#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 3.76 0.19 3.52 0.00 -1.26 -2.41 121.76 125.56 3b78 s ALA 3 Ca 0.00 -0.44 0.02 0.00 0.00 0.00 0.00 51.96 51.54 3b78 s ALA 3 Cb 0.00 -2.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.86 3b78 s ALA 3 CO 0.00 0.59 0.02 -0.06 0.00 0.00 0.00 175.76 176.31 3b78 s PHE 4 N -1.36 1.27 0.52 0.00 0.40 0.83 -4.93 117.98 114.71 3b78 s PHE 4 Ca 0.31 -1.04 0.03 0.00 -0.60 0.00 0.00 56.93 55.62 3b78 s PHE 4 Cb -0.14 -0.72 0.03 0.00 0.51 0.00 0.00 43.02 42.69 3b78 s PHE 4 CO 0.17 -0.23 0.73 0.95 0.70 0.00 0.00 175.22 177.54 3b78 s THR 5 N -3.67 2.81 0.52 0.64 -4.23 -1.26 -1.43 115.64 109.02 3b78 s THR 5 Ca 0.26 -0.73 0.40 0.00 -1.18 0.00 0.00 61.69 60.45 3b78 s THR 5 Cb 0.06 -3.03 0.42 0.00 1.34 0.00 0.00 72.50 71.29 3b78 s THR 5 CO 0.06 -0.02 2.26 0.58 -0.54 0.00 0.00 174.62 176.96 3b78 h VAL 6 N 0.21 0.08 0.09 2.29 2.07 -1.99 -1.95 116.25 117.05 3b78 h VAL 6 Ca -0.42 -0.15 -0.14 0.00 0.82 0.00 0.00 66.70 66.81 3b78 h VAL 6 Cb 1.29 1.14 0.01 0.00 -1.52 0.00 0.00 31.29 32.21 3b78 h VAL 6 CO 0.51 0.01 -0.67 0.44 0.02 0.00 0.00 177.57 177.88 3b78 h ASP 7 N 0.00 0.30 -0.46 0.57 3.32 -1.98 -2.42 116.42 115.75 3b78 h ASP 7 Ca -0.00 -0.94 0.04 0.00 0.02 0.00 0.00 57.03 56.15 3b78 h ASP 7 Cb 0.13 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 3b78 h ASP 7 CO 0.00 1.31 0.24 1.56 -1.72 0.00 0.00 179.24 180.63 3b78 h GLN 8 N -0.57 0.46 -0.08 3.56 4.20 -1.82 0.19 115.11 121.05 3b78 h GLN 8 Ca -0.13 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 3b78 h GLN 8 Cb 1.46 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 29.13 3b78 h GLN 8 CO 0.08 0.30 0.04 0.52 -0.67 0.00 0.00 178.83 179.10 3b78 h MET 9 N 0.47 0.11 -0.20 1.46 2.86 -1.51 -2.48 114.93 115.65 3b78 h MET 9 Ca 0.20 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.87 3b78 h MET 9 Cb 0.09 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.69 3b78 h MET 9 CO -0.13 0.19 -0.10 -0.09 1.06 0.00 0.00 176.91 177.84 3b78 h ARG 10 N 0.01 -0.07 -0.54 1.72 9.65 -0.95 -0.64 114.38 123.56 3b78 h ARG 10 Ca 0.03 0.00 0.06 0.00 -1.10 0.00 0.00 59.98 58.98 3b78 h ARG 10 Cb 0.11 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.68 3b78 h ARG 10 CO -0.00 -0.05 0.36 1.03 2.80 0.00 0.00 179.97 184.11 3b78 h SER 11 N -0.07 0.43 0.50 -3.80 0.87 -0.61 -1.00 113.55 109.86 3b78 h SER 11 Ca 0.11 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.51 3b78 h SER 11 Cb 0.23 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 3b78 h SER 11 CO -0.25 0.28 -0.69 0.25 -0.53 0.00 0.00 176.83 175.89 3b78 h LEU 12 N 0.48 0.20 -1.17 2.23 5.85 -0.78 -2.87 115.31 119.26 3b78 h LEU 12 Ca 0.24 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3b78 h LEU 12 Cb 0.32 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.29 3b78 h LEU 12 CO -0.07 0.83 0.00 0.24 -0.34 0.00 0.00 178.44 179.10 3b78 h MET 13 N 0.11 0.00 -0.09 1.25 2.86 0.23 -2.22 114.93 117.07 3b78 h MET 13 Ca -0.02 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.39 3b78 h MET 13 Cb 1.23 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.90 3b78 h MET 13 CO 0.10 0.00 -0.87 -0.44 1.06 0.00 0.00 176.91 176.76 3b78 h ASP 14 N 0.00 0.87 -0.37 1.22 3.32 -1.33 -3.36 116.42 116.76 3b78 h ASP 14 Ca 0.00 -0.62 -0.61 0.00 0.02 0.00 0.00 57.03 55.82 3b78 h ASP 14 Cb 0.30 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 3b78 h ASP 14 CO 0.00 1.42 2.25 0.29 -1.72 0.00 0.00 179.24 181.48 3b78 n LYS 15 N -3.89 2.45 0.31 3.56 4.01 -0.84 -4.72 118.16 119.04 3b78 n LYS 15 Ca -0.08 -2.65 0.19 0.00 -0.51 0.00 0.00 58.31 55.26 3b78 n LYS 15 Cb 0.79 -3.38 0.97 0.00 -0.51 0.00 0.00 35.03 32.90 3b78 n LYS 15 CO 0.00 0.00 0.00 -0.39 -1.11 0.00 0.00 177.40 175.90 3b78 h VAL 16 N 5.04 0.16 0.00 -0.18 -1.51 -1.79 -0.77 116.25 117.20 3b78 h VAL 16 Ca 0.43 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.66 3b78 h VAL 16 Cb 0.78 1.20 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 3b78 h VAL 16 CO 1.63 0.02 0.00 0.35 -1.23 0.00 0.00 177.57 178.34 3b78 n THR 17 N -3.26 0.07 -1.02 7.19 -2.24 -1.26 -3.05 114.28 110.71 3b78 n THR 17 Ca -0.02 0.02 0.09 0.00 -2.27 0.00 0.00 64.05 61.87 3b78 n THR 17 Cb 0.16 -0.54 0.20 0.00 -2.10 0.00 0.00 70.33 68.05 3b78 n THR 17 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3b78 n ASN 18 N -1.35 3.13 -4.75 3.42 4.13 -0.30 -4.55 115.26 114.98 3b78 n ASN 18 Ca 0.11 -3.04 -0.35 0.00 1.68 0.00 0.00 54.58 52.98 3b78 n ASN 18 Cb 0.26 -0.48 -0.08 0.00 -1.54 0.00 0.00 39.78 37.93 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 -2.83 4.70 -0.22 2.41 1.01 -1.17 -1.16 120.40 123.13 3b78 s VAL 19 Ca 0.37 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.21 3b78 s VAL 19 Cb 0.31 -3.02 0.06 0.00 0.00 0.00 0.00 36.38 33.72 3b78 s VAL 19 CO 0.06 0.57 -0.07 -0.13 0.00 0.00 0.00 175.10 175.53 3b78 s ARG 20 N -1.06 1.74 -0.23 2.72 1.81 0.16 -4.12 118.95 119.97 3b78 s ARG 20 Ca 0.15 -0.96 -0.08 0.00 -1.72 0.00 0.00 55.73 53.13 3b78 s ARG 20 Cb -0.12 -2.54 -0.04 0.00 -0.45 0.00 0.00 34.95 31.81 3b78 s ARG 20 CO 0.05 -0.55 0.08 -0.80 -0.68 0.00 0.00 175.30 173.40 3b78 s ASN 21 N 1.39 5.39 0.25 0.23 0.01 -1.26 0.18 114.94 121.14 3b78 s ASN 21 Ca -0.05 -0.10 -0.22 0.00 -0.71 0.00 0.00 52.86 51.79 3b78 s ASN 21 Cb -0.18 -1.96 0.03 0.00 0.41 0.00 0.00 41.25 39.55 3b78 s ASN 21 CO -0.07 0.02 0.71 0.00 -1.51 0.00 0.00 177.10 176.25 3b78 s MET 22 N 1.27 1.67 0.26 -0.60 0.23 -0.91 -1.46 119.30 119.77 3b78 s MET 22 Ca 0.05 -0.88 0.02 0.00 -1.03 0.00 0.00 55.69 53.85 3b78 s MET 22 Cb -0.15 0.60 -0.01 0.00 -1.53 0.00 0.00 34.83 33.75 3b78 s MET 22 CO 0.04 -0.76 0.08 0.45 -2.03 0.00 0.00 175.02 172.80 3b78 n SER 23 N -0.44 1.25 -4.09 -1.18 2.88 -1.05 -1.37 113.62 109.61 3b78 n SER 23 Ca -0.06 -2.35 -0.33 0.00 -1.33 0.00 0.00 58.87 54.79 3b78 n SER 23 Cb 0.60 0.61 -0.15 0.00 -0.75 0.00 0.00 64.21 64.53 3b78 n SER 23 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3b78 s VAL 24 N -2.47 2.37 -0.61 2.46 1.01 -1.26 -0.55 120.40 121.34 3b78 s VAL 24 Ca 0.12 -1.59 -0.22 0.00 0.00 0.00 0.00 61.98 60.29 3b78 s VAL 24 Cb 0.01 -2.39 0.07 0.00 0.00 0.00 0.00 36.38 34.06 3b78 s VAL 24 CO 0.08 -0.06 0.89 -0.63 0.00 0.00 0.00 175.10 175.38 3b78 s ILE 25 N 1.13 4.46 -0.12 2.22 1.01 -0.05 -4.83 121.20 125.03 3b78 s ILE 25 Ca -0.08 -0.29 -0.30 0.00 0.00 0.00 0.00 60.65 59.98 3b78 s ILE 25 Cb -0.20 -4.58 0.11 0.00 0.01 0.00 0.00 42.46 37.80 3b78 s ILE 25 CO -0.04 -1.26 0.88 0.00 0.00 0.00 0.00 174.94 174.52 3b78 s ALA 26 N 3.71 -1.88 0.39 9.38 0.00 -1.26 -1.10 121.76 131.00 3b78 s ALA 26 Ca 0.22 1.50 -0.24 0.00 0.00 0.00 0.00 51.96 53.43 3b78 s ALA 26 Cb -0.17 -0.47 -0.09 0.00 0.00 0.00 0.00 23.12 22.39 3b78 s ALA 26 CO 0.12 -0.33 1.03 -1.58 0.00 0.00 0.00 175.76 175.00 3b78 s HIS 27 N -1.12 3.33 0.48 0.00 2.46 -1.26 -4.93 115.29 114.26 3b78 s HIS 27 Ca -0.05 1.66 0.38 0.00 0.47 0.00 0.00 55.06 57.53 3b78 s HIS 27 Cb -0.00 -3.09 2.09 0.00 -0.13 0.00 0.00 32.58 31.45 3b78 s HIS 27 CO 0.05 -0.49 2.18 -0.39 -2.47 0.00 0.00 174.74 173.61 3b78 h VAL 28 N 2.26 0.00 -0.47 0.89 -1.51 -1.97 -0.98 116.25 114.47 3b78 h VAL 28 Ca -0.48 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 64.98 3b78 h VAL 28 Cb 1.21 0.85 -0.00 0.00 -2.13 0.00 0.00 31.29 31.22 3b78 h VAL 28 CO 0.63 0.00 0.01 0.47 -1.23 0.00 0.00 177.57 177.44 3b78 n ASP 29 N -2.88 5.10 -0.92 4.19 8.00 -1.26 -4.19 116.55 124.59 3b78 n ASP 29 Ca -0.03 -2.98 0.03 0.00 0.71 0.00 0.00 54.79 52.53 3b78 n ASP 29 Cb 0.09 -0.64 0.22 0.00 -0.02 0.00 0.00 41.12 40.77 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 0.21 0.89 -2.65 1.24 8.25 -0.37 -4.93 115.22 117.85 3b78 n HIS 30 Ca 0.26 -1.23 -0.15 0.00 -0.26 0.00 0.00 57.72 56.34 3b78 n HIS 30 Cb 1.10 -0.38 0.02 0.00 1.12 0.00 0.00 29.99 31.85 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 -0.90 -0.16 0.29 -1.41 0.00 -1.26 -4.70 105.19 97.05 3b78 n GLY 31 Ca 0.26 -0.19 -0.17 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.73 -0.67 0.00 1.61 3.64 -1.77 -0.99 116.57 117.67 3b78 h LYS 32 Ca -0.36 0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 58.97 3b78 h LYS 32 Cb 1.25 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 33.21 3b78 h LYS 32 CO 0.39 -0.44 -0.46 0.66 -2.27 0.00 0.00 179.45 177.33 3b78 h SER 33 N -0.70 0.00 0.66 4.20 4.64 -1.90 -2.38 113.55 118.06 3b78 h SER 33 Ca -0.07 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.13 3b78 h SER 33 Cb 0.53 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 3b78 h SER 33 CO 0.12 0.46 -0.56 0.74 -0.87 0.00 0.00 176.83 176.72 3b78 h THR 34 N 0.00 1.32 0.23 2.95 2.02 -1.91 -1.97 112.91 115.55 3b78 h THR 34 Ca -0.00 -1.96 -0.31 0.00 0.77 0.00 0.00 66.41 64.91 3b78 h THR 34 Cb 0.85 2.08 0.04 0.00 -1.74 0.00 0.00 68.15 69.37 3b78 h THR 34 CO 0.06 0.54 -1.34 -0.07 0.37 0.00 0.00 175.52 175.09 3b78 h LEU 35 N 0.00 0.77 -0.88 2.58 3.38 -1.00 -3.27 115.31 116.90 3b78 h LEU 35 Ca -0.01 -0.93 -0.01 0.00 0.09 0.00 0.00 57.88 57.02 3b78 h LEU 35 Cb 1.03 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 3b78 h LEU 35 CO 0.07 1.65 0.49 0.71 0.09 0.00 0.00 178.44 181.45 3b78 h THR 36 N 0.03 1.25 0.00 0.22 1.35 -1.38 -1.15 112.91 113.24 3b78 h THR 36 Ca -0.23 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 3b78 h THR 36 Cb 2.06 0.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.54 3b78 h THR 36 CO 0.25 0.28 0.00 0.44 -0.25 0.00 0.00 175.52 176.24 3b78 h ASP 37 N 1.22 0.00 0.08 5.36 3.32 -1.46 -2.48 116.42 122.46 3b78 h ASP 37 Ca 0.31 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.36 3b78 h ASP 37 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3b78 h ASP 37 CO -0.05 0.00 -0.04 -1.28 -1.72 0.00 0.00 179.24 176.15 3b78 h SER 38 N 0.00 -0.09 0.41 6.45 0.87 -1.25 -2.13 113.55 117.81 3b78 h SER 38 Ca 0.00 -0.52 -0.03 0.00 -1.23 0.00 0.00 61.79 60.02 3b78 h SER 38 Cb 0.15 0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.13 3b78 h SER 38 CO 0.00 0.54 -0.12 -0.07 -0.53 0.00 0.00 176.83 176.65 3b78 h LEU 39 N -0.79 0.00 0.11 2.23 4.07 -1.42 -2.72 115.31 116.79 3b78 h LEU 39 Ca -0.01 0.00 -0.30 0.00 0.08 0.00 0.00 57.88 57.65 3b78 h LEU 39 Cb 0.60 0.00 0.03 0.00 1.08 0.00 0.00 40.66 42.37 3b78 h LEU 39 CO 0.02 0.12 -1.25 0.58 -1.08 0.00 0.00 178.44 176.83 3b78 h VAL 40 N 0.00 1.29 -0.03 1.22 2.07 -1.47 -0.00 116.25 119.33 3b78 h VAL 40 Ca -0.00 -2.49 0.00 0.00 0.82 0.00 0.00 66.70 65.03 3b78 h VAL 40 Cb 0.36 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.83 3b78 h VAL 40 CO 0.02 0.76 0.00 0.00 0.02 0.00 0.00 177.57 178.36 3b78 n GLN 41 N -3.78 1.13 0.10 1.57 6.02 -0.80 -1.60 117.38 120.02 3b78 n GLN 41 Ca -0.13 -0.12 0.00 0.00 -0.01 0.00 0.00 57.00 56.73 3b78 n GLN 41 Cb 0.99 -1.36 0.00 0.00 1.02 0.00 0.00 30.24 30.89 3b78 n GLN 41 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 3b78 n ARG 42 N -0.13 0.00 -0.37 -1.09 3.00 -1.14 -4.86 116.66 112.08 3b78 n ARG 42 Ca 0.01 0.00 0.10 0.00 -0.00 0.00 0.00 57.85 57.96 3b78 n ARG 42 Cb 0.20 -0.21 0.29 0.00 0.00 0.00 0.00 32.46 32.74 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 -3.43 2.43 -1.62 5.13 0.00 -0.02 -4.86 120.51 118.15 3b78 n ALA 43 Ca 0.00 -1.33 -0.49 0.00 0.00 0.00 0.00 53.44 51.63 3b78 n ALA 43 Cb 0.00 -0.84 -0.05 0.00 0.00 0.00 0.00 19.45 18.57 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 1.33 0.61 3.30 0.00 0.00 -0.62 -1.46 105.19 108.36 3b78 n GLY 44 Ca 0.22 0.63 -0.36 0.00 0.00 0.00 0.00 46.02 46.52 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 0.41 3.57 0.19 -0.61 -1.09 -0.34 -3.73 121.20 119.60 3b78 s ILE 45 Ca 0.79 -0.71 0.06 0.00 -2.23 0.00 0.00 60.65 58.56 3b78 s ILE 45 Cb -0.82 -2.78 -0.04 0.00 -1.58 0.00 0.00 42.46 37.24 3b78 s ILE 45 CO 0.46 0.20 0.13 -0.63 -1.23 0.00 0.00 174.94 173.86 3b78 s ILE 46 N 1.46 4.33 0.36 2.92 1.09 -1.01 -4.75 121.20 125.59 3b78 s ILE 46 Ca 0.03 -1.24 -0.05 0.00 -1.10 0.00 0.00 60.65 58.29 3b78 s ILE 46 Cb -0.16 -3.24 0.08 0.00 -1.06 0.00 0.00 42.46 38.08 3b78 s ILE 46 CO -0.01 -0.18 0.50 -1.54 -0.10 0.00 0.00 174.94 173.61 3b78 n SER 47 N -0.54 0.15 -0.06 3.58 3.41 -1.26 -0.12 113.62 118.78 3b78 n SER 47 Ca -0.08 -1.24 -0.08 0.00 -0.26 0.00 0.00 58.87 57.21 3b78 n SER 47 Cb 0.56 -0.37 -0.02 0.00 -0.26 0.00 0.00 64.21 64.12 3b78 n SER 47 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3b78 h ALA 48 N -1.62 0.19 0.00 7.33 0.00 -1.61 -3.38 119.26 120.18 3b78 h ALA 48 Ca -0.16 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3b78 h ALA 48 Cb 0.47 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3b78 h ALA 48 CO 0.12 -0.44 0.00 0.41 0.00 0.00 0.00 179.25 179.34 3b78 n GLY 67 N -1.21 0.16 3.37 0.00 0.00 -1.26 -5.02 105.19 101.23 3b78 n GLY 67 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.51 2.63 -0.09 -0.61 -1.09 -1.26 -4.99 121.20 115.28 3b78 s ILE 68 Ca 0.00 -0.86 0.02 0.00 -2.23 0.00 0.00 60.65 57.58 3b78 s ILE 68 Cb 0.00 -2.02 -0.02 0.00 -1.58 0.00 0.00 42.46 38.85 3b78 s ILE 68 CO 0.00 0.57 -0.15 0.42 -1.23 0.00 0.00 174.94 174.55 3b78 s THR 69 N -0.28 2.94 0.51 2.92 -4.23 -1.26 -3.98 115.64 112.27 3b78 s THR 69 Ca 0.01 -0.74 0.00 0.00 -1.18 0.00 0.00 61.69 59.78 3b78 s THR 69 Cb -0.13 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.53 3b78 s THR 69 CO 0.03 0.56 0.01 2.30 -0.54 0.00 0.00 174.62 176.97 3b78 n ILE 70 N 2.91 0.00 -2.54 2.99 -5.35 0.12 -1.35 119.36 116.15 3b78 n ILE 70 Ca -0.18 -2.42 -0.41 0.00 -0.27 0.00 0.00 62.75 59.47 3b78 n ILE 70 Cb 0.52 0.48 -0.04 0.00 -1.74 0.00 0.00 39.64 38.86 3b78 n ILE 70 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 3b78 s LYS 71 N -3.86 4.55 -0.51 6.28 2.20 -1.19 -4.42 119.74 122.79 3b78 s LYS 71 Ca 0.01 1.66 -0.26 0.00 -0.36 0.00 0.00 55.97 57.01 3b78 s LYS 71 Cb -0.00 -3.34 -0.06 0.00 -1.51 0.00 0.00 37.83 32.93 3b78 s LYS 71 CO 0.00 -0.03 2.25 -1.12 -0.36 0.00 0.00 175.35 176.10 3b78 s SER 72 N 0.44 4.71 -0.16 1.43 0.01 -1.22 -4.70 113.70 114.20 3b78 s SER 72 Ca 0.52 0.93 0.07 0.00 1.31 0.00 0.00 55.95 58.79 3b78 s SER 72 Cb -0.27 -2.51 -0.15 0.00 0.21 0.00 0.00 66.02 63.30 3b78 s SER 72 CO 0.31 -2.70 -0.06 0.41 0.41 0.00 0.00 173.24 171.62 3b78 n THR 73 N 7.78 1.02 -3.82 1.44 -1.04 -1.25 -4.88 114.28 113.54 3b78 n THR 73 Ca 0.32 -0.51 -0.12 0.00 -2.04 0.00 0.00 64.05 61.70 3b78 n THR 73 Cb 0.54 -0.88 -0.13 0.00 -1.82 0.00 0.00 70.33 68.04 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 -2.36 -0.39 -0.05 2.41 0.00 -1.25 -0.11 121.76 120.02 3b78 s ALA 74 Ca -0.16 0.45 0.04 0.00 0.00 0.00 0.00 51.96 52.30 3b78 s ALA 74 Cb 0.05 -0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 3b78 s ALA 74 CO 0.51 -0.08 -0.17 0.42 0.00 0.00 0.00 175.76 176.44 3b78 s ILE 75 N 0.12 2.87 -0.21 0.00 -1.09 -0.95 -0.81 121.20 121.14 3b78 s ILE 75 Ca -0.00 -0.80 -0.14 0.00 -2.23 0.00 0.00 60.65 57.48 3b78 s ILE 75 Cb -0.01 -2.10 -0.04 0.00 -1.58 0.00 0.00 42.46 38.72 3b78 s ILE 75 CO -0.00 0.59 0.32 -0.44 -1.23 0.00 0.00 174.94 174.18 3b78 s SER 76 N -0.67 6.35 0.28 3.58 0.01 -1.26 -0.81 113.70 121.18 3b78 s SER 76 Ca 0.10 0.41 0.11 0.00 1.31 0.00 0.00 55.95 57.89 3b78 s SER 76 Cb -0.11 -2.19 -0.05 0.00 0.21 0.00 0.00 66.02 63.88 3b78 s SER 76 CO 0.00 -0.02 -0.15 -0.76 0.41 0.00 0.00 173.24 172.73 3b78 s LEU 77 N 1.13 2.75 -0.05 2.44 1.02 -0.05 -1.20 118.68 124.72 3b78 s LEU 77 Ca 0.16 -0.94 -0.02 0.00 0.02 0.00 0.00 54.13 53.35 3b78 s LEU 77 Cb -0.14 -1.26 0.04 0.00 0.02 0.00 0.00 46.19 44.85 3b78 s LEU 77 CO 0.06 0.02 0.09 -0.47 0.02 0.00 0.00 176.35 176.08 3b78 s TYR 78 N -2.47 -0.03 -0.01 0.29 5.04 -0.53 -1.33 117.35 118.32 3b78 s TYR 78 Ca 0.30 0.38 0.04 0.00 -2.44 0.00 0.00 57.07 55.35 3b78 s TYR 78 Cb -0.05 -0.38 -0.01 0.00 0.35 0.00 0.00 41.96 41.87 3b78 s TYR 78 CO 0.16 -0.21 -0.12 0.45 -1.34 0.00 0.00 175.55 174.49 3b78 s SER 79 N 2.12 1.44 -0.11 4.32 0.15 -1.05 -4.65 113.70 115.92 3b78 s SER 79 Ca 0.03 -0.23 0.03 0.00 0.70 0.00 0.00 55.95 56.48 3b78 s SER 79 Cb -0.12 -0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 3b78 s SER 79 CO -0.04 0.15 -0.22 -0.70 1.20 0.00 0.00 173.24 173.62 3b78 s GLU 80 N -0.32 3.08 0.00 5.44 2.12 -1.26 -1.35 118.70 126.41 3b78 s GLU 80 Ca 0.05 -0.85 0.00 0.00 0.36 0.00 0.00 54.97 54.52 3b78 s GLU 80 Cb -0.05 -2.37 0.00 0.00 0.26 0.00 0.00 34.13 31.97 3b78 s GLU 80 CO -0.00 0.13 0.00 -1.33 -0.54 0.00 0.00 175.26 173.52 3b78 n MET 81 N 3.66 2.67 -4.55 4.30 2.81 -0.81 -5.03 117.12 120.18 3b78 n MET 81 Ca -0.19 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.44 3b78 n MET 81 Cb 0.53 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 32.93 3b78 n MET 81 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3b78 s SER 82 N -0.82 3.53 0.62 7.83 1.04 -1.26 -4.86 113.70 119.78 3b78 s SER 82 Ca 0.00 -1.28 0.33 0.00 0.48 0.00 0.00 55.95 55.48 3b78 s SER 82 Cb 0.00 -0.32 1.88 0.00 0.10 0.00 0.00 66.02 67.68 3b78 s SER 82 CO 0.00 -0.35 2.17 0.44 0.98 0.00 0.00 173.24 176.47 3b78 h ASP 83 N 1.97 0.00 0.29 7.02 5.19 -1.98 0.18 116.42 129.09 3b78 h ASP 83 Ca -0.42 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 55.65 3b78 h ASP 83 Cb 1.24 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.74 3b78 h ASP 83 CO 0.74 0.00 -1.76 -0.33 -3.12 0.00 0.00 179.24 174.77 3b78 h GLU 84 N 0.00 0.26 0.00 3.56 4.39 -1.99 -3.20 114.58 117.61 3b78 h GLU 84 Ca 0.04 -0.44 -0.05 0.00 0.34 0.00 0.00 59.36 59.24 3b78 h GLU 84 Cb 0.32 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 3b78 h GLU 84 CO -0.00 1.12 -0.24 -0.44 -1.16 0.00 0.00 179.01 178.29 3b78 h ASP 85 N 0.07 0.00 1.72 1.42 3.32 -1.52 -1.32 116.42 120.12 3b78 h ASP 85 Ca -0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 3b78 h ASP 85 Cb 2.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.59 3b78 h ASP 85 CO 0.13 0.24 0.00 0.58 -1.72 0.00 0.00 179.24 178.48 3b78 h VAL 86 N 0.00 0.00 0.00 -1.35 2.07 -0.81 -3.16 116.25 113.00 3b78 h VAL 86 Ca -0.00 -0.84 -0.13 0.00 0.82 0.00 0.00 66.70 66.55 3b78 h VAL 86 Cb 0.63 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 3b78 h VAL 86 CO 0.03 0.00 -1.38 0.29 0.02 0.00 0.00 177.57 176.53 3b78 n LYS 87 N -3.02 0.62 -0.02 1.57 4.76 -0.65 -4.25 118.16 117.17 3b78 n LYS 87 Ca 0.03 0.17 -0.13 0.00 -2.87 0.00 0.00 58.31 55.52 3b78 n LYS 87 Cb 0.47 -1.79 -0.09 0.00 -1.84 0.00 0.00 35.03 31.78 3b78 n LYS 87 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 3b78 h GLU 88 N 0.00 0.08 -5.97 1.97 5.08 -1.25 -3.42 114.58 111.07 3b78 h GLU 88 Ca -0.13 -0.03 -0.64 0.00 -1.00 0.00 0.00 59.36 57.56 3b78 h GLU 88 Cb 1.44 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.68 3b78 h GLU 88 CO 0.03 0.48 1.45 -0.89 -1.00 0.00 0.00 179.01 179.08 3b78 n ILE 89 N -4.83 0.23 0.05 3.13 5.41 -1.21 -4.78 119.36 117.36 3b78 n ILE 89 Ca -0.08 -0.34 0.22 0.00 1.00 0.00 0.00 62.75 63.55 3b78 n ILE 89 Cb 0.24 -1.96 0.72 0.00 -0.71 0.00 0.00 39.64 37.93 3b78 n ILE 89 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 3b78 h LYS 90 N 13.47 0.00 -7.17 0.38 1.63 -1.85 -3.42 116.57 119.61 3b78 h LYS 90 Ca -0.31 0.00 -0.51 0.00 -0.85 0.00 0.00 60.65 58.98 3b78 h LYS 90 Cb 1.29 0.00 0.10 0.00 -0.60 0.00 0.00 32.23 33.02 3b78 h LYS 90 CO 1.01 0.00 0.39 -1.14 -3.45 0.00 0.00 179.45 176.26 3b78 s GLN 91 N -4.63 2.91 -0.32 1.90 0.74 -1.26 -4.98 119.66 114.02 3b78 s GLN 91 Ca -0.04 1.46 -0.27 0.00 0.05 0.00 0.00 55.36 56.56 3b78 s GLN 91 Cb 0.16 -1.96 0.01 0.00 1.10 0.00 0.00 33.01 32.32 3b78 s GLN 91 CO 0.56 -1.17 0.97 0.21 -0.55 0.00 0.00 175.29 175.31 3b78 s LYS 92 N -3.88 4.00 0.41 1.67 2.20 -1.26 -5.02 119.74 117.86 3b78 s LYS 92 Ca 0.69 0.86 0.01 0.00 -0.36 0.00 0.00 55.97 57.16 3b78 s LYS 92 Cb -0.22 -3.75 -0.00 0.00 -1.51 0.00 0.00 37.83 32.35 3b78 s LYS 92 CO 0.38 -0.85 0.03 0.25 -0.36 0.00 0.00 175.35 174.80 3b78 n THR 93 N 5.80 0.00 -3.22 3.43 -2.24 -1.26 -4.79 114.28 111.99 3b78 n THR 93 Ca 0.09 -2.04 -0.02 0.00 -2.27 0.00 0.00 64.05 59.81 3b78 n THR 93 Cb 0.47 0.48 -0.02 0.00 -2.10 0.00 0.00 70.33 69.16 3b78 n THR 93 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3b78 s ASP 94 N -3.32 -0.84 0.00 3.42 2.15 -1.26 -5.02 116.67 111.80 3b78 s ASP 94 Ca 0.04 -0.21 0.00 0.00 0.43 0.00 0.00 52.55 52.81 3b78 s ASP 94 Cb 0.00 1.66 0.00 0.00 -0.30 0.00 0.00 42.92 44.28 3b78 s ASP 94 CO 0.03 -0.30 0.00 0.61 -0.17 0.00 0.00 175.17 175.34 3b78 n GLY 95 N 5.21 -0.88 0.00 2.66 0.00 -1.26 -4.79 105.19 106.14 3b78 n GLY 95 Ca 0.05 -2.16 0.02 0.00 0.00 0.00 0.00 46.02 43.93 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 3.55 -4.75 1.61 3.02 -1.26 -4.91 115.26 112.53 3b78 n ASN 96 Ca 0.00 -0.08 -0.40 0.00 -0.03 0.00 0.00 54.58 54.07 3b78 n ASN 96 Cb 0.00 1.15 -0.05 0.00 -0.61 0.00 0.00 39.78 40.27 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 -2.30 7.42 -0.09 6.41 0.01 -1.26 -1.92 113.70 121.97 3b78 s SER 97 Ca -0.01 1.69 0.00 0.00 1.31 0.00 0.00 55.95 58.95 3b78 s SER 97 Cb 0.03 -2.54 0.02 0.00 0.21 0.00 0.00 66.02 63.74 3b78 s SER 97 CO 0.16 0.05 -0.08 -0.36 0.41 0.00 0.00 173.24 173.43 3b78 s PHE 98 N -0.46 1.31 0.10 2.43 0.08 -0.45 -4.82 117.98 116.17 3b78 s PHE 98 Ca 0.41 -0.56 -0.22 0.00 0.12 0.00 0.00 56.93 56.67 3b78 s PHE 98 Cb -0.23 -1.08 -0.07 0.00 -0.57 0.00 0.00 43.02 41.07 3b78 s PHE 98 CO 0.28 -0.39 0.67 -1.17 -0.10 0.00 0.00 175.22 174.51 3b78 s LEU 99 N 1.32 4.54 -0.18 -0.37 2.96 -0.31 -2.52 118.68 124.12 3b78 s LEU 99 Ca -0.03 1.42 -0.00 0.00 -0.22 0.00 0.00 54.13 55.30 3b78 s LEU 99 Cb -0.14 -3.09 0.05 0.00 0.50 0.00 0.00 46.19 43.51 3b78 s LEU 99 CO -0.03 0.21 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.53 3b78 s ILE 100 N -0.94 1.16 -0.36 6.68 1.01 -0.44 0.38 121.20 128.69 3b78 s ILE 100 Ca 0.33 -0.75 -0.18 0.00 0.00 0.00 0.00 60.65 60.05 3b78 s ILE 100 Cb -0.21 -1.38 -0.00 0.00 0.01 0.00 0.00 42.46 40.88 3b78 s ILE 100 CO 0.22 0.06 0.49 0.20 0.00 0.00 0.00 174.94 175.91 3b78 s ASN 101 N 1.60 6.29 -0.91 3.58 0.02 0.13 -0.87 114.94 124.77 3b78 s ASN 101 Ca -0.01 -0.12 -0.15 0.00 -1.02 0.00 0.00 52.86 51.57 3b78 s ASN 101 Cb -0.16 -2.26 0.20 0.00 0.02 0.00 0.00 41.25 39.05 3b78 s ASN 101 CO -0.07 -0.48 0.94 -0.22 0.02 0.00 0.00 177.10 177.29 3b78 s LEU 102 N 2.34 6.17 -0.15 0.60 2.96 0.01 -2.15 118.68 128.46 3b78 s LEU 102 Ca 0.17 -2.66 -0.29 0.00 -0.22 0.00 0.00 54.13 51.13 3b78 s LEU 102 Cb -0.16 -2.27 -0.02 0.00 0.50 0.00 0.00 46.19 44.24 3b78 s LEU 102 CO 0.13 -0.67 1.34 -0.63 -1.32 0.00 0.00 176.35 175.20 3b78 s ILE 103 N 0.72 4.14 0.55 6.68 1.09 -0.47 -2.23 121.20 131.69 3b78 s ILE 103 Ca 0.25 1.38 -0.21 0.00 -1.10 0.00 0.00 60.65 60.96 3b78 s ILE 103 Cb -0.08 -3.90 -0.05 0.00 -1.06 0.00 0.00 42.46 37.37 3b78 s ILE 103 CO -0.08 -0.14 1.35 -0.62 -0.10 0.00 0.00 174.94 175.34 3b78 s ASP 104 N 2.29 5.22 -0.02 3.58 2.15 0.85 -4.35 116.67 126.40 3b78 s ASP 104 Ca 0.58 2.74 0.05 0.00 0.43 0.00 0.00 52.55 56.35 3b78 s ASP 104 Cb -0.24 -2.63 -0.01 0.00 -0.30 0.00 0.00 42.92 39.74 3b78 s ASP 104 CO 0.18 -1.60 -0.18 -0.55 -0.17 0.00 0.00 175.17 172.85 3b78 s SER 105 N -1.01 2.12 0.93 -0.34 0.15 -1.26 -4.85 113.70 109.45 3b78 s SER 105 Ca 0.72 -0.33 -0.11 0.00 0.70 0.00 0.00 55.95 56.93 3b78 s SER 105 Cb -0.40 -0.34 0.10 0.00 -1.71 0.00 0.00 66.02 63.68 3b78 s SER 105 CO 0.47 0.20 0.83 -2.65 1.20 0.00 0.00 173.24 173.29 3b78 n PRO 106 N 2.78 -0.40 0.03 5.44 -0.02 -1.26 -5.00 135.00 136.57 3b78 n PRO 106 Ca -0.16 -0.06 -0.02 0.00 -2.02 0.00 0.00 63.50 61.25 3b78 n PRO 106 Cb 0.54 -2.16 -0.01 0.00 -0.02 0.00 0.00 33.50 31.85 3b78 n PRO 106 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3b78 h GLY 107 N -1.77 -0.12 -2.01 -1.23 0.00 -2.00 -3.46 103.07 92.48 3b78 h GLY 107 Ca -0.43 0.04 -0.46 0.00 0.00 0.00 0.00 47.33 46.48 3b78 h GLY 107 CO 0.38 -0.04 0.37 0.30 0.00 0.00 0.00 176.54 177.55 3b78 s HIS 108 N -1.85 3.14 -0.93 5.60 3.76 -1.26 -4.70 115.29 119.06 3b78 s HIS 108 Ca -0.02 1.57 0.28 0.00 -0.15 0.00 0.00 55.06 56.75 3b78 s HIS 108 Cb 0.00 -2.96 1.05 0.00 1.11 0.00 0.00 32.58 31.78 3b78 s HIS 108 CO 0.05 -0.56 1.83 0.28 -0.85 0.00 0.00 174.74 175.49 3b78 n VAL 109 N -0.99 0.15 0.29 -0.90 0.31 -1.26 -3.35 118.33 112.59 3b78 n VAL 109 Ca 0.08 -0.08 0.17 0.00 -0.01 0.00 0.00 64.34 64.51 3b78 n VAL 109 Cb 0.53 -0.45 0.93 0.00 -0.91 0.00 0.00 33.84 33.94 3b78 n VAL 109 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3b78 h ASP 110 N 0.00 0.00 -0.24 4.52 3.32 -2.00 -1.36 116.42 120.67 3b78 h ASP 110 Ca 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 3b78 h ASP 110 Cb 0.56 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.04 3b78 h ASP 110 CO 0.00 0.00 0.20 0.49 -1.72 0.00 0.00 179.24 178.21 3b78 n PHE 111 N -2.80 0.76 -0.32 4.55 3.72 -1.21 -4.67 117.46 117.48 3b78 n PHE 111 Ca -0.02 -1.48 0.19 0.00 -0.05 0.00 0.00 57.45 56.09 3b78 n PHE 111 Cb 0.18 -0.74 0.39 0.00 -0.94 0.00 0.00 39.48 38.37 3b78 n PHE 111 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3b78 h SER 112 N 1.26 0.11 0.84 4.37 0.02 -1.55 -0.78 113.55 117.82 3b78 h SER 112 Ca 0.14 0.22 -0.04 0.00 -0.84 0.00 0.00 61.79 61.28 3b78 h SER 112 Cb 0.96 0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.77 3b78 h SER 112 CO 0.38 -0.24 -0.46 0.77 -1.14 0.00 0.00 176.83 176.14 3b78 h SER 113 N 0.17 -1.14 1.16 3.07 4.64 -1.88 -2.50 113.55 117.06 3b78 h SER 113 Ca 0.66 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 62.04 3b78 h SER 113 Cb 1.48 0.32 0.00 0.00 -0.31 0.00 0.00 62.40 63.89 3b78 h SER 113 CO -0.71 -0.74 0.00 1.05 -0.87 0.00 0.00 176.83 175.56 3b78 h GLU 114 N -1.20 0.00 -0.26 4.77 4.11 -1.77 -2.47 114.58 117.77 3b78 h GLU 114 Ca -0.11 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.19 3b78 h GLU 114 Cb 0.94 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 3b78 h GLU 114 CO 0.15 0.00 -0.38 0.28 0.07 0.00 0.00 179.01 179.13 3b78 h VAL 115 N 0.00 1.29 0.00 -1.06 2.07 -1.00 -2.25 116.25 115.31 3b78 h VAL 115 Ca 0.00 -1.53 0.00 0.00 0.82 0.00 0.00 66.70 65.99 3b78 h VAL 115 Cb 0.58 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 3b78 h VAL 115 CO 0.00 0.49 0.00 0.74 0.02 0.00 0.00 177.57 178.82 3b78 h THR 116 N 0.49 0.00 0.22 2.57 2.02 -0.99 -2.87 112.91 114.35 3b78 h THR 116 Ca 0.05 -0.44 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 3b78 h THR 116 Cb 0.88 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 3b78 h THR 116 CO 0.08 0.00 -0.11 0.00 0.37 0.00 0.00 175.52 175.86 3b78 h ALA 117 N 2.11 -0.29 0.00 6.16 0.00 -1.34 -0.64 119.26 125.25 3b78 h ALA 117 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3b78 h ALA 117 Cb 0.50 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3b78 h ALA 117 CO 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 179.25 178.90 3b78 n ALA 118 N -2.61 1.52 -0.10 0.00 0.00 -1.10 -2.69 120.51 115.54 3b78 n ALA 118 Ca -0.07 -0.04 -0.23 0.00 0.00 0.00 0.00 53.44 53.10 3b78 n ALA 118 Cb 0.24 -1.15 -0.12 0.00 0.00 0.00 0.00 19.45 18.42 3b78 n ALA 118 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3b78 n LEU 119 N -1.40 2.33 0.00 0.00 7.94 -1.09 -3.99 117.00 120.80 3b78 n LEU 119 Ca 0.03 0.22 0.06 0.00 -1.11 0.00 0.00 56.01 55.21 3b78 n LEU 119 Cb 0.09 -0.95 0.27 0.00 0.53 0.00 0.00 43.42 43.37 3b78 n LEU 119 CO 0.08 0.65 0.68 -1.14 -1.11 0.00 0.00 177.39 176.55 3b78 n ARG 120 N -3.89 0.05 -0.00 1.96 0.63 -0.26 -2.51 116.66 112.64 3b78 n ARG 120 Ca -0.42 0.26 0.07 0.00 -0.92 0.00 0.00 57.85 56.84 3b78 n ARG 120 Cb 0.90 -1.50 -0.09 0.00 0.45 0.00 0.00 32.46 32.21 3b78 n ARG 120 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 3b78 n VAL 121 N -1.44 0.00 -3.28 5.15 0.24 -1.20 -5.02 118.33 112.78 3b78 n VAL 121 Ca 0.04 -0.26 -0.20 0.00 -2.04 0.00 0.00 64.34 61.88 3b78 n VAL 121 Cb 0.13 0.55 0.01 0.00 -1.47 0.00 0.00 33.84 33.06 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 -2.64 2.54 -0.00 3.34 -4.23 -1.05 -4.98 115.64 108.62 3b78 s THR 122 Ca -0.00 -1.16 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 3b78 s THR 122 Cb 0.09 -2.70 0.01 0.00 1.34 0.00 