#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g0b s THR 42 N 0.00 2.63 -0.60 0.58 -4.23 -1.26 -0.13 115.64 112.62 3g0b s THR 42 Ca 0.00 -1.72 -0.27 0.00 -1.18 0.00 0.00 61.69 58.52 3g0b s THR 42 Cb 0.00 -2.96 0.03 0.00 1.34 0.00 0.00 72.50 70.92 3g0b s THR 42 CO 0.00 -0.10 1.13 -0.47 -0.54 0.00 0.00 174.62 174.64 3g0b s TYR 43 N -2.52 2.61 0.67 3.99 5.04 -1.26 -4.87 117.35 121.01 3g0b s TYR 43 Ca 0.39 0.19 -0.03 0.00 -2.44 0.00 0.00 57.07 55.18 3g0b s TYR 43 Cb 0.01 -4.41 0.07 0.00 0.35 0.00 0.00 41.96 37.97 3g0b s TYR 43 CO 0.22 -1.61 0.95 0.95 -1.34 0.00 0.00 175.55 174.72 3g0b s THR 44 N 4.78 2.37 0.18 4.34 -4.23 -1.26 -3.99 115.64 117.82 3g0b s THR 44 Ca 0.38 -0.44 -0.13 0.00 -1.18 0.00 0.00 61.69 60.32 3g0b s THR 44 Cb -0.09 -2.92 0.09 0.00 1.34 0.00 0.00 72.50 70.92 3g0b s THR 44 CO 0.22 0.00 1.81 0.25 -0.54 0.00 0.00 174.62 176.35 3g0b h LEU 45 N -0.42 0.74 -1.11 4.79 5.85 -1.95 -2.52 115.31 120.70 3g0b h LEU 45 Ca -0.42 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.28 3g0b h LEU 45 Cb 1.30 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 42.08 3g0b h LEU 45 CO 0.53 0.60 0.61 0.74 -0.34 0.00 0.00 178.44 180.57 3g0b h THR 46 N 0.82 1.10 -0.66 1.05 2.02 -1.98 -0.00 112.91 115.26 3g0b h THR 46 Ca 0.22 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 3g0b h THR 46 Cb 0.01 -0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.29 3g0b h THR 46 CO -0.04 0.20 0.36 0.44 0.37 0.00 0.00 175.52 176.85 3g0b h ASP 47 N 1.10 0.82 -0.55 4.18 3.32 -1.84 0.16 116.42 123.61 3g0b h ASP 47 Ca 0.39 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.31 3g0b h ASP 47 Cb 0.14 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3g0b h ASP 47 CO -0.14 0.68 0.21 0.22 -1.72 0.00 0.00 179.24 178.49 3g0b h TYR 48 N 0.90 0.85 0.00 4.55 3.20 -1.01 -1.61 116.97 123.85 3g0b h TYR 48 Ca 0.23 -0.07 -0.18 0.00 3.14 0.00 0.00 58.73 61.85 3g0b h TYR 48 Cb 0.04 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.03 3g0b h TYR 48 CO -0.01 0.70 -0.86 -0.07 -1.64 0.00 0.00 178.16 176.28 3g0b h LEU 49 N 0.75 0.00 -2.11 2.82 3.38 -0.53 -3.24 115.31 116.38 3g0b h LEU 49 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3g0b h LEU 49 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3g0b h LEU 49 CO -0.01 0.86 0.00 0.29 0.09 0.00 0.00 178.44 179.67 3g0b n LYS 50 N -3.46 2.02 -3.64 1.13 4.76 0.53 -4.98 118.16 114.52 3g0b n LYS 50 Ca -0.00 -1.90 -0.22 0.00 -2.87 0.00 0.00 58.31 53.31 3g0b n LYS 50 Cb 0.84 -1.39 0.04 0.00 -1.84 0.00 0.00 35.03 32.68 3g0b n LYS 50 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3g0b n ASN 51 N 1.10 -2.63 -0.08 4.39 4.13 -0.68 -4.91 115.26 116.58 3g0b n ASN 51 Ca 0.14 -0.84 -0.11 0.00 1.68 0.00 0.00 54.58 55.45 3g0b n ASN 51 Cb 0.49 -4.08 0.03 0.00 -1.54 0.00 0.00 39.78 34.69 3g0b n ASN 51 CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 3g0b h THR 52 N -1.77 1.28 -3.54 3.41 2.02 -1.64 -3.36 112.91 109.31 3g0b h THR 52 Ca -0.62 -1.56 -0.73 0.00 0.77 0.00 0.00 66.41 64.28 3g0b h THR 52 Cb 1.35 1.43 -0.31 0.00 -1.74 0.00 0.00 68.15 68.88 3g0b h THR 52 CO 0.53 0.51 -0.26 -0.31 0.37 0.00 0.00 175.52 176.36 3g0b s TYR 53 N -4.35 3.51 -0.03 3.16 2.02 -1.26 -5.06 117.35 115.34 3g0b s TYR 53 Ca -0.10 -2.28 -0.22 0.00 -0.37 0.00 0.00 57.07 54.10 3g0b s TYR 53 Cb 0.12 -3.44 -0.05 0.00 -0.40 0.00 0.00 41.96 38.19 3g0b s TYR 53 CO 0.86 -0.93 0.65 0.50 -1.57 0.00 0.00 175.55 175.06 3g0b s ARG 54 N 0.45 4.39 -0.12 -0.62 3.52 -1.26 -5.03 118.95 120.27 3g0b s ARG 54 Ca 0.14 0.81 -0.29 0.00 -0.13 0.00 0.00 55.73 56.25 3g0b s ARG 54 Cb -0.20 -3.39 -0.01 0.00 -1.56 0.00 0.00 34.95 29.80 3g0b s ARG 54 CO -0.04 0.24 1.01 -0.51 -0.81 0.00 0.00 175.30 175.19 3g0b s LEU 55 N 0.21 4.23 0.16 -0.88 1.43 -1.26 -4.73 118.68 117.84 3g0b s LEU 55 Ca 0.34 1.51 -0.26 0.00 -1.03 0.00 0.00 54.13 54.69 3g0b s LEU 55 Cb -0.18 -3.55 -0.08 0.00 0.03 0.00 0.00 46.19 42.41 3g0b s LEU 55 CO 0.18 -0.47 0.80 -0.54 0.23 0.00 0.00 176.35 176.54 3g0b s LYS 56 N 2.16 4.60 0.33 1.70 1.02 -1.26 -5.08 119.74 123.21 3g0b s LYS 56 Ca 0.48 1.19 0.08 0.00 0.02 0.00 0.00 55.97 57.74 3g0b s LYS 56 Cb -0.18 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.82 3g0b s LYS 56 CO 0.16 0.53 0.17 -0.51 -0.92 0.00 0.00 175.35 174.79 3g0b s LEU 57 N -1.03 3.35 -0.62 3.17 1.02 -1.26 -4.88 118.68 118.44 3g0b s LEU 57 Ca 0.37 -0.69 0.05 0.00 0.02 0.00 0.00 54.13 53.88 3g0b s LEU 57 Cb -0.23 -1.86 0.18 0.00 0.02 0.00 0.00 46.19 44.30 3g0b s LEU 57 CO 0.27 -0.29 0.49 0.00 0.02 0.00 0.00 176.35 176.83 3g0b n TYR 58 N -1.19 2.14 -2.78 0.29 4.19 -1.26 -4.97 117.16 113.58 3g0b n TYR 58 Ca -0.03 -4.03 -0.43 0.00 3.31 0.00 0.00 57.90 56.73 3g0b n TYR 58 Cb 0.61 -0.39 -0.04 0.00 0.49 0.00 0.00 39.34 40.01 3g0b n TYR 58 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 3g0b s SER 59 N -1.20 6.40 0.44 2.98 0.15 -1.26 -5.01 113.70 116.20 3g0b s SER 59 Ca 0.29 -0.16 0.07 0.00 0.70 0.00 0.00 55.95 56.85 3g0b s SER 59 Cb 0.01 -2.46 -0.03 0.00 -1.71 0.00 0.00 66.02 61.82 3g0b s SER 59 CO -0.16 -1.24 0.26 -1.48 1.20 0.00 0.00 173.24 171.82 3g0b s LEU 60 N 4.11 3.10 -0.10 3.45 0.05 -1.26 -4.59 118.68 123.45 3g0b s LEU 60 Ca 0.34 -1.03 -0.04 0.00 0.05 0.00 0.00 54.13 53.45 3g0b s LEU 60 Cb -0.11 -1.55 0.05 0.00 -2.05 0.00 0.00 46.19 42.54 3g0b s LEU 60 CO 0.22 -0.67 0.19 0.00 -0.55 0.00 0.00 176.35 175.53 3g0b s ARG 61 N -4.02 0.07 -0.74 1.48 1.70 -1.22 -4.93 118.95 111.28 3g0b s ARG 61 Ca 0.41 0.57 -0.26 0.00 -0.47 0.00 0.00 55.73 55.98 3g0b s ARG 61 Cb 0.01 -0.31 -0.00 0.00 -0.57 0.00 0.00 34.95 34.08 3g0b s ARG 61 CO 0.23 -0.33 1.66 -1.58 -1.08 0.00 0.00 175.30 174.20 3g0b s TRP 62 N 2.32 1.96 0.29 5.89 0.52 -1.26 -2.74 118.94 125.92 3g0b s TRP 62 Ca 0.03 0.33 0.05 0.00 0.02 0.00 0.00 56.10 56.53 3g0b s TRP 62 Cb -0.12 -4.31 0.45 0.00 -1.15 0.00 0.00 33.47 28.34 3g0b s TRP 62 CO -0.07 -2.11 1.71 -0.84 0.02 0.00 0.00 176.95 175.66 3g0b h ILE 63 N 6.69 1.29 -1.01 2.03 3.07 -1.89 -3.44 117.51 124.25 3g0b h ILE 63 Ca -0.16 -1.43 0.00 0.00 1.55 0.00 0.00 64.86 64.83 3g0b h ILE 63 Cb 1.09 1.58 0.00 0.00 -0.27 0.00 0.00 36.82 39.22 3g0b h ILE 63 CO 1.26 0.43 0.00 -1.54 -1.05 0.00 0.00 178.15 177.25 3g0b n SER 64 N -4.06 0.00 -0.53 2.16 3.41 -1.23 -4.96 113.62 108.40 3g0b n SER 64 Ca -0.01 -0.01 0.13 0.00 -0.26 0.00 0.00 58.87 58.73 3g0b n SER 64 Cb 0.45 0.00 0.47 0.00 -0.26 0.00 0.00 64.21 64.88 3g0b n SER 64 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3g0b n ASP 65 N -0.02 1.65 0.00 4.04 4.64 -1.26 -2.78 116.55 122.82 3g0b n ASP 65 Ca 0.00 -1.56 0.00 0.00 -1.38 0.00 0.00 54.79 51.85 3g0b n ASP 65 Cb 0.00 -0.02 0.00 0.00 -1.04 0.00 0.00 41.12 40.06 3g0b n ASP 65 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 3g0b n HIS 66 N 0.29 0.00 -4.28 -0.67 8.25 -1.26 -4.63 115.22 112.92 3g0b n HIS 66 Ca 0.18 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.49 3g0b n HIS 66 Cb 0.37 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.38 3g0b n HIS 66 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3g0b s GLU 67 N -1.39 1.16 0.31 -0.41 2.02 -1.26 -1.64 118.70 117.49 3g0b s GLU 67 Ca 0.00 -1.54 -0.01 0.00 0.02 0.00 0.00 54.97 53.44 3g0b s GLU 67 Cb 0.00 -0.57 0.01 0.00 0.10 0.00 0.00 34.13 33.66 3g0b s GLU 67 CO 0.00 -0.01 0.42 2.48 0.02 0.00 0.00 175.26 178.16 3g0b n TYR 68 N -0.28 -1.29 -4.39 1.61 0.18 -0.23 -2.95 117.16 109.81 3g0b n TYR 68 Ca -0.08 -2.09 -0.26 0.00 1.88 0.00 0.00 57.90 57.35 3g0b n TYR 68 Cb 0.62 0.47 -0.12 0.00 -0.38 0.00 0.00 39.34 39.93 3g0b n TYR 68 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3g0b s LEU 69 N 0.00 2.40 -0.17 -3.48 1.43 -1.11 -0.35 118.68 117.40 3g0b s LEU 69 Ca 0.26 -0.83 -0.08 0.00 -1.03 0.00 0.00 54.13 52.46 3g0b s LEU 69 Cb -0.01 -1.10 0.07 0.00 0.03 0.00 0.00 46.19 45.18 3g0b s LEU 69 CO 0.19 0.10 0.38 -0.47 0.23 0.00 0.00 176.35 176.78 3g0b s TYR 70 N -1.57 -0.62 -0.56 0.29 5.04 -0.73 -3.40 117.35 115.82 3g0b s TYR 70 Ca 0.17 1.28 -0.28 0.00 -2.44 0.00 0.00 57.07 55.80 3g0b s TYR 70 Cb -0.08 0.22 0.02 0.00 0.35 0.00 0.00 41.96 42.47 3g0b s TYR 70 CO 0.08 -0.38 1.27 0.21 -1.34 0.00 0.00 175.55 175.40 3g0b s LYS 71 N 1.87 3.46 -0.61 4.97 2.20 -1.26 -2.13 119.74 128.24 3g0b s LYS 71 Ca -0.06 0.38 -0.18 0.00 -0.36 0.00 0.00 55.97 55.75 3g0b s LYS 71 Cb -0.10 -4.04 0.12 0.00 -1.51 0.00 0.00 37.83 32.29 3g0b s LYS 71 CO -0.12 -1.74 0.68 -1.14 -0.36 0.00 0.00 175.35 172.67 3g0b s GLN 72 N 5.11 3.08 0.53 4.03 0.74 -0.28 -4.83 119.66 128.04 3g0b s GLN 72 Ca 0.47 -1.48 0.00 0.00 0.05 0.00 0.00 55.36 54.40 3g0b s GLN 72 Cb -0.09 -4.31 0.00 0.00 1.10 0.00 0.00 33.01 29.72 3g0b s GLN 72 CO 0.26 -1.49 0.00 -1.91 -0.55 0.00 0.00 175.29 171.60 3g0b n GLU 73 N 5.98 0.00 0.00 1.67 4.07 -1.26 -2.60 120.64 128.50 3g0b n GLU 73 Ca -0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 3g0b n GLU 73 Cb 0.42 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.80 3g0b n GLU 73 CO 0.00 0.00 0.00 0.27 -0.06 0.00 0.00 177.13 177.34 3g0b n ASN 74 N 2.33 2.88 -4.72 4.31 2.04 -1.26 -5.05 115.26 115.79 3g0b n ASN 74 Ca 0.00 0.00 -0.39 0.00 -0.44 0.00 0.00 54.58 53.75 3g0b n ASN 74 Cb 0.00 0.46 -0.05 0.00 -2.53 0.00 0.00 39.78 37.66 3g0b n ASN 74 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 3g0b s ASN 75 N -1.57 6.87 -0.19 0.53 4.22 -1.07 -4.42 114.94 119.31 3g0b s ASN 75 Ca 0.00 1.04 -0.06 0.00 -2.14 0.00 0.00 52.86 51.71 3g0b s ASN 75 Cb 0.00 -2.36 -0.03 0.00 1.28 0.00 0.00 41.25 40.14 3g0b s ASN 75 CO 0.00 -0.07 0.02 -0.63 -2.04 0.00 0.00 177.10 174.37 3g0b s ILE 76 N 0.74 4.17 0.15 0.54 1.01 -0.38 -1.13 121.20 126.30 3g0b s ILE 76 Ca 0.33 -0.24 0.09 0.00 0.00 0.00 0.00 60.65 60.83 3g0b s ILE 76 Cb -0.17 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.38 3g0b s ILE 76 CO 0.15 0.44 -0.15 -0.76 0.00 0.00 0.00 174.94 174.61 3g0b s LEU 77 N 0.82 2.78 -0.49 2.97 2.01 -0.90 -2.23 118.68 123.63 3g0b s LEU 77 Ca 0.01 -0.61 -0.17 0.00 0.01 0.00 0.00 54.13 53.38 3g0b s LEU 77 Cb -0.14 -1.54 0.07 0.00 0.01 0.00 0.00 46.19 44.59 3g0b s LEU 77 CO 0.02 0.14 0.49 0.54 1.01 0.00 0.00 176.35 178.55 3g0b s VAL 78 N -1.44 5.11 -0.02 -1.59 0.11 -0.66 -1.77 120.40 120.14 3g0b s VAL 78 Ca 0.21 -0.92 -0.23 0.00 -2.93 0.00 0.00 61.98 58.11 3g0b s VAL 78 Cb -0.09 -4.21 -0.05 0.00 -1.53 0.00 0.00 36.38 30.50 3g0b s VAL 78 CO 0.12 -0.69 0.70 -0.36 -3.33 0.00 0.00 175.10 171.54 3g0b s PHE 79 N 1.98 3.65 -0.22 1.54 0.08 0.52 -3.10 117.98 122.44 3g0b s PHE 79 Ca 0.08 1.31 -0.28 0.00 0.12 0.00 0.00 56.93 58.15 3g0b s PHE 79 Cb -0.23 -2.77 0.00 0.00 -0.57 0.00 0.00 43.02 39.46 3g0b s PHE 79 CO 0.08 0.21 1.00 1.21 -0.10 0.00 0.00 175.22 177.61 3g0b s ASN 80 N 0.30 7.07 0.26 1.36 3.04 0.28 -1.07 114.94 126.19 3g0b s ASN 80 Ca 0.36 1.33 0.02 0.00 0.04 0.00 0.00 52.86 54.61 3g0b s ASN 80 Cb -0.19 -2.52 0.34 0.00 -1.54 0.00 0.00 41.25 37.34 3g0b s ASN 80 CO 0.19 -0.61 1.67 0.00 -3.04 0.00 0.00 177.10 175.31 3g0b h ALA 81 N 7.45 1.00 -0.38 1.71 0.00 -1.63 0.44 119.26 127.85 3g0b h ALA 81 Ca -0.21 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 54.16 3g0b h ALA 81 Cb 1.08 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3g0b h ALA 81 CO 0.95 0.60 -0.32 1.49 0.00 0.00 0.00 179.25 181.96 3g0b h GLU 82 N 0.40 0.86 0.00 0.00 4.81 -1.93 -3.37 114.58 115.35 3g0b h GLU 82 Ca 0.05 -0.41 -0.04 0.00 -0.13 0.00 0.00 59.36 58.83 3g0b h GLU 82 Cb 0.79 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.16 3g0b h GLU 82 CO 0.06 1.05 -1.31 0.66 -0.73 0.00 0.00 179.01 178.74 3g0b n TYR 83 N -4.07 0.00 -0.08 0.92 4.01 -1.23 -5.02 117.16 111.68 3g0b n TYR 83 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 3g0b n TYR 83 Cb 0.50 -0.19 0.00 0.00 -0.31 0.00 0.00 39.34 39.34 3g0b n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3g0b n GLY 84 N 2.36 1.04 3.79 2.72 0.00 0.14 -5.06 105.19 110.19 3g0b n GLY 84 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 3g0b n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g0b s ASN 85 N -2.81 6.00 0.16 1.61 4.22 -1.25 -4.70 114.94 118.17 3g0b s ASN 85 Ca 0.00 1.94 -0.14 0.00 -2.14 0.00 0.00 52.86 52.52 3g0b s ASN 85 Cb 0.00 -2.56 0.02 0.00 1.28 0.00 0.00 41.25 39.99 3g0b s ASN 85 CO 0.00 -1.02 0.39 -0.94 -2.04 0.00 0.00 177.10 173.50 3g0b s SER 86 N -2.21 -0.13 0.03 3.54 1.04 -1.26 -0.55 113.70 114.15 3g0b s SER 86 Ca 0.67 -0.57 0.02 0.00 0.48 0.00 0.00 55.95 56.55 3g0b s SER 86 Cb -0.18 0.49 -0.02 0.00 0.10 0.00 0.00 66.02 66.41 3g0b s SER 86 CO 0.27 -0.93 -0.07 -0.94 0.98 0.00 0.00 173.24 172.56 3g0b s SER 87 N -2.88 0.73 0.38 7.02 1.04 -1.18 -4.97 113.70 113.83 3g0b s SER 87 Ca 0.10 -0.46 -0.27 0.00 0.48 0.00 0.00 55.95 55.79 3g0b s SER 87 Cb 0.01 0.03 -0.09 0.00 0.10 0.00 0.00 66.02 66.07 3g0b s SER 87 CO -0.05 -0.17 1.30 -0.69 0.98 0.00 0.00 173.24 174.62 3g0b s VAL 88 N -1.16 2.66 0.00 5.02 1.01 -1.26 -1.65 120.40 125.02 3g0b s VAL 88 Ca -0.09 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.51 3g0b s VAL 88 Cb -0.09 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.92 3g0b s VAL 88 CO 0.00 0.11 0.00 0.33 0.00 0.00 0.00 175.10 175.54 3g0b n PHE 89 N 0.38 0.00 -3.64 5.22 -0.00 -0.95 -4.87 117.46 113.60 3g0b n PHE 89 Ca 0.02 0.00 -0.09 0.00 -0.00 0.00 0.00 57.45 57.39 3g0b n PHE 89 Cb 0.43 0.00 -0.07 0.00 -0.00 0.00 0.00 39.48 39.84 3g0b n PHE 89 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 3g0b s LEU 90 N -1.12 -0.57 0.00 -2.13 2.96 -1.03 -4.98 118.68 111.81 3g0b s LEU 90 Ca 0.00 1.03 0.03 0.00 -0.22 0.00 0.00 54.13 54.97 3g0b s LEU 90 Cb 0.00 2.02 0.03 0.00 0.50 0.00 0.00 46.19 48.74 3g0b s LEU 90 CO 0.00 -0.17 0.27 -1.84 -1.32 0.00 0.00 176.35 173.28 3g0b n GLU 91 N 2.78 0.90 -0.01 1.98 0.28 -1.26 -1.25 120.64 124.05 3g0b n GLU 91 Ca -0.15 -2.65 0.23 0.00 -0.16 0.00 0.00 57.16 54.44 3g0b n GLU 91 Cb 0.56 0.35 0.68 0.00 1.43 0.00 0.00 31.44 34.47 3g0b n GLU 91 CO 0.00 0.00 0.00 -2.95 -0.16 0.00 0.00 177.13 174.02 3g0b h ASN 92 N 0.56 0.00 -0.69 -1.84 7.08 -1.96 -3.22 115.58 115.52 3g0b h ASN 92 Ca -0.27 0.00 -0.33 0.00 -3.08 0.00 0.00 56.30 52.62 3g0b h ASN 92 Cb 0.97 0.00 -0.22 0.00 -2.08 0.00 0.00 38.32 36.99 3g0b h ASN 92 CO 0.43 0.00 -0.69 -1.54 -2.08 0.00 0.00 177.43 173.56 3g0b n SER 93 N -3.65 -1.96 0.07 6.14 3.41 -1.26 -4.88 113.62 111.48 3g0b n SER 93 Ca 0.12 -3.09 0.00 0.00 -0.26 0.00 0.00 58.87 55.64 3g0b n SER 93 Cb 0.87 1.04 -0.05 0.00 -0.26 0.00 0.00 64.21 65.81 3g0b n SER 93 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3g0b h THR 94 N 2.80 0.69 -2.22 6.66 2.02 -1.94 -3.37 112.91 117.56 3g0b h THR 94 Ca -0.07 -2.17 -0.60 0.00 0.77 0.00 0.00 66.41 64.35 3g0b h THR 94 Cb 0.99 2.21 -0.42 0.00 -1.74 0.00 0.00 68.15 69.19 3g0b h THR 94 CO 0.36 0.40 -0.62 0.49 0.37 0.00 0.00 175.52 176.52 3g0b n PHE 95 N -3.03 3.72 -0.07 3.16 3.72 -1.26 -4.91 117.46 118.79 3g0b n PHE 95 Ca -0.06 -4.10 -0.11 0.00 -0.05 0.00 0.00 57.45 53.14 3g0b n PHE 95 Cb 0.82 -0.53 -0.07 0.00 -0.94 0.00 0.00 39.48 38.75 3g0b n PHE 95 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 3g0b h ASP 96 N 3.79 0.00 0.13 4.37 2.03 -1.92 -3.35 116.42 121.48 3g0b h ASP 96 Ca 0.18 -0.47 0.00 0.00 -0.73 0.00 0.00 57.03 56.00 3g0b h ASP 96 Cb 0.62 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.12 3g0b h ASP 96 CO 0.83 0.94 0.00 -0.62 -1.03 0.00 0.00 179.24 179.35 3g0b n GLU 97 N -4.62 0.58 -0.12 4.15 1.02 -1.26 -2.81 120.64 117.58 3g0b n GLU 97 Ca -0.12 0.03 -0.05 0.00 -0.02 0.00 0.00 57.16 57.00 3g0b n GLU 97 Cb 0.36 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.30 3g0b n GLU 97 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 3g0b h PHE 98 N 0.00 -0.31 0.00 -0.32 3.04 -1.95 -3.46 116.94 113.93 3g0b h PHE 98 Ca 0.00 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.99 3g0b h PHE 98 Cb 0.07 0.20 0.00 0.00 2.56 0.00 0.00 35.95 38.78 3g0b h PHE 98 CO 0.00 -0.21 0.00 0.41 -2.02 0.00 0.00 178.31 176.49 3g0b n GLY 99 N -1.34 2.67 3.75 2.40 0.00 -1.12 -5.01 105.19 106.53 3g0b n GLY 99 Ca 0.02 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 3g0b n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3g0b s HIS 100 N -0.51 3.86 -0.06 1.61 3.76 -1.26 -5.03 115.29 117.66 3g0b s HIS 100 Ca 0.00 1.84 -0.27 0.00 -0.15 0.00 0.00 55.06 56.48 3g0b s HIS 100 Cb 0.00 -3.06 -0.03 0.00 1.11 0.00 0.00 32.58 30.60 3g0b s HIS 100 CO 0.00 0.18 0.87 -1.54 -0.85 0.00 0.00 174.74 173.39 3g0b s SER 101 N -0.79 7.16 -0.48 1.40 1.04 -1.26 -5.00 113.70 115.78 3g0b s SER 101 Ca 0.44 1.41 -0.29 0.00 0.48 0.00 0.00 55.95 57.99 3g0b s SER 101 Cb -0.27 -2.50 0.03 0.00 0.10 0.00 0.00 66.02 63.39 3g0b s SER 101 CO 0.33 -0.25 1.15 -0.63 0.98 0.00 0.00 173.24 174.81 3g0b s ILE 102 N 1.23 4.19 0.25 -1.02 -1.09 -1.26 -4.65 121.20 118.85 3g0b s ILE 102 Ca 0.45 1.21 -0.01 0.00 -2.23 0.00 0.00 60.65 60.07 3g0b s ILE 102 Cb -0.19 -4.60 0.06 0.00 -1.58 0.00 0.00 42.46 36.15 3g0b s ILE 102 CO 0.21 -1.01 1.68 -1.13 -1.23 0.00 0.00 174.94 173.46 3g0b h ASN 103 N 9.27 0.67 -4.58 3.58 -1.24 -0.49 -3.47 115.58 119.33 3g0b h ASN 103 Ca -0.23 -0.22 0.08 0.00 0.71 0.00 0.00 56.30 56.63 3g0b h ASN 103 Cb 1.06 -0.18 -0.17 0.00 0.73 0.00 0.00 38.32 39.76 3g0b h ASN 103 CO 1.13 0.87 0.45 -0.62 -1.29 0.00 0.00 177.43 177.97 3g0b s ASP 104 N -6.76 -0.41 0.21 1.15 -1.08 -1.06 -5.01 116.67 103.70 3g0b s ASP 104 Ca -0.08 0.17 0.09 0.00 -0.52 0.00 0.00 52.55 52.21 3g0b s ASP 104 Cb 0.13 0.40 -0.05 0.00 -1.46 0.00 0.00 42.92 41.95 3g0b s ASP 104 CO 0.81 -0.58 -0.17 -0.72 0.52 0.00 0.00 175.17 175.04 3g0b s TYR 105 N -2.48 1.88 -0.22 -5.34 1.13 -1.26 -0.18 117.35 110.88 3g0b s TYR 105 Ca 0.01 -0.48 -0.04 0.00 -1.41 0.00 0.00 57.07 55.16 3g0b s TYR 105 Cb -0.01 -0.88 0.11 0.00 -1.10 0.00 0.00 41.96 40.08 3g0b s TYR 105 CO -0.05 0.43 0.27 0.45 -2.51 0.00 0.00 175.55 174.14 3g0b s SER 106 N -3.12 1.07 0.17 -0.18 0.15 0.10 -4.97 113.70 106.91 3g0b s SER 106 Ca 0.22 -0.12 -0.30 0.00 0.70 0.00 0.00 55.95 56.45 3g0b s SER 106 Cb -0.03 0.59 -0.07 0.00 -1.71 0.00 0.00 66.02 64.79 3g0b s SER 106 CO 0.08 -0.32 1.10 -0.63 1.20 0.00 0.00 173.24 174.68 3g0b s ILE 107 N 2.39 3.87 0.31 6.45 -1.09 -1.26 -0.33 121.20 131.54 3g0b s ILE 107 Ca 0.09 1.60 -0.29 0.00 -2.23 0.00 0.00 60.65 59.82 3g0b s ILE 107 Cb -0.16 -4.02 -0.10 0.00 -1.58 0.00 0.00 42.46 36.60 3g0b s ILE 107 CO -0.14 0.27 1.37 -0.94 -1.23 0.00 0.00 174.94 174.27 3g0b s SER 108 N -0.06 6.68 0.65 3.58 1.04 0.65 -4.90 113.70 121.35 3g0b s SER 108 Ca 0.50 2.73 0.33 0.00 0.48 0.00 0.00 55.95 59.99 3g0b s SER 108 Cb -0.29 -2.64 1.82 0.00 0.10 0.00 0.00 66.02 65.00 3g0b s SER 108 CO 0.35 -0.63 2.05 -0.65 0.98 0.00 0.00 173.24 175.33 3g0b h PRO 109 N 3.82 0.00 0.00 4.02 0.11 -1.80 0.58 132.00 138.74 3g0b h PRO 109 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3g0b h PRO 109 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3g0b h PRO 109 CO 0.69 0.00 -0.24 0.38 -0.21 0.00 0.00 178.00 178.61 3g0b h ASP 110 N 0.00 0.00 0.00 -2.05 -0.00 -1.88 -3.45 116.42 109.04 3g0b h ASP 110 Ca 0.02 -0.05 0.00 0.00 -0.00 0.00 0.00 57.03 57.01 3g0b h ASP 110 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.85 3g0b h ASP 110 CO -0.00 0.02 0.00 0.61 -0.00 0.00 0.00 179.24 179.87 3g0b n GLY 111 N 1.24 0.51 0.08 7.15 0.00 0.20 -4.95 105.19 109.43 3g0b n GLY 111 Ca 0.04 -0.82 -0.06 0.00 0.00 0.00 0.00 46.02 45.18 3g0b n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3g0b n GLN 112 N -2.81 0.66 -4.25 1.61 6.02 -1.26 -4.81 117.38 112.56 3g0b n GLN 112 Ca 0.00 0.07 -0.18 0.00 -0.01 0.00 0.00 57.00 56.88 3g0b n GLN 112 Cb 0.00 -1.62 -0.13 0.00 1.02 0.00 0.00 30.24 29.51 3g0b n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3g0b s PHE 113 N -2.69 1.02 -0.11 1.08 0.08 -1.26 0.24 117.98 116.34 3g0b s PHE 113 Ca -0.08 -0.37 0.03 0.00 0.12 0.00 0.00 56.93 56.63 3g0b s PHE 113 Cb 0.08 -0.61 0.01 0.00 -0.57 0.00 0.00 43.02 41.93 3g0b s PHE 113 CO 0.84 0.01 -0.21 -1.50 -0.10 0.00 0.00 175.22 174.26 3g0b s ILE 114 N -0.94 1.87 -0.20 0.64 2.07 0.04 -0.25 121.20 124.43 3g0b s ILE 114 Ca -0.01 -0.89 -0.19 0.00 -1.41 0.00 0.00 60.65 58.15 3g0b s ILE 114 Cb -0.08 -1.65 -0.03 0.00 0.13 0.00 0.00 42.46 40.83 3g0b s ILE 114 CO 0.01 0.52 0.55 -0.22 -1.91 0.00 0.00 174.94 173.88 3g0b s LEU 115 N 0.63 4.14 -0.20 8.50 2.96 0.55 -0.96 118.68 134.30 3g0b s LEU 115 Ca -0.13 0.71 -0.09 0.00 -0.22 0.00 0.00 54.13 54.40 3g0b s LEU 115 Cb -0.16 -2.75 -0.05 0.00 0.50 0.00 0.00 46.19 43.72 3g0b s LEU 115 CO 0.03 -0.21 0.12 -0.76 -1.32 0.00 0.00 176.35 174.21 3g0b s LEU 116 N 1.73 4.09 -0.17 -0.68 1.43 0.18 -0.72 118.68 124.53 3g0b s LEU 116 Ca 0.25 0.17 -0.05 0.00 -1.03 0.00 0.00 54.13 53.47 3g0b s LEU 116 Cb -0.16 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 3g0b s LEU 116 CO 0.10 0.15 -0.01 -0.70 0.23 0.00 0.00 176.35 176.12 3g0b s GLU 117 N 0.52 3.74 0.25 1.70 2.12 0.74 -1.67 118.70 126.10 3g0b s GLU 117 Ca 0.07 -0.48 -0.06 0.00 0.36 0.00 0.00 54.97 54.86 3g0b s GLU 117 Cb -0.12 -3.02 0.03 0.00 0.26 0.00 0.00 34.13 31.28 3g0b s GLU 117 CO -0.00 0.21 0.44 2.48 -0.54 0.00 0.00 175.26 177.85 3g0b n TYR 118 N 3.67 -1.60 -3.52 5.30 4.11 -0.10 0.34 117.16 125.36 3g0b n TYR 118 Ca -0.17 -1.33 -0.25 0.00 -0.00 0.00 0.00 57.90 56.15 3g0b n TYR 118 Cb 0.52 0.51 -0.01 0.00 -0.00 0.00 0.00 39.34 40.36 3g0b n TYR 118 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.86 176.95 3g0b n ASN 119 N -1.51 -3.36 -4.74 9.48 3.02 -1.26 0.07 115.26 116.96 3g0b n ASN 119 Ca -0.03 -0.48 -0.42 0.00 -0.03 0.00 0.00 54.58 53.62 3g0b n ASN 119 Cb 0.38 -2.79 -0.02 0.00 -0.61 0.00 0.00 39.78 36.74 3g0b n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3g0b s TYR 120 N -2.94 2.94 -0.18 3.10 5.04 -1.26 -4.16 117.35 119.89 3g0b s TYR 120 Ca 0.46 0.84 -0.03 0.00 -2.44 0.00 0.00 57.07 55.90 3g0b s TYR 120 Cb -0.25 -3.93 0.06 0.00 0.35 0.00 0.00 41.96 38.19 3g0b s TYR 120 CO 0.56 -3.16 0.04 0.08 -1.34 0.00 0.00 175.55 171.73 3g0b s VAL 121 N 0.27 0.43 0.28 3.14 1.01 0.29 -4.98 120.40 120.85 3g0b s VAL 121 Ca 0.63 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.87 3g0b s VAL 121 Cb -0.44 -0.93 -0.11 0.00 0.00 0.00 0.00 36.38 34.90 3g0b s VAL 121 CO 0.42 -0.18 1.52 -0.75 0.00 0.00 0.00 175.10 176.10 3g0b s LYS 122 N 1.91 4.18 0.00 2.72 2.20 -1.26 -0.89 119.74 128.60 3g0b s LYS 122 Ca -0.00 2.46 0.00 0.00 -0.36 0.00 0.00 55.97 58.07 3g0b s LYS 122 Cb -0.17 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 33.10 3g0b s LYS 122 CO -0.08 -0.53 0.00 0.94 -0.36 0.00 0.00 175.35 175.32 3g0b n GLN 123 N 2.05 0.00 0.00 4.03 7.27 -0.06 -4.89 117.38 125.77 3g0b n GLN 123 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.14 3g0b n GLN 123 Cb 0.39 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.04 3g0b n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 3g0b n TRP 124 N 0.00 0.00 -0.28 3.69 5.03 -1.16 -4.95 117.44 119.77 3g0b n TRP 124 Ca 0.00 0.00 -0.06 0.00 3.03 0.00 0.00 57.50 60.47 3g0b n TRP 124 Cb 0.00 0.00 0.07 0.00 -1.03 0.00 0.00 31.31 30.35 3g0b n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 3g0b h ARG 125 N 0.00 1.18 0.00 -0.99 2.43 -1.98 -3.36 114.38 111.67 3g0b h ARG 125 Ca 0.00 -0.23 -0.13 0.00 -0.81 0.00 0.00 59.98 58.81 3g0b h ARG 125 Cb 0.00 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 3g0b h ARG 125 CO 0.00 0.97 -1.51 0.72 -1.51 0.00 0.00 179.97 178.64 3g0b n HIS 126 N -4.27 0.00 -1.97 2.20 8.25 -1.26 -5.04 115.22 113.13 3g0b n HIS 126 Ca 0.07 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.14 3g0b n HIS 126 Cb 0.20 -0.35 0.01 0.00 1.12 0.00 0.00 29.99 30.97 3g0b n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3g0b s SER 127 N -4.76 5.88 0.29 0.41 1.04 -1.26 -4.64 113.70 110.66 3g0b s SER 127 Ca -0.11 2.66 -0.19 0.00 0.48 0.00 0.00 55.95 58.79 3g0b s SER 127 Cb 0.03 -2.63 0.05 0.00 0.10 0.00 0.00 66.02 63.57 3g0b s SER 127 CO 0.22 -1.14 0.84 -0.72 0.98 0.00 0.00 173.24 173.41 3g0b s TYR 128 N -1.32 -0.00 0.08 5.02 -0.85 -1.26 -0.88 117.35 118.13 3g0b s TYR 128 Ca 0.63 -0.52 0.07 0.00 -0.52 0.00 0.00 57.07 56.73 3g0b s TYR 128 Cb -0.38 0.76 -0.03 0.00 0.38 0.00 0.00 41.96 42.69 3g0b s TYR 128 CO 0.47 -1.27 -0.19 0.99 -1.52 0.00 0.00 175.55 174.02 3g0b s THR 129 N -2.82 1.54 0.19 -3.49 2.01 -0.07 -4.59 115.64 108.41 3g0b s THR 129 Ca 0.15 -1.36 -0.20 0.00 0.31 0.00 0.00 61.69 60.58 3g0b s THR 129 Cb -0.04 -1.39 0.04 0.00 0.01 0.00 0.00 72.50 71.11 3g0b s THR 129 CO 0.08 -0.02 0.58 0.00 -0.69 0.00 0.00 174.62 174.57 3g0b s ALA 130 N -1.06 -1.24 0.04 7.40 0.00 -0.69 -0.54 121.76 125.67 3g0b s ALA 130 Ca 0.05 0.05 -0.05 0.00 0.00 0.00 0.00 51.96 52.02 3g0b s ALA 130 Cb -0.09 0.85 -0.05 0.00 0.00 0.00 0.00 23.12 23.83 3g0b s ALA 130 CO 0.03 -0.82 0.27 -1.12 0.00 0.00 0.00 175.76 174.12 3g0b s SER 131 N -2.83 6.45 -0.01 0.00 0.01 0.11 -1.82 113.70 