#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pu0 h HIS 0 N 0.00 0.00 -0.02 0.66 -0.00 -2.01 -2.89 115.15 110.90 2pu0 h HIS 0 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 2pu0 h HIS 0 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 2pu0 h HIS 0 CO 0.00 0.10 -0.16 -1.33 -0.00 0.00 0.00 177.93 176.54 2pu0 n MET 1 N -3.47 1.54 -1.94 5.12 0.00 -1.26 -4.43 117.12 112.68 2pu0 n MET 1 Ca -0.01 -1.10 -0.27 0.00 0.00 0.00 0.00 57.70 56.32 2pu0 n MET 1 Cb 0.25 -1.48 0.18 0.00 0.00 0.00 0.00 33.22 32.18 2pu0 n MET 1 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2pu0 n THR 2 N 0.23 0.00 -1.86 2.03 -2.24 -1.09 -4.77 114.28 106.57 2pu0 n THR 2 Ca 0.14 -1.04 -0.42 0.00 -2.27 0.00 0.00 64.05 60.46 2pu0 n THR 2 Cb 0.44 -1.42 -0.03 0.00 -2.10 0.00 0.00 70.33 67.22 2pu0 n THR 2 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2pu0 s ILE 3 N -3.63 2.90 -0.22 2.28 1.01 -0.50 -4.48 121.20 118.56 2pu0 s ILE 3 Ca 0.71 0.36 0.05 0.00 0.00 0.00 0.00 60.65 61.76 2pu0 s ILE 3 Cb -0.02 -3.23 -0.17 0.00 0.01 0.00 0.00 42.46 39.05 2pu0 s ILE 3 CO 0.49 -0.00 -0.15 0.00 0.00 0.00 0.00 174.94 175.28 2pu0 n GLN 4 N 5.65 0.68 -3.75 2.79 6.02 0.51 -0.21 117.38 129.07 2pu0 n GLN 4 Ca 0.16 0.10 -0.13 0.00 -0.01 0.00 0.00 57.00 57.12 2pu0 n GLN 4 Cb 0.40 -1.46 -0.09 0.00 1.02 0.00 0.00 30.24 30.11 2pu0 n GLN 4 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2pu0 s LYS 5 N -2.45 0.65 -0.04 -1.09 2.20 -1.07 -4.87 119.74 113.06 2pu0 s LYS 5 Ca -0.26 -0.10 0.00 0.00 -0.36 0.00 0.00 55.97 55.25 2pu0 s LYS 5 Cb 0.07 0.29 0.02 0.00 -1.51 0.00 0.00 37.83 36.71 2pu0 s LYS 5 CO 0.57 -0.17 -0.02 0.08 -0.36 0.00 0.00 175.35 175.46 2pu0 s VAL 6 N -1.14 0.36 -0.07 4.02 1.01 -1.26 -0.45 120.40 122.88 2pu0 s VAL 6 Ca -0.12 0.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 2pu0 s VAL 6 Cb -0.05 -0.45 0.04 0.00 0.00 0.00 0.00 36.38 35.93 2pu0 s VAL 6 CO 0.04 0.20 0.16 -2.28 0.00 0.00 0.00 175.10 173.22 2pu0 s HIS 7 N 1.20 -0.19 0.16 5.22 5.04 -0.34 -4.83 115.29 121.55 2pu0 s HIS 7 Ca -0.07 0.53 0.04 0.00 -1.54 0.00 0.00 55.06 54.02 2pu0 s HIS 7 Cb -0.14 -0.07 -0.04 0.00 0.04 0.00 0.00 32.58 32.37 2pu0 s HIS 7 CO -0.02 -0.18 0.16 0.20 -2.34 0.00 0.00 174.74 172.57 2pu0 s GLY 8 N 1.23 1.73 0.04 1.59 0.00 -1.26 -0.24 107.32 110.41 2pu0 s GLY 8 Ca -0.09 -1.17 -0.16 0.00 0.00 0.00 0.00 44.72 43.30 2pu0 s GLY 8 CO -0.06 -1.18 0.37 1.09 0.00 0.00 0.00 173.10 173.32 2pu0 s ARG 9 N -3.10 0.87 -0.12 2.90 1.70 -0.22 -4.91 118.95 116.06 2pu0 s ARG 9 Ca 0.32 -0.40 -0.25 0.00 -0.47 0.00 0.00 55.73 54.92 2pu0 s ARG 9 Cb -0.10 0.38 -0.02 0.00 -0.57 0.00 0.00 34.95 34.64 2pu0 s ARG 9 CO 0.24 -0.29 0.82 -2.00 -1.08 0.00 0.00 175.30 172.99 2pu0 s GLU 10 N -2.44 4.36 0.31 3.89 2.12 -1.26 -1.26 118.70 124.42 2pu0 s GLU 10 Ca -0.06 1.03 0.03 0.00 0.36 0.00 0.00 54.97 56.34 2pu0 s GLU 10 Cb -0.01 -3.53 -0.06 0.00 0.26 0.00 0.00 34.13 30.79 2pu0 s GLU 10 CO -0.02 -0.20 0.07 0.14 -0.54 0.00 0.00 175.26 174.71 2pu0 s VAL 11 N 1.68 1.03 0.03 3.70 -7.23 -0.39 -4.95 120.40 114.28 2pu0 s VAL 11 Ca 0.40 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.47 2pu0 s VAL 11 Cb -0.17 -2.76 -0.05 0.00 0.56 0.00 0.00 36.38 33.96 2pu0 s VAL 11 CO 0.16 -0.00 0.35 -0.76 -0.31 0.00 0.00 175.10 174.54 2pu0 s LEU 12 N -3.44 4.39 0.00 1.32 1.43 -1.26 0.64 118.68 121.75 2pu0 s LEU 12 Ca 0.37 0.75 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 2pu0 s LEU 12 Cb 0.09 -2.75 0.14 0.00 0.03 0.00 0.00 46.19 43.69 2pu0 s LEU 12 CO 0.15 0.24 0.94 -0.90 0.23 0.00 0.00 176.35 177.01 2pu0 n ASP 13 N 1.24 1.31 0.00 2.29 5.68 0.73 -4.86 116.55 122.94 2pu0 n ASP 13 Ca -0.11 -2.10 0.10 0.00 -0.50 0.00 0.00 54.79 52.18 2pu0 n ASP 13 Cb 0.53 -0.60 0.50 0.00 -1.14 0.00 0.00 41.12 40.40 2pu0 n ASP 13 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2pu0 n SER 14 N -2.89 0.00 -0.80 -1.12 3.41 0.86 -0.25 113.62 112.83 2pu0 n SER 14 Ca 0.16 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.86 2pu0 n SER 14 Cb 0.56 -0.28 0.11 0.00 -0.26 0.00 0.00 64.21 64.33 2pu0 n SER 14 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2pu0 n ARG 15 N -1.28 1.78 -1.00 4.33 1.74 -1.26 -4.97 116.66 115.99 2pu0 n ARG 15 Ca 0.09 -1.74 0.00 0.00 -0.77 0.00 0.00 57.85 55.43 2pu0 n ARG 15 Cb 0.16 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 2pu0 n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2pu0 n GLY 16 N 1.07 0.48 3.84 -0.13 0.00 0.65 -5.05 105.19 106.05 2pu0 n GLY 16 Ca 0.12 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 2pu0 n GLY 16 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pu0 s ASN 17 N -2.18 6.84 0.55 1.61 0.01 -1.26 -4.76 114.94 115.75 2pu0 s ASN 17 Ca 0.00 1.07 -0.21 0.00 -0.71 0.00 0.00 52.86 53.01 2pu0 s ASN 17 Cb 0.00 -2.28 -0.05 0.00 0.41 0.00 0.00 41.25 39.33 2pu0 s ASN 17 CO 0.00 0.15 1.24 -2.84 -1.51 0.00 0.00 177.10 174.15 2pu0 s PRO 18 N -1.75 3.20 0.13 -0.60 0.02 -1.26 -0.19 135.00 134.55 2pu0 s PRO 18 Ca 0.35 1.94 0.01 0.00 0.02 0.00 0.00 61.00 63.32 2pu0 s PRO 18 Cb -0.16 -2.14 -0.00 0.00 0.02 0.00 0.00 34.50 32.22 2pu0 s PRO 18 CO 0.18 -1.06 0.15 -2.37 -0.33 0.00 0.00 177.00 173.58 2pu0 n THR 19 N -1.17 0.00 -4.45 0.99 5.66 0.21 -4.78 114.28 110.74 2pu0 n THR 19 Ca 0.11 -0.82 -0.34 0.00 -3.05 0.00 0.00 64.05 59.95 2pu0 n THR 19 Cb 0.48 0.45 -0.12 0.00 -1.55 0.00 0.00 70.33 69.60 2pu0 n THR 19 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2pu0 s VAL 20 N -2.56 3.90 0.06 1.08 1.01 -1.26 -1.26 120.40 121.38 2pu0 s VAL 20 Ca 0.13 -0.37 0.07 0.00 0.00 0.00 0.00 61.98 61.81 2pu0 s VAL 20 Cb 0.00 -2.67 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 2pu0 s VAL 20 CO 0.10 0.53 -0.19 -0.70 0.00 0.00 0.00 175.10 174.83 2pu0 s GLU 21 N -0.03 1.19 -0.04 2.72 2.12 -0.39 -1.09 118.70 123.18 2pu0 s GLU 21 Ca 0.01 -0.99 0.03 0.00 0.36 0.00 0.00 54.97 54.38 2pu0 s GLU 21 Cb -0.13 -1.34 0.00 0.00 0.26 0.00 0.00 34.13 32.92 2pu0 s GLU 21 CO 0.03 0.33 -0.13 0.08 -0.54 0.00 0.00 175.26 175.02 2pu0 s VAL 22 N -0.96 1.15 -0.17 3.70 1.01 0.13 -1.06 120.40 124.20 2pu0 s VAL 22 Ca 0.06 -0.54 -0.03 0.00 0.00 0.00 0.00 61.98 61.46 2pu0 s VAL 22 Cb -0.09 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.25 2pu0 s VAL 22 CO 0.03 0.35 -0.05 -1.61 0.00 0.00 0.00 175.10 173.81 2pu0 s GLU 23 N 0.25 3.55 -0.23 2.72 2.02 0.67 -1.19 118.70 126.49 2pu0 s GLU 23 Ca -0.06 -0.57 -0.07 0.00 0.02 0.00 0.00 54.97 54.28 2pu0 s GLU 23 Cb -0.12 -2.91 -0.03 0.00 0.10 0.00 0.00 34.13 31.17 2pu0 s GLU 23 CO 0.02 0.11 0.07 0.08 0.02 0.00 0.00 175.26 175.57 2pu0 s VAL 24 N 0.69 4.50 -0.16 2.63 1.01 0.28 -1.19 120.40 128.14 2pu0 s VAL 24 Ca -0.03 -0.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.77 2pu0 s VAL 24 Cb -0.15 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 2pu0 s VAL 24 CO 0.02 0.37 0.05 -0.89 0.00 0.00 0.00 175.10 174.65 2pu0 s THR 25 N 1.24 4.70 0.41 3.92 2.01 0.41 -0.62 115.64 127.70 2pu0 s THR 25 Ca 0.05 -0.07 0.04 0.00 0.31 0.00 0.00 61.69 62.02 2pu0 s THR 25 Cb -0.14 -3.09 -0.02 0.00 0.01 0.00 0.00 72.50 69.25 2pu0 s THR 25 CO 0.04 0.49 0.14 0.42 -0.69 0.00 0.00 174.62 175.02 2pu0 s THR 26 N 0.12 0.54 0.62 -0.82 -4.23 -0.27 -0.36 115.64 111.24 2pu0 s THR 26 Ca 0.04 -2.00 0.43 0.00 -1.18 0.00 0.00 61.69 58.99 2pu0 s THR 26 Cb -0.12 -2.33 0.43 0.00 1.34 0.00 0.00 72.50 71.82 2pu0 s THR 26 CO 0.01 0.00 2.33 1.05 -0.54 0.00 0.00 174.62 177.47 2pu0 h GLU 27 N 1.78 0.00 -0.00 3.99 4.11 -1.78 -1.37 114.58 121.30 2pu0 h GLU 27 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.09 2pu0 h GLU 27 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2pu0 h GLU 27 CO 0.55 0.00 -0.28 1.63 0.07 0.00 0.00 179.01 180.98 2pu0 n LYS 28 N -3.03 0.41 0.00 1.06 4.76 -1.26 -5.03 118.16 115.06 2pu0 n LYS 28 Ca -0.03 -0.20 0.00 0.00 -2.87 0.00 0.00 58.31 55.21 2pu0 n LYS 28 Cb 0.08 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.77 2pu0 n LYS 28 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2pu0 n GLY 29 N 1.40 0.90 3.42 0.72 0.00 -0.52 -5.06 105.19 106.06 2pu0 n GLY 29 Ca 0.10 -1.93 -0.35 0.00 0.00 0.00 0.00 46.02 43.84 2pu0 n GLY 29 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pu0 s VAL 30 N -2.57 3.81 -0.23 1.61 1.01 -1.26 -1.11 120.40 121.66 2pu0 s VAL 30 Ca 0.00 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.63 2pu0 s VAL 30 Cb 0.00 -2.72 0.04 0.00 0.00 0.00 0.00 36.38 33.70 2pu0 s VAL 30 CO 0.00 0.43 -0.12 -0.36 0.00 0.00 0.00 175.10 175.05 2pu0 s PHE 31 N 1.04 3.04 -0.11 5.22 0.40 0.20 -4.96 117.98 122.82 2pu0 s PHE 31 Ca 0.02 -1.85 0.02 0.00 -0.60 0.00 0.00 56.93 54.52 2pu0 s PHE 31 Cb -0.14 -1.97 -0.01 0.00 0.51 0.00 0.00 43.02 41.40 2pu0 s PHE 31 CO 0.01 -0.81 -0.17 0.50 0.70 0.00 0.00 175.22 175.45 2pu0 s ARG 32 N 1.24 3.16 -0.01 0.44 3.52 -1.26 -0.56 118.95 125.48 2pu0 s ARG 32 Ca -0.01 -0.76 0.01 0.00 -0.13 0.00 0.00 55.73 54.84 2pu0 s ARG 32 Cb -0.17 -2.48 0.00 0.00 -1.56 0.00 0.00 34.95 30.75 2pu0 s ARG 32 CO -0.07 0.25 -0.02 -1.12 -0.81 0.00 0.00 175.30 173.52 2pu0 s SER 33 N 0.23 0.39 0.15 -2.12 0.01 -0.33 -4.94 113.70 107.08 2pu0 s SER 33 Ca -0.11 -0.05 0.10 0.00 1.31 0.00 0.00 55.95 57.20 2pu0 s SER 33 Cb -0.16 -0.09 -0.04 0.00 0.21 0.00 0.00 66.02 65.94 2pu0 s SER 33 CO 0.06 0.01 -0.21 0.00 0.41 0.00 0.00 173.24 173.51 2pu0 s ALA 34 N 0.18 2.59 -0.22 1.44 0.00 -1.26 -0.69 121.76 123.80 2pu0 s ALA 34 Ca -0.02 -1.48 -0.10 0.00 0.00 0.00 0.00 51.96 50.36 2pu0 s ALA 34 Cb -0.04 -0.50 -0.05 0.00 0.00 0.00 0.00 23.12 22.53 2pu0 s ALA 34 CO -0.00 0.52 0.14 0.08 0.00 0.00 0.00 175.76 176.49 2pu0 s VAL 35 N -1.33 5.36 0.92 0.00 1.01 -0.25 -4.93 120.40 121.19 2pu0 s VAL 35 Ca 0.18 0.18 -0.13 0.00 0.00 0.00 0.00 61.98 62.21 2pu0 s VAL 35 Cb -0.09 -3.47 0.20 0.00 0.00 0.00 0.00 36.38 33.01 2pu0 s VAL 35 CO 0.09 0.40 1.27 -2.16 0.00 0.00 0.00 175.10 174.70 2pu0 s PRO 36 N 0.66 0.74 -0.14 2.72 0.04 -1.26 -4.49 135.00 133.27 2pu0 s PRO 36 Ca 0.08 -0.63 -0.07 0.00 0.04 0.00 0.00 61.00 60.42 2pu0 s PRO 36 Cb -0.12 -1.95 0.06 0.00 0.04 0.00 0.00 34.50 32.53 2pu0 s PRO 36 CO 0.01 -2.28 0.33 0.45 0.04 0.00 0.00 177.00 175.54 2pu0 s SER 37 N -4.89 -0.21 0.61 6.66 0.15 -0.07 -4.99 113.70 110.96 2pu0 s SER 37 Ca 0.74 0.73 -0.13 0.00 0.70 0.00 0.00 55.95 57.98 2pu0 s SER 37 Cb -0.03 0.73 -0.04 0.00 -1.71 0.00 0.00 66.02 64.97 2pu0 s SER 37 CO 0.51 -0.20 1.03 -0.83 1.20 0.00 0.00 173.24 174.96 2pu0 s GLY 38 N 1.76 1.84 -0.24 9.45 0.00 -1.26 -0.68 107.32 118.19 2pu0 s GLY 38 Ca -0.06 0.11 -0.12 0.00 0.00 0.00 0.00 44.72 44.65 2pu0 s GLY 38 CO -0.11 0.40 -0.31 0.00 0.00 0.00 0.00 173.10 173.08 2pu0 n ALA 39 N -2.43 1.42 -2.50 3.20 0.00 -1.26 -4.67 120.51 114.27 2pu0 n ALA 39 Ca 0.07 -0.97 -0.43 0.00 0.00 0.00 0.00 53.44 52.11 2pu0 n ALA 39 Cb 0.54 0.18 0.00 0.00 0.00 0.00 0.00 19.45 20.17 2pu0 n ALA 39 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2pu0 n SER 40 N -4.10 5.12 -4.73 0.00 3.41 -1.26 -4.97 113.62 107.10 2pu0 n SER 40 Ca -0.48 -3.07 -0.40 0.00 -0.26 0.00 0.00 58.87 54.66 2pu0 n SER 40 Cb 0.84 -1.50 -0.05 0.00 -0.26 0.00 0.00 64.21 63.24 2pu0 n SER 40 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2pu0 s THR 41 N 0.72 4.91 0.53 6.66 -4.23 -1.26 -4.99 115.64 117.97 2pu0 s THR 41 Ca 0.41 1.61 -0.21 0.00 -1.18 0.00 0.00 61.69 62.31 2pu0 s THR 41 Cb 0.06 -4.11 -0.05 0.00 1.34 0.00 0.00 72.50 69.74 2pu0 s THR 41 CO 0.00 0.28 1.25 -0.83 -0.54 0.00 0.00 174.62 174.78 2pu0 s GLY 42 N 0.53 2.81 0.58 3.99 0.00 -1.26 -4.93 107.32 109.04 2pu0 s GLY 42 Ca 0.40 1.11 0.34 0.00 0.00 0.00 0.00 44.72 46.57 2pu0 s GLY 42 CO 0.21 1.57 2.18 -0.39 0.00 0.00 0.00 173.10 176.67 2pu0 h VAL 43 N 1.46 0.28 -0.32 1.40 -1.51 -1.96 -2.62 116.25 112.98 2pu0 h VAL 43 Ca -0.50 -0.30 0.00 0.00 -1.23 0.00 0.00 66.70 64.67 2pu0 h VAL 43 Cb 1.28 1.23 0.00 0.00 -2.13 0.00 0.00 31.29 31.67 2pu0 h VAL 43 CO 0.58 0.04 0.00 -1.22 -1.23 0.00 0.00 177.57 175.74 2pu0 n TYR 44 N -3.39 0.41 -2.11 5.19 4.02 -1.26 -4.97 117.16 115.06 2pu0 n TYR 44 Ca -0.02 -0.20 -0.37 0.00 -0.01 0.00 0.00 57.90 57.30 2pu0 n TYR 44 Cb 0.18 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.51 2pu0 n TYR 44 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2pu0 s GLU 45 N -1.59 3.45 0.72 -0.72 2.02 -0.99 -4.97 118.70 116.62 2pu0 s GLU 45 Ca 0.36 1.87 -0.16 0.00 0.02 0.00 0.00 54.97 57.07 2pu0 s GLU 45 Cb 0.21 -2.25 0.01 0.00 0.10 0.00 0.00 34.13 32.19 2pu0 s GLU 45 CO 0.29 -0.83 0.98 0.00 0.02 0.00 0.00 175.26 175.72 2pu0 n ALA 46 N -0.87 -0.19 -1.90 5.21 0.00 -0.45 -4.86 120.51 117.45 2pu0 n ALA 46 Ca 0.09 -0.18 -0.42 0.00 0.00 0.00 0.00 53.44 52.93 2pu0 n ALA 46 Cb 0.48 -2.13 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 2pu0 n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pu0 s GLU 48 N 4.35 3.38 -0.31 0.00 2.12 -1.26 -0.76 118.70 126.21 2pu0 s GLU 48 Ca 0.79 -0.17 -0.24 0.00 0.36 0.00 0.00 54.97 55.71 2pu0 s GLU 48 Cb -0.35 -3.94 0.00 0.00 0.26 0.00 0.00 34.13 30.10 2pu0 s GLU 48 CO 0.33 -1.08 0.84 -1.17 -0.54 0.00 0.00 175.26 173.63 2pu0 s LEU 49 N 3.16 4.07 0.29 2.70 2.96 -1.26 -5.02 118.68 125.57 2pu0 s LEU 49 Ca 0.28 0.70 0.11 0.00 -0.22 0.00 0.00 54.13 55.01 2pu0 s LEU 49 Cb -0.13 -3.15 -0.05 0.00 0.50 0.00 0.00 46.19 43.36 2pu0 s LEU 49 CO 0.22 -0.67 -0.17 -0.13 -1.32 0.00 0.00 176.35 174.28 2pu0 s ARG 50 N 3.08 1.76 0.14 1.98 0.52 -1.26 -4.60 118.95 120.57 2pu0 s ARG 50 Ca 0.34 -1.76 0.01 0.00 -0.52 0.00 0.00 55.73 53.80 2pu0 s ARG 50 Cb -0.14 -1.80 -0.08 0.00 0.52 0.00 0.00 34.95 33.45 2pu0 s ARG 50 CO 0.13 0.31 1.32 -0.44 0.02 0.00 0.00 175.30 176.64 2pu0 h ASP 51 N 2.20 0.30 -2.31 0.23 3.32 -1.30 -3.48 116.42 115.38 2pu0 h ASP 51 Ca -0.41 -0.26 -0.33 0.00 0.02 0.00 0.00 57.03 56.05 2pu0 h ASP 51 Cb 1.26 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 2pu0 h ASP 51 CO 0.61 1.09 -0.42 0.61 -1.72 0.00 0.00 179.24 179.42 2pu0 n GLY 52 N 1.02 -0.24 3.47 2.75 0.00 -0.30 -4.99 105.19 106.91 2pu0 n GLY 52 Ca -0.05 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 2pu0 n GLY 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2pu0 s ASP 53 N -2.27 6.26 0.63 1.61 2.15 -1.26 -4.76 116.67 119.03 2pu0 s ASP 53 Ca 0.00 -0.73 0.33 0.00 0.43 0.00 0.00 52.55 52.59 2pu0 s ASP 53 Cb 0.00 -2.31 1.85 0.00 -0.30 0.00 0.00 42.92 42.16 2pu0 s ASP 53 CO 0.00 -0.90 2.11 0.11 -0.17 0.00 0.00 175.17 176.32 2pu0 h LYS 54 N 9.01 0.00 -0.00 4.34 1.57 -1.91 0.17 116.57 129.75 2pu0 h LYS 54 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 2pu0 h LYS 54 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 2pu0 h LYS 54 CO 0.96 0.00 -0.07 1.63 -0.57 0.00 