#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 0.00 -4.06 -1.46 3.00 -1.25 -5.00 116.66 107.89 2ajc n ARG 40 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 57.85 57.63 2ajc n ARG 40 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 32.46 32.42 2ajc n ARG 40 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 2ajc s ARG 41 N 0.00 2.98 0.44 -0.14 1.70 -1.26 -4.96 118.95 117.71 2ajc s ARG 41 Ca 0.00 -1.04 0.06 0.00 -0.47 0.00 0.00 55.73 54.29 2ajc s ARG 41 Cb 0.00 -2.60 -0.04 0.00 -0.57 0.00 0.00 34.95 31.74 2ajc s ARG 41 CO 0.00 0.37 0.17 0.95 -1.08 0.00 0.00 175.30 175.71 2ajc s THR 42 N -2.13 2.03 -0.44 4.99 -4.23 -1.26 -0.00 115.64 114.60 2ajc s THR 42 Ca 0.34 -1.74 -0.27 0.00 -1.18 0.00 0.00 61.69 58.83 2ajc s THR 42 Cb -0.08 -2.77 0.02 0.00 1.34 0.00 0.00 72.50 71.02 2ajc s THR 42 CO 0.26 0.00 1.02 -0.47 -0.54 0.00 0.00 174.62 174.89 2ajc s TYR 43 N -2.67 2.93 0.51 3.99 5.04 -1.26 -4.82 117.35 121.06 2ajc s TYR 43 Ca 0.35 0.67 0.02 0.00 -2.44 0.00 0.00 57.07 55.66 2ajc s TYR 43 Cb 0.03 -4.07 0.02 0.00 0.35 0.00 0.00 41.96 38.30 2ajc s TYR 43 CO 0.19 -1.08 0.73 0.95 -1.34 0.00 0.00 175.55 175.00 2ajc s THR 44 N 3.97 3.09 0.28 4.34 -4.23 -1.26 -3.93 115.64 117.89 2ajc s THR 44 Ca 0.42 -0.65 -0.03 0.00 -1.18 0.00 0.00 61.69 60.26 2ajc s THR 44 Cb -0.09 -3.14 0.23 0.00 1.34 0.00 0.00 72.50 70.84 2ajc s THR 44 CO 0.26 -0.10 1.92 0.25 -0.54 0.00 0.00 174.62 176.41 2ajc h LEU 45 N 0.21 0.98 -0.87 4.79 5.85 -1.95 -1.74 115.31 122.59 2ajc h LEU 45 Ca -0.43 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.16 2ajc h LEU 45 Cb 1.28 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 2ajc h LEU 45 CO 0.53 0.76 0.09 0.74 -0.34 0.00 0.00 178.44 180.23 2ajc h THR 46 N 1.13 1.25 -0.44 1.05 2.02 -1.98 0.94 112.91 116.88 2ajc h THR 46 Ca 0.29 -0.95 0.02 0.00 0.77 0.00 0.00 66.41 66.54 2ajc h THR 46 Cb -0.03 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 2ajc h THR 46 CO -0.05 0.35 0.26 0.44 0.37 0.00 0.00 175.52 176.89 2ajc h ASP 47 N 0.88 0.42 0.12 4.18 3.32 -1.73 0.17 116.42 123.79 2ajc h ASP 47 Ca 0.18 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 2ajc h ASP 47 Cb 0.39 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2ajc h ASP 47 CO 0.01 0.30 -0.06 0.22 -1.72 0.00 0.00 179.24 177.99 2ajc h TYR 48 N 0.52 -0.15 -0.59 4.55 3.20 -0.98 -0.44 116.97 123.08 2ajc h TYR 48 Ca 0.17 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.00 2ajc h TYR 48 Cb 0.01 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.30 2ajc h TYR 48 CO -0.07 0.17 0.22 -0.07 -1.64 0.00 0.00 178.16 176.77 2ajc h LEU 49 N -0.47 0.80 -2.19 2.82 3.38 -0.70 -2.88 115.31 116.07 2ajc h LEU 49 Ca -0.02 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2ajc h LEU 49 Cb 0.38 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2ajc h LEU 49 CO 0.03 0.73 0.00 0.29 0.09 0.00 0.00 178.44 179.58 2ajc n LYS 50 N -4.31 2.44 -3.74 1.13 4.76 0.60 -4.97 118.16 114.07 2ajc n LYS 50 Ca 0.05 -2.17 -0.23 0.00 -2.87 0.00 0.00 58.31 53.09 2ajc n LYS 50 Cb 0.18 -1.50 0.03 0.00 -1.84 0.00 0.00 35.03 31.90 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 1.40 -1.76 -0.14 4.39 7.64 -0.32 -4.87 113.62 119.96 2ajc n SER 51 Ca 0.19 -0.82 0.05 0.00 1.01 0.00 0.00 58.87 59.30 2ajc n SER 51 Cb 0.59 -4.00 0.36 0.00 -1.01 0.00 0.00 64.21 60.15 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 -1.91 1.07 -3.50 0.44 1.35 -1.41 -3.35 112.91 105.59 2ajc h THR 52 Ca -0.61 -0.26 -0.72 0.00 -0.55 0.00 0.00 66.41 64.28 2ajc h THR 52 Cb 1.36 0.26 -0.23 0.00 -1.73 0.00 0.00 68.15 67.81 2ajc h THR 52 CO 0.58 0.14 -0.45 -0.36 -0.25 0.00 0.00 175.52 175.18 2ajc s PHE 53 N -5.65 3.25 -0.05 4.73 0.08 -1.26 -5.06 117.98 114.02 2ajc s PHE 53 Ca -0.10 -0.85 -0.26 0.00 0.12 0.00 0.00 56.93 55.84 2ajc s PHE 53 Cb 0.19 -2.64 -0.03 0.00 -0.57 0.00 0.00 43.02 39.96 2ajc s PHE 53 CO 0.76 -0.66 0.83 0.50 -0.10 0.00 0.00 175.22 176.55 2ajc s ARG 54 N 1.61 4.47 -0.31 0.44 6.06 -1.26 -5.04 118.95 124.93 2ajc s ARG 54 Ca 0.04 1.12 -0.12 0.00 -2.50 0.00 0.00 55.73 54.26 2ajc s ARG 54 Cb -0.20 -3.47 -0.03 0.00 0.06 0.00 0.00 34.95 31.31 2ajc s ARG 54 CO 0.08 -0.02 0.24 0.08 -2.50 0.00 0.00 175.30 173.17 2ajc s VAL 55 N 1.03 5.28 0.31 7.11 1.01 -1.26 -4.62 120.40 129.25 2ajc s VAL 55 Ca 0.44 0.05 -0.11 0.00 0.00 0.00 0.00 61.98 62.35 2ajc s VAL 55 Cb -0.19 -3.63 -0.07 0.00 0.00 0.00 0.00 36.38 32.48 2ajc s VAL 55 CO 0.22 0.12 0.67 -0.54 0.00 0.00 0.00 175.10 175.56 2ajc s LYS 56 N 1.79 3.85 0.36 2.72 1.02 -1.26 -5.09 119.74 123.12 2ajc s LYS 56 Ca 0.08 0.43 0.06 0.00 0.02 0.00 0.00 55.97 56.55 2ajc s LYS 56 Cb -0.17 -2.51 -0.03 0.00 -0.52 0.00 0.00 37.83 34.61 2ajc s LYS 56 CO 0.11 0.16 0.22 -0.59 -0.92 0.00 0.00 175.35 174.33 2ajc s PHE 57 N -2.05 1.76 -0.27 3.18 -0.12 -1.26 -4.86 117.98 114.36 2ajc s PHE 57 Ca 0.50 -1.53 -0.04 0.00 -0.05 0.00 0.00 56.93 55.81 2ajc s PHE 57 Cb -0.11 -0.88 0.09 0.00 -0.63 0.00 0.00 43.02 41.50 2ajc s PHE 57 CO 0.23 -0.67 0.12 -0.47 -0.05 0.00 0.00 175.22 174.39 2ajc s TYR 58 N -3.36 0.35 -0.24 3.49 6.14 -1.26 -4.96 117.35 117.51 2ajc s TYR 58 Ca 0.34 -0.83 -0.11 0.00 0.64 0.00 0.00 57.07 57.11 2ajc s TYR 58 Cb 0.02 -0.90 -0.05 0.00 0.42 0.00 0.00 41.96 41.45 2ajc s TYR 58 CO 0.23 -0.79 0.18 0.99 0.64 0.00 0.00 175.55 176.80 2ajc s THR 59 N 2.09 5.35 0.18 4.34 2.01 -1.26 -5.07 115.64 123.27 2ajc s THR 59 Ca 0.08 0.22 0.04 0.00 0.31 0.00 0.00 61.69 62.35 2ajc s THR 59 Cb -0.16 -3.52 -0.05 0.00 0.01 0.00 0.00 72.50 68.78 2ajc s THR 59 CO -0.33 0.34 -0.07 -1.48 -0.69 0.00 0.00 174.62 172.39 2ajc s LEU 60 N 1.08 2.40 -0.19 4.42 0.05 -1.26 -4.55 118.68 120.63 2ajc s LEU 60 Ca 0.08 -1.09 0.00 0.00 0.05 0.00 0.00 54.13 53.18 2ajc s LEU 60 Cb -0.14 -0.33 0.04 0.00 -2.05 0.00 0.00 46.19 43.71 2ajc s LEU 60 CO 0.05 -0.39 -0.09 -1.10 -0.55 0.00 0.00 176.35 174.27 2ajc s GLN 61 N -3.79 1.85 0.33 1.48 -0.21 -0.46 -4.95 119.66 113.90 2ajc s GLN 61 Ca 0.22 -0.73 -0.28 0.00 0.02 0.00 0.00 55.36 54.58 2ajc s GLN 61 Cb 0.04 -2.28 -0.10 0.00 1.00 0.00 0.00 33.01 31.67 2ajc s GLN 61 CO 0.04 -0.43 1.23 -1.58 -2.12 0.00 0.00 175.29 172.44 2ajc s TRP 62 N 1.47 3.19 0.00 0.91 0.52 -1.26 -0.36 118.94 123.41 2ajc s TRP 62 Ca -0.00 1.51 0.00 0.00 0.02 0.00 0.00 56.10 57.63 2ajc s TRP 62 Cb -0.16 -3.53 0.00 0.00 -1.15 0.00 0.00 33.47 28.63 2ajc s TRP 62 CO -0.08 -1.43 0.06 0.44 0.02 0.00 0.00 176.95 175.96 2ajc n ILE 63 N 0.79 0.00 -3.86 2.03 -5.35 -0.34 -4.91 119.36 107.73 2ajc n ILE 63 Ca 0.00 -0.23 -0.10 0.00 -0.27 0.00 0.00 62.75 62.15 2ajc n ILE 63 Cb 0.43 1.15 -0.01 0.00 -1.74 0.00 0.00 39.64 39.48 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 -0.33 -1.32 0.00 7.28 3.41 -1.16 -4.97 113.62 116.53 2ajc n SER 64 Ca 0.00 -2.44 0.10 0.00 -0.26 0.00 0.00 58.87 56.27 2ajc n SER 64 Cb 0.04 2.35 0.48 0.00 -0.26 0.00 0.00 64.21 66.82 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 -1.63 0.00 0.00 4.04 5.68 -1.26 -2.64 116.55 120.74 2ajc n ASP 65 Ca -0.02 0.31 0.00 0.00 -0.50 0.00 0.00 54.79 54.59 2ajc n ASP 65 Cb 0.47 -0.42 0.00 0.00 -1.14 0.00 0.00 41.12 40.03 2ajc n ASP 65 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ajc n HIS 66 N -1.42 0.00 -4.21 2.11 1.44 -1.26 -4.33 115.22 107.54 2ajc n HIS 66 Ca 0.07 0.00 -0.18 0.00 -2.01 0.00 0.00 57.72 55.60 2ajc n HIS 66 Cb 0.22 0.01 -0.12 0.00 0.12 0.00 0.00 29.99 30.21 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 0.76 0.02 -1.40 2.02 -1.25 -1.73 118.70 117.13 2ajc s GLU 67 Ca 0.00 -0.78 -0.03 0.00 0.02 0.00 0.00 54.97 54.18 2ajc s GLU 67 Cb 0.00 -0.71 -0.02 0.00 0.10 0.00 0.00 34.13 33.50 2ajc s GLU 67 CO 0.00 0.17 0.04 1.52 0.02 0.00 0.00 175.26 177.01 2ajc s TYR 68 N -1.06 0.23 -0.06 1.61 -0.85 -0.82 -1.19 117.35 115.20 2ajc s TYR 68 Ca -0.02 -0.50 -0.04 0.00 -0.52 0.00 0.00 57.07 55.99 2ajc s TYR 68 Cb -0.09 -0.17 -0.04 0.00 0.38 0.00 0.00 41.96 42.05 2ajc s TYR 68 CO 0.01 -0.28 0.14 -0.51 -1.52 0.00 0.00 175.55 173.39 2ajc s LEU 69 N -1.79 4.26 -0.11 -3.49 1.43 0.51 -0.36 118.68 119.13 2ajc s LEU 69 Ca -0.10 0.36 -0.09 0.00 -1.03 0.00 0.00 54.13 53.26 2ajc s LEU 69 Cb -0.05 -2.28 0.03 0.00 0.03 0.00 0.00 46.19 43.92 2ajc s LEU 69 CO -0.02 0.33 0.29 -0.47 0.23 0.00 0.00 176.35 176.71 2ajc s TYR 70 N -1.15 -0.34 -0.22 0.29 5.04 -0.43 -1.36 117.35 119.18 2ajc s TYR 70 Ca 0.21 0.81 -0.21 0.00 -2.44 0.00 0.00 57.07 55.44 2ajc s TYR 70 Cb -0.12 0.11 -0.02 0.00 0.35 0.00 0.00 41.96 42.27 2ajc s TYR 70 CO 0.11 -0.18 0.63 0.15 -1.34 0.00 0.00 175.55 174.92 2ajc s LYS 71 N 0.47 4.18 -0.14 4.97 1.02 -1.26 -0.06 119.74 128.92 2ajc s LYS 71 Ca -0.03 0.60 -0.01 0.00 0.02 0.00 0.00 55.97 56.55 2ajc s LYS 71 Cb -0.04 -3.60 0.04 0.00 -0.52 0.00 0.00 37.83 33.70 2ajc s LYS 71 CO -0.02 -0.30 -0.04 -1.14 -0.92 0.00 0.00 175.35 172.93 2ajc s GLN 72 N 2.12 1.21 -1.20 1.68 0.74 0.15 -4.80 119.66 119.57 2ajc s GLN 72 Ca 0.28 -0.36 -0.01 0.00 0.05 0.00 0.00 55.36 55.32 2ajc s GLN 72 Cb -0.16 -1.78 -0.01 0.00 1.10 0.00 0.00 33.01 32.17 2ajc s GLN 72 CO 0.10 -0.41 0.93 0.39 -0.55 0.00 0.00 175.29 175.75 2ajc n GLU 73 N 4.95 -5.66 0.00 1.67 1.02 -1.26 -2.57 120.64 118.79 2ajc n GLU 73 Ca -0.11 0.81 0.00 0.00 -0.02 0.00 0.00 57.16 57.84 2ajc n GLU 73 Cb 0.48 -5.72 0.00 0.00 -0.02 0.00 0.00 31.44 26.19 2ajc n GLU 73 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2ajc n ASN 74 N -3.12 0.00 -4.72 1.62 4.05 -1.26 -4.78 115.26 107.05 2ajc n ASN 74 Ca -0.26 0.00 -0.24 0.00 0.45 0.00 0.00 54.58 54.53 