115.61 3g0b s SER 131 Ca 0.06 0.49 0.03 0.00 1.31 0.00 0.00 55.95 57.83 3g0b s SER 131 Cb -0.02 -2.06 -0.00 0.00 0.21 0.00 0.00 66.02 64.15 3g0b s SER 131 CO -0.06 0.20 -0.09 -0.31 0.41 0.00 0.00 173.24 173.39 3g0b s TYR 132 N -1.40 0.86 -0.02 2.43 1.51 -1.26 -0.93 117.35 118.54 3g0b s TYR 132 Ca 0.31 -0.17 0.04 0.00 -1.01 0.00 0.00 57.07 56.24 3g0b s TYR 132 Cb -0.13 -0.57 -0.01 0.00 -0.11 0.00 0.00 41.96 41.15 3g0b s TYR 132 CO 0.20 -0.03 -0.16 -0.51 -1.11 0.00 0.00 175.55 173.94 3g0b s ASP 133 N -0.13 1.89 -0.05 2.29 1.01 -0.67 -4.38 116.67 116.64 3g0b s ASP 133 Ca 0.02 -0.30 -0.02 0.00 0.71 0.00 0.00 52.55 52.96 3g0b s ASP 133 Cb -0.05 -0.34 -0.04 0.00 1.01 0.00 0.00 42.92 43.51 3g0b s ASP 133 CO -0.00 0.17 0.07 -0.63 0.21 0.00 0.00 175.17 174.99 3g0b s ILE 134 N -0.19 4.77 -0.04 0.77 1.01 -1.26 0.50 121.20 126.76 3g0b s ILE 134 Ca 0.02 -0.24 0.04 0.00 0.00 0.00 0.00 60.65 60.47 3g0b s ILE 134 Cb -0.08 -3.12 -0.00 0.00 0.01 0.00 0.00 42.46 39.27 3g0b s ILE 134 CO 0.00 0.47 -0.17 -0.31 0.00 0.00 0.00 174.94 174.94 3g0b s TYR 135 N -1.08 1.69 -0.27 3.97 1.51 -0.13 -1.31 117.35 121.72 3g0b s TYR 135 Ca 0.19 -0.49 -0.29 0.00 -1.01 0.00 0.00 57.07 55.47 3g0b s TYR 135 Cb -0.12 -1.14 -0.02 0.00 -0.11 0.00 0.00 41.96 40.57 3g0b s TYR 135 CO 0.09 -0.17 1.70 0.34 -1.11 0.00 0.00 175.55 176.39 3g0b s ASP 136 N 0.08 6.16 0.52 2.29 3.68 -1.22 -0.78 116.67 127.40 3g0b s ASP 136 Ca -0.05 1.46 0.17 0.00 2.13 0.00 0.00 52.55 56.26 3g0b s ASP 136 Cb -0.12 -2.53 1.28 0.00 -1.45 0.00 0.00 42.92 40.10 3g0b s ASP 136 CO 0.02 -1.47 2.14 -0.07 0.13 0.00 0.00 175.17 175.93 3g0b h LEU 137 N 12.60 0.00 -1.44 -1.34 3.38 -0.52 -0.61 115.31 127.37 3g0b h LEU 137 Ca -0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.63 3g0b h LEU 137 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3g0b h LEU 137 CO 1.02 0.01 0.00 0.78 0.09 0.00 0.00 178.44 180.34 3g0b h ASN 138 N 0.00 0.00 0.00 -0.43 -0.26 -1.88 -3.29 115.58 109.72 3g0b h ASN 138 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 3g0b h ASN 138 Cb 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.28 3g0b h ASN 138 CO 0.00 0.00 -0.08 0.29 -1.06 0.00 0.00 177.43 176.58 3g0b n LYS 139 N -2.85 4.56 -3.52 0.81 5.02 -0.69 -5.02 118.16 116.46 3g0b n LYS 139 Ca 0.01 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.05 3g0b n LYS 139 Cb 0.25 -0.41 -0.05 0.00 -0.02 0.00 0.00 35.03 34.81 3g0b n LYS 139 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 3g0b n ARG 140 N -0.74 -1.47 -4.15 1.97 1.85 -0.32 -4.97 116.66 108.83 3g0b n ARG 140 Ca 0.00 0.08 -0.31 0.00 -1.00 0.00 0.00 57.85 56.62 3g0b n ARG 140 Cb 0.00 -4.13 -0.08 0.00 -1.05 0.00 0.00 32.46 27.20 3g0b n ARG 140 CO 0.00 0.00 0.00 1.14 -0.01 0.00 0.00 177.63 178.76 3g0b s GLN 141 N -5.81 2.79 0.13 2.89 -2.07 -1.26 -5.02 119.66 111.32 3g0b s GLN 141 Ca 0.48 -0.67 -0.31 0.00 -1.82 0.00 0.00 55.36 53.04 3g0b s GLN 141 Cb -0.28 -2.68 -0.08 0.00 -1.09 0.00 0.00 33.01 28.88 3g0b s GLN 141 CO 0.59 0.59 1.33 -1.17 -1.32 0.00 0.00 175.29 175.31 3g0b s LEU 142 N -2.01 4.38 -0.91 2.60 2.96 -1.26 -3.38 118.68 121.07 3g0b s LEU 142 Ca 0.24 2.29 -0.24 0.00 -0.22 0.00 0.00 54.13 56.20 3g0b s LEU 142 Cb -0.12 -3.59 -0.00 0.00 0.50 0.00 0.00 46.19 42.98 3g0b s LEU 142 CO 0.16 -0.58 1.71 -0.63 -1.32 0.00 0.00 176.35 175.69 3g0b s ILE 143 N 0.81 3.63 -0.05 6.68 1.01 -0.43 -4.84 121.20 128.01 3g0b s ILE 143 Ca 0.61 -0.41 0.30 0.00 0.00 0.00 0.00 60.65 61.15 3g0b s ILE 143 Cb -0.35 -4.45 0.36 0.00 0.01 0.00 0.00 42.46 38.03 3g0b s ILE 143 CO 0.32 -1.37 1.86 0.71 0.00 0.00 0.00 174.94 176.46 3g0b h THR 144 N 6.97 0.07 -2.26 2.92 1.35 -1.92 -3.43 112.91 116.61 3g0b h THR 144 Ca 0.08 -0.73 -0.52 0.00 -0.55 0.00 0.00 66.41 64.69 3g0b h THR 144 Cb 1.02 1.68 -0.05 0.00 -1.73 0.00 0.00 68.15 69.07 3g0b h THR 144 CO 1.30 0.03 -0.54 -1.83 -0.25 0.00 0.00 175.52 174.22 3g0b s GLU 145 N -3.53 2.87 -1.42 4.72 1.03 -1.26 -4.62 118.70 116.49 3g0b s GLU 145 Ca 0.03 -1.06 -0.05 0.00 0.03 0.00 0.00 54.97 53.91 3g0b s GLU 145 Cb 0.08 -2.54 0.00 0.00 -0.80 0.00 0.00 34.13 30.87 3g0b s GLU 145 CO 0.59 0.41 0.32 0.39 -1.33 0.00 0.00 175.26 175.64 3g0b n GLU 146 N -1.06 -1.97 -2.21 -4.83 -0.58 -1.26 -4.68 120.64 104.05 3g0b n GLU 146 Ca -0.08 0.26 -0.38 0.00 -0.42 0.00 0.00 57.16 56.55 3g0b n GLU 146 Cb 0.58 -3.95 -0.01 0.00 -0.57 0.00 0.00 31.44 27.49 3g0b n GLU 146 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3g0b s ARG 147 N -6.90 3.81 0.31 3.49 0.52 -1.26 -4.83 118.95 114.09 3g0b s ARG 147 Ca 0.09 1.86 -0.30 0.00 -0.52 0.00 0.00 55.73 56.86 3g0b s ARG 147 Cb -0.04 -2.50 -0.11 0.00 0.52 0.00 0.00 34.95 32.82 3g0b s ARG 147 CO 0.93 -0.54 1.57 -0.89 0.02 0.00 0.00 175.30 176.40 3g0b n ILE 148 N -0.33 1.24 -1.24 1.52 5.41 -1.26 -4.97 119.36 119.72 3g0b n ILE 148 Ca 0.06 -0.31 -0.29 0.00 1.00 0.00 0.00 62.75 63.21 3g0b n ILE 148 Cb 0.47 -1.97 0.15 0.00 -0.71 0.00 0.00 39.64 37.58 3g0b n ILE 148 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3g0b s PRO 149 N -0.85 0.93 0.84 0.38 0.04 -1.26 -4.59 135.00 130.49 3g0b s PRO 149 Ca 0.62 0.63 -0.12 0.00 0.04 0.00 0.00 61.00 62.17 3g0b s PRO 149 Cb -0.49 -1.79 0.10 0.00 0.04 0.00 0.00 34.50 32.36 3g0b s PRO 149 CO 0.52 -2.42 1.10 -0.80 0.04 0.00 0.00 177.00 175.44 3g0b s ASN 150 N -3.52 4.06 -1.56 6.66 0.01 -1.26 -4.03 114.94 115.29 3g0b s ASN 150 Ca 0.64 1.34 -0.04 0.00 -0.71 0.00 0.00 52.86 54.10 3g0b s ASN 150 Cb -0.18 -2.04 0.01 0.00 0.41 0.00 0.00 41.25 39.45 3g0b s ASN 150 CO 0.57 -2.25 0.40 0.59 -1.51 0.00 0.00 177.10 174.90 3g0b n ASN 151 N -3.62 -5.72 -4.73 -1.22 4.13 -1.20 -4.95 115.26 97.95 3g0b n ASN 151 Ca 0.07 -0.20 -0.41 0.00 1.68 0.00 0.00 54.58 55.72 3g0b n ASN 151 Cb 0.56 -4.68 -0.04 0.00 -1.54 0.00 0.00 39.78 34.09 3g0b n ASN 151 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3g0b s THR 152 N -3.09 4.11 -0.08 3.41 2.01 -0.76 -4.50 115.64 116.75 3g0b s THR 152 Ca 0.21 1.70 0.05 0.00 0.31 0.00 0.00 61.69 63.96 3g0b s THR 152 Cb -0.10 -4.09 -0.24 0.00 0.01 0.00 0.00 72.50 68.08 3g0b s THR 152 CO 0.26 0.24 0.53 0.00 -0.69 0.00 0.00 174.62 174.96 3g0b n GLN 153 N 2.93 0.68 -3.66 4.92 6.02 0.17 -1.70 117.38 126.75 3g0b n GLN 153 Ca 0.04 0.28 -0.15 0.00 -0.01 0.00 0.00 57.00 57.16 3g0b n GLN 153 Cb 0.47 -1.75 -0.08 0.00 1.02 0.00 0.00 30.24 29.90 3g0b n GLN 153 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 3g0b s TRP 154 N -2.58 -0.47 -0.04 1.08 -0.11 -1.12 -4.63 118.94 111.07 3g0b s TRP 154 Ca -0.12 0.91 -0.03 0.00 1.22 0.00 0.00 56.10 58.09 3g0b s TRP 154 Cb 0.07 0.23 0.02 0.00 -1.50 0.00 0.00 33.47 32.30 3g0b s TRP 154 CO 0.80 -0.43 0.10 0.54 -4.62 0.00 0.00 176.95 173.34 3g0b s VAL 155 N -0.78 -0.02 -0.10 5.86 0.11 -1.26 -0.36 120.40 123.85 3g0b s VAL 155 Ca -0.08 0.07 -0.09 0.00 -2.93 0.00 0.00 61.98 58.94 3g0b s VAL 155 Cb -0.03 -0.16 0.03 0.00 -1.53 0.00 0.00 36.38 34.69 3g0b s VAL 155 CO 0.05 0.03 0.27 0.28 -3.33 0.00 0.00 175.10 172.40 3g0b s THR 156 N 0.44 0.00 0.44 5.04 -1.32 0.83 -4.99 115.64 116.08 3g0b s THR 156 Ca -0.03 -0.02 -0.20 0.00 -1.21 0.00 0.00 61.69 60.23 3g0b s THR 156 Cb -0.05 -0.38 -0.11 0.00 -1.51 0.00 0.00 72.50 70.46 3g0b s THR 156 CO -0.02 -0.01 0.95 0.26 -2.21 0.00 0.00 174.62 173.59 3g0b s TRP 157 N 0.10 3.33 0.73 9.09 0.52 -1.26 -0.61 118.94 130.84 3g0b s TRP 157 Ca -0.00 1.58 -0.14 0.00 0.02 0.00 0.00 56.10 57.56 3g0b s TRP 157 Cb -0.02 -2.83 0.04 0.00 -1.15 0.00 0.00 33.47 29.51 3g0b s TRP 157 CO 0.00 -0.14 1.15 -1.54 0.02 0.00 0.00 176.95 176.45 3g0b s SER 158 N -2.30 4.41 0.57 2.95 1.04 0.02 -4.92 113.70 115.47 3g0b s SER 158 Ca 0.61 2.14 0.33 0.00 0.48 0.00 0.00 55.95 59.52 3g0b s SER 158 Cb -0.09 -2.56 1.75 0.00 0.10 0.00 0.00 66.02 65.22 3g0b s SER 158 CO 0.16 -2.11 2.17 -0.65 0.98 0.00 0.00 173.24 173.78 3g0b h PRO 159 N -0.47 0.00 -4.21 4.02 0.11 -1.81 -3.42 132.00 126.22 3g0b h PRO 159 Ca -0.46 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.47 3g0b h PRO 159 Cb 1.27 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.19 3g0b h PRO 159 CO 0.50 0.05 -0.70 0.14 -0.21 0.00 0.00 178.00 177.79 3g0b s VAL 160 N -4.18 0.26 0.00 3.15 -7.23 -1.26 -4.75 120.40 106.39 3g0b s VAL 160 Ca -0.03 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.82 3g0b s VAL 160 Cb 0.13 -0.85 0.00 0.00 0.56 0.00 0.00 36.38 36.22 3g0b s VAL 160 CO 0.53 -0.68 0.00 0.61 -0.31 0.00 0.00 175.10 175.25 3g0b n GLY 161 N 0.94 -0.75 2.75 2.32 0.00 -1.26 -4.62 105.19 104.57 3g0b n GLY 161 Ca -0.19 -1.22 -0.04 0.00 0.00 0.00 0.00 46.02 44.56 3g0b n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3g0b n HIS 162 N 0.00 1.29 -2.76 1.61 1.44 -1.26 -3.04 115.22 112.50 3g0b n HIS 162 Ca 0.00 -2.39 -0.41 0.00 -2.01 0.00 0.00 57.72 52.91 3g0b n HIS 162 Cb 0.00 -0.28 -0.05 0.00 0.12 0.00 0.00 29.99 29.78 3g0b n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 3g0b s LYS 163 N -3.55 4.72 -0.13 -1.40 1.02 -1.26 -4.60 119.74 114.54 3g0b s LYS 163 Ca 0.28 1.42 -0.06 0.00 0.02 0.00 0.00 55.97 57.63 3g0b s LYS 163 Cb 0.37 -3.34 -0.04 0.00 -0.52 0.00 0.00 37.83 34.30 3g0b s LYS 163 CO -0.01 0.32 0.10 -0.51 -0.92 0.00 0.00 175.35 174.32 3g0b s LEU 164 N -0.38 4.11 -0.11 3.17 2.01 0.12 -0.80 118.68 126.79 3g0b s LEU 164 Ca 0.44 0.32 0.02 0.00 0.01 0.00 0.00 54.13 54.92 3g0b s LEU 164 Cb -0.24 -2.00 0.02 0.00 0.01 0.00 0.00 46.19 43.98 3g0b s LEU 164 CO 0.30 0.35 -0.15 0.00 1.01 0.00 0.00 176.35 177.85 3g0b s ALA 165 N -0.67 1.74 0.06 4.21 0.00 0.22 -0.41 121.76 126.90 3g0b s ALA 165 Ca 0.12 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.35 3g0b s ALA 165 Cb -0.12 -0.87 -0.03 0.00 0.00 0.00 0.00 23.12 22.11 3g0b s ALA 165 CO 0.02 -0.11 -0.12 1.52 0.00 0.00 0.00 175.76 177.07 3g0b s TYR 166 N 1.04 1.03 -0.23 0.00 -0.85 -0.67 -0.12 117.35 117.55 3g0b s TYR 166 Ca -0.05 -0.46 -0.07 0.00 -0.52 0.00 0.00 57.07 55.97 3g0b s TYR 166 Cb -0.15 -0.59 -0.03 0.00 0.38 0.00 0.00 41.96 41.57 3g0b s TYR 166 CO -0.03 0.01 0.06 0.08 -1.52 0.00 0.00 175.55 174.16 3g0b s VAL 167 N -1.26 4.38 -0.02 -3.49 1.01 0.51 -0.38 120.40 121.14 3g0b s VAL 167 Ca -0.04 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.79 3g0b s VAL 167 Cb -0.10 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.27 3g0b s VAL 167 CO 0.02 0.37 -0.03 0.86 0.00 0.00 0.00 175.10 176.32 3g0b s TRP 168 N 1.32 0.45 -1.55 5.22 -0.00 -0.18 0.43 118.94 124.64 3g0b s TRP 168 Ca 0.05 -0.08 -0.11 0.00 -0.00 0.00 0.00 56.10 55.96 3g0b s TRP 168 Cb -0.15 -0.43 0.09 0.00 -0.00 0.00 0.00 33.47 32.98 3g0b s TRP 168 CO 0.03 -0.11 0.77 0.09 -0.00 0.00 0.00 176.95 177.74 3g0b n ASN 169 N 3.74 -2.99 -0.04 5.86 5.03 -1.26 -2.32 115.26 123.28 3g0b n ASN 169 Ca -0.22 -0.91 -0.01 0.00 0.87 0.00 0.00 54.58 54.31 3g0b n ASN 169 Cb 0.53 -3.32 -0.00 0.00 -1.02 0.00 0.00 39.78 35.97 3g0b n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3g0b n ASN 170 N -2.82 -4.17 -4.28 6.41 5.03 -1.26 -4.44 115.26 109.73 3g0b n ASN 170 Ca -0.05 0.01 -0.25 0.00 0.87 0.00 0.00 54.58 55.16 3g0b n ASN 170 Cb 0.56 -1.71 -0.13 0.00 -1.02 0.00 0.00 39.78 37.47 3g0b n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3g0b s ASP 171 N -2.06 2.62 -0.03 6.41 -0.00 -0.98 -1.17 116.67 121.46 3g0b s ASP 171 Ca 0.00 -0.61 -0.22 0.00 -0.00 0.00 0.00 52.55 51.72 3g0b s ASP 171 Cb 0.00 -0.18 -0.05 0.00 -0.00 0.00 0.00 42.92 42.69 3g0b s ASP 171 CO 0.00 0.13 0.64 -0.63 -0.00 0.00 0.00 175.17 175.30 3g0b s ILE 172 N -0.97 4.95 0.18 0.77 1.01 -1.26 -1.01 121.20 124.87 3g0b s ILE 172 Ca 0.08 1.32 0.08 0.00 0.00 0.00 0.00 60.65 62.13 3g0b s ILE 172 Cb -0.09 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 3g0b s ILE 172 CO 0.03 0.36 -0.17 -0.31 0.00 0.00 0.00 174.94 174.85 3g0b s TYR 173 N 0.18 1.77 -0.04 3.97 2.02 0.49 0.38 117.35 126.11 3g0b s TYR 173 Ca 0.33 -0.51 0.01 0.00 -0.37 0.00 0.00 57.07 56.53 3g0b s TYR 173 Cb -0.18 -0.85 0.02 0.00 -0.40 0.00 0.00 41.96 40.55 3g0b s TYR 173 CO 0.18 0.35 -0.03 0.08 -1.57 0.00 0.00 175.55 174.55 3g0b s VAL 174 N -2.44 0.45 -0.36 0.71 1.01 0.18 -1.66 120.40 118.29 3g0b s VAL 174 Ca 0.19 -0.07 -0.05 0.00 0.00 0.00 0.00 61.98 62.05 3g0b s VAL 174 Cb -0.04 -0.50 0.07 0.00 0.00 0.00 0.00 36.38 35.91 3g0b s VAL 174 CO 0.07 0.21 0.13 -0.54 0.00 0.00 0.00 175.10 174.96 3g0b s LYS 175 N 0.98 2.42 0.37 2.72 1.02 0.45 -0.46 119.74 127.23 3g0b s LYS 175 Ca -0.10 -1.41 0.15 0.00 0.02 0.00 0.00 55.97 54.63 3g0b s LYS 175 Cb -0.14 -3.47 0.72 0.00 -0.52 0.00 0.00 37.83 34.42 3g0b s LYS 175 CO -0.00 -0.80 1.79 0.82 -0.92 0.00 0.00 175.35 176.24 3g0b h ILE 176 N 6.28 1.14 -3.50 2.17 1.08 -1.86 0.36 117.51 123.18 3g0b h ILE 176 Ca -0.20 -1.40 -0.31 0.00 -0.39 0.00 0.00 64.86 62.55 3g0b h ILE 176 Cb 1.07 1.79 -0.34 0.00 -3.07 0.00 0.00 36.82 36.26 3g0b h ILE 176 CO 0.63 0.38 -0.73 -1.61 -0.69 0.00 0.00 178.15 176.13 3g0b s GLU 177 N -3.95 0.03 0.00 2.37 0.41 -1.26 -4.52 118.70 111.77 3g0b s GLU 177 Ca -0.02 0.18 0.00 0.00 -0.41 0.00 0.00 54.97 54.72 3g0b s GLU 177 Cb 0.13 -0.32 0.00 0.00 -1.78 0.00 0.00 34.13 32.16 3g0b s GLU 177 CO 0.71 -0.18 0.82 -2.30 -0.49 0.00 0.00 175.26 173.82 3g0b n PRO 178 N 4.26 0.00 -0.00 0.39 -0.02 -1.26 -0.23 135.00 138.14 3g0b n PRO 178 Ca -0.26 0.34 0.06 0.00 -2.02 0.00 0.00 63.50 61.62 3g0b n PRO 178 Cb 0.50 -1.58 -0.08 0.00 -0.02 0.00 0.00 33.50 32.32 3g0b n PRO 178 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3g0b n ASN 179 N -1.32 0.79 -4.89 2.55 0.23 -1.26 -4.86 115.26 106.51 3g0b n ASN 179 Ca 0.00 -0.71 -0.31 0.00 -0.53 0.00 0.00 54.58 53.03 3g0b n ASN 179 Cb 0.08 1.09 -0.05 0.00 -2.08 0.00 0.00 39.78 38.82 3g0b n ASN 179 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3g0b s LEU 180 N -2.81 4.20 0.44 -4.53 1.43 0.68 -4.40 118.68 113.70 3g0b s LEU 180 Ca 0.04 0.74 -0.23 0.00 -1.03 0.00 0.00 54.13 53.64 3g0b s LEU 180 Cb 0.10 -3.49 -0.10 0.00 0.03 0.00 0.00 46.19 42.73 3g0b s LEU 180 CO 0.56 -0.03 0.93 -2.65 0.23 0.00 0.00 176.35 175.39 3g0b n PRO 181 N -0.14 1.18 -2.55 1.29 -0.02 -1.26 -4.80 135.00 128.70 3g0b n PRO 181 Ca -0.01 0.43 -0.38 0.00 -2.02 0.00 0.00 63.50 61.52 3g0b n PRO 181 Cb 0.52 -1.98 -0.04 0.00 -0.02 0.00 0.00 33.50 31.98 3g0b n PRO 181 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3g0b s SER 182 N -0.83 6.99 -0.29 2.55 0.01 -1.26 -4.78 113.70 116.09 3g0b s SER 182 Ca 0.65 2.08 -0.18 0.00 1.31 0.00 0.00 55.95 59.81 3g0b s SER 182 Cb -0.55 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.06 3g0b s SER 182 CO 0.56 -0.33 0.50 -0.31 0.41 0.00 0.00 173.24 174.08 3g0b s TYR 183 N -1.49 3.23 -0.05 2.43 2.02 0.39 -4.87 117.35 119.01 3g0b s TYR 183 Ca 0.53 0.48 -0.30 0.00 -0.37 0.00 0.00 57.07 57.40 3g0b s TYR 183 Cb -0.25 -2.78 -0.03 0.00 -0.40 0.00 0.00 41.96 38.50 3g0b s TYR 183 CO 0.31 -0.36 1.19 0.50 -1.57 0.00 0.00 175.55 175.62 3g0b s ARG 184 N 2.33 4.36 -0.16 -0.62 3.52 -1.26 -0.64 118.95 126.48 3g0b s ARG 184 Ca 0.20 1.66 -0.17 0.00 -0.13 0.00 0.00 55.73 57.29 3g0b s ARG 184 Cb -0.16 -3.55 -0.14 0.00 -1.56 0.00 0.00 34.95 29.55 3g0b s ARG 184 CO 0.11 -0.43 0.24 0.82 -0.81 0.00 0.00 175.30 175.22 3g0b h ILE 185 N 4.99 0.78 -2.55 4.11 1.08 -0.43 -3.37 117.51 122.12 3g0b h ILE 185 Ca -0.34 -1.75 -0.57 0.00 -0.39 0.00 0.00 64.86 61.80 3g0b h ILE 185 Cb 1.16 1.64 -0.10 0.00 -3.07 0.00 0.00 36.82 36.45 3g0b h ILE 185 CO 0.88 0.26 -0.64 0.42 -0.69 0.00 0.00 178.15 178.38 3g0b s THR 186 N -2.15 3.70 0.00 -0.27 -4.23 -1.18 -4.67 115.64 106.84 3g0b s THR 186 Ca -0.18 -1.61 0.00 0.00 -1.18 0.00 0.00 61.69 58.73 3g0b s THR 186 Cb 0.02 -2.92 0.00 0.00 1.34 0.00 0.00 72.50 70.93 3g0b s THR 186 CO 0.43 -0.24 0.50 0.79 -0.54 0.00 0.00 174.62 175.56 3g0b n TRP 187 N -0.53 0.00 0.68 3.99 7.02 -1.26 -4.56 117.44 122.78 3g0b n TRP 187 Ca -0.08 -0.10 0.08 0.00 -1.02 0.00 0.00 57.50 56.37 3g0b n TRP 187 Cb 0.57 -0.01 -0.10 0.00 -2.42 0.00 0.00 31.31 29.35 3g0b n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 3g0b n THR 188 N -0.10 0.00 -1.64 -0.99 -2.24 -1.26 -5.00 114.28 103.05 3g0b n THR 188 Ca 0.00 -0.14 -0.49 0.00 -2.27 0.00 0.00 64.05 61.15 3g0b n THR 188 Cb 0.35 0.89 -0.05 0.00 -2.10 0.00 0.00 70.33 69.42 3g0b n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g0b n GLY 189 N 1.41 0.86 3.03 3.38 0.00 -1.26 -4.71 105.19 107.91 3g0b n GLY 189 Ca 0.02 0.68 -0.13 0.00 0.00 0.00 0.00 46.02 46.60 3g0b n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3g0b s LYS 190 N 0.86 0.19 0.14 1.61 2.20 -0.76 -4.85 119.74 119.13 3g0b s LYS 190 Ca 0.82 0.49 -0.35 0.00 -0.36 0.00 0.00 55.97 56.57 3g0b s LYS 190 Cb -0.80 -0.12 -0.15 0.00 -1.51 0.00 0.00 37.83 35.25 3g0b s LYS 190 CO 0.42 -0.16 1.49 -1.91 -0.36 0.00 0.00 175.35 174.83 3g0b n GLU 191 N 4.16 1.81 -0.66 4.03 2.13 -1.26 -1.65 120.64 129.20 3g0b n GLU 191 Ca -0.25 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.22 3g0b n GLU 191 Cb 0.53 -2.37 0.00 0.00 0.27 0.00 0.00 31.44 29.87 3g0b n GLU 191 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3g0b n ASP 192 N 3.04 -0.37 0.06 4.31 8.00 -1.26 -4.69 116.55 125.64 3g0b n ASP 192 Ca 0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.67 3g0b n ASP 192 Cb 0.26 -1.89 0.00 0.00 -0.02 0.00 0.00 41.12 39.46 3g0b n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3g0b n ILE 193 N -2.02 0.97 -4.86 0.53 5.41 -0.66 -4.67 119.36 114.06 3g0b n ILE 193 Ca 0.00 0.32 -0.33 0.00 1.00 0.00 0.00 62.75 63.74 3g0b n ILE 193 Cb 0.03 -1.42 -0.16 0.00 -0.71 0.00 0.00 39.64 37.38 3g0b n ILE 193 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3g0b s ILE 194 N -2.00 2.37 -0.22 1.39 1.09 -0.66 -0.57 121.20 122.61 3g0b s ILE 194 Ca 0.00 -0.89 0.02 0.00 -1.10 0.00 0.00 60.65 58.68 3g0b s ILE 194 Cb 0.00 -1.96 0.04 0.00 -1.06 0.00 0.00 42.46 39.48 3g0b s ILE 194 CO 0.00 0.54 -0.15 -0.31 -0.10 0.00 0.00 174.94 174.92 3g0b s TYR 195 N 0.56 3.03 -0.29 3.97 1.51 -0.43 -1.83 117.35 123.88 3g0b s TYR 195 Ca -0.12 -1.98 -0.09 0.00 -1.01 0.00 0.00 57.07 53.87 3g0b s TYR 195 Cb -0.16 -1.93 -0.02 0.00 -0.11 0.00 0.00 41.96 39.74 3g0b s TYR 195 CO 0.04 -0.84 0.13 -0.80 -1.11 0.00 0.00 175.55 172.96 3g0b s ASN 196 N 1.20 5.45 0.00 2.29 0.01 -0.32 -1.26 114.94 122.30 3g0b s ASN 196 Ca -0.02 -0.36 0.00 0.00 -0.71 0.00 0.00 52.86 51.77 3g0b s ASN 196 Cb -0.17 -1.99 0.00 0.00 0.41 0.00 0.00 41.25 39.51 3g0b s ASN 196 CO -0.09 -0.12 0.00 0.61 -1.51 0.00 0.00 177.10 175.99 3g0b n GLY 197 N 4.97 0.40 3.13 0.66 0.00 -0.62 -4.25 105.19 109.48 3g0b n GLY 197 Ca -0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 3g0b n GLY 197 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3g0b s ILE 198 N -1.96 0.73 0.30 -0.61 -4.36 -1.26 -0.81 121.20 113.22 3g0b s ILE 198 Ca 0.00 -1.51 -0.11 0.00 -0.26 0.00 0.00 60.65 58.77 3g0b s ILE 198 Cb 0.00 -1.16 -0.08 0.00 1.25 0.00 0.00 42.46 42.47 3g0b s ILE 198 CO 0.00 -0.57 0.66 0.42 0.24 0.00 0.00 174.94 175.69 3g0b s THR 199 N -2.35 4.82 0.77 8.37 -4.23 0.13 -4.70 115.64 118.46 3g0b s THR 199 Ca 0.01 0.64 -0.13 0.00 -1.18 0.00 0.00 61.69 61.03 3g0b s THR 199 Cb -0.03 -3.65 0.18 0.00 1.34 0.00 0.00 72.50 70.34 3g0b s THR 199 CO -0.01 -0.23 1.04 -0.90 -0.54 0.00 0.00 174.62 173.98 3g0b n ASP 200 N -0.53 0.05 0.03 3.99 3.85 -1.26 -4.76 116.55 117.92 3g0b n ASP 200 Ca 0.02 -1.37 -0.12 0.00 -0.71 0.00 0.00 54.79 52.61 3g0b n ASP 200 Cb 0.53 -0.80 -0.05 0.00 -1.35 0.00 0.00 41.12 39.45 3g0b n ASP 200 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.20 175.94 3g0b h TRP 201 N -1.62 -1.00 -0.02 2.11 7.01 -1.99 -1.37 115.95 119.06 3g0b h TRP 201 Ca -0.34 0.04 -0.18 0.00 2.11 0.00 0.00 58.89 60.52 3g0b h TRP 201 Cb 0.93 0.45 -0.01 0.00 -2.10 0.00 0.00 29.16 28.43 3g0b h TRP 201 CO 0.00 -0.44 -0.79 -0.24 -2.79 0.00 0.00 178.44 174.18 3g0b h VAL 202 N -0.47 1.45 -0.53 2.65 3.04 -1.94 -1.42 116.25 119.03 3g0b h VAL 202 Ca 0.07 -2.39 -0.08 0.00 -1.01 0.00 0.00 66.70 63.30 3g0b h VAL 202 Cb 0.59 2.30 -0.02 0.00 -2.01 0.00 0.00 31.29 32.15 3g0b h VAL 202 CO -0.33 0.70 0.01 1.88 -1.01 0.00 0.00 177.57 178.82 3g0b h TYR 203 N 0.15 0.96 0.44 3.17 -1.99 -1.91 0.80 116.97 118.58 3g0b h TYR 203 Ca -0.03 -0.14 -0.02 0.00 2.00 0.00 0.00 58.73 60.53 3g0b h TYR 203 Cb 1.38 -0.26 0.00 0.00 2.00 0.00 0.00 36.73 39.86 3g0b h TYR 203 CO 0.03 0.86 -0.21 1.49 -0.00 0.00 0.00 178.16 180.33 3g0b h GLU 204 N 0.83 -0.58 -0.22 4.88 4.81 -1.02 0.21 114.58 123.50 3g0b h GLU 204 Ca 0.16 0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.29 3g0b h GLU 204 Cb 0.48 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.99 3g0b h GLU 204 CO 0.02 -0.34 -0.39 1.49 -0.73 0.00 0.00 179.01 179.06 3g0b h GLU 205 N -0.69 0.65 0.00 1.92 4.57 -1.25 -2.58 114.58 117.20 3g0b h GLU 205 Ca -0.06 -0.41 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 3g0b h GLU 205 Cb 0.51 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 3g0b h GLU 205 CO 0.10 1.03 -0.88 0.39 -1.18 0.00 0.00 179.01 178.47 3g0b n GLU 206 N -4.23 1.94 -0.03 1.92 -0.58 0.27 -4.58 120.64 115.34 3g0b n GLU 206 Ca -0.05 -0.03 -0.07 0.00 -0.42 0.00 0.00 57.16 56.59 3g0b n GLU 206 Cb 0.53 -0.98 -0.02 0.00 -0.57 0.00 0.00 31.44 30.40 3g0b n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3g0b n VAL 207 N -1.48 1.28 0.76 2.62 0.31 -0.85 -4.87 118.33 116.10 3g0b n VAL 207 Ca -0.00 0.19 0.10 0.00 -0.01 0.00 0.00 64.34 64.62 3g0b n VAL 207 Cb 0.11 -1.94 -0.13 0.00 -0.91 0.00 0.00 33.84 30.97 3g0b n VAL 207 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3g0b n PHE 208 N -3.95 0.00 -4.02 3.52 3.72 0.70 -4.97 117.46 112.47 3g0b n PHE 208 Ca -0.11 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 56.99 3g0b n PHE 208 Cb 0.34 -0.11 -0.01 0.00 -0.94 0.00 0.00 39.48 38.77 3g0b n PHE 208 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3g0b n SER 209 N -1.66 -2.46 -3.52 4.37 7.64 -0.98 -4.94 113.62 112.06 3g0b n SER 209 Ca 0.02 -0.94 -0.11 0.00 1.01 0.00 0.00 58.87 58.85 3g0b n SER 209 Cb 0.38 -3.24 -0.04 0.00 -1.01 0.00 0.00 64.21 60.30 3g0b n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3g0b s ALA 210 N -3.55 -1.83 -0.03 -0.43 0.00 -1.15 -4.97 121.76 109.80 3g0b s ALA 210 Ca 0.41 1.23 -0.20 0.00 0.00 0.00 0.00 51.96 53.39 3g0b s ALA 210 Cb -0.22 -0.02 -0.32 0.00 0.00 0.00 0.00 23.12 22.57 3g0b s ALA 210 CO 0.88 -0.50 0.93 -0.92 0.00 0.00 0.00 175.76 176.15 3g0b h TYR 211 N 2.39 0.65 -3.99 0.00 -0.00 -1.88 -3.37 116.97 110.76 3g0b h TYR 211 Ca -0.23 -0.47 -0.54 0.00 -0.00 0.00 0.00 58.73 57.49 3g0b h TYR 211 Cb 1.20 -0.03 0.12 0.00 -0.00 0.00 0.00 36.73 38.02 3g0b h TYR 211 CO 0.29 1.36 0.68 -1.54 -0.00 0.00 0.00 178.16 178.94 3g0b s SER 212 N -7.09 5.84 -0.32 -2.11 1.04 -1.26 0.21 113.70 110.01 3g0b s SER 212 Ca -0.13 2.87 0.18 0.00 0.48 0.00 0.00 55.95 59.35 3g0b s SER 212 Cb 0.02 -2.65 0.46 0.00 0.10 0.00 0.00 66.02 63.95 3g0b s SER 212 CO 0.86 -1.20 0.99 0.00 0.98 0.00 0.00 173.24 174.87 3g0b n ALA 213 N -0.27 3.45 -3.67 5.32 0.00 0.00 -4.60 120.51 120.74 3g0b n ALA 213 Ca 0.06 -3.18 -0.27 0.00 0.00 0.00 0.00 53.44 50.05 3g0b n ALA 213 Cb 0.42 -0.89 -0.17 0.00 0.00 0.00 0.00 19.45 18.82 3g0b n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3g0b s LEU 214 N -3.26 1.54 -0.40 0.00 1.43 -1.25 -2.19 118.68 114.55 3g0b s LEU 214 Ca 0.29 -0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.06 3g0b s LEU 214 Cb 0.43 -0.92 0.12 0.00 0.03 0.00 0.00 46.19 45.86 3g0b s LEU 214 CO 0.01 -0.02 0.18 0.26 0.23 0.00 0.00 176.35 177.02 3g0b s TRP 215 N 1.09 2.12 0.58 0.29 0.51 0.21 -4.97 118.94 118.77 3g0b s TRP 215 Ca -0.06 -2.33 -0.20 0.00 -2.12 0.00 0.00 56.10 51.40 3g0b s TRP 215 Cb -0.14 -1.98 -0.05 0.00 -0.81 0.00 0.00 33.47 30.49 3g0b s TRP 215 CO -0.02 -0.82 1.13 0.91 -0.51 0.00 0.00 176.95 177.64 3g0b n TRP 216 N 3.94 1.42 -2.45 -1.98 7.02 -1.26 -1.45 117.44 122.68 3g0b n TRP 216 Ca 0.05 0.44 -0.33 0.00 -1.02 0.00 0.00 57.50 56.64 3g0b n TRP 216 Cb 0.37 -2.23 -0.03 0.00 -2.42 0.00 0.00 31.31 27.00 3g0b n TRP 216 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 3g0b s SER 217 N -1.15 6.42 0.41 -0.99 1.04 0.14 -4.88 113.70 114.69 3g0b s SER 217 Ca 0.75 1.75 0.25 0.00 0.48 0.00 0.00 55.95 59.18 3g0b s SER 217 Cb -0.42 -2.54 1.31 0.00 0.10 0.00 0.00 66.02 64.47 3g0b s SER 217 CO 0.47 -0.73 1.65 -0.65 0.98 0.00 0.00 173.24 174.97 3g0b h PRO 218 N 1.21 0.17 -0.01 4.02 0.11 -1.88 0.43 132.00 136.04 3g0b h PRO 218 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3g0b h PRO 218 Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3g0b h PRO 218 CO 0.60 0.11 -0.34 0.27 -0.21 0.00 0.00 178.00 178.43 3g0b n ASN 219 N -4.78 1.64 0.00 -2.05 6.94 -1.26 -4.31 115.26 111.44 3g0b n ASN 219 Ca 0.34 -1.29 0.00 0.00 -0.02 0.00 0.00 54.58 53.62 3g0b n ASN 219 Cb 1.25 0.29 0.00 0.00 -2.36 0.00 0.00 39.78 38.96 3g0b n ASN 219 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3g0b n GLY 220 N 1.37 0.47 0.17 4.83 