#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g0g s THR 42 N 0.00 3.26 -0.40 0.58 -4.23 -1.26 -0.66 115.64 112.93 3g0g s THR 42 Ca 0.00 -1.08 -0.29 0.00 -1.18 0.00 0.00 61.69 59.14 3g0g s THR 42 Cb 0.00 -3.12 0.02 0.00 1.34 0.00 0.00 72.50 70.75 3g0g s THR 42 CO 0.00 -0.05 1.09 -0.47 -0.54 0.00 0.00 174.62 174.65 3g0g s TYR 43 N -2.32 2.99 0.62 3.99 5.04 -1.26 -4.89 117.35 121.52 3g0g s TYR 43 Ca 0.50 0.94 0.00 0.00 -2.44 0.00 0.00 57.07 56.08 3g0g s TYR 43 Cb -0.09 -4.03 0.07 0.00 0.35 0.00 0.00 41.96 38.27 3g0g s TYR 43 CO 0.31 -1.00 0.87 0.95 -1.34 0.00 0.00 175.55 175.34 3g0g s THR 44 N 4.01 2.43 0.13 4.34 -4.23 -1.26 -3.83 115.64 117.22 3g0g s THR 44 Ca 0.46 -0.62 -0.16 0.00 -1.18 0.00 0.00 61.69 60.18 3g0g s THR 44 Cb -0.10 -2.80 -0.01 0.00 1.34 0.00 0.00 72.50 70.92 3g0g s THR 44 CO 0.23 0.00 1.67 0.25 -0.54 0.00 0.00 174.62 176.23 3g0g h LEU 45 N -0.19 0.53 -0.96 4.79 5.85 -1.95 -2.48 115.31 120.90 3g0g h LEU 45 Ca -0.40 -0.18 0.11 0.00 0.84 0.00 0.00 57.88 58.25 3g0g h LEU 45 Cb 1.29 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 42.10 3g0g h LEU 45 CO 0.48 0.57 0.59 0.74 -0.34 0.00 0.00 178.44 180.47 3g0g h THR 46 N 0.47 0.94 -0.43 1.05 2.02 -1.98 0.38 112.91 115.35 3g0g h THR 46 Ca 0.13 -0.33 0.09 0.00 0.77 0.00 0.00 66.41 67.06 3g0g h THR 46 Cb 0.21 -0.11 -0.08 0.00 -1.74 0.00 0.00 68.15 66.42 3g0g h THR 46 CO -0.01 0.18 -0.10 0.44 0.37 0.00 0.00 175.52 176.40 3g0g h ASP 47 N 0.97 -0.38 -0.41 4.18 3.32 -1.83 0.11 116.42 122.38 3g0g h ASP 47 Ca 0.46 0.13 -0.15 0.00 0.02 0.00 0.00 57.03 57.49 3g0g h ASP 47 Cb 0.41 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 3g0g h ASP 47 CO -0.25 -0.13 -0.34 0.22 -1.72 0.00 0.00 179.24 177.02 3g0g h TYR 48 N 0.01 1.14 -0.11 4.55 3.20 -0.97 -2.07 116.97 122.72 3g0g h TYR 48 Ca 0.21 -0.32 -0.23 0.00 3.14 0.00 0.00 58.73 61.52 3g0g h TYR 48 Cb 0.32 -0.25 0.01 0.00 1.54 0.00 0.00 36.73 38.35 3g0g h TYR 48 CO -0.37 1.16 -0.84 -0.07 -1.64 0.00 0.00 178.16 176.40 3g0g h LEU 49 N 0.80 0.90 -3.01 2.82 3.38 -0.40 -3.25 115.31 116.56 3g0g h LEU 49 Ca 0.08 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 57.42 3g0g h LEU 49 Cb 0.93 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3g0g h LEU 49 CO 0.09 1.42 0.00 0.29 0.09 0.00 0.00 178.44 180.33 3g0g n LYS 50 N -3.91 3.33 -3.99 1.13 4.01 0.35 -4.98 118.16 114.09 3g0g n LYS 50 Ca -0.08 -2.74 -0.41 0.00 -0.51 0.00 0.00 58.31 54.56 3g0g n LYS 50 Cb 0.78 -1.73 0.02 0.00 -0.51 0.00 0.00 35.03 33.58 3g0g n LYS 50 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 3g0g n ASN 51 N 1.15 -3.95 0.03 4.39 4.05 -0.92 -4.89 115.26 115.12 3g0g n ASN 51 Ca 0.24 -1.22 -0.03 0.00 0.45 0.00 0.00 54.58 54.02 3g0g n ASN 51 Cb 0.77 -2.15 0.21 0.00 1.23 0.00 0.00 39.78 39.84 3g0g n ASN 51 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 3g0g h THR 52 N -2.38 1.27 -3.61 -0.44 2.02 -1.67 -3.39 112.91 104.71 3g0g h THR 52 Ca -0.70 -1.29 -0.69 0.00 0.77 0.00 0.00 66.41 64.50 3g0g h THR 52 Cb 1.39 1.40 -0.32 0.00 -1.74 0.00 0.00 68.15 68.88 3g0g h THR 52 CO 0.53 0.40 -0.60 -0.31 0.37 0.00 0.00 175.52 175.91 3g0g s TYR 53 N -4.45 3.39 -0.23 3.16 2.02 -1.26 -5.09 117.35 114.90 3g0g s TYR 53 Ca -0.06 -1.93 -0.11 0.00 -0.37 0.00 0.00 57.07 54.59 3g0g s TYR 53 Cb 0.14 -2.64 -0.05 0.00 -0.40 0.00 0.00 41.96 39.01 3g0g s TYR 53 CO 0.79 -0.85 0.19 0.50 -1.57 0.00 0.00 175.55 174.60 3g0g s ARG 54 N 1.26 4.11 -0.25 -0.62 3.52 -1.26 -5.05 118.95 120.66 3g0g s ARG 54 Ca 0.01 -0.18 -0.29 0.00 -0.13 0.00 0.00 55.73 55.14 3g0g s ARG 54 Cb -0.21 -3.52 0.01 0.00 -1.56 0.00 0.00 34.95 29.67 3g0g s ARG 54 CO -0.01 0.09 1.12 -0.51 -0.81 0.00 0.00 175.30 175.18 3g0g s LEU 55 N 0.96 4.04 0.08 -0.88 1.43 -1.26 -4.69 118.68 118.36 3g0g s LEU 55 Ca 0.10 1.31 -0.22 0.00 -1.03 0.00 0.00 54.13 54.28 3g0g s LEU 55 Cb -0.13 -3.54 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 3g0g s LEU 55 CO 0.04 -0.80 0.67 -0.75 0.23 0.00 0.00 176.35 175.74 3g0g s LYS 56 N 3.51 4.38 0.14 1.70 2.20 -1.26 -5.09 119.74 125.33 3g0g s LYS 56 Ca 0.48 0.91 0.01 0.00 -0.36 0.00 0.00 55.97 57.01 3g0g s LYS 56 Cb -0.16 -3.29 0.01 0.00 -1.51 0.00 0.00 37.83 32.89 3g0g s LYS 56 CO 0.13 0.50 0.11 1.28 -0.36 0.00 0.00 175.35 177.00 3g0g n LEU 57 N 2.11 0.00 -3.25 5.43 4.32 -1.26 -4.90 117.00 119.45 3g0g n LEU 57 Ca -0.07 -0.71 -0.20 0.00 -0.02 0.00 0.00 56.01 55.02 3g0g n LEU 57 Cb 0.50 -0.02 -0.07 0.00 -1.62 0.00 0.00 43.42 42.21 3g0g n LEU 57 CO 0.44 -0.35 -0.18 -0.47 -1.22 0.00 0.00 177.39 175.61 3g0g s TYR 58 N -0.62 0.13 -0.07 -1.77 6.14 -1.26 -4.93 117.35 114.97 3g0g s TYR 58 Ca 0.08 -1.54 -0.28 0.00 0.64 0.00 0.00 57.07 55.97 3g0g s TYR 58 Cb -0.01 -0.52 -0.02 0.00 0.42 0.00 0.00 41.96 41.83 3g0g s TYR 58 CO 0.05 -0.96 0.91 0.45 0.64 0.00 0.00 175.55 176.64 3g0g s SER 59 N 0.62 7.18 0.07 4.32 0.15 -1.26 -5.05 113.70 119.73 3g0g s SER 59 Ca 0.28 1.44 0.03 0.00 0.70 0.00 0.00 55.95 58.40 3g0g s SER 59 Cb -0.03 -2.51 -0.03 0.00 -1.71 0.00 0.00 66.02 61.73 3g0g s SER 59 CO -0.11 -0.31 -0.10 -1.48 1.20 0.00 0.00 173.24 172.44 3g0g s LEU 60 N 1.47 2.32 -0.22 3.45 0.05 -1.26 -4.57 118.68 119.91 3g0g s LEU 60 Ca 0.46 -0.67 0.01 0.00 0.05 0.00 0.00 54.13 53.98 3g0g s LEU 60 Cb -0.19 -0.27 0.05 0.00 -2.05 0.00 0.00 46.19 43.73 3g0g s LEU 60 CO 0.20 -0.21 -0.10 -0.13 -0.55 0.00 0.00 176.35 175.56 3g0g s ARG 61 N -2.10 2.10 0.08 1.48 0.52 -1.11 -4.97 118.95 114.95 3g0g s ARG 61 Ca -0.03 -1.01 -0.31 0.00 -0.52 0.00 0.00 55.73 53.86 3g0g s ARG 61 Cb -0.07 -2.60 -0.09 0.00 0.52 0.00 0.00 34.95 32.71 3g0g s ARG 61 CO 0.00 -0.48 1.75 -1.58 0.02 0.00 0.00 175.30 175.01 3g0g s TRP 62 N 1.30 2.17 -0.17 -0.53 0.52 -1.26 -1.48 118.94 119.49 3g0g s TRP 62 Ca -0.04 0.10 0.00 0.00 0.02 0.00 0.00 56.10 56.19 3g0g s TRP 62 Cb -0.18 -4.07 -0.22 0.00 -1.15 0.00 0.00 33.47 27.85 3g0g s TRP 62 CO -0.07 -4.41 0.16 -0.89 0.02 0.00 0.00 176.95 171.76 3g0g n ILE 63 N 4.87 1.63 -1.49 2.03 -0.00 0.30 -4.90 119.36 121.81 3g0g n ILE 63 Ca 0.17 -0.66 0.00 0.00 -0.00 0.00 0.00 62.75 62.26 3g0g n ILE 63 Cb 0.40 -1.45 0.00 0.00 -0.00 0.00 0.00 39.64 38.59 3g0g n ILE 63 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 3g0g n SER 64 N -3.30 0.00 -0.97 4.38 3.41 -1.10 -5.00 113.62 111.04 3g0g n SER 64 Ca -0.36 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.37 3g0g n SER 64 Cb 1.04 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 65.10 3g0g n SER 64 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3g0g n ASP 65 N 0.00 3.03 -0.10 4.04 4.64 -1.26 -2.81 116.55 124.08 3g0g n ASP 65 Ca 0.00 -1.99 0.00 0.00 -1.38 0.00 0.00 54.79 51.42 3g0g n ASP 65 Cb 0.00 -0.03 0.00 0.00 -1.04 0.00 0.00 41.12 40.05 3g0g n ASP 65 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3g0g n HIS 66 N 1.35 0.00 -4.02 -0.67 1.44 -1.26 -4.49 115.22 107.57 3g0g n HIS 66 Ca 0.14 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.74 3g0g n HIS 66 Cb 0.59 0.06 -0.12 0.00 0.12 0.00 0.00 29.99 30.64 3g0g n HIS 66 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3g0g s GLU 67 N 0.00 0.35 0.06 -1.40 2.02 -1.26 -0.31 118.70 118.16 3g0g s GLU 67 Ca 0.00 -0.49 -0.09 0.00 0.02 0.00 0.00 54.97 54.41 3g0g s GLU 67 Cb 0.00 -0.12 0.00 0.00 0.10 0.00 0.00 34.13 34.11 3g0g s GLU 67 CO 0.00 0.02 0.19 1.52 0.02 0.00 0.00 175.26 177.01 3g0g s TYR 68 N -0.98 0.10 0.06 1.61 -0.85 -0.88 -0.54 117.35 115.88 3g0g s TYR 68 Ca -0.09 -0.41 -0.01 0.00 -0.52 0.00 0.00 57.07 56.05 3g0g s TYR 68 Cb -0.07 -0.05 -0.04 0.00 0.38 0.00 0.00 41.96 42.18 3g0g s TYR 68 CO -0.00 -0.47 0.23 -0.51 -1.52 0.00 0.00 175.55 173.27 3g0g s LEU 69 N -2.40 4.35 -0.09 -3.49 1.43 -0.55 -0.38 118.68 117.54 3g0g s LEU 69 Ca -0.01 0.32 -0.04 0.00 -1.03 0.00 0.00 54.13 53.37 3g0g s LEU 69 Cb 0.01 -2.96 0.05 0.00 0.03 0.00 0.00 46.19 43.32 3g0g s LEU 69 CO -0.07 0.17 0.19 -0.47 0.23 0.00 0.00 176.35 176.40 3g0g s TYR 70 N -1.51 -0.26 0.45 0.29 5.04 -0.56 -2.74 117.35 118.07 3g0g s TYR 70 Ca 0.35 0.70 -0.23 0.00 -2.44 0.00 0.00 57.07 55.45 3g0g s TYR 70 Cb -0.13 -0.13 -0.07 0.00 0.35 0.00 0.00 41.96 41.97 3g0g s TYR 70 CO 0.27 -0.27 1.18 0.21 -1.34 0.00 0.00 175.55 175.60 3g0g s LYS 71 N 1.99 3.78 0.00 4.97 2.20 -1.26 -1.81 119.74 129.61 3g0g s LYS 71 Ca -0.01 1.82 0.00 0.00 -0.36 0.00 0.00 55.97 57.42 3g0g s LYS 71 Cb -0.12 -2.45 0.00 0.00 -1.51 0.00 0.00 37.83 33.75 3g0g s LYS 71 CO -0.07 -0.54 0.00 1.04 -0.36 0.00 0.00 175.35 175.42 3g0g n GLN 72 N -0.40 0.00 -1.15 4.03 6.02 -1.26 -4.93 117.38 119.69 3g0g n GLN 72 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 3g0g n GLN 72 Cb 0.47 -0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.73 3g0g n GLN 72 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3g0g n ASN 75 N -2.34 -6.22 -3.84 1.08 4.13 -1.26 -4.97 115.26 101.84 3g0g n ASN 75 Ca 0.00 1.28 -0.25 0.00 1.68 0.00 0.00 54.58 57.29 3g0g n ASN 75 Cb 0.00 -3.39 -0.17 0.00 -1.54 0.00 0.00 39.78 34.68 3g0g n ASN 75 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3g0g s ILE 76 N -4.67 0.73 0.11 2.41 1.01 -1.05 -4.91 121.20 114.83 3g0g s ILE 76 Ca 0.00 -0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.52 3g0g s ILE 76 Cb 0.00 -0.86 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 3g0g s ILE 76 CO 0.00 0.26 0.10 -0.76 0.00 0.00 0.00 174.94 174.55 3g0g s LEU 77 N 1.82 3.80 -0.12 2.97 2.01 -0.75 0.10 118.68 128.50 3g0g s LEU 77 Ca 0.04 -0.06 -0.09 0.00 0.01 0.00 0.00 54.13 54.03 3g0g s LEU 77 Cb -0.13 -2.45 -0.05 0.00 0.01 0.00 0.00 46.19 43.57 3g0g s LEU 77 CO -0.07 0.13 0.19 -0.69 1.01 0.00 0.00 176.35 176.93 3g0g s VAL 78 N -1.53 5.40 0.01 -1.59 1.01 -0.60 -1.50 120.40 121.61 3g0g s VAL 78 Ca 0.30 0.34 0.07 0.00 0.00 0.00 0.00 61.98 62.68 3g0g s VAL 78 Cb -0.11 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 3g0g s VAL 78 CO 0.22 0.56 -0.20 -0.36 0.00 0.00 0.00 175.10 175.32 3g0g s PHE 79 N -0.61 2.52 -0.17 5.22 0.40 0.49 -2.60 117.98 123.23 3g0g s PHE 79 Ca 0.15 -0.29 -0.19 0.00 -0.60 0.00 0.00 56.93 56.00 3g0g s PHE 79 Cb -0.13 -1.49 -0.03 0.00 0.51 0.00 0.00 43.02 41.88 3g0g s PHE 79 CO 0.04 0.17 0.55 1.21 0.70 0.00 0.00 175.22 177.89 3g0g s ASN 80 N -1.12 6.65 0.37 1.36 3.04 -0.84 -2.06 114.94 122.33 3g0g s ASN 80 Ca 0.13 0.78 0.07 0.00 0.04 0.00 0.00 52.86 53.89 3g0g s ASN 80 Cb -0.10 -2.31 0.72 0.00 -1.54 0.00 0.00 41.25 38.01 3g0g s ASN 80 CO 0.03 -0.15 1.91 0.00 -3.04 0.00 0.00 177.10 175.84 3g0g h ALA 81 N 7.24 1.47 0.44 1.71 0.00 -1.02 -1.00 119.26 128.10 3g0g h ALA 81 Ca -0.35 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 3g0g h ALA 81 Cb 1.16 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3g0g h ALA 81 CO 0.75 0.38 -0.21 0.93 0.00 0.00 0.00 179.25 181.10 3g0g h GLU 82 N 0.34 -0.57 0.00 0.00 4.39 -1.94 -3.39 114.58 113.42 3g0g h GLU 82 Ca 0.07 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.81 3g0g h GLU 82 Cb 0.34 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 3g0g h GLU 82 CO 0.02 -0.38 -1.76 0.66 -1.16 0.00 0.00 179.01 176.39 3g0g n TYR 83 N -3.77 0.11 -1.00 4.33 4.01 -1.23 -4.98 117.16 114.64 3g0g n TYR 83 Ca -0.07 0.03 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 3g0g n TYR 83 Cb 0.23 -0.50 0.00 0.00 -0.31 0.00 0.00 39.34 38.76 3g0g n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3g0g n GLY 84 N 1.28 0.83 3.79 2.72 0.00 -0.38 -5.03 105.19 108.40 3g0g n GLY 84 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 3g0g n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g0g s ASN 85 N -2.66 6.31 -0.02 1.61 4.22 -1.26 -4.78 114.94 118.36 3g0g s ASN 85 Ca 0.00 1.98 0.01 0.00 -2.14 0.00 0.00 52.86 52.71 3g0g s ASN 85 Cb 0.00 -2.57 0.02 0.00 1.28 0.00 0.00 41.25 39.98 3g0g s ASN 85 CO 0.00 -0.80 -0.02 -0.94 -2.04 0.00 0.00 177.10 173.30 3g0g s SER 86 N -1.89 0.49 -0.04 3.54 1.04 -1.26 -1.99 113.70 113.59 3g0g s SER 86 Ca 0.67 -0.06 0.03 0.00 0.48 0.00 0.00 55.95 57.08 3g0g s SER 86 Cb -0.18 -0.20 -0.03 0.00 0.10 0.00 0.00 66.02 65.71 3g0g s SER 86 CO 0.22 -0.04 -0.13 -0.94 0.98 0.00 0.00 173.24 173.32 3g0g s SER 87 N 0.62 4.11 0.25 7.02 1.04 -1.07 -4.95 113.70 120.73 3g0g s SER 87 Ca -0.07 -0.18 -0.30 0.00 0.48 0.00 0.00 55.95 55.88 3g0g s SER 87 Cb -0.10 -0.88 -0.10 0.00 0.10 0.00 0.00 66.02 65.04 3g0g s SER 87 CO -0.01 0.34 1.49 -0.69 0.98 0.00 0.00 173.24 175.35 3g0g s VAL 88 N -0.76 2.50 -0.18 5.02 1.01 -1.26 -1.55 120.40 125.17 3g0g s VAL 88 Ca 0.12 0.41 -0.16 0.00 0.00 0.00 0.00 61.98 62.35 3g0g s VAL 88 Cb -0.11 -3.26 -0.21 0.00 0.00 0.00 0.00 36.38 32.80 3g0g s VAL 88 CO 0.01 0.06 0.26 0.33 0.00 0.00 0.00 175.10 175.76 3g0g n PHE 89 N 2.45 1.09 -3.78 5.22 -0.00 0.11 -4.84 117.46 117.72 3g0g n PHE 89 Ca 0.08 0.37 -0.13 0.00 -0.00 0.00 0.00 57.45 57.77 3g0g n PHE 89 Cb 0.39 -1.12 -0.10 0.00 -0.00 0.00 0.00 39.48 38.66 3g0g n PHE 89 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3g0g s LEU 90 N -7.58 0.93 0.65 -2.13 1.02 -1.19 -5.04 118.68 105.34 3g0g s LEU 90 Ca -0.27 0.22 -0.15 0.00 0.02 0.00 0.00 54.13 53.95 3g0g s LEU 90 Cb 0.06 1.13 -0.01 0.00 0.02 0.00 0.00 46.19 47.39 3g0g s LEU 90 CO 0.65 -0.33 1.10 -1.61 0.02 0.00 0.00 176.35 176.18 3g0g s GLU 91 N -0.87 2.92 0.23 1.70 8.01 -1.26 -2.52 118.70 126.91 3g0g s GLU 91 Ca -0.09 1.33 -0.13 0.00 0.01 0.00 0.00 54.97 56.09 3g0g s GLU 91 Cb -0.05 -1.97 0.29 0.00 -4.31 0.00 0.00 34.13 28.09 3g0g s GLU 91 CO 0.03 -1.15 1.60 -2.95 0.01 0.00 0.00 175.26 172.80 3g0g h ASN 92 N 0.09 -0.74 -2.21 -0.19 7.08 -1.93 -3.07 115.58 114.61 3g0g h ASN 92 Ca -0.47 0.23 -0.57 0.00 -3.08 0.00 0.00 56.30 52.40 3g0g h ASN 92 Cb 1.24 0.48 -0.42 0.00 -2.08 0.00 0.00 38.32 37.54 3g0g h ASN 92 CO 0.55 -0.25 -0.74 -1.54 -2.08 0.00 0.00 177.43 173.37 3g0g n SER 93 N -5.49 3.59 0.07 6.14 3.41 -1.26 -4.64 113.62 115.44 3g0g n SER 93 Ca 0.10 -3.49 -0.10 0.00 -0.26 0.00 0.00 58.87 55.12 3g0g n SER 93 Cb 0.38 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 3g0g n SER 93 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3g0g h THR 94 N 2.68 1.44 -1.55 6.66 2.02 -1.92 -3.25 112.91 118.98 3g0g h THR 94 Ca 0.14 -2.41 -0.71 0.00 0.77 0.00 0.00 66.41 64.20 3g0g h THR 94 Cb 0.62 2.33 -0.27 0.00 -1.74 0.00 0.00 68.15 69.10 3g0g h THR 94 CO 0.76 0.71 0.94 0.49 0.37 0.00 0.00 175.52 178.79 3g0g n PHE 95 N -3.74 2.92 -0.03 3.16 3.72 -1.26 -4.62 117.46 117.61 3g0g n PHE 95 Ca -0.04 -2.52 -0.03 0.00 -0.05 0.00 0.00 57.45 54.80 3g0g n PHE 95 Cb 0.77 -1.29 0.21 0.00 -0.94 0.00 0.00 39.48 38.23 3g0g n PHE 95 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 3g0g h ASP 96 N 2.61 0.58 -0.44 4.37 -0.00 -1.94 -2.57 116.42 119.03 3g0g h ASP 96 Ca 0.56 -0.16 0.00 0.00 -0.00 0.00 0.00 57.03 57.43 3g0g h ASP 96 Cb 0.36 -0.16 0.00 0.00 -0.00 0.00 0.00 39.33 39.54 3g0g h ASP 96 CO 1.43 0.73 0.00 -0.62 -0.00 0.00 0.00 179.24 180.79 3g0g n GLU 97 N -4.18 3.13 -0.04 0.28 1.02 -1.26 -4.36 120.64 115.23 3g0g n GLU 97 Ca 0.01 -2.04 -0.13 0.00 -0.02 0.00 0.00 57.16 54.98 3g0g n GLU 97 Cb 0.34 -1.80 -0.08 0.00 -0.02 0.00 0.00 31.44 29.89 3g0g n GLU 97 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 3g0g h PHE 98 N 2.83 0.26 0.00 -0.32 -0.00 -1.81 -3.47 116.94 114.42 3g0g h PHE 98 Ca 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 57.97 57.90 3g0g h PHE 98 Cb 1.21 -0.06 0.00 0.00 -0.00 0.00 0.00 35.95 37.11 3g0g h PHE 98 CO 0.60 0.60 0.00 0.41 -0.00 0.00 0.00 178.31 179.93 3g0g n GLY 99 N 0.10 2.90 3.69 2.40 0.00 -1.26 -5.03 105.19 107.99 3g0g n GLY 99 Ca -0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 3g0g n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3g0g s HIS 100 N -2.29 3.01 -0.40 1.61 3.76 -1.26 -5.08 115.29 114.64 3g0g s HIS 100 Ca 0.00 -0.01 -0.29 0.00 -0.15 0.00 0.00 55.06 54.61 3g0g s HIS 100 Cb 0.00 -1.56 0.02 0.00 1.11 0.00 0.00 32.58 32.15 3g0g s HIS 100 CO 0.00 0.48 1.12 0.45 -0.85 0.00 0.00 174.74 175.94 3g0g s SER 101 N -2.22 6.76 -0.29 1.40 0.15 -1.26 -4.99 113.70 113.25 3g0g s SER 101 Ca 0.25 0.75 -0.29 0.00 0.70 0.00 0.00 55.95 57.36 3g0g s SER 101 Cb -0.12 -2.55 -0.00 0.00 -1.71 0.00 0.00 66.02 61.65 3g0g s SER 101 CO 0.18 -1.09 1.31 -0.63 1.20 0.00 0.00 173.24 174.20 3g0g s ILE 102 N 4.13 4.13 -0.15 6.45 1.09 -1.26 -4.48 121.20 131.11 3g0g s ILE 102 Ca 0.47 1.28 -0.25 0.00 -1.10 0.00 0.00 60.65 61.05 3g0g s ILE 102 Cb -0.10 -4.13 -0.25 0.00 -1.06 0.00 0.00 42.46 36.93 3g0g s ILE 102 CO 0.25 -0.45 0.60 -1.13 -0.10 0.00 0.00 174.94 174.11 3g0g h ASN 103 N 9.30 0.08 -4.74 3.58 -1.24 -0.86 -3.49 115.58 118.21 3g0g h ASN 103 Ca -0.26 -0.84 -0.11 0.00 0.71 0.00 0.00 56.30 55.79 3g0g h ASN 103 Cb 1.10 -0.03 -0.21 0.00 0.73 0.00 0.00 38.32 39.92 3g0g h ASN 103 CO 1.03 1.23 -0.19 -0.62 -1.29 0.00 0.00 177.43 177.59 3g0g s ASP 104 N -6.55 -0.32 0.17 1.15 -1.08 -1.13 -5.01 116.67 103.90 3g0g s ASP 104 Ca -0.21 0.36 0.07 0.00 -0.52 0.00 0.00 52.55 52.24 3g0g s ASP 104 Cb 0.01 0.47 -0.04 0.00 -1.46 0.00 0.00 42.92 41.90 3g0g s ASP 104 CO 0.68 -0.40 0.03 -0.72 0.52 0.00 0.00 175.17 175.28 3g0g s TYR 105 N -0.95 2.92 -0.21 -5.34 1.13 -1.26 -0.53 117.35 113.10 3g0g s TYR 105 Ca -0.10 -0.11 -0.04 0.00 -1.41 0.00 0.00 57.07 55.42 3g0g s TYR 105 Cb -0.04 -1.41 0.11 0.00 -1.10 0.00 0.00 41.96 39.52 3g0g s TYR 105 CO 0.04 0.52 0.30 0.45 -2.51 0.00 0.00 175.55 174.35 3g0g s SER 106 N -2.95 0.72 0.18 -0.18 0.15 0.95 -4.97 113.70 107.60 3g0g s SER 106 Ca 0.28 0.09 -0.23 0.00 0.70 0.00 0.00 55.95 56.79 3g0g s SER 106 Cb -0.10 0.77 -0.08 0.00 -1.71 0.00 0.00 66.02 64.91 3g0g s SER 106 CO 0.20 -0.30 0.75 -0.63 1.20 0.00 0.00 173.24 174.46 3g0g s ILE 107 N 2.44 4.45 0.57 6.45 -1.09 -1.26 0.77 121.20 133.52 3g0g s ILE 107 Ca 0.09 1.55 -0.18 0.00 -2.23 0.00 0.00 60.65 59.87 3g0g s ILE 107 Cb -0.15 -4.03 -0.05 0.00 -1.58 0.00 0.00 42.46 36.65 3g0g s ILE 107 CO -0.13 0.41 1.12 -0.94 -1.23 0.00 0.00 174.94 174.16 3g0g s SER 108 N -1.32 5.61 0.54 3.58 1.04 0.55 -4.94 113.70 118.76 3g0g s SER 108 Ca 0.38 2.11 0.22 0.00 0.48 0.00 0.00 55.95 59.14 3g0g s SER 108 Cb -0.21 -2.57 1.45 0.00 0.10 0.00 0.00 66.02 64.79 3g0g s SER 108 CO 0.24 -1.29 2.14 -0.65 0.98 0.00 0.00 173.24 174.66 3g0g h PRO 109 N 0.91 0.00 -0.01 4.02 0.11 -1.82 -1.19 132.00 134.02 3g0g h PRO 109 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3g0g h PRO 109 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3g0g h PRO 109 CO 0.56 0.00 -0.00 -0.40 -0.21 0.00 0.00 178.00 177.95 3g0g n ASP 110 N -4.28 0.84 -0.07 -2.05 3.85 -0.94 -4.76 116.55 109.15 3g0g n ASP 110 Ca -0.00 -1.26 -0.01 0.00 -0.71 0.00 0.00 54.79 52.80 3g0g n ASP 110 Cb 0.20 -0.00 -0.00 0.00 -1.35 0.00 0.00 41.12 39.96 3g0g n ASP 110 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3g0g n GLY 111 N 1.11 0.37 0.10 6.12 0.00 -0.45 -4.89 105.19 107.54 3g0g n GLY 111 Ca 0.21 -0.07 0.06 0.00 0.00 0.00 0.00 46.02 46.22 3g0g n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3g0g n GLN 112 N -1.49 0.62 -4.00 1.61 6.02 -1.26 -4.93 117.38 113.96 3g0g n GLN 112 Ca -0.01 0.14 -0.11 0.00 -0.01 0.00 0.00 57.00 57.00 3g0g n GLN 112 Cb 0.22 -1.79 -0.12 0.00 1.02 0.00 0.00 30.24 29.57 3g0g n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3g0g s PHE 113 N -3.17 0.33 -0.13 1.08 0.08 -1.26 -2.11 117.98 112.79 3g0g s PHE 113 Ca -0.02 -0.36 0.03 0.00 0.12 0.00 0.00 56.93 56.70 3g0g s PHE 113 Cb 0.09 -0.21 0.01 0.00 -0.57 0.00 0.00 43.02 42.34 3g0g s PHE 113 CO 0.81 -0.10 -0.22 -1.50 -0.10 0.00 0.00 175.22 174.10 3g0g s ILE 114 N -0.97 2.11 -0.06 0.64 2.07 -0.87 -0.33 121.20 123.79 3g0g s ILE 114 Ca -0.09 -0.98 -0.19 0.00 -1.41 0.00 0.00 60.65 57.98 3g0g s ILE 114 Cb -0.07 -1.83 -0.05 0.00 0.13 0.00 0.00 42.46 40.64 3g0g s ILE 114 CO -0.00 0.55 0.53 -0.22 -1.91 0.00 0.00 174.94 173.88 3g0g s LEU 115 N 0.65 4.36 -0.08 8.50 2.96 0.23 -1.20 118.68 134.10 3g0g s LEU 115 Ca -0.11 0.99 0.03 0.00 -0.22 0.00 0.00 54.13 54.81 3g0g s LEU 115 Cb -0.16 -2.79 -0.02 0.00 0.50 0.00 0.00 46.19 43.72 3g0g s LEU 115 CO 0.02 0.07 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.19 3g0g s LEU 116 N 0.11 2.51 -0.15 -0.68 1.43 0.17 -0.03 118.68 122.04 3g0g s LEU 116 Ca 0.28 -0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 53.02 3g0g s LEU 116 Cb -0.17 -1.51 -0.01 0.00 0.03 0.00 0.00 46.19 44.53 3g0g s LEU 116 CO 0.14 0.25 -0.11 -0.70 0.23 0.00 0.00 176.35 176.15 3g0g s GLU 117 N -0.15 3.40 0.34 1.70 2.12 0.31 -2.15 118.70 124.27 3g0g s GLU 117 Ca -0.02 -0.66 -0.01 0.00 0.36 0.00 0.00 54.97 54.64 3g0g s GLU 117 Cb -0.14 -2.72 -0.00 0.00 0.26 0.00 0.00 34.13 31.53 3g0g s GLU 117 CO 0.04 0.13 0.45 1.52 -0.54 0.00 0.00 175.26 176.86 3g0g s TYR 118 N 0.57 1.17 -1.41 5.30 1.13 -0.49 -0.06 117.35 123.56 3g0g s TYR 118 Ca -0.07 -1.36 -0.08 0.00 -1.41 0.00 0.00 57.07 54.16 3g0g s TYR 118 Cb -0.15 -0.18 0.04 0.00 -1.10 0.00 0.00 41.96 40.57 3g0g s TYR 118 CO 0.03 -1.10 0.92 0.09 -2.51 0.00 0.00 175.55 172.98 3g0g n ASN 119 N -1.45 -3.64 -4.67 -0.18 3.02 -1.26 0.05 115.26 107.13 3g0g n ASN 119 Ca 0.02 -0.75 -0.42 0.00 -0.03 0.00 0.00 54.58 53.40 3g0g n ASN 119 Cb 0.62 -4.20 -0.03 0.00 -0.61 0.00 0.00 39.78 35.56 3g0g n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3g0g s TYR 120 N -3.43 2.62 -0.24 3.10 5.04 -1.26 -4.07 117.35 119.12 3g0g s TYR 120 Ca 0.39 0.74 0.01 0.00 -2.44 0.00 0.00 57.07 55.77 3g0g s TYR 120 Cb -0.19 -3.66 0.06 0.00 0.35 0.00 0.00 41.96 38.53 3g0g s TYR 120 CO 0.80 -2.48 -0.05 0.08 -1.34 0.00 0.00 175.55 172.57 3g0g s VAL 121 N 3.28 1.53 0.34 3.14 1.01 -0.08 -5.00 120.40 124.63 3g0g s VAL 121 Ca 0.62 -1.