2ajc n ASN 74 Cb 0.66 -0.17 -0.06 0.00 1.23 0.00 0.00 39.78 41.44 2ajc n ASN 74 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2ajc s ASN 75 N -1.90 5.01 -0.21 1.20 2.20 -1.06 -4.46 114.94 115.71 2ajc s ASN 75 Ca 0.00 -0.41 -0.17 0.00 -0.94 0.00 0.00 52.86 51.34 2ajc s ASN 75 Cb 0.00 -1.12 -0.03 0.00 -2.00 0.00 0.00 41.25 38.09 2ajc s ASN 75 CO 0.00 0.01 0.46 -0.63 -2.94 0.00 0.00 177.10 174.00 2ajc s ILE 76 N -2.08 5.14 0.05 0.54 1.01 -0.60 0.35 121.20 125.61 2ajc s ILE 76 Ca 0.31 0.82 0.04 0.00 0.00 0.00 0.00 60.65 61.82 2ajc s ILE 76 Cb -0.08 -3.78 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 2ajc s ILE 76 CO 0.22 0.19 -0.04 -0.76 0.00 0.00 0.00 174.94 174.55 2ajc s LEU 77 N 1.62 3.29 -0.41 2.97 1.43 0.92 -0.31 118.68 128.19 2ajc s LEU 77 Ca 0.21 -0.18 -0.12 0.00 -1.03 0.00 0.00 54.13 53.01 2ajc s LEU 77 Cb -0.15 -1.97 0.06 0.00 0.03 0.00 0.00 46.19 44.15 2ajc s LEU 77 CO 0.09 0.23 0.27 -0.22 0.23 0.00 0.00 176.35 176.95 2ajc s LEU 78 N -1.89 5.10 0.08 1.79 2.96 0.97 -1.31 118.68 126.38 2ajc s LEU 78 Ca 0.21 -1.25 -0.10 0.00 -0.22 0.00 0.00 54.13 52.78 2ajc s LEU 78 Cb -0.11 -2.05 -0.06 0.00 0.50 0.00 0.00 46.19 44.47 2ajc s LEU 78 CO 0.13 -0.50 0.40 -0.36 -1.32 0.00 0.00 176.35 174.69 2ajc s PHE 79 N 1.53 3.58 -0.38 5.38 0.08 0.51 -1.89 117.98 126.80 2ajc s PHE 79 Ca 0.03 0.78 -0.09 0.00 0.12 0.00 0.00 56.93 57.76 2ajc s PHE 79 Cb -0.22 -2.15 0.04 0.00 -0.57 0.00 0.00 43.02 40.12 2ajc s PHE 79 CO 0.05 0.52 0.19 1.21 -0.10 0.00 0.00 175.22 177.09 2ajc s ASN 80 N -1.79 5.60 0.18 1.36 3.84 -0.68 -1.95 114.94 121.51 2ajc s ASN 80 Ca 0.33 -1.16 -0.17 0.00 0.21 0.00 0.00 52.86 52.07 2ajc s ASN 80 Cb -0.14 -1.97 0.13 0.00 -0.55 0.00 0.00 41.25 38.72 2ajc s ASN 80 CO 0.18 -0.41 1.64 0.00 -2.79 0.00 0.00 177.10 175.73 2ajc h ALA 81 N 8.37 0.20 -1.01 1.71 0.00 -1.66 0.56 119.26 127.43 2ajc h ALA 81 Ca -0.24 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2ajc h ALA 81 Cb 1.09 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2ajc h ALA 81 CO 0.67 -0.51 0.00 0.39 0.00 0.00 0.00 179.25 179.80 2ajc n GLU 82 N -5.37 0.00 0.18 0.00 1.02 -1.26 -3.39 120.64 111.82 2ajc n GLU 82 Ca 0.03 0.68 0.07 0.00 -0.02 0.00 0.00 57.16 57.93 2ajc n GLU 82 Cb 0.28 -1.33 0.12 0.00 -0.02 0.00 0.00 31.44 30.48 2ajc n GLU 82 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 2ajc h TYR 83 N 0.00 0.00 0.00 -0.32 0.05 -1.94 -3.48 116.97 111.28 2ajc h TYR 83 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2ajc h TYR 83 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 2ajc h TYR 83 CO -0.39 0.28 0.00 0.41 -1.05 0.00 0.00 178.16 177.41 2ajc n GLY 84 N 1.10 0.62 3.81 3.88 0.00 0.19 -5.02 105.19 109.76 2ajc n GLY 84 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.16 6.96 0.33 1.61 4.22 -1.24 -4.82 114.94 119.84 2ajc s ASN 85 Ca 0.00 1.14 0.09 0.00 -2.14 0.00 0.00 52.86 51.96 2ajc s ASN 85 Cb 0.00 -2.33 -0.05 0.00 1.28 0.00 0.00 41.25 40.15 2ajc s ASN 85 CO 0.00 0.25 -0.02 -0.94 -2.04 0.00 0.00 177.10 174.35 2ajc s SER 86 N -0.88 4.12 -0.01 3.54 1.04 -1.26 -1.68 113.70 118.57 2ajc s SER 86 Ca 0.28 -0.98 -0.09 0.00 0.48 0.00 0.00 55.95 55.64 2ajc s SER 86 Cb -0.18 -0.53 0.01 0.00 0.10 0.00 0.00 66.02 65.42 2ajc s SER 86 CO 0.17 -0.19 0.18 -0.94 0.98 0.00 0.00 173.24 173.44 2ajc s SER 87 N -3.68 -0.04 0.13 7.02 1.04 -0.79 -4.96 113.70 112.41 2ajc s SER 87 Ca 0.34 -0.09 -0.31 0.00 0.48 0.00 0.00 55.95 56.37 2ajc s SER 87 Cb -0.01 0.25 -0.09 0.00 0.10 0.00 0.00 66.02 66.27 2ajc s SER 87 CO 0.19 -0.36 1.47 -0.63 0.98 0.00 0.00 173.24 174.89 2ajc s ILE 88 N -1.23 3.04 -0.16 -1.02 1.01 -1.26 -0.02 121.20 121.56 2ajc s ILE 88 Ca -0.13 0.72 0.12 0.00 0.00 0.00 0.00 60.65 61.36 2ajc s ILE 88 Cb -0.07 -3.46 -0.18 0.00 0.01 0.00 0.00 42.46 38.76 2ajc s ILE 88 CO 0.02 0.05 0.02 0.33 0.00 0.00 0.00 174.94 175.36 2ajc n PHE 89 N 4.10 0.00 -3.16 3.97 -0.00 0.58 -4.79 117.46 118.15 2ajc n PHE 89 Ca 0.13 0.00 0.03 0.00 -0.00 0.00 0.00 57.45 57.61 2ajc n PHE 89 Cb 0.41 -0.75 -0.00 0.00 -0.00 0.00 0.00 39.48 39.13 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 -5.27 -1.57 0.56 -2.13 0.20 -0.60 -4.99 118.68 104.89 2ajc s LEU 90 Ca -0.10 -0.11 -0.19 0.00 0.69 0.00 0.00 54.13 54.43 2ajc s LEU 90 Cb 0.05 1.98 -0.08 0.00 -0.43 0.00 0.00 46.19 47.71 2ajc s LEU 90 CO 0.60 -0.25 0.67 -0.62 -0.29 0.00 0.00 176.35 176.45 2ajc n GLU 91 N 5.10 0.65 0.00 1.98 1.02 -1.26 -1.56 120.64 126.57 2ajc n GLU 91 Ca 0.07 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 2ajc n GLU 91 Cb 0.55 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 2ajc n GLU 91 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2ajc n ASN 92 N 0.19 -1.21 0.00 1.62 0.23 -1.26 -3.26 115.26 111.56 2ajc n ASN 92 Ca 0.12 -0.29 0.00 0.00 -0.53 0.00 0.00 54.58 53.89 2ajc n ASN 92 Cb 0.47 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.17 2ajc n ASN 92 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2ajc n SER 93 N -2.67 0.00 0.05 0.53 3.41 -1.26 -4.42 113.62 109.26 2ajc n SER 93 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.64 2ajc n SER 93 Cb 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.13 2ajc n SER 93 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2ajc n THR 94 N 0.00 1.70 -2.89 6.66 -1.04 -1.20 -3.89 114.28 113.61 2ajc n THR 94 Ca 0.00 0.57 -0.43 0.00 -2.04 0.00 0.00 64.05 62.14 2ajc n THR 94 Cb 0.00 -1.56 -0.04 0.00 -1.82 0.00 0.00 70.33 66.91 2ajc n THR 94 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2ajc s PHE 95 N -3.17 2.78 -0.39 -1.42 0.08 -1.26 -4.90 117.98 109.70 2ajc s PHE 95 Ca -0.01 -0.74 -0.03 0.00 0.12 0.00 0.00 56.93 56.28 2ajc s PHE 95 Cb 0.02 -4.27 0.14 0.00 -0.57 0.00 0.00 43.02 38.34 2ajc s PHE 95 CO 0.06 -1.59 2.42 -0.25 -0.10 0.00 0.00 175.22 175.76 2ajc n ASP 96 N 7.38 6.50 -3.08 1.36 8.00 -1.25 -4.85 116.55 130.60 2ajc n ASP 96 Ca 0.00 -3.15 -0.11 0.00 0.71 0.00 0.00 54.79 52.24 2ajc n ASP 96 Cb 0.46 -1.15 -0.03 0.00 -0.02 0.00 0.00 41.12 40.38 2ajc n ASP 96 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2ajc n GLU 97 N 0.60 -0.97 -1.44 -1.24 0.00 -1.26 -4.60 120.64 111.73 2ajc n GLU 97 Ca 0.41 0.03 -0.49 0.00 0.00 0.00 0.00 57.16 57.11 2ajc n GLU 97 Cb 0.57 -1.28 -0.08 0.00 0.00 0.00 0.00 31.44 30.65 2ajc n GLU 97 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2ajc n LEU 98 N -2.20 1.81 0.00 -1.84 4.77 -1.26 -3.45 117.00 114.83 2ajc n LEU 98 Ca -0.10 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 2ajc n LEU 98 Cb 0.24 -1.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.10 2ajc n LEU 98 CO 0.30 -0.82 0.00 0.61 -1.33 0.00 0.00 177.39 176.15 2ajc n GLY 99 N 6.59 1.71 0.00 -0.72 0.00 -1.26 -4.02 105.19 107.49 2ajc n GLY 99 Ca 0.45 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.58 2ajc n GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ajc n TYR 100 N 0.00 0.00 -3.59 1.61 4.02 -1.22 -5.09 117.16 112.88 2ajc n TYR 100 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.79 2ajc n TYR 100 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.26 2ajc n TYR 100 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2ajc s SER 101 N 1.00 -0.40 -0.55 7.72 0.15 -1.26 -4.69 113.70 115.68 2ajc s SER 101 Ca 0.00 0.55 -0.28 0.00 0.70 0.00 0.00 55.95 56.92 2ajc s SER 101 Cb 0.00 0.48 0.01 0.00 -1.71 0.00 0.00 66.02 64.80 2ajc s SER 101 CO 0.00 -0.29 1.41 -0.89 1.20 0.00 0.00 173.24 174.68 2ajc s THR 102 N -0.70 3.79 -2.30 6.45 2.01 -1.26 -4.29 115.64 119.35 2ajc s THR 102 Ca -0.00 0.69 0.28 0.00 0.31 0.00 0.00 61.69 62.96 2ajc s THR 102 Cb -0.02 -4.42 0.50 0.00 0.01 0.00 0.00 72.50 68.57 2ajc s THR 102 CO -0.01 -1.14 1.73 -0.46 -0.69 0.00 0.00 174.62 174.05 2ajc n ASN 103 N 9.54 1.31 -3.63 3.53 6.94 -0.09 -4.94 115.26 127.92 2ajc n ASN 103 Ca 0.13 -1.32 -0.04 0.00 -0.02 0.00 0.00 54.58 53.32 2ajc n ASN 103 Cb 0.49 0.03 -0.05 0.00 -2.36 0.00 0.00 39.78 37.89 2ajc n ASN 103 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2ajc s ASP 104 N -2.12 -0.11 0.13 0.53 2.15 -1.18 -5.01 116.67 111.05 2ajc s ASP 104 Ca 0.35 0.14 0.04 0.00 0.43 0.00 0.00 52.55 53.50 2ajc s ASP 104 Cb 0.21 0.11 -0.04 0.00 -0.30 0.00 0.00 42.92 42.90 2ajc s ASP 104 CO 0.38 -0.09 -0.09 -0.72 -0.17 0.00 0.00 175.17 174.48 2ajc s TYR 105 N -0.83 1.14 -0.18 -5.34 -0.85 -1.26 0.05 117.35 110.09 2ajc s TYR 105 Ca 0.07 -0.78 -0.05 0.00 -0.52 0.00 0.00 57.07 55.79 2ajc s TYR 105 Cb -0.02 -0.60 0.09 0.00 0.38 0.00 0.00 41.96 41.81 2ajc s TYR 105 CO -0.07 0.01 0.34 0.45 -1.52 0.00 0.00 175.55 174.76 2ajc s SER 106 N -3.02 0.16 -0.04 -0.18 0.15 -0.68 -4.97 113.70 105.12 2ajc s SER 106 Ca 0.14 0.65 -0.19 0.00 0.70 0.00 0.00 55.95 57.24 2ajc s SER 106 Cb 0.02 1.00 -0.05 0.00 -1.71 0.00 0.00 66.02 65.29 2ajc s SER 106 CO -0.01 -0.25 0.54 -0.69 1.20 0.00 0.00 173.24 174.03 2ajc s VAL 107 N 2.51 5.02 0.69 4.45 1.01 -1.26 -0.10 120.40 132.72 2ajc s VAL 107 Ca 0.02 1.11 -0.17 0.00 0.00 0.00 0.00 61.98 62.94 2ajc s VAL 107 Cb -0.13 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.39 2ajc s VAL 107 CO -0.12 0.40 1.25 -1.54 0.00 0.00 0.00 175.10 175.10 2ajc n SER 108 N 2.98 1.72 -0.22 3.32 3.41 -0.46 -4.87 113.62 119.50 2ajc n SER 108 Ca -0.07 0.76 0.11 0.00 -0.26 0.00 0.00 58.87 59.40 2ajc n SER 108 Cb 0.51 -1.54 0.40 0.00 -0.26 0.00 0.00 64.21 63.32 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 0.12 0.63 -0.08 4.33 0.13 -1.80 -0.20 132.00 135.13 2ajc h PRO 109 Ca -0.50 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 