#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 2.41 -0.39 0.58 -4.23 -1.26 -1.21 115.64 111.53 3g0g s THR 42 Ca 0.00 -2.07 -0.28 0.00 -1.18 0.00 0.00 61.69 58.16 3g0g s THR 42 Cb 0.00 -2.75 -0.02 0.00 1.34 0.00 0.00 72.50 71.07 3g0g s THR 42 CO 0.00 -0.18 1.83 -0.47 -0.54 0.00 0.00 174.62 175.26 3g0g s TYR 43 N -2.57 1.76 0.45 3.99 5.04 -1.26 -4.90 117.35 119.86 3g0g s TYR 43 Ca 0.34 0.69 0.01 0.00 -2.44 0.00 0.00 57.07 55.67 3g0g s TYR 43 Cb 0.02 -4.10 0.00 0.00 0.35 0.00 0.00 41.96 38.23 3g0g s TYR 43 CO 0.18 -2.80 0.67 0.95 -1.34 0.00 0.00 175.55 173.21 3g0g s THR 44 N 7.46 3.80 0.29 4.34 -4.23 -1.26 -4.07 115.64 121.98 3g0g s THR 44 Ca 0.78 -0.57 -0.01 0.00 -1.18 0.00 0.00 61.69 60.71 3g0g s THR 44 Cb -0.20 -3.40 0.19 0.00 1.34 0.00 0.00 72.50 70.43 3g0g s THR 44 CO 0.31 -0.27 1.88 0.25 -0.54 0.00 0.00 174.62 176.25 3g0g h LEU 45 N 0.39 0.81 -0.68 4.79 5.85 -1.94 -1.83 115.31 122.71 3g0g h LEU 45 Ca -0.45 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.11 3g0g h LEU 45 Cb 1.26 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.05 3g0g h LEU 45 CO 0.56 0.72 0.23 0.74 -0.34 0.00 0.00 178.44 180.35 3g0g h THR 46 N 0.88 1.25 -0.48 1.05 2.02 -1.97 0.19 112.91 115.85 3g0g h THR 46 Ca 0.21 -0.84 0.08 0.00 0.77 0.00 0.00 66.41 66.62 3g0g h THR 46 Cb 0.16 0.52 -0.06 0.00 -1.74 0.00 0.00 68.15 67.03 3g0g h THR 46 CO -0.02 0.33 0.11 0.44 0.37 0.00 0.00 175.52 176.75 3g0g h ASP 47 N 0.98 0.04 0.69 4.18 3.32 -1.74 0.67 116.42 124.55 3g0g h ASP 47 Ca 0.22 0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.32 3g0g h ASP 47 Cb 0.28 0.10 0.01 0.00 0.22 0.00 0.00 39.33 39.93 3g0g h ASP 47 CO -0.01 0.05 -0.33 0.22 -1.72 0.00 0.00 179.24 177.45 3g0g h TYR 48 N 0.25 -0.85 -0.78 4.55 3.20 -1.10 -1.21 116.97 121.03 3g0g h TYR 48 Ca 0.24 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.04 3g0g h TYR 48 Cb 0.30 0.28 -0.03 0.00 1.54 0.00 0.00 36.73 38.82 3g0g h TYR 48 CO -0.21 -0.50 0.30 -0.07 -1.64 0.00 0.00 178.16 176.04 3g0g h LEU 49 N -1.04 1.07 -0.00 2.82 3.38 0.02 -1.57 115.31 119.98 3g0g h LEU 49 Ca -0.09 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.71 3g0g h LEU 49 Cb 0.73 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3g0g h LEU 49 CO 0.15 0.95 -0.15 0.29 0.09 0.00 0.00 178.44 179.78 3g0g n LYS 50 N -4.28 0.01 -3.36 1.13 4.01 0.23 -4.96 118.16 110.94 3g0g n LYS 50 Ca 0.07 -0.00 -0.18 0.00 -0.51 0.00 0.00 58.31 57.69 3g0g n LYS 50 Cb 0.19 -1.50 0.07 0.00 -0.51 0.00 0.00 35.03 33.28 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 -1.50 -5.28 -0.03 4.39 4.05 -0.59 -4.94 115.26 111.36 3g0g n ASN 51 Ca 0.07 -0.73 -0.11 0.00 0.45 0.00 0.00 54.58 54.25 3g0g n ASN 51 Cb 0.34 -4.93 0.02 0.00 1.23 0.00 0.00 39.78 36.44 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 -1.38 1.30 -3.61 -0.44 2.02 -1.52 -3.38 112.91 105.91 3g0g h THR 52 Ca -0.61 -1.73 -0.72 0.00 0.77 0.00 0.00 66.41 64.11 3g0g h THR 52 Cb 1.32 1.66 -0.33 0.00 -1.74 0.00 0.00 68.15 69.07 3g0g h THR 52 CO 0.46 0.55 -0.20 -0.31 0.37 0.00 0.00 175.52 176.40 3g0g s TYR 53 N -4.10 3.56 0.30 3.16 2.02 -1.26 -5.07 117.35 115.96 3g0g s TYR 53 Ca -0.09 -2.55 -0.24 0.00 -0.37 0.00 0.00 57.07 53.82 3g0g s TYR 53 Cb 0.11 -3.38 -0.10 0.00 -0.40 0.00 0.00 41.96 38.19 3g0g s TYR 53 CO 0.86 -0.87 0.89 0.50 -1.57 0.00 0.00 175.55 175.35 3g0g s ARG 54 N -0.16 4.48 -0.31 -0.62 3.52 -1.26 -5.04 118.95 119.56 3g0g s ARG 54 Ca 0.18 1.20 -0.18 0.00 -0.13 0.00 0.00 55.73 56.80 3g0g s ARG 54 Cb -0.16 -2.78 -0.02 0.00 -1.56 0.00 0.00 34.95 30.43 3g0g s ARG 54 CO -0.06 0.29 0.52 -0.51 -0.81 0.00 0.00 175.30 174.73 3g0g s LEU 55 N -2.10 4.18 0.11 -0.88 1.43 -1.26 -4.81 118.68 115.35 3g0g s LEU 55 Ca 0.49 0.26 -0.30 0.00 -1.03 0.00 0.00 54.13 53.55 3g0g s LEU 55 Cb -0.18 -2.63 -0.06 0.00 0.03 0.00 0.00 46.19 43.35 3g0g s LEU 55 CO 0.22 -0.39 1.08 -0.54 0.23 0.00 0.00 176.35 176.96 3g0g s LYS 56 N 2.37 4.57 0.38 1.70 1.02 -1.26 -5.06 119.74 123.47 3g0g s LYS 56 Ca 0.20 1.63 0.05 0.00 0.02 0.00 0.00 55.97 57.88 3g0g s LYS 56 Cb -0.15 -3.34 0.05 0.00 -0.52 0.00 0.00 37.83 33.86 3g0g s LYS 56 CO 0.11 -0.01 0.42 1.28 -0.92 0.00 0.00 175.35 176.24 3g0g n LEU 57 N 3.10 0.00 -2.96 3.17 4.32 -1.26 -4.90 117.00 118.47 3g0g n LEU 57 Ca 0.05 -1.81 -0.14 0.00 -0.02 0.00 0.00 56.01 54.08 3g0g n LEU 57 Cb 0.48 -0.17 -0.01 0.00 -1.62 0.00 0.00 43.42 42.10 3g0g n LEU 57 CO 0.53 -0.57 -0.02 0.00 -1.22 0.00 0.00 177.39 176.11 3g0g n TYR 58 N -1.64 -2.26 -2.47 -1.77 4.19 -1.26 -4.95 117.16 106.99 3g0g n TYR 58 Ca 0.05 -2.41 -0.42 0.00 3.31 0.00 0.00 57.90 58.44 3g0g n TYR 58 Cb 0.41 0.83 -0.03 0.00 0.49 0.00 0.00 39.34 41.04 3g0g n TYR 58 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 3g0g s SER 59 N -0.92 7.14 0.04 2.98 0.15 -1.26 -5.05 113.70 116.79 3g0g s SER 59 Ca 0.33 1.98 -0.00 0.00 0.70 0.00 0.00 55.95 58.95 3g0g s SER 59 Cb 0.15 -2.58 -0.03 0.00 -1.71 0.00 0.00 66.02 61.85 3g0g s SER 59 CO -0.17 -0.41 -0.04 -1.48 1.20 0.00 0.00 173.24 172.35 3g0g s LEU 60 N 0.84 2.36 -0.20 3.45 0.05 -1.26 -4.51 118.68 119.42 3g0g s LEU 60 Ca 0.56 -0.74 0.01 0.00 0.05 0.00 0.00 54.13 54.01 3g0g s LEU 60 Cb -0.28 0.10 0.04 0.00 -2.05 0.00 0.00 46.19 44.01 3g0g s LEU 60 CO 0.30 -0.43 -0.09 -0.13 -0.55 0.00 0.00 176.35 175.46 3g0g s ARG 61 N -2.64 1.86 0.16 1.48 0.52 -1.18 -4.96 118.95 114.20 3g0g s ARG 61 Ca -0.04 -0.81 -0.31 0.00 -0.52 0.00 0.00 55.73 54.05 3g0g s ARG 61 Cb -0.02 -2.37 -0.10 0.00 0.52 0.00 0.00 34.95 32.99 3g0g s ARG 61 CO -0.05 -0.45 1.51 -1.58 0.02 0.00 0.00 175.30 174.75 3g0g s TRP 62 N 1.44 3.10 -0.18 -0.53 0.52 -1.26 -1.38 118.94 120.66 3g0g s TRP 62 Ca -0.02 0.75 0.16 0.00 0.02 0.00 0.00 56.10 57.01 3g0g s TRP 62 Cb -0.16 -3.85 -0.22 0.00 -1.15 0.00 0.00 33.47 28.08 3g0g s TRP 62 CO -0.08 -3.08 0.06 -0.89 0.02 0.00 0.00 176.95 172.98 3g0g n ILE 63 N 3.78 1.25 -0.97 2.03 -0.00 0.51 -4.95 119.36 121.01 3g0g n ILE 63 Ca 0.12 -0.77 0.00 0.00 -0.00 0.00 0.00 62.75 62.11 3g0g n ILE 63 Cb 0.40 -0.53 0.00 0.00 -0.00 0.00 0.00 39.64 39.51 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 -2.68 0.37 -0.25 4.38 3.41 -1.15 -5.00 113.62 112.70 3g0g n SER 64 Ca -0.30 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.42 3g0g n SER 64 Cb 1.09 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 65.09 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 1.38 -0.20 4.04 4.64 -1.26 -2.17 116.55 122.98 3g0g n ASP 65 Ca 0.00 -1.12 0.00 0.00 -1.38 0.00 0.00 54.79 52.29 3g0g n ASP 65 Cb 0.00 0.56 0.00 0.00 -1.04 0.00 0.00 41.12 40.64 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 -0.74 0.00 -3.96 -0.67 1.44 -1.26 -4.37 115.22 105.65 3g0g n HIS 66 Ca 0.08 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.68 3g0g n HIS 66 Cb 0.39 0.07 -0.12 0.00 0.12 0.00 0.00 29.99 30.45 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 0.24 0.13 -1.40 2.02 -1.26 -1.62 118.70 116.82 3g0g s GLU 67 Ca 0.00 -0.42 -0.09 0.00 0.02 0.00 0.00 54.97 54.47 3g0g s GLU 67 Cb 0.00 0.01 -0.00 0.00 0.10 0.00 0.00 34.13 34.24 3g0g s GLU 67 CO 0.00 -0.02 0.26 1.52 0.02 0.00 0.00 175.26 177.04 3g0g s TYR 68 N -0.96 0.24 0.17 1.61 -0.85 -1.08 -0.36 117.35 116.12 3g0g s TYR 68 Ca -0.10 -0.63 0.02 0.00 -0.52 0.00 0.00 57.07 55.84 3g0g s TYR 68 Cb -0.07 -0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.21 3g0g s TYR 68 CO -0.01 -0.65 0.31 -0.51 -1.52 0.00 0.00 175.55 173.17 3g0g s LEU 69 N -2.91 4.32 -0.12 -3.49 1.43 -0.48 -1.03 118.68 116.41 3g0g s LEU 69 Ca 0.11 0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 53.34 3g0g s LEU 69 Cb 0.04 -2.93 0.06 0.00 0.03 0.00 0.00 46.19 43.38 3g0g s LEU 69 CO -0.05 0.02 0.26 -0.47 0.23 0.00 0.00 176.35 176.34 3g0g s TYR 70 N -1.79 -0.40 0.00 0.29 5.04 -0.97 -3.09 117.35 116.43 3g0g s TYR 70 Ca 0.35 0.93 0.00 0.00 -2.44 0.00 0.00 57.07 55.90 3g0g s TYR 70 Cb -0.11 0.00 0.00 0.00 0.35 0.00 0.00 41.96 42.20 3g0g s TYR 70 CO 0.29 -0.32 0.00 1.17 -1.34 0.00 0.00 175.55 175.35 3g0g n LYS 71 N 4.95 1.10 0.07 4.97 4.81 -1.26 -1.74 118.16 131.06 3g0g n LYS 71 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.31 3g0g n LYS 71 Cb 0.51 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.56 3g0g n LYS 71 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 3g0g n GLN 72 N -0.32 0.00 -1.52 1.64 6.02 -1.26 -4.89 117.38 117.05 3g0g n GLN 72 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3g0g n GLN 72 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 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 -2.78 -4.86 -4.18 1.08 4.13 -1.26 -5.22 115.26 102.17 3g0g n ASN 75 Ca 0.00 0.91 -0.33 0.00 1.68 0.00 0.00 54.58 56.84 3g0g n ASN 75 Cb 0.00 -3.46 -0.16 0.00 -1.54 0.00 0.00 39.78 34.62 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 -2.56 2.30 0.39 2.41 1.01 -0.57 -4.97 121.20 119.22 3g0g s ILE 76 Ca 0.00 -0.87 0.08 0.00 0.00 0.00 0.00 60.65 59.85 3g0g s ILE 76 Cb 0.00 -1.97 -0.04 0.00 0.01 0.00 0.00 42.46 40.47 3g0g s ILE 76 CO 0.00 0.53 0.25 -0.76 0.00 0.00 0.00 174.94 174.96 3g0g s LEU 77 N 1.10 3.28 -0.11 2.97 2.01 -0.71 -0.76 118.68 126.46 3g0g s LEU 77 Ca 0.00 -0.86 0.02 0.00 0.01 0.00 0.00 54.13 53.31 3g0g s LEU 77 Cb -0.14 -1.78 0.01 0.00 0.01 0.00 0.00 46.19 44.30 3g0g s LEU 77 CO -0.07 -0.52 -0.17 -0.69 1.01 0.00 0.00 176.35 175.92 3g0g s VAL 78 N -2.50 1.59 -0.04 -1.59 1.01 -0.94 -2.29 120.40 115.65 3g0g s VAL 78 Ca 0.43 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.71 3g0g s VAL 78 Cb -0.01 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 3g0g s VAL 78 CO 0.25 0.46 -0.01 -0.36 0.00 0.00 0.00 175.10 175.44 3g0g s PHE 79 N 0.87 3.08 -0.40 5.22 0.40 -0.19 -2.83 117.98 124.14 3g0g s PHE 79 Ca -0.09 0.11 -0.16 0.00 -0.60 0.00 0.00 56.93 56.20 3g0g s PHE 79 Cb -0.15 -1.71 0.01 0.00 0.51 0.00 0.00 43.02 41.67 3g0g s PHE 79 CO -0.00 0.45 0.35 1.21 0.70 0.00 0.00 175.22 177.92 3g0g s ASN 80 N -1.22 6.14 0.32 1.36 3.04 -1.23 -2.64 114.94 120.70 3g0g s ASN 80 Ca 0.16 -0.69 0.02 0.00 0.04 0.00 0.00 52.86 52.40 3g0g s ASN 80 Cb -0.11 -2.18 0.54 0.00 -1.54 0.00 0.00 41.25 37.96 3g0g s ASN 80 CO 0.06 -0.46 1.87 0.00 -3.04 0.00 0.00 177.10 175.53 3g0g h ALA 81 N 8.63 1.33 -0.58 1.71 0.00 -1.70 0.24 119.26 128.89 3g0g h ALA 81 Ca -0.28 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 54.55 3g0g h ALA 81 Cb 1.12 -0.18 -0.11 0.00 0.00 0.00 0.00 17.79 18.62 3g0g h ALA 81 CO 0.74 0.47 -0.31 0.93 0.00 0.00 0.00 179.25 181.07 3g0g h GLU 82 N 0.61 -0.14 0.00 0.00 4.39 -1.93 -3.41 114.58 114.10 3g0g h GLU 82 Ca 0.14 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.85 3g0g h GLU 82 Cb 0.29 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 3g0g h GLU 82 CO 0.00 -0.10 0.00 0.66 -1.16 0.00 0.00 179.01 178.42 3g0g n TYR 83 N -5.43 -0.33 0.00 4.33 4.01 -1.09 -5.09 117.16 113.56 3g0g n TYR 83 Ca 0.04 0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 3g0g n TYR 83 Cb 0.35 0.14 0.00 0.00 -0.31 0.00 0.00 39.34 39.52 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 2.99 -0.95 3.62 2.72 0.00 0.82 -4.99 105.19 109.40 3g0g n GLY 84 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 0.00 6.03 -0.22 1.61 4.22 -1.26 -4.61 114.94 120.71 3g0g s ASN 85 Ca 0.00 1.81 -0.14 0.00 -2.14 0.00 0.00 52.86 52.38 3g0g s ASN 85 Cb 0.00 -2.52 -0.04 0.00 1.28 0.00 0.00 41.25 39.96 3g0g s ASN 85 CO 0.00 -1.51 0.34 -0.94 -2.04 0.00 0.00 177.10 172.95 3g0g s SER 86 N 5.78 6.33 -0.00 3.54 1.04 -1.26 -3.56 113.70 125.57 3g0g s SER 86 Ca 0.84 0.38 0.05 0.00 0.48 0.00 0.00 55.95 57.70 3g0g s SER 86 Cb -0.30 -2.20 -0.01 0.00 0.10 0.00 0.00 66.02 63.61 3g0g s SER 86 CO 0.34 -0.07 -0.15 -0.94 0.98 0.00 0.00 173.24 173.40 3g0g s SER 87 N 1.16 1.73 0.48 7.02 1.04 -1.13 -4.99 113.70 119.02 3g0g s SER 87 Ca 0.16 -0.29 -0.24 0.00 0.48 0.00 0.00 55.95 56.05 3g0g s SER 87 Cb -0.15 -0.18 -0.07 0.00 0.10 0.00 0.00 66.02 65.72 3g0g s SER 87 CO 0.08 0.16 1.41 -0.69 0.98 0.00 0.00 173.24 175.18 3g0g s VAL 88 N -0.41 2.08 -0.03 5.02 1.01 -1.26 -2.20 120.40 124.60 3g0g s VAL 88 Ca 0.05 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.10 3g0g s VAL 88 Cb -0.06 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.26 3g0g s VAL 88 CO -0.00 0.01 -0.02 0.33 0.00 0.00 0.00 175.10 175.41 3g0g n PHE 89 N -0.42 0.00 -3.81 5.22 -0.00 0.06 -4.82 117.46 113.69 3g0g n PHE 89 Ca 0.07 0.00 -0.18 0.00 -0.00 0.00 0.00 57.45 57.34 3g0g n PHE 89 Cb 0.43 -0.13 -0.17 0.00 -0.00 0.00 0.00 39.48 39.61 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 -5.05 0.84 0.57 -2.13 1.02 -0.31 -5.00 118.68 108.62 3g0g s LEU 90 Ca -0.04 0.01 -0.18 0.00 0.02 0.00 0.00 54.13 53.94 3g0g s LEU 90 Cb 0.01 -0.19 -0.04 0.00 0.02 0.00 0.00 46.19 45.99 3g0g s LEU 90 CO 0.08 -0.15 1.12 -0.70 0.02 0.00 0.00 176.35 176.72 3g0g s GLU 91 N 1.41 3.21 0.13 1.70 2.56 -1.26 -1.51 118.70 124.95 3g0g s GLU 91 Ca -0.05 1.55 0.16 0.00 0.00 0.00 0.00 54.97 56.63 3g0g s GLU 91 Cb -0.13 -1.99 0.72 0.00 2.00 0.00 0.00 34.13 34.73 3g0g s GLU 91 CO -0.03 -0.95 1.50 0.27 -0.56 0.00 0.00 175.26 175.49 3g0g n ASN 92 N -1.60 0.31 -0.47 -1.70 0.23 -1.26 -2.68 115.26 108.08 3g0g n ASN 92 Ca 0.11 0.59 0.08 0.00 -0.53 0.00 0.00 54.58 54.84 3g0g n ASN 92 Cb 0.51 -0.65 0.19 0.00 -2.08 0.00 0.00 39.78 37.75 3g0g n ASN 92 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 3g0g n SER 93 N -1.86 2.90 -0.08 0.53 3.41 -1.26 -4.60 113.62 112.66 3g0g n SER 93 Ca 0.02 -3.15 -0.12 0.00 -0.26 0.00 0.00 58.87 55.36 3g0g n SER 93 Cb 0.14 -0.49 0.01 0.00 -0.26 0.00 0.00 64.21 63.61 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 0.79 1.28 -0.60 6.66 2.02 -1.89 -3.21 112.91 117.96 3g0g h THR 94 Ca 0.01 -1.60 -0.44 0.00 0.77 0.00 0.00 66.41 65.16 3g0g h THR 94 Cb 1.21 1.47 -0.34 0.00 -1.74 0.00 0.00 68.15 68.75 3g0g h THR 94 CO 0.11 0.52 -0.73 0.49 0.37 0.00 0.00 175.52 176.28 3g0g n PHE 95 N -4.04 2.20 0.24 3.16 3.72 -1.26 -4.77 117.46 116.72 3g0g n PHE 95 Ca -0.02 -2.08 0.11 0.00 -0.05 0.00 0.00 57.45 55.40 3g0g n PHE 95 Cb 0.55 -0.34 0.61 0.00 -0.94 0.00 0.00 39.48 39.37 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 1.94 0.00 -1.68 4.37 -0.00 -1.80 -2.91 116.42 116.33 3g0g h ASP 96 Ca 0.30 0.00 -0.53 0.00 -0.00 0.00 0.00 57.03 56.80 3g0g h ASP 96 Cb 1.43 0.00 -0.41 0.00 -0.00 0.00 0.00 39.33 40.34 3g0g h ASP 96 CO 0.62 0.18 -0.85 -0.62 -0.00 0.00 0.00 179.24 178.57 3g0g n GLU 97 N -3.62 2.66 0.12 0.28 1.02 -1.26 -4.83 120.64 115.00 3g0g n GLU 97 Ca -0.01 -4.23 -0.01 0.00 -0.02 0.00 0.00 57.16 52.88 3g0g n GLU 97 Cb 0.31 -1.99 0.03 0.00 -0.02 0.00 0.00 31.44 29.76 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 2.82 0.00 0.00 -0.32 -0.00 -1.87 -3.47 116.94 114.09 3g0g h PHE 98 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.13 3g0g h PHE 98 Cb 0.86 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.81 3g0g h PHE 98 CO 0.72 0.68 0.00 0.41 -0.00 0.00 0.00 178.31 180.12 3g0g n GLY 99 N 1.05 2.91 3.65 2.40 0.00 -1.26 -5.01 105.19 108.93 3g0g n GLY 99 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 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 1.83 -0.22 1.61 3.76 -1.26 -5.14 115.29 113.57 3g0g s HIS 100 Ca 0.00 -1.11 -0.06 0.00 -0.15 0.00 0.00 55.06 53.74 3g0g s HIS 100 Cb 0.00 -1.41 -0.02 0.00 1.11 0.00 0.00 32.58 32.26 3g0g s HIS 100 CO 0.00 -0.01 0.02 0.45 -0.85 0.00 0.00 174.74 174.35 3g0g s SER 101 N -3.76 4.89 -0.42 1.40 0.15 -1.26 -5.07 113.70 109.63 3g0g s SER 101 Ca 0.14 -0.23 -0.28 0.00 0.70 0.00 0.00 55.95 56.28 3g0g s SER 101 Cb 0.02 -1.86 0.02 0.00 -1.71 0.00 0.00 66.02 62.50 3g0g s SER 101 CO 0.08 0.01 1.08 -0.63 1.20 0.00 0.00 173.24 174.98 3g0g s ILE 102 N 1.33 4.36 -0.03 6.45 1.09 -1.26 -4.36 121.20 128.78 3g0g s ILE 102 Ca 0.04 1.33 -0.25 0.00 -1.10 0.00 0.00 60.65 60.67 3g0g s ILE 102 Cb -0.15 -4.51 -0.20 0.00 -1.06 0.00 0.00 42.46 36.55 3g0g s ILE 102 CO 0.02 -0.79 1.19 -1.13 -0.10 0.00 0.00 174.94 174.13 3g0g h ASN 103 N 8.80 -0.05 -5.05 3.58 -1.24 -0.85 -3.48 115.58 117.28 3g0g h ASN 103 Ca -0.22 -0.46 -0.06 0.00 0.71 0.00 0.00 56.30 56.27 3g0g h ASN 103 Cb 1.06 0.01 -0.14 0.00 0.73 0.00 0.00 38.32 39.98 3g0g h ASN 103 CO 1.08 0.45 -0.02 -0.62 -1.29 0.00 0.00 177.43 177.02 3g0g s ASP 104 N -5.63 -0.33 0.23 1.15 2.15 -1.15 -5.03 116.67 108.06 3g0g s ASP 104 Ca -0.15 -0.11 0.11 0.00 0.43 0.00 0.00 52.55 52.83 3g0g s ASP 104 Cb 0.01 0.48 -0.05 0.00 -0.30 0.00 0.00 42.92 43.07 3g0g s ASP 104 CO 0.64 -0.80 -0.22 -0.72 -0.17 0.00 0.00 175.17 173.90 3g0g s TYR 105 N -3.23 2.25 -0.28 -5.34 1.13 -1.26 -1.38 117.35 109.23 3g0g s TYR 105 Ca -0.01 -0.36 0.01 0.00 -1.41 0.00 0.00 57.07 55.30 3g0g s TYR 105 Cb 0.00 -1.05 0.17 0.00 -1.10 0.00 0.00 41.96 39.98 3g0g s TYR 105 CO -0.08 0.58 0.49 0.45 -2.51 0.00 0.00 175.55 174.48 3g0g s SER 106 N -3.05 -0.59 0.45 -0.18 0.15 -0.82 -4.99 113.70 104.67 3g0g s SER 106 Ca 0.24 0.28 -0.22 0.00 0.70 0.00 0.00 55.95 56.96 3g0g s SER 106 Cb -0.06 1.61 -0.09 0.00 -1.71 0.00 0.00 66.02 65.77 3g0g s SER 106 CO 0.12 -0.30 1.02 -0.63 1.20 0.00 0.00 173.24 174.64 3g0g s ILE 107 N 2.70 3.93 0.50 6.45 -1.09 -1.26 -0.46 121.20 131.96 3g0g s ILE 107 Ca 0.14 1.28 -0.19 0.00 -2.23 0.00 0.00 60.65 59.64 3g0g s ILE 107 Cb -0.14 -3.56 -0.08 0.00 -1.58 0.00 0.00 42.46 37.10 3g0g s ILE 107 CO -0.23 -0.18 1.04 -0.94 -1.23 0.00 0.00 174.94 173.40 3g0g s SER 108 N -1.91 6.28 0.44 3.58 1.04 0.74 -4.92 113.70 118.96 3g0g s SER 108 Ca 0.63 1.89 0.30 0.00 0.48 0.00 0.00 55.95 59.25 3g0g s SER 108 Cb -0.16 -2.55 1.61 0.00 0.10 0.00 0.00 66.02 65.01 3g0g s SER 108 CO 0.20 -0.82 1.90 -0.65 0.98 0.00 0.00 173.24 174.85 3g0g h PRO 109 N 1.37 0.00 -0.33 4.02 0.11 -1.82 -0.33 132.00 135.03 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 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3g0g h PRO 109 CO 0.59 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.98 3g0g n ASP 110 N -2.54 3.23 -1.89 -2.05 3.85 -1.13 -4.70 116.55 111.32 3g0g n ASP 110 Ca -0.02 -1.97 -0.20 0.00 -0.71 0.00 0.00 54.79 51.89 3g0g n ASP 110 Cb 0.05 -0.21 -0.05 0.00 -1.35 0.00 0.00 41.12 39.57 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 1.46 0.84 0.08 6.12 0.00 -0.13 -4.86 105.19 108.68 3g0g n GLY 111 Ca 0.19 -0.04 0.01 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.65 0.65 -4.12 1.61 6.02 -1.26 -4.82 117.38 112.81 3g0g n GLN 112 Ca -0.22 0.05 -0.15 0.00 -0.01 0.00 0.00 57.00 56.67 3g0g n GLN 112 Cb 0.67 -1.66 -0.14 0.00 1.02 0.00 0.00 30.24 30.12 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 -3.01 0.40 -0.16 1.08 0.08 -1.26 -0.20 117.98 114.91 3g0g s PHE 113 Ca -0.06 -0.08 -0.01 0.00 0.12 0.00 0.00 56.93 56.90 3g0g s PHE 113 Cb 0.09 -0.26 -0.01 0.00 -0.57 0.00 0.00 43.02 42.28 3g0g s PHE 113 CO 0.84 -0.01 -0.11 -1.50 -0.10 0.00 0.00 175.22 174.35 3g0g s ILE 114 N -0.12 3.08 0.02 0.64 2.07 -0.57 -0.19 121.20 126.14 3g0g s ILE 114 Ca 0.02 -0.62 -0.20 0.00 -1.41 0.00 0.00 60.65 58.43 3g0g s ILE 114 Cb -0.02 -2.33 -0.06 0.00 0.13 0.00 0.00 42.46 40.18 3g0g s ILE 114 CO -0.00 0.49 0.58 -0.22 -1.91 0.00 0.00 174.94 173.88 3g0g s LEU 115 N 0.81 4.45 -0.16 8.50 2.96 0.39 -1.40 118.68 134.23 3g0g s LEU 115 Ca -0.04 1.19 0.00 0.00 -0.22 0.00 0.00 54.13 55.06 3g0g s LEU 115 Cb -0.15 -2.91 0.00 0.00 0.50 0.00 0.00 46.19 43.63 3g0g s LEU 115 CO 0.01 0.16 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.28 3g0g s LEU 116 N -0.49 2.42 -0.22 -0.68 1.43 0.60 -1.95 118.68 119.79 3g0g s LEU 116 Ca 0.30 -0.50 -0.08 0.00 -1.03 0.00 0.00 54.13 52.82 3g0g s LEU 116 Cb -0.19 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 3g0g s LEU 116 CO 0.18 0.07 0.09 -0.70 0.23 0.00 0.00 176.35 176.21 3g0g s GLU 117 N 0.89 3.86 0.21 1.70 2.12 -0.48 -2.02 118.70 124.98 3g0g s GLU 117 Ca -0.04 -0.39 -0.08 0.00 0.36 0.00 0.00 54.97 54.82 3g0g s GLU 117 Cb -0.15 -3.33 -0.02 0.00 0.26 0.00 0.00 34.13 30.90 3g0g s GLU 117 CO -0.02 0.03 0.33 1.52 -0.54 0.00 0.00 175.26 176.58 3g0g s TYR 118 N 1.04 0.59 -1.16 5.30 1.13 -0.51 -0.06 117.35 123.68 3g0g s TYR 118 Ca 0.05 -0.92 -0.03 0.00 -1.41 0.00 0.00 57.07 54.76 3g0g s TYR 118 Cb -0.14 -0.09 -0.02 0.00 -1.10 0.00 0.00 41.96 40.61 3g0g s TYR 118 CO 0.03 -0.82 0.93 0.09 -2.51 0.00 0.00 175.55 173.27 3g0g n ASN 119 N -0.30 -3.71 -4.66 -0.18 3.02 -1.26 -0.11 115.26 108.06 3g0g n ASN 119 Ca -0.02 -0.69 -0.43 0.00 -0.03 0.00 0.00 54.58 53.41 3g0g n ASN 119 Cb 0.63 -4.95 -0.02 0.00 -0.61 0.00 0.00 39.78 34.82 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 -3.41 2.61 -0.26 3.10 5.04 -1.26 -4.06 117.35 119.11 3g0g s TYR 120 Ca 0.18 0.79 0.00 0.00 -2.44 0.00 0.00 57.07 55.60 3g0g s TYR 120 Cb -0.03 -3.62 0.07 0.00 0.35 0.00 0.00 41.96 38.74 3g0g s TYR 120 CO 0.75 -2.29 0.01 0.08 -1.34 0.00 0.00 175.55 172.76 3g0g s VAL 121 N 3.63 1.38 0.39 3.14 1.01 -0.18 -5.00 120.40 124.77 3g0g s VAL 121 Ca 0.60 -1.36 -0.27 0.00 0.00 0.00 0.00 61.98 60.95 3g0g s VAL 121 Cb -0.25 -1.82 -0.09 0.00 0.00 0.00 0.00 36.38 34.22 3g0g s VAL 121 CO 0.19 -0.32 1.38 -0.75 0.00 0.00 0.00 175.10 175.60 3g0g s LYS 122 N 1.42 4.02 0.00 2.72 2.20 -1.26 -1.53 119.74 127.31 3g0g s LYS 122 Ca 0.01 2.33 0.00 0.00 -0.36 0.00 0.00 55.97 57.95 3g0g s LYS 122 Cb -0.18 -2.85 0.00 0.00 -1.51 0.00 0.00 37.83 33.28 3g0g s LYS 122 CO -0.11 -0.51 0.00 0.94 -0.36 0.00 0.00 175.35 175.31 3g0g n GLN 123 N 0.28 0.00 0.00 4.03 7.27 -0.69 -4.90 117.38 123.37 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 0.42 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.07 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 0.01 3.69 5.03 -1.21 -4.99 117.44 119.98 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 0.09 0.00 -1.03 0.00 0.00 31.31 30.37 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 0.50 0.00 -0.99 2.43 -1.99 -3.38 114.38 110.95 3g0g h ARG 125 Ca 0.00 -0.29 -0.04 0.00 -0.81 0.00 0.00 59.98 58.84 3g0g h ARG 125 Cb 0.00 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3g0g h ARG 125 CO 0.00 0.88 -1.13 0.72 -1.51 0.00 0.00 179.97 178.93 3g0g n HIS 126 N -3.98 0.00 -1.74 2.20 8.25 -1.26 -5.06 115.22 113.63 3g0g n HIS 126 Ca -0.02 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.05 3g0g n HIS 126 Cb 0.57 -0.09 0.04 0.00 1.12 0.00 0.00 29.99 31.63 3g0g n HIS 126 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3g0g n SER 127 N -2.62 2.65 -3.18 0.41 3.41 -1.26 -4.76 113.62 108.27 3g0g n SER 127 Ca -0.04 0.98 -0.07 0.00 -0.26 0.00 0.00 58.87 59.47 3g0g n SER 127 Cb 0.54 -1.57 0.01 0.00 -0.26 0.00 0.00 64.21 62.94 3g0g n SER 127 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 3g0g s TYR 128 N -1.29 0.05 -0.00 7.33 -0.85 -1.26 -1.71 117.35 119.62 3g0g s TYR 128 Ca 0.71 -0.64 0.04 0.00 -0.52 0.00 0.00 57.07 56.66 3g0g s TYR 128 Cb -0.42 0.79 -0.01 0.00 0.38 0.00 0.00 41.96 42.70 3g0g s TYR 128 CO 0.49 -1.40 -0.12 0.99 -1.52 0.00 0.00 175.55 174.00 3g0g s THR 129 N -2.62 0.93 0.18 -3.49 2.01 -0.58 -4.58 115.64 107.49 3g0g s THR 129 Ca 0.15 -0.57 -0.14 0.00 0.31 0.00 0.00 61.69 61.45 3g0g s THR 129 Cb -0.05 -0.79 0.01 0.00 0.01 0.00 0.00 72.50 71.68 3g0g s THR 129 CO 0.09 0.22 0.42 0.00 -0.69 0.00 0.00 174.62 174.66 3g0g s ALA 130 N -0.36 -0.52 0.05 7.40 0.00 -0.68 -1.01 121.76 126.64 3g0g s ALA 130 Ca 0.04 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.46 3g0g s ALA 130 Cb -0.05 0.85 -0.04 0.00 0.00 0.00 0.00 23.12 23.88 3g0g s ALA 130 CO -0.00 -0.73 0.23 -1.12 0.00 0.00 0.00 175.76 174.13 3g0g s SER 131 N -2.92 6.39 -0.02 0.00 0.01 0.84 -1.37 113.70 116.64 3g0g s SER 131 Ca 0.13 0.36 0.01 0.00 1.31 0.00 0.00 55.95 57.76 3g0g s SER 131 Cb 0.01 -2.00 0.01 0.00 0.21 0.00 0.00 66.02 64.25 3g0g s SER 131 CO -0.01 0.19 -0.04 -0.31 0.41 0.00 0.00 173.24 173.47 3g0g s TYR 132 N -1.46 0.53 -0.03 2.43 1.51 -1.26 -1.43 117.35 117.65 3g0g s TYR 132 Ca 0.33 -0.11 0.05 0.00 -1.01 0.00 0.00 57.07 56.33 3g0g s TYR 132 Cb -0.13 -0.43 -0.01 0.00 -0.11 0.00 0.00 41.96 41.28 3g0g s TYR 132 CO 0.24 -0.08 -0.19 -0.51 -1.11 0.00 0.00 175.55 173.90 3g0g s ASP 133 N 0.37 2.25 0.02 2.29 1.01 -0.86 -4.30 116.67 117.46 3g0g s ASP 133 Ca -0.04 -0.36 -0.02 0.00 0.71 0.00 0.00 52.55 52.84 3g0g s ASP 133 Cb -0.08 -0.43 -0.04 