0.00 179.45 181.40 2pu0 n LYS 55 N -3.34 0.37 -3.99 3.15 5.02 -1.26 -3.89 118.16 114.23 2pu0 n LYS 55 Ca -0.00 -0.06 -0.28 0.00 -2.02 0.00 0.00 58.31 55.94 2pu0 n LYS 55 Cb 0.29 -1.50 -0.17 0.00 -0.02 0.00 0.00 35.03 33.63 2pu0 n LYS 55 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2pu0 s ARG 56 N -2.67 1.90 -1.64 1.97 0.52 -0.41 -4.85 118.95 113.77 2pu0 s ARG 56 Ca 0.24 -0.40 -0.17 0.00 -0.52 0.00 0.00 55.73 54.88 2pu0 s ARG 56 Cb 0.20 -1.83 0.13 0.00 0.52 0.00 0.00 34.95 33.97 2pu0 s ARG 56 CO 0.50 -0.24 0.86 0.66 0.02 0.00 0.00 175.30 177.10 2pu0 n TYR 57 N 4.82 -1.96 -3.99 -0.53 4.01 -1.26 -1.10 117.16 117.16 2pu0 n TYR 57 Ca -0.15 0.83 -0.27 0.00 -0.16 0.00 0.00 57.90 58.16 2pu0 n TYR 57 Cb 0.50 -3.32 -0.07 0.00 -0.31 0.00 0.00 39.34 36.14 2pu0 n TYR 57 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2pu0 n VAL 58 N -4.49 -0.96 -0.79 -0.72 0.31 -1.25 -1.39 118.33 109.04 2pu0 n VAL 58 Ca 0.07 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2pu0 n VAL 58 Cb 0.50 -0.92 0.00 0.00 -0.91 0.00 0.00 33.84 32.51 2pu0 n VAL 58 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2pu0 n GLY 59 N -2.25 0.80 1.21 2.92 0.00 -0.08 -4.79 105.19 102.99 2pu0 n GLY 59 Ca -0.25 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.87 2pu0 n GLY 59 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2pu0 n LYS 60 N -2.26 2.62 -1.37 1.61 5.02 -0.49 -1.15 118.16 122.14 2pu0 n LYS 60 Ca 0.00 -2.31 -0.36 0.00 -2.02 0.00 0.00 58.31 53.62 2pu0 n LYS 60 Cb 0.00 -1.55 0.07 0.00 -0.02 0.00 0.00 35.03 33.53 2pu0 n LYS 60 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2pu0 n GLY 61 N 1.42 -0.92 0.69 0.72 0.00 -1.26 -4.43 105.19 101.42 2pu0 n GLY 61 Ca 0.21 -0.31 0.04 0.00 0.00 0.00 0.00 46.02 45.96 2pu0 n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pu0 h LEU 63 N 0.92 1.11 -0.36 0.00 3.38 -1.92 -0.94 115.31 117.49 2pu0 h LEU 63 Ca 0.05 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2pu0 h LEU 63 Cb 1.17 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 2pu0 h LEU 63 CO 0.10 0.82 0.08 -0.61 0.09 0.00 0.00 178.44 178.92 2pu0 h GLN 64 N 1.30 0.59 -0.72 1.13 5.75 -1.92 0.20 115.11 121.44 2pu0 h GLN 64 Ca 0.35 -0.15 -0.03 0.00 -0.15 0.00 0.00 58.65 58.67 2pu0 h GLN 64 Cb -0.12 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.33 2pu0 h GLN 64 CO -0.07 0.64 0.34 0.00 -2.65 0.00 0.00 178.83 177.08 2pu0 h ALA 65 N 0.93 0.93 -0.49 3.38 0.00 -1.75 0.22 119.26 122.47 2pu0 h ALA 65 Ca 0.11 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2pu0 h ALA 65 Cb 0.32 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2pu0 h ALA 65 CO 0.00 0.51 0.31 0.28 0.00 0.00 0.00 179.25 180.35 2pu0 h VAL 66 N 1.01 1.14 -0.73 0.00 2.07 -0.99 -1.30 116.25 117.45 2pu0 h VAL 66 Ca 0.25 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.51 2pu0 h VAL 66 Cb 0.14 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 2pu0 h VAL 66 CO -0.03 0.14 0.47 0.50 0.02 0.00 0.00 177.57 178.67 2pu0 h LYS 67 N 0.66 0.90 -0.86 1.57 3.64 -0.06 0.39 116.57 122.81 2pu0 h LYS 67 Ca 0.18 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2pu0 h LYS 67 Cb -0.05 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 31.53 2pu0 h LYS 67 CO -0.04 0.59 0.54 -0.91 -2.27 0.00 0.00 179.45 177.37 2pu0 h ASN 68 N 0.92 1.01 0.62 4.20 2.35 -0.45 0.47 115.58 124.71 2pu0 h ASN 68 Ca 0.29 -0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.96 2pu0 h ASN 68 Cb -0.02 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.10 2pu0 h ASN 68 CO -0.10 0.76 -0.31 0.58 -1.65 0.00 0.00 177.43 176.71 2pu0 h VAL 69 N 1.17 0.36 -0.35 2.81 2.07 -0.81 0.07 116.25 121.57 2pu0 h VAL 69 Ca 0.31 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.76 2pu0 h VAL 69 Cb -0.08 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 2pu0 h VAL 69 CO -0.06 0.00 -0.09 0.78 0.02 0.00 0.00 177.57 178.22 2pu0 h ASN 70 N -0.85 0.56 0.00 0.57 -0.26 -0.39 0.39 115.58 115.59 2pu0 h ASN 70 Ca -0.08 -0.14 0.00 0.00 -0.56 0.00 0.00 56.30 55.52 2pu0 h ASN 70 Cb 0.67 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.78 2pu0 h ASN 70 CO 0.12 0.69 -1.12 -0.62 -1.06 0.00 0.00 177.43 175.44 2pu0 n GLU 71 N -4.21 1.56 0.06 0.81 1.02 0.16 -4.45 120.64 115.59 2pu0 n GLU 71 Ca 0.01 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 2pu0 n GLU 71 Cb 0.31 -1.19 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 2pu0 n GLU 71 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2pu0 n VAL 72 N -1.64 1.09 -0.04 2.62 0.31 -0.50 -4.72 118.33 115.45 2pu0 n VAL 72 Ca -0.00 0.36 -0.14 0.00 -0.01 0.00 0.00 64.34 64.54 2pu0 n VAL 72 Cb 0.26 -1.48 -0.12 0.00 -0.91 0.00 0.00 33.84 31.60 2pu0 n VAL 72 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2pu0 h ILE 73 N 0.00 1.59 -0.18 2.52 2.04 -1.04 -3.25 117.51 119.19 2pu0 h ILE 73 Ca 0.00 -1.87 0.05 0.00 1.00 0.00 0.00 64.86 64.03 2pu0 h ILE 73 Cb 0.03 2.82 -0.07 0.00 -0.74 0.00 0.00 36.82 38.85 2pu0 h ILE 73 CO 0.00 0.50 -0.41 1.23 0.00 0.00 0.00 178.15 179.47 2pu0 h GLY 74 N -0.65 -0.63 1.51 5.37 0.00 -0.43 -2.12 103.07 106.11 2pu0 h GLY 74 Ca -0.01 0.50 0.06 0.00 0.00 0.00 0.00 47.33 47.88 2pu0 h GLY 74 CO 0.02 -0.22 0.20 -2.55 0.00 0.00 0.00 176.54 173.99 2pu0 h PRO 75 N -0.45 0.11 -0.01 4.80 0.11 -1.78 -0.55 132.00 134.24 2pu0 h PRO 75 Ca 0.09 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 66.11 2pu0 h PRO 75 Cb 0.61 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.68 2pu0 h PRO 75 CO -0.42 0.07 -0.40 0.00 -0.21 0.00 0.00 178.00 177.04 2pu0 h ALA 76 N 1.85 1.32 0.00 -0.75 0.00 -1.42 -3.24 119.26 117.02 2pu0 h ALA 76 Ca 0.13 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 2pu0 h ALA 76 Cb 0.37 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2pu0 h ALA 76 CO -0.01 0.51 -0.73 -0.07 0.00 0.00 0.00 179.25 178.94 2pu0 h LEU 77 N 0.02 0.00 -9.59 0.00 3.38 -0.69 -3.46 115.31 104.96 2pu0 h LEU 77 Ca -0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 2pu0 h LEU 77 Cb 0.71 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.52 2pu0 h LEU 77 CO 0.05 0.16 0.98 -0.38 0.09 0.00 0.00 178.44 179.34 2pu0 n ILE 78 N -2.90 0.06 -0.71 1.22 2.08 -0.96 -1.12 119.36 117.04 2pu0 n ILE 78 Ca -0.00 -0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.30 2pu0 n ILE 78 Cb 0.62 -1.90 0.00 0.00 -0.75 0.00 0.00 39.64 37.60 2pu0 n ILE 78 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2pu0 n GLY 79 N 3.89 0.80 3.92 7.39 0.00 0.71 -4.97 105.19 116.93 2pu0 n GLY 79 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 2pu0 n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2pu0 s ARG 80 N -0.29 3.56 -0.54 1.61 1.81 -0.27 -4.70 118.95 120.13 2pu0 s ARG 80 Ca 0.00 -0.16 -0.28 0.00 -1.72 0.00 0.00 55.73 53.57 2pu0 s ARG 80 Cb 0.00 -2.68 0.03 0.00 -0.45 0.00 0.00 34.95 31.85 2pu0 s ARG 80 CO 0.00 0.22 1.19 0.34 -0.68 0.00 0.00 175.30 176.37 2pu0 s ASP 81 N -3.44 6.49 0.60 0.23 2.15 -1.26 -1.40 116.67 120.04 2pu0 s ASP 81 Ca 0.42 0.24 0.40 0.00 0.43 0.00 0.00 52.55 54.03 2pu0 s ASP 81 Cb -0.10 -2.55 2.03 0.00 -0.30 0.00 0.00 42.92 41.99 2pu0 s ASP 81 CO 0.32 -1.42 2.20 1.05 -0.17 0.00 0.00 175.17 177.15 2pu0 h GLU 82 N 9.51 0.00 0.00 4.34 9.09 -1.92 -2.33 114.58 133.27 2pu0 h GLU 82 Ca -0.24 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.15 2pu0 h GLU 82 Cb 1.06 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.16 2pu0 h GLU 82 CO 1.17 0.00 -0.09 -0.07 0.05 0.00 0.00 179.01 180.07 2pu0 h LEU 83 N 0.00 0.00 -6.08 3.06 3.38 -1.91 -3.37 115.31 110.40 2pu0 h LEU 83 Ca 0.00 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 57.24 2pu0 h LEU 83 Cb 0.14 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.80 2pu0 h LEU 83 CO 0.00 0.09 2.65 0.29 0.09 0.00 0.00 178.44 181.55 2pu0 n LYS 84 N -3.39 3.41 0.18 1.13 4.76 -0.88 -4.81 118.16 118.56 2pu0 n LYS 84 Ca -0.01 -3.05 -0.14 0.00 -2.87 0.00 0.00 58.31 52.24 2pu0 n LYS 84 Cb 0.25 -3.03 -0.07 0.00 -1.84 0.00 0.00 35.03 30.34 2pu0 n LYS 84 CO 0.00 0.00 0.00 0.37 -1.37 0.00 0.00 177.40 176.40 2pu0 h GLN 85 N 5.68 -0.41 -0.41 1.97 5.75 -1.86 -0.66 115.11 125.17 2pu0 h GLN 85 Ca 0.53 0.03 0.02 0.00 -0.15 0.00 0.00 58.65 59.08 2pu0 h GLN 85 Cb 0.58 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.19 2pu0 h GLN 85 CO 1.73 -0.27 0.24 1.49 -2.65 0.00 0.00 178.83 179.37 2pu0 h GLU 86 N -0.43 0.47 -0.25 1.69 4.81 -1.96 -0.50 114.58 118.42 2pu0 h GLU 86 Ca -0.03 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.22 2pu0 h GLU 86 Cb 0.36 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.59 2pu0 h GLU 86 CO 0.02 0.31 -0.03 1.49 -0.73 0.00 0.00 179.01 180.08 2pu0 h GLU 87 N 0.49 0.04 -0.26 1.92 4.81 -1.93 0.24 114.58 119.89 2pu0 h GLU 87 Ca 0.16 -0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.21 2pu0 h GLU 87 Cb 0.01 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 2pu0 h GLU 87 CO -0.08 0.03 -0.56 -0.07 -0.73 0.00 0.00 179.01 177.60 2pu0 h LEU 88 N 0.04 0.90 -0.53 1.64 3.38 -0.92 0.26 115.31 120.08 2pu0 h LEU 88 Ca 0.12 -0.49 0.01 0.00 0.09 0.00 0.00 57.88 57.60 2pu0 h LEU 88 Cb 0.17 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2pu0 h LEU 88 CO -0.22 1.28 0.35 0.44 0.09 0.00 0.00 178.44 180.37 2pu0 h ASP 89 N 0.62 0.61 -0.63 -0.43 3.32 -1.07 -1.36 116.42 117.48 2pu0 h ASP 89 Ca 0.01 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 2pu0 h ASP 89 Cb 1.16 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.53 2pu0 h ASP 89 CO 0.12 0.44 0.15 0.74 -1.72 0.00 0.00 179.24 178.97 2pu0 h THR 90 N 0.72 1.25 -0.45 0.35 2.02 -0.80 -0.84 112.91 115.17 2pu0 h THR 90 Ca 0.19 -0.94 0.04 0.00 0.77 0.00 0.00 66.41 66.47 2pu0 h THR 90 Cb -0.08 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 66.88 2pu0 h THR 90 CO -0.04 0.36 0.21 0.25 0.37 0.00 0.00 175.52 176.67 2pu0 h LEU 91 N 0.99 0.29 -0.60 2.58 5.85 -0.68 -1.12 115.31 122.62 2pu0 h LEU 91 Ca 0.21 0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.85 2pu0 h LEU 91 Cb 0.36 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2pu0 h LEU 91 CO 0.00 0.21 -0.06 0.24 -0.34 0.00 0.00 178.44 178.49 2pu0 h MET 92 N 0.42 1.05 -0.46 1.25 2.86 -0.79 0.16 114.93 119.43 2pu0 h MET 92 Ca 0.20 -0.36 0.08 0.00 -2.06 0.00 0.00 59.70 57.56 2pu0 h MET 92 Cb 0.12 -0.08 -0.07 0.00 0.06 0.00 0.00 31.60 31.63 2pu0 h MET 92 CO -0.15 1.06 0.05 -0.07 1.06 0.00 0.00 176.91 178.86 2pu0 h LEU 93 N 0.94 -0.09 -0.71 1.22 3.38 -0.87 -1.46 115.31 117.73 2pu0 h LEU 93 Ca 0.16 0.09 -0.13 0.00 0.09 0.00 0.00 57.88 58.09 2pu0 h LEU 93 Cb 0.62 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2pu0 h LEU 93 CO 0.04 -0.01 -0.44 0.03 0.09 0.00 0.00 178.44 178.15 2pu0 h ARG 94 N 0.17 0.47 -0.95 1.13 3.08 -0.66 0.15 114.38 117.77 2pu0 h ARG 94 Ca 0.23 -0.25 0.01 0.00 0.07 0.00 0.00 59.98 60.04 2pu0 h ARG 94 Cb 0.32 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.33 2pu0 h ARG 94 CO -0.34 0.82 0.62 -0.07 -1.07 0.00 0.00 179.97 179.93 2pu0 h LEU 95 N 0.38 1.09 -0.00 3.04 3.38 -0.32 -3.03 115.31 119.86 2pu0 h LEU 95 Ca 0.03 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2pu0 h LEU 95 Cb 0.93 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2pu0 h LEU 95 CO 0.08 0.80 -0.00 -0.78 0.09 0.00 0.00 178.44 178.63 2pu0 h ASP 96 N 1.29 0.00 0.00 -0.43 1.82 -1.01 -3.48 116.42 114.61 2pu0 h ASP 96 Ca 0.35 -0.70 0.00 0.00 -0.39 0.00 0.00 57.03 56.29 2pu0 h ASP 96 Cb -0.13 -0.00 0.00 0.00 0.68 0.00 0.00 39.33 39.88 2pu0 h ASP 96 CO -0.07 0.70 0.00 0.61 -1.61 0.00 0.00 179.24 178.87 2pu0 n GLY 97 N 0.80 0.56 3.39 -0.78 0.00 0.49 -4.68 105.19 104.96 2pu0 n GLY 97 Ca -0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 2pu0 n GLY 97 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pu0 s THR 98 N -2.37 2.21 0.42 2.61 -4.23 -1.26 -5.05 115.64 107.97 2pu0 s THR 98 Ca 0.00 -1.88 0.17 0.00 -1.18 0.00 0.00 61.69 58.79 2pu0 s THR 98 Cb 0.00 -2.00 0.18 0.00 1.34 0.00 0.00 72.50 72.02 2pu0 s THR 98 CO 0.00 -0.06 1.97 -0.65 -0.54 0.00 0.00 174.62 175.34 2pu0 h PRO 99 N 3.52 0.00 -0.55 3.99 0.11 -1.96 -3.14 132.00 133.97 2pu0 h PRO 99 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2pu0 h PRO 99 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2pu0 h PRO 99 CO 0.44 0.22 0.00 0.27 -0.21 0.00 0.00 178.00 178.72 2pu0 n ASN 100 N -4.12 4.13 -3.24 -2.05 6.94 -1.26 -4.96 115.26 110.69 2pu0 n ASN 100 Ca -0.02 -2.34 -0.23 0.00 -0.02 0.00 0.00 54.58 51.97 2pu0 n ASN 100 Cb 0.28 -0.48 0.01 0.00 -2.36 0.00 0.00 39.78 37.23 2pu0 n ASN 100 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2pu0 n LYS 101 N 0.90 -4.02 0.00 -3.83 5.02 -1.19 -0.89 118.16 114.15 2pu0 n LYS 101 Ca 0.22 0.64 0.14 0.00 -2.02 0.00 0.00 58.31 57.29 2pu0 n LYS 101 Cb 0.74 -5.41 0.57 0.00 -0.02 0.00 0.00 35.03 30.91 2pu0 n LYS 101 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2pu0 n GLY 102 N -1.32 -1.41 0.07 0.72 0.00 -1.26 -1.13 105.19 100.85 2pu0 n GLY 102 Ca -0.05 -0.15 -0.06 0.00 0.00 0.00 0.00 46.02 45.76 2pu0 n GLY 102 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2pu0 h LYS 103 N 0.03 0.00 0.00 1.61 3.64 -1.90 -3.41 116.57 116.54 2pu0 h LYS 103 Ca 0.00 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.18 2pu0 h LYS 103 Cb 0.47 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.26 2pu0 h LYS 103 CO 0.00 0.22 -1.32 -0.07 -2.27 0.00 0.00 179.45 176.01 2pu0 h LEU 104 N -1.00 0.00 -0.02 5.20 3.38 -1.87 -3.51 115.31 117.49 2pu0 h LEU 104 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2pu0 h LEU 104 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2pu0 h LEU 104 CO -0.02 0.73 0.00 0.61 0.09 0.00 0.00 178.44 179.84 2pu0 n GLY 105 N 1.41 0.92 0.30 0.83 0.00 -0.29 -4.34 105.19 104.01 2pu0 n GLY 105 Ca -0.09 -1.30 0.11 0.00 0.00 0.00 0.00 46.02 44.74 2pu0 n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pu0 h ALA 106 N 0.00 2.09 0.00 4.61 0.00 -0.82 -1.72 119.26 123.43 2pu0 h ALA 106 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2pu0 h ALA 106 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2pu0 h ALA 106 CO 0.00 -0.14 -0.27 -2.95 0.00 0.00 0.00 179.25 175.90 2pu0 h ASN 107 N 0.06 0.00 0.04 0.00 -0.00 -1.89 -0.93 115.58 112.86 2pu0 h ASN 107 Ca 0.08 0.00 -0.13 0.00 -0.00 0.00 0.00 56.30 56.25 2pu0 h ASN 107 Cb 0.25 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 38.58 2pu0 h ASN 107 CO -0.01 0.27 -0.52 0.00 -0.00 0.00 0.00 177.43 177.16 2pu0 h ALA 108 N 1.73 0.01 -0.21 4.14 0.00 -1.54 -3.35 119.26 120.05 2pu0 h ALA 108 Ca -0.00 -0.57 -0.04 0.00 0.00 0.00 0.00 54.91 54.30 2pu0 h ALA 108 Cb 0.87 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2pu0 