2ajc h PRO 109 Cb 1.33 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2ajc h PRO 109 CO 0.51 0.42 0.00 -0.40 -0.23 0.00 0.00 178.00 178.30 2ajc n ASP 110 N -4.51 0.60 -1.58 1.44 5.68 -1.02 -4.85 116.55 112.30 2ajc n ASP 110 Ca 0.14 -1.72 -0.20 0.00 -0.50 0.00 0.00 54.79 52.51 2ajc n ASP 110 Cb 0.40 -0.05 -0.09 0.00 -1.14 0.00 0.00 41.12 40.24 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 -0.30 -1.44 0.05 0.11 1.74 -0.09 -4.86 116.66 111.87 2ajc n ARG 111 Ca 0.10 1.19 0.12 0.00 -0.77 0.00 0.00 57.85 58.49 2ajc n ARG 111 Cb 0.13 -5.56 0.14 0.00 -1.02 0.00 0.00 32.46 26.16 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 -2.32 0.27 -4.01 5.56 6.02 -1.26 -4.80 117.38 116.84 2ajc n GLN 112 Ca -0.20 0.06 -0.10 0.00 -0.01 0.00 0.00 57.00 56.75 2ajc n GLN 112 Cb 0.66 -1.65 -0.07 0.00 1.02 0.00 0.00 30.24 30.19 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 -3.16 0.52 -0.10 1.08 0.08 -1.26 -1.42 117.98 113.72 2ajc s PHE 113 Ca 0.06 -0.87 -0.06 0.00 0.12 0.00 0.00 56.93 56.18 2ajc s PHE 113 Cb 0.14 -0.12 0.04 0.00 -0.57 0.00 0.00 43.02 42.50 2ajc s PHE 113 CO 0.74 -0.72 0.24 -1.50 -0.10 0.00 0.00 175.22 173.87 2ajc s ILE 114 N -4.00 -0.02 -0.06 0.64 2.07 -0.57 -1.35 121.20 117.90 2ajc s ILE 114 Ca 0.21 0.09 -0.15 0.00 -1.41 0.00 0.00 60.65 59.39 2ajc s ILE 114 Cb 0.04 -0.35 -0.05 0.00 0.13 0.00 0.00 42.46 42.22 2ajc s ILE 114 CO 0.02 0.04 0.40 -0.76 -1.91 0.00 0.00 174.94 172.73 2ajc s LEU 115 N 0.80 4.39 -0.19 8.50 1.43 0.85 -1.47 118.68 133.00 2ajc s LEU 115 Ca -0.06 0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 53.86 2ajc s LEU 115 Cb -0.07 -2.56 -0.01 0.00 0.03 0.00 0.00 46.19 43.58 2ajc s LEU 115 CO -0.05 0.22 -0.08 -0.36 0.23 0.00 0.00 176.35 176.31 2ajc s PHE 116 N -0.46 2.91 -0.21 0.29 2.99 -0.19 -1.68 117.98 121.63 2ajc s PHE 116 Ca 0.23 -0.88 -0.09 0.00 0.00 0.00 0.00 56.93 56.18 2ajc s PHE 116 Cb -0.16 -2.01 -0.05 0.00 0.00 0.00 0.00 43.02 40.81 2ajc s PHE 116 CO 0.11 -0.45 0.12 -2.00 -0.00 0.00 0.00 175.22 173.00 2ajc s GLU 117 N 1.09 4.09 0.33 0.44 2.12 0.11 -1.98 118.70 124.89 2ajc s GLU 117 Ca 0.01 -0.27 -0.07 0.00 0.36 0.00 0.00 54.97 54.99 2ajc s GLU 117 Cb -0.15 -3.39 0.01 0.00 0.26 0.00 0.00 34.13 30.87 2ajc s GLU 117 CO -0.01 0.22 0.54 1.52 -0.54 0.00 0.00 175.26 176.99 2ajc s TYR 118 N 0.56 0.72 -1.14 5.30 1.13 -0.78 -0.91 117.35 122.23 2ajc s TYR 118 Ca 0.06 -1.07 -0.02 0.00 -1.41 0.00 0.00 57.07 54.64 2ajc s TYR 118 Cb -0.12 0.16 0.00 0.00 -1.10 0.00 0.00 41.96 40.90 2ajc s TYR 118 CO 0.00 -1.19 0.25 0.09 -2.51 0.00 0.00 175.55 172.19 2ajc n ASN 119 N -1.18 -4.57 -4.68 -0.18 4.13 -1.26 -0.66 115.26 106.85 2ajc n ASN 119 Ca -0.01 -0.12 -0.43 0.00 1.68 0.00 0.00 54.58 55.69 2ajc n ASN 119 Cb 0.61 -3.56 -0.03 0.00 -1.54 0.00 0.00 39.78 35.26 2ajc n ASN 119 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ajc n TYR 120 N -4.08 2.54 -3.84 3.10 9.36 -1.26 -4.32 117.16 118.65 2ajc n TYR 120 Ca -0.12 -0.14 -0.30 0.00 3.32 0.00 0.00 57.90 60.67 2ajc n TYR 120 Cb 0.60 -2.72 -0.15 0.00 -0.63 0.00 0.00 39.34 36.44 2ajc n TYR 120 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2ajc s VAL 121 N 3.10 1.21 0.57 2.97 1.01 0.29 -4.99 120.40 124.56 2ajc s VAL 121 Ca 0.85 -1.29 -0.21 0.00 0.00 0.00 0.00 61.98 61.32 2ajc s VAL 121 Cb -0.52 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 2ajc s VAL 121 CO 0.40 -0.37 1.34 -0.75 0.00 0.00 0.00 175.10 175.72 2ajc s LYS 122 N 1.50 3.03 0.00 2.72 2.20 -1.26 -1.21 119.74 126.71 2ajc s LYS 122 Ca 0.02 2.19 0.00 0.00 -0.36 0.00 0.00 55.97 57.82 2ajc s LYS 122 Cb -0.18 -2.17 0.00 0.00 -1.51 0.00 0.00 37.83 33.97 2ajc s LYS 122 CO -0.13 -1.27 0.00 0.94 -0.36 0.00 0.00 175.35 174.53 2ajc n GLN 123 N -1.21 0.00 0.00 4.03 7.27 -0.24 -4.86 117.38 122.38 2ajc n GLN 123 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.18 2ajc n GLN 123 Cb 0.46 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.11 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 -0.15 3.69 5.03 -1.21 -4.95 117.44 119.85 2ajc n TRP 124 Ca 0.00 0.00 -0.06 0.00 3.03 0.00 0.00 57.50 60.47 2ajc n TRP 124 Cb 0.00 0.00 0.11 0.00 -1.03 0.00 0.00 31.31 30.39 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 0.89 0.00 -0.99 2.43 -1.98 -3.37 114.38 111.36 2ajc h ARG 125 Ca 0.00 -0.26 -0.04 0.00 -0.81 0.00 0.00 59.98 58.88 2ajc h ARG 125 Cb 0.00 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 2ajc h ARG 125 CO 0.00 0.89 -1.14 0.72 -1.51 0.00 0.00 179.97 178.93 2ajc n HIS 126 N -4.20 0.00 -2.31 2.20 8.25 -1.26 -5.07 115.22 112.84 2ajc n HIS 126 Ca 0.03 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.14 2ajc n HIS 126 Cb 0.32 -0.10 -0.01 0.00 1.12 0.00 0.00 29.99 31.32 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 -3.38 5.90 -0.08 0.41 1.04 -1.26 -4.73 113.70 111.61 2ajc s SER 127 Ca -0.01 2.05 -0.32 0.00 0.48 0.00 0.00 55.95 58.15 2ajc s SER 127 Cb 0.01 -2.57 0.12 0.00 0.10 0.00 0.00 66.02 63.68 2ajc s SER 127 CO 0.08 -1.09 1.12 -0.72 0.98 0.00 0.00 173.24 173.61 2ajc s TYR 128 N -1.94 -0.16 0.26 5.02 -0.85 -1.26 -1.08 117.35 117.34 2ajc s TYR 128 Ca 0.70 0.05 0.11 0.00 -0.52 0.00 0.00 57.07 57.41 2ajc s TYR 128 Cb -0.20 0.54 -0.05 0.00 0.38 0.00 0.00 41.96 42.63 2ajc s TYR 128 CO 0.26 -0.36 -0.17 0.95 -1.52 0.00 0.00 175.55 174.71 2ajc s THR 129 N -2.68 2.65 0.30 -3.49 -4.23 -0.35 -4.62 115.64 103.24 2ajc s THR 129 Ca 0.10 -2.22 -0.19 0.00 -1.18 0.00 0.00 61.69 58.20 2ajc s THR 129 Cb 0.00 -2.37 0.03 0.00 1.34 0.00 0.00 72.50 71.49 2ajc s THR 129 CO -0.05 -0.33 0.71 0.00 -0.54 0.00 0.00 174.62 174.41 2ajc s ALA 130 N -2.28 -0.99 0.10 3.99 0.00 -0.69 -0.55 121.76 121.34 2ajc s ALA 130 Ca 0.28 -0.48 0.05 0.00 0.00 0.00 0.00 51.96 51.81 2ajc s ALA 130 Cb -0.06 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.86 2ajc s ALA 130 CO 0.15 -1.01 0.02 -1.12 0.00 0.00 0.00 175.76 173.80 2ajc s SER 131 N -2.97 5.11 0.01 0.00 0.01 0.16 -0.67 113.70 115.35 2ajc s SER 131 Ca 0.13 -0.16 0.02 0.00 1.31 0.00 0.00 55.95 57.25 2ajc s SER 131 Cb -0.05 -1.24 -0.01 0.00 0.21 0.00 0.00 66.02 64.93 2ajc s SER 131 CO 0.08 0.17 -0.06 -0.31 0.41 0.00 0.00 173.24 173.53 2ajc s TYR 132 N -1.36 0.54 0.07 2.43 1.51 -1.26 -1.87 117.35 117.40 2ajc s TYR 132 Ca 0.27 -0.17 0.09 0.00 -1.01 0.00 0.00 57.07 56.25 2ajc s TYR 132 Cb -0.12 -0.34 -0.03 0.00 -0.11 0.00 0.00 41.96 41.36 2ajc s TYR 132 CO 0.19 -0.02 -0.25 -0.51 -1.11 0.00 0.00 175.55 173.85 2ajc s ASP 133 N -0.42 3.04 -0.12 2.29 1.01 -0.84 -4.20 116.67 117.44 2ajc s ASP 133 Ca -0.00 -0.63 0.00 0.00 0.71 0.00 0.00 52.55 52.63 2ajc s ASP 133 Cb -0.04 -0.25 -0.02 0.00 1.01 0.00 0.00 42.92 43.63 2ajc s ASP 133 CO -0.00 0.21 -0.12 -0.63 0.21 0.00 0.00 175.17 174.83 2ajc s ILE 134 N -0.89 3.14 -0.12 0.77 1.01 -1.26 -1.03 121.20 122.81 2ajc s ILE 134 Ca 0.11 -0.64 0.02 0.00 0.00 0.00 0.00 60.65 60.14 2ajc s ILE 134 Cb -0.10 -2.31 -0.00 0.00 0.01 0.00 0.00 42.46 40.06 2ajc s ILE 134 CO 0.03 0.53 -0.20 -0.47 0.00 0.00 0.00 174.94 174.83 2ajc s TYR 135 N 0.19 2.67 -0.46 3.97 5.04 -0.54 0.32 117.35 128.53 2ajc s TYR 135 Ca -0.07 -1.05 -0.29 0.00 -2.44 0.00 0.00 57.07 53.21 2ajc s TYR 135 Cb -0.15 -1.79 0.03 0.00 0.35 0.00 0.00 41.96 40.40 2ajc s TYR 135 CO 0.05 -0.44 1.12 0.34 -1.34 0.00 0.00 175.55 175.28 2ajc s ASP 136 N 0.55 6.65 0.42 4.32 -1.08 0.24 -1.52 116.67 126.25 2ajc s ASP 136 Ca -0.12 0.50 0.19 0.00 -0.52 0.00 0.00 52.55 52.60 2ajc s ASP 136 Cb -0.17 -2.54 0.94 0.00 -1.46 0.00 0.00 42.92 39.69 2ajc s ASP 136 CO 0.04 -1.21 1.88 -0.07 0.52 0.00 0.00 175.17 176.33 2ajc h LEU 137 N 11.10 0.00 0.12 -1.34 3.38 -1.52 0.77 115.31 127.82 2ajc h LEU 137 Ca -0.23 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 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 1.12 0.29 -0.06 0.78 0.09 0.00 0.00 178.44 180.66 2ajc h ASN 138 N 0.00 -0.13 0.55 -0.43 2.35 -1.89 -3.28 115.58 112.75 2ajc h ASN 138 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2ajc h ASN 138 Cb 0.62 0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.02 2ajc h ASN 138 CO 0.04 0.06 0.00 0.29 -1.65 0.00 0.00 177.43 176.17 2ajc n LYS 139 N -3.31 0.14 -3.90 0.81 5.02 -1.24 -4.87 118.16 110.81 2ajc n LYS 139 Ca -0.02 0.42 -0.28 0.00 -2.02 0.00 0.00 58.31 56.41 2ajc n LYS 139 Cb 0.06 -1.79 0.02 0.00 -0.02 0.00 0.00 35.03 33.30 2ajc n LYS 139 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2ajc n ARG 140 N -2.05 -4.88 -4.37 1.97 1.74 0.26 -4.97 116.66 104.36 2ajc n ARG 140 Ca 0.02 0.56 -0.20 0.00 -0.77 0.00 0.00 57.85 57.46 2ajc n ARG 140 Cb 0.18 -5.26 -0.10 0.00 -1.02 0.00 0.00 32.46 26.26 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 -6.49 1.41 0.00 5.56 -0.21 -0.89 -4.94 119.66 114.10 2ajc s GLN 141 Ca 0.43 -1.62 -0.19 0.00 0.02 0.00 0.00 55.36 54.00 2ajc s GLN 141 Cb -0.22 -1.28 -0.06 0.00 1.00 0.00 0.00 33.01 32.46 2ajc s GLN 141 CO 0.84 0.22 0.53 -1.17 -2.12 0.00 0.00 175.29 173.60 2ajc s LEU 142 N -3.34 4.44 -0.10 2.90 0.20 -1.26 0.80 118.68 122.32 2ajc s LEU 142 Ca 0.24 1.09 -0.30 0.00 0.69 0.00 0.00 54.13 55.86 2ajc s LEU 142 Cb -0.02 -2.81 -0.03 0.00 -0.43 0.00 0.00 46.19 42.90 2ajc s LEU 142 CO 0.09 0.18 1.28 -0.63 -0.29 0.00 0.00 176.35 176.98 2ajc s ILE 143 N -0.50 4.17 -0.17 6.68 1.09 0.15 -4.88 121.20 127.74 2ajc s ILE 143 Ca 0.28 1.46 0.16 0.00 -1.10 0.00 0.00 60.65 61.45 2ajc s ILE 143 Cb -0.18 -3.94 -0.23 0.00 -1.06 0.00 0.00 42.46 37.05 2ajc s ILE 143 CO 0.16 -0.07 0.42 0.35 -0.10 0.00 