#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cd3 h ASN 2 N 0.00 -0.62 0.00 -3.46 -1.07 -2.09 -3.45 115.58 104.89 1cd3 h ASN 2 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 56.30 56.33 1cd3 h ASN 2 Cb 0.00 0.16 0.00 0.00 -2.07 0.00 0.00 38.32 36.41 1cd3 h ASN 2 CO 0.00 -0.33 0.00 -0.38 0.07 0.00 0.00 177.43 176.79 1cd3 n ILE 3 N -5.34 0.00 -0.13 6.14 5.41 -1.26 -2.41 119.36 121.77 1cd3 n ILE 3 Ca -0.12 0.00 -0.05 0.00 1.00 0.00 0.00 62.75 63.59 1cd3 n ILE 3 Cb 0.33 0.00 0.04 0.00 -0.71 0.00 0.00 39.64 39.29 1cd3 n ILE 3 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 1cd3 h GLN 4 N 0.00 0.23 0.00 0.38 4.15 -2.06 -3.35 115.11 114.46 1cd3 h GLN 4 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1cd3 h GLN 4 Cb 0.00 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.64 1cd3 h GLN 4 CO 0.00 0.15 0.00 0.25 -1.93 0.00 0.00 178.83 177.30 1cd3 n THR 5 N -5.08 0.00 -0.77 2.39 -2.24 -1.01 -3.23 114.28 104.34 1cd3 n THR 5 Ca 0.03 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.39 1cd3 n THR 5 Cb 0.18 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.31 1cd3 n THR 5 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1cd3 n GLY 6 N -0.14 1.03 0.00 3.38 0.00 -1.26 -4.10 105.19 104.10 1cd3 n GLY 6 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.06 1cd3 n GLY 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cd3 n ALA 7 N 9.32 0.00 -1.54 4.61 0.00 -1.20 -5.13 120.51 126.57 1cd3 n ALA 7 Ca 0.47 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.54 1cd3 n ALA 7 Cb 0.42 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.81 1cd3 n ALA 7 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1cd3 n GLU 8 N 0.00 0.84 -4.05 0.00 2.13 -1.26 -4.94 120.64 113.36 1cd3 n GLU 8 Ca 0.00 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.74 1cd3 n GLU 8 Cb 0.00 -3.03 -0.09 0.00 0.27 0.00 0.00 31.44 28.59 1cd3 n GLU 8 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 1cd3 s ARG 9 N 8.39 0.87 0.45 5.31 3.03 -1.26 -5.02 118.95 130.72 1cd3 s ARG 9 Ca 1.06 -1.25 0.08 0.00 2.03 0.00 0.00 55.73 57.65 1cd3 s ARG 9 Cb -0.41 0.28 -0.00 0.00 -1.03 0.00 0.00 34.95 33.78 1cd3 s ARG 9 CO 0.31 -0.25 0.44 -1.64 -1.13 0.00 0.00 175.30 173.03 1cd3 s MET 10 N -3.97 2.51 -0.25 3.89 -1.94 -0.94 -4.90 119.30 113.70 1cd3 s MET 10 Ca 0.15 -1.57 -0.08 0.00 -1.71 0.00 0.00 55.69 52.48 1cd3 s MET 10 Cb 0.06 -2.41 -0.03 0.00 2.01 0.00 0.00 34.83 34.46 1cd3 s MET 10 CO -0.04 -0.31 0.09 -1.25 -0.01 0.00 0.00 175.02 173.50 1cd3 s PRO 11 N -4.22 3.71 0.13 2.03 0.05 -1.26 -1.20 135.00 134.25 1cd3 s PRO 11 Ca 0.48 -0.45 0.04 0.00 0.05 0.00 0.00 61.00 61.12 1cd3 s PRO 11 Cb -0.04 -3.37 -0.04 0.00 0.05 0.00 0.00 34.50 31.10 1cd3 s PRO 11 CO 0.29 -0.17 0.16 -1.01 0.05 0.00 0.00 177.00 176.32 1cd3 s HIS 12 N 1.58 3.27 -1.00 0.56 3.76 0.10 -4.89 115.29 118.68 1cd3 s HIS 12 Ca 0.06 0.06 -0.06 0.00 -0.15 0.00 0.00 55.06 54.97 1cd3 s HIS 12 Cb -0.15 -1.59 0.25 0.00 1.11 0.00 0.00 32.58 32.19 1cd3 s HIS 12 CO 0.05 0.53 0.94 0.34 -0.85 0.00 0.00 174.74 175.75 1cd3 s ASP 13 N -2.92 6.73 -0.04 1.40 2.15 -1.26 -0.54 116.67 122.18 1cd3 s ASP 13 Ca 0.32 -3.57 0.00 0.00 0.43 0.00 0.00 52.55 49.74 1cd3 s ASP 13 Cb -0.11 -2.09 0.06 0.00 -0.30 0.00 0.00 42.92 40.49 1cd3 s ASP 13 CO 0.25 -0.27 1.14 0.18 -0.17 0.00 0.00 175.17 176.30 1cd3 n LEU 14 N 2.66 3.49 -4.82 -1.34 4.77 -0.37 -4.86 117.00 116.53 1cd3 n LEU 14 Ca 0.22 -1.76 -0.32 0.00 -0.03 0.00 0.00 56.01 54.12 1cd3 n LEU 14 Cb 0.39 -0.57 -0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1cd3 n LEU 14 CO 0.41 0.58 0.70 -0.55 -1.33 0.00 0.00 177.39 177.21 1cd3 s SER 15 N 0.83 6.09 -0.26 -1.43 0.15 -0.54 -4.48 113.70 114.07 1cd3 s SER 15 Ca 0.06 1.68 -0.34 0.00 0.70 0.00 0.00 55.95 58.05 1cd3 s SER 15 Cb 0.05 -2.52 0.17 0.00 -1.71 0.00 0.00 66.02 62.01 1cd3 s SER 15 CO 0.01 -0.95 1.32 -1.38 1.20 0.00 0.00 173.24 173.43 1cd3 s HIS 16 N -2.62 -0.07 0.39 3.44 -3.43 -0.16 -4.85 115.29 108.00 1cd3 s HIS 16 Ca 0.61 0.08 0.08 0.00 -0.80 0.00 0.00 55.06 55.02 1cd3 s HIS 16 Cb -0.13 0.50 -0.03 0.00 -1.43 0.00 0.00 32.58 31.49 1cd3 s HIS 16 CO 0.38 -0.08 0.32 -0.48 -2.00 0.00 0.00 174.74 172.88 1cd3 s LEU 17 N -1.61 3.43 -0.01 5.38 0.05 -1.26 0.12 118.68 124.78 1cd3 s LEU 17 Ca 0.09 -0.69 -0.09 0.00 0.05 0.00 0.00 54.13 53.50 1cd3 s LEU 17 Cb -0.01 -2.05 0.01 0.00 -2.05 0.00 0.00 46.19 42.09 1cd3 s LEU 17 CO -0.05 -0.53 0.19 -0.83 -0.55 0.00 0.00 176.35 174.58 1cd3 s GLY 18 N -4.05 -0.02 -0.24 -3.48 0.00 0.11 -4.85 107.32 94.78 1cd3 s GLY 18 Ca 0.45 0.03 0.00 0.00 0.00 0.00 0.00 44.72 45.20 1cd3 s GLY 18 CO 0.27 -0.12 -0.10 -1.36 0.00 0.00 0.00 173.10 171.79 1cd3 s PHE 19 N -1.27 3.10 0.29 1.90 0.40 -1.26 -1.78 117.98 119.36 1cd3 s PHE 19 Ca -0.13 -1.85 0.02 0.00 -0.60 0.00 0.00 56.93 54.37 1cd3 s PHE 19 Cb -0.07 -2.00 -0.04 0.00 0.51 0.00 0.00 43.02 41.42 1cd3 s PHE 19 CO 0.02 -0.80 0.13 -0.48 0.70 0.00 0.00 175.22 174.79 1cd3 s LEU 20 N 1.24 1.68 -0.00 -0.37 2.34 -0.89 -5.00 118.68 117.68 1cd3 s LEU 20 Ca -0.02 -1.49 -0.23 0.00 0.06 0.00 0.00 54.13 52.45 1cd3 s LEU 20 Cb -0.17 0.10 0.05 0.00 -0.56 0.00 0.00 46.19 45.60 1cd3 s LEU 20 CO -0.06 -0.82 0.52 0.00 -1.06 0.00 0.00 176.35 174.93 1cd3 s ALA 21 N -3.65 -1.33 0.34 1.48 0.00 -1.26 0.19 121.76 117.53 1cd3 s ALA 21 Ca 0.36 0.77 -0.06 0.00 0.00 0.00 0.00 51.96 53.03 1cd3 s ALA 21 Cb 0.06 0.17 0.01 0.00 0.00 0.00 0.00 23.12 23.36 1cd3 s ALA 21 CO 0.16 -0.40 0.52 0.20 0.00 0.00 0.00 175.76 176.24 1cd3 s GLY 22 N -1.54 1.20 0.02 0.00 0.00 0.26 -4.95 107.32 102.30 1cd3 s GLY 22 Ca -0.09 -1.32 0.01 0.00 0.00 0.00 0.00 44.72 43.32 1cd3 s GLY 22 CO 0.04 -0.85 0.04 1.20 0.00 0.00 0.00 173.10 173.53 1cd3 s GLN 23 N -3.06 2.88 -0.54 2.90 -1.52 -1.26 -2.44 119.66 116.62 1cd3 s GLN 23 Ca 0.27 -0.60 -0.27 0.00 -1.95 0.00 0.00 55.36 52.81 1cd3 s GLN 23 Cb -0.01 -2.74 0.03 0.00 -0.22 0.00 0.00 33.01 30.07 1cd3 s GLN 23 CO 0.17 0.61 1.09 -1.50 -0.25 0.00 0.00 175.29 175.42 1cd3 s ILE 24 N -1.20 4.20 0.00 1.08 2.07 -1.26 -2.70 121.20 123.38 1cd3 s ILE 24 Ca 0.23 0.79 0.00 0.00 -1.41 0.00 0.00 60.65 60.26 1cd3 s ILE 24 Cb -0.12 -4.62 0.00 0.00 0.13 0.00 0.00 42.46 37.85 1cd3 s ILE 24 CO 0.14 -1.17 0.00 0.61 -1.91 0.00 0.00 174.94 172.62 1cd3 n GLY 25 N 5.02 0.77 3.24 1.50 0.00 -1.02 -4.40 105.19 110.30 1cd3 n GLY 25 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1cd3 n GLY 25 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cd3 s ARG 26 N 0.00 3.14 -0.53 1.61 0.52 -1.10 -0.75 118.95 121.84 1cd3 s ARG 26 Ca 0.00 -0.80 -0.28 0.00 -0.52 0.00 0.00 55.73 54.13 1cd3 s ARG 26 Cb 0.00 -2.50 -0.00 0.00 0.52 0.00 0.00 34.95 32.96 1cd3 s ARG 26 CO 0.00 0.06 1.61 -1.17 0.02 0.00 0.00 175.30 175.82 1cd3 s LEU 27 N 0.67 3.39 -0.16 2.53 2.96 -1.26 -4.41 118.68 122.40 1cd3 s LEU 27 Ca -0.09 0.48 -0.02 0.00 -0.22 0.00 0.00 54.13 54.28 1cd3 s LEU 27 Cb -0.16 -2.98 -0.02 0.00 0.50 0.00 0.00 46.19 43.53 1cd3 s LEU 27 CO 0.02 -1.90 -0.07 -0.63 -1.32 0.00 0.00 176.35 172.44 1cd3 s ILE 28 N 7.07 3.49 0.14 6.68 1.01 -1.03 -3.54 121.20 135.01 1cd3 s ILE 28 Ca 0.61 -0.50 -0.30 0.00 0.00 0.00 0.00 60.65 60.47 1cd3 s ILE 28 Cb -0.13 -2.52 -0.07 0.00 0.01 0.00 0.00 42.46 39.75 1cd3 s ILE 28 CO 0.25 0.49 1.24 0.42 0.00 0.00 0.00 174.94 177.34 1cd3 s THR 29 N 0.53 3.62 -0.15 2.92 -4.23 -1.12 -0.72 115.64 116.49 1cd3 s THR 29 Ca -0.05 1.27 0.11 0.00 -1.18 0.00 0.00 61.69 61.84 1cd3 s THR 29 Cb -0.15 -3.81 -0.23 0.00 1.34 0.00 0.00 72.50 69.64 1cd3 s THR 29 CO 0.03 0.16 0.25 -0.38 -0.54 0.00 0.00 174.62 174.14 1cd3 n ILE 30 N 3.11 1.52 -3.63 2.99 5.41 -0.88 -3.92 119.36 123.95 1cd3 n ILE 30 Ca 0.07 -0.78 -0.12 0.00 1.00 0.00 0.00 62.75 62.92 1cd3 n ILE 30 Cb 0.45 -0.92 -0.07 0.00 -0.71 0.00 0.00 39.64 38.38 1cd3 n ILE 30 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1cd3 s SER 31 N -6.00 -0.66 -0.13 4.38 0.15 -1.21 -4.92 113.70 105.31 1cd3 s SER 31 Ca -0.13 1.26 -0.01 0.00 0.70 0.00 0.00 55.95 57.77 1cd3 s SER 31 Cb 0.07 1.28 0.03 0.00 -1.71 0.00 0.00 66.02 65.70 1cd3 s SER 31 CO 0.79 -0.22 -0.04 0.42 1.20 0.00 0.00 173.24 175.39 1cd3 s THR 32 N 0.40 0.89 -0.06 6.45 -4.23 -1.26 -2.91 115.64 114.92 1cd3 s THR 32 Ca 0.00 -0.33 0.04 0.00 -1.18 0.00 0.00 61.69 60.22 1cd3 s THR 32 Cb -0.05 -1.02 -0.02 0.00 1.34 0.00 0.00 72.50 72.75 1cd3 s THR 32 CO -0.02 0.23 -0.17 0.42 -0.54 0.00 0.00 174.62 174.53 1cd3 s THR 33 N 1.75 2.76 0.40 3.99 -4.23 -1.15 -4.94 115.64 114.22 1cd3 s THR 33 Ca 0.03 -0.82 -0.25 0.00 -1.18 0.00 0.00 61.69 59.47 1cd3 s THR 33 Cb -0.14 -2.07 -0.08 0.00 1.34 0.00 0.00 72.50 71.55 1cd3 s THR 33 CO -0.07 0.58 1.15 -2.84 -0.54 0.00 0.00 174.62 172.89 1cd3 s PRO 34 N -0.44 4.05 0.02 3.99 0.02 -1.26 -2.48 135.00 138.90 1cd3 s PRO 34 Ca 0.05 1.78 0.02 0.00 0.02 0.00 0.00 61.00 62.87 1cd3 s PRO 34 Cb -0.12 -2.64 -0.02 0.00 0.02 0.00 0.00 34.50 31.75 1cd3 s PRO 34 CO 0.02 -0.31 -0.07 0.14 -0.33 0.00 0.00 177.00 176.45 1cd3 s VAL 35 N -1.46 0.49 0.07 3.83 -7.23 -0.65 -4.96 120.40 110.49 1cd3 s VAL 35 Ca 0.58 -0.73 0.05 0.00 -1.81 0.00 0.00 61.98 60.07 1cd3 s VAL 35 Cb -0.29 -0.51 -0.04 0.00 0.56 0.00 0.00 36.38 36.11 1cd3 s VAL 35 CO 0.36 -0.17 -0.07 -0.63 -0.31 0.00 0.00 175.10 174.28 1cd3 s ILE 36 N -0.86 3.55 -0.20 -0.62 1.01 -1.26 -0.62 121.20 122.21 1cd3 s ILE 36 Ca -0.05 -1.06 -0.39 0.00 0.00 0.00 0.00 60.65 59.15 1cd3 s ILE 36 Cb -0.07 -2.63 -0.16 0.00 0.01 0.00 0.00 42.46 39.62 1cd3 s ILE 36 CO 0.00 0.21 1.66 0.00 0.00 0.00 0.00 174.94 176.81 1cd3 n ALA 37 N 0.97 -0.37 0.00 9.38 0.00 -1.23 0.18 120.51 129.44 1cd3 n ALA 37 Ca -0.14 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1cd3 n ALA 37 Cb 0.52 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1cd3 n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cd3 n GLY 38 N 3.83 2.48 3.55 0.00 0.00 -0.87 -4.83 105.19 109.36 1cd3 n GLY 38 Ca 0.25 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 45.15 1cd3 n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1cd3 n ASP 39 N 0.17 -0.45 -3.96 1.61 9.92 0.13 -4.76 116.55 119.21 1cd3 n ASP 39 Ca 0.00 0.53 -0.30 0.00 -0.53 0.00 0.00 54.79 54.49 1cd3 n ASP 39 Cb 0.00 -1.34 -0.16 0.00 -0.64 0.00 0.00 41.12 38.98 1cd3 n ASP 39 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1cd3 s SER 40 N -1.86 3.40 -0.21 -2.24 0.01 -0.36 -1.14 113.70 111.31 1cd3 s SER 40 Ca 0.67 -0.92 -0.08 0.00 1.31 0.00 0.00 55.95 56.94 1cd3 s SER 40 Cb -0.29 -1.16 -0.04 0.00 0.21 0.00 0.00 66.02 64.74 1cd3 s SER 40 CO 0.57 -0.18 0.07 0.12 0.41 0.00 0.00 173.24 174.24 1cd3 s PHE 41 N 1.44 3.20 -0.08 2.43 5.36 -0.51 0.02 117.98 129.84 1cd3 s PHE 41 Ca -0.02 -0.06 0.02 0.00 -0.96 0.00 0.00 56.93 55.92 1cd3 s PHE 41 Cb -0.17 -2.14 0.01 0.00 -0.34 0.00 0.00 43.02 40.38 1cd3 s PHE 41 CO -0.08 -0.01 -0.15 -1.21 -1.46 0.00 0.00 175.22 172.31 1cd3 s GLU 42 N 0.81 2.07 0.02 10.12 2.02 -0.01 -1.64 118.70 132.09 1cd3 s GLU 42 Ca 0.04 -0.53 0.03 0.00 0.02 0.00 0.00 54.97 54.52 1cd3 s GLU 42 Cb -0.13 -1.68 -0.01 0.00 0.10 0.00 0.00 34.13 32.40 1cd3 s GLU 42 CO 0.02 0.04 -0.09 1.41 0.02 0.00 0.00 175.26 176.66 1cd3 s MET 43 N 0.67 0.62 -0.34 1.61 -2.45 -1.13 -0.36 119.30 117.92 1cd3 s MET 43 Ca -0.14 -0.51 -0.00 0.00 -1.25 0.00 0.00 55.69 53.79 1cd3 s MET 43 Cb -0.16 -0.55 0.14 0.00 1.25 0.00 0.00 34.83 35.51 1cd3 s MET 43 CO 0.04 0.14 0.24 -0.51 1.05 0.00 0.00 175.02 175.97 1cd3 s ASP 44 N -0.79 2.60 -0.11 1.11 1.01 0.11 -1.31 116.67 119.29 1cd3 s ASP 44 Ca -0.01 -1.79 -0.25 0.00 0.71 0.00 0.00 52.55 51.21 1cd3 s ASP 44 Cb -0.06 -0.12 -0.03 0.00 1.01 0.00 0.00 42.92 43.73 1cd3 s ASP 44 CO 0.00 -0.33 0.77 0.00 0.21 0.00 0.00 175.17 175.83 1cd3 s ALA 45 N 1.43 3.40 0.01 5.23 0.00 0.30 -2.59 121.76 129.54 1cd3 s ALA 45 Ca 0.15 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.23 1cd3 s ALA 45 Cb -0.19 -3.10 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 1cd3 s ALA 45 CO -0.09 -0.35 -0.03 0.08 0.00 0.00 0.00 175.76 175.37 1cd3 s VAL 46 N 1.39 0.13 -4.87 0.00 1.01 -1.03 0.47 120.40 117.49 1cd3 s VAL 46 Ca 0.39 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1cd3 s VAL 46 Cb -0.17 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 35.99 1cd3 s VAL 46 CO 0.17 -0.29 0.00 0.61 0.00 0.00 0.00 175.10 175.59 1cd3 n GLY 47 N 2.15 -0.49 3.12 4.51 0.00 -0.69 0.46 105.19 114.24 1cd3 n GLY 47 Ca -0.19 -0.97 -0.14 0.00 0.00 0.00 0.00 46.02 44.72 1cd3 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cd3 s ALA 48 N -1.00 0.83 0.16 4.61 0.00 0.71 -1.33 121.76 125.75 1cd3 s ALA 48 Ca 0.00 -0.97 0.10 0.00 0.00 0.00 0.00 51.96 51.09 1cd3 s ALA 48 Cb 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 1cd3 s ALA 48 CO 0.00 -0.03 -0.18 -1.17 0.00 0.00 0.00 175.76 174.38 1cd3 s LEU 49 N -1.99 2.66 -0.06 0.00 0.20 0.27 -2.07 118.68 117.69 1cd3 s LEU 49 Ca -0.03 -0.69 -0.30 0.00 0.69 0.00 0.00 54.13 53.80 1cd3 s LEU 49 Cb -0.06 -1.42 0.08 0.00 -0.43 0.00 0.00 46.19 44.36 1cd3 s LEU 49 CO -0.00 0.14 0.74 -0.13 -0.29 0.00 0.00 176.35 176.80 1cd3 s ARG 50 N -2.53 0.98 0.65 1.98 0.52 -0.76 -1.13 118.95 118.66 1cd3 s ARG 50 Ca 0.21 0.19 0.01 0.00 -0.52 0.00 0.00 55.73 55.62 1cd3 s ARG 50 Cb -0.09 0.46 0.09 0.00 0.52 0.00 0.00 34.95 35.93 1cd3 s ARG 50 CO 0.11 -0.31 0.90 -0.51 0.02 0.00 0.00 175.30 175.51 1cd3 s LEU 51 N -1.27 3.09 0.56 2.53 1.43 -1.26 -1.73 118.68 122.03 1cd3 s LEU 51 Ca -0.08 -0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 52.74 1cd3 s LEU 51 Cb -0.00 -2.29 0.02 0.00 0.03 0.00 0.00 46.19 43.95 1cd3 s LEU 51 CO 0.07 -1.57 0.82 -0.44 0.23 0.00 0.00 176.35 175.46 1cd3 s SER 52 N -4.62 5.42 0.13 2.29 0.01 -0.94 -4.65 113.70 111.35 1cd3 s SER 52 Ca 0.63 0.34 -0.34 0.00 1.31 0.00 0.00 55.95 57.89 1cd3 s SER 52 Cb -0.07 -1.31 -0.16 0.00 0.21 0.00 0.00 66.02 64.68 1cd3 s SER 52 CO 0.42 -1.09 1.16 -2.65 0.41 0.00 0.00 173.24 171.49 1cd3 n PRO 53 N -2.44 0.97 -3.53 12.44 -0.02 -1.26 -4.80 135.00 136.35 1cd3 n PRO 53 Ca 0.05 0.35 -0.30 0.00 -2.02 0.00 0.00 63.50 61.57 1cd3 n PRO 53 Cb 0.59 -1.85 -0.04 0.00 -0.02 0.00 0.00 33.50 32.17 1cd3 n PRO 53 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1cd3 s LEU 54 N 0.67 4.19 0.13 2.45 1.43 -1.21 -1.28 118.68 125.06 1cd3 s LEU 54 Ca 0.77 0.69 0.01 0.00 -1.03 0.00 0.00 54.13 54.57 1cd3 s LEU 54 Cb -0.93 -3.45 -0.11 0.00 0.03 0.00 0.00 46.19 41.73 1cd3 s LEU 54 CO 0.52 -0.05 1.30 0.03 0.23 0.00 0.00 176.35 178.38 1cd3 h ARG 55 N 2.40 0.20 0.00 1.70 3.08 -1.85 -3.38 114.38 116.52 1cd3 h ARG 55 Ca -0.47 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.33 1cd3 h ARG 55 Cb 1.17 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1cd3 h ARG 55 CO 0.70 