#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dtx s SER 2 N 0.00 6.93 0.19 1.61 0.01 -1.26 -2.65 113.70 118.52 3dtx s SER 2 Ca 0.00 1.10 0.01 0.00 1.31 0.00 0.00 55.95 58.37 3dtx s SER 2 Cb 0.00 -2.31 -0.05 0.00 0.21 0.00 0.00 66.02 63.88 3dtx s SER 2 CO 0.00 0.27 0.03 -1.00 0.41 0.00 0.00 173.24 172.96 3dtx s HIS 3 N -0.94 1.27 0.02 2.43 0.09 -0.35 -4.99 115.29 112.82 3dtx s HIS 3 Ca 0.27 -1.09 -0.03 0.00 -0.00 0.00 0.00 55.06 54.21 3dtx s HIS 3 Cb -0.18 -0.72 -0.01 0.00 -0.00 0.00 0.00 32.58 31.66 3dtx s HIS 3 CO 0.16 -0.28 0.04 -1.54 -0.00 0.00 0.00 174.74 173.11 3dtx s SER 4 N -3.20 0.20 -0.04 1.40 1.04 -1.26 -0.85 113.70 110.98 3dtx s SER 4 Ca 0.28 -0.48 0.04 0.00 0.48 0.00 0.00 55.95 56.27 3dtx s SER 4 Cb 0.07 0.16 -0.00 0.00 0.10 0.00 0.00 66.02 66.34 3dtx s SER 4 CO 0.07 -0.39 -0.16 -0.32 0.98 0.00 0.00 173.24 173.42 3dtx s MET 5 N -1.90 1.65 0.01 4.02 -2.45 -0.21 -0.79 119.30 119.63 3dtx s MET 5 Ca -0.11 -0.55 0.01 0.00 -1.25 0.00 0.00 55.69 53.78 3dtx s MET 5 Cb -0.06 -1.44 -0.01 0.00 1.25 0.00 0.00 34.83 34.57 3dtx s MET 5 CO -0.02 0.21 -0.03 1.03 1.05 0.00 0.00 175.02 177.26 3dtx s ARG 6 N 0.10 0.27 -0.10 4.11 1.81 -0.49 -1.32 118.95 123.33 3dtx s ARG 6 Ca -0.04 -0.40 0.03 0.00 -1.72 0.00 0.00 55.73 53.60 3dtx s ARG 6 Cb -0.11 -0.07 0.01 0.00 -0.45 0.00 0.00 34.95 34.32 3dtx s ARG 6 CO 0.02 0.01 -0.19 0.71 -0.68 0.00 0.00 175.30 175.17 3dtx s TYR 7 N -0.82 2.20 -0.07 -0.53 2.02 0.07 -0.82 117.35 119.40 3dtx s TYR 7 Ca -0.08 -0.97 0.02 0.00 -0.37 0.00 0.00 57.07 55.68 3dtx s TYR 7 Cb -0.06 -1.52 -0.03 0.00 -0.40 0.00 0.00 41.96 39.95 3dtx s TYR 7 CO -0.00 -0.44 -0.11 -0.06 -1.57 0.00 0.00 175.55 173.37 3dtx s PHE 8 N 0.66 2.82 -0.02 2.71 0.08 -0.05 -1.97 117.98 122.21 3dtx s PHE 8 Ca -0.13 -0.16 0.02 0.00 0.12 0.00 0.00 56.93 56.78 3dtx s PHE 8 Cb -0.16 -1.70 0.00 0.00 -0.57 0.00 0.00 43.02 40.59 3dtx s PHE 8 CO 0.03 0.18 -0.05 -1.01 -0.10 0.00 0.00 175.22 174.27 3dtx s HIS 9 N -0.58 0.56 -0.06 0.36 3.76 0.81 -1.48 115.29 118.66 3dtx s HIS 9 Ca 0.08 -0.11 -0.01 0.00 -0.15 0.00 0.00 55.06 54.87 3dtx s HIS 9 Cb -0.12 -0.42 0.03 0.00 1.11 0.00 0.00 32.58 33.18 3dtx s HIS 9 CO 0.02 -0.06 0.01 0.99 -0.85 0.00 0.00 174.74 174.85 3dtx s THR 10 N 0.19 0.25 -0.10 1.30 2.01 -0.13 -1.26 115.64 117.90 3dtx s THR 10 Ca -0.02 0.16 0.01 0.00 0.31 0.00 0.00 61.69 62.15 3dtx s THR 10 Cb -0.06 -0.41 -0.02 0.00 0.01 0.00 0.00 72.50 72.02 3dtx s THR 10 CO -0.00 0.22 -0.11 -0.44 -0.69 0.00 0.00 174.62 173.59 3dtx s SER 11 N 1.77 4.20 -0.15 3.53 0.01 0.16 -1.49 113.70 121.73 3dtx s SER 11 Ca 0.01 -0.22 -0.01 0.00 1.31 0.00 0.00 55.95 57.04 3dtx s SER 11 Cb -0.13 -1.35 0.04 0.00 0.21 0.00 0.00 66.02 64.79 3dtx s SER 11 CO -0.04 0.24 -0.03 -0.69 0.41 0.00 0.00 173.24 173.13 3dtx s VAL 12 N -0.11 0.89 0.53 3.43 1.01 -0.36 -0.94 120.40 124.85 3dtx s VAL 12 Ca -0.01 -0.46 -0.18 0.00 0.00 0.00 0.00 61.98 61.33 3dtx s VAL 12 Cb -0.14 -1.10 -0.06 0.00 0.00 0.00 0.00 36.38 35.08 3dtx s VAL 12 CO 0.03 0.12 1.06 -0.94 0.00 0.00 0.00 175.10 175.37 3dtx s SER 13 N 1.73 6.05 -0.44 3.32 1.04 -0.27 -1.42 113.70 123.71 3dtx s SER 13 Ca 0.02 1.92 0.06 0.00 0.48 0.00 0.00 55.95 58.42 3dtx s SER 13 Cb -0.15 -2.55 0.20 0.00 0.10 0.00 0.00 66.02 63.62 3dtx s SER 13 CO -0.07 -0.98 0.52 -2.11 0.98 0.00 0.00 173.24 171.58 3dtx n ARG 14 N -1.41 0.44 -1.62 4.02 1.85 -1.26 -4.00 116.66 114.68 3dtx n ARG 14 Ca 0.09 -2.80 -0.51 0.00 -1.00 0.00 0.00 57.85 53.63 3dtx n ARG 14 Cb 0.52 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 30.37 3dtx n ARG 14 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 3dtx n PRO 15 N 2.41 1.34 -0.88 2.89 -0.02 -1.26 -0.73 135.00 138.76 3dtx n PRO 15 Ca 0.23 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 3dtx n PRO 15 Cb 0.52 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3dtx n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dtx n GLY 16 N 2.88 0.94 2.18 -1.23 0.00 -1.26 -4.85 105.19 103.86 3dtx n GLY 16 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 3dtx n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dtx n ARG 17 N -2.00 2.49 0.00 1.61 1.74 0.09 -5.12 116.66 115.48 3dtx n ARG 17 Ca 0.00 -3.70 0.00 0.00 -0.77 0.00 0.00 57.85 53.38 3dtx n ARG 17 Cb 0.00 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 29.62 3dtx n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dtx n GLY 18 N -0.62 -1.77 3.82 -0.13 0.00 -1.25 -4.89 105.19 100.36 3dtx n GLY 18 Ca 0.25 -1.42 -0.31 0.00 0.00 0.00 0.00 46.02 44.55 3dtx n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dtx s GLU 19 N 0.00 2.81 0.56 1.61 0.41 -1.26 -4.48 118.70 118.34 3dtx s GLU 19 Ca 0.00 0.93 -0.21 0.00 -0.41 0.00 0.00 54.97 55.28 3dtx s GLU 19 Cb 0.00 -1.98 -0.04 0.00 -1.78 0.00 0.00 34.13 30.33 3dtx s GLU 19 CO 0.00 -1.18 1.33 -2.14 -0.49 0.00 0.00 175.26 172.77 3dtx s PRO 20 N -5.05 3.09 0.05 0.39 0.02 -1.26 -4.71 135.00 127.52 3dtx s PRO 20 Ca 0.58 2.15 -0.31 0.00 0.02 0.00 0.00 61.00 63.45 3dtx s PRO 20 Cb -0.14 -2.19 -0.07 0.00 0.02 0.00 0.00 34.50 32.12 3dtx s PRO 20 CO 0.55 -1.20 1.44 0.50 -0.33 0.00 0.00 177.00 177.96 3dtx s ARG 21 N -2.98 4.28 -0.14 5.54 6.06 -0.51 -4.83 118.95 126.37 3dtx s ARG 21 Ca 0.73 2.06 0.02 0.00 -2.50 0.00 0.00 55.73 56.04 3dtx s ARG 21 Cb -0.39 -3.48 0.01 0.00 0.06 0.00 0.00 34.95 31.15 3dtx s ARG 21 CO 0.45 -0.56 -0.21 0.12 -2.50 0.00 0.00 175.30 172.60 3dtx s PHE 22 N 2.04 2.69 -0.08 5.12 5.36 -1.26 -1.22 117.98 130.63 3dtx s PHE 22 Ca 0.66 -1.27 -0.00 0.00 -0.96 0.00 0.00 56.93 55.35 3dtx s PHE 22 Cb -0.34 -1.82 0.02 0.00 -0.34 0.00 0.00 43.02 40.54 3dtx s PHE 22 CO 0.29 -0.58 -0.05 0.42 -1.46 0.00 0.00 175.22 173.84 3dtx s ILE 23 N 0.79 0.71 0.00 3.12 1.01 -0.56 -1.02 121.20 125.26 3dtx s ILE 23 Ca -0.07 -0.14 0.06 0.00 0.00 0.00 0.00 60.65 60.50 3dtx s ILE 23 Cb -0.16 -0.76 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 3dtx s ILE 23 CO -0.01 0.30 -0.18 0.28 0.00 0.00 0.00 174.94 175.32 3dtx s THR 24 N 1.47 1.45 0.08 2.92 -1.32 -0.57 -0.96 115.64 118.72 3dtx s THR 24 Ca -0.01 -0.89 0.06 0.00 -1.21 0.00 0.00 61.69 59.64 3dtx s THR 24 Cb -0.13 -1.23 -0.03 0.00 -1.51 0.00 0.00 72.50 69.60 3dtx s THR 24 CO -0.04 0.32 -0.16 0.68 -2.21 0.00 0.00 174.62 173.20 3dtx s VAL 25 N -0.55 1.32 -0.03 5.08 -7.23 -0.55 -0.93 120.40 117.50 3dtx s VAL 25 Ca 0.07 -1.38 0.04 0.00 -1.81 0.00 0.00 61.98 58.90 3dtx s VAL 25 Cb -0.07 -1.24 -0.03 0.00 0.56 0.00 0.00 36.38 35.60 3dtx s VAL 25 CO 0.00 -0.17 -0.15 -0.83 -0.31 0.00 0.00 175.10 173.64 3dtx s GLY 26 N -1.79 1.53 0.03 2.32 0.00 -0.28 -0.87 107.32 108.26 3dtx s GLY 26 Ca 0.01 -1.02 0.06 0.00 0.00 0.00 0.00 44.72 43.76 3dtx s GLY 26 CO 0.03 -0.84 -0.16 -0.19 0.00 0.00 0.00 173.10 171.94 3dtx s TYR 27 N -0.77 1.42 -0.18 1.90 2.02 0.00 -0.73 117.35 121.02 3dtx s TYR 27 Ca 0.12 -0.35 0.01 0.00 -0.37 0.00 0.00 57.07 56.48 3dtx s TYR 27 Cb -0.11 -0.85 0.01 0.00 -0.40 0.00 0.00 41.96 40.62 3dtx s TYR 27 CO 0.02 0.05 -0.18 0.08 -1.57 0.00 0.00 175.55 173.94 3dtx s VAL 28 N -0.78 2.27 0.00 0.71 1.01 -0.18 -1.40 120.40 122.03 3dtx s VAL 28 Ca 0.04 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.14 3dtx s VAL 28 Cb -0.08 -1.96 0.00 0.00 0.00 0.00 0.00 36.38 34.34 3dtx s VAL 28 CO 0.01 0.52 0.00 0.47 0.00 0.00 0.00 175.10 176.11 3dtx n ASP 29 N 4.52 0.00 -1.87 3.32 8.00 0.03 -1.14 116.55 129.41 3dtx n ASP 29 Ca -0.20 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.37 3dtx n ASP 29 Cb 0.50 0.00 0.40 0.00 -0.02 0.00 0.00 41.12 42.01 3dtx n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3dtx n ASP 30 N 2.92 5.69 -4.30 -2.24 8.00 -1.26 -4.86 116.55 120.51 3dtx n ASP 30 Ca 0.00 -2.92 -0.35 0.00 0.71 0.00 0.00 54.79 52.23 3dtx n ASP 30 Cb 0.00 -0.68 -0.14 0.00 -0.02 0.00 0.00 41.12 40.28 3dtx n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3dtx s THR 31 N -2.73 3.33 0.07 -3.53 2.01 -0.29 -5.00 115.64 109.49 3dtx s THR 31 Ca 0.55 -0.58 -0.31 0.00 0.31 0.00 0.00 61.69 61.66 3dtx s THR 31 Cb 0.41 -2.55 -0.06 0.00 0.01 0.00 0.00 72.50 70.31 3dtx s THR 31 CO 0.16 0.38 1.28 -0.22 -0.69 0.00 0.00 174.62 175.53 3dtx s LEU 32 N 1.46 4.36 0.00 4.42 2.96 -1.26 -1.01 118.68 129.61 3dtx s LEU 32 Ca 0.05 2.12 0.00 0.00 -0.22 0.00 0.00 54.13 56.08 3dtx s LEU 32 Cb -0.15 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.96 3dtx s LEU 32 CO -0.03 -0.56 0.00 2.22 -1.32 0.00 0.00 176.35 176.66 3dtx n PHE 33 N 4.09 0.00 -4.04 5.38 -1.74 0.09 -4.18 117.46 117.07 3dtx n PHE 33 Ca 0.10 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.91 3dtx n PHE 33 Cb 0.45 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.35 3dtx n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 3dtx s VAL 34 N -1.68 0.18 -0.04 1.97 -7.23 -1.21 -0.61 120.40 111.78 3dtx s VAL 34 Ca 0.00 -1.50 -0.18 0.00 -1.81 0.00 0.00 61.98 58.49 3dtx s VAL 34 Cb 0.00 -1.14 0.03 0.00 0.56 0.00 0.00 36.38 35.83 3dtx s VAL 34 CO 0.00 -0.83 0.39 0.00 -0.31 0.00 0.00 175.10 174.35 3dtx s ARG 35 N -3.18 0.72 -0.02 4.82 1.04 -0.87 -1.13 118.95 120.33 3dtx s ARG 35 Ca 0.00 -0.03 0.00 0.00 -1.04 0.00 0.00 55.73 54.67 3dtx s ARG 35 Cb 0.03 0.33 0.02 0.00 -2.04 0.00 0.00 34.95 33.28 3dtx s ARG 35 CO -0.07 -0.20 -0.00 0.12 -0.04 0.00 0.00 175.30 175.11 3dtx s PHE 36 N -1.13 0.26 -0.08 5.89 2.19 -0.11 -1.38 117.98 123.61 3dtx s PHE 36 Ca -0.12 0.00 0.01 0.00 0.33 0.00 0.00 56.93 