0.00 174.94 175.69 2ajc n THR 144 N 5.05 0.00 -4.23 2.92 -2.24 -1.26 -4.62 114.28 109.91 2ajc n THR 144 Ca 0.13 -0.32 -0.25 0.00 -2.27 0.00 0.00 64.05 61.34 2ajc n THR 144 Cb 0.45 0.31 -0.07 0.00 -2.10 0.00 0.00 70.33 68.92 2ajc n THR 144 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2ajc s GLU 145 N -2.99 2.40 -1.32 -0.78 1.03 -1.26 -4.66 118.70 111.11 2ajc s GLU 145 Ca -0.03 -1.19 -0.00 0.00 0.03 0.00 0.00 54.97 53.77 2ajc s GLU 145 Cb 0.11 -2.31 -0.00 0.00 -0.80 0.00 0.00 34.13 31.12 2ajc s GLU 145 CO 0.67 0.43 0.64 0.39 -1.33 0.00 0.00 175.26 176.06 2ajc n GLU 146 N -0.38 -4.50 -1.73 -4.83 -0.58 -1.26 -4.73 120.64 102.63 2ajc n GLU 146 Ca -0.09 0.58 -0.33 0.00 -0.42 0.00 0.00 57.16 56.90 2ajc n GLU 146 Cb 0.56 -5.03 0.05 0.00 -0.57 0.00 0.00 31.44 26.45 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 -6.08 2.78 0.27 3.49 0.52 -1.26 -4.86 118.95 113.80 2ajc s ARG 147 Ca 0.01 1.37 -0.29 0.00 -0.52 0.00 0.00 55.73 56.30 2ajc s ARG 147 Cb -0.00 -1.95 -0.09 0.00 0.52 0.00 0.00 34.95 33.42 2ajc s ARG 147 CO 0.83 -1.27 1.24 0.42 0.02 0.00 0.00 175.30 176.54 2ajc s ILE 148 N -2.38 3.13 0.86 1.52 -1.09 -1.26 -4.96 121.20 117.03 2ajc s ILE 148 Ca 0.67 1.07 -0.13 0.00 -2.23 0.00 0.00 60.65 60.02 2ajc s ILE 148 Cb -0.20 -3.68 0.08 0.00 -1.58 0.00 0.00 42.46 37.07 2ajc s ILE 148 CO 0.42 0.22 0.92 -2.65 -1.23 0.00 0.00 174.94 172.62 2ajc n PRO 149 N 1.53 -0.09 -2.74 2.79 -0.02 -1.26 -4.60 135.00 130.61 2ajc n PRO 149 Ca 0.02 0.04 -0.37 0.00 -2.02 0.00 0.00 63.50 61.17 2ajc n PRO 149 Cb 0.43 -2.21 -0.06 0.00 -0.02 0.00 0.00 33.50 31.64 2ajc n PRO 149 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2ajc s ASN 150 N -2.16 7.25 -0.57 2.55 3.04 -1.26 -3.75 114.94 120.04 2ajc s ASN 150 Ca 0.67 1.87 -0.03 0.00 0.04 0.00 0.00 52.86 55.40 2ajc s ASN 150 Cb -0.26 -2.58 0.00 0.00 -1.54 0.00 0.00 41.25 36.87 2ajc s ASN 150 CO 0.58 -0.14 0.45 0.59 -3.04 0.00 0.00 177.10 175.54 2ajc n ASN 151 N 0.45 -3.76 -4.70 -4.21 3.02 -1.17 -4.99 115.26 99.90 2ajc n ASN 151 Ca 0.02 -0.21 -0.42 0.00 -0.03 0.00 0.00 54.58 53.95 2ajc n ASN 151 Cb 0.50 -2.37 -0.03 0.00 -0.61 0.00 0.00 39.78 37.28 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 -3.08 4.47 0.16 3.41 2.01 0.16 -4.64 115.64 118.11 2ajc s THR 152 Ca 0.23 1.77 0.03 0.00 0.31 0.00 0.00 61.69 64.02 2ajc s THR 152 Cb -0.10 -4.13 -0.16 0.00 0.01 0.00 0.00 72.50 68.11 2ajc s THR 152 CO 0.28 0.07 1.35 1.56 -0.69 0.00 0.00 174.62 177.20 2ajc h GLN 153 N 7.04 0.16 -1.79 4.92 4.20 -1.26 -1.84 115.11 126.55 2ajc h GLN 153 Ca -0.37 -0.19 0.01 0.00 0.06 0.00 0.00 58.65 58.15 2ajc h GLN 153 Cb 1.19 0.06 -0.22 0.00 0.30 0.00 0.00 27.48 28.81 2ajc h GLN 153 CO 0.82 0.97 0.34 -0.46 -0.67 0.00 0.00 178.83 179.83 2ajc s TRP 154 N -3.10 -0.56 -0.07 2.96 -0.11 -1.22 -4.67 118.94 112.17 2ajc s TRP 154 Ca -0.02 1.12 -0.16 0.00 1.22 0.00 0.00 56.10 58.26 2ajc s TRP 154 Cb 0.10 0.39 0.03 0.00 -1.50 0.00 0.00 33.47 32.49 2ajc s TRP 154 CO 0.83 -0.42 0.37 -1.50 -4.62 0.00 0.00 176.95 171.61 2ajc s ILE 155 N -0.63 0.03 -0.14 5.86 2.07 -1.26 -0.32 121.20 126.81 2ajc s ILE 155 Ca -0.04 -0.25 -0.24 0.00 -1.41 0.00 0.00 60.65 58.71 2ajc s ILE 155 Cb -0.02 -0.62 0.06 0.00 0.13 0.00 0.00 42.46 42.01 2ajc s ILE 155 CO 0.03 -0.14 0.60 0.28 -1.91 0.00 0.00 174.94 173.80 2ajc s THR 156 N -0.73 0.01 0.53 4.00 -1.32 -0.50 -5.00 115.64 112.63 2ajc s THR 156 Ca -0.08 -0.06 -0.17 0.00 -1.21 0.00 0.00 61.69 60.17 2ajc s THR 156 Cb -0.04 -0.88 -0.07 0.00 -1.51 0.00 0.00 72.50 70.01 2ajc s THR 156 CO 0.03 -0.03 1.01 0.26 -2.21 0.00 0.00 174.62 173.68 2ajc s TRP 157 N -0.39 3.24 0.98 9.09 0.52 -1.26 -1.81 118.94 129.31 2ajc s TRP 157 Ca -0.05 1.50 -0.12 0.00 0.02 0.00 0.00 56.10 57.45 2ajc s TRP 157 Cb -0.03 -2.90 0.18 0.00 -1.15 0.00 0.00 33.47 29.57 2ajc s TRP 157 CO 0.04 -0.66 1.08 -1.54 0.02 0.00 0.00 176.95 175.90 2ajc s SER 158 N -2.81 2.67 0.48 2.95 1.04 -0.45 -4.92 113.70 112.65 2ajc s SER 158 Ca 0.62 1.48 0.25 0.00 0.48 0.00 0.00 55.95 58.77 2ajc s SER 158 Cb -0.13 -2.15 1.19 0.00 0.10 0.00 0.00 66.02 65.03 2ajc s SER 158 CO 0.31 -3.14 1.96 -0.65 0.98 0.00 0.00 173.24 172.70 2ajc h PRO 159 N -1.90 0.00 -4.86 4.02 0.11 -1.81 -3.42 132.00 124.15 2ajc h PRO 159 Ca -0.53 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.31 2ajc h PRO 159 Cb 1.30 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.27 2ajc h PRO 159 CO 0.53 0.18 -0.70 0.14 -0.21 0.00 0.00 178.00 177.94 2ajc s VAL 160 N -3.97 0.92 0.00 3.15 -7.23 -1.26 -4.77 120.40 107.24 2ajc s VAL 160 Ca -0.02 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.16 2ajc s VAL 160 Cb 0.12 -1.79 0.00 0.00 0.56 0.00 0.00 36.38 35.27 2ajc s VAL 160 CO 0.61 -0.79 0.00 0.61 -0.31 0.00 0.00 175.10 175.23 2ajc n GLY 161 N -0.13 1.83 1.81 2.32 0.00 -1.26 -4.41 105.19 105.35 2ajc n GLY 161 Ca -0.11 -0.53 -0.03 0.00 0.00 0.00 0.00 46.02 45.35 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 13.03 -0.58 -1.48 1.61 1.44 -1.26 -2.44 115.22 125.54 2ajc n HIS 162 Ca 0.00 -1.08 -0.31 0.00 -2.01 0.00 0.00 57.72 54.33 2ajc n HIS 162 Cb 0.00 0.71 0.06 0.00 0.12 0.00 0.00 29.99 30.88 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 -0.33 2.70 0.04 -1.40 1.02 -1.26 -4.68 119.74 115.82 2ajc s LYS 163 Ca 0.10 1.00 0.05 0.00 0.02 0.00 0.00 55.97 57.13 2ajc s LYS 163 Cb 0.23 -1.96 -0.02 0.00 -0.52 0.00 0.00 37.83 35.56 2ajc s LYS 163 CO -0.07 -1.28 -0.13 -0.51 -0.92 0.00 0.00 175.35 172.43 2ajc s LEU 164 N -5.67 2.17 -0.02 3.17 1.43 -0.21 -1.35 118.68 118.21 2ajc s LEU 164 Ca 0.59 -0.45 0.03 0.00 -1.03 0.00 0.00 54.13 53.27 2ajc s LEU 164 Cb -0.15 -0.57 -0.00 0.00 0.03 0.00 0.00 46.19 45.50 2ajc s LEU 164 CO 0.55 0.02 -0.09 0.00 0.23 0.00 0.00 176.35 177.06 2ajc s ALA 165 N -0.86 0.86 0.08 4.21 0.00 -0.75 -0.78 121.76 124.51 2ajc s ALA 165 Ca 0.01 -0.37 -0.13 0.00 0.00 0.00 0.00 51.96 51.46 2ajc s ALA 165 Cb -0.08 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.78 2ajc s ALA 165 CO 0.01 0.17 0.31 1.52 0.00 0.00 0.00 175.76 177.77 2ajc s TYR 166 N 0.03 -0.08 -0.10 0.00 -0.85 -0.22 -1.41 117.35 114.73 2ajc s TYR 166 Ca -0.00 -0.18 0.01 0.00 -0.52 0.00 0.00 57.07 56.37 2ajc s TYR 166 Cb -0.07 0.11 -0.02 0.00 0.38 0.00 0.00 41.96 42.36 2ajc s TYR 166 CO 0.00 -0.57 -0.11 0.08 -1.52 0.00 0.00 175.55 173.43 2ajc s VAL 167 N -3.23 3.29 -0.14 -3.49 1.01 0.57 -0.62 120.40 117.78 2ajc s VAL 167 Ca -0.00 -0.60 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 2ajc s VAL 167 Cb 0.01 -2.36 0.05 0.00 0.00 0.00 0.00 36.38 34.09 2ajc s VAL 167 CO -0.08 0.55 0.32 0.86 0.00 0.00 0.00 175.10 176.76 2ajc s TRP 168 N -0.15 -0.46 -1.46 5.22 -0.00 -0.34 -0.86 118.94 120.89 2ajc s TRP 168 Ca 0.00 1.03 -0.10 0.00 -0.00 0.00 0.00 56.10 57.03 2ajc s TRP 168 Cb -0.13 0.15 0.06 0.00 -0.00 0.00 0.00 33.47 33.55 2ajc s TRP 168 CO 0.03 -0.29 0.80 0.09 -0.00 0.00 0.00 176.95 177.58 2ajc n ASN 169 N 4.25 -5.01 -0.33 5.86 5.03 -1.26 -1.70 115.26 122.10 2ajc n ASN 169 Ca -0.24 -0.55 -0.04 0.00 0.87 0.00 0.00 54.58 54.62 2ajc n ASN 169 Cb 0.54 -4.03 -0.02 0.00 -1.02 0.00 0.00 39.78 35.25 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 -2.64 -4.74 -4.34 6.41 5.03 -1.26 -4.46 115.26 109.25 2ajc n ASN 170 Ca -0.01 0.11 -0.24 0.00 0.87 0.00 0.00 54.58 55.31 2ajc n ASN 170 Cb 0.55 -2.62 -0.12 0.00 -1.02 0.00 0.00 39.78 36.57 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 -2.29 2.81 0.05 6.41 1.01 -0.69 -1.95 116.67 122.02 2ajc s ASP 171 Ca 0.00 -0.79 -0.14 0.00 0.71 0.00 0.00 52.55 52.33 2ajc s ASP 171 Cb 0.00 -0.17 -0.06 0.00 1.01 0.00 0.00 42.92 43.70 2ajc s ASP 171 CO 0.00 0.04 0.44 -0.63 0.21 0.00 0.00 175.17 175.23 2ajc s ILE 172 N -1.61 5.00 0.03 0.77 1.01 -1.26 -1.20 121.20 123.93 2ajc s ILE 172 Ca 0.13 0.77 0.03 0.00 0.00 0.00 0.00 60.65 61.58 2ajc s ILE 172 Cb -0.08 -3.71 -0.02 0.00 0.01 0.00 0.00 42.46 38.66 2ajc s ILE 172 CO 0.06 0.45 -0.08 -0.31 0.00 0.00 0.00 174.94 175.06 2ajc s TYR 173 N -1.22 0.72 -0.04 3.97 1.51 0.21 -0.36 117.35 122.13 2ajc s TYR 173 Ca 0.29 -0.34 0.05 0.00 -1.01 0.00 0.00 57.07 56.06 2ajc s TYR 173 Cb -0.16 -0.44 -0.01 0.00 -0.11 0.00 0.00 41.96 41.25 2ajc s TYR 173 CO 0.16 -0.04 -0.20 0.08 -1.11 0.00 0.00 175.55 174.44 2ajc s VAL 174 N -0.87 1.63 -0.23 0.71 1.01 0.15 -1.05 120.40 121.75 2ajc s VAL 174 Ca -0.04 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.12 2ajc s VAL 174 Cb -0.07 -1.38 0.05 0.00 0.00 0.00 0.00 36.38 34.98 2ajc s VAL 174 CO 0.00 0.46 -0.10 -0.54 0.00 0.00 0.00 175.10 174.93 2ajc s LYS 175 N -0.14 2.04 0.29 2.72 1.02 0.04 0.23 119.74 125.94 2ajc s LYS 175 Ca -0.01 -1.05 0.09 0.00 0.02 0.00 0.00 55.97 55.02 2ajc s LYS 175 Cb -0.11 -2.63 0.42 0.00 -0.52 0.00 0.00 37.83 34.99 2ajc s LYS 175 CO 0.02 -0.51 1.66 -0.91 -0.92 0.00 0.00 175.35 174.68 2ajc h ASN 176 N 7.90 0.08 -3.97 2.83 -0.26 -1.83 -0.54 115.58 119.78 2ajc h ASN 176 Ca -0.23 -0.04 -0.40 0.00 -0.56 0.00 0.00 56.30 55.07 2ajc h ASN 176 Cb 1.07 -0.02 -0.29 0.00 -1.06 0.00 0.00 38.32 38.02 2ajc h ASN 176 CO 0.46 0.60 -0.78 -1.61 -1.06 0.00 0.00 177.43 175.04 2ajc s GLU 177 N -3.82 0.80 0.33 0.81 0.41 -1.26 -4.35 118.70 111.61 2ajc s GLU 177 Ca -0.02 -0.32 0.07 0.00 -0.41 0.00 0.00 54.97 54.28 2ajc s GLU 177 Cb 0.13 -0.76 0.74 0.00 -1.78 0.00 0.00 34.13 32.45 2ajc s GLU 177 CO 0.76 0.17 1.84 -1.35 -0.49 0.00 0.00 175.26 176.19 2ajc h PRO 178 N 6.06 0.76 -0.00 0.39 0.11 -1.84 -1.06 132.00 136.41 2ajc h PRO 178 Ca -0.32 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2ajc