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.06 3g0g s VAL 121 Cb -0.28 -1.82 -0.11 0.00 0.00 0.00 0.00 36.38 34.18 3g0g s VAL 121 CO 0.22 -0.13 1.48 -0.75 0.00 0.00 0.00 175.10 175.92 3g0g s LYS 122 N 1.39 4.16 0.00 2.72 2.20 -1.26 -1.14 119.74 127.81 3g0g s LYS 122 Ca -0.05 2.50 0.00 0.00 -0.36 0.00 0.00 55.97 58.06 3g0g s LYS 122 Cb -0.19 -3.01 0.00 0.00 -1.51 0.00 0.00 37.83 33.12 3g0g s LYS 122 CO -0.07 -0.49 0.00 0.94 -0.36 0.00 0.00 175.35 175.37 3g0g n GLN 123 N 1.05 0.00 0.00 4.03 7.27 -0.52 -4.88 117.38 124.33 3g0g n GLN 123 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.10 3g0g n GLN 123 Cb 0.39 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.04 3g0g n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 3g0g n TRP 124 N 0.00 0.00 -0.17 3.69 5.03 -1.19 -4.95 117.44 119.85 3g0g n TRP 124 Ca 0.00 0.00 -0.08 0.00 3.03 0.00 0.00 57.50 60.45 3g0g n TRP 124 Cb 0.00 0.00 0.01 0.00 -1.03 0.00 0.00 31.31 30.29 3g0g n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 3g0g h ARG 125 N 0.00 0.74 0.00 -0.99 2.43 -1.99 -3.37 114.38 111.20 3g0g h ARG 125 Ca 0.00 -0.15 -0.05 0.00 -0.81 0.00 0.00 59.98 58.97 3g0g h ARG 125 Cb 0.00 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 3g0g h ARG 125 CO 0.00 0.68 -1.23 0.72 -1.51 0.00 0.00 179.97 178.63 3g0g n HIS 126 N -4.54 0.00 -2.57 2.20 8.25 -1.26 -5.05 115.22 112.25 3g0g n HIS 126 Ca 0.01 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.11 3g0g n HIS 126 Cb 0.17 -0.16 -0.04 0.00 1.12 0.00 0.00 29.99 31.08 3g0g n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3g0g s SER 127 N -3.25 6.87 0.25 0.41 1.04 -1.26 -4.73 113.70 113.03 3g0g s SER 127 Ca -0.02 2.03 -0.19 0.00 0.48 0.00 0.00 55.95 58.25 3g0g s SER 127 Cb 0.01 -2.59 0.02 0.00 0.10 0.00 0.00 66.02 63.57 3g0g s SER 127 CO 0.15 -0.41 0.64 -0.72 0.98 0.00 0.00 173.24 173.87 3g0g s TYR 128 N -1.61 -0.12 0.13 5.02 -0.85 -1.26 -1.44 117.35 117.22 3g0g s TYR 128 Ca 0.56 -0.29 0.07 0.00 -0.52 0.00 0.00 57.07 56.89 3g0g s TYR 128 Cb -0.22 0.56 -0.04 0.00 0.38 0.00 0.00 41.96 42.63 3g0g s TYR 128 CO 0.28 -1.11 -0.04 0.99 -1.52 0.00 0.00 175.55 174.16 3g0g s THR 129 N -3.91 3.68 0.17 -3.49 2.01 -0.29 -4.55 115.64 109.26 3g0g s THR 129 Ca 0.12 -1.26 -0.23 0.00 0.31 0.00 0.00 61.69 60.63 3g0g s THR 129 Cb -0.04 -2.78 0.06 0.00 0.01 0.00 0.00 72.50 69.75 3g0g s THR 129 CO 0.04 0.03 0.69 0.00 -0.69 0.00 0.00 174.62 174.69 3g0g s ALA 130 N -1.44 -1.52 0.10 7.40 0.00 -0.67 -0.90 121.76 124.73 3g0g s ALA 130 Ca 0.25 0.31 0.03 0.00 0.00 0.00 0.00 51.96 52.54 3g0g s ALA 130 Cb -0.11 0.81 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 3g0g s ALA 130 CO 0.17 -0.85 0.14 -1.12 0.00 0.00 0.00 175.76 174.09 3g0g s SER 131 N -2.78 5.79 0.08 0.00 0.01 0.11 -0.74 113.70 116.17 3g0g s SER 131 Ca 0.05 0.05 0.02 0.00 1.31 0.00 0.00 55.95 57.37 3g0g s SER 131 Cb -0.02 -1.62 -0.04 0.00 0.21 0.00 0.00 66.02 64.55 3g0g s SER 131 CO -0.06 0.14 -0.07 -0.31 0.41 0.00 0.00 173.24 173.35 3g0g s TYR 132 N -1.52 0.84 -0.06 2.43 1.51 -1.26 -1.40 117.35 117.89 3g0g s TYR 132 Ca 0.31 -0.76 -0.06 0.00 -1.01 0.00 0.00 57.07 55.56 3g0g s TYR 132 Cb -0.12 -0.49 0.01 0.00 -0.11 0.00 0.00 41.96 41.26 3g0g s TYR 132 CO 0.24 -0.11 0.16 -0.51 -1.11 0.00 0.00 175.55 174.21 3g0g s ASP 133 N -2.52 -0.16 -0.17 2.29 1.01 -0.91 -4.62 116.67 111.59 3g0g s ASP 133 Ca 0.04 0.30 -0.03 0.00 0.71 0.00 0.00 52.55 53.57 3g0g s ASP 133 Cb -0.00 0.32 -0.02 0.00 1.01 0.00 0.00 42.92 44.22 3g0g s ASP 133 CO -0.03 -0.06 -0.05 -0.63 0.21 0.00 0.00 175.17 174.61 3g0g s ILE 134 N 0.04 3.69 -0.23 0.77 1.01 -1.26 -0.66 121.20 124.56 3g0g s ILE 134 Ca -0.00 -0.42 -0.06 0.00 0.00 0.00 0.00 60.65 60.17 3g0g s ILE 134 Cb -0.01 -2.62 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 3g0g s ILE 134 CO 0.00 0.48 0.02 -0.47 0.00 0.00 0.00 174.94 174.98 3g0g s TYR 135 N 0.60 3.04 -0.41 3.97 5.04 -0.34 -0.71 117.35 128.54 3g0g s TYR 135 Ca -0.03 -0.58 -0.29 0.00 -2.44 0.00 0.00 57.07 53.73 3g0g s TYR 135 Cb -0.15 -2.17 0.01 0.00 0.35 0.00 0.00 41.96 40.01 3g0g s TYR 135 CO 0.03 -0.39 1.35 0.34 -1.34 0.00 0.00 175.55 175.53 3g0g s ASP 136 N 1.46 6.43 0.30 4.32 -1.08 -0.62 -2.04 116.67 125.44 3g0g s ASP 136 Ca 0.05 0.81 0.03 0.00 -0.52 0.00 0.00 52.55 52.92 3g0g s ASP 136 Cb -0.15 -2.54 0.48 0.00 -1.46 0.00 0.00 42.92 39.26 3g0g s ASP 136 CO 0.01 -1.35 1.79 -0.07 0.52 0.00 0.00 175.17 176.07 3g0g h LEU 137 N 11.85 0.52 0.19 -1.34 3.38 -1.74 0.32 115.31 128.50 3g0g h LEU 137 Ca -0.27 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.56 3g0g h LEU 137 Cb 1.10 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.71 3g0g h LEU 137 CO 1.09 0.67 -0.09 0.78 0.09 0.00 0.00 178.44 180.97 3g0g h ASN 138 N 0.50 -0.22 1.04 -0.43 2.35 -1.91 -3.30 115.58 113.61 3g0g h ASN 138 Ca 0.09 -0.31 0.00 0.00 -0.55 0.00 0.00 56.30 55.53 3g0g h ASN 138 Cb 0.49 0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.91 3g0g h ASN 138 CO 0.03 0.28 0.00 0.29 -1.65 0.00 0.00 177.43 176.38 3g0g n LYS 139 N -4.98 0.12 -3.50 0.81 5.02 -1.21 -4.94 118.16 109.49 3g0g n LYS 139 Ca -0.08 0.18 -0.19 0.00 -2.02 0.00 0.00 58.31 56.20 3g0g n LYS 139 Cb 0.26 -1.67 0.08 0.00 -0.02 0.00 0.00 35.03 33.68 3g0g n LYS 139 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3g0g n ARG 140 N -1.88 -6.48 -3.52 1.97 5.12 0.09 -5.01 116.66 106.94 3g0g n ARG 140 Ca 0.05 0.80 -0.16 0.00 -1.93 0.00 0.00 57.85 56.62 3g0g n ARG 140 Cb 0.33 -5.75 -0.05 0.00 -1.16 0.00 0.00 32.46 25.82 3g0g n ARG 140 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 3g0g s GLN 141 N -5.60 0.98 0.40 5.56 -2.07 -1.15 -5.01 119.66 112.77 3g0g s GLN 141 Ca 0.08 0.16 -0.25 0.00 -1.82 0.00 0.00 55.36 53.54 3g0g s GLN 141 Cb -0.04 0.46 -0.08 0.00 -1.09 0.00 0.00 33.01 32.26 3g0g s GLN 141 CO 0.75 -0.32 1.12 -0.51 -1.32 0.00 0.00 175.29 175.00 3g0g s LEU 142 N -1.33 4.16 0.17 2.60 2.01 -1.26 -1.59 118.68 123.44 3g0g s LEU 142 Ca -0.08 2.21 -0.30 0.00 0.01 0.00 0.00 54.13 55.97 3g0g s LEU 142 Cb -0.00 -4.10 -0.07 0.00 0.01 0.00 0.00 46.19 42.02 3g0g s LEU 142 CO 0.06 -0.61 1.09 -0.63 1.01 0.00 0.00 176.35 177.26 3g0g s ILE 143 N -1.52 3.93 0.00 -0.59 1.09 0.11 -4.90 121.20 119.33 3g0g s ILE 143 Ca 0.58 1.66 0.00 0.00 -1.10 0.00 0.00 60.65 61.79 3g0g s ILE 143 Cb -0.27 -4.06 0.00 0.00 -1.06 0.00 0.00 42.46 37.07 3g0g s ILE 143 CO 0.34 0.28 0.00 0.35 -0.10 0.00 0.00 174.94 175.81 3g0g n THR 144 N 2.40 0.00 -3.88 2.92 -2.24 -1.26 -4.67 114.28 107.54 3g0g n THR 144 Ca 0.03 -0.39 -0.37 0.00 -2.27 0.00 0.00 64.05 61.05 3g0g n THR 144 Cb 0.46 0.91 -0.06 0.00 -2.10 0.00 0.00 70.33 69.54 3g0g n THR 144 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3g0g s GLU 145 N -1.11 3.53 -1.20 -0.78 1.03 -1.26 -4.55 118.70 114.37 3g0g s GLU 145 Ca 0.00 -0.16 -0.12 0.00 0.03 0.00 0.00 54.97 54.72 3g0g s GLU 145 Cb 0.00 -3.20 -0.01 0.00 -0.80 0.00 0.00 34.13 30.11 3g0g s GLU 145 CO 0.00 0.70 0.74 0.39 -1.33 0.00 0.00 175.26 175.76 3g0g n GLU 146 N 2.22 -2.33 -1.50 -4.83 -0.58 -1.26 -4.69 120.64 107.67 3g0g n GLU 146 Ca -0.19 0.53 -0.31 0.00 -0.42 0.00 0.00 57.16 56.77 3g0g n GLU 146 Cb 0.54 -4.58 0.07 0.00 -0.57 0.00 0.00 31.44 26.90 3g0g n GLU 146 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3g0g s ARG 147 N -5.87 2.58 0.08 3.49 0.52 -1.26 -4.86 118.95 113.62 3g0g s ARG 147 Ca 0.32 0.92 -0.31 0.00 -0.52 0.00 0.00 55.73 56.14 3g0g s ARG 147 Cb -0.10 -1.95 -0.07 0.00 0.52 0.00 0.00 34.95 33.35 3g0g s ARG 147 CO 0.84 -1.34 1.30 0.42 0.02 0.00 0.00 175.30 176.54 3g0g s ILE 148 N -3.04 3.68 0.88 1.52 1.01 -1.26 -5.00 121.20 118.99 3g0g s ILE 148 Ca 0.59 1.20 -0.10 0.00 0.00 0.00 0.00 60.65 62.34 3g0g s ILE 148 Cb -0.15 -3.77 0.12 0.00 0.01 0.00 0.00 42.46 38.68 3g0g s ILE 148 CO 0.55 0.08 1.14 -2.16 0.00 0.00 0.00 174.94 174.55 3g0g s PRO 149 N 1.21 1.34 0.60 2.79 0.04 -1.26 -4.50 135.00 135.22 3g0g s PRO 149 Ca 0.62 1.47 -0.17 0.00 0.04 0.00 0.00 61.00 62.96 3g0g s PRO 149 Cb -0.33 -1.77 -0.03 0.00 0.04 0.00 0.00 34.50 32.41 3g0g s PRO 149 CO 0.29 -2.38 1.10 -0.80 0.04 0.00 0.00 177.00 175.25 3g0g s ASN 150 N -2.82 5.49 -0.87 6.66 0.01 -1.26 -3.80 114.94 118.34 3g0g s ASN 150 Ca 0.66 2.01 -0.03 0.00 -0.71 0.00 0.00 52.86 54.79 3g0g s ASN 150 Cb -0.22 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 38.89 3g0g s ASN 150 CO 0.57 -1.37 0.44 0.59 -1.51 0.00 0.00 177.10 175.82 3g0g n ASN 151 N -1.92 -4.30 -4.75 -1.22 4.13 -1.08 -4.99 115.26 101.14 3g0g n ASN 151 Ca 0.10 -0.20 -0.41 0.00 1.68 0.00 0.00 54.58 55.75 3g0g n ASN 151 Cb 0.52 -3.10 -0.04 0.00 -1.54 0.00 0.00 39.78 35.61 3g0g n ASN 151 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3g0g s THR 152 N -2.98 3.71 -0.04 3.41 2.01 0.09 -4.60 115.64 117.23 3g0g s THR 152 Ca 0.22 1.60 -0.00 0.00 0.31 0.00 0.00 61.69 63.82 3g0g s THR 152 Cb -0.10 -4.02 -0.26 0.00 0.01 0.00 0.00 72.50 68.13 3g0g s THR 152 CO 0.27 0.34 0.68 1.56 -0.69 0.00 0.00 174.62 176.78 3g0g h GLN 153 N 4.43 0.19 -2.06 4.92 4.20 -0.89 -1.78 115.11 124.13 3g0g h GLN 153 Ca -0.45 -0.32 -0.05 0.00 0.06 0.00 0.00 58.65 57.88 3g0g h GLN 153 Cb 1.21 0.12 -0.21 0.00 0.30 0.00 0.00 27.48 28.90 3g0g h GLN 153 CO 0.69 0.99 0.11 -0.46 -0.67 0.00 0.00 178.83 179.49 3g0g s TRP 154 N -2.60 -0.75 0.01 2.96 -0.11 -1.19 -4.60 118.94 112.66 3g0g s TRP 154 Ca -0.11 1.77 0.01 0.00 1.22 0.00 0.00 56.10 58.99 3g0g s TRP 154 Cb 0.07 0.28 -0.01 0.00 -1.50 0.00 0.00 33.47 32.31 3g0g s TRP 154 CO 0.82 -0.40 -0.03 0.14 -4.62 0.00 0.00 176.95 172.86 3g0g s VAL 155 N 0.18 0.24 -0.20 5.86 -7.23 -1.26 -0.43 120.40 117.56 3g0g s VAL 155 Ca -0.01 -0.32 -0.16 0.00 -1.81 0.00 0.00 61.98 59.67 3g0g s VAL 155 Cb -0.04 -0.25 0.06 0.00 0.56 0.00 0.00 36.38 36.71 3g0g s VAL 155 CO 0.02 -0.05 0.53 0.28 -0.31 0.00 0.00 175.10 175.56 3g0g s THR 156 N -0.38 -0.00 0.63 5.32 -1.32 -0.67 -5.02 115.64 114.19 3g0g s THR 156 Ca -0.02 0.02 -0.15 0.00 -1.21 0.00 0.00 61.69 60.33 3g0g s THR 156 Cb -0.03 -0.75 -0.02 0.00 -1.51 0.00 0.00 72.50 70.19 3g0g s THR 156 CO -0.00 0.01 1.07 0.26 -2.21 0.00 0.00 174.62 173.74 3g0g s TRP 157 N 0.67 2.92 0.77 9.09 0.52 -1.26 -1.92 118.94 129.73 3g0g s TRP 157 Ca -0.03 1.51 -0.11 0.00 0.02 0.00 0.00 56.10 57.48 3g0g s TRP 157 Cb -0.05 -3.02 0.05 0.00 -1.15 0.00 0.00 33.47 29.31 3g0g s TRP 157 CO -0.04 -1.27 1.09 -1.54 0.02 0.00 0.00 176.95 175.20 3g0g s SER 158 N -2.93 4.69 0.42 2.95 1.04 -0.40 -4.91 113.70 114.56 3g0g s SER 158 Ca 0.63 1.43 0.14 0.00 0.48 0.00 0.00 55.95 58.63 3g0g s SER 158 Cb -0.17 -2.20 0.90 0.00 0.10 0.00 0.00 66.02 64.66 3g0g s SER 158 CO 0.41 -1.86 1.93 -0.65 0.98 0.00 0.00 173.24 174.05 3g0g h PRO 159 N -1.01 0.00 -6.35 4.02 0.11 -1.82 -3.43 132.00 123.51 3g0g h PRO 159 Ca -0.46 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.05 3g0g h PRO 159 Cb 1.25 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.17 3g0g h PRO 159 CO 0.58 0.26 -0.82 0.14 -0.21 0.00 0.00 178.00 177.95 3g0g s VAL 160 N -4.43 2.07 0.00 3.15 -7.23 -1.26 -4.76 120.40 107.93 3g0g s VAL 160 Ca -0.03 -1.89 0.00 0.00 -1.81 0.00 0.00 61.98 58.25 3g0g s VAL 160 Cb 0.15 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 35.16 3g0g s VAL 160 CO 0.70 -0.15 0.00 0.61 -0.31 0.00 0.00 175.10 175.96 3g0g n GLY 161 N 0.48 1.04 0.93 2.32 0.00 -1.26 -4.40 105.19 104.29 3g0g n GLY 161 Ca -0.14 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.21 3g0g n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3g0g n HIS 162 N 12.48 0.00 -1.90 1.61 1.44 -1.26 -2.21 115.22 125.38 3g0g n HIS 162 Ca 0.00 -0.25 -0.35 0.00 -2.01 0.00 0.00 57.72 55.11 3g0g n HIS 162 Cb 0.00 0.04 0.04 0.00 0.12 0.00 0.00 29.99 30.20 3g0g n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 3g0g s LYS 163 N 0.00 2.85 -0.18 -1.40 1.02 -1.26 -4.66 119.74 116.12 3g0g s LYS 163 Ca 0.12 1.71 -0.06 0.00 0.02 0.00 0.00 55.97 57.76 3g0g s LYS 163 Cb 0.14 -1.93 0.08 0.00 -0.52 0.00 0.00 37.83 35.60 3g0g s LYS 163 CO -0.06 -1.28 0.35 -1.17 -0.92 0.00 0.00 175.35 172.28 3g0g s LEU 164 N -4.36 -0.50 -0.02 3.17 2.96 -0.34 -1.28 118.68 118.32 3g0g s LEU 164 Ca 0.74 0.74 0.03 0.00 -0.22 0.00 0.00 54.13 55.42 3g0g s LEU 164 Cb -0.28 1.06 -0.03 0.00 0.50 0.00 0.00 46.19 47.44 3g0g s LEU 164 CO 0.36 -0.24 -0.07 0.00 -1.32 0.00 0.00 176.35 175.07 3g0g s ALA 165 N 2.53 2.98 0.14 5.97 0.00 -0.81 0.29 121.76 132.87 3g0g s ALA 165 Ca 0.01 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 50.98 3g0g s ALA 165 Cb -0.12 -1.14 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 3g0g s ALA 165 CO -0.11 0.60 0.05 1.52 0.00 0.00 0.00 175.76 177.82 3g0g s TYR 166 N -0.93 0.94 -0.10 0.00 -0.85 0.26 -1.68 117.35 114.99 3g0g s TYR 166 Ca 0.15 -1.21 0.04 0.00 -0.52 0.00 0.00 57.07 55.53 3g0g s TYR 166 Cb -0.11 -0.52 0.00 0.00 0.38 0.00 0.00 41.96 41.71 3g0g s TYR 166 CO 0.05 -0.47 -0.22 0.08 -1.52 0.00 0.00 175.55 173.47 3g0g s VAL 167 N -3.99 1.89 -0.13 -3.49 1.01 0.42 -0.55 120.40 115.57 3g0g s VAL 167 Ca 0.25 -0.92 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 3g0g s VAL 167 Cb 0.07 -1.65 0.05 0.00 0.00 0.00 0.00 36.38 34.86 3g0g s VAL 167 CO 0.03 0.52 0.29 0.86 0.00 0.00 0.00 175.10 176.80 3g0g s TRP 168 N 0.44 -0.42 -1.37 5.22 -0.00 -0.55 -0.29 118.94 121.98 3g0g s TRP 168 Ca -0.17 0.96 -0.03 0.00 -0.00 0.00 0.00 56.10 56.86 3g0g s TRP 168 Cb -0.17 0.09 0.02 0.00 -0.00 0.00 0.00 33.47 33.40 3g0g s TRP 168 CO 0.07 -0.29 0.70 0.09 -0.00 0.00 0.00 176.95 177.52 3g0g n ASN 169 N 4.51 -1.64 -0.33 5.86 5.03 -1.26 -2.12 115.26 125.31 3g0g n ASN 169 Ca -0.20 -0.85 -0.04 0.00 0.87 0.00 0.00 54.58 54.36 3g0g n ASN 169 Cb 0.53 -3.85 -0.02 0.00 -1.02 0.00 0.00 39.78 35.42 3g0g n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3g0g n ASN 170 N -3.00 -5.68 -4.50 6.41 5.03 -1.26 -4.52 115.26 107.73 3g0g n ASN 170 Ca -0.24 0.11 -0.28 0.00 0.87 0.00 0.00 54.58 55.04 3g0g n ASN 170 Cb 0.65 -3.56 -0.11 0.00 -1.02 0.00 0.00 39.78 35.75 3g0g n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3g0g s ASP 171 N -2.18 3.91 -0.21 6.41 -0.00 -0.90 -2.13 116.67 121.58 3g0g s ASP 171 Ca 0.00 -0.65 -0.13 0.00 -0.00 0.00 0.00 52.55 51.77 3g0g s ASP 171 Cb 0.00 -0.54 -0.05 0.00 -0.00 0.00 0.00 42.92 42.34 3g0g s ASP 171 CO 0.00 0.13 0.26 -0.63 -0.00 0.00 0.00 175.17 174.93 3g0g s ILE 172 N -1.52 5.30 0.12 0.77 1.01 -1.26 -1.48 121.20 124.15 3g0g s ILE 172 Ca 0.22 0.42 0.10 0.00 0.00 0.00 0.00 60.65 61.39 3g0g s ILE 172 Cb -0.09 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 3g0g s ILE 172 CO 0.12 0.34 -0.23 -0.31 0.00 0.00 0.00 174.94 174.86 3g0g s TYR 173 N 0.92 2.41 -0.07 3.97 2.02 0.29 -0.03 117.35 126.85 3g0g s TYR 173 Ca 0.13 -0.33 0.03 0.00 -0.37 0.00 0.00 57.07 56.53 3g0g s TYR 173 Cb -0.13 -1.30 0.01 0.00 -0.40 0.00 0.00 41.96 40.13 3g0g s TYR 173 CO 0.05 0.35 -0.16 0.08 -1.57 0.00 0.00 175.55 174.29 3g0g s VAL 174 N -1.08 1.40 -0.26 0.71 1.01 -0.50 -0.58 120.40 121.11 3g0g s VAL 174 Ca 0.15 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 3g0g s VAL 174 Cb -0.10 -1.25 0.01 0.00 0.00 0.00 0.00 36.38 35.03 3g0g s VAL 174 CO 0.07 0.41 0.02 -0.54 0.00 0.00 0.00 175.10 175.07 3g0g s LYS 175 N 0.56 3.15 0.03 2.72 1.02 0.15 -0.78 119.74 126.58 3g0g s LYS 175 Ca -0.16 -0.80 -0.23 0.00 0.02 0.00 0.00 55.97 54.81 3g0g s LYS 175 Cb -0.16 -3.21 -0.16 0.00 -0.52 0.00 0.00 37.83 33.78 3g0g s LYS 175 CO 0.05 -0.36 1.39 0.82 -0.92 0.00 0.00 175.35 176.34 3g0g h ILE 176 N 5.86 1.31 -4.41 2.17 1.08 -1.83 -0.88 117.51 120.80 3g0g h ILE 176 Ca -0.34 -0.99 -0.68 0.00 -0.39 0.00 0.00 64.86 62.46 3g0g h ILE 176 Cb 1.13 1.80 -0.30 0.00 -3.07 0.00 0.00 36.82 36.38 3g0g h ILE 176 CO 0.59 0.28 -0.88 -1.61 -0.69 0.00 0.00 178.15 175.84 3g0g s GLU 177 N -4.65 2.15 0.39 2.37 0.41 -1.26 -4.13 118.70 113.98 3g0g s GLU 177 Ca -0.15 -0.89 0.18 0.00 -0.41 0.00 0.00 54.97 53.70 3g0g s GLU 177 Cb 0.04 -2.00 1.09 0.00 -1.78 0.00 0.00 34.13 31.49 3g0g s GLU 177 CO 0.70 0.49 1.76 -1.35 -0.49 0.00 0.00 175.26 176.37 3g0g h PRO 178 N 5.68 0.39 0.00 0.39 0.11 -1.85 -1.74 132.00 134.97 3g0g h PRO 178 Ca -0.39 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3g0g h PRO 178 Cb 1.14 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3g0g h PRO 178 CO 0.47 0.26 -0.77 -2.95 -0.21 0.00 0.00 178.00 174.79 3g0g h ASN 179 N 0.40 0.00 -4.30 -2.05 -0.00 -1.90 -3.47 115.58 104.26 3g0g h ASN 179 Ca 0.61 -0.02 -0.50 0.00 -0.00 0.00 0.00 56.30 56.40 3g0g h ASN 179 Cb 1.53 0.00 0.04 0.00 -0.00 0.00 0.00 38.32 39.89 3g0g h ASN 179 CO -0.33 0.01 0.40 -0.76 -0.00 0.00 0.00 177.43 176.76 3g0g s LEU 180 N -5.42 3.37 0.85 6.14 1.43 -0.66 -4.46 118.68 119.94 3g0g s LEU 180 Ca 0.02 1.48 -0.12 0.00 -1.03 0.00 0.00 54.13 54.47 3g0g s LEU 180 Cb 0.09 -4.48 0.11 0.00 0.03 0.00 0.00 46.19 41.94 3g0g s LEU 180 CO 0.76 -0.77 1.19 -2.16 0.23 0.00 0.00 176.35 175.59 3g0g s PRO 181 N -4.78 1.35 -0.01 1.29 0.04 -1.26 -4.83 135.00 126.80 3g0g s PRO 181 Ca 0.56 1.69 -0.06 0.00 0.04 0.00 0.00 61.00 63.24 3g0g s PRO 181 Cb -0.11 -1.75 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 3g0g s PRO 181 CO 0.46 -2.41 0.23 -1.54 0.04 0.00 0.00 177.00 173.77 3g0g s SER 182 N -2.34 6.45 -0.16 6.66 1.04 -1.26 -4.69 113.70 119.40 3g0g s SER 182 Ca 0.71 0.49 -0.19 0.00 0.48 0.00 0.00 55.95 57.44 3g0g s SER 182 Cb -0.27 -2.06 -0.03 0.00 0.10 0.00 0.00 66.02 63.76 3g0g s SER 182 CO 0.54 0.28 0.54 -0.31 0.98 0.00 0.00 173.24 175.26 3g0g s TYR 183 N -1.27 3.44 -0.30 5.02 2.02 0.04 -4.85 117.35 121.44 3g0g s TYR 183 Ca 0.26 0.88 -0.29 0.00 -0.37 0.00 0.00 57.07 57.55 3g0g s TYR 183 Cb -0.13 -2.66 0.01 0.00 -0.40 0.00 0.00 41.96 38.78 3g0g s TYR 183 CO 0.15 -0.01 1.05 0.50 -1.57 0.00 0.00 175.55 175.67 3g0g s ARG 184 N 1.27 4.10 -0.10 -0.62 3.52 -1.26 -1.41 118.95 124.46 3g0g s ARG 184 Ca 0.27 1.10 -0.22 0.00 -0.13 0.00 0.00 55.73 56.74 3g0g s ARG 184 Cb -0.16 -3.71 -0.28 0.00 -1.56 0.00 0.00 34.95 29.24 3g0g s ARG 184 CO 0.11 -0.82 0.71 0.82 -0.81 0.00 0.00 175.30 175.31 3g0g h ILE 185 N 5.66 1.41 -3.99 4.11 1.08 -0.83 -3.41 117.51 121.54 3g0g h ILE 185 Ca -0.20 -2.42 -0.66 0.00 -0.39 0.00 0.00 64.86 61.18 3g0g h ILE 185 Cb 1.06 3.04 -0.23 0.00 -3.07 0.00 0.00 36.82 37.62 3g0g h ILE 185 CO 1.01 0.65 -0.86 0.42 -0.69 0.00 0.00 178.15 178.67 3g0g s THR 186 N -2.38 2.11 0.00 -0.27 -4.23 -1.23 -4.81 115.64 104.83 3g0g s THR 186 Ca -0.18 -1.63 0.00 0.00 -1.18 0.00 0.00 61.69 58.70 3g0g s THR 186 Cb 0.01 -1.87 0.00 0.00 1.34 0.00 0.00 72.50 71.99 3g0g s THR 186 CO 0.76 0.11 0.37 0.79 -0.54 0.00 0.00 174.62 176.11 3g0g n TRP 187 N 1.13 0.00 1.10 3.99 7.02 -1.26 -4.49 117.44 124.93 3g0g n TRP 187 Ca -0.18 -0.02 0.12 0.00 -1.02 0.00 0.00 57.50 56.40 3g0g n TRP 187 Cb 0.53 -0.00 0.16 0.00 -2.42 0.00 0.00 31.31 29.58 3g0g n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 3g0g n THR 188 N -0.02 0.00 -1.68 -0.99 -2.24 -1.26 -4.97 114.28 103.12 3g0g n THR 188 Ca 0.00 -0.15 -0.45 0.00 -2.27 0.00 0.00 64.05 61.18 3g0g n THR 188 Cb 0.09 0.77 -0.04 0.00 -2.10 0.00 0.00 70.33 69.06 3g0g n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g0g n GLY 189 N 1.41 1.42 2.91 3.38 0.00 -1.26 -4.72 105.19 108.33 3g0g n GLY 189 Ca 0.09 0.72 -0.15 0.00 0.00 0.00 0.00 46.02 46.69 3g0g n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3g0g s LYS 190 N 2.31 0.08 0.06 1.61 2.20 -0.95 -4.86 119.74 120.19 3g0g s LYS 190 Ca 0.83 0.54 -0.36 0.00 -0.36 0.00 0.00 55.97 56.62 3g0g s LYS 190 Cb -0.60 -0.19 -0.16 0.00 -1.51 0.00 0.00 37.83 35.37 3g0g s LYS 190 CO 0.41 -0.25 1.44 -1.91 -0.36 0.00 0.00 175.35 174.68 3g0g n GLU 191 N 4.92 1.38 -0.91 4.03 2.13 -1.26 -0.70 120.64 130.24 3g0g n GLU 191 Ca -0.13 0.50 0.00 0.00 0.66 0.00 0.00 57.16 58.19 3g0g n GLU 191 Cb 0.51 -2.18 0.00 0.00 0.27 0.00 0.00 31.44 30.04 3g0g n GLU 191 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3g0g n ASP 192 N 3.11 -3.47 0.09 4.31 8.00 -1.26 -4.74 116.55 122.59 3g0g n ASP 192 Ca 0.19 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.69 3g0g n ASP 192 Cb 0.21 -2.15 0.00 0.00 -0.02 0.00 0.00 41.12 39.16 3g0g n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3g0g n ILE 193 N -2.26 0.46 -5.05 0.53 5.41 0.02 -4.71 119.36 113.76 3g0g n ILE 193 Ca 0.00 0.15 -0.31 0.00 1.00 0.00 0.00 62.75 63.59 3g0g n ILE 193 Cb 0.22 -0.97 -0.17 0.00 -0.71 0.00 0.00 39.64 38.01 3g0g n ILE 193 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3g0g s ILE 194 N -2.00 1.95 -0.25 1.39 -1.09 0.13 0.22 121.20 121.55 3g0g s ILE 194 Ca 0.00 -0.95 0.03 0.00 -2.23 0.00 0.00 60.65 57.50 3g0g s ILE 194 Cb 0.00 -1.70 0.06 0.00 -1.58 0.00 0.00 42.46 39.24 3g0g s ILE 194 CO 0.00 0.53 -0.10 -0.31 -1.23 0.00 0.00 174.94 173.83 3g0g s TYR 195 N 0.46 3.12 -0.31 3.97 1.51 -0.36 -2.24 117.35 123.50 3g0g s TYR 195 Ca -0.16 -2.22 -0.10 0.00 -1.01 0.00 0.00 57.07 53.58 3g0g s TYR 195 Cb -0.17 -1.87 -0.01 0.00 -0.11 0.00 0.00 41.96 39.79 3g0g s TYR 195 CO 0.06 -0.86 0.16 -0.80 -1.11 0.00 0.00 175.55 173.00 3g0g s ASN 196 N 1.15 5.61 0.00 2.29 0.01 -0.91 -1.48 114.94 121.62 3g0g s ASN 196 Ca -0.08 -0.46 0.00 0.00 -0.71 0.00 0.00 52.86 51.61 3g0g s ASN 196 Cb -0.20 -2.02 0.00 0.00 0.41 0.00 0.00 41.25 39.44 3g0g s ASN 196 CO -0.05 -0.18 0.00 0.61 -1.51 0.00 0.00 177.10 175.97 3g0g n GLY 197 N 5.00 2.13 3.23 0.66 0.00 -0.98 -4.36 105.19 110.87 3g0g n GLY 197 Ca -0.14 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.71 3g0g n GLY 197 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3g0g s ILE 198 N -2.46 1.27 0.42 -0.61 -4.36 -1.26 0.14 121.20 114.35 3g0g s ILE 198 Ca 0.00 -1.72 -0.12 0.00 -0.26 0.00 0.00 60.65 58.55 3g0g s ILE 198 Cb 0.00 -1.52 -0.07 0.00 1.25 0.00 0.00 42.46 42.12 3g0g s ILE 198 CO 0.00 -0.45 0.80 0.42 0.24 0.00 0.00 174.94 175.95 3g0g s THR 199 N -2.23 4.73 0.58 8.37 -4.23 0.18 -4.71 115.64 118.33 3g0g s THR 199 Ca 0.09 0.75 -0.04 0.00 -1.18 0.00 0.00 61.69 61.31 3g0g s THR 199 Cb -0.04 -3.72 0.12 0.00 1.34 0.00 0.00 72.50 70.20 3g0g s THR 199 CO 0.03 -0.52 0.79 -0.90 -0.54 0.00 0.00 174.62 173.47 3g0g n ASP 200 N -1.27 0.70 -0.09 3.99 3.85 -1.26 -4.76 116.55 117.70 3g0g n ASP 200 Ca 0.03 -1.68 -0.06 0.00 -0.71 0.00 0.00 54.79 52.38 3g0g n ASP 200 Cb 0.54 -0.54 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 3g0g n ASP 200 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.20 175.94 3g0g h TRP 201 N -0.84 -0.23 -0.04 2.11 7.01 -2.00 -0.77 115.95 121.19 3g0g h TRP 201 Ca -0.26 0.03 -0.18 0.00 2.11 0.00 0.00 58.89 60.59 3g0g h TRP 201 Cb 0.87 0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 28.07 3g0g h TRP 201 CO 0.00 -0.17 -0.77 -0.24 -2.79 0.00 0.00 178.44 174.47 3g0g h VAL 202 N -0.03 1.43 -0.12 2.65 3.04 -1.95 -1.72 116.25 119.56 3g0g h VAL 202 Ca 0.17 -2.31 -0.20 0.00 -1.01 0.00 0.00 66.70 63.34 3g0g h VAL 202 Cb 0.28 2.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.81 3g0g h VAL 202 CO -0.36 0.68 -0.73 1.88 -1.01 0.00 0.00 177.57 178.03 3g0g h TYR 203 N 0.17 0.77 -0.24 3.17 -1.99 -1.91 -0.66 116.97 116.28 3g0g h TYR 203 Ca -0.03 -0.33 -0.01 0.00 2.00 0.00 0.00 58.73 60.36 3g0g h TYR 203 Cb 1.35 -0.12 -0.01 0.00 2.00 0.00 0.00 36.73 39.95 3g0g h TYR 203 CO 0.03 1.11 0.13 1.49 -0.00 0.00 0.00 178.16 180.92 3g0g h GLU 204 N 0.40 0.34 0.18 4.88 4.81 -0.96 -1.54 114.58 122.69 3g0g h GLU 204 Ca -0.03 -0.05 -0.30 0.00 -0.13 0.00 0.00 59.36 58.85 3g0g h GLU 204 Cb 1.32 -0.06 0.02 0.00 0.63 0.00 0.00 28.75 30.65 3g0g h GLU 204 CO 0.14 0.33 -1.35 1.49 -0.73 0.00 0.00 179.01 178.88 3g0g h GLU 205 N 0.27 0.38 0.00 1.92 4.57 -1.32 -2.79 114.58 117.61 3g0g h GLU 205 Ca 0.08 -0.65 0.00 0.00 -1.18 0.00 0.00 59.36 57.61 3g0g h GLU 205 Cb 0.09 0.24 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 3g0g h GLU 205 CO -0.01 1.31 0.00 0.39 -1.18 0.00 0.00 179.01 179.52 3g0g n GLU 206 N -3.60 2.05 0.02 1.92 -0.58 -0.26 -4.62 120.64 115.57 3g0g n GLU 206 Ca -0.12 -0.27 -0.01 0.00 -0.42 0.00 0.00 57.16 56.34 3g0g n GLU 206 Cb 1.06 -0.75 -0.00 0.00 -0.57 0.00 0.00 31.44 31.18 3g0g n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3g0g n VAL 207 N -0.37 0.85 0.81 2.62 0.31 -1.04 -4.86 118.33 116.64 3g0g n VAL 207 Ca 0.00 0.24 0.08 0.00 -0.01 0.00 0.00 64.34 64.66 3g0g n VAL 207 Cb 0.01 -1.60 -0.08 0.00 -0.91 0.00 0.00 33.84 31.26 3g0g n VAL 207 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3g0g n PHE 208 N -3.39 0.00 -2.97 3.52 3.72 -0.61 -4.97 117.46 112.76 3g0g n PHE 208 Ca -0.02 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.22 3g0g n PHE 208 Cb 0.21 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.74 3g0g n PHE 208 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3g0g n SER 209 N -1.15 -2.99 -3.79 4.37 7.64 -1.06 -4.88 113.62 111.75 3g0g n SER 209 Ca 0.04 -0.07 -0.09 0.00 1.01 0.00 0.00 58.87 59.76 3g0g n SER 209 Cb 0.29 -2.55 -0.04 0.00 -1.01 0.00 0.00 64.21 60.90 3g0g n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3g0g s ALA 210 N -2.64 -0.88 -0.08 -0.43 0.00 -1.18 -4.95 121.76 111.61 3g0g s ALA 210 Ca 0.22 -0.32 0.14 0.00 0.00 0.00 0.00 51.96 51.99 3g0g s ALA 210 Cb -0.12 0.88 -0.23 0.00 0.00 0.00 0.00 23.12 23.65 3g0g s ALA 210 CO 0.27 -0.84 0.52 0.98 0.00 0.00 0.00 175.76 176.69 3g0g n TYR 211 N -0.36 0.76 -3.06 0.00 -0.00 -1.26 -4.18 117.16 109.06 3g0g n TYR 211 Ca -0.08 0.28 -0.39 0.00 -0.00 0.00 0.00 57.90 57.70 3g0g n TYR 211 Cb 0.62 -1.14 -0.05 0.00 -0.00 0.00 0.00 39.34 38.76 3g0g n TYR 211 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.86 175.32 3g0g s SER 212 N -5.95 7.17 -0.46 2.98 1.04 -1.26 0.51 113.70 117.73 3g0g s SER 212 Ca -0.06 1.39 0.05 0.00 0.48 0.00 0.00 55.95 57.82 3g0g s SER 212 Cb 0.07 -2.44 0.40 0.00 0.10 0.00 0.00 66.02 64.16 3g0g s SER 212 CO 0.83 0.09 1.07 0.00 0.98 0.00 0.00 173.24 176.21 3g0g n ALA 213 N 2.52 4.94 -2.57 5.32 0.00 0.38 -4.75 120.51 126.34 3g0g n ALA 213 Ca -0.05 -4.37 -0.27 0.00 0.00 0.00 0.00 53.44 48.75 3g0g n ALA 213 Cb 0.50 -0.59 -0.16 0.00 0.00 0.00 0.00 19.45 19.21 3g0g n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3g0g s LEU 214 N -3.51 2.01 -0.26 0.00 1.43 -1.24 -2.09 118.68 115.03 3g0g s LEU 214 Ca 0.48 -0.38 -0.02 0.00 -1.03 0.00 0.00 54.13 53.18 3g0g s LEU 214 Cb 0.38 -1.06 0.11 0.00 0.03 0.00 0.00 46.19 45.65 3g0g s LEU 214 CO -0.17 0.23 0.24 0.26 0.23 0.00 0.00 176.35 177.13 3g0g s TRP 215 N -0.33 -0.26 0.48 0.29 0.51 0.93 -5.00 118.94 115.55 3g0g s TRP 215 Ca 0.04 -0.14 -0.22 0.00 -2.12 0.00 0.00 56.10 53.66 3g0g s TRP 215 Cb -0.09 -0.50 -0.07 0.00 -0.81 0.00 0.00 33.47 32.00 3g0g s TRP 215 CO 0.00 -0.79 1.18 -1.58 -0.51 0.00 0.00 176.95 175.26 3g0g s TRP 216 N 2.30 2.77 0.68 -1.98 0.52 -1.26 -1.05 118.94 120.93 3g0g s TRP 216 Ca 0.08 1.52 -0.11 0.00 0.02 0.00 0.00 56.10 57.61 3g0g s TRP 216 Cb -0.15 -3.42 0.00 0.00 -1.15 0.00 0.00 33.47 28.76 3g0g s TRP 216 CO -0.26 -1.69 1.06 -1.54 0.02 0.00 0.00 176.95 174.55 3g0g s SER 217 N -1.37 5.43 0.58 2.95 1.04 -0.43 -4.92 113.70 116.97 3g0g s SER 217 Ca 0.66 1.63 0.28 0.00 0.48 0.00 0.00 55.95 59.01 3g0g s SER 217 Cb -0.29 -2.50 1.51 0.00 0.10 0.00 0.00 66.02 64.84 3g0g s SER 217 CO 0.35 -1.41 1.97 -0.65 0.98 0.00 0.00 173.24 174.48 3g0g h PRO 218 N -0.60 0.00 -0.31 4.02 0.11 -1.92 0.21 132.00 133.52 3g0g h PRO 218 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3g0g h PRO 218 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3g0g h PRO 218 CO 0.57 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.63 3g0g n ASN 219 N -3.87 2.81 0.00 -2.05 0.23 -1.26 -4.33 115.26 106.80 3g0g n ASN 219 Ca 0.07 -1.99 0.00 0.00 -0.53 0.00 0.00 54.58 52.13 3g0g n ASN 219 Cb 0.58 -0.20 0.00 0.00 -2.08 0.00 0.00 39.78 38.07 3g0g n ASN 219 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3g0g n GLY 220 N 0.41 0.97 0.20 4.83 0.00 0.06 -4.69 105.19 106.96 3g0g n GLY 220 Ca 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.07 3g0g n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3g0g h THR 221 N 0.00 1.01 -3.40 2.61 2.02 -1.94 -3.45 112.91 