#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b4j s GLN 3 N 0.00 3.65 -0.43 5.55 -0.44 -1.26 -4.65 119.66 122.08 1b4j s GLN 3 Ca 0.00 0.03 0.02 0.00 -2.50 0.00 0.00 55.36 52.91 1b4j s GLN 3 Cb 0.00 -3.09 0.13 0.00 -1.64 0.00 0.00 33.01 28.41 1b4j s GLN 3 CO 0.00 0.65 0.21 -0.48 0.50 0.00 0.00 175.29 176.17 1b4j s LEU 4 N -1.65 2.93 0.00 3.68 0.05 -1.26 -3.10 118.68 119.34 1b4j s LEU 4 Ca 0.27 -2.52 -0.10 0.00 0.05 0.00 0.00 54.13 51.83 1b4j s LEU 4 Cb -0.14 -1.12 0.15 0.00 -2.05 0.00 0.00 46.19 43.04 1b4j s LEU 4 CO 0.15 -0.29 0.93 0.00 -0.55 0.00 0.00 176.35 176.59 1b4j n GLN 5 N 3.70 -0.78 -3.94 1.48 1.13 -1.26 -3.85 117.38 113.86 1b4j n GLN 5 Ca 0.07 -1.57 -0.08 0.00 -1.94 0.00 0.00 57.00 53.47 1b4j n GLN 5 Cb 0.35 -0.91 -0.08 0.00 0.11 0.00 0.00 30.24 29.71 1b4j n GLN 5 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1b4j s GLN 6 N -4.99 0.79 0.73 -1.09 -0.21 -1.24 -3.51 119.66 110.14 1b4j s GLN 6 Ca 0.54 -1.06 -0.15 0.00 0.02 0.00 0.00 55.36 54.71 1b4j s GLN 6 Cb -0.02 0.30 0.04 0.00 1.00 0.00 0.00 33.01 34.34 1b4j s GLN 6 CO 0.37 -0.23 1.24 -2.14 -2.12 0.00 0.00 175.29 172.42 1b4j s PRO 7 N -3.89 2.07 0.16 2.91 0.02 -1.26 -4.79 135.00 130.22 1b4j s PRO 7 Ca 0.07 1.88 -0.18 0.00 0.02 0.00 0.00 61.00 62.79 1b4j s PRO 7 Cb 0.06 -1.81 0.07 0.00 0.02 0.00 0.00 34.50 32.84 1b4j s PRO 7 CO -0.10 -1.92 1.67 0.78 -0.33 0.00 0.00 177.00 177.10 1b4j h GLY 8 N -0.24 0.22 0.00 0.52 0.00 -1.94 -3.30 103.07 98.32 1b4j h GLY 8 Ca -0.48 0.15 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1b4j h GLY 8 CO 0.49 -0.15 0.00 0.00 0.00 0.00 0.00 176.54 176.88 1b4j n ALA 9 N -2.68 0.00 0.00 3.60 0.00 -1.26 -2.91 120.51 117.26 1b4j n ALA 9 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1b4j n ALA 9 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.67 1b4j n ALA 9 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1b4j n ASP 10 N 1.49 0.00 -4.23 0.00 -0.08 0.05 -4.88 116.55 108.90 1b4j n ASP 10 Ca 0.00 0.00 -0.31 0.00 -1.51 0.00 0.00 54.79 52.97 1b4j n ASP 10 Cb 0.00 0.00 -0.17 0.00 2.34 0.00 0.00 41.12 43.29 1b4j n ASP 10 CO 0.00 0.00 0.00 -1.48 0.12 0.00 0.00 177.20 175.84 1b4j s LEU 11 N 0.00 2.05 -0.08 -2.67 0.05 -1.26 -1.47 118.68 115.31 1b4j s LEU 11 Ca 0.00 -0.52 -0.08 0.00 0.05 0.00 0.00 54.13 53.58 1b4j s LEU 11 Cb 0.00 -1.35 0.02 0.00 -2.05 0.00 0.00 46.19 42.81 1b4j s LEU 11 CO 0.00 0.19 0.23 0.68 -0.55 0.00 0.00 176.35 176.89 1b4j s VAL 12 N 0.14 0.01 1.03 1.48 -7.23 -0.81 -4.99 120.40 110.03 1b4j s VAL 12 Ca -0.12 -0.05 -0.12 0.00 -1.81 0.00 0.00 61.98 59.88 1b4j s VAL 12 Cb -0.16 -0.34 0.20 0.00 0.56 0.00 0.00 36.38 36.64 1b4j s VAL 12 CO 0.06 -0.03 1.00 0.23 -0.31 0.00 0.00 175.10 176.06 1b4j n MET 13 N 2.83 -1.28 -1.59 4.82 2.81 -1.25 -2.87 117.12 120.59 1b4j n MET 13 Ca -0.13 -0.32 -0.35 0.00 -1.81 0.00 0.00 57.70 55.08 1b4j n MET 13 Cb 0.58 -2.24 0.08 0.00 -0.71 0.00 0.00 33.22 30.93 1b4j n MET 13 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 1b4j s PRO 14 N -4.43 2.37 -0.96 0.03 0.02 -1.26 -3.78 135.00 126.99 1b4j s PRO 14 Ca 0.67 1.80 -0.06 0.00 0.02 0.00 0.00 61.00 63.42 1b4j s PRO 14 Cb -0.23 -1.86 0.01 0.00 0.02 0.00 0.00 34.50 32.44 1b4j s PRO 14 CO 0.62 -1.67 0.78 0.41 -0.33 0.00 0.00 177.00 176.81 1b4j n GLY 15 N 0.44 -0.10 2.76 0.52 0.00 -0.25 -4.87 105.19 103.68 1b4j n GLY 15 Ca 0.14 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 1b4j n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4j s ALA 16 N -3.19 0.74 0.62 4.61 0.00 -1.25 -4.55 121.76 118.74 1b4j s ALA 16 Ca 0.39 -0.24 -0.18 0.00 0.00 0.00 0.00 51.96 51.92 1b4j s ALA 16 Cb -0.17 -0.84 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 1b4j s ALA 16 CO 0.48 -0.63 1.11 -2.30 0.00 0.00 0.00 175.76 174.42 1b4j n PRO 17 N 5.14 1.01 -4.06 0.00 -0.02 -1.25 -4.00 135.00 131.81 1b4j n PRO 17 Ca -0.07 0.39 -0.09 0.00 -2.02 0.00 0.00 63.50 61.71 1b4j n PRO 17 Cb 0.49 -2.33 -0.11 0.00 -0.02 0.00 0.00 33.50 31.54 1b4j n PRO 17 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1b4j s VAL 18 N -1.45 0.33 -0.31 -1.45 -7.23 -1.07 -4.96 120.40 104.25 1b4j s VAL 18 Ca 0.79 -1.42 -0.02 0.00 -1.81 0.00 0.00 61.98 59.51 1b4j s VAL 18 Cb -0.40 -0.99 0.11 0.00 0.56 0.00 0.00 36.38 35.66 1b4j s VAL 18 CO 0.44 -0.71 0.15 -0.75 -0.31 0.00 0.00 175.10 173.92 1b4j s LYS 19 N -2.71 0.42 0.93 4.82 2.20 -1.26 -2.82 119.74 121.32 1b4j s LYS 19 Ca -0.02 -0.87 -0.15 0.00 -0.36 0.00 0.00 55.97 54.57 1b4j s LYS 19 Cb -0.01 -1.40 0.17 0.00 -1.51 0.00 0.00 37.83 35.07 1b4j s LYS 19 CO -0.04 -1.06 1.24 -0.51 -0.36 0.00 0.00 175.35 174.62 1b4j s LEU 20 N 1.71 2.40 0.06 5.43 1.02 -1.10 -4.91 118.68 123.29 1b4j s LEU 20 Ca 0.11 0.52 -0.06 0.00 0.02 0.00 0.00 54.13 54.73 1b4j s LEU 20 Cb -0.18 -2.69 -0.02 0.00 0.02 0.00 0.00 46.19 43.32 1b4j s LEU 20 CO -0.25 -2.61 0.10 -0.44 0.02 0.00 0.00 176.35 173.17 1b4j s SER 21 N -4.62 0.25 0.00 2.29 0.01 -1.26 -3.53 113.70 106.84 1b4j s SER 21 Ca 0.69 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 57.22 1b4j s SER 21 Cb -0.08 0.27 0.00 0.00 0.21 0.00 0.00 66.02 66.42 1b4j s SER 21 CO 0.52 -0.63 0.00 0.00 0.41 0.00 0.00 173.24 173.54 1b4j n LEU 23 N 0.00 0.00 -3.42 0.00 7.94 -1.23 -4.41 117.00 115.89 1b4j n LEU 23 Ca 0.00 -2.78 -0.03 0.00 -1.11 0.00 0.00 56.01 52.08 1b4j n LEU 23 Cb 0.00 2.63 -0.05 0.00 0.53 0.00 0.00 43.42 46.53 1b4j n LEU 23 CO 0.00 -0.66 0.09 0.00 -1.11 0.00 0.00 177.39 175.70 1b4j s ALA 24 N -2.69 -1.65 -0.31 1.96 0.00 -1.21 -4.68 121.76 113.19 1b4j s ALA 24 Ca 0.27 1.60 0.07 0.00 0.00 0.00 0.00 51.96 53.91 1b4j s ALA 24 Cb -0.01 -1.77 0.47 0.00 0.00 0.00 0.00 23.12 21.81 1b4j s ALA 24 CO 0.20 -1.11 1.39 0.43 0.00 0.00 0.00 175.76 176.66 1b4j n SER 25 N 5.41 3.66 0.00 0.00 7.64 -1.18 -4.97 113.62 124.18 1b4j n SER 25 Ca -0.06 -3.81 0.00 0.00 1.01 0.00 0.00 58.87 56.02 1b4j n SER 25 Cb 0.50 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 63.15 1b4j n SER 25 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1b4j n GLY 26 N -0.97 2.17 0.01 0.23 0.00 -1.26 -3.40 105.19 101.98 1b4j n GLY 26 Ca 0.37 -0.21 -0.00 0.00 0.00 0.00 0.00 46.02 46.18 1b4j n GLY 26 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1b4j h TYR 27 N 0.00 -0.03 0.00 1.61 0.05 -1.93 -3.50 116.97 113.17 1b4j h TYR 27 Ca 0.00 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1b4j h TYR 27 Cb 0.00 0.01 0.00 0.00 1.01 0.00 0.00 36.73 37.75 1b4j h TYR 27 CO 0.00 -0.02 0.00 -0.89 -1.05 0.00 0.00 178.16 176.20 1b4j n ILE 28 N -2.30 0.00 -1.19 -2.88 5.41 -1.26 -5.01 119.36 112.14 1b4j n ILE 28 Ca -0.00 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.48 1b4j n ILE 28 Cb 0.01 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 38.85 1b4j n ILE 28 CO 0.00 0.00 0.00 2.22 0.00 0.00 0.00 176.55 178.77 1b4j n PHE 29 N 0.00 1.32 0.00 1.39 -1.74 -1.26 -1.43 117.46 115.73 1b4j n PHE 29 Ca 0.00 -2.35 0.00 0.00 -0.56 0.00 0.00 57.45 54.54 1b4j n PHE 29 Cb 0.00 -2.05 0.00 0.00 1.52 0.00 0.00 39.48 38.95 1b4j n PHE 29 CO 0.00 0.00 0.00 2.41 -0.56 0.00 0.00 176.76 178.61 1b4j n THR 30 N 2.99 0.00 0.00 1.97 -1.04 -1.26 -4.65 114.28 112.30 1b4j n THR 30 Ca 0.62 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 62.57 1b4j n THR 30 Cb 0.55 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 69.02 1b4j n THR 30 