#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ajc n ARG 40 N 0.00 -1.06 -2.15 4.33 1.74 -1.26 -4.91 116.66 113.35 2ajc n ARG 40 Ca 0.00 0.78 -0.33 0.00 -0.77 0.00 0.00 57.85 57.53 2ajc n ARG 40 Cb 0.00 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 2ajc n ARG 40 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2ajc s ARG 41 N -2.95 3.35 0.48 5.56 3.52 -1.23 -4.80 118.95 122.87 2ajc s ARG 41 Ca 0.00 1.35 0.06 0.00 -0.13 0.00 0.00 55.73 57.01 2ajc s ARG 41 Cb 0.00 -2.03 0.00 0.00 -1.56 0.00 0.00 34.95 31.36 2ajc s ARG 41 CO 0.00 -0.81 0.33 0.95 -0.81 0.00 0.00 175.30 174.97 2ajc s THR 42 N -2.19 2.04 -0.45 4.11 -4.23 -1.26 -0.69 115.64 112.98 2ajc s THR 42 Ca 0.67 -1.52 -0.25 0.00 -1.18 0.00 0.00 61.69 59.41 2ajc s THR 42 Cb -0.18 -2.56 0.02 0.00 1.34 0.00 0.00 72.50 71.12 2ajc s THR 42 CO 0.32 0.00 0.90 -0.47 -0.54 0.00 0.00 174.62 174.82 2ajc s TYR 43 N -2.66 2.96 0.49 3.99 5.04 -1.26 -4.82 117.35 121.09 2ajc s TYR 43 Ca 0.38 0.39 -0.01 0.00 -2.44 0.00 0.00 57.07 55.40 2ajc s TYR 43 Cb -0.01 -3.86 0.01 0.00 0.35 0.00 0.00 41.96 38.44 2ajc s TYR 43 CO 0.23 -1.04 0.73 0.95 -1.34 0.00 0.00 175.55 175.08 2ajc s THR 44 N 3.62 3.70 0.24 4.34 -4.23 -1.26 -3.94 115.64 118.11 2ajc s THR 44 Ca 0.36 -0.44 -0.05 0.00 -1.18 0.00 0.00 61.69 60.37 2ajc s THR 44 Cb -0.11 -3.39 0.21 0.00 1.34 0.00 0.00 72.50 70.56 2ajc s THR 44 CO 0.25 -0.30 1.84 0.25 -0.54 0.00 0.00 174.62 176.12 2ajc h LEU 45 N 0.24 0.78 -1.13 4.79 5.85 -1.95 0.68 115.31 124.57 2ajc h LEU 45 Ca -0.45 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.25 2ajc h LEU 45 Cb 1.26 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 2ajc h LEU 45 CO 0.57 0.48 0.15 0.74 -0.34 0.00 0.00 178.44 180.04 2ajc h THR 46 N 0.91 1.21 -0.41 1.05 2.02 -1.98 0.23 112.91 115.94 2ajc h THR 46 Ca 0.38 -0.73 0.01 0.00 0.77 0.00 0.00 66.41 66.84 2ajc h THR 46 Cb 0.23 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2ajc h THR 46 CO -0.20 0.27 0.26 0.44 0.37 0.00 0.00 175.52 176.67 2ajc h ASP 47 N 0.74 0.44 0.26 4.18 3.32 -1.30 0.10 116.42 124.18 2ajc h ASP 47 Ca 0.17 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 2ajc h ASP 47 Cb 0.24 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2ajc h ASP 47 CO -0.01 0.32 -0.13 0.22 -1.72 0.00 0.00 179.24 177.93 2ajc h TYR 48 N 0.53 -0.33 -0.41 4.55 3.20 -0.41 -2.08 116.97 122.02 2ajc h TYR 48 Ca 0.16 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 2ajc h TYR 48 Cb -0.04 0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 2ajc h TYR 48 CO -0.06 -0.06 0.09 -0.07 -1.64 0.00 0.00 178.16 176.42 2ajc h LEU 49 N -0.58 0.56 -1.73 2.82 3.38 -0.43 -2.79 115.31 116.54 2ajc h LEU 49 Ca -0.04 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2ajc h LEU 49 Cb 0.42 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2ajc h LEU 49 CO 0.06 0.57 0.00 0.29 0.09 0.00 0.00 178.44 179.45 2ajc n LYS 50 N -4.31 2.15 -3.94 1.13 4.76 0.01 -4.97 118.16 112.99 2ajc n LYS 50 Ca 0.02 -1.72 -0.27 0.00 -2.87 0.00 0.00 58.31 53.48 2ajc n LYS 50 Cb 0.20 -1.47 -0.01 0.00 -1.84 0.00 0.00 35.03 31.92 2ajc n LYS 50 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2ajc n SER 51 N 0.98 -1.35 0.01 4.39 7.64 -0.83 -4.86 113.62 119.60 2ajc n SER 51 Ca 0.17 -0.95 0.01 0.00 1.01 0.00 0.00 58.87 59.11 2ajc n SER 51 Cb 0.50 -3.27 0.33 0.00 -1.01 0.00 0.00 64.21 60.76 2ajc n SER 51 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2ajc h THR 52 N -1.82 1.17 -3.29 0.44 1.35 -1.70 -3.35 112.91 105.72 2ajc h THR 52 Ca -0.62 -0.65 -0.77 0.00 -0.55 0.00 0.00 66.41 63.82 2ajc h THR 52 Cb 1.37 0.88 -0.25 0.00 -1.73 0.00 0.00 68.15 68.43 2ajc h THR 52 CO 0.64 0.23 -0.14 -0.36 -0.25 0.00 0.00 175.52 175.64 2ajc s PHE 53 N -5.05 3.39 -0.16 4.73 0.08 -1.26 -5.05 117.98 114.66 2ajc s PHE 53 Ca -0.07 -1.49 -0.26 0.00 0.12 0.00 0.00 56.93 55.23 2ajc s PHE 53 Cb 0.16 -3.80 -0.01 0.00 -0.57 0.00 0.00 43.02 38.80 2ajc s PHE 53 CO 0.75 -1.01 0.87 0.50 -0.10 0.00 0.00 175.22 176.24 2ajc s ARG 54 N 1.22 4.32 -0.16 0.44 6.06 -1.26 -5.03 118.95 124.54 2ajc s ARG 54 Ca 0.07 1.10 -0.20 0.00 -2.50 0.00 0.00 55.73 54.20 2ajc s ARG 54 Cb -0.25 -3.57 -0.03 0.00 0.06 0.00 0.00 34.95 31.16 2ajc s ARG 54 CO -0.00 -0.33 0.60 0.08 -2.50 0.00 0.00 175.30 173.15 2ajc s VAL 55 N 2.15 5.06 0.28 7.11 1.01 -1.26 -4.64 120.40 130.12 2ajc s VAL 55 Ca 0.40 1.16 0.01 0.00 0.00 0.00 0.00 61.98 63.55 2ajc s VAL 55 Cb -0.17 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 2ajc s VAL 55 CO 0.13 0.18 0.47 -0.54 0.00 0.00 0.00 175.10 175.34 2ajc s LYS 56 N 1.47 3.49 0.18 2.72 1.02 -1.26 -5.11 119.74 122.26 2ajc s LYS 56 Ca 0.29 -0.41 0.04 0.00 0.02 0.00 0.00 55.97 55.92 2ajc s LYS 56 Cb -0.16 -2.75 -0.02 0.00 -0.52 0.00 0.00 37.83 34.38 2ajc s LYS 56 CO 0.11 0.27 0.15 1.97 -0.92 0.00 0.00 175.35 176.94 2ajc n PHE 57 N -1.37 -0.40 -3.42 3.18 1.16 -1.26 -4.88 117.46 110.47 2ajc n PHE 57 Ca -0.05 -1.51 -0.20 0.00 -1.87 0.00 0.00 57.45 53.82 2ajc n PHE 57 Cb 0.56 0.15 -0.10 0.00 -1.61 0.00 0.00 39.48 38.47 2ajc n PHE 57 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 2ajc s TYR 58 N -2.71 -0.22 -0.24 2.97 6.14 -1.26 -4.96 117.35 117.07 2ajc s TYR 58 Ca 0.21 -0.52 -0.16 0.00 0.64 0.00 0.00 57.07 57.24 2ajc s TYR 58 Cb 0.01 -0.55 -0.03 0.00 0.42 0.00 0.00 41.96 41.80 2ajc s TYR 58 CO 0.15 -0.91 0.43 0.99 0.64 0.00 0.00 175.55 176.84 2ajc s THR 59 N 2.04 5.15 0.19 4.34 2.01 -1.26 -5.07 115.64 123.05 2ajc s THR 59 Ca 0.11 0.72 0.08 0.00 0.31 0.00 0.00 61.69 62.91 2ajc s THR 59 Cb -0.15 -3.75 -0.05 0.00 0.01 0.00 0.00 72.50 68.56 2ajc s THR 59 CO -0.25 0.17 -0.15 -1.48 -0.69 0.00 0.00 174.62 172.22 2ajc s LEU 60 N 1.85 2.53 -0.25 4.42 0.05 -1.26 -4.47 118.68 121.54 2ajc s LEU 60 Ca 0.18 -0.99 0.02 0.00 0.05 0.00 0.00 54.13 53.39 2ajc s LEU 60 Cb -0.15 -0.67 0.07 0.00 -2.05 0.00 0.00 46.19 43.38 2ajc s LEU 60 CO 0.09 -0.16 -0.05 -1.10 -0.55 0.00 0.00 176.35 174.58 2ajc s GLN 61 N -3.47 1.75 0.26 1.48 -0.21 -0.38 -4.95 119.66 114.13 2ajc s GLN 61 Ca 0.20 -1.18 -0.30 0.00 0.02 0.00 0.00 55.36 54.11 2ajc s GLN 61 Cb -0.02 -2.71 -0.10 0.00 1.00 0.00 0.00 33.01 31.18 2ajc s GLN 61 CO 0.06 -0.64 1.44 -1.58 -2.12 0.00 0.00 175.29 172.46 2ajc s TRP 62 N 1.27 2.99 0.00 0.91 0.52 -1.26 -0.78 118.94 122.59 2ajc s TRP 62 Ca -0.05 1.04 0.00 0.00 0.02 0.00 0.00 56.10 57.11 2ajc s TRP 62 Cb -0.19 -3.84 0.00 0.00 -1.15 0.00 0.00 33.47 28.29 2ajc s TRP 62 CO -0.07 -2.69 0.39 0.44 0.02 0.00 0.00 176.95 175.04 2ajc n ILE 63 N 2.17 0.00 -3.14 2.03 -5.35 0.05 -4.91 119.36 110.20 2ajc n ILE 63 Ca 0.06 -0.39 -0.00 0.00 -0.27 0.00 0.00 62.75 62.15 2ajc n ILE 63 Cb 0.40 1.22 0.00 0.00 -1.74 0.00 0.00 39.64 39.52 2ajc n ILE 63 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2ajc n SER 64 N -0.00 -0.12 0.00 7.28 3.41 -1.17 -4.97 113.62 118.05 2ajc n SER 64 Ca 0.00 -1.08 0.13 0.00 -0.26 0.00 0.00 58.87 57.66 2ajc n SER 64 Cb 0.06 0.19 0.61 0.00 -0.26 0.00 0.00 64.21 64.80 2ajc n SER 64 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2ajc n ASP 65 N -0.93 0.00 -0.22 4.04 5.75 -1.26 -2.61 116.55 121.32 2ajc n ASP 65 Ca -0.00 0.18 0.00 0.00 -0.01 0.00 0.00 54.79 54.95 2ajc n ASP 65 Cb 0.03 -0.38 0.00 0.00 -1.03 0.00 0.00 41.12 39.74 2ajc n ASP 65 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ajc n HIS 66 N -1.38 0.00 -4.19 2.11 1.44 -1.26 -4.38 115.22 107.56 2ajc n HIS 66 Ca 0.10 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.64 2ajc n HIS 66 Cb 0.25 0.06 -0.14 0.00 0.12 0.00 0.00 29.99 30.28 2ajc n HIS 66 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 2ajc s GLU 67 N 0.00 0.55 0.03 -1.40 2.02 -1.26 -0.35 118.70 118.30 2ajc s GLU 67 Ca 0.00 -0.40 0.01 0.00 0.02 0.00 0.00 54.97 54.60 2ajc s GLU 67 Cb 0.00 -0.49 -0.02 0.00 0.10 0.00 0.00 34.13 33.72 2ajc s GLU 67 CO 0.00 0.12 -0.05 1.52 0.02 0.00 0.00 175.26 176.87 2ajc s TYR 68 N -0.50 0.46 0.08 1.61 -0.85 -0.79 -0.77 117.35 116.59 2ajc s TYR 68 Ca -0.01 -0.57 -0.09 0.00 -0.52 0.00 0.00 57.07 55.88 2ajc s TYR 68 Cb -0.05 -0.30 -0.06 0.00 0.38 0.00 0.00 41.96 41.94 2ajc s TYR 68 CO 0.00 -0.16 0.39 -0.51 -1.52 0.00 0.00 175.55 173.75 2ajc s LEU 69 N -1.68 4.34 -0.10 -3.49 1.43 0.04 -0.58 118.68 118.64 2ajc s LEU 69 Ca -0.11 0.75 -0.07 0.00 -1.03 0.00 0.00 54.13 53.68 2ajc s LEU 69 Cb -0.08 -2.99 0.03 0.00 0.03 0.00 0.00 46.19 43.18 2ajc s LEU 69 CO -0.01 0.17 0.24 -0.47 0.23 0.00 0.00 176.35 176.51 2ajc s TYR 70 N -1.42 -0.29 -0.23 0.29 5.04 -0.01 -1.25 117.35 119.48 2ajc s TYR 70 Ca 0.33 0.71 -0.19 0.00 -2.44 0.00 0.00 57.07 55.48 2ajc s TYR 70 Cb -0.14 0.07 -0.03 0.00 0.35 0.00 0.00 41.96 42.22 2ajc s TYR 70 CO 0.18 -0.17 0.55 0.21 -1.34 0.00 0.00 175.55 174.98 2ajc s LYS 71 N 0.60 4.13 -0.08 4.97 2.20 -1.26 -0.18 119.74 130.13 2ajc s LYS 71 Ca -0.04 0.43 -0.02 0.00 -0.36 0.00 0.00 55.97 55.98 2ajc s LYS 71 Cb -0.05 -3.61 0.03 0.00 -1.51 0.00 0.00 37.83 32.69 2ajc s LYS 71 CO -0.03 -0.29 0.03 -1.14 -0.36 0.00 0.00 175.35 173.56 2ajc s GLN 72 N 2.09 0.39 -1.57 4.03 0.74 -0.14 -4.78 119.66 120.41 2ajc s GLN 72 Ca 0.24 0.14 -0.04 0.00 0.05 0.00 0.00 55.36 55.75 2ajc s GLN 72 Cb -0.16 -0.96 0.01 0.00 1.10 0.00 0.00 33.01 33.00 2ajc s GLN 72 CO 0.09 -0.35 0.42 0.39 -0.55 0.00 0.00 175.29 175.29 2ajc n GLU 73 N 5.19 -3.85 -0.91 1.67 -0.58 -1.26 -0.69 120.64 120.20 2ajc n GLU 73 Ca -0.06 0.89 0.00 0.00 -0.42 0.00 0.00 57.16 57.57 2ajc n GLU 73 Cb 0.50 -5.68 0.00 0.00 -0.57 0.00 0.00 31.44 25.69 2ajc n GLU 73 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2ajc n ASN 74 N -2.35 -2.09 -4.93 1.62 3.02 -1.26 -4.85 115.26 104.41 2ajc n ASN 74 Ca -0.14 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.15 2ajc n ASN 74 Cb 0.63 -1.28 -0.02 0.00 -0.61 0.00 0.00 39.78 38.50 2ajc n ASN 74 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2ajc s ASN 75 N -2.31 6.36 -0.31 6.41 -0.87 0.13 -4.23 114.94 120.13 2ajc s ASN 75 Ca 0.00 0.43 -0.10 0.00 -1.57 0.00 0.00 52.86 51.62 2ajc s ASN 75 Cb 0.00 -2.02 -0.01 0.00 -0.02 0.00 0.00 41.25 39.19 2ajc s ASN 75 CO 0.00 -0.14 0.16 -0.63 -2.57 0.00 0.00 177.10 173.92 2ajc s ILE 76 N -2.04 4.75 -0.02 0.60 1.01 0.04 -0.97 121.20 124.57 2ajc s ILE 76 Ca 0.39 -0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.70 2ajc s ILE 76 Cb -0.10 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 38.93 2ajc s ILE 76 CO 0.31 0.08 0.08 -0.76 0.00 0.00 0.00 174.94 174.66 2ajc s LEU 77 N 1.64 3.93 -0.29 2.97 1.43 0.75 0.59 118.68 129.69 2ajc s LEU 77 Ca 0.05 0.18 -0.07 0.00 -1.03 0.00 0.00 54.13 53.26 2ajc s LEU 77 Cb -0.17 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.81 2ajc s LEU 77 CO 0.07 0.29 0.09 -0.22 0.23 0.00 0.00 176.35 176.82 2ajc s LEU 78 N -1.63 3.84 -0.06 1.79 2.96 0.06 -0.83 118.68 124.82 2ajc s LEU 78 Ca 0.22 -0.60 -0.03 0.00 -0.22 0.00 0.00 54.13 53.50 2ajc s LEU 78 Cb -0.12 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 2ajc s LEU 78 CO 0.13 -0.17 0.11 -0.36 -1.32 0.00 0.00 176.35 174.74 2ajc s PHE 79 N 1.54 3.43 -0.27 5.38 0.08 0.25 -1.50 117.98 126.90 2ajc s PHE 79 Ca 0.04 0.35 -0.05 0.00 0.12 0.00 0.00 56.93 57.38 2ajc s PHE 79 Cb -0.17 -1.83 0.01 0.00 -0.57 0.00 0.00 43.02 40.45 2ajc s PHE 79 CO 0.03 0.62 0.03 1.21 -0.10 0.00 0.00 175.22 177.01 2ajc s ASN 80 N -1.43 4.79 0.21 1.36 3.84 -0.06 -1.88 114.94 121.76 2ajc s ASN 80 Ca 0.20 -0.63 -0.03 0.00 0.21 0.00 0.00 52.86 52.61 2ajc s ASN 80 Cb -0.12 -1.81 0.16 0.00 -0.55 0.00 0.00 41.25 38.93 2ajc s ASN 80 CO 0.10 -0.13 1.56 0.00 -2.79 0.00 0.00 177.10 175.84 2ajc h ALA 81 N 8.16 0.79 -1.00 1.71 0.00 -0.99 0.14 119.26 128.07 2ajc h ALA 81 Ca -0.34 -0.45 0.23 0.00 0.00 0.00 0.00 54.91 54.34 2ajc h ALA 81 Cb 1.13 -0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.72 2ajc h ALA 81 CO 0.59 0.66 0.63 0.93 0.00 0.00 0.00 179.25 182.06 2ajc h GLU 82 N 0.50 0.54 0.00 0.00 5.08 -1.94 -3.25 114.58 115.50 2ajc h GLU 82 Ca 0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2ajc h GLU 82 Cb 0.94 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2ajc h GLU 82 CO 0.08 0.36 0.00 0.66 -1.00 0.00 0.00 179.01 179.11 2ajc n TYR 83 N -4.71 0.00 -0.49 4.33 4.01 -1.22 -5.04 117.16 114.05 2ajc n TYR 83 Ca 0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.98 2ajc n TYR 83 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.76 2ajc n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ajc n GLY 84 N 0.00 1.87 3.90 2.72 0.00 0.50 -5.02 105.19 109.16 2ajc n GLY 84 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2ajc n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ajc s ASN 85 N -3.40 5.41 0.23 1.61 4.22 -1.22 -4.78 114.94 117.00 2ajc s ASN 85 Ca 0.00 0.93 -0.09 0.00 -2.14 0.00 0.00 52.86 51.56 2ajc s ASN 85 Cb 0.00 -1.77 -0.02 0.00 1.28 0.00 0.00 41.25 40.74 2ajc s ASN 85 CO 0.00 -1.29 0.36 -0.94 -2.04 0.00 0.00 177.10 173.19 2ajc s SER 86 N -4.36 -0.01 0.08 3.54 1.04 -1.26 -0.89 113.70 111.84 2ajc s SER 86 Ca 0.57 -1.06 -0.08 0.00 0.48 0.00 0.00 55.95 55.86 2ajc s SER 86 Cb -0.11 0.51 -0.01 0.00 0.10 0.00 0.00 66.02 66.52 2ajc s SER 86 CO 0.49 -1.03 0.16 -0.94 0.98 0.00 0.00 173.24 172.90 2ajc s SER 87 N -3.06 0.16 -0.04 7.02 1.04 -0.56 -4.98 113.70 113.29 2ajc s SER 87 Ca 0.27 -0.68 -0.30 0.00 0.48 0.00 0.00 55.95 55.72 2ajc s SER 87 Cb 0.02 0.32 -0.04 0.00 0.10 0.00 0.00 66.02 66.42 2ajc s SER 87 CO 0.09 -0.70 1.23 -0.63 0.98 0.00 0.00 173.24 174.21 2ajc s ILE 88 N -3.78 4.16 -0.15 -1.02 1.01 -1.26 -0.76 121.20 119.40 2ajc s ILE 88 Ca 0.04 1.50 -0.04 0.00 0.00 0.00 0.00 60.65 62.15 2ajc s ILE 88 Cb 0.05 -3.96 -0.24 0.00 0.01 0.00 0.00 42.46 38.31 2ajc s ILE 88 CO -0.10 0.01 0.24 0.33 0.00 0.00 0.00 174.94 175.41 2ajc n PHE 89 N 5.13 0.98 -3.67 3.97 -0.00 0.20 -4.85 117.46 119.22 2ajc n PHE 89 Ca 0.11 0.21 -0.13 0.00 -0.00 0.00 0.00 57.45 57.64 2ajc n PHE 89 Cb 0.46 -1.13 -0.13 0.00 -0.00 0.00 0.00 39.48 38.68 2ajc n PHE 89 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 2ajc s LEU 90 N -6.91 -0.22 0.38 -2.13 2.96 -0.67 -4.98 118.68 107.10 2ajc s LEU 90 Ca -0.25 0.63 -0.25 0.00 -0.22 0.00 0.00 54.13 54.05 2ajc s LEU 90 Cb 0.07 0.79 -0.09 0.00 0.50 0.00 0.00 46.19 47.46 2ajc s LEU 90 CO 0.73 -0.23 1.02 -1.61 -1.32 0.00 0.00 176.35 174.95 2ajc s GLU 91 N 2.23 4.29 0.17 1.98 2.02 -1.26 -0.78 118.70 127.35 2ajc s GLU 91 Ca -0.01 1.46 0.16 0.00 0.02 0.00 0.00 54.97 56.61 2ajc s GLU 91 Cb -0.12 -2.62 0.77 0.00 0.10 0.00 0.00 34.13 32.27 2ajc s GLU 91 CO -0.09 -0.02 1.50 0.27 0.02 0.00 0.00 175.26 176.95 2ajc n ASN 92 N 0.11 0.37 -0.33 -0.19 0.23 -1.26 -1.70 115.26 112.50 2ajc n ASN 92 Ca 0.04 0.63 0.01 0.00 -0.53 0.00 0.00 54.58 54.73 2ajc n ASN 92 Cb 0.50 -0.69 0.18 0.00 -2.08 0.00 0.00 39.78 37.69 2ajc n ASN 92 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2ajc h SER 93 N 0.00 1.01 -0.97 0.53 0.02 -1.91 -1.21 113.55 111.02 2ajc h SER 93 Ca 0.00 -0.01 0.19 0.00 -0.84 0.00 0.00 61.79 61.13 2ajc h SER 93 Cb 0.16 -0.23 -0.11 0.00 0.14 0.00 0.00 62.40 62.36 2ajc h SER 93 CO 0.00 0.70 0.57 0.74 -1.14 0.00 0.00 176.83 177.70 2ajc h THR 94 N 1.18 0.68 -0.06 -2.27 2.02 -1.72 0.14 112.91 112.88 2ajc h THR 94 Ca 0.37 -0.24 -0.13 0.00 0.77 0.00 0.00 66.41 67.17 2ajc h THR 94 Cb 0.00 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.32 2ajc h THR 94 CO -0.11 0.13 -0.55 -0.26 0.37 0.00 0.00 175.52 175.09 2ajc h PHE 95 N 0.71 0.24 -0.47 3.16 0.04 -1.40 -2.60 116.94 116.62 2ajc h PHE 95 Ca 0.56 -0.08 -0.05 0.00 2.80 0.00 0.00 57.97 61.20 2ajc h PHE 95 Cb 0.89 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.97 2ajc h PHE 95 CO -0.03 0.70 0.10 -0.44 -0.60 0.00 0.00 178.31 178.05 2ajc h ASP 96 N 0.15 0.66 1.19 2.17 3.32 -0.50 -2.79 116.42 120.62 2ajc h ASP 96 Ca -0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 2ajc h ASP 96 Cb 1.02 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.40 2ajc h ASP 96 CO 0.08 0.66 0.00 -0.33 -1.72 0.00 0.00 179.24 177.94 2ajc h GLU 97 N 0.69 0.00 -0.45 3.56 5.08 -0.89 -3.35 114.58 119.22 2ajc h GLU 97 Ca 0.15 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.41 2ajc h GLU 97 Cb 0.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2ajc h GLU 97 CO -0.00 0.00 -0.11 -0.07 -1.00 0.00 0.00 179.01 177.83 2ajc h LEU 98 N 0.00 0.88 0.00 1.33 3.38 -1.31 -3.48 115.31 116.11 2ajc h LEU 98 Ca 0.00 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2ajc h LEU 98 Cb 0.59 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2ajc h LEU 98 CO 0.00 1.04 0.00 0.61 0.09 0.00 0.00 178.44 180.18 2ajc n GLY 99 N -0.21 0.75 3.44 0.83 0.00 -1.26 -5.05 105.19 103.69 2ajc n GLY 99 Ca -0.00 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 2ajc n GLY 99 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ajc s TYR 100 N -2.00 -0.54 -0.26 1.61 -0.85 -1.26 -5.10 117.35 108.94 2ajc s TYR 100 Ca 0.00 0.59 -0.29 0.00 -0.52 0.00 0.00 57.07 56.85 2ajc s TYR 100 Cb 0.00 0.46 -0.02 0.00 0.38 0.00 0.00 41.96 42.78 2ajc s TYR 100 CO 0.00 -0.73 1.51 -1.12 -1.52 0.00 0.00 175.55 173.69 2ajc s SER 101 N -2.10 6.46 -0.24 -0.18 0.01 -1.26 -4.95 113.70 111.44 2ajc s SER 101 Ca -0.04 1.44 -0.28 0.00 1.31 0.00 0.00 55.95 58.37 2ajc s SER 101 Cb -0.01 -2.53 0.01 0.00 0.21 0.00 0.00 66.02 63.70 2ajc s SER 101 CO -0.03 -1.22 1.01 -0.89 0.41 0.00 0.00 173.24 172.51 2ajc s THR 102 N 4.99 4.69 -0.01 1.44 2.01 -1.26 -4.52 115.64 122.97 2ajc s THR 102 Ca 0.66 1.93 0.11 0.00 0.31 0.00 0.00 61.69 64.71 2ajc s THR 102 Cb -0.22 -4.29 -0.14 0.00 0.01 0.00 0.00 72.50 67.87 2ajc s THR 102 CO 0.27 -0.19 1.11 -1.13 -0.69 0.00 0.00 174.62 174.00 2ajc h ASN 103 N 7.54 0.00 -5.41 3.53 -0.73 -1.33 -3.49 115.58 115.69 2ajc h ASN 103 Ca -0.20 0.00 0.27 0.00 1.87 0.00 0.00 56.30 58.24 2ajc h ASN 103 Cb 1.07 0.00 -0.12 0.00 0.27 0.00 0.00 38.32 39.54 2ajc h ASN 103 CO 0.97 0.82 0.72 -0.62 -0.37 0.00 0.00 177.43 178.95 2ajc s ASP 104 N -6.38 -0.11 0.09 1.15 2.15 -1.14 -5.01 116.67 107.42 2ajc s ASP 104 Ca -0.00 -0.18 -0.08 0.00 0.43 0.00 0.00 52.55 52.72 2ajc s ASP 104 Cb 0.09 0.26 -0.01 0.00 -0.30 0.00 0.00 42.92 42.96 2ajc s ASP 104 CO 0.80 -0.47 0.17 -0.72 -0.17 0.00 0.00 175.17 174.79 2ajc s TYR 105 N -2.69 0.21 -0.13 -5.34 -0.85 -1.26 -0.40 117.35 106.89 2ajc s TYR 105 Ca 0.13 -0.65 -0.05 0.00 -0.52 0.00 0.00 57.07 55.97 2ajc s TYR 105 Cb 0.02 -0.10 0.06 0.00 0.38 0.00 0.00 41.96 42.33 2ajc s TYR 105 CO -0.03 -0.54 0.28 0.45 -1.52 0.00 0.00 175.55 174.20 2ajc s SER 106 N -2.87 0.20 -0.02 -0.18 0.15 -0.60 -4.95 113.70 105.41 2ajc s SER 106 Ca 0.06 0.64 -0.23 0.00 0.70 0.00 0.00 55.95 57.11 2ajc s SER 106 Cb 0.05 0.74 -0.05 0.00 -1.71 0.00 0.00 66.02 65.05 2ajc s SER 106 CO -0.10 -0.23 0.70 -0.69 1.20 0.00 0.00 173.24 174.12 2ajc s VAL 107 N 2.28 4.92 0.53 4.45 1.01 -1.26 -0.31 120.40 132.01 2ajc s VAL 107 Ca -0.01 1.47 -0.22 0.00 0.00 0.00 0.00 61.98 63.22 2ajc s VAL 107 Cb -0.12 -4.05 -0.06 0.00 0.00 0.00 0.00 36.38 32.16 2ajc s VAL 107 CO -0.09 0.32 1.37 -1.54 0.00 0.00 0.00 175.10 175.15 2ajc n SER 108 N 3.29 2.80 -0.15 3.32 3.41 0.40 -4.88 113.62 121.79 2ajc n SER 108 Ca -0.03 1.01 0.12 0.00 -0.26 0.00 0.00 58.87 59.71 2ajc n SER 108 Cb 0.51 -1.58 0.45 0.00 -0.26 0.00 0.00 64.21 63.33 2ajc n SER 108 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2ajc h PRO 109 N 1.60 0.51 -0.03 4.33 0.13 -1.81 0.24 132.00 136.97 2ajc h PRO 109 Ca -0.51 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2ajc h PRO 109 Cb 1.30 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2ajc h PRO 109 CO 0.58 0.34 0.00 -0.40 -0.23 0.00 0.00 178.00 178.29 2ajc n ASP 110 N -4.49 0.24 -2.05 1.44 5.68 -1.05 -4.84 116.55 111.49 2ajc n ASP 110 Ca 0.12 -1.61 -0.20 0.00 -0.50 0.00 0.00 54.79 52.60 2ajc n ASP 110 Cb 0.40 -0.02 -0.04 0.00 -1.14 0.00 0.00 41.12 40.31 2ajc n ASP 110 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2ajc n ARG 111 N -0.55 -1.60 0.03 0.11 1.74 0.85 -4.88 116.66 112.35 2ajc n ARG 111 Ca 0.11 1.08 0.09 0.00 -0.77 0.00 0.00 57.85 58.36 2ajc n ARG 111 Cb 0.09 -5.62 -0.10 0.00 -1.02 0.00 0.00 32.46 25.81 2ajc n ARG 111 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2ajc n GLN 112 N -2.72 0.64 -4.14 5.56 6.02 -1.26 -4.88 117.38 116.61 2ajc n GLN 112 Ca -0.23 -0.03 -0.09 0.00 -0.01 0.00 0.00 57.00 56.64 2ajc n GLN 112 Cb 0.68 -1.66 -0.10 0.00 1.02 0.00 0.00 30.24 30.18 2ajc n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2ajc s PHE 113 N -3.35 0.74 0.00 1.08 0.08 -1.26 -0.76 117.98 114.51 2ajc s PHE 113 Ca -0.05 -1.02 0.01 0.00 0.12 0.00 0.00 56.93 55.98 2ajc s PHE 113 Cb 0.11 -0.47 -0.00 0.00 -0.57 0.00 0.00 43.02 42.10 2ajc s PHE 113 CO 0.85 -0.29 -0.02 -1.50 -0.10 0.00 0.00 175.22 174.16 2ajc s ILE 114 N -3.80 0.14 -0.15 0.64 2.07 -0.60 -0.46 121.20 119.04 2ajc s ILE 114 Ca 0.11 -0.13 -0.08 0.00 -1.41 0.00 0.00 60.65 59.15 2ajc s ILE 114 Cb 0.07 -0.14 -0.04 0.00 0.13 0.00 0.00 42.46 42.48 2ajc s ILE 114 CO -0.06 0.01 0.13 -0.22 -1.91 0.00 0.00 174.94 172.88 2ajc s LEU 115 N -0.13 4.25 -0.16 8.50 2.96 0.57 -0.47 118.68 134.19 2ajc s LEU 115 Ca -0.00 0.34 -0.00 0.00 -0.22 0.00 0.00 54.13 54.25 2ajc s LEU 115 Cb -0.01 -2.06 -0.00 0.00 0.50 0.00 0.00 46.19 44.61 2ajc s LEU 115 CO -0.00 0.31 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.85 2ajc s PHE 116 N -0.43 2.82 -0.19 5.38 2.99 0.07 -1.56 117.98 127.05 2ajc s PHE 116 Ca 0.12 -0.99 -0.08 0.00 0.00 0.00 0.00 56.93 55.97 2ajc s PHE 116 Cb -0.12 -1.92 -0.04 0.00 0.00 0.00 0.00 43.02 40.94 2ajc s PHE 116 CO 0.01 -0.46 0.08 -2.00 -0.00 0.00 0.00 175.22 172.86 2ajc s GLU 117 N 0.87 4.03 0.29 0.44 2.12 0.47 -1.58 118.70 125.34 2ajc s GLU 117 Ca -0.04 -0.31 -0.03 0.00 0.36 0.00 0.00 54.97 54.96 2ajc s GLU 117 Cb -0.15 -3.28 -0.01 0.00 0.26 0.00 0.00 34.13 30.94 2ajc s GLU 117 CO -0.01 0.26 0.36 1.52 -0.54 0.00 0.00 175.26 176.85 2ajc s TYR 118 N 0.44 1.07 -1.35 5.30 1.13 -0.55 -0.78 117.35 122.61 2ajc s TYR 118 Ca 0.05 -1.26 -0.07 0.00 -1.41 0.00 0.00 57.07 54.37 2ajc s TYR 118 Cb -0.12 -0.25 0.02 0.00 -1.10 0.00 0.00 41.96 40.51 2ajc s TYR 118 CO -0.00 -0.95 1.09 0.09 -2.51 0.00 0.00 175.55 173.27 2ajc n ASN 119 N -0.97 -4.92 -4.71 -0.18 3.02 -1.26 -0.37 115.26 105.87 2ajc n ASN 119 Ca 0.02 -0.61 -0.42 0.00 -0.03 0.00 0.00 54.58 53.54 2ajc n ASN 119 Cb 0.63 -4.84 -0.03 0.00 -0.61 0.00 0.00 39.78 34.92 2ajc n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2ajc s TYR 120 N -3.35 2.78 -0.18 3.10 5.04 -1.26 -4.32 117.35 119.16 2ajc s TYR 120 Ca 0.44 0.46 -0.01 0.00 -2.44 0.00 0.00 57.07 55.52 2ajc s TYR 120 Cb -0.20 -3.97 0.05 0.00 0.35 0.00 0.00 41.96 38.20 2ajc s TYR 120 CO 0.75 -3.71 -0.01 0.08 -1.34 0.00 0.00 175.55 171.31 2ajc s VAL 121 N 1.76 0.89 0.42 3.14 1.01 -0.49 -5.00 120.40 122.13 2ajc s VAL 121 Ca 0.72 -0.63 -0.25 0.00 0.00 0.00 0.00 61.98 61.82 2ajc s VAL 121 Cb -0.43 -1.20 -0.08 0.00 0.00 0.00 0.00 36.38 34.67 2ajc s VAL 121 CO 0.32 -0.02 1.24 -0.75 0.00 0.00 0.00 175.10 175.88 2ajc s LYS 122 N 1.71 3.93 0.00 2.72 2.20 -1.26 -1.30 119.74 127.74 2ajc s LYS 122 Ca -0.01 2.00 0.00 0.00 -0.36 0.00 0.00 55.97 57.60 2ajc s LYS 122 Cb -0.16 -2.66 0.00 0.00 -1.51 0.00 0.00 37.83 33.50 2ajc s LYS 122 CO -0.07 -0.47 0.00 0.94 -0.36 0.00 0.00 175.35 175.39 2ajc n GLN 123 N -0.02 0.00 0.00 4.03 7.27 0.53 -4.89 117.38 124.30 2ajc n GLN 123 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.12 2ajc n GLN 123 Cb 0.45 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.10 2ajc n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 2ajc n TRP 124 N 0.00 0.00 -0.10 3.69 5.03 -1.16 -4.94 117.44 119.96 2ajc n TRP 124 Ca 0.00 0.00 0.01 0.00 3.03 0.00 0.00 57.50 60.54 2ajc n TRP 124 Cb 0.00 0.00 0.30 0.00 -1.03 0.00 0.00 31.31 30.58 2ajc n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 2ajc h ARG 125 N 0.00 0.75 0.00 -0.99 2.43 -1.98 -3.36 114.38 111.23 2ajc h ARG 125 Ca 0.00 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2ajc h ARG 125 Cb 0.00 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 2ajc h ARG 125 CO 0.00 0.56 -0.97 0.72 -1.51 0.00 0.00 179.97 178.77 2ajc n HIS 126 N -4.39 0.00 -2.52 2.20 8.25 -1.26 -5.07 115.22 112.43 2ajc n HIS 126 Ca 0.05 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.17 2ajc n HIS 126 Cb 0.11 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.18 2ajc n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2ajc s SER 127 N -2.84 6.41 0.13 0.41 1.04 -1.26 -4.72 113.70 112.87 2ajc s SER 127 Ca 0.00 1.83 -0.26 0.00 0.48 0.00 0.00 55.95 58.01 2ajc s SER 127 Cb 0.00 -2.55 0.07 0.00 0.10 0.00 0.00 66.02 63.64 2ajc s SER 127 CO 0.00 -0.73 0.96 -0.72 0.98 0.00 0.00 173.24 173.73 2ajc s TYR 128 N -2.14 -0.16 0.24 5.02 -0.85 -1.26 -0.35 117.35 117.85 2ajc s TYR 128 Ca 0.65 -0.12 0.10 0.00 -0.52 0.00 0.00 57.07 57.18 2ajc s TYR 128 Cb -0.14 0.62 -0.05 0.00 0.38 0.00 0.00 41.96 42.77 2ajc s TYR 128 CO 0.22 -0.78 -0.17 0.95 -1.52 0.00 0.00 175.55 174.25 2ajc s THR 129 N -3.24 2.07 0.24 -3.49 -4.23 -0.42 -4.59 115.64 101.98 2ajc s THR 129 Ca 0.11 -2.30 -0.22 0.00 -1.18 0.00 0.00 61.69 58.10 2ajc s THR 129 Cb -0.01 -2.16 0.04 0.00 1.34 0.00 0.00 72.50 71.71 2ajc s THR 129 CO 0.01 -0.51 0.83 0.00 -0.54 0.00 0.00 174.62 174.41 2ajc s ALA 130 N -2.76 -1.35 0.16 3.99 0.00 -0.32 -1.39 121.76 120.07 2ajc s ALA 130 Ca 0.26 -0.19 0.04 0.00 0.00 0.00 0.00 51.96 52.06 2ajc s ALA 130 Cb -0.03 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.81 2ajc s ALA 130 CO 0.11 -1.04 0.21 -1.12 0.00 0.00 0.00 175.76 173.92 2ajc s SER 131 N -2.97 5.91 -0.03 0.00 0.01 0.50 -1.32 113.70 115.80 2ajc s SER 131 Ca 0.12 0.01 -0.03 0.00 1.31 0.00 0.00 55.95 57.36 2ajc s SER 131 Cb -0.04 -1.67 0.01 0.00 0.21 0.00 0.00 66.02 64.53 2ajc s SER 131 CO 0.06 0.06 0.09 -0.31 0.41 0.00 0.00 173.24 173.54 2ajc s TYR 132 N -1.76 -0.09 0.11 2.43 1.51 -1.26 -1.48 117.35 116.82 2ajc s TYR 132 Ca 0.33 0.22 0.09 0.00 -1.01 0.00 0.00 57.07 56.70 2ajc s TYR 132 Cb -0.10 0.03 -0.04 0.00 -0.11 0.00 0.00 41.96 41.73 2ajc s TYR 132 CO 0.26 -0.06 -0.21 -0.51 -1.11 0.00 0.00 175.55 173.92 2ajc s ASP 133 N -0.02 3.68 -0.14 2.29 1.01 -0.62 -4.17 116.67 118.71 2ajc s ASP 133 Ca -0.01 -0.60 -0.01 0.00 0.71 0.00 0.00 52.55 52.64 2ajc s ASP 133 Cb -0.01 -0.45 -0.02 0.00 1.01 0.00 0.00 42.92 43.45 2ajc s ASP 133 CO 0.00 0.19 -0.10 -0.63 0.21 0.00 0.00 175.17 174.85 2ajc s ILE 134 N -1.08 3.36 -0.17 0.77 1.01 -1.26 -0.75 121.20 123.08 2ajc s ILE 134 Ca 0.16 -0.55 -0.02 0.00 0.00 0.00 0.00 60.65 60.24 2ajc s ILE 134 Cb -0.10 -2.44 -0.01 0.00 0.01 0.00 0.00 42.46 39.92 2ajc s ILE 134 CO 0.08 0.51 -0.09 -0.47 0.00 0.00 0.00 174.94 174.97 2ajc s TYR 135 N 0.35 2.89 -0.32 3.97 5.04 0.37 -0.69 117.35 128.97 2ajc s TYR 135 Ca -0.08 -0.72 -0.29 0.00 -2.44 0.00 0.00 57.07 53.53 2ajc s TYR 135 Cb -0.15 -1.95 0.02 0.00 0.35 0.00 0.00 41.96 40.22 2ajc s TYR 135 CO 0.05 -0.32 1.08 0.34 -1.34 0.00 0.00 175.55 175.36 2ajc s ASP 136 N 0.76 6.93 0.40 4.32 -1.08 0.45 -1.56 116.67 126.89 2ajc s ASP 136 Ca -0.04 1.05 0.26 0.00 -0.52 0.00 0.00 52.55 53.30 2ajc s ASP 136 Cb -0.15 -2.54 0.66 0.00 -1.46 0.00 0.00 42.92 39.43 2ajc s ASP 136 CO 0.02 -0.88 1.72 -0.07 0.52 0.00 0.00 175.17 176.47 2ajc h LEU 137 N 10.10 0.00 0.14 -1.34 3.38 -1.24 0.13 115.31 126.49 2ajc h LEU 137 Ca -0.21 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 2ajc h LEU 137 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2ajc h LEU 137 CO 1.03 0.00 -0.07 0.78 0.09 0.00 0.00 178.44 180.27 2ajc h ASN 138 N 0.00 -0.16 -0.22 -0.43 2.35 -1.91 -3.31 115.58 111.89 2ajc h ASN 138 Ca 0.00 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2ajc h ASN 138 Cb 0.82 0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.23 2ajc h ASN 138 CO 0.00 0.27 0.00 2.29 -1.65 0.00 0.00 177.43 178.34 2ajc n LYS 139 N -4.70 1.55 -3.71 0.81 2.85 -1.25 -4.92 118.16 108.79 2ajc n LYS 139 Ca -0.02 -0.81 -0.22 0.00 -1.05 0.00 0.00 58.31 56.21 2ajc n LYS 139 Cb 0.08 -1.20 -0.05 0.00 -0.65 0.00 0.00 35.03 33.21 2ajc n LYS 139 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2ajc n ARG 140 N 0.15 -0.88 -4.19 -1.58 1.74 -0.01 -4.92 116.66 106.98 2ajc n ARG 140 Ca 0.07 0.02 -0.16 0.00 -0.77 0.00 0.00 57.85 57.02 2ajc n ARG 140 Cb 0.20 -2.08 -0.11 0.00 -1.02 0.00 0.00 32.46 29.45 2ajc n ARG 140 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2ajc s GLN 141 N -5.94 0.89 0.06 5.56 -0.21 -0.95 -4.98 119.66 114.09 2ajc s GLN 141 Ca 0.06 -1.17 -0.24 0.00 0.02 0.00 0.00 55.36 54.03 2ajc s GLN 141 Cb -0.03 -0.65 -0.06 0.00 1.00 0.00 0.00 33.01 33.26 2ajc s GLN 141 CO 0.63 0.11 0.72 -1.17 -2.12 0.00 0.00 175.29 173.46 2ajc s LEU 142 N -2.40 4.48 0.01 2.90 0.20 -1.26 -0.41 118.68 122.19 2ajc s LEU 142 Ca 0.06 1.41 -0.30 0.00 0.69 0.00 0.00 54.13 55.99 2ajc s LEU 142 Cb -0.04 -3.15 -0.04 0.00 -0.43 0.00 0.00 46.19 42.53 2ajc s LEU 142 CO 0.01 0.09 1.06 -0.63 -0.29 0.00 0.00 176.35 176.60 2ajc s ILE 143 N -0.39 4.57 -0.13 6.68 1.09 0.14 -4.90 121.20 128.26 2ajc s ILE 143 Ca 0.36 1.84 0.02 0.00 -1.10 0.00 0.00 60.65 61.76 2ajc s ILE 143 Cb -0.20 -4.18 -0.00 0.00 -1.06 0.00 0.00 42.46 37.01 2ajc s ILE 143 CO 0.22 0.13 0.26 0.35 -0.10 0.00 0.00 174.94 175.79 2ajc n THR 144 N 3.99 0.00 -3.71 2.92 -2.24 -1.26 -4.56 114.28 109.41 2ajc n THR 144 Ca 0.07 -0.48 -0.35 0.00 -2.27 0.00 0.00 64.05 61.02 2ajc n THR 144 Cb 0.49 1.01 -0.05 0.00 -2.10 0.00 0.00 70.33 69.68 2ajc n THR 144 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2ajc s GLU 145 N -0.75 3.63 -1.43 -0.78 0.41 -1.26 -4.46 118.70 114.06 2ajc s GLU 145 Ca 0.01 0.01 -0.02 0.00 -0.41 0.00 0.00 54.97 54.56 2ajc s GLU 145 Cb 0.01 -3.09 0.00 0.00 -1.78 0.00 0.00 34.13 29.27 2ajc s GLU 145 CO 0.05 0.65 0.32 0.39 -0.49 0.00 0.00 175.26 176.17 2ajc n GLU 146 N 1.23 -2.48 -1.18 1.61 -0.58 -1.26 -4.69 120.64 113.29 2ajc n GLU 146 Ca -0.12 0.31 -0.32 0.00 -0.42 0.00 0.00 57.16 56.62 2ajc n GLU 146 Cb 0.53 -4.19 0.11 0.00 -0.57 0.00 0.00 31.44 27.31 2ajc n GLU 146 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2ajc s ARG 147 N -6.79 1.95 0.24 3.49 0.52 -1.26 -4.86 118.95 112.24 2ajc s ARG 147 Ca 0.03 1.38 -0.30 0.00 -0.52 0.00 0.00 55.73 56.32 2ajc s ARG 147 Cb -0.01 -1.85 -0.09 0.00 0.52 0.00 0.00 34.95 33.52 2ajc s ARG 147 CO 0.92 -1.91 1.20 0.42 0.02 0.00 0.00 175.30 175.96 2ajc s ILE 148 N -2.66 3.34 0.81 1.52 1.01 -1.26 -4.99 121.20 118.97 2ajc s ILE 148 Ca 0.65 1.23 -0.13 0.00 0.00 0.00 0.00 60.65 62.40 2ajc s ILE 148 Cb -0.21 -3.78 0.08 0.00 0.01 0.00 0.00 42.46 38.57 2ajc s ILE 148 CO 0.53 0.24 1.18 -2.84 0.00 0.00 0.00 174.94 174.06 2ajc s PRO 149 N -0.89 1.70 0.80 2.79 0.02 -1.26 -4.57 135.00 133.58 2ajc s PRO 149 Ca 0.50 1.64 -0.12 0.00 0.02 0.00 0.00 61.00 63.05 2ajc s PRO 149 Cb -0.34 -1.79 0.07 0.00 0.02 0.00 0.00 34.50 32.45 2ajc s PRO 149 CO 0.41 -2.15 1.12 -0.80 -0.33 0.00 0.00 177.00 175.26 2ajc s ASN 150 N -2.37 4.57 -1.92 2.53 -0.87 -1.26 -3.73 114.94 111.89 2ajc s ASN 150 Ca 0.71 1.07 0.00 0.00 -1.57 0.00 0.00 52.86 53.07 2ajc s ASN 150 Cb -0.26 -1.74 0.00 0.00 -0.02 0.00 0.00 41.25 39.23 2ajc s ASN 150 CO 0.51 -1.90 0.00 0.59 -2.57 0.00 0.00 177.10 173.74 2ajc n ASN 151 N -3.35 -5.60 -4.75 -1.22 3.02 -1.15 -4.94 115.26 97.27 2ajc n ASN 151 Ca 0.07 0.22 -0.41 0.00 -0.03 0.00 0.00 54.58 54.43 2ajc n ASN 151 Cb 0.58 -4.74 -0.03 0.00 -0.61 0.00 0.00 39.78 34.99 2ajc n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2ajc s THR 152 N -2.89 3.14 -0.03 3.41 2.01 -0.43 -4.62 115.64 116.23 2ajc s THR 152 Ca 0.00 0.99 0.09 0.00 0.31 0.00 0.00 61.69 63.08 2ajc s THR 152 Cb 0.00 -3.63 -0.23 0.00 0.01 0.00 0.00 72.50 68.64 2ajc s THR 152 CO 0.00 0.17 0.72 1.56 -0.69 0.00 0.00 174.62 176.38 2ajc h GLN 153 N 4.81 0.04 -1.92 4.92 4.20 -1.22 -0.85 115.11 125.09 2ajc h GLN 153 Ca -0.46 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.16 2ajc h GLN 153 Cb 1.22 0.02 -0.21 0.00 0.30 0.00 0.00 27.48 28.81 2ajc h GLN 153 CO 0.74 0.65 0.23 -0.46 -0.67 0.00 0.00 178.83 179.32 2ajc s TRP 154 N -2.61 -0.66 -0.12 2.96 -0.11 -1.22 -4.64 118.94 112.53 2ajc s TRP 154 Ca -0.06 1.40 -0.17 0.00 1.22 0.00 0.00 56.10 58.49 2ajc s TRP 154 Cb 0.08 0.35 0.04 0.00 -1.50 0.00 0.00 33.47 32.45 2ajc s TRP 154 CO 0.82 -0.45 0.44 -1.50 -4.62 0.00 0.00 176.95 171.64 2ajc s ILE 155 N -0.41 0.01 -0.12 5.86 2.07 -1.26 -0.12 121.20 127.24 2ajc s ILE 155 Ca -0.04 -0.11 -0.17 0.00 -1.41 0.00 0.00 60.65 58.92 2ajc s ILE 155 Cb -0.03 -0.67 0.04 0.00 0.13 0.00 0.00 42.46 41.94 2ajc s ILE 155 CO 0.04 -0.06 0.43 0.28 -1.91 0.00 0.00 174.94 173.73 2ajc s THR 156 N -0.25 0.01 0.71 4.00 -1.32 -0.23 -5.01 115.64 113.57 2ajc s THR 156 Ca -0.04 -0.12 -0.11 0.00 -1.21 0.00 0.00 61.69 60.21 2ajc s THR 156 Cb -0.03 -0.66 0.02 0.00 -1.51 0.00 0.00 72.50 70.32 2ajc s THR 156 CO 0.02 -0.07 1.07 0.26 -2.21 0.00 0.00 174.62 173.69 2ajc s TRP 157 N -0.29 3.08 0.93 9.09 0.52 -1.26 -1.62 118.94 129.39 2ajc s TRP 157 Ca -0.04 1.37 -0.12 0.00 0.02 0.00 0.00 56.10 57.33 2ajc s TRP 157 Cb -0.03 -2.92 0.15 0.00 -1.15 0.00 0.00 33.47 29.52 2ajc s TRP 157 CO 0.02 -1.31 1.09 -1.54 0.02 0.00 0.00 176.95 175.24 2ajc s SER 158 N -3.82 3.23 0.51 2.95 1.04 0.28 -4.87 113.70 113.02 2ajc s SER 158 Ca 0.58 1.38 0.33 0.00 0.48 0.00 0.00 55.95 58.72 2ajc s SER 158 Cb -0.14 -2.05 1.39 0.00 0.10 0.00 0.00 66.02 65.32 2ajc s SER 158 CO 0.55 -2.78 1.97 -0.65 0.98 0.00 0.00 173.24 173.31 2ajc h PRO 159 N -1.65 0.00 -4.45 4.02 0.11 -1.81 -3.43 132.00 124.80 2ajc h PRO 159 Ca -0.51 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.42 2ajc h PRO 159 Cb 1.30 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.25 2ajc h PRO 159 CO 0.56 0.00 -0.69 0.14 -0.21 0.00 0.00 178.00 177.80 2ajc s VAL 160 N -3.65 0.46 0.00 3.15 -7.23 -1.26 -4.80 120.40 107.07 2ajc s VAL 160 Ca 0.01 -1.81 0.00 0.00 -1.81 0.00 0.00 61.98 58.37 2ajc s VAL 160 Cb 0.09 -1.52 0.00 0.00 0.56 0.00 0.00 36.38 35.52 2ajc s VAL 160 CO 0.50 -0.89 0.00 0.61 -0.31 0.00 0.00 175.10 175.01 2ajc n GLY 161 N 0.15 1.36 2.25 2.32 0.00 -1.26 -4.39 105.19 105.62 2ajc n GLY 161 Ca -0.14 -0.71 -0.01 0.00 0.00 0.00 0.00 46.02 45.16 2ajc n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2ajc n HIS 162 N 11.77 0.00 -2.02 1.61 1.44 -1.26 -2.52 115.22 124.24 2ajc n HIS 162 Ca 0.00 -1.45 -0.32 0.00 -2.01 0.00 0.00 57.72 53.94 2ajc n HIS 162 Cb 0.00 0.32 0.01 0.00 0.12 0.00 0.00 29.99 30.44 2ajc n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2ajc s LYS 163 N -1.50 3.45 0.01 -1.40 1.02 -1.26 -4.67 119.74 115.40 2ajc s LYS 163 Ca 0.21 1.02 0.04 0.00 0.02 0.00 0.00 55.97 57.26 2ajc s LYS 163 Cb 0.32 -2.06 -0.02 0.00 -0.52 0.00 0.00 37.83 35.56 2ajc s LYS 163 CO -0.09 -0.69 -0.14 -0.51 -0.92 0.00 0.00 175.35 173.00 2ajc s LEU 164 N -4.69 2.10 -0.01 3.17 1.43 -0.23 -0.56 118.68 119.89 2ajc s LEU 164 Ca 0.60 -0.35 0.04 0.00 -1.03 0.00 0.00 54.13 53.40 2ajc s LEU 164 Cb -0.13 -0.65 -0.01 0.00 0.03 0.00 0.00 46.19 45.43 2ajc s LEU 164 CO 0.41 0.10 -0.14 0.00 0.23 0.00 0.00 176.35 176.96 2ajc s ALA 165 N -0.57 1.14 0.09 4.21 0.00 -0.64 -0.15 121.76 125.84 2ajc s ALA 165 Ca 0.03 -0.59 -0.12 0.00 0.00 0.00 0.00 51.96 51.29 2ajc s ALA 165 Cb -0.06 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2ajc s ALA 165 CO 0.00 0.28 0.27 1.52 0.00 0.00 0.00 175.76 177.83 2ajc s TYR 166 N -0.31 -0.00 -0.11 0.00 -0.85 -0.24 -1.06 117.35 114.78 2ajc s TYR 166 Ca 0.05 -0.35 0.00 0.00 -0.52 0.00 0.00 57.07 56.26 2ajc s TYR 166 Cb -0.05 0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.33 2ajc s TYR 166 CO -0.00 -0.59 -0.12 0.08 -1.52 0.00 0.00 175.55 173.40 2ajc s VAL 167 N -3.64 3.21 -0.07 -3.49 1.01 0.84 -1.18 120.40 117.07 2ajc s VAL 167 Ca 0.03 -0.62 -0.04 0.00 0.00 0.00 0.00 61.98 61.35 2ajc s VAL 167 Cb 0.03 -2.33 0.04 0.00 0.00 0.00 0.00 36.38 34.12 2ajc s VAL 167 CO -0.10 0.54 0.17 0.86 0.00 0.00 0.00 175.10 176.57 2ajc s TRP 168 N 0.00 -0.20 -1.50 5.22 -0.00 -0.08 -0.81 118.94 121.57 2ajc s TRP 168 Ca -0.03 0.54 -0.12 0.00 -0.00 0.00 0.00 56.10 56.49 2ajc s TRP 168 Cb -0.14 -0.04 0.07 0.00 -0.00 0.00 0.00 33.47 33.36 2ajc s TRP 168 CO 0.04 -0.17 0.95 0.09 -0.00 0.00 0.00 176.95 177.85 2ajc n ASN 169 N 4.09 -4.35 -0.47 5.86 5.03 -1.26 -1.64 115.26 122.52 2ajc n ASN 169 Ca -0.25 -0.78 -0.06 0.00 0.87 0.00 0.00 54.58 54.36 2ajc n ASN 169 Cb 0.53 -3.91 -0.03 0.00 -1.02 0.00 0.00 39.78 35.35 2ajc n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2ajc n ASN 170 N -2.87 -5.07 -4.35 6.41 5.03 -1.26 -4.41 115.26 108.74 2ajc n ASN 170 Ca -0.00 0.15 -0.25 0.00 0.87 0.00 0.00 54.58 55.34 2ajc n ASN 170 Cb 0.55 -3.10 -0.12 0.00 -1.02 0.00 0.00 39.78 36.08 2ajc n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2ajc s ASP 171 N -2.33 2.95 0.10 6.41 1.01 -0.65 -1.71 116.67 122.45 2ajc s ASP 171 Ca 0.00 -0.78 -0.14 0.00 0.71 0.00 0.00 52.55 52.34 2ajc s ASP 171 Cb 0.00 -0.19 -0.06 0.00 1.01 0.00 0.00 42.92 43.68 2ajc s ASP 171 CO 0.00 0.08 0.50 -0.63 0.21 0.00 0.00 175.17 175.33 2ajc s ILE 172 N -1.45 4.92 0.00 0.77 1.01 -1.26 -0.90 121.20 124.29 2ajc s ILE 172 Ca 0.13 0.80 0.01 0.00 0.00 0.00 0.00 60.65 61.59 2ajc s ILE 172 Cb -0.09 -3.73 -0.00 0.00 0.01 0.00 0.00 42.46 38.65 2ajc s ILE 172 CO 0.06 0.34 -0.03 -0.31 0.00 0.00 0.00 174.94 175.01 2ajc s TYR 173 N -1.35 0.25 -0.09 3.97 1.51 -0.32 -0.51 117.35 120.80 2ajc s TYR 173 Ca 0.34 -0.11 0.04 0.00 -1.01 0.00 0.00 57.07 56.33 2ajc s TYR 173 Cb -0.16 -0.16 0.00 0.00 -0.11 0.00 0.00 41.96 41.54 2ajc s TYR 173 CO 0.18 -0.02 -0.21 0.08 -1.11 0.00 0.00 175.55 174.47 2ajc s VAL 174 N -0.25 1.81 -0.28 0.71 1.01 -0.26 -1.07 120.40 122.05 2ajc s VAL 174 Ca -0.01 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.09 2ajc s VAL 174 Cb -0.02 -1.57 0.05 0.00 0.00 0.00 0.00 36.38 34.84 2ajc s VAL 174 CO -0.00 0.50 -0.04 -0.54 0.00 0.00 0.00 175.10 175.02 2ajc s LYS 175 N 0.37 2.35 0.25 2.72 1.02 0.78 -0.19 119.74 127.04 2ajc s LYS 175 Ca -0.16 -1.31 0.05 0.00 0.02 0.00 0.00 55.97 54.58 2ajc s LYS 175 Cb -0.17 -3.06 0.31 0.00 -0.52 0.00 0.00 37.83 34.38 2ajc s LYS 175 CO 0.07 -0.60 1.60 -0.91 -0.92 0.00 0.00 175.35 174.58 2ajc h ASN 176 N 7.90 0.24 -3.88 2.83 -0.26 -1.85 -0.59 115.58 119.98 2ajc h ASN 176 Ca -0.20 -0.13 -0.42 0.00 -0.56 0.00 0.00 56.30 54.99 2ajc h ASN 176 Cb 1.05 -0.07 -0.30 0.00 -1.06 0.00 0.00 38.32 37.94 2ajc h ASN 176 CO 0.50 0.75 -0.79 -1.61 -1.06 0.00 0.00 177.43 175.23 2ajc s GLU 177 N -3.84 0.92 0.45 0.81 0.41 -1.26 -4.37 118.70 111.82 2ajc s GLU 177 Ca -0.04 -0.32 0.22 0.00 -0.41 0.00 0.00 54.97 54.43 2ajc s GLU 177 Cb 0.12 -0.87 1.21 0.00 -1.78 0.00 0.00 34.13 32.82 2ajc s GLU 177 CO 0.79 0.14 1.83 -1.35 -0.49 0.00 0.00 175.26 176.18 2ajc h PRO 178 N 6.26 0.28 -0.02 0.39 0.11 -1.85 -0.87 132.00 136.31 2ajc h PRO 178 Ca -0.33 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2ajc h PRO 178 Cb 1.17 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2ajc h PRO 178 CO 0.49 0.18 -0.13 0.27 -0.21 0.00 0.00 178.00 178.60 2ajc n ASN 179 N -4.47 1.98 -4.94 -2.05 6.94 -1.26 -4.82 115.26 106.64 2ajc n ASN 179 Ca 0.21 -1.55 -0.25 0.00 -0.02 0.00 0.00 54.58 52.97 2ajc n ASN 179 Cb 0.85 0.11 -0.03 0.00 -2.36 0.00 0.00 39.78 38.36 2ajc n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2ajc s LEU 180 N -2.18 4.24 0.54 -4.53 2.01 -0.33 -4.63 118.68 113.80 2ajc s LEU 180 Ca 0.29 0.30 -0.21 0.00 0.01 0.00 0.00 54.13 54.52 2ajc s LEU 180 Cb 0.20 -3.08 -0.05 0.00 0.01 0.00 0.00 46.19 43.27 2ajc s LEU 180 CO 0.40 -0.06 1.23 -0.55 1.01 0.00 0.00 176.35 178.37 2ajc s SER 181 N -3.46 5.53 0.54 2.29 0.15 -1.26 -4.76 113.70 112.73 2ajc s SER 181 Ca 0.37 2.44 -0.08 0.00 0.70 0.00 0.00 55.95 59.38 2ajc s SER 181 Cb -0.10 -2.61 -0.04 0.00 -1.71 0.00 0.00 66.02 61.56 2ajc s SER 181 CO 0.30 -1.36 0.90 -0.94 1.20 0.00 0.00 173.24 173.33 2ajc s SER 182 N -1.38 6.26 -0.21 5.45 1.04 -1.26 -4.74 113.70 118.86 2ajc s SER 182 Ca 0.72 1.16 -0.05 0.00 0.48 0.00 0.00 55.95 58.26 2ajc s SER 182 Cb -0.32 -2.35 -0.02 0.00 0.10 0.00 0.00 66.02 63.43 2ajc s SER 182 CO 0.37 -0.70 -0.01 -1.58 0.98 0.00 0.00 173.24 172.29 2ajc s GLN 183 N -4.90 3.53 0.22 4.02 2.00 0.73 -4.91 119.66 120.35 2ajc s GLN 183 Ca 0.51 -0.56 -0.30 0.00 -2.00 0.00 0.00 55.36 53.02 2ajc s GLN 183 Cb -0.11 -3.06 -0.08 0.00 0.80 0.00 0.00 33.01 30.56 2ajc s GLN 183 CO 0.48 -0.06 1.12 0.50 -0.50 0.00 0.00 175.29 176.83 2ajc s ARG 184 N 1.18 4.59 -0.18 1.67 3.52 -1.26 -1.11 118.95 127.36 2ajc s ARG 184 Ca 0.03 1.78 0.07 0.00 -0.13 0.00 0.00 55.73 57.48 2ajc s ARG 184 Cb -0.14 -3.24 -0.16 0.00 -1.56 0.00 0.00 34.95 29.85 2ajc s ARG 184 CO 0.01 0.10 -0.07 -0.89 -0.81 0.00 0.00 175.30 173.63 2ajc n ILE 185 N 1.93 1.10 -4.24 4.11 2.08 0.33 -4.95 119.36 119.72 2ajc n ILE 185 Ca 0.01 -0.53 -0.21 0.00 0.56 0.00 0.00 62.75 62.58 2ajc n ILE 185 Cb 0.45 -0.93 -0.12 0.00 -0.75 0.00 0.00 39.64 38.30 2ajc n ILE 185 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 2ajc s THR 186 N -2.39 1.44 0.00 1.39 -4.23 -1.22 -4.96 115.64 105.67 2ajc s THR 186 Ca -0.18 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 2ajc s THR 186 Cb 0.06 -1.41 0.00 0.00 1.34 0.00 0.00 72.50 72.49 2ajc s THR 186 CO 0.54 -0.21 0.56 0.79 -0.54 0.00 0.00 174.62 175.75 2ajc n TRP 187 N 0.98 0.00 1.14 3.99 7.02 -1.26 -4.54 117.44 124.76 2ajc n TRP 187 Ca -0.19 -0.13 0.12 0.00 -1.02 0.00 0.00 57.50 56.28 2ajc n TRP 187 Cb 0.55 -0.01 0.22 0.00 -2.42 0.00 0.00 31.31 29.64 2ajc n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2ajc n THR 188 N -0.13 0.00 -1.60 -0.99 -2.24 -1.26 -4.97 114.28 103.08 2ajc n THR 188 Ca 0.00 -0.16 -0.48 0.00 -2.27 0.00 0.00 64.05 61.14 2ajc n THR 188 Cb 0.15 0.71 -0.04 0.00 -2.10 0.00 0.00 70.33 69.05 2ajc n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ajc n GLY 189 N 1.38 0.27 3.36 3.38 0.00 -1.26 -4.66 105.19 107.67 2ajc n GLY 189 Ca 0.10 0.56 -0.08 0.00 0.00 0.00 0.00 46.02 46.60 2ajc n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ajc s LYS 190 N -0.21 0.42 0.01 1.61 2.20 -0.51 -4.91 119.74 118.35 2ajc s LYS 190 Ca 0.74 1.05 -0.38 0.00 -0.36 0.00 0.00 55.97 57.02 2ajc s LYS 190 Cb -0.83 0.30 -0.18 0.00 -1.51 0.00 0.00 37.83 35.61 2ajc s LYS 190 CO 0.50 -0.21 1.29 -1.91 -0.36 0.00 0.00 175.35 174.66 2ajc n GLU 191 N 4.98 0.73 -1.14 4.03 2.13 -1.26 -0.42 120.64 129.69 2ajc n GLU 191 Ca -0.14 0.26 -0.05 0.00 0.66 0.00 0.00 57.16 57.89 2ajc n GLU 191 Cb 0.52 -1.86 -0.02 0.00 0.27 0.00 0.00 31.44 30.35 2ajc n GLU 191 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2ajc n ASN 192 N 2.43 -5.72 0.11 4.31 5.03 -1.26 -4.71 115.26 115.45 2ajc n ASN 192 Ca 0.20 0.12 0.00 0.00 0.87 0.00 0.00 54.58 55.76 2ajc n ASN 192 Cb 0.14 -3.63 0.00 0.00 -1.02 0.00 0.00 39.78 35.27 2ajc n ASN 192 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 2ajc n VAL 193 N -2.15 0.41 -4.63 2.41 0.31 0.44 -4.73 118.33 110.39 2ajc n VAL 193 Ca -0.05 0.13 -0.33 0.00 -0.01 0.00 0.00 64.34 64.09 2ajc n VAL 193 Cb 0.51 -0.85 -0.16 0.00 -0.91 0.00 0.00 33.84 32.43 2ajc n VAL 193 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2ajc s ILE 194 N -1.96 2.08 -0.23 2.52 -1.09 -0.44 0.19 121.20 122.25 2ajc s ILE 194 Ca 0.00 -0.97 -0.00 0.00 -2.23 0.00 0.00 60.65 57.45 2ajc s ILE 194 Cb 0.00 -1.83 0.03 0.00 -1.58 0.00 0.00 42.46 39.08 2ajc s ILE 194 CO 0.00 0.55 -0.10 -0.31 -1.23 0.00 0.00 174.94 173.85 2ajc s TYR 195 N 0.85 3.03 -0.27 3.97 1.51 -0.40 -1.42 117.35 124.62 2ajc s TYR 195 Ca -0.06 -1.71 -0.07 0.00 -1.01 0.00 0.00 57.07 54.22 2ajc s TYR 195 Cb -0.15 -2.00 -0.01 0.00 -0.11 0.00 0.00 41.96 39.69 2ajc s TYR 195 CO -0.03 -0.77 0.06 -0.80 -1.11 0.00 0.00 175.55 172.90 2ajc s ASN 196 N 1.28 5.02 0.00 2.29 0.01 -0.70 -0.90 114.94 121.94 2ajc s ASN 196 Ca -0.00 -0.49 0.00 0.00 -0.71 0.00 0.00 52.86 51.66 2ajc s ASN 196 Cb -0.16 -1.88 0.00 0.00 0.41 0.00 0.00 41.25 39.62 2ajc s ASN 196 CO -0.07 -0.11 0.00 0.61 -1.51 0.00 0.00 177.10 176.02 2ajc n GLY 197 N 4.88 1.83 3.15 0.66 0.00 -0.63 -4.25 105.19 110.82 2ajc n GLY 197 Ca -0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 2ajc n GLY 197 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ajc s VAL 198 N -2.65 0.76 0.61 1.61 -7.23 -1.26 -0.11 120.40 112.13 2ajc s VAL 198 Ca 0.00 -1.63 -0.10 0.00 -1.81 0.00 0.00 61.98 58.44 2ajc s VAL 198 Cb 0.00 -1.32 -0.03 0.00 0.56 0.00 0.00 36.38 35.60 2ajc s VAL 198 CO 0.00 -0.64 1.00 0.42 -0.31 0.00 0.00 175.10 175.57 2ajc s THR 199 N -2.66 4.43 0.41 5.32 -4.23 -0.17 -4.74 115.64 114.00 2ajc s THR 199 Ca 0.04 0.63 -0.03 0.00 -1.18 0.00 0.00 61.69 61.16 2ajc s THR 199 Cb -0.01 -3.76 0.09 0.00 1.34 0.00 0.00 72.50 70.15 2ajc s THR 199 CO -0.02 -0.95 0.56 -0.90 -0.54 0.00 0.00 174.62 172.77 2ajc n ASP 200 N -2.71 0.49 -0.07 3.99 5.75 -1.26 -4.80 116.55 117.93 2ajc n ASP 200 Ca 0.05 -1.47 -0.08 0.00 -0.01 0.00 0.00 54.79 53.28 2ajc n ASP 200 Cb 0.55 -0.39 -0.01 0.00 -1.03 0.00 0.00 41.12 40.24 2ajc n ASP 200 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 2ajc h TRP 201 N -0.77 0.23 0.01 2.11 7.01 -1.99 -1.86 115.95 120.69 2ajc h TRP 201 Ca -0.18 0.01 -0.20 0.00 2.11 0.00 0.00 58.89 60.63 2ajc h TRP 201 Cb 0.61 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.60 2ajc h TRP 201 CO 0.00 0.12 -0.89 -0.24 -2.79 0.00 0.00 178.44 174.65 2ajc h VAL 202 N 0.27 1.51 -0.21 2.65 3.04 -1.95 -1.95 116.25 119.61 2ajc h VAL 202 Ca 0.12 -2.67 -0.13 0.00 -1.01 0.00 0.00 66.70 63.01 2ajc h VAL 202 Cb 0.05 2.50 -0.01 0.00 -2.01 0.00 0.00 31.29 31.82 2ajc h VAL 202 CO -0.09 0.78 -0.41 1.88 -1.01 0.00 0.00 177.57 178.72 2ajc h TYR 203 N 0.10 0.58 0.23 3.17 -1.99 -1.92 0.11 116.97 117.24 2ajc h TYR 203 Ca -0.04 -0.17 -0.01 0.00 2.00 0.00 0.00 58.73 60.51 2ajc h TYR 203 Cb 1.52 -0.13 0.00 0.00 2.00 0.00 0.00 36.73 40.13 2ajc h TYR 203 CO 0.03 0.82 -0.11 1.49 -0.00 0.00 0.00 178.16 180.39 2ajc h GLU 204 N 0.40 -0.29 -0.08 4.88 4.81 -1.16 0.29 114.58 123.43 2ajc h GLU 204 Ca 0.04 0.02 -0.17 0.00 -0.13 0.00 0.00 59.36 59.11 2ajc h GLU 204 Cb 0.89 0.07 0.01 0.00 0.63 0.00 0.00 28.75 30.34 2ajc h GLU 204 CO 0.08 -0.12 -0.62 1.49 -0.73 0.00 0.00 179.01 179.10 2ajc h GLU 205 N -0.41 0.57 0.00 1.92 4.57 -1.28 -1.31 114.58 118.64 2ajc h GLU 205 Ca -0.03 -0.50 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 2ajc h GLU 205 Cb 0.31 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 2ajc h GLU 205 CO 0.05 1.13 -0.85 0.39 -1.18 0.00 0.00 179.01 178.54 2ajc n GLU 206 N -4.14 2.34 -0.00 1.92 -0.58 0.02 -4.49 120.64 115.70 2ajc n GLU 206 Ca -0.09 -0.03 -0.03 0.00 -0.42 0.00 0.00 57.16 56.59 2ajc n GLU 206 Cb 0.67 -1.11 -0.01 0.00 -0.57 0.00 0.00 31.44 30.42 2ajc n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2ajc n VAL 207 N -1.47 1.06 0.09 2.62 0.31 -0.90 -4.84 118.33 115.20 2ajc n VAL 207 Ca 0.01 0.28 0.07 0.00 -0.01 0.00 0.00 64.34 64.69 2ajc n VAL 207 Cb 0.21 -1.74 -0.01 0.00 -0.91 0.00 0.00 33.84 31.39 2ajc n VAL 207 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2ajc h PHE 208 N -0.30 0.00 -6.25 3.52 -1.00 -1.15 -3.48 116.94 108.28 2ajc h PHE 208 Ca 0.00 0.00 -0.47 0.00 2.81 0.00 0.00 57.97 60.31 2ajc h PHE 208 Cb 0.30 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.84 2ajc h PHE 208 CO -0.13 0.24 -0.75 0.43 -1.61 0.00 0.00 178.31 176.49 2ajc n SER 209 N -2.83 -4.81 -3.52 2.17 7.64 -0.52 -4.93 113.62 106.83 2ajc n SER 209 Ca -0.03 -0.76 -0.09 0.00 1.01 0.00 0.00 58.87 59.00 2ajc n SER 209 Cb 0.67 -4.00 -0.02 0.00 -1.01 0.00 0.00 64.21 59.85 2ajc n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ajc s ALA 210 N -3.32 -1.75 -0.12 -0.43 0.00 -1.04 -4.99 121.76 110.10 2ajc s ALA 210 Ca 0.63 0.81 0.18 0.00 0.00 0.00 0.00 51.96 53.57 2ajc s ALA 210 Cb -0.31 0.54 -0.21 0.00 0.00 0.00 0.00 23.12 23.13 2ajc s ALA 210 CO 0.82 -0.74 0.54 0.98 0.00 0.00 0.00 175.76 177.35 2ajc n TYR 211 N -0.30 0.54 -2.20 0.00 9.36 -1.26 -4.27 117.16 119.04 2ajc n TYR 211 Ca -0.10 0.18 -0.41 0.00 3.32 0.00 0.00 57.90 60.89 2ajc n TYR 211 Cb 0.62 -0.97 -0.03 0.00 -0.63 0.00 0.00 39.34 38.33 2ajc n TYR 211 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2ajc s SER 212 N -5.51 6.89 -0.30 2.98 0.15 -1.26 -1.00 113.70 115.64 2ajc s SER 212 Ca -0.06 2.57 0.19 0.00 0.70 0.00 0.00 55.95 59.35 2ajc s SER 212 Cb 0.09 -2.64 0.48 0.00 -1.71 0.00 0.00 66.02 62.24 2ajc s SER 212 CO 0.83 -0.46 1.02 0.00 1.20 0.00 0.00 173.24 175.83 2ajc n ALA 213 N 1.18 3.17 -2.95 5.45 0.00 0.84 -4.63 120.51 123.57 2ajc n ALA 213 Ca 0.01 -3.03 -0.11 0.00 0.00 0.00 0.00 53.44 50.31 2ajc n ALA 213 Cb 0.42 -0.89 -0.13 0.00 0.00 0.00 0.00 19.45 18.86 2ajc n ALA 213 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2ajc s LEU 214 N -3.41 1.96 -0.19 0.00 0.05 -1.24 -1.80 118.68 114.05 2ajc s LEU 214 Ca 0.28 -0.13 -0.05 0.00 0.05 0.00 0.00 54.13 54.28 2ajc s LEU 214 Cb 0.40 0.16 0.07 0.00 -2.05 0.00 0.00 46.19 44.77 2ajc s LEU 214 CO 0.00 -0.13 0.11 0.26 -0.55 0.00 0.00 176.35 176.04 2ajc s TRP 215 N -0.55 0.14 0.45 3.48 0.51 0.69 -4.99 118.94 118.67 2ajc s TRP 215 Ca -0.06 -0.30 -0.22 0.00 -2.12 0.00 0.00 56.10 53.40 2ajc s TRP 215 Cb -0.04 -0.67 -0.08 0.00 -0.81 0.00 0.00 33.47 31.87 2ajc s TRP 215 CO -0.00 -0.56 1.08 -1.58 -0.51 0.00 0.00 176.95 175.39 2ajc s TRP 216 N 2.16 3.04 0.73 -1.98 0.52 -1.26 -0.59 118.94 121.56 2ajc s TRP 216 Ca 0.03 1.59 -0.11 0.00 0.02 0.00 0.00 56.10 57.64 2ajc s TRP 216 Cb -0.16 -3.19 0.03 0.00 -1.15 0.00 0.00 33.47 29.00 2ajc s TRP 216 CO -0.12 -0.99 1.07 -1.54 0.02 0.00 0.00 176.95 175.39 2ajc s SER 217 N -1.64 4.99 0.31 2.95 1.04 0.69 -4.91 113.70 117.13 2ajc s SER 217 Ca 0.63 1.63 0.08 0.00 0.48 0.00 0.00 55.95 58.77 2ajc s SER 217 Cb -0.22 -2.44 0.85 0.00 0.10 0.00 0.00 66.02 64.31 2ajc s SER 217 CO 0.27 -1.70 1.71 -0.65 0.98 0.00 0.00 173.24 173.85 2ajc h PRO 218 N -0.89 0.45 -0.62 4.02 0.11 -1.90 -0.62 132.00 132.54 2ajc h PRO 218 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2ajc h PRO 218 Cb 1.