0.00 72.50 71.24 3b78 s THR 122 CO 0.56 0.00 0.69 -0.90 -0.54 0.00 0.00 174.62 174.43 3b78 n ASP 123 N -1.84 0.62 -4.05 3.99 5.68 -0.88 -4.93 116.55 115.14 3b78 n ASP 123 Ca 0.07 -1.39 -0.10 0.00 -0.50 0.00 0.00 54.79 52.87 3b78 n ASP 123 Cb 0.61 -0.02 -0.08 0.00 -1.14 0.00 0.00 41.12 40.49 3b78 n ASP 123 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3b78 s GLY 124 N -0.41 0.74 -0.15 6.12 0.00 -0.53 -2.91 107.32 110.17 3b78 s GLY 124 Ca 0.01 -1.16 -0.28 0.00 0.00 0.00 0.00 44.72 43.29 3b78 s GLY 124 CO 0.00 -1.06 0.71 0.00 0.00 0.00 0.00 173.10 172.75 3b78 s ALA 125 N -4.01 -1.78 -0.55 3.20 0.00 -0.91 -2.54 121.76 115.16 3b78 s ALA 125 Ca 0.22 1.64 -0.06 0.00 0.00 0.00 0.00 51.96 53.75 3b78 s ALA 125 Cb 0.05 -0.55 0.14 0.00 0.00 0.00 0.00 23.12 22.77 3b78 s ALA 125 CO 0.02 -0.35 0.40 -1.17 0.00 0.00 0.00 175.76 174.66 3b78 s LEU 126 N -0.49 5.59 -0.85 0.00 2.96 0.28 -1.89 118.68 124.28 3b78 s LEU 126 Ca -0.06 -2.35 -0.25 0.00 -0.22 0.00 0.00 54.13 51.25 3b78 s LEU 126 Cb -0.02 -1.95 0.02 0.00 0.50 0.00 0.00 46.19 44.74 3b78 s LEU 126 CO 0.06 -0.54 1.52 -0.69 -1.32 0.00 0.00 176.35 175.37 3b78 s VAL 127 N 0.69 3.71 -0.51 1.68 1.01 0.19 -0.87 120.40 126.29 3b78 s VAL 127 Ca 0.11 -0.16 -0.23 0.00 0.00 0.00 0.00 61.98 61.70 3b78 s VAL 127 Cb -0.22 -4.71 0.04 0.00 0.00 0.00 0.00 36.38 31.49 3b78 s VAL 127 CO -0.03 -1.63 0.84 -0.69 0.00 0.00 0.00 175.10 173.59 3b78 s VAL 128 N 6.53 4.55 0.29 2.92 1.01 -0.26 -0.81 120.40 134.63 3b78 s VAL 128 Ca 0.48 0.23 0.07 0.00 0.00 0.00 0.00 61.98 62.77 3b78 s VAL 128 Cb -0.05 -4.43 -0.03 0.00 0.00 0.00 0.00 36.38 31.87 3b78 s VAL 128 CO 0.04 -0.93 0.22 -0.69 0.00 0.00 0.00 175.10 173.75 3b78 s VAL 129 N 3.53 3.99 0.42 2.92 1.01 -0.19 -4.41 120.40 127.67 3b78 s VAL 129 Ca 0.28 -1.42 -0.01 0.00 0.00 0.00 0.00 61.98 60.83 3b78 s VAL 129 Cb -0.13 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 3b78 s VAL 129 CO 0.20 -0.28 0.65 -0.62 0.00 0.00 0.00 175.10 175.05 3b78 s ASP 130 N -3.90 6.10 -0.13 3.32 2.15 -1.23 0.26 116.67 123.25 3b78 s ASP 130 Ca 0.36 0.50 -0.21 0.00 0.43 0.00 0.00 52.55 53.63 3b78 s ASP 130 Cb -0.07 -1.89 -0.25 0.00 -0.30 0.00 0.00 42.92 40.41 3b78 s ASP 130 CO 0.25 -0.52 0.56 0.74 -0.17 0.00 0.00 175.17 176.04 3b78 h THR 131 N 0.50 1.25 0.09 1.71 2.02 -1.71 -3.12 112.91 113.63 3b78 h THR 131 Ca -0.48 -2.35 -0.00 0.00 0.77 0.00 0.00 66.41 64.35 3b78 h THR 131 Cb 1.23 2.81 0.00 0.00 -1.74 0.00 0.00 68.15 70.45 3b78 h THR 131 CO 0.60 0.58 -0.04 0.40 0.37 0.00 0.00 175.52 177.43 3b78 h ILE 132 N -0.66 0.24 0.00 3.11 5.03 -1.88 -3.35 117.51 120.01 3b78 h ILE 132 Ca -0.22 -1.07 -0.02 0.00 -0.12 0.00 0.00 64.86 63.43 3b78 h ILE 132 Cb 1.45 0.44 -0.00 0.00 -3.03 0.00 0.00 36.82 35.68 3b78 h ILE 132 CO -0.01 0.08 -0.10 -0.33 -0.68 0.00 0.00 178.15 177.11 3b78 h GLU 133 N -1.02 0.00 0.00 2.37 5.08 -1.99 -3.49 114.58 115.53 3b78 h GLU 133 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3b78 h GLU 133 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 3b78 h GLU 133 CO 0.02 0.10 0.00 0.41 -1.00 0.00 0.00 179.01 178.54 3b78 n GLY 134 N 0.24 0.36 3.61 -3.84 0.00 -1.18 -4.56 105.19 99.82 3b78 n GLY 134 Ca 0.01 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.74 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 3.77 0.98 1.61 1.01 -1.26 -3.53 120.40 122.97 3b78 s VAL 135 Ca 0.00 0.80 -0.14 0.00 0.00 0.00 0.00 61.98 62.63 3b78 s VAL 135 Cb 0.00 -3.98 0.18 0.00 0.00 0.00 0.00 36.38 32.58 3b78 s VAL 135 CO 0.00 -0.58 1.18 0.00 0.00 0.00 0.00 175.10 175.69 3b78 h VAL 137 N -1.73 1.24 0.22 0.00 2.07 -1.97 -2.99 116.25 113.10 3b78 h VAL 137 Ca -0.48 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 65.93 3b78 h VAL 137 Cb 1.30 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 3b78 h VAL 137 CO 0.51 0.36 -0.11 -0.61 0.02 0.00 0.00 177.57 177.74 3b78 h GLN 138 N 0.46 -0.29 -0.05 1.57 4.15 -2.00 -2.90 115.11 116.05 3b78 h GLN 138 Ca 0.08 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.53 3b78 h GLN 138 Cb 0.55 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.31 3b78 h GLN 138 CO 0.04 0.05 0.04 1.15 -1.93 0.00 0.00 178.83 178.17 3b78 h THR 139 N -0.96 0.97 -0.14 2.39 2.02 -1.92 -1.79 112.91 113.48 3b78 h THR 139 Ca -0.03 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.95 3b78 h THR 139 Cb 0.47 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 3b78 h THR 139 CO 0.05 0.00 -0.73 -0.08 0.37 0.00 0.00 175.52 175.13 3b78 h GLU 140 N 0.00 0.65 0.11 6.66 4.81 -1.60 -3.05 114.58 122.16 3b78 h GLU 140 Ca 0.02 -0.52 -0.01 0.00 -0.13 0.00 0.00 59.36 58.73 3b78 h GLU 140 Cb 0.09 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.58 3b78 h GLU 140 CO -0.00 1.13 -0.05 1.15 -0.73 0.00 0.00 179.01 180.51 3b78 h THR 141 N 0.45 0.89 -0.77 0.32 2.02 -1.11 -2.36 112.91 112.35 3b78 h THR 141 Ca -0.04 -0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.26 3b78 h THR 141 Cb 1.34 0.89 -0.05 0.00 -1.74 0.00 0.00 68.15 68.59 3b78 h THR 141 CO 0.14 0.00 0.50 0.58 0.37 0.00 0.00 175.52 177.12 3b78 h VAL 142 N -0.15 0.88 -0.74 3.16 2.07 -1.56 -1.75 116.25 118.16 3b78 h VAL 142 Ca -0.02 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 3b78 h VAL 142 Cb 0.12 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 3b78 h VAL 142 CO 0.03 0.11 0.42 0.25 0.02 0.00 0.00 177.57 178.40 3b78 h LEU 143 N 0.58 0.90 -1.73 2.57 5.85 -1.32 -1.52 115.31 120.66 3b78 h LEU 143 Ca 0.37 -0.08 0.06 0.00 0.84 0.00 0.00 57.88 59.06 3b78 h LEU 143 Cb 0.62 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 3b78 h LEU 143 CO -0.13 0.72 0.29 0.03 -0.34 0.00 0.00 178.44 179.00 3b78 h ARG 144 N 1.01 0.33 -0.04 1.25 3.08 -1.08 -0.49 114.38 118.45 3b78 h ARG 144 Ca 0.26 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.24 3b78 h ARG 144 Cb 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.98 3b78 h ARG 144 CO -0.05 0.22 -0.17 1.96 -1.07 0.00 0.00 179.97 180.86 3b78 h GLN 145 N 0.34 0.18 -0.76 0.04 1.08 -1.30 -2.68 115.11 112.01 3b78 h GLN 145 Ca 0.18 -0.15 0.12 0.00 -1.45 0.00 0.00 58.65 57.35 3b78 h GLN 145 Cb 0.30 0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.71 3b78 h GLN 145 CO -0.04 0.80 0.50 0.00 -0.95 0.00 0.00 178.83 179.14 3b78 h ALA 146 N 0.39 1.90 -0.36 3.87 0.00 -0.68 0.32 119.26 124.70 3b78 h ALA 146 Ca -0.01 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 3b78 h ALA 146 Cb 0.83 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3b78 h ALA 146 CO 0.04 -0.08 -0.26 -0.07 0.00 0.00 0.00 179.25 178.88 3b78 h LEU 147 N 0.59 0.76 -0.31 0.00 3.38 -1.10 -2.20 115.31 116.42 3b78 h LEU 147 Ca 0.36 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3b78 h LEU 147 Cb 0.60 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3b78 h LEU 147 CO -0.13 0.98 0.00 0.61 0.09 0.00 0.00 178.44 179.99 3b78 n GLY 148 N -0.19 -1.22 0.79 0.83 0.00 0.01 -2.29 105.19 103.13 3b78 n GLY 148 Ca -0.00 0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.10 3b78 n GLY 148 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3b78 n GLU 149 N -1.89 2.61 -3.25 1.61 -0.58 -0.68 -5.02 120.64 113.45 3b78 n GLU 149 Ca 0.03 -2.10 -0.06 0.00 -0.42 0.00 0.00 57.16 54.60 3b78 n GLU 149 Cb 0.23 -1.34 0.00 0.00 -0.57 0.00 0.00 31.44 29.76 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 0.81 -1.38 -4.39 3.49 1.74 -0.96 -5.00 116.66 110.97 3b78 n ARG 150 Ca 0.14 1.31 -0.22 0.00 -0.77 0.00 0.00 57.85 58.31 3b78 n ARG 150 Cb 0.46 -4.86 -0.16 0.00 -1.02 0.00 0.00 32.46 26.88 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 -2.99 0.83 -0.12 0.55 1.01 -1.02 -4.91 121.20 114.55 3b78 s ILE 151 Ca 0.00 -0.33 -0.29 0.00 0.00 0.00 0.00 60.65 60.03 3b78 s ILE 151 Cb -0.00 -0.77 -0.05 0.00 0.01 0.00 0.00 42.46 41.65 3b78 s ILE 151 CO 0.79 0.28 1.73 -0.75 0.00 0.00 0.00 174.94 176.99 3b78 s LYS 152 N 0.59 3.95 0.30 2.79 2.47 -1.15 -4.73 119.74 123.96 3b78 s LYS 152 Ca -0.10 2.04 -0.23 0.00 -1.56 0.00 0.00 55.97 56.12 3b78 s LYS 152 Cb -0.13 -4.06 -0.09 0.00 -1.46 0.00 0.00 37.83 32.09 3b78 s LYS 152 CO 0.02 -1.13 0.86 -2.14 0.16 0.00 0.00 175.35 173.11 3b78 s PRO 153 N 4.52 4.42 -0.08 4.03 0.02 -1.26 -2.14 135.00 144.50 3b78 s PRO 153 Ca 0.77 1.12 -0.01 0.00 0.02 0.00 0.00 61.00 62.90 3b78 s PRO 153 Cb -0.31 -2.77 0.03 0.00 0.02 0.00 0.00 34.50 31.46 3b78 s PRO 153 CO 0.31 0.29 -0.02 0.08 -0.33 0.00 0.00 177.00 177.34 3b78 s VAL 154 N -1.64 0.53 -0.06 3.83 1.01 -0.79 -4.88 120.40 118.39 3b78 s VAL 154 Ca 0.49 0.03 -0.21 0.00 0.00 0.00 0.00 61.98 62.28 3b78 s VAL 154 Cb -0.17 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 3b78 s VAL 154 CO 0.22 0.28 0.59 -0.69 0.00 0.00 0.00 175.10 175.50 3b78 s VAL 155 N 1.89 5.04 -0.22 2.92 1.01 -1.15 0.52 120.40 130.40 3b78 s VAL 155 Ca 0.05 1.22 -0.03 0.00 0.00 0.00 0.00 61.98 63.21 3b78 s VAL 155 Cb -0.12 -3.93 0.07 0.00 0.00 0.00 0.00 36.38 32.40 3b78 s VAL 155 CO -0.06 0.34 0.07 -0.69 0.00 0.00 0.00 175.10 174.76 3b78 s VAL 156 N 0.36 0.39 -0.67 2.92 1.01 0.01 -1.97 120.40 122.45 3b78 s VAL 156 Ca 0.32 -0.66 -0.26 0.00 0.00 0.00 0.00 61.98 61.37 3b78 s VAL 156 Cb -0.17 -1.05 0.04 0.00 0.00 0.00 0.00 36.38 35.20 3b78 s VAL 156 CO 0.15 -0.37 1.18 -0.63 0.00 0.00 0.00 175.10 175.43 3b78 s ILE 157 N 1.90 3.94 0.58 2.22 1.01 -0.55 -1.02 121.20 129.29 3b78 s ILE 157 Ca 0.03 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.07 3b78 s ILE 157 Cb -0.17 -4.80 0.04 0.00 0.01 0.00 0.00 42.46 37.54 3b78 s ILE 157 CO -0.15 -1.61 0.81 0.21 0.00 0.00 0.00 174.94 174.20 3b78 s ASN 158 N 3.47 5.17 -1.21 3.58 2.47 0.14 -1.58 114.94 126.98 3b78 s ASN 158 Ca 0.34 0.01 -0.01 0.00 0.42 0.00 0.00 52.86 53.62 3b78 s ASN 158 Cb -0.10 -0.83 0.00 0.00 -1.45 0.00 0.00 41.25 38.87 3b78 s ASN 158 CO 0.17 -1.24 1.01 0.29 -3.72 0.00 0.00 177.10 173.62 3b78 n LYS 159 N -2.43 -6.72 0.21 0.43 5.02 -0.48 -2.68 118.16 111.50 3b78 n LYS 159 Ca 0.08 0.85 0.10 0.00 -2.02 0.00 0.00 58.31 57.32 3b78 n LYS 159 Cb 0.60 -5.87 0.26 0.00 -0.02 0.00 0.00 35.03 30.00 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 -1.96 0.36 0.00 -0.18 2.07 -1.73 -3.08 116.25 111.74 3b78 h VAL 160 Ca -0.59 -1.30 -0.06 0.00 0.82 0.00 0.00 66.70 65.57 3b78 h VAL 160 Cb 1.34 2.00 -0.01 0.00 -1.52 0.00 0.00 31.29 33.11 3b78 h VAL 160 CO 0.50 0.19 -0.29 -2.24 0.02 0.00 0.00 177.57 175.75 3b78 h ASP 161 N 0.00 0.00 0.58 0.57 3.04 -1.91 -2.46 116.42 116.24 3b78 h ASP 161 Ca -0.00 0.00 -0.00 0.00 -3.24 0.00 0.00 57.03 53.79 3b78 h ASP 161 Cb 0.99 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.28 3b78 h ASP 161 CO 0.02 0.29 -0.00 -0.09 -2.04 0.00 0.00 179.24 177.42 3b78 h ARG 162 N 0.00 0.00 0.00 4.15 2.43 -1.93 -0.64 114.38 118.39 3b78 h ARG 162 Ca -0.00 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 3b78 h ARG 162 Cb 0.61 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 3b78 h ARG 162 CO 0.04 0.00 -1.27 0.00 -1.51 0.00 0.00 179.97 177.23 3b78 n ALA 163 N -2.09 2.41 -0.08 2.80 0.00 -0.93 -3.52 120.51 119.09 3b78 n ALA 163 Ca -0.01 -0.37 -0.23 0.00 0.00 0.00 0.00 53.44 52.83 3b78 n ALA 163 Cb 0.21 -1.00 -0.12 0.00 0.00 0.00 0.00 19.45 18.53 3b78 n ALA 163 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3b78 n LEU 164 N -2.66 2.13 0.03 0.00 4.77 -0.81 -1.49 117.00 118.96 3b78 n LEU 164 Ca -0.04 0.33 -0.17 0.00 -0.03 0.00 0.00 56.01 56.10 3b78 n LEU 164 Cb 0.63 -0.98 -0.07 0.00 -2.33 0.00 0.00 43.42 40.67 3b78 n LEU 164 CO 0.42 0.50 0.17 -0.07 -1.33 0.00 0.00 177.39 177.08 3b78 h LEU 165 N -0.68 0.84 0.00 2.23 4.07 -1.35 -3.15 115.31 117.27 3b78 h LEU 165 Ca -0.43 -0.62 0.00 0.00 0.08 0.00 0.00 57.88 56.90 3b78 h LEU 165 Cb 1.57 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 43.05 3b78 h LEU 165 CO -0.16 1.42 0.00 -0.62 -1.08 0.00 0.00 178.44 177.99 3b78 n GLU 166 N -3.86 0.00 0.31 1.13 1.02 -1.23 -4.55 120.64 113.46 3b78 n GLU 166 Ca -0.09 0.06 0.19 0.00 -0.02 0.00 0.00 57.16 57.31 3b78 n GLU 166 Cb 0.82 -0.36 1.04 0.00 -0.02 0.00 0.00 31.44 32.92 3b78 n GLU 166 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3b78 h LEU 167 N 0.00 0.00 1.23 -4.62 4.07 -1.65 -3.45 115.31 110.89 3b78 h LEU 167 Ca 0.00 0.00 -0.39 0.00 0.08 0.00 0.00 57.88 57.57 3b78 h LEU 167 Cb 0.00 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.75 3b78 h LEU 167 CO 0.00 0.00 -0.56 0.00 -1.08 0.00 0.00 178.44 176.80 3b78 n GLN 168 N -3.45 -3.95 -1.75 1.13 6.02 -0.89 -4.90 117.38 109.60 3b78 n GLN 168 Ca -0.02 0.78 -0.39 0.00 -0.01 0.00 0.00 57.00 57.36 3b78 n GLN 168 Cb 0.13 -5.56 0.03 0.00 1.02 0.00 0.00 30.24 25.86 3b78 n GLN 168 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 3b78 n VAL 169 N -4.21 3.48 -0.90 5.09 3.14 -0.56 -5.00 118.33 119.38 3b78 n VAL 169 Ca -0.10 -0.50 -0.01 0.00 -2.96 0.00 0.00 64.34 60.76 3b78 n VAL 169 Cb 0.61 -1.72 0.01 0.00 -1.06 0.00 0.00 33.84 31.67 3b78 n VAL 169 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3b78 n SER 170 N -0.72 -0.29 0.08 6.55 3.41 -1.26 -4.85 113.62 116.55 3b78 n SER 170 Ca 0.09 -0.89 -0.22 0.00 -0.26 0.00 0.00 58.87 57.59 3b78 n SER 170 Cb 0.43 -0.05 -0.15 0.00 -0.26 0.00 0.00 64.21 64.19 3b78 n SER 170 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3b78 h LYS 171 N 0.00 0.38 -0.22 4.33 1.57 -1.96 -2.59 116.57 118.07 3b78 h LYS 171 Ca -0.02 -0.65 -0.17 0.00 -1.87 0.00 0.00 60.65 57.94 3b78 h LYS 171 Cb 0.06 0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 3b78 h LYS 171 CO 0.01 1.31 -0.55 1.49 -0.57 0.00 0.00 179.45 181.14 3b78 h GLU 172 N -0.20 0.68 0.00 3.15 4.57 -1.96 -1.95 114.58 118.87 3b78 h GLU 172 Ca -0.18 -0.43 -0.11 0.00 -1.18 0.00 0.00 59.36 57.46 3b78 h GLU 172 Cb 1.82 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 30.44 3b78 h GLU 172 CO 0.19 1.05 -0.53 -0.44 -1.18 0.00 0.00 179.01 178.11 3b78 h ASP 173 N 0.52 0.00 1.08 1.04 3.32 -1.95 -2.28 116.42 118.15 3b78 h ASP 173 Ca 0.01 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.87 3b78 h ASP 173 Cb 1.12 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.64 3b78 h ASP 173 CO 0.11 0.53 -0.92 0.25 -1.72 0.00 0.00 179.24 177.48 3b78 h LEU 174 N 0.00 0.00 -0.42 1.55 5.85 -1.40 -3.12 115.31 117.77 3b78 h LEU 174 Ca -0.01 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.56 3b78 h LEU 174 Cb 1.02 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 3b78 h LEU 174 CO 0.07 0.90 -0.33 0.22 -0.34 0.00 0.00 178.44 178.96 3b78 h TYR 175 N 0.00 1.14 0.00 1.25 3.20 -1.18 -2.37 116.97 119.00 3b78 h TYR 175 Ca -0.02 -0.32 0.00 0.00 3.14 0.00 0.00 58.73 61.53 3b78 h TYR 175 Cb 1.70 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 39.72 3b78 h TYR 175 CO 0.00 1.15 0.00 1.04 -1.64 0.00 0.00 178.16 178.71 3b78 n GLN 176 N -4.08 0.22 -0.08 1.82 1.13 -0.87 -2.18 117.38 113.34 3b78 n GLN 176 Ca -0.02 0.14 -0.14 0.00 -1.94 0.00 0.00 57.00 55.04 3b78 n GLN 176 Cb 0.52 -1.50 -0.10 0.00 0.11 0.00 0.00 30.24 29.27 3b78 n GLN 176 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 3b78 h THR 177 N 0.00 1.24 -0.01 5.09 2.02 -1.36 -3.24 112.91 116.65 3b78 h THR 177 Ca 0.00 -2.07 -0.10 0.00 0.77 0.00 0.00 66.41 65.00 3b78 h THR 177 Cb 0.16 2.49 -0.01 0.00 -1.74 0.00 0.00 68.15 69.05 3b78 h THR 177 CO 0.00 0.42 -0.48 -0.26 0.37 0.00 0.00 175.52 175.57 3b78 h PHE 178 N -1.00 0.04 -0.23 3.16 0.04 -1.45 -0.91 116.94 116.59 3b78 h PHE 178 Ca -0.10 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.61 3b78 h PHE 178 Cb 0.95 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.08 3b78 h PHE 178 CO 0.17 0.51 -0.06 0.00 -0.60 0.00 0.00 178.31 178.33 3b78 h ALA 179 N 1.49 1.47 0.00 2.45 0.00 -1.58 0.86 119.26 123.94 3b78 h ALA 179 Ca -0.00 -0.19 -0.21 0.00 0.00 0.00 0.00 54.91 54.51 3b78 h ALA 179 Cb 0.87 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 3b78 h ALA 179 CO 0.06 0.37 -1.47 0.00 0.00 0.00 0.00 179.25 178.22 3b78 h ARG 180 N 0.34 0.00 -0.27 0.00 3.08 -1.54 -2.79 114.38 113.20 3b78 h ARG 180 Ca 0.07 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 3b78 h ARG 180 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 3b78 h ARG 180 CO 0.01 0.38 -0.11 1.15 -1.07 0.00 0.00 179.97 180.34 3b78 h THR 181 N 0.00 1.29 0.00 2.04 2.02 -0.73 -0.94 112.91 116.60 3b78 h THR 181 Ca -0.20 -1.17 -0.14 0.00 0.77 0.00 0.00 66.41 65.67 3b78 h THR 181 Cb 1.73 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 69.61 3b78 h THR 181 CO 0.06 0.37 -0.67 0.58 0.37 0.00 0.00 175.52 176.23 3b78 h VAL 182 N 0.29 1.26 -0.01 3.16 2.07 -0.99 -3.03 116.25 119.00 3b78 h VAL 182 Ca 0.06 -2.48 -0.10 0.00 0.82 0.00 0.00 66.70 65.00 3b78 h VAL 182 Cb 0.60 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.78 3b78 h VAL 182 CO 0.03 0.66 -0.48 -0.08 0.02 0.00 0.00 177.57 177.72 3b78 h GLU 183 N 0.00 0.03 0.00 1.57 4.57 -1.41 -0.22 114.58 119.12 3b78 h GLU 183 Ca -0.01 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3b78 h GLU 183 Cb 1.37 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.96 3b78 h GLU 183 CO 0.09 0.50 0.00 0.43 -1.18 0.00 0.00 179.01 178.85 3b78 n SER 184 N -3.97 0.00 -0.13 1.04 7.64 -0.36 -2.82 113.62 115.02 3b78 n SER 184 Ca -0.02 0.42 -0.27 0.00 1.01 0.00 0.00 58.87 60.02 3b78 n SER 184 Cb 0.50 -0.47 -0.11 0.00 -1.01 0.00 0.00 64.21 63.13 3b78 n SER 184 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3b78 n VAL 185 N -1.47 1.53 -0.17 0.44 0.31 -0.52 -4.09 118.33 114.36 3b78 n VAL 185 Ca 0.06 -0.26 0.01 0.00 -0.01 0.00 0.00 64.34 64.14 3b78 n VAL 185 Cb 0.25 -1.94 0.27 0.00 -0.91 0.00 0.00 33.84 31.51 3b78 n VAL 185 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3b78 h ASN 186 N -1.00 0.79 -0.51 4.52 -1.07 -1.14 0.25 115.58 117.42 3b78 h ASN 186 Ca -0.58 -0.03 -0.01 0.00 0.07 0.00 0.00 56.30 55.75 3b78 h ASN 186 Cb 1.51 -0.20 -0.02 0.00 -2.07 0.00 0.00 38.32 37.53 3b78 h ASN 186 CO -0.35 0.60 0.30 0.58 0.07 0.00 0.00 177.43 178.62 3b78 h VAL 187 N 0.92 1.16 -0.05 6.14 2.07 -1.75 0.42 116.25 125.15 3b78 h VAL 187 Ca 0.24 -0.39 -0.09 0.00 0.82 0.00 0.00 66.70 67.28 3b78 h VAL 187 Cb -0.06 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 3b78 h VAL 187 CO -0.05 0.17 -0.39 0.40 0.02 0.00 0.00 177.57 177.72 3b78 h ILE 188 N 0.69 1.29 0.04 4.57 1.08 -1.46 -2.91 117.51 120.81 3b78 h ILE 188 Ca 0.18 -1.41 -0.00 0.00 -0.39 0.00 0.00 64.86 63.24 3b78 h ILE 188 Cb 0.01 1.69 0.00 0.00 -3.07 0.00 0.00 36.82 35.45 3b78 h ILE 188 CO -0.03 0.41 -0.02 0.58 -0.69 0.00 0.00 178.15 178.40 3b78 h VAL 189 N 0.10 0.00 -1.34 1.67 2.07 0.31 -2.90 116.25 116.16 3b78 h VAL 189 Ca 0.01 -0.05 0.39 0.00 0.82 0.00 0.00 66.70 67.86 3b78 h VAL 189 Cb 0.74 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.45 3b78 h VAL 189 CO 0.06 0.00 0.96 0.77 0.02 0.00 0.00 177.57 179.37 3b78 h SER 190 N -0.11 0.03 0.02 0.57 4.64 -0.31 0.42 113.55 118.81 3b78 h SER 190 Ca -0.01 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3b78 h SER 190 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3b78 h SER 190 CO 0.01 -0.00 -0.01 0.74 -0.87 0.00 0.00 176.83 176.70 3b78 h THR 191 N 0.02 0.00 -0.10 2.95 2.02 -1.60 -3.33 112.91 112.88 3b78 h THR 191 Ca 0.65 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.78 3b78 h THR 191 Cb 2.53 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.93 3b78 h THR 191 CO -0.03 0.00 0.03 -1.22 0.37 0.00 0.00 175.52 174.66 3b78 n TYR 192 N -2.12 0.33 -3.50 3.16 4.01 -0.92 -4.81 117.16 113.31 3b78 n TYR 192 Ca -0.00 -0.27 -0.37 0.00 -0.16 0.00 0.00 57.90 57.10 3b78 n TYR 192 Cb 0.01 -0.21 -0.08 0.00 -0.31 0.00 0.00 39.34 38.75 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 -1.02 3.58 0.83 -0.72 0.00 0.09 -4.65 121.76 119.88 3b78 s ALA 193 Ca 0.08 -0.57 -0.13 0.00 0.00 0.00 0.00 51.96 51.34 3b78 s ALA 193 Cb 0.06 -2.48 0.07 0.00 0.00 0.00 0.00 23.12 20.77 3b78 s ALA 193 CO 0.02 -0.13 1.01 -0.25 0.00 0.00 0.00 175.76 176.41 3b78 n ASP 194 N 4.09 0.26 0.03 0.00 8.00 -1.26 -4.94 116.55 122.73 3b78 n ASP 194 Ca -0.11 0.53 -0.18 0.00 0.71 0.00 0.00 54.79 55.74 3b78 n ASP 194 Cb 0.52 -1.43 -0.09 0.00 -0.02 0.00 0.00 41.12 40.10 3b78 n ASP 194 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3b78 h GLU 195 N -1.07 0.69 -0.63 -1.24 5.08 -1.97 -3.25 114.58 112.19 3b78 h GLU 195 Ca -0.45 -0.69 -0.03 0.00 -1.00 0.00 0.00 59.36 57.19 3b78 h GLU 195 Cb 1.30 0.18 -0.03 0.00 0.50 0.00 0.00 28.75 30.70 3b78 h GLU 195 CO 0.43 1.28 0.27 0.28 -1.00 0.00 0.00 179.01 180.27 3b78 h VAL 196 N 0.41 1.23 0.00 3.13 2.07 -2.05 -1.96 116.25 119.08 3b78 h VAL 196 Ca -0.10 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.72 3b78 h VAL 196 Cb 1.61 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 3b78 h VAL 196 CO 0.19 0.28 0.00 -0.07 0.02 0.00 0.00 177.57 177.98 3b78 h LEU 197 N 0.87 0.00 0.00 2.57 3.38 -1.95 -3.48 115.31 116.70 3b78 h LEU 197 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3b78 h LEU 197 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3b78 h LEU 197 CO -0.02 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.12 3b78 n GLY 198 N -0.57 -1.07 3.56 0.83 0.00 -0.74 -4.61 105.19 102.59 3b78 n GLY 198 Ca -0.01 -1.08 -0.47 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.11 2.87 0.00 1.61 2.03 -1.26 -4.78 116.55 114.91 3b78 n ASP 199 Ca 0.00 0.46 0.00 0.00 0.52 0.00 0.00 54.79 55.77 3b78 n ASP 199 Cb 0.00 -1.40 0.00 0.00 -0.72 0.00 0.00 41.12 39.00 3b78 n ASP 199 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 3b78 n VAL 200 N 6.95 0.46 -1.59 5.18 3.14 -1.26 -5.06 118.33 126.14 3b78 n VAL 200 Ca 0.33 -0.71 -0.40 0.00 -2.96 0.00 0.00 64.34 60.59 3b78 n VAL 200 Cb 0.33 0.79 0.02 0.00 -1.06 0.00 0.00 33.84 33.92 3b78 n VAL 200 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3b78 n GLN 201 N -0.23 1.17 -3.00 1.45 6.02 -1.26 -4.81 117.38 116.72 3b78 n GLN 201 Ca 0.00 0.43 -0.40 0.00 -0.01 0.00 0.00 57.00 57.01 3b78 n GLN 201 Cb 0.13 -2.02 -0.05 0.00 1.02 0.00 0.00 30.24 29.32 3b78 n GLN 201 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3b78 s VAL 202 N -1.37 5.00 -0.17 5.09 -7.23 -1.26 -5.05 120.40 115.40 3b78 s VAL 202 Ca 0.66 1.49 0.01 0.00 -1.81 0.00 0.00 61.98 62.34 3b78 s VAL 202 Cb -0.52 -4.07 0.02 0.00 0.56 0.00 0.00 36.38 32.37 3b78 s VAL 202 CO 0.55 0.18 -0.20 -0.31 -0.31 0.00 0.00 175.10 175.01 3b78 s TYR 203 N 1.24 2.76 0.30 2.82 2.02 -1.26 -4.93 117.35 120.30 3b78 s TYR 203 Ca 0.38 -1.51 -0.01 0.00 -0.37 0.00 0.00 57.07 55.55 3b78 s TYR 203 Cb -0.17 -1.90 0.48 0.00 -0.40 0.00 0.00 41.96 39.97 3b78 s TYR 203 CO 0.16 -0.73 1.95 -1.35 -1.57 0.00 0.00 175.55 174.02 3b78 h PRO 204 N 7.77 1.05 0.00 -1.71 0.11 -1.89 -1.84 132.00 135.49 3b78 h PRO 204 Ca -0.42 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3b78 h PRO 204 Cb 1.16 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3b78 h PRO 204 CO 0.61 0.69 0.00 0.00 -0.21 0.00 0.00 178.00 179.10 3b78 n ALA 205 N -2.41 2.41 0.20 -0.75 0.00 -1.26 -2.55 120.51 116.16 3b78 n ALA 205 Ca 0.10 -0.13 0.03 0.00 0.00 0.00 0.00 53.44 53.44 3b78 n ALA 205 Cb 0.08 -1.35 -0.04 0.00 0.00 0.00 0.00 19.45 18.14 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 -0.93 3.87 -0.09 0.00 1.74 -0.72 -4.41 116.66 116.12 3b78 n ARG 206 Ca 0.16 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 3b78 n ARG 206 Cb 0.07 -0.86 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 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 1.39 1.17 0.75 -0.13 0.00 -1.06 -4.95 105.19 102.37 3b78 n GLY 207 Ca 0.01 -0.08 0.07 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.88 0.70 -3.70 2.61 -2.24 -1.02 -4.56 114.28 104.20 3b78 n THR 208 Ca 0.00 -0.85 -0.23 0.00 -2.27 0.00 0.00 64.05 60.70 3b78 n THR 208 Cb 0.01 0.74 -0.18 0.00 -2.10 0.00 0.00 70.33 68.80 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 -1.06 0.12 0.40 2.28 1.01 -1.25 -2.94 120.40 118.96 3b78 s VAL 209 Ca 0.26 0.12 0.08 0.00 0.00 0.00 0.00 61.98 62.44 3b78 s VAL 209 Cb 0.14 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 3b78 s VAL 209 CO 0.20 0.08 0.27 0.00 0.00 0.00 0.00 175.10 175.65 3b78 s ALA 210 N 2.07 3.81 -0.05 5.51 0.00 -0.83 -4.27 121.76 127.99 3b78 s ALA 210 Ca 0.04 -1.95 -0.09 0.00 0.00 0.00 0.00 51.96 49.96 3b78 s ALA 210 Cb -0.13 -0.76 0.02 0.00 0.00 0.00 0.00 23.12 22.25 3b78 s ALA 210 CO -0.05 -0.16 0.22 -0.06 0.00 0.00 0.00 175.76 175.71 3b78 s PHE 211 N -2.50 -0.17 -4.68 0.00 0.08 0.10 -1.48 117.98 109.33 3b78 s PHE 211 Ca 0.44 0.38 0.00 0.00 0.12 0.00 0.00 56.93 57.87 3b78 s PHE 211 Cb -0.01 0.06 0.00 0.00 -0.57 0.00 0.00 43.02 42.50 3b78 s PHE 211 CO 0.25 -0.21 0.00 0.41 -0.10 0.00 0.00 175.22 175.57 3b78 n GLY 212 N 2.28 -1.10 3.16 4.36 0.00 -0.61 0.39 105.19 113.67 3b78 n GLY 212 Ca -0.17 -1.17 -0.15 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 1.42 -0.15 1.61 0.15 0.22 -1.38 113.70 111.56 3b78 s SER 213 Ca 0.00 -0.72 -0.03 0.00 0.70 0.00 0.00 55.95 55.90 3b78 s SER 213 Cb 0.00 -0.00 -0.24 0.00 -1.71 0.00 0.00 66.02 64.07 3b78 s SER 213 CO 0.00 -0.21 0.23 0.61 1.20 0.00 0.00 173.24 175.07 3b78 n GLY 214 N 0.87 -0.54 0.20 9.45 0.00 -1.26 -1.43 105.19 112.48 3b78 n GLY 214 Ca -0.18 -0.24 -0.02 0.00 0.00 0.00 0.00 46.02 45.57 3b78 n GLY 214 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3b78 h LEU 215 N 0.05 0.05 0.00 0.99 5.85 -1.96 -1.65 115.31 118.64 3b78 h LEU 215 Ca -0.46 0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.24 3b78 h LEU 215 Cb 2.01 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 43.13 3b78 h LEU 215 CO 0.04 0.05 -0.68 0.45 -0.34 0.00 0.00 178.44 177.97 3b78 h HIS 216 N 0.27 0.00 -1.21 1.25 3.86 -1.94 -3.48 115.15 113.90 3b78 h HIS 216 Ca 0.26 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 3b78 h HIS 216 Cb 0.34 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.81 3b78 h HIS 216 CO -0.21 0.46 0.00 0.41 0.86 0.00 0.00 177.93 179.44 3b78 n GLY 217 N 1.25 0.83 2.95 2.45 0.00 -0.62 -4.68 105.19 107.37 3b78 n GLY 217 Ca -0.00 -0.61 -0.16 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.96 0.50 -0.02 1.61 1.48 -0.52 -3.40 118.94 115.63 3b78 s TRP 218 Ca 0.00 -0.10 -0.27 0.00 -1.06 0.00 0.00 56.10 54.67 3b78 s TRP 218 Cb 0.00 -0.35 0.06 0.00 -1.16 0.00 0.00 33.47 32.02 3b78 s TRP 218 CO 0.00 -0.03 0.60 0.00 -4.06 0.00 0.00 176.95 173.46 3b78 s ALA 219 N 0.05 -1.56 -0.02 2.67 0.00 -1.01 0.70 121.76 122.59 3b78 s ALA 219 Ca -0.00 1.04 -0.07 0.00 0.00 0.00 0.00 51.96 52.93 3b78 s ALA 219 Cb -0.04 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.19 3b78 s ALA 219 CO -0.00 -0.39 0.16 -0.59 0.00 0.00 0.00 175.76 174.94 3b78 s PHE 220 N -1.50 -0.04 0.16 0.00 -0.12 0.16 -4.11 117.98 112.55 3b78 s PHE 220 Ca -0.10 0.06 0.06 0.00 -0.05 0.00 0.00 56.93 56.90 3b78 s PHE 220 Cb -0.01 -0.01 -0.04 0.00 -0.63 0.00 0.00 43.02 42.33 3b78 s PHE 220 CO 0.07 -0.24 0.07 0.95 -0.05 0.00 0.00 175.22 176.01 3b78 s THR 221 N -0.98 4.13 0.52 -4.49 -4.23 -1.26 -0.72 115.64 108.61 3b78 s THR 221 Ca -0.11 -1.22 0.30 0.00 -1.18 0.00 0.00 61.69 59.49 3b78 s THR 221 Cb -0.06 -3.09 0.34 0.00 1.34 0.00 0.00 72.50 71.04 3b78 s THR 221 CO 0.01 -0.09 2.20 0.40 -0.54 0.00 0.00 174.62 176.60 3b78 h ILE 222 N 2.27 0.48 0.00 2.99 2.04 -1.75 -0.66 117.51 122.88 3b78 h ILE 222 Ca -0.47 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.18 3b78 h ILE 222 Cb 1.20 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 3b78 h ILE 222 CO 0.61 0.04 0.00 -0.09 0.00 0.00 0.00 178.15 178.71 3b78 h ARG 223 N 0.00 0.00 0.08 2.37 2.43 -1.92 -2.94 114.38 114.40 3b78 h ARG 223 Ca -0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3b78 h ARG 223 Cb 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3b78 h ARG 223 CO 0.01 0.00 -0.04 1.96 -1.51 0.00 0.00 179.97 180.39 3b78 h GLN 224 N 0.00 -0.10 0.00 0.20 4.20 -1.52 -3.05 115.11 114.84 3b78 h GLN 224 Ca 0.00 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3b78 h GLN 224 Cb 0.73 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.53 3b78 h GLN 224 CO 0.00 0.45 0.00 1.19 -0.67 0.00 0.00 178.83 179.80 