0.00 1.01 0.00 0.00 42.92 43.39 3g0g s ASP 133 CO -0.00 0.20 0.19 -0.63 0.21 0.00 0.00 175.17 175.14 3g0g s ILE 134 N -0.23 5.41 -0.06 0.77 1.01 -1.26 -0.29 121.20 126.54 3g0g s ILE 134 Ca 0.02 -0.25 0.01 0.00 0.00 0.00 0.00 60.65 60.43 3g0g s ILE 134 Cb -0.09 -3.57 0.02 0.00 0.01 0.00 0.00 42.46 38.82 3g0g s ILE 134 CO 0.01 0.25 -0.07 -0.47 0.00 0.00 0.00 174.94 174.66 3g0g s TYR 135 N -1.40 1.08 -0.03 3.97 5.04 -0.50 -1.96 117.35 123.57 3g0g s TYR 135 Ca 0.30 -0.39 -0.30 0.00 -2.44 0.00 0.00 57.07 54.25 3g0g s TYR 135 Cb -0.13 -0.89 -0.03 0.00 0.35 0.00 0.00 41.96 41.26 3g0g s TYR 135 CO 0.22 -0.28 1.10 0.34 -1.34 0.00 0.00 175.55 175.60 3g0g s ASP 136 N 1.02 7.18 0.23 4.32 -1.08 -0.43 -1.51 116.67 126.41 3g0g s ASP 136 Ca -0.09 1.76 0.19 0.00 -0.52 0.00 0.00 52.55 53.89 3g0g s ASP 136 Cb -0.14 -2.57 0.05 0.00 -1.46 0.00 0.00 42.92 38.80 3g0g s ASP 136 CO -0.00 -0.45 1.20 -0.07 0.52 0.00 0.00 175.17 176.37 3g0g h LEU 137 N 7.49 0.00 0.12 -1.34 3.38 -0.90 -0.64 115.31 123.41 3g0g h LEU 137 Ca -0.37 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 3g0g h LEU 137 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 3g0g h LEU 137 CO 0.83 0.27 -0.06 0.78 0.09 0.00 0.00 178.44 180.35 3g0g h ASN 138 N 0.00 -0.13 1.13 -0.43 2.35 -1.90 -3.34 115.58 113.26 3g0g h ASN 138 Ca -0.04 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 3g0g h ASN 138 Cb 1.24 0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.64 3g0g h ASN 138 CO 0.03 0.37 0.00 0.11 -1.65 0.00 0.00 177.43 176.29 3g0g h LYS 139 N -1.04 0.00 -6.83 0.81 1.57 -1.93 -3.48 116.57 105.67 3g0g h LYS 139 Ca -0.02 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.23 3g0g h LYS 139 Cb 0.17 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3g0g h LYS 139 CO 0.03 0.00 -1.08 2.89 -0.57 0.00 0.00 179.45 180.72 3g0g n ARG 140 N -2.32 -1.12 -3.67 3.15 1.85 -0.26 -5.02 116.66 109.27 3g0g n ARG 140 Ca 0.04 0.52 -0.10 0.00 -1.00 0.00 0.00 57.85 57.31 3g0g n ARG 140 Cb 0.34 -2.26 -0.04 0.00 -1.05 0.00 0.00 32.46 29.45 3g0g n ARG 140 CO 0.00 0.00 0.00 1.14 -0.01 0.00 0.00 177.63 178.76 3g0g s GLN 141 N -5.75 1.25 0.13 2.89 -2.07 -1.13 -4.98 119.66 110.00 3g0g s GLN 141 Ca 0.15 -0.77 -0.30 0.00 -1.82 0.00 0.00 55.36 52.63 3g0g s GLN 141 Cb -0.09 0.51 -0.06 0.00 -1.09 0.00 0.00 33.01 32.28 3g0g s GLN 141 CO 0.92 -0.52 1.07 -0.51 -1.32 0.00 0.00 175.29 174.93 3g0g s LEU 142 N -2.84 4.46 0.10 2.60 2.01 -1.26 -1.31 118.68 122.44 3g0g s LEU 142 Ca 0.06 1.97 -0.30 0.00 0.01 0.00 0.00 54.13 55.87 3g0g s LEU 142 Cb 0.00 -3.59 -0.06 0.00 0.01 0.00 0.00 46.19 42.55 3g0g s LEU 142 CO -0.07 -0.22 1.09 -0.63 1.01 0.00 0.00 176.35 177.52 3g0g s ILE 143 N 0.12 4.20 -0.15 -0.59 1.09 -0.83 -4.94 121.20 120.11 3g0g s ILE 143 Ca 0.50 1.71 0.08 0.00 -1.10 0.00 0.00 60.65 61.85 3g0g s ILE 143 Cb -0.27 -4.10 -0.12 0.00 -1.06 0.00 0.00 42.46 36.92 3g0g s ILE 143 CO 0.32 0.21 0.24 0.35 -0.10 0.00 0.00 174.94 175.96 3g0g n THR 144 N 3.21 0.00 -4.40 2.92 -2.24 -1.26 -4.71 114.28 107.79 3g0g n THR 144 Ca 0.05 -0.23 -0.28 0.00 -2.27 0.00 0.00 64.05 61.32 3g0g n THR 144 Cb 0.48 0.56 -0.12 0.00 -2.10 0.00 0.00 70.33 69.14 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 -2.29 1.45 -1.14 -0.78 1.03 -1.26 -4.73 118.70 110.99 3g0g s GLU 145 Ca -0.01 -1.43 -0.06 0.00 0.03 0.00 0.00 54.97 53.51 3g0g s GLU 145 Cb 0.06 -1.87 0.01 0.00 -0.80 0.00 0.00 34.13 31.52 3g0g s GLU 145 CO 0.34 0.43 0.73 0.39 -1.33 0.00 0.00 175.26 175.82 3g0g n GLU 146 N 0.62 -5.20 -1.87 -4.83 -0.58 -1.26 -4.71 120.64 102.81 3g0g n GLU 146 Ca -0.16 0.68 -0.33 0.00 -0.42 0.00 0.00 57.16 56.93 3g0g n GLU 146 Cb 0.54 -5.17 0.04 0.00 -0.57 0.00 0.00 31.44 26.29 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 -5.77 2.92 0.07 3.49 0.52 -1.26 -4.86 118.95 114.05 3g0g s ARG 147 Ca 0.36 1.45 -0.31 0.00 -0.52 0.00 0.00 55.73 56.71 3g0g s ARG 147 Cb -0.16 -1.96 -0.08 0.00 0.52 0.00 0.00 34.95 33.27 3g0g s ARG 147 CO 0.45 -1.16 1.57 0.42 0.02 0.00 0.00 175.30 176.60 3g0g s ILE 148 N -2.20 3.16 1.05 1.52 1.01 -1.26 -4.98 121.20 119.50 3g0g s ILE 148 Ca 0.68 0.64 -0.11 0.00 0.00 0.00 0.00 60.65 61.86 3g0g s ILE 148 Cb -0.21 -3.41 0.22 0.00 0.01 0.00 0.00 42.46 39.06 3g0g s ILE 148 CO 0.38 0.01 1.06 -0.81 0.00 0.00 0.00 174.94 175.58 3g0g n PRO 149 N 5.27 -1.48 -1.70 2.79 -0.04 -1.26 -4.37 135.00 134.21 3g0g n PRO 149 Ca 0.15 -0.38 -0.33 0.00 -0.04 0.00 0.00 63.50 62.89 3g0g n PRO 149 Cb 0.41 -2.26 0.05 0.00 -0.04 0.00 0.00 33.50 31.66 3g0g n PRO 149 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3g0g s ASN 150 N -2.50 4.96 -1.20 3.54 0.01 -1.26 -3.93 114.94 114.56 3g0g s ASN 150 Ca 0.68 2.05 -0.07 0.00 -0.71 0.00 0.00 52.86 54.80 3g0g s ASN 150 Cb -0.24 -2.56 0.01 0.00 0.41 0.00 0.00 41.25 38.87 3g0g s ASN 150 CO 0.62 -1.73 1.04 0.59 -1.51 0.00 0.00 177.10 176.11 3g0g n ASN 151 N -2.48 -5.43 -4.74 -1.22 5.03 -1.19 -4.99 115.26 100.25 3g0g n ASN 151 Ca 0.11 -0.49 -0.41 0.00 0.87 0.00 0.00 54.58 54.65 3g0g n ASN 151 Cb 0.52 -4.58 -0.04 0.00 -1.02 0.00 0.00 39.78 34.65 3g0g n ASN 151 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3g0g s THR 152 N -3.29 4.16 -0.06 3.41 2.01 -0.47 -4.57 115.64 116.83 3g0g s THR 152 Ca 0.46 1.87 0.04 0.00 0.31 0.00 0.00 61.69 64.37 3g0g s THR 152 Cb -0.20 -4.20 -0.25 0.00 0.01 0.00 0.00 72.50 67.87 3g0g s THR 152 CO 0.65 0.33 0.60 1.56 -0.69 0.00 0.00 174.62 177.07 3g0g h GLN 153 N 5.17 0.13 -2.26 4.92 4.20 -0.73 -1.81 115.11 124.72 3g0g h GLN 153 Ca -0.44 -0.21 -0.07 0.00 0.06 0.00 0.00 58.65 57.98 3g0g h GLN 153 Cb 1.21 0.08 -0.20 0.00 0.30 0.00 0.00 27.48 28.87 3g0g h GLN 153 CO 0.71 0.84 0.06 -0.46 -0.67 0.00 0.00 178.83 179.31 3g0g s TRP 154 N -2.59 -0.57 -0.01 2.96 -0.11 -1.21 -4.58 118.94 112.82 3g0g s TRP 154 Ca -0.11 1.10 0.01 0.00 1.22 0.00 0.00 56.10 58.31 3g0g s TRP 154 Cb 0.07 0.30 0.01 0.00 -1.50 0.00 0.00 33.47 32.36 3g0g s TRP 154 CO 0.81 -0.50 -0.01 0.14 -4.62 0.00 0.00 176.95 172.77 3g0g s VAL 155 N -0.83 0.17 -0.09 5.86 -7.23 -1.26 -1.52 120.40 115.49 3g0g s VAL 155 Ca -0.09 -0.03 -0.05 0.00 -1.81 0.00 0.00 61.98 60.00 3g0g s VAL 155 Cb -0.02 -0.19 0.04 0.00 0.56 0.00 0.00 36.38 36.77 3g0g s VAL 155 CO 0.07 0.08 0.21 0.28 -0.31 0.00 0.00 175.10 175.43 3g0g s THR 156 N 0.30 -0.04 0.81 5.32 -1.32 -0.52 -5.02 115.64 115.16 3g0g s THR 156 Ca -0.03 0.15 -0.11 0.00 -1.21 0.00 0.00 61.69 60.50 3g0g s THR 156 Cb -0.05 -0.33 0.08 0.00 -1.51 0.00 0.00 72.50 70.69 3g0g s THR 156 CO -0.01 0.06 1.10 0.26 -2.21 0.00 0.00 174.62 173.82 3g0g s TRP 157 N 1.20 2.43 0.80 9.09 0.52 -1.26 -1.82 118.94 129.90 3g0g s TRP 157 Ca -0.09 1.53 -0.11 0.00 0.02 0.00 0.00 56.10 57.45 3g0g s TRP 157 Cb -0.10 -3.09 0.08 0.00 -1.15 0.00 0.00 33.47 29.20 3g0g s TRP 157 CO -0.07 -2.01 1.09 -1.54 0.02 0.00 0.00 176.95 174.44 3g0g s SER 158 N -3.32 4.24 0.50 2.95 1.04 0.18 -4.88 113.70 114.41 3g0g s SER 158 Ca 0.62 1.74 0.28 0.00 0.48 0.00 0.00 55.95 59.07 3g0g s SER 158 Cb -0.18 -2.43 1.29 0.00 0.10 0.00 0.00 66.02 64.80 3g0g s SER 158 CO 0.56 -2.19 1.98 -0.65 0.98 0.00 0.00 173.24 173.92 3g0g h PRO 159 N -1.24 0.00 -4.64 4.02 0.11 -1.83 -3.43 132.00 124.99 3g0g h PRO 159 Ca -0.45 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.35 3g0g h PRO 159 Cb 1.24 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.13 3g0g h PRO 159 CO 0.52 0.13 -0.75 0.14 -0.21 0.00 0.00 178.00 177.84 3g0g s VAL 160 N -3.88 0.60 0.00 3.15 -7.23 -1.26 -4.78 120.40 107.01 3g0g s VAL 160 Ca -0.01 -0.95 0.00 0.00 -1.81 0.00 0.00 61.98 59.21 3g0g s VAL 160 Cb 0.11 -0.63 0.00 0.00 0.56 0.00 0.00 36.38 36.42 3g0g s VAL 160 CO 0.59 -0.26 0.00 0.61 -0.31 0.00 0.00 175.10 175.73 3g0g n GLY 161 N 1.73 0.33 1.03 2.32 0.00 -1.26 -4.51 105.19 104.83 3g0g n GLY 161 Ca -0.21 -1.09 0.01 0.00 0.00 0.00 0.00 46.02 44.73 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 8.30 0.00 -1.80 1.61 1.44 -1.26 -2.85 115.22 120.66 3g0g n HIS 162 Ca 0.00 -0.31 -0.38 0.00 -2.01 0.00 0.00 57.72 55.03 3g0g n HIS 162 Cb 0.00 0.03 0.05 0.00 0.12 0.00 0.00 29.99 30.19 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 2.91 -0.01 -1.40 1.02 -1.26 -4.66 119.74 116.33 3g0g s LYS 163 Ca 0.15 2.12 0.00 0.00 0.02 0.00 0.00 55.97 58.26 3g0g s LYS 163 Cb 0.17 -2.06 0.02 0.00 -0.52 0.00 0.00 37.83 35.44 3g0g s LYS 163 CO -0.08 -1.34 0.02 -1.17 -0.92 0.00 0.00 175.35 171.86 3g0g s LEU 164 N -3.90 1.39 0.01 3.17 2.96 0.07 -0.65 118.68 121.74 3g0g s LEU 164 Ca 0.76 0.02 0.08 0.00 -0.22 0.00 0.00 54.13 54.78 3g0g s LEU 164 Cb -0.38 -0.06 -0.02 0.00 0.50 0.00 0.00 46.19 46.22 3g0g s LEU 164 CO 0.43 -0.08 -0.26 0.00 -1.32 0.00 0.00 176.35 175.12 3g0g s ALA 165 N 0.71 2.15 0.03 5.97 0.00 -0.76 -0.44 121.76 129.43 3g0g s ALA 165 Ca -0.06 -1.17 -0.12 0.00 0.00 0.00 0.00 51.96 50.61 3g0g s ALA 165 Cb -0.09 -0.50 0.01 0.00 0.00 0.00 0.00 23.12 22.55 3g0g s ALA 165 CO -0.02 0.52 0.26 1.52 0.00 0.00 0.00 175.76 178.04 3g0g s TYR 166 N -0.70 -0.06 -0.14 0.00 -0.85 -0.15 -1.44 117.35 114.02 3g0g s TYR 166 Ca 0.11 -0.07 0.00 0.00 -0.52 0.00 0.00 57.07 56.59 3g0g s TYR 166 Cb -0.10 0.05 -0.01 0.00 0.38 0.00 0.00 41.96 42.29 3g0g s TYR 166 CO 0.00 -0.46 -0.15 0.08 -1.52 0.00 0.00 175.55 173.51 3g0g s VAL 167 N -2.35 2.81 -0.08 -3.49 1.01 -0.58 -0.47 120.40 117.26 3g0g s VAL 167 Ca -0.06 -0.74 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 3g0g s VAL 167 Cb -0.02 -2.18 0.04 0.00 0.00 0.00 0.00 36.38 34.22 3g0g s VAL 167 CO -0.02 0.52 0.18 0.86 0.00 0.00 0.00 175.10 176.64 3g0g s TRP 168 N 0.54 -0.22 -1.50 5.22 -0.00 -0.59 -0.08 118.94 122.31 3g0g s TRP 168 Ca -0.09 0.59 -0.13 0.00 -0.00 0.00 0.00 56.10 56.47 3g0g s TRP 168 Cb -0.16 -0.02 0.08 0.00 -0.00 0.00 0.00 33.47 33.36 3g0g s TRP 168 CO 0.04 -0.18 0.91 0.09 -0.00 0.00 0.00 176.95 177.80 3g0g n ASN 169 N 4.09 -4.89 -0.53 5.86 5.03 -1.26 -1.92 115.26 121.64 3g0g n ASN 169 Ca -0.25 -0.68 -0.07 0.00 0.87 0.00 0.00 54.58 54.45 3g0g n ASN 169 Cb 0.53 -3.92 -0.03 0.00 -1.02 0.00 0.00 39.78 35.34 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 -2.75 -4.99 -4.51 6.41 5.03 -1.26 -4.42 115.26 108.77 3g0g n ASN 170 Ca 0.03 0.17 -0.25 0.00 0.87 0.00 0.00 54.58 55.40 3g0g n ASN 170 Cb 0.53 -3.10 -0.10 0.00 -1.02 0.00 0.00 39.78 36.10 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 -2.39 3.85 -0.14 6.41 -0.00 -0.81 -2.27 116.67 121.33 3g0g s ASP 171 Ca 0.00 -0.85 -0.10 0.00 -0.00 0.00 0.00 52.55 51.59 3g0g s ASP 171 Cb 0.00 -0.47 -0.05 0.00 -0.00 0.00 0.00 42.92 42.41 3g0g s ASP 171 CO 0.00 0.06 0.20 -0.63 -0.00 0.00 0.00 175.17 174.80 3g0g s ILE 172 N -2.19 5.38 -0.01 0.77 1.01 -1.26 -1.54 121.20 123.36 3g0g s ILE 172 Ca 0.28 0.35 0.04 0.00 0.00 0.00 0.00 60.65 61.32 3g0g s ILE 172 Cb -0.06 -3.51 -0.01 0.00 0.01 0.00 0.00 42.46 38.88 3g0g s ILE 172 CO 0.15 0.50 -0.14 -0.31 0.00 0.00 0.00 174.94 175.15 3g0g s TYR 173 N -0.24 1.22 -0.13 3.97 2.02 0.38 -0.41 117.35 124.17 3g0g s TYR 173 Ca 0.14 -0.24 0.01 0.00 -0.37 0.00 0.00 57.07 56.62 3g0g s TYR 173 Cb -0.12 -0.78 0.02 0.00 -0.40 0.00 0.00 41.96 40.67 3g0g s TYR 173 CO 0.03 -0.02 -0.16 0.08 -1.57 0.00 0.00 175.55 173.91 3g0g s VAL 174 N -0.35 1.65 -0.25 0.71 1.01 0.63 -0.97 120.40 122.83 3g0g s VAL 174 Ca 0.05 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.23 3g0g s VAL 174 Cb -0.05 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 3g0g s VAL 174 CO -0.00 0.47 0.10 -0.54 0.00 0.00 0.00 175.10 175.13 3g0g s LYS 175 N 1.12 3.77 0.18 2.72 1.02 0.41 -0.13 119.74 128.84 3g0g s LYS 175 Ca -0.03 -0.42 0.05 0.00 0.02 0.00 0.00 55.97 55.60 3g0g s LYS 175 Cb -0.14 -3.41 0.04 0.00 -0.52 0.00 0.00 37.83 33.80 3g0g s LYS 175 CO -0.05 -0.14 1.42 0.82 -0.92 0.00 0.00 175.35 176.48 3g0g h ILE 176 N 5.42 1.52 -3.92 2.17 1.08 -1.86 0.23 117.51 122.16 3g0g h ILE 176 Ca -0.37 -2.64 -0.32 0.00 -0.39 0.00 0.00 64.86 61.14 3g0g h ILE 176 Cb 1.18 2.45 -0.27 0.00 -3.07 0.00 0.00 36.82 37.11 3g0g h ILE 176 CO 0.58 0.76 -0.75 -1.61 -0.69 0.00 0.00 178.15 176.44 3g0g s GLU 177 N -3.22 0.46 0.30 2.37 0.41 -1.26 -4.26 118.70 113.51 3g0g s GLU 177 Ca -0.02 -0.29 0.06 0.00 -0.41 0.00 0.00 54.97 54.32 3g0g s GLU 177 Cb 0.11 -0.41 0.81 0.00 -1.78 0.00 0.00 34.13 32.86 3g0g s GLU 177 CO 0.81 0.11 1.69 -1.35 -0.49 0.00 0.00 175.26 176.03 3g0g h PRO 178 N 5.77 0.39 0.00 0.39 0.11 -1.85 -2.37 132.00 134.44 3g0g h PRO 178 Ca -0.29 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.75 3g0g h PRO 178 Cb 1.19 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3g0g h PRO 178 CO 0.49 0.26 -0.38 -2.95 -0.21 0.00 0.00 178.00 175.21 3g0g h ASN 179 N 0.40 0.00 -4.21 -2.05 -1.07 -1.90 -3.45 115.58 103.30 3g0g h ASN 179 Ca 0.60 0.00 -0.49 0.00 0.07 0.00 0.00 56.30 56.48 3g0g h ASN 179 Cb 1.19 0.00 0.05 0.00 -2.07 0.00 0.00 38.32 37.49 3g0g h ASN 179 CO -0.54 0.19 0.38 -0.76 0.07 0.00 0.00 177.43 176.76 3g0g s LEU 180 N -6.15 3.50 0.46 6.14 1.43 -0.89 -4.61 118.68 118.55 3g0g s LEU 180 Ca 0.04 1.72 -0.24 0.00 -1.03 0.00 0.00 54.13 54.62 3g0g s LEU 180 Cb 0.07 -4.52 -0.07 0.00 0.03 0.00 0.00 46.19 41.69 3g0g s LEU 180 CO 0.72 -1.01 1.23 -2.16 0.23 0.00 0.00 176.35 175.37 3g0g s PRO 181 N -4.19 3.72 0.56 1.29 0.04 -1.26 -4.83 135.00 130.33 3g0g s PRO 181 Ca 0.61 1.96 -0.15 0.00 0.04 0.00 0.00 61.00 63.47 3g0g s PRO 181 Cb -0.14 -2.49 -0.06 0.00 0.04 0.00 0.00 34.50 31.85 3g0g s PRO 181 CO 0.37 -0.64 1.01 -1.54 0.04 0.00 0.00 177.00 176.25 3g0g s SER 182 N -1.11 6.35 -0.16 6.66 1.04 -1.26 -4.77 113.70 120.44 3g0g s SER 182 Ca 0.63 1.56 -0.09 0.00 0.48 0.00 0.00 55.95 58.53 3g0g s SER 182 Cb -0.33 -2.50 -0.05 0.00 0.10 0.00 0.00 66.02 63.24 3g0g s SER 182 CO 0.41 -0.78 0.15 -0.31 0.98 0.00 0.00 173.24 173.69 3g0g s TYR 183 N -2.77 3.50 -0.37 5.02 2.02 0.81 -4.90 117.35 120.67 3g0g s TYR 183 Ca 0.58 0.44 -0.22 0.00 -0.37 0.00 0.00 57.07 57.51 3g0g s TYR 183 Cb -0.11 -2.08 0.01 0.00 -0.40 0.00 0.00 41.96 39.37 3g0g s TYR 183 CO 0.39 0.48 0.73 0.50 -1.57 0.00 0.00 175.55 176.08 3g0g s ARG 184 N -0.24 3.69 0.03 -0.62 3.52 -1.26 -0.27 118.95 123.80 3g0g s ARG 184 Ca 0.12 0.18 -0.09 0.00 -0.13 0.00 0.00 55.73 55.80 3g0g s ARG 184 Cb -0.12 -3.82 -0.32 0.00 -1.56 0.00 0.00 34.95 29.14 3g0g s ARG 184 CO 0.01 -0.83 0.97 0.82 -0.81 0.00 0.00 175.30 175.46 3g0g h ILE 185 N 5.74 1.28 -3.79 4.11 1.08 -1.10 -3.40 117.51 121.43 3g0g h ILE 185 Ca -0.25 -2.80 -0.47 0.00 -0.39 0.00 0.00 64.86 60.95 3g0g h ILE 185 Cb 1.10 2.93 -0.20 0.00 -3.07 0.00 0.00 36.82 37.57 3g0g h ILE 185 CO 0.89 0.84 -0.79 0.42 -0.69 0.00 0.00 178.15 178.82 3g0g s THR 186 N -2.62 1.40 -0.05 -0.27 -4.23 -1.21 -4.81 115.64 103.87 3g0g s THR 186 Ca -0.08 -1.53 0.07 0.00 -1.18 0.00 0.00 61.69 58.96 3g0g s THR 186 Cb 0.06 -1.40 0.11 0.00 1.34 0.00 0.00 72.50 72.60 3g0g s THR 186 CO 0.90 -0.23 1.04 0.79 -0.54 0.00 0.00 174.62 176.58 3g0g n TRP 187 N 0.94 0.00 0.35 3.99 7.02 -1.26 -4.43 117.44 124.05 3g0g n TRP 187 Ca -0.19 -0.38 0.04 0.00 -1.02 0.00 0.00 57.50 55.95 3g0g n TRP 187 Cb 0.55 -0.09 0.00 0.00 -2.42 0.00 0.00 31.31 29.35 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 -0.54 0.00 -1.68 -0.99 -2.24 -1.26 -5.03 114.28 102.54 3g0g n THR 188 Ca 0.06 -0.42 -0.45 0.00 -2.27 0.00 0.00 64.05 60.97 3g0g n THR 188 Cb 0.66 1.10 -0.04 0.00 -2.10 0.00 0.00 70.33 69.95 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 0.79 1.58 2.80 3.38 0.00 -1.26 -4.71 105.19 107.77 3g0g n GLY 189 Ca 0.03 0.79 -0.17 0.00 0.00 0.00 0.00 46.02 46.68 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 3.50 0.00 0.06 1.61 2.20 -1.04 -4.82 119.74 121.26 3g0g s LYS 190 Ca 0.88 0.40 -0.37 0.00 -0.36 0.00 0.00 55.97 56.52 3g0g s LYS 190 Cb -0.58 -0.31 -0.16 0.00 -1.51 0.00 0.00 37.83 35.27 3g0g s LYS 190 CO 0.44 -0.26 1.40 -1.91 -0.36 0.00 0.00 175.35 174.66 3g0g n GLU 191 N 4.86 1.25 -1.08 4.03 2.13 -1.26 -1.03 120.64 129.53 3g0g n GLU 191 Ca -0.13 0.45 -0.03 0.00 0.66 0.00 0.00 57.16 58.11 3g0g n GLU 191 Cb 0.50 -2.11 -0.01 0.00 0.27 0.00 0.00 31.44 30.09 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 2.85 -5.62 0.08 4.31 8.00 -1.26 -4.71 116.55 120.20 3g0g n ASP 192 Ca 0.19 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.75 3g0g n ASP 192 Cb 0.20 -3.35 0.00 0.00 -0.02 0.00 0.00 41.12 37.94 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 -2.16 0.53 -5.01 0.53 5.41 -0.20 -4.66 119.36 113.80 3g0g n ILE 193 Ca -0.03 0.18 -0.32 0.00 1.00 0.00 0.00 62.75 63.58 3g0g n ILE 193 Cb 0.47 -1.08 -0.16 0.00 -0.71 0.00 0.00 39.64 38.16 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 2.34 -0.21 1.39 -1.09 -0.22 -0.27 121.20 121.14 3g0g s ILE 194 Ca 0.00 -0.91 0.01 0.00 -2.23 0.00 0.00 60.65 57.51 3g0g s ILE 194 Cb 0.00 -1.93 0.05 0.00 -1.58 0.00 0.00 42.46 39.00 3g0g s ILE 194 CO 0.00 0.55 -0.07 -0.31 -1.23 0.00 0.00 174.94 173.88 3g0g s TYR 195 N 0.42 2.33 -0.23 3.97 1.51 -0.63 -2.50 117.35 122.22 3g0g s TYR 195 Ca -0.15 -1.62 -0.06 0.00 -1.01 0.00 0.00 57.07 54.23 3g0g s TYR 195 Cb -0.17 -1.57 -0.02 0.00 -0.11 0.00 0.00 41.96 40.09 3g0g s TYR 195 CO 0.06 -0.75 0.01 -0.80 -1.11 0.00 0.00 175.55 172.97 3g0g s ASN 196 N 1.42 4.73 0.00 2.29 0.01 -0.96 -1.00 114.94 121.43 3g0g s ASN 196 Ca -0.03 -0.29 0.00 0.00 -0.71 0.00 0.00 52.86 51.82 3g0g s ASN 196 Cb -0.17 -1.83 0.00 0.00 0.41 0.00 0.00 41.25 39.65 3g0g s ASN 196 CO -0.07 -0.02 0.00 0.61 -1.51 0.00 0.00 177.10 176.11 3g0g n GLY 197 N 4.83 0.97 3.07 0.66 0.00 -0.37 -4.44 105.19 109.91 3g0g n GLY 197 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.89 0.45 0.56 -0.61 -4.36 -1.26 -0.07 121.20 112.02 3g0g s ILE 198 Ca 0.00 -1.25 -0.08 0.00 -0.26 0.00 0.00 60.65 59.06 3g0g s ILE 198 Cb 0.00 -0.79 -0.03 0.00 1.25 0.00 0.00 42.46 42.89 3g0g s ILE 198 CO 0.00 -0.54 0.92 0.42 0.24 0.00 0.00 174.94 175.98 3g0g s THR 199 N -1.98 4.59 0.71 8.37 -4.23 0.58 -4.73 115.64 118.95 3g0g s THR 199 Ca -0.06 0.46 -0.01 0.00 -1.18 0.00 0.00 61.69 60.90 3g0g s THR 199 Cb -0.06 -3.79 0.12 0.00 1.34 0.00 0.00 72.50 70.11 3g0g s THR 199 CO -0.02 -0.91 0.98 1.51 -0.54 0.00 0.00 174.62 175.65 3g0g s ASP 200 N -4.18 4.40 0.18 3.99 3.84 -1.26 -4.81 116.67 118.84 3g0g s ASP 200 Ca 0.52 -0.34 -0.17 0.00 -0.00 0.00 0.00 52.55 52.55 3g0g s ASP 200 Cb -0.11 -0.07 0.14 0.00 -1.38 0.00 0.00 42.92 41.50 3g0g s ASP 200 CO 0.49 -1.82 1.63 -0.25 -0.00 0.00 0.00 175.17 175.22 3g0g h TRP 201 N -0.50 -0.46 0.00 2.11 7.01 -2.00 -0.77 115.95 121.35 3g0g h TRP 201 Ca -0.37 0.05 -0.13 0.00 2.11 0.00 0.00 58.89 60.55 3g0g h TRP 201 Cb 1.27 0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 28.59 3g0g h TRP 201 CO -0.16 -0.28 -0.62 -0.24 -2.79 0.00 0.00 178.44 174.36 3g0g h VAL 202 N -0.08 1.31 -0.03 2.65 3.04 -1.95 -1.89 116.25 119.30 3g0g h VAL 202 Ca 0.23 -2.22 -0.18 0.00 -1.01 0.00 0.00 66.70 63.52 3g0g h VAL 202 Cb 0.43 2.24 -0.01 0.00 -2.01 0.00 0.00 31.29 31.94 3g0g h VAL 202 CO -0.53 0.61 -0.78 1.88 -1.01 0.00 0.00 177.57 177.73 3g0g h TYR 203 N 0.00 0.38 0.06 3.17 -1.99 -1.80 -2.09 116.97 114.70 3g0g h TYR 203 Ca -0.01 -0.19 -0.00 0.00 2.00 0.00 0.00 58.73 60.54 3g0g h TYR 203 Cb 1.19 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.87 3g0g h TYR 203 CO 0.00 0.95 -0.03 1.49 -0.00 0.00 0.00 178.16 180.57 3g0g h GLU 204 N 0.17 -0.08 0.00 4.88 4.81 -0.87 -0.97 114.58 122.53 3g0g h GLU 204 Ca -0.04 0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.02 3g0g h GLU 204 Cb 1.37 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.74 3g0g h GLU 204 CO 0.13 0.27 -0.89 1.49 -0.73 0.00 0.00 179.01 179.28 3g0g h GLU 205 N -0.43 0.00 0.00 1.92 4.57 -1.43 -2.55 114.58 116.66 3g0g h GLU 205 Ca -0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 3g0g h GLU 205 Cb 0.38 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 3g0g h GLU 205 CO 0.01 0.85 -0.73 0.39 -1.18 0.00 0.00 179.01 178.35 3g0g n GLU 206 N -3.31 1.70 -0.01 1.92 -0.58 -0.79 -4.69 120.64 114.89 3g0g n GLU 206 Ca 0.00 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.70 3g0g n GLU 206 Cb 0.89 -0.86 -0.01 0.00 -0.57 0.00 0.00 31.44 30.89 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 -1.28 1.31 1.00 2.62 0.31 -1.06 -4.86 118.33 116.36 3g0g n VAL 207 Ca 0.00 0.27 0.10 0.00 -0.01 0.00 0.00 64.34 64.71 3g0g n VAL 207 Cb 0.00 -1.89 -0.08 0.00 -0.91 0.00 0.00 33.84 30.96 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 -3.87 0.00 -4.20 3.52 3.72 -0.39 -4.98 117.46 111.27 3g0g n PHE 208 Ca -0.07 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 56.99 3g0g n PHE 208 Cb 0.24 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.72 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 -1.47 -2.63 -3.53 4.37 7.64 -0.97 -4.90 113.62 112.13 3g0g n SER 209 Ca 0.04 -1.03 -0.08 0.00 1.01 0.00 0.00 58.87 58.81 3g0g n SER 209 Cb 0.33 -2.72 -0.02 0.00 -1.01 0.00 0.00 64.21 60.79 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 -3.44 -1.88 0.07 -0.43 0.00 -1.15 -4.99 121.76 109.94 3g0g s ALA 210 Ca 0.60 1.20 -0.02 0.00 0.00 0.00 0.00 51.96 53.74 3g0g s ALA 210 Cb -0.33 0.16 -0.27 0.00 0.00 0.00 0.00 23.12 22.68 3g0g s ALA 210 CO 0.93 -0.62 1.10 -0.92 0.00 0.00 0.00 175.76 176.25 3g0g h TYR 211 N 2.08 0.39 -3.91 0.00 -0.00 -1.88 -3.39 116.97 110.27 3g0g h TYR 211 Ca -0.19 -0.29 -0.46 0.00 -0.00 0.00 0.00 58.73 57.78 3g0g h TYR 211 Cb 1.22 -0.02 -0.02 0.00 -0.00 0.00 0.00 36.73 37.91 3g0g h TYR 211 CO 0.27 1.25 0.32 -1.54 -0.00 0.00 0.00 178.16 178.45 3g0g s SER 212 N -7.02 7.18 -0.36 -2.11 1.04 -1.26 -0.30 113.70 110.86 3g0g s SER 212 Ca -0.04 1.74 0.13 0.00 0.48 0.00 0.00 55.95 58.26 3g0g s SER 212 Cb 0.07 -2.55 0.45 0.00 0.10 0.00 0.00 66.02 64.09 3g0g s SER 212 CO 0.87 -0.15 1.01 0.00 0.98 0.00 0.00 173.24 175.95 3g0g n ALA 213 N 0.18 4.02 -3.78 5.32 0.00 0.90 -4.65 120.51 122.50 3g0g n ALA 213 Ca 0.03 -3.56 -0.27 0.00 0.00 0.00 0.00 53.44 49.64 3g0g n ALA 213 Cb 0.51 -0.79 -0.17 0.00 0.00 0.00 0.00 19.45 19.01 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 -3.28 1.46 -0.20 0.00 1.43 -1.25 -1.92 118.68 114.91 3g0g s LEU 214 Ca 0.35 -0.35 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 3g0g s LEU 214 Cb 0.44 -0.93 0.05 0.00 0.03 0.00 0.00 46.19 45.78 3g0g s LEU 214 CO -0.04 -0.05 -0.06 0.26 0.23 0.00 0.00 176.35 176.68 3g0g s TRP 215 N 1.31 2.10 0.49 0.29 0.51 0.97 -5.00 118.94 119.62 3g0g s TRP 215 Ca -0.01 -1.45 -0.20 0.00 -2.12 0.00 0.00 56.10 52.31 3g0g s TRP 215 Cb -0.14 -1.48 -0.08 0.00 -0.81 0.00 0.00 33.47 30.96 3g0g s TRP 215 CO -0.05 -0.71 1.05 -1.58 -0.51 0.00 0.00 176.95 175.15 3g0g s TRP 216 N 1.50 2.97 0.62 -1.98 0.52 -1.26 -0.48 118.94 120.82 3g0g s TRP 216 Ca -0.02 1.57 -0.14 0.00 0.02 0.00 0.00 56.10 57.53 3g0g s TRP 216 Cb -0.17 -3.09 -0.03 0.00 -1.15 0.00 0.00 33.47 29.04 3g0g s TRP 216 CO -0.07 -0.91 1.05 -1.54 0.02 0.00 0.00 176.95 175.50 3g0g s SER 217 N -1.99 5.80 0.25 2.95 1.04 -0.55 -4.91 113.70 116.29 3g0g s SER 217 Ca 0.68 1.70 -0.05 0.00 0.48 0.00 0.00 55.95 58.75 3g0g s SER 217 Cb -0.17 -2.51 0.47 0.00 0.10 0.00 0.00 66.02 63.90 3g0g s SER 217 CO 0.21 -1.15 1.67 -0.65 0.98 0.00 0.00 173.24 174.30 3g0g h PRO 218 N 0.11 0.21 -0.37 4.02 0.11 -1.91 0.13 132.00 134.30 3g0g h PRO 218 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3g0g h PRO 218 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3g0g h PRO 218 CO 0.58 0.14 0.00 0.27 -0.21 0.00 0.00 178.00 178.78 3g0g n ASN 219 N -5.21 2.09 -1.90 -2.05 0.23 -1.26 -4.33 115.26 102.83 3g0g n ASN 219 Ca 0.14 -1.96 -0.12 0.00 -0.53 0.00 0.00 54.58 52.10 3g0g n ASN 219 Cb 0.48 -0.25 0.03 0.00 -2.08 0.00 0.00 39.78 37.96 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 1.14 0.07 0.09 4.83 0.00 0.46 -4.76 105.19 107.02 3g0g n GLY 220 Ca 0.14 -0.25 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 3g0g n GLY 220 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3g0g n THR 221 N -3.91 1.48 -3.61 2.61 -1.04 -1.26 -4.88 114.28 103.68 3g0g n THR 221 Ca -0.04 0.07 -0.32 0.00 -2.04 0.00 0.00 64.05 61.72 3g0g n THR 221 Cb 0.55 -2.21 -0.05 0.00 -1.82 0.00 0.00 70.33 66.81 3g0g n THR 221 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 3g0g s PHE 222 N -2.34 3.48 -0.20 -1.42 0.08 -1.26 -1.19 117.98 115.13 