57.15 3dtx s PHE 36 Cb -0.04 -0.33 0.02 0.00 -1.31 0.00 0.00 43.02 41.37 3dtx s PHE 36 CO 0.05 -0.09 -0.08 0.34 1.83 0.00 0.00 175.22 177.26 3dtx s ASP 37 N 0.77 1.82 0.55 6.13 -1.08 -1.26 -1.50 116.67 122.10 3dtx s ASP 37 Ca -0.07 -0.26 0.34 0.00 -0.52 0.00 0.00 52.55 52.04 3dtx s ASP 37 Cb -0.11 -0.75 1.44 0.00 -1.46 0.00 0.00 42.92 42.05 3dtx s ASP 37 CO -0.01 -0.07 2.01 0.77 0.52 0.00 0.00 175.17 178.39 3dtx h SER 38 N 7.66 0.00 0.02 -0.34 4.64 -1.47 -2.81 113.55 121.25 3dtx h SER 38 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 3dtx h SER 38 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3dtx h SER 38 CO 0.43 0.00 -0.08 0.47 -0.87 0.00 0.00 176.83 176.78 3dtx n ASP 39 N -3.06 1.87 -4.72 4.97 8.00 -1.26 -4.84 116.55 117.51 3dtx n ASP 39 Ca 0.00 -1.54 -0.33 0.00 0.71 0.00 0.00 54.79 53.63 3dtx n ASP 39 Cb 0.28 0.06 0.10 0.00 -0.02 0.00 0.00 41.12 41.55 3dtx n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dtx s ALA 40 N -2.11 2.03 0.05 2.24 0.00 -1.06 -4.97 121.76 117.93 3dtx s ALA 40 Ca 0.32 0.75 -0.28 0.00 0.00 0.00 0.00 51.96 52.74 3dtx s ALA 40 Cb 0.20 -3.44 -0.17 0.00 0.00 0.00 0.00 23.12 19.71 3dtx s ALA 40 CO 0.37 -2.00 1.48 0.00 0.00 0.00 0.00 175.76 175.61 3dtx h ALA 41 N -0.65 -0.60 -3.16 0.00 0.00 -1.89 -3.33 119.26 109.63 3dtx h ALA 41 Ca -0.46 -0.16 -0.62 0.00 0.00 0.00 0.00 54.91 53.66 3dtx h ALA 41 Cb 1.28 0.23 -0.41 0.00 0.00 0.00 0.00 17.79 18.90 3dtx h ALA 41 CO 0.48 -0.77 -0.68 0.45 0.00 0.00 0.00 179.25 178.73 3dtx s SER 42 N -4.76 3.98 0.14 0.00 0.15 -1.26 -5.10 113.70 106.85 3dtx s SER 42 Ca -0.16 -2.88 -0.31 0.00 0.70 0.00 0.00 55.95 53.30 3dtx s SER 42 Cb 0.03 -1.33 -0.10 0.00 -1.71 0.00 0.00 66.02 62.91 3dtx s SER 42 CO 0.59 -0.24 1.67 -2.84 1.20 0.00 0.00 173.24 173.63 3dtx s PRO 43 N -0.05 4.18 0.09 5.44 0.02 -1.25 -5.01 135.00 138.41 3dtx s PRO 43 Ca 0.18 2.45 0.03 0.00 0.02 0.00 0.00 61.00 63.68 3dtx s PRO 43 Cb -0.23 -3.34 -0.04 0.00 0.02 0.00 0.00 34.50 30.91 3dtx s PRO 43 CO -0.01 -0.72 -0.09 1.03 -0.33 0.00 0.00 177.00 176.88 3dtx s ARG 44 N 1.84 0.80 0.14 5.54 1.81 -1.26 -5.07 118.95 122.75 3dtx s ARG 44 Ca 0.74 -1.13 -0.30 0.00 -1.72 0.00 0.00 55.73 53.31 3dtx s ARG 44 Cb -0.44 -0.43 -0.07 0.00 -0.45 0.00 0.00 34.95 33.55 3dtx s ARG 44 CO 0.33 0.06 1.22 -2.00 -0.68 0.00 0.00 175.30 174.22 3dtx s GLU 45 N -2.83 4.46 0.06 3.54 2.12 -1.26 -4.64 118.70 120.15 3dtx s GLU 45 Ca 0.04 1.87 0.09 0.00 0.36 0.00 0.00 54.97 57.33 3dtx s GLU 45 Cb -0.02 -3.27 -0.03 0.00 0.26 0.00 0.00 34.13 31.07 3dtx s GLU 45 CO -0.01 -0.17 -0.26 -1.21 -0.54 0.00 0.00 175.26 173.07 3dtx s GLU 46 N 0.25 1.67 0.56 4.30 2.02 -0.48 -4.91 118.70 122.11 3dtx s GLU 46 Ca 0.56 -1.13 -0.18 0.00 0.02 0.00 0.00 54.97 54.23 3dtx s GLU 46 Cb -0.32 -1.90 -0.05 0.00 0.10 0.00 0.00 34.13 31.96 3dtx s GLU 46 CO 0.34 0.48 1.08 -1.25 0.02 0.00 0.00 175.26 175.94 3dtx s PRO 47 N -1.38 3.38 -0.00 0.39 0.04 -1.26 -2.04 135.00 134.13 3dtx s PRO 47 Ca 0.11 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.57 3dtx s PRO 47 Cb -0.10 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.42 3dtx s PRO 47 CO 0.03 -0.79 0.60 0.54 0.04 0.00 0.00 177.00 177.42 3dtx n ARG 48 N -1.56 0.39 -3.86 4.56 5.12 0.22 -4.89 116.66 116.64 3dtx n ARG 48 Ca 0.10 -0.67 -0.12 0.00 -1.93 0.00 0.00 57.85 55.23 3dtx n ARG 48 Cb 0.52 -0.57 -0.11 0.00 -1.16 0.00 0.00 32.46 31.14 3dtx n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3dtx s ALA 49 N -0.15 -0.33 0.39 7.54 0.00 -1.24 -4.69 121.76 123.27 3dtx s ALA 49 Ca 0.00 0.07 0.10 0.00 0.00 0.00 0.00 51.96 52.13 3dtx s ALA 49 Cb 0.00 -0.03 0.78 0.00 0.00 0.00 0.00 23.12 23.87 3dtx s ALA 49 CO 0.00 -0.15 1.91 -1.00 0.00 0.00 0.00 175.76 176.52 3dtx h PRO 50 N 4.95 0.23 0.00 0.00 0.13 -1.95 -3.14 132.00 132.22 3dtx h PRO 50 Ca -0.29 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3dtx h PRO 50 Cb 1.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3dtx h PRO 50 CO 0.41 0.38 0.00 -2.67 -0.23 0.00 0.00 178.00 175.89 3dtx n TRP 51 N -4.27 0.13 -0.02 1.56 4.27 -1.26 -2.95 117.44 114.91 3dtx n TRP 51 Ca -0.01 0.05 0.02 0.00 -3.89 0.00 0.00 57.50 53.67 3dtx n TRP 51 Cb 0.27 -0.58 -0.13 0.00 -1.36 0.00 0.00 31.31 29.52 3dtx n TRP 51 CO 0.00 0.00 0.00 1.51 -2.29 0.00 0.00 177.69 176.91 3dtx n ILE 52 N -1.61 0.80 0.15 -1.67 0.13 -1.18 -4.35 119.36 111.63 3dtx n ILE 52 Ca 0.04 -0.67 0.19 0.00 -1.10 0.00 0.00 62.75 61.22 3dtx n ILE 52 Cb 0.23 -0.38 0.78 0.00 -0.84 0.00 0.00 39.64 39.44 3dtx n ILE 52 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 3dtx h GLU 53 N 0.00 0.00 0.00 9.51 5.08 -1.63 -1.45 114.58 126.08 3dtx h GLU 53 Ca -0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 3dtx h GLU 53 Cb 1.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.79 3dtx h GLU 53 CO 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.03 3dtx n GLN 54 N -3.67 0.01 -2.28 2.33 10.64 -1.26 -4.80 117.38 118.34 3dtx n GLN 54 Ca 0.04 0.22 -0.38 0.00 -1.83 0.00 0.00 57.00 55.06 3dtx n GLN 54 Cb 0.49 -1.51 -0.02 0.00 -0.86 0.00 0.00 30.24 28.34 3dtx n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 3dtx s GLU 55 N -3.01 3.91 1.01 2.61 0.41 -0.55 -5.00 118.70 118.09 3dtx s GLU 55 Ca 0.08 1.80 -0.13 0.00 -0.41 0.00 0.00 54.97 56.31 3dtx s GLU 55 Cb 0.11 -2.54 0.20 0.00 -1.78 0.00 0.00 34.13 30.11 3dtx s GLU 55 CO 0.31 -0.43 1.10 0.20 -0.49 0.00 0.00 175.26 175.95 3dtx s GLY 56 N -1.25 1.56 0.56 -1.39 0.00 -1.26 -4.87 107.32 100.67 3dtx s GLY 56 Ca 0.60 -0.42 0.25 0.00 0.00 0.00 0.00 44.72 45.15 3dtx s GLY 56 CO 0.36 0.21 2.13 -2.55 0.00 0.00 0.00 173.10 173.25 3dtx h PRO 57 N -1.93 0.00 0.00 2.90 0.11 -1.97 -1.96 132.00 129.15 3dtx h PRO 57 Ca -0.54 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.46 3dtx h PRO 57 Cb 1.33 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.43 3dtx h PRO 57 CO 0.57 0.00 -0.50 1.05 -0.21 0.00 0.00 178.00 178.92 3dtx h GLU 58 N 0.00 0.00 0.14 1.05 9.09 -1.99 -0.62 114.58 122.25 3dtx h GLU 58 Ca 0.07 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.47 3dtx h GLU 58 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.44 3dtx h GLU 58 CO -0.00 0.50 -0.06 -0.92 0.05 0.00 0.00 179.01 178.57 3dtx h TYR 59 N 0.00 -0.17 -0.24 2.06 3.20 -1.70 -2.23 116.97 117.90 3dtx h TYR 59 Ca -0.00 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 3dtx h TYR 59 Cb 0.97 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.28 3dtx h TYR 59 CO 0.00 0.10 -0.17 -1.49 -1.64 0.00 0.00 178.16 174.96 3dtx h TRP 60 N -0.43 0.45 0.50 -3.82 4.06 -1.46 0.11 115.95 115.36 3dtx h TRP 60 Ca -0.02 -0.07 -0.02 0.00 2.06 0.00 0.00 58.89 60.83 3dtx h TRP 60 Cb 0.34 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 28.39 3dtx h TRP 60 CO 0.01 0.57 -0.24 -0.44 -3.56 0.00 0.00 178.44 174.78 3dtx h ASP 61 N 0.39 -0.57 -0.17 -3.49 3.32 -1.13 -1.15 116.42 113.62 3dtx h ASP 61 Ca 0.07 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 3dtx h ASP 61 Cb 0.52 0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 3dtx h ASP 61 CO 0.03 -0.39 0.03 -0.09 -1.72 0.00 0.00 179.24 177.10 3dtx h ARG 62 N -0.69 0.28 -0.54 3.56 2.43 -1.22 -1.39 114.38 116.80 3dtx h ARG 62 Ca -0.07 -0.07 0.07 0.00 -0.81 0.00 0.00 59.98 59.10 3dtx h ARG 62 Cb 0.52 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.98 3dtx h ARG 62 CO 0.11 0.45 0.22 0.93 -1.51 0.00 0.00 179.97 180.17 3dtx h GLU 63 N 0.06 0.40 -0.48 0.20 4.39 -0.84 -0.44 114.58 117.88 3dtx h GLU 63 Ca 0.05 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.74 3dtx h GLU 63 Cb 0.30 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.84 3dtx h GLU 63 CO 0.00 0.27 0.30 1.15 -1.16 0.00 0.00 179.01 179.57 3dtx h THR 64 N 0.42 1.09 -0.50 1.13 2.02 -1.11 -2.05 112.91 113.91 3dtx h THR 64 Ca 0.26 -0.21 -0.08 0.00 0.77 0.00 0.00 66.41 67.15 3dtx h THR 64 Cb 0.26 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 3dtx h THR 64 CO -0.24 0.11 0.01 -0.61 0.37 0.00 0.00 175.52 175.17 3dtx h GLN 65 N 0.61 0.87 -0.94 6.66 4.15 -0.69 -1.33 115.11 124.45 3dtx h GLN 65 Ca 0.18 -0.27 0.11 0.00 0.77 0.00 0.00 58.65 59.44 3dtx h GLN 65 Cb -0.03 -0.08 -0.08 0.00 0.21 0.00 0.00 27.48 27.49 3dtx h GLN 65 CO -0.06 0.90 0.57 0.82 -1.93 0.00 0.00 178.83 179.13 3dtx h ILE 66 N 0.74 0.91 -0.39 2.39 2.04 -1.03 -0.62 117.51 121.55 3dtx h ILE 66 Ca 0.14 -0.32 -0.13 0.00 1.00 0.00 0.00 64.86 65.56 3dtx h ILE 66 Cb 0.50 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 3dtx h ILE 66 CO 0.02 0.17 -0.26 0.00 0.00 0.00 0.00 178.15 178.08 3dtx h LYS 68 N 0.68 0.85 -0.29 0.00 1.57 -0.99 -1.72 116.57 116.68 3dtx h LYS 68 Ca 0.08 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3dtx h LYS 68 Cb 0.83 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 3dtx h LYS 68 CO 0.07 0.83 0.17 0.00 -0.57 0.00 0.00 179.45 179.95 3dtx h ALA 69 N 0.99 0.37 -0.37 3.86 0.00 -1.02 -2.26 119.26 120.83 3dtx h ALA 69 Ca 0.16 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3dtx h ALA 69 Cb 0.38 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3dtx h ALA 69 CO 0.01 -0.13 0.21 -0.22 0.00 0.00 0.00 179.25 179.12 3dtx h LYS 70 N 0.37 0.50 -0.53 0.00 1.63 -1.10 0.15 116.57 117.60 3dtx h LYS 70 Ca 0.10 -0.05 0.09 0.00 -0.85 0.00 0.00 60.65 59.95 3dtx h LYS 70 Cb 0.01 -0.10 -0.08 0.00 -0.60 0.00 0.00 32.23 31.46 3dtx h LYS 70 CO -0.02 0.39 0.10 0.00 -3.45 0.00 0.00 179.45 