1.04 0.00 -2.13 -1.07 0.00 0.00 179.97 178.50 1cd3 n ARG 56 N -3.58 3.86 -2.63 0.04 0.63 -1.26 -4.78 116.66 108.93 1cd3 n ARG 56 Ca -0.04 0.00 -0.23 0.00 -0.92 0.00 0.00 57.85 56.66 1cd3 n ARG 56 Cb 0.88 0.00 0.09 0.00 0.45 0.00 0.00 32.46 33.88 1cd3 n ARG 56 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1cd3 s GLY 57 N -0.14 1.77 0.36 5.14 0.00 -1.26 -0.64 107.32 112.54 1cd3 s GLY 57 Ca 0.00 -1.67 -0.27 0.00 0.00 0.00 0.00 44.72 42.77 1cd3 s GLY 57 CO 0.00 -1.18 1.25 1.08 0.00 0.00 0.00 173.10 174.25 1cd3 s LEU 58 N -5.02 4.34 0.21 0.66 1.02 -1.26 -4.62 118.68 114.00 1cd3 s LEU 58 Ca 0.64 2.55 0.00 0.00 0.02 0.00 0.00 54.13 57.34 1cd3 s LEU 58 Cb -0.06 -3.79 0.00 0.00 0.02 0.00 0.00 46.19 42.36 1cd3 s LEU 58 CO 0.43 -0.59 0.00 0.00 0.02 0.00 0.00 176.35 176.21 1cd3 n ALA 59 N 0.53 2.85 -2.46 4.21 0.00 -1.26 -5.05 120.51 119.33 1cd3 n ALA 59 Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.27 1cd3 n ALA 59 Cb 0.44 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.78 1cd3 n ALA 59 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1cd3 s ILE 60 N -2.00 1.41 0.17 0.00 1.01 -1.26 -5.13 121.20 115.40 1cd3 s ILE 60 Ca 0.00 -1.81 0.07 0.00 0.00 0.00 0.00 60.65 58.91 1cd3 s ILE 60 Cb 0.00 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 1cd3 s ILE 60 CO 0.00 -0.44 -0.01 -1.81 0.00 0.00 0.00 174.94 172.68 1cd3 s ASP 61 N -2.61 4.74 0.31 3.58 1.01 -1.26 -5.00 116.67 117.44 1cd3 s ASP 61 Ca 0.11 -0.41 -0.08 0.00 0.71 0.00 0.00 52.55 52.89 1cd3 s ASP 61 Cb -0.04 -1.00 -0.06 0.00 1.01 0.00 0.00 42.92 42.83 1cd3 s ASP 61 CO 0.04 0.09 0.61 -0.94 0.21 0.00 0.00 175.17 175.18 1cd3 s SER 62 N -2.93 6.52 -0.18 0.27 1.04 -1.26 -4.22 113.70 112.94 1cd3 s SER 62 Ca 0.27 0.89 -0.04 0.00 0.48 0.00 0.00 55.95 57.55 1cd3 s SER 62 Cb -0.09 -2.22 -0.02 0.00 0.10 0.00 0.00 66.02 63.79 1cd3 s SER 62 CO 0.18 -0.22 -0.02 -0.89 0.98 0.00 0.00 173.24 173.27 1cd3 s THR 63 N -2.09 3.87 -0.13 2.02 2.01 0.62 -0.72 115.64 121.22 1cd3 s THR 63 Ca 0.47 -0.35 -0.06 0.00 0.31 0.00 0.00 61.69 62.05 1cd3 s THR 63 Cb -0.11 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 1cd3 s THR 63 CO 0.28 0.46 0.09 -0.69 -0.69 0.00 0.00 174.62 174.07 1cd3 s VAL 64 N 0.72 5.11 -0.09 3.82 1.01 0.17 -2.11 120.40 129.04 1cd3 s VAL 64 Ca -0.01 0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.07 1cd3 s VAL 64 Cb -0.14 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.00 1cd3 s VAL 64 CO 0.02 0.57 -0.20 -1.81 0.00 0.00 0.00 175.10 173.68 1cd3 s ASP 65 N -0.59 2.60 -0.37 3.32 1.11 -0.86 -1.09 116.67 120.79 1cd3 s ASP 65 Ca 0.12 -0.46 0.02 0.00 0.18 0.00 0.00 52.55 52.41 1cd3 s ASP 65 Cb -0.12 -1.19 0.11 0.00 1.07 0.00 0.00 42.92 42.79 1cd3 s ASP 65 CO 0.02 0.11 0.12 -0.63 1.18 0.00 0.00 175.17 175.98 1cd3 s ILE 66 N 0.45 1.85 0.32 0.77 1.01 -0.06 -1.63 121.20 123.91 1cd3 s ILE 66 Ca -0.17 -2.28 -0.13 0.00 0.00 0.00 0.00 60.65 58.07 1cd3 s ILE 66 Cb -0.17 -2.35 -0.08 0.00 0.01 0.00 0.00 42.46 39.87 1cd3 s ILE 66 CO 0.07 -0.69 0.70 -0.36 0.00 0.00 0.00 174.94 174.66 1cd3 s PHE 67 N 0.82 3.40 -0.29 3.97 0.40 -0.33 -3.19 117.98 122.77 1cd3 s PHE 67 Ca 0.13 1.10 -0.04 0.00 -0.60 0.00 0.00 56.93 57.52 1cd3 s PHE 67 Cb -0.20 -2.45 0.10 0.00 0.51 0.00 0.00 43.02 40.97 1cd3 s PHE 67 CO -0.10 0.09 0.12 0.99 0.70 0.00 0.00 175.22 177.02 1cd3 s THR 68 N -2.03 0.07 0.30 0.64 2.01 -0.83 -0.08 115.64 115.72 1cd3 s THR 68 Ca 0.52 -0.82 0.03 0.00 0.31 0.00 0.00 61.69 61.74 1cd3 s THR 68 Cb -0.10 -1.06 -0.03 0.00 0.01 0.00 0.00 72.50 71.32 1cd3 s THR 68 CO 0.21 -0.69 0.45 -0.36 -0.69 0.00 0.00 174.62 173.54 1cd3 s PHE 69 N 2.03 3.43 -0.21 4.92 0.40 0.23 -1.65 117.98 127.13 1cd3 s PHE 69 Ca 0.09 0.11 0.00 0.00 -0.60 0.00 0.00 56.93 56.53 1cd3 s PHE 69 Cb -0.16 -1.76 0.02 0.00 0.51 0.00 0.00 43.02 41.63 1cd3 s PHE 69 CO -0.33 0.25 -0.14 -0.47 0.70 0.00 0.00 175.22 175.22 1cd3 s TYR 70 N -2.15 2.93 -0.35 0.36 5.04 0.45 -1.92 117.35 121.72 1cd3 s TYR 70 Ca 0.38 -1.65 0.03 0.00 -2.44 0.00 0.00 57.07 53.38 1cd3 s TYR 70 Cb -0.09 -1.97 0.10 0.00 0.35 0.00 0.00 41.96 40.35 1cd3 s TYR 70 CO 0.32 -0.77 0.08 0.08 -1.34 0.00 0.00 175.55 173.92 1cd3 s VAL 71 N 1.29 1.88 0.37 3.14 1.01 0.75 -1.53 120.40 127.31 1cd3 s VAL 71 Ca 0.02 -2.15 -0.28 0.00 0.00 0.00 0.00 61.98 59.57 1cd3 s VAL 71 Cb -0.15 -2.39 -0.10 0.00 0.00 0.00 0.00 36.38 33.73 1cd3 s VAL 71 CO -0.09 -0.64 1.42 -2.84 0.00 0.00 0.00 175.10 172.95 1cd3 s PRO 72 N 1.01 4.14 0.41 2.72 0.02 -1.26 -0.93 135.00 141.11 1cd3 s PRO 72 Ca 0.11 2.44 0.09 0.00 0.02 0.00 0.00 61.00 63.66 1cd3 s PRO 72 Cb -0.19 -2.97 0.89 0.00 0.02 0.00 0.00 34.50 32.26 1cd3 s PRO 72 CO -0.12 -0.45 2.02 0.45 -0.33 0.00 0.00 177.00 178.56 1cd3 h HIS 73 N 3.05 0.53 0.00 6.54 3.86 -1.86 -1.66 115.15 125.61 1cd3 h HIS 73 Ca -0.50 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.72 1cd3 h HIS 73 Cb 1.24 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 29.53 1cd3 h HIS 73 CO 0.54 0.30 0.04 -2.13 0.86 0.00 0.00 177.93 177.54 1cd3 n ARG 74 N -4.47 0.00 -0.00 2.45 0.63 -1.26 0.90 116.66 114.90 1cd3 n ARG 74 Ca 0.07 0.21 0.09 0.00 -0.92 0.00 0.00 57.85 57.29 1cd3 n ARG 74 Cb 0.19 -1.54 -0.12 0.00 0.45 0.00 0.00 32.46 31.45 1cd3 n ARG 74 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1cd3 n HIS 75 N -1.17 0.00 -0.04 -0.14 8.25 -0.62 -3.68 115.22 117.81 1cd3 n HIS 75 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.41 1cd3 n HIS 75 Cb 0.04 -0.18 -0.02 0.00 1.12 0.00 0.00 29.99 30.95 1cd3 n HIS 75 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1cd3 n VAL 76 N -1.72 0.99 1.54 1.59 0.31 0.26 -4.46 118.33 116.83 1cd3 n VAL 76 Ca 0.00 0.26 0.15 0.00 -0.01 0.00 0.00 64.34 64.74 1cd3 n VAL 76 Cb 0.36 -1.91 0.78 0.00 -0.91 0.00 0.00 33.84 32.16 1cd3 n VAL 76 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1cd3 n TYR 77 N -3.68 0.00 0.00 3.52 4.02 -0.78 -4.98 117.16 115.26 1cd3 n TYR 77 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.82 1cd3 n TYR 77 Cb 0.27 -0.21 0.00 0.00 -0.02 0.00 0.00 39.34 39.37 1cd3 n TYR 77 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1cd3 n GLY 78 N 1.23 0.00 5.00 2.72 0.00 -1.23 -2.27 105.19 110.64 1cd3 n GLY 78 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1cd3 n GLY 78 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1cd3 n GLU 79 N 0.00 0.00 -0.43 1.61 -0.58 -1.26 -3.75 120.64 116.23 1cd3 n GLU 79 Ca 0.00 0.00 0.37 0.00 -0.42 0.00 0.00 57.16 57.11 1cd3 n GLU 79 Cb 0.00 0.00 0.65 0.00 -0.57 0.00 0.00 31.44 31.52 1cd3 n GLU 79 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 1cd3 h GLN 80 N 0.00 0.04 -0.05 3.49 4.15 -1.86 2.25 115.11 123.13 1cd3 h GLN 80 Ca 0.00 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.39 1cd3 h GLN 80 Cb 0.00 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 27.68 1cd3 h GLN 80 CO 0.00 0.02 -0.07 2.35 -1.93 0.00 0.00 178.83 179.21 1cd3 h TRP 81 N 0.04 0.15 -0.15 3.99 2.91 -1.61 -2.38 115.95 118.90 1cd3 h TRP 81 Ca 0.86 -0.05 0.02 0.00 1.13 0.00 0.00 58.89 60.85 1cd3 h TRP 81 Cb 2.60 -0.03 -0.04 0.00 -0.51 0.00 0.00 29.16 31.18 1cd3 h TRP 81 CO -0.01 0.62 -0.31 0.82 -1.03 0.00 0.00 178.44 178.54 1cd3 h ILE 82 N -0.36 0.00 -0.66 2.65 5.03 0.34 -0.37 117.51 124.14 1cd3 h ILE 82 Ca 0.00 0.00 0.13 0.00 -0.12 0.00 0.00 64.86 64.87 1cd3 h ILE 82 Cb 0.61 0.00 -0.13 0.00 -3.03 0.00 0.00 36.82 34.27 1cd3 h ILE 82 CO 0.02 0.00 -0.20 0.50 -0.68 0.00 0.00 178.15 177.78 1cd3 h LYS 83 N -0.28 -0.03 -0.03 2.37 3.64 -1.26 -1.23 116.57 119.74 1cd3 h LYS 83 Ca 0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1cd3 h LYS 83 Cb 0.36 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1cd3 h LYS 83 CO -0.29 -0.02 -0.05 0.35 -2.27 0.00 0.00 179.45 177.17 1cd3 h PHE 84 N -0.03 -0.15 -0.55 1.91 3.57 -0.56 0.72 116.94 121.85 1cd3 h PHE 84 Ca 0.31 0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.97 1cd3 h PHE 84 Cb 0.51 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 1cd3 h PHE 84 CO -0.56 -0.04 0.57 0.52 -2.23 0.00 0.00 178.31 176.56 1cd3 h MET 85 N -0.04 0.00 0.19 1.11 2.86 -0.87 0.26 114.93 118.44 1cd3 h MET 85 Ca 0.01 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.34 1cd3 h MET 85 Cb 0.05 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.73 1cd3 h MET 85 CO -0.05 0.00 -1.37 -0.22 1.06 0.00 0.00 176.91 176.33 1cd3 h LYS 86 N 0.00 0.40 0.00 1.72 3.64 0.39 -3.31 116.57 119.42 1cd3 h LYS 86 Ca 0.26 -0.69 -0.10 0.00 -1.27 0.00 0.00 60.65 58.85 1cd3 h LYS 86 Cb 1.39 0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 33.45 1cd3 h LYS 86 CO -0.00 1.33 -0.70 -0.44 -2.27 0.00 0.00 179.45 177.36 1cd3 h ASP 87 N 0.11 0.00 0.00 4.20 3.32 0.35 -3.50 116.42 120.91 1cd3 h ASP 87 Ca -0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1cd3 h ASP 87 Cb 2.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.62 1cd3 h ASP 87 CO 0.24 0.42 0.00 0.61 -1.72 0.00 0.00 179.24 178.79 1cd3 n GLY 88 N 1.25 1.37 0.11 2.75 0.00 0.24 -2.34 105.19 108.56 1cd3 n GLY 88 Ca -0.01 -0.50 0.01 0.00 0.00 0.00 0.00 46.02 45.53 1cd3 n GLY 88 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1cd3 n VAL 89 N 0.00 0.00 0.27 1.61 0.31 -1.26 0.23 118.33 119.49 1cd3 n VAL 89 Ca 0.00 0.31 0.09 0.00 -0.01 0.00 0.00 64.34 64.73 1cd3 n VAL 89 Cb 0.00 -0.61 -0.13 0.00 -0.91 0.00 0.00 33.84 32.19 1cd3 n VAL 89 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1cd3 n ASN 90 N -1.19 0.81 -4.75 4.52 3.02 -0.99 -5.00 115.26 111.68 1cd3 n ASN 90 Ca 0.01 -0.30 -0.34 0.00 -0.03 0.00 0.00 54.58 53.92 1cd3 n ASN 90 Cb 0.32 1.56 0.06 0.00 -0.61 0.00 0.00 39.78 41.11 1cd3 n ASN 90 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1cd3 s ALA 91 N -3.08 2.36 0.02 5.41 0.00 0.13 -4.97 121.76 121.63 1cd3 s ALA 91 Ca -0.02 0.73 -0.30 0.00 0.00 0.00 0.00 51.96 52.36 1cd3 s ALA 91 Cb 0.12 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1cd3 s ALA 91 CO 0.75 -1.45 1.00 0.95 0.00 0.00 0.00 175.76 177.01 1cd3 s THR 92 N -2.11 4.75 0.38 0.00 -4.23 -1.26 -4.99 115.64 108.19 1cd3 s THR 92 Ca 0.71 2.01 -0.21 0.00 -1.18 0.00 0.00 61.69 63.02 1cd3 s THR 92 Cb -0.25 -4.29 -0.15 0.00 1.34 0.00 0.00 72.50 69.16 1cd3 s THR 92 CO 0.41 0.18 0.10 -2.65 -0.54 0.00 0.00 174.62 172.11 1cd3 n PRO 93 N 3.76 0.00 -2.31 3.99 -0.01 -1.26 -4.91 135.00 134.26 1cd3 n PRO 93 Ca 0.06 0.00 -0.41 0.00 -0.01 0.00 0.00 63.50 63.14 1cd3 n PRO 93 Cb 0.50 -0.97 -0.03 0.00 -0.01 0.00 0.00 33.50 32.99 1cd3 n PRO 93 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 175.50 174.98 1cd3 s LEU 94 N 4.17 4.47 1.06 2.45 1.43 -1.26 -5.00 118.68 125.99 1cd3 s LEU 94 Ca 0.57 2.38 -0.14 0.00 -1.03 0.00 0.00 54.13 55.92 1cd3 s LEU 94 Cb -0.63 -3.62 0.16 0.00 0.03 0.00 0.00 46.19 42.13 1cd3 s LEU 94 CO 0.60 -0.38 0.68 -0.81 0.23 0.00 0.00 176.35 176.68 1cd3 n PRO 95 N 1.81 -1.35 -4.53 1.29 -0.04 -1.26 -4.95 135.00 125.97 1cd3 n PRO 95 Ca 0.02 -0.36 -0.29 0.00 -0.04 0.00 0.00 63.50 62.84 1cd3 n PRO 95 Cb 0.44 -2.04 -0.07 0.00 -0.04 0.00 0.00 33.50 31.79 1cd3 n PRO 95 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1cd3 n THR 96 N -4.40 0.00 -3.95 0.52 -2.24 -1.26 -3.22 114.28 99.73 1cd3 n THR 96 Ca 0.05 -2.37 -0.10 0.00 -2.27 0.00 0.00 64.05 59.36 1cd3 n THR 96 Cb 0.55 0.65 -0.12 0.00 -2.10 0.00 0.00 70.33 69.32 1cd3 n THR 96 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1cd3 s VAL 97 N -2.94 0.08 0.15 2.28 0.11 -0.20 -4.65 120.40 115.24 1cd3 s VAL 97 Ca 0.10 -0.69 -0.02 0.00 -2.93 0.00 0.00 61.98 58.44 1cd3 s VAL 97 Cb 0.00 -0.21 -0.05 0.00 -1.53 0.00 0.00 36.38 34.60 1cd3 s VAL 97 CO 0.07 -0.38 0.34 0.20 -3.33 0.00 0.00 175.10 172.00 1cd3 s ASN 98 N -1.11 6.41 -0.03 3.54 0.01 -1.26 -1.38 114.94 121.13 1cd3 s ASN 98 Ca -0.12 0.42 0.05 0.00 -0.71 0.00 0.00 52.86 52.49 1cd3 s ASN 98 Cb -0.08 -2.02 -0.01 0.00 0.41 0.00 0.00 41.25 39.56 1cd3 s ASN 98 CO -0.01 0.04 -0.17 0.42 -1.51 0.00 0.00 177.10 175.87 1cd3 s THR 99 N -1.72 1.34 0.39 1.60 -4.23 -0.62 -2.35 115.64 110.06 1cd3 s THR 99 Ca 0.38 -0.70 -0.26 0.00 -1.18 0.00 0.00 61.69 59.94 1cd3 s THR 99 Cb -0.12 -1.13 -0.11 0.00 1.34 0.00 0.00 72.50 72.48 1cd3 s THR 99 CO 0.27 0.38 1.15 0.35 -0.54 0.00 0.00 174.62 176.24 1cd3 n THR 100 N 2.89 2.37 -0.93 3.99 -2.24 -1.26 -4.64 114.28 114.46 1cd3 n THR 100 Ca -0.16 -0.50 -0.28 0.00 -2.27 0.00 0.00 64.05 60.84 1cd3 n THR 100 Cb 0.54 -1.36 -0.02 0.00 -2.10 0.00 0.00 70.33 67.39 1cd3 n THR 100 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1cd3 n GLY 101 N 0.98 3.36 2.85 3.38 0.00 -1.26 -4.83 105.19 109.68 1cd3 n GLY 101 Ca 0.08 -1.05 -0.21 0.00 0.00 0.00 0.00 46.02 44.84 1cd3 n GLY 101 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1cd3 s TYR 102 N 3.27 0.74 0.02 1.61 2.02 -1.26 -5.04 117.35 118.70 1cd3 s TYR 102 Ca 0.48 -0.21 -0.03 0.00 -0.37 0.00 0.00 57.07 56.93 1cd3 s TYR 102 Cb 0.12 -0.73 -0.01 0.00 -0.40 0.00 0.00 41.96 40.95 1cd3 s TYR 102 CO -0.03 -0.25 0.50 -0.89 -1.57 0.00 0.00 175.55 173.31 1cd3 n ILE 103 N 4.45 -0.07 -2.92 2.71 2.08 -1.26 -1.95 119.36 122.40 1cd3 n ILE 103 Ca -0.19 0.76 -0.44 0.00 0.56 0.00 0.00 62.75 63.45 1cd3 n ILE 103 Cb 0.50 -0.99 -0.02 0.00 -0.75 0.00 0.00 39.64 38.38 1cd3 n ILE 103 CO 0.00 0.00 0.00 1.51 0.56 0.00 0.00 176.55 178.62 1cd3 s ASP 104 N -3.50 6.65 0.00 4.38 3.84 -1.26 -2.13 116.67 124.65 1cd3 s ASP 104 Ca -0.01 -2.08 0.00 0.00 -0.00 0.00 0.00 52.55 50.46 1cd3 s ASP 104 Cb 0.01 -2.40 0.00 0.00 -1.38 0.00 0.00 42.92 39.15 1cd3 s ASP 104 CO 0.06 -1.06 0.00 1.57 -0.00 0.00 0.00 175.17 175.74 1cd3 n HIS 105 N 6.56 0.00 -0.27 2.11 -0.00 -0.82 -4.64 115.22 118.16 1cd3 n HIS 105 Ca 0.25 0.00 0.04 0.00 0.46 0.00 0.00 57.72 58.47 1cd3 n HIS 105 Cb 0.49 0.00 0.10 0.00 -0.12 0.00 0.00 29.99 30.45 1cd3 n HIS 105 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1cd3 n ALA 106 N 0.00 2.19 0.04 1.57 0.00 -1.26 -4.66 120.51 118.40 1cd3 n ALA 106 Ca 0.00 -1.35 0.13 0.00 0.00 0.00 0.00 53.44 52.21 1cd3 n ALA 106 Cb 0.00 -0.27 0.59 0.00 0.00 0.00 0.00 19.45 19.77 1cd3 n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1cd3 h ALA 107 N 0.92 2.13 0.00 0.00 0.00 -1.58 -1.86 119.26 118.87 1cd3 h ALA 107 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1cd3 h ALA 107 Cb 0.73 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1cd3 h ALA 107 CO 0.02 -0.22 0.00 1.97 0.00 0.00 0.00 179.25 181.02 1cd3 n PHE 108 N -4.46 0.00 -1.00 0.00 -0.00 -1.13 -1.87 117.46 109.01 1cd3 n PHE 108 Ca 0.06 0.00 0.06 0.00 -0.00 0.00 0.00 57.45 57.57 1cd3 n PHE 108 Cb 0.34 -0.48 0.31 0.00 -0.00 0.00 0.00 39.48 39.64 1cd3 n PHE 108 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 1cd3 n LEU 109 N -1.48 4.62 -3.79 