h ALA 108 CO 0.03 0.26 -0.01 0.82 0.00 0.00 0.00 179.25 180.36 2pu0 h ILE 109 N -0.34 1.26 -0.40 0.00 2.04 -1.33 -3.25 117.51 115.50 2pu0 h ILE 109 Ca -0.08 -0.91 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 2pu0 h ILE 109 Cb 1.30 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.81 2pu0 h ILE 109 CO 0.10 0.28 0.22 0.25 0.00 0.00 0.00 178.15 179.00 2pu0 h LEU 110 N 0.13 0.50 -0.64 1.44 5.85 -0.90 -1.08 115.31 120.60 2pu0 h LEU 110 Ca 0.06 -0.09 0.12 0.00 0.84 0.00 0.00 57.88 58.81 2pu0 h LEU 110 Cb 0.42 -0.13 -0.09 0.00 0.37 0.00 0.00 40.66 41.23 2pu0 h LEU 110 CO 0.01 0.44 0.14 1.23 -0.34 0.00 0.00 178.44 179.93 2pu0 h GLY 111 N 0.51 0.83 0.87 3.75 0.00 -1.70 -0.28 103.07 107.06 2pu0 h GLY 111 Ca 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2pu0 h GLY 111 CO -0.02 -0.13 -0.09 0.00 0.00 0.00 0.00 176.54 176.29 2pu0 h SER 113 N -0.20 -0.13 0.19 0.00 0.87 -0.71 -0.62 113.55 112.95 2pu0 h SER 113 Ca 0.01 0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2pu0 h SER 113 Cb 0.20 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.30 2pu0 h SER 113 CO -0.03 -0.03 -0.14 0.24 -0.53 0.00 0.00 176.83 176.34 2pu0 h MET 114 N 0.11 -0.32 -0.50 2.24 2.86 -1.02 -2.48 114.93 115.81 2pu0 h MET 114 Ca 0.18 0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.76 2pu0 h MET 114 Cb 0.25 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 2pu0 h MET 114 CO -0.29 -0.22 -0.02 0.00 1.06 0.00 0.00 176.91 177.44 2pu0 h ALA 115 N 0.45 1.03 -0.42 6.32 0.00 -0.98 -2.16 119.26 123.49 2pu0 h ALA 115 Ca -0.01 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.66 2pu0 h ALA 115 Cb 0.29 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2pu0 h ALA 115 CO -0.00 0.60 0.18 0.82 0.00 0.00 0.00 179.25 180.85 2pu0 h ILE 116 N 0.79 0.92 -0.36 0.00 2.04 -1.11 -0.30 117.51 119.49 2pu0 h ILE 116 Ca 0.15 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.83 2pu0 h ILE 116 Cb 0.50 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 2pu0 h ILE 116 CO 0.02 0.07 -0.02 0.77 0.00 0.00 0.00 178.15 179.00 2pu0 h SER 117 N 0.37 0.54 -0.30 1.72 4.64 -0.94 0.02 113.55 119.60 2pu0 h SER 117 Ca 0.19 -0.11 -0.18 0.00 -0.47 0.00 0.00 61.79 61.23 2pu0 h SER 117 Cb 0.14 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2pu0 h SER 117 CO -0.17 0.62 -0.50 0.11 -0.87 0.00 0.00 176.83 176.02 2pu0 h LYS 118 N 0.54 0.87 -0.80 4.77 1.57 -0.95 -1.01 116.57 121.57 2pu0 h LYS 118 Ca 0.11 -0.53 0.02 0.00 -1.87 0.00 0.00 60.65 58.38 2pu0 h LYS 118 Cb 0.37 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.69 2pu0 h LYS 118 CO 0.01 1.17 0.52 0.00 -0.57 0.00 0.00 179.45 180.58 2pu0 h ALA 119 N 0.69 1.04 -0.26 3.86 0.00 -0.65 -2.18 119.26 121.75 2pu0 h ALA 119 Ca 0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2pu0 h ALA 119 Cb 1.10 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2pu0 h ALA 119 CO 0.11 0.36 0.03 0.00 0.00 0.00 0.00 179.25 179.75 2pu0 h ALA 120 N 1.32 0.35 -0.66 0.00 0.00 -0.88 0.17 119.26 119.56 2pu0 h ALA 120 Ca 0.31 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 55.11 2pu0 h ALA 120 Cb -0.03 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.59 2pu0 h ALA 120 CO -0.10 0.05 0.32 0.00 0.00 0.00 0.00 179.25 179.52 2pu0 h ALA 121 N 0.85 0.89 -0.56 0.00 0.00 -1.10 -0.29 119.26 119.05 2pu0 h ALA 121 Ca 0.08 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2pu0 h ALA 121 Cb 0.35 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2pu0 h ALA 121 CO 0.01 -0.07 0.22 0.00 0.00 0.00 0.00 179.25 179.40 2pu0 h ALA 122 N 1.40 0.72 -0.92 0.00 0.00 -1.21 -0.34 119.26 118.91 2pu0 h ALA 122 Ca 0.32 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.12 2pu0 h ALA 122 Cb 0.32 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 2pu0 h ALA 122 CO -0.25 0.34 0.58 0.00 0.00 0.00 0.00 179.25 179.92 2pu0 h ALA 123 N 1.07 1.26 0.00 0.00 0.00 -0.28 -1.35 119.26 119.96 2pu0 h ALA 123 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2pu0 h ALA 123 Cb 0.21 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2pu0 h ALA 123 CO -0.01 0.37 0.00 0.87 0.00 0.00 0.00 179.25 180.47 2pu0 h LYS 124 N 1.08 0.00 -2.77 0.00 1.79 -0.66 -3.48 116.57 112.53 2pu0 h LYS 124 Ca 0.39 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.71 2pu0 h LYS 124 Cb 0.14 0.00 0.05 0.00 -1.58 0.00 0.00 32.23 30.84 2pu0 h LYS 124 CO -0.16 0.00 -0.26 0.41 -1.08 0.00 0.00 179.45 178.36 2pu0 n GLY 125 N 0.49 0.35 3.17 3.86 0.00 -0.22 -5.07 105.19 107.78 2pu0 n GLY 125 Ca 0.02 -0.33 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 2pu0 n GLY 125 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2pu0 s VAL 126 N -3.08 0.91 0.68 1.61 -7.23 -0.72 -5.03 120.40 107.54 2pu0 s VAL 126 Ca 0.21 -1.58 -0.15 0.00 -1.81 0.00 0.00 61.98 58.65 2pu0 s VAL 126 Cb -0.09 -1.29 0.01 0.00 0.56 0.00 0.00 36.38 35.57 2pu0 s VAL 126 CO 0.26 -0.53 1.13 -2.16 -0.31 0.00 0.00 175.10 173.49 2pu0 s PRO 127 N -2.66 2.58 0.23 4.82 0.04 -1.26 -4.23 135.00 134.53 2pu0 s PRO 127 Ca 0.04 1.48 -0.12 0.00 0.04 0.00 0.00 61.00 62.44 2pu0 s PRO 127 Cb -0.04 -1.92 0.31 0.00 0.04 0.00 0.00 34.50 32.90 2pu0 s PRO 127 CO 0.00 -1.43 1.60 1.25 0.04 0.00 0.00 177.00 178.46 2pu0 h LEU 128 N -0.12 -0.71 -1.50 -3.56 5.85 -1.93 0.43 115.31 113.76 2pu0 h LEU 128 Ca -0.47 0.23 0.09 0.00 0.84 0.00 0.00 57.88 58.57 2pu0 h LEU 128 Cb 1.26 0.47 -0.04 0.00 0.37 0.00 0.00 40.66 42.71 2pu0 h LEU 128 CO 0.53 -0.25 0.45 0.10 -0.34 0.00 0.00 178.44 178.93 2pu0 h TYR 129 N -0.00 0.60 -0.13 1.25 -0.00 -1.92 -0.23 116.97 116.54 2pu0 h TYR 129 Ca 0.36 0.02 -0.07 0.00 0.00 0.00 0.00 58.73 59.04 2pu0 h TYR 129 Cb 0.55 -0.19 -0.00 0.00 0.00 0.00 0.00 36.73 37.09 2pu0 h TYR 129 CO -0.60 0.28 -0.17 0.00 -0.00 0.00 0.00 178.16 177.67 2pu0 h ARG 130 N 0.56 0.35 -0.14 0.10 2.47 -1.29 -1.61 114.38 114.82 2pu0 h ARG 130 Ca 0.31 -0.20 0.01 0.00 -1.26 0.00 0.00 59.98 58.85 2pu0 h ARG 130 Cb 0.48 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.80 2pu0 h ARG 130 CO -0.10 0.77 0.06 -0.92 0.56 0.00 0.00 179.97 180.33 2pu0 h TYR 131 N -0.04 0.10 -0.48 3.04 5.03 -0.88 -2.35 116.97 121.39 2pu0 h TYR 131 Ca 0.02 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.29 2pu0 h TYR 131 Cb 0.72 -0.03 -0.02 0.00 1.55 0.00 0.00 36.73 38.96 2pu0 h TYR 131 CO 0.09 0.06 0.14 -0.07 -1.32 0.00 0.00 178.16 177.05 2pu0 h LEU 132 N 0.13 0.65 -0.72 2.82 3.38 -1.08 -1.42 115.31 119.08 2pu0 h LEU 132 Ca 0.06 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2pu0 h LEU 132 Cb 0.03 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2pu0 h LEU 132 CO -0.06 0.63 0.47 0.00 0.09 0.00 0.00 178.44 179.57 2pu0 h ALA 133 N 1.46 0.92 -0.42 1.53 0.00 -1.00 -0.90 119.26 120.85 2pu0 h ALA 133 Ca 0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2pu0 h ALA 133 Cb 0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2pu0 h ALA 133 CO -0.01 0.30 0.21 0.77 0.00 0.00 0.00 179.25 180.52 2pu0 h SER 134 N 0.94 0.55 -0.64 0.00 0.02 -0.87 -0.49 113.55 113.07 2pu0 h SER 134 Ca 0.27 -0.12 0.04 0.00 -0.84 0.00 0.00 61.79 61.13 2pu0 h SER 134 Cb -0.07 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.29 2pu0 h SER 134 CO -0.07 0.52 0.42 -0.07 -1.14 0.00 0.00 176.83 176.49 2pu0 h LEU 135 N 0.55 0.65 -0.67 5.07 3.38 -0.84 -2.78 115.31 120.66 2pu0 h LEU 135 Ca 0.15 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2pu0 h LEU 135 Cb 0.11 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2pu0 h LEU 135 CO -0.02 0.44 -0.23 0.00 0.09 0.00 0.00 178.44 178.73 2pu0 n ALA 136 N -2.45 3.02 -2.33 1.53 0.00 -0.38 -4.95 120.51 114.95 2pu0 n ALA 136 Ca 0.08 -0.44 -0.19 0.00 0.00 0.00 0.00 53.44 52.88 2pu0 n ALA 136 Cb 0.14 -1.10 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 2pu0 n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pu0 n GLY 137 N 1.32 -0.32 3.70 0.00 0.00 -0.34 -4.96 105.19 104.59 2pu0 n GLY 137 Ca 0.13 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2pu0 n GLY 137 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pu0 s THR 138 N -2.96 3.57 0.09 2.61 2.01 -0.36 -4.94 115.64 115.67 2pu0 s THR 138 Ca 0.00 1.04 0.08 0.00 0.31 0.00 0.00 61.69 63.12 2pu0 s THR 138 Cb 0.00 -3.67 -0.21 0.00 0.01 0.00 0.00 72.50 68.63 2pu0 s THR 138 CO 0.00 0.03 1.19 0.11 -0.69 0.00 0.00 174.62 175.26 2pu0 h LYS 139 N 7.44 0.00 -3.11 4.92 1.57 -1.92 -3.46 116.57 122.01 2pu0 h LYS 139 Ca -0.40 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.03 2pu0 h LYS 139 Cb 1.19 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 33.12 2pu0 h LYS 139 CO 0.88 0.91 -0.70 -2.00 -0.57 0.00 0.00 179.45 177.98 2pu0 s GLU 140 N -2.70 0.01 0.56 3.15 2.12 -1.26 -5.13 118.70 115.44 2pu0 s GLU 140 Ca 0.00 0.34 -0.19 0.00 0.36 0.00 0.00 54.97 55.48 2pu0 s GLU 140 Cb 0.10 -0.75 -0.05 0.00 0.26 0.00 0.00 34.13 33.68 2pu0 s GLU 140 CO 0.82 -0.42 1.15 -0.51 -0.54 0.00 0.00 175.26 175.76 2pu0 s LEU 141 N 2.22 3.72 0.00 2.70 1.43 -1.26 -4.37 118.68 123.12 2pu0 s LEU 141 Ca 0.04 2.23 -0.13 0.00 -1.03 0.00 0.00 54.13 55.24 2pu0 s LEU 141 Cb -0.13 -4.59 0.02 0.00 0.03 0.00 0.00 46.19 41.52 2pu0 s LEU 141 CO -0.06 -1.32 0.27 0.00 0.23 0.00 0.00 176.35 175.47 2pu0 s ARG 142 N -3.31 0.65 0.11 1.70 1.70 -1.24 -4.40 118.95 114.17 2pu0 s ARG 142 Ca 0.74 -0.31 -0.30 0.00 -0.47 0.00 0.00 55.73 55.39 2pu0 s ARG 142 Cb -0.25 0.28 -0.06 0.00 -0.57 0.00 0.00 34.95 34.35 2pu0 s ARG 142 CO 0.29 -0.18 1.05 -0.51 -1.08 0.00 0.00 175.30 174.86 2pu0 s LEU 143 N -1.49 4.46 0.41 -1.89 2.01 -0.23 -4.26 118.68 117.68 2pu0 s LEU 143 Ca -0.12 1.92 -0.13 0.00 0.01 0.00 0.00 54.13 55.81 2pu0 s LEU 143 Cb -0.05 -3.59 -0.07 0.00 0.01 0.00 0.00 46.19 42.49 2pu0 s LEU 143 CO 0.02 -0.21 0.81 -2.16 1.01 0.00 0.00 176.35 175.83 2pu0 s PRO 144 N 0.15 3.87 0.06 1.29 0.04 -1.26 -0.46 135.00 138.68 2pu0 s PRO 144 Ca 0.50 0.63 -0.31 0.00 0.04 0.00 0.00 61.00 61.86 2pu0 s PRO 144 Cb -0.26 -2.34 -0.07 0.00 0.04 0.00 0.00 34.50 31.86 2pu0 s PRO 144 CO 0.31 -0.04 1.51 0.54 0.04 0.00 0.00 177.00 179.36 2pu0 s VAL 145 N -2.34 3.29 0.09 -0.36 0.11 0.25 -4.64 120.40 116.80 2pu0 s VAL 145 Ca 0.54 0.77 -0.28 0.00 -2.93 0.00 0.00 61.98 60.08 2pu0 s VAL 145 Cb -0.10 -3.50 -0.06 0.00 -1.53 0.00 0.00 36.38 31.19 2pu0 s VAL 145 CO 0.28 0.01 0.89 -2.16 -3.33 0.00 0.00 175.10 170.79 2pu0 s PRO 146 N 2.19 4.63 -0.38 1.54 0.04 -1.26 -2.10 135.00 139.66 2pu0 s PRO 146 Ca 0.68 1.31 -0.05 0.00 0.04 0.00 0.00 61.00 62.99 2pu0 s PRO 146 Cb -0.37 -3.37 0.08 0.00 0.04 0.00 0.00 34.50 30.88 2pu0 s PRO 146 CO 0.30 0.25 0.16 0.00 0.04 0.00 0.00 177.00 177.75 2pu0 s PHE 148 N 1.28 3.20 -0.83 0.00 0.08 0.46 -4.19 117.98 117.98 2pu0 s PHE 148 Ca 0.02 -0.06 -0.25 0.00 0.12 0.00 0.00 56.93 56.76 2pu0 s PHE 148 Cb -0.22 -2.74 0.02 0.00 -0.57 0.00 0.00 43.02 39.51 2pu0 s PHE 148 CO -0.01 -0.49 1.49 1.21 -0.10 0.00 0.00 175.22 177.32 2pu0 s ASN 149 N 1.75 6.03 -0.02 1.36 2.47 -1.24 -1.22 114.94 124.06 2pu0 s ASN 149 Ca 0.13 -0.69 0.17 0.00 0.42 0.00 0.00 52.86 52.88 2pu0 s ASN 149 Cb -0.16 -2.56 -0.25 0.00 -1.45 0.00 0.00 41.25 36.83 2pu0 s ASN 149 CO 0.12 -1.91 0.41 1.33 -3.72 0.00 0.00 177.10 173.33 2pu0 n VAL 150 N 6.83 0.00 -4.00 -5.21 0.24 -0.65 -3.28 118.33 112.26 2pu0 n VAL 150 Ca 0.19 -0.34 -0.33 0.00 -2.04 0.00 0.00 64.34 61.82 2pu0 n VAL 150 Cb 0.50 0.24 -0.14 0.00 -1.47 0.00 0.00 33.84 32.97 2pu0 n VAL 150 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2pu0 s ILE 151 N -3.07 2.54 -0.05 1.34 1.01 -1.09 -0.05 121.20 121.84 2pu0 s ILE 151 Ca -0.04 -1.46 -0.18 0.00 0.00 0.00 0.00 60.65 58.96 2pu0 s ILE 151 Cb 0.11 -2.45 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 2pu0 s ILE 151 CO 0.69 -0.02 0.51 0.20 0.00 0.00 0.00 174.94 176.32 2pu0 s ASN 152 N 1.18 6.83 0.00 3.58 0.02 0.79 -2.28 114.94 125.07 2pu0 s ASN 152 Ca -0.06 0.99 0.00 0.00 -1.02 0.00 0.00 52.86 52.76 2pu0 s ASN 152 Cb -0.19 -2.31 0.00 0.00 0.02 0.00 0.00 41.25 38.77 2pu0 s ASN 152 CO -0.04 0.12 0.00 0.61 0.02 0.00 0.00 177.10 177.81 2pu0 n GLY 153 N 2.61 5.25 7.00 0.66 0.00 -0.07 -4.57 105.19 116.08 2pu0 n GLY 153 Ca -0.09 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.65 2pu0 n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pu0 n GLY 154 N 0.00 2.05 0.00 -0.02 0.00 -0.24 -1.63 105.19 105.35 2pu0 n GLY 154 Ca 0.00 -0.37 0.03 0.00 0.00 0.00 0.00 46.02 45.68 2pu0 n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2pu0 n LYS 155 N 11.69 0.05 0.00 1.61 5.02 -1.26 -3.30 118.16 131.98 2pu0 n LYS 155 Ca 0.00 0.30 0.12 0.00 -2.02 0.00 0.00 58.31 56.71 2pu0 n LYS 155 Cb 0.00 -1.50 0.28 0.00 -0.02 0.00 0.00 35.03 33.79 2pu0 n LYS 155 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2pu0 n HIS 156 N -1.39 0.00 -3.68 2.13 8.25 -0.64 -4.94 115.22 114.95 2pu0 n HIS 156 Ca 0.03 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 2pu0 n HIS 156 Cb 0.07 -0.10 -0.06 0.00 1.12 0.00 0.00 29.99 31.02 2pu0 n HIS 156 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2pu0 s ALA 157 N -2.52 -0.90 0.00 -1.41 0.00 -1.18 -1.47 121.76 114.28 2pu0 s ALA 157 Ca 0.22 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.31 2pu0 s ALA 157 Cb 0.19 0.43 0.00 0.00 0.00 0.00 0.00 23.12 23.74 2pu0 s ALA 157 CO 0.54 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 176.22 2pu0 n GLY 158 N 0.32 0.42 0.00 0.00 0.00 -1.26 -4.53 105.19 100.13 2pu0 n GLY 158 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2pu0 n GLY 158 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2pu0 n ASN 159 N 0.00 0.00 0.20 1.61 0.23 -1.26 -4.85 115.26 111.19 2pu0 n ASN 159 Ca 0.00 0.00 0.08 0.00 -0.53 0.00 0.00 54.58 54.13 2pu0 n ASN 159 Cb 0.00 0.00 0.30 0.00 -2.08 0.00 0.00 39.78 38.00 2pu0 n ASN 159 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2pu0 h ALA 160 N 0.00 0.91 -1.38 -2.53 0.00 -1.87 -3.47 119.26 110.92 2pu0 h ALA 160 Ca 0.00 -0.24 -0.67 0.00 0.00 0.00 0.00 54.91 54.00 2pu0 h ALA 160 Cb 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2pu0 h ALA 160 CO 0.00 0.34 1.30 -0.11 0.00 0.00 0.00 179.25 180.77 2pu0 n LEU 161 N -3.29 2.48 0.08 0.00 7.94 0.65 -4.70 117.00 120.17 2pu0 n LEU 161 Ca 0.01 0.59 -0.09 0.00 -1.11 0.00 0.00 56.01 55.41 2pu0 n LEU 161 Cb 0.53 -1.29 -0.04 0.00 0.53 0.00 0.00 43.42 43.16 2pu0 n LEU 161 CO 0.35 -0.56 0.20 1.55 -1.11 0.00 0.00 177.39 177.82 2pu0 h PRO 162 N 11.32 0.18 -6.59 1.96 0.13 -1.76 -0.62 132.00 136.62 2pu0 h PRO 162 Ca -0.35 -0.22 -0.51 0.00 -0.87 0.00 0.00 66.00 64.05 2pu0 h PRO 162 Cb 1.31 0.07 -0.03 0.00 0.13 0.00 0.00 31.00 32.48 2pu0 h PRO 162 CO 0.99 0.99 -0.01 -0.06 -0.23 0.00 0.00 178.00 179.68 