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2ajc h PRO 218 CO 0.56 0.30 0.00 -1.71 -0.21 0.00 0.00 178.00 176.94 2ajc n ASN 219 N -4.98 4.27 0.00 -2.05 5.15 -1.26 -4.36 115.26 112.04 2ajc n ASN 219 Ca 0.26 -2.29 0.00 0.00 -0.60 0.00 0.00 54.58 51.94 2ajc n ASN 219 Cb 0.75 -0.51 0.00 0.00 -0.53 0.00 0.00 39.78 39.49 2ajc n ASN 219 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ajc n GLY 220 N 1.12 0.43 0.14 8.20 0.00 -0.24 -4.86 105.19 109.97 2ajc n GLY 220 Ca 0.24 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.14 2ajc n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2ajc h THR 221 N 0.00 1.28 -3.50 2.61 2.02 -1.93 -3.45 112.91 109.94 2ajc h THR 221 Ca 0.00 -0.99 -0.66 0.00 0.77 0.00 0.00 66.41 65.53 2ajc h THR 221 Cb 0.19 1.53 -0.18 0.00 -1.74 0.00 0.00 68.15 67.94 2ajc h THR 221 CO 0.00 0.30 -0.80 -0.36 0.37 0.00 0.00 175.52 175.03 2ajc s PHE 222 N -4.81 2.49 -0.24 3.16 0.08 -1.26 -0.89 117.98 116.51 2ajc s PHE 222 Ca -0.14 -0.28 0.01 0.00 0.12 0.00 0.00 56.93 56.63 2ajc s PHE 222 Cb 0.06 -1.28 0.06 0.00 -0.57 0.00 0.00 43.02 41.29 2ajc s PHE 222 CO 0.74 0.43 -0.05 -1.17 -0.10 0.00 0.00 175.22 175.07 2ajc s LEU 223 N -2.37 2.65 0.22 -0.37 2.96 0.31 -0.22 118.68 121.85 2ajc s LEU 223 Ca 0.19 -1.23 -0.11 0.00 -0.22 0.00 0.00 54.13 52.77 2ajc s LEU 223 Cb -0.10 -1.19 -0.07 0.00 0.50 0.00 0.00 46.19 45.33 2ajc s LEU 223 CO 0.11 -0.25 0.56 0.00 -1.32 0.00 0.00 176.35 175.45 2ajc s ALA 224 N 1.38 3.55 0.12 5.97 0.00 0.24 -0.35 121.76 132.67 2ajc s ALA 224 Ca -0.05 -0.23 -0.14 0.00 0.00 0.00 0.00 51.96 51.54 2ajc s ALA 224 Cb -0.19 -2.47 0.03 0.00 0.00 0.00 0.00 23.12 20.49 2ajc s ALA 224 CO -0.07 0.49 0.36 1.52 0.00 0.00 0.00 175.76 178.06 2ajc s TYR 225 N -1.76 -0.11 0.11 0.00 1.13 -0.28 -0.22 117.35 116.22 2ajc s TYR 225 Ca 0.46 -0.24 0.07 0.00 -1.41 0.00 0.00 57.07 55.96 2ajc s TYR 225 Cb -0.12 0.19 -0.04 0.00 -1.10 0.00 0.00 41.96 40.89 2ajc s TYR 225 CO 0.21 -0.68 -0.10 0.00 -2.51 0.00 0.00 175.55 172.47 2ajc s ALA 226 N -3.82 2.94 -0.11 9.51 0.00 -0.75 -1.36 121.76 128.17 2ajc s ALA 226 Ca 0.04 -1.27 0.03 0.00 0.00 0.00 0.00 51.96 50.76 2ajc s ALA 226 Cb 0.02 -0.87 0.00 0.00 0.00 0.00 0.00 23.12 22.28 2ajc s ALA 226 CO -0.11 0.63 -0.23 -1.14 0.00 0.00 0.00 175.76 174.91 2ajc s GLN 227 N -2.26 3.07 -0.10 0.00 0.74 0.76 -1.61 119.66 120.27 2ajc s GLN 227 Ca 0.21 -0.86 0.00 0.00 0.05 0.00 0.00 55.36 54.77 2ajc s GLN 227 Cb -0.11 -2.35 -0.03 0.00 1.10 0.00 0.00 33.01 31.62 2ajc s GLN 227 CO 0.14 0.15 -0.09 -0.06 -0.55 0.00 0.00 175.29 174.88 2ajc s PHE 228 N 0.43 2.89 -0.29 1.67 0.08 -0.08 -1.05 117.98 121.63 2ajc s PHE 228 Ca -0.16 -0.21 -0.00 0.00 0.12 0.00 0.00 56.93 56.67 2ajc s PHE 228 Cb -0.17 -1.78 0.05 0.00 -0.57 0.00 0.00 43.02 40.55 2ajc s PHE 228 CO 0.07 0.12 -0.03 1.21 -0.10 0.00 0.00 175.22 176.49 2ajc s ASN 229 N -0.31 4.78 -0.18 1.36 3.84 0.10 -1.27 114.94 123.26 2ajc s ASN 229 Ca 0.04 -1.32 0.16 0.00 0.21 0.00 0.00 52.86 51.95 2ajc s ASN 229 Cb -0.13 -1.67 0.72 0.00 -0.55 0.00 0.00 41.25 39.63 2ajc s ASN 229 CO 0.02 -0.25 1.64 0.47 -2.79 0.00 0.00 177.10 176.20 2ajc n ASP 230 N 4.57 5.02 -0.27 -4.21 9.92 0.13 -1.84 116.55 129.86 2ajc n ASP 230 Ca -0.13 -2.74 0.08 0.00 -0.53 0.00 0.00 54.79 51.46 2ajc n ASP 230 Cb 0.43 -0.61 0.21 0.00 -0.64 0.00 0.00 41.12 40.51 2ajc n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2ajc h THR 231 N 3.61 0.41 -0.20 -3.53 2.02 -1.85 -1.60 112.91 111.78 2ajc h THR 231 Ca 0.00 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.10 2ajc h THR 231 Cb 1.67 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 2ajc h THR 231 CO 0.34 0.04 0.00 -0.62 0.37 0.00 0.00 175.52 175.65 2ajc n GLU 232 N -5.21 2.05 -2.82 6.66 1.02 -1.26 -4.92 120.64 116.16 2ajc n GLU 232 Ca 0.17 -1.57 -0.41 0.00 -0.02 0.00 0.00 57.16 55.33 2ajc n GLU 232 Cb 0.54 -1.45 -0.04 0.00 -0.02 0.00 0.00 31.44 30.47 2ajc n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2ajc s VAL 233 N -1.75 4.92 0.75 2.62 1.01 -0.60 -4.69 120.40 122.66 2ajc s VAL 233 Ca 0.34 1.86 -0.14 0.00 0.00 0.00 0.00 61.98 64.04 2ajc s VAL 233 Cb 0.20 -4.23 0.05 0.00 0.00 0.00 0.00 36.38 32.40 2ajc s VAL 233 CO 0.29 0.17 1.20 -2.84 0.00 0.00 0.00 175.10 173.93 2ajc s PRO 234 N 1.04 1.99 -0.16 2.72 0.02 -1.26 -4.66 135.00 134.68 2ajc s PRO 234 Ca 0.47 1.73 -0.08 0.00 0.02 0.00 0.00 61.00 63.14 2ajc s PRO 234 Cb -0.20 -1.82 -0.05 0.00 0.02 0.00 0.00 34.50 32.46 2ajc s PRO 234 CO 0.24 -1.94 0.13 -0.51 -0.33 0.00 0.00 177.00 174.59 2ajc s LEU 235 N -5.35 4.25 0.08 -5.54 1.43 -1.26 -1.05 118.68 111.23 2ajc s LEU 235 Ca 0.73 0.32 -0.22 0.00 -1.03 0.00 0.00 54.13 53.93 2ajc s LEU 235 Cb -0.28 -2.07 -0.07 0.00 0.03 0.00 0.00 46.19 43.80 2ajc s LEU 235 CO 0.47 0.28 0.64 -0.51 0.23 0.00 0.00 176.35 177.46 2ajc s ILE 236 N -0.22 4.69 -0.03 -0.59 1.10 -0.02 -4.87 121.20 121.25 2ajc s ILE 236 Ca 0.11 1.38 0.04 0.00 -0.51 0.00 0.00 60.65 61.67 2ajc s ILE 236 Cb -0.11 -3.98 -0.01 0.00 0.15 0.00 0.00 42.46 38.51 2ajc s ILE 236 CO 0.01 0.50 -0.16 -1.61 -2.11 0.00 0.00 174.94 171.56 2ajc s GLU 237 N -0.83 1.56 0.06 3.50 2.02 -1.26 -1.52 118.70 122.23 2ajc s GLU 237 Ca 0.32 -0.58 -0.15 0.00 0.02 0.00 0.00 54.97 54.58 2ajc s GLU 237 Cb -0.20 -1.41 0.03 0.00 0.10 0.00 0.00 34.13 32.64 2ajc s GLU 237 CO 0.21 0.28 0.34 1.52 0.02 0.00 0.00 175.26 177.63 2ajc s TYR 238 N -0.11 -0.15 0.32 1.61 1.13 -0.87 -4.97 117.35 114.30 2ajc s TYR 238 Ca 0.00 0.00 -0.27 0.00 -1.41 0.00 0.00 57.07 55.39 2ajc s TYR 238 Cb -0.09 0.15 -0.09 0.00 -1.10 0.00 0.00 41.96 40.82 2ajc s TYR 238 CO 0.01 -0.56 1.04 -1.12 -2.51 0.00 0.00 175.55 172.42 2ajc s SER 239 N -2.20 7.18 -0.12 -0.18 0.01 -1.26 -0.09 113.70 117.04 2ajc s SER 239 Ca -0.03 2.10 0.00 0.00 1.31 0.00 0.00 55.95 59.33 2ajc s SER 239 Cb -0.00 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.65 2ajc s SER 239 CO -0.05 -0.19 -0.10 0.12 0.41 0.00 0.00 173.24 173.43 2ajc s PHE 240 N -1.37 1.67 0.03 2.43 5.36 0.13 -4.69 117.98 121.54 2ajc s PHE 240 Ca 0.49 -0.84 0.06 0.00 -0.96 0.00 0.00 56.93 55.67 2ajc s PHE 240 Cb -0.26 -1.31 -0.24 0.00 -0.34 0.00 0.00 43.02 40.87 2ajc s PHE 240 CO 0.34 -0.52 0.96 1.88 -1.46 0.00 0.00 175.22 176.41 2ajc h TYR 241 N 7.97 0.14 -1.03 10.12 -1.99 -1.96 -0.96 116.97 129.26 2ajc h TYR 241 Ca -0.32 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.31 2ajc h TYR 241 Cb 1.14 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.87 2ajc h TYR 241 CO 0.48 1.12 0.00 0.45 -0.00 0.00 0.00 178.16 180.20 2ajc n SER 242 N -3.28 -3.10 -4.70 3.88 2.88 -1.26 -4.74 113.62 103.29 2ajc n SER 242 Ca -0.10 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.05 2ajc n SER 242 Cb 1.01 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.51 2ajc n SER 242 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2ajc n ASP 243 N -1.95 2.12 -0.15 -3.46 -0.08 -1.26 -4.86 116.55 106.90 2ajc n ASP 243 Ca 0.00 0.95 0.28 0.00 -1.51 0.00 0.00 54.79 54.51 2ajc n ASP 243 Cb 0.00 -1.51 0.71 0.00 2.34 0.00 0.00 41.12 42.66 2ajc n ASP 243 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2ajc h GLU 244 N 1.24 0.00 0.00 -0.67 4.81 -2.05 -0.56 114.58 117.34 2ajc h GLU 244 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2ajc h GLU 244 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 2ajc h GLU 244 CO 0.56 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 179.50 2ajc h SER 245 N 0.00 0.00 -2.92 1.04 4.64 -1.94 -3.43 113.55 110.94 2ajc h SER 245 Ca 0.41 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.16 2ajc h SER 245 Cb 1.86 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.91 2ajc h SER 245 CO -0.00 0.00 1.12 -0.22 -0.87 0.00 0.00 176.83 176.85 2ajc s LEU 246 N -5.27 3.75 0.21 5.97 0.20 -0.22 -4.88 118.68 118.44 2ajc s LEU 246 Ca 0.04 1.32 -0.06 0.00 0.69 0.00 0.00 54.13 56.12 2ajc s LEU 246 Cb 0.09 -3.53 0.15 0.00 -0.43 0.00 0.00 46.19 42.47 2ajc s LEU 246 CO 0.50 -1.35 1.66 -0.61 -0.29 0.00 0.00 176.35 176.26 2ajc h GLN 247 N 10.87 0.94 -5.78 1.98 4.15 -1.89 -3.42 115.11 121.96 2ajc h GLN 247 Ca -0.31 -0.31 -0.68 0.00 0.77 0.00 0.00 58.65 58.12 2ajc h GLN 247 Cb 1.14 -0.08 -0.29 0.00 0.21 0.00 0.00 27.48 28.45 2ajc h GLN 247 CO 1.03 0.97 -0.84 0.71 -1.93 0.00 0.00 178.83 178.77 2ajc s TYR 248 N -4.89 2.59 0.71 3.99 1.51 -1.26 -5.12 117.35 114.88 2ajc s TYR 248 Ca -0.11 -0.68 -0.15 0.00 -1.01 0.00 0.00 57.07 55.12 2ajc s TYR 248 Cb 0.14 -1.68 0.03 0.00 -0.11 0.00 0.00 41.96 40.34 2ajc s TYR 248 CO 0.84 -0.19 1.19 -2.14 -1.11 0.00 0.00 175.55 174.14 2ajc s PRO 249 N -0.04 2.27 0.25 -1.71 0.02 -1.26 -5.03 135.00 129.50 2ajc s PRO 249 Ca -0.06 1.70 0.06 0.00 0.02 0.00 0.00 61.00 62.72 2ajc s PRO 249 Cb -0.15 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.49 2ajc s PRO 249 CO 0.05 -1.72 0.31 -1.59 -0.33 0.00 0.00 177.00 173.72 2ajc s LYS 250 N -3.92 3.25 -0.22 5.54 -2.85 -0.36 -4.93 119.74 116.25 2ajc s LYS 250 Ca 0.73 -0.87 -0.04 0.00 -1.00 0.00 0.00 55.97 54.80 2ajc s LYS 250 Cb -0.28 -2.77 -0.00 0.00 -2.06 0.00 0.00 37.83 32.71 2ajc s LYS 250 CO 0.44 0.41 -0.05 0.99 0.10 0.00 0.00 175.35 177.24 2ajc s THR 251 N -2.04 3.29 0.14 3.79 2.01 -1.26 -0.69 115.64 120.87 2ajc s THR 251 Ca 0.34 -0.55 -0.24 0.00 0.31 0.00 0.00 61.69 61.56 2ajc s THR 251 Cb -0.09 -2.51 -0.08 0.00 0.01 0.00 0.00 72.50 69.84 2ajc s THR 251 CO 0.28 0.41 0.72 -0.69 -0.69 0.00 0.00 174.62 174.65 2ajc s VAL 252 N 1.46 4.48 -0.07 3.82 1.01 0.87 -4.91 120.40 127.07 2ajc s VAL 252 Ca 0.05 1.57 0.01 0.00 0.00 0.00 0.00 61.98 63.62 2ajc s VAL 252 Cb -0.14 -4.07 0.02 0.00 0.00 0.00 0.00 36.38 32.18 2ajc s VAL 252 CO -0.04 0.53 -0.09 -0.13 0.00 0.00 0.00 175.10 175.37 2ajc s ARG 253 N -1.10 1.38 -0.04 2.72 0.52 -1.26 -2.05 118.95 119.11 2ajc s ARG 253 Ca 0.34 -0.27 0.02 0.00 -0.52 0.00 0.00 55.73 55.29 2ajc s ARG 253 Cb -0.22 -1.26 0.02 0.00 0.52 0.00 0.00 34.95 34.00 2ajc s ARG 253 CO 0.24 -0.07 -0.07 0.42 0.02 0.00 0.00 175.30 175.84 2ajc s ILE 254 N 0.99 0.70 -0.23 1.52 1.01 -0.58 -4.95 121.20 119.65 2ajc s ILE 254 Ca -0.09 -0.24 -0.29 0.00 0.00 0.00 0.00 60.65 60.03 2ajc s ILE 254 Cb -0.15 -0.67 -0.03 0.00 0.01 0.00 0.00 42.46 41.62 2ajc s ILE 254 CO 0.00 0.25 1.66 -2.84 0.00 0.00 0.00 174.94 174.01 2ajc s PRO 255 N 0.70 3.73 -0.12 2.79 0.02 -1.26 -0.84 135.00 140.02 2ajc s PRO 255 Ca -0.11 1.65 -0.03 0.00 0.02 0.00 0.00 61.00 62.53 2ajc s PRO 255 Cb -0.14 -4.07 0.05 0.00 0.02 0.00 0.00 34.50 30.36 2ajc s PRO 255 CO 0.01 -1.38 0.06 -0.47 -0.33 0.00 0.00 177.00 174.89 2ajc s TYR 256 N 5.48 0.30 -0.25 6.54 6.14 -0.22 -4.53 117.35 130.81 2ajc s TYR 256 Ca 0.73 -0.16 -0.24 0.00 0.64 0.00 0.00 57.07 58.04 2ajc s TYR 256 Cb -0.25 -0.67 -0.00 0.00 0.42 0.00 0.00 41.96 41.45 2ajc s TYR 256 CO 0.30 -0.39 0.81 -1.25 0.64 0.00 0.00 175.55 175.67 2ajc s PRO 257 N 2.10 4.15 0.68 4.97 0.04 -1.26 -4.49 135.00 141.19 2ajc s PRO 257 Ca 0.03 0.88 -0.06 0.00 0.04 0.00 0.00 61.00 61.89 2ajc s PRO 257 Cb -0.14 -3.66 0.06 0.00 0.04 0.00 0.00 34.50 30.80 2ajc s PRO 257 CO -0.06 -0.53 0.98 0.15 0.04 0.00 0.00 177.00 177.58 2ajc s LYS 258 N 2.84 2.25 -0.10 4.56 1.02 -1.26 -0.71 119.74 128.34 2ajc s LYS 258 Ca 0.34 -0.32 -0.38 0.00 0.02 0.00 0.00 55.97 55.63 2ajc s LYS 258 Cb -0.15 -2.21 -0.16 0.00 -0.52 0.00 0.00 37.83 34.79 2ajc s LYS 258 CO 0.08 -1.17 1.60 0.00 -0.92 0.00 0.00 175.35 174.94 2ajc n ALA 259 N -2.84 -0.30 -0.57 5.17 0.00 -0.41 -1.10 120.51 120.45 2ajc n ALA 259 Ca 0.08 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.95 2ajc n ALA 259 Cb 0.60 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.85 2ajc n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ajc n GLY 260 N 3.54 1.47 3.93 0.00 0.00 -1.26 -4.84 105.19 108.04 2ajc n GLY 260 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 2ajc n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ajc s ALA 261 N -3.43 2.79 0.19 4.61 0.00 -0.26 -5.00 121.76 120.66 2ajc s ALA 261 Ca 0.00 -1.04 -0.31 0.00 0.00 0.00 0.00 51.96 50.60 2ajc s ALA 261 Cb 0.00 -2.68 -0.11 0.00 0.00 0.00 0.00 23.12 20.34 2ajc s ALA 261 CO 0.00 -1.78 1.60 -2.00 0.00 0.00 0.00 175.76 173.57 2ajc s GLU 262 N -5.53 4.19 0.31 0.00 2.56 -1.26 -4.90 118.70 114.07 2ajc s GLU 262 Ca 0.66 2.42 0.07 0.00 0.00 0.00 0.00 54.97 58.12 2ajc s GLU 262 Cb -0.08 -3.13 -0.02 0.00 2.00 0.00 0.00 34.13 32.90 2ajc s GLU 262 CO 0.48 -0.63 0.36 -0.80 -0.56 0.00 0.00 175.26 174.11 2ajc s ASN 263 N 1.07 5.75 0.70 -1.70 0.01 -1.26 -4.41 114.94 115.10 2ajc s ASN 263 Ca 0.70 -0.25 -0.13 0.00 -0.71 0.00 0.00 52.86 52.47 2ajc s ASN 263 Cb -0.45 -1.27 0.02 0.00 0.41 0.00 0.00 41.25 39.95 2ajc s ASN 263 CO 0.33 -0.30 1.09 -2.16 -1.51 0.00 0.00 177.10 174.55 2ajc s PRO 264 N -4.04 2.66 0.31 -0.60 0.04 -1.26 -4.76 135.00 127.35 2ajc s PRO 264 Ca 0.40 1.24 0.08 0.00 0.04 0.00 0.00 61.00 62.76 2ajc s PRO 264 Cb -0.08 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 2ajc s PRO 264 CO 0.28 -1.34 0.19 0.95 0.04 0.00 0.00 177.00 177.13 2ajc s THR 265 N -2.64 3.63 0.03 1.26 -4.23 -0.77 -4.91 115.64 108.01 2ajc s THR 265 Ca 0.63 -1.53 0.02 0.00 -1.18 0.00 0.00 61.69 59.63 2ajc s THR 265 Cb -0.18 -3.14 -0.02 0.00 1.34 0.00 0.00 72.50 70.50 2ajc s THR 265 CO 0.48 -0.25 -0.06 0.54 -0.54 0.00 0.00 174.62 174.79 2ajc s VAL 266 N -2.29 0.42 0.03 2.29 0.11 -1.26 -0.73 120.40 118.98 2ajc s VAL 266 Ca 0.37 -0.88 0.04 0.00 -2.93 0.00 0.00 61.98 58.58 2ajc s VAL 266 Cb -0.06 -0.48 -0.02 0.00 -1.53 0.00 0.00 36.38 34.29 2ajc s VAL 266 CO 0.24 -0.31 -0.11 -0.54 -3.33 0.00 0.00 175.10 171.05 2ajc s LYS 267 N -1.28 0.76 -0.07 1.54 1.02 -0.21 -4.97 119.74 116.53 2ajc s LYS 267 Ca -0.09 -0.64 0.05 0.00 0.02 0.00 0.00 55.97 55.31 2ajc s LYS 267 Cb -0.08 -0.71 -0.00 0.00 -0.52 0.00 0.00 37.83 36.51 2ajc s LYS 267 CO 0.00 0.17 -0.23 0.12 -0.92 0.00 0.00 175.35 174.49 2ajc s PHE 268 N -0.81 2.37 0.08 3.18 5.36 -1.26 -0.17 117.98 126.73 2ajc s PHE 268 Ca -0.01 -0.82 0.04 0.00 -0.96 0.00 0.00 56.93 55.19 2ajc s PHE 268 Cb -0.07 -1.57 -0.03 0.00 -0.34 0.00 0.00 43.02 41.01 2ajc s PHE 268 CO 0.01 -0.29 -0.11 -0.06 -1.46 0.00 0.00 175.22 173.30 2ajc s PHE 269 N 0.09 1.06 -0.16 10.12 0.40 -0.46 -1.58 117.98 127.44 2ajc s PHE 269 Ca -0.10 -0.55 0.02 0.00 -0.60 0.00 0.00 56.93 55.70 2ajc s PHE 269 Cb -0.15 -0.59 0.02 0.00 0.51 0.00 0.00 43.02 42.80 2ajc s PHE 269 CO 0.06 0.01 -0.20 0.08 0.70 0.00 0.00 175.22 175.87 2ajc s VAL 270 N -1.78 2.02 -0.18 -0.44 1.01 -0.26 -1.13 120.40 119.64 2ajc s VAL 270 Ca -0.00 -0.93 -0.10 0.00 0.00 0.00 0.00 61.98 60.95 2ajc s VAL 270 Cb -0.07 -1.81 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 2ajc s VAL 270 CO 0.01 0.54 0.14 -0.69 0.00 0.00 0.00 175.10 175.10 2ajc s VAL 271 N 1.12 5.42 -0.58 2.92 1.01 0.53 -1.52 120.40 129.30 2ajc s VAL 271 Ca 0.00 0.21 -0.23 0.00 0.00 0.00 0.00 61.98 61.97 2ajc s VAL 271 Cb -0.14 -3.46 0.05 0.00 0.00 0.00 0.00 36.38 32.83 2ajc s VAL 271 CO -0.08 0.47 0.90 -0.62 0.00 0.00 0.00 175.10 175.77 2ajc s ASP 272 N 0.09 6.27 0.00 3.32 3.68 -0.57 -0.53 116.67 128.93 2ajc s ASP 272 Ca 0.10 -0.63 0.23 0.00 2.13 0.00 0.00 52.55 54.37 2ajc s ASP 272 Cb -0.11 -2.41 1.03 0.00 -1.45 0.00 0.00 42.92 39.98 2ajc s ASP 272 CO -0.01 -1.24 1.73 0.35 0.13 0.00 0.00 175.17 176.14 2ajc n THR 273 N 6.02 0.39 0.25 1.71 -2.24 -0.06 -3.46 114.28 116.89 2ajc n THR 273 Ca -0.01 0.10 0.09 0.00 -2.27 0.00 0.00 64.05 61.95 2ajc n THR 273 Cb 0.46 -0.71 0.64 0.00 -2.10 0.00 0.00 70.33 68.63 2ajc n THR 273 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2ajc h ARG 274 N 0.00 0.00 -0.10 -0.78 3.08 -1.91 -2.72 114.38 111.95 2ajc h ARG 274 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ajc h ARG 274 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.38 2ajc h ARG 274 CO 0.00 0.10 0.00 0.25 -1.07 0.00 0.00 179.97 179.25 2ajc n THR 275 N -4.16 0.11 -1.79 2.04 -2.24 -1.22 -4.95 114.28 102.07 2ajc n THR 275 Ca -0.03 -0.46 -0.42 0.00 -2.27 0.00 0.00 64.05 60.87 2ajc n THR 275 Cb 0.19 1.03 -0.03 0.00 -2.10 0.00 0.00 70.33 69.41 2ajc n THR 275 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2ajc s LEU 276 N -1.86 4.37 -0.16 3.22 1.43 -1.03 -4.81 118.68 119.84 2ajc s LEU 276 Ca 0.33 2.78 -0.29 0.00 -1.03 0.00 0.00 54.13 55.92 2ajc s LEU 276 Cb 0.20 -3.60 0.10 0.00 0.03 0.00 0.00 46.19 42.93 2ajc s LEU 276 CO 0.31 -0.93 0.89 -0.55 0.23 0.00 0.00 176.35 176.30 2ajc s SER 277 N 1.25 -0.51 0.38 2.29 0.15 -1.26 -5.02 113.70 110.98 2ajc s SER 277 Ca 0.74 0.69 0.15 0.00 0.70 0.00 0.00 55.95 58.22 2ajc s SER 277 Cb -0.48 0.60 1.01 0.00 -1.71 0.00 0.00 66.02 65.45 2ajc s SER 277 CO 0.32 -0.37 1.78 1.55 1.20 0.00 0.00 173.24 177.72 2ajc h PRO 278 N 3.25 0.47 -0.48 5.44 0.13 -1.98 -1.23 132.00 137.60 2ajc h PRO 278 Ca -0.24 -0.03 -0.12 0.00 -0.87 0.00 0.00 66.00 64.75 2ajc h PRO 278 Cb 1.16 -0.11 -0.07 0.00 0.13 0.00 0.00 31.00 32.11 2ajc h PRO 278 CO 0.27 0.31 0.09 0.09 -0.23 0.00 0.00 178.00 178.53 2ajc n ASN 279 N -4.66 4.07 -4.63 1.44 3.02 -1.26 -4.95 115.26 108.30 2ajc n ASN 279 Ca 0.24 -3.24 -0.28 0.00 -0.03 0.00 0.00 54.58 51.27 2ajc n ASN 279 Cb 0.78 -0.65 -0.09 0.00 -0.61 0.00 0.00 39.78 39.22 2ajc n ASN 279 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ajc s ALA 280 N -2.97 3.11 0.89 5.41 0.00 -0.46 -5.13 121.76 122.60 2ajc s ALA 280 Ca 0.48 -1.31 -0.14 0.00 0.00 0.00 0.00 51.96 50.99 2ajc s ALA 280 Cb 0.40 -0.96 0.14 0.00 0.00 0.00 0.00 23.12 22.69 2ajc s ALA 280 CO 0.09 0.55 1.23 -1.54 0.00 0.00 0.00 175.76 176.10 2ajc s SER 281 N -2.64 3.80 -0.15 0.00 1.04 -1.26 -4.65 113.70 109.84 2ajc s SER 281 Ca 0.25 0.59 -0.20 0.00 0.48 0.00 0.00 55.95 57.07 2ajc s SER 281 Cb -0.10 -0.90 -0.03 0.00 0.10 0.00 0.00 66.02 65.08 2ajc s SER 281 CO 0.17 -2.33 0.58 -0.69 0.98 0.00 0.00 173.24 171.95 2ajc s VAL 282 N -3.67 5.09 -0.32 5.02 1.01 -1.26 -4.80 120.40 121.47 2ajc s VAL 282 Ca 0.67 1.14 -0.21 0.00 0.00 0.00 0.00 61.98 63.58 2ajc s VAL 282 Cb -0.08 -3.91 -0.00 0.00 0.00 0.00 0.00 36.38 32.38 2ajc s VAL 282 CO 0.51 0.22 0.66 -0.89 0.00 0.00 0.00 175.10 175.60 2ajc s THR 283 N 1.24 4.89 0.08 3.92 2.01 -1.26 -5.03 115.64 121.49 2ajc s THR 283 Ca 0.29 0.82 -0.11 0.00 0.31 0.00 0.00 61.69 63.00 2ajc s THR 283 Cb -0.16 -4.06 0.01 0.00 0.01 0.00 0.00 72.50 68.30 2ajc s THR 283 CO 0.12 -0.23 0.24 -0.94 -0.69 0.00 0.00 174.62 173.12 2ajc s SER 284 N 1.70 0.01 -0.05 3.53 1.04 -1.26 -1.52 113.70 117.16 2ajc s SER 284 Ca 0.26 -0.48 0.01 0.00 0.48 0.00 0.00 55.95 56.23 2ajc s SER 284 Cb -0.15 0.35 0.02 0.00 0.10 0.00 0.00 66.02 66.35 2ajc s SER 284 CO 0.13 -0.70 -0.07 -0.47 0.98 0.00 0.00 173.24 173.11 2ajc s TYR 285 N -3.43 0.91 -0.19 5.02 5.04 -0.57 -4.96 117.35 119.17 2ajc s TYR 285 Ca 0.01 -0.27 -0.18 0.00 -2.44 0.00 0.00 57.07 54.19 2ajc s TYR 285 Cb 0.03 -0.74 -0.03 0.00 0.35 0.00 0.00 41.96 41.56 2ajc s TYR 285 CO -0.09 -0.19 0.50 -1.14 -1.34 0.00 0.00 175.55 173.29 2ajc s GLN 286 N 0.76 4.21 -0.28 4.97 0.74 -1.26 -1.10 119.66 127.70 2ajc s GLN 286 Ca -0.12 0.40 -0.10 0.00 0.05 0.00 0.00 55.36 55.60 2ajc s GLN 286 Cb -0.14 -3.54 -0.04 0.00 1.10 0.00 0.00 33.01 30.40 2ajc s GLN 286 CO 0.01 -0.08 0.15 0.42 -0.55 0.00 0.00 175.29 175.24 2ajc s ILE 287 N 1.43 4.90 0.25 -2.34 1.01 -0.62 -5.00 121.20 120.83 2ajc s ILE 287 Ca 0.24 -0.04 -0.00 0.00 0.00 0.00 0.00 60.65 60.85 2ajc s ILE 287 Cb -0.15 -3.35 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 2ajc s ILE 287 CO 0.10 0.24 0.44 0.68 0.00 0.00 0.00 174.94 176.40 2ajc s VAL 288 N 1.69 5.17 0.83 2.92 -7.23 -1.26 -4.22 120.40 118.30 2ajc s VAL 288 Ca 0.06 -0.42 -0.11 0.00 -1.81 0.00 0.00 61.98 59.70 2ajc s VAL 288 Cb -0.16 -3.78 0.09 0.00 0.56 0.00 0.00 36.38 33.09 2ajc s VAL 288 CO 0.08 -0.31 1.09 -2.16 -0.31 0.00 0.00 175.10 173.49 2ajc s PRO 289 N -3.68 1.81 0.80 4.82 0.04 -1.26 -4.99 135.00 132.54 2ajc s PRO 289 Ca 0.39 0.87 -0.14 0.00 0.04 0.00 0.00 61.00 62.17 2ajc s PRO 289 Cb -0.10 -1.87 0.08 0.00 0.04 0.00 0.00 34.50 32.65 2ajc s PRO 289 CO 0.31 -1.87 1.21 -2.14 0.04 0.00 0.00 177.00 174.55 2ajc s PRO 290 N -4.98 1.69 0.32 0.56 0.02 -1.26 -4.60 135.00 126.74 2ajc s PRO 290 Ca 0.62 1.77 0.08 0.00 0.02 0.00 0.00 61.00 63.49 2ajc s PRO 290 Cb -0.17 -1.78 0.79 0.00 0.02 0.00 0.00 34.50 33.36 2ajc s PRO 290 CO 0.56 -2.18 1.79 0.00 -0.33 0.00 0.00 177.00 176.84 2ajc h ALA 291 N -0.82 1.75 0.00 -1.55 0.00 -1.97 -0.63 119.26 116.04 2ajc h ALA 291 Ca -0.46 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2ajc h ALA 291 Cb 1.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2ajc h ALA 291 CO 0.47 -0.11 0.00 0.66 0.00 0.00 0.00 179.25 180.27 2ajc h SER 292 N 0.72 0.00 0.00 0.00 4.64 -2.02 -2.22 113.55 114.67 2ajc h SER 292 Ca 0.56 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.66 2ajc h SER 292 Cb 0.93 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.97 2ajc h SER 292 CO -0.34 0.00 -1.83 0.52 -0.87 0.00 0.00 176.83 174.30 2ajc n VAL 293 N -2.50 0.83 0.27 0.95 0.31 -0.56 -4.55 118.33 113.09 2ajc n VAL 293 Ca -0.01 -0.51 0.13 0.00 -0.01 0.00 0.00 64.34 63.94 2ajc n VAL 293 Cb 0.12 -0.69 0.77 0.00 -0.91 0.00 0.00 33.84 33.13 2ajc n VAL 293 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2ajc h LEU 294 N 0.00 0.00 -0.57 7.52 6.46 -0.57 -3.10 115.31 125.05 2ajc h LEU 294 Ca -0.33 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.43 2ajc h LEU 294 Cb 1.74 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.67 2ajc h LEU 294 CO 0.02 0.08 0.00 2.30 -0.62 0.00 0.00 178.44 180.21 2ajc n ILE 295 N -3.83 1.36 -3.23 4.05 -5.35 -0.97 -4.84 119.36 106.54 2ajc n ILE 295 Ca -0.02 0.50 -0.01 0.00 -0.27 0.00 0.00 62.75 62.94 2ajc n ILE 295 Cb 0.17 -1.45 0.00 0.00 -1.74 0.00 0.00 39.64 36.63 2ajc n ILE 295 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ajc n GLY 296 N -0.98 2.16 3.76 3.28 0.00 -1.17 -5.14 105.19 107.11 2ajc n GLY 296 Ca 0.00 -1.13 -0.40 0.00 0.00 0.00 0.00 46.02 44.50 2ajc n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ajc s ASP 297 N -1.26 5.77 0.31 1.61 1.01 -1.26 -4.91 116.67 117.93 2ajc s ASP 297 Ca 0.02 2.89 -0.12 0.00 0.71 0.00 0.00 52.55 56.06 2ajc s ASP 297 Cb -0.00 -2.65 0.01 0.00 1.01 0.00 0.00 42.92 41.29 2ajc s ASP 297 CO 0.02 -1.25 0.57 -1.38 0.21 0.00 0.00 175.17 173.35 2ajc s HIS 298 N -1.22 0.43 0.06 4.23 -3.43 -1.26 -0.95 115.29 113.15 2ajc s HIS 298 Ca 0.63 -0.84 0.04 0.00 -0.80 0.00 0.00 55.06 54.09 2ajc s HIS 298 Cb -0.43 0.32 -0.03 0.00 -1.43 0.00 0.00 32.58 31.01 2ajc s HIS 298 CO 0.55 -1.19 -0.12 0.71 -2.00 0.00 0.00 174.74 172.69 2ajc s TYR 299 N -3.37 1.05 -0.16 0.38 2.02 0.69 -4.80 117.35 113.16 2ajc s TYR 299 Ca 0.22 -0.44 -0.20 0.00 -0.37 0.00 0.00 57.07 56.27 2ajc s TYR 299 Cb -0.02 -0.60 -0.03 0.00 -0.40 0.00 0.00 41.96 40.90 2ajc s TYR 299 CO 0.12 0.01 0.60 -1.17 -1.57 0.00 0.00 175.55 173.55 2ajc s LEU 300 N -1.56 4.20 0.00 -1.29 2.96 -1.26 -1.15 118.68 120.58 2ajc s LEU 300 Ca -0.03 0.87 0.00 0.00 -0.22 0.00 0.00 54.13 54.75 2ajc s LEU 300 Cb -0.09 -2.87 0.00 0.00 0.50 0.00 0.00 46.19 43.73 2ajc s LEU 300 CO 0.02 -0.19 0.63 0.00 -1.32 0.00 0.00 176.35 175.49 2ajc s GLY 302 N -0.34 -0.09 -0.05 0.00 0.00 -0.92 -4.88 107.32 101.04 2ajc s GLY 302 Ca 0.00 2.71 0.01 0.00 0.00 0.00 0.00 44.72 47.44 2ajc s GLY 302 CO 0.00 1.73 -0.05 0.14 0.00 0.00 0.00 173.10 174.92 2ajc s VAL 303 N -0.00 0.59 -0.12 1.40 1.01 -1.26 -0.69 120.40 121.32 2ajc s VAL 303 Ca 0.03 -0.15 -0.04 0.00 0.00 0.00 0.00 61.98 61.83 2ajc s VAL 303 Cb -0.04 -0.61 0.05 0.00 0.00 0.00 0.00 36.38 35.78 2ajc s VAL 303 CO -0.07 0.24 0.08 -0.89 0.00 0.00 0.00 175.10 174.46 2ajc s THR 304 N 0.93 -0.08 0.13 3.92 2.01 0.02 -5.01 115.64 117.56 2ajc s THR 304 Ca -0.11 0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.65 2ajc s THR 304 Cb -0.14 -0.42 -0.07 0.00 0.01 0.00 0.00 72.50 71.88 2ajc s THR 304 CO 0.00 -0.10 1.17 0.26 -0.69 0.00 0.00 174.62 175.27 2ajc s TRP 305 N 2.15 3.47 -0.19 4.92 0.52 -1.26 -0.31 118.94 128.24 2ajc s TRP 305 Ca 0.03 1.41 -0.14 0.00 0.02 0.00 0.00 56.10 57.42 2ajc s TRP 305 Cb -0.14 -3.39 -0.08 0.00 -1.15 0.00 0.00 33.47 28.71 2ajc s TRP 305 CO -0.07 -1.09 -0.32 0.28 0.02 0.00 0.00 176.95 175.77 2ajc n VAL 306 N 3.08 1.42 -4.27 4.03 0.31 -0.00 -4.92 118.33 117.99 2ajc n VAL 306 Ca 0.06 -0.05 -0.19 0.00 -0.01 0.00 0.00 64.34 64.14 2ajc n VAL 306 Cb 0.46 -2.08 -0.07 0.00 -0.91 0.00 0.00 33.84 31.23 2ajc n VAL 306 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2ajc n THR 307 N -4.25 0.00 0.33 2.52 -2.24 -0.81 -4.78 114.28 105.04 2ajc n THR 307 Ca -0.28 -2.43 0.22 0.00 -2.27 0.00 0.00 64.05 59.29 2ajc n THR 307 Cb 0.63 1.24 1.16 0.00 -2.10 0.00 0.00 70.33 71.26 2ajc n THR 307 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2ajc h GLU 308 N 0.00 0.00 0.00 -0.78 4.39 -1.98 -2.79 114.58 113.42 2ajc h GLU 308 Ca -0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.46 2ajc h GLU 308 Cb 1.