0.00 0.15 -4.56 105.19 107.62 3g0b n GLY 220 Ca 0.11 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.24 3g0b n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3g0b h THR 221 N 0.00 1.29 -3.92 2.61 2.02 -1.92 -3.46 112.91 109.53 3g0b h THR 221 Ca 0.00 -2.52 -0.69 0.00 0.77 0.00 0.00 66.41 63.98 3g0b h THR 221 Cb 0.00 2.81 -0.29 0.00 -1.74 0.00 0.00 68.15 68.93 3g0b h THR 221 CO 0.00 0.76 -0.84 -0.36 0.37 0.00 0.00 175.52 175.45 3g0b s PHE 222 N -2.86 2.56 -0.32 3.16 0.08 -1.26 0.08 117.98 119.41 3g0b s PHE 222 Ca -0.10 -0.57 -0.10 0.00 0.12 0.00 0.00 56.93 56.28 3g0b s PHE 222 Cb 0.05 -1.64 0.00 0.00 -0.57 0.00 0.00 43.02 40.86 3g0b s PHE 222 CO 0.93 -0.12 0.16 -1.17 -0.10 0.00 0.00 175.22 174.92 3g0b s LEU 223 N -0.22 4.23 -0.01 -0.37 2.96 0.44 0.25 118.68 125.96 3g0b s LEU 223 Ca -0.01 -0.64 -0.16 0.00 -0.22 0.00 0.00 54.13 53.10 3g0b s LEU 223 Cb -0.13 -2.00 -0.06 0.00 0.50 0.00 0.00 46.19 44.50 3g0b s LEU 223 CO 0.03 -0.24 0.44 0.00 -1.32 0.00 0.00 176.35 175.26 3g0b s ALA 224 N 1.59 3.65 0.07 5.97 0.00 -0.53 -0.74 121.76 131.78 3g0b s ALA 224 Ca 0.04 -0.18 -0.11 0.00 0.00 0.00 0.00 51.96 51.71 3g0b s ALA 224 Cb -0.18 -2.46 0.01 0.00 0.00 0.00 0.00 23.12 20.50 3g0b s ALA 224 CO 0.06 0.40 0.25 1.52 0.00 0.00 0.00 175.76 177.99 3g0b s TYR 225 N -0.84 0.02 -0.02 0.00 -0.85 0.24 0.67 117.35 116.56 3g0b s TYR 225 Ca 0.25 -0.31 0.01 0.00 -0.52 0.00 0.00 57.07 56.50 3g0b s TYR 225 Cb -0.17 0.03 -0.03 0.00 0.38 0.00 0.00 41.96 42.17 3g0b s TYR 225 CO 0.14 -0.53 -0.03 0.00 -1.52 0.00 0.00 175.55 173.61 3g0b s ALA 226 N -3.24 3.17 -0.14 9.51 0.00 -0.93 -0.54 121.76 129.59 3g0b s ALA 226 Ca -0.00 -0.94 -0.00 0.00 0.00 0.00 0.00 51.96 51.02 3g0b s ALA 226 Cb 0.02 -1.29 -0.01 0.00 0.00 0.00 0.00 23.12 21.84 3g0b s ALA 226 CO -0.08 0.62 -0.13 -1.14 0.00 0.00 0.00 175.76 175.03 3g0b s GLN 227 N -1.33 3.33 -0.02 0.00 0.74 0.65 -1.58 119.66 121.45 3g0b s GLN 227 Ca 0.17 -0.71 0.02 0.00 0.05 0.00 0.00 55.36 54.90 3g0b s GLN 227 Cb -0.11 -2.65 -0.03 0.00 1.10 0.00 0.00 33.01 31.32 3g0b s GLN 227 CO 0.07 0.13 -0.05 -0.06 -0.55 0.00 0.00 175.29 174.83 3g0b s PHE 228 N 0.57 2.95 -0.24 1.67 0.08 -0.39 -0.37 117.98 122.25 3g0b s PHE 228 Ca -0.08 0.01 -0.00 0.00 0.12 0.00 0.00 56.93 56.98 3g0b s PHE 228 Cb -0.16 -1.65 0.07 0.00 -0.57 0.00 0.00 43.02 40.71 3g0b s PHE 228 CO 0.03 0.39 -0.02 1.21 -0.10 0.00 0.00 175.22 176.74 3g0b s ASN 229 N -1.31 3.70 -0.13 1.36 2.47 0.11 -1.32 114.94 119.82 3g0b s ASN 229 Ca 0.17 -1.18 0.18 0.00 0.42 0.00 0.00 52.86 52.44 3g0b s ASN 229 Cb -0.11 -1.04 0.74 0.00 -1.45 0.00 0.00 41.25 39.38 3g0b s ASN 229 CO 0.07 -0.27 1.65 0.47 -3.72 0.00 0.00 177.10 175.29 3g0b n ASP 230 N 4.75 4.89 -0.18 -4.21 9.92 0.27 -1.51 116.55 130.48 3g0b n ASP 230 Ca -0.10 -2.51 -0.02 0.00 -0.53 0.00 0.00 54.79 51.63 3g0b n ASP 230 Cb 0.44 -0.60 0.05 0.00 -0.64 0.00 0.00 41.12 40.37 3g0b n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 3g0b h THR 231 N 4.09 0.41 -0.38 -3.53 2.02 -1.86 -0.46 112.91 113.20 3g0b h THR 231 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3g0b h THR 231 Cb 1.52 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 3g0b h THR 231 CO 0.27 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.54 3g0b n GLU 232 N -5.40 2.21 -2.41 6.66 1.02 -1.26 -4.91 120.64 116.55 3g0b n GLU 232 Ca 0.06 -1.85 -0.42 0.00 -0.02 0.00 0.00 57.16 54.93 3g0b n GLU 232 Cb 0.30 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.24 3g0b n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3g0b s VAL 233 N -1.51 4.07 0.50 2.62 1.01 -0.18 -4.71 120.40 122.20 3g0b s VAL 233 Ca 0.36 1.46 -0.21 0.00 0.00 0.00 0.00 61.98 63.59 3g0b s VAL 233 Cb 0.20 -3.93 -0.07 0.00 0.00 0.00 0.00 36.38 32.58 3g0b s VAL 233 CO 0.28 0.06 1.13 -2.84 0.00 0.00 0.00 175.10 173.73 3g0b s PRO 234 N 1.62 3.58 -0.07 2.72 0.02 -1.26 -4.73 135.00 136.88 3g0b s PRO 234 Ca 0.58 1.63 -0.19 0.00 0.02 0.00 0.00 61.00 63.05 3g0b s PRO 234 Cb -0.28 -2.17 -0.05 0.00 0.02 0.00 0.00 34.50 32.02 3g0b s PRO 234 CO 0.26 -0.67 0.51 -0.51 -0.33 0.00 0.00 177.00 176.27 3g0b s LEU 235 N -3.45 4.33 0.15 -5.54 1.43 -1.26 -0.77 118.68 113.57 3g0b s LEU 235 Ca 0.68 0.94 -0.30 0.00 -1.03 0.00 0.00 54.13 54.42 3g0b s LEU 235 Cb -0.25 -2.76 -0.07 0.00 0.03 0.00 0.00 46.19 43.14 3g0b s LEU 235 CO 0.29 0.05 0.97 -0.51 0.23 0.00 0.00 176.35 177.38 3g0b s ILE 236 N 0.25 4.31 -0.07 -0.59 1.10 0.62 -4.84 121.20 121.98 3g0b s ILE 236 Ca 0.28 2.02 0.04 0.00 -0.51 0.00 0.00 60.65 62.47 3g0b s ILE 236 Cb -0.16 -4.29 0.00 0.00 0.15 0.00 0.00 42.46 38.16 3g0b s ILE 236 CO 0.13 0.36 -0.18 -1.61 -2.11 0.00 0.00 174.94 171.53 3g0b s GLU 237 N -0.36 2.20 0.07 3.50 2.02 -1.26 -1.32 118.70 123.56 3g0b s GLU 237 Ca 0.46 -0.65 -0.06 0.00 0.02 0.00 0.00 54.97 54.74 3g0b s GLU 237 Cb -0.25 -1.77 -0.02 0.00 0.10 0.00 0.00 34.13 32.19 3g0b s GLU 237 CO 0.31 0.16 0.11 1.52 0.02 0.00 0.00 175.26 177.38 3g0b s TYR 238 N 0.33 0.28 0.24 1.61 -0.85 -0.61 -4.99 117.35 113.37 3g0b s TYR 238 Ca -0.12 -0.76 -0.30 0.00 -0.52 0.00 0.00 57.07 55.37 3g0b s TYR 238 Cb -0.15 -0.18 -0.09 0.00 0.38 0.00 0.00 41.96 41.92 3g0b s TYR 238 CO 0.05 -0.48 0.96 -1.12 -1.52 0.00 0.00 175.55 173.44 3g0b s SER 239 N -2.88 7.59 -0.16 -0.18 0.01 -1.26 -0.41 113.70 116.40 3g0b s SER 239 Ca 0.06 1.98 0.02 0.00 1.31 0.00 0.00 55.95 59.32 3g0b s SER 239 Cb 0.06 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.70 3g0b s SER 239 CO -0.11 0.10 -0.21 0.12 0.41 0.00 0.00 173.24 173.56 3g0b s PHE 240 N -1.10 2.72 -0.00 2.43 2.19 0.24 -4.67 117.98 119.79 3g0b s PHE 240 Ca 0.42 -1.52 0.08 0.00 0.33 0.00 0.00 56.93 56.24 3g0b s PHE 240 Cb -0.27 -1.87 -0.23 0.00 -1.31 0.00 0.00 43.02 39.34 3g0b s PHE 240 CO 0.33 -0.73 0.82 1.88 1.83 0.00 0.00 175.22 179.35 3g0b h TYR 241 N 7.71 0.08 -1.01 10.12 -1.99 -1.96 0.12 116.97 130.04 3g0b h TYR 241 Ca -0.41 -0.06 0.02 0.00 2.00 0.00 0.00 58.73 60.28 3g0b h TYR 241 Cb 1.16 -0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.88 3g0b h TYR 241 CO 0.47 1.09 -0.02 0.45 -0.00 0.00 0.00 178.16 180.15 3g0b n SER 242 N -3.19 -3.00 -4.54 3.88 2.88 -1.26 -4.72 113.62 103.67 3g0b n SER 242 Ca -0.13 0.07 -0.36 0.00 -1.33 0.00 0.00 58.87 57.12 3g0b n SER 242 Cb 1.02 -0.20 0.08 0.00 -0.75 0.00 0.00 64.21 64.36 3g0b n SER 242 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3g0b n ASP 243 N -1.07 -0.33 0.14 -3.46 2.03 -1.26 -4.86 116.55 107.74 3g0b n ASP 243 Ca 0.00 0.63 0.10 0.00 0.52 0.00 0.00 54.79 56.04 3g0b n ASP 243 Cb 0.03 -1.31 0.52 0.00 -0.72 0.00 0.00 41.12 39.64 3g0b n ASP 243 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 3g0b n GLU 244 N -1.34 0.13 0.06 -0.67 0.28 -1.26 -1.73 120.64 116.12 3g0b n GLU 244 Ca 0.12 0.60 0.12 0.00 -0.16 0.00 0.00 57.16 57.84 3g0b n GLU 244 Cb 0.50 -1.90 0.47 0.00 1.43 0.00 0.00 31.44 31.94 3g0b n GLU 244 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 3g0b n SER 245 N -2.18 0.43 -4.62 -1.84 3.41 -1.26 -4.65 113.62 102.91 3g0b n SER 245 Ca -0.01 0.56 -0.43 0.00 -0.26 0.00 0.00 58.87 58.73 3g0b n SER 245 Cb 0.05 -0.67 -0.02 0.00 -0.26 0.00 0.00 64.21 63.31 3g0b n SER 245 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3g0b s LEU 246 N -3.85 3.80 0.09 1.04 0.20 -0.70 -4.92 118.68 114.34 3g0b s LEU 246 Ca 0.10 0.92 -0.16 0.00 0.69 0.00 0.00 54.13 55.68 3g0b s LEU 246 Cb 0.13 -3.54 -0.09 0.00 -0.43 0.00 0.00 46.19 42.26 3g0b s LEU 246 CO 0.50 -1.09 1.43 -0.61 -0.29 0.00 0.00 176.35 176.28 3g0b h GLN 247 N 8.99 0.61 -5.17 1.98 4.15 -1.89 -3.42 115.11 120.36 3g0b h GLN 247 Ca -0.23 -0.30 -0.65 0.00 0.77 0.00 0.00 58.65 58.24 3g0b h GLN 247 Cb 1.08 -0.00 -0.25 0.00 0.21 0.00 0.00 27.48 28.52 3g0b h GLN 247 CO 1.06 0.89 -0.70 0.71 -1.93 0.00 0.00 178.83 178.86 3g0b s TYR 248 N -4.45 2.96 0.77 3.99 2.02 -1.26 -5.11 117.35 116.26 3g0b s TYR 248 Ca -0.13 -0.60 -0.15 0.00 -0.37 0.00 0.00 57.07 55.82 3g0b s TYR 248 Cb 0.08 -2.01 0.02 0.00 -0.40 0.00 0.00 41.96 39.65 3g0b s TYR 248 CO 0.80 -0.28 0.86 -2.30 -1.57 0.00 0.00 175.55 173.06 3g0b n PRO 249 N 4.08 0.30 -3.71 -1.71 -0.02 -1.26 -4.99 135.00 127.68 3g0b n PRO 249 Ca -0.18 0.16 -0.35 0.00 -2.02 0.00 0.00 63.50 61.11 3g0b n PRO 249 Cb 0.52 -2.14 -0.05 0.00 -0.02 0.00 0.00 33.50 31.81 3g0b n PRO 249 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3g0b s LYS 250 N -3.41 3.63 -0.28 -0.52 2.20 0.42 -4.91 119.74 116.87 3g0b s LYS 250 Ca 0.70 -0.01 -0.11 0.00 -0.36 0.00 0.00 55.97 56.19 3g0b s LYS 250 Cb -0.32 -3.06 -0.05 0.00 -1.51 0.00 0.00 37.83 32.89 3g0b s LYS 250 CO 0.54 0.63 0.18 0.99 -0.36 0.00 0.00 175.35 177.32 3g0b s THR 251 N -1.32 5.17 -0.06 3.43 2.01 -1.26 0.79 115.64 124.40 3g0b s THR 251 Ca 0.29 0.11 -0.21 0.00 0.31 0.00 0.00 61.69 62.18 3g0b s THR 251 Cb -0.13 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.87 3g0b s THR 251 CO 0.17 0.25 0.62 -0.69 -0.69 0.00 0.00 174.62 174.27 3g0b s VAL 252 N 1.74 5.04 -0.18 3.82 1.01 0.45 -4.94 120.40 127.33 3g0b s VAL 252 Ca 0.07 1.27 0.01 0.00 0.00 0.00 0.00 61.98 63.33 3g0b s VAL 252 Cb -0.16 -3.96 0.04 0.00 0.00 0.00 0.00 36.38 32.30 3g0b s VAL 252 CO 0.10 0.32 -0.12 -0.13 0.00 0.00 0.00 175.10 175.27 3g0b s ARG 253 N 0.45 2.17 -0.08 2.72 0.52 -1.26 -1.57 118.95 121.91 3g0b s ARG 253 Ca 0.33 -0.76 0.02 0.00 -0.52 0.00 0.00 55.73 54.80 3g0b s ARG 253 Cb -0.17 -2.33 0.02 0.00 0.52 0.00 0.00 34.95 32.98 3g0b s ARG 253 CO 0.16 -0.36 -0.11 0.08 0.02 0.00 0.00 175.30 175.09 3g0b s VAL 254 N 1.41 1.12 -0.02 3.52 1.01 -0.43 -4.95 120.40 122.06 3g0b s VAL 254 Ca 0.01 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.25 3g0b s VAL 254 Cb -0.15 -1.04 -0.08 0.00 0.00 0.00 0.00 36.38 35.11 3g0b s VAL 254 CO -0.09 0.36 1.92 -2.84 0.00 0.00 0.00 175.10 174.45 3g0b s PRO 255 N 0.88 4.02 -0.19 2.72 0.02 -1.26 -0.28 135.00 140.91 3g0b s PRO 255 Ca -0.10 2.42 -0.04 0.00 0.02 0.00 0.00 61.00 63.30 3g0b s PRO 255 Cb -0.15 -4.15 0.09 0.00 0.02 0.00 0.00 34.50 30.31 3g0b s PRO 255 CO 0.01 -1.08 0.29 -0.47 -0.33 0.00 0.00 177.00 175.42 3g0b s TYR 256 N 4.86 -0.50 -0.37 6.54 5.04 0.05 -4.57 117.35 128.40 3g0b s TYR 256 Ca 0.86 0.72 -0.25 0.00 -2.44 0.00 0.00 57.07 55.96 3g0b s TYR 256 Cb -0.39 -0.11 0.01 0.00 0.35 0.00 0.00 41.96 41.82 3g0b s TYR 256 CO 0.38 -0.54 0.87 -1.25 -1.34 0.00 0.00 175.55 173.67 3g0b s PRO 257 N 2.43 3.79 0.65 4.97 0.04 -1.26 -4.51 135.00 141.11 3g0b s PRO 257 Ca 0.06 0.45 -0.07 0.00 0.04 0.00 0.00 61.00 61.48 3g0b s PRO 257 Cb -0.14 -3.81 0.03 0.00 0.04 0.00 0.00 34.50 30.62 3g0b s PRO 257 CO -0.12 -0.92 0.98 0.15 0.04 0.00 0.00 177.00 177.13 3g0b s LYS 258 N 3.33 2.62 -0.34 4.56 1.02 -1.26 0.33 119.74 130.01 3g0b s LYS 258 Ca 0.35 -0.02 -0.39 0.00 0.02 0.00 0.00 55.97 55.93 3g0b s LYS 258 Cb -0.12 -2.19 -0.15 0.00 -0.52 0.00 0.00 37.83 34.85 3g0b s LYS 258 CO 0.18 -0.97 1.93 0.00 -0.92 0.00 0.00 175.35 175.58 3g0b n ALA 259 N -2.79 0.24 0.00 5.17 0.00 0.44 -0.44 120.51 123.13 3g0b n ALA 259 Ca 0.06 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.73 3g0b n ALA 259 Cb 0.59 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.74 3g0b n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g0b n GLY 260 N 5.37 1.13 3.84 0.00 0.00 -1.26 -4.78 105.19 109.49 3g0b n GLY 260 Ca 0.35 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.08 3g0b n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g0b s ALA 261 N -2.28 2.05 0.08 4.61 0.00 0.42 -4.95 121.76 121.69 3g0b s ALA 261 Ca 0.00 -0.73 -0.31 0.00 0.00 0.00 0.00 51.96 50.93 3g0b s ALA 261 Cb 0.00 -2.95 -0.09 0.00 0.00 0.00 0.00 23.12 20.08 3g0b s ALA 261 CO 0.00 -2.22 1.73 0.08 0.00 0.00 0.00 175.76 175.35 3g0b s VAL 262 N -3.47 2.89 0.55 0.00 1.01 -1.26 -4.88 120.40 115.25 3g0b s VAL 262 Ca 0.66 0.32 -0.07 0.00 0.00 0.00 0.00 61.98 62.89 3g0b s VAL 262 Cb -0.11 -3.21 -0.02 0.00 0.00 0.00 0.00 36.38 33.04 3g0b s VAL 262 CO 0.52 -0.00 0.89 0.20 0.00 0.00 0.00 175.10 176.70 3g0b s ASN 263 N 2.69 6.07 0.59 3.32 0.01 -1.26 -4.44 114.94 121.91 3g0b s ASN 263 Ca 0.77 1.01 -0.19 0.00 -0.71 0.00 0.00 52.86 53.74 3g0b s ASN 263 Cb -0.42 -2.17 -0.03 0.00 0.41 0.00 0.00 41.25 39.04 3g0b s ASN 263 CO 0.34 -0.79 1.26 -2.16 -1.51 0.00 0.00 177.10 174.24 3g0b s PRO 264 N -4.93 2.95 0.20 -0.60 0.04 -1.26 -4.73 135.00 126.67 3g0b s PRO 264 Ca 0.51 1.97 0.05 0.00 0.04 0.00 0.00 61.00 63.57 3g0b s PRO 264 Cb -0.11 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 3g0b s PRO 264 CO 0.48 -1.26 0.27 0.95 0.04 0.00 0.00 177.00 177.47 3g0b s THR 265 N -1.47 4.98 0.02 1.26 -4.23 -0.57 -4.90 115.64 110.72 3g0b s THR 265 Ca 0.77 -1.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.31 3g0b s THR 265 Cb -0.34 -3.63 -0.01 0.00 1.34 0.00 0.00 72.50 69.85 3g0b s THR 265 CO 0.38 -0.23 -0.10 0.54 -0.54 0.00 0.00 174.62 174.67 3g0b s VAL 266 N -1.90 0.79 0.14 2.29 0.11 -1.26 0.06 120.40 120.62 3g0b s VAL 266 Ca 0.33 -0.72 0.09 0.00 -2.93 0.00 0.00 61.98 58.76 3g0b s VAL 266 Cb -0.10 -0.72 -0.04 0.00 -1.53 0.00 0.00 36.38 34.00 3g0b s VAL 266 CO 0.27 0.01 -0.21 -0.54 -3.33 0.00 0.00 175.10 171.30 3g0b s LYS 267 N -0.79 1.24 -0.04 1.54 1.02 0.50 -4.98 119.74 118.24 3g0b s LYS 267 Ca 0.00 -1.30 0.07 0.00 0.02 0.00 0.00 55.97 54.76 3g0b s LYS 267 Cb -0.06 -1.48 -0.02 0.00 -0.52 0.00 0.00 37.83 35.76 3g0b s LYS 267 CO 0.00 0.33 -0.25 0.12 -0.92 0.00 0.00 175.35 174.63 3g0b s PHE 268 N -1.49 2.39 0.05 3.18 5.36 -1.25 -0.25 117.98 125.96 3g0b s PHE 268 Ca 0.12 -0.52 0.02 0.00 -0.96 0.00 0.00 56.93 55.58 3g0b s PHE 268 Cb -0.08 -1.54 -0.03 0.00 -0.34 0.00 0.00 43.02 41.03 3g0b s PHE 268 CO 0.06 -0.09 -0.07 -0.06 -1.46 0.00 0.00 175.22 173.60 3g0b s PHE 269 N -0.46 0.66 0.00 10.12 0.40 0.30 -1.59 117.98 127.41 3g0b s PHE 269 Ca 0.05 -0.56 0.07 0.00 -0.60 0.00 0.00 56.93 55.90 3g0b s PHE 269 Cb -0.11 -0.40 -0.02 0.00 0.51 0.00 0.00 43.02 43.00 3g0b s PHE 269 CO 0.01 -0.10 -0.22 0.08 0.70 0.00 0.00 175.22 175.68 3g0b s VAL 270 N -1.68 1.74 -0.04 -0.44 1.01 0.71 -0.60 120.40 121.11 3g0b s VAL 270 Ca -0.08 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 60.89 3g0b s VAL 270 Cb -0.08 -1.47 0.01 0.00 0.00 0.00 0.00 36.38 34.84 3g0b s VAL 270 CO -0.00 0.41 -0.10 0.54 0.00 0.00 0.00 175.10 175.94 3g0b s VAL 271 N -0.60 0.93 -0.46 2.92 0.11 0.08 -0.89 120.40 122.49 3g0b s VAL 271 Ca 0.08 -0.41 -0.29 0.00 -2.93 0.00 0.00 61.98 58.44 3g0b s VAL 271 Cb -0.09 -0.84 0.02 0.00 -1.53 0.00 0.00 36.38 33.94 3g0b s VAL 271 CO 0.00 0.29 1.28 0.21 -3.33 0.00 0.00 175.10 173.55 3g0b s ASN 272 N 0.40 6.46 0.00 3.54 3.84 -1.26 -0.42 114.94 127.49 3g0b s ASN 272 Ca -0.07 0.59 0.30 0.00 0.21 0.00 0.00 52.86 53.89 3g0b s ASN 272 Cb -0.12 -2.55 1.42 0.00 -0.55 0.00 0.00 41.25 39.46 3g0b s ASN 272 CO 0.02 -1.37 1.98 0.35 -2.79 0.00 0.00 177.10 175.28 3g0b n THR 273 N 6.95 0.00 0.57 -5.21 -2.24 0.11 -3.42 114.28 111.05 3g0b n THR 273 Ca 0.14 -0.02 0.11 0.00 -2.27 0.00 0.00 64.05 62.01 3g0b n THR 273 Cb 0.49 -0.33 0.04 0.00 -2.10 0.00 0.00 70.33 68.43 3g0b n THR 273 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3g0b n ASP 274 N -1.13 0.62 -1.23 3.42 8.00 -1.25 -4.02 116.55 120.96 3g0b n ASP 274 Ca 0.15 -0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.48 3g0b n ASP 274 Cb 0.25 0.72 0.24 0.00 -0.02 0.00 0.00 41.12 42.31 3g0b n ASP 274 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3g0b n SER 275 N -1.97 3.57 -4.58 -2.24 3.41 -1.22 -4.98 113.62 105.60 3g0b n SER 275 Ca 0.02 -3.34 -0.41 0.00 -0.26 0.00 0.00 58.87 54.89 3g0b n SER 275 Cb 0.44 -0.62 -0.03 0.00 -0.26 0.00 0.00 64.21 63.73 3g0b n SER 275 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3g0b s LEU 276 N -3.02 3.42 0.38 1.04 1.02 -1.26 -4.98 118.68 115.28 3g0b s LEU 276 Ca 0.46 0.87 -0.16 0.00 0.02 0.00 0.00 54.13 55.31 3g0b s LEU 276 Cb 0.39 -3.07 -0.09 0.00 0.02 0.00 0.00 46.19 43.43 3g0b s LEU 276 CO 0.07 -2.01 0.83 -0.55 0.02 0.00 0.00 176.35 174.70 3g0b s SER 277 N 7.02 6.78 0.00 2.29 0.15 -1.26 -4.99 113.70 123.69 3g0b s SER 277 Ca 0.74 1.41 0.22 0.00 0.70 0.00 0.00 55.95 59.03 3g0b s SER 277 Cb -0.18 -2.43 -0.05 0.00 -1.71 0.00 0.00 66.02 61.65 3g0b s SER 277 CO 0.28 -0.31 1.03 -0.24 1.20 0.00 0.00 173.24 175.20 3g0b n SER 278 N -0.66 1.07 -0.03 5.45 2.88 -1.26 -4.25 113.62 116.81 3g0b n SER 278 Ca 0.05 -0.95 -0.00 0.00 -1.33 0.00 0.00 58.87 56.63 3g0b n SER 278 Cb 0.54 0.78 -0.14 0.00 -0.75 0.00 0.00 64.21 64.64 3g0b n SER 278 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 3g0b n VAL 279 N -1.26 0.85 -4.56 2.46 0.31 -1.26 -4.94 118.33 109.93 3g0b n VAL 279 Ca 0.05 -0.69 -0.21 0.00 -0.01 0.00 0.00 64.34 63.48 3g0b n VAL 279 Cb 0.35 -0.37 -0.15 0.00 -0.91 0.00 0.00 33.84 32.77 3g0b n VAL 279 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3g0b s THR 280 N -2.96 0.98 0.25 2.52 -1.32 -1.26 -5.13 115.64 108.72 3g0b s THR 280 Ca -0.07 -0.53 -0.30 0.00 -1.21 0.00 0.00 61.69 59.58 3g0b s THR 280 Cb 0.09 -0.82 -0.14 0.00 -1.51 0.00 0.00 72.50 70.12 3g0b s THR 280 CO 0.85 0.28 1.16 0.59 -2.21 0.00 0.00 174.62 175.29 3g0b n ASN 281 N 2.79 1.73 -4.67 8.08 3.02 -1.26 -4.44 115.26 120.51 3g0b n ASN 281 Ca -0.14 1.16 -0.47 0.00 -0.03 0.00 0.00 54.58 55.10 3g0b n ASN 281 Cb 0.56 -1.31 -0.05 0.00 -0.61 0.00 0.00 39.78 38.37 3g0b n ASN 281 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g0b n ALA 282 N 0.93 0.99 -2.87 5.41 0.00 -1.26 -4.96 120.51 118.75 3g0b n ALA 282 Ca 0.11 0.40 -0.40 0.00 0.00 0.00 0.00 53.44 53.55 3g0b n ALA 282 Cb 0.30 -2.37 -0.11 0.00 0.00 0.00 0.00 19.45 17.27 3g0b n ALA 282 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3g0b s THR 283 N 1.86 4.49 -0.15 0.00 -1.32 -1.26 -4.95 115.64 114.30 3g0b s THR 283 Ca 0.84 -0.91 -0.10 0.00 -1.21 0.00 0.00 61.69 60.30 3g0b s THR 283 Cb -0.72 -3.52 -0.05 0.00 -1.51 0.00 0.00 72.50 66.71 3g0b s THR 283 CO 0.43 -0.25 0.19 -0.44 -2.21 0.00 0.00 174.62 172.35 3g0b s SER 284 N 1.55 6.36 -0.17 8.08 0.01 -1.26 -4.67 113.70 123.60 3g0b s SER 284 Ca 0.02 0.42 -0.19 0.00 1.31 0.00 0.00 55.95 57.51 3g0b s SER 284 Cb -0.19 -2.11 -0.03 0.00 0.21 0.00 0.00 66.02 63.89 3g0b s SER 284 CO 0.06 0.25 0.54 -0.63 0.41 0.00 0.00 173.24 173.88 3g0b s ILE 285 N -0.20 5.11 -0.20 1.44 -1.09 -0.07 -4.91 121.20 121.28 3g0b s ILE 285 Ca 0.13 1.03 -0.26 0.00 -2.23 0.00 0.00 60.65 59.33 3g0b s ILE 285 Cb -0.12 -3.87 -0.01 0.00 -1.58 0.00 0.00 42.46 36.88 3g0b s ILE 285 CO 0.02 0.21 0.88 -1.58 -1.23 0.00 0.00 174.94 173.24 3g0b s GLN 286 N 1.34 4.25 -0.38 2.79 0.74 -1.26 -0.21 119.66 126.93 3g0b s GLN 286 Ca 0.26 1.07 -0.21 0.00 0.05 0.00 0.00 55.36 56.53 3g0b s GLN 286 Cb -0.16 -3.61 0.01 0.00 1.10 0.00 0.00 33.01 30.35 3g0b s GLN 286 CO 0.11 -0.45 0.69 0.42 -0.55 0.00 0.00 175.29 175.50 3g0b s ILE 287 N 2.58 4.81 0.43 -2.34 1.01 -0.62 -4.89 121.20 122.19 3g0b s ILE 287 Ca 0.39 0.56 -0.11 0.00 0.00 0.00 0.00 60.65 61.48 3g0b s ILE 287 Cb -0.16 -4.16 -0.06 0.00 0.01 0.00 0.00 42.46 38.09 3g0b s ILE 287 CO 0.10 -0.44 0.81 0.42 0.00 0.00 0.00 174.94 175.82 3g0b s THR 288 N 2.89 4.76 0.58 2.92 -4.23 -1.26 -3.93 115.64 117.38 3g0b s THR 288 Ca 0.26 0.67 -0.19 0.00 -1.18 0.00 0.00 61.69 61.26 3g0b s THR 288 Cb -0.14 -3.74 -0.04 0.00 1.34 0.00 0.00 72.50 69.92 3g0b s THR 288 CO 0.17 -0.59 1.19 0.00 -0.54 0.00 0.00 174.62 174.85 3g0b s ALA 289 N -2.46 2.58 0.78 3.99 0.00 -1.26 -4.99 121.76 120.40 3g0b s ALA 289 Ca 0.52 0.95 -0.14 0.00 0.00 0.00 0.00 51.96 53.29 3g0b s ALA 289 Cb -0.10 -3.43 0.05 0.00 0.00 0.00 0.00 23.12 19.64 3g0b s ALA 289 CO 0.33 -1.07 1.06 -2.30 0.00 0.00 0.00 175.76 173.77 3g0b n PRO 290 N -1.54 0.29 -0.32 0.00 -0.02 -1.26 -4.76 135.00 127.39 3g0b n PRO 290 Ca 0.13 0.17 0.14 0.00 -2.02 0.00 0.00 63.50 61.92 3g0b n PRO 290 Cb 0.50 -2.31 0.37 0.00 -0.02 0.00 0.00 33.50 32.04 3g0b n PRO 290 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g0b h ALA 291 N -0.67 1.82 0.00 3.55 0.00 -2.00 -1.58 119.26 120.39 3g0b h ALA 291 Ca -0.47 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3g0b h ALA 291 Cb 1.31 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3g0b h ALA 291 CO 0.46 -0.16 0.00 -1.13 0.00 0.00 0.00 179.25 178.42 3g0b n SER 292 N -4.67 0.00 -0.12 0.00 3.41 -1.26 -2.85 113.62 108.13 3g0b n SER 292 Ca 0.22 0.46 -0.23 0.00 -0.26 0.00 0.00 58.87 59.05 3g0b n SER 292 Cb 0.59 -0.48 -0.11 0.00 -0.26 0.00 0.00 64.21 63.95 3g0b n SER 292 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3g0b n MET 293 N -1.48 0.63 0.30 4.33 2.00 -0.62 -4.41 117.12 117.87 3g0b n MET 293 Ca 0.05 0.24 0.18 0.00 0.00 0.00 0.00 57.70 58.17 3g0b n MET 293 Cb 0.23 -1.55 0.95 0.00 0.00 0.00 0.00 33.22 32.85 3g0b n MET 293 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 3g0b h LEU 294 N -0.46 0.00 -2.00 4.03 3.38 -1.34 -1.91 115.31 117.00 3g0b h LEU 294 Ca -0.60 0.00 0.35 0.00 0.09 0.00 0.00 57.88 57.72 3g0b h LEU 294 Cb 1.76 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.46 3g0b h LEU 294 CO -0.21 0.00 0.87 0.16 0.09 0.00 0.00 178.44 179.34 3g0b h ILE 295 N 0.00 0.40 -0.51 1.22 3.07 -1.74 -3.46 117.51 116.49 3g0b h ILE 295 Ca 0.03 -0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.44 3g0b h ILE 295 Cb 0.44 0.40 0.00 0.00 -0.27 0.00 0.00 36.82 37.39 3g0b h ILE 295 CO -0.00 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.71 3g0b n GLY 296 N -1.77 2.76 3.74 0.16 0.00 -0.72 -5.13 105.19 104.23 3g0b n GLY 296 Ca 0.26 -0.61 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 3g0b n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3g0b s ASP 297 N 2.00 6.88 0.21 1.61 1.11 -1.26 -4.96 116.67 122.26 3g0b s ASP 297 Ca 0.00 2.45 -0.12 0.00 0.18 0.00 0.00 52.55 55.06 3g0b s ASP 297 Cb 0.00 -2.62 -0.00 0.00 1.07 0.00 0.00 42.92 41.37 3g0b s ASP 297 CO 0.00 -0.52 0.40 -1.38 1.18 0.00 0.00 175.17 174.85 3g0b s HIS 298 N -0.10 0.34 0.13 4.23 -3.43 -1.26 -1.15 115.29 114.05 3g0b s HIS 298 Ca 0.55 -0.69 0.07 0.00 -0.80 0.00 0.00 55.06 54.20 3g0b s HIS 298 Cb -0.37 0.10 -0.04 0.00 -1.43 0.00 0.00 32.58 30.84 3g0b s HIS 298 CO 0.40 -0.87 -0.17 0.71 -2.00 0.00 0.00 174.74 172.81 3g0b s TYR 299 N -3.99 1.64 -0.22 0.38 2.02 0.37 -4.83 117.35 112.72 3g0b s TYR 299 Ca 0.19 -0.48 -0.25 0.00 -0.37 0.00 0.00 57.07 56.16 3g0b s TYR 299 Cb 0.01 -0.85 -0.01 0.00 -0.40 0.00 0.00 41.96 40.71 3g0b s TYR 299 CO 0.04 0.22 0.83 -1.17 -1.57 0.00 0.00 175.55 173.91 3g0b s LEU 300 N -2.35 4.11 -0.01 -1.29 2.96 -1.26 -0.16 118.68 120.69 3g0b s LEU 300 Ca 0.10 1.09 0.06 0.00 -0.22 0.00 0.00 54.13 55.16 3g0b s LEU 300 Cb -0.07 -3.21 -0.09 0.00 0.50 0.00 0.00 46.19 43.32 3g0b s LEU 300 CO 0.05 -0.48 0.15 0.00 -1.32 0.00 0.00 176.35 174.75 3g0b s ASP 302 N -2.52 -0.43 -0.09 0.00 -1.08 -0.96 -4.90 116.67 106.69 3g0b s ASP 302 Ca -0.02 0.80 0.01 0.00 -0.52 0.00 0.00 52.55 52.82 3g0b s ASP 302 Cb 0.04 0.82 0.02 0.00 -1.46 0.00 0.00 42.92 42.34 3g0b s ASP 302 CO 0.25 -0.17 -0.09 -0.69 0.52 0.00 0.00 175.17 174.98 3g0b s VAL 303 N 0.10 1.04 -0.13 1.11 1.01 -1.26 -0.86 120.40 121.41 3g0b s VAL 303 Ca -0.01 -0.35 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 3g0b s VAL 303 Cb -0.03 -1.02 0.06 0.00 0.00 0.00 0.00 36.38 35.38 3g0b s VAL 303 CO 0.01 0.36 0.12 -0.89 0.00 0.00 0.00 175.10 174.69 3g0b s THR 304 N 1.30 -0.16 0.16 3.92 2.01 0.13 -5.01 115.64 117.98 3g0b s THR 304 Ca -0.03 0.09 -0.31 0.00 0.31 0.00 0.00 61.69 61.76 3g0b s THR 304 Cb -0.14 -0.43 -0.08 0.00 0.01 0.00 0.00 72.50 71.86 3g0b s THR 304 CO -0.04 -0.08 1.34 0.26 -0.69 0.00 0.00 174.62 175.42 3g0b s TRP 305 N 2.20 3.25 -0.26 4.92 0.52 -1.26 0.74 118.94 129.06 3g0b s TRP 305 Ca 0.04 1.11 -0.11 0.00 0.02 0.00 0.00 56.10 57.16 3g0b s TRP 305 Cb -0.14 -3.63 -0.15 0.00 -1.15 0.00 0.00 33.47 28.40 3g0b s TRP 305 CO -0.07 -2.08 -0.21 0.00 0.02 0.00 0.00 176.95 174.60 3g0b n ALA 306 N 3.24 1.18 -3.40 0.98 0.00 0.96 -4.88 120.51 118.59 3g0b n ALA 306 Ca 0.09 -1.00 -0.05 0.00 0.00 0.00 0.00 53.44 52.48 3g0b n ALA 306 Cb 0.43 -0.06 -0.01 0.00 0.00 0.00 0.00 19.45 19.81 3g0b n ALA 306 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3g0b n THR 307 N -4.00 0.00 0.06 0.00 -2.24 -0.72 -4.65 114.28 102.74 3g0b n THR 307 Ca -0.49 -0.45 0.08 0.00 -2.27 0.00 0.00 64.05 60.93 3g0b n THR 307 Cb 0.90 0.20 0.53 0.00 -2.10 0.00 0.00 70.33 69.85 3g0b n THR 307 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3g0b h GLN 308 N 0.00 0.30 0.00 -0.78 1.08 -1.97 -3.17 115.11 110.57 3g0b h GLN 308 Ca -0.05 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 3g0b h GLN 308 Cb 0.22 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 3g0b h GLN 308 CO 0.07 0.20 -0.12 0.39 -0.95 0.00 0.00 178.83 178.42 3g0b n GLU 309 N -4.49 1.08 -4.04 1.46 1.02 -1.26 -4.81 120.64 109.60 3g0b n GLU 309 Ca 0.03 -2.03 -0.17 0.00 -0.02 0.00 0.00 57.16 54.98 3g0b n GLU 309 Cb 0.18 -1.18 -0.15 0.00 -0.02 0.00 0.00 31.44 30.26 3g0b