3g0g s PHE 222 Ca -0.23 0.65 0.01 0.00 0.12 0.00 0.00 56.93 57.48 3g0g s PHE 222 Cb 0.05 -2.08 0.03 0.00 -0.57 0.00 0.00 43.02 40.45 3g0g s PHE 222 CO 0.41 0.41 -0.18 -1.17 -0.10 0.00 0.00 175.22 174.59 3g0g s LEU 223 N -2.60 2.43 -0.08 -0.37 2.96 -0.35 -1.48 118.68 119.19 3g0g s LEU 223 Ca 0.41 -0.79 -0.08 0.00 -0.22 0.00 0.00 54.13 53.45 3g0g s LEU 223 Cb -0.12 -1.50 -0.04 0.00 0.50 0.00 0.00 46.19 45.02 3g0g s LEU 223 CO 0.23 -0.04 0.20 0.00 -1.32 0.00 0.00 176.35 175.42 3g0g s ALA 224 N 1.26 3.85 0.11 5.97 0.00 0.37 -1.30 121.76 132.02 3g0g s ALA 224 Ca 0.02 -0.58 -0.12 0.00 0.00 0.00 0.00 51.96 51.29 3g0g s ALA 224 Cb -0.14 -2.04 0.01 0.00 0.00 0.00 0.00 23.12 20.95 3g0g s ALA 224 CO -0.11 0.61 0.28 1.52 0.00 0.00 0.00 175.76 178.06 3g0g s TYR 225 N -1.09 0.02 -0.04 0.00 -0.85 -0.03 -0.02 117.35 115.33 3g0g s TYR 225 Ca 0.19 -0.41 0.01 0.00 -0.52 0.00 0.00 57.07 56.34 3g0g s TYR 225 Cb -0.13 0.07 -0.03 0.00 0.38 0.00 0.00 41.96 42.25 3g0g s TYR 225 CO 0.08 -0.62 -0.05 0.00 -1.52 0.00 0.00 175.55 173.44 3g0g s ALA 226 N -3.84 3.07 -0.15 9.51 0.00 -0.81 -1.20 121.76 128.34 3g0g s ALA 226 Ca 0.05 -0.92 -0.00 0.00 0.00 0.00 0.00 51.96 51.09 3g0g s ALA 226 Cb 0.04 -1.25 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 3g0g s ALA 226 CO -0.11 0.59 -0.14 -1.14 0.00 0.00 0.00 175.76 174.97 3g0g s GLN 227 N -1.07 3.28 -0.02 0.00 0.74 -0.81 -1.24 119.66 120.53 3g0g s GLN 227 Ca 0.15 -0.72 0.00 0.00 0.05 0.00 0.00 55.36 54.83 3g0g s GLN 227 Cb -0.11 -2.66 -0.04 0.00 1.10 0.00 0.00 33.01 31.31 3g0g s GLN 227 CO 0.04 0.06 0.03 -0.06 -0.55 0.00 0.00 175.29 174.80 3g0g s PHE 228 N 0.73 3.16 -0.24 1.67 0.08 -0.17 -1.29 117.98 121.92 3g0g s PHE 228 Ca -0.06 0.15 0.02 0.00 0.12 0.00 0.00 56.93 57.16 3g0g s PHE 228 Cb -0.15 -1.72 0.06 0.00 -0.57 0.00 0.00 43.02 40.63 3g0g s PHE 228 CO 0.01 0.49 -0.10 1.21 -0.10 0.00 0.00 175.22 176.74 3g0g s ASN 229 N -1.44 4.12 -0.11 1.36 3.84 -0.52 -1.61 114.94 120.58 3g0g s ASN 229 Ca 0.19 -1.25 0.17 0.00 0.21 0.00 0.00 52.86 52.17 3g0g s ASN 229 Cb -0.12 -1.41 0.62 0.00 -0.55 0.00 0.00 41.25 39.79 3g0g s ASN 229 CO 0.09 -0.19 1.53 0.47 -2.79 0.00 0.00 177.10 176.22 3g0g n ASP 230 N 4.53 4.34 -0.24 -4.21 9.92 0.63 -2.11 116.55 129.41 3g0g n ASP 230 Ca -0.14 -2.50 0.02 0.00 -0.53 0.00 0.00 54.79 51.64 3g0g n ASP 230 Cb 0.43 -0.52 0.11 0.00 -0.64 0.00 0.00 41.12 40.50 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 3.30 0.33 -0.55 -3.53 2.02 -1.84 -0.92 112.91 111.73 3g0g h THR 231 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.17 3g0g h THR 231 Cb 1.35 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 3g0g h THR 231 CO 0.20 0.01 0.00 -0.62 0.37 0.00 0.00 175.52 175.48 3g0g n GLU 232 N -5.41 2.61 -2.27 6.66 1.02 -1.26 -4.90 120.64 117.10 3g0g n GLU 232 Ca 0.11 -2.45 -0.43 0.00 -0.02 0.00 0.00 57.16 54.37 3g0g n GLU 232 Cb 0.40 -1.52 -0.02 0.00 -0.02 0.00 0.00 31.44 30.27 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 -1.20 3.86 0.75 2.62 1.01 -0.35 -4.68 120.40 122.41 3g0g s VAL 233 Ca 0.42 0.92 -0.15 0.00 0.00 0.00 0.00 61.98 63.17 3g0g s VAL 233 Cb 0.23 -4.00 0.01 0.00 0.00 0.00 0.00 36.38 32.62 3g0g s VAL 233 CO 0.31 -0.53 0.85 -2.65 0.00 0.00 0.00 175.10 173.08 3g0g n PRO 234 N 7.83 0.35 -4.04 2.72 -0.02 -1.26 -4.56 135.00 136.01 3g0g n PRO 234 Ca 0.17 0.17 -0.36 0.00 -2.02 0.00 0.00 63.50 61.47 3g0g n PRO 234 Cb 0.47 -2.13 -0.08 0.00 -0.02 0.00 0.00 33.50 31.74 3g0g n PRO 234 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3g0g s LEU 235 N -2.62 4.03 0.10 2.45 1.43 -1.26 -1.55 118.68 121.25 3g0g s LEU 235 Ca 0.70 0.29 -0.26 0.00 -1.03 0.00 0.00 54.13 53.83 3g0g s LEU 235 Cb -0.33 -1.98 -0.06 0.00 0.03 0.00 0.00 46.19 43.85 3g0g s LEU 235 CO 0.54 0.35 0.82 -0.51 0.23 0.00 0.00 176.35 177.77 3g0g s ILE 236 N -0.66 4.56 -0.04 -0.59 1.10 0.08 -4.90 121.20 120.76 3g0g s ILE 236 Ca 0.12 1.77 0.07 0.00 -0.51 0.00 0.00 60.65 62.09 3g0g s ILE 236 Cb -0.12 -4.18 -0.02 0.00 0.15 0.00 0.00 42.46 38.30 3g0g s ILE 236 CO 0.02 0.40 -0.25 -1.61 -2.11 0.00 0.00 174.94 171.39 3g0g s GLU 237 N -0.36 2.35 0.06 3.50 2.02 -1.26 -2.07 118.70 122.94 3g0g s GLU 237 Ca 0.40 -0.91 -0.20 0.00 0.02 0.00 0.00 54.97 54.28 3g0g s GLU 237 Cb -0.22 -2.12 0.04 0.00 0.10 0.00 0.00 34.13 31.93 3g0g s GLU 237 CO 0.26 0.48 0.46 1.52 0.02 0.00 0.00 175.26 177.99 3g0g s TYR 238 N -0.40 -0.33 -0.08 1.61 -0.85 -0.54 -4.98 117.35 111.78 3g0g s TYR 238 Ca 0.04 0.28 -0.29 0.00 -0.52 0.00 0.00 57.07 56.58 3g0g s TYR 238 Cb -0.12 0.29 -0.02 0.00 0.38 0.00 0.00 41.96 42.49 3g0g s TYR 238 CO 0.01 -0.63 0.96 -1.12 -1.52 0.00 0.00 175.55 173.25 3g0g s SER 239 N -2.13 7.23 -0.25 -0.18 0.01 -1.26 0.00 113.70 117.13 3g0g s SER 239 Ca -0.04 1.51 -0.07 0.00 1.31 0.00 0.00 55.95 58.65 3g0g s SER 239 Cb -0.00 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.66 3g0g s SER 239 CO -0.04 -0.37 0.07 0.12 0.41 0.00 0.00 173.24 173.43 3g0g s PHE 240 N 1.66 3.08 -0.11 2.43 2.19 0.27 -4.65 117.98 122.85 3g0g s PHE 240 Ca 0.48 -0.43 0.14 0.00 0.33 0.00 0.00 56.93 57.45 3g0g s PHE 240 Cb -0.19 -2.23 -0.01 0.00 -1.31 0.00 0.00 43.02 39.28 3g0g s PHE 240 CO 0.20 -0.35 1.32 1.88 1.83 0.00 0.00 175.22 180.10 3g0g h TYR 241 N 8.18 0.00 -0.62 10.12 -1.99 -1.96 0.11 116.97 130.82 3g0g h TYR 241 Ca -0.38 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.35 3g0g h TYR 241 Cb 1.17 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.90 3g0g h TYR 241 CO 0.66 0.60 0.00 0.45 -0.00 0.00 0.00 178.16 179.87 3g0g n SER 242 N -3.20 -1.85 -4.71 3.88 2.88 -1.26 -4.71 113.62 104.65 3g0g n SER 242 Ca -0.00 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.18 3g0g n SER 242 Cb 0.79 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 64.34 3g0g n SER 242 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3g0g n ASP 243 N -3.35 1.63 -0.19 -3.46 9.92 -1.26 -4.87 116.55 114.98 3g0g n ASP 243 Ca 0.00 0.72 0.30 0.00 -0.53 0.00 0.00 54.79 55.28 3g0g n ASP 243 Cb 0.00 -1.54 0.69 0.00 -0.64 0.00 0.00 41.12 39.63 3g0g n ASP 243 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 3g0g h GLU 244 N -0.10 0.00 0.00 -1.24 4.81 -2.06 0.13 114.58 116.12 3g0g h GLU 244 Ca -0.49 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.72 3g0g h GLU 244 Cb 1.32 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.70 3g0g h GLU 244 CO 0.50 0.00 -0.09 0.66 -0.73 0.00 0.00 179.01 179.35 3g0g h SER 245 N 0.00 0.00 -2.74 1.04 4.64 -1.94 -3.44 113.55 111.12 3g0g h SER 245 Ca 0.45 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.20 3g0g h SER 245 Cb 2.11 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 64.17 3g0g h SER 245 CO -0.00 0.09 1.22 -0.22 -0.87 0.00 0.00 176.83 177.05 3g0g s LEU 246 N -6.33 3.63 0.07 5.97 0.20 0.44 -4.89 118.68 117.76 3g0g s LEU 246 Ca 0.03 1.37 -0.15 0.00 0.69 0.00 0.00 54.13 56.08 3g0g s LEU 246 Cb 0.08 -3.53 -0.21 0.00 -0.43 0.00 0.00 46.19 42.10 3g0g s LEU 246 CO 0.63 -1.55 1.22 -0.61 -0.29 0.00 0.00 176.35 175.74 3g0g h GLN 247 N 12.08 0.69 -5.41 1.98 4.15 -1.87 -3.42 115.11 123.30 3g0g h GLN 247 Ca -0.33 -0.67 -0.65 0.00 0.77 0.00 0.00 58.65 57.77 3g0g h GLN 247 Cb 1.16 0.17 -0.23 0.00 0.21 0.00 0.00 27.48 28.79 3g0g h GLN 247 CO 1.02 1.26 -0.71 0.71 -1.93 0.00 0.00 178.83 179.19 3g0g s TYR 248 N -3.46 2.93 0.51 3.99 2.02 -1.26 -5.10 117.35 116.98 3g0g s TYR 248 Ca -0.11 -0.40 -0.23 0.00 -0.37 0.00 0.00 57.07 55.97 3g0g s TYR 248 Cb 0.07 -1.88 -0.06 0.00 -0.40 0.00 0.00 41.96 39.69 3g0g s TYR 248 CO 0.90 -0.06 1.33 -2.14 -1.57 0.00 0.00 175.55 174.00 3g0g s PRO 249 N 0.22 3.38 0.12 -1.71 0.02 -1.26 -5.01 135.00 130.76 3g0g s PRO 249 Ca -0.05 2.17 -0.13 0.00 0.02 0.00 0.00 61.00 63.02 3g0g s PRO 249 Cb -0.14 -2.37 -0.06 0.00 0.02 0.00 0.00 34.50 31.94 3g0g s PRO 249 CO 0.04 -0.98 0.49 0.21 -0.33 0.00 0.00 177.00 176.43 3g0g s LYS 250 N -2.76 3.90 -0.27 5.54 2.20 0.02 -4.91 119.74 123.46 3g0g s LYS 250 Ca 0.68 0.37 -0.06 0.00 -0.36 0.00 0.00 55.97 56.59 3g0g s LYS 250 Cb -0.39 -2.95 -0.00 0.00 -1.51 0.00 0.00 37.83 32.98 3g0g s LYS 250 CO 0.47 0.51 0.05 0.99 -0.36 0.00 0.00 175.35 177.00 3g0g s THR 251 N -1.44 3.91 0.12 3.43 2.01 -1.26 0.95 115.64 123.35 3g0g s THR 251 Ca 0.36 -0.54 -0.28 0.00 0.31 0.00 0.00 61.69 61.55 3g0g s THR 251 Cb -0.15 -2.93 -0.06 0.00 0.01 0.00 0.00 72.50 69.37 3g0g s THR 251 CO 0.19 0.21 0.88 -0.69 -0.69 0.00 0.00 174.62 174.52 3g0g s VAL 252 N 1.52 4.49 -0.13 3.82 1.01 0.10 -4.89 120.40 126.32 3g0g s VAL 252 Ca 0.04 1.90 -0.00 0.00 0.00 0.00 0.00 61.98 63.92 3g0g s VAL 252 Cb -0.16 -4.24 0.03 0.00 0.00 0.00 0.00 36.38 32.01 3g0g s VAL 252 CO 0.01 0.38 -0.07 -0.13 0.00 0.00 0.00 175.10 175.30 3g0g s ARG 253 N -0.34 1.55 -0.04 2.72 0.52 -1.26 -1.47 118.95 120.62 3g0g s ARG 253 Ca 0.42 -0.35 0.01 0.00 -0.52 0.00 0.00 55.73 55.29 3g0g s ARG 253 Cb -0.23 -1.74 0.02 0.00 0.52 0.00 0.00 34.95 33.53 3g0g s ARG 253 CO 0.28 -0.31 -0.04 0.08 0.02 0.00 0.00 175.30 175.33 3g0g s VAL 254 N 1.67 0.48 0.15 3.52 1.01 -0.88 -4.99 120.40 121.37 3g0g s VAL 254 Ca 0.04 -0.08 -0.31 0.00 0.00 0.00 0.00 61.98 61.62 3g0g s VAL 254 Cb -0.13 -0.52 -0.10 0.00 0.00 0.00 0.00 36.38 35.62 3g0g s VAL 254 CO -0.08 0.22 1.65 -2.84 0.00 0.00 0.00 175.10 174.04 3g0g s PRO 255 N 0.98 4.18 -0.28 2.72 0.02 -1.26 -0.74 135.00 140.63 3g0g s PRO 255 Ca -0.10 2.44 -0.05 0.00 0.02 0.00 0.00 61.00 63.31 3g0g s PRO 255 Cb -0.14 -3.28 0.15 0.00 0.02 0.00 0.00 34.50 31.25 3g0g s PRO 255 CO -0.00 -0.69 0.55 -0.47 -0.33 0.00 0.00 177.00 176.06 3g0g s TYR 256 N 1.64 -1.30 -0.41 6.54 5.04 -0.60 -4.59 117.35 123.68 3g0g s TYR 256 Ca 0.73 1.73 -0.23 0.00 -2.44 0.00 0.00 57.07 56.87 3g0g s TYR 256 Cb -0.45 0.52 0.02 0.00 0.35 0.00 0.00 41.96 42.40 3g0g s TYR 256 CO 0.32 -0.74 0.76 -1.25 -1.34 0.00 0.00 175.55 173.31 3g0g s PRO 257 N 2.79 3.53 0.80 4.97 0.04 -1.26 -4.61 135.00 141.26 3g0g s PRO 257 Ca 0.09 0.03 -0.12 0.00 0.04 0.00 0.00 61.00 61.04 3g0g s PRO 257 Cb -0.14 -3.89 0.07 0.00 0.04 0.00 0.00 34.50 30.58 3g0g s PRO 257 CO -0.18 -1.00 1.11 0.15 0.04 0.00 0.00 177.00 177.12 3g0g s LYS 258 N 3.16 2.11 -0.27 4.56 1.02 -1.26 -0.40 119.74 128.66 3g0g s LYS 258 Ca 0.30 0.54 -0.40 0.00 0.02 0.00 0.00 55.97 56.43 3g0g s LYS 258 Cb -0.13 -1.93 -0.15 0.00 -0.52 0.00 0.00 37.83 35.10 3g0g s LYS 258 CO 0.20 -1.58 1.77 0.00 -0.92 0.00 0.00 175.35 174.82 3g0g n ALA 259 N -3.39 -0.06 -0.66 5.17 0.00 -0.50 -1.02 120.51 120.05 3g0g n ALA 259 Ca 0.07 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3g0g n ALA 259 Cb 0.57 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.76 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 4.28 1.02 3.88 0.00 0.00 -1.26 -4.81 105.19 108.29 3g0g n GLY 260 Ca 0.26 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.99 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 -3.40 2.55 0.13 4.61 0.00 -0.19 -4.99 121.76 120.47 3g0g s ALA 261 Ca 0.00 -0.56 -0.31 0.00 0.00 0.00 0.00 51.96 51.09 3g0g s ALA 261 Cb 0.00 -2.99 -0.10 0.00 0.00 0.00 0.00 23.12 20.03 3g0g s ALA 261 CO 0.00 -1.67 1.71 0.08 0.00 0.00 0.00 175.76 175.88 3g0g s VAL 262 N -3.48 2.61 0.39 0.00 1.01 -1.26 -4.91 120.40 114.75 3g0g s VAL 262 Ca 0.62 0.25 -0.04 0.00 0.00 0.00 0.00 61.98 62.80 3g0g s VAL 262 Cb -0.12 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.06 3g0g s VAL 262 CO 0.50 0.01 0.66 0.20 0.00 0.00 0.00 175.10 176.47 3g0g s ASN 263 N 2.06 6.33 0.35 3.32 0.01 -1.26 -4.42 114.94 121.34 3g0g s ASN 263 Ca 0.76 0.75 -0.29 0.00 -0.71 0.00 0.00 52.86 53.37 3g0g s ASN 263 Cb -0.44 -2.17 -0.11 0.00 0.41 0.00 0.00 41.25 38.94 3g0g s ASN 263 CO 0.33 -0.39 1.53 -2.16 -1.51 0.00 0.00 177.10 174.90 3g0g s PRO 264 N -4.28 4.10 0.55 -0.60 0.04 -1.26 -4.78 135.00 128.77 3g0g s PRO 264 Ca 0.45 2.59 -0.02 0.00 0.04 0.00 0.00 61.00 64.06 3g0g s PRO 264 Cb -0.10 -2.98 0.02 0.00 0.04 0.00 0.00 34.50 31.48 3g0g s PRO 264 CO 0.38 -0.58 0.81 0.95 0.04 0.00 0.00 177.00 178.59 3g0g s THR 265 N -0.77 3.24 -0.10 1.26 -4.23 -0.90 -4.89 115.64 109.26 3g0g s THR 265 Ca 0.56 -0.40 -0.09 0.00 -1.18 0.00 0.00 61.69 60.59 3g0g s THR 265 Cb -0.47 -3.25 0.03 0.00 1.34 0.00 0.00 72.50 70.15 3g0g s THR 265 CO 0.59 -0.21 0.27 0.54 -0.54 0.00 0.00 174.62 175.26 3g0g s VAL 266 N -2.83 -0.01 0.19 2.29 0.11 -1.26 -1.43 120.40 117.47 3g0g s VAL 266 Ca 0.54 0.03 0.09 0.00 -2.93 0.00 0.00 61.98 59.71 3g0g s VAL 266 Cb -0.10 -0.38 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 3g0g s VAL 266 CO 0.41 0.01 -0.18 -0.54 -3.33 0.00 0.00 175.10 171.47 3g0g s LYS 267 N 0.35 1.36 -0.05 1.54 1.02 -0.41 -5.00 119.74 118.54 3g0g s LYS 267 Ca -0.02 -1.52 0.04 0.00 0.02 0.00 0.00 55.97 54.49 3g0g s LYS 267 Cb -0.03 -1.35 0.00 0.00 -0.52 0.00 0.00 37.83 35.93 3g0g s LYS 267 CO -0.01 0.26 -0.17 0.12 -0.92 0.00 0.00 175.35 174.62 3g0g s PHE 268 N -2.39 1.76 0.13 3.18 5.36 -1.26 -1.93 117.98 122.83 3g0g s PHE 268 Ca 0.20 -0.56 0.05 0.00 -0.96 0.00 0.00 56.93 55.66 3g0g s PHE 268 Cb -0.04 -1.20 -0.04 0.00 -0.34 0.00 0.00 43.02 41.40 3g0g s PHE 268 CO 0.08 -0.21 -0.12 -0.06 -1.46 0.00 0.00 175.22 173.44 3g0g s PHE 269 N 0.18 1.31 -0.03 10.12 0.40 -0.34 -1.31 117.98 128.32 3g0g s PHE 269 Ca -0.07 -0.62 -0.01 0.00 -0.60 0.00 0.00 56.93 55.62 3g0g s PHE 269 Cb -0.13 -0.68 0.03 0.00 0.51 0.00 0.00 43.02 42.75 3g0g s PHE 269 CO 0.03 0.11 0.04 0.08 0.70 0.00 0.00 175.22 176.18 3g0g s VAL 270 N -2.52 -0.01 -0.00 -0.44 1.01 0.74 -0.85 120.40 118.32 3g0g s VAL 270 Ca 0.11 0.28 0.05 0.00 0.00 0.00 0.00 61.98 62.41 3g0g s VAL 270 Cb -0.03 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.14 3g0g s VAL 270 CO 0.02 0.15 -0.13 0.54 0.00 0.00 0.00 175.10 175.69 3g0g s VAL 271 N 1.61 3.19 -0.33 2.92 0.11 -0.42 -0.86 120.40 126.62 3g0g s VAL 271 Ca -0.02 -0.88 -0.25 0.00 -2.93 0.00 0.00 61.98 57.90 3g0g s VAL 271 Cb -0.13 -2.33 0.01 0.00 -1.53 0.00 0.00 36.38 32.40 3g0g s VAL 271 CO -0.03 0.44 0.87 0.21 -3.33 0.00 0.00 175.10 173.27 3g0g s ASN 272 N -1.19 6.70 0.30 3.54 3.84 -1.26 -1.21 114.94 125.67 3g0g s ASN 272 Ca 0.14 0.67 0.23 0.00 0.21 0.00 0.00 52.86 54.12 3g0g s ASN 272 Cb -0.11 -2.44 0.20 0.00 -0.55 0.00 0.00 41.25 38.35 3g0g s ASN 272 CO 0.04 -0.74 1.34 0.71 -2.79 0.00 0.00 177.10 175.66 3g0g h THR 273 N 5.70 0.00 -0.14 -5.21 1.35 -1.50 -3.36 112.91 109.75 3g0g h THR 273 Ca -0.23 -0.94 -0.16 0.00 -0.55 0.00 0.00 66.41 64.52 3g0g h THR 273 Cb 1.08 1.68 -0.01 0.00 -1.73 0.00 0.00 68.15 69.18 3g0g h THR 273 CO 0.94 0.00 -0.59 0.44 -0.25 0.00 0.00 175.52 176.06 3g0g h ASP 274 N 0.00 0.52 -1.94 5.36 3.45 -1.90 -3.28 116.42 118.63 3g0g h ASP 274 Ca 0.00 -0.29 -0.75 0.00 0.43 0.00 0.00 57.03 56.42 3g0g h ASP 274 Cb 0.97 -0.15 -0.25 0.00 -0.56 0.00 0.00 39.33 39.34 3g0g h ASP 274 CO 0.00 0.99 1.06 -1.54 -1.57 0.00 0.00 179.24 178.17 3g0g n SER 275 N -3.92 7.41 -4.64 6.45 3.41 -1.26 -4.99 113.62 116.09 3g0g n SER 275 Ca -0.03 -3.70 -0.36 0.00 -0.26 0.00 0.00 58.87 54.52 3g0g n SER 275 Cb 0.62 -1.13 -0.10 0.00 -0.26 0.00 0.00 64.21 63.35 3g0g n SER 275 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3g0g s LEU 276 N -3.87 3.98 -0.02 1.04 2.96 -1.24 -5.02 118.68 116.50 3g0g s LEU 276 Ca 0.49 0.08 0.04 0.00 -0.22 0.00 0.00 54.13 54.52 3g0g s LEU 276 Cb 0.35 -2.05 -0.03 0.00 0.50 0.00 0.00 46.19 44.96 3g0g s LEU 276 CO -0.30 0.09 -0.11 -0.55 -1.32 0.00 0.00 176.35 174.15 3g0g s SER 277 N 0.90 4.28 0.15 3.68 0.15 -1.26 -5.02 113.70 116.57 3g0g s SER 277 Ca 0.06 -0.19 0.25 0.00 0.70 0.00 0.00 55.95 56.77 3g0g s SER 277 Cb -0.13 -0.93 0.44 0.00 -1.71 0.00 0.00 66.02 63.69 3g0g s SER 277 CO 0.03 0.32 1.42 0.77 1.20 0.00 0.00 173.24 176.98 3g0g h SER 278 N 4.96 0.00 0.08 5.45 4.64 -2.00 -3.31 113.55 123.37 3g0g h SER 278 Ca -0.48 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 60.68 3g0g h SER 278 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3g0g h SER 278 CO 0.51 0.08 -0.28 0.52 -0.87 0.00 0.00 176.83 176.80 3g0g n VAL 279 N -2.17 0.00 -3.91 0.95 0.31 -1.26 -4.92 118.33 107.33 3g0g n VAL 279 Ca 0.04 -0.23 -0.11 0.00 -0.01 0.00 0.00 64.34 64.03 3g0g n VAL 279 Cb 0.44 0.84 -0.11 0.00 -0.91 0.00 0.00 33.84 34.10 3g0g n VAL 279 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3g0g s THR 280 N -2.37 0.08 0.21 2.52 -4.23 -1.25 -5.14 115.64 105.46 3g0g s THR 280 Ca 0.24 -0.62 -0.31 0.00 -1.18 0.00 0.00 61.69 59.82 3g0g s THR 280 Cb 0.19 -0.30 -0.10 0.00 1.34 0.00 0.00 72.50 73.63 3g0g s THR 280 CO 0.49 -0.34 1.48 0.20 -0.54 0.00 0.00 174.62 175.91 3g0g s ASN 281 N -1.10 6.64 0.17 3.99 0.01 -1.26 -4.59 114.94 118.79 3g0g s ASN 281 Ca -0.12 2.63 -0.31 0.00 -0.71 0.00 0.00 52.86 54.35 3g0g s ASN 281 Cb -0.07 -2.61 -0.09 0.00 0.41 0.00 0.00 41.25 38.89 3g0g s ASN 281 CO 0.00 -0.74 1.47 0.00 -1.51 0.00 0.00 177.10 176.33 3g0g s ALA 282 N 0.45 3.68 -0.30 0.60 0.00 -1.26 -4.99 121.76 119.92 3g0g s ALA 282 Ca 0.63 1.27 -0.15 0.00 0.00 0.00 0.00 51.96 53.70 3g0g s ALA 282 Cb -0.42 -3.57 -0.02 0.00 0.00 0.00 0.00 23.12 19.10 3g0g s ALA 282 CO 0.38 -0.70 0.39 -0.08 0.00 0.00 0.00 175.76 175.75 3g0g s THR 283 N 0.85 5.15 -0.09 0.00 -1.32 -1.26 -4.94 115.64 114.03 3g0g s THR 283 Ca 0.65 0.37 -0.16 0.00 -1.21 0.00 0.00 61.69 61.34 3g0g s THR 283 Cb -0.41 -3.78 -0.05 0.00 -1.51 0.00 0.00 72.50 66.76 3g0g s THR 283 CO 0.34 0.02 0.41 -0.44 -2.21 0.00 0.00 174.62 172.74 3g0g s SER 284 N 1.69 6.67 -0.21 8.08 0.01 -1.26 -4.65 113.70 124.02 3g0g s SER 284 Ca 0.14 0.80 -0.20 0.00 1.31 0.00 0.00 55.95 58.00 3g0g s SER 284 Cb -0.16 -2.25 -0.02 0.00 0.21 0.00 0.00 66.02 63.80 3g0g s SER 284 CO 0.11 0.13 0.61 -0.63 0.41 0.00 0.00 173.24 173.88 3g0g s ILE 285 N 0.01 5.02 -0.06 1.44 -1.09 -0.04 -4.85 121.20 121.63 3g0g s ILE 285 Ca 0.23 1.14 -0.22 0.00 -2.23 0.00 0.00 60.65 59.57 3g0g s ILE 285 Cb -0.15 -3.93 -0.04 0.00 -1.58 0.00 0.00 42.46 36.76 3g0g s ILE 285 CO 0.10 0.10 0.65 -1.58 -1.23 0.00 0.00 174.94 172.98 3g0g s GLN 286 N 2.05 4.41 -0.31 2.79 0.74 -1.26 -0.19 119.66 127.89 3g0g s GLN 286 Ca 0.27 0.80 -0.10 0.00 0.05 0.00 0.00 55.36 56.38 3g0g s GLN 286 Cb -0.16 -3.43 -0.01 0.00 1.10 0.00 0.00 33.01 30.51 3g0g s GLN 286 CO 0.10 0.13 0.17 0.42 -0.55 0.00 0.00 175.29 175.56 3g0g s ILE 287 N 0.60 4.80 0.70 -2.34 1.01 -0.43 -4.90 121.20 120.65 3g0g s ILE 287 Ca 0.35 -0.31 -0.11 0.00 0.00 0.00 0.00 60.65 60.57 3g0g s ILE 287 Cb -0.17 -3.43 0.01 0.00 0.01 0.00 0.00 42.46 38.88 3g0g s ILE 287 CO 0.17 0.08 1.07 0.42 0.00 0.00 0.00 174.94 176.68 3g0g s THR 288 N 1.65 3.82 0.48 2.92 -4.23 -1.26 -4.18 115.64 114.83 3g0g s THR 288 Ca 0.05 0.59 -0.11 0.00 -1.18 0.00 0.00 61.69 61.05 3g0g s THR 288 Cb -0.17 -3.47 -0.06 0.00 1.34 0.00 0.00 72.50 70.14 3g0g s THR 288 CO 0.07 -0.77 0.86 0.00 -0.54 0.00 0.00 174.62 174.24 3g0g s ALA 289 N -3.20 3.27 0.69 3.99 0.00 -1.26 -5.04 121.76 120.20 3g0g s ALA 289 Ca 0.58 -0.18 -0.15 0.00 0.00 0.00 0.00 51.96 52.21 3g0g s ALA 289 Cb -0.12 -2.82 0.02 0.00 0.00 0.00 0.00 23.12 20.19 3g0g s ALA 289 CO 0.54 -0.23 1.17 -1.25 0.00 0.00 0.00 175.76 175.98 3g0g s PRO 290 N -4.29 2.48 0.26 0.00 0.04 -1.26 -4.71 135.00 127.53 3g0g s PRO 290 Ca 0.52 1.62 -0.05 0.00 0.04 0.00 0.00 61.00 63.14 3g0g s PRO 290 Cb -0.10 -1.89 0.50 0.00 0.04 0.00 0.00 34.50 33.05 3g0g s PRO 290 CO 0.38 -1.54 1.63 0.00 0.04 0.00 0.00 177.00 177.51 3g0g h ALA 291 N -0.04 0.88 0.00 8.56 0.00 -1.99 0.11 119.26 126.79 3g0g h ALA 291 Ca -0.48 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3g0g h ALA 291 Cb 1.28 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.50 3g0g h ALA 291 CO 0.52 -0.44 0.03 0.66 0.00 0.00 0.00 179.25 180.02 3g0g h SER 292 N 0.11 0.00 0.05 0.00 4.64 -2.02 -1.89 113.55 114.43 3g0g h SER 292 Ca 0.45 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.39 3g0g h SER 292 Cb 0.82 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.86 3g0g h SER 292 CO -0.70 0.00 -2.31 0.23 -0.87 0.00 0.00 176.83 173.18 3g0g n MET 293 N -2.84 0.69 0.19 4.77 2.00 0.33 -4.42 117.12 117.83 3g0g n MET 293 Ca -0.02 0.18 0.13 0.00 0.00 0.00 0.00 57.70 57.99 3g0g n MET 293 Cb 0.09 -1.58 0.71 0.00 0.00 0.00 0.00 33.22 32.43 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 0.02 0.00 -1.61 4.03 3.38 -0.58 -2.59 115.31 117.97 3g0g h LEU 294 Ca -0.53 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.50 3g0g h LEU 294 Cb 1.96 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.70 3g0g h LEU 294 CO -0.03 0.00 0.53 -0.29 0.09 0.00 0.00 178.44 178.74 3g0g h ILE 295 N 0.00 0.09 -0.86 1.22 6.09 -1.66 -3.45 117.51 118.94 3g0g h ILE 295 Ca 0.08 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.57 3g0g h ILE 295 Cb 0.35 0.51 0.00 0.00 0.47 0.00 0.00 36.82 38.14 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 -1.37 2.49 3.74 8.18 0.00 -0.98 -5.14 105.19 112.12 3g0g n GLY 296 Ca 0.02 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 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 1.82 6.67 0.33 1.61 1.01 -1.26 -4.97 116.67 121.88 3g0g s ASP 297 Ca 0.00 2.61 0.01 0.00 0.71 0.00 0.00 52.55 55.88 3g0g s ASP 297 Cb 0.00 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 3g0g s ASP 297 CO 0.00 -0.71 0.38 -1.38 0.21 0.00 0.00 175.17 173.67 3g0g s HIS 298 N 0.33 1.29 0.05 4.23 -3.43 -1.26 -0.84 115.29 115.67 3g0g s HIS 298 Ca 0.62 -1.41 0.03 0.00 -0.80 0.00 0.00 55.06 53.49 3g0g s HIS 298 Cb -0.41 -0.33 -0.03 0.00 -1.43 0.00 0.00 32.58 30.38 3g0g s HIS 298 CO 0.39 -1.01 -0.09 0.71 -2.00 0.00 0.00 174.74 172.75 3g0g s TYR 299 N -3.29 0.78 -0.21 0.38 2.02 0.13 -4.82 117.35 112.34 3g0g s TYR 299 Ca 0.34 -0.55 -0.22 0.00 -0.37 0.00 0.00 57.07 56.27 3g0g s TYR 299 Cb 0.01 -0.46 -0.02 0.00 -0.40 0.00 0.00 41.96 41.10 3g0g s TYR 299 CO 0.22 -0.07 0.70 -1.17 -1.57 0.00 0.00 175.55 173.66 3g0g s LEU 300 N -1.81 4.12 0.00 -1.29 2.96 -1.26 -0.30 118.68 121.10 3g0g s LEU 300 Ca -0.06 0.91 0.03 0.00 -0.22 0.00 0.00 54.13 54.79 3g0g s LEU 300 Cb -0.08 -3.00 -0.02 0.00 0.50 0.00 0.00 46.19 43.60 3g0g s LEU 300 CO -0.00 -0.35 0.22 0.00 -1.32 0.00 0.00 176.35 174.90 3g0g s ASP 302 N -1.02 -0.65 -0.08 0.00 -1.08 -1.06 -4.90 116.67 107.88 3g0g s ASP 302 Ca 0.02 1.20 0.01 0.00 -0.52 0.00 0.00 52.55 53.26 3g0g s ASP 302 Cb 0.02 1.23 0.02 0.00 -1.46 0.00 0.00 42.92 42.73 3g0g s ASP 302 CO 0.09 -0.20 -0.09 -0.69 0.52 0.00 0.00 175.17 174.80 3g0g s VAL 303 N 0.56 1.01 -0.05 1.11 1.01 -1.26 -0.88 120.40 121.89 3g0g s VAL 303 Ca -0.01 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 3g0g s VAL 303 Cb -0.05 -0.98 0.04 0.00 0.00 0.00 0.00 36.38 35.39 3g0g s VAL 303 CO -0.05 0.34 0.11 -0.89 0.00 0.00 0.00 175.10 174.61 3g0g s THR 304 N 1.11 -0.08 0.10 3.92 2.01 -0.16 -5.03 115.64 117.50 3g0g s THR 304 Ca -0.06 0.22 -0.28 0.00 0.31 0.00 0.00 61.69 61.88 3g0g s THR 304 Cb -0.14 -0.20 -0.06 0.00 0.01 0.00 0.00 72.50 72.11 3g0g s THR 304 CO -0.01 0.09 0.88 0.26 -0.69 0.00 0.00 174.62 175.14 3g0g s TRP 305 N 1.32 3.80 -0.18 4.92 0.52 -1.26 0.52 118.94 128.58 3g0g s TRP 305 Ca -0.07 1.67 -0.16 0.00 0.02 0.00 0.00 56.10 57.57 3g0g s TRP 305 Cb -0.12 -2.95 -0.21 0.00 -1.15 0.00 0.00 33.47 29.04 3g0g s TRP 305 CO -0.05 0.26 0.23 0.00 0.02 0.00 0.00 176.95 177.42 3g0g n ALA 306 N 2.65 0.85 -3.00 0.98 0.00 0.14 -4.89 120.51 117.23 3g0g n ALA 306 Ca -0.00 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.88 3g0g n ALA 306 Cb 0.49 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.38 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 -4.07 0.00 0.20 0.00 -2.24 -0.98 -4.62 114.28 102.57 3g0g n THR 307 Ca -0.33 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.52 3g0g n THR 307 Cb 0.83 0.00 0.31 0.00 -2.10 0.00 0.00 70.33 69.37 3g0g n THR 307 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3g0g h GLN 308 N 0.00 0.00 0.00 -0.78 1.08 -1.96 -3.28 115.11 110.17 3g0g h GLN 308 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3g0g h GLN 308 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3g0g h GLN 308 CO 0.00 0.29 -0.05 0.39 -0.95 0.00 0.00 178.83 178.51 3g0g n GLU 309 N -3.33 1.71 -3.82 1.46 1.02 -1.26 -4.86 120.64 111.56 3g0g n GLU 309 Ca 0.01 -1.57 -0.22 0.00 -0.02 0.00 0.00 57.16 55.35 3g0g n GLU 309 Cb 0.53 -1.00 -0.17 0.00 -0.02 0.00 0.00 31.44 