5.98 4.77 -0.70 -2.80 117.00 123.60 1cd3 n LEU 109 Ca 0.05 -3.05 -0.26 0.00 -0.03 0.00 0.00 56.01 52.73 1cd3 n LEU 109 Cb 0.24 -0.61 0.03 0.00 -2.33 0.00 0.00 43.42 40.75 1cd3 n LEU 109 CO 0.19 0.70 0.04 0.61 -1.33 0.00 0.00 177.39 177.59 1cd3 n GLY 110 N -0.18 -0.40 3.19 -0.72 0.00 -0.78 -4.85 105.19 101.44 1cd3 n GLY 110 Ca 0.25 0.17 -0.13 0.00 0.00 0.00 0.00 46.02 46.31 1cd3 n GLY 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1cd3 s THR 111 N -3.47 0.02 -0.05 2.61 -4.23 -1.24 -4.88 115.64 104.40 1cd3 s THR 111 Ca 0.35 -0.19 -0.30 0.00 -1.18 0.00 0.00 61.69 60.37 1cd3 s THR 111 Cb -0.17 -0.47 -0.03 0.00 1.34 0.00 0.00 72.50 73.17 1cd3 s THR 111 CO 0.82 -0.10 1.11 -0.63 -0.54 0.00 0.00 174.62 175.27 1cd3 s ILE 112 N -0.37 4.47 -0.30 2.99 1.01 -1.26 -3.48 121.20 124.25 1cd3 s ILE 112 Ca -0.05 1.77 -0.38 0.00 0.00 0.00 0.00 60.65 61.99 1cd3 s ILE 112 Cb -0.03 -4.14 -0.14 0.00 0.01 0.00 0.00 42.46 38.16 1cd3 s ILE 112 CO 0.01 0.04 1.94 -3.20 0.00 0.00 0.00 174.94 173.74 1cd3 n ASN 113 N 4.80 2.31 -4.62 3.58 2.85 -0.91 -4.87 115.26 118.40 1cd3 n ASN 113 Ca 0.09 0.81 -0.31 0.00 -0.11 0.00 0.00 54.58 55.06 1cd3 n ASN 113 Cb 0.48 -1.19 0.16 0.00 1.24 0.00 0.00 39.78 40.47 1cd3 n ASN 113 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1cd3 n PRO 114 N 6.66 -0.44 0.28 1.20 -0.04 -1.26 -4.82 135.00 136.58 1cd3 n PRO 114 Ca 0.33 -0.06 0.18 0.00 -0.04 0.00 0.00 63.50 63.91 1cd3 n PRO 114 Cb 0.17 -2.28 0.98 0.00 -0.04 0.00 0.00 33.50 32.33 1cd3 n PRO 114 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1cd3 h ASP 115 N -1.84 0.00 0.01 3.54 3.32 -1.94 -1.87 116.42 117.63 1cd3 h ASP 115 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1cd3 h ASP 115 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1cd3 h ASP 115 CO 0.40 0.00 -0.66 0.35 -1.72 0.00 0.00 179.24 177.61 1cd3 n THR 116 N -2.78 0.00 -3.36 0.35 -2.24 -1.26 -4.96 114.28 100.04 1cd3 n THR 116 Ca -0.02 -0.16 -0.18 0.00 -2.27 0.00 0.00 64.05 61.41 1cd3 n THR 116 Cb 0.07 1.13 0.07 0.00 -2.10 0.00 0.00 70.33 69.50 1cd3 n THR 116 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1cd3 n ASN 117 N -0.59 -4.57 -4.17 3.42 3.02 -0.70 -4.89 115.26 106.76 1cd3 n ASN 117 Ca 0.07 -0.48 -0.29 0.00 -0.03 0.00 0.00 54.58 53.85 1cd3 n ASN 117 Cb 0.41 -4.36 -0.17 0.00 -0.61 0.00 0.00 39.78 35.06 1cd3 n ASN 117 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1cd3 s LYS 118 N -5.81 2.40 -0.03 3.52 1.02 -1.26 -1.58 119.74 117.99 1cd3 s LYS 118 Ca 0.34 -0.74 0.00 0.00 0.02 0.00 0.00 55.97 55.60 1cd3 s LYS 118 Cb -0.15 -1.93 0.03 0.00 -0.52 0.00 0.00 37.83 35.25 1cd3 s LYS 118 CO 0.62 0.21 -0.01 0.42 -0.92 0.00 0.00 175.35 175.67 1cd3 s ILE 119 N 0.22 0.24 0.02 2.17 1.01 -0.48 -4.65 121.20 119.74 1cd3 s ILE 119 Ca -0.11 0.05 -0.32 0.00 0.00 0.00 0.00 60.65 60.27 1cd3 s ILE 119 Cb -0.15 -0.33 -0.11 0.00 0.01 0.00 0.00 42.46 41.89 1cd3 s ILE 119 CO 0.05 0.16 1.89 -2.65 0.00 0.00 0.00 174.94 174.39 1cd3 n PRO 120 N 4.15 2.55 -0.17 2.79 -0.02 -1.26 -1.03 135.00 142.01 1cd3 n PRO 120 Ca -0.26 0.93 -0.02 0.00 -2.02 0.00 0.00 63.50 62.14 1cd3 n PRO 120 Cb 0.50 -2.82 -0.01 0.00 -0.02 0.00 0.00 33.50 31.15 1cd3 n PRO 120 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1cd3 n LYS 121 N 6.53 -0.14 -0.27 -0.52 4.81 -1.20 -0.85 118.16 126.53 1cd3 n LYS 121 Ca 0.20 0.67 -0.05 0.00 -0.87 0.00 0.00 58.31 58.26 1cd3 n LYS 121 Cb 0.35 -0.98 0.01 0.00 0.02 0.00 0.00 35.03 34.42 1cd3 n LYS 121 CO 0.00 0.00 0.00 1.12 1.17 0.00 0.00 177.40 179.69 1cd3 h HIS 122 N 0.00 -1.07 -0.80 5.64 2.07 -1.88 0.69 115.15 119.79 1cd3 h HIS 122 Ca 0.12 0.09 0.23 0.00 -2.85 0.00 0.00 60.37 57.96 1cd3 h HIS 122 Cb 0.23 0.58 -0.03 0.00 2.57 0.00 0.00 27.41 30.75 1cd3 h HIS 122 CO -0.41 -0.40 0.72 1.25 -3.07 0.00 0.00 177.93 176.02 1cd3 h LEU 123 N -0.12 0.00 0.00 6.12 5.85 -1.35 0.16 115.31 125.97 1cd3 h LEU 123 Ca 0.26 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.98 1cd3 h LEU 123 Cb 0.56 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.59 1cd3 h LEU 123 CO -0.79 0.00 -0.59 0.33 -0.34 0.00 0.00 178.44 177.05 1cd3 n PHE 124 N -3.83 0.37 -0.28 1.25 7.35 0.22 -4.00 117.46 118.54 1cd3 n PHE 124 Ca 0.17 0.16 0.07 0.00 -0.76 0.00 0.00 57.45 57.08 1cd3 n PHE 124 Cb 1.00 -0.53 0.18 0.00 0.35 0.00 0.00 39.48 40.48 1cd3 n PHE 124 CO 0.00 0.00 0.00 1.96 -0.76 0.00 0.00 176.76 177.96 1cd3 h GLN 125 N -0.78 0.07 -0.40 -4.13 1.08 -0.91 0.45 115.11 110.49 1cd3 h GLN 125 Ca 0.00 -0.00 0.04 0.00 -1.45 0.00 0.00 58.65 57.23 1cd3 h GLN 125 Cb 0.59 -0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.95 1cd3 h GLN 125 CO 0.00 0.05 -0.31 0.78 -0.95 0.00 0.00 178.83 178.40 1cd3 h GLY 126 N 0.07 -1.62 -0.47 3.46 0.00 -0.88 0.17 103.07 103.80 1cd3 h GLY 126 Ca 0.45 0.89 0.05 0.00 0.00 0.00 0.00 47.33 48.72 1cd3 h GLY 126 CO -0.75 -0.44 -0.51 -1.82 0.00 0.00 0.00 176.54 173.02 1cd3 h TYR 127 N -0.09 -1.59 -0.84 5.60 3.20 -1.06 0.05 116.97 122.24 1cd3 h TYR 127 Ca 0.07 0.08 0.21 0.00 3.14 0.00 0.00 58.73 62.23 1cd3 h TYR 127 Cb 0.26 0.76 -0.13 0.00 1.54 0.00 0.00 36.73 39.15 1cd3 h TYR 127 CO -0.86 -0.43 0.21 -0.07 -1.64 0.00 0.00 178.16 175.38 1cd3 h LEU 128 N -0.30 -0.01 -0.01 2.82 3.38 -0.62 0.57 115.31 121.13 1cd3 h LEU 128 Ca 0.08 0.19 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 1cd3 h LEU 128 Cb 0.51 0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1cd3 h LEU 128 CO -0.60 -0.13 0.01 0.78 0.09 0.00 0.00 178.44 178.59 1cd3 h ASN 129 N 0.22 0.02 -0.33 -0.43 2.35 0.11 0.46 115.58 117.97 1cd3 h ASN 129 Ca 0.51 -0.13 0.06 0.00 -0.55 0.00 0.00 56.30 56.19 1cd3 h ASN 129 Cb 0.99 -0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.30 1cd3 h ASN 129 CO -0.62 0.14 -0.02 0.40 -1.65 0.00 0.00 177.43 175.68 1cd3 h ILE 130 N -0.11 0.73 0.08 2.81 2.04 0.11 0.81 117.51 123.98 1cd3 h ILE 130 Ca 0.00 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1cd3 h ILE 130 Cb 0.13 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1cd3 h ILE 130 CO -0.00 0.01 -0.06 0.22 0.00 0.00 0.00 178.15 178.32 1cd3 h TYR 131 N 0.07 -0.16 0.00 1.37 3.20 0.38 -1.76 116.97 120.06 1cd3 h TYR 131 Ca 0.16 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1cd3 h TYR 131 Cb 0.23 0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.56 1cd3 h TYR 131 CO -0.26 -0.10 0.00 0.09 -1.64 0.00 0.00 178.16 176.25 1cd3 n ASN 132 N -5.17 0.57 -0.00 -2.11 3.02 0.16 -2.29 115.26 109.43 1cd3 n ASN 132 Ca -0.07 0.70 0.04 0.00 -0.03 0.00 0.00 54.58 55.21 1cd3 n ASN 132 Cb 0.10 -0.79 -0.05 0.00 -0.61 0.00 0.00 39.78 38.43 1cd3 n ASN 132 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1cd3 n ASN 133 N -2.19 1.29 0.00 6.41 3.02 0.24 -4.77 115.26 119.27 1cd3 n ASN 133 Ca 0.00 -0.45 0.00 0.00 -0.03 0.00 0.00 54.58 54.10 1cd3 n ASN 133 Cb 0.13 1.11 0.00 0.00 -0.61 0.00 0.00 39.78 40.41 1cd3 n ASN 133 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1cd3 n TYR 134 N -1.36 0.00 -0.05 3.10 4.02 -0.74 -4.95 117.16 117.18 1cd3 n TYR 134 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.84 1cd3 n TYR 134 Cb 0.14 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.39 1cd3 n TYR 134 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1cd3 n PHE 135 N -0.10 0.00 -2.68 -0.72 3.01 -1.09 -4.98 117.46 110.89 1cd3 n PHE 135 Ca 0.00 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.10 1cd3 n PHE 135 Cb 0.00 -0.49 -0.05 0.00 -0.01 0.00 0.00 39.48 38.92 1cd3 n PHE 135 CO 0.00 0.00 0.00 -1.59 1.01 0.00 0.00 176.76 176.18 1cd3 s LYS 136 N -2.24 4.39 0.19 -1.08 -2.85 -0.97 -4.33 119.74 112.85 1cd3 s LYS 136 Ca -0.08 1.40 -0.33 0.00 -1.00 0.00 0.00 55.97 55.96 1cd3 s LYS 136 Cb 0.03 -2.65 -0.13 0.00 -2.06 0.00 0.00 37.83 33.02 1cd3 s LYS 136 CO 0.38 0.08 1.64 0.00 0.10 0.00 0.00 175.35 177.55 1cd3 n ALA 137 N 0.21 2.10 0.29 0.59 0.00 -1.26 -4.84 120.51 117.60 1cd3 n ALA 137 Ca 0.04 0.42 0.15 0.00 0.00 0.00 0.00 53.44 54.05 1cd3 n ALA 137 Cb 0.50 -2.43 0.72 0.00 0.00 0.00 0.00 19.45 18.24 1cd3 n ALA 137 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1cd3 h PRO 138 N 6.18 0.00 0.00 0.00 0.13 -1.95 0.17 132.00 136.53 1cd3 h PRO 138 Ca -0.44 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.58 1cd3 h PRO 138 Cb 1.23 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.34 1cd3 h PRO 138 CO 0.91 0.00 -0.51 0.11 -0.23 0.00 0.00 178.00 178.28 1cd3 h TRP 139 N 0.00 0.00 -3.70 1.56 0.09 -2.00 -3.45 115.95 108.45 1cd3 h TRP 139 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 58.89 58.51 1cd3 h TRP 139 Cb 0.21 0.00 0.19 0.00 0.08 0.00 0.00 29.16 29.64 1cd3 h TRP 139 CO 0.00 0.51 0.12 -1.64 0.09 0.00 0.00 178.44 177.53 1cd3 s MET 140 N -3.01 0.05 0.08 0.12 -1.94 0.60 -5.00 119.30 110.19 1cd3 s MET 140 Ca 0.03 0.96 -0.12 0.00 -1.71 0.00 0.00 55.69 54.85 1cd3 s MET 140 Cb 0.08 -1.66 -0.06 0.00 2.01 0.00 0.00 34.83 35.20 1cd3 s MET 140 CO 0.74 -3.11 0.44 -1.25 -0.01 0.00 0.00 175.02 171.83 1cd3 s PRO 141 N -4.64 3.84 0.52 2.03 0.04 -1.26 -4.92 135.00 130.60 1cd3 s PRO 141 Ca 0.67 0.29 -0.18 0.00 0.04 0.00 0.00 61.00 61.82 1cd3 s PRO 141 Cb -0.22 -3.03 -0.12 0.00 0.04 0.00 0.00 34.50 31.17 1cd3 s PRO 141 CO 0.61 0.57 0.23 -0.25 0.04 0.00 0.00 177.00 178.20 1cd3 n ASP 142 N 1.06 -2.22 -4.45 6.66 9.92 -1.26 -4.90 116.55 121.37 1cd3 n ASP 142 Ca -0.09 0.72 -0.43 0.00 -0.53 0.00 0.00 54.79 54.46 1cd3 n ASP 142 Cb 0.52 -1.02 -0.10 0.00 -0.64 0.00 0.00 41.12 39.89 1cd3 n ASP 142 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1cd3 s ARG 143 N -1.54 2.97 -0.59 -1.24 6.06 -1.26 -5.01 118.95 118.33 1cd3 s ARG 143 Ca 0.63 -1.08 0.04 0.00 -2.50 0.00 0.00 55.73 52.83 1cd3 s ARG 143 Cb -0.49 -4.01 0.16 0.00 0.06 0.00 0.00 34.95 30.67 1cd3 s ARG 143 CO 0.60 -0.80 0.39 0.95 -2.50 0.00 0.00 175.30 173.94 1cd3 s THR 144 N 1.68 2.33 0.39 4.11 -4.23 -1.26 -4.96 115.64 113.70 1cd3 s THR 144 Ca 0.05 -3.65 0.06 0.00 -1.18 0.00 0.00 61.69 56.97 1cd3 s THR 144 Cb -0.20 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.08 1cd3 s THR 144 CO 0.09 -0.97 0.54 -1.61 -0.54 0.00 0.00 174.62 172.13 1cd3 s GLU 145 N -0.78 2.98 0.00 3.99 0.41 -1.26 -5.07 118.70 118.96 1cd3 s GLU 145 Ca 0.23 -1.03 0.00 0.00 -0.41 0.00 0.00 54.97 53.76 1cd3 s GLU 145 Cb -0.11 -2.76 0.00 0.00 -1.78 0.00 0.00 34.13 29.49 1cd3 s GLU 145 CO -0.11 -0.13 0.00 0.00 -0.49 0.00 0.00 175.26 174.53 1cd3 n ALA 146 N -1.80 0.00 -2.46 5.21 0.00 -1.26 -5.00 120.51 115.20 1cd3 n ALA 146 Ca 0.03 -0.10 -0.26 0.00 0.00 0.00 0.00 53.44 53.11 1cd3 n ALA 146 Cb 0.58 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.90 1cd3 n ALA 146 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1cd3 s ASN 147 N -2.44 2.72 0.27 0.00 0.01 -1.26 -4.95 114.94 109.29 1cd3 s ASN 147 Ca 0.00 -0.61 0.21 0.00 -0.71 0.00 0.00 52.86 51.74 1cd3 s ASN 147 Cb 0.00 -0.20 0.92 0.00 0.41 0.00 0.00 41.25 42.38 1cd3 s ASN 147 CO 0.00 0.15 0.95 -2.65 -1.51 0.00 0.00 177.10 174.04 1cd3 n PRO 148 N 1.48 -0.02 -0.13 -0.60 -0.01 -1.02 -1.80 135.00 132.91 1cd3 n PRO 148 Ca -0.18 0.76 -0.01 0.00 -0.01 0.00 0.00 63.50 64.05 1cd3 n PRO 148 Cb 0.53 -1.51 -0.00 0.00 -0.01 0.00 0.00 33.50 32.51 1cd3 n PRO 148 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 175.50 175.58 1cd3 n ASN 149 N -3.84 -0.26 0.17 2.55 3.02 -0.99 0.18 115.26 116.09 1cd3 n ASN 149 Ca 0.25 0.58 0.16 0.00 -0.03 0.00 0.00 54.58 55.54 1cd3 n ASN 149 Cb 0.97 -0.11 0.77 0.00 -0.61 0.00 0.00 39.78 40.80 1cd3 n ASN 149 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1cd3 h GLU 150 N 0.00 0.00 -6.89 3.52 5.08 -1.69 -3.43 114.58 111.17 1cd3 h GLU 150 Ca 0.09 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.95 1cd3 h GLU 150 Cb 0.18 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.46 1cd3 h GLU 150 CO -0.32 0.00 0.50 -0.51 -1.00 0.00 0.00 179.01 177.68 1cd3 s LEU 151 N -8.12 4.33 0.31 1.33 1.43 0.47 -5.03 118.68 113.41 1cd3 s LEU 151 Ca -0.05 2.33 -0.23 0.00 -1.03 0.00 0.00 54.13 55.15 1cd3 s LEU 151 Cb 0.17 -3.86 -0.09 0.00 0.03 0.00 0.00 46.19 42.43 1cd3 s LEU 151 CO 0.61 -0.46 0.86 0.54 0.23 0.00 0.00 176.35 178.13 1cd3 s ASN 152 N -1.02 7.15 0.00 2.29 4.22 -1.26 -4.73 114.94 121.59 1cd3 s ASN 152 Ca 0.52 1.64 0.00 0.00 -2.14 0.00 0.00 52.86 52.88 1cd3 s ASN 152 Cb -0.31 -2.51 0.00 0.00 1.28 0.00 0.00 41.25 39.71 1cd3 s ASN 152 CO 0.40 -0.09 0.34 0.00 -2.04 0.00 0.00 177.10 175.71 1cd3 n GLN 153 N 0.37 0.00 -0.19 3.55 6.02 -1.26 0.22 117.38 126.09 1cd3 n GLN 153 Ca 0.01 0.34 -0.00 0.00 -0.01 0.00 0.00 57.00 57.34 1cd3 n GLN 153 Cb 0.51 -0.56 0.03 0.00 1.02 0.00 0.00 30.24 31.24 1cd3 n GLN 153 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1cd3 n ASP 154 N -1.67 -0.31 -0.09 1.08 8.00 -1.26 0.45 116.55 122.75 1cd3 n ASP 154 Ca 0.00 0.88 -0.11 0.00 0.71 0.00 0.00 54.79 56.27 1cd3 n ASP 154 Cb 0.00 -0.21 -0.04 0.00 -0.02 0.00 0.00 41.12 40.86 1cd3 n ASP 154 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1cd3 h ASP 155 N 0.00 0.40 0.94 -2.24 5.19 -0.45 -1.09 116.42 119.17 1cd3 h ASP 155 Ca 0.18 -0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1cd3 h ASP 155 Cb 0.31 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.71 1cd3 h ASP 155 CO -0.50 0.52 -0.26 0.00 -3.12 0.00 0.00 179.24 175.89 1cd3 n ALA 156 N -2.30 2.75 -0.11 3.45 0.00 0.17 -3.90 120.51 120.58 1cd3 n ALA 156 Ca -0.03 -0.18 -0.12 0.00 0.00 0.00 0.00 53.44 53.11 1cd3 n ALA 156 Cb 0.18 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 18.16 1cd3 n ALA 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1cd3 n ARG 157 N -1.78 0.68 -2.52 0.00 1.74 0.12 -2.82 116.66 112.07 1cd3 n ARG 157 Ca 0.06 0.05 -0.11 0.00 -0.77 0.00 0.00 57.85 57.07 1cd3 n ARG 157 Cb 0.38 -1.53 -0.00 0.00 -1.02 0.00 0.00 32.46 30.29 1cd3 n ARG 157 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1cd3 n PHE 158 N -2.91 -1.04 -2.00 -1.55 0.99 -0.42 -4.50 117.46 106.04 1cd3 n PHE 158 Ca -0.36 -1.00 -0.29 0.00 -0.00 0.00 0.00 57.45 55.80 1cd3 n PHE 158 Cb 1.11 -0.19 0.14 0.00 -1.00 0.00 0.00 39.48 39.54 1cd3 n PHE 158 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1cd3 s GLY 159 N -2.65 1.72 0.00 1.37 0.00 -1.26 -4.52 107.32 101.97 1cd3 s GLY 159 Ca 0.13 -1.07 0.00 0.00 0.00 0.00 0.00 44.72 43.78 1cd3 s GLY 159 CO 0.08 -0.42 0.00 0.69 0.00 0.00 0.00 173.10 173.45 1cd3 n PHE 160 N -3.50 0.00 -3.72 1.90 3.01 -1.23 -4.48 117.46 109.44 1cd3 n PHE 160 Ca 0.13 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.44 1cd3 n PHE 160 Cb 0.60 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.93 1cd3 n PHE 160 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1cd3 s ARG 161 N 0.00 0.10 0.47 -1.08 0.52 -1.26 -4.06 118.95 