n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3g0b s ARG 310 N -1.91 0.41 0.01 3.49 3.52 -1.20 0.56 118.95 123.82 3g0b s ARG 310 Ca 0.20 -0.05 0.01 0.00 -0.13 0.00 0.00 55.73 55.76 3g0b s ARG 310 Cb 0.18 -0.47 -0.01 0.00 -1.56 0.00 0.00 34.95 33.09 3g0b s ARG 310 CO 0.02 -0.03 -0.05 -1.50 -0.81 0.00 0.00 175.30 172.93 3g0b s ILE 311 N 0.51 0.36 0.04 4.11 2.07 -0.37 -0.03 121.20 127.89 3g0b s ILE 311 Ca -0.05 -0.50 0.07 0.00 -1.41 0.00 0.00 60.65 58.75 3g0b s ILE 311 Cb -0.09 -0.36 -0.03 0.00 0.13 0.00 0.00 42.46 42.11 3g0b s ILE 311 CO -0.01 -0.10 -0.16 -0.94 -1.91 0.00 0.00 174.94 171.82 3g0b s SER 312 N -0.65 3.94 -0.04 4.50 1.04 0.23 -0.60 113.70 122.12 3g0b s SER 312 Ca -0.03 -0.40 0.02 0.00 0.48 0.00 0.00 55.95 56.02 3g0b s SER 312 Cb -0.05 -0.68 0.01 0.00 0.10 0.00 0.00 66.02 65.40 3g0b s SER 312 CO -0.00 0.25 -0.08 -0.76 0.98 0.00 0.00 173.24 173.63 3g0b s LEU 313 N -1.52 1.65 -0.11 2.42 1.02 -0.20 -0.69 118.68 121.25 3g0b s LEU 313 Ca 0.15 -0.18 0.00 0.00 0.02 0.00 0.00 54.13 54.13 3g0b s LEU 313 Cb -0.11 -0.55 -0.02 0.00 0.02 0.00 0.00 46.19 45.53 3g0b s LEU 313 CO 0.06 0.03 -0.12 -1.10 0.02 0.00 0.00 176.35 175.24 3g0b s GLN 314 N 0.44 3.17 0.10 1.70 -0.21 -0.04 -0.52 119.66 124.30 3g0b s GLN 314 Ca -0.07 -0.66 0.10 0.00 0.02 0.00 0.00 55.36 54.75 3g0b s GLN 314 Cb -0.11 -2.60 -0.04 0.00 1.00 0.00 0.00 33.01 31.27 3g0b s GLN 314 CO 0.01 0.34 -0.26 -1.58 -2.12 0.00 0.00 175.29 171.67 3g0b s TRP 315 N 0.04 2.33 -0.07 0.91 0.52 -0.34 -0.59 118.94 121.73 3g0b s TRP 315 Ca -0.04 -0.38 0.01 0.00 0.02 0.00 0.00 56.10 55.71 3g0b s TRP 315 Cb -0.14 -1.31 0.02 0.00 -1.15 0.00 0.00 33.47 30.89 3g0b s TRP 315 CO 0.04 0.27 -0.09 -1.17 0.02 0.00 0.00 176.95 176.02 3g0b s LEU 316 N -1.78 1.42 0.76 2.99 0.20 0.78 -1.65 118.68 121.39 3g0b s LEU 316 Ca 0.13 -0.26 -0.14 0.00 0.69 0.00 0.00 54.13 54.56 3g0b s LEU 316 Cb -0.10 -0.74 0.05 0.00 -0.43 0.00 0.00 46.19 44.97 3g0b s LEU 316 CO 0.05 -0.03 1.20 -0.13 -0.29 0.00 0.00 176.35 177.14 3g0b s ARG 317 N 1.03 1.99 0.41 1.98 0.52 -0.91 0.14 118.95 124.11 3g0b s ARG 317 Ca -0.08 1.72 0.12 0.00 -0.52 0.00 0.00 55.73 56.97 3g0b s ARG 317 Cb -0.15 -1.82 0.86 0.00 0.52 0.00 0.00 34.95 34.37 3g0b s ARG 317 CO -0.00 -1.94 1.93 -0.09 0.02 0.00 0.00 175.30 175.21 3g0b h ARG 318 N -0.53 0.08 -5.90 3.54 2.43 -1.46 -3.18 114.38 109.36 3g0b h ARG 318 Ca -0.47 -0.02 -0.59 0.00 -0.81 0.00 0.00 59.98 58.09 3g0b h ARG 318 Cb 1.29 -0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 30.72 3g0b h ARG 318 CO 0.49 0.29 0.89 0.42 -1.51 0.00 0.00 179.97 180.55 3g0b s ILE 319 N -4.57 4.03 0.00 1.20 1.01 -1.26 -4.73 121.20 116.87 3g0b s ILE 319 Ca -0.04 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.48 3g0b s ILE 319 Cb 0.15 -4.84 0.00 0.00 0.01 0.00 0.00 42.46 37.79 3g0b s ILE 319 CO 0.72 -1.69 1.65 0.00 0.00 0.00 0.00 174.94 175.61 3g0b n GLN 320 N 8.52 0.99 -0.36 2.79 6.02 -1.20 -3.50 117.38 130.64 3g0b n GLN 320 Ca 0.05 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.11 3g0b n GLN 320 Cb 0.48 -1.00 0.24 0.00 1.02 0.00 0.00 30.24 30.97 3g0b n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3g0b n ASN 321 N 1.17 3.67 -3.69 1.08 0.23 -1.26 -0.40 115.26 116.05 3g0b n ASN 321 Ca 0.00 -2.39 -0.16 0.00 -0.53 0.00 0.00 54.58 51.50 3g0b n ASN 321 Cb 0.50 -0.41 -0.16 0.00 -2.08 0.00 0.00 39.78 37.63 3g0b n ASN 321 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 3g0b s TYR 322 N -1.70 -0.15 0.07 -2.53 5.04 -1.23 -1.51 117.35 115.33 3g0b s TYR 322 Ca 0.36 0.54 0.02 0.00 -2.44 0.00 0.00 57.07 55.55 3g0b s TYR 322 Cb 0.24 -0.23 -0.03 0.00 0.35 0.00 0.00 41.96 42.28 3g0b s TYR 322 CO 0.17 -0.23 -0.07 -1.54 -1.34 0.00 0.00 175.55 172.53 3g0b s SER 323 N 1.97 0.99 -0.04 4.32 1.04 0.02 -2.13 113.70 119.87 3g0b s SER 323 Ca -0.00 -0.75 0.01 0.00 0.48 0.00 0.00 55.95 55.68 3g0b s SER 323 Cb -0.12 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.09 3g0b s SER 323 CO -0.05 -0.32 -0.03 -0.69 0.98 0.00 0.00 173.24 173.13 3g0b s VAL 324 N -2.37 0.40 -0.26 5.02 1.01 -0.66 -1.86 120.40 121.67 3g0b s VAL 324 Ca -0.00 -0.04 -0.11 0.00 0.00 0.00 0.00 61.98 61.83 3g0b s VAL 324 Cb -0.03 -0.45 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 3g0b s VAL 324 CO -0.02 0.19 0.18 -0.32 0.00 0.00 0.00 175.10 175.13 3g0b s MET 325 N 0.97 4.00 -0.06 2.72 1.75 0.91 -1.20 119.30 128.39 3g0b s MET 325 Ca -0.10 -0.30 -0.03 0.00 -1.25 0.00 0.00 55.69 54.01 3g0b s MET 325 Cb -0.14 -3.60 -0.04 0.00 2.84 0.00 0.00 34.83 33.89 3g0b s MET 325 CO -0.01 -0.07 0.08 0.34 -0.65 0.00 0.00 175.02 174.71 3g0b s ASP 326 N 1.44 5.77 -0.15 1.11 3.68 0.32 -1.46 116.67 127.39 3g0b s ASP 326 Ca 0.07 0.24 0.02 0.00 2.13 0.00 0.00 52.55 55.01 3g0b s ASP 326 Cb -0.15 -1.72 0.02 0.00 -1.45 0.00 0.00 42.92 39.62 3g0b s ASP 326 CO 0.08 0.34 -0.20 -0.63 0.13 0.00 0.00 175.17 174.89 3g0b s ILE 327 N -1.07 1.95 -0.11 4.11 1.01 -1.26 -1.03 121.20 124.79 3g0b s ILE 327 Ca 0.18 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.97 3g0b s ILE 327 Cb -0.12 -1.75 0.01 0.00 0.01 0.00 0.00 42.46 40.61 3g0b s ILE 327 CO 0.08 0.52 -0.17 0.00 0.00 0.00 0.00 174.94 175.38 3g0b s ASP 329 N 0.90 6.67 0.32 0.00 1.11 0.22 -1.23 116.67 124.66 3g0b s ASP 329 Ca -0.08 0.80 -0.29 0.00 0.18 0.00 0.00 52.55 53.17 3g0b s ASP 329 Cb -0.15 -2.22 -0.10 0.00 1.07 0.00 0.00 42.92 41.52 3g0b s ASP 329 CO -0.01 0.27 1.35 -0.47 1.18 0.00 0.00 175.17 177.49 3g0b s TYR 330 N -0.65 3.00 -0.36 4.23 5.04 0.19 -0.58 117.35 128.22 3g0b s TYR 330 Ca 0.21 1.31 -0.06 0.00 -2.44 0.00 0.00 57.07 56.10 3g0b s TYR 330 Cb -0.15 -3.74 0.05 0.00 0.35 0.00 0.00 41.96 38.47 3g0b s TYR 330 CO 0.10 -2.13 0.13 0.34 -1.34 0.00 0.00 175.55 172.66 3g0b s ASP 331 N -0.27 5.34 0.10 4.32 -1.08 0.19 -4.92 116.67 120.34 3g0b s ASP 331 Ca 0.51 -1.30 -0.28 0.00 -0.52 0.00 0.00 52.55 50.96 3g0b s ASP 331 Cb -0.41 -1.87 -0.12 0.00 -1.46 0.00 0.00 42.92 39.06 3g0b s ASP 331 CO 0.52 -0.38 1.64 -0.33 0.52 0.00 0.00 175.17 177.14 3g0b h GLU 332 N 8.22 -0.53 0.00 4.34 5.08 -1.95 0.28 114.58 130.02 3g0b h GLU 332 Ca -0.22 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 3g0b h GLU 332 Cb 1.08 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3g0b h GLU 332 CO 0.63 -0.35 0.00 -1.13 -1.00 0.00 0.00 179.01 177.16 3g0b n SER 333 N -5.38 0.42 -0.11 1.42 3.41 -1.26 -3.58 113.62 108.54 3g0b n SER 333 Ca -0.09 0.61 -0.17 0.00 -0.26 0.00 0.00 58.87 58.96 3g0b n SER 333 Cb 0.29 -0.70 -0.09 0.00 -0.26 0.00 0.00 64.21 63.45 3g0b n SER 333 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3g0b n SER 334 N -1.98 2.11 0.00 4.04 7.64 -0.98 -5.01 113.62 119.45 3g0b n SER 334 Ca 0.02 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.92 3g0b n SER 334 Cb 0.19 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.95 3g0b n SER 334 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g0b n GLY 335 N 2.21 0.75 3.84 0.23 0.00 0.96 -5.08 105.19 108.10 3g0b n GLY 335 Ca -0.39 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.41 3g0b n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g0b s ARG 336 N -0.71 2.46 -0.15 1.61 0.52 -1.22 -4.87 118.95 116.60 3g0b s ARG 336 Ca 0.00 -1.60 -0.04 0.00 -0.52 0.00 0.00 55.73 53.57 3g0b s ARG 336 Cb 0.00 -2.28 -0.03 0.00 0.52 0.00 0.00 34.95 33.16 3g0b s ARG 336 CO 0.00 -0.15 -0.00 -1.58 0.02 0.00 0.00 175.30 173.59 3g0b s TRP 337 N -2.49 3.12 -0.10 -0.53 0.52 -1.26 0.56 118.94 118.75 3g0b s TRP 337 Ca 0.46 -0.09 0.03 0.00 0.02 0.00 0.00 56.10 56.52 3g0b s TRP 337 Cb -0.02 -1.95 -0.01 0.00 -1.15 0.00 0.00 33.47 30.34 3g0b s TRP 337 CO 0.26 0.13 -0.20 -0.80 0.02 0.00 0.00 176.95 176.36 3g0b s ASN 338 N 0.09 3.43 -0.27 2.95 0.01 0.25 -4.93 114.94 116.47 3g0b s ASN 338 Ca 0.02 -0.46 0.01 0.00 -0.71 0.00 0.00 52.86 51.72 3g0b s ASN 338 Cb -0.13 -1.36 0.07 0.00 0.41 0.00 0.00 41.25 40.24 3g0b s ASN 338 CO 0.02 0.18 -0.01 0.00 -1.51 0.00 0.00 177.10 175.78 3g0b s LEU 340 N 1.30 4.03 0.36 0.00 1.43 -1.25 -4.96 118.68 119.59 3g0b s LEU 340 Ca -0.00 2.11 0.19 0.00 -1.03 0.00 0.00 54.13 55.41 3g0b s LEU 340 Cb -0.19 -4.29 0.45 0.00 0.03 0.00 0.00 46.19 42.20 3g0b s LEU 340 CO -0.09 -0.71 1.62 0.58 0.23 0.00 0.00 176.35 177.97 3g0b h VAL 341 N 1.93 0.65 0.00 -1.59 2.07 -1.98 -2.75 116.25 114.57 3g0b h VAL 341 Ca -0.49 -1.63 -0.03 0.00 0.82 0.00 0.00 66.70 65.36 3g0b h VAL 341 Cb 1.23 2.10 -0.00 0.00 -1.52 0.00 0.00 31.29 33.10 3g0b h VAL 341 CO 0.61 0.33 -0.16 0.00 0.02 0.00 0.00 177.57 178.36 3g0b h ALA 342 N 1.67 0.92 -0.33 1.67 0.00 -1.93 -3.07 119.26 118.18 3g0b h ALA 342 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3g0b h ALA 342 Cb 1.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3g0b h ALA 342 CO 0.04 0.20 0.00 0.54 0.00 0.00 0.00 179.25 180.04 3g0b n ARG 343 N -3.17 1.79 -2.86 0.00 1.74 -1.04 -4.79 116.66 108.33 3g0b n ARG 343 Ca 0.02 -1.19 -0.38 0.00 -0.77 0.00 0.00 57.85 55.53 3g0b n ARG 343 Cb 0.54 -1.27 -0.06 0.00 -1.02 0.00 0.00 32.46 30.65 3g0b n ARG 343 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3g0b s GLN 344 N -1.57 4.60 -0.07 5.56 -0.21 -1.16 -4.16 119.66 122.65 3g0b s GLN 344 Ca 0.22 1.27 0.03 0.00 0.02 0.00 0.00 55.36 56.90 3g0b s GLN 344 Cb 0.12 -3.02 0.00 0.00 1.00 0.00 0.00 33.01 31.11 3g0b s GLN 344 CO 0.15 0.42 -0.17 -1.01 -2.12 0.00 0.00 175.29 172.55 3g0b s HIS 345 N -1.40 1.87 -0.26 0.91 3.76 -0.53 -4.95 115.29 114.69 3g0b s HIS 345 Ca 0.44 -0.68 -0.08 0.00 -0.15 0.00 0.00 55.06 54.59 3g0b s HIS 345 Cb -0.21 -1.29 -0.02 0.00 1.11 0.00 0.00 32.58 32.16 3g0b s HIS 345 CO 0.26 -0.29 0.09 0.42 -0.85 0.00 0.00 174.74 174.37 3g0b s ILE 346 N 0.39 4.37 -0.30 0.60 1.01 -1.26 -0.06 121.20 125.95 3g0b s ILE 346 Ca -0.13 -0.21 -0.07 0.00 0.00 0.00 0.00 60.65 60.24 3g0b s ILE 346 Cb -0.15 -3.08 0.01 0.00 0.01 0.00 0.00 42.46 39.25 3g0b s ILE 346 CO 0.05 0.29 0.08 -0.70 0.00 0.00 0.00 174.94 174.66 3g0b s GLU 347 N 1.62 3.03 0.09 2.79 2.12 -0.78 -5.01 118.70 122.56 3g0b s GLU 347 Ca 0.06 -0.90 0.02 0.00 0.36 0.00 0.00 54.97 54.51 3g0b s GLU 347 Cb -0.15 -3.38 -0.04 0.00 0.26 0.00 0.00 34.13 30.82 3g0b s GLU 347 CO 0.04 -0.47 -0.08 0.00 -0.54 0.00 0.00 175.26 174.21 3g0b s MET 348 N 1.48 0.81 -0.04 4.30 0.23 -1.26 -0.80 119.30 124.03 3g0b s MET 348 Ca 0.02 -1.23 0.05 0.00 -1.03 0.00 0.00 55.69 53.49 3g0b s MET 348 Cb -0.17 -0.31 -0.01 0.00 -1.53 0.00 0.00 34.83 32.81 3g0b s MET 348 CO 0.02 0.02 -0.18 0.45 -2.03 0.00 0.00 175.02 173.30 3g0b s SER 349 N -2.74 2.22 0.01 -1.18 0.15 -0.57 -5.00 113.70 106.58 3g0b s SER 349 Ca 0.08 -0.36 0.22 0.00 0.70 0.00 0.00 55.95 56.59 3g0b s SER 349 Cb 0.01 -0.57 -0.18 0.00 -1.71 0.00 0.00 66.02 63.58 3g0b s SER 349 CO -0.03 0.17 0.80 0.35 1.20 0.00 0.00 173.24 175.73 3g0b n THR 350 N 3.06 0.06 -0.05 6.45 -2.24 -1.26 -4.50 114.28 115.80 3g0b n THR 350 Ca -0.18 -0.25 -0.01 0.00 -2.27 0.00 0.00 64.05 61.35 3g0b n THR 350 Cb 0.53 0.40 -0.14 0.00 -2.10 0.00 0.00 70.33 69.02 3g0b n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3g0b n THR 351 N -1.91 0.67 -0.01 4.28 -2.24 -1.26 -5.06 114.28 108.75 3g0b n THR 351 Ca 0.01 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 3g0b n THR 351 Cb 0.45 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 3g0b n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g0b n GLY 352 N 1.70 3.73 4.00 3.38 0.00 -1.26 -4.83 105.19 111.91 3g0b n GLY 352 Ca -0.18 -0.15 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 3g0b n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3g0b s TRP 353 N -0.00 1.53 -0.21 1.61 -2.14 -1.26 -4.52 118.94 113.94 3g0b s TRP 353 Ca 0.00 -0.41 -0.08 0.00 2.66 0.00 0.00 56.10 58.27 3g0b s TRP 353 Cb 0.00 -2.77 -0.04 0.00 -3.10 0.00 0.00 33.47 27.56 3g0b s TRP 353 CO 0.00 -1.55 0.08 0.54 -2.66 0.00 0.00 176.95 173.36 3g0b s VAL 354 N -3.01 4.75 0.00 -0.66 0.11 0.47 -4.70 120.40 117.36 3g0b s VAL 354 Ca 0.65 -0.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.66 3g0b s VAL 354 Cb -0.05 -3.18 0.00 0.00 -1.53 0.00 0.00 36.38 31.62 3g0b s VAL 354 CO 0.43 0.40 0.00 0.61 -3.33 0.00 0.00 175.10 173.21 3g0b n GLY 355 N 4.08 -0.76 0.09 6.54 0.00 -1.26 -3.46 105.19 110.41 3g0b n GLY 355 Ca -0.16 -1.71 -0.12 0.00 0.00 0.00 0.00 46.02 44.03 3g0b n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3g0b h ARG 356 N 0.00 -0.08 0.00 1.61 3.08 -1.95 -3.41 114.38 113.63 3g0b h ARG 356 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3g0b h ARG 356 Cb 0.00 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.07 3g0b h ARG 356 CO 0.00 0.48 -0.27 1.19 -1.07 0.00 0.00 179.97 180.30 3g0b n PHE 357 N -4.84 0.00 -3.54 3.04 3.72 -1.26 -4.83 117.46 109.76 3g0b n PHE 357 Ca -0.08 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.23 3g0b n PHE 357 Cb 0.30 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.81 3g0b n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 3g0b s ARG 358 N -0.87 0.69 0.24 -1.08 1.70 -1.26 -5.01 118.95 113.37 3g0b s ARG 358 Ca 0.00 -0.13 -0.29 0.00 -0.47 0.00 0.00 55.73 54.84 3g0b s ARG 358 Cb 0.00 0.32 -0.15 0.00 -0.57 0.00 0.00 34.95 34.55 3g0b s ARG 358 CO 0.00 -0.28 1.00 -2.30 -1.08 0.00 0.00 175.30 172.64 3g0b n PRO 359 N 0.11 1.13 -2.14 3.89 -0.02 -1.23 -4.36 135.00 132.38 3g0b n PRO 359 Ca -0.08 0.40 -0.34 0.00 -2.02 0.00 0.00 63.50 61.46 3g0b n PRO 359 Cb 0.60 -1.76 0.01 0.00 -0.02 0.00 0.00 33.50 32.33 3g0b n PRO 359 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3g0b s SER 360 N -0.45 5.67 0.22 2.55 0.15 -1.26 -4.90 113.70 115.69 3g0b s SER 360 Ca 0.64 2.03 -0.30 0.00 0.70 0.00 0.00 55.95 59.02 3g0b s SER 360 Cb -0.77 -2.56 -0.08 0.00 -1.71 0.00 0.00 66.02 60.89 3g0b s SER 360 CO 0.57 -1.25 1.03 -1.83 1.20 0.00 0.00 173.24 172.97 3g0b s GLU 361 N -3.62 4.71 0.42 5.44 1.03 -1.26 -4.89 118.70 120.53 3g0b s GLU 361 Ca 0.69 1.64 -0.15 0.00 0.03 0.00 0.00 54.97 57.17 3g0b s GLU 361 Cb -0.20 -3.26 -0.08 0.00 -0.80 0.00 0.00 34.13 29.78 3g0b s GLU 361 CO 0.31 0.28 0.85 -1.25 -1.33 0.00 0.00 175.26 174.12 3g0b s PRO 362 N -0.91 3.96 -0.25 -4.83 0.04 -1.26 -4.60 135.00 127.14 3g0b s PRO 362 Ca 0.45 0.76 0.02 0.00 0.04 0.00 0.00 61.00 62.27 3g0b s PRO 362 Cb -0.28 -2.30 0.06 0.00 0.04 0.00 0.00 34.50 32.02 3g0b s PRO 362 CO 0.35 -0.05 -0.07 -1.01 0.04 0.00 0.00 177.00 176.27 3g0b s HIS 363 N -2.30 2.83 0.04 0.56 3.76 0.51 -4.94 115.29 115.75 3g0b s HIS 363 Ca 0.56 -2.07 -0.19 0.00 -0.15 0.00 0.00 55.06 53.21 3g0b s HIS 363 Cb -0.10 -1.81 -0.06 0.00 1.11 0.00 0.00 32.58 31.72 3g0b s HIS 363 CO 0.24 -0.83 0.56 -0.06 -0.85 0.00 0.00 174.74 173.80 3g0b s PHE 364 N 1.25 3.76 0.79 1.40 0.40 -1.26 -1.17 117.98 123.15 3g0b s PHE 364 Ca -0.06 1.22 -0.11 0.00 -0.60 0.00 0.00 56.93 57.39 3g0b s PHE 364 Cb -0.19 -2.51 0.07 0.00 0.51 0.00 0.00 43.02 40.90 3g0b s PHE 364 CO -0.06 0.53 1.10 0.95 0.70 0.00 0.00 175.22 178.44 3g0b s THR 365 N -0.84 3.07 0.28 0.64 -4.23 -0.33 -4.91 115.64 109.32 3g0b s THR 365 Ca 0.29 0.36 0.01 0.00 -1.18 0.00 0.00 61.69 61.16 3g0b s THR 365 Cb -0.19 -2.76 0.29 0.00 1.34 0.00 0.00 72.50 71.19 3g0b s THR 365 CO 0.18 -0.45 1.66 0.25 -0.54 0.00 0.00 174.62 175.72 3g0b h LEU 366 N -1.21 0.05 -1.05 4.79 5.85 -1.93 -0.56 115.31 121.25 3g0b h LEU 366 Ca -0.44 0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.37 3g0b h LEU 366 Cb 1.24 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.49 3g0b h LEU 366 CO 0.50 -0.11 -0.48 -2.24 -0.34 0.00 0.00 178.44 175.77 3g0b h ASP 367 N 0.25 0.00 0.00 1.25 -0.00 -1.92 -3.48 116.42 112.52 3g0b h ASP 367 Ca 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.56 3g0b h ASP 367 Cb 1.02 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.35 3g0b h ASP 367 CO -0.61 0.48 0.00 0.61 -0.00 0.00 0.00 179.24 179.72 3g0b n GLY 368 N -0.16 0.71 0.81 7.15 0.00 -0.22 -4.92 105.19 108.56 3g0b n GLY 368 Ca -0.02 -0.27 0.12 0.00 0.00 0.00 0.00 46.02 45.86 3g0b n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3g0b n ASN 369 N 0.49 2.65 -3.66 1.61 3.02 -1.26 -4.95 115.26 113.15 3g0b n ASN 369 Ca 0.00 -1.84 -0.15 0.00 -0.03 0.00 0.00 54.58 52.56 3g0b n ASN 369 Cb 0.00 0.10 -0.08 0.00 -0.61 0.00 0.00 39.78 39.20 3g0b n ASN 369 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3g0b s SER 370 N -2.11 -0.43 -0.01 6.41 0.15 -1.26 -2.06 113.70 114.38 3g0b s SER 370 Ca 0.27 0.53 -0.08 0.00 0.70 0.00 0.00 55.95 57.36 3g0b s SER 370 Cb 0.20 0.56 0.01 0.00 -1.71 0.00 0.00 66.02 65.08 3g0b s SER 370 CO 0.36 -0.44 0.17 0.72 1.20 0.00 0.00 173.24 175.26 3g0b s PHE 371 N -0.91 -0.04 -0.19 3.44 -0.12 -1.06 -1.19 117.98 117.91 3g0b s PHE 371 Ca -0.10 0.05 -0.06 0.00 -0.05 0.00 0.00 56.93 56.78 3g0b s PHE 371 Cb -0.03 -0.00 -0.03 0.00 -0.63 0.00 0.00 43.02 42.32 3g0b s PHE 371 CO 0.05 -0.27 0.03 0.71 -0.05 0.00 0.00 175.22 175.70 3g0b s TYR 372 N -1.09 3.13 -0.01 3.49 2.02 -0.32 -1.45 117.35 123.12 3g0b s TYR 372 Ca -0.12 -0.18 -0.06 0.00 -0.37 0.00 0.00 57.07 56.34 3g0b s TYR 372 Cb -0.06 -2.08 0.00 0.00 -0.40 0.00 0.00 41.96 39.43 3g0b s TYR 372 CO 0.02 -0.04 0.12 -1.59 -1.57 0.00 0.00 175.55 172.49 3g0b s LYS 373 N 0.67 0.37 -0.07 -0.62 -2.85 -1.08 -0.37 119.74 115.80 3g0b s LYS 373 Ca 0.01 -0.25 -0.30 0.00 -1.00 0.00 0.00 55.97 54.44 3g0b s LYS 373 Cb -0.14 0.16 -0.03 0.00 -2.06 0.00 0.00 37.83 35.76 3g0b s LYS 373 CO 0.02 -0.08 1.20 0.42 0.10 0.00 0.00 175.35 177.01 3g0b s ILE 374 N -0.96 4.26 0.11 3.79 1.01 -1.26 -1.95 121.20 126.20 3g0b s ILE 374 Ca -0.10 1.58 0.03 0.00 0.00 0.00 0.00 60.65 62.15 3g0b s ILE 374 Cb -0.06 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 3g0b s ILE 374 CO 0.01 -0.01 -0.08 0.27 0.00 0.00 0.00 174.94 175.12 3g0b s ILE 375 N 2.32 0.86 -0.13 2.92 -4.36 -0.24 -4.50 121.20 118.07 3g0b s ILE 375 Ca 0.56 -1.86 -0.29 0.00 -0.26 0.00 0.00 60.65 58.79 3g0b s ILE 375 Cb -0.24 -1.60 -0.03 0.00 1.25 0.00 0.00 42.46 41.83 3g0b s ILE 375 CO 0.21 -0.75 1.44 -0.55 0.24 0.00 0.00 174.94 175.53 3g0b s SER 376 N -2.88 6.79 1.03 4.36 0.15 -1.26 -0.94 113.70 120.95 3g0b s SER 376 Ca 0.11 1.87 -0.09 0.00 0.70 0.00 0.00 55.95 58.53 3g0b s SER 376 Cb 0.02 -2.54 0.13 0.00 -1.71 0.00 0.00 66.02 61.93 3g0b s SER 376 CO -0.02 -0.87 0.68 -0.46 1.20 0.00 0.00 173.24 173.77 3g0b n ASN 377 N 6.98 -0.37 -0.25 5.45 0.23 0.15 -4.85 115.26 122.61 3g0b n ASN 377 Ca 0.16 -1.15 0.10 0.00 -0.53 0.00 0.00 54.58 53.15 3g0b n ASN 377 Cb 0.44 -0.54 0.36 0.00 -2.08 0.00 0.00 39.78 37.96 3g0b n ASN 377 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3g0b h GLU 378 N 0.00 0.72 -0.69 -3.83 9.09 -1.96 -1.57 114.58 116.35 3g0b h GLU 378 Ca -0.23 -0.04 -0.05 0.00 0.05 0.00 0.00 59.36 59.09 3g0b h GLU 378 Cb 0.64 -0.16 -0.03 0.00 -1.65 0.00 0.00 28.75 27.55 3g0b h GLU 378 CO 0.16 0.48 0.06 -0.85 0.05 0.00 0.00 179.01 178.91 3g0b n GLU 379 N -4.53 4.08 -0.23 1.06 0.28 -1.26 -4.93 120.64 115.11 3g0b n GLU 379 Ca 0.15 -2.67 0.00 0.00 -0.16 0.00 0.00 57.16 54.48 3g0b n GLU 379 Cb 0.38 -2.14 0.00 0.00 1.43 0.00 0.00 31.44 31.11 3g0b n GLU 379 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3g0b n GLY 380 N 0.37 1.95 3.81 -1.84 0.00 -0.59 -4.76 105.19 104.14 3g0b n GLY 380 Ca 0.27 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.91 3g0b n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g0b s TYR 381 N -3.02 3.77 -0.37 1.61 1.51 -1.26 0.05 117.35 119.64 3g0b s TYR 381 Ca 0.00 1.30 -0.23 0.00 -1.01 0.00 0.00 57.07 57.14 3g0b s TYR 381 Cb 0.00 -2.53 0.01 0.00 -0.11 0.00 0.00 41.96 39.33 3g0b s TYR 381 CO 0.00 0.53 0.75 1.03 -1.11 0.00 0.00 175.55 176.75 3g0b s ARG 382 N -1.34 3.70 0.14 -0.62 0.52 -1.26 0.33 118.95 120.43 3g0b s ARG 382 Ca 0.33 0.22 0.01 0.00 -0.52 0.00 0.00 55.73 55.77 3g0b s ARG 382 Cb -0.19 -3.82 -0.04 0.00 0.52 0.00 0.00 34.95 31.42 3g0b s ARG 382 CO 0.20 -0.85 -0.01 -1.01 0.02 0.00 0.00 175.30 173.65 3g0b s HIS 383 N 3.03 1.05 -0.17 -0.53 3.76 -0.12 -0.49 115.29 121.82 3g0b s HIS 383 Ca 0.30 -1.02 -0.29 0.00 -0.15 0.00 0.00 55.06 53.89 3g0b s HIS 383 Cb -0.13 -0.60 -0.00 0.00 1.11 0.00 0.00 32.58 32.95 3g0b s HIS 383 CO 0.17 -0.24 1.08 0.42 -0.85 0.00 0.00 174.74 175.31 3g0b s ILE 384 N -3.71 4.61 0.00 0.60 1.01 -1.26 -1.07 121.20 121.38 3g0b s ILE 384 Ca 0.20 1.92 -0.01 0.00 0.00 0.00 0.00 60.65 62.76 3g0b s ILE 384 Cb 0.06 -4.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 3g0b s ILE 384 CO 0.01 -0.10 0.12 0.00 0.00 0.00 0.00 174.94 174.96 3g0b s TYR 386 N -1.26 3.21 -0.06 0.00 6.04 0.31 -2.62 117.35 122.97 3g0b s TYR 386 Ca 0.25 -0.76 -0.03 0.00 0.04 0.00 0.00 57.07 56.57 3g0b s TYR 386 Cb -0.12 -2.40 -0.04 0.00 -1.04 0.00 0.00 41.96 38.36 3g0b s TYR 386 CO 0.17 -0.55 0.08 -0.06 -1.54 0.00 0.00 175.55 173.65 3g0b s PHE 387 N 1.58 3.35 0.06 4.97 0.08 -0.53 -2.20 117.98 125.30 3g0b s PHE 387 Ca 0.03 0.30 -0.10 0.00 0.12 0.00 0.00 56.93 57.28 3g0b s PHE 387 Cb -0.18 -1.81 -0.06 0.00 -0.57 0.00 0.00 43.02 40.40 3g0b s PHE 387 CO 0.06 0.58 0.39 -0.65 -0.10 0.00 0.00 175.22 175.50 3g0b s GLN 388 N -1.33 3.75 0.44 0.44 -1.52 -1.26 -2.56 119.66 117.61 3g0b s GLN 388 Ca 0.19 0.17 0.10 0.00 -1.95 0.00 0.00 55.36 53.86 3g0b s GLN 388 Cb -0.12 -3.02 0.98 0.00 -0.22 0.00 0.00 33.01 30.63 3g0b s GLN 388 CO 0.08 0.58 2.06 0.82 -0.25 0.00 0.00 175.29 178.58 3g0b h ILE 389 N 2.95 1.04 0.00 1.08 1.08 -1.78 -3.35 117.51 118.52 3g0b h ILE 389 Ca -0.49 -0.14 -0.10 0.00 -0.39 0.00 0.00 64.86 63.73 3g0b h ILE 389 Cb 1.20 0.58 -0.01 0.00 -3.07 0.00 0.00 36.82 35.51 3g0b h ILE 389 CO 0.66 0.08 -1.06 0.47 -0.69 0.00 0.00 178.15 177.61 3g0b n ASP 390 N -4.48 1.88 -4.73 1.72 8.00 -1.26 -4.51 116.55 113.17 3g0b n ASP 390 Ca 0.03 0.47 -0.30 0.00 0.71 0.00 0.00 54.79 55.70 3g0b n ASP 390 Cb 0.14 -0.84 0.13 0.00 -0.02 0.00 0.00 41.12 40.53 3g0b n ASP 390 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 3g0b s LYS 391 N -2.51 1.38 0.00 -1.24 -2.85 -1.26 -4.65 119.74 108.62 3g0b s LYS 391 Ca -0.25 0.80 0.00 0.00 -1.00 0.00 0.00 55.97 55.52 3g0b s LYS 391 Cb 0.05 -1.83 0.00 0.00 -2.06 0.00 0.00 37.83 33.99 3g0b s LYS 391 CO 0.38 -2.15 0.00 1.63 0.10 0.00 0.00 175.35 175.31 3g0b n LYS 392 N -3.81 0.00 -1.70 1.78 5.02 -1.26 -4.51 118.16 113.67 3g0b n LYS 392 Ca 0.07 0.08 -0.67 0.00 -2.02 0.00 0.00 58.31 55.77 3g0b n LYS 392 Cb 0.55 -0.55 -0.10 0.00 -0.02 0.00 0.00 35.03 34.91 3g0b n LYS 392 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3g0b n ASP 393 N -2.34 1.17 -4.48 4.39 10.43 -1.26 -4.76 116.55 119.71 3g0b n ASP 393 Ca 0.00 1.14 -0.24 0.00 2.57 0.00 0.00 54.79 58.27 3g0b n ASP 393 Cb 0.00 -0.88 0.13 0.00 1.84 0.00 0.00 41.12 42.21 3g0b n ASP 393 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3g0b s THR 395 N -3.18 0.98 -0.04 0.00 -1.32 -0.94 -4.93 115.64 106.22 3g0b s THR 395 Ca 0.67 -0.36 -0.30 0.00 -1.21 0.00 0.00 61.69 60.49 3g0b s THR 395 Cb -0.04 -0.94 -0.05 0.00 -1.51 0.00 0.00 72.50 69.96 3g0b s THR 395 CO 0.45 0.33 1.49 -0.36 -2.21 0.00 0.00 174.62 174.32 3g0b s PHE 396 N 0.95 2.50 -0.54 9.09 0.08 -1.26 -0.53 117.98 128.28 3g0b s PHE 396 Ca -0.09 0.58 0.24 0.00 0.12 0.00 0.00 56.93 57.78 3g0b s PHE 396 Cb -0.15 -3.75 0.35 0.00 -0.57 0.00 0.00 43.02 38.90 3g0b s PHE 396 CO 0.00 -2.95 1.39 -0.84 -0.10 0.00 0.00 175.22 172.71 3g0b h ILE 397 N 5.24 0.00 -3.91 0.64 3.07 -1.18 -3.46 117.51 117.90 3g0b h ILE 397 Ca -0.37 -0.67 -0.35 0.00 1.55 0.00 0.00 64.86 65.01 3g0b h ILE 397 Cb 1.17 1.38 -0.21 0.00 -0.27 0.00 0.00 36.82 38.89 3g0b h ILE 397 CO 0.93 0.00 -0.76 0.42 -1.05 0.00 0.00 178.15 177.70 3g0b s THR 398 N -3.20 0.91 0.26 0.16 -4.23 -1.24 -4.92 115.64 103.37 3g0b s THR 398 Ca 0.06 -1.29 -0.09 0.00 -1.18 0.00 0.00 61.69 59.18 3g0b s THR 398 Cb 0.11 -0.97 -0.01 0.00 1.34 0.00 0.00 72.50 72.97 3g0b s THR 398 CO 0.71 -0.33 0.42 -1.59 -0.54 0.00 0.00 174.62 173.29 3g0b s LYS 399 N -1.87 1.56 0.00 3.99 -2.85 -1.26 -4.59 119.74 114.72 3g0b s LYS 399 Ca -0.03 -1.40 0.00 0.00 -1.00 0.00 0.00 55.97 53.54 3g0b s LYS 399 Cb -0.09 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.12 3g0b s LYS 399 CO 0.01 -0.63 0.00 0.41 0.10 0.00 0.00 175.35 175.24 3g0b n GLY 400 N -0.39 2.32 2.58 0.59 0.00 -1.26 -4.89 105.19 104.15 3g0b n GLY 400 Ca -0.01 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.59 3g0b n GLY 400 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g0b n THR 401 N -1.47 4.36 -3.72 2.61 -2.24 -1.26 -4.79 114.28 107.78 3g0b n THR 401 Ca 0.00 -3.55 -0.06 0.00 -2.27 0.00 0.00 64.05 58.17 3g0b n THR 401 Cb 0.00 -2.42 0.02 0.00 -2.10 0.00 0.00 70.33 65.83 3g0b n THR 401 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 3g0b n TRP 402 N 3.76 -1.80 -4.13 4.78 4.27 -1.26 -5.03 117.44 118.03 3g0b n TRP 402 Ca 0.59 -1.37 -0.15 0.00 -3.89 0.00 0.00 57.50 52.69 3g0b n TRP 402 Cb 0.30 0.68 -0.13 0.00 -1.36 0.00 0.00 31.31 30.80 3g0b n TRP 402 CO 0.00 0.00 0.00 -1.21 -2.29 0.00 0.00 177.69 174.19 3g0b s GLU 403 N -2.06 0.50 0.04 -2.67 2.02 -1.26 -4.38 118.70 110.88 3g0b s GLU 403 Ca 0.15 -0.46 -0.30 0.00 0.02 0.00 0.00 54.97 54.38 3g0b s GLU 403 Cb -0.03 -0.39 -0.04 0.00 0.10 0.00 0.00 34.13 33.76 3g0b s GLU 403 CO 0.08 0.09 1.09 0.08 0.02 0.00 0.00 175.26 176.62 3g0b s VAL 404 N -0.70 4.43 -0.05 2.63 1.01 0.36 -2.53 120.40 125.54 3g0b s VAL 404 Ca -0.03 1.76 0.06 0.00 0.00 0.00 0.00 61.98 63.77 3g0b s VAL 404 Cb -0.06 -4.13 -0.24 0.00 0.00 0.00 0.00 36.38 31.95 3g0b s VAL 404 CO 0.00 0.15 0.63 0.40 0.00 0.00 0.00 175.10 176.28 3g0b h ILE 405 N 4.60 0.85 -1.09 2.22 1.08 -0.48 -3.45 117.51 121.24 3g0b h ILE 405 Ca -0.41 -2.65 0.19 0.00 -0.39 0.00 0.00 64.86 61.59 3g0b h ILE 405 Cb 1.22 2.49 -0.33 0.00 -3.07 0.00 0.00 36.82 37.13 3g0b h ILE 405 CO 0.78 0.64 0.85 -0.83 -0.69 0.00 0.00 178.15 178.90 3g0b s GLY 406 N -5.20 0.38 -0.17 5.37 0.00 -1.17 -5.00 107.32 101.54 3g0b s GLY 406 Ca -0.09 3.55 -0.29 0.00 0.00 0.00 0.00 44.72 47.90 3g0b s GLY 406 CO 0.81 2.06 0.99 -0.42 0.00 0.00 0.00 173.10 176.55 3g0b s ILE 407 N 0.18 4.76 -0.26 0.90 1.01 -1.26 -1.43 121.20 125.10 3g0b s ILE 407 Ca 0.05 1.97 -0.12 0.00 0.00 0.00 0.00 60.65 62.55 3g0b s ILE 407 Cb -0.05 -4.28 -0.12 0.00 0.01 0.00 0.00 42.46 38.03 3g0b s ILE 407 CO -0.15 -0.07 -0.33 -0.62 0.00 0.00 0.00 174.94 173.78 3g0b n GLU 408 N 5.58 0.56 -4.24 2.79 -0.58 0.14 -4.98 120.64 119.90 3g0b n GLU 408 Ca 0.09 0.24 -0.14 0.00 -0.42 0.00 0.00 57.16 56.93 3g0b n GLU 408 Cb 0.48 -1.43 -0.10 0.00 -0.57 0.00 0.00 31.44 29.81 3g0b n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3g0b s ALA 409 N -2.48 1.40 -0.15 0.62 0.00 -0.78 -4.99 121.76 115.37 3g0b s ALA 409 Ca -0.36 -1.49 -0.04 0.00 0.00 0.00 0.00 51.96 50.07 3g0b s ALA 409 Cb 0.14 0.11 0.07 0.00 0.00 0.00 0.00 23.12 23.44 3g0b s ALA 409 CO 0.47 -0.13 0.22 -1.17 0.00 0.00 0.00 175.76 175.14 3g0b s LEU 410 N -3.16 -0.15 0.36 0.00 2.96 -1.26 -1.81 118.68 115.63 3g0b s LEU 410 Ca 0.17 0.13 0.08 0.00 -0.22 0.00 0.00 54.13 54.29 3g0b s LEU 410 Cb 0.03 0.44 -0.04 0.00 0.50 0.00 0.00 46.19 47.12 3g0b s LEU 410 CO 0.00 -0.28 0.20 0.42 -1.32 0.00 0.00 176.35 175.37 3g0b s THR 411 N 2.34 2.90 -1.44 3.68 -4.23 -0.46 -4.99 115.64 113.44 3g0b s THR 411 Ca 0.04 -1.60 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 3g0b s THR 411 Cb -0.14 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.69 3g0b s THR 411 CO -0.10 -0.12 0.37 -1.54 -0.54 0.00 0.00 174.62 172.70 3g0b n SER 412 N -1.25 0.29 0.00 3.99 3.41 -1.26 -3.08 113.62 115.73 3g0b n SER 412 Ca -0.02 -1.04 0.00 0.00 -0.26 0.00 0.00 58.87 57.55 3g0b n SER 412 Cb 0.62 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 3g0b n SER 412 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3g0b n ASP 413 N -0.08 0.89 -4.31 4.04 8.00 -1.26 -5.03 116.55 118.80 3g0b n ASP 413 Ca 0.00 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.33 3g0b n ASP 413 Cb 0.07 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.07 3g0b n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3g0b s TYR 414 N -1.71 1.57 -0.10 1.24 1.51 -1.18 -2.11 117.35 116.58 3g0b s TYR 414 Ca 0.00 -0.62 0.03 0.00 -1.01 0.00 0.00 57.07 55.47 3g0b s TYR 414 Cb 0.00 -0.75 -0.01 0.00 -0.11 0.00 0.00 41.96 41.09 3g0b s TYR 414 CO 0.00 0.27 -0.19 -1.17 -1.11 0.00 0.00 175.55 173.35 3g0b s LEU 415 N -3.21 2.41 -0.18 -1.29 1.98 -0.22 -1.36 118.68 116.80 3g0b s LEU 415 Ca 0.20 -0.42 -0.02 0.00 -2.89 0.00 0.00 54.13 51.00 3g0b s LEU 415 Cb -0.00 -1.50 -0.01 0.00 0.66 0.00 0.00 46.19 45.34 3g0b s LEU 415 CO 0.05 0.19 -0.10 -0.31 -1.89 0.00 0.00 176.35 174.29 3g0b s TYR 416 N 0.16 2.88 0.10 5.38 2.02 -0.75 0.01 117.35 127.15 3g0b s TYR 416 Ca -0.10 -0.95 -0.00 0.00 -0.37 0.00 0.00 57.07 55.65 3g0b s TYR 416 Cb -0.16 -1.99 -0.04 0.00 -0.40 0.00 0.00 41.96 39.37 3g0b s TYR 416 CO 0.06 -0.47 -0.01 1.52 -1.57 0.00 0.00 175.55 175.08 3g0b s TYR 417 N 1.06 0.77 -0.10 2.71 -0.85 0.08 0.25 117.35 121.26 3g0b s TYR 417 Ca -0.00 -1.08 -0.00 0.00 -0.52 0.00 0.00 57.07 55.47 3g0b s TYR 417 Cb -0.15 -0.48 -0.02 0.00 0.38 0.00 0.00 41.96 41.69 3g0b s TYR 417 CO -0.02 -0.35 -0.09 0.42 -1.52 0.00 0.00 175.55 173.99 3g0b s ILE 418 N -3.87 3.49 0.18 -3.49 1.01 -0.51 0.38 121.20 118.39 3g0b s ILE 418 Ca 0.15 -0.53 -0.05 0.00 0.00 0.00 0.00 60.65 60.22 3g0b s ILE 418 Cb 0.07 -2.45 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 3g0b s ILE 418 CO -0.04 0.55 0.20 -0.94 0.00 0.00 0.00 174.94 174.71 3g0b s SER 419 N -0.23 0.13 -0.43 3.58 1.04 -0.72 0.29 113.70 117.37 3g0b s SER 419 Ca 0.02 -1.14 0.05 0.00 0.48 0.00 0.00 55.95 55.36 3g0b s SER 419 Cb -0.13 0.40 0.54 0.00 0.10 0.00 0.00 66.02 66.94 3g0b s SER 419 CO 0.03 -0.87 1.72 -0.46 0.98 0.00 0.00 173.24 174.63 3g0b n ASN 420 N -0.22 4.31 -0.01 7.02 0.23 -1.05 -1.94 115.26 123.60 3g0b n ASN 420 Ca -0.03 -3.73 -0.17 0.00 -0.53 0.00 0.00 54.58 50.12 3g0b n ASN 420 Cb 0.64 -0.75 -0.09 0.00 -2.08 0.00 0.00 39.78 37.50 3g0b n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3g0b h GLU 421 N 1.35 0.56 -6.17 -3.83 4.81 -1.82 -3.29 114.58 106.19 3g0b h GLU 421 Ca 0.46 -0.50 -0.71 0.00 -0.13 0.00 0.00 59.36 58.48 3g0b h GLU 421 Cb 1.87 0.12 0.01 0.00 0.63 0.00 0.00 28.75 31.38 3g0b h GLU 421 CO 0.94 1.13 0.98 0.98 -0.73 0.00 0.00 179.01 182.30 3g0b n TYR 422 N -4.14 2.10 -1.35 0.92 -0.00 -1.26 -0.74 117.16 112.69 3g0b n TYR 422 Ca -0.09 0.40 -0.12 0.00 -0.00 0.00 0.00 57.90 58.10 3g0b n TYR 422 Cb 0.67 -2.51 -0.05 0.00 -0.00 0.00 0.00 39.34 37.45 3g0b n TYR 422 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 3g0b n LYS 423 N 5.83 -1.53 -2.60 2.98 5.02 -1.26 -2.81 118.16 123.79 3g0b n LYS 423 Ca 0.26 0.90 -0.18 0.00 -2.02 0.00 0.00 58.31 57.28 3g0b n LYS 423 Cb 0.17 -5.24 0.01 0.00 -0.02 0.00 0.00 35.03 29.95 3g0b n LYS 423 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g0b n GLY 424 N -0.12 -0.32 3.34 0.72 0.00 0.08 -4.98 105.19 103.91 3g0b n GLY 424 Ca -0.12 -0.10 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 3g0b n GLY 424 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g0b s MET 425 N -5.17 2.76 0.58 1.61 -1.94 -1.12 -4.95 119.30 111.06 3g0b s MET 425 Ca 0.12 -1.19 0.32 0.00 -1.71 0.00 0.00 55.69 53.24 3g0b s MET 425 Cb -0.05 -3.74 1.79 0.00 2.01 0.00 0.00 34.83 34.84 3g0b s MET 425 CO 0.15 -0.77 2.20 -1.35 -0.01 0.00 0.00 175.02 175.24 3g0b h PRO 426 N 8.43 0.00 -0.63 2.03 0.11 -1.88 -2.30 132.00 137.76 3g0b h PRO 426 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 3g0b h PRO 426 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3g0b h PRO 426 CO 0.69 0.04 0.00 0.41 -0.21 0.00 0.00 178.00 178.94 3g0b n GLY 427 N -0.96 2.11 3.76 -0.55 0.00 -1.26 -4.85 105.19 103.43 3g0b n GLY 427 Ca -0.02 -0.63 -0.26 0.00 0.00 0.00 0.00 46.02 45.11 3g0b n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g0b s GLY 428 N -0.76 1.69 -0.03 -0.02 0.00 -0.87 -1.56 107.32 105.77 3g0b s GLY 428 Ca 0.38 -1.29 0.01 0.00 0.00 0.00 0.00 44.72 43.83 3g0b s GLY 428 CO 0.18 -1.31 -0.05 0.50 0.00 0.00 0.00 173.10 172.42 3g0b s ARG 429 N -3.15 0.65 -0.00 2.90 1.81 0.36 -4.07 118.95 117.45 3g0b s ARG 429 Ca 0.30 -0.13 -0.07 0.00 -1.72 0.00 0.00 55.73 54.11 3g0b s ARG 429 Cb -0.09 -0.67 0.00 0.00 -0.45 0.00 0.00 34.95 33.74 3g0b s ARG 429 CO 0.22 -0.00 0.13 -0.80 -0.68 0.00 0.00 175.30 174.17 3g0b s ASN 430 N 0.52 0.02 -0.25 0.23 -0.87 -0.82 -1.56 114.94 112.21 3g0b s ASN 430 Ca -0.06 -0.18 -0.22 0.00 -1.57 0.00 0.00 52.86 50.82 3g0b s ASN 430 Cb -0.10 0.21 -0.01 0.00 -0.02 0.00 0.00 41.25 41.33 3g0b s ASN 430 CO -0.00 -0.34 0.73 -0.22 -2.57 0.00 0.00 177.10 174.70 3g0b s LEU 431 N -1.26 4.07 0.05 0.60 2.96 -1.26 -1.75 118.68 122.10 3g0b s LEU 431 Ca -0.13 0.85 0.05 0.00 -0.22 0.00 0.00 54.13 54.67 3g0b s LEU 431 Cb -0.07 -3.02 -0.04 0.00 0.50 0.00 0.00 46.19 43.56 3g0b s LEU 431 CO 0.01 -0.46 -0.07 -0.31 -1.32 0.00 0.00 176.35 174.21 3g0b s TYR 432 N 2.70 2.85 -0.17 5.38 2.02 0.16 0.27 117.35 130.55 3g0b s TYR 432 Ca 0.31 -0.08 0.01 0.00 -0.37 0.00 0.00 57.07 56.94 3g0b s TYR 432 Cb -0.15 -1.54 0.01 0.00 -0.40 0.00 0.00 41.96 39.88 3g0b s TYR 432 CO 0.08 0.41 -0.19 0.21 -1.57 0.00 0.00 175.55 174.49 3g0b s LYS 433 N -1.83 3.05 -0.15 -0.62 2.20 0.26 -0.74 119.74 121.90 3g0b s LYS 433 Ca 0.20 -0.82 -0.01 0.00 -0.36 0.00 0.00 55.97 54.99 3g0b s LYS 433 Cb -0.11 -2.57 -0.01 0.00 -1.51 0.00 0.00 37.83 33.63 3g0b s LYS 433 CO 0.11 -0.13 -0.12 -1.50 -0.36 0.00 0.00 175.35 173.35 3g0b s ILE 434 N 1.12 2.99 -0.05 5.43 2.07 0.10 0.26 121.20 133.12 3g0b s ILE 434 Ca 0.01 -0.67 -0.30 0.00 -1.41 0.00 0.00 60.65 58.28 3g0b s ILE 434 Cb -0.14 -2.27 -0.04 0.00 0.13 0.00 0.00 42.46 40.14 3g0b s ILE 434 CO -0.08 0.51 1.31 -1.58 -1.91 0.00 0.00 174.94 173.18 3g0b s GLN 435 N 0.65 4.30 0.00 3.50 0.74 -0.77 -1.06 119.66 127.02 3g0b s GLN 435 Ca -0.07 1.80 0.21 0.00 0.05 0.00 0.00 55.36 57.35 3g0b s GLN 435 Cb -0.15 -3.62 0.98 0.00 1.10 0.00 0.00 33.01 31.32 3g0b s GLN 435 CO 0.02 -0.56 1.66 1.28 -0.55 0.00 0.00 175.29 177.14 3g0b n LEU 436 N 5.58 0.00 0.02 3.68 4.32 -0.90 -2.35 117.00 127.36 3g0b n LEU 436 Ca 0.13 0.36 0.11 0.00 -0.02 0.00 0.00 56.01 56.59 3g0b n LEU 436 Cb 0.45 -0.36 -0.08 0.00 -1.62 0.00 0.00 43.42 41.80 3g0b n LEU 436 CO 0.57 -0.11 -0.34 -1.54 -1.22 0.00 0.00 177.39 174.74 3g0b n SER 437 N -1.36 0.42 -3.21 -1.43 3.41 -1.26 -4.86 113.62 105.33 3g0b n SER 437 Ca 0.08 -0.09 -0.00 0.00 -0.26 0.00 0.00 58.87 58.60 3g0b n SER 437 Cb 0.19 1.29 -0.03 0.00 -0.26 0.00 0.00 64.21 65.40 3g0b n SER 437 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3g0b s ASP 438 N -4.39 -0.92 0.51 4.04 3.68 -0.99 -5.05 116.67 113.55 3g0b s ASP 438 Ca -0.02 0.52 0.32 0.00 2.13 0.00 0.00 52.55 55.51 3g0b s ASP 438 Cb 0.13 1.83 1.31 0.00 -1.45 0.00 0.00 42.92 44.74 3g0b s ASP 438 CO 0.85 -0.28 1.94 1.88 0.13 0.00 0.00 175.17 179.70 3g0b h TYR 439 N 8.05 0.00 0.00 -5.34 0.05 -1.89 -2.09 116.97 115.75 3g0b h TYR 439 Ca -0.18 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.60 3g0b h TYR 439 Cb 1.16 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.90 3g0b h TYR 439 CO 0.14 0.00 0.00 1.79 -1.05 0.00 0.00 178.16 179.04 3g0b h THR 440 N 0.00 0.00 -1.85 -2.88 1.35 -1.91 -3.39 112.91 104.24 3g0b h THR 440 Ca 0.00 -0.51 -0.72 0.00 -0.55 0.00 0.00 66.41 64.63 3g0b h THR 440 Cb 0.49 1.44 -0.15 0.00 -1.73 0.00 0.00 68.15 68.20 3g0b h THR 440 CO 0.00 0.00 1.55 -0.54 -0.25 0.00 0.00 175.52 176.28 3g0b s LYS 441 N -3.21 4.05 -0.21 4.72 1.02 -0.79 -4.96 119.74 120.37 3g0b s LYS 441 Ca 0.08 -2.41 -0.04 0.00 0.02 0.00 0.00 55.97 53.61 3g0b s LYS 441 Cb 0.10 -5.18 -0.02 0.00 -0.52 0.00 0.00 37.83 32.22 3g0b s LYS 441 CO 0.56 -1.89 -0.03 0.08 -0.92 0.00 0.00 175.35 173.15 3g0b s VAL 442 N 2.27 3.62 -0.20 3.17 1.01 -1.26 -1.85 120.40 127.16 3g0b s VAL 442 Ca 0.45 -0.42 -0.05 0.00 0.00 0.00 0.00 61.98 61.96 3g0b s VAL 442 Cb -0.01 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 3g0b s VAL 442 CO 0.02 0.43 0.01 -0.89 0.00 0.00 0.00 175.10 174.66 3g0b s THR 443 N 1.22 4.01 -0.07 3.92 2.01 0.14 -4.94 115.64 121.92 3g0b s THR 443 Ca 0.03 -0.29 -0.30 0.00 0.31 0.00 0.00 61.69 61.44 3g0b s THR 443 Cb -0.14 -2.82 -0.02 0.00 0.01 0.00 0.00 72.50 69.53 3g0b s THR 443 CO -0.00 0.43 1.05 0.00 -0.69 0.00 0.00 174.62 175.40 3g0b n LEU 445 N 4.83 0.56 -0.02 0.00 4.77 0.14 -4.57 117.00 122.71 3g0b n LEU 445 Ca 0.09 0.23 -0.01 0.00 -0.03 0.00 0.00 56.01 56.29 3g0b n LEU 445 Cb 0.49 0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.60 3g0b n LEU 445 CO 0.53 0.07 -0.64 -1.54 -1.33 0.00 0.00 177.39 174.47 3g0b n SER 446 N -2.67 3.68 -0.34 -1.43 3.41 -1.19 -4.73 113.62 110.34 3g0b n SER 446 Ca -0.09 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.49 3g0b n SER 446 Cb 0.74 0.82 0.01 0.00 -0.26 0.00 0.00 64.21 65.52 3g0b n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g0b n GLU 448 N -5.43 1.14 0.19 0.00 -0.58 -1.26 -4.32 120.64 110.37 3g0b n GLU 448 Ca 0.07 -0.61 -0.14 0.00 -0.42 0.00 0.00 57.16 56.06 3g0b n GLU 448 Cb 0.37 -1.49 -0.07 0.00 -0.57 0.00 0.00 31.44 29.68 3g0b n GLU 448 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3g0b h LEU 449 N 1.48 -0.50 -6.39 -4.62 3.38 -1.66 -3.39 115.31 103.61 3g0b h LEU 449 Ca 0.00 0.04 -0.30 0.00 0.09 0.00 0.00 57.88 57.70 3g0b h LEU 449 Cb 0.46 0.16 -0.31 0.00 0.09 0.00 0.00 40.66 41.05 3g0b h LEU 449 CO 0.00 -0.31 -0.63 0.21 0.09 0.00 0.00 178.44 177.80 3g0b s ASN 450 N -4.78 1.10 0.19 -0.43 3.84 -1.26 -5.06 114.94 108.53 3g0b s ASN 450 Ca -0.16 -0.98 -0.11 0.00 0.21 0.00 0.00 52.86 51.83 3g0b s ASN 450 Cb 0.06 0.71 0.11 0.00 -0.55 0.00 0.00 41.25 41.57 3g0b s ASN 450 CO 0.64 -0.33 1.76 -0.65 -2.79 0.00 0.00 177.10 175.74 3g0b h PRO 451 N 7.76 0.98 0.02 0.43 0.11 -1.77 0.10 132.00 139.62 3g0b h PRO 451 Ca -0.05 -0.16 -0.30 0.00 0.11 0.00 0.00 66.00 65.60 3g0b h PRO 451 Cb 1.08 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 31.98 3g0b h PRO 451 CO 0.26 0.80 -1.77 0.39 -0.21 0.00 0.00 178.00 177.47 3g0b n GLU 452 N -4.43 0.65 0.08 1.05 1.02 -1.26 -4.07 120.64 113.68 3g0b n GLU 452 Ca 0.05 0.29 -0.15 0.00 -0.02 0.00 0.00 57.16 57.32 3g0b n GLU 452 Cb 0.15 -1.78 -0.14 0.00 -0.02 0.00 0.00 31.44 29.65 3g0b n GLU 452 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 3g0b h ARG 453 N 0.01 0.23 -4.11 3.49 2.43 -1.92 -3.41 114.38 111.10 3g0b h ARG 453 Ca -0.31 -0.39 -0.60 0.00 -0.81 0.00 0.00 59.98 57.87 3g0b h ARG 453 Cb 2.02 0.14 -0.39 0.00 -0.42 0.00 0.00 29.97 31.32 3g0b h ARG 453 CO 0.08 1.12 -0.76 0.00 -1.51 0.00 0.00 179.97 178.90 3g0b n GLN 455 N 4.67 0.41 -3.56 0.00 6.02 0.80 -4.56 117.38 121.16 3g0b n GLN 455 Ca -0.05 -0.61 -0.29 0.00 -0.01 0.00 0.00 57.00 56.03 3g0b n GLN 455 Cb 0.43 -0.77 -0.15 0.00 1.02 0.00 0.00 30.24 30.77 3g0b n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 3g0b s TYR 456 N -0.24 0.61 -0.06 1.08 6.14 -1.00 -0.49 117.35 123.40 3g0b s TYR 456 Ca 0.00 -1.13 0.03 0.00 0.64 0.00 0.00 57.07 56.61 3g0b s TYR 456 Cb 0.00 -1.04 -0.02 0.00 0.42 0.00 0.00 41.96 41.31 3g0b s TYR 456 CO 0.00 -0.84 -0.14 0.71 0.64 0.00 0.00 175.55 175.92 3g0b s TYR 457 N 1.86 2.70 0.38 4.97 2.02 -0.60 -0.26 117.35 128.42 3g0b s TYR 457 Ca 0.10 -0.20 0.07 0.00 -0.37 0.00 0.00 57.07 56.68 3g0b s TYR 457 Cb -0.17 -1.64 -0.07 0.00 -0.40 0.00 0.00 41.96 39.67 3g0b s TYR 457 CO -0.30 0.15 -0.02 -1.54 -1.57 0.00 0.00 175.55 172.28 3g0b s SER 458 N -0.64 3.67 0.01 2.29 1.04 -0.12 -4.45 113.70 115.49 3g0b s SER 458 Ca 0.10 -1.31 -0.04 0.00 0.48 0.00 0.00 55.95 55.17 3g0b s SER 458 Cb -0.11 -0.35 -0.01 0.00 0.10 0.00 0.00 66.02 65.65 3g0b s SER 458 CO 0.01 -0.39 0.07 0.54 0.98 0.00 0.00 173.24 174.45 3g0b s VAL 459 N -2.74 0.08 -0.15 5.02 0.11 -1.26 -0.26 120.40 121.20 3g0b s VAL 459 Ca 0.34 -0.70 -0.03 0.00 -2.93 0.00 0.00 61.98 58.66 3g0b s VAL 459 Cb 0.08 -0.34 0.05 0.00 -1.53 0.00 0.00 36.38 34.64 3g0b s VAL 459 CO 0.17 -0.39 0.05 -0.55 -3.33 0.00 0.00 175.10 171.06 3g0b s SER 460 N -1.26 2.29 0.30 3.54 0.15 -0.36 -4.98 113.70 113.38 3g0b s SER 460 Ca -0.14 -0.53 -0.10 0.00 0.70 0.00 0.00 55.95 55.88 3g0b s SER 460 Cb -0.08 -0.39 -0.07 0.00 -1.71 0.00 0.00 66.02 63.78 3g0b s SER 460 CO 0.00 -0.30 0.64 -0.36 1.20 0.00 0.00 173.24 174.43 3g0b s PHE 461 N 2.02 3.43 0.99 3.44 0.40 -1.26 -0.36 117.98 126.64 3g0b s PHE 461 Ca 0.02 0.95 -0.12 0.00 -0.60 0.00 0.00 56.93 57.17 3g0b s PHE 461 Cb -0.15 -2.33 0.18 0.00 0.51 0.00 0.00 43.02 41.23 3g0b s PHE 461 CO -0.07 0.13 1.09 -1.54 0.70 0.00 0.00 175.22 175.52 3g0b s SER 462 N -2.67 2.64 0.00 1.36 1.04 0.63 -4.81 113.70 111.89 3g0b s SER 462 Ca 0.49 1.32 0.00 0.00 0.48 0.00 0.00 55.95 58.24 3g0b s SER 462 Cb -0.11 -2.00 0.00 0.00 0.10 0.00 0.00 66.02 64.01 3g0b s SER 462 CO 0.24 -3.14 0.40 1.17 0.98 0.00 0.00 173.24 172.89 3g0b n LYS 463 N -4.20 0.00 -0.30 4.02 4.81 -1.12 -0.02 118.16 121.36 3g0b n LYS 463 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.49 3g0b n LYS 463 Cb 0.56 -1.47 0.00 0.00 0.02 0.00 0.00 35.03 34.15 3g0b n LYS 463 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 3g0b n GLU 464 N -0.90 0.00 -3.41 1.64 2.13 -1.26 -4.89 120.64 113.95 3g0b n GLU 464 Ca 0.00 -0.25 -0.20 0.00 0.66 0.00 0.00 57.16 57.37 3g0b n GLU 464 Cb 0.00 -0.15 0.07 0.00 0.27 0.00 0.00 31.44 31.62 3g0b n GLU 464 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3g0b n ALA 465 N 0.00 -1.09 0.72 4.31 0.00 0.98 -4.92 120.51 120.50 3g0b n ALA 465 Ca 0.00 0.34 0.11 0.00 0.00 0.00 0.00 53.44 53.89 3g0b n ALA 465 Cb 0.54 -4.68 -0.03 0.00 0.00 0.00 0.00 19.45 15.28 3g0b n ALA 465 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3g0b n LYS 466 N -4.25 0.19 -3.65 0.00 5.02 -1.26 -4.66 118.16 109.55 3g0b n LYS 466 Ca 0.01 -0.03 -0.15 0.00 -2.02 0.00 0.00 58.31 56.13 3g0b n LYS 466 Cb 0.55 -1.54 -0.14 0.00 -0.02 0.00 0.00 35.03 33.89 3g0b n LYS 466 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3g0b s TYR 467 N -3.14 -0.36 -0.05 2.13 1.51 -1.26 -3.07 117.35 113.12 3g0b s TYR 467 Ca 0.05 0.84 0.03 0.00 -1.01 0.00 0.00 57.07 56.97 3g0b s TYR 467 Cb 0.15 -0.11 -0.03 0.00 -0.11 0.00 0.00 41.96 41.86 3g0b s TYR 467 CO 0.83 -0.35 -0.11 1.52 -1.11 0.00 0.00 175.55 176.33 3g0b s TYR 468 N 2.38 2.81 -0.09 2.71 1.13 -0.10 -0.27 117.35 125.93 3g0b s TYR 468 Ca 0.02 -0.08 -0.15 0.00 -1.41 0.00 0.00 57.07 55.46 3g0b s TYR 468 Cb -0.12 -1.65 -0.05 0.00 -1.10 0.00 0.00 41.96 39.04 3g0b s TYR 468 CO -0.08 0.27 0.38 -1.14 -2.51 0.00 0.00 175.55 172.47 3g0b s GLN 469 N -0.88 4.11 -0.20 -3.49 0.74 0.51 -0.73 119.66 119.73 3g0b s GLN 469 Ca 0.13 0.29 -0.06 0.00 0.05 0.00 0.00 55.36 55.76 3g0b s GLN 469 Cb -0.11 -3.34 -0.03 0.00 1.10 0.00 0.00 33.01 30.63 3g0b s GLN 469 CO 0.02 0.41 0.04 -0.51 -0.55 0.00 0.00 175.29 174.69 3g0b s LEU 470 N -0.12 3.54 -0.34 3.68 1.43 -0.29 -1.23 118.68 125.36 3g0b s LEU 470 Ca 0.22 -0.07 -0.10 0.00 -1.03 0.00 0.00 54.13 53.14 3g0b s LEU 470 Cb -0.15 -1.90 0.01 0.00 0.03 0.00 0.00 46.19 44.18 3g0b s LEU 470 CO 0.09 0.10 0.18 -0.60 0.23 0.00 0.00 176.35 176.35 3g0b s ARG 471 N 0.79 3.08 -0.31 1.70 3.52 0.64 -2.39 118.95 125.97 3g0b s ARG 471 Ca 0.02 -0.90 -0.15 0.00 -0.13 0.00 0.00 55.73 54.57 3g0b s ARG 471 Cb -0.14 -3.65 -0.02 0.00 -1.56 0.00 0.00 34.95 29.58 3g0b s ARG 471 CO 0.02 -0.56 0.36 0.00 -0.81 0.00 0.00 175.30 174.32 3g0b n SER 473 N 5.37 2.15 0.00 0.00 7.64 0.64 -1.02 113.62 128.40 3g0b n SER 473 Ca -0.09 -1.64 0.00 0.00 1.01 0.00 0.00 58.87 58.15 3g0b n SER 473 Cb 0.50 0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 3g0b n SER 473 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g0b n GLY 474 N 1.31 -0.31 0.26 0.23 0.00 -1.26 -0.77 105.19 104.65 3g0b n GLY 474 Ca 0.15 -1.66 0.15 0.00 0.00 0.00 0.00 46.02 44.65 3g0b n GLY 474 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3g0b h PRO 475 N 4.11 0.00 0.00 1.61 0.13 -0.51 0.24 132.00 137.58 3g0b h PRO 475 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.04 3g0b h PRO 475 Cb 0.00 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.17 3g0b h PRO 475 CO 0.00 0.05 0.06 0.41 -0.23 0.00 0.00 178.00 178.29 3g0b n GLY 476 N 0.17 -1.79 3.75 1.56 0.00 -0.03 -4.29 105.19 104.57 3g0b n GLY 476 Ca 0.01 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 3g0b n GLY 476 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3g0b n LEU 477 N 0.00 4.41 -4.60 0.99 4.32 -1.26 -4.54 117.00 116.32 3g0b n LEU 477 Ca 0.03 1.14 -0.41 0.00 -0.02 0.00 0.00 56.01 56.75 3g0b n LEU 477 Cb 0.12 -1.60 0.01 0.00 -1.62 0.00 0.00 43.42 40.33 3g0b n LEU 477 CO 0.09 0.20 0.55 -2.65 -1.22 0.00 0.00 177.39 174.36 3g0b n PRO 478 N 2.32 1.29 -4.21 3.23 -0.02 -1.26 -4.77 135.00 131.58 3g0b n PRO 478 Ca 0.09 0.46 -0.20 0.00 -2.02 0.00 0.00 63.50 61.84 3g0b n PRO 478 Cb 0.37 -2.01 -0.16 0.00 -0.02 0.00 0.00 33.50 31.68 3g0b n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3g0b s LEU 479 N -0.43 1.44 -0.19 2.45 2.96 -0.19 -4.17 118.68 120.56 3g0b s LEU 479 Ca 0.64 -0.14 0.00 0.00 -0.22 0.00 0.00 54.13 54.41 3g0b s LEU 479 Cb -0.56 -0.46 0.02 0.00 0.50 0.00 0.00 46.19 45.69 3g0b s LEU 479 CO 0.57 -0.03 -0.18 -0.31 -1.32 0.00 0.00 176.35 175.08 3g0b s TYR 480 N 0.74 2.81 0.06 5.38 2.02 0.10 -0.45 117.35 128.02 3g0b s TYR 480 Ca -0.10 -1.54 0.04 0.00 -0.37 0.00 0.00 57.07 55.09 3g0b s TYR 480 Cb -0.13 -1.95 -0.03 0.00 -0.40 0.00 0.00 41.96 39.45 3g0b s TYR 480 CO 0.00 -0.77 -0.11 0.95 -1.57 0.00 0.00 175.55 174.06 3g0b s THR 481 N 1.32 0.83 -0.13 -0.71 -4.23 -1.01 0.18 115.64 111.89 3g0b s THR 481 Ca 0.05 -1.25 -0.03 0.00 -1.18 0.00 0.00 61.69 59.28 3g0b s THR 481 Cb -0.13 -0.91 -0.03 0.00 1.34 0.00 0.00 72.50 72.77 3g0b s THR 481 CO -0.12 -0.34 -0.04 -0.22 -0.54 0.00 0.00 174.62 173.36 3g0b s LEU 482 N -1.77 3.27 0.03 4.79 0.20 -0.45 -1.13 118.68 123.62 3g0b s LEU 482 Ca -0.05 -0.08 0.05 0.00 0.69 0.00 0.00 54.13 54.75 3g0b s LEU 482 Cb -0.09 -1.77 -0.02 0.00 -0.43 0.00 0.00 46.19 43.88 3g0b s LEU 482 CO 0.01 0.23 -0.15 -1.00 -0.29 0.00 0.00 176.35 175.14 3g0b s HIS 483 N 0.01 1.36 -0.03 5.38 3.76 0.09 0.26 115.29 126.12 3g0b s HIS 483 Ca 0.01 -0.33 -0.22 0.00 -0.15 0.00 0.00 55.06 54.37 3g0b s HIS 483 Cb -0.13 -0.83 -0.05 0.00 1.11 0.00 0.00 32.58 32.69 3g0b s HIS 483 CO 0.03 0.03 0.65 -1.54 -0.85 0.00 0.00 174.74 173.06 3g0b s SER 484 N -0.92 6.98 0.00 1.40 1.04 -0.92 -0.92 113.70 120.36 3g0b s SER 484 Ca 0.04 1.18 0.28 0.00 0.48 0.00 0.00 55.95 57.93 3g0b s SER 484 Cb -0.07 -2.39 1.10 0.00 0.10 0.00 0.00 66.02 64.75 3g0b s SER 484 CO 0.01 -0.01 1.79 -1.54 0.98 0.00 0.00 173.24 174.46 3g0b n SER 485 N 3.27 0.43 0.08 7.02 3.41 -1.18 -1.39 113.62 125.28 3g0b n SER 485 Ca -0.04 -0.38 -0.13 0.00 -0.26 0.00 0.00 58.87 58.06 3g0b n SER 485 Cb 0.51 -0.08 -0.08 0.00 -0.26 0.00 0.00 64.21 64.30 3g0b n SER 485 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 3g0b h VAL 486 N 0.43 0.97 0.00 -3.33 3.04 -1.89 -3.36 116.25 112.12 3g0b h VAL 486 Ca 0.00 -0.48 0.00 0.00 -1.01 0.00 0.00 66.70 65.21 3g0b h VAL 486 Cb 0.41 1.27 0.00 0.00 -2.01 0.00 0.00 31.29 30.96 3g0b h VAL 486 CO 0.00 0.12 -0.01 0.59 -1.01 0.00 0.00 177.57 177.25 3g0b n ASN 487 N -5.07 1.81 -2.65 3.17 4.13 -1.25 -5.00 115.26 110.40 3g0b n ASN 487 Ca -0.09 -2.06 -0.15 0.00 1.68 0.00 0.00 54.58 53.96 3g0b n ASN 487 Cb 0.18 -0.07 -0.00 0.00 -1.54 0.00 0.00 39.78 38.35 3g0b n ASN 487 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 3g0b n ASP 488 N -0.58 -3.91 -4.80 6.41 10.43 -0.48 -4.96 116.55 118.65 3g0b n ASP 488 Ca 0.02 0.06 -0.36 0.00 2.57 0.00 0.00 54.79 57.09 3g0b n ASP 488 Cb 0.34 -3.30 -0.07 0.00 1.84 0.00 0.00 41.12 39.93 3g0b n ASP 488 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 3g0b s LYS 489 N -5.25 3.81 0.01 -1.24 2.20 -1.18 -4.90 119.74 113.19 3g0b s LYS 489 Ca 0.09 -0.18 -0.30 0.00 -0.36 0.00 0.00 55.97 55.22 3g0b s LYS 489 Cb -0.05 -3.30 -0.06 0.00 -1.51 0.00 0.00 37.83 32.91 3g0b s LYS 489 CO 0.11 0.54 1.45 0.20 -0.36 0.00 0.00 175.35 177.30 3g0b s GLY 490 N -0.34 1.79 -0.07 5.54 0.00 -1.26 -2.17 107.32 110.81 3g0b s GLY 490 Ca 0.11 0.95 -0.02 0.00 0.00 0.00 0.00 44.72 45.76 3g0b s GLY 490 CO 0.01 2.59 0.10 1.41 0.00 0.00 0.00 173.10 177.21 3g0b h LEU 491 N 8.40 -0.06 -7.55 0.66 3.38 -0.55 -3.48 115.31 116.10 3g0b h LEU 491 Ca -0.39 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.53 3g0b h LEU 491 Cb 1.18 0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.83 3g0b h LEU 491 CO 0.91 0.32 -0.08 0.00 0.09 0.00 0.00 178.44 179.68 3g0b s ARG 492 N -1.69 1.16 -0.31 1.13 1.70 -1.21 -5.01 118.95 114.72 3g0b s ARG 492 Ca -0.01 -0.81 -0.24 0.00 -0.47 0.00 0.00 55.73 54.20 3g0b s ARG 492 Cb 0.00 0.47 0.00 0.00 -0.57 0.00 0.00 34.95 34.85 3g0b s ARG 492 CO 0.03 -0.46 0.82 0.08 -1.08 0.00 0.00 175.30 174.69 3g0b s VAL 493 N -3.84 4.76 -0.12 4.99 1.01 -1.26 -1.34 120.40 124.60 3g0b s VAL 493 Ca 0.06 1.24 -0.26 0.00 0.00 0.00 0.00 61.98 63.02 3g0b s VAL 493 Cb 0.01 -4.18 -0.27 0.00 0.00 0.00 0.00 36.38 31.94 3g0b s VAL 493 CO -0.08 -0.28 0.76 -0.07 0.00 0.00 0.00 175.10 175.43 3g0b h LEU 494 N 9.54 0.14 -7.29 3.92 3.38 -0.61 -3.47 115.31 120.92 3g0b h LEU 494 Ca -0.24 -0.96 -0.15 0.00 0.09 0.00 0.00 57.88 56.62 3g0b h LEU 494 Cb 1.09 -0.04 -0.28 0.00 0.09 0.00 0.00 40.66 41.52 3g0b h LEU 494 CO 0.90 1.15 -0.38 -0.70 0.09 0.00 0.00 178.44 179.50 3g0b s GLU 495 N -2.29 0.31 0.00 1.13 2.56 -0.99 -4.99 118.70 114.43 3g0b s GLU 495 Ca -0.18 0.65 0.00 0.00 0.00 0.00 0.00 54.97 55.44 3g0b s GLU 495 Cb -0.01 -0.05 0.00 0.00 2.00 0.00 0.00 34.13 36.07 3g0b s GLU 495 CO 0.72 -0.15 0.96 -0.40 -0.56 0.00 0.00 175.26 175.83 3g0b n ASP 496 N 4.15 1.87 -3.01 -1.70 3.85 -1.26 0.00 116.55 120.45 3g0b n ASP 496 Ca -0.23 -1.92 -0.22 0.00 -0.71 0.00 0.00 54.79 51.71 3g0b n ASP 496 Cb 0.54 0.00 0.02 0.00 -1.35 0.00 0.00 41.12 40.33 3g0b n ASP 496 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 3g0b n