h PRO 178 Cb 1.18 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2ajc h PRO 178 CO 0.49 0.50 -0.15 0.27 -0.21 0.00 0.00 178.00 178.90 2ajc n ASN 179 N -4.62 0.64 -4.96 -2.05 6.94 -1.26 -4.83 115.26 105.11 2ajc n ASN 179 Ca 0.19 -0.66 -0.22 0.00 -0.02 0.00 0.00 54.58 53.88 2ajc n ASN 179 Cb 0.48 -0.01 -0.01 0.00 -2.36 0.00 0.00 39.78 37.87 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 -2.49 4.16 0.58 -4.53 2.01 -0.40 -4.69 118.68 113.32 2ajc s LEU 180 Ca 0.27 0.18 -0.18 0.00 0.01 0.00 0.00 54.13 54.41 2ajc s LEU 180 Cb 0.20 -3.01 -0.04 0.00 0.01 0.00 0.00 46.19 43.34 2ajc s LEU 180 CO 0.49 -0.20 1.14 -0.94 1.01 0.00 0.00 176.35 177.85 2ajc s SER 181 N -4.02 5.49 0.47 2.29 1.04 -1.26 -4.77 113.70 112.93 2ajc s SER 181 Ca 0.37 2.19 -0.08 0.00 0.48 0.00 0.00 55.95 58.91 2ajc s SER 181 Cb -0.09 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 63.40 2ajc s SER 181 CO 0.32 -1.38 0.81 -0.94 0.98 0.00 0.00 173.24 173.03 2ajc s SER 182 N -1.88 6.37 -0.18 7.02 1.04 -1.26 -4.69 113.70 120.11 2ajc s SER 182 Ca 0.73 1.08 -0.02 0.00 0.48 0.00 0.00 55.95 58.22 2ajc s SER 182 Cb -0.25 -2.31 -0.01 0.00 0.10 0.00 0.00 66.02 63.56 2ajc s SER 182 CO 0.31 -0.54 -0.09 -1.58 0.98 0.00 0.00 173.24 172.31 2ajc s GLN 183 N -4.42 3.34 0.19 4.02 2.00 0.14 -4.92 119.66 120.01 2ajc s GLN 183 Ca 0.50 -0.67 -0.30 0.00 -2.00 0.00 0.00 55.36 52.89 2ajc s GLN 183 Cb -0.10 -2.81 -0.08 0.00 0.80 0.00 0.00 33.01 30.81 2ajc s GLN 183 CO 0.40 -0.04 1.23 0.50 -0.50 0.00 0.00 175.29 176.89 2ajc s ARG 184 N 1.01 4.46 -0.16 1.67 3.52 -1.26 -0.67 118.95 127.51 2ajc s ARG 184 Ca -0.01 1.94 0.09 0.00 -0.13 0.00 0.00 55.73 57.62 2ajc s ARG 184 Cb -0.15 -3.22 -0.17 0.00 -1.56 0.00 0.00 34.95 29.86 2ajc s ARG 184 CO -0.01 -0.14 -0.03 -0.89 -0.81 0.00 0.00 175.30 173.43 2ajc n ILE 185 N 2.48 1.06 -4.17 4.11 2.08 0.51 -4.94 119.36 120.50 2ajc n ILE 185 Ca 0.05 -0.56 -0.15 0.00 0.56 0.00 0.00 62.75 62.64 2ajc n ILE 185 Cb 0.44 -0.81 -0.11 0.00 -0.75 0.00 0.00 39.64 38.41 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 -2.37 0.97 0.00 1.39 -4.23 -1.22 -4.95 115.64 105.22 2ajc s THR 186 Ca -0.14 -1.49 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 2ajc s THR 186 Cb 0.05 -1.21 0.00 0.00 1.34 0.00 0.00 72.50 72.68 2ajc s THR 186 CO 0.56 -0.44 0.55 0.79 -0.54 0.00 0.00 174.62 175.54 2ajc n TRP 187 N 0.85 0.00 1.24 3.99 7.02 -1.26 -4.54 117.44 124.74 2ajc n TRP 187 Ca -0.18 -0.15 0.13 0.00 -1.02 0.00 0.00 57.50 56.28 2ajc n TRP 187 Cb 0.56 -0.02 0.32 0.00 -2.42 0.00 0.00 31.31 29.76 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 -0.15 0.00 -1.64 -0.99 -2.24 -1.26 -4.97 114.28 103.03 2ajc n THR 188 Ca 0.00 -0.21 -0.48 0.00 -2.27 0.00 0.00 64.05 61.09 2ajc n THR 188 Cb 0.24 0.67 -0.05 0.00 -2.10 0.00 0.00 70.33 69.09 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 1.32 0.85 3.26 3.38 0.00 -1.26 -4.62 105.19 108.12 2ajc n GLY 189 Ca 0.13 0.67 -0.09 0.00 0.00 0.00 0.00 46.02 46.73 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 0.68 0.32 0.06 1.61 2.20 -0.69 -4.93 119.74 118.99 2ajc s LYS 190 Ca 0.80 1.03 -0.38 0.00 -0.36 0.00 0.00 55.97 57.06 2ajc s LYS 190 Cb -0.79 0.32 -0.18 0.00 -1.51 0.00 0.00 37.83 35.68 2ajc s LYS 190 CO 0.42 -0.25 1.21 -1.91 -0.36 0.00 0.00 175.35 174.46 2ajc n GLU 191 N 5.38 0.68 -1.00 4.03 2.13 -1.26 -0.05 120.64 130.55 2ajc n GLU 191 Ca -0.08 0.25 -0.00 0.00 0.66 0.00 0.00 57.16 57.98 2ajc n GLU 191 Cb 0.49 -1.82 -0.00 0.00 0.27 0.00 0.00 31.44 30.39 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 2.09 -5.81 0.10 4.31 5.03 -1.26 -4.71 115.26 115.00 2ajc n ASN 192 Ca 0.19 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.64 2ajc n ASN 192 Cb 0.15 -3.31 0.00 0.00 -1.02 0.00 0.00 39.78 35.60 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 -2.06 0.54 -4.92 2.41 0.31 0.93 -4.72 118.33 110.81 2ajc n VAL 193 Ca -0.00 0.18 -0.31 0.00 -0.01 0.00 0.00 64.34 64.20 2ajc n VAL 193 Cb 0.47 -1.00 -0.17 0.00 -0.91 0.00 0.00 33.84 32.23 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 -2.00 1.92 -0.18 2.52 -1.09 -0.31 -0.33 121.20 121.73 2ajc s ILE 194 Ca 0.00 -0.92 0.01 0.00 -2.23 0.00 0.00 60.65 57.51 2ajc s ILE 194 Cb 0.00 -1.69 0.02 0.00 -1.58 0.00 0.00 42.46 39.22 2ajc s ILE 194 CO 0.00 0.53 -0.19 -0.31 -1.23 0.00 0.00 174.94 173.73 2ajc s TYR 195 N 0.58 2.81 -0.23 3.97 1.51 -0.11 -1.70 117.35 124.18 2ajc s TYR 195 Ca -0.14 -1.68 -0.03 0.00 -1.01 0.00 0.00 57.07 54.21 2ajc s TYR 195 Cb -0.17 -1.92 0.01 0.00 -0.11 0.00 0.00 41.96 39.77 2ajc s TYR 195 CO 0.04 -0.81 -0.06 -0.80 -1.11 0.00 0.00 175.55 172.81 2ajc s ASN 196 N 1.28 4.20 0.00 2.29 0.01 -0.82 -0.48 114.94 121.42 2ajc s ASN 196 Ca 0.04 -0.60 0.00 0.00 -0.71 0.00 0.00 52.86 51.59 2ajc s ASN 196 Cb -0.13 -1.69 0.00 0.00 0.41 0.00 0.00 41.25 39.84 2ajc s ASN 196 CO -0.13 -0.06 0.00 0.61 -1.51 0.00 0.00 177.10 176.01 2ajc n GLY 197 N 4.74 1.64 3.10 0.66 0.00 -0.68 -4.29 105.19 110.35 2ajc n GLY 197 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.47 0.44 0.67 1.61 -7.23 -1.26 -0.25 120.40 111.91 2ajc s VAL 198 Ca 0.00 -1.62 -0.10 0.00 -1.81 0.00 0.00 61.98 58.45 2ajc s VAL 198 Cb 0.00 -1.27 0.00 0.00 0.56 0.00 0.00 36.38 35.67 2ajc s VAL 198 CO 0.00 -0.78 1.05 0.42 -0.31 0.00 0.00 175.10 175.47 2ajc s THR 199 N -3.07 3.81 0.28 5.32 -4.23 -0.14 -4.71 115.64 112.90 2ajc s THR 199 Ca 0.03 0.49 -0.01 0.00 -1.18 0.00 0.00 61.69 61.02 2ajc s THR 199 Cb 0.02 -3.57 0.06 0.00 1.34 0.00 0.00 72.50 70.35 2ajc s THR 199 CO -0.05 -0.72 0.39 -0.90 -0.54 0.00 0.00 174.62 172.79 2ajc n ASP 200 N -2.87 0.42 0.08 3.99 5.75 -1.26 -4.81 116.55 117.85 2ajc n ASP 200 Ca 0.06 -1.38 -0.12 0.00 -0.01 0.00 0.00 54.79 53.34 2ajc n ASP 200 Cb 0.56 -0.26 -0.06 0.00 -1.03 0.00 0.00 41.12 40.34 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 -0.59 -0.34 -0.11 2.11 7.01 -1.99 -1.94 115.95 120.10 2ajc h TRP 201 Ca -0.13 0.01 -0.12 0.00 2.11 0.00 0.00 58.89 60.76 2ajc h TRP 201 Cb 0.45 0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.63 2ajc h TRP 201 CO 0.00 -0.20 -0.47 -0.24 -2.79 0.00 0.00 178.44 174.74 2ajc h VAL 202 N -0.25 1.33 -0.18 2.65 3.04 -1.95 -1.86 116.25 119.03 2ajc h VAL 202 Ca 0.02 -1.68 -0.16 0.00 -1.01 0.00 0.00 66.70 63.88 2ajc h VAL 202 Cb 0.28 1.78 -0.01 0.00 -2.01 0.00 0.00 31.29 31.33 2ajc h VAL 202 CO -0.08 0.50 -0.55 1.88 -1.01 0.00 0.00 177.57 178.31 2ajc h TYR 203 N 0.22 0.67 -0.01 3.17 -1.99 -1.93 0.11 116.97 117.21 2ajc h TYR 203 Ca 0.01 -0.24 -0.00 0.00 2.00 0.00 0.00 58.73 60.51 2ajc h TYR 203 Cb 0.92 -0.13 -0.00 0.00 2.00 0.00 0.00 36.73 39.53 2ajc h TYR 203 CO 0.02 0.96 0.00 1.49 -0.00 0.00 0.00 178.16 180.63 2ajc h GLU 204 N 0.41 0.01 -0.08 4.88 4.81 -1.04 0.30 114.58 123.87 2ajc h GLU 204 Ca 0.01 -0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.07 2ajc h GLU 204 Cb 1.09 -0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.48 2ajc h GLU 204 CO 0.10 0.24 -0.58 1.49 -0.73 0.00 0.00 179.01 179.53 2ajc h GLU 205 N -0.22 0.54 0.00 1.92 4.57 -1.33 -1.63 114.58 118.43 2ajc h GLU 205 Ca 0.00 -0.47 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 2ajc h GLU 205 Cb 0.24 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.93 2ajc h GLU 205 CO 0.00 1.10 -1.58 0.39 -1.18 0.00 0.00 179.01 177.74 2ajc n GLU 206 N -4.18 0.54 -0.05 1.92 -0.58 0.37 -4.49 120.64 114.17 2ajc n GLU 206 Ca -0.09 -0.12 -0.08 0.00 -0.42 0.00 0.00 57.16 56.45 2ajc n GLU 206 Cb 0.64 -1.32 -0.03 0.00 -0.57 0.00 0.00 31.44 30.17 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 -1.94 1.27 0.04 2.62 0.31 -0.94 -4.83 118.33 114.85 2ajc n VAL 207 Ca -0.02 0.13 0.03 0.00 -0.01 0.00 0.00 64.34 64.47 2ajc n VAL 207 Cb 0.35 -1.96 -0.07 0.00 -0.91 0.00 0.00 33.84 31.25 2ajc n VAL 207 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2ajc n PHE 208 N -3.99 0.84 -3.81 3.52 3.01 0.05 -4.97 117.46 112.13 2ajc n PHE 208 Ca -0.14 0.27 -0.28 0.00 1.01 0.00 0.00 57.45 58.31 2ajc n PHE 208 Cb 0.41 -1.00 0.04 0.00 -0.01 0.00 0.00 39.48 38.92 2ajc n PHE 208 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2ajc n SER 209 N -2.77 -5.18 -3.51 4.37 7.64 -0.63 -4.94 113.62 108.59 2ajc n SER 209 Ca -0.08 -0.70 -0.08 0.00 1.01 0.00 0.00 58.87 59.01 2ajc n SER 209 Cb 0.76 -4.27 -0.02 0.00 -1.01 0.00 0.00 64.21 59.68 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 -1.84 -0.12 -0.43 0.00 -1.10 -4.99 121.76 109.96 2ajc s ALA 210 Ca 0.61 1.05 0.17 0.00 0.00 0.00 0.00 51.96 53.79 2ajc s ALA 210 Cb -0.30 0.37 -0.22 0.00 0.00 0.00 0.00 23.12 22.98 2ajc s ALA 210 CO 0.80 -0.68 0.51 0.98 0.00 0.00 0.00 175.76 177.37 2ajc n TYR 211 N -0.22 0.59 -2.25 0.00 9.36 -1.26 -4.27 117.16 119.10 2ajc n TYR 211 Ca -0.08 0.20 -0.39 0.00 3.32 0.00 0.00 57.90 60.95 2ajc n TYR 211 Cb 0.62 -1.03 -0.02 0.00 -0.63 0.00 0.00 39.34 38.27 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 -5.65 6.64 -0.32 2.98 0.15 -1.26 -0.97 113.70 115.26 2ajc s SER 212 Ca -0.06 2.44 0.17 0.00 0.70 0.00 0.00 55.95 59.20 2ajc s SER 212 Cb 0.08 -2.63 0.46 0.00 -1.71 0.00 0.00 66.02 62.22 2ajc s SER 212 CO 0.83 -0.60 1.07 0.00 1.20 0.00 0.00 173.24 175.74 2ajc n ALA 213 N 0.36 2.91 -2.91 5.45 0.00 0.65 -4.63 120.51 122.34 2ajc n ALA 213 Ca 0.03 -2.69 -0.19 0.00 0.00 0.00 0.00 53.44 50.59 2ajc n ALA 213 Cb 0.45 -0.93 -0.15 0.00 0.00 0.00 0.00 19.45 18.82 2ajc n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ajc s LEU 214 N -3.32 1.86 -0.21 0.00 1.43 -1.24 -2.05 