3b78 n PHE 225 N -4.82 0.67 0.09 2.96 3.72 -1.22 -2.08 117.46 116.77 3b78 n PHE 225 Ca -0.08 0.28 -0.04 0.00 -0.05 0.00 0.00 57.45 57.55 3b78 n PHE 225 Cb 0.30 -0.94 -0.03 0.00 -0.94 0.00 0.00 39.48 37.87 3b78 n PHE 225 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3b78 h ALA 226 N 2.25 0.54 0.00 4.37 0.00 -1.50 -2.31 119.26 122.61 3b78 h ALA 226 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.14 3b78 h ALA 226 Cb 0.29 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3b78 h ALA 226 CO 0.00 1.06 0.00 1.15 0.00 0.00 0.00 179.25 181.46 3b78 h THR 227 N 0.00 0.00 0.04 0.00 2.02 -1.31 -2.73 112.91 110.94 3b78 h THR 227 Ca -0.01 -0.51 -0.33 0.00 0.77 0.00 0.00 66.41 66.33 3b78 h THR 227 Cb 1.55 1.44 -0.04 0.00 -1.74 0.00 0.00 68.15 69.37 3b78 h THR 227 CO 0.11 0.00 -1.87 0.54 0.37 0.00 0.00 175.52 174.67 3b78 n ARG 228 N -2.49 0.64 -0.08 6.66 1.74 -1.16 -4.25 116.66 117.72 3b78 n ARG 228 Ca 0.04 0.37 0.08 0.00 -0.77 0.00 0.00 57.85 57.57 3b78 n ARG 228 Cb 0.39 -1.66 0.30 0.00 -1.02 0.00 0.00 32.46 30.46 3b78 n ARG 228 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3b78 n TYR 229 N -3.96 0.21 0.19 -1.55 4.01 -0.88 -3.44 117.16 111.74 3b78 n TYR 229 Ca -0.38 -0.11 0.10 0.00 -0.16 0.00 0.00 57.90 57.36 3b78 n TYR 229 Cb 0.87 0.00 0.12 0.00 -0.31 0.00 0.00 39.34 40.02 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 3.70 0.88 0.01 -0.72 0.00 -1.66 -3.15 119.26 118.32 3b78 h ALA 230 Ca 0.00 -0.09 -0.40 0.00 0.00 0.00 0.00 54.91 54.42 3b78 h ALA 230 Cb 0.32 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.04 3b78 h ALA 230 CO 0.00 0.12 -2.44 1.63 0.00 0.00 0.00 179.25 178.56 3b78 n LYS 231 N -3.06 0.65 0.23 0.00 5.02 -1.22 -1.65 118.16 118.12 3b78 n LYS 231 Ca 0.03 0.18 0.08 0.00 -2.02 0.00 0.00 58.31 56.58 3b78 n LYS 231 Cb 0.57 -1.53 0.56 0.00 -0.02 0.00 0.00 35.03 34.61 3b78 n LYS 231 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 3b78 h LYS 232 N -0.17 0.00 -0.01 1.97 1.57 -1.70 -2.81 116.57 115.41 3b78 h LYS 232 Ca -0.59 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 3b78 h LYS 232 Cb 1.86 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.17 3b78 h LYS 232 CO -0.13 0.19 -0.06 1.19 -0.57 0.00 0.00 179.45 180.07 3b78 n PHE 233 N -4.04 0.00 -3.44 -1.35 3.72 -1.19 -5.03 117.46 106.13 3b78 n PHE 233 Ca -0.02 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.20 3b78 n PHE 233 Cb 0.27 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.87 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 0.62 -0.65 2.81 1.37 0.00 -1.06 -5.02 105.19 103.25 3b78 n GLY 234 Ca 0.05 0.29 -0.14 0.00 0.00 0.00 0.00 46.02 46.22 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 -3.44 -0.04 0.15 1.61 1.01 -0.66 -5.02 120.40 114.01 3b78 s VAL 235 Ca 0.18 0.14 -0.34 0.00 0.00 0.00 0.00 61.98 61.96 3b78 s VAL 235 Cb -0.03 -0.06 -0.16 0.00 0.00 0.00 0.00 36.38 36.13 3b78 s VAL 235 CO 0.76 0.06 1.25 -0.90 0.00 0.00 0.00 175.10 176.26 3b78 n ASP 236 N 3.77 1.57 0.25 3.32 5.68 -1.26 -4.46 116.55 125.42 3b78 n ASP 236 Ca -0.22 1.13 0.17 0.00 -0.50 0.00 0.00 54.79 55.37 3b78 n ASP 236 Cb 0.54 -1.23 0.86 0.00 -1.14 0.00 0.00 41.12 40.15 3b78 n ASP 236 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 3b78 h LYS 237 N 3.89 0.00 -0.67 0.11 2.10 -1.89 -1.41 116.57 118.71 3b78 h LYS 237 Ca -0.45 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.21 3b78 h LYS 237 Cb 1.33 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.63 3b78 h LYS 237 CO 0.73 0.00 0.44 0.00 -2.00 0.00 0.00 179.45 178.63 3b78 h ALA 238 N 2.03 0.85 0.00 0.07 0.00 -1.94 -1.07 119.26 119.21 3b78 h ALA 238 Ca 0.00 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.69 3b78 h ALA 238 Cb 0.12 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3b78 h ALA 238 CO 0.00 0.26 -1.24 -0.22 0.00 0.00 0.00 179.25 178.05 3b78 h LYS 239 N 0.89 0.00 0.00 0.00 3.64 -1.65 -3.33 116.57 116.12 3b78 h LYS 239 Ca 0.25 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.58 3b78 h LYS 239 Cb -0.09 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 3b78 h LYS 239 CO -0.06 0.41 -0.23 1.98 -2.27 0.00 0.00 179.45 179.28 3b78 h MET 240 N 0.00 0.00 -0.06 1.90 4.05 -0.99 -2.31 114.93 117.52 3b78 h MET 240 Ca -0.13 0.00 -0.17 0.00 -0.28 0.00 0.00 59.70 59.11 3b78 h MET 240 Cb 1.61 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.41 3b78 h MET 240 CO 0.06 0.23 -0.72 0.52 0.23 0.00 0.00 176.91 177.23 3b78 h MET 241 N 0.00 0.32 -0.32 0.39 2.86 -1.31 -3.24 114.93 113.64 3b78 h MET 241 Ca -0.00 -0.26 -0.07 0.00 -2.06 0.00 0.00 59.70 57.30 3b78 h MET 241 Cb 0.52 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 3b78 h MET 241 CO 0.03 0.91 -0.07 0.22 1.06 0.00 0.00 176.91 179.06 3b78 h ASP 242 N 0.22 0.61 -0.20 1.22 1.82 -1.56 -3.28 116.42 115.26 3b78 h ASP 242 Ca -0.03 -0.36 -0.02 0.00 -0.39 0.00 0.00 57.03 56.24 3b78 h ASP 242 Cb 1.28 -0.17 -0.01 0.00 0.68 0.00 0.00 39.33 41.11 3b78 h ASP 242 CO 0.12 0.83 0.05 0.03 -1.61 0.00 0.00 179.24 178.65 3b78 h ARG 243 N 0.39 0.33 -0.68 0.28 3.08 -1.61 -3.27 114.38 112.89 3b78 h ARG 243 Ca 0.08 -0.08 0.08 0.00 0.07 0.00 0.00 59.98 60.13 3b78 h ARG 243 Cb 0.56 -0.04 -0.11 0.00 0.08 0.00 0.00 29.97 30.46 3b78 h ARG 243 CO 0.03 0.46 -0.52 -0.07 -1.07 0.00 0.00 179.97 178.79 3b78 h LEU 244 N 0.14 -1.83-10.06 3.04 3.38 -1.61 -3.38 115.31 104.99 3b78 h LEU 244 Ca 0.06 0.28 -0.52 0.00 0.09 0.00 0.00 57.88 57.79 3b78 h LEU 244 Cb 0.28 0.80 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 3b78 h LEU 244 CO 0.00 -0.32 -0.07 0.86 0.09 0.00 0.00 178.44 179.00 3b78 s TRP 245 N -5.68 3.45 0.00 1.13 -0.11 -1.24 -1.83 118.94 114.67 3b78 s TRP 245 Ca -0.14 0.85 0.00 0.00 1.22 0.00 0.00 56.10 58.03 3b78 s TRP 245 Cb 0.11 -2.26 0.00 0.00 -1.50 0.00 0.00 33.47 29.83 3b78 s TRP 245 CO 0.64 0.15 0.00 0.41 -4.62 0.00 0.00 176.95 173.53 3b78 n GLY 246 N -0.66 -1.97 3.58 5.86 0.00 -1.26 -4.59 105.19 106.14 3b78 n GLY 246 Ca 0.00 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 44.04 3b78 n GLY 246 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3b78 s ASP 247 N -4.00 6.59 -0.07 1.61 1.01 -1.26 -4.78 116.67 115.78 3b78 s ASP 247 Ca 0.00 -2.30 -0.03 0.00 0.71 0.00 0.00 52.55 50.93 3b78 s ASP 247 Cb 0.00 -2.58 0.04 0.00 1.01 0.00 0.00 42.92 41.39 3b78 s ASP 247 CO 0.00 -1.43 0.12 -0.44 0.21 0.00 0.00 175.17 173.63 3b78 s SER 248 N 4.56 0.84 0.25 0.27 0.01 -1.26 -4.65 113.70 113.72 3b78 s SER 248 Ca 0.55 0.24 0.12 0.00 1.31 0.00 0.00 55.95 58.17 3b78 s SER 248 Cb 0.03 0.12 -0.05 0.00 0.21 0.00 0.00 66.02 66.34 3b78 s SER 248 CO 0.08 -0.24 -0.21 -0.36 0.41 0.00 0.00 173.24 172.92 3b78 s PHE 249 N 2.19 2.27 -0.35 2.43 0.08 -0.44 -0.69 117.98 123.47 3b78 s PHE 249 Ca 0.03 -0.35 0.01 0.00 0.12 0.00 0.00 56.93 56.74 3b78 s PHE 249 Cb -0.12 -1.03 0.11 0.00 -0.57 0.00 0.00 43.02 41.41 3b78 s PHE 249 CO -0.05 0.64 0.13 0.12 -0.10 0.00 0.00 175.22 175.97 3b78 s PHE 250 N -2.27 2.05 -0.22 0.36 5.36 -1.25 -1.68 117.98 120.33 3b78 s PHE 250 Ca 0.27 -2.10 -0.29 0.00 -0.96 0.00 0.00 56.93 53.85 3b78 s PHE 250 Cb -0.06 -1.92 -0.03 0.00 -0.34 0.00 0.00 43.02 40.67 3b78 s PHE 250 CO 0.13 -0.86 1.69 1.21 -1.46 0.00 0.00 175.22 175.93 3b78 s ASN 251 N 1.16 6.27 0.61 6.13 3.84 -1.21 -4.87 114.94 126.88 3b78 s ASN 251 Ca 0.12 1.66 0.34 0.00 0.21 0.00 0.00 52.86 55.20 3b78 s ASN 251 Cb -0.20 -2.53 2.00 0.00 -0.55 0.00 0.00 41.25 39.97 3b78 s ASN 251 CO -0.16 -1.34 2.28 -0.65 -2.79 0.00 0.00 177.10 174.45 3b78 h PRO 252 N 11.21 0.00 0.00 0.43 0.11 -1.98 0.20 132.00 141.98 3b78 h PRO 252 Ca -0.35 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 3b78 h PRO 252 Cb 1.16 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3b78 h PRO 252 CO 1.00 0.01 -0.08 0.87 -0.21 0.00 0.00 178.00 179.59 3b78 h LYS 253 N 0.00 0.00 0.00 1.05 1.57 -1.98 -3.36 116.57 113.86 3b78 h LYS 253 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3b78 h LYS 253 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3b78 h LYS 253 CO 0.00 0.36 -0.02 1.79 -0.57 0.00 0.00 179.45 181.01 3b78 h THR 254 N -1.00 0.04 -3.52 -0.16 1.35 -1.95 -3.47 112.91 104.20 3b78 h THR 254 Ca -0.01 -0.83 -0.40 0.00 -0.55 0.00 0.00 66.41 64.61 3b78 h THR 254 Cb 0.40 1.80 0.01 0.00 -1.73 0.00 0.00 68.15 68.64 3b78 h THR 254 CO -0.01 0.02 -0.55 0.29 -0.25 0.00 0.00 175.52 175.02 3b78 n LYS 255 N -3.11 -2.98 -3.99 4.72 4.76 0.70 -5.00 118.16 113.27 3b78 n LYS 255 Ca 0.02 0.95 -0.09 0.00 -2.87 0.00 0.00 58.31 56.32 3b78 n LYS 255 Cb 0.44 -5.65 -0.11 0.00 -1.84 0.00 0.00 35.03 27.87 3b78 n LYS 255 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3b78 s LYS 256 N -5.29 0.34 0.34 1.97 1.02 -1.25 -5.00 119.74 111.87 3b78 s LYS 256 Ca 0.13 -0.64 -0.26 0.00 0.02 0.00 0.00 55.97 55.22 3b78 s LYS 256 Cb -0.06 0.06 -0.10 0.00 -0.52 0.00 0.00 37.83 37.22 3b78 s LYS 256 CO 0.16 -0.04 0.97 -1.58 -0.92 0.00 0.00 175.35 173.94 3b78 s TRP 257 N -1.50 3.59 0.04 3.18 0.52 -1.26 -3.31 118.94 120.21 3b78 s TRP 257 Ca -0.15 1.75 -0.05 0.00 0.02 0.00 0.00 56.10 57.67 3b78 s TRP 257 Cb -0.10 -2.97 -0.01 0.00 -1.15 0.00 0.00 33.47 29.24 3b78 s TRP 257 CO -0.01 0.02 0.09 0.99 0.02 0.00 0.00 176.95 178.06 3b78 s THR 258 N -1.64 0.14 -1.72 2.01 2.01 -0.68 -5.00 115.64 110.76 3b78 s THR 258 Ca 0.52 -1.17 0.20 0.00 0.31 0.00 0.00 61.69 61.55 3b78 s THR 258 Cb -0.19 -1.00 0.65 0.00 0.01 0.00 0.00 72.50 71.97 3b78 s THR 258 CO 0.24 -0.65 1.55 0.59 -0.69 0.00 0.00 174.62 175.66 3b78 n ASN 259 N 0.63 4.07 -4.60 3.53 3.02 -1.26 -1.33 115.26 119.32 3b78 n ASN 259 Ca -0.18 -2.14 -0.34 0.00 -0.03 0.00 0.00 54.58 51.88 3b78 n ASN 259 Cb 0.59 -0.51 -0.11 0.00 -0.61 0.00 0.00 39.78 39.15 3b78 n ASN 259 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3b78 s LYS 260 N -1.32 3.42 -0.07 3.52 1.02 -1.26 -4.87 119.74 120.17 3b78 s LYS 260 Ca 0.48 -0.45 0.01 0.00 0.02 0.00 0.00 55.97 56.03 3b78 s LYS 260 Cb 0.27 -2.90 0.13 0.00 -0.52 0.00 0.00 37.83 34.81 3b78 s LYS 260 CO 0.29 0.45 1.06 -0.40 -0.92 0.00 0.00 175.35 175.83 3b78 n ASP 261 N 2.93 2.83 -3.68 2.83 5.68 -1.26 -4.75 116.55 121.13 3b78 n ASP 261 Ca -0.18 -2.26 -0.09 0.00 -0.50 0.00 0.00 54.79 51.76 3b78 n ASP 261 Cb 0.53 -0.55 -0.10 0.00 -1.14 0.00 0.00 41.12 39.86 3b78 n ASP 261 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3b78 s THR 262 N -0.76 -0.20 0.90 2.12 2.01 -1.26 -3.24 115.64 115.21 3b78 s THR 262 Ca 0.10 0.10 -0.12 0.00 0.31 0.00 0.00 61.69 62.08 3b78 s THR 262 Cb 0.08 -0.68 0.13 0.00 0.01 0.00 0.00 72.50 72.04 3b78 s THR 262 CO 0.02 0.04 1.09 -0.62 -0.69 0.00 0.00 174.62 174.47 3b78 s ASP 263 N 1.76 3.49 0.30 3.53 -1.08 0.14 -4.84 116.67 119.97 3b78 s ASP 263 Ca -0.08 1.41 0.05 0.00 -0.52 0.00 0.00 52.55 53.41 3b78 s ASP 263 Cb -0.09 -2.09 0.76 0.00 -1.46 0.00 0.00 42.92 40.04 3b78 s ASP 263 CO -0.14 -2.62 1.72 0.00 0.52 0.00 0.00 175.17 174.65 3b78 h ALA 264 N -1.54 1.54 -0.00 3.66 0.00 -2.00 0.27 119.26 121.18 3b78 h ALA 264 Ca -0.50 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3b78 h ALA 264 Cb 1.29 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.16 3b78 h ALA 264 CO 0.56 -0.28 -0.01 0.39 0.00 0.00 0.00 179.25 179.91 3b78 n GLU 265 N -4.97 1.08 -0.66 0.00 1.02 -1.26 -4.87 120.64 110.99 3b78 n GLU 265 Ca 0.23 -0.20 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 3b78 n GLU 265 Cb 0.66 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.58 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 1.06 1.13 3.74 0.62 0.00 0.94 -5.07 105.19 107.61 3b78 n GLY 266 Ca 0.22 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.69 4.24 0.09 1.61 1.02 -1.24 -4.76 119.74 119.01 3b78 s LYS 267 Ca 0.00 0.32 -0.31 0.00 0.02 0.00 0.00 55.97 56.00 3b78 s LYS 267 Cb 0.00 -3.40 -0.10 0.00 -0.52 0.00 0.00 37.83 33.82 3b78 s LYS 267 CO 0.00 0.27 1.80 -2.14 -0.92 0.00 0.00 175.35 174.36 3b78 s PRO 268 N 0.31 4.15 0.05 -1.68 0.02 -1.26 0.28 135.00 136.86 3b78 s PRO 268 Ca 0.22 2.53 -0.01 0.00 0.02 0.00 0.00 61.00 63.76 3b78 s PRO 268 Cb -0.15 -3.68 -0.04 0.00 0.02 0.00 0.00 34.50 30.65 3b78 s PRO 268 CO 0.09 -0.83 0.22 -0.51 -0.33 0.00 0.00 177.00 175.63 3b78 s LEU 269 N 2.98 4.36 0.15 -5.54 1.43 -1.20 -4.89 118.68 115.96 3b78 s LEU 269 Ca 0.80 0.33 -0.18 0.00 -1.03 0.00 0.00 54.13 54.05 3b78 s LEU 269 Cb -0.44 -2.88 -0.07 0.00 0.03 0.00 0.00 46.19 42.83 3b78 s LEU 269 CO 0.36 0.19 0.62 -0.70 0.23 0.00 0.00 176.35 177.05 3b78 s GLU 270 N -2.34 4.15 0.68 1.70 2.12 -1.26 -4.85 118.70 118.90 3b78 s GLU 270 Ca 0.33 0.71 -0.16 0.00 0.36 0.00 0.00 54.97 56.21 3b78 s GLU 270 Cb -0.13 -3.02 0.01 0.00 0.26 0.00 0.00 34.13 31.25 3b78 s GLU 270 CO 0.25 0.51 1.17 0.50 -0.54 0.00 0.00 175.26 177.14 3b78 s ARG 271 N -1.68 2.54 0.42 4.30 3.52 -1.26 -3.93 118.95 122.86 3b78 s ARG 271 Ca 0.37 1.63 0.08 0.00 -0.13 0.00 0.00 55.73 57.67 3b78 s ARG 271 Cb -0.17 -1.90 0.89 0.00 -1.56 0.00 0.00 34.95 32.21 3b78 s ARG 271 CO 0.20 -1.49 2.06 0.00 -0.81 0.00 0.00 175.30 175.26 3b78 h ALA 272 N 0.05 1.72 -0.04 6.12 0.00 -1.11 -0.42 119.26 125.58 3b78 h ALA 272 Ca -0.48 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.15 3b78 h ALA 272 Cb 1.28 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 18.93 3b78 h ALA 272 CO 0.52 0.26 -0.97 0.35 0.00 0.00 0.00 179.25 179.41 3b78 h PHE 273 N 0.50 1.01 0.00 0.00 3.57 -1.62 -1.49 116.94 118.92 3b78 h PHE 273 Ca 0.14 -0.52 0.00 0.00 3.53 0.00 0.00 57.97 61.11 3b78 h PHE 273 Cb -0.04 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 38.57 3b78 h PHE 273 CO 0.00 1.36 0.00 -0.91 -2.23 0.00 0.00 178.31 176.53 3b78 h ASN 274 N 0.42 0.00 0.00 0.41 4.21 -1.73 -0.05 115.58 118.84 3b78 h ASN 274 Ca -0.11 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.35 3b78 h ASN 274 Cb 1.61 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.80 3b78 h ASN 274 CO 0.19 0.00 -1.75 0.80 -1.29 0.00 0.00 177.43 175.38 3b78 n MET 275 N -3.01 0.71 -0.02 0.81 1.56 -0.22 -2.60 117.12 114.34 3b78 n MET 275 Ca 0.03 -0.11 -0.00 0.00 -0.27 0.00 0.00 57.70 57.34 3b78 n MET 275 Cb 0.42 -1.36 -0.06 0.00 2.15 0.00 0.00 33.22 34.37 3b78 n MET 275 CO 0.00 0.00 0.00 1.19 -0.73 0.00 0.00 175.97 176.43 3b78 n PHE 276 N -2.12 0.00 -0.04 1.12 3.72 -0.56 -4.55 117.46 115.02 3b78 n PHE 276 Ca -0.07 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.24 3b78 n PHE 276 Cb 0.51 -0.31 -0.03 0.00 -0.94 0.00 0.00 39.48 38.71 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 -2.08 1.10 0.04 4.37 2.08 -0.48 -4.57 119.36 119.81 3b78 n ILE 277 Ca -0.08 0.06 -0.11 0.00 0.56 0.00 0.00 62.75 63.17 3b78 n ILE 277 Cb 0.53 -1.85 0.01 0.00 -0.75 0.00 0.00 39.64 37.58 3b78 n ILE 277 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 3b78 h LEU 278 N -0.51 0.56 0.16 1.39 3.38 -1.24 -3.30 115.31 115.75 3b78 h LEU 278 Ca -0.17 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.44 3b78 h LEU 278 Cb 0.88 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 3b78 h LEU 278 CO -0.10 1.13 -0.16 -0.78 0.09 0.00 0.00 178.44 178.61 3b78 h ASP 279 N 0.32 -0.43 -0.21 -0.43 3.58 -1.72 -0.31 116.42 117.21 3b78 h ASP 279 Ca -0.04 0.04 0.02 0.00 0.42 0.00 0.00 57.03 57.47 3b78 h ASP 279 Cb 1.34 0.15 -0.02 0.00 1.72 0.00 0.00 39.33 42.52 3b78 h ASP 279 CO 0.13 -0.25 0.09 -0.65 -2.88 0.00 0.00 179.24 175.69 3b78 h PRO 280 N -0.35 0.20 -0.30 0.28 0.11 -1.81 -2.14 132.00 127.99 3b78 h PRO 280 Ca 0.00 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.04 3b78 h PRO 280 Cb 0.34 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.39 3b78 h PRO 280 CO -0.05 0.13 -0.09 0.82 -0.21 0.00 0.00 178.00 178.61 3b78 h ILE 281 N 0.21 1.22 -0.34 4.15 2.04 -1.62 -2.88 117.51 120.29 3b78 h ILE 281 Ca 0.09 -0.94 -0.01 0.00 1.00 0.00 0.00 64.86 64.99 3b78 h ILE 281 Cb 0.03 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 3b78 h ILE 281 CO -0.07 0.31 0.15 -0.26 0.00 0.00 0.00 178.15 178.28 3b78 h PHE 282 N 0.46 0.49 -0.04 1.37 -1.00 -0.67 -2.70 116.94 114.86 3b78 h PHE 282 Ca 0.09 -0.03 -0.07 0.00 2.81 0.00 0.00 57.97 60.77 3b78 h PHE 282 Cb 0.44 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.84 3b78 h PHE 282 CO 0.01 0.44 -0.29 0.00 -1.61 0.00 0.00 178.31 176.86 3b78 h ARG 283 N 0.40 0.07 -0.08 1.51 2.47 -1.22 0.46 114.38 117.99 3b78 h ARG 283 Ca 0.11 -0.02 -0.10 0.00 -1.26 0.00 0.00 59.98 58.71 3b78 h ARG 283 Cb 0.14 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.44 3b78 h ARG 283 CO -0.01 0.37 -0.39 -0.07 0.56 0.00 0.00 179.97 180.43 3b78 h LEU 284 N 0.07 0.17 -0.18 3.04 3.38 -1.37 0.13 115.31 120.55 3b78 h LEU 284 Ca 0.01 -0.07 -0.16 0.00 0.09 0.00 0.00 57.88 57.75 3b78 h LEU 284 Cb 0.56 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3b78 h LEU 284 CO 0.04 0.55 -0.77 -0.26 0.09 0.00 0.00 178.44 178.09 3b78 h PHE 285 N 0.14 0.00 0.00 1.13 0.05 -0.96 -2.61 116.94 114.69 3b78 h PHE 285 Ca 0.01 0.00 -0.20 0.00 3.82 0.00 0.00 57.97 61.60 3b78 h PHE 285 Cb 0.75 0.00 -0.03 0.00 2.00 0.00 0.00 35.95 38.67 3b78 h PHE 285 CO 0.01 0.77 -1.05 1.15 -0.18 0.00 0.00 178.31 179.01 3b78 h THR 286 N 0.00 1.31 0.00 -1.55 2.02 -0.50 -2.99 112.91 111.21 3b78 h THR 286 Ca -0.01 -2.96 -0.28 0.00 0.77 0.00 0.00 66.41 63.94 3b78 h THR 286 Cb 1.51 2.63 -0.05 0.00 -1.74 0.00 0.00 68.15 70.50 3b78 h THR 286 CO 0.10 0.75 -1.70 0.00 0.37 0.00 0.00 175.52 175.04 3b78 n ALA 287 N -2.36 1.56 -0.01 6.16 0.00 0.43 -3.83 120.51 122.46 3b78 n ALA 287 Ca -0.03 -0.76 -0.21 0.00 0.00 0.00 0.00 53.44 52.44 3b78 n ALA 287 Cb 0.91 -0.84 -0.14 0.00 0.00 0.00 0.00 19.45 19.39 3b78 n ALA 287 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3b78 h ILE 288 N 0.00 1.16 -0.25 0.00 2.04 -1.60 -1.70 117.51 117.16 3b78 h ILE 288 Ca -0.28 -2.39 -0.00 0.00 1.00 0.00 0.00 64.86 63.19 3b78 h ILE 288 Cb 1.96 2.79 -0.01 0.00 -0.74 0.00 0.00 36.82 40.82 3b78 h ILE 288 CO 0.07 0.65 0.14 0.24 0.00 0.00 0.00 178.15 179.26 3b78 h MET 289 N -0.45 0.34 0.00 2.37 2.86 -1.73 -2.35 114.93 115.96 3b78 h MET 289 Ca -0.26 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 3b78 h MET 289 Cb 1.62 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 33.21 3b78 h MET 289 CO 0.04 0.29 0.00 0.09 1.06 0.00 0.00 176.91 178.39 3b78 n ASN 290 N -4.87 0.00 -2.76 1.22 4.13 -1.25 -4.66 115.26 107.08 3b78 n ASN 290 Ca -0.03 -1.47 -0.20 0.00 1.68 0.00 0.00 54.58 54.56 3b78 n ASN 290 Cb 0.07 0.00 0.01 0.00 -1.54 0.00 0.00 39.78 38.31 3b78 n ASN 290 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 3b78 n PHE 291 N -0.61 -1.53 -2.23 3.10 3.72 -0.88 -4.86 117.46 114.16 3b78 n PHE 291 Ca 0.04 0.25 -0.32 0.00 -0.05 0.00 0.00 57.45 57.37 3b78 n PHE 291 Cb 0.02 -3.81 -0.04 0.00 -0.94 0.00 0.00 39.48 34.71 3b78 n PHE 291 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3b78 s LYS 292 N -5.41 2.95 0.06 -1.08 1.02 -0.64 -4.78 119.74 111.86 3b78 s LYS 292 Ca 0.16 -0.91 0.14 0.00 0.02 0.00 0.00 55.97 55.38 3b78 s LYS 292 Cb -0.08 -5.23 0.59 0.00 -0.52 0.00 0.00 37.83 32.59 3b78 s LYS 292 CO 0.20 -3.14 1.43 1.63 -0.92 0.00 0.00 175.35 174.55 3b78 n LYS 293 N 8.66 0.04 0.11 1.68 5.02 -1.26 -1.80 118.16 130.60 3b78 n LYS 293 Ca 0.41 0.34 0.09 0.00 -2.02 0.00 0.00 58.31 57.13 3b78 n LYS 293 Cb 0.48 -1.58 0.01 0.00 -0.02 0.00 0.00 35.03 33.92 3b78 n LYS 293 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3b78 h ASP 294 N 0.00 0.00 0.00 4.39 3.32 -1.94 -3.39 116.42 118.79 3b78 h ASP 294 Ca 0.00 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.67 3b78 h ASP 294 Cb 0.21 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.69 3b78 h ASP 294 CO 0.00 0.14 -2.43 -0.62 -1.72 0.00 0.00 179.24 174.62 3b78 n GLU 295 N -2.83 0.62 -0.20 3.56 1.02 -0.75 -4.53 120.64 117.54 3b78 n GLU 295 Ca -0.01 0.15 -0.08 0.00 -0.02 0.00 0.00 57.16 57.21 3b78 n GLU 295 Cb 0.61 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.52 3b78 n GLU 295 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3b78 h ILE 296 N -0.07 0.11 0.51 -3.67 2.04 -1.60 0.34 117.51 115.17 3b78 h ILE 296 Ca -0.57 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.28 3b78 h ILE 296 Cb 1.84 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 3b78 h ILE 296 CO -0.11 0.00 -0.35 1.55 0.00 0.00 0.00 178.15 179.24 3b78 h PRO 297 N -0.22 -0.80 -0.32 2.37 0.13 -1.83 -1.26 132.00 130.08 3b78 h PRO 297 Ca 0.19 0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.36 3b78 h PRO 297 Cb 0.56 0.18 -0.02 0.00 0.13 0.00 0.00 31.00 31.86 3b78 h PRO 297 CO -0.67 -0.53 0.14 0.28 -0.23 0.00 0.00 178.00 176.98 3b78 h VAL 298 N -0.83 1.12 -0.21 1.56 2.07 -1.70 -2.45 116.25 115.81 3b78 h VAL 298 Ca -0.06 -0.37 -0.16 0.00 0.82 0.00 0.00 66.70 66.94 3b78 h VAL 298 Cb 0.69 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3b78 h VAL 298 CO 0.03 0.14 -0.51 0.25 0.02 0.00 0.00 177.57 177.51 3b78 h LEU 299 N 0.44 0.65 -0.57 2.57 5.85 -0.07 -3.07 115.31 121.10 3b78 h LEU 299 Ca 0.11 -0.33 -0.16 0.00 0.84 0.00 0.00 57.88 58.35 3b78 h LEU 299 Cb 0.08 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 3b78 h LEU 299 CO -0.01 1.04 -0.65 -0.07 -0.34 0.00 0.00 178.44 178.41 3b78 h LEU 300 N 0.46 0.30 -0.27 2.25 4.07 -0.79 -3.24 115.31 118.10 3b78 h LEU 300 Ca 0.02 -0.18 -0.05 0.00 0.08 0.00 0.00 57.88 57.74 3b78 h LEU 300 Cb 1.05 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.69 3b78 h LEU 300 CO 0.10 0.87 -0.03 -0.08 -1.08 0.00 0.00 178.44 178.21 3b78 h GLU 301 N 0.19 0.49 0.00 1.13 4.81 -1.40 0.28 114.58 120.08 3b78 h GLU 301 Ca -0.01 -0.17 -0.03 0.00 -0.13 0.00 0.00 59.36 59.01 3b78 h GLU 301 Cb 1.18 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.52 3b78 h GLU 301 CO 0.10 0.68 -0.15 -0.22 -0.73 0.00 0.00 179.01 178.70 3b78 h LYS 302 N 0.26 0.00 -0.64 1.92 3.64 -1.61 -1.67 116.57 118.47 3b78 h LYS 302 Ca 0.07 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3b78 h LYS 302 Cb 0.48 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 3b78 h LYS 302 CO 0.02 0.15 0.00 1.28 -2.27 0.00 0.00 179.45 178.63 3b78 n LEU 303 N -4.03 3.44 -3.36 5.20 4.77 -1.14 -4.96 117.00 116.93 3b78 n LEU 303 Ca -0.02 -1.72 -0.16 0.00 -0.03 0.00 0.00 56.01 54.08 3b78 n LEU 303 Cb 0.23 -0.43 0.08 0.00 -2.33 0.00 0.00 43.42 40.97 3b78 n LEU 303 CO 0.33 0.86 0.07 1.21 -1.33 0.00 0.00 177.39 178.53 3b78 n GLU 304 N 1.38 -4.53 -3.96 3.23 2.13 -0.63 -5.00 120.64 113.27 3b78 n GLU 304 Ca 0.21 0.85 -0.31 0.00 0.66 0.00 0.00 57.16 58.57 3b78 n GLU 304 Cb 0.54 -5.81 -0.15 0.00 0.27 0.00 0.00 31.44 26.29 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 -3.38 1.96 -0.24 6.31 1.01 0.96 -4.94 121.20 122.88 3b78 s ILE 305 Ca 0.21 -2.12 -0.12 0.00 0.00 0.00 0.00 60.65 58.63 3b78 s ILE 305 Cb -0.03 -2.45 -0.05 0.00 0.01 0.00 0.00 42.46 39.95 3b78 s ILE 305 CO 0.74 -0.60 0.24 0.68 0.00 0.00 0.00 174.94 176.00 3b78 s VAL 306 N 1.07 5.30 0.40 2.92 -7.23 -1.26 -4.43 120.40 117.16 3b78 s VAL 306 Ca 0.10 0.35 -0.15 0.00 -1.81 0.00 0.00 61.98 60.47 3b78 s VAL 306 Cb -0.19 -3.58 -0.08 0.00 0.56 0.00 0.00 36.38 33.09 3b78 s VAL 306 CO -0.12 0.30 0.83 -0.76 -0.31 0.00 0.00 175.10 175.03 3b78 s LEU 307 N 1.28 3.90 -0.71 1.32 1.43 -1.26 -4.98 118.68 119.67 3b78 s LEU 307 Ca 0.11 1.36 -0.04 0.00 -1.03 0.00 0.00 54.13 54.53 3b78 s LEU 307 Cb -0.14 -4.22 0.13 0.00 0.03 0.00 0.00 46.19 41.99 3b78 s LEU 307 CO 0.06 -0.35 2.55 0.29 0.23 0.00 0.00 176.35 179.13 3b78 n LYS 308 N -0.88 3.03 0.00 1.70 4.76 -1.26 -4.94 118.16 120.57 3b78 n LYS 308 Ca 0.04 -2.85 0.00 0.00 -2.87 0.00 0.00 58.31 52.64 3b78 n LYS 308 Cb 0.54 -2.27 0.00 0.00 -1.84 0.00 0.00 35.03 31.45 3b78 n LYS 308 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3b78 n GLY 309 N 0.79 1.92 0.13 0.72 0.00 -1.26 -4.12 105.19 103.38 3b78 n GLY 309 Ca 0.52 0.16 0.08 0.00 0.00 0.00 0.00 46.02 46.78 3b78 n GLY 309 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3b78 n ASP 310 N 4.59 0.42 -0.71 1.61 4.64 -1.26 -0.75 116.55 125.08 3b78 n ASP 310 Ca 0.00 0.67 0.12 0.00 -1.38 0.00 0.00 54.79 54.20 3b78 n ASP 310 Cb 0.00 -0.71 0.34 0.00 -1.04 0.00 0.00 41.12 39.71 3b78 n ASP 310 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 3b78 n GLU 311 N -2.07 1.95 0.05 -0.67 1.02 -1.26 -3.93 120.64 115.72 3b78 n GLU 311 Ca -0.01 -1.41 0.11 0.00 -0.02 0.00 0.00 57.16 55.83 3b78 n GLU 311 Cb 0.08 -1.44 -0.06 0.00 -0.02 0.00 0.00 31.44 30.00 3b78 n GLU 311 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3b78 n LYS 312 N 0.66 0.55 0.00 3.49 0.00 0.07 -3.91 118.16 119.01 3b78 n LYS 312 Ca 0.17 -0.02 0.11 0.00 0.00 0.00 0.00 58.31 58.57 3b78 n LYS 312 Cb 0.42 -1.66 0.12 0.00 0.00 0.00 0.00 35.03 33.90 3b78 n LYS 312 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 3b78 n ASP 313 N -2.36 0.74 -4.77 3.14 5.68 -1.25 -4.94 116.55 112.78 3b78 n ASP 313 Ca -0.01 -0.57 -0.40 0.00 -0.50 0.00 0.00 54.79 53.31 3b78 n ASP 313 Cb 0.53 0.52 -0.01 0.00 -1.14 0.00 0.00 41.12 41.02 3b78 n ASP 313 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 3b78 s LEU 314 N -2.97 4.29 0.11 -2.12 1.43 -1.25 -5.04 118.68 113.12 3b78 s LEU 314 Ca 0.11 2.67 0.01 0.00 -1.03 0.00 0.00 54.13 55.89 3b78 s LEU 314 Cb 0.17 -3.81 -0.04 0.00 0.03 0.00 0.00 46.19 42.54 3b78 s LEU 314 CO 0.75 -0.74 -0.03 -1.61 0.23 0.00 0.00 176.35 174.95 3b78 s GLU 315 N -2.09 0.85 3.33 1.70 2.02 -1.26 -4.51 118.70 118.74 3b78 s GLU 315 Ca 0.54 -1.36 0.00 0.00 0.02 0.00 0.00 54.97 54.17 3b78 s GLU 315 Cb -0.39 -0.08 0.00 0.00 0.10 0.00 0.00 34.13 33.77 3b78 s GLU 315 CO 0.51 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 176.11 3b78 n GLY 316 N -0.05 0.17 0.09 -1.39 0.00 -1.25 -3.03 105.19 99.72 3b78 n GLY 316 Ca -0.11 -0.91 0.07 0.00 0.00 0.00 0.00 46.02 45.08 3b78 n GLY 316 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3b78 n LYS 317 N 0.00 0.09 0.12 1.61 5.02 -1.26 -1.60 118.16 122.14 3b78 n LYS 317 Ca 0.00 0.51 -0.02 0.00 -2.02 0.00 0.00 58.31 56.78 3b78 n LYS 317 Cb 0.00 -1.75 0.09 0.00 -0.02 0.00 0.00 35.03 33.35 3b78 n LYS 317 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3b78 h ALA 318 N 2.10 0.76 0.12 7.82 0.00 -1.93 -3.01 119.26 125.12 3b78 h ALA 318 Ca 0.00 -0.64 -0.36 0.00 0.00 0.00 0.00 54.91 53.91 3b78 h ALA 318 Cb 0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3b78 h ALA 318 CO 0.00 0.88 -1.99 -0.11 0.00 0.00 0.00 179.25 178.03 3b78 n LEU 319 N -3.58 2.55 -0.08 0.00 7.94 -0.63 -4.15 117.00 119.05 3b78 n LEU 319 Ca -0.00 0.21 -0.04 0.00 -1.11 0.00 0.00 56.01 55.07 3b78 n LEU 319 Cb 0.72 -1.05 0.19 0.00 0.53 0.00 0.00 43.42 43.80 3b78 n LEU 319 CO 0.43 0.83 0.88 0.25 -1.11 0.00 0.00 177.39 178.68 3b78 h LEU 320 N 0.07 0.70 -1.20 -1.96 5.85 -1.61 -1.59 115.31 115.57 3b78 h LEU 320 Ca -0.42 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.13 3b78 h LEU 320 Cb 2.03 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.88 3b78 h LEU 320 CO 0.09 0.78 0.00 0.11 -0.34 0.00 0.00 178.44 179.07 3b78 h LYS 321 N 0.69 0.00 0.05 1.25 1.57 -1.71 -2.56 116.57 115.86 3b78 h LYS 321 Ca 0.14 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.56 3b78 h LYS 321 Cb 0.44 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 3b78 h LYS 321 CO 0.02 0.00 -2.05 0.28 -0.57 0.00 0.00 179.45 177.13 3b78 n VAL 322 N -2.60 1.63 0.19 0.50 0.31 -0.77 -3.89 118.33 113.70 3b78 n VAL 322 Ca 0.01 -0.48 0.04 0.00 -0.01 0.00 0.00 64.34 63.90 3b78 n VAL 322 Cb 0.23 -1.73 0.46 0.00 -0.91 0.00 0.00 33.84 31.88 3b78 n VAL 322 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3b78 h VAL 323 N -0.29 1.15 0.00 2.52 2.07 -1.26 -2.48 116.25 117.96 3b78 h VAL 323 Ca -0.49 -0.71 -0.09 0.00 0.82 0.00 0.00 66.70 66.24 3b78 h VAL 323 Cb 1.81 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.88 3b78 h VAL 323 CO -0.08 0.21 -0.41 0.24 0.02 0.00 0.00 177.57 177.55 3b78 h MET 324 N 0.07 0.00 -0.28 1.57 2.07 -1.64 -2.20 114.93 114.52 3b78 h MET 324 Ca 0.01 0.00 -0.14 0.00 -2.07 0.00 0.00 59.70 57.50 3b78 h MET 324 Cb 0.35 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.08 3b78 h MET 324 CO 0.02 0.41 -0.38 0.00 1.07 0.00 0.00 176.91 