109.77 3g0g h THR 221 Ca 0.00 -0.19 -0.66 0.00 0.77 0.00 0.00 66.41 66.33 3g0g h THR 221 Cb 0.00 0.42 -0.14 0.00 -1.74 0.00 0.00 68.15 66.69 3g0g h THR 221 CO 0.00 0.10 -0.66 -0.36 0.37 0.00 0.00 175.52 174.97 3g0g s PHE 222 N -6.14 3.01 -0.23 3.16 0.08 -1.26 -0.76 117.98 115.84 3g0g s PHE 222 Ca -0.13 0.02 0.02 0.00 0.12 0.00 0.00 56.93 56.96 3g0g s PHE 222 Cb 0.13 -1.61 0.04 0.00 -0.57 0.00 0.00 43.02 41.02 3g0g s PHE 222 CO 0.73 0.45 -0.14 -1.17 -0.10 0.00 0.00 175.22 175.00 3g0g s LEU 223 N -1.84 2.93 -0.09 -0.37 2.96 -0.23 -1.32 118.68 120.73 3g0g s LEU 223 Ca 0.22 -1.09 -0.11 0.00 -0.22 0.00 0.00 54.13 52.92 3g0g s LEU 223 Cb -0.12 -1.53 -0.05 0.00 0.50 0.00 0.00 46.19 45.00 3g0g s LEU 223 CO 0.13 -0.11 0.27 0.00 -1.32 0.00 0.00 176.35 175.31 3g0g s ALA 224 N 1.18 3.74 0.06 5.97 0.00 -0.21 -0.70 121.76 131.79 3g0g s ALA 224 Ca -0.03 -0.45 -0.10 0.00 0.00 0.00 0.00 51.96 51.37 3g0g s ALA 224 Cb -0.17 -2.23 0.01 0.00 0.00 0.00 0.00 23.12 20.73 3g0g s ALA 224 CO -0.08 0.42 0.22 1.52 0.00 0.00 0.00 175.76 177.83 3g0g s TYR 225 N -0.60 0.05 0.09 0.00 -0.85 -0.11 -0.05 117.35 115.88 3g0g s TYR 225 Ca 0.18 -0.31 0.01 0.00 -0.52 0.00 0.00 57.07 56.43 3g0g s TYR 225 Cb -0.14 -0.01 -0.04 0.00 0.38 0.00 0.00 41.96 42.15 3g0g s TYR 225 CO 0.07 -0.48 0.19 0.00 -1.52 0.00 0.00 175.55 173.81 3g0g s ALA 226 N -2.94 3.88 -0.11 9.51 0.00 -0.89 -0.64 121.76 130.56 3g0g s ALA 226 Ca -0.02 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.02 3g0g s ALA 226 Cb 0.01 -1.71 0.01 0.00 0.00 0.00 0.00 23.12 21.43 3g0g s ALA 226 CO -0.06 0.73 -0.17 -1.14 0.00 0.00 0.00 175.76 175.12 3g0g s GLN 227 N -2.67 2.46 -0.12 0.00 0.74 0.12 -2.31 119.66 117.88 3g0g s GLN 227 Ca 0.33 -0.65 -0.02 0.00 0.05 0.00 0.00 55.36 55.07 3g0g s GLN 227 Cb -0.12 -2.03 -0.03 0.00 1.10 0.00 0.00 33.01 31.93 3g0g s GLN 227 CO 0.27 -0.03 -0.03 -0.06 -0.55 0.00 0.00 175.29 174.89 3g0g s PHE 228 N 0.88 3.04 -0.26 1.67 0.08 -0.55 -0.92 117.98 121.92 3g0g s PHE 228 Ca -0.08 -0.10 -0.03 0.00 0.12 0.00 0.00 56.93 56.85 3g0g s PHE 228 Cb -0.15 -1.86 0.03 0.00 -0.57 0.00 0.00 43.02 40.46 3g0g s PHE 228 CO -0.01 0.17 -0.03 1.21 -0.10 0.00 0.00 175.22 176.47 3g0g s ASN 229 N -0.20 4.53 -0.36 1.36 3.84 0.01 -1.23 114.94 122.88 3g0g s ASN 229 Ca 0.04 -0.89 0.06 0.00 0.21 0.00 0.00 52.86 52.28 3g0g s ASN 229 Cb -0.13 -1.71 0.56 0.00 -0.55 0.00 0.00 41.25 39.42 3g0g s ASN 229 CO 0.02 -0.16 1.64 0.47 -2.79 0.00 0.00 177.10 176.29 3g0g n ASP 230 N 4.70 3.19 -0.35 -4.21 9.92 0.13 -1.40 116.55 128.54 3g0g n ASP 230 Ca -0.16 -3.74 -0.03 0.00 -0.53 0.00 0.00 54.79 50.34 3g0g n ASP 230 Cb 0.47 -0.71 0.09 0.00 -0.64 0.00 0.00 41.12 40.33 3g0g n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 3g0g h THR 231 N 1.04 1.26 -0.19 -3.53 2.02 -1.86 -3.11 112.91 108.53 3g0g h THR 231 Ca 0.39 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 67.01 3g0g h THR 231 Cb 2.04 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 3g0g h THR 231 CO 0.70 0.27 0.00 -0.62 0.37 0.00 0.00 175.52 176.24 3g0g n GLU 232 N -4.37 2.81 -2.39 6.66 1.02 -1.26 -4.95 120.64 118.16 3g0g n GLU 232 Ca 0.10 -1.98 -0.42 0.00 -0.02 0.00 0.00 57.16 54.84 3g0g n GLU 232 Cb 0.06 -1.25 -0.03 0.00 -0.02 0.00 0.00 31.44 30.20 3g0g n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3g0g s VAL 233 N -1.32 4.14 0.80 2.62 1.01 -1.18 -4.72 120.40 121.75 3g0g s VAL 233 Ca 0.18 1.46 -0.11 0.00 0.00 0.00 0.00 61.98 63.50 3g0g s VAL 233 Cb 0.11 -3.94 0.08 0.00 0.00 0.00 0.00 36.38 32.63 3g0g s VAL 233 CO 0.09 -0.03 1.12 -2.84 0.00 0.00 0.00 175.10 173.44 3g0g s PRO 234 N 2.53 1.91 -0.14 2.72 0.02 -1.26 -4.68 135.00 136.10 3g0g s PRO 234 Ca 0.58 1.36 -0.05 0.00 0.02 0.00 0.00 61.00 62.90 3g0g s PRO 234 Cb -0.26 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.38 3g0g s PRO 234 CO 0.22 -1.93 0.05 -0.51 -0.33 0.00 0.00 177.00 174.49 3g0g s LEU 235 N -5.98 3.78 -0.02 -5.54 1.43 -1.26 -0.75 118.68 110.33 3g0g s LEU 235 Ca 0.64 0.14 -0.26 0.00 -1.03 0.00 0.00 54.13 53.62 3g0g s LEU 235 Cb -0.20 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 3g0g s LEU 235 CO 0.54 0.27 0.81 -0.51 0.23 0.00 0.00 176.35 177.69 3g0g s ILE 236 N -0.20 4.93 -0.03 -0.59 1.10 0.03 -4.88 121.20 121.56 3g0g s ILE 236 Ca 0.07 1.69 0.05 0.00 -0.51 0.00 0.00 60.65 61.95 3g0g s ILE 236 Cb -0.12 -4.15 -0.02 0.00 0.15 0.00 0.00 42.46 38.32 3g0g s ILE 236 CO 0.02 0.24 -0.19 -1.61 -2.11 0.00 0.00 174.94 171.29 3g0g s GLU 237 N 0.73 2.33 0.13 3.50 2.02 -1.26 -1.40 118.70 124.75 3g0g s GLU 237 Ca 0.43 -0.80 -0.15 0.00 0.02 0.00 0.00 54.97 54.47 3g0g s GLU 237 Cb -0.19 -2.24 0.03 0.00 0.10 0.00 0.00 34.13 31.83 3g0g s GLU 237 CO 0.22 0.60 0.39 1.52 0.02 0.00 0.00 175.26 178.00 3g0g s TYR 238 N -0.70 -0.14 0.26 1.61 -0.85 -0.55 -4.99 117.35 111.99 3g0g s TYR 238 Ca 0.11 -0.19 -0.29 0.00 -0.52 0.00 0.00 57.07 56.18 3g0g s TYR 238 Cb -0.10 0.23 -0.09 0.00 0.38 0.00 0.00 41.96 42.37 3g0g s TYR 238 CO 0.00 -0.70 0.95 -1.12 -1.52 0.00 0.00 175.55 173.16 3g0g s SER 239 N -2.82 7.56 -0.15 -0.18 0.01 -1.26 -0.47 113.70 116.39 3g0g s SER 239 Ca 0.04 1.94 0.01 0.00 1.31 0.00 0.00 55.95 59.26 3g0g s SER 239 Cb 0.02 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.65 3g0g s SER 239 CO -0.11 0.09 -0.19 0.12 0.41 0.00 0.00 173.24 173.56 3g0g s PHE 240 N -1.27 2.72 -0.06 2.43 2.19 0.26 -4.66 117.98 119.58 3g0g s PHE 240 Ca 0.43 -1.21 0.13 0.00 0.33 0.00 0.00 56.93 56.62 3g0g s PHE 240 Cb -0.25 -1.85 -0.23 0.00 -1.31 0.00 0.00 43.02 39.38 3g0g s PHE 240 CO 0.31 -0.55 0.59 0.66 1.83 0.00 0.00 175.22 178.06 3g0g n TYR 241 N 4.07 0.88 -4.98 10.12 4.02 -1.26 -0.20 117.16 129.80 3g0g n TYR 241 Ca -0.20 0.32 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 3g0g n TYR 241 Cb 0.52 -1.16 0.00 0.00 -0.02 0.00 0.00 39.34 38.68 3g0g n TYR 241 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3g0g n SER 242 N -3.00 -2.36 -4.76 7.72 2.88 -1.26 -4.76 113.62 108.07 3g0g n SER 242 Ca -0.19 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 56.96 3g0g n SER 242 Cb 1.06 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.55 3g0g n SER 242 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 3g0g s ASP 243 N -4.00 5.52 0.55 -3.46 1.11 -1.26 -4.89 116.67 110.25 3g0g s ASP 243 Ca 0.00 2.83 0.42 0.00 0.18 0.00 0.00 52.55 55.98 3g0g s ASP 243 Cb 0.00 -2.64 1.62 0.00 1.07 0.00 0.00 42.92 42.96 3g0g s ASP 243 CO 0.00 -1.40 1.70 -0.08 1.18 0.00 0.00 175.17 176.56 3g0g h GLU 244 N 1.82 0.00 0.00 8.23 4.81 -2.05 0.13 114.58 127.53 3g0g h GLU 244 Ca -0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3g0g h GLU 244 Cb 1.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.67 3g0g h GLU 244 CO 0.59 0.00 -0.01 -1.13 -0.73 0.00 0.00 179.01 177.73 3g0g n SER 245 N -4.04 0.09 -4.60 1.04 3.41 -1.26 -4.67 113.62 103.58 3g0g n SER 245 Ca 0.33 0.49 -0.43 0.00 -0.26 0.00 0.00 58.87 59.00 3g0g n SER 245 Cb 1.57 -0.51 -0.02 0.00 -0.26 0.00 0.00 64.21 64.99 3g0g n SER 245 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3g0g s LEU 246 N -3.14 3.64 0.08 1.04 0.20 0.47 -4.92 118.68 116.04 3g0g s LEU 246 Ca 0.14 0.67 -0.16 0.00 0.69 0.00 0.00 54.13 55.46 3g0g s LEU 246 Cb 0.18 -3.55 -0.12 0.00 -0.43 0.00 0.00 46.19 42.28 3g0g s LEU 246 CO 0.54 -1.30 1.35 -0.61 -0.29 0.00 0.00 176.35 176.04 3g0g h GLN 247 N 9.76 0.61 -5.01 1.98 4.15 -1.87 -3.42 115.11 121.30 3g0g h GLN 247 Ca -0.25 -0.37 -0.66 0.00 0.77 0.00 0.00 58.65 58.14 3g0g h GLN 247 Cb 1.08 0.04 -0.27 0.00 0.21 0.00 0.00 27.48 28.54 3g0g h GLN 247 CO 1.10 0.98 -0.72 0.71 -1.93 0.00 0.00 178.83 178.98 3g0g s TYR 248 N -4.14 2.96 0.53 3.99 2.02 -1.26 -5.09 117.35 116.37 3g0g s TYR 248 Ca -0.13 -0.88 -0.21 0.00 -0.37 0.00 0.00 57.07 55.49 3g0g s TYR 248 Cb 0.07 -2.10 -0.07 0.00 -0.40 0.00 0.00 41.96 39.46 3g0g s TYR 248 CO 0.82 -0.51 0.98 -2.30 -1.57 0.00 0.00 175.55 172.98 3g0g n PRO 249 N 4.72 1.11 -2.70 -1.71 -0.02 -1.26 -4.96 135.00 130.19 3g0g n PRO 249 Ca -0.18 0.41 -0.38 0.00 -2.02 0.00 0.00 63.50 61.34 3g0g n PRO 249 Cb 0.51 -2.13 -0.06 0.00 -0.02 0.00 0.00 33.50 31.80 3g0g n PRO 249 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3g0g s LYS 250 N -2.45 4.58 -0.34 -0.52 2.20 0.72 -4.89 119.74 119.03 3g0g s LYS 250 Ca 0.70 1.45 -0.09 0.00 -0.36 0.00 0.00 55.97 57.67 3g0g s LYS 250 Cb -0.47 -2.90 0.02 0.00 -1.51 0.00 0.00 37.83 32.98 3g0g s LYS 250 CO 0.51 0.25 0.16 0.99 -0.36 0.00 0.00 175.35 176.90 3g0g s THR 251 N -1.48 4.35 0.15 3.43 2.01 -1.26 0.92 115.64 123.76 3g0g s THR 251 Ca 0.49 -0.78 -0.27 0.00 0.31 0.00 0.00 61.69 61.44 3g0g s THR 251 Cb -0.22 -3.35 -0.07 0.00 0.01 0.00 0.00 72.50 68.86 3g0g s THR 251 CO 0.28 -0.10 0.84 -0.69 -0.69 0.00 0.00 174.62 174.26 3g0g s VAL 252 N 1.53 4.39 -0.08 3.82 1.01 0.38 -4.91 120.40 126.53 3g0g s VAL 252 Ca 0.02 1.84 0.00 0.00 0.00 0.00 0.00 61.98 63.85 3g0g s VAL 252 Cb -0.18 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 32.01 3g0g s VAL 252 CO 0.05 0.45 -0.07 -0.13 0.00 0.00 0.00 175.10 175.41 3g0g s ARG 253 N -0.75 1.27 -0.04 2.72 0.52 -1.26 -1.48 118.95 119.93 3g0g s ARG 253 Ca 0.39 -0.19 0.03 0.00 -0.52 0.00 0.00 55.73 55.44 3g0g s ARG 253 Cb -0.23 -1.30 0.01 0.00 0.52 0.00 0.00 34.95 33.94 3g0g s ARG 253 CO 0.28 -0.18 -0.11 0.08 0.02 0.00 0.00 175.30 175.38 3g0g s VAL 254 N 1.39 1.00 0.07 3.52 1.01 -0.49 -4.97 120.40 121.93 3g0g s VAL 254 Ca -0.02 -0.45 -0.31 0.00 0.00 0.00 0.00 61.98 61.20 3g0g s VAL 254 Cb -0.13 -0.89 -0.08 0.00 0.00 0.00 0.00 36.38 35.27 3g0g s VAL 254 CO -0.04 0.31 1.61 -2.84 0.00 0.00 0.00 175.10 174.14 3g0g s PRO 255 N 0.31 4.21 -0.27 2.72 0.02 -1.26 -0.79 135.00 139.94 3g0g s PRO 255 Ca -0.06 2.29 -0.01 0.00 0.02 0.00 0.00 61.00 63.24 3g0g s PRO 255 Cb -0.11 -3.54 0.15 0.00 0.02 0.00 0.00 34.50 31.03 3g0g s PRO 255 CO 0.02 -0.70 0.44 -0.47 -0.33 0.00 0.00 177.00 175.96 3g0g s TYR 256 N 2.41 -1.09 -0.34 6.54 6.04 0.07 -4.57 117.35 126.41 3g0g s TYR 256 Ca 0.72 0.93 -0.28 0.00 0.04 0.00 0.00 57.07 58.49 3g0g s TYR 256 Cb -0.39 0.12 0.02 0.00 -1.04 0.00 0.00 41.96 40.66 3g0g s TYR 256 CO 0.32 -0.83 1.01 -1.25 -1.54 0.00 0.00 175.55 173.26 3g0g s PRO 257 N 2.63 3.97 0.70 4.97 0.04 -1.26 -4.57 135.00 141.47 3g0g s PRO 257 Ca 0.14 0.85 -0.07 0.00 0.04 0.00 0.00 61.00 61.95 3g0g s PRO 257 Cb -0.14 -3.77 0.05 0.00 0.04 0.00 0.00 34.50 30.68 3g0g s PRO 257 CO -0.20 -0.93 1.02 0.15 0.04 0.00 0.00 177.00 177.07 3g0g s LYS 258 N 3.61 2.35 0.12 4.56 1.02 -1.26 -1.46 119.74 128.69 3g0g s LYS 258 Ca 0.42 -0.11 -0.35 0.00 0.02 0.00 0.00 55.97 55.95 3g0g s LYS 258 Cb -0.12 -2.15 -0.15 0.00 -0.52 0.00 0.00 37.83 34.89 3g0g s LYS 258 CO 0.17 -1.17 1.52 0.00 -0.92 0.00 0.00 175.35 174.95 3g0g n ALA 259 N -2.91 0.62 -1.00 5.17 0.00 0.10 -1.34 120.51 121.15 3g0g n ALA 259 Ca 0.07 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.97 3g0g n ALA 259 Cb 0.60 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.78 3g0g n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g0g n GLY 260 N 3.18 0.95 3.94 0.00 0.00 -1.26 -4.83 105.19 107.17 3g0g n GLY 260 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 3g0g n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g0g s ALA 261 N -3.79 2.69 0.03 4.61 0.00 -0.45 -4.99 121.76 119.85 3g0g s ALA 261 Ca 0.00 -1.23 -0.30 0.00 0.00 0.00 0.00 51.96 50.43 3g0g s ALA 261 Cb 0.00 -2.61 -0.07 0.00 0.00 0.00 0.00 23.12 20.44 3g0g s ALA 261 CO 0.00 -2.03 1.48 0.08 0.00 0.00 0.00 175.76 175.30 3g0g s VAL 262 N -3.63 3.46 0.31 0.00 1.01 -1.26 -4.92 120.40 115.37 3g0g s VAL 262 Ca 0.70 0.88 -0.07 0.00 0.00 0.00 0.00 61.98 63.49 3g0g s VAL 262 Cb -0.06 -3.57 -0.06 0.00 0.00 0.00 0.00 36.38 32.70 3g0g s VAL 262 CO 0.50 0.00 0.60 0.20 0.00 0.00 0.00 175.10 176.40 3g0g s ASN 263 N 2.01 6.48 0.80 3.32 0.01 -1.26 -4.41 114.94 121.88 3g0g s ASN 263 Ca 0.67 0.83 -0.14 0.00 -0.71 0.00 0.00 52.86 53.51 3g0g s ASN 263 Cb -0.34 -2.19 0.05 0.00 0.41 0.00 0.00 41.25 39.18 3g0g s ASN 263 CO 0.29 -0.23 1.02 -0.81 -1.51 0.00 0.00 177.10 175.86 3g0g n PRO 264 N -0.94 0.21 -4.12 -0.60 -0.04 -1.26 -4.84 135.00 123.41 3g0g n PRO 264 Ca -0.01 0.14 -0.22 0.00 -0.04 0.00 0.00 63.50 63.37 3g0g n PRO 264 Cb 0.54 -2.29 -0.05 0.00 -0.04 0.00 0.00 33.50 31.66 3g0g n PRO 264 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3g0g s THR 265 N -2.07 4.03 0.02 0.52 -4.23 -0.49 -4.91 115.64 108.50 3g0g s THR 265 Ca 0.71 -1.53 0.02 0.00 -1.18 0.00 0.00 61.69 59.71 3g0g s THR 265 Cb -0.30 -3.23 -0.01 0.00 1.34 0.00 0.00 72.50 70.30 3g0g s THR 265 CO 0.53 -0.32 -0.07 0.54 -0.54 0.00 0.00 174.62 174.75 3g0g s VAL 266 N -2.22 0.56 0.06 2.29 0.11 -1.26 -0.81 120.40 119.13 3g0g s VAL 266 Ca 0.34 -0.67 0.04 0.00 -2.93 0.00 0.00 61.98 58.76 3g0g s VAL 266 Cb -0.07 -0.54 -0.03 0.00 -1.53 0.00 0.00 36.38 34.21 3g0g s VAL 266 CO 0.24 -0.10 -0.12 -0.54 -3.33 0.00 0.00 175.10 171.25 3g0g s LYS 267 N -0.84 0.73 -0.09 1.54 1.02 -0.09 -4.97 119.74 117.04 3g0g s LYS 267 Ca -0.03 -0.86 0.04 0.00 0.02 0.00 0.00 55.97 55.14 3g0g s LYS 267 Cb -0.06 -0.67 -0.01 0.00 -0.52 0.00 0.00 37.83 36.57 3g0g s LYS 267 CO 0.00 0.15 -0.22 0.12 -0.92 0.00 0.00 175.35 174.48 3g0g s PHE 268 N -1.25 2.57 0.13 3.18 5.36 -1.26 0.16 117.98 126.87 3g0g s PHE 268 Ca -0.04 -0.80 0.05 0.00 -0.96 0.00 0.00 56.93 55.18 3g0g s PHE 268 Cb -0.10 -1.69 -0.04 0.00 -0.34 0.00 0.00 43.02 40.86 3g0g s PHE 268 CO 0.02 -0.27 -0.12 -0.06 -1.46 0.00 0.00 175.22 173.32 3g0g s PHE 269 N 0.09 1.32 -0.04 10.12 0.40 0.19 -0.58 117.98 129.48 3g0g s PHE 269 Ca -0.10 -0.64 -0.00 0.00 -0.60 0.00 0.00 56.93 55.59 3g0g s PHE 269 Cb -0.16 -0.68 0.03 0.00 0.51 0.00 0.00 43.02 42.72 3g0g s PHE 269 CO 0.06 0.12 0.00 0.08 0.70 0.00 0.00 175.22 176.18 3g0g s VAL 270 N -2.62 0.19 0.06 -0.44 1.01 0.92 -0.93 120.40 118.59 3g0g s VAL 270 Ca 0.12 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.29 3g0g s VAL 270 Cb -0.02 -0.31 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 3g0g s VAL 270 CO 0.02 0.17 -0.18 0.54 0.00 0.00 0.00 175.10 175.65 3g0g s VAL 271 N 1.26 2.81 -0.41 2.92 0.11 0.12 -0.97 120.40 126.22 3g0g s VAL 271 Ca -0.06 -1.25 -0.20 0.00 -2.93 0.00 0.00 61.98 57.54 3g0g s VAL 271 Cb -0.13 -2.20 0.02 0.00 -1.53 0.00 0.00 36.38 32.53 3g0g s VAL 271 CO -0.02 0.29 0.59 0.21 -3.33 0.00 0.00 175.10 172.83 3g0g s ASN 272 N -1.59 6.31 0.21 3.54 3.84 -1.26 -1.06 114.94 124.92 3g0g s ASN 272 Ca 0.15 -0.29 0.26 0.00 0.21 0.00 0.00 52.86 53.19 3g0g s ASN 272 Cb -0.11 -2.30 0.77 0.00 -0.55 0.00 0.00 41.25 39.06 3g0g s ASN 272 CO 0.06 -0.69 1.74 0.35 -2.79 0.00 0.00 177.10 175.78 3g0g n THR 273 N 5.70 0.59 0.17 -5.21 -2.24 0.07 -3.44 114.28 109.91 3g0g n THR 273 Ca -0.03 -0.29 0.04 0.00 -2.27 0.00 0.00 64.05 61.50 3g0g n THR 273 Cb 0.48 -0.55 0.22 0.00 -2.10 0.00 0.00 70.33 68.38 3g0g n THR 273 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3g0g h ASP 274 N 0.00 0.00 -3.42 3.42 3.45 -1.88 -3.35 116.42 114.64 3g0g h ASP 274 Ca 0.00 0.00 -0.67 0.00 0.43 0.00 0.00 57.03 56.79 3g0g h ASP 274 Cb 0.74 0.00 -0.38 0.00 -0.56 0.00 0.00 39.33 39.13 3g0g h ASP 274 CO 0.00 0.44 -0.34 -0.94 -1.57 0.00 0.00 179.24 176.82 3g0g s SER 275 N -6.44 5.35 -0.23 6.45 1.04 -1.22 -5.03 113.70 113.61 3g0g s SER 275 Ca 0.01 -3.63 0.02 0.00 0.48 0.00 0.00 55.95 52.84 3g0g s SER 275 Cb 0.10 -1.78 0.05 0.00 0.10 0.00 0.00 66.02 64.48 3g0g s SER 275 CO 0.71 -0.17 -0.12 -0.76 0.98 0.00 0.00 173.24 173.88 3g0g s LEU 276 N -1.17 2.89 0.01 2.42 1.02 -1.26 -4.90 118.68 117.70 3g0g s LEU 276 Ca 0.25 -1.15 -0.17 0.00 0.02 0.00 0.00 54.13 53.08 3g0g s LEU 276 Cb -0.09 -1.43 -0.06 0.00 0.02 0.00 0.00 46.19 44.63 3g0g s LEU 276 CO -0.12 -0.16 0.49 -0.55 0.02 0.00 0.00 176.35 176.03 3g0g s SER 277 N 1.23 6.90 -0.05 2.29 0.15 -1.26 -4.95 113.70 118.00 3g0g s SER 277 Ca -0.05 1.07 0.11 0.00 0.70 0.00 0.00 55.95 57.78 3g0g s SER 277 Cb -0.18 -2.30 0.41 0.00 -1.71 0.00 0.00 66.02 62.23 3g0g s SER 277 CO -0.07 0.26 1.27 -1.54 1.20 0.00 0.00 173.24 174.35 3g0g n SER 278 N 2.05 2.81 -0.03 5.45 3.41 -1.26 -4.05 113.62 122.00 3g0g n SER 278 Ca -0.11 -2.21 -0.06 0.00 -0.26 0.00 0.00 58.87 56.23 3g0g n SER 278 Cb 0.52 -0.41 -0.02 0.00 -0.26 0.00 0.00 64.21 64.03 3g0g n SER 278 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3g0g n VAL 279 N 0.57 0.33 -4.03 -3.33 0.31 -1.26 -5.05 118.33 105.87 3g0g n VAL 279 Ca 0.15 -0.10 -0.30 0.00 -0.01 0.00 0.00 64.34 64.08 3g0g n VAL 279 Cb 0.53 -1.28 -0.06 0.00 -0.91 0.00 0.00 33.84 32.11 3g0g n VAL 279 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3g0g s THR 280 N -2.11 4.66 0.25 2.52 -1.32 -1.26 -5.09 115.64 113.30 3g0g s THR 280 Ca -0.08 -0.74 -0.30 0.00 -1.21 0.00 0.00 61.69 59.36 3g0g s THR 280 Cb 0.03 -3.26 -0.10 0.00 -1.51 0.00 0.00 72.50 67.65 3g0g s THR 280 CO 0.12 0.10 1.46 0.20 -2.21 0.00 0.00 174.62 174.29 3g0g s ASN 281 N -2.48 6.62 0.21 8.08 0.01 -1.26 -4.43 114.94 121.69 3g0g s ASN 281 Ca 0.30 2.70 -0.32 0.00 -0.71 0.00 0.00 52.86 54.84 3g0g s ASN 281 Cb -0.12 -2.62 -0.12 0.00 0.41 0.00 0.00 41.25 38.80 3g0g s ASN 281 CO 0.23 -0.73 1.69 0.00 -1.51 0.00 0.00 177.10 176.78 3g0g s ALA 282 N -0.01 3.90 -0.23 0.60 0.00 -1.26 -4.98 121.76 119.78 3g0g s ALA 282 Ca 0.60 1.56 -0.18 0.00 0.00 0.00 0.00 51.96 53.94 3g0g s ALA 282 Cb -0.43 -3.68 -0.03 0.00 0.00 0.00 0.00 23.12 18.98 3g0g s ALA 282 CO 0.44 -0.91 0.49 -0.08 0.00 0.00 0.00 175.76 175.70 3g0g s THR 283 N 1.07 5.11 -0.23 0.00 -1.32 -1.26 -4.99 115.64 114.02 3g0g s THR 283 Ca 0.73 0.86 -0.09 0.00 -1.21 0.00 0.00 61.69 61.99 3g0g s THR 283 Cb -0.49 -3.81 -0.04 0.00 -1.51 0.00 0.00 72.50 66.65 3g0g s THR 283 CO 0.33 0.15 0.11 -0.44 -2.21 0.00 0.00 174.62 172.56 3g0g s SER 284 N 1.34 5.75 -0.30 8.08 0.01 -1.26 -4.57 113.70 122.75 3g0g s SER 284 Ca 0.22 0.02 -0.22 0.00 1.31 0.00 0.00 55.95 57.28 3g0g s SER 284 Cb -0.15 -2.03 -0.01 0.00 0.21 0.00 0.00 66.02 64.04 3g0g s SER 284 CO 0.09 0.06 0.71 -0.63 0.41 0.00 0.00 173.24 173.88 3g0g s ILE 285 N 1.05 4.87 0.20 1.44 -1.09 -0.15 -4.85 121.20 122.67 3g0g s ILE 285 Ca 0.06 1.05 -0.30 0.00 -2.23 0.00 0.00 60.65 59.23 3g0g s ILE 285 Cb -0.14 -4.06 -0.08 0.00 -1.58 0.00 0.00 42.46 36.60 3g0g s ILE 285 CO 0.04 -0.17 1.03 -1.58 -1.23 0.00 0.00 174.94 173.03 3g0g s GLN 286 N 2.76 4.69 -0.37 2.79 0.74 -1.26 -0.06 119.66 128.95 3g0g s GLN 286 Ca 0.29 1.63 -0.03 0.00 0.05 0.00 0.00 55.36 57.29 3g0g s GLN 286 Cb -0.15 -3.28 0.08 0.00 1.10 0.00 0.00 33.01 30.77 3g0g s GLN 286 CO 0.12 0.24 0.14 0.42 -0.55 0.00 0.00 175.29 175.66 3g0g s ILE 287 N -0.61 3.32 0.40 -2.34 1.01 0.26 -4.87 121.20 118.36 3g0g s ILE 287 Ca 0.46 -1.73 -0.24 0.00 0.00 0.00 0.00 60.65 59.14 3g0g s ILE 287 Cb -0.28 -3.12 -0.09 0.00 0.01 0.00 0.00 42.46 38.99 3g0g s ILE 287 CO 0.34 -0.46 1.09 0.42 0.00 0.00 0.00 174.94 176.34 3g0g s THR 288 N 1.22 3.50 0.81 2.92 -4.23 -1.26 -4.19 115.64 114.40 3g0g s THR 288 Ca 0.03 1.18 -0.13 0.00 -1.18 0.00 0.00 61.69 61.59 3g0g s THR 288 Cb -0.22 -3.62 0.08 0.00 1.34 0.00 0.00 72.50 70.09 3g0g s THR 288 CO -0.02 0.04 1.20 0.00 -0.54 0.00 0.00 174.62 175.29 3g0g s ALA 289 N -1.57 1.84 0.72 3.99 0.00 -1.26 -4.97 121.76 120.51 3g0g s ALA 289 Ca 0.58 0.81 -0.15 0.00 0.00 0.00 0.00 51.96 53.20 3g0g s ALA 289 Cb -0.25 -3.48 0.04 0.00 0.00 0.00 0.00 23.12 19.42 3g0g s ALA 289 CO 0.31 -2.29 1.21 -1.25 0.00 0.00 0.00 175.76 173.75 3g0g s PRO 290 N -4.19 2.16 0.30 0.00 0.04 -1.26 -4.73 135.00 127.32 3g0g s PRO 290 Ca 0.72 1.79 0.05 0.00 0.04 0.00 0.00 61.00 63.60 3g0g s PRO 290 Cb -0.28 -1.83 0.75 0.00 0.04 0.00 0.00 34.50 33.18 3g0g s PRO 290 CO 0.51 -1.82 1.73 0.00 0.04 0.00 0.00 177.00 177.46 3g0g h ALA 291 N -0.23 1.57 0.00 8.56 0.00 -1.99 0.11 119.26 127.27 3g0g h ALA 291 Ca -0.48 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3g0g h ALA 291 Cb 1.30 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3g0g h ALA 291 CO 0.50 -0.22 0.00 -1.13 0.00 0.00 0.00 179.25 178.40 3g0g n SER 292 N -4.91 0.21 -0.09 0.00 3.41 -1.26 -2.56 113.62 108.42 3g0g n SER 292 Ca 0.23 0.58 -0.11 0.00 -0.26 0.00 0.00 58.87 59.31 3g0g n SER 292 Cb 0.63 -0.61 -0.10 0.00 -0.26 0.00 0.00 64.21 63.86 3g0g n SER 292 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3g0g n MET 293 N -1.76 0.86 0.24 4.33 2.00 0.33 -4.52 117.12 118.60 3g0g n MET 293 Ca 0.01 0.07 0.17 0.00 0.00 0.00 0.00 57.70 57.94 3g0g n MET 293 Cb 0.07 -1.39 0.75 0.00 0.00 0.00 0.00 33.22 32.65 3g0g n MET 293 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 3g0g h LEU 294 N 0.00 0.00 -2.67 4.03 3.38 -1.14 -2.89 115.31 116.03 3g0g h LEU 294 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3g0g h LEU 294 Cb 1.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.52 3g0g h LEU 294 CO -0.04 0.00 0.08 -0.29 0.09 0.00 0.00 178.44 178.28 3g0g h ILE 295 N 0.00 0.00 -1.38 1.22 6.09 -1.77 -3.46 117.51 118.21 3g0g h ILE 295 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 3g0g h ILE 295 Cb 0.31 0.89 0.00 0.00 0.47 0.00 0.00 36.82 38.49 3g0g h ILE 295 CO 0.00 0.00 0.00 0.61 -3.07 0.00 0.00 178.15 175.69 3g0g n GLY 296 N -1.12 2.41 3.77 8.18 0.00 -1.09 -5.15 105.19 112.19 3g0g n GLY 296 Ca -0.03 -0.86 -0.40 0.00 0.00 0.00 0.00 46.02 44.74 3g0g n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3g0g s ASP 297 N 0.65 6.70 0.19 1.61 1.01 -1.26 -4.97 116.67 120.59 3g0g s ASP 297 Ca 0.00 2.53 -0.19 0.00 0.71 0.00 0.00 52.55 55.60 3g0g s ASP 297 Cb 0.00 -2.63 0.04 0.00 1.01 0.00 0.00 42.92 41.33 3g0g s ASP 297 CO 0.00 -0.57 0.55 -1.38 0.21 0.00 0.00 175.17 173.98 3g0g s HIS 298 N -1.24 -0.21 0.01 4.23 -3.43 -1.26 -0.91 115.29 112.47 3g0g s HIS 298 Ca 0.52 -0.11 0.07 0.00 -0.80 0.00 0.00 55.06 54.74 3g0g s HIS 298 Cb -0.36 0.44 -0.02 0.00 -1.43 0.00 0.00 32.58 31.21 3g0g s HIS 298 CO 0.47 -0.92 -0.22 0.71 -2.00 0.00 0.00 174.74 172.78 3g0g s TYR 299 N -3.85 1.98 -0.34 0.38 2.02 0.12 -4.82 117.35 112.85 3g0g s TYR 299 Ca 0.07 -0.38 -0.27 0.00 -0.37 0.00 0.00 57.07 56.13 3g0g s TYR 299 Cb -0.01 -1.24 0.01 0.00 -0.40 0.00 0.00 41.96 40.32 3g0g s TYR 299 CO -0.05 0.02 0.96 -1.17 -1.57 0.00 0.00 175.55 173.74 3g0g s LEU 300 N -0.80 3.99 -0.01 -1.29 2.96 -1.26 -0.59 118.68 121.69 3g0g s LEU 300 Ca 0.09 0.78 0.13 0.00 -0.22 0.00 0.00 54.13 54.90 3g0g s LEU 300 Cb -0.09 -3.33 -0.16 0.00 0.50 0.00 0.00 46.19 43.11 3g0g s LEU 300 CO 0.00 -0.82 0.45 0.00 -1.32 0.00 0.00 176.35 174.67 3g0g s ASP 302 N -2.59 -0.63 -0.07 0.00 -1.08 -1.08 -4.89 116.67 106.33 3g0g s ASP 302 Ca 0.02 1.01 -0.00 0.00 -0.52 0.00 0.00 52.55 53.06 3g0g s ASP 302 Cb 0.09 0.98 0.02 0.00 -1.46 0.00 0.00 42.92 42.56 3g0g s ASP 302 CO 0.52 -0.36 -0.03 -0.69 0.52 0.00 0.00 175.17 175.12 3g0g s VAL 303 N -0.28 0.56 -0.08 1.11 1.01 -1.26 -0.93 120.40 120.53 3g0g s VAL 303 Ca -0.05 -0.05 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 3g0g s VAL 303 Cb -0.03 -0.65 0.04 0.00 0.00 0.00 0.00 36.38 35.75 3g0g s VAL 303 CO 0.04 0.27 0.15 -0.89 0.00 0.00 0.00 175.10 174.67 3g0g s THR 304 N 1.54 -0.22 0.18 3.92 2.01 -0.18 -5.02 115.64 117.88 3g0g s THR 304 Ca -0.01 0.34 -0.30 0.00 0.31 0.00 0.00 61.69 62.04 3g0g s THR 304 Cb -0.13 -0.27 -0.08 0.00 0.01 0.00 0.00 72.50 72.03 3g0g s THR 304 CO -0.04 0.14 1.08 0.26 -0.69 0.00 0.00 174.62 175.37 3g0g s TRP 305 N 2.14 3.64 -0.27 4.92 0.52 -1.26 0.46 118.94 129.09 3g0g s TRP 305 Ca 0.02 1.65 -0.14 0.00 0.02 0.00 0.00 56.10 57.65 3g0g s TRP 305 Cb -0.12 -3.23 -0.11 0.00 -1.15 0.00 0.00 33.47 28.85 3g0g s TRP 305 CO -0.05 -0.45 -0.35 0.00 0.02 0.00 0.00 176.95 176.11 3g0g n ALA 306 N 2.25 1.20 -3.07 0.98 0.00 0.13 -4.90 120.51 117.11 3g0g n ALA 306 Ca 0.02 -1.06 0.00 0.00 0.00 0.00 0.00 53.44 52.40 3g0g n ALA 306 Cb 0.46 0.14 0.00 0.00 0.00 0.00 0.00 19.45 20.05 3g0g n ALA 306 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3g0g n THR 307 N -4.25 0.00 0.58 0.00 -2.24 -0.84 -4.67 114.28 102.86 3g0g n THR 307 Ca -0.50 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.40 3g0g n THR 307 Cb 0.85 0.00 0.45 0.00 -2.10 0.00 0.00 70.33 69.53 3g0g n THR 307 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g0g n GLN 308 N 0.00 0.18 0.00 -0.78 1.13 -1.26 -3.82 117.38 112.84 3g0g n GLN 308 Ca 0.00 0.26 0.00 0.00 -1.94 0.00 0.00 57.00 55.32 3g0g n GLN 308 Cb 0.00 -1.76 0.00 0.00 0.11 0.00 0.00 30.24 28.59 3g0g n GLN 308 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3g0g n GLU 309 N -2.10 0.06 -4.38 -1.09 1.02 -1.26 -4.89 120.64 108.01 3g0g n GLU 309 Ca 0.04 -0.41 -0.25 0.00 -0.02 0.00 0.00 57.16 56.53 3g0g n GLU 309 Cb 0.33 -0.52 -0.17 0.00 -0.02 0.00 0.00 31.44 31.07 3g0g n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3g0g s ARG 310 N -0.02 1.61 0.01 3.49 3.52 -1.25 -1.09 118.95 125.23 3g0g s ARG 310 Ca 0.00 -0.36 0.06 0.00 -0.13 0.00 0.00 55.73 55.31 