113.64 1cd3 s ARG 161 Ca 0.00 0.48 0.07 0.00 -0.52 0.00 0.00 55.73 55.76 1cd3 s ARG 161 Cb 0.00 -0.18 0.00 0.00 0.52 0.00 0.00 34.95 35.29 1cd3 s ARG 161 CO 0.00 -0.21 0.41 0.00 0.02 0.00 0.00 175.30 175.52 1cd3 s HIS 164 N -3.13 2.20 0.42 0.00 3.76 -1.11 -4.86 115.29 112.57 1cd3 s HIS 164 Ca 0.57 1.29 -0.26 0.00 -0.15 0.00 0.00 55.06 56.51 1cd3 s HIS 164 Cb -0.11 -3.17 -0.09 0.00 1.11 0.00 0.00 32.58 30.33 1cd3 s HIS 164 CO 0.45 -2.53 1.41 -0.51 -0.85 0.00 0.00 174.74 172.72 1cd3 s LEU 165 N -6.32 4.18 -0.06 0.89 1.43 -1.26 -4.78 118.68 112.76 1cd3 s LEU 165 Ca 0.64 2.89 -0.40 0.00 -1.03 0.00 0.00 54.13 56.23 1cd3 s LEU 165 Cb -0.19 -3.86 -0.19 0.00 0.03 0.00 0.00 46.19 41.98 1cd3 s LEU 165 CO 0.58 -1.03 1.28 0.29 0.23 0.00 0.00 176.35 177.69 1cd3 n LYS 166 N 0.03 0.46 -3.57 1.70 4.01 -1.26 -4.83 118.16 114.70 1cd3 n LYS 166 Ca 0.04 0.16 -0.17 0.00 -0.51 0.00 0.00 58.31 57.84 1cd3 n LYS 166 Cb 0.42 -1.73 -0.06 0.00 -0.51 0.00 0.00 35.03 33.15 1cd3 n LYS 166 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 1cd3 s ASN 167 N 0.86 -0.66 0.26 4.39 3.84 -1.26 -4.97 114.94 117.39 1cd3 s ASN 167 Ca 0.91 0.89 0.08 0.00 0.21 0.00 0.00 52.86 54.96 1cd3 s ASN 167 Cb -1.19 0.79 0.46 0.00 -0.55 0.00 0.00 41.25 40.76 1cd3 s ASN 167 CO 0.58 -0.49 1.10 0.00 -2.79 0.00 0.00 177.10 175.49 1cd3 n ILE 168 N 1.45 0.57 0.01 -5.21 3.06 -1.26 -0.29 119.36 117.69 1cd3 n ILE 168 Ca -0.18 0.70 0.00 0.00 -2.50 0.00 0.00 62.75 60.77 1cd3 n ILE 168 Cb 0.56 -1.70 -0.01 0.00 0.54 0.00 0.00 39.64 39.04 1cd3 n ILE 168 CO 0.00 0.00 0.00 -2.67 -2.50 0.00 0.00 176.55 171.38 1cd3 n TRP 169 N -1.84 0.00 0.43 9.51 4.27 -1.26 -4.69 117.44 123.86 1cd3 n TRP 169 Ca -0.01 0.00 0.11 0.00 -3.89 0.00 0.00 57.50 53.71 1cd3 n TRP 169 Cb 0.38 -0.01 -0.08 0.00 -1.36 0.00 0.00 31.31 30.24 1cd3 n TRP 169 CO 0.00 0.00 0.00 0.25 -2.29 0.00 0.00 177.69 175.65 1cd3 n THR 170 N -1.38 0.10 -3.09 -1.67 -2.24 0.60 -4.63 114.28 101.97 1cd3 n THR 170 Ca -0.00 -0.30 -0.18 0.00 -2.27 0.00 0.00 64.05 61.29 1cd3 n THR 170 Cb 0.02 0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.49 1cd3 n THR 170 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cd3 n ALA 171 N -1.93 1.50 -1.35 6.98 0.00 -0.34 -4.69 120.51 120.68 1cd3 n ALA 171 Ca 0.00 -2.97 -0.19 0.00 0.00 0.00 0.00 53.44 50.28 1cd3 n ALA 171 Cb 0.47 -0.95 0.22 0.00 0.00 0.00 0.00 19.45 19.19 1cd3 n ALA 171 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1cd3 n PRO 172 N 0.94 -2.38 -0.85 0.00 -0.05 -1.26 -4.78 135.00 126.61 1cd3 n PRO 172 Ca 0.19 -1.76 -0.32 0.00 -0.05 0.00 0.00 63.50 61.56 1cd3 n PRO 172 Cb 0.60 -1.46 0.15 0.00 -0.05 0.00 0.00 33.50 32.75 1cd3 n PRO 172 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 175.50 176.73 1cd3 n LEU 173 N 0.00 3.76 -4.74 1.53 4.77 -0.97 -4.87 117.00 116.49 1cd3 n LEU 173 Ca 0.15 0.49 -0.42 0.00 -0.03 0.00 0.00 56.01 56.20 1cd3 n LEU 173 Cb 0.55 -1.49 -0.02 0.00 -2.33 0.00 0.00 43.42 40.13 1cd3 n LEU 173 CO 0.39 -1.98 1.24 -2.16 -1.33 0.00 0.00 177.39 173.55 1cd3 s PRO 174 N -4.41 4.17 0.00 3.23 0.04 -1.26 -4.66 135.00 132.10 1cd3 s PRO 174 Ca 0.70 2.49 0.00 0.00 0.04 0.00 0.00 61.00 64.23 1cd3 s PRO 174 Cb -0.26 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.21 1cd3 s PRO 174 CO 0.55 -0.61 0.20 -0.35 0.04 0.00 0.00 177.00 176.83 1cd3 n PRO 175 N 2.91 0.00 -0.41 0.56 -0.04 -1.26 -1.19 135.00 135.56 1cd3 n PRO 175 Ca 0.10 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.57 1cd3 n PRO 175 Cb 0.38 -1.31 0.01 0.00 -0.04 0.00 0.00 33.50 32.54 1cd3 n PRO 175 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1cd3 n GLU 176 N -0.63 0.12 -1.76 0.54 4.71 -1.26 -5.03 120.64 117.33 1cd3 n GLU 176 Ca 0.00 -1.07 -0.42 0.00 -0.01 0.00 0.00 57.16 55.66 1cd3 n GLU 176 Cb 0.00 -0.58 -0.03 0.00 -1.01 0.00 0.00 31.44 29.82 1cd3 n GLU 176 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1cd3 s THR 177 N -0.22 2.27 0.19 2.62 -4.23 -0.33 -4.86 115.64 111.09 1cd3 s THR 177 Ca 0.02 0.10 -0.32 0.00 -1.18 0.00 0.00 61.69 60.32 1cd3 s THR 177 Cb 0.02 -3.07 -0.15 0.00 1.34 0.00 0.00 72.50 70.64 1cd3 s THR 177 CO 0.00 0.01 1.19 -0.62 -0.54 0.00 0.00 174.62 174.66 1cd3 n GLU 178 N 4.47 1.34 -0.07 3.99 1.02 -1.26 -4.88 120.64 125.24 1cd3 n GLU 178 Ca 0.16 0.48 0.09 0.00 -0.02 0.00 0.00 57.16 57.87 1cd3 n GLU 178 Cb 0.37 -1.99 0.12 0.00 -0.02 0.00 0.00 31.44 29.92 1cd3 n GLU 178 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1cd3 n LEU 179 N 1.98 2.77 -3.86 -4.62 7.99 -1.26 -4.78 117.00 115.22 1cd3 n LEU 179 Ca 0.14 -1.25 0.03 0.00 -0.01 0.00 0.00 56.01 54.92 1cd3 n LEU 179 Cb 0.26 -0.10 0.01 0.00 -0.11 0.00 0.00 43.42 43.48 1cd3 n LEU 179 CO 0.61 0.55 1.13 -0.94 -1.51 0.00 0.00 177.39 177.23 1cd3 s SER 180 N -1.39 -0.01 -0.20 -1.43 1.04 -1.26 -4.89 113.70 105.56 1cd3 s SER 180 Ca 0.26 -0.12 -0.09 0.00 0.48 0.00 0.00 55.95 56.47 1cd3 s SER 180 Cb 0.16 0.10 0.08 0.00 0.10 0.00 0.00 66.02 66.46 1cd3 s SER 180 CO 0.24 -0.20 0.45 -0.60 0.98 0.00 0.00 173.24 174.11 1cd3 s ARG 181 N -2.09 0.40 0.28 4.02 6.06 -1.26 -5.16 118.95 121.19 1cd3 s ARG 181 Ca 0.25 0.95 0.07 0.00 -2.50 0.00 0.00 55.73 54.49 1cd3 s ARG 181 Cb 0.02 0.16 -0.03 0.00 0.06 0.00 0.00 34.95 35.16 1cd3 s ARG 181 CO -0.03 -0.19 0.27 -1.14 -2.50 0.00 0.00 175.30 171.71 1cd3 s GLN 182 N 1.93 2.98 -0.28 5.12 0.74 -1.26 -5.10 119.66 123.79 1cd3 s GLN 182 Ca -0.07 -1.06 -0.03 0.00 0.05 0.00 0.00 55.36 54.26 1cd3 s GLN 182 Cb -0.10 -2.62 0.11 0.00 1.10 0.00 0.00 33.01 31.51 1cd3 s GLN 182 CO -0.14 0.30 0.20 1.41 -0.55 0.00 0.00 175.29 176.52 1cd3 s MET 183 N -3.93 0.24 0.29 1.67 -2.45 -1.26 -5.13 119.30 108.73 1cd3 s MET 183 Ca 0.36 -0.29 -0.26 0.00 -1.25 0.00 0.00 55.69 54.25 1cd3 s MET 183 Cb -0.08 -0.98 -0.16 0.00 1.25 0.00 0.00 34.83 34.86 1cd3 s MET 183 CO 0.27 -0.98 0.44 0.25 1.05 0.00 0.00 175.02 176.05 1cd3 n THR 184 N 5.28 1.60 -3.89 10.11 -2.24 -1.26 -4.98 114.28 118.89 1cd3 n THR 184 Ca -0.04 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.14 1cd3 n THR 184 Cb 0.45 -0.14 -0.06 0.00 -2.10 0.00 0.00 70.33 68.48 1cd3 n THR 184 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1cd3 s THR 185 N -1.24 0.06 0.53 4.28 -4.23 -1.26 -4.99 115.64 108.79 1cd3 s THR 185 Ca 0.62 -1.20 -0.20 0.00 -1.18 0.00 0.00 61.69 59.73 1cd3 s THR 185 Cb -0.79 -1.73 -0.06 0.00 1.34 0.00 0.00 72.50 71.25 1cd3 s THR 185 CO 0.58 -0.27 1.15 -0.55 -0.54 0.00 0.00 174.62 175.00 1cd3 s SER 186 N -2.93 5.72 0.63 3.99 0.15 -1.22 -4.89 113.70 115.15 1cd3 s SER 186 Ca 0.14 2.24 0.37 0.00 0.70 0.00 0.00 55.95 59.41 1cd3 s SER 186 Cb 0.02 -2.59 2.11 0.00 -1.71 0.00 0.00 66.02 63.86 1cd3 s SER 186 CO -0.02 -1.22 2.31 0.71 1.20 0.00 0.00 173.24 176.22 1cd3 h THR 187 N 1.29 0.27 -1.32 6.45 1.35 -2.04 -3.24 112.91 115.65 1cd3 h THR 187 Ca -0.50 -0.02 -0.40 0.00 -0.55 0.00 0.00 66.41 64.94 1cd3 h THR 187 Cb 1.27 1.01 -0.39 0.00 -1.73 0.00 0.00 68.15 68.31 1cd3 h THR 187 CO 0.57 0.00 -1.15 0.35 -0.25 0.00 0.00 175.52 175.04 1cd3 n THR 188 N -3.46 0.49 0.00 6.82 -2.24 -1.26 -5.09 114.28 109.54 1cd3 n THR 188 Ca -0.03 -3.55 0.00 0.00 -2.27 0.00 0.00 64.05 58.20 1cd3 n THR 188 Cb 0.08 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 1cd3 n THR 188 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1cd3 n SER 189 N 0.06 0.00 -4.89 3.42 3.41 -1.23 -5.15 113.62 109.25 1cd3 n SER 189 Ca 0.15 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.41 1cd3 n SER 189 Cb 0.76 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.65 1cd3 n SER 189 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1cd3 s ILE 190 N 0.00 5.42 -0.88 -1.33 1.01 -1.26 -3.42 121.20 120.73 1cd3 s ILE 190 Ca 0.00 0.08 -0.21 0.00 0.00 0.00 0.00 60.65 60.52 1cd3 s ILE 190 Cb 0.00 -3.50 0.09 0.00 0.01 0.00 0.00 42.46 39.06 1cd3 s ILE 190 CO 0.00 0.44 1.18 -0.62 0.00 0.00 0.00 174.94 175.94 1cd3 s ASP 191 N -1.54 6.48 0.14 3.58 2.15 -1.26 -4.88 116.67 121.33 1cd3 s ASP 191 Ca 0.23 -1.60 -0.20 0.00 0.43 0.00 0.00 52.55 51.41 1cd3 s ASP 191 Cb -0.13 -2.45 0.03 0.00 -0.30 0.00 0.00 42.92 40.07 1cd3 s ASP 191 CO 0.13 -1.29 1.16 -0.38 -0.17 0.00 0.00 175.17 174.62 1cd3 n ILE 192 N 5.96 -0.47 -0.29 4.11 5.41 -1.26 0.11 119.36 132.93 1cd3 n ILE 192 Ca 0.19 1.80 0.11 0.00 1.00 0.00 0.00 62.75 65.85 1cd3 n ILE 192 Cb 0.49 -2.27 0.25 0.00 -0.71 0.00 0.00 39.64 37.40 1cd3 n ILE 192 CO 0.00 0.00 0.00 0.24 0.00 0.00 0.00 176.55 176.79 1cd3 h MET 193 N 0.00 0.18 0.18 0.38 2.86 -2.01 -1.23 114.93 115.29 1cd3 h MET 193 Ca 0.17 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 1cd3 h MET 193 Cb 0.36 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.98 1cd3 h MET 193 CO -0.72 0.12 -0.09 0.78 1.06 0.00 0.00 176.91 178.06 1cd3 h GLY 194 N 0.18 -0.25 -1.11 8.32 0.00 0.38 -2.86 103.07 107.72 1cd3 h GLY 194 Ca 0.52 0.09 0.44 0.00 0.00 0.00 0.00 47.33 48.38 1cd3 h GLY 194 CO -0.66 -0.09 0.65 -2.00 0.00 0.00 0.00 176.54 174.44 1cd3 h LEU 195 N -0.58 0.28 0.14 3.11 6.46 -0.10 0.48 115.31 125.11 1cd3 h LEU 195 Ca -0.02 0.23 -0.01 0.00 -0.12 0.00 0.00 57.88 57.96 1cd3 h LEU 195 Cb 0.43 0.24 0.00 0.00 -0.73 0.00 0.00 40.66 40.60 1cd3 h LEU 195 CO 0.04 -0.38 -0.07 -0.61 -0.62 0.00 0.00 178.44 176.80 1cd3 h GLN 196 N 0.00 -0.19 -1.35 1.25 4.15 -1.19 -0.93 115.11 116.86 1cd3 h GLN 196 Ca 0.86 0.01 0.47 0.00 0.77 0.00 0.00 58.65 60.76 1cd3 h GLN 196 Cb 2.43 0.04 -0.14 0.00 0.21 0.00 0.00 27.48 30.03 1cd3 h GLN 196 CO -0.68 -0.12 0.86 0.00 -1.93 0.00 0.00 178.83 176.96 1cd3 h ALA 197 N -1.88 2.78 0.36 3.38 0.00 -0.45 1.41 119.26 124.86 1cd3 h ALA 197 Ca -0.02 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1cd3 h ALA 197 Cb 0.15 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1cd3 h ALA 197 CO 0.03 -1.47 -0.18 0.00 0.00 0.00 0.00 179.25 177.64 1cd3 h ALA 198 N 1.63 -0.49 -0.42 0.00 0.00 0.04 -0.11 119.26 119.92 1cd3 h ALA 198 Ca 0.87 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.64 1cd3 h ALA 198 Cb 2.75 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 20.71 1cd3 h ALA 198 CO -0.47 -0.71 0.28 1.88 0.00 0.00 0.00 179.25 180.22 1cd3 h TYR 199 N -0.62 0.52 -0.59 0.00 -1.99 0.32 -1.98 116.97 112.63 1cd3 h TYR 199 Ca -0.05 0.01 0.11 0.00 2.00 0.00 0.00 58.73 60.81 1cd3 h TYR 199 Cb 0.45 -0.18 -0.12 0.00 2.00 0.00 0.00 36.73 38.89 1cd3 h TYR 199 CO -0.02 0.33 -0.24 0.00 -0.00 0.00 0.00 178.16 178.23 1cd3 h ALA 200 N 1.15 0.19 -0.25 3.88 0.00 -0.42 0.11 119.26 123.93 1cd3 h ALA 200 Ca 0.15 0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.32 1cd3 h ALA 200 Cb -0.06 0.61 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1cd3 h ALA 200 CO -0.03 -0.55 -0.08 -0.97 0.00 0.00 0.00 179.25 177.61 1cd3 h ASN 201 N -0.09 -0.30 -0.13 0.00 -1.24 -0.34 -2.67 115.58 110.82 1cd3 h ASN 201 Ca 0.27 0.08 0.02 0.00 0.71 0.00 0.00 56.30 57.38 1cd3 h ASN 201 Cb 0.51 0.18 -0.03 0.00 0.73 0.00 0.00 38.32 39.71 1cd3 h ASN 201 CO -0.65 -0.11 -0.19 0.25 -1.29 0.00 0.00 177.43 175.44 1cd3 h LEU 202 N -0.03 -0.63 -0.20 0.34 6.46 -0.30 0.47 115.31 121.42 1cd3 h LEU 202 Ca 0.12 0.08 0.02 0.00 -0.12 0.00 0.00 57.88 57.98 1cd3 h LEU 202 Cb 0.22 0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 40.39 1cd3 h LEU 202 CO -0.28 -0.14 -0.12 1.41 -0.62 0.00 0.00 178.44 178.70 1cd3 n HIS 203 N -3.60 -0.09 -0.12 1.25 8.25 -0.82 -0.21 115.22 119.87 1cd3 n HIS 203 Ca -0.01 0.25 -0.05 0.00 -0.26 0.00 0.00 57.72 57.65 1cd3 n HIS 203 Cb 0.12 -0.49 0.01 0.00 1.12 0.00 0.00 29.99 30.74 1cd3 n HIS 203 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1cd3 h THR 204 N 0.00 0.43 -0.09 1.59 1.03 -1.22 -1.50 112.91 113.15 1cd3 h THR 204 Ca 0.03 0.00 0.02 0.00 -0.01 0.00 0.00 66.41 66.45 1cd3 h THR 204 Cb 0.08 0.43 -0.05 0.00 -1.07 0.00 0.00 68.15 67.55 1cd3 h THR 204 CO -0.19 0.00 -0.39 0.44 -0.01 0.00 0.00 175.52 175.37 1cd3 h ASP 205 N -0.11 -1.23 0.00 0.00 5.19 0.52 -0.72 116.42 120.08 1cd3 h ASP 205 Ca 0.20 0.14 0.00 0.00 -0.62 0.00 0.00 57.03 56.75 1cd3 h ASP 205 Cb 0.42 0.48 0.00 0.00 0.18 0.00 0.00 39.33 40.41 1cd3 h ASP 205 CO -0.48 -0.35 0.00 0.00 -3.12 0.00 0.00 179.24 175.29 1cd3 n GLN 206 N -4.60 0.00 0.00 3.56 6.02 0.70 -1.66 117.38 121.40 1cd3 n GLN 206 Ca -0.04 0.27 0.00 0.00 -0.01 0.00 0.00 57.00 57.22 1cd3 n GLN 206 Cb 0.27 -0.63 0.00 0.00 1.02 0.00 0.00 30.24 30.90 1cd3 n GLN 206 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1cd3 n GLU 207 N -0.65 0.00 0.16 -1.09 2.13 -0.69 0.29 120.64 120.78 1cd3 n GLU 207 Ca 0.00 0.60 0.00 0.00 0.66 0.00 0.00 57.16 58.42 1cd3 n GLU 207 Cb 0.00 -0.96 0.00 0.00 0.27 0.00 0.00 31.44 30.75 1cd3 n GLU 207 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1cd3 n ARG 208 N -2.07 0.01 -0.11 5.31 0.63 -0.29 0.92 116.66 121.07 1cd3 n ARG 208 Ca 0.00 0.45 -0.24 0.00 -0.92 0.00 0.00 57.85 57.14 1cd3 n ARG 208 Cb 0.00 -1.99 -0.11 0.00 0.45 0.00 0.00 32.46 30.81 1cd3 n ARG 208 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1cd3 n ASP 209 N -1.61 1.93 0.00 6.15 9.92 0.14 -4.06 116.55 129.03 1cd3 n ASP 209 Ca 0.00 0.32 0.00 0.00 -0.53 0.00 0.00 54.79 54.58 1cd3 n ASP 209 Cb 0.67 -0.86 0.00 0.00 -0.64 0.00 0.00 41.12 40.29 1cd3 n ASP 209 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1cd3 n TYR 210 N -4.17 0.00 -3.04 1.24 4.02 0.15 -4.66 117.16 110.70 1cd3 n TYR 210 Ca -0.42 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.03 1cd3 n TYR 210 Cb 0.82 -0.42 -0.03 0.00 -0.02 0.00 0.00 39.34 39.69 1cd3 n TYR 210 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1cd3 s PHE 211 N -0.84 3.20 0.00 -0.72 2.99 0.26 -4.79 117.98 118.10 1cd3 s PHE 211 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 56.93 55.55 1cd3 s PHE 211 Cb 0.00 -4.14 0.00 0.00 0.00 0.00 0.00 43.02 38.88 1cd3 s PHE 211 CO 0.00 -1.36 0.00 -0.12 -0.00 0.00 0.00 175.22 173.74 1cd3 n MET 212 N 6.04 0.00 0.00 0.44 1.56 -1.25 -2.96 117.12 120.95 1cd3 n MET 212 Ca 0.14 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.57 1cd3 n MET 212 Cb 0.47 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.84 1cd3 n MET 212 CO 0.00 0.00 0.00 1.04 -0.73 0.00 0.00 175.97 176.28 1cd3 n GLN 213 N -1.85 0.00 -2.21 2.12 6.02 -1.26 -4.40 117.38 115.80 1cd3 n GLN 213 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.64 1cd3 n GLN 213 Cb 0.00 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.27 1cd3 n GLN 213 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1cd3 s ARG 214 N 0.00 3.31 0.14 -1.09 0.52 -1.26 -4.94 118.95 115.63 1cd3 s ARG 214 Ca 0.00 1.67 -0.29 0.00 -0.52 0.00 0.00 55.73 56.59 1cd3 s ARG 214 Cb 0.00 -2.02 -0.05 0.00 0.52 0.00 0.00 34.95 33.40 1cd3 s ARG 214 CO 0.00 -0.90 1.57 -0.92 0.02 0.00 0.00 175.30 