#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mv8 s SER 2 N 0.00 7.28 0.05 1.61 0.01 -1.26 -4.05 113.70 117.34 3mv8 s SER 2 Ca 0.00 1.54 -0.01 0.00 1.31 0.00 0.00 55.95 58.79 3mv8 s SER 2 Cb 0.00 -2.46 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 3mv8 s SER 2 CO 0.00 0.20 -0.01 -1.00 0.41 0.00 0.00 173.24 172.83 3mv8 s HIS 3 N -1.19 0.47 0.05 2.43 0.09 -0.39 -4.99 115.29 111.75 3mv8 s HIS 3 Ca 0.35 -0.98 -0.06 0.00 -0.00 0.00 0.00 55.06 54.37 3mv8 s HIS 3 Cb -0.22 -0.35 -0.01 0.00 -0.00 0.00 0.00 32.58 32.01 3mv8 s HIS 3 CO 0.24 -0.37 0.11 -1.54 -0.00 0.00 0.00 174.74 173.18 3mv8 s SER 4 N -2.77 0.20 -0.03 1.40 1.04 -1.26 0.11 113.70 112.39 3mv8 s SER 4 Ca 0.05 -0.62 0.06 0.00 0.48 0.00 0.00 55.95 55.92 3mv8 s SER 4 Cb 0.06 0.25 -0.01 0.00 0.10 0.00 0.00 66.02 66.42 3mv8 s SER 4 CO -0.09 -0.58 -0.23 -0.32 0.98 0.00 0.00 173.24 173.00 3mv8 s MET 5 N -3.10 2.11 -0.03 4.02 -2.45 -0.63 -0.89 119.30 118.33 3mv8 s MET 5 Ca -0.01 -0.83 -0.02 0.00 -1.25 0.00 0.00 55.69 53.58 3mv8 s MET 5 Cb 0.02 -1.91 0.02 0.00 1.25 0.00 0.00 34.83 34.20 3mv8 s MET 5 CO -0.07 0.43 0.07 1.03 1.05 0.00 0.00 175.02 177.53 3mv8 s ARG 6 N -0.34 0.04 -0.17 4.11 1.81 -0.25 -2.15 118.95 121.99 3mv8 s ARG 6 Ca 0.03 0.19 -0.06 0.00 -1.72 0.00 0.00 55.73 54.17 3mv8 s ARG 6 Cb -0.11 -0.11 -0.04 0.00 -0.45 0.00 0.00 34.95 34.24 3mv8 s ARG 6 CO 0.01 -0.10 0.03 0.71 -0.68 0.00 0.00 175.30 175.27 3mv8 s TYR 7 N 0.66 3.19 -0.23 -0.53 2.02 -0.20 -0.07 117.35 122.18 3mv8 s TYR 7 Ca -0.05 -0.02 -0.05 0.00 -0.37 0.00 0.00 57.07 56.57 3mv8 s TYR 7 Cb -0.07 -2.03 -0.02 0.00 -0.40 0.00 0.00 41.96 39.44 3mv8 s TYR 7 CO -0.02 0.12 0.00 -0.06 -1.57 0.00 0.00 175.55 174.01 3mv8 s PHE 8 N 0.31 3.01 -0.09 2.71 0.08 0.73 -2.11 117.98 122.61 3mv8 s PHE 8 Ca 0.01 -0.73 -0.03 0.00 0.12 0.00 0.00 56.93 56.30 3mv8 s PHE 8 Cb -0.13 -2.16 -0.04 0.00 -0.57 0.00 0.00 43.02 40.13 3mv8 s PHE 8 CO 0.01 -0.47 0.04 0.71 -0.10 0.00 0.00 175.22 175.41 3mv8 s TYR 9 N 1.52 3.28 -0.07 0.36 2.02 0.16 -1.41 117.35 123.21 3mv8 s TYR 9 Ca 0.06 0.28 0.03 0.00 -0.37 0.00 0.00 57.07 57.07 3mv8 s TYR 9 Cb -0.15 -1.82 0.01 0.00 -0.40 0.00 0.00 41.96 39.60 3mv8 s TYR 9 CO -0.01 0.54 -0.15 0.95 -1.57 0.00 0.00 175.55 175.31 3mv8 s THR 10 N -0.94 1.38 -0.23 -0.71 -4.23 -0.36 -1.52 115.64 109.02 3mv8 s THR 10 Ca 0.14 -0.63 0.01 0.00 -1.18 0.00 0.00 61.69 60.03 3mv8 s THR 10 Cb -0.12 -1.23 0.06 0.00 1.34 0.00 0.00 72.50 72.56 3mv8 s THR 10 CO 0.03 0.41 -0.06 0.00 -0.54 0.00 0.00 174.62 174.46 3mv8 s ALA 11 N 0.52 1.96 -0.04 3.99 0.00 0.12 -0.92 121.76 127.39 3mv8 s ALA 11 Ca -0.14 -1.33 0.04 0.00 0.00 0.00 0.00 51.96 50.53 3mv8 s ALA 11 Cb -0.16 -1.41 -0.00 0.00 0.00 0.00 0.00 23.12 21.55 3mv8 s ALA 11 CO 0.05 -1.14 -0.16 0.00 0.00 0.00 0.00 175.76 174.50 3mv8 s MET 12 N 1.40 1.68 0.50 0.00 0.23 -0.47 -0.82 119.30 121.83 3mv8 s MET 12 Ca -0.05 -0.58 -0.17 0.00 -1.03 0.00 0.00 55.69 53.86 3mv8 s MET 12 Cb -0.19 -1.48 -0.08 0.00 -1.53 0.00 0.00 34.83 31.55 3mv8 s MET 12 CO -0.06 0.23 0.98 -1.54 -2.03 0.00 0.00 175.02 172.60 3mv8 s SER 13 N 0.04 6.68 0.25 -1.18 1.04 -0.57 -1.01 113.70 118.95 3mv8 s SER 13 Ca -0.03 1.59 0.08 0.00 0.48 0.00 0.00 55.95 58.07 3mv8 s SER 13 Cb -0.11 -2.51 -0.04 0.00 0.10 0.00 0.00 66.02 63.46 3mv8 s SER 13 CO 0.02 -0.55 0.13 -0.13 0.98 0.00 0.00 173.24 173.69 3mv8 s ARG 14 N -3.91 2.72 0.73 4.02 1.81 -1.26 -4.13 118.95 118.92 3mv8 s ARG 14 Ca 0.59 -1.16 -0.16 0.00 -1.72 0.00 0.00 55.73 53.28 3mv8 s ARG 14 Cb -0.10 -2.43 0.00 0.00 -0.45 0.00 0.00 34.95 31.97 3mv8 s ARG 14 CO 0.28 0.39 0.85 -2.30 -0.68 0.00 0.00 175.30 173.84 3mv8 n PRO 15 N -1.04 0.40 0.00 3.54 -0.02 -1.26 -4.26 135.00 132.35 3mv8 n PRO 15 Ca -0.07 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 3mv8 n PRO 15 Cb 0.58 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 3mv8 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mv8 n GLY 16 N 1.22 1.51 2.69 -1.23 0.00 -1.26 -3.49 105.19 104.63 3mv8 n GLY 16 Ca 0.12 0.09 -0.03 0.00 0.00 0.00 0.00 46.02 46.20 3mv8 n GLY 16 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3mv8 n ARG 17 N 0.00 1.36 -1.71 1.61 0.00 -1.26 -4.33 116.66 112.33 3mv8 n ARG 17 Ca 0.00 -1.56 -0.30 0.00 -0.00 0.00 0.00 57.85 55.99 3mv8 n ARG 17 Cb 0.00 0.13 0.08 0.00 -0.00 0.00 0.00 32.46 32.68 3mv8 n ARG 17 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 3mv8 s GLY 18 N -1.41 1.61 0.07 2.89 0.00 -1.23 -4.99 107.32 104.26 3mv8 s GLY 18 Ca 0.13 -0.36 -0.31 0.00 0.00 0.00 0.00 44.72 44.18 3mv8 s GLY 18 CO -0.11 0.07 1.73 -0.54 0.00 0.00 0.00 173.10 174.25 3mv8 s GLU 19 N -5.30 4.18 0.47 2.90 2.02 -1.26 -4.41 118.70 117.30 3mv8 s GLU 19 Ca 0.61 2.41 -0.24 0.00 0.02 0.00 0.00 54.97 57.77 3mv8 s GLU 19 Cb -0.13 -3.69 -0.07 0.00 0.10 0.00 0.00 34.13 30.34 3mv8 s GLU 19 CO 0.52 -0.79 1.30 -2.14 0.02 0.00 0.00 175.26 174.17 3mv8 s PRO 20 N 2.98 3.59 -0.15 0.39 0.02 -1.26 -4.65 135.00 135.92 3mv8 s PRO 20 Ca 0.77 2.10 -0.15 0.00 0.02 0.00 0.00 61.00 63.74 3mv8 s PRO 20 Cb -0.41 -2.47 -0.04 0.00 0.02 0.00 0.00 34.50 31.60 3mv8 s PRO 20 CO 0.34 -0.79 0.34 0.50 -0.33 0.00 0.00 177.00 177.06 3mv8 s ARG 21 N -2.63 4.28 -0.18 5.54 3.52 -0.18 -4.90 118.95 124.41 3mv8 s ARG 21 Ca 0.64 0.19 -0.02 0.00 -0.13 0.00 0.00 55.73 56.42 3mv8 s ARG 21 Cb -0.37 -3.43 -0.01 0.00 -1.56 0.00 0.00 34.95 29.58 3mv8 s ARG 21 CO 0.45 0.21 -0.09 0.12 -0.81 0.00 0.00 175.30 175.19 3mv8 s PHE 22 N 0.52 2.90 -0.07 5.12 5.36 -1.26 -1.36 117.98 129.19 3mv8 s PHE 22 Ca 0.19 -0.81 0.05 0.00 -0.96 0.00 0.00 56.93 55.40 3mv8 s PHE 22 Cb -0.14 -1.98 -0.00 0.00 -0.34 0.00 0.00 43.02 40.56 3mv8 s PHE 22 CO 0.06 -0.39 -0.22 0.42 -1.46 0.00 0.00 175.22 173.63 3mv8 s ILE 23 N 0.93 1.82 -0.09 3.12 1.01 -0.10 -1.21 121.20 126.68 3mv8 s ILE 23 Ca -0.02 -0.92 0.04 0.00 0.00 0.00 0.00 60.65 59.76 3mv8 s ILE 23 Cb -0.15 -1.56 -0.00 0.00 0.01 0.00 0.00 42.46 40.76 3mv8 s ILE 23 CO 0.00 0.51 -0.23 0.00 0.00 0.00 0.00 174.94 175.22 3mv8 s ALA 24 N 0.09 2.22 -0.04 9.38 0.00 -0.17 -1.22 121.76 132.02 3mv8 s ALA 24 Ca -0.09 -0.98 0.04 0.00 0.00 0.00 0.00 51.96 50.94 3mv8 s ALA 24 Cb -0.14 -0.82 -0.00 0.00 0.00 0.00 0.00 23.12 22.15 3mv8 s ALA 24 CO 0.05 0.32 -0.16 0.14 0.00 0.00 0.00 175.76 176.10 3mv8 s VAL 25 N 0.21 1.36 -0.03 0.00 -7.23 -0.50 -1.01 120.40 113.20 3mv8 s VAL 25 Ca -0.14 -0.68 0.02 0.00 -1.81 0.00 0.00 61.98 59.36 3mv8 s VAL 25 Cb -0.17 -1.17 -0.03 0.00 0.56 0.00 0.00 36.38 35.57 3mv8 s VAL 25 CO 0.07 0.39 -0.05 -0.83 -0.31 0.00 0.00 175.10 174.38 3mv8 s GLY 26 N 0.01 1.77 -0.02 2.32 0.00 -0.92 -0.19 107.32 110.28 3mv8 s GLY 26 Ca -0.03 -0.95 0.02 0.00 0.00 0.00 0.00 44.72 43.76 3mv8 s GLY 26 CO 0.02 -0.78 -0.05 -0.19 0.00 0.00 0.00 173.10 172.09 3mv8 s TYR 27 N -0.95 0.60 -0.31 1.90 2.02 0.90 -1.39 117.35 120.12 3mv8 s TYR 27 Ca 0.16 -0.13 -0.06 0.00 -0.37 0.00 0.00 57.07 56.67 3mv8 s TYR 27 Cb -0.11 -0.47 0.02 0.00 -0.40 0.00 0.00 41.96 41.00 3mv8 s TYR 27 CO 0.06 -0.08 0.08 0.08 -1.57 0.00 0.00 175.55 174.12 3mv8 s VAL 28 N 0.30 3.81 0.00 0.71 1.01 0.12 -1.09 120.40 125.27 3mv8 s VAL 28 Ca -0.04 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.08 3mv8 s VAL 28 Cb -0.08 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.27 3mv8 s VAL 28 CO -0.00 0.00 0.00 0.47 0.00 0.00 0.00 175.10 175.57 3mv8 n ASP 29 N 4.83 0.00 -1.77 3.32 8.00 -0.06 -0.71 116.55 130.16 3mv8 n ASP 29 Ca -0.14 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.43 3mv8 n ASP 29 Cb 0.47 0.00 0.39 0.00 -0.02 0.00 0.00 41.12 41.96 3mv8 n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3mv8 n ASP 30 N 6.77 5.47 -4.22 -2.24 8.00 -1.26 -4.87 116.55 124.20 3mv8 n ASP 30 Ca 0.00 -2.89 -0.38 0.00 0.71 0.00 0.00 54.79 52.23 3mv8 n ASP 30 Cb 0.00 -0.66 -0.12 0.00 -0.02 0.00 0.00 41.12 40.32 3mv8 n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3mv8 s THR 31 N -2.67 3.66 0.40 -3.53 2.01 0.12 -5.08 115.64 110.54 3mv8 s THR 31 Ca 0.53 -1.46 -0.27 0.00 0.31 0.00 0.00 61.69 60.80 3mv8 s THR 31 Cb 0.40 -3.22 -0.10 0.00 0.01 0.00 0.00 72.50 69.59 3mv8 s THR 31 CO 0.16 -0.37 1.43 1.67 -0.69 0.00 0.00 174.62 176.82 3mv8 n GLN 32 N 4.76 2.44 0.00 4.92 7.27 -1.26 -0.70 117.38 134.80 3mv8 n GLN 32 Ca -0.10 0.86 0.00 0.00 0.07 0.00 0.00 57.00 57.83 3mv8 n GLN 32 Cb 0.43 -2.60 0.00 0.00 2.41 0.00 0.00 30.24 30.49 3mv8 n GLN 32 CO 0.00 0.00 0.00 1.97 0.07 0.00 0.00 177.06 179.10 3mv8 n PHE 33 N 0.19 0.00 -3.97 3.69 1.16 -0.49 -4.15 117.46 113.90 3mv8 n PHE 33 Ca 0.03 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.52 3mv8 n PHE 33 Cb 0.39 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.16 3mv8 n PHE 33 CO 0.00 0.00 0.00 0.14 -1.87 0.00 0.00 176.76 175.03 3mv8 s VAL 34 N -0.09 0.13 -0.06 1.97 -7.23 -1.23 -0.40 120.40 113.49 3mv8 s VAL 34 Ca 0.00 -1.08 -0.05 0.00 -1.81 0.00 0.00 61.98 59.04 3mv8 s VAL 34 Cb 0.00 -0.63 0.02 0.00 0.56 0.00 0.00 36.38 36.33 3mv8 s VAL 34 CO 0.00 -0.59 0.16 -0.60 -0.31 0.00 0.00 175.10 173.75 3mv8 s ARG 35 N -2.11 0.18 -0.04 4.82 3.52 -0.11 -2.16 118.95 123.05 3mv8 s ARG 35 Ca -0.10 0.22 0.03 0.00 -0.13 0.00 0.00 55.73 55.75 3mv8 s ARG 35 Cb -0.05 0.08 0.01 0.00 -1.56 0.00 0.00 34.95 33.43 3mv8 s ARG 35 CO -0.03 -0.03 -0.10 0.12 -0.81 0.00 0.00 175.30 174.45 3mv8 s PHE 36 N 0.11 1.15 -0.15 5.12 5.36 -0.18 0.04 117.98 129.43 3mv8 s PHE 36 Ca -0.00 -0.34 -0.01 0.00 -0.96 0.00 0.00 56.93 55.62 3mv8 s PHE 36 