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.88 2ajc h GLU 308 CO 0.35 0.00 -0.08 0.39 -1.16 0.00 0.00 179.01 178.51 2ajc n GLU 309 N -3.03 1.28 -3.69 2.33 1.02 -1.26 -4.92 120.64 112.36 2ajc n GLU 309 Ca -0.03 -2.09 -0.14 0.00 -0.02 0.00 0.00 57.16 54.88 2ajc n GLU 309 Cb 0.08 -1.23 -0.14 0.00 -0.02 0.00 0.00 31.44 30.13 2ajc n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2ajc s ARG 310 N -2.04 0.11 0.00 3.49 3.52 -1.05 -0.90 118.95 122.09 2ajc s ARG 310 Ca 0.21 0.58 0.06 0.00 -0.13 0.00 0.00 55.73 56.45 2ajc s ARG 310 Cb 0.18 -0.15 -0.02 0.00 -1.56 0.00 0.00 34.95 33.40 2ajc s ARG 310 CO 0.02 -0.25 -0.18 -1.50 -0.81 0.00 0.00 175.30 172.59 2ajc s ILE 311 N 1.93 1.40 -0.20 4.11 2.07 -0.61 -0.82 121.20 129.08 2ajc s ILE 311 Ca -0.02 -0.86 -0.04 0.00 -1.41 0.00 0.00 60.65 58.31 2ajc s ILE 311 Cb -0.12 -1.18 -0.02 0.00 0.13 0.00 0.00 42.46 41.27 2ajc s ILE 311 CO -0.07 0.30 -0.03 -0.55 -1.91 0.00 0.00 174.94 172.68 2ajc s SER 312 N -0.65 4.53 -0.11 4.50 0.15 0.58 -0.69 113.70 122.01 2ajc s SER 312 Ca 0.06 -0.29 -0.01 0.00 0.70 0.00 0.00 55.95 56.41 2ajc s SER 312 Cb -0.07 -1.77 -0.03 0.00 -1.71 0.00 0.00 66.02 62.44 2ajc s SER 312 CO 0.00 0.04 -0.06 -0.76 1.20 0.00 0.00 173.24 173.65 2ajc s LEU 313 N 1.15 3.14 -0.16 3.45 1.43 0.13 -0.80 118.68 127.03 2ajc s LEU 313 Ca 0.02 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 53.01 2ajc s LEU 313 Cb -0.15 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 2ajc s LEU 313 CO 0.00 0.26 -0.12 -1.58 0.23 0.00 0.00 176.35 175.14 2ajc s GLN 314 N -0.19 3.34 0.18 1.70 0.74 0.13 -0.40 119.66 125.16 2ajc s GLN 314 Ca 0.03 -0.69 0.09 0.00 0.05 0.00 0.00 55.36 54.84 2ajc s GLN 314 Cb -0.13 -2.71 -0.04 0.00 1.10 0.00 0.00 33.01 31.23 2ajc s GLN 314 CO 0.03 0.07 -0.19 -1.58 -0.55 0.00 0.00 175.29 173.06 2ajc s TRP 315 N 0.71 1.95 0.00 1.67 0.52 -0.36 -0.19 118.94 123.24 2ajc s TRP 315 Ca -0.06 -0.44 -0.02 0.00 0.02 0.00 0.00 56.10 55.61 2ajc s TRP 315 Cb -0.15 -0.96 -0.01 0.00 -1.15 0.00 0.00 33.47 31.20 2ajc s TRP 315 CO 0.02 0.39 0.03 -1.50 0.02 0.00 0.00 176.95 175.90 2ajc s ILE 316 N -2.01 0.05 0.68 2.03 2.07 -0.30 -0.62 121.20 123.10 2ajc s ILE 316 Ca 0.18 -0.44 -0.13 0.00 -1.41 0.00 0.00 60.65 58.85 2ajc s ILE 316 Cb -0.06 -0.19 0.01 0.00 0.13 0.00 0.00 42.46 42.35 2ajc s ILE 316 CO 0.08 -0.24 1.07 -0.13 -1.91 0.00 0.00 174.94 173.81 2ajc s ARG 317 N -0.74 2.86 0.48 3.50 0.52 -0.57 -0.22 118.95 124.79 2ajc s ARG 317 Ca -0.08 1.15 0.19 0.00 -0.52 0.00 0.00 55.73 56.47 2ajc s ARG 317 Cb -0.05 -1.97 1.22 0.00 0.52 0.00 0.00 34.95 34.67 2ajc s ARG 317 CO -0.00 -1.17 2.00 -0.09 0.02 0.00 0.00 175.30 176.05 2ajc h ARG 318 N -0.38 0.18 0.00 3.54 2.43 -1.35 0.19 114.38 118.99 2ajc h ARG 318 Ca -0.45 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.69 2ajc h ARG 318 Cb 1.22 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2ajc h ARG 318 CO 0.55 0.12 -0.11 0.00 -1.51 0.00 0.00 179.97 179.02 2ajc h ALA 319 N 1.74 1.20 -1.25 2.80 0.00 -1.91 -3.45 119.26 118.38 2ajc h ALA 319 Ca 0.25 -0.10 -0.29 0.00 0.00 0.00 0.00 54.91 54.77 2ajc h ALA 319 Cb 0.74 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 2ajc h ALA 319 CO -0.04 0.14 -0.31 1.04 0.00 0.00 0.00 179.25 180.08 2ajc n GLN 320 N -3.52 -1.05 -0.02 0.00 6.02 0.66 -4.68 117.38 114.78 2ajc n GLN 320 Ca -0.01 0.87 0.03 0.00 -0.01 0.00 0.00 57.00 57.88 2ajc n GLN 320 Cb 0.25 -5.06 0.04 0.00 1.02 0.00 0.00 30.24 26.50 2ajc n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2ajc n ASN 321 N -0.48 2.08 -3.54 1.08 6.94 -1.26 -1.58 115.26 118.50 2ajc n ASN 321 Ca -0.15 -2.34 -0.16 0.00 -0.02 0.00 0.00 54.58 51.91 2ajc n ASN 321 Cb 0.54 -0.14 -0.13 0.00 -2.36 0.00 0.00 39.78 37.69 2ajc n ASN 321 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 2ajc s TYR 322 N -1.58 -0.35 0.18 -2.53 6.14 -1.26 -1.53 117.35 116.41 2ajc s TYR 322 Ca 0.10 0.49 0.06 0.00 0.64 0.00 0.00 57.07 58.36 2ajc s TYR 322 Cb 0.09 -0.24 -0.05 0.00 0.42 0.00 0.00 41.96 42.18 2ajc s TYR 322 CO 0.01 -0.52 -0.12 -1.54 0.64 0.00 0.00 175.55 174.02 2ajc s SER 323 N 2.37 2.16 -0.06 4.32 1.04 0.01 -1.51 113.70 122.03 2ajc s SER 323 Ca 0.06 -1.02 -0.05 0.00 0.48 0.00 0.00 55.95 55.42 2ajc s SER 323 Cb -0.14 -0.07 0.02 0.00 0.10 0.00 0.00 66.02 65.93 2ajc s SER 323 CO -0.11 -0.26 0.15 -0.51 0.98 0.00 0.00 173.24 173.49 2ajc s ILE 324 N -3.16 -0.01 -0.19 -1.02 2.07 0.21 -0.81 121.20 118.28 2ajc s ILE 324 Ca 0.20 0.05 -0.11 0.00 -1.41 0.00 0.00 60.65 59.37 2ajc s ILE 324 Cb 0.01 -0.23 -0.05 0.00 0.13 0.00 0.00 42.46 42.32 2ajc s ILE 324 CO 0.04 0.02 0.19 -0.63 -1.91 0.00 0.00 174.94 172.64 2ajc s ILE 325 N 0.38 5.37 -0.22 2.00 1.01 0.23 -1.22 121.20 128.75 2ajc s ILE 325 Ca -0.02 0.30 0.02 0.00 0.00 0.00 0.00 60.65 60.94 2ajc s ILE 325 Cb -0.04 -3.53 0.04 0.00 0.01 0.00 0.00 42.46 38.95 2ajc s ILE 325 CO -0.02 0.41 -0.13 -0.62 0.00 0.00 0.00 174.94 174.58 2ajc s ASP 326 N 0.50 3.72 -0.44 3.58 2.15 0.46 -1.07 116.67 125.57 2ajc s ASP 326 Ca 0.11 -1.02 -0.14 0.00 0.43 0.00 0.00 52.55 51.93 2ajc s ASP 326 Cb -0.12 -1.42 0.05 0.00 -0.30 0.00 0.00 42.92 41.13 2ajc s ASP 326 CO 0.01 -0.12 0.33 -0.63 -0.17 0.00 0.00 175.17 174.58 2ajc s ILE 327 N 1.26 5.08 -0.15 4.11 1.01 -1.11 -0.69 121.20 130.70 2ajc s ILE 327 Ca -0.02 -0.94 -0.06 0.00 0.00 0.00 0.00 60.65 59.63 2ajc s ILE 327 Cb -0.17 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.31 2ajc s ILE 327 CO -0.08 -0.44 0.07 0.00 0.00 0.00 0.00 174.94 174.48 2ajc s ASP 329 N -0.15 5.25 0.08 0.00 1.01 -0.31 -1.57 116.67 120.99 2ajc s ASP 329 Ca 0.08 0.11 -0.31 0.00 0.71 0.00 0.00 52.55 53.14 2ajc s ASP 329 Cb -0.12 -1.59 -0.07 0.00 1.01 0.00 0.00 42.92 42.16 2ajc s ASP 329 CO 0.01 0.33 1.29 -0.47 0.21 0.00 0.00 175.17 176.54 2ajc s TYR 330 N -0.58 3.32 -0.49 4.23 5.04 -0.08 0.13 117.35 128.92 2ajc s TYR 330 Ca 0.10 1.12 -0.16 0.00 -2.44 0.00 0.00 57.07 55.69 2ajc s TYR 330 Cb -0.12 -3.55 0.09 0.00 0.35 0.00 0.00 41.96 38.73 2ajc s TYR 330 CO 0.02 -1.83 0.44 0.34 -1.34 0.00 0.00 175.55 173.18 2ajc s ASP 331 N 1.12 6.16 0.56 4.32 2.15 0.73 -4.94 116.67 126.77 2ajc s ASP 331 Ca 0.62 -1.44 0.26 0.00 0.43 0.00 0.00 52.55 52.42 2ajc s ASP 331 Cb -0.33 -2.20 1.50 0.00 -0.30 0.00 0.00 42.92 41.59 2ajc s ASP 331 CO 0.29 -0.73 2.04 -0.33 -0.17 0.00 0.00 175.17 176.28 2ajc h GLU 332 N 8.81 0.00 0.00 4.34 5.08 -1.94 0.20 114.58 131.07 2ajc h GLU 332 Ca -0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 2ajc h GLU 332 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2ajc h GLU 332 CO 0.93 0.00 -0.01 0.66 -1.00 0.00 0.00 179.01 179.59 2ajc h SER 333 N 0.00 0.00 0.00 1.42 4.64 -1.96 -3.37 113.55 114.28 2ajc h SER 333 Ca 0.15 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2ajc h SER 333 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2ajc h SER 333 CO -0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 2ajc n THR 334 N -2.58 0.00 -0.93 2.95 -2.24 -0.83 -5.02 114.28 105.64 2ajc n THR 334 Ca 0.05 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2ajc n THR 334 Cb 0.47 1.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.78 2ajc n THR 334 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ajc n GLY 335 N 0.40 0.83 3.92 3.38 0.00 0.65 -5.02 105.19 109.36 2ajc n GLY 335 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 2ajc n GLY 335 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ajc s ARG 336 N -0.15 3.00 -0.30 1.61 1.70 -1.25 -4.79 118.95 118.77 2ajc s ARG 336 Ca 0.00 -0.11 -0.05 0.00 -0.47 0.00 0.00 55.73 55.10 2ajc s ARG 336 Cb 0.00 -2.35 0.02 0.00 -0.57 0.00 0.00 34.95 32.05 2ajc s ARG 336 CO 0.00 -0.56 0.06 -1.58 -1.08 0.00 0.00 175.30 172.13 2ajc s TRP 337 N -2.87 3.17 -0.12 5.89 0.52 -1.26 -0.20 118.94 124.07 2ajc s TRP 337 Ca 0.52 -1.25 -0.13 0.00 0.02 0.00 0.00 56.10 55.26 2ajc s TRP 337 Cb -0.10 -2.22 -0.05 0.00 -1.15 0.00 0.00 33.47 29.95 2ajc s TRP 337 CO 0.43 -0.66 0.29 0.42 0.02 0.00 0.00 176.95 177.46 2ajc s ILE 338 N 1.43 5.28 0.15 2.03 1.01 0.12 -4.79 121.20 126.44 2ajc s ILE 338 Ca 0.01 0.55 0.02 0.00 0.00 0.00 0.00 60.65 61.23 2ajc s ILE 338 Cb -0.18 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 2ajc s ILE 338 CO 0.01 0.46 0.30 -0.55 0.00 0.00 0.00 174.94 175.15 2ajc s SER 339 N -0.04 6.34 -0.13 3.58 0.15 -1.26 -1.16 113.70 121.19 2ajc s SER 339 Ca 0.18 0.20 -0.11 0.00 0.70 0.00 0.00 55.95 56.91 2ajc s SER 339 Cb -0.13 -1.92 0.03 0.00 -1.71 0.00 0.00 66.02 62.29 2ajc s SER 339 CO 0.06 0.04 0.34 -0.55 1.20 0.00 0.00 173.24 174.33 2ajc s SER 340 N -3.22 -0.36 0.47 5.45 0.15 -1.26 -5.03 113.70 109.89 2ajc s SER 340 Ca 0.35 0.69 0.19 0.00 0.70 0.00 0.00 55.95 57.88 2ajc s SER 340 Cb -0.11 0.69 1.17 0.00 -1.71 0.00 0.00 66.02 66.06 2ajc s SER 340 CO 0.29 -0.12 1.96 0.58 1.20 0.00 0.00 173.24 177.14 2ajc h VAL 341 N 4.70 0.80 0.00 4.45 2.07 -1.98 0.23 116.25 126.51 2ajc h VAL 341 Ca -0.27 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 2ajc h VAL 341 Cb 1.19 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 2ajc h VAL 341 CO 0.30 0.05 -0.21 0.00 0.02 0.00 0.00 177.57 177.72 2ajc h ALA 342 N 1.69 1.54 -0.54 1.67 0.00 -1.95 -2.68 119.26 118.99 2ajc h ALA 342 Ca 0.30 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2ajc h ALA 342 Cb 0.84 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2ajc h ALA 342 CO -0.07 0.27 0.00 0.54 0.00 0.00 0.00 179.25 179.99 2ajc n ARG 343 N -4.13 4.28 -4.36 0.00 1.74 0.06 -3.84 116.66 110.41 2ajc n ARG 343 Ca -0.02 -2.81 -0.35 0.00 -0.77 0.00 0.00 57.85 53.90 2ajc n ARG 343 Cb 0.28 -2.11 -0.09 0.00 -1.02 0.00 0.00 32.46 29.52 2ajc n ARG 343 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2ajc s GLN 344 N -2.39 3.00 -0.12 5.56 -0.21 -1.01 -2.75 119.66 121.74 2ajc s GLN 344 Ca 0.49 -0.40 -0.01 0.00 0.02 0.00 0.00 55.36 55.46 2ajc s GLN 344 Cb 0.36 -2.81 0.03 0.00 1.00 0.00 0.00 33.01 31.59 2ajc s GLN 344 CO 0.17 0.70 -0.02 -1.01 -2.12 0.00 0.00 175.29 173.01 2ajc s HIS 345 N -0.88 1.11 0.03 0.91 3.76 -0.24 -4.89 115.29 115.08 2ajc s HIS 345 Ca 0.13 -0.57 -0.12 0.00 -0.15 0.00 0.00 55.06 54.36 2ajc s HIS 345 Cb -0.11 -1.03 -0.06 0.00 1.11 0.00 0.00 32.58 32.49 2ajc s HIS 345 CO 0.02 -0.47 0.38 0.42 -0.85 0.00 0.00 174.74 174.24 2ajc s ILE 346 N 1.83 5.11 -0.05 0.60 1.01 -1.26 -0.60 121.20 127.83 2ajc s ILE 346 Ca 0.03 0.59 0.01 0.00 0.00 0.00 0.00 60.65 61.28 2ajc s ILE 346 Cb -0.13 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.71 2ajc s ILE 346 CO -0.07 0.45 -0.05 -0.70 0.00 0.00 0.00 174.94 174.57 2ajc s GLU 347 N -1.47 0.94 0.30 2.79 2.12 0.01 -5.00 118.70 118.39 2ajc s GLU 347 Ca 0.27 -0.12 0.03 0.00 0.36 0.00 0.00 54.97 55.51 2ajc s GLU 347 Cb -0.15 -0.96 -0.05 0.00 0.26 0.00 0.00 34.13 33.23 2ajc s GLU 347 CO 0.15 -0.11 0.10 0.96 -0.54 0.00 0.00 175.26 175.82 2ajc s ILE 348 N 1.08 0.70 -0.02 -3.70 -4.36 -1.26 -0.81 121.20 112.84 2ajc s ILE 348 Ca -0.08 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.31 2ajc s ILE 348 Cb -0.14 -2.63 0.02 0.00 1.25 0.00 0.00 42.46 40.96 2ajc s ILE 348 CO -0.01 0.00 0.00 -0.55 0.24 0.00 0.00 174.94 174.62 2ajc s SER 349 N -3.41 0.24 -0.03 4.36 0.15 -0.58 -4.92 113.70 109.52 2ajc s SER 349 Ca 0.35 -0.01 0.21 0.00 0.70 0.00 0.00 55.95 57.20 2ajc s SER 349 Cb 0.07 -0.11 -0.31 0.00 -1.71 0.00 0.00 66.02 63.95 2ajc s SER 349 CO 0.15 -0.07 0.48 0.35 1.20 0.00 0.00 173.24 175.35 2ajc n THR 350 N 3.78 0.00 0.93 6.45 -2.24 -1.26 -4.40 114.28 117.54 2ajc n THR 350 Ca -0.22 -0.44 0.10 0.00 -2.27 0.00 0.00 64.05 61.21 2ajc n THR 350 Cb 0.53 0.09 -0.08 0.00 -2.10 0.00 0.00 70.33 68.78 2ajc n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2ajc n THR 351 N -2.17 0.00 0.00 4.28 -2.24 -1.26 -5.05 114.28 107.84 2ajc n THR 351 Ca -0.03 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2ajc n THR 351 Cb 0.52 1.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.83 2ajc n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ajc n GLY 352 N 1.43 1.15 3.90 3.38 0.00 -1.26 -4.82 105.19 108.97 2ajc n GLY 352 Ca 0.05 0.23 -0.20 0.00 0.00 0.00 0.00 46.02 46.10 2ajc n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2ajc s TRP 353 N 1.58 2.84 -0.07 1.61 -2.14 -1.26 -4.65 118.94 116.86 2ajc s TRP 353 Ca 0.00 -0.38 -0.22 0.00 2.66 0.00 0.00 56.10 58.16 2ajc s TRP 353 Cb 0.00 -2.04 -0.04 0.00 -3.10 0.00 0.00 33.47 28.29 2ajc s TRP 353 CO 0.00 -0.04 0.66 0.08 -2.66 0.00 0.00 176.95 174.99 2ajc s VAL 354 N -2.36 5.05 0.00 -0.66 1.01 -0.62 -4.78 120.40 118.05 2ajc s VAL 354 Ca 0.46 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.79 2ajc s VAL 354 Cb -0.06 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.32 2ajc s VAL 354 CO 0.29 0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.27 2ajc n GLY 355 N 3.06 -1.83 0.06 4.51 0.00 -1.26 -3.81 105.19 105.92 2ajc n GLY 355 Ca -0.03 -1.34 -0.03 0.00 0.00 0.00 0.00 46.02 44.63 2ajc n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2ajc h ARG 356 N 0.00 0.00 0.00 1.61 3.08 -1.93 -3.43 114.38 113.71 2ajc h ARG 356 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ajc h ARG 356 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2ajc h ARG 356 CO 0.00 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.09 2ajc n PHE 357 N -4.68 0.00 -3.58 3.04 3.72 -1.26 -4.89 117.46 109.81 2ajc n PHE 357 Ca -0.04 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.30 2ajc n PHE 357 Cb 0.17 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.68 2ajc n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 2ajc s ARG 358 N -0.58 0.41 0.60 -1.08 1.70 -1.26 -4.93 118.95 113.82 2ajc s ARG 358 Ca 0.00 -0.14 -0.19 0.00 -0.47 0.00 0.00 55.73 54.93 2ajc s ARG 358 Cb 0.00 0.19 -0.03 0.00 -0.57 0.00 0.00 34.95 34.54 2ajc s ARG 358 CO 0.00 -0.18 1.26 -1.25 -1.08 0.00 0.00 175.30 174.06 2ajc s PRO 359 N -2.46 2.85 0.61 3.89 0.04 -1.25 -4.33 135.00 134.35 2ajc s PRO 359 Ca 0.08 1.98 -0.17 0.00 0.04 0.00 0.00 61.00 62.94 2ajc s PRO 359 Cb -0.01 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.55 2ajc s PRO 359 CO -0.05 -1.34 1.12 0.00 0.04 0.00 0.00 177.00 176.77 2ajc s ALA 360 N -1.46 2.56 0.30 8.56 0.00 -1.26 -4.96 121.76 125.49 2ajc s ALA 360 Ca 0.78 0.68 -0.21 0.00 0.00 0.00 0.00 51.96 53.21 2ajc s ALA 360 Cb -0.35 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.34 2ajc s ALA 360 CO 0.38 -1.08 0.83 -1.21 0.00 0.00 0.00 175.76 174.68 2ajc s GLU 361 N -3.73 4.32 0.31 0.00 0.41 -1.26 -4.86 118.70 113.89 2ajc s GLU 361 Ca 0.70 1.03 -0.25 0.00 -0.41 0.00 0.00 54.97 56.03 2ajc s GLU 361 Cb -0.22 -2.69 -0.10 0.00 -1.78 0.00 0.00 34.13 29.34 2ajc s GLU 361 CO 0.35 0.26 0.91 -1.25 -0.49 0.00 0.00 175.26 175.04 2ajc s PRO 362 N -2.32 4.52 -0.32 0.39 0.04 -1.26 -4.61 135.00 131.45 2ajc s PRO 362 Ca 0.50 1.25 0.01 0.00 0.04 0.00 0.00 61.00 62.80 2ajc s PRO 362 Cb -0.15 -2.80 0.08 0.00 0.04 0.00 0.00 34.50 31.66 2ajc s PRO 362 CO 0.20 0.29 0.03 -1.01 0.04 0.00 0.00 177.00 176.55 2ajc s HIS 363 N -1.61 3.49 0.37 0.56 3.76 0.18 -4.93 115.29 117.11 2ajc s HIS 363 Ca 0.49 -2.46 -0.16 0.00 -0.15 0.00 0.00 55.06 52.77 2ajc s HIS 363 Cb -0.18 -2.54 -0.09 0.00 1.11 0.00 0.00 32.58 30.88 2ajc s HIS 363 CO 0.23 -0.90 0.82 -0.06 -0.85 0.00 0.00 174.74 173.98 2ajc s PHE 364 N 1.08 3.37 0.84 1.40 0.40 -1.26 -0.60 117.98 123.21 2ajc s PHE 364 Ca 0.02 1.33 -0.11 0.00 -0.60 0.00 0.00 56.93 57.56 2ajc s PHE 364 Cb -0.20 -2.64 0.10 0.00 0.51 0.00 0.00 43.02 40.79 2ajc s PHE 364 CO -0.05 -0.02 1.09 0.95 0.70 0.00 0.00 175.22 177.90 2ajc s THR 365 N -2.12 2.87 0.36 0.64 -4.23 -0.83 -4.89 115.64 107.44 2ajc s THR 365 Ca 0.57 0.28 0.06 0.00 -1.18 0.00 0.00 61.69 61.42 2ajc s THR 365 Cb -0.10 -2.90 0.30 0.00 1.34 0.00 0.00 72.50 71.14 2ajc s THR 365 CO 0.18 -0.37 1.94 -1.28 -0.54 0.00 0.00 174.62 174.55 2ajc h SER 366 N -1.31 0.68 1.91 3.99 0.87 -1.92 -0.53 113.55 117.25 2ajc h SER 366 Ca -0.48 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2ajc h SER 366 Cb 1.28 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2ajc h SER 366 CO 0.57 0.43 0.00 -2.24 -0.53 0.00 0.00 176.83 175.05 2ajc h ASP 367 N 0.77 0.00 -0.01 6.23 2.03 -1.91 -3.46 116.42 120.07 2ajc h ASP 367 Ca 0.34 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.64 2ajc h ASP 367 Cb 0.34 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.84 2ajc h ASP 367 CO -0.12 0.00 -0.00 0.61 -1.03 0.00 0.00 179.24 178.69 2ajc n GLY 368 N 1.10 0.45 0.04 7.15 0.00 -0.21 -4.92 105.19 108.80 2ajc n GLY 368 Ca 0.04 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2ajc n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ajc n ASN 369 N -0.05 0.44 -3.92 1.61 5.03 -1.26 -4.77 115.26 112.35 2ajc n ASN 369 Ca -0.00 0.30 -0.09 0.00 0.87 0.00 0.00 54.58 55.66 2ajc n ASN 369 Cb 0.06 -0.30 -0.05 0.00 -1.02 0.00 0.00 39.78 38.47 2ajc n ASN 369 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2ajc s SER 370 N -3.63 -0.12 0.17 6.41 1.04 -1.26 0.12 113.70 116.43 2ajc s SER 370 Ca 0.11 -0.79 -0.12 0.00 0.48 0.00 0.00 55.95 55.63 2ajc s SER 370 Cb 0.16 0.57 0.01 0.00 0.10 0.00 0.00 66.02 66.85 2ajc s SER 370 CO 0.62 -1.09 0.37 0.72 0.98 0.00 0.00 173.24 174.84 2ajc s PHE 371 N -3.97 0.17 -0.02 5.02 -0.12 0.51 -1.96 117.98 117.61 2ajc s PHE 371 Ca 0.18 -0.52 0.08 0.00 -0.05 0.00 0.00 56.93 56.61 2ajc s PHE 371 Cb -0.00 0.13 -0.02 0.00 -0.63 0.00 0.00 43.02 42.49 2ajc s PHE 371 CO 0.04 -0.78 -0.25 0.71 -0.05 0.00 0.00 175.22 174.89 2ajc s TYR 372 N -3.92 2.26 -0.21 3.49 1.51 0.23 -0.06 117.35 120.66 2ajc s TYR 372 Ca 0.13 -0.43 -0.22 0.00 -1.01 0.00 0.00 57.07 55.54 2ajc s TYR 372 Cb 0.02 -1.46 0.06 0.00 -0.11 0.00 0.00 41.96 40.47 2ajc s TYR 372 CO -0.02 -0.04 0.60 0.21 -1.11 0.00 0.00 175.55 175.19 2ajc s LYS 373 N -0.58 0.73 -0.06 -0.62 2.20 -0.64 0.47 119.74 121.24 2ajc s LYS 373 Ca 0.09 0.76 -0.30 0.00 -0.36 0.00 0.00 55.97 56.17 2ajc s LYS 373 Cb -0.10 0.35 -0.02 0.00 -1.51 0.00 0.00 37.83 36.55 2ajc s LYS 373 CO -0.01 -0.11 1.03 0.42 -0.36 0.00 0.00 175.35 176.33 2ajc s ILE 374 N 0.15 4.71 0.07 5.43 1.01 -1.26 -0.81 121.20 130.50 2ajc s ILE 374 Ca -0.01 1.96 -0.07 0.00 0.00 0.00 0.00 60.65 62.53 2ajc s ILE 374 Cb -0.04 -4.26 -0.01 0.00 0.01 0.00 0.00 42.46 38.16 2ajc s ILE 374 CO 0.02 0.06 0.14 0.27 0.00 0.00 0.00 174.94 175.43 2ajc s ILE 375 N 1.66 0.15 0.19 2.92 -4.36 -0.58 -4.45 121.20 116.72 2ajc s ILE 375 Ca 0.51 -1.27 -0.31 0.00 -0.26 0.00 0.00 60.65 59.33 2ajc s ILE 375 Cb -0.21 -1.30 -0.09 0.00 1.25 0.00 0.00 42.46 42.11 2ajc s ILE 375 CO 0.22 -0.70 1.44 -0.44 0.24 0.00 0.00 174.94 175.70 2ajc s SER 376 N -2.74 6.72 0.65 4.36 0.01 -1.26 -1.50 113.70 119.94 2ajc s SER 376 Ca 0.04 2.53 -0.02 0.00 1.31 0.00 0.00 55.95 59.81 2ajc s SER 376 Cb 0.04 -2.60 0.08 0.00 0.21 0.00 0.00 66.02 63.75 2ajc s SER 376 CO -0.10 -0.69 0.55 -0.46 0.41 0.00 0.00 173.24 172.95 2ajc n ASN 377 N 3.19 0.57 0.19 2.44 0.23 0.07 -4.89 115.26 117.04 2ajc n ASN 377 Ca 0.10 -1.52 0.13 0.00 -0.53 0.00 0.00 54.58 52.76 2ajc n ASN 377 Cb 0.41 -0.37 0.66 0.00 -2.08 0.00 0.00 39.78 38.40 2ajc n ASN 377 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2ajc h GLU 378 N 0.00 0.00 -0.26 -3.83 3.07 -1.96 -0.67 114.58 110.93 2ajc h GLU 378 Ca -0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.68 2ajc h GLU 378 Cb 0.62 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.53 2ajc h GLU 378 CO 0.18 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 178.18 2ajc n GLU 379 N -2.43 2.45 -0.71 2.33 1.02 -1.26 -4.94 120.64 117.09 2ajc n GLU 379 Ca -0.01 -2.16 0.00 0.00 -0.02 0.00 0.00 57.16 54.98 2ajc n GLU 379 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2ajc n GLU 379 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ajc n GLY 380 N 1.46 0.60 3.49 0.62 0.00 -0.26 -4.85 105.19 106.25 2ajc n GLY 380 Ca 0.18 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 2ajc n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ajc s TYR 381 N -2.00 2.90 -0.28 1.61 1.51 -1.26 0.13 117.35 119.96 2ajc s TYR 381 Ca 0.00 -0.27 -0.29 0.00 -1.01 0.00 0.00 57.07 55.50 2ajc s TYR 381 Cb 0.00 -1.81 -0.01 0.00 -0.11 0.00 0.00 41.96 40.03 2ajc s TYR 381 CO 0.00 0.06 1.44 0.15 -1.11 0.00 0.00 175.55 176.09 2ajc s LYS 382 N -0.14 3.83 0.27 -0.62 1.02 -1.26 -0.75 119.74 122.09 2ajc s LYS 382 Ca 0.01 1.37 0.02 0.00 0.02 0.00 0.00 55.97 57.39 2ajc s LYS 382 Cb -0.13 -3.96 -0.05 0.00 -0.52 0.00 0.00 37.83 33.17 2ajc s LYS 382 CO 0.03 -1.24 0.08 -1.01 -0.92 0.00 0.00 175.35 172.29 2ajc s HIS 383 N 4.83 1.62 -0.13 3.18 3.76 -0.56 -1.26 115.29 126.73 2ajc s HIS 383 Ca 0.63 -1.13 -0.26 0.00 -0.15 0.00 0.00 55.06 54.15 2ajc s HIS 383 Cb -0.19 -0.97 -0.02 0.00 1.11 0.00 0.00 32.58 32.50 2ajc s HIS 383 CO 0.26 -0.26 0.86 0.42 -0.85 0.00 0.00 174.74 175.18 2ajc s ILE 384 N -3.65 4.88 -0.07 0.60 1.01 -1.26 -1.53 121.20 121.18 2ajc s ILE 384 Ca 0.37 1.72 0.02 0.00 0.00 0.00 0.00 60.65 62.76 2ajc s ILE 384 Cb 0.08 -4.17 -0.03 0.00 0.01 0.00 0.00 42.46 38.35 2ajc s ILE 384 CO 0.14 0.06 -0.10 0.00 0.00 0.00 0.00 174.94 175.04 2ajc s HIS 386 N -0.72 3.29 0.02 0.00 2.46 0.59 -1.62 115.29 119.30 2ajc s HIS 386 Ca 0.11 0.33 0.04 0.00 0.47 0.00 0.00 55.06 56.02 2ajc s HIS 386 Cb -0.11 -2.43 -0.03 0.00 -0.13 0.00 0.00 32.58 29.87 2ajc s HIS 386 CO 0.01 -0.09 -0.09 -0.06 -2.47 0.00 0.00 174.74 172.04 2ajc s PHE 387 N 1.56 2.80 -0.05 3.88 0.40 0.92 -1.77 117.98 125.72 2ajc s PHE 387 Ca 0.12 -0.10 -0.15 0.00 -0.60 0.00 0.00 56.93 56.20 2ajc s PHE 387 Cb -0.15 -1.56 -0.05 0.00 0.51 0.00 0.00 43.02 41.77 2ajc s PHE 387 CO 0.08 0.35 0.39 -1.14 0.70 0.00 0.00 175.22 175.60 2ajc s GLN 388 N -1.51 4.03 0.32 0.44 2.00 -1.26 -0.37 119.66 123.31 2ajc s GLN 388 Ca 0.17 0.35 0.05 0.00 -2.00 0.00 0.00 55.36 53.93 2ajc s GLN 388 Cb -0.11 -3.29 0.68 0.00 0.80 0.00 0.00 33.01 31.09 2ajc s GLN 388 CO 0.08 0.53 1.86 1.15 -0.50 0.00 0.00 175.29 178.40 2ajc h THR 389 N 4.06 0.89 -0.59 -0.34 2.02 -0.62 -2.54 112.91 115.78 2ajc h THR 389 Ca -0.48 -0.29 -0.17 0.00 0.77 0.00 0.00 66.41 66.23 2ajc h THR 389 Cb 1.20 -0.03 -0.10 0.00 -1.74 0.00 0.00 68.15 67.48 2ajc h THR 389 CO 0.66 0.15 0.17 -0.90 0.37 0.00 0.00 175.52 175.98 2ajc n ASP 390 N -4.58 4.29 -4.17 4.18 5.68 -1.26 -4.30 116.55 116.39 2ajc n ASP 390 Ca 0.18 -3.27 -0.14 0.00 -0.50 0.00 0.00 54.79 51.05 2ajc n ASP 390 Cb 0.39 -0.69 -0.11 0.00 -1.14 0.00 0.00 41.12 39.57 2ajc n ASP 390 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 2ajc s LYS 391 N -3.01 0.83 0.08 0.11 -0.14 -0.96 -4.76 119.74 111.88 2ajc s LYS 391 Ca 0.51 -1.13 0.20 0.00 -1.36 0.00 0.00 55.97 54.20 2ajc s LYS 391 Cb 0.42 -0.53 -0.14 0.00 -1.68 0.00 0.00 37.83 35.90 2ajc s LYS 391 CO 0.11 0.08 0.77 -1.13 -0.76 0.00 0.00 175.35 174.42 2ajc n SER 392 N 0.64 0.60 -4.85 2.83 3.41 -1.26 -4.45 113.62 110.53 2ajc n SER 392 Ca -0.17 0.25 -0.33 0.00 -0.26 0.00 0.00 58.87 58.36 2ajc n SER 392 Cb 0.57 0.74 -0.06 0.00 -0.26 0.00 0.00 64.21 65.21 2ajc n SER 392 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2ajc s ASN 393 N -5.31 6.76 0.28 4.04 2.20 -1.26 -5.01 114.94 116.63 2ajc s ASN 393 Ca -0.04 1.10 0.05 0.00 -0.94 0.00 0.00 52.86 53.03 2ajc s ASN 393 Cb 0.10 -2.30 -0.06 0.00 -2.00 0.00 0.00 41.25 36.99 2ajc s ASN 393 CO 0.83 -0.05 -0.00 0.00 -2.94 0.00 0.00 177.10 174.93 2ajc s THR 395 N -3.24 1.96 0.17 0.00 2.01 -0.73 -4.90 115.64 110.91 2ajc s THR 395 Ca 0.32 -0.94 -0.30 0.00 0.31 0.00 0.00 61.69 61.08 2ajc s THR 395 Cb 0.06 -1.72 -0.08 0.00 0.01 0.00 0.00 72.50 70.77 2ajc s THR 395 CO 0.12 0.53 1.18 -0.36 -0.69 0.00 0.00 174.62 175.40 2ajc s PHE 396 N 0.64 3.46 -0.88 4.92 0.08 -1.26 -0.30 117.98 124.64 2ajc s PHE 396 Ca -0.12 1.44 0.13 0.00 0.12 0.00 0.00 56.93 58.50 2ajc s PHE 396 Cb -0.16 -3.40 -0.08 0.00 -0.57 0.00 0.00 43.02 38.81 2ajc s PHE 396 CO 0.03 -1.09 0.64 0.44 -0.10 0.00 0.00 175.22 175.13 2ajc n ILE 397 N 2.69 0.00 -4.19 0.64 -5.35 0.32 -4.93 119.36 108.53 2ajc n ILE 397 Ca 0.05 -0.27 -0.16 0.00 -0.27 0.00 0.00 62.75 62.10 2ajc n ILE 397 Cb 0.45 1.07 -0.11 0.00 -1.74 0.00 0.00 39.64 39.31 2ajc n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2ajc s THR 398 N -1.97 1.05 -0.07 7.28 -4.23 -1.24 -4.91 115.64 111.55 2ajc s THR 398 Ca 0.08 -1.58 -0.31 0.00 -1.18 0.00 0.00 61.69 58.70 2ajc s THR 398 Cb 0.10 -1.32 0.08 0.00 1.34 0.00 0.00 72.50 72.70 2ajc s THR 398 CO 0.44 -0.46 0.74 -0.75 -0.54 0.00 0.00 174.62 174.05 2ajc s LYS 399 N -2.54 0.97 0.00 3.99 2.20 -1.26 -4.51 119.74 118.60 2ajc s LYS 399 Ca 0.04 0.25 0.00 0.00 -0.36 0.00 0.00 55.97 55.90 2ajc s LYS 399 Cb -0.05 0.46 0.00 0.00 -1.51 0.00 0.00 37.83 36.73 2ajc s LYS 399 CO 0.01 -0.30 0.00 0.41 -0.36 0.00 0.00 175.35 175.11 2ajc n GLY 400 N 0.90 3.29 2.55 5.54 0.00 -1.26 -4.94 105.19 111.26 2ajc n GLY 400 Ca -0.17 -1.52 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 2ajc n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ajc n ALA 401 N -1.77 6.53 -3.84 4.61 0.00 -1.26 -4.74 120.51 120.04 2ajc n ALA 401 Ca 0.00 -3.91 -0.05 