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1b4j h SER 31 N 0.00 -0.64 -0.62 8.00 0.02 -1.57 -3.42 113.55 115.32 1b4j h SER 31 Ca 0.00 0.08 -0.54 0.00 -0.84 0.00 0.00 61.79 60.48 1b4j h SER 31 Cb 0.00 0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 1b4j h SER 31 CO 0.00 -0.18 -0.20 -0.94 -1.14 0.00 0.00 176.83 174.37 1b4j s SER 32 N -3.40 4.83 0.05 3.07 1.04 -1.25 -5.06 113.70 112.97 1b4j s SER 32 Ca -0.06 -1.08 0.03 0.00 0.48 0.00 0.00 55.95 55.32 1b4j s SER 32 Cb 0.03 0.42 -0.04 0.00 0.10 0.00 0.00 66.02 66.53 1b4j s SER 32 CO 0.23 -1.25 0.01 0.26 0.98 0.00 0.00 173.24 173.47 1b4j s TRP 33 N -2.74 3.06 -0.02 5.02 0.52 -1.26 -4.37 118.94 119.15 1b4j s TRP 33 Ca 0.47 0.04 -0.09 0.00 0.02 0.00 0.00 56.10 56.54 1b4j s TRP 33 Cb -0.04 -1.61 -0.05 0.00 -1.15 0.00 0.00 33.47 30.63 1b4j s TRP 33 CO 0.30 0.48 0.27 0.42 0.02 0.00 0.00 176.95 178.44 1b4j s ILE 34 N -1.23 5.28 -0.00 2.03 -1.09 -1.13 -2.06 121.20 123.00 1b4j s ILE 34 Ca 0.24 0.34 0.06 0.00 -2.23 0.00 0.00 60.65 59.06 1b4j s ILE 34 Cb -0.12 -3.56 -0.03 0.00 -1.58 0.00 0.00 42.46 37.18 1b4j s ILE 34 CO 0.16 0.47 -0.17 0.20 -1.23 0.00 0.00 174.94 174.36 1b4j s ASN 35 N -1.40 3.80 -0.09 3.58 0.01 -0.85 -2.88 114.94 117.12 1b4j s ASN 35 Ca 0.24 -0.34 0.02 0.00 -0.71 0.00 0.00 52.86 52.07 1b4j s ASN 35 Cb -0.14 -0.67 -0.02 0.00 0.41 0.00 0.00 41.25 40.83 1b4j s ASN 35 CO 0.12 0.30 -0.14 0.26 -1.51 0.00 0.00 177.10 176.14 1b4j s TRP 36 N -0.81 2.76 -0.07 2.20 0.52 -0.42 -0.91 118.94 122.21 1b4j s TRP 36 Ca 0.13 -0.39 0.00 0.00 0.02 0.00 0.00 56.10 55.86 1b4j s TRP 36 Cb -0.10 -1.73 0.02 0.00 -1.15 0.00 0.00 33.47 30.50 1b4j s TRP 36 CO 0.03 -0.01 -0.05 0.08 0.02 0.00 0.00 176.95 177.02 1b4j s VAL 37 N -0.21 0.67 -0.53 4.03 1.01 -0.97 -0.21 120.40 124.19 1b4j s VAL 37 Ca 0.00 -0.15 -0.16 0.00 0.00 0.00 0.00 61.98 61.67 1b4j s VAL 37 Cb -0.13 -0.71 0.12 0.00 0.00 0.00 0.00 36.38 35.66 1b4j s VAL 37 CO 0.03 0.28 0.50 -0.75 0.00 0.00 0.00 175.10 175.16 1b4j s LYS 38 N 1.25 2.99 -0.46 2.72 2.20 0.18 -1.90 119.74 126.72 1b4j s LYS 38 Ca -0.05 -1.61 -0.16 0.00 -0.36 0.00 0.00 55.97 53.79 1b4j s LYS 38 Cb -0.14 -4.27 0.06 0.00 -1.51 0.00 0.00 37.83 31.97 1b4j s LYS 38 CO -0.02 -1.30 0.38 -1.14 -0.36 0.00 0.00 175.35 172.92 1b4j s GLN 39 N 1.70 2.99 0.31 4.03 0.74 -0.40 -2.38 119.66 126.65 1b4j s GLN 39 Ca 0.04 -1.23 -0.26 0.00 0.05 0.00 0.00 55.36 53.95 1b4j s GLN 39 Cb -0.29 -4.09 -0.10 0.00 1.10 0.00 0.00 33.01 29.64 1b4j s GLN 39 CO 0.04 -0.96 0.94 0.50 -0.55 0.00 0.00 175.29 175.26 1b4j s ARG 40 N 1.71 4.61 -0.47 1.67 3.52 -1.26 -2.02 118.95 126.71 1b4j s ARG 40 Ca 0.05 1.34 -0.44 0.00 -0.13 0.00 0.00 55.73 56.55 1b4j s ARG 40 Cb -0.23 -2.86 -0.19 0.00 -1.56 0.00 0.00 34.95 30.12 1b4j s ARG 40 CO 0.08 0.31 1.91 -2.30 -0.81 0.00 0.00 175.30 174.49 1b4j n PRO 41 N 0.68 0.17 -3.16 5.12 -0.02 -1.26 -1.70 135.00 134.82 1b4j n PRO 41 Ca 0.01 0.06 -0.14 0.00 -2.02 0.00 0.00 63.50 61.41 1b4j n PRO 41 Cb 0.50 -1.62 0.07 0.00 -0.02 0.00 0.00 33.50 32.43 1b4j n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b4j n GLY 42 N 5.84 -0.63 3.45 -1.23 0.00 -1.26 -5.04 105.19 106.31 1b4j n GLY 42 Ca 0.43 0.28 -0.11 0.00 0.00 0.00 0.00 46.02 46.62 1b4j n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b4j s ARG 43 N -4.69 1.29 0.71 1.61 0.52 -0.69 -5.16 118.95 112.54 1b4j s ARG 43 Ca 0.22 -0.63 -0.13 0.00 -0.52 0.00 0.00 55.73 54.68 1b4j s ARG 43 Cb -0.03 0.55 0.03 0.00 0.52 0.00 0.00 34.95 36.02 1b4j s ARG 43 CO 0.66 -0.55 1.09 0.20 0.02 0.00 0.00 175.30 176.72 1b4j s GLY 44 N -2.79 1.88 0.63 -3.53 0.00 -1.26 -4.62 107.32 97.63 1b4j s GLY 44 Ca 0.03 0.37 -0.18 0.00 0.00 0.00 0.00 44.72 44.94 1b4j s GLY 44 CO -0.10 0.71 1.22 1.08 0.00 0.00 0.00 173.10 176.01 1b4j s LEU 45 N -5.41 3.58 -0.01 0.66 1.43 -1.26 -4.49 118.68 113.18 1b4j s LEU 45 Ca 0.63 2.41 0.04 0.00 -1.03 0.00 0.00 54.13 56.18 1b4j s LEU 45 Cb -0.18 -4.60 -0.01 0.00 0.03 0.00 0.00 46.19 41.43 1b4j s LEU 45 CO 0.49 -1.78 -0.13 -0.70 0.23 0.00 0.00 176.35 174.47 1b4j s GLU 46 N -3.47 1.02 0.07 1.70 2.12 -1.00 -4.97 118.70 114.17 1b4j s GLU 46 Ca 0.77 -0.47 -0.21 0.00 0.36 0.00 0.00 54.97 55.43 1b4j s GLU 46 Cb -0.31 -0.99 -0.07 0.00 0.26 0.00 0.00 34.13 33.03 1b4j s GLU 46 CO 0.36 0.27 0.61 -0.46 -0.54 0.00 0.00 175.26 175.51 1b4j s TRP 47 N -0.33 3.80 -0.00 5.30 -0.00 -1.26 0.49 118.94 126.93 1b4j s TRP 47 Ca 0.05 1.32 -0.03 0.00 -0.00 0.00 0.00 56.10 57.44 1b4j s TRP 47 Cb -0.05 -2.57 -0.02 0.00 -0.00 0.00 0.00 33.47 30.83 1b4j s TRP 47 CO -0.00 0.53 -0.08 -0.89 -0.00 0.00 0.00 176.95 176.51 1b4j n ILE 48 N 1.91 0.86 -3.81 5.86 5.41 0.70 -4.63 119.36 125.66 1b4j n ILE 48 Ca -0.09 0.16 0.00 0.00 1.00 0.00 0.00 62.75 63.82 1b4j n ILE 48 Cb 0.50 -1.67 0.00 0.00 -0.71 0.00 0.00 39.64 37.76 1b4j n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1b4j n GLY 49 N 2.87 0.67 3.40 7.39 0.00 -1.16 0.18 105.19 118.54 1b4j n GLY 49 Ca -0.07 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 44.95 1b4j n GLY 49 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1b4j s ARG 50 N -2.00 0.56 -0.01 1.61 1.70 -0.24 -1.30 118.95 119.27 1b4j s ARG 50 Ca 0.04 0.75 0.05 0.00 -0.47 0.00 0.00 55.73 56.10 1b4j s ARG 50 Cb -0.00 0.22 -0.01 0.00 -0.57 0.00 0.00 34.95 34.59 1b4j s ARG 50 CO 0.00 -0.09 -0.16 -1.50 -1.08 0.00 0.00 175.30 172.47 1b4j s ILE 51 N 0.56 1.26 -0.39 4.99 1.10 -1.14 -0.77 121.20 126.81 1b4j s ILE 51 Ca -0.02 -0.69 -0.14 0.00 -0.51 0.00 0.00 60.65 59.29 1b4j s ILE 51 Cb -0.04 -1.05 0.02 0.00 0.15 0.00 0.00 42.46 41.53 1b4j s ILE 51 CO -0.03 0.35 0.27 -0.62 -2.11 0.00 0.00 174.94 172.79 1b4j s ASP 52 N -0.40 6.01 0.00 4.50 2.15 0.80 -2.83 116.67 126.90 1b4j s ASP 52 Ca 0.06 -0.84 0.00 0.00 0.43 0.00 0.00 52.55 52.20 1b4j s ASP 52 Cb -0.06 -2.12 0.00 0.00 -0.30 0.00 0.00 42.92 40.43 1b4j s ASP 52 CO -0.01 -0.40 0.57 -2.65 -0.17 0.00 0.00 175.17 172.52 1b4j n PRO 53 N 5.11 0.00 0.00 4.34 -0.02 -1.26 0.59 135.00 143.76 1b4j n PRO 53 Ca -0.11 -0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.26 1b4j n PRO 53 Cb 0.47 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 1b4j n PRO 53 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1b4j n SER 54 N 3.34 0.00 0.20 2.55 3.41 -1.26 -4.00 113.62 117.86 1b4j n SER 54 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 1b4j n SER 54 Cb 0.00 0.22 0.22 0.00 -0.26 0.00 0.00 64.21 64.39 1b4j n SER 54 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1b4j h ASP 55 N 0.00 0.00 0.00 4.04 3.04 -1.96 -3.47 116.42 118.07 1b4j h ASP 55 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1b4j h ASP 55 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 1b4j h ASP 55 CO 0.00 0.18 0.00 0.61 -2.04 0.00 0.00 179.24 177.99 1b4j n GLY 56 N 0.90 0.50 3.66 7.15 0.00 0.20 -4.97 105.19 112.63 1b4j n GLY 56 Ca 0.03 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.48 1b4j n GLY 56 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1b4j n GLU 57 N -2.87 1.04 -5.16 1.61 2.13 -1.23 -4.30 120.64 111.85 1b4j n GLU 57 Ca 0.00 0.38 -0.30 0.00 0.66 0.00 0.00 57.16 57.90 1b4j n GLU 57 Cb 0.01 -2.03 -0.16 0.00 0.27 0.00 0.00 31.44 29.53 1b4j n GLU 57 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1b4j s VAL 58 N 2.27 1.90 -0.23 6.31 -7.23 -1.26 -0.14 120.40 122.02 1b4j s VAL 