Cb -0.01 -0.83 0.04 0.00 -0.34 0.00 0.00 43.02 41.87 3mv8 s PHE 36 CO 0.00 -0.16 -0.03 0.34 -1.46 0.00 0.00 175.22 173.91 3mv8 s ASP 37 N 0.37 2.61 0.14 6.13 -1.08 -1.26 -1.00 116.67 122.57 3mv8 s ASP 37 Ca -0.07 -0.58 0.18 0.00 -0.52 0.00 0.00 52.55 51.56 3mv8 s ASP 37 Cb -0.11 -0.78 0.77 0.00 -1.46 0.00 0.00 42.92 41.33 3mv8 s ASP 37 CO 0.01 -0.20 1.54 -1.54 0.52 0.00 0.00 175.17 175.51 3mv8 n SER 38 N 4.95 0.34 -4.48 -0.34 3.41 -0.35 -4.34 113.62 112.82 3mv8 n SER 38 Ca -0.11 0.60 -0.44 0.00 -0.26 0.00 0.00 58.87 58.66 3mv8 n SER 38 Cb 0.48 -0.67 -0.00 0.00 -0.26 0.00 0.00 64.21 63.76 3mv8 n SER 38 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3mv8 s ASP 39 N -3.64 7.01 0.07 4.04 -1.08 -1.26 -4.84 116.67 116.98 3mv8 s ASP 39 Ca 0.04 -2.86 -0.27 0.00 -0.52 0.00 0.00 52.55 48.94 3mv8 s ASP 39 Cb 0.08 -2.42 0.08 0.00 -1.46 0.00 0.00 42.92 39.20 3mv8 s ASP 39 CO 0.29 -0.82 0.96 0.00 0.52 0.00 0.00 175.17 176.11 3mv8 s ALA 40 N 1.99 -1.77 0.06 3.66 0.00 -1.26 -5.05 121.76 119.40 3mv8 s ALA 40 Ca 0.44 0.54 -0.19 0.00 0.00 0.00 0.00 51.96 52.74 3mv8 s ALA 40 Cb -0.02 0.52 -0.11 0.00 0.00 0.00 0.00 23.12 23.50 3mv8 s ALA 40 CO 0.00 -0.90 1.42 0.00 0.00 0.00 0.00 175.76 176.28 3mv8 h ALA 41 N 2.00 0.28 -2.76 0.00 0.00 -1.96 -3.38 119.26 113.44 3mv8 h ALA 41 Ca -0.23 -0.30 -0.60 0.00 0.00 0.00 0.00 54.91 53.78 3mv8 h ALA 41 Cb 1.23 -0.07 -0.40 0.00 0.00 0.00 0.00 17.79 18.56 3mv8 h ALA 41 CO 0.28 0.13 -0.79 -1.12 0.00 0.00 0.00 179.25 177.74 3mv8 s SER 42 N -6.11 3.09 0.28 0.00 0.01 -1.26 -5.12 113.70 104.59 3mv8 s SER 42 Ca -0.14 -2.98 -0.29 0.00 1.31 0.00 0.00 55.95 53.85 3mv8 s SER 42 Cb 0.06 -0.89 -0.10 0.00 0.21 0.00 0.00 66.02 65.31 3mv8 s SER 42 CO 0.76 -0.20 1.12 -2.16 0.41 0.00 0.00 173.24 173.17 3mv8 s PRO 43 N -0.04 4.61 0.02 12.44 0.04 -1.26 -5.04 135.00 145.76 3mv8 s PRO 43 Ca 0.24 1.85 0.01 0.00 0.04 0.00 0.00 61.00 63.14 3mv8 s PRO 43 Cb -0.11 -3.18 -0.02 0.00 0.04 0.00 0.00 34.50 31.23 3mv8 s PRO 43 CO -0.10 0.16 -0.05 1.03 0.04 0.00 0.00 177.00 178.09 3mv8 s ARG 44 N -1.43 0.38 0.26 4.56 0.52 -1.26 -5.05 118.95 116.93 3mv8 s ARG 44 Ca 0.45 -0.54 -0.30 0.00 -0.52 0.00 0.00 55.73 54.82 3mv8 s ARG 44 Cb -0.33 -0.13 -0.10 0.00 0.52 0.00 0.00 34.95 34.91 3mv8 s ARG 44 CO 0.42 0.02 1.41 0.99 0.02 0.00 0.00 175.30 178.15 3mv8 s THR 45 N -1.08 2.71 0.02 0.02 2.01 -1.26 -4.58 115.64 113.47 3mv8 s THR 45 Ca -0.09 0.61 0.07 0.00 0.31 0.00 0.00 61.69 62.59 3mv8 s THR 45 Cb -0.08 -3.39 -0.02 0.00 0.01 0.00 0.00 72.50 69.02 3mv8 s THR 45 CO -0.00 0.11 -0.21 -1.61 -0.69 0.00 0.00 174.62 172.22 3mv8 s GLU 46 N -0.63 1.49 0.44 4.92 2.02 0.11 -4.96 118.70 122.09 3mv8 s GLU 46 Ca 0.57 -0.88 -0.23 0.00 0.02 0.00 0.00 54.97 54.46 3mv8 s GLU 46 Cb -0.41 -1.55 -0.08 0.00 0.10 0.00 0.00 34.13 32.19 3mv8 s GLU 46 CO 0.45 0.40 1.10 -1.25 0.02 0.00 0.00 175.26 175.99 3mv8 s PRO 47 N -0.95 3.92 0.00 0.39 0.04 -1.26 -0.93 135.00 136.20 3mv8 s PRO 47 Ca 0.08 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.73 3mv8 s PRO 47 Cb -0.09 -2.42 0.00 0.00 0.04 0.00 0.00 34.50 32.04 3mv8 s PRO 47 CO 0.01 -0.38 0.30 0.54 0.04 0.00 0.00 177.00 177.51 3mv8 n ARG 48 N -0.39 0.35 -4.11 4.56 5.12 0.46 -4.83 116.66 117.82 3mv8 n ARG 48 Ca 0.07 -0.30 -0.15 0.00 -1.93 0.00 0.00 57.85 55.54 3mv8 n ARG 48 Cb 0.49 -0.77 -0.14 0.00 -1.16 0.00 0.00 32.46 30.88 3mv8 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3mv8 s ALA 49 N -0.14 0.43 0.35 7.54 0.00 -1.24 -4.69 121.76 124.02 3mv8 s ALA 49 Ca 0.00 -0.36 0.07 0.00 0.00 0.00 0.00 51.96 51.67 3mv8 s ALA 49 Cb 0.00 -0.06 0.77 0.00 0.00 0.00 0.00 23.12 23.84 3mv8 s ALA 49 CO 0.00 0.06 1.90 -1.00 0.00 0.00 0.00 175.76 176.72 3mv8 h PRO 50 N 5.60 0.72 0.00 0.00 0.13 -1.95 -2.78 132.00 133.72 3mv8 h PRO 50 Ca -0.30 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3mv8 h PRO 50 Cb 1.20 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3mv8 h PRO 50 CO 0.48 0.47 0.00 -2.67 -0.23 0.00 0.00 178.00 176.05 3mv8 n TRP 51 N -4.53 0.00 0.58 1.56 4.27 -1.26 -2.73 117.44 115.32 3mv8 n TRP 51 Ca 0.15 0.00 0.11 0.00 -3.89 0.00 0.00 57.50 53.87 3mv8 n TRP 51 Cb 0.38 -0.40 -0.06 0.00 -1.36 0.00 0.00 31.31 29.87 3mv8 n TRP 51 CO 0.00 0.00 0.00 1.51 -2.29 0.00 0.00 177.69 176.91 3mv8 n ILE 52 N -1.40 0.08 0.26 -1.67 0.13 -1.05 -4.33 119.36 111.39 3mv8 n ILE 52 Ca 0.08 -0.22 0.09 0.00 -1.10 0.00 0.00 62.75 61.60 3mv8 n ILE 52 Cb 0.23 0.40 0.66 0.00 -0.84 0.00 0.00 39.64 40.09 3mv8 n ILE 52 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 3mv8 h GLU 53 N 0.00 0.00 0.00 9.51 5.08 -1.62 -2.07 114.58 125.48 3mv8 h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3mv8 h GLU 53 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 3mv8 h GLU 53 CO 0.00 0.03 0.00 -0.56 -1.00 0.00 0.00 179.01 177.48 3mv8 h GLN 54 N 0.00 0.00 -6.71 2.33 3.07 -1.78 -3.44 115.11 108.58 3mv8 h GLN 54 Ca -0.00 0.00 -0.53 0.00 0.09 0.00 0.00 58.65 58.21 3mv8 h GLN 54 Cb 0.06 0.00 0.05 0.00 0.08 0.00 0.00 27.48 27.67 3mv8 h GLN 54 CO 0.00 0.00 0.74 -1.21 0.09 0.00 0.00 178.83 178.46 3mv8 s GLU 55 N -3.44 4.29 0.95 0.06 0.41 -0.78 -5.00 118.70 115.19 3mv8 s GLU 55 Ca 0.03 2.24 -0.12 0.00 -0.41 0.00 0.00 54.97 56.70 3mv8 s GLU 55 Cb 0.09 -3.14 0.16 0.00 -1.78 0.00 0.00 34.13 29.46 3mv8 s GLU 55 CO 0.40 -0.40 1.12 0.20 -0.49 0.00 0.00 175.26 176.09 3mv8 s GLY 56 N 0.46 1.57 0.40 -1.39 0.00 -1.26 -4.86 107.32 102.23 3mv8 s GLY 56 Ca 0.60 -0.47 0.12 0.00 0.00 0.00 0.00 44.72 44.96 3mv8 s GLY 56 CO 0.40 0.11 1.93 -0.56 0.00 0.00 0.00 173.10 174.98 3mv8 h PRO 57 N -1.66 0.53 -0.81 2.90 0.13 -1.98 -1.91 132.00 129.20 3mv8 h PRO 57 Ca -0.52 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.53 3mv8 h PRO 57 Cb 1.33 -0.12 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 3mv8 h PRO 57 CO 0.60 0.35 0.33 0.93 -0.23 0.00 0.00 178.00 179.99 3mv8 h GLU 58 N 0.55 1.21 -0.22 0.86 5.08 -1.99 -1.07 114.58 118.99 3mv8 h GLU 58 Ca 0.36 -0.21 0.04 0.00 -1.00 0.00 0.00 59.36 58.55 3mv8 h GLU 58 Cb 0.65 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 3mv8 h GLU 58 CO -0.13 0.97 -0.02 -0.92 -1.00 0.00 0.00 179.01 177.91 3mv8 h TYR 59 N 1.18 -0.05 -0.69 4.33 3.20 -1.70 -1.67 116.97 121.56 3mv8 h TYR 59 Ca 0.27 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.09 3mv8 h TYR 59 Cb 0.20 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 3mv8 h TYR 59 CO 0.02 -0.06 0.18 -1.49 -1.64 0.00 0.00 178.16 175.17 3mv8 h TRP 60 N 0.04 1.15 -0.49 -3.82 4.06 -1.38 -2.55 115.95 112.96 3mv8 h TRP 60 Ca 0.11 -0.13 -0.06 0.00 2.06 0.00 0.00 58.89 60.87 3mv8 h TRP 60 Cb 0.15 -0.33 -0.02 0.00 -1.00 0.00 0.00 29.16 27.96 3mv8 h TRP 60 CO -0.20 0.94 0.09 0.22 -3.56 0.00 0.00 178.44 175.92 3mv8 h ASP 61 N 1.03 0.78 -0.48 -3.49 3.58 -1.04 -1.07 116.42 115.73 3mv8 h ASP 61 Ca 0.22 -0.26 0.07 0.00 0.42 0.00 0.00 57.03 57.48 3mv8 h ASP 61 Cb 0.36 -0.21 -0.06 0.00 1.72 0.00 0.00 39.33 41.14 3mv8 h ASP 61 CO 0.00 0.84 0.13 0.03 -2.88 0.00 0.00 179.24 177.36 3mv8 h ARG 62 N 0.69 0.28 0.29 0.28 3.08 -1.16 0.14 114.38 117.97 3mv8 h ARG 62 Ca 0.15 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 3mv8 h ARG 62 Cb 0.38 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 3mv8 h ARG 62 CO 0.01 0.18 -0.26 -0.91 -1.07 0.00 0.00 179.97 177.92 3mv8 h ASN 63 N 0.29 -0.69 -0.66 7.04 2.35 -1.32 -2.11 115.58 120.46 3mv8 h ASN 63 Ca 0.23 0.06 0.04 0.00 -0.55 0.00 0.00 56.30 56.09 3mv8 h ASN 63 Cb 0.28 0.23 -0.05 0.00 0.05 0.00 0.00 38.32 38.83 3mv8 h ASN 63 CO -0.27 -0.38 0.39 0.74 -1.65 0.00 0.00 177.43 176.26 3mv8 h THR 64 N -0.57 1.03 -0.61 2.81 2.02 -0.78 -0.60 112.91 116.22 3mv8 h THR 64 Ca -0.01 -0.26 -0.07 0.00 0.77 0.00 0.00 66.41 66.84 3mv8 h THR 64 Cb 0.52 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 3mv8 h THR 64 CO -0.04 0.14 0.11 1.56 0.37 0.00 0.00 175.52 177.66 3mv8 h GLN 65 N 0.75 0.98 -0.06 6.66 1.08 -0.71 0.34 115.11 124.15 3mv8 h GLN 65 Ca 0.28 -0.24 -0.00 0.00 -1.45 0.00 0.00 58.65 57.24 3mv8 h GLN 65 Cb 0.09 -0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 27.39 3mv8 h GLN 65 CO -0.14 0.89 0.04 0.82 -0.95 0.00 0.00 178.83 179.49 3mv8 h ILE 66 N 0.93 1.06 -0.01 2.54 2.04 -0.76 -1.60 117.51 121.70 3mv8 h ILE 66 Ca 0.19 -0.16 -0.12 0.00 1.00 0.00 0.00 64.86 65.77 3mv8 h ILE 66 Cb 0.38 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3mv8 h ILE 66 CO 0.01 0.05 -0.57 -0.26 0.00 0.00 0.00 178.15 177.38 3mv8 h PHE 67 N 0.03 0.05 -0.22 1.37 0.04 -0.78 -0.65 116.94 116.78 3mv8 h PHE 67 Ca 0.02 -0.02 -0.17 0.00 2.80 0.00 0.00 57.97 60.60 3mv8 h PHE 67 Cb 0.05 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.19 3mv8 h PHE 67 CO -0.06 0.60 -0.56 0.87 -0.60 0.00 0.00 178.31 178.56 3mv8 h LYS 68 N 0.03 0.69 -0.32 1.51 1.57 -0.28 -1.54 116.57 118.23 3mv8 h LYS 68 Ca -0.01 -0.44 -0.09 0.00 -1.87 0.00 0.00 60.65 58.25 3mv8 h LYS 68 Cb 1.02 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 3mv8 h LYS 68 CO 0.08 1.06 -0.14 1.15 -0.57 0.00 0.00 179.45 181.03 3mv8 h THR 69 N 0.52 1.29 -0.90 -0.16 2.02 -1.09 -3.02 112.91 111.57 3mv8 h THR 69 Ca 0.01 -1.24 0.03 0.00 0.77 0.00 0.00 66.41 65.98 3mv8 h THR 69 Cb 1.14 1.42 -0.05 0.00 -1.74 0.00 0.00 68.15 68.92 3mv8 h THR 69 CO 0.11 0.40 0.59 0.78 0.37 0.00 0.00 175.52 177.78 3mv8 h ASN 70 N 0.42 0.99 -0.58 4.18 4.21 -1.09 -1.06 115.58 122.65 3mv8 h ASN 70 Ca 0.07 -0.02 0.11 0.00 1.21 0.00 0.00 56.30 