176.47 3dtx h ALA 71 N 1.08 0.60 -0.21 5.00 0.00 -1.22 0.15 119.26 124.66 3dtx h ALA 71 Ca 0.13 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3dtx h ALA 71 Cb 0.03 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3dtx h ALA 71 CO -0.02 -0.32 0.06 1.96 0.00 0.00 0.00 179.25 180.93 3dtx h GLN 72 N 0.23 0.32 -0.49 0.00 4.20 -1.06 -1.62 115.11 116.69 3dtx h GLN 72 Ca 0.27 -0.07 0.08 0.00 0.06 0.00 0.00 58.65 58.99 3dtx h GLN 72 Cb 0.38 -0.05 -0.07 0.00 0.30 0.00 0.00 27.48 28.05 3dtx h GLN 72 CO -0.36 0.43 0.12 1.15 -0.67 0.00 0.00 178.83 179.50 3dtx h THR 73 N 0.16 0.75 -0.88 -0.54 2.02 -0.34 -2.52 112.91 111.55 3dtx h THR 73 Ca 0.07 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.16 3dtx h THR 73 Cb 0.24 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.08 3dtx h THR 73 CO -0.00 0.05 0.55 0.44 0.37 0.00 0.00 175.52 176.93 3dtx h ASP 74 N 0.27 1.04 -0.19 4.18 5.19 -0.54 0.09 116.42 126.45 3dtx h ASP 74 Ca 0.24 -0.05 0.03 0.00 -0.62 0.00 0.00 57.03 56.64 3dtx h ASP 74 Cb 0.31 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 39.53 3dtx h ASP 74 CO -0.30 0.78 0.02 0.03 -3.12 0.00 0.00 179.24 176.64 3dtx h ARG 75 N 1.20 0.08 -0.20 3.56 3.08 -0.88 0.09 114.38 121.31 3dtx h ARG 75 Ca 0.32 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.34 3dtx h ARG 75 Cb -0.09 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 3dtx h ARG 75 CO -0.06 0.05 0.05 1.49 -1.07 0.00 0.00 179.97 180.43 3dtx h GLU 76 N 0.08 0.33 -0.84 0.04 4.81 -1.15 -2.91 114.58 114.94 3dtx h GLU 76 Ca 0.09 -0.08 0.13 0.00 -0.13 0.00 0.00 59.36 59.37 3dtx h GLU 76 Cb 0.10 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.37 3dtx h GLU 76 CO -0.14 0.45 0.55 -0.44 -0.73 0.00 0.00 179.01 178.71 3dtx h ASP 77 N 0.14 0.61 0.04 1.04 5.19 -0.77 -0.79 116.42 121.89 3dtx h ASP 77 Ca 0.06 0.03 -0.13 0.00 -0.62 0.00 0.00 57.03 56.37 3dtx h ASP 77 Cb 0.28 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.68 3dtx h ASP 77 CO 0.00 0.33 -0.43 -0.07 -3.12 0.00 0.00 179.24 175.95 3dtx h LEU 78 N 0.65 0.51 -0.01 1.55 3.38 -0.88 -1.36 115.31 119.15 3dtx h LEU 78 Ca 0.41 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 3dtx h LEU 78 Cb 0.66 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 3dtx h LEU 78 CO -0.17 0.88 -0.00 0.03 0.09 0.00 0.00 178.44 179.27 3dtx h ARG 79 N 0.39 0.01 -0.66 1.13 3.08 -1.14 -2.98 114.38 114.21 3dtx h ARG 79 Ca 0.03 -0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.22 3dtx h ARG 79 Cb 0.92 -0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.86 3dtx h ARG 79 CO 0.08 0.33 0.07 1.15 -1.07 0.00 0.00 179.97 180.53 3dtx h THR 80 N -0.31 0.51 0.00 2.04 2.02 -1.05 -2.23 112.91 113.88 3dtx h THR 80 Ca 0.00 -0.06 -0.06 0.00 0.77 0.00 0.00 66.41 67.06 3dtx h THR 80 Cb 0.33 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 3dtx h THR 80 CO 0.00 0.03 -0.27 -0.07 0.37 0.00 0.00 175.52 175.58 3dtx h LEU 81 N 0.18 0.00 -1.03 2.58 3.38 -1.22 -1.34 115.31 117.85 3dtx h LEU 81 Ca 0.36 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.36 3dtx h LEU 81 Cb 0.59 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.28 3dtx h LEU 81 CO -0.52 0.27 0.65 -0.07 0.09 0.00 0.00 178.44 178.86 3dtx h LEU 82 N 0.00 1.09 0.19 1.67 3.38 -1.24 -1.47 115.31 118.93 3dtx h LEU 82 Ca -0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3dtx h LEU 82 Cb 0.49 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3dtx h LEU 82 CO 0.04 0.76 -0.09 0.03 0.09 0.00 0.00 178.44 179.27 3dtx h ARG 83 N 1.27 -0.24 -0.23 1.13 3.08 -1.20 0.25 114.38 118.44 3dtx h ARG 83 Ca 0.39 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.45 3dtx h ARG 83 Cb -0.04 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 3dtx h ARG 83 CO -0.11 -0.02 0.15 1.88 -1.07 0.00 0.00 179.97 180.80 3dtx h TYR 84 N -0.43 0.29 -0.49 3.04 -1.99 -1.16 -2.12 116.97 114.12 3dtx h TYR 84 Ca -0.03 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.71 3dtx h TYR 84 Cb 0.33 -0.10 0.00 0.00 2.00 0.00 0.00 36.73 38.96 3dtx h TYR 84 CO -0.01 0.19 0.00 0.66 -0.00 0.00 0.00 178.16 178.99 3dtx n TYR 85 N -4.50 0.66 -3.81 4.88 4.01 -0.57 -4.82 117.16 113.00 3dtx n TYR 85 Ca 0.00 -0.49 -0.24 0.00 -0.16 0.00 0.00 57.90 57.02 3dtx n TYR 85 Cb 0.07 -0.02 0.01 0.00 -0.31 0.00 0.00 39.34 39.10 3dtx n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3dtx n ASN 86 N 0.97 -1.26 -4.90 7.72 3.02 -0.48 -4.96 115.26 115.37 3dtx n ASN 86 Ca 0.17 -0.88 -0.28 0.00 -0.03 0.00 0.00 54.58 53.56 3dtx n ASN 86 Cb 0.50 -3.69 -0.04 0.00 -0.61 0.00 0.00 39.78 35.94 3dtx n ASN 86 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3dtx s GLN 87 N -6.24 3.29 0.75 3.52 -0.21 0.75 -5.03 119.66 116.48 3dtx s GLN 87 Ca 0.08 -0.61 -0.13 0.00 0.02 0.00 0.00 55.36 54.72 3dtx s GLN 87 Cb -0.04 -2.91 0.05 0.00 1.00 0.00 0.00 33.01 31.11 3dtx s GLN 87 CO 0.84 0.54 1.14 0.45 -2.12 0.00 0.00 175.29 176.14 3dtx s SER 88 N -2.92 4.37 0.00 5.90 0.15 -1.26 -4.75 113.70 115.19 3dtx s SER 88 Ca 0.33 2.08 0.29 0.00 0.70 0.00 0.00 55.95 59.36 3dtx s SER 88 Cb -0.12 -2.56 1.73 0.00 -1.71 0.00 0.00 66.02 63.36 3dtx s SER 88 CO 0.27 -2.13 2.11 -0.62 1.20 0.00 0.00 173.24 174.07 3dtx n GLU 89 N -3.06 1.03 0.07 5.44 1.02 -1.26 -4.25 120.64 119.62 3dtx n GLU 89 Ca 0.11 -0.04 -0.09 0.00 -0.02 0.00 0.00 57.16 57.12 3dtx n GLU 89 Cb 0.52 -1.46 -0.12 0.00 -0.02 0.00 0.00 31.44 30.35 3dtx n GLU 89 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dtx h ALA 90 N 3.93 0.31 -2.01 0.62 0.00 -2.00 -3.45 119.26 116.66 3dtx h ALA 90 Ca 0.00 -0.92 -0.45 0.00 0.00 0.00 0.00 54.91 53.54 3dtx h ALA 90 Cb 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3dtx h ALA 90 CO 0.00 1.20 -0.34 0.20 0.00 0.00 0.00 179.25 180.31 3dtx s GLY 91 N -4.71 1.42 -0.04 0.00 0.00 -1.26 -4.74 107.32 97.99 3dtx s GLY 91 Ca -0.00 -1.29 -0.22 0.00 0.00 0.00 0.00 44.72 43.21 3dtx s GLY 91 CO 0.83 -1.24 0.65 -0.45 0.00 0.00 0.00 173.10 172.89 3dtx s SER 92 N -4.09 6.97 0.13 1.64 0.15 -1.26 -4.66 113.70 112.58 3dtx s SER 92 Ca 0.41 1.16 0.06 0.00 0.70 0.00 0.00 55.95 58.27 3dtx s SER 92 Cb -0.09 -2.39 -0.04 0.00 -1.71 0.00 0.00 66.02 61.79 3dtx s SER 92 CO 0.31 -0.02 -0.14 -1.00 1.20 0.00 0.00 173.24 173.60 3dtx s HIS 93 N 0.38 1.42 -0.09 3.44 3.76 -1.26 -4.94 115.29 118.01 3dtx s HIS 93 Ca 0.34 -0.59 0.04 0.00 -0.15 0.00 0.00 55.06 54.71 3dtx s HIS 93 Cb -0.18 -0.73 0.00 0.00 1.11 0.00 0.00 32.58 32.79 3dtx s HIS 93 CO 0.17 0.16 -0.22 0.99 -0.85 0.00 0.00 174.74 175.00 3dtx s THR 94 N -2.40 1.85 -0.14 1.30 2.01 -1.26 -1.12 115.64 115.88 3dtx s THR 94 Ca 0.12 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.22 3dtx s THR 94 Cb -0.03 -1.61 -0.00 0.00 0.01 0.00 0.00 72.50 70.87 3dtx s THR 94 CO 0.03 0.51 -0.17 -0.22 -0.69 0.00 0.00 174.62 174.09 3dtx s LEU 95 N 0.34 2.43 -0.03 4.42 0.20 -0.12 0.07 118.68 125.98 3dtx s LEU 95 Ca -0.16 -0.47 0.05 0.00 0.69 0.00 0.00 54.13 54.24 3dtx s LEU 95 Cb -0.17 -1.54 -0.01 0.00 -0.43 0.00 0.00 46.19 44.04 3dtx s LEU 95 CO 0.07 0.11 -0.19 -1.10 -0.29 0.00 0.00 176.35 174.95 3dtx s GLN 96 N 0.67 1.73 0.00 1.98 -0.21 -0.24 -0.66 119.66 122.93 3dtx s GLN 96 Ca -0.08 -0.67 0.03 0.00 0.02 0.00 0.00 55.36 54.65 3dtx s GLN 96 Cb -0.16 -1.58 -0.01 0.00 1.00 0.00 0.00 33.01 32.26 3dtx s GLN 96 CO 0.02 0.34 -0.10 1.21 -2.12 0.00 0.00 175.29 174.64 3dtx s ASN 97 N -0.23 1.20 0.01 5.90 3.84 -0.39 -0.52 114.94 124.75 3dtx s ASN 97 Ca 0.02 -0.24 0.04 0.00 0.21 0.00 0.00 52.86 52.89 3dtx s ASN 97 Cb -0.10 -0.11 -0.02 0.00 -0.55 0.00 0.00 41.25 40.48 3dtx s ASN 97 CO 0.01 0.09 -0.14 0.00 -2.79 0.00 0.00 177.10 174.27 3dtx s MET 98 N -0.46 1.01 0.09 0.43 0.23 -0.60 -0.14 119.30 119.87 3dtx s MET 98 Ca 0.03 -0.60 -0.14 0.00 -1.03 0.00 0.00 55.69 53.94 3dtx s MET 98 Cb -0.05 -1.00 0.02 0.00 -1.53 0.00 0.00 34.83 32.28 3dtx s MET 98 CO -0.00 0.26 0.34 1.52 -2.03 0.00 0.00 175.02 175.11 3dtx s TYR 99 N -0.55 -0.12 -3.92 3.16 -0.85 -0.83 -1.25 117.35 112.99 3dtx s TYR 99 Ca 0.04 -0.15 0.00 0.00 -0.52 0.00 0.00 57.07 56.43 3dtx s TYR 99 Cb -0.06 0.16 0.00 0.00 0.38 0.00 0.00 41.96 42.43 3dtx s TYR 99 CO 0.00 -0.61 0.00 0.41 -1.52 0.00 0.00 175.55 173.83 3dtx n GLY 100 N 0.05 -1.01 3.11 5.49 0.00 -1.00 -0.76 105.19 111.08 3dtx n GLY 100 Ca -0.17 -1.08 -0.11 0.00 0.00 0.00 0.00 46.02 44.66 3dtx n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dtx s ASP 102 N -1.56 5.04 0.12 0.00 1.01 0.50 -1.04 116.67 120.74 3dtx s ASP 102 Ca -0.13 0.04 0.09 0.00 0.71 0.00 0.00 52.55 53.26 3dtx s ASP 102 Cb -0.06 -1.54 -0.04 0.00 1.01 0.00 0.00 42.92 42.29 3dtx s ASP 102 CO 0.00 0.31 -0.19 0.68 0.21 0.00 0.00 175.17 176.18 3dtx s VAL 103 N -0.45 2.80 0.63 -1.27 -7.23 -0.03 -0.44 120.40 114.41 3dtx s VAL 103 Ca 0.08 -1.53 -0.08 0.00 -1.81 0.00 0.00 61.98 58.64 3dtx s VAL 103 Cb -0.12 -2.28 0.14 0.00 0.56 0.00 0.00 36.38 34.67 3dtx s VAL 103 CO 0.02 0.09 0.86 0.61 -0.31 0.00 0.00 175.10 176.38 3dtx n GLY 104 N 0.79 -0.68 0.36 2.32 0.00 -0.85 -1.21 105.19 105.92 3dtx n GLY 104 Ca -0.16 -1.81 0.16 0.00 0.00 0.00 0.00 46.02 44.21 3dtx n GLY 104 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3dtx h PRO 105 N 0.00 0.64 0.00 1.61 0.11 -1.87 0.99 132.00 133.48 3dtx h PRO 105 Ca -0.28 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3dtx h PRO 105 Cb 0.85 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.82 3dtx h PRO 105 CO 0.23 