58 Ca 0.93 -0.98 0.01 0.00 -1.81 0.00 0.00 61.98 60.13 1b4j s VAL 58 Cb -1.06 -1.61 0.05 0.00 0.56 0.00 0.00 36.38 34.32 1b4j s VAL 58 CO 0.59 0.53 -0.08 -1.00 -0.31 0.00 0.00 175.10 174.84 1b4j s HIS 59 N -0.13 2.51 0.10 2.82 3.76 0.05 -5.00 115.29 119.42 1b4j s HIS 59 Ca -0.03 -1.77 0.03 0.00 -0.15 0.00 0.00 55.06 53.13 1b4j s HIS 59 Cb -0.13 -1.64 -0.04 0.00 1.11 0.00 0.00 32.58 31.88 1b4j s HIS 59 CO 0.03 -0.78 0.14 0.71 -0.85 0.00 0.00 174.74 174.00 1b4j s TYR 60 N 1.36 3.28 0.35 1.40 1.51 -1.26 -1.08 117.35 122.91 1b4j s TYR 60 Ca -0.05 0.09 -0.27 0.00 -1.01 0.00 0.00 57.07 55.83 1b4j s TYR 60 Cb -0.18 -1.63 -0.09 0.00 -0.11 0.00 0.00 41.96 39.95 1b4j s TYR 60 CO -0.07 0.53 1.22 1.21 -1.11 0.00 0.00 175.55 177.34 1b4j s ASN 61 N -2.69 6.74 0.15 2.29 3.84 0.13 -4.85 114.94 120.56 1b4j s ASN 61 Ca 0.31 2.49 0.11 0.00 0.21 0.00 0.00 52.86 55.99 1b4j s ASN 61 Cb -0.12 -2.63 0.59 0.00 -0.55 0.00 0.00 41.25 38.54 1b4j s ASN 61 CO 0.24 -0.53 1.35 0.00 -2.79 0.00 0.00 177.10 175.37 1b4j n GLN 62 N 0.58 0.07 0.03 0.43 3.00 -1.26 -1.20 117.38 119.02 1b4j n GLN 62 Ca 0.01 0.53 0.08 0.00 -0.01 0.00 0.00 57.00 57.62 1b4j n GLN 62 Cb 0.44 -1.71 -0.10 0.00 0.00 0.00 0.00 30.24 28.87 1b4j n GLN 62 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1b4j n ASP 63 N -1.86 0.38 -0.63 1.08 9.92 -1.26 -4.18 116.55 120.00 1b4j n ASP 63 Ca -0.00 0.15 0.06 0.00 -0.53 0.00 0.00 54.79 54.48 1b4j n ASP 63 Cb 0.04 1.20 0.12 0.00 -0.64 0.00 0.00 41.12 41.84 1b4j n ASP 63 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1b4j n PHE 64 N -2.51 0.28 -0.04 1.24 3.01 -0.34 -4.73 117.46 114.37 1b4j n PHE 64 Ca -0.05 -0.26 -0.14 0.00 1.01 0.00 0.00 57.45 58.00 1b4j n PHE 64 Cb 0.64 -0.01 -0.09 0.00 -0.01 0.00 0.00 39.48 40.00 1b4j n PHE 64 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1b4j h LYS 65 N 2.42 -0.50 -0.11 -1.08 1.63 -1.47 -1.85 116.57 115.61 1b4j h LYS 65 Ca 0.00 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 1b4j h LYS 65 Cb 0.66 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.40 1b4j h LYS 65 CO 0.00 -0.34 0.00 -0.40 -3.45 0.00 0.00 179.45 175.26 1b4j n ASP 66 N -5.42 0.80 -0.01 4.20 5.68 -1.26 -4.37 116.55 116.16 1b4j n ASP 66 Ca -0.05 -1.72 -0.03 0.00 -0.50 0.00 0.00 54.79 52.50 1b4j n ASP 66 Cb 0.37 -0.07 -0.01 0.00 -1.14 0.00 0.00 41.12 40.27 1b4j n ASP 66 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1b4j n LYS 67 N -0.19 0.17 -3.76 0.11 -0.00 -0.88 -4.96 118.16 108.66 1b4j n LYS 67 Ca 0.11 0.07 -0.29 0.00 -0.00 0.00 0.00 58.31 58.20 1b4j n LYS 67 Cb 0.17 -0.71 -0.04 0.00 -0.00 0.00 0.00 35.03 34.45 1b4j n LYS 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1b4j s ALA 68 N -2.50 3.87 -0.11 0.58 0.00 -0.75 -2.35 121.76 120.51 1b4j s ALA 68 Ca -0.09 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.09 1b4j s ALA 68 Cb 0.01 -1.98 0.03 0.00 0.00 0.00 0.00 23.12 21.18 1b4j s ALA 68 CO 0.14 0.61 -0.01 0.95 0.00 0.00 0.00 175.76 177.45 1b4j s THR 69 N -1.71 0.56 -0.60 0.00 -4.23 0.35 -4.70 115.64 105.32 1b4j s THR 69 Ca 0.38 -0.12 -0.27 0.00 -1.18 0.00 0.00 61.69 60.50 1b4j s THR 69 Cb -0.12 -0.76 -0.02 0.00 1.34 0.00 0.00 72.50 72.94 1b4j s THR 69 CO 0.27 0.19 1.80 -0.76 -0.54 0.00 0.00 174.62 175.58 1b4j s LEU 70 N 1.88 3.30 0.67 4.79 2.01 -1.26 -2.76 118.68 127.31 1b4j s LEU 70 Ca 0.04 0.35 -0.01 0.00 0.01 0.00 0.00 54.13 54.52 1b4j s LEU 70 Cb -0.13 -2.62 0.09 0.00 0.01 0.00 0.00 46.19 43.53 1b4j s LEU 70 CO -0.06 -2.27 0.93 0.42 1.01 0.00 0.00 176.35 176.38 1b4j s THR 71 N 8.57 2.32 0.38 5.49 -4.23 0.09 -4.98 115.64 123.27 1b4j s THR 71 Ca 0.65 -0.58 -0.10 0.00 -1.18 0.00 0.00 61.69 60.49 1b4j s THR 71 Cb -0.13 -2.74 0.03 0.00 1.34 0.00 0.00 72.50 71.01 1b4j s THR 71 CO 0.21 0.00 0.66 0.54 -0.54 0.00 0.00 174.62 175.50 1b4j s VAL 72 N -3.04 0.00 -0.29 2.29 0.11 -1.26 -2.89 120.40 115.32 1b4j s VAL 72 Ca 0.63 -1.26 -0.02 0.00 -2.93 0.00 0.00 61.98 58.40 1b4j s VAL 72 Cb -0.07 -2.82 0.18 0.00 -1.53 0.00 0.00 36.38 32.13 1b4j s VAL 72 CO 0.43 0.00 0.57 -0.62 -3.33 0.00 0.00 175.10 172.14 1b4j s ASP 73 N -3.15 -1.12 0.11 3.54 -1.08 0.22 -4.86 116.67 110.32 1b4j s ASP 73 Ca 0.22 0.83 0.23 0.00 -0.52 0.00 0.00 52.55 53.31 1b4j s ASP 73 Cb -0.03 2.01 0.03 0.00 -1.46 0.00 0.00 42.92 43.47 1b4j s ASP 73 CO 0.16 -0.26 1.01 1.17 0.52 0.00 0.00 175.17 177.77 1b4j n LYS 74 N 5.42 0.45 0.00 4.34 0.00 -1.26 -2.25 118.16 124.86 1b4j n LYS 74 Ca -0.02 0.03 0.00 0.00 0.00 0.00 0.00 58.31 58.32 1b4j n LYS 74 Cb 0.51 -1.69 0.00 0.00 0.00 0.00 0.00 35.03 33.85 1b4j n LYS 74 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1b4j n SER 75 N -2.29 0.00 -4.68 3.14 7.64 -1.26 -4.55 113.62 111.62 1b4j n SER 75 Ca 0.01 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1b4j n SER 75 Cb 0.49 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.67 1b4j n SER 75 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1b4j s SER 76 N -1.18 6.77 -0.62 6.43 1.04 -1.26 -4.83 113.70 120.06 1b4j s SER 76 Ca 0.00 2.19 -0.24 0.00 0.48 0.00 0.00 55.95 58.37 1b4j s SER 76 Cb 0.00 -2.55 -0.21 0.00 0.10 0.00 0.00 66.02 63.36 1b4j s SER 76 CO 0.00 -0.79 1.85 -1.54 0.98 0.00 0.00 173.24 173.74 1b4j n SER 77 N 5.82 2.19 -3.93 7.02 3.41 -1.24 -4.34 113.62 122.55 1b4j n SER 77 Ca 0.14 -2.64 -0.10 0.00 -0.26 0.00 0.00 58.87 56.02 1b4j n SER 77 Cb 0.43 -1.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.26 1b4j n SER 77 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1b4j s THR 78 N 5.74 0.08 0.02 6.66 -4.23 -0.95 -3.31 115.64 119.64 1b4j s THR 78 Ca 0.61 -0.67 0.04 0.00 -1.18 0.00 0.00 61.69 60.48 1b4j s THR 78 Cb 0.14 -0.24 -0.03 0.00 1.34 0.00 0.00 72.50 73.70 1b4j s THR 78 CO 0.17 -0.37 -0.06 0.00 -0.54 0.00 0.00 174.62 173.82 1b4j s ALA 79 N -1.12 3.03 0.04 3.99 0.00 -1.26 -0.61 121.76 125.83 1b4j s ALA 79 Ca -0.12 -1.04 0.03 0.00 0.00 0.00 0.00 51.96 50.83 1b4j s ALA 79 Cb -0.07 -1.12 -0.02 0.00 0.00 0.00 0.00 23.12 21.91 1b4j s ALA 79 CO -0.00 0.62 -0.10 0.71 0.00 0.00 0.00 175.76 176.99 1b4j s TYR 80 N -1.03 0.86 0.23 0.00 1.51 -1.14 -0.76 117.35 117.02 1b4j s TYR 80 Ca 0.18 -0.37 0.11 0.00 -1.01 0.00 0.00 57.07 55.98 1b4j s TYR 80 Cb -0.11 -0.51 -0.05 0.00 -0.11 0.00 0.00 41.96 41.18 1b4j s TYR 80 CO 0.09 -0.02 -0.20 -1.50 -1.11 0.00 0.00 175.55 172.81 1b4j s ILE 81 N -0.98 2.53 -0.11 2.71 2.07 -1.23 -0.73 121.20 125.46 1b4j s ILE 81 Ca -0.03 -2.17 -0.04 0.00 -1.41 0.00 0.00 60.65 57.00 1b4j s ILE 81 Cb -0.08 -2.27 0.06 0.00 0.13 0.00 0.00 42.46 40.30 1b4j s ILE 81 CO 0.01 -0.25 0.23 -1.58 -1.91 0.00 0.00 174.94 171.43 1b4j s GLN 82 N -3.11 0.11 -0.39 3.50 0.74 -1.11 -2.73 119.66 116.68 1b4j s GLN 82 Ca 0.26 0.68 -0.13 0.00 0.05 0.00 0.00 55.36 56.21 1b4j s GLN 82 Cb -0.07 -0.13 0.02 0.00 1.10 0.00 0.00 33.01 33.93 1b4j s GLN 82 CO 0.13 -0.30 0.25 -0.51 -0.55 0.00 0.00 175.29 174.31 1b4j s LEU 83 N 2.38 4.86 -0.17 3.68 1.02 -1.13 -0.50 118.68 128.82 1b4j s LEU 83 Ca 0.02 -0.88 -0.23 0.00 0.02 0.00 0.00 54.13 53.07 1b4j s LEU 83 Cb -0.12 -2.10 -0.02 0.00 0.02 0.00 0.00 46.19 43.97 1b4j s LEU 83 CO -0.08 -0.39 0.71 0.20 0.02 0.00 0.00 176.35 176.81 1b4j s ASN 84 N 1.63 6.82 -0.87 2.29 0.01 -0.99 -2.59 114.94 121.24 1b4j s ASN 84 Ca 0.04 1.00 -0.03 0.00 -0.71 0.00 0.00 52.86 53.16 1b4j s ASN 84 Cb -0.19 -2.40 -0.02 0.00 0.41 