#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g2g s THR 15 N 0.00 1.17 -1.06 -0.39 -4.23 -1.26 -4.06 115.64 105.81 3g2g s THR 15 Ca 0.00 -2.03 0.00 0.00 -1.18 0.00 0.00 61.69 58.48 3g2g s THR 15 Cb 0.00 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.26 3g2g s THR 15 CO 0.00 -0.16 0.00 0.00 -0.54 0.00 0.00 174.62 173.92 3g2g n GLN 16 N -0.57 -2.04 -3.54 3.99 6.02 0.45 -1.29 117.38 120.41 3g2g n GLN 16 Ca -0.03 0.60 -0.26 0.00 -0.01 0.00 0.00 57.00 57.29 3g2g n GLN 16 Cb 0.65 -5.11 0.02 0.00 1.02 0.00 0.00 30.24 26.82 3g2g n GLN 16 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3g2g n GLN 17 N -2.56 -4.80 0.19 -1.09 1.13 -1.26 -4.77 117.38 104.22 3g2g n GLN 17 Ca -0.13 0.63 0.05 0.00 -1.94 0.00 0.00 57.00 55.60 3g2g n GLN 17 Cb 0.56 -5.47 0.36 0.00 0.11 0.00 0.00 30.24 25.80 3g2g n GLN 17 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 3g2g h LEU 18 N -1.61 0.00 -0.30 1.08 3.38 -1.52 -0.46 115.31 115.88 3g2g h LEU 18 Ca -0.52 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.42 3g2g h LEU 18 Cb 1.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.08 3g2g h LEU 18 CO 0.60 0.38 0.06 -0.74 0.09 0.00 0.00 178.44 178.84 3g2g h HIS 19 N 0.00 0.53 0.00 1.13 2.76 -1.89 -2.61 115.15 115.06 3g2g h HIS 19 Ca -0.00 -0.07 -0.04 0.00 -2.20 0.00 0.00 60.37 58.06 3g2g h HIS 19 Cb 0.81 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.62 3g2g h HIS 19 CO 0.00 0.57 -0.18 0.00 -1.30 0.00 0.00 177.93 177.02 3g2g h ALA 20 N 0.89 1.29 0.00 5.26 0.00 -1.68 -2.62 119.26 122.39 3g2g h ALA 20 Ca 0.09 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 3g2g h ALA 20 Cb 0.32 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3g2g h ALA 20 CO 0.00 0.23 -0.31 0.00 0.00 0.00 0.00 179.25 179.17 3g2g h ALA 21 N 1.82 1.39 -0.33 0.00 0.00 -0.71 -2.75 119.26 118.67 3g2g h ALA 21 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3g2g h ALA 21 Cb 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3g2g h ALA 21 CO 0.02 0.39 0.00 -1.33 0.00 0.00 0.00 179.25 178.34 3g2g n MET 22 N -4.04 1.98 -2.13 0.00 2.81 -0.99 -4.67 117.12 110.08 3g2g n MET 22 Ca -0.02 -1.50 -0.37 0.00 -1.81 0.00 0.00 57.70 54.00 3g2g n MET 22 Cb 0.37 -1.38 0.01 0.00 -0.71 0.00 0.00 33.22 31.50 3g2g n MET 22 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3g2g s ALA 23 N -1.56 2.89 -0.50 3.04 0.00 -1.04 -4.95 121.76 119.64 3g2g s ALA 23 Ca 0.32 1.02 0.24 0.00 0.00 0.00 0.00 51.96 53.54 3g2g s ALA 23 Cb 0.17 -3.43 0.37 0.00 0.00 0.00 0.00 23.12 20.24 3g2g s ALA 23 CO 0.24 -0.86 1.47 -0.44 0.00 0.00 0.00 175.76 176.17 3g2g h ASP 24 N 1.78 0.00 -4.65 0.00 3.32 -1.92 -3.47 116.42 111.48 3g2g h ASP 24 Ca -0.50 -0.04 -0.24 0.00 0.02 0.00 0.00 57.03 56.27 3g2g h ASP 24 Cb 1.26 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.67 3g2g h ASP 24 CO 0.59 0.02 -0.68 0.42 -1.72 0.00 0.00 179.24 177.87 3g2g s THR 25 N -3.21 0.63 0.19 0.35 -4.23 -1.26 -5.05 115.64 103.06 3g2g s THR 25 Ca 0.06 -1.95 -0.06 0.00 -1.18 0.00 0.00 61.69 58.56 3g2g s THR 25 Cb 0.09 -1.86 0.01 0.00 1.34 0.00 0.00 72.50 72.08 3g2g s THR 25 CO 0.69 -0.71 1.57 0.15 -0.54 0.00 0.00 174.62 175.78 3g2g h PHE 26 N 2.87 0.95 -0.12 3.99 3.04 -1.99 -1.20 116.94 124.49 3g2g h PHE 26 Ca -0.36 -0.24 0.02 0.00 3.98 0.00 0.00 57.97 61.37 3g2g h PHE 26 Cb 1.18 -0.22 -0.02 0.00 2.56 0.00 0.00 35.95 39.45 3g2g h PHE 26 CO 0.56 1.01 -0.02 1.25 -2.02 0.00 0.00 178.31 179.09 3g2g h LEU 27 N 0.70 -0.08 -1.38 0.59 5.85 -1.99 -0.51 115.31 118.48 3g2g h LEU 27 Ca 0.08 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 3g2g h LEU 27 Cb 0.83 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 3g2g h LEU 27 CO 0.07 -0.02 -0.24 -0.08 -0.34 0.00 0.00 178.44 177.83 3g2g h GLU 28 N 0.02 0.10 -0.06 1.25 4.57 -1.95 -0.37 114.58 118.15 3g2g h GLU 28 Ca 0.06 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.23 3g2g h GLU 28 Cb 0.08 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 3g2g h GLU 28 CO -0.11 0.34 -0.05 1.25 -1.18 0.00 0.00 179.01 179.26 3g2g h HIS 29 N 0.10 -0.12 -0.05 0.92 2.76 -0.43 -1.90 115.15 116.42 3g2g h HIS 29 Ca 0.02 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 3g2g h HIS 29 Cb 0.48 0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.48 3g2g h HIS 29 CO 0.00 -0.08 -0.08 0.52 -1.30 0.00 0.00 177.93 176.99 3g2g h MET 30 N -0.07 -0.11 -0.33 5.26 2.86 -0.59 -2.26 114.93 119.70 3g2g h MET 30 Ca 0.04 0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.79 3g2g h MET 30 Cb 0.13 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3g2g h MET 30 CO -0.10 -0.07 0.47 0.00 1.06 0.00 0.00 176.91 178.27 3g2g n ARG 32 N -3.46 0.88 -1.66 0.00 1.74 -0.75 -4.96 116.66 108.45 3g2g n ARG 32 Ca 0.06 -0.39 -0.46 0.00 -0.77 0.00 0.00 57.85 56.29 3g2g n ARG 32 Cb 0.62 -1.42 -0.04 0.00 -1.02 0.00 0.00 32.46 30.60 3g2g n ARG 32 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3g2g n LEU 33 N -0.88 2.87 -3.77 0.55 4.77 -0.73 -4.43 117.00 115.37 3g2g n LEU 33 Ca 0.06 1.12 -0.28 0.00 -0.03 0.00 0.00 56.01 56.87 3g2g n LEU 33 Cb 0.36 -1.39 -0.16 0.00 -2.33 0.00 0.00 43.42 39.89 3g2g n LEU 33 CO 0.34 -0.51 -0.38 -0.62 -1.33 0.00 0.00 177.39 174.90 3g2g s ASP 34 N 0.55 3.08 0.40 -1.43 3.68 -1.26 -4.99 116.67 116.69 3g2g s ASP 34 Ca 0.74 -0.89 0.26 0.00 2.13 0.00 0.00 52.55 54.80 3g2g s ASP 34 Cb -0.70 -0.71 1.42 0.00 -1.45 0.00 0.00 42.92 41.48 3g2g s ASP 34 CO 0.45 -0.29 1.80 0.16 0.13 0.00 0.00 175.17 177.41 3g2g h ILE 35 N 6.54 0.00 -0.72 4.11 3.07 -2.03 -1.03 117.51 127.45 3g2g h ILE 35 Ca -0.17 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.24 3g2g h ILE 35 Cb 1.11 0.58 0.00 0.00 -0.27 0.00 0.00 36.82 38.24 3g2g h ILE 35 CO 0.35 0.00 0.00 0.47 -1.05 0.00 0.00 178.15 177.92 3g2g n ASP 36 N -2.42 4.06 -4.33 2.16 10.43 -1.26 -4.78 116.55 120.41 3g2g n ASP 36 Ca -0.02 -2.06 -0.45 0.00 2.57 0.00 0.00 54.79 54.83 3g2g n ASP 36 Cb 0.06 -0.50 -0.06 0.00 1.84 0.00 0.00 41.12 42.45 3g2g n ASP 36 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 3g2g s SER 37 N -0.99 6.11 0.37 -2.24 0.15 -0.39 -4.92 113.70 111.79 3g2g s SER 37 Ca 0.49 -1.63 -0.26 0.00 0.70 0.00 0.00 55.95 55.24 3g2g s SER 37 Cb 0.26 -2.18 -0.09 0.00 -1.71 0.00 0.00 66.02 62.31 3g2g s SER 37 CO 0.32 -0.76 1.16 -2.84 1.20 0.00 0.00 173.24 172.32 3g2g s PRO 38 N 1.59 4.22 0.89 5.44 0.02 -1.26 -4.36 135.00 141.53 3g2g s PRO 38 Ca 0.04 1.85 -0.12 0.00 0.02 0.00 0.00 61.00 62.78 3g2g s PRO 38 Cb -0.27 -2.81 0.12 0.00 0.02 0.00 0.00 34.50 31.55 3g2g s PRO 38 CO 0.04 -0.18 1.10 -1.25 -0.33 0.00 0.00 177.00 176.38 3g2g s PRO 39 N -2.09 1.35 1.11 5.54 0.04 -1.26 -0.41 135.00 139.28 3g2g s PRO 39 Ca 0.54 0.59 -0.17 0.00 0.04 0.00 0.00 61.00 62.00 3g2g s PRO 39 Cb -0.31 -1.84 0.24 0.00 0.04 0.00 0.00 34.50 32.63 3g2g s PRO 39 CO 0.40 -2.12 1.14 0.96 0.04 0.00 0.00 177.00 177.42 3g2g s ILE 40 N -3.09 1.77 0.05 0.56 -4.36 -1.26 -4.78 121.20 110.09 3g2g s ILE 40 Ca 0.63 0.00 -0.13 0.00 -0.26 0.00 0.00 60.65 60.89 3g2g s ILE 40 Cb -0.16 -2.59 -0.31 0.00 1.25 0.00 0.00 42.46 40.64 3g2g s ILE 40 CO 0.55 0.00 1.08 0.74 0.24 0.00 0.00 174.94 177.55 3g2g h THR 41 N -2.23 1.32 -4.00 8.37 2.02 -1.91 -3.46 112.91 113.03 3g2g h THR 41 Ca -0.47 -2.64 -0.53 0.00 0.77 0.00 0.00 66.41 63.53 3g2g h THR 41 Cb 1.30 2.85 0.11 0.00 -1.74 0.00 0.00 68.15 70.67 3g2g h THR 41 CO 0.41 0.79 0.61 0.00 0.37 0.00 0.00 175.52 177.71 3g2g s ALA 42 N -2.80 3.07 -0.14 6.16 0.00 -1.26 -5.02 121.76 121.77 3g2g s ALA 42 Ca -0.08 1.27 0.01 0.00 0.00 0.00 0.00 51.96 53.16 3g2g s ALA 42 Cb 0.05 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.67 3g2g s ALA 42 CO 0.93 -1.06 -0.15 0.50 0.00 0.00 0.00 175.76 175.97 3g2g s ARG 43 N -2.58 2.35 0.10 0.00 3.00 -1.26 -4.92 118.95 115.65 3g2g s ARG 43 Ca 0.64 -0.59 0.15 0.00 -1.00 0.00 0.00 55.73 54.93 3g2g s ARG 43 Cb -0.39 -2.08 -0.11 0.00 0.00 0.00 0.00 34.95 32.37 3g2g s ARG 43 CO 0.48 -0.17 0.97 -0.91 0.00 0.00 0.00 175.30 175.67 3g2g h ASN 44 N 7.80 0.00 -3.35 -2.12 2.35 -1.91 -3.46 115.58 114.89 3g2g h ASN 44 Ca -0.36 0.00 -0.60 0.00 -0.55 0.00 0.00 56.30 54.79 3g2g h ASN 44 Cb 1.15 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 39.43 3g2g h ASN 44 CO 0.52 0.63 0.35 -0.89 -1.65 0.00 0.00 177.43 176.39 3g2g s THR 45 N -2.89 4.90 0.43 2.81 2.01 -1.26 0.16 115.64 121.80 3g2g s THR 45 Ca -0.01 1.42 -0.26 0.00 0.31 0.00 0.00 61.69 63.15 3g2g s THR 45 Cb 0.08 -4.05 -0.08 0.00 0.01 0.00 0.00 72.50 68.46 3g2g s THR 45 CO 0.80 -0.02 1.39 -0.83 -0.69 0.00 0.00 174.62 175.27 3g2g s GLY 46 N 1.35 2.92 -0.19 4.40 0.00 -0.96 -4.83 107.32 110.01 3g2g s GLY 46 Ca 0.32 1.40 -0.04 0.00 0.00 0.00 0.00 44.72 46.40 3g2g s GLY 46 CO 0.08 2.01 -0.04 -0.42 0.00 0.00 0.00 173.10 174.73 3g2g s ILE 47 N -1.22 3.59 -0.25 0.90 1.01 -1.26 -1.29 121.20 122.68 3g2g s ILE 47 Ca 0.59 -0.44 -0.06 0.00 0.00 0.00 0.00 60.65 60.74 3g2g s ILE 47 Cb -0.42 -2.60 -0.01 0.00 0.01 0.00 0.00 42.46 39.43 3g2g s ILE 47 CO 0.54 0.45 0.04 -0.63 0.00 0.00 0.00 174.94 175.34 3g2g s ILE 48 N 0.99 3.94 -0.14 2.92 1.01 -0.16 -1.87 121.20 127.89 3g2g s ILE 48 Ca 0.00 -0.39 -0.02 0.00 0.00 0.00 0.00 60.65 60.24 3g2g s ILE 48 Cb -0.15 -2.87 -0.02 0.00 0.01 0.00 0.00 42.46 39.43 3g2g s ILE 48 CO 0.01 0.31 -0.09 0.00 0.00 0.00 0.00 174.94 175.16 3g2g s THR 50 N 0.40 4.30 0.13 0.00 2.01 -0.16 -0.81 115.64 121.51 3g2g s THR 50 Ca -0.08 1.63 -0.14 0.00 0.31 0.00 0.00 61.69 63.41 3g2g s THR 50 Cb -0.15 -4.04 -0.07 0.00 0.01 0.00 0.00 72.50 68.25 3g2g s THR 50 CO 0.04 0.03 0.54 -0.63 -0.69 0.00 0.00 174.62 173.91 3g2g s ILE 51 N 1.94 4.87 0.00 1.82 -1.09 -0.74 -2.01 121.20 125.99 3g2g s ILE 51 Ca 0.55 0.84 0.00 0.00 -2.23 0.00 0.00 60.65 59.81 3g2g s ILE 51 Cb -0.25 -3.74 0.00 0.00 -1.58 0.00 0.00 42.46 36.89 3g2g s ILE 51 CO 0.23 0.29 0.00 0.61 -1.23 0.00 0.00 174.94 174.84 3g2g n GLY 52 N 0.93 2.14 0.42 6.18 0.00 -1.24 -4.79 105.19 108.83 3g2g n GLY 52 Ca -0.06 -0.81 0.23 0.00 0.00 0.00 0.00 46.02 45.37 3g2g n GLY 52 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3g2g h PRO 53 N 0.00 0.34 0.00 1.61 0.11 -1.84 0.31 132.00 132.53 3g2g h PRO 53 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 3g2g h PRO 53 Cb 0.00 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.03 3g2g h PRO 53 CO 0.00 0.22 0.00 0.00 -0.21 0.00 0.00 178.00 178.01 3g2g n ALA 54 N -2.53 2.12 -1.03 -0.75 0.00 -0.42 -4.08 120.51 113.82 3g2g n ALA 54 Ca 0.22 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.67 3g2g n ALA 54 Cb 0.84 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.84 3g2g n ALA 54 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3g2g n SER 55 N -2.27 0.00 0.08 0.00 3.41 0.41 -4.87 113.62 110.38 3g2g n SER 55 Ca 0.05 -1.00 -0.09 0.00 -0.26 0.00 0.00 58.87 57.57 3g2g n SER 55 Cb 0.38 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.32 3g2g n SER 55 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3g2g h ARG 56 N 0.00 0.19 -7.13 4.33 2.43 -0.68 -3.37 114.38 110.16 3g2g h ARG 56 Ca 0.00 -0.21 -0.55 0.00 -0.81 0.00 0.00 59.98 58.41 3g2g h ARG 56 Cb 0.93 0.06 0.15 0.00 -0.42 0.00 0.00 29.97 30.69 3g2g h ARG 56 CO 0.00 0.95 0.47 -1.54 -1.51 0.00 0.00 179.97 178.34 3g2g s SER 57 N -6.93 4.58 0.23 -3.80 1.04 -1.26 -4.81 113.70 102.75 3g2g s SER 57 Ca -0.03 2.50 -0.08 0.00 0.48 0.00 0.00 55.95 58.83 3g2g s SER 57 Cb 0.10 -2.61 0.25 0.00 0.10 0.00 0.00 66.02 63.86 3g2g s SER 57 CO 0.83 -2.01 1.87 0.58 0.98 0.00 0.00 173.24 175.49 3g2g h VAL 58 N 0.35 1.12 -0.38 5.02 2.07 -1.90 -1.70 116.25 120.84 3g2g h VAL 58 Ca -0.50 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 3g2g h VAL 58 Cb 1.32 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 3g2g h VAL 58 CO 0.52 0.19 0.18 -0.33 0.02 0.00 0.00 177.57 178.15 3g2g h GLU 59 N 1.02 0.55 -0.29 1.57 3.07 -1.95 -2.17 114.58 116.38 3g2g h GLU 59 Ca 0.33 -0.08 -0.16 0.00 -0.50 0.00 0.00 59.36 58.94 3g2g h GLU 59 Cb 0.02 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 27.83 3g2g h GLU 59 CO -0.12 0.49 -0.47 1.15 -1.40 0.00 0.00 179.01 178.66 3g2g h THR 60 N 0.48 1.29 -0.98 1.13 2.02 -1.87 -2.98 112.91 111.99 3g2g h THR 60 Ca 0.13 -1.66 0.07 0.00 0.77 0.00 0.00 66.41 65.72 3g2g h THR 60 Cb 0.12 1.56 -0.07 0.00 -1.74 0.00 0.00 68.15 68.02 3g2g h THR 60 CO -0.02 0.54 0.63 -0.07 0.37 0.00 0.00 175.52 176.97 3g2g h LEU 61 N 0.62 0.99 -0.95 2.58 3.38 -1.11 0.95 115.31 121.78 3g2g h LEU 61 Ca 0.03 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3g2g h LEU 61 Cb 1.04 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 3g2g h LEU 61 CO 0.10 0.62 0.20 0.11 0.09 0.00 0.00 178.44 179.57 3g2g h LYS 62 N 1.11 0.97 -0.41 1.13 1.57 -1.25 -0.51 116.57 119.19 3g2g h LYS 62 Ca 0.43 -0.19 -0.14 0.00 -1.87 0.00 0.00 60.65 58.88 3g2g h LYS 62 Cb 0.22 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 3g2g h LYS 62 CO -0.18 0.83 -0.31 0.93 -0.57 0.00 0.00 179.45 180.16 3g2g h GLU 63 N 0.94 0.91 -0.26 3.15 4.39 -1.13 -1.37 114.58 121.22 3g2g h GLU 63 Ca 0.21 -0.43 -0.06 0.00 0.34 0.00 0.00 59.36 59.42 3g2g h GLU 63 Cb 0.26 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 3g2g h GLU 63 CO -0.01 1.08 -0.10 0.52 -1.16 0.00 0.00 179.01 179.34 3g2g h MET 64 N 0.76 0.42 -0.04 2.33 2.86 -0.39 0.31 114.93 121.17 3g2g h MET 64 Ca 0.08 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3g2g h MET 64 Cb 0.88 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.49 3g2g h MET 64 CO 0.08 0.53 -0.00 0.82 1.06 0.00 0.00 176.91 179.40 3g2g h ILE 65 N 0.39 1.25 0.00 -1.22 2.04 -0.84 0.08 117.51 119.21 3g2g h ILE 65 Ca 0.08 -0.77 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 3g2g h ILE 65 Cb 0.43 1.