0.42 0.00 -0.40 -0.21 0.00 0.00 178.00 178.04 3dtx n ASP 106 N -4.78 0.73 0.00 -2.05 3.85 -1.26 -4.52 116.55 108.52 3dtx n ASP 106 Ca 0.25 0.60 0.00 0.00 -0.71 0.00 0.00 54.79 54.93 3dtx n ASP 106 Cb 0.66 -0.79 0.00 0.00 -1.35 0.00 0.00 41.12 39.65 3dtx n ASP 106 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dtx n GLY 107 N 0.87 0.69 3.84 6.12 0.00 0.34 -5.07 105.19 111.99 3dtx n GLY 107 Ca 0.04 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 3dtx n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dtx s ARG 108 N -0.75 4.02 0.07 1.61 0.52 -1.26 -4.80 118.95 118.36 3dtx s ARG 108 Ca 0.00 0.61 -0.34 0.00 -0.52 0.00 0.00 55.73 55.48 3dtx s ARG 108 Cb 0.00 -2.65 -0.13 0.00 0.52 0.00 0.00 34.95 32.69 3dtx s ARG 108 CO 0.00 0.29 1.69 -0.11 0.02 0.00 0.00 175.30 177.19 3dtx n LEU 109 N 0.11 3.22 -0.09 2.53 7.94 -1.26 -2.02 117.00 127.44 3dtx n LEU 109 Ca 0.00 1.04 -0.22 0.00 -1.11 0.00 0.00 56.01 55.73 3dtx n LEU 109 Cb 0.52 -1.41 -0.12 0.00 0.53 0.00 0.00 43.42 42.95 3dtx n LEU 109 CO 0.43 -0.20 -1.12 0.18 -1.11 0.00 0.00 177.39 175.56 3dtx n LEU 110 N 4.63 2.56 -3.63 -1.96 4.77 0.42 -4.86 117.00 118.93 3dtx n LEU 110 Ca 0.19 0.11 -0.11 0.00 -0.03 0.00 0.00 56.01 56.18 3dtx n LEU 110 Cb 0.29 -0.96 -0.07 0.00 -2.33 0.00 0.00 43.42 40.35 3dtx n LEU 110 CO 0.67 0.77 0.54 -0.60 -1.33 0.00 0.00 177.39 177.44 3dtx s ARG 111 N -2.51 0.68 0.16 3.23 3.52 -1.19 -5.00 118.95 117.85 3dtx s ARG 111 Ca -0.31 0.87 0.07 0.00 -0.13 0.00 0.00 55.73 56.22 3dtx s ARG 111 Cb 0.09 0.31 -0.04 0.00 -1.56 0.00 0.00 34.95 33.75 3dtx s ARG 111 CO 0.63 -0.09 -0.02 0.20 -0.81 0.00 0.00 175.30 175.21 3dtx s GLY 112 N 0.51 1.76 0.03 8.12 0.00 -1.26 -0.37 107.32 116.10 3dtx s GLY 112 Ca -0.00 -1.34 0.02 0.00 0.00 0.00 0.00 44.72 43.40 3dtx s GLY 112 CO -0.05 -1.35 -0.08 -0.19 0.00 0.00 0.00 173.10 171.44 3dtx s TYR 113 N -1.63 0.68 -0.30 1.90 2.02 -0.06 -4.78 117.35 115.19 3dtx s TYR 113 Ca 0.26 -0.37 -0.06 0.00 -0.37 0.00 0.00 57.07 56.54 3dtx s TYR 113 Cb -0.10 -0.41 0.16 0.00 -0.40 0.00 0.00 41.96 41.21 3dtx s TYR 113 CO 0.18 -0.05 0.67 -1.58 -1.57 0.00 0.00 175.55 173.20 3dtx s HIS 114 N -0.96 -1.39 -0.06 2.71 2.46 -1.26 -2.38 115.29 114.42 3dtx s HIS 114 Ca -0.05 1.86 -0.11 0.00 0.47 0.00 0.00 55.06 57.23 3dtx s HIS 114 Cb -0.07 0.63 0.02 0.00 -0.13 0.00 0.00 32.58 33.03 3dtx s HIS 114 CO 0.00 -0.73 0.27 1.14 -2.47 0.00 0.00 174.74 172.95 3dtx s GLN 115 N 2.85 0.48 0.16 2.88 -2.07 -0.38 -0.06 119.66 123.52 3dtx s GLN 115 Ca 0.08 0.05 0.11 0.00 -1.82 0.00 0.00 55.36 53.77 3dtx s GLN 115 Cb -0.13 0.22 -0.04 0.00 -1.09 0.00 0.00 33.01 31.96 3dtx s GLN 115 CO -0.19 -0.10 -0.22 -0.51 -1.32 0.00 0.00 175.29 172.94 3dtx s ASP 116 N -0.63 3.57 0.02 12.60 1.11 0.52 -1.56 116.67 132.30 3dtx s ASP 116 Ca -0.07 -0.74 0.03 0.00 0.18 0.00 0.00 52.55 51.95 3dtx s ASP 116 Cb -0.04 -0.35 -0.01 0.00 1.07 0.00 0.00 42.92 43.58 3dtx s ASP 116 CO 0.02 0.15 -0.09 0.00 1.18 0.00 0.00 175.17 176.43 3dtx s ALA 117 N -1.37 0.70 -0.13 5.23 0.00 0.32 -1.36 121.76 125.13 3dtx s ALA 117 Ca 0.18 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 51.61 3dtx s ALA 117 Cb -0.09 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 22.95 3dtx s ALA 117 CO 0.09 0.11 -0.21 -0.47 0.00 0.00 0.00 175.76 175.28 3dtx s TYR 118 N -0.70 2.54 -1.44 0.00 5.04 -0.50 -1.07 117.35 121.22 3dtx s TYR 118 Ca -0.02 -1.27 -0.10 0.00 -2.44 0.00 0.00 57.07 53.24 3dtx s TYR 118 Cb -0.06 -1.74 0.06 0.00 0.35 0.00 0.00 41.96 40.57 3dtx s TYR 118 CO 0.00 -0.59 0.72 -0.25 -1.34 0.00 0.00 175.55 174.10 3dtx n ASP 119 N 4.09 -4.75 0.00 4.32 8.00 0.11 -2.41 116.55 125.91 3dtx n ASP 119 Ca -0.20 -0.52 0.00 0.00 0.71 0.00 0.00 54.79 54.79 3dtx n ASP 119 Cb 0.51 -3.84 0.00 0.00 -0.02 0.00 0.00 41.12 37.77 3dtx n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dtx n GLY 120 N -1.47 0.64 3.34 0.44 0.00 -1.26 -5.00 105.19 101.88 3dtx n GLY 120 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 3dtx n GLY 120 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dtx s LYS 121 N -0.07 1.32 0.18 1.61 -2.85 -1.01 -5.10 119.74 113.81 3dtx s LYS 121 Ca 0.00 -1.24 -0.32 0.00 -1.00 0.00 0.00 55.97 53.41 3dtx s LYS 121 Cb 0.00 -1.69 -0.16 0.00 -2.06 0.00 0.00 37.83 33.93 3dtx s LYS 121 CO 0.00 0.40 1.10 -0.25 0.10 0.00 0.00 175.35 176.71 3dtx n ASP 122 N 1.08 1.13 0.00 0.03 8.00 -1.26 -1.40 116.55 124.12 3dtx n ASP 122 Ca -0.18 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.46 3dtx n ASP 122 Cb 0.53 -1.20 0.00 0.00 -0.02 0.00 0.00 41.12 40.44 3dtx n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dtx n TYR 123 N 1.27 0.00 -4.00 1.24 9.36 -0.47 -4.67 117.16 119.89 3dtx n TYR 123 Ca 0.15 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.25 3dtx n TYR 123 Cb 0.25 0.00 -0.13 0.00 -0.63 0.00 0.00 39.34 38.83 3dtx n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 3dtx s ILE 124 N -0.43 0.22 -0.01 2.97 2.07 -1.15 -0.37 121.20 124.50 3dtx s ILE 124 Ca 0.00 -0.53 0.02 0.00 -1.41 0.00 0.00 60.65 58.73 3dtx s ILE 124 Cb 0.00 -0.27 -0.00 0.00 0.13 0.00 0.00 42.46 42.31 3dtx s ILE 124 CO 0.00 -0.20 -0.06 0.00 -1.91 0.00 0.00 174.94 172.77 3dtx s ALA 125 N -0.73 0.55 0.12 1.50 0.00 -0.15 -0.36 121.76 122.69 3dtx s ALA 125 Ca -0.06 -0.27 -0.31 0.00 0.00 0.00 0.00 51.96 51.32 3dtx s ALA 125 Cb -0.05 -0.15 -0.07 0.00 0.00 0.00 0.00 23.12 22.85 3dtx s ALA 125 CO -0.00 0.13 1.25 -1.17 0.00 0.00 0.00 175.76 175.97 3dtx s LEU 126 N -0.11 4.40 0.75 0.00 2.96 0.92 -0.99 118.68 126.60 3dtx s LEU 126 Ca 0.02 2.18 -0.11 0.00 -0.22 0.00 0.00 54.13 56.00 3dtx s LEU 126 Cb -0.03 -3.59 0.04 0.00 0.50 0.00 0.00 46.19 43.11 3dtx s LEU 126 CO -0.00 -0.49 1.09 0.20 -1.32 0.00 0.00 176.35 175.82 3dtx s ASN 127 N 0.75 4.93 0.49 3.68 0.01 -0.10 -4.56 114.94 120.15 3dtx s ASN 127 Ca 0.58 1.35 0.22 0.00 -0.71 0.00 0.00 52.86 54.31 3dtx s ASN 127 Cb -0.33 -2.14 1.27 0.00 0.41 0.00 0.00 41.25 40.46 3dtx s ASN 127 CO 0.32 -1.69 1.95 -0.08 -1.51 0.00 0.00 177.10 176.08 3dtx h GLU 128 N -0.90 0.16 0.00 -0.60 4.81 -1.89 0.46 114.58 116.63 3dtx h GLU 128 Ca -0.46 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 3dtx h GLU 128 Cb 1.25 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.59 3dtx h GLU 128 CO 0.60 0.11 0.00 -0.40 -0.73 0.00 0.00 179.01 178.58 3dtx n ASP 129 N -4.40 0.48 -2.58 1.04 5.68 -1.26 -4.74 116.55 110.76 3dtx n ASP 129 Ca 0.13 0.70 -0.18 0.00 -0.50 0.00 0.00 54.79 54.94 3dtx n ASP 129 Cb 0.64 -0.77 -0.00 0.00 -1.14 0.00 0.00 41.12 39.85 3dtx n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3dtx n LEU 130 N -2.11 -1.74 0.00 -2.12 4.77 0.15 -4.78 117.00 111.16 3dtx n LEU 130 Ca -0.00 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3dtx n LEU 130 Cb 0.07 -2.61 0.00 0.00 -2.33 0.00 0.00 43.42 38.56 3dtx n LEU 130 CO 0.10 -0.09 -0.03 -1.20 -1.33 0.00 0.00 177.39 174.84 3dtx n SER 131 N -2.04 0.27 -4.49 -1.43 7.64 -1.26 -4.50 113.62 107.81 3dtx n SER 131 Ca -0.18 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.47 3dtx n SER 131 Cb 0.64 0.04 -0.11 0.00 -1.01 0.00 0.00 64.21 63.78 3dtx n SER 131 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3dtx s SER 132 N -0.56 2.94 0.08 6.43 1.04 -1.26 -4.88 113.70 117.50 3dtx s SER 132 Ca 0.00 -1.31 0.10 0.00 0.48 0.00 0.00 55.95 55.22 3dtx s SER 132 Cb 0.00 -0.20 -0.03 0.00 0.10 0.00 0.00 66.02 65.88 3dtx s SER 132 CO 0.00 -0.47 -0.26 0.26 0.98 0.00 0.00 173.24 173.75 3dtx s TRP 133 N -3.03 2.33 -0.26 5.02 0.52 -1.26 -0.93 118.94 121.33 3dtx s TRP 133 Ca 0.34 -0.39 -0.02 0.00 0.02 0.00 0.00 56.10 56.05 3dtx s TRP 133 Cb 0.07 -1.33 0.03 0.00 -1.15 0.00 0.00 33.47 31.09 3dtx s TRP 133 CO 0.15 0.23 -0.04 0.99 0.02 0.00 0.00 176.95 178.30 3dtx s THR 134 N -0.93 3.03 -0.16 2.01 2.01 -0.16 -4.90 115.64 116.54 3dtx s THR 134 Ca 0.13 -1.02 -0.07 0.00 0.31 0.00 0.00 61.69 61.04 3dtx s THR 134 Cb -0.10 -2.56 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 3dtx s THR 134 CO 0.04 0.15 0.08 0.00 -0.69 0.00 0.00 174.62 174.21 3dtx s ALA 135 N 1.34 3.54 -0.51 7.40 0.00 -1.26 -0.98 121.76 131.29 3dtx s ALA 135 Ca -0.00 -0.72 0.24 0.00 0.00 0.00 0.00 51.96 51.48 3dtx s ALA 135 Cb -0.17 -1.93 0.50 0.00 0.00 0.00 0.00 23.12 21.51 3dtx s ALA 135 CO -0.03 0.30 1.67 0.00 0.00 0.00 0.00 175.76 177.69 3dtx h ALA 136 N 6.22 1.00 -2.85 0.00 0.00 -0.98 -3.46 119.26 119.19 3dtx h ALA 136 Ca -0.42 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.49 3dtx h ALA 136 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3dtx h ALA 136 CO 0.68 0.00 0.32 -0.40 0.00 0.00 0.00 179.25 179.85 3dtx n ASP 137 N -2.86 -2.08 0.23 0.00 5.68 -1.26 -5.03 116.55 111.24 3dtx n ASP 137 Ca 0.04 -2.38 0.10 0.00 -0.50 0.00 0.00 54.79 52.05 3dtx n ASP 137 Cb 0.49 3.44 0.56 0.00 -1.14 0.00 0.00 41.12 44.48 3dtx n ASP 137 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3dtx h THR 138 N 1.93 0.66 -0.06 2.12 1.35 -1.99 -0.34 112.91 116.59 3dtx h THR 138 Ca -0.31 -0.91 -0.02 0.00 -0.55 0.00 0.00 66.41 64.62 3dtx h THR 138 Cb 1.16 1.58 -0.00 0.00 -1.73 0.00 0.00 68.15 69.16 3dtx h THR 138 CO 0.39 0.20 -0.04 0.00 -0.25 0.00 0.00 175.52 175.83 3dtx h ALA 139 N 1.79 0.08 -0.29 6.62 0.00 -1.97 -3.09 119.26 122.41 3dtx h ALA 139 Ca -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3dtx h ALA 139 Cb 0.57 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3dtx h ALA 139 