2pu0 s PHE 163 N -3.07 3.40 -0.14 1.56 2.99 -1.26 -3.85 117.98 117.61 2pu0 s PHE 163 Ca -0.02 1.02 -0.17 0.00 0.00 0.00 0.00 56.93 57.75 2pu0 s PHE 163 Cb 0.10 -2.38 -0.25 0.00 0.00 0.00 0.00 43.02 40.49 2pu0 s PHE 163 CO 0.83 0.17 0.45 0.37 -0.00 0.00 0.00 175.22 177.04 2pu0 h GLN 164 N 2.32 0.15 -3.75 0.44 4.15 -1.38 -2.69 115.11 114.35 2pu0 h GLN 164 Ca -0.47 -0.26 -0.37 0.00 0.77 0.00 0.00 58.65 58.32 2pu0 h GLN 164 Cb 1.17 0.10 -0.35 0.00 0.21 0.00 0.00 27.48 28.61 2pu0 h GLN 164 CO 0.67 1.13 -0.75 -1.21 -1.93 0.00 0.00 178.83 176.73 2pu0 s GLU 165 N -2.43 0.41 -0.24 1.69 2.02 -0.12 -0.89 118.70 119.14 2pu0 s GLU 165 Ca -0.23 0.07 0.00 0.00 0.02 0.00 0.00 54.97 54.83 2pu0 s GLU 165 Cb 0.04 -0.61 0.04 0.00 0.10 0.00 0.00 34.13 33.70 2pu0 s GLU 165 CO 0.71 -0.16 -0.10 -0.06 0.02 0.00 0.00 175.26 175.67 2pu0 s PHE 166 N 1.20 3.08 0.15 1.61 0.08 -0.96 -1.15 117.98 121.99 2pu0 s PHE 166 Ca -0.07 -1.84 0.10 0.00 0.12 0.00 0.00 56.93 55.23 2pu0 s PHE 166 Cb -0.13 -1.99 -0.04 0.00 -0.57 0.00 0.00 43.02 40.28 2pu0 s PHE 166 CO -0.02 -0.80 -0.17 -1.64 -0.10 0.00 0.00 175.22 172.49 2pu0 s MET 167 N 1.24 1.79 0.00 0.44 -1.94 0.31 -1.64 119.30 119.51 2pu0 s MET 167 Ca -0.02 -1.29 0.07 0.00 -1.71 0.00 0.00 55.69 52.74 2pu0 s MET 167 Cb -0.17 -2.06 -0.03 0.00 2.01 0.00 0.00 34.83 34.58 2pu0 s MET 167 CO -0.06 0.45 -0.22 0.96 -0.01 0.00 0.00 175.02 176.14 2pu0 s ILE 168 N -1.41 2.45 -0.09 2.53 -4.36 -0.36 -1.73 121.20 118.23 2pu0 s ILE 168 Ca 0.20 -1.12 -0.02 0.00 -0.26 0.00 0.00 60.65 59.45 2pu0 s ILE 168 Cb -0.09 -1.95 0.04 0.00 1.25 0.00 0.00 42.46 41.71 2pu0 s ILE 168 CO 0.11 0.47 0.03 0.00 0.24 0.00 0.00 174.94 175.80 2pu0 s ALA 169 N -0.76 0.60 -0.96 2.27 0.00 -0.11 -0.40 121.76 122.39 2pu0 s ALA 169 Ca 0.12 -0.15 -0.15 0.00 0.00 0.00 0.00 51.96 51.78 2pu0 s ALA 169 Cb -0.10 -0.81 -0.09 0.00 0.00 0.00 0.00 23.12 22.12 2pu0 s ALA 169 CO 0.02 -0.64 2.09 -0.35 0.00 0.00 0.00 175.76 176.87 2pu0 n PRO 170 N 5.19 2.00 0.27 0.00 -0.04 -1.26 -0.48 135.00 140.68 2pu0 n PRO 170 Ca -0.06 -1.84 0.14 0.00 -0.04 0.00 0.00 63.50 61.69 2pu0 n PRO 170 Cb 0.49 -2.81 0.78 0.00 -0.04 0.00 0.00 33.50 31.92 2pu0 n PRO 170 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 2pu0 h VAL 171 N 3.99 0.51 -0.16 0.52 -1.51 -1.77 -2.05 116.25 115.77 2pu0 h VAL 171 Ca 0.49 -0.43 0.00 0.00 -1.23 0.00 0.00 66.70 65.53 2pu0 h VAL 171 Cb 0.48 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 30.92 2pu0 h VAL 171 CO 1.78 0.09 0.00 0.29 -1.23 0.00 0.00 177.57 178.50 2pu0 n LYS 172 N -3.62 2.12 -1.19 5.19 4.76 -0.62 -4.29 118.16 120.50 2pu0 n LYS 172 Ca -0.02 -1.65 -0.33 0.00 -2.87 0.00 0.00 58.31 53.44 2pu0 n LYS 172 Cb 0.21 -1.46 0.12 0.00 -1.84 0.00 0.00 35.03 32.05 2pu0 n LYS 172 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2pu0 s ALA 173 N -1.81 1.92 -1.10 7.82 0.00 -0.77 -4.97 121.76 122.86 2pu0 s ALA 173 Ca 0.34 0.76 0.10 0.00 0.00 0.00 0.00 51.96 53.16 2pu0 s ALA 173 Cb 0.20 -3.46 0.05 0.00 0.00 0.00 0.00 23.12 19.91 2pu0 s ALA 173 CO 0.30 -2.15 0.73 0.25 0.00 0.00 0.00 175.76 174.89 2pu0 n THR 174 N -3.24 0.00 -3.88 0.00 -2.24 -1.26 -4.93 114.28 98.74 2pu0 n THR 174 Ca 0.13 -0.46 -0.09 0.00 -2.27 0.00 0.00 64.05 61.36 2pu0 n THR 174 Cb 0.51 1.17 -0.07 0.00 -2.10 0.00 0.00 70.33 69.84 2pu0 n THR 174 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2pu0 s SER 175 N -1.04 0.09 0.20 3.42 1.04 -1.26 -4.72 113.70 111.42 2pu0 s SER 175 Ca 0.10 -0.70 -0.10 0.00 0.48 0.00 0.00 55.95 55.73 2pu0 s SER 175 Cb 0.08 0.37 0.13 0.00 0.10 0.00 0.00 66.02 66.70 2pu0 s SER 175 CO 0.17 -0.78 1.79 0.15 0.98 0.00 0.00 173.24 175.56 2pu0 h PHE 176 N 2.68 1.02 -0.34 5.02 3.57 -1.92 -1.00 116.94 125.97 2pu0 h PHE 176 Ca -0.33 -0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.20 2pu0 h PHE 176 Cb 1.21 -0.32 -0.08 0.00 2.79 0.00 0.00 35.95 39.55 2pu0 h PHE 176 CO 0.41 0.75 -0.25 0.77 -2.23 0.00 0.00 178.31 177.77 2pu0 h SER 177 N 1.00 -0.81 -0.39 0.41 0.02 -1.96 0.13 113.55 111.94 2pu0 h SER 177 Ca 0.25 0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 61.34 2pu0 h SER 177 Cb 0.10 0.40 -0.02 0.00 0.14 0.00 0.00 62.40 63.03 2pu0 h SER 177 CO -0.03 -0.27 0.20 -0.08 -1.14 0.00 0.00 176.83 175.50 2pu0 h GLU 178 N -0.20 0.55 -0.46 3.45 4.81 -1.96 -1.07 114.58 119.71 2pu0 h GLU 178 Ca 0.17 -0.08 0.08 0.00 -0.13 0.00 0.00 59.36 59.41 2pu0 h GLU 178 Cb 0.47 -0.10 -0.07 0.00 0.63 0.00 0.00 28.75 29.68 2pu0 h GLU 178 CO -0.46 0.48 0.05 0.00 -0.73 0.00 0.00 179.01 178.35 2pu0 h ALA 179 N 1.05 0.47 -0.23 2.92 0.00 -0.55 0.10 119.26 123.02 2pu0 h ALA 179 Ca 0.14 0.11 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 2pu0 h ALA 179 Cb 0.10 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2pu0 h ALA 179 CO -0.02 -0.35 -0.26 1.25 0.00 0.00 0.00 179.25 179.88 2pu0 h LEU 180 N 0.17 0.62 -0.28 0.00 5.85 -0.63 -0.85 115.31 120.21 2pu0 h LEU 180 Ca 0.23 -0.49 0.01 0.00 0.84 0.00 0.00 57.88 58.47 2pu0 h LEU 180 Cb 0.32 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2pu0 h LEU 180 CO -0.33 0.98 0.17 -0.09 -0.34 0.00 0.00 178.44 178.82 2pu0 h ARG 181 N 0.27 0.33 -0.57 1.25 2.43 -0.93 -1.09 114.38 116.06 2pu0 h ARG 181 Ca 0.03 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.24 2pu0 h ARG 181 Cb 0.82 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.24 2pu0 h ARG 181 CO 0.06 0.22 0.29 0.52 -1.51 0.00 0.00 179.97 179.55 2pu0 h MET 182 N 0.34 0.53 -0.21 0.20 2.86 -0.70 -0.02 114.93 117.94 2pu0 h MET 182 Ca 0.11 -0.03 0.04 0.00 -2.06 0.00 0.00 59.70 57.75 2pu0 h MET 182 Cb -0.01 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.49 2pu0 h MET 182 CO -0.04 0.35 -0.03 0.78 1.06 0.00 0.00 176.91 179.03 2pu0 h GLY 183 N 0.55 0.17 0.98 8.32 0.00 -0.88 -1.11 103.07 111.11 2pu0 h GLY 183 Ca 0.26 0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.63 2pu0 h GLY 183 CO -0.18 -0.06 0.24 0.23 0.00 0.00 0.00 176.54 176.76 2pu0 h SER 184 N 0.03 0.47 -0.80 0.19 0.87 -0.93 -1.05 113.55 112.32 2pu0 h SER 184 Ca 0.10 -0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.62 2pu0 h SER 184 Cb 0.14 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 61.94 2pu0 h SER 184 CO -0.19 0.38 0.53 -0.33 -0.53 0.00 0.00 176.83 176.69 2pu0 h GLU 185 N 0.51 1.04 -0.44 2.24 5.08 -0.64 -0.35 114.58 122.03 2pu0 h GLU 185 Ca 0.14 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 2pu0 h GLU 185 Cb -0.00 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.00 2pu0 h GLU 185 CO -0.03 0.69 0.03 0.28 -1.00 0.00 0.00 179.01 178.98 2pu0 h VAL 186 N 1.08 1.26 -0.56 3.13 2.07 -1.09 -1.13 116.25 121.00 2pu0 h VAL 186 Ca 0.30 -0.99 0.06 0.00 0.82 0.00 0.00 66.70 66.89 2pu0 h VAL 186 Cb -0.11 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 30.63 2pu0 h VAL 186 CO -0.07 0.34 0.26 0.22 0.02 0.00 0.00 177.57 178.34 2pu0 h TYR 187 N 0.62 0.46 -0.52 1.57 3.20 -0.79 0.24 116.97 121.75 2pu0 h TYR 187 Ca 0.13 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 2pu0 h TYR 187 Cb 0.46 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 2pu0 h TYR 187 CO 0.03 0.19 0.21 0.45 -1.64 0.00 0.00 178.16 177.41 2pu0 h HIS 188 N 0.48 0.79 -0.82 -3.82 3.86 -0.77 -1.93 115.15 112.94 2pu0 h HIS 188 Ca 0.26 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.40 2pu0 h HIS 188 Cb 0.23 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.42 2pu0 h HIS 188 CO -0.12 0.65 0.45 0.77 0.86 0.00 0.00 177.93 180.53 2pu0 h SER 189 N 0.70 1.04 -0.84 2.45 0.02 -0.59 -2.89 113.55 113.44 2pu0 h SER 189 Ca 0.17 -0.10 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 2pu0 h SER 189 Cb 0.19 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.42 2pu0 h SER 189 CO -0.01 0.84 0.55 0.25 -1.14 0.00 0.00 176.83 177.31 2pu0 h LEU 190 N 1.15 0.91 -0.35 5.07 5.85 -0.23 -1.95 115.31 125.76 2pu0 h LEU 190 Ca 0.29 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.06 2pu0 h LEU 190 Cb 0.04 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.81 2pu0 h LEU 190 CO -0.05 0.64 0.02 -0.09 -0.34 0.00 0.00 178.44 178.62 2pu0 h ARG 191 N 1.07 0.12 -0.96 1.25 2.43 -1.14 -0.59 114.38 116.57 2pu0 h ARG 191 Ca 0.33 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 2pu0 h ARG 191 Cb -0.02 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.45 2pu0 h ARG 191 CO -0.10 0.08 0.61 0.78 -1.51 0.00 0.00 179.97 179.82 2pu0 h GLY 192 N 0.13 1.37 0.88 2.80 0.00 -1.37 0.26 103.07 107.13 2pu0 h GLY 192 Ca 0.17 -0.54 -0.06 0.00 0.00 0.00 0.00 47.33 46.90 2pu0 h GLY 192 CO -0.27 0.53 -0.06 -2.22 0.00 0.00 0.00 176.54 174.52 2pu0 h ILE 193 N 1.31 1.28 -0.28 2.60 2.04 -1.00 -1.45 117.51 122.01 2pu0 h ILE 193 Ca 0.35 -1.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.09 2pu0 h ILE 193 Cb -0.10 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 2pu0 h ILE 193 CO -0.07 0.34 0.04 0.40 0.00 0.00 0.00 178.15 178.87 2pu0 h ILE 194 N 0.30 1.23 -0.68 -0.67 2.04 -0.91 -1.48 117.51 117.35 2pu0 h ILE 194 Ca 0.07 -0.80 0.05 0.00 1.00 0.00 0.00 64.86 65.18 2pu0 h ILE 194 Cb 0.54 1.21 -0.05 0.00 -0.74 0.00 0.00 36.82 37.78 2pu0 h ILE 194 CO 0.03 0.26 0.40 0.50 0.00 0.00 0.00 178.15 179.34 2pu0 h LYS 195 N 0.28 0.74 -0.58 2.37 3.64 -0.90 0.70 116.57 122.83 2pu0 h LYS 195 Ca 0.08 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.31 2pu0 h LYS 195 Cb 0.34 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 2pu0 h LYS 195 CO 0.01 0.49 -0.06 -0.22 -2.27 0.00 0.00 179.45 177.39 2pu0 h LYS 196 N 0.76 1.06 0.23 1.90 3.64 -1.08 0.14 116.57 123.23 2pu0 h LYS 196 Ca 0.29 -0.37 -0.32 0.00 -1.27 0.00 0.00 60.65 58.98 2pu0 h LYS 196 Cb 0.11 -0.08 0.04 0.00 -0.41 0.00 0.00 32.23 31.89 2pu0 h LYS 196 CO -0.15 1.07 -1.38 -0.22 -2.27 0.00 0.00 179.45 176.50 2pu0 h LYS 197 N 0.95 0.53 0.00 1.90 3.64 -0.97 -3.39 116.57 119.23 2pu0 h LYS 197 Ca 0.16 -0.88 0.00 0.00 -1.27 0.00 0.00 60.65 58.66 2pu0 h LYS 197 Cb 0.63 0.32 0.00 0.00 -0.41 0.00 0.00 32.23 32.78 2pu0 h LYS 197 CO 0.04 1.42 -0.89 0.66 -2.27 0.00 0.00 179.45 178.41 2pu0 n TYR 198 N -3.78 0.00 0.00 1.91 4.01 0.21 -5.10 117.16 114.42 2pu0 n TYR 198 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 2pu0 n TYR 198 Cb 1.06 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 40.00 2pu0 n TYR 198 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2pu0 n GLY 199 N 1.66 0.75 0.31 2.72 0.00 0.50 -4.64 105.19 106.49 2pu0 n GLY 199 Ca -0.00 -1.90 0.08 0.00 0.00 0.00 0.00 46.02 44.20 2pu0 n GLY 199 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2pu0 h GLN 200 N 0.00 0.05 0.00 1.61 4.20 -1.91 -2.01 115.11 117.05 2pu0 h GLN 200 Ca 0.00 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2pu0 h GLN 200 Cb 0.00 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.77 2pu0 h GLN 200 CO 0.00 0.03 0.00 -0.25 -0.67 0.00 0.00 178.83 177.94 2pu0 n ASP 201 N -5.45 0.00 -0.18 1.46 10.43 -1.26 -3.08 116.55 118.47 2pu0 n ASP 201 Ca 0.16 0.00 0.12 0.00 2.57 0.00 0.00 54.79 57.64 2pu0 n ASP 201 Cb 0.55 -0.23 0.20 0.00 1.84 0.00 0.00 41.12 43.48 2pu0 n ASP 201 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2pu0 n ALA 202 N -1.23 3.54 -0.25 2.24 0.00 -0.75 -4.45 120.51 119.61 2pu0 n ALA 202 Ca 0.07 -0.46 0.07 0.00 0.00 0.00 0.00 53.44 53.12 2pu0 n ALA 202 Cb 0.10 -1.02 0.19 0.00 0.00 0.00 0.00 19.45 18.72 2pu0 n ALA 202 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2pu0 n VAL 203 N -0.91 1.06 -1.04 0.00 0.24 -1.18 -3.43 118.33 113.07 2pu0 n VAL 203 Ca 0.09 -1.03 -0.30 0.00 -2.04 0.00 0.00 64.34 61.05 2pu0 n VAL 203 Cb 0.36 0.47 0.14 0.00 -1.47 0.00 0.00 33.84 33.34 2pu0 n VAL 203 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2pu0 s ASN 204 N -1.03 3.47 0.16 -1.34 0.01 -1.26 -4.85 114.94 110.10 2pu0 s ASN 204 Ca 0.29 1.78 0.08 0.00 -0.71 0.00 0.00 52.86 54.30 2pu0 s ASN 204 Cb 0.16 -2.40 -0.04 0.00 0.41 0.00 0.00 41.25 39.38 2pu0 s ASN 204 CO 0.19 -2.68 -0.07 0.68 -1.51 0.00 0.00 177.10 173.71 2pu0 s VAL 205 N -2.81 3.37 0.31 1.60 -7.23 -1.26 -2.05 120.40 112.32 2pu0 s VAL 205 Ca 0.64 -1.51 -0.05 0.00 -1.81 0.00 0.00 61.98 59.25 2pu0 s VAL 205 Cb -0.19 -2.66 0.07 0.00 0.56 0.00 0.00 36.38 34.16 2pu0 s VAL 205 CO 0.58 -0.06 0.42 0.61 -0.31 0.00 0.00 175.10 176.34 2pu0 n GLY 206 N 0.14 -0.93 0.28 2.32 0.00 0.22 -4.85 105.19 102.37 2pu0 n GLY 206 Ca -0.11 -1.73 0.06 0.00 0.00 0.00 0.00 46.02 44.23 2pu0 n GLY 206 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2pu0 h ASP 207 N -0.52 0.23 -0.72 1.61 3.32 -1.58 -2.07 116.42 116.68 2pu0 h ASP 207 Ca -0.14 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2pu0 h ASP 207 Cb 0.39 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2pu0 h ASP 207 CO 0.10 0.19 0.00 -0.62 -1.72 0.00 0.00 179.24 177.20 2pu0 n GLU 208 N -4.48 2.88 -0.53 3.56 1.02 -1.26 -4.93 120.64 116.90 2pu0 n GLU 208 Ca -0.00 -2.70 0.00 0.00 -0.02 0.00 0.00 57.16 54.44 2pu0 n GLU 208 Cb 0.10 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.91 2pu0 n GLU 208 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pu0 n GLY 209 N 1.58 0.94 3.82 0.62 0.00 -0.78 -1.67 105.19 109.70 2pu0 n GLY 209 Ca 0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 2pu0 n GLY 209 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2pu0 s GLY 210 N -1.66 1.65 0.40 -0.02 0.00 -1.21 -4.72 107.32 101.76 2pu0 s GLY 210 Ca 0.00 -0.07 -0.25 0.00 0.00 0.00 0.00 44.72 44.40 2pu0 s GLY 210 CO 0.00 0.29 1.19 -1.36 0.00 0.00 0.00 173.10 173.22 2pu0 s PHE 211 N -3.12 3.02 -0.71 1.90 0.08 0.93 -0.61 117.98 119.48 2pu0 s PHE 211 Ca 0.59 1.53 0.04 0.00 0.12 0.00 0.00 56.93 59.21 2pu0 s PHE 211 Cb -0.14 -3.44 0.29 0.00 -0.57 0.00 0.00 43.02 39.16 2pu0 s PHE 211 CO 0.54 -1.45 0.97 0.00 -0.10 0.00 0.00 175.22 175.19 2pu0 n ALA 212 N 0.08 4.52 -1.35 5.36 0.00 -0.87 -0.15 120.51 128.09 2pu0 n ALA 212 Ca 0.04 -4.75 -0.30 0.00 0.00 0.00 0.00 53.44 48.43 2pu0 n ALA 212 Cb 0.46 -1.14 0.11 0.00 0.00 0.00 0.00 19.45 18.88 2pu0 n ALA 212 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2pu0 s PRO 213 N -2.91 1.85 -1.41 0.00 0.04 -1.22 -4.81 135.00 126.54 2pu0 s PRO 213 Ca 0.41 0.84 -0.13 0.00 0.04 0.00 0.00 61.00 62.16 2pu0 s PRO 213 Cb 0.17 -1.87 0.07 0.00 0.04 0.00 0.00 34.50 32.91 2pu0 s PRO 213 CO -0.04 -1.84 2.14 -0.35 0.04 0.00 0.00 177.00 176.96 2pu0 n PRO 214 N -3.61 3.08 -4.66 0.56 -0.04 -1.26 -4.79 135.00 124.28 2pu0 n PRO 214 Ca 0.07 -2.86 -0.33 0.00 -0.04 0.00 0.00 63.50 60.34 2pu0 n PRO 214 Cb 0.55 -3.18 -0.12 0.00 -0.04 0.00 0.00 33.50 30.72 2pu0 n PRO 214 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2pu0 s ILE 215 N 2.38 3.57 -0.21 0.52 1.01 -1.26 -4.94 121.20 122.26 2pu0 s ILE 