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.20 3g2g h ILE 65 CO 0.02 0.21 -0.01 0.11 0.00 0.00 0.00 178.15 178.49 3g2g h LYS 66 N -0.23 0.00 0.00 2.37 1.57 -0.88 -2.32 116.57 117.09 3g2g h LYS 66 Ca 0.01 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 3g2g h LYS 66 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 3g2g h LYS 66 CO 0.00 0.01 -0.61 0.77 -0.57 0.00 0.00 179.45 179.04 3g2g h SER 67 N 0.00 0.00 0.00 0.86 0.02 -0.10 -3.48 113.55 110.85 3g2g h SER 67 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3g2g h SER 67 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 3g2g h SER 67 CO 0.00 0.36 0.00 0.61 -1.14 0.00 0.00 176.83 176.66 3g2g n GLY 68 N 1.22 -0.72 3.75 -3.77 0.00 -0.68 -4.32 105.19 100.68 3g2g n GLY 68 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3g2g n GLY 68 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3g2g s MET 69 N 0.00 4.12 -0.01 1.61 0.00 -0.07 -4.50 119.30 120.44 3g2g s MET 69 Ca 0.00 2.58 0.02 0.00 0.00 0.00 0.00 55.69 58.29 3g2g s MET 69 Cb 0.00 -3.03 -0.02 0.00 0.00 0.00 0.00 34.83 31.78 3g2g s MET 69 CO 0.00 -0.65 0.01 0.09 0.00 0.00 0.00 175.02 174.47 3g2g n ASN 70 N 2.35 4.59 -3.93 1.11 5.03 -0.78 -4.68 115.26 118.95 3g2g n ASN 70 Ca 0.09 0.00 -0.22 0.00 0.87 0.00 0.00 54.58 55.32 3g2g n ASN 70 Cb 0.37 0.60 -0.16 0.00 -1.02 0.00 0.00 39.78 39.57 3g2g n ASN 70 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3g2g s VAL 71 N -2.05 0.76 -0.29 2.41 1.01 -1.09 -1.08 120.40 120.06 3g2g s VAL 71 Ca -0.01 -0.24 -0.16 0.00 0.00 0.00 0.00 61.98 61.58 3g2g s VAL 71 Cb 0.01 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 3g2g s VAL 71 CO 0.07 0.28 0.40 0.00 0.00 0.00 0.00 175.10 175.85 3g2g s ALA 72 N 0.93 3.54 -0.18 5.51 0.00 0.15 -1.47 121.76 130.24 3g2g s ALA 72 Ca -0.11 -0.90 -0.13 0.00 0.00 0.00 0.00 51.96 50.82 3g2g s ALA 72 Cb -0.15 -2.79 -0.05 0.00 0.00 0.00 0.00 23.12 20.14 3g2g s ALA 72 CO 0.01 -0.82 0.28 0.50 0.00 0.00 0.00 175.76 175.72 3g2g s ARG 73 N 2.13 4.23 -0.25 0.00 3.52 0.01 0.51 118.95 129.10 3g2g s ARG 73 Ca 0.15 0.05 -0.04 0.00 -0.13 0.00 0.00 55.73 55.76 3g2g s ARG 73 Cb -0.16 -3.45 0.01 0.00 -1.56 0.00 0.00 34.95 29.79 3g2g s ARG 73 CO 0.11 0.20 -0.01 -0.51 -0.81 0.00 0.00 175.30 174.27 3g2g s LEU 74 N 0.60 3.28 -0.49 -0.88 1.43 0.43 -1.80 118.68 121.25 3g2g s LEU 74 Ca 0.15 -0.66 -0.22 0.00 -1.03 0.00 0.00 54.13 52.37 3g2g s LEU 74 Cb -0.13 -1.75 0.04 0.00 0.03 0.00 0.00 46.19 44.38 3g2g s LEU 74 CO 0.04 -0.11 0.76 0.21 0.23 0.00 0.00 176.35 177.48 3g2g s ASN 75 N 1.43 6.32 -0.04 2.29 2.47 -1.26 -0.31 114.94 125.85 3g2g s ASN 75 Ca 0.03 -0.43 0.05 0.00 0.42 0.00 0.00 52.86 52.92 3g2g s ASN 75 Cb -0.16 -2.36 0.20 0.00 -1.45 0.00 0.00 41.25 37.48 3g2g s ASN 75 CO -0.02 -0.98 0.95 0.49 -3.72 0.00 0.00 177.10 173.82 3g2g n PHE 76 N 6.72 0.45 0.24 0.43 3.01 0.58 -2.80 117.46 126.09 3g2g n PHE 76 Ca -0.01 -0.17 0.14 0.00 1.01 0.00 0.00 57.45 58.42 3g2g n PHE 76 Cb 0.47 -0.13 0.46 0.00 -0.01 0.00 0.00 39.48 40.27 3g2g n PHE 76 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3g2g h SER 77 N 1.09 0.00 -4.76 4.37 0.02 -1.85 -3.37 113.55 109.06 3g2g h SER 77 Ca 0.00 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.74 3g2g h SER 77 Cb 0.67 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.06 3g2g h SER 77 CO 0.08 0.07 -0.69 -1.00 -1.14 0.00 0.00 176.83 174.16 3g2g s HIS 78 N -3.50 0.85 0.01 3.45 3.76 -1.12 -5.03 115.29 113.71 3g2g s HIS 78 Ca 0.03 -0.97 0.00 0.00 -0.15 0.00 0.00 55.06 53.97 3g2g s HIS 78 Cb 0.08 -0.51 0.00 0.00 1.11 0.00 0.00 32.58 33.26 3g2g s HIS 78 CO 0.61 -0.22 0.00 0.41 -0.85 0.00 0.00 174.74 174.69 3g2g n GLY 79 N -0.04 -2.65 3.99 -2.22 0.00 -1.26 -4.87 105.19 98.14 3g2g n GLY 79 Ca -0.12 -1.43 -0.21 0.00 0.00 0.00 0.00 46.02 44.26 3g2g n GLY 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g2g s THR 80 N -3.09 2.56 0.21 2.61 -4.23 -1.26 -4.93 115.64 107.51 3g2g s THR 80 Ca 0.00 -0.74 -0.10 0.00 -1.18 0.00 0.00 61.69 59.67 3g2g s THR 80 Cb 0.00 -2.82 0.13 0.00 1.34 0.00 0.00 72.50 71.16 3g2g s THR 80 CO 0.00 0.00 1.82 0.45 -0.54 0.00 0.00 174.62 176.35 3g2g h HIS 81 N 0.05 0.70 -0.52 3.99 -0.00 -1.98 -0.74 115.15 116.65 3g2g h HIS 81 Ca -0.39 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 59.99 3g2g h HIS 81 Cb 1.29 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 28.45 3g2g h HIS 81 CO 0.27 0.36 0.30 0.93 -0.00 0.00 0.00 177.93 179.78 3g2g h GLU 82 N 0.72 0.72 0.23 2.45 3.07 -1.98 0.53 114.58 120.32 3g2g h GLU 82 Ca 0.28 -0.08 0.01 0.00 -0.50 0.00 0.00 59.36 59.08 3g2g h GLU 82 Cb 0.13 -0.15 -0.04 0.00 -0.84 0.00 0.00 28.75 27.86 3g2g h GLU 82 CO -0.15 0.55 -0.44 -0.92 -1.40 0.00 0.00 179.01 176.64 3g2g h TYR 83 N 0.70 -1.24 -0.62 4.33 3.20 -1.86 -1.00 116.97 120.48 3g2g h TYR 83 Ca 0.19 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 3g2g h TYR 83 Cb 0.03 0.51 -0.03 0.00 1.54 0.00 0.00 36.73 38.78 3g2g h TYR 83 CO -0.02 -0.56 0.29 0.45 -1.64 0.00 0.00 178.16 176.68 3g2g h HIS 84 N -0.75 0.87 -0.67 -3.82 3.86 -0.74 -0.12 115.15 113.78 3g2g h HIS 84 Ca -0.01 -0.03 0.05 0.00 -1.16 0.00 0.00 60.37 59.23 3g2g h HIS 84 Cb 0.73 -0.27 -0.05 0.00 1.06 0.00 0.00 27.41 28.87 3g2g h HIS 84 CO -0.33 0.64 0.38 0.00 0.86 0.00 0.00 177.93 179.48 3g2g h ALA 85 N 1.44 0.89 -0.40 2.45 0.00 0.24 0.11 119.26 123.99 3g2g h ALA 85 Ca 0.22 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 3g2g h ALA 85 Cb 0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3g2g h ALA 85 CO -0.03 0.07 0.05 1.49 0.00 0.00 0.00 179.25 180.83 3g2g h GLU 86 N 0.70 0.67 -0.16 0.00 4.81 0.30 0.36 114.58 121.26 3g2g h GLU 86 Ca 0.30 -0.19 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 3g2g h GLU 86 Cb 0.16 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 3g2g h GLU 86 CO -0.17 0.73 0.06 1.15 -0.73 0.00 0.00 179.01 180.06 3g2g h THR 87 N 0.52 0.98 -0.92 0.32 2.02 -0.70 0.42 112.91 115.54 3g2g h THR 87 Ca 0.12 -0.05 0.11 0.00 0.77 0.00 0.00 66.41 67.35 3g2g h THR 87 Cb 0.40 0.81 -0.08 0.00 -1.74 0.00 0.00 68.15 67.54 3g2g h THR 87 CO 0.01 0.03 0.55 0.40 0.37 0.00 0.00 175.52 176.88 3g2g h ILE 88 N 0.15 0.92 -0.23 3.11 2.04 -0.57 0.11 117.51 123.04 3g2g h ILE 88 Ca 0.07 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 3g2g h ILE 88 Cb 0.03 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.04 3g2g h ILE 88 CO -0.06 0.16 0.10 0.50 0.00 0.00 0.00 178.15 178.85 3g2g h LYS 89 N 0.90 0.33 -0.74 2.37 3.64 -0.16 -2.29 116.57 120.62 3g2g h LYS 89 Ca 0.45 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.73 3g2g h LYS 89 Cb 0.42 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.15 3g2g h LYS 89 CO -0.26 0.36 0.28 -0.91 -2.27 0.00 0.00 179.45 176.66 3g2g h ASN 90 N 0.22 1.03 -0.14 4.20 2.35 -0.04 -1.03 115.58 122.18 3g2g h ASN 90 Ca 0.08 -0.16 0.01 0.00 -0.55 0.00 0.00 56.30 55.68 3g2g h ASN 90 Cb 0.15 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 3g2g h ASN 90 CO -0.01 0.92 0.06 0.58 -1.65 0.00 0.00 177.43 177.33 3g2g h VAL 91 N 1.09 0.98 -0.24 2.81 2.07 -0.68 -1.60 116.25 120.68 3g2g h VAL 91 Ca 0.25 -0.05 -0.07 0.00 0.82 0.00 0.00 66.70 67.66 3g2g h VAL 91 Cb 0.23 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 3g2g h VAL 91 CO -0.02 0.02 -0.14 0.03 0.02 0.00 0.00 177.57 177.49 3g2g h ARG 92 N 0.13 0.40 -0.03 1.57 3.08 -1.13 0.02 114.38 118.42 3g2g h ARG 92 Ca 0.06 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 3g2g h ARG 92 Cb 0.03 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 3g2g h ARG 92 CO -0.06 0.54 0.00 1.15 -1.07 0.00 0.00 179.97 180.54 3g2g h THR 93 N 0.37 1.24 -0.27 2.04 2.02 -0.95 0.18 112.91 117.54 3g2g h THR 93 Ca 0.07 -0.74 0.03 0.00 0.77 0.00 0.00 66.41 66.54 3g2g h THR 93 Cb 0.47 1.68 -0.03 0.00 -1.74 0.00 0.00 68.15 68.53 3g2g h THR 93 CO 0.03 0.20 0.09 0.00 0.37 0.00 0.00 175.52 176.21 3g2g h ALA 94 N 0.71 0.31 0.23 6.16 0.00 -1.11 -1.47 119.26 124.08 3g2g h ALA 94 Ca 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3g2g h ALA 94 Cb 0.32 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3g2g h ALA 94 CO 0.00 -0.31 -0.12 1.15 0.00 0.00 0.00 179.25 179.97 3g2g h THR 95 N 0.22 0.74 0.00 0.00 2.02 -0.93 -2.67 112.91 112.29 3g2g h THR 95 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.30 3g2g h THR 95 Cb 0.09 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 3g2g h THR 95 CO -0.12 0.00 0.00 -0.33 0.37 0.00 0.00 175.52 175.44 3g2g h GLU 96 N -0.33 0.00 0.00 6.66 4.39 -0.87 -2.61 114.58 121.81 3g2g h GLU 96 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 3g2g h GLU 96 Cb 0.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 3g2g h GLU 96 CO 0.04 0.00 0.02 0.66 -1.16 0.00 0.00 179.01 178.57 3g2g h SER 97 N 0.00 0.00 -0.32 1.42 4.64 -0.89 0.72 113.55 119.12 3g2g h SER 97 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g2g h SER 97 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3g2g h SER 97 CO 0.00 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.45 3g2g n PHE 98 N -2.88 0.41 0.26 4.77 3.72 -0.98 -4.55 117.46 118.21 3g2g n PHE 98 Ca -0.03 -0.22 0.14 0.00 -0.05 0.00 0.00 57.45 57.30 3g2g n PHE 98 Cb 0.08 -0.00 0.68 0.00 -0.94 0.00 0.00 39.48 39.30 3g2g n PHE 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3g2g h ALA 99 N 4.32 1.08 -0.57 4.37 0.00 -1.00 -3.18 119.26 124.28 3g2g h ALA 99 Ca 0.00 -0.09 0.12 0.00 0.00 0.00 0.00 54.91 54.94 3g2g h ALA 99 Cb 0.96 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 3g2g h ALA 99 CO 0.00 0.12 0.39 0.66 0.00 0.00 0.00 179.25 180.42 3g2g h SER 100 N 0.00 0.22 -3.58 0.00 4.64 -1.80 -3.27 113.55 109.75 3g2g h SER 100 Ca -0.00 0.01 -0.68 0.00 -0.47 0.00 0.00 61.79 60.65 3g2g h SER 100 Cb 0.49 -0.04 -0.37 0.00 -0.31 0.00 0.00 62.40 62.17 3g2g h SER 100 CO 0.01 0.13 -0.61 -0.62 -0.87 0.00 0.00 176.83 174.87 3g2g s ASP 101 N -6.23 5.07 0.51 4.97 -1.08 -1.20 -4.97 116.67 113.73 3g2g s ASP 101 Ca -0.07 -2.11 0.17 0.00 -0.52 0.00 0.00 52.55 50.03 3g2g s ASP 101 Cb 0.20 -1.75 1.25 0.00 -1.46 0.00 0.00 42.92 41.15 3g2g s ASP 101 CO 0.74 -0.48 2.10 -0.65 0.52 0.00 0.00 175.17 177.40 3g2g h PRO 102 N 7.85 0.07 0.00 4.34 0.11 -1.83 0.26 132.00 142.80 3g2g h PRO 102 Ca -0.09 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.97 3g2g h PRO 102 Cb 1.03 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3g2g h PRO 102 CO 0.63 0.05 -0.19 0.82 -0.21 0.00 0.00 178.00 179.10 3g2g h ILE 103 N 0.07 0.82 -0.01 4.15 2.04 -1.92 -3.12 117.51 119.54 3g2g h ILE 103 Ca 0.08 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.21 3g2g h ILE 103 Cb 0.24 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.76 3g2g h ILE 103 CO -0.01 0.18 -0.30 0.18 0.00 0.00 0.00 178.15 178.21 3g2g n LEU 104 N -3.86 1.25 -4.75 1.44 4.77 0.79 -4.65 117.00 111.98 3g2g n LEU 104 Ca -0.02 -0.73 -0.41 0.00 -0.03 0.00 0.00 56.01 54.83 3g2g n LEU 104 Cb 0.28 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.34 3g2g n LEU 104 CO 0.33 0.25 0.95 -0.47 -1.33 0.00 0.00 177.39 177.12 3g2g s TYR 105 N -1.64 3.24 -0.25 -1.77 5.04 -0.37 -5.01 117.35 116.59 3g2g s TYR 105 Ca 0.09 1.36 0.02 0.00 -2.44 0.00 0.00 57.07 56.10 3g2g s TYR 105 Cb 0.10 -3.57 0.05 0.00 0.35 0.00 0.00 41.96 38.88 3g2g s TYR 105 CO 0.33 -1.65 -0.11 1.03 -1.34 0.00 0.00 175.55 173.82 3g2g s ARG 106 N -0.88 2.43 0.63 4.97 0.52 -1.26 -4.83 118.95 120.53 3g2g s ARG 106 Ca 0.52 -1.22 -0.18 0.00 -0.52 0.00 0.00 55.73 54.33 3g2g s ARG 106 Cb -0.37 -2.89 -0.05 0.00 0.52 0.00 0.00 34.95 32.17 3g2g s ARG 106 CO 0.43 -0.50 0.84 -2.30 0.02 0.00 0.00 175.30 173.79 3g2g n PRO 107 N 4.51 0.70 -4.00 3.54 -0.02 -1.26 -5.01 135.00 133.45 3g2g n PRO 107 Ca -0.15 0.28 -0.20 0.00 -2.02 0.00 0.00 63.50 61.41 3g2g n PRO 107 Cb 0.44 -2.06 -0.17 0.00 -0.02 0.00 0.00 33.50 31.69 3g2g n PRO 107 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3g2g s VAL 108 N -1.63 0.39 0.34 -1.45 1.01 -1.26 -4.88 120.40 112.93 3g2g s VAL 108 Ca 0.74 -0.00 -0.00 0.00 0.00 0.00 0.00 61.98 62.71 3g2g s VAL 108 Cb -0.40 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.47 3g2g s VAL 108 CO 0.49 0.21 0.55 0.00 0.00 0.00 0.00 175.10 176.35 3g2g s ALA 109 N 1.19 3.69 -0.13 5.51 0.00 -0.24 -4.91 121.76 126.87 3g2g s ALA 109 Ca -0.07 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.05 3g2g s ALA 109 Cb -0.14 -2.14 0.00 0.00 0.00 0.00 0.00 23.12 20.85 3g2g s ALA 109 CO -0.02 -0.00 -0.22 0.08 0.00 0.00 0.00 175.76 175.60 3g2g s VAL 110 N -2.31 2.15 -0.07 0.00 1.01 -1.26 0.32 120.40 120.24 3g2g s VAL 110 Ca 0.40 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.46 3g2g s VAL 110 Cb -0.10 -1.85 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 3g2g s VAL 110 CO 0.36 0.55 -0.20 0.00 0.00 0.00 0.00 175.10 175.81 3g2g s ALA 111 N 0.61 2.37 -0.27 5.51 0.00 0.18 -1.70 121.76 128.47 3g2g s ALA 111 Ca -0.12 -0.99 -0.08 0.00 0.00 0.00 0.00 51.96 50.77 3g2g s ALA 111 Cb -0.16 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.07 3g2g s ALA 111 CO 0.03 0.40 0.09 -1.17 0.00 0.00 0.00 175.76 175.11 3g2g s LEU 112 N -0.13 3.64 -0.28 0.00 0.20 -0.46 -0.43 118.68 121.22 3g2g s LEU 112 Ca -0.03 -0.32 -0.08 0.00 0.69 0.00 0.00 54.13 54.39 3g2g s LEU 112 Cb -0.14 -1.94 -0.01 0.00 -0.43 0.00 0.00 46.19 43.66 3g2g s LEU 112 CO 0.04 -0.08 0.10 -0.62 -0.29 0.00 0.00 176.35 175.49 3g2g s ASP 113 N 1.61 5.27 0.49 3.68 -1.08 0.58 -0.53 116.67 126.69 3g2g s ASP 113 Ca 0.06 -0.40 -0.15 0.00 -0.52 0.00 0.00 52.55 51.53 3g2g s ASP 113 Cb -0.16 -1.94 -0.08 0.00 -1.46 0.00 0.00 42.92 39.29 3g2g s ASP 113 CO 0.04 -0.11 0.94 0.42 0.52 0.00 0.00 175.17 176.98 3g2g s THR 114 N 1.59 4.58 0.02 1.71 -4.23 -0.79 -0.31 115.64 118.21 3g2g s THR 114 Ca 0.05 1.11 -0.25 0.00 -1.18 0.00 0.00 61.69 61.42 3g2g s THR 114 Cb -0.16 -3.72 -0.18 0.00 1.34 0.00 0.00 72.50 69.78 3g2g s THR 114 CO 0.04 -0.65 1.42 0.50 -0.54 0.00 0.00 174.62 175.39 3g2g h LYS 115 N 1.00 -0.05 0.00 3.99 3.64 -1.92 -3.39 116.57 119.83 3g2g h LYS 115 Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 3g2g h LYS 115 Cb 1.18 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 3g2g h LYS 115 CO 0.62 0.26 0.00 0.41 -2.27 0.00 0.00 179.45 178.47 3g2g n GLY 116 N -0.26 -0.68 2.71 5.01 0.00 -1.26 -4.14 105.19 106.57 3g2g n GLY 116 Ca -0.08 -1.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 3g2g n GLY 116 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3g2g n PRO 117 N -0.91 1.31 -1.75 1.61 -0.02 -1.26 -4.92 135.00 129.07 3g2g n PRO 117 Ca 0.00 -1.06 -0.30 0.00 -2.02 0.00 0.00 63.50 60.12 3g2g n PRO 117 Cb 0.00 -2.24 0.05 0.00 -0.02 0.00 0.00 33.50 31.29 3g2g n PRO 117 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3g2g s GLU 118 N 3.81 2.75 -0.13 -0.52 2.02 -1.26 -4.98 118.70 120.39 3g2g s GLU 118 Ca 0.26 0.62 -0.01 0.00 0.02 0.00 0.00 54.97 55.86 3g2g s GLU 118 Cb 0.07 -2.00 0.03 0.00 0.10 0.00 0.00 34.13 32.34 3g2g s GLU 118 CO -0.02 -1.15 -0.04 0.42 0.02 0.00 0.00 175.26 174.49 3g2g s ILE 119 N -3.23 0.91 0.06 -1.63 1.01 -1.26 -4.95 121.20 112.10 3g2g s ILE 119 Ca 0.58 -0.38 0.09 0.00 0.00 0.00 0.00 60.65 60.94 3g2g s ILE 119 Cb -0.12 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 3g2g s ILE 119 CO 0.53 0.21 -0.23 -0.13 0.00 0.00 0.00 174.94 175.32 3g2g s ARG 120 N 1.74 1.85 -1.22 2.79 1.81 -1.26 -0.14 118.95 124.52 3g2g s ARG 120 Ca 0.03 -1.10 -0.21 0.00 -1.72 0.00 0.00 55.73 52.73 3g2g s ARG 120 Cb -0.14 -2.05 -0.03 0.00 -0.45 0.00 0.00 34.95 32.28 3g2g s ARG 120 CO -0.07 0.51 1.87 0.25 -0.68 0.00 0.00 175.30 177.18 3g2g n THR 121 N 1.54 2.68 0.00 0.02 -2.24 0.00 -4.67 114.28 111.61 3g2g n THR 121 Ca -0.17 -2.77 0.00 0.00 -2.27 0.00 0.00 64.05 58.85 3g2g n THR 121 Cb 0.52 -2.25 0.00 0.00 -2.10 0.00 0.00 70.33 66.50 3g2g n THR 121 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3g2g n ASP 160 N 11.88 0.00 -4.52 3.42 5.75 -1.26 -3.63 116.55 128.19 3g2g n ASP 160 Ca 0.47 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.83 3g2g n ASP 160 Cb 0.46 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.46 3g2g n ASP 160 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 3g2g s TYR 161 N 0.00 3.18 0.00 2.11 6.04 -1.26 -5.01 117.35 122.40 3g2g s TYR 161 Ca 0.00 -0.16 0.00 0.00 0.04 0.00 0.00 57.07 56.95 3g2g s TYR 161 Cb 0.00 -2.84 0.00 0.00 -1.04 0.00 0.00 41.96 38.08 3g2g s TYR 161 CO 0.00 -0.59 0.64 0.36 -1.54 0.00 0.00 175.55 174.42 3g2g n LYS 162 N 5.57 0.00 0.00 4.97 -0.00 -1.26 -2.76 118.16 124.68 3g2g n LYS 162 Ca -0.07 0.30 0.00 0.00 -0.00 0.00 0.00 58.31 58.54 3g2g n LYS 162 Cb 0.48 -1.14 0.00 0.00 -0.00 0.00 0.00 35.03 34.37 3g2g n LYS 162 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 3g2g n ASN 163 N -1.14 1.64 -0.33 -5.58 0.23 -1.26 -4.36 115.26 104.46 3g2g n ASN 163 Ca 0.00 -1.63 -0.05 0.00 -0.53 0.00 0.00 54.58 52.38 3g2g n ASN 163 Cb 0.00 -0.41 -0.00 0.00 -2.08 0.00 0.00 39.78 37.29 3g2g n ASN 163 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 3g2g h ILE 164 N 0.09 0.04 0.00 1.53 1.08 -1.95 0.48 117.51 118.78 3g2g h ILE 164 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 3g2g h ILE 164 Cb 0.61 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.40 3g2g h ILE 164 CO 0.00 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.46 3g2g n LYS 166 N -1.24 1.67 0.00 0.00 -0.00 0.17 -4.36 118.16 114.40 3g2g n LYS 166 Ca 0.05 -1.33 0.00 0.00 -0.00 0.00 0.00 58.31 57.02 3g2g n LYS 166 Cb 0.06 -1.41 0.00 0.00 -0.00 0.00 0.00 35.03 33.68 3g2g n LYS 166 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 3g2g n VAL 167 N 0.53 0.00 -2.93 0.58 0.24 -0.50 -5.08 118.33 111.17 3g2g n VAL 167 Ca 0.10 -0.25 -0.27 0.00 -2.04 0.00 0.00 64.34 61.89 3g2g n VAL 167 Cb 0.48 0.79 -0.01 0.00 -1.47 0.00 0.00 33.84 33.63 3g2g n VAL 167 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 3g2g s VAL 168 N -1.00 4.96 0.01 3.34 -7.23 -0.85 -4.59 120.40 115.03 3g2g s VAL 168 Ca 0.00 0.04 -0.03 0.00 -1.81 0.00 0.00 61.98 60.18 3g2g s VAL 168 Cb 0.00 -3.84 -0.02 0.00 0.56 0.00 0.00 36.38 33.08 3g2g s VAL 168 CO 0.00 -0.69 0.08 2.29 -0.31 0.00 0.00 175.10 176.47 3g2g n LYS 173 N -1.91 0.00 -4.45 4.82 -0.00 -1.26 -4.96 118.16 110.40 3g2g n LYS 173 Ca -0.01 0.00 -0.24 0.00 -0.00 0.00 0.00 58.31 58.06 3g2g n LYS 173 Cb 0.55 -0.13 -0.17 0.00 -0.00 0.00 0.00 35.03 35.29 3g2g n LYS 173 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 3g2g s ILE 174 N -0.04 1.00 0.01 0.58 1.01 0.13 -4.26 121.20 119.62 3g2g s ILE 174 Ca 0.08 -0.39 0.05 0.00 0.00 0.00 0.00 60.65 60.39 3g2g s ILE 174 Cb -0.11 -0.93 -0.03 0.00 0.01 0.00 0.00 42.46 41.40 3g2g s ILE 174 CO 0.05 0.33 -0.14 -0.31 0.00 0.00 0.00 174.94 174.87 3g2g s TYR 175 N 0.79 2.69 -0.03 3.97 1.51 -0.49 -0.35 117.35 125.44 3g2g s TYR 175 Ca -0.13 -0.17 0.01 0.00 -1.01 0.00 0.00 57.07 55.78 3g2g s TYR 175 Cb -0.15 -1.55 0.02 0.00 -0.11 0.00 0.00 41.96 40.17 3g2g s TYR 175 CO 0.02 0.27 -0.04 0.08 -1.11 0.00 0.00 175.55 174.77 3g2g s VAL 176 N -0.90 0.45 -0.17 0.71 1.01 -0.29 -0.90 120.40 120.31 3g2g s VAL 176 Ca 0.15 -0.10 -0.06 0.00 0.00 0.00 0.00 61.98 61.96 3g2g s VAL 176 Cb -0.11 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 35.81 3g2g s VAL 176 CO 0.05 0.19 0.23 -0.67 0.00 0.00 0.00 175.10 174.90 3g2g n ASP 177 N 3.88 -4.38 -3.03 3.32 4.64 -0.24 -2.03 116.55 118.71 3g2g n ASP 177 Ca -0.24 0.22 -0.21 0.00 -1.38 0.00 0.00 54.79 53.19 3g2g n ASP 177 Cb 0.52 -2.76 0.01 0.00 -1.04 0.00 0.00 41.12 37.84 3g2g n ASP 177 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 3g2g n ASP 178 N -0.41 -4.56 -1.10 1.67 4.64 -1.26 -0.66 116.55 114.88 3g2g n ASP 178 Ca 0.05 -0.22 -0.12 0.00 -1.38 0.00 0.00 54.79 53.11 3g2g n ASP 178 Cb 0.18 -3.75 -0.05 0.00 -1.04 0.00 0.00 41.12 36.45 3g2g n ASP 178 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3g2g n GLY 179 N -1.19 1.18 0.18 0.27 0.00 -1.26 -4.81 105.19 99.55 3g2g n GLY 179 Ca -0.08 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.77 3g2g n GLY 179 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3g2g h LEU 180 N 0.00 0.72 -9.26 0.99 3.38 -0.95 -3.43 115.31 106.77 3g2g h LEU 180 Ca -0.25 -0.68 -0.59 0.00 0.09 0.00 0.00 57.88 56.45 3g2g h LEU 180 Cb 1.01 -0.22 -0.09 0.00 0.09 0.00 0.00 40.66 41.45 3g2g h LEU 180 CO 0.37 1.29 -0.16 -0.63 0.09 0.00 0.00 178.44 179.40 3g2g s ILE 181 N -3.55 5.19 0.09 1.22 1.01 -0.86 -4.23 121.20 120.07 3g2g s ILE 181 Ca -0.12 0.85 0.08 0.00 0.00 0.00 0.00 60.65 61.47 3g2g s ILE 181 Cb 0.06 -3.78 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 3g2g s ILE 181 CO 0.86 0.30 -0.18 -0.55 0.00 0.00 0.00 174.94 175.36 3g2g s SER 182 N 0.76 3.83 -0.03 3.58 0.15 -1.26 -1.13 113.70 119.60 3g2g s SER 182 Ca 0.23 -0.51 -0.06 0.00 0.70 0.00 0.00 55.95 56.31 3g2g s SER 182 Cb -0.15 -0.56 0.01 0.00 -1.71 0.00 0.00 66.02 63.61 3g2g s SER 182 CO 0.09 0.21 0.15 -0.76 1.20 0.00 0.00 173.24 174.12 3g2g s LEU 183 N -1.86 1.48 -0.02 3.45 1.43 0.53 -2.60 118.68 121.10 3g2g s LEU 183 Ca 0.16 0.08 0.06 0.00 -1.03 0.00 0.00 54.13 53.40 3g2g s LEU 183 Cb -0.11 0.59 -0.01 0.00 0.03 0.00 0.00 46.19 46.69 3g2g s LEU 183 CO 0.08 -0.20 -0.19 -1.58 0.23 0.00 0.00 176.35 174.69 3g2g s GLN 184 N -0.58 1.61 -1.32 1.70 0.74 -1.26 0.19 119.66 120.74 3g2g s GLN 184 Ca -0.07 -0.68 -0.13 0.00 0.05 0.00 0.00 55.36 54.53 3g2g s GLN 184 Cb -0.04 -1.53 -0.04 0.00 1.10 0.00 0.00 33.01 32.50 3g2g s GLN 184 CO 0.01 0.39 2.36 0.28 -0.55 0.00 0.00 175.29 177.78 3g2g n VAL 185 N 2.68 3.28 0.00 1.34 0.31 -1.26 -4.82 118.33 119.86 3g2g n VAL 185 Ca -0.15 -2.46 0.00 0.00 -0.01 0.00 0.00 64.34 61.71 3g2g n VAL 185 Cb 0.53 -2.51 0.00 0.00 -0.91 0.00 0.00 33.84 30.96 3g2g n VAL 185 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 3g2g n GLU 196 N 5.36 0.00 -2.14 5.55 0.28 -1.26 -5.06 120.64 123.37 3g2g n GLU 196 Ca 0.58 0.00 -0.40 0.00 -0.16 0.00 0.00 57.16 57.18 3g2g n GLU 196 Cb 0.32 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 33.16 3g2g n GLU 196 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 3g2g s VAL 197 N -2.38 3.49 -0.12 3.84 -7.23 -1.26 -4.55 120.40 112.18 3g2g s VAL 197 Ca 0.00 0.37 -0.25 0.00 -1.81 0.00 0.00 61.98 60.28 3g2g s VAL 197 Cb 0.00 -4.05 -0.22 0.00 0.56 0.00 0.00 36.38 32.67 3g2g s VAL 197 CO 0.00 -0.93 0.72 -0.33 -0.31 0.00 0.00 175.10 174.26 3g2g h GLU 198 N 13.49 -0.01 0.00 4.82 5.08 -1.87 -3.46 114.58 132.64 3g2g h GLU 198 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 3g2g h GLU 198 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 3g2g h GLU 198 CO 1.18 0.82 0.00 0.09 -1.00 0.00 0.00 179.01 180.10 3g2g n ASN 199 N -4.66 0.00 0.00 1.42 5.03 -1.19 -4.97 115.26 110.89 3g2g n ASN 199 Ca -0.09 -0.86 0.00 0.00 0.87 0.00 0.00 54.58 54.50 3g2g n ASN 199 Cb 0.40 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.16 3g2g n ASN 199 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3g2g n GLY 200 N 5.00 -0.52 0.00 7.41 0.00 -1.26 -4.24 105.19 111.58 3g2g n GLY 200 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.10 3g2g n GLY 200 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g2g n GLY 201 N 0.00 0.76 3.64 -0.02 0.00 -1.26 -4.71 105.19 103.60 3g2g n GLY 201 Ca 0.00 -1.98 -0.43 0.00 0.00 0.00 0.00 46.02 43.61 3g2g n GLY 201 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g2g s SER 202 N -4.00 6.87 0.17 1.61 1.04 -1.26 -5.02 113.70 113.11 3g2g s SER 202 Ca 0.00 1.22 -0.17 0.00 0.48 0.00 0.00 55.95 57.48 3g2g s SER 202 Cb 0.00 -2.54 -0.07 0.00 0.10 0.00 0.00 66.02 63.50 3g2g s SER 202 CO 0.00 -0.91 0.63 -0.22 0.98 0.00 0.00 173.24 173.72 3g2g s LEU 203 N 3.82 4.35 0.00 2.42 2.96 -1.26 -5.07 118.68 125.90 3g2g s LEU 203 Ca 0.50 1.24 0.00 0.00 -0.22 0.00 0.00 54.13 55.65 3g2g s LEU 203 Cb -0.15 -3.38 0.00 0.00 0.50 0.00 0.00 46.19 43.16 3g2g s LEU 203 CO 0.17 0.08 0.00 0.61 -1.32 0.00 0.00 176.35 175.89 3g2g n GLY 204 N 0.83 5.46 3.77 7.98 0.00 -1.26 -5.12 105.19 116.86 3g2g n GLY 204 Ca -0.04 -2.12 -0.39 0.00 0.00 0.00 0.00 46.02 43.46 3g2g n GLY 204 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3g2g s SER 205 N -0.19 7.23 -1.53 1.61 0.01 -1.26 -4.37 113.70 115.21 3g2g s SER 205 Ca 0.00 1.46 -0.01 0.00 1.31 0.00 0.00 55.95 58.71 3g2g s SER 205 Cb 0.00 -2.45 0.01 0.00 0.21 0.00 0.00 66.02 63.79 3g2g s SER 205 CO 0.00 0.15 0.02 2.29 0.41 0.00 0.00 173.24 176.11 3g2g n LYS 206 N 2.12 -0.93 -1.73 12.44 -0.00 -1.24 -4.90 118.16 123.92 3g2g n LYS 206 Ca -0.06 0.09 -0.31 0.00 -0.00 0.00 0.00 58.31 58.04 3g2g n LYS 206 Cb 0.50 -3.54 0.04 0.00 -0.00 0.00 0.00 35.03 32.03 3g2g n LYS 206 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 3g2g s LYS 207 N -7.28 3.04 0.18 -1.58 1.02 -1.26 -4.42 119.74 109.43 3g2g s LYS 207 Ca 0.03 0.74 -0.26 0.00 0.02 0.00 0.00 55.97 56.50 3g2g s LYS 207 Cb -0.02 -2.02 -0.08 0.00 -0.52 0.00 0.00 37.83 35.19 3g2g s LYS 207 CO 0.98 -0.97 0.81 0.20 -0.92 0.00 0.00 175.35 175.45 3g2g s GLY 208 N -4.05 2.97 0.01 -3.33 0.00 -1.26 -0.82 107.32 100.84 3g2g s GLY 208 Ca 0.57 0.42 0.08 0.00 0.00 0.00 0.00 44.72 45.79 3g2g s GLY 208 CO 0.54 0.94 -0.25 0.14 0.00 0.00 0.00 173.10 174.46 3g2g s VAL 209 N -1.15 2.16 -0.03 1.40 1.01 0.80 -1.07 120.40 123.51 3g2g s VAL 209 Ca 0.37 -1.24 0.05 0.00 0.00 0.00 0.00 61.98 61.16 3g2g s VAL 209 Cb -0.24 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 3g2g s VAL 209 CO 0.27 0.47 -0.19 0.20 0.00 0.00 0.00 175.10 175.85 3g2g s ASN 210 N -0.96 2.27 -0.74 3.32 -0.87 -0.08 -4.42 114.94 113.46 3g2g s ASN 210 Ca 0.11 -0.36 0.04 0.00 -1.57 0.00 0.00 52.86 51.07 3g2g s ASN 210 Cb -0.10 -0.48 0.20 0.00 -0.02 0.00 0.00 41.25 40.85 3g2g s ASN 210 CO 0.01 0.19 0.62 0.18 -2.57 0.00 0.00 177.10 175.54 3g2g n LEU 211 N 2.91 3.48 -4.69 0.60 4.77 -1.26 -1.40 117.00 121.42 3g2g n LEU 211 Ca -0.17 -5.24 -0.42 0.00 -0.03 0.00 0.00 56.01 50.15 3g2g n LEU 211 Cb 0.53 -0.82 -0.00 0.00 -2.33 0.00 0.00 43.42 40.80 3g2g n LEU 211 CO 0.25 1.77 0.87 -2.65 -1.33 0.00 0.00 177.39 176.30 3g2g n PRO 212 N 1.80 2.03 0.00 3.23 -0.02 -1.26 -1.65 135.00 139.13 3g2g n PRO 212 Ca 0.22 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 3g2g n PRO 212 Cb 0.36 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 3g2g n PRO 212 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g2g n GLY 213 N 0.81 2.68 3.73 -1.23 0.00 -1.26 -4.82 105.19 105.10 3g2g n GLY 213 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3g2g n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g2g s ALA 214 N -0.60 3.33 -1.15 4.61 0.00 -0.66 -4.99 121.76 122.30 3g2g s ALA 214 Ca 0.00 0.29 -0.19 0.00 0.00 0.00 0.00 51.96 52.06 3g2g s ALA 214 Cb 0.00 -3.04 0.08 0.00 0.00 0.00 0.00 23.12 20.16 3g2g s ALA 214 CO 0.00 -0.02 1.54 0.00 0.00 0.00 0.00 175.76 177.28 3g2g s ALA 215 N 0.28 3.19 -0.11 0.00 0.00 -1.26 -4.91 121.76 118.95 3g2g s ALA 215 Ca 0.40 -2.72 -0.29 0.00 0.00 0.00 0.00 51.96 49.35 3g2g s ALA 215 Cb -0.20 -4.48 -0.04 0.00 0.00 0.00 0.00 23.12 18.40 3g2g s ALA 215 CO 0.23 -3.32 1.53 0.08 0.00 0.00 0.00 175.76 174.28 3g2g s VAL 216 N 4.03 3.80 -0.37 0.00 1.01 -1.26 -4.91 120.40 122.70 3g2g s VAL 216 Ca 0.48 0.97 0.06 0.00 0.00 0.00 0.00 61.98 63.48 3g2g s VAL 216 Cb 0.01 -3.65 0.57 0.00 0.00 0.00 0.00 36.38 33.31 3g2g s VAL 216 CO -0.01 -0.11 1.61 -0.90 0.00 0.00 0.00 175.10 175.69 3g2g n ASP 217 N 7.12 4.02 -4.64 3.32 5.75 -1.26 -4.97 116.55 125.89 3g2g n ASP 217 Ca 0.16 -3.04 -0.30 0.00 -0.01 0.00 0.00 54.79 51.61 3g2g n ASP 217 Cb 0.44 -0.72 0.18 0.00 -1.03 0.00 0.00 41.12 39.99 3g2g n ASP 217 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3g2g s LEU 218 N -2.38 2.24 0.20 -2.12 1.43 -1.26 -4.97 118.68 111.81 3g2g s LEU 218 Ca 0.43 1.86 -0.30 0.00 -1.03 0.00 0.00 54.13 55.09 3g2g s LEU 218 Cb 0.35 -4.16 -0.08 0.00 0.03 0.00 0.00 46.19 42.34 3g2g s LEU 218 CO 0.10 -3.20 0.96 -2.16 0.23 0.00 0.00 176.35 172.28 3g2g s PRO 219 N -4.68 4.78 0.23 1.29 0.04 -1.26 -4.95 135.00 130.46 3g2g s PRO 219 Ca 0.66 1.51 -0.06 0.00 0.04 0.00 0.00 61.00 63.15 3g2g s PRO 219 Cb -0.22 -3.31 0.31 0.00 0.04 0.00 0.00 34.50 31.33 3g2g s PRO 219 CO 0.59 0.38 1.84 0.00 0.04 0.00 0.00 177.00 179.86 3g2g h ALA 220 N 4.64 1.13 -3.58 8.56 0.00 -1.96 -3.36 119.26 124.68 3g2g h ALA 220 Ca -0.44 -0.01 -0.62 0.00 0.00 0.00 0.00 54.91 53.84 3g2g h ALA 220 Cb 1.20 -0.22 -0.39 0.00 0.00 0.00 0.00 17.79 18.39 3g2g h ALA 220 CO 0.69 0.24 -0.77 0.08 0.00 0.00 0.00 179.25 179.50 3g2g s VAL 221 N -6.07 1.62 0.51 0.00 1.01 -1.26 -4.46 120.40 111.75 3g2g s VAL 221 Ca -0.13 -1.52 -0.04 0.00 0.00 0.00 0.00 61.98 60.30 3g2g s VAL 221 Cb 0.18 -2.00 0.11 0.00 0.00 0.00 0.00 36.38 34.67 3g2g s VAL 221 CO 0.78 -0.30 0.70 -1.54 0.00 0.00 0.00 175.10 174.74 3g2g n SER 222 N 4.60 0.58 -0.05 3.32 3.41 -1.26 -4.84 113.62 119.38 3g2g n SER 222 Ca -0.07 -1.57 -0.11 0.00 -0.26 0.00 0.00 58.87 56.85 3g2g n SER 222 Cb 0.43 -0.48 -0.06 0.00 -0.26 0.00 0.00 64.21 63.84 3g2g n SER 222 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3g2g h GLU 223 N 0.00 0.25 -0.69 4.33 3.07 -1.99 -0.09 114.58 119.46 3g2g h GLU 223 Ca -0.23 -0.07 0.09 0.00 -0.50 0.00 0.00 59.36 58.66 3g2g h GLU 223 Cb 0.76 -0.03 -0.07 0.00 -0.84 0.00 0.00 28.75 28.57 3g2g h GLU 223 CO 0.21 0.43 0.34 -0.22 -1.40 0.00 0.00 179.01 178.37 3g2g h LYS 224 N 0.04 0.56 -0.30 2.33 3.64 -1.99 -1.49 116.57 119.35 3g2g h LYS 224 Ca 0.05 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 3g2g h LYS 224 Cb 0.30 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 3g2g h LYS 224 CO 0.00 0.37 0.19 -0.44 -2.27 0.00 0.00 179.45 177.31 3g2g h ASP 225 N 0.58 0.33 -0.33 4.20 3.32 -1.79 0.03 116.42 122.76 3g2g h ASP 225 Ca 0.34 -0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.42 3g2g h ASP 225 Cb 0.36 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.79 3g2g h ASP 225 CO -0.27 0.24 0.10 0.40 -1.72 0.00 0.00 179.24 177.99 3g2g h ILE 226 N 0.40 0.89 -0.13 0.35 2.04 -0.28 0.23 117.51 121.00 3g2g h ILE 226 Ca 0.11 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.83 3g2g h ILE 226 Cb -0.03 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 3g2g h ILE 226 CO -0.03 0.04 -0.21 1.56 0.00 0.00 0.00 178.15 179.51 3g2g h GLN 227 N 0.23 0.22 -0.13 2.37 1.08 -1.01 -1.03 115.11 116.84 3g2g h GLN 227 Ca 0.15 -0.06 -0.12 0.00 -1.45 0.00 0.00 58.65 57.16 3g2g h GLN 227 Cb 0.13 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 3g2g h GLN 227 CO -0.16 0.43 -0.40 -0.44 -0.95 0.00 0.00 178.83 177.31 3g2g h ASP 228 N 0.21 0.57 -0.41 1.46 3.32 -0.01 -1.11 116.42 120.45 3g2g h ASP 228 Ca 0.04 -0.60 0.00 0.00 0.02 0.00 0.00 57.03 56.49 3g2g h ASP 228 Cb 0.49 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 3g2g h ASP 228 CO 0.03 1.07 0.26 -0.07 -1.72 0.00 0.00 179.24 178.82 3g2g h LEU 229 N 0.10 0.48 -0.17 1.55 3.38 -0.43 0.69 115.31 120.90 3g2g h LEU 229 Ca -0.01 -0.03 0.05 0.00 0.09 0.00 0.00 57.88 57.98 3g2g h LEU 229 Cb 1.02 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.60 3g2g h LEU 229 CO 0.09 0.36 -0.17 0.11 0.09 0.00 0.00 178.44 178.92 3g2g h LYS 230 N 0.55 -0.19 -0.82 1.13 1.79 -1.17 0.27 116.57 118.13 3g2g h LYS 230 Ca 0.15 0.01 0.16 0.00 -2.18 0.00 0.00 60.65 58.80 3g2g h LYS 230 Cb -0.04 0.04 -0.06 0.00 -1.58 0.00 0.00 32.23 30.59 3g2g h LYS 230 CO -0.03 -0.12 0.54 0.35 -1.08 0.00 0.00 179.45 179.11 3g2g h PHE 231 N -0.19 0.55 -0.09 -1.35 3.57 -0.72 0.38 116.94 119.09 3g2g h PHE 231 Ca 0.11 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 3g2g h PHE 231 Cb 0.36 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 3g2g h PHE 231 CO -0.30 0.19 0.05 0.78 -2.23 0.00 0.00 178.31 176.80 3g2g h GLY 232 N 0.45 0.12 0.90 2.40 0.00 0.12 0.46 103.07 107.52 3g2g h GLY 232 Ca 0.41 -0.04 0.01 0.00 0.00 0.00 0.00 47.33 47.71 3g2g h GLY 232 CO -0.15 0.04 0.00 -2.08 0.00 0.00 0.00 176.54 174.35 3g2g h VAL 233 N 0.11 0.95 -0.83 4.60 2.07 0.01 -1.64 116.25 121.53 3g2g h VAL 233 Ca 0.03 -0.01 0.18 0.00 0.82 0.00 0.00 66.70 67.72 3g2g h VAL 233 Cb -0.01 0.93 -0.11 0.00 -1.52 0.00 0.00 31.29 30.58 3g2g h VAL 233 CO -0.01 0.00 0.34 -0.33 0.02 0.00 0.00 177.57 177.60 3g2g h GLU 234 N 0.03 0.42 -0.00 1.57 5.08 -0.92 -2.00 114.58 118.76 3g2g h GLU 234 Ca 0.03 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3g2g h GLU 234 Cb 0.04 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3g2g h GLU 234 CO -0.05 0.28 -0.11 1.04 -1.00 0.00 0.00 179.01 179.17 3g2g n GLN 235 N -5.02 0.72 -2.85 2.33 1.13 0.13 -4.93 117.38 108.89 3g2g n GLN 235 Ca 0.18 -0.25 -0.16 0.00 -1.94 0.00 0.00 57.00 54.82 3g2g n GLN 235 Cb 0.52 -1.49 0.03 0.00 0.11 0.00 0.00 30.24 29.40 3g2g n GLN 235 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3g2g n ASP 236 N -0.92 -4.85 -4.75 1.08 2.03 -0.69 -4.99 116.55 103.46 3g2g n ASP 236 Ca 0.15 -0.22 -0.33 0.00 0.52 0.00 0.00 54.79 54.90 3g2g n ASP 236 Cb 0.28 -3.68 0.07 0.00 -0.72 0.00 0.00 41.12 37.07 3g2g n ASP 236 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3g2g s VAL 237 N -3.02 2.93 -0.17 5.18 -7.23 -1.07 -4.96 120.40 112.07 3g2g s VAL 237 Ca 0.24 0.41 0.20 0.00 -1.81 0.00 0.00 61.98 61.02 3g2g s VAL 237 Cb -0.10 -2.90 -0.10 0.00 0.56 0.00 0.00 36.38 33.83 3g2g s VAL 237 CO 0.29 -0.29 0.85 0.47 -0.31 0.00 0.00 175.10 176.12 3g2g n ASP 238 N -2.78 