ASN 497 N -0.46 -5.23 0.01 -1.12 3.02 -1.26 -4.88 115.26 105.34 3g0b n ASN 497 Ca 0.00 -0.25 0.02 0.00 -0.03 0.00 0.00 54.58 54.32 3g0b n ASN 497 Cb 0.25 -4.28 0.36 0.00 -0.61 0.00 0.00 39.78 35.51 3g0b n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3g0b h SER 498 N -1.02 0.46 0.01 6.41 4.64 -1.94 -1.26 113.55 120.85 3g0b h SER 498 Ca -0.48 -0.05 0.01 0.00 -0.47 0.00 0.00 61.79 60.80 3g0b h SER 498 Cb 1.33 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 3g0b h SER 498 CO 0.54 0.45 -0.04 0.00 -0.87 0.00 0.00 176.83 176.91 3g0b h ALA 499 N 1.62 -0.05 -0.53 5.18 0.00 -1.99 -2.63 119.26 120.86 3g0b h ALA 499 Ca 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 3g0b h ALA 499 Cb 0.15 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3g0b h ALA 499 CO -0.01 -0.54 -0.13 1.25 0.00 0.00 0.00 179.25 179.82 3g0b h LEU 500 N -0.08 1.03 -1.00 0.00 5.85 -1.76 -2.99 115.31 116.35 3g0b h LEU 500 Ca 0.02 -0.36 0.20 0.00 0.84 0.00 0.00 57.88 58.57 3g0b h LEU 500 Cb 0.10 -0.28 -0.11 0.00 0.37 0.00 0.00 40.66 40.74 3g0b h LEU 500 CO -0.04 1.15 0.61 -0.78 -0.34 0.00 0.00 178.44 179.04 3g0b h ASP 501 N 0.90 0.77 -0.04 1.25 1.82 -1.16 -2.03 116.42 117.92 3g0b h ASP 501 Ca 0.13 0.10 -0.02 0.00 -0.39 0.00 0.00 57.03 56.86 3g0b h ASP 501 Cb 0.70 -0.03 -0.00 0.00 0.68 0.00 0.00 39.33 40.68 3g0b h ASP 501 CO 0.05 0.25 -0.04 0.50 -1.61 0.00 0.00 179.24 178.39 3g0b h LYS 502 N 0.74 0.10 0.00 0.28 3.64 -1.32 -3.11 116.57 116.90 3g0b h LYS 502 Ca 0.59 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.92 3g0b h LYS 502 Cb 0.94 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 3g0b h LYS 502 CO -0.40 0.57 0.00 0.00 -2.27 0.00 0.00 179.45 177.35 3g0b h MET 503 N -0.37 0.00 -0.00 1.90 -0.00 -1.52 -2.84 114.93 112.11 3g0b h MET 503 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.71 3g0b h MET 503 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.15 3g0b h MET 503 CO 0.01 0.00 -0.17 1.28 -0.00 0.00 0.00 176.91 178.03 3g0b n LEU 504 N -2.36 0.20 0.21 -0.10 4.32 -0.78 -3.38 117.00 115.12 3g0b n LEU 504 Ca 0.03 0.29 0.12 0.00 -0.02 0.00 0.00 56.01 56.44 3g0b n LEU 504 Cb 0.32 -0.39 0.21 0.00 -1.62 0.00 0.00 43.42 41.95 3g0b n LEU 504 CO 0.25 0.05 0.82 1.56 -1.22 0.00 0.00 177.39 178.85 3g0b h GLN 505 N 0.05 0.00 -0.05 3.23 4.20 -1.43 -3.07 115.11 118.03 3g0b h GLN 505 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3g0b h GLN 505 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 3g0b h GLN 505 CO 0.00 0.00 0.00 -1.71 -0.67 0.00 0.00 178.83 176.45 3g0b n ASN 506 N -3.04 1.33 -4.25 1.46 5.15 -1.22 -4.89 115.26 109.80 3g0b n ASN 506 Ca 0.04 -1.50 -0.28 0.00 -0.60 0.00 0.00 54.58 52.23 3g0b n ASN 506 Cb 0.51 -0.03 -0.16 0.00 -0.53 0.00 0.00 39.78 39.58 3g0b n ASN 506 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3g0b s VAL 507 N -1.94 1.77 -1.11 3.44 1.01 -1.16 -3.86 120.40 118.54 3g0b s VAL 507 Ca 0.37 -0.97 -0.20 0.00 0.00 0.00 0.00 61.98 61.18 3g0b s VAL 507 Cb 0.20 -1.47 0.07 0.00 0.00 0.00 0.00 36.38 35.18 3g0b s VAL 507 CO 0.31 0.49 1.50 -1.10 0.00 0.00 0.00 175.10 176.30 3g0b s GLN 508 N -0.55 3.75 0.24 2.72 -0.21 0.81 -4.97 119.66 121.45 3g0b s GLN 508 Ca 0.09 -1.57 -0.23 0.00 0.02 0.00 0.00 55.36 53.67 3g0b s GLN 508 Cb -0.09 -5.34 -0.09 0.00 1.00 0.00 0.00 33.01 28.50 3g0b s GLN 508 CO -0.01 -2.14 0.80 -1.64 -2.12 0.00 0.00 175.29 170.19 3g0b s MET 509 N 4.23 4.43 0.84 2.91 -1.94 -1.26 -4.44 119.30 124.06 3g0b s MET 509 Ca 0.47 1.08 -0.11 0.00 -1.71 0.00 0.00 55.69 55.41 3g0b s MET 509 Cb 0.00 -2.94 0.10 0.00 2.01 0.00 0.00 34.83 34.00 3g0b s MET 509 CO -0.04 0.40 1.09 -1.25 -0.01 0.00 0.00 175.02 175.21 3g0b s PRO 510 N -1.81 1.72 0.39 2.03 0.04 -1.26 -4.24 135.00 131.87 3g0b s PRO 510 Ca 0.44 0.96 0.08 0.00 0.04 0.00 0.00 61.00 62.52 3g0b s PRO 510 Cb -0.19 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.48 3g0b s PRO 510 CO 0.23 -1.96 0.34 -1.54 0.04 0.00 0.00 177.00 174.11 3g0b s SER 511 N -3.43 5.09 -0.15 6.66 1.04 0.22 -4.91 113.70 118.22 3g0b s SER 511 Ca 0.62 -0.68 0.01 0.00 0.48 0.00 0.00 55.95 56.38 3g0b s SER 511 Cb -0.17 -0.70 0.02 0.00 0.10 0.00 0.00 66.02 65.27 3g0b s SER 511 CO 0.56 -0.54 -0.15 -0.75 0.98 0.00 0.00 173.24 173.34 3g0b s LYS 512 N -4.07 2.41 -0.25 4.02 2.20 -1.26 -0.10 119.74 122.70 3g0b s LYS 512 Ca 0.45 -0.61 -0.14 0.00 -0.36 0.00 0.00 55.97 55.32 3g0b s LYS 512 Cb -0.04 -2.16 -0.04 0.00 -1.51 0.00 0.00 37.83 34.08 3g0b s LYS 512 CO 0.27 -0.21 0.31 0.21 -0.36 0.00 0.00 175.35 175.57 3g0b s LYS 513 N 1.40 4.06 -0.16 4.03 2.20 -0.07 -4.94 119.74 126.26 3g0b s LYS 513 Ca 0.04 -0.03 -0.02 0.00 -0.36 0.00 0.00 55.97 55.60 3g0b s LYS 513 Cb -0.13 -3.60 -0.01 0.00 -1.51 0.00 0.00 37.83 32.58 3g0b s LYS 513 CO -0.10 -0.13 -0.09 -1.17 -0.36 0.00 0.00 175.35 173.50 3g0b s LEU 514 N 1.61 2.85 0.00 5.43 0.20 -1.26 -0.14 118.68 127.37 3g0b s LEU 514 Ca 0.13 -0.32 -0.13 0.00 0.69 0.00 0.00 54.13 54.50 3g0b s LEU 514 Cb -0.15 -1.68 0.05 0.00 -0.43 0.00 0.00 46.19 43.98 3g0b s LEU 514 CO 0.08 0.10 0.68 -0.67 -0.29 0.00 0.00 176.35 176.26 3g0b n ASP 515 N 3.96 -1.55 -4.26 3.68 4.64 -0.84 -5.03 116.55 117.15 3g0b n ASP 515 Ca -0.18 -1.98 -0.16 0.00 -1.38 0.00 0.00 54.79 51.09 3g0b n ASP 515 Cb 0.52 2.56 -0.10 0.00 -1.04 0.00 0.00 41.12 43.06 3g0b n ASP 515 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 3g0b s PHE 516 N -3.49 1.38 0.12 -0.67 -0.12 -1.26 -0.55 117.98 113.39 3g0b s PHE 516 Ca 0.14 -0.64 0.11 0.00 -0.05 0.00 0.00 56.93 56.49 3g0b s PHE 516 Cb -0.03 -0.70 -0.04 0.00 -0.63 0.00 0.00 43.02 41.62 3g0b s PHE 516 CO 0.07 0.15 -0.26 0.96 -0.05 0.00 0.00 175.22 176.09 3g0b s ILE 517 N -2.73 2.32 -0.29 -4.49 -4.36 -0.07 -4.94 121.20 106.63 3g0b s ILE 517 Ca 0.14 -1.70 -0.16 0.00 -0.26 0.00 0.00 60.65 58.67 3g0b s ILE 517 Cb -0.01 -2.02 -0.02 0.00 1.25 0.00 0.00 42.46 41.65 3g0b s ILE 517 CO 0.03 0.12 0.44 -0.63 0.24 0.00 0.00 174.94 175.13 3g0b s ILE 518 N -1.05 5.11 -0.24 8.37 -1.09 -1.26 -1.54 121.20 129.50 3g0b s ILE 518 Ca 0.14 0.54 0.01 0.00 -2.23 0.00 0.00 60.65 59.11 3g0b s ILE 518 Cb -0.10 -3.80 0.06 0.00 -1.58 0.00 0.00 42.46 37.04 3g0b s ILE 518 CO 0.06 0.03 -0.07 -0.76 -1.23 0.00 0.00 174.94 172.97 3g0b s LEU 519 N 2.20 2.81 -1.22 2.97 1.02 -0.57 -4.78 118.68 121.10 3g0b s LEU 519 Ca 0.17 -1.24 -0.11 0.00 0.02 0.00 0.00 54.13 52.96 3g0b s LEU 519 Cb -0.16 -1.28 -0.01 0.00 0.02 0.00 0.00 46.19 44.77 3g0b s LEU 519 CO 0.11 -0.23 0.70 0.59 0.02 0.00 0.00 176.35 177.54 3g0b n ASN 520 N 4.61 -3.48 -1.16 2.29 3.02 -1.26 -2.09 115.26 117.18 3g0b n ASN 520 Ca -0.12 -0.96 -0.15 0.00 -0.03 0.00 0.00 54.58 53.31 3g0b n ASN 520 Cb 0.43 -3.54 -0.06 0.00 -0.61 0.00 0.00 39.78 36.00 3g0b n ASN 520 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3g0b n GLU 521 N -4.20 -1.49 -5.05 3.52 1.02 -1.26 -4.98 120.64 108.20 3g0b n GLU 521 Ca -0.18 1.03 -0.32 0.00 -0.02 0.00 0.00 57.16 57.66 3g0b n GLU 521 Cb 0.63 -5.38 -0.14 0.00 -0.02 0.00 0.00 31.44 26.53 3g0b n GLU 521 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3g0b s THR 522 N -2.34 2.63 -0.25 2.62 2.01 -0.89 -5.10 115.64 114.32 3g0b s THR 522 Ca 0.00 -0.88 -0.28 0.00 0.31 0.00 0.00 61.69 60.85 3g0b s THR 522 Cb 0.00 -2.00 0.01 0.00 0.01 0.00 0.00 72.50 70.52 3g0b s THR 522 CO 0.00 0.58 0.98 -0.54 -0.69 0.00 0.00 174.62 174.95 3g0b s LYS 523 N -0.54 4.20 -0.16 4.92 1.02 -1.26 -1.51 119.74 126.41 3g0b s LYS 523 Ca 0.07 1.17 0.01 0.00 0.02 0.00 0.00 55.97 57.24 3g0b s LYS 523 Cb -0.11 -3.66 0.00 0.00 -0.52 0.00 0.00 37.83 33.54 3g0b s LYS 523 CO 0.01 -0.65 -0.17 -0.06 -0.92 0.00 0.00 175.35 173.56 3g0b s PHE 524 N 3.17 2.77 0.08 3.18 0.08 -0.59 -4.97 117.98 121.70 3g0b s PHE 524 Ca 0.41 -1.22 -0.15 0.00 0.12 0.00 0.00 56.93 56.10 3g0b s PHE 524 Cb -0.15 -1.89 -0.06 0.00 -0.57 0.00 0.00 43.02 40.35 3g0b s PHE 524 CO 0.08 -0.57 0.49 -1.58 -0.10 0.00 0.00 175.22 173.54 3g0b s TRP 525 N 0.95 3.68 0.12 0.36 0.52 -1.25 -0.89 118.94 122.42 3g0b s TRP 525 Ca -0.03 1.05 0.04 0.00 0.02 0.00 0.00 56.10 57.18 3g0b s TRP 525 Cb -0.15 -2.34 -0.04 0.00 -1.15 0.00 0.00 33.47 29.79 3g0b s TRP 525 CO -0.03 0.53 -0.10 1.52 0.02 0.00 0.00 176.95 178.89 3g0b s TYR 526 N -1.28 1.13 0.09 -1.98 -0.85 0.29 -0.79 117.35 113.96 3g0b s TYR 526 Ca 0.31 -0.71 0.09 0.00 -0.52 0.00 0.00 57.07 56.24 3g0b s TYR 526 Cb -0.16 -0.60 -0.03 0.00 0.38 0.00 0.00 41.96 41.54 3g0b s TYR 526 CO 0.17 0.02 -0.22 1.14 -1.52 0.00 0.00 175.55 175.14 3g0b s GLN 527 N -3.23 1.26 -0.10 -3.49 -2.07 -0.47 -1.99 119.66 109.57 3g0b s GLN 527 Ca 0.10 -1.15 0.00 0.00 -1.82 0.00 0.00 55.36 52.50 3g0b s GLN 527 Cb -0.00 -1.53 0.02 0.00 -1.09 0.00 0.00 33.01 30.41 3g0b s GLN 527 CO -0.00 0.37 -0.09 -1.64 -1.32 0.00 0.00 175.29 172.61 3g0b s MET 528 N -1.76 1.53 -0.39 9.60 -1.94 0.80 -1.51 119.30 125.63 3g0b s MET 528 Ca 0.08 -0.29 -0.25 0.00 -1.71 0.00 0.00 55.69 53.53 3g0b s MET 528 Cb -0.10 -1.49 0.02 0.00 2.01 0.00 0.00 34.83 35.27 3g0b s MET 528 CO 0.04 -0.17 0.87 0.42 -0.01 0.00 0.00 175.02 176.16 3g0b s ILE 529 N 1.37 4.62 -0.16 2.53 -1.09 0.11 -0.89 121.20 127.68 3g0b s ILE 529 Ca -0.01 0.95 -0.04 0.00 -2.23 0.00 0.00 60.65 59.32 3g0b s ILE 529 Cb -0.14 -4.31 -0.03 0.00 -1.58 0.00 0.00 42.46 36.41 3g0b s ILE 529 CO -0.04 -0.57 -0.03 -0.76 -1.23 0.00 0.00 174.94 172.30 3g0b s LEU 530 N 3.39 3.25 0.62 2.97 1.43 0.86 -2.09 118.68 129.11 3g0b s LEU 530 Ca 0.35 -0.14 -0.17 0.00 -1.03 0.00 0.00 54.13 53.13 3g0b s LEU 530 Cb -0.12 -1.79 -0.08 0.00 0.03 0.00 0.00 46.19 44.23 3g0b s LEU 530 CO 0.20 0.15 0.46 -2.65 0.23 0.00 0.00 176.35 174.74 3g0b n PRO 531 N 3.68 0.41 -1.64 1.29 -0.02 -1.26 -0.61 135.00 136.84 3g0b n PRO 531 Ca -0.17 0.17 -0.37 0.00 -2.02 0.00 0.00 63.50 61.11 3g0b n PRO 531 Cb 0.52 -1.69 0.08 0.00 -0.02 0.00 0.00 33.50 32.39 3g0b n PRO 531 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3g0b n PRO 532 N -0.12 0.99 -3.69 0.52 -0.04 -1.26 -2.87 135.00 128.53 3g0b n PRO 532 Ca 0.11 0.40 -0.25 0.00 -0.04 0.00 0.00 63.50 63.71 3g0b n PRO 532 Cb 0.48 -2.52 0.06 0.00 -0.04 0.00 0.00 33.50 31.49 3g0b n PRO 532 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3g0b n HIS 533 N -2.10 -2.54 -1.68 0.54 8.25 -1.26 -4.86 115.22 111.57 3g0b n HIS 533 Ca 0.16 0.96 -0.47 0.00 -0.26 0.00 0.00 57.72 58.11 3g0b n HIS 533 Cb 0.48 -4.66 -0.04 0.00 1.12 0.00 0.00 29.99 26.89 3g0b n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3g0b n PHE 534 N -4.75 2.37 -4.02 4.41 7.35 -1.14 -4.95 117.46 116.75 3g0b n PHE 534 Ca -0.04 -0.05 -0.32 0.00 -0.76 0.00 0.00 57.45 56.28 3g0b n PHE 534 Cb 0.57 -2.68 -0.15 0.00 0.35 0.00 0.00 39.48 37.57 3g0b n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3g0b s ASP 535 N 3.75 4.68 0.00 -2.13 -1.08 -1.26 -4.97 116.67 115.65 3g0b s ASP 535 Ca 0.90 -1.77 0.16 0.00 -0.52 0.00 0.00 52.55 51.32 3g0b s ASP 535 Cb -0.64 -1.62 0.81 0.00 -1.46 0.00 0.00 42.92 40.02 3g0b s ASP 535 CO 0.48 -0.30 1.54 2.29 0.52 0.00 0.00 175.17 179.70 3g0b n LYS 536 N 4.37 1.22 0.00 4.34 2.85 -1.26 -1.21 118.16 128.48 3g0b n LYS 536 Ca -0.05 -0.34 0.13 0.00 -1.05 0.00 0.00 58.31 57.00 3g0b n LYS 536 Cb 0.42 -1.27 0.39 0.00 -0.65 0.00 0.00 35.03 33.91 3g0b n LYS 536 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 3g0b n SER 537 N -0.40 0.33 -4.93 -5.58 3.41 -1.26 -4.34 113.62 100.84 3g0b n SER 537 Ca 0.12 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.49 3g0b n SER 537 Cb 0.13 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.05 3g0b n SER 537 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3g0b s LYS 538 N -2.99 3.51 -0.34 4.33 1.02 -0.35 -5.04 119.74 119.88 3g0b s LYS 538 Ca 0.12 -0.26 -0.07 0.00 0.02 0.00 0.00 55.97 55.78 3g0b s LYS 538 Cb 0.18 -2.66 0.03 0.00 -0.52 0.00 0.00 37.83 34.86 3g0b s LYS 538 CO 0.64 0.17 0.12 0.15 -0.92 0.00 0.00 175.35 175.50 3g0b s LYS 539 N -4.13 2.71 0.10 1.68 -0.14 -1.26 -4.32 119.74 114.38 3g0b s LYS 539 Ca 0.41 -1.13 -0.05 0.00 -1.36 0.00 0.00 55.97 53.84 3g0b s LYS 539 Cb -0.10 -3.50 -0.05 0.00 -1.68 0.00 0.00 37.83 32.50 3g0b s LYS 539 CO 0.35 -0.65 0.33 0.71 -0.76 0.00 0.00 175.35 175.33 3g0b s TYR 540 N 1.44 3.51 0.73 3.18 2.02 0.53 -4.43 117.35 124.34 3g0b s TYR 540 Ca -0.01 0.52 -0.13 0.00 -0.37 0.00 0.00 57.07 57.09 3g0b s TYR 540 Cb -0.19 -1.97 0.04 0.00 -0.40 0.00 0.00 41.96 39.44 3g0b s TYR 540 CO 0.04 0.50 1.11 -1.25 -1.57 0.00 0.00 175.55 174.38 3g0b s PRO 541 N -2.41 2.39 -0.02 -1.71 0.04 -1.26 0.02 135.00 132.05 3g0b s PRO 541 Ca 0.37 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.73 3g0b s PRO 541 Cb -0.13 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.53 3g0b s PRO 541 CO 0.23 -1.56 -0.00 -1.17 0.04 0.00 0.00 177.00 174.53 3g0b s LEU 542 N -5.50 1.47 -0.23 -3.56 2.96 -0.58 -1.33 118.68 111.91 3g0b s LEU 542 Ca 0.65 -0.02 -0.02 0.00 -0.22 0.00 0.00 54.13 54.51 3g0b s LEU 542 Cb -0.20 -0.16 0.01 0.00 0.50 0.00 0.00 46.19 46.34 3g0b s LEU 542 CO 0.50 -0.06 -0.06 -0.22 -1.32 0.00 0.00 176.35 175.19 3g0b s LEU 543 N 0.62 2.98 -0.38 -0.68 2.96 0.94 0.08 118.68 125.21 3g0b s LEU 543 Ca -0.06 -0.65 -0.29 0.00 -0.22 0.00 0.00 54.13 52.91 3g0b s LEU 543 Cb -0.09 -1.68 0.01 0.00 0.50 0.00 0.00 46.19 44.94 3g0b s LEU 543 CO -0.01 -0.07 1.23 -0.22 -1.32 0.00 0.00 176.35 175.96 3g0b s LEU 544 N 1.39 3.76 -0.35 -0.68 2.96 0.10 -0.53 118.68 125.34 3g0b s LEU 544 Ca 0.03 0.89 -0.19 0.00 -0.22 0.00 0.00 54.13 54.64 3g0b s LEU 544 Cb -0.15 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 42.99 3g0b s LEU 544 CO -0.05 -1.16 0.55 -0.62 -1.32 0.00 0.00 176.35 173.75 3g0b s ASP 545 N 2.70 6.35 -0.03 3.68 3.68 0.28 -0.56 116.67 132.78 3g0b s ASP 545 Ca 0.53 0.03 0.06 0.00 2.13 0.00 0.00 52.55 55.30 3g0b s ASP 545 Cb -0.12 -2.29 -0.01 0.00 -1.45 0.00 0.00 42.92 39.05 3g0b s ASP 545 CO 0.26 -0.52 -0.22 0.54 0.13 0.00 0.00 175.17 175.37 3g0b s VAL 546 N 2.49 1.75 0.01 1.11 0.11 -0.17 -4.23 120.40 121.48 3g0b s VAL 546 Ca 0.21 -0.92 -0.00 0.00 -2.93 0.00 0.00 61.98 58.33 3g0b s VAL 546 Cb -0.15 -1.47 -0.00 0.00 -1.53 0.00 0.00 36.38 33.22 3g0b s VAL 546 CO 0.14 0.50 -0.01 0.00 -3.33 0.00 0.00 175.10 172.39 3g0b n TYR 547 N 2.79 0.00 -1.12 1.54 -0.00 -1.26 -4.17 117.16 114.94 3g0b n TYR 547 Ca -0.17 0.00 -0.04 0.00 -0.00 0.00 0.00 57.90 57.69 3g0b n TYR 547 Cb 0.52 -0.01 -0.02 0.00 -0.00 0.00 0.00 39.34 39.83 3g0b n TYR 547 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 3g0b n ALA 548 N -2.66 -0.06 -1.21 2.98 0.00 -1.26 -3.04 120.51 115.26 3g0b n ALA 548 Ca -0.00 0.07 -0.29 0.00 0.00 0.00 0.00 53.44 53.21 3g0b n ALA 548 Cb 0.01 -1.61 0.15 0.00 0.00 0.00 0.00 19.45 18.00 3g0b n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3g0b s GLY 549 N -2.15 1.60 0.15 0.00 0.00 -1.26 -4.79 107.32 100.85 3g0b s GLY 549 Ca 0.00 -0.19 -0.34 0.00 0.00 0.00 0.00 44.72 44.19 3g0b s GLY 549 CO 0.00 0.35 1.52 -1.05 0.00 0.00 0.00 173.10 173.92 3g0b n PRO 550 N -3.98 1.92 -1.25 2.90 -0.02 -1.26 -1.50 135.00 131.81 3g0b n PRO 550 Ca 0.06 0.69 -0.09 0.00 -2.02 0.00 0.00 63.50 62.15 3g0b n PRO 550 Cb 0.56 -2.43 -0.04 0.00 -0.02 0.00 0.00 33.50 31.57 3g0b n PRO 550 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g0b s SER 552 N -2.46 5.88 -0.19 0.00 1.04 -0.56 -3.95 113.70 113.46 3g0b s SER 552 Ca 0.00 2.41 -0.03 0.00 0.48 0.00 0.00 55.95 58.81 3g0b s SER 552 Cb 0.00 -2.61 0.06 0.00 0.10 0.00 0.00 66.02 63.57 3g0b s SER 552 CO 0.00 -1.12 0.04 -1.58 0.98 0.00 0.00 173.24 171.56 3g0b s GLN 553 N -2.81 0.58 -0.00 4.02 0.74 -1.26 -1.63 119.66 119.29 3g0b s GLN 553 Ca 0.67 -0.40 0.13 0.00 0.05 0.00 0.00 55.36 55.81 3g0b s GLN 553 Cb -0.31 -2.07 -0.15 0.00 1.10 0.00 0.00 33.01 31.57 3g0b s GLN 553 CO 0.37 -0.66 0.54 1.63 -0.55 0.00 0.00 175.29 176.63 3g0b n LYS 554 N 5.08 2.36 -3.73 1.67 4.76 -1.26 -4.84 118.16 122.20 3g0b n LYS 554 Ca -0.09 -0.01 -0.38 0.00 -2.87 0.00 0.00 58.31 54.96 3g0b n LYS 554 Cb 0.47 -1.15 -0.12 0.00 -1.84 0.00 0.00 35.03 32.39 3g0b n LYS 554 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3g0b s ALA 555 N -2.33 3.11 0.21 7.82 0.00 -1.26 -4.71 121.76 124.59 3g0b s ALA 555 Ca 0.04 -1.54 -0.05 0.00 0.00 0.00 0.00 51.96 50.41 3g0b s ALA 555 Cb 0.10 -2.25 0.02 0.00 0.00 0.00 0.00 23.12 20.99 3g0b s ALA 555 CO 0.55 -1.07 0.37 -0.40 0.00 0.00 0.00 175.76 175.22 3g0b n ASP 556 N 4.88 -1.07 -1.28 0.00 3.85 -1.26 -4.41 116.55 117.26 3g0b n ASP 556 Ca -0.14 -1.99 0.09 0.00 -0.71 0.00 0.00 54.79 52.05 3g0b n ASP 556 Cb 0.47 1.85 0.29 0.00 -1.35 0.00 0.00 41.12 42.38 3g0b n ASP 556 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 3g0b n THR 557 N -0.32 1.17 -2.47 2.12 -2.24 -0.60 -4.94 114.28 107.00 3g0b n THR 557 Ca -0.03 -0.92 -0.42 0.00 -2.27 0.00 0.00 64.05 60.41 3g0b n THR 557 Cb 0.34 0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.81 3g0b n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3g0b s VAL 558 N -1.44 4.25 0.13 2.28 1.01 -1.26 -1.39 120.40 123.99 3g0b s VAL 558 Ca 0.43 1.59 -0.30 0.00 0.00 0.00 0.00 61.98 63.70 3g0b s VAL 558 Cb 0.25 -4.02 -0.07 0.00 0.00 0.00 0.00 36.38 32.53 3g0b s VAL 558 CO 0.26 0.04 1.27 0.12 0.00 0.00 0.00 175.10 176.79 3g0b s PHE 559 N 1.85 3.35 0.01 5.22 5.36 0.05 -4.92 117.98 128.89 3g0b s PHE 559 Ca 0.56 1.22 0.01 0.00 -0.96 0.00 0.00 56.93 57.76 3g0b s PHE 559 Cb -0.25 -3.53 -0.01 0.00 -0.34 0.00 0.00 43.02 38.88 3g0b s PHE 559 CO 0.24 -1.68 -0.03 1.03 -1.46 0.00 0.00 175.22 173.32 3g0b s ARG 560 N 0.51 0.25 -0.31 10.12 0.52 -1.26 -4.89 118.95 123.89 3g0b s ARG 560 Ca 0.58 -0.36 0.03 0.00 -0.52 0.00 0.00 55.73 55.46 3g0b s ARG 560 Cb -0.34 -0.06 0.08 0.00 0.52 0.00 0.00 34.95 35.16 3g0b s ARG 560 CO 0.33 0.00 -0.00 -0.51 0.02 0.00 0.00 175.30 175.14 3g0b s LEU 561 N -0.78 4.28 0.00 2.53 1.43 -1.26 -4.87 118.68 120.00 3g0b s LEU 561 Ca -0.07 -1.84 0.00 0.00 -1.03 0.00 0.00 54.13 51.19 3g0b s LEU 561 Cb -0.05 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.55 3g0b s LEU 561 CO -0.00 -0.31 0.00 -0.46 0.23 0.00 0.00 176.35 175.80 3g0b n ASN 562 N 4.35 0.00 -0.19 2.29 0.23 -1.26 -5.00 115.26 115.68 3g0b n ASN 562 Ca -0.04 -0.28 -0.10 0.00 -0.53 0.00 0.00 54.58 53.63 3g0b n ASN 562 Cb 0.42 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.13 3g0b n ASN 562 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 3g0b h TRP 563 N 0.28 1.14 -0.93 -2.53 7.01 -1.97 -2.49 115.95 116.46 3g0b h TRP 563 Ca 0.00 -0.22 0.09 0.00 2.11 0.00 0.00 58.89 60.87 3g0b h TRP 563 Cb 0.00 -0.29 -0.07 0.00 -2.10 0.00 0.00 29.16 26.71 3g0b h TRP 563 CO 0.00 1.04 0.60 0.00 -2.79 0.00 0.00 178.44 177.30 3g0b h ALA 564 N 0.94 1.56 0.05 2.65 0.00 -1.98 -0.37 119.26 122.12 3g0b h ALA 564 Ca 0.15 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.07 3g0b h ALA 564 Cb 0.64 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3g0b h ALA 564 CO 0.04 0.26 -0.20 1.15 0.00 0.00 0.00 179.25 180.50 3g0b h THR 565 N 0.98 0.53 -0.42 0.00 2.02 -1.79 -0.81 112.91 113.42 3g0b h THR 565 Ca 0.43 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.65 3g0b h THR 565 Cb 0.35 0.53 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 3g0b h THR 565 CO -0.19 0.00 0.18 0.22 0.37 0.00 0.00 175.52 176.10 3g0b h TYR 566 N -0.36 0.33 -0.85 3.16 5.03 -1.29 0.20 116.97 123.19 3g0b h TYR 566 Ca 0.04 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.41 3g0b h TYR 566 Cb 0.40 -0.09 -0.05 0.00 1.55 0.00 0.00 36.73 38.55 3g0b h TYR 566 CO -0.22 0.15 0.55 -0.07 -1.32 0.00 0.00 178.16 177.25 3g0b h LEU 567 N 0.37 0.91 0.14 2.82 3.38 -0.70 0.10 115.31 122.32 3g0b h LEU 567 Ca 0.19 -0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.95 3g0b h LEU 567 Cb 0.14 -0.20 0.02 0.00 0.09 0.00 0.00 40.66 40.71 3g0b h LEU 567 CO -0.16 0.63 -0.87 0.00 0.09 0.00 0.00 178.44 178.12 3g0b h ALA 568 N 1.36 -0.08 0.11 1.53 0.00 -0.93 -1.56 119.26 119.70 3g0b h ALA 568 Ca 0.34 -0.70 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 3g0b h ALA 568 Cb 0.01 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3g0b h ALA 568 CO -0.12 0.42 -0.05 1.03 0.00 0.00 0.00 179.25 180.53 3g0b h SER 569 N -0.26 -0.13 0.00 0.00 0.87 -0.46 -2.99 113.55 110.58 3g0b h SER 569 Ca -0.15 -0.18 -0.28 0.00 -1.23 0.00 0.00 61.79 59.96 3g0b h SER 569 Cb 1.67 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 63.62 3g0b h SER 569 CO 0.17 0.11 -1.56 0.41 -0.53 0.00 0.00 176.83 175.42 3g0b n THR 570 N -5.06 1.53 1.33 2.23 -1.04 0.34 -4.53 114.28 109.08 3g0b n THR 570 Ca -0.08 -0.11 0.13 0.00 -2.04 0.00 0.00 64.05 61.95 3g0b n THR 570 Cb 0.17 -2.03 0.44 0.00 -1.82 0.00 0.00 70.33 67.09 3g0b n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3g0b n GLU 571 N -4.39 1.05 -3.67 -2.82 -0.58 -0.90 -4.93 120.64 104.40 3g0b n GLU 571 Ca -0.36 -0.60 -0.25 0.00 -0.42 0.00 0.00 57.16 55.52 3g0b n GLU 571 Cb 0.71 -1.49 0.07 0.00 -0.57 0.00 0.00 31.44 30.16 3g0b n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3g0b n ASN 572 N -0.45 -5.76 -4.72 1.62 5.03 -0.71 -4.94 115.26 105.33 3g0b n ASN 572 Ca 0.14 -0.61 -0.35 0.00 0.87 0.00 0.00 54.58 54.63 3g0b n ASN 572 Cb 0.34 -4.74 -0.09 0.00 -1.02 0.00 0.00 39.78 34.28 3g0b n ASN 572 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3g0b s ILE 573 N -3.32 4.91 -0.10 2.41 1.01 -0.67 -4.46 121.20 120.98 3g0b s ILE 573 Ca 0.58 -0.00 -0.29 0.00 0.00 0.00 0.00 60.65 60.94 3g0b s ILE 573 Cb -0.26 -3.16 -0.02 0.00 0.01 0.00 0.00 42.46 39.03 3g0b s ILE 573 CO 0.76 0.53 0.96 -0.63 0.00 0.00 0.00 174.94 176.56 3g0b s ILE 574 N -0.28 4.82 -0.24 2.92 1.01 -0.44 -3.45 121.20 125.53 3g0b s ILE 574 Ca 0.09 1.96 -0.05 0.00 0.00 0.00 0.00 60.65 62.65 3g0b s ILE 574 Cb -0.12 -4.28 -0.00 0.00 0.01 0.00 0.00 42.46 38.07 3g0b s ILE 574 CO 0.01 0.04 -0.01 -0.69 0.00 0.00 0.00 174.94 174.29 3g0b s VAL 575 N 1.87 3.55 0.14 2.92 1.01 -0.89 -0.04 120.40 128.97 3g0b s VAL 575 Ca 0.47 -0.53 0.10 0.00 0.00 0.00 0.00 61.98 62.01 3g0b s VAL 575 Cb -0.18 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 3g0b s VAL 575 CO 0.18 0.33 -0.23 0.00 0.00 0.00 0.00 175.10 175.38 3g0b s ALA 576 N 1.49 2.15 0.05 5.51 0.00 0.31 0.04 121.76 131.31 3g0b s ALA 576 Ca 0.05 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.61 3g0b s ALA 576 Cb -0.15 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.65 3g0b s ALA 576 CO -0.01 0.41 -0.10 -1.12 0.00 0.00 0.00 175.76 174.94 3g0b s SER 577 N -2.21 1.14 -0.03 0.00 0.01 -0.57 0.10 113.70 112.15 3g0b s SER 577 Ca 0.13 -0.58 0.02 0.00 1.31 0.00 0.00 55.95 56.83 3g0b s SER 577 Cb -0.09 0.01 0.01 0.00 0.21 0.00 0.00 66.02 66.15 3g0b s SER 577 CO 0.06 -0.17 -0.09 0.12 0.41 0.00 0.00 173.24 173.58 3g0b s PHE 578 N -1.40 0.96 -0.71 2.43 5.36 -1.26 -1.37 117.98 121.99 3g0b s PHE 578 Ca -0.07 -0.26 -0.11 0.00 -0.96 0.00 0.00 56.93 55.53 3g0b s PHE 578 Cb -0.10 -0.70 0.19 0.00 -0.34 0.00 0.00 43.02 42.06 3g0b s PHE 578 CO 0.01 -0.12 0.62 -0.51 -1.46 0.00 0.00 175.22 173.76 3g0b s ASP 579 N 0.31 6.26 0.21 6.13 1.01 0.03 -4.81 116.67 125.81 3g0b s ASP 579 Ca -0.05 -2.53 0.00 0.00 0.71 0.00 0.00 52.55 50.68 3g0b s ASP 579 Cb -0.10 -2.11 0.00 0.00 1.01 0.00 0.00 42.92 41.72 3g0b s ASP 579 CO 0.01 -0.58 0.00 0.61 0.21 0.00 0.00 175.17 175.42 3g0b n GLY 580 N 4.13 1.14 3.64 0.21 0.00 -1.26 -3.93 105.19 109.12 3g0b n GLY 580 Ca 0.07 -1.99 -0.45 0.00 0.00 0.00 0.00 46.02 43.64 3g0b n GLY 580 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g0b n ARG 581 N -0.78 1.69 0.00 1.61 1.74 -1.26 -1.37 116.66 118.29 3g0b n ARG 581 Ca 0.00 0.60 0.00 0.00 -0.77 0.00 0.00 57.85 57.68 3g0b n ARG 581 Cb 0.00 -2.15 0.00 0.00 -1.02 0.00 0.00 32.46 29.29 3g0b n ARG 581 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3g0b n GLY 582 N 1.73 3.23 3.77 -0.13 0.00 0.19 -3.86 105.19 110.12 3g0b n GLY 582 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 3g0b n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g0b s SER 583 N -0.19 5.00 0.56 1.61 1.04 -0.47 -0.01 113.70 121.24 3g0b s SER 583 Ca 0.00 1.93 0.09 0.00 0.48 0.00 0.00 55.95 58.45 3g0b s SER 583 Cb 0.00 -2.54 0.08 0.00 0.10 0.00 0.00 66.02 63.66 3g0b s SER 583 CO 0.00 -1.70 0.76 -0.83 0.98 0.00 0.00 173.24 172.44 3g0b s GLY 584 N -2.86 1.78 -1.23 7.32 0.00 -0.65 -3.38 107.32 108.31 3g0b s GLY 584 Ca 0.65 -2.07 0.00 0.00 0.00 0.00 0.00 44.72 43.30 3g0b s GLY 584 CO 0.46 -1.69 0.00 -1.72 0.00 0.00 0.00 173.10 170.15 3g0b n TYR 585 N -2.19 0.00 -0.78 1.90 4.02 -1.26 -4.83 117.16 114.02 3g0b n TYR 585 Ca 0.14 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 58.06 3g0b n TYR 585 Cb 0.62 -2.23 0.04 0.00 -0.02 0.00 0.00 39.34 37.75 3g0b n TYR 585 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3g0b n GLN 586 N -2.40 1.52 0.00 -0.72 6.02 -1.26 -4.53 117.38 116.00 3g0b n GLN 586 Ca -0.12 -1.56 0.00 0.00 -0.01 0.00 0.00 57.00 55.32 3g0b n GLN 586 Cb 0.41 -0.98 0.00 0.00 1.02 0.00 0.00 30.24 30.69 3g0b