CO 0.03 -0.16 0.15 0.00 0.00 0.00 0.00 179.25 179.27 3dtx h ALA 140 N 0.59 1.71 -0.22 0.00 0.00 -1.74 -1.10 119.26 118.51 3dtx h ALA 140 Ca 0.01 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.89 3dtx h ALA 140 Cb 0.50 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3dtx h ALA 140 CO 0.01 0.24 0.15 1.96 0.00 0.00 0.00 179.25 181.61 3dtx h GLN 141 N 0.40 0.19 -0.45 0.00 4.20 -1.06 0.16 115.11 118.54 3dtx h GLN 141 Ca 0.10 -0.01 -0.13 0.00 0.06 0.00 0.00 58.65 58.67 3dtx h GLN 141 Cb 0.03 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 3dtx h GLN 141 CO -0.02 0.12 -0.23 0.82 -0.67 0.00 0.00 178.83 178.85 3dtx h ILE 142 N 0.19 1.27 -0.32 2.54 1.08 -1.12 -1.90 117.51 119.26 3dtx h ILE 142 Ca 0.09 -1.40 -0.01 0.00 -0.39 0.00 0.00 64.86 63.15 3dtx h ILE 142 Cb 0.12 1.19 -0.01 0.00 -3.07 0.00 0.00 36.82 35.05 3dtx h ILE 142 CO -0.02 0.48 0.14 0.74 -0.69 0.00 0.00 178.15 178.80 3dtx h THR 143 N 0.80 1.17 -0.54 -0.27 2.02 -1.25 -2.75 112.91 112.09 3dtx h THR 143 Ca 0.10 -0.50 0.10 0.00 0.77 0.00 0.00 66.41 66.87 3dtx h THR 143 Cb 0.81 0.90 -0.08 0.00 -1.74 0.00 0.00 68.15 68.05 3dtx h THR 143 CO 0.07 0.18 0.12 -0.61 0.37 0.00 0.00 175.52 175.65 3dtx h GLN 144 N 0.38 0.25 -0.61 6.66 4.15 -0.61 0.33 115.11 125.66 3dtx h GLN 144 Ca 0.11 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.47 3dtx h GLN 144 Cb 0.15 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.75 3dtx h GLN 144 CO -0.01 0.17 0.21 0.00 -1.93 0.00 0.00 178.83 177.26 3dtx h ARG 145 N 0.26 0.92 -0.32 1.69 3.08 -1.27 0.22 114.38 118.95 3dtx h ARG 145 Ca 0.28 -0.17 -0.17 0.00 0.07 0.00 0.00 59.98 59.99 3dtx h ARG 145 Cb 0.38 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 3dtx h ARG 145 CO -0.35 0.78 -0.49 0.87 -1.07 0.00 0.00 179.97 179.71 3dtx h LYS 146 N 0.89 0.87 -0.01 0.04 1.57 -1.06 -2.35 116.57 116.53 3dtx h LYS 146 Ca 0.20 -0.52 -0.15 0.00 -1.87 0.00 0.00 60.65 58.31 3dtx h LYS 146 Cb 0.24 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 3dtx h LYS 146 CO -0.01 1.15 -0.72 -1.49 -0.57 0.00 0.00 179.45 177.81 3dtx h TRP 147 N 0.68 0.06 -0.41 -1.35 4.06 -0.60 -1.42 115.95 116.98 3dtx h TRP 147 Ca 0.03 -0.03 -0.07 0.00 2.06 0.00 0.00 58.89 60.88 3dtx h TRP 147 Cb 1.08 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 29.22 3dtx h TRP 147 CO 0.07 0.75 -0.03 0.93 -3.56 0.00 0.00 178.44 176.59 3dtx h GLU 148 N 0.03 0.75 -0.38 0.49 5.08 -0.57 -1.36 114.58 118.61 3dtx h GLU 148 Ca -0.01 -0.26 -0.09 0.00 -1.00 0.00 0.00 59.36 58.00 3dtx h GLU 148 Cb 1.27 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 3dtx h GLU 148 CO 0.10 0.85 -0.14 0.00 -1.00 0.00 0.00 179.01 178.81 3dtx h ALA 149 N 0.88 1.04 -0.01 3.43 0.00 -1.30 -2.96 119.26 120.33 3dtx h ALA 149 Ca 0.11 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3dtx h ALA 149 Cb 0.53 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3dtx h ALA 149 CO 0.03 0.58 -0.11 0.00 0.00 0.00 0.00 179.25 179.75 3dtx n ALA 150 N -2.49 2.79 -3.65 0.00 0.00 -0.54 -4.95 120.51 111.67 3dtx n ALA 150 Ca 0.01 -0.35 -0.22 0.00 0.00 0.00 0.00 53.44 52.88 3dtx n ALA 150 Cb 0.37 -1.25 0.05 0.00 0.00 0.00 0.00 19.45 18.62 3dtx n ALA 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3dtx n ARG 151 N -0.56 -5.83 -0.12 0.00 1.74 -0.71 -4.94 116.66 106.25 3dtx n ARG 151 Ca 0.16 0.70 -0.13 0.00 -0.77 0.00 0.00 57.85 57.82 3dtx n ARG 151 Cb 0.30 -5.49 -0.03 0.00 -1.02 0.00 0.00 32.46 26.22 3dtx n ARG 151 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3dtx h VAL 152 N -2.01 1.28 -1.01 1.55 2.07 -1.57 -3.10 116.25 113.47 3dtx h VAL 152 Ca -0.60 -1.43 0.12 0.00 0.82 0.00 0.00 66.70 65.61 3dtx h VAL 152 Cb 1.36 1.41 -0.08 0.00 -1.52 0.00 0.00 31.29 32.45 3dtx h VAL 152 CO 0.56 0.47 0.64 0.00 0.02 0.00 0.00 177.57 179.26 3dtx h ALA 153 N 0.77 1.51 -0.66 1.67 0.00 -1.89 -1.02 119.26 119.63 3dtx h ALA 153 Ca 0.07 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3dtx h ALA 153 Cb 0.84 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 3dtx h ALA 153 CO 0.07 0.24 0.27 0.93 0.00 0.00 0.00 179.25 180.76 3dtx h GLU 154 N 1.01 0.97 -0.24 0.00 3.07 -1.77 -0.19 114.58 117.43 3dtx h GLU 154 Ca 0.50 -0.16 -0.08 0.00 -0.50 0.00 0.00 59.36 59.12 3dtx h GLU 154 Cb 0.47 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 3dtx h GLU 154 CO -0.26 0.79 -0.16 1.96 -1.40 0.00 0.00 179.01 179.94 3dtx h GLN 155 N 0.95 0.53 -0.61 2.33 4.20 -1.22 -2.29 115.11 119.00 3dtx h GLN 155 Ca 0.22 -0.25 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 3dtx h GLN 155 Cb 0.18 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 3dtx h GLN 155 CO -0.02 0.82 0.21 -0.07 -0.67 0.00 0.00 178.83 179.10 3dtx h LEU 156 N 0.24 0.84 -0.28 1.46 3.38 -1.12 -2.70 115.31 117.14 3dtx h LEU 156 Ca 0.05 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 3dtx h LEU 156 Cb 0.69 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3dtx h LEU 156 CO 0.04 0.78 0.13 -0.09 0.09 0.00 0.00 178.44 179.39 3dtx h ARG 157 N 0.89 0.40 -0.77 1.13 2.43 -0.98 0.15 114.38 117.64 3dtx h ARG 157 Ca 0.20 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.39 3dtx h ARG 157 Cb 0.23 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 3dtx h ARG 157 CO -0.01 0.40 0.44 0.00 -1.51 0.00 0.00 179.97 179.29 3dtx h ALA 158 N 0.98 1.06 -0.02 2.80 0.00 -1.22 -1.63 119.26 121.23 3dtx h ALA 158 Ca 0.09 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3dtx h ALA 158 Cb 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dtx h ALA 158 CO -0.01 0.10 -0.05 -0.92 0.00 0.00 0.00 179.25 178.36 3dtx h TYR 159 N 0.77 0.10 0.00 0.00 3.20 -1.25 -2.37 116.97 117.42 3dtx h TYR 159 Ca 0.35 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 62.16 3dtx h TYR 159 Cb 0.27 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.52 3dtx h TYR 159 CO -0.07 0.65 -0.11 -0.07 -1.64 0.00 0.00 178.16 176.93 3dtx h LEU 160 N -0.49 0.00 0.00 2.82 3.38 -0.45 -1.26 115.31 119.32 3dtx h LEU 160 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 3dtx h LEU 160 Cb 0.65 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 3dtx h LEU 160 CO 0.01 0.11 -1.39 -0.62 0.09 0.00 0.00 178.44 176.64 3dtx n GLU 161 N -4.38 0.62 0.00 1.13 1.02 -0.64 -4.02 120.64 114.38 3dtx n GLU 161 Ca -0.03 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 3dtx n GLU 161 Cb 0.18 -1.75 0.00 0.00 -0.02 0.00 0.00 31.44 29.85 3dtx n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dtx n GLY 162 N 1.30 0.01 0.29 0.62 0.00 -0.89 -4.66 105.19 101.86 3dtx n GLY 162 Ca -0.06 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.96 3dtx n GLY 162 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3dtx h GLU 163 N 0.00 0.80 -0.16 1.61 5.08 -1.58 -1.02 114.58 119.31 3dtx h GLU 163 Ca 0.00 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 3dtx h GLU 163 Cb 0.00 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.03 3dtx h GLU 163 CO 0.00 0.53 -0.07 0.00 -1.00 0.00 0.00 179.01 178.47 3dtx h VAL 165 N -0.05 1.26 -0.15 0.00 2.07 -1.58 -1.09 116.25 116.72 3dtx h VAL 165 Ca 0.09 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 3dtx h VAL 165 Cb 0.18 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3dtx h VAL 165 CO -0.19 0.35 0.06 -0.33 0.02 0.00 0.00 177.57 177.49 3dtx h GLU 166 N 0.53 0.23 -0.22 1.57 5.08 -0.86 -1.46 114.58 119.44 3dtx h GLU 166 Ca 0.11 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 58.29 3dtx h GLU 166 Cb 0.51 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 3dtx h GLU 166 CO 0.02 0.30 -0.46 -1.49 -1.00 0.00 0.00 179.01 176.39 3dtx h TRP 167 N 0.10 0.69 -0.41 4.33 4.06 -0.78 -2.04 115.95 121.91 3dtx h TRP 167 Ca 0.05 -0.22 0.00 0.00 2.06 0.00 0.00 58.89 60.79 3dtx h TRP 167 Cb 0.16 -0.14 -0.02 0.00 -1.00 0.00 0.00 29.16 28.15 3dtx h TRP 167 CO -0.02 0.92 0.26 1.25 -3.56 0.00 0.00 178.44 177.30 3dtx h LEU 168 N 0.46 0.48 -0.93 -4.49 5.85 -1.10 -0.44 115.31 115.13 3dtx h LEU 168 Ca 0.03 -0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.76 3dtx h LEU 168 Cb 0.98 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.83 3dtx h LEU 168 CO 0.09 0.36 0.60 0.03 -0.34 0.00 0.00 178.44 179.18 3dtx h ARG 169 N 0.55 1.14 -0.59 1.25 3.08 -1.17 -0.62 114.38 118.02 3dtx h ARG 169 Ca 0.15 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 3dtx h ARG 169 Cb -0.04 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 29.72 3dtx h ARG 169 CO -0.03 0.75 0.29 -0.09 -1.07 0.00 0.00 179.97 179.82 3dtx h ARG 170 N 1.17 0.84 -0.42 0.04 2.43 -0.93 -2.29 114.38 115.22 3dtx h ARG 170 Ca 0.37 -0.12 -0.13 0.00 -0.81 0.00 0.00 59.98 59.29 3dtx h ARG 170 Cb 0.01 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 3dtx h ARG 170 CO -0.12 0.68 -0.25 1.88 -1.51 0.00 0.00 179.97 180.65 3dtx h TYR 171 N 0.80 1.00 -0.75 2.20 0.05 -0.56 -1.26 116.97 118.45 3dtx h TYR 171 Ca 0.20 -0.25 -0.04 0.00 0.05 0.00 0.00 58.73 58.69 3dtx h TYR 171 Cb 0.11 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.59 3dtx h TYR 171 CO -0.00 1.03 0.31 -0.07 -1.05 0.00 0.00 178.16 178.37 3dtx h LEU 172 N 0.75 1.03 0.55 3.88 3.38 -1.00 0.24 115.31 124.15 3dtx h LEU 172 Ca 0.09 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3dtx h LEU 172 Cb 0.80 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.29 3dtx h LEU 172 CO 0.07 0.92 -0.27 -0.08 0.09 0.00 0.00 178.44 179.17 3dtx h GLU 173 N 1.08 -0.72 -0.33 1.13 4.57 -1.28 -0.95 114.58 118.08 3dtx h GLU 173 Ca 0.25 0.05 0.03 0.00 -1.18 0.00 0.00 59.36 58.51 3dtx h GLU 173 Cb 0.20 0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 3dtx h GLU 173 CO -0.02 -0.41 0.22 -0.91 -1.18 0.00 0.00 179.01 176.71 3dtx h ASN 174 N -0.99 0.29 -0.63 1.04 2.35 -1.19 -2.13 115.58 114.32 3dtx h ASN 174 Ca -0.08 -0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.48 3dtx h ASN 174 Cb 0.64 -0.07 -0.11 0.00 0.05 0.00 0.00 38.32 38.83 3dtx h ASN 174 CO 0.12 0.20 0.20 0.61 -1.65 0.00 0.00 177.43 176.92 3dtx n GLY 175 N -1.51 3.91 0.33 2.83 0.00 0.84 -4.73 105.19 106.85 3dtx n GLY 175 Ca 0.03 -1.04 0.13 0.00 0.00 0.00 0.00 46.02 45.14 3dtx n GLY 175 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3dtx h LYS 176 N 2.28 0.09 -0.67 1.61 2.10 -0.45 0.24 116.57 121.77 3dtx h LYS 176 Ca 0.24 -0.01 0.04 0.00 -2.00 0.00 0.00 60.65 58.92 3dtx h LYS 176 Cb 2.15 -0.02 -0.04 0.00 -0.90 0.00 0.00 32.23 33.42 3dtx h LYS 176 CO 0.64 0.06 0.44 1.49 -2.00 0.00 0.00 179.45 180.08 3dtx h GLU 177 N 0.10 0.76 0.00 0.07 4.81 -1.85 -3.03 114.58 115.44 3dtx h GLU 177 Ca 0.15 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 59.15 3dtx h GLU 177 Cb 0.48 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 3dtx h GLU 177 CO -0.02 0.50 -1.63 0.25 -0.73 0.00 0.00 179.01 177.39 3dtx n THR 178 N -4.46 0.62 0.23 0.32 -2.24 -0.70 -4.38 114.28 103.66 3dtx n THR 178 Ca 0.09 -0.18 0.09 0.00 -2.27 0.00 0.00 64.05 61.77 3dtx n THR 178 Cb 0.15 -1.42 0.57 0.00 -2.10 0.00 0.00 70.33 67.53 3dtx n THR 178 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3dtx h LEU 179 N -0.29 0.00 -3.36 3.22 3.38 -0.72 -2.44 115.31 115.11 3dtx h LEU 179 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3dtx h LEU 179 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3dtx h LEU 179 CO -0.13 0.20 0.00 0.00 0.09 0.00 0.00 178.44 178.60 3dtx n GLN 180 N -3.84 3.74 -4.46 1.13 6.02 -1.14 -4.90 117.38 113.93 3dtx n GLN 180 Ca -0.02 -2.94 -0.32 0.00 -0.01 0.00 0.00 57.00 53.71 3dtx n GLN 180 Cb 0.30 -1.99 -0.16 0.00 1.02 0.00 0.00 30.24 29.40 3dtx n GLN 180 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3dtx s ARG 181 N -2.68 2.86 -0.15 -1.09 3.52 -0.92 -5.00 118.95 115.50 3dtx s ARG 181 Ca 0.47 -0.79 -0.13 0.00 -0.13 0.00 0.00 55.73 55.14 3dtx s ARG 181 Cb 0.36 -2.38 -0.05 0.00 -1.56 0.00 0.00 34.95 31.33 3dtx s ARG 181 CO 0.13 -0.09 0.29 0.00 -0.81 0.00 0.00 175.30 174.82 3dtx s ALA 182 N 1.00 3.61 -0.30 6.12 0.00 -1.26 -4.76 121.76 126.18 3dtx s ALA 182 Ca -0.03 -0.45 -0.11 0.00 0.00 0.00 0.00 51.96 51.37 3dtx s ALA 182 Cb -0.15 -2.37 -0.03 0.00 0.00 0.00 0.00 23.12 20.58 3dtx s ALA 182 CO -0.05 0.14 0.18 -0.51 0.00 0.00 0.00 175.76 175.51 3dtx s ASP 183 N 0.30 5.78 0.67 0.00 1.01 0.90 -4.62 116.67 120.72 3dtx s ASP 183 Ca 0.17 -0.28 -0.15 0.00 0.71 0.00 0.00 52.55 52.99 3dtx s ASP 183 Cb -0.13 -2.07 0.01 0.00 1.01 0.00 0.00 42.92 41.74 3dtx s ASP 183 CO 0.04 -0.13 1.15 -2.16 0.21 0.00 0.00 175.17 174.28 3dtx s PRO 184 N 1.69 2.61 0.43 8.23 0.04 -1.26 -1.28 135.00 145.47 3dtx s PRO 184 Ca 0.06 1.54 -0.25 0.00 0.04 0.00 0.00 61.00 62.40 3dtx s PRO 184 Cb -0.16 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.38 3dtx s PRO 184 CO 0.09 -1.42 1.26 -1.25 0.04 0.00 0.00 177.00 175.72 3dtx s PRO 185 N -3.95 3.84 -0.18 0.56 0.04 -1.26 -4.25 135.00 129.79 3dtx s PRO 185 Ca 0.70 2.05 -0.21 0.00 0.04 0.00 0.00 61.00 63.58 3dtx s PRO 185 Cb -0.24 -2.62 -0.03 0.00 0.04 0.00 0.00 34.50 31.66 3dtx s PRO 185 CO 0.41 -0.57 0.62 0.15 0.04 0.00 0.00 177.00 177.65 3dtx s LYS 186 N -2.42 4.25 0.02 4.56 1.02 0.12 -4.84 119.74 122.45 3dtx s LYS 186 Ca 0.60 0.62 0.08 0.00 0.02 0.00 0.00 55.97 57.29 3dtx s LYS 186 Cb -0.35 -3.55 -0.02 0.00 -0.52 0.00 0.00 37.83 33.38 3dtx s LYS 186 CO 0.45 -0.16 -0.24 0.95 -0.92 0.00 0.00 175.35 175.42 3dtx s THR 187 N 1.64 1.95 0.14 2.17 -4.23 -1.26 -1.00 115.64 115.06 3dtx s THR 187 Ca 0.29 -1.20 -0.19 0.00 -1.18 0.00 0.00 61.69 59.40 3dtx s THR 187 Cb -0.16 -1.65 0.05 0.00 1.34 0.00 0.00 72.50 72.08 3dtx s THR 187 CO 0.11 0.41 0.49 -1.38 -0.54 0.00 0.00 174.62 173.71 3dtx s HIS 188 N -0.70 -0.36 -0.13 3.99 -3.43 -1.17 -5.01 115.29 108.49 3dtx s HIS 188 Ca 0.10 0.09 0.00 0.00 -0.80 0.00 0.00 55.06 54.45 3dtx s HIS 188 Cb -0.09 0.40 -0.01 0.00 -1.43 0.00 0.00 32.58 31.44 3dtx s HIS 188 CO 0.01 -0.77 -0.14 0.08 -2.00 0.00 0.00 174.74 171.92 3dtx s VAL 189 N -3.78 2.99 0.23 -5.38 1.01 -1.26 -0.51 120.40 113.70 3dtx s VAL 189 Ca 0.02 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.40 3dtx s VAL 189 Cb 0.01 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 3dtx s VAL 189 CO -0.12 0.53 0.01 0.42 0.00 0.00 0.00 175.10 175.93 3dtx s THR 190 N 0.32 3.61 -0.17 3.92 -4.23 0.37 -4.64 115.64 114.83 3dtx s THR 190 Ca -0.11 -1.69 0.01 0.00 -1.18 0.00 0.00 61.69 58.71 3dtx s THR 190 Cb -0.16 -2.89 0.03 0.00 1.34 0.00 0.00 72.50 70.82 3dtx s THR 190 CO 0.06 -0.27 -0.13 -2.28 -0.54 0.00 0.00 174.62 171.46 3dtx s HIS 191 N -2.07 2.28 -0.47 3.99 2.46 -1.26 -0.95 115.29 119.26 3dtx s HIS 191 Ca 0.30 -1.37 0.03 0.00 0.47 0.00 0.00 55.06 54.50 3dtx s HIS 191 Cb -0.08 -1.62 0.13 0.00 -0.13 0.00 0.00 32.58 30.88 3dtx s HIS 191 CO 0.20 -0.70 0.23 -1.01 -2.47 0.00 0.00 174.74 170.98 3dtx s HIS 192 N 1.45 2.89 0.13 3.88 3.76 0.18 -4.94 115.29 122.64 3dtx s HIS 192 Ca 0.03 -2.92 -0.34 0.00 -0.15 0.00 0.00 55.06 51.67 3dtx s HIS 192 Cb -0.14 -2.56 -0.16 0.00 1.11 0.00 0.00 32.58 30.83 3dtx s HIS 192 CO -0.10 -0.78 1.23 -2.30 -0.85 0.00 0.00 174.74 171.94 3dtx n PRO 193 N 3.40 1.12 -0.12 8.40 -0.02 -1.26 0.10 135.00 146.62 3dtx n PRO 193 Ca 0.06 0.40 -0.19 0.00 -2.02 0.00 0.00 63.50 61.75 3dtx n PRO 193 Cb 0.34 -1.95 -0.11 0.00 -0.02 0.00 0.00 33.50 31.76 3dtx n PRO 193 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3dtx n ILE 194 N 1.89 1.42 -2.37 4.25 5.41 0.05 -4.82 119.36 125.19 3dtx n ILE 194 Ca 0.16 -0.51 0.00 0.00 1.00 0.00 0.00 62.75 63.41 3dtx n ILE 194 Cb 0.22 -1.46 0.00 0.00 -0.71 0.00 0.00 39.64 37.69 3dtx n ILE 194 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3dtx n SER 195 N -3.40 0.00 0.06 4.38 3.41 -0.88 -4.97 113.62 112.21 3dtx n SER 195 Ca -0.45 -0.28 0.12 0.00 -0.26 0.00 0.00 58.87 58.00 3dtx n SER 195 Cb 0.95 0.00 0.47 0.00 -0.26 0.00 0.00 64.21 65.36 3dtx n SER 195 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3dtx n ASP 196 N -0.33 0.37 -0.06 4.04 8.00 -1.26 -3.94 116.55 123.38 3dtx n ASP 196 Ca 0.00 0.56 -0.03 0.00 0.71 0.00 0.00 54.79 56.02 3dtx n ASP 196 Cb 0.00 -0.65 -0.12 0.00 -0.02 0.00 0.00 41.12 40.33 3dtx n ASP 196 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3dtx n HIS 197 N -1.87 0.00 -4.00 1.24 8.25 -1.26 -4.80 115.22 112.78 3dtx n HIS 197 Ca 0.05 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.42 3dtx n HIS 197 Cb 0.31 -0.65 -0.10 0.00 1.12 0.00 0.00 29.99 30.66 3dtx n HIS 197 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3dtx s GLU 198 N -2.58 0.47 0.05 -0.41 2.02 -1.25 -0.84 118.70 116.16 3dtx s GLU 198 Ca -0.07 -0.83 -0.02 0.00 0.02 0.00 0.00 54.97 54.07 3dtx s GLU 198 Cb 0.06 0.17 -0.03 0.00 0.10 0.00 0.00 34.13 34.43 3dtx s GLU 198 CO 0.64 -0.09 -0.00 0.00 0.02 0.00 0.00 175.26 175.82 3dtx s ALA 199 N -2.48 0.34 -0.15 5.21 0.00 -0.50 -0.77 121.76 123.41 3dtx s ALA 199 Ca -0.06 -1.01 -0.15 0.00 0.00 0.00 0.00 51.96 50.74 3dtx s ALA 199 Cb -0.02 0.26 -0.05 0.00 0.00 0.00 0.00 23.12 23.31 3dtx s ALA 199 CO -0.05 -0.34 0.34 0.99 0.00 0.00 0.00 175.76 176.71 3dtx s THR 200 N -3.39 5.27 -0.24 0.00 2.01 0.11 -0.39 115.64 119.02 3dtx s THR 200 Ca 0.02 0.66 -0.10 0.00 0.31 0.00 0.00 61.69 62.58 3dtx s THR 200 Cb 0.04 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.82 3dtx s THR 200 CO -0.08 0.38 0.15 -0.76 -0.69 0.00 0.00 174.62 173.61 3dtx s LEU 201 N 0.49 3.99 -0.18 4.42 1.43 -0.09 0.48 118.68 129.22 3dtx s LEU 201 Ca 0.19 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.34 3dtx s LEU 201 Cb -0.14 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 44.02 3dtx s LEU 201 CO 0.06 0.04 -0.18 -0.60 0.23 0.00 0.00 176.35 175.90 3dtx s ARG 202 N 1.19 3.06 -0.38 1.70 3.52 -0.13 -1.77 118.95 126.15 3dtx s ARG 202 Ca 0.07 -0.80 -0.13 0.00 -0.13 0.00 0.00 55.73 54.74 3dtx s ARG 202 Cb -0.14 -2.61 0.01 0.00 -1.56 0.00 0.00 34.95 30.66 3dtx s ARG 202 CO 0.05 -0.15 0.25 0.00 -0.81 0.00 0.00 175.30 174.64 3dtx s TRP 204 N 1.64 3.66 -0.15 0.00 0.52 0.34 -2.07 118.94 122.87 3dtx s TRP 204 Ca 0.04 1.03 -0.01 0.00 0.02 0.00 0.00 56.10 57.18 3dtx s TRP 204 Cb -0.19 -2.34 0.05 0.00 -1.15 0.00 0.00 33.47 29.84 3dtx s TRP 204 CO 0.09 0.51 -0.01 0.00 0.02 0.00 0.00 176.95 177.56 3dtx s ALA 205 N -1.33 1.13 0.09 0.98 0.00 0.05 -3.04 121.76 119.64 3dtx s ALA 205 Ca 0.33 -0.62 0.06 0.00 0.00 0.00 0.00 51.96 51.72 3dtx s ALA 205 Cb -0.16 -1.06 -0.03 0.00 0.00 0.00 0.00 23.12 21.87 3dtx s ALA 205 CO 0.18 -0.85 -0.15 -0.51 0.00 0.00 0.00 175.76 174.43 3dtx s LEU 206 N 1.79 2.31 -0.95 0.00 1.43 -0.17 -1.29 118.68 121.81 3dtx s LEU 206 Ca 0.01 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 3dtx s LEU 206 Cb -0.15 -0.56 0.00 0.00 0.03 0.00 0.00 46.19 45.51 3dtx s LEU 206 CO -0.07 -0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.03 3dtx n GLY 207 N 1.06 0.95 3.89 -3.19 0.00 -0.91 0.10 105.19 107.09 3dtx n GLY 207 Ca -0.20 -0.61 -0.31 