0.72 -3.47 4.85 8.00 -0.69 -4.86 116.55 118.33 3g2g n ASP 238 Ca 0.11 0.29 -0.15 0.00 0.71 0.00 0.00 54.79 55.76 3g2g n ASP 238 Cb 0.52 0.55 -0.04 0.00 -0.02 0.00 0.00 41.12 42.13 3g2g n ASP 238 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g2g s MET 239 N -3.18 1.17 -0.11 -1.24 0.23 -1.17 -2.40 119.30 112.59 3g2g s MET 239 Ca -0.03 -0.14 0.03 0.00 -1.03 0.00 0.00 55.69 54.52 3g2g s MET 239 Cb 0.10 0.54 -0.01 0.00 -1.53 0.00 0.00 34.83 33.93 3g2g s MET 239 CO 0.81 -0.45 -0.20 0.08 -2.03 0.00 0.00 175.02 173.23 3g2g s VAL 240 N -2.59 2.43 -0.52 5.16 1.01 0.58 -1.36 120.40 125.11 3g2g s VAL 240 Ca -0.04 -0.89 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 3g2g s VAL 240 Cb -0.01 -1.96 0.08 0.00 0.00 0.00 0.00 36.38 34.49 3g2g s VAL 240 CO -0.03 0.55 0.56 -0.36 0.00 0.00 0.00 175.10 175.82 3g2g s PHE 241 N 0.30 3.12 -0.18 5.22 0.08 0.31 -0.14 117.98 126.68 3g2g s PHE 241 Ca -0.15 -0.81 -0.22 0.00 0.12 0.00 0.00 56.93 55.87 3g2g s PHE 241 Cb -0.17 -3.54 -0.02 0.00 -0.57 0.00 0.00 43.02 38.71 3g2g s PHE 241 CO 0.07 -1.01 0.68 0.00 -0.10 0.00 0.00 175.22 174.87 3g2g s ALA 242 N 2.24 3.52 0.36 5.36 0.00 0.33 -1.89 121.76 131.68 3g2g s ALA 242 Ca 0.10 -0.17 -0.19 0.00 0.00 0.00 0.00 51.96 51.70 3g2g s ALA 242 Cb -0.23 -3.03 -0.10 0.00 0.00 0.00 0.00 23.12 19.76 3g2g s ALA 242 CO 0.08 -0.55 0.85 -1.12 0.00 0.00 0.00 175.76 175.03 3g2g s SER 243 N 1.16 6.92 -1.39 0.00 0.01 -1.26 -0.16 113.70 118.98 3g2g s SER 243 Ca 0.32 1.52 -0.05 0.00 1.31 0.00 0.00 55.95 59.05 3g2g s SER 243 Cb -0.16 -2.47 0.03 0.00 0.21 0.00 0.00 66.02 63.63 3g2g s SER 243 CO 0.11 -0.24 0.37 0.49 0.41 0.00 0.00 173.24 174.38 3g2g n PHE 244 N -0.33 -1.68 -1.88 2.43 3.01 -1.21 -4.69 117.46 113.11 3g2g n PHE 244 Ca 0.04 0.33 -0.42 0.00 1.01 0.00 0.00 57.45 58.42 3g2g n PHE 244 Cb 0.53 -3.56 -0.03 0.00 -0.01 0.00 0.00 39.48 36.41 3g2g n PHE 244 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3g2g s ILE 245 N -2.96 3.00 -0.02 4.37 -1.09 -0.89 -4.88 121.20 118.74 3g2g s ILE 245 Ca 0.23 0.39 0.14 0.00 -2.23 0.00 0.00 60.65 59.18 3g2g s ILE 245 Cb -0.11 -3.25 -0.21 0.00 -1.58 0.00 0.00 42.46 37.30 3g2g s ILE 245 CO 0.29 -0.01 0.30 0.54 -1.23 0.00 0.00 174.94 174.83 3g2g n ARG 246 N 5.93 0.45 -3.73 2.79 1.74 -1.26 -4.23 116.66 118.34 3g2g n ARG 246 Ca 0.17 -0.12 -0.04 0.00 -0.77 0.00 0.00 57.85 57.08 3g2g n ARG 246 Cb 0.40 -1.33 -0.01 0.00 -1.02 0.00 0.00 32.46 30.50 3g2g n ARG 246 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 3g2g s LYS 247 N -2.95 1.18 0.47 5.56 -2.85 -1.26 -4.00 119.74 115.90 3g2g s LYS 247 Ca -0.05 -0.63 0.16 0.00 -1.00 0.00 0.00 55.97 54.45 3g2g s LYS 247 Cb 0.09 0.42 1.15 0.00 -2.06 0.00 0.00 37.83 37.43 3g2g s LYS 247 CO 0.58 -0.54 2.04 0.00 0.10 0.00 0.00 175.35 177.53 3g2g h ALA 248 N 2.00 2.08 -0.05 0.59 0.00 -1.87 -1.53 119.26 120.48 3g2g h ALA 248 Ca -0.24 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 3g2g h ALA 248 Cb 1.23 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3g2g h ALA 248 CO 0.26 -0.17 -0.55 0.66 0.00 0.00 0.00 179.25 179.45 3g2g h SER 249 N 0.23 0.17 -0.53 0.00 4.64 -1.96 -2.31 113.55 113.80 3g2g h SER 249 Ca 0.18 -0.09 0.02 0.00 -0.47 0.00 0.00 61.79 61.43 3g2g h SER 249 Cb 0.42 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.43 3g2g h SER 249 CO -0.03 0.69 0.33 0.44 -0.87 0.00 0.00 176.83 177.39 3g2g h ASP 250 N 0.12 0.56 -0.25 4.97 3.32 -1.68 -2.31 116.42 121.15 3g2g h ASP 250 Ca -0.00 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 3g2g h ASP 250 Cb 1.01 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.42 3g2g h ASP 250 CO 0.08 0.40 0.07 0.58 -1.72 0.00 0.00 179.24 178.65 3g2g h VAL 251 N 0.67 1.16 -0.02 -1.35 2.07 -1.35 -2.77 116.25 114.66 3g2g h VAL 251 Ca 0.21 -0.55 -0.18 0.00 0.82 0.00 0.00 66.70 66.99 3g2g h VAL 251 Cb -0.02 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 3g2g h VAL 251 CO -0.07 0.20 -0.80 0.45 0.02 0.00 0.00 177.57 177.37 3g2g h HIS 252 N 0.46 0.28 -0.24 1.57 3.86 -1.05 -1.96 115.15 118.08 3g2g h HIS 252 Ca 0.11 -0.14 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 3g2g h HIS 252 Cb 0.19 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 3g2g h HIS 252 CO 0.01 0.91 0.13 0.93 0.86 0.00 0.00 177.93 180.77 3g2g h GLU 253 N 0.12 0.33 -0.63 2.45 5.08 -1.16 -0.78 114.58 119.99 3g2g h GLU 253 Ca -0.03 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3g2g h GLU 253 Cb 1.39 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.54 3g2g h GLU 253 CO 0.12 0.29 0.32 0.28 -1.00 0.00 0.00 179.01 179.02 3g2g h VAL 254 N 0.28 1.21 -0.62 3.13 2.07 -1.37 -1.60 116.25 119.35 3g2g h VAL 254 Ca 0.08 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 3g2g h VAL 254 Cb 0.05 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 3g2g h VAL 254 CO -0.01 0.24 0.33 -0.09 0.02 0.00 0.00 177.57 178.05 3g2g h ARG 255 N 0.87 0.87 -0.54 1.57 9.65 -1.23 -1.66 114.38 123.91 3g2g h ARG 255 Ca 0.22 -0.11 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 3g2g h ARG 255 Cb 0.09 -0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 28.48 3g2g h ARG 255 CO -0.03 0.68 0.35 0.87 2.80 0.00 0.00 179.97 184.63 3g2g h LYS 256 N 0.85 0.72 0.10 0.20 6.56 -0.86 -0.37 116.57 123.77 3g2g h LYS 256 Ca 0.22 -0.05 -0.00 0.00 -1.06 0.00 0.00 60.65 59.75 3g2g h LYS 256 Cb 0.07 -0.16 -0.00 0.00 -0.57 0.00 0.00 32.23 31.57 3g2g h LYS 256 CO -0.03 0.50 -0.06 0.28 -2.06 0.00 0.00 179.45 178.08 3g2g h VAL 257 N 0.73 0.88 -0.37 0.50 2.07 -0.85 0.13 116.25 119.33 3g2g h VAL 257 Ca 0.20 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.82 3g2g h VAL 257 Cb -0.06 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 3g2g h VAL 257 CO -0.04 0.00 0.27 -0.07 0.02 0.00 0.00 177.57 177.75 3g2g h LEU 258 N -0.15 0.00 0.00 2.57 3.38 -1.21 -3.46 115.31 116.43 3g2g h LEU 258 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3g2g h LEU 258 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3g2g h LEU 258 CO 0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.15 3g2g n GLY 259 N -1.61 0.86 0.19 0.83 0.00 0.03 -0.70 105.19 104.78 3g2g n GLY 259 Ca 0.06 -0.70 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 3g2g n GLY 259 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3g2g h GLU 260 N 0.00 0.45 -0.20 1.61 4.22 -1.88 -2.17 114.58 116.60 3g2g h GLU 260 Ca 0.00 -0.34 -0.07 0.00 0.08 0.00 0.00 59.36 59.03 3g2g h GLU 260 Cb 0.00 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3g2g h GLU 260 CO 0.00 0.96 -0.19 0.87 -2.18 0.00 0.00 179.01 178.47 3g2g h LYS 261 N 0.32 0.35 -0.45 1.92 1.79 -1.95 -3.03 116.57 115.52 3g2g h LYS 261 Ca -0.02 -0.11 -0.11 0.00 -2.18 0.00 0.00 60.65 58.23 3g2g h LYS 261 Cb 1.24 -0.03 -0.06 0.00 -1.58 0.00 0.00 32.23 31.79 3g2g h LYS 261 CO 0.12 0.54 0.08 0.41 -1.08 0.00 0.00 179.45 179.51 3g2g n GLY 262 N -0.61 4.04 0.30 3.86 0.00 0.12 -4.67 105.19 108.23 3g2g n GLY 262 Ca -0.00 -1.06 0.17 0.00 0.00 0.00 0.00 46.02 45.12 3g2g n GLY 262 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3g2g h LYS 263 N 2.04 0.00 -0.01 1.61 2.10 -1.26 -1.29 116.57 119.75 3g2g h LYS 263 Ca 0.13 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.78 3g2g h LYS 263 Cb 1.82 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.15 3g2g h LYS 263 CO 0.44 0.02 -0.13 0.09 -2.00 0.00 0.00 179.45 177.87 3g2g n ASN 264 N -3.59 1.31 -4.67 7.07 3.02 -1.26 -4.87 115.26 112.27 3g2g n ASN 264 Ca -0.03 -1.21 -0.42 0.00 -0.03 0.00 0.00 54.58 52.89 3g2g n ASN 264 Cb 0.11 0.07 -0.03 0.00 -0.61 0.00 0.00 39.78 39.32 3g2g n ASN 264 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3g2g s ILE 265 N -2.25 4.78 0.16 2.41 1.01 -0.49 -4.98 121.20 121.84 3g2g s ILE 265 Ca 0.31 1.87 -0.31 0.00 0.00 0.00 0.00 60.65 62.52 3g2g s ILE 265 Cb 0.20 -4.24 -0.09 0.00 0.01 0.00 0.00 42.46 38.34 3g2g s ILE 265 CO 0.43 -0.06 1.42 -0.54 0.00 0.00 0.00 174.94 176.18 3g2g s LYS 266 N 2.56 4.30 -0.31 2.79 -0.14 -1.01 -4.82 119.74 123.11 3g2g s LYS 266 Ca 0.43 2.16 -0.12 0.00 -1.36 0.00 0.00 55.97 57.08 3g2g s LYS 266 Cb -0.16 -3.20 -0.03 0.00 -1.68 0.00 0.00 37.83 32.76 3g2g s LYS 266 CO 0.11 -0.44 0.20 0.42 -0.76 0.00 0.00 175.35 174.88 3g2g s ILE 267 N 0.80 5.20 -0.32 2.17 1.01 -1.26 -0.31 121.20 128.49 3g2g s ILE 267 Ca 0.64 -0.06 -0.09 0.00 0.00 0.00 0.00 60.65 61.13 3g2g s ILE 267 Cb -0.39 -3.57 -0.00 0.00 0.01 0.00 0.00 42.46 38.51 3g2g s ILE 267 CO 0.33 0.12 0.15 -0.63 0.00 0.00 0.00 174.94 174.92 3g2g s ILE 268 N 1.73 4.51 0.07 2.92 -1.09 0.80 -0.82 121.20 129.31 3g2g s ILE 268 Ca 0.06 -0.52 -0.29 0.00 -2.23 0.00 0.00 60.65 57.67 3g2g s ILE 268 Cb -0.17 -3.33 -0.05 0.00 -1.58 0.00 0.00 42.46 37.33 3g2g s ILE 268 CO 0.10 0.03 0.94 -0.44 -1.23 0.00 0.00 174.94 174.34 3g2g s SER 269 N 1.59 7.42 -0.25 3.58 0.01 -0.81 -0.51 113.70 124.72 3g2g s SER 269 Ca 0.04 1.70 -0.14 0.00 1.31 0.00 0.00 55.95 58.86 3g2g s SER 269 Cb -0.17 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 3g2g s SER 269 CO 0.06 -0.12 0.34 -0.54 0.41 0.00 0.00 173.24 173.39 3g2g s LYS 270 N 0.31 4.05 -0.48 12.44 1.02 0.78 -0.94 119.74 136.92 3g2g s LYS 270 Ca 0.47 0.01 -0.17 0.00 0.02 0.00 0.00 55.97 56.29 3g2g s LYS 270 Cb -0.22 -3.62 0.06 0.00 -0.52 0.00 0.00 37.83 33.53 3g2g s LYS 270 CO 0.28 -0.18 0.52 0.42 -0.92 0.00 0.00 175.35 175.47 3g2g s ILE 271 N 1.76 5.04 0.00 2.17 -1.09 -0.86 -2.09 121.20 126.13 3g2g s ILE 271 Ca 0.14 -0.71 0.00 0.00 -2.23 0.00 0.00 60.65 57.86 3g2g s ILE 271 Cb -0.15 -4.20 0.00 0.00 -1.58 0.00 0.00 42.46 36.52 3g2g s ILE 271 CO 0.09 -0.68 0.78 -0.62 -1.23 0.00 0.00 174.94 173.28 3g2g n GLU 272 N 5.73 1.70 -4.06 2.79 1.02 -1.26 -2.59 120.64 123.97 3g2g n GLU 272 Ca -0.09 -1.07 -0.10 0.00 -0.02 0.00 0.00 57.16 55.89 3g2g n GLU 272 Cb 0.45 -0.80 -0.07 0.00 -0.02 0.00 0.00 31.44 31.00 3g2g n GLU 272 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3g2g s ASN 273 N -0.58 -0.01 0.22 1.62 2.20 -1.26 -2.94 114.94 114.19 3g2g s ASN 273 Ca 0.00 -1.06 -0.08 0.00 -0.94 0.00 0.00 52.86 50.77 3g2g s ASN 273 Cb 0.00 0.53 0.23 0.00 -2.00 0.00 0.00 41.25 40.01 3g2g s ASN 273 CO 0.00 -1.06 1.87 -0.74 -2.94 0.00 0.00 177.10 174.23 3g2g h HIS 274 N 2.36 0.94 -0.63 1.54 -0.00 -1.92 -2.57 115.15 114.87 3g2g h HIS 274 Ca -0.29 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.04 3g2g h HIS 274 Cb 1.25 -0.31 -0.03 0.00 -0.00 0.00 0.00 27.41 28.32 3g2g h HIS 274 CO 0.40 0.54 0.12 1.49 -0.00 0.00 0.00 177.93 180.48 3g2g h GLU 275 N 0.98 1.00 -0.90 5.26 4.81 -1.95 -0.86 114.58 122.93 3g2g h GLU 275 Ca 0.31 -0.24 0.10 0.00 -0.13 0.00 0.00 59.36 59.40 3g2g h GLU 275 Cb 0.00 -0.13 -0.08 0.00 0.63 0.00 0.00 28.75 29.18 3g2g h GLU 275 CO -0.11 0.91 0.54 0.78 -0.73 0.00 0.00 179.01 180.40 3g2g h GLY 276 N 1.04 1.41 0.64 1.92 0.00 -1.60 0.97 103.07 107.45 3g2g h GLY 276 Ca 0.20 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 3g2g h GLY 276 CO 0.01 0.17 -0.11 -2.08 0.00 0.00 0.00 176.54 174.52 3g2g h VAL 277 N 0.90 0.84 -0.96 4.60 2.07 -1.11 -2.15 116.25 120.44 3g2g h VAL 277 Ca 0.43 -0.69 0.07 0.00 0.82 0.00 0.00 66.70 67.33 3g2g h VAL 277 Cb 0.37 1.22 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 3g2g h VAL 277 CO -0.24 0.15 0.62 -0.09 0.02 0.00 0.00 177.57 178.03 3g2g h ARG 278 N -0.67 1.07 -0.81 1.57 2.43 -0.94 -1.02 114.38 116.01 3g2g h ARG 278 Ca -0.03 -0.06 -0.26 0.00 -0.81 0.00 0.00 59.98 58.81 3g2g h ARG 278 Cb 0.47 -0.24 -0.16 0.00 -0.42 0.00 0.00 29.97 29.62 3g2g h ARG 278 CO 0.05 0.71 0.33 0.54 -1.51 0.00 0.00 179.97 180.09 3g2g n ARG 279 N -4.50 3.45 -0.26 0.20 1.74 0.31 -4.67 116.66 112.93 3g2g n ARG 279 Ca 0.15 -2.98 0.03 0.00 -0.77 0.00 0.00 57.85 54.28 3g2g n ARG 279 Cb 0.20 -2.19 0.16 0.00 -1.02 0.00 0.00 32.46 29.61 3g2g n ARG 279 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 3g2g h PHE 280 N 2.36 0.68 -0.27 -1.55 3.57 -0.48 -2.77 116.94 118.49 3g2g h PHE 280 Ca 0.32 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.85 3g2g h PHE 280 Cb 2.40 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 40.93 3g2g h PHE 280 CO 1.32 0.23 0.16 -0.44 -2.23 0.00 0.00 178.31 177.34 3g2g h ASP 281 N 0.63 0.32 -0.06 0.41 3.32 -1.83 0.11 116.42 119.31 3g2g h ASP 281 Ca 0.38 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 57.25 3g2g h ASP 281 Cb 0.43 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 3g2g h ASP 281 CO -0.29 0.29 -0.34 1.05 -1.72 0.00 0.00 179.24 178.23 3g2g h GLU 282 N 0.33 0.55 -0.57 3.56 4.11 -1.91 -1.11 114.58 119.54 3g2g h GLU 282 Ca 0.10 -0.25 -0.03 0.00 0.07 0.00 0.00 59.36 59.24 3g2g h GLU 282 Cb 0.03 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3g2g h GLU 282 CO -0.02 0.82 0.24 0.82 0.07 0.00 0.00 179.01 180.95 3g2g h ILE 283 N 0.47 1.22 -0.55 -1.06 2.04 -1.19 -2.28 117.51 116.15 3g2g h ILE 283 Ca 0.05 -0.67 -0.08 0.00 1.00 0.00 0.00 64.86 65.16 3g2g h ILE 283 Cb 0.82 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 3g2g h ILE 283 CO 0.07 0.26 0.04 0.25 0.00 0.00 0.00 178.15 178.77 3g2g h LEU 284 N 0.79 0.92 -1.25 1.44 5.85 -0.68 -1.97 115.31 120.41 3g2g h LEU 284 Ca 0.19 -0.29 0.02 0.00 0.84 0.00 0.00 57.88 58.64 3g2g h LEU 284 Cb 0.18 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 3g2g h LEU 284 CO -0.02 0.98 0.51 -0.08 -0.34 0.00 0.00 178.44 179.50 3g2g h GLU 285 N 0.84 0.98 0.00 1.25 4.81 -1.00 -2.66 114.58 118.78 3g2g h GLU 285 Ca 0.16 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.28 3g2g h GLU 285 Cb 0.49 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 3g2g h GLU 285 CO 0.02 0.65 -0.33 0.00 -0.73 0.00 0.00 179.01 178.61 3g2g h ALA 286 N 1.53 0.81 -1.71 2.92 0.00 -1.15 -3.47 119.26 118.18 3g2g h ALA 286 Ca 0.30 -0.25 -0.43 0.00 0.00 0.00 0.00 54.91 54.53 3g2g h ALA 286 Cb -0.05 -0.03 0.04 0.00 0.00 0.00 0.00 17.79 17.76 3g2g h ALA 286 CO -0.07 0.33 -0.09 -1.12 0.00 0.00 0.00 179.25 178.29 3g2g s SER 287 N -6.27 5.35 0.03 0.00 0.01 -0.76 -4.96 113.70 107.09 3g2g s SER 287 Ca 0.05 -0.14 0.23 0.00 1.31 0.00 0.00 55.95 57.40 3g2g s SER 287 Cb 0.07 -0.78 0.13 0.00 0.21 0.00 0.00 66.02 65.65 3g2g s SER 287 CO 0.72 -1.07 1.11 0.47 0.41 0.00 0.00 173.24 174.88 3g2g n ASP 288 N -2.23 0.64 0.00 2.44 8.00 0.00 -4.96 116.55 120.45 3g2g n ASP 288 Ca 0.08 -0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.26 3g2g n ASP 288 Cb 0.60 0.67 0.00 0.00 -0.02 0.00 0.00 41.12 42.37 3g2g n ASP 288 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3g2g n GLY 289 N 1.42 -1.10 3.00 0.44 0.00 -1.12 -4.16 105.19 103.67 3g2g n GLY 289 Ca 0.03 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 3g2g n GLY 289 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g2g s ILE 290 N -2.12 0.40 -0.14 -0.61 -1.09 0.04 -1.92 121.20 115.77 3g2g s ILE 290 Ca 0.00 -0.70 0.01 0.00 -2.23 0.00 0.00 60.65 57.73 3g2g s ILE 290 Cb 0.00 -0.43 -0.01 0.00 -1.58 0.00 0.00 42.46 40.44 3g2g s ILE 290 CO 0.00 -0.21 -0.16 -0.32 -1.23 0.00 0.00 174.94 173.03 3g2g s MET 291 N -0.98 3.26 -0.88 2.79 -2.45 -0.12 -0.81 119.30 120.12 3g2g s MET 291 Ca -0.06 -0.74 -0.24 0.00 -1.25 0.00 0.00 55.69 53.40 3g2g s MET 291 Cb -0.07 -2.58 0.05 0.00 1.25 0.00 0.00 34.83 33.48 3g2g s MET 291 CO 0.00 0.12 1.31 0.08 1.05 0.00 0.00 175.02 177.58 3g2g s VAL 292 N 0.56 3.96 -1.23 10.11 1.01 0.81 -2.03 120.40 133.58 3g2g s VAL 292 Ca -0.10 -0.37 -0.16 0.00 0.00 0.00 0.00 61.98 61.36 3g2g s VAL 292 Cb -0.16 -4.95 0.13 0.00 0.00 0.00 0.00 36.38 31.41 3g2g s VAL 292 CO 0.04 -1.83 1.53 0.00 0.00 0.00 0.00 175.10 174.84 3g2g s ALA 293 N 4.96 3.73 0.20 5.51 0.00 -1.07 -2.89 121.76 132.20 3g2g s ALA 293 Ca 0.39 -3.17 0.31 0.00 0.00 0.00 0.00 51.96 