n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g0b n GLY 587 N -0.61 0.21 0.31 1.08 0.00 -1.26 -4.60 105.19 100.32 3g0b n GLY 587 Ca 0.05 -1.61 0.17 0.00 0.00 0.00 0.00 46.02 44.62 3g0b n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g0b h ASP 588 N 0.00 0.00 -0.83 1.61 3.32 -0.68 -2.26 116.42 117.58 3g0b h ASP 588 Ca 0.00 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.06 3g0b h ASP 588 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3g0b h ASP 588 CO 0.00 0.00 0.55 0.11 -1.72 0.00 0.00 179.24 178.18 3g0b h LYS 589 N 0.00 1.08 0.00 3.56 1.57 -1.85 0.15 116.57 121.08 3g0b h LYS 589 Ca 0.01 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 3g0b h LYS 589 Cb 0.09 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 3g0b h LYS 589 CO -0.00 0.72 -0.35 0.82 -0.57 0.00 0.00 179.45 180.07 3g0b h ILE 590 N 1.12 0.76 -0.46 1.86 2.04 -1.67 -3.30 117.51 117.86 3g0b h ILE 590 Ca 0.31 -1.67 0.03 0.00 1.00 0.00 0.00 64.86 64.53 3g0b h ILE 590 Cb -0.12 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 3g0b h ILE 590 CO -0.07 0.26 0.25 -0.03 0.00 0.00 0.00 178.15 178.56 3g0b h MET 591 N -1.00 0.49 -0.01 2.37 4.05 -1.43 0.78 114.93 120.18 3g0b h MET 591 Ca -0.07 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 3g0b h MET 591 Cb 0.68 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.37 3g0b h MET 591 CO -0.04 0.32 0.00 0.72 0.23 0.00 0.00 176.91 178.14 3g0b n HIS 592 N -4.86 0.01 0.13 1.39 8.25 0.50 -3.99 115.22 116.65 3g0b n HIS 592 Ca 0.03 -0.01 0.16 0.00 -0.26 0.00 0.00 57.72 57.64 3g0b n HIS 592 Cb 0.09 0.00 0.71 0.00 1.12 0.00 0.00 29.99 31.91 3g0b n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3g0b h ALA 593 N 3.85 2.17 -0.63 -1.41 0.00 -1.42 -1.06 119.26 120.76 3g0b h ALA 593 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3g0b h ALA 593 Cb 0.06 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3g0b h ALA 593 CO 0.00 -0.36 0.00 0.44 0.00 0.00 0.00 179.25 179.33 3g0b n ILE 594 N -4.29 1.51 -1.66 0.00 -6.64 -1.26 -4.95 119.36 102.09 3g0b n ILE 594 Ca 0.04 -1.15 -0.50 0.00 -1.77 0.00 0.00 62.75 59.37 3g0b n ILE 594 Cb 0.38 0.27 -0.05 0.00 -1.44 0.00 0.00 39.64 38.79 3g0b n ILE 594 CO 0.00 0.00 0.00 -3.20 -1.77 0.00 0.00 176.55 171.58 3g0b n ASN 595 N 1.16 2.67 0.00 7.28 4.05 -0.41 0.17 115.26 130.18 3g0b n ASN 595 Ca 0.24 1.06 0.00 0.00 0.45 0.00 0.00 54.58 56.33 3g0b n ASN 595 Cb 0.76 -1.30 0.00 0.00 1.23 0.00 0.00 39.78 40.47 3g0b n ASN 595 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 3g0b n ARG 596 N 4.31 -1.46 -2.72 1.20 1.74 0.50 -4.84 116.66 115.40 3g0b n ARG 596 Ca 0.20 0.37 -0.06 0.00 -0.77 0.00 0.00 57.85 57.59 3g0b n ARG 596 Cb 0.23 -4.46 0.04 0.00 -1.02 0.00 0.00 32.46 27.25 3g0b n ARG 596 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 3g0b n ARG 597 N -0.07 1.33 -1.97 5.56 3.00 0.13 -4.86 116.66 119.77 3g0b n ARG 597 Ca 0.00 -3.22 -0.39 0.00 -0.00 0.00 0.00 57.85 54.23 3g0b n ARG 597 Cb 0.37 -1.27 0.01 0.00 0.00 0.00 0.00 32.46 31.56 3g0b n ARG 597 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 3g0b s LEU 598 N -3.36 4.14 -0.14 6.15 1.02 -1.21 -3.52 118.68 121.77 3g0b s LEU 598 Ca 0.26 2.72 -0.00 0.00 0.02 0.00 0.00 54.13 57.13 3g0b s LEU 598 Cb 0.41 -3.96 0.00 0.00 0.02 0.00 0.00 46.19 42.66 3g0b s LEU 598 CO 0.01 -1.01 0.03 0.61 0.02 0.00 0.00 176.35 176.01 3g0b n GLY 599 N 0.63 0.48 0.00 -3.19 0.00 -1.26 -4.80 105.19 97.05 3g0b n GLY 599 Ca 0.05 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3g0b n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g0b n THR 600 N -3.57 0.00 -0.22 2.61 -2.24 -1.23 -4.83 114.28 104.80 3g0b n THR 600 Ca -0.01 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.70 3g0b n THR 600 Cb 0.51 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.78 3g0b n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 3g0b h PHE 601 N 0.00 0.89 -0.22 4.78 0.04 -1.93 0.19 116.94 120.70 3g0b h PHE 601 Ca 0.00 -0.05 -0.06 0.00 2.80 0.00 0.00 57.97 60.66 3g0b h PHE 601 Cb 0.00 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 37.86 3g0b h PHE 601 CO 0.00 0.69 -0.11 1.05 -0.60 0.00 0.00 178.31 179.34 3g0b h GLU 602 N 0.84 0.35 0.17 1.51 9.09 -1.90 0.42 114.58 125.07 3g0b h GLU 602 Ca 0.21 -0.09 -0.01 0.00 0.05 0.00 0.00 59.36 59.52 3g0b h GLU 602 Cb 0.14 -0.05 0.00 0.00 -1.65 0.00 0.00 28.75 27.19 3g0b h GLU 602 CO -0.02 0.47 -0.08 0.28 0.05 0.00 0.00 179.01 179.71 3g0b h VAL 603 N 0.33 0.81 -0.78 -1.06 2.07 -1.81 -2.97 116.25 112.85 3g0b h VAL 603 Ca 0.07 -1.10 0.12 0.00 0.82 0.00 0.00 66.70 66.61 3g0b h VAL 603 Cb 0.41 1.36 -0.09 0.00 -1.52 0.00 0.00 31.29 31.45 3g0b h VAL 603 CO 0.02 0.21 0.38 -0.33 0.02 0.00 0.00 177.57 177.88 3g0b h GLU 604 N -0.87 0.58 0.00 1.57 5.08 -0.53 -2.15 114.58 118.26 3g0b h GLU 604 Ca -0.02 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 3g0b h GLU 604 Cb 0.52 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 3g0b h GLU 604 CO 0.04 0.38 -0.20 -0.44 -1.00 0.00 0.00 179.01 177.79 3g0b h ASP 605 N 0.59 0.00 -0.39 1.42 3.32 -0.22 -1.07 116.42 120.08 3g0b h ASP 605 Ca 0.41 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.30 3g0b h ASP 605 Cb 0.53 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 3g0b h ASP 605 CO -0.33 0.20 -0.37 1.56 -1.72 0.00 0.00 179.24 178.58 3g0b h GLN 606 N 0.00 0.94 -0.27 3.56 1.08 -1.22 -1.30 115.11 117.91 3g0b h GLN 606 Ca -0.00 -0.49 -0.02 0.00 -1.45 0.00 0.00 58.65 56.69 3g0b h GLN 606 Cb 0.41 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.84 3g0b h GLN 606 CO 0.03 1.15 0.09 0.82 -0.95 0.00 0.00 178.83 179.96 3g0b h ILE 607 N 0.77 1.19 -0.10 2.54 2.04 -1.19 -2.75 117.51 120.01 3g0b h ILE 607 Ca 0.06 -0.60 -0.05 0.00 1.00 0.00 0.00 64.86 65.27 3g0b h ILE 607 Cb 0.97 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 3g0b h ILE 607 CO 0.09 0.20 -0.18 -0.08 0.00 0.00 0.00 178.15 178.18 3g0b h GLU 608 N 0.28 0.17 -0.04 2.37 4.57 -1.20 -2.51 114.58 118.22 3g0b h GLU 608 Ca 0.09 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 3g0b h GLU 608 Cb 0.22 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.79 3g0b h GLU 608 CO -0.00 0.35 0.03 0.00 -1.18 0.00 0.00 179.01 178.20 3g0b h ALA 609 N 1.66 0.05 -0.61 2.92 0.00 -1.10 -1.89 119.26 120.29 3g0b h ALA 609 Ca 0.03 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3g0b h ALA 609 Cb 0.42 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3g0b h ALA 609 CO 0.03 -0.45 0.41 0.00 0.00 0.00 0.00 179.25 179.23 3g0b h ALA 610 N 1.01 1.59 -0.64 0.00 0.00 -1.21 -1.01 119.26 119.00 3g0b h ALA 610 Ca 0.01 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3g0b h ALA 610 Cb -0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3g0b h ALA 610 CO -0.00 0.36 0.22 0.00 0.00 0.00 0.00 179.25 179.83 3g0b h ARG 611 N 0.80 0.96 -0.25 0.00 3.08 -1.18 -1.85 114.38 115.94 3g0b h ARG 611 Ca 0.23 -0.18 -0.16 0.00 0.07 0.00 0.00 59.98 59.94 3g0b h ARG 611 Cb -0.04 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.85 3g0b h ARG 611 CO -0.05 0.81 -0.51 1.96 -1.07 0.00 0.00 179.97 181.11 3g0b h GLN 612 N 0.94 0.71 -0.53 0.04 1.08 -0.50 -1.10 115.11 115.75 3g0b h GLN 612 Ca 0.21 -0.43 -0.07 0.00 -1.45 0.00 0.00 58.65 56.91 3g0b h GLN 612 Cb 0.24 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 3g0b h GLN 612 CO -0.01 1.05 0.04 0.74 -0.95 0.00 0.00 178.83 179.70 3g0b h PHE 613 N 0.56 0.98 -0.85 2.96 0.04 -1.07 -1.82 116.94 117.73 3g0b h PHE 613 Ca 0.02 -0.15 0.01 0.00 2.80 0.00 0.00 57.97 60.65 3g0b h PHE 613 Cb 1.07 -0.26 -0.04 0.00 2.20 0.00 0.00 35.95 38.92 3g0b h PHE 613 CO 0.05 0.89 0.56 0.77 -0.60 0.00 0.00 178.31 179.99 3g0b h SER 614 N 0.79 0.97 0.02 2.17 0.02 -1.26 -2.13 113.55 114.13 3g0b h SER 614 Ca 0.16 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3g0b h SER 614 Cb 0.47 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 3g0b h SER 614 CO 0.02 0.70 -0.01 0.50 -1.14 0.00 0.00 176.83 176.90 3g0b h LYS 615 N 1.15 0.00 0.00 3.45 3.64 -0.81 -2.19 116.57 121.81 3g0b h LYS 615 Ca 0.31 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 3g0b h LYS 615 Cb -0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 3g0b h LYS 615 CO -0.07 0.01 0.00 0.52 -2.27 0.00 0.00 179.45 177.64 3g0b h MET 616 N 0.00 0.00 0.00 1.90 2.86 -0.63 -3.47 114.93 115.59 3g0b h MET 616 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g0b h MET 616 Cb 0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.69 3g0b h MET 616 CO 0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 3g0b n GLY 617 N -0.07 1.89 1.43 8.32 0.00 -0.82 -4.88 105.19 111.05 3g0b n GLY 617 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 3g0b n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3g0b n PHE 618 N -2.00 1.39 -4.67 1.61 -1.74 -1.26 -4.75 117.46 106.04 3g0b n PHE 618 Ca 0.00 -0.67 -0.33 0.00 -0.56 0.00 0.00 57.45 55.89 3g0b n PHE 618 Cb 0.00 -0.28 -0.13 0.00 1.52 0.00 0.00 39.48 40.59 3g0b n PHE 618 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 3g0b s VAL 619 N -2.08 3.33 -0.55 1.97 1.01 -1.26 -0.35 120.40 122.48 3g0b s VAL 619 Ca 0.47 -0.57 -0.28 0.00 0.00 0.00 0.00 61.98 61.61 3g0b s VAL 619 Cb 0.33 -2.41 0.01 0.00 0.00 0.00 0.00 36.38 34.31 3g0b s VAL 619 CO 0.20 0.53 1.40 -0.62 0.00 0.00 0.00 175.10 176.60 3g0b s ASP 620 N 0.17 6.17 0.61 3.32 3.68 0.10 -4.71 116.67 126.01 3g0b s ASP 620 Ca -0.05 0.32 0.38 0.00 2.13 0.00 0.00 52.55 55.33 3g0b s ASP 620 Cb -0.15 -2.55 2.04 0.00 -1.45 0.00 0.00 42.92 40.82 3g0b s ASP 620 CO 0.04 -1.66 2.15 0.78 0.13 0.00 0.00 175.17 176.61 3g0b h ASN 621 N 10.91 0.00 0.45 -0.34 2.35 -1.95 -1.39 115.58 125.61 3g0b h ASN 621 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 3g0b h ASN 621 Cb 1.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.46 3g0b h ASN 621 CO 1.17 0.00 -0.42 0.29 -1.65 0.00 0.00 177.43 176.82 3g0b n LYS 622 N -2.89 0.22 -3.32 0.81 5.02 -1.26 -4.44 118.16 112.30 3g0b n LYS 622 Ca -0.03 -0.12 -0.25 0.00 -2.02 0.00 0.00 58.31 55.89 3g0b n LYS 622 Cb 0.14 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.57 3g0b n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3g0b n ARG 623 N -1.28 0.93 -4.23 1.97 1.74 -0.52 -4.82 116.66 110.44 3g0b n ARG 623 Ca 0.07 -3.51 -0.32 0.00 -0.77 0.00 0.00 57.85 53.33 3g0b n ARG 623 Cb 0.34 -1.54 -0.16 0.00 -1.02 0.00 0.00 32.46 30.07 3g0b n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3g0b s ILE 624 N -1.10 1.88 0.39 0.55 1.01 -1.25 -1.53 121.20 121.14 3g0b s ILE 624 Ca 0.35 -0.84 0.08 0.00 0.00 0.00 0.00 60.65 60.24 3g0b s ILE 624 Cb 0.12 -1.70 -0.07 0.00 0.01 0.00 0.00 42.46 40.82 3g0b s ILE 624 CO -0.12 0.51 0.03 0.00 0.00 0.00 0.00 174.94 175.36 3g0b s ALA 625 N 1.22 3.23 -0.05 9.38 0.00 0.11 -1.15 121.76 134.50 3g0b s ALA 625 Ca 0.02 -2.18 -0.04 0.00 0.00 0.00 0.00 51.96 49.75 3g0b s ALA 625 Cb -0.14 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 22.94 3g0b s ALA 625 CO -0.09 -0.07 0.14 -1.50 0.00 0.00 0.00 175.76 174.23 3g0b s ILE 626 N -2.64 -0.01 0.08 0.00 2.07 -1.05 0.03 121.20 119.68 3g0b s ILE 626 Ca 0.36 0.03 -0.10 0.00 -1.41 0.00 0.00 60.65 59.53 3g0b s ILE 626 Cb 0.06 -0.20 0.00 0.00 0.13 0.00 0.00 42.46 42.45 3g0b s ILE 626 CO 0.19 0.01 0.22 -1.66 -1.91 0.00 0.00 174.94 171.79 3g0b s TRP 627 N 0.26 0.09 -0.19 3.50 1.48 0.28 -1.23 118.94 123.12 3g0b s TRP 627 Ca -0.02 -0.46 -0.35 0.00 -1.06 0.00 0.00 56.10 54.21 3g0b s TRP 627 Cb -0.03 -0.02 0.14 0.00 -1.16 0.00 0.00 33.47 32.41 3g0b s TRP 627 CO -0.01 -0.54 1.21 0.20 -4.06 0.00 0.00 176.95 173.75 3g0b s GLY 628 N -2.69 -0.28 0.09 3.67 0.00 -0.95 -1.00 107.32 106.16 3g0b s GLY 628 Ca 0.03 1.66 0.09 0.00 0.00 0.00 0.00 44.72 46.50 3g0b s GLY 628 CO -0.10 0.57 -0.22 0.86 0.00 0.00 0.00 173.10 174.21 3g0b s TRP 629 N -2.33 2.43 0.00 1.90 -0.11 -1.26 -1.01 118.94 118.57 3g0b s TRP 629 Ca 0.09 -0.32 0.00 0.00 1.22 0.00 0.00 56.10 57.09 3g0b s TRP 629 Cb -0.01 -1.35 0.00 0.00 -1.50 0.00 0.00 33.47 30.61 3g0b s TRP 629 CO -0.05 0.30 0.00 0.43 -4.62 0.00 0.00 176.95 173.01 3g0b n SER 630 N 1.15 0.00 -0.12 5.86 7.64 -0.25 0.36 113.62 128.26 3g0b n SER 630 Ca -0.17 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.72 3g0b n SER 630 Cb 0.53 0.00 0.30 0.00 -1.01 0.00 0.00 64.21 64.03 3g0b n SER 630 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 3g0b h TYR 631 N 0.00 0.76 -0.79 1.43 3.20 -1.85 -0.90 116.97 118.82 3g0b h TYR 631 Ca 0.00 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.94 3g0b h TYR 631 Cb 0.00 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 37.97 3g0b h TYR 631 CO 0.00 0.52 0.51 0.78 -1.64 0.00 0.00 178.16 178.33 3g0b h GLY 632 N 0.85 1.08 0.88 1.82 0.00 -0.01 -0.72 103.07 106.96 3g0b h GLY 632 Ca 0.21 -0.34 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 3g0b h GLY 632 CO -0.04 0.24 0.04 -1.33 0.00 0.00 0.00 176.54 175.46 3g0b h GLY 633 N 0.84 0.50 0.69 4.60 0.00 -0.97 -0.07 103.07 108.65 3g0b h GLY 633 Ca 0.34 -0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.36 3g0b h GLY 633 CO -0.12 0.31 -0.11 -1.82 0.00 0.00 0.00 176.54 174.80 3g0b h TYR 634 N 0.28 -0.27 -0.60 5.60 5.03 -0.73 -1.15 116.97 125.12 3g0b h TYR 634 Ca 0.08 0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.34 3g0b h TYR 634 Cb 0.34 0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.72 3g0b h TYR 634 CO 0.02 -0.16 0.13 0.28 -1.32 0.00 0.00 178.16 177.11 3g0b h VAL 635 N -0.17 1.25 -0.48 1.81 2.07 -1.09 -0.44 116.25 119.20 3g0b h VAL 635 Ca 0.05 -0.93 0.07 0.00 0.82 0.00 0.00 66.70 66.71 3g0b h VAL 635 Cb 0.24 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.66 3g0b h VAL 635 CO -0.13 0.35 0.17 0.74 0.02 0.00 0.00 177.57 178.71 3g0b h THR 636 N 0.88 0.83 -0.44 2.57 2.02 -0.84 0.11 112.91 118.04 3g0b h THR 636 Ca 0.19 -0.12 -0.13 0.00 0.77 0.00 0.00 66.41 67.12 3g0b h THR 636 Cb 0.37 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 3g0b h THR 636 CO 0.00 0.06 -0.22 0.28 0.37 0.00 0.00 175.52 176.01 3g0b h SER 637 N 0.34 0.96 -0.55 4.18 0.02 -0.90 -0.26 113.55 117.33 3g0b h SER 637 Ca 0.23 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.77 3g0b h SER 637 Cb 0.24 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 3g0b h SER 637 CO -0.24 1.15 0.31 0.24 -1.14 0.00 0.00 176.83 177.16 3g0b h MET 638 N 0.76 0.77 -0.19 3.45 2.07 -0.73 0.30 114.93 121.36 3g0b h MET 638 Ca 0.10 -0.08 -0.00 0.00 -2.07 0.00 0.00 59.70 57.64 3g0b h MET 638 Cb 0.80 -0.15 -0.01 0.00 -1.87 0.00 0.00 31.60 30.36 3g0b h MET 638 CO 0.07 0.58 0.11 0.28 1.07 0.00 0.00 176.91 179.02 3g0b h VAL 639 N 0.75 1.08 0.00 -2.22 2.07 -0.65 -1.37 116.25 115.90 3g0b h VAL 639 Ca 0.20 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3g0b h VAL 639 Cb 0.03 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3g0b h VAL 639 CO -0.03 0.07 0.00 -0.07 0.02 0.00 0.00 177.57 177.56 3g0b h LEU 640 N 0.22 0.00 -2.62 2.57 3.38 -0.76 -2.36 115.31 115.75 3g0b h LEU 640 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3g0b h LEU 640 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3g0b h LEU 640 CO -0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.13 3g0b n GLY 641 N -0.49 2.23 0.15 0.83 0.00 0.07 -4.24 105.19 103.74 3g0b n GLY 641 Ca -0.01 -0.61 0.04 0.00 0.00 0.00 0.00 46.02 45.45 3g0b n GLY 641 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3g0b h SER 642 N 3.40 0.00 -0.04 1.61 4.64 -0.70 -3.43 113.55 119.03 3g0b h SER 642 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 3g0b h SER 642 Cb 0.86 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.95 3g0b h SER 642 CO 0.00 0.42 -0.02 0.61 -0.87 0.00 0.00 176.83 176.97 3g0b n GLY 643 N 1.22 0.47 0.27 -0.77 0.00 -1.26 -4.94 105.19 100.18 3g0b n GLY 643 Ca 0.02 -0.76 0.01 0.00 0.00 0.00 0.00 46.02 45.28 3g0b n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3g0b h SER 644 N 0.00 0.43 0.00 1.61 4.64 -1.93 -3.47 113.55 114.84 3g0b h SER 644 Ca -0.02 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 3g0b h SER 644 Cb 0.08 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3g0b h SER 644 CO 0.03 0.50 0.00 0.61 -0.87 0.00 0.00 176.83 177.10 3g0b n GLY 645 N -0.94 0.60 0.13 -0.77 0.00 -1.26 -4.93 105.19 98.02 3g0b n GLY 645 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 3g0b n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3g0b h VAL 646 N 0.00 1.16 -2.96 1.61 2.07 -1.95 -3.46 116.25 112.73 3g0b h VAL 646 Ca 0.00 -2.73 -0.64 0.00 0.82 0.00 0.00 66.70 64.15 3g0b h VAL 646 Cb 0.00 2.85 -0.10 0.00 -1.52 0.00 0.00 31.29 32.52 3g0b h VAL 646 CO 0.00 0.84 -0.50 -0.36 0.02 0.00 0.00 177.57 177.57 3g0b s PHE 647 N -2.61 3.48 -0.05 1.57 0.40 -1.26 -4.54 117.98 114.97 3g0b s PHE 647 Ca -0.10 0.41 -0.16 0.00 -0.60 0.00 0.00 56.93 56.48 3g0b s PHE 647 Cb 0.06 -2.03 -0.31 0.00 0.51 0.00 0.00 43.02 41.26 3g0b s PHE 647 CO 0.88 0.51 0.73 -0.22 0.70 0.00 0.00 175.22 177.82 3g0b h LYS 648 N 5.76 0.35 -3.65 0.44 3.64 -1.45 -3.45 116.57 118.20 3g0b h LYS 648 Ca -0.48 -0.60 -0.06 0.00 -1.27 0.00 0.00 60.65 58.23 3g0b h LYS 648 Cb 1.19 0.22 -0.09 0.00 -0.41 0.00 0.00 32.23 33.15 3g0b h LYS 648 CO 0.66 1.29 -0.11 0.00 -2.27 0.00 0.00 179.45 179.01 3g0b s GLY 650 N -3.03 -0.34 -0.09 0.00 0.00 0.12 -2.54 107.32 101.44 3g0b s GLY 650 Ca 0.23 0.64 -0.00 0.00 0.00 0.00 0.00 44.72 45.58 3g0b s GLY 650 CO 0.09 0.16 -0.06 -0.42 0.00 0.00 0.00 173.10 172.87 3g0b s ILE 651 N -2.83 0.84 -0.17 0.90 1.01 -0.37 -0.77 121.20 119.81 3g0b s ILE 651 Ca 0.12 -0.19 -0.04 0.00 0.00 0.00 0.00 60.65 60.53 3g0b s ILE 651 Cb 0.01 -0.88 -0.03 0.00 0.01 0.00 0.00 42.46 41.57 3g0b s ILE 651 CO -0.02 0.33 -0.02 0.00 0.00 0.00 0.00 174.94 175.23 3g0b s ALA 652 N 1.61 3.03 -0.15 9.38 0.00 -0.24 -2.25 121.76 133.15 3g0b s ALA 652 Ca 0.02 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.11 3g0b s ALA 652 Cb -0.13 -1.66 -0.00 0.00 0.00 0.00 0.00 23.12 21.33 3g0b s ALA 652 CO -0.06 0.07 -0.17 0.08 0.00 0.00 0.00 175.76 175.69 3g0b s VAL 653 N 0.61 2.55 -1.26 0.00 1.01 -0.18 -1.27 120.40 121.86 3g0b s VAL 653 Ca -0.02 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 60.96 3g0b s VAL 653 Cb -0.14 -2.06 0.03 0.00 0.00 0.00 0.00 36.38 34.20 3g0b s VAL 653 CO 0.02 0.52 0.37 0.00 0.00 0.00 0.00 175.10 176.01 3g0b n ALA 654 N 4.00 -2.26 -1.83 5.51 0.00 0.76 -1.09 120.51 125.60 3g0b n ALA 654 Ca -0.19 -0.49 -0.33 0.00 0.00 0.00 0.00 53.44 52.43 3g0b n ALA 654 Cb 0.52 -1.68 -0.06 0.00 0.00 0.00 0.00 19.45 18.23 3g0b n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3g0b s PRO 655 N -7.23 4.13 0.38 0.00 0.04 -1.26 -3.24 135.00 127.83 3g0b s PRO 655 Ca 0.27 1.06 -0.25 0.00 0.04 0.00 0.00 61.00 62.12 3g0b s PRO 655 Cb -0.15 -2.16 -0.09 0.00 0.04 0.00 0.00 34.50 32.14 3g0b s PRO 655 CO 0.92 -0.11 1.13 0.08 0.04 0.00 0.00 177.00 179.05 3g0b s VAL 656 N -2.33 3.34 -0.05 -0.36 1.01 -1.24 -4.53 120.40 116.24 3g0b s VAL 656 Ca 0.61 1.13 0.01 0.00 0.00 0.00 0.00 61.98 63.73 3g0b s VAL 656 Cb -0.09 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 3g0b s VAL 656 CO 0.19 0.10 -0.03 -1.54 0.00 0.00 0.00 175.10 173.83 3g0b n SER 657 N 0.18 3.70 -3.84 3.32 3.41 -1.26 -4.19 113.62 114.93 3g0b n SER 657 Ca 0.04 -0.02 -0.12 0.00 -0.26 0.00 0.00 58.87 58.51 3g0b n SER 657 Cb 0.47 0.13 -0.10 0.00 -0.26 0.00 0.00 64.21 64.46 3g0b n SER 657 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g0b s ARG 658 N -2.11 0.51 0.45 4.33 1.70 -1.26 -0.26 118.95 122.31 3g0b s ARG 658 Ca -0.06 -0.32 0.25 0.00 -0.47 0.00 0.00 55.73 55.13 3g0b s ARG 658 Cb 0.02 0.22 0.88 0.00 -0.57 0.00 0.00 34.95 35.49 3g0b s ARG 658 CO 0.14 -0.13 1.80 -1.49 -1.08 0.00 0.00 175.30 174.55 3g0b h TRP 659 N 4.27 0.00 0.00 5.89 4.06 -1.87 -2.60 115.95 125.69 3g0b h TRP 659 Ca -0.30 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.65 3g0b h TRP 659 Cb 1.19 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.35 3g0b h TRP 659 CO 0.57 0.20 0.00 0.93 -3.56 0.00 0.00 178.44 176.57 3g0b h GLU 660 N 0.00 0.00 0.00 0.49 3.07 -1.90 -2.10 114.58 114.14 3g0b h GLU 660 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3g0b h GLU 660 Cb 0.78 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 3g0b h GLU 660 CO 0.03 0.00 -0.65 0.66 -1.40 0.00 0.00 179.01 177.65 3g0b n TYR 661 N -2.79 0.44 -3.06 4.33 4.01 -0.98 -3.57 117.16 115.54 3g0b n TYR 661 Ca -0.02 0.13 -0.19 0.00 -0.16 0.00 0.00 57.90 57.66 3g0b n TYR 661 Cb 0.08 -0.58 0.01 0.00 -0.31 0.00 0.00 39.34 38.55 3g0b n TYR 661 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 3g0b s TYR 662 N -3.15 2.93 0.57 -0.72 5.04 -0.79 -4.78 117.35 116.45 3g0b s TYR 662 Ca 0.07 -0.23 -0.18 0.00 -2.44 0.00 0.00 57.07 54.28 3g0b s TYR 662 Cb 0.14 -2.34 -0.04 0.00 0.35 0.00 0.00 41.96 40.06 3g0b s TYR 662 CO 0.72 -0.39 1.14 0.16 -1.34 0.00 0.00 175.55 175.84 3g0b s ASP 663 N -4.31 5.53 0.13 4.32 1.47 -1.26 -0.42 116.67 122.12 3g0b s ASP 663 Ca 0.52 2.17 -0.19 0.00 1.18 0.00 0.00 52.55 56.24 3g0b s ASP 663 Cb -0.10 -2.58 -0.05 0.00 -0.34 0.00 0.00 42.92 39.85 3g0b s ASP 663 CO 0.34 -1.35 1.78 0.77 0.68 0.00 0.00 175.17 177.39 3g0b h SER 664 N 0.93 0.26 0.25 2.11 4.64 -0.28 -2.03 113.55 119.44 3g0b h SER 664 Ca -0.49 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.81 3g0b h SER 664 Cb 1.26 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3g0b h SER 664 CO 0.56 0.19 -0.12 0.58 -0.87 0.00 0.00 176.83 177.17 3g0b h VAL 665 N 0.31 0.77 0.07 0.95 2.07 -1.93 -0.81 116.25 117.69 3g0b h VAL 665 Ca 0.09 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 3g0b h VAL 665 Cb -0.03 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 3g0b h VAL 665 CO -0.02 0.03 -0.03 0.22 0.02 0.00 0.00 177.57 177.78 3g0b h TYR 666 N -0.39 -0.09 -0.15 1.57 3.20 -1.91 -3.21 116.97 116.00 3g0b h TYR 666 Ca -0.03 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.82 3g0b h TYR 666 Cb 0.30 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 3g0b h TYR 666 CO -0.04 0.19 0.02 1.15 -1.64 0.00 0.00 178.16 177.84 3g0b h THR 667 N -0.36 1.22 0.00 1.81 2.02 -1.29 -3.12 112.91 113.19 3g0b h THR 667 Ca -0.01 -0.72 -0.02 0.00 0.77 0.00 0.00 66.41 66.43 3g0b h THR 667 Cb 0.32 1.42 -0.00 0.00 -1.74 0.00 0.00 68.15 68.14 3g0b h THR 667 CO 0.02 0.21 -0.09 -0.33 0.37 0.00 0.00 175.52 175.70 3g0b h GLU 668 N 0.02 0.00 -0.97 6.66 5.08 -1.28 0.45 114.58 124.54 3g0b h GLU 668 Ca 0.04 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.54 3g0b h GLU 668 Cb 0.31 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.48 3g0b h GLU 668 CO 0.00 0.09 0.61 -0.09 -1.00 0.00 0.00 179.01 178.63 3g0b h ARG 669 N 0.00 0.84 0.00 2.33 2.43 -1.54 -0.85 114.38 117.60 3g0b h ARG 669 Ca -0.00 -0.05 -0.26 0.00 -0.81 0.00 0.00 59.98 58.86 3g0b h ARG 669 Cb 0.83 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 30.14 3g0b h ARG 669 CO 0.01 0.56 -1.99 0.66 -1.51 0.00 0.00 179.97 177.70 3g0b n TYR 670 N -4.61 0.00 0.62 2.20 4.01 -0.96 -4.54 117.16 113.88 3g0b n TYR 670 Ca 0.19 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 58.01 3g0b n TYR 670 Cb 0.42 -0.71 -0.10 0.00 -0.31 0.00 0.00 39.34 38.64 3g0b n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3g0b n MET 671 N -2.52 1.36 0.00 -0.72 2.81 0.11 0.19 117.12 118.35 3g0b n MET 671 Ca -0.23 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.63 3g0b n MET 671 Cb 0.95 -1.30 0.00 0.00 -0.71 0.00 0.00 33.22 32.16 3g0b n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g0b n GLY 672 N 1.42 0.55 3.73 3.03 0.00 -0.33 -4.66 105.19 108.93 3g0b n GLY 672 Ca 0.02 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 44.91 3g0b n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g0b s LEU 673 N 0.00 3.65 -1.33 0.99 1.43 -1.26 -4.25 118.68 117.91 3g0b s LEU 673 Ca 0.00 -0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 53.00 3g0b s LEU 673 Cb 0.00 -2.24 0.01 0.00 0.03 0.00 0.00 46.19 43.99 3g0b s LEU 673 CO 0.00 0.22 2.72 -0.81 0.23 0.00 0.00 176.35 178.71 3g0b n PRO 674 N 0.89 3.97 -4.51 1.29 -0.04 -1.26 -0.82 135.00 134.51 3g0b n PRO 674 Ca -0.12 -2.74 -0.30 0.00 -0.04 0.00 0.00 63.50 60.30 3g0b n PRO 674 Cb 0.52 -2.64 -0.13 0.00 -0.04 0.00 0.00 33.50 31.22 3g0b n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3g0b s THR 675 N 0.27 2.49 0.54 0.52 -4.23 -1.26 -4.61 115.64 109.36 3g0b s THR 675 Ca 0.62 -1.52 0.32 0.00 -1.18 0.00 0.00 61.69 59.93 3g0b s THR 675 Cb 0.20 -2.08 0.49 0.00 1.34 0.00 0.00 72.50 72.45 3g0b s THR 675 CO -0.08 0.19 1.88 -0.65 -0.54 0.00 0.00 174.62 175.41 3g0b h PRO 676 N 4.13 0.00 -0.23 3.99 0.11 -1.96 0.13 132.00 138.16 3g0b h PRO 676 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3g0b h PRO 676 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3g0b h PRO 676 CO 0.43 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.37 3g0b n GLU 677 N -4.23 