#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b78 s ALA 3 N 0.00 3.36 0.10 1.55 0.00 -1.26 -0.49 121.76 125.03 3b78 s ALA 3 Ca 0.00 0.30 0.04 0.00 0.00 0.00 0.00 51.96 52.30 3b78 s ALA 3 Cb 0.00 -3.01 -0.04 0.00 0.00 0.00 0.00 23.12 20.07 3b78 s ALA 3 CO 0.00 0.06 -0.11 -0.06 0.00 0.00 0.00 175.76 175.65 3b78 s PHE 4 N -0.06 1.13 0.46 0.00 0.08 0.70 -4.83 117.98 115.46 3b78 s PHE 4 Ca 0.39 -0.64 0.01 0.00 0.12 0.00 0.00 56.93 56.81 3b78 s PHE 4 Cb -0.21 -0.61 0.00 0.00 -0.57 0.00 0.00 43.02 41.64 3b78 s PHE 4 CO 0.23 0.03 0.67 0.95 -0.10 0.00 0.00 175.22 177.01 3b78 s THR 5 N -2.45 3.77 0.46 0.64 -4.23 -1.26 -1.87 115.64 110.70 3b78 s THR 5 Ca 0.07 -0.56 0.11 0.00 -1.18 0.00 0.00 61.69 60.13 3b78 s THR 5 Cb -0.03 -3.39 0.27 0.00 1.34 0.00 0.00 72.50 70.70 3b78 s THR 5 CO 0.01 -0.26 2.09 0.58 -0.54 0.00 0.00 174.62 176.50 3b78 h VAL 6 N 0.38 1.05 0.21 2.29 2.07 -1.96 -2.04 116.25 118.24 3b78 h VAL 6 Ca -0.45 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 3b78 h VAL 6 Cb 1.26 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 3b78 h VAL 6 CO 0.56 0.06 -0.10 0.44 0.02 0.00 0.00 177.57 178.55 3b78 h ASP 7 N 0.31 -0.23 -0.98 0.57 3.32 -1.99 -2.09 116.42 115.33 3b78 h ASP 7 Ca 0.09 -0.10 0.04 0.00 0.02 0.00 0.00 57.03 57.09 3b78 h ASP 7 Cb -0.00 0.06 -0.06 0.00 0.22 0.00 0.00 39.33 39.55 3b78 h ASP 7 CO -0.02 -0.04 0.64 1.56 -1.72 0.00 0.00 179.24 179.66 3b78 h GLN 8 N -0.42 1.18 -0.39 3.56 4.20 -1.84 -1.39 115.11 120.01 3b78 h GLN 8 Ca -0.03 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 3b78 h GLN 8 Cb 0.32 -0.27 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 3b78 h GLN 8 CO 0.05 0.78 0.22 0.52 -0.67 0.00 0.00 178.83 179.73 3b78 h MET 9 N 1.21 0.54 -0.46 1.46 2.86 -1.29 -1.32 114.93 117.93 3b78 h MET 9 Ca 0.40 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.97 3b78 h MET 9 Cb 0.05 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 3b78 h MET 9 CO -0.13 0.42 0.25 -0.09 1.06 0.00 0.00 176.91 178.42 3b78 h ARG 10 N 0.51 0.64 0.00 1.72 9.65 -0.72 0.13 114.38 126.30 3b78 h ARG 10 Ca 0.14 -0.08 -0.03 0.00 -1.10 0.00 0.00 59.98 58.91 3b78 h ARG 10 Cb 0.03 -0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 28.49 3b78 h ARG 10 CO -0.02 0.52 -0.12 0.66 2.80 0.00 0.00 179.97 183.80 3b78 h SER 11 N 0.60 0.00 0.29 -3.80 4.64 -1.12 -0.79 113.55 113.37 3b78 h SER 11 Ca 0.16 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.19 3b78 h SER 11 Cb 0.07 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.18 3b78 h SER 11 CO -0.02 0.12 -1.27 0.25 -0.87 0.00 0.00 176.83 175.04 3b78 h LEU 12 N 0.00 0.74 -0.10 5.97 5.85 -0.32 -3.17 115.31 124.28 3b78 h LEU 12 Ca -0.00 -0.72 0.00 0.00 0.84 0.00 0.00 57.88 58.00 3b78 h LEU 12 Cb 0.24 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.04 3b78 h LEU 12 CO 0.02 1.54 0.00 0.23 -0.34 0.00 0.00 178.44 179.89 3b78 n MET 13 N -3.72 0.10 -0.03 1.25 2.81 0.37 -3.39 117.12 114.51 3b78 n MET 13 Ca -0.13 0.17 -0.15 0.00 -1.81 0.00 0.00 57.70 55.78 3b78 n MET 13 Cb 1.01 -1.63 -0.10 0.00 -0.71 0.00 0.00 33.22 31.78 3b78 n MET 13 CO 0.00 0.00 0.00 0.22 1.51 0.00 0.00 175.97 177.70 3b78 h ASP 14 N 0.00 0.34 -1.04 7.83 -0.00 -1.13 -3.37 116.42 119.06 3b78 h ASP 14 Ca 0.00 -0.69 -0.63 0.00 -0.00 0.00 0.00 57.03 55.71 3b78 h ASP 14 Cb 0.49 -0.10 -0.09 0.00 -0.00 0.00 0.00 39.33 39.63 3b78 h ASP 14 CO 0.00 0.98 1.76 -0.54 -0.00 0.00 0.00 179.24 181.44 3b78 s LYS 15 N -3.46 3.74 0.00 0.28 1.02 -1.22 -4.79 119.74 115.31 3b78 s LYS 15 Ca -0.15 -1.47 0.29 0.00 0.02 0.00 0.00 55.97 54.67 3b78 s LYS 15 Cb 0.03 -5.42 1.31 0.00 -0.52 0.00 0.00 37.83 33.23 3b78 s LYS 15 CO 0.76 -2.22 1.95 1.55 -0.92 0.00 0.00 175.35 176.47 3b78 n VAL 16 N 6.68 0.00 0.24 3.17 3.14 -1.26 -2.36 118.33 127.93 3b78 n VAL 16 Ca 0.39 -0.00 0.13 0.00 -2.96 0.00 0.00 64.34 61.89 3b78 n VAL 16 Cb 0.49 -0.44 0.50 0.00 -1.06 0.00 0.00 33.84 33.33 3b78 n VAL 16 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 3b78 h THR 17 N 0.04 0.30 -0.72 1.55 1.35 -1.88 -3.08 112.91 110.47 3b78 h THR 17 Ca 0.00 -0.92 -0.33 0.00 -0.55 0.00 0.00 66.41 64.61 3b78 h THR 17 Cb 0.41 1.72 -0.20 0.00 -1.73 0.00 0.00 68.15 68.35 3b78 h THR 17 CO 0.00 0.12 0.33 0.59 -0.25 0.00 0.00 175.52 176.32 3b78 n ASN 18 N -3.24 3.66 -4.60 5.36 4.13 -1.00 -4.75 115.26 114.82 3b78 n ASN 18 Ca 0.01 -3.54 -0.33 0.00 1.68 0.00 0.00 54.58 52.40 3b78 n ASN 18 Cb 0.40 -0.75 -0.11 0.00 -1.54 0.00 0.00 39.78 37.79 3b78 n ASN 18 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3b78 s VAL 19 N -3.19 3.70 -0.29 2.41 1.01 -1.16 -1.07 120.40 121.80 3b78 s VAL 19 Ca 0.52 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.85 3b78 s VAL 19 Cb 0.44 -2.58 0.09 0.00 0.00 0.00 0.00 36.38 34.33 3b78 s VAL 19 CO 0.08 0.46 0.04 -0.13 0.00 0.00 0.00 175.10 175.55 3b78 s ARG 20 N -1.23 1.19 -0.43 2.72 1.81 0.34 -4.01 118.95 119.33 3b78 s ARG 20 Ca 0.16 -1.27 -0.21 0.00 -1.72 0.00 0.00 55.73 52.69 3b78 s ARG 20 Cb -0.11 -2.52 0.02 0.00 -0.45 0.00 0.00 34.95 31.89 3b78 s ARG 20 CO 0.06 -0.85 0.65 -0.80 -0.68 0.00 0.00 175.30 173.68 3b78 s ASN 21 N 1.35 6.34 0.22 0.23 0.01 -1.26 -0.48 114.94 121.35 3b78 s ASN 21 Ca 0.05 -0.28 -0.09 0.00 -0.71 0.00 0.00 52.86 51.83 3b78 s ASN 21 Cb -0.18 -2.33 -0.01 0.00 0.41 0.00 0.00 41.25 39.14 3b78 s ASN 21 CO -0.14 -0.78 0.36 0.00 -1.51 0.00 0.00 177.10 175.03 3b78 s MET 22 N 2.85 1.39 0.27 -0.60 0.23 -0.89 -0.25 119.30 122.30 3b78 s MET 22 Ca 0.23 -1.34 0.02 0.00 -1.03 0.00 0.00 55.69 53.57 3b78 s MET 22 Cb -0.14 0.40 -0.04 0.00 -1.53 0.00 0.00 34.83 33.52 3b78 s MET 22 CO 0.19 -0.54 0.12 -1.54 -2.03 0.00 0.00 175.02 171.22 3b78 s SER 23 N -3.05 1.22 -0.24 -1.18 1.04 -1.07 -1.37 113.70 109.05 3b78 s SER 23 Ca 0.26 -1.45 -0.05 0.00 0.48 0.00 0.00 55.95 55.19 3b78 s SER 23 Cb 0.02 0.27 -0.00 0.00 0.10 0.00 0.00 66.02 66.41 3b78 s SER 23 CO 0.08 -0.80 -0.00 -0.69 0.98 0.00 0.00 173.24 172.81 3b78 s VAL 24 N -3.74 3.57 -0.49 5.02 1.01 -1.26 -1.01 120.40 123.51 3b78 s VAL 24 Ca 0.37 -0.55 -0.15 0.00 0.00 0.00 0.00 61.98 61.65 3b78 s VAL 24 Cb 0.07 -2.70 0.09 0.00 0.00 0.00 0.00 36.38 33.83 3b78 s VAL 24 CO 0.15 0.31 0.41 -0.63 0.00 0.00 0.00 175.10 175.35 3b78 s ILE 25 N 1.48 5.19 -0.03 2.22 1.01 -0.37 -4.87 121.20 125.83 3b78 s ILE 25 Ca 0.05 -1.18 -0.27 0.00 0.00 0.00 0.00 60.65 59.24 3b78 s ILE 25 Cb -0.15 -4.15 0.06 0.00 0.01 0.00 0.00 42.46 38.22 3b78 s ILE 25 CO -0.01 -0.64 0.60 0.00 0.00 0.00 0.00 174.94 174.89 3b78 s ALA 26 N 1.62 -1.57 0.17 9.38 0.00 -1.26 -0.90 121.76 129.21 3b78 s ALA 26 Ca 0.04 1.08 -0.30 0.00 0.00 0.00 0.00 51.96 52.78 3b78 s ALA 26 Cb -0.26 0.06 -0.07 0.00 0.00 0.00 0.00 23.12 22.85 3b78 s ALA 26 CO 0.06 -0.37 1.04 -1.58 0.00 0.00 0.00 175.76 174.91 3b78 s HIS 27 N -1.35 3.70 0.36 0.00 2.46 -1.26 -4.90 115.29 114.30 3b78 s HIS 27 Ca -0.11 1.70 0.13 0.00 0.47 0.00 0.00 55.06 57.25 3b78 s HIS 27 Cb -0.01 -3.18 0.95 0.00 -0.13 0.00 0.00 32.58 30.21 3b78 s HIS 27 CO 0.08 -0.25 1.78 0.28 -2.47 0.00 0.00 174.74 174.16 3b78 h VAL 28 N 3.72 0.61 0.00 0.89 2.07 -1.97 0.27 116.25 121.83 3b78 h VAL 28 Ca -0.44 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3b78 h VAL 28 Cb 1.21 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 3b78 h VAL 28 CO 0.71 0.10 0.00 0.47 0.02 0.00 0.00 177.57 178.87 3b78 n ASP 29 N -4.69 0.15 -2.19 0.57 8.00 -1.26 -2.99 116.55 114.13 3b78 n ASP 29 Ca 0.24 0.53 -0.24 0.00 0.71 0.00 0.00 54.79 56.02 3b78 n ASP 29 Cb 0.73 -0.56 0.16 0.00 -0.02 0.00 0.00 41.12 41.43 3b78 n ASP 29 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3b78 n HIS 30 N -1.65 2.97 -3.34 1.24 8.25 0.94 -4.91 115.22 118.72 3b78 n HIS 30 Ca 0.05 -1.94 -0.18 0.00 -0.26 0.00 0.00 57.72 55.39 3b78 n HIS 30 Cb 0.25 -0.98 0.07 0.00 1.12 0.00 0.00 29.99 30.45 3b78 n HIS 30 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3b78 n GLY 31 N -1.05 -0.27 0.23 -1.41 0.00 -1.16 -4.88 105.19 96.65 3b78 n GLY 31 Ca 0.58 0.07 -0.15 0.00 0.00 0.00 0.00 46.02 46.51 3b78 n GLY 31 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3b78 h LYS 32 N -2.05 -0.49 -0.05 1.61 3.64 -1.67 -2.46 116.57 115.09 3b78 h LYS 32 Ca -0.48 0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 58.87 3b78 h LYS 32 Cb 1.30 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.22 3b78 h LYS 32 CO 0.45 -0.29 -0.28 0.66 -2.27 0.00 0.00 179.45 177.71 3b78 h SER 33 N -0.58 0.09 0.23 4.20 4.64 -1.92 -2.71 113.55 117.51 3b78 h SER 33 Ca -0.05 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 3b78 h SER 33 Cb 0.43 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3b78 h SER 33 CO 0.09 0.38 -0.11 0.74 -0.87 0.00 0.00 176.83 177.06 3b78 h THR 34 N 0.09 0.81 -0.16 2.95 2.02 -1.91 -0.32 112.91 116.39 3b78 h THR 34 Ca 0.01 -0.19 -0.04 0.00 0.77 0.00 0.00 66.41 66.96 3b78 h THR 34 Cb 0.55 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 3b78 h THR 34 CO 0.04 0.04 -0.10 -0.07 0.37 0.00 0.00 175.52 175.80 3b78 h LEU 35 N -0.40 0.23 -0.86 2.58 3.38 -1.41 -2.18 115.31 116.66 3b78 h LEU 35 Ca -0.03 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 3b78 h LEU 35 Cb 0.31 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 3b78 h LEU 35 CO 0.05 0.36 -0.09 0.74 0.09 0.00 0.00 178.44 179.60 3b78 h THR 36 N 0.24 1.25 -0.67 0.22 2.02 -1.14 -2.83 112.91 112.00 3b78 h THR 36 Ca 0.05 -1.12 -0.08 0.00 0.77 0.00 0.00 66.41 66.03 3b78 h THR 36 Cb 0.33 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 3b78 h THR 36 CO 0.02 0.38 0.11 0.44 0.37 0.00 0.00 175.52 176.84 3b78 h ASP 37 N 0.69 1.07 -0.82 4.18 3.32 -0.44 -2.52 116.42 121.90 3b78 h ASP 37 Ca 0.12 -0.26 0.05 0.00 0.02 0.00 0.00 57.03 56.96 3b78 h ASP 37 Cb 0.55 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.77 3b78 h ASP 37 CO 0.03 1.06 0.54 0.28 -1.72 0.00 0.00 179.24 179.43 3b78 h SER 38 N 1.04 0.84 -0.20 6.45 0.02 -1.23 -1.19 113.55 119.27 3b78 h SER 38 Ca 0.20 -0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.05 3b78 h SER 38 Cb 0.44 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 3b78 h SER 38 CO 0.01 0.56 -0.26 -0.07 -1.14 0.00 0.00 176.83 175.93 3b78 h LEU 39 N 0.97 0.58 -0.65 5.07 3.38 -1.25 -2.89 115.31 120.52 3b78 h LEU 39 Ca 0.34 -0.50 -0.14 0.00 0.09 0.00 0.00 57.88 57.67 3b78 h LEU 39 Cb 0.12 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 3b78 h LEU 39 CO -0.11 0.97 -0.65 -0.37 0.09 0.00 0.00 178.44 178.37 3b78 h VAL 40 N 0.21 1.42 0.00 1.22 -1.51 -1.22 0.41 116.25 116.77 3b78 h VAL 40 Ca 0.03 -2.26 0.00 0.00 -1.23 0.00 0.00 66.70 63.23 3b78 h VAL 40 Cb 0.83 2.24 0.00 0.00 -2.13 0.00 0.00 31.29 32.22 3b78 h VAL 40 CO 0.06 0.64 0.00 1.67 -1.23 0.00 0.00 177.57 178.71 3b78 n GLN 41 N -3.70 0.19 -0.11 5.19 7.27 -0.47 -1.27 117.38 124.49 3b78 n GLN 41 Ca -0.01 0.20 -0.22 0.00 0.07 0.00 0.00 57.00 57.05 3b78 n GLN 41 Cb 0.66 -1.75 -0.07 0.00 2.41 0.00 0.00 30.24 31.49 3b78 n GLN 41 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 3b78 n ARG 42 N -2.09 0.48 0.00 3.69 3.00 -1.09 -4.78 116.66 115.87 3b78 n ARG 42 Ca 0.05 0.21 0.00 0.00 -0.00 0.00 0.00 57.85 58.11 3b78 n ARG 42 Cb 0.38 -1.31 0.00 0.00 0.00 0.00 0.00 32.46 31.53 3b78 n ARG 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3b78 n ALA 43 N -4.07 2.05 -1.70 5.13 0.00 0.11 -4.80 120.51 117.24 3b78 n ALA 43 Ca -0.40 -0.94 -0.44 0.00 0.00 0.00 0.00 53.44 51.66 3b78 n ALA 43 Cb 0.76 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.18 3b78 n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b78 n GLY 44 N -0.44 1.25 3.54 0.00 0.00 -0.40 -0.66 105.19 108.48 3b78 n GLY 44 Ca 0.00 0.58 -0.42 0.00 0.00 0.00 0.00 46.02 46.18 3b78 n GLY 44 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3b78 s ILE 45 N 0.65 5.02 0.35 -0.61 1.01 -0.21 -1.28 121.20 126.12 3b78 s ILE 45 Ca 0.73 0.21 0.03 0.00 0.00 0.00 0.00 60.65 61.62 3b78 s ILE 45 Cb -0.58 -3.98 -0.02 0.00 0.01 0.00 0.00 42.46 37.89 3b78 s ILE 45 CO 0.40 -0.27 0.51 -0.63 0.00 0.00 0.00 174.94 174.96 3b78 s ILE 46 N 2.37 4.54 -0.19 2.92 1.01 0.35 -4.83 121.20 127.37 3b78 s ILE 46 Ca 0.18 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 60.08 3b78 s ILE 46 Cb -0.16 -3.62 0.02 0.00 0.01 0.00 0.00 42.46 38.71 3b78 s ILE 46 CO 0.14 -0.33 -0.17 -0.94 0.00 0.00 0.00 174.94 173.64 3b78 s SER 47 N -4.11 3.42 -1.16 3.58 1.04 -1.26 -0.21 113.70 114.99 3b78 s SER 47 Ca 0.42 -0.69 -0.20 0.00 0.48 0.00 0.00 55.95 55.96 3b78 s SER 47 Cb -0.10 -1.52 -0.04 0.00 0.10 0.00 0.00 66.02 64.46 3b78 s SER 47 CO 0.33 -0.02 1.92 0.00 0.98 0.00 0.00 173.24 176.45 3b78 n ALA 48 N 4.63 3.18 0.00 5.32 0.00 -0.78 -4.87 120.51 127.99 3b78 n ALA 48 Ca -0.20 -3.44 0.00 0.00 0.00 0.00 0.00 53.44 49.80 3b78 n ALA 48 Cb 0.49 -3.56 0.00 0.00 0.00 0.00 0.00 19.45 16.38 3b78 n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b78 n GLY 67 N 5.15 1.36 3.62 0.00 0.00 -1.26 -4.76 105.19 109.30 3b78 n GLY 67 Ca 0.48 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 3b78 n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3b78 s ILE 68 N 0.00 4.90 0.32 -0.61 1.01 -1.26 -4.99 121.20 120.57 3b78 s ILE 68 Ca 0.00 1.16 0.07 0.00 0.00 0.00 0.00 60.65 61.89 3b78 s ILE 68 Cb 0.00 -4.03 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 3b78 s ILE 68 CO 0.00 -0.10 0.26 0.42 0.00 0.00 0.00 174.94 175.52 3b78 s THR 69 N 2.70 3.63 0.26 2.92 -4.23 -1.26 -3.95 115.64 115.71 3b78 s THR 69 Ca 0.29 -1.41 0.02 0.00 -1.18 0.00 0.00 61.69 59.41 3b78 s THR 69 Cb -0.15 -3.20 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 3b78 s THR 69 CO 0.10 -0.20 0.18 0.27 -0.54 0.00 0.00 174.62 174.43 3b78 s ILE 70 N -2.29 0.04 -0.26 2.99 -4.36 0.22 -1.05 121.20 116.50 3b78 s ILE 70 Ca 0.39 -2.00 -0.26 0.00 -0.26 0.00 0.00 60.65 58.53 3b78 s ILE 70 Cb -0.06 -2.50 0.00 0.00 1.25 0.00 0.00 42.46 41.15 3b78 s ILE 70 CO 0.26 0.00 0.89 -0.75 0.24 0.00 0.00 174.94 175.58 3b78 s LYS 71 N -3.88 4.15 -0.30 0.37 2.20 -1.03 -4.53 119.74 116.73 3b78 s LYS 71 Ca 0.39 0.98 -0.39 0.00 -0.36 0.00 0.00 55.97 56.59 3b78 s LYS 71 Cb 0.05 -3.67 -0.15 0.00 -1.51 0.00 0.00 37.83 32.56 3b78 s LYS 71 CO 0.18 -0.60 1.85 0.45 -0.36 0.00 0.00 175.35 176.87 3b78 n SER 72 N 6.18 2.28 0.00 1.43 2.88 -1.24 -4.79 113.62 120.36 3b78 n SER 72 Ca 0.07 0.94 0.00 0.00 -1.33 0.00 0.00 58.87 58.55 3b78 n SER 72 Cb 0.47 -1.15 0.00 0.00 -0.75 0.00 0.00 64.21 62.78 3b78 n SER 72 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 3b78 n THR 73 N 5.17 0.00 -3.71 2.46 -1.04 -1.26 -4.96 114.28 110.95 3b78 n THR 73 Ca 0.31 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 62.18 3b78 n THR 73 Cb 0.14 -0.40 -0.08 0.00 -1.82 0.00 0.00 70.33 68.17 3b78 n THR 73 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3b78 s ALA 74 N -1.83 -0.97 -0.03 2.41 0.00 -1.26 -1.57 121.76 118.51 3b78 s ALA 74 Ca 0.00 0.48 0.05 0.00 0.00 0.00 0.00 51.96 52.49 3b78 s ALA 74 Cb 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.22 3b78 s ALA 74 CO 0.00 -0.31 -0.18 0.42 0.00 0.00 0.00 175.76 175.69 3b78 s ILE 75 N -1.50 1.44 -0.17 0.00 1.01 -0.49 -1.19 121.20 120.30 3b78 s ILE 75 Ca -0.12 -0.75 -0.13 0.00 0.00 0.00 0.00 60.65 59.65 3b78 s ILE 75 Cb -0.04 -1.22 -0.05 0.00 0.01 0.00 0.00 42.46 41.17 3b78 s ILE 75 CO 0.04 0.41 0.24 -0.44 0.00 0.00 0.00 174.94 175.19 3b78 s SER 76 N -0.22 6.36 0.03 3.58 0.01 -1.26 -0.37 113.70 121.83 3b78 s SER 76 Ca 0.02 0.42 0.08 0.00 1.31 0.00 0.00 55.95 57.78 3b78 s SER 76 Cb -0.09 -2.15 -0.02 0.00 0.21 0.00 0.00 66.02 63.96 3b78 s SER 76 CO 0.01 0.13 -0.23 -0.76 0.41 0.00 0.00 173.24 172.79 3b78 s LEU 77 N 0.42 2.14 -0.12 2.44 1.02 0.13 -1.04 118.68 123.66 3b78 s LEU 77 Ca 0.14 -0.52 0.03 0.00 0.02 0.00 0.00 54.13 53.80 3b78 s LEU 77 Cb -0.12 -1.14 0.01 0.00 0.02 0.00 0.00 46.19 44.95 3b78 s LEU 77 CO 0.02 0.23 -0.22 -0.47 0.02 0.00 0.00 176.35 175.93 3b78 s TYR 78 N -0.73 2.56 -0.00 0.29 5.04 0.16 0.05 117.35 124.71 3b78 s TYR 78 Ca 0.09 -1.19 0.04 0.00 -2.44 0.00 0.00 57.07 53.58 3b78 s TYR 78 Cb -0.09 -1.73 -0.01 0.00 0.35 0.00 0.00 41.96 40.47 3b78 s TYR 78 CO 0.01 -0.52 -0.14 0.45 -1.34 0.00 0.00 175.55 174.01 3b78 s SER 79 N 0.63 1.65 -0.03 4.32 0.15 -0.71 -4.66 113.70 115.05 3b78 s SER 79 Ca -0.12 -0.29 0.06 0.00 0.70 0.00 0.00 55.95 56.30 3b78 s SER 79 Cb -0.16 -0.17 -0.01 0.00 -1.71 0.00 0.00 66.02 63.96 3b78 s SER 79 CO 0.03 0.15 -0.20 -0.70 1.20 0.00 0.00 173.24 173.72 3b78 s GLU 80 N -0.46 1.74 0.31 5.44 2.12 -1.26 -1.11 118.70 125.48 3b78 s GLU 80 Ca 0.05 -0.71 0.05 0.00 0.36 0.00 0.00 54.97 54.72 3b78 s GLU 80 Cb -0.06 -1.61 -0.02 0.00 0.26 0.00 0.00 34.13 32.70 3b78 s GLU 80 CO -0.00 0.38 0.17 -1.33 -0.54 0.00 0.00 175.26 173.94 3b78 n MET 81 N 2.75 0.51 -2.86 4.30 2.81 -1.02 -5.05 117.12 118.56 3b78 n MET 81 Ca -0.16 -2.83 -0.23 0.00 -1.81 0.00 0.00 57.70 52.67 3b78 n MET 81 Cb 0.53 1.85 0.02 0.00 -0.71 0.00 0.00 33.22 34.91 3b78 n MET 81 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 3b78 s SER 82 N -3.03 5.71 0.40 7.83 0.01 -1.26 -4.78 113.70 118.58 3b78 s SER 82 Ca 0.24 0.28 0.08 0.00 1.31 0.00 0.00 55.95 57.86 3b78 s SER 82 Cb 0.01 -1.44 0.82 0.00 0.21 0.00 0.00 66.02 65.62 3b78 s SER 82 CO 0.17 -0.81 1.98 0.44 0.41 0.00 0.00 173.24 175.42 3b78 h ASP 83 N 0.28 0.33 1.16 2.44 3.32 -1.99 -0.80 116.42 121.16 3b78 h ASP 83 Ca -0.45 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.56 3b78 h ASP 83 Cb 1.26 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.72 3b78 h ASP 83 CO 0.57 0.37 -0.63 -0.33 -1.72 0.00 0.00 179.24 177.50 3b78 h GLU 84 N 0.36 0.00 0.03 3.56 5.08 -1.99 -2.94 114.58 118.68 3b78 h GLU 84 Ca 0.09 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.22 3b78 h GLU 84 Cb 0.19 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.46 3b78 h GLU 84 CO 0.00 0.00 -0.89 -0.44 -1.00 0.00 0.00 179.01 176.68 3b78 h ASP 85 N 0.00 0.74 0.35 1.42 3.32 -1.78 -3.27 116.42 117.20 3b78 h ASP 85 Ca 0.00 -0.77 -0.06 0.00 0.02 0.00 0.00 57.03 56.22 3b78 h ASP 85 Cb 0.89 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 3b78 h ASP 85 CO 0.00 1.42 -0.27 0.58 -1.72 0.00 0.00 179.24 179.25 3b78 h VAL 86 N 0.14 1.07 0.00 -1.35 2.07 -1.21 -2.53 116.25 114.43 3b78 h VAL 86 Ca -0.12 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.43 3b78 h VAL 86 Cb 1.58 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.89 3b78 h VAL 86 CO 0.17 0.27 -0.00 0.11 0.02 0.00 0.00 177.57 178.14 3b78 h LYS 87 N 0.00 0.00 -0.00 1.57 1.57 -1.56 -2.06 116.57 116.08 3b78 h LYS 87 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3b78 h LYS 87 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3b78 h LYS 87 CO 0.04 0.00 -0.15 0.39 -0.57 0.00 0.00 179.45 179.16 3b78 n GLU 88 N -3.09 0.19 -2.62 3.15 1.02 -0.95 -4.79 120.64 113.55 3b78 n GLU 88 Ca -0.01 -0.05 -0.43 0.00 -0.02 0.00 0.00 57.16 56.65 3b78 n GLU 88 Cb 0.22 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.12 3b78 n GLU 88 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3b78 s ILE 89 N -2.84 4.60 -0.13 -3.67 1.01 -0.78 -4.92 121.20 114.47 3b78 s ILE 89 Ca 0.18 1.92 0.01 0.00 0.00 0.00 0.00 60.65 62.76 3b78 s ILE 89 Cb 0.19 -4.28 0.17 0.00 0.01 0.00 0.00 42.46 38.55 3b78 s ILE 89 CO 0.55 -0.21 1.42 0.29 0.00 0.00 0.00 174.94 177.00 3b78 n LYS 90 N 6.43 1.36 -3.94 2.79 5.02 -1.26 -4.78 118.16 123.78 3b78 n LYS 90 Ca 0.12 -0.83 -0.09 0.00 -2.02 0.00 0.00 58.31 55.49 3b78 n LYS 90 Cb 0.46 -1.32 -0.09 0.00 -0.02 0.00 0.00 35.03 34.05 3b78 n LYS 90 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 3b78 s GLN 91 N -0.92 0.58 0.19 1.97 -2.07 -1.26 -5.12 119.66 113.02 3b78 s GLN 91 Ca 0.16 -0.78 -0.33 0.00 -1.82 0.00 0.00 55.36 52.59 3b78 s GLN 91 Cb 0.13 0.22 -0.15 0.00 -1.09 0.00 0.00 33.01 32.13 3b78 s GLN 91 CO 0.02 -0.14 1.36 1.17 -1.32 0.00 0.00 175.29 176.38 3b78 n LYS 92 N 0.76 1.69 -4.17 9.60 3.00 -1.26 -4.98 118.16 122.79 3b78 n LYS 92 Ca -0.19 0.60 -0.12 0.00 -0.00 0.00 0.00 58.31 58.60 3b78 n LYS 92 Cb 0.58 -2.23 -0.10 0.00 0.00 0.00 0.00 35.03 33.28 3b78 n LYS 92 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 3b78 s THR 93 N 0.13 0.79 -0.38 3.15 2.01 -1.26 -4.77 115.64 115.31 3b78 s THR 93 Ca 0.73 -1.83 0.03 0.00 0.31 0.00 0.00 61.69 60.93 3b78 s THR 93 Cb -0.75 -1.56 0.16 0.00 0.01 0.00 0.00 72.50 70.36 3b78 s THR 93 CO 0.48 -0.76 0.37 -0.62 -0.69 0.00 0.00 174.62 173.40 3b78 s ASP 94 N -2.83 1.33 0.00 3.53 2.15 -1.26 -5.06 116.67 114.52 3b78 s ASP 94 Ca 0.10 -1.81 0.00 0.00 0.43 0.00 0.00 52.55 51.26 3b78 s ASP 94 Cb 0.02 0.40 0.00 0.00 -0.30 0.00 0.00 42.92 43.04 3b78 s ASP 94 CO -0.03 -0.25 0.00 0.61 -0.17 0.00 0.00 175.17 175.34 3b78 n GLY 95 N 4.03 -3.63 0.00 2.66 0.00 -1.26 -4.77 105.19 102.22 3b78 n GLY 95 Ca 0.13 -2.13 0.09 0.00 0.00 0.00 0.00 46.02 44.11 3b78 n GLY 95 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3b78 n ASN 96 N 0.00 0.81 -4.79 1.61 3.02 -1.26 -4.96 115.26 109.68 3b78 n ASN 96 Ca 0.00 -0.73 -0.37 0.00 -0.03 0.00 0.00 54.58 53.45 3b78 n ASN 96 Cb 0.00 1.20 -0.06 0.00 -0.61 0.00 0.00 39.78 40.31 3b78 n ASN 96 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3b78 s SER 97 N -3.13 7.24 -0.02 6.41 0.01 -1.26 -2.44 113.70 120.51 3b78 s SER 97 Ca 0.04 1.71 -0.00 0.00 1.31 0.00 0.00 55.95 59.01 3b78 s SER 97 Cb 0.14 -2.53 0.03 0.00 0.21 0.00 0.00 66.02 63.87 3b78 s SER 97 CO 0.79 -0.05 0.03 -0.36 0.41 0.00 0.00 173.24 174.05 3b78 s PHE 98 N -1.62 0.05 -0.24 2.43 0.40 -0.26 -4.83 117.98 113.91 3b78 s PHE 98 Ca 0.49 0.13 -0.09 0.00 -0.60 0.00 0.00 56.93 56.85 3b78 s PHE 98 Cb -0.18 -0.27 -0.04 0.00 0.51 0.00 0.00 43.02 43.04 3b78 s PHE 98 CO 0.22 -0.10 0.13 -1.17 0.70 0.00 0.00 175.22 175.01 3b78 s LEU 99 N 1.14 3.87 -0.18 -0.37 2.96 -0.23 -1.74 118.68 124.13 3b78 s LEU 99 Ca -0.08 -0.01 -0.01 0.00 -0.22 0.00 0.00 54.13 53.81 3b78 s LEU 99 Cb -0.13 -2.04 -0.00 0.00 0.50 0.00 0.00 46.19 44.52 3b78 s LEU 99 CO -0.03 0.03 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.28 3b78 s ILE 100 N 1.28 2.86 -0.44 6.68 1.01 0.11 -0.51 121.20 132.18 3b78 s ILE 100 Ca 0.06 -0.69 -0.16 0.00 0.00 0.00 0.00 60.65 59.86 3b78 s ILE 100 Cb -0.14 -2.24 0.04 0.00 0.01 0.00 0.00 42.46 40.12 3b78 s ILE 100 CO 0.05 0.49 0.41 0.20 0.00 0.00 0.00 174.94 176.09 3b78 s ASN 101 N 1.11 6.16 -0.63 3.58 0.01 0.37 0.18 114.94 125.72 3b78 s ASN 101 Ca 0.00 -0.95 -0.21 0.00 -0.71 0.00 0.00 52.86 51.00 3b78 s ASN 101 Cb -0.14 -2.20 0.09 0.00 0.41 0.00 0.00 41.25 39.40 3b78 s ASN 101 CO -0.03 -0.60 0.84 -0.22 -1.51 0.00 0.00 177.10 175.57 3b78 s LEU 102 N 1.93 4.88 -0.11 0.60 2.96 0.50 -2.09 118.68 127.34 3b78 s LEU 102 Ca 0.08 -1.21 -0.30 0.00 -0.22 0.00 0.00 54.13 52.49 3b78 s LEU 102 Cb -0.20 -2.36 -0.01 0.00 0.50 0.00 0.00 46.19 44.12 3b78 s LEU 102 CO 0.10 -1.28 1.04 -0.63 -1.32 0.00 0.00 176.35 174.26 3b78 s ILE 103 N 3.39 4.70 0.56 6.68 -1.09 -0.47 -1.39 121.20 133.58 3b78 s ILE 103 Ca 0.17 1.98 -0.20 0.00 -2.23 0.00 0.00 60.65 60.37 3b78 s ILE 103 Cb -0.20 -4.28 -0.04 0.00 -1.58 0.00 0.00 42.46 36.36 3b78 s ILE 103 CO 0.08 -0.02 1.26 -0.62 -1.23 0.00 0.00 174.94 174.42 3b78 s ASP 104 N 1.16 5.32 0.09 3.58 2.15 -0.61 -4.36 116.67 123.99 3b78 s ASP 104 Ca 0.49 2.54 0.02 0.00 0.43 0.00 0.00 52.55 56.03 3b78 s ASP 104 Cb -0.19 -2.62 -0.04 0.00 -0.30 0.00 0.00 42.92 39.78 3b78 s ASP 104 CO 0.17 -1.52 -0.07 -0.94 -0.17 0.00 0.00 175.17 172.64 3b78 s SER 105 N -1.30 1.11 0.98 -0.34 1.04 -1.26 -4.84 113.70 109.09 3b78 s SER 105 Ca 0.74 -0.88 -0.12 0.00 0.48 0.00 0.00 55.95 56.17 3b78 s SER 105 Cb -0.35 0.07 0.14 0.00 0.10 0.00 0.00 66.02 65.99 3b78 s SER 105 CO 0.39 -0.38 0.86 -2.65 0.98 0.00 0.00 173.24 172.44 3b78 n PRO 106 N 0.37 -0.81 0.02 4.02 -0.02 -1.26 -4.96 135.00 132.35 3b78 n PRO 106 Ca -0.15 -0.18 -0.01 0.00 -2.02 0.00 0.00 63.50 61.13 3b78 n PRO 106 Cb 0.59 -2.17 -0.09 0.00 -0.02 0.00 0.00 33.50 31.81 3b78 n PRO 106 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3b78 n GLY 107 N 0.81 -1.16 3.12 -1.23 0.00 -1.26 -4.91 105.19 100.56 3b78 n GLY 107 Ca 0.09 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 3b78 n GLY 107 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3b78 s HIS 108 N -2.87 1.18 0.11 1.61 5.65 -1.26 -4.43 115.29 115.28 3b78 s HIS 108 Ca -0.03 -0.31 0.32 0.00 0.25 0.00 0.00 55.06 55.29 3b78 s HIS 108 Cb 0.09 -0.72 1.62 0.00 -1.18 0.00 0.00 32.58 32.38 3b78 s HIS 108 CO 0.81 0.02 1.97 -0.24 -0.65 0.00 0.00 174.74 176.65 3b78 h VAL 109 N 4.60 0.00 -0.42 0.89 3.04 -1.97 -2.05 116.25 120.34 3b78 h VAL 109 Ca -0.37 -0.13 0.12 0.00 -1.01 0.00 0.00 66.70 65.32 3b78 h VAL 109 Cb 1.18 0.92 -0.02 0.00 -2.01 0.00 0.00 31.29 31.36 3b78 h VAL 109 CO 0.45 0.00 0.30 0.44 -1.01 0.00 0.00 177.57 177.75 3b78 h ASP 110 N 0.00 0.01 -0.51 3.17 3.32 -1.97 -2.53 116.42 117.92 3b78 h ASP 110 Ca 0.00 0.00 -0.71 0.00 0.02 0.00 0.00 57.03 56.35 3b78 h ASP 110 Cb 0.15 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 3b78 h ASP 110 CO 0.00 0.01 3.16 0.49 -1.72 0.00 0.00 179.24 181.17 3b78 n PHE 111 N -4.42 2.62 -0.16 4.55 3.01 -0.77 -4.73 117.46 117.56 3b78 n PHE 111 Ca 0.07 -2.97 -0.05 0.00 1.01 0.00 0.00 57.45 55.51 3b78 n PHE 111 Cb 0.49 -2.23 0.13 0.00 -0.01 0.00 0.00 39.48 37.86 3b78 n PHE 111 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3b78 h SER 112 N 5.01 0.87 -0.60 4.37 0.02 -1.71 -2.44 113.55 119.07 3b78 h SER 112 Ca 0.75 -0.19 -0.06 0.00 -0.84 0.00 0.00 61.79 61.46 3b78 h SER 112 Cb 0.35 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 3b78 h SER 112 CO 1.68 0.88 0.17 0.28 -1.14 0.00 0.00 176.83 178.70 3b78 h SER 113 N 0.87 0.92 0.59 3.07 0.02 -1.86 -2.39 113.55 114.77 3b78 h SER 113 Ca 0.18 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3b78 h SER 113 Cb 0.38 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.68 3b78 h SER 113 CO 0.01 0.88 -0.46 -1.84 -1.14 0.00 0.00 176.83 174.28 3b78 n GLU 114 N -4.26 0.03 -0.08 3.45 0.28 -1.16 -2.76 120.64 116.14 3b78 n GLU 114 Ca 0.05 0.01 -0.14 0.00 -0.16 0.00 0.00 57.16 56.91 3b78 n GLU 114 Cb 0.23 -1.52 -0.05 0.00 1.43 0.00 0.00 31.44 31.54 3b78 n GLU 114 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 3b78 h VAL 115 N 0.00 1.29 -0.50 3.84 2.07 -1.01 -2.91 116.25 119.04 3b78 h VAL 115 Ca 0.00 -1.63 -0.12 0.00 0.82 0.00 0.00 66.70 65.77 3b78 h VAL 115 Cb 0.52 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 3b78 h VAL 115 CO 0.00 0.52 -0.15 0.74 0.02 0.00 0.00 177.57 178.70 3b78 h THR 116 N 0.54 1.27 -0.69 2.57 2.02 -1.44 -2.63 112.91 114.56 3b78 h THR 116 Ca 0.02 -1.31 0.04 0.00 0.77 0.00 0.00 66.41 65.93 3b78 h THR 116 Cb 1.03 1.06 -0.05 0.00 -1.74 0.00 0.00 68.15 68.46 3b78 h THR 116 CO 0.10 0.46 0.42 0.00 0.37 0.00 0.00 175.52 176.87 3b78 h ALA 117 N 0.89 0.90 -0.29 6.16 0.00 -1.55 -0.42 119.26 124.95 3b78 h ALA 117 Ca 0.12 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3b78 h ALA 117 Cb 0.73 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3b78 h ALA 117 CO 0.06 0.17 0.01 0.00 0.00 0.00 0.00 179.25 179.48 3b78 h ALA 118 N 1.31 0.39 0.00 0.00 0.00 -1.43 -3.09 119.26 116.43 3b78 h ALA 118 Ca 0.28 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3b78 h ALA 118 Cb 0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3b78 h ALA 118 CO -0.12 0.12 -0.38 -0.07 0.00 0.00 0.00 179.25 178.80 3b78 h LEU 119 N 0.30 0.00 -0.97 0.00 3.38 -1.18 -3.07 115.31 113.76 3b78 h LEU 119 Ca 0.08 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 3b78 h LEU 119 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3b78 h LEU 119 CO 0.01 0.38 -0.48 -0.09 0.09 0.00 0.00 178.44 178.35 3b78 h ARG 120 N 0.00 0.00 -0.65 1.13 2.43 -1.00 -2.61 114.38 113.69 3b78 h ARG 120 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3b78 h ARG 120 Cb 0.67 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 3b78 h ARG 120 CO 0.05 0.48 0.00 1.33 -1.51 0.00 0.00 179.97 180.31 3b78 n VAL 121 N -3.79 0.90 -4.33 0.20 0.24 -1.16 -4.93 118.33 105.45 3b78 n VAL 121 Ca -0.01 -0.87 -0.24 0.00 -2.04 0.00 0.00 64.34 61.18 3b78 n VAL 121 Cb 0.52 0.41 -0.08 0.00 -1.47 0.00 0.00 33.84 33.23 3b78 n VAL 121 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3b78 s THR 122 N -1.17 3.03 0.00 3.34 -4.23 -0.98 -4.84 115.64 110.79 3b78 s THR 122 Ca 0.43 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.92 3b78 s THR 122 Cb 0.23 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 71.34 3b78 s THR 122 CO 0.29 -0.33 0.00 0.47 -0.54 0.00 0.00 174.62 174.51 3b78 n ASP 123 N -0.87 4.88 -4.43 3.99 10.43 0.65 -4.93 116.55 126.27 3b78 n ASP 123 Ca -0.05 0.00 -0.21 