30.77 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 -1.24 0.60 -0.02 3.49 3.52 -1.24 -1.17 118.95 122.88 3g0g s ARG 310 Ca 0.09 0.09 0.07 0.00 -0.13 0.00 0.00 55.73 55.85 3g0g s ARG 310 Cb 0.08 -0.92 -0.02 0.00 -1.56 0.00 0.00 34.95 32.53 3g0g s ARG 310 CO 0.01 -0.27 -0.23 -1.50 -0.81 0.00 0.00 175.30 172.49 3g0g s ILE 311 N 1.81 1.86 -0.12 4.11 2.07 -0.65 0.23 121.20 130.52 3g0g s ILE 311 Ca 0.02 -1.00 -0.01 0.00 -1.41 0.00 0.00 60.65 58.26 3g0g s ILE 311 Cb -0.13 -1.55 -0.02 0.00 0.13 0.00 0.00 42.46 40.90 3g0g s ILE 311 CO -0.04 0.53 -0.10 -0.94 -1.91 0.00 0.00 174.94 172.47 3g0g s SER 312 N -0.48 4.26 0.00 4.50 1.04 0.19 -0.72 113.70 122.48 3g0g s SER 312 Ca 0.07 -0.24 0.07 0.00 0.48 0.00 0.00 55.95 56.33 3g0g s SER 312 Cb -0.10 -1.56 -0.02 0.00 0.10 0.00 0.00 66.02 64.45 3g0g s SER 312 CO -0.00 0.20 -0.21 -0.76 0.98 0.00 0.00 173.24 173.44 3g0g s LEU 313 N 0.17 2.08 -0.16 2.42 1.02 -0.20 -0.99 118.68 123.02 3g0g s LEU 313 Ca -0.06 -0.43 -0.00 0.00 0.02 0.00 0.00 54.13 53.66 3g0g s LEU 313 Cb -0.15 -1.08 -0.00 0.00 0.02 0.00 0.00 46.19 44.98 3g0g s LEU 313 CO 0.04 0.24 -0.13 -1.10 0.02 0.00 0.00 176.35 175.42 3g0g s GLN 314 N -0.70 3.25 0.12 1.70 -0.21 -0.06 -0.60 119.66 123.17 3g0g s GLN 314 Ca 0.08 -0.72 0.05 0.00 0.02 0.00 0.00 55.36 54.79 3g0g s GLN 314 Cb -0.08 -2.68 -0.04 0.00 1.00 0.00 0.00 33.01 31.20 3g0g s GLN 314 CO -0.00 0.00 0.06 -1.58 -2.12 0.00 0.00 175.29 171.65 3g0g s TRP 315 N 0.87 3.07 -0.05 0.91 0.52 -0.25 0.46 118.94 124.48 3g0g s TRP 315 Ca -0.04 -0.01 0.01 0.00 0.02 0.00 0.00 56.10 56.08 3g0g s TRP 315 Cb -0.15 -1.53 0.02 0.00 -1.15 0.00 0.00 33.47 30.66 3g0g s TRP 315 CO -0.01 0.51 -0.04 -1.17 0.02 0.00 0.00 176.95 176.26 3g0g s LEU 316 N -2.66 1.28 0.82 2.99 0.20 0.59 -1.89 118.68 120.01 3g0g s LEU 316 Ca 0.29 -0.13 -0.11 0.00 0.69 0.00 0.00 54.13 54.87 3g0g s LEU 316 Cb -0.11 -0.45 0.09 0.00 -0.43 0.00 0.00 46.19 45.29 3g0g s LEU 316 CO 0.21 -0.06 1.12 -0.13 -0.29 0.00 0.00 176.35 177.19 3g0g s ARG 317 N 0.99 1.78 0.24 1.98 0.52 -0.91 0.19 118.95 123.74 3g0g s ARG 317 Ca -0.10 1.35 -0.07 0.00 -0.52 0.00 0.00 55.73 56.40 3g0g s ARG 317 Cb -0.14 -1.83 0.23 0.00 0.52 0.00 0.00 34.95 33.73 3g0g s ARG 317 CO -0.00 -2.03 1.90 -0.09 0.02 0.00 0.00 175.30 175.10 3g0g h ARG 318 N -1.34 1.27 -6.47 3.54 2.43 -1.31 -3.28 114.38 109.21 3g0g h ARG 318 Ca -0.44 -0.10 -0.57 0.00 -0.81 0.00 0.00 59.98 58.07 3g0g h ARG 318 Cb 1.25 -0.28 -0.06 0.00 -0.42 0.00 0.00 29.97 30.46 3g0g h ARG 318 CO 0.47 0.87 0.94 0.42 -1.51 0.00 0.00 179.97 181.16 3g0g s ILE 319 N -6.04 4.23 -0.14 1.20 1.01 -1.26 -4.80 121.20 115.39 3g0g s ILE 319 Ca -0.13 1.34 -0.04 0.00 0.00 0.00 0.00 60.65 61.82 3g0g s ILE 319 Cb 0.17 -4.37 -0.08 0.00 0.01 0.00 0.00 42.46 38.19 3g0g s ILE 319 CO 0.82 -0.68 2.91 0.00 0.00 0.00 0.00 174.94 177.99 3g0g n GLN 320 N 7.46 1.86 -0.09 2.79 6.02 -1.24 -4.01 117.38 130.17 3g0g n GLN 320 Ca 0.13 -1.16 0.09 0.00 -0.01 0.00 0.00 57.00 56.05 3g0g n GLN 320 Cb 0.48 -1.78 0.13 0.00 1.02 0.00 0.00 30.24 30.08 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 1.67 2.19 -3.43 1.08 0.23 -1.26 -1.88 115.26 113.87 3g0g n ASN 321 Ca 0.34 -2.99 -0.04 0.00 -0.53 0.00 0.00 54.58 51.36 3g0g n ASN 321 Cb 0.71 -0.41 -0.06 0.00 -2.08 0.00 0.00 39.78 37.95 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 -2.65 -1.14 0.07 -2.53 5.04 -1.26 -1.99 117.35 112.89 3g0g s TYR 322 Ca 0.29 1.56 0.05 0.00 -2.44 0.00 0.00 57.07 56.53 3g0g s TYR 322 Cb 0.26 0.40 -0.03 0.00 0.35 0.00 0.00 41.96 42.94 3g0g s TYR 322 CO 0.03 -0.69 -0.14 -1.54 -1.34 0.00 0.00 175.55 171.86 3g0g s SER 323 N 2.72 1.63 -0.03 4.32 1.04 -0.41 -2.15 113.70 120.82 3g0g s SER 323 Ca 0.08 -0.59 0.07 0.00 0.48 0.00 0.00 55.95 55.99 3g0g s SER 323 Cb -0.14 -0.05 -0.02 0.00 0.10 0.00 0.00 66.02 65.91 3g0g s SER 323 CO -0.17 -0.07 -0.24 -0.69 0.98 0.00 0.00 173.24 173.05 3g0g s VAL 324 N -1.21 2.20 -0.22 5.02 1.01 -0.79 -1.09 120.40 125.31 3g0g s VAL 324 Ca -0.02 -1.05 -0.06 0.00 0.00 0.00 0.00 61.98 60.86 3g0g s VAL 324 Cb -0.10 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 3g0g s VAL 324 CO 0.02 0.58 0.02 -0.32 0.00 0.00 0.00 175.10 175.39 3g0g s MET 325 N -0.55 3.57 -0.18 2.72 1.75 0.44 -1.09 119.30 125.96 3g0g s MET 325 Ca 0.08 -0.53 -0.10 0.00 -1.25 0.00 0.00 55.69 53.89 3g0g s MET 325 Cb -0.11 -3.15 -0.05 0.00 2.84 0.00 0.00 34.83 34.36 3g0g s MET 325 CO -0.00 -0.12 0.15 -0.51 -0.65 0.00 0.00 175.02 173.89 3g0g s ASP 326 N 1.35 6.26 -0.24 1.11 -0.00 0.24 -1.77 116.67 123.62 3g0g s ASP 326 Ca 0.05 0.30 -0.07 0.00 -0.00 0.00 0.00 52.55 52.82 3g0g s ASP 326 Cb -0.15 -2.10 -0.03 0.00 -0.00 0.00 0.00 42.92 40.64 3g0g s ASP 326 CO 0.01 0.20 0.07 -0.63 -0.00 0.00 0.00 175.17 174.82 3g0g s ILE 327 N 0.18 4.37 -0.07 0.77 1.09 -1.26 -1.03 121.20 125.25 3g0g s ILE 327 Ca 0.10 -0.16 0.05 0.00 -1.10 0.00 0.00 60.65 59.55 3g0g s ILE 327 Cb -0.11 -3.03 -0.01 0.00 -1.06 0.00 0.00 42.46 38.25 3g0g s ILE 327 CO -0.00 0.36 -0.24 0.00 -0.10 0.00 0.00 174.94 174.95 3g0g s ASP 329 N -0.04 4.50 -0.05 0.00 1.01 0.90 -1.63 116.67 121.36 3g0g s ASP 329 Ca -0.07 -0.08 -0.30 0.00 0.71 0.00 0.00 52.55 52.81 3g0g s ASP 329 Cb -0.15 -1.08 -0.03 0.00 1.01 0.00 0.00 42.92 42.67 3g0g s ASP 329 CO 0.05 0.35 1.09 -0.47 0.21 0.00 0.00 175.17 176.40 3g0g s TYR 330 N -0.82 3.42 -0.28 4.23 5.04 -0.32 -1.35 117.35 127.27 3g0g s TYR 330 Ca 0.13 1.45 -0.13 0.00 -2.44 0.00 0.00 57.07 56.07 3g0g s TYR 330 Cb -0.11 -3.28 -0.04 0.00 0.35 0.00 0.00 41.96 38.88 3g0g s TYR 330 CO 0.02 -0.69 0.30 0.34 -1.34 0.00 0.00 175.55 174.18 3g0g s ASP 331 N 1.21 6.15 0.15 4.32 -1.08 -0.42 -5.00 116.67 122.01 3g0g s ASP 331 Ca 0.53 0.10 -0.17 0.00 -0.52 0.00 0.00 52.55 52.49 3g0g s ASP 331 Cb -0.22 -2.17 0.06 0.00 -1.46 0.00 0.00 42.92 39.12 3g0g s ASP 331 CO 0.23 -0.16 1.73 -0.33 0.52 0.00 0.00 175.17 177.16 3g0g h GLU 332 N 8.29 0.20 -0.04 4.34 4.39 -1.96 -0.81 114.58 128.99 3g0g h GLU 332 Ca -0.33 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.28 3g0g h GLU 332 Cb 1.17 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 3g0g h GLU 332 CO 0.62 0.13 -0.29 0.66 -1.16 0.00 0.00 179.01 178.97 3g0g h SER 333 N 0.20 0.31 1.52 1.42 4.64 -1.97 -3.33 113.55 116.36 3g0g h SER 333 Ca 0.16 -0.69 -0.01 0.00 -0.47 0.00 0.00 61.79 60.77 3g0g h SER 333 Cb 0.17 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3g0g h SER 333 CO -0.20 0.96 -0.49 0.77 -0.87 0.00 0.00 176.83 177.00 3g0g h SER 334 N -0.31 0.00 0.00 4.97 4.64 -2.01 -3.47 113.55 117.38 3g0g h SER 334 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3g0g h SER 334 Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 3g0g h SER 334 CO 0.06 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.68 3g0g n GLY 335 N 1.15 0.44 3.87 -0.77 0.00 -0.31 -5.01 105.19 104.56 3g0g n GLY 335 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.53 2.61 -0.20 1.61 0.52 -1.25 -4.87 118.95 116.86 3g0g s ARG 336 Ca 0.00 -1.43 -0.04 0.00 -0.52 0.00 0.00 55.73 53.73 3g0g s ARG 336 Cb 0.00 -2.43 -0.02 0.00 0.52 0.00 0.00 34.95 33.02 3g0g s ARG 336 CO 0.00 -0.08 -0.02 -1.58 0.02 0.00 0.00 175.30 173.64 3g0g s TRP 337 N -2.40 3.01 -0.03 -0.53 0.52 -1.26 -1.30 118.94 116.95 3g0g s TRP 337 Ca 0.45 -0.52 0.04 0.00 0.02 0.00 0.00 56.10 56.09 3g0g s TRP 337 Cb -0.04 -2.06 -0.03 0.00 -1.15 0.00 0.00 33.47 30.19 3g0g s TRP 337 CO 0.27 -0.26 -0.13 -0.80 0.02 0.00 0.00 176.95 176.05 3g0g s ASN 338 N 0.97 4.11 -0.23 2.95 0.02 -0.46 -4.89 114.94 117.42 3g0g s ASN 338 Ca 0.01 -0.21 0.02 0.00 -1.02 0.00 0.00 52.86 51.66 3g0g s ASN 338 Cb -0.14 -0.86 0.05 0.00 0.02 0.00 0.00 41.25 40.31 3g0g s ASN 338 CO 0.01 0.33 -0.14 0.00 0.02 0.00 0.00 177.10 177.33 3g0g s LEU 340 N 1.20 4.39 0.54 0.00 1.02 -1.26 -4.92 118.68 119.66 3g0g s LEU 340 Ca -0.04 1.94 0.26 0.00 0.02 0.00 0.00 54.13 56.31 3g0g s LEU 340 Cb -0.17 -3.58 1.44 0.00 0.02 0.00 0.00 46.19 43.89 3g0g s LEU 340 CO -0.08 -0.38 2.01 0.58 0.02 0.00 0.00 176.35 178.50 3g0g h VAL 341 N 4.47 0.68 0.00 -1.59 2.07 -1.99 0.10 116.25 119.99 3g0g h VAL 341 Ca -0.42 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.10 3g0g h VAL 341 Cb 1.22 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 3g0g h VAL 341 CO 0.78 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.37 3g0g n ALA 342 N -2.56 2.13 -0.25 1.67 0.00 -1.26 -2.76 120.51 117.47 3g0g n ALA 342 Ca 0.08 -0.10 0.07 0.00 0.00 0.00 0.00 53.44 53.48 3g0g n ALA 342 Cb 0.54 -1.36 0.19 0.00 0.00 0.00 0.00 19.45 18.82 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 -1.33 2.87 -3.09 0.00 1.74 0.35 -4.72 116.66 112.49 3g0g n ARG 343 Ca 0.10 -2.20 -0.39 0.00 -0.77 0.00 0.00 57.85 54.59 3g0g n ARG 343 Cb 0.19 -1.35 -0.06 0.00 -1.02 0.00 0.00 32.46 30.22 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 -1.09 4.42 -0.11 5.56 -0.21 -1.11 -4.13 119.66 122.99 3g0g s GLN 344 Ca 0.29 0.97 0.03 0.00 0.02 0.00 0.00 55.36 56.67 3g0g s GLN 344 Cb 0.15 -3.29 0.01 0.00 1.00 0.00 0.00 33.01 30.88 3g0g s GLN 344 CO 0.18 0.50 -0.19 -1.01 -2.12 0.00 0.00 175.29 172.65 3g0g s HIS 345 N -0.77 2.27 -0.20 0.91 3.76 -0.73 -4.95 115.29 115.57 3g0g s HIS 345 Ca 0.34 -1.01 -0.09 0.00 -0.15 0.00 0.00 55.06 54.15 3g0g s HIS 345 Cb -0.21 -1.56 -0.05 0.00 1.11 0.00 0.00 32.58 31.87 3g0g s HIS 345 CO 0.22 -0.46 0.11 0.42 -0.85 0.00 0.00 174.74 174.19 3g0g s ILE 346 N 0.67 5.15 -0.30 0.60 1.01 -1.26 -0.42 121.20 126.63 3g0g s ILE 346 Ca -0.12 0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.66 3g0g s ILE 346 Cb -0.16 -3.35 0.08 0.00 0.01 0.00 0.00 42.46 39.04 3g0g s ILE 346 CO 0.03 0.43 -0.01 -0.70 0.00 0.00 0.00 174.94 174.69 3g0g s GLU 347 N 0.53 1.72 0.36 2.79 2.12 -0.25 -5.02 118.70 120.95 3g0g s GLU 347 Ca 0.06 -1.61 0.08 0.00 0.36 0.00 0.00 54.97 53.87 3g0g s GLU 347 Cb -0.12 -3.01 -0.05 0.00 0.26 0.00 0.00 34.13 31.21 3g0g s GLU 347 CO 0.00 -0.79 0.06 0.00 -0.54 0.00 0.00 175.26 173.99 3g0g s MET 348 N 1.03 2.14 -0.00 4.30 0.23 -1.26 -1.29 119.30 124.44 3g0g s MET 348 Ca 0.03 -1.76 -0.01 0.00 -1.03 0.00 0.00 55.69 52.92 3g0g s MET 348 Cb -0.19 -1.95 -0.00 0.00 -1.53 0.00 0.00 34.83 31.15 3g0g s MET 348 CO -0.08 0.08 0.01 0.45 -2.03 0.00 0.00 175.02 173.45 3g0g s SER 349 N -3.77 0.02 -0.18 -1.18 0.15 -0.84 -4.98 113.70 102.93 3g0g s SER 349 Ca 0.36 -0.05 0.17 0.00 0.70 0.00 0.00 55.95 57.13 3g0g s SER 349 Cb 0.01 0.05 -0.24 0.00 -1.71 0.00 0.00 66.02 64.13 3g0g s SER 349 CO 0.20 -0.06 0.09 0.35 1.20 0.00 0.00 173.24 175.03 3g0g n THR 350 N 2.83 1.20 0.06 6.45 -2.24 -1.26 -4.57 114.28 116.75 3g0g n THR 350 Ca -0.14 -0.78 0.08 0.00 -2.27 0.00 0.00 64.05 60.94 3g0g n THR 350 Cb 0.59 -0.46 -0.05 0.00 -2.10 0.00 0.00 70.33 68.31 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 -2.66 0.73 -0.16 4.28 -2.24 -1.26 -5.03 114.28 107.94 3g0g n THR 351 Ca -0.29 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 60.90 3g0g n THR 351 Cb 1.07 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 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 1.27 3.45 3.97 3.38 0.00 -1.26 -4.85 105.19 111.14 3g0g n GLY 352 Ca -0.04 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.58 3g0g n GLY 352 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 3g0g n TRP 353 N 0.00 -2.74 -4.48 1.61 2.14 -1.26 -4.61 117.44 108.10 3g0g n TRP 353 Ca 0.00 -1.90 -0.34 0.00 2.07 0.00 0.00 57.50 57.33 3g0g n TRP 353 Cb 0.00 -0.69 -0.12 0.00 -0.81 0.00 0.00 31.31 29.69 3g0g n TRP 353 CO 0.00 0.00 0.00 0.54 2.07 0.00 0.00 177.69 180.30 3g0g s VAL 354 N -3.02 3.76 0.05 -1.67 0.11 -0.78 -4.82 120.40 114.03 3g0g s VAL 354 Ca 0.66 -0.41 0.00 0.00 -2.93 0.00 0.00 61.98 59.30 3g0g s VAL 354 Cb -0.04 -2.63 0.00 0.00 -1.53 0.00 0.00 36.38 32.18 3g0g s VAL 354 CO 0.43 0.51 0.00 0.61 -3.33 0.00 0.00 175.10 173.32 3g0g n GLY 355 N 3.37 -1.73 0.09 6.54 0.00 -1.26 -3.51 105.19 108.68 3g0g n GLY 355 Ca -0.18 -1.47 -0.14 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.17 0.14 0.00 1.61 3.08 -1.95 -3.41 114.38 113.68 3g0g h ARG 356 Ca -0.00 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.95 3g0g h ARG 356 Cb 0.16 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3g0g h ARG 356 CO 0.00 0.70 -0.61 1.19 -1.07 0.00 0.00 179.97 180.18 3g0g n PHE 357 N -4.67 0.00 -3.47 3.04 3.72 -1.26 -4.89 117.46 109.94 3g0g n PHE 357 Ca -0.08 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.19 3g0g n PHE 357 Cb 0.36 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.87 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 -1.37 1.13 0.28 -1.08 1.70 -1.26 -5.03 118.95 113.33 3g0g s ARG 358 Ca 0.00 -0.22 -0.30 0.00 -0.47 0.00 0.00 55.73 54.75 3g0g s ARG 358 Cb 0.00 0.52 -0.13 0.00 -0.57 0.00 0.00 34.95 34.77 3g0g s ARG 358 CO 0.00 -0.45 1.29 -2.30 -1.08 0.00 0.00 175.30 172.75 3g0g n PRO 359 N 0.05 1.91 -0.70 3.89 -0.02 -1.23 -4.37 135.00 134.53 3g0g n PRO 359 Ca -0.16 0.68 -0.31 0.00 -2.02 0.00 0.00 63.50 61.68 3g0g n PRO 359 Cb 0.62 -2.25 0.16 0.00 -0.02 0.00 0.00 33.50 32.01 3g0g n PRO 359 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3g0g n SER 360 N 1.48 -0.12 -4.84 2.55 2.88 -1.26 -4.95 113.62 109.36 3g0g n SER 360 Ca 0.09 0.41 -0.37 0.00 -1.33 0.00 0.00 58.87 57.67 3g0g n SER 360 Cb 0.33 -1.43 -0.06 0.00 -0.75 0.00 0.00 64.21 62.30 3g0g n SER 360 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 3g0g s GLU 361 N -4.43 4.01 0.43 -1.46 1.03 -1.26 -4.94 118.70 112.07 3g0g s GLU 361 Ca 0.65 0.52 -0.22 0.00 0.03 0.00 0.00 54.97 55.95 3g0g s GLU 361 Cb -0.23 -3.07 -0.10 0.00 -0.80 0.00 0.00 34.13 29.93 3g0g s GLU 361 CO 0.60 0.57 0.99 -1.25 -1.33 0.00 0.00 175.26 174.84 3g0g s PRO 362 N -1.57 4.13 -0.32 -4.83 0.04 -1.26 -4.60 135.00 126.59 3g0g s PRO 362 Ca 0.32 1.28 0.03 0.00 0.04 0.00 0.00 61.00 62.68 3g0g s PRO 362 Cb -0.16 -2.28 0.09 0.00 0.04 0.00 0.00 34.50 32.18 3g0g s PRO 362 CO 0.18 -0.13 0.01 -1.01 0.04 0.00 0.00 177.00 176.08 3g0g s HIS 363 N -1.97 3.59 0.31 0.56 3.76 0.21 -4.93 115.29 116.81 3g0g s HIS 363 Ca 0.62 -2.73 -0.27 0.00 -0.15 0.00 0.00 55.06 52.53 3g0g s HIS 363 Cb -0.14 -2.60 -0.09 0.00 1.11 0.00 0.00 32.58 30.85 3g0g s HIS 363 CO 0.19 -0.92 0.98 -0.06 -0.85 0.00 0.00 174.74 174.07 3g0g s PHE 364 N 0.99 3.69 0.64 1.40 0.40 -1.26 -0.51 117.98 123.32 3g0g s PHE 364 Ca 0.04 1.79 -0.17 0.00 -0.60 0.00 0.00 56.93 57.99 3g0g s PHE 364 Cb -0.20 -3.01 -0.01 0.00 0.51 0.00 0.00 43.02 40.31 3g0g s PHE 364 CO -0.07 0.05 1.16 0.95 0.70 0.00 0.00 175.22 178.02 3g0g s THR 365 N -1.45 2.83 0.37 0.64 -4.23 -0.20 -4.88 115.64 108.72 3g0g s THR 365 Ca 0.48 0.45 0.17 0.00 -1.18 0.00 0.00 61.69 61.62 3g0g s THR 365 Cb -0.23 -3.06 0.37 0.00 1.34 0.00 0.00 72.50 70.92 3g0g s THR 365 CO 0.29 -0.18 1.71 0.25 -0.54 0.00 0.00 174.62 176.15 3g0g h LEU 366 N 0.41 0.48 -0.05 4.79 5.85 -1.91 0.59 115.31 125.48 3g0g h LEU 366 Ca -0.49 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.37 3g0g h LEU 366 Cb 1.28 0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.38 3g0g h LEU 366 CO 0.54 -0.02 0.00 -2.24 -0.34 0.00 0.00 178.44 176.38 3g0g h ASP 367 N 0.36 0.00 -0.12 1.25 -0.00 -1.91 -3.47 116.42 112.52 3g0g h ASP 367 Ca 0.68 0.00 -0.05 0.00 -0.00 0.00 0.00 57.03 57.66 3g0g h ASP 367 Cb 1.67 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.98 3g0g h ASP 367 CO -0.44 0.00 -0.05 0.61 -0.00 0.00 0.00 179.24 179.36 3g0g n GLY 368 N 1.20 0.59 0.27 7.15 0.00 0.21 -4.90 105.19 109.70 3g0g n GLY 368 Ca 0.05 -0.59 0.11 0.00 0.00 0.00 0.00 46.02 45.60 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 0.83 1.36 -4.02 1.61 3.02 -1.26 -4.93 115.26 111.87 3g0g n ASN 369 Ca -0.03 -1.09 -0.08 0.00 -0.03 0.00 0.00 54.58 53.36 3g0g n ASN 369 Cb 0.12 0.46 -0.09 0.00 -0.61 0.00 0.00 39.78 39.66 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 -2.65 0.37 0.07 6.41 0.01 -1.26 -1.72 113.70 114.93 3g0g s SER 370 Ca 0.17 -0.88 -0.18 0.00 1.31 0.00 0.00 55.95 56.37 3g0g s SER 370 Cb 0.18 0.24 0.04 0.00 0.21 0.00 0.00 66.02 66.69 3g0g s SER 370 CO 0.63 -0.63 0.43 0.72 0.41 0.00 0.00 173.24 174.81 3g0g s PHE 371 N -3.83 -0.29 -0.11 2.43 -0.12 -0.84 -1.03 117.98 114.20 3g0g s PHE 371 Ca 0.06 0.17 -0.01 0.00 -0.05 0.00 0.00 56.93 57.09 3g0g s PHE 371 Cb 0.07 0.26 -0.03 0.00 -0.63 0.00 0.00 43.02 42.69 3g0g s PHE 371 CO -0.10 -0.63 -0.05 0.71 -0.05 0.00 0.00 175.22 175.10 3g0g s TYR 372 N -2.92 3.00 -0.05 3.49 2.02 0.33 0.03 117.35 123.26 3g0g s TYR 372 Ca -0.03 -0.12 -0.16 0.00 -0.37 0.00 0.00 57.07 56.39 3g0g s TYR 372 Cb 0.00 -1.83 0.03 0.00 -0.40 0.00 0.00 41.96 39.76 3g0g s TYR 372 CO -0.06 0.17 0.37 -1.59 -1.57 0.00 0.00 175.55 172.87 3g0g s LYS 373 N -0.27 0.67 -0.09 -0.62 -2.85 -0.74 0.64 119.74 116.48 3g0g s LYS 373 Ca 0.04 0.01 -0.30 0.00 -1.00 0.00 0.00 55.97 54.73 3g0g s LYS 373 Cb -0.13 0.30 -0.03 0.00 -2.06 0.00 0.00 37.83 35.92 3g0g s LYS 373 CO 0.02 -0.17 1.24 0.42 0.10 0.00 0.00 175.35 176.96 3g0g s ILE 374 N -0.99 4.21 0.12 3.79 1.01 -1.26 -1.47 121.20 126.61 3g0g s ILE 374 Ca -0.10 1.52 0.03 0.00 0.00 0.00 0.00 60.65 62.10 3g0g s ILE 374 Cb -0.04 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 3g0g s ILE 374 CO 0.04 -0.05 -0.09 0.27 0.00 0.00 0.00 174.94 175.12 3g0g s ILE 375 N 2.66 0.92 0.17 2.92 -4.36 -0.60 -4.54 121.20 118.37 3g0g s ILE 375 Ca 0.56 -1.92 -0.30 0.00 -0.26 0.00 0.00 60.65 58.74 3g0g s ILE 375 Cb -0.24 -1.67 -0.07 0.00 1.25 0.00 0.00 42.46 41.72 3g0g s ILE 375 CO 0.20 -0.76 1.03 -0.94 0.24 0.00 0.00 174.94 174.71 3g0g s SER 376 N -2.96 7.40 0.81 4.36 1.04 -1.26 -0.75 113.70 122.34 3g0g s SER 376 Ca 0.12 1.99 0.00 0.00 0.48 0.00 0.00 55.95 58.54 3g0g s SER 376 Cb 0.02 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.54 3g0g s SER 376 CO -0.02 -0.11 0.00 -0.46 0.98 0.00 0.00 173.24 173.63 3g0g n ASN 377 N 2.29 0.00 0.03 7.02 0.23 0.42 -4.86 115.26 120.39 3g0g n ASN 377 Ca 0.02 -0.82 -0.07 0.00 -0.53 0.00 0.00 54.58 53.18 3g0g n ASN 377 Cb 0.47 0.00 0.11 0.00 -2.08 0.00 0.00 39.78 38.28 3g0g n ASN 377 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3g0g h GLU 378 N 0.00 0.44 -0.00 -3.83 3.07 -1.96 -2.81 114.58 109.48 3g0g h GLU 378 Ca 0.00 -0.25 0.00 0.00 -0.50 0.00 0.00 59.36 58.61 3g0g h GLU 378 Cb 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 3g0g h GLU 378 CO 0.00 0.83 0.00 -0.85 -1.40 0.00 0.00 179.01 177.59 3g0g n GLU 379 N -3.98 1.02 -0.13 2.33 0.28 -1.26 -4.88 120.64 114.02 3g0g n GLU 379 Ca -0.02 -0.03 0.00 0.00 -0.16 0.00 0.00 57.16 56.95 3g0g n GLU 379 Cb 0.56 -1.34 0.00 0.00 1.43 0.00 0.00 31.44 32.09 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 0.84 0.71 3.82 -1.84 0.00 -1.06 -4.83 105.19 102.84 3g0g n GLY 380 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 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 3.42 -0.29 1.61 1.51 -1.26 -0.68 117.35 119.49 3g0g s TYR 381 Ca 0.00 0.33 -0.25 0.00 -1.01 0.00 0.00 57.07 56.14 3g0g s TYR 381 Cb 0.00 -1.82 0.00 0.00 -0.11 0.00 0.00 41.96 40.03 3g0g s TYR 381 CO 0.00 0.62 0.88 1.03 -1.11 0.00 0.00 175.55 176.97 3g0g s ARG 382 N -1.46 4.05 0.10 -0.62 0.52 -1.26 0.16 118.95 120.44 3g0g s ARG 382 Ca 0.20 0.82 -0.01 0.00 -0.52 0.00 0.00 55.73 56.21 3g0g s ARG 382 Cb -0.12 -3.71 -0.04 0.00 0.52 0.00 0.00 34.95 31.60 3g0g s ARG 382 CO 0.10 -0.70 0.03 -1.01 0.02 0.00 0.00 175.30 173.75 3g0g s HIS 383 N 3.11 0.72 -0.08 -0.53 3.76 0.07 -1.25 115.29 121.09 3g0g s HIS 383 Ca 0.37 -1.16 -0.30 0.00 -0.15 0.00 0.00 55.06 53.82 3g0g s HIS 383 Cb -0.14 -0.43 -0.03 0.00 1.11 0.00 0.00 32.58 33.09 3g0g s HIS 383 CO 0.12 -0.47 1.17 0.42 -0.85 0.00 0.00 174.74 175.13 3g0g s ILE 384 N -4.00 4.35 -0.10 0.60 1.01 -1.26 -1.56 121.20 120.23 3g0g s ILE 384 Ca 0.17 1.66 0.02 0.00 0.00 0.00 0.00 60.65 62.51 3g0g s ILE 384 Cb 0.08 -4.07 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 3g0g s ILE 384 CO -0.03 -0.02 -0.18 0.00 0.00 0.00 0.00 174.94 174.71 3g0g s TYR 386 N 0.12 3.45 -0.01 0.00 6.14 -0.42 -1.79 117.35 124.83 3g0g s TYR 386 Ca -0.09 0.87 0.06 0.00 0.64 0.00 0.00 57.07 58.55 3g0g s TYR 386 Cb -0.15 -2.64 -0.03 0.00 0.42 0.00 0.00 41.96 39.56 3g0g s TYR 386 CO 0.06 0.03 -0.19 -0.06 0.64 0.00 0.00 175.55 176.03 3g0g s PHE 387 N 1.14 2.56 -0.21 4.97 0.08 0.10 -2.40 117.98 124.23 3g0g s PHE 387 Ca 0.26 -0.26 -0.16 0.00 0.12 0.00 0.00 56.93 56.89 3g0g s PHE 387 Cb -0.15 -1.54 -0.04 0.00 -0.57 0.00 0.00 43.02 40.71 3g0g s PHE 387 CO 0.11 0.15 0.42 -0.65 -0.10 0.00 0.00 175.22 175.14 3g0g s GLN 388 N -0.91 4.15 0.41 0.44 -1.52 -1.26 -1.99 119.66 118.98 3g0g s GLN 388 Ca 0.12 0.22 0.22 0.00 -1.95 0.00 0.00 55.36 53.96 3g0g s GLN 388 Cb -0.10 -3.56 1.20 0.00 -0.22 0.00 0.00 33.01 30.32 3g0g s GLN 388 CO 0.01 -0.10 1.72 0.82 -0.25 0.00 0.00 175.29 177.50 3g0g h ILE 389 N 5.10 0.40 0.15 1.08 5.03 -1.70 -2.34 117.51 125.23 3g0g h ILE 389 Ca -0.35 -0.10 -0.34 0.00 -0.12 0.00 0.00 64.86 63.95 3g0g h ILE 389 Cb 1.16 0.07 -0.00 0.00 -3.03 0.00 0.00 36.82 35.02 3g0g h ILE 389 CO 0.71 0.05 -1.72 0.44 -0.68 0.00 0.00 178.15 176.95 3g0g h ASP 390 N 0.30 0.50 -2.96 1.72 3.32 -1.84 -3.41 116.42 114.05 3g0g h ASP 390 Ca 0.67 -0.78 -0.61 0.00 0.02 0.00 0.00 57.03 56.32 3g0g h ASP 390 Cb 1.82 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 41.17 3g0g h ASP 390 CO -0.35 1.67 -0.44 -0.54 -1.72 0.00 0.00 179.24 177.86 3g0g s LYS 391 N -2.59 3.49 0.05 3.56 1.02 -0.88 -4.76 119.74 119.63 3g0g s LYS 391 Ca -0.14 -0.31 -0.23 0.00 0.02 0.00 0.00 55.97 55.30 3g0g s LYS 391 Cb 0.06 -3.01 -0.16 0.00 -0.52 0.00 0.00 37.83 34.21 3g0g s LYS 391 CO 0.84 0.59 1.54 -0.22 -0.92 0.00 0.00 175.35 177.18 3g0g h LYS 392 N 3.20 0.06 -6.15 1.68 1.63 -1.93 -3.41 116.57 111.65 3g0g h LYS 392 Ca -0.46 -0.01 -0.58 0.00 -0.85 0.00 0.00 60.65 58.74 3g0g h LYS 392 Cb 1.17 -0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.75 3g0g h LYS 392 CO 0.73 0.26 -0.21 -0.51 -3.45 0.00 0.00 179.45 176.27 3g0g s ASP 393 N -5.47 6.67 0.45 4.20 -0.00 -1.26 -5.01 116.67 116.25 3g0g s ASP 393 Ca -0.14 0.84 0.07 0.00 -0.00 0.00 0.00 52.55 53.32 3g0g s ASP 393 Cb 0.05 -2.20 -0.01 0.00 -0.00 0.00 0.00 42.92 40.76 3g0g s ASP 393 CO 0.68 0.15 0.38 0.00 -0.00 0.00 0.00 175.17 176.38 3g0g s THR 395 N -2.56 1.62 0.22 0.00 -4.23 -1.01 -4.95 115.64 104.73 3g0g s THR 395 Ca 0.45 -0.80 -0.30 0.00 -1.18 0.00 0.00 61.69 59.86 3g0g s THR 395 Cb -0.02 -1.41 -0.09 0.00 1.34 0.00 0.00 72.50 72.33 3g0g s THR 395 CO 0.26 0.46 0.96 -0.36 -0.54 0.00 0.00 174.62 175.40 3g0g s PHE 396 N 0.21 3.93 -0.59 3.99 0.08 -1.26 -1.30 117.98 123.04 3g0g s PHE 396 Ca -0.10 1.88 0.09 0.00 0.12 0.00 0.00 56.93 58.92 3g0g s PHE 396 Cb -0.14 -3.02 -0.06 0.00 -0.57 0.00 0.00 43.02 39.23 3g0g s PHE 396 CO 0.04 0.33 0.46 0.44 -0.10 0.00 0.00 175.22 176.40 3g0g n ILE 397 N 1.67 0.00 -4.28 0.64 -5.35 -0.36 -4.96 119.36 106.73 3g0g n ILE 397 Ca -0.01 -0.34 -0.17 0.00 -0.27 0.00 0.00 62.75 61.96 3g0g n ILE 397 Cb 0.47 1.04 -0.11 0.00 -1.74 0.00 0.00 39.64 39.31 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 -1.60 1.43 0.29 7.28 -4.23 -1.25 -4.81 115.64 112.75 3g0g s THR 398 Ca 0.05 -1.95 -0.20 0.00 -1.18 0.00 0.00 61.69 58.41 3g0g s THR 398 Cb 0.07 -1.77 0.02 0.00 1.34 0.00 0.00 72.50 72.16 3g0g s THR 398 CO 0.31 -0.54 0.71 -1.59 -0.54 0.00 0.00 174.62 172.96 3g0g s LYS 399 N -3.22 1.84 0.00 3.99 -2.85 -1.26 -4.58 119.74 113.66 3g0g s LYS 399 Ca 0.15 -1.08 0.00 0.00 -1.00 0.00 0.00 55.97 54.04 3g0g s LYS 399 Cb -0.02 0.60 0.00 0.00 -2.06 0.00 0.00 37.83 36.35 3g0g s LYS 399 CO 0.04 -0.84 0.00 0.41 0.10 0.00 0.00 175.35 175.06 3g0g n GLY 400 N -0.47 2.25 2.73 0.59 0.00 -1.26 -4.87 105.19 104.17 3g0g n GLY 400 Ca -0.04 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 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 -1.33 4.70 -3.83 2.61 -2.24 -1.26 -4.80 114.28 108.13 3g0g n THR 401 Ca 0.00 -4.43 -0.06 0.00 -2.27 0.00 0.00 64.05 57.29 3g0g n THR 401 Cb 0.00 -2.25 -0.01 0.00 -2.10 0.00 0.00 70.33 65.97 3g0g n THR 401 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3g0g s TRP 402 N -0.28 -0.13 0.11 4.78 1.48 -1.26 -5.02 118.94 118.62 3g0g s TRP 402 Ca 0.44 -0.32 0.09 0.00 -1.06 0.00 0.00 56.10 55.25 3g0g s TRP 402 Cb 0.13 0.71 -0.04 