk s VAL 206 Ca 0.33 -0.40 0.05 0.00 0.00 0.00 0.00 61.98 61.95 1ruk s VAL 206 Cb -0.16 -2.65 -0.01 0.00 0.00 0.00 0.00 36.38 33.56 1ruk s VAL 206 CO 0.10 0.47 -0.18 -0.54 0.00 0.00 0.00 175.10 174.95 1ruk s LYS 207 N 0.69 1.87 0.14 2.72 -0.14 -0.27 -5.00 119.74 119.74 1ruk s LYS 207 Ca -0.02 -0.66 0.00 0.00 -1.36 0.00 0.00 55.97 53.93 1ruk s LYS 207 Cb -0.14 -1.63 -0.04 0.00 -1.68 0.00 0.00 37.83 34.33 1ruk s LYS 207 CO 0.02 0.28 0.02 -1.12 -0.76 0.00 0.00 175.35 173.79 1ruk s SER 208 N -0.03 0.72 0.15 2.83 0.01 -1.26 -0.50 113.70 115.61 1ruk s SER 208 Ca -0.03 -1.16 -0.12 0.00 1.31 0.00 0.00 55.95 55.95 1ruk s SER 208 Cb -0.11 0.21 0.01 0.00 0.21 0.00 0.00 66.02 66.33 1ruk s SER 208 CO 0.02 -0.64 0.33 0.72 0.41 0.00 0.00 173.24 174.08 1ruk s PHE 209 N -3.86 0.16 -0.14 2.43 -0.71 -0.52 -5.00 117.98 110.33 1ruk s PHE 209 Ca 0.22 -0.53 -0.05 0.00 -1.04 0.00 0.00 56.93 55.53 1ruk s PHE 209 Cb 0.07 0.07 -0.04 0.00 -1.21 0.00 0.00 43.02 41.92 1ruk s PHE 209 CO 0.01 -0.72 0.03 -0.80 -1.34 0.00 0.00 175.22 172.40 1ruk s ASN 210 N -2.90 5.37 0.45 1.98 0.01 -1.26 -1.14 114.94 117.44 1ruk s ASN 210 Ca 0.11 0.08 -0.25 0.00 -0.71 0.00 0.00 52.86 52.09 1ruk s ASN 210 Cb 0.03 -1.78 -0.09 0.00 0.41 0.00 0.00 41.25 39.82 1ruk s ASN 210 CO -0.05 0.25 1.38 -1.14 -1.51 0.00 0.00 177.10 176.04 1ruk n ARG 211 N 3.01 2.13 -1.04 -0.60 0.63 0.41 -1.92 116.66 119.28 1ruk n ARG 211 Ca -0.18 0.76 -0.01 0.00 -0.92 0.00 0.00 57.85 57.50 1ruk n ARG 211 Cb 0.53 -2.56 -0.01 0.00 0.45 0.00 0.00 32.46 30.88 1ruk n ARG 211 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1ruk n ASN 212 N -0.11 -4.94 -4.49 6.15 2.85 -1.26 -4.99 115.26 108.47 1ruk n ASN 212 Ca 0.06 0.03 -0.33 0.00 -0.11 0.00 0.00 54.58 54.23 1ruk n ASN 212 Cb 0.41 -2.56 -0.13 0.00 1.24 0.00 0.00 39.78 38.75 1ruk n ASN 212 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 1ruk s GLU 213 N -1.50 2.73 0.00 1.20 2.02 -0.81 -5.29 118.70 117.06 1ruk s GLU 213 Ca 0.00 -0.64 0.00 0.00 0.02 0.00 0.00 54.97 54.35 1ruk s GLU 213 Cb 0.00 -2.49 0.00 0.00 0.10 0.00 0.00 34.13 31.74 1ruk s GLU 213 CO 0.00 0.57 0.22 0.00 0.02 0.00 0.00 175.26 176.07