0.00 0.00 41.25 39.05 1b4j s ASN 84 CO 0.09 -0.31 0.78 -1.54 -1.51 0.00 0.00 177.10 174.61 1b4j n SER 85 N 5.00 -7.22 -4.75 -1.22 3.41 -1.26 -4.89 113.62 102.69 1b4j n SER 85 Ca 0.01 -0.36 -0.40 0.00 -0.26 0.00 0.00 58.87 57.86 1b4j n SER 85 Cb 0.49 -5.09 -0.05 0.00 -0.26 0.00 0.00 64.21 59.30 1b4j n SER 85 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 1b4j s LEU 86 N -4.62 4.49 0.59 1.04 0.05 -1.26 -4.33 118.68 114.65 1b4j s LEU 86 Ca 0.18 1.53 0.01 0.00 0.05 0.00 0.00 54.13 55.90 1b4j s LEU 86 Cb -0.03 -3.28 0.06 0.00 -2.05 0.00 0.00 46.19 40.89 1b4j s LEU 86 CO 0.76 0.06 0.83 0.28 -0.55 0.00 0.00 176.35 177.72 1b4j s THR 87 N -0.32 2.52 -2.00 5.48 -1.32 -1.26 -1.10 115.64 117.64 1b4j s THR 87 Ca 0.39 -0.66 0.07 0.00 -1.21 0.00 0.00 61.69 60.28 1b4j s THR 87 Cb -0.21 -2.87 0.21 0.00 -1.51 0.00 0.00 72.50 68.12 1b4j s THR 87 CO 0.24 0.00 0.86 -1.20 -2.21 0.00 0.00 174.62 172.31 1b4j n SER 88 N -2.45 0.00 -1.00 8.08 7.64 -1.26 -1.27 113.62 123.36 1b4j n SER 88 Ca 0.10 -0.54 -0.02 0.00 1.01 0.00 0.00 58.87 59.42 1b4j n SER 88 Cb 0.60 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 63.98 1b4j n SER 88 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1b4j n GLU 89 N -0.80 1.98 0.00 1.43 -0.58 -1.26 -4.35 120.64 117.05 1b4j n GLU 89 Ca 0.06 -3.41 0.00 0.00 -0.42 0.00 0.00 57.16 53.39 1b4j n GLU 89 Cb 0.03 -1.78 0.00 0.00 -0.57 0.00 0.00 31.44 29.11 1b4j n GLU 89 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1b4j n ASP 90 N -1.06 0.05 -4.56 1.62 8.00 -0.39 -5.03 116.55 115.19 1b4j n ASP 90 Ca 0.27 -0.20 -0.33 0.00 0.71 0.00 0.00 54.79 55.24 1b4j n ASP 90 Cb 0.83 0.41 -0.04 0.00 -0.02 0.00 0.00 41.12 42.29 1b4j n ASP 90 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1b4j s SER 91 N -0.42 5.49 0.23 -2.24 1.04 -1.25 -4.91 113.70 111.64 1b4j s SER 91 Ca 0.00 -0.51 -0.20 0.00 0.48 0.00 0.00 55.95 55.72 1b4j s SER 91 Cb 0.00 -2.55 0.03 0.00 0.10 0.00 0.00 66.02 63.60 1b4j s SER 91 CO 0.00 -2.37 0.63 0.00 0.98 0.00 0.00 173.24 172.48 1b4j s ALA 92 N 8.60 -1.14 0.33 5.32 0.00 -1.05 -4.67 121.76 129.15 1b4j s ALA 92 Ca 0.62 -0.18 -0.28 0.00 0.00 0.00 0.00 51.96 52.13 1b4j s ALA 92 Cb -0.07 0.88 -0.10 0.00 0.00 0.00 0.00 23.12 23.83 1b4j s ALA 92 CO 0.05 -0.91 1.19 0.08 0.00 0.00 0.00 175.76 176.17 1b4j s VAL 93 N -3.88 3.11 -0.06 0.00 1.01 -0.86 -3.54 120.40 116.18 1b4j s VAL 93 Ca 0.10 1.07 0.05 0.00 0.00 0.00 0.00 61.98 63.19 1b4j s VAL 93 Cb -0.03 -3.66 -0.00 0.00 0.00 0.00 0.00 36.38 32.68 1b4j s VAL 93 CO 0.01 0.22 -0.20 -0.31 0.00 0.00 0.00 175.10 174.82 1b4j s TYR 94 N -1.22 2.02 0.34 5.22 1.51 -0.76 -1.27 117.35 123.19 1b4j s TYR 94 Ca 0.49 -0.65 0.08 0.00 -1.01 0.00 0.00 57.07 55.99 1b4j s TYR 94 Cb -0.34 -1.36 -0.07 0.00 -0.11 0.00 0.00 41.96 40.08 1b4j s TYR 94 CO 0.45 -0.23 -0.06 0.71 -1.11 0.00 0.00 175.55 175.30 1b4j s TYR 95 N 0.10 2.33 -0.04 2.71 2.02 -0.80 -2.24 117.35 121.43 1b4j s TYR 95 Ca -0.07 -0.58 -0.02 0.00 -0.37 0.00 0.00 57.07 56.03 1b4j s TYR 95 Cb -0.14 -1.40 0.03 0.00 -0.40 0.00 0.00 41.96 40.05 1b4j s TYR 95 CO 0.04 0.49 0.05 0.00 -1.57 0.00 0.00 175.55 174.55 1b4j s ALA 97 N 1.93 2.28 -0.54 0.00 0.00 -0.09 -3.66 121.76 121.68 1b4j s ALA 97 Ca 0.02 -1.09 -0.26 0.00 0.00 0.00 0.00 51.96 50.63 1b4j s ALA 97 Cb -0.12 -1.02 -0.04 0.00 0.00 0.00 0.00 23.12 21.94 1b4j s ALA 97 CO -0.03 -0.02 2.08 0.50 0.00 0.00 0.00 175.76 178.29 1b4j s ARG 98 N 0.80 2.48 -0.78 0.00 3.52 0.13 -2.01 118.95 123.10 1b4j s ARG 98 Ca -0.07 1.01 -0.25 0.00 -0.13 0.00 0.00 55.73 56.29 1b4j s ARG 98 Cb -0.16 -4.45 -0.04 0.00 -1.56 0.00 0.00 34.95 28.74 1b4j s ARG 98 CO -0.01 -2.88 1.95 0.20 -0.81 0.00 0.00 175.30 173.75 1b4j s GLY 99 N 9.58 0.12 0.00 8.12 0.00 -0.87 -2.97 107.32 121.30 1b4j s GLY 99 Ca 0.81 -1.13 0.00 0.00 0.00 0.00 0.00 44.72 44.40 1b4j s GLY 99 CO 0.24 3.52 0.70 0.69 0.00 0.00 0.00 173.10 178.25 1b4j n PHE 100 N 13.82 0.00 -1.24 1.90 3.01 -0.71 -4.35 117.46 129.88 1b4j n PHE 100 Ca 0.33 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.79 1b4j n PHE 100 Cb 0.49 -0.20 0.00 0.00 -0.01 0.00 0.00 39.48 39.76 1b4j n PHE 100 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 1b4j n LEU 101 N -1.53 0.00 0.00 4.37 0.00 -1.26 -4.87 117.00 113.71 1b4j n LEU 101 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 56.01 56.04 1b4j n LEU 101 Cb 0.00 0.00 0.17 0.00 0.00 0.00 0.00 43.42 43.59 1b4j n LEU 101 CO 0.00 0.00 0.36 -0.81 0.00 0.00 0.00 177.39 176.94 1b4j n PRO 102 N 0.00 0.29 -4.90 1.96 -0.04 -1.26 -4.65 135.00 126.40 1b4j n PRO 102 Ca 0.00 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.15 1b4j n PRO 102 Cb 0.00 -1.30 -0.14 0.00 -0.04 0.00 0.00 33.50 32.02 1b4j n PRO 102 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 1b4j s TRP 103 N -2.00 2.52 -0.60 0.54 1.48 -1.26 -5.06 118.94 114.56 1b4j s TRP 103 Ca 0.08 -0.29 -0.27 0.00 -1.06 0.00 0.00 56.10 54.57 1b4j s TRP 103 Cb 0.04 -1.51 -0.02 0.00 -1.16 0.00 0.00 33.47 30.82 1b4j s TRP 103 CO 0.07 0.15 1.84 -0.06 -4.06 0.00 0.00 176.95 174.89 1b4j s PHE 104 N -0.78 1.68 0.00 1.66 0.08 -1.26 -1.74 117.98 117.61 1b4j s PHE 104 Ca 0.12 0.77 0.00 0.00 0.12 0.00 0.00 56.93 57.94 1b4j s PHE 104 Cb -0.10 -4.10 0.00 0.00 -0.57 0.00 0.00 43.02 38.24 1b4j s PHE 104 CO 0.02 -2.32 0.00 0.00 -0.10 0.00 0.00 175.22 172.82 1b4j n ALA 105 N 12.57 0.00 -2.44 5.36 0.00 -1.16 -4.89 120.51 129.95 1b4j n ALA 105 Ca 0.20 -0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.25 1b4j n ALA 105 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.91 1b4j n ALA 105 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1b4j s ASP 106 N -2.12 6.95 0.00 0.00 2.15 -1.23 -4.98 116.67 117.44 1b4j s ASP 106 Ca 0.00 1.13 0.00 0.00 0.43 0.00 0.00 52.55 54.11 1b4j s ASP 106 Cb 0.00 -2.34 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 1b4j s ASP 106 CO 0.00 0.18 0.00 0.79 -0.17 0.00 0.00 175.17 175.97 1b4j n TRP 107 N 2.38 0.00 -3.46 -5.34 7.02 -1.26 -0.69 117.44 116.10 1b4j n TRP 107 Ca -0.09 0.00 0.02 0.00 -1.02 0.00 0.00 57.50 56.42 1b4j n TRP 107 Cb 0.51 0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 29.35 1b4j n TRP 107 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1b4j s GLY 108 N 0.00 0.41 0.05 6.99 0.00 -1.24 -4.02 107.32 109.51 1b4j s GLY 108 Ca 0.00 3.68 -0.18 0.00 0.00 0.00 0.00 44.72 48.22 1b4j s GLY 108 CO 0.00 3.02 0.42 -1.06 0.00 0.00 0.00 173.10 175.49 1b4j n GLN 109 N 3.81 0.00 -2.20 2.90 1.13 -1.26 -4.50 117.38 117.26 1b4j n GLN 109 Ca -0.13 0.00 -0.39 0.00 -1.94 0.00 0.00 57.00 54.54 1b4j n GLN 109 Cb 0.56 -0.67 -0.02 0.00 0.11 0.00 0.00 30.24 30.23 1b4j n GLN 109 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1b4j s GLY 110 N -0.27 2.93 -0.30 1.08 0.00 -1.26 -3.64 107.32 105.85 1b4j s GLY 110 Ca 0.41 1.10 -0.13 0.00 0.00 0.00 0.00 44.72 46.11 1b4j s GLY 110 CO 0.30 1.67 0.26 -1.59 0.00 0.00 0.00 173.10 173.74 1b4j s THR 111 N -1.29 5.26 -0.05 0.90 2.01 -0.95 -4.72 115.64 116.80 1b4j s THR 111 Ca 0.54 0.13 -0.23 0.00 0.31 0.00 0.00 61.69 62.44 1b4j s THR 111 Cb -0.35 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.48 1b4j s THR 111 CO 0.45 0.12 0.70 -0.22 -0.69 0.00 0.00 174.62 174.98 1b4j s LEU 112 N 1.84 4.34 -0.29 4.42 0.20 -1.14 -1.82 118.68 126.23 1b4j s LEU 112 Ca 0.09 1.22 0.01 0.00 0.69 0.00 0.00 54.13 