0.00 2.57 0.00 0.00 54.79 57.10 3b78 n ASP 123 Cb 0.60 0.77 -0.11 0.00 1.84 0.00 0.00 41.12 44.22 3b78 n ASP 123 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 3b78 s GLY 124 N -2.38 2.01 -0.14 0.44 0.00 -0.62 -2.54 107.32 104.09 3b78 s GLY 124 Ca 0.00 -2.02 -0.08 0.00 0.00 0.00 0.00 44.72 42.61 3b78 s GLY 124 CO 0.00 -1.79 0.35 0.00 0.00 0.00 0.00 173.10 171.66 3b78 s ALA 125 N -3.33 -0.86 -0.51 3.20 0.00 -0.18 -2.61 121.76 117.48 3b78 s ALA 125 Ca 0.36 1.26 -0.18 0.00 0.00 0.00 0.00 51.96 53.40 3b78 s ALA 125 Cb 0.08 -0.77 0.07 0.00 0.00 0.00 0.00 23.12 22.50 3b78 s ALA 125 CO 0.15 -0.23 0.58 -1.17 0.00 0.00 0.00 175.76 175.10 3b78 s LEU 126 N 1.14 5.18 -0.27 0.00 2.96 -0.18 -0.84 118.68 126.67 3b78 s LEU 126 Ca -0.08 -1.08 -0.18 0.00 -0.22 0.00 0.00 54.13 52.57 3b78 s LEU 126 Cb -0.08 -2.37 -0.02 0.00 0.50 0.00 0.00 46.19 44.22 3b78 s LEU 126 CO -0.09 -0.86 0.52 -0.69 -1.32 0.00 0.00 176.35 173.90 3b78 s VAL 127 N 2.40 5.06 -0.18 1.68 1.01 0.73 -1.24 120.40 129.86 3b78 s VAL 127 Ca 0.12 0.81 -0.11 0.00 0.00 0.00 0.00 61.98 62.80 3b78 s VAL 127 Cb -0.21 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 3b78 s VAL 127 CO 0.10 0.04 0.18 -0.69 0.00 0.00 0.00 175.10 174.73 3b78 s VAL 128 N 2.33 5.38 0.14 2.92 1.01 -0.07 -1.11 120.40 131.00 3b78 s VAL 128 Ca 0.21 0.30 0.05 0.00 0.00 0.00 0.00 61.98 62.55 3b78 s VAL 128 Cb -0.16 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 3b78 s VAL 128 CO 0.10 0.43 -0.12 0.68 0.00 0.00 0.00 175.10 176.19 3b78 s VAL 129 N 0.34 1.30 0.19 2.92 -7.23 -0.74 -4.63 120.40 112.56 3b78 s VAL 129 Ca 0.11 -1.91 -0.16 0.00 -1.81 0.00 0.00 61.98 58.21 3b78 s VAL 129 Cb -0.12 -1.71 -0.08 0.00 0.56 0.00 0.00 36.38 35.04 3b78 s VAL 129 CO 0.00 -0.58 0.62 -0.62 -0.31 0.00 0.00 175.10 174.22 3b78 s ASP 130 N -2.85 6.88 0.06 4.85 2.15 -0.74 0.32 116.67 127.34 3b78 s ASP 130 Ca 0.14 1.20 -0.29 0.00 0.43 0.00 0.00 52.55 54.02 3b78 s ASP 130 Cb -0.01 -2.34 -0.18 0.00 -0.30 0.00 0.00 42.92 40.10 3b78 s ASP 130 CO 0.02 0.04 1.57 0.74 -0.17 0.00 0.00 175.17 177.37 3b78 h THR 131 N 2.65 0.54 0.05 1.71 2.02 -1.57 -0.97 112.91 117.35 3b78 h THR 131 Ca -0.48 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 66.58 3b78 h THR 131 Cb 1.19 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 3b78 h THR 131 CO 0.66 0.02 -0.03 0.40 0.37 0.00 0.00 175.52 176.94 3b78 h ILE 132 N -0.69 0.80 0.00 3.11 2.04 -1.86 -3.35 117.51 117.56 3b78 h ILE 132 Ca -0.06 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.33 3b78 h ILE 132 Cb 0.51 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.06 3b78 h ILE 132 CO 0.10 0.26 0.00 -0.62 0.00 0.00 0.00 178.15 177.89 3b78 n GLU 133 N -4.77 0.36 0.00 2.37 1.02 -1.26 -4.98 120.64 113.38 3b78 n GLU 133 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 3b78 n GLU 133 Cb 0.23 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 3b78 n GLU 133 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3b78 n GLY 134 N 1.28 3.14 3.55 0.62 0.00 -0.37 -4.47 105.19 108.94 3b78 n GLY 134 Ca 0.13 -0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 3b78 n GLY 134 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b78 s VAL 135 N 0.00 5.18 0.81 1.61 1.01 -1.26 -1.80 120.40 125.96 3b78 s VAL 135 Ca 0.00 0.10 -0.12 0.00 0.00 0.00 0.00 61.98 61.96 3b78 s VAL 135 Cb 0.00 -3.78 0.08 0.00 0.00 0.00 0.00 36.38 32.67 3b78 s VAL 135 CO 0.00 -0.04 1.15 0.00 0.00 0.00 0.00 175.10 176.21 3b78 h VAL 137 N -1.08 1.26 0.58 0.00 2.07 -1.94 -2.15 116.25 114.98 3b78 h VAL 137 Ca -0.47 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.20 3b78 h VAL 137 Cb 1.31 0.40 0.01 0.00 -1.52 0.00 0.00 31.29 31.48 3b78 h VAL 137 CO 0.64 0.33 -0.28 -0.61 0.02 0.00 0.00 177.57 177.67 3b78 h GLN 138 N 1.08 -0.74 -0.94 1.57 4.15 -1.94 -1.60 115.11 116.68 3b78 h GLN 138 Ca 0.25 0.05 0.12 0.00 0.77 0.00 0.00 58.65 59.84 3b78 h GLN 138 Cb 0.24 0.17 -0.08 0.00 0.21 0.00 0.00 27.48 28.02 3b78 h GLN 138 CO -0.02 -0.46 0.60 1.15 -1.93 0.00 0.00 178.83 178.17 3b78 h THR 139 N -0.87 0.90 -0.60 2.39 2.02 -1.94 -0.53 112.91 114.28 3b78 h THR 139 Ca -0.08 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 66.76 3b78 h THR 139 Cb 0.63 -0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 3b78 h THR 139 CO 0.13 0.16 0.21 -0.08 0.37 0.00 0.00 175.52 176.31 3b78 h GLU 140 N 0.87 0.91 -0.37 6.66 4.81 -1.23 -0.03 114.58 126.20 3b78 h GLU 140 Ca 0.46 -0.18 -0.07 0.00 -0.13 0.00 0.00 59.36 59.44 3b78 h GLU 140 Cb 0.55 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 3b78 h GLU 140 CO -0.23 0.80 -0.04 1.15 -0.73 0.00 0.00 179.01 179.96 3b78 h THR 141 N 0.84 1.27 -0.32 0.32 2.02 -0.16 -1.93 112.91 114.95 3b78 h THR 141 Ca 0.20 -1.07 -0.08 0.00 0.77 0.00 0.00 66.41 66.22 3b78 h THR 141 Cb 0.25 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 3b78 h THR 141 CO -0.01 0.36 -0.13 0.58 0.37 0.00 0.00 175.52 176.69 3b78 h VAL 142 N 0.49 1.29 -0.79 3.16 2.07 -1.04 -2.44 116.25 118.99 3b78 h VAL 142 Ca 0.10 -1.21 0.06 0.00 0.82 0.00 0.00 66.70 66.47 3b78 h VAL 142 Cb 0.53 1.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.65 3b78 h VAL 142 CO 0.03 0.39 0.52 0.25 0.02 0.00 0.00 177.57 178.77 3b78 h LEU 143 N 0.41 0.77 -0.93 2.57 5.85 -0.99 0.37 115.31 123.37 3b78 h LEU 143 Ca 0.07 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 3b78 h LEU 143 Cb 0.64 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 3b78 h LEU 143 CO 0.04 0.50 0.53 -0.09 -0.34 0.00 0.00 178.44 179.09 3b78 h ARG 144 N 0.88 1.28 -0.29 1.25 2.43 -1.02 -1.06 114.38 117.85 3b78 h ARG 144 Ca 0.33 -0.13 -0.18 0.00 -0.81 0.00 0.00 59.98 59.19 3b78 h ARG 144 Cb 0.19 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 3b78 h ARG 144 CO -0.11 0.91 -0.53 1.96 -1.51 0.00 0.00 179.97 180.69 3b78 h GLN 145 N 1.29 0.88 -0.81 0.20 1.08 -0.73 -2.50 115.11 114.51 3b78 h GLN 145 Ca 0.33 -0.55 0.01 0.00 -1.45 0.00 0.00 58.65 56.99 3b78 h GLN 145 Cb -0.01 0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.44 3b78 h GLN 145 CO -0.06 1.19 0.53 0.00 -0.95 0.00 0.00 178.83 179.55 3b78 h ALA 146 N 0.68 1.03 -0.07 3.87 0.00 -0.64 -1.51 119.26 122.63 3b78 h ALA 146 Ca 0.02 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3b78 h ALA 146 Cb 1.14 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3b78 h ALA 146 CO 0.12 0.42 -0.32 -0.07 0.00 0.00 0.00 179.25 179.40 3b78 h LEU 147 N 1.08 0.13 -1.53 0.00 3.38 -1.16 -1.61 115.31 115.61 3b78 h LEU 147 Ca 0.30 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 3b78 h LEU 147 Cb -0.10 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3b78 h LEU 147 CO -0.07 0.45 -0.23 1.23 0.09 0.00 0.00 178.44 179.91 3b78 h GLY 148 N 1.05 0.00 -0.55 0.83 0.00 -0.84 -0.59 103.07 102.97 3b78 h GLY 148 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3b78 h GLY 148 CO 0.05 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.77 3b78 n GLU 149 N -3.74 1.56 -3.37 4.80 -0.58 -0.70 -4.92 120.64 113.69 3b78 n GLU 149 Ca -0.01 -0.85 -0.16 0.00 -0.42 0.00 0.00 57.16 55.71 3b78 n GLU 149 Cb 0.33 -1.35 0.09 0.00 -0.57 0.00 0.00 31.44 29.94 3b78 n GLU 149 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3b78 n ARG 150 N 0.09 -5.97 -4.13 3.49 1.74 -0.23 -4.98 116.66 106.66 3b78 n ARG 150 Ca 0.15 0.83 -0.34 0.00 -0.77 0.00 0.00 57.85 57.71 3b78 n ARG 150 Cb 0.26 -5.76 -0.10 0.00 -1.02 0.00 0.00 32.46 25.84 3b78 n ARG 150 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3b78 s ILE 151 N -3.35 4.55 0.06 0.55 1.01 -0.69 -4.96 121.20 118.36 3b78 s ILE 151 Ca 0.05 -0.12 -0.27 0.00 0.00 0.00 0.00 60.65 60.31 3b78 s ILE 151 Cb -0.01 -3.03 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 3b78 s ILE 151 CO 0.71 0.48 0.84 -0.75 0.00 0.00 0.00 174.94 176.22 3b78 s LYS 152 N 0.24 4.56 -0.03 2.79 2.20 -1.05 -4.45 119.74 123.99 3b78 s LYS 152 Ca 0.02 1.20 -0.04 0.00 -0.36 0.00 0.00 55.97 56.79 3b78 s LYS 152 Cb -0.13 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.78 3b78 s LYS 152 CO 0.01 0.23 0.18 -1.25 -0.36 0.00 0.00 175.35 174.17 3b78 s PRO 153 N 0.06 3.46 0.01 4.03 0.05 -1.26 -1.01 135.00 140.34 3b78 s PRO 153 Ca 0.42 -0.25 0.06 0.00 0.05 0.00 0.00 61.00 61.28 3b78 s PRO 153 Cb -0.21 -3.11 -0.02 0.00 0.05 0.00 0.00 34.50 31.20 3b78 s PRO 153 CO 0.25 0.69 -0.20 0.14 0.05 0.00 0.00 177.00 177.94 3b78 s VAL 154 N -1.26 1.57 0.00 -0.36 -7.23 -0.02 -4.87 120.40 108.23 3b78 s VAL 154 Ca 0.25 -0.98 0.03 0.00 -1.81 0.00 0.00 61.98 59.46 3b78 s VAL 154 Cb -0.13 -1.33 -0.03 0.00 0.56 0.00 0.00 36.38 35.45 3b78 s VAL 154 CO 0.15 0.33 -0.04 -0.69 -0.31 0.00 0.00 175.10 174.54 3b78 s VAL 155 N -0.60 3.83 -0.08 1.32 1.01 -0.58 -0.19 120.40 125.10 3b78 s VAL 155 Ca 0.07 -0.71 -0.00 0.00 0.00 0.00 0.00 61.98 61.34 3b78 s VAL 155 Cb -0.08 -2.68 0.02 0.00 0.00 0.00 0.00 36.38 33.65 3b78 s VAL 155 CO 0.00 0.39 -0.05 0.54 0.00 0.00 0.00 175.10 175.98 3b78 s VAL 156 N -1.02 0.77 -0.45 2.92 0.11 -0.27 -0.69 120.40 121.76 3b78 s VAL 156 Ca 0.18 -0.17 -0.23 0.00 -2.93 0.00 0.00 61.98 58.83 3b78 s VAL 156 Cb -0.11 -0.81 0.03 0.00 -1.53 0.00 0.00 36.38 33.95 3b78 s VAL 156 CO 0.08 0.31 0.79 -0.63 -3.33 0.00 0.00 175.10 172.32 3b78 s ILE 157 N 1.50 4.64 0.45 7.04 1.01 0.13 -1.79 121.20 134.18 3b78 s ILE 157 Ca -0.01 0.44 0.04 0.00 0.00 0.00 0.00 60.65 61.13 3b78 s ILE 157 Cb -0.13 -4.33 0.01 0.00 0.01 0.00 0.00 42.46 38.02 3b78 s ILE 157 CO -0.04 -0.73 0.64 0.21 0.00 0.00 0.00 174.94 175.02 3b78 s ASN 158 N 2.14 5.63 -1.21 3.58 2.47 0.15 -1.79 114.94 125.91 3b78 s ASN 158 Ca 0.30 -0.09 -0.04 0.00 0.42 0.00 0.00 52.86 53.45 3b78 s ASN 158 Cb -0.12 -1.03 0.00 0.00 -1.45 0.00 0.00 41.25 38.65 3b78 s ASN 158 CO 0.23 -0.81 1.04 0.29 -3.72 0.00 0.00 177.10 174.13 3b78 n LYS 159 N -2.02 -6.92 0.13 0.43 5.02 -0.74 -1.78 118.16 112.28 3b78 n LYS 159 Ca 0.05 0.80 -0.01 0.00 -2.02 0.00 0.00 58.31 57.13 3b78 n LYS 159 Cb 0.59 -5.73 0.22 0.00 -0.02 0.00 0.00 35.03 30.09 3b78 n LYS 159 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3b78 h VAL 160 N -2.17 1.37 -1.00 -0.18 2.07 -1.75 -3.18 116.25 111.40 3b78 h VAL 160 Ca -0.55 -1.77 0.22 0.00 0.82 0.00 0.00 66.70 65.41 3b78 h VAL 160 Cb 1.34 1.92 -0.11 0.00 -1.52 0.00 0.00 31.29 32.92 3b78 h VAL 160 CO 0.50 0.51 0.61 -2.24 0.02 0.00 0.00 177.57 176.98 3b78 h ASP 161 N 0.07 0.69 -0.32 0.57 3.04 -1.90 -0.27 116.42 118.30 3b78 h ASP 161 Ca -0.00 0.11 -0.05 0.00 -3.24 0.00 0.00 57.03 53.85 3b78 h ASP 161 Cb 0.94 -0.01 -0.02 0.00 -1.04 0.00 0.00 39.33 39.20 3b78 h ASP 161 CO 0.07 0.19 0.06 -0.09 -2.04 0.00 0.00 179.24 177.43 3b78 h ARG 162 N 0.64 0.62 0.00 4.15 2.43 -1.95 0.58 114.38 120.84 3b78 h ARG 162 Ca 0.60 -0.12 -0.07 0.00 -0.81 0.00 0.00 59.98 59.57 3b78 h ARG 162 Cb 1.10 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.55 3b78 h ARG 162 CO -0.39 0.60 -0.35 0.00 -1.51 0.00 0.00 179.97 178.31 3b78 h ALA 163 N 1.47 1.17 0.00 2.80 0.00 -1.21 -1.86 119.26 121.63 3b78 h ALA 163 Ca 0.13 -0.32 -0.22 0.00 0.00 0.00 0.00 54.91 54.50 3b78 h ALA 163 Cb 0.29 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3b78 h ALA 163 CO 0.00 0.44 -1.25 1.28 0.00 0.00 0.00 179.25 179.72 3b78 n LEU 164 N -3.76 1.86 0.05 0.00 4.77 -0.78 -1.47 117.00 117.67 3b78 n LEU 164 Ca -0.01 0.44 -0.18 0.00 -0.03 0.00 0.00 56.01 56.23 3b78 n LEU 164 Cb 0.44 -0.95 -0.09 0.00 -2.33 0.00 0.00 43.42 40.49 3b78 n LEU 164 CO 0.37 0.21 0.10 -0.07 -1.33 0.00 0.00 177.39 176.67 3b78 h LEU 165 N -1.00 0.79 0.00 2.23 3.38 -1.01 -2.87 115.31 116.83 3b78 h LEU 165 Ca -0.33 -0.64 -0.10 0.00 0.09 0.00 0.00 57.88 56.90 3b78 h LEU 165 Cb 1.24 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 3b78 h LEU 165 CO -0.20 1.44 -1.09 1.21 0.09 0.00 0.00 178.44 179.89 3b78 n GLU 166 N -3.81 0.52 0.17 1.13 2.13 -0.74 -4.55 120.64 115.48 3b78 n GLU 166 Ca -0.10 0.39 0.06 0.00 0.66 0.00 0.00 57.16 58.17 3b78 n GLU 166 Cb 0.87 -1.58 0.11 0.00 0.27 0.00 0.00 31.44 31.11 3b78 n GLU 166 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 3b78 h LEU 167 N -1.00 0.00 -1.73 4.31 3.38 -1.51 -3.48 115.31 115.28 3b78 h LEU 167 Ca -0.16 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.34 3b78 h LEU 167 Cb 0.96 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 3b78 h LEU 167 CO -0.09 0.32 -0.85 0.00 0.09 0.00 0.00 178.44 177.91 3b78 n GLN 168 N -3.20 -4.04 -1.33 1.13 6.02 -0.54 -4.94 117.38 110.48 3b78 n GLN 168 Ca 0.02 0.49 -0.31 0.00 -0.01 0.00 0.00 57.00 57.20 3b78 n GLN 168 Cb 0.64 -4.87 0.09 0.00 1.02 0.00 0.00 30.24 27.12 3b78 n GLN 168 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3b78 s VAL 169 N -3.76 3.40 0.78 5.09 -7.23 -0.76 -5.02 120.40 112.90 3b78 s VAL 169 Ca 0.11 0.46 -0.10 0.00 -1.81 0.00 0.00 61.98 60.63 3b78 s VAL 169 Cb -0.06 -3.00 0.08 0.00 0.56 0.00 0.00 36.38 33.96 3b78 s VAL 169 CO 0.86 -0.59 1.13 -0.94 -0.31 0.00 0.00 175.10 175.25 3b78 s SER 170 N -3.50 4.57 0.13 4.85 1.04 -1.26 -4.90 113.70 114.63 3b78 s SER 170 Ca 0.61 0.67 -0.16 0.00 0.48 0.00 0.00 55.95 57.55 3b78 s SER 170 Cb -0.16 -1.20 -0.00 0.00 0.10 0.00 0.00 66.02 64.75 3b78 s SER 170 CO 0.56 -1.83 1.69 0.11 0.98 0.00 0.00 173.24 174.74 3b78 h LYS 171 N -0.93 0.61 -0.63 4.02 1.57 -1.97 -1.64 116.57 117.59 3b78 h LYS 171 Ca -0.45 -0.11 -0.09 0.00 -1.87 0.00 0.00 60.65 58.13 3b78 h LYS 171 Cb 1.32 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.51 3b78 h LYS 171 CO 0.64 0.57 0.05 1.49 -0.57 0.00 0.00 179.45 181.62 3b78 h GLU 172 N 0.51 1.07 -0.35 3.15 4.57 -1.97 -1.16 114.58 120.40 3b78 h GLU 172 Ca 0.14 -0.31 0.02 0.00 -1.18 0.00 0.00 59.36 58.03 3b78 h GLU 172 Cb 0.18 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.63 3b78 h GLU 172 CO -0.01 1.01 0.18 -0.44 -1.18 0.00 0.00 179.01 178.57 3b78 h ASP 173 N 0.99 0.28 -0.59 1.04 3.32 -1.91 -1.01 116.42 118.55 3b78 h ASP 173 Ca 0.19 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 3b78 h ASP 173 Cb 0.50 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 3b78 h ASP 173 CO 0.02 0.21 0.32 0.25 -1.72 0.00 0.00 179.24 178.32 3b78 h LEU 174 N 0.38 0.73 0.34 1.55 5.85 -1.06 -1.26 115.31 121.84 3b78 h LEU 174 Ca 0.14 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3b78 h LEU 174 Cb 0.03 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 3b78 h LEU 174 CO -0.09 0.62 -0.28 0.22 -0.34 0.00 0.00 178.44 178.57 3b78 h TYR 175 N 0.79 -0.73 -0.65 1.25 3.20 -0.90 -1.48 116.97 118.45 3b78 h TYR 175 Ca 0.21 0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.17 3b78 h TYR 175 Cb 0.05 0.28 -0.04 0.00 1.54 0.00 0.00 36.73 38.55 3b78 h TYR 175 CO -0.01 -0.41 0.43 1.96 -1.64 0.00 0.00 178.16 178.49 3b78 h GLN 176 N -0.62 0.48 -0.40 1.82 1.08 -1.06 -0.02 115.11 116.38 3b78 h GLN 176 Ca -0.02 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.13 3b78 h GLN 176 Cb 0.55 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.85 3b78 h GLN 176 CO -0.02 0.32 0.18 1.15 -0.95 0.00 0.00 178.83 179.51 3b78 h THR 177 N 0.49 1.18 -0.44 -0.54 2.02 -0.67 -1.36 112.91 113.59 3b78 h THR 177 Ca 0.30 -0.53 -0.01 0.00 0.77 0.00 0.00 66.41 66.94 3b78 h THR 177 Cb 0.52 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 3b78 h THR 177 CO -0.09 0.20 0.22 -0.26 0.37 0.00 0.00 175.52 175.96 3b78 h PHE 178 N 0.51 0.63 -0.45 3.16 0.04 -0.15 -1.82 116.94 118.85 3b78 h PHE 178 Ca 0.14 -0.03 0.06 0.00 2.80 0.00 0.00 57.97 60.94 3b78 h PHE 178 Cb 0.14 -0.20 -0.05 0.00 2.20 0.00 0.00 35.95 38.04 3b78 h PHE 178 CO -0.01 0.50 0.16 0.00 -0.60 0.00 0.00 178.31 178.35 3b78 h ALA 179 N 1.07 0.54 -0.68 2.45 0.00 -0.80 0.17 119.26 122.00 3b78 h ALA 179 Ca 0.15 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 3b78 h ALA 179 Cb 0.10 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3b78 h ALA 179 CO -0.02 -0.23 0.20 0.00 0.00 0.00 0.00 179.25 179.19 3b78 h ARG 180 N 0.32 1.07 0.29 0.00 3.08 -1.13 -0.67 114.38 117.34 3b78 h ARG 180 Ca 0.21 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3b78 h ARG 180 Cb 0.21 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3b78 h ARG 180 CO -0.22 0.93 -0.14 1.15 -1.07 0.00 0.00 179.97 180.62 3b78 h THR 181 N 1.00 0.72 -0.80 2.04 2.02 -0.55 -0.21 112.91 117.13 3b78 h THR 181 Ca 0.22 -0.03 0.08 0.00 0.77 0.00 0.00 66.41 67.45 3b78 h THR 181 Cb 0.32 0.73 -0.05 0.00 -1.74 0.00 0.00 68.15 67.41 3b78 h THR 181 CO -0.00 0.01 0.52 0.58 0.37 0.00 0.00 175.52 176.99 3b78 h VAL 182 N -0.41 0.99 -0.21 3.16 2.07 -0.58 -1.63 116.25 119.64 3b78 h VAL 182 Ca -0.04 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 3b78 h VAL 182 Cb 0.31 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 3b78 h VAL 182 CO 0.07 0.14 0.05 -0.08 0.02 0.00 0.00 177.57 177.77 3b78 h GLU 183 N 0.79 0.34 -0.35 1.57 4.57 -0.65 -2.05 114.58 118.80 3b78 h GLU 183 Ca 0.36 -0.08 0.05 0.00 -1.18 0.00 0.00 59.36 58.50 3b78 h GLU 183 Cb 0.35 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.85 3b78 h GLU 183 CO -0.13 0.45 0.09 0.77 -1.18 0.00 0.00 179.01 179.01 3b78 h SER 184 N 0.16 0.07 -0.35 1.04 0.02 -0.33 -1.77 113.55 112.39 3b78 h SER 184 Ca 0.07 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.09 3b78 h SER 184 Cb 0.27 0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.83 3b78 h SER 184 CO 0.00 0.07 0.18 0.58 -1.14 0.00 0.00 176.83 176.53 3b78 h VAL 185 N 0.22 1.00 0.00 2.27 2.07 -1.21 -2.62 116.25 117.99 3b78 h VAL 185 Ca 0.16 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.50 3b78 h VAL 185 Cb 0.16 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 3b78 h VAL 185 CO -0.19 0.07 -0.25 0.78 0.02 0.00 0.00 177.57 177.99 3b78 h ASN 186 N 0.37 0.00 -0.62 0.57 2.35 -1.11 -0.73 115.58 116.42 3b78 h ASN 186 Ca 0.14 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.84 3b78 h ASN 186 Cb 0.04 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 3b78 h ASN 186 CO -0.09 0.25 0.19 0.58 -1.65 0.00 0.00 177.43 176.71 3b78 h VAL 187 N 0.00 1.25 -0.45 2.81 2.07 -0.96 0.22 116.25 121.19 3b78 h VAL 187 Ca -0.00 -0.85 -0.11 0.00 0.82 0.00 0.00 66.70 66.56 3b78 h VAL 187 Cb 0.67 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3b78 h VAL 187 CO 0.03 0.32 -0.13 0.40 0.02 0.00 0.00 177.57 178.22 3b78 h ILE 188 N 0.89 1.27 0.32 4.57 2.04 -1.19 -2.70 117.51 122.71 3b78 h ILE 188 Ca 0.20 -1.26 -0.02 0.00 1.00 0.00 0.00 64.86 64.78 3b78 h ILE 188 Cb 0.30 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 3b78 h ILE 188 CO -0.01 0.43 -0.15 0.58 0.00 0.00 0.00 178.15 179.00 3b78 h VAL 189 N 0.73 0.68 0.00 1.67 2.07 -0.90 -1.88 116.25 118.62 3b78 h VAL 189 Ca 0.11 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 3b78 h VAL 189 Cb 0.68 0.95 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 3b78 h VAL 189 CO 0.05 0.10 -0.08 0.77 0.02 0.00 0.00 177.57 178.44 3b78 h SER 190 N -0.74 0.00 0.05 0.57 4.64 -0.66 0.34 113.55 117.74 3b78 h SER 190 Ca -0.04 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.06 3b78 h SER 190 Cb 0.50 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.61 3b78 h SER 190 CO 0.07 0.08 -0.87 0.74 -0.87 0.00 0.00 176.83 175.98 3b78 h THR 191 N 0.00 1.38 -0.00 2.95 2.02 -1.41 -3.39 112.91 114.46 3b78 h THR 191 Ca -0.00 -2.26 0.00 0.00 0.77 0.00 0.00 66.41 64.92 3b78 h THR 191 Cb 0.15 2.65 0.00 0.00 -1.74 0.00 0.00 68.15 69.22 3b78 h THR 191 CO 0.01 0.67 -0.41 -1.22 0.37 0.00 0.00 175.52 174.94 3b78 n TYR 192 N -4.04 0.00 -2.27 3.16 4.01 -0.71 -4.62 117.16 112.69 3b78 n TYR 192 Ca -0.12 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.23 3b78 n TYR 192 Cb 0.81 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.81 3b78 n TYR 192 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3b78 s ALA 193 N -1.81 3.31 0.12 -0.72 0.00 0.12 -4.45 121.76 118.34 3b78 s ALA 193 Ca 0.05 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.76 3b78 s ALA 193 Cb 0.08 -3.40 -0.06 0.00 0.00 0.00 0.00 23.12 19.73 3b78 s ALA 193 CO 0.37 -0.50 1.08 0.34 0.00 0.00 0.00 175.76 177.05 3b78 s ASP 194 N -0.88 7.29 0.62 0.00 -1.08 -1.26 -4.91 116.67 116.45 3b78 s ASP 194 Ca 0.52 1.97 0.41 0.00 -0.52 0.00 0.00 52.55 54.93 3b78 s ASP 194 Cb -0.34 -2.59 2.24 0.00 -1.46 0.00 0.00 42.92 40.76 3b78 s ASP 194 CO 0.44 -0.24 2.26 1.05 0.52 0.00 0.00 175.17 179.20 3b78 h GLU 195 N 5.72 0.00 -0.35 4.34 9.09 -1.93 -1.81 114.58 129.64 3b78 h GLU 195 Ca -0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.98 3b78 h GLU 195 Cb 1.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.31 3b78 h GLU 195 CO 0.74 0.00 0.00 0.28 0.05 0.00 0.00 179.01 180.08 3b78 n VAL 196 N -2.95 0.15 0.09 -1.06 0.31 -1.26 -3.12 118.33 110.49 3b78 n VAL 196 Ca -0.03 -0.11 0.02 0.00 -0.01 0.00 0.00 64.34 64.22 3b78 n VAL 196 Cb 0.08 -0.12 -0.04 0.00 -0.91 0.00 0.00 33.84 32.86 3b78 n VAL 196 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3b78 n LEU 197 N -0.18 0.09 -0.25 7.52 4.77 -0.68 -5.04 117.00 123.24 3b78 n LEU 197 Ca 0.03 -0.20 0.03 0.00 -0.03 0.00 0.00 56.01 55.84 3b78 n LEU 197 Cb 0.15 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 3b78 n LEU 197 CO 0.02 0.02 -0.05 0.61 -1.33 0.00 0.00 177.39 176.67 3b78 n GLY 198 N 1.77 -1.45 3.47 -0.72 0.00 -1.18 -4.74 105.19 102.33 3b78 n GLY 198 Ca -0.00 -1.47 -0.49 0.00 0.00 0.00 0.00 46.02 44.06 3b78 n GLY 198 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3b78 n ASP 199 N -1.70 2.24 -0.04 1.61 -0.08 -1.26 -4.77 116.55 112.55 3b78 n ASP 199 Ca 0.00 0.35 0.03 0.00 -1.51 0.00 0.00 54.79 53.67 3b78 n ASP 199 Cb 0.12 -1.30 0.05 0.00 2.34 0.00 0.00 41.12 42.32 3b78 n ASP 199 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 3b78 n VAL 200 N 7.30 1.22 -1.36 5.18 3.14 -1.26 -5.04 118.33 127.51 3b78 n VAL 200 Ca 0.40 -1.35 -0.34 0.00 -2.96 0.00 0.00 64.34 60.10 3b78 n VAL 200 Cb 0.26 0.28 0.10 0.00 -1.06 0.00 0.00 33.84 33.42 3b78 n VAL 200 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 3b78 s GLN 201 N -1.55 2.05 -0.05 1.45 -0.21 -1.26 -4.73 119.66 115.35 3b78 s GLN 201 Ca 0.11 1.68 -0.13 0.00 0.02 0.00 0.00 55.36 57.04 3b78 s GLN 201 Cb 0.09 -1.83 -0.05 0.00 1.00 0.00 0.00 33.01 32.22 3b78 s GLN 201 CO 0.01 -1.89 0.33 0.14 -2.12 0.00 0.00 175.29 171.77 3b78 s VAL 202 N -2.13 5.18 -0.07 1.09 -7.23 -1.26 -5.07 120.40 110.91 3b78 s VAL 202 Ca 0.72 0.66 0.01 0.00 -1.81 0.00 0.00 61.98 61.56 3b78 s VAL 202 Cb -0.27 -3.63 0.02 0.00 0.56 0.00 0.00 36.38 33.05 3b78 s VAL 202 CO 0.47 0.56 -0.07 -0.31 -0.31 0.00 0.00 175.10 175.44 3b78 s TYR 203 N -0.82 1.06 0.22 2.82 2.02 -1.26 -4.96 117.35 116.42 3b78 s TYR 203 Ca 0.21 -0.38 -0.08 0.00 -0.37 0.00 0.00 57.07 56.44 3b78 s TYR 203 Cb -0.15 -0.89 0.27 0.00 -0.40 0.00 0.00 41.96 40.79 3b78 s TYR 203 CO 0.10 -0.29 1.81 -1.35 -1.57 0.00 0.00 175.55 174.25 3b78 h PRO 204 N 7.44 0.69 0.00 -1.71 0.11 -1.91 -1.41 132.00 135.22 3b78 h PRO 204 Ca -0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.75 3b78 h PRO 204 Cb 1.15 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.11 3b78 h PRO 204 CO 0.43 0.46 0.00 0.00 -0.21 0.00 0.00 178.00 178.68 3b78 n ALA 205 N -2.36 1.46 0.77 -0.75 0.00 -1.26 -1.58 120.51 116.79 3b78 n ALA 205 Ca 0.09 -0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.59 3b78 n ALA 205 Cb 0.19 -1.17 -0.05 0.00 0.00 0.00 0.00 19.45 18.41 3b78 n ALA 205 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3b78 n ARG 206 N -1.53 1.59 -0.39 0.00 1.74 -0.56 -4.46 116.66 113.04 3b78 n ARG 206 Ca 0.02 -0.40 0.00 0.00 -0.77 0.00 0.00 57.85 56.71 3b78 n ARG 206 Cb 0.12 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 3b78 n ARG 206 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3b78 n GLY 207 N 1.30 0.80 1.02 -0.13 0.00 -0.62 -4.95 105.19 102.62 3b78 n GLY 207 Ca 0.05 -0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.13 3b78 n GLY 207 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3b78 n THR 208 N -2.39 0.72 -3.96 2.61 -2.24 -1.07 -4.67 114.28 103.28 3b78 n THR 208 Ca 0.00 -0.73 -0.20 0.00 -2.27 0.00 0.00 64.05 60.85 3b78 n THR 208 Cb 0.00 0.40 -0.17 0.00 -2.10 0.00 0.00 70.33 68.47 3b78 n THR 208 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3b78 s VAL 209 N -1.28 0.36 0.24 2.28 1.01 -1.26 -1.53 120.40 120.22 3b78 s VAL 209 Ca 0.37 0.03 0.10 0.00 0.00 0.00 0.00 61.98 62.49 3b78 s VAL 209 Cb 0.20 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 3b78 s VAL 209 CO 0.26 0.21 -0.09 0.00 0.00 0.00 0.00 175.10 175.48 3b78 s ALA 210 N 1.31 2.97 0.02 5.51 0.00 0.13 -4.51 121.76 127.19 3b78 s ALA 210 Ca -0.05 -1.65 0.04 0.00 0.00 0.00 0.00 51.96 50.30 3b78 s ALA 210 Cb -0.13 -0.62 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 3b78 s ALA 210 CO -0.02 0.34 -0.11 -0.06 0.00 0.00 0.00 175.76 175.90 3b78 s PHE 211 N -2.14 1.00 -3.01 0.00 0.08 -0.29 0.21 117.98 113.83 3b78 s PHE 211 Ca 0.28 -0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.05 3b78 s PHE 211 Cb -0.07 -0.61 0.00 0.00 -0.57 0.00 0.00 43.02 41.77 3b78 s PHE 211 CO 0.17 -0.00 0.00 0.41 -0.10 0.00 0.00 175.22 175.70 3b78 n GLY 212 N 2.28 -1.23 2.77 4.36 0.00 -0.74 -0.04 105.19 112.58 3b78 n GLY 212 Ca -0.16 -1.04 -0.28 0.00 0.00 0.00 0.00 46.02 44.54 3b78 n GLY 212 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3b78 s SER 213 N -4.00 2.92 0.38 1.61 0.15 0.44 -1.79 113.70 113.40 3b78 s SER 213 Ca 0.00 -0.80 0.05 0.00 0.70 0.00 0.00 55.95 55.89 3b78 s SER 213 Cb 0.00 -0.66 0.74 0.00 -1.71 0.00 0.00 66.02 64.39 3b78 s SER 213 CO 0.00 -0.29 2.03 1.23 1.20 0.00 0.00 173.24 177.41 3b78 h GLY 214 N 8.21 0.76 -0.02 9.45 0.00 -1.93 -0.00 103.07 119.53 3b78 h GLY 214 Ca -0.17 -0.28 0.08 0.00 0.00 0.00 0.00 47.33 46.96 3b78 h GLY 214 CO 0.34 0.27 -0.23 -2.00 0.00 0.00 0.00 176.54 174.92 3b78 h LEU 215 N 0.72 -0.78 -0.23 3.11 5.85 -1.94 -2.25 115.31 119.80 3b78 h LEU 215 Ca 0.20 0.16 0.00 0.00 0.84 0.00 0.00 57.88 59.08 3b78 h LEU 215 Cb -0.06 0.40 0.00 0.00 0.37 0.00 0.00 40.66 41.37 3b78 h LEU 215 CO -0.05 -0.26 -0.52 1.41 -0.34 0.00 0.00 178.44 178.68 3b78 n HIS 216 N -5.39 0.00 -2.17 1.25 8.25 -1.06 -4.98 115.22 111.13 3b78 n HIS 216 Ca 0.02 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.47 3b78 n HIS 216 Cb 0.30 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.27 3b78 n HIS 216 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3b78 n GLY 217 N 1.45 0.51 3.26 -1.41 0.00 -0.05 -4.48 105.19 104.47 3b78 n GLY 217 Ca 0.07 -0.80 -0.23 0.00 0.00 0.00 0.00 46.02 45.07 3b78 n GLY 217 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3b78 s TRP 218 N -2.32 1.67 0.06 1.61 1.48 -0.99 -2.40 118.94 118.06 3b78 s TRP 218 Ca 0.01 -0.42 -0.26 0.00 -1.06 0.00 0.00 56.10 54.36 3b78 s TRP 218 Cb -0.00 -0.92 0.09 0.00 -1.16 0.00 0.00 33.47 31.47 3b78 s TRP 218 CO 0.01 0.17 0.78 0.00 -4.06 0.00 0.00 176.95 173.84 3b78 s ALA 219 N -1.15 -1.73 0.14 2.67 0.00 -0.28 -0.42 121.76 120.99 3b78 s ALA 219 Ca 0.05 0.79 -0.15 0.00 0.00 0.00 0.00 51.96 52.65 3b78 s ALA 219 Cb -0.10 0.60 0.02 0.00 0.00 0.00 0.00 23.12 23.65 3b78 s ALA 219 CO 0.04 -0.73 0.39 -0.59 0.00 0.00 0.00 175.76 174.87 3b78 s PHE 220 N -3.37 -0.07 0.25 0.00 -0.12 0.94 -4.44 117.98 111.16 3b78 s PHE 220 Ca 0.04 -0.27 0.09 0.00 -0.05 0.00 0.00 56.93 56.74 3b78 s PHE 220 Cb -0.01 0.22 -0.05 0.00 -0.63 0.00 0.00 43.02 42.55 3b78 s PHE 220 CO -0.10 -0.74 -0.14 0.95 -0.05 0.00 0.00 175.22 175.14 3b78 s THR 221 N -3.85 1.92 0.46 -4.49 -4.23 -1.26 -1.14 115.64 103.05 3b78 s THR 221 Ca 0.06 -2.24 0.11 0.00 -1.18 0.00 0.00 61.69 58.45 3b78 s THR 221 Cb 0.02 -2.23 0.26 0.00 1.34 0.00 0.00 72.50 71.89 3b78 s THR 221 CO -0.08 -0.46 2.08 0.40 -0.54 0.00 0.00 174.62 176.02 3b78 h ILE 222 N 2.40 1.07 -0.29 2.99 1.08 -1.79 -2.23 117.51 120.74 3b78 h ILE 222 Ca -0.39 -0.17 -0.07 0.00 -0.39 0.00 0.00 64.86 63.84 3b78 h ILE 222 Cb 1.23 0.80 -0.02 0.00 -3.07 0.00 0.00 36.82 35.77 3b78 h ILE 222 CO 0.63 0.07 -0.11 -0.09 -0.69 0.00 0.00 178.15 177.96 3b78 h ARG 223 N 0.27 0.49 -0.45 2.37 2.43 -1.92 0.12 114.38 117.68 3b78 h ARG 223 Ca 0.07 -0.14 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 3b78 h ARG 223 Cb 0.01 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 3b78 h ARG 223 CO -0.01 0.60 -0.10 1.96 -1.51 0.00 0.00 179.97 180.91 3b78 h GLN 224 N 0.45 0.82 0.03 0.20 4.20 -1.81 -1.54 115.11 117.47 3b78 h GLN 224 Ca 0.09 -0.27 -0.23 0.00 0.06 0.00 0.00 58.65 58.29 3b78 h GLN 224 Cb 0.47 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 3b78 h GLN 224 CO 0.03 0.89 -1.11 0.74 -0.67 0.00 0.00 178.83 178.70 3b78 h PHE 225 N 0.74 0.13 -0.82 2.96 0.04 -1.45 -3.15 116.94 115.39 3b78 h PHE 225 Ca 0.12 -0.09 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 3b78 h PHE 225 Cb 0.60 -0.01 -0.04 0.00 2.20 0.00 0.00 35.95 38.70 3b78 h PHE 225 CO 0.03 1.08 0.45 0.00 -0.60 0.00 0.00 178.31 179.27 3b78 h ALA 226 N 0.89 1.24 -0.70 2.45 0.00 -0.60 -1.74 119.26 120.80 3b78 h ALA 226 Ca -0.06 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 3b78 h ALA 226 Cb 1.84 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 19.27 3b78 h ALA 226 CO 0.15 0.61 0.31 1.15 0.00 0.00 0.00 179.25 181.46 3b78 h THR 227 N 1.15 1.23 0.52 0.00 2.02 -1.30 0.99 112.91 117.53 3b78 h THR 227 Ca 0.29 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.75 3b78 h THR 227 Cb 0.03 0.37 0.01 0.00 -1.74 0.00 0.00 68.15 66.81 3b78 h THR 227 CO -0.05 0.28 -0.25 0.03 0.37 0.00 0.00 175.52 175.91 3b78 h ARG 228 N 1.00 -0.68 -0.00 6.66 3.08 -1.35 -3.28 114.38 119.81 3b78 h ARG 228 Ca 0.24 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.34 3b78 h ARG 228 Cb 0.15 0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.35 3b78 h ARG 228 CO -0.03 -0.38 -0.14 0.66 -1.07 0.00 0.00 179.97 179.01 3b78 n TYR 229 N -5.32 0.00 -0.35 3.04 4.01 -0.72 -3.86 117.16 113.97 3b78 n TYR 229 Ca -0.12 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.69 3b78 n TYR 229 Cb 0.32 -0.38 0.23 0.00 -0.31 0.00 0.00 39.34 39.19 3b78 n TYR 229 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3b78 h ALA 230 N 3.11 1.46 0.16 -0.72 0.00 -0.85 -2.51 119.26 119.90 3b78 h ALA 230 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3b78 h ALA 230 Cb 0.47 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3b78 h ALA 230 CO 0.00 0.19 -0.08 0.87 0.00 0.00 0.00 179.25 180.23 3b78 h LYS 231 N 0.94 -0.20 -0.31 0.00 1.57 -1.76 -1.20 116.57 115.61 3b78 h LYS 231 Ca 0.48 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 3b78 h LYS 231 Cb 0.49 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3b78 h LYS 231 CO -0.27 0.19 0.00 1.63 -0.57 0.00 0.00 179.45 180.43 3b78 n LYS 232 N -4.90 0.70 0.00 3.15 5.02 -1.12 -0.83 118.16 120.18 3b78 n LYS 232 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 3b78 n LYS 232 Cb 0.24 -1.16 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 3b78 n LYS 232 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3b78 n PHE 233 N -0.21 0.00 -3.72 2.13 3.72 -0.96 -5.04 117.46 113.38 3b78 n PHE 233 Ca 0.00 -0.03 -0.28 0.00 -0.05 0.00 0.00 57.45 57.10 3b78 n PHE 233 Cb 0.08 -0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.64 3b78 n PHE 233 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3b78 n GLY 234 N -0.03 -0.70 3.13 1.37 0.00 -0.01 -4.99 105.19 103.96 3b78 n GLY 234 Ca 0.00 0.33 -0.12 0.00 0.00 0.00 0.00 46.02 46.23 3b78 n GLY 234 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b78 s VAL 235 N -3.61 -0.02 0.21 1.61 1.01 -0.47 -5.06 120.40 114.08 3b78 s VAL 235 Ca 0.28 0.07 -0.32 0.00 0.00 0.00 0.00 61.98 62.01 3b78 s VAL 235 Cb -0.10 -0.40 -0.13 0.00 0.00 0.00 0.00 36.38 35.75 3b78 s VAL 235 CO 0.85 0.03 1.63 -0.90 0.00 0.00 0.00 175.10 176.71 3b78 n ASP 236 N 3.58 3.58 0.28 3.32 5.75 -1.26 -4.51 116.55 127.29 3b78 n ASP 236 Ca -0.19 1.09 0.15 0.00 -0.01 0.00 0.00 54.79 55.83 3b78 n ASP 236 Cb 0.56 -1.52 0.79 0.00 -1.03 0.00 0.00 41.12 39.92 3b78 n ASP 236 CO 0.00 0.00 0.00 0.07 -0.11 0.00 0.00 177.20 177.16 3b78 h LYS 237 N 5.90 0.00 -0.01 0.11 2.10 -1.89 0.07 116.57 122.85 3b78 h LYS 237 Ca -0.44 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.21 3b78 h LYS 237 Cb 1.23 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.56 3b78 h LYS 237 CO 0.89 0.00 0.01 0.00 -2.00 0.00 0.00 179.45 178.35 3b78 h ALA 238 N 1.55 0.02 -0.03 0.07 0.00 -1.94 -0.82 119.26 118.11 3b78 h ALA 238 Ca 0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 3b78 h ALA 238 Cb 0.41 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3b78 h ALA 238 CO 0.00 -0.47 -0.64 -0.22 0.00 0.00 0.00 179.25 177.92 3b78 h LYS 239 N -0.01 0.12 -0.20 0.00 3.64 -1.35 -2.98 116.57 115.78 3b78 h LYS 239 Ca 0.01 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.25 3b78 h LYS 239 Cb 0.03 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3b78 h LYS 239 CO -0.00 0.72 -0.05 1.98 -2.27 0.00 0.00 179.45 179.83 3b78 h MET 240 N 0.08 0.38 0.00 1.90 4.05 -1.21 -2.92 114.93 117.21 3b78 h MET 240 Ca -0.01 -0.15 0.00 0.00 -0.28 0.00 0.00 59.70 59.26 3b78 h MET 240 Cb 1.15 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.93 3b78 h MET 240 CO 0.09 0.64 0.00 0.00 0.23 0.00 0.00 176.91 177.87 3b78 h MET 241 N 0.10 0.00 0.00 0.39 -0.00 -1.23 -1.94 114.93 112.25 3b78 h MET 241 Ca 0.05 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.70 3b78 h MET 241 Cb 0.50 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.09 3b78 h MET 241 CO 0.02 0.00 -0.24 0.22 -0.00 0.00 0.00 176.91 176.91 3b78 h ASP 242 N 0.00 0.00 0.51 -0.10 1.82 -1.40 -3.01 116.42 114.24 3b78 h ASP 242 Ca 0.00 0.00 -0.29 0.00 -0.39 0.00 0.00 57.03 56.35 3b78 h ASP 242 Cb 0.76 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.74 3b78 h ASP 242 CO 0.00 0.24 -1.61 0.03 -1.61 0.00 0.00 179.24 176.29 3b78 h ARG 243 N 0.00 0.09 0.00 0.28 3.08 -1.21 -3.35 114.38 113.27 3b78 h ARG 243 Ca -0.00 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.90 3b78 h ARG 243 Cb 0.60 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.70 3b78 h ARG 243 CO 0.03 0.79 0.00 1.28 -1.07 0.00 0.00 179.97 181.00 3b78 n LEU 244 N -3.23 0.00 -3.78 3.04 4.77 -0.79 -4.38 117.00 112.62 3b78 n LEU 244 Ca -0.16 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.69 3b78 n LEU 244 Cb 1.03 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 42.02 3b78 n LEU 244 CO 0.46 0.00 -0.02 0.86 -1.33 0.00 0.00 177.39 177.36 3b78 s TRP 245 N -2.00 -0.24 0.00 -1.77 -0.11 -1.25 -3.89 118.94 109.68 3b78 s TRP 245 Ca 0.01 0.51 0.00 0.00 1.22 0.00 0.00 56.10 57.84 3b78 s TRP 245 Cb 0.00 0.09 0.00 0.00 -1.50 0.00 0.00 33.47 32.07 3b78 s TRP 245 CO 0.01 -0.26 0.00 0.41 -4.62 0.00 0.00 176.95 172.48 3b78 n GLY 246 N 2.12 -0.47 2.78 5.86 0.00 -1.26 -4.57 105.19 109.65 3b78 n GLY 246 Ca -0.17 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 3b78 n GLY 246 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3b78 n ASP 247 N 0.45 6.49 -4.24 1.61 8.00 -1.26 -4.76 116.55 122.84 3b78 n ASP 247 Ca 0.00 -3.29 -0.32 0.00 0.71 0.00 0.00 54.79 51.89 3b78 n ASP 247 Cb 0.00 -1.35 -0.16 0.00 -0.02 0.00 0.00 41.12 39.59 3b78 n ASP 247 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3b78 s SER 248 N -0.32 3.26 -0.08 -2.24 0.01 -1.26 -4.51 113.70 108.55 3b78 s SER 248 Ca 0.41 -0.52 0.01 0.00 1.31 0.00 0.00 55.95 57.16 3b78 s SER 248 Cb 0.12 -1.45 0.02 0.00 0.21 0.00 0.00 66.02 64.92 3b78 s SER 248 CO -0.01 0.16 -0.10 -0.36 0.41 0.00 0.00 173.24 173.34 3b78 s PHE 249 N 0.37 1.45 -0.45 2.43 0.08 0.08 -0.54 117.98 121.39 3b78 s PHE 249 Ca -0.17 -0.61 -0.14 0.00 0.12 0.00 0.00 56.93 56.13 3b78 s PHE 249 Cb -0.17 -1.12 0.07 0.00 -0.57 0.00 0.00 43.02 41.22 3b78 s PHE 249 CO 0.08 -0.37 0.36 0.12 -0.10 0.00 0.00 175.22 175.30 3b78 s PHE 250 N 1.10 3.26 -0.25 0.36 5.36 -1.26 0.18 117.98 126.74 3b78 s PHE 250 Ca -0.06 -1.03 -0.29 0.00 -0.96 0.00 0.00 56.93 54.59 3b78 s PHE 250 Cb -0.14 -3.07 -0.03 0.00 -0.34 0.00 0.00 43.02 39.44 3b78 s PHE 250 CO -0.01 -0.79 1.81 1.21 -1.46 0.00 0.00 175.22 175.97 3b78 s ASN 251 N 2.42 6.05 0.44 6.13 3.84 0.88 -4.87 114.94 129.82 3b78 s ASN 251 Ca 0.04 1.61 0.20 0.00 0.21 0.00 0.00 52.86 54.91 3b78 s ASN 251 Cb -0.24 -2.53 1.02 0.00 -0.55 0.00 0.00 41.25 38.96 3b78 s ASN 251 CO 0.06 -1.53 1.92 -0.65 -2.79 0.00 0.00 177.10 174.11 3b78 h PRO 252 N 12.24 0.00 0.11 0.43 0.11 -1.96 0.48 132.00 143.40 3b78 h PRO 252 Ca -0.36 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.48 3b78 h PRO 252 Cb 1.18 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.30 3b78 h PRO 252 CO 1.00 0.25 -1.20 0.87 -0.21 0.00 0.00 178.00 178.72 3b78 h LYS 253 N 0.00 0.35 0.00 1.05 1.57 -1.97 -3.34 116.57 114.23 3b78 h LYS 253 Ca -0.00 -0.52 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 3b78 h LYS 253 Cb 0.53 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.03 3b78 h LYS 253 CO 0.03 1.22 -1.12 0.25 -0.57 0.00 0.00 179.45 179.27 3b78 n THR 254 N -3.61 0.00 -3.59 -0.16 -2.24 -1.14 -4.98 114.28 98.56 3b78 n THR 254 Ca -0.09 -0.15 -0.25 0.00 -2.27 0.00 0.00 64.05 61.29 3b78 n THR 254 Cb 0.99 0.78 0.07 0.00 -2.10 0.00 0.00 70.33 70.06 3b78 n THR 254 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3b78 n LYS 255 N -1.61 -7.23 -4.48 -0.78 4.01 0.17 -5.00 118.16 103.23 3b78 n LYS 255 Ca 0.02 0.80 -0.29 0.00 -0.51 0.00 0.00 58.31 58.33 3b78 n LYS 255 Cb 0.34 -5.81 -0.13 0.00 -0.51 0.00 0.00 35.03 28.92 3b78 n LYS 255 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 3b78 s LYS 256 N -6.30 1.45 0.08 1.97 1.02 -1.10 -4.94 119.74 111.92 3b78 s LYS 256 Ca 0.57 -1.28 -0.14 0.00 0.02 0.00 0.00 55.97 55.13 3b78 s LYS 256 Cb -0.26 -1.87 -0.06 0.00 -0.52 0.00 0.00 37.83 35.12 3b78 s LYS 256 CO 0.70 0.45 0.48 -1.58 -0.92 0.00 0.00 175.35 174.49 3b78 s TRP 257 N -1.01 3.67 0.13 3.18 0.52 -1.26 -0.08 118.94 124.08 3b78 s TRP 257 Ca 0.13 1.02 -0.08 0.00 0.02 0.00 0.00 56.10 57.19 3b78 s TRP 257 Cb -0.10 -2.32 -0.01 0.00 -1.15 0.00 0.00 33.47 29.89 3b78 s TRP 257 CO 0.05 0.54 0.22 0.99 0.02 0.00 0.00 176.95 178.77 3b78 s THR 258 N -1.28 0.10 -1.17 2.01 2.01 0.13 -4.95 115.64 112.48 3b78 s THR 258 Ca 0.31 -1.36 0.11 0.00 0.31 0.00 0.00 61.69 61.06 3b78 s THR 258 Cb -0.16 -1.65 0.18 0.00 0.01 0.00 0.00 72.50 70.87 3b78 s THR 258 CO 0.17 -0.46 1.02 0.59 -0.69 0.00 0.00 174.62 175.25 3b78 n ASN 259 N -0.14 2.34 -4.62 3.53 5.03 -1.26 -0.74 115.26 119.39 3b78 n ASN 259 Ca -0.10 -1.69 -0.35 0.00 0.87 0.00 0.00 54.58 53.30 3b78 n ASN 259 Cb 0.63 -0.10 -0.10 0.00 -1.02 0.00 0.00 39.78 39.19 3b78 n ASN 259 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 3b78 s LYS 260 N -0.95 3.98 -0.03 3.52 2.20 -1.26 -4.88 119.74 122.32 3b78 s LYS 260 Ca 0.17 -0.33 0.03 0.00 -0.36 0.00 0.00 55.97 55.48 3b78 s LYS 260 Cb 0.10 -3.35 0.12 0.00 -1.51 0.00 0.00 37.83 33.20 3b78 s LYS 260 CO 0.14 0.14 0.83 -0.40 -0.36 0.00 0.00 175.35 175.70 3b78 n ASP 261 N 3.98 1.40 -3.85 1.43 5.75 -1.26 -4.74 116.55 119.26 3b78 n ASP 261 Ca -0.16 -2.10 -0.12 0.00 -0.01 0.00 0.00 54.79 52.40 3b78 n ASP 261 Cb 0.52 -0.39 -0.12 0.00 -1.03 0.00 0.00 41.12 40.11 3b78 n ASP 261 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3b78 s THR 262 N -1.46 0.04 0.45 2.12 -4.23 -1.26 -1.06 115.64 110.23 3b78 s THR 262 Ca 0.09 -0.30 -0.08 0.00 -1.18 0.00 0.00 61.69 60.22 3b78 s THR 262 Cb 0.06 -0.28 0.10 0.00 1.34 0.00 0.00 72.50 73.72 3b78 s THR 262 CO 0.03 -0.16 0.61 -0.90 -0.54 0.00 0.00 174.62 173.66 3b78 n ASP 263 N 2.39 0.06 -0.37 3.99 5.75 -0.57 -4.87 116.55 122.93 3b78 n ASP 263 Ca -0.17 -1.23 0.02 0.00 -0.01 0.00 0.00 54.79 53.40 3b78 n ASP 263 Cb 0.58 -0.47 0.17 0.00 -1.03 0.00 0.00 41.12 40.37 3b78 n ASP 263 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3b78 h ALA 264 N -1.87 1.38 -0.04 2.12 0.00 -2.01 -1.23 119.26 117.61 3b78 h ALA 264 Ca -0.20 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3b78 h ALA 264 Cb 0.55 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3b78 h ALA 264 CO 0.14 0.48 0.00 0.39 0.00 0.00 0.00 179.25 180.26 3b78 n GLU 265 N -4.48 1.19 -1.28 0.00 1.02 -1.26 -4.88 120.64 110.94 3b78 n GLU 265 Ca 0.15 -0.28 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 3b78 n GLU 265 Cb 0.16 -1.32 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 3b78 n GLU 265 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3b78 n GLY 266 N 0.88 0.48 3.81 0.62 0.00 -0.46 -5.05 105.19 105.47 3b78 n GLY 266 Ca 0.15 -0.91 -0.38 0.00 0.00 0.00 0.00 46.02 44.88 3b78 n GLY 266 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3b78 s LYS 267 N -2.60 4.09 0.35 1.61 1.02 -1.26 -4.80 119.74 118.15 3b78 s LYS 267 Ca 0.00 0.57 -0.29 0.00 0.02 0.00 0.00 55.97 56.27 3b78 s LYS 267 Cb 0.00 -3.25 -0.11 0.00 -0.52 0.00 0.00 37.83 33.94 3b78 s LYS 267 CO 0.00 0.61 1.54 -2.14 -0.92 0.00 0.00 175.35 174.44 3b78 s PRO 268 N -0.89 4.10 -0.06 -1.68 0.02 -1.26 -1.51 135.00 133.71 3b78 s PRO 268 Ca 0.26 2.60 0.01 0.00 0.02 0.00 0.00 61.00 63.90 3b78 s PRO 268 Cb -0.18 -2.98 -0.03 0.00 0.02 0.00 0.00 34.50 31.33 3b78 s PRO 268 CO 0.16 -0.60 -0.07 -0.51 -0.33 0.00 0.00 177.00 175.65 3b78 s LEU 269 N -1.51 3.15 0.08 -5.54 1.43 -0.23 -4.87 118.68 111.20 3b78 s LEU 269 Ca 0.57 -0.04 -0.29 0.00 -1.03 0.00 0.00 54.13 53.34 3b78 s LEU 269 Cb -0.48 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.00 3b78 s LEU 269 CO 0.58 0.36 0.93 -0.70 0.23 0.00 0.00 176.35 177.74 3b78 s GLU 270 N -0.85 4.64 0.71 1.70 2.12 -1.26 -4.87 118.70 120.88 3b78 s GLU 270 Ca 0.13 1.37 -0.14 0.00 0.36 0.00 0.00 54.97 56.69 3b78 s GLU 270 Cb -0.11 -3.39 0.03 0.00 0.26 0.00 0.00 34.13 30.92 3b78 s GLU 270 CO 0.02 0.19 1.12 -0.98 -0.54 0.00 0.00 175.26 175.06 3b78 s ARG 271 N 0.14 2.49 0.30 4.30 1.70 -1.26 -4.17 118.95 122.45 3b78 s ARG 271 Ca 0.46 1.39 -0.02 0.00 -0.47 0.00 0.00 55.73 57.10 3b78 s ARG 271 Cb -0.22 -1.91 0.46 0.00 -0.57 0.00 0.00 34.95 32.70 3b78 s ARG 271 CO 0.28 -1.49 1.96 0.00 -1.08 0.00 0.00 175.30 174.97 3b78 h ALA 272 N -0.39 1.43 -0.77 7.88 0.00 -1.05 -1.89 119.26 124.47 3b78 h ALA 272 Ca -0.46 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.42 3b78 h ALA 272 Cb 1.25 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 3b78 h ALA 272 CO 0.52 0.52 0.50 0.35 0.00 0.00 0.00 179.25 181.14 3b78 h PHE 273 N 1.10 0.95 -0.01 0.00 3.57 -1.80 0.16 116.94 120.92 3b78 h PHE 273 Ca 0.31 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.70 3b78 h PHE 273 Cb -0.09 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.31 3b78 h PHE 273 CO -0.00 0.57 -0.62 -0.91 -2.23 0.00 0.00 178.31 175.13 3b78 h ASN 274 N 1.00 0.04 0.12 0.41 4.21 -1.77 -2.27 115.58 117.31 3b78 h ASN 274 Ca 0.29 -0.02 -0.26 0.00 1.21 0.00 0.00 56.30 57.52 3b78 h ASN 274 Cb -0.07 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 37.12 3b78 h ASN 274 CO -0.08 0.64 -1.30 -0.03 -1.29 0.00 0.00 177.43 175.37 3b78 h MET 275 N 0.02 0.24 0.00 0.81 4.05 -0.69 -1.78 114.93 117.59 3b78 h MET 275 Ca -0.01 -0.42 -0.06 0.00 -0.28 0.00 0.00 59.70 58.94 3b78 h MET 275 Cb 1.09 0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 32.04 3b78 h MET 275 CO 0.08 1.20 -1.92 1.19 0.23 0.00 0.00 176.91 177.69 3b78 n PHE 276 N -3.97 0.14 -0.03 1.39 3.72 -0.02 -4.32 117.46 114.38 3b78 n PHE 276 Ca -0.23 0.04 -0.04 0.00 -0.05 0.00 0.00 57.45 57.17 3b78 n PHE 276 Cb 0.88 -0.64 -0.01 0.00 -0.94 0.00 0.00 39.48 38.76 3b78 n PHE 276 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3b78 n ILE 277 N -2.40 1.10 -0.17 4.37 5.41 -1.04 -4.64 119.36 121.99 3b78 n ILE 277 Ca -0.08 0.26 -0.11 0.00 1.00 0.00 0.00 62.75 63.83 3b78 n ILE 277 Cb 0.66 -1.88 0.00 0.00 -0.71 0.00 0.00 39.64 37.71 3b78 n ILE 277 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3b78 h LEU 278 N -0.47 0.94 -0.14 1.39 3.38 -1.52 -3.25 115.31 115.65 3b78 h LEU 278 Ca 0.00 -0.35 0.04 0.00 0.09 0.00 0.00 57.88 57.65 3b78 h LEU 278 Cb 0.47 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3b78 h LEU 278 CO 0.00 1.08 -0.08 -0.78 0.09 0.00 0.00 178.44 178.74 3b78 h ASP 279 N 0.80 -0.28 -0.91 -0.43 3.58 -1.51 0.31 116.42 117.98 3b78 h ASP 279 Ca 0.13 0.06 0.10 0.00 0.42 0.00 0.00 57.03 57.74 3b78 h ASP 279 Cb 0.65 0.15 -0.08 0.00 1.72 0.00 0.00 39.33 41.77 3b78 h ASP 279 CO 0.05 -0.11 0.55 -0.65 -2.88 0.00 0.00 179.24 176.19 3b78 h PRO 280 N -0.08 0.87 -0.13 0.28 0.11 -1.80 0.28 132.00 131.53 3b78 h PRO 280 Ca 0.08 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.09 3b78 h PRO 280 Cb 0.20 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.12 3b78 h PRO 280 CO -0.19 0.58 -0.10 0.82 -0.21 0.00 0.00 178.00 178.89 3b78 h ILE 281 N 0.90 1.34 -0.89 4.15 2.04 -1.38 -2.71 117.51 120.96 3b78 h ILE 281 Ca 0.44 -1.22 0.04 0.00 1.00 0.00 0.00 64.86 65.12 3b78 h ILE 281 Cb 0.40 1.86 -0.05 0.00 -0.74 0.00 0.00 36.82 38.29 3b78 h ILE 281 CO -0.25 0.35 0.58 -0.26 0.00 0.00 0.00 178.15 178.58 3b78 h PHE 282 N -0.08 1.07 -0.67 1.37 -1.00 -0.05 -1.56 116.94 116.03 3b78 h PHE 282 Ca 0.02 0.03 -0.07 0.00 2.81 0.00 0.00 57.97 60.76 3b78 h PHE 282 Cb 0.61 -0.36 -0.03 0.00 3.61 0.00 0.00 35.95 39.78 3b78 h PHE 282 CO 0.08 0.61 0.14 0.00 -1.61 0.00 0.00 178.31 177.53 3b78 h ARG 283 N 1.10 1.09 -0.15 1.51 3.08 -0.89 -0.77 114.38 119.35 3b78 h ARG 283 Ca 0.36 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 3b78 h ARG 283 Cb 0.04 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 3b78 h ARG 283 CO -0.11 0.99 0.04 -0.07 -1.07 0.00 0.00 179.97 179.75 3b78 h LEU 284 N 1.01 0.23 -1.00 3.04 3.38 -1.12 -0.33 115.31 120.53 3b78 h LEU 284 Ca 0.21 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 58.02 3b78 h LEU 284 Cb 0.40 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.03 3b78 h LEU 284 CO 0.01 0.38 0.65 -0.26 0.09 0.00 0.00 178.44 179.31 3b78 h PHE 285 N 0.06 1.20 -0.06 1.13 0.04 -1.11 -0.10 116.94 118.10 3b78 h PHE 285 Ca 0.05 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.79 3b78 h PHE 285 Cb 0.24 -0.39 0.00 0.00 2.20 0.00 0.00 35.95 38.00 3b78 h PHE 285 CO 0.00 0.63 -0.18 1.15 -0.60 0.00 0.00 178.31 179.31 3b78 h THR 286 N 1.18 1.44 0.04 -1.55 2.02 -1.01 -2.05 112.91 112.99 3b78 h THR 286 Ca 0.43 -1.58 -0.00 0.00 0.77 0.00 0.00 66.41 66.02 3b78 h THR 286 Cb 0.14 2.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.88 3b78 h THR 286 CO -0.17 0.44 -0.02 0.00 0.37 0.00 0.00 175.52 176.14 3b78 h ALA 287 N 0.43 -0.06 -0.01 6.16 0.00 -0.87 -2.18 119.26 122.73 3b78 h ALA 287 Ca -0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3b78 h ALA 287 Cb 0.81 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3b78 h ALA 287 CO 0.04 -0.47 -0.00 0.82 0.00 0.00 0.00 179.25 179.64 3b78 h ILE 288 N -0.18 1.31 0.00 0.00 2.04 -1.12 -2.29 117.51 117.26 3b78 h ILE 288 Ca -0.01 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 64.94 3b78 h ILE 288 Cb 0.16 1.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.15 3b78 h ILE 288 CO 0.01 0.24 0.00 0.24 0.00 0.00 0.00 178.15 178.64 3b78 h MET 289 N -0.36 0.00 -0.71 2.37 2.86 -1.43 -1.97 114.93 115.68 3b78 h MET 289 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3b78 h MET 289 Cb 0.39 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.05 3b78 h MET 289 CO 0.00 0.00 0.00 0.09 1.06 0.00 0.00 176.91 178.06 3b78 n ASN 290 N -2.83 4.14 -3.98 1.22 3.02 -0.82 -4.95 115.26 111.05 3b78 n ASN 290 Ca 0.01 -2.12 -0.31 0.00 -0.03 0.00 0.00 54.58 52.13 3b78 n ASN 290 Cb 0.31 -0.51 0.01 0.00 -0.61 0.00 0.00 39.78 38.98 3b78 n ASN 290 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3b78 n PHE 291 N 1.51 -2.13 -2.80 3.10 3.72 -0.74 -4.86 117.46 115.25 3b78 n PHE 291 Ca 0.25 0.87 -0.44 0.00 -0.05 0.00 0.00 57.45 58.08 3b78 n PHE 291 Cb 0.69 -3.74 0.00 0.00 -0.94 0.00 0.00 39.48 35.49 3b78 n PHE 291 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3b78 n LYS 292 N -4.59 3.33 0.24 -1.08 5.02 -0.88 -4.84 118.16 115.35 3b78 n LYS 292 Ca 0.02 -3.66 0.13 0.00 -2.02 0.00 0.00 58.31 52.78 3b78 n LYS 292 Cb 0.53 -3.16 0.72 0.00 -0.02 0.00 0.00 35.03 33.09 3b78 n LYS 292 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 3b78 h LYS 293 N 7.16 0.00 0.00 1.97 2.10 -1.89 -1.04 116.57 124.88 3b78 h LYS 293 Ca 0.36 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 58.77 3b78 h LYS 293 Cb 0.86 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.14 3b78 h LYS 293 CO 1.33 0.00 -1.51 -0.44 -2.00 0.00 0.00 179.45 176.84 3b78 h ASP 294 N 0.00 0.00 0.11 7.07 3.32 -1.97 -3.39 116.42 121.56 3b78 h ASP 294 Ca 0.00 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.85 3b78 h ASP 294 Cb 0.27 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.83 3b78 h ASP 294 CO 0.00 0.88 -0.98 -0.33 -1.72 0.00 0.00 179.24 177.10 3b78 h GLU 295 N 0.00 0.24 -0.71 3.56 5.08 -1.59 -3.39 114.58 117.77 3b78 h GLU 295 Ca -0.21 -0.41 0.12 0.00 -1.00 0.00 0.00 59.36 57.86 3b78 h GLU 295 Cb 1.86 0.15 -0.13 0.00 0.50 0.00 0.00 28.75 31.13 3b78 h GLU 295 CO 0.08 1.20 -0.33 0.82 -1.00 0.00 0.00 179.01 179.78 3b78 h ILE 296 N -0.43 0.14 -0.10 3.13 2.04 -1.67 0.11 117.51 120.72 3b78 h ILE 296 Ca -0.20 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.69 3b78 h ILE 296 Cb 1.61 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 3b78 h ILE 296 CO 0.09 0.00 -0.07 -0.65 0.00 0.00 0.00 178.15 177.52 3b78 h PRO 297 N -0.10 -0.07 -0.58 2.37 0.11 -1.76 0.59 132.00 132.56 3b78 h PRO 297 Ca 0.28 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.41 3b78 h PRO 297 Cb 0.57 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.66 3b78 h PRO 297 CO -0.77 -0.05 0.38 0.28 -0.21 0.00 0.00 178.00 177.64 3b78 h VAL 298 N -0.07 1.13 -0.09 3.15 2.07 -1.49 -1.50 116.25 119.45 3b78 h VAL 298 Ca 0.06 -0.26 -0.18 0.00 0.82 0.00 0.00 66.70 67.15 3b78 h VAL 298 Cb 0.16 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3b78 h VAL 298 CO -0.14 0.14 -0.70 0.25 0.02 0.00 0.00 177.57 177.14 3b78 h LEU 299 N 0.75 0.48 -0.15 2.57 5.85 -0.32 -2.59 115.31 121.89 3b78 h LEU 299 Ca 0.22 -0.30 -0.13 0.00 0.84 0.00 0.00 57.88 58.50 3b78 h LEU 299 Cb -0.04 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.86 3b78 h LEU 299 CO -0.05 1.03 -0.42 -0.07 -0.34 0.00 0.00 178.44 178.59 3b78 h LEU 300 N 0.28 0.64 -1.50 2.25 4.07 -0.35 -2.95 115.31 117.75 3b78 h LEU 300 Ca -0.02 -0.59 -0.04 0.00 0.08 0.00 0.00 57.88 57.31 3b78 h LEU 300 Cb 1.26 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.81 3b78 h LEU 300 CO 0.12 1.11 -0.09 -0.08 -1.08 0.00 0.00 178.44 178.42 3b78 h GLU 301 N 0.19 0.21 -0.70 1.13 4.81 -1.33 0.20 114.58 119.10 3b78 h GLU 301 Ca -0.01 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.13 3b78 h GLU 301 Cb 1.04 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.36 3b78 h GLU 301 CO 0.09 0.32 0.26 -0.22 -0.73 0.00 0.00 179.01 178.73 3b78 h LYS 302 N 0.21 1.06 -0.29 1.92 3.64 -1.37 -2.15 116.57 119.59 3b78 h LYS 302 Ca 0.05 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 3b78 h LYS 302 Cb 0.30 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3b78 h LYS 302 CO 0.02 0.89 0.00 1.28 -2.27 0.00 0.00 179.45 179.37 3b78 n LEU 303 N -4.35 2.55 -3.58 5.20 4.77 -1.02 -4.96 117.00 115.61 3b78 n LEU 303 Ca 0.05 -1.09 -0.23 0.00 -0.03 0.00 0.00 56.01 54.71 3b78 n LEU 303 Cb 0.19 -0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 3b78 n LEU 303 CO 0.40 0.55 -0.04 1.21 -1.33 0.00 0.00 177.39 178.18 3b78 n GLU 304 N 0.90 -3.19 -3.64 3.23 2.13 -0.12 -4.97 120.64 114.98 3b78 n GLU 304 Ca 0.17 0.64 -0.39 0.00 0.66 0.00 0.00 57.16 58.24 3b78 n GLU 304 Cb 0.46 -5.03 -0.10 0.00 0.27 0.00 0.00 31.44 27.04 3b78 n GLU 304 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3b78 s ILE 305 N -3.53 4.03 -0.14 6.31 1.01 0.53 -5.01 121.20 124.41 3b78 s ILE 305 Ca 0.26 -1.52 -0.17 0.00 0.00 0.00 0.00 60.65 59.21 3b78 s ILE 305 Cb -0.07 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 3b78 s ILE 305 CO 0.81 -0.54 0.43 -0.69 0.00 0.00 0.00 174.94 174.95 3b78 s VAL 306 N 1.37 5.21 0.43 2.92 1.01 -1.26 -4.61 120.40 125.47 3b78 s VAL 306 Ca 0.03 0.84 0.08 0.00 0.00 0.00 0.00 61.98 62.94 3b78 s VAL 306 Cb -0.23 -3.77 0.01 0.00 0.00 0.00 0.00 36.38 32.39 3b78 s VAL 306 CO 0.01 0.32 0.58 -0.76 0.00 0.00 0.00 175.10 175.25 3b78 s LEU 307 N 0.71 3.62 -0.08 3.92 1.43 -1.26 -5.12 118.68 121.90 3b78 s LEU 307 Ca 0.23 -0.45 -0.00 0.00 -1.03 0.00 0.00 54.13 52.87 3b78 s LEU 307 Cb -0.15 -2.59 0.03 0.00 0.03 0.00 0.00 46.19 43.51 3b78 s LEU 307 CO 0.09 -0.80 -0.04 -0.54 0.23 0.00 0.00 176.35 175.29 3b78 s LYS 308 N -4.37 1.04 0.00 1.70 -0.14 -1.26 -4.94 119.74 111.76 3b78 s LYS 308 Ca 0.55 -0.08 0.00 0.00 -1.36 0.00 0.00 55.97 55.08 3b78 s LYS 308 Cb -0.10 -1.21 0.00 0.00 -1.68 0.00 0.00 37.83 34.85 3b78 s LYS 308 CO 0.33 -0.24 0.00 0.41 -0.76 0.00 0.00 175.35 175.09 3b78 n GLY 309 N 4.86 0.47 0.38 -3.33 0.00 -1.26 -0.40 105.19 105.90 3b78 n GLY 309 Ca -0.12 0.57 0.15 0.00 0.00 0.00 0.00 46.02 46.62 3b78 n GLY 309 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3b78 h ASP 310 N 0.00 0.63 0.44 1.61 3.32 -2.02 -0.54 116.42 119.86 3b78 h ASP 310 Ca 0.00 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 3b78 h ASP 310 Cb 0.00 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 3b78 h ASP 310 CO 0.00 0.25 -0.15 -0.33 -1.72 0.00 0.00 179.24 177.29 3b78 h GLU 311 N 0.63 0.00 0.00 3.56 5.08 -1.13 -2.78 114.58 119.94 3b78 h GLU 311 Ca 0.52 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.88 3b78 h GLU 311 Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 3b78 h GLU 311 CO -0.27 0.15 0.00 1.63 -1.00 0.00 0.00 179.01 179.51 3b78 n LYS 312 N -3.64 0.46 0.00 2.33 5.02 -0.21 -2.68 118.16 119.44 3b78 n LYS 312 Ca -0.02 0.04 0.05 0.00 -2.02 0.00 0.00 58.31 56.37 3b78 n LYS 312 Cb 0.27 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.75 3b78 n LYS 312 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3b78 n ASP 313 N -1.21 0.87 -4.74 4.39 -0.08 -1.05 -5.02 116.55 109.70 3b78 n ASP 313 Ca 0.13 -0.93 -0.30 0.00 -1.51 0.00 0.00 54.79 52.17 3b78 n ASP 313 Cb 0.17 0.76 0.11 0.00 2.34 0.00 0.00 41.12 44.50 3b78 n ASP 313 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3b78 s LEU 314 N -2.16 2.71 0.20 -2.67 1.43 -1.09 -5.07 118.68 112.02 3b78 s LEU 314 Ca 0.07 1.71 -0.20 0.00 -1.03 0.00 0.00 54.13 54.68 3b78 s LEU 314 Cb 0.09 -4.28 0.04 0.00 0.03 0.00 0.00 46.19 42.07 3b78 s LEU 314 CO 0.38 -2.34 0.58 -1.83 0.23 0.00 0.00 176.35 173.37 3b78 s GLU 315 N -4.90 1.41 4.04 1.70 -1.05 -1.26 -4.70 118.70 113.94 3b78 s GLU 315 Ca 0.62 -0.75 0.00 0.00 -0.15 0.00 0.00 54.97 54.69 3b78 s GLU 315 Cb -0.18 0.56 0.00 0.00 -0.44 0.00 0.00 34.13 34.07 3b78 s GLU 315 CO 0.57 -0.61 0.00 0.41 0.95 0.00 0.00 175.26 176.57 3b78 n GLY 316 N -0.37 0.84 0.35 -3.83 0.00 -1.26 -3.17 105.19 97.76 3b78 n GLY 316 Ca -0.11 -0.76 0.05 0.00 0.00 0.00 0.00 46.02 45.20 3b78 n GLY 316 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3b78 h LYS 317 N 0.00 0.77 -0.28 1.61 1.57 -1.96 -1.47 116.57 116.81 3b78 h LYS 317 Ca 0.00 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.79 3b78 h LYS 317 Cb 0.00 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.08 3b78 h LYS 317 CO 0.00 0.51 -0.04 0.00 -0.57 0.00 0.00 179.45 179.35 3b78 h ALA 318 N 1.60 0.21 -0.32 3.86 0.00 -1.97 0.46 119.26 123.10 3b78 h ALA 318 Ca 0.31 0.10 -0.12 0.00 0.00 0.00 0.00 54.91 55.19 3b78 h ALA 318 Cb 0.20 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3b78 h ALA 318 CO -0.10 -0.45 -0.28 1.25 0.00 0.00 0.00 179.25 179.68 3b78 h LEU 319 N 0.03 0.79 -1.19 0.00 5.85 -1.46 -3.02 115.31 116.32 3b78 h LEU 319 Ca 0.14 -0.46 0.04 0.00 0.84 0.00 0.00 57.88 58.44 3b78 h LEU 319 Cb 0.20 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 3b78 h LEU 319 CO -0.27 1.08 0.56 0.25 -0.34 0.00 0.00 178.44 179.73 3b78 h LEU 320 N 0.51 0.90 -0.50 2.25 5.85 -0.84 -0.55 115.31 122.93 3b78 h LEU 320 Ca 0.06 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 3b78 h LEU 320 Cb 0.85 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 3b78 h LEU 320 CO 0.07 0.61 -0.11 0.50 -0.34 0.00 0.00 178.44 179.16 3b78 h LYS 321 N 1.04 0.96 -0.20 1.25 3.64 -0.88 -1.52 116.57 120.86 3b78 h LYS 321 Ca 0.35 -0.36 -0.06 0.00 -1.27 0.00 0.00 60.65 59.30 3b78 h LYS 321 Cb 0.08 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3b78 h LYS 321 CO -0.11 1.03 -0.12 0.28 -2.27 0.00 0.00 179.45 178.26 3b78 h VAL 322 N 0.82 1.31 -0.07 2.00 2.07 -1.29 -2.58 116.25 118.51 3b78 h VAL 322 Ca 0.13 -1.21 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 3b78 h VAL 322 Cb 0.67 1.68 -0.00 0.00 -1.52 0.00 0.00 31.29 32.12 3b78 h VAL 322 CO 0.05 0.37 0.02 0.58 0.02 0.00 0.00 177.57 178.61 3b78 h VAL 323 N 0.12 1.16 -0.52 2.57 2.07 -1.11 -2.99 116.25 117.55 3b78 h VAL 323 Ca 0.04 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 3b78 h VAL 323 Cb 0.62 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 3b78 h VAL 323 CO 0.03 0.13 0.24 0.24 0.02 0.00 0.00 177.57 178.24 3b78 h MET 324 N -0.07 0.75 0.00 1.57 2.07 -1.34 -1.65 114.93 116.27 3b78 h MET 324 Ca 0.02 -0.12 0.00 0.00 -2.07 0.00 0.00 59.70 57.54 3b78 h MET 324 Cb 0.19 -0.13 0.00 0.00 -1.87 0.00 0.00 31.60 29.79 3b78 h MET 324 CO -0.00 0.63 0.00 2.89 1.07 0.00 0.00 