0.00 0.00 0.00 0.00 53.44 49.48 2ajc n ALA 401 Cb 0.00 -3.16 0.01 0.00 0.00 0.00 0.00 19.45 16.30 2ajc n ALA 401 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 2ajc s TRP 402 N 1.10 0.05 0.05 0.00 1.48 -1.26 -5.05 118.94 115.31 2ajc s TRP 402 Ca 0.55 -0.53 0.02 0.00 -1.06 0.00 0.00 56.10 55.09 2ajc s TRP 402 Cb 0.16 0.74 -0.03 0.00 -1.16 0.00 0.00 33.47 33.18 2ajc s TRP 402 CO -0.06 -1.13 -0.08 -1.21 -4.06 0.00 0.00 176.95 170.40 2ajc s GLU 403 N -2.43 0.59 -0.00 3.25 2.02 -1.26 -4.57 118.70 116.29 2ajc s GLU 403 Ca 0.18 -0.84 -0.27 0.00 0.02 0.00 0.00 54.97 54.06 2ajc s GLU 403 Cb -0.03 -0.34 -0.04 0.00 0.10 0.00 0.00 34.13 33.82 2ajc s GLU 403 CO 0.07 0.06 0.86 0.08 0.02 0.00 0.00 175.26 176.35 2ajc s VAL 404 N -1.61 4.87 -0.13 2.63 1.01 -0.39 -2.64 120.40 124.14 2ajc s VAL 404 Ca -0.07 1.81 -0.25 0.00 0.00 0.00 0.00 61.98 63.47 2ajc s VAL 404 Cb -0.08 -4.20 -0.26 0.00 0.00 0.00 0.00 36.38 31.83 2ajc s VAL 404 CO 0.00 0.23 0.67 0.40 0.00 0.00 0.00 175.10 176.41 2ajc h ILE 405 N 4.61 1.50 -2.19 2.22 1.08 -0.55 -3.45 117.51 120.72 2ajc h ILE 405 Ca -0.42 -2.36 0.03 0.00 -0.39 0.00 0.00 64.86 61.72 2ajc h ILE 405 Cb 1.21 3.07 -0.17 0.00 -3.07 0.00 0.00 36.82 37.86 2ajc h ILE 405 CO 0.74 0.59 0.37 -0.83 -0.69 0.00 0.00 178.15 178.33 2ajc s GLY 406 N -4.46 -0.48 -0.17 5.37 0.00 -1.19 -5.01 107.32 101.38 2ajc s GLY 406 Ca -0.20 1.23 -0.20 0.00 0.00 0.00 0.00 44.72 45.55 2ajc s GLY 406 CO 0.71 0.62 0.59 -0.42 0.00 0.00 0.00 173.10 174.60 2ajc s ILE 407 N -2.28 5.07 -0.19 0.90 1.01 -1.26 -1.52 121.20 122.93 2ajc s ILE 407 Ca -0.01 1.13 0.11 0.00 0.00 0.00 0.00 60.65 61.88 2ajc s ILE 407 Cb -0.01 -3.91 -0.23 0.00 0.01 0.00 0.00 42.46 38.32 2ajc s ILE 407 CO -0.02 0.18 0.09 -0.62 0.00 0.00 0.00 174.94 174.56 2ajc n GLU 408 N 4.61 0.68 -3.51 2.79 -0.58 0.67 -4.98 120.64 120.32 2ajc n GLU 408 Ca -0.03 0.10 -0.15 0.00 -0.42 0.00 0.00 57.16 56.66 2ajc n GLU 408 Cb 0.50 -1.57 -0.05 0.00 -0.57 0.00 0.00 31.44 29.76 2ajc n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ajc s ALA 409 N -2.52 -1.77 -0.04 0.62 0.00 -1.13 -4.84 121.76 112.08 2ajc s ALA 409 Ca -0.17 1.18 -0.02 0.00 0.00 0.00 0.00 51.96 52.95 2ajc s ALA 409 Cb 0.07 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.30 2ajc s ALA 409 CO 0.76 -0.46 0.09 -1.17 0.00 0.00 0.00 175.76 174.98 2ajc s LEU 410 N -1.59 1.26 0.46 0.00 2.96 -1.26 -0.55 118.68 119.95 2ajc s LEU 410 Ca -0.06 0.18 0.03 0.00 -0.22 0.00 0.00 54.13 54.06 2ajc s LEU 410 Cb -0.00 0.23 -0.02 0.00 0.50 0.00 0.00 46.19 46.90 2ajc s LEU 410 CO 0.02 -0.09 0.08 0.42 -1.32 0.00 0.00 176.35 175.46 2ajc s THR 411 N 0.62 0.81 0.45 3.68 -4.23 0.09 -4.91 115.64 112.15 2ajc s THR 411 Ca -0.05 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 58.77 2ajc s THR 411 Cb -0.07 -2.24 0.34 0.00 1.34 0.00 0.00 72.50 71.87 2ajc s THR 411 CO -0.02 0.00 2.14 0.77 -0.54 0.00 0.00 174.62 176.96 2ajc h SER 412 N 1.58 0.00 0.00 3.99 4.64 -2.01 -3.30 113.55 118.45 2ajc h SER 412 Ca -0.39 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.88 2ajc h SER 412 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 2ajc h SER 412 CO 0.64 0.07 -1.58 0.47 -0.87 0.00 0.00 176.83 175.56 2ajc n ASP 413 N -3.53 2.41 -4.02 4.97 8.00 -1.26 -4.88 116.55 118.24 2ajc n ASP 413 Ca -0.02 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.40 2ajc n ASP 413 Cb 0.20 1.30 -0.10 0.00 -0.02 0.00 0.00 41.12 42.50 2ajc n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2ajc s TYR 414 N -2.64 0.36 -0.08 1.24 1.51 -1.24 -1.20 117.35 115.31 2ajc s TYR 414 Ca -0.04 -0.75 0.04 0.00 -1.01 0.00 0.00 57.07 55.31 2ajc s TYR 414 Cb 0.06 -0.27 -0.00 0.00 -0.11 0.00 0.00 41.96 41.64 2ajc s TYR 414 CO 0.46 -0.29 -0.22 -1.17 -1.11 0.00 0.00 175.55 173.23 2ajc s LEU 415 N -2.13 1.99 -0.10 -1.29 1.98 -0.62 -0.73 118.68 117.77 2ajc s LEU 415 Ca -0.05 -0.48 -0.02 0.00 -2.89 0.00 0.00 54.13 50.69 2ajc s LEU 415 Cb -0.02 -1.25 -0.03 0.00 0.66 0.00 0.00 46.19 45.55 2ajc s LEU 415 CO -0.05 0.16 -0.03 -0.31 -1.89 0.00 0.00 176.35 174.24 2ajc s TYR 416 N 0.21 3.07 0.17 5.38 1.51 0.29 -0.62 117.35 127.35 2ajc s TYR 416 Ca -0.12 0.03 -0.11 0.00 -1.01 0.00 0.00 57.07 55.86 2ajc s TYR 416 Cb -0.16 -1.82 0.00 0.00 -0.11 0.00 0.00 41.96 39.88 2ajc s TYR 416 CO 0.06 0.30 0.33 1.52 -1.11 0.00 0.00 175.55 176.66 2ajc s TYR 417 N -0.53 0.26 -0.09 2.71 -0.85 -0.28 -0.23 117.35 118.34 2ajc s TYR 417 Ca 0.09 -0.63 0.00 0.00 -0.52 0.00 0.00 57.07 56.01 2ajc s TYR 417 Cb -0.12 0.05 -0.03 0.00 0.38 0.00 0.00 41.96 42.24 2ajc s TYR 417 CO 0.02 -0.76 -0.08 0.42 -1.52 0.00 0.00 175.55 173.63 2ajc s ILE 418 N -3.94 3.56 0.20 -3.49 1.01 -0.57 -0.16 121.20 117.80 2ajc s ILE 418 Ca 0.15 -0.52 -0.06 0.00 0.00 0.00 0.00 60.65 60.22 2ajc s ILE 418 Cb 0.02 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 40.00 2ajc s ILE 418 CO -0.01 0.57 0.26 -0.94 0.00 0.00 0.00 174.94 174.81 2ajc s SER 419 N -0.41 0.07 -0.39 3.58 1.04 -0.69 0.23 113.70 117.13 2ajc s SER 419 Ca 0.06 -1.12 0.06 0.00 0.48 0.00 0.00 55.95 55.42 2ajc s SER 419 Cb -0.12 0.44 0.56 0.00 0.10 0.00 0.00 66.02 67.00 2ajc s SER 419 CO 0.02 -0.93 1.68 -0.46 0.98 0.00 0.00 173.24 174.53 2ajc n ASN 420 N -0.27 3.55 -0.19 7.02 0.23 -1.08 -1.34 115.26 123.18 2ajc n ASN 420 Ca -0.02 -3.73 -0.09 0.00 -0.53 0.00 0.00 54.58 50.22 2ajc n ASN 420 Cb 0.64 -0.73 0.01 0.00 -2.08 0.00 0.00 39.78 37.62 2ajc n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2ajc h GLU 421 N 1.16 0.89 -6.26 -3.83 4.81 -1.85 -3.31 114.58 106.18 2ajc h GLU 421 Ca 0.43 -0.24 -0.67 0.00 -0.13 0.00 0.00 59.36 58.75 2ajc h GLU 421 Cb 2.04 -0.11 0.03 0.00 0.63 0.00 0.00 28.75 31.34 2ajc h GLU 421 CO 0.80 0.86 0.84 1.58 -0.73 0.00 0.00 179.01 182.36 2ajc n HIS 422 N -4.37 2.04 -1.08 0.92 -0.00 -1.26 -0.20 115.22 111.26 2ajc n HIS 422 Ca 0.02 0.37 -0.03 0.00 0.46 0.00 0.00 57.72 58.54 2ajc n HIS 422 Cb 0.26 -2.50 -0.01 0.00 -0.12 0.00 0.00 29.99 27.62 2ajc n HIS 422 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 2ajc n LYS 423 N 4.77 -1.75 -2.79 1.57 4.01 -1.26 -2.35 118.16 120.35 2ajc n LYS 423 Ca 0.22 0.56 -0.21 0.00 -0.51 0.00 0.00 58.31 58.37 2ajc n LYS 423 Cb 0.21 -4.92 0.01 0.00 -0.51 0.00 0.00 35.03 29.83 2ajc n LYS 423 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2ajc n GLY 424 N 0.45 -0.51 3.32 0.72 0.00 0.72 -4.96 105.19 104.93 2ajc n GLY 424 Ca -0.03 0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 2ajc n GLY 424 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2ajc s MET 425 N -5.45 3.06 0.59 1.61 0.23 -0.99 -4.98 119.30 113.36 2ajc s MET 425 Ca 0.19 -0.87 0.29 0.00 -1.03 0.00 0.00 55.69 54.26 2ajc s MET 425 Cb -0.08 -3.32 1.68 0.00 -1.53 0.00 0.00 34.83 31.58 2ajc s MET 425 CO 0.23 -0.44 2.10 -1.00 -2.03 0.00 0.00 175.02 173.88 2ajc h PRO 426 N 8.20 0.00 -0.58 3.16 0.13 -1.90 -1.98 132.00 139.04 2ajc h PRO 426 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2ajc h PRO 426 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2ajc h PRO 426 CO 0.60 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.78 2ajc n GLY 427 N -1.39 1.76 3.72 1.56 0.00 -1.26 -4.86 105.19 104.72 2ajc n GLY 427 Ca 0.01 -0.57 -0.23 0.00 0.00 0.00 0.00 46.02 45.23 2ajc n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ajc s GLY 428 N -0.83 1.62 -0.07 -0.02 0.00 -0.75 -1.64 107.32 105.63 2ajc s GLY 428 Ca 0.35 -1.60 -0.03 0.00 0.00 0.00 0.00 44.72 43.43 2ajc s GLY 428 CO 0.19 -1.64 0.15 0.50 0.00 0.00 0.00 173.10 172.30 2ajc s ARG 429 N -3.76 0.11 0.04 2.90 1.81 -0.08 -4.18 118.95 115.79 2ajc s ARG 429 Ca 0.33 0.37 0.00 0.00 -1.72 0.00 0.00 55.73 54.72 2ajc s ARG 429 Cb -0.06 -0.16 -0.03 0.00 -0.45 0.00 0.00 34.95 34.25 2ajc s ARG 429 CO 0.22 -0.16 -0.04 -0.80 -0.68 0.00 0.00 175.30 173.84 2ajc s ASN 430 N 1.11 0.54 -0.17 0.23 0.01 -0.45 -0.89 114.94 115.33 2ajc s ASN 430 Ca -0.09 -0.73 -0.19 0.00 -0.71 0.00 0.00 52.86 51.14 2ajc s ASN 430 Cb -0.11 0.12 -0.03 0.00 0.41 0.00 0.00 41.25 41.64 2ajc s ASN 430 CO -0.06 -0.40 0.53 -0.22 -1.51 0.00 0.00 177.10 175.44 2ajc s LEU 431 N -2.16 4.20 0.17 0.60 2.96 -1.26 -1.70 118.68 121.49 2ajc s LEU 431 Ca -0.04 0.77 0.09 0.00 -0.22 0.00 0.00 54.13 54.73 2ajc s LEU 431 Cb -0.02 -2.75 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 2ajc s LEU 431 CO -0.04 -0.13 -0.19 -0.31 -1.32 0.00 0.00 176.35 174.36 2ajc s TYR 432 N 1.29 1.88 -0.09 5.38 1.51 0.77 -0.51 117.35 127.57 2ajc s TYR 432 Ca 0.26 -0.45 0.02 0.00 -1.01 0.00 0.00 57.07 55.88 2ajc s TYR 432 Cb -0.15 -0.94 0.01 0.00 -0.11 0.00 0.00 41.96 40.77 2ajc s TYR 432 CO 0.10 0.35 -0.14 0.50 -1.11 0.00 0.00 175.55 175.25 2ajc s ARG 433 N -2.76 2.05 -0.04 -0.62 3.52 -0.07 -1.12 118.95 119.91 2ajc s ARG 433 Ca 0.16 -0.51 0.05 0.00 -0.13 0.00 0.00 55.73 55.30 2ajc s ARG 433 Cb -0.06 -1.74 -0.02 0.00 -1.56 0.00 0.00 34.95 31.57 2ajc s ARG 433 CO 0.07 -0.04 -0.19 -1.50 -0.81 0.00 0.00 175.30 172.83 2ajc s ILE 434 N 0.91 2.65 -0.22 4.11 2.07 0.21 -1.20 121.20 129.72 2ajc s ILE 434 Ca -0.09 -0.88 -0.29 0.00 -1.41 0.00 0.00 60.65 57.98 2ajc s ILE 434 Cb -0.15 -2.00 0.00 0.00 0.13 0.00 0.00 42.46 40.44 2ajc s ILE 434 CO 0.00 0.58 1.13 -1.58 -1.91 0.00 0.00 174.94 173.16 2ajc s GLN 435 N -0.64 4.22 0.44 3.50 0.74 -0.38 -1.60 119.66 125.94 2ajc s GLN 435 Ca 0.10 1.43 0.15 0.00 0.05 0.00 0.00 55.36 57.09 2ajc s GLN 435 Cb -0.11 -3.70 0.98 0.00 1.10 0.00 0.00 33.01 31.29 2ajc s GLN 435 CO 0.00 -0.70 1.96 -0.07 -0.55 0.00 0.00 175.29 175.94 2ajc h LEU 436 N 9.65 0.00 -0.36 3.68 4.07 -1.49 -2.06 115.31 128.80 2ajc h LEU 436 Ca -0.22 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.74 2ajc h LEU 436 Cb 1.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.82 2ajc h LEU 436 CO 0.98 0.22 -0.11 -0.46 -1.08 0.00 0.00 178.44 177.99 2ajc n ASN 437 N -4.20 0.67 -3.01 -0.43 0.23 -1.26 -4.56 115.26 102.70 2ajc n ASN 437 Ca -0.02 -0.78 -0.01 0.00 -0.53 0.00 0.00 54.58 53.23 2ajc n ASN 437 Cb 0.28 -0.02 -0.00 0.00 -2.08 0.00 0.00 39.78 37.96 2ajc n ASN 437 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2ajc s ASP 438 N -2.38 -1.41 0.10 0.53 -1.08 -0.79 -5.02 116.67 106.62 2ajc s ASP 438 Ca 0.31 -1.10 0.05 0.00 -0.52 0.00 0.00 52.55 51.29 2ajc s ASP 438 Cb 0.20 1.82 0.29 0.00 -1.46 0.00 0.00 42.92 43.78 2ajc s ASP 438 CO 0.46 -0.11 1.07 -1.22 0.52 0.00 0.00 175.17 175.88 2ajc n TYR 439 N 3.78 0.18 0.51 -5.34 4.01 -1.10 -0.51 117.16 118.69 2ajc n TYR 439 Ca 0.13 0.10 0.13 0.00 -0.16 0.00 0.00 57.90 58.10 2ajc n TYR 439 Cb 0.57 -0.54 0.30 0.00 -0.31 0.00 0.00 39.34 39.37 2ajc n TYR 439 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 2ajc h THR 440 N 0.00 0.00 -2.71 -0.72 1.35 -1.91 -3.42 112.91 105.50 2ajc h THR 440 Ca 0.00 -0.62 -0.68 0.00 -0.55 0.00 0.00 66.41 64.57 2ajc h THR 440 Cb 0.27 1.54 -0.18 0.00 -1.73 0.00 0.00 68.15 68.06 2ajc h THR 440 CO 0.00 0.00 0.48 -0.54 -0.25 0.00 0.00 175.52 175.21 2ajc s LYS 441 N -3.14 3.26 -0.06 4.72 1.02 0.34 -5.00 119.74 120.87 2ajc s LYS 441 Ca 0.09 -1.34 0.03 0.00 0.02 0.00 0.00 55.97 54.77 2ajc s LYS 441 Cb 0.11 -4.46 0.00 0.00 -0.52 0.00 0.00 37.83 32.96 2ajc s LYS 441 CO 0.64 -1.70 -0.16 0.54 -0.92 0.00 0.00 175.35 173.75 2ajc s VAL 442 N 3.04 1.39 -0.07 3.17 0.11 -1.26 -1.25 120.40 125.53 2ajc s VAL 442 Ca 0.22 -0.65 0.05 0.00 -2.93 0.00 0.00 61.98 58.66 2ajc s VAL 442 Cb -0.15 -1.22 -0.01 0.00 -1.53 0.00 0.00 36.38 33.47 2ajc s VAL 442 CO 0.02 0.41 -0.21 -0.89 -3.33 0.00 0.00 175.10 171.10 2ajc s THR 443 N 0.35 2.40 -0.30 5.04 2.01 -0.34 -4.97 115.64 119.83 2ajc s THR 443 Ca -0.11 -0.94 -0.22 0.00 0.31 0.00 0.00 61.69 60.74 2ajc s THR 443 Cb -0.14 -1.91 -0.01 0.00 0.01 0.00 0.00 72.50 70.45 2ajc s THR 443 CO 0.04 0.57 0.69 0.00 -0.69 0.00 0.00 174.62 175.23 2ajc h LEU 445 N 9.24 0.00 0.00 0.00 3.38 -1.15 -3.39 115.31 123.39 2ajc h LEU 445 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2ajc h LEU 445 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2ajc h LEU 445 CO 0.83 0.28 -0.66 -1.54 0.09 0.00 0.00 178.44 177.44 2ajc n SER 446 N -3.07 1.75 -0.32 -0.43 3.41 -1.20 -4.77 113.62 108.98 2ajc n SER 446 Ca 0.01 -0.36 0.16 0.00 -0.26 0.00 0.00 58.87 58.43 2ajc n SER 446 Cb 0.66 1.10 0.41 0.00 -0.26 0.00 0.00 64.21 66.11 2ajc n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ajc n GLU 448 N -4.67 2.20 0.15 0.00 4.71 -1.26 -4.34 120.64 117.43 2ajc n GLU 448 Ca 0.22 -1.92 -0.14 0.00 -0.01 0.00 0.00 57.16 55.31 2ajc n GLU 448 Cb 0.66 -1.33 -0.08 0.00 -1.01 0.00 0.00 31.44 29.68 2ajc n GLU 448 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2ajc h LEU 449 N 2.73 -0.27 -5.75 -4.62 3.38 -1.81 -3.38 115.31 105.58 2ajc h LEU 449 Ca 0.00 -0.06 -0.43 0.00 0.09 0.00 0.00 57.88 57.49 2ajc h LEU 449 Cb 0.73 0.07 -0.30 0.00 0.09 0.00 0.00 40.66 41.26 2ajc h LEU 449 CO 0.00 -0.12 -0.83 0.59 0.09 0.00 0.00 178.44 178.18 2ajc n ASN 450 N -5.19 -1.38 -0.29 -0.43 4.13 -1.26 -5.04 115.26 105.80 2ajc n ASN 450 Ca -0.09 -2.72 0.17 0.00 1.68 0.00 0.00 54.58 53.62 2ajc n ASN 450 Cb 0.18 0.32 0.44 0.00 -1.54 0.00 0.00 39.78 39.17 2ajc n ASN 450 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2ajc h PRO 451 N 4.83 0.53 0.20 3.52 0.13 -1.75 0.50 132.00 139.96 2ajc h PRO 451 Ca 0.11 -0.03 -0.31 0.00 -0.87 0.00 0.00 66.00 64.89 2ajc h PRO 451 Cb 0.97 -0.12 0.02 0.00 0.13 0.00 0.00 31.00 32.00 2ajc h PRO 451 CO 0.30 0.35 -1.48 0.93 -0.23 0.00 0.00 178.00 177.88 2ajc h GLU 452 N 0.55 0.42 0.09 0.86 4.39 -1.96 -3.38 114.58 115.55 2ajc h GLU 452 Ca 0.52 -0.71 -0.26 0.00 0.34 0.00 0.00 59.36 59.25 2ajc h GLU 452 Cb 1.09 0.27 0.01 0.00 -0.10 0.00 0.00 28.75 30.01 2ajc h GLU 452 CO -0.26 1.34 -1.14 -0.09 -1.16 0.00 0.00 179.01 177.70 2ajc h ARG 453 N -0.00 0.36 -4.55 2.33 2.43 -1.87 -3.41 114.38 109.67 2ajc h ARG 453 Ca -0.28 -0.50 -0.63 0.00 -0.81 0.00 0.00 59.98 57.76 2ajc h ARG 453 Cb 2.02 0.17 -0.38 0.00 -0.42 0.00 0.00 29.97 31.36 2ajc h ARG 453 CO 0.19 1.20 -0.79 0.00 -1.51 0.00 0.00 179.97 179.06 2ajc n GLN 455 N 4.58 0.20 -3.60 0.00 6.02 0.38 -4.45 117.38 120.51 2ajc n GLN 455 Ca -0.13 -0.53 -0.28 0.00 -0.01 0.00 0.00 57.00 56.05 2ajc n GLN 455 Cb 0.43 -0.77 -0.16 0.00 1.02 0.00 0.00 30.24 30.76 2ajc n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 2ajc s TYR 456 N -0.19 0.41 0.20 1.08 6.14 -1.14 -0.90 117.35 122.96 2ajc s TYR 456 Ca 0.00 -0.70 0.11 0.00 0.64 0.00 0.00 57.07 57.13 2ajc s TYR 456 Cb 0.00 -0.87 -0.04 0.00 0.42 0.00 0.00 41.96 41.46 2ajc s TYR 456 CO 0.00 -0.68 -0.22 0.71 0.64 0.00 0.00 175.55 175.99 2ajc s TYR 457 N 2.07 2.33 0.20 4.97 1.51 -0.07 -0.25 117.35 128.11 2ajc s TYR 457 Ca 0.05 -0.34 0.03 0.00 -1.01 0.00 0.00 57.07 55.80 2ajc s TYR 457 Cb -0.16 -1.14 -0.05 0.00 -0.11 0.00 0.00 41.96 40.50 2ajc s TYR 457 CO -0.22 0.53 0.00 -1.54 -1.11 0.00 0.00 175.55 173.20 2ajc s SER 458 N -2.78 1.46 0.08 2.29 1.04 -0.40 -4.53 113.70 110.86 2ajc s SER 458 Ca 0.22 -1.20 -0.04 0.00 0.48 0.00 0.00 55.95 55.42 2ajc s SER 458 Cb -0.08 0.08 -0.03 0.00 0.10 0.00 0.00 66.02 66.09 2ajc s SER 458 CO 0.11 -0.55 0.06 0.00 0.98 0.00 0.00 173.24 173.84 2ajc s ALA 459 N -3.56 0.31 -0.09 5.32 0.00 -1.26 -0.68 121.76 121.81 2ajc s ALA 459 Ca 0.26 -1.05 -0.03 0.00 0.00 0.00 0.00 51.96 51.14 2ajc s ALA 459 Cb 0.06 0.44 0.04 0.00 0.00 0.00 0.00 23.12 23.66 2ajc s ALA 459 CO 0.06 -0.44 0.09 0.45 0.00 0.00 0.00 175.76 175.92 2ajc s SER 460 N -2.92 1.40 0.06 0.00 0.15 -0.54 -4.97 113.70 106.88 2ajc s SER 460 Ca 0.09 -0.07 -0.04 0.00 0.70 0.00 0.00 55.95 56.63 2ajc s SER 460 Cb 0.07 -0.09 -0.05 0.00 -1.71 0.00 0.00 66.02 64.24 2ajc s SER 460 CO -0.08 -0.28 0.27 -0.36 1.20 0.00 0.00 173.24 173.99 2ajc s PHE 461 N 2.18 3.53 1.02 3.44 0.40 -1.26 -0.42 117.98 126.88 2ajc s PHE 461 Ca 0.04 0.44 -0.16 0.00 -0.60 0.00 0.00 56.93 56.66 2ajc s PHE 461 Cb -0.13 -1.90 0.21 0.00 0.51 0.00 0.00 43.02 41.70 2ajc s PHE 461 CO -0.05 0.56 1.20 -1.54 0.70 0.00 0.00 175.22 176.09 2ajc s SER 462 N -2.17 2.56 0.44 1.36 1.04 -0.28 -4.87 113.70 111.78 2ajc s SER 462 Ca 0.33 0.60 -0.25 0.00 0.48 0.00 0.00 55.95 57.11 2ajc s SER 462 Cb -0.13 -0.88 -0.08 0.00 0.10 0.00 0.00 66.02 65.03 2ajc s SER 462 CO 0.22 -3.11 1.39 0.20 0.98 0.00 0.00 173.24 172.93 2ajc s ASN 463 N -4.31 5.96 -0.87 7.02 0.02 -1.07 -1.42 114.94 120.27 2ajc s ASN 463 Ca 0.70 2.84 0.00 0.00 -1.02 0.00 0.00 52.86 55.38 2ajc s ASN 463 Cb -0.09 -2.65 0.00 0.00 0.02 0.00 0.00 41.25 38.53 2ajc s ASN 463 CO 0.54 -1.11 0.00 0.29 0.02 0.00 0.00 177.10 176.84 2ajc n LYS 464 N -0.16 -1.49 -2.92 -0.60 5.02 -1.26 -3.31 118.16 113.45 2ajc n LYS 464 Ca 0.05 0.75 -0.18 0.00 -2.02 0.00 0.00 58.31 56.90 2ajc n LYS 464 Cb 0.42 -5.01 0.00 0.00 -0.02 0.00 0.00 35.03 30.42 2ajc n LYS 464 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ajc n ALA 465 N 1.15 -0.93 0.12 7.82 0.00 -0.51 -4.87 120.51 123.30 2ajc n ALA 465 Ca -0.08 0.12 -0.01 0.00 0.00 0.00 0.00 53.44 53.46 2ajc n ALA 465 Cb 0.50 -2.35 0.23 0.00 0.00 0.00 0.00 19.45 17.83 2ajc n ALA 465 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2ajc h LYS 466 N -0.60 0.13 -4.38 0.00 1.57 -1.74 -3.42 116.57 108.13 2ajc h LYS 466 Ca -0.38 -0.07 -0.16 0.00 -1.87 0.00 0.00 60.65 58.17 2ajc h LYS 466 Cb 1.27 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.43 2ajc h LYS 466 CO 0.45 0.58 -0.67 0.71 -0.57 0.00 0.00 179.45 179.95 2ajc s TYR 467 N -3.99 0.72 -0.05 -1.35 2.02 -1.26 -0.96 117.35 112.48 2ajc s TYR 467 Ca -0.03 -1.11 -0.11 0.00 -0.37 0.00 0.00 57.07 55.44 2ajc s TYR 467 Cb 0.13 -0.45 0.02 0.00 -0.40 0.00 0.00 41.96 41.26 2ajc s TYR 467 CO 0.76 -0.40 0.27 1.52 -1.57 0.00 0.00 175.55 176.14 2ajc s TYR 468 N -3.92 -0.21 -0.15 2.71 1.13 -0.52 -1.13 117.35 115.27 2ajc s TYR 468 Ca 0.15 0.43 -0.12 0.00 -1.41 0.00 0.00 57.07 56.12 2ajc s TYR 468 Cb 0.07 0.08 -0.05 0.00 -1.10 0.00 0.00 41.96 40.97 2ajc s TYR 468 CO -0.04 -0.26 0.25 -1.14 -2.51 0.00 0.00 175.55 171.84 2ajc s GLN 469 N -0.66 4.10 -0.14 -3.49 0.74 0.44 -0.25 119.66 120.41 2ajc s GLN 469 Ca -0.08 0.04 -0.06 0.00 0.05 0.00 0.00 55.36 55.31 2ajc s GLN 469 Cb -0.04 -3.37 -0.04 0.00 1.10 0.00 0.00 33.01 30.66 2ajc s GLN 469 CO 0.02 0.37 0.06 -0.51 -0.55 0.00 0.00 175.29 174.68 2ajc s LEU 470 N 0.09 3.84 -0.31 3.68 1.43 0.51 -1.46 118.68 126.47 2ajc s LEU 470 Ca 0.15 0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.44 2ajc s LEU 470 Cb -0.13 -1.94 0.07 0.00 0.03 0.00 0.00 46.19 44.23 2ajc s LEU 470 CO 0.04 0.28 -0.01 -0.13 0.23 0.00 0.00 176.35 176.76 2ajc s ARG 471 N -0.29 2.06 -0.25 1.70 0.52 0.14 -1.75 118.95 121.08 2ajc s ARG 471 Ca 0.08 -1.52 -0.18 0.00 -0.52 0.00 0.00 55.73 53.60 2ajc s ARG 471 Cb -0.12 -3.11 -0.03 0.00 0.52 0.00 0.00 34.95 32.21 2ajc s ARG 471 CO 0.02 -0.73 0.49 0.00 0.02 0.00 0.00 175.30 175.10 2ajc n PHE 473 N 5.35 0.00 -0.12 0.00 3.01 0.65 -1.27 117.46 125.08 2ajc n PHE 473 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.41 2ajc n PHE 473 Cb 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 2ajc n PHE 473 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ajc n GLY 474 N 1.18 -2.27 0.12 1.37 0.00 -1.25 -0.23 105.19 104.11 2ajc n GLY 474 Ca 0.07 -1.21 0.12 0.00 0.00 0.00 0.00 46.02 45.00 2ajc n GLY 474 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ajc n PRO 475 N -0.63 0.21 -0.18 1.61 -0.04 -0.43 -0.47 135.00 135.07 2ajc n PRO 475 Ca 0.00 0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.81 2ajc n PRO 475 Cb 0.00 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 31.62 2ajc n PRO 475 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ajc n GLY 476 N 0.42 -0.02 3.76 0.55 0.00 -0.24 -4.55 105.19 105.10 2ajc n GLY 476 Ca 0.03 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 2ajc n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ajc s LEU 477 N 0.00 4.43 0.24 0.99 1.43 -1.26 -4.57 118.68 119.94 2ajc s LEU 477 Ca 0.00 2.58 -0.29 0.00 -1.03 0.00 0.00 54.13 55.39 2ajc s LEU 477 Cb 0.00 -3.63 -0.15 0.00 0.03 0.00 0.00 46.19 42.43 2ajc s LEU 477 CO 0.00 -0.52 0.92 -2.65 0.23 0.00 0.00 176.35 174.32 2ajc n PRO 478 N 1.50 0.94 -3.94 1.29 -0.02 -1.26 -4.82 135.00 128.69 2ajc n PRO 478 Ca 0.02 0.33 -0.22 0.00 -2.02 0.00 0.00 63.50 61.61 2ajc n PRO 478 Cb 0.42 -1.64 -0.17 0.00 -0.02 0.00 0.00 33.50 32.09 2ajc n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2ajc s LEU 479 N 1.12 0.95 -0.18 2.45 2.96 -0.40 -4.26 118.68 121.32 2ajc s LEU 479 Ca 0.64 -0.12 -0.02 0.00 -0.22 0.00 0.00 54.13 54.40 2ajc s LEU 479 Cb -0.80 -0.48 -0.01 0.00 0.50 0.00 0.00 46.19 45.40 2ajc s LEU 479 CO 0.57 -0.13 -0.09 -0.31 -1.32 0.00 0.00 176.35 175.08 2ajc s TYR 480 N 1.52 2.90 0.17 5.38 1.51 0.12 -1.28 117.35 127.66 2ajc s TYR 480 Ca -0.02 -0.90 0.03 0.00 -1.01 0.00 0.00 57.07 55.18 2ajc s TYR 480 Cb -0.13 -2.00 -0.05 0.00 -0.11 0.00 0.00 41.96 39.68 2ajc s TYR 480 CO -0.03 -0.45 -0.06 0.95 -1.11 0.00 0.00 175.55 174.85 2ajc s THR 481 N 1.06 1.00 -0.05 -0.71 -4.23 -0.72 0.04 115.64 112.04 2ajc s THR 481 Ca 0.00 -2.03 0.06 0.00 -1.18 0.00 0.00 61.69 58.55 2ajc s THR 481 Cb -0.15 -1.99 -0.01 0.00 1.34 0.00 0.00 72.50 71.69 2ajc s THR 481 CO -0.01 -0.62 -0.25 -0.22 -0.54 0.00 0.00 174.62 172.98 2ajc s LEU 482 N -3.19 2.07 0.14 4.79 2.96 -0.40 -0.36 118.68 124.69 2ajc s LEU 482 Ca 0.20 -0.51 0.05 0.00 -0.22 0.00 0.00 54.13 53.66 2ajc s LEU 482 Cb 0.04 -1.37 -0.04 0.00 0.50 0.00 0.00 46.19 45.32 2ajc s LEU 482 CO 0.02 0.25 -0.12 -1.00 -1.32 0.00 0.00 176.35 174.18 2ajc s HIS 483 N -0.20 1.36 -0.20 5.38 3.76 0.66 0.25 115.29 126.29 2ajc s HIS 483 Ca -0.02 -0.64 -0.10 0.00 -0.15 0.00 0.00 55.06 54.15 2ajc s HIS 483 Cb -0.13 -0.69 -0.05 0.00 1.11 0.00 0.00 32.58 32.82 2ajc s HIS 483 CO 0.03 0.14 0.12 0.45 -0.85 0.00 0.00 174.74 174.64 2ajc s SER 484 N -2.85 6.10 0.30 1.40 0.15 -0.80 -1.43 113.70 116.57 2ajc s SER 484 Ca 0.13 0.19 0.15 0.00 0.70 0.00 0.00 55.95 57.12 2ajc s SER 484 Cb -0.01 -2.07 0.38 0.00 -1.71 0.00 0.00 66.02 62.60 2ajc s SER 484 CO 0.02 0.16 1.59 0.28 1.20 0.00 0.00 173.24 176.50 2ajc h SER 485 N 6.80 0.00 1.17 5.45 0.02 -1.30 0.31 113.55 126.00 2ajc h SER 485 Ca -0.40 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.49 2ajc h SER 485 Cb 1.16 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2ajc h SER 485 CO 0.74 0.54 -0.28 0.77 -1.14 0.00 0.00 176.83 177.45 2ajc h SER 486 N 0.00 0.00 0.00 3.07 4.64 -1.90 -3.34 113.55 116.02 2ajc h SER 486 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2ajc h SER 486 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2ajc h SER 486 CO 0.07 0.28 -0.13 -1.54 -0.87 0.00 0.00 176.83 174.64 2ajc n SER 487 N -3.32 0.66 -2.23 4.97 3.41 -1.23 -5.01 113.62 110.87 2ajc n SER 487 Ca 0.01 -0.26 -0.21 0.00 -0.26 0.00 0.00 58.87 58.15 2ajc n SER 487 Cb 0.52 0.65 -0.03 0.00 -0.26 0.00 0.00 64.21 65.09 2ajc n SER 487 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2ajc n ASP 488 N -0.71 -5.79 -4.82 4.04 10.43 0.11 -4.98 116.55 114.82 2ajc n ASP 488 Ca 0.00 0.10 -0.36 0.00 2.57 0.00 0.00 54.79 57.10 2ajc n ASP 488 Cb 0.00 -4.88 -0.06 0.00 1.84 0.00 0.00 41.12 38.01 2ajc n ASP 488 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 2ajc s LYS 489 N -4.77 4.22 -0.24 -1.24 2.20 -1.24 -4.84 119.74 113.83 2ajc s LYS 489 Ca 0.00 0.83 -0.27 0.00 -0.36 0.00 0.00 55.97 56.16 2ajc s LYS 489 Cb 0.00 -2.87 0.00 0.00 -1.51 0.00 0.00 37.83 33.45 2ajc s LYS 489 CO 0.00 0.39 0.96 -2.00 -0.36 0.00 0.00 175.35 174.35 2ajc s GLU 490 N -2.00 4.22 0.15 4.03 2.12 -1.26 -1.90 118.70 124.06 2ajc s GLU 490 Ca 0.43 1.19 0.01 0.00 0.36 0.00 0.00 54.97 56.96 2ajc s GLU 490 Cb -0.16 -3.65 -0.05 0.00 0.26 0.00 0.00 34.13 30.53 2ajc s GLU 490 CO 0.21 -0.60 1.34 -0.07 -0.54 0.00 0.00 175.26 175.60 2ajc h LEU 491 N 9.38 0.28 0.00 2.70 3.38 -0.55 -3.49 115.31 127.02 2ajc h LEU 491 Ca -0.21 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2ajc h LEU 491 Cb 1.07 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2ajc h LEU 491 CO 0.94 1.06 0.00 -2.11 0.09 0.00 0.00 178.44 178.42 2ajc n ARG 492 N -3.64 0.00 -3.10 1.13 1.85 -1.18 -5.01 116.66 106.72 2ajc n ARG 492 Ca -0.04 0.00 -0.40 0.00 -1.00 0.00 0.00 57.85 56.41 2ajc n ARG 492 Cb 0.84 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 32.20 2ajc n ARG 492 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2ajc s VAL 493 N -2.00 5.06 -0.15 8.89 1.01 -1.26 -1.28 120.40 130.67 2ajc s VAL 493 Ca 0.00 1.32 0.01 0.00 0.00 0.00 0.00 61.98 63.30 2ajc s VAL 493 Cb 0.00 -3.99 -0.23 0.00 0.00 0.00 0.00 36.38 32.16 2ajc s VAL 493 CO 0.00 0.22 0.26 0.18 0.00 0.00 0.00 175.10 175.76 2ajc n LEU 494 N 4.11 2.19 -3.65 3.92 4.77 0.11 -4.94 117.00 123.51 2ajc n LEU 494 Ca -0.02 0.15 -0.04 0.00 -0.03 0.00 0.00 56.01 56.07 2ajc n LEU 494 Cb 0.51 -0.71 -0.06 0.00 -2.33 0.00 0.00 43.42 40.83 2ajc n LEU 494 CO 0.46 0.76 0.25 -0.70 -1.33 0.00 0.00 177.39 176.83 2ajc s GLU 495 N -2.55 0.58 0.00 3.23 2.56 -0.91 -4.99 118.70 116.62 2ajc s GLU 495 Ca -0.21 