3g0g s ARG 310 Cb 0.00 -1.43 -0.02 0.00 -1.56 0.00 0.00 34.95 31.94 3g0g s ARG 310 CO 0.00 -0.06 -0.19 -1.50 -0.81 0.00 0.00 175.30 172.74 3g0g s ILE 311 N 0.96 1.53 -0.06 4.11 2.07 0.00 0.19 121.20 130.00 3g0g s ILE 311 Ca -0.09 -0.98 0.03 0.00 -1.41 0.00 0.00 60.65 58.20 3g0g s ILE 311 Cb -0.15 -1.31 -0.03 0.00 0.13 0.00 0.00 42.46 41.11 3g0g s ILE 311 CO 0.00 0.31 -0.13 -0.94 -1.91 0.00 0.00 174.94 172.27 3g0g s SER 312 N -0.78 4.12 -0.05 4.50 1.04 0.17 0.27 113.70 122.97 3g0g s SER 312 Ca 0.07 -0.18 0.03 0.00 0.48 0.00 0.00 55.95 56.35 3g0g s SER 312 Cb -0.08 -0.98 0.00 0.00 0.10 0.00 0.00 66.02 65.07 3g0g s SER 312 CO 0.00 0.33 -0.15 -0.76 0.98 0.00 0.00 173.24 173.64 3g0g s LEU 313 N -0.62 1.83 -0.13 2.42 1.02 -0.56 -1.01 118.68 121.63 3g0g s LEU 313 Ca 0.09 -0.32 -0.04 0.00 0.02 0.00 0.00 54.13 53.88 3g0g s LEU 313 Cb -0.11 -0.88 -0.04 0.00 0.02 0.00 0.00 46.19 45.18 3g0g s LEU 313 CO 0.01 0.11 0.03 -1.10 0.02 0.00 0.00 176.35 175.42 3g0g s GLN 314 N 0.24 3.44 0.11 1.70 -0.21 -0.11 -0.35 119.66 124.48 3g0g s GLN 314 Ca -0.07 -0.38 0.09 0.00 0.02 0.00 0.00 55.36 55.02 3g0g s GLN 314 Cb -0.12 -2.98 -0.04 0.00 1.00 0.00 0.00 33.01 30.87 3g0g s GLN 314 CO 0.03 0.51 -0.21 -1.58 -2.12 0.00 0.00 175.29 171.91 3g0g s TRP 315 N -0.33 1.86 -0.03 0.91 0.52 0.13 -0.34 118.94 121.66 3g0g s TRP 315 Ca 0.08 -0.42 0.01 0.00 0.02 0.00 0.00 56.10 55.79 3g0g s TRP 315 Cb -0.12 -1.00 0.02 0.00 -1.15 0.00 0.00 33.47 31.21 3g0g s TRP 315 CO 0.02 0.24 -0.04 -1.17 0.02 0.00 0.00 176.95 176.02 3g0g s LEU 316 N -2.01 1.42 0.62 2.99 0.20 0.25 -0.83 118.68 121.31 3g0g s LEU 316 Ca 0.08 -0.11 -0.17 0.00 0.69 0.00 0.00 54.13 54.62 3g0g s LEU 316 Cb -0.10 -0.39 -0.02 0.00 -0.43 0.00 0.00 46.19 45.25 3g0g s LEU 316 CO 0.05 -0.04 1.17 -0.13 -0.29 0.00 0.00 176.35 177.10 3g0g s ARG 317 N 0.74 2.89 0.34 1.98 0.52 -0.60 0.11 118.95 124.93 3g0g s ARG 317 Ca -0.09 1.66 0.08 0.00 -0.52 0.00 0.00 55.73 56.85 3g0g s ARG 317 Cb -0.13 -1.94 0.77 0.00 0.52 0.00 0.00 34.95 34.18 3g0g s ARG 317 CO -0.00 -1.23 1.87 -0.09 0.02 0.00 0.00 175.30 175.86 3g0g h ARG 318 N 0.56 0.72 -6.26 3.54 2.43 -1.36 -2.89 114.38 111.12 3g0g h ARG 318 Ca -0.49 -0.04 -0.54 0.00 -0.81 0.00 0.00 59.98 58.10 3g0g h ARG 318 Cb 1.28 -0.16 -0.07 0.00 -0.42 0.00 0.00 29.97 30.59 3g0g h ARG 318 CO 0.54 0.48 1.14 0.42 -1.51 0.00 0.00 179.97 181.04 3g0g s ILE 319 N -5.72 3.68 0.00 1.20 1.01 -1.26 -4.83 121.20 115.27 3g0g s ILE 319 Ca -0.10 0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.79 3g0g s ILE 319 Cb 0.22 -4.77 0.00 0.00 0.01 0.00 0.00 42.46 37.92 3g0g s ILE 319 CO 0.79 -1.71 1.26 0.00 0.00 0.00 0.00 174.94 175.28 3g0g n GLN 320 N 9.29 0.75 -0.36 2.79 6.02 -1.09 -3.74 117.38 131.04 3g0g n GLN 320 Ca 0.10 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.16 3g0g n GLN 320 Cb 0.50 -1.12 0.22 0.00 1.02 0.00 0.00 30.24 30.86 3g0g n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3g0g n ASN 321 N 1.31 3.57 -3.62 1.08 0.23 -1.26 -1.64 115.26 114.93 3g0g n ASN 321 Ca 0.00 -2.68 -0.09 0.00 -0.53 0.00 0.00 54.58 51.27 3g0g n ASN 321 Cb 0.38 -0.44 -0.10 0.00 -2.08 0.00 0.00 39.78 37.54 3g0g n ASN 321 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 3g0g s TYR 322 N -2.23 -0.74 0.12 -2.53 5.04 -1.25 -2.64 117.35 113.13 3g0g s TYR 322 Ca 0.36 1.35 0.05 0.00 -2.44 0.00 0.00 57.07 56.39 3g0g s TYR 322 Cb 0.27 0.21 -0.04 0.00 0.35 0.00 0.00 41.96 42.75 3g0g s TYR 322 CO 0.11 -0.49 -0.13 -1.54 -1.34 0.00 0.00 175.55 172.17 3g0g s SER 323 N 2.57 1.85 -0.03 4.32 1.04 -0.70 -1.55 113.70 121.20 3g0g s SER 323 Ca 0.00 -0.84 0.02 0.00 0.48 0.00 0.00 55.95 55.61 3g0g s SER 323 Cb -0.12 -0.04 0.01 0.00 0.10 0.00 0.00 66.02 65.96 3g0g s SER 323 CO -0.12 -0.20 -0.06 -0.69 0.98 0.00 0.00 173.24 173.15 3g0g s VAL 324 N -2.37 0.63 -0.23 5.02 1.01 -0.01 -2.39 120.40 122.04 3g0g s VAL 324 Ca 0.09 -0.23 -0.07 0.00 0.00 0.00 0.00 61.98 61.77 3g0g s VAL 324 Cb -0.03 -0.60 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 3g0g s VAL 324 CO 0.02 0.22 0.06 -0.32 0.00 0.00 0.00 175.10 175.08 3g0g s MET 325 N 0.52 3.67 0.07 2.72 1.75 0.15 -0.69 119.30 127.50 3g0g s MET 325 Ca -0.07 -0.47 -0.19 0.00 -1.25 0.00 0.00 55.69 53.70 3g0g s MET 325 Cb -0.11 -3.27 -0.07 0.00 2.84 0.00 0.00 34.83 34.23 3g0g s MET 325 CO 0.00 -0.11 0.57 -0.51 -0.65 0.00 0.00 175.02 174.32 3g0g s ASP 326 N 1.39 7.06 -0.26 1.11 -0.00 0.52 -1.95 116.67 124.54 3g0g s ASP 326 Ca 0.05 1.25 -0.05 0.00 -0.00 0.00 0.00 52.55 53.80 3g0g s ASP 326 Cb -0.15 -2.36 0.00 0.00 -0.00 0.00 0.00 42.92 40.42 3g0g s ASP 326 CO 0.03 0.27 0.02 -0.63 -0.00 0.00 0.00 175.17 174.87 3g0g s ILE 327 N -1.12 3.65 -0.13 0.77 1.09 -1.26 -1.50 121.20 122.71 3g0g s ILE 327 Ca 0.29 -0.66 -0.00 0.00 -1.10 0.00 0.00 60.65 59.18 3g0g s ILE 327 Cb -0.19 -2.81 -0.02 0.00 -1.06 0.00 0.00 42.46 38.38 3g0g s ILE 327 CO 0.19 0.21 -0.13 0.00 -0.10 0.00 0.00 174.94 175.11 3g0g s ASP 329 N 0.28 4.30 0.19 0.00 1.11 0.53 -0.82 116.67 122.26 3g0g s ASP 329 Ca -0.10 -0.17 -0.30 0.00 0.18 0.00 0.00 52.55 52.16 3g0g s ASP 329 Cb -0.16 -1.25 -0.08 0.00 1.07 0.00 0.00 42.92 42.50 3g0g s ASP 329 CO 0.05 0.28 1.28 -0.47 1.18 0.00 0.00 175.17 177.50 3g0g s TYR 330 N -0.35 3.30 -0.20 4.23 5.04 -0.25 -0.70 117.35 128.43 3g0g s TYR 330 Ca 0.04 1.26 -0.07 0.00 -2.44 0.00 0.00 57.07 55.86 3g0g s TYR 330 Cb -0.12 -3.56 -0.04 0.00 0.35 0.00 0.00 41.96 38.59 3g0g s TYR 330 CO 0.02 -1.73 0.05 0.34 -1.34 0.00 0.00 175.55 172.89 3g0g s ASP 331 N 0.36 5.34 -0.03 4.32 -1.08 0.98 -4.94 116.67 121.62 3g0g s ASP 331 Ca 0.56 -0.04 -0.09 0.00 -0.52 0.00 0.00 52.55 52.46 3g0g s ASP 331 Cb -0.35 -1.92 -0.05 0.00 -1.46 0.00 0.00 42.92 39.14 3g0g s ASP 331 CO 0.37 0.11 0.46 -0.33 0.52 0.00 0.00 175.17 176.30 3g0g h GLU 332 N 7.19 -0.30 -1.98 4.34 4.39 -1.96 -0.36 114.58 125.90 3g0g h GLU 332 Ca -0.36 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.36 3g0g h GLU 332 Cb 1.17 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 3g0g h GLU 332 CO 0.65 -0.20 0.00 -1.13 -1.16 0.00 0.00 179.01 177.17 3g0g n SER 333 N -4.12 4.64 0.00 1.42 3.41 -1.26 -2.86 113.62 114.85 3g0g n SER 333 Ca -0.04 -2.22 0.00 0.00 -0.26 0.00 0.00 58.87 56.35 3g0g n SER 333 Cb 0.12 -0.98 0.00 0.00 -0.26 0.00 0.00 64.21 63.10 3g0g n SER 333 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3g0g n SER 334 N 1.54 0.00 -0.91 4.04 3.41 -1.26 -5.05 113.62 115.39 3g0g n SER 334 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 3g0g n SER 334 Cb 0.44 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.36 3g0g n SER 334 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g0g n GLY 335 N -0.27 0.66 3.89 5.00 0.00 -0.15 -5.03 105.19 109.29 3g0g n GLY 335 Ca 0.00 -0.54 -0.27 0.00 0.00 0.00 0.00 46.02 45.22 3g0g n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g0g s ARG 336 N -3.52 2.25 -0.08 1.61 0.52 -1.21 -4.90 118.95 113.61 3g0g s ARG 336 Ca 0.00 -2.05 0.04 0.00 -0.52 0.00 0.00 55.73 53.20 3g0g s ARG 336 Cb 0.00 -2.04 -0.01 0.00 0.52 0.00 0.00 34.95 33.42 3g0g s ARG 336 CO 0.00 -0.58 -0.22 -1.58 0.02 0.00 0.00 175.30 172.94 3g0g s TRP 337 N -2.78 2.56 -0.08 -0.53 0.52 -1.26 -0.01 118.94 117.35 3g0g s TRP 337 Ca 0.31 -0.80 0.05 0.00 0.02 0.00 0.00 56.10 55.68 3g0g s TRP 337 Cb -0.02 -1.68 -0.01 0.00 -1.15 0.00 0.00 33.47 30.62 3g0g s TRP 337 CO 0.19 -0.27 -0.24 -0.80 0.02 0.00 0.00 176.95 175.85 3g0g s ASN 338 N 0.07 3.10 -0.35 2.95 0.02 0.13 -4.88 114.94 115.98 3g0g s ASN 338 Ca -0.10 -0.53 0.02 0.00 -1.02 0.00 0.00 52.86 51.23 3g0g s ASN 338 Cb -0.15 -1.13 0.11 0.00 0.02 0.00 0.00 41.25 40.09 3g0g s ASN 338 CO 0.06 0.20 0.10 0.00 0.02 0.00 0.00 177.10 177.48 3g0g s LEU 340 N 1.03 4.44 0.65 0.00 1.02 -1.26 -4.90 118.68 119.67 3g0g s LEU 340 Ca 0.12 2.62 0.43 0.00 0.02 0.00 0.00 54.13 57.31 3g0g s LEU 340 Cb -0.19 -3.64 2.32 0.00 0.02 0.00 0.00 46.19 44.70 3g0g s LEU 340 CO -0.13 -0.50 2.35 0.58 0.02 0.00 0.00 176.35 178.66 3g0g h VAL 341 N 3.13 0.06 0.00 -1.59 2.07 -1.98 -0.19 116.25 117.75 3g0g h VAL 341 Ca -0.48 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3g0g h VAL 341 Cb 1.22 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 3g0g h VAL 341 CO 0.67 0.00 -0.29 0.00 0.02 0.00 0.00 177.57 177.98 3g0g n ALA 342 N -2.11 2.60 0.64 1.67 0.00 -1.26 -3.64 120.51 118.41 3g0g n ALA 342 Ca -0.03 -0.13 0.12 0.00 0.00 0.00 0.00 53.44 53.40 3g0g n ALA 342 Cb 0.08 -1.33 0.21 0.00 0.00 0.00 0.00 19.45 18.42 3g0g n ALA 342 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3g0g n ARG 343 N -2.15 2.35 -2.55 0.00 1.74 -0.09 -4.83 116.66 111.13 3g0g n ARG 343 Ca 0.05 -2.02 -0.38 0.00 -0.77 0.00 0.00 57.85 54.73 3g0g n ARG 343 Cb 0.43 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.34 3g0g n ARG 343 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3g0g s GLN 344 N -1.68 4.39 -0.05 5.56 -0.21 -1.21 -4.26 119.66 122.20 3g0g s GLN 344 Ca 0.35 1.59 0.05 0.00 0.02 0.00 0.00 55.36 57.36 3g0g s GLN 344 Cb 0.21 -2.81 -0.00 0.00 1.00 0.00 0.00 33.01 31.41 3g0g s GLN 344 CO 0.31 0.04 -0.19 -1.01 -2.12 0.00 0.00 175.29 172.32 3g0g s HIS 345 N -1.47 1.89 -0.22 0.91 3.76 -0.82 -4.95 115.29 114.39 3g0g s HIS 345 Ca 0.52 -0.56 -0.04 0.00 -0.15 0.00 0.00 55.06 54.83 3g0g s HIS 345 Cb -0.25 -1.27 -0.01 0.00 1.11 0.00 0.00 32.58 32.16 3g0g s HIS 345 CO 0.32 -0.19 -0.04 0.42 -0.85 0.00 0.00 174.74 174.39 3g0g s ILE 346 N 0.02 3.39 -0.20 0.60 1.01 -1.26 -0.67 121.20 124.08 3g0g s ILE 346 Ca -0.05 -0.49 -0.04 0.00 0.00 0.00 0.00 60.65 60.07 3g0g s ILE 346 Cb -0.12 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.79 3g0g s ILE 346 CO 0.03 0.43 -0.02 -0.70 0.00 0.00 0.00 174.94 174.67 3g0g s GLU 347 N 1.42 3.51 0.24 2.79 2.12 -1.01 -5.02 118.70 122.75 3g0g s GLU 347 Ca 0.05 -0.57 0.02 0.00 0.36 0.00 0.00 54.97 54.83 3g0g s GLU 347 Cb -0.14 -3.03 -0.04 0.00 0.26 0.00 0.00 34.13 31.18 3g0g s GLU 347 CO -0.03 -0.05 0.18 0.00 -0.54 0.00 0.00 175.26 174.81 3g0g s MET 348 N 1.14 1.37 -0.09 4.30 0.23 -1.26 -1.73 119.30 123.27 3g0g s MET 348 Ca 0.02 -1.75 -0.07 0.00 -1.03 0.00 0.00 55.69 52.87 3g0g s MET 348 Cb -0.15 0.29 0.03 0.00 -1.53 0.00 0.00 34.83 33.47 3g0g s MET 348 CO 0.00 -0.47 0.22 0.45 -2.03 0.00 0.00 175.02 173.20 3g0g s SER 349 N -3.23 -0.23 -0.05 -1.18 0.15 -1.08 -4.96 113.70 103.11 3g0g s SER 349 Ca 0.40 0.46 0.21 0.00 0.70 0.00 0.00 55.95 57.71 3g0g s SER 349 Cb 0.06 0.42 -0.30 0.00 -1.71 0.00 0.00 66.02 64.49 3g0g s SER 349 CO 0.17 -0.11 0.42 0.35 1.20 0.00 0.00 173.24 175.28 3g0g n THR 350 N 3.40 0.37 1.02 6.45 -2.24 -1.26 -4.38 114.28 117.64 3g0g n THR 350 Ca -0.17 -0.59 0.11 0.00 -2.27 0.00 0.00 64.05 61.13 3g0g n THR 350 Cb 0.56 -0.14 -0.00 0.00 -2.10 0.00 0.00 70.33 68.65 3g0g n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3g0g n THR 351 N -2.40 0.00 -0.54 4.28 -2.24 -1.26 -5.04 114.28 107.07 3g0g n THR 351 Ca -0.10 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3g0g n THR 351 Cb 0.71 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.87 3g0g n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g0g n GLY 352 N 1.47 1.91 3.99 3.38 0.00 -1.26 -4.83 105.19 109.85 3g0g n GLY 352 Ca 0.06 -0.11 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 3g0g n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3g0g s TRP 353 N 0.09 2.72 -0.17 1.61 -2.14 -1.26 -4.58 118.94 115.20 3g0g s TRP 353 Ca 0.00 -0.20 -0.08 0.00 2.66 0.00 0.00 56.10 58.48 3g0g s TRP 353 Cb 0.00 -2.60 -0.04 0.00 -3.10 0.00 0.00 33.47 27.73 3g0g s TRP 353 CO 0.00 -0.75 0.09 0.54 -2.66 0.00 0.00 176.95 174.17 3g0g s VAL 354 N -2.62 5.07 0.00 -0.66 0.11 -0.65 -4.77 120.40 116.88 3g0g s VAL 354 Ca 0.57 0.06 0.00 0.00 -2.93 0.00 0.00 61.98 59.68 3g0g s VAL 354 Cb -0.10 -3.27 0.00 0.00 -1.53 0.00 0.00 36.38 31.48 3g0g s VAL 354 CO 0.37 0.49 0.00 0.61 -3.33 0.00 0.00 175.10 173.23 3g0g n GLY 355 N 3.20 -0.62 0.43 6.54 0.00 -1.26 -3.58 105.19 109.89 3g0g n GLY 355 Ca -0.17 -1.69 -0.17 0.00 0.00 0.00 0.00 46.02 44.00 3g0g n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3g0g h ARG 356 N 0.00 -1.02 0.00 1.61 3.08 -1.94 -3.41 114.38 112.70 3g0g h ARG 356 Ca 0.00 0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 3g0g h ARG 356 Cb 0.00 0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 3g0g h ARG 356 CO 0.00 -0.67 -1.03 1.19 -1.07 0.00 0.00 179.97 178.39 3g0g n PHE 357 N -5.48 0.00 -3.71 3.04 3.72 -1.26 -4.89 117.46 108.88 3g0g n PHE 357 Ca -0.13 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.15 3g0g n PHE 357 Cb 0.42 -0.02 -0.07 0.00 -0.94 0.00 0.00 39.48 38.88 3g0g n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 3g0g s ARG 358 N -2.02 0.88 0.34 -1.08 1.70 -1.26 -5.04 118.95 112.46 3g0g s ARG 358 Ca -0.00 -0.45 -0.27 0.00 -0.47 0.00 0.00 55.73 54.54 3g0g s ARG 358 Cb 0.00 0.38 -0.13 0.00 -0.57 0.00 0.00 34.95 34.64 3g0g s ARG 358 CO 0.02 -0.29 1.03 -2.30 -1.08 0.00 0.00 175.30 172.67 3g0g n PRO 359 N 0.50 1.42 -1.47 3.89 -0.02 -1.23 -4.42 135.00 133.67 3g0g n PRO 359 Ca -0.18 0.50 -0.34 0.00 -2.02 0.00 0.00 63.50 61.46 3g0g n PRO 359 Cb 0.60 -1.95 0.09 0.00 -0.02 0.00 0.00 33.50 32.22 3g0g n PRO 359 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3g0g s SER 360 N -0.59 4.33 0.09 2.55 0.15 -1.26 -4.95 113.70 114.02 3g0g s SER 360 Ca 0.60 2.27 -0.23 0.00 0.70 0.00 0.00 55.95 59.28 3g0g s SER 360 Cb -0.64 -2.58 -0.07 0.00 -1.71 0.00 0.00 66.02 61.02 3g0g s SER 360 CO 0.59 -2.16 0.69 -1.83 1.20 0.00 0.00 173.24 171.73 3g0g s GLU 361 N -3.99 4.42 0.25 5.44 1.03 -1.26 -4.92 118.70 119.67 3g0g s GLU 361 Ca 0.72 0.97 -0.23 0.00 0.03 0.00 0.00 54.97 56.46 3g0g s GLU 361 Cb -0.27 -3.29 -0.09 0.00 -0.80 0.00 0.00 34.13 29.68 3g0g s GLU 361 CO 0.45 0.50 0.81 -1.25 -1.33 0.00 0.00 175.26 174.43 3g0g s PRO 362 N -0.75 4.42 -0.31 -4.83 0.04 -1.26 -4.65 135.00 127.65 3g0g s PRO 362 Ca 0.34 1.07 0.01 0.00 0.04 0.00 0.00 61.00 62.46 3g0g s PRO 362 Cb -0.21 -2.91 0.07 0.00 0.04 0.00 0.00 34.50 31.49 3g0g s PRO 362 CO 0.22 0.38 0.01 -1.01 0.04 0.00 0.00 177.00 176.65 3g0g s HIS 363 N -1.50 3.42 0.41 0.56 3.76 0.44 -4.93 115.29 117.44 3g0g s HIS 363 Ca 0.44 -2.31 -0.20 0.00 -0.15 0.00 0.00 55.06 52.85 3g0g s HIS 363 Cb -0.18 -2.39 -0.10 0.00 1.11 0.00 0.00 32.58 31.01 3g0g s HIS 363 CO 0.23 -0.88 0.90 -0.06 -0.85 0.00 0.00 174.74 174.08 3g0g s PHE 364 N 1.12 3.33 1.02 1.40 0.40 -1.26 -1.39 117.98 122.59 3g0g s PHE 364 Ca -0.01 1.52 -0.12 0.00 -0.60 0.00 0.00 56.93 57.72 3g0g s PHE 364 Cb -0.20 -2.78 0.20 0.00 0.51 0.00 0.00 43.02 40.75 3g0g s PHE 364 CO -0.04 -0.07 1.08 0.95 0.70 0.00 0.00 175.22 177.84 3g0g s THR 365 N -2.15 2.18 0.18 0.64 -4.23 0.75 -4.90 115.64 108.11 3g0g s THR 365 Ca 0.60 0.06 -0.12 0.00 -1.18 0.00 0.00 61.69 61.05 3g0g s THR 365 Cb -0.09 -2.43 0.10 0.00 1.34 0.00 0.00 72.50 71.42 3g0g s THR 365 CO 0.14 -0.08 1.80 0.25 -0.54 0.00 0.00 174.62 176.20 3g0g h LEU 366 N -2.01 0.78 -0.46 4.79 5.85 -1.92 -1.27 115.31 121.09 3g0g h LEU 366 Ca -0.55 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.09 3g0g h LEU 366 Cb 1.32 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3g0g h LEU 366 CO 0.55 0.64 0.00 -0.90 -0.34 0.00 0.00 178.44 178.39 3g0g n ASP 367 N -4.56 0.57 -0.99 1.25 3.85 -1.26 -4.86 116.55 110.55 3g0g n ASP 367 Ca 0.05 0.62 -0.12 0.00 -0.71 0.00 0.00 54.79 54.63 3g0g n ASP 367 Cb 0.08 -0.75 -0.04 0.00 -1.35 0.00 0.00 41.12 39.06 3g0g n ASP 367 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3g0g n GLY 368 N 0.28 1.10 0.44 6.12 0.00 -0.48 -4.87 105.19 107.79 3g0g n GLY 368 Ca 0.03 -0.46 0.12 0.00 0.00 0.00 0.00 46.02 45.71 3g0g n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3g0g n ASN 369 N 0.01 1.76 -3.84 1.61 3.02 -1.26 -4.90 115.26 111.66 3g0g n ASN 369 Ca -0.12 -1.35 -0.12 0.00 -0.03 0.00 0.00 54.58 52.96 3g0g n ASN 369 Cb 0.43 0.34 -0.09 0.00 -0.61 0.00 0.00 39.78 39.84 3g0g n ASN 369 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3g0g s SER 370 N -2.45 -0.03 0.19 6.41 0.01 -1.26 -1.32 113.70 115.25 3g0g s SER 370 Ca 0.21 -0.17 -0.09 0.00 1.31 0.00 0.00 55.95 57.22 3g0g s SER 370 Cb 0.19 0.25 -0.01 0.00 0.21 0.00 0.00 66.02 66.66 3g0g s SER 370 CO 0.54 -0.43 0.31 0.72 0.41 0.00 0.00 173.24 174.78 3g0g s PHE 371 N -1.64 0.49 -0.02 2.43 -0.12 -0.96 -0.18 117.98 117.99 3g0g s PHE 371 Ca -0.12 -0.84 0.06 0.00 -0.05 0.00 0.00 56.93 55.98 3g0g s PHE 371 Cb -0.06 -0.07 -0.02 0.00 -0.63 0.00 0.00 43.02 42.25 3g0g s PHE 371 CO 0.01 -0.77 -0.21 0.71 -0.05 0.00 0.00 175.22 174.91 3g0g s TYR 372 N -4.01 1.92 -0.03 3.49 2.02 -0.49 -0.26 117.35 120.00 3g0g s TYR 372 Ca 0.21 -0.39 -0.14 0.00 -0.37 0.00 0.00 57.07 56.39 3g0g s TYR 372 Cb 0.03 -1.24 0.02 0.00 -0.40 0.00 0.00 41.96 40.37 3g0g s TYR 372 CO 0.04 -0.05 0.30 -1.59 -1.57 0.00 0.00 175.55 172.68 3g0g s LYS 373 N -0.45 0.61 0.00 -0.62 -2.85 -0.97 -0.42 119.74 115.04 3g0g s LYS 373 Ca 0.07 -0.10 -0.30 0.00 -1.00 0.00 0.00 55.97 54.64 3g0g s LYS 373 Cb -0.09 0.27 -0.05 0.00 -2.06 0.00 0.00 37.83 35.90 3g0g s LYS 373 CO -0.00 -0.16 1.37 0.42 0.10 0.00 0.00 175.35 177.08 3g0g s ILE 374 N -1.09 3.76 0.07 3.79 1.01 -1.26 -1.51 121.20 125.97 3g0g s ILE 374 Ca -0.11 1.15 0.00 0.00 0.00 0.00 0.00 60.65 61.69 3g0g s ILE 374 Cb -0.05 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 3g0g s ILE 374 CO 0.03 0.01 -0.05 0.27 0.00 0.00 0.00 174.94 175.20 3g0g s ILE 375 N 2.27 0.43 0.26 2.92 -4.36 0.38 -4.51 121.20 118.60 3g0g s ILE 375 Ca 0.63 -1.81 -0.30 0.00 -0.26 0.00 0.00 60.65 58.91 3g0g s ILE 375 Cb -0.31 -1.52 -0.09 0.00 1.25 0.00 0.00 42.46 41.79 3g0g s ILE 375 CO 0.26 -0.91 1.07 -0.94 0.24 0.00 0.00 174.94 174.66 3g0g s SER 376 N -2.88 7.35 0.57 4.36 1.04 -1.26 -0.35 113.70 122.53 3g0g s SER 376 Ca 0.08 2.19 0.00 0.00 0.48 0.00 0.00 55.95 58.70 3g0g s SER 376 Cb 0.06 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.55 3g0g s SER 376 CO -0.07 -0.08 0.00 -0.46 0.98 0.00 0.00 173.24 173.61 3g0g n ASN 377 N 1.34 0.00 -0.07 7.02 0.23 0.37 -4.87 115.26 119.27 3g0g n ASN 377 Ca -0.01 -0.76 -0.03 0.00 -0.53 0.00 0.00 54.58 53.25 3g0g n ASN 377 Cb 0.45 0.00 0.20 0.00 -2.08 0.00 0.00 39.78 38.36 3g0g n ASN 377 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3g0g h GLU 378 N 0.00 0.69 -0.03 -3.83 9.09 -1.97 -2.45 114.58 116.08 3g0g h GLU 378 Ca 0.00 -0.18 0.00 0.00 0.05 0.00 0.00 59.36 59.23 3g0g h GLU 378 Cb 0.00 -0.09 0.00 0.00 -1.65 0.00 0.00 28.75 27.01 3g0g h GLU 378 CO 0.00 0.72 0.00 -0.85 0.05 0.00 0.00 179.01 178.93 3g0g n GLU 379 N -4.23 1.48 -0.13 1.06 0.28 -1.26 -4.93 120.64 112.92 3g0g n GLU 379 Ca 0.02 -0.71 0.00 0.00 -0.16 0.00 0.00 57.16 56.31 3g0g n GLU 379 Cb 0.29 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.69 3g0g n GLU 379 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3g0g n GLY 380 N 1.11 0.69 3.89 -1.84 0.00 -0.92 -4.83 105.19 103.29 3g0g n GLY 380 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3g0g n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g0g s TYR 381 N -2.17 3.54 -0.27 1.61 1.51 -1.26 -0.74 117.35 119.57 3g0g s TYR 381 Ca 0.00 0.51 -0.24 0.00 -1.01 0.00 0.00 57.07 56.33 3g0g s TYR 381 Cb 0.00 -1.95 -0.00 0.00 -0.11 0.00 0.00 41.96 39.89 3g0g s TYR 381 CO 0.00 0.56 0.79 1.03 -1.11 0.00 0.00 175.55 176.81 3g0g s ARG 382 N -2.15 4.09 0.27 -0.62 0.52 -1.26 0.14 118.95 119.94 3g0g s ARG 382 Ca 0.33 0.75 0.03 0.00 -0.52 0.00 0.00 55.73 56.32 3g0g s ARG 382 Cb -0.13 -3.68 -0.04 0.00 0.52 0.00 0.00 34.95 31.63 3g0g s ARG 382 CO 0.21 -0.57 0.19 -1.01 0.02 0.00 0.00 175.30 174.14 3g0g s HIS 383 N 2.84 1.46 -0.17 -0.53 3.76 0.53 -1.27 115.29 121.91 3g0g s HIS 383 Ca 0.33 -1.48 -0.20 0.00 -0.15 0.00 0.00 55.06 53.56 3g0g s HIS 383 Cb -0.15 -0.67 -0.03 0.00 1.11 0.00 0.00 32.58 32.84 3g0g s HIS 383 CO 0.09 -0.70 0.58 0.42 -0.85 0.00 0.00 174.74 174.29 3g0g s ILE 384 N -3.80 5.07 -0.09 0.60 1.01 -1.26 -0.47 121.20 122.26 3g0g s ILE 384 Ca 0.39 1.11 -0.02 0.00 0.00 0.00 0.00 60.65 62.12 3g0g s ILE 384 Cb 0.05 -3.90 -0.03 0.00 0.01 0.00 0.00 42.46 38.58 3g0g s ILE 384 CO 0.19 0.18 0.02 0.00 0.00 0.00 0.00 174.94 175.32 3g0g s TYR 386 N -0.88 3.48 0.10 0.00 6.04 0.53 -2.30 117.35 124.32 3g0g s TYR 386 Ca 0.13 0.57 0.10 0.00 0.04 0.00 0.00 57.07 57.92 3g0g s TYR 386 Cb -0.11 -2.29 -0.04 0.00 -1.04 0.00 0.00 41.96 38.48 3g0g s TYR 386 CO 0.02 0.30 -0.26 -0.06 -1.54 0.00 0.00 175.55 174.02 3g0g s PHE 387 N 0.27 2.21 -0.18 4.97 0.08 0.64 -2.45 117.98 123.53 3g0g s PHE 387 Ca 0.16 -0.39 -0.06 0.00 0.12 0.00 0.00 56.93 56.76 3g0g s PHE 387 Cb -0.13 -1.24 -0.03 0.00 -0.57 0.00 0.00 43.02 41.05 3g0g s PHE 387 CO 0.03 0.26 0.02 -0.65 -0.10 0.00 0.00 175.22 174.78 3g0g s GLN 388 N -1.79 3.78 0.36 0.44 -1.52 -1.26 -2.26 119.66 117.41 3g0g s GLN 388 Ca 0.12 -0.45 0.18 0.00 -1.95 0.00 0.00 55.36 53.26 3g0g s GLN 388 Cb -0.10 -3.09 1.24 0.00 -0.22 0.00 0.00 33.01 30.84 3g0g s GLN 388 CO 0.05 0.18 1.61 0.82 -0.25 0.00 0.00 175.29 177.70 3g0g h ILE 389 N 5.11 0.12 0.00 1.08 1.08 -1.55 -1.62 117.51 121.73 3g0g h ILE 389 Ca -0.35 -0.04 -0.23 0.00 -0.39 0.00 0.00 64.86 63.85 3g0g h ILE 389 Cb 1.18 -0.02 -0.04 0.00 -3.07 0.00 0.00 36.82 34.87 3g0g h ILE 389 CO 0.65 0.02 -1.54 0.47 -0.69 0.00 0.00 178.15 177.06 3g0g n ASP 390 N -5.18 0.88 -4.80 1.72 8.00 -1.26 -4.61 116.55 111.29 3g0g n ASP 390 Ca 0.35 0.40 -0.38 0.00 0.71 0.00 0.00 54.79 55.88 3g0g n ASP 390 Cb 1.16 0.03 -0.06 0.00 -0.02 0.00 0.00 41.12 42.23 3g0g n ASP 390 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3g0g s LYS 391 N -2.77 4.00 0.30 -1.24 1.02 -0.61 -4.88 119.74 115.57 3g0g s LYS 391 Ca -0.04 0.29 0.00 0.00 0.02 0.00 0.00 55.97 56.25 3g0g s LYS 391 Cb 0.08 -3.29 0.48 0.00 -0.52 0.00 0.00 37.83 34.58 3g0g s LYS 391 CO 0.82 0.53 1.86 -0.22 -0.92 0.00 0.00 175.35 177.42 3g0g h LYS 392 N 5.44 0.77 -6.90 1.68 1.63 -1.91 -3.40 116.57 113.87 3g0g h LYS 392 Ca -0.48 -0.14 -0.47 0.00 -0.85 0.00 0.00 60.65 58.70 3g0g h LYS 392 Cb 1.20 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 32.69 3g0g h LYS 392 CO 0.66 0.68 0.21 -0.51 -3.45 0.00 0.00 179.45 177.03 3g0g s ASP 393 N -6.60 6.77 0.04 4.20 -0.00 -1.26 -5.01 116.67 114.81 3g0g s ASP 393 Ca -0.09 1.41 0.04 0.00 -0.00 0.00 0.00 52.55 53.91 3g0g s ASP 393 Cb 0.16 -2.43 -0.02 0.00 -0.00 0.00 0.00 42.92 40.62 3g0g s ASP 393 CO 0.79 -0.33 -0.12 0.00 -0.00 0.00 0.00 175.17 175.51 3g0g s THR 395 N -0.96 5.31 0.16 0.00 -4.23 -1.03 -4.87 115.64 110.03 3g0g s THR 395 Ca -0.01 0.15 -0.30 0.00 -1.18 0.00 0.00 61.69 60.34 3g0g s THR 395 Cb -0.08 -3.37 -0.07 0.00 1.34 0.00 0.00 72.50 70.32 3g0g s THR 395 CO 0.01 0.52 1.04 -0.36 -0.54 0.00 0.00 174.62 175.29 3g0g s PHE 396 N -0.20 3.69 -0.29 3.99 0.08 -1.26 -0.35 117.98 123.65 3g0g s PHE 396 Ca 0.10 1.69 0.11 0.00 0.12 0.00 0.00 56.93 58.95 3g0g s PHE 396 Cb -0.12 -3.18 -0.15 0.00 -0.57 0.00 0.00 43.02 39.00 3g0g s PHE 396 CO 0.01 -0.27 0.37 0.44 -0.10 0.00 0.00 175.22 175.67 3g0g n ILE 397 N 2.44 0.00 -4.35 0.64 -5.35 -0.27 -4.94 119.36 107.52 3g0g n ILE 397 Ca 0.02 -0.25 -0.26 0.00 -0.27 0.00 0.00 62.75 61.99 3g0g n ILE 397 Cb 0.47 0.65 -0.12 0.00 -1.74 0.00 0.00 39.64 38.89 3g0g n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3g0g s THR 398 N -2.40 2.05 0.08 7.28 -4.23 -1.25 -4.92 115.64 112.24 3g0g s THR 398 Ca 0.00 -1.75 -0.05 0.00 -1.18 0.00 0.00 61.69 58.72 3g0g s THR 398 Cb 0.08 -1.86 -0.02 0.00 1.34 0.00 0.00 72.50 72.04 3g0g s THR 398 CO 0.47 -0.04 0.08 -0.54 -0.54 0.00 0.00 174.62 174.05 3g0g s LYS 399 N -2.19 0.76 0.00 3.99 -0.14 -1.26 -4.56 119.74 116.34 3g0g s LYS 399 Ca 0.13 -1.13 0.00 0.00 -1.36 0.00 0.00 55.97 53.61 3g0g s LYS 399 Cb -0.09 0.28 0.00 0.00 -1.68 0.00 0.00 37.83 36.33 3g0g s LYS 399 CO 0.06 -0.20 0.00 0.41 -0.76 0.00 0.00 175.35 174.86 3g0g n GLY 400 N 0.01 2.35 2.72 -3.33 0.00 -1.26 -4.90 105.19 100.78 3g0g n GLY 400 Ca -0.13 -2.01 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 3g0g n GLY 400 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g0g n THR 401 N -1.47 5.00 -3.71 2.61 -2.24 -1.26 -4.81 114.28 108.40 3g0g n THR 401 Ca 0.00 -4.75 -0.05 0.00 -2.27 0.00 0.00 64.05 56.98 3g0g n THR 401 Cb 0.00 -2.13 0.02 0.00 -2.10 0.00 0.00 70.33 66.12 3g0g n THR 401 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 3g0g n TRP 402 N 2.31 -1.62 -4.01 4.78 4.27 -1.26 -5.02 117.44 116.90 3g0g n TRP 402 Ca 0.47 -1.22 -0.12 0.00 -3.89 0.00 0.00 57.50 52.74 3g0g n TRP 402 Cb 0.30 0.60 -0.12 0.00 -1.36 0.00 0.00 31.31 30.73 3g0g n TRP 402 CO 0.00 0.00 0.00 -1.21 -2.29 0.00 0.00 177.69 174.19 3g0g s GLU 403 N -2.05 0.33 -0.10 -2.67 2.02 -1.26 -4.46 118.70 110.50 3g0g s GLU 403 Ca 0.15 -0.46 -0.28 0.00 0.02 0.00 0.00 54.97 54.40 3g0g s GLU 403 Cb -0.03 -0.10 -0.02 0.00 0.10 0.00 0.00 34.13 