178.04 3b78 h ARG 325 N 0.00 0.75 0.04 1.72 3.08 -1.56 -1.46 114.38 116.95 3b78 h ARG 325 Ca -0.00 -0.43 -0.25 0.00 0.07 0.00 0.00 59.98 59.36 3b78 h ARG 325 Cb 1.18 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.24 3b78 h ARG 325 CO 0.05 1.06 -1.27 0.87 -1.07 0.00 0.00 179.97 179.61 3b78 h LYS 326 N 0.49 0.09 -0.12 0.04 1.57 -1.60 -2.92 116.57 114.12 3b78 h LYS 326 Ca 0.03 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.61 3b78 h LYS 326 Cb 0.97 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.33 3b78 h LYS 326 CO 0.09 0.96 -0.12 0.35 -0.57 0.00 0.00 179.45 180.17 3b78 h PHE 327 N 0.02 0.35 -2.27 -1.35 3.57 -1.44 -3.41 116.94 112.42 3b78 h PHE 327 Ca -0.12 -0.10 -0.51 0.00 3.53 0.00 0.00 57.97 60.76 3b78 h PHE 327 Cb 1.89 -0.07 -0.36 0.00 2.79 0.00 0.00 35.95 40.20 3b78 h PHE 327 CO 0.02 0.70 -0.84 -0.51 -2.23 0.00 0.00 178.31 175.45 3b78 s LEU 328 N -9.13 0.77 -0.22 0.59 1.43 -0.55 -5.08 118.68 106.48 3b78 s LEU 328 Ca -0.14 -2.37 -0.32 0.00 -1.03 0.00 0.00 54.13 50.27 3b78 s LEU 328 Cb 0.05 -0.07 -0.08 0.00 0.03 0.00 0.00 46.19 46.11 3b78 s LEU 328 CO 0.74 -0.23 2.14 -2.65 0.23 0.00 0.00 176.35 176.58 3b78 n PRO 329 N 3.56 1.76 -0.22 1.29 -0.02 -1.10 -2.40 135.00 137.87 3b78 n PRO 329 Ca 0.19 0.53 0.07 0.00 -2.02 0.00 0.00 63.50 62.27 3b78 n PRO 329 Cb 0.44 -2.87 0.33 0.00 -0.02 0.00 0.00 33.50 31.38 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 12.94 1.67 -0.63 3.55 0.00 -1.70 -2.53 119.26 132.56 3b78 h ALA 330 Ca -0.38 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 3b78 h ALA 330 Cb 1.27 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 3b78 h ALA 330 CO 0.98 0.19 0.14 0.00 0.00 0.00 0.00 179.25 180.55 3b78 h ALA 331 N 1.58 0.84 -0.48 0.00 0.00 -1.87 -2.68 119.26 116.65 3b78 h ALA 331 Ca 0.35 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 3b78 h ALA 331 Cb 0.31 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3b78 h ALA 331 CO -0.13 0.57 -0.15 -0.44 0.00 0.00 0.00 179.25 179.10 3b78 h ASP 332 N 0.94 0.96 0.36 0.00 5.19 -1.81 -0.56 116.42 121.51 3b78 h ASP 332 Ca 0.20 -0.38 -0.03 0.00 -0.62 0.00 0.00 57.03 56.20 3b78 h ASP 332 Cb 0.38 -0.26 -0.00 0.00 0.18 0.00 0.00 39.33 39.63 3b78 h ASP 332 CO 0.01 1.12 -0.14 0.00 -3.12 0.00 0.00 179.24 177.10 3b78 h ALA 333 N 0.87 1.33 0.00 3.45 0.00 -1.47 -0.09 119.26 123.35 3b78 h ALA 333 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3b78 h ALA 333 Cb 0.72 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3b78 h ALA 333 CO 0.05 0.18 -0.55 1.28 0.00 0.00 0.00 179.25 180.21 3b78 n LEU 334 N -3.74 0.54 -0.00 0.00 4.77 -0.88 -3.70 117.00 113.98 3b78 n LEU 334 Ca -0.02 0.06 0.10 0.00 -0.03 0.00 0.00 56.01 56.12 3b78 n LEU 334 Cb 0.25 -0.23 -0.14 0.00 -2.33 0.00 0.00 43.42 40.97 3b78 n LEU 334 CO 0.31 0.08 -0.40 0.18 -1.33 0.00 0.00 177.39 176.23 3b78 n LEU 335 N -1.66 0.50 0.15 2.23 4.77 -0.27 -4.36 117.00 118.36 3b78 n LEU 335 Ca 0.05 -0.25 -0.07 0.00 -0.03 0.00 0.00 56.01 55.71 3b78 n LEU 335 Cb 0.36 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 3b78 n LEU 335 CO 0.35 0.13 0.19 -0.08 -1.33 0.00 0.00 177.39 176.65 3b78 h GLU 336 N 0.00 -0.42 -0.81 3.23 4.81 -1.14 -3.25 114.58 117.00 3b78 h GLU 336 Ca 0.00 0.03 0.12 0.00 -0.13 0.00 0.00 59.36 59.37 3b78 h GLU 336 Cb 0.74 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 30.16 3b78 h GLU 336 CO 0.00 -0.28 0.53 0.52 -0.73 0.00 0.00 179.01 179.04 3b78 h MET 337 N -1.01 0.65 0.32 1.92 2.86 -1.80 -1.87 114.93 115.99 3b78 h MET 337 Ca -0.05 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 3b78 h MET 337 Cb 0.34 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 3b78 h MET 337 CO 0.07 0.43 -0.34 0.82 1.06 0.00 0.00 176.91 178.95 3b78 h ILE 338 N 0.67 0.30 -0.24 -1.22 1.08 -1.76 -0.96 117.51 115.38 3b78 h ILE 338 Ca 0.39 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 64.78 3b78 h ILE 338 Cb 0.58 0.30 -0.01 0.00 -3.07 0.00 0.00 36.82 34.62 3b78 h ILE 338 CO -0.15 0.00 -0.13 0.58 -0.69 0.00 0.00 178.15 177.76 3b78 h VAL 339 N -0.69 1.31 -0.39 1.67 2.07 -1.51 -2.30 116.25 116.40 3b78 h VAL 339 Ca -0.02 -1.22 -0.08 0.00 0.82 0.00 0.00 66.70 66.20 3b78 h VAL 339 Cb 0.63 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 3b78 h VAL 339 CO -0.07 0.38 -0.09 -0.07 0.02 0.00 0.00 177.57 177.73 3b78 h LEU 340 N 0.22 0.66 0.00 2.57 3.38 -1.31 -3.40 115.31 117.43 3b78 h LEU 340 Ca 0.05 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3b78 h LEU 340 Cb 0.64 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3b78 h LEU 340 CO 0.04 0.79 -0.31 1.41 0.09 0.00 0.00 178.44 180.46 3b78 n HIS 341 N -4.19 0.00 -1.64 1.13 8.25 -0.37 -4.67 115.22 113.73 3b78 n HIS 341 Ca 0.01 0.00 -0.59 0.00 -0.26 0.00 0.00 57.72 56.89 3b78 n HIS 341 Cb 0.34 -0.16 -0.08 0.00 1.12 0.00 0.00 29.99 31.21 3b78 n HIS 341 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3b78 n LEU 342 N -3.59 1.44 -4.45 2.41 4.77 -0.87 -4.92 117.00 111.78 3b78 n LEU 342 Ca -0.04 1.13 -0.29 0.00 -0.03 0.00 0.00 56.01 56.78 3b78 n LEU 342 Cb 0.16 -1.05 0.26 0.00 -2.33 0.00 0.00 43.42 40.46 3b78 n LEU 342 CO 0.07 -0.99 0.50 -2.16 -1.33 0.00 0.00 177.39 173.47 3b78 s PRO 343 N 1.87 -1.49 0.42 3.23 0.04 -1.26 -4.81 135.00 133.01 3b78 s PRO 343 Ca 0.95 0.52 0.07 0.00 0.04 0.00 0.00 61.00 62.58 3b78 s PRO 343 Cb -1.17 -1.51 -0.04 0.00 0.04 0.00 0.00 34.50 31.81 3b78 s PRO 343 CO 0.62 -4.02 0.23 -1.54 0.04 0.00 0.00 177.00 172.33 3b78 s SER 344 N -2.87 4.56 0.04 6.66 1.04 -1.26 -4.59 113.70 117.27 3b78 s SER 344 Ca 0.68 -1.03 0.02 0.00 0.48 0.00 0.00 55.95 56.11 3b78 s SER 344 Cb -0.20 -0.44 0.12 0.00 0.10 0.00 0.00 66.02 65.59 3b78 s SER 344 CO 0.62 -0.60 0.97 -2.65 0.98 0.00 0.00 173.24 172.56 3b78 n PRO 345 N -1.33 0.01 -0.02 4.02 -0.02 -1.26 -0.55 135.00 135.87 3b78 n PRO 345 Ca -0.00 0.43 -0.12 0.00 -2.02 0.00 0.00 63.50 61.78 3b78 n PRO 345 Cb 0.64 -1.65 -0.14 0.00 -0.02 0.00 0.00 33.50 32.33 3b78 n PRO 345 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3b78 n VAL 346 N -1.49 1.65 -0.01 -1.45 0.31 -1.26 -3.80 118.33 112.27 3b78 n VAL 346 Ca -0.00 -0.76 -0.06 0.00 -0.01 0.00 0.00 64.34 63.51 3b78 n VAL 346 Cb 0.11 -1.22 -0.05 0.00 -0.91 0.00 0.00 33.84 31.77 3b78 n VAL 346 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 3b78 h THR 347 N 0.02 0.59 0.28 2.52 2.02 -1.20 -3.32 112.91 113.81 3b78 h THR 347 Ca -0.33 -1.30 -0.01 0.00 0.77 0.00 0.00 66.41 65.54 3b78 h THR 347 Cb 2.03 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 69.51 3b78 h THR 347 CO 0.08 0.19 -0.13 0.00 0.37 0.00 0.00 175.52 176.02 3b78 h ALA 348 N -0.65 -0.37 0.00 6.16 0.00 -1.65 -2.61 119.26 120.14 3b78 h ALA 348 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3b78 h ALA 348 Cb 0.38 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3b78 h ALA 348 CO 0.02 -0.68 0.12 1.96 0.00 0.00 0.00 179.25 180.66 3b78 h GLN 349 N -0.43 0.00 -0.30 0.00 4.20 -1.76 0.32 115.11 117.15 3b78 h GLN 349 Ca -0.04 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.52 3b78 h GLN 349 Cb 0.32 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 3b78 h GLN 349 CO 0.06 0.00 -0.42 0.00 -0.67 0.00 0.00 178.83 177.80 3b78 h ALA 350 N 1.71 0.68 -0.00 3.87 0.00 -1.54 -3.03 119.26 120.95 3b78 h ALA 350 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3b78 h ALA 350 Cb 0.24 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3b78 h ALA 350 CO 0.00 0.67 -0.34 2.48 0.00 0.00 0.00 179.25 182.06 3b78 n TYR 351 N -4.03 0.00 -0.35 0.00 0.18 -0.21 -4.55 117.16 108.19 3b78 n TYR 351 Ca -0.02 0.00 0.07 0.00 1.88 0.00 0.00 57.90 59.83 3b78 n TYR 351 Cb 0.55 0.00 0.20 0.00 -0.38 0.00 0.00 39.34 39.70 3b78 n TYR 351 CO 0.00 0.00 0.00 -2.13 -2.08 0.00 0.00 176.86 172.65 3b78 n ARG 352 N -0.91 2.93 -0.06 -3.48 0.63 0.97 -4.57 116.66 112.17 3b78 n ARG 352 Ca 0.02 -2.28 -0.14 0.00 -0.92 0.00 0.00 57.85 54.53 3b78 n ARG 352 Cb 0.15 -1.43 -0.12 0.00 0.45 0.00 0.00 32.46 31.51 3b78 n ARG 352 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3b78 h ALA 353 N 2.29 -0.00 -0.36 5.13 0.00 -1.74 -3.14 119.26 121.44 3b78 h ALA 353 Ca 0.00 -0.46 0.02 0.00 0.00 0.00 0.00 54.91 54.47 3b78 h ALA 353 Cb 0.91 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 3b78 h ALA 353 CO 0.05 -0.03 0.24 1.05 0.00 0.00 0.00 179.25 180.56 3b78 h GLU 354 N -0.89 0.40 0.00 0.00 4.11 -1.88 -1.11 114.58 115.21 3b78 h GLU 354 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.40 3b78 h GLU 354 Cb 0.93 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.09 3b78 h GLU 354 CO 0.00 0.26 0.00 0.37 0.07 0.00 0.00 179.01 179.72 3b78 h GLN 355 N 0.41 0.00 -0.23 1.06 4.15 -1.84 -3.24 115.11 115.42 3b78 h GLN 355 Ca 0.14 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.55 3b78 h GLN 355 Cb 0.06 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.75 3b78 h GLN 355 CO -0.03 0.00 -0.00 1.28 -1.93 0.00 0.00 178.83 178.15 3b78 n LEU 356 N -3.01 3.72 -3.73 -2.39 4.77 -0.45 -4.85 117.00 111.06 3b78 n LEU 356 Ca 0.03 -3.06 -0.25 0.00 -0.03 0.00 0.00 56.01 52.70 3b78 n LEU 356 Cb 0.43 -0.54 -0.17 0.00 -2.33 0.00 0.00 43.42 40.82 3b78 n LEU 356 CO 0.31 0.70 -0.37 -0.47 -1.33 0.00 0.00 177.39 176.23 3b78 s TYR 357 N -2.86 0.72 -0.41 -1.77 5.04 -1.00 -3.63 117.35 113.46 3b78 s TYR 357 Ca 0.41 -0.44 -0.05 0.00 -2.44 0.00 0.00 57.07 54.55 3b78 s TYR 357 Cb 0.34 -0.86 -0.09 0.00 0.35 0.00 0.00 41.96 41.69 3b78 s TYR 357 CO 0.08 -0.46 3.13 0.39 -1.34 0.00 0.00 175.55 177.35 3b78 n GLU 358 N 5.13 2.49 -0.93 4.97 1.02 -1.23 -4.83 120.64 127.26 3b78 n GLU 358 Ca -0.08 -1.83 0.00 0.00 -0.02 0.00 0.00 57.16 55.23 3b78 n GLU 358 Cb 0.49 -2.17 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 3b78 n GLU 358 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3b78 n GLY 359 N 1.85 3.47 3.68 0.62 0.00 -1.26 -4.60 105.19 108.94 3b78 n GLY 359 Ca 0.50 -1.25 -0.46 0.00 0.00 0.00 0.00 46.02 44.81 3b78 n GLY 359 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3b78 n PRO 360 N 0.00 2.27 0.00 1.61 -0.02 -1.26 -4.84 135.00 132.76 3b78 n PRO 360 Ca 0.00 0.82 0.04 0.00 -2.02 0.00 0.00 63.50 62.35 3b78 n PRO 360 Cb 0.00 -2.63 0.20 0.00 -0.02 0.00 0.00 33.50 31.05 3b78 n PRO 360 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3b78 n ALA 361 N 4.57 1.46 -0.03 3.55 0.00 -1.26 -1.40 120.51 127.40 3b78 n ALA 361 Ca 0.18 -0.03 0.02 0.00 0.00 0.00 0.00 53.44 53.61 3b78 n ALA 361 Cb 0.30 -1.15 0.05 0.00 0.00 0.00 0.00 19.45 18.65 3b78 n ALA 361 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3b78 n ASP 362 N -1.45 2.16 -4.70 0.00 5.68 -1.26 -4.72 116.55 112.26 3b78 n ASP 362 Ca 0.03 -1.88 -0.37 0.00 -0.50 0.00 0.00 54.79 52.08 3b78 n ASP 362 Cb 0.10 -0.07 0.08 0.00 -1.14 0.00 0.00 41.12 40.09 3b78 n ASP 362 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 3b78 n ASP 363 N -0.11 1.63 0.22 -1.12 2.03 -0.49 -4.82 116.55 113.88 3b78 n ASP 363 Ca 0.04 0.78 0.17 0.00 0.52 0.00 0.00 54.79 56.30 3b78 n ASP 363 Cb 0.28 -1.51 0.84 0.00 -0.72 0.00 0.00 41.12 40.01 3b78 n ASP 363 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3b78 h ALA 364 N 0.28 1.76 0.09 -1.67 0.00 -1.97 -2.37 119.26 115.39 3b78 h ALA 364 Ca -0.50 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.16 3b78 h ALA 364 Cb 1.34 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 3b78 h ALA 364 CO 0.51 -0.28 -1.27 -0.91 0.00 0.00 0.00 179.25 177.30 3b78 h ASN 365 N 0.00 0.31 -0.09 0.00 4.21 -1.93 -3.22 115.58 114.85 3b78 h ASN 365 Ca 0.08 -0.83 -0.00 0.00 1.21 0.00 0.00 56.30 56.76 3b78 h ASN 365 Cb 0.47 -0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 37.57 3b78 h ASN 365 CO -0.00 1.55 0.05 0.00 -1.29 0.00 0.00 177.43 177.74 3b78 h ILE 367 N 0.15 1.34 0.00 0.00 2.04 -1.58 -2.67 117.51 116.79 3b78 h ILE 367 Ca 0.04 -1.87 0.00 0.00 1.00 0.00 0.00 64.86 64.02 3b78 h ILE 367 Cb 0.02 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 3b78 h ILE 367 CO -0.01 0.57 0.00 0.00 0.00 0.00 0.00 178.15 178.72 3b78 h ALA 368 N 0.99 1.00 0.08 1.87 0.00 -1.07 -2.28 119.26 119.84 3b78 h ALA 368 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 3b78 h ALA 368 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3b78 h ALA 368 CO 0.11 0.00 -0.70 0.82 0.00 0.00 0.00 179.25 179.48 3b78 h ILE 369 N 0.00 1.46 -1.01 0.00 1.08 -1.06 -0.17 117.51 117.81 3b78 h ILE 369 Ca 0.00 -2.42 0.02 0.00 -0.39 0.00 0.00 64.86 62.08 3b78 h ILE 369 Cb 0.32 3.09 -0.05 0.00 -3.07 0.00 0.00 36.82 37.10 3b78 h ILE 369 CO 0.00 0.64 0.67 0.11 -0.69 0.00 0.00 178.15 178.88 3b78 h LYS 370 N -0.63 1.29 0.00 2.37 1.57 -1.33 -1.73 116.57 118.11 3b78 h LYS 370 Ca -0.14 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 3b78 h LYS 370 Cb 1.42 -0.29 0.00 0.00 0.08 0.00 0.00 32.23 33.44 3b78 h LYS 370 CO 0.05 0.85 -0.28 0.09 -0.57 0.00 0.00 179.45 179.59 3b78 n ASN 371 N -4.41 0.34 -3.20 0.86 3.02 -0.88 -3.72 115.26 107.27 3b78 n ASN 371 Ca 0.13 0.14 -0.23 0.00 -0.03 0.00 0.00 54.58 54.59 3b78 n ASN 371 Cb 0.05 -0.12 0.01 0.00 -0.61 0.00 0.00 39.78 39.11 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 -2.69 5.83 0.00 0.00 2.15 -0.20 -4.70 116.67 117.05 3b78 s ASP 373 Ca 0.35 1.82 0.00 0.00 0.43 0.00 0.00 52.55 55.15 3b78 s ASP 373 Cb -0.17 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 39.93 3b78 s ASP 373 CO 0.43 -1.67 0.65 -0.81 -0.17 0.00 0.00 175.17 173.59 3b78 n PRO 374 N 8.35 0.81 -0.04 4.34 -0.04 -1.26 -0.90 135.00 146.26 3b78 n PRO 374 Ca 0.25 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.66 3b78 n PRO 374 Cb 0.45 -1.16 -0.04 0.00 -0.04 0.00 0.00 33.50 32.70 3b78 n PRO 374 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3b78 n LYS 375 N -0.26 1.17 -0.45 0.54 4.76 -1.26 -3.98 118.16 118.68 3b78 n LYS 375 Ca 0.00 0.03 -0.23 0.00 -2.87 0.00 0.00 58.31 55.24 3b78 n LYS 375 Cb 0.08 -1.16 0.21 0.00 -1.84 0.00 0.00 35.03 32.32 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 -3.34 -1.71 7.82 0.00 -1.23 -4.83 120.51 114.66 3b78 n ALA 376 Ca -0.13 -1.19 -0.40 0.00 0.00 0.00 0.00 53.44 51.72 3b78 n ALA 376 Cb 0.67 -0.10 0.03 0.00 0.00 0.00 0.00 19.45 20.05 3b78 n ALA 376 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3b78 n ASP 377 N -4.81 2.43 -4.75 0.00 8.00 -1.26 -3.69 116.55 112.47 3b78 n ASP 377 Ca 0.11 1.04 -0.42 0.00 0.71 0.00 0.00 54.79 56.23 3b78 n ASP 377 Cb 0.45 -1.52 -0.01 0.00 -0.02 0.00 0.00 41.12 40.03 3b78 n ASP 377 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3b78 n LEU 378 N -0.28 4.37 -3.19 0.64 7.94 -1.26 -3.81 117.00 121.42 3b78 n LEU 378 Ca 0.08 1.19 -0.22 0.00 -1.11 0.00 0.00 56.01 55.95 3b78 n LEU 378 Cb 0.42 -1.58 -0.06 0.00 0.53 0.00 0.00 43.42 42.73 3b78 n LEU 378 CO 0.56 0.04 -0.28 0.23 -1.11 0.00 0.00 177.39 176.83 3b78 n MET 379 N 1.16 0.79 -3.22 1.96 2.81 -0.78 -2.72 117.12 117.12 3b78 n MET 379 Ca 0.05 -3.27 -0.40 0.00 -1.81 0.00 0.00 57.70 52.27 3b78 n MET 379 Cb 0.37 -1.37 -0.07 0.00 -0.71 0.00 0.00 33.22 31.44 3b78 n MET 379 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 3b78 s LEU 380 N -1.58 4.07 -0.16 4.03 0.20 0.08 -1.35 118.68 123.97 3b78 s LEU 380 Ca 0.37 0.57 -0.16 0.00 0.69 0.00 0.00 54.13 55.60 3b78 s LEU 380 Cb 0.23 -2.69 -0.04 0.00 -0.43 0.00 0.00 46.19 43.25 3b78 s LEU 380 CO -0.10 -0.27 0.39 -0.47 -0.29 0.00 0.00 176.35 175.61 3b78 s TYR 381 N 2.18 3.45 -0.27 5.38 5.04 -0.29 -0.85 117.35 131.99 3b78 s TYR 381 Ca 0.22 0.70 -0.11 0.00 -2.44 0.00 0.00 57.07 55.44 3b78 s TYR 381 Cb -0.16 -2.48 -0.05 0.00 0.35 0.00 0.00 41.96 39.63 3b78 s TYR 381 CO 0.09 0.13 0.20 0.08 -1.34 0.00 0.00 175.55 174.70 3b78 s VAL 382 N 0.82 5.31 -0.16 3.14 1.01 -0.41 -1.15 120.40 128.95 3b78 s VAL 382 Ca 0.20 0.20 -0.13 0.00 0.00 0.00 0.00 61.98 62.25 3b78 s VAL 382 Cb -0.14 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 3b78 s VAL 382 CO 0.07 0.26 -0.23 -1.20 0.00 0.00 0.00 175.10 174.01 3b78 n SER 383 N 4.95 1.86 -4.06 3.32 7.64 0.67 -2.94 113.62 125.06 3b78 n SER 383 Ca -0.14 0.50 -0.08 0.00 1.01 0.00 0.00 58.87 60.17 3b78 n SER 383 Cb 0.52 -0.83 -0.10 0.00 -1.01 0.00 0.00 64.21 62.79 3b78 n SER 383 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 3b78 s LYS 384 N -2.50 0.54 -0.22 1.43 -2.85 -1.08 -4.37 119.74 110.68 3b78 s LYS 384 Ca -0.22 -1.04 -0.09 0.00 -1.00 0.00 0.00 55.97 53.62 3b78 s LYS 384 Cb 0.03 0.14 -0.04 0.00 -2.06 0.00 0.00 37.83 35.90 3b78 s LYS 384 CO 0.33 -0.08 0.11 -1.64 0.10 0.00 0.00 175.35 174.17 3b78 s MET 385 N -3.16 3.99 -0.19 1.78 -1.94 -1.25 -0.60 119.30 117.94 3b78 s MET 385 Ca 0.00 -0.32 -0.06 0.00 -1.71 0.00 0.00 55.69 53.61 3b78 s MET 385 Cb 0.02 -3.40 -0.03 0.00 2.01 0.00 0.00 34.83 33.43 3b78 s MET 385 CO -0.07 0.11 0.02 0.54 -0.01 0.00 0.00 175.02 175.61 3b78 s VAL 386 N 0.87 4.29 0.58 -6.03 0.11 -0.51 -4.90 120.40 114.81 3b78 s VAL 386 Ca 0.06 -0.21 -0.19 0.00 -2.93 0.00 0.00 61.98 58.71 3b78 s VAL 386 Cb -0.13 -2.93 -0.05 0.00 -1.53 0.00 0.00 36.38 31.74 3b78 s VAL 386 CO 0.03 0.45 1.08 -2.65 -3.33 0.00 0.00 175.10 170.67 3b78 n PRO 387 N 3.85 1.10 -4.15 1.54 -0.02 -1.26 -1.48 135.00 134.57 3b78 n PRO 387 Ca -0.17 0.42 -0.15 0.00 -2.02 0.00 0.00 63.50 61.58 3b78 n PRO 387 Cb 0.52 -2.28 -0.11 0.00 -0.02 0.00 0.00 33.50 31.61 3b78 n PRO 387 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3b78 s THR 388 N -1.44 0.92 0.33 3.45 -4.23 -0.82 -3.17 115.64 110.68 3b78 s THR 388 Ca 0.75 -1.44 0.15 0.00 -1.18 0.00 0.00 61.69 59.97 3b78 s THR 388 Cb -0.42 -1.13 0.11 0.00 1.34 0.00 0.00 72.50 72.39 3b78 s THR 388 CO 0.47 -0.43 1.81 0.77 -0.54 0.00 0.00 174.62 176.71 3b78 h SER 389 N 3.95 0.00 -1.10 3.99 4.64 -1.53 -3.40 113.55 120.10 3b78 h SER 389 Ca -0.38 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 60.62 3b78 h SER 389 Cb 1.19 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.25 3b78 h SER 389 CO 0.47 0.38 0.88 -0.62 -0.87 0.00 0.00 176.83 177.07 3b78 s ASP 390 N -6.76 4.92 0.88 4.97 2.15 -1.26 -4.79 116.67 116.78 3b78 s ASP 390 Ca -0.02 -0.12 0.00 0.00 0.43 0.00 0.00 52.55 52.84 3b78 s ASP 390 Cb 0.13 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 3b78 s ASP 390 CO 0.71 -2.83 0.00 1.17 -0.17 0.00 0.00 175.17 174.05 3b78 n LYS 391 N 8.96 0.00 -0.33 4.34 3.00 -1.26 -2.70 118.16 130.17 3b78 n LYS 391 Ca 0.35 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.62 3b78 n LYS 391 Cb 0.49 0.00 0.07 0.00 0.00 0.00 0.00 35.03 35.59 3b78 n LYS 391 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3b78 n GLY 392 N 0.00 2.48 3.82 3.14 0.00 -1.26 -4.67 105.19 108.70 3b78 n GLY 392 Ca 0.00 -0.30 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.13 3.09 0.03 1.61 1.81 -1.10 -4.89 118.95 118.37 3b78 s ARG 393 Ca 0.16 0.97 0.05 0.00 -1.72 0.00 0.00 55.73 55.20 3b78 s ARG 393 Cb 0.13 -2.01 -0.02 0.00 -0.45 0.00 0.00 34.95 32.60 3b78 s ARG 393 CO 0.04 -0.98 -0.14 -0.06 -0.68 0.00 0.00 175.30 173.47 3b78 s PHE 394 N -2.96 1.25 -0.11 -0.53 0.08 -1.26 -1.94 117.98 112.51 3b78 s PHE 394 Ca 0.59 -0.34 -0.03 0.00 0.12 0.00 0.00 56.93 57.26 3b78 s PHE 394 Cb -0.14 -0.75 -0.03 0.00 -0.57 0.00 0.00 43.02 41.53 3b78 s PHE 394 CO 0.51 0.03 0.01 0.71 -0.10 0.00 0.00 175.22 176.38 3b78 s TYR 395 N -0.80 3.16 -0.17 0.36 2.02 -0.55 -4.04 117.35 117.33 3b78 s TYR 395 Ca 0.02 0.09 -0.29 0.00 -0.37 0.00 0.00 57.07 56.52 3b78 s TYR 395 Cb -0.08 -1.87 -0.01 0.00 -0.40 0.00 0.00 41.96 39.61 3b78 s TYR 395 CO 0.01 0.33 1.17 0.00 -1.57 0.00 0.00 175.55 175.49 3b78 s ALA 396 N -0.47 3.64 -0.20 3.71 0.00 -0.43 -1.42 121.76 126.60 3b78 s ALA 396 Ca 0.08 0.38 -0.10 0.00 0.00 0.00 0.00 51.96 52.32 3b78 s ALA 396 Cb -0.12 -3.58 -0.05 0.00 0.00 0.00 0.00 23.12 19.37 3b78 s ALA 396 CO 0.02 -1.06 0.13 0.12 0.00 0.00 0.00 175.76 174.97 3b78 s PHE 397 N 3.19 3.40 0.00 0.00 5.36 0.23 -0.52 117.98 129.65 3b78 s PHE 397 Ca 0.51 0.32 0.00 0.00 -0.96 0.00 0.00 56.93 56.80 3b78 s PHE 397 Cb -0.20 -2.16 0.00 0.00 -0.34 0.00 0.00 43.02 40.32 3b78 s PHE 397 CO 0.13 0.28 0.00 0.41 -1.46 0.00 0.00 175.22 174.58 3b78 n GLY 398 N 3.55 1.49 2.98 13.12 0.00 -0.87 -0.24 105.19 125.22 3b78 n GLY 398 Ca -0.16 -0.87 -0.21 0.00 0.00 0.00 0.00 46.02 44.78 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 -1.37 1.06 -0.54 1.61 3.52 -0.30 -1.56 118.95 121.38 3b78 s ARG 399 Ca 0.00 -0.29 -0.28 0.00 -0.13 0.00 0.00 55.73 55.04 3b78 s ARG 399 Cb 0.00 -0.98 0.03 0.00 -1.56 0.00 0.00 34.95 32.45 3b78 s ARG 399 CO 0.00 0.06 1.12 0.08 -0.81 0.00 0.00 175.30 175.75 3b78 s VAL 400 N 0.41 4.15 -0.77 7.11 1.01 -0.86 -1.13 120.40 130.32 3b78 s VAL 400 Ca -0.07 0.87 0.24 0.00 0.00 0.00 0.00 61.98 63.03 3b78 s VAL 400 Cb -0.11 -4.65 0.01 0.00 0.00 0.00 0.00 36.38 31.63 3b78 s VAL 400 CO 0.01 -1.19 1.31 0.49 0.00 0.00 0.00 175.10 175.72 3b78 n PHE 401 N 8.05 0.29 -3.49 5.22 3.72 -0.46 0.13 117.46 130.92 3b78 n PHE 401 Ca 0.08 0.08 -0.11 0.00 -0.05 0.00 0.00 57.45 57.45 3b78 n PHE 401 Cb 0.49 -0.46 -0.03 0.00 -0.94 0.00 0.00 39.48 38.53 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 -3.11 -1.76 0.00 4.37 0.00 -1.21 -4.35 121.76 115.70 3b78 s ALA 402 Ca 0.08 0.99 0.00 0.00 0.00 0.00 0.00 51.96 53.02 3b78 s ALA 402 Cb 0.15 0.33 0.00 0.00 0.00 0.00 0.00 23.12 23.60 3b78 s ALA 402 CO 0.73 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 176.29 3b78 n GLY 403 N 0.05 0.45 2.86 0.00 0.00 -0.08 -1.86 105.19 106.61 3b78 n GLY 403 Ca -0.13 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.02 -0.09 2.61 -4.23 -1.26 -2.40 115.64 110.27 3b78 s THR 404 Ca 0.00 0.06 -0.12 0.00 -1.18 0.00 0.00 61.69 60.45 3b78 s THR 404 Cb 0.00 -0.05 -0.05 0.00 1.34 0.00 0.00 72.50 73.74 3b78 s THR 404 CO 0.00 0.02 0.27 0.54 -0.54 0.00 0.00 174.62 174.92 3b78 s VAL 405 N 0.30 5.28 0.10 2.29 0.11 -1.05 -4.89 120.40 122.55 3b78 s VAL 405 Ca -0.02 0.52 0.05 0.00 -2.93 0.00 0.00 61.98 59.59 3b78 s VAL 405 Cb -0.04 -3.57 -0.03 0.00 -1.53 0.00 0.00 36.38 31.21 3b78 s VAL 405 CO -0.01 0.55 -0.12 -0.54 -3.33 0.00 0.00 175.10 171.64 3b78 s LYS 406 N -0.66 0.89 0.00 1.54 1.02 -1.26 -1.26 119.74 120.01 3b78 s LYS 406 Ca 0.18 -1.12 -0.30 0.00 0.02 0.00 0.00 55.97 54.75 3b78 s LYS 406 Cb -0.14 -0.72 -0.05 0.00 -0.52 0.00 0.00 37.83 36.40 3b78 s LYS 406 CO 0.07 0.13 1.38 -1.12 -0.92 0.00 0.00 175.35 174.90 3b78 s SER 407 N -2.25 6.87 0.00 2.83 0.01 0.17 -2.35 113.70 118.97 3b78 s SER 407 Ca 0.04 2.10 0.00 0.00 1.31 0.00 0.00 55.95 59.40 3b78 s SER 407 Cb -0.05 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.61 3b78 s SER 407 CO 0.02 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 173.58 3b78 n GLY 408 N 3.61 3.32 3.74 3.44 0.00 0.18 -5.01 105.19 114.46 3b78 n GLY 408 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.79 2.51 -3.18 1.61 7.27 -0.99 -4.40 117.38 118.41 3b78 n GLN 409 Ca 0.00 0.89 -0.39 0.00 0.07 0.00 0.00 57.00 57.57 3b78 n GLN 409 Cb 0.00 -2.60 -0.05 0.00 2.41 0.00 0.00 30.24 30.00 3b78 n GLN 409 CO 0.00 0.00 0.00 -1.59 0.07 0.00 0.00 177.06 175.54 3b78 s LYS 410 N -1.37 4.34 0.07 3.69 -2.85 -1.26 -0.32 119.74 122.04 3b78 s LYS 410 Ca 0.59 0.74 0.04 0.00 -1.00 0.00 0.00 55.97 56.34 3b78 s LYS 410 Cb -0.52 -3.37 -0.03 0.00 -2.06 0.00 0.00 37.83 31.85 3b78 s LYS 410 CO 0.57 0.29 -0.12 0.08 0.10 0.00 0.00 175.35 176.28 3b78 s VAL 411 N 0.06 0.96 -0.60 1.79 1.01 -0.34 -4.95 120.40 118.32 3b78 s VAL 411 Ca 0.32 -1.36 -0.24 0.00 0.00 0.00 0.00 61.98 60.70 3b78 s VAL 411 Cb -0.18 -1.06 0.05 0.00 0.00 0.00 0.00 36.38 35.19 3b78 s VAL 411 CO 0.17 -0.35 0.97 -0.13 0.00 0.00 0.00 175.10 175.76 3b78 s ARG 412 N -2.00 3.23 -0.80 2.72 0.52 -0.57 -2.76 118.95 119.29 3b78 s ARG 412 Ca -0.01 -0.49 -0.26 0.00 -0.52 0.00 0.00 55.73 54.45 3b78 s ARG 412 Cb -0.08 -4.13 0.04 0.00 0.52 0.00 0.00 34.95 31.30 3b78 s ARG 412 CO 0.01 -1.65 1.31 0.42 0.02 0.00 0.00 175.30 175.41 3b78 s ILE 413 N 4.09 3.79 -0.34 1.52 1.01 -0.35 -2.46 121.20 128.46 3b78 s ILE 413 Ca 0.27 0.11 -0.17 0.00 0.00 0.00 0.00 60.65 60.85 3b78 s ILE 413 Cb -0.14 -4.95 -0.01 0.00 0.01 0.00 0.00 42.46 37.38 3b78 s ILE 413 CO 0.15 -1.87 0.48 -1.10 0.00 0.00 0.00 174.94 172.61 3b78 s GLN 414 N 5.50 3.64 0.81 2.79 -0.21 -0.64 -1.95 119.66 129.59 3b78 s GLN 414 Ca 0.37 -0.18 -0.14 0.00 0.02 0.00 0.00 55.36 55.43 3b78 s GLN 414 Cb -0.06 -3.80 0.19 0.00 1.00 0.00 0.00 33.01 30.34 3b78 s GLN 414 CO 0.09 -0.60 0.98 0.41 -2.12 0.00 0.00 175.29 174.05 3b78 n GLY 415 N 4.80 -1.77 0.05 3.09 0.00 -0.65 -1.75 105.19 108.97 3b78 n GLY 415 Ca -0.06 -1.64 -0.12 0.00 0.00 0.00 0.00 46.02 44.21 3b78 n GLY 415 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3b78 h PRO 416 N 0.00 0.01 0.00 1.61 0.11 -1.87 -2.73 132.00 129.14 3b78 h PRO 416 Ca -0.33 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3b78 h PRO 416 Cb 0.93 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 3b78 h PRO 416 CO 0.23 0.01 0.00 0.09 -0.21 0.00 0.00 178.00 178.12 3b78 n ASN 417 N -5.09 0.00 -4.77 -2.05 3.02 -1.26 -4.87 115.26 100.24 3b78 n ASN 417 Ca -0.06 -0.81 -0.39 0.00 -0.03 0.00 0.00 54.58 53.29 3b78 n ASN 417 Cb 0.04 -0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.19 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 -2.01 3.10 -0.03 3.10 5.04 -1.03 -4.80 117.35 120.73 3b78 s TYR 418 Ca 0.39 1.54 0.00 0.00 -2.44 0.00 0.00 57.07 56.56 3b78 s TYR 418 Cb 0.18 -3.44 0.03 0.00 0.35 0.00 0.00 41.96 39.07 3b78 s TYR 418 CO 0.30 -1.36 0.01 0.08 -1.34 0.00 0.00 175.55 173.23 3b78 s VAL 419 N -1.33 0.13 0.58 3.14 1.01 -1.26 -4.85 120.40 117.82 3b78 s VAL 419 Ca 0.54 0.11 0.32 0.00 0.00 0.00 0.00 61.98 62.95 3b78 s VAL 419 Cb -0.33 -0.23 0.45 0.00 0.00 0.00 0.00 36.38 36.27 3b78 s VAL 419 CO 0.42 0.13 1.69 -0.65 0.00 0.00 0.00 175.10 176.69 3b78 h PRO 420 N 7.27 0.00 0.14 2.72 0.11 -1.91 -1.09 132.00 139.24 3b78 h PRO 420 Ca -0.43 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 3b78 h PRO 420 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3b78 h PRO 420 CO 0.47 0.00 -0.07 0.78 -0.21 0.00 0.00 178.00 178.98 3b78 h GLY 421 N 0.00 -0.20 -1.69 -0.55 0.00 -1.96 -3.47 103.07 95.21 3b78 h GLY 421 Ca 0.42 0.07 -0.50 0.00 0.00 0.00 0.00 47.33 47.33 3b78 h GLY 421 CO -0.00 -0.07 -0.07 0.54 0.00 0.00 0.00 176.54 176.93 3b78 s LYS 422 N -4.27 2.22 -0.27 4.80 1.02 -0.41 -5.03 119.74 117.79 3b78 s LYS 422 Ca -0.14 -1.69 0.11 0.00 0.02 0.00 0.00 55.97 54.27 3b78 s LYS 422 Cb 0.02 -2.63 0.56 0.00 -0.52 0.00 0.00 37.83 35.26 3b78 s LYS 422 CO 0.58 -0.96 1.53 0.36 -0.92 0.00 0.00 175.35 175.95 3b78 n LYS 423 N -2.31 2.45 -2.91 1.68 2.85 -1.26 -4.56 118.16 114.10 3b78 n LYS 423 Ca 0.17 -3.04 -0.38 0.00 -1.05 0.00 0.00 58.31 54.01 3b78 n LYS 423 Cb 0.62 -1.90 -0.06 0.00 -0.65 0.00 0.00 35.03 33.03 3b78 n LYS 423 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 3b78 s ASP 424 N -2.06 7.33 -1.27 -5.58 1.01 -1.26 -4.09 116.67 110.75 3b78 s ASP 424 Ca 0.46 1.70 -0.02 0.00 0.71 0.00 0.00 52.55 55.40 3b78 s ASP 424 Cb 0.39 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.80 3b78 s ASP 424 CO 0.05 0.07 0.73 -0.67 0.21 0.00 0.00 175.17 175.56 3b78 n ASP 425 N 1.02 -1.88 -4.01 0.27 -0.08 -1.26 -4.06 116.55 106.56 3b78 n ASP 425 Ca -0.02 -0.82 -0.19 0.00 -1.51 0.00 0.00 54.79 52.25 3b78 n ASP 425 Cb 0.49 -4.12 -0.15 0.00 2.34 0.00 0.00 41.12 39.69 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 -6.56 1.93 -0.22 -2.67 2.96 -1.26 -1.64 118.68 111.22 3b78 s LEU 426 Ca 0.07 -0.17 -0.04 0.00 -0.22 0.00 0.00 54.13 53.77 3b78 s LEU 426 Cb -0.02 -0.49 0.08 0.00 0.50 0.00 0.00 46.19 46.27 3b78 s LEU 426 CO 0.81 0.09 0.13 -0.36 -1.32 0.00 0.00 176.35 175.69 3b78 s PHE 427 N -0.05 0.17 -0.80 5.38 0.40 -0.82 -5.00 117.98 117.25 3b78 s PHE 427 Ca 0.01 -0.47 -0.20 0.00 -0.60 0.00 0.00 56.93 55.68 3b78 s PHE 427 Cb -0.05 -0.73 0.11 0.00 0.51 0.00 0.00 43.02 42.86 3b78 s PHE 427 CO -0.00 -0.65 1.00 0.42 0.70 0.00 0.00 175.22 176.69 3b78 s ILE 428 N 2.15 4.66 0.00 0.64 1.01 -1.26 -1.21 121.20 127.19 3b78 s ILE 428 Ca 0.05 -1.17 0.00 0.00 0.00 0.00 0.00 60.65 59.53 3b78 s ILE 428 Cb -0.16 -4.70 0.00 0.00 0.01 0.00 0.00 42.46 37.61 3b78 s ILE 428 CO -0.21 -1.42 0.00 0.29 0.00 0.00 0.00 174.94 173.61 3b78 n LYS 429 N 6.75 2.75 -4.92 2.79 4.76 -1.11 -4.95 118.16 124.23 3b78 n LYS 429 Ca 0.10 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.26 3b78 n LYS 429 Cb 0.47 0.00 -0.17 0.00 -1.84 0.00 0.00 35.03 33.49 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 -2.00 1.72 -0.38 7.82 0.00 -1.26 -1.20 121.76 126.46 3b78 s ALA 430 Ca 0.00 -0.71 -0.28 0.00 0.00 0.00 0.00 51.96 50.98 3b78 s ALA 430 Cb 0.00 -0.67 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 3b78 s ALA 430 CO 0.00 0.22 2.01 0.42 0.00 0.00 0.00 175.76 178.41 3b78 s ILE 431 N 0.44 3.27 0.21 0.00 -1.09 0.56 -4.86 121.20 119.72 3b78 s ILE 431 Ca -0.15 0.24 -0.10 0.00 -2.23 0.00 0.00 60.65 58.41 3b78 s ILE 431 Cb -0.16 -3.44 0.14 0.00 -1.58 0.00 0.00 42.46 37.41 3b78 s ILE 431 CO 0.06 -0.33 1.85 1.56 -1.23 0.00 0.00 174.94 176.85 3b78 h GLN 432 N 14.83 0.84 -2.07 2.79 4.20 -1.79 0.52 115.11 134.43 3b78 h GLN 432 Ca -0.33 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.28 3b78 h GLN 432 Cb 1.20 -0.19 -0.20 0.00 0.30 0.00 0.00 27.48 28.59 3b78 h GLN 432 CO 1.07 0.55 0.13 0.50 -0.67 0.00 0.00 178.83 180.41 3b78 s ARG 433 N -6.12 0.95 -0.18 1.46 6.06 -1.14 -4.30 118.95 115.67 3b78 s ARG 433 Ca -0.13 0.51 -0.02 0.00 -2.50 0.00 0.00 55.73 53.59 3b78 s ARG 433 Cb 0.15 0.45 -0.01 0.00 0.06 0.00 0.00 34.95 35.60 3b78 s ARG 433 CO 0.77 -0.23 -0.09 0.08 -2.50 0.00 0.00 175.30 173.32 3b78 s VAL 434 N -0.60 3.10 0.10 7.11 1.01 -1.25 -0.72 120.40 129.15 3b78 s VAL 434 Ca -0.07 -0.61 0.08 0.00 0.00 0.00 0.00 61.98 61.38 3b78 s VAL 434 Cb -0.02 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 3b78 s VAL 434 CO 0.06 0.48 -0.20 0.68 0.00 0.00 0.00 175.10 176.12 3b78 s VAL 435 N 1.01 1.63 0.14 2.92 -7.23 -0.28 0.51 120.40 119.09 3b78 s VAL 435 Ca -0.01 -1.53 -0.25 0.00 -1.81 0.00 0.00 61.98 58.37 3b78 s VAL 435 Cb -0.15 -1.50 -0.07 0.00 0.56 0.00 0.00 36.38 35.21 3b78 s VAL 435 CO -0.01 -0.10 0.78 -0.76 -0.31 0.00 0.00 175.10 174.70 3b78 s LEU 436 N -1.93 4.57 -1.29 1.32 1.43 -0.11 -0.65 118.68 122.01 3b78 s LEU 436 Ca 0.06 1.62 -0.17 0.00 -1.03 0.00 0.00 54.13 54.61 3b78 s LEU 436 Cb -0.10 -3.30 0.09 0.00 0.03 0.00 0.00 46.19 42.91 3b78 s LEU 436 CO 0.04 0.16 1.71 0.23 0.23 0.00 0.00 176.35 178.73 3b78 n MET 437 N 1.86 3.22 -1.07 1.70 2.81 -1.26 -2.76 117.12 121.61 3b78 n MET 437 Ca -0.05 -3.35 -0.16 0.00 -1.81 0.00 0.00 57.70 52.33 3b78 n MET 437 Cb 0.49 -3.40 -0.08 0.00 -0.71 0.00 0.00 33.22 29.53 3b78 n MET 437 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 3b78 n MET 438 N 7.70 1.96 0.00 0.03 2.81 -0.52 -4.44 117.12 124.66 3b78 n MET 438 Ca 0.47 -1.39 0.00 0.00 -1.81 0.00 0.00 57.70 54.97 3b78 n MET 438 Cb 0.45 -1.84 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 3b78 n MET 438 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3b78 n GLY 439 N 1.48 1.54 0.02 3.03 0.00 0.01 -2.54 105.19 108.72 3b78 n GLY 439 Ca 0.37 0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.57 3b78 n GLY 439 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3b78 n ARG 440 N 0.00 0.08 -4.46 1.61 0.63 -1.26 -3.46 116.66 109.80 3b78 n ARG 440 Ca 0.00 0.02 -0.23 0.00 -0.92 0.00 0.00 57.85 56.72 3b78 n ARG 440 Cb 0.00 -1.54 -0.10 0.00 0.45 0.00 0.00 32.46 31.26 3b78 n ARG 440 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 3b78 s PHE 441 N -3.05 2.13 0.03 -0.14 0.08 -1.05 0.16 117.98 116.14 3b78 s PHE 441 Ca 0.09 -0.53 0.08 0.00 0.12 0.00 0.00 56.93 56.70 3b78 s PHE 441 Cb 0.16 -1.11 -0.03 0.00 -0.57 0.00 0.00 43.02 41.48 3b78 s PHE 441 CO 0.72 0.49 -0.24 0.14 -0.10 0.00 0.00 175.22 176.23 3b78 s VAL 442 N -2.76 1.93 -0.24 -0.44 -7.23 -1.26 -1.44 120.40 108.96 3b78 s VAL 442 Ca 0.29 -1.25 0.01 0.00 -1.81 0.00 0.00 61.98 59.22 3b78 s VAL 442 Cb 0.00 -1.65 0.06 0.00 0.56 0.00 0.00 36.38 35.36 3b78 s VAL 442 CO 0.13 0.35 -0.04 -0.70 -0.31 0.00 0.00 175.10 174.53 3b78 s GLU 443 N -1.08 1.54 0.39 4.82 2.56 -1.11 -4.87 118.70 120.94 3b78 s GLU 443 Ca 0.10 -1.01 -0.25 0.00 0.00 0.00 0.00 54.97 53.81 3b78 s GLU 443 Cb -0.09 -2.57 -0.12 0.00 2.00 0.00 0.00 34.13 33.35 3b78 s GLU 443 CO 0.01 -0.63 1.01 -2.30 -0.56 0.00 0.00 175.26 172.79 3b78 n PRO 444 N 4.68 1.37 -3.81 4.30 -0.02 -1.26 -0.94 135.00 139.32 3b78 n PRO 444 Ca -0.11 0.49 -0.12 0.00 -2.02 0.00 0.00 63.50 61.74 3b78 n PRO 444 Cb 0.44 -1.99 -0.12 0.00 -0.02 0.00 0.00 33.50 31.81 3b78 n PRO 444 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3b78 s ILE 445 N -1.22 0.01 0.14 4.25 1.10 0.18 -4.82 121.20 120.83 3b78 s ILE 445 Ca 0.62 -0.07 -0.06 0.00 -0.51 0.00 0.00 60.65 60.62 3b78 s ILE 445 Cb -0.59 -0.29 -0.14 0.00 0.15 0.00 0.00 42.46 41.58 3b78 s ILE 445 CO 0.58 -0.04 1.36 0.44 -2.11 0.00 0.00 174.94 175.17 3b78 h ASP 446 N 5.66 0.64 -5.18 4.50 3.32 -1.94 -3.34 116.42 120.08 3b78 h ASP 446 Ca -0.26 -0.44 -0.07 0.00 0.02 0.00 0.00 57.03 56.28 3b78 h ASP 446 Cb 1.20 -0.19 -0.12 0.00 0.22 0.00 0.00 39.33 40.44 3b78 h ASP 446 CO 0.39 1.22 -0.20 1.51 -1.72 0.00 0.00 179.24 180.44 3b78 s ASP 447 N -7.05 -0.07 -0.24 6.45 -4.77 -1.26 -0.66 116.67 109.07 3b78 s ASP 447 Ca -0.07 -0.68 -0.03 0.00 -3.30 0.00 0.00 52.55 48.47 3b78 s ASP 447 Cb 0.09 0.47 0.13 0.00 -1.09 0.00 0.00 42.92 42.52 3b78 s ASP 447 CO 0.87 -0.92 0.39 0.00 0.70 0.00 0.00 175.17 176.20 3b78 s PRO 449 N 2.56 -0.88 0.49 0.00 0.04 -1.26 -2.52 135.00 133.43 3b78 s PRO 449 Ca 0.11 0.82 -0.21 0.00 0.04 0.00 0.00 61.00 61.76 3b78 s PRO 449 Cb -0.15 -1.56 -0.08 0.00 0.04 0.00 0.00 34.50 32.76 3b78 s PRO 449 CO -0.15 -3.69 1.09 0.00 0.04 0.00 0.00 177.00 174.29 3b78 s ALA 450 N -2.49 2.87 0.00 8.56 0.00 -1.01 -3.88 121.76 125.81 3b78 s ALA 450 Ca 0.68 0.75 0.00 0.00 0.00 0.00 0.00 51.96 53.40 3b78 s ALA 450 Cb -0.25 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.56 3b78 s ALA 450 CO 0.64 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 176.30 3b78 n GLY 451 N 0.11 0.57 3.56 0.00 0.00 0.34 -4.93 105.19 104.83 3b78 n GLY 451 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.80 4.19 -0.12 1.61 0.02 -1.25 -4.68 114.94 111.91 3b78 s ASN 452 Ca 0.00 -0.58 -0.20 0.00 -1.02 0.00 0.00 52.86 51.06 3b78 s ASN 452 Cb 0.00 -0.69 -0.04 0.00 0.02 0.00 0.00 41.25 40.54 3b78 s ASN 452 CO 0.00 0.11 0.58 -0.63 0.02 0.00 0.00 177.10 177.19 3b78 s ILE 453 N -1.63 5.10 0.14 0.60 1.09 -1.26 -2.02 121.20 123.23 3b78 s ILE 453 Ca 0.24 1.16 -0.05 0.00 -1.10 0.00 0.00 60.65 60.89 3b78 s ILE 453 Cb -0.09 -3.92 -0.02 0.00 -1.06 0.00 0.00 42.46 37.37 3b78 s ILE 453 CO 0.14 0.25 0.17 -0.51 -0.10 0.00 0.00 174.94 174.89 3b78 s ILE 454 N 1.02 0.09 0.18 2.92 1.10 -0.60 -4.72 121.20 121.19 3b78 s ILE 454 Ca 0.30 -1.62 0.11 0.00 -0.51 0.00 0.00 60.65 58.92 3b78 s ILE 454 Cb -0.16 -1.89 -0.04 0.00 0.15 0.00 0.00 42.46 40.52 3b78 s ILE 454 CO 0.13 -0.42 -0.20 -0.83 -2.11 0.00 0.00 174.94 171.51 3b78 s GLY 455 N -2.99 1.70 0.05 1.50 0.00 0.18 -2.06 107.32 105.70 3b78 s GLY 455 Ca 0.19 -1.56 0.07 0.00 0.00 0.00 0.00 44.72 43.42 3b78 s GLY 455 CO -0.00 -1.58 -0.19 1.08 0.00 0.00 0.00 173.10 172.41 3b78 s LEU 456 N -2.61 2.20 -0.18 0.66 1.43 0.32 -1.13 118.68 119.37 3b78 s LEU 456 Ca 0.21 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.77 3b78 s LEU 456 Cb -0.09 -0.85 0.01 0.00 0.03 0.00 0.00 46.19 45.29 3b78 s LEU 456 CO 0.11 0.10 -0.17 -0.69 0.23 0.00 0.00 176.35 175.93 3b78 s VAL 457 N -0.89 2.37 0.00 -1.59 1.01 0.10 -1.31 120.40 120.09 3b78 s VAL 457 Ca 0.06 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.19 3b78 s VAL 457 Cb -0.09 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.28 3b78 s VAL 457 CO 0.02 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.25 3b78 n GLY 458 N 4.51 1.38 0.00 4.51 0.00 -1.26 -2.50 105.19 111.82 3b78 n GLY 458 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.26 0.00 0.14 -0.61 -0.00 -1.26 -4.76 119.36 112.61 3b78 n ILE 459 Ca 0.00 -0.21 0.05 0.00 -0.00 0.00 0.00 62.75 62.59 3b78 n ILE 459 Cb 0.00 1.33 0.26 0.00 -0.00 0.00 0.00 39.64 41.23 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 -0.18 0.23 -0.88 4.38 5.75 -1.26 -0.85 116.55 123.75 3b78 n ASP 460 Ca 0.00 0.60 0.09 0.00 -0.01 0.00 0.00 54.79 55.47 3b78 n ASP 460 Cb 0.08 -0.63 0.16 0.00 -1.03 0.00 0.00 41.12 39.70 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 -1.80 2.15 0.00 0.11 0.00 -1.26 -4.47 117.38 112.11 3b78 n GLN 461 Ca 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 57.00 55.02 3b78 n GLN 461 Cb 0.05 -1.39 0.00 0.00 0.00 0.00 0.00 30.24 28.90 3b78 n GLN 461 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3b78 n PHE 462 N 1.07 0.00 -4.26 2.61 3.72 -0.03 -5.00 117.46 115.57 3b78 n PHE 462 Ca 0.15 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.21 3b78 n PHE 462 Cb 0.49 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.87 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 -3.31 2.28 0.05 4.37 1.43 -0.51 -4.93 118.68 118.06 3b78 s LEU 463 Ca 0.00 -0.58 -0.30 0.00 -1.03 0.00 0.00 54.13 52.22 3b78 s LEU 463 Cb 0.00 -1.52 -0.17 0.00 0.03 0.00 0.00 46.19 44.53 3b78 s LEU 463 CO 0.00 0.03 1.43 0.25 0.23 0.00 0.00 176.35 178.29 3b78 h LEU 464 N 7.75 -0.92 0.00 1.79 5.85 -1.88 -3.43 115.31 124.47 3b78 h LEU 464 Ca -0.41 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.34 3b78 h LEU 464 Cb 1.16 0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.43 3b78 h LEU 464 CO 0.61 -0.65 0.00 0.29 -0.34 0.00 0.00 178.44 178.35 3b78 n LYS 465 N -4.94 0.00 -4.74 1.25 5.02 -1.26 -4.81 118.16 108.68 3b78 n LYS 465 Ca -0.13 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.85 3b78 n LYS 465 Cb 0.43 -0.09 -0.13 0.00 -0.02 0.00 0.00 35.03 35.22 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 -1.81 2.67 0.19 -0.18 2.01 -1.26 -3.86 115.64 113.39 3b78 s THR 466 Ca 0.00 -1.19 -0.23 0.00 0.31 0.00 0.00 61.69 60.58 3b78 s THR 466 Cb 0.00 -2.10 0.06 0.00 0.01 0.00 0.00 72.50 70.48 3b78 s THR 466 CO 0.00 0.37 0.95 -0.83 -0.69 0.00 0.00 174.62 174.42 3b78 s GLY 467 N -1.32 -0.08 -0.15 4.40 0.00 -1.15 -4.62 107.32 104.39 3b78 s GLY 467 Ca 0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 44.72 44.74 3b78 s GLY 467 CO 0.04 0.57 -0.03 -1.59 0.00 0.00 0.00 173.10 172.09 3b78 s THR 468 N -2.96 0.90 -0.22 0.90 2.01 -0.72 -1.29 115.64 114.26 3b78 s THR 468 Ca 0.15 -0.49 -0.15 0.00 0.31 0.00 0.00 61.69 61.51 3b78 s THR 468 Cb -0.02 -1.12 -0.04 0.00 0.01 0.00 0.00 72.50 71.32 3b78 s THR 468 CO 0.04 0.10 0.35 -0.76 -0.69 0.00 0.00 174.62 173.66 3b78 s LEU 469 N 1.72 4.12 0.30 4.42 1.02 -0.03 -1.63 118.68 128.61 3b78 s LEU 469 Ca 0.01 0.39 0.03 0.00 0.02 0.00 0.00 54.13 54.58 3b78 s LEU 469 Cb -0.15 -2.41 -0.04 0.00 0.02 0.00 0.00 46.19 43.60 3b78 s LEU 469 CO -0.07 -0.07 0.14 0.42 0.02 0.00 0.00 176.35 176.79 3b78 s THR 470 N 1.41 0.41 0.00 5.49 -4.23 -1.03 -0.74 115.64 116.96 3b78 s THR 470 Ca 0.16 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.67 3b78 s THR 470 Cb -0.15 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.15 3b78 s THR 470 CO 0.08 0.00 0.00 0.41 -0.54 0.00 0.00 174.62 174.57 3b78 n THR 471 N -0.56 0.00 -2.18 3.99 -1.04 -1.10 -1.51 114.28 111.87 3b78 n THR 471 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 3b78 n THR 471 Cb 0.65 -0.72 -0.03 0.00 -1.82 0.00 0.00 70.33 68.41 3b78 n THR 471 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3b78 s SER 472 N -2.77 6.83 0.00 8.00 0.15 -1.26 -4.90 113.70 119.75 3b78 s SER 472 Ca 0.00 2.27 0.22 0.00 0.70 0.00 0.00 55.95 59.14 3b78 s SER 472 Cb 0.00 -2.58 1.02 0.00 -1.71 0.00 0.00 66.02 62.75 3b78 s SER 472 CO 0.00 -0.67 1.71 1.21 1.20 0.00 0.00 173.24 176.68 3b78 n GLU 473 N 4.40 0.16 -1.43 5.44 2.13 -1.26 -2.69 120.64 127.39 3b78 n GLU 473 Ca 0.12 0.10 -0.11 0.00 0.66 0.00 0.00 57.16 57.94 3b78 n GLU 473 Cb 0.43 -1.50 0.10 0.00 0.27 0.00 0.00 31.44 30.74 3b78 n GLU 473 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 3b78 n THR 474 N -1.39 2.33 -3.57 6.31 -2.24 -1.26 -4.91 114.28 109.55 3b78 n THR 474 Ca 0.08 -3.74 -0.37 0.00 -2.27 0.00 0.00 64.05 57.74 3b78 n THR 474 Cb 0.21 -0.68 -0.06 0.00 -2.10 0.00 0.00 70.33 67.70 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 -3.40 3.70 0.90 6.98 0.00 -1.09 -5.01 121.76 123.83 3b78 s ALA 475 Ca 0.45 -0.35 -0.12 0.00 0.00 0.00 0.00 51.96 51.95 3b78 s ALA 475 Cb 0.39 -2.32 0.19 0.00 0.00 0.00 0.00 23.12 21.37 3b78 s ALA 475 CO -0.01 0.39 1.24 -1.01 0.00 0.00 0.00 175.76 176.37 3b78 s HIS 476 N -0.63 1.47 -0.30 0.00 3.76 -1.26 -4.56 115.29 113.77 3b78 s HIS 476 Ca 0.21 0.10 -0.16 0.00 -0.15 0.00 0.00 55.06 55.06 3b78 s HIS 476 Cb -0.15 -3.82 -0.02 0.00 1.11 0.00 0.00 32.58 29.70 3b78 s HIS 476 CO 0.09 -2.44 0.41 -0.80 -0.85 0.00 0.00 174.74 171.15 3b78 s ASN 477 N -4.87 6.27 -0.08 1.40 0.01 -1.26 -4.94 114.94 111.46 3b78 s ASN 477 Ca 0.73 0.14 -0.29 0.00 -0.71 0.00 0.00 52.86 52.73 3b78 s ASN 477 Cb -0.04 -2.23 -0.06 0.00 0.41 0.00 0.00 41.25 39.34 3b78 s ASN 477 CO 0.51 -0.28 1.89 -0.04 -1.51 0.00 0.00 177.10 177.67 3b78 s MET 478 N 2.15 3.87 0.00 -0.60 -1.94 -1.26 -3.54 119.30 117.97 3b78 s MET 478 Ca 0.16 2.23 0.00 0.00 -1.71 0.00 0.00 55.69 56.36 3b78 s MET 478 Cb -0.16 -4.15 0.00 0.00 2.01 0.00 0.00 34.83 32.53 3b78 s MET 478 CO 0.11 -1.24 0.00 1.63 -0.01 0.00 0.00 175.02 175.51 3b78 n LYS 479 N 7.74 0.00 -2.21 2.03 4.76 -1.24 -4.77 118.16 124.48 3b78 n LYS 479 Ca 0.21 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.26 3b78 n LYS 479 Cb 0.43 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.60 3b78 n LYS 479 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3b78 s VAL 480 N 0.00 2.95 -0.40 -0.18 -7.23 -1.26 -5.00 120.40 109.27 3b78 s VAL 480 Ca 0.00 0.85 -0.12 0.00 -1.81 0.00 0.00 61.98 60.90 3b78 s VAL 480 Cb 0.00 -3.51 0.04 0.00 0.56 0.00 0.00 36.38 33.47 3b78 s VAL 480 CO 0.00 0.13 0.26 -0.04 -0.31 0.00 0.00 175.10 175.14 3b78 s MET 481 N -2.11 2.85 -0.21 4.82 1.00 -1.26 -5.03 119.30 119.36 3b78 s MET 481 Ca 0.54 -1.14 -0.30 0.00 0.00 0.00 0.00 55.69 54.80 3b78 s MET 481 Cb -0.35 -3.85 -0.07 0.00 0.00 0.00 0.00 34.83 30.57 3b78 s MET 481 CO 0.44 -0.78 2.18 1.63 0.00 0.00 0.00 175.02 178.50 3b78 n LYS 482 N 5.05 1.93 -4.22 2.03 5.02 -1.26 -4.84 118.16 121.87 3b78 n LYS 482 Ca -0.11 0.56 -0.28 0.00 -2.02 0.00 0.00 58.31 56.45 3b78 n LYS 482 Cb 0.46 -3.08 -0.17 0.00 -0.02 0.00 0.00 35.03 32.22 3b78 n LYS 482 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3b78 s PHE 483 N 7.64 1.91 -0.06 2.13 0.08 -1.26 -4.87 117.98 123.55 3b78 s PHE 483 Ca 1.01 -0.96 0.01 0.00 0.12 0.00 0.00 56.93 57.11 3b78 s PHE 483 Cb -0.44 -1.42 -0.03 0.00 -0.57 0.00 0.00 43.02 40.56 3b78 s PHE 483 CO 0.39 -0.53 -0.07 0.45 -0.10 0.00 0.00 175.22 175.36 3b78 s SER 484 N 1.26 4.64 -0.23 1.36 0.15 -1.26 -4.98 113.70 114.64 3b78 s SER 484 Ca -0.01 -0.04 0.12 0.00 0.70 0.00 0.00 55.95 56.72 3b78 s SER 484 Cb -0.14 -1.15 0.73 0.00 -1.71 0.00 0.00 66.02 63.75 3b78 s SER 484 CO -0.05 0.35 1.65 0.55 1.20 0.00 0.00 173.24 176.94 3b78 n VAL 485 N 2.13 2.55 -2.49 4.45 3.14 -1.26 -4.88 118.33 121.96 3b78 n VAL 485 Ca -0.18 -1.30 -0.43 0.00 -2.96 0.00 0.00 64.34 59.47 3b78 n VAL 485 Cb 0.53 -0.32 -0.02 0.00 -1.06 0.00 0.00 33.84 32.97 3b78 n VAL 485 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 3b78 s SER 486 N -0.73 6.71 -0.82 6.55 0.01 -1.26 -4.93 113.70 119.23 3b78 s SER 486 Ca 0.50 1.07 -0.23 0.00 1.31 0.00 0.00 55.95 58.60 3b78 s SER 486 Cb 0.38 -2.54 -0.16 0.00 0.21 0.00 0.00 66.02 63.91 3b78 s SER 486 CO 0.14 -1.07 1.91 -2.65 0.41 0.00 0.00 173.24 171.97 3b78 n PRO 487 N 7.31 1.40 0.09 12.44 -0.02 -1.26 -4.35 135.00 150.61 3b78 n PRO 487 Ca 0.14 -1.94 -0.11 0.00 -2.02 0.00 0.00 63.50 59.57 3b78 n PRO 487 Cb 0.47 -3.10 -0.07 0.00 -0.02 0.00 0.00 33.50 30.77 3b78 n PRO 487 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3b78 h VAL 488 N 4.96 1.53 -4.34 -1.45 2.07 -1.57 -3.44 116.25 114.01 3b78 h VAL 488 Ca 0.36 -2.90 -0.70 0.00 0.82 0.00 0.00 66.70 64.28 3b78 h VAL 488 Cb 0.74 2.69 -0.27 0.00 -1.52 0.00 0.00 31.29 32.93 3b78 h VAL 488 CO 1.77 0.84 -0.84 -0.69 0.02 0.00 0.00 177.57 178.68 3b78 s VAL 489 N -2.94 2.51 0.20 2.57 1.01 -1.14 -0.68 120.40 121.93 3b78 s VAL 489 Ca -0.03 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 3b78 s VAL 489 Cb 0.09 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.54 3b78 s VAL 489 CO 0.85 0.58 0.41 0.00 0.00 0.00 0.00 175.10 176.94 3b78 s GLN 490 N -0.68 1.35 0.24 2.72 -2.07 -0.28 0.84 119.66 121.78 3b78 s GLN 490 Ca 0.11 -1.13 -0.06 0.00 -1.82 0.00 0.00 55.36 52.46 3b78 s GLN 490 Cb -0.10 0.44 -0.02 0.00 -1.09 0.00 0.00 33.01 32.24 3b78 s GLN 490 CO -0.00 -0.54 0.33 0.14 -1.32 0.00 0.00 175.29 173.89 3b78 s VAL 491 N -3.96 0.00 -0.15 3.63 -7.23 -0.35 -1.43 120.40 110.91 3b78 s VAL 491 Ca 0.17 -1.69 -0.05 0.00 -1.81 0.00 0.00 61.98 58.60 3b78 s VAL 491 Cb 0.01 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.54 3b78 s VAL 491 CO 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.82 3b78 s ALA 492 N -3.97 3.19 -0.18 1.32 0.00 -1.26 -1.39 121.76 119.48 3b78 s ALA 492 Ca 0.31 -0.79 -0.03 0.00 0.00 0.00 0.00 51.96 51.45 3b78 s ALA 492 Cb 0.03 -1.66 -0.02 0.00 0.00 0.00 0.00 23.12 21.47 3b78 s ALA 492 CO 0.12 0.28 -0.05 0.08 0.00 0.00 0.00 175.76 176.18 3b78 s VAL 493 N 0.12 3.58 -0.04 0.00 1.01 -0.33 -3.93 120.40 120.81 3b78 s VAL 493 Ca 0.01 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.51 3b78 s VAL 493 Cb -0.13 -2.58 0.01 0.00 0.00 0.00 0.00 36.38 33.69 3b78 s VAL 493 CO 0.02 0.47 0.10 -0.70 0.00 0.00 0.00 175.10 174.99 3b78 s GLU 494 N 0.78 0.11 0.20 2.72 -6.30 -1.20 -4.17 118.70 110.84 3b78 s GLU 494 Ca -0.02 0.17 -0.30 0.00 -2.50 0.00 0.00 54.97 52.32 3b78 s GLU 494 Cb -0.15 0.01 -0.08 0.00 0.00 0.00 0.00 34.13 33.91 3b78 s GLU 494 CO 0.02 -0.04 1.06 0.14 0.02 0.00 0.00 175.26 176.45 3b78 s VAL 495 N 0.25 3.88 0.19 3.70 -7.23 -1.26 -0.86 120.40 119.07 3b78 s VAL 495 Ca -0.02 1.72 0.05 0.00 -1.81 0.00 0.00 61.98 61.93 3b78 s VAL 495 Cb -0.03 -4.10 -0.13 0.00 0.56 0.00 0.00 36.38 32.69 3b78 s VAL 495 CO -0.01 0.34 1.42 0.50 -0.31 0.00 0.00 175.10 177.04 3b78 h LYS 496 N 4.70 0.11 -4.85 4.82 3.64 -1.44 -3.42 116.57 120.13 3b78 h LYS 496 Ca -0.45 -0.12 -0.66 0.00 -1.27 0.00 0.00 60.65 58.16 3b78 h LYS 496 Cb 1.21 0.03 -0.19 0.00 -0.41 0.00 0.00 32.23 32.87 3b78 h LYS 496 CO 0.70 0.87 -0.54 -0.80 -2.27 0.00 0.00 179.45 177.41 3b78 s ASN 497 N -6.87 5.76 0.31 4.20 0.01 -1.26 -4.99 114.94 112.11 3b78 s ASN 497 Ca -0.02 -0.22 0.01 0.00 -0.71 0.00 0.00 52.86 51.92 3b78 s ASN 497 Cb 0.11 -2.06 0.51 0.00 0.41 0.00 0.00 41.25 40.21 3b78 s ASN 497 CO 0.81 -0.11 1.88 0.00 -1.51 0.00 0.00 177.10 178.17 3b78 h ALA 498 N 8.36 1.33 0.00 0.60 0.00 -1.99 -2.64 119.26 124.92 3b78 h ALA 498 Ca -0.34 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.33 3b78 h ALA 498 Cb 1.17 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3b78 h ALA 498 CO 0.58 0.48 -0.28 -2.95 0.00 0.00 0.00 179.25 177.09 3b78 h ASN 499 N 0.72 0.00 -0.46 0.00 -1.07 -1.98 -2.82 115.58 109.97 3b78 h ASN 499 Ca 0.16 0.00 -0.23 0.00 0.07 0.00 0.00 56.30 56.31 3b78 h ASN 499 Cb 0.23 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 36.35 3b78 h ASN 499 CO -0.01 0.28 0.29 0.47 0.07 0.00 0.00 177.43 178.53 3b78 n ASP 500 N -3.90 3.35 0.03 6.14 8.00 -0.99 -4.46 116.55 124.72 3b78 n ASP 500 Ca -0.02 -2.74 -0.13 0.00 0.71 0.00 0.00 54.79 52.62 3b78 n ASP 500 Cb 0.36 -0.66 -0.09 0.00 -0.02 0.00 0.00 41.12 40.71 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 1.08 -0.06 -2.45 0.64 6.46 -1.62 -3.09 115.31 116.27 3b78 h LEU 501 Ca 0.28 -0.33 0.01 0.00 -0.12 0.00 0.00 57.88 57.72 3b78 h LEU 501 Cb 1.84 0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 41.78 3b78 h LEU 501 CO 0.50 0.30 0.06 -0.65 -0.62 0.00 0.00 178.44 178.04 3b78 h PRO 502 N -0.44 0.00 -0.08 5.25 0.11 -1.87 -1.64 132.00 133.33 3b78 h PRO 502 Ca -0.01 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.98 3b78 h PRO 502 Cb 0.39 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 3b78 h PRO 502 CO 0.01 0.00 -0.49 0.87 -0.21 0.00 0.00 178.00 178.18 3b78 h LYS 503 N 0.00 0.21 -0.13 1.05 1.57 -1.87 -2.96 116.57 114.44 3b78 h LYS 503 Ca 0.02 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.59 3b78 h LYS 503 Cb 0.14 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3b78 h LYS 503 CO -0.00 0.66 -0.30 1.25 -0.57 0.00 0.00 179.45 180.49 3b78 h LEU 504 N 0.17 0.49 -1.93 2.94 5.85 -1.33 -1.64 115.31 119.86 3b78 h LEU 504 Ca 0.01 -0.57 0.08 0.00 0.84 0.00 0.00 57.88 58.24 3b78 h LEU 504 Cb 0.93 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 3b78 h LEU 504 CO 0.07 0.97 0.24 0.58 -0.34 0.00 0.00 178.44 179.97 3b78 h VAL 505 N 0.03 0.87 0.20 1.05 2.07 -1.51 -0.80 116.25 118.15 3b78 h VAL 505 Ca -0.00 -0.03 -0.31 0.00 0.82 0.00 0.00 66.70 67.18 3b78 h VAL 505 Cb 0.90 0.78 0.02 0.00 -1.52 0.00 0.00 31.29 31.47 3b78 h VAL 505 CO 0.07 0.02 -1.38 -0.08 0.02 0.00 0.00 177.57 176.21 3b78 h GLU 506 N 0.08 0.41 -0.69 1.57 4.57 -1.43 -3.25 114.58 115.85 3b78 h GLU 506 Ca 0.16 -0.71 -0.05 0.00 -1.18 0.00 0.00 59.36 57.58 3b78 h GLU 506 Cb 0.53 0.26 -0.03 0.00 -0.16 0.00 0.00 28.75 29.35 3b78 h GLU 506 CO -0.01 1.34 0.23 0.78 -1.18 0.00 0.00 179.01 180.17 3b78 h GLY 507 N 0.85 1.13 0.80 1.92 0.00 -0.19 -1.06 103.07 106.51 3b78 h GLY 507 Ca -0.20 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 46.48 3b78 h GLY 507 CO 0.24 0.60 0.02 1.41 0.00 0.00 0.00 176.54 178.81 3b78 h LEU 508 N 1.02 0.14 -1.64 3.11 3.38 -1.35 -0.06 115.31 119.90 3b78 h LEU 508 Ca 0.23 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 3b78 h LEU 508 Cb 0.26 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3b78 h LEU 508 CO -0.01 0.34 -0.19 0.11 0.09 0.00 0.00 178.44 178.78 3b78 h LYS 509 N -0.07 0.00 0.00 1.13 1.57 -1.56 -1.24 116.57 116.40 3b78 h LYS 509 Ca 0.03 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 3b78 h LYS 509 Cb 0.25 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 3b78 h LYS 509 CO 0.00 0.19 -0.16 -0.09 -0.57 0.00 0.00 179.45 178.82 3b78 h ARG 510 N 0.00 0.00 0.10 3.15 2.43 -0.86 -3.23 114.38 115.98 3b78 h ARG 510 Ca -0.00 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.89 3b78 h ARG 510 Cb 0.34 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 3b78 h ARG 510 CO 0.02 0.16 -1.36 1.25 -1.51 0.00 0.00 179.97 178.54 3b78 h LEU 511 N 0.00 0.35 -1.12 3.80 5.85 0.13 -3.23 115.31 121.09 3b78 h LEU 511 Ca -0.00 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3b78 h LEU 511 Cb 1.02 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.93 3b78 h LEU 511 CO 0.02 1.34 0.00 0.28 -0.34 0.00 0.00 178.44 179.74 3b78 h SER 512 N 0.06 0.00 0.73 1.25 0.02 -1.38 -2.41 113.55 111.82 3b78 h SER 512 Ca -0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 3b78 h SER 512 Cb 1.97 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.51 3b78 h SER 512 CO 0.17 0.00 -0.89 0.29 -1.14 0.00 0.00 176.83 175.27 3b78 n LYS 513 N -2.74 0.37 0.00 3.45 5.02 -1.22 -3.86 118.16 119.18 3b78 n LYS 513 Ca 0.01 0.06 0.12 0.00 -2.02 0.00 0.00 58.31 56.48 3b78 n LYS 513 Cb 0.28 -1.68 0.16 0.00 -0.02 0.00 0.00 35.03 33.77 3b78 n LYS 513 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3b78 n SER 514 N -2.20 2.05 -3.46 4.39 3.41 -0.93 -4.81 113.62 112.07 3b78 n SER 514 Ca 0.02 -1.54 0.01 0.00 -0.26 0.00 0.00 58.87 57.10 3b78 n SER 514 Cb 0.47 0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.61 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 -2.29 -1.16 0.14 4.04 -1.08 -1.10 -4.88 116.67 110.34 3b78 s ASP 515 Ca 0.25 1.26 0.20 0.00 -0.52 0.00 0.00 52.55 53.74 3b78 s ASP 515 Cb 0.19 2.19 0.82 0.00 -1.46 0.00 0.00 42.92 44.66 3b78 s ASP 515 CO 0.46 -0.22 1.60 -2.65 0.52 0.00 0.00 175.17 174.88 3b78 n PRO 516 N 5.41 0.10 -0.07 4.34 -0.02 -1.26 -3.28 135.00 140.22 3b78 n PRO 516 Ca -0.08 0.34 -0.10 0.00 -2.02 0.00 0.00 63.50 61.63 3b78 n PRO 516 Cb 0.50 -1.70 -0.15 0.00 -0.02 0.00 0.00 33.50 32.13 3b78 n PRO 516 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3b78 s VAL 518 N -2.53 3.25 -0.11 0.00 0.11 -1.20 -4.75 120.40 115.16 3b78 s VAL 518 Ca -0.10 1.12 0.00 0.00 -2.93 0.00 0.00 61.98 60.07 3b78 s VAL 518 Cb 0.07 -3.66 0.02 0.00 -1.53 0.00 0.00 36.38 31.28 3b78 s VAL 518 CO 0.81 0.16 -0.11 -0.22 -3.33 0.00 0.00 175.10 172.42 3b78 s LEU 519 N -2.14 1.43 -0.25 2.54 2.96 -0.92 -4.80 118.68 117.50 3b78 s LEU 519 Ca 0.53 -0.36 0.02 0.00 -0.22 0.00 0.00 54.13 54.10 3b78 s LEU 519 Cb -0.31 -0.95 0.05 0.00 0.50 0.00 0.00 46.19 45.48 3b78 s LEU 519 CO 0.40 -0.07 -0.11 0.42 -1.32 0.00 0.00 176.35 175.68 3b78 s THR 520 N 1.42 2.28 0.29 3.68 -4.23 -1.26 -0.82 115.64 116.99 3b78 s THR 520 Ca 0.01 -1.50 0.03 0.00 -1.18 0.00 0.00 61.69 59.04 3b78 s THR 520 Cb -0.13 -2.29 -0.04 0.00 1.34 0.00 0.00 72.50 71.38 3b78 s THR 520 CO -0.06 0.04 0.17 -0.72 -0.54 0.00 0.00 174.62 173.51 3b78 s TYR 521 N 1.15 1.54 0.03 3.99 -0.85 -0.89 -4.95 117.35 117.36 3b78 s TYR 521 Ca -0.07 -1.43 0.07 0.00 -0.52 0.00 0.00 57.07 55.12 3b78 s TYR 521 Cb -0.19 -0.77 -0.03 0.00 0.38 0.00 0.00 41.96 41.35 3b78 s TYR 521 CO -0.05 -0.61 -0.17 -1.64 -1.52 0.00 0.00 175.55 171.55 3b78 s MET 522 N -3.82 2.14 0.47 -3.49 -1.94 -1.26 0.12 119.30 111.52 3b78 s MET 522 Ca 0.37 -0.94 0.01 0.00 -1.71 0.00 0.00 55.69 53.43 3b78 s MET 522 Cb 0.05 -2.22 0.09 0.00 2.01 0.00 0.00 34.83 34.76 3b78 s MET 522 CO 0.18 0.55 0.65 -1.13 -0.01 0.00 0.00 175.02 175.26 3b78 n SER 523 N 1.67 1.01 0.24 3.03 3.41 -0.61 -4.96 113.62 117.42 3b78 n SER 523 Ca -0.16 -1.82 0.13 0.00 -0.26 0.00 0.00 58.87 56.75 3b78 n SER 523 Cb 0.52 -0.40 0.54 0.00 -0.26 0.00 0.00 64.21 64.61 3b78 n SER 523 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3b78 h GLU 524 N 0.00 0.00 0.00 4.33 5.08 -2.01 -2.01 114.58 119.97 3b78 h GLU 524 Ca -0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 3b78 h GLU 524 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 3b78 h GLU 524 CO 0.24 0.14 0.00 -1.13 -1.00 0.00 0.00 179.01 177.27 3b78 n SER 525 N -3.30 0.00 0.00 1.42 3.41 -1.26 -4.87 113.62 109.02 3b78 n SER 525 Ca 0.00 -0.66 0.00 0.00 -0.26 0.00 0.00 58.87 57.95 3b78 n SER 525 Cb 0.38 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 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 0.92 1.71 3.76 5.00 0.00 -0.75 -5.01 105.19 110.82 3b78 n GLY 526 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3b78 n GLY 526 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3b78 s GLU 527 N -0.22 4.35 0.01 1.61 2.02 -1.26 -4.70 118.70 120.51 3b78 s GLU 527 Ca 0.00 2.21 -0.22 0.00 0.02 0.00 0.00 54.97 56.98 3b78 s GLU 527 Cb 0.00 -3.09 -0.05 0.00 0.10 0.00 0.00 34.13 31.09 3b78 s GLU 527 CO 0.00 -0.22 0.65 -1.01 0.02 0.00 0.00 175.26 174.70 3b78 s HIS 528 N -0.90 3.70 0.11 1.61 3.76 -1.26 -1.58 115.29 120.73 3b78 s HIS 528 Ca 0.51 1.29 0.10 0.00 -0.15 0.00 0.00 55.06 56.80 3b78 s HIS 528 Cb -0.40 -2.68 -0.04 0.00 1.11 0.00 0.00 32.58 30.58 3b78 s HIS 528 CO 0.50 0.33 -0.24 0.42 -0.85 0.00 0.00 174.74 174.90 3b78 s ILE 529 N -0.15 1.98 -0.15 0.60 -1.09 0.12 -1.18 121.20 121.33 3b78 s ILE 529 Ca 0.33 -1.62 -0.02 0.00 -2.23 0.00 0.00 60.65 57.11 3b78 s ILE 529 Cb -0.19 -1.77 0.05 0.00 -1.58 0.00 0.00 42.46 38.97 3b78 s ILE 529 CO 0.19 0.04 0.02 -0.69 -1.23 0.00 0.00 174.94 173.26 3b78 s VAL 530 N -1.08 0.53 0.24 2.92 1.01 -0.48 -2.09 120.40 121.43 3b78 s VAL 530 Ca 0.10 -0.33 0.09 0.00 0.00 0.00 0.00 61.98 61.84 3b78 s VAL 530 Cb -0.10 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 3b78 s VAL 530 CO 0.05 -0.01 0.02 0.00 0.00 0.00 0.00 175.10 175.15 3b78 s ALA 531 N 1.88 3.21 0.00 5.51 0.00 -0.00 -1.21 121.76 131.16 3b78 s ALA 531 Ca 0.01 -1.55 0.00 0.00 0.00 0.00 0.00 51.96 50.42 3b78 s ALA 531 Cb -0.15 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.08 3b78 s ALA 531 CO -0.07 0.32 0.00 0.41 0.00 0.00 0.00 175.76 176.42 3b78 n GLY 532 N -0.72 3.63 0.10 0.00 0.00 0.25 -2.18 105.19 106.26 3b78 n GLY 532 Ca -0.08 -1.53 0.02 0.00 0.00 0.00 0.00 46.02 44.44 3b78 n GLY 532 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3b78 n THR 533 N 0.00 1.08 -3.44 2.61 -1.04 -1.26 -1.65 114.28 110.57 3b78 n THR 533 Ca 0.00 -0.67 -0.03 0.00 -2.04 0.00 0.00 64.05 61.31 3b78 n THR 533 Cb 0.00 -0.66 0.01 0.00 -1.82 0.00 0.00 70.33 67.87 3b78 n THR 533 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3b78 n GLY 534 N 1.37 1.36 0.05 3.41 0.00 -1.26 -4.64 105.19 105.48 3b78 n GLY 534 Ca -0.09 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 3b78 n GLY 534 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3b78 h GLU 535 N 0.00 -0.02 0.55 1.61 4.81 -1.95 -2.47 114.58 117.10 3b78 h GLU 535 Ca -0.14 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.07 3b78 h GLU 535 Cb 0.53 0.01 0.01 0.00 0.63 0.00 0.00 28.75 29.92 3b78 h GLU 535 CO 0.18 -0.01 -0.27 1.25 -0.73 0.00 0.00 179.01 179.43 3b78 h LEU 536 N -0.03 -0.63 -0.87 1.64 5.85 -1.98 -2.55 115.31 116.74 3b78 h LEU 536 Ca -0.00 -0.05 0.23 0.00 0.84 0.00 0.00 57.88 58.90 3b78 h LEU 536 Cb 0.03 0.16 -0.14 0.00 0.37 0.00 0.00 40.66 41.08 3b78 h LEU 536 CO 0.00 -0.28 0.20 -0.74 -0.34 0.00 0.00 178.44 177.28 3b78 h HIS 537 N -1.00 0.28 -0.51 1.25 2.76 -1.95 0.23 115.15 116.21 3b78 h HIS 537 Ca -0.08 0.05 -0.12 0.00 -2.20 0.00 0.00 60.37 58.02 3b78 h HIS 537 Cb 0.64 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.60 3b78 h HIS 537 CO 0.00 -0.23 -0.16 1.25 -1.30 0.00 0.00 177.93 177.49 3b78 h LEU 538 N 0.18 1.03 -0.38 0.26 5.85 -1.45 -3.08 115.31 117.72 3b78 h LEU 538 Ca 0.54 -0.38 0.06 0.00 0.84 0.00 0.00 57.88 58.95 3b78 h LEU 538 Cb 1.09 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.78 3b78 h LEU 538 CO -0.68 1.17 0.03 -0.08 -0.34 0.00 0.00 178.44 178.55 3b78 h GLU 539 N 0.88 0.14 0.21 1.25 4.57 -0.12 -2.20 114.58 119.31 3b78 h GLU 539 Ca 0.12 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 3b78 h GLU 539 Cb 0.74 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.30 3b78 h GLU 539 CO 0.06 0.09 -0.10 0.82 -1.18 0.00 0.00 179.01 178.70 3b78 h ILE 540 N 0.14 0.81 -0.31 2.32 5.03 -1.43 -2.68 117.51 121.39 3b78 h ILE 540 Ca 0.18 -0.08 0.09 0.00 -0.12 0.00 0.00 64.86 64.93 3b78 h ILE 540 Cb 0.24 0.86 -0.01 0.00 -3.03 0.00 0.00 36.82 34.88 3b78 h ILE 540 CO -0.28 0.02 0.25 0.00 -0.68 0.00 0.00 178.15 177.46 3b78 h LEU 542 N 0.00 0.55 0.41 0.00 3.38 -1.08 -2.82 115.31 115.76 3b78 h LEU 542 Ca 0.15 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 57.56 3b78 h LEU 542 Cb 0.65 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3b78 h LEU 542 CO -0.00 0.99 -0.20 1.56 0.09 0.00 0.00 178.44 180.88 3b78 h GLN 543 N 0.14 -0.53 -0.28 1.13 4.20 -0.95 -2.54 115.11 116.28 3b78 h GLN 543 Ca 0.01 0.04 0.08 0.00 0.06 0.00 0.00 58.65 58.84 3b78 h GLN 543 Cb 0.88 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.77 3b78 h GLN 543 CO 0.07 -0.32 0.20 -0.44 -0.67 0.00 0.00 178.83 177.67 3b78 h ASP 544 N -0.61 0.00 -0.10 1.46 5.19 -1.46 -1.86 116.42 119.04 3b78 h ASP 544 Ca -0.06 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.16 3b78 h ASP 544 Cb 0.46 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.98 3b78 h ASP 544 CO 0.09 0.00 -0.71 0.25 -3.12 0.00 0.00 179.24 175.76 3b78 h LEU 545 N 0.00 0.79 -0.47 1.55 5.85 -1.29 -0.16 115.31 121.57 3b78 h LEU 545 Ca 0.13 -0.66 -0.02 0.00 0.84 0.00 0.00 57.88 58.17 3b78 h LEU 545 Cb 0.54 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.33 3b78 h LEU 545 CO -0.00 1.33 -0.10 -0.08 -0.34 0.00 0.00 178.44 179.25 3b78 h GLU 546 N 0.30 0.00 0.00 1.25 4.81 -0.94 -0.76 114.58 119.24 3b78 h GLU 546 Ca -0.06 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.88 3b78 h GLU 546 Cb 1.35 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.68 3b78 h GLU 546 CO 0.14 0.10 -2.10 0.72 -0.73 0.00 0.00 179.01 177.15 3b78 n HIS 547 N -3.15 0.00 0.00 0.92 8.25 -0.79 -2.83 115.22 117.62 3b78 n HIS 547 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 3b78 n HIS 547 Cb 0.50 -0.76 0.00 0.00 1.12 0.00 0.00 29.99 30.85 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 -2.88 0.00 -0.27 0.41 8.00 -0.12 -4.19 116.55 117.49 3b78 n ASP 548 Ca -0.31 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.24 3b78 n ASP 548 Cb 0.92 -0.07 0.15 0.00 -0.02 0.00 0.00 41.12 42.11 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 0.00 -0.17 0.00 1.24 3.86 -1.52 -3.22 115.15 115.34 3b78 h HIS 549 Ca 0.00 0.06 -0.29 0.00 -1.16 0.00 0.00 60.37 58.99 3b78 h HIS 549 Cb 0.00 0.20 -0.05 0.00 1.06 0.00 0.00 27.41 28.62 3b78 h HIS 549 CO 0.00 -0.30 -2.02 0.00 0.86 0.00 0.00 177.93 176.48 3b78 n ALA 550 N -3.09 1.71 -3.36 2.45 0.00 -0.30 -3.87 120.51 114.05 3b78 n ALA 550 Ca 0.14 -0.74 -0.19 0.00 0.00 0.00 0.00 53.44 52.65 3b78 n ALA 550 Cb 0.49 0.18 0.06 0.00 0.00 0.00 0.00 19.45 20.17 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 2.26 -0.24 2.95 0.00 0.00 -1.18 -4.83 105.19 104.15 3b78 n GLY 551 Ca -0.34 0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.57 3b78 n GLY 551 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b78 s VAL 552 N -3.25 0.49 -0.38 1.61 1.01 -1.13 -4.96 120.40 113.80 3b78 s VAL 552 Ca 0.46 -0.22 -0.34 0.00 0.00 0.00 0.00 61.98 61.88 3b78 s VAL 552 Cb -0.20 -0.45 -0.11 0.00 0.00 0.00 0.00 36.38 35.62 3b78 s VAL 552 CO 0.57 0.16 2.22 -2.65 0.00 0.00 0.00 175.10 175.41 3b78 n PRO 553 N 3.24 1.06 -4.23 2.72 -0.02 -1.26 -4.77 135.00 131.74 3b78 n PRO 553 Ca -0.17 0.27 -0.31 0.00 -2.02 0.00 0.00 63.50 61.27 3b78 n PRO 553 Cb 0.56 -2.50 -0.09 0.00 -0.02 0.00 0.00 33.50 31.45 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 7.67 3.43 -0.29 2.45 1.43 -1.26 -1.09 118.68 131.02 3b78 s LEU 554 Ca 1.10 -0.12 0.00 0.00 -1.03 0.00 0.00 54.13 54.08 3b78 s LEU 554 Cb -0.82 -2.07 0.06 0.00 0.03 0.00 0.00 46.19 43.38 3b78 s LEU 554 CO 0.47 0.23 -0.03 -0.75 0.23 0.00 0.00 176.35 176.50 3b78 s LYS 555 N -1.92 2.27 0.00 1.70 2.20 -0.04 -4.86 119.74 119.08 3b78 s LYS 555 Ca 0.22 -1.37 0.00 0.00 -0.36 0.00 0.00 55.97 54.46 3b78 s LYS 555 Cb -0.12 -3.10 0.00 0.00 -1.51 0.00 0.00 37.83 33.11 3b78 s LYS 555 CO 0.14 -0.65 0.00 -0.89 -0.36 0.00 0.00 175.35 173.59 3b78 n ILE 556 N 4.52 0.00 -3.47 5.43 2.08 -1.26 -3.23 119.36 123.44 3b78 n ILE 556 Ca -0.12 0.00 -0.10 0.00 0.56 0.00 0.00 62.75 63.09 3b78 n ILE 556 Cb 0.43 0.00 -0.02 0.00 -0.75 0.00 0.00 39.64 39.30 3b78 n ILE 556 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 3b78 s SER 557 N -1.00 -0.48 0.78 4.38 1.04 -1.25 -4.91 113.70 112.25 3b78 s SER 557 Ca 0.00 -0.02 -0.16 0.00 0.48 0.00 0.00 55.95 56.25 3b78 s SER 557 Cb 0.00 0.53 -0.05 0.00 0.10 0.00 0.00 66.02 66.59 3b78 s SER 557 CO 0.00 -0.86 0.23 -2.65 0.98 0.00 0.00 173.24 170.95 3b78 n PRO 558 N -0.34 0.11 -2.07 4.02 -0.02 -1.26 -4.74 135.00 130.71 3b78 n PRO 558 Ca -0.14 0.07 -0.43 0.00 -2.02 0.00 0.00 63.50 60.98 3b78 n PRO 558 Cb 0.64 -1.62 -0.03 0.00 -0.02 0.00 0.00 33.50 32.47 3b78 n PRO 558 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3b78 s PRO 559 N -2.62 3.49 -0.07 0.52 0.04 -1.26 -4.81 135.00 130.28 3b78 s PRO 559 Ca 0.59 1.45 -0.12 0.00 0.04 0.00 0.00 61.00 62.95 3b78 s PRO 559 Cb -0.31 -4.13 -0.05 0.00 0.04 0.00 0.00 34.50 30.04 3b78 s PRO 559 CO 0.64 -1.66 0.30 0.08 0.04 0.00 0.00 177.00 176.40 3b78 s VAL 560 N 6.25 5.23 0.05 -0.36 1.01 -0.51 -4.94 120.40 127.13 3b78 s VAL 560 Ca 0.76 0.59 -0.20 0.00 0.00 0.00 0.00 61.98 63.13 3b78 s VAL 560 Cb -0.22 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.49 3b78 s VAL 560 CO 0.33 0.54 0.59 -0.69 0.00 0.00 0.00 175.10 175.87 3b78 s VAL 561 N -0.69 4.78 -0.11 2.92 1.01 -1.26 -1.12 120.40 125.92 3b78 s VAL 561 Ca 0.20 1.25 -0.20 0.00 0.00 0.00 0.00 61.98 63.22 3b78 s VAL 561 Cb -0.14 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 3b78 s VAL 561 CO 0.08 0.51 0.57 0.00 0.00 0.00 0.00 175.10 176.26 3b78 s ALA 562 N -0.79 3.44 0.49 5.51 0.00 0.14 -4.96 121.76 125.58 3b78 s ALA 562 Ca 0.30 -0.11 0.05 0.00 0.00 0.00 0.00 51.96 52.21 3b78 s ALA 562 Cb -0.19 -2.79 -0.00 0.00 0.00 0.00 0.00 23.12 20.14 3b78 s ALA 562 CO 0.19 -0.12 0.26 0.71 0.00 0.00 0.00 175.76 176.81 3b78 s TYR 563 N 0.87 2.07 0.17 0.00 2.02 -1.26 -4.43 117.35 116.79 3b78 s TYR 563 Ca 0.30 -0.75 0.11 0.00 -0.37 0.00 0.00 57.07 56.35 3b78 s TYR 563 Cb -0.16 -1.90 -0.04 0.00 -0.40 0.00 0.00 41.96 39.46 3b78 s TYR 563 CO 0.13 -0.12 -0.24 1.03 -1.57 0.00 0.00 175.55 174.78 3b78 s ARG 564 N -4.08 1.44 -0.13 -0.62 1.81 -0.62 -4.07 118.95 112.68 3b78 s ARG 564 Ca 0.33 -1.46 -0.01 0.00 -1.72 0.00 0.00 55.73 52.87 3b78 s ARG 564 Cb 0.00 -1.75 -0.02 0.00 -0.45 0.00 0.00 34.95 32.73 3b78 s ARG 564 CO 0.19 0.38 -0.11 -1.21 -0.68 0.00 0.00 175.30 173.88 3b78 s GLU 565 N -2.54 3.38 0.29 3.54 2.02 0.12 -0.84 118.70 124.67 3b78 s GLU 565 Ca 0.18 -0.64 0.02 0.00 0.02 0.00 0.00 54.97 54.55 3b78 s GLU 565 Cb -0.08 -2.68 -0.03 0.00 0.10 0.00 0.00 34.13 31.44 3b78 s GLU 565 CO 0.08 0.26 0.29 -0.08 0.02 0.00 0.00 175.26 175.83 3b78 s THR 566 N 0.25 0.00 0.10 3.63 -1.32 0.00 -0.17 115.64 118.12 3b78 s THR 566 Ca -0.07 -1.89 0.07 0.00 -1.21 0.00 0.00 61.69 58.59 3b78 s THR 566 Cb -0.15 -2.51 -0.03 0.00 -1.51 0.00 0.00 72.50 68.29 3b78 s THR 566 CO 0.05 0.00 -0.19 0.68 -2.21 0.00 0.00 174.62 172.95 3b78 s VAL 567 N -3.60 1.53 -0.74 5.08 -7.23 -1.26 -0.66 120.40 113.51 3b78 s VAL 567 Ca 0.37 -1.50 0.07 0.00 -1.81 0.00 0.00 61.98 59.12 3b78 s VAL 567 Cb 0.03 -1.43 0.17 0.00 0.56 0.00 0.00 36.38 35.71 3b78 s VAL 567 CO 0.21 -0.13 1.04 -0.62 -0.31 0.00 0.00 175.10 175.29 3b78 n GLU 568 N 1.09 2.03 -2.70 4.82 1.02 -0.79 -4.41 120.64 121.71 3b78 n GLU 568 Ca -0.20 -1.60 -0.04 0.00 -0.02 0.00 0.00 57.16 55.30 3b78 n GLU 568 Cb 0.54 -1.17 0.02 0.00 -0.02 0.00 0.00 31.44 30.80 3b78 n GLU 568 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3b78 n SER 569 N 0.27 -1.27 -4.83 1.62 3.41 -1.09 -4.90 113.62 106.84 3b78 n SER 569 Ca 0.07 -1.83 -0.34 0.00 -0.26 0.00 0.00 58.87 56.51 3b78 n SER 569 Cb 0.32 2.10 -0.06 0.00 -0.26 0.00 0.00 64.21 66.31 3b78 n SER 569 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3b78 s GLU 570 N -2.05 4.15 0.02 4.33 2.12 -1.26 -4.06 118.70 121.96 3b78 s GLU 570 Ca 0.10 0.81 -0.37 0.00 0.36 0.00 0.00 54.97 55.88 3b78 s GLU 570 Cb -0.03 -2.62 -0.16 0.00 0.26 0.00 0.00 34.13 31.58 3b78 s GLU 570 CO 0.06 0.25 1.48 0.43 -0.54 0.00 0.00 175.26 176.94 3b78 n SER 571 N 0.13 2.11 0.11 -1.70 7.64 -0.61 -4.58 113.62 116.72 3b78 n SER 571 Ca 0.01 1.10 0.16 0.00 1.01 0.00 0.00 58.87 61.15 3b78 n SER 571 Cb 0.52 -1.23 0.71 0.00 -1.01 0.00 0.00 64.21 63.20 3b78 n SER 571 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3b78 h SER 572 N 5.50 0.00 -5.26 6.43 4.64 -1.37 -3.43 113.55 120.05 3b78 h SER 572 Ca -0.47 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.78 3b78 h SER 572 Cb 1.32 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.31 3b78 h SER 572 CO 0.84 0.00 -0.16 0.00 -0.87 0.00 0.00 176.83 176.63 3b78 s GLN 573 N -4.94 1.48 0.12 4.77 -2.07 -1.26 -5.14 119.66 112.63 3b78 s GLN 573 Ca -0.05 -1.26 -0.31 0.00 -1.82 0.00 0.00 55.36 51.92 3b78 s GLN 573 Cb 0.18 0.45 -0.08 0.00 -1.09 0.00 0.00 33.01 32.47 3b78 s GLN 573 CO 0.67 -0.61 1.40 0.99 -1.32 0.00 0.00 175.29 176.43 3b78 s THR 574 N -4.02 3.24 0.00 3.63 2.01 -1.26 -4.93 115.64 114.31 3b78 s THR 574 Ca 0.23 0.90 -0.21 0.00 0.31 0.00 0.00 61.69 62.92 3b78 s THR 574 Cb 0.00 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.88 3b78 s THR 574 CO 0.08 0.07 0.61 0.00 -0.69 0.00 0.00 174.62 174.69 3b78 s ALA 575 N 1.06 3.48 -0.00 7.40 0.00 -0.34 -4.94 121.76 128.42 3b78 s ALA 575 Ca 0.65 0.05 0.03 0.00 0.00 0.00 0.00 51.96 52.69 3b78 s ALA 575 Cb -0.37 -2.76 -0.01 0.00 0.00 0.00 0.00 23.12 19.97 3b78 s ALA 575 CO 0.31 0.16 -0.10 -1.17 0.00 0.00 0.00 175.76 174.96 3b78 s LEU 576 N -0.20 2.05 -0.08 0.00 2.96 -1.26 -1.42 118.68 120.73 3b78 s LEU 576 Ca 0.32 -0.22 -0.11 0.00 -0.22 0.00 0.00 54.13 53.89 3b78 s LEU 576 Cb -0.18 -0.51 0.02 0.00 0.50 0.00 0.00 46.19 46.02 3b78 s LEU 576 CO 0.18 0.10 0.28 -0.55 -1.32 0.00 0.00 176.35 175.04 3b78 s SER 577 N -0.39 -0.25 0.17 3.68 0.15 -1.12 -0.35 113.70 115.59 3b78 s SER 577 Ca 0.03 0.42 0.05 0.00 0.70 0.00 0.00 55.95 57.15 3b78 s SER 577 Cb -0.05 0.51 -0.04 0.00 -1.71 0.00 0.00 66.02 64.73 3b78 s SER 577 CO -0.00 -0.19 0.15 -0.54 1.20 0.00 0.00 173.24 173.86 3b78 s LYS 578 N -0.25 2.94 0.72 5.44 1.02 -1.26 -2.28 119.74 126.07 3b78 s LYS 578 Ca -0.04 -0.85 -0.11 0.00 0.02 0.00 0.00 55.97 54.99 3b78 s LYS 578 Cb -0.03 -2.67 0.02 0.00 -0.52 0.00 0.00 37.83 34.63 3b78 s LYS 578 CO 0.01 0.49 1.07 -1.54 -0.92 0.00 0.00 175.35 174.45 3b78 s SER 579 N -3.13 5.21 0.23 2.83 1.04 -0.61 -4.64 113.70 114.63 3b78 s SER 579 Ca 0.31 1.54 -0.07 0.00 0.48 0.00 0.00 55.95 58.21 3b78 s SER 579 Cb -0.10 -2.39 0.38 0.00 0.10 0.00 0.00 66.02 64.01 3b78 s SER 579 CO 0.24 -1.54 1.70 -0.65 0.98 0.00 0.00 173.24 173.96 3b78 h PRO 580 N -0.79 0.27 0.00 4.02 0.11 -1.89 0.15 132.00 133.87 3b78 h PRO 580 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3b78 h PRO 580 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3b78 h PRO 580 CO 0.57 0.18 0.00 0.27 -0.21 0.00 0.00 178.00 178.81 3b78 n ASN 581 N -5.13 0.10 -1.29 -2.05 0.23 -1.26 -4.89 115.26 100.97 3b78 n ASN 581 Ca 0.12 0.52 -0.12 0.00 -0.53 0.00 0.00 54.58 54.56 3b78 n ASN 581 Cb 0.39 -0.54 -0.02 0.00 -2.08 0.00 0.00 39.78 37.53 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 -1.61 -0.95 0.00 -3.83 5.02 0.53 -4.88 118.16 112.44 3b78 n LYS 582 Ca 0.04 0.68 0.06 0.00 -2.02 0.00 0.00 58.31 57.07 3b78 n LYS 582 Cb 0.22 -4.82 -0.07 0.00 -0.02 0.00 0.00 35.03 30.35 3b78 n LYS 582 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3b78 n HIS 583 N -3.68 0.00 -5.04 2.13 8.25 -1.26 -4.91 115.22 110.71 3b78 n HIS 583 Ca -0.14 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.02 3b78 n HIS 583 Cb 0.56 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.52 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 -2.11 2.94 0.03 0.41 0.01 -1.26 -3.58 114.94 111.38 3b78 s ASN 584 Ca 0.05 -0.51 0.02 0.00 -0.71 0.00 0.00 52.86 51.70 3b78 s ASN 584 Cb 0.09 -0.29 -0.02 0.00 0.41 0.00 0.00 41.25 41.44 3b78 s ASN 584 CO 0.48 0.27 -0.06 -0.13 -1.51 0.00 0.00 177.10 176.15 3b78 s ARG 585 N -0.90 0.46 -0.07 -0.60 0.52 -0.43 -1.57 118.95 116.35 3b78 s ARG 585 Ca 0.10 -0.55 -0.01 0.00 -0.52 0.00 0.00 55.73 54.75 3b78 s ARG 585 Cb -0.10 -0.28 0.03 0.00 0.52 0.00 0.00 34.95 35.12 3b78 s ARG 585 CO 0.01 0.06 -0.02 0.42 0.02 0.00 0.00 175.30 175.79 3b78 s ILE 586 N -0.97 0.49 -0.14 1.52 1.01 -0.97 -1.84 121.20 120.31 3b78 s ILE 586 Ca -0.07 0.03 -0.05 0.00 0.00 0.00 0.00 60.65 60.56 3b78 s ILE 586 Cb -0.07 -0.61 -0.04 0.00 0.01 0.00 0.00 42.46 41.75 3b78 s ILE 586 CO 0.00 0.27 0.03 -0.31 0.00 0.00 0.00 174.94 174.93 3b78 s TYR 587 N 1.79 3.21 0.23 3.97 2.02 -0.26 -2.77 117.35 125.54 3b78 s TYR 587 Ca 0.03 0.09 -0.16 0.00 -0.37 0.00 0.00 57.07 56.66 3b78 s TYR 587 Cb -0.13 -1.95 0.01 0.00 -0.40 0.00 0.00 41.96 39.50 3b78 s TYR 587 CO -0.05 0.28 0.52 -0.48 -1.57 0.00 0.00 175.55 174.25 3b78 s LEU 588 N -0.18 0.17 -0.03 -1.29 0.05 -0.50 -0.84 118.68 116.06 3b78 s LEU 588 Ca 0.06 -0.70 -0.02 0.00 0.05 0.00 0.00 54.13 53.52 3b78 s LEU 588 Cb -0.12 2.04 0.01 0.00 -2.05 0.00 0.00 46.19 46.06 3b78 s LEU 588 CO 0.02 -1.13 0.07 -0.54 -0.55 0.00 0.00 176.35 174.22 3b78 s LYS 589 N -3.94 0.08 0.14 1.48 1.02 -0.31 -1.20 119.74 117.01 3b78 s LYS 589 Ca 0.15 0.10 0.03 0.00 0.02 0.00 0.00 55.97 56.26 3b78 s LYS 589 Cb -0.01 0.04 -0.04 0.00 -0.52 0.00 0.00 37.83 37.30 3b78 s LYS 589 CO 0.04 -0.01 0.26 0.00 -0.92 0.00 0.00 175.35 174.72 3b78 s ALA 590 N 0.04 3.93 0.08 5.17 0.00 -1.26 -0.39 121.76 129.33 3b78 s ALA 590 Ca -0.00 -1.03 -0.26 0.00 0.00 0.00 0.00 51.96 50.67 3b78 s ALA 590 Cb -0.01 -1.74 0.08 0.00 0.00 0.00 0.00 23.12 21.45 3b78 s ALA 590 CO 0.00 0.56 0.66 -1.83 0.00 0.00 0.00 175.76 175.15 3b78 s GLU 591 N -3.16 1.15 0.35 0.00 -1.05 0.30 -1.58 118.70 114.72 3b78 s GLU 591 Ca 0.34 -0.23 -0.27 0.00 -0.15 0.00 0.00 54.97 54.66 3b78 s GLU 591 Cb -0.11 0.53 -0.09 0.00 -0.44 0.00 0.00 34.13 34.02 3b78 s GLU 591 CO 0.28 -0.46 1.21 -2.14 0.95 0.00 0.00 175.26 175.10 3b78 s PRO 592 N -2.90 4.26 -0.13 -4.83 0.02 -1.26 -0.60 135.00 129.57 3b78 s PRO 592 Ca -0.02 1.99 -0.14 0.00 0.02 0.00 0.00 61.00 62.85 3b78 s PRO 592 Cb -0.01 -2.91 -0.05 0.00 0.02 0.00 0.00 34.50 31.55 3b78 s PRO 592 CO -0.06 -0.19 0.31 0.42 -0.33 0.00 0.00 177.00 177.15 3b78 s ILE 593 N -1.26 5.27 0.40 2.83 1.01 0.94 -4.76 121.20 125.63 3b78 s ILE 593 Ca 0.52 0.59 -0.27 0.00 0.00 0.00 0.00 60.65 61.49 3b78 s ILE 593 Cb -0.35 -3.64 -0.10 0.00 0.01 0.00 0.00 42.46 38.39 3b78 s ILE 593 CO 0.45 0.44 1.43 -1.81 0.00 0.00 0.00 174.94 175.45 3b78 s ASP 594 N 0.08 6.20 0.35 3.58 1.01 -1.26 -4.78 116.67 121.84 3b78 s ASP 594 Ca 0.18 2.93 0.13 0.00 0.71 0.00 0.00 52.55 56.50 3b78 s ASP 594 Cb -0.14 -2.66 0.98 0.00 1.01 0.00 0.00 42.92 42.11 3b78 s ASP 594 CO 0.06 -0.96 1.73 -0.33 0.21 0.00 0.00 175.17 175.88 3b78 h GLU 595 N 2.75 0.48 -0.44 8.23 4.39 -1.97 0.22 114.58 128.23 3b78 h GLU 595 Ca -0.51 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.22 3b78 h GLU 595 Cb 1.25 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 29.74 3b78 h GLU 595 CO 0.63 0.32 0.16 0.93 -1.16 0.00 0.00 179.01 179.88 3b78 h GLU 596 N 0.50 0.32 -0.30 2.33 5.08 -1.99 0.80 114.58 121.31 3b78 h GLU 596 Ca 0.64 -0.02 -0.17 0.00 -1.00 0.00 0.00 59.36 58.82 3b78 h GLU 596 Cb 1.38 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.55 3b78 h GLU 596 CO -0.44 0.21 -0.47 0.28 -1.00 0.00 0.00 179.01 177.60 3b78 h VAL 597 N 0.32 1.28 -0.15 3.13 2.07 -1.35 -0.69 116.25 120.86 3b78 h VAL 597 Ca 0.21 -1.65 -0.00 0.00 0.82 0.00 0.00 66.70 66.07 3b78 h VAL 597 Cb 0.20 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 3b78 h VAL 597 CO -0.21 0.54 0.09 0.28 0.02 0.00 0.00 177.57 178.29 3b78 h SER 598 N 0.63 0.19 -0.81 0.57 0.02 -1.00 0.71 113.55 113.87 3b78 h SER 598 Ca 0.03 -0.06 0.02 0.00 -0.84 0.00 0.00 61.79 60.95 3b78 h SER 598 Cb 1.07 -0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.52 3b78 h SER 598 CO 0.11 0.19 0.52 -0.07 -1.14 0.00 0.00 176.83 176.44 3b78 h LEU 599 N 0.17 0.88 -1.14 5.07 3.38 -0.83 -0.70 115.31 122.13 3b78 h LEU 599 Ca 0.05 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3b78 h LEU 599 Cb 0.04 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 3b78 h LEU 599 CO -0.01 0.61 0.26 0.00 0.09 0.00 0.00 178.44 179.39 3b78 h ALA 600 N 1.32 1.33 -0.32 1.53 0.00 -0.59 0.23 119.26 122.76 3b78 h ALA 600 Ca 0.31 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 3b78 h ALA 600 Cb -0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3b78 h ALA 600 CO -0.10 0.51 -0.18 0.82 0.00 0.00 0.00 179.25 180.31 3b78 h ILE 601 N 0.85 1.29 0.00 0.00 2.04 -0.34 -1.18 117.51 120.18 3b78 h ILE 601 Ca 0.21 -1.29 -0.02 0.00 1.00 0.00 0.00 64.86 64.75 3b78 h ILE 601 Cb 0.14 1.45 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 3b78 h ILE 601 CO -0.02 0.42 -0.11 -0.33 0.00 0.00 0.00 178.15 178.10 3b78 h GLU 602 N 0.44 0.00 -0.18 2.37 5.08 -0.57 -2.83 114.58 118.89 3b78 h GLU 602 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3b78 h GLU 602 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 3b78 h GLU 602 CO 0.05 0.11 0.00 0.09 -1.00 0.00 0.00 179.01 178.26 3b78 n ASN 603 N -3.28 2.85 0.00 1.42 3.02 0.75 -4.96 115.26 115.06 3b78 n ASN 603 Ca 0.00 -1.91 0.00 0.00 -0.03 0.00 0.00 54.58 52.64 3b78 n ASN 603 Cb 0.35 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.41 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 1.36 2.74 0.22 7.41 0.00 -0.88 -4.72 105.19 111.33 3b78 n GLY 604 Ca 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 0.50 -3.57 -0.61 2.04 -1.50 -3.27 117.51 111.11 3b78 h ILE 605 Ca 0.00 -0.03 -0.70 0.00 1.00 0.00 0.00 64.86 65.13 3b78 h ILE 605 Cb 0.00 0.40 -0.31 0.00 -0.74 0.00 0.00 36.82 36.18 3b78 h ILE 605 CO 0.00 0.02 -0.56 -0.63 0.00 0.00 0.00 178.15 176.98 3b78 s ILE 606 N -6.17 3.66 0.06 -0.67 1.01 -0.94 -5.00 121.20 113.15 3b78 s ILE 606 Ca -0.14 -1.50 0.06 0.00 0.00 0.00 0.00 60.65 59.07 3b78 s ILE 606 Cb 0.18 -3.25 -0.03 0.00 0.01 0.00 0.00 42.46 39.38 3b78 s ILE 606 CO 0.73 -0.41 -0.16 0.54 0.00 0.00 0.00 174.94 175.64 3b78 s ASN 607 N 1.73 1.94 0.61 3.58 2.20 -1.24 -4.16 114.94 119.61 3b78 s ASN 607 Ca 0.02 -0.54 0.30 0.00 -0.94 0.00 0.00 52.86 51.70 3b78 s ASN 607 Cb -0.22 -0.11 1.69 0.00 -2.00 0.00 0.00 41.25 40.61 3b78 s ASN 607 CO 0.00 0.03 2.06 -0.65 -2.94 0.00 0.00 177.10 175.60 3b78 h PRO 608 N 4.63 0.00 -0.01 3.55 0.11 -1.92 -1.99 132.00 136.38 3b78 h PRO 608 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3b78 h PRO 608 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3b78 h PRO 608 CO 0.42 0.00 -0.18 0.54 -0.21 0.00 0.00 178.00 178.57 3b78 n ARG 609 N -3.54 1.22 -1.17 1.05 1.74 -1.26 -4.94 116.66 109.76 3b78 n ARG 609 Ca 0.02 -0.77 -0.30 0.00 -0.77 0.00 0.00 57.85 56.03 3b78 n ARG 609 Cb 0.37 -1.48 0.14 0.00 -1.02 0.00 0.00 32.46 30.47 3b78 n ARG 609 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3b78 s ASP 610 N -2.32 3.34 0.06 0.55 1.11 -0.75 -4.98 116.67 113.68 3b78 s ASP 610 Ca 0.28 1.49 -0.31 0.00 0.18 0.00 0.00 52.55 54.19 3b78 s ASP 610 Cb 0.20 -2.17 -0.07 0.00 1.07 0.00 0.00 42.92 41.95 3b78 s ASP 610 CO 0.46 -2.73 1.42 -0.62 1.18 0.00 0.00 175.17 174.88 3b78 s ASP 611 N -3.38 6.81 0.54 0.27 2.15 -1.26 -4.91 116.67 116.89 3b78 s ASP 611 Ca 0.64 2.25 0.20 0.00 0.43 0.00 0.00 52.55 56.07 3b78 s ASP 611 Cb -0.18 -2.57 1.42 0.00 -0.30 0.00 0.00 42.92 41.28 3b78 s ASP 611 CO 0.57 -0.71 2.17 2.19 -0.17 0.00 0.00 175.17 179.23 3b78 h PHE 612 N 7.43 0.00 -0.04 -5.34 -5.15 -1.95 0.38 116.94 112.26 3b78 h PHE 612 Ca -0.40 0.00 -0.15 0.00 -0.20 0.00 0.00 57.97 57.22 3b78 h PHE 612 Cb 1.20 0.00 0.01 0.00 0.22 0.00 0.00 35.95 37.37 3b78 h PHE 612 CO 0.71 0.00 -0.55 0.87 -2.00 0.00 0.00 178.31 177.35 3b78 h LYS 613 N 0.00 0.45 -0.43 6.09 1.57 -1.93 -1.29 116.57 121.02 3b78 h LYS 613 Ca 0.01 -0.42 -0.11 0.00 -1.87 0.00 0.00 60.65 58.26 3b78 h LYS 613 Cb 0.03 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 3b78 h LYS 613 CO -0.00 1.07 -0.17 0.00 -0.57 0.00 0.00 179.45 179.78 3b78 h ALA 614 N 0.39 0.89 -0.39 3.86 0.00 -1.79 -1.45 119.26 120.77 3b78 h ALA 614 Ca -0.06 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 3b78 h ALA 614 Cb 1.23 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3b78 h ALA 614 CO 0.11 0.63 -0.07 -0.09 0.00 0.00 0.00 179.25 179.83 3b78 h ARG 615 N 0.73 0.73 -0.85 0.00 2.43 -1.00 -2.59 114.38 113.83 3b78 h ARG 615 Ca 0.11 -0.27 -0.02 0.00 -0.81 0.00 0.00 59.98 58.99 3b78 h ARG 615 Cb 0.68 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.14 3b78 h ARG 615 CO 0.05 0.86 0.44 0.00 -1.51 0.00 0.00 179.97 179.81 3b78 h ALA 616 N 0.84 1.10 -0.84 2.80 0.00 -1.11 -1.30 119.26 120.75 3b78 h ALA 616 Ca 0.10 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 54.97 3b78 h ALA 616 Cb 0.58 -0.34 -0.08 0.00 0.00 0.00 0.00 17.79 17.95 3b78 h ALA 616 CO 0.03 0.63 0.48 -0.09 0.00 0.00 0.00 179.25 180.31 3b78 h ARG 617 N 1.20 0.76 -0.15 0.00 9.65 -1.10 -0.99 114.38 123.75 3b78 h ARG 617 Ca 0.30 -0.05 -0.05 0.00 -1.10 0.00 0.00 59.98 59.08 3b78 h ARG 617 Cb 0.07 -0.17 -0.00 0.00 -1.39 0.00 0.00 29.97 28.48 3b78 h ARG 617 CO -0.04 0.51 -0.10 0.82 2.80 0.00 0.00 179.97 183.95 3b78 h ILE 618 N 0.79 1.33 -0.07 1.20 2.04 -1.00 -2.15 117.51 119.64 3b78 h ILE 618 Ca 0.41 -1.19 -0.05 0.00 1.00 0.00 0.00 64.86 65.02 3b78 h ILE 618 Cb 0.40 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 3b78 h ILE 618 CO -0.26 0.35 -0.21 0.24 0.00 0.00 0.00 178.15 178.28 3b78 h MET 619 N -0.00 0.11 0.07 2.37 2.86 -0.83 -0.71 114.93 118.80 3b78 h MET 619 Ca 0.03 -0.03 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 3b78 h MET 619 Cb 0.60 -0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.25 3b78 h MET 619 CO 0.03 0.32 -0.50 0.00 1.06 0.00 0.00 176.91 177.82 3b78 h ALA 620 N 1.69 -0.02 -0.07 6.32 0.00 -1.21 -1.76 119.26 124.20 3b78 h ALA 620 Ca 0.02 -0.65 -0.19 0.00 0.00 0.00 0.00 54.91 54.09 3b78 h ALA 620 Cb 0.43 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3b78 h ALA 620 CO 0.03 0.25 -0.76 -0.44 0.00 0.00 0.00 179.25 178.33 3b78 h ASP 621 N -0.69 0.50 0.00 0.00 3.32 -1.31 -2.98 116.42 115.26 3b78 h ASP 621 Ca -0.10 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 56.62 3b78 h ASP 621 Cb 1.34 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.74 3b78 h ASP 621 CO 0.06 1.08 -1.59 0.47 -1.72 0.00 0.00 179.24 177.54 3b78 n ASP 622 N -3.83 1.19 -0.09 6.45 8.00 -0.28 -4.65 116.55 123.34 3b78 n ASP 622 Ca -0.05 -0.13 0.01 0.00 0.71 0.00 0.00 54.79 55.33 3b78 n ASP 622 Cb 0.72 1.63 0.02 0.00 -0.02 0.00 0.00 41.12 43.48 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 -1.96 0.00 -3.52 1.24 4.01 -1.05 -5.03 117.16 110.85 3b78 n TYR 623 Ca -0.02 -0.31 -0.20 0.00 -0.16 0.00 0.00 57.90 57.21 3b78 n TYR 623 Cb 0.40 -0.05 0.08 0.00 -0.31 0.00 0.00 39.34 39.46 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 -0.38 -0.44 3.90 2.72 0.00 -1.12 -4.91 105.19 104.96 3b78 n GLY 624 Ca 0.02 0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.35 3.53 -0.12 1.61 0.52 -0.69 -4.97 118.94 115.47 3b78 s TRP 625 Ca 0.26 0.48 -0.29 0.00 0.02 0.00 0.00 56.10 56.57 3b78 s TRP 625 Cb -0.12 -1.93 -0.04 0.00 -1.15 0.00 0.00 33.47 30.24 3b78 s TRP 625 CO 0.73 0.56 1.53 -0.51 0.02 0.00 0.00 176.95 179.28 3b78 s ASP 626 N -2.13 6.71 0.60 2.95 -0.00 -1.26 -4.19 116.67 119.35 3b78 s ASP 626 Ca 0.33 1.97 0.40 0.00 -0.00 0.00 0.00 52.55 55.25 3b78 s ASP 626 Cb -0.13 -2.53 2.12 0.00 -0.00 0.00 0.00 42.92 42.37 3b78 s ASP 626 CO 0.22 -0.93 2.22 1.62 -0.00 0.00 0.00 175.17 178.30 3b78 h VAL 627 N 5.64 0.00 -0.26 -1.27 3.04 -1.95 0.68 116.25 122.13 3b78 h VAL 627 Ca -0.34 -0.07 -0.19 0.00 -1.01 0.00 0.00 66.70 65.09 3b78 h VAL 627 Cb 1.15 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 31.42 3b78 h VAL 627 CO 0.97 0.00 -0.58 0.71 -1.01 0.00 0.00 177.57 177.66 3b78 h THR 628 N 0.00 1.28 -0.08 3.17 1.35 -1.97 -2.35 112.91 114.32 3b78 h THR 628 Ca 0.00 -1.77 -0.06 0.00 -0.55 0.00 0.00 66.41 64.03 3b78 h THR 628 Cb 0.07 1.69 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 3b78 h THR 628 CO 0.00 0.57 -0.17 0.44 -0.25 0.00 0.00 175.52 176.11 3b78 h ASP 629 N 0.62 0.28 0.24 5.36 3.32 -1.30 -3.18 116.42 121.77 3b78 h ASP 629 Ca 0.00 -0.57 -0.02 0.00 0.02 0.00 0.00 57.03 56.46 3b78 h ASP 629 Cb 1.18 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.65 3b78 h ASP 629 CO 0.12 0.80 -0.10 0.00 -1.72 0.00 0.00 179.24 178.35 3b78 h ALA 630 N 0.49 1.43 0.00 3.45 0.00 -1.38 -1.05 119.26 122.19 3b78 h ALA 630 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3b78 h ALA 630 Cb 0.76 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3b78 h ALA 630 CO 0.04 0.13 0.00 -0.09 0.00 0.00 0.00 179.25 179.33 3b78 h ARG 631 N 0.00 0.00 -0.53 0.00 9.65 -1.43 -3.27 114.38 118.80 3b78 h ARG 631 Ca -0.00 0.00 -0.31 0.00 -1.10 0.00 0.00 59.98 58.57 3b78 h ARG 631 Cb 0.25 0.00 -0.19 0.00 -1.39 0.00 0.00 29.97 28.64 3b78 h ARG 631 CO 0.01 0.00 -0.03 1.63 2.80 0.00 0.00 179.97 184.38 3b78 n LYS 632 N -2.72 2.19 -2.24 0.20 5.02 -0.40 -4.97 118.16 115.24 3b78 n LYS 632 Ca 0.04 -3.33 -0.42 0.00 -2.02 0.00 0.00 58.31 52.58 3b78 n LYS 632 Cb 0.44 -1.96 -0.03 0.00 -0.02 0.00 0.00 35.03 33.46 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 -3.61 3.63 -0.11 -0.18 1.01 -1.23 -1.87 121.20 118.84 3b78 s ILE 633 Ca 0.49 1.11 0.08 0.00 0.00 0.00 0.00 60.65 62.33 3b78 s ILE 633 Cb 0.42 -3.71 -0.24 0.00 0.01 0.00 0.00 42.46 38.95 3b78 s ILE 633 CO 