118.68 115.16 2ajc s LEU 214 Ca 0.25 -0.15 -0.04 0.00 -1.03 0.00 0.00 54.13 53.16 2ajc s LEU 214 Cb 0.42 -0.45 0.08 0.00 0.03 0.00 0.00 46.19 46.28 2ajc s LEU 214 CO -0.00 0.07 0.13 0.26 0.23 0.00 0.00 176.35 177.03 2ajc s TRP 215 N 0.06 0.13 0.56 0.29 0.51 0.89 -4.99 118.94 116.40 2ajc s TRP 215 Ca -0.01 -0.40 -0.19 0.00 -2.12 0.00 0.00 56.10 53.39 2ajc s TRP 215 Cb -0.06 -0.70 -0.05 0.00 -0.81 0.00 0.00 33.47 31.86 2ajc s TRP 215 CO -0.00 -0.63 1.13 -1.58 -0.51 0.00 0.00 176.95 175.35 2ajc s TRP 216 N 2.16 2.66 0.69 -1.98 0.52 -1.26 -1.04 118.94 120.69 2ajc s TRP 216 Ca 0.05 1.54 -0.11 0.00 0.02 0.00 0.00 56.10 57.60 2ajc s TRP 216 Cb -0.16 -3.27 0.00 0.00 -1.15 0.00 0.00 33.47 28.90 2ajc s TRP 216 CO -0.18 -1.60 1.07 -1.54 0.02 0.00 0.00 176.95 174.72 2ajc s SER 217 N -1.92 5.58 0.31 2.95 1.04 0.77 -4.91 113.70 117.53 2ajc s SER 217 Ca 0.72 1.33 0.08 0.00 0.48 0.00 0.00 55.95 58.56 2ajc s SER 217 Cb -0.23 -2.22 0.88 0.00 0.10 0.00 0.00 66.02 64.56 2ajc s SER 217 CO 0.30 -1.28 1.68 -0.65 0.98 0.00 0.00 173.24 174.27 2ajc h PRO 218 N -0.61 0.36 -0.51 4.02 0.11 -1.90 -1.10 132.00 132.38 2ajc h PRO 218 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2ajc h PRO 218 Cb 1.23 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2ajc h PRO 218 CO 0.62 0.24 0.00 0.09 -0.21 0.00 0.00 178.00 178.73 2ajc n ASN 219 N -5.05 3.70 0.00 -2.05 3.02 -1.26 -4.27 115.26 109.35 2ajc n ASN 219 Ca 0.26 -2.20 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 2ajc n ASN 219 Cb 0.80 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.56 2ajc n ASN 219 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ajc n GLY 220 N 0.84 0.61 0.16 7.41 0.00 -0.42 -4.83 105.19 108.96 2ajc n GLY 220 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 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 1.30 -3.57 2.61 2.02 -1.94 -3.45 112.91 109.88 2ajc h THR 221 Ca 0.00 -1.12 -0.67 0.00 0.77 0.00 0.00 66.41 65.39 2ajc h THR 221 Cb 0.06 1.56 -0.16 0.00 -1.74 0.00 0.00 68.15 67.87 2ajc h THR 221 CO 0.00 0.34 -0.75 -0.36 0.37 0.00 0.00 175.52 175.12 2ajc s PHE 222 N -4.66 2.68 -0.21 3.16 0.08 -1.26 -1.45 117.98 116.31 2ajc s PHE 222 Ca -0.14 -0.19 0.01 0.00 0.12 0.00 0.00 56.93 56.73 2ajc s PHE 222 Cb 0.07 -1.40 0.05 0.00 -0.57 0.00 0.00 43.02 41.17 2ajc s PHE 222 CO 0.76 0.42 -0.08 -1.17 -0.10 0.00 0.00 175.22 175.05 2ajc s LEU 223 N -2.24 2.40 0.15 -0.37 2.96 -0.13 -0.16 118.68 121.29 2ajc s LEU 223 Ca 0.21 -1.01 -0.06 0.00 -0.22 0.00 0.00 54.13 53.04 2ajc s LEU 223 Cb -0.11 -1.20 -0.06 0.00 0.50 0.00 0.00 46.19 45.33 2ajc s LEU 223 CO 0.13 -0.19 0.41 0.00 -1.32 0.00 0.00 176.35 175.38 2ajc s ALA 224 N 1.40 3.74 0.16 5.97 0.00 -0.21 -0.37 121.76 132.46 2ajc s ALA 224 Ca -0.03 -0.49 -0.16 0.00 0.00 0.00 0.00 51.96 51.27 2ajc s ALA 224 Cb -0.17 -2.20 0.03 0.00 0.00 0.00 0.00 23.12 20.78 2ajc s ALA 224 CO -0.07 0.63 0.45 1.52 0.00 0.00 0.00 175.76 178.29 2ajc s TYR 225 N -1.65 -0.15 0.13 0.00 1.13 -0.51 -0.08 117.35 116.22 2ajc s TYR 225 Ca 0.41 -0.18 0.09 0.00 -1.41 0.00 0.00 57.07 55.98 2ajc s TYR 225 Cb -0.12 0.31 -0.04 0.00 -1.10 0.00 0.00 41.96 41.00 2ajc s TYR 225 CO 0.23 -0.80 -0.19 0.00 -2.51 0.00 0.00 175.55 172.29 2ajc s ALA 226 N -3.84 2.66 -0.13 9.51 0.00 -0.87 -1.44 121.76 127.65 2ajc s ALA 226 Ca 0.06 -1.39 0.02 0.00 0.00 0.00 0.00 51.96 50.66 2ajc s ALA 226 Cb 0.01 -0.61 0.00 0.00 0.00 0.00 0.00 23.12 22.52 2ajc s ALA 226 CO -0.08 0.57 -0.21 -1.14 0.00 0.00 0.00 175.76 174.90 2ajc s GLN 227 N -2.21 3.07 -0.11 0.00 0.74 0.11 -1.68 119.66 119.59 2ajc s GLN 227 Ca 0.18 -0.84 -0.02 0.00 0.05 0.00 0.00 55.36 54.73 2ajc s GLN 227 Cb -0.10 -2.44 -0.03 0.00 1.10 0.00 0.00 33.01 31.54 2ajc s GLN 227 CO 0.10 0.05 -0.01 -0.06 -0.55 0.00 0.00 175.29 174.82 2ajc s PHE 228 N 0.67 3.12 -0.29 1.67 0.08 0.37 -1.69 117.98 121.91 2ajc s PHE 228 Ca -0.10 0.06 0.03 0.00 0.12 0.00 0.00 56.93 57.04 2ajc s PHE 228 Cb -0.16 -1.84 0.07 0.00 -0.57 0.00 0.00 43.02 40.52 2ajc s PHE 228 CO 0.01 0.32 -0.05 1.21 -0.10 0.00 0.00 175.22 176.61 2ajc s ASN 229 N -0.49 4.59 -0.05 1.36 3.84 -0.39 -0.93 114.94 122.86 2ajc s ASN 229 Ca 0.08 -1.62 0.16 0.00 0.21 0.00 0.00 52.86 51.69 2ajc s ASN 229 Cb -0.12 -1.59 0.56 0.00 -0.55 0.00 0.00 41.25 39.55 2ajc s ASN 229 CO 0.02 -0.26 1.45 0.47 -2.79 0.00 0.00 177.10 176.00 2ajc n ASP 230 N 4.39 3.63 -0.33 -4.21 9.92 0.55 -1.88 116.55 128.62 2ajc n ASP 230 Ca -0.09 -2.21 0.15 0.00 -0.53 0.00 0.00 54.79 52.12 2ajc n ASP 230 Cb 0.42 -0.47 0.31 0.00 -0.64 0.00 0.00 41.12 40.74 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 3.39 0.08 -0.41 -3.53 2.02 -1.85 -0.73 112.91 111.88 2ajc h THR 231 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.17 2ajc h THR 231 Cb 1.05 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 2ajc h THR 231 CO 0.11 0.01 0.00 -0.62 0.37 0.00 0.00 175.52 175.39 2ajc n GLU 232 N -5.42 2.49 -2.78 6.66 1.02 -1.26 -4.93 120.64 116.41 2ajc n GLU 232 Ca 0.24 -2.25 -0.42 0.00 -0.02 0.00 0.00 57.16 54.71 2ajc n GLU 232 Cb 0.78 -1.51 -0.03 0.00 -0.02 0.00 0.00 31.44 30.66 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 -1.47 4.86 0.75 2.62 1.01 -0.28 -4.67 120.40 123.21 2ajc s VAL 233 Ca 0.39 1.88 -0.14 0.00 0.00 0.00 0.00 61.98 64.11 2ajc s VAL 233 Cb 0.23 -4.24 0.05 0.00 0.00 0.00 0.00 36.38 32.42 2ajc s VAL 233 CO 0.32 0.08 1.18 -2.84 0.00 0.00 0.00 175.10 173.83 2ajc s PRO 234 N 1.66 2.09 -0.14 2.72 0.02 -1.26 -4.63 135.00 135.46 2ajc s PRO 234 Ca 0.46 1.65 -0.09 0.00 0.02 0.00 0.00 61.00 63.03 2ajc s PRO 234 Cb -0.18 -1.84 -0.05 0.00 0.02 0.00 0.00 34.50 32.45 2ajc s PRO 234 CO 0.19 -1.85 0.18 -0.51 -0.33 0.00 0.00 177.00 174.68 2ajc s LEU 235 N -5.34 4.33 0.04 -5.54 1.43 -1.26 -1.03 118.68 111.30 2ajc s LEU 235 Ca 0.72 0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 54.07 2ajc s LEU 235 Cb -0.26 -2.15 -0.06 0.00 0.03 0.00 0.00 46.19 43.74 2ajc s LEU 235 CO 0.47 0.30 0.55 -0.51 0.23 0.00 0.00 176.35 177.40 2ajc s ILE 236 N -0.47 4.83 -0.01 -0.59 1.10 -0.11 -4.88 121.20 121.07 2ajc s ILE 236 Ca 0.14 1.17 0.05 0.00 -0.51 0.00 0.00 60.65 61.50 2ajc s ILE 236 Cb -0.12 -3.88 -0.01 0.00 0.15 0.00 0.00 42.46 38.59 2ajc s ILE 236 CO 0.03 0.51 -0.15 -1.61 -2.11 0.00 0.00 174.94 171.62 2ajc s GLU 237 N -0.81 1.17 0.00 3.50 2.02 -1.26 -1.49 118.70 121.84 2ajc s GLU 237 Ca 0.29 -0.55 -0.26 0.00 0.02 0.00 0.00 54.97 54.48 2ajc s GLU 237 Cb -0.19 -1.14 0.06 0.00 0.10 0.00 0.00 34.13 32.96 2ajc s GLU 237 CO 0.18 0.31 0.58 1.52 0.02 0.00 0.00 175.26 177.86 2ajc s TYR 238 N -0.38 -0.52 0.38 1.61 1.13 -0.75 -4.98 117.35 113.85 2ajc s TYR 238 Ca 0.05 0.75 -0.25 0.00 -1.41 0.00 0.00 57.07 56.21 2ajc s TYR 238 Cb -0.06 0.36 -0.09 0.00 -1.10 0.00 0.00 41.96 41.08 2ajc s TYR 238 CO -0.00 -0.62 1.06 -1.12 -2.51 0.00 0.00 175.55 172.36 2ajc s SER 239 N -1.59 6.81 -0.10 -0.18 0.01 -1.26 -0.02 113.70 117.36 2ajc s SER 239 Ca -0.08 2.07 0.00 0.00 1.31 0.00 0.00 55.95 59.25 2ajc s SER 239 Cb -0.01 -2.59 0.02 0.00 0.21 0.00 0.00 66.02 63.65 2ajc s SER 239 CO 0.04 -0.45 -0.09 0.12 0.41 0.00 0.00 173.24 173.26 2ajc s PHE 240 N -1.59 1.53 -0.04 2.43 5.36 0.58 -4.71 117.98 121.54 2ajc s PHE 240 Ca 0.56 -0.73 0.13 0.00 -0.96 0.00 0.00 56.93 55.93 2ajc s PHE 240 Cb -0.23 -1.22 -0.16 0.00 -0.34 0.00 0.00 43.02 41.07 2ajc s PHE 240 CO 0.29 -0.47 0.97 1.88 -1.46 0.00 0.00 175.22 176.44 2ajc h TYR 241 N 7.88 0.00 -1.29 10.12 -1.99 -1.96 -0.17 116.97 129.55 2ajc h TYR 241 Ca -0.31 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.42 2ajc h TYR 241 Cb 1.14 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.87 2ajc h TYR 241 CO 0.48 0.81 0.00 0.45 -0.00 0.00 0.00 178.16 179.90 2ajc n SER 242 N -3.10 -3.88 -4.70 3.88 2.88 -1.26 -4.72 113.62 102.72 2ajc n SER 242 Ca -0.08 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.09 2ajc n SER 242 Cb 0.92 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.45 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 -2.35 1.66 -0.16 -3.46 -0.08 -1.26 -4.85 116.55 106.06 2ajc n ASP 243 Ca 0.00 0.79 0.28 0.00 -1.51 0.00 0.00 54.79 54.36 2ajc n ASP 243 Cb 0.00 -1.52 0.72 0.00 2.34 0.00 0.00 41.12 42.67 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 0.33 0.00 0.00 -0.67 4.81 -2.06 -0.66 114.58 116.33 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 1.34 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.72 2ajc h GLU 244 CO 0.52 0.00 -0.01 0.66 -0.73 0.00 0.00 179.01 179.45 2ajc h SER 245 N 0.00 0.00 -2.90 1.04 4.64 -1.93 -3.42 113.55 110.97 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 1.75 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.81 2ajc h SER 245 CO -0.00 0.01 1.13 -0.22 -0.87 0.00 0.00 176.83 176.88 2ajc s LEU 246 N -6.22 3.73 0.19 5.97 0.20 -0.26 -4.91 118.68 117.40 2ajc s LEU 246 Ca -0.00 1.33 -0.09 0.00 0.69 0.00 0.00 54.13 56.06 2ajc s LEU 246 Cb 0.10 -3.53 0.10 0.00 -0.43 0.00 0.00 46.19 42.43 2ajc s LEU 246 CO 0.52 -1.38 1.68 -0.61 -0.29 0.00 0.00 176.35 176.27 2ajc h GLN 247 N 11.07 1.11 -5.68 1.98 4.15 -1.89 -3.42 115.11 122.43 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 -0.13 -0.29 0.00 0.21 0.00 0.00 27.48 28.42 2ajc h GLN 247 CO 1.03 1.03 -0.82 0.71 -1.93 0.00 0.00 178.83 178.85 2ajc s TYR 248 N -5.17 2.65 0.76 3.99 1.51 -1.26 -5.12 117.35 114.71 2ajc s TYR 248 Ca -0.12 -0.66 -0.14 0.00 -1.01 0.00 0.00 57.07 55.15 2ajc s TYR 248 Cb 0.14 -1.72 0.06 0.00 -0.11 0.00 0.00 41.96 40.33 2ajc s TYR 248 CO 0.85 -0.18 