215 Ca 0.45 -0.56 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 2pu0 s ILE 215 Cb 0.13 -2.46 -0.10 0.00 0.01 0.00 0.00 42.46 40.04 2pu0 s ILE 215 CO -0.06 0.58 -0.24 1.17 0.00 0.00 0.00 174.94 176.39 2pu0 n LYS 216 N 2.18 0.46 -2.14 2.79 4.81 -1.26 -0.25 118.16 124.75 2pu0 n LYS 216 Ca -0.18 0.17 -0.42 0.00 -0.87 0.00 0.00 58.31 57.01 2pu0 n LYS 216 Cb 0.53 -1.30 -0.03 0.00 0.02 0.00 0.00 35.03 34.25 2pu0 n LYS 216 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2pu0 s ASP 217 N -6.57 6.79 0.50 3.14 2.15 -1.26 -4.22 116.67 117.20 2pu0 s ASP 217 Ca -0.29 2.31 0.31 0.00 0.43 0.00 0.00 52.55 55.32 2pu0 s ASP 217 Cb 0.10 -2.58 1.20 0.00 -0.30 0.00 0.00 42.92 41.34 2pu0 s ASP 217 CO 0.40 -0.71 1.91 0.16 -0.17 0.00 0.00 175.17 176.76 2pu0 h ILE 218 N 4.46 0.00 0.00 4.11 3.07 -1.95 -2.80 117.51 124.40 2pu0 h ILE 218 Ca -0.41 -0.54 -0.09 0.00 1.55 0.00 0.00 64.86 65.37 2pu0 h ILE 218 Cb 1.20 1.52 -0.01 0.00 -0.27 0.00 0.00 36.82 39.26 2pu0 h ILE 218 CO 0.88 0.00 -0.49 0.78 -1.05 0.00 0.00 178.15 178.28 2pu0 h ASN 219 N 0.00 0.00 -0.47 2.16 4.21 -2.02 -3.40 115.58 116.06 2pu0 h ASN 219 Ca 0.00 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.45 2pu0 h ASN 219 Cb 0.56 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.74 2pu0 h ASN 219 CO 0.00 0.40 0.07 -0.08 -1.29 0.00 0.00 177.43 176.53 2pu0 h GLU 220 N 0.00 0.84 0.00 0.81 4.81 -1.90 -2.27 114.58 116.88 2pu0 h GLU 220 Ca -0.01 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 59.00 2pu0 h GLU 220 Cb 1.32 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 2pu0 h GLU 220 CO 0.05 0.80 -0.07 -1.35 -0.73 0.00 0.00 179.01 177.71 2pu0 h PRO 221 N 0.80 0.00 -0.13 0.92 0.11 -1.77 -3.35 132.00 128.58 2pu0 h PRO 221 Ca 0.16 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 2pu0 h PRO 221 Cb 0.38 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 2pu0 h PRO 221 CO 0.01 0.07 0.05 -0.07 -0.21 0.00 0.00 178.00 177.84 2pu0 h LEU 222 N 0.00 0.18 -1.56 2.35 3.38 -1.70 -1.99 115.31 115.97 2pu0 h LEU 222 Ca -0.00 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2pu0 h LEU 222 Cb 0.20 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2pu0 h LEU 222 CO 0.01 0.32 0.26 -0.65 0.09 0.00 0.00 178.44 178.47 2pu0 h PRO 223 N 0.04 0.55 -0.44 1.13 0.11 -1.77 -2.51 132.00 129.12 2pu0 h PRO 223 Ca 0.04 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 2pu0 h PRO 223 Cb 0.20 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 2pu0 h PRO 223 CO -0.00 0.38 0.24 0.82 -0.21 0.00 0.00 178.00 179.23 2pu0 h ILE 224 N 0.57 1.16 -0.45 4.15 2.04 -1.65 -0.86 117.51 122.46 2pu0 h ILE 224 Ca 0.15 -0.40 0.04 0.00 1.00 0.00 0.00 64.86 65.65 2pu0 h ILE 224 Cb -0.04 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 2pu0 h ILE 224 CO -0.03 0.16 0.22 -0.07 0.00 0.00 0.00 178.15 178.44 2pu0 h LEU 225 N 0.58 0.32 -0.70 1.44 3.38 -0.99 -1.23 115.31 118.11 2pu0 h LEU 225 Ca 0.16 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 2pu0 h LEU 225 Cb 0.05 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2pu0 h LEU 225 CO -0.03 0.23 0.31 0.24 0.09 0.00 0.00 178.44 179.29 2pu0 h MET 226 N 0.45 1.03 -0.21 1.13 2.86 -1.21 -0.95 114.93 118.03 2pu0 h MET 226 Ca 0.19 -0.17 0.03 0.00 -2.06 0.00 0.00 59.70 57.69 2pu0 h MET 226 Cb 0.10 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 2pu0 h MET 226 CO -0.14 0.83 0.04 1.49 1.06 0.00 0.00 176.91 180.20 2pu0 h GLU 227 N 0.99 0.12 -0.41 1.72 4.81 -0.90 -0.95 114.58 119.96 2pu0 h GLU 227 Ca 0.24 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.47 2pu0 h GLU 227 Cb 0.16 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 2pu0 h GLU 227 CO -0.03 0.08 0.26 0.00 -0.73 0.00 0.00 179.01 178.60 2pu0 h ALA 228 N 1.15 0.52 -0.51 2.92 0.00 -1.00 0.18 119.26 122.52 2pu0 h ALA 228 Ca 0.09 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.05 2pu0 h ALA 228 Cb 0.09 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 2pu0 h ALA 228 CO -0.12 -0.04 0.18 0.82 0.00 0.00 0.00 179.25 180.08 2pu0 h ILE 229 N 0.54 0.81 -0.07 0.00 2.04 -0.96 -1.36 117.51 118.51 2pu0 h ILE 229 Ca 0.15 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 2pu0 h ILE 229 Cb -0.04 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.47 2pu0 h ILE 229 CO -0.04 0.06 0.01 -0.08 0.00 0.00 0.00 178.15 178.10 2pu0 h GLU 230 N 0.35 0.12 -0.57 2.37 4.57 -0.75 -1.66 114.58 119.00 2pu0 h GLU 230 Ca 0.25 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.36 2pu0 h GLU 230 Cb 0.28 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 2pu0 h GLU 230 CO -0.26 0.35 0.21 1.49 -1.18 0.00 0.00 179.01 179.62 2pu0 h GLU 231 N -0.13 0.84 0.00 1.92 4.81 -0.44 -1.75 114.58 119.82 2pu0 h GLU 231 Ca 0.02 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2pu0 h GLU 231 Cb 0.29 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.52 2pu0 h GLU 231 CO 0.00 0.71 0.00 0.00 -0.73 0.00 0.00 179.01 178.99 2pu0 n ALA 232 N -2.45 1.86 -0.60 2.92 0.00 -0.53 -4.88 120.51 116.83 2pu0 n ALA 232 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2pu0 n ALA 232 Cb 0.18 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.36 2pu0 n ALA 232 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pu0 n GLY 233 N 0.11 0.65 0.87 0.00 0.00 -0.66 -4.91 105.19 101.26 2pu0 n GLY 233 Ca 0.07 -0.46 0.01 0.00 0.00 0.00 0.00 46.02 45.63 2pu0 n GLY 233 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2pu0 n HIS 234 N -2.60 0.52 -1.57 1.61 8.25 -0.63 -5.04 115.22 115.76 2pu0 n HIS 234 Ca 0.00 -1.59 -0.53 0.00 -0.26 0.00 0.00 57.72 55.34 2pu0 n HIS 234 Cb 0.00 -0.35 -0.06 0.00 1.12 0.00 0.00 29.99 30.70 2pu0 n HIS 234 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2pu0 n ARG 235 N -1.10 0.94 0.00 -0.41 0.63 -1.23 -1.69 116.66 113.80 2pu0 n ARG 235 Ca 0.25 0.34 0.00 0.00 -0.92 0.00 0.00 57.85 57.52 2pu0 n ARG 235 Cb 0.82 -1.95 0.00 0.00 0.45 0.00 0.00 32.46 31.78 2pu0 n ARG 235 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2pu0 n GLY 236 N 2.33 2.32 0.06 5.14 0.00 -1.26 -4.86 105.19 108.92 2pu0 n GLY 236 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 2pu0 n GLY 236 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2pu0 n LYS 237 N -2.00 0.28 -4.33 1.61 4.76 -0.68 -4.85 118.16 112.95 2pu0 n LYS 237 Ca 0.00 0.07 -0.29 0.00 -2.87 0.00 0.00 58.31 55.23 2pu0 n LYS 237 Cb 0.00 -1.67 -0.11 0.00 -1.84 0.00 0.00 35.03 31.41 2pu0 n LYS 237 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2pu0 s PHE 238 N -3.17 2.48 0.41 2.13 0.08 -1.26 -1.60 117.98 117.06 2pu0 s PHE 238 Ca 0.06 -0.29 0.07 0.00 0.12 0.00 0.00 56.93 56.89 2pu0 s PHE 238 Cb 0.14 -1.30 -0.08 0.00 -0.57 0.00 0.00 43.02 41.21 2pu0 s PHE 238 CO 0.73 0.41 0.02 0.00 -0.10 0.00 0.00 175.22 176.28 2pu0 s ALA 239 N -1.26 3.20 -0.02 5.36 0.00 0.36 -4.88 121.76 124.53 2pu0 s ALA 239 Ca 0.18 -2.29 0.04 0.00 0.00 0.00 0.00 51.96 49.90 2pu0 s ALA 239 Cb -0.10 0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.13 2pu0 s ALA 239 CO 0.10 -0.12 -0.11 0.42 0.00 0.00 0.00 175.76 176.04 2pu0 s ILE 240 N -2.71 3.31 0.00 0.00 1.01 0.88 -0.94 121.20 122.75 2pu0 s ILE 240 Ca 0.35 -0.79 0.06 0.00 0.00 0.00 0.00 60.65 60.28 2pu0 s ILE 240 Cb 0.10 -2.37 -0.02 0.00 0.01 0.00 0.00 42.46 40.18 2pu0 s ILE 240 CO 0.18 0.48 -0.20 0.00 0.00 0.00 0.00 174.94 175.40 2pu0 s MET 242 N -0.65 2.13 -0.26 0.00 -1.94 0.71 -0.53 119.30 118.76 2pu0 s MET 242 Ca 0.07 -0.96 0.01 0.00 -1.71 0.00 0.00 55.69 53.11 2pu0 s MET 242 Cb -0.08 -2.23 0.07 0.00 2.01 0.00 0.00 34.83 34.61 2pu0 s MET 242 CO -0.00 0.54 -0.01 0.34 -0.01 0.00 0.00 175.02 175.89 2pu0 s ASP 243 N -1.48 3.97 0.23 3.03 2.15 -0.30 -0.92 116.67 123.35 2pu0 s ASP 243 Ca 0.15 -1.39 0.11 0.00 0.43 0.00 0.00 52.55 51.85 2pu0 s ASP 243 Cb -0.11 -1.16 0.18 0.00 -0.30 0.00 0.00 42.92 41.54 2pu0 s ASP 243 CO 0.06 -0.29 1.50 0.00 -0.17 0.00 0.00 175.17 176.27 2pu0 n ALA 245 N -2.37 -2.17 0.29 0.00 0.00 -1.22 -3.25 120.51 111.78 2pu0 n ALA 245 Ca -0.00 -0.38 0.18 0.00 0.00 0.00 0.00 53.44 53.23 2pu0 n ALA 245 Cb 0.72 -1.68 0.76 0.00 0.00 0.00 0.00 19.45 19.26 2pu0 n ALA 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pu0 h ALA 246 N 0.96 1.01 -0.97 0.00 0.00 -1.65 -2.11 119.26 116.50 2pu0 h ALA 246 Ca -0.66 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.32 2pu0 h ALA 246 Cb 1.39 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 19.11 2pu0 h ALA 246 CO 0.62 0.01 0.61 0.77 0.00 0.00 0.00 179.25 181.27 2pu0 h SER 247 N 0.00 0.95 -0.00 0.00 0.02 -1.84 -2.03 113.55 110.65 2pu0 h SER 247 Ca -0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2pu0 h SER 247 Cb 0.44 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 2pu0 h SER 247 CO 0.00 0.57 0.01 -0.33 -1.14 0.00 0.00 176.83 175.94 2pu0 h GLU 248 N 1.06 0.00 0.00 3.45 4.39 -1.74 -1.94 114.58 119.80 2pu0 h GLU 248 Ca 0.44 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.14 2pu0 h GLU 248 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2pu0 h GLU 248 CO -0.21 0.00 -1.01 0.25 -1.16 0.00 0.00 179.01 176.88 2pu0 n THR 249 N -3.10 0.00 -2.75 1.13 -2.24 -0.78 -5.01 114.28 101.53 2pu0 n THR 249 Ca -0.03 -0.10 -0.41 0.00 -2.27 0.00 0.00 64.05 61.24 2pu0 n THR 249 Cb 0.08 0.89 -0.05 0.00 -2.10 0.00 0.00 70.33 69.15 2pu0 n THR 249 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2pu0 s TYR 250 N -2.85 3.86 -0.29 4.78 5.04 -0.73 -0.26 117.35 126.90 2pu0 s TYR 250 Ca 0.05 1.82 -0.05 0.00 -2.44 0.00 0.00 57.07 56.46 2pu0 s TYR 250 Cb 0.14 -3.02 0.02 0.00 0.35 0.00 0.00 41.96 39.45 2pu0 s TYR 250 CO 0.78 0.29 0.04 0.34 -1.34 0.00 0.00 175.55 175.65 2pu0 s ASP 251 N -0.37 4.92 0.22 4.32 2.15 -0.36 -4.95 116.67 122.61 2pu0 s ASP 251 Ca 0.45 -0.91 -0.08 0.00 0.43 0.00 0.00 52.55 52.44 2pu0 s ASP 251 Cb -0.24 -1.80 0.26 0.00 -0.30 0.00 0.00 42.92 40.84 2pu0 s ASP 251 CO 0.30 -0.21 1.83 -0.08 -0.17 0.00 0.00 175.17 176.85 2pu0 h GLU 252 N 8.14 0.81 -0.41 4.34 4.81 -1.96 0.39 114.58 130.70 2pu0 h GLU 252 Ca -0.29 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 58.75 2pu0 h GLU 252 Cb 1.10 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 2pu0 h GLU 252 CO 0.59 0.54 -0.30 1.57 -0.73 0.00 0.00 179.01 180.68 2pu0 h LYS 253 N 0.84 0.92 0.00 1.92 2.10 -1.96 -3.19 116.57 117.19 2pu0 h LYS 253 Ca 0.32 -0.45 -0.06 0.00 -2.00 0.00 0.00 60.65 58.46 2pu0 h LYS 253 Cb 0.14 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.45 2pu0 h LYS 253 CO -0.16 1.10 -0.61 -0.22 -2.00 0.00 0.00 179.45 177.57 2pu0 h LYS 254 N 0.75 0.00 -5.84 0.07 3.64 -1.95 -3.48 116.57 109.77 2pu0 h LYS 254 Ca 0.08 0.00 -0.39 0.00 -1.27 0.00 0.00 60.65 59.07 2pu0 h LYS 254 Cb 0.88 0.00 0.13 0.00 -0.41 0.00 0.00 32.23 32.84 2pu0 h LYS 254 CO 0.08 0.21 -0.71 1.04 -2.27 0.00 0.00 179.45 177.80 2pu0 n GLN 255 N -3.02 -7.49 -3.99 1.90 6.02 0.13 -5.00 117.38 105.94 2pu0 n GLN 255 Ca 0.00 0.82 -0.10 0.00 -0.01 0.00 0.00 57.00 57.71 2pu0 n GLN 255 Cb 0.65 -5.85 -0.07 0.00 1.02 0.00 0.00 30.24 25.99 2pu0 n GLN 255 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2pu0 s GLN 256 N -6.11 1.12 -0.11 -1.09 -0.21 -1.20 -4.69 119.66 107.37 2pu0 s GLN 256 Ca 0.45 -1.21 -0.01 0.00 0.02 0.00 0.00 55.36 54.60 2pu0 s GLN 256 Cb -0.20 0.36 -0.03 0.00 1.00 0.00 0.00 33.01 34.14 2pu0 s GLN 256 CO 0.74 -0.40 -0.07 0.71 -2.12 0.00 0.00 175.29 174.15 2pu0 s TYR 257 N -3.98 2.95 -0.66 0.91 2.02 0.17 -1.23 117.35 117.54 2pu0 s TYR 257 Ca 0.18 -0.23 -0.18 0.00 -0.37 0.00 0.00 57.07 56.48 2pu0 s TYR 257 Cb 0.04 -1.83 0.12 0.00 -0.40 0.00 0.00 41.96 39.89 2pu0 s TYR 257 CO 0.00 0.09 0.74 1.21 -1.57 0.00 0.00 175.55 176.02 2pu0 s ASN 258 N -0.14 6.31 0.00 2.29 3.04 0.64 -0.67 114.94 126.42 2pu0 s ASN 258 Ca 0.02 -1.71 0.16 0.00 0.04 0.00 0.00 52.86 51.37 2pu0 s ASN 258 Cb -0.13 -2.29 0.97 0.00 -1.54 0.00 0.00 41.25 38.26 2pu0 s ASN 258 CO 0.03 -1.01 1.38 0.18 -3.04 0.00 0.00 177.10 174.64 2pu0 n LEU 259 N 5.93 0.00 -2.71 3.21 4.77 -0.21 -3.05 117.00 124.94 2pu0 n LEU 259 Ca -0.03 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.89 2pu0 n LEU 259 Cb 0.44 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.56 2pu0 n LEU 259 CO 0.54 0.00 -0.05 1.07 -1.33 0.00 0.00 177.39 177.61 2pu0 n THR 260 N -0.98 1.20 0.34 -5.08 5.66 -1.26 -4.34 114.28 109.82 2pu0 n THR 260 Ca 0.12 -3.09 0.14 0.00 -3.05 0.00 0.00 64.05 58.17 2pu0 n THR 260 Cb 0.06 0.83 0.59 0.00 -1.55 0.00 0.00 70.33 70.25 2pu0 n THR 260 CO 0.00 0.00 0.00 2.19 -3.05 0.00 0.00 175.07 174.21 2pu0 h PHE 261 N 2.79 0.00 -0.57 1.09 -5.15 -1.85 -2.08 116.94 111.18 2pu0 h PHE 261 Ca -0.09 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.68 2pu0 h PHE 261 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.39 2pu0 h PHE 261 CO 0.52 0.00 0.00 1.63 -2.00 0.00 0.00 178.31 178.46 2pu0 n LYS 262 N -2.53 4.03 -4.35 6.09 5.02 -1.26 -4.95 118.16 120.21 2pu0 n LYS 262 Ca 0.01 -2.95 -0.21 0.00 -2.02 0.00 0.00 58.31 53.14 2pu0 n LYS 262 Cb 0.23 -1.99 -0.11 0.00 -0.02 0.00 0.00 35.03 33.14 2pu0 n LYS 262 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2pu0 s SER 263 N -0.98 2.73 0.30 4.39 0.01 -0.78 -4.87 113.70 114.50 2pu0 s SER 263 Ca 0.51 -0.91 0.03 0.00 1.31 0.00 0.00 55.95 56.88 2pu0 s SER 263 Cb 0.35 -0.16 0.63 0.00 0.21 0.00 0.00 66.02 67.05 2pu0 s SER 263 CO 0.20 -0.06 1.83 -0.65 0.41 0.00 0.00 173.24 174.97 2pu0 h PRO 264 N 3.00 0.88 -6.45 12.44 0.11 -1.92 -3.42 132.00 136.63 2pu0 h PRO 264 Ca -0.41 -0.05 -0.67 0.00 0.11 0.00 0.00 66.00 64.98 2pu0 h PRO 264 Cb 1.21 -0.20 -0.16 0.00 0.11 0.00 0.00 31.00 31.97 2pu0 h PRO 264 CO 0.54 0.58 -0.72 -1.21 -0.21 0.00 0.00 178.00 176.98 2pu0 s GLU 265 N -5.90 2.30 0.21 1.05 0.41 -1.26 -5.13 118.70 110.38 2pu0 s GLU 265 Ca -0.11 -0.91 -0.08 0.00 -0.41 0.00 0.00 54.97 53.45 2pu0 s GLU 265 Cb 0.23 -2.38 -0.07 0.00 -1.78 0.00 0.00 34.13 30.13 2pu0 s GLU 265 CO 0.80 0.54 0.51 -1.25 -0.49 0.00 0.00 175.26 175.37 2pu0 s PRO 266 N -1.96 3.75 -0.42 0.39 0.04 -1.26 -4.79 135.00 130.75 2pu0 s PRO 266 Ca 0.20 0.18 0.01 0.00 0.04 0.00 0.00 61.00 61.43 2pu0 s PRO 266 Cb -0.11 -2.69 0.11 0.00 0.04 0.00 0.00 34.50 31.85 2pu0 s PRO 266 CO 0.12 0.35 0.17 0.99 0.04 0.00 0.00 177.00 178.67 2pu0 s THR 267 N -1.79 2.75 0.01 1.26 2.01 -1.26 -4.95 115.64 113.67 2pu0 s THR 267 Ca 0.46 -2.53 -0.30 0.00 0.31 0.00 0.00 61.69 59.63 2pu0 s THR 267 Cb -0.11 -2.94 -0.04 0.00 0.01 0.00 0.00 72.50 69.42 2pu0 s THR 267 CO 0.22 -0.69 1.02 0.26 -0.69 0.00 0.00 174.62 174.74 2pu0 s TRP 268 N 0.63 3.62 -0.01 4.92 0.52 -1.26 -1.04 118.94 126.31 2pu0 s TRP 268 Ca 0.12 1.62 0.01 0.00 0.02 0.00 0.00 56.10 57.87 2pu0 s TRP 268 Cb -0.21 -3.18 