56.14 1b4j s LEU 112 Cb -0.16 -3.09 0.06 0.00 -0.43 0.00 0.00 46.19 42.57 1b4j s LEU 112 CO 0.11 -0.08 -0.04 -0.69 -0.29 0.00 0.00 176.35 175.36 1b4j s VAL 113 N 0.59 2.50 -0.19 1.68 1.01 -1.23 -0.77 120.40 123.99 1b4j s VAL 113 Ca 0.37 -1.65 -0.09 0.00 0.00 0.00 0.00 61.98 60.61 1b4j s VAL 113 Cb -0.18 -2.51 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 1b4j s VAL 113 CO 0.19 -0.14 0.12 -0.89 0.00 0.00 0.00 175.10 174.38 1b4j s THR 114 N 1.13 5.34 -0.34 3.92 2.01 -0.54 -2.52 115.64 124.63 1b4j s THR 114 Ca -0.05 0.16 -0.03 0.00 0.31 0.00 0.00 61.69 62.09 1b4j s THR 114 Cb -0.20 -3.42 0.07 0.00 0.01 0.00 0.00 72.50 68.96 1b4j s THR 114 CO -0.04 0.46 0.09 -0.69 -0.69 0.00 0.00 174.62 173.74 1b4j s VAL 115 N 0.24 3.18 -0.18 3.82 1.01 -1.26 -1.92 120.40 125.28 1b4j s VAL 115 Ca 0.08 -1.61 -0.16 0.00 0.00 0.00 0.00 61.98 60.29 1b4j s VAL 115 Cb -0.11 -2.96 0.05 0.00 0.00 0.00 0.00 36.38 33.35 1b4j s VAL 115 CO -0.01 -0.33 0.48 -0.55 0.00 0.00 0.00 175.10 174.69 1b4j s SER 116 N 1.47 -0.52 -0.44 3.32 0.15 -1.14 -4.63 113.70 111.91 1b4j s SER 116 Ca 0.00 0.98 0.02 0.00 0.70 0.00 0.00 55.95 57.66 1b4j s SER 116 Cb -0.21 0.98 0.54 0.00 -1.71 0.00 0.00 66.02 65.62 1b4j s SER 116 CO -0.02 -0.17 1.87 0.00 1.20 0.00 0.00 173.24 176.12 1b4j n ALA 117 N 2.96 5.44 -2.96 5.45 0.00 -1.26 -3.83 120.51 126.32 1b4j n ALA 117 Ca -0.14 -2.68 -0.21 0.00 0.00 0.00 0.00 53.44 50.41 1b4j n ALA 117 Cb 0.57 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 18.53 1b4j n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b4j s ALA 118 N -3.02 3.91 -0.00 0.00 0.00 -1.26 -5.09 121.76 116.30 1b4j s ALA 118 Ca 0.52 -1.24 -0.01 0.00 0.00 0.00 0.00 51.96 51.23 1b4j s ALA 118 Cb 0.43 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.80 1b4j s ALA 118 CO 0.07 0.24 0.10 0.45 0.00 0.00 0.00 175.76 176.62 1b4j s SER 119 N -3.97 5.77 0.13 0.00 0.15 -1.26 -5.05 113.70 109.46 1b4j s SER 119 Ca 0.34 0.17 -0.34 0.00 0.70 0.00 0.00 55.95 56.81 1b4j s SER 119 Cb -0.09 -1.68 -0.14 0.00 -1.71 0.00 0.00 66.02 62.40 1b4j s SER 119 CO 0.29 0.27 1.55 0.41 1.20 0.00 0.00 173.24 176.95 1b4j n THR 120 N 1.11 0.03 -3.76 6.45 -1.04 -1.26 -4.72 114.28 111.10 1b4j n THR 120 Ca -0.12 -0.01 -0.13 0.00 -2.04 0.00 0.00 64.05 61.75 1b4j n THR 120 Cb 0.53 -1.41 -0.09 0.00 -1.82 0.00 0.00 70.33 67.53 1b4j n THR 120 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1b4j s LYS 121 N 1.00 0.63 0.27 -2.82 2.20 0.02 -4.95 119.74 116.09 1b4j s LYS 121 Ca 0.81 -0.07 -0.19 0.00 -0.36 0.00 0.00 55.97 56.16 1b4j s LYS 121 Cb -0.74 0.28 -0.09 0.00 -1.51 0.00 0.00 37.83 35.78 1b4j s LYS 121 CO 0.40 -0.16 0.75 0.20 -0.36 0.00 0.00 175.35 176.18 1b4j s GLY 122 N -1.08 2.53 0.92 5.54 0.00 -1.26 -1.89 107.32 112.07 1b4j s GLY 122 Ca -0.11 0.16 -0.12 0.00 0.00 0.00 0.00 44.72 44.65 1b4j s GLY 122 CO 0.04 0.47 1.11 2.56 0.00 0.00 0.00 173.10 177.28 1b4j s PRO 123 N -2.36 1.06 -0.13 2.90 0.04 -1.26 -4.68 135.00 130.56 1b4j s PRO 123 Ca 0.48 0.49 0.01 0.00 0.04 0.00 0.00 61.00 62.02 1b4j s PRO 123 Cb -0.14 -1.81 0.02 0.00 0.04 0.00 0.00 34.50 32.60 1b4j s PRO 123 CO 0.20 -2.30 -0.16 -1.12 0.04 0.00 0.00 177.00 173.66 1b4j s SER 124 N -3.74 2.68 -0.25 6.66 0.01 -0.37 -4.92 113.70 113.78 1b4j s SER 124 Ca 0.64 -0.49 -0.14 0.00 1.31 0.00 0.00 55.95 57.26 1b4j s SER 124 Cb -0.16 -1.20 -0.04 0.00 0.21 0.00 0.00 66.02 64.83 1b4j s SER 124 CO 0.55 -0.01 0.34 0.68 0.41 0.00 0.00 173.24 175.21 1b4j s VAL 125 N 1.21 5.22 -0.03 3.43 -7.23 -1.25 0.04 120.40 121.78 1b4j s VAL 125 Ca -0.01 0.53 0.07 0.00 -1.81 0.00 0.00 61.98 60.76 1b4j s VAL 125 Cb -0.14 -3.67 -0.02 0.00 0.56 0.00 0.00 36.38 33.11 1b4j s VAL 125 CO -0.06 0.22 -0.25 -0.36 -0.31 0.00 0.00 175.10 174.34 1b4j s PHE 126 N 1.70 2.39 0.07 2.82 0.08 0.11 -4.92 117.98 120.22 1b4j s PHE 126 Ca 0.14 -0.46 -0.31 0.00 0.12 0.00 0.00 56.93 56.42 1b4j s PHE 126 Cb -0.15 -1.53 -0.07 0.00 -0.57 0.00 0.00 43.02 40.69 1b4j s PHE 126 CO 0.09 -0.05 1.47 -1.25 -0.10 0.00 0.00 175.22 175.37 1b4j s PRO 127 N -0.54 4.27 -1.12 0.24 0.04 -1.26 -0.89 135.00 135.75 1b4j s PRO 127 Ca 0.08 2.12 -0.07 0.00 0.04 0.00 0.00 61.00 63.16 1b4j s PRO 127 Cb -0.11 -3.44 0.28 0.00 0.04 0.00 0.00 34.50 31.28 1b4j s PRO 127 CO 0.00 -0.57 1.31 1.28 0.04 0.00 0.00 177.00 179.06 1b4j n LEU 128 N 4.83 5.90 -4.60 -3.56 7.99 0.23 -4.91 117.00 122.88 1b4j n LEU 128 Ca 0.13 -5.06 -0.49 0.00 -0.01 0.00 0.00 56.01 50.58 1b4j n LEU 128 Cb 0.42 -1.41 -0.04 0.00 -0.11 0.00 0.00 43.42 42.28 1b4j n LEU 128 CO 0.60 1.45 0.86 0.00 -1.51 0.00 0.00 177.39 178.79 1b4j n ALA 129 N 2.36 -0.37 -0.44 -1.18 0.00 -1.26 -1.57 120.51 118.04 1b4j n ALA 129 Ca 0.26 0.47 -0.17 0.00 0.00 0.00 0.00 53.44 54.00 1b4j n ALA 129 Cb 0.37 -2.11 -0.03 0.00 0.00 0.00 0.00 19.45 17.68 1b4j n ALA 129 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1b4j n PRO 130 N 2.20 0.00 -3.63 0.00 -0.02 -1.26 -4.88 135.00 127.42 1b4j n PRO 130 Ca 0.16 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.25 1b4j n PRO 130 Cb 0.24 -0.38 -0.08 0.00 -0.02 0.00 0.00 33.50 33.26 1b4j n PRO 130 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1b4j s SER 131 N 0.72 5.59 -0.02 2.55 0.15 -0.02 -4.68 113.70 117.99 1b4j s SER 131 Ca 0.26 -2.68 0.09 0.00 0.70 0.00 0.00 55.95 54.33 1b4j s SER 131 Cb -0.38 -1.94 0.16 0.00 -1.71 0.00 0.00 66.02 62.15 1b4j s SER 131 CO 0.20 -0.45 1.07 -0.24 1.20 0.00 0.00 173.24 175.02 1b4j n SER 132 N 3.79 0.56 0.00 5.45 2.88 -1.26 -2.94 113.62 122.10 1b4j n SER 132 Ca 0.07 -2.18 0.00 0.00 -1.33 0.00 0.00 58.87 55.43 1b4j n SER 132 Cb 0.40 -0.26 0.00 0.00 -0.75 0.00 0.00 64.21 63.60 1b4j n SER 132 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1b4j n LYS 133 N -0.05 0.00 0.06 -1.46 4.01 -1.26 -2.71 118.16 116.75 1b4j n LYS 133 Ca 0.04 0.00 0.13 0.00 -0.51 0.00 0.00 58.31 57.97 1b4j n LYS 133 Cb 0.82 -0.14 0.42 0.00 -0.51 0.00 0.00 35.03 35.61 1b4j n LYS 133 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1b4j n SER 134 N 0.00 0.53 -0.69 4.39 7.64 -1.26 -3.08 113.62 121.15 1b4j n SER 134 Ca 0.00 0.41 -0.00 0.00 1.01 0.00 0.00 58.87 60.29 1b4j n SER 134 Cb 0.00 -0.47 0.01 0.00 -1.01 0.00 0.00 64.21 62.74 1b4j n SER 134 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1b4j n THR 135 N -1.95 0.38 1.82 0.44 -2.24 -1.26 -4.05 114.28 107.42 1b4j n THR 135 Ca 0.06 -0.06 0.03 0.00 -2.27 0.00 0.00 64.05 61.81 1b4j n THR 135 Cb 0.40 -0.62 0.17 0.00 -2.10 0.00 0.00 70.33 68.17 1b4j n THR 135 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1b4j n SER 136 N 0.14 0.32 -3.55 3.42 3.41 -1.10 -4.29 113.62 111.96 1b4j n SER 136 Ca 0.01 -1.85 -0.41 0.00 -0.26 0.00 0.00 58.87 56.37 1b4j n SER 136 Cb 0.36 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.22 1b4j n SER 136 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b4j n GLY 137 N 0.67 2.39 5.00 5.00 0.00 -1.26 -4.55 105.19 112.44 1b4j n GLY 137 Ca 0.05 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1b4j n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4j n GLY 138 N 4.49 1.48 3.32 -0.02 0.00 -1.26 -4.88 105.19 108.32 1b4j n GLY 138 Ca 0.48 -0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.22 1b4j n GLY 138 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b4j s THR 139 N 0.00 1.96 0.09 2.61 -4.23 -1.26 0.40 115.64 115.21 