176.91 181.50 3b78 n ARG 325 N -4.58 0.22 0.00 1.72 0.00 -0.97 -0.55 116.66 112.50 3b78 n ARG 325 Ca 0.02 0.22 0.10 0.00 -0.00 0.00 0.00 57.85 58.19 3b78 n ARG 325 Cb 0.13 -1.77 -0.09 0.00 -0.00 0.00 0.00 32.46 30.72 3b78 n ARG 325 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 3b78 n LYS 326 N -2.16 0.09 0.05 2.89 2.85 -1.13 -2.88 118.16 117.87 3b78 n LYS 326 Ca 0.05 -0.02 -0.22 0.00 -1.05 0.00 0.00 58.31 57.08 3b78 n LYS 326 Cb 0.39 -1.51 -0.15 0.00 -0.65 0.00 0.00 35.03 33.12 3b78 n LYS 326 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 177.40 177.70 3b78 h PHE 327 N 0.00 0.62 -1.84 5.58 3.57 -0.73 -3.43 116.94 120.71 3b78 h PHE 327 Ca 0.00 -0.45 -0.52 0.00 3.53 0.00 0.00 57.97 60.53 3b78 h PHE 327 Cb 0.57 -0.02 -0.36 0.00 2.79 0.00 0.00 35.95 38.92 3b78 h PHE 327 CO 0.00 1.65 -1.01 1.28 -2.23 0.00 0.00 178.31 178.00 3b78 n LEU 328 N -3.54 -0.35 -4.70 0.59 4.77 0.29 -5.09 117.00 108.97 3b78 n LEU 328 Ca -0.25 -4.45 -0.54 0.00 -0.03 0.00 0.00 56.01 50.74 3b78 n LEU 328 Cb 1.07 0.65 -0.06 0.00 -2.33 0.00 0.00 43.42 42.74 3b78 n LEU 328 CO 0.49 2.02 1.36 -2.65 -1.33 0.00 0.00 177.39 177.29 3b78 n PRO 329 N 1.74 1.49 -0.11 3.23 -0.02 -1.14 -1.13 135.00 139.07 3b78 n PRO 329 Ca 0.21 0.55 -0.06 0.00 -2.02 0.00 0.00 63.50 62.18 3b78 n PRO 329 Cb 0.53 -2.28 0.02 0.00 -0.02 0.00 0.00 33.50 31.75 3b78 n PRO 329 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3b78 h ALA 330 N 7.73 0.40 -0.88 3.55 0.00 -1.69 -2.86 119.26 125.52 3b78 h ALA 330 Ca -0.47 0.06 0.09 0.00 0.00 0.00 0.00 54.91 54.60 3b78 h ALA 330 Cb 1.30 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 19.10 3b78 h ALA 330 CO 0.95 -0.31 0.57 0.00 0.00 0.00 0.00 179.25 180.46 3b78 h ALA 331 N 1.26 1.64 -0.40 0.00 0.00 -1.86 -2.25 119.26 117.65 3b78 h ALA 331 Ca 0.17 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 3b78 h ALA 331 Cb 0.18 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3b78 h ALA 331 CO -0.21 0.18 0.19 -0.44 0.00 0.00 0.00 179.25 178.97 3b78 h ASP 332 N 0.88 0.53 -0.92 0.00 3.45 -1.89 0.48 116.42 118.95 3b78 h ASP 332 Ca 0.40 -0.13 0.02 0.00 0.43 0.00 0.00 57.03 57.75 3b78 h ASP 332 Cb 0.40 -0.14 -0.05 0.00 -0.56 0.00 0.00 39.33 38.98 3b78 h ASP 332 CO -0.17 0.52 0.60 0.00 -1.57 0.00 0.00 179.24 178.62 3b78 h ALA 333 N 1.04 1.18 -0.04 3.45 0.00 -1.45 -0.44 119.26 123.01 3b78 h ALA 333 Ca 0.14 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3b78 h ALA 333 Cb 0.13 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3b78 h ALA 333 CO -0.02 0.51 -0.08 -0.07 0.00 0.00 0.00 179.25 179.60 3b78 h LEU 334 N 1.20 0.14 -1.36 0.00 3.38 -1.20 -3.00 115.31 114.47 3b78 h LEU 334 Ca 0.35 -0.56 0.01 0.00 0.09 0.00 0.00 57.88 57.77 3b78 h LEU 334 Cb -0.07 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3b78 h LEU 334 CO -0.09 0.67 0.44 -0.07 0.09 0.00 0.00 178.44 179.47 3b78 h LEU 335 N -0.39 0.74 0.15 1.67 3.38 -0.82 -1.36 115.31 118.69 3b78 h LEU 335 Ca 0.00 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.97 3b78 h LEU 335 Cb 0.65 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 3b78 h LEU 335 CO 0.02 0.54 -0.25 -0.08 0.09 0.00 0.00 178.44 178.76 3b78 h GLU 336 N 0.88 -0.45 -0.32 1.13 4.81 -1.05 -0.84 114.58 118.73 3b78 h GLU 336 Ca 0.24 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.50 3b78 h GLU 336 Cb -0.08 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 3b78 h GLU 336 CO -0.05 -0.30 0.19 0.52 -0.73 0.00 0.00 179.01 178.63 3b78 h MET 337 N -0.47 0.44 -0.14 1.92 2.86 -1.34 -1.50 114.93 116.70 3b78 h MET 337 Ca 0.02 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.65 3b78 h MET 337 Cb 0.48 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 3b78 h MET 337 CO -0.12 0.36 -0.09 0.82 1.06 0.00 0.00 176.91 178.94 3b78 h ILE 338 N 0.41 0.72 -0.35 -1.22 2.04 -1.04 0.20 117.51 118.27 3b78 h ILE 338 Ca 0.11 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.84 3b78 h ILE 338 Cb 0.04 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 3b78 h ILE 338 CO -0.02 0.00 -0.32 0.58 0.00 0.00 0.00 178.15 178.39 3b78 h VAL 339 N -0.10 1.28 0.00 1.67 2.07 -1.12 -2.19 116.25 117.87 3b78 h VAL 339 Ca 0.09 -1.48 -0.16 0.00 0.82 0.00 0.00 66.70 65.97 3b78 h VAL 339 Cb 0.22 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 3b78 h VAL 339 CO -0.20 0.49 -0.91 -0.07 0.02 0.00 0.00 177.57 176.90 3b78 h LEU 340 N 0.63 0.00 0.00 2.57 3.38 -1.08 -3.41 115.31 117.40 3b78 h LEU 340 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3b78 h LEU 340 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3b78 h LEU 340 CO 0.08 0.67 -0.92 1.41 0.09 0.00 0.00 178.44 179.78 3b78 n HIS 341 N -3.17 0.00 -2.52 1.13 8.25 0.69 -4.62 115.22 114.97 3b78 n HIS 341 Ca -0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.03 3b78 n HIS 341 Cb 0.83 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.90 3b78 n HIS 341 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3b78 s LEU 342 N -3.71 4.47 0.57 2.41 1.43 -0.82 -5.01 118.68 118.02 3b78 s LEU 342 Ca 0.00 2.05 -0.19 0.00 -1.03 0.00 0.00 54.13 54.96 3b78 s LEU 342 Cb 0.00 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.57 3b78 s LEU 342 CO 0.00 -0.24 1.18 -2.16 0.23 0.00 0.00 176.35 175.37 3b78 s PRO 343 N -0.17 3.15 0.60 1.29 0.04 -1.26 -4.81 135.00 133.84 3b78 s PRO 343 Ca 0.50 1.76 -0.06 0.00 0.04 0.00 0.00 61.00 63.24 3b78 s PRO 343 Cb -0.29 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.27 3b78 s PRO 343 CO 0.34 -1.05 0.92 -1.54 0.04 0.00 0.00 177.00 175.71 3b78 s SER 344 N -1.62 5.54 0.28 6.66 1.04 -1.26 -4.53 113.70 119.81 3b78 s SER 344 Ca 0.75 0.74 0.01 0.00 0.48 0.00 0.00 55.95 57.93 3b78 s SER 344 Cb -0.28 -1.70 0.61 0.00 0.10 0.00 0.00 66.02 64.75 3b78 s SER 344 CO 0.31 -1.11 1.76 -0.65 0.98 0.00 0.00 173.24 174.53 3b78 h PRO 345 N -0.23 0.62 -0.21 4.02 0.11 -1.73 -0.86 132.00 133.71 3b78 h PRO 345 Ca -0.45 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 65.67 3b78 h PRO 345 Cb 1.26 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 3b78 h PRO 345 CO 0.61 0.41 -0.08 0.28 -0.21 0.00 0.00 178.00 179.01 3b78 h VAL 346 N 0.63 0.73 -0.19 3.15 2.07 -1.93 -1.38 116.25 119.33 3b78 h VAL 346 Ca 0.50 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.96 3b78 h VAL 346 Cb 0.76 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 3b78 h VAL 346 CO -0.39 0.00 -0.13 0.74 0.02 0.00 0.00 177.57 177.81 3b78 h THR 347 N -0.04 1.32 -0.17 2.57 2.02 -1.73 -3.30 112.91 113.58 3b78 h THR 347 Ca 0.11 -1.24 -0.07 0.00 0.77 0.00 0.00 66.41 65.97 3b78 h THR 347 Cb 0.20 1.73 -0.00 0.00 -1.74 0.00 0.00 68.15 68.33 3b78 h THR 347 CO -0.24 0.37 -0.16 0.00 0.37 0.00 0.00 175.52 175.86 3b78 h ALA 348 N 0.66 0.25 0.00 6.16 0.00 -1.12 -3.14 119.26 122.07 3b78 h ALA 348 Ca 0.04 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3b78 h ALA 348 Cb 0.65 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3b78 h ALA 348 CO 0.04 0.15 0.00 1.96 0.00 0.00 0.00 179.25 181.40 3b78 h GLN 349 N 0.07 0.00 -0.14 0.00 4.20 -1.37 -1.35 115.11 116.52 3b78 h GLN 349 Ca 0.03 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 3b78 h GLN 349 Cb 0.70 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 3b78 h GLN 349 CO 0.04 0.00 -0.07 0.00 -0.67 0.00 0.00 178.83 178.13 3b78 h ALA 350 N 2.00 1.63 -0.01 3.87 0.00 -1.59 -2.28 119.26 122.89 3b78 h ALA 350 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3b78 h ALA 350 Cb 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3b78 h ALA 350 CO 0.00 0.27 0.00 2.48 0.00 0.00 0.00 179.25 182.00 3b78 n TYR 351 N -4.35 0.01 0.30 0.00 0.18 -0.61 -4.58 117.16 108.12 3b78 n TYR 351 Ca -0.01 -0.03 0.09 0.00 1.88 0.00 0.00 57.90 59.83 3b78 n TYR 351 Cb 0.21 -0.00 -0.13 0.00 -0.38 0.00 0.00 39.34 39.04 3b78 n TYR 351 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 3b78 n ARG 352 N 0.17 0.70 0.30 -3.48 1.74 -0.63 -4.70 116.66 110.76 3b78 n ARG 352 Ca 0.02 -0.11 -0.17 0.00 -0.77 0.00 0.00 57.85 56.82 3b78 n ARG 352 Cb 0.10 -1.42 -0.09 0.00 -1.02 0.00 0.00 32.46 30.03 3b78 n ARG 352 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3b78 h ALA 353 N 2.04 -1.15 -0.68 7.54 0.00 -1.66 -1.84 119.26 123.51 3b78 h ALA 353 Ca 0.00 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 54.86 3b78 h ALA 353 Cb 0.71 0.66 -0.12 0.00 0.00 0.00 0.00 17.79 19.04 3b78 h ALA 353 CO 0.00 -1.16 -0.11 0.93 0.00 0.00 0.00 179.25 178.91 3b78 h GLU 354 N -0.96 0.03 -0.64 0.00 5.08 -1.87 0.10 114.58 116.33 3b78 h GLU 354 Ca -0.07 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 3b78 h GLU 354 Cb 0.82 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.03 3b78 h GLU 354 CO -0.02 0.02 0.37 0.37 -1.00 0.00 0.00 179.01 178.75 3b78 h GLN 355 N 0.03 0.86 -0.06 2.33 4.15 -1.79 -2.49 115.11 118.14 3b78 h GLN 355 Ca 0.34 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.68 3b78 h GLN 355 Cb 0.54 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.05 3b78 h GLN 355 CO -0.66 0.61 0.00 1.28 -1.93 0.00 0.00 178.83 178.13 3b78 n LEU 356 N -4.40 1.67 -4.18 -2.39 4.77 -0.08 -4.68 117.00 107.72 3b78 n LEU 356 Ca 0.06 -0.60 -0.34 0.00 -0.03 0.00 0.00 56.01 55.10 3b78 n LEU 356 Cb 0.08 -0.03 -0.15 0.00 -2.33 0.00 0.00 43.42 40.99 3b78 n LEU 356 CO 0.37 0.30 -0.43 -0.47 -1.33 0.00 0.00 177.39 175.83 3b78 s TYR 357 N -1.94 3.05 0.00 -1.77 5.04 -0.59 -1.03 117.35 120.11 3b78 s TYR 357 Ca 0.36 -1.64 -0.04 0.00 -2.44 0.00 0.00 57.07 53.32 3b78 s TYR 357 Cb 0.20 -2.03 -0.16 0.00 0.35 0.00 0.00 41.96 40.32 3b78 s TYR 357 CO 0.32 -0.75 2.94 0.39 -1.34 0.00 0.00 175.55 177.11 3b78 n GLU 358 N 4.64 1.58 -0.85 4.97 -0.58 -0.92 -4.80 120.64 124.68 3b78 n GLU 358 Ca -0.17 -0.59 0.00 0.00 -0.42 0.00 0.00 57.16 55.98 3b78 n GLU 358 Cb 0.47 -1.59 0.00 0.00 -0.57 0.00 0.00 31.44 29.75 3b78 n GLU 358 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3b78 n GLY 359 N 2.10 2.66 3.68 0.62 0.00 -1.26 -4.69 105.19 108.30 3b78 n GLY 359 Ca 0.25 -1.06 -0.43 0.00 0.00 0.00 0.00 46.02 44.78 3b78 n GLY 359 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3b78 n PRO 360 N 0.00 2.06 0.17 1.61 -0.04 -1.26 -4.91 135.00 132.63 3b78 n PRO 360 Ca 0.00 0.73 0.05 0.00 -0.04 0.00 0.00 63.50 64.23 3b78 n PRO 360 Cb 0.00 -2.32 0.21 0.00 -0.04 0.00 0.00 33.50 31.36 3b78 n PRO 360 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3b78 h ALA 361 N 2.97 0.85 -0.61 0.55 0.00 -1.95 -2.98 119.26 118.09 3b78 h ALA 361 Ca -0.45 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.07 3b78 h ALA 361 Cb 1.28 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3b78 h ALA 361 CO 0.66 0.53 0.00 -0.40 0.00 0.00 0.00 179.25 180.04 3b78 n ASP 362 N -3.37 4.98 -4.73 0.00 5.68 -1.26 -4.42 116.55 113.43 3b78 n ASP 362 Ca 0.01 -2.60 -0.33 0.00 -0.50 0.00 0.00 54.79 51.36 3b78 n ASP 362 Cb 0.60 -0.61 0.09 0.00 -1.14 0.00 0.00 41.12 40.06 3b78 n ASP 362 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3b78 s ASP 363 N -0.83 4.25 0.33 -1.12 2.15 -1.13 -4.84 116.67 115.49 3b78 s ASP 363 Ca 0.51 2.23 0.05 0.00 0.43 0.00 0.00 52.55 55.77 3b78 s ASP 363 Cb 0.35 -2.57 0.59 0.00 -0.30 0.00 0.00 42.92 40.99 3b78 s ASP 363 CO 0.21 -2.22 1.85 0.00 -0.17 0.00 0.00 175.17 174.84 3b78 h ALA 364 N -0.46 1.34 0.08 3.66 0.00 -1.93 -1.01 119.26 120.94 3b78 h ALA 364 Ca -0.47 -0.23 -0.27 0.00 0.00 0.00 0.00 54.91 53.95 3b78 h ALA 364 Cb 1.28 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.95 3b78 h ALA 364 CO 0.50 0.45 -1.13 -0.91 0.00 0.00 0.00 179.25 178.15 3b78 h ASN 365 N 0.45 0.68 -0.22 0.00 4.21 -1.95 -2.02 115.58 116.74 3b78 h ASN 365 Ca 0.09 -0.61 -0.10 0.00 1.21 0.00 0.00 56.30 56.89 3b78 h ASN 365 Cb 0.39 -0.21 -0.02 0.00 -1.12 0.00 0.00 38.32 37.36 3b78 h ASN 365 CO 0.02 1.43 -0.20 0.00 -1.29 0.00 0.00 177.43 177.39 3b78 h ILE 367 N 0.59 1.31 0.00 0.00 2.04 -1.23 -2.07 117.51 118.15 3b78 h ILE 367 Ca 0.09 -1.59 -0.06 0.00 1.00 0.00 0.00 64.86 64.30 3b78 h ILE 367 Cb 0.67 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 38.36 3b78 h ILE 367 CO 0.05 0.49 -0.27 0.00 0.00 0.00 0.00 178.15 178.42 3b78 h ALA 368 N 1.16 1.32 0.13 1.87 0.00 -0.89 -2.22 119.26 120.63 3b78 h ALA 368 Ca 0.03 -0.25 -0.28 0.00 0.00 0.00 0.00 54.91 54.41 3b78 h ALA 368 Cb 0.90 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3b78 h ALA 368 CO 0.08 0.34 -1.29 0.82 0.00 0.00 0.00 179.25 179.20 3b78 h ILE 369 N 0.00 1.45 -0.75 0.00 2.04 -1.03 0.16 117.51 119.38 3b78 h ILE 369 Ca -0.00 -3.02 -0.05 0.00 1.00 0.00 0.00 64.86 62.78 3b78 h ILE 369 Cb 0.57 2.93 -0.03 0.00 -0.74 0.00 0.00 36.82 39.54 3b78 h ILE 369 CO 0.04 0.88 0.27 0.11 0.00 0.00 0.00 178.15 179.44 3b78 h LYS 370 N 0.08 1.15 -0.01 2.37 1.57 -1.09 -2.61 116.57 118.02 3b78 h LYS 370 Ca -0.15 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 3b78 h LYS 370 Cb 1.99 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 34.12 3b78 h LYS 370 CO 0.20 0.95 -0.12 0.09 -0.57 0.00 0.00 179.45 180.00 3b78 n ASN 371 N -4.26 1.17 -3.84 0.86 3.02 -0.86 -3.56 115.26 107.78 3b78 n ASN 371 Ca 0.06 -1.14 -0.24 0.00 -0.03 0.00 0.00 54.58 53.23 3b78 n ASN 371 Cb 0.21 0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 3b78 n ASN 371 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3b78 s ASP 373 N -4.33 6.70 0.29 0.00 -1.08 0.51 -4.80 116.67 113.96 3b78 s ASP 373 Ca 0.02 0.59 0.25 0.00 -0.52 0.00 0.00 52.55 52.90 3b78 s ASP 373 Cb -0.01 -2.55 1.01 0.00 -1.46 0.00 0.00 42.92 39.91 3b78 s ASP 373 CO 0.86 -1.18 1.75 1.55 0.52 0.00 0.00 175.17 178.67 3b78 h PRO 374 N 8.99 0.00 0.00 4.34 0.13 -1.89 0.31 132.00 143.89 3b78 h PRO 374 Ca -0.22 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.63 3b78 h PRO 374 Cb 1.06 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.14 3b78 h PRO 374 CO 1.11 0.00 -1.83 1.63 -0.23 0.00 0.00 178.00 178.68 3b78 n LYS 375 N -2.35 0.65 -0.48 0.86 4.76 -1.26 -3.39 118.16 116.95 3b78 n LYS 375 Ca 0.02 0.18 -0.16 0.00 -2.87 0.00 0.00 58.31 55.48 3b78 n LYS 375 Cb 0.26 -1.72 0.14 0.00 -1.84 0.00 0.00 35.03 31.87 3b78 n LYS 375 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3b78 n ALA 376 N -2.56 -2.03 -1.78 7.82 0.00 -1.22 -4.89 120.51 115.86 3b78 n ALA 376 Ca -0.19 -0.87 -0.41 0.00 0.00 0.00 0.00 53.44 51.97 3b78 n ALA 376 Cb 1.01 -0.06 -0.01 0.00 0.00 0.00 0.00 19.45 20.39 3b78 n ALA 376 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3b78 s ASP 377 N -3.01 6.51 0.24 0.00 1.01 -1.26 -3.93 116.67 116.23 3b78 s ASP 377 Ca 0.38 2.91 -0.31 0.00 0.71 0.00 0.00 52.55 56.24 3b78 s ASP 377 Cb -0.04 -2.66 -0.12 0.00 1.01 0.00 0.00 42.92 41.10 3b78 s ASP 377 CO 0.30 -0.74 1.61 -0.11 0.21 0.00 0.00 175.17 176.43 3b78 n LEU 378 N 0.59 3.92 -3.55 1.23 7.94 -1.26 -3.85 117.00 122.02 3b78 n LEU 378 Ca 0.01 1.11 -0.29 0.00 -1.11 0.00 0.00 56.01 55.73 3b78 n LEU 378 Cb 0.40 -1.54 -0.12 0.00 0.53 0.00 0.00 43.42 42.69 3b78 n LEU 378 CO 0.62 0.02 -0.28 -0.04 -1.11 0.00 0.00 177.39 176.60 3b78 s MET 379 N 0.19 0.99 -0.14 1.96 -1.94 0.23 -3.27 119.30 117.32 3b78 s MET 379 Ca 0.70 -1.86 -0.05 0.00 -1.71 0.00 0.00 55.69 52.78 3b78 s MET 379 Cb -0.54 -1.79 -0.03 0.00 2.01 0.00 0.00 34.83 34.48 3b78 s MET 379 CO 0.42 -1.24 0.02 -1.17 -0.01 0.00 0.00 175.02 173.04 3b78 s LEU 380 N 0.44 3.63 -0.23 -0.03 0.20 -0.13 -0.34 118.68 122.22 3b78 s LEU 380 Ca 0.22 0.07 -0.07 0.00 0.69 0.00 0.00 54.13 55.04 3b78 s LEU 380 Cb -0.16 -1.88 -0.03 0.00 -0.43 0.00 0.00 46.19 43.69 3b78 s LEU 380 CO -0.05 0.25 0.07 -0.47 -0.29 0.00 0.00 176.35 175.86 3b78 s TYR 381 N -0.13 3.13 -0.41 5.38 5.04 0.71 -0.90 117.35 130.17 3b78 s TYR 381 Ca 0.05 -0.24 -0.16 0.00 -2.44 0.00 0.00 57.07 54.29 3b78 s TYR 381 Cb -0.12 -2.19 0.02 0.00 0.35 0.00 0.00 41.96 40.01 3b78 s TYR 381 CO 0.02 -0.19 0.34 0.08 -1.34 0.00 0.00 175.55 174.46 3b78 s VAL 382 N 1.23 5.20 -0.08 3.14 1.01 -0.87 -0.71 120.40 129.31 3b78 s VAL 382 Ca 0.05 -0.52 0.15 0.00 0.00 0.00 0.00 61.98 61.66 3b78 s VAL 382 Cb -0.14 -3.95 -0.16 0.00 0.00 0.00 0.00 36.38 32.12 3b78 s VAL 382 CO 0.04 -0.33 0.84 0.77 0.00 0.00 0.00 175.10 176.42 3b78 h SER 383 N 8.65 0.00 -4.73 3.32 4.64 -1.28 -2.90 113.55 121.24 3b78 h SER 383 Ca -0.27 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.13 3b78 h SER 383 Cb 1.12 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.07 3b78 h SER 383 CO 0.75 0.74 0.43 -1.59 -0.87 0.00 0.00 176.83 176.28 3b78 s LYS 384 N -2.81 0.93 -0.16 4.77 -2.85 -1.15 -4.66 119.74 113.83 3b78 s LYS 384 Ca -0.03 -0.35 -0.07 0.00 -1.00 0.00 0.00 55.97 54.53 3b78 s LYS 384 Cb 0.08 0.43 -0.04 0.00 -2.06 0.00 0.00 37.83 36.24 3b78 s LYS 384 CO 0.81 -0.41 0.09 -1.64 0.10 0.00 0.00 175.35 174.30 3b78 s MET 385 N -3.27 3.75 -0.17 1.78 -1.94 -1.26 -1.12 119.30 117.08 3b78 s MET 385 Ca 0.04 -0.27 -0.02 0.00 -1.71 0.00 0.00 55.69 53.73 3b78 s MET 385 Cb -0.01 -3.19 -0.02 0.00 2.01 0.00 0.00 34.83 33.62 3b78 s MET 385 CO -0.10 0.47 -0.08 0.08 -0.01 0.00 0.00 175.02 175.39 3b78 s VAL 386 N -0.17 3.38 0.37 -6.03 1.01 0.22 -4.91 120.40 114.27 3b78 s VAL 386 Ca 0.09 -0.52 -0.28 0.00 0.00 0.00 0.00 61.98 61.26 3b78 s VAL 386 Cb -0.12 -2.48 -0.11 0.00 0.00 0.00 0.00 36.38 33.67 3b78 s VAL 386 CO 0.01 0.48 1.50 -2.84 0.00 0.00 0.00 175.10 174.26 3b78 s PRO 387 N 0.72 4.10 0.26 2.72 0.02 -1.26 -1.01 135.00 140.56 3b78 s PRO 387 Ca -0.04 2.58 0.04 0.00 0.02 0.00 0.00 61.00 63.60 3b78 s PRO 387 Cb -0.15 -2.97 -0.06 0.00 0.02 0.00 0.00 34.50 31.34 3b78 s PRO 387 CO 0.02 -0.55 0.02 0.95 -0.33 0.00 0.00 177.00 177.11 3b78 s THR 388 N -0.98 1.07 -0.87 0.99 -4.23 -1.15 -2.47 115.64 108.00 3b78 s THR 388 Ca 0.54 -2.03 0.26 0.00 -1.18 0.00 0.00 61.69 59.29 3b78 s THR 388 Cb -0.47 -2.51 0.14 0.00 1.34 0.00 0.00 72.50 71.00 3b78 s THR 388 CO 0.62 -0.19 1.62 -1.54 -0.54 0.00 0.00 174.62 174.58 3b78 n SER 389 N -0.51 0.45 -4.58 3.99 3.41 -0.21 -4.56 113.62 111.61 3b78 n SER 389 Ca -0.04 0.22 -0.30 0.00 -0.26 0.00 0.00 58.87 58.50 3b78 n SER 389 Cb 0.65 -0.20 -0.06 0.00 -0.26 0.00 0.00 64.21 64.34 3b78 n SER 389 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3b78 s ASP 390 N -3.58 5.20 0.80 4.04 2.15 -1.26 -4.83 116.67 119.19 3b78 s ASP 390 Ca 0.11 -1.72 0.00 0.00 0.43 0.00 0.00 52.55 51.37 3b78 s ASP 390 Cb 0.16 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 3b78 s ASP 390 CO 0.63 -2.90 0.00 0.29 -0.17 0.00 0.00 175.17 173.03 3b78 n LYS 391 N 8.31 0.00 -0.45 4.34 5.02 -1.26 -2.53 118.16 131.58 3b78 n LYS 391 Ca 0.45 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.84 3b78 n LYS 391 Cb 0.47 0.00 0.32 0.00 -0.02 0.00 0.00 35.03 35.79 3b78 n LYS 391 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3b78 n GLY 392 N 0.00 2.35 3.78 0.72 0.00 -1.26 -4.75 105.19 106.03 3b78 n GLY 392 Ca 0.00 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 3b78 n GLY 392 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3b78 s ARG 393 N -1.42 2.90 -0.03 1.61 1.81 -1.05 -4.89 118.95 117.89 3b78 s ARG 393 Ca 0.47 1.38 0.06 0.00 -1.72 0.00 0.00 55.73 55.91 3b78 s ARG 393 Cb 0.27 -1.96 -0.02 0.00 -0.45 0.00 0.00 34.95 32.78 3b78 s ARG 393 CO 0.28 -1.17 -0.19 -0.06 -0.68 0.00 0.00 175.30 173.48 3b78 s PHE 394 N -2.32 2.54 -0.08 -0.53 0.08 -1.26 -2.95 117.98 113.46 3b78 s PHE 394 Ca 0.67 -0.28 -0.13 0.00 0.12 0.00 0.00 56.93 57.31 3b78 s PHE 394 Cb -0.20 -1.56 -0.05 0.00 -0.57 0.00 0.00 43.02 40.64 3b78 s PHE 394 CO 0.40 0.10 0.32 0.71 -0.10 0.00 0.00 175.22 176.65 3b78 s TYR 395 N -0.70 3.62 -0.32 0.36 2.02 -0.18 -4.18 117.35 117.97 3b78 s TYR 395 Ca 0.11 0.78 -0.29 0.00 -0.37 0.00 0.00 57.07 57.30 3b78 s TYR 395 Cb -0.10 -2.24 0.01 0.00 -0.40 0.00 0.00 41.96 39.23 3b78 s TYR 395 CO 0.00 0.54 1.14 0.00 -1.57 0.00 0.00 175.55 175.66 3b78 s ALA 396 N -0.58 3.45 -0.13 3.71 0.00 -0.29 -0.61 121.76 127.32 3b78 s ALA 396 Ca 0.20 -0.03 -0.10 0.00 0.00 0.00 0.00 51.96 52.03 3b78 s ALA 396 Cb -0.15 -3.71 -0.05 0.00 0.00 0.00 0.00 23.12 19.22 3b78 s ALA 396 CO 0.09 -1.60 0.20 0.12 0.00 0.00 0.00 175.76 174.56 3b78 s PHE 397 N 3.88 3.54 0.00 0.00 5.36 -0.28 -0.26 117.98 130.23 3b78 s PHE 397 Ca 0.49 0.55 0.00 0.00 -0.96 0.00 0.00 56.93 57.00 3b78 s PHE 397 Cb -0.13 -2.11 0.00 0.00 -0.34 0.00 0.00 43.02 40.44 3b78 s PHE 397 CO 0.18 0.53 0.00 0.41 -1.46 0.00 0.00 175.22 174.88 3b78 n GLY 398 N 2.59 1.55 3.16 13.12 0.00 -0.70 -0.93 105.19 123.98 3b78 n GLY 398 Ca -0.17 -0.41 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 3b78 n GLY 398 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3b78 s ARG 399 N 1.69 0.32 -0.29 1.61 3.52 0.11 -1.59 118.95 124.32 3b78 s ARG 399 Ca 0.00 0.42 -0.23 0.00 -0.13 0.00 0.00 55.73 55.78 3b78 s ARG 399 Cb 0.00 0.13 -0.00 0.00 -1.56 0.00 0.00 34.95 33.51 3b78 s ARG 399 CO 0.00 -0.06 0.79 0.08 -0.81 0.00 0.00 175.30 175.30 3b78 s VAL 400 N 0.30 4.82 -0.10 7.11 1.01 -0.63 -0.21 120.40 132.70 3b78 s VAL 400 Ca -0.01 1.28 0.21 0.00 0.00 0.00 0.00 61.98 63.45 3b78 s VAL 400 Cb -0.03 -4.12 -0.24 0.00 0.00 0.00 0.00 36.38 31.99 3b78 s VAL 400 CO -0.01 -0.18 0.56 0.49 0.00 0.00 0.00 175.10 175.96 3b78 n PHE 401 N 6.12 0.29 -3.66 5.22 3.72 0.54 0.81 117.46 130.50 3b78 n PHE 401 Ca 0.04 0.09 -0.15 0.00 -0.05 0.00 0.00 57.45 57.37 3b78 n PHE 401 Cb 0.48 -0.72 -0.08 0.00 -0.94 0.00 0.00 39.48 38.22 3b78 n PHE 401 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3b78 s ALA 402 N -3.28 -1.21 0.00 4.37 0.00 -1.10 -4.41 121.76 116.13 3b78 s ALA 402 Ca -0.06 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.67 3b78 s ALA 402 Cb 0.11 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.26 3b78 s ALA 402 CO 0.87 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.73 3b78 n GLY 403 N 1.14 -0.91 2.93 0.00 0.00 0.11 -0.60 105.19 107.86 3b78 n GLY 403 Ca -0.20 -1.14 -0.19 0.00 0.00 0.00 0.00 46.02 44.48 3b78 n GLY 403 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3b78 s THR 404 N 0.00 0.54 0.14 2.61 -4.23 -1.22 -1.26 115.64 112.23 3b78 s THR 404 Ca 0.00 -0.18 -0.20 0.00 -1.18 0.00 0.00 61.69 60.13 3b78 s THR 404 Cb 0.00 -0.53 -0.07 0.00 1.34 0.00 0.00 72.50 73.24 3b78 s THR 404 CO 0.00 0.20 0.65 0.54 -0.54 0.00 0.00 174.62 175.47 3b78 s VAL 405 N 0.54 4.64 0.03 2.29 0.11 -0.76 -4.84 120.40 122.42 3b78 s VAL 405 Ca -0.07 1.26 0.02 0.00 -2.93 0.00 0.00 61.98 60.26 3b78 s VAL 405 Cb -0.11 -3.91 -0.02 0.00 -1.53 0.00 0.00 36.38 30.82 3b78 s VAL 405 CO 0.00 0.40 -0.08 -0.54 -3.33 0.00 0.00 175.10 171.56 3b78 s LYS 406 N -1.50 0.52 0.09 1.54 1.02 -1.26 -1.03 119.74 119.13 3b78 s LYS 406 Ca 0.36 -0.66 -0.31 0.00 0.02 0.00 0.00 55.97 55.38 3b78 s LYS 406 Cb -0.19 -0.34 -0.08 0.00 -0.52 0.00 0.00 37.83 36.70 3b78 s LYS 406 CO 0.21 0.07 1.60 -1.12 -0.92 0.00 0.00 175.35 175.19 3b78 s SER 407 N -1.32 6.63 0.00 2.83 0.01 -0.33 -2.00 113.70 119.52 3b78 s SER 407 Ca -0.08 2.48 0.00 0.00 1.31 0.00 0.00 55.95 59.66 3b78 s SER 407 Cb -0.09 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.57 3b78 s SER 407 CO 0.00 -0.85 0.00 0.61 0.41 0.00 0.00 173.24 173.41 3b78 n GLY 408 N 3.89 3.07 3.66 3.44 0.00 0.21 -5.02 105.19 114.45 3b78 n GLY 408 Ca 0.15 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.67 3b78 n GLY 408 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3b78 n GLN 409 N -0.81 1.76 -2.71 1.61 7.27 -0.84 -4.28 117.38 119.37 3b78 n GLN 409 Ca 0.00 0.64 -0.42 0.00 0.07 0.00 0.00 57.00 57.29 3b78 n GLN 409 Cb 0.00 -2.39 -0.03 0.00 2.41 0.00 0.00 30.24 30.23 3b78 n GLN 409 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 3b78 s LYS 410 N 2.28 4.51 0.27 3.69 1.02 -1.26 -1.63 119.74 128.62 3b78 s LYS 410 Ca 0.88 1.40 0.08 0.00 0.02 0.00 0.00 55.97 58.35 3b78 s LYS 410 Cb -0.82 -3.49 -0.06 0.00 -0.52 0.00 0.00 37.83 32.95 3b78 s LYS 410 CO 0.49 -0.13 -0.10 0.14 -0.92 0.00 0.00 175.35 174.82 3b78 s VAL 411 N 1.33 1.88 -0.48 3.17 -7.23 0.13 -4.96 120.40 114.24 3b78 s VAL 411 Ca 0.51 -2.20 -0.18 0.00 -1.81 0.00 0.00 61.98 58.30 3b78 s VAL 411 Cb -0.20 -2.37 0.06 0.00 0.56 0.00 0.00 36.38 34.43 3b78 s VAL 411 CO 0.25 -0.36 0.52 -0.13 -0.31 0.00 0.00 175.10 175.06 3b78 s ARG 412 N -3.66 3.06 -0.61 4.82 0.52 -0.60 -2.35 118.95 120.13 3b78 s ARG 412 Ca 0.29 -1.05 -0.24 0.00 -0.52 0.00 0.00 55.73 54.20 3b78 s ARG 412 Cb 0.01 -4.09 0.05 0.00 0.52 0.00 0.00 34.95 31.44 3b78 s ARG 412 CO 0.12 -1.10 1.01 0.42 0.02 0.00 0.00 175.30 175.77 3b78 s ILE 413 N 2.20 4.26 -0.39 1.52 1.01 -0.01 -2.05 121.20 127.74 3b78 s ILE 413 Ca 0.11 0.17 -0.15 0.00 0.00 0.00 0.00 60.65 60.77 3b78 s ILE 413 Cb -0.21 -4.64 0.01 0.00 0.01 0.00 0.00 42.46 37.63 3b78 s ILE 413 CO 0.10 -1.32 0.32 -1.10 0.00 0.00 0.00 174.94 172.94 3b78 s GLN 414 N 4.28 3.16 1.13 2.79 -0.21 0.04 -1.98 119.66 128.86 3b78 s GLN 414 Ca 0.30 -0.84 -0.17 0.00 0.02 0.00 0.00 55.36 54.67 3b78 s GLN 414 Cb -0.13 -3.93 0.26 0.00 1.00 0.00 0.00 33.01 30.21 3b78 s GLN 414 CO 0.17 -0.69 1.13 0.20 -2.12 0.00 0.00 175.29 173.98 3b78 s GLY 415 N 1.72 1.60 0.20 3.09 0.00 -0.20 -1.62 107.32 112.10 3b78 s GLY 415 Ca 0.07 -0.87 -0.11 0.00 0.00 0.00 0.00 44.72 43.82 3b78 s GLY 415 CO 0.11 -0.05 1.78 -2.55 0.00 0.00 0.00 173.10 172.39 3b78 h PRO 416 N -2.33 0.51 -0.15 2.90 0.11 -1.87 -2.24 132.00 128.93 3b78 h PRO 416 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3b78 h PRO 416 Cb 1.30 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3b78 h PRO 416 CO 0.40 0.34 0.00 0.09 -0.21 0.00 0.00 178.00 178.62 3b78 n ASN 417 N -4.89 1.08 -4.77 -2.05 3.02 -1.26 -4.91 115.26 101.48 3b78 n ASN 417 Ca 0.07 -1.77 -0.38 0.00 -0.03 0.00 0.00 54.58 52.47 3b78 n ASN 417 Cb 0.19 -0.10 -0.02 0.00 -0.61 0.00 0.00 39.78 39.24 3b78 n ASN 417 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3b78 s TYR 418 N -1.80 3.06 -0.06 3.10 5.04 -0.85 -4.83 117.35 121.01 3b78 s TYR 418 Ca 0.24 1.56 -0.03 0.00 -2.44 0.00 0.00 57.07 56.40 3b78 s TYR 418 Cb 0.12 -3.37 0.04 0.00 0.35 0.00 0.00 41.96 39.10 3b78 s TYR 418 CO 0.18 -1.28 0.13 0.08 -1.34 0.00 0.00 175.55 173.33 3b78 s VAL 419 N -1.45 -0.05 -0.27 3.14 1.01 -1.26 -4.80 120.40 116.71 3b78 s VAL 419 Ca 0.58 0.19 -0.34 0.00 0.00 0.00 0.00 61.98 62.41 3b78 s VAL 419 Cb -0.30 -0.23 -0.10 0.00 0.00 0.00 0.00 36.38 35.76 3b78 s VAL 419 CO 0.37 0.08 2.12 -2.65 0.00 0.00 0.00 175.10 175.02 3b78 n PRO 420 N 4.23 1.45 0.00 2.72 -0.02 -1.26 -2.22 135.00 139.90 3b78 n PRO 420 Ca -0.26 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 3b78 n PRO 420 Cb 0.51 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 3b78 n PRO 420 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3b78 n GLY 421 N 5.91 2.86 3.78 -1.23 0.00 -1.26 -5.10 105.19 110.15 3b78 n GLY 421 Ca 0.35 -0.55 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 3b78 n GLY 421 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3b78 s LYS 422 N 0.00 1.60 -0.15 1.61 3.01 -0.94 -4.98 119.74 119.89 3b78 s LYS 422 Ca 0.00 0.55 0.16 0.00 -1.01 0.00 0.00 55.97 55.67 3b78 s LYS 422 Cb 0.00 -1.87 0.50 0.00 -1.01 0.00 0.00 37.83 35.45 3b78 s LYS 422 CO 0.00 -1.94 1.41 1.63 0.51 0.00 0.00 175.35 176.96 3b78 n LYS 423 N -3.64 2.99 -2.37 1.68 5.02 -1.26 -4.74 118.16 115.85 3b78 n LYS 423 Ca 0.07 -2.72 -0.41 0.00 -2.02 0.00 0.00 58.31 53.23 3b78 n LYS 423 Cb 0.57 -1.76 -0.03 0.00 -0.02 0.00 0.00 35.03 33.79 3b78 n LYS 423 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3b78 s ASP 424 N -1.72 7.07 -1.13 4.39 1.01 -1.26 -3.51 116.67 121.52 3b78 s ASP 424 Ca 0.39 2.22 -0.07 0.00 0.71 0.00 0.00 52.55 55.81 3b78 s ASP 424 Cb 0.31 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.64 3b78 s ASP 424 CO 0.10 -0.40 0.98 -0.67 0.21 0.00 0.00 175.17 175.40 3b78 n ASP 425 N 2.72 -5.24 -4.12 0.27 -0.08 -1.26 -4.20 116.55 104.64 3b78 n ASP 425 Ca 0.05 -0.46 -0.24 0.00 -1.51 0.00 0.00 54.79 52.63 3b78 n ASP 425 Cb 0.45 -4.33 -0.15 0.00 2.34 0.00 0.00 41.12 39.42 3b78 n ASP 425 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 3b78 s LEU 426 N -6.24 1.98 -0.17 -2.67 2.96 -1.23 -1.03 118.68 112.29 3b78 s LEU 426 Ca 0.43 -0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 54.02 3b78 s LEU 426 Cb -0.19 -0.80 0.08 0.00 0.50 0.00 0.00 46.19 45.77 3b78 s LEU 426 CO 0.61 0.17 0.18 -0.36 -1.32 0.00 0.00 176.35 175.64 3b78 s PHE 427 N -0.23 -0.17 -0.97 5.38 0.08 -0.84 -5.00 117.98 116.23 3b78 s PHE 427 Ca 0.03 0.24 -0.15 0.00 0.12 0.00 0.00 56.93 57.17 3b78 s PHE 427 Cb -0.07 -0.39 0.19 0.00 -0.57 0.00 0.00 43.02 42.18 3b78 s PHE 427 CO 0.00 -0.50 1.05 0.42 -0.10 0.00 0.00 175.22 176.09 3b78 s ILE 428 N 2.29 5.28 0.30 0.64 1.01 -1.26 -0.83 121.20 128.63 3b78 s ILE 