34.08 3g0g s GLU 403 CO 0.07 0.01 0.95 0.08 0.02 0.00 0.00 175.26 176.39 3g0g s VAL 404 N -0.94 4.83 0.06 2.63 1.01 -0.39 -2.64 120.40 124.96 3g0g s VAL 404 Ca -0.08 1.93 0.03 0.00 0.00 0.00 0.00 61.98 63.85 3g0g s VAL 404 Cb -0.07 -4.26 -0.24 0.00 0.00 0.00 0.00 36.38 31.81 3g0g s VAL 404 CO -0.00 0.04 1.04 0.40 0.00 0.00 0.00 175.10 176.58 3g0g h ILE 405 N 5.06 1.39 0.00 2.22 1.08 -1.05 -3.46 117.51 122.75 3g0g h ILE 405 Ca -0.32 -3.08 0.00 0.00 -0.39 0.00 0.00 64.86 61.07 3g0g h ILE 405 Cb 1.15 2.78 0.00 0.00 -3.07 0.00 0.00 36.82 37.68 3g0g h ILE 405 CO 0.83 0.84 0.00 0.61 -0.69 0.00 0.00 178.15 179.75 3g0g n GLY 406 N 1.50 1.50 3.69 5.37 0.00 -1.16 -5.00 105.19 111.09 3g0g n GLY 406 Ca -0.09 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 3g0g n GLY 406 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g0g s ILE 407 N -1.53 4.89 -0.24 -0.61 1.01 -1.26 -1.55 121.20 121.91 3g0g s ILE 407 Ca 0.00 1.71 0.02 0.00 0.00 0.00 0.00 60.65 62.38 3g0g s ILE 407 Cb 0.00 -4.17 -0.16 0.00 0.01 0.00 0.00 42.46 38.14 3g0g s ILE 407 CO 0.00 0.08 -0.20 -0.62 0.00 0.00 0.00 174.94 174.20 3g0g n GLU 408 N 4.78 0.61 -3.70 2.79 -0.58 -0.19 -4.99 120.64 119.37 3g0g n GLU 408 Ca 0.04 0.13 -0.14 0.00 -0.42 0.00 0.00 57.16 56.78 3g0g n GLU 408 Cb 0.49 -1.48 -0.09 0.00 -0.57 0.00 0.00 31.44 29.80 3g0g n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3g0g s ALA 409 N -2.48 -1.22 -0.17 0.62 0.00 -1.17 -4.91 121.76 112.43 3g0g s ALA 409 Ca -0.31 1.33 0.01 0.00 0.00 0.00 0.00 51.96 52.99 3g0g s ALA 409 Cb 0.08 -0.72 0.02 0.00 0.00 0.00 0.00 23.12 22.50 3g0g s ALA 409 CO 0.56 -0.24 -0.19 -1.17 0.00 0.00 0.00 175.76 174.72 3g0g s LEU 410 N 0.10 2.00 0.00 0.00 2.96 -1.26 -0.46 118.68 122.01 3g0g s LEU 410 Ca -0.01 -0.60 0.01 0.00 -0.22 0.00 0.00 54.13 53.31 3g0g s LEU 410 Cb -0.03 -1.39 0.01 0.00 0.50 0.00 0.00 46.19 45.27 3g0g s LEU 410 CO 0.01 -0.01 0.05 0.35 -1.32 0.00 0.00 176.35 175.44 3g0g n THR 411 N 4.60 0.00 -0.09 3.68 -2.24 0.23 -5.03 114.28 115.43 3g0g n THR 411 Ca -0.20 -0.97 0.01 0.00 -2.27 0.00 0.00 64.05 60.62 3g0g n THR 411 Cb 0.50 0.04 0.30 0.00 -2.10 0.00 0.00 70.33 69.07 3g0g n THR 411 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3g0g h SER 412 N 0.43 0.65 0.00 3.42 0.87 -2.00 -3.34 113.55 113.58 3g0g h SER 412 Ca -0.17 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 3g0g h SER 412 Cb 0.53 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 3g0g h SER 412 CO 0.27 0.55 -0.16 -0.90 -0.53 0.00 0.00 176.83 176.06 3g0g n ASP 413 N -4.38 0.81 -4.02 6.23 3.85 -1.26 -4.96 116.55 112.81 3g0g n ASP 413 Ca 0.04 -0.40 -0.13 0.00 -0.71 0.00 0.00 54.79 53.59 3g0g n ASP 413 Cb 0.12 0.97 -0.12 0.00 -1.35 0.00 0.00 41.12 40.73 3g0g n ASP 413 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 3g0g s TYR 414 N -1.13 0.55 -0.12 2.11 1.51 -1.25 -1.40 117.35 117.61 3g0g s TYR 414 Ca 0.00 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.68 3g0g s TYR 414 Cb 0.00 -0.34 -0.01 0.00 -0.11 0.00 0.00 41.96 41.50 3g0g s TYR 414 CO 0.00 -0.08 -0.14 -1.17 -1.11 0.00 0.00 175.55 173.05 3g0g s LEU 415 N -1.17 2.64 -0.12 -1.29 0.20 -0.84 -0.60 118.68 117.50 3g0g s LEU 415 Ca -0.08 -0.35 -0.05 0.00 0.69 0.00 0.00 54.13 54.35 3g0g s LEU 415 Cb -0.08 -1.58 -0.04 0.00 -0.43 0.00 0.00 46.19 44.06 3g0g s LEU 415 CO 0.00 0.17 0.07 -0.31 -0.29 0.00 0.00 176.35 176.00 3g0g s TYR 416 N 0.29 3.36 0.05 5.38 2.02 0.39 -0.25 117.35 128.59 3g0g s TYR 416 Ca -0.11 0.32 -0.14 0.00 -0.37 0.00 0.00 57.07 56.77 3g0g s TYR 416 Cb -0.16 -1.90 0.02 0.00 -0.40 0.00 0.00 41.96 39.52 3g0g s TYR 416 CO 0.06 0.53 0.32 1.52 -1.57 0.00 0.00 175.55 176.41 3g0g s TYR 417 N -0.74 -0.13 -0.09 2.71 -0.85 0.16 -1.02 117.35 117.39 3g0g s TYR 417 Ca 0.12 -0.02 -0.03 0.00 -0.52 0.00 0.00 57.07 56.62 3g0g s TYR 417 Cb -0.12 0.12 -0.04 0.00 0.38 0.00 0.00 41.96 42.30 3g0g s TYR 417 CO 0.03 -0.53 0.05 0.42 -1.52 0.00 0.00 175.55 174.00 3g0g s ILE 418 N -2.66 4.73 0.25 -3.49 1.01 -0.59 0.02 121.20 120.47 3g0g s ILE 418 Ca -0.04 -0.11 -0.13 0.00 0.00 0.00 0.00 60.65 60.37 3g0g s ILE 418 Cb -0.00 -3.03 -0.00 0.00 0.01 0.00 0.00 42.46 39.44 3g0g s ILE 418 CO -0.04 0.59 0.50 -0.94 0.00 0.00 0.00 174.94 175.06 3g0g s SER 419 N -0.98 -0.09 -0.50 3.58 1.04 -0.94 -0.38 113.70 115.43 3g0g s SER 419 Ca 0.14 -0.91 0.02 0.00 0.48 0.00 0.00 55.95 55.68 3g0g s SER 419 Cb -0.12 0.60 0.47 0.00 0.10 0.00 0.00 66.02 67.07 3g0g s SER 419 CO 0.04 -1.17 1.70 -0.46 0.98 0.00 0.00 173.24 174.32 3g0g n ASN 420 N -0.42 6.26 0.10 7.02 0.23 -1.08 -2.06 115.26 125.30 3g0g n ASN 420 Ca -0.02 -3.77 -0.17 0.00 -0.53 0.00 0.00 54.58 50.10 3g0g n ASN 420 Cb 0.62 -0.73 -0.14 0.00 -2.08 0.00 0.00 39.78 37.45 3g0g n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3g0g h GLU 421 N 1.97 0.29 -6.04 -3.83 4.81 -1.83 -3.31 114.58 106.64 3g0g h GLU 421 Ca 0.50 -0.49 -0.64 0.00 -0.13 0.00 0.00 59.36 58.60 3g0g h GLU 421 Cb 1.20 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.75 3g0g h GLU 421 CO 1.21 1.22 1.37 0.98 -0.73 0.00 0.00 179.01 183.06 3g0g n TYR 422 N -3.53 1.82 -1.17 0.92 -0.00 -1.26 -0.94 117.16 112.99 3g0g n TYR 422 Ca -0.10 0.14 -0.06 0.00 -0.00 0.00 0.00 57.90 57.88 3g0g n TYR 422 Cb 1.03 -2.60 -0.03 0.00 -0.00 0.00 0.00 39.34 37.75 3g0g n TYR 422 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 3g0g n LYS 423 N 8.01 -0.74 -2.42 2.98 4.76 -1.26 -3.16 118.16 126.34 3g0g n LYS 423 Ca 0.35 0.61 -0.20 0.00 -2.87 0.00 0.00 58.31 56.20 3g0g n LYS 423 Cb 0.29 -4.42 -0.01 0.00 -1.84 0.00 0.00 35.03 29.06 3g0g n LYS 423 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3g0g n GLY 424 N -1.61 -0.46 3.46 0.72 0.00 -0.12 -4.98 105.19 102.21 3g0g n GLY 424 Ca -0.06 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 3g0g n GLY 424 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g0g s MET 425 N -5.04 2.97 0.19 1.61 -1.94 -1.19 -4.95 119.30 110.96 3g0g s MET 425 Ca 0.02 -1.03 0.20 0.00 -1.71 0.00 0.00 55.69 53.17 3g0g s MET 425 Cb -0.01 -3.98 0.86 0.00 2.01 0.00 0.00 34.83 33.71 3g0g s MET 425 CO 0.02 -0.76 1.60 -2.30 -0.01 0.00 0.00 175.02 173.57 3g0g n PRO 426 N 5.17 0.13 -0.02 2.03 -0.02 -1.26 -2.19 135.00 138.84 3g0g n PRO 426 Ca -0.11 0.42 0.12 0.00 -2.02 0.00 0.00 63.50 61.92 3g0g n PRO 426 Cb 0.47 -1.78 0.23 0.00 -0.02 0.00 0.00 33.50 32.40 3g0g n PRO 426 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g0g n GLY 427 N -0.32 0.77 3.92 -1.23 0.00 -1.26 -4.89 105.19 102.19 3g0g n GLY 427 Ca 0.02 -0.62 -0.27 0.00 0.00 0.00 0.00 46.02 45.15 3g0g n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g0g s GLY 428 N -1.95 1.65 -0.07 -0.02 0.00 -0.93 -2.98 107.32 103.02 3g0g s GLY 428 Ca 0.32 -0.76 -0.03 0.00 0.00 0.00 0.00 44.72 44.25 3g0g s GLY 428 CO 0.31 -0.68 0.07 0.50 0.00 0.00 0.00 173.10 173.30 3g0g s ARG 429 N -3.77 -0.05 0.13 2.90 1.81 0.34 -4.05 118.95 116.26 3g0g s ARG 429 Ca 0.41 0.29 0.06 0.00 -1.72 0.00 0.00 55.73 54.77 3g0g s ARG 429 Cb -0.10 -0.77 -0.04 0.00 -0.45 0.00 0.00 34.95 33.59 3g0g s ARG 429 CO 0.32 -0.40 -0.14 -0.80 -0.68 0.00 0.00 175.30 173.60 3g0g s ASN 430 N 2.17 2.05 -0.10 0.23 -0.87 -0.88 0.03 114.94 117.57 3g0g s ASN 430 Ca 0.04 -0.86 -0.18 0.00 -1.57 0.00 0.00 52.86 50.30 3g0g s ASN 430 Cb -0.13 -0.07 -0.04 0.00 -0.02 0.00 0.00 41.25 40.99 3g0g s ASN 430 CO -0.04 -0.17 0.47 -0.22 -2.57 0.00 0.00 177.10 174.57 3g0g s LEU 431 N -2.63 4.31 0.01 0.60 2.96 -1.26 -2.21 118.68 120.47 3g0g s LEU 431 Ca 0.11 0.84 0.06 0.00 -0.22 0.00 0.00 54.13 54.92 3g0g s LEU 431 Cb -0.04 -2.68 -0.02 0.00 0.50 0.00 0.00 46.19 43.95 3g0g s LEU 431 CO 0.03 0.05 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.63 3g0g s TYR 432 N 0.36 1.53 -0.16 5.38 2.02 0.10 -0.79 117.35 125.79 3g0g s TYR 432 Ca 0.26 -0.32 -0.04 0.00 -0.37 0.00 0.00 57.07 56.59 3g0g s TYR 432 Cb -0.15 -0.95 -0.03 0.00 -0.40 0.00 0.00 41.96 40.43 3g0g s TYR 432 CO 0.11 0.02 -0.04 0.21 -1.57 0.00 0.00 175.55 174.28 3g0g s LYS 433 N -0.78 3.66 -0.21 -0.62 2.20 -0.38 -0.67 119.74 122.93 3g0g s LYS 433 Ca 0.06 -0.53 0.01 0.00 -0.36 0.00 0.00 55.97 55.16 3g0g s LYS 433 Cb -0.07 -2.92 0.03 0.00 -1.51 0.00 0.00 37.83 33.36 3g0g s LYS 433 CO 0.00 0.22 -0.16 -1.50 -0.36 0.00 0.00 175.35 173.56 3g0g s ILE 434 N 0.42 2.17 -0.09 5.43 2.07 0.65 -1.72 121.20 130.14 3g0g s ILE 434 Ca -0.04 -1.17 -0.29 0.00 -1.41 0.00 0.00 60.65 57.74 3g0g s ILE 434 Cb -0.14 -2.05 -0.07 0.00 0.13 0.00 0.00 42.46 40.33 3g0g s ILE 434 CO 0.03 0.32 2.00 -1.58 -1.91 0.00 0.00 174.94 173.80 3g0g s GLN 435 N 1.23 3.74 0.39 3.50 0.74 -0.79 -2.00 119.66 126.47 3g0g s GLN 435 Ca 0.00 2.27 0.15 0.00 0.05 0.00 0.00 55.36 57.82 3g0g s GLN 435 Cb -0.16 -4.22 0.81 0.00 1.10 0.00 0.00 33.01 30.55 3g0g s GLN 435 CO -0.10 -1.41 1.85 -0.07 -0.55 0.00 0.00 175.29 175.02 3g0g h LEU 436 N 12.34 0.00 -0.52 3.68 4.07 -1.59 -2.55 115.31 130.75 3g0g h LEU 436 Ca -0.44 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.49 3g0g h LEU 436 Cb 1.22 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.96 3g0g h LEU 436 CO 0.96 0.33 -0.13 0.77 -1.08 0.00 0.00 178.44 179.29 3g0g h SER 437 N 0.00 0.00 -1.90 -0.43 4.64 -1.90 -3.43 113.55 110.53 3g0g h SER 437 Ca -0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 3g0g h SER 437 Cb 0.62 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.41 3g0g h SER 437 CO 0.04 0.13 -0.50 -0.62 -0.87 0.00 0.00 176.83 175.02 3g0g s ASP 438 N -6.14 0.35 0.00 4.97 3.68 -0.96 -5.05 116.67 113.52 3g0g s ASP 438 Ca 0.04 0.09 0.13 0.00 2.13 0.00 0.00 52.55 54.94 3g0g s ASP 438 Cb 0.07 1.07 0.60 0.00 -1.45 0.00 0.00 42.92 43.21 3g0g s ASP 438 CO 0.65 -0.31 1.37 -1.22 0.13 0.00 0.00 175.17 175.79 3g0g n TYR 439 N 5.36 0.00 0.32 -5.34 4.01 -1.21 -2.09 117.16 118.21 3g0g n TYR 439 Ca -0.03 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.83 3g0g n TYR 439 Cb 0.50 -0.40 0.11 0.00 -0.31 0.00 0.00 39.34 39.24 3g0g n TYR 439 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 3g0g h THR 440 N 0.00 0.00 -1.90 -0.72 2.02 -1.91 -3.42 112.91 106.98 3g0g h THR 440 Ca 0.00 -0.78 -0.67 0.00 0.77 0.00 0.00 66.41 65.73 3g0g h THR 440 Cb 0.17 1.40 -0.15 0.00 -1.74 0.00 0.00 68.15 67.84 3g0g h THR 440 CO 0.00 0.00 1.18 -0.75 0.37 0.00 0.00 175.52 176.32 3g0g s LYS 441 N -3.25 3.68 -0.14 6.66 2.47 -0.89 -4.96 119.74 123.31 3g0g s LYS 441 Ca 0.04 -1.68 -0.00 0.00 -1.56 0.00 0.00 55.97 52.76 3g0g s LYS 441 Cb 0.10 -5.10 -0.01 0.00 -1.46 0.00 0.00 37.83 31.36 3g0g s LYS 441 CO 0.74 -1.93 -0.13 0.08 0.16 0.00 0.00 175.35 174.26 3g0g s VAL 442 N 3.33 2.97 -0.12 4.02 1.01 -1.26 -1.89 120.40 128.46 3g0g s VAL 442 Ca 0.39 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.72 3g0g s VAL 442 Cb -0.03 -2.25 0.00 0.00 0.00 0.00 0.00 36.38 34.11 3g0g s VAL 442 CO -0.07 0.52 -0.22 -0.89 0.00 0.00 0.00 175.10 174.43 3g0g s THR 443 N 0.46 2.15 -0.37 3.92 2.01 -0.70 -4.97 115.64 118.12 3g0g s THR 443 Ca -0.10 -0.98 -0.26 0.00 0.31 0.00 0.00 61.69 60.67 3g0g s THR 443 Cb -0.16 -1.84 0.02 0.00 0.01 0.00 0.00 72.50 70.53 3g0g s THR 443 CO 0.05 0.55 0.94 0.00 -0.69 0.00 0.00 174.62 175.47 3g0g n LEU 445 N 6.83 0.31 0.00 0.00 4.77 0.03 -4.33 117.00 124.61 3g0g n LEU 445 Ca 0.07 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 3g0g n LEU 445 Cb 0.48 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3g0g n LEU 445 CO 0.59 0.07 -0.12 -1.54 -1.33 0.00 0.00 177.39 175.06 3g0g n SER 446 N -1.32 1.19 -0.19 -1.43 3.41 -1.24 -4.87 113.62 109.17 3g0g n SER 446 Ca 0.09 -0.12 -0.00 0.00 -0.26 0.00 0.00 58.87 58.58 3g0g n SER 446 Cb 0.32 0.47 0.08 0.00 -0.26 0.00 0.00 64.21 64.82 3g0g n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g0g n GLU 448 N -5.25 2.32 -0.07 0.00 4.71 -1.26 -4.20 120.64 116.88 3g0g n GLU 448 Ca 0.08 -2.01 -0.07 0.00 -0.01 0.00 0.00 57.16 55.15 3g0g n GLU 448 Cb 0.32 -1.47 -0.00 0.00 -1.01 0.00 0.00 31.44 29.28 3g0g n GLU 448 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 3g0g h LEU 449 N 4.54 -0.04 -5.08 -4.62 3.38 -1.87 -3.38 115.31 108.25 3g0g h LEU 449 Ca 0.00 0.05 -0.20 0.00 0.09 0.00 0.00 57.88 57.82 3g0g h LEU 449 Cb 0.98 0.08 -0.17 0.00 0.09 0.00 0.00 40.66 41.64 3g0g h LEU 449 CO 0.00 0.02 -0.53 -3.20 0.09 0.00 0.00 178.44 174.82 3g0g n ASN 450 N -5.11 -3.05 0.32 -0.43 2.85 -1.26 -5.05 115.26 103.52 3g0g n ASN 450 Ca -0.00 -3.04 0.20 0.00 -0.11 0.00 0.00 54.58 51.63 3g0g n ASN 450 Cb 0.13 1.64 1.09 0.00 1.24 0.00 0.00 39.78 43.88 3g0g n ASN 450 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3g0g h PRO 451 N 4.63 0.00 0.01 1.20 0.13 -1.75 0.82 132.00 137.04 3g0g h PRO 451 Ca -0.01 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.12 3g0g h PRO 451 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3g0g h PRO 451 CO 0.15 0.01 -0.00 0.93 -0.23 0.00 0.00 178.00 178.86 3g0g h GLU 452 N 0.00 -0.01 0.00 0.86 5.08 -1.96 -3.38 114.58 115.17 3g0g h GLU 452 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3g0g h GLU 452 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 3g0g h GLU 452 CO 0.00 0.79 -1.16 2.89 -1.00 0.00 0.00 179.01 180.52 3g0g n ARG 453 N -4.70 0.37 -4.00 2.33 1.85 -0.96 -4.64 116.66 106.90 3g0g n ARG 453 Ca -0.09 -0.01 -0.31 0.00 -1.00 0.00 0.00 57.85 56.44 3g0g n ARG 453 Cb 0.39 -1.61 -0.16 0.00 -1.05 0.00 0.00 32.46 30.03 3g0g n ARG 453 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3g0g n GLN 455 N 4.65 0.00 -3.75 0.00 6.02 0.91 -4.43 117.38 120.78 3g0g n GLN 455 Ca -0.14 -0.13 -0.28 0.00 -0.01 0.00 0.00 57.00 56.44 3g0g n GLN 455 Cb 0.46 -0.47 -0.16 0.00 1.02 0.00 0.00 30.24 31.08 3g0g n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 3g0g s TYR 456 N 0.00 1.10 -0.02 1.08 6.14 -1.04 -0.51 117.35 124.10 3g0g s TYR 456 Ca 0.00 -0.88 0.06 0.00 0.64 0.00 0.00 57.07 56.89 3g0g s TYR 456 Cb 0.00 -1.05 -0.01 0.00 0.42 0.00 0.00 41.96 41.32 3g0g s TYR 456 CO 0.00 -0.61 -0.19 0.71 0.64 0.00 0.00 175.55 176.10 3g0g s TYR 457 N 1.83 1.72 0.39 4.97 2.02 0.10 -0.72 117.35 127.67 3g0g s TYR 457 Ca -0.01 -0.35 0.07 0.00 -0.37 0.00 0.00 57.07 56.41 3g0g s TYR 457 Cb -0.17 -1.11 -0.08 0.00 -0.40 0.00 0.00 41.96 40.20 3g0g s TYR 457 CO -0.08 -0.05 -0.00 -1.54 -1.57 0.00 0.00 175.55 172.31 3g0g s SER 458 N -0.39 3.73 0.04 2.29 1.04 -0.04 -4.56 113.70 115.81 3g0g s SER 458 Ca 0.06 -1.34 -0.02 0.00 0.48 0.00 0.00 55.95 55.13 3g0g s SER 458 Cb -0.08 -0.37 -0.03 0.00 0.10 0.00 0.00 66.02 65.65 3g0g s SER 458 CO -0.00 -0.43 -0.00 0.54 0.98 0.00 0.00 173.24 174.33 3g0g s VAL 459 N -2.75 0.18 -0.27 5.02 0.11 -1.26 -1.23 120.40 120.20 3g0g s VAL 459 Ca 0.35 -1.48 -0.03 0.00 -2.93 0.00 0.00 61.98 57.89 3g0g s VAL 459 Cb 0.09 -1.14 0.11 0.00 -1.53 0.00 0.00 36.38 33.90 3g0g s VAL 459 CO 0.17 -0.82 0.19 -0.55 -3.33 0.00 0.00 175.10 170.77 3g0g s SER 460 N -2.48 2.63 0.36 3.54 0.15 -0.54 -4.97 113.70 112.39 3g0g s SER 460 Ca 0.00 -0.97 -0.22 0.00 0.70 0.00 0.00 55.95 55.46 3g0g s SER 460 Cb 0.03 0.01 -0.10 0.00 -1.71 0.00 0.00 66.02 64.25 3g0g s SER 460 CO -0.07 -0.41 0.91 -0.36 1.20 0.00 0.00 173.24 174.51 3g0g s PHE 461 N 2.21 3.48 1.02 3.44 0.40 -1.26 -0.60 117.98 126.67 3g0g s PHE 461 Ca 0.08 1.61 -0.12 0.00 -0.60 0.00 0.00 56.93 57.90 3g0g s PHE 461 Cb -0.15 -2.82 0.20 0.00 0.51 0.00 0.00 43.02 40.75 3g0g s PHE 461 CO -0.31 0.06 1.09 -1.54 0.70 0.00 0.00 175.22 175.22 3g0g s SER 462 N -1.94 2.44 0.28 1.36 1.04 -0.36 -4.82 113.70 111.70 3g0g s SER 462 Ca 0.55 1.22 0.07 0.00 0.48 0.00 0.00 55.95 58.27 3g0g s SER 462 Cb -0.13 -1.89 0.82 0.00 0.10 0.00 0.00 66.02 64.91 3g0g s SER 462 CO 0.18 -3.25 1.34 1.17 0.98 0.00 0.00 173.24 173.66 3g0g n LYS 463 N -4.26 -0.06 -0.21 4.02 4.81 -1.12 -0.15 118.16 121.19 3g0g n LYS 463 Ca 0.05 1.24 0.07 0.00 -0.87 0.00 0.00 58.31 58.80 3g0g n LYS 463 Cb 0.57 -2.06 0.16 0.00 0.02 0.00 0.00 35.03 33.72 3g0g n LYS 463 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3g0g n GLU 464 N -5.12 2.55 -2.33 1.64 4.71 -1.26 -4.98 120.64 115.85 3g0g n GLU 464 Ca 0.24 -2.33 -0.13 0.00 -0.01 0.00 0.00 57.16 54.93 3g0g n GLU 464 Cb 0.81 -1.46 -0.00 0.00 -1.01 0.00 0.00 31.44 29.77 3g0g n GLU 464 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3g0g n ALA 465 N -0.47 -0.42 -0.07 0.62 0.00 0.79 -4.93 120.51 116.04 3g0g n ALA 465 Ca 0.14 0.12 -0.14 0.00 0.00 0.00 0.00 53.44 53.55 3g0g n ALA 465 Cb 0.60 -1.74 -0.03 0.00 0.00 0.00 0.00 19.45 18.28 3g0g n ALA 465 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3g0g h LYS 466 N -0.13 0.84 -5.35 0.00 3.11 -1.81 -3.43 116.57 109.80 3g0g h LYS 466 Ca -0.32 -0.54 -0.44 0.00 -2.81 0.00 0.00 60.65 56.55 3g0g h LYS 466 Cb 1.23 0.06 -0.14 0.00 -1.00 0.00 0.00 32.23 32.39 3g0g h LYS 466 CO 0.37 1.17 -0.68 0.71 -2.81 0.00 0.00 179.45 178.21 3g0g s TYR 467 N -4.10 1.74 -0.02 1.91 1.51 -1.26 -1.34 117.35 115.79 3g0g s TYR 467 Ca -0.10 -0.76 -0.06 0.00 -1.01 0.00 0.00 57.07 55.14 3g0g s TYR 467 Cb 0.10 -0.96 0.01 0.00 -0.11 0.00 0.00 41.96 40.99 3g0g s TYR 467 CO 0.89 0.17 0.14 1.52 -1.11 0.00 0.00 175.55 177.16 3g0g s TYR 468 N -3.16 -0.02 -0.27 2.71 1.13 -0.69 -1.22 117.35 115.83 3g0g s TYR 468 Ca 0.27 0.04 -0.11 0.00 -1.41 0.00 0.00 57.07 55.87 3g0g s TYR 468 Cb 0.04 -0.02 -0.05 0.00 -1.10 0.00 0.00 41.96 40.83 3g0g s TYR 468 CO 0.09 -0.21 0.18 -1.14 -2.51 0.00 0.00 175.55 171.96 3g0g s GLN 469 N -0.87 3.98 -0.09 -3.49 0.74 0.23 -1.18 119.66 118.98 3g0g s GLN 469 Ca -0.10 -0.31 -0.17 0.00 0.05 0.00 0.00 55.36 54.84 3g0g s GLN 469 Cb -0.05 -3.62 -0.05 0.00 1.10 0.00 0.00 33.01 30.39 3g0g s GLN 469 CO 0.01 -0.11 0.43 -0.51 -0.55 0.00 0.00 175.29 174.56 3g0g s LEU 470 N 1.55 4.33 -0.20 3.68 1.43 -0.13 -1.47 118.68 127.86 3g0g s LEU 470 Ca 0.07 0.81 -0.03 0.00 -1.03 0.00 0.00 54.13 53.96 3g0g s LEU 470 Cb -0.15 -2.62 -0.00 0.00 0.03 0.00 0.00 46.19 43.44 3g0g s LEU 470 CO 0.09 0.10 -0.08 -0.60 0.23 0.00 0.00 176.35 176.09 3g0g s ARG 471 N 0.14 3.31 -0.21 1.70 3.52 -0.36 -1.78 118.95 125.26 3g0g s ARG 471 Ca 0.24 -0.67 -0.07 0.00 -0.13 0.00 0.00 55.73 55.11 3g0g s ARG 471 Cb -0.15 -2.90 -0.03 0.00 -1.56 0.00 0.00 34.95 30.31 3g0g s ARG 471 CO 0.10 -0.16 0.05 0.00 -0.81 0.00 0.00 175.30 174.48 3g0g n SER 473 N 4.25 1.14 0.00 0.00 7.64 0.10 -1.24 113.62 125.51 3g0g n SER 473 Ca -0.16 -1.07 0.00 0.00 1.01 0.00 0.00 58.87 58.65 3g0g n SER 473 Cb 0.52 0.86 0.00 0.00 -1.01 0.00 0.00 64.21 64.57 3g0g n SER 473 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g0g n GLY 474 N 1.40 -0.95 0.06 0.23 0.00 -1.25 -0.11 105.19 104.55 3g0g n GLY 474 Ca 0.05 -1.16 0.14 0.00 0.00 0.00 0.00 46.02 45.05 3g0g n GLY 474 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3g0g n PRO 475 N -0.48 0.47 -0.90 1.61 -0.04 -0.75 -0.06 135.00 134.85 3g0g n PRO 475 Ca 0.00 -0.11 -0.04 0.00 -0.04 0.00 0.00 63.50 63.31 3g0g n PRO 475 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 3g0g n PRO 475 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g0g n GLY 476 N 1.32 0.60 3.70 0.55 0.00 -0.24 -4.56 105.19 106.55 3g0g n GLY 476 Ca 0.13 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 3g0g n GLY 476 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3g0g n LEU 477 N 0.00 3.68 -4.65 0.99 4.32 -1.26 -4.57 117.00 115.51 3g0g n LEU 477 Ca 0.03 1.18 -0.43 0.00 -0.02 0.00 0.00 56.01 56.77 3g0g n LEU 477 Cb 0.10 -1.49 -0.00 0.00 -1.62 0.00 0.00 43.42 40.41 3g0g n LEU 477 CO 0.07 -0.53 0.74 -2.65 -1.22 0.00 0.00 177.39 173.80 3g0g n PRO 478 N 0.41 1.74 -4.43 3.23 -0.02 -1.26 -4.77 135.00 129.90 3g0g n PRO 478 Ca 0.05 0.61 -0.23 0.00 -2.02 0.00 0.00 63.50 61.92 3g0g n PRO 478 Cb 0.37 -2.14 -0.16 0.00 -0.02 0.00 0.00 33.50 31.55 3g0g n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3g0g s LEU 479 N -0.56 1.56 -0.18 2.45 2.96 -0.38 -4.42 118.68 120.12 3g0g s LEU 479 Ca 0.58 -0.23 0.00 0.00 -0.22 0.00 0.00 54.13 54.27 3g0g s LEU 479 Cb -0.60 -0.67 0.01 0.00 0.50 0.00 0.00 46.19 45.43 3g0g s LEU 479 CO 0.60 0.01 -0.18 -0.31 -1.32 0.00 0.00 176.35 175.16 3g0g s TYR 480 N 0.68 2.79 0.06 5.38 2.02 -0.61 -0.84 117.35 126.84 3g0g s TYR 480 Ca -0.12 -1.49 0.03 0.00 -0.37 0.00 0.00 57.07 55.12 3g0g s TYR 480 Cb -0.15 -1.93 -0.03 0.00 -0.40 0.00 0.00 41.96 39.45 3g0g s TYR 480 CO 0.02 -0.74 -0.10 0.95 -1.57 0.00 0.00 175.55 174.12 3g0g s THR 481 N 1.25 0.73 -0.13 -0.71 -4.23 -0.74 0.63 115.64 112.44 3g0g s THR 481 Ca 0.03 -1.23 -0.04 0.00 -1.18 0.00 0.00 61.69 59.28 3g0g s THR 481 Cb -0.14 -0.84 -0.03 0.00 1.34 0.00 0.00 72.50 72.83 3g0g s THR 481 CO -0.10 -0.38 0.01 -0.22 -0.54 0.00 0.00 174.62 173.39 3g0g s LEU 482 N -1.77 3.57 0.05 4.79 1.98 -0.16 -0.95 118.68 126.19 3g0g s LEU 482 Ca -0.06 0.06 0.04 0.00 -2.89 0.00 0.00 54.13 51.29 3g0g s LEU 482 Cb -0.09 -1.85 -0.03 0.00 0.66 0.00 0.00 46.19 44.89 3g0g s LEU 482 CO 0.01 0.27 -0.11 -1.00 -1.89 0.00 0.00 176.35 173.63 3g0g s HIS 483 N -0.25 0.96 -0.26 5.38 3.76 -0.33 0.12 115.29 124.67 3g0g s HIS 483 Ca 0.06 -0.46 -0.14 0.00 -0.15 0.00 0.00 55.06 54.37 3g0g s HIS 483 Cb -0.12 -0.55 -0.04 0.00 1.11 0.00 0.00 32.58 32.97 3g0g s HIS 483 CO 0.02 -0.01 0.31 0.45 -0.85 0.00 0.00 174.74 174.66 3g0g s SER 484 N -1.58 6.21 0.29 1.40 0.15 -0.48 -1.70 113.70 117.99 3g0g s SER 484 Ca -0.05 0.24 0.26 0.00 0.70 0.00 0.00 55.95 57.09 3g0g s SER 484 Cb -0.10 -2.18 0.77 0.00 -1.71 0.00 0.00 66.02 62.80 3g0g s SER 484 CO 0.01 -0.11 1.74 0.77 1.20 0.00 0.00 173.24 176.86 3g0g h SER 485 N 8.01 0.00 0.63 5.45 4.64 -1.48 0.25 113.55 131.05 3g0g h SER 485 Ca -0.34 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.94 3g0g h SER 485 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 3g0g h SER 485 CO 0.64 0.00 -0.19 1.62 -0.87 0.00 0.00 176.83 178.03 3g0g h VAL 486 N 0.00 0.59 0.00 0.95 3.04 -1.89 -3.32 116.25 115.62 3g0g h VAL 486 Ca 0.00 -0.86 0.00 0.00 -1.01 0.00 0.00 66.70 64.83 3g0g h VAL 486 Cb 0.72 1.57 0.00 0.00 -2.01 0.00 0.00 31.29 31.57 3g0g h VAL 486 CO 0.00 0.18 -0.07 -0.46 -1.01 0.00 0.00 177.57 176.21 3g0g n ASN 487 N -3.53 0.00 0.00 3.17 6.94 -1.21 -5.02 115.26 115.61 3g0g n ASN 487 Ca -0.01 -1.14 0.00 0.00 -0.02 0.00 0.00 54.58 53.41 3g0g n ASN 487 Cb 0.34 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.73 3g0g n ASN 487 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 3g0g n ASP 488 N 0.00 0.00 -4.76 0.53 10.43 0.86 -4.92 116.55 118.68 3g0g n ASP 488 Ca 0.00 0.00 -0.40 0.00 2.57 0.00 0.00 54.79 56.96 3g0g n ASP 488 Cb 0.53 -1.95 0.02 0.00 1.84 0.00 0.00 41.12 41.56 3g0g n ASP 488 CO 0.00 0.00 0.00 -1.59 -1.07 0.00 0.00 177.20 174.54 3g0g s LYS 489 N -0.47 3.60 0.22 -1.24 -2.85 -1.21 -4.63 119.74 113.17 3g0g s LYS 489 Ca 0.00 2.42 -0.30 0.00 -1.00 0.00 0.00 55.97 57.09 3g0g s LYS 489 Cb 0.00 -2.61 -0.09 0.00 -2.06 0.00 0.00 37.83 33.08 3g0g s LYS 489 CO 0.00 -0.88 1.10 0.20 0.10 0.00 0.00 175.35 175.86 3g0g s GLY 490 N -0.53 2.94 -0.11 0.59 0.00 -1.26 -1.38 107.32 107.56 3g0g s GLY 490 Ca 0.62 0.85 -0.07 0.00 0.00 0.00 0.00 44.72 46.13 3g0g s GLY 490 CO 0.56 1.58 -0.13 1.41 0.00 0.00 0.00 173.10 176.52 3g0g h LEU 491 N 4.52 0.00 -7.22 0.66 3.38 -0.67 -3.47 115.31 112.52 3g0g h LEU 491 Ca -0.45 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.60 3g0g h LEU 491 Cb 1.21 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.84 3g0g h LEU 491 CO 0.70 0.61 0.40 0.00 0.09 0.00 0.00 178.44 180.23 3g0g s ARG 492 N -1.96 1.10 -0.11 1.13 1.70 -1.13 -5.00 118.95 114.67 3g0g s ARG 492 Ca -0.10 -0.47 -0.27 0.00 -0.47 0.00 0.00 55.73 54.41 3g0g s ARG 492 Cb 0.01 0.46 -0.02 0.00 -0.57 0.00 0.00 34.95 34.83 3g0g s ARG 492 CO 0.16 -0.49 0.88 0.08 -1.08 0.00 0.00 175.30 174.85 3g0g s VAL 493 N -3.38 4.87 -0.21 4.99 1.01 -1.26 -0.99 120.40 125.43 3g0g s VAL 493 Ca 0.06 1.78 -0.18 0.00 0.00 0.00 0.00 61.98 63.64 3g0g s VAL 493 Cb -0.01 -4.20 -0.19 0.00 0.00 0.00 0.00 36.38 31.98 3g0g s VAL 493 CO -0.06 0.07 0.13 0.18 0.00 0.00 0.00 175.10 175.42 3g0g n LEU 494 N 4.78 1.98 -3.69 3.92 4.77 0.21 -4.93 117.00 124.04 3g0g n LEU 494 Ca 0.05 0.38 -0.17 0.00 -0.03 0.00 0.00 56.01 56.24 3g0g n LEU 494 Cb 0.49 -0.96 -0.16 0.00 -2.33 0.00 0.00 43.42 40.47 3g0g n LEU 494 CO 0.50 0.40 -0.26 -0.70 -1.33 0.00 0.00 177.39 175.99 3g0g s GLU 495 N -2.41 0.02 0.00 3.23 2.56 -1.07 -5.00 118.70 116.03 3g0g s GLU 495 Ca -0.30 0.47 0.14 0.00 0.00 0.00 0.00 54.97 55.28 3g0g s GLU 495 Cb 0.07 -0.30 -0.00 0.00 2.00 0.00 0.00 34.13 35.90 3g0g s GLU 495 CO 0.59 -0.28 0.79 -0.40 -0.56 0.00 0.00 175.26 175.41 3g0g n ASP 496 N 5.03 1.51 -2.83 -1.70 3.85 -1.26 -1.57 116.55 119.58 3g0g n ASP 496 Ca -0.10 -1.26 -0.21 0.00 -0.71 0.00 0.00 54.79 52.51 3g0g n ASP 496 Cb 0.50 0.47 0.03 0.00 -1.35 0.00 0.00 41.12 40.77 3g0g n ASP 496 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 3g0g n ASN 497 N -0.15 -5.90 0.24 -1.12 3.02 -1.26 -4.88 115.26 105.20 3g0g n ASN 497 Ca 0.06 -0.26 0.15 0.00 -0.03 0.00 0.00 54.58 54.50 3g0g n ASN 497 Cb 0.30 -4.73 0.54 0.00 -0.61 0.00 0.00 39.78 35.29 3g0g n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3g0g h SER 498 N -1.27 0.00 0.73 6.41 4.64 -1.95 -1.54 113.55 120.57 3g0g h SER 498 Ca -0.50 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.78 3g0g h SER 498 Cb 1.35 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.44 3g0g h SER 498 CO 0.54 0.00 -0.35 0.00 -0.87 0.00 0.00 176.83 176.15 3g0g h ALA 499 N 2.07 -1.15 -0.69 5.18 0.00 -1.98 -1.99 119.26 120.69 3g0g h ALA 499 Ca 0.00 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.82 3g0g h ALA 499 Cb 0.60 0.38 -0.09 0.00 0.00 0.00 0.00 17.79 18.68 3g0g h ALA 499 CO 0.00 -1.08 0.25 1.25 0.00 0.00 0.00 179.25 179.67 3g0g h LEU 500 N -1.07 0.22 -0.95 0.00 5.85 -1.81 -1.71 115.31 115.84 3g0g h LEU 500 Ca -0.10 0.10 0.11 0.00 0.84 0.00 0.00 57.88 58.83 3g0g h LEU 500 Cb 0.75 0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.79 3g0g h LEU 500 CO 0.16 0.10 0.58 -0.78 -0.34 0.00 0.00 178.44 178.16 3g0g h ASP 501 N 0.41 0.84 0.81 1.25 1.82 -1.26 0.49 116.42 120.78 3g0g h ASP 501 Ca 0.37 0.05 -0.04 0.00 -0.39 0.00 0.00 57.03 57.02 3g0g h ASP 501 Cb 0.53 -0.12 0.01 0.00 0.68 0.00 0.00 39.33 40.43 3g0g h ASP 501 CO -0.38 0.45 -0.41 0.11 -1.61 0.00 0.00 179.24 177.40 3g0g h LYS 502 N 0.92 -1.07 -0.84 0.28 1.79 -0.52 -2.72 116.57 114.40 3g0g h LYS 502 Ca 0.47 0.07 0.10 0.00 -2.18 0.00 0.00 60.65 59.11 3g0g h LYS 502 Cb 0.46 0.24 -0.08 0.00 -1.58 0.00 0.00 32.23 31.28 3g0g h LYS 502 CO -0.26 -0.71 0.48 0.52 -1.08 0.00 0.00 179.45 178.39 3g0g h MET 503 N -1.11 0.77 0.00 3.15 2.86 -1.15 -1.34 114.93 118.11 3g0g h MET 503 Ca -0.11 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 3g0g h MET 503 Cb 0.86 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.35 3g0g h MET 503 CO 0.17 0.51 0.00 1.28 1.06 0.00 0.00 176.91 179.93 3g0g n LEU 504 N -4.74 0.22 0.13 1.22 4.32 0.11 -2.09 117.00 116.17 3g0g n LEU 504 Ca 0.14 0.56 -0.01 0.00 -0.02 0.00 0.00 56.01 56.68 3g0g n LEU 504 Cb 0.30 -0.53 0.21 0.00 -1.62 0.00 0.00 43.42 41.77 3g0g n LEU 504 CO 0.26 -0.39 0.56 -0.61 -1.22 0.00 0.00 177.39 175.99 3g0g h GLN 505 N 0.00 0.07 -0.05 3.23 4.15 -0.91 -3.06 115.11 118.54 3g0g h GLN 505 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.37 3g0g h GLN 505 Cb 0.26 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.95 3g0g h GLN 505 CO 0.00 0.60 0.00 -1.71 -1.93 0.00 0.00 178.83 175.79 3g0g n ASN 506 N -3.90 0.71 -4.19 -0.69 4.05 -0.89 -4.86 115.26 105.48 3g0g n ASN 506 Ca -0.02 -1.44 -0.28 0.00 0.45 0.00 0.00 54.58 53.30 3g0g n ASN 506 Cb 0.56 -0.03 -0.16 0.00 1.23 0.00 0.00 39.78 41.37 3g0g n ASN 506 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3g0g s VAL 507 N -1.94 1.66 -0.98 3.44 1.01 -1.16 -4.20 120.40 118.23 3g0g s VAL 507 Ca 0.34 -0.85 -0.24 0.00 0.00 0.00 0.00 61.98 61.24 3g0g s VAL 507 Cb 0.17 -1.