1b4j s THR 139 Ca 0.00 -1.42 0.06 0.00 -1.18 0.00 0.00 61.69 59.16 1b4j s THR 139 Cb 0.00 -1.71 -0.03 0.00 1.34 0.00 0.00 72.50 72.10 1b4j s THR 139 CO 0.00 0.22 -0.16 0.00 -0.54 0.00 0.00 174.62 174.13 1b4j s ALA 140 N -0.89 1.41 0.11 3.99 0.00 -0.85 -4.55 121.76 120.98 1b4j s ALA 140 Ca 0.10 -1.11 0.07 0.00 0.00 0.00 0.00 51.96 51.02 1b4j s ALA 140 Cb -0.10 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 1b4j s ALA 140 CO 0.03 0.23 -0.07 0.00 0.00 0.00 0.00 175.76 175.94 1b4j s ALA 141 N -1.31 3.05 0.15 0.00 0.00 -1.15 -0.74 121.76 121.75 1b4j s ALA 141 Ca 0.02 -1.25 -0.19 0.00 0.00 0.00 0.00 51.96 50.55 1b4j s ALA 141 Cb -0.10 -0.95 0.04 0.00 0.00 0.00 0.00 23.12 22.11 1b4j s ALA 141 CO 0.03 0.63 0.50 -0.48 0.00 0.00 0.00 175.76 176.43 1b4j s LEU 142 N -2.34 0.01 0.00 0.00 0.05 -1.20 -0.84 118.68 114.36 1b4j s LEU 142 Ca 0.23 -0.26 0.00 0.00 0.05 0.00 0.00 54.13 54.15 1b4j s LEU 142 Cb -0.11 2.16 0.00 0.00 -2.05 0.00 0.00 46.19 46.19 1b4j s LEU 142 CO 0.15 -0.94 0.00 0.61 -0.55 0.00 0.00 176.35 175.62 1b4j n GLY 143 N -0.30 1.52 2.99 -3.48 0.00 -0.61 -1.38 105.19 103.93 1b4j n GLY 143 Ca -0.15 -0.89 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 1b4j n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4j s LEU 145 N 0.77 5.13 -0.97 0.00 2.96 -0.07 -1.38 118.68 125.12 1b4j s LEU 145 Ca -0.13 -0.91 -0.13 0.00 -0.22 0.00 0.00 54.13 52.74 1b4j s LEU 145 Cb -0.15 -2.17 0.22 0.00 0.50 0.00 0.00 46.19 44.58 1b4j s LEU 145 CO 0.02 -0.46 1.00 -0.69 -1.32 0.00 0.00 176.35 174.90 1b4j s VAL 146 N 1.69 5.52 0.57 1.68 1.01 -1.08 -0.71 120.40 129.08 1b4j s VAL 146 Ca 0.05 -2.62 -0.09 0.00 0.00 0.00 0.00 61.98 59.32 1b4j s VAL 146 Cb -0.19 -4.61 -0.04 0.00 0.00 0.00 0.00 36.38 31.54 1b4j s VAL 146 CO 0.10 -1.22 0.94 -0.75 0.00 0.00 0.00 175.10 174.17 1b4j s LYS 147 N 0.32 3.58 -0.37 2.72 2.20 0.11 -2.21 119.74 126.08 1b4j s LYS 147 Ca 0.27 0.55 -0.15 0.00 -0.36 0.00 0.00 55.97 56.28 1b4j s LYS 147 Cb -0.08 -2.19 0.02 0.00 -1.51 0.00 0.00 37.83 34.07 1b4j s LYS 147 CO -0.08 -0.44 0.40 -0.25 -0.36 0.00 0.00 175.35 174.62 1b4j n ASP 148 N -2.57 -3.20 -4.15 1.43 8.00 -0.70 -1.24 116.55 114.11 1b4j n ASP 148 Ca 0.04 -0.31 -0.16 0.00 0.71 0.00 0.00 54.79 55.07 1b4j n ASP 148 Cb 0.54 -0.98 -0.11 0.00 -0.02 0.00 0.00 41.12 40.55 1b4j n ASP 148 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1b4j s TYR 149 N -1.59 1.07 -0.17 1.24 -0.85 -0.83 -4.22 117.35 112.00 1b4j s TYR 149 Ca 0.14 -0.53 -0.11 0.00 -0.52 0.00 0.00 57.07 56.06 1b4j s TYR 149 Cb -0.01 -0.60 0.05 0.00 0.38 0.00 0.00 41.96 41.78 1b4j s TYR 149 CO 0.55 0.02 0.42 0.12 -1.52 0.00 0.00 175.55 175.13 1b4j s PHE 150 N -1.68 -0.57 0.00 -3.49 2.19 -0.79 -1.42 117.98 112.22 1b4j s PHE 150 Ca -0.01 1.26 0.00 0.00 0.33 0.00 0.00 56.93 58.51 1b4j s PHE 150 Cb -0.08 0.24 0.00 0.00 -1.31 0.00 0.00 43.02 41.88 1b4j s PHE 150 CO 0.01 -0.31 0.00 -0.35 1.83 0.00 0.00 175.22 176.40 1b4j n PRO 151 N 3.86 2.47 -4.24 10.12 -0.04 -1.26 -0.80 135.00 145.11 1b4j n PRO 151 Ca -0.20 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.03 1b4j n PRO 151 Cb 0.56 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.95 1b4j n PRO 151 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1b4j s GLU 152 N 3.46 2.35 0.50 0.54 2.02 -1.26 -4.77 118.70 121.54 1b4j s GLU 152 Ca 0.00 -1.43 0.06 0.00 0.02 0.00 0.00 54.97 53.62 1b4j s GLU 152 Cb 0.00 -2.19 0.06 0.00 0.10 0.00 0.00 34.13 32.11 1b4j s GLU 152 CO 0.00 0.30 0.51 -0.35 0.02 0.00 0.00 175.26 175.74 1b4j n PRO 153 N -0.98 0.72 -3.44 0.39 -0.04 -1.26 -4.95 135.00 125.44 1b4j n PRO 153 Ca -0.06 -2.93 -0.27 0.00 -0.04 0.00 0.00 63.50 60.20 1b4j n PRO 153 Cb 0.60 0.10 -0.11 0.00 -0.04 0.00 0.00 33.50 34.05 1b4j n PRO 153 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1b4j s VAL 154 N -2.32 0.46 0.57 0.52 0.11 -1.26 -4.13 120.40 114.35 1b4j s VAL 154 Ca 0.39 -2.58 -0.18 0.00 -2.93 0.00 0.00 61.98 56.68 1b4j s VAL 154 Cb -0.03 -1.33 -0.11 0.00 -1.53 0.00 0.00 36.38 33.37 1b4j s VAL 154 CO 0.24 -1.18 0.21 0.41 -3.33 0.00 0.00 175.10 171.46 1b4j n THR 155 N 3.01 1.21 -3.54 5.04 -1.04 -1.22 -4.64 114.28 113.10 1b4j n THR 155 Ca 0.26 -0.49 -0.22 0.00 -2.04 0.00 0.00 64.05 61.55 1b4j n THR 155 Cb 0.45 -0.38 -0.15 0.00 -1.82 0.00 0.00 70.33 68.43 1b4j n THR 155 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1b4j s VAL 156 N -1.86 -0.21 0.07 12.58 1.01 -1.26 -2.35 120.40 128.39 1b4j s VAL 156 Ca 0.63 -0.21 0.05 0.00 0.00 0.00 0.00 61.98 62.45 1b4j s VAL 156 Cb -0.45 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 1b4j s VAL 156 CO 0.60 -0.30 -0.07 -0.44 0.00 0.00 0.00 175.10 174.90 1b4j s SER 157 N 2.23 4.62 -0.23 3.32 0.01 -0.73 -4.93 113.70 117.99 1b4j s SER 157 Ca 0.05 -0.26 -0.04 0.00 1.31 0.00 0.00 55.95 57.01 1b4j s SER 157 Cb -0.16 -1.00 -0.01 0.00 0.21 0.00 0.00 66.02 65.06 1b4j s SER 157 CO -0.14 0.21 -0.02 0.26 0.41 0.00 0.00 173.24 173.97 1b4j s TRP 158 N -1.17 3.00 -0.89 2.43 0.52 -1.26 0.85 118.94 122.42 1b4j s TRP 158 Ca 0.21 -0.91 -0.01 0.00 0.02 0.00 0.00 56.10 55.41 1b4j s TRP 158 Cb -0.11 -2.14 0.00 0.00 -1.15 0.00 0.00 33.47 30.07 1b4j s TRP 158 CO 0.13 -0.54 0.74 0.09 0.02 0.00 0.00 176.95 177.39 1b4j n ASN 159 N 4.81 -2.48 -0.65 2.95 4.13 0.16 -2.72 115.26 121.46 1b4j n ASN 159 Ca -0.17 -0.44 -0.07 0.00 1.68 0.00 0.00 54.58 55.58 1b4j n ASN 159 Cb 0.50 -3.84 -0.03 0.00 -1.54 0.00 0.00 39.78 34.87 1b4j n ASN 159 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1b4j n SER 160 N -2.43 -4.17 0.00 6.41 7.64 -1.26 -0.28 113.62 119.53 1b4j n SER 160 Ca -0.18 0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.87 1b4j n SER 160 Cb 0.61 -3.11 0.00 0.00 -1.01 0.00 0.00 64.21 60.70 1b4j n SER 160 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1b4j n GLY 161 N 0.27 1.06 0.13 0.23 0.00 -1.10 -4.99 105.19 100.77 1b4j n GLY 161 Ca -0.07 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 1b4j n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4j h ALA 162 N 0.00 0.13 -2.43 4.61 0.00 -0.64 -3.41 119.26 117.53 1b4j h ALA 162 Ca 0.00 -0.43 -0.68 0.00 0.00 0.00 0.00 54.91 53.80 1b4j h ALA 162 Cb 0.00 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 17.60 1b4j h ALA 162 CO 0.00 0.16 -0.21 -1.17 0.00 0.00 0.00 179.25 178.03 1b4j s LEU 163 N -8.74 4.73 -0.28 0.00 0.20 -1.15 -4.91 118.68 108.53 1b4j s LEU 163 Ca -0.14 -0.53 0.16 0.00 0.69 0.00 0.00 54.13 54.30 1b4j s LEU 163 Cb 0.04 -2.39 0.49 0.00 -0.43 0.00 0.00 46.19 43.89 1b4j s LEU 163 CO 0.77 -0.52 1.14 0.35 -0.29 0.00 0.00 176.35 177.79 1b4j n THR 164 N 5.40 1.81 -3.62 3.68 -2.24 -1.26 -4.35 114.28 113.70 1b4j n THR 164 Ca -0.07 -3.51 -0.19 0.00 -2.27 0.00 0.00 64.05 58.00 1b4j n THR 164 Cb 0.48 0.21 -0.15 0.00 -2.10 0.00 0.00 70.33 68.76 1b4j n THR 164 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1b4j s SER 165 N -3.69 1.20 0.00 3.42 1.04 -1.26 -4.77 113.70 109.63 1b4j s SER 165 Ca 0.37 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.83 1b4j s SER 165 Cb 0.36 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.66 1b4j s SER 165 CO -0.01 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.54 1b4j n GLY 166 N 5.31 0.71 3.71 7.32 0.00 -1.26 -4.80 105.19 116.19 1b4j n GLY 166 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1b4j n GLY 