428 Ca 0.05 -2.34 0.01 0.00 0.00 0.00 0.00 60.65 58.36 3b78 s ILE 428 Cb -0.15 -4.67 0.01 0.00 0.01 0.00 0.00 42.46 37.66 3b78 s ILE 428 CO -0.10 -1.31 0.05 0.29 0.00 0.00 0.00 174.94 173.87 3b78 n LYS 429 N 4.92 1.24 -4.91 2.79 4.76 -0.99 -4.89 118.16 121.08 3b78 n LYS 429 Ca 0.23 -2.11 -0.32 0.00 -2.87 0.00 0.00 58.31 53.24 3b78 n LYS 429 Cb 0.46 0.50 -0.13 0.00 -1.84 0.00 0.00 35.03 34.01 3b78 n LYS 429 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3b78 s ALA 430 N -2.50 2.56 -0.27 7.82 0.00 -1.26 0.19 121.76 128.30 3b78 s ALA 430 Ca 0.04 -1.06 -0.29 0.00 0.00 0.00 0.00 51.96 50.64 3b78 s ALA 430 Cb -0.00 -0.83 0.01 0.00 0.00 0.00 0.00 23.12 22.29 3b78 s ALA 430 CO 0.02 0.56 1.18 0.42 0.00 0.00 0.00 175.76 177.94 3b78 s ILE 431 N -0.76 4.37 0.00 0.00 -1.09 -0.65 -4.94 121.20 118.13 3b78 s ILE 431 Ca 0.12 1.59 0.00 0.00 -2.23 0.00 0.00 60.65 60.13 3b78 s ILE 431 Cb -0.10 -4.24 0.00 0.00 -1.58 0.00 0.00 42.46 36.53 3b78 s ILE 431 CO 0.02 -0.38 0.74 0.00 -1.23 0.00 0.00 174.94 174.08 3b78 n GLN 432 N 6.90 0.00 -3.93 2.79 6.02 -0.75 0.67 117.38 129.08 3b78 n GLN 432 Ca 0.13 0.40 -0.15 0.00 -0.01 0.00 0.00 57.00 57.37 3b78 n GLN 432 Cb 0.46 -1.24 -0.15 0.00 1.02 0.00 0.00 30.24 30.34 3b78 n GLN 432 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3b78 s ARG 433 N -1.95 0.18 -0.17 -1.09 0.52 -1.25 -3.46 118.95 111.73 3b78 s ARG 433 Ca 0.00 0.02 -0.18 0.00 -0.52 0.00 0.00 55.73 55.05 3b78 s ARG 433 Cb 0.00 -0.29 -0.04 0.00 0.52 0.00 0.00 34.95 35.15 3b78 s ARG 433 CO 0.00 -0.05 0.50 0.08 0.02 0.00 0.00 175.30 175.85 3b78 s VAL 434 N 0.50 5.14 0.07 3.52 1.01 -1.26 -1.59 120.40 127.79 3b78 s VAL 434 Ca -0.05 0.95 0.07 0.00 0.00 0.00 0.00 61.98 62.95 3b78 s VAL 434 Cb -0.07 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 3b78 s VAL 434 CO -0.01 0.23 -0.18 0.68 0.00 0.00 0.00 175.10 175.82 3b78 s VAL 435 N 1.27 1.41 0.10 2.92 -7.23 -0.65 -0.32 120.40 117.91 3b78 s VAL 435 Ca 0.25 -1.33 -0.27 0.00 -1.81 0.00 0.00 61.98 58.82 3b78 s VAL 435 Cb -0.15 -1.29 -0.06 0.00 0.56 0.00 0.00 36.38 35.43 3b78 s VAL 435 CO 0.10 -0.06 0.86 -0.76 -0.31 0.00 0.00 175.10 174.93 3b78 s LEU 436 N -1.62 4.50 -0.97 1.32 1.43 0.13 -1.26 118.68 122.21 3b78 s LEU 436 Ca 0.03 1.65 -0.10 0.00 -1.03 0.00 0.00 54.13 54.68 3b78 s LEU 436 Cb -0.09 -3.42 0.25 0.00 0.03 0.00 0.00 46.19 42.96 3b78 s LEU 436 CO 0.03 0.02 0.94 -0.04 0.23 0.00 0.00 176.35 177.52 3b78 s MET 437 N -0.25 3.86 -1.38 1.70 -1.94 -1.26 -1.86 119.30 118.17 3b78 s MET 437 Ca 0.42 -2.92 -0.12 0.00 -1.71 0.00 0.00 55.69 51.36 3b78 s MET 437 Cb -0.22 -4.44 0.10 0.00 2.01 0.00 0.00 34.83 32.27 3b78 s MET 437 CO 0.27 -1.26 2.09 -1.33 -0.01 0.00 0.00 175.02 174.78 3b78 n MET 438 N 3.17 3.26 0.00 2.03 0.00 -0.85 -4.53 117.12 120.21 3b78 n MET 438 Ca 0.19 -3.03 0.00 0.00 0.00 0.00 0.00 57.70 54.86 3b78 n MET 438 Cb 0.42 -3.10 0.00 0.00 0.00 0.00 0.00 33.22 30.54 3b78 n MET 438 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3b78 n GLY 439 N 3.44 1.23 0.31 3.03 0.00 -0.33 -2.34 105.19 110.53 3b78 n GLY 439 Ca 0.47 0.24 0.12 0.00 0.00 0.00 0.00 46.02 46.86 3b78 n GLY 439 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3b78 n ARG 440 N 0.00 0.91 -4.40 1.61 1.74 -1.26 -3.61 116.66 111.65 3b78 n ARG 440 Ca 0.00 -0.63 -0.27 0.00 -0.77 0.00 0.00 57.85 56.19 3b78 n ARG 440 Cb 0.00 -1.49 -0.09 0.00 -1.02 0.00 0.00 32.46 29.86 3b78 n ARG 440 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3b78 s PHE 441 N -2.52 2.55 -0.02 -1.55 0.08 -0.99 -0.61 117.98 114.92 3b78 s PHE 441 Ca 0.22 -0.63 0.02 0.00 0.12 0.00 0.00 56.93 56.65 3b78 s PHE 441 Cb 0.19 -1.86 0.01 0.00 -0.57 0.00 0.00 43.02 40.78 3b78 s PHE 441 CO 0.55 0.33 -0.06 0.08 -0.10 0.00 0.00 175.22 176.01 3b78 s VAL 442 N -2.66 0.60 -0.20 -0.44 1.01 -1.25 -2.00 120.40 115.45 3b78 s VAL 442 Ca 0.38 -0.24 -0.00 0.00 0.00 0.00 0.00 61.98 62.11 3b78 s VAL 442 Cb 0.07 -0.55 0.05 0.00 0.00 0.00 0.00 36.38 35.95 3b78 s VAL 442 CO 0.20 0.20 -0.03 -1.61 0.00 0.00 0.00 175.10 173.86 3b78 s GLU 443 N 0.33 1.34 0.31 2.72 0.41 -0.78 -4.94 118.70 118.10 3b78 s GLU 443 Ca -0.04 -0.72 -0.29 0.00 -0.41 0.00 0.00 54.97 53.51 3b78 s GLU 443 Cb -0.09 -2.31 -0.10 0.00 -1.78 0.00 0.00 34.13 29.85 3b78 s GLU 443 CO 0.00 -0.56 1.38 -2.14 -0.49 0.00 0.00 175.26 173.45 3b78 s PRO 444 N 1.58 4.28 0.12 0.39 0.02 -1.26 0.19 135.00 140.31 3b78 s PRO 444 Ca -0.03 2.31 -0.01 0.00 0.02 0.00 0.00 61.00 63.30 3b78 s PRO 444 Cb -0.17 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.24 3b78 s PRO 444 CO -0.07 -0.33 0.03 0.96 -0.33 0.00 0.00 177.00 177.27 3b78 s ILE 445 N -0.78 0.18 -0.01 2.83 -4.36 0.57 -4.89 121.20 114.74 3b78 s ILE 445 Ca 0.53 -1.90 -0.08 0.00 -0.26 0.00 0.00 60.65 58.94 3b78 s ILE 445 Cb -0.42 -1.94 -0.04 0.00 1.25 0.00 0.00 42.46 41.31 3b78 s ILE 445 CO 0.52 -0.58 0.63 -0.78 0.24 0.00 0.00 174.94 174.97 3b78 h ASP 446 N 2.91 -0.24 -2.44 4.36 -0.00 -1.96 -3.37 116.42 115.69 3b78 h ASP 446 Ca -0.35 0.01 0.00 0.00 -0.00 0.00 0.00 57.03 56.69 3b78 h ASP 446 Cb 1.19 0.06 0.00 0.00 -0.00 0.00 0.00 39.33 40.58 3b78 h ASP 446 CO 0.61 -0.07 0.00 -0.90 -0.00 0.00 0.00 179.24 178.88 3b78 n ASP 447 N -3.31 0.95 -3.15 2.28 5.75 -1.26 -1.19 116.55 116.62 3b78 n ASP 447 Ca -0.04 -0.98 0.05 0.00 -0.01 0.00 0.00 54.79 53.81 3b78 n ASP 447 Cb 0.11 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.19 3b78 n ASP 447 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3b78 s PRO 449 N 2.91 0.39 0.49 0.00 0.04 -1.26 -1.82 135.00 135.75 3b78 s PRO 449 Ca 0.14 1.04 -0.23 0.00 0.04 0.00 0.00 61.00 61.99 3b78 s PRO 449 Cb -0.08 -1.69 -0.06 0.00 0.04 0.00 0.00 34.50 32.70 3b78 s PRO 449 CO -0.19 -2.90 1.24 0.00 0.04 0.00 0.00 177.00 175.19 3b78 s ALA 450 N -2.68 2.93 0.00 8.56 0.00 -0.39 -3.59 121.76 126.59 3b78 s ALA 450 Ca 0.66 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.70 3b78 s ALA 450 Cb -0.22 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.45 3b78 s ALA 450 CO 0.60 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.85 3b78 n GLY 451 N 0.55 0.74 3.77 0.00 0.00 0.24 -4.92 105.19 105.58 3b78 n GLY 451 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 3b78 n GLY 451 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3b78 s ASN 452 N -1.92 5.46 0.13 1.61 0.01 -1.24 -4.77 114.94 114.23 3b78 s ASN 452 Ca 0.00 -0.06 -0.21 0.00 -0.71 0.00 0.00 52.86 51.88 3b78 s ASN 452 Cb 0.00 -1.44 -0.07 0.00 0.41 0.00 0.00 41.25 40.15 3b78 s ASN 452 CO 0.00 0.15 0.67 -0.63 -1.51 0.00 0.00 177.10 175.78 3b78 s ILE 453 N -1.46 4.57 0.23 0.60 -1.09 -1.26 -1.60 121.20 121.19 3b78 s ILE 453 Ca 0.29 1.40 -0.17 0.00 -2.23 0.00 0.00 60.65 59.94 3b78 s ILE 453 Cb -0.12 -3.98 0.02 0.00 -1.58 0.00 0.00 42.46 36.80 3b78 s ILE 453 CO 0.22 0.48 0.56 -0.51 -1.23 0.00 0.00 174.94 174.46 3b78 s ILE 454 N -1.20 0.01 0.21 2.92 1.10 -0.62 -4.89 121.20 118.73 3b78 s ILE 454 Ca 0.34 -0.98 0.11 0.00 -0.51 0.00 0.00 60.65 59.61 3b78 s ILE 454 Cb -0.20 -1.83 -0.04 0.00 0.15 0.00 0.00 42.46 40.54 3b78 s ILE 454 CO 0.22 -0.06 -0.20 -0.83 -2.11 0.00 0.00 174.94 171.96 3b78 s GLY 455 N -2.92 1.75 0.03 1.50 0.00 -0.39 -1.73 107.32 105.56 3b78 s GLY 455 Ca 0.13 -1.66 0.04 0.00 0.00 0.00 0.00 44.72 43.23 3b78 s GLY 455 CO 0.02 -1.70 -0.13 1.08 0.00 0.00 0.00 173.10 172.37 3b78 s LEU 456 N -2.88 2.13 -0.10 0.66 1.43 0.65 -1.63 118.68 118.94 3b78 s LEU 456 Ca 0.23 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 3b78 s LEU 456 Cb -0.07 -0.60 -0.02 0.00 0.03 0.00 0.00 46.19 45.53 3b78 s LEU 456 CO 0.12 0.06 -0.12 -0.69 0.23 0.00 0.00 176.35 175.95 3b78 s VAL 457 N -0.71 3.20 0.00 -1.59 1.01 -0.62 -1.13 120.40 120.56 3b78 s VAL 457 Ca 0.02 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.37 3b78 s VAL 457 Cb -0.07 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.99 3b78 s VAL 457 CO 0.01 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.27 3b78 n GLY 458 N 3.01 0.58 0.00 4.51 0.00 -1.26 -1.81 105.19 110.22 3b78 n GLY 458 Ca -0.18 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3b78 n GLY 458 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3b78 n ILE 459 N -0.78 0.00 0.12 -0.61 5.41 -1.26 -4.70 119.36 117.54 3b78 n ILE 459 Ca 0.00 -0.01 0.08 0.00 1.00 0.00 0.00 62.75 63.82 3b78 n ILE 459 Cb 0.29 0.51 0.43 0.00 -0.71 0.00 0.00 39.64 40.15 3b78 n ILE 459 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 3b78 n ASP 460 N -0.07 0.40 -0.86 4.38 5.75 -1.26 -0.96 116.55 123.93 3b78 n ASP 460 Ca 0.00 0.69 0.12 0.00 -0.01 0.00 0.00 54.79 55.59 3b78 n ASP 460 Cb 0.00 -0.74 0.22 0.00 -1.03 0.00 0.00 41.12 39.57 3b78 n ASP 460 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3b78 n GLN 461 N -2.05 2.18 0.00 0.11 10.64 -1.26 -4.23 117.38 122.78 3b78 n GLN 461 Ca -0.01 -1.73 0.00 0.00 -1.83 0.00 0.00 57.00 53.43 3b78 n GLN 461 Cb 0.03 -1.47 0.00 0.00 -0.86 0.00 0.00 30.24 27.94 3b78 n GLN 461 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 3b78 n PHE 462 N 1.07 0.00 -4.27 2.61 3.72 -0.14 -4.99 117.46 115.46 3b78 n PHE 462 Ca 0.16 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.22 3b78 n PHE 462 Cb 0.54 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.94 3b78 n PHE 462 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3b78 s LEU 463 N -3.68 3.03 -0.06 4.37 1.43 -0.63 -4.90 118.68 118.23 3b78 s LEU 463 Ca 0.00 -0.26 -0.27 0.00 -1.03 0.00 0.00 54.13 52.57 3b78 s LEU 463 Cb 0.00 -1.74 -0.22 0.00 0.03 0.00 0.00 46.19 44.25 3b78 s LEU 463 CO 0.00 0.09 1.08 0.25 0.23 0.00 0.00 176.35 178.00 3b78 h LEU 464 N 7.28 0.02 0.00 1.79 5.85 -1.89 -3.41 115.31 124.94 3b78 h LEU 464 Ca -0.34 -0.68 0.00 0.00 0.84 0.00 0.00 57.88 57.70 3b78 h LEU 464 Cb 1.18 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.21 3b78 h LEU 464 CO 0.60 0.70 0.00 0.29 -0.34 0.00 0.00 178.44 179.69 3b78 n LYS 465 N -4.75 0.00 -4.06 1.25 5.02 -1.26 -4.75 118.16 109.61 3b78 n LYS 465 Ca -0.09 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 55.92 3b78 n LYS 465 Cb 0.34 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.30 3b78 n LYS 465 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3b78 s THR 466 N -1.34 4.52 -0.04 -0.18 2.01 -1.26 -3.81 115.64 115.55 3b78 s THR 466 Ca 0.00 -0.93 -0.30 0.00 0.31 0.00 0.00 61.69 60.77 3b78 s THR 466 Cb 0.00 -3.25 0.11 0.00 0.01 0.00 0.00 72.50 69.36 3b78 s THR 466 CO 0.00 -0.00 1.32 -0.83 -0.69 0.00 0.00 174.62 174.41 3b78 s GLY 467 N -2.79 -0.23 -0.06 4.40 0.00 -1.10 -4.50 107.32 103.04 3b78 s GLY 467 Ca 0.30 0.27 0.02 0.00 0.00 0.00 0.00 44.72 45.31 3b78 s GLY 467 CO 0.23 4.29 -0.10 -1.59 0.00 0.00 0.00 173.10 175.93 3b78 s THR 468 N -2.09 0.97 -0.19 0.90 2.01 -0.64 -2.04 115.64 114.55 3b78 s THR 468 Ca 0.26 -0.37 -0.07 0.00 0.31 0.00 0.00 61.69 61.82 3b78 s THR 468 Cb 0.01 -0.91 -0.04 0.00 0.01 0.00 0.00 72.50 71.58 3b78 s THR 468 CO -0.02 0.32 0.05 -0.76 -0.69 0.00 0.00 174.62 173.51 3b78 s LEU 469 N 0.77 3.62 0.00 4.42 1.02 -0.08 -0.78 118.68 127.66 3b78 s LEU 469 Ca -0.13 -0.03 0.05 0.00 0.02 0.00 0.00 54.13 54.04 3b78 s LEU 469 Cb -0.15 -1.92 -0.02 0.00 0.02 0.00 0.00 46.19 44.12 3b78 s LEU 469 CO 0.02 0.12 0.17 0.35 0.02 0.00 0.00 176.35 177.04 3b78 n THR 470 N 3.87 0.00 -0.71 5.49 -2.24 -0.87 -0.96 114.28 118.87 3b78 n THR 470 Ca -0.17 -2.01 0.00 0.00 -2.27 0.00 0.00 64.05 59.60 3b78 n THR 470 Cb 0.52 0.85 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 3b78 n THR 470 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3b78 n THR 471 N -0.66 0.00 -3.75 4.28 -2.24 -1.20 -1.56 114.28 109.15 3b78 n THR 471 Ca 0.00 -0.02 -0.37 0.00 -2.27 0.00 0.00 64.05 61.40 3b78 n THR 471 Cb 0.51 1.71 -0.06 0.00 -2.10 0.00 0.00 70.33 70.38 3b78 n THR 471 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3b78 s SER 472 N -0.01 6.44 -0.00 3.42 0.15 -1.26 -4.95 113.70 117.49 3b78 s SER 472 Ca 0.00 0.52 0.01 0.00 0.70 0.00 0.00 55.95 57.19 3b78 s SER 472 Cb 0.00 -2.12 0.04 0.00 -1.71 0.00 0.00 66.02 62.23 3b78 s SER 472 CO 0.00 0.32 0.96 -0.62 1.20 0.00 0.00 173.24 175.10 3b78 n GLU 473 N 2.39 1.11 0.00 5.44 1.02 -1.26 -3.14 120.64 126.21 3b78 n GLU 473 Ca -0.17 -0.15 0.00 0.00 -0.02 0.00 0.00 57.16 56.82 3b78 n GLU 473 Cb 0.54 -1.11 0.00 0.00 -0.02 0.00 0.00 31.44 30.84 3b78 n GLU 473 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3b78 n THR 474 N -0.32 0.21 -2.85 2.62 -2.24 -1.26 -4.82 114.28 105.62 3b78 n THR 474 Ca 0.01 -0.33 -0.41 0.00 -2.27 0.00 0.00 64.05 61.06 3b78 n THR 474 Cb 0.08 1.18 -0.04 0.00 -2.10 0.00 0.00 70.33 69.45 3b78 n THR 474 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3b78 s ALA 475 N -0.21 3.27 0.82 6.98 0.00 -1.19 -4.98 121.76 126.45 3b78 s ALA 475 Ca 0.00 0.41 -0.11 0.00 0.00 0.00 0.00 51.96 52.25 3b78 s ALA 475 Cb 0.00 -3.16 0.11 0.00 0.00 0.00 0.00 23.12 20.07 3b78 s ALA 475 CO 0.00 -0.07 1.17 -1.01 0.00 0.00 0.00 175.76 175.85 3b78 s HIS 476 N 0.42 2.56 0.78 0.00 3.76 -1.26 -4.66 115.29 116.89 3b78 s HIS 476 Ca 0.44 0.53 -0.11 0.00 -0.15 0.00 0.00 55.06 55.78 3b78 s HIS 476 Cb -0.21 -3.56 0.06 0.00 1.11 0.00 0.00 32.58 29.98 3b78 s HIS 476 CO 0.25 -1.90 1.09 -0.80 -0.85 0.00 0.00 174.74 172.53 3b78 s ASN 477 N -4.65 4.44 0.37 1.40 0.01 -1.26 -4.89 114.94 110.36 3b78 s ASN 477 Ca 0.65 1.72 -0.05 0.00 -0.71 0.00 0.00 52.86 54.46 3b78 s ASN 477 Cb -0.09 -2.44 -0.05 0.00 0.41 0.00 0.00 41.25 39.09 3b78 s ASN 477 CO 0.49 -2.06 0.65 -0.04 -1.51 0.00 0.00 177.10 174.64 3b78 s MET 478 N -4.94 3.62 -0.41 -0.60 -1.94 -1.26 -2.17 119.30 111.60 3b78 s MET 478 Ca 0.61 0.10 -0.28 0.00 -1.71 0.00 0.00 55.69 54.41 3b78 s MET 478 Cb -0.17 -2.53 -0.13 0.00 2.01 0.00 0.00 34.83 34.01 3b78 s MET 478 CO 0.56 0.05 1.52 1.17 -0.01 0.00 0.00 175.02 178.31 3b78 n LYS 479 N -1.46 0.00 -2.76 2.03 0.00 -0.20 -4.76 118.16 111.02 3b78 n LYS 479 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 58.31 57.90 3b78 n LYS 479 Cb 0.55 -1.01 -0.05 0.00 0.00 0.00 0.00 35.03 34.51 3b78 n LYS 479 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 3b78 s VAL 480 N 4.47 4.31 -0.37 3.15 -7.23 -1.26 -5.03 120.40 118.44 3b78 s VAL 480 Ca 0.83 2.05 -0.16 0.00 -1.81 0.00 0.00 61.98 62.90 3b78 s VAL 480 Cb -0.98 -4.31 -0.00 0.00 0.56 0.00 0.00 36.38 31.65 3b78 s VAL 480 CO 0.42 0.41 0.37 -0.04 -0.31 0.00 0.00 175.10 175.96 3b78 s MET 481 N -0.59 3.42 0.18 4.82 -1.94 -1.26 -5.05 119.30 118.88 3b78 s MET 481 Ca 0.44 -0.54 -0.31 0.00 -1.71 0.00 0.00 55.69 53.56 3b78 s MET 481 Cb -0.24 -3.85 -0.10 0.00 2.01 0.00 0.00 34.83 32.64 3b78 s MET 481 CO 0.30 -0.62 1.59 0.15 -0.01 0.00 0.00 175.02 176.43 3b78 s LYS 482 N 2.02 4.20 0.06 2.03 1.02 -1.26 -4.85 119.74 122.97 3b78 s LYS 482 Ca 0.11 2.40 -0.08 0.00 0.02 0.00 0.00 55.97 58.43 3b78 s LYS 482 Cb -0.17 -3.13 -0.00 0.00 -0.52 0.00 0.00 37.83 34.01 3b78 s LYS 482 CO 0.12 -0.62 0.17 -0.06 -0.92 0.00 0.00 175.35 174.04 3b78 s PHE 483 N 1.04 0.14 -0.12 3.18 0.40 -1.26 -4.92 117.98 116.44 3b78 s PHE 483 Ca 0.70 -0.48 -0.12 0.00 -0.60 0.00 0.00 56.93 56.42 3b78 s PHE 483 Cb -0.45 -0.07 0.03 0.00 0.51 0.00 0.00 43.02 43.04 3b78 s PHE 483 CO 0.33 -0.47 0.34 0.45 0.70 0.00 0.00 175.22 176.57 3b78 s SER 484 N -2.50 -0.34 0.01 1.36 0.15 -1.26 -4.95 113.70 106.17 3b78 s SER 484 Ca 0.00 0.63 0.23 0.00 0.70 0.00 0.00 55.95 57.51 3b78 s SER 484 Cb 0.02 0.66 0.17 0.00 -1.71 0.00 0.00 66.02 65.16 3b78 s SER 484 CO -0.08 -0.16 1.16 0.55 1.20 0.00 0.00 173.24 175.92 3b78 n VAL 485 N 2.70 0.04 -1.65 4.45 3.14 -1.26 -4.90 118.33 120.84 3b78 n VAL 485 Ca -0.14 -0.05 -0.51 0.00 -2.96 0.00 0.00 64.34 60.68 3b78 n VAL 485 Cb 0.57 0.48 -0.06 0.00 -1.06 0.00 0.00 33.84 33.78 3b78 n VAL 485 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3b78 n SER 486 N -1.60 3.01 -4.55 6.55 3.41 -1.26 -4.85 113.62 114.32 3b78 n SER 486 Ca 0.04 0.88 -0.39 0.00 -0.26 0.00 0.00 58.87 59.15 3b78 n SER 486 Cb 0.36 -1.31 -0.03 0.00 -0.26 0.00 0.00 64.21 62.96 3b78 n SER 486 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 3b78 s PRO 487 N 4.38 3.11 0.05 4.33 0.02 -1.26 -4.47 135.00 141.17 3b78 s PRO 487 Ca 0.97 -0.31 0.23 0.00 0.02 0.00 0.00 61.00 61.91 3b78 s PRO 487 Cb -0.79 -4.62 0.01 0.00 0.02 0.00 0.00 34.50 29.12 3b78 s PRO 487 CO 0.54 -2.41 0.99 1.33 -0.33 0.00 0.00 177.00 177.12 3b78 n VAL 488 N 6.83 0.19 -4.23 3.83 0.24 -0.85 -4.68 118.33 119.65 3b78 n VAL 488 Ca 0.18 -0.28 -0.17 0.00 -2.04 0.00 0.00 64.34 62.04 3b78 n VAL 488 Cb 0.50 0.17 -0.13 0.00 -1.47 0.00 0.00 33.84 32.90 3b78 n VAL 488 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 3b78 s VAL 489 N -3.23 0.69 0.16 3.34 -7.23 -1.19 -0.07 120.40 112.88 3b78 s VAL 489 Ca 0.03 -0.67 -0.14 0.00 -1.81 0.00 0.00 61.98 59.38 3b78 s VAL 489 Cb 0.14 -0.64 0.02 0.00 0.56 0.00 0.00 36.38 36.46 3b78 s VAL 489 CO 0.81 -0.02 0.41 0.00 -0.31 0.00 0.00 175.10 175.99 3b78 s GLN 490 N -0.76 1.21 0.04 4.82 -2.07 0.47 -0.09 119.66 123.28 3b78 s GLN 490 Ca -0.01 -0.92 -0.02 0.00 -1.82 0.00 0.00 55.36 52.59 3b78 s GLN 490 Cb -0.06 0.46 -0.02 0.00 -1.09 0.00 0.00 33.01 32.30 3b78 s GLN 490 CO 0.00 -0.48 0.02 0.14 -1.32 0.00 0.00 175.29 173.65 3b78 s VAL 491 N -3.88 0.16 -0.16 3.63 -7.23 -0.32 -0.75 120.40 111.84 3b78 s VAL 491 Ca 0.10 -1.28 -0.18 0.00 -1.81 0.00 0.00 61.98 58.81 3b78 s VAL 491 Cb 0.01 -0.92 -0.04 0.00 0.56 0.00 0.00 36.38 35.99 3b78 s VAL 491 CO -0.05 -0.71 0.46 0.00 -0.31 0.00 0.00 175.10 174.50 3b78 s ALA 492 N -2.73 3.52 -0.13 1.32 0.00 -1.26 -1.45 121.76 121.03 3b78 s ALA 492 Ca -0.04 -0.34 -0.04 0.00 0.00 0.00 0.00 51.96 51.54 3b78 s ALA 492 Cb -0.01 -2.68 -0.03 0.00 0.00 0.00 0.00 23.12 20.40 3b78 s ALA 492 CO -0.05 -0.20 0.03 0.08 0.00 0.00 0.00 175.76 175.61 3b78 s VAL 493 N 1.08 4.49 -0.10 0.00 1.01 0.16 -2.65 120.40 124.39 3b78 s VAL 493 Ca 0.23 -0.16 -0.11 0.00 0.00 0.00 0.00 61.98 61.94 3b78 s VAL 493 Cb -0.15 -2.95 0.03 0.00 0.00 0.00 0.00 36.38 33.31 3b78 s VAL 493 CO 0.09 0.55 0.30 -0.70 0.00 0.00 0.00 175.10 175.34 3b78 s GLU 494 N -0.33 0.38 0.23 2.72 2.12 -0.72 -4.17 118.70 118.93 3b78 s GLU 494 Ca 0.07 0.36 -0.24 0.00 0.36 0.00 0.00 54.97 55.53 3b78 s GLU 494 Cb -0.12 0.18 -0.09 0.00 0.26 0.00 0.00 34.13 34.37 3b78 s GLU 494 CO 0.02 -0.06 0.81 0.14 -0.54 0.00 0.00 175.26 175.63 3b78 s VAL 495 N 0.01 4.38 0.11 3.70 -7.23 -1.26 0.15 120.40 120.26 3b78 s VAL 495 Ca -0.01 1.61 -0.04 0.00 -1.81 0.00 0.00 61.98 61.72 3b78 s VAL 495 Cb -0.02 -4.02 -0.23 0.00 0.56 0.00 0.00 36.38 32.67 3b78 s VAL 495 CO 0.01 0.32 1.23 0.11 -0.31 0.00 0.00 175.10 176.47 3b78 h LYS 496 N 3.73 0.34 -4.83 4.82 1.57 -1.85 -3.42 116.57 116.93 3b78 h LYS 496 Ca -0.47 -0.45 -0.67 0.00 -1.87 0.00 0.00 60.65 57.18 3b78 h LYS 496 Cb 1.20 0.15 -0.26 0.00 0.08 0.00 0.00 32.23 33.40 3b78 h LYS 496 CO 0.66 1.15 -0.62 -0.80 -0.57 0.00 0.00 179.45 179.26 3b78 s ASN 497 N -7.11 5.10 0.63 0.86 0.02 -1.26 -4.99 114.94 108.19 3b78 s ASN 497 Ca -0.05 -0.63 0.33 0.00 -1.02 0.00 0.00 52.86 51.50 3b78 s ASN 497 Cb 0.08 -1.88 1.80 0.00 0.02 0.00 0.00 41.25 41.27 3b78 s ASN 497 CO 0.87 -0.16 2.01 0.00 0.02 0.00 0.00 177.10 179.84 3b78 h ALA 498 N 8.23 1.22 0.00 0.60 0.00 -2.00 0.30 119.26 127.61 3b78 h ALA 498 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3b78 h ALA 498 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3b78 h ALA 498 CO 0.60 -0.22 0.00 -0.91 0.00 0.00 0.00 179.25 178.73 3b78 h ASN 499 N 0.00 0.00 -0.24 0.00 2.35 -1.97 -3.15 115.58 112.58 3b78 h ASN 499 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3b78 h ASN 499 Cb 0.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.81 3b78 h ASN 499 CO 0.00 0.00 0.00 0.47 -1.65 0.00 0.00 177.43 176.25 3b78 n ASP 500 N -2.75 1.78 -0.08 5.81 8.00 0.10 -4.41 116.55 124.99 3b78 n ASP 500 Ca 0.03 -1.82 -0.06 0.00 0.71 0.00 0.00 54.79 53.65 3b78 n ASP 500 Cb 0.37 -0.16 -0.00 0.00 -0.02 0.00 0.00 41.12 41.32 3b78 n ASP 500 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3b78 h LEU 501 N 2.20 -0.51 -1.31 0.64 5.85 -1.71 -1.78 115.31 118.68 3b78 h LEU 501 Ca 0.00 0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.91 3b78 h LEU 501 Cb 0.49 0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.75 3b78 h LEU 501 CO 0.00 -0.19 0.51 1.55 -0.34 0.00 0.00 178.44 179.97 3b78 h PRO 502 N -0.10 0.80 0.00 5.25 0.13 -1.88 -1.62 132.00 134.57 3b78 h PRO 502 Ca 0.16 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 65.16 3b78 h PRO 502 Cb 0.35 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.29 3b78 h PRO 502 CO -0.39 0.53 -0.41 0.87 -0.23 0.00 0.00 178.00 178.37 3b78 h LYS 503 N 0.82 0.00 -0.00 0.86 1.57 -1.65 -2.53 116.57 115.64 3b78 h LYS 503 Ca 0.34 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.89 3b78 h LYS 503 Cb 0.27 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.58 3b78 h LYS 503 CO -0.12 0.41 -0.95 1.25 -0.57 0.00 0.00 179.45 179.47 3b78 h LEU 504 N 0.00 0.59 -0.60 2.94 5.85 -0.87 -1.97 115.31 121.25 3b78 h LEU 504 Ca -0.00 -0.47 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 3b78 h LEU 504 Cb 0.74 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 3b78 h LEU 504 CO 0.05 1.27 0.32 0.58 -0.34 0.00 0.00 178.44 180.33 3b78 h VAL 505 N 0.26 1.20 0.00 1.05 2.07 -1.00 -0.32 116.25 119.51 3b78 h VAL 505 Ca -0.08 -0.52 -0.12 0.00 0.82 0.00 0.00 66.70 66.79 3b78 h VAL 505 Cb 1.59 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 3b78 h VAL 505 CO 0.17 0.22 -0.59 -0.08 0.02 0.00 0.00 177.57 177.31 3b78 h GLU 506 N 0.82 0.00 -0.42 1.57 4.57 -1.54 -2.97 114.58 116.60 3b78 h GLU 506 Ca 0.21 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.31 3b78 h GLU 506 Cb 0.06 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 3b78 h GLU 506 CO -0.03 0.59 -0.04 0.78 -1.18 0.00 0.00 179.01 179.12 3b78 h GLY 507 N 3.39 0.84 1.77 1.92 0.00 -0.92 -2.11 103.07 107.96 3b78 h GLY 507 Ca -0.01 -0.65 -0.07 0.00 0.00 0.00 0.00 47.33 46.60 3b78 h GLY 507 CO 0.08 0.60 -0.21 1.41 0.00 0.00 0.00 176.54 178.41 3b78 h LEU 508 N 0.60 0.26 -0.94 3.11 3.38 -1.12 -0.25 115.31 120.37 3b78 h LEU 508 Ca 0.11 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 3b78 h LEU 508 Cb 0.55 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3b78 h LEU 508 CO 0.03 0.49 -0.28 0.50 0.09 0.00 0.00 178.44 179.27 3b78 h LYS 509 N 0.25 0.44 0.00 1.13 3.64 -1.31 -2.30 116.57 118.42 3b78 h LYS 509 Ca 0.04 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 3b78 h LYS 509 Cb 0.52 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 3b78 h LYS 509 CO 0.04 0.68 -1.70 2.89 -2.27 0.00 0.00 179.45 179.09 3b78 n ARG 510 N -4.11 0.61 0.03 1.90 1.85 -0.82 -3.72 116.66 112.39 3b78 n ARG 510 Ca -0.01 -0.11 -0.05 0.00 -1.00 0.00 0.00 57.85 56.69 3b78 n ARG 510 Cb 0.42 -1.59 0.17 0.00 -1.05 0.00 0.00 32.46 30.40 3b78 n ARG 510 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 3b78 h LEU 511 N 0.00 0.47 -1.08 2.89 5.85 -0.99 -2.74 115.31 119.71 3b78 h LEU 511 Ca 0.00 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.53 3b78 h LEU 511 Cb 0.97 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.87 3b78 h LEU 511 CO 0.00 0.79 0.00 -1.28 -0.34 0.00 0.00 178.44 177.61 3b78 h SER 512 N 0.38 0.00 0.06 1.25 0.87 -1.49 -3.03 113.55 111.59 3b78 h SER 512 Ca 0.04 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3b78 h SER 512 Cb 0.81 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 3b78 h SER 512 CO 0.07 0.00 -1.63 0.29 -0.53 0.00 0.00 176.83 175.03 3b78 n LYS 513 N -2.65 0.45 0.00 2.24 4.76 -1.06 -4.10 118.16 117.80 3b78 n LYS 513 Ca 0.01 -0.12 0.14 0.00 -2.87 0.00 0.00 58.31 55.47 3b78 n LYS 513 Cb 0.26 -1.53 0.62 0.00 -1.84 0.00 0.00 35.03 32.54 3b78 n LYS 513 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 3b78 n SER 514 N -2.04 0.48 -3.64 4.39 3.41 -1.06 -4.77 113.62 110.39 3b78 n SER 514 Ca -0.01 -0.60 -0.02 0.00 -0.26 0.00 0.00 58.87 57.98 3b78 n SER 514 Cb 0.49 -0.07 -0.04 0.00 -0.26 0.00 0.00 64.21 64.33 3b78 n SER 514 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3b78 s ASP 515 N -2.45 -1.10 0.43 4.04 2.15 -1.25 -4.74 116.67 113.75 3b78 s ASP 515 Ca 0.29 1.54 0.30 0.00 0.43 0.00 0.00 52.55 55.11 3b78 s ASP 515 Cb 0.20 2.16 1.43 0.00 -0.30 0.00 0.00 42.92 46.41 3b78 s ASP 515 CO 0.47 -0.22 1.90 1.55 -0.17 0.00 0.00 175.17 178.71 3b78 h PRO 516 N 7.84 0.00 -0.06 4.34 0.13 -1.86 -2.80 132.00 139.60 3b78 h PRO 516 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 3b78 h PRO 516 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3b78 h PRO 516 CO 0.11 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 177.88 3b78 s VAL 518 N -1.92 5.15 -0.10 0.00 1.01 -1.06 -4.49 120.40 118.99 3b78 s VAL 518 Ca 0.28 0.46 -0.00 0.00 0.00 0.00 0.00 61.98 62.72 3b78 s VAL 518 Cb 0.20 -3.63 0.02 0.00 0.00 0.00 0.00 36.38 32.98 3b78 s VAL 518 CO 0.30 0.40 -0.06 -0.22 0.00 0.00 0.00 175.10 175.51 3b78 s LEU 519 N -1.62 1.10 -0.13 3.92 2.96 -0.76 -4.85 118.68 119.30 3b78 s LEU 519 Ca 0.28 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 53.96 3b78 s LEU 519 Cb -0.14 -0.75 -0.00 0.00 0.50 0.00 0.00 46.19 45.80 3b78 s LEU 519 CO 0.15 -0.12 -0.19 0.42 -1.32 0.00 0.00 176.35 175.29 3b78 s THR 520 N 1.67 2.39 0.34 3.68 -4.23 -1.26 -0.42 115.64 117.81 3b78 s THR 520 Ca 0.03 -0.88 -0.07 0.00 -1.18 0.00 0.00 61.69 59.60 3b78 s THR 520 Cb -0.13 -1.97 0.01 0.00 1.34 0.00 0.00 72.50 71.76 3b78 s THR 520 CO -0.07 0.54 0.54 -0.72 -0.54 0.00 0.00 174.62 174.37 3b78 s TYR 521 N 0.59 0.78 -0.13 3.99 -0.85 -0.78 -5.00 117.35 115.96 3b78 s TYR 521 Ca -0.11 -1.12 0.03 0.00 -0.52 0.00 0.00 57.07 55.35 3b78 s TYR 521 Cb -0.16 0.14 0.01 0.00 0.38 0.00 0.00 41.96 42.32 3b78 s TYR 521 CO 0.03 -1.21 -0.23 -1.64 -1.52 0.00 0.00 175.55 170.99 3b78 s MET 522 N -3.03 3.03 1.05 -3.49 -1.94 -1.26 -0.30 119.30 113.36 3b78 s MET 522 Ca 0.26 -0.86 -0.14 0.00 -1.71 0.00 0.00 55.69 53.24 3b78 s MET 522 Cb -0.01 -2.39 0.21 0.00 2.01 0.00 0.00 34.83 34.65 3b78 s MET 522 CO 0.17 0.05 1.10 -1.54 -0.01 0.00 0.00 175.02 174.78 3b78 s SER 523 N 0.67 2.20 0.34 3.03 1.04 -0.97 -4.90 113.70 115.11 3b78 s SER 523 Ca -0.11 1.06 0.02 0.00 0.48 0.00 0.00 55.95 57.40 3b78 s SER 523 Cb -0.16 -1.64 0.62 0.00 0.10 0.00 0.00 66.02 64.94 3b78 s SER 523 CO 0.01 -3.38 1.98 -0.33 0.98 0.00 0.00 173.24 172.51 3b78 h GLU 524 N -2.07 0.87 0.00 4.02 5.08 -2.00 -1.68 114.58 118.80 3b78 h GLU 524 Ca -0.53 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 3b78 h GLU 524 Cb 1.33 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3b78 h GLU 524 CO 0.53 0.57 0.00 -1.13 -1.00 0.00 0.00 179.01 177.99 3b78 n SER 525 N -4.45 0.00 0.00 1.42 3.41 -1.26 -4.85 113.62 107.89 3b78 n SER 525 Ca 0.09 -0.58 0.00 0.00 -0.26 0.00 0.00 58.87 58.12 3b78 n SER 525 Cb 0.10 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 3b78 n SER 525 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3b78 n GLY 526 N 0.46 0.75 3.76 5.00 0.00 -0.63 -5.04 105.19 109.48 3b78 n GLY 526 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3b78 n GLY 526 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3b78 n GLU 527 N -2.00 2.59 -2.82 1.61 1.02 -1.26 -4.75 120.64 115.03 3b78 n GLU 527 Ca 0.00 0.91 -0.43 0.00 -0.02 0.00 0.00 57.16 57.62 3b78 n GLU 527 Cb 0.00 -2.62 -0.04 0.00 -0.02 0.00 0.00 31.44 28.76 3b78 n GLU 527 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3b78 s HIS 528 N -0.97 3.03 -0.11 -0.32 3.76 -1.26 -2.28 115.29 117.14 3b78 s HIS 528 Ca 0.55 0.65 -0.04 0.00 -0.15 0.00 0.00 55.06 56.06 3b78 s HIS 528 Cb -0.49 -3.74 -0.04 0.00 1.11 0.00 0.00 32.58 29.42 3b78 s HIS 528 CO 0.62 -0.91 0.06 0.42 -0.85 0.00 0.00 174.74 174.08 3b78 s ILE 529 N 3.55 4.80 -0.18 0.60 -1.09 0.59 -0.66 121.20 128.80 3b78 s ILE 529 Ca 0.38 -0.06 0.01 0.00 -2.23 0.00 0.00 60.65 58.74 3b78 s ILE 529 Cb -0.11 -3.06 0.03 0.00 -1.58 0.00 0.00 42.46 37.74 3b78 s ILE 529 CO 0.21 0.59 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.70 3b78 s VAL 530 N -0.78 1.67 -0.01 2.92 1.01 -0.53 -1.86 120.40 122.81 3b78 s VAL 530 Ca 0.13 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.28 3b78 s VAL 530 Cb -0.12 -1.66 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 3b78 s VAL 530 CO 0.03 0.30 -0.20 0.00 0.00 0.00 0.00 175.10 175.22 3b78 s ALA 531 N 1.41 2.44 0.23 5.51 0.00 0.44 -1.17 121.76 130.62 3b78 s ALA 531 Ca 0.01 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.90 3b78 s ALA 531 Cb -0.15 -0.74 -0.01 0.00 0.00 0.00 0.00 23.12 22.23 3b78 s ALA 531 CO -0.09 0.55 0.07 0.41 0.00 0.00 0.00 175.76 176.69 3b78 n GLY 532 N 2.15 3.67 