49.48 3g2g s ALA 293 Cb -0.05 -4.31 1.33 0.00 0.00 0.00 0.00 23.12 20.09 3g2g s ALA 293 CO 0.01 -2.97 1.98 0.00 0.00 0.00 0.00 175.76 174.78 3g2g h ARG 294 N 7.40 0.00 0.39 0.00 3.08 -1.82 -2.35 114.38 121.07 3g2g h ARG 294 Ca 0.35 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.39 3g2g h ARG 294 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.93 3g2g h ARG 294 CO 1.32 0.08 -0.19 0.78 -1.07 0.00 0.00 179.97 180.89 3g2g h GLY 295 N 1.73 -0.54 1.28 0.04 0.00 -1.87 -1.25 103.07 102.45 3g2g h GLY 295 Ca -0.00 0.20 -0.10 0.00 0.00 0.00 0.00 47.33 47.43 3g2g h GLY 295 CO 0.01 -0.20 -0.11 -0.55 0.00 0.00 0.00 176.54 175.69 3g2g h ASP 296 N -0.56 0.85 -0.94 0.19 3.32 -1.84 -3.07 116.42 114.36 3g2g h ASP 296 Ca -0.05 -0.26 0.08 0.00 0.02 0.00 0.00 57.03 56.82 3g2g h ASP 296 Cb 0.40 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.65 3g2g h ASP 296 CO 0.09 0.97 0.59 0.25 -1.72 0.00 0.00 179.24 179.42 3g2g h LEU 297 N 0.77 0.91 0.00 1.55 5.85 -1.30 -0.38 115.31 122.70 3g2g h LEU 297 Ca 0.13 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3g2g h LEU 297 Cb 0.62 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.49 3g2g h LEU 297 CO 0.04 0.55 0.00 0.61 -0.34 0.00 0.00 178.44 179.30 3g2g n GLY 298 N -1.34 -1.04 0.12 3.75 0.00 -0.47 -1.06 105.19 105.14 3g2g n GLY 298 Ca 0.15 -0.18 -0.17 0.00 0.00 0.00 0.00 46.02 45.83 3g2g n GLY 298 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3g2g n ILE 299 N -1.08 1.50 0.09 -0.61 5.41 -0.44 -3.94 119.36 120.28 3g2g n ILE 299 Ca 0.21 -0.63 -0.04 0.00 1.00 0.00 0.00 62.75 63.29 3g2g n ILE 299 Cb 0.14 -1.27 0.17 0.00 -0.71 0.00 0.00 39.64 37.96 3g2g n ILE 299 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3g2g h GLU 300 N 0.00 0.25 -5.66 0.38 4.39 -0.65 -3.44 114.58 109.85 3g2g h GLU 300 Ca -0.56 -0.14 -0.51 0.00 0.34 0.00 0.00 59.36 58.48 3g2g h GLU 300 Cb 1.97 0.01 -0.14 0.00 -0.10 0.00 0.00 28.75 30.49 3g2g h GLU 300 CO -0.05 0.70 -0.70 0.96 -1.16 0.00 0.00 179.01 178.75 3g2g s ILE 301 N -3.97 1.84 0.20 3.13 -4.36 -0.23 -4.64 121.20 113.18 3g2g s ILE 301 Ca -0.04 -2.19 -0.32 0.00 -0.26 0.00 0.00 60.65 57.84 3g2g s ILE 301 Cb 0.13 -2.37 -0.15 0.00 1.25 0.00 0.00 42.46 41.32 3g2g s ILE 301 CO 0.79 -0.37 1.24 -2.65 0.24 0.00 0.00 174.94 174.19 3g2g n PRO 302 N -0.57 1.47 -0.06 0.37 -0.02 -1.26 -4.49 135.00 130.44 3g2g n PRO 302 Ca -0.06 0.52 0.13 0.00 -2.02 0.00 0.00 63.50 62.08 3g2g n PRO 302 Cb 0.62 -2.07 0.53 0.00 -0.02 0.00 0.00 33.50 32.57 3g2g n PRO 302 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g2g h ALA 303 N 3.60 2.09 0.00 3.55 0.00 -1.93 -0.96 119.26 125.62 3g2g h ALA 303 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3g2g h ALA 303 Cb 1.32 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3g2g h ALA 303 CO 0.72 -0.23 0.00 -0.85 0.00 0.00 0.00 179.25 178.89 3g2g n GLU 304 N -4.46 0.36 0.00 0.00 0.00 -1.26 -2.55 120.64 112.73 3g2g n GLU 304 Ca 0.09 0.07 0.10 0.00 0.00 0.00 0.00 57.16 57.42 3g2g n GLU 304 Cb 0.40 -1.50 -0.10 0.00 0.00 0.00 0.00 31.44 30.24 3g2g n GLU 304 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3g2g n LYS 305 N -1.26 0.45 -0.18 3.44 5.02 -0.37 -4.60 118.16 120.67 3g2g n LYS 305 Ca 0.11 -0.08 -0.04 0.00 -2.02 0.00 0.00 58.31 56.28 3g2g n LYS 305 Cb 0.17 -1.45 0.06 0.00 -0.02 0.00 0.00 35.03 33.79 3g2g n LYS 305 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3g2g h VAL 306 N 0.20 0.95 -0.07 -0.18 2.07 -1.56 -1.59 116.25 116.06 3g2g h VAL 306 Ca 0.00 -0.18 0.02 0.00 0.82 0.00 0.00 66.70 67.36 3g2g h VAL 306 Cb 0.50 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 3g2g h VAL 306 CO 0.00 0.09 0.05 2.19 0.02 0.00 0.00 177.57 179.93 3g2g h PHE 307 N 0.52 0.00 -0.14 1.57 -5.15 -1.81 0.10 116.94 112.03 3g2g h PHE 307 Ca 0.24 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.98 3g2g h PHE 307 Cb 0.15 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.32 3g2g h PHE 307 CO -0.10 0.00 -0.02 -0.07 -2.00 0.00 0.00 178.31 176.12 3g2g h LEU 308 N 0.00 0.26 -0.64 2.10 3.38 -1.60 -1.40 115.31 117.40 3g2g h LEU 308 Ca 0.04 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 3g2g h LEU 308 Cb 0.14 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 3g2g h LEU 308 CO -0.00 0.54 0.36 0.00 0.09 0.00 0.00 178.44 179.44 3g2g h ALA 309 N 0.72 0.82 -0.11 1.53 0.00 -1.04 -1.33 119.26 119.85 3g2g h ALA 309 Ca 0.04 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3g2g h ALA 309 Cb 0.42 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3g2g h ALA 309 CO 0.01 0.32 -0.03 0.37 0.00 0.00 0.00 179.25 179.91 3g2g h GLN 310 N 0.87 -0.01 -0.11 0.00 4.15 -0.71 -0.76 115.11 118.53 3g2g h GLN 310 Ca 0.23 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.48 3g2g h GLN 310 Cb 0.02 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 3g2g h GLN 310 CO -0.04 -0.01 -0.63 0.87 -1.93 0.00 0.00 178.83 177.09 3g2g h LYS 311 N -0.01 0.41 0.07 1.69 1.57 -1.14 -0.89 116.57 118.27 3g2g h LYS 311 Ca 0.06 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 58.54 3g2g h LYS 311 Cb 0.09 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3g2g h LYS 311 CO -0.12 0.91 -0.03 1.98 -0.57 0.00 0.00 179.45 181.62 3g2g h MET 312 N 0.30 -0.09 -0.44 3.15 4.05 -1.10 -0.13 114.93 120.67 3g2g h MET 312 Ca -0.01 0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.35 3g2g h MET 312 Cb 1.17 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.98 3g2g h MET 312 CO 0.11 -0.05 0.04 0.52 0.23 0.00 0.00 176.91 177.76 3g2g h MET 313 N -0.10 0.76 -0.51 0.39 2.86 -0.97 0.38 114.93 117.72 3g2g h MET 313 Ca -0.01 -0.22 -0.05 0.00 -2.06 0.00 0.00 59.70 57.35 3g2g h MET 313 Cb 0.08 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 3g2g h MET 313 CO 0.02 0.81 0.12 0.82 1.06 0.00 0.00 176.91 179.73 3g2g h ILE 314 N 0.61 1.24 -0.40 -1.22 2.04 -1.17 0.36 117.51 118.97 3g2g h ILE 314 Ca 0.13 -0.87 0.04 0.00 1.00 0.00 0.00 64.86 65.15 3g2g h ILE 314 Cb 0.44 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 37.31 3g2g h ILE 314 CO 0.02 0.32 0.19 1.23 0.00 0.00 0.00 178.15 179.90 3g2g h GLY 315 N 0.72 0.54 1.76 5.37 0.00 -0.76 -0.14 103.07 110.56 3g2g h GLY 315 Ca 0.16 -0.13 -0.17 0.00 0.00 0.00 0.00 47.33 47.19 3g2g h GLY 315 CO 0.00 0.08 -0.73 3.21 0.00 0.00 0.00 176.54 179.11 3g2g h ARG 316 N 0.38 0.23 -0.46 4.80 3.08 -0.67 -1.20 114.38 120.54 3g2g h ARG 316 Ca 0.18 -0.20 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 3g2g h ARG 316 Cb 0.10 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 3g2g h ARG 316 CO -0.14 0.86 0.02 0.00 -1.07 0.00 0.00 179.97 179.64 3g2g h ASN 318 N 0.66 0.69 -0.25 0.00 -0.26 -0.81 0.53 115.58 116.12 3g2g h ASN 318 Ca 0.13 -0.04 -0.03 0.00 -0.56 0.00 0.00 56.30 55.81 3g2g h ASN 318 Cb 0.47 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.54 3g2g h ASN 318 CO 0.02 0.52 0.09 -0.09 -1.06 0.00 0.00 177.43 176.91 3g2g h ARG 319 N 0.79 0.46 0.00 0.81 2.43 -1.06 -2.85 114.38 114.96 3g2g h ARG 319 Ca 0.21 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3g2g h ARG 319 Cb -0.05 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 3g2g h ARG 319 CO -0.04 0.42 -0.67 0.00 -1.51 0.00 0.00 179.97 178.17 3g2g h ALA 320 N 1.64 0.63 0.00 2.80 0.00 -0.55 -3.48 119.26 120.30 3g2g h ALA 320 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3g2g h ALA 320 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3g2g h ALA 320 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 3g2g n GLY 321 N 1.23 0.48 3.39 0.00 0.00 0.07 -5.06 105.19 105.29 3g2g n GLY 321 Ca 0.02 -0.88 -0.32 0.00 0.00 0.00 0.00 46.02 44.84 3g2g n GLY 321 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g2g s LYS 322 N -3.09 2.23 0.29 1.61 1.02 -0.56 -4.97 119.74 116.28 3g2g s LYS 322 Ca 0.00 -0.86 -0.30 0.00 0.02 0.00 0.00 55.97 54.83 3g2g s LYS 322 Cb 0.00 -2.18 -0.12 0.00 -0.52 0.00 0.00 37.83 35.01 3g2g s LYS 322 CO 0.00 0.58 1.46 -2.30 -0.92 0.00 0.00 175.35 174.17 3g2g n PRO 323 N 2.22 2.34 -4.53 -1.68 -0.02 -1.26 -4.38 135.00 127.69 3g2g n PRO 323 Ca -0.17 0.83 -0.22 0.00 -2.02 0.00 0.00 63.50 61.92 3g2g n PRO 323 Cb 0.52 -2.52 -0.16 0.00 -0.02 0.00 0.00 33.50 31.32 3g2g n PRO 323 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3g2g s VAL 324 N -0.32 1.00 -0.14 -1.45 0.11 -1.26 -0.78 120.40 117.56 3g2g s VAL 324 Ca 0.63 -0.47 -0.02 0.00 -2.93 0.00 0.00 61.98 59.19 3g2g s VAL 324 Cb -0.57 -0.88 -0.02 0.00 -1.53 0.00 0.00 36.38 33.38 3g2g s VAL 324 CO 0.53 0.30 -0.08 -0.63 -3.33 0.00 0.00 175.10 171.89 3g2g s ILE 325 N 0.18 3.54 -0.16 7.04 1.01 0.01 -1.39 121.20 131.43 3g2g s ILE 325 Ca -0.04 -0.49 -0.15 0.00 0.00 0.00 0.00 60.65 59.97 3g2g s ILE 325 Cb -0.10 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.81 3g2g s ILE 325 CO 0.01 0.51 0.33 0.00 0.00 0.00 0.00 174.94 175.80 3g2g s ALA 327 N 0.62 0.85 0.00 0.00 0.00 -1.14 -2.00 121.76 120.08 3g2g s ALA 327 Ca 0.18 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.23 3g2g s ALA 327 Cb -0.13 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 22.98 3g2g s ALA 327 CO 0.05 0.04 0.00 2.41 0.00 0.00 0.00 175.76 178.26 3g2g n THR 328 N 1.26 -0.73 -1.22 0.00 -1.04 -1.26 -3.55 114.28 107.73 3g2g n THR 328 Ca -0.21 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.72 3g2g n THR 328 Cb 0.55 -0.98 -0.03 0.00 -1.82 0.00 0.00 70.33 68.05 3g2g n THR 328 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3g2g n GLN 329 N 1.90 -0.71 -0.32 -2.82 6.02 -1.26 -4.81 117.38 115.38 3g2g n GLN 329 Ca 0.00 0.71 -0.02 0.00 -0.01 0.00 0.00 57.00 57.69 3g2g n GLN 329 Cb 0.00 -4.57 0.15 0.00 1.02 0.00 0.00 30.24 26.84 3g2g n GLN 329 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 3g2g h MET 330 N 0.11 1.21 -0.31 -1.09 2.86 -1.88 -3.14 114.93 112.69 3g2g h MET 330 Ca -0.16 -0.08 -0.25 0.00 -2.06 0.00 0.00 59.70 57.15 3g2g h MET 330 Cb 0.59 -0.27 -0.33 0.00 0.06 0.00 0.00 31.60 31.65 3g2g h MET 330 CO 0.23 0.82 -0.91 1.28 1.06 0.00 0.00 176.91 179.39 3g2g n LEU 331 N -4.38 2.45 -0.29 1.22 4.77 -1.26 -4.54 117.00 114.96 3g2g n LEU 331 Ca 0.10 -3.34 0.09 0.00 -0.03 0.00 0.00 56.01 52.83 3g2g n LEU 331 Cb 0.03 -0.03 0.21 0.00 -2.33 0.00 0.00 43.42 41.30 3g2g n LEU 331 CO 0.37 1.23 0.83 -0.08 -1.33 0.00 0.00 177.39 178.41 3g2g h GLU 332 N 1.78 0.09 0.00 3.23 4.57 -1.94 0.27 114.58 122.59 3g2g h GLU 332 Ca -0.01 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3g2g h GLU 332 Cb 1.44 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 30.01 3g2g h GLU 332 CO 0.26 0.06 0.00 0.66 -1.18 0.00 0.00 179.01 178.81 3g2g h SER 333 N 0.10 0.00 0.02 1.04 4.64 -1.93 -1.40 113.55 116.02 3g2g h SER 333 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 3g2g h SER 333 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3g2g h SER 333 CO -0.74 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 175.45 3g2g n MET 334 N -2.52 0.85 -0.22 4.77 2.81 0.95 -1.73 117.12 122.03 3g2g n MET 334 Ca -0.01 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.82 3g2g n MET 334 Cb 0.09 -1.50 0.09 0.00 -0.71 0.00 0.00 33.22 31.19 3g2g n MET 334 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 3g2g h ILE 335 N 0.00 1.25 0.00 2.02 2.04 -1.41 -3.33 117.51 118.08 3g2g h ILE 335 Ca 0.00 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 64.91 3g2g h ILE 335 Cb 0.01 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 3g2g h ILE 335 CO 0.00 0.36 -0.87 0.29 0.00 0.00 0.00 178.15 177.93 3g2g n LYS 336 N -4.24 2.36 -4.27 2.37 4.01 -0.96 -0.86 118.16 116.58 3g2g n LYS 336 Ca 0.05 -0.04 -0.23 0.00 -0.51 0.00 0.00 58.31 57.59 3g2g n LYS 336 Cb 0.26 -1.07 -0.12 0.00 -0.51 0.00 0.00 35.03 33.58 3g2g n LYS 336 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 3g2g s LYS 337 N -2.23 1.05 0.00 1.97 3.01 -0.71 -4.96 119.74 117.87 3g2g s LYS 337 Ca 0.01 -1.10 0.29 0.00 -1.01 0.00 0.00 55.97 54.16 3g2g s LYS 337 Cb 0.07 -1.24 1.49 0.00 -1.01 0.00 0.00 37.83 37.14 3g2g s LYS 337 CO 0.40 0.29 2.01 -0.35 0.51 0.00 0.00 175.35 178.21 3g2g n PRO 338 N 1.17 0.47 -4.28 -1.68 -0.04 -1.26 -4.17 135.00 125.21 3g2g n PRO 338 Ca -0.20 0.01 -0.19 0.00 -0.04 0.00 0.00 63.50 63.08 3g2g n PRO 338 Cb 0.54 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.37 3g2g n PRO 338 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3g2g s ARG 339 N -2.50 0.88 0.65 0.54 1.81 -1.26 -4.92 118.95 114.14 3g2g s ARG 339 Ca 0.29 -0.81 -0.09 0.00 -1.72 0.00 0.00 55.73 53.41 3g2g s ARG 339 Cb 0.19 -0.88 0.01 0.00 -0.45 0.00 0.00 34.95 33.83 3g2g s ARG 339 CO 0.43 0.21 1.00 -1.25 -0.68 0.00 0.00 175.30 175.00 3g2g s PRO 340 N -1.32 2.87 0.89 3.54 0.04 -1.26 -4.59 135.00 135.17 3g2g s PRO 340 Ca 0.00 0.22 -0.12 0.00 0.04 0.00 0.00 61.00 61.13 3g2g s PRO 340 Cb -0.08 -2.15 0.12 0.00 0.04 0.00 0.00 34.50 32.43 3g2g s PRO 340 CO 0.02 -0.87 1.15 0.95 0.04 0.00 0.00 177.00 178.28 3g2g s THR 341 N -3.17 2.00 0.21 1.26 -4.23 -1.26 -4.89 115.64 105.55 3g2g s THR 341 Ca 0.56 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 61.23 3g2g s THR 341 Cb -0.11 -2.82 0.08 0.00 1.34 0.00 0.00 72.50 70.99 3g2g s THR 341 CO 0.48 0.00 1.69 0.03 -0.54 0.00 0.00 174.62 176.29 3g2g h ARG 342 N -1.39 0.00 -0.41 3.99 2.47 -1.99 -2.00 114.38 115.04 3g2g h ARG 342 Ca -0.49 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.11 3g2g h ARG 342 Cb 1.33 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.64 3g2g h ARG 342 CO 0.62 0.46 -0.20 0.00 0.56 0.00 0.00 179.97 181.41 3g2g h ALA 343 N 1.54 0.87 -0.19 0.04 0.00 -1.99 -2.35 119.26 117.19 3g2g h ALA 343 Ca -0.00 -0.37 -0.20 0.00 0.00 0.00 0.00 54.91 54.34 3g2g h ALA 343 Cb 0.96 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3g2g h ALA 343 CO 0.06 0.63 -0.67 0.93 0.00 0.00 0.00 179.25 180.21 3g2g h GLU 344 N 0.71 0.71 -0.60 0.00 5.08 -1.71 -0.46 114.58 118.32 3g2g h GLU 344 Ca 0.10 -0.52 0.05 0.00 -1.00 0.00 0.00 59.36 57.99 3g2g h GLU 344 Cb 0.72 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 30.01 3g2g h GLU 344 CO 0.06 1.14 0.32 0.78 -1.00 0.00 0.00 179.01 180.30 3g2g h GLY 345 N 0.80 0.86 1.31 -3.84 0.00 -1.35 -2.41 103.07 98.45 3g2g h GLY 345 Ca -0.02 -0.22 -0.16 0.00 0.00 0.00 0.00 47.33 46.94 3g2g h GLY 345 CO 0.13 0.13 -0.45 0.23 0.00 0.00 0.00 176.54 176.59 3g2g h SER 346 N 0.60 0.80 -0.21 0.19 0.87 -1.23 -2.78 113.55 111.79 3g2g h SER 346 Ca 0.27 -0.39 -0.00 0.00 -1.23 0.00 0.00 61.79 60.44 3g2g h SER 346 Cb 0.17 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 3g2g h SER 346 CO -0.18 1.13 0.13 -0.78 -0.53 0.00 0.00 176.83 176.60 3g2g h ASP 347 N 0.60 0.26 -0.29 6.23 3.58 -0.79 0.11 116.42 126.11 3g2g h ASP 347 Ca 0.04 -0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.42 3g2g h ASP 347 Cb 1.01 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.98 3g2g h ASP 347 CO 0.10 0.24 0.15 0.58 -2.88 0.00 0.00 179.24 177.42 3g2g h VAL 348 N 0.25 1.14 -0.59 2.25 2.07 -1.44 -0.67 116.25 119.26 3g2g h VAL 348 Ca 0.08 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 3g2g h VAL 348 Cb 0.03 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 3g2g h VAL 348 CO -0.01 0.14 0.34 0.00 0.02 0.00 0.00 177.57 178.06 3g2g h ALA 349 N 1.01 0.76 0.00 1.67 0.00 -1.28 -2.51 119.26 118.91 3g2g h ALA 349 Ca 0.10 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 3g2g h ALA 349 Cb 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3g2g h ALA 349 CO -0.01 0.26 -0.59 -0.91 0.00 0.00 0.00 179.25 177.99 3g2g h ASN 350 N 0.80 0.00 -0.58 0.00 2.35 -0.58 -0.65 115.58 116.92 3g2g h ASN 350 Ca 0.21 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 3g2g h ASN 350 Cb 0.02 