0.00 -1.16 0.00 0.00 33.47 33.11 3g0g s TRP 402 CO -0.03 -1.18 -0.22 -1.21 -4.06 0.00 0.00 176.95 170.25 3g0g s GLU 403 N -3.52 1.21 -0.12 3.25 2.02 -1.26 -4.57 118.70 115.70 3g0g s GLU 403 Ca 0.12 -1.20 -0.25 0.00 0.02 0.00 0.00 54.97 53.67 3g0g s GLU 403 Cb -0.05 -1.53 -0.02 0.00 0.10 0.00 0.00 34.13 32.63 3g0g s GLU 403 CO 0.06 0.36 0.78 0.08 0.02 0.00 0.00 175.26 176.56 3g0g s VAL 404 N -1.12 4.95 -0.17 2.63 1.01 -0.38 -2.41 120.40 124.91 3g0g s VAL 404 Ca 0.08 1.56 -0.24 0.00 0.00 0.00 0.00 61.98 63.39 3g0g s VAL 404 Cb -0.10 -4.10 -0.23 0.00 0.00 0.00 0.00 36.38 31.95 3g0g s VAL 404 CO 0.05 0.13 0.46 0.40 0.00 0.00 0.00 175.10 176.13 3g0g h ILE 405 N 5.00 1.25 -1.86 2.22 1.08 -0.98 -3.45 117.51 120.77 3g0g h ILE 405 Ca -0.35 -2.27 -0.01 0.00 -0.39 0.00 0.00 64.86 61.85 3g0g h ILE 405 Cb 1.16 2.71 -0.22 0.00 -3.07 0.00 0.00 36.82 37.40 3g0g h ILE 405 CO 0.79 0.47 0.25 -0.83 -0.69 0.00 0.00 178.15 178.15 3g0g s GLY 406 N -4.63 -0.42 -0.24 5.37 0.00 -1.06 -5.00 107.32 101.33 3g0g s GLY 406 Ca -0.24 2.12 -0.29 0.00 0.00 0.00 0.00 44.72 46.31 3g0g s GLY 406 CO 0.65 1.63 1.12 -0.42 0.00 0.00 0.00 173.10 176.07 3g0g s ILE 407 N 0.04 4.52 -0.17 0.90 1.01 -1.26 -1.14 121.20 125.10 3g0g s ILE 407 Ca -0.01 1.81 0.17 0.00 0.00 0.00 0.00 60.65 62.62 3g0g s ILE 407 Cb -0.04 -4.25 -0.25 0.00 0.01 0.00 0.00 42.46 37.94 3g0g s ILE 407 CO 0.00 -0.25 0.20 -0.62 0.00 0.00 0.00 174.94 174.27 3g0g n GLU 408 N 6.56 0.68 -3.61 2.79 -0.58 -0.06 -4.97 120.64 121.45 3g0g n GLU 408 Ca 0.13 0.06 -0.13 0.00 -0.42 0.00 0.00 57.16 56.79 3g0g n GLU 408 Cb 0.46 -1.58 -0.07 0.00 -0.57 0.00 0.00 31.44 29.68 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 -2.51 -1.83 -0.21 0.62 0.00 -1.10 -4.89 121.76 111.83 3g0g s ALA 409 Ca -0.09 1.82 0.01 0.00 0.00 0.00 0.00 51.96 53.70 3g0g s ALA 409 Cb 0.06 -0.97 0.05 0.00 0.00 0.00 0.00 23.12 22.26 3g0g s ALA 409 CO 0.83 -0.32 -0.11 -1.17 0.00 0.00 0.00 175.76 174.99 3g0g s LEU 410 N -0.08 2.53 0.00 0.00 2.96 -1.26 0.52 118.68 123.35 3g0g s LEU 410 Ca -0.02 -1.00 0.00 0.00 -0.22 0.00 0.00 54.13 52.89 3g0g s LEU 410 Cb -0.04 -1.31 0.00 0.00 0.50 0.00 0.00 46.19 45.35 3g0g s LEU 410 CO 0.01 -0.15 0.00 0.35 -1.32 0.00 0.00 176.35 175.24 3g0g n THR 411 N 4.63 0.00 0.12 3.68 -2.24 0.40 -5.02 114.28 115.86 3g0g n THR 411 Ca -0.15 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.67 3g0g n THR 411 Cb 0.46 -1.06 0.02 0.00 -2.10 0.00 0.00 70.33 67.64 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 0.00 0.00 0.00 3.42 0.87 -2.00 -3.38 113.55 112.46 3g0g h SER 412 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3g0g h SER 412 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 3g0g h SER 412 CO 0.00 0.41 -0.89 0.47 -0.53 0.00 0.00 176.83 176.29 3g0g n ASP 413 N -3.10 3.00 -3.81 6.23 8.00 -1.26 -4.91 116.55 120.70 3g0g n ASP 413 Ca -0.00 -0.17 -0.13 0.00 0.71 0.00 0.00 54.79 55.20 3g0g n ASP 413 Cb 0.72 1.13 -0.14 0.00 -0.02 0.00 0.00 41.12 42.80 3g0g n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3g0g s TYR 414 N -2.01 -0.10 -0.26 1.24 1.51 -1.26 -1.21 117.35 115.27 3g0g s TYR 414 Ca -0.01 0.28 -0.10 0.00 -1.01 0.00 0.00 57.07 56.24 3g0g s TYR 414 Cb 0.03 -0.03 -0.04 0.00 -0.11 0.00 0.00 41.96 41.80 3g0g s TYR 414 CO 0.16 -0.08 0.14 -1.17 -1.11 0.00 0.00 175.55 173.49 3g0g s LEU 415 N 0.46 3.87 -0.12 -1.29 1.98 -0.86 -0.45 118.68 122.26 3g0g s LEU 415 Ca -0.03 -0.04 -0.09 0.00 -2.89 0.00 0.00 54.13 51.08 3g0g s LEU 415 Cb -0.05 -2.05 -0.04 0.00 0.66 0.00 0.00 46.19 44.70 3g0g s LEU 415 CO -0.02 -0.01 0.20 -0.31 -1.89 0.00 0.00 176.35 174.32 3g0g s TYR 416 N 1.50 3.58 0.18 5.38 2.02 0.19 -0.26 117.35 129.93 3g0g s TYR 416 Ca 0.07 0.58 -0.12 0.00 -0.37 0.00 0.00 57.07 57.22 3g0g s TYR 416 Cb -0.15 -2.07 0.00 0.00 -0.40 0.00 0.00 41.96 39.34 3g0g s TYR 416 CO 0.07 0.60 0.39 1.52 -1.57 0.00 0.00 175.55 176.56 3g0g s TYR 417 N -0.66 0.22 -0.07 2.71 -0.85 -0.46 -0.88 117.35 117.36 3g0g s TYR 417 Ca 0.15 -0.57 0.05 0.00 -0.52 0.00 0.00 57.07 56.18 3g0g s TYR 417 Cb -0.13 0.12 -0.00 0.00 0.38 0.00 0.00 41.96 42.33 3g0g s TYR 417 CO 0.05 -0.82 -0.21 0.42 -1.52 0.00 0.00 175.55 173.47 3g0g s ILE 418 N -3.94 1.78 0.24 -3.49 1.01 -0.29 0.50 121.20 117.00 3g0g s ILE 418 Ca 0.15 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 59.85 3g0g s ILE 418 Cb 0.01 -1.53 -0.02 0.00 0.01 0.00 0.00 42.46 40.93 3g0g s ILE 418 CO -0.00 0.50 0.31 -0.94 0.00 0.00 0.00 174.94 174.81 3g0g s SER 419 N 0.12 0.17 -0.38 3.58 1.04 -0.69 -0.29 113.70 117.25 3g0g s SER 419 Ca -0.09 -1.22 0.06 0.00 0.48 0.00 0.00 55.95 55.18 3g0g s SER 419 Cb -0.15 0.49 0.64 0.00 0.10 0.00 0.00 66.02 67.10 3g0g s SER 419 CO 0.05 -1.01 1.77 -0.46 0.98 0.00 0.00 173.24 174.57 3g0g n ASN 420 N -0.46 3.58 -0.19 7.02 0.23 -1.01 -1.46 115.26 122.98 3g0g n ASN 420 Ca 0.01 -3.58 -0.09 0.00 -0.53 0.00 0.00 54.58 50.38 3g0g n ASN 420 Cb 0.64 -0.77 0.01 0.00 -2.08 0.00 0.00 39.78 37.58 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 1.27 0.89 -6.30 -3.83 4.81 -1.82 -3.33 114.58 106.27 3g0g h GLU 421 Ca 0.46 -0.24 -0.66 0.00 -0.13 0.00 0.00 59.36 58.78 3g0g h GLU 421 Cb 2.45 -0.10 0.04 0.00 0.63 0.00 0.00 28.75 31.77 3g0g h GLU 421 CO 0.85 0.87 0.71 0.98 -0.73 0.00 0.00 179.01 181.69 3g0g n TYR 422 N -4.36 1.91 -1.12 0.92 -0.00 -1.26 -1.60 117.16 111.65 3g0g n TYR 422 Ca 0.02 0.45 -0.09 0.00 -0.00 0.00 0.00 57.90 58.28 3g0g n TYR 422 Cb 0.27 -2.45 -0.04 0.00 -0.00 0.00 0.00 39.34 37.12 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 3.89 -1.57 -2.29 2.98 5.02 -1.26 -2.29 118.16 122.63 3g0g n LYS 423 Ca 0.20 0.63 -0.17 0.00 -2.02 0.00 0.00 58.31 56.96 3g0g n LYS 423 Cb 0.21 -4.73 -0.01 0.00 -0.02 0.00 0.00 35.03 30.48 3g0g n LYS 423 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g0g n GLY 424 N 0.10 -0.25 3.51 0.72 0.00 -0.63 -4.98 105.19 103.66 3g0g n GLY 424 Ca -0.09 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 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 -4.79 3.35 0.11 1.61 -1.94 -0.97 -4.94 119.30 111.73 3g0g s MET 425 Ca 0.00 -0.64 0.21 0.00 -1.71 0.00 0.00 55.69 53.54 3g0g s MET 425 Cb 0.00 -3.87 0.85 0.00 2.01 0.00 0.00 34.83 33.82 3g0g s MET 425 CO 0.00 -0.61 1.64 -2.30 -0.01 0.00 0.00 175.02 173.75 3g0g n PRO 426 N 5.32 0.10 -0.05 2.03 -0.02 -1.26 -2.63 135.00 138.49 3g0g n PRO 426 Ca -0.10 0.27 0.12 0.00 -2.02 0.00 0.00 63.50 61.78 3g0g n PRO 426 Cb 0.49 -1.66 0.21 0.00 -0.02 0.00 0.00 33.50 32.51 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 0.34 0.97 3.95 -1.23 0.00 -1.26 -4.87 105.19 103.08 3g0g n GLY 427 Ca 0.04 -0.65 -0.23 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.86 1.44 -0.06 -0.02 0.00 -1.08 -2.90 107.32 102.84 3g0g s GLY 428 Ca 0.32 -0.99 -0.03 0.00 0.00 0.00 0.00 44.72 44.03 3g0g s GLY 428 CO 0.31 -0.89 0.11 0.50 0.00 0.00 0.00 173.10 173.13 3g0g s ARG 429 N -4.41 -0.02 0.18 2.90 1.81 -0.06 -4.13 118.95 115.22 3g0g s ARG 429 Ca 0.44 0.45 0.05 0.00 -1.72 0.00 0.00 55.73 54.94 3g0g s ARG 429 Cb -0.10 -0.37 -0.05 0.00 -0.45 0.00 0.00 34.95 33.98 3g0g s ARG 429 CO 0.37 -0.30 -0.10 -0.80 -0.68 0.00 0.00 175.30 173.79 3g0g s ASN 430 N 2.10 2.03 -0.14 0.23 -0.87 -0.53 -1.07 114.94 116.69 3g0g s ASN 430 Ca 0.02 -1.05 -0.11 0.00 -1.57 0.00 0.00 52.86 50.16 3g0g s ASN 430 Cb -0.12 -0.05 -0.05 0.00 -0.02 0.00 0.00 41.25 41.02 3g0g s ASN 430 CO -0.04 -0.31 0.22 -0.22 -2.57 0.00 0.00 177.10 174.17 3g0g s LEU 431 N -3.23 4.30 0.13 0.60 2.96 -1.26 -1.70 118.68 120.47 3g0g s LEU 431 Ca 0.20 0.47 0.06 0.00 -0.22 0.00 0.00 54.13 54.64 3g0g s LEU 431 Cb 0.02 -2.23 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 3g0g s LEU 431 CO 0.04 0.24 -0.14 -0.31 -1.32 0.00 0.00 176.35 174.85 3g0g s TYR 432 N -0.16 1.46 -0.11 5.38 2.02 0.18 -0.89 117.35 125.23 3g0g s TYR 432 Ca 0.14 -0.55 -0.00 0.00 -0.37 0.00 0.00 57.07 56.29 3g0g s TYR 432 Cb -0.13 -0.76 0.02 0.00 -0.40 0.00 0.00 41.96 40.70 3g0g s TYR 432 CO 0.03 0.17 -0.09 0.21 -1.57 0.00 0.00 175.55 174.31 3g0g s LYS 433 N -2.74 1.59 -0.25 -0.62 2.20 -0.24 -1.36 119.74 118.33 3g0g s LYS 433 Ca 0.10 -0.29 -0.11 0.00 -0.36 0.00 0.00 55.97 55.32 3g0g s LYS 433 Cb -0.05 -1.59 -0.05 0.00 -1.51 0.00 0.00 37.83 34.64 3g0g s LYS 433 CO 0.03 -0.22 0.17 0.42 -0.36 0.00 0.00 175.35 175.39 3g0g s ILE 434 N 1.55 5.35 -0.40 5.43 1.01 0.64 -1.65 121.20 133.12 3g0g s ILE 434 Ca 0.02 0.18 -0.29 0.00 0.00 0.00 0.00 60.65 60.56 3g0g s ILE 434 Cb -0.13 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.84 3g0g s ILE 434 CO -0.07 0.33 1.49 -1.58 0.00 0.00 0.00 174.94 175.11 3g0g s GLN 435 N 1.19 3.52 0.39 2.79 0.74 -0.93 -2.02 119.66 125.34 3g0g s GLN 435 Ca 0.07 1.03 0.28 0.00 0.05 0.00 0.00 55.36 56.79 3g0g s GLN 435 Cb -0.14 -4.06 1.35 0.00 1.10 0.00 0.00 33.01 31.26 3g0g s GLN 435 CO 0.06 -1.64 1.84 -0.07 -0.55 0.00 0.00 175.29 174.93 3g0g h LEU 436 N 12.53 0.00 0.00 3.68 4.07 -1.50 -1.80 115.31 132.28 3g0g h LEU 436 Ca -0.29 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.55 3g0g h LEU 436 Cb 1.12 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.84 3g0g h LEU 436 CO 1.08 0.00 -0.75 0.77 -1.08 0.00 0.00 178.44 178.45 3g0g h SER 437 N 0.00 0.00 -1.93 -0.43 4.64 -1.91 -3.41 113.55 110.51 3g0g h SER 437 Ca 0.00 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.94 3g0g h SER 437 Cb 0.18 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 61.96 3g0g h SER 437 CO 0.00 0.51 -0.71 -0.62 -0.87 0.00 0.00 176.83 175.13 3g0g s ASP 438 N -6.25 1.00 0.64 4.97 3.68 -0.72 -5.02 116.67 114.97 3g0g s ASP 438 Ca 0.02 -1.81 0.32 0.00 2.13 0.00 0.00 52.55 53.21 3g0g s ASP 438 Cb 0.08 0.53 1.77 0.00 -1.45 0.00 0.00 42.92 43.84 3g0g s ASP 438 CO 0.76 -0.23 2.04 0.10 0.13 0.00 0.00 175.17 177.98 3g0g h TYR 439 N 6.68 0.00 -0.44 -5.34 -0.00 -1.68 0.22 116.97 116.41 3g0g h TYR 439 Ca 0.08 0.00 0.05 0.00 0.00 0.00 0.00 58.73 58.87 3g0g h TYR 439 Cb 1.04 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.75 3g0g h TYR 439 CO 0.30 0.00 0.30 1.15 -0.00 0.00 0.00 178.16 179.91 3g0g h THR 440 N 0.00 0.98 -3.57 -0.90 2.02 -1.87 -3.39 112.91 106.18 3g0g h THR 440 Ca 0.04 -0.13 -0.58 0.00 0.77 0.00 0.00 66.41 66.51 3g0g h THR 440 Cb 0.57 0.56 -0.08 0.00 -1.74 0.00 0.00 68.15 67.45 3g0g h THR 440 CO -0.00 0.07 0.73 -0.54 0.37 0.00 0.00 175.52 176.15 3g0g s LYS 441 N -5.37 3.77 -0.04 6.66 3.01 0.76 -5.01 119.74 123.53 3g0g s LYS 441 Ca -0.07 0.56 0.02 0.00 -1.01 0.00 0.00 55.97 55.46 3g0g s LYS 441 Cb 0.18 -3.85 0.01 0.00 -1.01 0.00 0.00 37.83 33.17 3g0g s LYS 441 CO 0.73 -1.13 -0.07 0.08 0.51 0.00 0.00 175.35 175.47 3g0g s VAL 442 N 3.86 0.71 -0.11 3.17 1.01 -1.26 -2.19 120.40 125.59 3g0g s VAL 442 Ca 0.42 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 62.14 3g0g s VAL 442 Cb -0.10 -0.67 -0.02 0.00 0.00 0.00 0.00 36.38 35.59 3g0g s VAL 442 CO 0.24 0.25 -0.13 -0.89 0.00 0.00 0.00 175.10 174.57 3g0g s THR 443 N 0.56 3.13 -0.28 3.92 2.01 -0.66 -4.96 115.64 119.36 3g0g s THR 443 Ca -0.09 -0.65 -0.23 0.00 0.31 0.00 0.00 61.69 61.04 3g0g s THR 443 Cb -0.12 -2.29 -0.01 0.00 0.01 0.00 0.00 72.50 70.09 3g0g s THR 443 CO 0.01 0.54 0.74 0.00 -0.69 0.00 0.00 174.62 175.22 3g0g n LEU 445 N 6.00 0.69 0.00 0.00 4.77 -0.07 -4.38 117.00 124.01 3g0g n LEU 445 Ca 0.02 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 3g0g n LEU 445 Cb 0.48 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 3g0g n LEU 445 CO 0.47 -0.04 -0.43 -1.54 -1.33 0.00 0.00 177.39 174.52 3g0g n SER 446 N -2.09 4.30 -0.13 -1.43 3.41 -1.23 -4.79 113.62 111.66 3g0g n SER 446 Ca 0.03 -0.02 -0.11 0.00 -0.26 0.00 0.00 58.87 58.51 3g0g n SER 446 Cb 0.44 0.90 -0.08 0.00 -0.26 0.00 0.00 64.21 65.20 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 -4.92 1.41 -0.25 0.00 4.71 -1.26 -4.19 120.64 116.13 3g0g n GLU 448 Ca -0.03 -0.72 -0.02 0.00 -0.01 0.00 0.00 57.16 56.39 3g0g n GLU 448 Cb 0.28 -1.49 0.10 0.00 -1.01 0.00 0.00 31.44 29.32 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 1.75 0.66 -5.00 -4.62 3.38 -1.83 -3.38 115.31 106.27 3g0g h LEU 449 Ca 0.00 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.82 3g0g h LEU 449 Cb 0.41 -0.12 -0.15 0.00 0.09 0.00 0.00 40.66 40.90 3g0g h LEU 449 CO 0.00 0.43 -0.43 -3.20 0.09 0.00 0.00 178.44 175.34 3g0g n ASN 450 N -4.72 -2.89 -0.14 -0.43 2.85 -1.26 -5.06 115.26 103.62 3g0g n ASN 450 Ca 0.09 -2.87 0.20 0.00 -0.11 0.00 0.00 54.58 51.89 3g0g n ASN 450 Cb 0.14 1.64 0.61 0.00 1.24 0.00 0.00 39.78 43.41 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 4.32 0.20 0.15 1.20 0.13 -1.75 -0.14 132.00 136.11 3g0g h PRO 451 Ca -0.07 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.04 3g0g h PRO 451 Cb 1.09 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3g0g h PRO 451 CO 0.13 0.13 -0.07 0.93 -0.23 0.00 0.00 178.00 178.89 3g0g h GLU 452 N 0.21 -0.20 0.00 0.86 5.08 -1.97 -3.37 114.58 115.19 3g0g h GLU 452 Ca 0.37 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 3g0g h GLU 452 Cb 1.14 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3g0g h GLU 452 CO -0.07 -0.13 -0.10 2.89 -1.00 0.00 0.00 179.01 180.60 3g0g n ARG 453 N -4.57 0.01 -3.68 2.33 -4.01 -1.13 -4.55 116.66 101.06 3g0g n ARG 453 Ca -0.03 0.01 -0.27 0.00 -1.04 0.00 0.00 57.85 56.52 3g0g n ARG 453 Cb 0.08 -1.51 -0.16 0.00 -3.04 0.00 0.00 32.46 27.82 3g0g n ARG 453 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 3g0g n GLN 455 N 5.14 0.40 -3.95 0.00 6.02 0.81 -4.40 117.38 121.40 3g0g n GLN 455 Ca -0.08 -0.07 -0.30 0.00 -0.01 0.00 0.00 57.00 56.54 3g0g n GLN 455 Cb 0.47 -0.43 -0.16 0.00 1.02 0.00 0.00 30.24 31.14 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 -0.08 2.40 0.02 1.08 6.14 -0.97 -0.88 117.35 125.06 3g0g s TYR 456 Ca 0.00 -1.73 0.08 0.00 0.64 0.00 0.00 57.07 56.06 3g0g s TYR 456 Cb 0.00 -1.59 -0.02 0.00 0.42 0.00 0.00 41.96 40.77 3g0g s TYR 456 CO 0.00 -0.77 -0.24 0.71 0.64 0.00 0.00 175.55 175.89 3g0g s TYR 457 N 1.40 2.13 0.33 4.97 2.02 -0.23 -0.09 117.35 127.88 3g0g s TYR 457 Ca -0.05 -0.40 0.06 0.00 -0.37 0.00 0.00 57.07 56.31 3g0g s TYR 457 Cb -0.18 -1.31 -0.06 0.00 -0.40 0.00 0.00 41.96 40.00 3g0g s TYR 457 CO -0.06 0.06 -0.01 -1.54 -1.57 0.00 0.00 175.55 172.42 3g0g s SER 458 N -0.97 2.95 -0.01 2.29 1.04 0.47 -4.65 113.70 114.82 3g0g s SER 458 Ca 0.10 -1.29 -0.04 0.00 0.48 0.00 0.00 55.95 55.20 3g0g s SER 458 Cb -0.09 -0.20 0.00 0.00 0.10 0.00 0.00 66.02 65.82 3g0g s SER 458 CO 0.01 -0.44 0.08 0.54 0.98 0.00 0.00 173.24 174.41 3g0g s VAL 459 N -3.01 0.05 -0.18 5.02 0.11 -1.26 -0.98 120.40 120.15 3g0g s VAL 459 Ca 0.33 -0.42 0.00 0.00 -2.93 0.00 0.00 61.98 58.96 3g0g s VAL 459 Cb 0.07 -0.26 0.04 0.00 -1.53 0.00 0.00 36.38 34.70 3g0g s VAL 459 CO 0.15 -0.23 -0.07 -0.55 -3.33 0.00 0.00 175.10 171.06 3g0g s SER 460 N -0.74 3.12 0.10 3.54 0.15 -0.41 -4.98 113.70 114.47 3g0g s SER 460 Ca -0.08 -0.78 -0.07 0.00 0.70 0.00 0.00 55.95 55.71 3g0g s SER 460 Cb -0.05 -1.06 -0.06 0.00 -1.71 0.00 0.00 66.02 63.15 3g0g s SER 460 CO 0.00 -0.17 0.37 -0.36 1.20 0.00 0.00 173.24 174.28 3g0g s PHE 461 N 1.53 3.53 0.83 3.44 0.40 -1.26 -1.24 117.98 125.20 3g0g s PHE 461 Ca -0.00 0.64 -0.11 0.00 -0.60 0.00 0.00 56.93 56.85 3g0g s PHE 461 Cb -0.16 -2.06 0.09 0.00 0.51 0.00 0.00 43.02 41.40 3g0g s PHE 461 CO -0.08 0.49 1.09 -1.54 0.70 0.00 0.00 175.22 175.89 3g0g s SER 462 N -2.08 4.17 0.29 1.36 1.04 -0.93 -4.85 113.70 112.70 3g0g s SER 462 Ca 0.36 1.46 0.06 0.00 0.48 0.00 0.00 55.95 58.30 3g0g s SER 462 Cb -0.13 -2.18 0.81 0.00 0.10 0.00 0.00 66.02 64.62 3g0g s SER 462 CO 0.21 -2.20 1.41 1.17 0.98 0.00 0.00 173.24 174.81 3g0g n LYS 463 N -3.59 -0.07 -0.29 4.02 4.81 -0.92 0.72 118.16 122.84 3g0g n LYS 463 Ca 0.07 1.32 0.07 0.00 -0.87 0.00 0.00 58.31 58.90 3g0g n LYS 463 Cb 0.55 -2.15 0.19 0.00 0.02 0.00 0.00 35.03 33.64 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 -5.24 2.76 -2.10 1.64 4.71 -1.26 -4.98 120.64 116.16 3g0g n GLU 464 Ca 0.24 -2.46 -0.13 0.00 -0.01 0.00 0.00 57.16 54.81 3g0g n GLU 464 Cb 0.80 -1.56 -0.01 0.00 -1.01 0.00 0.00 31.44 29.66 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 -0.26 -0.34 0.03 0.62 0.00 0.22 -4.93 120.51 115.86 3g0g n ALA 465 Ca 0.16 0.12 -0.06 0.00 0.00 0.00 0.00 53.44 53.66 3g0g n ALA 465 Cb 0.67 -1.51 0.12 0.00 0.00 0.00 0.00 19.45 18.73 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 0.00 0.45 -5.24 0.00 3.64 -1.78 -3.43 116.57 110.21 3g0g h LYS 466 Ca -0.29 -0.24 -0.40 0.00 -1.27 0.00 0.00 60.65 58.44 3g0g h LYS 466 Cb 1.16 0.01 -0.14 0.00 -0.41 0.00 0.00 32.23 32.84 3g0g h LYS 466 CO 0.36 0.82 -0.69 0.71 -2.27 0.00 0.00 179.45 178.38 3g0g s TYR 467 N -4.12 1.60 -0.13 1.91 1.51 -1.26 -1.50 117.35 115.35 3g0g s TYR 467 Ca -0.06 -0.79 -0.13 0.00 -1.01 0.00 0.00 57.07 55.09 3g0g s TYR 467 Cb 0.12 -0.87 0.03 0.00 -0.11 0.00 0.00 41.96 41.13 3g0g s TYR 467 CO 0.81 0.12 0.36 1.52 -1.11 0.00 0.00 175.55 177.25 3g0g s TYR 468 N -3.24 -0.39 -0.17 2.71 1.13 0.33 -2.19 117.35 115.53 3g0g s TYR 468 Ca 0.25 0.94 -0.15 0.00 -1.41 0.00 0.00 57.07 56.70 3g0g s TYR 468 Cb 0.04 0.13 -0.04 0.00 -1.10 0.00 0.00 41.96 40.99 3g0g s TYR 468 CO 0.07 -0.20 0.36 -1.14 -2.51 0.00 0.00 175.55 172.13 3g0g s GLN 469 N 0.12 4.25 -0.26 -3.49 0.74 -0.37 0.23 119.66 120.88 3g0g s GLN 469 Ca -0.01 0.19 -0.10 0.00 0.05 0.00 0.00 55.36 55.49 3g0g s GLN 469 Cb -0.03 -3.46 -0.05 0.00 1.10 0.00 0.00 33.01 30.58 3g0g s GLN 469 CO 0.01 0.14 0.15 -0.51 -0.55 0.00 0.00 175.29 174.53 3g0g s LEU 470 N 0.75 3.92 -0.33 3.68 1.43 0.44 -1.29 118.68 127.28 3g0g s LEU 470 Ca 0.19 -0.01 -0.11 0.00 -1.03 0.00 0.00 54.13 53.17 3g0g s LEU 470 Cb -0.14 -2.07 -0.00 0.00 0.03 0.00 0.00 46.19 44.01 3g0g s LEU 470 CO 0.06 -0.01 0.18 -0.60 0.23 0.00 0.00 176.35 176.22 3g0g s ARG 471 N 1.50 3.29 -0.28 1.70 3.52 -0.15 -1.62 118.95 126.91 3g0g s ARG 471 Ca 0.07 -0.76 -0.11 0.00 -0.13 0.00 0.00 55.73 54.80 3g0g s ARG 471 Cb -0.15 -3.65 -0.05 0.00 -1.56 0.00 0.00 34.95 29.54 3g0g s ARG 471 CO 0.08 -0.47 0.18 0.00 -0.81 0.00 0.00 175.30 174.28 3g0g n SER 473 N 4.99 2.55 0.00 0.00 7.64 0.88 -1.36 113.62 128.32 3g0g n SER 473 Ca -0.14 -1.81 0.00 0.00 1.01 0.00 0.00 58.87 57.93 3g0g n SER 473 Cb 0.52 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.80 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 1.34 -2.02 0.20 0.23 0.00 -1.26 -0.84 105.19 102.84 3g0g n GLY 474 Ca 0.14 -1.42 -0.05 0.00 0.00 0.00 0.00 46.02 44.68 3g0g n GLY 474 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3g0g h PRO 475 N 1.12 0.37 0.00 1.61 0.11 -1.25 0.24 132.00 134.20 3g0g h PRO 475 Ca 0.00 -0.21 -0.12 0.00 0.11 0.00 0.00 66.00 65.78 3g0g h PRO 475 Cb 0.00 0.02 0.06 0.00 0.11 0.00 0.00 31.00 31.18 3g0g h PRO 475 CO 0.00 0.78 0.06 0.41 -0.21 0.00 0.00 178.00 179.04 3g0g n GLY 476 N 0.08 -2.21 3.68 -0.55 0.00 -0.43 -4.25 105.19 101.51 3g0g n GLY 476 Ca -0.02 -1.52 -0.39 0.00 0.00 0.00 0.00 46.02 44.09 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 4.45 -4.64 0.99 4.32 -1.26 -4.65 117.00 116.21 3g0g n LEU 477 Ca 0.05 0.95 -0.41 0.00 -0.02 0.00 0.00 56.01 56.58 3g0g n LEU 477 Cb 0.17 -1.48 0.02 0.00 -1.62 0.00 0.00 43.42 40.51 3g0g n LEU 477 CO 0.12 -1.09 0.67 -2.65 -1.22 0.00 0.00 177.39 173.23 3g0g n PRO 478 N -0.75 1.46 -3.99 3.23 -0.02 -1.26 -4.70 135.00 128.97 3g0g n PRO 478 Ca 0.11 0.53 -0.23 0.00 -2.02 0.00 0.00 63.50 61.88 3g0g n PRO 478 Cb 0.44 -2.16 -0.17 0.00 -0.02 0.00 0.00 33.50 31.59 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 -1.10 1.05 -0.27 2.45 2.96 -0.46 -4.22 118.68 119.09 3g0g s LEU 479 Ca 0.64 -0.18 -0.04 0.00 -0.22 0.00 0.00 54.13 54.34 3g0g s LEU 479 Cb -0.52 -0.59 0.02 0.00 0.50 0.00 0.00 46.19 45.60 3g0g s LEU 479 CO 0.56 -0.11 -0.00 -0.31 -1.32 0.00 0.00 176.35 175.16 3g0g s TYR 480 N 1.49 3.11 0.12 5.38 2.02 0.17 -0.59 117.35 129.05 3g0g s TYR 480 Ca -0.01 -1.37 0.07 0.00 -0.37 0.00 0.00 57.07 55.39 3g0g s TYR 480 Cb -0.13 -2.13 -0.04 0.00 -0.40 0.00 0.00 41.96 39.26 3g0g s TYR 480 CO -0.04 -0.68 -0.17 0.95 -1.57 0.00 0.00 175.55 174.05 3g0g s THR 481 N 1.38 1.50 -0.07 -0.71 -4.23 -0.64 -0.09 115.64 112.78 3g0g s THR 481 Ca 0.01 -1.67 0.01 0.00 -1.18 0.00 0.00 61.69 58.85 3g0g s THR 481 Cb -0.17 -1.54 -0.03 0.00 1.34 0.00 0.00 72.50 72.10 3g0g s THR 481 CO -0.02 -0.29 -0.06 -0.22 -0.54 0.00 0.00 174.62 173.50 3g0g s LEU 482 N -2.28 3.24 0.02 4.79 0.20 -0.35 -0.42 118.68 123.88 3g0g s LEU 482 Ca 0.08 0.00 0.01 0.00 0.69 0.00 0.00 54.13 54.92 3g0g s LEU 482 Cb -0.07 -1.72 -0.02 0.00 -0.43 0.00 0.00 46.19 43.95 3g0g s LEU 482 CO 0.04 0.36 -0.06 -1.00 -0.29 0.00 0.00 176.35 175.41 3g0g s HIS 483 N -0.84 0.48 -0.13 5.38 3.76 0.14 -1.47 115.29 122.60 3g0g s HIS 483 Ca 0.13 -0.34 -0.20 0.00 -0.15 0.00 0.00 55.06 54.50 3g0g s HIS 483 Cb -0.11 -0.30 -0.04 0.00 1.11 0.00 0.00 32.58 33.25 3g0g s HIS 483 CO 0.02 -0.07 0.56 0.45 -0.85 0.00 0.00 174.74 174.85 3g0g s SER 484 N -0.99 6.73 0.00 1.40 0.15 -0.85 -0.51 113.70 119.64 3g0g s SER 484 Ca -0.07 0.88 0.27 0.00 0.70 0.00 0.00 55.95 57.73 3g0g s SER 484 Cb -0.07 -2.33 0.84 0.00 -1.71 0.00 0.00 66.02 62.76 3g0g s SER 484 CO -0.00 -0.10 1.62 -1.54 1.20 0.00 0.00 173.24 174.42 3g0g n SER 485 N 4.11 1.77 0.22 5.45 3.41 -0.56 -1.36 113.62 126.67 3g0g n SER 485 Ca -0.04 -1.56 0.08 0.00 -0.26 0.00 0.00 58.87 57.09 3g0g n SER 485 Cb 0.51 0.02 0.50 0.00 -0.26 0.00 0.00 64.21 64.98 3g0g n SER 485 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 3g0g h VAL 486 N 2.74 0.77 0.00 -3.33 3.04 -1.90 -3.34 116.25 114.23 3g0g h VAL 486 Ca 0.00 -1.04 0.00 0.00 -1.01 0.00 0.00 66.70 64.65 3g0g h VAL 486 Cb 0.60 1.64 0.00 0.00 -2.01 0.00 0.00 31.29 31.53 3g0g h VAL 486 CO 0.00 0.25 0.00 -0.46 -1.01 0.00 0.00 177.57 176.35 3g0g n ASN 487 N -3.64 0.00 -3.06 3.17 6.94 -1.26 -5.03 115.26 112.38 3g0g n ASN 487 Ca -0.01 -1.00 -0.22 0.00 -0.02 0.00 0.00 54.58 53.33 3g0g n ASN 487 Cb 0.38 0.00 0.05 0.00 -2.36 0.00 0.00 39.78 37.85 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 -5.97 -4.83 0.53 9.92 -0.46 -5.01 116.55 110.74 3g0g n ASP 488 Ca 0.00 -0.36 -0.34 0.00 -0.53 0.00 0.00 54.79 53.55 3g0g n ASP 488 Cb 0.44 -4.70 -0.06 0.00 -0.64 0.00 0.00 41.12 36.15 3g0g n ASP 488 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 3g0g s LYS 489 N -5.87 4.17 -0.39 -1.24 -2.85 -0.99 -4.89 119.74 107.69 3g0g s LYS 489 Ca 0.39 0.84 -0.29 0.00 -1.00 0.00 0.00 55.97 55.92 3g0g s LYS 489 Cb -0.17 -2.64 0.02 0.00 -2.06 0.00 0.00 37.83 32.98 3g0g s LYS 489 CO 0.49 0.26 1.08 0.20 0.10 0.00 0.00 175.35 177.47 3g0g s GLY 490 N -1.94 1.46 -0.02 0.59 0.00 -1.26 -2.01 107.32 104.13 3g0g s GLY 490 Ca 0.50 -0.26 -0.02 0.00 0.00 0.00 0.00 44.72 44.94 3g0g s GLY 490 CO 0.19 2.29 0.16 1.41 0.00 0.00 0.00 173.10 177.16 3g0g h LEU 491 N 10.51 -0.05 -7.57 0.66 3.38 -1.62 -3.49 115.31 117.14 3g0g h LEU 491 Ca -0.22 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 3g0g h LEU 491 Cb 1.06 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.72 3g0g h LEU 491 CO 1.06 0.09 0.05 0.00 0.09 0.00 0.00 178.44 179.74 3g0g s ARG 492 N -1.54 1.35 -0.34 1.13 1.70 -1.16 -5.01 118.95 115.08 3g0g s ARG 492 Ca -0.01 -0.80 -0.21 0.00 -0.47 0.00 0.00 55.73 54.24 3g0g s ARG 492 Cb 0.00 0.53 -0.00 0.00 -0.57 0.00 0.00 34.95 34.91 3g0g s ARG 492 CO 0.02 -0.57 0.66 0.08 -1.08 0.00 0.00 175.30 174.41 3g0g s VAL 493 N -3.85 4.88 0.01 4.99 1.01 -1.26 -1.22 120.40 124.96 3g0g s VAL 493 Ca 0.08 0.73 -0.02 0.00 0.00 0.00 0.00 61.98 62.77 3g0g s VAL 493 Cb -0.01 -4.07 -0.27 0.00 0.00 0.00 0.00 36.38 32.03 3g0g s VAL 493 CO -0.05 -0.27 0.87 -0.07 0.00 0.00 0.00 175.10 175.58 3g0g h LEU 494 N 9.35 0.36 -6.93 3.92 3.38 -0.84 -3.47 115.31 121.08 3g0g h LEU 494 Ca -0.26 -0.50 0.08 0.00 0.09 0.00 0.00 57.88 57.29 3g0g h LEU 494 Cb 1.11 -0.12 -0.22 0.00 0.09 0.00 0.00 40.66 41.53 3g0g h LEU 494 CO 0.84 1.41 0.01 -0.70 0.09 0.00 0.00 178.44 180.09 3g0g s GLU 495 N -2.62 0.56 0.00 1.13 2.56 -0.77 -4.98 118.70 114.58 3g0g s GLU 495 Ca -0.08 1.22 0.00 0.00 0.00 0.00 0.00 54.97 56.10 3g0g s GLU 495 Cb 0.07 0.53 0.00 0.00 2.00 0.00 0.00 34.13 36.73 3g0g s GLU 495 CO 0.85 -0.16 0.78 -0.40 -0.56 0.00 0.00 175.26 175.77 3g0g n ASP 496 N 4.90 