0.01 0.00 0.00 0.87 -1.82 105.19 110.07 3b78 n GLY 532 Ca -0.17 -2.07 0.11 0.00 0.00 0.00 0.00 46.02 43.90 3b78 n GLY 532 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3b78 n THR 533 N -0.53 0.02 -3.78 2.61 -2.24 -1.26 -2.02 114.28 107.09 3b78 n THR 533 Ca -0.04 -0.05 -0.03 0.00 -2.27 0.00 0.00 64.05 61.65 3b78 n THR 533 Cb 0.33 0.63 -0.00 0.00 -2.10 0.00 0.00 70.33 69.19 3b78 n THR 533 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3b78 s GLY 534 N -3.15 -0.15 0.08 3.38 0.00 -1.26 -4.73 107.32 101.49 3b78 s GLY 534 Ca 0.08 0.04 -0.30 0.00 0.00 0.00 0.00 44.72 44.54 3b78 s GLY 534 CO 0.81 0.58 1.65 -2.09 0.00 0.00 0.00 173.10 174.05 3b78 h GLU 535 N 2.00 -0.61 -0.39 2.90 4.81 -1.95 -1.45 114.58 119.89 3b78 h GLU 535 Ca -0.26 0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 58.99 3b78 h GLU 535 Cb 1.23 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.73 3b78 h GLU 535 CO 0.28 -0.41 0.13 1.25 -0.73 0.00 0.00 179.01 179.54 3b78 h LEU 536 N -0.64 0.56 -0.63 1.64 5.85 -1.97 -1.17 115.31 118.95 3b78 h LEU 536 Ca -0.04 -0.19 0.06 0.00 0.84 0.00 0.00 57.88 58.54 3b78 h LEU 536 Cb 0.52 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.36 3b78 h LEU 536 CO 0.04 0.60 0.33 -0.74 -0.34 0.00 0.00 178.44 178.33 3b78 h HIS 537 N 0.48 0.61 -0.05 1.25 2.76 -1.94 -1.19 115.15 117.08 3b78 h HIS 537 Ca 0.13 0.02 -0.12 0.00 -2.20 0.00 0.00 60.37 58.21 3b78 h HIS 537 Cb 0.23 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 3b78 h HIS 537 CO 0.01 0.28 -0.50 1.25 -1.30 0.00 0.00 177.93 177.66 3b78 h LEU 538 N 0.62 0.13 0.19 0.26 5.85 -1.11 -2.92 115.31 118.33 3b78 h LEU 538 Ca 0.28 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 3b78 h LEU 538 Cb 0.19 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.19 3b78 h LEU 538 CO -0.19 0.61 -0.09 -0.08 -0.34 0.00 0.00 178.44 178.35 3b78 h GLU 539 N 0.10 -0.25 0.00 1.25 4.57 -0.03 -2.31 114.58 117.91 3b78 h GLU 539 Ca 0.00 0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 58.12 3b78 h GLU 539 Cb 0.93 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.56 3b78 h GLU 539 CO 0.07 -0.11 -0.37 -0.84 -1.18 0.00 0.00 179.01 176.58 3b78 h ILE 540 N -0.32 1.05 -0.40 2.32 3.07 -1.40 -2.30 117.51 119.53 3b78 h ILE 540 Ca -0.03 -1.36 -0.12 0.00 1.55 0.00 0.00 64.86 64.90 3b78 h ILE 540 Cb 0.25 1.78 -0.01 0.00 -0.27 0.00 0.00 36.82 38.57 3b78 h ILE 540 CO 0.04 0.36 -0.22 0.00 -1.05 0.00 0.00 178.15 177.28 3b78 h LEU 542 N 0.70 0.00 0.09 0.00 3.38 -1.11 -1.08 115.31 117.28 3b78 h LEU 542 Ca 0.10 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.77 3b78 h LEU 542 Cb 0.74 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.52 3b78 h LEU 542 CO 0.06 0.39 -1.20 1.56 0.09 0.00 0.00 178.44 179.33 3b78 h GLN 543 N 0.00 0.64 -0.17 1.13 4.20 -1.11 -2.42 115.11 117.39 3b78 h GLN 543 Ca -0.00 -0.82 -0.07 0.00 0.06 0.00 0.00 58.65 57.82 3b78 h GLN 543 Cb 1.02 0.26 -0.01 0.00 0.30 0.00 0.00 27.48 29.05 3b78 h GLN 543 CO 0.05 1.37 -0.20 -0.44 -0.67 0.00 0.00 178.83 178.94 3b78 h ASP 544 N 0.30 0.28 -0.09 1.46 3.32 -0.71 -2.81 116.42 118.17 3b78 h ASP 544 Ca -0.18 -0.08 -0.16 0.00 0.02 0.00 0.00 57.03 56.64 3b78 h ASP 544 Cb 1.87 -0.08 0.01 0.00 0.22 0.00 0.00 39.33 41.35 3b78 h ASP 544 CO 0.23 0.50 -0.56 0.25 -1.72 0.00 0.00 179.24 177.95 3b78 h LEU 545 N 0.27 0.65 -0.01 1.55 5.85 -1.20 -0.12 115.31 122.30 3b78 h LEU 545 Ca 0.05 -0.66 0.00 0.00 0.84 0.00 0.00 57.88 58.11 3b78 h LEU 545 Cb 0.52 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.35 3b78 h LEU 545 CO 0.03 1.20 0.00 1.21 -0.34 0.00 0.00 178.44 180.55 3b78 n GLU 546 N -4.19 0.04 -0.00 1.25 2.13 -0.91 -0.49 120.64 118.47 3b78 n GLU 546 Ca -0.08 0.06 -0.00 0.00 0.66 0.00 0.00 57.16 57.80 3b78 n GLU 546 Cb 0.63 -1.55 -0.00 0.00 0.27 0.00 0.00 31.44 30.79 3b78 n GLU 546 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 3b78 n HIS 547 N -1.63 0.00 0.03 4.31 8.25 -1.07 -3.42 115.22 121.69 3b78 n HIS 547 Ca 0.06 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.52 3b78 n HIS 547 Cb 0.33 -0.01 -0.00 0.00 1.12 0.00 0.00 29.99 31.44 3b78 n HIS 547 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3b78 n ASP 548 N -1.93 0.79 0.11 0.41 8.00 -0.13 -4.41 116.55 119.39 3b78 n ASP 548 Ca -0.00 0.10 -0.02 0.00 0.71 0.00 0.00 54.79 55.58 3b78 n ASP 548 Cb 0.43 -0.26 0.21 0.00 -0.02 0.00 0.00 41.12 41.48 3b78 n ASP 548 CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 3b78 h HIS 549 N -0.05 0.23 0.00 1.24 3.86 -1.43 -3.38 115.15 115.61 3b78 h HIS 549 Ca 0.00 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 3b78 h HIS 549 Cb 0.05 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.47 3b78 h HIS 549 CO -0.02 0.63 -0.31 0.00 0.86 0.00 0.00 177.93 179.08 3b78 n ALA 550 N -2.47 2.07 -0.63 2.45 0.00 0.36 -3.80 120.51 118.49 3b78 n ALA 550 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.15 3b78 n ALA 550 Cb 0.51 0.13 0.00 0.00 0.00 0.00 0.00 19.45 20.09 3b78 n ALA 550 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b78 n GLY 551 N 2.69 0.85 3.82 0.00 0.00 -1.10 -4.91 105.19 106.54 3b78 n GLY 551 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 3b78 n GLY 551 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3b78 s VAL 552 N -3.28 4.80 0.06 1.61 -7.23 -1.25 -4.83 120.40 110.28 3b78 s VAL 552 Ca 0.00 -0.64 -0.34 0.00 -1.81 0.00 0.00 61.98 59.18 3b78 s VAL 552 Cb 0.00 -3.32 -0.14 0.00 0.56 0.00 0.00 36.38 33.48 3b78 s VAL 552 CO 0.00 0.13 1.66 -2.65 -0.31 0.00 0.00 175.10 173.93 3b78 n PRO 553 N 0.42 2.03 -4.76 4.82 -0.02 -1.26 -4.78 135.00 131.45 3b78 n PRO 553 Ca -0.08 0.74 -0.31 0.00 -2.02 0.00 0.00 63.50 61.84 3b78 n PRO 553 Cb 0.51 -2.52 -0.13 0.00 -0.02 0.00 0.00 33.50 31.34 3b78 n PRO 553 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3b78 s LEU 554 N 1.94 2.47 -0.38 2.45 1.43 -1.26 -2.80 118.68 122.52 3b78 s LEU 554 Ca 0.84 -0.47 -0.13 0.00 -1.03 0.00 0.00 54.13 53.35 3b78 s LEU 554 Cb -0.72 -1.44 0.02 0.00 0.03 0.00 0.00 46.19 44.07 3b78 s LEU 554 CO 0.44 0.26 0.25 -0.75 0.23 0.00 0.00 176.35 176.78 3b78 s LYS 555 N -1.33 2.98 -0.11 1.70 2.20 0.40 -4.86 119.74 120.72 3b78 s LYS 555 Ca 0.13 -0.99 0.02 0.00 -0.36 0.00 0.00 55.97 54.77 3b78 s LYS 555 Cb -0.10 -3.84 -0.01 0.00 -1.51 0.00 0.00 37.83 32.36 3b78 s LYS 555 CO 0.04 -0.68 -0.18 0.42 -0.36 0.00 0.00 175.35 174.59 3b78 s ILE 556 N 1.63 2.65 0.61 5.43 1.01 -1.26 -1.76 121.20 129.51 3b78 s ILE 556 Ca 0.04 -0.81 -0.13 0.00 0.00 0.00 0.00 60.65 59.75 3b78 s ILE 556 Cb -0.19 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 3b78 s ILE 556 CO 0.09 0.54 1.03 -0.94 0.00 0.00 0.00 174.94 175.66 3b78 s SER 557 N 0.27 6.09 0.58 3.58 1.04 -1.08 -5.01 113.70 119.16 3b78 s SER 557 Ca -0.12 1.54 -0.20 0.00 0.48 0.00 0.00 55.95 57.65 3b78 s SER 557 Cb -0.16 -2.49 -0.05 0.00 0.10 0.00 0.00 66.02 63.42 3b78 s SER 557 CO 0.07 -0.96 1.09 -2.65 0.98 0.00 0.00 173.24 171.76 3b78 n PRO 558 N -2.47 1.12 -1.72 4.02 -0.02 -1.26 -4.61 135.00 130.07 3b78 n PRO 558 Ca 0.07 0.43 -0.43 0.00 -2.02 0.00 0.00 63.50 61.55 3b78 n PRO 558 Cb 0.54 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 3b78 n PRO 558 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3b78 n PRO 559 N -1.03 2.55 -5.12 0.52 -0.02 -1.26 -4.81 135.00 125.83 3b78 n PRO 559 Ca 0.13 0.91 -0.29 0.00 -2.02 0.00 0.00 63.50 62.23 3b78 n PRO 559 Cb 0.46 -2.69 -0.16 0.00 -0.02 0.00 0.00 33.50 31.09 3b78 n PRO 559 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3b78 s VAL 560 N 0.47 1.80 0.15 -1.45 1.01 0.07 -4.95 120.40 117.49 3b78 s VAL 560 Ca 0.70 -0.96 -0.28 0.00 0.00 0.00 0.00 61.98 61.44 3b78 s VAL 560 Cb -0.55 -1.50 -0.07 0.00 0.00 0.00 0.00 36.38 34.26 3b78 s VAL 560 CO 0.42 0.51 0.88 -0.69 0.00 0.00 0.00 175.10 176.22 3b78 s VAL 561 N -0.40 4.39 0.02 2.92 1.01 -1.26 -0.40 120.40 126.68 3b78 s VAL 561 Ca 0.05 1.92 -0.26 0.00 0.00 0.00 0.00 61.98 63.69 3b78 s VAL 561 Cb -0.10 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 31.98 3b78 s VAL 561 CO 0.00 0.42 0.81 0.00 0.00 0.00 0.00 175.10 176.34 3b78 s ALA 562 N -0.60 3.31 0.50 5.51 0.00 0.90 -4.93 121.76 126.45 3b78 s ALA 562 Ca 0.41 0.33 0.04 0.00 0.00 0.00 0.00 51.96 52.74 3b78 s ALA 562 Cb -0.24 -3.08 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 3b78 s ALA 562 CO 0.29 -0.04 0.14 0.71 0.00 0.00 0.00 175.76 176.86 3b78 s TYR 563 N 0.33 1.94 -0.01 0.00 2.02 -1.26 -4.37 117.35 116.01 3b78 s TYR 563 Ca 0.42 -0.85 0.05 0.00 -0.37 0.00 0.00 57.07 56.31 3b78 s TYR 563 Cb -0.20 -1.75 -0.01 0.00 -0.40 0.00 0.00 41.96 39.59 3b78 s TYR 563 CO 0.24 0.04 -0.16 1.03 -1.57 0.00 0.00 175.55 175.13 3b78 s ARG 564 N -3.98 1.24 -0.17 -0.62 1.81 -0.55 -3.99 118.95 112.68 3b78 s ARG 564 Ca 0.20 -0.58 -0.08 0.00 -1.72 0.00 0.00 55.73 53.55 3b78 s ARG 564 Cb 0.01 -1.21 -0.05 0.00 -0.45 0.00 0.00 34.95 33.26 3b78 s ARG 564 CO 0.12 0.33 0.12 -1.21 -0.68 0.00 0.00 175.30 173.98 3b78 s GLU 565 N -0.45 3.87 0.27 3.54 2.02 0.13 0.21 118.70 128.30 3b78 s GLU 565 Ca 0.06 -0.20 -0.05 0.00 0.02 0.00 0.00 54.97 54.79 3b78 s GLU 565 Cb -0.06 -3.30 -0.01 0.00 0.10 0.00 0.00 34.13 30.85 3b78 s GLU 565 CO -0.00 0.48 0.37 -0.08 0.02 0.00 0.00 175.26 176.05 3b78 s THR 566 N -0.17 0.00 0.11 3.63 -1.32 0.20 -0.71 115.64 117.38 3b78 s THR 566 Ca 0.10 -1.67 0.07 0.00 -1.21 0.00 0.00 61.69 58.98 3b78 s THR 566 Cb -0.11 -2.44 -0.04 0.00 -1.51 0.00 0.00 72.50 68.40 3b78 s THR 566 CO 0.00 0.00 -0.16 0.68 -2.21 0.00 0.00 174.62 172.93 3b78 s VAL 567 N -3.71 1.44 -0.29 5.08 -7.23 -1.26 0.09 120.40 114.52 3b78 s VAL 567 Ca 0.31 -1.62 0.17 0.00 -1.81 0.00 0.00 61.98 59.02 3b78 s VAL 567 Cb 0.02 -1.49 0.49 0.00 0.56 0.00 0.00 36.38 35.96 3b78 s VAL 567 CO 0.15 -0.29 1.11 -1.84 -0.31 0.00 0.00 175.10 173.92 3b78 n GLU 568 N 0.77 2.24 -3.61 4.82 0.28 -1.22 -4.30 120.64 119.63 3b78 n GLU 568 Ca -0.17 -3.71 -0.01 0.00 -0.16 0.00 0.00 57.16 53.11 3b78 n GLU 568 Cb 0.56 -1.77 -0.01 0.00 1.43 0.00 0.00 31.44 31.64 3b78 n GLU 568 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 3b78 s SER 569 N -3.65 -0.07 0.45 -1.84 1.04 -1.25 -4.94 113.70 103.43 3b78 s SER 569 Ca 0.34 -0.04 -0.21 0.00 0.48 0.00 0.00 55.95 56.53 3b78 s SER 569 Cb 0.37 0.11 -0.10 0.00 0.10 0.00 0.00 66.02 66.49 3b78 s SER 569 CO -0.02 -0.18 0.98 -0.70 0.98 0.00 0.00 173.24 174.29 3b78 s GLU 570 N -2.30 4.10 -0.10 4.02 2.12 -1.26 -4.26 118.70 121.03 3b78 s GLU 570 Ca 0.12 1.19 -0.37 0.00 0.36 0.00 0.00 54.97 56.26 3b78 s GLU 570 Cb 0.02 -2.15 -0.15 0.00 0.26 0.00 0.00 34.13 32.10 3b78 s GLU 570 CO -0.04 -0.15 1.64 0.43 -0.54 0.00 0.00 175.26 176.60 3b78 n SER 571 N -0.75 2.45 -0.35 -1.70 7.64 -0.63 -4.54 113.62 115.73 3b78 n SER 571 Ca 0.08 1.07 0.25 0.00 1.01 0.00 0.00 58.87 61.28 3b78 n SER 571 Cb 0.54 -1.23 0.50 0.00 -1.01 0.00 0.00 64.21 63.01 3b78 n SER 571 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3b78 h SER 572 N 6.70 0.48 -5.28 6.43 0.02 -1.26 -3.43 113.55 117.21 3b78 h SER 572 Ca -0.47 0.15 -0.09 0.00 -0.84 0.00 0.00 61.79 60.54 3b78 h SER 572 Cb 1.31 0.10 -0.11 0.00 0.14 0.00 0.00 62.40 63.83 3b78 h SER 572 CO 0.90 -0.07 -0.24 0.00 -1.14 0.00 0.00 176.83 176.28 3b78 s GLN 573 N -5.58 1.36 0.26 3.45 -2.07 -1.26 -5.14 119.66 110.67 3b78 s GLN 573 Ca -0.09 -1.24 -0.30 0.00 -1.82 0.00 0.00 55.36 51.90 3b78 s GLN 573 Cb 0.29 0.42 -0.11 0.00 -1.09 0.00 0.00 33.01 32.52 3b78 s GLN 573 CO 0.80 -0.53 1.52 0.99 -1.32 0.00 0.00 175.29 176.74 3b78 s THR 574 N -4.01 2.41 -0.03 3.63 2.01 -1.26 -4.95 115.64 113.45 3b78 s THR 574 Ca 0.22 0.34 -0.21 0.00 0.31 0.00 0.00 61.69 62.34 3b78 s THR 574 Cb 0.02 -3.22 -0.05 0.00 0.01 0.00 0.00 72.50 69.26 3b78 s THR 574 CO 0.05 0.05 0.62 0.00 -0.69 0.00 0.00 174.62 174.66 3b78 s ALA 575 N 0.14 3.44 -0.01 7.40 0.00 0.27 -4.95 121.76 128.05 3b78 s ALA 575 Ca 0.62 0.05 0.04 0.00 0.00 0.00 0.00 51.96 52.67 3b78 s ALA 575 Cb -0.44 -2.80 -0.01 0.00 0.00 0.00 0.00 23.12 19.86 3b78 s ALA 575 CO 0.44 0.08 -0.13 -1.17 0.00 0.00 0.00 175.76 174.98 3b78 s LEU 576 N 0.12 2.02 -0.11 0.00 2.96 -1.26 -1.19 118.68 121.22 3b78 s LEU 576 Ca 0.33 -0.23 -0.10 0.00 -0.22 0.00 0.00 54.13 53.91 3b78 s LEU 576 Cb -0.18 -0.66 0.03 0.00 0.50 0.00 0.00 46.19 45.89 3b78 s LEU 576 CO 0.17 0.16 0.30 -0.55 -1.32 0.00 0.00 176.35 175.10 3b78 s SER 577 N -0.30 -0.31 0.16 3.68 0.15 -1.06 -1.18 113.70 114.84 3b78 s SER 577 Ca 0.05 0.60 0.04 0.00 0.70 0.00 0.00 55.95 57.34 3b78 s SER 577 Cb -0.05 0.60 -0.04 0.00 -1.71 0.00 0.00 66.02 64.82 3b78 s SER 577 CO -0.00 -0.11 0.20 -0.54 1.20 0.00 0.00 173.24 173.99 3b78 s LYS 578 N 0.27 3.13 0.61 5.44 1.02 -1.26 -1.95 119.74 127.00 3b78 s LYS 578 Ca -0.01 -0.76 -0.13 0.00 0.02 0.00 0.00 55.97 55.09 3b78 s LYS 578 Cb -0.03 -2.78 -0.04 0.00 -0.52 0.00 0.00 37.83 34.47 3b78 s LYS 578 CO -0.01 0.50 1.03 -1.54 -0.92 0.00 0.00 175.35 174.41 3b78 s SER 579 N -3.19 6.02 0.32 2.83 1.04 0.16 -4.63 113.70 116.25 3b78 s SER 579 Ca 0.32 1.57 0.07 0.00 0.48 0.00 0.00 55.95 58.39 3b78 s SER 579 Cb -0.10 -2.49 0.77 0.00 0.10 0.00 0.00 66.02 64.30 3b78 s SER 579 CO 0.26 -1.01 1.79 -0.65 0.98 0.00 0.00 173.24 174.61 3b78 h PRO 580 N -0.04 0.71 -0.00 4.02 0.11 -1.89 0.17 132.00 135.07 3b78 h PRO 580 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3b78 h PRO 580 Cb 1.20 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3b78 h PRO 580 CO 0.60 0.47 -0.00 0.27 -0.21 0.00 0.00 178.00 179.13 3b78 n ASN 581 N -4.71 0.04 -0.08 -2.05 0.23 -1.26 -4.90 115.26 102.52 3b78 n ASN 581 Ca 0.22 -0.68 -0.01 0.00 -0.53 0.00 0.00 54.58 53.58 3b78 n ASN 581 Cb 0.57 -0.11 -0.00 0.00 -2.08 0.00 0.00 39.78 38.16 3b78 n ASN 581 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3b78 n LYS 582 N -1.08 -0.65 -0.00 -3.83 4.76 0.58 -4.86 118.16 113.07 3b78 n LYS 582 Ca 0.20 0.26 0.09 0.00 -2.87 0.00 0.00 58.31 55.99 3b78 n LYS 582 Cb 0.17 -3.81 -0.12 0.00 -1.84 0.00 0.00 35.03 29.43 3b78 n LYS 582 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 3b78 n HIS 583 N -2.68 0.00 -5.20 2.13 8.25 -1.26 -4.89 115.22 111.57 3b78 n HIS 583 Ca -0.01 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.15 3b78 n HIS 583 Cb 0.18 -0.14 -0.16 0.00 1.12 0.00 0.00 29.99 30.98 3b78 n HIS 583 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 3b78 s ASN 584 N -3.20 2.86 0.02 0.41 0.01 -1.26 -3.65 114.94 110.13 3b78 s ASN 584 Ca 0.02 -0.46 0.04 0.00 -0.71 0.00 0.00 52.86 51.75 3b78 s ASN 584 Cb 0.13 -0.55 -0.02 0.00 0.41 0.00 0.00 41.25 41.23 3b78 s ASN 584 CO 0.76 0.26 -0.12 -0.13 -1.51 0.00 0.00 177.10 176.36 3b78 s ARG 585 N -0.35 0.88 -0.11 -0.60 0.52 -0.32 -0.67 118.95 118.30 3b78 s ARG 585 Ca 0.03 -0.58 0.01 0.00 -0.52 0.00 0.00 55.73 54.66 3b78 s ARG 585 Cb -0.11 -0.85 0.02 0.00 0.52 0.00 0.00 34.95 34.52 3b78 s ARG 585 CO 0.01 0.22 -0.12 0.42 0.02 0.00 0.00 175.30 175.86 3b78 s ILE 586 N -0.61 1.28 -0.23 1.52 1.01 -0.82 -1.72 121.20 121.63 3b78 s ILE 586 Ca 0.02 -0.48 -0.07 0.00 0.00 0.00 0.00 60.65 60.12 3b78 s ILE 586 Cb -0.06 -1.22 -0.03 0.00 0.01 0.00 0.00 42.46 41.16 3b78 s ILE 586 CO 0.00 0.40 0.06 -0.31 0.00 0.00 0.00 174.94 175.10 3b78 s TYR 587 N 1.32 3.11 0.24 3.97 2.02 0.39 -2.57 117.35 125.83 3b78 s TYR 587 Ca -0.01 -0.32 -0.03 0.00 -0.37 0.00 0.00 57.07 56.34 3b78 s TYR 587 Cb -0.14 -2.19 -0.03 0.00 -0.40 0.00 0.00 41.96 39.21 3b78 s TYR 587 CO -0.05 -0.24 0.26 -0.48 -1.57 0.00 0.00 175.55 173.46 3b78 s LEU 588 N 1.29 1.03 -0.12 -1.29 0.05 -0.34 -0.32 118.68 118.97 3b78 s LEU 588 Ca 0.05 -1.34 -0.10 0.00 0.05 0.00 0.00 54.13 52.79 3b78 s LEU 588 Cb -0.15 0.81 0.04 0.00 -2.05 0.00 0.00 46.19 44.84 3b78 s LEU 588 CO 0.03 -0.98 0.32 -0.75 -0.55 0.00 0.00 176.35 174.42 3b78 s LYS 589 N -3.94 0.34 0.13 1.48 2.20 -0.14 -0.57 119.74 119.24 3b78 s LYS 589 Ca 0.35 0.52 -0.01 0.00 -0.36 0.00 0.00 55.97 56.46 3b78 s LYS 589 Cb 0.04 0.09 -0.04 0.00 -1.51 0.00 0.00 37.83 36.40 3b78 s LYS 589 CO 0.14 -0.09 0.31 0.00 -0.36 0.00 0.00 175.35 175.35 3b78 s ALA 590 N 0.58 3.90 -0.02 3.13 0.00 -1.26 -0.18 121.76 127.93 3b78 s ALA 590 Ca -0.03 -0.79 -0.27 0.00 0.00 0.00 0.00 51.96 50.86 3b78 s ALA 590 Cb -0.05 -1.94 0.06 0.00 0.00 0.00 0.00 23.12 21.19 3b78 s ALA 590 CO -0.03 0.66 0.61 -1.83 0.00 0.00 0.00 175.76 175.16 3b78 s GLU 591 N -2.84 1.03 0.47 0.00 -1.05 0.34 -1.60 118.70 115.05 3b78 s GLU 591 Ca 0.37 0.09 -0.23 0.00 -0.15 0.00 0.00 54.97 55.05 3b78 s GLU 591 Cb -0.12 0.48 -0.07 0.00 -0.44 0.00 0.00 34.13 33.98 3b78 s GLU 591 CO 0.27 -0.34 1.24 -1.25 0.95 0.00 0.00 175.26 176.13 3b78 s PRO 592 N -1.57 3.63 -0.14 -4.83 0.04 -1.26 -0.48 135.00 130.38 3b78 s PRO 592 Ca -0.10 1.95 -0.07 0.00 0.04 0.00 0.00 61.00 62.83 3b78 s PRO 592 Cb -0.01 -2.42 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 3b78 s PRO 592 CO 0.06 -0.71 0.09 0.42 0.04 0.00 0.00 177.00 176.90 3b78 s ILE 593 N -1.44 5.02 0.49 0.56 1.01 0.14 -4.73 121.20 122.26 3b78 s ILE 593 Ca 0.65 0.04 -0.23 0.00 0.00 0.00 0.00 60.65 61.11 3b78 s ILE 593 Cb -0.33 -3.21 -0.08 0.00 0.01 0.00 0.00 42.46 38.85 3b78 s ILE 593 CO 0.40 0.54 1.13 0.47 0.00 0.00 0.00 174.94 177.49 3b78 n ASP 594 N 2.74 1.76 -0.24 3.58 8.00 -1.26 -4.79 116.55 126.33 3b78 n ASP 594 Ca -0.18 0.99 0.03 0.00 0.71 0.00 0.00 54.79 56.33 3b78 n ASP 594 Cb 0.53 -1.44 0.26 0.00 -0.02 0.00 0.00 41.12 40.45 3b78 n ASP 594 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3b78 h GLU 595 N 1.40 0.95 -0.66 -1.24 4.39 -1.98 -1.19 114.58 116.25 3b78 h GLU 595 Ca -0.48 -0.06 0.07 0.00 0.34 0.00 0.00 59.36 59.24 3b78 h GLU 595 Cb 1.33 -0.21 -0.06 0.00 -0.10 0.00 0.00 28.75 29.70 3b78 h GLU 595 CO 0.56 0.63 0.34 0.93 -1.16 0.00 0.00 179.01 180.31 3b78 h GLU 596 N 0.97 0.60 -0.29 2.33 5.08 -1.99 0.67 114.58 121.96 3b78 h GLU 596 Ca 0.32 -0.04 -0.13 0.00 -1.00 0.00 0.00 59.36 58.51 3b78 h GLU 596 Cb 0.06 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 3b78 h GLU 596 CO -0.10 0.40 -0.35 0.28 -1.00 0.00 0.00 179.01 178.24 3b78 h VAL 597 N 0.62 1.30 -0.60 3.13 2.07 -1.70 -0.71 116.25 120.35 3b78 h VAL 597 Ca 0.31 -1.53 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 3b78 h VAL 597 Cb 0.25 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 3b78 h VAL 597 CO -0.21 0.49 0.34 0.28 0.02 0.00 0.00 177.57 178.49 3b78 h SER 598 N 0.49 0.75 -0.59 0.57 0.02 -0.90 -0.67 113.55 113.22 3b78 h SER 598 Ca 0.04 -0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 60.85 3b78 h SER 598 Cb 0.93 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.25 3b78 h SER 598 CO 0.08 0.62 0.18 -0.07 -1.14 0.00 0.00 176.83 176.50 3b78 h LEU 599 N 0.82 0.86 -0.86 5.07 4.07 -0.82 -1.08 115.31 123.38 3b78 h LEU 599 Ca 0.21 -0.21 0.04 0.00 0.08 0.00 0.00 57.88 58.00 3b78 h LEU 599 Cb 0.03 -0.23 -0.05 0.00 1.08 0.00 0.00 40.66 41.49 3b78 h LEU 599 CO -0.04 0.85 0.55 0.00 -1.08 0.00 0.00 178.44 178.72 3b78 h ALA 600 N 1.05 1.15 -0.37 1.53 0.00 -0.71 0.90 119.26 122.82 3b78 h ALA 600 Ca 0.19 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 3b78 h ALA 600 Cb 0.30 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3b78 h ALA 600 CO -0.00 0.36 -0.05 0.82 0.00 0.00 0.00 179.25 180.37 3b78 h ILE 601 N 1.05 1.27 0.00 0.00 2.04 -0.84 -1.26 117.51 119.77 3b78 h ILE 601 Ca 0.35 -1.10 0.00 0.00 1.00 0.00 0.00 64.86 65.11 3b78 h ILE 601 Cb 0.05 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 3b78 h ILE 601 CO -0.13 0.36 0.00 -0.33 0.00 0.00 0.00 178.15 178.05 3b78 h GLU 602 N 0.49 0.00 -0.53 2.37 5.08 -0.71 -2.90 114.58 118.37 3b78 h GLU 602 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3b78 h GLU 602 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 3b78 h GLU 602 CO 0.03 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.13 3b78 n ASN 603 N -2.71 3.78 0.00 1.42 3.02 0.27 -4.96 115.26 116.07 3b78 n ASN 603 Ca 0.01 -2.20 0.00 0.00 -0.03 0.00 0.00 54.58 52.36 3b78 n ASN 603 Cb 0.26 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 3b78 n ASN 603 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3b78 n GLY 604 N 0.92 2.64 0.33 7.41 0.00 -0.97 -4.75 105.19 110.75 3b78 n GLY 604 Ca 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 3b78 n GLY 604 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3b78 h ILE 605 N 0.00 0.37 -3.34 -0.61 2.04 -1.51 -3.33 117.51 111.13 3b78 h ILE 605 Ca 0.00 0.00 -0.69 0.00 1.00 0.00 0.00 64.86 65.17 3b78 h ILE 605 Cb 0.00 0.37 -0.18 0.00 -0.74 0.00 0.00 36.82 36.27 3b78 h ILE 605 CO 0.00 0.00 -0.02 -0.63 0.00 0.00 0.00 178.15 177.50 3b78 s ILE 606 N -6.04 4.94 -0.11 -0.67 1.01 -0.99 -4.99 121.20 114.35 3b78 s ILE 606 Ca -0.16 -0.46 -0.00 0.00 0.00 0.00 0.00 60.65 60.03 3b78 s ILE 606 Cb 0.07 -4.23 -0.02 0.00 0.01 0.00 0.00 42.46 38.28 3b78 s ILE 606 CO 0.64 -0.70 -0.09 0.21 0.00 0.00 0.00 174.94 175.00 3b78 s ASN 607 N 2.47 4.43 0.45 3.58 3.84 -1.25 -4.34 114.94 124.12 3b78 s ASN 607 Ca 0.14 -0.16 0.18 0.00 0.21 0.00 0.00 52.86 53.24 3b78 s ASN 607 Cb -0.19 -1.42 1.06 0.00 -0.55 0.00 0.00 41.25 40.16 3b78 s ASN 607 CO 0.12 0.25 1.97 -0.65 -2.79 0.00 0.00 177.10 176.01 3b78 h PRO 608 N 6.05 0.00 -0.15 0.43 0.11 -1.93 -2.44 132.00 134.07 3b78 h PRO 608 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3b78 h PRO 608 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3b78 h PRO 608 CO 0.56 0.21 0.00 0.54 -0.21 0.00 0.00 178.00 179.10 3b78 n ARG 609 N -4.05 1.85 -2.29 1.05 1.74 -1.26 -4.93 116.66 108.77 3b78 n ARG 609 Ca -0.02 -1.26 -0.31 0.00 -0.77 0.00 0.00 57.85 55.49 3b78 n ARG 609 Cb 0.29 -1.43 -0.02 0.00 -1.02 0.00 0.00 32.46 30.28 3b78 n ARG 609 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3b78 s ASP 610 N -1.69 6.44 0.11 0.55 3.68 -0.92 -4.99 116.67 119.85 3b78 s ASP 610 Ca 0.34 1.40 -0.32 0.00 2.13 0.00 0.00 52.55 56.10 3b78 s ASP 610 Cb 0.19 -2.45 -0.11 0.00 -1.45 0.00 0.00 42.92 39.10 3b78 s ASP 610 CO 0.29 -0.66 1.81 -0.67 0.13 0.00 0.00 175.17 176.06 3b78 n ASP 611 N -2.02 3.84 0.30 -0.34 2.03 -1.26 -4.85 116.55 114.25 3b78 n ASP 611 Ca 0.05 1.00 0.19 0.00 0.52 0.00 0.00 54.79 56.55 3b78 n ASP 611 Cb 0.54 -1.51 1.02 0.00 -0.72 0.00 0.00 41.12 40.45 3b78 n ASP 611 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 3b78 h PHE 612 N 8.22 0.00 0.12 -0.67 -5.15 -1.94 0.78 116.94 118.29 3b78 h PHE 612 Ca -0.46 0.00 -0.34 0.00 -0.20 0.00 0.00 57.97 56.97 3b78 h PHE 612 Cb 1.23 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.39 3b78 h PHE 612 CO 0.77 0.00 -1.81 0.87 -2.00 0.00 0.00 178.31 176.14 3b78 h LYS 613 N 0.00 0.25 -0.44 6.09 1.57 -1.93 -2.82 116.57 119.29 3b78 h LYS 613 Ca 0.02 -0.42 -0.14 0.00 -1.87 0.00 0.00 60.65 58.24 3b78 h LYS 613 Cb 0.19 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3b78 h LYS 613 CO -0.00 1.10 -0.27 0.00 -0.57 0.00 0.00 179.45 179.71 3b78 h ALA 614 N 0.31 0.68 -0.49 3.86 0.00 -1.67 -2.39 119.26 119.56 3b78 h ALA 614 Ca -0.35 -0.41 -0.11 0.00 0.00 0.00 0.00 54.91 54.04 3b78 h ALA 614 Cb 2.04 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.66 3b78 h ALA 614 CO 0.12 0.67 -0.13 -0.09 0.00 0.00 0.00 179.25 179.82 3b78 h ARG 615 N 0.81 0.92 -0.58 0.00 2.43 -1.03 -2.89 114.38 114.04 3b78 h ARG 615 Ca 0.09 -0.34 -0.06 0.00 -0.81 0.00 0.00 59.98 58.86 3b78 h ARG 615 Cb 0.85 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.31 3b78 h ARG 615 CO 0.08 1.00 0.11 0.00 -1.51 0.00 0.00 179.97 179.65 3b78 h ALA 616 N 1.02 1.11 -0.53 2.80 0.00 -1.39 -1.91 119.26 120.36 3b78 h ALA 616 Ca 0.13 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 3b78 h ALA 616 Cb 0.67 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3b78 h ALA 616 CO 0.05 0.59 0.13 -0.09 0.00 0.00 0.00 179.25 179.93 3b78 h ARG 617 N 0.87 0.80 -0.23 0.00 9.65 -1.30 -1.37 114.38 122.80 3b78 h ARG 617 Ca 0.18 -0.16 -0.08 0.00 -1.10 0.00 0.00 59.98 58.83 3b78 h ARG 617 Cb 0.35 -0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 28.81 3b78 h ARG 617 CO 0.00 0.71 -0.16 0.82 2.80 0.00 0.00 179.97 184.15 3b78 h ILE 618 N 0.77 1.31 -0.11 1.20 2.04 -1.24 -1.17 117.51 120.32 3b78 h ILE 618 Ca 0.17 -1.28 -0.09 0.00 1.00 0.00 0.00 64.86 64.66 3b78 h ILE 618 Cb 0.27 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 3b78 h ILE 618 CO -0.00 0.39 -0.35 0.24 0.00 0.00 0.00 178.15 178.43 3b78 h MET 619 N 0.21 0.23 0.05 2.37 2.86 -1.19 -0.39 114.93 119.06 3b78 h MET 619 Ca 0.04 -0.09 -0.13 0.00 -2.06 0.00 0.00 59.70 57.46 3b78 h MET 619 Cb 0.69 -0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.35 3b78 h MET 619 CO 0.04 0.55 -0.55 0.00 1.06 0.00 0.00 176.91 178.02 3b78 h ALA 620 N 1.44 0.00 -0.02 6.32 0.00 -1.24 -0.60 119.26 125.17 3b78 h ALA 620 Ca 0.02 -0.59 -0.12 0.00 0.00 0.00 0.00 54.91 54.22 3b78 h ALA 620 Cb 0.72 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.57 3b78 h ALA 620 CO 0.05 0.27 -0.47 -0.44 0.00 0.00 0.00 179.25 178.66 3b78 h ASP 621 N -0.36 0.45 0.15 0.00 3.32 -1.19 -3.10 116.42 115.69 3b78 h ASP 621 Ca -0.08 -0.74 0.00 0.00 0.02 0.00 0.00 57.03 56.23 3b78 h ASP 621 Cb 1.33 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3b78 h ASP 621 CO 0.11 1.13 -1.52 0.47 -1.72 0.00 0.00 179.24 177.70 3b78 n ASP 622 N -4.31 0.40 0.00 6.45 8.00 -0.16 -4.52 116.55 122.41 3b78 n ASP 622 Ca -0.10 -0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.16 3b78 n ASP 622 Cb 0.60 1.44 0.00 0.00 -0.02 0.00 0.00 41.12 43.15 3b78 n ASP 622 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3b78 n TYR 623 N -2.06 0.00 -3.16 1.24 4.01 -1.02 -5.03 117.16 111.14 3b78 n TYR 623 Ca -0.01 -0.18 -0.18 0.00 -0.16 0.00 0.00 57.90 57.37 3b78 n TYR 623 Cb 0.49 -0.02 0.05 0.00 -0.31 0.00 0.00 39.34 39.55 3b78 n TYR 623 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3b78 n GLY 624 N -0.18 -0.19 3.90 2.72 0.00 -0.91 -4.92 105.19 105.60 3b78 n GLY 624 Ca 0.00 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 3b78 n GLY 624 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3b78 s TRP 625 N -3.17 3.46 -0.27 1.61 0.52 -0.28 -4.97 118.94 115.85 3b78 s TRP 625 Ca 0.37 0.70 -0.29 0.00 0.02 0.00 0.00 56.10 56.90 3b78 s TRP 625 Cb -0.16 -2.13 -0.00 0.00 -1.15 0.00 0.00 33.47 30.02 3b78 s TRP 625 CO 0.46 0.23 1.27 -0.51 0.02 0.00 0.00 176.95 178.42 3b78 s ASP 626 N -2.84 6.76 0.64 2.95 -0.00 -1.26 -4.15 116.67 118.77 3b78 s ASP 626 Ca 0.45 1.30 0.34 0.00 -0.00 0.00 0.00 52.55 54.64 3b78 s ASP 626 Cb -0.11 -2.54 1.87 0.00 -0.00 0.00 0.00 42.92 42.14 3b78 s ASP 626 CO 0.27 -0.99 2.11 1.62 -0.00 0.00 0.00 175.17 178.18 3b78 h VAL 627 N 5.83 0.15 0.11 -1.27 3.04 -1.94 0.24 116.25 122.42 3b78 h VAL 627 Ca -0.26 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.43 3b78 h VAL 627 Cb 1.09 0.81 0.00 0.00 -2.01 0.00 0.00 31.29 31.19 3b78 h VAL 627 CO 1.02 0.00 -0.05 0.74 -1.01 0.00 0.00 177.57 178.26 3b78 h THR 628 N 0.00 0.94 -0.11 3.17 2.02 -1.96 -1.72 112.91 115.25 3b78 h THR 628 Ca 0.03 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.02 3b78 h THR 628 Cb 0.44 1.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.90 3b78 h THR 628 CO -0.00 0.04 0.02 0.44 0.37 0.00 0.00 175.52 176.39 3b78 h ASP 629 N -0.23 0.17 -0.04 4.18 3.32 -0.97 -3.13 116.42 119.72 3b78 h ASP 629 Ca -0.02 -0.25 0.01 0.00 0.02 0.00 0.00 57.03 56.80 3b78 h ASP 629 Cb 0.19 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 3b78 h ASP 629 CO 0.03 0.38 0.04 0.00 -1.72 0.00 0.00 179.24 177.96 3b78 h ALA 630 N 0.80 1.88 0.00 3.45 0.00 -1.18 0.18 119.26 124.39 3b78 h ALA 630 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3b78 h ALA 630 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3b78 h ALA 630 CO 0.00 -0.06 -0.14 0.54 0.00 0.00 0.00 179.25 179.59 3b78 n ARG 631 N -4.28 0.03 -0.71 0.00 1.74 -0.65 -3.72 116.66 109.06 3b78 n ARG 631 Ca -0.02 0.02 -0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3b78 n ARG 631 Cb 0.13 -1.53 0.24 0.00 -1.02 0.00 0.00 32.46 30.29 3b78 n ARG 631 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3b78 n LYS 632 N -1.58 2.64 -2.05 5.56 5.02 0.62 -4.98 118.16 123.40 3b78 n LYS 632 Ca 0.06 -3.02 -0.42 0.00 -2.02 0.00 0.00 58.31 52.92 3b78 n LYS 632 Cb 0.35 -1.92 -0.03 0.00 -0.02 0.00 0.00 35.03 33.41 3b78 n LYS 632 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3b78 s ILE 633 N -3.03 3.28 -0.08 -0.18 1.01 -1.19 -1.64 121.20 119.36 3b78 s ILE 633 Ca 0.46 0.73 0.04 0.00 0.00 0.00 0.00 60.65 61.88 3b78 s ILE 633 Cb 0.39 -3.47 -0.24 0.00 0.01 0.00 0.00 42.46 39.15 3b78 s ILE 633 CO 0.07 0.00 0.50 0.79 0.00 0.00 0.00 174.94 176.30 3b78 n TRP 634 N 5.41 1.07 -3.61 3.97 7.02 0.44 -4.96 117.44 126.78 3b78 n TRP 634 Ca 0.15 0.30 -0.03 0.00 -1.02 0.00 0.00 57.50 56.90 3b78 n TRP 634 Cb 0.42 -1.17 -0.01 0.00 -2.42 0.00 0.00 31.31 28.12 3b78 n TRP 634 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3b78 s PHE 636 N -2.57 2.61 -0.20 0.00 0.08 -1.26 -2.58 117.98 114.07 3b78 s PHE 636 Ca 0.11 -0.49 -0.32 0.00 0.12 0.00 0.00 56.93 56.35 3b78 s PHE 636 Cb 0.01 -2.25 0.15 0.00 -0.57 0.00 0.00 43.02 40.36 3b78 s PHE 636 CO -0.04 -0.33 1.17 0.20 -0.10 0.00 0.00 175.22 176.12 3b78 s GLY 637 N -4.27 -0.19 0.72 4.36 0.00 -0.80 -3.71 107.32 103.44 3b78 s GLY 637 Ca 0.51 2.02 -0.12 0.00 0.00 0.00 0.00 44.72 47.13 3b78 s GLY 637 CO 0.30 0.81 0.89 -1.05 0.00 0.00 0.00 173.10 174.05 3b78 n PRO 638 N 0.28 -1.28 -1.28 2.90 -0.02 -1.26 -2.52 135.00 131.83 3b78 n PRO 638 Ca -0.03 -1.38 -0.12 0.00 -2.02 0.00 0.00 63.50 59.95 3b78 n PRO 638 Cb 0.59 -1.