1.32 0.03 0.00 0.00 0.00 0.00 54.97 56.11 2ajc s GLU 495 Cb 0.07 0.57 0.06 0.00 2.00 0.00 0.00 34.13 36.83 2ajc s GLU 495 CO 0.75 -0.19 0.82 -0.40 -0.56 0.00 0.00 175.26 175.67 2ajc n ASP 496 N 5.06 1.73 -3.32 -1.70 5.68 -1.26 -0.70 116.55 122.04 2ajc n ASP 496 Ca -0.14 -1.53 -0.24 0.00 -0.50 0.00 0.00 54.79 52.38 2ajc n ASP 496 Cb 0.52 -0.03 0.03 0.00 -1.14 0.00 0.00 41.12 40.50 2ajc n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2ajc n ASN 497 N 0.01 -5.41 -0.12 -1.12 3.02 -1.26 -4.85 115.26 105.54 2ajc n ASN 497 Ca 0.03 -0.42 0.00 0.00 -0.03 0.00 0.00 54.58 54.16 2ajc n ASN 497 Cb 0.18 -4.36 0.27 0.00 -0.61 0.00 0.00 39.78 35.26 2ajc n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2ajc h SER 498 N -1.59 0.71 0.02 6.41 4.64 -1.95 -1.25 113.55 120.55 2ajc h SER 498 Ca -0.52 -0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 60.73 2ajc h SER 498 Cb 1.35 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2ajc h SER 498 CO 0.58 0.60 -0.01 0.00 -0.87 0.00 0.00 176.83 177.13 2ajc h ALA 499 N 1.51 -0.03 -0.30 5.18 0.00 -1.97 -2.18 119.26 121.46 2ajc h ALA 499 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2ajc h ALA 499 Cb 0.08 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2ajc h ALA 499 CO -0.03 -0.51 0.19 1.25 0.00 0.00 0.00 179.25 180.16 2ajc h LEU 500 N -0.05 0.33 -0.67 0.00 5.85 -1.76 -2.82 115.31 116.20 2ajc h LEU 500 Ca -0.00 -0.01 0.14 0.00 0.84 0.00 0.00 57.88 58.85 2ajc h LEU 500 Cb 0.04 -0.08 -0.12 0.00 0.37 0.00 0.00 40.66 40.87 2ajc h LEU 500 CO 0.01 0.24 -0.08 -0.78 -0.34 0.00 0.00 178.44 177.49 2ajc h ASP 501 N 0.40 -0.45 0.69 1.25 3.58 -0.96 -1.43 116.42 119.48 2ajc h ASP 501 Ca 0.11 0.18 -0.03 0.00 0.42 0.00 0.00 57.03 57.72 2ajc h ASP 501 Cb -0.04 0.35 -0.01 0.00 1.72 0.00 0.00 39.33 41.36 2ajc h ASP 501 CO -0.03 -0.18 -0.45 0.50 -2.88 0.00 0.00 179.24 176.20 2ajc h LYS 502 N 0.05 -1.03 -0.81 0.28 1.63 -1.16 -2.97 116.57 112.56 2ajc h LYS 502 Ca 0.34 0.07 0.19 0.00 -0.85 0.00 0.00 60.65 60.40 2ajc h LYS 502 Cb 0.55 0.23 -0.12 0.00 -0.60 0.00 0.00 32.23 32.30 2ajc h LYS 502 CO -0.63 -0.69 0.26 0.52 -3.45 0.00 0.00 179.45 175.46 2ajc h MET 503 N -1.07 0.30 0.00 1.90 2.86 -1.19 -0.75 114.93 116.97 2ajc h MET 503 Ca -0.09 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 2ajc h MET 503 Cb 0.87 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.47 2ajc h MET 503 CO 0.07 0.20 0.00 1.28 1.06 0.00 0.00 176.91 179.52 2ajc n LEU 504 N -5.13 0.03 0.20 1.22 4.77 -0.59 -2.94 117.00 114.56 2ajc n LEU 504 Ca 0.18 0.51 0.08 0.00 -0.03 0.00 0.00 56.01 56.74 2ajc n LEU 504 Cb 0.55 -0.50 0.33 0.00 -2.33 0.00 0.00 43.42 41.48 2ajc n LEU 504 CO 0.12 -0.25 0.71 1.56 -1.33 0.00 0.00 177.39 178.20 2ajc h GLN 505 N 0.00 0.00 0.00 3.23 4.20 -1.05 -2.92 115.11 118.57 2ajc h GLN 505 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2ajc h GLN 505 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 2ajc h GLN 505 CO 0.00 0.29 -0.37 0.22 -0.67 0.00 0.00 178.83 178.30 2ajc h ASP 506 N 0.00 0.00 -2.92 1.46 1.82 -1.68 -3.46 116.42 111.64 2ajc h ASP 506 Ca -0.00 -0.12 -0.62 0.00 -0.39 0.00 0.00 57.03 55.90 2ajc h ASP 506 Cb 0.92 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.89 2ajc h ASP 506 CO 0.04 0.06 -0.47 0.54 -1.61 0.00 0.00 179.24 177.79 2ajc s VAL 507 N -3.15 5.37 -1.13 2.25 0.11 -1.10 -3.50 120.40 119.25 2ajc s VAL 507 Ca 0.08 -0.28 -0.18 0.00 -2.93 0.00 0.00 61.98 58.66 2ajc s VAL 507 Cb 0.12 -3.61 0.10 0.00 -1.53 0.00 0.00 36.38 31.46 2ajc s VAL 507 CO 0.67 0.17 1.47 -1.10 -3.33 0.00 0.00 175.10 172.99 2ajc s GLN 508 N -2.39 3.83 0.45 1.54 -0.21 0.14 -4.97 119.66 118.05 2ajc s GLN 508 Ca 0.34 -1.85 -0.21 0.00 0.02 0.00 0.00 55.36 53.66 2ajc s GLN 508 Cb -0.13 -5.26 -0.10 0.00 1.00 0.00 0.00 33.01 28.53 2ajc s GLN 508 CO 0.25 -2.03 0.99 -1.64 -2.12 0.00 0.00 175.29 170.74 2ajc s MET 509 N 3.51 4.04 0.68 2.91 -1.94 -1.26 -4.37 119.30 122.86 2ajc s MET 509 Ca 0.45 1.25 -0.07 0.00 -1.71 0.00 0.00 55.69 55.61 2ajc s MET 509 Cb -0.00 -2.16 0.05 0.00 2.01 0.00 0.00 34.83 34.72 2ajc s MET 509 CO -0.02 -0.21 0.99 -1.25 -0.01 0.00 0.00 175.02 174.52 2ajc s PRO 510 N -3.16 2.36 0.18 2.03 0.04 -1.26 -4.37 135.00 130.82 2ajc s PRO 510 Ca 0.64 -0.18 0.08 0.00 0.04 0.00 0.00 61.00 61.58 2ajc s PRO 510 Cb -0.13 -2.18 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 2ajc s PRO 510 CO 0.17 -1.13 -0.05 -1.54 0.04 0.00 0.00 177.00 174.49 2ajc s SER 511 N -4.47 4.50 -0.19 6.66 1.04 -0.53 -4.90 113.70 115.82 2ajc s SER 511 Ca 0.59 -0.50 -0.01 0.00 0.48 0.00 0.00 55.95 56.51 2ajc s SER 511 Cb -0.11 -0.86 0.01 0.00 0.10 0.00 0.00 66.02 65.16 2ajc s SER 511 CO 0.45 0.09 -0.13 -0.75 0.98 0.00 0.00 173.24 173.88 2ajc s LYS 512 N -2.94 3.18 -0.05 4.02 2.20 -1.26 0.76 119.74 125.66 2ajc s LYS 512 Ca 0.26 -0.74 0.06 0.00 -0.36 0.00 0.00 55.97 55.20 2ajc s LYS 512 Cb -0.09 -2.75 -0.02 0.00 -1.51 0.00 0.00 37.83 33.46 2ajc s LYS 512 CO 0.17 -0.17 -0.21 0.21 -0.36 0.00 0.00 175.35 174.99 2ajc s LYS 513 N 1.29 2.43 0.01 4.03 2.20 0.02 -4.95 119.74 124.77 2ajc s LYS 513 Ca 0.04 -0.83 0.06 0.00 -0.36 0.00 0.00 55.97 54.87 2ajc s LYS 513 Cb -0.14 -2.22 -0.03 0.00 -1.51 0.00 0.00 37.83 33.94 2ajc s LYS 513 CO -0.07 0.51 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.75 2ajc s LEU 514 N -0.47 2.66 0.00 5.43 1.02 -1.26 -0.78 118.68 125.28 2ajc s LEU 514 Ca 0.05 -0.34 -0.02 0.00 0.02 0.00 0.00 54.13 53.84 2ajc s LEU 514 Cb -0.12 -1.55 0.01 0.00 0.02 0.00 0.00 46.19 44.56 2ajc s LEU 514 CO 0.01 0.29 0.12 -0.67 0.02 0.00 0.00 176.35 176.12 2ajc n ASP 515 N 1.82 -0.29 -4.33 2.29 4.64 -0.53 -5.00 116.55 115.14 2ajc n ASP 515 Ca -0.16 -1.18 -0.20 0.00 -1.38 0.00 0.00 54.79 51.87 2ajc n ASP 515 Cb 0.52 0.48 -0.11 0.00 -1.04 0.00 0.00 41.12 40.97 2ajc n ASP 515 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 2ajc s VAL 516 N -2.73 1.75 0.13 5.18 1.01 -1.26 -0.73 120.40 123.74 2ajc s VAL 516 Ca 0.03 -2.07 -0.03 0.00 0.00 0.00 0.00 61.98 59.90 2ajc s VAL 516 Cb -0.01 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 2ajc s VAL 516 CO 0.01 -0.48 0.11 0.27 0.00 0.00 0.00 175.10 175.01 2ajc s ILE 517 N -2.57 0.11 -0.11 2.22 -4.36 -0.49 -4.96 121.20 111.03 2ajc s ILE 517 Ca 0.19 -1.73 -0.01 0.00 -0.26 0.00 0.00 60.65 58.84 2ajc s ILE 517 Cb -0.03 -1.90 -0.03 0.00 1.25 0.00 0.00 42.46 41.76 2ajc s ILE 517 CO 0.07 -0.49 -0.07 0.20 0.24 0.00 0.00 174.94 174.88 2ajc s ASN 518 N -3.00 4.59 -0.06 4.36 -0.87 -1.26 -0.49 114.94 118.20 2ajc s ASN 518 Ca 0.19 -0.12 0.00 0.00 -1.57 0.00 0.00 52.86 51.37 2ajc s ASN 518 Cb 0.06 -1.49 0.02 0.00 -0.02 0.00 0.00 41.25 39.83 2ajc s ASN 518 CO -0.01 0.25 -0.04 -0.76 -2.57 0.00 0.00 177.10 173.97 2ajc s LEU 519 N -0.13 1.10 -1.16 0.60 1.43 -0.27 -4.80 118.68 115.45 2ajc s LEU 519 Ca 0.01 -0.15 -0.04 0.00 -1.03 0.00 0.00 54.13 52.92 2ajc s LEU 519 Cb -0.13 -0.52 0.03 0.00 0.03 0.00 0.00 46.19 45.60 2ajc s LEU 519 CO 0.03 -0.10 0.26 1.41 0.23 0.00 0.00 176.35 178.18 2ajc n HIS 520 N 4.49 -1.64 -0.86 0.29 8.25 -1.26 -1.33 115.22 123.16 2ajc n HIS 520 Ca -0.18 0.25 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 2ajc n HIS 520 Cb 0.51 -2.93 0.00 0.00 1.12 0.00 0.00 29.99 28.69 2ajc n HIS 520 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ajc n GLY 521 N -1.01 0.57 3.21 -1.41 0.00 -1.26 -5.04 105.19 100.24 2ajc n GLY 521 Ca -0.08 -0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 2ajc n GLY 521 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ajc s THR 522 N -2.00 1.75 -0.00 2.61 2.01 -0.44 -5.11 115.64 114.46 2ajc s THR 522 Ca 0.00 -0.90 -0.25 0.00 0.31 0.00 0.00 61.69 60.84 2ajc s THR 522 Cb 0.00 -1.49 -0.04 0.00 0.01 0.00 0.00 72.50 70.98 2ajc s THR 522 CO 0.00 0.49 0.78 -1.59 -0.69 0.00 0.00 174.62 173.62 2ajc s LYS 523 N -0.12 4.49 0.10 4.92 -2.85 -1.26 -1.11 119.74 123.90 2ajc s LYS 523 Ca -0.02 1.07 0.07 0.00 -1.00 0.00 0.00 55.97 56.09 2ajc s LYS 523 Cb -0.12 -3.41 -0.03 0.00 -2.06 0.00 0.00 37.83 32.20 2ajc s LYS 523 CO 0.02 0.14 -0.18 -0.06 0.10 0.00 0.00 175.35 175.38 2ajc s PHE 524 N 0.44 1.55 0.13 1.78 0.40 0.36 -4.96 117.98 117.68 2ajc s PHE 524 Ca 0.41 -0.45 -0.06 0.00 -0.60 0.00 0.00 56.93 56.23 2ajc s PHE 524 Cb -0.20 -0.84 -0.06 0.00 0.51 0.00 0.00 43.02 42.43 2ajc s PHE 524 CO 0.22 0.16 0.39 -1.58 0.70 0.00 0.00 175.22 175.11 2ajc s TRP 525 N -1.40 3.49 0.10 0.36 0.52 -1.26 -1.40 118.94 119.35 2ajc s TRP 525 Ca 0.05 0.61 -0.02 0.00 0.02 0.00 0.00 56.10 56.75 2ajc s TRP 525 Cb -0.09 -2.04 -0.03 0.00 -1.15 0.00 0.00 33.47 30.16 2ajc s TRP 525 CO 0.04 0.44 0.05 1.52 0.02 0.00 0.00 176.95 179.02 2ajc s TYR 526 N -1.62 0.61 0.07 -1.98 -0.85 0.09 -1.80 117.35 111.88 2ajc s TYR 526 Ca 0.40 -1.07 0.03 0.00 -0.52 0.00 0.00 57.07 55.91 2ajc s TYR 526 Cb -0.12 -0.37 -0.03 0.00 0.38 0.00 0.00 41.96 41.82 2ajc s TYR 526 CO 0.23 -0.48 -0.09 1.14 -1.52 0.00 0.00 175.55 174.83 2ajc s GLN 527 N -3.97 0.73 -0.02 -3.49 -2.07 -0.52 -1.46 119.66 108.86 2ajc s GLN 527 Ca 0.15 -1.01 0.01 0.00 -1.82 0.00 0.00 55.36 52.68 2ajc s GLN 527 Cb 0.07 -0.45 0.01 0.00 -1.09 0.00 0.00 33.01 31.56 2ajc s GLN 527 CO -0.04 0.07 -0.03 -1.64 -1.32 0.00 0.00 175.29 172.33 2ajc s MET 528 N -2.36 0.38 -0.37 9.60 -1.94 0.04 -1.58 119.30 123.08 2ajc s MET 528 Ca -0.00 -0.06 -0.14 0.00 -1.71 0.00 0.00 55.69 53.78 2ajc s MET 528 Cb -0.05 -0.44 -0.00 0.00 2.01 0.00 0.00 34.83 36.35 2ajc s MET 528 CO -0.00 -0.01 0.27 0.42 -0.01 0.00 0.00 175.02 175.69 2ajc s ILE 529 N 0.41 5.27 -0.14 2.53 -1.09 0.72 -0.80 121.20 128.10 2ajc s ILE 529 Ca -0.04 -0.36 -0.07 0.00 -2.23 0.00 0.00 60.65 57.94 2ajc s ILE 529 Cb -0.07 -3.80 -0.04 0.00 -1.58 0.00 0.00 42.46 36.96 2ajc s ILE 529 CO -0.01 -0.12 0.12 -0.76 -1.23 0.00 0.00 174.94 172.94 2ajc s LEU 530 N 1.73 4.23 0.69 2.97 1.43 0.23 -2.49 118.68 127.47 2ajc s LEU 530 Ca 0.06 0.35 -0.17 0.00 -1.03 0.00 0.00 54.13 53.34 2ajc s LEU 530 Cb -0.18 -2.04 -0.02 0.00 0.03 0.00 0.00 46.19 43.98 2ajc s LEU 530 CO 0.10 0.33 0.88 -2.65 0.23 0.00 0.00 176.35 175.24 2ajc n PRO 531 N 2.50 0.56 -1.06 1.29 -0.02 -1.26 -1.45 135.00 135.57 2ajc n PRO 531 Ca -0.19 0.24 -0.32 0.00 -2.02 0.00 0.00 63.50 61.22 2ajc n PRO 531 Cb 0.54 -2.12 0.13 0.00 -0.02 0.00 0.00 33.50 32.02 2ajc n PRO 531 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2ajc s PRO 532 N -3.06 1.66 -1.47 0.52 0.02 -1.26 -2.60 135.00 128.81 2ajc s PRO 532 Ca 0.73 1.51 -0.11 0.00 0.02 0.00 0.00 61.00 63.15 2ajc s PRO 532 Cb -0.37 -1.80 0.07 0.00 0.02 0.00 0.00 34.50 32.42 2ajc s PRO 532 CO 0.51 -2.15 0.79 0.72 -0.33 0.00 0.00 177.00 176.54 2ajc n HIS 533 N -3.60 -2.10 -1.64 6.54 8.25 -1.26 -4.80 115.22 116.61 2ajc n HIS 533 Ca 0.12 0.72 -0.50 0.00 -0.26 0.00 0.00 57.72 57.80 2ajc n HIS 533 Cb 0.52 -3.74 -0.05 0.00 1.12 0.00 0.00 29.99 27.83 2ajc n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2ajc n PHE 534 N -4.45 2.14 -3.38 4.41 7.35 -1.07 -4.92 117.46 117.54 2ajc n PHE 534 Ca 0.01 0.12 -0.45 0.00 -0.76 0.00 0.00 57.45 56.37 2ajc n PHE 534 Cb 0.54 -2.62 -0.05 0.00 0.35 0.00 0.00 39.48 37.70 2ajc n PHE 534 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2ajc s ASP 535 N 4.90 6.18 0.59 -2.13 1.11 -1.26 -4.92 116.67 121.13 2ajc s ASP 535 Ca 0.97 -2.03 0.14 0.00 0.18 0.00 0.00 52.55 51.81 2ajc s ASP 535 Cb -0.76 -2.16 0.75 0.00 1.07 0.00 0.00 42.92 41.83 2ajc s ASP 535 CO 0.52 -0.75 1.39 0.07 1.18 0.00 0.00 175.17 177.58 2ajc h LYS 536 N 8.52 0.00 0.08 8.23 5.09 -1.98 0.13 116.57 136.63 2ajc h LYS 536 Ca -0.19 0.00 -0.27 0.00 0.09 0.00 0.00 60.65 60.28 2ajc h LYS 536 Cb 1.08 0.00 0.03 0.00 0.10 0.00 0.00 32.23 33.43 2ajc h LYS 536 CO 0.94 0.00 -1.09 1.03 -2.09 0.00 0.00 179.45 178.23 2ajc h SER 537 N 0.00 0.82 -4.35 7.07 0.87 -1.92 -3.39 113.55 112.65 2ajc h SER 537 Ca 0.00 -0.81 -0.51 0.00 -1.23 0.00 0.00 61.79 59.24 2ajc h SER 537 Cb 1.24 -0.26 0.08 0.00 -0.44 0.00 0.00 62.40 63.03 2ajc h SER 537 CO 0.00 1.54 0.39 -0.75 -0.53 0.00 0.00 176.83 177.47 2ajc s LYS 538 N -3.04 3.13 -0.35 2.24 2.20 0.43 -4.91 119.74 119.44 2ajc s LYS 538 Ca -0.10 0.85 -0.08 0.00 -0.36 0.00 0.00 55.97 56.28 2ajc s LYS 538 Cb 0.05 -2.02 0.04 0.00 -1.51 0.00 0.00 37.83 34.39 2ajc s LYS 538 CO 0.91 -0.94 0.13 0.15 -0.36 0.00 0.00 175.35 175.25 2ajc s LYS 539 N -5.11 2.67 0.13 4.03 1.02 -1.26 -4.35 119.74 116.86 2ajc s LYS 539 Ca 0.57 -1.16 -0.03 0.00 0.02 0.00 0.00 55.97 55.37 2ajc s LYS 539 Cb -0.13 -3.54 -0.05 0.00 -0.52 0.00 0.00 37.83 33.60 2ajc s LYS 539 CO 0.54 -0.68 0.33 0.71 -0.92 0.00 0.00 175.35 175.34 2ajc s TYR 540 N 1.44 3.49 0.71 3.18 1.51 0.85 -4.40 117.35 124.13 2ajc s TYR 540 Ca -0.01 0.44 -0.12 0.00 -1.01 0.00 0.00 57.07 56.38 2ajc s TYR 540 Cb -0.19 -1.92 0.02 0.00 -0.11 0.00 0.00 41.96 39.76 2ajc s TYR 540 CO 0.04 0.47 1.08 -1.25 -1.11 0.00 0.00 175.55 174.78 2ajc s PRO 541 N -2.70 2.64 -0.07 -1.71 0.04 -1.26 0.14 135.00 132.08 2ajc s PRO 541 Ca 0.39 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.58 2ajc s PRO 541 Cb -0.12 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.49 2ajc s PRO 541 CO 0.26 -1.34 -0.05 -1.17 0.04 0.00 0.00 177.00 174.74 2ajc s LEU 542 N -5.51 1.17 -0.19 -3.56 0.20 -0.31 -1.32 118.68 109.16 2ajc s LEU 542 Ca 0.61 -0.19 -0.05 0.00 0.69 0.00 0.00 54.13 55.19 2ajc s LEU 542 Cb -0.17 -0.60 -0.03 0.00 -0.43 0.00 0.00 46.19 44.96 2ajc s LEU 542 CO 0.52 -0.09 0.01 -0.22 -0.29 0.00 0.00 176.35 176.28 2ajc s LEU 543 N 1.32 3.40 -0.23 -0.68 0.20 0.55 -0.92 118.68 122.32 2ajc s LEU 543 Ca -0.04 -0.12 -0.15 0.00 0.69 0.00 0.00 54.13 54.51 2ajc s LEU 543 Cb -0.14 -1.85 -0.04 0.00 -0.43 0.00 0.00 46.19 43.73 2ajc s LEU 543 CO -0.03 0.11 0.38 -0.63 -0.29 0.00 0.00 176.35 175.90 2ajc s ILE 544 N 0.72 5.19 -0.24 6.68 -1.09 0.16 -1.22 121.20 131.39 2ajc s ILE 544 Ca 0.00 0.63 -0.10 0.00 -2.23 0.00 0.00 60.65 58.96 2ajc s ILE 544 Cb -0.14 -3.71 -0.05 0.00 -1.58 0.00 0.00 42.46 36.99 2ajc s ILE 544 CO 0.02 0.21 0.14 -0.70 -1.23 0.00 0.00 174.94 173.38 2ajc s GLU 545 N 1.65 4.00 0.03 2.79 2.12 -0.10 -0.84 118.70 128.35 2ajc s GLU 545 Ca 0.17 -0.31 0.06 0.00 0.36 0.00 0.00 54.97 55.26 2ajc s GLU 545 Cb -0.15 -3.48 -0.02 0.00 0.26 0.00 0.00 34.13 30.74 2ajc s GLU 545 CO 0.08 0.04 -0.19 0.54 -0.54 0.00 0.00 175.26 175.20 2ajc s VAL 546 N 1.08 1.52 0.00 3.70 0.11 0.15 -4.40 120.40 122.56 2ajc s VAL 546 Ca 0.07 -1.06 0.00 0.00 -2.93 0.00 0.00 61.98 58.06 2ajc s VAL 546 Cb -0.14 -1.31 0.00 0.00 -1.53 0.00 0.00 36.38 33.40 2ajc s VAL 546 CO 0.04 0.23 0.00 0.00 -3.33 0.00 0.00 175.10 172.04 2ajc n TYR 547 N 2.06 0.00 -1.23 1.54 -0.00 -1.26 -4.21 117.16 114.05 2ajc n TYR 547 Ca -0.17 0.00 -0.08 0.00 -0.00 0.00 0.00 57.90 57.65 2ajc n TYR 547 Cb 0.54 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.85 2ajc n TYR 547 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2ajc n ALA 548 N -1.21 -0.12 -1.72 2.98 0.00 -1.26 -2.93 120.51 116.25 2ajc n ALA 548 Ca 0.00 0.13 -0.29 0.00 0.00 0.00 0.00 53.44 53.27 2ajc n ALA 548 Cb 0.00 -1.36 0.09 0.00 0.00 0.00 0.00 19.45 18.18 2ajc n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ajc s GLY 549 N -2.44 1.60 0.12 0.00 0.00 -1.26 -4.86 107.32 100.48 2ajc s GLY 549 Ca 0.00 -0.43 -0.34 0.00 0.00 0.00 0.00 44.72 43.95 2ajc s GLY 549 CO 0.00 0.03 1.62 -1.55 0.00 0.00 0.00 173.10 173.20 2ajc n PRO 550 N -3.37 2.14 -1.42 2.90 -0.04 -1.26 -0.58 135.00 133.36 2ajc n PRO 550 Ca 0.07 0.77 -0.14 0.00 -0.04 0.00 0.00 63.50 64.16 2ajc n PRO 550 Cb 0.58 -2.55 -0.06 0.00 -0.04 0.00 0.00 33.50 31.43 2ajc n PRO 550 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ajc s SER 552 N -2.83 5.35 -0.28 0.00 1.04 0.25 -3.86 113.70 113.36 2ajc s SER 552 Ca 0.00 1.74 -0.02 0.00 0.48 0.00 0.00 55.95 58.16 2ajc s SER 552 Cb 0.00 -2.52 0.12 0.00 0.10 0.00 0.00 66.02 63.73 2ajc s SER 552 CO 0.00 -1.46 0.24 -1.58 0.98 0.00 0.00 173.24 171.42 2ajc s GLN 553 N -4.63 0.28 0.00 4.02 0.74 -1.26 -1.08 119.66 117.72 2ajc s GLN 553 Ca 0.61 -0.23 0.22 0.00 0.05 0.00 0.00 55.36 56.01 2ajc s GLN 553 Cb -0.16 -0.83 -0.11 0.00 1.10 0.00 0.00 33.01 33.01 2ajc s GLN 553 CO 0.48 -1.00 1.00 1.63 -0.55 0.00 0.00 175.29 176.85 2ajc n LYS 554 N 5.29 0.67 -3.86 1.67 4.76 -1.26 -4.82 118.16 120.61 2ajc n LYS 554 Ca -0.03 -0.55 -0.36 0.00 -2.87 0.00 0.00 58.31 54.50 2ajc n LYS 554 Cb 0.45 -1.49 -0.13 0.00 -1.84 0.00 0.00 35.03 32.02 2ajc n LYS 554 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2ajc s VAL 555 N -2.71 3.37 0.32 -0.18 1.01 -1.26 -4.88 120.40 116.07 2ajc s VAL 555 Ca 0.14 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 61.05 2ajc s VAL 555 Cb 0.17 -2.77 0.02 0.00 0.00 0.00 0.00 36.38 33.80 2ajc s VAL 555 CO 0.71 0.08 0.60 1.51 0.00 0.00 0.00 175.10 178.00 2ajc s ASP 556 N 1.39 0.23 -0.35 3.32 1.47 -1.26 -4.34 116.67 117.13 2ajc s ASP 556 Ca 0.00 -1.13 0.07 0.00 1.18 0.00 0.00 52.55 52.67 2ajc s ASP 556 Cb -0.17 0.71 0.66 0.00 -0.34 0.00 0.00 42.92 43.77 2ajc s ASP 556 CO -0.01 -1.38 1.78 0.35 0.68 0.00 0.00 175.17 176.59 2ajc n THR 557 N -0.49 2.87 -2.71 2.11 -2.24 -0.65 -4.97 114.28 108.19 2ajc n THR 557 Ca -0.03 -1.61 -0.39 0.00 -2.27 0.00 0.00 64.05 59.75 2ajc n THR 557 Cb 0.61 -0.45 -0.06 0.00 -2.10 0.00 0.00 70.33 68.33 2ajc n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2ajc s VAL 558 N -2.89 4.01 -0.12 2.28 1.01 -1.26 -1.31 120.40 122.10 2ajc s VAL 558 Ca 0.52 1.88 -0.23 0.00 0.00 0.00 0.00 61.98 64.15 2ajc s VAL 558 Cb 0.42 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 2ajc s VAL 558 CO 0.12 0.34 0.68 0.12 0.00 0.00 0.00 175.10 176.36 2ajc s PHE 559 N -1.34 3.49 -0.03 5.22 5.36 0.68 -4.88 117.98 126.48 2ajc s PHE 559 Ca 0.45 1.13 -0.03 0.00 -0.96 0.00 0.00 56.93 57.52 2ajc s PHE 559 Cb -0.24 -2.81 0.01 0.00 -0.34 0.00 0.00 43.02 39.63 2ajc s PHE 559 CO 0.31 -0.03 0.09 1.03 -1.46 0.00 0.00 175.22 175.16 2ajc s ARG 560 N 1.30 0.13 -0.47 10.12 0.52 -1.26 -4.92 118.95 124.36 2ajc s ARG 560 Ca 0.34 0.09 -0.12 0.00 -0.52 0.00 0.00 55.73 55.51 2ajc s ARG 560 Cb -0.17 0.06 0.10 0.00 0.52 0.00 0.00 34.95 35.46 2ajc s ARG 560 CO 0.14 -0.02 0.37 -0.51 0.02 0.00 0.00 175.30 175.31 2ajc s LEU 561 N -0.05 5.65 0.00 2.53 1.02 -1.26 -4.87 118.68 121.70 2ajc s LEU 561 Ca -0.01 -1.64 0.03 0.00 0.02 0.00 0.00 54.13 52.53 2ajc s LEU 561 Cb -0.01 -2.09 -0.01 0.00 0.02 0.00 0.00 46.19 44.10 2ajc s LEU 561 CO 0.00 -0.68 0.09 -1.54 0.02 0.00 0.00 176.35 174.25 2ajc n SER 562 N 5.06 1.60 -0.28 2.29 3.41 -1.26 -4.97 113.62 119.47 2ajc n SER 562 Ca -0.11 -2.78 0.01 0.00 -0.26 0.00 0.00 58.87 55.73 2ajc n SER 562 Cb 0.42 0.72 0.21 0.00 -0.26 0.00 0.00 64.21 65.30 2ajc n SER 562 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 2ajc h TRP 563 N 1.48 1.05 -0.43 7.33 7.01 -1.96 -0.85 115.95 129.58 2ajc h TRP 563 Ca -0.28 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.74 2ajc h TRP 563 Cb 1.00 -0.35 -0.02 0.00 -2.10 0.00 0.00 29.16 27.68 2ajc h TRP 563 CO 0.00 0.64 0.21 0.00 -2.79 0.00 0.00 178.44 176.50 2ajc h ALA 564 N 1.48 1.58 -0.84 2.65 0.00 -1.98 -0.72 119.26 121.43 2ajc h ALA 564 Ca 0.33 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.16 2ajc h ALA 564 Cb -0.05 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 2ajc h ALA 564 CO -0.09 0.35 0.55 1.15 0.00 0.00 0.00 179.25 181.21 2ajc h THR 565 N 0.59 1.22 -0.21 0.00 2.02 -1.49 -1.32 112.91 113.72 2ajc h THR 565 Ca 0.15 -0.42 -0.07 0.00 0.77 0.00 0.00 66.41 66.85 2ajc h THR 565 Cb 0.05 -0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.45 2ajc h THR 565 CO -0.02 0.22 -0.14 0.22 0.37 0.00 0.00 175.52 176.17 2ajc h TYR 566 N 1.14 0.54 -0.96 3.16 3.20 -1.10 -0.68 116.97 122.27 2ajc h TYR 566 Ca 0.31 -0.14 0.11 0.00 3.14 0.00 0.00 58.73 62.14 2ajc h TYR 566 Cb -0.11 -0.12 -0.07 0.00 1.54 0.00 0.00 36.73 37.96 2ajc h TYR 566 CO -0.01 0.77 0.62 -0.07 -1.64 0.00 0.00 178.16 177.83 2ajc h LEU 567 N 0.16 0.89 0.00 2.82 3.38 -0.84 -0.10 115.31 121.62 2ajc h LEU 567 Ca 0.04 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2ajc h LEU 567 Cb 0.65 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2ajc h LEU 567 CO 0.04 0.50 -0.00 0.00 0.09 0.00 0.00 178.44 179.07 2ajc h ALA 568 N 1.53 -0.00 -0.10 1.53 0.00 -1.16 -1.63 119.26 119.44 2ajc h ALA 568 Ca 0.46 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2ajc h ALA 568 Cb 0.43 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2ajc h ALA 568 CO -0.22 -0.03 0.03 1.03 0.00 0.00 0.00 179.25 180.06 2ajc h SER 569 N -0.94 0.15 0.06 0.00 0.87 -1.03 -2.83 113.55 109.83 2ajc h SER 569 Ca -0.00 -0.22 -0.35 0.00 -1.23 0.00 0.00 61.79 59.99 2ajc h SER 569 Cb 0.91 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.80 2ajc h SER 569 CO 0.00 0.33 -1.98 0.41 -0.53 0.00 0.00 176.83 175.07 2ajc n THR 570 N -4.88 1.64 1.17 2.23 -1.04 -0.06 -4.55 114.28 108.80 2ajc n THR 570 Ca -0.06 -0.46 0.12 0.00 -2.04 0.00 0.00 64.05 61.61 2ajc n THR 570 Cb 0.14 -1.76 0.25 0.00 -1.82 0.00 0.00 70.33 67.14 2ajc n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2ajc n GLU 571 N -3.75 1.00 -3.48 -2.82 -0.58 -1.05 -4.98 120.64 104.98 2ajc n GLU 571 Ca -0.37 -0.68 -0.21 0.00 -0.42 0.00 0.00 57.16 55.48 2ajc n GLU 571 Cb 0.93 -1.49 0.08 0.00 -0.57 0.00 0.00 31.44 30.40 2ajc n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2ajc n ASN 572 N -0.40 -4.99 -4.62 1.62 4.13 -0.71 -4.95 115.26 105.32 2ajc n ASN 572 Ca 0.11 -0.53 -0.34 0.00 1.68 0.00 0.00 54.58 55.50 2ajc n ASN 572 Cb 0.39 -4.79 -0.10 0.00 -1.54 0.00 0.00 39.78 33.73 2ajc n ASN 572 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2ajc s ILE 573 N -3.31 4.07 0.02 2.41 1.01 -0.69 -4.33 121.20 120.37 2ajc s ILE 573 Ca 0.40 -0.33 -0.23 0.00 0.00 0.00 0.00 60.65 60.49 2ajc s ILE 573 Cb -0.18 -2.71 -0.05 0.00 0.01 0.00 0.00 42.46 39.53 2ajc s ILE 573 CO 0.69 0.58 0.70 -0.63 0.00 0.00 0.00 174.94 176.27 2ajc s ILE 574 N -0.61 4.83 -0.22 2.92 1.01 -0.44 -3.62 121.20 125.07 2ajc s ILE 574 Ca 0.10 1.47 0.01 0.00 0.00 0.00 0.00 60.65 62.22 2ajc s ILE 574 Cb -0.12 -4.04 0.03 0.00 0.01 0.00 0.00 42.46 38.35 2ajc s ILE 574 CO 0.02 0.37 -0.14 -0.69 0.00 0.00 0.00 174.94 174.50 2ajc s VAL 575 N -0.02 2.29 0.15 2.92 1.01 -1.04 -0.33 120.40 125.38 2ajc s VAL 575 Ca 0.36 -1.13 0.09 0.00 0.00 0.00 0.00 61.98 61.29 2ajc s VAL 575 Cb -0.19 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 2ajc s VAL 575 CO 0.20 0.32 -0.13 0.00 0.00 0.00 0.00 175.10 175.49 2ajc s ALA 576 N 1.25 2.85 0.05 5.51 0.00 -0.36 -0.20 121.76 130.86 2ajc s ALA 576 Ca 0.00 -1.42 0.02 0.00 0.00 0.00 0.00 51.96 50.56 2ajc s ALA 576 Cb -0.16 -0.70 -0.03 0.00 0.00 0.00 0.00 23.12 22.23 2ajc s ALA 576 CO -0.09 0.52 -0.08 -1.12 0.00 0.00 0.00 175.76 174.99 2ajc s SER 577 N -2.56 0.95 -0.02 0.00 0.01 -0.61 -0.92 113.70 110.54 2ajc s SER 577 Ca 0.22 -0.61 -0.01 0.00 1.31 0.00 0.00 55.95 56.86 2ajc s SER 577 Cb -0.09 0.04 0.02 0.00 0.21 0.00 0.00 66.02 66.20 2ajc s SER 577 CO 0.13 -0.23 0.04 0.12 0.41 0.00 0.00 173.24 173.71 2ajc s PHE 578 N -1.67 -0.01 -0.41 2.43 5.36 -1.26 -1.44 117.98 120.98 2ajc s PHE 578 Ca -0.07 0.15 -0.11 0.00 -0.96 0.00 0.00 56.93 55.95 2ajc s PHE 578 Cb -0.08 -0.15 0.06 0.00 -0.34 0.00 0.00 43.02 42.51 2ajc s PHE 578 CO -0.00 -0.08 0.25 -0.51 -1.46 0.00 0.00 175.22 173.43 2ajc s ASP 579 N 0.77 5.74 0.00 6.13 1.01 -0.75 -4.83 116.67 124.75 2ajc s ASP 579 Ca -0.06 -1.27 0.00 0.00 0.71 0.00 0.00 52.55 51.93 2ajc s ASP 579 Cb -0.09 -2.03 0.00 0.00 1.01 0.00 0.00 42.92 41.81 2ajc s ASP 579 CO -0.02 -0.49 0.00 0.61 0.21 0.00 0.00 175.17 175.48 2ajc n GLY 580 N 4.99 2.82 3.77 0.21 0.00 -1.26 -3.99 105.19 111.72 2ajc n GLY 580 Ca -0.11 -1.86 -0.40 0.00 0.00 0.00 0.00 46.02 43.64 2ajc n GLY 580 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ajc s ARG 581 N 3.51 4.02 0.00 1.61 0.52 -1.26 -1.68 118.95 125.66 2ajc s ARG 581 Ca 0.00 2.36 0.00 0.00 -0.52 0.00 0.00 55.73 57.57 2ajc s ARG 581 Cb 0.00 -2.86 0.00 0.00 0.52 0.00 0.00 34.95 32.61 2ajc s ARG 581 CO 0.00 -0.53 0.00 0.41 0.02 0.00 0.00 175.30 175.20 2ajc n GLY 582 N 0.61 2.30 3.78 -3.53 0.00 0.27 -4.06 105.19 104.56 2ajc n GLY 582 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 2ajc n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ajc s SER 583 N -1.75 4.61 0.49 1.61 1.04 -0.68 -0.02 113.70 119.01 2ajc s SER 583 Ca 0.00 1.60 0.07 0.00 0.48 0.00 0.00 55.95 58.10 2ajc s SER 583 Cb 0.00 -2.36 0.07 0.00 0.10 0.00 0.00 66.02 63.83 2ajc s SER 583 CO 0.00 -1.93 0.60 0.61 0.98 0.00 0.00 173.24 173.50 2ajc n GLY 584 N -1.62 2.16 2.60 7.32 0.00 -0.24 -3.50 105.19 111.91 2ajc n GLY 584 Ca 0.08 -2.23 -0.05 0.00 0.00 0.00 0.00 46.02 43.82 2ajc n GLY 584 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ajc n TYR 585 N -1.96 0.00 -1.45 1.61 4.01 -1.26 -4.82 117.16 113.29 2ajc n TYR 585 Ca 0.10 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.90 2ajc n TYR 585 Cb 0.51 -1.79 0.10 0.00 -0.31 0.00 0.00 39.34 37.85 2ajc n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2ajc