1.45 -2.34 -1.70 3.85 -1.26 0.42 116.55 121.87 3g0g n ASP 496 Ca -0.14 -1.60 -0.18 0.00 -0.71 0.00 0.00 54.79 52.16 3g0g n ASP 496 Cb 0.53 0.00 -0.01 0.00 -1.35 0.00 0.00 41.12 40.29 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 -0.30 -5.18 0.22 -1.12 3.02 -1.26 -4.87 115.26 105.77 3g0g n ASN 497 Ca 0.00 0.09 0.13 0.00 -0.03 0.00 0.00 54.58 54.77 3g0g n ASN 497 Cb 0.21 -4.36 0.73 0.00 -0.61 0.00 0.00 39.78 35.75 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 0.00 0.00 0.17 6.41 4.64 -1.95 -1.88 113.55 120.94 3g0g h SER 498 Ca -0.42 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.89 3g0g h SER 498 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3g0g h SER 498 CO 0.50 0.00 -0.08 0.00 -0.87 0.00 0.00 176.83 176.38 3g0g h ALA 499 N 1.92 -0.23 -0.34 5.18 0.00 -2.00 -2.19 119.26 121.61 3g0g h ALA 499 Ca 0.05 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3g0g h ALA 499 Cb 0.24 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3g0g h ALA 499 CO -0.00 -0.62 0.02 1.25 0.00 0.00 0.00 179.25 179.90 3g0g h LEU 500 N -0.25 0.47 -1.19 0.00 5.85 -1.68 -2.23 115.31 116.28 3g0g h LEU 500 Ca -0.02 -0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 3g0g h LEU 500 Cb 0.19 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 3g0g h LEU 500 CO 0.04 0.53 -0.06 -0.78 -0.34 0.00 0.00 178.44 177.82 3g0g h ASP 501 N 0.49 0.46 -0.38 1.25 1.82 -1.24 0.16 116.42 118.99 3g0g h ASP 501 Ca 0.11 -0.10 -0.11 0.00 -0.39 0.00 0.00 57.03 56.54 3g0g h ASP 501 Cb 0.28 -0.12 -0.02 0.00 0.68 0.00 0.00 39.33 40.16 3g0g h ASP 501 CO 0.01 0.58 -0.14 0.11 -1.61 0.00 0.00 179.24 178.18 3g0g h LYS 502 N 0.46 0.85 0.09 0.28 1.79 -0.79 -2.80 116.57 116.45 3g0g h LYS 502 Ca 0.09 -0.31 -0.26 0.00 -2.18 0.00 0.00 60.65 57.99 3g0g h LYS 502 Cb 0.40 -0.06 0.03 0.00 -1.58 0.00 0.00 32.23 31.02 3g0g h LYS 502 CO 0.02 0.94 -1.08 0.52 -1.08 0.00 0.00 179.45 178.77 3g0g h MET 503 N 0.75 0.58 0.00 3.15 2.86 -1.16 -3.22 114.93 117.89 3g0g h MET 503 Ca 0.12 -0.74 0.00 0.00 -2.06 0.00 0.00 59.70 57.02 3g0g h MET 503 Cb 0.66 0.24 0.00 0.00 0.06 0.00 0.00 31.60 32.56 3g0g h MET 503 CO 0.05 1.32 0.00 1.28 1.06 0.00 0.00 176.91 180.62 3g0g n LEU 504 N -3.90 0.37 -0.30 1.22 4.32 0.01 -2.76 117.00 115.95 3g0g n LEU 504 Ca -0.13 0.61 0.01 0.00 -0.02 0.00 0.00 56.01 56.48 3g0g n LEU 504 Cb 0.91 -0.58 0.14 0.00 -1.62 0.00 0.00 43.42 42.27 3g0g n LEU 504 CO 0.55 -0.52 1.18 -0.61 -1.22 0.00 0.00 177.39 176.77 3g0g h GLN 505 N 0.00 0.89 0.12 3.23 4.15 -1.50 -2.96 115.11 119.04 3g0g h GLN 505 Ca 0.00 -0.05 -0.28 0.00 0.77 0.00 0.00 58.65 59.09 3g0g h GLN 505 Cb 0.23 -0.20 0.01 0.00 0.21 0.00 0.00 27.48 27.73 3g0g h GLN 505 CO 0.00 0.59 -1.22 -0.97 -1.93 0.00 0.00 178.83 175.29 3g0g h ASN 506 N 0.92 0.51 -3.60 -0.69 -0.73 -1.72 -3.47 115.58 106.80 3g0g h ASN 506 Ca 0.38 -0.52 -0.52 0.00 1.87 0.00 0.00 56.30 57.50 3g0g h ASN 506 Cb 0.21 -0.17 0.05 0.00 0.27 0.00 0.00 38.32 38.69 3g0g h ASN 506 CO -0.19 1.39 0.65 -0.69 -0.37 0.00 0.00 177.43 178.22 3g0g s VAL 507 N -2.76 2.95 -0.63 2.57 1.01 -1.12 -4.33 120.40 118.09 3g0g s VAL 507 Ca -0.05 0.86 -0.27 0.00 0.00 0.00 0.00 61.98 62.51 3g0g s VAL 507 Cb 0.07 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.91 3g0g s VAL 507 CO 0.89 0.16 1.52 -1.10 0.00 0.00 0.00 175.10 176.58 3g0g s GLN 508 N -0.88 3.05 0.03 2.72 -0.21 -0.35 -4.98 119.66 119.04 3g0g s GLN 508 Ca 0.53 0.30 -0.05 0.00 0.02 0.00 0.00 55.36 56.16 3g0g s GLN 508 Cb -0.38 -4.23 -0.05 0.00 1.00 0.00 0.00 33.01 29.35 3g0g s GLN 508 CO 0.45 -2.26 0.26 -1.64 -2.12 0.00 0.00 175.29 169.98 3g0g s MET 509 N 6.07 3.55 1.12 2.91 -1.94 -1.26 -4.19 119.30 125.56 3g0g s MET 509 Ca 0.52 -0.16 -0.16 0.00 -1.71 0.00 0.00 55.69 54.18 3g0g s MET 509 Cb -0.11 -3.05 0.25 0.00 2.01 0.00 0.00 34.83 33.93 3g0g s MET 509 CO 0.21 0.63 1.11 -1.25 -0.01 0.00 0.00 175.02 175.70 3g0g s PRO 510 N -1.98 -0.52 0.01 2.03 0.04 -1.26 -4.15 135.00 129.16 3g0g s PRO 510 Ca 0.30 0.12 0.05 0.00 0.04 0.00 0.00 61.00 61.51 3g0g s PRO 510 Cb -0.13 -1.66 -0.01 0.00 0.04 0.00 0.00 34.50 32.73 3g0g s PRO 510 CO 0.19 -3.29 -0.15 -1.54 0.04 0.00 0.00 177.00 172.25 3g0g s SER 511 N -3.79 1.76 0.33 6.66 1.04 0.19 -4.90 113.70 114.98 3g0g s SER 511 Ca 0.69 -0.33 -0.10 0.00 0.48 0.00 0.00 55.95 56.69 3g0g s SER 511 Cb -0.13 -0.17 -0.07 0.00 0.10 0.00 0.00 66.02 65.76 3g0g s SER 511 CO 0.56 0.14 0.67 -0.75 0.98 0.00 0.00 173.24 174.84 3g0g s LYS 512 N -0.61 3.79 -0.20 4.02 2.20 -1.26 0.14 119.74 127.81 3g0g s LYS 512 Ca 0.05 0.35 -0.04 0.00 -0.36 0.00 0.00 55.97 55.97 3g0g s LYS 512 Cb -0.06 -2.51 0.08 0.00 -1.51 0.00 0.00 37.83 33.83 3g0g s LYS 512 CO 0.00 0.13 0.16 0.21 -0.36 0.00 0.00 175.35 175.49 3g0g s LYS 513 N -3.43 0.15 -0.14 4.03 2.20 -0.57 -4.95 119.74 117.03 3g0g s LYS 513 Ca 0.49 0.00 -0.12 0.00 -0.36 0.00 0.00 55.97 55.98 3g0g s LYS 513 Cb -0.11 -1.43 -0.05 0.00 -1.51 0.00 0.00 37.83 34.74 3g0g s LYS 513 CO 0.27 -0.72 0.25 -1.17 -0.36 0.00 0.00 175.35 173.63 3g0g s LEU 514 N 2.23 4.30 0.00 5.43 0.20 -1.26 -1.69 118.68 127.89 3g0g s LEU 514 Ca 0.05 0.52 -0.12 0.00 0.69 0.00 0.00 54.13 55.27 3g0g s LEU 514 Cb -0.16 -2.30 0.04 0.00 -0.43 0.00 0.00 46.19 43.34 3g0g s LEU 514 CO -0.14 0.20 0.60 -0.67 -0.29 0.00 0.00 176.35 176.04 3g0g n ASP 515 N 3.04 -1.15 -4.26 3.68 4.64 -0.42 -5.02 116.55 117.06 3g0g n ASP 515 Ca -0.14 -1.66 -0.14 0.00 -1.38 0.00 0.00 54.79 51.46 3g0g n ASP 515 Cb 0.52 1.89 -0.10 0.00 -1.04 0.00 0.00 41.12 42.39 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 -3.91 1.30 0.09 -0.67 -0.12 -1.26 -0.15 117.98 113.27 3g0g s PHE 516 Ca 0.13 -1.03 0.03 0.00 -0.05 0.00 0.00 56.93 56.01 3g0g s PHE 516 Cb -0.02 -0.75 -0.04 0.00 -0.63 0.00 0.00 43.02 41.59 3g0g s PHE 516 CO 0.04 -0.21 -0.09 0.96 -0.05 0.00 0.00 175.22 175.87 3g0g s ILE 517 N -3.65 0.89 -0.28 -4.49 -4.36 0.03 -4.94 121.20 104.40 3g0g s ILE 517 Ca 0.27 -1.65 -0.13 0.00 -0.26 0.00 0.00 60.65 58.88 3g0g s ILE 517 Cb 0.06 -1.36 -0.04 0.00 1.25 0.00 0.00 42.46 42.37 3g0g s ILE 517 CO 0.06 -0.59 0.27 -0.63 0.24 0.00 0.00 174.94 174.29 3g0g s ILE 518 N -2.54 5.25 -0.07 8.37 -1.09 -1.26 -1.58 121.20 128.27 3g0g s ILE 518 Ca 0.05 0.35 0.05 0.00 -2.23 0.00 0.00 60.65 58.87 3g0g s ILE 518 Cb -0.02 -3.61 -0.00 0.00 -1.58 0.00 0.00 42.46 37.24 3g0g s ILE 518 CO -0.01 0.20 -0.23 -0.76 -1.23 0.00 0.00 174.94 172.92 3g0g s LEU 519 N 1.90 2.02 -1.54 2.97 1.02 -0.50 -4.78 118.68 119.78 3g0g s LEU 519 Ca 0.11 -0.49 -0.13 0.00 0.02 0.00 0.00 54.13 53.63 3g0g s LEU 519 Cb -0.16 -1.29 0.13 0.00 0.02 0.00 0.00 46.19 44.89 3g0g s LEU 519 CO 0.11 0.18 0.32 0.59 0.02 0.00 0.00 176.35 177.57 3g0g n ASN 520 N 3.25 -0.66 -2.09 2.29 3.02 -1.26 0.51 115.26 120.32 3g0g n ASN 520 Ca -0.19 -1.11 -0.20 0.00 -0.03 0.00 0.00 54.58 53.06 3g0g n ASN 520 Cb 0.52 -1.40 -0.03 0.00 -0.61 0.00 0.00 39.78 38.27 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 -3.82 -1.55 -4.97 3.52 1.02 -1.26 -5.00 120.64 108.58 3g0g n GLU 521 Ca -0.05 1.04 -0.27 0.00 -0.02 0.00 0.00 57.16 57.86 3g0g n GLU 521 Cb 0.48 -5.58 -0.16 0.00 -0.02 0.00 0.00 31.44 26.16 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 -2.93 1.60 0.28 2.62 2.01 0.18 -5.14 115.64 114.26 3g0g s THR 522 Ca 0.00 -0.84 -0.29 0.00 0.31 0.00 0.00 61.69 60.88 3g0g s THR 522 Cb 0.00 -1.35 -0.09 0.00 0.01 0.00 0.00 72.50 71.07 3g0g s THR 522 CO 0.00 0.45 1.01 -0.54 -0.69 0.00 0.00 174.62 174.86 3g0g s LYS 523 N -0.22 4.67 -0.02 4.92 1.02 -1.26 -1.41 119.74 127.44 3g0g s LYS 523 Ca 0.01 1.59 0.00 0.00 0.02 0.00 0.00 55.97 57.60 3g0g s LYS 523 Cb -0.10 -3.12 0.03 0.00 -0.52 0.00 0.00 37.83 34.12 3g0g s LYS 523 CO 0.01 0.31 0.02 -0.06 -0.92 0.00 0.00 175.35 174.71 3g0g s PHE 524 N -1.27 0.15 0.19 3.18 0.08 -0.62 -4.96 117.98 114.74 3g0g s PHE 524 Ca 0.45 0.08 -0.06 0.00 0.12 0.00 0.00 56.93 57.52 3g0g s PHE 524 Cb -0.27 -0.32 -0.06 0.00 -0.57 0.00 0.00 43.02 41.80 3g0g s PHE 524 CO 0.34 -0.11 0.45 -1.58 -0.10 0.00 0.00 175.22 174.22 3g0g s TRP 525 N 1.08 3.46 0.06 0.36 0.52 -1.26 -0.79 118.94 122.37 3g0g s TRP 525 Ca -0.09 0.65 -0.13 0.00 0.02 0.00 0.00 56.10 56.55 3g0g s TRP 525 Cb -0.13 -2.09 0.02 0.00 -1.15 0.00 0.00 33.47 30.12 3g0g s TRP 525 CO -0.02 0.34 0.30 1.52 0.02 0.00 0.00 176.95 179.11 3g0g s TYR 526 N -1.78 -0.08 0.09 -1.98 -0.85 0.79 -1.60 117.35 111.94 3g0g s TYR 526 Ca 0.43 -0.13 0.05 0.00 -0.52 0.00 0.00 57.07 56.91 3g0g s TYR 526 Cb -0.12 0.10 -0.03 0.00 0.38 0.00 0.00 41.96 42.29 3g0g s TYR 526 CO 0.24 -0.54 -0.14 1.14 -1.52 0.00 0.00 175.55 174.73 3g0g s GLN 527 N -2.94 0.89 0.06 -3.49 -2.07 -0.72 -1.30 119.66 110.09 3g0g s GLN 527 Ca -0.02 -1.05 0.08 0.00 -1.82 0.00 0.00 55.36 52.55 3g0g s GLN 527 Cb 0.00 -0.86 -0.03 0.00 -1.09 0.00 0.00 33.01 31.04 3g0g s GLN 527 CO -0.06 0.18 -0.22 -1.64 -1.32 0.00 0.00 175.29 172.23 3g0g s MET 528 N -2.04 1.39 -0.32 9.60 -1.94 -0.68 -0.64 119.30 124.68 3g0g s MET 528 Ca 0.02 -1.05 -0.08 0.00 -1.71 0.00 0.00 55.69 52.86 3g0g s MET 528 Cb -0.08 -1.59 0.01 0.00 2.01 0.00 0.00 34.83 35.18 3g0g s MET 528 CO 0.02 0.40 0.12 0.42 -0.01 0.00 0.00 175.02 175.97 3g0g s ILE 529 N -0.91 4.20 -0.14 2.53 -1.09 0.80 -1.51 121.20 125.08 3g0g s ILE 529 Ca 0.08 -0.71 -0.04 0.00 -2.23 0.00 0.00 60.65 57.76 3g0g s ILE 529 Cb -0.09 -3.21 -0.03 0.00 -1.58 0.00 0.00 42.46 37.54 3g0g s ILE 529 CO 0.03 -0.01 -0.02 -0.76 -1.23 0.00 0.00 174.94 172.95 3g0g s LEU 530 N 1.52 3.36 0.77 2.97 1.43 0.12 -2.57 118.68 126.28 3g0g s LEU 530 Ca 0.02 -0.06 -0.15 0.00 -1.03 0.00 0.00 54.13 52.92 3g0g s LEU 530 Cb -0.18 -1.80 0.05 0.00 0.03 0.00 0.00 46.19 44.29 3g0g s LEU 530 CO 0.04 0.21 1.12 -2.65 0.23 0.00 0.00 176.35 175.31 3g0g n PRO 531 N 3.25 0.39 -1.58 1.29 -0.02 -1.26 -0.64 135.00 136.42 3g0g n PRO 531 Ca -0.17 0.20 -0.44 0.00 -2.02 0.00 0.00 63.50 61.06 3g0g n PRO 531 Cb 0.53 -2.37 -0.01 0.00 -0.02 0.00 0.00 33.50 31.62 3g0g n PRO 531 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3g0g n PRO 532 N -2.64 1.31 -3.74 0.52 -0.02 -1.26 -2.56 135.00 126.62 3g0g n PRO 532 Ca 0.14 0.46 -0.25 0.00 -2.02 0.00 0.00 63.50 61.83 3g0g n PRO 532 Cb 0.50 -1.85 0.05 0.00 -0.02 0.00 0.00 33.50 32.18 3g0g n PRO 532 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3g0g n HIS 533 N 0.07 -2.30 -1.66 6.00 8.25 -1.26 -4.89 115.22 119.44 3g0g n HIS 533 Ca 0.10 0.91 -0.45 0.00 -0.26 0.00 0.00 57.72 58.02 3g0g n HIS 533 Cb 0.33 -4.44 -0.02 0.00 1.12 0.00 0.00 29.99 26.98 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 -4.57 2.00 -3.84 4.41 7.35 -1.06 -4.98 117.46 116.77 3g0g n PHE 534 Ca -0.10 0.50 -0.30 0.00 -0.76 0.00 0.00 57.45 56.79 3g0g n PHE 534 Cb 0.59 -2.41 -0.15 0.00 0.35 0.00 0.00 39.48 37.86 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 0.11 4.07 0.39 -2.13 -1.08 -1.26 -5.02 116.67 111.75 3g0g s ASP 535 Ca 0.66 -1.60 0.18 0.00 -0.52 0.00 0.00 52.55 51.28 3g0g s ASP 535 Cb -0.67 -1.07 0.99 0.00 -1.46 0.00 0.00 42.92 40.71 3g0g s ASP 535 CO 0.52 -0.36 1.50 0.11 0.52 0.00 0.00 175.17 177.45 3g0g h LYS 536 N 7.97 0.00 0.00 4.34 1.57 -1.97 -0.24 116.57 128.24 3g0g h LYS 536 Ca -0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 3g0g h LYS 536 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.35 3g0g h LYS 536 CO 0.46 0.00 -1.06 -1.13 -0.57 0.00 0.00 179.45 177.15 3g0g n SER 537 N -2.26 0.88 -4.85 0.86 3.41 -1.26 -4.19 113.62 106.21 3g0g n SER 537 Ca -0.01 -0.86 -0.32 0.00 -0.26 0.00 0.00 58.87 57.42 3g0g n SER 537 Cb 0.27 1.04 -0.05 0.00 -0.26 0.00 0.00 64.21 65.22 3g0g n SER 537 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3g0g s LYS 538 N -3.05 3.97 -0.31 4.33 2.20 -0.10 -4.98 119.74 121.80 3g0g s LYS 538 Ca 0.07 0.75 -0.13 0.00 -0.36 0.00 0.00 55.97 56.30 3g0g s LYS 538 Cb 0.16 -2.31 -0.03 0.00 -1.51 0.00 0.00 37.83 34.14 3g0g s LYS 538 CO 0.86 -0.02 0.28 0.15 -0.36 0.00 0.00 175.35 176.26 3g0g s LYS 539 N -3.49 3.76 -0.01 4.03 -0.14 -1.26 -4.48 119.74 118.15 3g0g s LYS 539 Ca 0.56 -0.35 0.02 0.00 -1.36 0.00 0.00 55.97 54.84 3g0g s LYS 539 Cb -0.10 -3.73 -0.03 0.00 -1.68 0.00 0.00 37.83 32.29 3g0g s LYS 539 CO 0.23 -0.35 -0.04 0.71 -0.76 0.00 0.00 175.35 175.15 3g0g s TYR 540 N 1.88 2.97 0.60 3.18 2.02 0.67 -4.55 117.35 124.13 3g0g s TYR 540 Ca 0.10 0.02 -0.17 0.00 -0.37 0.00 0.00 57.07 56.65 3g0g s TYR 540 Cb -0.16 -1.65 -0.03 0.00 -0.40 0.00 0.00 41.96 39.71 3g0g s TYR 540 CO 0.11 0.40 1.10 -1.25 -1.57 0.00 0.00 175.55 174.34 3g0g s PRO 541 N -1.36 3.13 -0.01 -1.71 0.04 -1.26 -0.07 135.00 133.76 3g0g s PRO 541 Ca 0.17 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.61 3g0g s PRO 541 Cb -0.11 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.45 3g0g s PRO 541 CO 0.07 -0.99 0.01 -1.17 0.04 0.00 0.00 177.00 174.96 3g0g s LEU 542 N -4.42 1.58 -0.19 -3.56 0.20 -0.78 -1.10 118.68 110.41 3g0g s LEU 542 Ca 0.68 0.00 -0.02 0.00 0.69 0.00 0.00 54.13 55.48 3g0g s LEU 542 Cb -0.20 -0.07 -0.00 0.00 -0.43 0.00 0.00 46.19 45.49 3g0g s LEU 542 CO 0.35 -0.05 -0.10 -0.22 -0.29 0.00 0.00 176.35 176.04 3g0g s LEU 543 N 0.48 2.64 -0.25 -0.68 2.96 0.63 -0.23 118.68 124.22 3g0g s LEU 543 Ca -0.04 -0.46 -0.24 0.00 -0.22 0.00 0.00 54.13 53.17 3g0g s LEU 543 Cb -0.06 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.98 3g0g s LEU 543 CO -0.01 0.01 0.80 -0.22 -1.32 0.00 0.00 176.35 175.61 3g0g s LEU 544 N 1.25 4.08 -0.34 -0.68 2.96 0.24 -1.10 118.68 125.08 3g0g s LEU 544 Ca 0.03 0.95 -0.16 0.00 -0.22 0.00 0.00 54.13 54.73 3g0g s LEU 544 Cb -0.14 -3.13 -0.01 0.00 0.50 0.00 0.00 46.19 43.41 3g0g s LEU 544 CO -0.05 -0.51 0.41 -0.62 -1.32 0.00 0.00 176.35 174.26 3g0g s ASP 545 N 1.39 6.22 -0.07 3.68 3.68 0.18 -0.96 116.67 130.80 3g0g s ASP 545 Ca 0.33 -0.13 0.04 0.00 2.13 0.00 0.00 52.55 54.92 3g0g s ASP 545 Cb -0.15 -2.22 0.00 0.00 -1.45 0.00 0.00 42.92 39.10 3g0g s ASP 545 CO 0.08 -0.36 -0.19 0.54 0.13 0.00 0.00 175.17 175.36 3g0g s VAL 546 N 2.13 1.64 0.00 1.11 0.11 -0.79 -4.35 120.40 120.25 3g0g s VAL 546 Ca 0.14 -0.80 0.00 0.00 -2.93 0.00 0.00 61.98 58.39 3g0g s VAL 546 Cb -0.16 -1.43 0.00 0.00 -1.53 0.00 0.00 36.38 33.26 3g0g s VAL 546 CO 0.12 0.47 0.00 0.00 -3.33 0.00 0.00 175.10 172.36 3g0g n TYR 547 N 3.43 0.00 -1.02 1.54 9.36 -1.26 -4.17 117.16 125.05 3g0g n TYR 547 Ca -0.20 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.02 3g0g n TYR 547 Cb 0.52 0.00 -0.00 0.00 -0.63 0.00 0.00 39.34 39.23 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 -1.51 -0.01 -1.57 2.98 0.00 -1.26 -2.83 120.51 116.30 3g0g n ALA 548 Ca 0.00 0.01 -0.29 0.00 0.00 0.00 0.00 53.44 53.16 3g0g n ALA 548 Cb 0.00 -0.55 0.13 0.00 0.00 0.00 0.00 19.45 19.03 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 -2.08 1.58 0.11 0.00 0.00 -1.26 -4.80 107.32 100.88 3g0g s GLY 549 Ca 0.00 -0.50 -0.35 0.00 0.00 0.00 0.00 44.72 43.87 3g0g s GLY 549 CO 0.00 0.04 1.31 -1.05 0.00 0.00 0.00 173.10 173.40 3g0g n PRO 550 N -3.68 1.23 -1.35 2.90 -0.02 -1.26 -1.05 135.00 131.77 3g0g n PRO 550 Ca 0.07 0.44 -0.12 0.00 -2.02 0.00 0.00 63.50 61.87 3g0g n PRO 550 Cb 0.59 -2.06 -0.05 0.00 -0.02 0.00 0.00 33.50 31.96 3g0g n PRO 550 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g0g s SER 552 N -2.74 5.50 -0.25 0.00 1.04 -0.21 -3.97 113.70 113.07 3g0g s SER 552 Ca 0.00 1.65 -0.03 0.00 0.48 0.00 0.00 55.95 58.05 3g0g s SER 552 Cb 0.00 -2.50 0.14 0.00 0.10 0.00 0.00 66.02 63.76 3g0g s SER 552 CO 0.00 -1.36 0.41 -1.58 0.98 0.00 0.00 173.24 171.69 3g0g s GLN 553 N -4.84 0.37 0.00 4.02 0.74 -1.26 -0.04 119.66 118.65 3g0g s GLN 553 Ca 0.59 0.63 0.10 0.00 0.05 0.00 0.00 55.36 56.73 3g0g s GLN 553 Cb -0.14 -0.29 -0.01 0.00 1.10 0.00 0.00 33.01 33.66 3g0g s GLN 553 CO 0.51 -0.61 0.61 1.63 -0.55 0.00 0.00 175.29 176.88 3g0g n LYS 554 N 5.37 2.22 -3.70 1.67 4.76 -1.26 -4.84 118.16 122.38 3g0g n LYS 554 Ca -0.04 -0.56 -0.38 0.00 -2.87 0.00 0.00 58.31 54.47 3g0g n LYS 554 Cb 0.50 -1.06 -0.11 0.00 -1.84 0.00 0.00 35.03 32.52 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 -1.37 3.21 0.14 7.82 0.00 -1.26 -4.78 121.76 125.53 3g0g s ALA 555 Ca 0.08 -2.41 0.02 0.00 0.00 0.00 0.00 51.96 49.65 3g0g s ALA 555 Cb 0.08 -2.52 -0.01 0.00 0.00 0.00 0.00 23.12 20.67 3g0g s ALA 555 CO 0.25 -1.76 0.15 -0.40 0.00 0.00 0.00 175.76 174.00 3g0g n ASP 556 N 4.73 -0.40 -1.33 0.00 5.68 -1.26 -4.40 116.55 119.58 3g0g n ASP 556 Ca -0.06 -1.87 0.08 0.00 -0.50 0.00 0.00 54.79 52.44 3g0g n ASP 556 Cb 0.42 0.84 0.32 0.00 -1.14 0.00 0.00 41.12 41.55 3g0g n ASP 556 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3g0g n THR 557 N -0.26 2.18 -2.63 2.12 -2.24 -1.14 -4.92 114.28 107.39 3g0g n THR 557 Ca 0.02 -1.48 -0.41 0.00 -2.27 0.00 0.00 64.05 59.91 3g0g n THR 557 Cb 0.25 -0.08 -0.04 0.00 -2.10 0.00 0.00 70.33 68.36 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 -2.37 4.21 -0.11 2.28 1.01 -1.26 -1.96 120.40 122.20 3g0g s VAL 558 Ca 0.46 1.87 -0.28 0.00 0.00 0.00 0.00 61.98 64.03 3g0g s VAL 558 Cb 0.34 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 3g0g s VAL 558 CO 0.16 0.30 0.94 0.12 0.00 0.00 0.00 175.10 176.62 3g0g s PHE 559 N -0.11 3.51 -0.03 5.22 5.36 -0.02 -4.93 117.98 126.99 3g0g s PHE 559 Ca 0.48 1.50 0.04 0.00 -0.96 0.00 0.00 56.93 58.00 3g0g s PHE 559 Cb -0.26 -3.12 -0.01 0.00 -0.34 0.00 0.00 43.02 39.30 3g0g s PHE 559 CO 0.32 -0.19 -0.16 1.03 -1.46 0.00 0.00 175.22 174.76 3g0g s ARG 560 N 1.87 1.45 -0.50 10.12 0.52 -1.26 -4.90 118.95 126.25 3g0g s ARG 560 Ca 0.46 -0.56 -0.09 0.00 -0.52 0.00 0.00 55.73 55.02 3g0g s ARG 560 Cb -0.18 -1.34 0.13 0.00 0.52 0.00 0.00 34.95 34.08 3g0g s ARG 560 CO 0.17 0.28 0.37 -0.51 0.02 0.00 0.00 175.30 175.64 3g0g s LEU 561 N -0.16 5.70 0.00 2.53 1.43 -1.26 -4.84 118.68 122.08 3g0g s LEU 561 Ca 0.01 -2.05 0.00 0.00 -1.03 0.00 0.00 54.13 51.07 3g0g s LEU 561 Cb -0.08 -2.00 -0.00 0.00 0.03 0.00 0.00 46.19 44.14 3g0g s LEU 561 CO 0.01 -0.65 0.01 -0.46 0.23 0.00 0.00 176.35 175.48 3g0g n ASN 562 N 4.72 -0.03 -0.34 2.29 0.23 -1.26 -5.00 115.26 115.87 3g0g n ASN 562 Ca -0.05 -1.09 0.06 0.00 -0.53 0.00 0.00 54.58 52.97 3g0g n ASN 562 Cb 0.41 0.07 0.22 0.00 -2.08 0.00 0.00 39.78 38.40 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 1.04 1.03 -0.84 -2.53 7.01 -1.98 -1.11 115.95 118.57 3g0g h TRP 563 Ca -0.01 0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.03 3g0g h TRP 563 Cb 0.05 -0.32 -0.04 0.00 -2.10 0.00 0.00 29.16 26.75 3g0g h TRP 563 CO 0.00 0.39 0.56 0.00 -2.79 0.00 0.00 178.44 176.60 3g0g h ALA 564 N 1.52 1.41 -0.78 2.65 0.00 -1.97 -0.76 119.26 121.33 3g0g h ALA 564 Ca 0.47 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.44 3g0g h ALA 564 Cb 0.48 -0.34 -0.08 0.00 0.00 0.00 0.00 17.79 17.85 3g0g h ALA 564 CO -0.27 0.55 0.40 1.15 0.00 0.00 0.00 179.25 181.07 3g0g h THR 565 N 1.13 0.81 -0.24 0.00 2.02 -1.53 0.22 112.91 115.32 3g0g h THR 565 Ca 0.31 -0.22 -0.07 0.00 0.77 0.00 0.00 66.41 67.21 3g0g h THR 565 Cb -0.12 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.40 3g0g h THR 565 CO -0.07 0.11 -0.11 0.22 0.37 0.00 0.00 175.52 176.05 3g0g h TYR 566 N 0.63 0.58 -0.71 3.16 5.03 -1.08 0.11 116.97 124.69 3g0g h TYR 566 Ca 0.40 -0.14 0.02 0.00 2.58 0.00 0.00 58.73 61.58 3g0g h TYR 566 Cb 0.47 -0.14 -0.04 0.00 1.55 0.00 0.00 36.73 38.58 3g0g h TYR 566 CO -0.10 0.77 0.46 -0.07 -1.32 0.00 0.00 178.16 177.90 3g0g h LEU 567 N 0.23 0.78 -0.07 2.82 3.38 -0.58 0.20 115.31 122.07 3g0g h LEU 567 Ca 0.06 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 3g0g h LEU 567 Cb 0.61 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.18 3g0g h LEU 567 CO 0.03 0.55 -0.38 0.00 0.09 0.00 0.00 178.44 178.73 3g0g h ALA 568 N 1.28 0.14 -0.11 1.53 0.00 -0.56 -1.08 119.26 120.47 3g0g h ALA 568 Ca 0.27 -0.47 -0.24 0.00 0.00 0.00 0.00 54.91 54.48 3g0g h ALA 568 Cb -0.05 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.75 3g0g h ALA 568 CO -0.08 0.25 -0.85 1.03 0.00 0.00 0.00 179.25 179.59 3g0g h SER 569 N -0.09 0.94 0.00 0.00 0.87 -0.53 -3.23 113.55 111.50 3g0g h SER 569 Ca -0.03 -0.66 -0.33 0.00 -1.23 0.00 0.00 61.79 59.55 3g0g h SER 569 Cb 1.04 -0.28 -0.06 0.00 -0.44 0.00 0.00 62.40 62.66 3g0g h SER 569 CO 0.08 1.46 -2.20 0.41 -0.53 0.00 0.00 176.83 176.04 3g0g n THR 570 N -3.92 1.20 1.18 2.23 -1.04 0.68 -4.65 114.28 109.96 3g0g n THR 570 Ca -0.09 -0.43 0.12 0.00 -2.04 0.00 0.00 64.05 61.61 3g0g n THR 570 Cb 0.79 -1.35 0.37 0.00 -1.82 0.00 0.00 70.33 68.32 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 -3.28 1.90 -3.97 -2.82 -0.58 -0.98 -4.95 120.64 105.96 3g0g n GLU 571 Ca -0.38 -1.32 -0.30 0.00 -0.42 0.00 0.00 57.16 54.74 3g0g n GLU 571 Cb 0.88 -1.45 0.01 0.00 -0.57 0.00 0.00 31.44 30.30 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 0.57 -3.05 -4.44 1.62 5.03 -0.92 -4.95 115.26 109.12 3g0g n ASN 572 Ca 0.17 -0.89 -0.34 0.00 0.87 0.00 0.00 54.58 54.40 3g0g n ASN 572 Cb 0.42 -3.48 -0.13 0.00 -1.02 0.00 0.00 39.78 35.57 3g0g n ASN 572 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3g0g s ILE 573 N -3.48 3.59 0.02 2.41 1.01 -0.45 -4.41 121.20 119.90 3g0g s ILE 573 Ca 0.46 -0.46 -0.30 0.00 0.00 0.00 0.00 60.65 60.35 3g0g s ILE 573 Cb -0.24 -2.56 -0.05 0.00 0.01 0.00 0.00 42.46 39.61 3g0g s ILE 573 CO 0.86 0.49 1.29 -0.63 0.00 0.00 0.00 174.94 176.96 3g0g s ILE 574 N 0.47 3.88 -0.29 2.92 1.01 -0.25 -3.49 121.20 125.44 3g0g s ILE 574 Ca -0.05 1.29 -0.05 0.00 0.00 0.00 0.00 60.65 61.84 3g0g s ILE 574 Cb -0.15 -3.83 0.02 0.00 0.01 0.00 0.00 42.46 38.51 3g0g s ILE 574 CO 0.03 0.04 0.04 -0.69 0.00 0.00 0.00 174.94 174.36 3g0g s VAL 575 N 1.80 3.58 0.07 2.92 1.01 -1.06 -0.27 120.40 128.45 3g0g s VAL 575 Ca 0.61 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.75 3g0g s VAL 575 Cb -0.30 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 3g0g s VAL 575 CO 0.27 0.06 -0.08 0.00 0.00 0.00 0.00 175.10 175.34 3g0g s ALA 576 N 1.42 2.99 0.11 5.51 0.00 -0.26 -0.14 121.76 131.39 3g0g s ALA 576 Ca 0.01 -1.16 0.07 0.00 0.00 0.00 0.00 51.96 50.87 3g0g s ALA 576 Cb -0.18 -0.99 -0.03 0.00 0.00 0.00 0.00 23.12 21.92 3g0g s ALA 576 CO 0.00 0.64 -0.17 -1.12 0.00 0.00 0.00 175.76 175.11 3g0g s SER 577 N -1.94 2.17 -0.09 0.00 0.01 0.19 0.47 113.70 114.50 3g0g s SER 577 Ca 0.20 -0.72 -0.05 0.00 1.31 0.00 0.00 55.95 56.69 3g0g s SER 577 Cb -0.11 -0.10 0.04 0.00 0.21 0.00 0.00 66.02 66.06 3g0g s SER 577 CO 0.12 -0.05 0.22 0.12 0.41 0.00 0.00 173.24 174.06 3g0g s PHE 578 N -1.58 -0.27 -0.76 2.43 5.36 -1.26 -1.75 117.98 120.13 3g0g s PHE 578 Ca 0.06 0.67 -0.07 0.00 -0.96 0.00 0.00 56.93 56.63 3g0g s PHE 578 Cb -0.08 0.03 0.20 0.00 -0.34 0.00 0.00 43.02 42.82 3g0g s PHE 578 CO 0.04 -0.19 0.64 -0.51 -1.46 0.00 0.00 175.22 173.74 3g0g s ASP 579 N 1.00 6.00 0.00 6.13 1.01 -0.62 -4.83 116.67 125.35 3g0g s ASP 579 Ca -0.07 -2.96 0.00 0.00 0.71 0.00 0.00 52.55 50.22 3g0g s ASP 579 Cb -0.09 -2.01 0.00 0.00 1.01 0.00 0.00 42.92 41.83 3g0g s ASP 579 CO -0.06 -0.41 0.00 0.61 0.21 0.00 0.00 175.17 175.52 3g0g n GLY 580 N 3.45 1.25 3.74 0.21 0.00 -1.26 -4.07 105.19 108.50 3g0g n GLY 580 Ca 0.13 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.16 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 1.50 4.47 0.00 1.61 0.52 -1.26 -2.62 118.95 123.16 3g0g s ARG 581 Ca 0.00 1.93 0.00 0.00 -0.52 0.00 0.00 55.73 57.14 3g0g s ARG 581 Cb 0.00 -3.22 0.00 0.00 0.52 0.00 0.00 34.95 32.25 3g0g s ARG 581 CO 0.00 -0.12 0.00 0.41 0.02 0.00 0.00 175.30 175.61 3g0g n GLY 582 N 2.12 2.77 3.68 -3.53 0.00 -0.14 -4.21 105.19 105.87 3g0g n GLY 582 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.51 3.09 0.65 1.61 1.04 -1.08 0.05 113.70 118.56 3g0g s SER 583 Ca 0.00 2.16 0.02 0.00 0.48 0.00 0.00 55.95 58.61 3g0g s SER 583 Cb 0.00 -2.56 0.10 0.00 0.10 0.00 0.00 66.02 63.65 3g0g s SER 583 CO 0.00 -2.99 0.90 -0.83 0.98 0.00 0.00 173.24 171.30 3g0g s GLY 584 N -2.73 1.77 -1.96 7.32 0.00 0.95 -3.83 107.32 108.83 3g0g s GLY 584 Ca 0.66 -1.74 0.00 0.00 0.00 0.00 0.00 44.72 43.64 3g0g s GLY 584 CO 0.58 -1.26 0.00 -1.72 0.00 0.00 0.00 173.10 170.70 3g0g n TYR 585 N -2.59 -0.29 -1.89 1.90 4.02 -1.26 -4.81 117.16 112.24 3g0g n TYR 585 Ca 0.14 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 58.05 3g0g n TYR 585 Cb 0.61 -3.46 