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.02 3b78 n PRO 638 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3b78 n ASP 639 N -3.76 -4.54 -0.63 2.55 8.00 -1.26 -1.44 116.55 115.47 3b78 n ASP 639 Ca 0.11 0.29 -0.08 0.00 0.71 0.00 0.00 54.79 55.82 3b78 n ASP 639 Cb 0.40 -3.67 -0.04 0.00 -0.02 0.00 0.00 41.12 37.80 3b78 n ASP 639 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3b78 n GLY 640 N 0.03 0.96 0.00 0.44 0.00 -1.24 -4.74 105.19 100.63 3b78 n GLY 640 Ca -0.12 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.60 3b78 n GLY 640 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3b78 n ASN 641 N -0.20 0.00 -4.69 1.61 0.23 -0.85 -4.32 115.26 107.04 3b78 n ASN 641 Ca -0.08 -1.00 -0.29 0.00 -0.53 0.00 0.00 54.58 52.68 3b78 n ASN 641 Cb 0.37 0.00 0.15 0.00 -2.08 0.00 0.00 39.78 38.22 3b78 n ASN 641 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 3b78 s GLY 642 N 0.00 1.58 0.00 4.83 0.00 -0.52 -4.77 107.32 108.44 3b78 s GLY 642 Ca 0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 44.72 44.15 3b78 s GLY 642 CO 0.00 0.04 2.18 -1.05 0.00 0.00 0.00 173.10 174.28 3b78 n PRO 643 N -3.89 1.13 -3.90 2.90 -0.02 -1.22 -3.45 135.00 126.55 3b78 n PRO 643 Ca 0.07 -0.38 -0.13 0.00 -2.02 0.00 0.00 63.50 61.04 3b78 n PRO 643 Cb 0.59 -1.51 -0.14 0.00 -0.02 0.00 0.00 33.50 32.42 3b78 n PRO 643 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 3b78 s ASN 644 N 2.13 0.08 0.03 2.55 0.01 -1.05 -0.83 114.94 117.86 3b78 s ASN 644 Ca 0.26 -0.01 0.05 0.00 -0.71 0.00 0.00 52.86 52.45 3b78 s ASN 644 Cb 0.12 -0.01 -0.02 0.00 0.41 0.00 0.00 41.25 41.75 3b78 s ASN 644 CO 0.00 0.00 -0.15 -0.76 -1.51 0.00 0.00 177.10 174.69 3b78 s LEU 645 N 0.01 2.15 -0.25 0.60 1.43 -0.95 -1.90 118.68 119.77 3b78 s LEU 645 Ca -0.00 -0.43 -0.06 0.00 -1.03 0.00 0.00 54.13 52.61 3b78 s LEU 645 Cb -0.01 -0.65 -0.01 0.00 0.03 0.00 0.00 46.19 45.56 3b78 s LEU 645 CO -0.00 0.06 0.03 -0.69 0.23 0.00 0.00 176.35 175.98 3b78 s VAL 646 N -0.76 3.80 -0.21 -1.59 1.01 -1.06 -0.81 120.40 120.77 3b78 s VAL 646 Ca 0.03 -0.48 -0.07 0.00 0.00 0.00 0.00 61.98 61.46 3b78 s VAL 646 Cb -0.08 -2.82 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 3b78 s VAL 646 CO 0.01 0.29 0.05 -0.63 0.00 0.00 0.00 175.10 174.82 3b78 s ILE 647 N 1.52 4.40 -0.50 2.22 -1.09 0.54 -0.42 121.20 127.87 3b78 s ILE 647 Ca 0.05 -0.16 -0.28 0.00 -2.23 0.00 0.00 60.65 58.03 3b78 s ILE 647 Cb -0.15 -3.01 0.03 0.00 -1.58 0.00 0.00 42.46 37.74 3b78 s ILE 647 CO 0.00 0.40 1.12 -0.62 -1.23 0.00 0.00 174.94 174.61 3b78 s ASP 648 N 1.04 6.57 -0.20 3.58 2.15 -0.65 -1.30 116.67 127.85 3b78 s ASP 648 Ca 0.04 0.32 0.12 0.00 0.43 0.00 0.00 52.55 53.46 3b78 s ASP 648 Cb -0.14 -2.53 0.41 0.00 -0.30 0.00 0.00 42.92 40.35 3b78 s ASP 648 CO 0.03 -1.28 1.21 0.00 -0.17 0.00 0.00 175.17 174.96 3b78 n GLN 649 N 7.87 1.54 -2.55 4.34 6.02 -0.25 -4.86 117.38 129.49 3b78 n GLN 649 Ca 0.10 -3.22 -0.27 0.00 -0.01 0.00 0.00 57.00 53.61 3b78 n GLN 649 Cb 0.49 -1.59 0.01 0.00 1.02 0.00 0.00 30.24 30.17 3b78 n GLN 649 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3b78 s THR 650 N -3.16 4.48 -0.09 5.09 -4.23 -1.08 -4.59 115.64 112.05 3b78 s THR 650 Ca 0.37 0.14 0.00 0.00 -1.18 0.00 0.00 61.69 61.02 3b78 s THR 650 Cb 0.36 -3.72 0.02 0.00 1.34 0.00 0.00 72.50 70.50 3b78 s THR 650 CO -0.06 -0.72 -0.07 -0.54 -0.54 0.00 0.00 174.62 172.68 3b78 s LYS 651 N -4.83 1.38 -1.13 3.99 1.02 -1.26 -4.89 119.74 114.02 3b78 s LYS 651 Ca 0.50 -0.23 -0.10 0.00 0.02 0.00 0.00 55.97 56.16 3b78 s LYS 651 Cb -0.10 -1.40 -0.03 0.00 -0.52 0.00 0.00 37.83 35.77 3b78 s LYS 651 CO 0.45 -0.19 0.84 0.00 -0.92 0.00 0.00 175.35 175.53 3b78 n ALA 652 N 4.64 -2.41 -3.20 5.17 0.00 -1.26 -4.98 120.51 118.48 3b78 n ALA 652 Ca -0.15 -0.06 -0.36 0.00 0.00 0.00 0.00 53.44 52.86 3b78 n ALA 652 Cb 0.50 -4.37 -0.13 0.00 0.00 0.00 0.00 19.45 15.46 3b78 n ALA 652 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3b78 s VAL 653 N -3.46 4.02 0.12 0.00 1.01 -1.26 -5.08 120.40 115.74 3b78 s VAL 653 Ca 0.36 -0.29 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 3b78 s VAL 653 Cb -0.09 -2.87 -0.07 0.00 0.00 0.00 0.00 36.38 33.35 3b78 s VAL 653 CO 0.80 0.35 1.15 -1.58 0.00 0.00 0.00 175.10 175.82 3b78 s GLN 654 N 1.57 4.51 -0.32 2.72 0.74 -1.26 -3.13 119.66 124.49 3b78 s GLN 654 Ca 0.06 1.74 0.00 0.00 0.05 0.00 0.00 55.36 57.21 3b78 s GLN 654 Cb -0.15 -3.31 0.00 0.00 1.10 0.00 0.00 33.01 30.65 3b78 s GLN 654 CO 0.02 -0.10 0.00 0.66 -0.55 0.00 0.00 175.29 175.32 3b78 n TYR 655 N 3.15 0.00 -0.33 1.67 0.53 -1.26 -4.79 117.16 116.13 3b78 n TYR 655 Ca 0.06 0.00 0.12 0.00 -1.02 0.00 0.00 57.90 57.05 3b78 n TYR 655 Cb 0.46 -1.22 0.30 0.00 -1.03 0.00 0.00 39.34 37.85 3b78 n TYR 655 CO 0.00 0.00 0.00 1.25 -1.02 0.00 0.00 176.86 177.09 3b78 h LEU 656 N 0.00 0.67 -1.77 7.72 5.85 -1.97 0.13 115.31 125.93 3b78 h LEU 656 Ca -0.06 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 3b78 h LEU 656 Cb 0.51 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.54 3b78 h LEU 656 CO 0.09 0.23 -0.01 1.12 -0.34 0.00 0.00 178.44 179.53 3b78 h HIS 657 N 0.68 0.00 0.00 1.25 2.07 -1.90 -2.75 115.15 114.50 3b78 h HIS 657 Ca 0.55 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.07 3b78 h HIS 657 Cb 0.86 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.84 3b78 h HIS 657 CO -0.04 0.01 0.00 0.39 -3.07 0.00 0.00 177.93 175.21 3b78 n GLU 658 N -3.11 0.39 -0.00 5.12 1.02 0.44 -2.96 120.64 121.55 3b78 n GLU 658 Ca -0.00 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 3b78 n GLU 658 Cb 0.26 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 3b78 n GLU 658 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 3b78 n ILE 659 N -1.29 0.24 -0.24 -3.67 -5.35 -1.04 -4.79 119.36 103.22 3b78 n ILE 659 Ca 0.13 -0.62 -0.03 0.00 -0.27 0.00 0.00 62.75 61.96 3b78 n ILE 659 Cb 0.23 0.89 0.08 0.00 -1.74 0.00 0.00 39.64 39.10 3b78 n ILE 659 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3b78 h LYS 660 N 0.09 0.78 -0.06 6.28 3.64 -1.53 -0.49 116.57 125.27 3b78 h LYS 660 Ca 0.00 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 3b78 h LYS 660 Cb 0.14 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 3b78 h LYS 660 CO 0.00 0.52 -0.19 -0.44 -2.27 0.00 0.00 179.45 177.07 3b78 h ASP 661 N 0.80 0.09 0.08 4.20 3.32 -1.86 -0.75 116.42 122.29 3b78 h ASP 661 Ca 0.28 -0.02 -0.29 0.00 0.02 0.00 0.00 57.03 57.03 3b78 h ASP 661 Cb 0.06 -0.02 0.03 0.00 0.22 0.00 0.00 39.33 39.61 3b78 h ASP 661 CO -0.12 0.28 -1.17 0.28 -1.72 0.00 0.00 179.24 176.80 3b78 h SER 662 N 0.09 0.89 -0.46 6.45 0.02 -1.67 -2.44 113.55 116.43 3b78 h SER 662 Ca 0.02 -0.78 -0.03 0.00 -0.84 0.00 0.00 61.79 60.16 3b78 h SER 662 Cb 0.39 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 3b78 h SER 662 CO 0.03 1.58 0.17 0.58 -1.14 0.00 0.00 176.83 178.05 3b78 h VAL 663 N 0.33 1.21 -0.47 2.27 2.07 -0.81 -1.24 116.25 119.61 3b78 h VAL 663 Ca -0.16 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 3b78 h VAL 663 Cb 1.83 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.37 3b78 h VAL 663 CO 0.23 0.25 0.23 0.58 0.02 0.00 0.00 177.57 178.87 3b78 h VAL 664 N 0.60 1.19 -0.44 2.57 2.07 -1.21 -1.89 116.25 119.13 3b78 h VAL 664 Ca 0.15 -0.53 0.02 0.00 0.82 0.00 0.00 66.70 67.16 3b78 h VAL 664 Cb 0.22 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 3b78 h VAL 664 CO -0.01 0.21 0.27 0.00 0.02 0.00 0.00 177.57 178.05 3b78 h ALA 665 N 1.07 0.56 -0.53 1.67 0.00 -1.26 -1.63 119.26 119.13 3b78 h ALA 665 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3b78 h ALA 665 Cb 0.12 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3b78 h ALA 665 CO -0.02 -0.05 0.33 0.00 0.00 0.00 0.00 179.25 179.52 3b78 h ALA 666 N 1.19 1.58 -0.24 0.00 0.00 -1.00 -2.12 119.26 118.67 3b78 h ALA 666 Ca 0.17 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 3b78 h ALA 666 Cb -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3b78 h ALA 666 CO -0.07 0.37 -0.39 0.35 0.00 0.00 0.00 179.25 179.51 3b78 h PHE 667 N 0.73 0.66 -0.73 0.00 3.57 -0.62 -0.55 116.94 120.00 3b78 h PHE 667 Ca 0.19 -0.19 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 3b78 h PHE 667 Cb -0.05 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 3b78 h PHE 667 CO 0.00 0.87 0.35 1.96 -2.23 0.00 0.00 178.31 179.26 3b78 h GLN 668 N 0.46 1.04 0.09 1.11 1.08 -0.64 -0.88 115.11 117.36 3b78 h GLN 668 Ca 0.04 -0.14 -0.25 0.00 -1.45 0.00 0.00 58.65 56.85 3b78 h GLN 668 Cb 0.89 -0.19 -0.00 0.00 -0.05 0.00 0.00 27.48 28.12 3b78 h GLN 668 CO 0.08 0.80 -1.15 -1.49 -0.95 0.00 0.00 178.83 176.11 3b78 h TRP 669 N 1.03 0.39 -0.29 2.96 4.06 -1.30 -3.01 115.95 119.79 3b78 h TRP 669 Ca 0.25 -0.28 -0.14 0.00 2.06 0.00 0.00 58.89 60.79 3b78 h TRP 669 Cb 0.10 -0.02 -0.01 0.00 -1.00 0.00 0.00 29.16 28.23 3b78 h TRP 669 CO 0.01 1.20 -0.39 0.00 -3.56 0.00 0.00 178.44 175.70 3b78 h ALA 670 N 0.70 0.76 0.00 1.49 0.00 -0.85 -3.05 119.26 118.30 3b78 h ALA 670 Ca -0.10 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3b78 h ALA 670 Cb 1.88 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.55 3b78 h ALA 670 CO 0.18 0.66 -0.37 1.79 0.00 0.00 0.00 179.25 181.51 3b78 h THR 671 N 0.57 0.00 0.03 0.00 1.35 -1.26 -3.31 112.91 110.29 3b78 h THR 671 Ca 0.05 -0.96 -0.27 0.00 -0.55 0.00 0.00 66.41 64.68 3b78 h THR 671 Cb 0.92 1.78 0.02 0.00 -1.73 0.00 0.00 68.15 69.14 3b78 h THR 671 CO 0.08 0.00 -1.08 0.50 -0.25 0.00 0.00 175.52 174.77 3b78 h LYS 672 N 0.00 0.63 -3.42 4.72 1.63 -1.50 0.17 116.57 118.80 3b78 h LYS 672 Ca 0.00 -0.72 -0.56 0.00 -0.85 0.00 0.00 60.65 58.52 3b78 h LYS 672 Cb 0.98 0.22 -0.40 0.00 -0.60 0.00 0.00 32.23 32.43 3b78 h LYS 672 CO 0.00 1.31 -0.76 -1.21 -3.45 0.00 0.00 179.45 175.33 3b78 s GLU 673 N -3.22 0.62 0.90 1.90 2.02 -1.16 -2.91 118.70 116.85 3b78 s GLU 673 Ca -0.09 -0.86 -0.12 0.00 0.02 0.00 0.00 54.97 53.92 3b78 s GLU 673 Cb 0.07 -1.87 0.13 0.00 0.10 0.00 0.00 34.13 32.56 3b78 s GLU 673 CO 0.92 -0.93 1.11 0.20 0.02 0.00 0.00 175.26 176.58 3b78 s GLY 674 N 1.75 1.59 0.51 -1.39 0.00 0.91 -4.73 107.32 105.97 3b78 s GLY 674 Ca 0.07 -0.37 0.30 0.00 0.00 0.00 0.00 44.72 44.73 3b78 s GLY 674 CO -0.24 0.16 1.89 -0.56 0.00 0.00 0.00 173.10 174.35 3b78 h PRO 675 N -1.48 0.00 0.27 2.90 0.13 -1.87 -2.12 132.00 129.83 3b78 h PRO 675 Ca -0.50 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 3b78 h PRO 675 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 3b78 h PRO 675 CO 0.60 0.04 -0.13 0.82 -0.23 0.00 0.00 178.00 179.09 3b78 h ILE 676 N 0.00 0.73 0.00 -3.56 2.04 -1.93 -3.43 117.51 111.36 3b78 h ILE 676 Ca -0.00 -0.71 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 3b78 h ILE 676 Cb 0.65 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 3b78 h ILE 676 CO 0.00 0.14 -0.12 2.22 0.00 0.00 0.00 178.15 180.39 3b78 n PHE 677 N -5.08 0.00 -0.45 1.37 -0.00 -1.25 -4.86 117.46 107.19 3b78 n PHE 677 Ca -0.09 -0.21 0.00 0.00 -0.00 0.00 0.00 57.45 57.15 3b78 n PHE 677 Cb 0.26 0.35 0.00 0.00 -0.00 0.00 0.00 39.48 40.09 3b78 n PHE 677 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3b78 n GLY 678 N 0.00 0.74 3.88 4.97 0.00 -0.79 -4.82 105.19 109.16 3b78 n GLY 678 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 3b78 n GLY 678 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3b78 s GLU 679 N -0.55 3.73 0.64 1.61 0.41 -1.26 -4.11 118.70 119.17 3b78 s GLU 679 Ca 0.00 0.50 -0.18 0.00 -0.41 0.00 0.00 54.97 54.88 3b78 s GLU 679 Cb 0.00 -2.32 -0.01 0.00 -1.78 0.00 0.00 34.13 30.01 3b78 s GLU 679 CO 0.00 -0.15 1.30 -1.21 -0.49 0.00 0.00 175.26 174.71 3b78 s GLU 680 N -4.19 2.58 0.54 1.61 2.02 -1.15 -0.06 118.70 120.05 3b78 s GLU 680 Ca 0.52 2.09 -0.10 0.00 0.02 0.00 0.00 54.97 57.50 3b78 s GLU 680 Cb -0.10 -1.87 -0.05 0.00 0.10 0.00 0.00 34.13 32.21 3b78 s GLU 680 CO 0.36 -1.58 0.91 -1.64 0.02 0.00 0.00 175.26 173.33 3b78 s MET 681 N -3.35 3.64 -0.18 1.61 -1.94 0.61 0.22 119.30 119.91 3b78 s MET 681 Ca 0.82 0.56 -0.15 0.00 -1.71 0.00 0.00 55.69 55.21 3b78 s MET 681 Cb -0.38 -2.22 0.05 0.00 2.01 0.00 0.00 34.83 34.29 3b78 s MET 681 CO 0.40 -0.35 0.48 0.50 -0.01 0.00 0.00 175.02 176.04 3b78 s ARG 682 N -4.76 0.54 -1.39 2.03 3.52 0.11 -4.76 118.95 114.24 3b78 s ARG 682 Ca 0.52 0.71 -0.08 0.00 -0.13 0.00 0.00 55.73 56.76 3b78 s ARG 682 Cb -0.11 0.22 0.01 0.00 -1.56 0.00 0.00 34.95 33.51 3b78 s ARG 682 CO 0.46 -0.08 1.03 0.43 -0.81 0.00 0.00 175.30 176.32 3b78 n SER 683 N 3.11 -6.29 -4.28 -2.12 7.64 -0.01 -4.44 113.62 107.22 3b78 n SER 683 Ca -0.15 -0.47 -0.35 0.00 1.01 0.00 0.00 58.87 58.90 3b78 n SER 683 Cb 0.57 -4.96 -0.14 0.00 -1.01 0.00 0.00 64.21 58.66 3b78 n SER 683 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3b78 s VAL 684 N -3.28 3.36 -0.19 0.44 1.01 -1.22 -0.68 120.40 119.83 3b78 s VAL 684 Ca 0.51 -0.70 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 3b78 s VAL 684 Cb -0.23 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 3b78 s VAL 684 CO 0.63 0.28 0.06 -0.60 0.00 0.00 0.00 175.10 175.47 3b78 s ARG 685 N 1.44 3.91 -0.19 2.72 3.52 0.37 -2.24 118.95 128.48 3b78 s ARG 685 Ca 0.03 -0.37 -0.03 0.00 -0.13 0.00 0.00 55.73 55.22 3b78 s ARG 685 Cb -0.16 -3.23 -0.01 0.00 -1.56 0.00 0.00 34.95 29.99 3b78 s ARG 685 CO -0.02 0.18 -0.05 0.08 -0.81 0.00 0.00 175.30 174.68 3b78 s VAL 686 N 0.61 3.50 -0.37 7.11 1.01 0.01 -0.51 120.40 131.77 3b78 s VAL 686 Ca 0.03 -0.47 -0.10 0.00 0.00 0.00 0.00 61.98 61.44 3b78 s VAL 686 Cb -0.13 -2.56 0.03 0.00 0.00 0.00 0.00 36.38 33.72 3b78 s VAL 686 CO 0.01 0.45 0.19 0.20 0.00 0.00 0.00 175.10 175.95 3b78 s ASN 687 N 1.06 5.67 -0.50 3.32 0.01 0.75 -0.34 114.94 124.90 3b78 s ASN 687 Ca 0.01 -1.00 -0.28 0.00 -0.71 0.00 0.00 52.86 50.87 3b78 s ASN 687 Cb -0.15 -2.00 0.01 0.00 0.41 0.00 0.00 41.25 39.53 3b78 s ASN 687 CO 0.00 -0.37 1.37 -0.63 -1.51 0.00 0.00 177.10 175.96 3b78 s ILE 688 N 1.53 3.88 -0.00 0.60 1.01 -0.42 -0.97 121.20 126.83 3b78 s ILE 688 Ca 0.02 0.82 -0.01 0.00 0.00 0.00 0.00 60.65 61.48 3b78 s ILE 688 Cb -0.19 -4.39 -0.27 0.00 0.01 0.00 0.00 42.46 37.62 3b78 s ILE 688 CO 0.06 -1.03 0.83 -0.07 0.00 0.00 0.00 174.94 174.73 3b78 h LEU 689 N 12.55 0.34 -7.00 2.97 3.38 -0.93 -0.60 115.31 126.02 3b78 h LEU 689 Ca -0.26 -0.49 -0.05 0.00 0.09 0.00 0.00 57.88 57.16 3b78 h LEU 689 Cb 1.09 -0.11 -0.19 0.00 0.09 0.00 0.00 40.66 41.55 3b78 h LEU 689 CO 1.14 1.41 0.21 -0.62 0.09 0.00 0.00 178.44 180.68 3b78 s ASP 690 N -6.89 -0.64 -0.08 -0.43 2.15 -0.94 -4.11 116.67 105.74 3b78 s ASP 690 Ca -0.09 0.64 -0.05 0.00 0.43 0.00 0.00 52.55 53.48 3b78 s ASP 690 Cb 0.07 0.53 0.03 0.00 -0.30 0.00 0.00 42.92 43.26 3b78 s ASP 690 CO 0.84 -0.63 0.19 -0.69 -0.17 0.00 0.00 175.17 174.71 3b78 s VAL 691 N -1.42 -0.03 -0.11 1.11 1.01 -1.26 -0.46 120.40 119.23 3b78 s VAL 691 Ca -0.09 0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.01 3b78 s VAL 691 Cb -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 36.38 36.09 3b78 s VAL 691 CO 0.07 0.04 -0.23 0.42 0.00 0.00 0.00 175.10 175.40 3b78 s THR 692 N 0.73 2.03 0.17 3.92 -4.23 -0.70 -4.86 115.64 112.70 3b78 s THR 692 Ca -0.05 -0.99 0.08 0.00 -1.18 0.00 0.00 61.69 59.55 3b78 s THR 692 Cb -0.07 -1.77 -0.04 0.00 1.34 0.00 0.00 72.50 71.96 3b78 s THR 692 CO -0.04 0.55 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.65 3b78 s LEU 693 N 0.53 2.45 0.19 4.79 1.43 -1.26 -1.17 118.68 125.64 3b78 s LEU 693 Ca -0.14 -0.88 -0.30 0.00 -1.03 0.00 0.00 54.13 51.78 3b78 s LEU 693 Cb -0.17 -0.81 -0.08 0.00 0.03 0.00 0.00 46.19 45.17 3b78 s LEU 693 CO 0.05 -0.05 1.05 -2.28 0.23 0.00 0.00 176.35 175.35 3b78 s HIS 694 N -2.14 3.69 0.28 0.29 5.65 -1.24 -4.95 115.29 116.88 3b78 s HIS 694 Ca 0.16 1.70 0.01 0.00 0.25 0.00 0.00 55.06 57.18 3b78 s HIS 694 Cb -0.05 -3.19 0.56 0.00 -1.18 0.00 0.00 32.58 28.72 3b78 s HIS 694 CO 0.07 -0.28 1.82 0.00 -0.65 0.00 0.00 174.74 175.69 3b78 h ALA 695 N 4.86 1.49 -2.42 1.58 0.00 -1.97 -3.40 119.26 119.40 3b78 h ALA 695 Ca -0.44 0.03 -0.56 0.00 0.00 0.00 0.00 54.91 53.94 3b78 h ALA 695 Cb 1.21 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 3b78 h ALA 695 CO 0.71 0.17 0.37 -0.51 0.00 0.00 0.00 179.25 179.99 3b78 s ASP 696 N -5.63 7.14 0.44 0.00 1.01 -1.26 -4.93 116.67 113.43 3b78 s ASP 696 Ca -0.12 1.39 0.30 0.00 0.71 0.00 0.00 52.55 54.83 3b78 s ASP 696 Cb 0.22 -2.50 1.44 0.00 1.01 0.00 0.00 42.92 43.09 3b78 s ASP 696 CO 0.80 -0.32 1.91 0.00 0.21 0.00 0.00 175.17 177.78 3b78 h ALA 697 N 7.02 1.00 0.00 5.23 0.00 -2.03 -3.34 119.26 127.14 3b78 h ALA 697 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3b78 h ALA 697 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3b78 h ALA 697 CO 0.80 0.00 0.00 -0.89 0.00 0.00 0.00 179.25 179.16 3b78 n ILE 698 N -2.65 0.26 -0.64 0.00 5.41 -1.26 -3.72 119.36 116.76 3b78 n ILE 698 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 3b78 n ILE 698 Cb 0.17 -0.61 0.00 0.00 -0.71 0.00 0.00 39.64 38.49 3b78 n ILE 698 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 3b78 n ARG 700 N 0.83 -0.40 -0.43 0.38 1.85 -1.26 -5.07 116.66 112.56 3b78 n ARG 700 Ca 0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.79 3b78 n ARG 700 Cb 0.13 0.00 0.04 0.00 -1.05 0.00 0.00 32.46 31.59 3b78 n ARG 700 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3b78 n GLY 701 N -0.22 -1.16 0.25 2.89 0.00 -1.24 -4.69 105.19 101.01 3b78 n GLY 701 Ca 0.00 -1.69 -0.02 0.00 0.00 0.00 0.00 46.02 44.31 3b78 n GLY 701 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3b78 h GLY 702 N -0.38 0.92 1.83 -0.02 0.00 -1.96 -0.64 103.07 102.82 3b78 h GLY 702 Ca -0.09 -0.24 0.01 0.00 0.00 0.00 0.00 47.33 47.01 3b78 h GLY 702 CO 0.07 0.14 0.07 -1.33 0.00 0.00 0.00 176.54 175.49 3b78 h GLY 703 N 0.64 0.00 0.28 4.60 0.00 -2.00 -0.53 103.07 106.05 3b78 h GLY 703 Ca 0.28 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 47.26 3b78 h GLY 703 CO -0.18 0.00 -1.98 -1.06 0.00 0.00 0.00 176.54 173.32 3b78 n GLN 704 N -3.67 0.67 0.01 4.80 1.13 -0.60 -4.52 117.38 115.20 3b78 n GLN 704 Ca -0.02 0.31 -0.18 0.00 -1.94 0.00 0.00 57.00 55.18 3b78 n GLN 704 Cb 0.16 -1.66 -0.14 0.00 0.11 0.00 0.00 30.24 28.71 3b78 n GLN 704 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 3b78 h ILE 705 N -0.31 1.61 -0.32 5.09 1.08 -0.92 -3.31 117.51 120.43 3b78 h ILE 705 Ca -0.47 -2.46 0.07 0.00 -0.39 0.00 0.00 64.86 61.61 3b78 h ILE 705 Cb 1.79 3.27 -0.07 0.00 -3.07 0.00 0.00 36.82 38.73 3b78 h ILE 705 CO -0.07 0.68 -0.17 0.40 -0.69 0.00 0.00 178.15 178.30 3b78 h ILE 706 N -0.59 0.50 -0.55 -0.67 2.04 -1.33 0.45 117.51 117.37 3b78 h ILE 706 Ca -0.09 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 3b78 h ILE 706 Cb 1.41 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.97 3b78 h ILE 706 CO 0.10 0.00 0.18 -0.65 0.00 0.00 0.00 178.15 177.77 3b78 h PRO 707 N -0.12 0.81 0.06 2.37 0.11 -1.77 -1.65 132.00 131.82 3b78 h PRO 707 Ca 0.17 -0.14 -0.00 0.00 0.11 0.00 0.00 66.00 66.13 3b78 h PRO 707 Cb 0.37 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.35 3b78 h PRO 707 CO -0.40 0.70 -0.03 1.15 -0.21 0.00 0.00 178.00 179.21 3b78 h THR 708 N 0.79 0.99 -0.56 -1.15 2.02 -1.24 -1.92 112.91 111.85 3b78 h THR 708 Ca 0.18 -0.17 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 3b78 h THR 708 Cb 0.22 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 3b78 h THR 708 CO -0.01 0.04 0.23 -0.03 0.37 0.00 0.00 175.52 176.12 3b78 h MET 709 N -0.16 0.83 -0.33 6.66 1.85 -0.82 -1.17 114.93 121.78 3b78 h MET 709 Ca -0.01 -0.15 0.00 0.00 -0.61 0.00 0.00 59.70 58.94 3b78 h MET 709 Cb 0.13 -0.14 -0.02 0.00 0.43 0.00 0.00 31.60 32.01 3b78 h MET 709 CO 0.01 0.72 0.22 0.00 -0.40 0.00 0.00 176.91 177.46 3b78 h ARG 710 N 0.76 0.43 -0.14 0.39 3.08 -1.22 -0.20 114.38 117.48 3b78 h ARG 710 Ca 0.19 -0.03 -0.17 0.00 0.07 0.00 0.00 59.98 60.04 3b78 h ARG 710 Cb 0.19 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3b78 h ARG 710 CO -0.02 0.29 -0.60 0.00 -1.07 0.00 0.00 179.97 178.56 3b78 h ARG 711 N 0.45 0.49 -0.71 0.04 3.08 -1.23 -1.41 114.38 115.09 3b78 h ARG 711 Ca 0.12 -0.33 -0.07 0.00 0.07 0.00 0.00 59.98 59.77 3b78 h ARG 711 Cb -0.05 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3b78 h ARG 711 CO -0.03 0.95 0.19 0.00 -1.07 0.00 0.00 179.97 180.00 3b78 h ALA 712 N 0.98 0.93 -0.43 0.04 0.00 -1.05 -0.49 119.26 119.24 3b78 h ALA 712 Ca -0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3b78 h ALA 712 Cb 1.15 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3b78 h ALA 712 CO 0.11 0.65 0.22 1.15 0.00 0.00 0.00 179.25 181.37 3b78 h THR 713 N 1.06 1.17 -0.31 0.00 2.02 -0.78 -0.05 112.91 116.03 3b78 h THR 713 Ca 0.22 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.95 3b78 h THR 713 Cb 0.35 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 3b78 h THR 713 CO -0.00 0.18 0.20 1.88 0.37 0.00 0.00 175.52 178.15 3b78 h TYR 714 N 0.55 0.39 -0.66 3.16 -1.99 -1.04 0.10 116.97 117.48 3b78 h TYR 714 Ca 0.15 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.89 3b78 h TYR 714 Cb 0.09 -0.13 -0.03 0.00 2.00 0.00 0.00 36.73 38.65 3b78 h TYR 714 CO -0.02 0.26 0.42 0.00 -0.00 0.00 0.00 178.16 178.82 3b78 h ALA 715 N 1.10 0.83 -0.38 3.88 0.00 -0.89 -1.18 119.26 122.63 3b78 h ALA 715 Ca 0.11 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 3b78 h ALA 715 Cb -0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 3b78 h ALA 715 CO -0.02 0.28 -0.22 0.78 0.00 0.00 0.00 179.25 180.07 3b78 h GLY 716 N 0.89 0.81 0.88 0.00 0.00 -0.73 -2.60 103.07 102.32 3b78 h GLY 716 Ca 0.24 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 3b78 h GLY 716 CO -0.05 0.63 -0.00 -2.75 0.00 0.00 0.00 176.54 174.36 3b78 h PHE 717 N 0.66 -0.01 0.00 5.60 3.57 -0.46 -2.89 116.94 123.41 3b78 h PHE 717 Ca 0.09 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3b78 h PHE 717 Cb 0.72 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.46 3b78 h PHE 717 CO 0.04 0.12 0.00 1.28 -2.23 0.00 0.00 178.31 177.51 3b78 n LEU 718 N -5.04 0.39 -0.14 0.59 4.77 -0.48 -1.77 117.00 115.32 3b78 n LEU 718 Ca -0.07 0.60 0.12 0.00 -0.03 0.00 0.00 56.01 56.63 3b78 n LEU 718 Cb 0.09 -0.55 0.28 0.00 -2.33 0.00 0.00 43.42 40.91 3b78 n LEU 718 CO 0.33 -0.45 0.51 0.18 -1.33 0.00 0.00 177.39 176.64 3b78 n LEU 719 N -1.93 0.86 -2.75 2.23 4.77 -0.99 -4.34 117.00 114.84 3b78 n LEU 719 Ca 0.02 -0.19 -0.36 0.00 -0.03 0.00 0.00 56.01 55.46 3b78 n LEU 719 Cb 0.19 -0.16 0.03 0.00 -2.33 0.00 0.00 43.42 41.15 3b78 n LEU 719 CO 0.16 0.18 1.10 0.00 -1.33 0.00 0.00 177.39 177.50 3b78 n ALA 720 N -1.02 6.04 -1.02 -1.18 0.00 -0.73 -0.69 120.51 121.92 3b78 n ALA 720 Ca 0.09 -4.17 -0.01 0.00 0.00 0.00 0.00 53.44 49.35 3b78 n ALA 720 Cb 0.35 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.29 3b78 n ALA 720 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3b78 n ASP 721 N -0.53 -1.08 -4.73 0.00 3.85 -1.26 -3.37 116.55 109.43 3b78 n ASP 721 Ca 0.49 0.05 -0.35 0.00 -0.71 0.00 0.00 54.79 54.28 3b78 n ASP 721 Cb 0.39 -0.27 0.08 0.00 -1.35 0.00 0.00 41.12 39.97 3b78 n ASP 721 CO 0.00 0.00 0.00 -2.84 -1.01 0.00 0.00 177.20 173.35 3b78 s PRO 722 N -0.20 2.30 0.16 0.11 0.02 -1.26 -3.52 135.00 132.61 3b78 s PRO 722 Ca 0.01 1.83 -0.05 0.00 0.02 0.00 0.00 61.00 62.82 3b78 s PRO 722 Cb -0.00 -1.84 -0.03 0.00 0.02 0.00 0.00 34.50 32.65 3b78 s PRO 722 CO 0.02 -1.73 0.17 0.15 -0.33 0.00 0.00 177.00 175.28 3b78 s LYS 723 N -3.74 1.07 0.11 5.54 -0.14 0.11 -4.63 119.74 118.07 3b78 s LYS 723 Ca 0.76 -1.35 0.09 0.00 -1.36 0.00 0.00 55.97 54.12 3b78 s LYS 723 Cb -0.31 0.31 -0.04 0.00 -1.68 0.00 0.00 37.83 36.11 3b78 s LYS 723 CO 0.43 -0.35 -0.24 0.96 -0.76 0.00 0.00 175.35 175.39 3b78 s ILE 724 N -4.03 1.96 0.01 2.17 -4.36 -1.26 -0.63 121.20 115.05 3b78 s ILE 724 Ca 0.23 -1.64 0.06 0.00 -0.26 0.00 0.00 60.65 59.04 3b78 s ILE 724 Cb 0.05 -1.75 -0.03 0.00 1.25 0.00 0.00 42.46 41.98 3b78 s ILE 724 CO 0.03 0.01 -0.16 -1.10 0.24 0.00 0.00 174.94 173.95 3b78 s GLN 725 N -1.96 2.25 -0.02 0.37 -0.21 0.13 -1.44 119.66 118.78 3b78 s GLN 725 Ca 0.10 -0.87 0.03 0.00 0.02 0.00 0.00 55.36 54.64 3b78 s GLN 725 Cb -0.10 -2.26 -0.03 0.00 1.00 0.00 0.00 33.01 31.62 3b78 s GLN 725 CO 0.05 0.57 -0.09 -1.83 -2.12 0.00 0.00 175.29 171.87 3b78 s GLU 726 N -1.16 2.55 0.40 2.91 -1.05 0.47 -1.48 118.70 121.33 3b78 s GLU 726 Ca 0.14 -0.70 -0.25 0.00 -0.15 0.00 0.00 54.97 54.00 3b78 s GLU 726 Cb -0.11 -2.48 -0.08 0.00 -0.44 0.00 0.00 34.13 31.02 3b78 s GLU 726 CO 0.04 0.62 1.19 -1.25 0.95 0.00 0.00 175.26 176.80 3b78 s PRO 727 N -1.17 4.06 -0.05 -4.83 0.04 -1.26 -0.53 135.00 131.26 3b78 s PRO 727 Ca 0.15 1.88 0.01 0.00 0.04 0.00 0.00 61.00 63.09 3b78 s PRO 727 Cb -0.11 -2.70 0.02 0.00 0.04 0.00 0.00 34.50 31.75 3b78 s PRO 727 CO 0.05 -0.33 -0.06 0.08 0.04 0.00 0.00 177.00 176.78 3b78 s VAL 728 N -1.39 0.67 0.42 -0.36 1.01 -0.24 -2.00 120.40 118.51 3b78 s VAL 728 Ca 0.57 -0.20 -0.16 0.00 0.00 0.00 0.00 61.98 62.18 3b78 s VAL 728 Cb -0.32 -0.67 -0.09 0.00 0.00 0.00 0.00 36.38 35.31 3b78 s VAL 728 CO 0.40 0.25 0.86 -0.36 0.00 0.00 0.00 175.10 176.26 3b78 s PHE 729 N 0.85 3.40 -0.29 5.22 0.08 0.42 -0.83 117.98 126.83 3b78 s PHE 729 Ca -0.12 1.34 -0.09 0.00 0.12 0.00 0.00 56.93 58.18 3b78 s PHE 729 Cb -0.15 -2.66 -0.02 0.00 -0.57 0.00 0.00 43.02 39.62 3b78 s PHE 729 CO 0.01 -0.12 0.13 -1.17 -0.10 0.00 0.00 175.22 173.97 3b78 s LEU 730 N -3.51 3.88 -0.14 -0.37 2.96 0.46 -1.37 118.68 120.59 3b78 s LEU 730 Ca 0.57 -0.32 -0.06 0.00 -0.22 0.00 0.00 54.13 54.10 3b78 s LEU 730 Cb -0.10 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 3b78 s LEU 730 CO 0.23 -0.11 0.06 -0.69 -1.32 0.00 0.00 176.35 174.51 3b78 s VAL 731 N 1.64 4.79 -0.17 1.68 1.01 0.95 -1.83 120.40 128.47 3b78 s VAL 731 Ca 0.06 -0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.00 3b78 s VAL 731 Cb -0.16 -3.11 0.02 0.00 0.00 0.00 0.00 36.38 33.14 3b78 s VAL 731 CO 0.06 0.53 -0.16 -0.70 0.00 0.00 0.00 175.10 174.83 3b78 s GLU 732 N -0.24 2.59 -0.14 2.72 2.12 0.22 -1.31 118.70 124.66 3b78 s GLU 732 Ca 0.08 -0.75 0.01 0.00 0.36 0.00 0.00 54.97 54.67 3b78 s GLU 732 Cb -0.12 -2.39 0.02 0.00 0.26 0.00 0.00 34.13 31.90 3b78 s GLU 732 CO 0.01 -0.26 -0.16 0.42 -0.54 0.00 0.00 175.26 174.74 3b78 s ILE 733 N 1.37 1.65 0.05 -3.70 1.01 0.17 -1.74 121.20 120.02 3b78 s ILE 733 Ca 0.04 -0.70 -0.19 0.00 0.00 0.00 0.00 60.65 59.79 3b78 s ILE 733 Cb -0.14 -1.53 -0.06 0.00 0.01 0.00 0.00 42.46 40.75 3b78 s ILE 733 CO -0.11 0.47 0.57 -1.10 0.00 0.00 0.00 174.94 174.77 3b78 s GLN 734 N 1.29 4.22 -0.28 2.79 1.11 -1.04 -0.62 119.66 127.13 3b78 s GLN 734 Ca 0.01 0.73 -0.23 0.00 0.01 0.00 0.00 55.36 55.88 3b78 s GLN 734 Cb -0.14 -3.26 0.12 0.00 -1.01 0.00 0.00 33.01 28.72 3b78 s GLN 734 CO -0.08 0.57 0.98 0.00 0.01 0.00 0.00 175.29 176.77 3b78 n PRO 736 N 2.65 2.49 -0.33 0.00 -0.02 -1.26 -0.60 135.00 137.92 3b78 n PRO 736 Ca -0.14 0.87 0.22 0.00 -2.02 0.00 0.00 63.50 62.44 3b78 n PRO 736 Cb 0.56 -2.59 0.45 0.00 -0.02 0.00 0.00 33.50 31.90 3b78 n PRO 736 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3b78 h GLU 737 N 2.75 0.28 -0.94 -0.52 4.81 -0.77 -0.09 114.58 120.08 3b78 h GLU 737 Ca -0.50 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 58.78 3b78 h GLU 737 Cb 1.26 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 30.51 3b78 h GLU 737 CO 0.63 0.18 0.61 -0.56 -0.73 0.00 0.00 179.01 179.15 3b78 h GLN 738 N 0.28 1.07 -0.26 1.92 3.07 -1.90 -2.86 115.11 116.44 3b78 h GLN 738 Ca 0.71 -0.06 0.00 0.00 0.09 0.00 0.00 58.65 59.39 3b78 h GLN 738 Cb 1.61 -0.24 0.00 0.00 0.08 0.00 0.00 27.48 28.93 3b78 h GLN 738 CO -0.63 0.71 0.00 0.00 0.09 0.00 0.00 178.83 179.00 3b78 n ALA 739 N -2.38 2.40 0.09 0.06 0.00 -0.10 -4.45 