1.17 -2.14 -1.11 0.00 0.00 175.55 174.14 2ajc s PRO 249 N 0.03 1.98 0.16 -1.71 0.02 -1.26 -5.03 135.00 129.19 2ajc s PRO 249 Ca -0.07 1.63 0.01 0.00 0.02 0.00 0.00 61.00 62.59 2ajc s PRO 249 Cb -0.15 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.50 2ajc s PRO 249 CO 0.05 -1.93 0.32 0.15 -0.33 0.00 0.00 177.00 175.26 2ajc s LYS 250 N -4.17 3.48 -0.23 5.54 3.01 -0.08 -4.92 119.74 122.37 2ajc s LYS 250 Ca 0.71 -0.46 -0.05 0.00 -1.01 0.00 0.00 55.97 55.16 2ajc s LYS 250 Cb -0.26 -2.92 -0.01 0.00 -1.01 0.00 0.00 37.83 33.62 2ajc s LYS 250 CO 0.48 0.49 -0.01 0.99 0.51 0.00 0.00 175.35 177.81 2ajc s THR 251 N -1.76 3.66 0.11 2.17 2.01 -1.26 -0.31 115.64 120.26 2ajc s THR 251 Ca 0.36 -0.40 -0.23 0.00 0.31 0.00 0.00 61.69 61.74 2ajc s THR 251 Cb -0.11 -2.68 -0.07 0.00 0.01 0.00 0.00 72.50 69.65 2ajc s THR 251 CO 0.28 0.40 0.69 -0.69 -0.69 0.00 0.00 174.62 174.62 2ajc s VAL 252 N 1.51 4.56 -0.07 3.82 1.01 0.97 -4.90 120.40 127.31 2ajc s VAL 252 Ca 0.06 1.50 0.01 0.00 0.00 0.00 0.00 61.98 63.55 2ajc s VAL 252 Cb -0.14 -4.04 0.02 0.00 0.00 0.00 0.00 36.38 32.21 2ajc s VAL 252 CO -0.01 0.51 -0.08 -0.13 0.00 0.00 0.00 175.10 175.39 2ajc s ARG 253 N -0.96 1.27 -0.03 2.72 0.52 -1.26 -1.81 118.95 119.39 2ajc s ARG 253 Ca 0.33 -0.23 0.02 0.00 -0.52 0.00 0.00 55.73 55.32 2ajc s ARG 253 Cb -0.21 -1.20 0.01 0.00 0.52 0.00 0.00 34.95 34.07 2ajc s ARG 253 CO 0.23 -0.09 -0.06 0.42 0.02 0.00 0.00 175.30 175.82 2ajc s ILE 254 N 1.03 0.59 -0.10 1.52 1.01 -0.55 -4.96 121.20 119.74 2ajc s ILE 254 Ca -0.09 -0.20 -0.30 0.00 0.00 0.00 0.00 60.65 60.06 2ajc s ILE 254 Cb -0.14 -0.57 -0.04 0.00 0.01 0.00 0.00 42.46 41.72 2ajc s ILE 254 CO -0.00 0.22 1.48 -2.84 0.00 0.00 0.00 174.94 173.79 2ajc s PRO 255 N 0.57 4.21 -0.16 2.79 0.02 -1.26 -0.93 135.00 140.23 2ajc s PRO 255 Ca -0.08 1.96 -0.04 0.00 0.02 0.00 0.00 61.00 62.86 2ajc s PRO 255 Cb -0.11 -3.88 0.07 0.00 0.02 0.00 0.00 34.50 30.60 2ajc s PRO 255 CO 0.00 -0.78 0.19 -0.47 -0.33 0.00 0.00 177.00 175.62 2ajc s TYR 256 N 3.74 -0.19 -0.29 6.54 6.14 -0.20 -4.56 117.35 128.53 2ajc s TYR 256 Ca 0.65 0.33 -0.25 0.00 0.64 0.00 0.00 57.07 58.44 2ajc s TYR 256 Cb -0.28 -0.35 0.00 0.00 0.42 0.00 0.00 41.96 41.75 2ajc s TYR 256 CO 0.23 -0.47 0.86 -1.25 0.64 0.00 0.00 175.55 175.56 2ajc s PRO 257 N 2.30 4.05 0.83 4.97 0.04 -1.26 -4.51 135.00 141.41 2ajc s PRO 257 Ca 0.05 0.79 -0.10 0.00 0.04 0.00 0.00 61.00 61.78 2ajc s PRO 257 Cb -0.14 -3.71 0.13 0.00 0.04 0.00 0.00 34.50 30.82 2ajc s PRO 257 CO -0.09 -0.68 1.16 0.15 0.04 0.00 0.00 177.00 177.58 2ajc s LYS 258 N 3.06 1.44 0.07 4.56 1.02 -1.26 -0.28 119.74 128.35 2ajc s LYS 258 Ca 0.36 -0.41 -0.36 0.00 0.02 0.00 0.00 55.97 55.58 2ajc s LYS 258 Cb -0.14 -2.03 -0.15 0.00 -0.52 0.00 0.00 37.83 34.98 2ajc s LYS 258 CO 0.11 -1.81 1.49 0.00 -0.92 0.00 0.00 175.35 174.23 2ajc n ALA 259 N -3.31 0.03 -0.36 5.17 0.00 -0.32 -0.98 120.51 120.73 2ajc n ALA 259 Ca 0.12 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.03 2ajc n ALA 259 Cb 0.60 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 3.10 2.27 3.90 0.00 0.00 -1.26 -4.88 105.19 108.31 2ajc n GLY 260 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.36 2.76 0.24 4.61 0.00 -0.15 -4.99 121.76 120.86 2ajc s ALA 261 Ca 0.00 -0.60 -0.31 0.00 0.00 0.00 0.00 51.96 51.05 2ajc s ALA 261 Cb 0.00 -2.94 -0.11 0.00 0.00 0.00 0.00 23.12 20.07 2ajc s ALA 261 CO 0.00 -1.51 1.63 -2.00 0.00 0.00 0.00 175.76 173.88 2ajc s GLU 262 N -5.49 4.15 0.33 0.00 2.56 -1.26 -4.89 118.70 114.10 2ajc s GLU 262 Ca 0.61 2.53 0.06 0.00 0.00 0.00 0.00 54.97 58.17 2ajc s GLU 262 Cb -0.11 -3.07 -0.01 0.00 2.00 0.00 0.00 34.13 32.94 2ajc s GLU 262 CO 0.49 -0.66 0.47 -0.80 -0.56 0.00 0.00 175.26 174.20 2ajc s ASN 263 N 0.86 6.01 0.67 -1.70 0.01 -1.26 -4.45 114.94 115.08 2ajc s ASN 263 Ca 0.69 -0.10 -0.13 0.00 -0.71 0.00 0.00 52.86 52.60 2ajc s ASN 263 Cb -0.47 -1.36 0.01 0.00 0.41 0.00 0.00 41.25 39.83 2ajc s ASN 263 CO 0.39 -0.40 1.08 -2.16 -1.51 0.00 0.00 177.10 174.50 2ajc s PRO 264 N -4.18 2.83 0.26 -0.60 0.04 -1.26 -4.73 135.00 127.35 2ajc s PRO 264 Ca 0.44 1.22 0.08 0.00 0.04 0.00 0.00 61.00 62.77 2ajc s PRO 264 Cb -0.09 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 2ajc s PRO 264 CO 0.31 -1.20 0.12 0.95 0.04 0.00 0.00 177.00 177.22 2ajc s THR 265 N -2.62 4.01 0.07 1.26 -4.23 -0.79 -4.92 115.64 108.42 2ajc s THR 265 Ca 0.63 -1.61 0.04 0.00 -1.18 0.00 0.00 61.69 59.58 2ajc s THR 265 Cb -0.17 -3.17 -0.03 0.00 1.34 0.00 0.00 72.50 70.47 2ajc s THR 265 CO 0.46 -0.35 -0.12 0.54 -0.54 0.00 0.00 174.62 174.60 2ajc s VAL 266 N -2.22 0.97 -0.02 2.29 0.11 -1.26 -1.26 120.40 119.01 2ajc s VAL 266 Ca 0.33 -1.29 0.02 0.00 -2.93 0.00 0.00 61.98 58.11 2ajc s VAL 266 Cb -0.07 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.79 2ajc s VAL 266 CO 0.23 -0.29 -0.07 -0.54 -3.33 0.00 0.00 175.10 171.10 2ajc s LYS 267 N -1.80 0.68 -0.13 1.54 1.02 -0.68 -4.98 119.74 115.39 2ajc s LYS 267 Ca -0.03 -0.22 0.01 0.00 0.02 0.00 0.00 55.97 55.75 2ajc s LYS 267 Cb -0.09 -0.67 -0.01 0.00 -0.52 0.00 0.00 37.83 36.54 2ajc s LYS 267 CO 0.02 0.08 -0.15 0.12 -0.92 0.00 0.00 175.35 174.50 2ajc s PHE 268 N 0.18 2.77 0.13 3.18 5.36 -1.26 -0.71 117.98 127.63 2ajc s PHE 268 Ca -0.02 -0.77 0.07 0.00 -0.96 0.00 0.00 56.93 55.25 2ajc s PHE 268 Cb -0.07 -1.83 -0.04 0.00 -0.34 0.00 0.00 43.02 40.74 2ajc s PHE 268 CO -0.00 -0.29 -0.16 -0.06 -1.46 0.00 0.00 175.22 173.25 2ajc s PHE 269 N 0.43 1.56 -0.16 10.12 0.40 -0.52 -1.00 117.98 128.81 2ajc s PHE 269 Ca -0.11 -0.51 0.00 0.00 -0.60 0.00 0.00 56.93 55.71 2ajc s PHE 269 Cb -0.16 -0.81 0.03 0.00 0.51 0.00 0.00 43.02 42.58 2ajc s PHE 269 CO 0.05 0.20 -0.14 0.08 0.70 0.00 0.00 175.22 176.12 2ajc s VAL 270 N -1.95 1.61 -0.13 -0.44 1.01 0.09 -1.43 120.40 119.17 2ajc s VAL 270 Ca 0.10 -0.73 -0.12 0.00 0.00 0.00 0.00 61.98 61.24 2ajc s VAL 270 Cb -0.06 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 2ajc s VAL 270 CO 0.04 0.40 0.26 -0.69 0.00 0.00 0.00 175.10 175.11 2ajc s VAL 271 N 1.46 5.32 -0.49 2.92 1.01 0.50 -1.23 120.40 129.88 2ajc s VAL 271 Ca 0.04 0.47 -0.20 0.00 0.00 0.00 0.00 61.98 62.29 2ajc s VAL 271 Cb -0.14 -3.57 0.05 0.00 0.00 0.00 0.00 36.38 32.72 2ajc s VAL 271 CO -0.10 0.49 0.64 -0.62 0.00 0.00 0.00 175.10 175.50 2ajc s ASP 272 N -0.20 6.25 0.00 3.32 3.68 -0.08 -0.95 116.67 128.69 2ajc s ASP 272 Ca 0.16 -0.72 0.25 0.00 2.13 0.00 0.00 52.55 54.37 2ajc s ASP 272 Cb -0.13 -2.30 1.14 0.00 -1.45 0.00 0.00 42.92 40.18 2ajc s ASP 272 CO 0.05 -0.87 1.81 0.35 0.13 0.00 0.00 175.17 176.64 2ajc n THR 273 N 5.70 0.26 0.25 1.71 -2.24 -0.53 -3.59 114.28 115.84 2ajc n THR 273 Ca -0.05 0.07 0.11 0.00 -2.27 0.00 0.00 64.05 61.91 2ajc n THR 273 Cb 0.46 -0.65 0.65 0.00 -2.10 0.00 0.00 70.33 68.70 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 -0.13 -0.78 3.08 -1.91 -2.89 114.38 111.75 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 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 2ajc h ARG 274 CO 0.00 0.16 0.00 0.25 -1.07 0.00 0.00 179.97 179.31 2ajc n THR 275 N -3.71 0.14 -1.67 2.04 -2.24 -1.24 -4.95 114.28 102.65 2ajc n THR 275 Ca -0.02 -0.57 -0.43 0.00 -2.27 0.00 0.00 64.05 60.77 2ajc n THR 275 Cb 0.27 1.35 -0.03 0.00 -2.10 0.00 0.00 70.33 69.82 2ajc n THR 275 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2ajc n LEU 276 N 1.38 4.06 -3.58 3.22 4.77 -1.09 -4.81 117.00 120.95 2ajc n LEU 276 Ca 0.16 0.94 -0.16 0.00 -0.03 0.00 0.00 56.01 56.92 2ajc n LEU 276 Cb 0.60 -1.52 -0.06 0.00 -2.33 0.00 0.00 43.42 40.11 2ajc n LEU 276 CO 0.15 0.17 0.32 -0.55 -1.33 0.00 0.00 177.39 176.15 2ajc s SER 277 N 3.74 -0.51 0.50 -1.43 0.15 -1.26 -5.03 113.70 109.86 2ajc s SER 277 Ca 0.87 0.45 0.16 0.00 0.70 0.00 0.00 55.95 58.13 2ajc s SER 277 Cb -0.47 0.49 1.23 0.00 -1.71 0.00 0.00 66.02 65.55 2ajc s SER 277 CO 0.41 -0.61 2.10 1.55 1.20 0.00 0.00 173.24 177.89 2ajc h PRO 278 N 3.10 0.09 -0.69 5.44 0.13 -1.99 -1.88 132.00 136.20 2ajc h PRO 278 Ca -0.29 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2ajc h PRO 278 Cb 1.17 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2ajc h PRO 278 CO 0.40 0.06 0.00 0.09 -0.23 0.00 0.00 178.00 178.32 2ajc n ASN 279 N -4.50 4.32 -4.64 1.44 3.02 -1.26 -4.92 115.26 108.72 2ajc n ASN 279 Ca 0.01 -2.23 -0.30 0.00 -0.03 0.00 0.00 54.58 52.03 2ajc n ASN 279 Cb 0.20 -0.53 -0.09 0.00 -0.61 0.00 0.00 39.78 38.75 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 -1.46 3.14 1.07 5.41 0.00 -0.71 -5.13 121.76 124.08 2ajc s ALA 280 Ca 0.50 -1.16 -0.17 0.00 0.00 0.00 0.00 51.96 51.13 2ajc s ALA 280 Cb 0.29 -1.07 0.24 0.00 0.00 0.00 0.00 23.12 22.58 2ajc s ALA 280 CO 0.29 0.67 1.20 -1.13 0.00 0.00 0.00 175.76 176.79 2ajc n SER 281 N 0.70 -0.51 -4.74 0.00 3.41 -1.26 -4.60 113.62 106.62 2ajc n SER 281 Ca -0.12 -1.37 -0.36 0.00 -0.26 0.00 0.00 58.87 56.76 2ajc n SER 281 Cb 0.52 -0.96 -0.07 0.00 -0.26 0.00 0.00 64.21 63.44 2ajc n SER 281 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2ajc s VAL 282 N -3.52 5.33 -0.40 -3.33 1.01 -1.26 -4.77 120.40 113.46 2ajc s VAL 282 Ca 0.70 0.46 -0.19 0.00 0.00 0.00 0.00 61.98 62.95 2ajc s VAL 282 Cb -0.03 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 32.78 2ajc s VAL 282 CO 0.51 0.43 0.53 -0.89 0.00 0.00 0.00 175.10 175.68 2ajc s THR 283 N 0.25 4.97 0.08 3.92 2.01 -1.26 -5.02 115.64 120.59 2ajc s THR 283 Ca 0.15 0.05 -0.09 0.00 0.31 0.00 0.00 61.69 62.11 2ajc s THR 283 Cb -0.13 -4.07 -0.00 0.00 0.01 0.00 0.00 