1.98 0.00 1.05 0.00 -1.26 -4.78 120.64 113.40 3g0b n GLU 677 Ca 0.19 -1.48 0.00 0.00 0.00 0.00 0.00 57.16 55.87 3g0b n GLU 677 Cb 0.99 -1.43 0.00 0.00 0.00 0.00 0.00 31.44 31.00 3g0b n GLU 677 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 3g0b n ASP 678 N 0.70 0.00 -1.39 -1.84 4.64 0.42 -5.06 116.55 114.03 3g0b n ASP 678 Ca 0.17 0.00 0.03 0.00 -1.38 0.00 0.00 54.79 53.61 3g0b n ASP 678 Cb 0.42 0.00 0.02 0.00 -1.04 0.00 0.00 41.12 40.51 3g0b n ASP 678 CO 0.00 0.00 0.00 -3.20 -0.82 0.00 0.00 177.20 173.18 3g0b n ASN 679 N -0.07 0.86 -0.36 1.67 5.15 -0.00 -4.90 115.26 117.60 3g0b n ASN 679 Ca 0.00 -2.00 -0.02 0.00 -0.60 0.00 0.00 54.58 51.96 3g0b n ASN 679 Cb 0.00 -0.28 0.10 0.00 -0.53 0.00 0.00 39.78 39.08 3g0b n ASN 679 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3g0b h LEU 680 N 0.88 1.11 -0.39 1.20 5.85 -1.52 -2.67 115.31 119.76 3g0b h LEU 680 Ca -0.22 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.56 3g0b h LEU 680 Cb 1.84 -0.27 -0.08 0.00 0.37 0.00 0.00 40.66 42.51 3g0b h LEU 680 CO 0.08 0.80 -0.18 0.44 -0.34 0.00 0.00 178.44 179.24 3g0b h ASP 681 N 1.30 -0.62 0.65 1.25 3.32 -1.90 -0.41 116.42 120.01 3g0b h ASP 681 Ca 0.36 0.15 -0.16 0.00 0.02 0.00 0.00 57.03 57.39 3g0b h ASP 681 Cb -0.14 0.34 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 3g0b h ASP 681 CO -0.08 -0.21 -0.76 -0.74 -1.72 0.00 0.00 179.24 175.73 3g0b h HIS 682 N -0.11 0.12 -0.44 4.55 2.76 -1.90 -1.61 115.15 118.52 3g0b h HIS 682 Ca 0.19 -0.06 0.07 0.00 -2.20 0.00 0.00 60.37 58.37 3g0b h HIS 682 Cb 0.40 -0.02 -0.06 0.00 1.55 0.00 0.00 27.41 29.29 3g0b h HIS 682 CO -0.42 0.81 0.12 1.88 -1.30 0.00 0.00 177.93 179.01 3g0b h TYR 683 N 0.05 0.20 -0.06 5.26 0.05 -1.06 0.07 116.97 121.48 3g0b h TYR 683 Ca -0.02 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.69 3g0b h TYR 683 Cb 1.33 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 39.04 3g0b h TYR 683 CO 0.01 0.04 -0.39 0.00 -1.05 0.00 0.00 178.16 176.77 3g0b h ARG 684 N 0.26 0.12 0.00 4.88 2.47 -0.89 -3.16 114.38 118.07 3g0b h ARG 684 Ca 0.21 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.88 3g0b h ARG 684 Cb 0.25 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.57 3g0b h ARG 684 CO -0.26 0.50 -0.17 -0.91 0.56 0.00 0.00 179.97 179.69 3g0b h ASN 685 N 0.10 0.00 -0.56 7.04 4.21 -0.71 -3.36 115.58 122.30 3g0b h ASN 685 Ca 0.01 -0.01 -0.09 0.00 1.21 0.00 0.00 56.30 57.41 3g0b h ASN 685 Cb 0.75 0.00 -0.06 0.00 -1.12 0.00 0.00 38.32 37.89 3g0b h ASN 685 CO 0.06 0.01 0.10 -1.54 -1.29 0.00 0.00 177.43 174.77 3g0b n SER 686 N -2.78 4.84 -4.87 5.81 3.41 -0.04 -5.00 113.62 115.00 3g0b n SER 686 Ca 0.04 -3.11 -0.31 0.00 -0.26 0.00 0.00 58.87 55.22 3g0b n SER 686 Cb 0.50 -0.68 -0.04 0.00 -0.26 0.00 0.00 64.21 63.73 3g0b n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3g0b s THR 687 N -2.90 4.80 0.18 6.66 -4.23 -1.26 -4.81 115.64 114.08 3g0b s THR 687 Ca 0.52 0.64 0.02 0.00 -1.18 0.00 0.00 61.69 61.69 3g0b s THR 687 Cb 0.41 -3.68 -0.12 0.00 1.34 0.00 0.00 72.50 70.45 3g0b s THR 687 CO 0.13 -0.33 1.42 1.62 -0.54 0.00 0.00 174.62 176.91 3g0b h VAL 688 N 1.52 1.45 -0.79 2.29 3.04 -0.97 -3.28 116.25 119.52 3g0b h VAL 688 Ca -0.47 -2.41 0.16 0.00 -1.01 0.00 0.00 66.70 62.96 3g0b h VAL 688 Cb 1.18 2.32 -0.10 0.00 -2.01 0.00 0.00 31.29 32.68 3g0b h VAL 688 CO 0.65 0.71 0.32 0.24 -1.01 0.00 0.00 177.57 178.48 3g0b h MET 689 N 0.15 0.43 -0.07 4.17 2.07 -1.91 -0.47 114.93 119.30 3g0b h MET 689 Ca -0.04 -0.03 0.02 0.00 -2.07 0.00 0.00 59.70 57.59 3g0b h MET 689 Cb 1.40 -0.10 -0.00 0.00 -1.87 0.00 0.00 31.60 31.03 3g0b h MET 689 CO 0.13 0.28 0.15 0.66 1.07 0.00 0.00 176.91 179.19 3g0b h SER 690 N 0.44 0.00 -0.06 1.22 4.64 -1.92 -1.72 113.55 116.14 3g0b h SER 690 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 3g0b h SER 690 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 3g0b h SER 690 CO -0.43 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.07 3g0b n ARG 691 N -3.39 2.32 -0.36 4.77 1.74 -0.19 -4.71 116.66 116.84 3g0b n ARG 691 Ca -0.01 -1.92 0.06 0.00 -0.77 0.00 0.00 57.85 55.21 3g0b n ARG 691 Cb 0.23 -1.47 0.14 0.00 -1.02 0.00 0.00 32.46 30.34 3g0b n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g0b h ALA 692 N 4.68 0.65 -0.77 7.54 0.00 -1.22 0.32 119.26 130.46 3g0b h ALA 692 Ca 0.00 0.39 0.15 0.00 0.00 0.00 0.00 54.91 55.45 3g0b h ALA 692 Cb 0.98 0.75 -0.05 0.00 0.00 0.00 0.00 17.79 19.47 3g0b h ALA 692 CO 0.00 -0.38 0.51 1.49 0.00 0.00 0.00 179.25 180.87 3g0b h GLU 693 N -0.00 0.42 0.00 0.00 4.57 -1.84 -1.63 114.58 116.09 3g0b h GLU 693 Ca 0.47 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.63 3g0b h GLU 693 Cb 0.72 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 3g0b h GLU 693 CO -1.02 0.28 0.00 0.09 -1.18 0.00 0.00 179.01 177.18 3g0b n ASN 694 N -4.48 0.45 0.00 1.04 3.02 0.10 -2.60 115.26 112.79 3g0b n ASN 694 Ca 0.15 0.60 0.11 0.00 -0.03 0.00 0.00 54.58 55.40 3g0b n ASN 694 Cb 0.54 -0.70 0.48 0.00 -0.61 0.00 0.00 39.78 39.49 3g0b n ASN 694 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3g0b n PHE 695 N -1.98 0.00 0.31 3.10 3.01 -0.61 -2.81 117.46 118.48 3g0b n PHE 695 Ca 0.03 0.00 0.20 0.00 1.01 0.00 0.00 57.45 58.69 3g0b n PHE 695 Cb 0.25 -0.47 1.06 0.00 -0.01 0.00 0.00 39.48 40.31 3g0b n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 3g0b h LYS 696 N 0.00 0.00 -0.00 -1.08 1.57 -1.69 -2.67 116.57 112.70 3g0b h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g0b h LYS 696 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 3g0b h LYS 696 CO 0.00 0.00 -0.41 1.04 -0.57 0.00 0.00 179.45 179.51 3g0b n GLN 697 N -3.34 0.48 -4.36 3.15 6.02 -1.12 -4.97 117.38 113.23 3g0b n GLN 697 Ca -0.02 -0.30 -0.19 0.00 -0.01 0.00 0.00 57.00 56.49 3g0b n GLN 697 Cb 0.13 -1.49 -0.10 0.00 1.02 0.00 0.00 30.24 29.80 3g0b n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3g0b s VAL 698 N -2.73 1.48 -0.19 5.09 -7.23 -1.01 -4.88 120.40 110.93 3g0b s VAL 698 Ca 0.18 -2.12 -0.09 0.00 -1.81 0.00 0.00 61.98 58.14 3g0b s VAL 698 Cb 0.18 -2.22 -0.05 0.00 0.56 0.00 0.00 36.38 34.86 3g0b s VAL 698 CO 0.62 -0.46 0.10 -1.61 -0.31 0.00 0.00 175.10 173.43 3g0b s GLU 699 N -3.73 4.07 -0.03 4.82 2.02 -0.35 -4.97 118.70 120.53 3g0b s GLU 699 Ca 0.25 -0.29 0.02 0.00 0.02 0.00 0.00 54.97 54.97 3g0b s GLU 699 Cb 0.03 -3.32 0.01 0.00 0.10 0.00 0.00 34.13 30.95 3g0b s GLU 699 CO 0.08 0.27 -0.06 -0.47 0.02 0.00 0.00 175.26 175.10 3g0b s TYR 700 N 0.40 0.78 -0.15 1.61 5.04 -1.26 0.16 117.35 123.92 3g0b s TYR 700 Ca 0.05 -0.20 0.01 0.00 -2.44 0.00 0.00 57.07 54.50 3g0b s TYR 700 Cb -0.12 -0.61 0.02 0.00 0.35 0.00 0.00 41.96 41.60 3g0b s TYR 700 CO -0.01 -0.12 -0.19 -1.17 -1.34 0.00 0.00 175.55 172.72 3g0b s LEU 701 N 0.45 1.98 -0.17 6.97 2.96 0.05 0.18 118.68 131.10 3g0b s LEU 701 Ca -0.06 -0.58 -0.04 0.00 -0.22 0.00 0.00 54.13 53.24 3g0b s LEU 701 Cb -0.10 -1.36 -0.02 0.00 0.50 0.00 0.00 46.19 45.21 3g0b s LEU 701 CO 0.00 0.01 -0.04 -0.22 -1.32 0.00 0.00 176.35 174.79 3g0b s LEU 702 N 1.16 3.13 -0.01 -0.68 2.96 -0.21 -1.08 118.68 123.94 3g0b s LEU 702 Ca 0.00 -0.21 0.03 0.00 -0.22 0.00 0.00 54.13 53.73 3g0b s LEU 702 Cb -0.14 -1.76 -0.01 0.00 0.50 0.00 0.00 46.19 44.78 3g0b s LEU 702 CO -0.08 0.11 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.33 3g0b s ILE 703 N 0.69 0.84 -0.26 6.68 1.01 -0.39 -1.47 121.20 128.30 3g0b s ILE 703 Ca -0.02 -0.44 -0.23 0.00 0.00 0.00 0.00 60.65 59.96 3g0b s ILE 703 Cb -0.15 -0.72 0.07 0.00 0.01 0.00 0.00 42.46 41.68 3g0b s ILE 703 CO 0.02 0.24 0.68 -2.28 0.00 0.00 0.00 174.94 173.61 3g0b s HIS 704 N -0.13 -0.78 0.24 3.97 2.46 -0.92 -0.17 115.29 119.96 3g0b s HIS 704 Ca 0.02 1.86 -0.30 0.00 0.47 0.00 0.00 55.06 57.11 3g0b s HIS 704 Cb -0.05 0.29 -0.09 0.00 -0.13 0.00 0.00 32.58 32.60 3g0b s HIS 704 CO -0.00 -0.38 1.00 0.20 -2.47 0.00 0.00 174.74 173.09 3g0b s GLY 705 N 0.50 3.08 0.38 1.59 0.00 -1.26 -0.82 107.32 110.79 3g0b s GLY 705 Ca -0.01 0.72 0.21 0.00 0.00 0.00 0.00 44.72 45.63 3g0b s GLY 705 CO -0.01 1.33 1.64 -0.91 0.00 0.00 0.00 173.10 175.15 3g0b h THR 706 N 3.22 0.51 -0.65 0.90 1.35 -1.01 -3.13 112.91 114.10 3g0b h THR 706 Ca -0.45 -1.49 -0.27 0.00 -0.55 0.00 0.00 66.41 63.65 3g0b h THR 706 Cb 1.20 2.06 -0.16 0.00 -1.73 0.00 0.00 68.15 69.53 3g0b h THR 706 CO 0.68 0.26 0.25 0.00 -0.25 0.00 0.00 175.52 176.47 3g0b n ALA 707 N -2.19 4.62 -2.08 6.62 0.00 -0.57 -4.71 120.51 122.19 3g0b n ALA 707 Ca 0.02 -2.72 -0.41 0.00 0.00 0.00 0.00 53.44 50.33 3g0b n ALA 707 Cb 0.57 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 3g0b n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3g0b s ASP 708 N -1.63 5.63 0.30 0.00 3.68 -1.06 -4.22 116.67 119.36 3g0b s ASP 708 Ca 0.51 0.68 0.25 0.00 2.13 0.00 0.00 52.55 56.13 3g0b s ASP 708 Cb 0.43 -2.53 0.74 0.00 -1.45 0.00 0.00 42.92 40.11 3g0b s ASP 708 CO 0.08 -2.03 1.74 -2.24 0.13 0.00 0.00 175.17 172.85 3g0b h ASP 709 N 13.61 0.00 0.00 -0.34 2.03 -1.92 -3.35 116.42 126.45 3g0b h ASP 709 Ca -0.29 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.01 3g0b h ASP 709 Cb 1.15 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.65 3g0b h ASP 709 CO 1.14 0.00 0.00 -3.20 -1.03 0.00 0.00 179.24 176.15 3g0b n ASN 710 N -2.54 0.00 -4.41 4.15 4.05 -1.26 -4.73 115.26 110.52 3g0b n ASN 710 Ca 0.04 0.16 -0.44 0.00 0.45 0.00 0.00 54.58 54.80 3g0b n ASN 710 Cb 0.43 -0.40 -0.08 0.00 1.23 0.00 0.00 39.78 40.95 3g0b n ASN 710 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3g0b s VAL 711 N -0.80 5.23 0.40 3.44 1.01 -1.26 -4.78 120.40 123.64 3g0b s VAL 711 Ca 0.00 -0.91 -0.27 0.00 0.00 0.00 0.00 61.98 60.80 3g0b s VAL 711 Cb 0.00 -4.07 -0.09 0.00 0.00 0.00 0.00 36.38 32.22 3g0b s VAL 711 CO 0.00 -0.50 1.35 -1.00 0.00 0.00 0.00 175.10 174.95 3g0b s HIS 712 N 1.68 2.76 0.44 5.22 3.76 -1.25 -4.69 115.29 123.21 3g0b s HIS 712 Ca 0.05 1.35 0.26 0.00 -0.15 0.00 0.00 55.06 56.57 3g0b s HIS 712 Cb -0.22 -3.76 1.30 0.00 1.11 0.00 0.00 32.58 31.01 3g0b s HIS 712 CO 0.08 -2.32 1.73 0.35 -0.85 0.00 0.00 174.74 173.73 3g0b h PHE 713 N 2.77 0.46 -0.98 1.40 3.57 -1.77 0.20 116.94 122.59 3g0b h PHE 713 Ca -0.50 0.02 0.40 0.00 3.53 0.00 0.00 57.97 61.42 3g0b h PHE 713 Cb 1.25 -0.13 -0.18 0.00 2.79 0.00 0.00 35.95 39.68 3g0b h PHE 713 CO 0.53 -0.02 0.50 0.94 -2.23 0.00 0.00 178.31 178.03 3g0b n GLN 714 N -4.52 -0.06 -0.16 1.11 7.27 -1.26 -1.22 117.38 118.54 3g0b n GLN 714 Ca 0.29 1.36 -0.08 0.00 0.07 0.00 0.00 57.00 58.64 3g0b n GLN 714 Cb 1.13 -2.43 0.01 0.00 2.41 0.00 0.00 30.24 31.36 3g0b n GLN 714 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 3g0b h GLN 715 N 0.00 0.68 0.02 3.69 4.20 -0.92 -0.37 115.11 122.40 3g0b h GLN 715 Ca 0.82 -0.10 -0.22 0.00 0.06 0.00 0.00 58.65 59.21 3g0b h GLN 715 Cb 2.16 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 29.81 3g0b h GLN 715 CO -0.76 0.58 -0.95 0.77 -0.67 0.00 0.00 178.83 177.80 3g0b h SER 716 N 0.61 0.36 -0.71 1.46 0.02 -1.38 -2.68 113.55 111.22 3g0b h SER 716 Ca 0.16 -0.30 0.06 0.00 -0.84 0.00 0.00 61.79 60.87 3g0b h SER 716 Cb 0.14 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.52 3g0b h SER 716 CO -0.02 1.12 0.47 0.00 -1.14 0.00 0.00 176.83 177.26 3g0b h ALA 717 N 0.85 1.72 0.00 3.77 0.00 -0.95 0.12 119.26 124.77 3g0b h ALA 717 Ca -0.07 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 3g0b h ALA 717 Cb 1.60 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.18 3g0b h ALA 717 CO 0.15 0.17 -0.91 1.96 0.00 0.00 0.00 179.25 180.62 3g0b h GLN 718 N 0.73 0.01 -0.29 0.00 1.08 -1.00 -2.21 115.11 113.44 3g0b h GLN 718 Ca 0.31 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.45 3g0b h GLN 718 Cb 0.26 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.69 3g0b h GLN 718 CO -0.10 0.91 0.02 0.82 -0.95 0.00 0.00 178.83 179.53 3g0b h ILE 719 N 0.01 1.25 -0.27 2.54 2.04 -1.01 -2.84 117.51 119.22 3g0b h ILE 719 Ca -0.01 -0.87 -0.05 0.00 1.00 0.00 0.00 64.86 64.92 3g0b h ILE 719 Cb 1.61 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 38.94 3g0b h ILE 719 CO 0.12 0.28 -0.03 0.77 0.00 0.00 0.00 178.15 179.29 3g0b h SER 720 N 0.29 0.49 -0.91 1.72 4.64 -0.79 -1.98 113.55 117.02 3g0b h SER 720 Ca 0.08 -0.33 0.09 0.00 -0.47 0.00 0.00 61.79 61.16 3g0b h SER 720 Cb 0.39 -0.13 -0.07 0.00 -0.31 0.00 0.00 62.40 62.27 3g0b h SER 720 CO 0.01 0.71 0.56 0.50 -0.87 0.00 0.00 176.83 177.74 3g0b h LYS 721 N 0.27 0.92 -0.44 4.77 3.64 -1.46 -0.62 116.57 123.64 3g0b h LYS 721 Ca 0.07 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 3g0b h LYS 721 Cb 0.47 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3g0b h LYS 721 CO 0.02 0.61 -0.17 0.00 -2.27 0.00 0.00 179.45 177.64 3g0b h ALA 722 N 1.47 0.86 -0.36 5.00 0.00 -1.23 -0.22 119.26 124.77 3g0b h ALA 722 Ca 0.42 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3g0b h ALA 722 Cb 0.32 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3g0b h ALA 722 CO -0.22 0.64 -0.06 -0.07 0.00 0.00 0.00 179.25 179.54 3g0b h LEU 723 N 0.75 0.68 -0.32 0.00 3.38 -0.82 -2.10 115.31 116.89 3g0b h LEU 723 Ca 0.11 -0.34 0.03 0.00 0.09 0.00 0.00 57.88 57.77 3g0b h LEU 723 Cb 0.69 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 3g0b h LEU 723 CO 0.05 0.86 0.11 0.58 0.09 0.00 0.00 178.44 180.14 3g0b h VAL 724 N 0.48 0.91 0.00 1.22 2.07 -1.04 -0.24 116.25 119.65 3g0b h VAL 724 Ca 0.10 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 3g0b h VAL 724 Cb 0.55 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 3g0b h VAL 724 CO 0.03 0.04 -0.10 0.44 0.02 0.00 0.00 177.57 178.01 3g0b h ASP 725 N 0.25 0.00 0.08 0.57 3.45 -0.86 -2.38 116.42 117.53 3g0b h ASP 725 Ca 0.14 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.60 3g0b h ASP 725 Cb 0.11 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.88 3g0b h ASP 725 CO -0.14 0.10 -0.49 1.33 -1.57 0.00 0.00 179.24 178.46 3g0b n VAL 726 N -3.79 0.00 -0.74 -1.35 0.24 -0.80 -4.99 118.33 106.89 3g0b n VAL 726 Ca -0.02 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 3g0b n VAL 726 Cb 0.20 0.93 0.00 0.00 -1.47 0.00 0.00 33.84 33.50 3g0b n VAL 726 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3g0b n GLY 727 N 1.41 0.73 3.66 7.63 0.00 -0.49 -4.98 105.19 113.16 3g0b n GLY 727 Ca 0.09 -0.62 -0.38 0.00 0.00 0.00 0.00 46.02 45.11 3g0b n GLY 727 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g0b s VAL 728 N -2.00 5.25 0.45 1.61 0.11 -0.22 -5.01 120.40 120.58 3g0b s VAL 728 Ca 0.00 0.52 -0.21 0.00 -2.93 0.00 0.00 61.98 59.36 3g0b s VAL 728 Cb 0.00 -3.65 -0.10 0.00 -1.53 0.00 0.00 36.38 31.10 3g0b s VAL 728 CO 0.00 0.27 1.00 -0.62 -3.33 0.00 0.00 175.10 172.41 3g0b s ASP 729 N 1.14 6.67 0.21 3.54 2.15 -1.26 -4.33 116.67 124.79 3g0b s ASP 729 Ca 0.15 1.83 -0.23 0.00 0.43 0.00 0.00 52.55 54.72 3g0b s ASP 729 Cb -0.15 -2.55 0.05 0.00 -0.30 0.00 0.00 42.92 39.97 3g0b s ASP 729 CO 0.07 -0.55 0.87 0.72 -0.17 0.00 0.00 175.17 176.11 3g0b s PHE 730 N -2.03 -0.15 0.04 -5.34 -0.12 -1.26 -4.81 117.98 104.31 3g0b s PHE 730 Ca 0.64 -0.23 0.01 0.00 -0.05 0.00 0.00 56.93 57.30 3g0b s PHE 730 Cb -0.14 0.67 -0.04 0.00 -0.63 0.00 0.00 43.02 42.89 3g0b s PHE 730 CO 0.17 -1.00 0.10 -0.65 -0.05 0.00 0.00 175.22 173.79 3g0b s GLN 731 N -3.50 3.04 0.05 1.99 -1.52 0.13 -5.01 119.66 114.83 3g0b s GLN 731 Ca 0.12 -0.57 0.01 0.00 -1.95 0.00 0.00 55.36 52.98 3g0b s GLN 731 Cb -0.03 -2.83 -0.03 0.00 -0.22 0.00 0.00 33.01 29.90 3g0b s GLN 731 CO 0.04 0.61 -0.06 0.00 -0.25 0.00 0.00 175.29 175.63 3g0b s ALA 732 N -1.32 0.52 -0.15 6.09 0.00 -1.26 -1.04 121.76 124.60 3g0b s ALA 732 Ca 0.27 -0.85 -0.05 0.00 0.00 0.00 0.00 51.96 51.33 3g0b s ALA 732 Cb -0.12 0.11 0.07 0.00 0.00 0.00 0.00 23.12 23.18 3g0b s ALA 732 CO 0.19 -0.12 0.31 1.41 0.00 0.00 0.00 175.76 177.56 3g0b s MET 733 N -2.09 0.20 0.23 0.00 1.75 -0.54 -4.93 119.30 113.92 3g0b s MET 733 Ca -0.07 0.83 -0.06 0.00 -1.25 0.00 0.00 55.69 55.15 3g0b s MET 733 Cb -0.06 0.07 -0.06 0.00 2.84 0.00 0.00 34.83 37.62 3g0b s MET 733 CO -0.02 -0.28 0.50 1.67 -0.65 0.00 0.00 175.02 176.24 3g0b s TRP 734 N 2.48 3.46 -0.30 4.11 -2.14 -1.26 -2.17 118.94 123.12 3g0b s TRP 734 Ca 0.00 0.67 0.01 0.00 2.66 0.00 0.00 56.10 59.44 3g0b s TRP 734 Cb -0.12 -2.11 0.07 0.00 -3.10 0.00 0.00 33.47 28.21 3g0b s TRP 734 CO -0.10 0.28 -0.01 0.71 -2.66 0.00 0.00 176.95 175.17 3g0b s TYR 735 N -1.88 3.36 -0.02 1.66 2.02 -0.00 -4.92 117.35 117.56 3g0b s TYR 735 Ca 0.44 -2.24 -0.30 0.00 -0.37 0.00 0.00 57.07 54.60 3g0b s TYR 735 Cb -0.11 -2.26 -0.08 0.00 -0.40 0.00 0.00 41.96 39.11 3g0b s TYR 735 CO 0.26 -0.87 2.03 2.41 -1.57 0.00 0.00 175.55 177.81 3g0b n THR 736 N 4.50 0.67 -1.06 -0.71 -1.04 -1.26 -1.08 114.28 114.31 3g0b n THR 736 Ca -0.10 -0.21 -0.02 0.00 -2.04 0.00 0.00 64.05 61.68 3g0b n THR 736 Cb 0.42 -2.35 -0.01 0.00 -1.82 0.00 0.00 70.33 66.57 3g0b n THR 736 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3g0b n ASP 737 N 8.40 -4.11 -4.85 8.00 10.43 -1.26 -4.89 116.55 128.28 3g0b n ASP 737 Ca 0.22 0.05 -0.34 0.00 2.57 0.00 0.00 54.79 57.29 3g0b n ASP 737 Cb 0.41 -1.80 -0.06 0.00 1.84 0.00 0.00 41.12 41.52 3g0b n ASP 737 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 3g0b s GLU 738 N -1.28 3.98 0.00 -1.24 0.41 -1.02 -4.63 118.70 114.92 3g0b s GLU 738 Ca 0.00 0.51 0.00 0.00 -0.41 0.00 0.00 54.97 55.07 3g0b s GLU 738 Cb 0.00 -2.83 0.00 0.00 -1.78 0.00 0.00 34.13 29.52 3g0b s GLU 738 CO 0.00 0.41 0.00 -0.40 -0.49 0.00 0.00 175.26 174.78 3g0b n ASP 739 N 0.51 0.00 0.26 -0.19 3.85 -1.26 -1.52 116.55 118.20 3g0b n ASP 739 Ca -0.03 0.00 0.12 0.00 -0.71 0.00 0.00 54.79 54.17 3g0b n ASP 739 Cb 0.52 0.00 0.71 0.00 -1.35 0.00 0.00 41.12 41.00 3g0b n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.01 0.00 0.00 177.20 175.45 3g0b h HIS 740 N 0.00 0.00 0.00 2.11 -0.00 -1.92 -1.48 115.15 113.86 3g0b h HIS 740 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.26 3g0b h HIS 740 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.39 3g0b h HIS 740 CO 0.00 0.12 -0.54 0.78 -0.00 0.00 0.00 177.93 178.29 3g0b h GLY 741 N 0.78 0.00 -6.86 5.26 0.00 -1.99 -3.48 103.07 96.78 3g0b h GLY 741 Ca -0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 3g0b h GLY 741 CO 0.02 0.00 -0.83 1.39 0.00 0.00 0.00 176.54 177.11 3g0b n ILE 742 N -3.53 -1.30 0.35 2.60 5.41 -0.56 -4.87 119.36 117.47 3g0b n ILE 742 Ca -0.00 -0.45 0.04 0.00 1.00 0.00 0.00 62.75 63.34 3g0b n ILE 742 Cb 0.63 -1.19 0.02 0.00 -0.71 0.00 0.00 39.64 38.39 3g0b n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3g0b n ALA 743 N -4.18 2.58 -1.60 -1.39 0.00 -1.26 -3.21 120.51 111.45 3g0b n ALA 743 Ca -0.22 -0.50 -0.41 0.00 0.00 0.00 0.00 53.44 52.32 3g0b n ALA 743 Cb 0.55 -0.28 0.01 0.00 0.00 0.00 0.00 19.45 19.73 3g0b n ALA 743 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3g0b n SER 744 N 0.15 1.08 -0.10 0.00 7.64 -1.26 -4.70 113.62 116.43 3g0b n SER 744 Ca 0.04 1.01 -0.06 0.00 1.01 0.00 0.00 58.87 60.88 3g0b n SER 744 Cb 0.19 -1.34 0.01 0.00 -1.01 0.00 0.00 64.21 62.06 3g0b n SER 744 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 3g0b h SER 745 N 1.42 -0.39 -0.34 6.43 0.87 -1.99 0.25 113.55 119.81 3g0b h SER 745 Ca -0.44 0.11 -0.14 0.00 -1.23 0.00 0.00 61.79 60.09 3g0b h SER 745 Cb 1.34 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 63.54 3g0b h SER 745 CO 0.56 -0.14 -0.32 0.71 -0.53 0.00 0.00 176.83 177.11 3g0b h THR 746 N -0.03 1.28 -0.28 2.23 1.35 -1.98 -2.52 112.91 112.97 3g0b h THR 746 Ca 0.17 -1.48 -0.17 0.00 -0.55 0.00 0.00 66.41 64.39 3g0b h THR 746 Cb 0.29 1.31 -0.00 0.00 -1.73 0.00 0.00 68.15 68.02 3g0b h THR 746 CO -0.38 0.49 -0.50 0.00 -0.25 0.00 0.00 175.52 174.89 3g0b h ALA 747 N 0.91 0.58 -0.52 6.62 0.00 -1.71 -1.50 119.26 123.64 3g0b h ALA 747 Ca 0.08 -0.49 0.05 0.00 0.00 0.00 0.00 54.91 54.54 3g0b h ALA 747 Cb 0.88 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 3g0b h ALA 747 CO 0.08 0.68 0.26 1.25 0.00 0.00 0.00 179.25 181.52 3g0b h HIS 748 N 0.62 0.48 -0.58 0.00 2.76 -0.49 0.36 115.15 118.30 3g0b h HIS 748 Ca 0.03 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.12 3g0b h HIS 748 Cb 1.08 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.88 3g0b h HIS 748 CO 0.06 0.23 -0.02 1.96 -1.30 0.00 0.00 177.93 178.86 3g0b h GLN 749 N 0.51 1.02 -0.15 5.26 4.20 -1.39 -3.03 115.11 121.54 3g0b h GLN 749 Ca 0.23 -0.33 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 3g0b h GLN 749 Cb 0.14 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 3g0b h GLN 749 CO -0.16 1.02 -0.05 1.25 -0.67 0.00 0.00 178.83 180.21 3g0b h HIS 750 N 0.93 0.33 -0.39 2.96 2.76 -0.78 -1.59 115.15 119.38 3g0b h HIS 750 Ca 0.16 -0.08 0.01 0.00 -2.20 0.00 0.00 60.37 58.27 3g0b h HIS 750 Cb 0.57 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.43 3g0b h HIS 750 CO 0.04 0.60 0.24 0.97 -1.30 0.00 0.00 177.93 178.48 3g0b h ILE 751 N -0.03 1.07 -0.05 6.26 2.10 -0.99 0.95 117.51 126.82 3g0b h ILE 751 Ca 0.03 -0.17 -0.11 0.00 1.08 0.00 0.00 64.86 65.69 3g0b h ILE 751 Cb 0.50 0.53 -0.01 0.00 -1.09 0.00 0.00 36.82 36.75 3g0b h ILE 751 CO 0.02 0.09 -0.48 1.88 -1.08 0.00 0.00 178.15 178.58 3g0b h TYR 752 N 0.49 0.15 -0.43 2.19 -1.99 -1.52 0.56 116.97 116.42 3g0b h TYR 752 Ca 0.15 -0.05 -0.11 0.00 2.00 0.00 0.00 58.73 60.73 3g0b h TYR 752 Cb -0.02 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 38.66 3g0b h TYR 752 CO -0.06 0.58 -0.15 1.15 -0.00 0.00 0.00 178.16 179.68 3g0b h THR 753 N 0.10 1.28 -0.54 -2.88 2.02 -1.02 -1.26 112.91 110.61 3g0b h THR 753 Ca 0.00 -1.28 -0.09 0.00 0.77 0.00 0.00 66.41 65.81 3g0b h THR 753 Cb 0.89 1.20 -0.02 0.00 -1.74 0.00 0.00 68.15 68.48 3g0b h THR 753 CO 0.07 0.43 -0.03 -0.74 0.37 0.00 0.00 175.52 175.62 3g0b h HIS 754 N 0.68 1.03 -0.05 3.16 6.17 -0.36 -2.56 115.15 123.23 3g0b h HIS 754 Ca 0.10 -0.18 -0.20 0.00 0.71 0.00 0.00 60.37 60.81 3g0b h HIS 754 Cb 0.70 -0.27 -0.00 0.00 2.52 0.00 0.00 27.41 30.36 3g0b h HIS 754 CO 0.05 0.94 -0.81 0.52 0.71 0.00 0.00 177.93 179.34 3g0b h MET 755 N 0.87 0.40 -0.05 5.26 2.07 -0.84 -2.22 114.93 120.42 3g0b h MET 755 Ca 0.15 -0.37 0.02 0.00 -2.07 0.00 0.00 59.70 57.44 3g0b h MET 755 Cb 0.56 0.09 -0.03 0.00 -1.87 0.00 0.00 31.60 30.35 3g0b h MET 755 CO 0.03 1.02 -0.09 0.77 1.07 0.00 0.00 176.91 179.71 3g0b h SER 756 N 0.25 -0.26 -0.76 1.22 0.02 -1.16 0.89 113.55 113.75 3g0b h SER 756 Ca -0.05 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 3g0b h SER 756 Cb 1.41 0.12 -0.04 0.00 0.14 0.00 0.00 62.40 64.03 3g0b h SER 756 CO 0.14 -0.12 0.49 0.45 -1.14 0.00 0.00 176.83 176.64 3g0b h HIS 757 N -0.13 0.92 -0.05 3.45 3.86 -1.38 0.02 115.15 121.84 3g0b h HIS 757 Ca 0.05 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 3g0b h HIS 757 Cb 0.20 -0.30 -0.00 0.00 1.06 0.00 0.00 27.41 28.36 3g0b h HIS 757 CO -0.18 0.54 0.03 0.35 0.86 0.00 0.00 177.93 179.53 3g0b h PHE 758 N 0.96 0.07 -0.40 2.45 3.57 -1.03 -1.09 116.94 121.46 3g0b h PHE 758 Ca 0.30 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.75 3g0b h PHE 758 Cb -0.03 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 3g0b h PHE 758 CO -0.03 0.13 0.06 0.82 -2.23 0.00 0.00 178.31 177.06 3g0b h ILE 759 N -0.01 1.24 -0.64 1.41 1.08 -0.51 -1.58 117.51 118.51 3g0b h ILE 759 Ca 0.02 -0.87 -0.04 0.00 -0.39 0.00 0.00 64.86 63.58 3g0b h ILE 759 Cb 0.08 1.03 -0.03 0.00 -3.07 0.00 0.00 36.82 34.84 3g0b h ILE 759 CO -0.00 0.30 0.26 0.11 -0.69 0.00 0.00 178.15 178.13 3g0b h LYS 760 N 0.52 0.95 -0.13 2.37 1.57 -0.95 -1.00 116.57 119.89 3g0b h LYS 760 Ca 0.12 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3g0b h LYS 760 Cb 0.37 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3g0b h LYS 760 CO 0.01 0.79 0.03 0.37 -0.57 0.00 0.00 179.45 180.09 3g0b h GLN 761 N 0.89 0.22 -0.96 3.15 4.15 -1.11 1.01 115.11 122.45 3g0b h GLN 761 Ca 0.21 -0.05 0.12 0.00 0.77 0.00 0.00 58.65 59.71 3g0b h GLN 761 Cb 0.20 -0.03 -0.08 0.00 0.21 0.00 0.00 27.48 27.78 3g0b h GLN 761 CO -0.02 0.37 0.61 0.00 -1.93 0.00 0.00 178.83 177.87 3g0b n PHE 763 N -4.60 0.02 -3.48 0.00 3.72 -0.39 -4.94 117.46 107.79 3g0b n PHE 763 Ca 0.18 -0.01 -0.21 0.00 -0.05 0.00 0.00 57.45 57.36 3g0b n PHE 763 Cb 0.38 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 39.00 3g0b n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3g0b n SER 764 N 0.27 -5.52 -4.57 4.37 7.64 -0.06 -4.99 113.62 110.75 3g0b n SER 764 Ca 0.18 -0.50 -0.40 0.00 1.01 0.00 0.00 58.87 59.16 3g0b n SER 764 Cb 0.37 -4.66 -0.09 0.00 -1.01 0.00 0.00 64.21 58.81 3g0b n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3g0b s LEU 765 N -6.68 4.23 0.00 -3.43 1.43 0.33 -5.00 118.68 109.56 3g0b s LEU 765 Ca 0.47 -0.00 0.31 0.00 -1.03 0.00 0.00 54.13 53.87 3g0b s LEU 765 Cb -0.21 -2.35 1.67 0.00 0.03 0.00 0.00 46.19 45.33 3g0b s LEU 765 CO 0.67 -0.25 2.09 -0.81 0.23 0.00 0.00 176.35 178.28