57.68 3mv8 h ASN 70 Cb 0.66 -0.24 -0.09 0.00 -1.12 0.00 0.00 38.32 37.54 3mv8 h ASN 70 CO 0.04 0.70 0.04 0.74 -1.29 0.00 0.00 177.43 177.66 3mv8 h THR 71 N 1.16 0.57 0.46 2.81 2.02 -1.16 0.23 112.91 119.01 3mv8 h THR 71 Ca 0.35 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.45 3mv8 h THR 71 Cb -0.04 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 66.78 3mv8 h THR 71 CO -0.09 0.03 -0.22 -0.61 0.37 0.00 0.00 175.52 174.99 3mv8 h GLN 72 N 0.16 -0.60 -0.15 6.66 4.15 -1.21 -3.18 115.11 120.95 3mv8 h GLN 72 Ca 0.30 0.04 -0.13 0.00 0.77 0.00 0.00 58.65 59.63 3mv8 h GLN 72 Cb 0.47 0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.28 3mv8 h GLN 72 CO -0.46 -0.31 -0.48 1.79 -1.93 0.00 0.00 178.83 177.45 3mv8 h THR 73 N -0.86 1.33 0.00 2.39 1.35 -1.02 -2.95 112.91 113.15 3mv8 h THR 73 Ca -0.06 -1.69 -0.01 0.00 -0.55 0.00 0.00 66.41 64.10 3mv8 h THR 73 Cb 0.57 1.74 -0.00 0.00 -1.73 0.00 0.00 68.15 68.73 3mv8 h THR 73 CO 0.10 0.51 -0.05 1.88 -0.25 0.00 0.00 175.52 177.72 3mv8 h TYR 74 N 0.30 0.00 -0.30 4.73 -1.99 -0.64 -1.51 116.97 117.56 3mv8 h TYR 74 Ca 0.02 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.70 3mv8 h TYR 74 Cb 0.95 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.67 3mv8 h TYR 74 CO 0.03 0.05 0.03 -0.09 -0.00 0.00 0.00 178.16 178.17 3mv8 h ARG 75 N 0.00 0.52 -0.59 4.88 2.43 -1.49 -1.73 114.38 118.40 3mv8 h ARG 75 Ca -0.00 -0.15 -0.09 0.00 -0.81 0.00 0.00 59.98 58.93 3mv8 h ARG 75 Cb 0.56 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 3mv8 h ARG 75 CO 0.01 0.64 0.03 1.49 -1.51 0.00 0.00 179.97 180.62 3mv8 h GLU 76 N 0.33 1.01 -0.75 0.20 4.81 -1.41 -2.44 114.58 116.33 3mv8 h GLU 76 Ca 0.09 -0.30 0.03 0.00 -0.13 0.00 0.00 59.36 59.05 3mv8 h GLU 76 Cb 0.39 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 3mv8 h GLU 76 CO 0.01 0.98 0.48 0.77 -0.73 0.00 0.00 179.01 180.52 3mv8 h SER 77 N 0.94 0.81 -0.84 1.04 0.02 -1.27 0.64 113.55 114.88 3mv8 h SER 77 Ca 0.17 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 3mv8 h SER 77 Cb 0.50 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.82 3mv8 h SER 77 CO 0.02 0.56 0.48 -0.07 -1.14 0.00 0.00 176.83 176.69 3mv8 h LEU 78 N 0.95 1.04 -0.51 5.07 3.38 -1.00 0.93 115.31 125.16 3mv8 h LEU 78 Ca 0.29 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 58.10 3mv8 h LEU 78 Cb -0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 3mv8 h LEU 78 CO -0.10 0.82 -0.04 -0.09 0.09 0.00 0.00 178.44 179.13 3mv8 h ARG 79 N 1.18 0.93 -0.26 1.13 2.43 -0.97 -2.06 114.38 116.75 3mv8 h ARG 79 Ca 0.30 -0.31 0.03 0.00 -0.81 0.00 0.00 59.98 59.19 3mv8 h ARG 79 Cb -0.01 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 3mv8 h ARG 79 CO -0.05 0.97 0.07 -0.91 -1.51 0.00 0.00 179.97 178.53 3mv8 h ASN 80 N 0.79 0.05 -0.58 -3.80 2.35 -0.25 -2.47 115.58 111.67 3mv8 h ASN 80 Ca 0.14 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.90 3mv8 h ASN 80 Cb 0.57 0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.95 3mv8 h ASN 80 CO 0.03 0.06 0.27 -0.07 -1.65 0.00 0.00 177.43 176.08 3mv8 h LEU 81 N 0.18 0.77 -0.44 1.61 -0.00 -0.76 -1.64 115.31 115.03 3mv8 h LEU 81 Ca 0.12 -0.14 0.09 0.00 -0.00 0.00 0.00 57.88 57.95 3mv8 h LEU 81 Cb 0.11 -0.20 -0.08 0.00 -0.00 0.00 0.00 40.66 40.48 3mv8 h LEU 81 CO -0.14 0.70 -0.11 0.03 -0.00 0.00 0.00 178.44 178.92 3mv8 h ARG 82 N 0.80 -0.00 -0.35 1.13 3.08 -1.30 -2.19 114.38 115.54 3mv8 h ARG 82 Ca 0.20 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.27 3mv8 h ARG 82 Cb 0.14 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 3mv8 h ARG 82 CO -0.02 -0.00 0.18 0.78 -1.07 0.00 0.00 179.97 179.84 3mv8 h GLY 83 N -0.00 0.47 0.62 0.04 0.00 -0.93 0.12 103.07 103.39 3mv8 h GLY 83 Ca 0.21 -0.13 0.09 0.00 0.00 0.00 0.00 47.33 47.50 3mv8 h GLY 83 CO -0.45 0.10 0.62 -0.97 0.00 0.00 0.00 176.54 175.84 3mv8 h TYR 84 N 0.37 1.13 -0.63 5.60 0.05 -0.91 -2.48 116.97 120.11 3mv8 h TYR 84 Ca 0.14 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.95 3mv8 h TYR 84 Cb 0.04 -0.36 0.00 0.00 1.01 0.00 0.00 36.73 37.42 3mv8 h TYR 84 CO -0.09 0.52 0.00 0.66 -1.05 0.00 0.00 178.16 178.20 3mv8 n TYR 85 N -4.58 1.15 -4.11 4.88 4.01 -0.80 -4.96 117.16 112.75 3mv8 n TYR 85 Ca 0.16 -0.57 -0.31 0.00 -0.16 0.00 0.00 57.90 57.02 3mv8 n TYR 85 Cb 0.25 -0.13 -0.03 0.00 -0.31 0.00 0.00 39.34 39.12 3mv8 n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3mv8 n ASN 86 N 1.17 -1.93 -4.89 7.72 4.13 0.30 -4.96 115.26 116.80 3mv8 n ASN 86 Ca 0.23 -1.02 -0.35 0.00 1.68 0.00 0.00 54.58 55.13 3mv8 n ASN 86 Cb 0.74 -2.86 -0.05 0.00 -1.54 0.00 0.00 39.78 36.06 3mv8 n ASN 86 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 3mv8 s GLN 87 N -6.79 3.46 0.93 3.52 -0.21 -0.53 -5.03 119.66 115.02 3mv8 s GLN 87 Ca 0.40 -0.21 -0.15 0.00 0.02 0.00 0.00 55.36 55.43 3mv8 s GLN 87 Cb -0.22 -3.13 0.17 0.00 1.00 0.00 0.00 33.01 30.83 3mv8 s GLN 87 CO 0.91 0.71 1.26 -1.54 -2.12 0.00 0.00 175.29 174.52 3mv8 s SER 88 N -1.54 3.38 0.32 5.90 1.04 -1.26 -4.68 113.70 116.85 3mv8 s SER 88 Ca 0.22 0.47 0.02 0.00 0.48 0.00 0.00 55.95 57.14 3mv8 s SER 88 Cb -0.13 -0.67 0.54 0.00 0.10 0.00 0.00 66.02 65.87 3mv8 s SER 88 CO 0.13 -2.59 1.90 -0.33 0.98 0.00 0.00 173.24 173.33 3mv8 h GLU 89 N -1.54 0.73 -2.18 4.02 4.39 -1.99 -3.39 114.58 114.62 3mv8 h GLU 89 Ca -0.45 -0.11 -0.59 0.00 0.34 0.00 0.00 59.36 58.55 3mv8 h GLU 89 Cb 1.27 -0.13 -0.41 0.00 -0.10 0.00 0.00 28.75 29.38 3mv8 h GLU 89 CO 0.47 0.62 -0.79 0.00 -1.16 0.00 0.00 179.01 178.14 3mv8 n ALA 90 N -2.46 3.40 0.00 3.43 0.00 -1.26 -4.34 120.51 119.28 3mv8 n ALA 90 Ca 0.04 -4.21 0.00 0.00 0.00 0.00 0.00 53.44 49.27 3mv8 n ALA 90 Cb 0.17 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 18.75 3mv8 n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mv8 n GLY 91 N 1.19 0.73 3.10 0.00 0.00 -1.26 -4.83 105.19 104.12 3mv8 n GLY 91 Ca 0.26 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 45.18 3mv8 n GLY 91 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3mv8 s SER 92 N -1.29 3.06 0.14 1.61 0.15 -1.26 -4.33 113.70 111.78 3mv8 s SER 92 Ca 0.00 -0.62 0.00 0.00 0.70 0.00 0.00 55.95 56.03 3mv8 s SER 92 Cb 0.00 -1.43 -0.04 0.00 -1.71 0.00 0.00 66.02 62.84 3mv8 s SER 92 CO 0.00 -0.01 0.03 -1.00 1.20 0.00 0.00 173.24 173.46 3mv8 s HIS 93 N 1.31 0.97 -0.04 3.44 3.76 -1.26 -4.97 115.29 118.51 3mv8 s HIS 93 Ca 0.05 -1.14 -0.01 0.00 -0.15 0.00 0.00 55.06 53.80 3mv8 s HIS 93 Cb -0.13 -0.56 0.03 0.00 1.11 0.00 0.00 32.58 33.04 3mv8 s HIS 93 CO -0.12 -0.39 0.06 -1.50 -0.85 0.00 0.00 174.74 171.93 3mv8 s ILE 94 N -3.89 -0.09 -0.18 0.60 2.07 -1.26 -1.51 121.20 116.93 3mv8 s ILE 94 Ca 0.23 0.31 -0.15 0.00 -1.41 0.00 0.00 60.65 59.63 3mv8 s ILE 94 Cb 0.07 -0.13 -0.04 0.00 0.13 0.00 0.00 42.46 42.48 3mv8 s ILE 94 CO 0.02 0.13 0.35 -0.63 -1.91 0.00 0.00 174.94 172.89 3mv8 s ILE 95 N 1.60 5.25 -0.03 2.00 1.01 0.00 -0.50 121.20 130.53 3mv8 s ILE 95 Ca -0.03 0.62 0.07 0.00 0.00 0.00 0.00 60.65 61.32 3mv8 s ILE 95 Cb -0.12 -3.68 -0.02 0.00 0.01 0.00 0.00 42.46 38.64 3mv8 s ILE 95 CO -0.03 0.32 -0.24 -1.10 0.00 0.00 0.00 174.94 173.89 3mv8 s GLN 96 N 0.92 2.26 -0.03 2.79 -0.21 -0.57 -0.70 119.66 124.11 3mv8 s GLN 96 Ca 0.18 -0.88 -0.02 0.00 0.02 0.00 0.00 55.36 54.66 3mv8 s GLN 96 Cb -0.14 -2.12 0.02 0.00 1.00 0.00 0.00 33.01 31.76 3mv8 s GLN 96 CO 0.06 0.54 0.07 0.50 -2.12 0.00 0.00 175.29 174.34 3mv8 s ARG 97 N -0.56 0.04 -0.03 2.91 3.52 -0.58 -0.21 118.95 124.04 3mv8 s ARG 97 Ca 0.08 0.17 0.02 0.00 -0.13 0.00 0.00 55.73 55.87 3mv8 s ARG 97 Cb -0.11 -0.09 0.01 0.00 -1.56 0.00 0.00 34.95 33.20 3mv8 s ARG 97 CO -0.00 -0.09 -0.06 0.00 -0.81 0.00 0.00 175.30 174.34 3mv8 s MET 98 N 0.56 0.74 0.13 5.12 0.23 -0.14 0.38 119.30 126.32 3mv8 s MET 98 Ca -0.04 -0.19 -0.08 0.00 -1.03 0.00 0.00 55.69 54.34 3mv8 s MET 98 Cb -0.06 -0.72 -0.01 0.00 -1.53 0.00 0.00 34.83 32.51 3mv8 s MET 98 CO -0.02 0.04 0.23 1.52 -2.03 0.00 0.00 175.02 174.76 3mv8 s TYR 99 N 0.36 0.32 -5.00 3.16 -0.85 -0.90 -0.75 117.35 113.70 3mv8 s TYR 99 Ca -0.05 -0.71 0.00 0.00 -0.52 0.00 0.00 57.07 55.79 3mv8 s TYR 99 Cb -0.09 -0.09 0.00 0.00 0.38 0.00 0.00 41.96 42.17 3mv8 s TYR 99 CO 0.00 -0.63 0.00 0.41 -1.52 0.00 0.00 175.55 173.81 3mv8 n GLY 100 N -0.14 -0.38 3.14 5.49 0.00 -0.90 -1.04 105.19 111.37 3mv8 n GLY 100 Ca -0.11 -1.54 -0.23 0.00 0.00 0.00 0.00 46.02 44.15 3mv8 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mv8 s ASP 102 N -0.49 5.46 -0.08 0.00 1.01 -0.05 -1.61 116.67 120.90 3mv8 s ASP 102 Ca 0.06 0.09 0.00 0.00 0.71 0.00 0.00 52.55 53.40 3mv8 s ASP 102 Cb -0.06 -1.84 -0.03 0.00 1.01 0.00 0.00 42.92 42.00 3mv8 s ASP 102 CO -0.00 0.23 -0.07 -0.76 0.21 0.00 0.00 175.17 174.78 3mv8 s LEU 103 N 0.01 3.16 0.00 1.23 1.43 0.31 0.02 118.68 124.84 3mv8 s LEU 103 Ca 0.05 -0.05 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 3mv8 s LEU 103 Cb -0.12 -1.70 0.17 0.00 0.03 0.00 0.00 46.19 44.56 3mv8 s LEU 103 CO 0.01 0.33 0.98 0.61 0.23 0.00 0.00 176.35 178.51 3mv8 n GLY 104 N 2.46 -1.43 0.31 -3.19 0.00 -0.61 -1.27 105.19 101.48 3mv8 n GLY 104 Ca -0.18 -1.70 0.14 0.00 0.00 0.00 0.00 46.02 44.29 3mv8 n GLY 104 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3mv8 h PRO 105 N 0.00 0.00 0.00 1.61 0.11 -1.89 -1.81 132.00 130.02 3mv8 h PRO 105 Ca -0.32 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.71 3mv8 h PRO 105 Cb 0.87 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.97 