0.01 0.05 0.39 0.79 0.00 0.00 0.00 174.94 176.18 3b78 n TRP 634 N 4.54 0.76 -3.61 3.97 7.02 0.20 -4.97 117.44 125.35 3b78 n TRP 634 Ca 0.12 0.23 -0.01 0.00 -1.02 0.00 0.00 57.50 56.82 3b78 n TRP 634 Cb 0.44 -1.13 -0.01 0.00 -2.42 0.00 0.00 31.31 28.19 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 -2.43 2.87 0.02 0.00 0.08 -1.26 -2.48 117.98 114.79 3b78 s PHE 636 Ca 0.12 -0.31 -0.28 0.00 0.12 0.00 0.00 56.93 56.59 3b78 s PHE 636 Cb 0.02 -1.73 0.08 0.00 -0.57 0.00 0.00 43.02 40.82 3b78 s PHE 636 CO -0.04 0.24 0.70 0.20 -0.10 0.00 0.00 175.22 176.22 3b78 s GLY 637 N -3.95 -0.55 0.22 4.36 0.00 -0.59 -3.74 107.32 103.07 3b78 s GLY 637 Ca 0.40 1.05 -0.03 0.00 0.00 0.00 0.00 44.72 46.14 3b78 s GLY 637 CO 0.26 0.60 0.30 -1.55 0.00 0.00 0.00 173.10 172.71 3b78 n PRO 638 N 0.29 -0.09 -2.34 2.90 -0.05 -1.26 -2.45 135.00 132.00 3b78 n PRO 638 Ca -0.16 -0.55 -0.13 0.00 -0.05 0.00 0.00 63.50 62.60 3b78 n PRO 638 Cb 0.61 -0.28 -0.01 0.00 -0.05 0.00 0.00 33.50 33.76 3b78 n PRO 638 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 175.50 175.20 3b78 n ASP 639 N -3.14 -4.06 0.00 3.54 8.00 -1.26 -1.24 116.55 118.38 3b78 n ASP 639 Ca 0.04 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.73 3b78 n ASP 639 Cb 0.14 -3.47 0.00 0.00 -0.02 0.00 0.00 41.12 37.77 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 -0.77 0.40 0.00 0.44 0.00 -1.25 -4.68 105.19 99.33 3b78 n GLY 640 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.16 0.00 -4.79 1.61 0.23 -0.92 -4.24 115.26 106.99 3b78 n ASN 641 Ca 0.00 -1.00 -0.30 0.00 -0.53 0.00 0.00 54.58 52.75 3b78 n ASN 641 Cb 0.08 0.00 0.10 0.00 -2.08 0.00 0.00 39.78 37.88 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 1.62 0.00 4.83 0.00 -0.38 -4.77 107.32 108.62 3b78 s GLY 642 Ca 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 44.72 44.53 3b78 s GLY 642 CO 0.00 0.26 1.79 -1.55 0.00 0.00 0.00 173.10 173.60 3b78 n PRO 643 N -3.54 0.91 -4.14 2.90 -0.04 -1.19 -3.01 135.00 126.89 3b78 n PRO 643 Ca 0.07 -0.27 -0.16 0.00 -0.04 0.00 0.00 63.50 63.10 3b78 n PRO 643 Cb 0.56 -1.46 -0.15 0.00 -0.04 0.00 0.00 33.50 32.42 3b78 n PRO 643 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3b78 s ASN 644 N 2.16 0.60 0.00 3.54 0.01 -1.03 -1.15 114.94 119.08 3b78 s ASN 644 Ca 0.18 -0.09 0.06 0.00 -0.71 0.00 0.00 52.86 52.30 3b78 s ASN 644 Cb 0.09 -0.10 -0.02 0.00 0.41 0.00 0.00 41.25 41.63 3b78 s ASN 644 CO 0.00 0.05 -0.18 -0.76 -1.51 0.00 0.00 177.10 174.70 3b78 s LEU 645 N 0.00 2.08 -0.22 0.60 1.43 -0.66 -1.54 118.68 120.37 3b78 s LEU 645 Ca 0.00 -0.38 -0.06 0.00 -1.03 0.00 0.00 54.13 52.66 3b78 s LEU 645 Cb -0.03 -0.90 -0.03 0.00 0.03 0.00 0.00 46.19 45.26 3b78 s LEU 645 CO -0.00 0.19 0.04 -0.69 0.23 0.00 0.00 176.35 176.11 3b78 s VAL 646 N -0.55 4.19 -0.11 -1.59 1.01 -1.03 -0.30 120.40 122.01 3b78 s VAL 646 Ca 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.81 3b78 s VAL 646 Cb -0.07 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 3b78 s VAL 646 CO 0.00 0.39 -0.07 -0.63 0.00 0.00 0.00 175.10 174.79 3b78 s ILE 647 N 1.22 3.60 -0.53 2.22 -1.09 0.66 -0.63 121.20 126.65 3b78 s ILE 647 Ca 0.04 -0.49 -0.21 0.00 -2.23 0.00 0.00 60.65 57.76 3b78 s ILE 647 Cb -0.14 -2.52 0.05 0.00 -1.58 0.00 0.00 42.46 38.27 3b78 s ILE 647 CO 0.02 0.54 0.76 -0.62 -1.23 0.00 0.00 174.94 174.42 3b78 s ASP 648 N -0.13 6.27 -0.21 3.58 2.15 -0.78 -1.33 116.67 126.22 3b78 s ASP 648 Ca 0.01 -0.70 0.13 0.00 0.43 0.00 0.00 52.55 52.43 3b78 s ASP 648 Cb -0.13 -2.35 0.43 0.00 -0.30 0.00 0.00 42.92 40.57 3b78 s ASP 648 CO 0.03 -1.04 1.31 0.00 -0.17 0.00 0.00 175.17 175.29 3b78 n GLN 649 N 6.72 1.78 -2.78 4.34 6.02 -0.70 -4.89 117.38 127.87 3b78 n GLN 649 Ca -0.03 -3.03 -0.33 0.00 -0.01 0.00 0.00 57.00 53.59 3b78 n GLN 649 Cb 0.46 -1.68 -0.06 0.00 1.02 0.00 0.00 30.24 29.97 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 -3.10 4.29 -0.22 5.09 -4.23 -1.10 -4.68 115.64 111.69 3b78 s THR 650 Ca 0.39 1.46 -0.04 0.00 -1.18 0.00 0.00 61.69 62.32 3b78 s THR 650 Cb 0.36 -3.61 -0.01 0.00 1.34 0.00 0.00 72.50 70.57 3b78 s THR 650 CO -0.00 -0.27 -0.02 -0.54 -0.54 0.00 0.00 174.62 173.24 3b78 s LYS 651 N -3.10 3.43 -1.32 3.99 -0.14 -1.26 -4.78 119.74 116.56 3b78 s LYS 651 Ca 0.62 -0.60 -0.00 0.00 -1.36 0.00 0.00 55.97 54.63 3b78 s LYS 651 Cb -0.11 -3.06 0.00 0.00 -1.68 0.00 0.00 37.83 32.98 3b78 s LYS 651 CO 0.15 -0.19 0.66 0.00 -0.76 0.00 0.00 175.35 175.20 3b78 n ALA 652 N 4.80 -2.01 -2.71 5.17 0.00 -1.26 -4.96 120.51 119.54 3b78 n ALA 652 Ca -0.18 -0.18 -0.38 0.00 0.00 0.00 0.00 53.44 52.70 3b78 n ALA 652 Cb 0.51 -1.87 -0.11 0.00 0.00 0.00 0.00 19.45 17.98 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 -3.71 5.06 0.23 0.00 1.01 -1.26 -5.09 120.40 116.63 3b78 s VAL 653 Ca 0.00 0.08 -0.11 0.00 0.00 0.00 0.00 61.98 61.95 3b78 s VAL 653 Cb -0.00 -3.40 -0.07 0.00 0.00 0.00 0.00 36.38 32.91 3b78 s VAL 653 CO 0.82 0.27 0.58 -1.10 0.00 0.00 0.00 175.10 175.67 3b78 s GLN 654 N 1.72 3.87 0.00 2.72 -0.21 -1.26 -3.66 119.66 122.83 3b78 s GLN 654 Ca 0.07 0.38 0.00 0.00 0.02 0.00 0.00 55.36 55.82 3b78 s GLN 654 Cb -0.16 -2.68 0.00 0.00 1.00 0.00 0.00 33.01 31.18 3b78 s GLN 654 CO 0.09 0.33 0.00 0.66 -2.12 0.00 0.00 175.29 174.25 3b78 n TYR 655 N 0.03 0.00 -0.33 0.91 4.01 -1.26 -4.88 117.16 115.64 3b78 n TYR 655 Ca -0.00 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.87 3b78 n TYR 655 Cb 0.52 -0.37 0.31 0.00 -0.31 0.00 0.00 39.34 39.49 3b78 n TYR 655 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 3b78 h LEU 656 N 0.00 0.61 -2.39 7.72 5.85 -2.00 0.38 115.31 125.48 3b78 h LEU 656 Ca 0.00 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 3b78 h LEU 656 Cb 0.00 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 3b78 h LEU 656 CO 0.00 0.16 -0.01 1.12 -0.34 0.00 0.00 178.44 179.37 3b78 h HIS 657 N 0.61 0.00 0.00 1.25 2.07 -1.90 -2.50 115.15 114.67 3b78 h HIS 657 Ca 0.57 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.09 3b78 h HIS 657 Cb 0.96 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.94 3b78 h HIS 657 CO -0.05 0.01 0.00 0.39 -3.07 0.00 0.00 177.93 175.21 3b78 n GLU 658 N -3.15 0.13 -0.08 5.12 1.02 0.13 -3.07 120.64 120.75 3b78 n GLU 658 Ca -0.02 0.14 0.03 0.00 -0.02 0.00 0.00 57.16 57.30 3b78 n GLU 658 Cb 0.16 -1.66 0.07 0.00 -0.02 0.00 0.00 31.44 29.99 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 -1.89 0.71 -0.11 -3.67 -5.35 -0.95 -4.73 119.36 103.37 3b78 n ILE 659 Ca 0.06 -0.85 -0.10 0.00 -0.27 0.00 0.00 62.75 61.59 3b78 n ILE 659 Cb 0.36 0.69 -0.02 0.00 -1.74 0.00 0.00 39.64 38.93 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 1.25 0.51 -0.72 6.28 3.64 -1.54 -1.19 116.57 124.80 3b78 h LYS 660 Ca 0.00 -0.10 0.03 0.00 -1.27 0.00 0.00 60.65 59.31 3b78 h LYS 660 Cb 0.53 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.24 3b78 h LYS 660 CO 0.00 0.52 0.47 -0.44 -2.27 0.00 0.00 179.45 177.74 3b78 h ASP 661 N 0.39 0.76 -0.14 4.20 3.32 -1.85 0.11 116.42 123.21 3b78 h ASP 661 Ca 0.11 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.09 3b78 h ASP 661 Cb 0.21 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 3b78 h ASP 661 CO -0.01 0.53 -0.13 0.28 -1.72 0.00 0.00 179.24 178.19 3b78 h SER 662 N 0.89 0.36 -0.78 6.45 0.02 -1.81 -1.16 113.55 117.51 3b78 h SER 662 Ca 0.28 -0.48 0.01 0.00 -0.84 0.00 0.00 61.79 60.77 3b78 h SER 662 Cb 0.02 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.42 3b78 h SER 662 CO -0.08 0.76 0.51 0.58 -1.14 0.00 0.00 176.83 177.47 3b78 h VAL 663 N -0.04 1.18 -0.29 2.27 2.07 -0.81 -0.68 116.25 119.94 3b78 h VAL 663 Ca 0.02 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 3b78 h VAL 663 Cb 0.66 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 3b78 h VAL 663 CO 0.03 0.19 0.09 0.58 0.02 0.00 0.00 177.57 178.48 3b78 h VAL 664 N 1.04 1.20 -0.81 2.57 2.07 -0.78 -1.99 116.25 119.55 3b78 h VAL 664 Ca 0.29 -0.65 0.01 0.00 0.82 0.00 0.00 66.70 67.17 3b78 h VAL 664 Cb -0.09 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 3b78 h VAL 664 CO -0.07 0.22 0.54 0.00 0.02 0.00 0.00 177.57 178.27 3b78 h ALA 665 N 0.92 1.03 -0.77 1.67 0.00 -0.92 -2.00 119.26 119.20 3b78 h ALA 665 Ca 0.09 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3b78 h ALA 665 Cb 0.25 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3b78 h ALA 665 CO -0.00 0.45 0.33 0.00 0.00 0.00 0.00 179.25 180.03 3b78 h ALA 666 N 1.29 1.15 -0.03 0.00 0.00 -0.99 -2.64 119.26 118.04 3b78 h ALA 666 Ca 0.30 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 3b78 h ALA 666 Cb -0.12 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 3b78 h ALA 666 CO -0.06 0.63 -0.40 0.35 0.00 0.00 0.00 179.25 179.77 3b78 h PHE 667 N 1.10 0.07 -0.37 0.00 3.57 -0.76 -0.21 116.94 120.33 3b78 h PHE 667 Ca 0.26 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.68 3b78 h PHE 667 Cb 0.16 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 3b78 h PHE 667 CO 0.02 0.45 -0.03 1.96 -2.23 0.00 0.00 178.31 178.48 3b78 h GLN 668 N 0.05 0.60 0.11 1.11 1.08 -1.01 -1.98 115.11 115.08 3b78 h GLN 668 Ca 0.00 -0.15 -0.32 0.00 -1.45 0.00 0.00 58.65 56.73 3b78 h GLN 668 Cb 0.73 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.07 3b78 h GLN 668 CO 0.05 0.65 -1.64 -1.49 -0.95 0.00 0.00 178.83 175.45 3b78 h TRP 669 N 0.57 0.44 -0.78 2.96 4.06 -1.40 -2.91 115.95 118.89 3b78 h TRP 669 Ca 0.12 -0.32 0.01 0.00 2.06 0.00 0.00 58.89 60.75 3b78 h TRP 669 Cb 0.41 -0.02 -0.04 0.00 -1.00 0.00 0.00 29.16 28.51 3b78 h TRP 669 CO 0.02 1.43 0.51 0.00 -3.56 0.00 0.00 178.44 176.84 3b78 h ALA 670 N 0.45 0.99 0.00 1.49 0.00 -0.96 -1.63 119.26 119.59 3b78 h ALA 670 Ca -0.28 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3b78 h ALA 670 Cb 2.03 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.50 3b78 h ALA 670 CO 0.14 0.41 -0.31 1.79 0.00 0.00 0.00 179.25 181.28 3b78 h THR 671 N 1.06 0.00 -0.06 0.00 1.35 -1.50 -3.31 112.91 110.45 3b78 h THR 671 Ca 0.28 -0.60 -0.18 0.00 -0.55 0.00 0.00 66.41 65.37 3b78 h THR 671 Cb -0.11 1.40 0.01 0.00 -1.73 0.00 0.00 68.15 67.72 3b78 h THR 671 CO -0.06 0.00 -0.67 0.50 -0.25 0.00 0.00 175.52 175.04 3b78 h LYS 672 N 0.00 0.57 -3.27 4.72 1.63 -1.17 0.80 116.57 119.84 3b78 h LYS 672 Ca 0.00 -0.53 -0.51 0.00 -0.85 0.00 0.00 60.65 58.76 3b78 h LYS 672 Cb 0.80 0.13 -0.40 0.00 -0.60 0.00 0.00 32.23 32.15 3b78 h LYS 672 CO 0.00 1.15 -0.76 -1.21 -3.45 0.00 0.00 179.45 175.18 3b78 s GLU 673 N -3.49 0.41 0.86 1.90 2.02 -0.68 -3.22 118.70 116.50 3b78 s GLU 673 Ca -0.12 -0.42 -0.12 0.00 0.02 0.00 0.00 54.97 54.33 3b78 s GLU 673 Cb 0.06 -1.85 0.11 0.00 0.10 0.00 0.00 34.13 32.54 3b78 s GLU 673 CO 0.86 -0.76 1.13 0.20 0.02 0.00 0.00 175.26 176.71 3b78 s GLY 674 N 1.95 1.59 0.28 -1.39 0.00 0.62 -4.68 107.32 105.69 3b78 s GLY 674 Ca 0.03 -0.45 0.26 0.00 0.00 0.00 0.00 44.72 44.55 3b78 s GLY 674 CO -0.15 0.05 1.76 -0.56 0.00 0.00 0.00 173.10 174.19 3b78 h PRO 675 N -1.29 0.00 0.18 2.90 0.13 -1.88 -1.99 132.00 130.06 3b78 h PRO 675 Ca -0.49 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 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 0.62 0.00 -0.09 0.82 -0.23 0.00 0.00 178.00 179.12 3b78 h ILE 676 N 0.00 0.12 -0.06 -3.56 2.04 -1.93 -3.44 117.51 110.68 3b78 h ILE 676 Ca 0.00 -0.88 -0.17 0.00 1.00 0.00 0.00 64.86 64.80 3b78 h ILE 676 Cb 0.57 0.21 -0.19 0.00 -0.74 0.00 0.00 36.82 36.67 3b78 h ILE 676 CO 0.00 0.04 -0.42 2.22 0.00 0.00 0.00 178.15 179.98 3b78 n PHE 677 N -4.94 -1.20 -1.14 1.37 1.16 -1.26 -4.89 117.46 106.57 3b78 n PHE 677 Ca -0.04 -1.54 -0.05 0.00 -1.87 0.00 0.00 57.45 53.95 3b78 n PHE 677 Cb 0.13 1.08 -0.02 0.00 -1.61 0.00 0.00 39.48 39.06 3b78 n PHE 677 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3b78 n GLY 678 N -1.10 0.76 3.93 4.97 0.00 -0.75 -4.91 105.19 108.09 3b78 n GLY 678 Ca -0.15 -0.66 -0.26 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.18 3.52 0.41 1.61 0.41 -1.26 -4.24 118.70 116.96 3b78 s GLU 679 Ca 0.00 -0.32 -0.27 0.00 -0.41 0.00 0.00 54.97 53.97 3b78 s GLU 679 Cb 0.00 -2.76 -0.10 0.00 -1.78 0.00 0.00 34.13 29.50 3b78 s GLU 679 CO 0.00 0.30 1.43 -1.21 -0.49 0.00 0.00 175.26 175.28 3b78 s GLU 680 N -3.72 3.94 0.54 1.61 2.02 -1.20 -0.28 118.70 121.61 3b78 s GLU 680 Ca 0.39 2.43 -0.16 0.00 0.02 0.00 0.00 54.97 57.66 3b78 s GLU 680 Cb -0.10 -2.82 -0.07 0.00 0.10 0.00 0.00 34.13 31.24 3b78 s GLU 680 CO 0.31 -0.62 1.01 -1.64 0.02 0.00 0.00 175.26 174.34 3b78 s MET 681 N -2.23 3.76 -0.11 1.61 -1.94 0.27 0.14 119.30 120.81 3b78 s MET 681 Ca 0.56 1.00 -0.10 0.00 -1.71 0.00 0.00 55.69 55.45 3b78 s MET 681 Cb -0.44 -2.11 0.03 0.00 2.01 0.00 0.00 34.83 34.33 3b78 s MET 681 CO 0.58 -0.43 0.29 0.50 -0.01 0.00 0.00 175.02 175.95 3b78 s ARG 682 N -4.15 0.34 -1.56 2.03 3.52 0.76 -4.74 118.95 115.14 3b78 s ARG 682 Ca 0.60 0.41 -0.04 0.00 -0.13 0.00 0.00 55.73 56.57 3b78 s ARG 682 Cb -0.11 0.16 0.00 0.00 -1.56 0.00 0.00 34.95 33.44 3b78 s ARG 682 CO 0.34 -0.04 0.50 0.43 -0.81 0.00 0.00 175.30 175.72 3b78 n SER 683 N 2.95 -6.01 -4.43 -2.12 7.64 -0.30 -4.37 113.62 106.98 3b78 n SER 683 Ca -0.13 -0.24 -0.35 0.00 1.01 0.00 0.00 58.87 59.16 3b78 n SER 683 Cb 0.58 -4.86 -0.13 0.00 -1.01 0.00 0.00 64.21 58.80 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 -3.14 3.98 -0.14 0.44 1.01 -1.22 -0.04 120.40 121.28 3b78 s VAL 684 Ca 0.25 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.91 3b78 s VAL 684 Cb -0.11 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 3b78 s VAL 684 CO 0.30 0.41 -0.09 -0.60 0.00 0.00 0.00 175.10 175.13 3b78 s ARG 685 N 1.19 3.46 -0.17 2.72 3.52 0.23 -1.65 118.95 128.25 3b78 s ARG 685 Ca 0.03 -0.60 -0.01 0.00 -0.13 0.00 0.00 55.73 55.02 3b78 s ARG 685 Cb -0.14 -2.75 -0.00 0.00 -1.56 0.00 0.00 34.95 30.50 3b78 s ARG 685 CO 0.01 0.27 -0.13 0.08 -0.81 0.00 0.00 175.30 174.72 3b78 s VAL 686 N 0.25 2.79 -0.32 7.11 1.01 0.59 -0.54 120.40 131.29 3b78 s VAL 686 Ca -0.06 -0.72 -0.10 0.00 0.00 0.00 0.00 61.98 61.10 3b78 s VAL 686 Cb -0.15 -2.20 -0.00 0.00 0.00 0.00 0.00 36.38 34.03 3b78 s VAL 686 CO 0.04 0.50 0.16 0.20 0.00 0.00 0.00 175.10 176.00 3b78 s ASN 687 N 1.00 5.59 -0.54 3.32 0.01 0.47 -0.24 114.94 124.54 3b78 s ASN 687 Ca -0.02 -0.60 -0.28 0.00 -0.71 0.00 0.00 52.86 51.25 3b78 s ASN 687 Cb -0.15 -2.01 0.03 0.00 0.41 0.00 0.00 41.25 39.53 3b78 s ASN 687 CO -0.02 -0.23 1.23 -0.63 -1.51 0.00 0.00 177.10 175.94 3b78 s ILE 688 N 1.61 4.01 0.04 0.60 1.01 -0.44 -1.16 121.20 126.87 3b78 s ILE 688 Ca 0.04 0.94 -0.10 0.00 0.00 0.00 0.00 60.65 61.53 3b78 s ILE 688 Cb -0.17 -4.62 -0.32 0.00 0.01 0.00 0.00 42.46 37.36 3b78 s ILE 688 CO 0.06 -1.20 1.04 -0.07 0.00 0.00 0.00 174.94 174.77 3b78 h LEU 689 N 11.98 0.63 -7.00 2.97 3.38 -1.26 -1.81 115.31 124.19 3b78 h LEU 689 Ca -0.25 -0.69 -0.03 0.00 0.09 0.00 0.00 57.88 57.00 3b78 h LEU 689 Cb 1.07 -0.20 -0.14 0.00 0.09 0.00 0.00 40.66 41.47 3b78 h LEU 689 CO 1.17 1.54 0.21 -0.62 0.09 0.00 0.00 178.44 180.83 3b78 s ASP 690 N -7.34 -0.59 -0.11 -0.43 2.15 -1.13 -4.00 116.67 105.22 3b78 s ASP 690 Ca -0.07 0.19 -0.08 0.00 0.43 0.00 0.00 52.55 53.02 3b78 s ASP 690 Cb 0.06 0.58 0.04 0.00 -0.30 0.00 0.00 42.92 43.29 3b78 s ASP 690 CO 0.91 -0.86 0.29 -0.69 -0.17 0.00 0.00 175.17 174.64 3b78 s VAL 691 N -3.05 -0.02 -0.12 1.11 1.01 -1.26 -1.10 120.40 116.96 3b78 s VAL 691 Ca -0.02 0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.04 3b78 s VAL 691 Cb -0.01 -0.42 -0.00 0.00 0.00 0.00 0.00 36.38 35.95 3b78 s VAL 691 CO -0.07 0.02 -0.19 0.42 0.00 0.00 0.00 175.10 175.28 3b78 s THR 692 N 0.66 2.42 0.15 3.92 -4.23 -0.77 -4.93 115.64 112.87 3b78 s THR 692 Ca -0.04 -0.88 0.10 0.00 -1.18 0.00 0.00 61.69 59.69 3b78 s THR 692 Cb -0.05 -1.98 -0.04 0.00 1.34 0.00 0.00 72.50 71.77 3b78 s THR 692 CO -0.04 0.54 -0.23 -0.76 -0.54 0.00 0.00 174.62 173.58 3b78 s LEU 693 N 0.52 2.37 0.46 4.79 1.43 -1.26 -1.32 118.68 125.67 3b78 s LEU 693 Ca -0.12 -0.79 -0.22 0.00 -1.03 0.00 0.00 54.13 51.96 3b78 s LEU 693 Cb -0.17 -1.07 -0.07 0.00 0.03 0.00 0.00 46.19 44.91 3b78 s LEU 693 CO 0.05 0.10 1.14 -2.28 0.23 0.00 0.00 176.35 175.58 3b78 s HIS 694 N -1.42 2.91 0.26 0.29 5.65 -1.23 -4.95 115.29 116.79 3b78 s HIS 694 Ca 0.15 1.56 -0.04 0.00 0.25 0.00 0.00 55.06 56.97 3b78 s HIS 694 Cb -0.09 -3.31 0.31 0.00 -1.18 0.00 0.00 32.58 28.31 3b78 s HIS 694 CO 0.07 -1.35 1.87 0.00 -0.65 0.00 0.00 174.74 174.68 3b78 h ALA 695 N 1.96 1.23 -2.73 1.58 0.00 -2.00 -3.42 119.26 115.88 3b78 h ALA 695 Ca -0.49 -0.14 -0.57 0.00 0.00 0.00 0.00 54.91 53.71 3b78 h ALA 695 Cb 1.24 -0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.65 3b78 h ALA 695 CO 0.60 0.61 0.03 -0.51 0.00 0.00 0.00 179.25 179.98 3b78 s ASP 696 N -6.35 6.84 0.52 0.00 1.01 -1.26 -4.94 116.67 112.49 3b78 s ASP 696 Ca -0.12 1.01 0.35 0.00 0.71 0.00 0.00 52.55 54.50 3b78 s ASP 696 Cb 0.17 -2.36 1.65 0.00 1.01 0.00 0.00 42.92 43.38 3b78 s ASP 696 CO 0.81 -0.12 2.04 0.00 0.21 0.00 0.00 175.17 178.12 3b78 h ALA 697 N 6.89 1.00 0.00 5.23 0.00 -2.03 -3.34 119.26 127.01 3b78 h ALA 697 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3b78 h ALA 697 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3b78 h ALA 697 CO 0.76 0.00 0.00 1.51 0.00 0.00 0.00 179.25 181.52 3b78 n ILE 698 N -2.87 0.74 -0.63 0.00 3.06 -1.26 -3.55 119.36 114.85 3b78 n ILE 698 Ca -0.01 -0.15 0.00 0.00 -2.50 0.00 0.00 62.75 60.09 3b78 n ILE 698 Cb 0.19 -1.06 0.00 0.00 0.54 0.00 0.00 39.64 39.31 3b78 n ILE 698 CO 0.00 0.00 0.00 -2.11 -2.50 0.00 0.00 176.55 171.94 3b78 n ARG 700 N 1.46 -0.39 -0.65 9.51 1.85 -1.26 -5.09 116.66 122.09 3b78 n ARG 700 Ca 0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.74 3b78 n ARG 700 Cb 0.22 0.00 0.08 0.00 -1.05 0.00 0.00 32.46 31.71 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 -1.45 0.29 2.89 0.00 -1.23 -4.70 105.19 100.77 3b78 n GLY 701 Ca 0.00 -1.65 0.04 0.00 0.00 0.00 0.00 46.02 44.41 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 -0.74 1.23 0.71 -0.02 0.00 -1.97 -1.68 103.07 100.60 3b78 h GLY 702 Ca -0.16 -0.25 0.17 0.00 0.00 0.00 0.00 47.33 47.10 3b78 h GLY 702 CO 0.11 0.03 0.47 -1.33 0.00 0.00 0.00 176.54 175.82 3b78 h GLY 703 N 0.64 0.32 0.28 4.60 0.00 -2.00 -0.73 103.07 106.18 3b78 h GLY 703 Ca 0.40 -0.08 -0.34 0.00 0.00 0.00 0.00 47.33 47.32 3b78 h GLY 703 CO -0.31 0.02 -1.88 -1.06 0.00 0.00 0.00 176.54 173.31 3b78 n GLN 704 N -4.41 0.67 0.11 4.80 1.13 -0.68 -4.50 117.38 114.51 3b78 n GLN 704 Ca 0.13 0.35 -0.24 0.00 -1.94 0.00 0.00 57.00 55.30 3b78 n GLN 704 Cb 0.63 -1.68 -0.15 0.00 0.11 0.00 0.00 30.24 29.15 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 -0.38 1.12 -0.11 5.09 5.03 -1.27 -3.27 117.51 123.72 3b78 h ILE 705 Ca -0.45 -2.61 0.04 0.00 -0.12 0.00 0.00 64.86 61.72 3b78 h ILE 705 Cb 1.75 2.92 -0.05 0.00 -3.03 0.00 0.00 36.82 38.40 3b78 h ILE 705 CO -0.08 0.83 -0.23 0.40 -0.68 0.00 0.00 178.15 178.40 3b78 h ILE 706 N 0.13 0.45 -0.54 -0.67 2.04 -1.36 0.21 117.51 117.77 3b78 h ILE 706 Ca -0.30 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 3b78 h ILE 706 Cb 2.14 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.65 3b78 h ILE 706 CO 0.23 0.00 0.08 -0.65 0.00 0.00 0.00 178.15 177.82 3b78 h PRO 707 N -0.30 0.86 0.12 2.37 0.11 -1.76 -2.07 132.00 131.33 3b78 h PRO 707 Ca 0.09 -0.20 0.00 0.00 0.11 0.00 0.00 66.00 66.00 3b78 h PRO 707 Cb 0.43 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 3b78 h PRO 707 CO -0.28 0.80 -0.10 1.15 -0.21 0.00 0.00 178.00 179.36 3b78 h THR 708 N 0.81 0.77 -0.81 -1.15 2.02 -1.44 -1.18 112.91 111.93 3b78 h THR 708 Ca 0.17 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.34 3b78 h THR 708 Cb 0.37 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 3b78 h THR 708 CO 0.01 0.00 0.48 -0.03 0.37 0.00 0.00 175.52 176.35 3b78 h MET 709 N -0.24 1.10 0.03 6.66 1.85 -0.88 -1.10 114.93 122.34 3b78 h MET 709 Ca -0.00 -0.10 -0.00 0.00 -0.61 0.00 0.00 59.70 58.99 3b78 h MET 709 Cb 0.22 -0.23 0.00 0.00 0.43 0.00 0.00 31.60 32.02 3b78 h MET 709 CO -0.02 0.78 -0.01 -0.09 -0.40 0.00 0.00 176.91 177.17 3b78 h ARG 710 N 1.11 -0.04 -0.43 0.39 2.43 -1.19 -0.86 114.38 115.80 3b78 h ARG 710 Ca 0.29 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.46 3b78 h ARG 710 Cb -0.04 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 3b78 h ARG 710 CO -0.05 0.17 0.25 0.00 -1.51 0.00 0.00 179.97 178.82 3b78 h ARG 711 N -0.24 0.59 -0.50 0.20 3.08 -1.12 -0.55 114.38 115.85 3b78 h ARG 711 Ca -0.00 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 3b78 h ARG 711 Cb 0.22 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 3b78 h ARG 711 CO 0.01 0.46 0.29 0.00 -1.07 0.00 0.00 179.97 179.65 3b78 h ALA 712 N 1.10 1.56 -0.30 0.04 0.00 -1.13 0.83 119.26 121.37 3b78 h ALA 712 Ca 0.15 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3b78 h ALA 712 Cb 0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3b78 h ALA 712 CO -0.03 0.37 0.03 1.15 0.00 0.00 0.00 179.25 180.78 3b78 h THR 713 N 0.69 1.24 -0.21 0.00 2.02 -0.56 -1.08 112.91 115.01 3b78 h THR 713 Ca 0.18 -0.85 0.02 0.00 0.77 0.00 0.00 66.41 66.53 3b78 h THR 713 Cb -0.00 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 3b78 h THR 713 CO -0.03 0.28 0.06 1.88 0.37 0.00 0.00 175.52 178.08 3b78 h TYR 714 N 0.32 0.11 -0.58 3.16 -1.99 -0.24 0.11 116.97 117.85 3b78 h TYR 714 Ca 0.09 0.01 0.02 0.00 2.00 0.00 0.00 58.73 60.85 3b78 h TYR 714 Cb 0.38 -0.02 -0.03 0.00 2.00 0.00 0.00 36.73 39.06 3b78 h TYR 714 CO 0.03 0.05 0.37 0.00 -0.00 0.00 0.00 178.16 178.61 3b78 h ALA 715 N 1.14 0.75 -0.68 3.88 0.00 -0.81 -0.41 119.26 123.13 3b78 h ALA 715 Ca 0.09 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3b78 h ALA 715 Cb 0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3b78 h ALA 715 CO -0.11 0.13 0.15 0.78 0.00 0.00 0.00 179.25 180.20 3b78 h GLY 716 N 0.74 1.17 0.88 0.00 0.00 -0.88 -2.12 103.07 102.85 3b78 h GLY 716 Ca 0.22 -0.73 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 3b78 h GLY 716 CO -0.07 0.68 -0.10 -2.75 0.00 0.00 0.00 176.54 174.30 3b78 h PHE 717 N 1.03 -0.26 0.00 5.60 3.57 -0.32 -2.59 116.94 123.96 3b78 h PHE 717 Ca 0.21 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.71 3b78 h PHE 717 Cb 0.38 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.21 3b78 h PHE 717 CO 0.03 -0.07 0.00 -0.07 -2.23 0.00 0.00 178.31 175.97 3b78 h LEU 718 N -0.41 0.00 -0.47 0.59 3.38 -1.01 -0.96 115.31 116.43 3b78 h LEU 718 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3b78 h LEU 718 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3b78 h LEU 718 CO 0.05 0.00 -0.35 0.18 0.09 0.00 0.00 178.44 178.41 3b78 n LEU 719 N -2.73 1.07 -1.88 1.67 4.77 -0.81 -4.27 117.00 114.83 3b78 n LEU 719 Ca -0.00 -0.29 -0.17 0.00 -0.03 0.00 0.00 56.01 55.51 3b78 n LEU 719 Cb 0.18 -0.12 0.19 0.00 -2.33 0.00 0.00 43.42 41.34 3b78 n LEU 719 CO 0.20 0.21 1.09 0.00 -1.33 0.00 0.00 177.39 177.56 3b78 n ALA 720 N -0.72 5.17 -3.00 -1.18 0.00 -0.37 -0.90 120.51 119.51 3b78 n ALA 720 Ca 0.11 -2.97 -0.04 0.00 0.00 0.00 0.00 53.44 50.53 3b78 n ALA 720 Cb 0.36 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.60 3b78 n ALA 720 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3b78 n ASP 721 N -1.12 -7.76 -4.77 0.00 2.03 -1.26 -2.65 116.55 101.02 3b78 n ASP 721 Ca 0.51 0.14 -0.40 0.00 0.52 0.00 0.00 54.79 55.56 3b78 n ASP 721 Cb 1.47 -5.20 -0.02 0.00 -0.72 0.00 0.00 41.12 36.64 3b78 n ASP 721 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 3b78 s PRO 722 N -2.89 4.31 0.11 -0.67 0.02 -1.26 -1.88 135.00 132.74 3b78 s PRO 722 Ca 0.10 2.16 0.01 0.00 0.02 0.00 0.00 61.00 63.29 3b78 s PRO 722 Cb -0.03 -3.02 -0.04 0.00 0.02 0.00 0.00 34.50 31.43 3b78 s PRO 722 CO 0.76 -0.21 -0.02 0.15 -0.33 0.00 0.00 177.00 177.36 3b78 s LYS 723 N -1.85 0.88 0.13 5.54 3.01 0.16 -4.53 119.74 123.07 3b78 s LYS 723 Ca 0.50 -1.38 0.09 0.00 -1.01 0.00 0.00 55.97 54.17 3b78 s LYS 723 Cb -0.39 -0.06 -0.04 0.00 -1.01 0.00 0.00 37.83 36.33 3b78 s LYS 723 CO 0.51 -0.11 -0.16 0.96 0.51 0.00 0.00 175.35 177.06 3b78 s ILE 724 N -3.77 2.92 0.01 2.17 -4.36 -1.26 -0.82 121.20 116.09 3b78 s ILE 724 Ca 0.16 -1.56 0.06 0.00 -0.26 0.00 0.00 60.65 59.05 3b78 s ILE 724 Cb 0.06 -2.37 -0.03 0.00 1.25 0.00 0.00 42.46 41.38 3b78 s ILE 724 CO -0.02 0.04 -0.17 -1.10 0.24 0.00 0.00 174.94 173.93 3b78 s GLN 725 N -2.33 2.23 0.00 0.37 -0.21 -0.02 -1.27 119.66 118.43 3b78 s GLN 725 Ca 0.20 -0.88 0.05 0.00 0.02 0.00 0.00 55.36 54.75 3b78 s GLN 725 Cb -0.10 -2.25 -0.03 0.00 1.00 0.00 0.00 33.01 31.63 3b78 s GLN 725 CO 0.11 0.57 -0.13 -1.83 -2.12 0.00 0.00 175.29 171.89 3b78 s GLU 726 N -1.15 2.34 0.47 2.91 -1.05 -0.05 -1.59 118.70 120.58 3b78 s GLU 726 Ca 0.13 -0.82 -0.21 0.00 -0.15 0.00 0.00 54.97 53.92 3b78 s GLU 726 Cb -0.10 -2.34 -0.09 0.00 -0.44 0.00 0.00 34.13 31.16 3b78 s GLU 726 CO 0.03 0.58 1.03 -1.25 0.95 0.00 0.00 175.26 176.60 3b78 s PRO 727 N -1.24 3.89 -0.07 -4.83 0.04 -1.26 -0.65 135.00 130.88 3b78 s PRO 727 Ca 0.15 1.35 -0.03 0.00 0.04 0.00 0.00 61.00 62.50 3b78 s PRO 727 Cb -0.11 -2.15 0.04 0.00 0.04 0.00 0.00 34.50 32.32 3b78 s PRO 727 CO 0.05 -0.36 0.16 0.08 0.04 0.00 0.00 177.00 176.97 3b78 s VAL 728 N -1.97 -0.04 0.68 -0.36 1.01 -0.80 -2.44 120.40 116.48 3b78 s VAL 728 Ca 0.66 0.15 -0.11 0.00 0.00 0.00 0.00 61.98 62.67 3b78 s VAL 728 Cb -0.16 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 35.97 3b78 s VAL 728 CO 0.20 0.06 1.07 -0.36 0.00 0.00 0.00 175.10 176.07 3b78 s PHE 729 N 1.00 3.37 -0.50 5.22 0.08 0.17 -1.25 117.98 126.08 3b78 s PHE 729 Ca -0.08 1.06 -0.00 0.00 0.12 0.00 0.00 56.93 58.03 3b78 s PHE 729 Cb -0.10 -2.99 0.13 0.00 -0.57 0.00 0.00 43.02 39.50 3b78 s PHE 729 CO -0.05 -1.07 0.28 -1.17 -0.10 0.00 0.00 175.22 173.10 3b78 s LEU 730 N -5.30 4.96 -0.46 -0.37 0.20 0.14 -1.52 118.68 116.34 3b78 s LEU 730 Ca 0.57 -2.57 -0.21 0.00 0.69 0.00 0.00 54.13 52.62 3b78 s LEU 730 Cb -0.11 -1.76 0.03 0.00 -0.43 0.00 0.00 46.19 43.92 3b78 s LEU 730 CO 0.52 -0.39 0.65 0.54 -0.29 0.00 0.00 176.35 177.38 3b78 s VAL 731 N 0.35 4.82 -0.13 1.68 0.11 0.14 -3.37 120.40 124.00 3b78 s VAL 731 Ca 0.14 0.01 -0.09 0.00 -2.93 0.00 0.00 61.98 59.10 3b78 s VAL 731 Cb -0.22 -4.24 -0.05 0.00 -1.53 0.00 0.00 36.38 30.35 3b78 s VAL 731 CO -0.04 -0.66 0.19 -0.70 -3.33 0.00 0.00 175.10 170.57 3b78 s GLU 732 N 2.83 3.76 -0.03 1.54 2.12 0.22 -1.34 118.70 127.80 3b78 s GLU 732 Ca 0.21 -0.05 0.01 0.00 0.36 0.00 0.00 54.97 55.50 3b78 s GLU 732 Cb -0.15 -3.27 0.02 0.00 0.26 0.00 0.00 34.13 30.99 3b78 s GLU 732 CO 0.18 0.60 -0.02 0.42 -0.54 0.00 0.00 175.26 175.90 3b78 s ILE 733 N -0.56 0.34 -0.19 -3.70 1.01 -0.25 -2.44 121.20 115.41 3b78 s ILE 733 Ca 0.15 -0.03 -0.10 0.00 0.00 0.00 0.00 60.65 60.67 3b78 s ILE 733 Cb -0.12 -0.39 -0.05 0.00 0.01 0.00 0.00 42.46 41.90 3b78 s ILE 733 CO 0.04 0.17 0.13 -1.10 0.00 0.00 0.00 174.94 174.18 3b78 s GLN 734 N 0.85 4.12 -0.27 2.79 1.11 -1.15 -1.54 119.66 125.58 3b78 s GLN 734 Ca -0.10 -0.22 -0.25 0.00 0.01 0.00 0.00 55.36 54.80 3b78 s GLN 734 Cb -0.13 -3.39 0.10 0.00 -1.01 0.00 0.00 33.01 28.58 3b78 s GLN 734 CO -0.01 0.33 0.89 0.00 0.01 0.00 0.00 175.29 176.51 3b78 n PRO 736 N 2.33 0.97 0.30 0.00 -0.02 -1.26 -1.46 135.00 135.85 3b78 n PRO 736 Ca -0.13 0.37 0.19 0.00 -2.02 0.00 0.00 63.50 61.90 3b78 n PRO 736 Cb 0.56 -2.07 1.02 0.00 -0.02 0.00 0.00 33.50 32.98 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 0.74 0.00 0.00 -0.52 4.81 -1.61 -1.08 114.58 116.92 3b78 h GLU 737 Ca -0.47 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.67 3b78 h GLU 737 Cb 1.36 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.73 3b78 h GLU 737 CO 0.52 0.00 -0.44 -0.56 -0.73 0.00 0.00 179.01 177.80 3b78 h GLN 738 N 0.00 0.00 -0.12 1.92 3.07 -1.89 -3.24 115.11 114.86 3b78 h GLN 738 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.76 3b78 h GLN 738 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.72 3b78 h GLN 738 CO -0.00 0.44 0.00 0.00 0.09 0.00 0.00 178.83 179.36 3b78 n ALA 739 