0.00 0.00 0.00 0.00 46.02 44.91 3dtx n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3dtx s PHE 208 N -2.35 3.45 -0.13 1.61 -0.71 -1.13 -4.66 117.98 114.05 3dtx s PHE 208 Ca 0.00 0.76 -0.10 0.00 -1.04 0.00 0.00 56.93 56.55 3dtx s PHE 208 Cb 0.00 -2.17 0.04 0.00 -1.21 0.00 0.00 43.02 39.68 3dtx s PHE 208 CO 0.00 0.28 0.33 -0.47 -1.34 0.00 0.00 175.22 174.02 3dtx s TYR 209 N -1.85 -0.41 1.13 3.49 5.04 -0.40 -0.69 117.35 123.66 3dtx s TYR 209 Ca 0.45 0.95 -0.18 0.00 -2.44 0.00 0.00 57.07 55.86 3dtx s TYR 209 Cb -0.11 0.14 0.25 0.00 0.35 0.00 0.00 41.96 42.59 3dtx s TYR 209 CO 0.24 -0.22 1.15 -1.25 -1.34 0.00 0.00 175.55 174.13 3dtx s PRO 210 N 0.64 -0.63 0.46 4.97 0.04 -1.26 -0.07 135.00 139.15 3dtx s PRO 210 Ca -0.04 -0.07 0.12 0.00 0.04 0.00 0.00 61.00 61.05 3dtx s PRO 210 Cb -0.05 -1.67 1.06 0.00 0.04 0.00 0.00 34.50 33.88 3dtx s PRO 210 CO -0.04 -3.32 2.08 0.00 0.04 0.00 0.00 177.00 175.76 3dtx h ALA 211 N -2.30 1.90 -2.38 8.56 0.00 -1.94 -3.44 119.26 119.66 3dtx h ALA 211 Ca -0.46 -0.02 -0.55 0.00 0.00 0.00 0.00 54.91 53.88 3dtx h ALA 211 Cb 1.29 -0.09 0.04 0.00 0.00 0.00 0.00 17.79 19.03 3dtx h ALA 211 CO 0.38 0.06 1.06 -1.91 0.00 0.00 0.00 179.25 178.85 3dtx n GLU 212 N -4.49 2.59 -3.52 0.00 4.07 -1.26 -4.97 120.64 113.06 3dtx n GLU 212 Ca 0.02 0.94 -0.15 0.00 -0.06 0.00 0.00 57.16 57.91 3dtx n GLU 212 Cb 0.14 -2.81 -0.05 0.00 -0.06 0.00 0.00 31.44 28.67 3dtx n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 3dtx s ILE 213 N 2.65 0.01 -0.15 6.31 2.07 -1.26 -4.73 121.20 126.10 3dtx s ILE 213 Ca 0.83 -0.07 0.01 0.00 -1.41 0.00 0.00 60.65 60.01 3dtx s ILE 213 Cb -0.55 -0.98 0.02 0.00 0.13 0.00 0.00 42.46 41.08 3dtx s ILE 213 CO 0.40 -0.04 -0.18 -0.89 -1.91 0.00 0.00 174.94 172.31 3dtx s THR 214 N -2.12 1.86 -0.16 4.00 2.01 -0.85 -5.02 115.64 115.36 3dtx s THR 214 Ca -0.07 -0.83 0.01 0.00 0.31 0.00 0.00 61.69 61.11 3dtx s THR 214 Cb -0.01 -1.69 0.02 0.00 0.01 0.00 0.00 72.50 70.84 3dtx s THR 214 CO 0.01 0.51 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.50 3dtx s LEU 215 N 1.17 2.06 0.03 4.42 1.43 -1.26 -2.12 118.68 124.41 3dtx s LEU 215 Ca 0.00 -0.61 0.02 0.00 -1.03 0.00 0.00 54.13 52.51 3dtx s LEU 215 Cb -0.14 -1.43 -0.02 0.00 0.03 0.00 0.00 46.19 44.63 3dtx s LEU 215 CO -0.08 0.02 -0.07 0.42 0.23 0.00 0.00 176.35 176.86 3dtx s THR 216 N 1.18 0.52 -0.16 5.49 -4.23 -1.02 -4.95 115.64 112.48 3dtx s THR 216 Ca 0.02 -0.91 -0.08 0.00 -1.18 0.00 0.00 61.69 59.53 3dtx s THR 216 Cb -0.14 -0.56 -0.04 0.00 1.34 0.00 0.00 72.50 73.10 3dtx s THR 216 CO -0.10 -0.28 0.12 0.26 -0.54 0.00 0.00 174.62 174.09 3dtx s TRP 217 N -1.13 3.47 0.02 3.99 0.52 -1.26 -0.83 118.94 123.72 3dtx s TRP 217 Ca -0.07 0.39 0.06 0.00 0.02 0.00 0.00 56.10 56.50 3dtx s TRP 217 Cb -0.08 -2.04 -0.03 0.00 -1.15 0.00 0.00 33.47 30.16 3dtx s TRP 217 CO 0.00 0.48 -0.18 -0.65 0.02 0.00 0.00 176.95 176.62 3dtx s GLN 218 N -0.29 2.17 -0.29 4.98 -0.21 0.17 -2.24 119.66 123.95 3dtx s GLN 218 Ca 0.11 -0.92 -0.02 0.00 0.02 0.00 0.00 55.36 54.56 3dtx s GLN 218 Cb -0.12 -2.21 0.05 0.00 1.00 0.00 0.00 33.01 31.73 3dtx s GLN 218 CO 0.01 0.56 -0.02 0.50 -2.12 0.00 0.00 175.29 174.22 3dtx s ARG 219 N -1.20 2.49 0.00 2.91 3.52 -0.59 -0.03 118.95 126.05 3dtx s ARG 219 Ca 0.13 -1.22 0.00 0.00 -0.13 0.00 0.00 55.73 54.51 3dtx s ARG 219 Cb -0.10 -3.13 0.00 0.00 -1.56 0.00 0.00 34.95 30.15 3dtx s ARG 219 CO 0.04 -0.58 0.00 -0.25 -0.81 0.00 0.00 175.30 173.69 3dtx n ASP 220 N 4.62 -2.39 0.00 -2.12 8.00 0.33 -2.11 116.55 122.89 3dtx n ASP 220 Ca -0.14 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.36 3dtx n ASP 220 Cb 0.44 -2.40 0.00 0.00 -0.02 0.00 0.00 41.12 39.14 3dtx n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dtx n GLY 221 N -1.03 1.97 3.90 0.44 0.00 -1.26 -5.12 105.19 104.10 3dtx n GLY 221 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 3dtx n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dtx s GLU 222 N -0.11 3.58 -0.12 1.61 8.01 -0.90 -4.97 118.70 125.81 3dtx s GLU 222 Ca 0.00 0.33 -0.20 0.00 0.01 0.00 0.00 54.97 55.11 3dtx s GLU 222 Cb 0.00 -2.32 -0.04 0.00 -4.31 0.00 0.00 34.13 27.46 3dtx s GLU 222 CO 0.00 -0.25 0.58 0.34 0.01 0.00 0.00 175.26 175.94 3dtx s ASP 223 N -4.00 6.77 -0.44 -0.19 -1.08 -1.26 -1.54 116.67 114.93 3dtx s ASP 223 Ca 0.49 0.92 0.04 0.00 -0.52 0.00 0.00 52.55 53.48 3dtx s ASP 223 Cb -0.10 -2.34 0.61 0.00 -1.46 0.00 0.00 42.92 39.63 3dtx s ASP 223 CO 0.45 -0.10 1.83 0.00 0.52 0.00 0.00 175.17 177.87 3dtx n GLN 224 N 4.06 2.25 -0.32 4.34 1.13 -0.95 -4.71 117.38 123.19 3dtx n GLN 224 Ca -0.04 -3.11 0.12 0.00 -1.94 0.00 0.00 57.00 52.03 3dtx n GLN 224 Cb 0.51 -2.13 0.30 0.00 0.11 0.00 0.00 30.24 29.03 3dtx n GLN 224 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 3dtx h THR 225 N 1.03 0.63 0.00 5.09 2.02 -1.93 -0.02 112.91 119.71 3dtx h THR 225 Ca 0.55 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 67.48 3dtx h THR 225 Cb 2.36 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 3dtx h THR 225 CO 1.03 0.11 -0.21 -0.61 0.37 0.00 0.00 175.52 176.20 3dtx h GLN 226 N 0.60 0.00 0.00 6.66 4.15 -2.00 -3.13 115.11 121.39 3dtx h GLN 226 Ca 0.55 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.97 3dtx h GLN 226 Cb 0.91 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.60 3dtx h GLN 226 CO -0.43 0.21 -0.89 -0.25 -1.93 0.00 0.00 178.83 175.54 3dtx n ASP 227 N -3.82 0.84 -4.67 -0.69 10.43 -0.19 -4.96 116.55 113.48 3dtx n ASP 227 Ca -0.02 -0.72 -0.43 0.00 2.57 0.00 0.00 54.79 56.20 3dtx n ASP 227 Cb 0.31 1.12 -0.02 0.00 1.84 0.00 0.00 41.12 44.37 3dtx n ASP 227 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 3dtx s THR 228 N -2.56 4.75 -0.36 -3.53 2.01 -0.23 -4.60 115.64 111.12 3dtx s THR 228 Ca 0.04 2.01 -0.26 0.00 0.31 0.00 0.00 61.69 63.79 3dtx s THR 228 Cb 0.11 -4.30 0.01 0.00 0.01 0.00 0.00 72.50 68.34 3dtx s THR 228 CO 0.63 -0.07 0.93 -0.70 -0.69 0.00 0.00 174.62 174.72 3dtx s GLU 229 N 2.52 3.86 -0.29 4.92 2.12 -0.13 -4.91 118.70 126.79 3dtx s GLU 229 Ca 0.46 0.61 0.01 0.00 0.36 0.00 0.00 54.97 56.40 3dtx s GLU 229 Cb -0.17 -3.80 0.06 0.00 0.26 0.00 0.00 34.13 30.49 3dtx s GLU 229 CO 0.13 -0.93 -0.03 -1.17 -0.54 0.00 0.00 175.26 172.71 3dtx s LEU 230 N 3.46 3.86 0.62 2.70 2.96 -1.26 -0.99 118.68 130.02 3dtx s LEU 230 Ca 0.38 -1.46 -0.14 0.00 -0.22 0.00 0.00 54.13 52.68 3dtx s LEU 230 Cb -0.12 -1.64 -0.02 0.00 0.50 0.00 0.00 46.19 44.91 3dtx s LEU 230 CO 0.18 -0.26 1.06 0.68 -1.32 0.00 0.00 176.35 176.69 3dtx s VAL 231 N 1.14 3.87 0.30 1.68 -7.23 -1.12 -4.99 120.40 114.03 3dtx s VAL 231 Ca -0.05 0.81 -0.30 0.00 -1.81 0.00 0.00 61.98 60.64 3dtx s VAL 231 Cb -0.20 -3.38 -0.11 0.00 0.56 0.00 0.00 36.38 33.25 3dtx s VAL 231 CO -0.04 -0.59 1.50 -0.70 -0.31 0.00 0.00 175.10 174.96 3dtx s GLU 232 N -4.32 4.19 0.11 4.82 2.12 -1.26 -4.65 118.70 119.71 3dtx s GLU 232 Ca 0.62 2.46 -0.35 0.00 0.36 0.00 0.00 54.97 58.06 3dtx s GLU 232 Cb -0.15 -3.05 -0.14 0.00 0.26 0.00 0.00 34.13 31.05 3dtx s GLU 232 CO 0.41 -0.51 1.55 2.41 -0.54 0.00 0.00 175.26 178.58 3dtx n THR 233 N 1.83 0.05 -4.56 -1.70 -1.04 -1.26 -4.85 114.28 102.75 3dtx n THR 233 Ca 0.06 -0.01 -0.23 0.00 -2.04 0.00 0.00 64.05 61.83 3dtx n THR 233 Cb 0.39 -1.39 -0.14 0.00 -1.82 0.00 0.00 70.33 67.37 3dtx n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dtx s ARG 234 N 1.12 1.21 0.17 -2.82 1.70 -0.48 -4.95 118.95 114.90 3dtx s ARG 234 Ca 0.82 -0.82 -0.29 0.00 -0.47 0.00 0.00 55.73 54.97 3dtx s ARG 234 Cb -0.75 -1.27 -0.08 0.00 -0.57 0.00 0.00 34.95 32.29 3dtx s ARG 234 CO 0.42 0.32 0.91 -1.25 -1.08 0.00 0.00 175.30 174.62 3dtx s PRO 235 N -1.04 4.74 0.38 3.89 0.04 -1.26 -0.34 135.00 141.41 3dtx s PRO 235 Ca 0.05 1.40 0.20 0.00 0.04 0.00 0.00 61.00 62.70 3dtx s PRO 235 Cb -0.08 -3.32 0.28 0.00 0.04 0.00 0.00 34.50 31.42 3dtx s PRO 235 CO 0.01 0.40 1.56 0.00 0.04 0.00 0.00 177.00 179.02 3dtx h ALA 236 N 4.77 0.86 0.00 8.56 0.00 -1.12 -3.47 119.26 128.87 3dtx h ALA 236 Ca -0.44 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.26 3dtx h ALA 236 Cb 1.