0.01 0.00 -1.15 0.00 0.00 33.47 28.93 2pu0 s TRP 268 CO -0.05 -0.26 -0.03 0.54 0.02 0.00 0.00 176.95 177.17 2pu0 s VAL 269 N 1.03 0.29 0.70 4.03 0.11 0.16 -4.95 120.40 121.76 2pu0 s VAL 269 Ca 0.53 -0.10 -0.09 0.00 -2.93 0.00 0.00 61.98 59.40 2pu0 s VAL 269 Cb -0.23 -0.29 0.04 0.00 -1.53 0.00 0.00 36.38 34.38 2pu0 s VAL 269 CO 0.28 0.11 1.04 0.42 -3.33 0.00 0.00 175.10 173.63 2pu0 s THR 270 N 0.28 2.86 0.39 5.04 -4.23 -1.26 0.46 115.64 119.18 2pu0 s THR 270 Ca -0.03 0.04 0.08 0.00 -1.18 0.00 0.00 61.69 60.60 2pu0 s THR 270 Cb -0.06 -3.23 0.20 0.00 1.34 0.00 0.00 72.50 70.75 2pu0 s THR 270 CO -0.01 -0.27 1.96 0.00 -0.54 0.00 0.00 174.62 175.76 2pu0 h ALA 271 N -0.60 1.56 -0.37 3.99 0.00 -1.97 -1.93 119.26 119.94 2pu0 h ALA 271 Ca -0.45 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.17 2pu0 h ALA 271 Cb 1.29 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2pu0 h ALA 271 CO 0.62 0.33 -0.36 1.49 0.00 0.00 0.00 179.25 181.33 2pu0 h GLU 272 N 0.37 0.85 -0.39 0.00 4.57 -1.98 -1.62 114.58 116.38 2pu0 h GLU 272 Ca 0.09 -0.43 -0.01 0.00 -1.18 0.00 0.00 59.36 57.83 2pu0 h GLU 272 Cb 0.22 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.79 2pu0 h GLU 272 CO 0.00 1.07 0.19 1.96 -1.18 0.00 0.00 179.01 181.05 2pu0 h GLN 273 N 0.70 0.53 -0.32 1.92 4.20 -1.85 -2.67 115.11 117.62 2pu0 h GLN 273 Ca 0.07 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.62 2pu0 h GLN 273 Cb 0.92 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 2pu0 h GLN 273 CO 0.09 0.42 -0.18 -0.07 -0.67 0.00 0.00 178.83 178.42 2pu0 h LEU 274 N 0.54 0.72 -0.84 1.46 4.07 -1.14 -2.95 115.31 117.16 2pu0 h LEU 274 Ca 0.14 -0.42 -0.05 0.00 0.08 0.00 0.00 57.88 57.63 2pu0 h LEU 274 Cb 0.06 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 41.57 2pu0 h LEU 274 CO -0.02 0.98 0.25 -0.09 -1.08 0.00 0.00 178.44 178.48 2pu0 h ARG 275 N 0.46 1.11 -0.80 1.13 2.43 -1.00 0.42 114.38 118.13 2pu0 h ARG 275 Ca 0.07 -0.22 0.03 0.00 -0.81 0.00 0.00 59.98 59.05 2pu0 h ARG 275 Cb 0.72 -0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 30.04 2pu0 h ARG 275 CO 0.05 0.93 0.51 0.93 -1.51 0.00 0.00 179.97 180.88 2pu0 h GLU 276 N 1.07 0.96 -0.18 0.20 5.08 -1.56 -0.14 114.58 120.02 2pu0 h GLU 276 Ca 0.24 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 2pu0 h GLU 276 Cb 0.26 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2pu0 h GLU 276 CO -0.01 0.64 0.03 1.15 -1.00 0.00 0.00 179.01 179.81 2pu0 h THR 277 N 0.99 1.22 -0.52 1.13 2.02 -1.16 -1.89 112.91 114.71 2pu0 h THR 277 Ca 0.32 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 2pu0 h THR 277 Cb 0.02 1.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 2pu0 h THR 277 CO -0.11 0.22 0.29 1.88 0.37 0.00 0.00 175.52 178.17 2pu0 h TYR 278 N 0.08 0.70 -0.76 3.16 0.05 -0.66 0.33 116.97 119.87 2pu0 h TYR 278 Ca 0.05 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.80 2pu0 h TYR 278 Cb 0.31 -0.23 -0.04 0.00 1.01 0.00 0.00 36.73 37.79 2pu0 h TYR 278 CO 0.02 0.50 0.40 0.00 -1.05 0.00 0.00 178.16 178.04 2pu0 h LYS 280 N 1.06 0.18 -0.45 0.00 3.64 -0.92 -1.92 116.57 118.17 2pu0 h LYS 280 Ca 0.27 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.71 2pu0 h LYS 280 Cb 0.06 -0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 31.76 2pu0 h LYS 280 CO -0.04 0.27 -0.20 -1.49 -2.27 0.00 0.00 179.45 175.73 2pu0 h TRP 281 N 0.05 -0.50 0.00 1.91 4.06 -0.80 0.12 115.95 120.79 2pu0 h TRP 281 Ca 0.04 0.05 -0.07 0.00 2.06 0.00 0.00 58.89 60.97 2pu0 h TRP 281 Cb 0.16 0.29 -0.01 0.00 -1.00 0.00 0.00 29.16 28.60 2pu0 h TRP 281 CO -0.02 -0.28 -0.34 0.00 -3.56 0.00 0.00 178.44 174.23 2pu0 h ALA 282 N 1.21 1.36 0.16 1.49 0.00 -1.09 -1.48 119.26 120.91 2pu0 h ALA 282 Ca 0.21 -0.31 -0.26 0.00 0.00 0.00 0.00 54.91 54.55 2pu0 h ALA 282 Cb 0.44 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.20 2pu0 h ALA 282 CO -0.52 0.43 -1.12 1.25 0.00 0.00 0.00 179.25 179.30 2pu0 h HIS 283 N 0.00 0.82 0.00 0.00 -0.00 -0.88 -3.38 115.15 111.70 2pu0 h HIS 283 Ca -0.00 -0.56 -0.05 0.00 -0.00 0.00 0.00 60.37 59.76 2pu0 h HIS 283 Cb 0.64 -0.05 -0.01 0.00 -0.00 0.00 0.00 27.41 27.99 2pu0 h HIS 283 CO 0.00 1.42 -0.27 -0.44 -0.00 0.00 0.00 177.93 178.64 2pu0 h ASP 284 N -0.01 0.00 -4.79 3.26 3.32 -0.42 -3.47 116.42 114.31 2pu0 h ASP 284 Ca -0.19 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.67 2pu0 h ASP 284 Cb 1.85 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 41.25 2pu0 h ASP 284 CO 0.21 0.23 -0.69 -0.31 -1.72 0.00 0.00 179.24 176.96 2pu0 s TYR 285 N -3.10 0.78 -1.50 4.55 2.02 -0.59 -5.04 117.35 114.47 2pu0 s TYR 285 Ca 0.05 -0.95 -0.12 0.00 -0.37 0.00 0.00 57.07 55.68 2pu0 s TYR 285 Cb 0.06 -0.48 -0.02 0.00 -0.40 0.00 0.00 41.96 41.12 2pu0 s TYR 285 CO 0.71 -0.22 2.53 -0.35 -1.57 0.00 0.00 175.55 176.65 2pu0 n PRO 286 N 0.03 3.15 -2.81 -1.71 -0.04 -1.26 -4.56 135.00 127.79 2pu0 n PRO 286 Ca -0.13 -2.38 -0.43 0.00 -0.04 0.00 0.00 63.50 60.52 2pu0 n PRO 286 Cb 0.61 -3.05 -0.04 0.00 -0.04 0.00 0.00 33.50 30.98 2pu0 n PRO 286 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2pu0 s ILE 287 N 2.82 4.45 -1.59 0.52 1.01 -1.26 -0.09 121.20 127.07 2pu0 s ILE 287 Ca 0.57 0.71 0.20 0.00 0.00 0.00 0.00 60.65 62.13 2pu0 s ILE 287 Cb 0.16 -4.45 -0.07 0.00 0.01 0.00 0.00 42.46 38.10 2pu0 s ILE 287 CO -0.07 -0.88 0.96 1.33 0.00 0.00 0.00 174.94 176.29 2pu0 n VAL 288 N 6.42 0.00 -3.67 2.92 0.24 -0.04 -4.57 118.33 119.62 2pu0 n VAL 288 Ca 0.06 -0.21 -0.09 0.00 -2.04 0.00 0.00 64.34 62.07 2pu0 n VAL 288 Cb 0.48 1.17 -0.09 0.00 -1.47 0.00 0.00 33.84 33.93 2pu0 n VAL 288 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2pu0 s SER 289 N -2.47 -0.62 -0.12 -1.34 0.15 -1.23 -1.49 113.70 106.56 2pu0 s SER 289 Ca 0.14 1.12 0.00 0.00 0.70 0.00 0.00 55.95 57.91 2pu0 s SER 289 Cb 0.16 1.14 0.02 0.00 -1.71 0.00 0.00 66.02 65.63 2pu0 s SER 289 CO 0.61 -0.21 -0.11 -0.63 1.20 0.00 0.00 173.24 174.10 2pu0 s ILE 290 N 1.78 1.27 -0.12 6.45 1.01 -0.62 -0.20 121.20 130.77 2pu0 s ILE 290 Ca -0.08 -0.46 -0.05 0.00 0.00 0.00 0.00 60.65 60.07 2pu0 s ILE 290 Cb -0.08 -1.23 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 2pu0 s ILE 290 CO -0.15 0.41 0.06 -0.70 0.00 0.00 0.00 174.94 174.56 2pu0 s GLU 291 N 1.50 3.33 -1.31 2.79 2.12 -0.10 -1.09 118.70 125.93 2pu0 s GLU 291 Ca 0.03 -0.30 -0.19 0.00 0.36 0.00 0.00 54.97 54.87 2pu0 s GLU 291 Cb -0.13 -3.01 0.02 0.00 0.26 0.00 0.00 34.13 31.27 2pu0 s GLU 291 CO -0.08 0.65 0.50 -0.25 -0.54 0.00 0.00 175.26 175.55 2pu0 n ASP 292 N 2.35 -2.58 0.25 -1.70 8.00 -0.20 -1.60 116.55 121.06 2pu0 n ASP 292 Ca -0.19 -1.20 0.17 0.00 0.71 0.00 0.00 54.79 54.28 2pu0 n ASP 292 Cb 0.54 -2.18 0.77 0.00 -0.02 0.00 0.00 41.12 40.23 2pu0 n ASP 292 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2pu0 h PRO 293 N -2.19 0.00 -5.00 -0.24 0.13 -1.85 -2.49 132.00 120.36 2pu0 h PRO 293 Ca -0.68 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.03 2pu0 h PRO 293 Cb 1.39 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.38 2pu0 h PRO 293 CO 0.57 0.00 -0.59 0.71 -0.23 0.00 0.00 178.00 178.46 2pu0 s TYR 294 N -3.70 1.70 0.66 1.56 2.02 -1.26 -4.76 117.35 113.57 2pu0 s TYR 294 Ca -0.00 -1.17 -0.17 0.00 -0.37 0.00 0.00 57.07 55.36 2pu0 s TYR 294 Cb 0.10 -1.03 -0.03 0.00 -0.40 0.00 0.00 41.96 40.59 2pu0 s TYR 294 CO 0.45 -0.27 0.86 -3.47 -1.57 0.00 0.00 175.55 171.55 2pu0 n ASP 295 N -0.73 0.21 0.19 2.29 -0.08 -1.26 -4.22 116.55 112.95 2pu0 n ASP 295 Ca -0.01 0.72 0.14 0.00 -1.51 0.00 0.00 54.79 54.12 2pu0 n ASP 295 Cb 0.66 -1.35 0.66 0.00 2.34 0.00 0.00 41.12 43.43 2pu0 n ASP 295 CO 0.00 0.00 0.00 0.06 0.12 0.00 0.00 177.20 177.38 2pu0 h GLN 296 N 0.08 0.00 -0.17 -0.67 3.07 -1.94 -0.41 115.11 115.08 2pu0 h GLN 296 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.27 2pu0 h GLN 296 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.92 2pu0 h GLN 296 CO 0.48 0.00 0.00 -0.25 0.09 0.00 0.00 178.83 179.15 2pu0 n ASP 297 N -2.45 2.35 -4.22 0.06 10.43 -1.26 -4.26 116.55 117.21 2pu0 n ASP 297 Ca -0.00 -1.79 -0.43 0.00 2.57 0.00 0.00 54.79 55.13 2pu0 n ASP 297 Cb 0.12 -0.11 0.00 0.00 1.84 0.00 0.00 41.12 42.97 2pu0 n ASP 297 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 2pu0 n ASP 298 N 0.30 4.80 -0.02 -2.24 4.64 -0.16 -4.74 116.55 119.12 2pu0 n ASP 298 Ca 0.07 -2.95 -0.04 0.00 -1.38 0.00 0.00 54.79 50.49 2pu0 n ASP 298 Cb 0.32 -1.63 0.20 0.00 -1.04 0.00 0.00 41.12 38.97 2pu0 n ASP 298 CO 0.00 0.00 0.00 -0.26 -0.82 0.00 0.00 177.20 176.12 2pu0 h PHE 299 N 6.74 0.63 -0.44 -0.67 0.04 -1.89 -2.16 116.94 119.18 2pu0 h PHE 299 Ca 0.43 -0.12 -0.14 0.00 2.80 0.00 0.00 57.97 60.94 2pu0 h PHE 299 Cb 0.77 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 38.75 2pu0 h PHE 299 CO 1.32 0.71 -0.28 0.00 -0.60 0.00 0.00 178.31 179.46 2pu0 h ALA 300 N 1.30 0.63 0.03 2.45 0.00 -1.95 -1.19 119.26 120.54 2pu0 h ALA 300 Ca 0.09 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2pu0 h ALA 300 Cb 0.59 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2pu0 h ALA 300 CO 0.04 0.67 -0.01 0.78 0.00 0.00 0.00 179.25 180.73 2pu0 h GLY 301 N 0.82 -0.04 -0.03 0.00 0.00 -1.93 -1.57 103.07 100.32 2pu0 h GLY 301 Ca 0.09 0.01 0.08 0.00 0.00 0.00 0.00 47.33 47.52 2pu0 h GLY 301 CO 0.08 -0.01 -0.22 0.74 0.00 0.00 0.00 176.54 177.12 2pu0 h PHE 302 N -0.26 -0.57 -0.59 5.60 0.04 -1.35 -2.35 116.94 117.46 2pu0 h PHE 302 Ca -0.00 0.05 0.04 0.00 2.80 0.00 0.00 57.97 60.85 2pu0 h PHE 302 Cb 0.24 0.31 -0.04 0.00 2.20 0.00 0.00 35.95 38.66 2pu0 h PHE 302 CO -0.00 -0.30 0.34 0.00 -0.60 0.00 0.00 178.31 177.75 2pu0 h ALA 303 N 1.08 0.76 -0.38 2.45 0.00 -1.07 -0.85 119.26 121.25 2pu0 h ALA 303 Ca 0.19 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2pu0 h ALA 303 Cb 0.45 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2pu0 h ALA 303 CO -0.49 0.04 0.15 0.78 0.00 0.00 0.00 179.25 179.73 2pu0 h GLY 304 N 0.66 0.50 1.77 0.00 0.00 -0.91 -1.71 103.07 103.37 2pu0 h GLY 304 Ca 0.25 -0.09 -0.17 0.00 0.00 0.00 0.00 47.33 47.32 2pu0 h GLY 304 CO -0.13 0.05 -0.71 1.19 0.00 0.00 0.00 176.54 176.94 2pu0 h ILE 305 N 0.32 1.43 -0.36 2.60 6.09 -1.19 -1.60 117.51 124.80 2pu0 h ILE 305 Ca 0.17 -2.23 -0.00 0.00 -1.37 0.00 0.00 64.86 61.43 2pu0 h ILE 305 Cb 0.13 2.18 -0.02 0.00 0.47 0.00 0.00 36.82 39.58 2pu0 h ILE 305 CO -0.16 0.65 0.21 0.74 -3.07 0.00 0.00 178.15 176.53 2pu0 h THR 306 N 0.15 1.13 -0.28 2.19 2.02 -0.97 -1.24 112.91 115.91 2pu0 h THR 306 Ca -0.02 -0.31 -0.17 0.00 0.77 0.00 0.00 66.41 66.69 2pu0 h THR 306 Cb 1.26 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 68.35 2pu0 h THR 306 CO 0.11 0.13 -0.48 -0.08 0.37 0.00 0.00 175.52 175.57 2pu0 h GLU 307 N 0.47 0.81 -0.90 6.66 4.57 -1.29 -1.39 114.58 123.50 2pu0 h GLU 307 Ca 0.13 -0.50 -0.02 0.00 -1.18 0.00 0.00 59.36 57.79 2pu0 h GLU 307 Cb 0.02 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.62 2pu0 h GLU 307 CO -0.02 1.13 0.50 0.00 -1.18 0.00 0.00 179.01 179.44 2pu0 h ALA 308 N 0.67 1.17 -0.64 2.92 0.00 -1.13 -3.04 119.26 119.22 2pu0 h ALA 308 Ca 0.02 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2pu0 h ALA 308 Cb 1.08 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2pu0 h ALA 308 CO 0.11 0.67 0.00 1.28 0.00 0.00 0.00 179.25 181.30 2pu0 n LEU 309 N -4.33 3.82 -4.62 0.00 4.77 -0.48 -5.00 117.00 111.16 2pu0 n LEU 309 Ca 0.10 -1.87 -0.63 0.00 -0.03 0.00 0.00 56.01 53.58 2pu0 n LEU 309 Cb 0.10 -0.42 -0.09 0.00 -2.33 0.00 0.00 43.42 40.68 2pu0 n LEU 309 CO 0.39 0.92 0.87 1.17 -1.33 0.00 0.00 177.39 179.41 2pu0 n LYS 310 N 1.59 0.09 0.00 3.23 4.81 -0.53 -0.76 118.16 126.60 2pu0 n LYS 310 Ca 0.23 0.03 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 2pu0 n LYS 310 Cb 0.62 -1.55 0.00 0.00 0.02 0.00 0.00 35.03 34.12 2pu0 n LYS 310 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2pu0 n GLY 311 N 2.74 2.71 0.41 3.14 0.00 -1.26 -4.77 105.19 108.16 2pu0 n GLY 311 Ca 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.19 2pu0 n GLY 311 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2pu0 n LYS 312 N -2.00 0.21 -3.69 1.61 5.02 0.06 -5.03 118.16 114.34 2pu0 n LYS 312 Ca 0.00 0.07 -0.21 0.00 -2.02 0.00 0.00 58.31 56.15 2pu0 n LYS 312 Cb 0.00 -0.99 -0.18 0.00 -0.02 0.00 0.00 35.03 33.84 2pu0 n LYS 312 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2pu0 s THR 313 N -2.17 0.01 0.41 -0.18 2.01 -0.40 -4.62 115.64 110.71 2pu0 s THR 313 Ca -0.13 0.29 -0.25 0.00 0.31 0.00 0.00 61.69 61.92 2pu0 s THR 313 Cb 0.04 -0.29 -0.08 0.00 0.01 0.00 0.00 72.50 72.18 2pu0 s THR 313 CO 0.18 0.15 1.16 0.00 -0.69 0.00 0.00 174.62 175.42 2pu0 s GLN 314 N 2.12 4.00 -0.26 4.92 -2.07 -0.56 -4.49 119.66 123.31 2pu0 s GLN 314 Ca 0.05 1.79 -0.07 0.00 -1.82 0.00 0.00 55.36 55.31 2pu0 s GLN 314 Cb -0.13 -2.60 -0.02 0.00 -1.09 0.00 0.00 33.01 29.18 2pu0 s GLN 314 CO -0.04 -0.36 0.07 0.42 -1.32 0.00 0.00 175.29 174.06 2pu0 s ILE 315 N -1.47 4.20 -0.26 3.63 -1.09 -1.26 -1.60 121.20 123.35 2pu0 s ILE 315 Ca 0.59 -0.29 -0.10 0.00 -2.23 0.00 0.00 60.65 58.62 2pu0 s ILE 315 Cb -0.29 -3.00 -0.04 0.00 -1.58 0.00 0.00 42.46 37.54 2pu0 s ILE 315 CO 0.37 0.29 0.14 -0.69 -1.23 0.00 0.00 174.94 173.82 2pu0 s VAL 316 N 1.59 4.95 0.06 2.92 1.01 -0.25 -1.44 120.40 129.24 2pu0 s VAL 316 Ca 0.06 0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 2pu0 s VAL 316 Cb -0.15 -3.34 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 2pu0 s VAL 316 CO 0.03 0.30 1.07 -0.83 0.00 0.00 0.00 175.10 175.66 2pu0 s GLY 317 N 1.60 2.75 0.00 4.51 0.00 -0.42 -1.03 107.32 114.72 2pu0 s GLY 317 Ca 0.07 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.47 2pu0 s GLY 317 CO 0.08 1.77 0.00 1.34 0.00 0.00 0.00 173.10 176.29 2pu0 n ASP 318 N 3.56 0.00 0.24 1.64 2.03 -1.26 -1.27 116.55 121.49 2pu0 n ASP 318 Ca 0.06 0.00 0.08 0.00 0.52 0.00 0.00 54.79 55.45 2pu0 n ASP 318 Cb 0.49 0.00 0.60 0.00 -0.72 0.00 0.00 41.12 41.49 2pu0 n ASP 318 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2pu0 h ASP 319 N 0.00 0.00 -0.42 1.67 3.45 -1.94 0.17 116.42 119.34 2pu0 h ASP 319 Ca 0.00 0.00 0.03 0.00 0.43 0.00 0.00 57.03 57.49 2pu0 h ASP 319 Cb 0.00 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 38.73 2pu0 h ASP 319 CO 0.00 0.13 0.21 0.25 -1.57 0.00 0.00 179.24 178.26 2pu0 h LEU 320 N 0.00 0.31 0.00 1.55 5.85 -1.88 -3.36 115.31 117.78 2pu0 h LEU 320 Ca -0.00 0.02 -0.22 0.00 0.84 0.00 0.00 57.88 58.52 2pu0 h LEU 320 Cb 0.24 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2pu0 h LEU 320 CO 0.02 0.23 -1.97 0.35 -0.34 0.00 0.00 178.44 176.72 2pu0 n THR 321 N -4.91 0.84 -4.32 1.05 -2.24 -1.10 -4.86 114.28 98.74 2pu0 n THR 321 Ca 