3mv8 h PRO 105 CO 0.22 0.00 -0.37 0.38 -0.21 0.00 0.00 178.00 178.02 3mv8 h ASP 106 N 0.00 0.00 0.00 -2.05 2.03 -1.93 -3.43 116.42 111.04 3mv8 h ASP 106 Ca 0.08 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.38 3mv8 h ASP 106 Cb 0.35 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.85 3mv8 h ASP 106 CO -0.00 0.37 0.00 0.61 -1.03 0.00 0.00 179.24 179.19 3mv8 n GLY 107 N 0.87 0.50 3.84 7.15 0.00 -0.68 -5.09 105.19 111.78 3mv8 n GLY 107 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 3mv8 n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mv8 s ARG 108 N -0.94 4.07 0.13 1.61 3.00 -1.26 -4.81 118.95 120.74 3mv8 s ARG 108 Ca 0.00 0.69 -0.31 0.00 0.00 0.00 0.00 55.73 56.11 3mv8 s ARG 108 Cb 0.00 -2.65 -0.11 0.00 0.00 0.00 0.00 34.95 32.20 3mv8 s ARG 108 CO 0.00 0.28 1.84 -1.17 0.00 0.00 0.00 175.30 176.25 3mv8 s LEU 109 N -2.53 4.40 -0.19 2.53 2.96 -1.26 -1.57 118.68 123.02 3mv8 s LEU 109 Ca 0.48 2.79 -0.15 0.00 -0.22 0.00 0.00 54.13 57.03 3mv8 s LEU 109 Cb -0.13 -3.57 -0.20 0.00 0.50 0.00 0.00 46.19 42.79 3mv8 s LEU 109 CO 0.19 -1.01 0.17 0.18 -1.32 0.00 0.00 176.35 174.55 3mv8 n LEU 110 N 5.63 2.18 -3.52 -0.68 4.77 0.10 -4.86 117.00 120.62 3mv8 n LEU 110 Ca 0.18 0.31 -0.16 0.00 -0.03 0.00 0.00 56.01 56.31 3mv8 n LEU 110 Cb 0.38 -0.99 -0.05 0.00 -2.33 0.00 0.00 43.42 40.42 3mv8 n LEU 110 CO 0.66 0.53 0.49 0.00 -1.33 0.00 0.00 177.39 177.75 3mv8 s ARG 111 N -2.45 1.00 0.20 3.23 1.70 -1.22 -5.02 118.95 116.39 3mv8 s ARG 111 Ca -0.28 0.17 0.04 0.00 -0.47 0.00 0.00 55.73 55.19 3mv8 s ARG 111 Cb 0.07 0.47 -0.03 0.00 -0.57 0.00 0.00 34.95 34.89 3mv8 s ARG 111 CO 0.64 -0.33 0.28 0.20 -1.08 0.00 0.00 175.30 175.01 3mv8 s GLY 112 N -1.33 1.48 0.04 3.88 0.00 -1.26 -0.88 107.32 109.25 3mv8 s GLY 112 Ca -0.08 -1.18 0.03 0.00 0.00 0.00 0.00 44.72 43.48 3mv8 s GLY 112 CO 0.06 -1.19 -0.09 0.30 0.00 0.00 0.00 173.10 172.19 3mv8 s HIS 113 N -1.88 0.74 -0.25 1.90 0.09 0.33 -4.88 115.29 111.34 3mv8 s HIS 113 Ca 0.34 -0.40 -0.04 0.00 -0.00 0.00 0.00 55.06 54.96 3mv8 s HIS 113 Cb -0.10 -0.44 0.14 0.00 -0.00 0.00 0.00 32.58 32.18 3mv8 s HIS 113 CO 0.28 -0.04 0.46 0.34 -0.00 0.00 0.00 174.74 175.78 3mv8 s ASP 114 N -1.26 -0.39 -0.03 1.40 2.15 -1.26 -2.11 116.67 115.18 3mv8 s ASP 114 Ca -0.06 0.68 0.02 0.00 0.43 0.00 0.00 52.55 53.62 3mv8 s ASP 114 Cb -0.08 1.53 0.01 0.00 -0.30 0.00 0.00 42.92 44.07 3mv8 s ASP 114 CO 0.01 -0.27 -0.07 -1.10 -0.17 0.00 0.00 175.17 173.57 3mv8 s GLN 115 N 2.67 0.78 0.04 4.34 -0.21 0.07 -0.19 119.66 127.18 3mv8 s GLN 115 Ca 0.10 -0.21 0.08 0.00 0.02 0.00 0.00 55.36 55.34 3mv8 s GLN 115 Cb -0.14 -0.76 -0.03 0.00 1.00 0.00 0.00 33.01 33.08 3mv8 s GLN 115 CO -0.17 0.05 -0.22 -1.12 -2.12 0.00 0.00 175.29 171.72 3mv8 s SER 116 N 0.35 2.62 0.13 5.90 0.01 0.69 -0.97 113.70 122.43 3mv8 s SER 116 Ca -0.05 -0.53 0.07 0.00 1.31 0.00 0.00 55.95 56.75 3mv8 s SER 116 Cb -0.09 -0.22 -0.04 0.00 0.21 0.00 0.00 66.02 65.88 3mv8 s SER 116 CO 0.00 0.18 -0.18 0.00 0.41 0.00 0.00 173.24 173.66 3mv8 s ALA 117 N -0.80 1.74 -0.15 1.44 0.00 0.70 -0.56 121.76 124.13 3mv8 s ALA 117 Ca 0.08 -1.32 0.01 0.00 0.00 0.00 0.00 51.96 50.73 3mv8 s ALA 117 Cb -0.09 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.89 3mv8 s ALA 117 CO 0.02 0.23 -0.16 -0.47 0.00 0.00 0.00 175.76 175.38 3mv8 s TYR 118 N -1.75 2.29 -1.46 0.00 5.04 -0.42 -1.51 117.35 119.54 3mv8 s TYR 118 Ca 0.10 -1.28 -0.10 0.00 -2.44 0.00 0.00 57.07 53.35 3mv8 s TYR 118 Cb -0.07 -1.65 0.06 0.00 0.35 0.00 0.00 41.96 40.64 3mv8 s TYR 118 CO 0.05 -0.68 0.90 -0.25 -1.34 0.00 0.00 175.55 174.23 3mv8 n ASP 119 N 4.67 -3.75 0.00 4.32 8.00 0.34 -2.75 116.55 127.38 3mv8 n ASP 119 Ca -0.18 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.53 3mv8 n ASP 119 Cb 0.50 -3.95 0.00 0.00 -0.02 0.00 0.00 41.12 37.65 3mv8 n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mv8 n GLY 120 N -1.68 0.82 3.25 0.44 0.00 -1.26 -5.03 105.19 101.73 3mv8 n GLY 120 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 3mv8 n GLY 120 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3mv8 s LYS 121 N -0.19 2.43 0.03 1.61 2.20 -1.11 -5.06 119.74 119.64 3mv8 s LYS 121 Ca 0.00 -0.86 -0.38 0.00 -0.36 0.00 0.00 55.97 54.37 3mv8 s LYS 121 Cb 0.00 -2.06 -0.19 0.00 -1.51 0.00 0.00 37.83 34.06 3mv8 s LYS 121 CO 0.00 0.36 1.00 -0.25 -0.36 0.00 0.00 175.35 176.10 3mv8 n ASP 122 N 2.98 -0.12 0.04 1.43 8.00 -1.26 -1.30 116.55 126.32 3mv8 n ASP 122 Ca -0.18 1.15 -0.00 0.00 0.71 0.00 0.00 54.79 56.48 3mv8 n ASP 122 Cb 0.52 -0.93 -0.00 0.00 -0.02 0.00 0.00 41.12 40.69 3mv8 n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3mv8 n TYR 123 N 1.32 0.00 -3.87 1.24 9.36 0.28 -4.73 117.16 120.76 3mv8 n TYR 123 Ca 0.20 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.30 3mv8 n TYR 123 Cb 0.11 -0.00 -0.13 0.00 -0.63 0.00 0.00 39.34 38.69 3mv8 n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 3mv8 s ILE 124 N -1.84 0.02 -0.00 2.97 2.07 -1.12 -1.39 121.20 121.91 3mv8 s ILE 124 Ca -0.00 -0.19 0.00 0.00 -1.41 0.00 0.00 60.65 59.05 3mv8 s ILE 124 Cb 0.00 -0.15 0.00 0.00 0.13 0.00 0.00 42.46 42.44 3mv8 s ILE 124 CO 0.00 -0.10 0.00 0.00 -1.91 0.00 0.00 174.94 172.93 3mv8 s ALA 125 N -0.30 0.03 0.08 1.50 0.00 -0.67 -0.22 121.76 122.17 3mv8 s ALA 125 Ca -0.04 0.04 -0.31 0.00 0.00 0.00 0.00 51.96 51.66 3mv8 s ALA 125 Cb -0.02 -0.04 -0.06 0.00 0.00 0.00 0.00 23.12 22.99 3mv8 s ALA 125 CO 0.00 -0.01 1.29 -1.17 0.00 0.00 0.00 175.76 175.87 3mv8 s LEU 126 N 0.17 4.36 0.82 0.00 2.96 0.74 -0.88 118.68 126.85 3mv8 s LEU 126 Ca -0.01 2.14 -0.11 0.00 -0.22 0.00 0.00 54.13 55.93 3mv8 s LEU 126 Cb -0.02 -3.58 0.08 0.00 0.50 0.00 0.00 46.19 43.17 3mv8 s LEU 126 CO -0.00 -0.56 1.09 0.20 -1.32 0.00 0.00 176.35 175.76 3mv8 s ASN 127 N 1.14 4.26 0.38 3.68 0.02 0.34 -4.59 114.94 120.16 3mv8 s ASN 127 Ca 0.61 1.43 0.10 0.00 -1.02 0.00 0.00 52.86 53.98 3mv8 s ASN 127 Cb -0.32 -2.16 0.87 0.00 0.02 0.00 0.00 41.25 39.66 3mv8 s ASN 127 CO 0.29 -2.13 1.93 -0.08 0.02 0.00 0.00 177.10 177.12 3mv8 h GLU 128 N -1.20 0.60 0.00 -0.60 4.81 -1.90 0.22 114.58 116.51 3mv8 h GLU 128 Ca -0.47 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3mv8 h GLU 128 Cb 1.27 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.51 3mv8 h GLU 128 CO 0.57 0.40 0.00 -0.40 -0.73 0.00 0.00 179.01 178.85 3mv8 n ASP 129 N -4.50 0.00 -1.93 1.04 5.68 -1.26 -4.83 116.55 110.75 3mv8 n ASP 129 Ca 0.13 0.06 -0.16 0.00 -0.50 0.00 0.00 54.79 54.32 3mv8 n ASP 129 Cb 0.38 -0.23 -0.04 0.00 -1.14 0.00 0.00 41.12 40.10 3mv8 n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3mv8 n LEU 130 N -1.23 -1.35 0.00 -2.12 4.77 0.07 -4.75 117.00 112.39 3mv8 n LEU 130 Ca 0.05 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 3mv8 n LEU 130 Cb 0.06 -2.43 0.00 0.00 -2.33 0.00 0.00 43.42 38.72 3mv8 n LEU 130 CO 0.07 -0.52 -0.01 -1.54 -1.33 0.00 0.00 177.39 174.06 3mv8 n SER 131 N -1.36 0.06 -4.29 -1.43 3.41 -1.26 -4.51 113.62 104.23 3mv8 n SER 131 Ca -0.18 -0.04 -0.15 0.00 -0.26 0.00 0.00 58.87 58.24 3mv8 n SER 131 Cb 0.59 0.09 -0.10 0.00 -0.26 0.00 0.00 64.21 64.53 3mv8 n SER 131 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3mv8 s SER 132 N -0.11 1.43 0.10 4.04 1.04 -1.26 -4.92 113.70 114.02 3mv8 s SER 132 Ca 0.00 -1.23 0.10 0.00 0.48 0.00 0.00 55.95 55.30 3mv8 s SER 132 Cb 0.00 0.09 -0.04 0.00 0.10 0.00 0.00 66.02 66.17 3mv8 s SER 132 CO 0.00 -0.58 -0.25 0.26 0.98 0.00 0.00 173.24 173.64 3mv8 s TRP 133 N -3.59 2.35 -0.26 5.02 0.52 -1.26 -0.51 118.94 121.21 3mv8 s TRP 133 Ca 0.28 -0.37 -0.02 0.00 0.02 0.00 0.00 56.10 56.01 3mv8 s TRP 133 Cb 0.06 -1.31 0.03 0.00 -1.15 0.00 0.00 33.47 31.10 3mv8 s TRP 133 CO 0.08 0.28 -0.04 0.99 0.02 0.00 0.00 176.95 178.27 3mv8 s THR 134 N -0.99 2.93 -0.15 2.01 2.01 -0.06 -4.89 115.64 116.51 3mv8 s THR 134 Ca 0.14 -1.09 -0.05 0.00 0.31 0.00 0.00 61.69 61.00 3mv8 s THR 134 Cb -0.10 -2.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.84 3mv8 s THR 134 CO 0.05 0.13 0.03 0.00 -0.69 0.00 0.00 174.62 174.14 3mv8 s ALA 135 N 1.32 3.32 0.21 7.40 0.00 -1.26 -1.68 121.76 131.06 3mv8 s ALA 135 Ca -0.01 -0.77 -0.03 0.00 0.00 0.00 0.00 51.96 51.15 3mv8 s ALA 135 Cb -0.17 -1.73 0.18 0.00 0.00 0.00 0.00 23.12 21.40 3mv8 s ALA 135 CO -0.04 0.32 1.59 0.00 0.00 0.00 0.00 175.76 177.64 3mv8 h ALA 136 N 6.19 0.83 -2.36 0.00 0.00 -1.52 -3.47 119.26 118.93 3mv8 h ALA 136 Ca -0.40 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.09 3mv8 h ALA 136 Cb 1.18 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3mv8 h ALA 136 CO 0.64 0.64 0.00 -0.40 0.00 0.00 0.00 179.25 180.13 3mv8 n ASP 137 N -4.06 0.00 0.22 0.00 5.68 -1.26 -5.03 116.55 112.10 3mv8 n ASP 137 Ca -0.01 -1.00 0.08 0.00 -0.50 0.00 0.00 54.79 53.36 3mv8 n ASP 137 Cb 0.49 0.00 0.50 0.00 -1.14 0.00 0.00 41.12 40.97 3mv8 n ASP 137 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3mv8 h THR 138 N 1.00 0.78 -0.06 2.12 1.35 -1.99 -1.38 112.91 114.72 3mv8 h THR 138 Ca 0.00 -1.06 -0.02 0.00 -0.55 0.00 0.00 66.41 64.78 3mv8 h THR 138 Cb 0.00 1.65 -0.00 0.00 -1.73 0.00 0.00 68.15 68.07 3mv8 h THR 138 CO 0.00 0.25 -0.04 0.00 -0.25 0.00 0.00 175.52 175.48 3mv8 h ALA 139 N 1.74 0.09 0.00 6.62 0.00 -1.97 -2.76 119.26 122.99 3mv8 h ALA 139 Ca -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3mv8 h ALA 139 Cb 0.63 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3mv8 h ALA 