175.07 1cd3 h TYR 215 N 1.20 -1.32 -0.52 -0.53 -0.00 -2.00 -1.87 116.97 111.94 1cd3 h TYR 215 Ca -0.50 0.06 0.05 0.00 -0.00 0.00 0.00 58.73 58.34 1cd3 h TYR 215 Cb 1.27 0.61 -0.06 0.00 -0.00 0.00 0.00 36.73 38.55 1cd3 h TYR 215 CO 0.50 -0.47 -0.31 0.54 -0.00 0.00 0.00 178.16 178.42 1cd3 n ARG 216 N -5.42 -0.23 -0.23 1.82 1.74 -1.26 0.54 116.66 113.62 1cd3 n ARG 216 Ca -0.03 1.09 0.12 0.00 -0.77 0.00 0.00 57.85 58.26 1cd3 n ARG 216 Cb 0.36 -1.61 0.24 0.00 -1.02 0.00 0.00 32.46 30.43 1cd3 n ARG 216 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1cd3 n ASP 217 N -4.21 -0.01 0.07 0.55 8.00 -0.71 0.57 116.55 120.81 1cd3 n ASP 217 Ca 0.01 1.14 -0.03 0.00 0.71 0.00 0.00 54.79 56.62 1cd3 n ASP 217 Cb 0.13 -0.45 -0.02 0.00 -0.02 0.00 0.00 41.12 40.77 1cd3 n ASP 217 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1cd3 h VAL 218 N 0.00 0.00 -0.92 2.53 2.07 0.10 0.26 116.25 120.29 1cd3 h VAL 218 Ca 0.44 -0.17 0.35 0.00 0.82 0.00 0.00 66.70 68.14 1cd3 h VAL 218 Cb 0.99 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.59 1cd3 h VAL 218 CO -0.61 0.00 0.36 0.00 0.02 0.00 0.00 177.57 177.33 1cd3 n ILE 219 N -3.04 -0.39 -0.09 4.57 0.13 0.22 0.16 119.36 120.91 1cd3 n ILE 219 Ca -0.03 1.92 -0.13 0.00 -1.10 0.00 0.00 62.75 63.42 1cd3 n ILE 219 Cb 0.08 -3.03 -0.04 0.00 -0.84 0.00 0.00 39.64 35.81 1cd3 n ILE 219 CO 0.00 0.00 0.00 0.77 2.80 0.00 0.00 176.55 180.12 1cd3 h SER 220 N 0.00 0.75 0.00 9.51 4.64 0.18 -2.12 113.55 126.51 1cd3 h SER 220 Ca 0.72 -0.47 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1cd3 h SER 220 Cb 1.80 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.68 1cd3 h SER 220 CO -0.76 1.06 0.10 -1.54 -0.87 0.00 0.00 176.83 174.82 1cd3 n SER 221 N -4.27 0.00 0.03 4.97 3.41 0.41 0.24 113.62 118.41 1cd3 n SER 221 Ca -0.04 0.37 0.11 0.00 -0.26 0.00 0.00 58.87 59.05 1cd3 n SER 221 Cb 0.46 -0.37 -0.08 0.00 -0.26 0.00 0.00 64.21 63.96 1cd3 n SER 221 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1cd3 n PHE 222 N -1.36 0.36 0.00 7.33 3.01 -0.81 -4.94 117.46 121.05 1cd3 n PHE 222 Ca 0.00 0.10 0.00 0.00 1.01 0.00 0.00 57.45 58.56 1cd3 n PHE 222 Cb 0.10 -0.62 0.00 0.00 -0.01 0.00 0.00 39.48 38.96 1cd3 n PHE 222 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1cd3 n GLY 223 N 1.26 0.71 3.95 1.37 0.00 0.65 -5.08 105.19 108.05 1cd3 n GLY 223 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 1cd3 n GLY 223 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cd3 s GLY 224 N -1.64 1.74 0.30 -0.02 0.00 -1.15 -4.98 107.32 101.56 1cd3 s GLY 224 Ca 0.00 -1.22 0.06 0.00 0.00 0.00 0.00 44.72 43.56 1cd3 s GLY 224 CO 0.00 -0.70 -0.02 0.54 0.00 0.00 0.00 173.10 172.92 1cd3 s LYS 225 N -5.33 1.62 -0.04 2.90 1.02 -1.26 -3.76 119.74 114.89 1cd3 s LYS 225 Ca 0.65 -1.85 -0.29 0.00 0.02 0.00 0.00 55.97 54.49 1cd3 s LYS 225 Cb -0.08 -1.12 0.09 0.00 -0.52 0.00 0.00 37.83 36.20 1cd3 s LYS 225 CO 0.46 -0.03 0.80 -0.08 -0.92 0.00 0.00 175.35 175.58 1cd3 s THR 226 N -3.06 0.00 -1.89 2.17 -1.32 -1.26 -4.96 115.64 105.31 1cd3 s THR 226 Ca 0.32 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 61.02 1cd3 s THR 226 Cb 0.06 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 70.01 1cd3 s THR 226 CO 0.13 0.00 1.06 -1.54 -2.21 0.00 0.00 174.62 172.06 1cd3 n SER 227 N 0.42 1.89 -3.51 8.08 3.41 -1.26 -4.98 113.62 117.67 1cd3 n SER 227 Ca -0.14 -1.45 -0.48 0.00 -0.26 0.00 0.00 58.87 56.54 1cd3 n SER 227 Cb 0.59 0.55 -0.07 0.00 -0.26 0.00 0.00 64.21 65.03 1cd3 n SER 227 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cd3 n TYR 228 N -0.22 0.87 -0.02 7.33 9.36 -1.26 -4.83 117.16 128.39 1cd3 n TYR 228 Ca 0.08 0.84 0.01 0.00 3.32 0.00 0.00 57.90 62.15 1cd3 n TYR 228 Cb 0.45 -1.64 -0.06 0.00 -0.63 0.00 0.00 39.34 37.46 1cd3 n TYR 228 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1cd3 n ASP 229 N 2.00 3.10 -0.22 2.98 -0.08 -1.26 -4.81 116.55 118.25 1cd3 n ASP 229 Ca 0.19 0.00 0.14 0.00 -1.51 0.00 0.00 54.79 53.61 1cd3 n ASP 229 Cb 0.01 1.09 0.26 0.00 2.34 0.00 0.00 41.12 44.82 1cd3 n ASP 229 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1cd3 n ALA 230 N -2.00 0.45 -0.39 -1.67 0.00 -1.26 -1.18 120.51 114.46 1cd3 n ALA 230 Ca -0.06 0.70 0.35 0.00 0.00 0.00 0.00 53.44 54.42 1cd3 n ALA 230 Cb 0.44 -0.57 0.53 0.00 0.00 0.00 0.00 19.45 19.86 1cd3 n ALA 230 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1cd3 n ASP 231 N -4.75 0.00 0.00 0.00 5.68 -1.26 -4.63 116.55 111.59 1cd3 n ASP 231 Ca 0.19 0.76 0.00 0.00 -0.50 0.00 0.00 54.79 55.23 1cd3 n ASP 231 Cb 0.62 -0.32 0.00 0.00 -1.14 0.00 0.00 41.12 40.28 1cd3 n ASP 231 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1cd3 n ASN 232 N -3.30 -4.65 -4.71 -1.12 3.02 -0.32 -4.89 115.26 99.28 1cd3 n ASN 232 Ca 0.29 0.00 -0.58 0.00 -0.03 0.00 0.00 54.58 54.26 1cd3 n ASN 232 Cb 1.54 -2.51 -0.07 0.00 -0.61 0.00 0.00 39.78 38.13 1cd3 n ASN 232 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1cd3 n ARG 233 N -0.38 1.05 -1.51 3.52 0.00 -1.26 -4.89 116.66 113.19 1cd3 n ARG 233 Ca 0.00 0.38 -0.31 0.00 -0.00 0.00 0.00 57.85 57.93 1cd3 n ARG 233 Cb 0.32 -2.05 0.07 0.00 0.00 0.00 0.00 32.46 30.80 1cd3 n ARG 233 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 1cd3 s PRO 234 N 3.40 2.46 -0.49 -0.14 0.02 -1.26 -4.98 135.00 134.02 1cd3 s PRO 234 Ca 0.99 0.86 -0.27 0.00 0.02 0.00 0.00 61.00 62.59 1cd3 s PRO 234 Cb -1.11 -1.94 0.03 0.00 0.02 0.00 0.00 34.50 31.50 1cd3 s PRO 234 CO 0.67 -1.41 1.04 -0.51 -0.33 0.00 0.00 177.00 176.46 1cd3 s LEU 235 N -5.71 3.80 -0.34 -5.54 2.01 -0.58 -4.89 118.68 107.43 1cd3 s LEU 235 Ca 0.60 0.21 -0.29 0.00 0.01 0.00 0.00 54.13 54.65 1cd3 s LEU 235 Cb -0.15 -3.30 0.01 0.00 0.01 0.00 0.00 46.19 42.77 1cd3 s LEU 235 CO 0.55 -1.20 1.25 -0.22 1.01 0.00 0.00 176.35 177.74 1cd3 s LEU 236 N 4.20 3.82 -0.14 1.79 2.96 -1.26 -0.41 118.68 129.64 1cd3 s LEU 236 Ca 0.41 1.03 0.03 0.00 -0.22 0.00 0.00 54.13 55.38 1cd3 s LEU 236 Cb -0.09 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.83 1cd3 s LEU 236 CO 0.28 -1.11 0.28 0.52 -1.32 0.00 0.00 176.35 174.99 1cd3 n VAL 237 N 6.35 1.63 -3.64 1.68 0.31 -0.66 -4.96 118.33 119.04 1cd3 n VAL 237 Ca 0.14 -0.70 -0.09 0.00 -0.01 0.00 0.00 64.34 63.68 1cd3 n VAL 237 Cb 0.47 -1.33 -0.07 0.00 -0.91 0.00 0.00 33.84 32.01 1cd3 n VAL 237 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 1cd3 s MET 238 N -2.55 0.59 0.04 5.55 1.75 -1.12 -4.99 119.30 118.56 1cd3 s MET 238 Ca -0.19 0.79 0.05 0.00 -1.25 0.00 0.00 55.69 55.10 1cd3 s MET 238 Cb 0.07 0.24 -0.02 0.00 2.84 0.00 0.00 34.83 37.96 1cd3 s MET 238 CO 0.76 -0.09 -0.15 0.50 -0.65 0.00 0.00 175.02 175.39 1cd3 s ARG 239 N 0.67 0.99 -0.06 4.11 3.52 -1.26 -1.96 118.95 124.96 1cd3 s ARG 239 Ca -0.02 -0.76 -0.04 0.00 -0.13 0.00 0.00 55.73 54.78 1cd3 s ARG 239 Cb -0.05 -1.01 0.02 0.00 -1.56 0.00 0.00 34.95 32.36 1cd3 s ARG 239 CO -0.08 0.25 0.15 -1.54 -0.81 0.00 0.00 175.30 173.28 1cd3 s SER 240 N -1.09 -0.15 0.04 -2.12 1.04 -1.19 -5.00 113.70 105.23 1cd3 s SER 240 Ca 0.02 0.32 0.06 0.00 0.48 0.00 0.00 55.95 56.83 1cd3 s SER 240 Cb -0.08 0.27 -0.02 0.00 0.10 0.00 0.00 66.02 66.29 1cd3 s SER 240 CO 0.01 -0.09 -0.19 0.21 0.98 0.00 0.00 173.24 174.17 1cd3 s ASN 241 N 0.51 2.21 0.05 7.02 2.47 -1.26 -0.88 114.94 125.05 1cd3 s ASN 241 Ca -0.04 -0.49 -0.07 0.00 0.42 0.00 0.00 52.86 52.68 1cd3 s ASN 241 Cb -0.05 -0.18 -0.01 0.00 -1.45 0.00 0.00 41.25 39.57 1cd3 s ASN 241 CO -0.02 0.13 0.14 -1.48 -3.72 0.00 0.00 177.10 172.14 1cd3 s LEU 242 N -1.12 1.63 -0.12 3.21 0.05 -0.25 -4.99 118.68 117.10 1cd3 s LEU 242 Ca 0.06 -0.52 -0.06 0.00 0.05 0.00 0.00 54.13 53.66 1cd3 s LEU 242 Cb -0.08 0.77 -0.04 0.00 -2.05 0.00 0.00 46.19 44.79 1cd3 s LEU 242 CO 0.01 -0.56 0.09 0.26 -0.55 0.00 0.00 176.35 175.60 1cd3 s TRP 243 N -2.84 3.43 -0.46 3.48 0.52 -1.26 0.44 118.94 122.24 1cd3 s TRP 243 Ca -0.03 0.38 -0.11 0.00 0.02 0.00 0.00 56.10 56.36 1cd3 s TRP 243 Cb 0.00 -1.92 0.10 0.00 -1.15 0.00 0.00 33.47 30.50 1cd3 s TRP 243 CO -0.06 0.58 0.35 0.00 0.02 0.00 0.00 176.95 177.84 1cd3 s ALA 244 N -0.77 3.42 0.22 0.98 0.00 0.10 -4.92 121.76 120.79 1cd3 s ALA 244 Ca 0.13 -2.33 0.09 0.00 0.00 0.00 0.00 51.96 49.85 1cd3 s ALA 244 Cb -0.12 -2.87 -0.05 0.00 0.00 0.00 0.00 23.12 20.09 1cd3 s ALA 244 CO 0.03 -1.80 -0.17 0.45 0.00 0.00 0.00 175.76 174.27 1cd3 s SER 245 N 2.60 2.90 0.00 0.00 0.15 -1.26 -4.14 113.70 113.95 1cd3 s SER 245 Ca 0.04 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 55.68 1cd3 s SER 245 Cb -0.25 -0.19 0.00 0.00 -1.71 0.00 0.00 66.02 63.87 1cd3 s SER 245 CO 0.02 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 174.98 1cd3 n GLY 246 N -0.40 4.49 3.17 9.45 0.00 -1.25 -3.85 105.19 116.79 1cd3 n GLY 246 Ca -0.07 -0.75 -0.10 0.00 0.00 0.00 0.00 46.02 45.09 1cd3 n GLY 246 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1cd3 s TYR 247 N 3.51 0.91 0.37 1.61 -0.00 0.10 -4.91 117.35 118.93 1cd3 s TYR 247 Ca 0.00 -1.13 -0.04 0.00 -0.00 0.00 0.00 57.07 55.90 1cd3 s TYR 247 Cb 0.00 -0.53 -0.04 0.00 -0.00 0.00 0.00 41.96 41.39 1cd3 s TYR 247 CO 0.00 -0.39 0.63 -0.51 -0.00 0.00 0.00 175.55 175.28 1cd3 s ASP 248 N -3.06 6.36 -0.29 -0.18 1.01 -1.26 0.43 116.67 119.68 1cd3 s ASP 248 Ca 0.21 0.72 -0.02 0.00 0.71 0.00 0.00 52.55 54.17 1cd3 s ASP 248 Cb 0.07 -2.15 0.04 0.00 1.01 0.00 0.00 42.92 41.89 1cd3 s ASP 248 CO 0.00 -0.34 -0.01 -0.69 0.21 0.00 0.00 175.17 174.34 1cd3 s VAL 249 N -2.35 3.00 0.30 -1.27 1.01 0.27 -4.80 120.40 116.56 1cd3 s VAL 249 Ca 0.44 -1.29 -0.29 0.00 0.00 0.00 0.00 61.98 60.84 1cd3 s VAL 249 Cb -0.10 -2.68 -0.11 0.00 0.00 0.00 0.00 36.38 33.49 1cd3 s VAL 249 CO 0.36 -0.04 1.48 -1.81 0.00 0.00 0.00 175.10 175.09 1cd3 s ASP 250 N 1.27 6.52 0.51 3.32 1.01 -1.26 -2.07 116.67 125.97 1cd3 s ASP 250 Ca -0.04 2.84 -0.18 0.00 0.71 0.00 0.00 52.55 55.87 1cd3 s ASP 250 Cb -0.19 -2.64 -0.08 0.00 1.01 0.00 0.00 42.92 41.02 1cd3 s ASP 250 CO -0.02 -0.78 1.01 -0.83 0.21 0.00 0.00 175.17 174.77 1cd3 s GLY 251 N 0.18 2.29 0.00 0.21 0.00 0.15 -4.95 107.32 105.19 1cd3 s GLY 251 Ca 0.58 0.41 0.10 0.00 0.00 0.00 0.00 44.72 45.81 1cd3 s GLY 251 CO 0.50 0.71 1.04 -1.30 0.00 0.00 0.00 173.10 174.05 1cd3 n THR 252 N -1.31 0.00 -3.83 0.90 -2.24 -1.16 -4.68 114.28 101.95 1cd3 n THR 252 Ca 0.08 -0.37 -0.14 0.00 -2.27 0.00 0.00 64.05 61.35 1cd3 n THR 252 Cb 0.53 0.66 -0.15 0.00 -2.10 0.00 0.00 70.33 69.27 1cd3 n THR 252 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1cd3 s ASP 253 N -1.31 0.08 0.00 3.42 1.47 -1.25 -4.99 116.67 114.08 1cd3 s ASP 253 Ca 0.13 0.02 0.00 0.00 1.18 0.00 0.00 52.55 53.87 1cd3 s ASP 253 Cb 0.14 -0.05 0.00 0.00 -0.34 0.00 0.00 42.92 42.67 1cd3 s ASP 253 CO -0.06 -0.07 0.00 1.67 0.68 0.00 0.00 175.17 177.39 1cd3 n GLN 254 N 3.69 0.00 -0.31 2.11 7.27 -1.26 0.88 117.38 129.77 1cd3 n GLN 254 Ca -0.21 0.00 0.13 0.00 0.07 0.00 0.00 57.00 56.99 1cd3 n GLN 254 Cb 0.54 0.00 0.31 0.00 2.41 0.00 0.00 30.24 33.50 1cd3 n GLN 254 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 1cd3 h THR 255 N 0.00 0.53 -2.29 1.69 1.35 -2.04 -3.31 112.91 108.85 1cd3 h THR 255 Ca 0.00 -0.16 -0.59 0.00 -0.55 0.00 0.00 66.41 65.10 1cd3 h THR 255 Cb 0.00 0.02 -0.41 0.00 -1.73 0.00 0.00 68.15 66.03 1cd3 h THR 255 CO 0.00 0.09 -0.74 -1.54 -0.25 0.00 0.00 175.52 173.08 1cd3 n SER 256 N -4.98 2.49 0.00 5.36 3.41 0.25 -4.92 113.62 115.24 1cd3 n SER 256 Ca 0.22 -3.16 0.00 0.00 -0.26 0.00 0.00 58.87 55.67 1cd3 n SER 256 Cb 0.63 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1cd3 n SER 256 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1cd3 n LEU 257 N 1.28 1.69 -0.12 1.04 4.77 -1.25 -3.00 117.00 121.41 1cd3 n LEU 257 Ca 0.26 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 1cd3 n LEU 257 Cb 0.43 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1cd3 n LEU 257 CO 0.31 -0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.77 1cd3 n GLY 258 N 2.29 0.00 3.93 -0.72 0.00 -1.26 -3.93 105.19 105.50 1cd3 n GLY 258 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1cd3 n GLY 258 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1cd3 s GLN 259 N -0.97 3.52 0.08 1.61 -0.21 -1.25 -4.98 119.66 117.46 1cd3 s GLN 259 Ca 0.00 -0.26 -0.23 0.00 0.02 0.00 0.00 55.36 54.89 1cd3 s GLN 259 Cb 0.00 -2.69 0.06 0.00 1.00 0.00 0.00 33.01 31.38 1cd3 s GLN 259 CO 0.00 0.21 0.56 -0.06 -2.12 0.00 0.00 175.29 173.88 1cd3 s PHE 260 N -2.18 -0.47 -0.03 0.91 0.40 -1.26 -0.67 117.98 114.67 1cd3 s PHE 260 Ca 0.40 0.44 0.02 0.00 -0.60 0.00 0.00 56.93 57.20 1cd3 s PHE 260 Cb -0.10 0.42 0.01 0.00 0.51 0.00 0.00 43.02 43.86 1cd3 s PHE 260 CO 0.33 -0.72 -0.06 0.45 0.70 0.00 0.00 175.22 175.92 1cd3 s SER 261 N -2.23 0.97 -0.01 1.36 0.15 -0.88 -4.07 113.70 108.99 1cd3 s SER 261 Ca -0.03 -0.14 -0.23 0.00 0.70 0.00 0.00 55.95 56.25 1cd3 s SER 261 Cb -0.00 -0.36 -0.05 0.00 -1.71 0.00 0.00 66.02 63.90 1cd3 s SER 261 CO -0.05 0.00 0.69 -0.83 1.20 0.00 0.00 173.24 174.25 1cd3 s GLY 262 N 0.52 2.67 -0.16 9.45 0.00 0.18 0.98 107.32 120.95 1cd3 s GLY 262 Ca -0.07 0.15 -0.01 0.00 0.00 0.00 0.00 44.72 44.78 1cd3 s GLY 262 CO 0.00 1.01 -0.10 -1.60 0.00 0.00 0.00 173.10 172.41 1cd3 s ARG 263 N 0.20 3.37 -0.21 2.90 3.52 0.17 -3.29 118.95 125.61 1cd3 s ARG 263 Ca 0.36 -0.67 -0.10 0.00 -0.13 0.00 0.00 55.73 55.19 1cd3 s ARG 263 Cb -0.19 -2.77 -0.05 0.00 -1.56 0.00 0.00 34.95 30.39 1cd3 s ARG 263 CO 0.19 0.05 0.14 0.08 -0.81 0.00 0.00 175.30 174.94 1cd3 s VAL 264 N 0.80 5.36 -0.46 7.11 1.01 -1.26 -0.73 120.40 132.22 1cd3 s VAL 264 Ca -0.04 0.17 0.06 0.00 0.00 0.00 0.00 61.98 62.17 1cd3 s VAL 264 Cb -0.15 -3.46 0.18 0.00 0.00 0.00 0.00 36.38 32.95 1cd3 s VAL 264 CO 0.01 0.41 0.55 1.67 0.00 0.00 0.00 175.10 177.74 1cd3 n GLN 265 N 3.75 0.38 -3.39 2.72 7.27 -1.25 -4.00 117.38 122.86 1cd3 n GLN 265 Ca -0.16 -2.59 -0.37 0.00 0.07 0.00 0.00 57.00 53.95 1cd3 n GLN 265 Cb 0.52 -1.56 -0.06 0.00 2.41 0.00 0.00 30.24 31.55 1cd3 n GLN 265 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 1cd3 s GLN 266 N 0.44 4.02 -0.10 3.69 2.00 -0.28 -4.80 119.66 124.63 1cd3 s GLN 266 Ca 0.32 0.53 -0.05 0.00 -2.00 0.00 0.00 55.36 54.15 1cd3 s GLN 266 Cb 0.03 -3.13 -0.04 0.00 0.80 0.00 0.00 33.01 30.67 1cd3 s GLN 266 CO -0.13 0.61 0.12 0.99 -0.50 0.00 0.00 175.29 176.38 1cd3 s THR 267 N -1.22 5.30 -0.00 -0.34 2.01 -1.26 0.95 115.64 121.08 1cd3 s THR 267 Ca 0.30 0.07 -0.19 0.00 0.31 0.00 0.00 61.69 62.18 1cd3 s THR 267 Cb -0.17 -3.32 0.04 0.00 0.01 0.00 0.00 72.50 69.05 1cd3 s THR 267 CO 0.17 0.57 0.41 -0.72 -0.69 0.00 0.00 174.62 174.36 1cd3 s TYR 268 N -1.05 -0.30 -0.07 4.92 -0.00 -0.44 -4.95 117.35 115.45 1cd3 s TYR 268 Ca 0.17 0.41 0.02 0.00 -0.00 0.00 0.00 