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3dtx h ALA 236 CO 0.69 0.28 0.00 0.41 0.00 0.00 0.00 179.25 180.63 3dtx n GLY 237 N 1.08 0.37 0.42 0.00 0.00 -1.26 -4.95 105.19 100.86 3dtx n GLY 237 Ca 0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.14 3dtx n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dtx n ASP 238 N 0.00 3.01 0.00 1.61 3.85 -1.26 -4.94 116.55 118.82 3dtx n ASP 238 Ca 0.00 -3.05 0.00 0.00 -0.71 0.00 0.00 54.79 51.03 3dtx n ASP 238 Cb 0.00 -0.48 0.00 0.00 -1.35 0.00 0.00 41.12 39.29 3dtx n ASP 238 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.20 175.05 3dtx n ARG 239 N -1.03 0.00 -4.39 0.11 0.63 -1.26 -5.07 116.66 105.65 3dtx n ARG 239 Ca 0.18 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.84 3dtx n ARG 239 Cb 0.75 -0.09 -0.09 0.00 0.45 0.00 0.00 32.46 33.48 3dtx n ARG 239 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3dtx s THR 240 N -2.11 2.00 0.24 5.15 -4.23 -1.26 -4.77 115.64 110.67 3dtx s THR 240 Ca 0.00 -1.85 0.06 0.00 -1.18 0.00 0.00 61.69 58.73 3dtx s THR 240 Cb 0.00 -2.85 -0.05 0.00 1.34 0.00 0.00 72.50 70.94 3dtx s THR 240 CO 0.00 0.00 -0.07 -0.36 -0.54 0.00 0.00 174.62 173.65 3dtx s PHE 241 N -2.69 1.78 0.10 3.99 0.08 0.14 -0.51 117.98 120.87 3dtx s PHE 241 Ca 0.34 -0.71 0.03 0.00 0.12 0.00 0.00 56.93 56.71 3dtx s PHE 241 Cb 0.06 -0.97 -0.04 0.00 -0.57 0.00 0.00 43.02 41.50 3dtx s PHE 241 CO 0.18 0.23 -0.08 -0.65 -0.10 0.00 0.00 175.22 174.80 3dtx s GLN 242 N -3.73 0.84 -0.08 0.44 -0.21 0.54 -2.14 119.66 115.32 3dtx s GLN 242 Ca 0.27 -1.24 -0.30 0.00 0.02 0.00 0.00 55.36 54.10 3dtx s GLN 242 Cb 0.03 -0.36 0.10 0.00 1.00 0.00 0.00 33.01 33.77 3dtx s GLN 242 CO 0.09 0.03 0.82 0.21 -2.12 0.00 0.00 175.29 174.33 3dtx s LYS 243 N -3.31 0.86 0.04 2.91 2.20 -0.41 -1.38 119.74 120.65 3dtx s LYS 243 Ca 0.09 0.13 -0.01 0.00 -0.36 0.00 0.00 55.97 55.81 3dtx s LYS 243 Cb 0.01 0.40 -0.03 0.00 -1.51 0.00 0.00 37.83 36.71 3dtx s LYS 243 CO -0.02 -0.28 -0.01 1.67 -0.36 0.00 0.00 175.35 176.34 3dtx s TRP 244 N -1.44 0.39 -0.02 4.03 1.48 -1.26 -0.77 118.94 121.36 3dtx s TRP 244 Ca -0.05 -0.82 0.05 0.00 -1.06 0.00 0.00 56.10 54.22 3dtx s TRP 244 Cb -0.00 -0.29 -0.01 0.00 -1.16 0.00 0.00 33.47 32.01 3dtx s TRP 244 CO 0.04 -0.32 -0.17 0.00 -4.06 0.00 0.00 176.95 172.44 3dtx s ALA 245 N -2.95 1.45 -0.01 2.67 0.00 -0.88 -2.81 121.76 119.24 3dtx s ALA 245 Ca -0.02 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.21 3dtx s ALA 245 Cb 0.01 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.75 3dtx s ALA 245 CO -0.06 0.34 -0.01 0.00 0.00 0.00 0.00 175.76 176.03 3dtx s ALA 246 N -0.35 0.21 0.03 0.00 0.00 -0.16 -0.27 121.76 121.22 3dtx s ALA 246 Ca 0.05 -0.01 0.07 0.00 0.00 0.00 0.00 51.96 52.08 3dtx s ALA 246 Cb -0.07 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 3dtx s ALA 246 CO -0.00 0.01 -0.21 0.14 0.00 0.00 0.00 175.76 175.70 3dtx s VAL 247 N 0.28 1.67 -0.26 0.00 -7.23 -0.73 -0.96 120.40 113.18 3dtx s VAL 247 Ca -0.02 -1.14 -0.22 0.00 -1.81 0.00 0.00 61.98 58.79 3dtx s VAL 247 Cb -0.05 -1.44 -0.01 0.00 0.56 0.00 0.00 36.38 35.44 3dtx s VAL 247 CO -0.01 0.26 0.70 -0.69 -0.31 0.00 0.00 175.10 175.05 3dtx s VAL 248 N -0.74 4.93 0.03 1.32 1.01 -1.26 -0.91 120.40 124.78 3dtx s VAL 248 Ca 0.08 1.25 0.07 0.00 0.00 0.00 0.00 61.98 63.38 3dtx s VAL 248 Cb -0.09 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 3dtx s VAL 248 CO 0.01 -0.02 -0.21 0.68 0.00 0.00 0.00 175.10 175.56 3dtx s VAL 249 N 2.63 2.56 0.16 2.92 -7.23 0.47 -4.97 120.40 116.96 3dtx s VAL 249 Ca 0.29 -1.19 -0.31 0.00 -1.81 0.00 0.00 61.98 58.95 3dtx s VAL 249 Cb -0.15 -2.04 -0.10 0.00 0.56 0.00 0.00 36.38 34.65 3dtx s VAL 249 CO 0.08 0.39 1.53 -2.84 -0.31 0.00 0.00 175.10 173.96 3dtx s PRO 250 N -1.24 4.23 0.02 4.82 0.02 -1.26 -1.41 135.00 140.18 3dtx s PRO 250 Ca 0.13 2.32 -0.36 0.00 0.02 0.00 0.00 61.00 63.10 3dtx s PRO 250 Cb -0.10 -3.16 -0.15 0.00 0.02 0.00 0.00 34.50 31.10 3dtx s PRO 250 CO 0.03 -0.57 1.51 0.43 -0.33 0.00 0.00 177.00 178.07 3dtx n SER 251 N 3.85 2.24 0.00 2.53 7.64 -0.02 -1.11 113.62 128.76 3dtx n SER 251 Ca 0.13 1.09 0.00 0.00 1.01 0.00 0.00 58.87 61.10 3dtx n SER 251 Cb 0.39 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.34 3dtx n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dtx n GLY 252 N 3.17 3.18 1.47 0.23 0.00 -1.26 -4.90 105.19 107.07 3dtx n GLY 252 Ca 0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 3dtx n GLY 252 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dtx n GLU 253 N -0.87 3.40 -0.05 1.61 1.02 -0.26 -4.59 120.64 120.90 3dtx n GLU 253 Ca 0.00 -2.08 0.03 0.00 -0.02 0.00 0.00 57.16 55.09 3dtx n GLU 253 Cb 0.00 -1.99 0.38 0.00 -0.02 0.00 0.00 31.44 29.81 3dtx n GLU 253 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3dtx h GLU 254 N 2.43 0.65 0.00 3.49 3.07 -1.91 -2.73 114.58 119.59 3dtx h GLU 254 Ca 0.05 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 3dtx h GLU 254 Cb 1.57 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 29.33 3dtx h GLU 254 CO 0.37 0.43 0.00 1.04 -1.40 0.00 0.00 179.01 179.46 3dtx n GLN 255 N -4.46 0.12 0.19 2.33 1.13 -1.26 -1.95 117.38 113.49 3dtx n GLN 255 Ca 0.04 0.06 0.14 0.00 -1.94 0.00 0.00 57.00 55.30 3dtx n GLN 255 Cb 0.05 -1.50 0.54 0.00 0.11 0.00 0.00 30.24 29.44 3dtx n GLN 255 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3dtx h ARG 256 N 0.00 0.00 -5.28 -1.09 3.08 -1.85 -3.45 114.38 105.79 3dtx h ARG 256 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 3dtx h ARG 256 Cb 0.37 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 30.27 3dtx h ARG 256 CO 0.00 0.00 -0.55 0.71 -1.07 0.00 0.00 179.97 179.06 3dtx s TYR 257 N -3.43 3.28 -0.05 3.04 1.51 -0.82 -0.51 117.35 120.37 3dtx s TYR 257 Ca 0.04 0.12 0.04 0.00 -1.01 0.00 0.00 57.07 56.26 3dtx s TYR 257 Cb 0.09 -2.09 -0.00 0.00 -0.11 0.00 0.00 41.96 39.84 3dtx s TYR 257 CO 0.49 0.18 -0.18 0.95 -1.11 0.00 0.00 175.55 175.87 3dtx s THR 258 N 0.37 1.55 -0.13 -0.71 -4.23 0.95 -4.67 115.64 108.78 3dtx s THR 258 Ca 0.04 -0.77 -0.09 0.00 -1.18 0.00 0.00 61.69 59.68 3dtx s THR 258 Cb -0.12 -1.33 -0.05 0.00 1.34 0.00 0.00 72.50 72.34 3dtx s THR 258 CO -0.00 0.44 0.19 0.00 -0.54 0.00 0.00 174.62 174.71 3dtx s HIS 260 N -0.56 2.52 -0.20 0.00 3.76 -0.01 -0.14 115.29 120.66 3dtx s HIS 260 Ca 0.15 -1.29 -0.01 0.00 -0.15 0.00 0.00 55.06 53.76 3dtx s HIS 260 Cb -0.13 -1.74 0.01 0.00 1.11 0.00 0.00 32.58 31.84 3dtx s HIS 260 CO 0.04 -0.61 -0.14 0.08 -0.85 0.00 0.00 174.74 173.26 3dtx s VAL 261 N 0.94 2.51 -0.09 -0.90 1.01 -0.72 -2.43 120.40 120.71 3dtx s VAL 261 Ca -0.05 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.12 3dtx s VAL 261 Cb -0.15 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 34.10 3dtx s VAL 261 CO -0.04 0.47 -0.12 0.00 0.00 0.00 0.00 175.10 175.42 3dtx s GLN 262 N 1.35 2.97 -0.26 2.72 -2.07 -0.90 -1.04 119.66 122.43 3dtx s GLN 262 Ca 0.05 -0.66 -0.26 0.00 -1.82 0.00 0.00 55.36 52.67 3dtx s GLN 262 Cb -0.14 -2.54 0.10 0.00 -1.09 0.00 0.00 33.01 29.34 3dtx s GLN 262 CO -0.09 0.44 0.91 -1.58 -1.32 0.00 0.00 175.29 173.64 3dtx s HIS 263 N -0.23 -0.59 0.62 9.60 2.46 -1.26 -2.01 115.29 123.88 3dtx s HIS 263 Ca 0.01 1.40 0.37 0.00 0.47 0.00 0.00 55.06 57.32 3dtx s HIS 263 Cb -0.13 0.34 2.12 0.00 -0.13 0.00 0.00 32.58 34.78 3dtx s HIS 263 CO 0.03 -0.30 2.31 1.05 -2.47 0.00 0.00 174.74 175.36 3dtx h GLU 264 N 4.34 0.00 -0.00 2.88 4.11 -1.93 -1.51 114.58 122.47 3dtx h GLU 264 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.15 3dtx h GLU 264 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3dtx h GLU 264 CO 0.11 0.00 -0.13 0.41 0.07 0.00 0.00 179.01 179.47 3dtx n GLY 265 N -1.17 -1.00 3.70 1.06 0.00 -1.26 -4.85 105.19 101.67 3dtx n GLY 265 Ca -0.03 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 3dtx n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dtx s LEU 266 N -2.55 4.29 0.15 0.99 1.43 -0.57 -4.09 118.68 118.32 3dtx s LEU 266 Ca 0.26 1.34 -0.18 0.00 -1.03 0.00 0.00 54.13 54.52 3dtx s LEU 266 Cb 0.20 -3.29 0.06 0.00 0.03 0.00 0.00 46.19 43.19 3dtx s LEU 266 CO 0.50 -0.26 1.69 -0.65 0.23 0.00 0.00 176.35 177.85 3dtx h PRO 267 N 6.96 0.03 -5.73 1.29 0.11 -1.88 -3.42 132.00 129.35 3dtx h PRO 267 Ca -0.37 -0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.24 3dtx h PRO 267 Cb 1.18 -0.01 -0.23 0.00 0.11 0.00 0.00 31.00 32.05 3dtx h PRO 267 CO 0.78 0.02 -0.81 0.15 -0.21 0.00 0.00 178.00 177.93 3dtx s LYS 268 N -6.20 1.04 0.36 1.05 -0.14 -1.26 -5.13 119.74 109.46 3dtx s LYS 268 Ca -0.14 -0.97 -0.27 0.00 -1.36 0.00 0.00 55.97 53.24 3dtx s LYS 268 Cb 0.13 -1.15 -0.12 0.00 -1.68 0.00 0.00 37.83 35.01 3dtx s LYS 268 CO 0.70 0.28 1.16 -2.30 -0.76 0.00 0.00 175.35 174.43 3dtx n PRO 269 N 1.48 1.75 -3.55 -1.68 -0.02 -1.26 -4.99 135.00 126.73 3dtx n PRO 269 Ca -0.19 0.62 -0.32 0.00 -2.02 0.00 0.00 63.50 61.59 3dtx n PRO 269 Cb 0.54 -2.17 -0.05 0.00 -0.02 0.00 0.00 33.50 31.80 3dtx n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3dtx s LEU 270 N -0.70 4.23 -0.08 2.45 1.43 -0.20 -4.95 118.68 120.86 3dtx s LEU 270 Ca 0.59 0.76 0.01 0.00 -1.03 0.00 0.00 54.13 54.45 3dtx s LEU 270 Cb -0.58 -3.46 0.02 0.00 0.03 0.00 0.00 46.19 42.20 3dtx s LEU 270 CO 0.60 0.00 -0.07 -0.89 0.23 0.00 0.00 176.35 176.22 3dtx s THR 271 N -1.71 0.83 0.16 5.49 2.01 -1.26 -1.76 115.64 119.41 3dtx s THR 271 Ca 0.43 -0.24 0.08 0.00 0.31 0.00 0.00 61.69 62.27 3dtx s THR 271 Cb -0.12 -0.84 -0.04 0.00 0.01 0.00 0.00 72.50 71.51 3dtx s THR 271 CO 0.23 0.31 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.55 3dtx s LEU 272 N 1.26 2.46 0.07 4.42 1.02 0.80 -4.95 118.68 123.75 3dtx s LEU 272 Ca -0.04 -0.89 0.02 0.00 0.02 0.00 0.00 54.13 53.23 3dtx s LEU 272 Cb -0.14 -0.72 -0.03 0.00 0.02 0.00 0.00 46.19 45.32 3dtx s LEU 272 CO -0.02 -0.10 -0.07 -0.13 0.02 0.00 0.00 176.35 176.05 3dtx s ARG 273 N -2.97 0.67 0.07 1.70 0.52 -1.26 -1.15 118.95 116.52 3dtx s ARG 273 Ca 0.16 -1.06 -0.31 0.00 -0.52 0.00 0.00 55.73 54.00 3dtx s ARG 273 Cb -0.04 -0.19 -0.08 0.00 0.52 0.00 0.00 34.95 35.16 3dtx s ARG 273 CO 0.06 -0.00 1.67 -0.46 0.02 0.00 0.00 175.30 176.58 3dtx s TRP 274 N -2.66 2.38 -0.57 -0.53 -0.11 -1.26 -4.66 118.94 111.53 3dtx s TRP 274 Ca 0.01 0.29 -0.03 0.00 1.22 0.00 0.00 56.10 57.60 3dtx s TRP 274 Cb -0.01 -3.98 0.15 0.00 -1.50 0.00 0.00 33.47 28.13 3dtx s TRP 274 CO -0.03 -3.94 0.38 -1.21 -4.62 0.00 0.00 176.95 167.53 3dtx s GLU 275 N 2.70 2.42 0.00 5.86 2.02 -1.26 -4.96 118.70 125.48 3dtx s GLU 275 Ca 0.74 -2.38 0.16 0.00 0.02 0.00 0.00 54.97 53.51 3dtx s GLU 275 Cb -0.40 -3.68 0.95 0.00 0.10 0.00 0.00 34.13 31.09 3dtx s GLU 275 CO 0.32 -1.15 1.36 -0.35 0.02 0.00 0.00 175.26 175.46