120.51 116.13 3b78 n ALA 739 Ca 0.14 -0.89 0.07 0.00 0.00 0.00 0.00 53.44 52.76 3b78 n ALA 739 Cb 0.18 -0.68 0.53 0.00 0.00 0.00 0.00 19.45 19.47 3b78 n ALA 739 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3b78 h VAL 740 N 3.61 1.03 -0.85 0.00 2.07 -1.17 -2.31 116.25 118.62 3b78 h VAL 740 Ca 0.00 -0.10 0.12 0.00 0.82 0.00 0.00 66.70 67.54 3b78 h VAL 740 Cb 0.83 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 3b78 h VAL 740 CO 0.00 0.05 0.55 1.23 0.02 0.00 0.00 177.57 179.43 3b78 h GLY 741 N 0.30 1.14 1.80 2.17 0.00 -1.78 -0.95 103.07 105.75 3b78 h GLY 741 Ca 0.11 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.11 3b78 h GLY 741 CO -0.02 0.13 -0.01 -1.33 0.00 0.00 0.00 176.54 175.30 3b78 h GLY 742 N 0.72 0.28 0.83 4.60 0.00 -1.61 -2.39 103.07 105.49 3b78 h GLY 742 Ca 0.41 -0.14 0.02 0.00 0.00 0.00 0.00 47.33 47.62 3b78 h GLY 742 CO -0.18 0.13 0.12 -2.22 0.00 0.00 0.00 176.54 174.39 3b78 h ILE 743 N 0.26 0.96 -0.14 2.60 2.04 -1.29 -1.92 117.51 120.02 3b78 h ILE 743 Ca 0.06 -0.09 -0.12 0.00 1.00 0.00 0.00 64.86 65.71 3b78 h ILE 743 Cb 0.20 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 3b78 h ILE 743 CO 0.01 0.05 -0.44 1.88 0.00 0.00 0.00 178.15 179.65 3b78 h TYR 744 N 0.25 0.41 -0.91 1.37 0.05 -1.54 -2.17 116.97 114.43 3b78 h TYR 744 Ca 0.12 -0.12 0.02 0.00 0.05 0.00 0.00 58.73 58.80 3b78 h TYR 744 Cb 0.06 -0.09 -0.05 0.00 1.01 0.00 0.00 36.73 37.66 3b78 h TYR 744 CO -0.11 0.73 0.60 1.03 -1.05 0.00 0.00 178.16 179.35 3b78 h SER 745 N 0.28 1.02 0.16 3.88 0.87 -1.01 -1.55 113.55 117.19 3b78 h SER 745 Ca 0.02 -0.02 -0.26 0.00 -1.23 0.00 0.00 61.79 60.30 3b78 h SER 745 Cb 0.89 -0.24 0.02 0.00 -0.44 0.00 0.00 62.40 62.62 3b78 h SER 745 CO 0.07 0.72 -1.06 0.58 -0.53 0.00 0.00 176.83 176.60 3b78 h VAL 746 N 1.19 1.33 -0.08 2.23 2.07 -1.19 -3.28 116.25 118.51 3b78 h VAL 746 Ca 0.35 -2.39 -0.09 0.00 0.82 0.00 0.00 66.70 65.39 3b78 h VAL 746 Cb -0.06 2.48 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 3b78 h VAL 746 CO -0.10 0.73 -0.36 -0.07 0.02 0.00 0.00 177.57 177.79 3b78 h LEU 747 N 0.31 0.16 -1.39 2.57 3.38 -1.19 -3.07 115.31 116.08 3b78 h LEU 747 Ca -0.13 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.78 3b78 h LEU 747 Cb 1.72 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.42 3b78 h LEU 747 CO 0.20 0.51 0.00 0.78 0.09 0.00 0.00 178.44 180.02 3b78 h ASN 748 N 0.14 0.00 -0.13 -0.43 2.35 -1.35 -1.64 115.58 114.53 3b78 h ASN 748 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3b78 h ASN 748 Cb 0.70 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.07 3b78 h ASN 748 CO 0.05 0.00 0.00 2.29 -1.65 0.00 0.00 177.43 178.12 3b78 n LYS 749 N -2.63 2.09 -0.47 0.81 2.85 -1.16 -4.51 118.16 115.14 3b78 n LYS 749 Ca 0.00 -2.70 0.06 0.00 -1.05 0.00 0.00 58.31 54.62 3b78 n LYS 749 Cb 0.20 -1.66 0.10 0.00 -0.65 0.00 0.00 35.03 33.01 3b78 n LYS 749 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3b78 n LYS 750 N -0.98 0.81 -2.50 -1.58 4.01 -0.71 -4.97 118.16 112.24 3b78 n LYS 750 Ca 0.18 -2.19 -0.12 0.00 -0.51 0.00 0.00 58.31 55.68 3b78 n LYS 750 Cb 0.76 -1.05 -0.00 0.00 -0.51 0.00 0.00 35.03 34.23 3b78 n LYS 750 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 3b78 n ARG 751 N -0.72 -2.37 -1.69 1.97 1.74 -1.22 -4.50 116.66 109.88 3b78 n ARG 751 Ca 0.11 0.55 -0.33 0.00 -0.77 0.00 0.00 57.85 57.42 3b78 n ARG 751 Cb 0.73 -5.16 0.05 0.00 -1.02 0.00 0.00 32.46 27.07 3b78 n ARG 751 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3b78 s GLY 752 N -2.07 2.06 -0.23 -0.13 0.00 -0.70 -4.67 107.32 101.57 3b78 s GLY 752 Ca 0.03 0.48 -0.03 0.00 0.00 0.00 0.00 44.72 45.19 3b78 s GLY 752 CO 0.03 0.82 0.07 1.62 0.00 0.00 0.00 173.10 175.65 3b78 s GLN 753 N -4.25 0.51 0.08 2.90 0.74 -0.31 -4.86 119.66 114.46 3b78 s GLN 753 Ca 0.65 -0.53 -0.31 0.00 0.05 0.00 0.00 55.36 55.22 3b78 s GLN 753 Cb -0.19 -1.88 -0.09 0.00 1.10 0.00 0.00 33.01 31.94 3b78 s GLN 753 CO 0.44 -0.78 1.72 0.08 -0.55 0.00 0.00 175.29 176.20 3b78 s VAL 754 N 1.89 2.87 -0.17 1.34 1.01 -1.26 -0.48 120.40 125.60 3b78 s VAL 754 Ca 0.03 0.33 -0.12 0.00 0.00 0.00 0.00 61.98 62.22 3b78 s VAL 754 Cb -0.17 -3.21 -0.22 0.00 0.00 0.00 0.00 36.38 32.78 3b78 s VAL 754 CO -0.17 -0.00 0.23 0.52 0.00 0.00 0.00 175.10 175.68 3b78 n VAL 755 N 4.76 1.66 -3.53 2.92 0.31 0.17 -4.92 118.33 119.70 3b78 n VAL 755 Ca 0.17 -0.40 -0.10 0.00 -0.01 0.00 0.00 64.34 64.00 3b78 n VAL 755 Cb 0.40 -1.84 -0.04 0.00 -0.91 0.00 0.00 33.84 31.45 3b78 n VAL 755 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3b78 s SER 756 N -6.97 -0.41 -0.16 4.52 1.04 -0.92 -5.00 113.70 105.80 3b78 s SER 756 Ca -0.27 0.22 -0.01 0.00 0.48 0.00 0.00 55.95 56.38 3b78 s SER 756 Cb 0.07 0.38 0.04 0.00 0.10 0.00 0.00 66.02 66.61 3b78 s SER 756 CO 0.68 -0.54 -0.04 -0.70 0.98 0.00 0.00 173.24 173.62 3b78 s GLU 757 N -2.22 1.26 0.10 4.02 2.12 -1.26 -1.49 118.70 121.22 3b78 s GLU 757 Ca 0.01 -0.44 0.09 0.00 0.36 0.00 0.00 54.97 54.99 3b78 s GLU 757 Cb -0.01 -1.91 -0.03 0.00 0.26 0.00 0.00 34.13 32.44 3b78 s GLU 757 CO -0.03 -0.44 -0.23 -2.00 -0.54 0.00 0.00 175.26 172.01 3b78 s GLU 758 N 1.69 1.31 -0.11 4.30 2.12 -0.32 -4.98 118.70 122.71 3b78 s GLU 758 Ca 0.01 -1.19 0.02 0.00 0.36 0.00 0.00 54.97 54.17 3b78 s GLU 758 Cb -0.15 -1.62 -0.01 0.00 0.26 0.00 0.00 34.13 32.61 3b78 s GLU 758 CO -0.07 0.39 -0.19 -1.14 -0.54 0.00 0.00 175.26 173.71 3b78 s GLN 759 N -1.80 3.13 -0.15 4.30 0.74 -1.26 0.48 119.66 125.10 3b78 s GLN 759 Ca 0.09 -0.79 -0.29 0.00 0.05 0.00 0.00 55.36 54.43 3b78 s GLN 759 Cb -0.10 -2.44 -0.04 0.00 1.10 0.00 0.00 33.01 31.53 3b78 s GLN 759 CO 0.04 0.24 1.73 0.50 -0.55 0.00 0.00 175.29 177.25 3b78 s ARG 760 N 0.25 3.87 -0.01 1.67 3.52 0.08 -4.91 118.95 123.41 3b78 s ARG 760 Ca -0.13 1.95 -0.34 0.00 -0.13 0.00 0.00 55.73 57.09 3b78 s ARG 760 Cb -0.16 -4.07 -0.12 0.00 -1.56 0.00 0.00 34.95 29.03 3b78 s ARG 760 CO 0.07 -1.22 1.81 -0.35 -0.81 0.00 0.00 175.30 174.79 3b78 n PRO 761 N 7.62 2.22 0.00 5.12 -0.04 -1.26 -2.17 135.00 146.50 3b78 n PRO 761 Ca 0.20 0.81 0.00 0.00 -0.04 0.00 0.00 63.50 64.47 3b78 n PRO 761 Cb 0.44 -2.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.25 3b78 n PRO 761 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3b78 n GLY 762 N 4.16 3.10 3.96 0.55 0.00 -1.26 -5.02 105.19 110.68 3b78 n GLY 762 Ca 0.21 -0.87 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 3b78 n GLY 762 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3b78 s THR 763 N -0.99 3.97 -0.33 2.61 -4.23 -0.92 -5.00 115.64 110.75 3b78 s THR 763 Ca 0.00 -0.62 0.03 0.00 -1.18 0.00 0.00 61.69 59.92 3b78 s THR 763 Cb 0.00 -3.45 0.49 0.00 1.34 0.00 0.00 72.50 70.89 3b78 s THR 763 CO 0.00 -0.28 1.65 -0.81 -0.54 0.00 0.00 174.62 174.64 3b78 n PRO 764 N -1.98 2.01 -3.48 3.99 -0.04 -1.26 -4.59 135.00 129.65 3b78 n PRO 764 Ca 0.01 -2.19 -0.38 0.00 -0.04 0.00 0.00 63.50 60.91 3b78 n PRO 764 Cb 0.58 -1.87 -0.08 0.00 -0.04 0.00 0.00 33.50 32.09 3b78 n PRO 764 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3b78 s LEU 765 N -2.37 4.13 -0.04 1.53 2.96 -1.26 0.02 118.68 123.65 3b78 s LEU 765 Ca 0.41 0.36 0.01 0.00 -0.22 0.00 0.00 54.13 54.69 3b78 s LEU 765 Cb 0.35 -2.37 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 3b78 s LEU 765 CO 0.08 -0.04 -0.03 -0.36 -1.32 0.00 0.00 176.35 174.68 3b78 s PHE 766 N 1.30 3.03 -0.25 5.38 0.40 0.23 -0.74 117.98 127.34 3b78 s PHE 766 Ca 0.15 0.08 -0.05 0.00 -0.60 0.00 0.00 56.93 56.51 3b78 s PHE 766 Cb -0.14 -1.70 -0.00 0.00 0.51 0.00 0.00 43.02 41.68 3b78 s PHE 766 CO 0.07 0.42 0.01 0.99 0.70 0.00 0.00 175.22 177.41 3b78 s THR 767 N -0.95 3.63 -0.19 0.64 2.01 0.18 -1.21 115.64 119.76 3b78 s THR 767 Ca 0.16 -0.55 -0.03 0.00 0.31 0.00 0.00 61.69 61.58 3b78 s THR 767 Cb -0.11 -2.75 -0.01 0.00 0.01 0.00 0.00 72.50 69.64 3b78 s THR 767 CO 0.05 0.29 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.52 3b78 s VAL 768 N 1.49 3.33 -0.09 3.82 1.01 0.21 -1.17 120.40 129.00 3b78 s VAL 768 Ca 0.04 -0.53 -0.00 0.00 0.00 0.00 0.00 61.98 61.50 3b78 s VAL 768 Cb -0.15 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 3b78 s VAL 768 CO -0.01 0.46 -0.07 -0.54 0.00 0.00 0.00 175.10 174.94 3b78 s LYS 769 N 1.05 3.00 0.07 2.72 1.02 -0.55 -0.65 119.74 126.39 3b78 s LYS 769 Ca 0.00 -0.57 -0.22 0.00 0.02 0.00 0.00 55.97 55.21 3b78 s LYS 769 Cb -0.15 -2.65 0.05 0.00 -0.52 0.00 0.00 37.83 34.57 3b78 s LYS 769 CO -0.01 0.52 0.52 0.00 -0.92 0.00 0.00 175.35 175.47 3b78 s ALA 770 N -0.42 -1.33 -0.06 5.17 0.00 -0.43 0.42 121.76 125.11 3b78 s ALA 770 Ca 0.06 0.54 -0.21 0.00 0.00 0.00 0.00 51.96 52.35 3b78 s ALA 770 Cb -0.12 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 23.42 3b78 s ALA 770 CO 0.02 -0.55 0.60 0.71 0.00 0.00 0.00 175.76 176.55 3b78 s TYR 771 N -2.70 3.60 -0.13 0.00 2.02 0.36 -0.04 117.35 120.47 3b78 s TYR 771 Ca -0.04 1.13 -0.02 0.00 -0.37 0.00 0.00 57.07 57.78 3b78 s TYR 771 Cb -0.00 -2.66 0.04 0.00 -0.40 0.00 0.00 41.96 38.93 3b78 s TYR 771 CO -0.04 0.21 0.00 -1.17 -1.57 0.00 0.00 175.55 172.98 3b78 s LEU 772 N 0.38 0.96 0.21 -1.29 2.96 -0.47 -1.16 118.68 120.27 3b78 s LEU 772 Ca 0.32 -0.43 -0.32 0.00 -0.22 0.00 0.00 54.13 53.47 3b78 s LEU 772 Cb -0.17 -0.58 -0.14 0.00 0.50 0.00 0.00 46.19 45.81 3b78 s LEU 772 CO 0.16 -0.23 1.45 -2.65 -1.32 0.00 0.00 176.35 173.76 3b78 n PRO 773 N 5.07 2.04 -0.10 0.98 -0.02 -1.26 -0.44 135.00 141.27 3b78 n PRO 773 Ca -0.09 0.73 0.08 0.00 -2.02 0.00 0.00 63.50 62.20 3b78 n PRO 773 Cb 0.49 -2.42 0.43 0.00 -0.02 0.00 0.00 33.50 31.98 3b78 n PRO 773 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3b78 h VAL 774 N 3.22 0.99 0.00 -1.45 2.07 -1.75 0.48 116.25 119.80 3b78 h VAL 774 Ca -0.45 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.88 3b78 h VAL 774 Cb 1.27 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 3b78 h VAL 774 CO 0.80 0.10 0.00 -0.46 0.02 0.00 0.00 177.57 178.03 3b78 n ASN 775 N -4.48 0.00 -0.03 0.57 0.23 -1.26 -2.15 115.26 108.14 3b78 n ASN 775 Ca 0.08 -1.55 0.00 0.00 -0.53 0.00 0.00 54.58 52.59 3b78 n ASN 775 Cb 0.25 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 37.95 3b78 n ASN 775 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3b78 n GLU 776 N -0.66 0.18 0.00 -3.83 -0.58 0.14 -4.71 120.64 111.18 3b78 n GLU 776 Ca 0.07 -0.82 0.12 0.00 -0.42 0.00 0.00 57.16 56.12 3b78 n GLU 776 Cb 0.03 -1.02 0.20 0.00 -0.57 0.00 0.00 31.44 30.08 3b78 n GLU 776 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 3b78 n SER 777 N -0.09 2.33 -4.64 1.62 3.41 -0.91 -4.79 113.62 110.55 3b78 n SER 777 Ca 0.01 -1.71 -0.43 0.00 -0.26 0.00 0.00 58.87 56.48 3b78 n SER 777 Cb 0.09 0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 64.11 3b78 n SER 777 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3b78 s PHE 778 N -2.13 2.16 -0.52 7.33 0.40 -1.26 -1.95 117.98 122.01 3b78 s PHE 778 Ca 0.28 0.50 0.00 0.00 -0.60 0.00 0.00 56.93 57.11 3b78 s PHE 778 Cb 0.20 -3.90 0.00 0.00 0.51 0.00 0.00 43.02 39.83 3b78 s PHE 778 CO 0.38 -3.06 0.00 0.41 0.70 0.00 0.00 175.22 173.64 3b78 n GLY 779 N 4.36 0.69 0.17 4.36 0.00 -1.26 -4.95 105.19 108.56 3b78 n GLY 779 Ca 0.18 -0.82 -0.12 0.00 0.00 0.00 0.00 46.02 45.26 3b78 n GLY 779 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3b78 h PHE 780 N 0.00 0.57 -0.03 1.61 3.57 -1.70 -2.64 116.94 118.32 3b78 h PHE 780 Ca -0.10 -0.13 -0.07 0.00 3.53 0.00 0.00 57.97 61.20 3b78 h PHE 780 Cb 0.42 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 3b78 h PHE 780 CO 0.14 0.73 -0.29 1.79 -2.23 0.00 0.00 178.31 178.44 3b78 h THR 781 N 0.24 1.22 -0.37 4.41 1.35 -1.93 -0.45 112.91 117.39 3b78 h THR 781 Ca 0.06 -1.06 -0.08 0.00 -0.55 0.00 0.00 66.41 64.78 3b78 h THR 781 Cb 0.56 1.53 -0.01 0.00 -1.73 0.00 0.00 68.15 68.50 3b78 h THR 781 CO 0.03 0.31 -0.09 1.23 -0.25 0.00 0.00 175.52 176.74 3b78 h GLY 782 N 0.92 0.77 1.30 5.82 0.00 -1.94 0.44 103.07 110.39 3b78 h GLY 782 Ca 0.00 -0.64 -0.20 0.00 0.00 0.00 0.00 47.33 46.49 3b78 h GLY 782 CO 0.04 0.59 -0.70 0.83 0.00 0.00 0.00 176.54 177.30 3b78 h GLU 783 N 0.51 0.70 -0.60 4.80 5.08 -1.17 -1.36 114.58 122.54 3b78 h GLU 783 Ca 0.09 -0.53 -0.06 0.00 -1.00 0.00 0.00 59.36 57.86 3b78 h GLU 783 Cb 0.61 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 3b78 h GLU 783 CO 0.04 1.15 0.13 1.25 -1.00 0.00 0.00 179.01 180.58 3b78 h LEU 784 N 0.49 0.92 0.03 1.33 5.85 -1.07 -0.65 115.31 122.22 3b78 h LEU 784 Ca -0.03 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.48 3b78 h LEU 784 Cb 1.30 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 3b78 h LEU 784 CO 0.14 0.92 -0.28 -0.09 -0.34 0.00 0.00 178.44 178.79 3b78 h ARG 785 N 0.88 -0.43 -0.86 1.25 9.65 -0.82 -1.45 114.38 122.61 3b78 h ARG 785 Ca 0.19 0.03 0.08 0.00 -1.10 0.00 0.00 59.98 59.18 3b78 h ARG 785 Cb 0.37 0.10 -0.06 0.00 -1.39 0.00 0.00 29.97 28.99 3b78 h ARG 785 CO 0.00 -0.29 0.56 0.37 2.80 0.00 0.00 179.97 183.42 3b78 h GLN 786 N -0.45 0.86 0.00 0.20 5.75 -0.93 -0.90 115.11 119.64 3b78 h GLN 786 Ca 0.05 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3b78 h GLN 786 Cb 0.52 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 28.87 3b78 h GLN 786 CO -0.22 0.57 -0.55 0.00 -2.65 0.00 0.00 178.83 175.97 3b78 n ALA 787 N -2.42 3.23 -0.08 3.38 0.00 -0.28 -3.87 120.51 120.49 3b78 n ALA 787 Ca 0.14 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.28 3b78 n ALA 787 Cb 0.27 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.57 3b78 n ALA 787 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3b78 n THR 788 N -1.76 0.69 -1.79 0.00 -2.24 -0.58 -4.37 114.28 104.23 3b78 n THR 788 Ca 0.04 -0.81 -0.18 0.00 -2.27 0.00 0.00 64.05 60.84 3b78 n THR 788 Cb 0.38 0.67 -0.05 0.00 -2.10 0.00 0.00 70.33 69.23 3b78 n THR 788 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b78 n GLY 789 N -0.35 1.02 1.96 3.38 0.00 -0.63 -1.82 105.19 108.75 3b78 n GLY 789 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3b78 n GLY 789 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b78 n GLY 790 N -0.89 0.47 0.08 -0.02 0.00 -0.44 -4.92 105.19 99.47 3b78 n GLY 790 Ca -0.19 -0.38 -0.05 0.00 0.00 0.00 0.00 46.02 45.40 3b78 n GLY 790 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3b78 h GLN 791 N 0.69 0.00 -6.92 1.61 1.08 -1.64 -3.45 115.11 106.48 3b78 h GLN 791 Ca 0.00 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 56.70 3b78 h GLN 791 Cb 0.00 0.00 0.04 0.00 -0.05 0.00 0.00 27.48 27.47 3b78 h GLN 791 CO 0.00 0.81 0.48 0.00 -0.95 0.00 0.00 178.83 179.16 3b78 s ALA 792 N -2.75 3.20 -0.51 3.87 0.00 -1.26 -4.59 121.76 119.72 3b78 s ALA 792 Ca 0.01 0.89 0.04 0.00 0.00 0.00 0.00 51.96 52.89 3b78 s ALA 792 Cb 0.09 -3.34 0.13 0.00 0.00 0.00 0.00 23.12 20.00 3b78 s ALA 792 CO 0.81 -0.36 0.26 0.12 0.00 0.00 0.00 175.76 176.58 3b78 s PHE 793 N -1.42 3.01 0.67 0.00 5.36 0.94 -4.95 117.98 121.58 3b78 s PHE 793 Ca 0.54 -3.07 -0.14 0.00 -0.96 0.00 0.00 56.93 53.30 3b78 s PHE 793 Cb -0.29 -2.68 0.01 0.00 -0.34 0.00 0.00 43.02 39.71 3b78 s PHE 793 CO 0.36 -0.75 1.10 -2.14 -1.46 0.00 0.00 175.22 172.34 3b78 s PRO 794 N -0.21 2.76 -0.30 10.12 0.02 -1.26 -2.51 135.00 143.62 3b78 s PRO 794 Ca 0.17 1.35 -0.06 0.00 0.02 0.00 0.00 61.00 62.48 3b78 s PRO 794 Cb -0.26 -1.95 0.19 0.00 0.02 0.00 0.00 34.50 32.50 3b78 s PRO 794 CO -0.00 -1.28 0.85 -1.14 -0.33 0.00 0.00 177.00 175.11 3b78 s GLN 795 N -4.21 0.34 -0.02 5.54 0.74 -0.71 -4.67 119.66 116.66 3b78 s GLN 795 Ca 0.66 0.48 0.03 0.00 0.05 0.00 0.00 55.36 56.58 3b78 s GLN 795 Cb -0.20 0.25 -0.00 0.00 1.10 0.00 0.00 33.01 34.16 3b78 s GLN 795 CO 0.43 -0.49 -0.11 0.00 -0.55 0.00 0.00 175.29 174.58 3b78 s MET 796 N 2.91 1.08 0.04 1.67 0.23 -1.26 0.68 119.30 124.65 3b78 s MET 796 Ca 0.13 -0.37 0.03 0.00 -1.03 0.00 0.00 55.69 54.45 3b78 s MET 796 Cb -0.09 -1.00 -0.02 0.00 -1.53 0.00 0.00 34.83 32.19 3b78 s MET 796 CO -0.19 0.16 -0.11 0.54 -2.03 0.00 0.00 175.02 173.39 3b78 s VAL 797 N 0.07 0.81 0.17 5.16 0.11 -0.76 -4.94 120.40 121.03 3b78 s VAL 797 Ca -0.02 -0.94 -0.33 0.00 -2.93 0.00 0.00 61.98 57.76 3b78 s VAL 797 Cb -0.08 -0.78 -0.14 0.00 -1.53 0.00 0.00 36.38 33.85 3b78 s VAL 797 CO 0.01 -0.13 1.59 0.33 -3.33 0.00 0.00 175.10 173.56 3b78 n PHE 798 N 1.85 2.33 -0.02 1.54 7.35 -1.26 -0.40 117.46 128.85 3b78 n PHE 798 Ca -0.19 0.25 -0.05 0.00 -0.76 0.00 0.00 57.45 56.70 3b78 n PHE 798 Cb 0.55 -2.56 -0.02 0.00 0.35 0.00 0.00 39.48 37.81 3b78 n PHE 798 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 3b78 n ASP 799 N 3.39 1.49 -3.85 -2.13 -0.08 -0.01 -4.76 116.55 110.59 3b78 n ASP 799 Ca 0.16 0.23 -0.09 0.00 -1.51 0.00 0.00 54.79 53.58 3b78 n ASP 799 Cb 0.30 -0.54 -0.04 0.00 2.34 0.00 0.00 41.12 43.17 3b78 n ASP 799 CO 0.00 0.00 0.00 -1.38 0.12 0.00 0.00 177.20 175.94 3b78 s HIS 800 N -2.42 0.07 0.10 -0.67 -3.43 -1.13 -5.02 115.29 102.78 3b78 s HIS 800 Ca -0.15 -0.43 -0.09 0.00 -0.80 0.00 0.00 55.06 53.59 3b78 s HIS 800 Cb 0.02 0.32 -0.06 0.00 -1.43 0.00 0.00 32.58 31.43 3b78 s HIS 800 CO 0.22 -0.95 0.40 -1.58 -2.00 0.00 0.00 174.74 170.82 3b78 s TRP 801 N -3.93 3.56 -0.10 0.38 0.52 -1.26 -1.08 118.94 117.03 3b78 s TRP 801 Ca 0.14 0.75 0.00 0.00 0.02 0.00 0.00 56.10 57.01 3b78 s TRP 801 Cb -0.01 -2.13 0.02 0.00 -1.15 0.00 0.00 33.47 30.20 3b78 s TRP 801 CO 0.02 0.49 -0.08 0.45 0.02 0.00 0.00 176.95 177.85 3b78 s SER 802 N -1.91 1.98 0.04 2.95 0.15 0.32 -4.92 113.70 112.31 3b78 s SER 802 Ca 0.35 -0.28 -0.30 0.00 0.70 0.00 0.00 55.95 56.42 3b78 s SER 802 Cb -0.13 -0.79 -0.05 0.00 -1.71 0.00 0.00 66.02 63.34 3b78 s SER 802 CO 0.19 -0.08 1.13 -0.89 1.20 0.00 0.00 173.24 174.79 3b78 s THR 803 N 1.44 4.29 0.21 6.45 2.01 -1.26 -0.40 115.64 128.38 3b78 s THR 803 Ca -0.00 1.64 -0.30 0.00 0.31 0.00 0.00 61.69 63.34 3b78 s THR 803 Cb -0.13 -4.05 -0.08 0.00 0.01 0.00 0.00 72.50 68.24 3b78 s THR 803 CO -0.05 0.12 0.99 -0.76 -0.69 0.00 0.00 174.62 174.23 3b78 s LEU 804 N 1.10 4.59 0.21 4.42 1.43 -0.52 -4.96 118.68 124.94 3b78 s LEU 804 Ca 0.57 1.98 -0.02 0.00 -1.03 0.00 0.00 54.13 55.63 3b78 s LEU 804 Cb -0.27 -3.61 0.17 0.00 0.03 0.00 0.00 46.19 42.51 3b78 s LEU 804 CO 0.28 0.03 1.55 1.23 0.23 0.00 0.00 176.35 179.67 3b78 h GLY 805 N 4.49 0.60 -1.26 -3.19 0.00 -1.95 -3.43 103.07 98.34 3b78 h GLY 805 Ca -0.45 -0.65 -0.51 0.00 0.00 0.00 0.00 47.33 45.72 3b78 h GLY 805 CO 0.69 0.58 0.21 -1.35 0.00 0.00 0.00 176.54 176.68 3b78 s SER 806 N -6.88 2.88 -0.35 0.19 1.04 -1.26 -4.97 113.70 104.35 3b78 s SER 806 Ca -0.07 2.08 -0.20 0.00 0.48 0.00 0.00 55.95 58.23 3b78 s SER 806 Cb 0.12 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.71 3b78 s SER 806 CO 0.83 -3.11 0.64 -0.62 0.98 0.00 0.00 173.24 171.96 3b78 s ASP 807 N -2.74 6.44 0.57 7.02 3.68 -1.26 -4.75 116.67 125.63 3b78 s ASP 807 Ca 0.66 0.20 0.38 0.00 2.13 0.00 0.00 52.55 55.92 3b78 s ASP 807 Cb -0.22 -2.33 2.06 0.00 -1.45 0.00 0.00 42.92 40.98 3b78 s ASP 807 CO 0.58 -0.57 2.17 1.55 0.13 0.00 0.00 175.17 179.03 3b78 h PRO 808 N 8.41 0.00 -0.00 4.34 0.13 -1.84 -0.41 132.00 142.63 3b78 h PRO 808 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3b78 h PRO 808 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3b78 h PRO 808 CO 0.83 0.00 -0.17 1.28 -0.23 0.00 0.00 178.00 179.71 3b78 n LEU 809 N -2.84 0.21 -4.46 1.56 4.77 -1.26 -4.05 117.00 110.92 3b78 n LEU 809 Ca -0.02 0.28 -0.43 0.00 -0.03 0.00 0.00 56.01 55.80 3b78 n LEU 809 Cb 0.07 -0.38 -0.10 0.00 -2.33 0.00 0.00 43.42 40.68 3b78 n LEU 809 CO 0.17 0.05 -0.06 -0.62 -1.33 0.00 0.00 177.39 175.60 3b78 s ASP 810 N -2.93 6.11 0.66 -1.43 2.15 -0.16 -4.90 116.67 116.16 3b78 s ASP 810 Ca 0.15 -0.90 0.42 0.00 0.43 0.00 0.00 52.55 52.66 3b78 s ASP 810 Cb 0.19 -2.16 2.34 0.00 -0.30 0.00 0.00 42.92 42.98 3b78 s ASP 810 CO 0.58 -0.45 2.36 -0.65 -0.17 0.00 0.00 175.17 176.83 3b78 h PRO 811 N 8.63 0.00 0.00 4.34 0.11 -1.83 -2.37 132.00 140.88 3b78 h PRO 811 Ca -0.27 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.76 3b78 h PRO 811 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3b78 h PRO 811 CO 0.73 0.00 -1.44 0.25 -0.21 0.00 0.00 178.00 177.33 3b78 n THR 812 N -3.21 0.73 -1.27 -1.15 -2.24 -1.26 -3.25 114.28 102.63 3b78 n THR 812 Ca -0.03 -0.61 -0.29 0.00 -2.27 0.00 0.00 64.05 60.85 3b78 n THR 812 Cb 0.07 -0.41 0.15 0.00 -2.10 0.00 0.00 70.33 68.05 3b78 n THR 812 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3b78 s SER 813 N -5.33 3.18 0.14 3.42 1.04 -0.90 -4.72 113.70 110.52 3b78 s SER 813 Ca -0.04 1.25 -0.17 0.00 0.48 0.00 0.00 55.95 57.47 3b78 s SER 813 Cb 0.10 -1.91 -0.02 0.00 0.10 0.00 0.00 66.02 64.29 3b78 s SER 813 CO 0.82 -2.79 1.76 0.11 0.98 0.00 0.00 173.24 174.12 3b78 h LYS 814 N -1.66 0.47 -0.26 4.02 1.79 -1.90 0.28 116.57 119.32 3b78 h LYS 814 Ca -0.52 -0.05 -0.06 0.00 -2.18 0.00 0.00 60.65 57.85 3b78 h LYS 814 Cb 1.31 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 31.86 3b78 h LYS 814 CO 0.58 0.37 -0.07 0.00 -1.08 0.00 0.00 179.45 179.25 3b78 h ALA 815 N 1.08 0.36 -0.59 3.86 0.00 -1.85 -2.85 119.26 119.26 3b78 h ALA 815 Ca 0.12 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 3b78 h ALA 815 Cb 0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3b78 h ALA 815 CO -0.02 0.17 0.06 0.78 0.00 0.00 0.00 179.25 180.23 3b78 h GLY 816 N 0.25 1.06 0.78 0.00 0.00 -1.52 -1.57 103.07 102.07 3b78 h GLY 816 Ca 0.07 -0.71 0.05 0.00 0.00 0.00 0.00 47.33 46.73 3b78 h GLY 816 CO 0.03 0.66 0.45 -2.09 0.00 0.00 0.00 176.54 175.59 3b78 h GLU 817 N 0.92 0.83 -0.29 4.80 4.81 -0.41 0.10 114.58 125.34 3b78 h GLU 817 Ca 0.18 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 3b78 h GLU 817 Cb 0.45 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 3b78 h GLU 817 CO 0.02 0.55 0.12 0.82 -0.73 0.00 0.00 179.01 179.79 3b78 h ILE 818 N 0.85 1.17 0.13 2.32 2.04 -1.22 -2.60 117.51 120.21 3b78 h ILE 818 Ca 0.32 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.67 3b78 h ILE 818 Cb 0.11 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 3b78 h ILE 818 CO -0.15 0.18 -0.15 0.58 0.00 0.00 0.00 178.15 178.61 3b78 h VAL 819 N 0.33 0.65 -0.47 1.67 2.07 -0.66 -2.43 116.25 117.41 3b78 h VAL 819 Ca 0.10 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.68 3b78 h VAL 819 Cb 0.16 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.53 3b78 h VAL 819 CO -0.01 0.00 0.16 0.25 0.02 0.00 0.00 177.57 177.99 3b78 h LEU 820 N -0.33 0.15 -0.86 2.57 5.85 -0.79 0.19 115.31 122.09 3b78 h LEU 820 Ca 0.01 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.81 3b78 h LEU 820 Cb 0.32 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 3b78 h LEU 820 CO -0.06 0.12 0.56 0.00 -0.34 0.00 0.00 178.44 178.72 3b78 h ALA 821 N 1.32 1.12 -0.26 1.25 0.00 -1.37 -1.33 119.26 119.98 3b78 h ALA 821 Ca 0.22 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3b78 h ALA 821 Cb 0.24 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3b78 h ALA 821 CO -0.24 0.43 -0.15 0.00 0.00 0.00 0.00 179.25 179.29 3b78 h ALA 822 N 1.34 0.37 -0.55 0.00 0.00 -0.86 -2.01 119.26 117.56 3b78 h ALA 822 Ca 0.33 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3b78 h ALA 822 Cb -0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3b78 h ALA 822 CO -0.10 0.26 0.34 0.00 0.00 0.00 0.00 179.25 179.75 3b78 h ARG 823 N 0.30 0.74 -0.42 0.00 3.08 -0.66 -0.52 114.38 116.90 3b78 h ARG 823 Ca 0.06 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.06 3b78 h ARG 823 Cb 0.66 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.53 3b78 h ARG 823 CO 0.04 0.53 0.25 0.87 -1.07 0.00 0.00 179.97 180.59 3b78 h LYS 824 N 0.74 0.50 0.00 0.04 1.57 -1.26 0.42 116.57 118.59 3b78 h LYS 824 Ca 0.20 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 3b78 h LYS 824 Cb -0.03 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.17 3b78 h LYS 824 CO -0.04 0.33 -0.05 -0.09 -0.57 0.00 0.00 179.45 179.03 3b78 h ARG 825 N 0.51 0.00 -0.07 3.15 2.43 -0.65 -1.44 114.38 118.31 3b78 h ARG 825 Ca 0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3b78 h ARG 825 Cb -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 3b78 h ARG 825 CO -0.07 0.05 0.00 0.72 -1.51 0.00 0.00 179.97 179.16 3b78 n HIS 826 N -4.41 0.06 -0.99 2.20 8.25 -0.27 -4.93 115.22 115.13 3b78 n HIS 826 Ca -0.03 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 3b78 n HIS 826 Cb 0.13 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.24 3b78 n HIS 826 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3b78 n GLY 827 N 1.28 0.47 3.72 -1.41 0.00 -0.54 -5.02 105.19 103.70 3b78 n GLY 827 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3b78 n GLY 827 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3b78 s MET 828 N -0.33 1.15 0.09 1.61 -1.94 0.07 -4.97 119.30 114.98 3b78 s MET 828 Ca 0.00 0.70 -0.31 0.00 -1.71 0.00 0.00 55.69 54.37 3b78 s MET 828 Cb 0.00 -1.81 -0.08 0.00 2.01 0.00 0.00 34.83 34.96 3b78 s MET 828 CO 0.00 -2.28 1.48 0.21 -0.01 0.00 0.00 175.02 174.42 3b78 s LYS 829 N -4.99 4.27 0.17 2.03 2.20 -1.26 -4.46 119.74 117.70 3b78 s LYS 829 Ca 0.64 2.16 -0.24 0.00 -0.36 0.00 0.00 55.97 58.16 3b78 s LYS 829 Cb -0.17 -3.38 0.06 0.00 -1.51 0.00 0.00 37.83 32.83 3b78 s LYS 829 CO 0.57 -0.56 1.58 0.93 -0.36 0.00 0.00 175.35 177.50 3b78 h GLU 830 N 7.38 -0.21 -6.71 4.03 5.08 -1.93 -3.40 114.58 118.82 3b78 h GLU 830 Ca -0.41 0.01 -0.52 0.00 -1.00 0.00 0.00 59.36 57.44 3b78 h GLU 830 Cb 1.20 0.05 0.03 0.00 0.50 0.00 0.00 28.75 30.52 3b78 h GLU 830 CO 0.90 -0.14 0.57 -1.83 -1.00 0.00 0.00 179.01 177.51 3b78 s GLU 831 N -5.90 4.48 0.20 2.33 1.03 -1.26 -4.77 118.70 114.81 3b78 s GLU 831 Ca -0.14 1.94 -0.31 0.00 0.03 0.00 0.00 54.97 56.49 3b78 s GLU 831 Cb 0.14 -3.21 -0.10 0.00 -0.80 0.00 0.00 34.13 30.17 3b78 s GLU 831 CO 0.67 -0.09 1.45 0.08 -1.33 0.00 0.00 175.26 176.04 3b78 s VAL 832 N -0.27 2.80 0.40 1.83 1.01 -1.26 -4.95 120.40 119.96 3b78 s VAL 832 Ca 0.52 0.63 -0.27 0.00 0.00 0.00 0.00 61.98 62.86 3b78 s VAL 832 Cb -0.34 -3.40 -0.10 0.00 0.00 0.00 0.00 36.38 32.54 3b78 s VAL 832 CO 0.39 0.08 1.48 -2.84 0.00 0.00 0.00 175.10 174.20 3b78 s PRO 833 N 0.27 3.95 0.64 2.72 0.02 -1.26 -5.01 135.00 136.34 3b78 s PRO 833 Ca 0.63 2.54 -0.11 0.00 0.02 0.00 0.00 61.00 64.08 3b78 s PRO 833 Cb -0.41 -2.86 -0.03 0.00 0.02 0.00 0.00 34.50 31.22 3b78 s PRO 833 CO 0.38 -0.65 1.04 0.20 -0.33 0.00 0.00 177.00 177.64 3b78 s GLY 834 N -0.25 1.67 0.50 0.52 0.00 -1.26 -4.96 107.32 103.54 3b78 s GLY 834 Ca 0.56 -0.03 0.20 0.00 0.00 0.00 0.00 44.72 45.44 3b78 s GLY 834 CO 0.61 0.25 2.07 0.11 0.00 0.00 0.00 173.10 176.15 3b78 h TRP 835 N -0.42 0.00 -0.06 1.90 5.08 -1.89 -1.65 115.95 118.91 3b78 h TRP 835 Ca -0.44 0.00 0.02 0.00 1.08 0.00 0.00 58.89 59.55 3b78 h TRP 835 Cb 1.20 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.35 3b78 h TRP 835 CO 0.65 0.11 0.07 1.96 -1.28 0.00 0.00 178.44 179.95 3b78 h GLN 836 N 0.00 0.00 -0.54 0.12 7.50 -1.92 0.13 115.11 120.39 3b78 h GLN 836 Ca -0.00 0.00 -0.07 0.00 0.50 0.00 0.00 58.65 59.08 3b78 h GLN 836 Cb 0.23 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.74 3b78 h GLN 836 CO 0.01 0.00 0.05 1.49 -1.50 0.00 0.00 178.83 178.88 3b78 h GLU 837 N 0.00 0.88 0.00 1.46 4.81 -1.68 -3.11 114.58 116.95 3b78 h GLU 837 Ca 0.03 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.03 3b78 h GLU 837 Cb 0.16 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.43 3b78 h GLU 837 CO -0.00 0.85 -1.97 0.66 -0.73 0.00 0.00 179.01 177.82 3b78 n TYR 838 N -4.22 0.01 -1.41 0.92 4.02 -0.73 -4.92 117.16 110.82 3b78 n TYR 838 Ca 0.03 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.60 3b78 n TYR 838 Cb 0.29 -0.49 0.09 0.00 -0.02 0.00 0.00 39.34 39.20 3b78 n TYR 838 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 3b78 s TYR 839 N -3.51 2.28 0.20 -0.72 5.04 0.37 -4.44 117.35 116.57 3b78 s TYR 839 Ca -0.08 1.60 -0.33 0.00 -2.44 0.00 0.00 57.07 55.83 3b78 s TYR 839 Cb 0.14 -3.27 -0.13 0.00 0.35 0.00 0.00 41.96 39.05 3b78 s TYR 839 CO 0.91 -2.17 1.57 -3.47 -1.34 0.00 0.00 175.55 171.05 3b78 n ASP 840 N -2.96 3.26 -4.56 4.32 4.64 -0.32 -4.89 116.55 116.03 3b78 n ASP 840 Ca 0.11 1.10 -0.42 0.00 -1.38 0.00 0.00 54.79 54.21 3b78 n ASP 840 Cb 0.52 -1.47 -0.03 0.00 -1.04 0.00 0.00 41.12 39.10 3b78 n ASP 840 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 3b78 s LYS 841 N 0.54 3.35 0.00 -0.67 -0.14 -1.26 -5.04 119.74 116.51 3b78 s LYS 841 Ca 0.74 -0.00 0.00 0.00 -1.36 0.00 0.00 55.97 55.35 3b78 s LYS 841 Cb -0.62 -4.10 0.00 0.00 -1.68 0.00 0.00 37.83 31.43 3b78 s LYS 841 CO 0.40 -1.92 0.00 1.47 -0.76 0.00 0.00 175.35 174.54