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 3g2g h ASN 350 CO -0.04 0.59 0.27 0.00 -1.65 0.00 0.00 177.43 176.60 3g2g h ALA 351 N 1.41 0.75 -0.19 -0.83 0.00 -0.87 0.21 119.26 119.73 3g2g h ALA 351 Ca -0.01 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 3g2g h ALA 351 Cb 1.05 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3g2g h ALA 351 CO 0.08 0.32 -0.07 0.28 0.00 0.00 0.00 179.25 179.85 3g2g h VAL 352 N 0.79 1.30 -0.87 0.00 2.07 -1.18 -2.07 116.25 116.28 3g2g h VAL 352 Ca 0.20 -1.09 0.04 0.00 0.82 0.00 0.00 66.70 66.67 3g2g h VAL 352 Cb 0.13 1.62 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 3g2g h VAL 352 CO -0.02 0.33 0.57 -0.07 0.02 0.00 0.00 177.57 178.40 3g2g h LEU 353 N 0.09 0.92 -1.48 2.57 3.38 -1.00 -1.43 115.31 118.36 3g2g h LEU 353 Ca 0.05 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.11 3g2g h LEU 353 Cb 0.54 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 3g2g h LEU 353 CO 0.02 0.63 0.47 0.44 0.09 0.00 0.00 178.44 180.09 3g2g h ASP 354 N 1.06 0.53 0.00 -0.43 3.32 -0.42 -3.46 116.42 117.02 3g2g h ASP 354 Ca 0.35 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.41 3g2g h ASP 354 Cb 0.06 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.51 3g2g h ASP 354 CO -0.11 0.31 0.00 0.61 -1.72 0.00 0.00 179.24 178.34 3g2g n GLY 355 N -1.48 1.18 3.67 2.75 0.00 -0.54 -4.68 105.19 106.10 3g2g n GLY 355 Ca 0.12 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.68 3g2g n GLY 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g2g n ALA 356 N 0.00 1.53 -0.14 4.61 0.00 -0.80 -4.91 120.51 120.80 3g2g n ALA 356 Ca 0.00 0.44 -0.12 0.00 0.00 0.00 0.00 53.44 53.76 3g2g n ALA 356 Cb 0.00 -2.37 -0.01 0.00 0.00 0.00 0.00 19.45 17.06 3g2g n ALA 356 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3g2g h ASP 357 N 6.02 0.96 -4.68 0.00 3.32 -1.53 -3.45 116.42 117.06 3g2g h ASP 357 Ca -0.45 -0.42 -0.26 0.00 0.02 0.00 0.00 57.03 55.92 3g2g h ASP 357 Cb 1.25 -0.27 -0.18 0.00 0.22 0.00 0.00 39.33 40.35 3g2g h ASP 357 CO 0.90 1.18 -0.72 0.00 -1.72 0.00 0.00 179.24 178.87 3g2g s ILE 359 N -2.36 2.12 0.09 0.00 -4.36 -0.41 -1.60 121.20 114.67 3g2g s ILE 359 Ca -0.00 -2.30 0.06 0.00 -0.26 0.00 0.00 60.65 58.14 3g2g s ILE 359 Cb -0.03 -2.23 -0.03 0.00 1.25 0.00 0.00 42.46 41.42 3g2g s ILE 359 CO -0.02 -0.46 -0.15 -0.32 0.24 0.00 0.00 174.94 174.24 3g2g s MET 360 N -3.58 0.92 -0.04 0.37 1.75 -0.85 -0.99 119.30 116.88 3g2g s MET 360 Ca 0.27 -1.09 0.06 0.00 -1.25 0.00 0.00 55.69 53.68 3g2g s MET 360 Cb -0.02 -0.90 -0.01 0.00 2.84 0.00 0.00 34.83 36.74 3g2g s MET 360 CO 0.12 0.19 -0.22 -0.51 -0.65 0.00 0.00 175.02 173.95 3g2g s LEU 361 N -2.05 2.01 0.00 4.11 1.43 0.80 -4.43 118.68 120.56 3g2g s LEU 361 Ca 0.03 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 3g2g s LEU 361 Cb -0.08 -1.18 0.00 0.00 0.03 0.00 0.00 46.19 44.96 3g2g s LEU 361 CO 0.03 0.23 0.00 -1.20 0.23 0.00 0.00 176.35 175.63 3g2g n SER 362 N 2.88 0.00 -0.35 2.29 7.64 -1.26 -0.98 113.62 123.84 3g2g n SER 362 Ca -0.17 0.00 0.24 0.00 1.01 0.00 0.00 58.87 59.95 3g2g n SER 362 Cb 0.52 0.00 0.50 0.00 -1.01 0.00 0.00 64.21 64.22 3g2g n SER 362 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3g2g h GLY 363 N 0.00 1.50 0.61 0.23 0.00 -1.96 0.25 103.07 103.70 3g2g h GLY 363 Ca 0.00 -0.22 0.16 0.00 0.00 0.00 0.00 47.33 47.27 3g2g h GLY 363 CO 0.00 -0.25 0.52 0.83 0.00 0.00 0.00 176.54 177.64 3g2g h GLU 364 N 0.38 0.40 0.00 4.80 3.07 -1.89 -0.80 114.58 120.54 3g2g h GLU 364 Ca 0.66 -0.02 -0.17 0.00 -0.50 0.00 0.00 59.36 59.32 3g2g h GLU 364 Cb 1.62 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 29.41 3g2g h GLU 364 CO -0.40 0.26 -1.65 0.25 -1.40 0.00 0.00 179.01 176.07 3g2g n THR 365 N -4.48 0.64 0.24 1.13 -2.24 -0.62 -3.71 114.28 105.24 3g2g n THR 365 Ca 0.15 -0.40 -0.16 0.00 -2.27 0.00 0.00 64.05 61.37 3g2g n THR 365 Cb 0.57 -0.72 -0.08 0.00 -2.10 0.00 0.00 70.33 68.00 3g2g n THR 365 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g2g h ALA 366 N 0.49 -0.54 0.00 6.98 0.00 0.09 -3.34 119.26 122.94 3g2g h ALA 366 Ca -0.25 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3g2g h ALA 366 Cb 1.56 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.56 3g2g h ALA 366 CO 0.01 -0.80 -0.13 0.36 0.00 0.00 0.00 179.25 178.69 3g2g n LYS 367 N -5.32 3.08 -1.43 0.00 -0.00 -0.43 -1.30 118.16 112.76 3g2g n LYS 367 Ca -0.11 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 57.91 3g2g n LYS 367 Cb 0.23 -0.36 0.15 0.00 -0.00 0.00 0.00 35.03 35.05 3g2g n LYS 367 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 3g2g s GLY 368 N -0.54 1.58 0.04 2.58 0.00 -0.50 -4.75 107.32 105.73 3g2g s GLY 368 Ca 0.00 -0.53 0.28 0.00 0.00 0.00 0.00 44.72 44.47 3g2g s GLY 368 CO 0.00 0.07 1.88 1.22 0.00 0.00 0.00 173.10 176.26 3g2g n ASP 369 N -3.93 0.17 -2.58 1.64 8.00 -0.04 -4.26 116.55 115.56 3g2g n ASP 369 Ca 0.07 0.52 -0.15 0.00 0.71 0.00 0.00 54.79 55.93 3g2g n ASP 369 Cb 0.59 -0.56 0.02 0.00 -0.02 0.00 0.00 41.12 41.15 3g2g n ASP 369 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3g2g n TYR 370 N -1.66 2.03 -0.13 1.24 4.01 -1.26 -4.94 117.16 116.45 3g2g n TYR 370 Ca 0.06 -2.81 -0.04 0.00 -0.16 0.00 0.00 57.90 54.95 3g2g n TYR 370 Cb 0.35 -0.26 0.04 0.00 -0.31 0.00 0.00 39.34 39.16 3g2g n TYR 370 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3g2g h PRO 371 N 2.78 0.15 -0.49 -0.72 0.13 -1.74 -1.24 132.00 130.87 3g2g h PRO 371 Ca 0.06 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 65.07 3g2g h PRO 371 Cb 1.12 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 3g2g h PRO 371 CO 0.61 0.10 -0.15 -0.07 -0.23 0.00 0.00 178.00 178.26 3g2g h LEU 372 N 0.15 0.95 -0.68 1.56 3.38 -1.92 -2.31 115.31 116.44 3g2g h LEU 372 Ca 0.21 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 3g2g h LEU 372 Cb 0.29 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3g2g h LEU 372 CO -0.32 1.09 0.20 -0.33 0.09 0.00 0.00 178.44 179.16 3g2g h GLU 373 N 0.83 1.07 -0.73 1.13 3.07 -1.80 -0.62 114.58 117.53 3g2g h GLU 373 Ca 0.12 -0.24 0.00 0.00 -0.50 0.00 0.00 59.36 58.75 3g2g h GLU 373 Cb 0.70 -0.15 -0.04 0.00 -0.84 0.00 0.00 28.75 28.42 3g2g h GLU 373 CO 0.05 0.94 0.46 0.00 -1.40 0.00 0.00 179.01 179.06 3g2g h ALA 374 N 1.09 0.93 -0.40 3.43 0.00 -0.98 -0.71 119.26 122.62 3g2g h ALA 374 Ca 0.22 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 3g2g h ALA 374 Cb 0.32 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3g2g h ALA 374 CO -0.00 0.37 -0.10 0.28 0.00 0.00 0.00 179.25 179.80 3g2g h VAL 375 N 0.99 1.28 -0.46 0.00 2.07 -1.10 -2.31 116.25 116.73 3g2g h VAL 375 Ca 0.27 -1.19 -0.06 0.00 0.82 0.00 0.00 66.70 66.54 3g2g h VAL 375 Cb -0.08 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 3g2g h VAL 375 CO -0.05 0.40 0.05 0.03 0.02 0.00 0.00 177.57 178.01 3g2g h ARG 376 N 0.59 0.72 -0.19 1.57 3.08 -0.91 -1.84 114.38 117.40 3g2g h ARG 376 Ca 0.10 -0.16 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 3g2g h ARG 376 Cb 0.63 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 3g2g h ARG 376 CO 0.04 0.70 -0.26 1.98 -1.07 0.00 0.00 179.97 181.36 3g2g h MET 377 N 0.69 0.52 -0.89 0.04 -1.53 -0.97 0.13 114.93 112.92 3g2g h MET 377 Ca 0.14 -0.30 0.06 0.00 -3.44 0.00 0.00 59.70 56.16 3g2g h MET 377 Cb 0.35 0.02 -0.06 0.00 -0.55 0.00 0.00 31.60 31.37 3g2g h MET 377 CO 0.01 0.89 0.56 1.96 0.14 0.00 0.00 176.91 180.47 3g2g h GLN 378 N 0.18 1.00 0.11 0.39 4.20 -1.36 0.60 115.11 120.23 3g2g h GLN 378 Ca 0.02 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 3g2g h GLN 378 Cb 0.83 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.39 3g2g h GLN 378 CO 0.06 0.66 -0.05 1.25 -0.67 0.00 0.00 178.83 180.08 3g2g h HIS 379 N 1.03 -0.13 -0.27 2.96 2.76 -1.01 0.60 115.15 121.10 3g2g h HIS 379 Ca 0.38 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.56 3g2g h HIS 379 Cb 0.13 0.04 -0.02 0.00 1.55 0.00 0.00 27.41 29.12 3g2g h HIS 379 CO -0.02 -0.01 0.15 -0.07 -1.30 0.00 0.00 177.93 176.68 3g2g h LEU 380 N -0.23 0.23 -0.20 0.26 3.38 -0.44 -2.39 115.31 115.92 3g2g h LEU 380 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3g2g h LEU 380 Cb 0.18 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3g2g h LEU 380 CO 0.02 0.17 -0.01 0.40 0.09 0.00 0.00 178.44 179.12 3g2g h ILE 381 N 0.31 1.26 -0.50 1.22 2.04 -0.77 -2.43 117.51 118.63 3g2g h ILE 381 Ca 0.11 -0.90 0.09 0.00 1.00 0.00 0.00 64.86 65.15 3g2g h ILE 381 Cb 0.01 1.46 -0.07 0.00 -0.74 0.00 0.00 36.82 37.48 3g2g h ILE 381 CO -0.06 0.27 0.07 0.00 0.00 0.00 0.00 178.15 178.44 3g2g h ALA 382 N 0.78 0.54 -0.38 1.87 0.00 -0.85 0.49 119.26 121.70 3g2g h ALA 382 Ca 0.06 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.09 3g2g h ALA 382 Cb 0.41 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3g2g h ALA 382 CO 0.01 -0.34 0.25 -0.09 0.00 0.00 0.00 179.25 179.08 3g2g h ARG 383 N 0.20 0.49 -0.06 0.00 2.43 -1.37 0.14 114.38 116.20 3g2g h ARG 383 Ca 0.25 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 3g2g h ARG 383 Cb 0.35 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 3g2g h ARG 383 CO -0.36 0.32 0.03 0.93 -1.51 0.00 0.00 179.97 179.39 3g2g h GLU 384 N 0.50 0.07 -0.62 0.20 4.39 -0.91 -3.03 114.58 115.18 3g2g h GLU 384 Ca 0.14 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.81 3g2g h GLU 384 Cb -0.05 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 3g2g h GLU 384 CO -0.04 0.04 0.29 0.00 -1.16 0.00 0.00 179.01 178.15 3g2g h ALA 385 N 1.03 1.36 -0.75 3.43 0.00 -0.59 -2.69 119.26 121.04 3g2g h ALA 385 Ca 0.02 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.83 3g2g h ALA 385 Cb -0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 3g2g h ALA 385 CO -0.01 0.50 0.49 0.93 0.00 0.00 0.00 179.25 181.16 3g2g h GLU 386 N 0.87 0.91 0.00 0.00 5.08 -0.62 -0.30 114.58 120.53 3g2g h GLU 386 Ca 0.21 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 3g2g h GLU 386 Cb 0.10 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.14 3g2g h GLU 386 CO -0.03 0.60 -0.14 0.00 -1.00 0.00 0.00 179.01 178.45 3g2g h ALA 387 N 1.56 0.95 -0.01 3.43 0.00 -1.42 -3.16 119.26 120.60 3g2g h ALA 387 Ca 0.29 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3g2g h ALA 387 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3g2g h ALA 387 CO -0.08 0.17 -0.20 0.00 0.00 0.00 0.00 179.25 179.15 3g2g n ALA 388 N -2.15 2.95 -1.77 0.00 0.00 -0.16 -4.54 120.51 114.85 3g2g n ALA 388 Ca 0.02 -0.39 -0.40 0.00 0.00 0.00 0.00 53.44 52.67 3g2g n ALA 388 Cb 0.49 -1.17 0.02 0.00 0.00 0.00 0.00 19.45 18.79 3g2g n ALA 388 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3g2g s ILE 389 N -2.41 2.06 -1.17 0.00 1.01 -0.95 -4.92 121.20 114.82 3g2g s ILE 389 Ca 0.27 0.05 -0.13 0.00 0.00 0.00 0.00 60.65 60.84 3g2g s ILE 389 Cb 0.20 -3.03 0.19 0.00 0.01 0.00 0.00 42.46 39.83 3g2g s ILE 389 CO 0.48 0.01 1.35 -0.47 0.00 0.00 0.00 174.94 176.31 3g2g s TYR 390 N -1.21 3.62 0.36 3.97 5.04 -1.26 -4.85 117.35 123.03 3g2g s TYR 390 Ca 0.62 -2.20 0.05 0.00 -2.44 0.00 0.00 57.07 53.10 3g2g s TYR 390 Cb -0.44 -4.22 0.68 0.00 0.35 0.00 0.00 41.96 38.33 3g2g s TYR 390 CO 0.56 -1.32 1.92 0.45 -1.34 0.00 0.00 175.55 175.83 3g2g h HIS 391 N 7.16 0.52 -0.34 4.97 3.86 -1.91 -2.06 115.15 127.35 3g2g h HIS 391 Ca 0.28 -0.04 0.07 0.00 -1.16 0.00 0.00 60.37 59.53 3g2g h HIS 391 Cb 0.88 -0.16 -0.08 0.00 1.06 0.00 0.00 27.41 29.12 3g2g h HIS 391 CO 1.04 0.47 -0.18 1.25 0.86 0.00 0.00 177.93 181.38 3g2g h LEU 392 N 0.50 -0.61 -0.08 2.43 5.85 -1.89 0.24 115.31 121.76 3g2g h LEU 392 Ca 0.12 0.14 -0.15 0.00 0.84 0.00 0.00 57.88 58.82 3g2g h LEU 392 Cb 0.23 0.32 0.01 0.00 0.37 0.00 0.00 40.66 41.59 3g2g h LEU 392 CO -0.00 -0.22 -0.55 -0.61 -0.34 0.00 0.00 178.44 176.72 3g2g h GLN 393 N -0.13 0.52 0.03 1.25 4.15 -1.87 -2.87 115.11 116.19 3g2g h GLN 393 Ca 0.17 -0.45 0.01 0.00 0.77 0.00 0.00 58.65 59.16 3g2g h GLN 393 Cb 0.39 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.17 3g2g h GLN 393 CO -0.42 1.08 -0.10 1.25 -1.93 0.00 0.00 178.83 178.71 3g2g h LEU 394 N 0.11 -0.28 -0.33 -2.39 5.85 -1.10 -0.93 115.31 116.25 3g2g h LEU 394 Ca -0.04 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 3g2g h LEU 394 Cb 1.21 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.33 3g2g h LEU 394 CO 0.11 -0.14 0.17 0.15 -0.34 0.00 0.00 178.44 178.38 3g2g h PHE 395 N -0.18 0.48 -0.96 1.25 -0.00 -0.61 -0.37 116.94 116.54 3g2g h PHE 395 Ca 0.03 -0.02 0.04 0.00 -0.00 0.00 0.00 57.97 58.01 3g2g h PHE 395 Cb 0.21 -0.15 -0.06 0.00 -0.00 0.00 0.00 35.95 35.96 3g2g h PHE 395 CO -0.15 0.41 0.62 0.93 -0.00 0.00 0.00 178.31 180.12 3g2g h GLU 396 N 0.41 1.17 -0.09 1.11 4.39 -1.39 -0.36 114.58 119.82 3g2g h GLU 396 Ca 0.12 -0.07 -0.15 0.00 0.34 0.00 0.00 59.36 59.60 3g2g h GLU 396 Cb 0.11 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.48 3g2g h GLU 396 CO -0.02 0.77 -0.60 0.93 -1.16 0.00 0.00 179.01 178.94 3g2g h GLU 397 N 1.20 0.30 -0.31 2.33 5.08 -0.78 -1.62 114.58 120.79 3g2g h GLU 397 Ca 0.38 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.41 3g2g h GLU 397 Cb 0.01 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 3g2g h GLU 397 CO -0.13 0.81 -0.29 -0.07 -1.00 0.00 0.00 179.01 178.33 3g2g h LEU 398 N 0.23 0.79 -0.18 1.33 3.38 -0.51 -1.39 115.31 118.96 3g2g h LEU 398 Ca -0.00 -0.46 0.03 0.00 0.09 0.00 0.00 57.88 57.53 3g2g h LEU 398 Cb 1.11 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 3g2g h LEU 398 CO 0.10 1.09 0.01 0.03 0.09 0.00 0.00 178.44 179.76 3g2g h ARG 399 N 0.50 0.07 -0.52 1.13 3.08 -1.00 -1.67 114.38 115.97 3g2g h ARG 399 Ca 0.05 -0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.99 3g2g h ARG 399 Cb 0.86 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 3g2g h ARG 399 CO 0.07 0.05 -0.10 0.00 -1.07 0.00 0.00 179.97 178.92 3g2g h ARG 400 N 0.07 0.96 -0.00 0.04 3.08 -1.23 -2.97 114.38 114.33 3g2g h ARG 400 Ca 0.09 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 59.79 3g2g h ARG 400 Cb 0.10 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.08 3g2g h ARG 400 CO -0.14 1.01 -0.10 1.47 -1.07 0.00 0.00 179.97 181.15 3g2g n LEU 401 N -4.15 0.30 -4.73 3.04 -0.00 -0.53 -4.85 117.00 106.09 3g2g n LEU 401 Ca 0.02 0.12 -0.41 0.00 -0.00 0.00 0.00 56.01 55.73 3g2g n LEU 401 Cb 0.39 -0.24 -0.03 0.00 -0.00 0.00 0.00 43.42 43.54 3g2g n LEU 401 CO 0.45 0.06 0.97 0.00 -0.00 0.00 0.00 177.39 178.86 3g2g s ALA 402 N -2.58 3.51 0.00 1.47 0.00 -0.64 -5.06 121.76 118.46 3g2g s ALA 402 Ca 0.26 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.28 3g2g s ALA 402 Cb 0.20 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.84 3g2g s ALA 402 CO 0.49 -0.51 0.00 -2.30 0.00 0.00 0.00 175.76 173.44 3g2g n PRO 403 N 2.96 0.00 -0.33 0.00 -0.02 -1.26 -5.04 135.00 131.30 3g2g n PRO 403 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 3g2g n PRO 403 Cb 0.43 -0.29 0.00 0.00 -0.02 0.00 0.00 33.50 33.62 3g2g n PRO 403 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3g2g n ASP 407 N 0.00 -1.08 0.10 2.55 -0.08 -1.26 -5.13 116.55 111.65 3g2g n ASP 407 Ca 0.00 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.31 3g2g n ASP 407 Cb 0.00 -0.54 0.40 0.00 2.34 0.00 0.00 41.12 43.32 3g2g n ASP 407 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3g2g h PRO 408 N 0.00 0.30 -0.34 -0.67 0.11 -2.04 -2.55 132.00 126.82 3g2g h PRO 408 Ca 0.00 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 65.95 3g2g h PRO 408 Cb 0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 3g2g h PRO 408 CO 0.00 0.37 -0.22 1.79 -0.21 0.00 0.00 178.00 179.73 3g2g h THR 409 N 0.29 1.27 -0.49 -1.15 1.35 -1.99 0.56 112.91 112.76 3g2g h THR 409 Ca 0.07 -1.29 -0.12 0.00 -0.55 0.00 0.00 66.41 64.51 3g2g h THR 409 Cb 0.28 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 67.93 3g2g h THR 409 CO 0.01 0.42 -0.18 -0.08 -0.25 0.00 0.00 175.52 175.44 3g2g h GLU 410 N 0.57 0.97 -0.46 4.72 4.57 -1.92 -1.58 114.58 121.46 3g2g h GLU 410 Ca 0.08 -0.39 -0.11 0.00 -1.18 0.00 0.00 59.36 57.77 3g2g h GLU 410 Cb 0.69 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.22 3g2g h GLU 410 CO 0.05 1.06 -0.14 0.00 -1.18 0.00 0.00 179.01 178.80 3g2g h ALA 411 N 0.93 0.89 -0.46 2.92 0.00 -1.05 -2.02 119.26 120.48 3g2g h ALA 411 Ca 0.12 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 3g2g h ALA 411 Cb 0.75 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3g2g h ALA 411 CO 0.06 0.63 -0.22 1.15 0.00 0.00 0.00 179.25 180.88 3g2g h THR 412 N 0.76 1.27 -0.24 0.00 2.02 -0.75 -1.42 112.91 114.55 3g2g h THR 412 Ca 0.12 -1.37 -0.06 0.00 0.77 0.00 0.00 66.41 65.87 3g2g h THR 412 Cb 0.66 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 3g2g h THR 412 CO 0.05 0.47 -0.09 0.00 0.37 0.00 0.00 175.52 176.32 3g2g h ALA 413 N 0.93 0.34 -0.44 6.16 0.00 -1.18 -0.79 119.26 124.27 3g2g h ALA 413 Ca 0.11 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 3g2g h ALA 413 Cb 0.78 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3g2g h ALA 413 CO 0.06 0.16 -0.05 -0.24 0.00 0.00 0.00 179.25 179.18 3g2g h VAL 414 N 0.21 1.25 -0.70 0.00 3.04 -1.35 -1.72 116.25 116.98 3g2g h VAL 414 Ca 0.06 -1.07 -0.05 0.00 -1.01 0.00 0.00 66.70 64.64 3g2g h VAL 414 Cb 0.57 0.97 -0.03 0.00 -2.01 0.00 0.00 31.29 30.78 3g2g h VAL 414 CO 0.03 0.37 0.25 1.23 -1.01 0.00 0.00 177.57 178.44 3g2g h GLY 415 N 0.97 1.14 0.99 3.17 0.00 -1.13 -0.23 103.07 108.00 3g2g h GLY 415 Ca 0.13 -0.65 -0.03 0.00 0.00 0.00 0.00 47.33 46.78 3g2g h GLY 415 CO 0.03 0.61 0.27 0.00 0.00 0.00 0.00 176.54 177.44 3g2g h ALA 416 N 1.12 0.78 -0.35 3.60 0.00 -0.79 -0.41 119.26 123.21 3g2g h ALA 416 Ca 0.23 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3g2g h ALA 416 Cb 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3g2g h ALA 416 CO -0.01 0.37 0.07 0.28 0.00 0.00 0.00 179.25 179.96 3g2g h VAL 417 N 0.83 1.23 -0.19 0.00 2.07 -0.96 0.50 116.25 119.74 3g2g h VAL 417 Ca 0.21 -0.79 0.04 0.00 0.82 0.00 0.00 66.70 66.97 3g2g h VAL 417 Cb 0.16 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 3g2g h VAL 417 CO -0.02 0.27 -0.03 -0.08 0.02 0.00 0.00 177.57 177.73 3g2g h GLU 418 N 0.41 0.02 -0.81 1.57 4.57 -0.92 -1.87 114.58 117.55 3g2g h GLU 418 Ca 0.11 -0.00 0.10 0.00 -1.18 0.00 0.00 59.36 58.38 3g2g h GLU 418 Cb 0.33 -0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 28.84 3g2g h GLU 418 CO 0.00 0.01 0.45 0.00 -1.18 0.00 0.00 179.01 178.30 3g2g h ALA 419 N 1.18 1.15 -0.06 2.92 0.00 -0.73 -2.04 119.26 121.67 3g2g h ALA 419 Ca 0.09 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3g2g h ALA 419 Cb 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3g2g h ALA 419 CO -0.18 0.07 -0.27 0.66 0.00 0.00 0.00 179.25 179.53 3g2g h SER 420 N 0.75 0.11 0.49 0.00 4.64 -0.14 -0.13 113.55 119.27 3g2g h SER 420 Ca 0.39 -0.03 -0.15 0.00 -0.47 0.00 0.00 61.79 61.54 3g2g h SER 420 Cb 0.38 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 3g2g h SER 420 CO -0.25 0.38 -0.64 -0.26 -0.87 0.00 0.00 176.83 175.19 3g2g h PHE 421 N 0.10 0.19 -0.14 4.77 0.04 -0.88 -1.81 116.94 119.20 3g2g h PHE 421 Ca 0.01 -0.08 -0.11 0.00 2.80 0.00 0.00 57.97 60.60 3g2g h PHE 421 Cb 0.54 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.66 3g2g h PHE 421 CO 0.00 0.74 -0.33 0.87 -0.60 0.00 0.00 178.31 179.00 3g2g h LYS 422 N 0.10 0.48 -0.15 1.51 6.56 -0.38 -3.28 116.57 121.41 3g2g h LYS 422 Ca -0.01 -0.32 0.00 0.00 -1.06 0.00 0.00 60.65 59.26 3g2g h LYS 422 Cb 1.15 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.85 3g2g h LYS 422 CO 0.09 0.93 0.00 0.00 -2.06 0.00 0.00 179.45 178.41 3g2g s SER 425 N -4.28 3.46 0.37 0.00 1.04 -1.05 -4.93 113.70 108.31 3g2g s SER 425 Ca 0.06 2.24 0.25 0.00 0.48 0.00 0.00 55.95 58.98 3g2g s SER 425 Cb -0.03 -2.57 0.62 0.00 0.10 0.00 0.00 66.02 64.14 3g2g s SER 425 CO 0.83 -2.75 1.70 1.23 0.98 0.00 0.00 173.24 175.23 3g2g h GLY 426 N -1.27 0.00 -3.27 7.32 0.00 -1.70 -3.44 103.07 100.71 3g2g h GLY 426 Ca -0.45 0.00 0.20 0.00 0.00 0.00 0.00 47.33 47.09 3g2g h GLY 426 CO 0.45 0.00 0.65 0.00 0.00 0.00 0.00 176.54 177.64 3g2g s ALA 427 N -3.23 -1.95 -0.23 3.60 0.00 -1.26 -4.36 121.76 114.33 3g2g s ALA 427 Ca 0.07 1.05 0.01 0.00 0.00 0.00 0.00 51.96 53.09 3g2g s ALA 427 Cb 0.08 0.25 0.03 0.00 0.00 0.00 0.00 23.12 23.48 3g2g s ALA 427 CO 0.62 -0.76 -0.12 0.42 0.00 0.00 0.00 175.76 175.92 3g2g s ILE 428 N -2.79 2.39 -0.20 0.00 1.01 -0.40 -1.69 121.20 119.52 3g2g s ILE 428 Ca 0.09 -1.19 -0.17 0.00 0.00 0.00 0.00 60.65 59.39 3g2g s ILE 428 Cb -0.00 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 3g2g s ILE 428 CO -0.05 0.24 0.43 -0.63 0.00 0.00 0.00 174.94 174.93 3g2g s ILE 429 N 1.24 5.17 -0.12 2.92 1.01 0.80 -1.34 121.20 130.89 3g2g s ILE 429 Ca -0.01 0.78 0.01 0.00 0.00 0.00 0.00 60.65 61.44 3g2g s ILE 429 Cb -0.16 -3.76 0.02 0.00 0.01 0.00 0.00 42.46 38.56 3g2g s ILE 429 CO -0.07 0.24 -0.15 -0.69 0.00 0.00 0.00 174.94 174.26 3g2g s VAL 430 N 1.36 1.54 -0.19 2.92 1.01 -0.02 0.10 120.40 127.13 3g2g s VAL 430 Ca 0.21 -0.65 -0.21 0.00 0.00 0.00 0.00 61.98 61.32 3g2g s VAL 430 Cb -0.15 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 3g2g s VAL 430 CO 0.09 0.45 0.65 -0.76 0.00 0.00 0.00 175.10 175.52 3g2g s LEU 431 N 1.09 4.16 -0.12 3.92 1.43 -0.54 -0.86 118.68 127.75 3g2g s LEU 431 Ca -0.04 0.88 -0.09 0.00 -1.03 0.00 0.00 54.13 53.85 3g2g s LEU 431 Cb -0.14 -2.93 0.04 0.00 0.03 0.00 0.00 46.19 43.19 3g2g s LEU 431 CO -0.04 -0.27 0.32 0.28 0.23 0.00 0.00 176.35 176.87 3g2g s THR 432 N 1.83 -0.01 -0.17 5.49 -1.32 -0.71 -4.51 115.64 116.23 3g2g s THR 432 Ca 0.30 0.05 -0.16 0.00 -1.21 0.00 0.00 61.69 60.68 3g2g s THR 432 Cb -0.16 -0.46 -0.12 0.00 -1.51 0.00 0.00 72.50 70.25 3g2g s THR 432 CO 0.11 0.02 0.06 0.11 -2.21 0.00 0.00 174.62 172.71 3g2g h LYS 433 N 6.30 0.00 0.00 7.08 6.56 -1.96 -3.35 116.57 131.20 3g2g h LYS 433 Ca -0.32 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.27 3g2g h LYS 433 Cb 1.18 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.84 3g2g h LYS 433 CO 0.32 0.54 -0.65 0.66 -2.06 0.00 0.00 179.45 178.27 3g2g h SER 434 N -1.00 0.00 0.00 0.86 4.64 -1.98 -3.42 113.55 112.65 3g2g h SER 434 Ca -0.17 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 3g2g h SER 434 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 3g2g h SER 434 CO -0.11 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.53 3g2g n GLY 435 N 1.27 3.40 0.29 -0.77 0.00 -1.26 -4.84 105.19 103.28 3g2g n GLY 435 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.00 3g2g n GLY 435 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3g2g h ARG 436 N 2.61 -0.12 -0.79 1.61 1.12 -1.96 -0.00 114.38 116.85 3g2g h ARG 436 Ca 0.00 0.01 0.11 0.00 -1.11 0.00 0.00 59.98 58.99 3g2g h ARG 436 Cb 0.00 0.03 -0.08 0.00 -0.01 0.00 0.00 29.97 29.91 3g2g h ARG 436 CO 0.00 -0.08 0.42 -0.92 -3.11 0.00 0.00 179.97 176.27 3g2g h TYR 437 N -0.13 0.74 -0.17 2.20 3.20 -1.92 -0.18 116.97 120.72 3g2g h TYR 437 Ca 0.23 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.98 3g2g h TYR 437 Cb 0.49 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 3g2g h TYR 437 CO -0.52 0.26 -0.54 0.00 -1.64 0.00 0.00 178.16 175.72 3g2g h ALA 438 N 1.47 0.76 -0.90 1.82 0.00 -1.61 -2.84 119.26 117.95 3g2g h ALA 438 Ca 0.39 -0.51 0.06 0.00 0.00 0.00 0.00 54.91 54.86 3g2g h ALA 438 Cb 0.44 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 3g2g h ALA 438 CO -0.28 0.69 0.57 0.45 0.00 0.00 0.00 179.25 180.67 3g2g h HIS 439 N 0.37 1.06 -0.38 0.00 3.86 0.58 -1.20 115.15 119.43 3g2g h HIS 439 Ca 0.01 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.19 3g2g h HIS 439 Cb 1.07 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 29.17 3g2g h HIS 439 CO 0.04 0.54 -0.02 1.96 0.86 0.00 0.00 177.93 181.31 3g2g h GLN 440 N 1.04 0.62 -0.20 2.45 4.20 -0.87 -1.74 115.11 120.62 3g2g h GLN 440 Ca 0.39 -0.15 -0.14 0.00 0.06 0.00 0.00 58.65 58.81 3g2g h GLN 440 Cb 0.16 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.86 3g2g h GLN 440 CO -0.17 0.66 -0.42 0.28 -0.67 0.00 0.00 178.83 178.51 3g2g h VAL 441 N 0.58 1.33 -0.20 -0.54 2.07 -1.30 -3.26 116.25 114.93 3g2g h VAL 441 Ca 0.12 -1.65 -0.02 0.00 0.82 0.00 0.00 66.70 65.96 3g2g h VAL 441 Cb 0.41 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 3g2g h VAL 441 CO 0.02 0.51 0.02 0.00 0.02 0.00 0.00 177.57 178.15 3g2g h ALA 442 N 0.59 1.68 0.00 1.67 0.00 -0.74 -2.27 119.26 120.19 3g2g h ALA 442 Ca 0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3g2g h ALA 442 Cb 1.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3g2g h ALA 442 CO 0.09 0.24 -0.01 0.00 0.00 0.00 0.00 179.25 179.58 3g2g h ARG 443 N 0.28 0.00 -0.23 0.00 3.08 -1.37 0.75 114.38 116.90 3g2g h ARG 443 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 3g2g h ARG 443 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 3g2g h ARG 443 CO 0.00 0.01 0.00 0.66 -1.07 0.00 0.00 179.97 179.57 3g2g n TYR 444 N -3.15 0.29 -3.67 3.04 4.01 -0.86 -4.97 117.16 111.85 3g2g n TYR 444 Ca -0.02 -0.14 -0.28 0.00 -0.16 0.00 0.00 57.90 57.30 3g2g n TYR 444 Cb 0.17 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.24 3g2g n TYR 444 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3g2g n ARG 445 N 0.61 -1.90 -1.18 -0.72 5.12 0.26 -4.82 116.66 114.03 3g2g n ARG 445 Ca 0.17 0.51 -0.32 0.00 -1.93 0.00 0.00 57.85 56.28 3g2g n ARG 445 Cb 0.39 -4.44 0.11 0.00 -1.16 0.00 0.00 32.46 27.37 3g2g n ARG 445 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3g2g s PRO 446 N -5.88 1.93 0.02 5.56 0.04 -1.26 -4.94 135.00 130.46 3g2g s PRO 446 Ca 0.38 1.41 -0.20 0.00 0.04 0.00 0.00 61.00 62.63 3g2g s PRO 446 Cb -0.13 -1.84 -0.19 0.00 0.04 0.00 0.00 34.50 32.38 3g2g s PRO 446 CO 0.85 -1.93 1.19 -0.09 0.04 0.00 0.00 177.00 177.06 3g2g h ARG 447 N -1.06 0.39 -6.96 4.56 2.43 -1.94 -3.45 114.38 108.35 3g2g h ARG 447 Ca -0.44 -0.32 -0.54 0.00 -0.81 0.00 0.00 59.98 57.87 3g2g h ARG 447 Cb 1.26 0.07 0.10 0.00 -0.42 0.00 0.00 29.97 30.98 3g2g h ARG 447 CO 0.48 0.96 0.70 0.00 -1.51 0.00 0.00 179.97 180.61 3g2g s ALA 448 N -3.62 3.37 0.58 2.80 0.00 -1.26 -4.97 121.76 118.66 3g2g s ALA 448 Ca -0.14 1.43 -0.19 0.00 0.00 0.00 0.00 51.96 53.06 3g2g s ALA 448 Cb 0.04 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.56 3g2g s ALA 448 CO 0.79 -1.02 1.22 -1.25 0.00 0.00 0.00 175.76 175.50 3g2g s PRO 449 N -2.23 3.01 -0.45 0.00 0.04 -1.26 -4.72 135.00 129.38 3g2g s PRO 449 Ca 0.56 1.86 -0.12 0.00 0.04 0.00 0.00 61.00 63.35 3g2g s PRO 449 Cb -0.43 -1.97 0.08 0.00 0.04 0.00 0.00 34.50 32.22 3g2g s PRO 449 CO 0.57 -1.19 0.33 0.42 0.04 0.00 0.00 177.00 177.17 3g2g s ILE 450 N -1.56 4.68 -0.46 0.56 1.01 0.20 -1.28 121.20 124.35 3g2g s ILE 450 Ca 0.77 -1.30 -0.24 0.00 0.00 0.00 0.00 60.65 59.88 3g2g s ILE 450 Cb -0.31 -3.85 0.03 0.00 0.01 0.00 0.00 42.46 38.33 3g2g s ILE 450 CO 0.34 -0.57 0.85 -0.63 0.00 0.00 0.00 174.94 174.93 3g2g s ILE 451 N 1.52 4.56 -0.45 2.92 1.01 -0.45 0.80 121.20 131.10 3g2g s ILE 451 Ca 0.04 0.55 -0.17 0.00 0.00 0.00 0.00 60.65 61.07 3g2g s ILE 451 Cb -0.24 -4.38 0.05 0.00 0.01 0.00 0.00 42.46 37.90 3g2g s ILE 451 CO 0.04 -0.79 0.44 0.00 0.00 0.00 0.00 174.94 174.63 3g2g s ALA 452 N 3.51 3.47 -0.38 9.38 0.00 -0.76 -0.84 121.76 136.15 3g2g s ALA 452 Ca 0.33 -1.80 -0.20 0.00 0.00 0.00 0.00 51.96 50.29 3g2g s ALA 452 Cb -0.11 -3.09 0.01 0.00 0.00 0.00 0.00 23.12 19.92 3g2g s ALA 452 CO 0.24 -1.70 0.61 0.08 0.00 0.00 0.00 175.76 174.99 3g2g s VAL 453 N 1.99 4.90 0.09 0.00 1.01 -0.04 -0.63 120.40 127.73 3g2g s VAL 453 Ca 0.09 0.40 0.05 0.00 0.00 0.00 0.00 61.98 62.52 3g2g s VAL 453 Cb -0.20 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 3g2g s VAL 453 CO 0.10 -0.37 -0.12 0.28 0.00 0.00 0.00 175.10 175.00 3g2g s THR 454 N 2.67 1.06 -1.42 3.92 -1.32 -0.81 -1.74 115.64 118.00 3g2g s THR 454 Ca 0.23 -1.55 0.24 0.00 -1.21 0.00 0.00 61.69 59.40 3g2g s THR 454 Cb -0.15 -1.29 0.05 0.00 -1.51 0.00 0.00 72.50 69.60 3g2g s THR 454 CO 0.16 -0.43 1.32 0.54 -2.21 0.00 0.00 174.62 174.00 3g2g n ARG 455 N 0.78 0.47 -3.14 7.08 1.74 -1.26 -0.75 116.66 121.58 3g2g n ARG 455 Ca -0.18 -0.32 -0.42 0.00 -0.77 0.00 0.00 57.85 56.17 3g2g n ARG 455 Cb 0.56 -1.49 -0.07 0.00 -1.02 0.00 0.00 32.46 30.44 3g2g n ARG 455 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3g2g s ASN 456 N -2.75 6.41 0.28 0.55 3.84 -1.26 -4.87 114.94 117.13 3g2g s ASN 456 Ca 0.16 0.12 -0.02 0.00 0.21 0.00 0.00 52.86 53.34 3g2g s ASN 456 Cb 0.18 -2.32 0.38 0.00 -0.55 0.00 0.00 41.25 38.95 3g2g s ASN 456 CO 0.65 -0.57 1.82 -0.65 -2.79 0.00 0.00 177.10 175.57 3g2g h PRO 457 N 8.45 0.86 -0.36 0.43 0.11 -1.95 -1.65 132.00 137.89 3g2g h PRO 457 Ca -0.27 -0.17 -0.11 0.00 0.11 0.00 0.00 66.00 65.57 3g2g h PRO 457 Cb 1.11 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 3g2g h PRO 457 CO 0.82 0.76 -0.19 0.37 -0.21 0.00 0.00 178.00 179.56 3g2g h GLN 458 N 0.83 0.77 -0.70 1.05 4.15 -1.97 -2.45 115.11 116.79 3g2g h GLN 458 Ca 0.18 -0.34 0.09 0.00 0.77 0.00 0.00 58.65 59.35 3g2g h GLN 458 Cb 0.28 -0.02 -0.07 0.00 0.21 0.00 0.00 27.48 27.88 3g2g h GLN 458 CO -0.00 0.96 0.34 1.15 -1.93 0.00 0.00 178.83 179.35 3g2g h THR 459 N 0.56 0.85 -0.91 2.39 2.02 -1.79 -0.78 112.91 115.25 3g2g h THR 459 Ca 0.08 -0.20 0.02 0.00 0.77 0.00 0.00 66.41 67.07 3g2g h THR 459 Cb 0.74 0.21 -0.05 0.00 -1.74 0.00 0.00 68.15 67.31 3g2g h THR 459 CO 0.06 0.11 0.60 0.00 0.37 0.00 0.00 175.52 176.66 3g2g h ALA 460 N 1.42 1.37 0.08 6.16 0.00 -1.00 -2.03 119.26 125.27 3g2g h ALA 460 Ca 0.34 -0.06 -0.23 0.00 0.00 0.00 0.00 54.91 54.96 3g2g h ALA 460 Cb 0.35 -0.35 0.02 0.00 0.00 0.00 0.00 17.79 17.81 3g2g h ALA 460 CO -0.26 0.57 -0.95 0.00 0.00 0.00 0.00 179.25 178.60 3g2g h ARG 461 N 1.21 0.50 0.00 0.00 3.08 -0.93 -3.32 114.38 114.92 3g2g h ARG 461 Ca 0.35 -0.65 -0.03 0.00 0.07 0.00 0.00 59.98 59.72 3g2g h ARG 461 Cb -0.09 0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 3g2g h ARG 461 CO -0.09 1.27 -0.15 1.96 -1.07 0.00 0.00 179.97 181.89 3g2g h GLN 462 N 0.04 0.00 0.00 0.04 4.20 -1.02 -3.01 115.11 115.36 3g2g h GLN 462 Ca -0.14 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.57 3g2g h GLN 462 Cb 1.66 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.44 3g2g h GLN 462 CO 0.18 0.15 -0.01 0.00 -0.67 0.00 0.00 178.83 178.48 3g2g h ALA 463 N 1.85 1.08 -0.01 3.87 0.00 -1.47 -2.16 119.26 122.43 3g2g h ALA 463 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3g2g h ALA 463 Cb 0.68 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3g2g h ALA 463 CO 0.02 0.02 0.09 0.45 0.00 0.00 0.00 179.25 179.83 3g2g h HIS 464 N 0.00 0.00 0.00 0.00 3.86 -1.73 -2.42 115.15 114.86 3g2g h HIS 464 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3g2g h HIS 464 Cb 0.13 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.60 3g2g h HIS 464 CO 0.00 0.00 0.00 -0.07 0.86 0.00 0.00 177.93 178.72 3g2g h LEU 465 N 0.00 0.00 -9.12 2.43 3.38 -1.65 -3.40 115.31 106.95 3g2g h LEU 465 Ca 0.00 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.34 3g2g h LEU 465 Cb 0.18 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.77 3g2g h LEU 465 CO -0.00 0.00 -0.59 -0.31 0.09 0.00 0.00 178.44 177.63 3g2g s TYR 466 N -3.61 3.21 0.19 1.13 2.02 -0.91 -4.58 117.35 114.80 3g2g s TYR 466 Ca 0.01 