139 CO 0.03 -0.14 -0.04 0.00 0.00 0.00 0.00 179.25 179.10 3mv8 h ALA 140 N 0.59 1.71 -0.15 0.00 0.00 -1.80 -1.58 119.26 118.03 3mv8 h ALA 140 Ca 0.01 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3mv8 h ALA 140 Cb 0.51 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3mv8 h ALA 140 CO 0.01 0.06 -0.28 1.96 0.00 0.00 0.00 179.25 181.00 3mv8 h GLN 141 N 0.00 0.28 -0.44 0.00 4.20 -1.11 0.87 115.11 118.91 3mv8 h GLN 141 Ca -0.00 -0.10 -0.07 0.00 0.06 0.00 0.00 58.65 58.54 3mv8 h GLN 141 Cb 0.09 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 3mv8 h GLN 141 CO 0.01 0.55 0.02 0.82 -0.67 0.00 0.00 178.83 179.55 3mv8 h ILE 142 N 0.25 1.26 -0.64 2.54 2.04 -1.01 -2.12 117.51 119.83 3mv8 h ILE 142 Ca 0.04 -1.00 -0.01 0.00 1.00 0.00 0.00 64.86 64.89 3mv8 h ILE 142 Cb 0.63 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 3mv8 h ILE 142 CO 0.05 0.34 0.36 0.74 0.00 0.00 0.00 178.15 179.64 3mv8 h THR 143 N 0.61 1.20 -0.67 -0.27 2.02 -1.18 -2.56 112.91 112.06 3mv8 h THR 143 Ca 0.13 -0.48 0.04 0.00 0.77 0.00 0.00 66.41 66.87 3mv8 h THR 143 Cb 0.46 0.36 -0.05 0.00 -1.74 0.00 0.00 68.15 67.18 3mv8 h THR 143 CO 0.02 0.21 0.40 -0.61 0.37 0.00 0.00 175.52 175.91 3mv8 h GLN 144 N 0.87 0.74 -0.34 6.66 4.15 -0.68 -0.88 115.11 125.63 3mv8 h GLN 144 Ca 0.23 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.59 3mv8 h GLN 144 Cb 0.02 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.53 3mv8 h GLN 144 CO -0.04 0.49 0.18 0.00 -1.93 0.00 0.00 178.83 177.53 3mv8 h ARG 145 N 0.76 0.47 -0.59 1.69 -0.00 -1.23 0.23 114.38 115.71 3mv8 h ARG 145 Ca 0.28 -0.06 0.05 0.00 -0.50 0.00 0.00 59.98 59.76 3mv8 h ARG 145 Cb 0.09 -0.09 -0.05 0.00 0.00 0.00 0.00 29.97 29.92 3mv8 h ARG 145 CO -0.14 0.40 0.31 0.87 0.00 0.00 0.00 179.97 181.41 3mv8 h LYS 146 N 0.42 0.57 -0.03 0.04 1.57 -1.15 -0.46 116.57 117.53 3mv8 h LYS 146 Ca 0.12 -0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.71 3mv8 h LYS 146 Cb 0.07 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 3mv8 h LYS 146 CO -0.02 0.38 -0.69 -1.49 -0.57 0.00 0.00 179.45 177.06 3mv8 h TRP 147 N 0.59 0.22 -0.30 -1.35 4.06 -0.82 -1.64 115.95 116.71 3mv8 h TRP 147 Ca 0.27 -0.10 -0.09 0.00 2.06 0.00 0.00 58.89 61.03 3mv8 h TRP 147 Cb 0.17 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.29 3mv8 h TRP 147 CO -0.09 0.80 -0.18 0.93 -3.56 0.00 0.00 178.44 176.33 3mv8 h GLU 148 N 0.11 0.65 -0.49 0.49 5.08 -0.30 -0.74 114.58 119.38 3mv8 h GLU 148 Ca -0.02 -0.30 0.01 0.00 -1.00 0.00 0.00 59.36 58.06 3mv8 h GLU 148 Cb 1.23 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.45 3mv8 h GLU 148 CO 0.10 0.89 0.32 0.00 -1.00 0.00 0.00 179.01 179.33 3mv8 h ALA 149 N 0.74 1.69 -0.45 3.43 0.00 -0.91 -1.94 119.26 121.81 3mv8 h ALA 149 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3mv8 h ALA 149 Cb 0.72 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3mv8 h ALA 149 CO 0.05 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.58 3mv8 n ALA 150 N -2.47 2.43 -3.22 0.00 0.00 -0.63 -4.94 120.51 111.68 3mv8 n ALA 150 Ca 0.05 -0.86 -0.22 0.00 0.00 0.00 0.00 53.44 52.40 3mv8 n ALA 150 Cb 0.08 -0.97 0.01 0.00 0.00 0.00 0.00 19.45 18.57 3mv8 n ALA 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3mv8 n ARG 151 N 0.98 -3.69 -0.16 0.00 1.74 -0.70 -4.87 116.66 109.96 3mv8 n ARG 151 Ca 0.18 0.59 -0.02 0.00 -0.77 0.00 0.00 57.85 57.82 3mv8 n ARG 151 Cb 0.45 -5.33 0.07 0.00 -1.02 0.00 0.00 32.46 26.63 3mv8 n ARG 151 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3mv8 h VAL 152 N -1.01 0.72 -0.53 1.55 2.07 -1.43 -2.59 116.25 115.03 3mv8 h VAL 152 Ca -0.44 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 67.06 3mv8 h VAL 152 Cb 1.30 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 31.47 3mv8 h VAL 152 CO 0.53 0.05 0.20 0.00 0.02 0.00 0.00 177.57 178.36 3mv8 h ALA 153 N 1.39 0.66 -0.67 1.67 0.00 -1.89 0.57 119.26 120.99 3mv8 h ALA 153 Ca 0.25 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 3mv8 h ALA 153 Cb 0.34 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3mv8 h ALA 153 CO -0.33 -0.20 0.20 0.93 0.00 0.00 0.00 179.25 179.86 3mv8 h GLU 154 N 0.38 1.03 -0.01 0.00 3.07 -1.72 0.89 114.58 118.22 3mv8 h GLU 154 Ca 0.26 -0.21 -0.25 0.00 -0.50 0.00 0.00 59.36 58.66 3mv8 h GLU 154 Cb 0.27 -0.15 0.01 0.00 -0.84 0.00 0.00 28.75 28.04 3mv8 h GLU 154 CO -0.25 0.88 -0.98 1.96 -1.40 0.00 0.00 179.01 179.22 3mv8 h GLN 155 N 0.99 0.58 -0.71 2.33 4.20 -1.15 -2.03 115.11 119.33 3mv8 h GLN 155 Ca 0.22 -0.61 -0.07 0.00 0.06 0.00 0.00 58.65 58.25 3mv8 h GLN 155 Cb 0.29 0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.21 3mv8 h GLN 155 CO -0.01 1.22 0.16 -0.07 -0.67 0.00 0.00 178.83 179.47 3mv8 h LEU 156 N 0.34 1.08 -0.45 1.46 3.38 -0.72 -1.70 115.31 118.69 3mv8 h LEU 156 Ca -0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 3mv8 h LEU 156 Cb 1.62 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 42.06 3mv8 h LEU 156 CO 0.18 1.03 0.24 -0.09 0.09 0.00 0.00 178.44 179.90 3mv8 h ARG 157 N 1.07 0.63 -0.79 1.13 2.43 -0.76 0.45 114.38 118.54 3mv8 h ARG 157 Ca 0.22 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3mv8 h ARG 157 Cb 0.38 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.77 3mv8 h ARG 157 CO 0.00 0.50 0.49 0.00 -1.51 0.00 0.00 179.97 179.46 3mv8 h ALA 158 N 1.09 1.01 -0.08 2.80 0.00 -1.22 -1.64 119.26 121.22 3mv8 h ALA 158 Ca 0.16 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3mv8 h ALA 158 Cb 0.06 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 3mv8 h ALA 158 CO -0.02 0.46 0.03 -0.92 0.00 0.00 0.00 179.25 178.80 3mv8 h TYR 159 N 1.08 0.12 -0.42 0.00 3.20 -0.97 -2.58 116.97 117.41 3mv8 h TYR 159 Ca 0.29 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.07 3mv8 h TYR 159 Cb -0.06 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.15 3mv8 h TYR 159 CO -0.01 0.23 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.62 3mv8 h LEU 160 N -0.02 0.67 0.00 2.82 3.38 -0.65 -0.03 115.31 121.47 3mv8 h LEU 160 Ca 0.03 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3mv8 h LEU 160 Cb 0.16 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3mv8 h LEU 160 CO -0.00 0.77 -0.30 -0.33 0.09 0.00 0.00 178.44 178.67 3mv8 h GLU 161 N 0.65 0.00 0.00 1.13 5.08 -1.35 -3.32 114.58 116.77 3mv8 h GLU 161 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3mv8 h GLU 161 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3mv8 h GLU 161 CO 0.02 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.44 3mv8 n GLY 162 N 1.19 0.69 0.34 -3.84 0.00 -0.97 -4.69 105.19 97.91 3mv8 n GLY 162 Ca 0.03 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.10 3mv8 n GLY 162 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3mv8 h LEU 163 N 0.00 -0.90 0.08 0.99 5.85 -1.67 0.20 115.31 119.87 3mv8 h LEU 163 Ca 0.00 0.28 0.02 0.00 0.84 0.00 0.00 57.88 59.02 3mv8 h LEU 163 Cb 0.00 0.59 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 3mv8 h LEU 163 CO 0.00 -0.31 -0.23 0.00 -0.34 0.00 0.00 178.44 177.56 3mv8 h VAL 165 N -0.40 1.23 -0.05 0.00 2.07 -1.12 -1.72 116.25 116.26 3mv8 h VAL 165 Ca 0.04 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.75 3mv8 h VAL 165 Cb 0.44 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 3mv8 h VAL 165 CO -0.15 0.29 0.02 -0.33 0.02 0.00 0.00 177.57 177.42 3mv8 h GLU 166 N 0.64 0.04 -0.17 1.57 5.08 -0.57 -1.79 114.58 119.38 3mv8 h GLU 166 Ca 0.15 -0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.35 3mv8 h GLU 166 Cb 0.31 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 3mv8 h GLU 166 CO -0.00 0.03 -0.54 -1.49 -1.00 0.00 0.00 179.01 176.01 3mv8 h TRP 167 N 0.04 0.61 -0.79 4.33 4.06 -1.23 -2.30 115.95 120.67 3mv8 h TRP 167 Ca 0.02 -0.21 -0.01 0.00 2.06 0.00 0.00 58.89 60.75 3mv8 h TRP 167 Cb 0.01 -0.12 -0.04 0.00 -1.00 0.00 0.00 29.16 28.01 3mv8 h TRP 167 CO -0.09 0.92 0.44 1.25 -3.56 0.00 0.00 178.44 177.40 3mv8 h LEU 168 N 0.38 0.98 -1.11 -4.49 5.85 -1.20 -0.58 115.31 115.13 3mv8 h LEU 168 Ca 0.01 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.57 3mv8 h LEU 168 Cb 1.06 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 3mv8 h LEU 168 CO 0.10 0.78 -0.08 0.03 -0.34 0.00 0.00 178.44 178.93 3mv8 h ARG 169 N 1.09 0.53 0.08 1.25 3.08 -1.21 -1.12 114.38 118.07 3mv8 h ARG 169 Ca 0.28 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 3mv8 h ARG 169 Cb 0.01 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.00 3mv8 h ARG 169 CO -0.05 0.61 -0.04 -0.09 -1.07 0.00 0.00 179.97 179.34 3mv8 h ARG 170 N 0.49 -0.10 -0.88 0.04 2.43 -0.83 -2.36 114.38 113.18 3mv8 h ARG 170 Ca 0.10 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3mv8 h ARG 170 Cb 0.45 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.98 3mv8 h ARG 170 CO 0.02 0.15 0.54 1.88 -1.51 0.00 0.00 179.97 181.05 3mv8 h TYR 171 N -0.35 1.15 -0.65 2.20 0.05 -0.99 0.14 116.97 118.52 3mv8 h TYR 171 Ca -0.01 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.74 3mv8 h TYR 171 Cb 0.30 -0.38 -0.03 0.00 1.01 0.00 0.00 36.73 37.63 3mv8 h TYR 171 CO 0.01 0.76 0.28 -0.07 -1.05 0.00 0.00 178.16 178.09 3mv8 h LEU 172 N 1.21 0.88 -0.07 3.88 3.38 -1.20 0.52 115.31 123.92 3mv8 h LEU 172 Ca 0.32 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 3mv8 h LEU 172 Cb -0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 3mv8 h LEU 172 CO -0.06 0.79 -0.07 -0.08 0.09 0.00 0.00 178.44 