166 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b4j s VAL 167 N -2.45 4.61 -0.11 1.61 -7.23 -1.26 -2.89 120.40 112.68 1b4j s VAL 167 Ca 0.00 1.89 0.03 0.00 -1.81 0.00 0.00 61.98 62.09 1b4j s VAL 167 Cb 0.00 -4.21 0.01 0.00 0.56 0.00 0.00 36.38 32.74 1b4j s VAL 167 CO 0.00 0.16 -0.20 -1.00 -0.31 0.00 0.00 175.10 173.75 1b4j s HIS 168 N 0.96 2.34 -0.73 2.82 3.76 0.15 -4.96 115.29 119.63 1b4j s HIS 168 Ca 0.54 -1.08 0.04 0.00 -0.15 0.00 0.00 55.06 54.41 1b4j s HIS 168 Cb -0.24 -1.61 0.23 0.00 1.11 0.00 0.00 32.58 32.07 1b4j s HIS 168 CO 0.29 -0.49 0.73 2.41 -0.85 0.00 0.00 174.74 176.82 1b4j n THR 169 N 3.93 2.46 -1.04 1.30 -1.04 -1.26 0.71 114.28 119.34 1b4j n THR 169 Ca -0.20 -5.16 -0.36 0.00 -2.04 0.00 0.00 64.05 56.29 1b4j n THR 169 Cb 0.52 -2.16 0.04 0.00 -1.82 0.00 0.00 70.33 66.91 1b4j n THR 169 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1b4j n PHE 170 N 1.41 -4.14 -2.36 -1.42 3.01 -0.62 -4.90 117.46 108.44 1b4j n PHE 170 Ca 0.25 0.10 -0.42 0.00 1.01 0.00 0.00 57.45 58.40 1b4j n PHE 170 Cb 0.38 -1.54 -0.03 0.00 -0.01 0.00 0.00 39.48 38.27 1b4j n PHE 170 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 1b4j s PRO 171 N -2.04 4.43 0.32 -1.08 0.02 -1.26 -4.34 135.00 131.05 1b4j s PRO 171 Ca 0.46 1.85 -0.29 0.00 0.02 0.00 0.00 61.00 63.05 1b4j s PRO 171 Cb -0.25 -3.30 -0.10 0.00 0.02 0.00 0.00 34.50 30.87 1b4j s PRO 171 CO 0.77 -0.24 1.28 0.00 -0.33 0.00 0.00 177.00 178.48 1b4j s ALA 172 N 0.73 3.49 -0.07 -1.55 0.00 -1.26 -4.82 121.76 118.28 1b4j s ALA 172 Ca 0.58 1.21 0.02 0.00 0.00 0.00 0.00 51.96 53.77 1b4j s ALA 172 Cb -0.32 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.32 1b4j s ALA 172 CO 0.32 -0.57 -0.12 0.14 0.00 0.00 0.00 175.76 175.52 1b4j s VAL 173 N -1.11 3.21 0.43 0.00 -7.23 0.40 -4.86 120.40 111.23 1b4j s VAL 173 Ca 0.48 -0.65 -0.24 0.00 -1.81 0.00 0.00 61.98 59.76 1b4j s VAL 173 Cb -0.39 -2.29 -0.08 0.00 0.56 0.00 0.00 36.38 34.18 1b4j s VAL 173 CO 0.51 0.58 1.20 -0.22 -0.31 0.00 0.00 175.10 176.86 1b4j s LEU 174 N -0.52 4.12 0.47 1.32 2.96 -1.26 -1.73 118.68 124.04 1b4j s LEU 174 Ca 0.07 2.40 0.06 0.00 -0.22 0.00 0.00 54.13 56.45 1b4j s LEU 174 Cb -0.12 -4.08 -0.01 0.00 0.50 0.00 0.00 46.19 42.48 1b4j s LEU 174 CO 0.02 -0.82 0.26 -1.10 -1.32 0.00 0.00 176.35 173.39 1b4j s GLN 175 N -2.44 2.27 0.66 1.98 -0.21 -0.91 -4.92 119.66 116.08 1b4j s GLN 175 Ca 0.60 -1.94 0.38 0.00 0.02 0.00 0.00 55.36 54.42 1b4j s GLN 175 Cb -0.32 -2.01 2.08 0.00 1.00 0.00 0.00 33.01 33.76 1b4j s GLN 175 CO 0.39 -0.33 2.18 0.77 -2.12 0.00 0.00 175.29 176.18 1b4j h SER 176 N 1.13 0.00 1.49 5.90 0.02 -1.96 -0.38 113.55 119.75 1b4j h SER 176 Ca -0.41 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 1b4j h SER 176 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1b4j h SER 176 CO 0.65 0.00 -0.09 0.77 -1.14 0.00 0.00 176.83 177.01 1b4j h SER 177 N 0.00 0.00 0.00 3.07 4.64 -2.01 -3.47 113.55 115.78 1b4j h SER 177 Ca 0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1b4j h SER 177 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1b4j h SER 177 CO -0.00 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1b4j n GLY 178 N 1.27 1.80 3.86 -0.77 0.00 -0.15 -5.01 105.19 106.20 1b4j n GLY 178 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1b4j n GLY 178 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b4j s LEU 179 N 0.00 4.42 0.62 0.99 1.43 -1.26 -4.82 118.68 120.06 1b4j s LEU 179 Ca 0.00 0.67 -0.07 0.00 -1.03 0.00 0.00 54.13 53.70 1b4j s LEU 179 Cb 0.00 -2.36 0.01 0.00 0.03 0.00 0.00 46.19 43.87 1b4j s LEU 179 CO 0.00 0.35 0.94 -0.31 0.23 0.00 0.00 176.35 177.56 1b4j s TYR 180 N -1.09 3.24 -0.03 0.29 2.02 -0.50 -2.15 117.35 119.12 1b4j s TYR 180 Ca 0.20 0.70 -0.01 0.00 -0.37 0.00 0.00 57.07 57.59 1b4j s TYR 180 Cb -0.14 -2.83 0.03 0.00 -0.40 0.00 0.00 41.96 38.62 1b4j s TYR 180 CO 0.09 -0.93 0.04 0.45 -1.57 0.00 0.00 175.55 173.64 1b4j s SER 181 N -4.33 0.60 0.48 2.29 0.15 -0.71 -1.72 113.70 110.46 1b4j s SER 181 Ca 0.55 0.04 0.04 0.00 0.70 0.00 0.00 55.95 57.28 1b4j s SER 181 Cb -0.11 -0.13 -0.03 0.00 -1.71 0.00 0.00 66.02 64.04 1b4j s SER 181 CO 0.46 -0.17 0.09 -0.22 1.20 0.00 0.00 173.24 174.59 1b4j s LEU 182 N 1.53 2.62 -0.29 3.45 0.20 -0.94 -0.45 118.68 124.80 1b4j s LEU 182 Ca -0.03 -1.44 -0.15 0.00 0.69 0.00 0.00 54.13 53.20 1b4j s LEU 182 Cb -0.13 -0.95 0.13 0.00 -0.43 0.00 0.00 46.19 44.82 1b4j s LEU 182 CO -0.03 -0.74 0.86 -0.55 -0.29 0.00 0.00 176.35 175.60 1b4j s SER 183 N -3.90 -0.73 -0.10 3.68 0.15 -1.26 -2.62 113.70 108.91 1b4j s SER 183 Ca 0.22 1.11 0.03 0.00 0.70 0.00 0.00 55.95 58.01 1b4j s SER 183 Cb 0.03 1.52 -0.01 0.00 -1.71 0.00 0.00 66.02 65.86 1b4j s SER 183 CO 0.12 -0.17 -0.21 -0.55 1.20 0.00 0.00 173.24 173.64 1b4j s SER 184 N 1.90 3.38 -0.07 5.45 0.15 -0.48 -1.59 113.70 122.44 1b4j s SER 184 Ca -0.07 -0.48 0.02 0.00 0.70 0.00 0.00 55.95 56.12 1b4j s SER 184 Cb -0.06 -1.38 0.01 0.00 -1.71 0.00 0.00 66.02 62.88 1b4j s SER 184 CO -0.17 0.18 -0.13 -0.69 1.20 0.00 0.00 173.24 173.63 1b4j s VAL 185 N 0.25 1.19 -0.18 4.45 1.01 0.22 -0.65 120.40 126.69 1b4j s VAL 185 Ca -0.14 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1b4j s VAL 185 Cb -0.17 -1.09 0.03 0.00 0.00 0.00 0.00 36.38 35.15 1b4j s VAL 185 CO 0.07 0.37 -0.17 0.54 0.00 0.00 0.00 175.10 175.92 1b4j s VAL 186 N 0.73 1.90 0.12 2.92 0.11 -0.48 0.34 120.40 126.05 1b4j s VAL 186 Ca -0.13 -0.94 -0.30 0.00 -2.93 0.00 0.00 61.98 57.68 1b4j s VAL 186 Cb -0.16 -1.79 -0.06 0.00 -1.53 0.00 0.00 36.38 32.84 1b4j s VAL 186 CO 0.03 0.42 1.00 0.42 -3.33 0.00 0.00 175.10 173.64 1b4j s THR 187 N 1.33 4.36 -0.22 5.04 -4.23 -1.14 -3.24 115.64 117.54 1b4j s THR 187 Ca 0.03 1.96 -0.15 0.00 -1.18 0.00 0.00 61.69 62.35 1b4j s THR 187 Cb -0.14 -4.25 0.07 0.00 1.34 0.00 0.00 72.50 69.51 1b4j s THR 187 CO -0.11 0.30 0.56 0.54 -0.54 0.00 0.00 174.62 175.37 1b4j s VAL 188 N 0.00 -0.01 -0.09 2.29 0.11 0.08 -4.76 120.40 118.02 1b4j s VAL 188 Ca 0.48 0.03 -0.08 0.00 -2.93 0.00 0.00 61.98 59.48 1b4j s VAL 188 Cb -0.25 -0.81 -0.04 0.00 -1.53 0.00 0.00 36.38 33.76 1b4j s VAL 188 CO 0.31 0.01 0.39 -0.81 -3.33 0.00 0.00 175.10 171.67 1b4j n PRO 189 N 3.88 0.00 -0.41 1.54 -0.04 -1.26 -2.01 135.00 136.70 1b4j n PRO 189 Ca -0.19 0.00 0.37 0.00 -0.04 0.00 0.00 63.50 63.63 1b4j n PRO 189 Cb 0.57 -0.28 0.64 0.00 -0.04 0.00 0.00 33.50 34.39 1b4j n PRO 189 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1b4j h SER 190 N 1.58 0.25 0.39 3.54 0.02 -0.30 0.15 113.55 119.19 1b4j h SER 190 Ca -0.03 0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1b4j h SER 190 Cb 0.26 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.01 1b4j h SER 190 CO 0.20 -0.33 -0.19 -1.28 -1.14 0.00 0.00 176.83 174.09 1b4j h SER 191 N 0.01 -0.44 -0.34 3.07 0.87 -1.88 -3.26 113.55 111.57 1b4j h SER 191 Ca 0.87 0.02 0.10 0.00 -1.23 0.00 0.00 61.79 61.54 1b4j h SER 191 Cb 2.59 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 64.65 1b4j h SER 191 CO -0.59 -0.24 1.00 0.77 -0.53 0.00 0.00 176.83 177.23 1b4j h SER 192 N -0.66 0.00 -0.09 6.23 4.64 -1.04 -3.33 113.55 119.30 1b4j h SER 192 Ca -0.05 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.76 1b4j h SER 192 Cb 0.40 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.55 1b4j h SER 192 CO 0.09 0.00 1.57 0.18 -0.87 0.00 0.00 176.83 177.80 1b4j n LEU 193 N -2.81 2.71 0.00 5.97 4.32 -1.14 0.79 117.00 126.84 1b4j n LEU 193 Ca 0.08 -2.49 0.00 0.00 -0.02 0.00 0.00 56.01 53.57 1b4j n LEU 193 Cb 1.11 -1.11 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1b4j n LEU 193 CO 0.10 -1.45 0.00 0.61 -1.22 0.00 0.00 177.39 175.42 1b4j n GLY 194 N 5.05 3.83 0.28 -0.72 0.00 -1.25 -4.88 105.19 107.50 1b4j n GLY 194 Ca 0.47 -0.58 0.18 0.00 0.00 0.00 0.00 46.02 46.09 1b4j n GLY 194 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1b4j h THR 195 N 0.00 0.00 -3.40 2.61 2.02 -0.93 -3.44 112.91 109.77 1b4j h THR 195 Ca 0.00 -0.33 -0.05 0.00 0.77 0.00 0.00 66.41 66.80 1b4j h THR 195 Cb 0.00 1.28 -0.13 0.00 -1.74 0.00 0.00 68.15 67.56 1b4j h THR 195 CO 0.00 0.00 -0.09 -1.10 0.37 0.00 0.00 175.52 174.70 1b4j s GLN 196 N -3.77 1.05 -0.14 6.66 -0.21 0.24 -5.00 119.66 118.49 1b4j s GLN 196 Ca -0.00 -0.70 -0.03 0.00 0.02 0.00 0.00 55.36 54.64 1b4j s GLN 196 Cb 0.10 0.46 -0.03 0.00 1.00 0.00 0.00 33.01 34.54 1b4j s GLN 196 CO 0.48 -0.40 -0.03 0.99 -2.12 0.00 0.00 175.29 174.20 1b4j s THR 197 N -3.74 3.95 -0.11 -0.19 2.01 -1.26 -4.58 115.64 111.72 1b4j s THR 197 Ca 0.03 -0.35 -0.00 0.00 0.31 0.00 0.00 61.69 61.68 1b4j s THR 197 Cb 0.02 -2.72 -0.02 0.00 0.01 0.00 0.00 72.50 69.79 1b4j s THR 197 CO -0.11 0.51 -0.10 -0.31 -0.69 0.00 0.00 174.62 173.92 1b4j s TYR 198 N 0.12 2.87 -0.03 4.92 2.02 -1.26 -5.02 117.35 120.97 1b4j s TYR 198 Ca -0.01 -0.36 -0.00 0.00 -0.37 0.00 0.00 57.07 56.33 1b4j s TYR 198 Cb -0.14 -1.82 0.03 0.00 -0.40 0.00 0.00 41.96 39.64 1b4j s TYR 198 CO 0.03 -0.01 0.02 0.42 -1.57 0.00 0.00 175.55 174.44 1b4j s ILE 199 N -0.02 0.03 0.07 2.71 1.01 -1.26 -2.41 121.20 121.33 1b4j s ILE 199 Ca -0.02 0.19 -0.01 0.00 0.00 0.00 0.00 60.65 60.81 1b4j s ILE 199 Cb -0.14 -0.17 -0.04 0.00 0.01 0.00 0.00 42.46 42.12 1b4j s ILE 199 CO 0.03 0.12 0.23 0.00 0.00 0.00 0.00 174.94 175.33 1b4j s ASN 201 N -2.46 4.49 0.34 0.00 0.02 0.25 -2.98 114.94 114.60 1b4j s ASN 201 Ca 0.35 -2.63 -0.12 0.00 -1.02 0.00 0.00 52.86 49.44 1b4j s ASN 201 Cb -0.13 -1.62 -0.08 0.00 0.02 0.00 0.00 41.25 39.45 1b4j s ASN 201 CO 0.27 -0.30 0.72 -0.69 0.02 0.00 0.00 177.10 177.12 1b4j s VAL 202 N 0.25 4.76 -0.48 1.60 1.01 -0.93 -1.77 120.40 124.83 1b4j s VAL 202 Ca 0.14 0.75 0.07 0.00 0.00 0.00 0.00 61.98 62.94 1b4j s VAL 202 Cb -0.23 -3.66 0.19 0.00 0.00 0.00 0.00 36.38 32.68 1b4j s VAL 202 CO -0.04 -0.29 0.68 0.21 0.00 0.00 0.00 175.10 175.66 1b4j s ASN 203 N -2.62 -1.36 -0.21 3.32 3.04 -0.99 -2.91 114.94 113.21 1b4j s ASN 203 Ca 0.52 -1.46 -0.24 0.00 0.04 0.00 0.00 52.86 51.72 1b4j s ASN 203 Cb -0.10 1.84 -0.01 0.00 -1.54 0.00 0.00 41.25 41.43 1b4j s ASN 203 CO 0.23 -0.10 0.79 -2.28 -3.04 0.00 0.00 177.10 172.70 1b4j s HIS 204 N 1.18 3.36 -0.03 0.43 5.65 -0.73 -3.41 115.29 121.73 1b4j s HIS 204 Ca 0.25 1.12 -0.21 0.00 0.25 0.00 0.00 55.06 56.48 1b4j s HIS 204 Cb -0.02 -2.98 -0.28 0.00 -1.18 0.00 0.00 32.58 28.12 1b4j s HIS 204 CO -0.06 -0.30 0.98 0.87 -0.65 0.00 0.00 174.74 175.58 1b4j h LYS 205 N 7.54 0.34 -0.05 2.88 1.57 -1.76 0.39 116.57 127.47 1b4j h LYS 205 Ca -0.27 -0.47 0.04 0.00 -1.87 0.00 0.00 60.65 58.08 1b4j h LYS 205 Cb 1.12 0.16 -0.06 0.00 0.08 0.00 0.00 32.23 33.53 1b4j h LYS 205 CO 0.84 1.18 -0.35 -1.35 -0.57 0.00 0.00 179.45 179.19 1b4j h PRO 206 N -0.28 -0.46 0.00 3.15 0.11 -1.92 0.64 132.00 133.24 1b4j h PRO 206 Ca -0.11 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1b4j h PRO 206 Cb 1.49 0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.70 1b4j h PRO 206 CO 0.13 -0.30 0.00 0.66 -0.21 0.00 0.00 178.00 178.28 1b4j h SER 207 N -0.47 0.00 -2.95 -2.05 4.64 -1.85 -3.46 113.55 107.40 1b4j h SER 207 Ca 0.07 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.26 1b4j h SER 207 Cb 0.58 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.73 1b4j h SER 207 CO -0.32 0.00 -0.25 0.59 -0.87 0.00 0.00 176.83 175.98 1b4j n ASN 208 N -2.70 -2.87 -4.87 4.97 4.13 0.22 -4.88 115.26 109.26 1b4j n ASN 208 Ca 0.00 -0.20 -0.36 0.00 1.68 0.00 0.00 54.58 55.70 1b4j n ASN 208 Cb 0.21 -2.11 -0.06 0.00 -1.54 0.00 0.00 39.78 36.29 1b4j n ASN 208 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1b4j s THR 209 N -3.12 5.21 -0.47 3.41 2.01 0.14 -4.99 115.64 117.82 1b4j s THR 209 Ca 0.12 0.40 0.06 0.00 0.31 0.00 0.00 61.69 62.58 1b4j s THR 209 Cb -0.05 -3.60 0.27 0.00 0.01 0.00 0.00 72.50 69.13 1b4j s THR 209 CO 0.26 0.42 0.94 1.17 -0.69 0.00 0.00 174.62 176.72 1b4j n LYS 210 N 1.31 0.86 -2.46 4.92 4.81 -1.26 -1.77 118.16 124.56 1b4j n LYS 210 Ca -0.12 -1.88 -0.31 0.00 -0.87 0.00 0.00 58.31 55.12 1b4j n LYS 210 Cb 0.53 -1.33 -0.03 0.00 0.02 0.00 0.00 35.03 34.22 1b4j n LYS 210 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1b4j s VAL 211 N 0.43 4.64 -0.43 3.15 1.01 -1.15 -4.96 120.40 123.10 1b4j s VAL 211 Ca 0.29 0.97 0.10 0.00 0.00 0.00 0.00 61.98 63.35 1b4j s VAL 211 Cb 0.25 -3.75 0.38 0.00 0.00 0.00 0.00 36.38 33.26 1b4j s VAL 211 CO -0.18 -0.71 0.89 0.47 0.00 0.00 0.00 175.10 175.57 1b4j n ASP 212 N -1.69 2.48 -4.75 3.32 9.92 -1.26 -2.20 116.55 122.38 1b4j n ASP 212 Ca 0.05 -3.23 -0.39 0.00 -0.53 0.00 0.00 54.79 50.69 1b4j n ASP 212 Cb 0.54 -0.56 0.03 0.00 -0.64 0.00 0.00 41.12 40.49 1b4j n ASP 212 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1b4j n LYS 213 N -0.04 1.93 -3.95 -1.24 3.00 -1.16 -4.73 118.16 111.97 1b4j n LYS 213 Ca 0.25 0.70 -0.35 0.00 -0.00 0.00 0.00 58.31 58.91 1b4j n LYS 213 Cb 0.62 -2.59 -0.14 0.00 0.00 0.00 0.00 35.03 32.91 1b4j n LYS 213 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1b4j s LYS 214 N -2.69 3.20 -0.20 1.64 2.20 -1.26 -0.79 119.74 121.84 1b4j s LYS 214 Ca 0.67 -0.73 -0.11 0.00 -0.36 0.00 0.00 55.97 55.44 1b4j s LYS 214 Cb -0.43 -2.94 -0.05 0.00 -1.51 0.00 0.00 37.83 32.89 1b4j s LYS 214 CO 0.53 -0.25 0.19 0.14 -0.36 0.00 0.00 175.35 175.60 1b4j s VAL 215 N 1.42 5.37 0.05 4.02 -7.23 -1.01 -5.00 120.40 118.02 1b4j s VAL 215 Ca 0.05 0.30 -0.02 0.00 -1.81 0.00 0.00 61.98 60.49 1b4j s VAL 215 Cb -0.15 -3.53 -0.03 0.00 0.56 0.00 0.00 36.38 33.24 1b4j s VAL 215 CO -0.05 0.40 0.01 -1.83 -0.31 0.00 0.00 175.10 173.33 1b4j s GLU 216 N 0.55 0.63 0.17 4.82 -1.05 -1.26 -4.30 118.70 118.25 1b4j s GLU 216 Ca 0.11 -1.11 -0.20 0.00 -0.15 0.00 0.00 54.97 53.62 1b4j s GLU 216 Cb -0.12 0.23 -0.12 0.00 -0.44 0.00 0.00 34.13 33.67 1b4j s GLU 216 CO 0.01 -0.13 0.34 -2.30 0.95 0.00 0.00 175.26 174.12 1b4j n PRO 217 N 0.22 0.00 -3.04 -4.83 -0.02 -1.26 -4.47 135.00 121.60 1b4j n PRO 217 Ca -0.15 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 60.97 1b4j n PRO 217 Cb 0.61 -0.74 -0.06 0.00 -0.02 0.00 0.00 33.50 33.29 1b4j n PRO 217 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1b4j s LYS 218 N -0.74 4.25 -0.27 -0.52 2.47 -1.26 -4.93 119.74 118.75 1b4j s LYS 218 Ca 0.47 0.91 -0.05 0.00 -1.56 0.00 0.00 55.97 55.74 1b4j s LYS 218 Cb -0.65 -2.75 -0.13 0.00 -1.46 0.00 0.00 37.83 32.84 1b4j s LYS 218 CO 0.42 0.31 3.26 -1.13 0.16 0.00 0.00 175.35 178.37 1b4j n SER 219 N 0.42 5.92 0.00 1.43 3.41 -1.26 -5.07 113.62 118.47 1b4j n SER 219 Ca -0.00 -2.77 0.00 0.00 -0.26 0.00 0.00 58.87 55.84 1b4j n SER 219 Cb 0.51 -1.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 1b4j n SER 219 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88