0.05 -0.33 0.00 -0.37 0.00 0.00 57.07 56.43 3g2g s TYR 466 Cb 0.09 -1.98 -0.13 0.00 -0.40 0.00 0.00 41.96 39.54 3g2g s TYR 466 CO 0.43 0.23 1.56 -2.13 -1.57 0.00 0.00 175.55 174.07 3g2g n ARG 467 N 3.11 2.23 0.00 -0.62 3.00 -1.26 -2.65 116.66 120.47 3g2g n ARG 467 Ca -0.17 0.80 0.00 0.00 -0.00 0.00 0.00 57.85 58.48 3g2g n ARG 467 Cb 0.53 -2.56 0.00 0.00 0.00 0.00 0.00 32.46 30.43 3g2g n ARG 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3g2g n GLY 468 N 3.13 2.83 3.64 5.14 0.00 0.12 -4.79 105.19 115.27 3g2g n GLY 468 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 3g2g n GLY 468 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g2g s ILE 469 N -2.19 4.54 -0.50 -0.61 1.01 -1.08 0.59 121.20 122.96 3g2g s ILE 469 Ca 0.00 1.74 -0.09 0.00 0.00 0.00 0.00 60.65 62.30 3g2g s ILE 469 Cb 0.00 -4.39 0.13 0.00 0.01 0.00 0.00 42.46 38.21 3g2g s ILE 469 CO 0.00 -0.43 0.38 0.12 0.00 0.00 0.00 174.94 175.00 3g2g s PHE 470 N 3.56 3.44 0.23 3.97 5.36 0.24 -4.69 117.98 130.09 3g2g s PHE 470 Ca 0.45 -1.92 -0.29 0.00 -0.96 0.00 0.00 56.93 54.20 3g2g s PHE 470 Cb -0.13 -3.51 -0.09 0.00 -0.34 0.00 0.00 43.02 38.96 3g2g s PHE 470 CO 0.14 -0.99 0.91 -1.25 -1.46 0.00 0.00 175.22 172.57 3g2g s PRO 471 N 1.22 4.80 -0.03 10.12 0.04 -1.26 -1.83 135.00 148.05 3g2g s PRO 471 Ca 0.07 1.42 0.04 0.00 0.04 0.00 0.00 61.00 62.57 3g2g s PRO 471 Cb -0.25 -3.26 -0.00 0.00 0.04 0.00 0.00 34.50 31.03 3g2g s PRO 471 CO -0.01 0.52 -0.13 0.14 0.04 0.00 0.00 177.00 177.55 3g2g s VAL 472 N -1.19 1.12 -0.46 -0.36 -7.23 0.19 -4.53 120.40 107.95 3g2g s VAL 472 Ca 0.40 -0.56 -0.16 0.00 -1.81 0.00 0.00 61.98 59.86 3g2g s VAL 472 Cb -0.25 -0.97 0.06 0.00 0.56 0.00 0.00 36.38 35.78 3g2g s VAL 472 CO 0.31 0.33 0.40 -0.22 -0.31 0.00 0.00 175.10 175.61 3g2g s LEU 473 N 0.01 5.42 0.06 1.32 2.96 -1.26 -1.93 118.68 125.26 3g2g s LEU 473 Ca -0.01 -1.17 -0.30 0.00 -0.22 0.00 0.00 54.13 52.42 3g2g s LEU 473 Cb -0.09 -2.22 -0.05 0.00 0.50 0.00 0.00 46.19 44.34 3g2g s LEU 473 CO 0.01 -0.63 1.06 0.00 -1.32 0.00 0.00 176.35 175.46 3g2g n LYS 475 N 3.55 2.57 -2.34 0.00 5.02 -1.26 -4.46 118.16 121.24 3g2g n LYS 475 Ca 0.06 -1.41 -0.36 0.00 -2.02 0.00 0.00 58.31 54.58 3g2g n LYS 475 Cb 0.49 -1.01 -0.01 0.00 -0.02 0.00 0.00 35.03 34.47 3g2g n LYS 475 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3g2g s ASP 476 N -0.90 6.11 0.73 4.39 1.01 -1.26 -5.00 116.67 121.75 3g2g s ASP 476 Ca 0.01 2.17 -0.15 0.00 0.71 0.00 0.00 52.55 55.29 3g2g s ASP 476 Cb 0.00 -2.59 0.04 0.00 1.01 0.00 0.00 42.92 41.39 3g2g s ASP 476 CO 0.01 -0.95 1.19 -2.84 0.21 0.00 0.00 175.17 172.79 3g2g s PRO 477 N -2.96 2.17 -0.18 8.23 0.02 -1.26 -4.92 135.00 136.09 3g2g s PRO 477 Ca 0.67 1.70 -0.29 0.00 0.02 0.00 0.00 61.00 63.09 3g2g s PRO 477 Cb -0.24 -1.84 -0.03 0.00 0.02 0.00 0.00 34.50 32.41 3g2g s PRO 477 CO 0.29 -1.80 1.49 0.08 -0.33 0.00 0.00 177.00 176.74 3g2g s VAL 478 N -2.07 3.87 0.62 3.83 1.01 -1.26 -5.00 120.40 121.41 3g2g s VAL 478 Ca 0.73 1.02 -0.17 0.00 0.00 0.00 0.00 61.98 63.55 3g2g s VAL 478 Cb -0.28 -3.79 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 3g2g s VAL 478 CO 0.45 -0.24 1.17 -1.10 0.00 0.00 0.00 175.10 175.39 3g2g s GLN 479 N 4.19 2.85 0.02 2.72 -1.52 -1.26 -4.97 119.66 121.68 3g2g s GLN 479 Ca 0.66 1.68 -0.21 0.00 -1.95 0.00 0.00 55.36 55.53 3g2g s GLN 479 Cb -0.25 -1.93 -0.17 0.00 -0.22 0.00 0.00 33.01 30.44 3g2g s GLN 479 CO 0.25 -1.27 1.26 0.93 -0.25 0.00 0.00 175.29 176.21 3g2g h GLU 480 N 0.53 0.31 -6.13 2.91 5.08 -1.99 -3.43 114.58 111.87 3g2g h GLU 480 Ca -0.49 -0.20 -0.57 0.00 -1.00 0.00 0.00 59.36 57.10 3g2g h GLU 480 Cb 1.28 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.50 3g2g h GLU 480 CO 0.54 0.79 0.61 0.00 -1.00 0.00 0.00 179.01 179.95 3g2g s ALA 481 N -3.99 3.53 0.14 3.43 0.00 -1.26 -4.95 121.76 118.66 3g2g s ALA 481 Ca -0.14 0.24 -0.19 0.00 0.00 0.00 0.00 51.96 51.86 3g2g s ALA 481 Cb 0.04 -3.43 0.02 0.00 0.00 0.00 0.00 23.12 19.74 3g2g s ALA 481 CO 0.75 -0.77 1.69 2.35 0.00 0.00 0.00 175.76 179.78 3g2g h TRP 482 N 7.27 -0.19 -0.31 0.00 7.01 -2.00 -1.47 115.95 126.26 3g2g h TRP 482 Ca -0.26 0.03 0.02 0.00 2.11 0.00 0.00 58.89 60.78 3g2g h TRP 482 Cb 1.11 0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 28.28 3g2g h TRP 482 CO 0.73 -0.14 0.21 0.00 -2.79 0.00 0.00 178.44 176.45 3g2g h ALA 483 N 1.22 1.87 -0.18 2.65 0.00 -1.97 -0.85 119.26 122.01 3g2g h ALA 483 Ca 0.13 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 3g2g h ALA 483 Cb 0.22 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3g2g h ALA 483 CO -0.28 0.10 -0.61 0.93 0.00 0.00 0.00 179.25 179.38 3g2g h GLU 484 N 0.34 0.61 -0.24 0.00 4.39 -1.70 -1.84 114.58 116.14 3g2g h GLU 484 Ca 0.12 -0.42 -0.16 0.00 0.34 0.00 0.00 59.36 59.25 3g2g h GLU 484 Cb 0.07 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 3g2g h GLU 484 CO -0.03 1.04 -0.49 0.22 -1.16 0.00 0.00 179.01 178.59 3g2g h ASP 485 N 0.45 0.71 0.01 1.42 3.58 -0.54 -0.47 116.42 121.58 3g2g h ASP 485 Ca -0.01 -0.36 -0.00 0.00 0.42 0.00 0.00 57.03 57.09 3g2g h ASP 485 Cb 1.18 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 42.03 3g2g h ASP 485 CO 0.12 1.08 -0.00 0.58 -2.88 0.00 0.00 179.24 178.14 3g2g h VAL 486 N 0.52 1.05 -0.66 2.25 2.07 -1.19 -1.98 116.25 118.30 3g2g h VAL 486 Ca 0.02 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 3g2g h VAL 486 Cb 1.04 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 3g2g h VAL 486 CO 0.10 0.04 0.37 -0.78 0.02 0.00 0.00 177.57 177.32 3g2g h ASP 487 N -0.07 0.80 -0.45 0.57 1.82 -1.13 0.13 116.42 118.09 3g2g h ASP 487 Ca -0.00 -0.06 -0.04 0.00 -0.39 0.00 0.00 57.03 56.54 3g2g h ASP 487 Cb 0.07 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 39.86 3g2g h ASP 487 CO 0.00 0.64 0.11 0.25 -1.61 0.00 0.00 179.24 178.63 3g2g h LEU 488 N 0.91 0.68 -0.33 2.28 5.85 -1.01 -1.15 115.31 122.55 3g2g h LEU 488 Ca 0.23 -0.23 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 3g2g h LEU 488 Cb 0.01 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 3g2g h LEU 488 CO -0.04 0.74 -0.24 0.03 -0.34 0.00 0.00 178.44 178.59 3g2g h ARG 489 N 0.60 0.75 -0.42 1.25 3.08 -0.55 -1.82 114.38 117.26 3g2g h ARG 489 Ca 0.14 -0.36 0.01 0.00 0.07 0.00 0.00 59.98 59.84 3g2g h ARG 489 Cb 0.32 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 3g2g h ARG 489 CO 0.00 0.98 0.27 0.28 -1.07 0.00 0.00 179.97 180.43 3g2g h VAL 490 N 0.52 1.08 0.00 2.04 2.07 -0.73 -1.70 116.25 119.53 3g2g h VAL 490 Ca 0.06 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.36 3g2g h VAL 490 Cb 0.80 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3g2g h VAL 490 CO 0.06 0.10 -0.20 0.78 0.02 0.00 0.00 177.57 178.33 3g2g h ASN 491 N 0.55 0.00 -0.07 0.57 -0.26 -1.14 0.01 115.58 115.24 3g2g h ASN 491 Ca 0.16 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.90 3g2g h ASN 491 Cb -0.04 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.22 3g2g h ASN 491 CO -0.05 0.20 0.04 0.15 -1.06 0.00 0.00 177.43 176.71 3g2g h PHE 492 N 0.00 0.10 -0.77 1.19 3.57 -0.55 -0.95 116.94 119.53 3g2g h PHE 492 Ca -0.00 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.56 3g2g h PHE 492 Cb 0.41 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.06 3g2g h PHE 492 CO 0.00 0.14 0.46 0.00 -2.23 0.00 0.00 178.31 176.68 3g2g h ALA 493 N 0.95 1.04 -0.56 2.41 0.00 -0.32 -0.63 119.26 122.15 3g2g h ALA 493 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3g2g h ALA 493 Cb 0.07 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3g2g h ALA 493 CO -0.00 0.17 0.32 0.52 0.00 0.00 0.00 179.25 180.25 3g2g h MET 494 N 0.84 0.60 -0.33 0.00 2.86 -0.81 -0.67 114.93 117.42 3g2g h MET 494 Ca 0.34 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.92 3g2g h MET 494 Cb 0.18 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 3g2g h MET 494 CO -0.18 0.40 0.14 -0.91 1.06 0.00 0.00 176.91 177.42 3g2g h ASN 495 N 0.62 0.45 -0.16 1.22 2.35 -0.47 -1.33 115.58 118.27 3g2g h ASN 495 Ca 0.23 -0.16 0.03 0.00 -0.55 0.00 0.00 56.30 55.85 3g2g h ASN 495 Cb 0.08 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 3g2g h ASN 495 CO -0.13 0.49 -0.02 0.58 -1.65 0.00 0.00 177.43 176.71 3g2g h VAL 496 N 0.39 0.87 -0.91 2.81 2.07 -0.74 -1.19 116.25 119.54 3g2g h VAL 496 Ca 0.11 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.63 3g2g h VAL 496 Cb 0.18 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 3g2g h VAL 496 CO -0.01 0.01 0.59 1.23 0.02 0.00 0.00 177.57 179.41 3g2g h GLY 497 N 0.03 1.29 0.97 2.17 0.00 -0.98 -0.70 103.07 105.84 3g2g h GLY 497 Ca 0.08 -0.49 -0.06 0.00 0.00 0.00 0.00 47.33 46.86 3g2g h GLY 497 CO -0.14 0.48 0.07 0.50 0.00 0.00 0.00 176.54 177.45 3g2g h LYS 498 N 1.24 0.78 -0.18 4.80 1.57 -1.06 0.24 116.57 123.95 3g2g h LYS 498 Ca 0.33 -0.21 -0.06 0.00 -1.87 0.00 0.00 60.65 58.84 3g2g h LYS 498 Cb -0.12 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 3g2g h LYS 498 CO -0.07 0.80 -0.15 0.00 -0.57 0.00 0.00 179.45 179.46 3g2g h ALA 499 N 0.95 1.40 -0.02 3.86 0.00 -0.66 -2.64 119.26 122.16 3g2g h ALA 499 Ca 0.14 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3g2g h ALA 499 Cb 0.40 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3g2g h ALA 499 CO 0.01 0.41 -0.10 0.54 0.00 0.00 0.00 179.25 180.11 3g2g n ARG 500 N -4.23 1.63 -1.11 0.00 5.12 -0.32 -4.95 116.66 112.80 3g2g n ARG 500 Ca -0.00 -1.12 -0.02 0.00 -1.93 0.00 0.00 57.85 54.77 3g2g n ARG 500 Cb 0.30 -1.48 -0.01 0.00 -1.16 0.00 0.00 32.46 30.12 3g2g n ARG 500 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3g2g n GLY 501 N 1.27 0.52 0.16 -0.13 0.00 -0.80 -4.87 105.19 101.34 3g2g n GLY 501 Ca 0.15 -0.99 -0.09 0.00 0.00 0.00 0.00 46.02 45.10 3g2g n GLY 501 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3g2g h PHE 502 N 0.00 0.45 -3.07 1.61 0.04 -0.81 -3.42 116.94 111.75 3g2g h PHE 502 Ca -0.04 -0.22 -0.02 0.00 2.80 0.00 0.00 57.97 60.49 3g2g h PHE 502 Cb 0.18 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.25 3g2g h PHE 502 CO 0.06 0.98 0.24 -0.59 -0.60 0.00 0.00 178.31 178.40 3g2g s PHE 503 N -3.47 0.14 0.15 -0.55 -0.12 -1.21 -4.85 117.98 108.07 3g2g s PHE 503 Ca -0.05 -0.77 -0.05 0.00 -0.05 0.00 0.00 56.93 56.01 3g2g s PHE 503 Cb 0.10 0.77 -0.02 0.00 -0.63 0.00 0.00 43.02 43.24 3g2g s PHE 503 CO 0.83 -1.51 0.17 -1.59 -0.05 0.00 0.00 175.22 173.07 3g2g s LYS 504 N -2.53 1.04 0.21 1.99 -2.85 -1.26 -4.10 119.74 112.25 3g2g s LYS 504 Ca 0.16 -1.31 -0.30 0.00 -1.00 0.00 0.00 55.97 53.52 3g2g s LYS 504 Cb -0.05 0.31 -0.16 0.00 -2.06 0.00 0.00 37.83 35.87 3g2g s LYS 504 CO 0.11 -0.34 0.84 1.17 0.10 0.00 0.00 175.35 177.24 3g2g n LYS 505 N -0.15 0.68 0.00 1.78 4.81 -1.26 -0.81 118.16 123.20 3g2g n LYS 505 Ca -0.06 0.24 0.00 0.00 -0.87 0.00 0.00 58.31 57.62 3g2g n LYS 505 Cb 0.63 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 34.19 3g2g n LYS 505 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3g2g n GLY 506 N 1.69 2.90 3.47 3.14 0.00 -0.34 -4.95 105.19 111.09 3g2g n GLY 506 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 3g2g n GLY 506 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3g2g n ASP 507 N 0.28 -1.73 -4.34 1.61 8.00 0.01 -4.59 116.55 115.79 3g2g n ASP 507 Ca 0.00 -0.15 -0.32 0.00 0.71 0.00 0.00 54.79 55.03 3g2g n ASP 507 Cb 0.00 -1.25 -0.15 0.00 -0.02 0.00 0.00 41.12 39.69 3g2g n ASP 507 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3g2g s VAL 508 N -2.40 2.38 0.19 2.53 1.01 -1.26 -0.03 120.40 122.82 3g2g s VAL 508 Ca 0.68 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.74 3g2g s VAL 508 Cb -0.25 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.20 3g2g s VAL 508 CO 0.65 0.57 -0.05 0.68 0.00 0.00 0.00 175.10 176.96 3g2g s VAL 509 N -0.38 1.11 -0.11 2.92 -7.23 0.31 -1.88 120.40 115.14 3g2g s VAL 509 Ca 0.03 -2.05 -0.06 0.00 -1.81 0.00 0.00 61.98 58.10 3g2g s VAL 509 Cb -0.12 -2.12 -0.04 0.00 0.56 0.00 0.00 36.38 34.66 3g2g s VAL 509 CO 0.02 -0.51 0.10 -0.63 -0.31 0.00 0.00 175.10 173.77 3g2g s ILE 510 N -3.37 5.19 -0.10 -0.62 -1.09 -0.68 -0.80 121.20 119.73 3g2g s ILE 510 Ca 0.23 0.08 0.02 0.00 -2.23 0.00 0.00 60.65 58.75 3g2g s ILE 510 Cb 0.04 -3.24 0.01 0.00 -1.58 0.00 0.00 42.46 37.69 3g2g s ILE 510 CO 0.05 0.61 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.54 3g2g s VAL 511 N -0.99 1.40 -0.26 2.92 1.01 0.18 -0.14 120.40 124.51 3g2g s VAL 511 Ca 0.15 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.51 3g2g s VAL 511 Cb -0.12 -1.28 0.02 0.00 0.00 0.00 0.00 36.38 35.00 3g2g s VAL 511 CO 0.04 0.42 -0.02 -0.76 0.00 0.00 0.00 175.10 174.78 3g2g s LEU 512 N 0.96 3.39 0.07 3.92 1.43 0.12 0.03 118.68 128.59 3g2g s LEU 512 Ca -0.08 -0.83 0.20 0.00 -1.03 0.00 0.00 54.13 52.39 3g2g s LEU 512 Cb -0.15 -1.73 -0.13 0.00 0.03 0.00 0.00 46.19 44.21 3g2g s LEU 512 CO -0.01 -0.15 0.78 0.35 0.23 0.00 0.00 176.35 177.56 3g2g n THR 513 N 4.72 0.83 -0.26 5.49 -2.24 -0.98 -1.47 114.28 120.38 3g2g n THR 513 Ca -0.16 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 3g2g n THR 513 Cb 0.47 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 3g2g n THR 513 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g2g n GLY 514 N 1.33 0.71 3.22 3.38 0.00 -1.26 -4.62 105.19 107.95 3g2g n GLY 514 Ca -0.07 -0.67 -0.35 0.00 0.00 0.00 0.00 46.02 44.92 3g2g n GLY 514 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3g2g s ASN 523 N -2.05 4.75 -0.03 1.61 3.04 -1.26 -5.13 114.94 115.87 3g2g s ASN 523 Ca 0.00 -1.02 0.05 0.00 0.04 0.00 0.00 52.86 51.93 3g2g s ASN 523 Cb 0.00 -1.73 -0.01 0.00 -1.54 0.00 0.00 41.25 37.97 3g2g s ASN 523 CO 0.00 -0.21 -0.19 -0.89 -3.04 0.00 0.00 177.10 172.77 3g2g s THR 524 N 1.33 1.57 -0.10 -5.21 2.01 -1.26 -5.05 115.64 108.93 3g2g s THR 524 Ca -0.02 -0.82 0.03 0.00 0.31 0.00 0.00 61.69 61.19 3g2g s THR 524 Cb -0.18 -1.33 0.01 0.00 0.01 0.00 0.00 72.50 71.01 3g2g s THR 524 CO -0.01 0.45 -0.18 -0.32 -0.69 0.00 0.00 174.62 173.87 3g2g s MET 525 N -0.19 2.39 -0.02 4.92 1.75 -1.26 -2.32 119.30 124.58 3g2g s MET 525 Ca 0.01 -0.64 0.07 0.00 -1.25 0.00 0.00 55.69 53.88 3g2g s MET 525 Cb -0.10 -1.93 -0.02 0.00 2.84 0.00 0.00 34.83 35.62 3g2g s MET 525 CO 0.01 0.03 -0.23 1.03 -0.65 0.00 0.00 175.02 175.22 3g2g s ARG 526 N 0.71 2.16 -0.27 4.11 3.00 0.10 -4.95 118.95 123.82 3g2g s ARG 526 Ca -0.12 -0.90 -0.09 0.00 0.00 0.00 0.00 55.73 54.62 3g2g s ARG 526 Cb -0.16 -2.12 -0.04 0.00 0.00 0.00 0.00 34.95 32.63 3g2g s ARG 526 CO 0.03 0.57 0.14 0.08 0.00 0.00 0.00 175.30 176.11 3g2g s VAL 527 N -0.68 4.82 -0.02 3.52 1.01 -1.26 0.48 120.40 128.27 3g2g s VAL 527 Ca 0.11 -0.05 0.02 0.00 0.00 0.00 0.00 61.98 62.06 3g2g s VAL 527 Cb -0.10 -3.30 0.01 0.00 0.00 0.00 0.00 36.38 32.98 3g2g s VAL 527 CO 0.00 0.26 -0.06 -0.69 0.00 0.00 0.00 175.10 174.61 3g2g s VAL 528 N 1.68 0.58 0.30 2.92 1.01 0.02 -4.97 120.40 121.94 3g2g s VAL 528 Ca 0.06 -0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.51 3g2g s VAL 528 Cb -0.16 -0.53 -0.10 0.00 0.00 0.00 0.00 36.38 35.60 3g2g s VAL 528 CO 0.07 0.19 1.13 -2.84 0.00 0.00 0.00 175.10 173.66 3g2g s PRO 529 N 0.25 4.53 -0.10 2.72 0.02 -1.26 -0.53 135.00 140.63 3g2g s PRO 529 Ca -0.03 1.85 -0.29 0.00 0.02 0.00 0.00 61.00 62.54 3g2g s PRO 529 Cb -0.08 -3.09 -0.04 0.00 0.02 0.00 0.00 34.50 31.31 3g2g s PRO 529 CO 0.00 0.09 1.56 0.08 -0.33 0.00 0.00 177.00 178.40 3g2g s VAL 530 N -1.21 3.76 -2.00 3.83 1.01 0.95 -4.89 120.40 121.86 3g2g s VAL 530 Ca 0.47 0.92 0.15 0.00 0.00 0.00 0.00 61.98 63.51 3g2g s VAL 530 Cb -0.32 -3.62 0.43 0.00 0.00 0.00 0.00 36.38 32.87 3g2g s VAL 530 CO 0.42 -0.11 1.31 -0.81 0.00 0.00 0.00 175.10 175.91