n GLN 586 N -1.04 0.85 0.00 -0.72 6.02 -1.26 -4.36 117.38 116.87 2ajc n GLN 586 Ca -0.05 -2.11 0.00 0.00 -0.01 0.00 0.00 57.00 54.83 2ajc n GLN 586 Cb 0.39 -1.14 0.00 0.00 1.02 0.00 0.00 30.24 30.51 2ajc n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ajc n GLY 587 N -0.89 1.13 0.23 1.08 0.00 -1.26 -4.57 105.19 100.90 2ajc n GLY 587 Ca 0.11 -1.74 0.08 0.00 0.00 0.00 0.00 46.02 44.48 2ajc n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2ajc h ASP 588 N 0.00 0.00 -0.56 1.61 3.32 -0.64 -1.59 116.42 118.56 2ajc h ASP 588 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2ajc h ASP 588 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2ajc h ASP 588 CO 0.00 0.24 0.30 0.50 -1.72 0.00 0.00 179.24 178.55 2ajc h LYS 589 N 0.00 0.79 0.06 3.56 3.64 -1.86 0.23 116.57 122.99 2ajc h LYS 589 Ca -0.00 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2ajc h LYS 589 Cb 0.56 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 2ajc h LYS 589 CO 0.03 0.62 -0.03 0.82 -2.27 0.00 0.00 179.45 178.62 2ajc h ILE 590 N 0.75 1.25 -0.41 2.00 1.08 -1.75 -3.23 117.51 117.21 2ajc h ILE 590 Ca 0.20 -1.41 -0.00 0.00 -0.39 0.00 0.00 64.86 63.25 2ajc h ILE 590 Cb 0.07 2.13 -0.02 0.00 -3.07 0.00 0.00 36.82 35.93 2ajc h ILE 590 CO -0.03 0.33 0.25 -0.03 -0.69 0.00 0.00 178.15 177.98 2ajc h MET 591 N -0.76 0.55 0.00 2.37 4.05 -1.17 0.86 114.93 120.83 2ajc h MET 591 Ca -0.01 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 2ajc h MET 591 Cb 0.61 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.30 2ajc h MET 591 CO 0.01 0.40 0.00 0.72 0.23 0.00 0.00 176.91 178.28 2ajc n HIS 592 N -4.77 0.00 0.24 1.39 8.25 0.80 -3.88 115.22 117.26 2ajc n HIS 592 Ca 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.54 2ajc n HIS 592 Cb 0.05 0.00 0.58 0.00 1.12 0.00 0.00 29.99 31.74 2ajc n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ajc h ALA 593 N 3.58 1.80 -0.61 -1.41 0.00 -1.51 -1.27 119.26 119.84 2ajc h ALA 593 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2ajc h ALA 593 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2ajc h ALA 593 CO 0.00 0.12 0.00 0.44 0.00 0.00 0.00 179.25 179.81 2ajc n ILE 594 N -4.37 1.84 -1.68 0.00 -5.35 -1.25 -4.92 119.36 103.63 2ajc n ILE 594 Ca -0.03 -1.14 -0.45 0.00 -0.27 0.00 0.00 62.75 60.87 2ajc n ILE 594 Cb 0.17 0.05 -0.03 0.00 -1.74 0.00 0.00 39.64 38.09 2ajc n ILE 594 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 2ajc n ASN 595 N 1.02 2.96 -1.07 7.28 4.05 -0.48 -1.40 115.26 127.62 2ajc n ASN 595 Ca 0.25 1.13 -0.12 0.00 0.45 0.00 0.00 54.58 56.28 2ajc n ASN 595 Cb 0.89 -1.44 -0.05 0.00 1.23 0.00 0.00 39.78 40.40 2ajc n ASN 595 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2ajc n ARG 596 N 2.43 -1.54 -2.75 1.20 1.74 0.22 -4.82 116.66 113.13 2ajc n ARG 596 Ca 0.13 0.82 -0.10 0.00 -0.77 0.00 0.00 57.85 57.93 2ajc n ARG 596 Cb 0.31 -5.06 0.06 0.00 -1.02 0.00 0.00 32.46 26.74 2ajc n ARG 596 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2ajc n ARG 597 N -1.29 1.12 -1.75 5.56 1.85 -0.49 -4.88 116.66 116.78 2ajc n ARG 597 Ca -0.12 -2.68 -0.38 0.00 -1.00 0.00 0.00 57.85 53.67 2ajc n ARG 597 Cb 0.50 -0.91 0.05 0.00 -1.05 0.00 0.00 32.46 31.06 2ajc n ARG 597 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2ajc s LEU 598 N -2.96 3.73 0.00 2.89 1.43 -1.23 -2.63 118.68 119.90 2ajc s LEU 598 Ca 0.27 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 56.09 2ajc s LEU 598 Cb 0.41 -4.42 0.00 0.00 0.03 0.00 0.00 46.19 42.21 2ajc s LEU 598 CO -0.03 -1.78 0.00 0.61 0.23 0.00 0.00 176.35 175.39 2ajc n GLY 599 N 0.81 0.77 0.00 -3.19 0.00 -1.26 -4.83 105.19 97.48 2ajc n GLY 599 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2ajc n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ajc n THR 600 N -2.12 0.00 -0.36 2.61 -2.24 -1.08 -4.63 114.28 106.46 2ajc n THR 600 Ca 0.00 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.82 2ajc n THR 600 Cb 0.00 -0.26 0.19 0.00 -2.10 0.00 0.00 70.33 68.16 2ajc n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2ajc h PHE 601 N 0.00 1.17 -0.16 4.78 0.04 -1.92 -0.88 116.94 119.97 2ajc h PHE 601 Ca 0.00 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.73 2ajc h PHE 601 Cb 0.00 -0.38 -0.01 0.00 2.20 0.00 0.00 35.95 37.76 2ajc h PHE 601 CO 0.00 0.57 -0.24 1.05 -0.60 0.00 0.00 178.31 179.09 2ajc h GLU 602 N 1.11 0.28 -0.08 1.51 9.09 -1.90 0.50 114.58 125.08 2ajc h GLU 602 Ca 0.45 -0.09 -0.10 0.00 0.05 0.00 0.00 59.36 59.67 2ajc h GLU 602 Cb 0.25 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.33 2ajc h GLU 602 CO -0.20 0.51 -0.34 0.28 0.05 0.00 0.00 179.01 179.31 2ajc h VAL 603 N 0.25 1.41 -0.84 -1.06 2.07 -1.64 -2.91 116.25 113.53 2ajc h VAL 603 Ca 0.04 -1.72 -0.02 0.00 0.82 0.00 0.00 66.70 65.83 2ajc h VAL 603 Cb 0.57 2.28 -0.04 0.00 -1.52 0.00 0.00 31.29 32.58 2ajc h VAL 603 CO 0.04 0.50 0.46 -0.33 0.02 0.00 0.00 177.57 178.25 2ajc h GLU 604 N -0.10 1.18 -0.40 1.57 5.08 -0.96 -2.60 114.58 118.34 2ajc h GLU 604 Ca -0.02 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.14 2ajc h GLU 604 Cb 0.98 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 2ajc h GLU 604 CO 0.07 0.87 -0.02 -0.44 -1.00 0.00 0.00 179.01 178.49 2ajc h ASP 605 N 1.18 0.62 -0.60 1.42 3.32 -0.94 -0.44 116.42 120.98 2ajc h ASP 605 Ca 0.30 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 57.15 2ajc h ASP 605 Cb 0.04 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 2ajc h ASP 605 CO -0.05 0.71 0.18 1.56 -1.72 0.00 0.00 179.24 179.92 2ajc h GLN 606 N 0.62 0.98 -0.23 3.56 1.08 -1.27 0.31 115.11 120.16 2ajc h GLN 606 Ca 0.12 -0.20 -0.06 0.00 -1.45 0.00 0.00 58.65 57.07 2ajc h GLN 606 Cb 0.41 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.69 2ajc h GLN 606 CO 0.02 0.85 -0.07 0.82 -0.95 0.00 0.00 178.83 179.49 2ajc h ILE 607 N 0.94 1.29 -0.61 2.54 2.04 -1.02 -2.32 117.51 120.37 2ajc h ILE 607 Ca 0.21 -1.10 -0.07 0.00 1.00 0.00 0.00 64.86 64.90 2ajc h ILE 607 Cb 0.29 1.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 2ajc h ILE 607 CO -0.01 0.34 0.10 -0.33 0.00 0.00 0.00 178.15 178.25 2ajc h GLU 608 N 0.17 1.01 -0.58 2.37 4.39 -0.91 -0.87 114.58 120.17 2ajc h GLU 608 Ca 0.05 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.47 2ajc h GLU 608 Cb 0.55 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.05 2ajc h GLU 608 CO 0.03 0.95 0.29 0.00 -1.16 0.00 0.00 179.01 179.12 2ajc h ALA 609 N 1.02 0.74 -0.58 3.43 0.00 -0.97 -1.99 119.26 120.90 2ajc h ALA 609 Ca 0.18 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2ajc h ALA 609 Cb 0.43 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2ajc h ALA 609 CO 0.01 0.29 0.12 1.15 0.00 0.00 0.00 179.25 180.82 2ajc h THR 610 N 0.78 1.25 -0.85 0.00 2.02 -1.20 -0.48 112.91 114.43 2ajc h THR 610 Ca 0.20 -0.94 0.10 0.00 0.77 0.00 0.00 66.41 66.54 2ajc h THR 610 Cb 0.09 0.74 -0.06 0.00 -1.74 0.00 0.00 68.15 67.18 2ajc h THR 610 CO -0.03 0.35 0.55 0.03 0.37 0.00 0.00 175.52 176.79 2ajc h ARG 611 N 0.85 0.78 -0.04 6.66 3.08 -0.77 0.35 114.38 125.29 2ajc h ARG 611 Ca 0.18 -0.05 -0.22 0.00 0.07 0.00 0.00 59.98 59.96 2ajc h ARG 611 Cb 0.38 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2ajc h ARG 611 CO 0.01 0.52 -0.88 1.96 -1.07 0.00 0.00 179.97 180.50 2ajc h GLN 612 N 0.80 0.50 -0.73 0.04 4.20 -0.75 -3.10 115.11 116.09 2ajc h GLN 612 Ca 0.40 -0.49 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 2ajc h GLN 612 Cb 0.45 0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 2ajc h GLN 612 CO -0.17 1.12 0.38 0.74 -0.67 0.00 0.00 178.83 180.24 2ajc h PHE 613 N 0.31 1.01 0.00 2.96 0.04 0.40 -2.08 116.94 119.58 2ajc h PHE 613 Ca -0.07 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.67 2ajc h PHE 613 Cb 1.50 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 39.33 2ajc h PHE 613 CO 0.07 0.73 0.00 -1.13 -0.60 0.00 0.00 178.31 177.37 2ajc n SER 614 N -4.45 0.00 -0.43 2.17 3.41 0.11 -1.36 113.62 113.07 2ajc n SER 614 Ca 0.06 0.06 0.08 0.00 -0.26 0.00 0.00 58.87 58.81 2ajc n SER 614 Cb 0.10 -0.22 0.02 0.00 -0.26 0.00 0.00 64.21 63.85 2ajc n SER 614 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2ajc n LYS 615 N -1.22 1.60 0.00 4.33 5.02 -0.79 -4.52 118.16 122.57 2ajc n LYS 615 Ca 0.05 -0.97 0.07 0.00 -2.02 0.00 0.00 58.31 55.43 2ajc n LYS 615 Cb 0.06 -1.27 0.38 0.00 -0.02 0.00 0.00 35.03 34.19 2ajc n LYS 615 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2ajc n MET 616 N 0.15 0.33 0.00 1.97 2.81 -0.46 -4.88 117.12 117.04 2ajc n MET 616 Ca 0.07 0.07 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 2ajc n MET 616 Cb 0.35 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.36 2ajc n MET 616 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ajc n GLY 617 N -0.13 2.78 1.23 3.03 0.00 -1.26 -4.75 105.19 106.09 2ajc n GLY 617 Ca 0.09 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.21 2ajc n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2ajc n PHE 618 N -0.53 0.91 -4.09 1.61 1.16 -1.26 -4.67 117.46 110.58 2ajc n PHE 618 Ca 0.00 -0.51 -0.35 0.00 -1.87 0.00 0.00 57.45 54.73 2ajc n PHE 618 Cb 0.00 -0.02 -0.11 0.00 -1.61 0.00 0.00 39.48 37.74 2ajc n PHE 618 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 2ajc s VAL 619 N -1.06 4.36 -0.74 1.97 1.01 -1.26 -0.11 120.40 124.57 2ajc s VAL 619 Ca 0.44 -0.18 -0.26 0.00 0.00 0.00 0.00 61.98 61.98 2ajc s VAL 619 Cb 0.23 -2.96 0.04 0.00 0.00 0.00 0.00 36.38 33.69 2ajc s VAL 619 CO 0.29 0.45 1.22 -0.62 0.00 0.00 0.00 175.10 176.44 2ajc s ASP 620 N 0.64 6.19 0.01 3.32 -1.08 0.12 -4.73 116.67 121.13 2ajc s ASP 620 Ca 0.01 -0.65 0.01 0.00 -0.52 0.00 0.00 52.55 51.40 2ajc s ASP 620 Cb -0.14 -2.53 0.06 0.00 -1.46 0.00 0.00 42.92 38.86 2ajc s ASP 620 CO 0.02 -1.72 1.04 -0.90 0.52 0.00 0.00 175.17 174.12 2ajc n ASP 621 N 8.95 0.01 -0.11 -0.34 5.75 -1.26 -0.42 116.55 129.14 2ajc n ASP 621 Ca 0.04 0.51 0.13 0.00 -0.01 0.00 0.00 54.79 55.45 2ajc n ASP 621 Cb 0.48 -0.51 0.42 0.00 -1.03 0.00 0.00 41.12 40.49 2ajc n ASP 621 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2ajc n LYS 622 N -1.52 0.44 -3.31 0.11 5.02 -1.26 -4.44 118.16 113.19 2ajc n LYS 622 Ca 0.00 -0.21 -0.25 0.00 -2.02 0.00 0.00 58.31 55.82 2ajc n LYS 622 Cb 0.01 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.44 2ajc n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2ajc n ARG 623 N -1.10 0.87 -4.59 1.97 1.74 0.44 -4.87 116.66 111.12 2ajc n ARG 623 Ca 0.10 -3.47 -0.33 0.00 -0.77 0.00 0.00 57.85 53.38 2ajc n ARG 623 Cb 0.32 -1.52 -0.16 0.00 -1.02 0.00 0.00 32.46 30.08 2ajc n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2ajc s ILE 624 N -1.05 2.25 0.40 0.55 1.01 -1.26 -1.16 121.20 121.94 2ajc s ILE 624 Ca 0.35 -0.91 0.06 0.00 0.00 0.00 0.00 60.65 60.14 2ajc s ILE 624 Cb 0.12 -1.92 -0.07 0.00 0.01 0.00 0.00 42.46 40.60 2ajc s ILE 624 CO -0.12 0.54 0.02 0.00 0.00 0.00 0.00 174.94 175.38 2ajc s ALA 625 N 0.85 3.07 -0.10 9.38 0.00 -0.09 -0.45 121.76 134.43 2ajc s ALA 625 Ca -0.06 -2.08 -0.11 0.00 0.00 0.00 0.00 51.96 49.71 2ajc s ALA 625 Cb -0.15 0.27 0.03 0.00 0.00 0.00 0.00 23.12 23.27 2ajc s ALA 625 CO -0.02 -0.16 0.31 -1.50 0.00 0.00 0.00 175.76 174.39 2ajc s ILE 626 N -2.86 0.01 0.08 0.00 2.07 -0.93 -0.67 121.20 118.91 2ajc s ILE 626 Ca 0.33 -0.10 -0.12 0.00 -1.41 0.00 0.00 60.65 59.35 2ajc s ILE 626 Cb 0.09 -0.47 0.01 0.00 0.13 0.00 0.00 42.46 42.22 2ajc s ILE 626 CO 0.16 -0.05 0.27 -1.66 -1.91 0.00 0.00 174.94 171.75 2ajc s TRP 627 N -0.12 -0.00 -0.06 3.50 1.48 -0.02 -1.66 118.94 122.05 2ajc s TRP 627 Ca -0.03 -0.31 -0.31 0.00 -1.06 0.00 0.00 56.10 54.39 2ajc s TRP 627 Cb -0.03 0.06 0.12 0.00 -1.16 0.00 0.00 33.47 32.45 2ajc s TRP 627 CO 0.01 -0.56 1.12 0.20 -4.06 0.00 0.00 176.95 173.66 2ajc s GLY 628 N -2.58 -0.35 -0.03 3.67 0.00 -0.96 -0.67 107.32 106.40 2ajc s GLY 628 Ca 0.01 1.03 0.07 0.00 0.00 0.00 0.00 44.72 45.84 2ajc s GLY 628 CO -0.09 0.31 -0.25 0.86 0.00 0.00 0.00 173.10 173.93 2ajc s TRP 629 N -2.70 2.37 0.00 1.90 -0.11 -1.26 -1.25 118.94 117.90 2ajc s TRP 629 Ca 0.10 -0.47 0.00 0.00 1.22 0.00 0.00 56.10 56.95 2ajc s TRP 629 Cb 0.00 -1.53 0.00 0.00 -1.50 0.00 0.00 33.47 30.45 2ajc s TRP 629 CO -0.04 -0.06 0.00 0.45 -4.62 0.00 0.00 176.95 172.68 2ajc n SER 630 N 2.52 0.00 -0.19 5.86 2.88 0.13 -1.40 113.62 123.43 2ajc n SER 630 Ca -0.16 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.43 2ajc n SER 630 Cb 0.51 0.00 0.33 0.00 -0.75 0.00 0.00 64.21 64.30 2ajc n SER 630 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2ajc h TYR 631 N 0.00 0.81 0.00 0.66 5.03 -1.86 0.19 116.97 121.80 2ajc h TYR 631 Ca 0.00 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.29 2ajc h TYR 631 Cb 0.00 -0.27 -0.01 0.00 1.55 0.00 0.00 36.73 38.01 2ajc h TYR 631 CO 0.00 0.45 -0.17 0.78 -1.32 0.00 0.00 178.16 177.89 2ajc h GLY 632 N 0.82 0.00 1.24 1.82 0.00 -1.11 -0.47 103.07 105.37 2ajc h GLY 632 Ca 0.30 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.43 2ajc h GLY 632 CO -0.10 0.00 -0.66 -1.33 0.00 0.00 0.00 176.54 174.46 2ajc h GLY 633 N 0.54 0.85 0.96 4.60 0.00 -0.62 -0.87 103.07 108.53 2ajc h GLY 633 Ca -0.00 -1.09 -0.01 0.00 0.00 0.00 0.00 47.33 46.23 2ajc h GLY 633 CO 0.02 0.97 -0.12 -1.82 0.00 0.00 0.00 176.54 175.60 2ajc h TYR 634 N 0.56 -0.30 -0.45 5.60 3.20 -0.47 -1.25 116.97 123.86 2ajc h TYR 634 Ca -0.02 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.85 2ajc h TYR 634 Cb 1.27 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.62 2ajc h TYR 634 CO 0.07 -0.15 0.29 0.28 -1.64 0.00 0.00 178.16 177.01 2ajc h VAL 635 N -0.37 1.13 -0.59 1.81 2.07 -1.15 0.20 116.25 119.34 2ajc h VAL 635 Ca -0.03 -0.25 0.10 0.00 0.82 0.00 0.00 66.70 67.33 2ajc h VAL 635 Cb 0.28 0.49 -0.08 0.00 -1.52 0.00 0.00 31.29 30.47 2ajc h VAL 635 CO 0.05 0.12 0.18 0.74 0.02 0.00 0.00 177.57 178.69 2ajc h THR 636 N 0.60 0.72 -0.34 2.57 2.02 -1.09 0.41 112.91 117.79 2ajc h THR 636 Ca 0.16 -0.12 -0.10 0.00 0.77 0.00 0.00 66.41 67.13 2ajc h THR 636 Cb -0.04 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 2ajc h THR 636 CO -0.03 0.06 -0.16 0.28 0.37 0.00 0.00 175.52 176.04 2ajc h SER 637 N 0.34 0.73 -0.80 4.18 0.02 -0.60 -0.72 113.55 116.69 2ajc h SER 637 Ca 0.30 -0.40 -0.03 0.00 -0.84 0.00 0.00 61.79 60.82 2ajc h SER 637 Cb 0.41 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.71 2ajc h SER 637 CO -0.34 0.97 0.39 0.24 -1.14 0.00 0.00 176.83 176.95 2ajc h MET 638 N 0.49 1.16 -0.43 3.45 2.86 -0.08 0.11 114.93 122.49 2ajc h MET 638 Ca 0.08 -0.17 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 2ajc h MET 638 Cb 0.69 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.13 2ajc h MET 638 CO 0.05 0.89 0.19 0.28 1.06 0.00 0.00 176.91 179.38 2ajc h VAL 639 N 1.14 1.19 0.00 -2.22 2.07 0.00 -1.82 116.25 116.61 2ajc h VAL 639 Ca 0.28 -0.56 -0.06 0.00 0.82 0.00 0.00 66.70 67.17 2ajc h VAL 639 Cb 0.12 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2ajc h VAL 639 CO -0.03 0.21 -0.29 -0.07 0.02 0.00 0.00 177.57 177.40 2ajc h LEU 640 N 0.55 0.00 -0.28 2.57 3.38 -0.79 -2.42 115.31 118.32 2ajc h LEU 640 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2ajc h LEU 640 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2ajc h LEU 640 CO -0.02 0.29 -0.05 0.61 0.09 0.00 0.00 178.44 179.37 2ajc n GLY 641 N -0.58 -0.82 0.22 0.83 0.00 -0.00 -3.90 105.19 100.94 2ajc n GLY 641 Ca -0.02 -0.27 0.11 0.00 0.00 0.00 0.00 46.02 45.85 2ajc n GLY 641 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ajc h ALA 642 N 3.84 0.95 -3.03 4.61 0.00 -0.82 -3.41 119.26 121.40 2ajc h ALA 642 Ca 0.00 -0.12 -0.23 0.00 0.00 0.00 0.00 54.91 54.57 2ajc h ALA 642 Cb 0.27 -0.02 0.05 0.00 0.00 0.00 0.00 17.79 18.09 2ajc h ALA 642 CO 0.00 0.16 -0.35 0.41 0.00 0.00 0.00 179.25 179.47 2ajc n GLY 643 N 0.61 0.04 0.15 0.00 0.00 -1.25 -4.93 105.19 99.82 2ajc n GLY 643 Ca 0.02 -0.24 0.13 0.00 0.00 0.00 0.00 46.02 45.93 2ajc n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ajc h SER 644 N -1.01 0.00 0.00 1.61 4.64 -1.88 -3.47 113.55 113.44 2ajc h SER 644 Ca -0.30 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2ajc h SER 644 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2ajc h SER 644 CO 0.32 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.89 2ajc n GLY 645 N 1.22 1.36 0.21 -0.77 0.00 -1.26 -4.87 105.19 101.08 2ajc n GLY 645 Ca 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 2ajc n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ajc h VAL 646 N 0.00 1.28 -3.38 1.61 2.07 -1.97 -3.45 116.25 112.41 2ajc h VAL 646 Ca 0.00 -2.11 -0.62 0.00 0.82 0.00 0.00 66.70 64.80 2ajc h VAL 646 Cb 0.00 2.17 -0.15 0.00 -1.52 0.00 0.00 31.29 31.78 2ajc h VAL 646 CO 0.00 0.66 -0.54 -0.36 0.02 0.00 0.00 177.57 177.35 2ajc s PHE 647 N -3.55 3.29 0.12 1.57 0.40 -1.26 -4.57 117.98 113.98 2ajc s PHE 647 Ca -0.10 0.13 -0.07 0.00 -0.60 0.00 0.00 56.93 56.29 2ajc s PHE 647 Cb 0.08 -2.16 -0.10 0.00 0.51 0.00 0.00 43.02 41.35 2ajc s PHE 647 CO 0.91 0.13 1.31 -0.22 0.70 0.00 0.00 175.22 178.05 2ajc h LYS 648 N 7.00 0.55 -3.31 0.44 3.64 -1.07 -3.46 116.57 120.36 2ajc h LYS 648 Ca -0.38 -0.53 -0.00 0.00 -1.27 0.00 0.00 60.65 58.47 2ajc h LYS 648 Cb 1.16 0.13 -0.08 0.00 -0.41 0.00 0.00 32.23 33.04 2ajc h LYS 648 CO 0.70 1.15 0.05 0.00 -2.27 0.00 0.00 179.45 179.08 2ajc s GLY 650 N -2.93 -0.58 -0.08 0.00 0.00 -0.63 -2.20 107.32 100.89 2ajc s GLY 650 Ca 0.14 0.77 0.01 0.00 0.00 0.00 0.00 44.72 45.64 2ajc s GLY 650 CO 0.04 0.37 -0.11 -0.42 0.00 0.00 0.00 173.10 172.98 2ajc s ILE 651 N -3.09 1.10 -0.13 0.90 1.01 -0.67 -1.69 121.20 118.63 2ajc s ILE 651 Ca -0.01 -0.41 0.01 0.00 0.00 0.00 0.00 60.65 60.23 2ajc s ILE 651 Cb -0.01 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.41 2ajc s ILE 651 CO -0.08 0.36 -0.16 0.00 0.00 0.00 0.00 174.94 175.07 2ajc s ALA 652 N 1.03 2.49 -0.17 9.38 0.00 -0.41 -2.26 121.76 131.83 2ajc s ALA 652 Ca -0.08 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 50.92 2ajc s ALA 652 Cb -0.15 -1.14 -0.00 0.00 0.00 0.00 0.00 23.12 21.82 2ajc s ALA 652 CO -0.01 0.15 -0.13 0.08 0.00 0.00 0.00 175.76 175.86 2ajc s VAL 653 N 0.52 2.85 -1.45 0.00 1.01 -0.38 -1.32 120.40 121.63 2ajc s VAL 653 Ca -0.10 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 2ajc s VAL 653 Cb -0.16 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.01 2ajc s VAL 653 CO 0.04 0.50 0.38 0.00 0.00 0.00 0.00 175.10 176.02 2ajc n ALA 654 N 4.15 -1.96 -1.78 5.51 0.00 0.14 -0.69 120.51 125.87 2ajc n ALA 654 Ca -0.19 -0.27 -0.33 0.00 0.00 0.00 0.00 53.44 52.65 2ajc n ALA 654 Cb 0.52 -1.51 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 2ajc n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2ajc s PRO 655 N -6.69 3.81 0.26 0.00 0.04 -1.26 -3.23 135.00 127.92 2ajc s PRO 655 Ca 0.05 1.22 -0.29 0.00 0.04 0.00 0.00 61.00 62.02 2ajc s PRO 655 Cb -0.03 -2.10 -0.09 0.00 0.04 0.00 0.00 34.50 32.32 2ajc s PRO 655 CO 0.91 -0.41 0.93 0.08 0.04 0.00 0.00 177.00 178.55 2ajc s VAL 656 N -2.22 4.13 0.00 -0.36 1.01 -1.25 -4.54 120.40 117.17 2ajc s VAL 656 Ca 0.64 1.99 0.00 0.00 0.00 0.00 0.00 61.98 64.61 2ajc s VAL 656 Cb -0.14 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.02 2ajc s VAL 656 CO 0.24 0.39 0.00 -1.54 0.00 0.00 0.00 175.10 174.19 2ajc n SER 657 N 1.21 4.99 -3.67 3.32 3.41 -1.26 -4.10 113.62 117.53 2ajc n SER 657 Ca -0.01 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.51 2ajc n SER 657 Cb 0.48 0.87 -0.10 0.00 -0.26 0.00 0.00 64.21 65.20 2ajc n SER 657 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2ajc s LYS 658 N -2.00 0.34 0.49 4.33 2.20 -1.26 -0.89 119.74 122.95 2ajc s LYS 658 Ca 0.00 0.98 0.19 0.00 -0.36 0.00 0.00 55.97 56.77 2ajc s LYS 658 Cb 0.00 0.24 1.22 0.00 -1.51 0.00 0.00 37.83 37.78 2ajc s LYS 658 CO 0.00 -0.23 2.02 -1.49 -0.36 0.00 0.00 175.35 175.29 2ajc h TRP 659 N 7.93 0.17 0.00 4.03 4.06 -1.87 0.18 115.95 130.45 2ajc h TRP 659 Ca -0.21 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.75 2ajc h TRP 659 Cb 1.13 -0.06 0.00 0.00 -1.00 0.00 0.00 29.16 29.23 2ajc h TRP 659 CO 0.28 0.08 0.00 0.93 -3.56 0.00 0.00 178.44 176.17 2ajc h GLU 660 N 0.17 0.00 0.00 0.49 5.08 -1.92 -1.61 114.58 116.78 2ajc h GLU 660 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2ajc h GLU 660 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2ajc h GLU 660 CO -0.03 0.00 -0.42 0.66 -1.00 0.00 0.00 179.01 178.22 2ajc n TYR 661 N -2.66 0.61 -2.49 4.33 4.01 0.05 -3.67 117.16 117.34 2ajc n TYR 661 Ca -0.01 0.18 -0.23 0.00 -0.16 0.00 0.00 57.90 57.68 2ajc n TYR 661 Cb 0.15 -0.71 0.08 0.00 -0.31 0.00 0.00 39.34 38.55 2ajc n TYR 661 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2ajc s TYR 662 N -3.13 2.36 0.64 -0.72 5.04 -0.61 -4.82 117.35 116.10 2ajc s TYR 662 Ca 0.08 0.01 -0.14 0.00 -2.44 0.00 0.00 57.07 54.58 2ajc s TYR 662 Cb 0.14 -3.01 -0.02 0.00 0.35 0.00 0.00 41.96 39.42 2ajc s TYR 662 CO 0.68 -1.38 1.06 0.16 -1.34 0.00 0.00 175.55 174.73 2ajc s ASP 663 N -4.58 5.59 0.09 4.32 1.47 -1.26 -1.29 116.67 121.01 2ajc s ASP 663 Ca 0.62 1.75 -0.27 0.00 1.18 0.00 0.00 52.55 55.83 2ajc s ASP 663 Cb -0.08 -2.52 -0.15 0.00 -0.34 0.00 0.00 42.92 39.83 2ajc s ASP 663 CO 0.43 -1.30 1.69 0.77 0.68 0.00 0.00 175.17 177.43 2ajc h SER 664 N -0.01 -0.38 0.00 2.11 4.64 -1.05 -1.53 113.55 117.33 2ajc h SER 664 Ca -0.46 0.02 0.03 0.00 -0.47 0.00 0.00 61.79 60.92 2ajc h SER 664 Cb 1.22 0.11 -0.04 0.00 -0.31 0.00 0.00 62.40 63.38 2ajc h SER 664 CO 0.57 -0.24 -0.20 0.58 -0.87 0.00 0.00 176.83 176.66 2ajc h VAL 665 N -0.38 0.52 0.14 0.95 2.07 -1.93 -0.23 116.25 117.39 2ajc h VAL 665 Ca -0.02 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 2ajc h VAL 665 Cb 0.32 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 2ajc h VAL 665 CO 0.02 0.00 -0.07 0.22 0.02 0.00 0.00 177.57 177.76 2ajc h TYR 666 N -0.33 -0.17 0.07 1.57 5.03 -1.91 -2.92 116.97 118.31 2ajc h TYR 666 Ca 0.06 -0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.37 2ajc h TYR 666 Cb 0.40 0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.72 2ajc h TYR 666 CO -0.25 0.25 -0.12 1.15 -1.32 0.00 0.00 178.16 177.87 2ajc h THR 667 N -0.68 0.72 0.00 1.81 2.02 -1.24 -2.65 112.91 112.88 2ajc h THR 667 Ca -0.02 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.13 2ajc h THR 667 Cb 0.50 0.72 -0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2ajc h THR 667 CO 0.03 0.00 -0.17 -0.33 0.37 0.00 0.00 175.52 175.43 2ajc h GLU 668 N -0.24 0.00 -1.00 6.66 5.08 -1.16 0.15 114.58 124.06 2ajc h GLU 668 Ca 0.02 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.52 2ajc h GLU 668 Cb 0.26 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.42 2ajc h GLU 668 CO -0.07 0.17 0.62 -0.09 -1.00 0.00 0.00 179.01 178.64 2ajc h ARG 669 N 0.00 0.89 0.00 2.33 2.43 -1.26 -0.97 114.38 117.80 2ajc h ARG 669 Ca -0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2ajc h ARG 669 Cb 0.32 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2ajc h ARG 669 CO 0.02 0.59 -1.47 0.66 -1.51 0.00 0.00 179.97 178.26 2ajc n TYR 670 N -4.67 0.00 0.10 2.20 4.01 -0.89 -4.61 117.16 113.30 2ajc n TYR 670 Ca 0.20 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.95 2ajc n TYR 670 Cb 0.42 -0.27 -0.00 0.00 -0.31 0.00 0.00 39.34 39.18 2ajc n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2ajc n MET 671 N -1.88 3.76 0.00 -0.72 2.81 0.46 0.72 117.12 122.28 2ajc n MET 671 Ca -0.02 -0.24 0.00 0.00 -1.81 0.00 0.00 57.70 55.64 2ajc n MET 671 Cb 0.35 -0.76 0.00 0.00 -0.71 0.00 0.00 33.22 32.09 2ajc n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ajc n GLY 672 N 0.72 -0.03 3.89 3.03 0.00 -0.38 -4.65 105.19 107.78 2ajc n GLY 672 Ca 0.01 -0.97 -0.35 0.00 0.00 0.00 0.00 46.02 44.70 2ajc n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ajc s LEU 673 N 0.00 4.38 -0.61 0.99 1.02 -1.26 -4.29 118.68 118.91 2ajc s LEU 673 Ca 0.00 0.46 -0.07 0.00 0.02 0.00 0.00 54.13 54.54 2ajc s LEU 673 Cb 0.00 -2.41 -0.18 0.00 0.02 0.00 0.00 46.19 43.62 2ajc s LEU 673 CO 0.00 0.32 3.18 -0.81 0.02 0.00 0.00 176.35 179.06 2ajc n PRO 674 N 1.42 2.50 -4.38 1.29 -0.04 -1.26 -1.50 135.00 133.03 2ajc n PRO 674 Ca -0.15 -1.39 -0.23 0.00 -0.04 0.00 0.00 63.50 61.69 2ajc n PRO 674 Cb 0.54 -2.28 -0.11 0.00 -0.04 0.00 0.00 33.50 31.61 2ajc n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2ajc s THR 675 N 1.63 2.04 0.39 0.52 -4.23 -1.26 -4.63 115.64 110.11 2ajc s THR 675 Ca 0.63 -2.03 0.07 0.00 -1.18 0.00 0.00 61.69 59.19 2ajc s THR 675 Cb 0.25 -1.99 0.28 0.00 1.34 0.00 0.00 72.50 72.38 2ajc s THR 675 CO -0.02 -0.29 2.02 1.55 -0.54 0.00 0.00 174.62 177.35 2ajc h PRO 676 N 3.08 0.61 0.00 3.99 0.13 -1.96 -0.22 132.00 137.62 2ajc h PRO 676 Ca -0.43 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 2ajc h PRO 676 Cb 1.21 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 2ajc h PRO 676 CO 0.52 0.40 -0.05 0.93 -0.23 0.00 0.00 178.00 179.57 2ajc h GLU 677 N 0.63 0.00 0.00 0.86 3.07 -1.96 -3.43 114.58 113.75 2ajc h GLU 677 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 2ajc h GLU 677 Cb 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 2ajc h GLU 677 CO -0.05 0.05 0.00 -3.47 -1.40 0.00 0.00 179.01 174.13 2ajc n ASP 678 N -3.33 0.00 -0.12 1.42 -0.08 -0.19 -5.03 116.55 109.22 2ajc n ASP 678 Ca -0.02 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.36 2ajc n ASP 678 Cb 0.20 0.00 0.14 0.00 2.34 0.00 0.00 41.12 43.80 2ajc n ASP 678 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 2ajc n ASN 679 N 0.00 2.26 -0.34 1.67 4.05 -0.57 -4.82 115.26 117.52 2ajc n ASN 679 Ca 0.00 -3.13 0.17 0.00 0.45 0.00 0.00 54.58 52.07 2ajc n ASN 679 Cb 0.00 -0.43 0.40 0.00 1.23 0.00 0.00 39.78 40.97 2ajc n ASN 679 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 2ajc h LEU 680 N 0.08 0.66 -0.99 1.20 5.85 -1.38 -2.14 115.31 118.58 2ajc h LEU 680 Ca -0.00 0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.88 2ajc h LEU 680 Cb 1.01 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.98 2ajc h LEU 680 CO 0.00 0.15 0.64 0.44 -0.34 0.00 0.00 178.44 179.33 2ajc h ASP 681 N 0.59 1.05 1.95 1.25 3.32 -1.87 0.24 116.42 122.95 2ajc h ASP 681 Ca 0.61 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.66 2ajc h ASP 681 Cb 1.19 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.52 2ajc h ASP 681 CO -0.41 0.70 -0.05 1.88 -1.72 0.00 0.00 179.24 179.64 2ajc h TYR 682 N 1.21 0.00 -0.17 4.55 -1.99 -1.73 -2.59 116.97 116.25 2ajc h TYR 682 Ca 0.41 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 61.01 2ajc h TYR 682 Cb 0.08 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.81 2ajc h TYR 682 CO -0.00 0.04 -0.41 1.88 -0.00 0.00 0.00 178.16 179.66 2ajc h TYR 683 N 0.00 0.74 -0.60 4.88 0.05 -1.05 -3.17 116.97 117.81 2ajc h TYR 683 Ca -0.00 -0.28 -0.08 0.00 0.05 0.00 0.00 58.73 58.42 2ajc h TYR 683 Cb 1.03 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.62 2ajc h TYR 683 CO 0.00 1.04 0.06 0.00 -1.05 0.00 0.00 178.16 178.21 2ajc h ARG 684 N 0.23 1.01 -0.62 4.88 3.08 -0.81 -2.98 114.38 119.17 2ajc h ARG 684 Ca -0.00 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2ajc h ARG 684 Cb 1.03 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.96 2ajc h ARG 684 CO 0.09 0.96 0.00 0.27 -1.07 0.00 0.00 179.97 180.22 2ajc n ASN 685 N -4.21 5.32 -0.52 7.04 6.94 -0.99 -4.07 115.26 124.77 2ajc n ASN 685 Ca 0.04 -2.76 0.05 0.00 -0.02 0.00 0.00 54.58 51.89 2ajc n ASN 685 Cb 0.31 -0.65 0.14 0.00 -2.36 0.00 0.00 39.78 37.21 2ajc n ASN 685 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 2ajc n SER 686 N 0.76 2.86 -4.84 0.53 3.41 -1.12 -5.00 113.62 110.22 2ajc n SER 686 Ca 0.26 -2.21 -0.33 0.00 -0.26 0.00 0.00 58.87 56.34 2ajc n SER 686 Cb 1.08 -0.24 -0.06 0.00 -0.26 0.00 0.00 64.21 64.73 2ajc n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2ajc s THR 687 N -1.37 4.54 0.27 6.66 -4.23 -1.25 -4.81 115.64 115.44 2ajc s THR 687 Ca 0.22 1.21 0.06 0.00 -1.18 0.00 0.00 61.69 62.00 2ajc s THR 687 Cb 0.14 -3.62 -0.01 0.00 1.34 0.00 0.00 72.50 70.35 2ajc s THR 687 CO 0.11 -0.31 1.63 0.58 -0.54 0.00 0.00 174.62 176.09 2ajc h VAL 688 N 1.80 1.36 -0.49 2.29 2.07 -1.37 -2.99 116.25 118.92 2ajc h VAL 688 Ca -0.48 -1.79 0.05 0.00 0.82 0.00 0.00 66.70 65.30 2ajc h VAL 688 Cb 1.18 1.