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.13 3g0g s VAL 507 CO 0.28 0.47 1.79 -1.10 0.00 0.00 0.00 175.10 176.53 3g0g s GLN 508 N -0.10 2.93 0.40 2.72 -0.21 0.17 -4.98 119.66 120.59 3g0g s GLN 508 Ca -0.02 -0.69 -0.14 0.00 0.02 0.00 0.00 55.36 54.53 3g0g s GLN 508 Cb -0.12 -5.19 -0.08 0.00 1.00 0.00 0.00 33.01 28.63 3g0g s GLN 508 CO 0.02 -3.03 0.82 -1.64 -2.12 0.00 0.00 175.29 169.34 3g0g s MET 509 N 6.22 3.91 0.84 2.91 -1.94 -1.26 -4.36 119.30 125.62 3g0g s MET 509 Ca 0.62 0.68 -0.12 0.00 -1.71 0.00 0.00 55.69 55.15 3g0g s MET 509 Cb -0.04 -2.33 0.10 0.00 2.01 0.00 0.00 34.83 34.57 3g0g s MET 509 CO -0.02 -0.03 1.19 -1.25 -0.01 0.00 0.00 175.02 174.91 3g0g s PRO 510 N -3.59 1.74 0.37 2.03 0.04 -1.26 -4.16 135.00 130.17 3g0g s PRO 510 Ca 0.54 0.07 0.08 0.00 0.04 0.00 0.00 61.00 61.74 3g0g s PRO 510 Cb -0.10 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.44 3g0g s PRO 510 CO 0.26 -1.74 -0.03 -1.54 0.04 0.00 0.00 177.00 173.98 3g0g s SER 511 N -4.56 3.87 -0.07 6.66 1.04 -0.62 -4.91 113.70 115.11 3g0g s SER 511 Ca 0.63 -1.23 0.05 0.00 0.48 0.00 0.00 55.95 55.89 3g0g s SER 511 Cb -0.11 -0.40 -0.01 0.00 0.10 0.00 0.00 66.02 65.61 3g0g s SER 511 CO 0.50 -0.31 -0.24 -0.75 0.98 0.00 0.00 173.24 173.42 3g0g s LYS 512 N -3.67 2.63 -0.19 4.02 2.20 -1.26 0.08 119.74 123.54 3g0g s LYS 512 Ca 0.34 -0.86 -0.03 0.00 -0.36 0.00 0.00 55.97 55.06 3g0g s LYS 512 Cb 0.05 -2.14 -0.01 0.00 -1.51 0.00 0.00 37.83 34.22 3g0g s LYS 512 CO 0.18 0.30 -0.07 0.21 -0.36 0.00 0.00 175.35 175.60 3g0g s LYS 513 N 0.04 3.39 -0.15 4.03 2.20 -0.46 -4.94 119.74 123.85 3g0g s LYS 513 Ca -0.09 -0.64 -0.03 0.00 -0.36 0.00 0.00 55.97 54.85 3g0g s LYS 513 Cb -0.15 -2.89 -0.03 0.00 -1.51 0.00 0.00 37.83 33.25 3g0g s LYS 513 CO 0.05 -0.06 -0.05 -1.17 -0.36 0.00 0.00 175.35 173.76 3g0g s LEU 514 N 1.10 3.20 0.00 5.43 0.20 -1.26 -0.48 118.68 126.86 3g0g s LEU 514 Ca 0.01 -0.15 -0.10 0.00 0.69 0.00 0.00 54.13 54.58 3g0g s LEU 514 Cb -0.15 -1.77 0.04 0.00 -0.43 0.00 0.00 46.19 43.89 3g0g s LEU 514 CO -0.01 0.17 0.52 -0.67 -0.29 0.00 0.00 176.35 176.07 3g0g n ASP 515 N 3.53 -1.16 -4.29 3.68 4.64 -0.08 -5.01 116.55 117.86 3g0g n ASP 515 Ca -0.17 -1.72 -0.16 0.00 -1.38 0.00 0.00 54.79 51.36 3g0g n ASP 515 Cb 0.52 1.91 -0.10 0.00 -1.04 0.00 0.00 41.12 42.42 3g0g n ASP 515 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 3g0g s PHE 516 N -4.46 1.43 0.27 -0.67 -0.12 -1.26 0.39 117.98 113.57 3g0g s PHE 516 Ca 0.11 -0.73 0.08 0.00 -0.05 0.00 0.00 56.93 56.35 3g0g s PHE 516 Cb -0.02 -0.73 -0.05 0.00 -0.63 0.00 0.00 43.02 41.59 3g0g s PHE 516 CO 0.05 0.15 -0.11 0.96 -0.05 0.00 0.00 175.22 176.22 3g0g s ILE 517 N -3.24 1.93 -0.25 -4.49 -4.36 -0.16 -4.94 121.20 105.70 3g0g s ILE 517 Ca 0.20 -2.21 -0.06 0.00 -0.26 0.00 0.00 60.65 58.31 3g0g s ILE 517 Cb 0.02 -2.36 -0.02 0.00 1.25 0.00 0.00 42.46 41.35 3g0g s ILE 517 CO 0.03 -0.37 0.04 -0.63 0.24 0.00 0.00 174.94 174.25 3g0g s ILE 518 N -2.84 3.97 -0.09 8.37 -1.09 -1.26 -0.81 121.20 127.44 3g0g s ILE 518 Ca 0.28 -0.35 0.03 0.00 -2.23 0.00 0.00 60.65 58.39 3g0g s ILE 518 Cb 0.01 -2.87 0.00 0.00 -1.58 0.00 0.00 42.46 38.02 3g0g s ILE 518 CO 0.12 0.33 -0.20 -0.76 -1.23 0.00 0.00 174.94 173.20 3g0g s LEU 519 N 1.56 1.94 -1.61 2.97 1.02 -0.29 -4.76 118.68 119.51 3g0g s LEU 519 Ca 0.06 -0.48 -0.05 0.00 0.02 0.00 0.00 54.13 53.68 3g0g s LEU 519 Cb -0.15 -1.22 0.05 0.00 0.02 0.00 0.00 46.19 44.89 3g0g s LEU 519 CO 0.01 0.11 0.17 0.59 0.02 0.00 0.00 176.35 177.26 3g0g n ASN 520 N 3.65 0.19 -1.19 2.29 3.02 -1.26 -0.58 115.26 121.37 3g0g n ASN 520 Ca -0.20 -1.24 -0.15 0.00 -0.03 0.00 0.00 54.58 52.96 3g0g n ASN 520 Cb 0.52 -1.76 -0.06 0.00 -0.61 0.00 0.00 39.78 37.88 3g0g n ASN 520 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3g0g n GLU 521 N -4.47 -1.04 -4.67 3.52 1.02 -1.26 -5.01 120.64 108.73 3g0g n GLU 521 Ca -0.23 0.97 -0.24 0.00 -0.02 0.00 0.00 57.16 57.64 3g0g n GLU 521 Cb 0.65 -5.12 -0.15 0.00 -0.02 0.00 0.00 31.44 26.80 3g0g n GLU 521 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3g0g s THR 522 N -2.57 1.42 -0.06 2.62 2.01 0.25 -5.10 115.64 114.21 3g0g s THR 522 Ca 0.00 -0.95 -0.30 0.00 0.31 0.00 0.00 61.69 60.76 3g0g s THR 522 Cb 0.00 -1.22 -0.02 0.00 0.01 0.00 0.00 72.50 71.27 3g0g s THR 522 CO 0.00 0.25 1.05 -0.54 -0.69 0.00 0.00 174.62 174.69 3g0g s LYS 523 N -0.81 4.44 -0.10 4.92 1.02 -1.26 -1.14 119.74 126.81 3g0g s LYS 523 Ca 0.06 1.48 0.03 0.00 0.02 0.00 0.00 55.97 57.56 3g0g s LYS 523 Cb -0.08 -3.51 0.01 0.00 -0.52 0.00 0.00 37.83 33.73 3g0g s LYS 523 CO 0.01 -0.27 -0.18 -0.06 -0.92 0.00 0.00 175.35 173.92 3g0g s PHE 524 N 1.73 2.15 0.16 3.18 0.08 0.01 -4.97 117.98 120.32 3g0g s PHE 524 Ca 0.51 -0.96 -0.12 0.00 0.12 0.00 0.00 56.93 56.49 3g0g s PHE 524 Cb -0.21 -1.50 -0.07 0.00 -0.57 0.00 0.00 43.02 40.67 3g0g s PHE 524 CO 0.22 -0.45 0.51 -1.58 -0.10 0.00 0.00 175.22 173.82 3g0g s TRP 525 N 0.73 3.54 0.04 0.36 0.52 -1.25 -0.99 118.94 121.88 3g0g s TRP 525 Ca -0.11 0.93 -0.01 0.00 0.02 0.00 0.00 56.10 56.93 3g0g s TRP 525 Cb -0.16 -2.28 -0.03 0.00 -1.15 0.00 0.00 33.47 29.85 3g0g s TRP 525 CO 0.02 0.40 -0.03 1.52 0.02 0.00 0.00 176.95 178.88 3g0g s TYR 526 N -1.57 0.43 0.19 -1.98 -0.85 0.16 -1.47 117.35 112.25 3g0g s TYR 526 Ca 0.40 -0.88 0.06 0.00 -0.52 0.00 0.00 57.07 56.13 3g0g s TYR 526 Cb -0.13 -0.32 -0.05 0.00 0.38 0.00 0.00 41.96 41.84 3g0g s TYR 526 CO 0.20 -0.32 -0.11 1.14 -1.52 0.00 0.00 175.55 174.95 3g0g s GLN 527 N -3.06 1.23 -0.08 -3.49 -2.07 -0.91 -0.91 119.66 110.37 3g0g s GLN 527 Ca -0.01 -1.55 -0.03 0.00 -1.82 0.00 0.00 55.36 51.94 3g0g s GLN 527 Cb 0.02 -0.85 0.04 0.00 -1.09 0.00 0.00 33.01 31.12 3g0g s GLN 527 CO -0.07 0.10 0.17 -1.64 -1.32 0.00 0.00 175.29 172.53 3g0g s MET 528 N -3.72 0.12 -0.35 9.60 -1.94 0.36 -1.76 119.30 121.62 3g0g s MET 528 Ca 0.21 0.43 -0.19 0.00 -1.71 0.00 0.00 55.69 54.43 3g0g s MET 528 Cb 0.02 -0.17 -0.00 0.00 2.01 0.00 0.00 34.83 36.69 3g0g s MET 528 CO 0.05 -0.18 0.57 0.42 -0.01 0.00 0.00 175.02 175.87 3g0g s ILE 529 N 1.28 4.96 -0.14 2.53 -1.09 0.21 -1.35 121.20 127.60 3g0g s ILE 529 Ca -0.08 0.46 -0.06 0.00 -2.23 0.00 0.00 60.65 58.74 3g0g s ILE 529 Cb -0.11 -4.01 -0.04 0.00 -1.58 0.00 0.00 42.46 36.71 3g0g s ILE 529 CO -0.07 -0.26 0.08 -0.76 -1.23 0.00 0.00 174.94 172.71 3g0g s LEU 530 N 2.54 3.97 0.55 2.97 1.43 0.11 -2.42 118.68 127.83 3g0g s LEU 530 Ca 0.21 0.23 -0.20 0.00 -1.03 0.00 0.00 54.13 53.34 3g0g s LEU 530 Cb -0.15 -1.98 -0.06 0.00 0.03 0.00 0.00 46.19 44.03 3g0g s LEU 530 CO 0.14 0.29 1.03 -2.65 0.23 0.00 0.00 176.35 175.39 3g0g n PRO 531 N 2.76 1.13 -1.67 1.29 -0.02 -1.26 -1.58 135.00 135.65 3g0g n PRO 531 Ca -0.18 0.42 -0.39 0.00 -2.02 0.00 0.00 63.50 61.33 3g0g n PRO 531 Cb 0.53 -2.20 0.04 0.00 -0.02 0.00 0.00 33.50 31.85 3g0g n PRO 531 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3g0g n PRO 532 N -0.71 1.40 -3.17 0.52 -0.04 -1.26 -2.58 135.00 129.17 3g0g n PRO 532 Ca 0.12 0.52 -0.23 0.00 -0.04 0.00 0.00 63.50 63.87 3g0g n PRO 532 Cb 0.45 -2.32 0.04 0.00 -0.04 0.00 0.00 33.50 31.63 3g0g n PRO 532 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3g0g n HIS 533 N -1.05 -2.11 -1.66 0.54 8.25 -1.26 -4.89 115.22 113.03 3g0g n HIS 533 Ca 0.11 0.61 -0.52 0.00 -0.26 0.00 0.00 57.72 57.65 3g0g n HIS 533 Cb 0.44 -4.43 -0.06 0.00 1.12 0.00 0.00 29.99 27.06 3g0g n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3g0g n PHE 534 N -4.55 1.99 -3.83 4.41 7.35 -1.06 -4.97 117.46 116.79 3g0g n PHE 534 Ca -0.08 0.41 -0.36 0.00 -0.76 0.00 0.00 57.45 56.66 3g0g n PHE 534 Cb 0.60 -2.48 -0.13 0.00 0.35 0.00 0.00 39.48 37.82 3g0g n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3g0g s ASP 535 N 2.38 5.09 0.55 -2.13 -1.08 -1.26 -4.99 116.67 115.23 3g0g s ASP 535 Ca 0.90 -1.22 0.30 0.00 -0.52 0.00 0.00 52.55 52.01 3g0g s ASP 535 Cb -0.90 -1.79 1.46 0.00 -1.46 0.00 0.00 42.92 40.24 3g0g s ASP 535 CO 0.53 -0.29 1.91 0.11 0.52 0.00 0.00 175.17 177.95 3g0g h LYS 536 N 8.10 0.00 -0.01 4.34 1.57 -1.98 -1.09 116.57 127.50 3g0g h LYS 536 Ca -0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 3g0g h LYS 536 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 3g0g h LYS 536 CO 0.57 0.00 -0.00 -1.13 -0.57 0.00 0.00 179.45 178.32 3g0g n SER 537 N -4.19 1.29 -4.89 0.86 3.41 -1.26 -4.20 113.62 104.63 3g0g n SER 537 Ca 0.15 -1.43 -0.28 0.00 -0.26 0.00 0.00 58.87 57.05 3g0g n SER 537 Cb 0.83 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.74 3g0g n SER 537 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3g0g s LYS 538 N -2.00 3.27 -0.17 4.33 1.02 -0.41 -5.04 119.74 120.74 3g0g s LYS 538 Ca 0.39 -0.63 -0.10 0.00 0.02 0.00 0.00 55.97 55.65 3g0g s LYS 538 Cb 0.21 -2.89 -0.05 0.00 -0.52 0.00 0.00 37.83 34.58 3g0g s LYS 538 CO 0.34 0.54 0.16 0.15 -0.92 0.00 0.00 175.35 175.62 3g0g s LYS 539 N -2.97 3.98 0.03 1.68 -0.14 -1.26 -4.43 119.74 116.64 3g0g s LYS 539 Ca 0.33 -0.13 0.08 0.00 -1.36 0.00 0.00 55.97 54.89 3g0g s LYS 539 Cb -0.11 -3.35 -0.02 0.00 -1.68 0.00 0.00 37.83 32.66 3g0g s LYS 539 CO 0.27 0.44 -0.22 0.71 -0.76 0.00 0.00 175.35 175.78 3g0g s TYR 540 N -0.05 1.95 0.47 3.18 2.02 0.22 -4.73 117.35 120.40 3g0g s TYR 540 Ca 0.12 -0.38 -0.24 0.00 -0.37 0.00 0.00 57.07 56.19 3g0g s TYR 540 Cb -0.12 -1.18 -0.07 0.00 -0.40 0.00 0.00 41.96 40.19 3g0g s TYR 540 CO 0.01 0.07 1.36 -1.25 -1.57 0.00 0.00 175.55 174.17 3g0g s PRO 541 N -1.04 3.59 -0.05 -1.71 0.04 -1.26 -1.01 135.00 133.56 3g0g s PRO 541 Ca 0.09 2.26 0.04 0.00 0.04 0.00 0.00 61.00 63.42 3g0g s PRO 541 Cb -0.09 -2.54 0.00 0.00 0.04 0.00 0.00 34.50 31.91 3g0g s PRO 541 CO 0.01 -0.84 -0.17 -1.17 0.04 0.00 0.00 177.00 174.88 3g0g s LEU 542 N -2.92 1.88 -0.19 -3.56 0.20 -0.72 -2.05 118.68 111.32 3g0g s LEU 542 Ca 0.63 -0.36 -0.03 0.00 0.69 0.00 0.00 54.13 55.06 3g0g s LEU 542 Cb -0.40 -0.98 -0.02 0.00 -0.43 0.00 0.00 46.19 44.36 3g0g s LEU 542 CO 0.50 0.13 -0.05 -0.22 -0.29 0.00 0.00 176.35 176.43 3g0g s LEU 543 N 0.18 2.98 -0.36 -0.68 2.96 0.47 -0.70 118.68 123.54 3g0g s LEU 543 Ca -0.07 -0.31 -0.21 0.00 -0.22 0.00 0.00 54.13 53.32 3g0g s LEU 543 Cb -0.13 -1.74 0.00 0.00 0.50 0.00 0.00 46.19 44.83 3g0g s LEU 543 CO 0.03 0.05 0.66 -0.22 -1.32 0.00 0.00 176.35 175.56 3g0g s LEU 544 N 1.04 4.24 -0.30 -0.68 2.96 0.12 -0.83 118.68 125.22 3g0g s LEU 544 Ca 0.01 0.18 -0.24 0.00 -0.22 0.00 0.00 54.13 53.86 3g0g s LEU 544 Cb -0.15 -2.83 0.00 0.00 0.50 0.00 0.00 46.19 43.72 3g0g s LEU 544 CO 0.00 -0.62 0.81 -0.62 -1.32 0.00 0.00 176.35 174.60 3g0g s ASP 545 N 1.80 6.69 -0.09 3.68 3.68 0.75 -1.19 116.67 131.99 3g0g s ASP 545 Ca 0.26 0.70 0.04 0.00 2.13 0.00 0.00 52.55 55.68 3g0g s ASP 545 Cb -0.14 -2.42 0.00 0.00 -1.45 0.00 0.00 42.92 38.91 3g0g s ASP 545 CO 0.15 -0.63 -0.22 0.54 0.13 0.00 0.00 175.17 175.15 3g0g s VAL 546 N 2.99 1.88 0.00 1.11 0.11 -0.88 -4.37 120.40 121.25 3g0g s VAL 546 Ca 0.33 -0.93 0.00 0.00 -2.93 0.00 0.00 61.98 58.46 3g0g s VAL 546 Cb -0.14 -1.63 0.00 0.00 -1.53 0.00 0.00 36.38 33.08 3g0g s VAL 546 CO 0.12 0.52 0.00 0.00 -3.33 0.00 0.00 175.10 172.42 3g0g n TYR 547 N 3.47 0.00 -1.46 1.54 9.36 -1.26 -4.17 117.16 124.64 3g0g n TYR 547 Ca -0.19 0.00 -0.16 0.00 3.32 0.00 0.00 57.90 60.87 3g0g n TYR 547 Cb 0.53 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 39.17 3g0g n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3g0g n ALA 548 N -2.13 -0.24 -1.58 2.98 0.00 -1.26 -3.26 120.51 115.01 3g0g n ALA 548 Ca 0.00 0.26 -0.29 0.00 0.00 0.00 0.00 53.44 53.41 3g0g n ALA 548 Cb 0.00 -1.85 0.14 0.00 0.00 0.00 0.00 19.45 17.74 3g0g n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3g0g s GLY 549 N -2.65 1.59 0.30 0.00 0.00 -1.26 -4.86 107.32 100.45 3g0g s GLY 549 Ca 0.00 -0.62 -0.30 0.00 0.00 0.00 0.00 44.72 43.80 3g0g s GLY 549 CO 0.00 -0.03 1.55 -4.14 0.00 0.00 0.00 173.10 170.47 3g0g s PRO 550 N -5.37 4.15 -1.82 2.90 0.02 -1.26 -1.39 135.00 132.22 3g0g s PRO 550 Ca 0.65 2.52 0.00 0.00 0.02 0.00 0.00 61.00 64.19 3g0g s PRO 550 Cb -0.13 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.36 3g0g s PRO 550 CO 0.53 -0.57 0.00 0.00 -0.33 0.00 0.00 177.00 176.63 3g0g s SER 552 N -2.28 6.37 -0.25 0.00 1.04 -0.49 -4.23 113.70 113.87 3g0g s SER 552 Ca 0.00 1.24 -0.02 0.00 0.48 0.00 0.00 55.95 57.65 3g0g s SER 552 Cb 0.00 -2.38 0.11 0.00 0.10 0.00 0.00 66.02 63.85 3g0g s SER 552 CO 0.00 -0.64 0.26 -1.58 0.98 0.00 0.00 173.24 172.26 3g0g s GLN 553 N -4.59 0.25 0.00 4.02 0.74 -1.26 -1.66 119.66 117.17 3g0g s GLN 553 Ca 0.53 0.04 0.19 0.00 0.05 0.00 0.00 55.36 56.16 3g0g s GLN 553 Cb -0.10 -0.94 -0.07 0.00 1.10 0.00 0.00 33.01 33.00 3g0g s GLN 553 CO 0.43 -0.83 0.89 1.63 -0.55 0.00 0.00 175.29 176.86 3g0g n LYS 554 N 5.31 1.35 -3.71 1.67 4.76 -1.26 -4.83 118.16 121.45 3g0g n LYS 554 Ca -0.04 -0.60 -0.38 0.00 -2.87 0.00 0.00 58.31 54.41 3g0g n LYS 554 Cb 0.48 -1.36 -0.12 0.00 -1.84 0.00 0.00 35.03 32.19 3g0g n LYS 554 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3g0g s ALA 555 N -2.33 3.11 0.33 7.82 0.00 -1.26 -4.77 121.76 124.67 3g0g s ALA 555 Ca 0.13 -1.79 -0.14 0.00 0.00 0.00 0.00 51.96 50.16 3g0g s ALA 555 Cb 0.15 -2.36 0.03 0.00 0.00 0.00 0.00 23.12 20.93 3g0g s ALA 555 CO 0.56 -1.38 0.68 0.16 0.00 0.00 0.00 175.76 175.78 3g0g s ASP 556 N 1.49 0.08 0.00 0.00 1.47 -1.26 -4.42 116.67 114.02 3g0g s ASP 556 Ca -0.00 -1.04 0.16 0.00 1.18 0.00 0.00 52.55 52.85 3g0g s ASP 556 Cb -0.20 0.76 0.50 0.00 -0.34 0.00 0.00 42.92 43.63 3g0g s ASP 556 CO 0.03 -1.47 1.39 0.35 0.68 0.00 0.00 175.17 176.16 3g0g n THR 557 N -0.50 0.47 -2.10 2.11 -2.24 -1.16 -4.94 114.28 105.91 3g0g n THR 557 Ca -0.05 -0.53 -0.41 0.00 -2.27 0.00 0.00 64.05 60.80 3g0g n THR 557 Cb 0.60 0.38 -0.02 0.00 -2.10 0.00 0.00 70.33 69.19 3g0g n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3g0g s VAL 558 N -1.53 2.70 -0.13 2.28 1.01 -1.26 -1.81 120.40 121.64 3g0g s VAL 558 Ca 0.31 0.69 -0.25 0.00 0.00 0.00 0.00 61.98 62.74 3g0g s VAL 558 Cb 0.16 -3.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 3g0g s VAL 558 CO 0.23 0.16 0.78 0.12 0.00 0.00 0.00 175.10 176.39 3g0g s PHE 559 N -1.08 3.47 -0.04 5.22 5.36 0.84 -4.88 117.98 126.88 3g0g s PHE 559 Ca 0.50 1.24 0.03 0.00 -0.96 0.00 0.00 56.93 57.73 3g0g s PHE 559 Cb -0.40 -2.94 0.01 0.00 -0.34 0.00 0.00 43.02 39.35 3g0g s PHE 559 CO 0.53 -0.13 -0.10 1.03 -1.46 0.00 0.00 175.22 175.08 3g0g s ARG 560 N 1.69 1.21 -0.46 10.12 0.52 -1.26 -4.90 118.95 125.87 3g0g s ARG 560 Ca 0.38 -0.34 -0.11 0.00 -0.52 0.00 0.00 55.73 55.14 3g0g s ARG 560 Cb -0.17 -1.09 0.10 0.00 0.52 0.00 0.00 34.95 34.31 3g0g s ARG 560 CO 0.15 0.09 0.34 -0.51 0.02 0.00 0.00 175.30 175.39 3g0g s LEU 561 N 0.36 5.56 0.00 2.53 1.43 -1.26 -4.85 118.68 122.46 3g0g s LEU 561 Ca -0.07 -1.68 0.00 0.00 -1.03 0.00 0.00 54.13 51.35 3g0g s LEU 561 Cb -0.11 -2.05 0.00 0.00 0.03 0.00 0.00 46.19 44.06 3g0g s LEU 561 CO 0.01 -0.66 0.00 -0.46 0.23 0.00 0.00 176.35 175.48 3g0g n ASN 562 N 4.99 0.00 -0.15 2.29 0.23 -1.26 -5.02 115.26 116.35 3g0g n ASN 562 Ca -0.10 -0.64 -0.05 0.00 -0.53 0.00 0.00 54.58 53.25 3g0g n ASN 562 Cb 0.42 0.00 0.04 0.00 -2.08 0.00 0.00 39.78 38.15 3g0g n ASN 562 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 3g0g h TRP 563 N 0.64 0.43 -0.99 -2.53 7.01 -1.96 -1.55 115.95 117.00 3g0g h TRP 563 Ca 0.00 0.02 0.16 0.00 2.11 0.00 0.00 58.89 61.18 3g0g h TRP 563 Cb 0.00 -0.13 -0.10 0.00 -2.10 0.00 0.00 29.16 26.84 3g0g h TRP 563 CO 0.00 0.22 0.60 0.00 -2.79 0.00 0.00 178.44 176.46 3g0g h ALA 564 N 1.24 1.57 -0.75 2.65 0.00 -1.98 -0.34 119.26 121.66 3g0g h ALA 564 Ca 0.20 0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.27 3g0g h ALA 564 Cb 0.10 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.70 3g0g h ALA 564 CO -0.14 0.04 0.38 1.15 0.00 0.00 0.00 179.25 180.68 3g0g h THR 565 N 0.83 0.83 -0.44 0.00 2.02 -1.61 -1.10 112.91 113.44 3g0g h THR 565 Ca 0.54 -0.21 -0.14 0.00 0.77 0.00 0.00 66.41 67.36 3g0g h THR 565 Cb 0.72 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 3g0g h THR 565 CO -0.34 0.11 -0.28 0.22 0.37 0.00 0.00 175.52 175.60 3g0g h TYR 566 N 0.62 1.11 -0.16 3.16 5.03 -0.92 -0.01 116.97 125.81 3g0g h TYR 566 Ca 0.37 -0.29 -0.08 0.00 2.58 0.00 0.00 58.73 61.31 3g0g h TYR 566 Cb 0.42 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.44 3g0g h TYR 566 CO -0.10 1.11 -0.28 -0.07 -1.32 0.00 0.00 178.16 177.50 3g0g h LEU 567 N 0.81 0.29 0.16 2.82 3.38 -1.07 0.26 115.31 121.96 3g0g h LEU 567 Ca 0.09 -0.09 -0.28 0.00 0.09 0.00 0.00 57.88 57.68 3g0g h LEU 567 Cb 0.86 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.54 3g0g h LEU 567 CO 0.08 0.57 -1.38 0.00 0.09 0.00 0.00 178.44 177.80 3g0g h ALA 568 N 1.46 0.06 0.72 1.53 0.00 -1.16 0.28 119.26 122.15 3g0g h ALA 568 Ca 0.04 -0.98 -0.04 0.00 0.00 0.00 0.00 54.91 53.93 3g0g h ALA 568 Cb 0.63 0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.77 3g0g h ALA 568 CO 0.05 0.75 -0.35 1.03 0.00 0.00 0.00 179.25 180.73 3g0g h SER 569 N -0.15 -0.82 0.13 0.00 0.87 -0.87 -3.19 113.55 109.52 3g0g h SER 569 Ca -0.27 0.03 -0.37 0.00 -1.23 0.00 0.00 61.79 59.95 3g0g h SER 569 Cb 1.88 0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 64.03 3g0g h SER 569 CO 0.14 -0.48 -2.04 0.41 -0.53 0.00 0.00 176.83 174.33 3g0g n THR 570 N -5.20 1.75 1.05 2.23 -1.04 0.91 -4.38 114.28 109.60 3g0g n THR 570 Ca -0.12 -0.65 0.12 0.00 -2.04 0.00 0.00 64.05 61.35 3g0g n THR 570 Cb 0.38 -1.67 0.18 0.00 -1.82 0.00 0.00 70.33 67.41 3g0g n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3g0g n GLU 571 N -3.44 0.25 -3.52 -2.82 -0.58 -1.14 -4.96 120.64 104.42 3g0g n GLU 571 Ca -0.33 -0.16 -0.21 0.00 -0.42 0.00 0.00 57.16 56.04 3g0g n GLU 571 Cb 1.04 -1.50 0.08 0.00 -0.57 0.00 0.00 31.44 30.50 3g0g n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3g0g n ASN 572 N -1.23 -4.55 -4.49 1.62 4.13 -0.62 -4.96 115.26 105.16 3g0g n ASN 572 Ca 0.07 -0.57 -0.34 0.00 1.68 0.00 0.00 54.58 55.42 3g0g n ASN 572 Cb 0.35 -5.03 -0.12 0.00 -1.54 0.00 0.00 39.78 33.43 3g0g n ASN 572 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3g0g s ILE 573 N -3.33 3.87 0.14 2.41 1.01 0.89 -4.48 121.20 121.70 3g0g s ILE 573 Ca 0.34 -0.37 -0.31 0.00 0.00 0.00 0.00 60.65 60.32 3g0g s ILE 573 Cb -0.15 -2.69 -0.08 0.00 0.01 0.00 0.00 42.46 39.55 3g0g s ILE 573 CO 0.72 0.49 1.30 -0.63 0.00 0.00 0.00 174.94 176.82 3g0g s ILE 574 N 0.39 3.48 -0.27 2.92 1.01 -0.87 -3.42 121.20 124.43 3g0g s ILE 574 Ca -0.04 1.12 -0.03 0.00 0.00 0.00 0.00 60.65 61.70 3g0g s ILE 574 Cb -0.14 -3.72 0.02 0.00 0.01 0.00 0.00 42.46 38.63 3g0g s ILE 574 CO 0.03 0.12 -0.02 -0.69 0.00 0.00 0.00 174.94 174.39 3g0g s VAL 575 N 0.66 3.18 0.09 2.92 1.01 -1.01 -0.39 120.40 126.85 3g0g s VAL 575 Ca 0.59 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 61.64 3g0g s VAL 575 Cb -0.34 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 3g0g s VAL 575 CO 0.33 0.13 -0.01 0.00 0.00 0.00 0.00 175.10 175.55 3g0g s ALA 576 N 1.36 3.25 0.21 5.51 0.00 -0.01 -0.61 121.76 131.47 3g0g s ALA 576 Ca 0.00 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 50.91 3g0g s ALA 576 Cb -0.17 -1.16 -0.05 0.00 0.00 0.00 0.00 23.12 21.74 3g0g s ALA 576 CO -0.02 0.69 -0.12 -1.12 0.00 0.00 0.00 175.76 175.19 3g0g s SER 577 N -2.27 2.50 -0.20 0.00 0.01 -0.72 -0.18 113.70 112.84 3g0g s SER 577 Ca 0.25 -1.06 -0.09 0.00 1.31 0.00 0.00 55.95 56.36 3g0g s SER 577 Cb -0.12 -0.12 0.08 0.00 0.21 0.00 0.00 66.02 66.07 3g0g s SER 577 CO 0.17 -0.23 0.45 0.12 0.41 0.00 0.00 173.24 174.17 3g0g s PHE 578 N -3.03 -0.75 -0.76 2.43 5.36 -1.26 -2.15 117.98 117.81 3g0g s PHE 578 Ca 0.23 1.51 -0.13 0.00 -0.96 0.00 0.00 56.93 57.58 3g0g s PHE 578 Cb 0.01 0.34 0.20 0.00 -0.34 0.00 0.00 43.02 43.23 3g0g s PHE 578 CO 0.07 -0.43 0.69 -0.51 -1.46 0.00 0.00 175.22 173.58 3g0g s ASP 579 N 1.94 6.50 0.00 6.13 1.01 -0.54 -4.83 116.67 126.88 3g0g s ASP 579 Ca -0.07 -2.56 0.00 0.00 0.71 0.00 0.00 52.55 50.64 3g0g s ASP 579 Cb -0.10 -2.17 0.00 0.00 1.01 0.00 0.00 42.92 41.66 3g0g s ASP 579 CO -0.14 -0.60 0.00 0.61 0.21 0.00 0.00 175.17 175.26 3g0g n GLY 580 N 4.13 1.22 3.76 0.21 0.00 -1.26 -3.96 105.19 109.30 3g0g n GLY 580 Ca 0.09 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 44.05 3g0g n GLY 580 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g0g s ARG 581 N 1.63 3.54 0.00 1.61 0.52 -1.26 -2.30 118.95 122.68 3g0g s ARG 581 Ca 0.00 2.12 0.00 0.00 -0.52 0.00 0.00 55.73 57.33 3g0g s ARG 581 Cb 0.00 -2.45 0.00 0.00 0.52 0.00 0.00 34.95 33.02 3g0g s ARG 581 CO 0.00 -0.83 0.00 0.41 0.02 0.00 0.00 175.30 174.90 3g0g n GLY 582 N 0.62 2.57 3.76 -3.53 0.00 0.20 -4.34 105.19 104.47 3g0g n GLY 582 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 3g0g n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g0g s SER 583 N -1.95 4.31 0.14 1.61 1.04 -0.97 -0.26 113.70 117.61 3g0g s SER 583 Ca 0.00 1.72 0.02 0.00 0.48 0.00 0.00 55.95 58.17 3g0g s SER 583 Cb 0.00 -2.43 0.02 0.00 0.10 0.00 0.00 66.02 63.71 3g0g s SER 583 CO 0.00 -2.14 0.16 0.61 0.98 0.00 0.00 173.24 172.85 3g0g n GLY 584 N -1.25 1.85 2.35 7.32 0.00 -0.66 -3.25 105.19 111.54 3g0g n GLY 584 Ca 0.08 -2.14 -0.12 0.00 0.00 0.00 0.00 46.02 43.85 3g0g n GLY 584 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3g0g n TYR 585 N -1.28 -0.19 -1.52 1.61 4.02 -1.26 -4.72 117.16 113.82 3g0g n TYR 585 Ca 0.03 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.96 3g0g n TYR 585 Cb 0.12 -2.58 0.05 0.00 -0.02 0.00 0.00 39.34 36.92 3g0g n TYR 585 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3g0g n GLN 586 N -1.36 0.60 0.00 -0.72 6.02 -1.26 -4.54 117.38 116.11 3g0g n GLN 586 Ca -0.12 -1.60 0.00 0.00 -0.01 0.00 0.00 57.00 55.27 3g0g n GLN 586 Cb 0.49 -0.90 0.00 0.00 1.02 0.00 0.00 30.24 