57.07 57.67 1cd3 s TYR 268 Cb -0.12 0.19 0.01 0.00 -0.00 0.00 0.00 41.96 42.04 1cd3 s TYR 268 CO 0.06 -0.49 -0.14 0.21 -0.00 0.00 0.00 175.55 175.19 1cd3 s LYS 269 N -1.68 1.95 -0.17 -3.49 2.20 -1.25 -1.71 119.74 115.58 1cd3 s LYS 269 Ca -0.10 -0.50 -0.01 0.00 -0.36 0.00 0.00 55.97 55.00 1cd3 s LYS 269 Cb -0.03 -1.58 0.05 0.00 -1.51 0.00 0.00 37.83 34.76 1cd3 s LYS 269 CO 0.03 0.04 -0.03 -1.58 -0.36 0.00 0.00 175.35 173.45 1cd3 s HIS 270 N 0.65 1.58 -0.05 4.03 5.65 0.18 -4.98 115.29 122.34 1cd3 s HIS 270 Ca -0.15 -1.04 0.03 0.00 0.25 0.00 0.00 55.06 54.15 1cd3 s HIS 270 Cb -0.16 -1.25 0.01 0.00 -1.18 0.00 0.00 32.58 29.99 1cd3 s HIS 270 CO 0.04 -0.61 -0.12 -1.54 -0.65 0.00 0.00 174.74 171.86 1cd3 s SER 271 N 1.67 1.66 -0.34 9.88 1.04 -1.26 0.11 113.70 126.47 1cd3 s SER 271 Ca 0.00 -0.27 -0.11 0.00 0.48 0.00 0.00 55.95 56.05 1cd3 s SER 271 Cb -0.16 -0.61 0.00 0.00 0.10 0.00 0.00 66.02 65.36 1cd3 s SER 271 CO -0.07 0.07 0.18 -0.69 0.98 0.00 0.00 173.24 173.71 1cd3 s VAL 272 N 0.39 4.69 0.24 5.02 1.01 -0.43 -5.00 120.40 126.33 1cd3 s VAL 272 Ca -0.09 -0.54 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 1cd3 s VAL 272 Cb -0.13 -3.47 -0.09 0.00 0.00 0.00 0.00 36.38 32.70 1cd3 s VAL 272 CO 0.02 -0.04 1.23 -2.84 0.00 0.00 0.00 175.10 173.47 1cd3 s PRO 273 N 1.61 4.47 -0.15 2.72 0.02 -1.26 -2.83 135.00 139.57 1cd3 s PRO 273 Ca 0.04 1.99 -0.11 0.00 0.02 0.00 0.00 61.00 62.94 1cd3 s PRO 273 Cb -0.18 -3.18 -0.05 0.00 0.02 0.00 0.00 34.50 31.12 1cd3 s PRO 273 CO 0.07 -0.09 0.57 -2.13 -0.33 0.00 0.00 177.00 175.09 1cd3 n ARG 274 N 1.85 0.00 -4.89 5.54 0.63 -1.26 -4.91 116.66 113.62 1cd3 n ARG 274 Ca 0.03 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.63 1cd3 n ARG 274 Cb 0.43 -0.38 -0.15 0.00 0.45 0.00 0.00 32.46 32.81 1cd3 n ARG 274 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 1cd3 s PHE 275 N 1.65 2.72 -0.13 -0.14 5.36 -0.65 -4.95 117.98 121.85 1cd3 s PHE 275 Ca 0.31 -0.84 -0.28 0.00 -0.96 0.00 0.00 56.93 55.16 1cd3 s PHE 275 Cb -0.37 -1.80 -0.01 0.00 -0.34 0.00 0.00 43.02 40.49 1cd3 s PHE 275 CO 0.16 -0.32 0.92 0.12 -1.46 0.00 0.00 175.22 174.64 1cd3 s PHE 276 N 0.42 3.48 -0.25 10.12 5.36 -1.26 -1.42 117.98 134.42 1cd3 s PHE 276 Ca -0.13 1.45 -0.24 0.00 -0.96 0.00 0.00 56.93 57.05 1cd3 s PHE 276 Cb -0.17 -3.10 -0.01 0.00 -0.34 0.00 0.00 43.02 39.41 1cd3 s PHE 276 CO 0.06 -0.21 0.81 0.08 -1.46 0.00 0.00 175.22 174.50 1cd3 s VAL 277 N 2.01 4.84 -0.01 3.12 1.01 -0.29 -4.98 120.40 126.09 1cd3 s VAL 277 Ca 0.44 1.49 -0.05 0.00 0.00 0.00 0.00 61.98 63.86 1cd3 s VAL 277 Cb -0.18 -4.11 -0.28 0.00 0.00 0.00 0.00 36.38 31.81 1cd3 s VAL 277 CO 0.16 -0.09 0.80 1.55 0.00 0.00 0.00 175.10 177.52 1cd3 h PRO 278 N 7.76 0.28 -4.95 2.72 0.14 -1.89 -2.31 132.00 133.75 1cd3 h PRO 278 Ca -0.23 -0.49 -0.33 0.00 0.14 0.00 0.00 66.00 65.09 1cd3 h PRO 278 Cb 1.09 0.18 -0.14 0.00 0.14 0.00 0.00 31.00 32.27 1cd3 h PRO 278 CO 0.87 1.16 -0.67 -1.21 0.14 0.00 0.00 178.00 178.29 1cd3 s GLU 279 N -2.61 1.20 0.95 0.86 2.02 -1.26 -4.34 118.70 115.53 1cd3 s GLU 279 Ca -0.11 -1.59 -0.11 0.00 0.02 0.00 0.00 54.97 53.19 1cd3 s GLU 279 Cb 0.06 -0.46 0.15 0.00 0.10 0.00 0.00 34.13 33.99 1cd3 s GLU 279 CO 0.85 -0.09 1.03 0.72 0.02 0.00 0.00 175.26 177.79 1cd3 n HIS 280 N -0.31 0.33 -3.64 1.61 8.25 -1.26 -3.56 115.22 116.63 1cd3 n HIS 280 Ca -0.06 0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.72 1cd3 n HIS 280 Cb 0.63 -1.94 0.00 0.00 1.12 0.00 0.00 29.99 29.80 1cd3 n HIS 280 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1cd3 n GLY 281 N 0.52 -0.89 3.35 -1.41 0.00 0.21 -2.82 105.19 104.15 1cd3 n GLY 281 Ca 0.10 -0.99 -0.30 0.00 0.00 0.00 0.00 46.02 44.83 1cd3 n GLY 281 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cd3 s THR 282 N -3.00 2.18 -0.39 2.61 2.01 -0.10 -1.64 115.64 117.31 1cd3 s THR 282 Ca 0.00 -1.36 0.04 0.00 0.31 0.00 0.00 61.69 60.68 1cd3 s THR 282 Cb 0.00 -1.84 0.11 0.00 0.01 0.00 0.00 72.50 70.77 1cd3 s THR 282 CO 0.00 0.38 0.11 -0.04 -0.69 0.00 0.00 174.62 174.38 1cd3 s MET 283 N -1.20 1.62 0.19 4.92 1.00 -1.03 -0.18 119.30 124.61 1cd3 s MET 283 Ca 0.12 -2.05 -0.21 0.00 0.00 0.00 0.00 55.69 53.55 1cd3 s MET 283 Cb -0.10 -3.25 -0.08 0.00 0.00 0.00 0.00 34.83 31.40 1cd3 s MET 283 CO 0.02 -0.98 0.71 -0.06 0.00 0.00 0.00 175.02 174.70 1cd3 s PHE 284 N 0.63 3.73 -0.31 -0.03 0.40 -0.81 -2.95 117.98 118.65 1cd3 s PHE 284 Ca 0.12 1.42 -0.02 0.00 -0.60 0.00 0.00 56.93 57.85 1cd3 s PHE 284 Cb -0.21 -2.63 0.12 0.00 0.51 0.00 0.00 43.02 40.82 1cd3 s PHE 284 CO -0.06 0.41 0.20 -0.08 0.70 0.00 0.00 175.22 176.39 1cd3 s THR 285 N -1.38 -0.12 0.33 0.64 -1.32 -1.15 0.75 115.64 113.40 1cd3 s THR 285 Ca 0.39 -0.90 0.06 0.00 -1.21 0.00 0.00 61.69 60.03 1cd3 s THR 285 Cb -0.18 -0.98 -0.01 0.00 -1.51 0.00 0.00 72.50 69.81 1cd3 s THR 285 CO 0.22 -0.71 0.47 -0.76 -2.21 0.00 0.00 174.62 171.63 1cd3 s LEU 286 N 1.91 3.99 0.33 9.08 1.02 0.88 -2.08 118.68 133.82 1cd3 s LEU 286 Ca 0.11 -0.11 0.10 0.00 0.02 0.00 0.00 54.13 54.25 1cd3 s LEU 286 Cb -0.17 -2.81 -0.06 0.00 0.02 0.00 0.00 46.19 43.17 1cd3 s LEU 286 CO -0.27 -0.41 -0.11 0.00 0.02 0.00 0.00 176.35 175.58 1cd3 s ALA 287 N -2.18 2.93 -0.30 4.21 0.00 0.10 -1.19 121.76 125.33 1cd3 s ALA 287 Ca 0.44 -2.03 -0.01 0.00 0.00 0.00 0.00 51.96 50.37 1cd3 s ALA 287 Cb -0.09 -0.13 0.19 0.00 0.00 0.00 0.00 23.12 23.08 1cd3 s ALA 287 CO 0.31 0.13 0.64 -1.17 0.00 0.00 0.00 175.76 175.68 1cd3 s LEU 288 N -3.59 -1.35 -0.17 0.00 2.96 -0.65 -2.48 118.68 113.40 1cd3 s LEU 288 Ca 0.32 0.67 -0.09 0.00 -0.22 0.00 0.00 54.13 54.82 1cd3 s LEU 288 Cb 0.00 2.07 -0.05 0.00 0.50 0.00 0.00 46.19 48.71 1cd3 s LEU 288 CO 0.16 -0.25 0.13 -0.69 -1.32 0.00 0.00 176.35 174.38 1cd3 s VAL 289 N 2.86 5.43 -0.01 1.68 1.01 -1.26 -2.04 120.40 128.08 1cd3 s VAL 289 Ca 0.17 0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.34 1cd3 s VAL 289 Cb -0.13 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1cd3 s VAL 289 CO -0.21 0.50 0.02 -0.13 0.00 0.00 0.00 175.10 175.28 1cd3 s ARG 290 N -0.10 0.05 0.08 2.72 0.52 -0.89 -2.44 118.95 118.89 1cd3 s ARG 290 Ca 0.10 -0.01 -0.21 0.00 -0.52 0.00 0.00 55.73 55.09 1cd3 s ARG 290 Cb -0.11 0.02 -0.07 0.00 0.52 0.00 0.00 34.95 35.31 1cd3 s ARG 290 CO -0.00 -0.01 0.64 -0.06 0.02 0.00 0.00 175.30 175.89 1cd3 s PHE 291 N -0.10 3.80 0.30 -0.53 0.40 -1.26 -0.27 117.98 120.32 1cd3 s PHE 291 Ca -0.01 1.36 -0.29 0.00 -0.60 0.00 0.00 56.93 57.39 1cd3 s PHE 291 Cb -0.01 -2.61 -0.11 0.00 0.51 0.00 0.00 43.02 40.80 1cd3 s PHE 291 CO -0.00 0.50 1.50 -1.25 0.70 0.00 0.00 175.22 176.67 1cd3 s PRO 292 N -0.84 4.18 0.00 0.24 0.04 -1.26 -4.78 135.00 132.58 1cd3 s PRO 292 Ca 0.32 2.47 0.00 0.00 0.04 0.00 0.00 61.00 63.83 1cd3 s PRO 292 Cb -0.20 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.30 1cd3 s PRO 292 CO 0.21 -0.52 0.61 -0.35 0.04 0.00 0.00 177.00 176.99 1cd3 n PRO 293 N 1.72 0.00 -2.99 0.56 -0.04 -1.26 -4.88 135.00 128.11 1cd3 n PRO 293 Ca 0.05 -0.14 -0.41 0.00 -0.04 0.00 0.00 63.50 62.97 1cd3 n PRO 293 Cb 0.39 -1.59 -0.05 0.00 -0.04 0.00 0.00 33.50 32.21 1cd3 n PRO 293 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1cd3 s THR 294 N 3.39 4.93 0.38 0.52 -4.23 -1.26 -4.87 115.64 114.49 1cd3 s THR 294 Ca 0.00 1.43 0.08 0.00 -1.18 0.00 0.00 61.69 62.01 1cd3 s THR 294 Cb 0.00 -4.05 -0.03 0.00 1.34 0.00 0.00 72.50 69.76 1cd3 s THR 294 CO 0.00 0.04 0.26 0.00 -0.54 0.00 0.00 174.62 174.38 1cd3 s ALA 295 N 2.20 3.77 -2.12 3.99 0.00 -1.26 0.56 121.76 128.91 1cd3 s ALA 295 Ca 0.33 -1.87 0.26 0.00 0.00 0.00 0.00 51.96 50.68 1cd3 s ALA 295 Cb -0.16 -0.84 0.63 0.00 0.00 0.00 0.00 23.12 22.75 1cd3 s ALA 295 CO 0.10 -0.10 1.49 0.25 0.00 0.00 0.00 175.76 177.51 1cd3 n THR 296 N -1.34 0.00 -0.47 0.00 -2.24 -0.48 -4.27 114.28 105.48 1cd3 n THR 296 Ca -0.00 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1cd3 n THR 296 Cb 0.62 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.54 1cd3 n THR 296 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1cd3 n LYS 297 N -0.13 0.64 -2.12 -0.78 5.02 -1.26 -4.83 118.16 114.70 1cd3 n LYS 297 Ca 0.13 -0.69 -0.36 0.00 -2.02 0.00 0.00 58.31 55.38 1cd3 n LYS 297 Cb 0.40 -0.76 0.02 0.00 -0.02 0.00 0.00 35.03 34.66 1cd3 n LYS 297 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1cd3 s GLU 298 N -0.29 3.26 0.13 1.97 2.12 -1.26 0.88 118.70 125.51 1cd3 s GLU 298 Ca 0.00 1.79 0.05 0.00 0.36 0.00 0.00 54.97 57.17 1cd3 s GLU 298 Cb 0.00 -2.08 -0.04 0.00 0.26 0.00 0.00 34.13 32.27 1cd3 s GLU 298 CO 0.00 -0.96 -0.11 0.42 -0.54 0.00 0.00 175.26 174.06 1cd3 s ILE 299 N -1.61 1.20 -0.26 -3.70 1.01 0.96 -4.81 121.20 113.98 1cd3 s ILE 299 Ca 0.73 -1.88 -0.29 0.00 0.00 0.00 0.00 60.65 59.21 1cd3 s ILE 299 Cb -0.29 -1.66 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 1cd3 s ILE 299 CO 0.33 -0.60 1.77 -1.10 0.00 0.00 0.00 174.94 175.33 1cd3 s GLN 300 N -3.22 3.54 0.48 2.79 -0.21 -1.26 -4.69 119.66 117.09 1cd3 s GLN 300 Ca 0.12 1.62 0.36 0.00 0.02 0.00 0.00 55.36 57.49 1cd3 s GLN 300 Cb -0.01 -4.15 1.52 0.00 1.00 0.00 0.00 33.01 31.38 1cd3 s GLN 300 CO 0.01 -1.61 1.62 -0.92 -2.12 0.00 0.00 175.29 172.27 1cd3 h TYR 301 N 12.09 0.35 -0.05 0.91 3.20 -1.92 1.17 116.97 132.73 1cd3 h TYR 301 Ca -0.35 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 61.38 1cd3 h TYR 301 Cb 1.17 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.34 1cd3 h TYR 301 CO 0.94 -0.15 -0.68 -0.07 -1.64 0.00 0.00 178.16 176.56 1cd3 h LEU 302 N 0.05 0.26 0.00 2.82 3.38 -1.87 -1.75 115.31 118.20 1cd3 h LEU 302 Ca 0.84 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 58.51 1cd3 h LEU 302 Cb 2.89 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 43.55 1cd3 h LEU 302 CO -0.29 0.86 -0.76 0.78 0.09 0.00 0.00 178.44 179.12 1cd3 h ASN 303 N 0.16 0.00 0.09 -0.43 2.35 0.96 -3.38 115.58 115.34 1cd3 h ASN 303 Ca -0.02 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.40 1cd3 h ASN 303 Cb 1.22 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.56 1cd3 h ASN 303 CO 0.10 0.61 -1.84 0.00 -1.65 0.00 0.00 177.43 174.65 1cd3 n ALA 304 N -2.28 0.87 -0.12 -0.83 0.00 -0.20 -4.29 120.51 113.66 1cd3 n ALA 304 Ca -0.01 -0.57 0.27 0.00 0.00 0.00 0.00 53.44 53.13 1cd3 n ALA 304 Cb 0.79 -0.64 0.62 0.00 0.00 0.00 0.00 19.45 20.23 1cd3 n ALA 304 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1cd3 h LYS 305 N -0.20 0.00 0.00 0.00 3.64 -1.48 -3.47 116.57 115.06 1cd3 h LYS 305 Ca -0.41 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 1cd3 h LYS 305 Cb 1.86 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.68 1cd3 h LYS 305 CO 0.01 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 177.60 1cd3 n GLY 306 N -1.64 -1.73 0.00 5.01 0.00 -1.26 -4.94 105.19 100.63 1cd3 n GLY 306 Ca 0.18 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1cd3 n GLY 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cd3 n ALA 307 N 0.98 0.00 -2.60 4.61 0.00 -1.26 -4.78 120.51 117.45 1cd3 n ALA 307 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1cd3 n ALA 307 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1cd3 n ALA 307 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1cd3 s LEU 308 N 0.00 4.36 0.16 0.00 1.43 -1.26 -5.09 118.68 118.27 1cd3 s LEU 308 Ca 0.00 1.01 0.10 0.00 -1.03 0.00 0.00 54.13 54.22 1cd3 s LEU 308 Cb 0.00 -2.82 -0.04 0.00 0.03 0.00 0.00 46.19 43.35 1cd3 s LEU 308 CO 0.00 0.06 -0.21 0.42 0.23 0.00 0.00 176.35 176.85 1cd3 s THR 309 N 0.16 2.59 0.30 5.49 -4.23 -1.26 -5.00 115.64 113.69 1cd3 s THR 309 Ca 0.29 -1.79 0.16 0.00 -1.18 0.00 0.00 61.69 59.17 1cd3 s THR 309 Cb -0.17 -2.21 0.29 0.00 1.34 0.00 0.00 72.50 71.75 1cd3 s THR 309 CO 0.14 -0.02 1.29 0.00 -0.54 0.00 0.00 174.62 175.50 1cd3 n TYR 310 N 0.50 0.92 0.02 3.99 9.36 -1.26 0.11 117.16 130.80 1cd3 n TYR 310 Ca -0.14 0.97 -0.10 0.00 3.32 0.00 0.00 57.90 61.94 1cd3 n TYR 310 Cb 0.54 -1.36 0.04 0.00 -0.63 0.00 0.00 39.34 37.93 1cd3 n TYR 310 CO 0.00 0.00 0.00 1.79 0.22 0.00 0.00 176.86 178.87 1cd3 h THR 311 N 0.00 1.34 0.00 2.97 1.35 -1.98 -0.37 112.91 116.22 1cd3 h THR 311 Ca 0.68 -1.94 -0.04 0.00 -0.55 0.00 0.00 66.41 64.56 1cd3 h THR 311 Cb 1.77 1.91 -0.01 0.00 -1.73 0.00 0.00 68.15 70.10 1cd3 h THR 311 CO -0.64 0.59 -0.20 0.44 -0.25 0.00 0.00 175.52 175.46 1cd3 h ASP 312 N 0.38 0.00 0.00 5.36 5.19 0.43 -3.34 116.42 124.44 1cd3 h ASP 312 Ca -0.01 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.38 1cd3 h ASP 312 Cb 1.20 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.70 1cd3 h ASP 312 CO 0.12 0.20 -1.08 0.00 -3.12 0.00 0.00 179.24 175.36 1cd3 n ILE 313 N -3.31 0.08 -0.29 0.35 0.00 -0.85 -4.68 119.36 110.66 1cd3 n ILE 313 Ca 0.01 -0.03 0.10 0.00 0.00 0.00 0.00 62.75 62.82 1cd3 n ILE 313 Cb 0.45 -0.58 0.25 0.00 0.00 0.00 0.00 39.64 39.76 1cd3 n ILE 313 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1cd3 h ALA 314 N 0.00 1.26 -3.38 1.51 0.00 -1.23 -3.45 119.26 113.98 1cd3 h ALA 314 Ca -0.03 0.15 -0.25 0.00 0.00 0.00 0.00 54.91 54.77 1cd3 h ALA 314 Cb 1.05 0.14 0.06 0.00 0.00 0.00 0.00 17.79 19.03 1cd3 h ALA 314 CO -0.00 -0.29 -0.40 0.41 0.00 0.00 0.00 179.25 178.97 1cd3 n GLY 315 N -1.34 -0.04 3.56 0.00 0.00 -1.25 -4.93 105.19 101.18 1cd3 n GLY 315 Ca 0.19 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1cd3 n GLY 315 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1cd3 s ASP 316 N -2.96 6.32 0.40 1.61 -1.08 -1.26 -4.93 116.67 114.76 1cd3 s ASP 316 Ca 0.26 -0.20 0.25 0.00 -0.52 0.00 0.00 52.55 52.34 1cd3 s ASP 316 Cb -0.11 -2.54 1.39 0.00 -1.46 0.00 0.00 42.92 40.20 1cd3 s ASP 316 CO 0.32 -1.59 1.58 1.55 0.52 0.00 0.00 175.17 177.55 1cd3 h PRO 317 N 9.71 0.02 -0.48 4.34 0.13 -1.97 0.45 132.00 144.20 1cd3 h PRO 317 Ca -0.26 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1cd3 h PRO 317 Cb 1.06 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 1cd3 h PRO 317 CO 1.21 0.01 0.29 0.28 -0.23 0.00 0.00 178.00 179.57 1cd3 h VAL 318 N 0.02 1.14 0.66 1.56 2.07 -1.97 1.00 116.25 120.74 1cd3 h VAL 318 Ca 0.86 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 68.04 1cd3 h VAL 318 Cb 2.45 0.49 0.01 0.00 -1.52 0.00 0.00 31.29 32.71 1cd3 h VAL 318 CO -0.65 0.14 -0.32 -0.07 0.02 0.00 0.00 177.57 176.70 1cd3 h LEU 319 N 0.64 -0.75 -2.37 2.57 3.38 -1.27 -1.27 115.31 116.24 1cd3 h LEU 319 Ca 0.17 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.16 1cd3 h LEU 319 Cb -0.03 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1cd3 h LEU 319 CO -0.03 -0.40 0.16 1.88 0.09 0.00 0.00 178.44 180.13 1cd3 h TYR 320 N -1.13 0.00 0.00 1.13 0.99 -1.51 -2.67 116.97 113.77 1cd3 h TYR 320 Ca -0.09 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.64 