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.80 2ajc h VAL 688 CO 0.63 0.53 0.33 0.24 0.02 0.00 0.00 177.57 179.32 2ajc h MET 689 N 0.17 0.46 0.00 1.57 2.86 -1.93 -0.05 114.93 118.02 2ajc h MET 689 Ca 0.00 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2ajc h MET 689 Cb 0.98 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.53 2ajc h MET 689 CO 0.08 0.31 0.00 0.66 1.06 0.00 0.00 176.91 179.02 2ajc h SER 690 N 0.48 0.00 -0.35 1.22 4.64 -1.87 -1.61 113.55 116.05 2ajc h SER 690 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2ajc h SER 690 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2ajc h SER 690 CO -0.05 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.45 2ajc n ARG 691 N -2.47 2.99 -0.26 4.77 1.74 -0.03 -4.77 116.66 118.62 2ajc n ARG 691 Ca -0.01 -2.42 0.06 0.00 -0.77 0.00 0.00 57.85 54.70 2ajc n ARG 691 Cb 0.08 -1.54 0.17 0.00 -1.02 0.00 0.00 32.46 30.15 2ajc n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ajc h ALA 692 N 2.20 0.83 -1.01 7.54 0.00 -1.31 -2.07 119.26 125.45 2ajc h ALA 692 Ca 0.00 0.24 0.17 0.00 0.00 0.00 0.00 54.91 55.32 2ajc h ALA 692 Cb 1.06 0.41 -0.10 0.00 0.00 0.00 0.00 17.79 19.16 2ajc h ALA 692 CO 0.10 -0.43 0.62 1.49 0.00 0.00 0.00 179.25 181.04 2ajc h GLU 693 N 0.12 0.82 0.00 0.00 4.57 -1.86 -1.50 114.58 116.73 2ajc h GLU 693 Ca 0.43 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.56 2ajc h GLU 693 Cb 0.76 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2ajc h GLU 693 CO -0.66 0.54 0.00 0.09 -1.18 0.00 0.00 179.01 177.80 2ajc n ASN 694 N -4.71 0.54 0.01 1.04 5.03 -0.78 -2.56 115.26 113.83 2ajc n ASN 694 Ca 0.22 0.63 0.08 0.00 0.87 0.00 0.00 54.58 56.39 2ajc n ASN 694 Cb 0.50 -0.75 0.37 0.00 -1.02 0.00 0.00 39.78 38.88 2ajc n ASN 694 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 2ajc n PHE 695 N -2.10 0.07 0.30 3.10 3.01 -0.56 -2.59 117.46 118.68 2ajc n PHE 695 Ca 0.02 0.03 0.19 0.00 1.01 0.00 0.00 57.45 58.70 2ajc n PHE 695 Cb 0.22 -0.54 0.89 0.00 -0.01 0.00 0.00 39.48 40.04 2ajc n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 2ajc h LYS 696 N 0.00 0.00 -0.33 -1.08 1.57 -1.66 -2.34 116.57 112.73 2ajc h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2ajc h LYS 696 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2ajc h LYS 696 CO 0.00 0.01 0.00 1.04 -0.57 0.00 0.00 179.45 179.93 2ajc n GLN 697 N -3.14 2.14 -4.19 3.15 6.02 -1.07 -4.96 117.38 115.35 2ajc n GLN 697 Ca -0.01 -1.74 -0.11 0.00 -0.01 0.00 0.00 57.00 55.13 2ajc n GLN 697 Cb 0.21 -1.44 -0.10 0.00 1.02 0.00 0.00 30.24 29.93 2ajc n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 2ajc s VAL 698 N -1.58 0.56 -0.28 5.09 -7.23 -0.88 -4.96 120.40 111.13 2ajc s VAL 698 Ca 0.35 -1.94 -0.13 0.00 -1.81 0.00 0.00 61.98 58.45 2ajc s VAL 698 Cb 0.20 -1.89 -0.04 0.00 0.56 0.00 0.00 36.38 35.21 2ajc s VAL 698 CO 0.28 -0.67 0.29 -1.61 -0.31 0.00 0.00 175.10 173.08 2ajc s GLU 699 N -3.90 3.95 -0.00 4.82 2.02 -0.87 -4.98 118.70 119.74 2ajc s GLU 699 Ca 0.18 -0.15 0.07 0.00 0.02 0.00 0.00 54.97 55.09 2ajc s GLU 699 Cb 0.06 -3.67 -0.02 0.00 0.10 0.00 0.00 34.13 30.60 2ajc s GLU 699 CO -0.01 -0.26 -0.22 -0.47 0.02 0.00 0.00 175.26 174.33 2ajc s TYR 700 N 1.93 1.94 -0.17 1.61 5.04 -1.26 -1.61 117.35 124.83 2ajc s TYR 700 Ca 0.11 -0.37 0.01 0.00 -2.44 0.00 0.00 57.07 54.38 2ajc s TYR 700 Cb -0.16 -1.23 0.03 0.00 0.35 0.00 0.00 41.96 40.95 2ajc s TYR 700 CO 0.10 -0.01 -0.12 -1.17 -1.34 0.00 0.00 175.55 173.02 2ajc s LEU 701 N -0.65 1.98 -0.21 6.97 0.20 -0.68 -0.73 118.68 125.56 2ajc s LEU 701 Ca 0.08 -0.70 -0.05 0.00 0.69 0.00 0.00 54.13 54.15 2ajc s LEU 701 Cb -0.08 -1.19 -0.02 0.00 -0.43 0.00 0.00 46.19 44.46 2ajc s LEU 701 CO -0.00 -0.11 0.00 -0.22 -0.29 0.00 0.00 176.35 175.73 2ajc s LEU 702 N 1.45 3.20 -0.02 -0.68 0.20 -0.34 -1.28 118.68 121.21 2ajc s LEU 702 Ca 0.02 -0.25 0.06 0.00 0.69 0.00 0.00 54.13 54.65 2ajc s LEU 702 Cb -0.15 -1.82 -0.01 0.00 -0.43 0.00 0.00 46.19 43.78 2ajc s LEU 702 CO -0.09 0.03 -0.20 -0.63 -0.29 0.00 0.00 176.35 175.17 2ajc s ILE 703 N 1.23 1.55 -0.23 6.68 1.01 -0.43 -1.69 121.20 129.31 2ajc s ILE 703 Ca 0.03 -0.84 -0.24 0.00 0.00 0.00 0.00 60.65 59.61 2ajc s ILE 703 Cb -0.15 -1.29 0.07 0.00 0.01 0.00 0.00 42.46 41.10 2ajc s ILE 703 CO 0.01 0.44 0.67 -2.28 0.00 0.00 0.00 174.94 173.78 2ajc s HIS 704 N -0.44 -0.73 0.11 3.97 2.46 -0.95 0.26 115.29 119.96 2ajc s HIS 704 Ca 0.07 1.72 -0.27 0.00 0.47 0.00 0.00 55.06 57.05 2ajc s HIS 704 Cb -0.08 0.27 -0.06 0.00 -0.13 0.00 0.00 32.58 32.58 2ajc s HIS 704 CO -0.01 -0.38 0.84 0.20 -2.47 0.00 0.00 174.74 172.92 2ajc s GLY 705 N 0.17 2.91 0.53 1.59 0.00 -1.26 -1.42 107.32 109.83 2ajc s GLY 705 Ca -0.01 0.42 0.31 0.00 0.00 0.00 0.00 44.72 45.43 2ajc s GLY 705 CO 0.02 1.17 1.98 -0.91 0.00 0.00 0.00 173.10 175.36 2ajc h THR 706 N 3.85 0.22 -0.86 0.90 1.35 -1.06 -2.90 112.91 114.42 2ajc h THR 706 Ca -0.44 -0.65 -0.45 0.00 -0.55 0.00 0.00 66.41 64.32 2ajc h THR 706 Cb 1.21 1.53 -0.27 0.00 -1.73 0.00 0.00 68.15 68.89 2ajc h THR 706 CO 0.70 0.07 0.50 0.00 -0.25 0.00 0.00 175.52 176.54 2ajc n ALA 707 N -2.15 5.36 -2.32 6.62 0.00 -0.42 -4.71 120.51 122.88 2ajc n ALA 707 Ca -0.00 -2.98 -0.43 0.00 0.00 0.00 0.00 53.44 50.03 2ajc n ALA 707 Cb 0.32 -1.30 -0.02 0.00 0.00 0.00 0.00 19.45 18.44 2ajc n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2ajc s ASP 708 N -1.60 6.39 0.00 0.00 -1.08 -1.09 -4.28 116.67 115.01 2ajc s ASP 708 Ca 0.55 1.03 0.28 0.00 -0.52 0.00 0.00 52.55 53.88 2ajc s ASP 708 Cb 0.47 -2.54 1.02 0.00 -1.46 0.00 0.00 42.92 40.41 2ajc s ASP 708 CO 0.08 -1.35 1.74 -0.90 0.52 0.00 0.00 175.17 175.26 2ajc n ASP 709 N 8.59 0.47 0.00 -0.34 5.75 -1.26 -4.03 116.55 125.74 2ajc n ASP 709 Ca 0.17 -0.37 0.00 0.00 -0.01 0.00 0.00 54.79 54.58 2ajc n ASP 709 Cb 0.47 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 2ajc n ASP 709 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2ajc n ASN 710 N -1.12 0.00 -4.36 -1.12 2.85 -1.26 -4.79 115.26 105.47 2ajc n ASN 710 Ca 0.11 0.00 -0.44 0.00 -0.11 0.00 0.00 54.58 54.14 2ajc n ASN 710 Cb 0.31 -0.42 -0.07 0.00 1.24 0.00 0.00 39.78 40.84 2ajc n ASN 710 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2ajc s VAL 711 N -0.93 5.12 0.48 3.44 1.01 -1.26 -4.82 120.40 123.43 2ajc s VAL 711 Ca 0.00 -1.21 -0.24 0.00 0.00 0.00 0.00 61.98 60.53 2ajc s VAL 711 Cb 0.00 -4.12 -0.07 0.00 0.00 0.00 0.00 36.38 32.19 2ajc s VAL 711 CO 0.00 -0.64 1.36 -1.00 0.00 0.00 0.00 175.10 174.82 2ajc s HIS 712 N 1.61 2.47 0.52 5.22 3.76 -1.26 -4.71 115.29 122.90 2ajc s HIS 712 Ca 0.04 1.35 0.25 0.00 -0.15 0.00 0.00 55.06 56.54 2ajc s HIS 712 Cb -0.25 -3.80 1.36 0.00 1.11 0.00 0.00 32.58 30.99 2ajc s HIS 712 CO 0.05 -2.71 1.96 0.35 -0.85 0.00 0.00 174.74 173.55 2ajc h PHE 713 N 2.01 0.08 -0.98 1.40 3.57 -1.80 0.22 116.94 121.44 2ajc h PHE 713 Ca -0.51 0.00 0.31 0.00 3.53 0.00 0.00 57.97 61.30 2ajc h PHE 713 Cb 1.28 -0.03 -0.15 0.00 2.79 0.00 0.00 35.95 39.84 2ajc h PHE 713 CO 0.49 0.03 0.49 0.37 -2.23 0.00 0.00 178.31 177.46 2ajc h GLN 714 N 0.07 0.28 -0.29 1.11 4.15 -1.94 0.11 115.11 118.60 2ajc h GLN 714 Ca 0.31 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.73 2ajc h GLN 714 Cb 1.13 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.74 2ajc h GLN 714 CO -0.02 0.19 0.16 1.96 -1.93 0.00 0.00 178.83 179.18 2ajc h GLN 715 N 0.29 0.32 0.00 1.69 4.20 -0.88 0.27 115.11 121.00 2ajc h GLN 715 Ca 0.70 -0.02 -0.16 0.00 0.06 0.00 0.00 58.65 59.23 2ajc h GLN 715 Cb 1.57 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 29.26 2ajc h GLN 715 CO -0.63 0.21 -0.75 0.77 -0.67 0.00 0.00 178.83 177.77 2ajc h SER 716 N 0.33 0.00 -0.46 1.46 0.02 -1.29 -2.22 113.55 111.39 2ajc h SER 716 Ca 0.12 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.96 2ajc h SER 716 Cb 0.02 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 2ajc h SER 716 CO -0.07 0.75 -0.12 0.00 -1.14 0.00 0.00 176.83 176.25 2ajc h ALA 717 N 1.25 0.85 -0.17 3.77 0.00 -0.45 0.61 119.26 125.12 2ajc h ALA 717 Ca -0.01 -0.34 -0.19 0.00 0.00 0.00 0.00 54.91 54.37 2ajc h ALA 717 Cb 1.36 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2ajc h ALA 717 CO 0.10 0.65 -0.66 1.96 0.00 0.00 0.00 179.25 181.29 2ajc h GLN 718 N 0.83 0.64 0.11 0.00 1.08 -0.96 -2.32 115.11 114.49 2ajc h GLN 718 Ca 0.13 -0.47 -0.01 0.00 -1.45 0.00 0.00 58.65 56.86 2ajc h GLN 718 Cb 0.65 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.16 2ajc h GLN 718 CO 0.05 1.09 -0.05 1.25 -0.95 0.00 0.00 178.83 180.21 2ajc h LEU 719 N 0.47 -0.13 -1.01 1.46 5.85 -1.15 -1.89 115.31 118.90 2ajc h LEU 719 Ca -0.02 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.58 2ajc h LEU 719 Cb 1.25 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.25 2ajc h LEU 719 CO 0.13 0.08 0.66 0.77 -0.34 0.00 0.00 178.44 179.74 2ajc h SER 720 N -0.33 1.10 -0.76 1.25 4.64 -0.92 -1.28 113.55 117.24 2ajc h SER 720 Ca -0.02 -0.01 0.02 0.00 -0.47 0.00 0.00 61.79 61.32 2ajc h SER 720 Cb 0.27 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 62.06 2ajc h SER 720 CO 0.03 0.76 0.49 0.50 -0.87 0.00 0.00 176.83 177.74 2ajc h LYS 721 N 1.28 0.95 -0.46 4.77 3.64 -1.23 0.12 116.57 125.64 2ajc h LYS 721 Ca 0.40 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.64 2ajc h LYS 721 Cb -0.01 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.57 2ajc h LYS 721 CO -0.12 0.63 -0.03 0.00 -2.27 0.00 0.00 179.45 177.65 2ajc h ALA 722 N 1.31 1.08 -0.37 5.00 0.00 -0.59 -0.38 119.26 125.30 2ajc h ALA 722 Ca 0.30 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 2ajc h ALA 722 Cb -0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2ajc h ALA 722 CO -0.10 0.58 -0.15 -0.07 0.00 0.00 0.00 179.25 179.51 2ajc h LEU 723 N 0.72 0.78 -0.57 0.00 3.38 -0.63 -1.68 115.31 117.31 2ajc h LEU 723 Ca 0.14 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 2ajc h LEU 723 Cb 0.49 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 2ajc h LEU 723 CO 0.02 1.00 0.33 0.58 0.09 0.00 0.00 178.44 180.46 2ajc h VAL 724 N 0.55 1.18 -0.09 1.22 2.07 -0.47 -0.85 116.25 119.86 2ajc h VAL 724 Ca 0.09 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 2ajc h VAL 724 Cb 0.69 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2ajc h VAL 724 CO 0.05 0.19 -0.01 0.44 0.02 0.00 0.00 177.57 178.25 2ajc h ASP 725 N 0.76 0.11 0.17 0.57 3.32 -0.89 -0.54 116.42 119.92 2ajc h ASP 725 Ca 0.20 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.24 2ajc h ASP 725 Cb 0.01 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.54 2ajc h ASP 725 CO -0.04 0.15 -0.11 0.00 -1.72 0.00 0.00 179.24 177.53 2ajc n ALA 726 N -2.51 2.79 -1.58 3.45 0.00 -0.65 -4.93 120.51 117.07 2ajc n ALA 726 Ca -0.02 -0.36 -0.01 0.00 0.00 0.00 0.00 53.44 53.06 2ajc n ALA 726 Cb 0.14 -1.24 -0.00 0.00 0.00 0.00 0.00 19.45 18.35 2ajc n ALA 726 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ajc n GLY 727 N 1.24 0.39 3.68 0.00 0.00 -0.21 -4.94 105.19 105.35 2ajc n GLY 727 Ca 0.16 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.87 2ajc n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ajc s VAL 728 N -2.06 5.10 0.22 1.61 1.01 -0.39 -5.03 120.40 120.86 2ajc s VAL 728 Ca 0.00 1.06 -0.16 0.00 0.00 0.00 0.00 61.98 62.89 2ajc s VAL 728 Cb 0.00 -3.88 -0.08 0.00 0.00 0.00 0.00 36.38 32.42 2ajc s VAL 728 CO 0.00 0.20 0.65 -0.62 0.00 0.00 0.00 175.10 175.33 2ajc s ASP 729 N 1.01 6.87 0.21 3.32 2.15 -1.26 -4.50 116.67 124.47 2ajc s ASP 729 Ca 0.27 1.22 -0.22 0.00 0.43 0.00 0.00 52.55 54.25 2ajc s ASP 729 Cb -0.16 -2.34 0.06 0.00 -0.30 0.00 0.00 42.92 40.18 2ajc s ASP 729 CO 0.11 -0.02 0.94 0.72 -0.17 0.00 0.00 175.17 176.75 2ajc s PHE 730 N -1.65 -0.04 0.21 -5.34 -0.71 -1.26 -4.75 117.98 104.44 2ajc s PHE 730 Ca 0.45 -0.37 0.09 0.00 -1.04 0.00 0.00 56.93 56.06 2ajc s PHE 730 Cb -0.14 0.69 -0.04 0.00 -1.21 0.00 0.00 43.02 42.32 2ajc s PHE 730 CO 0.20 -1.00 -0.03 -0.65 -1.34 0.00 0.00 175.22 172.39 2ajc s GLN 731 N -2.85 2.26 0.14 1.99 -0.21 0.09 -5.02 119.66 116.06 2ajc s GLN 731 Ca 0.16 -1.28 0.02 0.00 0.02 0.00 0.00 55.36 54.28 2ajc s GLN 731 Cb -0.03 -2.22 -0.04 0.00 1.00 0.00 0.00 33.01 31.72 2ajc s GLN 731 CO 0.05 0.41 -0.04 0.99 -2.12 0.00 0.00 175.29 174.58 2ajc s THR 732 N -1.96 0.75 -0.29 -0.19 2.01 -1.26 -1.19 115.64 113.51 2ajc s THR 732 Ca 0.28 -1.97 -0.01 0.00 0.31 0.00 0.00 61.69 60.30 2ajc s THR 732 Cb -0.08 -1.91 0.18 0.00 0.01 0.00 0.00 72.50 70.69 2ajc s THR 732 CO 0.18 -0.67 0.55 -0.32 -0.69 0.00 0.00 174.62 173.67 2ajc s MET 733 N -3.86 0.52 0.28 4.92 0.00 -0.68 -4.88 119.30 115.59 2ajc s MET 733 Ca 0.18 0.84 -0.03 0.00 0.00 0.00 0.00 55.69 56.69 2ajc s MET 733 Cb 0.05 0.28 -0.04 0.00 0.00 0.00 0.00 34.83 35.12 2ajc s MET 733 CO 0.00 -0.67 0.51 1.67 0.00 0.00 0.00 175.02 176.53 2ajc s TRP 734 N 2.78 3.48 -0.28 4.11 -2.14 -1.26 -2.25 118.94 123.38 2ajc s TRP 734 Ca 0.18 0.50 0.02 0.00 2.66 0.00 0.00 56.10 59.46 2ajc s TRP 734 Cb -0.15 -1.99 0.08 0.00 -3.10 0.00 0.00 33.47 28.31 2ajc s TRP 734 CO -0.21 0.21 -0.02 0.71 -2.66 0.00 0.00 176.95 174.99 2ajc s TYR 735 N -2.08 2.90 0.04 1.66 2.02 -0.51 -4.92 117.35 116.47 2ajc s TYR 735 Ca 0.42 -2.24 -0.33 0.00 -0.37 0.00 0.00 57.07 54.55 2ajc s TYR 735 Cb -0.11 -2.05 -0.12 0.00 -0.40 0.00 0.00 41.96 39.29 2ajc s TYR 735 CO 0.31 -0.86 1.81 2.41 -1.57 0.00 0.00 175.55 177.65 2ajc n THR 736 N 4.52 0.41 -1.09 -0.71 -1.04 -1.26 -0.96 114.28 114.14 2ajc n THR 736 Ca -0.07 -0.07 -0.03 0.00 -2.04 0.00 0.00 64.05 61.84 2ajc n THR 736 Cb 0.43 -1.92 -0.01 0.00 -1.82 0.00 0.00 70.33 67.01 2ajc n THR 736 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2ajc n ASP 737 N 5.72 -5.50 -4.86 8.00 8.00 -1.26 -4.87 116.55 121.78 2ajc n ASP 737 Ca 0.20 0.08 -0.32 0.00 0.71 0.00 0.00 54.79 55.45 2ajc n ASP 737 Cb 0.33 -3.29 -0.06 0.00 -0.02 0.00 0.00 41.12 38.08 2ajc n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2ajc s GLU 738 N -2.04 3.93 0.00 -1.24 0.41 -1.01 -4.62 118.70 114.13 2ajc s GLU 738 Ca 0.00 0.51 0.00 0.00 -0.41 0.00 0.00 54.97 55.07 2ajc s GLU 738 Cb 0.00 -2.55 0.00 0.00 -1.78 0.00 0.00 34.13 29.80 2ajc s GLU 738 CO 0.00 0.24 0.00 -0.40 -0.49 0.00 0.00 175.26 174.61 2ajc n ASP 739 N -0.20 0.00 0.27 -0.19 5.68 -1.26 -1.31 116.55 119.55 2ajc n ASP 739 Ca 0.02 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.40 2ajc n ASP 739 Cb 0.53 0.00 0.69 0.00 -1.14 0.00 0.00 41.12 41.20 2ajc n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 2ajc h HIS 740 N 0.00 0.00 -0.00 2.11 -0.00 -1.91 -1.82 115.15 113.53 2ajc h HIS 740 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 2ajc h HIS 740 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 2ajc h HIS 740 CO 0.00 0.01 -0.30 0.41 -0.00 0.00 0.00 177.93 178.05 2ajc n GLY 741 N -1.47 -1.23 3.96 5.26 0.00 -1.26 -4.91 105.19 105.54 2ajc n GLY 741 Ca -0.03 -0.28 -0.25 0.00 0.00 0.00 0.00 46.02 45.46 2ajc n GLY 741 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2ajc n ILE 742 N -1.36 -0.84 0.94 -0.61 5.41 -0.68 -4.82 119.36 117.40 2ajc n ILE 742 Ca 0.08 -0.40 0.11 0.00 1.00 0.00 0.00 62.75 63.54 2ajc n ILE 742 Cb 0.33 -0.83 0.09 0.00 -0.71 0.00 0.00 39.64 38.52 2ajc n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ajc n ALA 743 N -3.88 2.49 -1.38 -1.39 0.00 -1.26 -3.61 120.51 111.48 2ajc n ALA 743 Ca -0.26 -0.68 -0.35 0.00 0.00 0.00 0.00 53.44 52.16 2ajc n ALA 743 Cb 0.56 -0.76 0.10 0.00 0.00 0.00 0.00 19.45 19.34 2ajc n ALA 743 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2ajc s SER 744 N -1.90 4.02 0.17 0.00 1.04 -1.26 -4.69 113.70 111.09 2ajc s SER 744 Ca 0.26 2.48 -0.15 0.00 0.48 0.00 0.00 55.95 59.02 2ajc s SER 744 Cb 0.19 -2.60 0.14 0.00 0.10 0.00 0.00 66.02 63.84 2ajc s SER 744 CO 0.29 -2.39 1.70 -1.13 0.98 0.00 0.00 173.24 172.69 2ajc h ASN 745 N -0.28 -0.14 -0.07 7.02 -1.24 -2.00 0.56 115.58 119.44 2ajc h ASN 745 Ca -0.48 0.10 -0.19 0.00 0.71 0.00 0.00 56.30 56.44 2ajc h ASN 745 Cb 1.31 0.16 -0.00 0.00 0.73 0.00 0.00 38.32 40.53 2ajc h ASN 745 CO 0.49 -0.04 -0.63 0.24 -1.29 0.00 0.00 177.43 176.21 2ajc h MET 746 N 0.13 0.68 -0.51 6.67 2.86 -1.98 -2.80 114.93 119.99 2ajc h MET 746 Ca 0.21 -0.47 -0.09 0.00 -2.06 0.00 0.00 59.70 57.29 2ajc h MET 746 Cb 0.30 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 2ajc h MET 746 CO -0.34 1.09 -0.04 0.00 1.06 0.00 0.00 176.91 178.68 2ajc h ALA 747 N 0.79 0.98 -0.21 6.32 0.00 -1.79 0.17 119.26 125.52 2ajc h ALA 747 Ca -0.01 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.62 2ajc h ALA 747 Cb 1.21 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2ajc h ALA 747 CO 0.12 0.62 0.09 1.25 0.00 0.00 0.00 179.25 181.33 2ajc h HIS 748 N 0.81 0.17 -0.70 0.00 6.17 -0.86 0.76 115.15 121.48 2ajc h HIS 748 Ca 0.14 0.01 -0.06 0.00 0.71 0.00 0.00 60.37 61.17 2ajc h HIS 748 Cb 0.54 -0.04 -0.03 0.00 2.52 0.00 0.00 27.41 30.40 2ajc h HIS 748 CO 0.03 0.09 0.19 1.96 0.71 0.00 0.00 177.93 180.91 2ajc h GLN 749 N 0.20 1.11 -0.06 5.26 4.20 -1.27 -2.93 115.11 121.63 2ajc h GLN 749 Ca 0.09 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 2ajc h GLN 749 Cb 0.03 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 2ajc h GLN 749 CO -0.07 0.97 0.01 1.25 -0.67 0.00 0.00 178.83 180.32 2ajc h HIS 750 N 1.06 0.11 -0.58 2.96 2.76 -0.39 -1.83 115.15 119.24 2ajc h HIS 750 Ca 0.22 -0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.34 2ajc h HIS 750 Cb 0.35 -0.03 -0.03 0.00 1.55 0.00 0.00 27.41 29.25 2ajc h HIS 750 CO 0.03 0.35 0.21 0.97 -1.30 0.00 0.00 177.93 178.19 2ajc h ILE 751 N -0.16 1.23 -0.35 6.26 2.10 -0.85 0.13 117.51 125.89 2ajc h ILE 751 Ca 0.02 -0.75 -0.11 0.00 1.08 0.00 0.00 64.86 65.10 2ajc h ILE 751 Cb 0.30 0.63 -0.01 0.00 -1.09 0.00 0.00 36.82 36.65 2ajc h ILE 751 CO 0.00 0.29 -0.25 1.88 -1.08 0.00 0.00 178.15 178.99 2ajc h TYR 752 N 0.81 0.80 -0.40 2.19 0.05 -1.56 -0.07 116.97 118.78 2ajc h TYR 752 Ca 0.19 -0.18 -0.03 0.00 0.05 0.00 0.00 58.73 58.76 2ajc h TYR 752 Cb 0.24 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.77 2ajc h TYR 752 CO 0.01 0.88 0.13 1.15 -1.05 0.00 0.00 178.16 179.28 2ajc h THR 753 N 0.61 1.21 -0.50 -2.88 2.02 -1.01 -0.74 112.91 111.62 2ajc h THR 753 Ca 0.08 -0.70 -0.03 0.00 0.77 0.00 0.00 66.41 66.54 2ajc h THR 753 Cb 0.74 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 2ajc h THR 753 CO 0.06 0.25 0.20 -0.74 0.37 0.00 0.00 175.52 175.65 2ajc h HIS 754 N 0.50 0.77 -0.12 3.16 -0.00 -0.55 -2.33 115.15 116.59 2ajc h HIS 754 Ca 0.13 -0.06 -0.08 0.00 -0.00 0.00 0.00 60.37 60.36 2ajc h HIS 754 Cb 0.25 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.42 2ajc h HIS 754 CO 0.01 0.64 -0.31 0.52 -0.00 0.00 0.00 177.93 178.79 2ajc h MET 755 N 0.67 0.23 -0.33 5.26 2.07 -0.86 -1.96 114.93 120.00 2ajc h MET 755 Ca 0.17 -0.09 -0.04 0.00 -2.07 0.00 0.00 59.70 57.68 2ajc h MET 755 Cb 0.20 -0.01 -0.01 0.00 -1.87 0.00 0.00 31.60 29.91 2ajc h MET 755 CO -0.01 0.52 0.07 0.77 1.07 0.00 0.00 176.91 179.32 2ajc h SER 756 N 0.20 0.52 -0.42 1.22 0.02 -0.85 -0.80 113.55 113.44 2ajc h SER 756 Ca 0.03 -0.25 0.01 0.00 -0.84 0.00 0.00 61.79 60.74 2ajc h SER 756 Cb 0.65 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.03 2ajc h SER 756 CO 0.05 0.63 0.27 0.45 -1.14 0.00 0.00 176.83 177.08 2ajc h HIS 757 N 0.38 0.50 -0.18 3.45 3.86 -1.27 -0.22 115.15 121.68 2ajc h HIS 757 Ca 0.10 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.33 2ajc h HIS 757 Cb 0.32 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 2ajc h HIS 757 CO 0.02 0.31 0.11 0.35 0.86 0.00 0.00 177.93 179.57 2ajc h PHE 758 N 0.54 0.23 -0.23 2.45 3.57 -1.11 -1.16 116.94 121.24 2ajc h PHE 758 Ca 0.16 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 2ajc h PHE 758 Cb -0.04 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 2ajc h PHE 758 CO -0.06 0.19 0.13 -0.07 -2.23 0.00 0.00 178.31 176.27 2ajc h LEU 759 N 0.21 0.28 -1.58 0.59 3.38 -0.93 -0.19 115.31 117.07 2ajc h LEU 759 Ca 0.06 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2ajc h LEU 759 Cb 0.02 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2ajc h LEU 759 CO -0.01 0.27 0.17 0.11 0.09 0.00 0.00 178.44 179.08 2ajc h LYS 760 N 0.27 0.45 -0.10 1.13 1.57 -0.94 0.29 116.57 119.24 2ajc h LYS 760 Ca 0.08 -0.04 -0.23 0.00 -1.87 0.00 0.00 60.65 58.59 2ajc h LYS 760 Cb 0.05 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 32.28 2ajc h LYS 760 CO -0.01 0.34 -0.83 -0.56 -0.57 0.00 0.00 179.45 177.81 2ajc h GLN 761 N 0.46 0.68 -0.68 3.15 3.07 -0.91 0.62 115.11 121.51 2ajc h GLN 761 Ca 0.12 -0.60 -0.04 0.00 0.09 0.00 0.00 58.65 58.22 2ajc h GLN 761 Cb 0.03 0.14 -0.03 0.00 0.08 0.00 0.00 27.48 27.69 2ajc h GLN 761 CO -0.02 1.21 0.28 0.00 0.09 0.00 0.00 178.83 180.39 2ajc n PHE 763 N -4.31 0.81 -3.96 0.00 3.72 0.91 -4.92 117.46 109.71 2ajc n PHE 763 Ca 0.06 -0.36 -0.30 0.00 -0.05 0.00 0.00 57.45 56.80 2ajc n PHE 763 Cb 0.17 -0.07 0.01 0.00 -0.94 0.00 0.00 39.48 38.65 2ajc n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2ajc n SER 764 N 0.87 -3.75 -4.62 4.37 7.64 -0.42 -4.96 113.62 112.75 2ajc n SER 764 Ca 0.17 -0.85 -0.35 0.00 1.01 0.00 0.00 58.87 58.85 2ajc n SER 764 Cb 0.51 -3.62 -0.10 0.00 -1.01 0.00 0.00 64.21 59.99 2ajc n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2ajc s LEU 765 N -7.19 3.87 0.00 -3.43 1.43 0.20 -5.02 118.68 108.55 2ajc s LEU 765 Ca 0.55 0.06 0.31 0.00 -1.03 0.00 0.00 54.13 54.03 2ajc s LEU 765 Cb -0.28 -2.00 1.87 0.00 0.03 0.00 0.00 46.19 45.80 2ajc s LEU 765 CO 0.85 0.12 2.19 -0.81 0.23 0.00 0.00 176.35 178.93