30.84 3g0g n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g0g n GLY 587 N -0.57 1.66 0.26 1.08 0.00 -1.26 -4.63 105.19 101.72 3g0g n GLY 587 Ca 0.06 -1.84 -0.09 0.00 0.00 0.00 0.00 46.02 44.16 3g0g n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g0g h ASP 588 N 0.00 0.83 -0.91 1.61 3.32 -1.26 -2.32 116.42 117.70 3g0g h ASP 588 Ca 0.00 -0.26 0.26 0.00 0.02 0.00 0.00 57.03 57.05 3g0g h ASP 588 Cb 0.00 -0.22 -0.15 0.00 0.22 0.00 0.00 39.33 39.18 3g0g h ASP 588 CO 0.00 0.88 0.26 0.50 -1.72 0.00 0.00 179.24 179.16 3g0g h LYS 589 N 0.75 0.18 0.02 3.56 1.63 -1.87 1.28 116.57 122.13 3g0g h LYS 589 Ca 0.16 -0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.91 3g0g h LYS 589 Cb 0.40 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 3g0g h LYS 589 CO 0.01 0.12 -0.19 0.82 -3.45 0.00 0.00 179.45 176.76 3g0g h ILE 590 N 0.19 1.72 -0.37 2.00 2.04 -1.80 -3.27 117.51 118.00 3g0g h ILE 590 Ca 0.59 -2.37 0.00 0.00 1.00 0.00 0.00 64.86 64.08 3g0g h ILE 590 Cb 1.23 3.32 -0.02 0.00 -0.74 0.00 0.00 36.82 40.61 3g0g h ILE 590 CO -0.69 0.62 0.24 -0.03 0.00 0.00 0.00 178.15 178.29 3g0g h MET 591 N -0.90 0.49 -0.00 2.37 4.05 -0.69 0.57 114.93 120.82 3g0g h MET 591 Ca -0.04 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 3g0g h MET 591 Cb 1.12 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.81 3g0g h MET 591 CO 0.02 0.34 0.00 0.72 0.23 0.00 0.00 176.91 178.21 3g0g n HIS 592 N -4.82 0.00 -0.31 1.39 8.25 0.43 -4.09 115.22 116.07 3g0g n HIS 592 Ca -0.00 -0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.50 3g0g n HIS 592 Cb 0.03 0.00 0.24 0.00 1.12 0.00 0.00 29.99 31.37 3g0g n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3g0g h ALA 593 N 3.93 1.51 -0.36 -1.41 0.00 -1.57 -1.17 119.26 120.19 3g0g h ALA 593 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3g0g h ALA 593 Cb 0.04 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3g0g h ALA 593 CO 0.00 0.35 0.00 0.44 0.00 0.00 0.00 179.25 180.04 3g0g n ILE 594 N -4.50 0.90 -1.67 0.00 -6.64 -1.26 -4.93 119.36 101.27 3g0g n ILE 594 Ca 0.14 -0.61 -0.48 0.00 -1.77 0.00 0.00 62.75 60.03 3g0g n ILE 594 Cb 0.21 0.01 -0.05 0.00 -1.44 0.00 0.00 39.64 38.37 3g0g n ILE 594 CO 0.00 0.00 0.00 -3.20 -1.77 0.00 0.00 176.55 171.58 3g0g n ASN 595 N 0.53 3.03 -0.13 7.28 4.05 -0.45 -1.23 115.26 128.34 3g0g n ASN 595 Ca 0.14 1.05 -0.02 0.00 0.45 0.00 0.00 54.58 56.20 3g0g n ASN 595 Cb 0.50 -1.37 -0.01 0.00 1.23 0.00 0.00 39.78 40.13 3g0g n ASN 595 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 3g0g n ARG 596 N 4.48 -1.24 -2.81 1.20 1.74 0.12 -4.84 116.66 115.31 3g0g n ARG 596 Ca 0.19 0.40 -0.01 0.00 -0.77 0.00 0.00 57.85 57.66 3g0g n ARG 596 Cb 0.27 -4.38 0.05 0.00 -1.02 0.00 0.00 32.46 27.39 3g0g n ARG 596 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3g0g n ARG 597 N -0.71 1.63 -1.69 5.56 5.12 -0.36 -4.92 116.66 121.30 3g0g n ARG 597 Ca -0.02 -3.30 -0.40 0.00 -1.93 0.00 0.00 57.85 52.20 3g0g n ARG 597 Cb 0.34 -1.41 0.03 0.00 -1.16 0.00 0.00 32.46 30.25 3g0g n ARG 597 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3g0g n LEU 598 N -0.60 4.20 0.00 0.55 4.32 -1.23 -2.94 117.00 121.30 3g0g n LEU 598 Ca 0.05 1.01 0.00 0.00 -0.02 0.00 0.00 56.01 57.06 3g0g n LEU 598 Cb 0.81 -1.48 0.00 0.00 -1.62 0.00 0.00 43.42 41.12 3g0g n LEU 598 CO 0.08 -0.93 0.00 0.61 -1.22 0.00 0.00 177.39 175.93 3g0g n GLY 599 N 0.92 0.58 0.00 -0.72 0.00 -1.26 -4.83 105.19 99.88 3g0g n GLY 599 Ca 0.09 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.32 3g0g n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g0g n THR 600 N -2.80 0.00 -0.29 2.61 -2.24 -1.15 -4.77 114.28 105.64 3g0g n THR 600 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 3g0g n THR 600 Cb 0.05 0.00 0.35 0.00 -2.10 0.00 0.00 70.33 68.63 3g0g n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 3g0g h PHE 601 N 0.00 0.89 -0.11 4.78 0.04 -1.94 0.13 116.94 120.72 3g0g h PHE 601 Ca 0.00 0.03 -0.12 0.00 2.80 0.00 0.00 57.97 60.68 3g0g h PHE 601 Cb 0.00 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 37.86 3g0g h PHE 601 CO 0.00 0.34 -0.45 1.05 -0.60 0.00 0.00 178.31 178.65 3g0g h GLU 602 N 0.76 0.27 0.14 1.51 9.09 -1.90 -0.80 114.58 123.65 3g0g h GLU 602 Ca 0.45 -0.14 -0.01 0.00 0.05 0.00 0.00 59.36 59.72 3g0g h GLU 602 Cb 0.65 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.76 3g0g h GLU 602 CO -0.21 0.67 -0.07 0.28 0.05 0.00 0.00 179.01 179.73 3g0g h VAL 603 N 0.22 0.99 -0.96 -1.06 2.07 -1.41 -3.01 116.25 113.09 3g0g h VAL 603 Ca 0.01 -1.05 0.16 0.00 0.82 0.00 0.00 66.70 66.64 3g0g h VAL 603 Cb 0.89 1.59 -0.10 0.00 -1.52 0.00 0.00 31.29 32.16 3g0g h VAL 603 CO 0.07 0.23 0.57 -0.33 0.02 0.00 0.00 177.57 178.13 3g0g h GLU 604 N -0.74 0.75 -0.00 1.57 5.08 -0.74 -2.39 114.58 118.12 3g0g h GLU 604 Ca -0.02 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.18 3g0g h GLU 604 Cb 0.52 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 3g0g h GLU 604 CO 0.03 0.50 -0.56 -0.44 -1.00 0.00 0.00 179.01 177.55 3g0g h ASP 605 N 0.78 0.01 0.14 1.42 5.19 -1.19 -1.58 116.42 121.19 3g0g h ASP 605 Ca 0.53 -0.01 -0.11 0.00 -0.62 0.00 0.00 57.03 56.82 3g0g h ASP 605 Cb 0.74 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.24 3g0g h ASP 605 CO -0.35 0.57 -0.40 1.56 -3.12 0.00 0.00 179.24 177.50 3g0g h GLN 606 N 0.01 0.34 -0.02 3.56 1.08 -1.29 -1.14 115.11 117.64 3g0g h GLN 606 Ca -0.01 -0.16 -0.01 0.00 -1.45 0.00 0.00 58.65 57.02 3g0g h GLN 606 Cb 0.99 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.41 3g0g h GLN 606 CO 0.07 0.68 -0.03 0.82 -0.95 0.00 0.00 178.83 179.43 3g0g h ILE 607 N 0.28 1.39 -0.92 2.54 2.04 -1.29 -2.71 117.51 118.84 3g0g h ILE 607 Ca 0.03 -1.20 0.06 0.00 1.00 0.00 0.00 64.86 64.75 3g0g h ILE 607 Cb 0.83 2.15 -0.06 0.00 -0.74 0.00 0.00 36.82 38.99 3g0g h ILE 607 CO 0.07 0.32 0.58 -0.08 0.00 0.00 0.00 178.15 179.03 3g0g h GLU 608 N -0.42 1.03 -0.27 2.37 4.57 -1.25 -1.09 114.58 119.51 3g0g h GLU 608 Ca 0.00 -0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.16 3g0g h GLU 608 Cb 0.53 -0.23 -0.03 0.00 -0.16 0.00 0.00 28.75 28.86 3g0g h GLU 608 CO 0.01 0.68 0.06 0.00 -1.18 0.00 0.00 179.01 178.57 3g0g h ALA 609 N 1.42 0.28 -0.96 2.92 0.00 -1.15 0.41 119.26 122.18 3g0g h ALA 609 Ca 0.40 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.40 3g0g h ALA 609 Cb 0.17 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 3g0g h ALA 609 CO -0.17 -0.36 0.63 0.00 0.00 0.00 0.00 179.25 179.35 3g0g h ALA 610 N 1.19 1.40 -0.36 0.00 0.00 -1.14 0.19 119.26 120.54 3g0g h ALA 610 Ca 0.12 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3g0g h ALA 610 Cb 0.12 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3g0g h ALA 610 CO -0.16 0.48 0.17 0.00 0.00 0.00 0.00 179.25 179.75 3g0g h ARG 611 N 1.18 0.52 -0.54 0.00 3.08 0.21 -1.56 114.38 117.27 3g0g h ARG 611 Ca 0.40 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.34 3g0g h ARG 611 Cb 0.07 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 3g0g h ARG 611 CO -0.13 0.47 0.20 1.96 -1.07 0.00 0.00 179.97 181.39 3g0g h GLN 612 N 0.45 0.78 -0.06 0.04 1.08 0.52 -2.01 115.11 115.92 3g0g h GLN 612 Ca 0.12 -0.12 -0.07 0.00 -1.45 0.00 0.00 58.65 57.13 3g0g h GLN 612 Cb 0.12 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 3g0g h GLN 612 CO -0.02 0.66 -0.29 0.74 -0.95 0.00 0.00 178.83 178.97 3g0g h PHE 613 N 0.77 0.11 -0.08 2.96 0.04 -0.28 -2.87 116.94 117.59 3g0g h PHE 613 Ca 0.18 -0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.93 3g0g h PHE 613 Cb 0.18 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.30 3g0g h PHE 613 CO 0.01 0.38 0.03 0.77 -0.60 0.00 0.00 178.31 178.91 3g0g h SER 614 N 0.09 0.11 0.10 2.17 0.02 -0.54 -2.69 113.55 112.81 3g0g h SER 614 Ca 0.01 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 3g0g h SER 614 Cb 0.56 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.08 3g0g h SER 614 CO 0.04 0.24 0.00 0.29 -1.14 0.00 0.00 176.83 176.26 3g0g n LYS 615 N -4.94 0.18 0.03 3.45 5.02 -1.09 -2.66 118.16 118.15 3g0g n LYS 615 Ca -0.06 0.13 0.13 0.00 -2.02 0.00 0.00 58.31 56.49 3g0g n LYS 615 Cb 0.11 -1.50 0.51 0.00 -0.02 0.00 0.00 35.03 34.13 3g0g n LYS 615 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3g0g n MET 616 N -1.18 0.07 0.00 1.97 2.81 -1.01 -4.96 117.12 114.81 3g0g n MET 616 Ca 0.05 0.05 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 3g0g n MET 616 Cb 0.05 -1.58 0.00 0.00 -0.71 0.00 0.00 33.22 30.99 3g0g n MET 616 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g0g n GLY 617 N 1.45 2.83 1.03 3.03 0.00 -1.09 -4.81 105.19 107.64 3g0g n GLY 617 Ca 0.06 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3g0g n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3g0g n PHE 618 N 0.00 0.75 -4.42 1.61 -1.74 -1.26 -4.77 117.46 107.63 3g0g n PHE 618 Ca 0.00 -0.37 -0.34 0.00 -0.56 0.00 0.00 57.45 56.18 3g0g n PHE 618 Cb 0.00 -0.01 -0.13 0.00 1.52 0.00 0.00 39.48 40.86 3g0g n PHE 618 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 3g0g s VAL 619 N -1.28 3.69 -0.54 1.97 1.01 -1.26 -0.61 120.40 123.38 3g0g s VAL 619 Ca 0.37 -0.43 -0.28 0.00 0.00 0.00 0.00 61.98 61.64 3g0g s VAL 619 Cb 0.19 -2.61 0.02 0.00 0.00 0.00 0.00 36.38 33.99 3g0g s VAL 619 CO 0.25 0.49 1.26 -0.62 0.00 0.00 0.00 175.10 176.48 3g0g s ASP 620 N 0.48 6.39 0.00 3.32 3.68 -0.18 -4.73 116.67 125.64 3g0g s ASP 620 Ca -0.04 0.30 0.29 0.00 2.13 0.00 0.00 52.55 55.23 3g0g s ASP 620 Cb -0.15 -2.55 1.64 0.00 -1.45 0.00 0.00 42.92 40.41 3g0g s ASP 620 CO 0.03 -1.49 2.06 -0.46 0.13 0.00 0.00 175.17 175.44 3g0g n ASN 621 N 8.64 0.00 0.01 -0.34 0.23 -1.26 -1.59 115.26 120.95 3g0g n ASN 621 Ca 0.11 -0.59 0.13 0.00 -0.53 0.00 0.00 54.58 53.70 3g0g n ASN 621 Cb 0.49 -0.12 0.52 0.00 -2.08 0.00 0.00 39.78 38.59 3g0g n ASN 621 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3g0g n LYS 622 N -1.12 0.03 -3.22 -3.83 5.02 -1.26 -4.43 118.16 109.34 3g0g n LYS 622 Ca 0.19 0.02 -0.24 0.00 -2.02 0.00 0.00 58.31 56.25 3g0g n LYS 622 Cb 0.15 -1.53 -0.07 0.00 -0.02 0.00 0.00 35.03 33.57 3g0g n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3g0g n ARG 623 N -1.58 1.03 -5.14 1.97 1.74 -0.62 -4.80 116.66 109.26 3g0g n ARG 623 Ca 0.06 -3.47 -0.32 0.00 -0.77 0.00 0.00 57.85 53.36 3g0g n ARG 623 Cb 0.35 -1.40 -0.16 0.00 -1.02 0.00 0.00 32.46 30.22 3g0g n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3g0g s ILE 624 N -1.47 2.29 0.34 0.55 1.01 -1.26 -1.75 121.20 120.91 3g0g s ILE 624 Ca 0.36 -0.96 0.04 0.00 0.00 0.00 0.00 60.65 60.09 3g0g s ILE 624 Cb 0.18 -1.88 -0.06 0.00 0.01 0.00 0.00 42.46 40.71 3g0g s ILE 624 CO -0.09 0.56 0.07 0.00 0.00 0.00 0.00 174.94 175.47 3g0g s ALA 625 N 0.12 2.50 -0.04 9.38 0.00 0.12 -0.91 121.76 132.93 3g0g s ALA 625 Ca -0.11 -1.89 -0.09 0.00 0.00 0.00 0.00 51.96 49.87 3g0g s ALA 625 Cb -0.16 0.66 0.02 0.00 0.00 0.00 0.00 23.12 23.63 3g0g s ALA 625 CO 0.06 -0.31 0.22 -1.50 0.00 0.00 0.00 175.76 174.23 3g0g s ILE 626 N -3.27 0.04 0.09 0.00 2.07 -1.08 -0.70 121.20 118.35 3g0g s ILE 626 Ca 0.34 -0.34 -0.15 0.00 -1.41 0.00 0.00 60.65 59.09 3g0g s ILE 626 Cb 0.08 -0.43 0.03 0.00 0.13 0.00 0.00 42.46 42.27 3g0g s ILE 626 CO 0.15 -0.19 0.36 -1.66 -1.91 0.00 0.00 174.94 171.70 3g0g s TRP 627 N -0.70 -0.16 -0.21 3.50 1.48 -0.33 -1.04 118.94 121.48 3g0g s TRP 627 Ca -0.08 -0.09 -0.29 0.00 -1.06 0.00 0.00 56.10 54.58 3g0g s TRP 627 Cb -0.04 0.19 0.15 0.00 -1.16 0.00 0.00 33.47 32.60 3g0g s TRP 627 CO 0.02 -0.63 1.13 0.20 -4.06 0.00 0.00 176.95 173.60 3g0g s GLY 628 N -2.54 -0.12 0.09 3.67 0.00 -0.47 -2.07 107.32 105.87 3g0g s GLY 628 Ca 0.00 2.40 0.09 0.00 0.00 0.00 0.00 44.72 47.22 3g0g s GLY 628 CO -0.09 1.18 -0.22 0.86 0.00 0.00 0.00 173.10 174.83 3g0g s TRP 629 N -0.89 2.45 0.00 1.90 -0.11 -1.26 -0.96 118.94 120.07 3g0g s TRP 629 Ca 0.02 -0.32 0.00 0.00 1.22 0.00 0.00 56.10 57.03 3g0g s TRP 629 Cb -0.01 -1.35 0.00 0.00 -1.50 0.00 0.00 33.47 30.60 3g0g s TRP 629 CO -0.03 0.30 0.00 0.43 -4.62 0.00 0.00 176.95 173.03 3g0g n SER 630 N 1.16 0.00 -0.35 5.86 7.64 -0.70 0.23 113.62 127.46 3g0g n SER 630 Ca -0.17 0.00 0.27 0.00 1.01 0.00 0.00 58.87 59.98 3g0g n SER 630 Cb 0.53 0.00 0.55 0.00 -1.01 0.00 0.00 64.21 64.28 3g0g n SER 630 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 3g0g h TYR 631 N 0.00 0.60 -0.55 1.43 3.20 -1.87 0.92 116.97 120.70 3g0g h TYR 631 Ca 0.00 0.02 0.10 0.00 3.14 0.00 0.00 58.73 61.99 3g0g h TYR 631 Cb 0.00 -0.17 -0.08 0.00 1.54 0.00 0.00 36.73 38.02 3g0g h TYR 631 CO 0.00 -0.02 0.11 0.78 -1.64 0.00 0.00 178.16 177.39 3g0g h GLY 632 N 0.30 0.68 1.03 1.82 0.00 -0.20 0.01 103.07 106.72 3g0g h GLY 632 Ca 0.65 -0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.92 3g0g h GLY 632 CO -0.32 -0.10 0.29 -1.33 0.00 0.00 0.00 176.54 175.08 3g0g h GLY 633 N 0.24 1.18 0.88 4.60 0.00 0.16 -1.51 103.07 108.62 3g0g h GLY 633 Ca 0.28 -0.65 0.02 0.00 0.00 0.00 0.00 47.33 46.98 3g0g h GLY 633 CO -0.37 0.61 0.07 -1.82 0.00 0.00 0.00 176.54 175.03 3g0g h TYR 634 N 1.06 0.13 -0.31 5.60 5.03 -0.49 -0.79 116.97 127.20 3g0g h TYR 634 Ca 0.24 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.51 3g0g h TYR 634 Cb 0.22 -0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.46 3g0g h TYR 634 CO 0.02 0.07 -0.01 0.28 -1.32 0.00 0.00 178.16 177.20 3g0g h VAL 635 N 0.17 1.26 -1.01 1.81 2.07 -1.00 -0.73 116.25 118.82 3g0g h VAL 635 Ca 0.08 -0.96 0.13 0.00 0.82 0.00 0.00 66.70 66.77 3g0g h VAL 635 Cb 0.04 1.27 -0.09 0.00 -1.52 0.00 0.00 31.29 30.99 3g0g h VAL 635 CO -0.07 0.31 0.63 0.74 0.02 0.00 0.00 177.57 179.20 3g0g h THR 636 N 0.35 0.88 0.02 2.57 2.02 -1.18 0.27 112.91 117.84 3g0g h THR 636 Ca 0.09 -0.33 -0.17 0.00 0.77 0.00 0.00 66.41 66.77 3g0g h THR 636 Cb 0.45 -0.16 0.01 0.00 -1.74 0.00 0.00 68.15 66.72 3g0g h THR 636 CO 0.02 0.17 -0.68 0.28 0.37 0.00 0.00 175.52 175.68 3g0g h SER 637 N 0.96 0.57 -0.70 4.18 0.02 -0.72 -1.96 113.55 115.89 3g0g h SER 637 Ca 0.51 -0.78 0.10 0.00 -0.84 0.00 0.00 61.79 60.78 3g0g h SER 637 Cb 0.56 -0.17 -0.07 0.00 0.14 0.00 0.00 62.40 62.86 3g0g h SER 637 CO -0.29 1.28 0.34 0.24 -1.14 0.00 0.00 176.83 177.26 3g0g h MET 638 N -0.08 0.56 -0.11 3.45 2.07 -0.83 0.32 114.93 120.30 3g0g h MET 638 Ca -0.09 -0.03 -0.01 0.00 -2.07 0.00 0.00 59.70 57.50 3g0g h MET 638 Cb 1.40 -0.13 -0.01 0.00 -1.87 0.00 0.00 31.60 31.00 3g0g h MET 638 CO 0.13 0.37 0.05 0.28 1.07 0.00 0.00 176.91 178.81 3g0g h VAL 639 N 0.57 1.14 0.00 -2.22 2.07 -0.41 -1.66 116.25 115.74 3g0g h VAL 639 Ca 0.35 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 3g0g h VAL 639 Cb 0.39 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3g0g h VAL 639 CO -0.28 0.12 -0.19 -0.07 0.02 0.00 0.00 177.57 177.17 3g0g h LEU 640 N 0.04 0.00 -1.08 2.57 3.38 -1.11 -1.34 115.31 117.77 3g0g h LEU 640 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3g0g h LEU 640 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3g0g h LEU 640 CO -0.00 0.19 0.00 0.61 0.09 0.00 0.00 178.44 179.33 3g0g n GLY 641 N -0.72 0.17 0.14 0.83 0.00 0.08 -4.20 105.19 101.48 3g0g n GLY 641 Ca -0.02 -0.46 0.01 0.00 0.00 0.00 0.00 46.02 45.56 3g0g n GLY 641 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3g0g h SER 642 N 2.49 0.00 -2.14 1.61 4.64 -0.28 -3.42 113.55 116.45 3g0g h SER 642 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 3g0g h SER 642 Cb 0.53 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.66 3g0g h SER 642 CO 0.00 0.56 -0.21 0.61 -0.87 0.00 0.00 176.83 176.93 3g0g n GLY 643 N 1.03 0.38 0.19 -0.77 0.00 -1.26 -4.94 105.19 99.82 3g0g n GLY 643 Ca 0.01 -0.44 0.09 0.00 0.00 0.00 0.00 46.02 45.68 3g0g n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3g0g h SER 644 N -0.64 0.00 0.00 1.61 4.64 -1.90 -3.47 113.55 113.78 3g0g h SER 644 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3g0g h SER 644 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3g0g h SER 644 CO 0.18 0.20 0.00 0.61 -0.87 0.00 0.00 176.83 176.95 3g0g n GLY 645 N 1.04 1.46 0.23 -0.77 0.00 -1.26 -4.94 105.19 100.96 3g0g n GLY 645 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.89 3g0g n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3g0g h VAL 646 N 0.00 1.28 -3.21 1.61 2.07 -1.96 -3.45 116.25 112.59 3g0g h VAL 646 Ca 0.00 -1.84 -0.66 0.00 0.82 0.00 0.00 66.70 65.02 3g0g h VAL 646 Cb 0.00 1.83 -0.15 0.00 -1.52 0.00 0.00 31.29 31.45 3g0g h VAL 646 CO 0.00 0.59 -0.59 -0.36 0.02 0.00 0.00 177.57 177.23 3g0g s PHE 647 N -3.93 3.23 0.18 1.57 0.40 -1.26 -4.59 117.98 113.57 3g0g s PHE 647 Ca -0.11 0.17 0.07 0.00 -0.60 0.00 0.00 56.93 56.47 3g0g s PHE 647 Cb 0.09 -1.89 0.01 0.00 0.51 0.00 0.00 43.02 41.74 3g0g s PHE 647 CO 0.89 0.40 1.40 -0.22 0.70 0.00 0.00 175.22 178.40 3g0g h LYS 648 N 5.58 0.03 -2.32 0.44 3.64 -1.33 -3.45 116.57 119.16 3g0g h LYS 648 Ca -0.47 -0.04 0.16 0.00 -1.27 0.00 0.00 60.65 59.03 3g0g h LYS 648 Cb 1.19 0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 32.93 3g0g h LYS 648 CO 0.59 0.87 0.49 0.00 -2.27 0.00 0.00 179.45 179.13 3g0g s GLY 650 N -2.83 -0.46 -0.10 0.00 0.00 -0.63 -2.64 107.32 100.66 3g0g s GLY 650 Ca 0.10 0.52 0.03 0.00 0.00 0.00 0.00 44.72 45.38 3g0g s GLY 650 CO -0.01 0.17 -0.20 -0.42 0.00 0.00 0.00 173.10 172.64 3g0g s ILE 651 N -3.50 1.78 -0.27 0.90 1.01 -0.20 -1.65 121.20 119.26 3g0g s ILE 651 Ca 0.05 -0.85 0.01 0.00 0.00 0.00 0.00 60.65 59.86 3g0g s ILE 651 Cb -0.02 -1.57 0.05 0.00 0.01 0.00 0.00 42.46 40.94 3g0g s ILE 651 CO -0.07 0.50 -0.08 0.00 0.00 0.00 0.00 174.94 175.29 3g0g s ALA 652 N 0.53 2.64 -0.27 9.38 0.00 -0.44 -1.37 121.76 132.23 3g0g s ALA 652 Ca -0.15 -1.73 -0.12 0.00 0.00 0.00 0.00 51.96 49.95 3g0g s ALA 652 Cb -0.17 -1.68 -0.05 0.00 0.00 0.00 0.00 23.12 21.22 3g0g s ALA 652 CO 0.06 -1.17 0.24 0.08 0.00 0.00 0.00 175.76 174.96 3g0g s VAL 653 N 1.16 5.28 -1.31 0.00 1.01 -0.13 -2.37 120.40 124.04 3g0g s VAL 653 Ca -0.07 0.29 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 3g0g s VAL 653 Cb -0.20 -3.57 0.01 0.00 0.00 0.00 0.00 36.38 32.62 3g0g s VAL 653 CO -0.04 0.25 0.51 0.00 0.00 0.00 0.00 175.10 175.82 3g0g n ALA 654 N 4.93 -2.28 -1.89 5.51 0.00 0.79 -1.72 120.51 125.85 3g0g n ALA 654 Ca -0.13 -0.34 -0.37 0.00 0.00 0.00 0.00 53.44 52.60 3g0g n ALA 654 Cb 0.52 -2.35 -0.06 0.00 0.00 0.00 0.00 19.45 17.56 3g0g n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3g0g s PRO 655 N -6.67 4.50 0.30 0.00 0.04 -1.26 -3.49 135.00 128.42 3g0g s PRO 655 Ca 0.23 1.19 -0.30 0.00 0.04 0.00 0.00 61.00 62.16 3g0g s PRO 655 Cb -0.10 -2.89 -0.11 0.00 0.04 0.00 0.00 34.50 31.44 3g0g s PRO 655 CO 0.91 0.35 1.59 0.08 0.04 0.00 0.00 177.00 179.97 3g0g s VAL 656 N -1.53 2.06 -0.13 -0.36 1.01 -1.26 -4.39 120.40 115.80 3g0g s VAL 656 Ca 0.46 0.06 0.09 0.00 0.00 0.00 0.00 61.98 62.59 3g0g s VAL 656 Cb -0.19 -3.04 -0.14 0.00 0.00 0.00 0.00 36.38 33.01 3g0g s VAL 656 CO 0.24 0.01 -0.00 -1.54 0.00 0.00 0.00 175.10 173.80 3g0g n SER 657 N 2.10 2.10 -3.67 3.32 3.41 -1.26 -4.15 113.62 115.47 3g0g n SER 657 Ca 0.08 -0.02 -0.14 0.00 -0.26 0.00 0.00 58.87 58.52 3g0g n SER 657 Cb 0.37 0.55 -0.08 0.00 -0.26 0.00 0.00 64.21 64.79 3g0g n SER 657 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g0g s ARG 658 N -2.31 0.71 0.18 4.33 1.70 -1.26 -0.60 118.95 121.69 3g0g s ARG 658 Ca -0.10 0.50 0.19 0.00 -0.47 0.00 0.00 55.73 55.85 3g0g s ARG 658 Cb 0.04 0.34 0.84 0.00 -0.57 0.00 0.00 34.95 35.60 3g0g s ARG 658 CO 0.48 -0.14 1.59 0.91 -1.08 0.00 0.00 175.30 177.06 3g0g n TRP 659 N 2.20 0.52 0.63 5.89 7.02 -1.26 -1.24 117.44 131.20 3g0g n TRP 659 Ca -0.16 0.22 0.13 0.00 -1.02 0.00 0.00 57.50 56.67 3g0g n TRP 659 Cb 0.56 -0.85 0.39 0.00 -2.42 0.00 0.00 31.31 28.99 3g0g n TRP 659 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 3g0g n GLU 660 N -1.99 0.26 0.21 -0.99 4.71 -1.26 -3.15 120.64 118.44 3g0g n GLU 660 Ca 0.02 0.20 0.11 0.00 -0.01 0.00 0.00 57.16 57.48 3g0g n GLU 660 Cb 0.17 -1.79 0.17 0.00 -1.01 0.00 0.00 31.44 28.98 3g0g n GLU 660 CO 0.00 0.00 0.00 1.88 0.09 0.00 0.00 177.13 179.10 3g0g h TYR 661 N 0.00 0.00 -2.47 -0.32 0.05 -1.55 -3.28 116.97 109.40 3g0g h TYR 661 Ca 0.00 0.00 -0.45 0.00 0.05 0.00 0.00 58.73 58.33 3g0g h TYR 661 Cb 0.74 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.50 3g0g h TYR 661 CO 0.00 0.06 -0.16 -0.47 -1.05 0.00 0.00 178.16 176.54 3g0g s TYR 662 N -3.19 3.17 0.98 4.88 5.04 -1.19 -4.81 117.35 122.23 3g0g s TYR 662 Ca 0.07 0.09 -0.11 0.00 -2.44 0.00 0.00 57.07 54.68 3g0g s TYR 662 Cb 0.05 -2.25 0.18 0.00 0.35 0.00 0.00 41.96 40.29 3g0g s TYR 662 CO 0.68 -0.29 1.10 0.16 -1.34 0.00 0.00 175.55 175.85 3g0g s ASP 663 N -4.22 2.47 0.03 4.32 1.47 -1.26 0.02 116.67 119.50 3g0g s ASP 663 Ca 0.48 1.91 -0.19 0.00 1.18 0.00 0.00 52.55 55.93 3g0g s ASP 663 Cb -0.10 -2.46 -0.19 0.00 -0.34 0.00 0.00 42.92 39.84 3g0g s ASP 663 CO 0.36 -3.34 1.20 0.77 0.68 0.00 0.00 175.17 174.85 3g0g h SER 664 N -2.03 0.52 0.62 2.11 4.64 -1.43 -2.98 113.55 115.00 3g0g h SER 664 Ca -0.49 -0.65 -0.03 0.00 -0.47 0.00 0.00 61.79 60.15 3g0g h SER 664 Cb 1.29 -0.15 0.01 0.00 -0.31 0.00 0.00 62.40 63.23 3g0g h SER 664 CO 0.46 1.09 -0.30 0.58 -0.87 0.00 0.00 176.83 177.79 3g0g h VAL 665 N -0.01 0.37 0.01 0.95 2.07 -1.93 -0.58 116.25 117.13 3g0g h VAL 665 Ca -0.03 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 3g0g h VAL 665 Cb 1.08 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 3g0g h VAL 665 CO 0.09 0.01 -0.00 0.22 0.02 0.00 0.00 177.57 177.91 3g0g h TYR 666 N -0.89 -0.01 -0.20 1.57 3.20 -1.89 -2.89 116.97 115.86 3g0g h TYR 666 Ca -0.09 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.77 3g0g h TYR 666 Cb 0.66 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 3g0g h TYR 666 CO -0.02 0.34 0.08 1.15 -1.64 0.00 0.00 178.16 178.07 3g0g h THR 667 N -0.35 1.16 0.00 1.81 2.02 -1.51 -2.83 112.91 113.21 3g0g h THR 667 Ca -0.00 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.70 3g0g h THR 667 Cb 0.35 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 3g0g h THR 667 CO 0.00 0.15 0.00 -0.62 0.37 0.00 0.00 175.52 175.43 3g0g n GLU 668 N -4.84 0.18 -0.25 6.66 1.02 -0.23 -0.84 120.64 122.33 3g0g n GLU 668 Ca -0.04 0.27 -0.03 0.00 -0.02 0.00 0.00 57.16 57.34 3g0g n GLU 668 Cb 0.12 -1.76 0.15 0.00 -0.02 0.00 0.00 31.44 29.93 3g0g n GLU 668 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 3g0g h ARG 669 N 0.00 1.08 0.00 3.49 2.43 -1.27 -2.70 114.38 117.41 3g0g h ARG 669 Ca 0.00 -0.15 -0.24 0.00 -0.81 0.00 0.00 59.98 58.79 3g0g h ARG 669 Cb 0.52 -0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 29.82 3g0g h ARG 669 CO 0.00 0.83 -2.12 0.66 -1.51 0.00 0.00 179.97 177.83 3g0g n TYR 670 N -4.33 0.00 0.21 2.20 4.01 -1.03 -4.63 117.16 113.59 3g0g n TYR 670 Ca 0.07 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.89 3g0g n TYR 670 Cb 0.13 -0.75 -0.10 0.00 -0.31 0.00 0.00 39.34 38.30 3g0g n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3g0g n MET 671 N -2.52 1.04 0.00 -0.72 2.81 -0.02 0.10 117.12 117.81 3g0g n MET 671 Ca -0.22 -0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.58 3g0g n MET 671 Cb 0.92 -1.29 0.00 0.00 -0.71 0.00 0.00 33.22 32.14 3g0g n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g0g n GLY 672 N 1.57 -1.05 3.82 3.03 0.00 -1.02 -4.69 105.19 106.85 3g0g n GLY 672 Ca -0.01 -1.20 -0.38 0.00 0.00 0.00 0.00 46.02 44.43 3g0g n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g0g s LEU 673 N 0.00 4.50 -0.57 0.99 2.01 -1.26 -4.40 118.68 119.94 3g0g s LEU 673 Ca 0.00 1.16 -0.07 0.00 0.01 0.00 0.00 54.13 55.23 3g0g s LEU 673 Cb 0.00 -2.84 -0.18 0.00 0.01 0.00 0.00 46.19 43.18 3g0g s LEU 673 CO 0.00 0.27 3.10 -0.81 1.01 0.00 0.00 176.35 179.92 3g0g n PRO 674 N 1.66 2.40 -4.42 1.29 -0.04 -1.26 -2.30 135.00 132.32 3g0g n PRO 674 Ca -0.11 -1.34 -0.26 0.00 -0.04 0.00 0.00 63.50 61.75 3g0g n PRO 674 Cb 0.51 -2.25 -0.11 0.00 -0.04 0.00 0.00 33.50 31.61 3g0g n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3g0g s THR 675 N 1.70 2.44 0.47 0.52 -4.23 -1.26 -4.62 115.64 110.66 3g0g s THR 675 Ca 0.61 -2.10 0.18 0.00 -1.18 0.00 0.00 61.69 59.21 3g0g s THR 675 Cb 0.24 -2.20 0.35 0.00 1.34 0.00 0.00 72.50 72.23 3g0g s THR 675 CO -0.02 -0.18 1.98 -0.65 -0.54 0.00 0.00 174.62 175.21 3g0g h PRO 676 N 2.96 0.25 0.00 3.99 0.11 -1.96 0.89 132.00 138.25 3g0g h PRO 676 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3g0g h PRO 676 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3g0g h PRO 676 CO 0.51 0.17 0.00 -0.85 -0.21 0.00 0.00 178.00 177.62 3g0g n GLU 677 N -4.45 0.43 0.00 1.05 0.00 -1.26 -4.70 120.64 111.71 3g0g n GLU 677 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.27 3g0g n GLU 677 Cb 0.46 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.40 