1cd3 h TYR 320 Cb 0.72 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.45 1cd3 h TYR 320 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 1cd3 n GLY 321 N -1.31 -3.22 2.74 3.88 0.00 0.35 -3.92 105.19 103.71 1cd3 n GLY 321 Ca -0.00 0.43 -0.29 0.00 0.00 0.00 0.00 46.02 46.16 1cd3 n GLY 321 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cd3 n ASN 322 N -1.39 3.61 -3.62 1.61 2.04 -1.01 -4.95 115.26 111.54 1cd3 n ASN 322 Ca 0.00 -3.31 -0.22 0.00 -0.44 0.00 0.00 54.58 50.61 1cd3 n ASN 322 Cb 0.00 -0.78 -0.17 0.00 -2.53 0.00 0.00 39.78 36.31 1cd3 n ASN 322 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 1cd3 s LEU 323 N -1.93 0.17 0.75 -4.53 1.43 -1.06 -4.94 118.68 108.58 1cd3 s LEU 323 Ca 0.31 -0.23 -0.14 0.00 -1.03 0.00 0.00 54.13 53.05 1cd3 s LEU 323 Cb 0.04 -0.06 0.05 0.00 0.03 0.00 0.00 46.19 46.25 1cd3 s LEU 323 CO -0.09 -0.30 1.17 -2.16 0.23 0.00 0.00 176.35 175.19 1cd3 s PRO 324 N 2.20 2.07 0.23 1.29 0.05 -1.26 -4.65 135.00 134.92 1cd3 s PRO 324 Ca 0.04 1.60 -0.14 0.00 0.05 0.00 0.00 61.00 62.54 1cd3 s PRO 324 Cb -0.14 -1.84 -0.10 0.00 0.05 0.00 0.00 34.50 32.46 1cd3 s PRO 324 CO -0.07 -1.85 0.12 -2.30 0.05 0.00 0.00 177.00 172.94 1cd3 n PRO 325 N -3.01 0.00 -3.28 0.56 -0.02 -1.26 -4.68 135.00 123.31 1cd3 n PRO 325 Ca 0.12 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.42 1cd3 n PRO 325 Cb 0.51 -0.63 0.00 0.00 -0.02 0.00 0.00 33.50 33.36 1cd3 n PRO 325 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1cd3 s ARG 326 N -0.63 3.01 -0.75 -0.52 0.52 -0.24 -4.89 118.95 115.45 1cd3 s ARG 326 Ca 0.38 -1.07 0.03 0.00 -0.52 0.00 0.00 55.73 54.55 1cd3 s ARG 326 Cb -0.45 -2.79 0.29 0.00 0.52 0.00 0.00 34.95 32.52 1cd3 s ARG 326 CO 0.39 -0.07 1.04 -1.91 0.02 0.00 0.00 175.30 174.76 1cd3 n GLU 327 N -1.74 3.34 -0.69 3.54 2.13 -1.26 -1.46 120.64 124.50 1cd3 n GLU 327 Ca 0.03 -4.70 -0.33 0.00 0.66 0.00 0.00 57.16 52.82 1cd3 n GLU 327 Cb 0.58 -2.32 0.16 0.00 0.27 0.00 0.00 31.44 30.13 1cd3 n GLU 327 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1cd3 n ILE 328 N 0.62 0.00 -3.74 6.31 5.41 -0.89 -4.67 119.36 122.40 1cd3 n ILE 328 Ca 0.31 -0.28 -0.13 0.00 1.00 0.00 0.00 62.75 63.64 1cd3 n ILE 328 Cb 0.38 -0.56 -0.14 0.00 -0.71 0.00 0.00 39.64 38.60 1cd3 n ILE 328 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1cd3 s SER 329 N -1.78 -0.10 0.12 4.38 1.04 -1.26 -1.42 113.70 114.68 1cd3 s SER 329 Ca 0.55 0.35 0.10 0.00 0.48 0.00 0.00 55.95 57.43 1cd3 s SER 329 Cb -0.10 0.24 0.40 0.00 0.10 0.00 0.00 66.02 66.67 1cd3 s SER 329 CO 0.66 -0.16 0.40 0.23 0.98 0.00 0.00 173.24 175.36 1cd3 n MET 330 N 4.28 -0.01 0.27 4.02 2.81 -1.07 0.21 117.12 127.63 1cd3 n MET 330 Ca -0.25 0.31 0.17 0.00 -1.81 0.00 0.00 57.70 56.13 1cd3 n MET 330 Cb 0.52 -0.64 0.74 0.00 -0.71 0.00 0.00 33.22 33.13 1cd3 n MET 330 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1cd3 h LYS 331 N 0.00 0.00 -0.00 0.03 3.64 -1.80 -1.10 116.57 117.34 1cd3 h LYS 331 Ca 0.23 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1cd3 h LYS 331 Cb 0.80 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1cd3 h LYS 331 CO -0.09 0.00 0.00 -0.25 -2.27 0.00 0.00 179.45 176.84 1cd3 n ASP 332 N -2.99 0.25 0.00 4.20 8.00 0.55 -3.90 116.55 122.65 1cd3 n ASP 332 Ca 0.00 -1.10 0.00 0.00 0.71 0.00 0.00 54.79 54.41 1cd3 n ASP 332 Cb 0.26 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 1cd3 n ASP 332 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1cd3 n VAL 333 N -0.80 0.00 -4.02 2.53 0.24 -0.77 -4.30 118.33 111.21 1cd3 n VAL 333 Ca 0.23 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.41 1cd3 n VAL 333 Cb 0.15 0.81 -0.12 0.00 -1.47 0.00 0.00 33.84 33.21 1cd3 n VAL 333 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1cd3 s PHE 334 N 0.00 0.40 0.60 6.34 0.40 -0.49 -0.03 117.98 125.20 1cd3 s PHE 334 Ca 0.00 -0.37 0.43 0.00 -0.60 0.00 0.00 56.93 56.39 1cd3 s PHE 334 Cb 0.00 -0.25 2.34 0.00 0.51 0.00 0.00 43.02 45.62 1cd3 s PHE 334 CO 0.00 -0.09 2.32 -0.09 0.70 0.00 0.00 175.22 178.06 1cd3 h ARG 335 N 5.05 0.00 -0.09 0.44 9.65 0.18 -3.16 114.38 126.46 1cd3 h ARG 335 Ca -0.31 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.38 1cd3 h ARG 335 Cb 1.20 0.00 -0.20 0.00 -1.39 0.00 0.00 29.97 29.58 1cd3 h ARG 335 CO 0.44 0.00 -0.46 -1.13 2.80 0.00 0.00 179.97 181.62 1cd3 n SER 336 N -3.01 -0.77 -4.77 -3.80 3.41 -1.26 -5.12 113.62 98.30 1cd3 n SER 336 Ca -0.03 -2.16 -0.32 0.00 -0.26 0.00 0.00 58.87 56.10 1cd3 n SER 336 Cb 0.07 0.41 0.07 0.00 -0.26 0.00 0.00 64.21 64.49 1cd3 n SER 336 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1cd3 s GLY 337 N -1.70 1.98 -0.87 5.00 0.00 -1.19 -4.95 107.32 105.59 1cd3 s GLY 337 Ca 0.13 0.45 -0.24 0.00 0.00 0.00 0.00 44.72 45.06 1cd3 s GLY 337 CO -0.10 0.81 1.30 -0.35 0.00 0.00 0.00 173.10 174.75 1cd3 s ASP 338 N -2.86 6.35 0.62 1.64 -1.08 -1.26 -4.26 116.67 115.82 1cd3 s ASP 338 Ca 0.65 -1.08 0.24 0.00 -0.52 0.00 0.00 52.55 51.84 1cd3 s ASP 338 Cb -0.20 -2.53 1.13 0.00 -1.46 0.00 0.00 42.92 39.86 1cd3 s ASP 338 CO 0.47 -1.58 1.60 -1.28 0.52 0.00 0.00 175.17 174.90 1cd3 h SER 339 N 9.76 0.00 -0.22 -0.34 0.87 -1.92 0.30 113.55 122.00 1cd3 h SER 339 Ca -0.04 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1cd3 h SER 339 Cb 1.03 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 1cd3 h SER 339 CO 1.31 0.00 0.14 -1.28 -0.53 0.00 0.00 176.83 176.48 1cd3 h SER 340 N 0.00 0.27 -3.45 6.23 0.87 -1.98 -3.40 113.55 112.09 1cd3 h SER 340 Ca 0.20 -0.01 -0.60 0.00 -1.23 0.00 0.00 61.79 60.15 1cd3 h SER 340 Cb 1.63 -0.07 -0.10 0.00 -0.44 0.00 0.00 62.40 63.42 1cd3 h SER 340 CO -0.00 0.21 0.09 -0.54 -0.53 0.00 0.00 176.83 176.06 1cd3 s LYS 341 N -5.28 4.18 0.12 2.24 3.01 0.11 -5.06 119.74 119.05 1cd3 s LYS 341 Ca -0.07 0.55 0.09 0.00 -1.01 0.00 0.00 55.97 55.53 1cd3 s LYS 341 Cb 0.17 -3.59 -0.04 0.00 -1.01 0.00 0.00 37.83 33.36 1cd3 s LYS 341 CO 0.71 -0.26 -0.21 0.15 0.51 0.00 0.00 175.35 176.25 1cd3 s LYS 342 N 1.98 1.20 0.32 1.68 1.02 -1.26 -2.58 119.74 122.11 1cd3 s LYS 342 Ca 0.27 -1.25 0.03 0.00 0.02 0.00 0.00 55.97 55.04 1cd3 s LYS 342 Cb -0.16 -1.45 -0.05 0.00 -0.52 0.00 0.00 37.83 35.65 1cd3 s LYS 342 CO 0.10 0.33 0.08 -0.59 -0.92 0.00 0.00 175.35 174.35 1cd3 s PHE 343 N -1.38 1.83 -0.17 3.18 -0.12 -0.51 -4.96 117.98 115.85 1cd3 s PHE 343 Ca 0.10 -1.07 -0.06 0.00 -0.05 0.00 0.00 56.93 55.85 1cd3 s PHE 343 Cb -0.09 -1.17 -0.03 0.00 -0.63 0.00 0.00 43.02 41.10 1cd3 s PHE 343 CO 0.05 -0.13 0.02 0.15 -0.05 0.00 0.00 175.22 175.25 1cd3 s LYS 344 N -3.89 3.83 0.28 1.99 1.02 -1.26 -2.09 119.74 119.61 1cd3 s LYS 344 Ca 0.35 -0.43 0.10 0.00 0.02 0.00 0.00 55.97 56.01 1cd3 s LYS 344 Cb 0.07 -3.08 -0.05 0.00 -0.52 0.00 0.00 37.83 34.26 1cd3 s LYS 344 CO 0.15 0.25 -0.04 0.42 -0.92 0.00 0.00 175.35 175.21 1cd3 s ILE 345 N 0.39 3.16 -0.51 2.17 1.01 -0.54 -2.28 121.20 124.61 1cd3 s ILE 345 Ca -0.00 -2.01 -0.22 0.00 0.00 0.00 0.00 60.65 58.41 1cd3 s ILE 345 Cb -0.13 -2.73 0.04 0.00 0.01 0.00 0.00 42.46 39.65 1cd3 s ILE 345 CO 0.01 -0.36 0.80 0.00 0.00 0.00 0.00 174.94 175.40 1cd3 s ALA 346 N -2.38 3.26 0.00 9.38 0.00 -1.26 -1.08 121.76 129.68 1cd3 s ALA 346 Ca 0.32 -1.31 0.00 0.00 0.00 0.00 0.00 51.96 50.96 1cd3 s ALA 346 Cb -0.05 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1cd3 s ALA 346 CO 0.19 -2.14 0.00 -1.91 0.00 0.00 0.00 175.76 171.90 1cd3 n GLU 347 N 6.87 0.00 0.00 0.00 4.07 -1.26 0.23 120.64 130.55 1cd3 n GLU 347 Ca -0.01 0.00 0.14 0.00 -0.06 0.00 0.00 57.16 57.23 1cd3 n GLU 347 Cb 0.47 0.00 0.58 0.00 -0.06 0.00 0.00 31.44 32.43 1cd3 n GLU 347 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1cd3 n GLY 348 N -0.30 -1.26 0.30 8.31 0.00 -1.26 -4.49 105.19 106.49 1cd3 n GLY 348 Ca 0.00 -0.20 0.26 0.00 0.00 0.00 0.00 46.02 46.09 1cd3 n GLY 348 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1cd3 n GLN 349 N -1.31 -0.03 0.16 1.61 -0.06 0.63 -0.51 117.38 117.88 1cd3 n GLN 349 Ca 0.10 0.91 0.04 0.00 -2.00 0.00 0.00 57.00 56.05 1cd3 n GLN 349 Cb 0.30 -1.73 0.44 0.00 -4.06 0.00 0.00 30.24 25.19 1cd3 n GLN 349 CO 0.00 0.00 0.00 -1.49 -0.20 0.00 0.00 177.06 175.37 1cd3 h TRP 350 N 0.00 0.14 -0.59 3.69 6.55 -1.82 -1.00 115.95 122.91 1cd3 h TRP 350 Ca 0.61 -0.01 -0.34 0.00 0.95 0.00 0.00 58.89 60.10 1cd3 h TRP 350 Cb 1.85 -0.04 -0.18 0.00 -0.86 0.00 0.00 29.16 29.94 1cd3 h TRP 350 CO -0.01 0.29 0.43 0.66 -1.05 0.00 0.00 178.44 178.76 1cd3 n TYR 351 N -4.29 1.85 -0.83 0.49 0.53 0.33 -3.44 117.16 111.80 1cd3 n TYR 351 Ca -0.01 -1.58 0.00 0.00 -1.02 0.00 0.00 57.90 55.28 1cd3 n TYR 351 Cb 0.26 -0.79 0.00 0.00 -1.03 0.00 0.00 39.34 37.78 1cd3 n TYR 351 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 1cd3 n ARG 352 N -0.30 0.00 -4.09 -0.72 1.74 -0.39 -5.08 116.66 107.82 1cd3 n ARG 352 Ca 0.36 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.33 1cd3 n ARG 352 Cb 1.01 -0.38 -0.11 0.00 -1.02 0.00 0.00 32.46 31.96 1cd3 n ARG 352 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1cd3 s TYR 353 N 0.00 0.68 -0.21 -1.55 5.04 -1.15 -5.10 117.35 115.06 1cd3 s TYR 353 Ca 0.00 -0.67 -0.05 0.00 -2.44 0.00 0.00 57.07 53.92 1cd3 s TYR 353 Cb 0.00 -0.41 0.07 0.00 0.35 0.00 0.00 41.96 41.97 1cd3 s TYR 353 CO 0.00 -0.14 0.10 0.00 -1.34 0.00 0.00 175.55 174.17 1cd3 s ALA 354 N -2.24 0.49 0.57 3.97 0.00 -1.26 -4.92 121.76 118.37 1cd3 s ALA 354 Ca -0.03 -0.55 -0.19 0.00 0.00 0.00 0.00 51.96 51.20 1cd3 s ALA 354 Cb -0.04 -1.14 -0.05 0.00 0.00 0.00 0.00 23.12 21.89 1cd3 s ALA 354 CO -0.02 -1.32 1.14 -1.25 0.00 0.00 0.00 175.76 174.32 1cd3 s PRO 355 N 2.13 3.21 1.05 0.00 0.04 -1.26 -5.01 135.00 135.15 1cd3 s PRO 355 Ca 0.04 1.64 -0.14 0.00 0.04 0.00 0.00 61.00 62.57 1cd3 s PRO 355 Cb -0.16 -1.98 0.21 0.00 0.04 0.00 0.00 34.50 32.61 1cd3 s PRO 355 CO -0.18 -0.97 1.11 -1.12 0.04 0.00 0.00 177.00 175.88 1cd3 s SER 356 N -1.82 2.24 -0.07 6.66 0.01 -1.26 -5.05 113.70 114.42 1cd3 s SER 356 Ca 0.73 0.96 -0.03 0.00 1.31 0.00 0.00 55.95 58.92 1cd3 s SER 356 Cb -0.25 -1.48 0.04 0.00 0.21 0.00 0.00 66.02 64.54 1cd3 s SER 356 CO 0.30 -3.34 0.13 -0.47 0.41 0.00 0.00 173.24 170.27 1cd3 s TYR 357 N -3.05 -0.13 -0.35 2.43 5.04 -1.26 -4.91 117.35 115.12 1cd3 s TYR 357 Ca 0.67 0.49 0.01 0.00 -2.44 0.00 0.00 57.07 55.80 1cd3 s TYR 357 Cb -0.15 -0.23 0.09 0.00 0.35 0.00 0.00 41.96 42.02 1cd3 s TYR 357 CO 0.56 -0.21 0.08 0.08 -1.34 0.00 0.00 175.55 174.72 1cd3 s VAL 358 N 1.83 2.67 0.16 3.14 1.01 -1.26 -5.08 120.40 122.86 1cd3 s VAL 358 Ca -0.02 -2.10 -0.34 0.00 0.00 0.00 0.00 61.98 59.53 1cd3 s VAL 358 Cb -0.12 -2.84 -0.15 0.00 0.00 0.00 0.00 36.38 33.27 1cd3 s VAL 358 CO -0.05 -0.53 1.34 -0.24 0.00 0.00 0.00 175.10 175.62 1cd3 n SER 359 N 4.41 2.01 -0.31 3.32 2.88 -1.26 -4.78 113.62 119.90 1cd3 n SER 359 Ca -0.01 1.12 0.26 0.00 -1.33 0.00 0.00 58.87 58.91 1cd3 n SER 359 Cb 0.42 -1.29 0.44 0.00 -0.75 0.00 0.00 64.21 63.03 1cd3 n SER 359 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1cd3 n PRO 360 N 2.34 -0.02 -0.27 -1.46 -0.01 -1.26 -1.69 135.00 132.62 1cd3 n PRO 360 Ca 0.16 0.81 0.00 0.00 -0.01 0.00 0.00 63.50 64.46 1cd3 n PRO 360 Cb 0.25 -1.60 0.07 0.00 -0.01 0.00 0.00 33.50 32.21 1cd3 n PRO 360 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1cd3 h ALA 361 N 1.03 0.34 -0.28 3.55 0.00 -2.01 0.55 119.26 122.45 1cd3 h ALA 361 Ca 0.57 0.27 -0.13 0.00 0.00 0.00 0.00 54.91 55.62 1cd3 h ALA 361 Cb 1.84 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 20.32 1cd3 h ALA 361 CO -0.30 -0.50 -0.36 1.88 0.00 0.00 0.00 179.25 179.97 1cd3 h TYR 362 N -0.04 0.74 0.00 0.00 -1.99 -1.66 -3.38 116.97 110.64 1cd3 h TYR 362 Ca 0.34 -0.20 0.00 0.00 2.00 0.00 0.00 58.73 60.87 1cd3 h TYR 362 Cb 0.58 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 39.15 1cd3 h TYR 362 CO -0.66 0.90 0.00 1.58 -0.00 0.00 0.00 178.16 179.98 1cd3 n HIS 363 N -4.05 0.00 -1.53 4.88 -0.00 0.19 0.91 115.22 115.62 1cd3 n HIS 363 Ca -0.01 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 57.87 1cd3 n HIS 363 Cb 0.50 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.36 1cd3 n HIS 363 CO 0.00 0.00 0.00 1.47 0.46 0.00 0.00 176.34 178.27 1cd3 n LEU 364 N -1.38 6.85 -4.79 0.27 -0.00 -1.26 -4.92 117.00 111.78 1cd3 n LEU 364 Ca 0.00 -4.20 -0.23 0.00 -0.00 0.00 0.00 56.01 51.58 1cd3 n LEU 364 Cb 0.00 -1.15 -0.05 0.00 -0.00 0.00 0.00 43.42 42.22 1cd3 n LEU 364 CO 0.00 1.66 -0.10 -0.76 -0.00 0.00 0.00 177.39 178.19 1cd3 s LEU 365 N -2.78 3.27 -0.18 1.47 1.43 0.26 -5.11 118.68 117.04 1cd3 s LEU 365 Ca 0.54 -0.87 -0.05 0.00 -1.03 0.00 0.00 54.13 52.72 1cd3 s LEU 365 Cb 0.39 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.83 1cd3 s LEU 365 CO -0.24 -0.53 0.01 -0.70 0.23 0.00 0.00 176.35 175.12 1cd3 s GLU 366 N -3.98 3.73 0.00 1.70 2.12 -1.26 -4.68 118.70 116.32 1cd3 s GLU 366 Ca 0.43 -0.47 0.00 0.00 0.36 0.00 0.00 54.97 55.29 1cd3 s GLU 366 Cb -0.00 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.32 1cd3 s GLU 366 CO 0.25 0.14 0.00 0.41 -0.54 0.00 0.00 175.26 175.52 1cd3 n GLY 367 N 3.87 1.62 3.29 -1.50 0.00 -1.26 -4.81 105.19 106.40 1cd3 n GLY 367 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 1cd3 n GLY 367 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1cd3 s PHE 368 N -2.00 2.92 -0.86 1.61 0.40 -1.26 -4.61 117.98 114.18 1cd3 s PHE 368 Ca 0.00 -1.01 0.00 0.00 -0.60 0.00 0.00 56.93 55.32 1cd3 s PHE 368 Cb 0.00 -2.05 0.00 0.00 0.51 0.00 0.00 43.02 41.48 1cd3 s PHE 368 CO 0.00 -0.55 0.15 -0.35 0.70 0.00 0.00 175.22 175.17 1cd3 n PRO 369 N 4.64 0.27 -1.00 0.24 -0.04 -1.26 -4.82 135.00 133.03 1cd3 n PRO 369 Ca -0.19 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 62.96 1cd3 n PRO 369 Cb 0.51 -1.17 0.13 0.00 -0.04 0.00 0.00 33.50 32.93 1cd3 n PRO 369 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1cd3 s PHE 370 N -0.76 2.02 -0.55 0.54 0.40 -1.26 -4.85 117.98 113.52 1cd3 s PHE 370 Ca 0.00 1.69 -0.27 0.00 -0.60 0.00 0.00 56.93 57.75 1cd3 s PHE 370 Cb 0.00 -3.26 0.03 0.00 0.51 0.00 0.00 43.02 40.31 1cd3 s PHE 370 CO 0.00 -2.42 1.11 0.42 0.70 0.00 0.00 175.22 175.03 1cd3 s ILE 371 N -2.65 4.16 0.00 0.64 1.01 0.19 -4.89 121.20 119.66 1cd3 s ILE 371 Ca 0.66 0.78 0.00 0.00 0.00 0.00 0.00 60.65 62.09 1cd3 s ILE 371 Cb -0.22 -4.65 0.00 0.00 0.01 0.00 0.00 42.46 37.60 1cd3 s ILE 371 CO 0.55 -1.22 0.35 0.00 0.00 0.00 0.00 174.94 174.62 1cd3 n GLN 372 N 8.06 0.00 -3.59 2.79 1.13 -1.26 -1.38 117.38 123.13 1cd3 n GLN 372 Ca 0.07 0.14 -0.26 0.00 -1.94 0.00 0.00 57.00 55.01 1cd3 n GLN 372 Cb 0.49 -0.85 -0.02 0.00 0.11 0.00 0.00 30.24 29.96 1cd3 n GLN 372 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1cd3 s GLU 373 N -0.69 3.52 