0.03 0.00 -0.02 0.00 0.00 39.34 36.50 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 -2.57 0.25 0.00 -0.72 6.02 -1.26 -4.52 117.38 114.58 3g0g n GLN 586 Ca -0.21 -1.43 0.00 0.00 -0.01 0.00 0.00 57.00 55.35 3g0g n GLN 586 Cb 0.65 -0.64 0.00 0.00 1.02 0.00 0.00 30.24 31.27 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 -0.21 1.75 0.12 1.08 0.00 -1.26 -4.67 105.19 102.00 3g0g n GLY 587 Ca 0.04 -1.89 -0.04 0.00 0.00 0.00 0.00 46.02 44.13 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 0.05 -0.56 1.61 3.32 -1.22 -2.58 116.42 117.04 3g0g h ASP 588 Ca 0.00 -0.04 0.11 0.00 0.02 0.00 0.00 57.03 57.12 3g0g h ASP 588 Cb 0.00 -0.02 -0.11 0.00 0.22 0.00 0.00 39.33 39.42 3g0g h ASP 588 CO 0.00 0.75 -0.29 0.50 -1.72 0.00 0.00 179.24 178.48 3g0g h LYS 589 N 0.03 -0.14 0.09 3.56 1.63 -1.87 0.32 116.57 120.19 3g0g h LYS 589 Ca -0.01 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.79 3g0g h LYS 589 Cb 1.27 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.94 3g0g h LYS 589 CO 0.10 -0.09 -0.05 0.82 -3.45 0.00 0.00 179.45 176.78 3g0g h ILE 590 N -0.14 1.13 -0.23 2.00 2.04 -1.83 -3.24 117.51 117.24 3g0g h ILE 590 Ca 0.24 -0.99 -0.12 0.00 1.00 0.00 0.00 64.86 64.99 3g0g h ILE 590 Cb 0.53 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.35 3g0g h ILE 590 CO -0.65 0.23 -0.36 -0.03 0.00 0.00 0.00 178.15 177.35 3g0g h MET 591 N -0.59 0.50 -0.01 2.37 4.05 -1.02 -0.25 114.93 119.98 3g0g h MET 591 Ca -0.01 -0.23 0.00 0.00 -0.28 0.00 0.00 59.70 59.17 3g0g h MET 591 Cb 0.48 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.27 3g0g h MET 591 CO 0.02 0.79 -0.05 0.72 0.23 0.00 0.00 176.91 178.62 3g0g n HIS 592 N -4.06 0.00 0.20 1.39 8.25 0.11 -4.18 115.22 116.93 3g0g n HIS 592 Ca -0.01 0.00 0.18 0.00 -0.26 0.00 0.00 57.72 57.63 3g0g n HIS 592 Cb 0.48 -0.08 0.82 0.00 1.12 0.00 0.00 29.99 32.33 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 1.78 -0.57 -1.41 0.00 -1.47 -0.09 119.26 121.43 3g0g h ALA 593 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3g0g h ALA 593 Cb 0.30 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3g0g h ALA 593 CO 0.00 -0.41 0.00 0.44 0.00 0.00 0.00 179.25 179.28 3g0g n ILE 594 N -3.56 1.28 -1.68 0.00 -6.64 -1.26 -4.91 119.36 102.60 3g0g n ILE 594 Ca 0.03 -1.10 -0.49 0.00 -1.77 0.00 0.00 62.75 59.41 3g0g n ILE 594 Cb 0.42 0.37 -0.05 0.00 -1.44 0.00 0.00 39.64 38.94 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 1.05 3.32 0.00 7.28 2.85 -0.05 -1.24 115.26 128.48 3g0g n ASN 595 Ca 0.21 0.95 0.00 0.00 -0.11 0.00 0.00 54.58 55.63 3g0g n ASN 595 Cb 0.64 -1.35 0.00 0.00 1.24 0.00 0.00 39.78 40.31 3g0g n ASN 595 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 3g0g n ARG 596 N 6.65 0.00 -2.63 1.20 1.74 0.34 -4.80 116.66 119.16 3g0g n ARG 596 Ca 0.24 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 57.11 3g0g n ARG 596 Cb 0.28 -3.09 0.00 0.00 -1.02 0.00 0.00 32.46 28.64 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 -2.00 2.53 -1.76 5.56 5.12 -0.37 -4.89 116.66 120.84 3g0g n ARG 597 Ca 0.00 -4.07 -0.39 0.00 -1.93 0.00 0.00 57.85 51.46 3g0g n ARG 597 Cb 0.00 -1.89 0.04 0.00 -1.16 0.00 0.00 32.46 29.44 3g0g n ARG 597 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3g0g s LEU 598 N -3.33 3.90 0.00 0.55 1.02 -1.21 -3.15 118.68 116.47 3g0g s LEU 598 Ca 0.41 2.83 0.00 0.00 0.02 0.00 0.00 54.13 57.39 3g0g s LEU 598 Cb 0.40 -4.20 0.00 0.00 0.02 0.00 0.00 46.19 42.42 3g0g s LEU 598 CO -0.10 -1.51 0.00 0.61 0.02 0.00 0.00 176.35 175.36 3g0g n GLY 599 N 0.70 0.41 0.00 -3.19 0.00 -1.26 -4.89 105.19 96.95 3g0g n GLY 599 Ca 0.09 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.09 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 -3.14 0.00 -0.31 2.61 -2.24 -1.19 -4.82 114.28 105.20 3g0g n THR 600 Ca 0.00 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.87 3g0g n THR 600 Cb 0.09 0.00 0.25 0.00 -2.10 0.00 0.00 70.33 68.57 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 0.83 0.00 4.78 0.04 -1.92 -1.15 116.94 119.52 3g0g h PHE 601 Ca 0.00 0.03 -0.10 0.00 2.80 0.00 0.00 57.97 60.70 3g0g h PHE 601 Cb 0.00 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 37.90 3g0g h PHE 601 CO 0.00 0.19 -0.49 1.05 -0.60 0.00 0.00 178.31 178.45 3g0g h GLU 602 N 0.65 0.00 0.41 1.51 9.09 -1.91 -0.04 114.58 124.29 3g0g h GLU 602 Ca 0.49 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.88 3g0g h GLU 602 Cb 0.72 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.82 3g0g h GLU 602 CO -0.37 0.49 -0.20 0.28 0.05 0.00 0.00 179.01 179.26 3g0g h VAL 603 N 0.00 0.46 -0.96 -1.06 2.07 -1.57 -2.77 116.25 112.41 3g0g h VAL 603 Ca -0.00 -0.55 0.11 0.00 0.82 0.00 0.00 66.70 67.08 3g0g h VAL 603 Cb 0.89 0.68 -0.08 0.00 -1.52 0.00 0.00 31.29 31.26 3g0g h VAL 603 CO 0.06 0.08 0.61 -0.33 0.02 0.00 0.00 177.57 178.02 3g0g h GLU 604 N -0.92 0.93 -0.00 1.57 5.08 -1.06 -1.82 114.58 118.35 3g0g h GLU 604 Ca -0.06 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.11 3g0g h GLU 604 Cb 0.56 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3g0g h GLU 604 CO 0.09 0.62 -0.65 -0.44 -1.00 0.00 0.00 179.01 177.63 3g0g h ASP 605 N 0.96 0.00 -0.44 1.42 3.32 -1.06 -0.28 116.42 120.34 3g0g h ASP 605 Ca 0.46 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.42 3g0g h ASP 605 Cb 0.45 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 3g0g h ASP 605 CO -0.22 0.65 -0.05 1.56 -1.72 0.00 0.00 179.24 179.46 3g0g h GLN 606 N 0.00 0.88 -0.04 3.56 1.08 -1.04 -0.44 115.11 119.10 3g0g h GLN 606 Ca -0.01 -0.27 -0.02 0.00 -1.45 0.00 0.00 58.65 56.91 3g0g h GLN 606 Cb 1.16 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 28.50 3g0g h GLN 606 CO 0.09 0.90 -0.04 0.82 -0.95 0.00 0.00 178.83 179.65 3g0g h ILE 607 N 0.80 1.36 -0.78 2.54 2.04 -1.13 -2.91 117.51 119.44 3g0g h ILE 607 Ca 0.14 -1.15 0.07 0.00 1.00 0.00 0.00 64.86 64.93 3g0g h ILE 607 Cb 0.55 2.04 -0.06 0.00 -0.74 0.00 0.00 36.82 38.61 3g0g h ILE 607 CO 0.03 0.31 0.46 -0.08 0.00 0.00 0.00 178.15 178.87 3g0g h GLU 608 N -0.34 0.78 -0.53 2.37 4.57 -0.99 -1.73 114.58 118.72 3g0g h GLU 608 Ca 0.01 -0.05 0.10 0.00 -1.18 0.00 0.00 59.36 58.24 3g0g h GLU 608 Cb 0.52 -0.18 -0.08 0.00 -0.16 0.00 0.00 28.75 28.85 3g0g h GLU 608 CO 0.01 0.52 0.07 0.00 -1.18 0.00 0.00 179.01 178.43 3g0g h ALA 609 N 1.40 0.57 -0.34 2.92 0.00 -1.04 -0.40 119.26 122.38 3g0g h ALA 609 Ca 0.36 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.34 3g0g h ALA 609 Cb 0.25 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3g0g h ALA 609 CO -0.20 -0.34 -0.03 0.00 0.00 0.00 0.00 179.25 178.68 3g0g h ALA 610 N 1.43 1.33 -0.65 0.00 0.00 -1.16 0.14 119.26 120.35 3g0g h ALA 610 Ca 0.27 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3g0g h ALA 610 Cb 0.39 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3g0g h ALA 610 CO -0.38 0.46 0.20 0.00 0.00 0.00 0.00 179.25 179.52 3g0g h ARG 611 N 0.51 1.01 -0.60 0.00 3.08 -0.34 -1.70 114.38 116.35 3g0g h ARG 611 Ca 0.11 -0.22 -0.08 0.00 0.07 0.00 0.00 59.98 59.86 3g0g h ARG 611 Cb 0.37 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3g0g h ARG 611 CO 0.01 0.89 0.08 1.96 -1.07 0.00 0.00 179.97 181.85 3g0g h GLN 612 N 0.94 1.00 -0.17 0.04 1.08 -0.48 -2.81 115.11 114.71 3g0g h GLN 612 Ca 0.21 -0.28 -0.04 0.00 -1.45 0.00 0.00 58.65 57.09 3g0g h GLN 612 Cb 0.31 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 3g0g h GLN 612 CO -0.01 0.95 -0.07 0.74 -0.95 0.00 0.00 178.83 179.49 3g0g h PHE 613 N 0.91 0.27 -0.42 2.96 0.04 -0.74 -2.10 116.94 117.86 3g0g h PHE 613 Ca 0.18 -0.02 -0.14 0.00 2.80 0.00 0.00 57.97 60.79 3g0g h PHE 613 Cb 0.45 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.51 3g0g h PHE 613 CO 0.03 0.34 -0.29 0.77 -0.60 0.00 0.00 178.31 178.56 3g0g h SER 614 N 0.25 0.97 0.77 2.17 0.02 -1.23 -3.14 113.55 113.36 3g0g h SER 614 Ca 0.06 -0.40 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 3g0g h SER 614 Cb 0.30 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.57 3g0g h SER 614 CO 0.01 1.18 0.00 0.11 -1.14 0.00 0.00 176.83 177.00 3g0g h LYS 615 N 0.79 0.00 0.00 3.45 1.57 -1.13 -2.15 116.57 119.09 3g0g h LYS 615 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3g0g h LYS 615 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.18 3g0g h LYS 615 CO 0.08 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 177.63 3g0g n MET 616 N -3.02 0.18 -0.37 3.15 2.81 -0.86 -4.91 117.12 114.10 3g0g n MET 616 Ca -0.00 0.44 0.00 0.00 -1.81 0.00 0.00 57.70 56.33 3g0g n MET 616 Cb 0.25 -1.87 0.00 0.00 -0.71 0.00 0.00 33.22 30.89 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 -0.16 1.32 1.06 3.03 0.00 -0.81 -4.87 105.19 104.76 3g0g n GLY 617 Ca 0.02 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.00 0.98 -4.26 1.61 -1.74 -1.26 -4.79 117.46 106.01 3g0g n PHE 618 Ca 0.00 -0.66 -0.34 0.00 -0.56 0.00 0.00 57.45 55.89 3g0g n PHE 618 Cb 0.00 -0.19 -0.14 0.00 1.52 0.00 0.00 39.48 40.67 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 -1.86 3.32 -0.40 1.97 1.01 -1.26 -0.24 120.40 122.93 3g0g s VAL 619 Ca 0.39 -0.54 -0.28 0.00 0.00 0.00 0.00 61.98 61.55 3g0g s VAL 619 Cb 0.26 -2.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.17 3g0g s VAL 619 CO 0.17 0.47 1.67 -0.62 0.00 0.00 0.00 175.10 176.79 3g0g s ASP 620 N 0.95 5.96 0.00 3.32 3.68 0.90 -4.71 116.67 126.78 3g0g s ASP 620 Ca -0.01 1.00 0.14 0.00 2.13 0.00 0.00 52.55 55.81 3g0g s ASP 620 Cb -0.15 -2.53 0.74 0.00 -1.45 0.00 0.00 42.92 39.53 3g0g s ASP 620 CO 0.00 -1.71 1.49 -0.46 0.13 0.00 0.00 175.17 174.63 3g0g n ASN 621 N 10.10 0.48 -0.11 -0.34 6.94 -1.26 -2.13 115.26 128.94 3g0g n ASN 621 Ca 0.20 -1.65 0.12 0.00 -0.02 0.00 0.00 54.58 53.24 3g0g n ASN 621 Cb 0.48 -0.04 0.28 0.00 -2.36 0.00 0.00 39.78 38.13 3g0g n ASN 621 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3g0g n LYS 622 N -0.40 0.36 -3.20 -3.83 5.02 -1.26 -4.49 118.16 110.36 3g0g n LYS 622 Ca 0.11 -0.22 -0.23 0.00 -2.02 0.00 0.00 58.31 55.95 3g0g n LYS 622 Cb 0.12 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.58 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 -1.12 1.16 -4.07 1.97 1.74 -0.91 -4.83 116.66 110.61 3g0g n ARG 623 Ca 0.08 -3.54 -0.35 0.00 -0.77 0.00 0.00 57.85 53.27 3g0g n ARG 623 Cb 0.34 -1.55 -0.14 0.00 -1.02 0.00 0.00 32.46 30.09 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 -1.94 3.28 0.43 0.55 1.01 -1.26 -1.87 121.20 121.41 3g0g s ILE 624 Ca 0.38 -0.53 0.06 0.00 0.00 0.00 0.00 60.65 60.56 3g0g s ILE 624 Cb 0.23 -2.47 -0.05 0.00 0.01 0.00 0.00 42.46 40.18 3g0g s ILE 624 CO -0.09 0.45 0.11 0.00 0.00 0.00 0.00 174.94 175.40 3g0g s ALA 625 N 1.25 3.56 -0.14 9.38 0.00 0.68 -0.22 121.76 136.26 3g0g s ALA 625 Ca 0.03 -1.88 -0.14 0.00 0.00 0.00 0.00 51.96 49.96 3g0g s ALA 625 Cb -0.14 -0.15 0.04 0.00 0.00 0.00 0.00 23.12 22.87 3g0g s ALA 625 CO -0.02 -0.15 0.40 -1.50 0.00 0.00 0.00 175.76 174.49 3g0g s ILE 626 N -2.69 0.00 0.04 0.00 2.07 -1.12 -0.60 121.20 118.90 3g0g s ILE 626 Ca 0.33 -0.03 -0.20 0.00 -1.41 0.00 0.00 60.65 59.34 3g0g s ILE 626 Cb 0.05 -0.58 0.04 0.00 0.13 0.00 0.00 42.46 42.11 3g0g s ILE 626 CO 0.18 -0.02 0.47 -1.66 -1.91 0.00 0.00 174.94 172.00 3g0g s TRP 627 N 0.09 -0.35 -0.13 3.50 1.48 -0.13 -0.81 118.94 122.58 3g0g s TRP 627 Ca -0.01 0.38 -0.32 0.00 -1.06 0.00 0.00 56.10 55.09 3g0g s TRP 627 Cb -0.03 0.28 0.13 0.00 -1.16 0.00 0.00 33.47 32.69 3g0g s TRP 627 CO 0.01 -0.60 1.08 0.20 -4.06 0.00 0.00 176.95 173.58 3g0g s GLY 628 N -1.91 -0.32 0.14 3.67 0.00 -0.82 -1.89 107.32 106.19 3g0g s GLY 628 Ca -0.06 1.57 0.09 0.00 0.00 0.00 0.00 44.72 46.32 3g0g s GLY 628 CO -0.01 0.59 -0.16 0.86 0.00 0.00 0.00 173.10 174.38 3g0g s TRP 629 N -2.33 2.56 0.00 1.90 -0.11 -1.26 -1.56 118.94 118.14 3g0g s TRP 629 Ca 0.06 -0.25 0.00 0.00 1.22 0.00 0.00 56.10 57.13 3g0g s TRP 629 Cb -0.01 -1.32 0.00 0.00 -1.50 0.00 0.00 33.47 30.64 3g0g s TRP 629 CO -0.05 0.43 0.00 0.43 -4.62 0.00 0.00 176.95 173.14 3g0g n SER 630 N 0.56 0.00 -0.33 5.86 7.64 -1.04 0.23 113.62 126.53 3g0g n SER 630 Ca -0.14 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.70 3g0g n SER 630 Cb 0.54 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.82 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 1.19 -0.65 1.43 3.20 -1.86 -2.67 116.97 117.61 3g0g h TYR 631 Ca 0.00 -0.00 0.14 0.00 3.14 0.00 0.00 58.73 62.00 3g0g h TYR 631 Cb 0.00 -0.39 -0.11 0.00 1.54 0.00 0.00 36.73 37.77 3g0g h TYR 631 CO 0.00 0.79 0.04 0.78 -1.64 0.00 0.00 178.16 178.13 3g0g h GLY 632 N 1.24 0.74 1.41 1.82 0.00 -0.06 0.51 103.07 108.73 3g0g h GLY 632 Ca 0.32 0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.67 3g0g h GLY 632 CO -0.06 -0.20 0.14 -1.33 0.00 0.00 0.00 176.54 175.09 3g0g h GLY 633 N 0.15 0.80 0.84 4.60 0.00 -1.24 0.13 103.07 108.34 3g0g h GLY 633 Ca 0.34 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 3g0g h GLY 633 CO -0.53 0.41 -0.09 -1.82 0.00 0.00 0.00 176.54 174.51 3g0g h TYR 634 N 0.73 -0.24 -0.15 5.60 5.03 -0.84 -0.67 116.97 126.42 3g0g h TYR 634 Ca 0.17 -0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.51 3g0g h TYR 634 Cb 0.24 0.08 -0.05 0.00 1.55 0.00 0.00 36.73 38.55 3g0g h TYR 634 CO 0.01 -0.02 -0.13 0.28 -1.32 0.00 0.00 178.16 176.98 3g0g h VAL 635 N -0.42 0.64 -0.53 1.81 2.07 -0.69 0.27 116.25 119.40 3g0g h VAL 635 Ca -0.03 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.60 3g0g h VAL 635 Cb 0.33 0.64 -0.09 0.00 -1.52 0.00 0.00 31.29 30.65 3g0g h VAL 635 CO 0.04 0.00 0.00 0.74 0.02 0.00 0.00 177.57 178.37 3g0g h THR 636 N -0.14 0.58 -0.27 2.57 2.02 -0.75 0.22 112.91 117.15 3g0g h THR 636 Ca 0.10 -0.04 -0.04 0.00 0.77 0.00 0.00 66.41 67.20 3g0g h THR 636 Cb 0.29 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 3g0g h THR 636 CO -0.24 0.02 0.02 0.28 0.37 0.00 0.00 175.52 175.98 3g0g h SER 637 N 0.12 0.44 -0.79 4.18 0.02 -0.55 -1.13 113.55 115.84 3g0g h SER 637 Ca 0.27 -0.28 0.10 0.00 -0.84 0.00 0.00 61.79 61.04 3g0g h SER 637 Cb 0.41 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.78 3g0g h SER 637 CO -0.45 0.61 0.51 0.24 -1.14 0.00 0.00 176.83 176.61 3g0g h MET 638 N 0.25 0.66 -0.03 3.45 2.07 0.32 -1.76 114.93 119.89 3g0g h MET 638 Ca 0.08 -0.04 -0.20 0.00 -2.07 0.00 0.00 59.70 57.47 3g0g h MET 638 Cb 0.37 -0.15 0.01 0.00 -1.87 0.00 0.00 31.60 29.97 3g0g h MET 638 CO 0.01 0.44 -0.75 0.28 1.07 0.00 0.00 176.91 177.96 3g0g h VAL 639 N 0.68 1.35 -0.32 -2.22 2.07 -0.34 -2.94 116.25 114.53 3g0g h VAL 639 Ca 0.37 -2.08 -0.03 0.00 0.82 0.00 0.00 66.70 65.77 3g0g h VAL 639 Cb 0.51 2.41 -0.02 0.00 -1.52 0.00 0.00 31.29 32.67 3g0g h VAL 639 CO -0.14 0.63 0.08 -0.07 0.02 0.00 0.00 177.57 178.08 3g0g h LEU 640 N 0.15 0.43 -2.52 2.57 3.38 -0.92 -1.99 115.31 116.41 3g0g h LEU 640 Ca -0.09 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3g0g h LEU 640 Cb 1.42 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.06 3g0g h LEU 640 CO 0.15 0.44 0.00 0.61 0.09 0.00 0.00 178.44 179.73 3g0g n GLY 641 N -1.11 2.25 0.14 0.83 0.00 -0.69 -4.28 105.19 102.34 3g0g n GLY 641 Ca 0.02 -0.59 0.12 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 2.67 0.00 -2.54 1.61 4.64 -1.17 -3.44 113.55 115.33 3g0g h SER 642 Ca 0.00 -0.03 -0.25 0.00 -0.47 0.00 0.00 61.79 61.04 3g0g h SER 642 Cb 1.32 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.43 3g0g h SER 642 CO 0.26 0.01 -0.35 0.61 -0.87 0.00 0.00 176.83 176.49 3g0g n GLY 643 N 1.18 -0.08 0.08 -0.77 0.00 -1.26 -4.92 105.19 99.42 3g0g n GLY 643 Ca 0.02 -0.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.57 0.00 0.00 1.61 4.64 -1.90 -3.47 113.55 113.86 3g0g h SER 644 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 3g0g h SER 644 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3g0g h SER 644 CO 0.35 0.86 0.00 0.61 -0.87 0.00 0.00 176.83 177.78 3g0g n GLY 645 N 1.25 1.21 0.20 -0.77 0.00 -1.26 -4.90 105.19 100.92 3g0g n GLY 645 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 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 1.29 -3.15 1.61 2.07 -1.95 -3.45 116.25 112.66 3g0g h VAL 646 Ca 0.00 -2.11 -0.63 0.00 0.82 0.00 0.00 66.70 64.78 3g0g h VAL 646 Cb 0.00 2.23 -0.13 0.00 -1.52 0.00 0.00 31.29 31.87 3g0g h VAL 646 CO 0.00 0.66 -0.54 -0.36 0.02 0.00 0.00 177.57 177.35 3g0g s PHE 647 N -3.49 3.35 0.03 1.57 0.40 -1.26 -4.55 117.98 114.03 3g0g s PHE 647 Ca -0.10 0.24 -0.16 0.00 -0.60 0.00 0.00 56.93 56.31 3g0g s PHE 647 Cb 0.07 -2.03 -0.31 0.00 0.51 0.00 0.00 43.02 41.26 3g0g s PHE 647 CO 0.91 0.35 1.05 -0.22 0.70 0.00 0.00 175.22 178.00 3g0g h LYS 648 N 6.14 0.56 -3.55 0.44 3.64 -0.92 -3.45 116.57 119.43 3g0g h LYS 648 Ca -0.43 -0.81 -0.04 0.00 -1.27 0.00 0.00 60.65 58.09 3g0g h LYS 648 Cb 1.18 0.28 -0.09 0.00 -0.41 0.00 0.00 32.23 33.19 3g0g h LYS 648 CO 0.67 1.37 -0.07 0.00 -2.27 0.00 0.00 179.45 179.16 3g0g s GLY 650 N -2.99 -0.56 -0.09 0.00 0.00 -0.29 -2.81 107.32 100.59 3g0g s GLY 650 Ca 0.20 0.65 0.02 0.00 0.00 0.00 0.00 44.72 45.59 3g0g s GLY 650 CO 0.07 0.21 -0.15 -0.42 0.00 0.00 0.00 173.10 172.82 3g0g s ILE 651 N -3.54 1.39 -0.20 0.90 1.01 0.01 -1.38 121.20 119.39 3g0g s ILE 651 Ca 0.03 -0.60 0.01 0.00 0.00 0.00 0.00 60.65 60.08 3g0g s ILE 651 Cb -0.01 -1.26 0.04 0.00 0.01 0.00 0.00 42.46 41.24 3g0g s ILE 651 CO -0.11 0.41 -0.10 0.00 0.00 0.00 0.00 174.94 175.14 3g0g s ALA 652 N 0.76 1.99 -0.23 9.38 0.00 0.55 -1.95 121.76 132.26 3g0g s ALA 652 Ca -0.12 -1.18 -0.06 0.00 0.00 0.00 0.00 51.96 50.60 3g0g s ALA 652 Cb -0.16 -1.26 -0.02 0.00 0.00 0.00 0.00 23.12 21.68 3g0g s ALA 652 CO 0.02 -0.79 0.03 0.08 0.00 0.00 0.00 175.76 175.10 3g0g s VAL 653 N 1.40 4.00 -0.89 0.00 1.01 -0.60 -1.25 120.40 124.08 3g0g s VAL 653 Ca -0.01 -0.28 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 3g0g s VAL 653 Cb -0.16 -2.85 0.02 0.00 0.00 0.00 0.00 36.38 33.39 3g0g s VAL 653 CO -0.08 0.38 0.58 0.00 0.00 0.00 0.00 175.10 175.97 3g0g n ALA 654 N 4.77 -2.60 -2.09 5.51 0.00 0.16 -2.50 120.51 123.76 3g0g n ALA 654 Ca -0.17 -0.36 -0.31 0.00 0.00 0.00 0.00 53.44 52.60 3g0g n ALA 654 Cb 0.51 -1.24 -0.04 0.00 0.00 0.00 0.00 19.45 18.69 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 -5.66 3.86 0.25 0.00 0.04 -1.26 -2.94 135.00 129.30 3g0g s PRO 655 Ca 0.16 0.62 -0.30 0.00 0.04 0.00 0.00 61.00 61.53 3g0g s PRO 655 Cb -0.09 -2.34 -0.09 0.00 0.04 0.00 0.00 34.50 32.02 3g0g s PRO 655 CO 0.85 -0.06 1.20 0.08 0.04 0.00 0.00 177.00 179.11 3g0g s VAL 656 N -2.36 3.33 -0.16 -0.36 1.01 -1.24 -4.51 120.40 116.11 3g0g s VAL 656 Ca 0.54 1.23 0.04 0.00 0.00 0.00 0.00 61.98 63.78 3g0g s VAL 656 Cb -0.10 -3.78 -0.12 0.00 0.00 0.00 0.00 36.38 32.37 3g0g s VAL 656 CO 0.29 0.25 -0.10 -1.54 0.00 0.00 0.00 175.10 174.00 3g0g n SER 657 N 1.72 2.44 -3.74 3.32 3.41 -1.26 -4.22 113.62 115.28 3g0g n SER 657 Ca 0.02 -0.07 -0.13 0.00 -0.26 0.00 0.00 58.87 58.43 3g0g n SER 657 Cb 0.44 0.03 -0.09 0.00 -0.26 0.00 0.00 64.21 64.32 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 -2.33 0.58 0.52 4.33 1.70 -1.26 -1.27 118.95 121.22 3g0g s ARG 658 Ca -0.18 0.16 0.34 0.00 -0.47 0.00 0.00 55.73 55.58 3g0g s ARG 658 Cb 0.05 0.27 1.49 0.00 -0.57 0.00 0.00 34.95 36.19 3g0g s ARG 658 CO 0.43 -0.13 2.00 -1.49 -1.08 0.00 0.00 175.30 175.03 3g0g h TRP 659 N 4.61 0.00 0.00 5.89 4.06 -1.86 -1.96 115.95 126.69 3g0g h TRP 659 Ca -0.28 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.67 3g0g h TRP 659 Cb 1.18 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 3g0g h TRP 659 CO 0.46 0.00 0.00 0.39 -3.56 0.00 0.00 178.44 175.73 3g0g n GLU 660 N -2.94 0.17 0.09 0.49 4.71 -1.26 -2.60 120.64 119.29 3g0g n GLU 660 Ca 0.00 0.29 0.02 0.00 -0.01 0.00 0.00 57.16 57.45 3g0g n GLU 660 Cb 0.25 -1.76 -0.03 0.00 -1.01 0.00 0.00 31.44 28.89 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 -3.93 -0.32 0.05 -1.74 -3.31 116.97 107.72 3g0g h TYR 661 Ca 0.00 0.00 -0.49 0.00 0.05 0.00 0.00 58.73 58.29 3g0g h TYR 661 Cb 0.49 0.00 0.05 0.00 1.01 0.00 0.00 36.73 38.28 3g0g h TYR 661 CO 0.00 0.52 0.25 -0.47 -1.05 0.00 0.00 178.16 177.41 3g0g s TYR 662 N -2.96 3.50 0.90 4.88 5.04 -1.07 -4.82 117.35 122.83 3g0g s TYR 662 Ca 0.00 0.96 -0.10 0.00 -2.44 0.00 0.00 57.07 55.49 3g0g s TYR 662 Cb 0.08 -2.59 0.14 0.00 0.35 0.00 0.00 41.96 39.94 3g0g s TYR 662 CO 0.78 -0.60 1.14 0.16 -1.34 0.00 0.00 175.55 175.68 3g0g s ASP 663 N -4.19 3.05 0.20 4.32 1.47 -1.26 -1.41 116.67 118.86 3g0g s ASP 663 Ca 0.52 2.12 0.07 0.00 1.18 0.00 0.00 52.55 56.45 3g0g s ASP 663 Cb -0.11 -2.55 0.11 0.00 -0.34 0.00 0.00 42.92 40.03 3g0g s ASP 663 CO 0.48 -3.01 1.46 0.77 0.68 0.00 0.00 175.17 175.56 3g0g h SER 664 N -1.81 0.08 -0.08 2.11 4.64 -0.92 -2.79 113.55 114.79 3g0g h SER 664 Ca -0.44 -0.06 -0.11 0.00 -0.47 0.00 0.00 61.79 60.71 3g0g h SER 664 Cb 1.27 -0.03 0.01 0.00 -0.31 0.00 0.00 62.40 63.34 3g0g h SER 664 CO 0.43 0.83 -0.38 0.58 -0.87 0.00 0.00 176.83 177.42 3g0g h VAL 665 N 0.04 1.41 0.01 0.95 2.07 -1.93 -1.24 116.25 117.56 3g0g h VAL 665 Ca -0.02 -1.77 -0.00 0.00 0.82 0.00 0.00 66.70 65.73 3g0g h VAL 665 Cb 1.37 2.30 0.00 0.00 -1.52 0.00 0.00 31.29 33.44 3g0g h VAL 665 CO 0.11 0.52 -0.01 0.22 0.02 0.00 0.00 177.57 178.43 3g0g h TYR 666 N -0.08 -0.02 0.10 1.57 3.20 -1.92 -3.13 116.97 116.70 3g0g h TYR 666 Ca -0.03 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.84 3g0g h TYR 666 Cb 1.03 0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.31 3g0g h TYR 666 CO 0.13 0.67 -0.05 1.15 -1.64 0.00 0.00 178.16 178.42 3g0g h THR 667 N -0.73 0.97 0.00 1.81 2.02 -1.57 -3.03 112.91 112.38 3g0g h THR 667 Ca -0.00 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 3g0g h THR 667 Cb 0.69 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 3g0g h THR 667 CO 0.00 0.06 -0.27 -0.33 0.37 0.00 0.00 175.52 175.35 3g0g h GLU 668 N -0.24 0.00 -0.66 6.66 5.08 -1.37 0.10 114.58 124.15 3g0g h GLU 668 Ca -0.01 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.48 3g0g h GLU 668 Cb 0.20 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.35 3g0g h GLU 668 CO 0.02 0.27 0.11 -0.09 -1.00 0.00 0.00 179.01 178.33 3g0g h ARG 669 N 0.00 0.22 0.00 2.33 2.43 -1.46 0.63 114.38 118.52 3g0g h ARG 669 Ca -0.00 -0.01 -0.22 0.00 -0.81 0.00 0.00 59.98 58.93 3g0g h ARG 669 Cb 0.53 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.99 3g0g h ARG 669 CO 0.04 0.14 -2.17 0.66 -1.51 0.00 0.00 179.97 177.13 3g0g n TYR 670 N -5.19 0.09 0.60 2.20 4.01 -1.00 -4.61 117.16 113.26 3g0g n TYR 670 Ca 0.11 0.03 0.07 0.00 -0.16 0.00 0.00 57.90 57.95 3g0g n TYR 670 Cb 0.39 -0.84 -0.09 0.00 -0.31 0.00 0.00 39.34 38.50 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 -2.59 1.92 0.00 -0.72 2.81 0.32 0.13 117.12 118.98 3g0g n MET 671 Ca -0.21 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.66 3g0g n MET 671 Cb 0.93 -1.22 0.00 0.00 -0.71 0.00 0.00 33.22 32.22 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 1.39 0.36 3.88 3.03 0.00 0.20 -4.67 105.19 109.38 3g0g n GLY 672 Ca 0.02 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 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 4.32 -1.51 0.99 1.02 -1.26 -4.37 118.68 117.88 3g0g s LEU 673 Ca 0.00 0.64 -0.10 0.00 0.02 0.00 0.00 54.13 54.69 3g0g s LEU 673 Cb 0.00 -3.03 -0.00 0.00 0.02 0.00 0.00 46.19 43.18 3g0g s LEU 673 CO 0.00 0.15 2.61 -0.81 0.02 0.00 0.00 176.35 178.32 3g0g n PRO 674 N 0.63 3.68 -4.33 1.29 -0.04 -1.26 -1.22 135.00 133.75 3g0g n PRO 674 Ca -0.07 -2.63 -0.22 0.00 -0.04 0.00 0.00 63.50 60.55 3g0g n PRO 674 Cb 0.52 -2.89 -0.11 0.00 -0.04 0.00 0.00 33.50 30.98 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 1.65 1.79 0.59 0.52 -4.23 -1.26 -4.72 115.64 109.98 3g0g s THR 675 Ca 0.60 -1.91 0.29 0.00 -1.18 0.00 0.00 61.69 59.49 3g0g s THR 675 Cb 0.17 -1.83 0.38 0.00 1.34 0.00 0.00 72.50 72.55 3g0g s THR 675 CO -0.07 -0.32 1.89 -0.65 -0.54 0.00 0.00 174.62 174.93 3g0g h PRO 676 N 3.26 0.00 -0.62 3.99 0.11 -1.97 0.12 132.00 136.89 3g0g h PRO 676 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3g0g h PRO 676 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3g0g h PRO 676 CO 0.51 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.45 3g0g n GLU 