N -2.32 2.28 0.33 0.06 0.00 -0.44 -4.50 120.51 115.91 3b78 n ALA 739 Ca -0.00 -1.68 0.15 0.00 0.00 0.00 0.00 53.44 51.91 3b78 n ALA 739 Cb 0.55 -0.32 0.64 0.00 0.00 0.00 0.00 19.45 20.32 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 0.75 0.00 -0.47 0.00 2.07 -1.48 -2.93 116.25 114.18 3b78 h VAL 740 Ca 0.00 -0.33 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 3b78 h VAL 740 Cb 0.84 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 3b78 h VAL 740 CO 0.04 0.00 0.01 1.23 0.02 0.00 0.00 177.57 178.87 3b78 h GLY 741 N 1.86 0.90 1.95 2.17 0.00 -1.81 -2.71 103.07 105.43 3b78 h GLY 741 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.68 3b78 h GLY 741 CO 0.00 0.60 0.02 -1.33 0.00 0.00 0.00 176.54 175.83 3b78 h GLY 742 N 0.69 0.00 0.71 4.60 0.00 -1.63 -2.07 103.07 105.36 3b78 h GLY 742 Ca 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.44 3b78 h GLY 742 CO 0.02 0.00 -0.30 -2.22 0.00 0.00 0.00 176.54 174.04 3b78 h ILE 743 N 0.00 0.14 0.00 2.60 1.08 -1.61 -3.03 117.51 116.69 3b78 h ILE 743 Ca 0.00 -0.35 0.00 0.00 -0.39 0.00 0.00 64.86 64.12 3b78 h ILE 743 Cb 0.05 0.20 0.00 0.00 -3.07 0.00 0.00 36.82 33.99 3b78 h ILE 743 CO -0.00 0.02 0.00 -1.22 -0.69 0.00 0.00 178.15 176.26 3b78 n TYR 744 N -5.36 0.00 0.09 1.37 4.01 -0.99 -2.00 117.16 114.28 3b78 n TYR 744 Ca -0.11 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.59 3b78 n TYR 744 Cb 0.35 -0.47 -0.05 0.00 -0.31 0.00 0.00 39.34 38.86 3b78 n TYR 744 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3b78 h SER 745 N 0.00 0.00 0.00 7.72 0.87 -1.28 -3.25 113.55 117.61 3b78 h SER 745 Ca 0.00 0.00 -0.29 0.00 -1.23 0.00 0.00 61.79 60.27 3b78 h SER 745 Cb 0.23 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.14 3b78 h SER 745 CO 0.00 0.81 -2.27 0.52 -0.53 0.00 0.00 176.83 175.36 3b78 n VAL 746 N -3.32 1.10 -0.12 2.23 0.31 -0.96 -4.40 118.33 113.17 3b78 n VAL 746 Ca 0.01 -0.77 -0.09 0.00 -0.01 0.00 0.00 64.34 63.48 3b78 n VAL 746 Cb 0.85 -0.39 -0.01 0.00 -0.91 0.00 0.00 33.84 33.38 3b78 n VAL 746 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3b78 h LEU 747 N 0.00 0.49 0.00 7.52 3.38 -1.53 -2.06 115.31 123.11 3b78 h LEU 747 Ca -0.44 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.39 3b78 h LEU 747 Cb 1.98 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.61 3b78 h LEU 747 CO 0.02 0.49 0.00 0.59 0.09 0.00 0.00 178.44 179.64 3b78 n ASN 748 N -4.71 0.00 -0.11 -0.43 3.02 -1.23 -0.45 115.26 111.36 3b78 n ASN 748 Ca -0.01 -1.08 0.01 0.00 -0.03 0.00 0.00 54.58 53.47 3b78 n ASN 748 Cb 0.12 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.31 3b78 n ASN 748 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3b78 n LYS 749 N -0.70 1.80 -0.28 3.52 5.02 -0.80 -4.59 118.16 122.12 3b78 n LYS 749 Ca 0.07 -1.29 0.01 0.00 -2.02 0.00 0.00 58.31 55.07 3b78 n LYS 749 Cb 0.03 -1.05 0.01 0.00 -0.02 0.00 0.00 35.03 34.01 3b78 n LYS 749 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3b78 n LYS 750 N -0.17 0.26 -2.67 1.97 4.76 -0.49 -4.99 118.16 116.82 3b78 n LYS 750 Ca 0.02 -1.00 -0.21 0.00 -2.87 0.00 0.00 58.31 54.24 3b78 n LYS 750 Cb 0.21 -0.61 0.01 0.00 -1.84 0.00 0.00 35.03 32.80 3b78 n LYS 750 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3b78 n ARG 751 N -0.15 -3.05 -2.77 1.97 1.74 -0.93 -4.49 116.66 108.99 3b78 n ARG 751 Ca 0.01 0.95 -0.38 0.00 -0.77 0.00 0.00 57.85 57.67 3b78 n ARG 751 Cb 0.61 -5.70 -0.06 0.00 -1.02 0.00 0.00 32.46 26.28 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 -2.33 2.86 -0.25 -0.13 0.00 0.40 -4.55 107.32 103.33 3b78 s GLY 752 Ca 0.13 0.54 0.01 0.00 0.00 0.00 0.00 44.72 45.40 3b78 s GLY 752 CO 0.16 1.01 -0.09 1.62 0.00 0.00 0.00 173.10 175.81 3b78 s GLN 753 N -1.88 2.53 -0.05 2.90 0.74 -0.44 -4.59 119.66 118.86 3b78 s GLN 753 Ca 0.48 -1.17 -0.30 0.00 0.05 0.00 0.00 55.36 54.43 3b78 s GLN 753 Cb -0.20 -2.93 -0.06 0.00 1.10 0.00 0.00 33.01 30.92 3b78 s GLN 753 CO 0.25 -0.49 1.74 0.08 -0.55 0.00 0.00 175.29 176.33 3b78 s VAL 754 N 1.21 3.44 -0.11 1.34 1.01 -1.26 -0.45 120.40 125.58 3b78 s VAL 754 Ca -0.04 0.53 -0.04 0.00 0.00 0.00 0.00 61.98 62.43 3b78 s VAL 754 Cb -0.18 -3.36 -0.01 0.00 0.00 0.00 0.00 36.38 32.83 3b78 s VAL 754 CO -0.05 -0.06 -0.07 0.58 0.00 0.00 0.00 175.10 175.49 3b78 h VAL 755 N 5.68 0.00 -2.30 2.92 2.07 -0.23 -3.48 116.25 120.91 3b78 h VAL 755 Ca -0.41 -0.96 -0.04 0.00 0.82 0.00 0.00 66.70 66.11 3b78 h VAL 755 Cb 1.19 0.00 -0.24 0.00 -1.52 0.00 0.00 31.29 30.72 3b78 h VAL 755 CO 0.95 0.00 -0.18 -0.94 0.02 0.00 0.00 177.57 177.43 3b78 s SER 756 N -5.54 -0.72 -0.24 0.57 1.04 -1.05 -5.00 113.70 102.76 3b78 s SER 756 Ca -0.06 1.23 -0.08 0.00 0.48 0.00 0.00 55.95 57.52 3b78 s SER 756 Cb 0.01 1.33 -0.03 0.00 0.10 0.00 0.00 66.02 67.42 3b78 s SER 756 CO 0.09 -0.22 0.08 -0.70 0.98 0.00 0.00 173.24 173.47 3b78 s GLU 757 N 1.94 3.76 0.33 4.02 2.12 -1.26 -1.34 118.70 128.27 3b78 s GLU 757 Ca -0.08 -0.43 0.04 0.00 0.36 0.00 0.00 54.97 54.86 3b78 s GLU 757 Cb -0.08 -3.33 -0.06 0.00 0.26 0.00 0.00 34.13 30.91 3b78 s GLU 757 CO -0.16 -0.07 0.06 -1.21 -0.54 0.00 0.00 175.26 173.34 3b78 s GLU 758 N 1.32 1.68 0.09 4.30 2.02 -1.16 -4.99 118.70 121.97 3b78 s GLU 758 Ca 0.05 -1.94 0.05 0.00 0.02 0.00 0.00 54.97 53.15 3b78 s GLU 758 Cb -0.15 -0.88 -0.03 0.00 0.10 0.00 0.00 34.13 33.17 3b78 s GLU 758 CO 0.04 -0.20 -0.13 -1.14 0.02 0.00 0.00 175.26 173.84 3b78 s GLN 759 N -3.88 0.88 0.07 1.61 0.74 -1.26 -0.42 119.66 117.40 3b78 s GLN 759 Ca 0.35 -1.08 -0.30 0.00 0.05 0.00 0.00 55.36 54.39 3b78 s GLN 759 Cb 0.08 -0.78 -0.05 0.00 1.10 0.00 0.00 33.01 33.36 3b78 s GLN 759 CO 0.15 0.16 1.03 0.50 -0.55 0.00 0.00 175.29 176.58 3b78 s ARG 760 N -2.22 4.59 0.27 1.67 3.52 -0.87 -4.95 118.95 120.95 3b78 s ARG 760 Ca 0.03 1.53 -0.04 0.00 -0.13 0.00 0.00 55.73 57.12 3b78 s ARG 760 Cb -0.07 -3.39 0.54 0.00 -1.56 0.00 0.00 34.95 30.47 3b78 s ARG 760 CO 0.02 0.02 1.61 -1.35 -0.81 0.00 0.00 175.30 174.79 3b78 h PRO 761 N 6.15 0.07 0.00 5.12 0.11 -2.00 -3.34 132.00 138.10 3b78 h PRO 761 Ca -0.42 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3b78 h PRO 761 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3b78 h PRO 761 CO 0.75 0.05 0.00 0.41 -0.21 0.00 0.00 178.00 178.99 3b78 n GLY 762 N -1.46 -0.20 3.76 -0.55 0.00 -1.26 -5.00 105.19 100.49 3b78 n GLY 762 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.49 2.91 0.00 2.61 -4.23 -1.26 -4.87 115.64 110.31 3b78 s THR 763 Ca 0.00 0.58 0.00 0.00 -1.18 0.00 0.00 61.69 61.09 3b78 s THR 763 Cb 0.00 -3.24 0.00 0.00 1.34 0.00 0.00 72.50 70.60 3b78 s THR 763 CO 0.00 -0.10 0.78 -2.65 -0.54 0.00 0.00 174.62 172.11 3b78 n PRO 764 N -1.30 0.55 -2.90 3.99 -0.02 -1.26 -4.05 135.00 130.00 3b78 n PRO 764 Ca 0.12 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.16 3b78 n PRO 764 Cb 0.50 -1.22 -0.04 0.00 -0.02 0.00 0.00 33.50 32.72 3b78 n PRO 764 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3b78 s LEU 765 N 0.00 4.66 1.10 2.45 2.96 -1.26 -1.37 118.68 127.22 3b78 s LEU 765 Ca 0.00 -1.28 -0.15 0.00 -0.22 0.00 0.00 54.13 52.47 3b78 s LEU 765 Cb 0.00 -2.40 0.24 0.00 0.50 0.00 0.00 46.19 44.53 3b78 s LEU 765 CO 0.00 -1.32 1.10 -0.36 -1.32 0.00 0.00 176.35 174.45 3b78 s PHE 766 N 3.59 1.36 -0.46 5.38 2.99 -0.54 -2.05 117.98 128.25 3b78 s PHE 766 Ca 0.23 0.77 0.06 0.00 0.00 0.00 0.00 56.93 57.98 3b78 s PHE 766 Cb -0.15 -3.34 0.18 0.00 0.00 0.00 0.00 43.02 39.71 3b78 s PHE 766 CO 0.05 -3.40 0.56 -0.08 -0.00 0.00 0.00 175.22 172.35 3b78 s THR 767 N -2.96 -0.52 -0.12 0.64 -1.32 0.43 -2.93 115.64 108.87 3b78 s THR 767 Ca 0.68 -1.42 -0.24 0.00 -1.21 0.00 0.00 61.69 59.50 3b78 s THR 767 Cb -0.15 -0.46 -0.03 0.00 -1.51 0.00 0.00 72.50 70.36 3b78 s THR 767 CO 0.57 -0.44 0.74 -0.69 -2.21 0.00 0.00 174.62 172.59 3b78 s VAL 768 N 0.76 4.98 -0.07 5.08 1.01 -0.59 -2.98 120.40 128.60 3b78 s VAL 768 Ca 0.28 1.49 -0.01 0.00 0.00 0.00 0.00 61.98 63.74 3b78 s VAL 768 Cb -0.01 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 3b78 s VAL 768 CO -0.09 0.15 0.02 -0.54 0.00 0.00 0.00 175.10 174.64 3b78 s LYS 769 N 1.42 2.98 0.13 2.72 1.02 -0.45 -1.08 119.74 126.47 3b78 s LYS 769 Ca 0.37 -0.43 -0.19 0.00 0.02 0.00 0.00 55.97 55.74 3b78 s LYS 769 Cb -0.17 -2.80 0.05 0.00 -0.52 0.00 0.00 37.83 34.39 3b78 s LYS 769 CO 0.15 0.69 0.47 0.00 -0.92 0.00 0.00 175.35 175.75 3b78 s ALA 770 N -0.96 -1.18 0.08 5.17 0.00 -0.45 0.55 121.76 124.97 3b78 s ALA 770 Ca 0.15 0.17 -0.06 0.00 0.00 0.00 0.00 51.96 52.23 3b78 s ALA 770 Cb -0.11 0.74 -0.05 0.00 0.00 0.00 0.00 23.12 23.69 3b78 s ALA 770 CO 0.05 -0.68 0.33 0.71 0.00 0.00 0.00 175.76 176.17 3b78 s TYR 771 N -3.70 3.53 -0.15 0.00 2.02 0.41 0.27 117.35 119.73 3b78 s TYR 771 Ca 0.02 0.58 -0.04 0.00 -0.37 0.00 0.00 57.07 57.25 3b78 s TYR 771 Cb 0.01 -2.01 0.06 0.00 -0.40 0.00 0.00 41.96 39.62 3b78 s TYR 771 CO -0.12 0.52 0.10 -1.17 -1.57 0.00 0.00 175.55 173.32 3b78 s LEU 772 N -2.21 0.25 0.20 -1.29 2.96 -0.57 -1.33 118.68 116.68 3b78 s LEU 772 Ca 0.35 -0.44 -0.32 0.00 -0.22 0.00 0.00 54.13 53.49 3b78 s LEU 772 Cb -0.13 -0.14 -0.15 0.00 0.50 0.00 0.00 46.19 46.27 3b78 s LEU 772 CO 0.21 -0.33 1.30 -2.65 -1.32 0.00 0.00 176.35 173.56 3b78 n PRO 773 N 5.29 1.59 -0.12 0.98 -0.02 -1.26 -0.65 135.00 140.80 3b78 n PRO 773 Ca -0.06 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3b78 n PRO 773 Cb 0.49 -2.16 0.27 0.00 -0.02 0.00 0.00 33.50 32.08 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 2.92 1.19 0.00 -1.45 2.07 -1.85 -0.39 116.25 118.74 3b78 h VAL 774 Ca -0.44 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 66.56 3b78 h VAL 774 Cb 1.31 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 3b78 h VAL 774 CO 0.74 0.22 0.00 -0.46 0.02 0.00 0.00 177.57 178.09 3b78 n ASN 775 N -4.37 0.47 -0.09 0.57 6.94 -1.26 -2.21 115.26 115.31 3b78 n ASN 775 Ca 0.05 -1.53 0.01 0.00 -0.02 0.00 0.00 54.58 53.09 3b78 n ASN 775 Cb 0.12 -0.23 0.01 0.00 -2.36 0.00 0.00 39.78 37.32 3b78 n ASN 775 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3b78 n GLU 776 N -0.12 0.71 0.00 -3.83 -0.58 -0.16 -4.81 120.64 111.85 3b78 n GLU 776 Ca 0.00 -0.92 0.07 0.00 -0.42 0.00 0.00 57.16 55.89 3b78 n GLU 776 Cb 0.12 -0.67 0.06 0.00 -0.57 0.00 0.00 31.44 30.38 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 -0.19 2.15 -4.63 1.62 3.41 -0.94 -4.83 113.62 110.21 3b78 n SER 777 Ca 0.01 -1.57 -0.43 0.00 -0.26 0.00 0.00 58.87 56.62 3b78 n SER 777 Cb 0.49 0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.44 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 -1.21 1.77 -0.98 7.33 0.08 -1.26 -1.73 117.98 121.98 3b78 s PHE 778 Ca 0.16 0.35 0.00 0.00 0.12 0.00 0.00 56.93 57.57 3b78 s PHE 778 Cb 0.12 -4.02 0.00 0.00 -0.57 0.00 0.00 43.02 38.55 3b78 s PHE 778 CO 0.19 -3.65 0.00 0.41 -0.10 0.00 0.00 175.22 172.07 3b78 n GLY 779 N 4.84 0.27 0.16 4.36 0.00 -1.26 -4.94 105.19 108.62 3b78 n GLY 779 Ca 0.21 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.31 -0.99 1.61 3.57 -1.66 -2.88 116.94 116.28 3b78 h PHE 780 Ca -0.25 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.29 3b78 h PHE 780 Cb 1.06 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.84 3b78 h PHE 780 CO 0.29 -0.18 0.65 1.15 -2.23 0.00 0.00 178.31 177.99 3b78 h THR 781 N -0.36 1.15 -0.16 4.41 2.02 -1.92 -1.19 112.91 116.86 3b78 h THR 781 Ca -0.03 -0.42 0.05 0.00 0.77 0.00 0.00 66.41 66.77 3b78 h THR 781 Cb 0.27 -0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.49 3b78 h THR 781 CO 0.06 0.22 0.17 1.23 0.37 0.00 0.00 175.52 177.57 3b78 h GLY 782 N 1.23 0.00 0.55 2.16 0.00 -1.92 0.24 103.07 105.33 3b78 h GLY 782 Ca 0.40 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.52 3b78 h GLY 782 CO -0.14 0.00 -1.82 1.18 0.00 0.00 0.00 176.54 175.76 3b78 n GLU 783 N -3.88 0.65 0.16 4.80 1.02 -0.54 -4.10 120.64 118.74 3b78 n GLU 783 Ca 0.01 0.10 0.08 0.00 -0.02 0.00 0.00 57.16 57.33 3b78 n GLU 783 Cb 0.29 -1.68 0.08 0.00 -0.02 0.00 0.00 31.44 30.11 3b78 n GLU 783 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3b78 h LEU 784 N 0.00 0.00 -1.00 -4.62 5.85 -0.31 -3.12 115.31 112.10 3b78 h LEU 784 Ca -0.27 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.38 3b78 h LEU 784 Cb 1.75 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.76 3b78 h LEU 784 CO 0.04 0.20 -0.34 -0.09 -0.34 0.00 0.00 178.44 177.91 3b78 h ARG 785 N 0.00 0.00 -0.18 1.25 9.65 -0.72 -3.12 114.38 121.26 3b78 h ARG 785 Ca -0.02 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.82 3b78 h ARG 785 Cb 1.17 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.72 3b78 h ARG 785 CO 0.02 0.34 -0.06 1.04 2.80 0.00 0.00 179.97 184.11 3b78 n GLN 786 N -3.53 2.07 0.00 0.20 6.02 -1.22 -2.74 117.38 118.18 3b78 n GLN 786 Ca -0.00 -2.89 0.00 0.00 -0.01 0.00 0.00 57.00 54.09 3b78 n GLN 786 Cb 0.48 -1.72 0.00 0.00 1.02 0.00 0.00 30.24 30.02 3b78 n GLN 786 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3b78 n ALA 787 N -0.98 1.78 0.27 -1.58 0.00 -1.18 -4.71 120.51 114.11 3b78 n ALA 787 Ca 0.22 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.70 3b78 n ALA 787 Cb 0.84 0.09 0.02 0.00 0.00 0.00 0.00 19.45 20.39 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 -1.50 0.00 0.00 0.00 -2.24 -1.19 -3.92 114.28 105.44 3b78 n THR 788 Ca 0.00 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 3b78 n THR 788 Cb 0.18 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 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 0.47 1.69 0.00 3.38 0.00 -1.25 -3.84 105.19 105.64 3b78 n GLY 789 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.00 0.93 0.18 -0.02 0.00 -1.11 -4.93 105.19 98.24 3b78 n GLY 790 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 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 3.02 0.00 -6.60 1.61 4.20 -1.89 -3.46 115.11 112.00 3b78 h GLN 791 Ca 0.00 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 58.20 3b78 h GLN 791 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 3b78 h GLN 791 CO 0.00 0.17 0.32 0.00 -0.67 0.00 0.00 178.83 178.64 3b78 s ALA 792 N -3.13 3.31 -0.42 3.87 0.00 -1.26 -4.58 121.76 119.55 3b78 s ALA 792 Ca 0.05 0.54 -0.06 0.00 0.00 0.00 0.00 51.96 52.48 3b78 s ALA 792 Cb 0.06 -3.19 0.10 0.00 0.00 0.00 0.00 23.12 20.10 3b78 s ALA 792 CO 0.71 0.10 0.25 0.12 0.00 0.00 0.00 175.76 176.94 3b78 s PHE 793 N -0.55 3.46 0.97 0.00 5.36 0.29 -4.97 117.98 122.54 3b78 s PHE 793 Ca 0.43 -1.99 -0.11 0.00 -0.96 0.00 0.00 56.93 54.29 3b78 s PHE 793 Cb -0.24 -3.18 0.17 0.00 -0.34 0.00 0.00 43.02 39.43 3b78 s PHE 793 CO 0.29 -0.94 1.09 -2.14 -1.46 0.00 0.00 175.22 172.07 3b78 s PRO 794 N 1.29 0.61 0.00 10.12 0.02 -1.26 -2.92 135.00 142.86 3b78 s PRO 794 Ca 0.05 1.14 0.00 0.00 0.02 0.00 0.00 61.00 62.21 3b78 s PRO 794 Cb -0.24 -1.71 0.00 0.00 0.02 0.00 0.00 34.50 32.57 3b78 s PRO 794 CO -0.01 -2.78 0.00 0.94 -0.33 0.00 0.00 177.00 174.82 3b78 n GLN 795 N -4.29 0.00 -3.81 5.54 7.27 -1.02 -4.93 117.38 116.13 3b78 n GLN 795 Ca 0.08 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 57.03 3b78 n GLN 795 Cb 0.53 0.00 -0.09 0.00 2.41 0.00 0.00 30.24 33.09 3b78 n GLN 795 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3b78 s MET 796 N 0.00 0.55 0.07 3.69 0.23 -1.26 0.72 119.30 123.29 3b78 s MET 796 Ca 0.00 -0.22 -0.06 0.00 -1.03 0.00 0.00 55.69 54.38 3b78 s MET 796 Cb 0.00 0.24 -0.01 0.00 -1.53 0.00 0.00 34.83 33.53 3b78 s MET 796 CO 0.00 -0.14 0.12 0.54 -2.03 0.00 0.00 175.02 173.52 3b78 s VAL 797 N -1.18 0.16 0.19 5.16 0.11 -1.22 -4.91 120.40 118.71 3b78 s VAL 797 Ca -0.12 -1.28 -0.33 0.00 -2.93 0.00 0.00 61.98 57.32 3b78 s VAL 797 Cb -0.06 -1.25 -0.13 0.00 -1.53 0.00 0.00 36.38 33.41 3b78 s VAL 797 CO 0.03 -0.71 1.60 0.33 -3.33 0.00 0.00 175.10 173.02 3b78 n PHE 798 N 0.21 2.43 -0.00 1.54 7.35 -1.26 -0.68 117.46 127.04 3b78 n PHE 798 Ca -0.16 0.23 -0.01 0.00 -0.76 0.00 0.00 57.45 56.75 3b78 n PHE 798 Cb 0.61 -2.57 -0.00 0.00 0.35 0.00 0.00 39.48 37.86 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 3.31 0.57 -3.81 -2.13 4.64 -0.38 -4.81 116.55 113.94 3b78 n ASP 799 Ca 0.15 0.08 -0.11 0.00 -1.38 0.00 0.00 54.79 53.54 3b78 n ASP 799 Cb 0.31 -0.30 -0.06 0.00 -1.04 0.00 0.00 41.12 40.03 3b78 n ASP 799 CO 0.00 0.00 0.00 -1.38 -0.82 0.00 0.00 177.20 175.00 3b78 s HIS 800 N -1.54 0.70 -0.07 -0.67 -3.43 -1.17 -5.02 115.29 104.10 3b78 s HIS 800 Ca -0.04 -1.01 -0.04 0.00 -0.80 0.00 0.00 55.06 53.17 3b78 s HIS 800 Cb 0.01 -0.02 -0.04 0.00 -1.43 0.00 0.00 32.58 31.10 3b78 s HIS 800 CO 0.06 -0.98 0.12 -1.58 -2.00 0.00 0.00 174.74 170.37 3b78 s TRP 801 N -3.75 3.48 -0.16 0.38 0.52 -1.26 -1.91 118.94 116.23 3b78 s TRP 801 Ca 0.28 0.39 0.00 0.00 0.02 0.00 0.00 56.10 56.79 3b78 s TRP 801 Cb 0.01 -1.86 0.03 0.00 -1.15 0.00 0.00 33.47 30.50 3b78 s TRP 801 CO 0.13 0.65 -0.14 0.45 0.02 0.00 0.00 176.95 178.06 3b78 s SER 802 N -1.37 2.83 -0.08 2.95 0.15 0.18 -4.92 113.70 113.44 3b78 s SER 802 Ca 0.19 -0.57 -0.30 0.00 0.70 0.00 0.00 55.95 55.98 3b78 s SER 802 Cb -0.12 -1.21 -0.03 0.00 -1.71 0.00 0.00 66.02 62.96 3b78 s SER 802 CO 0.09 -0.07 1.23 -0.89 1.20 0.00 0.00 173.24 174.80 3b78 s THR 803 N 1.46 4.24 0.10 6.45 2.01 -1.26 -0.87 115.64 127.76 3b78 s THR 803 Ca 0.04 1.55 -0.30 0.00 0.31 0.00 0.00 61.69 63.29 3b78 s THR 803 Cb -0.13 -4.00 -0.06 0.00 0.01 0.00 0.00 72.50 68.32 3b78 s THR 803 CO -0.10 -0.04 1.11 -0.76 -0.69 0.00 0.00 174.62 174.14 3b78 s LEU 804 N 2.56 4.42 0.48 4.42 1.43 -0.40 -4.94 118.68 126.66 3b78 s LEU 804 Ca 0.56 1.97 0.28 0.00 -1.03 0.00 0.00 54.13 55.90 3b78 s LEU 804 Cb -0.24 -3.59 0.90 0.00 0.03 0.00 0.00 46.19 43.29 3b78 s LEU 804 CO 0.20 -0.32 1.81 1.23 0.23 0.00 0.00 176.35 179.50 3b78 h GLY 805 N 6.11 0.00 -1.51 -3.19 0.00 -1.94 -3.41 103.07 99.12 3b78 h GLY 805 Ca -0.43 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.40 3b78 h GLY 805 CO 0.76 0.00 0.36 -1.35 0.00 0.00 0.00 176.54 176.32 3b78 s SER 806 N -5.99 5.27 -0.41 0.19 1.04 -1.26 -4.98 113.70 107.56 3b78 s SER 806 Ca 0.03 1.78 -0.27 0.00 0.48 0.00 0.00 55.95 57.97 3b78 s SER 806 Cb 0.08 -2.52 0.02 0.00 0.10 0.00 0.00 66.02 63.70 3b78 s SER 806 CO 0.61 -1.51 1.00 -0.62 0.98 0.00 0.00 173.24 173.69 3b78 s ASP 807 N -3.21 6.66 0.09 7.02 3.68 -1.26 -4.73 116.67 124.92 3b78 s ASP 807 Ca 0.62 0.51 0.13 0.00 2.13 0.00 0.00 52.55 55.93 3b78 s ASP 807 Cb -0.16 -2.49 0.57 0.00 -1.45 0.00 0.00 42.92 39.39 3b78 s ASP 807 CO 0.48 -1.00 1.39 -0.81 0.13 0.00 0.00 175.17 175.36 3b78 n PRO 808 N 7.14 0.05 0.11 4.34 -0.04 -1.26 -1.47 135.00 143.87 3b78 n PRO 808 Ca 0.09 0.41 0.06 0.00 -0.04 0.00 0.00 63.50 64.01 3b78 n PRO 808 Cb 0.48 -1.63 0.01 0.00 -0.04 0.00 0.00 33.50 32.32 3b78 n PRO 808 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3b78 h LEU 809 N 0.00 0.00 -8.55 1.53 3.38 -1.90 -3.38 115.31 106.39 3b78 h LEU 809 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 3b78 h LEU 809 Cb 0.16 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.78 3b78 h LEU 809 CO 0.00 0.31 0.39 -0.62 0.09 0.00 0.00 178.44 178.61 3b78 s ASP 810 N -5.92 6.36 0.41 -0.43 2.15 -0.54 -4.90 116.67 113.81 3b78 s ASP 810 Ca 0.01 -0.29 0.13 0.00 0.43 0.00 0.00 52.55 52.83 3b78 s ASP 810 Cb 0.08 -2.39 0.97 0.00 -0.30 0.00 0.00 42.92 41.28 3b78 s ASP 810 CO 0.77 -1.02 1.95 -0.65 -0.17 0.00 0.00 175.17 176.05 3b78 h PRO 811 N 9.09 0.48 0.00 4.34 0.11 -1.83 -1.18 132.00 143.01 3b78 h PRO 811 Ca -0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3b78 h PRO 811 Cb 1.08 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3b78 h PRO 811 CO 1.00 0.32 0.00 1.79 -0.21 0.00 0.00 178.00 180.90 3b78 h THR 812 N 0.50 0.00 -4.26 -1.15 1.35 -1.92 -1.79 112.91 105.63 3b78 h THR 812 Ca 0.33 -0.52 -0.46 0.00 -0.55 0.00 0.00 66.41 65.20 3b78 h THR 812 Cb 0.60 1.45 0.13 0.00 -1.73 0.00 0.00 68.15 68.60 3b78 h THR 812 CO -0.11 0.00 0.31 -0.94 -0.25 0.00 0.00 175.52 174.53 3b78 s SER 813 N -4.91 3.70 0.17 5.36 1.04 -0.45 -4.83 113.70 113.78 3b78 s SER 813 Ca 0.07 1.00 -0.12 0.00 0.48 0.00 0.00 55.95 57.39 3b78 s SER 813 Cb 0.10 -1.60 0.07 0.00 0.10 0.00 0.00 66.02 64.69 3b78 s SER 813 CO 0.55 -2.44 1.70 0.50 0.98 0.00 0.00 173.24 174.54 3b78 h LYS 814 N -1.42 0.91 0.03 4.02 3.64 -1.87 -1.85 116.57 120.02 3b78 h LYS 814 Ca -0.50 -0.20 -0.21 0.00 -1.27 0.00 0.00 60.65 58.47 3b78 h LYS 814 Cb 1.32 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 3b78 h LYS 814 CO 0.62 0.82 -0.96 0.00 -2.27 0.00 0.00 179.45 177.66 3b78 h ALA 815 N 1.05 0.42 -0.52 5.00 0.00 -1.85 -3.27 119.26 120.09 3b78 h ALA 815 Ca 0.19 -0.79 -0.01 0.00 0.00 0.00 0.00 54.91 54.31 3b78 h ALA 815 Cb 0.29 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3b78 h ALA 815 CO -0.01 0.99 0.30 0.78 0.00 0.00 0.00 179.25 181.32 3b78 h GLY 816 N 2.04 0.76 1.55 0.00 0.00 -1.47 -1.63 103.07 104.32 3b78 h GLY 816 Ca -0.05 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 3b78 h GLY 816 CO 0.14 0.32 -0.09 1.05 0.00 0.00 0.00 176.54 177.97 3b78 h GLU 817 N 0.70 0.55 -0.39 4.80 4.11 -0.48 0.25 114.58 124.12 3b78 h GLU 817 Ca 0.18 -0.15 -0.02 0.00 0.07 0.00 0.00 59.36 59.44 3b78 h GLU 817 Cb 0.01 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 3b78 h GLU 817 CO -0.03 0.64 0.15 0.82 0.07 0.00 0.00 179.01 180.65 3b78 h ILE 818 N 0.51 1.20 -0.22 -1.06 2.04 -1.53 -0.53 117.51 117.92 3b78 h ILE 818 Ca 0.10 -0.62 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 3b78 h ILE 818 Cb 0.46 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 3b78 h ILE 818 CO 0.02 0.22 0.05 0.58 0.00 0.00 0.00 178.15 179.02 3b78 h VAL 819 N 0.48 1.21 -0.02 1.67 2.07 -0.86 -1.95 116.25 118.86 3b78 h VAL 819 Ca 0.13 -0.69 0.03 0.00 0.82 0.00 0.00 66.70 66.98 3b78 h VAL 819 Cb 0.20 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 3b78 h VAL 819 CO -0.01 0.22 -0.16 0.25 0.02 0.00 0.00 177.57 177.89 3b78 h LEU 820 N 0.16 -0.46 -0.80 2.57 5.85 -0.39 0.11 115.31 122.35 3b78 h LEU 820 Ca 0.07 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 3b78 h LEU 820 Cb 0.29 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 3b78 h LEU 820 CO 0.00 -0.21 0.48 0.00 -0.34 0.00 0.00 178.44 178.37 3b78 h ALA 821 N 0.71 1.02 -0.26 1.25 0.00 -1.10 -1.55 119.26 119.33 3b78 h ALA 821 Ca 0.06 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3b78 h ALA 821 Cb 0.33 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3b78 h ALA 821 CO -0.17 0.49 -0.21 0.00 0.00 0.00 0.00 179.25 179.37 3b78 h ALA 822 N 1.26 1.17 -0.08 0.00 0.00 -0.96 -1.83 119.26 118.82 3b78 h ALA 822 Ca 0.29 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3b78 h ALA 822 Cb -0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3b78 h ALA 822 CO -0.05 0.53 -0.06 0.00 0.00 0.00 0.00 179.25 179.66 3b78 h ARG 823 N 0.42 0.17 -0.49 0.00 3.08 -0.27 -2.73 114.38 114.57 3b78 h ARG 823 Ca 0.07 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 3b78 h ARG 823 Cb 0.60 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 3b78 h ARG 823 CO 0.04 0.59 0.22 0.87 -1.07 0.00 0.00 179.97 180.62 3b78 h LYS 824 N -0.24 0.70 -0.16 0.04 1.57 -1.25 -1.98 116.57 115.25 3b78 h LYS 824 Ca 0.01 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.65 3b78 h LYS 824 Cb 0.55 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 3b78 h LYS 824 CO 0.02 0.55 -0.15 -0.09 -0.57 0.00 0.00 179.45 179.21 3b78 h ARG 825 N 0.70 0.26 -0.04 3.15 2.43 -1.27 -2.11 114.38 117.49 3b78 h ARG 825 Ca 0.17 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 3b78 h ARG 825 Cb 0.10 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 3b78 h ARG 825 CO -0.02 0.41 0.00 0.72 -1.51 0.00 0.00 179.97 179.57 3b78 n HIS 826 N -4.25 0.03 -2.99 2.20 8.25 -0.86 -4.95 115.22 112.65 3b78 n HIS 826 Ca -0.01 -0.02 -0.12 0.00 -0.26 0.00 0.00 57.72 57.32 3b78 n HIS 826 Cb 0.29 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.45 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 1.22 -0.03 3.42 -1.41 0.00 -0.79 -5.05 105.19 102.54 3b78 n GLY 827 Ca 0.18 -0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 3b78 n GLY 827 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3b78 s MET 828 N -5.16 1.55 -0.17 1.61 0.23 -0.80 -5.04 119.30 111.52 3b78 s MET 828 Ca 0.12 -1.82 -0.37 0.00 -1.03 0.00 0.00 55.69 52.59 3b78 s MET 828 Cb -0.05 -0.96 -0.13 0.00 -1.53 0.00 0.00 34.83 32.15 3b78 s MET 828 CO 0.46 -0.07 1.84 1.63 -2.03 0.00 0.00 175.02 176.84 3b78 n LYS 829 N -0.60 1.76 -0.33 3.16 5.02 -1.26 -4.31 118.16 121.61 3b78 n LYS 829 Ca -0.04 0.65 0.22 0.00 -2.02 0.00 0.00 58.31 57.11 3b78 n LYS 829 Cb 0.65 -2.43 0.42 0.00 -0.02 0.00 0.00 35.03 33.64 3b78 n LYS 829 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3b78 h GLU 830 N 8.50 0.07 -6.23 1.97 5.08 -1.93 -3.39 114.58 118.65 3b78 h GLU 830 Ca -0.47 -0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.33 3b78 h GLU 830 Cb 1.29 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.48 3b78 h GLU 830 CO 0.96 0.05 0.18 -1.21 -1.00 0.00 0.00 179.01 177.98 3b78 s GLU 831 N -5.78 4.49 -0.10 2.33 8.01 -1.26 -4.81 118.70 121.58 3b78 s GLU 831 Ca -0.11 1.07 -0.30 0.00 0.01 0.00 0.00 54.97 55.65 3b78 s GLU 831 Cb 0.30 -3.41 -0.03 0.00 -4.31 0.00 0.00 34.13 26.68 3b78 s GLU 831 CO 0.78 0.14 1.30 0.08 0.01 0.00 0.00 175.26 177.56 3b78 s VAL 832 N 0.46 4.13 0.24 2.63 1.01 -1.26 -4.97 120.40 122.64 3b78 s VAL 832 Ca 0.41 1.42 -0.31 0.00 0.00 0.00 0.00 61.98 63.50 3b78 s VAL 832 Cb -0.20 -3.92 -0.13 0.00 0.00 0.00 0.00 36.38 32.14 3b78 s VAL 832 CO 0.22 -0.07 1.55 -2.65 0.00 0.00 0.00 175.10 174.15 3b78 n PRO 833 N 6.02 2.38 -1.11 2.72 -0.02 -1.26 -4.98 135.00 138.76 3b78 n PRO 833 Ca 0.13 0.85 -0.29 0.00 -2.02 0.00 0.00 63.50 62.17 3b78 n PRO 833 Cb 0.45 -2.60 0.20 0.00 -0.02 0.00 0.00 33.50 31.53 3b78 n PRO 833 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3b78 s GLY 834 N 0.60 1.56 0.54 -1.23 0.00 -1.26 -4.92 107.32 102.62 3b78 s GLY 834 Ca 0.70 -0.54 0.32 0.00 0.00 0.00 0.00 44.72 45.19 3b78 s GLY 834 CO 0.45 0.17 2.06 0.11 0.00 0.00 0.00 173.10 175.88 3b78 h TRP 835 N -2.16 0.00 0.00 1.90 5.08 -1.90 -2.54 115.95 116.33 3b78 h TRP 835 Ca -0.53 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.42 3b78 h TRP 835 Cb 1.32 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.48 3b78 h TRP 835 CO -0.41 0.08 -0.10 1.96 -1.28 0.00 0.00 178.44 178.69 3b78 h GLN 836 N 0.00 0.00 -0.03 0.12 7.50 -1.91 0.41 115.11 121.20 3b78 h GLN 836 Ca -0.00 0.00 -0.14 0.00 0.50 0.00 0.00 58.65 59.01 3b78 h GLN 836 Cb 0.40 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.91 3b78 h GLN 836 CO 0.01 0.10 -0.64 1.49 -1.50 0.00 0.00 178.83 178.29 3b78 h GLU 837 N 0.00 0.12 0.00 1.46 4.81 -1.81 -3.27 114.58 115.89 3b78 h GLU 837 Ca -0.00 -0.09 -0.25 0.00 -0.13 0.00 0.00 59.36 58.89 3b78 h GLU 837 Cb 0.38 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.73 3b78 h GLU 837 CO 0.01 0.72 -2.09 0.66 -0.73 0.00 0.00 179.01 177.59 3b78 n TYR 838 N -3.81 0.25 -1.74 0.92 4.02 -1.01 -4.93 117.16 110.86 3b78 n TYR 838 Ca -0.02 0.08 -0.36 0.00 -0.01 0.00 0.00 57.90 57.60 3b78 n TYR 838 Cb 0.64 -0.92 0.07 0.00 -0.02 0.00 0.00 39.34 39.10 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 -2.80 2.15 0.00 -0.72 5.04 0.10 -4.51 117.35 116.61 3b78 s TYR 839 Ca -0.08 1.52 -0.36 0.00 -2.44 0.00 0.00 57.07 55.71 3b78 s TYR 839 Cb 0.08 -3.59 -0.15 0.00 0.35 0.00 0.00 41.96 38.66 3b78 s TYR 839 CO 0.84 -2.68 1.60 -3.47 -1.34 0.00 0.00 175.55 170.51 3b78 n ASP 840 N -2.02 2.60 -4.58 4.32 4.64 0.52 -4.84 116.55 117.18 3b78 n ASP 840 Ca 0.15 1.07 -0.42 0.00 -1.38 0.00 0.00 54.79 54.21 3b78 n ASP 840 Cb 0.49 -1.29 -0.03 0.00 -1.04 0.00 0.00 41.12 39.26 3b78 n ASP 840 CO 0.00 0.00 0.00 -0.75 -0.82 0.00 0.00 177.20 175.63 3b78 s LYS 841 N 1.96 3.27 0.00 -0.67 2.20 -1.26 -5.03 119.74 120.21 3b78 s LYS 841 Ca 0.87 0.85 0.00 0.00 -0.36 0.00 0.00 55.97 57.33 3b78 s LYS 841 Cb -0.84 -4.16 0.00 0.00 -1.51 0.00 0.00 37.83 31.32 3b78 s LYS 841 CO 0.49 -1.95 0.00 1.47 -0.36 0.00 0.00 175.35 175.00