0.43 -1.09 0.41 -1.26 -3.76 118.70 116.25 1cd3 s GLU 373 Ca 0.00 -0.34 -0.22 0.00 -0.41 0.00 0.00 54.97 54.00 1cd3 s GLU 373 Cb 0.00 -2.77 -0.09 0.00 -1.78 0.00 0.00 34.13 29.49 1cd3 s GLU 373 CO 0.00 0.31 1.01 -1.25 -0.49 0.00 0.00 175.26 174.84 1cd3 s PRO 374 N -3.70 4.09 1.02 0.39 0.04 -1.26 -4.99 135.00 130.59 1cd3 s PRO 374 Ca 0.39 1.35 -0.25 0.00 0.04 0.00 0.00 61.00 62.53 1cd3 s PRO 374 Cb -0.10 -2.32 -0.11 0.00 0.04 0.00 0.00 34.50 32.00 1cd3 s PRO 374 CO 0.31 -0.18 -1.10 -2.30 0.04 0.00 0.00 177.00 173.77 1cd3 n PRO 375 N -0.46 -0.47 0.03 0.56 -0.01 -1.26 -4.99 135.00 128.40 1cd3 n PRO 375 Ca 0.07 -0.13 0.00 0.00 -0.01 0.00 0.00 63.50 63.42 1cd3 n PRO 375 Cb 0.52 -1.19 0.00 0.00 -0.01 0.00 0.00 33.50 32.82 1cd3 n PRO 375 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 175.50 174.36 1cd3 n SER 376 N 2.06 0.10 -0.48 2.55 3.41 -1.26 -4.86 113.62 115.13 1cd3 n SER 376 Ca -0.01 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1cd3 n SER 376 Cb 0.70 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.68 1cd3 n SER 376 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1cd3 n GLY 377 N 2.17 -2.14 4.00 5.00 0.00 -1.26 -4.95 105.19 108.01 1cd3 n GLY 377 Ca 0.00 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.26 1cd3 n GLY 377 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1cd3 s ASP 378 N -2.39 4.40 0.00 1.61 2.15 -1.26 -4.66 116.67 116.52 1cd3 s ASP 378 Ca 0.00 -0.49 0.00 0.00 0.43 0.00 0.00 52.55 52.49 1cd3 s ASP 378 Cb 0.00 0.13 0.00 0.00 -0.30 0.00 0.00 42.92 42.75 1cd3 s ASP 378 CO 0.00 -1.83 0.17 -0.11 -0.17 0.00 0.00 175.17 173.23 1cd3 n LEU 379 N -2.77 0.29 0.04 -1.34 7.94 -1.26 0.19 117.00 120.10 1cd3 n LEU 379 Ca 0.16 -0.15 -0.01 0.00 -1.11 0.00 0.00 56.01 54.90 1cd3 n LEU 379 Cb 0.61 -0.15 -0.00 0.00 0.53 0.00 0.00 43.42 44.41 1cd3 n LEU 379 CO 0.42 0.07 -0.05 1.67 -1.11 0.00 0.00 177.39 178.39 1cd3 n GLN 380 N 0.26 0.04 -0.03 1.96 7.27 -1.26 -4.30 117.38 121.33 1cd3 n GLN 380 Ca 0.00 0.02 0.08 0.00 0.07 0.00 0.00 57.00 57.17 1cd3 n GLN 380 Cb 0.07 -0.54 0.47 0.00 2.41 0.00 0.00 30.24 32.65 1cd3 n GLN 380 CO 0.00 0.00 0.00 1.49 0.07 0.00 0.00 177.06 178.62 1cd3 h GLU 381 N -0.07 0.44 -0.07 3.69 4.22 -1.79 0.47 114.58 121.47 1cd3 h GLU 381 Ca 0.00 -0.03 -0.07 0.00 0.08 0.00 0.00 59.36 59.34 1cd3 h GLU 381 Cb 0.07 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1cd3 h GLU 381 CO 0.00 0.29 -0.23 0.00 -2.18 0.00 0.00 179.01 176.89 1cd3 h ARG 382 N 0.46 0.28 -0.17 1.92 3.08 0.19 -3.31 114.38 116.83 1cd3 h ARG 382 Ca 0.20 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1cd3 h ARG 382 Cb 0.23 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1cd3 h ARG 382 CO -0.05 0.83 0.09 0.28 -1.07 0.00 0.00 179.97 180.05 1cd3 h VAL 383 N -0.22 1.09 -3.43 2.04 2.07 -1.45 -3.45 116.25 112.90 1cd3 h VAL 383 Ca -0.01 -0.25 -0.44 0.00 0.82 0.00 0.00 66.70 66.82 1cd3 h VAL 383 Cb 0.86 0.96 0.20 0.00 -1.52 0.00 0.00 31.29 31.79 1cd3 h VAL 383 CO 0.05 0.09 0.06 -0.76 0.02 0.00 0.00 177.57 177.03 1cd3 s LEU 384 N -10.03 0.99 -0.15 2.57 1.43 0.16 -2.75 118.68 110.90 1cd3 s LEU 384 Ca -0.13 1.39 -0.05 0.00 -1.03 0.00 0.00 54.13 54.31 1cd3 s LEU 384 Cb 0.07 -3.36 -0.04 0.00 0.03 0.00 0.00 46.19 42.89 1cd3 s LEU 384 CO 0.69 -3.93 0.03 -0.63 0.23 0.00 0.00 176.35 172.74 1cd3 s ILE 385 N -2.62 4.49 -0.54 -0.59 1.09 -1.04 -4.74 121.20 117.26 1cd3 s ILE 385 Ca 0.68 -0.15 -0.20 0.00 -1.10 0.00 0.00 60.65 59.88 1cd3 s ILE 385 Cb -0.23 -2.98 0.07 0.00 -1.06 0.00 0.00 42.46 38.26 1cd3 s ILE 385 CO 0.63 0.51 0.68 -0.60 -0.10 0.00 0.00 174.94 176.05 1cd3 s ARG 386 N 0.03 3.12 0.57 2.79 3.52 -1.26 -4.87 118.95 122.85 1cd3 s ARG 386 Ca 0.04 -0.94 0.33 0.00 -0.13 0.00 0.00 55.73 55.03 1cd3 s ARG 386 Cb -0.13 -4.14 1.70 0.00 -1.56 0.00 0.00 34.95 30.82 1cd3 s ARG 386 CO 0.01 -1.34 2.14 1.12 -0.81 0.00 0.00 175.30 176.42 1cd3 h HIS 387 N 9.09 0.00 -0.54 5.12 2.07 -1.95 -2.53 115.15 126.41 1cd3 h HIS 387 Ca -0.28 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.23 1cd3 h HIS 387 Cb 1.09 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.04 1cd3 h HIS 387 CO 0.79 0.06 0.28 0.45 -3.07 0.00 0.00 177.93 176.44 1cd3 h HIS 388 N 0.00 0.72 -0.76 6.12 3.86 -1.91 -2.34 115.15 120.84 1cd3 h HIS 388 Ca -0.00 -0.01 0.22 0.00 -1.16 0.00 0.00 60.37 59.42 1cd3 h HIS 388 Cb 0.28 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 1cd3 h HIS 388 CO 0.00 0.52 0.82 -0.44 0.86 0.00 0.00 177.93 179.69 1cd3 h ASP 389 N 0.74 0.00 0.54 2.45 3.32 -1.87 -0.52 116.42 121.08 1cd3 h ASP 389 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1cd3 h ASP 389 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1cd3 h ASP 389 CO -0.03 0.00 -1.21 -1.22 -1.72 0.00 0.00 179.24 175.06 1cd3 n TYR 390 N -3.54 0.45 -0.39 4.55 4.02 -0.88 -4.22 117.16 117.15 1cd3 n TYR 390 Ca 0.16 0.13 0.33 0.00 -0.01 0.00 0.00 57.90 58.52 1cd3 n TYR 390 Cb 1.08 -0.63 0.66 0.00 -0.02 0.00 0.00 39.34 40.43 1cd3 n TYR 390 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1cd3 h ASP 391 N 0.00 0.20 -0.08 7.72 3.32 -1.21 0.39 116.42 126.75 1cd3 h ASP 391 Ca 0.00 0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.13 1cd3 h ASP 391 Cb 0.87 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.45 1cd3 h ASP 391 CO 0.00 -0.01 0.06 -0.61 -1.72 0.00 0.00 179.24 176.96 1cd3 h GLN 392 N 0.15 0.00 -0.72 3.56 4.15 -1.73 -2.34 115.11 118.18 1cd3 h GLN 392 Ca 0.67 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.09 1cd3 h GLN 392 Cb 2.24 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.93 1cd3 h GLN 392 CO -0.19 0.00 0.00 0.00 -1.93 0.00 0.00 178.83 176.71 1cd3 s PHE 394 N -1.68 1.11 0.60 0.00 0.40 -0.88 -2.96 117.98 114.58 1cd3 s PHE 394 Ca 0.21 -0.33 0.35 0.00 -0.60 0.00 0.00 56.93 56.56 1cd3 s PHE 394 Cb 0.15 -0.81 1.89 0.00 0.51 0.00 0.00 43.02 44.75 1cd3 s PHE 394 CO 0.08 -0.16 2.06 0.37 0.70 0.00 0.00 175.22 178.27 1cd3 h GLN 395 N 6.62 0.00 -1.03 0.44 4.15 -1.43 -3.43 115.11 120.43 1cd3 h GLN 395 Ca -0.33 0.00 0.21 0.00 0.77 0.00 0.00 58.65 59.29 1cd3 h GLN 395 Cb 1.17 0.00 -0.33 0.00 0.21 0.00 0.00 27.48 28.53 1cd3 h GLN 395 CO 0.48 0.00 0.74 0.45 -1.93 0.00 0.00 178.83 178.57 1cd3 s SER 396 N -4.65 -0.07 -0.46 -0.69 0.15 -1.26 -4.99 113.70 101.74 1cd3 s SER 396 Ca -0.04 0.11 0.04 0.00 0.70 0.00 0.00 55.95 56.75 1cd3 s SER 396 Cb 0.10 1.03 0.54 0.00 -1.71 0.00 0.00 66.02 65.98 1cd3 s SER 396 CO 0.32 -0.02 1.75 0.52 1.20 0.00 0.00 173.24 177.01 1cd3 n VAL 397 N 3.16 3.09 0.19 4.45 0.31 -1.26 -4.54 118.33 123.73 1cd3 n VAL 397 Ca -0.17 -2.72 0.03 0.00 -0.01 0.00 0.00 64.34 61.48 1cd3 n VAL 397 Cb 0.56 -0.72 0.42 0.00 -0.91 0.00 0.00 33.84 33.19 1cd3 n VAL 397 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 1cd3 h GLN 398 N 1.44 0.03 -0.92 5.55 4.15 -1.99 -1.85 115.11 121.52 1cd3 h GLN 398 Ca 0.49 -0.01 -0.58 0.00 0.77 0.00 0.00 58.65 59.33 1cd3 h GLN 398 Cb 1.78 -0.00 -0.41 0.00 0.21 0.00 0.00 27.48 29.06 1cd3 h GLN 398 CO 1.03 0.30 -0.56 -0.11 -1.93 0.00 0.00 178.83 177.56 1cd3 n LEU 399 N -4.21 5.30 0.00 -2.39 0.00 -1.26 -5.07 117.00 109.37 1cd3 n LEU 399 Ca -0.02 -4.76 0.00 0.00 0.00 0.00 0.00 56.01 51.23 1cd3 n LEU 399 Cb 0.33 -0.45 0.00 0.00 0.00 0.00 0.00 43.42 43.30 1cd3 n LEU 399 CO 0.38 2.04 0.00 0.18 0.00 0.00 0.00 177.39 179.99 1cd3 n LEU 400 N -0.70 0.00 -0.07 -1.96 4.77 -0.70 -4.45 117.00 113.88 1cd3 n LEU 400 Ca 0.46 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.34 1cd3 n LEU 400 Cb 0.87 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.91 1cd3 n LEU 400 CO 0.44 -0.45 -0.18 1.56 -1.33 0.00 0.00 177.39 177.44 1cd3 h GLN 401 N 0.00 0.00 -5.01 3.23 4.20 -1.80 -3.40 115.11 112.33 1cd3 h GLN 401 Ca 0.00 0.00 -0.64 0.00 0.06 0.00 0.00 58.65 58.07 1cd3 h GLN 401 Cb 0.00 0.00 -0.34 0.00 0.30 0.00 0.00 27.48 27.44 1cd3 h GLN 401 CO 0.00 0.42 -0.86 1.67 -0.67 0.00 0.00 178.83 179.39 1cd3 s TRP 402 N -2.10 2.42 0.29 2.96 1.48 -1.02 -2.21 118.94 120.76 1cd3 s TRP 402 Ca -0.15 -1.23 0.09 0.00 -1.06 0.00 0.00 56.10 53.75 1cd3 s TRP 402 Cb 0.02 -1.68 -0.04 0.00 -1.16 0.00 0.00 33.47 30.60 1cd3 s TRP 402 CO 0.34 -0.59 0.03 0.54 -4.06 0.00 0.00 176.95 173.21 1cd3 s ASN 403 N 0.95 4.58 -0.28 -2.66 2.20 -0.71 0.89 114.94 119.91 1cd3 s ASN 403 Ca -0.05 -0.68 -0.20 0.00 -0.94 0.00 0.00 52.86 50.98 1cd3 s ASN 403 Cb -0.15 -0.82 0.11 0.00 -2.00 0.00 0.00 41.25 38.39 1cd3 s ASN 403 CO -0.03 -0.08 0.90 -0.55 -2.94 0.00 0.00 177.10 174.40 1cd3 s SER 404 N -3.72 -0.61 -0.07 3.54 0.15 0.13 -1.82 113.70 111.30 1cd3 s SER 404 Ca 0.33 1.07 -0.04 0.00 0.70 0.00 0.00 55.95 58.01 1cd3 s SER 404 Cb -0.05 1.17 -0.04 0.00 -1.71 0.00 0.00 66.02 65.39 1cd3 s SER 404 CO 0.21 -0.18 0.12 0.00 1.20 0.00 0.00 173.24 174.59 1cd3 s GLN 405 N 0.88 3.30 -0.23 5.44 0.00 -0.88 -2.10 119.66 126.08 1cd3 s GLN 405 Ca -0.04 -0.28 -0.26 0.00 -0.00 0.00 0.00 55.36 54.78 1cd3 s GLN 405 Cb -0.05 -3.05 0.07 0.00 0.00 0.00 0.00 33.01 29.99 1cd3 s GLN 405 CO -0.11 0.72 0.72 0.14 0.00 0.00 0.00 175.29 176.77 1cd3 s VAL 406 N -1.11 0.00 -0.25 3.63 -7.23 -0.73 -0.20 120.40 114.51 1cd3 s VAL 406 Ca 0.19 0.00 -0.10 0.00 -1.81 0.00 0.00 61.98 60.26 1cd3 s VAL 406 Cb -0.12 -1.00 -0.05 0.00 0.56 0.00 0.00 36.38 35.77 1cd3 s VAL 406 CO 0.09 0.00 0.16 -0.75 -0.31 0.00 0.00 175.10 174.28 1cd3 s LYS 407 N 0.06 3.98 -1.05 4.82 2.20 0.17 -0.72 119.74 129.21 1cd3 s LYS 407 Ca -0.02 -0.31 -0.17 0.00 -0.36 0.00 0.00 55.97 55.11 1cd3 s LYS 407 Cb -0.04 -3.54 0.14 0.00 -1.51 0.00 0.00 37.83 32.88 1cd3 s LYS 407 CO 0.03 -0.04 1.27 -0.06 -0.36 0.00 0.00 175.35 176.19 1cd3 s PHE 408 N 1.32 3.25 -0.80 4.03 0.08 0.12 -2.47 117.98 123.52 1cd3 s PHE 408 Ca 0.07 -1.69 -0.25 0.00 0.12 0.00 0.00 56.93 55.18 1cd3 s PHE 408 Cb -0.14 -4.31 0.00 0.00 -0.57 0.00 0.00 43.02 37.99 1cd3 s PHE 408 CO 0.06 -1.47 1.64 -0.80 -0.10 0.00 0.00 175.22 174.55 1cd3 s ASN 409 N 3.35 5.74 -0.18 1.36 0.01 -1.07 -0.99 114.94 123.16 1cd3 s ASN 409 Ca 0.37 -0.47 0.01 0.00 -0.71 0.00 0.00 52.86 52.06 1cd3 s ASN 409 Cb -0.04 -2.55 0.03 0.00 0.41 0.00 0.00 41.25 39.10 1cd3 s ASN 409 CO -0.05 -2.14 -0.13 -0.69 -1.51 0.00 0.00 177.10 172.58 1cd3 s VAL 410 N 7.55 1.71 0.19 1.60 1.01 -1.26 0.09 120.40 131.28 1cd3 s VAL 410 Ca 0.55 -0.90 0.08 0.00 0.00 0.00 0.00 61.98 61.71 1cd3 s VAL 410 Cb -0.07 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 1cd3 s VAL 410 CO 0.08 0.31 -0.04 0.42 0.00 0.00 0.00 175.10 175.87 1cd3 s THR 411 N 1.40 3.44 -0.10 3.92 -4.23 0.51 -1.23 115.64 119.34 1cd3 s THR 411 Ca 0.01 -1.59 -0.04 0.00 -1.18 0.00 0.00 61.69 58.90 1cd3 s THR 411 Cb -0.15 -2.73 0.05 0.00 1.34 0.00 0.00 72.50 71.01 1cd3 s THR 411 CO -0.10 -0.14 0.20 -0.69 -0.54 0.00 0.00 174.62 173.36 1cd3 s VAL 412 N -1.79 -0.27 -0.70 2.29 1.01 0.30 -0.83 120.40 120.41 1cd3 s VAL 412 Ca 0.27 0.29 -0.24 0.00 0.00 0.00 0.00 61.98 62.30 1cd3 s VAL 412 Cb -0.09 -0.35 0.06 0.00 0.00 0.00 0.00 36.38 36.01 1cd3 s VAL 412 CO 0.17 0.12 1.08 -0.31 0.00 0.00 0.00 175.10 176.16 1cd3 s TYR 413 N 2.11 2.57 0.33 5.22 1.51 0.10 0.03 117.35 129.23 1cd3 s TYR 413 Ca -0.00 -0.44 0.04 0.00 -1.01 0.00 0.00 57.07 55.66 1cd3 s TYR 413 Cb -0.12 -4.40 -0.02 0.00 -0.11 0.00 0.00 41.96 37.31 1cd3 s TYR 413 CO -0.07 -1.78 0.16 2.89 -1.11 0.00 0.00 175.55 175.64 1cd3 n ARG 414 N 8.19 0.55 -3.68 -0.62 1.85 -0.34 -1.22 116.66 121.39 1cd3 n ARG 414 Ca 0.00 -2.95 -0.23 0.00 -1.00 0.00 0.00 57.85 53.68 1cd3 n ARG 414 Cb 0.47 1.83 -0.18 0.00 -1.05 0.00 0.00 32.46 33.53 1cd3 n ARG 414 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 1cd3 s ASN 415 N -3.12 1.65 0.05 2.89 3.84 -1.26 -2.22 114.94 116.77 1cd3 s ASN 415 Ca 0.22 -0.19 0.04 0.00 0.21 0.00 0.00 52.86 53.15 1cd3 s ASN 415 Cb 0.01 -0.25 -0.03 0.00 -0.55 0.00 0.00 41.25 40.44 1cd3 s ASN 415 CO 0.16 -0.27 -0.12 -0.76 -2.79 0.00 0.00 177.10 173.32 1cd3 s LEU 416 N 2.11 2.25 1.30 3.21 1.43 -1.26 -5.09 118.68 122.62 1cd3 s LEU 416 Ca 0.04 -0.55 -0.20 0.00 -1.03 0.00 0.00 54.13 52.39 1cd3 s LEU 416 Cb -0.13 -0.40 0.32 0.00 0.03 0.00 0.00 46.19 46.01 1cd3 s LEU 416 CO -0.05 -0.10 1.01 -2.16 0.23 0.00 0.00 176.35 175.27 1cd3 s PRO 417 N -1.55 -1.98 0.94 1.29 0.04 -1.26 -5.00 135.00 127.48 1cd3 s PRO 417 Ca -0.04 0.19 -0.14 0.00 0.04 0.00 0.00 61.00 61.04 1cd3 s PRO 417 Cb -0.09 -1.48 0.20 0.00 0.04 0.00 0.00 34.50 33.16 1cd3 s PRO 417 CO 0.01 -4.27 1.29 0.95 0.04 0.00 0.00 177.00 175.03 1cd3 s THR 418 N -2.56 2.01 -2.00 1.26 -4.23 -1.26 -4.86 115.64 104.00 1cd3 s THR 418 Ca 0.69 -0.07 0.04 0.00 -1.18 0.00 0.00 61.69 61.17 1cd3 s THR 418 Cb -0.14 -2.94 0.13 0.00 1.34 0.00 0.00 72.50 70.89 1cd3 s THR 418 CO 0.58 0.00 0.87 0.35 -0.54 0.00 0.00 174.62 175.88 1cd3 n THR 419 N -3.68 0.00 -3.50 3.99 -2.24 -1.26 -3.40 114.28 104.19 1cd3 n THR 419 Ca 0.16 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.56 1cd3 n THR 419 Cb 0.59 -0.27 -0.08 0.00 -2.10 0.00 0.00 70.33 68.47 1cd3 n THR 419 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1cd3 s ARG 420 N -2.00 4.18 0.00 -0.78 3.00 -1.26 -1.42 118.95 120.67 1cd3 s ARG 420 Ca 0.07 0.06 0.00 0.00 0.00 0.00 0.00 55.73 55.86 1cd3 s ARG 420 Cb 0.03 -3.50 0.00 0.00 0.00 0.00 0.00 34.95 31.48 1cd3 s ARG 420 CO 0.05 0.07 0.00 -3.47 0.00 0.00 0.00 175.30 171.95 1cd3 n ASP 421 N 4.16 0.00 0.26 0.23 2.03 -1.07 -4.31 116.55 117.84 1cd3 n ASP 421 Ca -0.11 0.00 0.18 0.00 0.52 0.00 0.00 54.79 55.38 1cd3 n ASP 421 Cb 0.51 0.00 0.87 0.00 -0.72 0.00 0.00 41.12 41.79 1cd3 n ASP 421 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1cd3 h SER 422 N 0.00 0.00 0.00 1.67 4.64 -1.71 -2.64 113.55 115.51 1cd3 h SER 422 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cd3 h SER 422 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1cd3 h SER 422 CO 0.00 0.00 -0.34 -0.38 -0.87 0.00 0.00 176.83 175.24 1cd3 n ILE 423 N -3.31 0.00 -3.23 0.95 5.41 -0.51 -4.94 119.36 113.74 1cd3 n ILE 423 Ca 0.00 0.00 -0.34 0.00 1.00 0.00 0.00 62.75 63.42 1cd3 n ILE 423 Cb 0.36 0.15 -0.04 0.00 -0.71 0.00 0.00 39.64 39.40 1cd3 n ILE 423 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 176.55 176.78 1cd3 n MET 424 N -0.52 3.38 -0.07 0.38 2.81 -1.00 -4.98 117.12 117.11 1cd3 n MET 424 Ca 0.00 -4.63 -0.01 0.00 -1.81 0.00 0.00 57.70 51.25 1cd3 n MET 424 Cb 0.01 -2.36 -0.00 0.00 -0.71 0.00 0.00 33.22 30.15 1cd3 n MET 424 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1cd3 n THR 425 N 1.00 -0.10 1.32 2.03 -2.24 -1.17 -2.61 114.28 112.50 1cd3 n THR 425 Ca 0.29 0.41 0.11 0.00 -2.27 0.00 0.00 64.05 62.58 1cd3 n THR 425 Cb 0.38 -0.52 0.63 0.00 -2.10 0.00 0.00 70.33 68.71 1cd3 n THR 425 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96