677 N -3.67 2.66 0.00 1.05 0.00 -1.26 -4.83 120.64 114.58 3g0g n GLU 677 Ca 0.08 -2.55 0.00 0.00 0.00 0.00 0.00 57.16 54.69 3g0g n GLU 677 Cb 0.67 -1.56 0.00 0.00 0.00 0.00 0.00 31.44 30.55 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 1.62 0.00 -1.27 -1.84 4.64 0.00 -5.06 116.55 114.65 3g0g n ASP 678 Ca 0.23 0.00 0.03 0.00 -1.38 0.00 0.00 54.79 53.67 3g0g n ASP 678 Cb 0.62 0.00 0.10 0.00 -1.04 0.00 0.00 41.12 40.80 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 1.52 -0.28 1.67 5.15 -0.35 -4.87 115.26 118.09 3g0g n ASN 679 Ca 0.00 -2.83 -0.01 0.00 -0.60 0.00 0.00 54.58 51.14 3g0g n ASN 679 Cb 0.00 -0.40 0.12 0.00 -0.53 0.00 0.00 39.78 38.97 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 1.17 0.77 -0.87 1.20 5.85 -1.58 -2.78 115.31 119.07 3g0g h LEU 680 Ca -0.10 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.65 3g0g h LEU 680 Cb 1.49 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 42.33 3g0g h LEU 680 CO 0.10 0.50 0.57 0.44 -0.34 0.00 0.00 178.44 179.71 3g0g h ASP 681 N 0.91 0.96 0.78 1.25 3.32 -1.89 -0.80 116.42 120.94 3g0g h ASP 681 Ca 0.34 -0.02 -0.19 0.00 0.02 0.00 0.00 57.03 57.18 3g0g h ASP 681 Cb 0.13 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 3g0g h ASP 681 CO -0.16 0.68 -0.89 -0.74 -1.72 0.00 0.00 179.24 176.41 3g0g h HIS 682 N 1.13 0.11 -0.77 4.55 2.76 -1.90 0.19 115.15 121.22 3g0g h HIS 682 Ca 0.33 -0.06 0.10 0.00 -2.20 0.00 0.00 60.37 58.54 3g0g h HIS 682 Cb -0.06 -0.01 -0.07 0.00 1.55 0.00 0.00 27.41 28.81 3g0g h HIS 682 CO -0.02 0.92 0.41 1.88 -1.30 0.00 0.00 177.93 179.82 3g0g h TYR 683 N 0.03 0.74 0.01 5.26 0.05 -1.16 -2.05 116.97 119.85 3g0g h TYR 683 Ca -0.02 0.03 -0.21 0.00 0.05 0.00 0.00 58.73 58.58 3g0g h TYR 683 Cb 1.55 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 39.06 3g0g h TYR 683 CO 0.01 0.27 -0.90 0.00 -1.05 0.00 0.00 178.16 176.49 3g0g h ARG 684 N 0.68 0.24 -0.00 4.88 2.47 -0.79 -3.28 114.38 118.59 3g0g h ARG 684 Ca 0.38 -0.27 0.00 0.00 -1.26 0.00 0.00 59.98 58.83 3g0g h ARG 684 Cb 0.40 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.80 3g0g h ARG 684 CO -0.27 0.99 -0.02 0.09 0.56 0.00 0.00 179.97 181.33 3g0g n ASN 685 N -3.67 0.39 -1.69 7.04 5.03 0.65 -4.13 115.26 118.88 3g0g n ASN 685 Ca -0.04 -0.97 -0.06 0.00 0.87 0.00 0.00 54.58 54.38 3g0g n ASN 685 Cb 0.82 -0.04 0.08 0.00 -1.02 0.00 0.00 39.78 39.63 3g0g n ASN 685 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 3g0g n SER 686 N -0.77 2.68 -4.90 6.41 3.41 -0.81 -5.04 113.62 114.59 3g0g n SER 686 Ca 0.21 -3.16 -0.30 0.00 -0.26 0.00 0.00 58.87 55.36 3g0g n SER 686 Cb 0.20 -0.42 -0.04 0.00 -0.26 0.00 0.00 64.21 63.69 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 -3.28 5.08 -0.16 6.66 -4.23 -1.26 -4.77 115.64 113.67 3g0g s THR 687 Ca 0.40 0.04 0.21 0.00 -1.18 0.00 0.00 61.69 61.15 3g0g s THR 687 Cb 0.38 -3.69 0.21 0.00 1.34 0.00 0.00 72.50 70.74 3g0g s THR 687 CO -0.04 -0.17 1.62 -0.37 -0.54 0.00 0.00 174.62 175.12 3g0g h VAL 688 N 1.65 0.47 -0.74 2.29 -1.51 -1.52 -3.33 116.25 113.56 3g0g h VAL 688 Ca -0.47 -1.49 -0.01 0.00 -1.23 0.00 0.00 66.70 63.50 3g0g h VAL 688 Cb 1.18 2.09 -0.04 0.00 -2.13 0.00 0.00 31.29 32.39 3g0g h VAL 688 CO 0.68 0.25 0.42 0.24 -1.23 0.00 0.00 177.57 177.93 3g0g h MET 689 N 0.00 1.03 0.00 5.19 2.86 -1.90 -2.48 114.93 119.63 3g0g h MET 689 Ca -0.00 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 3g0g h MET 689 Cb 1.07 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.52 3g0g h MET 689 CO 0.03 0.76 0.00 -1.13 1.06 0.00 0.00 176.91 177.63 3g0g n SER 690 N -4.47 0.00 -0.61 1.22 3.41 -1.25 -1.72 113.62 110.20 3g0g n SER 690 Ca 0.07 -0.35 0.07 0.00 -0.26 0.00 0.00 58.87 58.40 3g0g n SER 690 Cb 0.08 -0.15 0.18 0.00 -0.26 0.00 0.00 64.21 64.07 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 -1.15 2.70 -0.26 4.33 1.74 -0.94 -4.79 116.66 118.30 3g0g n ARG 691 Ca 0.13 -2.41 0.02 0.00 -0.77 0.00 0.00 57.85 54.82 3g0g n ARG 691 Cb 0.13 -1.53 0.14 0.00 -1.02 0.00 0.00 32.46 30.18 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 1.44 1.04 -0.93 7.54 0.00 -1.34 -2.53 119.26 124.48 3g0g h ALA 692 Ca 0.00 0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.13 3g0g h ALA 692 Cb 1.06 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.69 3g0g h ALA 692 CO 0.10 0.01 0.60 1.49 0.00 0.00 0.00 179.25 181.44 3g0g h GLU 693 N 0.67 0.62 0.00 0.00 4.57 -1.86 -1.57 114.58 117.00 3g0g h GLU 693 Ca 0.36 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.50 3g0g h GLU 693 Cb 0.35 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 3g0g h GLU 693 CO -0.26 0.41 0.00 0.09 -1.18 0.00 0.00 179.01 178.07 3g0g n ASN 694 N -4.60 0.00 0.03 1.04 3.02 -0.95 -2.51 115.26 111.29 3g0g n ASN 694 Ca 0.20 0.30 0.11 0.00 -0.03 0.00 0.00 54.58 55.16 3g0g n ASN 694 Cb 0.56 -0.41 0.48 0.00 -0.61 0.00 0.00 39.78 39.81 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 -1.41 0.21 0.00 3.10 3.01 -0.59 -2.02 117.46 119.76 3g0g n PHE 695 Ca 0.06 0.07 0.00 0.00 1.01 0.00 0.00 57.45 58.59 3g0g n PHE 695 Cb 0.17 -0.61 0.00 0.00 -0.01 0.00 0.00 39.48 39.03 3g0g n PHE 695 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3g0g n LYS 696 N -1.68 0.00 -0.05 -1.08 5.02 -1.04 -2.73 118.16 116.59 3g0g n LYS 696 Ca 0.05 0.50 0.10 0.00 -2.02 0.00 0.00 58.31 56.94 3g0g n LYS 696 Cb 0.29 -1.50 0.12 0.00 -0.02 0.00 0.00 35.03 33.91 3g0g n LYS 696 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3g0g n GLN 697 N -1.50 1.95 -3.94 1.97 6.02 -0.86 -4.98 117.38 116.04 3g0g n GLN 697 Ca 0.00 -1.83 -0.09 0.00 -0.01 0.00 0.00 57.00 55.07 3g0g n GLN 697 Cb 0.00 -1.40 -0.08 0.00 1.02 0.00 0.00 30.24 29.78 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 -1.56 0.11 -0.31 5.09 -7.23 -1.11 -4.91 120.40 110.49 3g0g s VAL 698 Ca 0.26 -1.38 -0.13 0.00 -1.81 0.00 0.00 61.98 58.92 3g0g s VAL 698 Cb 0.18 -1.62 -0.03 0.00 0.56 0.00 0.00 36.38 35.46 3g0g s VAL 698 CO 0.26 -0.52 0.26 -1.61 -0.31 0.00 0.00 175.10 173.18 3g0g s GLU 699 N -3.93 3.73 -0.09 4.82 2.02 -0.85 -4.96 118.70 119.44 3g0g s GLU 699 Ca 0.12 -0.40 0.00 0.00 0.02 0.00 0.00 54.97 54.71 3g0g s GLU 699 Cb 0.05 -3.74 -0.03 0.00 0.10 0.00 0.00 34.13 30.51 3g0g s GLU 699 CO -0.05 -0.35 -0.09 -0.47 0.02 0.00 0.00 175.26 174.32 3g0g s TYR 700 N 1.84 2.89 -0.17 1.61 5.04 -1.26 -1.13 117.35 126.15 3g0g s TYR 700 Ca 0.09 -0.17 0.00 0.00 -2.44 0.00 0.00 57.07 54.55 3g0g s TYR 700 Cb -0.17 -1.76 0.01 0.00 0.35 0.00 0.00 41.96 40.40 3g0g s TYR 700 CO 0.11 0.16 -0.16 -1.17 -1.34 0.00 0.00 175.55 173.15 3g0g s LEU 701 N -0.43 2.37 -0.18 6.97 2.96 -0.48 -0.90 118.68 129.00 3g0g s LEU 701 Ca 0.06 -0.54 -0.02 0.00 -0.22 0.00 0.00 54.13 53.40 3g0g s LEU 701 Cb -0.12 -1.55 -0.01 0.00 0.50 0.00 0.00 46.19 45.01 3g0g s LEU 701 CO 0.02 0.03 -0.08 -0.22 -1.32 0.00 0.00 176.35 174.79 3g0g s LEU 702 N 1.12 2.85 -0.08 -0.68 2.96 0.19 -0.33 118.68 124.70 3g0g s LEU 702 Ca 0.00 -0.35 0.01 0.00 -0.22 0.00 0.00 54.13 53.58 3g0g s LEU 702 Cb -0.14 -1.69 0.02 0.00 0.50 0.00 0.00 46.19 44.88 3g0g s LEU 702 CO -0.06 0.07 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.32 3g0g s ILE 703 N 0.95 1.00 -0.08 6.68 1.01 -0.38 -0.76 121.20 129.63 3g0g s ILE 703 Ca -0.01 -0.35 -0.07 0.00 0.00 0.00 0.00 60.65 60.23 3g0g s ILE 703 Cb -0.15 -0.97 0.03 0.00 0.01 0.00 0.00 42.46 41.38 3g0g s ILE 703 CO 0.00 0.34 0.22 -2.28 0.00 0.00 0.00 174.94 173.22 3g0g s HIS 704 N 1.14 -0.25 0.21 3.97 2.46 -0.56 0.37 115.29 122.62 3g0g s HIS 704 Ca -0.06 0.61 -0.27 0.00 0.47 0.00 0.00 55.06 55.81 3g0g s HIS 704 Cb -0.14 0.07 -0.09 0.00 -0.13 0.00 0.00 32.58 32.29 3g0g s HIS 704 CO -0.02 -0.14 0.85 0.20 -2.47 0.00 0.00 174.74 173.17 3g0g s GLY 705 N 0.37 2.98 0.21 1.59 0.00 -1.26 -1.99 107.32 109.21 3g0g s GLY 705 Ca -0.02 0.47 -0.01 0.00 0.00 0.00 0.00 44.72 45.15 3g0g s GLY 705 CO -0.02 0.98 1.53 -0.91 0.00 0.00 0.00 173.10 174.69 3g0g h THR 706 N 3.17 1.33 -0.39 0.90 1.35 -0.94 -3.05 112.91 115.28 3g0g h THR 706 Ca -0.46 -1.81 -0.12 0.00 -0.55 0.00 0.00 66.41 63.48 3g0g h THR 706 Cb 1.20 1.80 -0.07 0.00 -1.73 0.00 0.00 68.15 69.35 3g0g h THR 706 CO 0.67 0.56 0.15 0.00 -0.25 0.00 0.00 175.52 176.64 3g0g n ALA 707 N -2.51 3.60 -2.10 6.62 0.00 -0.59 -4.66 120.51 120.87 3g0g n ALA 707 Ca -0.03 -1.20 -0.43 0.00 0.00 0.00 0.00 53.44 51.78 3g0g n ALA 707 Cb 0.60 -1.14 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.30 6.35 0.15 0.00 3.68 -1.09 -4.32 116.67 121.13 3g0g s ASP 708 Ca 0.29 1.61 0.22 0.00 2.13 0.00 0.00 52.55 56.80 3g0g s ASP 708 Cb 0.23 -2.53 -0.05 0.00 -1.45 0.00 0.00 42.92 39.11 3g0g s ASP 708 CO 0.07 -1.29 0.94 -0.90 0.13 0.00 0.00 175.17 174.13 3g0g n ASP 709 N 8.56 0.67 0.00 -0.34 5.75 -1.26 -4.11 116.55 125.82 3g0g n ASP 709 Ca 0.19 0.24 0.00 0.00 -0.01 0.00 0.00 54.79 55.21 3g0g n ASP 709 Cb 0.45 0.75 0.00 0.00 -1.03 0.00 0.00 41.12 41.29 3g0g n ASP 709 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 3g0g n ASN 710 N -2.55 0.00 -4.48 -1.12 4.05 -1.26 -4.69 115.26 105.20 3g0g n ASN 710 Ca -0.01 0.31 -0.42 0.00 0.45 0.00 0.00 54.58 54.91 3g0g n ASN 710 Cb 0.55 -0.36 -0.10 0.00 1.23 0.00 0.00 39.78 41.10 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 -0.71 5.25 0.54 3.44 1.01 -1.26 -4.80 120.40 123.86 3g0g s VAL 711 Ca 0.00 -0.51 -0.20 0.00 0.00 0.00 0.00 61.98 61.27 3g0g s VAL 711 Cb 0.00 -3.89 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 3g0g s VAL 711 CO 0.00 -0.24 1.15 -1.00 0.00 0.00 0.00 175.10 175.01 3g0g s HIS 712 N 1.74 2.63 0.41 5.22 3.76 -1.26 -4.71 115.29 123.08 3g0g s HIS 712 Ca 0.06 1.53 0.12 0.00 -0.15 0.00 0.00 55.06 56.63 3g0g s HIS 712 Cb -0.18 -3.35 0.96 0.00 1.11 0.00 0.00 32.58 31.12 3g0g s HIS 712 CO 0.10 -1.71 1.95 0.35 -0.85 0.00 0.00 174.74 174.58 3g0g h PHE 713 N 1.24 0.55 -0.53 1.40 3.57 -1.79 -1.73 116.94 119.65 3g0g h PHE 713 Ca -0.50 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.09 3g0g h PHE 713 Cb 1.27 -0.18 -0.08 0.00 2.79 0.00 0.00 35.95 39.75 3g0g h PHE 713 CO 0.50 0.25 -0.23 0.94 -2.23 0.00 0.00 178.31 177.54 3g0g n GLN 714 N -4.48 -0.15 -0.20 1.11 7.27 -1.26 -0.90 117.38 118.77 3g0g n GLN 714 Ca 0.12 0.80 0.01 0.00 0.07 0.00 0.00 57.00 58.00 3g0g n GLN 714 Cb 0.40 -1.19 0.10 0.00 2.41 0.00 0.00 30.24 31.96 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 0.14 0.03 3.69 4.20 -1.64 0.13 115.11 121.65 3g0g h GLN 715 Ca 0.16 -0.01 -0.22 0.00 0.06 0.00 0.00 58.65 58.64 3g0g h GLN 715 Cb 0.29 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 3g0g h GLN 715 CO -0.51 0.09 -0.98 0.77 -0.67 0.00 0.00 178.83 177.53 3g0g h SER 716 N 0.14 0.32 -0.66 1.46 0.02 -1.35 -2.91 113.55 110.57 3g0g h SER 716 Ca 0.31 -0.29 0.11 0.00 -0.84 0.00 0.00 61.79 61.09 3g0g h SER 716 Cb 0.50 -0.10 -0.08 0.00 0.14 0.00 0.00 62.40 62.86 3g0g h SER 716 CO -0.49 1.12 0.24 0.00 -1.14 0.00 0.00 176.83 176.56 3g0g h ALA 717 N 0.85 0.87 0.00 3.77 0.00 -0.10 0.22 119.26 124.88 3g0g h ALA 717 Ca -0.07 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3g0g h ALA 717 Cb 1.64 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 3g0g h ALA 717 CO 0.15 -0.21 -0.28 1.96 0.00 0.00 0.00 179.25 180.87 3g0g h GLN 718 N 0.41 0.00 -0.01 0.00 1.08 -0.78 -1.06 115.11 114.74 3g0g h GLN 718 Ca 0.35 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.54 3g0g h GLN 718 Cb 0.47 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.90 3g0g h GLN 718 CO -0.35 0.28 -0.01 0.82 -0.95 0.00 0.00 178.83 178.62 3g0g h ILE 719 N 0.00 1.40 -0.11 2.54 2.04 -1.05 -2.87 117.51 119.47 3g0g h ILE 719 Ca -0.00 -1.19 0.01 0.00 1.00 0.00 0.00 64.86 64.67 3g0g h ILE 719 Cb 0.77 2.20 -0.01 0.00 -0.74 0.00 0.00 36.82 39.04 3g0g h ILE 719 CO 0.04 0.31 0.06 0.77 0.00 0.00 0.00 178.15 179.33 3g0g h SER 720 N -0.48 0.09 -0.84 1.72 4.64 -0.83 -0.56 113.55 117.29 3g0g h SER 720 Ca 0.00 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.45 3g0g h SER 720 Cb 0.51 -0.01 -0.09 0.00 -0.31 0.00 0.00 62.40 62.50 3g0g h SER 720 CO 0.00 0.07 0.45 0.50 -0.87 0.00 0.00 176.83 176.98 3g0g h LYS 721 N 0.12 0.67 -0.04 4.77 3.64 -1.30 -0.60 116.57 123.83 3g0g h LYS 721 Ca 0.04 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.27 3g0g h LYS 721 Cb 0.00 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 3g0g h LYS 721 CO -0.03 0.44 -0.52 0.00 -2.27 0.00 0.00 179.45 177.07 3g0g h ALA 722 N 1.52 1.07 -0.16 5.00 0.00 -1.19 0.35 119.26 125.84 3g0g h ALA 722 Ca 0.44 -0.48 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 3g0g h ALA 722 Cb 0.54 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3g0g h ALA 722 CO -0.32 0.66 -0.56 -0.07 0.00 0.00 0.00 179.25 178.96 3g0g h LEU 723 N 0.08 0.56 -0.33 0.00 3.38 -0.01 -3.02 115.31 115.97 3g0g h LEU 723 Ca -0.00 -0.30 -0.10 0.00 0.09 0.00 0.00 57.88 57.57 3g0g h LEU 723 Cb 0.95 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 3g0g h LEU 723 CO 0.07 1.00 -0.17 0.58 0.09 0.00 0.00 178.44 180.02 3g0g h VAL 724 N 0.38 1.29 0.00 1.22 2.07 -0.98 0.53 116.25 120.76 3g0g h VAL 724 Ca 0.00 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.24 3g0g h VAL 724 Cb 1.10 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 3g0g h VAL 724 CO 0.10 0.42 0.00 0.44 0.02 0.00 0.00 177.57 178.55 3g0g h ASP 725 N 0.47 0.00 -0.04 0.57 3.45 -0.80 -1.51 116.42 118.56 3g0g h ASP 725 Ca 0.07 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.53 3g0g h ASP 725 Cb 0.70 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.47 3g0g h ASP 725 CO 0.05 0.00 0.00 1.33 -1.57 0.00 0.00 179.24 179.05 3g0g n VAL 726 N -2.70 0.60 -2.52 -1.35 0.24 -1.17 -5.02 118.33 106.42 3g0g n VAL 726 Ca -0.02 -0.80 -0.03 0.00 -2.04 0.00 0.00 64.34 61.45 3g0g n VAL 726 Cb 0.07 0.72 0.01 0.00 -1.47 0.00 0.00 33.84 33.17 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 -0.13 0.63 3.68 7.63 0.00 -0.57 -4.98 105.19 111.45 3g0g n GLY 727 Ca 0.02 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.83 5.28 0.27 1.61 1.01 0.11 -5.03 120.40 120.81 3g0g s VAL 728 Ca 0.06 0.49 -0.25 0.00 0.00 0.00 0.00 61.98 62.28 3g0g s VAL 728 Cb -0.03 -3.63 -0.09 0.00 0.00 0.00 0.00 36.38 32.63 3g0g s VAL 728 CO 0.08 0.31 0.88 -0.62 0.00 0.00 0.00 175.10 175.75 3g0g s ASP 729 N 0.91 7.33 0.35 3.32 3.68 -1.26 -4.47 116.67 126.54 3g0g s ASP 729 Ca 0.14 1.74 -0.16 0.00 2.13 0.00 0.00 52.55 56.40 3g0g s ASP 729 Cb -0.14 -2.54 0.04 0.00 -1.45 0.00 0.00 42.92 38.83 3g0g s ASP 729 CO 0.06 0.02 0.75 0.72 0.13 0.00 0.00 175.17 176.85 3g0g s PHE 730 N -1.48 0.09 0.07 -5.34 -0.12 -1.26 -4.75 117.98 105.18 3g0g s PHE 730 Ca 0.46 -0.68 0.10 0.00 -0.05 0.00 0.00 56.93 56.75 3g0g s PHE 730 Cb -0.20 0.75 -0.03 0.00 -0.63 0.00 0.00 43.02 42.92 3g0g s PHE 730 CO 0.25 -1.46 -0.26 -0.65 -0.05 0.00 0.00 175.22 173.05 3g0g s GLN 731 N -2.79 1.67 0.06 1.99 -0.21 -0.07 -5.02 119.66 115.29 3g0g s GLN 731 Ca 0.15 -1.16 0.02 0.00 0.02 0.00 0.00 55.36 54.40 3g0g s GLN 731 Cb -0.05 -1.92 -0.03 0.00 1.00 0.00 0.00 33.01 32.01 3g0g s GLN 731 CO 0.11 0.49 -0.08 0.00 -2.12 0.00 0.00 175.29 173.69 3g0g s ALA 732 N -0.87 0.71 -0.06 6.09 0.00 -1.26 -0.64 121.76 125.72 3g0g s ALA 732 Ca 0.12 -0.95 -0.03 0.00 0.00 0.00 0.00 51.96 51.10 3g0g s ALA 732 Cb -0.10 0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.14 3g0g s ALA 732 CO 0.03 -0.08 0.14 1.41 0.00 0.00 0.00 175.76 177.26 3g0g s MET 733 N -2.28 0.09 0.05 0.00 1.75 0.06 -4.93 119.30 114.04 3g0g s MET 733 Ca -0.03 0.36 0.03 0.00 -1.25 0.00 0.00 55.69 54.80 3g0g s MET 733 Cb -0.05 -0.18 -0.04 0.00 2.84 0.00 0.00 34.83 37.40 3g0g s MET 733 CO -0.01 -0.16 0.02 1.67 -0.65 0.00 0.00 175.02 175.89 3g0g s TRP 734 N 1.16 3.09 -0.22 4.11 -2.14 -1.26 -1.50 118.94 122.18 3g0g s TRP 734 Ca -0.09 0.05 0.01 0.00 2.66 0.00 0.00 56.10 58.73 3g0g s TRP 734 Cb -0.12 -1.61 0.03 0.00 -3.10 0.00 0.00 33.47 28.67 3g0g s TRP 734 CO -0.06 0.49 -0.14 0.71 -2.66 0.00 0.00 176.95 175.29 3g0g s TYR 735 N -1.25 2.98 0.06 1.66 2.02 -0.84 -4.95 117.35 117.04 3g0g s TYR 735 Ca 0.24 -1.78 -0.31 0.00 -0.37 0.00 0.00 57.07 54.86 3g0g s TYR 735 Cb -0.12 -1.96 -0.08 0.00 -0.40 0.00 0.00 41.96 39.40 3g0g s TYR 735 CO 0.16 -0.80 1.71 0.99 -1.57 0.00 0.00 175.55 176.05 3g0g s THR 736 N 1.25 3.00 0.00 -0.71 2.01 -1.26 -0.72 115.64 119.21 3g0g s THR 736 Ca 0.00 0.39 0.00 0.00 0.31 0.00 0.00 61.69 62.39 3g0g s THR 736 Cb -0.16 -3.25 0.00 0.00 0.01 0.00 0.00 72.50 69.10 3g0g s THR 736 CO -0.09 -0.01 0.00 0.47 -0.69 0.00 0.00 174.62 174.31 3g0g n ASP 737 N 5.96 -0.79 -4.82 3.53 10.43 -1.26 -4.87 116.55 124.72 3g0g n ASP 737 Ca 0.17 0.00 -0.33 0.00 2.57 0.00 0.00 54.79 57.20 3g0g n ASP 737 Cb 0.40 -1.97 -0.06 0.00 1.84 0.00 0.00 41.12 41.33 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 -0.85 4.15 0.00 -1.24 0.41 -1.18 -4.50 118.70 115.50 3g0g s GLU 738 Ca 0.00 1.10 0.00 0.00 -0.41 0.00 0.00 54.97 55.66 3g0g s GLU 738 Cb 0.00 -2.17 0.00 0.00 -1.78 0.00 0.00 34.13 30.18 3g0g s GLU 738 CO 0.00 -0.10 0.00 -0.40 -0.49 0.00 0.00 175.26 174.27 3g0g n ASP 739 N -0.84 1.03 0.10 -0.19 3.85 -1.26 -1.54 116.55 117.70 3g0g n ASP 739 Ca 0.07 -0.10 0.19 0.00 -0.71 0.00 0.00 54.79 54.24 3g0g n ASP 739 Cb 0.54 0.00 0.75 0.00 -1.35 0.00 0.00 41.12 41.06 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 0.05 0.00 0.00 2.11 -0.00 -1.91 -0.90 115.15 114.50 3g0g h HIS 740 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 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 -0.47 0.41 -0.00 0.00 0.00 177.93 177.87 3g0g n GLY 741 N -1.52 -1.37 3.79 5.26 0.00 -1.26 -4.95 105.19 105.14 3g0g n GLY 741 Ca 0.06 -0.26 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 3g0g n GLY 741 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3g0g n ILE 742 N -1.79 -1.09 0.69 -0.61 5.41 -0.34 -4.81 119.36 116.81 3g0g n ILE 742 Ca 0.05 -0.34 0.08 0.00 1.00 0.00 0.00 62.75 63.54 3g0g n ILE 742 Cb 0.38 -0.97 0.02 0.00 -0.71 0.00 0.00 39.64 38.36 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 -3.38 2.93 -1.59 -1.39 0.00 -1.26 -3.19 120.51 112.64 3g0g n ALA 743 Ca -0.14 -0.56 -0.43 0.00 0.00 0.00 0.00 53.44 52.30 3g0g n ALA 743 Cb 0.40 -0.55 -0.00 0.00 0.00 0.00 0.00 19.45 19.29 3g0g n ALA 743 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3g0g n SER 744 N 0.20 1.12 -0.12 0.00 7.64 -1.26 -4.71 113.62 116.48 3g0g n SER 744 Ca 0.07 1.11 -0.06 0.00 1.01 0.00 0.00 58.87 61.01 3g0g n SER 744 Cb 0.35 -1.30 0.01 0.00 -1.01 0.00 0.00 64.21 62.26 3g0g n SER 744 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 3g0g h SER 745 N 1.75 -0.81 0.36 6.43 0.87 -1.99 0.36 113.55 120.53 3g0g h SER 745 Ca -0.41 0.17 -0.18 0.00 -1.23 0.00 0.00 61.79 60.14 3g0g h SER 745 Cb 1.34 0.41 -0.01 0.00 -0.44 0.00 0.00 62.40 63.71 3g0g h SER 745 CO 0.59 -0.26 -0.75 0.71 -0.53 0.00 0.00 176.83 176.59 3g0g h THR 746 N -0.16 1.41 -0.17 2.23 1.35 -1.97 -2.50 112.91 113.10 3g0g h THR 746 Ca 0.20 -2.23 -0.04 0.00 -0.55 0.00 0.00 66.41 63.78 3g0g h THR 746 Cb 0.47 2.19 -0.01 0.00 -1.73 0.00 0.00 68.15 69.07 3g0g h THR 746 CO -0.51 0.66 -0.05 0.00 -0.25 0.00 0.00 175.52 175.37 3g0g h ALA 747 N 0.99 0.23 -0.80 6.62 0.00 -1.78 -1.12 119.26 123.40 3g0g h ALA 747 Ca -0.03 -0.25 0.10 0.00 0.00 0.00 0.00 54.91 54.73 3g0g h ALA 747 Cb 1.32 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.98 3g0g h ALA 747 CO 0.12 0.01 0.44 1.25 0.00 0.00 0.00 179.25 181.07 3g0g h HIS 748 N 0.03 0.79 -0.25 0.00 2.76 -0.22 0.53 115.15 118.79 3g0g h HIS 748 Ca 0.04 0.03 -0.14 0.00 -2.20 0.00 0.00 60.37 58.10 3g0g h HIS 748 Cb 0.49 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 29.22 3g0g h HIS 748 CO 0.05 0.29 -0.39 1.96 -1.30 0.00 0.00 177.93 178.55 3g0g h GLN 749 N 0.72 0.71 -0.55 5.26 4.20 -1.39 -2.93 115.11 121.14 3g0g h GLN 749 Ca 0.40 -0.43 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 3g0g h GLN 749 Cb 0.41 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 3g0g h GLN 749 CO -0.27 1.05 0.34 1.25 -0.67 0.00 0.00 178.83 180.53 3g0g h HIS 750 N 0.44 0.71 -0.09 2.96 2.76 -0.32 -1.21 115.15 120.40 3g0g h HIS 750 Ca 0.02 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.19 3g0g h HIS 750 Cb 0.98 -0.24 -0.00 0.00 1.55 0.00 0.00 27.41 29.70 3g0g h HIS 750 CO 0.08 0.48 0.01 0.97 -1.30 0.00 0.00 177.93 178.17 3g0g h ILE 751 N 0.74 1.22 -0.79 6.26 2.10 -0.95 -0.93 117.51 125.15 3g0g h ILE 751 Ca 0.20 -0.67 -0.03 0.00 1.08 0.00 0.00 64.86 65.44 3g0g h ILE 751 Cb -0.04 1.49 -0.04 0.00 -1.09 0.00 0.00 36.82 37.14 3g0g h ILE 751 CO -0.04 0.19 0.38 1.88 -1.08 0.00 0.00 178.15 179.49 3g0g h TYR 752 N -0.08 1.12 -0.81 2.19 -1.99 -1.46 0.13 116.97 116.08 3g0g h TYR 752 Ca 0.03 -0.05 0.04 0.00 2.00 0.00 0.00 58.73 60.75 3g0g h TYR 752 Cb 0.29 -0.35 -0.05 0.00 2.00 0.00 0.00 36.73 38.61 3g0g h TYR 752 CO 0.02 0.81 0.51 1.15 -0.00 0.00 0.00 178.16 180.65 3g0g h THR 753 N 1.12 1.08 -0.06 -2.88 2.02 -1.07 -1.87 112.91 111.25 3g0g h THR 753 Ca 0.27 -0.33 -0.17 0.00 0.77 0.00 0.00 66.41 66.95 3g0g h THR 753 Cb 0.11 0.03 0.01 0.00 -1.74 0.00 0.00 68.15 66.56 3g0g h THR 753 CO -0.04 0.18 -0.63 -0.74 0.37 0.00 0.00 175.52 174.66 3g0g h HIS 754 N 0.96 0.76 -0.33 3.16 -0.00 -0.32 -3.02 115.15 116.36 3g0g h HIS 754 Ca 0.34 -0.36 -0.02 0.00 -0.00 0.00 0.00 60.37 60.32 3g0g h HIS 754 Cb 0.08 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 27.37 3g0g h HIS 754 CO -0.03 1.17 0.11 0.52 -0.00 0.00 0.00 177.93 179.69 3g0g h MET 755 N 0.13 0.46 0.33 5.26 2.07 -0.69 -2.80 114.93 119.70 3g0g h MET 755 Ca -0.06 -0.06 -0.02 0.00 -2.07 0.00 0.00 59.70 57.49 3g0g h MET 755 Cb 1.29 -0.09 0.00 0.00 -1.87 0.00 0.00 31.60 30.94 3g0g h MET 755 CO 0.13 0.41 -0.16 0.77 1.07 0.00 0.00 176.91 179.12 3g0g h SER 756 N 0.46 -0.38 -0.88 1.22 0.02 -1.33 -2.30 113.55 110.36 3g0g h SER 756 Ca 0.11 -0.12 0.11 0.00 -0.84 0.00 0.00 61.79 61.05 3g0g h SER 756 Cb 0.14 0.10 -0.08 0.00 0.14 0.00 0.00 62.40 62.70 3g0g h SER 756 CO -0.01 -0.09 0.51 0.45 -1.14 0.00 0.00 176.83 176.56 3g0g h HIS 757 N -0.69 0.93 -0.69 3.45 3.86 -1.44 0.10 115.15 120.68 3g0g h HIS 757 Ca -0.05 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.17 3g0g h HIS 757 Cb 0.48 -0.29 -0.03 0.00 1.06 0.00 0.00 27.41 28.63 3g0g h HIS 757 CO 0.00 0.36 0.35 0.35 0.86 0.00 0.00 177.93 179.85 3g0g h PHE 758 N 0.83 0.97 0.15 2.45 3.57 -1.47 0.52 116.94 123.96 3g0g h PHE 758 Ca 0.43 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.89 3g0g h PHE 758 Cb 0.43 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.86 3g0g h PHE 758 CO -0.05 0.71 -0.07 0.82 -2.23 0.00 0.00 178.31 177.49 3g0g h ILE 759 N 0.95 0.98 -0.57 1.41 1.08 -0.63 -0.54 117.51 120.18 3g0g h ILE 759 Ca 0.24 -0.57 0.13 0.00 -0.39 0.00 0.00 64.86 64.26 3g0g h ILE 759 Cb 0.09 1.33 -0.03 0.00 -3.07 0.00 0.00 36.82 35.14 3g0g h ILE 759 CO -0.03 0.13 0.39 0.11 -0.69 0.00 0.00 178.15 178.06 3g0g h LYS 760 N -0.48 0.20 -0.15 2.37 1.57 -0.72 0.25 116.57 119.61 3g0g h LYS 760 Ca -0.02 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.62 3g0g h LYS 760 Cb 0.37 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.64 3g0g h LYS 760 CO 0.03 0.13 -0.40 0.37 -0.57 0.00 0.00 179.45 179.02 3g0g h GLN 761 N 0.21 0.53 -0.26 3.15 4.15 -0.73 0.76 115.11 122.91 3g0g h GLN 761 Ca 0.27 -0.37 -0.11 0.00 0.77 0.00 0.00 58.65 59.21 3g0g h GLN 761 Cb 0.78 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.52 3g0g h GLN 761 CO -0.05 0.99 -0.29 0.00 -1.93 0.00 0.00 178.83 177.55 3g0g n PHE 763 N -4.09 0.79 -3.84 0.00 3.72 0.69 -4.96 117.46 109.77 3g0g n PHE 763 Ca -0.01 -0.40 -0.25 0.00 -0.05 0.00 0.00 57.45 56.74 3g0g n PHE 763 Cb 0.44 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.99 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 1.30 -2.18 -4.86 4.37 7.64 -0.82 -4.99 113.62 114.09 3g0g n SER 764 Ca 0.21 -0.85 -0.37 0.00 1.01 0.00 0.00 58.87 58.87 3g0g n SER 764 Cb 0.52 -3.76 -0.06 0.00 -1.01 0.00 0.00 64.21 59.90 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 4.37 0.00 -3.43 1.43 0.26 -5.02 118.68 109.35 3g0g s LEU 765 Ca 0.23 0.46 0.01 0.00 -1.03 0.00 0.00 54.13 53.80 3g0g s LEU 765 Cb -0.12 -2.10 0.04 0.00 0.03 0.00 0.00 46.19 44.05 3g0g s LEU 765 CO 0.84 0.38 0.54 -0.81 0.23 0.00 0.00 176.35 177.52