3g0g n GLU 677 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 3g0g n ASP 678 N -1.28 0.00 -1.89 -1.84 4.64 0.28 -5.04 116.55 111.43 3g0g n ASP 678 Ca 0.14 0.00 0.01 0.00 -1.38 0.00 0.00 54.79 53.56 3g0g n ASP 678 Cb 0.23 0.00 0.05 0.00 -1.04 0.00 0.00 41.12 40.36 3g0g n ASP 678 CO 0.00 0.00 0.00 -3.20 -0.82 0.00 0.00 177.20 173.18 3g0g n ASN 679 N 0.00 1.46 -0.21 1.67 5.15 -0.97 -4.89 115.26 117.47 3g0g n ASN 679 Ca 0.00 -2.27 -0.07 0.00 -0.60 0.00 0.00 54.58 51.65 3g0g n ASN 679 Cb 0.00 -0.38 0.03 0.00 -0.53 0.00 0.00 39.78 38.90 3g0g n ASN 679 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3g0g h LEU 680 N 1.59 0.73 -0.83 1.20 5.85 -1.63 -2.84 115.31 119.38 3g0g h LEU 680 Ca -0.15 -0.08 0.13 0.00 0.84 0.00 0.00 57.88 58.63 3g0g h LEU 680 Cb 1.59 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 42.35 3g0g h LEU 680 CO 0.15 0.60 0.43 0.44 -0.34 0.00 0.00 178.44 179.72 3g0g h ASP 681 N 0.80 0.53 1.24 1.25 5.19 -1.90 -1.56 116.42 121.97 3g0g h ASP 681 Ca 0.21 0.08 -0.15 0.00 -0.62 0.00 0.00 57.03 56.55 3g0g h ASP 681 Cb 0.02 -0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.50 3g0g h ASP 681 CO -0.04 0.25 -0.72 -0.74 -3.12 0.00 0.00 179.24 174.87 3g0g h HIS 682 N 0.64 0.00 -0.96 4.55 2.76 -1.91 -1.62 115.15 118.60 3g0g h HIS 682 Ca 0.44 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.62 3g0g h HIS 682 Cb 0.58 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.49 3g0g h HIS 682 CO -0.09 0.72 0.64 1.88 -1.30 0.00 0.00 177.93 179.77 3g0g h TYR 683 N 0.00 1.20 0.00 5.26 0.05 -1.15 -2.20 116.97 120.14 3g0g h TYR 683 Ca -0.01 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.71 3g0g h TYR 683 Cb 1.53 -0.41 -0.01 0.00 1.01 0.00 0.00 36.73 38.85 3g0g h TYR 683 CO 0.00 0.75 -0.42 0.00 -1.05 0.00 0.00 178.16 177.43 3g0g h ARG 684 N 1.29 0.00 0.00 4.88 2.47 -1.12 -3.23 114.38 118.67 3g0g h ARG 684 Ca 0.36 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.08 3g0g h ARG 684 Cb -0.13 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.19 3g0g h ARG 684 CO -0.08 0.42 -0.43 -0.91 0.56 0.00 0.00 179.97 179.53 3g0g h ASN 685 N 0.00 0.00 -0.70 7.04 -0.26 -1.02 -3.39 115.58 117.25 3g0g h ASN 685 Ca -0.00 -0.03 -0.38 0.00 -0.56 0.00 0.00 56.30 55.33 3g0g h ASN 685 Cb 1.18 0.00 -0.22 0.00 -1.06 0.00 0.00 38.32 38.22 3g0g h ASN 685 CO 0.05 0.01 0.30 -1.54 -1.06 0.00 0.00 177.43 175.20 3g0g n SER 686 N -2.74 3.38 -4.85 5.81 3.41 -0.85 -4.99 113.62 112.80 3g0g n SER 686 Ca 0.03 -3.71 -0.35 0.00 -0.26 0.00 0.00 58.87 54.57 3g0g n SER 686 Cb 0.52 -0.75 -0.06 0.00 -0.26 0.00 0.00 64.21 63.66 3g0g n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3g0g s THR 687 N -3.39 4.89 0.18 6.66 -4.23 -1.26 -4.76 115.64 113.74 3g0g s THR 687 Ca 0.52 0.79 -0.10 0.00 -1.18 0.00 0.00 61.69 61.72 3g0g s THR 687 Cb 0.45 -3.73 0.10 0.00 1.34 0.00 0.00 72.50 70.65 3g0g s THR 687 CO 0.05 0.28 1.72 0.58 -0.54 0.00 0.00 174.62 176.71 3g0g h VAL 688 N 2.88 1.25 -0.94 2.29 2.07 -1.19 -3.21 116.25 119.40 3g0g h VAL 688 Ca -0.49 -0.82 0.21 0.00 0.82 0.00 0.00 66.70 66.42 3g0g h VAL 688 Cb 1.20 0.55 -0.12 0.00 -1.52 0.00 0.00 31.29 31.40 3g0g h VAL 688 CO 0.66 0.32 0.51 0.24 0.02 0.00 0.00 177.57 179.31 3g0g h MET 689 N 0.94 0.55 0.00 1.57 2.86 -1.90 -1.15 114.93 117.80 3g0g h MET 689 Ca 0.21 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 3g0g h MET 689 Cb 0.27 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.80 3g0g h MET 689 CO -0.01 0.36 0.00 -1.13 1.06 0.00 0.00 176.91 177.19 3g0g n SER 690 N -4.91 0.24 -0.79 1.22 3.41 -1.21 -2.20 113.62 109.38 3g0g n SER 690 Ca 0.23 0.59 0.07 0.00 -0.26 0.00 0.00 58.87 59.50 3g0g n SER 690 Cb 0.63 -0.63 0.21 0.00 -0.26 0.00 0.00 64.21 64.16 3g0g n SER 690 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3g0g n ARG 691 N -1.80 2.95 -0.07 4.33 1.74 -0.43 -4.70 116.66 118.67 3g0g n ARG 691 Ca 0.01 -2.42 0.12 0.00 -0.77 0.00 0.00 57.85 54.79 3g0g n ARG 691 Cb 0.09 -1.54 0.50 0.00 -1.02 0.00 0.00 32.46 30.50 3g0g n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g0g h ALA 692 N 2.04 2.02 -0.88 7.54 0.00 -1.52 -1.87 119.26 126.58 3g0g h ALA 692 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3g0g h ALA 692 Cb 1.06 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 3g0g h ALA 692 CO 0.10 -0.14 0.58 1.49 0.00 0.00 0.00 179.25 181.28 3g0g h GLU 693 N 0.40 1.11 0.00 0.00 4.57 -1.85 -2.32 114.58 116.49 3g0g h GLU 693 Ca 0.27 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.38 3g0g h GLU 693 Cb 0.52 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 3g0g h GLU 693 CO -0.07 0.73 0.00 0.09 -1.18 0.00 0.00 179.01 178.58 3g0g n ASN 694 N -4.43 0.48 0.08 1.04 3.02 -0.70 -2.88 115.26 111.87 3g0g n ASN 694 Ca 0.11 0.59 0.09 0.00 -0.03 0.00 0.00 54.58 55.34 3g0g n ASN 694 Cb 0.07 -0.70 0.39 0.00 -0.61 0.00 0.00 39.78 38.92 3g0g n ASN 694 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3g0g n PHE 695 N -2.00 0.45 0.34 3.10 3.01 -0.87 -2.13 117.46 119.36 3g0g n PHE 695 Ca 0.04 0.19 0.22 0.00 1.01 0.00 0.00 57.45 58.91 3g0g n PHE 695 Cb 0.26 -0.81 1.16 0.00 -0.01 0.00 0.00 39.48 40.09 3g0g n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 3g0g h LYS 696 N 0.00 0.00 0.00 -1.08 1.57 -1.72 -2.31 116.57 113.03 3g0g h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g0g h LYS 696 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 3g0g h LYS 696 CO 0.00 0.00 -0.48 1.04 -0.57 0.00 0.00 179.45 179.44 3g0g n GLN 697 N -3.06 0.24 -4.37 3.15 6.02 -0.90 -4.96 117.38 113.50 3g0g n GLN 697 Ca -0.03 0.09 -0.19 0.00 -0.01 0.00 0.00 57.00 56.87 3g0g n GLN 697 Cb 0.12 -1.68 -0.10 0.00 1.02 0.00 0.00 30.24 29.60 3g0g n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3g0g s VAL 698 N -3.13 1.18 -0.20 5.09 -7.23 -0.87 -4.93 120.40 110.30 3g0g s VAL 698 Ca 0.08 -2.05 -0.09 0.00 -1.81 0.00 0.00 61.98 58.12 3g0g s VAL 698 Cb 0.14 -2.44 -0.04 0.00 0.56 0.00 0.00 36.38 34.59 3g0g s VAL 698 CO 0.69 -0.26 0.10 -1.61 -0.31 0.00 0.00 175.10 173.71 3g0g s GLU 699 N -3.84 4.01 -0.05 4.82 2.02 -0.84 -4.98 118.70 119.84 3g0g s GLU 699 Ca 0.30 -0.31 0.04 0.00 0.02 0.00 0.00 54.97 55.02 3g0g s GLU 699 Cb 0.06 -3.34 -0.00 0.00 0.10 0.00 0.00 34.13 30.95 3g0g s GLU 699 CO 0.10 0.19 -0.17 -0.47 0.02 0.00 0.00 175.26 174.93 3g0g s TYR 700 N 0.63 1.77 -0.15 1.61 5.04 -1.26 -1.61 117.35 123.39 3g0g s TYR 700 Ca 0.05 -0.54 0.01 0.00 -2.44 0.00 0.00 57.07 54.15 3g0g s TYR 700 Cb -0.13 -1.20 0.00 0.00 0.35 0.00 0.00 41.96 40.99 3g0g s TYR 700 CO 0.01 -0.20 -0.18 -1.17 -1.34 0.00 0.00 175.55 172.67 3g0g s LEU 701 N 0.11 2.31 -0.19 6.97 2.96 -0.66 -0.69 118.68 129.49 3g0g s LEU 701 Ca -0.06 -0.53 0.01 0.00 -0.22 0.00 0.00 54.13 53.33 3g0g s LEU 701 Cb -0.12 -1.51 0.04 0.00 0.50 0.00 0.00 46.19 45.10 3g0g s LEU 701 CO 0.03 0.08 -0.10 -0.22 -1.32 0.00 0.00 176.35 174.82 3g0g s LEU 702 N 0.81 2.17 -0.04 -0.68 2.96 -0.55 -1.33 118.68 122.02 3g0g s LEU 702 Ca -0.06 -0.84 0.05 0.00 -0.22 0.00 0.00 54.13 53.07 3g0g s LEU 702 Cb -0.15 -1.20 -0.01 0.00 0.50 0.00 0.00 46.19 45.33 3g0g s LEU 702 CO -0.01 -0.14 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.04 3g0g s ILE 703 N 1.42 1.70 -0.17 6.68 1.01 -1.00 -1.94 121.20 128.90 3g0g s ILE 703 Ca -0.01 -0.88 -0.14 0.00 0.00 0.00 0.00 60.65 59.62 3g0g s ILE 703 Cb -0.16 -1.44 0.05 0.00 0.01 0.00 0.00 42.46 40.92 3g0g s ILE 703 CO -0.08 0.48 0.45 -2.28 0.00 0.00 0.00 174.94 173.51 3g0g s HIS 704 N -0.17 -0.55 0.21 3.97 2.46 -0.68 -0.15 115.29 120.38 3g0g s HIS 704 Ca -0.01 1.28 -0.30 0.00 0.47 0.00 0.00 55.06 56.50 3g0g s HIS 704 Cb -0.11 0.22 -0.08 0.00 -0.13 0.00 0.00 32.58 32.47 3g0g s HIS 704 CO 0.02 -0.28 1.05 0.20 -2.47 0.00 0.00 174.74 173.25 3g0g s GLY 705 N 0.63 2.99 0.22 1.59 0.00 -1.26 -0.59 107.32 110.90 3g0g s GLY 705 Ca -0.03 0.76 0.11 0.00 0.00 0.00 0.00 44.72 45.56 3g0g s GLY 705 CO -0.04 1.48 1.45 -0.91 0.00 0.00 0.00 173.10 175.08 3g0g h THR 706 N 3.46 1.38 -0.74 0.90 1.35 -0.90 -3.06 112.91 115.30 3g0g h THR 706 Ca -0.45 -2.65 -0.38 0.00 -0.55 0.00 0.00 66.41 62.38 3g0g h THR 706 Cb 1.21 2.49 -0.23 0.00 -1.73 0.00 0.00 68.15 69.89 3g0g h THR 706 CO 0.70 0.72 0.48 0.00 -0.25 0.00 0.00 175.52 177.17 3g0g n ALA 707 N -2.34 4.79 -2.52 6.62 0.00 -0.12 -4.68 120.51 122.27 3g0g n ALA 707 Ca 0.00 -2.15 -0.43 0.00 0.00 0.00 0.00 53.44 50.87 3g0g n ALA 707 Cb 0.77 -1.33 -0.02 0.00 0.00 0.00 0.00 19.45 18.87 3g0g n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3g0g s ASP 708 N -0.71 6.82 0.18 0.00 3.68 -0.96 -4.12 116.67 121.55 3g0g s ASP 708 Ca 0.42 1.19 0.24 0.00 2.13 0.00 0.00 52.55 56.53 3g0g s ASP 708 Cb 0.36 -2.54 0.27 0.00 -1.45 0.00 0.00 42.92 39.55 3g0g s ASP 708 CO 0.08 -0.95 1.29 -2.24 0.13 0.00 0.00 175.17 173.48 3g0g h ASP 709 N 8.63 0.00 0.00 -0.34 2.03 -1.91 -3.36 116.42 121.46 3g0g h ASP 709 Ca -0.24 -0.12 0.00 0.00 -0.73 0.00 0.00 57.03 55.95 3g0g h ASP 709 Cb 1.08 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.58 3g0g h ASP 709 CO 1.03 0.06 0.00 -3.20 -1.03 0.00 0.00 179.24 176.09 3g0g n ASN 710 N -2.39 0.00 -4.36 4.15 4.05 -1.26 -4.71 115.26 110.73 3g0g n ASN 710 Ca 0.02 0.17 -0.45 0.00 0.45 0.00 0.00 54.58 54.77 3g0g n ASN 710 Cb 0.48 -0.50 -0.06 0.00 1.23 0.00 0.00 39.78 40.94 3g0g n ASN 710 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3g0g s VAL 711 N -1.00 5.09 0.40 3.44 1.01 -1.26 -4.85 120.40 123.24 3g0g s VAL 711 Ca 0.00 -1.14 -0.26 0.00 0.00 0.00 0.00 61.98 60.58 3g0g s VAL 711 Cb 0.00 -4.31 -0.09 0.00 0.00 0.00 0.00 36.38 31.98 3g0g s VAL 711 CO 0.00 -0.83 1.34 -1.00 0.00 0.00 0.00 175.10 174.60 3g0g s HIS 712 N 1.97 2.78 0.55 5.22 3.76 -1.26 -4.70 115.29 123.62 3g0g s HIS 712 Ca 0.07 1.37 0.31 0.00 -0.15 0.00 0.00 55.06 56.65 3g0g s HIS 712 Cb -0.26 -3.74 1.47 0.00 1.11 0.00 0.00 32.58 31.17 3g0g s HIS 712 CO 0.06 -2.25 1.88 0.35 -0.85 0.00 0.00 174.74 173.93 3g0g h PHE 713 N 2.75 0.00 -0.83 1.40 3.57 -1.79 0.91 116.94 122.95 3g0g h PHE 713 Ca -0.50 0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.16 3g0g h PHE 713 Cb 1.25 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.84 3g0g h PHE 713 CO 0.53 0.00 -0.24 0.94 -2.23 0.00 0.00 178.31 177.31 3g0g n GLN 714 N -4.12 -0.11 -0.16 1.11 7.27 -1.26 -0.71 117.38 119.40 3g0g n GLN 714 Ca 0.16 1.28 -0.07 0.00 0.07 0.00 0.00 57.00 58.44 3g0g n GLN 714 Cb 0.89 -1.91 0.01 0.00 2.41 0.00 0.00 30.24 31.64 3g0g n GLN 714 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 3g0g h GLN 715 N 0.00 0.63 0.00 3.69 4.20 -1.13 -1.26 115.11 121.24 3g0g h GLN 715 Ca 0.37 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.98 3g0g h GLN 715 Cb 0.57 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 3g0g h GLN 715 CO -0.84 0.44 -0.24 0.77 -0.67 0.00 0.00 178.83 178.29 3g0g h SER 716 N 0.64 0.00 0.43 1.46 0.02 -1.49 -3.01 113.55 111.60 3g0g h SER 716 Ca 0.17 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 3g0g h SER 716 Cb -0.04 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 3g0g h SER 716 CO -0.03 0.24 -0.48 0.00 -1.14 0.00 0.00 176.83 175.42 3g0g h ALA 717 N 1.76 1.17 0.00 3.77 0.00 0.20 -2.57 119.26 123.59 3g0g h ALA 717 Ca -0.00 -0.44 -0.25 0.00 0.00 0.00 0.00 54.91 54.22 3g0g h ALA 717 Cb 0.88 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 3g0g h ALA 717 CO 0.03 0.61 -1.34 1.96 0.00 0.00 0.00 179.25 180.51 3g0g h GLN 718 N 0.04 0.01 0.30 0.00 1.08 -1.30 -2.27 115.11 112.97 3g0g h GLN 718 Ca -0.00 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.17 3g0g h GLN 718 Cb 0.86 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.30 3g0g h GLN 718 CO 0.06 0.77 -0.15 0.82 -0.95 0.00 0.00 178.83 179.39 3g0g h ILE 719 N 0.00 0.70 -0.60 2.54 2.04 -1.42 -2.28 117.51 118.49 3g0g h ILE 719 Ca -0.14 -0.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 3g0g h ILE 719 Cb 1.89 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 38.66 3g0g h ILE 719 CO 0.11 0.00 0.19 0.77 0.00 0.00 0.00 178.15 179.22 3g0g h SER 720 N -0.42 0.88 -0.88 1.72 4.64 -1.51 -1.13 113.55 116.85 3g0g h SER 720 Ca -0.04 -0.21 0.14 0.00 -0.47 0.00 0.00 61.79 61.21 3g0g h SER 720 Cb 0.32 -0.23 -0.09 0.00 -0.31 0.00 0.00 62.40 62.09 3g0g h SER 720 CO 0.07 0.85 0.48 0.50 -0.87 0.00 0.00 176.83 177.86 3g0g h LYS 721 N 0.86 0.69 -0.20 4.77 3.64 -1.36 0.11 116.57 125.07 3g0g h LYS 721 Ca 0.19 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.44 3g0g h LYS 721 Cb 0.29 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3g0g h LYS 721 CO -0.01 0.45 -0.24 0.00 -2.27 0.00 0.00 179.45 177.39 3g0g h ALA 722 N 1.55 0.30 -0.77 5.00 0.00 -0.64 0.15 119.26 124.85 3g0g h ALA 722 Ca 0.47 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 55.03 3g0g h ALA 722 Cb 0.61 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 3g0g h ALA 722 CO -0.33 0.27 0.50 -0.07 0.00 0.00 0.00 179.25 179.61 3g0g h LEU 723 N 0.19 0.83 0.05 0.00 3.38 -1.01 -1.88 115.31 116.87 3g0g h LEU 723 Ca 0.03 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3g0g h LEU 723 Cb 0.80 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 3g0g h LEU 723 CO 0.06 0.59 -0.07 0.58 0.09 0.00 0.00 178.44 179.68 3g0g h VAL 724 N 0.98 0.83 -0.31 1.22 2.07 -0.32 0.18 116.25 120.91 3g0g h VAL 724 Ca 0.30 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.88 3g0g h VAL 724 Cb -0.03 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 3g0g h VAL 724 CO -0.09 0.00 0.21 0.44 0.02 0.00 0.00 177.57 178.15 3g0g h ASP 725 N -0.15 0.13 -0.63 0.57 3.45 -0.12 0.78 116.42 120.46 3g0g h ASP 725 Ca 0.01 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.47 3g0g h ASP 725 Cb 0.16 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 38.90 3g0g h ASP 725 CO -0.04 0.09 0.00 1.33 -1.57 0.00 0.00 179.24 179.05 3g0g n VAL 726 N -4.48 0.83 -3.01 -1.35 0.24 -0.76 -5.00 118.33 104.80 3g0g n VAL 726 Ca 0.04 -0.91 -0.12 0.00 -2.04 0.00 0.00 64.34 61.31 3g0g n VAL 726 Cb 0.27 0.64 0.06 0.00 -1.47 0.00 0.00 33.84 33.35 3g0g n VAL 726 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3g0g n GLY 727 N 1.62 -0.19 3.58 7.63 0.00 0.53 -5.01 105.19 113.34 3g0g n GLY 727 Ca 0.23 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 3g0g n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g0g s VAL 728 N -3.26 4.89 0.14 1.61 1.01 -0.64 -5.03 120.40 119.11 3g0g s VAL 728 Ca 0.04 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.73 3g0g s VAL 728 Cb -0.00 -3.27 -0.07 0.00 0.00 0.00 0.00 36.38 33.04 3g0g s VAL 728 CO 0.53 0.36 1.02 -0.62 0.00 0.00 0.00 175.10 176.39 3g0g s ASP 729 N 1.14 7.40 0.28 3.32 3.68 -1.26 -4.63 116.67 126.60 3g0g s ASP 729 Ca 0.06 1.92 -0.10 0.00 2.13 0.00 0.00 52.55 56.56 3g0g s ASP 729 Cb -0.14 -2.59 0.00 0.00 -1.45 0.00 0.00 42.92 38.74 3g0g s ASP 729 CO 0.04 -0.13 0.49 0.72 0.13 0.00 0.00 175.17 176.43 3g0g s PHE 730 N -0.10 0.56 0.18 -5.34 -0.12 -1.26 -4.73 117.98 107.17 3g0g s PHE 730 Ca 0.48 -0.91 0.06 0.00 -0.05 0.00 0.00 56.93 56.51 3g0g s PHE 730 Cb -0.26 0.15 -0.04 0.00 -0.63 0.00 0.00 43.02 42.24 3g0g s PHE 730 CO 0.32 -1.07 0.07 -0.65 -0.05 0.00 0.00 175.22 173.83 3g0g s GLN 731 N -3.60 2.64 0.09 1.99 -1.52 0.14 -5.00 119.66 114.39 3g0g s GLN 731 Ca 0.25 -1.01 -0.07 0.00 -1.95 0.00 0.00 55.36 52.57 3g0g s GLN 731 Cb -0.01 -2.48 -0.01 0.00 -0.22 0.00 0.00 33.01 30.29 3g0g s GLN 731 CO 0.12 0.46 0.15 0.00 -0.25 0.00 0.00 175.29 175.77 3g0g s ALA 732 N -1.78 -0.00 -0.23 6.09 0.00 -1.26 -1.49 121.76 123.09 3g0g s ALA 732 Ca 0.29 -0.80 -0.12 0.00 0.00 0.00 0.00 51.96 51.33 3g0g s ALA 732 Cb -0.09 0.49 0.08 0.00 0.00 0.00 0.00 23.12 23.59 3g0g s ALA 732 CO 0.21 -0.49 0.56 1.41 0.00 0.00 0.00 175.76 177.45 3g0g s MET 733 N -3.89 0.55 0.09 0.00 0.00 -0.82 -4.89 119.30 110.35 3g0g s MET 733 Ca 0.07 1.06 0.04 0.00 0.00 0.00 0.00 55.69 56.86 3g0g s MET 733 Cb 0.05 0.14 -0.04 0.00 0.00 0.00 0.00 34.83 34.98 3g0g s MET 733 CO -0.09 -0.16 0.07 1.67 0.00 0.00 0.00 175.02 176.50 3g0g s TRP 734 N 1.69 3.14 -0.29 4.11 -2.14 -1.26 -1.69 118.94 122.50 3g0g s TRP 734 Ca -0.09 0.04 0.01 0.00 2.66 0.00 0.00 56.10 58.72 3g0g s TRP 734 Cb -0.07 -1.59 0.06 0.00 -3.10 0.00 0.00 33.47 28.77 3g0g s TRP 734 CO -0.17 0.51 -0.04 0.71 -2.66 0.00 0.00 176.95 175.31 3g0g s TYR 735 N -1.42 3.31 -0.04 1.66 2.02 0.24 -4.92 117.35 118.21 3g0g s TYR 735 Ca 0.29 -2.17 -0.30 0.00 -0.37 0.00 0.00 57.07 54.52 3g0g s TYR 735 Cb -0.12 -2.13 -0.07 0.00 -0.40 0.00 0.00 41.96 39.24 3g0g s TYR 735 CO 0.21 -0.85 1.84 0.99 -1.57 0.00 0.00 175.55 176.17 3g0g s THR 736 N 1.16 3.28 -0.01 -0.71 2.01 -1.26 -0.79 115.64 119.31 3g0g s THR 736 Ca -0.05 0.33 0.00 0.00 0.31 0.00 0.00 61.69 62.28 3g0g s THR 736 Cb -0.20 -3.23 0.00 0.00 0.01 0.00 0.00 72.50 69.08 3g0g s THR 736 CO -0.03 -0.05 0.00 0.47 -0.69 0.00 0.00 174.62 174.32 3g0g n ASP 737 N 7.78 -4.08 -4.87 3.53 10.43 -1.26 -4.89 116.55 123.19 3g0g n ASP 737 Ca 0.20 0.00 -0.31 0.00 2.57 0.00 0.00 54.79 57.25 3g0g n ASP 737 Cb 0.42 -1.59 -0.05 0.00 1.84 0.00 0.00 41.12 41.75 3g0g n ASP 737 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 3g0g s GLU 738 N -0.75 3.82 0.00 -1.24 0.41 -1.04 -4.57 118.70 115.32 3g0g s GLU 738 Ca 0.00 0.35 0.00 0.00 -0.41 0.00 0.00 54.97 54.91 3g0g s GLU 738 Cb 0.00 -2.55 0.00 0.00 -1.78 0.00 0.00 34.13 29.80 3g0g s GLU 738 CO 0.00 0.20 0.00 -0.40 -0.49 0.00 0.00 175.26 174.57 3g0g n ASP 739 N -0.51 0.47 0.21 -0.19 3.85 -1.26 -0.94 116.55 118.18 3g0g n ASP 739 Ca 0.01 -0.48 0.17 0.00 -0.71 0.00 0.00 54.79 53.78 3g0g n ASP 739 Cb 0.53 0.00 0.83 0.00 -1.35 0.00 0.00 41.12 41.13 3g0g n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.01 0.00 0.00 177.20 175.45 3g0g h HIS 740 N 0.11 0.00 0.00 2.11 -0.00 -1.91 -1.72 115.15 113.75 3g0g h HIS 740 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.36 3g0g h HIS 740 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.41 3g0g h HIS 740 CO 0.00 0.00 -0.42 0.78 -0.00 0.00 0.00 177.93 178.29 3g0g h GLY 741 N 0.00 0.00 -6.94 5.26 0.00 -1.99 -3.48 103.07 95.92 3g0g h GLY 741 Ca 0.08 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.84 3g0g h GLY 741 CO -0.00 0.00 -0.90 1.39 0.00 0.00 0.00 176.54 177.03 3g0g n ILE 742 N -2.96 -1.15 1.04 2.60 5.41 -0.65 -4.86 119.36 118.78 3g0g n ILE 742 Ca 0.02 -0.47 0.12 0.00 1.00 0.00 0.00 62.75 63.41 3g0g n ILE 742 Cb 0.56 -1.10 0.08 0.00 -0.71 0.00 0.00 39.64 38.48 3g0g n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3g0g n ALA 743 N -4.39 3.15 -1.77 -1.39 0.00 -1.26 -3.64 120.51 111.21 3g0g n ALA 743 Ca -0.27 -0.63 -0.39 0.00 0.00 0.00 0.00 53.44 52.15 3g0g n ALA 743 Cb 0.63 -0.84 -0.02 0.00 0.00 0.00 0.00 19.45 19.22 3g0g n ALA 743 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3g0g s SER 744 N -2.32 6.57 0.08 0.00 1.04 -1.26 -4.74 113.70 113.08 3g0g s SER 744 Ca 0.23 2.38 -0.16 0.00 0.48 0.00 0.00 55.95 58.88 3g0g s SER 744 Cb 0.19 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.65 3g0g s SER 744 CO 0.48 -0.64 0.79 -0.24 0.98 0.00 0.00 173.24 174.60 3g0g n SER 745 N 0.19 -0.54 -0.03 7.02 2.88 -1.26 -0.16 113.62 121.72 3g0g n SER 745 Ca 0.04 0.91 -0.15 0.00 -1.33 0.00 0.00 58.87 58.33 3g0g n SER 745 Cb 0.46 -0.12 -0.09 0.00 -0.75 0.00 0.00 64.21 63.71 3g0g n SER 745 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 3g0g h THR 746 N 0.00 1.40 -0.38 2.46 1.35 -1.98 -2.40 112.91 113.37 3g0g h THR 746 Ca 0.08 -1.78 0.06 0.00 -0.55 0.00 0.00 66.41 64.22 3g0g h THR 746 Cb 0.21 2.28 -0.05 0.00 -1.73 0.00 0.00 68.15 68.86 3g0g h THR 746 CO -0.48 0.52 0.08 0.00 -0.25 0.00 0.00 175.52 175.39 3g0g h ALA 747 N 0.44 0.40 -0.54 6.62 0.00 -1.65 0.50 119.26 125.03 3g0g h ALA 747 Ca -0.03 0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.99 3g0g h ALA 747 Cb 1.05 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 3g0g h ALA 747 CO 0.08 -0.32 0.30 1.25 0.00 0.00 0.00 179.25 180.56 3g0g h HIS 748 N 0.20 0.56 -0.20 0.00 2.76 -0.56 0.69 115.15 118.61 3g0g h HIS 748 Ca 0.18 0.02 -0.12 0.00 -2.20 0.00 0.00 60.37 58.24 3g0g h HIS 748 Cb 0.21 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.98 3g0g h HIS 748 CO -0.19 0.30 -0.41 1.96 -1.30 0.00 0.00 177.93 178.29 3g0g h GLN 749 N 0.59 0.46 0.05 5.26 4.20 -0.89 -3.04 115.11 121.74 3g0g h GLN 749 Ca 0.23 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 3g0g h GLN 749 Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 3g0g h GLN 749 CO -0.13 0.79 -0.02 1.25 -0.67 0.00 0.00 178.83 180.05 3g0g h HIS 750 N 0.38 -0.06 -0.18 2.96 2.76 0.80 -2.83 115.15 118.99 3g0g h HIS 750 Ca 0.03 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.18 3g0g h HIS 750 Cb 0.88 0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.85 3g0g h HIS 750 CO 0.03 0.08 0.02 0.97 -1.30 0.00 0.00 177.93 177.73 3g0g h ILE 751 N -0.19 1.23 -0.26 6.26 2.10 -0.86 -0.48 117.51 125.31 3g0g h ILE 751 Ca -0.01 -0.75 -0.02 0.00 1.08 0.00 0.00 64.86 65.16 3g0g h ILE 751 Cb 0.17 1.38 -0.01 0.00 -1.09 0.00 0.00 36.82 37.27 3g0g h ILE 751 CO 0.01 0.23 0.09 1.88 -1.08 0.00 0.00 178.15 179.28 3g0g h TYR 752 N 0.08 0.36 -0.19 2.19 -1.99 -1.65 0.50 116.97 116.26 3g0g h TYR 752 Ca 0.05 -0.01 -0.15 0.00 2.00 0.00 0.00 58.73 60.63 3g0g h TYR 752 Cb 0.33 -0.11 0.00 0.00 2.00 0.00 0.00 36.73 38.94 3g0g h TYR 752 CO 0.02 0.30 -0.46 1.15 -0.00 0.00 0.00 178.16 179.17 3g0g h THR 753 N 0.36 1.32 -0.76 -2.88 2.02 -1.20 -1.65 112.91 110.13 3g0g h THR 753 Ca 0.09 -1.70 -0.03 0.00 0.77 0.00 0.00 66.41 65.54 3g0g h THR 753 Cb 0.10 1.89 -0.03 0.00 -1.74 0.00 0.00 68.15 68.37 3g0g h THR 753 CO -0.01 0.53 0.35 -0.74 0.37 0.00 0.00 175.52 176.02 3g0g h HIS 754 N 0.34 1.12 -0.31 3.16 6.17 -0.29 -2.44 115.15 122.89 3g0g h HIS 754 Ca -0.00 -0.06 -0.15 0.00 0.71 0.00 0.00 60.37 60.86 3g0g h HIS 754 Cb 1.07 -0.34 -0.01 0.00 2.52 0.00 0.00 27.41 30.65 3g0g h HIS 754 CO 0.09 0.83 -0.43 0.52 0.71 0.00 0.00 177.93 179.65 3g0g h MET 755 N 1.08 0.77 -0.67 5.26 2.07 -0.91 -1.99 114.93 120.55 3g0g h MET 755 Ca 0.26 -0.42 0.02 0.00 -2.07 0.00 0.00 59.70 57.49 3g0g h MET 755 Cb 0.15 0.02 -0.04 0.00 -1.87 0.00 0.00 31.60 29.86 3g0g h MET 755 CO -0.03 1.05 0.43 0.77 1.07 0.00 0.00 176.91 180.19 3g0g h SER 756 N 0.62 0.72 0.13 1.22 0.02 -1.10 0.40 113.55 115.56 3g0g h SER 756 Ca 0.04 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 3g0g h SER 756 Cb 0.99 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.36 3g0g h SER 756 CO 0.09 0.51 -0.06 0.45 -1.14 0.00 0.00 176.83 176.68 3g0g h HIS 757 N 0.86 -0.16 -0.39 3.45 3.86 -1.28 0.15 115.15 121.63 3g0g h HIS 757 Ca 0.26 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.54 3g0g h HIS 757 Cb -0.04 0.05 -0.07 0.00 1.06 0.00 0.00 27.41 28.41 3g0g h HIS 757 CO -0.04 -0.05 -0.06 0.35 0.86 0.00 0.00 177.93 179.00 3g0g h PHE 758 N -0.23 -0.14 -0.01 2.45 3.57 -0.97 0.48 116.94 122.10 3g0g h PHE 758 Ca -0.02 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 3g0g h PHE 758 Cb 0.18 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 3g0g h PHE 758 CO -0.05 -0.13 0.00 0.82 -2.23 0.00 0.00 178.31 176.72 3g0g h ILE 759 N 0.04 1.20 -0.83 1.41 1.08 -0.77 -0.51 117.51 119.13 3g0g h ILE 759 Ca 0.19 -0.60 0.13 0.00 -0.39 0.00 0.00 64.86 64.18 3g0g h ILE 759 Cb 0.28 1.60 -0.06 0.00 -3.07 0.00 0.00 36.82 35.57 3g0g h ILE 759 CO -0.37 0.16 0.54 0.11 -0.69 0.00 0.00 178.15 177.90 3g0g h LYS 760 N -0.24 0.64 -0.13 2.37 1.57 -0.40 0.49 116.57 120.87 3g0g h LYS 760 Ca 0.00 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.65 3g0g h LYS 760 Cb 0.26 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3g0g h LYS 760 CO 0.00 0.42 -0.27 0.37 -0.57 0.00 0.00 179.45 179.40 3g0g h GLN 761 N 0.66 0.41 -0.97 3.15 4.15 -0.69 0.28 115.11 122.11 3g0g h GLN 761 Ca 0.40 -0.27 0.07 0.00 0.77 0.00 0.00 58.65 59.62 3g0g h GLN 761 Cb 0.64 0.04 -0.07 0.00 0.21 0.00 0.00 27.48 28.30 3g0g h GLN 761 CO -0.17 0.87 0.63 0.00 -1.93 0.00 0.00 178.83 178.24 3g0g n PHE 763 N -4.50 0.50 -3.36 0.00 3.72 0.10 -4.95 117.46 108.96 3g0g n PHE 763 Ca 0.15 -0.25 -0.24 0.00 -0.05 0.00 0.00 57.45 57.06 3g0g n PHE 763 Cb 0.19 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.78 3g0g n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3g0g n SER 764 N 0.71 -5.75 -4.67 4.37 7.64 -0.84 -4.99 113.62 110.08 3g0g n SER 764 Ca 0.15 -0.44 -0.35 0.00 1.01 0.00 0.00 58.87 59.24 3g0g n SER 764 Cb 0.37 -4.61 -0.09 0.00 -1.01 0.00 0.00 64.21 58.87 3g0g n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3g0g s LEU 765 N -6.94 4.00 0.00 -3.43 1.43 0.93 -5.03 118.68 109.64 3g0g s LEU 765 Ca 0.45 0.14 0.22 0.00 -1.03 0.00 0.00 54.13 53.92 3g0g s LEU 765 Cb -0.21 -2.03 1.33 0.00 0.03 0.00 0.00 46.19 45.31 3g0g s LEU 765 CO 0.56 0.16 1.70 -0.81 0.23 0.00 0.00 176.35 178.20