179.11 3mv8 h GLU 173 N 0.91 0.17 -0.16 1.13 4.57 -1.04 -0.17 114.58 119.99 3mv8 h GLU 173 Ca 0.22 -0.09 -0.06 0.00 -1.18 0.00 0.00 59.36 58.25 3mv8 h GLU 173 Cb 0.17 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.75 3mv8 h GLU 173 CO -0.02 0.62 -0.15 -0.91 -1.18 0.00 0.00 179.01 177.37 3mv8 h ASN 174 N -0.28 0.25 -0.50 1.04 2.35 -0.62 -2.87 115.58 114.95 3mv8 h ASN 174 Ca 0.01 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3mv8 h ASN 174 Cb 0.60 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.90 3mv8 h ASN 174 CO 0.02 0.43 0.00 0.61 -1.65 0.00 0.00 177.43 176.84 3mv8 n GLY 175 N -0.80 2.95 3.50 2.83 0.00 0.18 -4.87 105.19 108.98 3mv8 n GLY 175 Ca -0.01 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.96 3mv8 n GLY 175 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3mv8 n LYS 176 N 0.73 -0.32 0.00 1.61 2.85 -0.08 -1.46 118.16 121.49 3mv8 n LYS 176 Ca 0.20 -0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.42 3mv8 n LYS 176 Cb 0.71 -2.02 0.00 0.00 -0.65 0.00 0.00 35.03 33.07 3mv8 n LYS 176 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 3mv8 n GLU 177 N -2.48 0.00 -0.05 -1.58 0.00 -1.26 -4.56 120.64 110.72 3mv8 n GLU 177 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 57.16 57.14 3mv8 n GLU 177 Cb 0.53 -0.62 -0.03 0.00 0.00 0.00 0.00 31.44 31.31 3mv8 n GLU 177 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 3mv8 n THR 178 N -1.51 0.60 0.04 6.31 -2.24 -1.04 -4.52 114.28 111.92 3mv8 n THR 178 Ca 0.00 -0.11 -0.16 0.00 -2.27 0.00 0.00 64.05 61.51 3mv8 n THR 178 Cb 0.00 -1.65 -0.06 0.00 -2.10 0.00 0.00 70.33 66.52 3mv8 n THR 178 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3mv8 h LEU 179 N -0.36 0.76 -2.84 3.22 3.38 -1.50 -3.30 115.31 114.67 3mv8 h LEU 179 Ca -0.24 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.16 3mv8 h LEU 179 Cb 1.16 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.68 3mv8 h LEU 179 CO -0.14 1.36 0.00 0.00 0.09 0.00 0.00 178.44 179.75 3mv8 n GLN 180 N -3.84 3.51 -4.27 1.13 6.02 -1.26 -4.83 117.38 113.85 3mv8 n GLN 180 Ca -0.08 -2.57 -0.34 0.00 -0.01 0.00 0.00 57.00 54.00 3mv8 n GLN 180 Cb 0.82 -1.86 -0.15 0.00 1.02 0.00 0.00 30.24 30.07 3mv8 n GLN 180 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 3mv8 s ARG 181 N -1.86 3.19 -0.37 -1.09 1.70 -1.24 -4.75 118.95 114.52 3mv8 s ARG 181 Ca 0.46 -0.74 -0.18 0.00 -0.47 0.00 0.00 55.73 54.79 3mv8 s ARG 181 Cb 0.30 -2.70 0.00 0.00 -0.57 0.00 0.00 34.95 31.99 3mv8 s ARG 181 CO 0.22 -0.10 0.50 0.00 -1.08 0.00 0.00 175.30 174.84 3mv8 s ALA 182 N 1.11 3.45 -0.22 7.88 0.00 -1.26 -4.81 121.76 127.91 3mv8 s ALA 182 Ca 0.00 -1.14 -0.27 0.00 0.00 0.00 0.00 51.96 50.56 3mv8 s ALA 182 Cb -0.14 -3.04 -0.00 0.00 0.00 0.00 0.00 23.12 19.93 3mv8 s ALA 182 CO -0.05 -1.34 0.93 -0.51 0.00 0.00 0.00 175.76 174.79 3mv8 s ASP 183 N 1.80 6.98 0.52 0.00 1.01 -0.22 -4.66 116.67 122.10 3mv8 s ASP 183 Ca 0.18 1.22 -0.19 0.00 0.71 0.00 0.00 52.55 54.47 3mv8 s ASP 183 Cb -0.16 -2.49 -0.07 0.00 1.01 0.00 0.00 42.92 41.22 3mv8 s ASP 183 CO 0.14 -0.56 1.05 -2.16 0.21 0.00 0.00 175.17 173.86 3mv8 s PRO 184 N 2.84 3.62 0.34 8.23 0.04 -1.26 -1.56 135.00 147.24 3mv8 s PRO 184 Ca 0.40 1.35 -0.28 0.00 0.04 0.00 0.00 61.00 62.51 3mv8 s PRO 184 Cb -0.16 -2.07 -0.10 0.00 0.04 0.00 0.00 34.50 32.22 3mv8 s PRO 184 CO 0.08 -0.58 1.29 -1.25 0.04 0.00 0.00 177.00 176.57 3mv8 s PRO 185 N -3.46 4.32 -0.16 0.56 0.04 -1.26 -4.42 135.00 130.61 3mv8 s PRO 185 Ca 0.67 2.16 -0.21 0.00 0.04 0.00 0.00 61.00 63.67 3mv8 s PRO 185 Cb -0.17 -3.02 -0.03 0.00 0.04 0.00 0.00 34.50 31.31 3mv8 s PRO 185 CO 0.25 -0.20 0.60 0.15 0.04 0.00 0.00 177.00 177.84 3mv8 s LYS 186 N -1.85 4.28 -0.01 4.56 1.02 -0.10 -4.85 119.74 122.80 3mv8 s LYS 186 Ca 0.50 0.61 0.06 0.00 0.02 0.00 0.00 55.97 57.16 3mv8 s LYS 186 Cb -0.39 -3.52 -0.01 0.00 -0.52 0.00 0.00 37.83 33.39 3mv8 s LYS 186 CO 0.51 -0.09 -0.18 0.95 -0.92 0.00 0.00 175.35 175.62 3mv8 s THR 187 N 1.41 1.43 0.15 2.17 -4.23 -1.26 -1.20 115.64 114.11 3mv8 s THR 187 Ca 0.29 -0.81 -0.13 0.00 -1.18 0.00 0.00 61.69 59.86 3mv8 s THR 187 Cb -0.16 -1.20 0.02 0.00 1.34 0.00 0.00 72.50 72.50 3mv8 s THR 187 CO 0.12 0.38 0.38 -1.38 -0.54 0.00 0.00 174.62 173.57 3mv8 s HIS 188 N -0.46 0.04 -0.14 3.99 -3.43 -1.17 -5.00 115.29 109.10 3mv8 s HIS 188 Ca 0.07 -0.39 0.00 0.00 -0.80 0.00 0.00 55.06 53.94 3mv8 s HIS 188 Cb -0.07 0.17 -0.01 0.00 -1.43 0.00 0.00 32.58 31.24 3mv8 s HIS 188 CO -0.00 -0.75 -0.14 0.08 -2.00 0.00 0.00 174.74 171.92 3mv8 s VAL 189 N -3.88 2.82 0.24 -5.38 1.01 -1.26 -0.77 120.40 113.18 3mv8 s VAL 189 Ca 0.09 -0.73 0.06 0.00 0.00 0.00 0.00 61.98 61.40 3mv8 s VAL 189 Cb 0.02 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 3mv8 s VAL 189 CO -0.06 0.52 0.29 0.42 0.00 0.00 0.00 175.10 176.27 3mv8 s THR 190 N 0.63 4.95 -0.20 3.92 -4.23 0.02 -4.62 115.64 116.11 3mv8 s THR 190 Ca -0.08 -1.13 -0.01 0.00 -1.18 0.00 0.00 61.69 59.30 3mv8 s THR 190 Cb -0.16 -3.68 0.05 0.00 1.34 0.00 0.00 72.50 70.06 3mv8 s THR 190 CO 0.03 -0.32 -0.03 -2.28 -0.54 0.00 0.00 174.62 171.48 3mv8 s HIS 191 N -2.02 1.73 -0.28 3.99 2.46 -1.26 -1.75 115.29 118.17 3mv8 s HIS 191 Ca 0.34 -1.24 0.03 0.00 0.47 0.00 0.00 55.06 54.66 3mv8 s HIS 191 Cb -0.09 -1.32 0.07 0.00 -0.13 0.00 0.00 32.58 31.12 3mv8 s HIS 191 CO 0.27 -0.66 -0.05 -1.01 -2.47 0.00 0.00 174.74 170.82 3mv8 s HIS 192 N 1.62 3.17 0.72 3.88 3.76 -0.01 -4.95 115.29 123.48 3mv8 s HIS 192 Ca -0.02 -2.38 -0.15 0.00 -0.15 0.00 0.00 55.06 52.36 3mv8 s HIS 192 Cb -0.17 -2.12 0.03 0.00 1.11 0.00 0.00 32.58 31.44 3mv8 s HIS 192 CO -0.07 -0.88 1.21 -2.14 -0.85 0.00 0.00 174.74 172.01 3mv8 s PRO 193 N 1.12 2.21 0.00 8.40 0.02 -1.26 0.10 135.00 145.59 3mv8 s PRO 193 Ca -0.02 1.76 0.00 0.00 0.02 0.00 0.00 61.00 62.76 3mv8 s PRO 193 Cb -0.19 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.48 3mv8 s PRO 193 CO -0.07 -1.78 0.03 1.55 -0.33 0.00 0.00 177.00 176.40 3mv8 n VAL 194 N -2.63 0.00 0.00 3.83 3.14 0.58 -4.81 118.33 118.44 3mv8 n VAL 194 Ca 0.13 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.51 3mv8 n VAL 194 Cb 0.50 1.22 0.00 0.00 -1.06 0.00 0.00 33.84 34.50 3mv8 n VAL 194 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 3mv8 n SER 195 N 0.00 0.00 -4.61 6.55 7.64 0.20 -4.73 113.62 118.67 3mv8 n SER 195 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.45 3mv8 n SER 195 Cb 0.27 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.45 3mv8 n SER 195 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3mv8 s ASP 196 N 0.00 6.75 -0.11 6.43 -0.00 -1.26 -1.64 116.67 126.84 3mv8 s ASP 196 Ca 0.00 0.69 0.00 0.00 -0.00 0.00 0.00 52.55 53.24 3mv8 s ASP 196 Cb 0.00 -2.53 0.00 0.00 -0.00 0.00 0.00 42.92 40.39 3mv8 s ASP 196 CO 0.00 -1.04 0.00 1.41 -0.00 0.00 0.00 175.17 175.54 3mv8 n HIS 197 N 7.27 0.00 0.00 4.23 8.25 -1.26 -4.83 115.22 128.88 3mv8 n HIS 197 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 3mv8 n HIS 197 Cb 0.48 -0.90 0.00 0.00 1.12 0.00 0.00 29.99 30.69 3mv8 n HIS 197 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 3mv8 n GLU 198 N -1.58 0.00 -4.01 -0.41 4.71 -0.65 -4.08 120.64 114.63 3mv8 n GLU 198 Ca -0.01 0.00 -0.08 0.00 -0.01 0.00 0.00 57.16 57.06 3mv8 n GLU 198 Cb 0.21 0.00 -0.10 0.00 -1.01 0.00 0.00 31.44 30.54 3mv8 n GLU 198 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3mv8 s ALA 199 N -1.00 0.22 -0.18 0.62 0.00 -0.56 0.22 121.76 121.08 3mv8 s ALA 199 Ca 0.00 -0.82 -0.10 0.00 0.00 0.00 0.00 51.96 51.04 3mv8 s ALA 199 Cb 0.00 0.22 -0.05 0.00 0.00 0.00 0.00 23.12 23.30 3mv8 s ALA 199 CO 0.00 -0.28 0.17 0.99 0.00 0.00 0.00 175.76 176.64 3mv8 s THR 200 N -2.71 5.39 -0.37 0.00 2.01 0.28 0.49 115.64 120.72 3mv8 s THR 200 Ca -0.04 0.28 -0.07 0.00 0.31 0.00 0.00 61.69 62.17 3mv8 s THR 200 Cb -0.01 -3.50 0.06 0.00 0.01 0.00 0.00 72.50 69.07 3mv8 s THR 200 CO -0.05 0.46 0.17 -0.76 -0.69 0.00 0.00 174.62 173.74 3mv8 s LEU 201 N 0.16 4.72 -0.21 4.42 1.43 -0.12 -0.83 118.68 128.24 3mv8 s LEU 201 Ca 0.11 -1.39 -0.07 0.00 -1.03 0.00 0.00 54.13 51.75 3mv8 s LEU 201 Cb -0.12 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 3mv8 s LEU 201 CO 0.00 -0.43 0.07 -0.60 0.23 0.00 0.00 176.35 175.63 3mv8 s ARG 202 N 1.37 3.84 -0.34 1.70 3.52 -0.72 -2.09 118.95 126.23 3mv8 s ARG 202 Ca 0.01 -0.40 -0.11 0.00 -0.13 0.00 0.00 55.73 55.10 3mv8 s ARG 202 Cb -0.21 -3.27 0.00 0.00 -1.56 0.00 0.00 34.95 29.91 3mv8 s ARG 202 CO 0.01 0.07 0.20 0.00 -0.81 0.00 0.00 175.30 174.77 3mv8 s TRP 204 N 1.62 3.58 -0.07 0.00 0.52 0.05 -1.62 118.94 123.02 3mv8 s TRP 204 Ca 0.04 0.76 -0.02 0.00 0.02 0.00 0.00 56.10 56.91 3mv8 s TRP 204 Cb -0.18 -2.14 0.03 0.00 -1.15 0.00 0.00 33.47 30.03 3mv8 s TRP 204 CO 0.07 0.52 0.02 0.00 0.02 0.00 0.00 176.95 177.59 3mv8 s ALA 205 N -1.40 0.58 0.12 0.98 0.00 0.12 -3.06 121.76 119.10 3mv8 s ALA 205 Ca 0.33 -0.07 0.05 0.00 0.00 0.00 0.00 51.96 52.27 3mv8 s ALA 205 Cb -0.14 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 3mv8 s ALA 205 CO 0.18 -0.52 -0.13 -0.51 0.00 0.00 0.00 175.76 174.79 3mv8 s LEU 206 N 2.02 2.43 -1.53 0.00 1.43 -0.34 -1.32 118.68 121.37 3mv8 s LEU 206 Ca 0.05 -0.84 0.00 0.00 -1.03 0.00 0.00 54.13 52.30 3mv8 s LEU 206 Cb -0.12 -0.48 0.00 0.00 0.03 0.00 0.00 46.19 45.61 3mv8 s LEU 206 CO -0.05 -0.19 0.00 0.61 0.23 0.00 0.00 176.35 176.95 3mv8 n GLY 207 N 0.41 -0.17 3.90 -3.19 0.00 -0.92 -0.92 105.19 104.31 