0.02 -0.59 -0.38 0.00 -2.27 0.00 0.00 64.05 60.84 2pu0 n THR 321 Cb 0.10 -0.47 -0.08 0.00 -2.10 0.00 0.00 70.33 67.78 2pu0 n THR 321 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2pu0 n VAL 322 N -2.47 -0.20 -3.40 2.28 0.24 0.57 -1.54 118.33 113.81 2pu0 n VAL 322 Ca -0.21 -0.10 -0.25 0.00 -2.04 0.00 0.00 64.34 61.75 2pu0 n VAL 322 Cb 0.89 -0.57 0.01 0.00 -1.47 0.00 0.00 33.84 32.70 2pu0 n VAL 322 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2pu0 n THR 323 N -3.94 -1.50 -3.88 3.34 -1.04 -1.26 -4.31 114.28 101.68 2pu0 n THR 323 Ca 0.02 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.76 2pu0 n THR 323 Cb 0.47 -2.50 -0.17 0.00 -1.82 0.00 0.00 70.33 66.32 2pu0 n THR 323 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2pu0 s ASN 324 N -2.85 2.59 0.46 8.00 3.84 -0.59 -4.67 114.94 121.72 2pu0 s ASN 324 Ca 0.44 -0.54 0.20 0.00 0.21 0.00 0.00 52.86 53.17 2pu0 s ASN 324 Cb -0.22 -0.86 1.18 0.00 -0.55 0.00 0.00 41.25 40.80 2pu0 s ASN 324 CO 0.54 -0.17 1.92 0.71 -2.79 0.00 0.00 177.10 177.31 2pu0 h THR 325 N 6.32 0.74 -0.08 -5.21 1.35 -1.90 0.22 112.91 114.35 2pu0 h THR 325 Ca -0.25 -0.10 -0.01 0.00 -0.55 0.00 0.00 66.41 65.50 2pu0 h THR 325 Cb 1.12 0.43 -0.00 0.00 -1.73 0.00 0.00 68.15 67.97 2pu0 h THR 325 CO 0.39 0.05 0.02 -0.33 -0.25 0.00 0.00 175.52 175.40 2pu0 h GLU 326 N 0.28 0.13 -0.61 4.72 4.39 -1.95 -0.21 114.58 121.33 2pu0 h GLU 326 Ca 0.37 -0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.94 2pu0 h GLU 326 Cb 1.03 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.64 2pu0 h GLU 326 CO -0.09 0.33 0.02 0.00 -1.16 0.00 0.00 179.01 178.11 2pu0 h ARG 327 N -0.09 1.07 -0.72 2.33 2.47 -1.52 -2.74 114.38 115.17 2pu0 h ARG 327 Ca 0.02 -0.33 0.02 0.00 -1.26 0.00 0.00 59.98 58.44 2pu0 h ARG 327 Cb 0.26 -0.10 -0.04 0.00 -1.65 0.00 0.00 29.97 28.44 2pu0 h ARG 327 CO 0.00 1.03 0.47 0.82 0.56 0.00 0.00 179.97 182.85 2pu0 h ILE 328 N 0.97 1.14 -0.92 2.04 2.04 -0.95 -0.36 117.51 121.48 2pu0 h ILE 328 Ca 0.18 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 2pu0 h ILE 328 Cb 0.53 0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 36.70 2pu0 h ILE 328 CO 0.03 0.17 0.57 0.11 0.00 0.00 0.00 178.15 179.03 2pu0 h LYS 329 N 0.93 1.23 -0.58 2.37 1.57 -0.84 0.17 116.57 121.42 2pu0 h LYS 329 Ca 0.28 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.93 2pu0 h LYS 329 Cb -0.05 -0.26 -0.03 0.00 0.08 0.00 0.00 32.23 31.97 2pu0 h LYS 329 CO -0.08 0.85 0.23 0.52 -0.57 0.00 0.00 179.45 180.40 2pu0 h MET 330 N 1.26 0.87 -0.52 3.15 2.86 -1.09 -1.38 114.93 120.07 2pu0 h MET 330 Ca 0.33 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.81 2pu0 h MET 330 Cb -0.08 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.41 2pu0 h MET 330 CO -0.07 0.74 0.30 0.00 1.06 0.00 0.00 176.91 178.95 2pu0 h ALA 331 N 1.08 0.67 0.06 6.32 0.00 -0.34 -1.96 119.26 125.09 2pu0 h ALA 331 Ca 0.19 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2pu0 h ALA 331 Cb 0.20 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2pu0 h ALA 331 CO -0.02 0.17 -0.03 0.82 0.00 0.00 0.00 179.25 180.20 2pu0 h ILE 332 N 0.70 0.97 -0.91 0.00 2.04 -0.56 0.13 117.51 119.88 2pu0 h ILE 332 Ca 0.19 -0.07 0.12 0.00 1.00 0.00 0.00 64.86 66.09 2pu0 h ILE 332 Cb 0.01 1.02 -0.08 0.00 -0.74 0.00 0.00 36.82 37.03 2pu0 h ILE 332 CO -0.03 0.02 0.53 -0.08 0.00 0.00 0.00 178.15 178.59 2pu0 h GLU 333 N -0.11 0.81 -0.27 2.37 4.81 -1.17 -1.64 114.58 119.38 2pu0 h GLU 333 Ca -0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2pu0 h GLU 333 Cb 0.09 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.29 2pu0 h GLU 333 CO 0.01 0.53 0.00 1.63 -0.73 0.00 0.00 179.01 180.46 2pu0 n LYS 334 N -4.72 1.95 -4.32 1.92 5.02 -0.74 -4.93 118.16 112.33 2pu0 n LYS 334 Ca 0.17 -1.43 -0.35 0.00 -2.02 0.00 0.00 58.31 54.67 2pu0 n LYS 334 Cb 0.36 -1.40 -0.07 0.00 -0.02 0.00 0.00 35.03 33.89 2pu0 n LYS 334 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2pu0 n LYS 335 N 0.66 -1.64 0.19 1.97 5.02 -0.62 -4.73 118.16 119.01 2pu0 n LYS 335 Ca 0.16 0.21 0.06 0.00 -2.02 0.00 0.00 58.31 56.72 2pu0 n LYS 335 Cb 0.39 -4.37 0.36 0.00 -0.02 0.00 0.00 35.03 31.40 2pu0 n LYS 335 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2pu0 h ALA 336 N 0.85 1.03 -2.48 7.82 0.00 -1.05 -3.39 119.26 122.04 2pu0 h ALA 336 Ca -0.62 -0.32 0.15 0.00 0.00 0.00 0.00 54.91 54.12 2pu0 h ALA 336 Cb 1.39 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 19.06 2pu0 h ALA 336 CO 0.77 0.44 0.46 0.00 0.00 0.00 0.00 179.25 180.92 2pu0 n ASN 338 N -0.63 0.03 -3.75 0.00 0.23 -0.52 -4.87 115.26 105.75 2pu0 n ASN 338 Ca -0.05 -1.99 -0.12 0.00 -0.53 0.00 0.00 54.58 51.88 2pu0 n ASN 338 Cb 0.60 -0.20 -0.12 0.00 -2.08 0.00 0.00 39.78 37.98 2pu0 n ASN 338 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 2pu0 s SER 339 N -1.02 -0.31 -0.23 0.53 0.15 -0.89 -2.06 113.70 109.86 2pu0 s SER 339 Ca 0.01 0.59 -0.13 0.00 0.70 0.00 0.00 55.95 57.12 2pu0 s SER 339 Cb 0.01 0.55 -0.04 0.00 -1.71 0.00 0.00 66.02 64.82 2pu0 s SER 339 CO -0.01 -0.13 0.28 -0.22 1.20 0.00 0.00 173.24 174.36 2pu0 s LEU 340 N 0.63 4.11 -0.40 3.45 2.96 -0.18 -1.30 118.68 127.95 2pu0 s LEU 340 Ca -0.04 0.28 -0.28 0.00 -0.22 0.00 0.00 54.13 53.87 2pu0 s LEU 340 Cb -0.05 -2.30 0.02 0.00 0.50 0.00 0.00 46.19 44.36 2pu0 s LEU 340 CO -0.04 -0.03 1.06 -0.22 -1.32 0.00 0.00 176.35 175.80 2pu0 s LEU 341 N 1.33 3.83 -0.38 -0.68 2.96 -0.40 -0.44 118.68 124.90 2pu0 s LEU 341 Ca 0.13 0.67 -0.17 0.00 -0.22 0.00 0.00 54.13 54.54 2pu0 s LEU 341 Cb -0.14 -3.47 0.01 0.00 0.50 0.00 0.00 46.19 43.09 2pu0 s LEU 341 CO 0.07 -1.03 0.42 -0.22 -1.32 0.00 0.00 176.35 174.27 2pu0 s LEU 342 N 3.94 4.62 -0.29 -0.68 0.20 0.56 -4.47 118.68 122.56 2pu0 s LEU 342 Ca 0.44 -0.41 0.03 0.00 0.69 0.00 0.00 54.13 54.89 2pu0 s LEU 342 Cb -0.10 -2.40 0.07 0.00 -0.43 0.00 0.00 46.19 43.33 2pu0 s LEU 342 CO 0.23 -0.48 -0.05 -0.54 -0.29 0.00 0.00 176.35 175.22 2pu0 s LYS 343 N 2.14 1.98 0.35 1.98 1.02 -1.26 -1.48 119.74 124.47 2pu0 s LYS 343 Ca 0.13 -1.54 0.10 0.00 0.02 0.00 0.00 55.97 54.68 2pu0 s LYS 343 Cb -0.17 -3.02 0.86 0.00 -0.52 0.00 0.00 37.83 34.99 2pu0 s LYS 343 CO 0.13 -0.71 1.82 -0.84 -0.92 0.00 0.00 175.35 174.84 2pu0 h ILE 344 N 6.70 0.73 -0.00 2.17 3.07 -1.95 -1.31 117.51 126.92 2pu0 h ILE 344 Ca -0.14 -0.22 0.00 0.00 1.55 0.00 0.00 64.86 66.05 2pu0 h ILE 344 Cb 1.03 0.02 0.00 0.00 -0.27 0.00 0.00 36.82 37.61 2pu0 h ILE 344 CO 0.49 0.12 -0.04 -0.46 -1.05 0.00 0.00 178.15 177.20 2pu0 n ASN 345 N -4.63 0.27 0.21 2.16 6.94 -1.26 -0.60 115.26 118.35 2pu0 n ASN 345 Ca 0.21 -0.59 0.10 0.00 -0.02 0.00 0.00 54.58 54.28 2pu0 n ASN 345 Cb 0.59 -0.12 0.35 0.00 -2.36 0.00 0.00 39.78 38.25 2pu0 n ASN 345 CO 0.00 0.00 0.00 1.56 -1.03 0.00 0.00 177.26 177.79 2pu0 h GLN 346 N 0.36 0.00 0.00 -3.83 4.20 -1.54 -3.41 115.11 110.90 2pu0 h GLN 346 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 2pu0 h GLN 346 Cb 0.26 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.04 2pu0 h GLN 346 CO 0.00 0.20 -1.07 1.51 -0.67 0.00 0.00 178.83 178.81 2pu0 n ILE 347 N -3.26 0.07 0.00 2.54 0.13 -1.14 -1.33 119.36 116.36 2pu0 n ILE 347 Ca 0.01 -0.02 0.00 0.00 -1.10 0.00 0.00 62.75 61.64 2pu0 n ILE 347 Cb 0.49 -1.10 0.00 0.00 -0.84 0.00 0.00 39.64 38.19 2pu0 n ILE 347 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2pu0 n GLY 348 N 3.15 0.66 3.08 4.50 0.00 0.23 -4.80 105.19 112.01 2pu0 n GLY 348 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 2pu0 n GLY 348 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pu0 s THR 349 N -2.00 0.62 0.21 2.61 -4.23 -1.26 -2.60 115.64 108.99 2pu0 s THR 349 Ca 0.00 -1.16 -0.10 0.00 -1.18 0.00 0.00 61.69 59.25 2pu0 s THR 349 Cb 0.00 -0.74 0.15 0.00 1.34 0.00 0.00 72.50 73.26 2pu0 s THR 349 CO 0.00 -0.39 1.85 0.40 -0.54 0.00 0.00 174.62 175.93 2pu0 h ILE 350 N 4.37 1.21 -0.56 2.99 1.08 -1.90 -1.60 117.51 123.10 2pu0 h ILE 350 Ca -0.36 -0.48 0.01 0.00 -0.39 0.00 0.00 64.86 63.64 2pu0 h ILE 350 Cb 1.20 0.17 -0.03 0.00 -3.07 0.00 0.00 36.82 35.09 2pu0 h ILE 350 CO 0.42 0.23 0.36 0.28 -0.69 0.00 0.00 178.15 178.74 2pu0 h SER 351 N 1.03 0.60 -0.42 1.72 0.02 -1.96 0.55 113.55 115.10 2pu0 h SER 351 Ca 0.27 -0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 61.07 2pu0 h SER 351 Cb -0.03 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2pu0 h SER 351 CO -0.05 0.43 -0.29 -0.33 -1.14 0.00 0.00 176.83 175.45 2pu0 h GLU 352 N 0.72 0.94 -0.57 3.45 5.08 -1.95 -1.11 114.58 121.13 2pu0 h GLU 352 Ca 0.21 -0.45 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2pu0 h GLU 352 Cb -0.05 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 2pu0 h GLU 352 CO -0.06 1.11 0.30 0.00 -1.00 0.00 0.00 179.01 179.35 2pu0 h ALA 353 N 0.81 0.73 -0.47 3.43 0.00 -0.97 -1.12 119.26 121.67 2pu0 h ALA 353 Ca 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2pu0 h ALA 353 Cb 0.88 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2pu0 h ALA 353 CO 0.08 0.27 0.29 0.82 0.00 0.00 0.00 179.25 180.71 2pu0 h ILE 354 N 0.77 1.14 -0.95 0.00 2.04 -0.80 -1.91 117.51 117.80 2pu0 h ILE 354 Ca 0.20 -0.29 0.04 0.00 1.00 0.00 0.00 64.86 65.82 2pu0 h ILE 354 Cb 0.07 0.48 -0.06 0.00 -0.74 0.00 0.00 36.82 36.58 2pu0 h ILE 354 CO -0.03 0.14 0.61 0.00 0.00 0.00 0.00 178.15 178.87 2pu0 h ALA 355 N 1.15 1.27 -0.23 1.87 0.00 -1.01 -1.08 119.26 121.22 2pu0 h ALA 355 Ca 0.17 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2pu0 h ALA 355 Cb -0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2pu0 h ALA 355 CO -0.03 0.46 0.09 0.77 0.00 0.00 0.00 179.25 180.54 2pu0 h SER 356 N 1.17 0.32 -0.30 0.00 0.02 -0.83 -0.53 113.55 113.40 2pu0 h SER 356 Ca 0.39 -0.17 0.06 0.00 -0.84 0.00 0.00 61.79 61.23 2pu0 h SER 356 Cb 0.05 -0.08 -0.06 0.00 0.14 0.00 0.00 62.40 62.45 2pu0 h SER 356 CO -0.14 0.40 -0.09 -1.28 -1.14 0.00 0.00 176.83 174.58 2pu0 h SER 357 N 0.22 -0.33 -0.33 3.07 0.87 -0.99 -1.13 113.55 114.92 2pu0 h SER 357 Ca 0.08 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.73 2pu0 h SER 357 Cb 0.18 0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 2pu0 h SER 357 CO -0.01 -0.12 0.18 0.11 -0.53 0.00 0.00 176.83 176.47 2pu0 h LYS 358 N -0.03 0.46 -0.53 2.24 1.57 -1.08 -1.13 116.57 118.08 2pu0 h LYS 358 Ca 0.15 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.91 2pu0 h LYS 358 Cb 0.25 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.43 2pu0 h LYS 358 CO -0.32 0.38 0.31 1.25 -0.57 0.00 0.00 179.45 180.49 2pu0 h LEU 359 N 0.42 0.48 -0.14 2.94 5.85 -0.94 -0.92 115.31 122.99 2pu0 h LEU 359 Ca 0.12 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2pu0 h LEU 359 Cb 0.05 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 2pu0 h LEU 359 CO -0.02 0.34 0.05 0.00 -0.34 0.00 0.00 178.44 178.47 2pu0 h MET 361 N 0.06 0.88 0.00 0.00 2.86 -1.09 -0.66 114.93 116.98 2pu0 h MET 361 Ca 0.05 -0.24 -0.02 0.00 -2.06 0.00 0.00 59.70 57.42 2pu0 h MET 361 Cb 0.18 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.74 2pu0 h MET 361 CO -0.00 0.87 -0.09 0.93 1.06 0.00 0.00 176.91 179.67 2pu0 h GLU 362 N 0.82 0.00 -0.63 1.72 5.08 -1.13 -1.52 114.58 118.92 2pu0 h GLU 362 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2pu0 h GLU 362 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2pu0 h GLU 362 CO 0.02 0.09 0.00 0.09 -1.00 0.00 0.00 179.01 178.21 2pu0 n ASN 363 N -3.94 5.23 0.00 1.42 4.13 -0.85 -4.95 115.26 116.30 2pu0 n ASN 363 Ca -0.02 -2.66 0.00 0.00 1.68 0.00 0.00 54.58 53.58 2pu0 n ASN 363 Cb 0.18 -0.63 0.00 0.00 -1.54 0.00 0.00 39.78 37.79 2pu0 n ASN 363 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2pu0 n GLY 364 N 0.94 0.65 3.89 7.41 0.00 -0.57 -5.05 105.19 112.46 2pu0 n GLY 364 Ca 0.27 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.00 2pu0 n GLY 364 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2pu0 s TRP 365 N -2.04 3.49 0.67 1.61 0.52 -0.31 -4.99 118.94 117.89 2pu0 s TRP 365 Ca 0.00 0.93 -0.09 0.00 0.02 0.00 0.00 56.10 56.96 2pu0 s TRP 365 Cb 0.00 -2.36 0.02 0.00 -1.15 0.00 0.00 33.47 29.98 2pu0 s TRP 365 CO 0.00 -0.11 1.02 -1.54 0.02 0.00 0.00 176.95 176.34 2pu0 s SER 366 N -3.39 5.36 -0.09 2.95 1.04 -0.88 -4.05 113.70 114.65 2pu0 s SER 366 Ca 0.49 0.87 -0.01 0.00 0.48 0.00 0.00 55.95 57.79 2pu0 s SER 366 Cb -0.10 -1.70 0.03 0.00 0.10 0.00 0.00 66.02 64.34 2pu0 s SER 366 CO 0.34 -1.31 -0.04 -0.69 0.98 0.00 0.00 173.24 172.52 2pu0 s VAL 367 N -3.22 0.73 -0.37 5.02 1.01 -1.26 -1.01 120.40 121.30 2pu0 s VAL 367 Ca 0.57 -0.11 -0.08 0.00 0.00 0.00 0.00 61.98 62.35 2pu0 s VAL 367 Cb -0.11 -0.81 0.04 0.00 0.00 0.00 0.00 36.38 35.51 2pu0 s VAL 367 CO 0.48 0.32 0.17 -0.32 0.00 0.00 0.00 175.10 175.75 2pu0 s MET 368 N 1.75 2.67 0.35 2.72 0.00 0.41 -4.20 119.30 123.01 2pu0 s MET 368 Ca 0.04 -1.22 -0.27 0.00 0.00 0.00 0.00 55.69 54.24 2pu0 s MET 368 Cb -0.13 -3.62 -0.09 0.00 0.00 0.00 0.00 34.83 31.00 2pu0 s MET 368 CO -0.06 -0.74 1.17 0.08 0.00 0.00 0.00 175.02 175.47 2pu0 s VAL 369 N 1.45 3.18 0.01 10.11 1.01 -0.71 -0.33 120.40 135.12 2pu0 s VAL 369 Ca 0.01 1.08 0.01 0.00 0.00 0.00 0.00 61.98 63.07 2pu0 s VAL 369 Cb -0.20 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 2pu0 s VAL 369 CO 0.04 0.18 -0.03 -0.55 0.00 0.00 0.00 175.10 174.73 2pu0 s SER 370 N -0.95 0.33 1.18 3.32 0.15 -0.55 -1.20 113.70 115.98 2pu0 s SER 370 Ca 0.52 -0.21 -0.19 0.00 0.70 0.00 0.00 55.95 56.77 2pu0 s SER 370 Cb -0.33 0.01 0.28 0.00 -1.71 0.00 0.00 66.02 64.28 2pu0 s SER 370 CO 0.42 -0.08 1.16 -1.38 1.20 0.00 0.00 173.24 174.56 2pu0 s HIS 371 N -0.53 0.48 0.36 3.44 -3.43 -0.83 -4.66 115.29 110.12 2pu0 s HIS 371 Ca -0.04 0.39 0.08 0.00 -0.80 0.00 0.00 55.06 54.69 2pu0 s HIS 371 Cb -0.04 -3.62 -0.03 0.00 -1.43 0.00 0.00 32.58 27.45 2pu0 s HIS 371 CO -0.00 -3.77 0.26 1.03 -2.00 0.00 0.00 174.74 170.26 2pu0 s ARG 372 N -5.56 2.53 0.43 -0.38 1.81 -1.26 -5.00 118.95 111.53 2pu0 s ARG 372 Ca 0.72 -1.47 0.20 0.00 -1.72 0.00 0.00 55.73 53.47 2pu0 s ARG 372 Cb -0.07 -2.32 0.99 0.00 -0.45 0.00 0.00 34.95 33.10 2pu0 s ARG 372 CO 0.55 0.01 1.90 0.66 -0.68 0.00 0.00 175.30 177.74 2pu0 h SER 373 N 1.30 0.00 -2.97 0.23 4.64 -1.93 -3.34 113.55 111.48 2pu0 h SER 373 Ca -0.43 0.00 -0.70 0.00 -0.47 0.00 0.00 61.79 60.18 2pu0 h SER 373 Cb 1.26 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.15 2pu0 h SER 373 CO 0.60 0.26 0.08 -0.83 -0.87 0.00 0.00 176.83 176.08 2pu0 s GLY 374 N -4.27 1.79 0.45 -0.77 0.00 0.14 -4.70 107.32 99.97 2pu0 s GLY 374 Ca -0.02 -2.18 0.06 0.00 0.00 0.00 0.00 44.72 42.58 2pu0 s GLY 374 CO 0.66 1.53 0.19 -0.54 0.00 0.00 0.00 173.10 174.94 2pu0 s GLU 375 N 2.60 2.22 