3mv8 n GLY 207 Ca -0.15 -0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 3mv8 n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3mv8 s PHE 208 N -2.85 3.55 -0.01 1.61 -0.12 -1.13 -4.68 117.98 114.34 3mv8 s PHE 208 Ca 0.00 0.37 -0.01 0.00 -0.05 0.00 0.00 56.93 57.24 3mv8 s PHE 208 Cb 0.00 -1.84 0.01 0.00 -0.63 0.00 0.00 43.02 40.56 3mv8 s PHE 208 CO 0.00 0.65 0.03 -0.47 -0.05 0.00 0.00 175.22 175.38 3mv8 s TYR 209 N -1.31 -0.02 0.55 3.49 5.04 -0.60 -0.47 117.35 124.03 3mv8 s TYR 209 Ca 0.27 0.09 -0.09 0.00 -2.44 0.00 0.00 57.07 54.90 3mv8 s TYR 209 Cb -0.13 -0.05 0.13 0.00 0.35 0.00 0.00 41.96 42.26 3mv8 s TYR 209 CO 0.18 -0.03 0.72 -0.35 -1.34 0.00 0.00 175.55 174.73 3mv8 n PRO 210 N 3.35 -0.82 0.04 4.97 -0.04 -1.26 -1.06 135.00 140.18 3mv8 n PRO 210 Ca -0.16 -1.11 -0.03 0.00 -0.04 0.00 0.00 63.50 62.16 3mv8 n PRO 210 Cb 0.57 -0.76 0.21 0.00 -0.04 0.00 0.00 33.50 33.48 3mv8 n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3mv8 h ALA 211 N -1.93 1.11 -2.04 0.55 0.00 -1.95 -3.45 119.26 111.55 3mv8 h ALA 211 Ca -0.24 -0.36 -0.62 0.00 0.00 0.00 0.00 54.91 53.69 3mv8 h ALA 211 Cb 0.65 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.36 3mv8 h ALA 211 CO 0.16 0.56 1.05 -1.91 0.00 0.00 0.00 179.25 179.12 3mv8 n GLU 212 N -4.09 2.13 -3.52 0.00 4.07 -1.26 -4.96 120.64 113.01 3mv8 n GLU 212 Ca -0.01 0.78 -0.15 0.00 -0.06 0.00 0.00 57.16 57.72 3mv8 n GLU 212 Cb 0.43 -2.61 -0.05 0.00 -0.06 0.00 0.00 31.44 29.15 3mv8 n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 3mv8 s ILE 213 N 3.63 0.01 -0.12 6.31 2.07 -1.26 -4.55 121.20 127.29 3mv8 s ILE 213 Ca 0.91 -0.09 0.01 0.00 -1.41 0.00 0.00 60.65 60.08 3mv8 s ILE 213 Cb -0.71 -0.98 0.02 0.00 0.13 0.00 0.00 42.46 40.92 3mv8 s ILE 213 CO 0.50 -0.05 -0.14 -0.89 -1.91 0.00 0.00 174.94 172.45 3mv8 s THR 214 N -2.17 1.46 -0.16 4.00 2.01 -0.59 -4.98 115.64 115.21 3mv8 s THR 214 Ca -0.07 -0.60 0.00 0.00 0.31 0.00 0.00 61.69 61.34 3mv8 s THR 214 Cb -0.01 -1.35 0.03 0.00 0.01 0.00 0.00 72.50 71.18 3mv8 s THR 214 CO 0.01 0.44 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.51 3mv8 s LEU 215 N 1.16 1.83 0.00 4.42 1.43 -1.26 -1.26 118.68 125.00 3mv8 s LEU 215 Ca -0.03 -0.63 0.01 0.00 -1.03 0.00 0.00 54.13 52.45 3mv8 s LEU 215 Cb -0.14 -1.12 -0.01 0.00 0.03 0.00 0.00 46.19 44.95 3mv8 s LEU 215 CO -0.04 -0.11 -0.02 0.42 0.23 0.00 0.00 176.35 176.82 3mv8 s THR 216 N 1.50 0.17 -0.07 5.49 -4.23 -0.87 -4.92 115.64 112.71 3mv8 s THR 216 Ca 0.02 -0.26 -0.15 0.00 -1.18 0.00 0.00 61.69 60.13 3mv8 s THR 216 Cb -0.14 -0.18 -0.05 0.00 1.34 0.00 0.00 72.50 73.46 3mv8 s THR 216 CO -0.09 -0.06 0.37 0.26 -0.54 0.00 0.00 174.62 174.56 3mv8 s TRP 217 N -0.32 3.61 -0.06 3.99 0.52 -1.26 -1.15 118.94 124.27 3mv8 s TRP 217 Ca -0.02 0.83 0.04 0.00 0.02 0.00 0.00 56.10 56.97 3mv8 s TRP 217 Cb -0.03 -2.32 -0.02 0.00 -1.15 0.00 0.00 33.47 29.95 3mv8 s TRP 217 CO -0.00 0.46 -0.18 -0.65 0.02 0.00 0.00 176.95 176.60 3mv8 s GLN 218 N -0.35 2.60 -0.19 4.98 -0.21 0.55 -1.93 119.66 125.12 3mv8 s GLN 218 Ca 0.22 -0.77 -0.01 0.00 0.02 0.00 0.00 55.36 54.82 3mv8 s GLN 218 Cb -0.15 -2.33 0.00 0.00 1.00 0.00 0.00 33.01 31.53 3mv8 s GLN 218 CO 0.10 0.50 -0.12 0.50 -2.12 0.00 0.00 175.29 174.15 3mv8 s ARG 219 N -0.44 3.21 -1.95 2.91 3.52 -0.02 -0.51 118.95 125.67 3mv8 s ARG 219 Ca 0.05 -0.72 0.00 0.00 -0.13 0.00 0.00 55.73 54.93 3mv8 s ARG 219 Cb -0.12 -2.76 0.00 0.00 -1.56 0.00 0.00 34.95 30.51 3mv8 s ARG 219 CO 0.02 -0.14 0.00 -0.25 -0.81 0.00 0.00 175.30 174.11 3mv8 n ASP 220 N 4.54 -5.10 -0.57 -2.12 8.00 -0.55 -2.16 116.55 118.60 3mv8 n ASP 220 Ca -0.19 0.39 0.00 0.00 0.71 0.00 0.00 54.79 55.70 3mv8 n ASP 220 Cb 0.51 -4.49 0.00 0.00 -0.02 0.00 0.00 41.12 37.12 3mv8 n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mv8 n GLY 221 N -0.47 0.75 3.00 0.44 0.00 -1.26 -5.09 105.19 102.57 3mv8 n GLY 221 Ca -0.20 -0.47 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 3mv8 n GLY 221 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3mv8 s GLU 222 N -3.56 0.16 0.02 1.61 2.56 -0.92 -5.09 118.70 113.48 3mv8 s GLU 222 Ca 0.00 0.57 -0.30 0.00 0.00 0.00 0.00 54.97 55.24 3mv8 s GLU 222 Cb 0.00 -0.12 -0.09 0.00 2.00 0.00 0.00 34.13 35.92 3mv8 s GLU 222 CO 0.00 -0.21 1.97 -0.25 -0.56 0.00 0.00 175.26 176.21 3mv8 n ASP 223 N 4.65 4.10 0.10 -1.70 9.92 -1.26 -0.84 116.55 131.51 3mv8 n ASP 223 Ca -0.18 0.91 -0.05 0.00 -0.53 0.00 0.00 54.79 54.93 3mv8 n ASP 223 Cb 0.52 -1.51 -0.02 0.00 -0.64 0.00 0.00 41.12 39.46 3mv8 n ASP 223 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 3mv8 h GLN 224 N 10.50 -0.33 0.00 -1.24 1.08 -1.76 -3.46 115.11 119.89 3mv8 h GLN 224 Ca -0.50 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.72 3mv8 h GLN 224 Cb 1.24 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.75 3mv8 h GLN 224 CO 0.94 -0.22 0.00 2.41 -0.95 0.00 0.00 178.83 181.01 3mv8 n THR 225 N -4.83 0.00 -0.14 -0.54 -1.04 -1.26 -4.32 114.28 102.15 3mv8 n THR 225 Ca -0.04 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.85 3mv8 n THR 225 Cb 0.13 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.63 3mv8 n THR 225 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 3mv8 h GLN 226 N 0.00 0.83 -0.29 -2.82 1.08 -1.99 -3.26 115.11 108.66 3mv8 h GLN 226 Ca 0.00 -0.35 -0.11 0.00 -1.45 0.00 0.00 58.65 56.74 3mv8 h GLN 226 Cb 0.00 -0.03 -0.07 0.00 -0.05 0.00 0.00 27.48 27.33 3mv8 h GLN 226 CO 0.00 0.98 -0.06 -0.40 -0.95 0.00 0.00 178.83 178.40 3mv8 n ASP 227 N -4.25 2.85 -4.61 1.46 5.68 -1.26 -4.95 116.55 111.47 3mv8 n ASP 227 Ca -0.01 -3.51 -0.36 0.00 -0.50 0.00 0.00 54.79 50.41 3mv8 n ASP 227 Cb 0.41 -0.59 -0.10 0.00 -1.14 0.00 0.00 41.12 39.70 3mv8 n ASP 227 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3mv8 s THR 228 N -3.10 4.88 -0.31 2.12 2.01 -1.23 -4.54 115.64 115.46 3mv8 s THR 228 Ca 0.43 0.01 -0.22 0.00 0.31 0.00 0.00 61.69 62.21 3mv8 s THR 228 Cb 0.38 -3.24 -0.00 0.00 0.01 0.00 0.00 72.50 69.64 3mv8 s THR 228 CO 0.02 0.40 0.73 -0.70 -0.69 0.00 0.00 174.62 174.38 3mv8 s GLU 229 N 0.83 3.92 -0.20 4.92 2.12 0.31 -4.94 118.70 125.66 3mv8 s GLU 229 Ca 0.05 0.45 -0.07 0.00 0.36 0.00 0.00 54.97 55.76 3mv8 s GLU 229 Cb -0.13 -3.74 -0.03 0.00 0.26 0.00 0.00 34.13 30.49 3mv8 s GLU 229 CO 0.02 -0.65 0.05 -0.51 -0.54 0.00 0.00 175.26 173.63 3mv8 s LEU 230 N 2.83 3.59 0.25 2.70 2.01 -1.26 -1.44 118.68 127.37 3mv8 s LEU 230 Ca 0.29 -0.05 -0.05 0.00 0.01 0.00 0.00 54.13 54.33 3mv8 s LEU 230 Cb -0.14 -1.92 -0.06 0.00 0.01 0.00 0.00 46.19 44.08 3mv8 s LEU 230 CO 0.13 0.10 0.52 0.54 1.01 0.00 0.00 176.35 178.65 3mv8 s VAL 231 N 0.79 5.04 0.28 -1.59 0.11 -1.08 -5.05 120.40 118.89 3mv8 s VAL 231 Ca 0.03 0.10 -0.29 0.00 -2.93 0.00 0.00 61.98 58.88 3mv8 s VAL 231 Cb -0.14 -3.70 -0.10 0.00 -1.53 0.00 0.00 36.38 30.92 3mv8 s VAL 231 CO 0.02 -0.22 1.26 -0.70 -3.33 0.00 0.00 175.10 172.13 3mv8 s GLU 232 N -3.29 4.44 0.13 1.54 2.12 -1.26 -4.68 118.70 117.71 3mv8 s GLU 232 Ca 0.44 2.07 -0.33 0.00 0.36 0.00 0.00 54.97 57.50 3mv8 s GLU 232 Cb -0.11 -3.14 -0.13 0.00 0.26 0.00 0.00 34.13 31.02 3mv8 s GLU 232 CO 0.28 -0.11 1.69 2.41 -0.54 0.00 0.00 175.26 178.99 3mv8 n THR 233 N 1.43 0.13 -4.34 -1.70 -1.04 -1.26 -4.81 114.28 102.70 3mv8 n THR 233 Ca 0.01 -0.02 -0.22 0.00 -2.04 0.00 0.00 64.05 61.79 3mv8 n THR 233 Cb 0.43 -1.76 -0.13 0.00 -1.82 0.00 0.00 70.33 67.05 3mv8 n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3mv8 s ARG 234 N 1.64 1.03 0.14 -2.82 1.70 0.13 -4.95 118.95 115.83 3mv8 s ARG 234 Ca 0.80 -0.95 -0.29 0.00 -0.47 0.00 0.00 55.73 54.82 3mv8 s ARG 234 Cb -0.61 -1.13 -0.07 0.00 -0.57 0.00 0.00 34.95 32.57 3mv8 s ARG 234 CO 0.38 0.27 0.92 -1.25 -1.08 0.00 0.00 175.30 174.55 3mv8 s PRO 235 N -1.51 4.71 0.47 3.89 0.04 -1.26 0.82 135.00 142.16 3mv8 s PRO 235 Ca 0.03 1.40 0.27 0.00 0.04 0.00 0.00 61.00 62.75 3mv8 s PRO 235 Cb -0.09 -3.34 0.77 0.00 0.04 0.00 0.00 34.50 31.88 3mv8 s PRO 235 CO 0.02 0.32 1.76 0.00 0.04 0.00 0.00 177.00 179.15 3mv8 h ALA 236 N 5.14 1.00 0.00 8.56 0.00 -1.51 -3.46 119.26 129.00 3mv8 h ALA 236 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3mv8 h ALA 236 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3mv8 h ALA 236 CO 0.70 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.36 3mv8 n GLY 237 N 0.67 2.96 1.87 0.00 0.00 -1.26 -4.90 105.19 104.52 3mv8 n GLY 237 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.01 3mv8 n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3mv8 n ASP 238 N 0.00 4.73 0.00 1.61 5.68 -1.26 -4.91 116.55 122.40 3mv8 n ASP 238 Ca 0.00 -3.22 0.00 0.00 -0.50 0.00 0.00 54.79 51.07 3mv8 n ASP 238 Cb 0.00 -0.72 0.00 0.00 -1.14 0.00 0.00 41.12 39.26 3mv8 n ASP 238 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3mv8 n ARG 239 N -0.17 0.00 -2.47 0.11 5.12 -1.26 -5.04 116.66 112.94 3mv8 n ARG 239 Ca 0.38 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 56.06 3mv8 n ARG 239 Cb 1.32 -0.85 0.11 0.00 -1.16 0.00 0.00 32.46 31.88 3mv8 n ARG 239 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 3mv8 s THR 240 N -2.39 2.18 0.19 0.55 -4.23 -1.26 -4.87 115.64 105.80 3mv8 s THR 240 Ca 0.00 -0.49 0.06 0.00 -1.18 0.00 0.00 61.69 60.08 3mv8 s THR 240 Cb 0.00 -2.69 -0.05 0.00 1.34 0.00 0.00 72.50 71.11 3mv8 s THR 240 CO 0.00 0.00 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.61 3mv8 s PHE 241 N -3.22 1.52 0.04 3.99 0.08 0.38 -1.30 117.98 119.48 3mv8 