0.40 2.90 0.41 -1.25 -0.89 118.70 125.08 2pu0 s GLU 375 Ca 0.11 -1.96 0.02 0.00 -0.41 0.00 0.00 54.97 52.73 2pu0 s GLU 375 Cb -0.24 -1.93 -0.01 0.00 -1.78 0.00 0.00 34.13 30.17 2pu0 s GLU 375 CO 0.07 -0.24 0.09 0.25 -0.49 0.00 0.00 175.26 174.93 2pu0 n THR 376 N -1.33 0.00 0.30 3.63 -2.24 -1.26 -0.10 114.28 113.28 2pu0 n THR 376 Ca -0.04 -2.17 0.03 0.00 -2.27 0.00 0.00 64.05 59.61 2pu0 n THR 376 Cb 0.65 0.66 0.17 0.00 -2.10 0.00 0.00 70.33 69.71 2pu0 n THR 376 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2pu0 n GLU 377 N -0.94 0.06 -1.71 -0.78 0.00 -1.26 -4.56 120.64 111.44 2pu0 n GLU 377 Ca -0.10 0.28 -0.41 0.00 0.00 0.00 0.00 57.16 56.93 2pu0 n GLU 377 Cb 0.57 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.51 2pu0 n GLU 377 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2pu0 n ASP 378 N -1.37 2.79 -0.03 -1.84 -0.08 -1.26 -4.92 116.55 109.84 2pu0 n ASP 378 Ca 0.03 1.14 0.03 0.00 -1.51 0.00 0.00 54.79 54.48 2pu0 n ASP 378 Cb 0.07 -1.52 0.04 0.00 2.34 0.00 0.00 41.12 42.05 2pu0 n ASP 378 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2pu0 n THR 379 N -0.05 1.21 -0.26 5.18 -2.24 -1.26 -4.70 114.28 112.15 2pu0 n THR 379 Ca 0.06 -1.32 0.07 0.00 -2.27 0.00 0.00 64.05 60.59 2pu0 n THR 379 Cb 0.39 0.30 0.19 0.00 -2.10 0.00 0.00 70.33 69.12 2pu0 n THR 379 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2pu0 h TYR 380 N 0.00 0.10 0.00 4.78 3.20 -1.96 -1.46 116.97 121.64 2pu0 h TYR 380 Ca 0.00 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2pu0 h TYR 380 Cb 0.67 0.08 -0.00 0.00 1.54 0.00 0.00 36.73 39.02 2pu0 h TYR 380 CO 0.00 -0.20 -0.06 -0.84 -1.64 0.00 0.00 178.16 175.41 2pu0 h ILE 381 N 0.16 0.44 0.43 1.81 3.07 -1.96 -1.08 117.51 120.39 2pu0 h ILE 381 Ca 0.45 -0.32 -0.02 0.00 1.55 0.00 0.00 64.86 66.52 2pu0 h ILE 381 Cb 0.81 1.22 0.00 0.00 -0.27 0.00 0.00 36.82 38.58 2pu0 h ILE 381 CO -0.63 0.06 -0.21 0.00 -1.05 0.00 0.00 178.15 176.32 2pu0 h ALA 382 N 1.94 -0.58 -0.76 0.16 0.00 -1.57 -0.60 119.26 117.85 2pu0 h ALA 382 Ca -0.00 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.81 2pu0 h ALA 382 Cb 0.21 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 2pu0 h ALA 382 CO 0.01 -0.81 0.48 -0.44 0.00 0.00 0.00 179.25 178.49 2pu0 h ASP 383 N -0.62 0.78 -0.17 0.00 5.19 -1.50 -2.98 116.42 117.12 2pu0 h ASP 383 Ca -0.06 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 2pu0 h ASP 383 Cb 0.47 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.80 2pu0 h ASP 383 CO 0.10 0.54 0.11 0.25 -3.12 0.00 0.00 179.24 177.12 2pu0 h LEU 384 N 0.93 0.20 -0.81 1.55 5.85 -1.10 0.36 115.31 122.29 2pu0 h LEU 384 Ca 0.31 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.97 2pu0 h LEU 384 Cb 0.03 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 2pu0 h LEU 384 CO -0.12 0.15 0.35 1.62 -0.34 0.00 0.00 178.44 180.10 2pu0 h VAL 385 N 0.22 1.26 -0.43 1.05 3.04 -1.11 -1.11 116.25 119.18 2pu0 h VAL 385 Ca 0.06 -0.79 -0.01 0.00 -1.01 0.00 0.00 66.70 64.95 2pu0 h VAL 385 Cb -0.02 0.27 -0.02 0.00 -2.01 0.00 0.00 31.29 29.52 2pu0 h VAL 385 CO -0.01 0.33 0.23 0.58 -1.01 0.00 0.00 177.57 177.69 2pu0 h VAL 386 N 1.17 1.16 -0.91 1.51 2.07 -1.36 -2.42 116.25 117.47 2pu0 h VAL 386 Ca 0.27 -0.40 0.05 0.00 0.82 0.00 0.00 66.70 67.43 2pu0 h VAL 386 Cb 0.19 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 2pu0 h VAL 386 CO -0.03 0.16 0.60 0.00 0.02 0.00 0.00 177.57 178.33 2pu0 h ALA 387 N 1.09 1.45 0.00 1.67 0.00 -0.29 -1.40 119.26 121.78 2pu0 h ALA 387 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2pu0 h ALA 387 Cb 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2pu0 h ALA 387 CO -0.02 0.45 0.00 -0.07 0.00 0.00 0.00 179.25 179.60 2pu0 h LEU 388 N 1.11 0.00 2.72 0.00 3.38 -1.17 -3.37 115.31 117.98 2pu0 h LEU 388 Ca 0.37 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.93 2pu0 h LEU 388 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2pu0 h LEU 388 CO -0.12 0.00 -0.54 0.61 0.09 0.00 0.00 178.44 178.48 2pu0 n GLY 389 N 1.21 -0.49 0.15 0.83 0.00 -0.53 -4.88 105.19 101.49 2pu0 n GLY 389 Ca 0.05 -0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.10 2pu0 n GLY 389 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2pu0 h SER 390 N -0.15 0.00 0.00 1.61 4.64 -1.83 -3.43 113.55 114.38 2pu0 h SER 390 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2pu0 h SER 390 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2pu0 h SER 390 CO 0.58 0.49 0.00 0.61 -0.87 0.00 0.00 176.83 177.63 2pu0 n GLY 391 N 0.85 0.90 2.78 -0.77 0.00 -1.26 -4.68 105.19 103.02 2pu0 n GLY 391 Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 2pu0 n GLY 391 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2pu0 s GLN 392 N -0.04 0.35 0.00 1.61 -0.21 -1.26 -0.58 119.66 119.53 2pu0 s GLN 392 Ca 0.00 0.12 0.02 0.00 0.02 0.00 0.00 55.36 55.52 2pu0 s GLN 392 Cb 0.00 -0.64 -0.01 0.00 1.00 0.00 0.00 33.01 33.36 2pu0 s GLN 392 CO 0.00 -0.21 -0.07 -1.50 -2.12 0.00 0.00 175.29 171.40 2pu0 s ILE 393 N 1.47 0.51 -0.15 1.08 2.07 -0.89 -1.74 121.20 123.53 2pu0 s ILE 393 Ca -0.03 -0.35 0.01 0.00 -1.41 0.00 0.00 60.65 58.86 2pu0 s ILE 393 Cb -0.13 -0.44 0.02 0.00 0.13 0.00 0.00 42.46 42.03 2pu0 s ILE 393 CO -0.03 0.09 -0.18 -1.59 -1.91 0.00 0.00 174.94 171.33 2pu0 s LYS 394 N -0.29 2.64 0.00 3.50 -2.85 -0.34 -0.49 119.74 121.90 2pu0 s LYS 394 Ca 0.01 -0.70 0.14 0.00 -1.00 0.00 0.00 55.97 54.42 2pu0 s LYS 394 Cb -0.03 -2.29 0.23 0.00 -2.06 0.00 0.00 37.83 33.68 2pu0 s LYS 394 CO -0.00 -0.17 1.07 -2.37 0.10 0.00 0.00 175.35 173.99 2pu0 n THR 395 N 4.52 0.00 0.00 3.79 5.66 -1.26 -1.96 114.28 125.03 2pu0 n THR 395 Ca -0.19 -0.54 0.00 0.00 -3.05 0.00 0.00 64.05 60.27 2pu0 n THR 395 Cb 0.50 0.75 0.00 0.00 -1.55 0.00 0.00 70.33 70.04 2pu0 n THR 395 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2pu0 n GLY 396 N 0.27 2.64 3.44 1.09 0.00 -1.26 -4.47 105.19 106.90 2pu0 n GLY 396 Ca 0.02 -2.06 -0.33 0.00 0.00 0.00 0.00 46.02 43.65 2pu0 n GLY 396 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pu0 n ALA 397 N -0.46 -2.46 -0.95 4.61 0.00 -0.67 -3.74 120.51 116.85 2pu0 n ALA 397 Ca 0.00 -0.65 -0.27 0.00 0.00 0.00 0.00 53.44 52.52 2pu0 n ALA 397 Cb 0.00 -1.84 -0.03 0.00 0.00 0.00 0.00 19.45 17.58 2pu0 n ALA 397 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2pu0 n PRO 398 N -2.12 2.63 -3.63 0.00 -0.04 -1.26 -4.63 135.00 125.93 2pu0 n PRO 398 Ca 0.07 -1.66 -0.11 0.00 -0.04 0.00 0.00 63.50 61.75 2pu0 n PRO 398 Cb 0.54 -2.53 -0.07 0.00 -0.04 0.00 0.00 33.50 31.40 2pu0 n PRO 398 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2pu0 n ARG 400 N 2.44 0.00 -0.03 0.00 1.74 -1.26 -4.31 116.66 115.24 2pu0 n ARG 400 Ca -0.13 0.18 0.20 0.00 -0.77 0.00 0.00 57.85 57.32 2pu0 n ARG 400 Cb 0.55 0.00 0.66 0.00 -1.02 0.00 0.00 32.46 32.65 2pu0 n ARG 400 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2pu0 h GLY 401 N 0.00 0.12 2.00 -0.13 0.00 -1.98 0.43 103.07 103.51 2pu0 h GLY 401 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2pu0 h GLY 401 CO 0.00 0.01 0.00 -1.84 0.00 0.00 0.00 176.54 174.71 2pu0 n GLU 402 N -4.39 0.07 -0.13 4.80 0.00 -1.26 -0.81 120.64 118.91 2pu0 n GLU 402 Ca 0.11 0.25 -0.27 0.00 0.00 0.00 0.00 57.16 57.25 2pu0 n GLU 402 Cb 0.60 -1.61 -0.09 0.00 0.00 0.00 0.00 31.44 30.34 2pu0 n GLU 402 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2pu0 n ARG 403 N -1.74 0.58 0.22 3.44 5.12 0.02 -4.50 116.66 119.79 2pu0 n ARG 403 Ca 0.04 0.25 0.05 0.00 -1.93 0.00 0.00 57.85 56.26 2pu0 n ARG 403 Cb 0.23 -1.48 0.49 0.00 -1.16 0.00 0.00 32.46 30.54 2pu0 n ARG 403 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 2pu0 h THR 404 N -0.99 1.10 -0.70 0.55 1.35 -1.24 -2.13 112.91 110.84 2pu0 h THR 404 Ca -0.62 -0.79 0.10 0.00 -0.55 0.00 0.00 66.41 64.55 2pu0 h THR 404 Cb 1.54 1.44 -0.07 0.00 -1.73 0.00 0.00 68.15 69.32 2pu0 h THR 404 CO -0.37 0.22 0.32 0.00 -0.25 0.00 0.00 175.52 175.44 2pu0 h ALA 405 N 1.77 0.96 -0.56 6.62 0.00 -1.21 0.14 119.26 126.98 2pu0 h ALA 405 Ca -0.00 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 2pu0 h ALA 405 Cb 0.42 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2pu0 h ALA 405 CO 0.03 -0.10 0.16 0.87 0.00 0.00 0.00 179.25 180.21 2pu0 h LYS 406 N 0.54 0.88 -0.57 0.00 6.56 -1.62 -1.81 116.57 120.55 2pu0 h LYS 406 Ca 0.35 -0.20 -0.11 0.00 -1.06 0.00 0.00 60.65 59.64 2pu0 h LYS 406 Cb 0.41 -0.12 -0.02 0.00 -0.57 0.00 0.00 32.23 31.93 2pu0 h LYS 406 CO -0.30 0.81 -0.06 -0.07 -2.06 0.00 0.00 179.45 177.78 2pu0 h LEU 407 N 0.79 1.03 -0.57 2.94 3.38 -1.18 -1.48 115.31 120.22 2pu0 h LEU 407 Ca 0.18 -0.32 -0.09 0.00 0.09 0.00 0.00 57.88 57.74 2pu0 h LEU 407 Cb 0.31 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2pu0 h LEU 407 CO -0.00 1.11 -0.00 0.78 0.09 0.00 0.00 178.44 180.42 2pu0 h ASN 408 N 0.94 0.99 -0.76 -0.43 2.35 -0.72 -1.68 115.58 116.26 2pu0 h ASN 408 Ca 0.16 -0.31 -0.04 0.00 -0.55 0.00 0.00 56.30 55.56 2pu0 h ASN 408 Cb 0.62 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.69 2pu0 h ASN 408 CO 0.04 1.05 0.33 -0.61 -1.65 0.00 0.00 177.43 176.59 2pu0 h GLN 409 N 0.89 1.14 -0.99 0.81 5.75 -1.01 -1.62 115.11 120.07 2pu0 h GLN 409 Ca 0.16 -0.19 0.06 0.00 -0.15 0.00 0.00 58.65 58.53 2pu0 h GLN 409 Cb 0.55 -0.19 -0.06 0.00 1.07 0.00 0.00 27.48 28.84 2pu0 h GLN 409 CO 0.03 0.90 0.64 -0.07 -2.65 0.00 0.00 178.83 177.69 2pu0 h LEU 410 N 1.12 1.04 -0.57 -2.39 3.38 -1.04 0.01 115.31 116.86 2pu0 h LEU 410 Ca 0.26 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.29 2pu0 h LEU 410 Cb 0.17 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 2pu0 h LEU 410 CO -0.03 0.68 0.29 -0.07 0.09 0.00 0.00 178.44 179.40 2pu0 h LEU 411 N 1.19 0.42 -0.51 1.67 3.38 -0.40 -0.71 115.31 120.35 2pu0 h LEU 411 Ca 0.42 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.38 2pu0 h LEU 411 Cb 0.12 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2pu0 h LEU 411 CO -0.16 0.28 0.14 0.03 0.09 0.00 0.00 178.44 178.82 2pu0 h ARG 412 N 0.56 0.80 -0.36 1.13 3.08 -0.59 -1.31 114.38 117.68 2pu0 h ARG 412 Ca 0.25 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 2pu0 h ARG 412 Cb 0.16 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2pu0 h ARG 412 CO -0.17 0.75 0.15 0.82 -1.07 0.00 0.00 179.97 180.45 2pu0 h ILE 413 N 0.69 1.18 -0.57 2.04 2.04 -0.87 -2.11 117.51 119.92 2pu0 h ILE 413 Ca 0.16 -0.55 0.10 0.00 1.00 0.00 0.00 64.86 65.57 2pu0 h ILE 413 Cb 0.30 0.87 -0.08 0.00 -0.74 0.00 0.00 36.82 37.17 2pu0 h ILE 413 CO -0.00 0.20 0.14 -0.08 0.00 0.00 0.00 178.15 178.40 2pu0 h GLU 414 N 0.44 0.27 -0.69 2.37 4.81 -0.93 -1.35 114.58 119.50 2pu0 h GLU 414 Ca 0.12 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 2pu0 h GLU 414 Cb 0.17 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 2pu0 h GLU 414 CO -0.01 0.18 0.35 1.49 -0.73 0.00 0.00 179.01 180.28 2pu0 h GLU 415 N 0.28 0.99 -0.87 1.92 4.81 -1.03 -1.49 114.58 119.19 2pu0 h GLU 415 Ca 0.29 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 2pu0 h GLU 415 Cb 0.41 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.56 2pu0 h GLU 415 CO -0.36 0.77 0.46 0.93 -0.73 0.00 0.00 179.01 180.08 2pu0 h GLU 416 N 0.96 1.22 0.00 1.92 5.08 -0.83 -3.07 114.58 119.85 2pu0 h GLU 416 Ca 0.24 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 2pu0 h GLU 416 Cb 0.09 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2pu0 h GLU 416 CO -0.03 0.90 -0.35 -0.07 -1.00 0.00 0.00 179.01 178.45 2pu0 h LEU 417 N 1.22 0.00 0.00 1.33 3.38 -0.87 -3.50 115.31 116.87 2pu0 h LEU 417 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2pu0 h LEU 417 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2pu0 h LEU 417 CO -0.05 0.35 0.00 0.61 0.09 0.00 0.00 178.44 179.45 2pu0 n GLY 418 N 1.15 -1.02 0.03 0.83 0.00 -0.60 -4.33 105.19 101.25 2pu0 n GLY 418 Ca 0.02 -1.64 0.10 0.00 0.00 0.00 0.00 46.02 44.51 2pu0 n GLY 418 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pu0 n ALA 419 N -0.79 1.83 1.40 4.61 0.00 -1.26 -2.28 120.51 124.02 2pu0 n ALA 419 Ca 0.00 -0.03 0.14 0.00 0.00 0.00 0.00 53.44 53.54 2pu0 n ALA 419 Cb 0.00 -1.32 0.48 0.00 0.00 0.00 0.00 19.45 18.60 2pu0 n ALA 419 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2pu0 n HIS 420 N -1.68 0.00 -1.92 0.00 8.25 -1.26 -4.92 115.22 113.69 2pu0 n HIS 420 Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.08 2pu0 n HIS 420 Cb 0.23 -0.06 -0.02 0.00 1.12 0.00 0.00 29.99 31.26 2pu0 n HIS 420 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2pu0 s ALA 421 N -2.23 3.72 0.35 -1.41 0.00 -0.97 -4.97 121.76 116.25 2pu0 s ALA 421 Ca 0.32 1.40 -0.28 0.00 0.00 0.00 0.00 51.96 53.40 2pu0 s ALA 421 Cb 0.20 -3.60 -0.10 0.00 0.00 0.00 0.00 23.12 19.62 2pu0 s ALA 421 CO 0.42 -0.81 1.30 0.15 0.00 0.00 0.00 175.76 176.82 2pu0 s LYS 422 N 0.21 4.28 0.04 0.00 -0.14 -1.26 -4.92 119.74 117.94 2pu0 s LYS 422 Ca 0.65 2.20 0.08 0.00 -1.36 0.00 0.00 55.97 57.54 2pu0 s LYS 422 Cb -0.44 -3.00 -0.03 0.00 -1.68 0.00 0.00 37.83 32.68 2pu0 s LYS 422 CO 0.39 -0.25 -0.24 0.12 -0.76 0.00 0.00 175.35 174.62 2pu0 s PHE 423 N -1.17 2.10 0.00 3.18 5.36 -1.26 -1.07 117.98 125.12 2pu0 s PHE 423 Ca 0.51 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.08 2pu0 s PHE 423 Cb -0.39 -1.26 0.00 0.00 -0.34 0.00 0.00 43.02 41.02 2pu0 s PHE 423 CO 0.52 0.10 0.00 0.41 -1.46 0.00 0.00 175.22 174.79 2pu0 n GLY 424 N 1.85 -3.37 3.37 13.12 0.00 0.39 -4.85 105.19 115.70 2pu0 n GLY 424 Ca -0.17 -1.96 -0.38 0.00 0.00 0.00 0.00 46.02 43.51 2pu0 n GLY 424 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2pu0 s PHE 425 N -0.75 3.19 0.29 1.61 5.36 -1.24 -4.47 117.98 121.97 2pu0 s PHE 425 Ca 0.00 -0.92 0.03 0.00 -0.96 0.00 0.00 56.93 55.08 2pu0 s PHE 425 Cb 0.00 -2.32 0.69 0.00 -0.34 0.00 0.00 43.02 41.05 2pu0 s PHE 425 CO 0.00 -0.58 1.73 -1.35 -1.46 0.00 0.00 175.22 173.57 2pu0 h PRO 426 N 8.30 0.53 0.00 10.12 0.11 -1.93 0.42 132.00 149.55 2pu0 h PRO 426 Ca -0.29 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2pu0 h PRO 426 Cb 1.12 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2pu0 h PRO 426 CO 0.62 0.35 0.01 0.78 -0.21 0.00 0.00 178.00 179.55 2pu0 h GLY 427 N 0.55 0.00 0.00 -0.55 0.00 -2.01 -2.31 103.07 98.75 2pu0 h GLY 427 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 2pu0 h GLY 427 CO -0.45 0.00 -0.82 0.79 0.00 0.00 0.00 176.54 176.07 2pu0 n TRP 428 N -2.83 0.00 1.96 5.60 8.01 0.11 -5.16 117.44 125.13 2pu0 n TRP 428 Ca -0.03 0.00 0.16 0.00 -1.31 0.00 0.00 57.50 56.32 2pu0 n TRP 428 Cb 0.07 -0.05 0.93 0.00 -2.01 0.00 0.00 31.31 30.25 2pu0 n TRP 428 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.69 177.11