s PHE 241 Ca 0.66 -0.68 0.04 0.00 0.12 0.00 0.00 56.93 57.07 3mv8 s PHE 241 Cb -0.06 -0.75 -0.02 0.00 -0.57 0.00 0.00 43.02 41.61 3mv8 s PHE 241 CO 0.45 0.21 -0.13 -0.65 -0.10 0.00 0.00 175.22 175.00 3mv8 s GLN 242 N -3.71 0.86 -0.18 0.44 -0.21 0.24 -2.16 119.66 114.95 3mv8 s GLN 242 Ca 0.21 -0.75 -0.22 0.00 0.02 0.00 0.00 55.36 54.62 3mv8 s GLN 242 Cb 0.01 -0.85 0.06 0.00 1.00 0.00 0.00 33.01 33.23 3mv8 s GLN 242 CO 0.05 0.21 0.59 0.21 -2.12 0.00 0.00 175.29 174.22 3mv8 s LYS 243 N -1.18 0.77 0.16 2.91 2.20 -0.43 -0.69 119.74 123.47 3mv8 s LYS 243 Ca 0.00 0.65 0.05 0.00 -0.36 0.00 0.00 55.97 56.31 3mv8 s LYS 243 Cb -0.08 0.37 -0.04 0.00 -1.51 0.00 0.00 37.83 36.56 3mv8 s LYS 243 CO 0.01 -0.14 -0.11 1.67 -0.36 0.00 0.00 175.35 176.43 3mv8 s TRP 244 N -0.09 1.34 -0.03 4.03 1.48 -1.26 -0.70 118.94 123.71 3mv8 s TRP 244 Ca -0.03 -0.72 0.01 0.00 -1.06 0.00 0.00 56.10 54.29 3mv8 s TRP 244 Cb -0.04 -0.67 0.02 0.00 -1.16 0.00 0.00 33.47 31.63 3mv8 s TRP 244 CO 0.03 0.13 -0.01 0.00 -4.06 0.00 0.00 176.95 173.04 3mv8 s ALA 245 N -3.24 0.31 0.03 2.67 0.00 -0.64 -2.64 121.76 118.25 3mv8 s ALA 245 Ca 0.17 0.12 0.04 0.00 0.00 0.00 0.00 51.96 52.30 3mv8 s ALA 245 Cb 0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.84 3mv8 s ALA 245 CO 0.02 -0.05 -0.13 0.00 0.00 0.00 0.00 175.76 175.60 3mv8 s ALA 246 N 0.85 1.10 0.12 0.00 0.00 -0.52 -0.02 121.76 123.29 3mv8 s ALA 246 Ca -0.09 -0.77 0.06 0.00 0.00 0.00 0.00 51.96 51.16 3mv8 s ALA 246 Cb -0.12 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 3mv8 s ALA 246 CO -0.01 0.21 -0.15 0.14 0.00 0.00 0.00 175.76 175.95 3mv8 s VAL 247 N -0.79 1.36 -0.17 0.00 -7.23 -0.89 -0.53 120.40 112.15 3mv8 s VAL 247 Ca 0.01 -1.70 -0.14 0.00 -1.81 0.00 0.00 61.98 58.35 3mv8 s VAL 247 Cb -0.07 -1.52 -0.05 0.00 0.56 0.00 0.00 36.38 35.30 3mv8 s VAL 247 CO 0.01 -0.38 0.30 -0.69 -0.31 0.00 0.00 175.10 174.03 3mv8 s VAL 248 N -2.03 5.29 0.09 1.32 1.01 -1.26 -0.95 120.40 123.87 3mv8 s VAL 248 Ca 0.09 0.56 0.08 0.00 0.00 0.00 0.00 61.98 62.71 3mv8 s VAL 248 Cb -0.05 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 3mv8 s VAL 248 CO 0.03 0.36 -0.22 0.68 0.00 0.00 0.00 175.10 175.96 3mv8 s VAL 249 N 0.64 1.79 -1.13 2.92 -7.23 0.18 -4.97 120.40 112.60 3mv8 s VAL 249 Ca 0.16 -1.49 -0.08 0.00 -1.81 0.00 0.00 61.98 58.77 3mv8 s VAL 249 Cb -0.13 -1.61 -0.09 0.00 0.56 0.00 0.00 36.38 35.11 3mv8 s VAL 249 CO 0.05 0.03 2.61 -2.65 -0.31 0.00 0.00 175.10 174.83 3mv8 n PRO 250 N 1.25 2.77 0.00 4.82 -0.02 -1.26 -1.49 135.00 141.08 3mv8 n PRO 250 Ca -0.19 -1.72 0.00 0.00 -2.02 0.00 0.00 63.50 59.58 3mv8 n PRO 250 Cb 0.53 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 3mv8 n PRO 250 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3mv8 n SER 251 N 3.72 0.00 -0.74 2.55 3.41 -1.26 -3.89 113.62 117.41 3mv8 n SER 251 Ca 0.59 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.20 3mv8 n SER 251 Cb 0.25 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 3mv8 n SER 251 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3mv8 n GLY 252 N 0.00 0.02 0.09 5.00 0.00 -1.26 -2.30 105.19 106.74 3mv8 n GLY 252 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 3mv8 n GLY 252 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3mv8 n GLU 253 N 0.73 1.37 -0.11 1.61 1.02 -1.25 -4.78 120.64 119.22 3mv8 n GLU 253 Ca 0.00 -2.56 0.06 0.00 -0.02 0.00 0.00 57.16 54.63 3mv8 n GLU 253 Cb 0.00 -1.50 0.39 0.00 -0.02 0.00 0.00 31.44 30.31 3mv8 n GLU 253 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3mv8 h GLU 254 N 0.05 0.65 0.00 3.49 3.07 -1.80 -2.92 114.58 117.12 3mv8 h GLU 254 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 3mv8 h GLU 254 Cb 1.00 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.77 3mv8 h GLU 254 CO 0.01 0.43 0.00 1.04 -1.40 0.00 0.00 179.01 179.09 3mv8 n GLN 255 N -4.47 0.10 0.00 2.33 1.13 -1.26 -1.72 117.38 113.49 3mv8 n GLN 255 Ca 0.08 0.35 0.13 0.00 -1.94 0.00 0.00 57.00 55.62 3mv8 n GLN 255 Cb 0.17 -1.70 0.40 0.00 0.11 0.00 0.00 30.24 29.22 3mv8 n GLN 255 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 3mv8 n ARG 256 N -1.90 1.28 -3.91 -1.09 1.85 -1.10 -4.86 116.66 106.93 3mv8 n ARG 256 Ca 0.03 -0.79 -0.36 0.00 -1.00 0.00 0.00 57.85 55.73 3mv8 n ARG 256 Cb 0.20 -1.48 -0.08 0.00 -1.05 0.00 0.00 32.46 30.05 3mv8 n ARG 256 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 3mv8 s TYR 257 N -2.27 3.41 0.01 2.89 2.02 -0.70 -1.48 117.35 121.24 3mv8 s TYR 257 Ca 0.30 0.32 0.06 0.00 -0.37 0.00 0.00 57.07 57.39 3mv8 s TYR 257 Cb 0.20 -2.03 -0.02 0.00 -0.40 0.00 0.00 41.96 39.71 3mv8 s TYR 257 CO 0.43 0.43 -0.20 0.95 -1.57 0.00 0.00 175.55 175.60 3mv8 s THR 258 N -0.24 1.55 -0.12 -0.71 -4.23 0.33 -4.71 115.64 107.52 3mv8 s THR 258 Ca 0.10 -0.97 -0.07 0.00 -1.18 0.00 0.00 61.69 59.57 3mv8 s THR 258 Cb -0.12 -1.32 -0.04 0.00 1.34 0.00 0.00 72.50 72.36 3mv8 s THR 258 CO 0.01 0.33 0.14 0.00 -0.54 0.00 0.00 174.62 174.55 3mv8 s HIS 260 N -1.03 1.98 -0.10 0.00 3.76 -0.30 -0.21 115.29 119.39 3mv8 s HIS 260 Ca 0.15 -0.84 0.03 0.00 -0.15 0.00 0.00 55.06 54.25 3mv8 s HIS 260 Cb -0.12 -1.39 0.01 0.00 1.11 0.00 0.00 32.58 32.19 3mv8 s HIS 260 CO 0.04 -0.40 -0.18 0.54 -0.85 0.00 0.00 174.74 173.90 3mv8 s VAL 261 N 0.70 1.63 -0.12 -0.90 0.11 -0.92 -2.05 120.40 118.85 3mv8 s VAL 261 Ca -0.13 -0.75 0.02 0.00 -2.93 0.00 0.00 61.98 58.19 3mv8 s VAL 261 Cb -0.16 -1.46 -0.01 0.00 -1.53 0.00 0.00 36.38 33.22 3mv8 s VAL 261 CO 0.03 0.47 -0.19 -1.10 -3.33 0.00 0.00 175.10 170.98 3mv8 s GLN 262 N 0.72 3.20 -0.05 1.54 -0.21 -0.39 -2.09 119.66 122.38 3mv8 s GLN 262 Ca -0.12 -0.79 -0.26 0.00 0.02 0.00 0.00 55.36 54.21 3mv8 s GLN 262 Cb -0.16 -2.47 0.06 0.00 1.00 0.00 0.00 33.01 31.43 3mv8 s GLN 262 CO 0.02 0.16 0.58 -1.58 -2.12 0.00 0.00 175.29 172.36 3mv8 s HIS 263 N 0.42 -0.54 0.41 0.91 2.46 -1.26 -1.55 115.29 116.15 3mv8 s HIS 263 Ca -0.14 0.94 0.17 0.00 0.47 0.00 0.00 55.06 56.50 3mv8 s HIS 263 Cb -0.17 0.32 1.06 0.00 -0.13 0.00 0.00 32.58 33.66 3mv8 s HIS 263 CO 0.06 -0.54 1.85 1.49 -2.47 0.00 0.00 174.74 175.13 3mv8 h GLU 264 N 3.34 0.42 0.00 2.88 4.81 -1.93 0.90 114.58 125.00 3mv8 h GLU 264 Ca -0.28 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 3mv8 h GLU 264 Cb 1.15 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.44 3mv8 h GLU 264 CO 0.38 0.28 0.00 0.41 -0.73 0.00 0.00 179.01 179.35 3mv8 n GLY 265 N -1.50 -1.19 3.40 1.92 0.00 -1.26 -4.69 105.19 101.87 3mv8 n GLY 265 Ca 0.20 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 3mv8 n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mv8 s LEU 266 N -2.53 3.21 0.54 0.99 1.43 0.31 -4.56 118.68 118.08 3mv8 s LEU 266 Ca 0.28 -0.27 0.28 0.00 -1.03 0.00 0.00 54.13 53.40 3mv8 s LEU 266 Cb 0.19 -1.84 1.54 0.00 0.03 0.00 0.00 46.19 46.11 3mv8 s LEU 266 CO 0.42 -0.01 2.11 1.55 0.23 0.00 0.00 176.35 180.66 3mv8 h PRO 267 N 8.01 0.00 -3.35 1.29 0.13 -1.83 -3.43 132.00 132.83 3mv8 h PRO 267 Ca -0.39 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.66 3mv8 h PRO 267 Cb 1.17 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.15 3mv8 h PRO 267 CO 0.59 0.09 -0.19 -1.59 -0.23 0.00 0.00 178.00 176.67 3mv8 s LYS 268 N -4.27 0.90 0.25 0.86 -2.85 -1.26 -5.14 119.74 108.23 3mv8 s LYS 268 Ca -0.03 -0.60 -0.31 0.00 -1.00 0.00 0.00 55.97 54.03 3mv8 s LYS 268 Cb 0.13 0.39 -0.12 0.00 -2.06 0.00 0.00 37.83 36.17 3mv8 s LYS 268 CO 0.57 -0.31 1.56 -2.30 0.10 0.00 0.00 175.35 174.97 3mv8 n PRO 269 N 0.26 2.45 -3.05 1.78 -0.02 -1.26 -4.92 135.00 130.23 3mv8 n PRO 269 Ca -0.17 0.87 -0.40 0.00 -2.02 0.00 0.00 63.50 61.78 3mv8 n PRO 269 Cb 0.61 -2.63 -0.05 0.00 -0.02 0.00 0.00 33.50 31.41 3mv8 n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3mv8 s LEU 270 N 0.13 4.42 -0.24 2.45 1.43 -0.89 -4.91 118.68 121.07 3mv8 s LEU 270 Ca 0.69 1.34 -0.07 0.00 -1.03 0.00 0.00 54.13 55.06 3mv8 s LEU 270 Cb -0.57 -3.13 -0.03 0.00 0.03 0.00 0.00 46.19 42.49 3mv8 s LEU 270 CO 0.45 0.02 0.07 -0.89 0.23 0.00 0.00 176.35 176.22 3mv8 s THR 271 N 0.04 4.33 0.09 5.49 2.01 -1.26 -2.15 115.64 124.19 3mv8 s THR 271 Ca 0.37 -0.17 0.09 0.00 0.31 0.00 0.00 61.69 62.29 3mv8 s THR 271 Cb -0.20 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 3mv8 s THR 271 CO 0.21 0.35 -0.22 -0.22 -0.69 0.00 0.00 174.62 174.04 3mv8 s LEU 272 N 1.51 2.27 0.25 4.42 2.96 0.70 -4.95 118.68 125.85 3mv8 s LEU 272 Ca 0.06 -0.67 0.01 0.00 -0.22 0.00 0.00 54.13 53.31 3mv8 s LEU 272 Cb -0.15 -0.99 -0.05 0.00 0.50 0.00 0.00 46.19 45.50 3mv8 s LEU 272 CO 0.04 0.11 0.09 -0.13 -1.32 0.00 0.00 176.35 175.14 3mv8 s ARG 273 N -1.78 1.38 -0.06 1.98 0.52 -1.26 -0.24 118.95 119.48 3mv8 s ARG 273 Ca 0.08 -1.74 -0.30 0.00 -0.52 0.00 0.00 55.73 53.26 3mv8 s ARG 273 Cb -0.10 -0.22 -0.03 0.00 0.52 0.00 0.00 34.95 35.12 3mv8 s ARG 273 CO 0.04 -0.29 1.13 -0.46 0.02 0.00 0.00 175.30 175.74 3mv8 s TRP 274 N -3.78 3.33 -0.29 -0.53 -0.00 -1.26 -4.58 118.94 111.82 3mv8 s TRP 274 Ca 0.37 1.36 -0.18 0.00 -0.00 0.00 0.00 56.10 57.66 3mv8 s TRP 274 Cb 0.08 -3.33 -0.02 0.00 -0.00 0.00 0.00 33.47 30.19 3mv8 s TRP 274 CO 0.13 -0.91 0.50 -1.21 -0.00 0.00 0.00 176.95 175.46 3mv8 s GLU 275 N 2.03 3.91 0.00 5.86 8.01 -1.26 -4.99 118.70 132.26 3mv8 s GLU 275 Ca 0.53 0.13 0.32 0.00 0.01 0.00 0.00 54.97 55.96 3mv8 s GLU 275 Cb -0.23 -3.70 1.81 0.00 -4.31 0.00 0.00 34.13 27.70 3mv8 s GLU 275 CO 0.21 -0.44 2.18 -0.35 0.01 0.00 0.00 175.26 176.87