72.50 68.31 2ajc s THR 283 CO 0.03 -0.41 0.19 -0.94 -0.69 0.00 0.00 174.62 172.80 2ajc s SER 284 N 1.86 0.11 -0.04 3.53 1.04 -1.26 -0.90 113.70 118.03 2ajc s SER 284 Ca 0.18 -0.59 0.02 0.00 0.48 0.00 0.00 55.95 56.04 2ajc s SER 284 Cb -0.15 0.32 0.01 0.00 0.10 0.00 0.00 66.02 66.30 2ajc s SER 284 CO 0.15 -0.68 -0.08 -0.47 0.98 0.00 0.00 173.24 173.14 2ajc s TYR 285 N -3.53 0.97 -0.21 5.02 5.04 -0.37 -4.93 117.35 119.34 2ajc s TYR 285 Ca 0.02 -0.27 -0.16 0.00 -2.44 0.00 0.00 57.07 54.23 2ajc s TYR 285 Cb 0.03 -0.73 -0.04 0.00 0.35 0.00 0.00 41.96 41.58 2ajc s TYR 285 CO -0.09 -0.14 0.40 -1.14 -1.34 0.00 0.00 175.55 173.23 2ajc s GLN 286 N 0.42 4.14 -0.25 4.97 0.74 -1.26 -0.73 119.66 127.69 2ajc s GLN 286 Ca -0.07 0.18 -0.10 0.00 0.05 0.00 0.00 55.36 55.42 2ajc s GLN 286 Cb -0.11 -3.56 -0.05 0.00 1.10 0.00 0.00 33.01 30.40 2ajc s GLN 286 CO 0.01 -0.09 0.15 0.42 -0.55 0.00 0.00 175.29 175.23 2ajc s ILE 287 N 1.47 5.11 0.27 -2.34 1.01 -0.17 -5.01 121.20 121.56 2ajc s ILE 287 Ca 0.18 0.10 0.04 0.00 0.00 0.00 0.00 60.65 60.97 2ajc s ILE 287 Cb -0.15 -3.40 -0.03 0.00 0.01 0.00 0.00 42.46 38.89 2ajc s ILE 287 CO 0.08 0.31 0.42 0.68 0.00 0.00 0.00 174.94 176.43 2ajc s VAL 288 N 1.42 5.20 0.78 2.92 -7.23 -1.26 -4.18 120.40 118.05 2ajc s VAL 288 Ca 0.07 -0.83 -0.11 0.00 -1.81 0.00 0.00 61.98 59.30 2ajc s VAL 288 Cb -0.15 -3.86 0.06 0.00 0.56 0.00 0.00 36.38 32.99 2ajc s VAL 288 CO 0.07 -0.40 1.09 -2.16 -0.31 0.00 0.00 175.10 173.39 2ajc s PRO 289 N -4.09 2.21 0.78 4.82 0.04 -1.26 -4.98 135.00 132.52 2ajc s PRO 289 Ca 0.36 0.79 -0.15 0.00 0.04 0.00 0.00 61.00 62.04 2ajc s PRO 289 Cb -0.09 -1.92 0.03 0.00 0.04 0.00 0.00 34.50 32.56 2ajc s PRO 289 CO 0.31 -1.57 0.96 -2.30 0.04 0.00 0.00 177.00 174.45 2ajc n PRO 290 N -3.42 0.28 -0.34 0.56 -0.02 -1.26 -4.40 135.00 126.40 2ajc n PRO 290 Ca 0.07 0.16 0.18 0.00 -2.02 0.00 0.00 63.50 61.89 2ajc n PRO 290 Cb 0.55 -2.23 0.39 0.00 -0.02 0.00 0.00 33.50 32.18 2ajc n PRO 290 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ajc h ALA 291 N -0.64 1.78 0.00 3.55 0.00 -1.97 -0.01 119.26 121.97 2ajc h ALA 291 Ca -0.46 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2ajc h ALA 291 Cb 1.32 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2ajc h ALA 291 CO 0.45 -0.28 0.00 -1.13 0.00 0.00 0.00 179.25 178.29 2ajc n SER 292 N -4.90 0.15 -0.03 0.00 3.41 -1.26 -2.32 113.62 108.67 2ajc n SER 292 Ca 0.27 0.55 -0.04 0.00 -0.26 0.00 0.00 58.87 59.39 2ajc n SER 292 Cb 0.75 -0.58 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 2ajc n SER 292 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2ajc n VAL 293 N -1.68 0.31 0.31 -3.33 0.31 -0.32 -4.56 118.33 109.36 2ajc n VAL 293 Ca 0.02 -0.12 0.18 0.00 -0.01 0.00 0.00 64.34 64.41 2ajc n VAL 293 Cb 0.11 -0.70 0.96 0.00 -0.91 0.00 0.00 33.84 33.30 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 -2.59 7.52 6.46 -0.97 -2.29 115.31 123.44 2ajc h LEU 294 Ca -0.12 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.64 2ajc h LEU 294 Cb 1.19 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.12 2ajc h LEU 294 CO -0.02 0.00 -0.01 -0.29 -0.62 0.00 0.00 178.44 177.50 2ajc h ILE 295 N 0.00 0.10 -2.39 4.05 2.10 -1.70 -3.46 117.51 116.21 2ajc h ILE 295 Ca 0.02 -0.13 -0.04 0.00 1.08 0.00 0.00 64.86 65.78 2ajc h ILE 295 Cb 0.41 1.12 -0.01 0.00 -1.09 0.00 0.00 36.82 37.25 2ajc h ILE 295 CO -0.00 0.01 0.00 0.61 -1.08 0.00 0.00 178.15 177.69 2ajc n GLY 296 N -0.88 2.44 3.67 8.18 0.00 -0.86 -5.13 105.19 112.62 2ajc n GLY 296 Ca -0.02 -1.29 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 2ajc n GLY 296 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ajc n ASP 297 N -1.66 2.40 -3.27 1.61 9.92 -1.26 -4.91 116.55 119.38 2ajc n ASP 297 Ca -0.01 1.20 -0.13 0.00 -0.53 0.00 0.00 54.79 55.32 2ajc n ASP 297 Cb 0.14 -1.43 -0.03 0.00 -0.64 0.00 0.00 41.12 39.16 2ajc n ASP 297 CO 0.00 0.00 0.00 -1.38 0.13 0.00 0.00 177.20 175.95 2ajc s HIS 298 N -1.05 0.81 0.04 1.24 -3.43 -1.26 -1.70 115.29 109.94 2ajc s HIS 298 Ca 0.57 -1.14 0.02 0.00 -0.80 0.00 0.00 55.06 53.71 2ajc s HIS 298 Cb -0.60 0.12 -0.02 0.00 -1.43 0.00 0.00 32.58 30.64 2ajc s HIS 298 CO 0.61 -1.20 -0.08 0.71 -2.00 0.00 0.00 174.74 172.78 2ajc s TYR 299 N -3.03 0.71 -0.21 0.38 2.02 -0.05 -4.80 117.35 112.37 2ajc s TYR 299 Ca 0.27 -0.42 -0.18 0.00 -0.37 0.00 0.00 57.07 56.38 2ajc s TYR 299 Cb -0.01 -0.43 -0.03 0.00 -0.40 0.00 0.00 41.96 41.09 2ajc s TYR 299 CO 0.17 -0.05 0.48 -1.17 -1.57 0.00 0.00 175.55 173.41 2ajc s LEU 300 N -1.31 4.13 0.00 -1.29 2.96 -1.26 -1.58 118.68 120.33 2ajc s LEU 300 Ca -0.07 0.60 0.01 0.00 -0.22 0.00 0.00 54.13 54.45 2ajc s LEU 300 Cb -0.08 -2.64 -0.01 0.00 0.50 0.00 0.00 46.19 43.96 2ajc s LEU 300 CO 0.00 -0.16 0.16 0.00 -1.32 0.00 0.00 176.35 175.03 2ajc s GLY 302 N -0.86 -0.43 -0.04 0.00 0.00 -0.81 -4.86 107.32 100.33 2ajc s GLY 302 Ca 0.01 1.28 -0.01 0.00 0.00 0.00 0.00 44.72 45.99 2ajc s GLY 302 CO 0.03 1.01 0.05 0.14 0.00 0.00 0.00 173.10 174.33 2ajc s VAL 303 N -0.51 -0.08 -0.12 1.40 1.01 -1.26 -1.09 120.40 119.75 2ajc s VAL 303 Ca -0.06 0.36 -0.02 0.00 0.00 0.00 0.00 61.98 62.25 2ajc s VAL 303 Cb -0.03 -0.15 0.04 0.00 0.00 0.00 0.00 36.38 36.25 2ajc s VAL 303 CO 0.05 0.16 0.02 -0.89 0.00 0.00 0.00 175.10 174.43 2ajc s THR 304 N 1.85 0.38 0.16 3.92 2.01 0.49 -5.00 115.64 119.46 2ajc s THR 304 Ca 0.01 -0.12 -0.30 0.00 0.31 0.00 0.00 61.69 61.59 2ajc s THR 304 Cb -0.12 -0.69 -0.08 0.00 0.01 0.00 0.00 72.50 71.62 2ajc s THR 304 CO -0.03 0.07 1.21 0.26 -0.69 0.00 0.00 174.62 175.43 2ajc s TRP 305 N 1.95 3.42 -0.23 4.92 0.52 -1.26 0.23 118.94 128.48 2ajc s TRP 305 Ca 0.03 1.38 -0.16 0.00 0.02 0.00 0.00 56.10 57.37 2ajc s TRP 305 Cb -0.14 -3.44 -0.09 0.00 -1.15 0.00 0.00 33.47 28.64 2ajc s TRP 305 CO -0.06 -1.28 -0.35 0.28 0.02 0.00 0.00 176.95 175.55 2ajc n VAL 306 N 2.83 1.51 -4.21 4.03 0.31 0.22 -4.89 118.33 118.14 2ajc n VAL 306 Ca 0.06 -0.15 -0.15 0.00 -0.01 0.00 0.00 64.34 64.09 2ajc n VAL 306 Cb 0.45 -2.09 -0.06 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 -4.34 0.00 0.30 2.52 -2.24 -0.95 -4.79 114.28 104.78 2ajc n THR 307 Ca -0.37 -1.83 0.15 0.00 -2.27 0.00 0.00 64.05 59.74 2ajc n THR 307 Cb 0.72 0.92 0.71 0.00 -2.10 0.00 0.00 70.33 70.59 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 -2.84 114.58 113.37 2ajc h GLU 308 Ca -0.18 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.52 2ajc h GLU 308 Cb 0.91 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.56 2ajc h GLU 308 CO 0.26 0.00 -0.04 0.39 -1.16 0.00 0.00 179.01 178.46 2ajc n GLU 309 N -2.61 1.77 -3.74 2.33 1.02 -1.26 -4.92 120.64 113.22 2ajc n GLU 309 Ca -0.00 -1.88 -0.15 0.00 -0.02 0.00 0.00 57.16 55.11 2ajc n GLU 309 Cb 0.16 -1.15 -0.16 0.00 -0.02 0.00 0.00 31.44 30.27 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 -1.70 0.00 0.04 3.49 3.52 -1.07 -0.94 118.95 122.28 2ajc s ARG 310 Ca 0.14 0.30 0.05 0.00 -0.13 0.00 0.00 55.73 56.10 2ajc s ARG 310 Cb 0.13 -0.26 -0.02 0.00 -1.56 0.00 0.00 34.95 33.23 2ajc s ARG 310 CO 0.01 -0.20 -0.16 -1.50 -0.81 0.00 0.00 175.30 172.65 2ajc s ILE 311 N 1.35 1.24 -0.20 4.11 2.07 -0.66 -0.61 121.20 128.50 2ajc s ILE 311 Ca -0.06 -1.02 -0.03 0.00 -1.41 0.00 0.00 60.65 58.12 2ajc s ILE 311 Cb -0.12 -1.10 -0.01 0.00 0.13 0.00 0.00 42.46 41.35 2ajc s ILE 311 CO -0.04 0.07 -0.05 -0.55 -1.91 0.00 0.00 174.94 172.46 2ajc s SER 312 N -1.09 4.37 -0.09 4.50 0.15 0.14 -1.58 113.70 120.10 2ajc s SER 312 Ca 0.03 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.35 2ajc s SER 312 Cb -0.08 -1.74 -0.03 0.00 -1.71 0.00 0.00 66.02 62.47 2ajc s SER 312 CO 0.01 0.03 -0.07 -0.76 1.20 0.00 0.00 173.24 173.65 2ajc s LEU 313 N 1.17 3.10 -0.14 3.45 1.43 -0.45 -0.38 118.68 126.86 2ajc s LEU 313 Ca 0.02 -0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.06 2ajc s LEU 313 Cb -0.14 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.39 2ajc s LEU 313 CO -0.01 0.30 -0.21 -1.58 0.23 0.00 0.00 176.35 175.08 2ajc s GLN 314 N -0.44 3.04 0.28 1.70 0.74 -0.25 -0.13 119.66 124.61 2ajc s GLN 314 Ca 0.06 -0.84 0.12 0.00 0.05 0.00 0.00 55.36 54.75 2ajc s GLN 314 Cb -0.12 -2.45 -0.05 0.00 1.10 0.00 0.00 33.01 31.49 2ajc s GLN 314 CO 0.02 -0.01 -0.20 -1.58 -0.55 0.00 0.00 175.29 172.98 2ajc s TRP 315 N 0.80 2.28 -0.07 1.67 0.52 -0.13 -0.58 118.94 123.44 2ajc s TRP 315 Ca -0.07 -0.34 -0.09 0.00 0.02 0.00 0.00 56.10 55.62 2ajc s TRP 315 Cb -0.16 -1.00 0.02 0.00 -1.15 0.00 0.00 33.47 31.19 2ajc s TRP 315 CO -0.01 0.71 0.23 -1.50 0.02 0.00 0.00 176.95 176.39 2ajc s ILE 316 N -2.53 0.02 0.75 2.03 2.07 -0.62 -0.93 121.20 122.00 2ajc s ILE 316 Ca 0.30 -0.15 -0.11 0.00 -1.41 0.00 0.00 60.65 59.28 2ajc s ILE 316 Cb -0.05 -0.38 0.05 0.00 0.13 0.00 0.00 42.46 42.21 2ajc s ILE 316 CO 0.15 -0.08 1.09 -0.13 -1.91 0.00 0.00 174.94 174.05 2ajc s ARG 317 N -0.24 2.40 0.27 3.50 0.52 -0.63 -0.87 118.95 123.88 2ajc s ARG 317 Ca -0.04 1.16 -0.01 0.00 -0.52 0.00 0.00 55.73 56.32 2ajc s ARG 317 Cb -0.03 -1.91 0.49 0.00 0.52 0.00 0.00 34.95 34.01 2ajc s ARG 317 CO 0.01 -1.53 1.82 -0.09 0.02 0.00 0.00 175.30 175.53 2ajc h ARG 318 N -0.98 0.87 0.00 3.54 2.43 -1.64 0.45 114.38 119.06 2ajc h ARG 318 Ca -0.44 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 2ajc h ARG 318 Cb 1.23 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 2ajc h ARG 318 CO 0.52 0.57 0.00 0.00 -1.51 0.00 0.00 179.97 179.56 2ajc h ALA 319 N 1.50 1.00 -2.55 2.80 0.00 -1.92 -3.45 119.26 116.65 2ajc h ALA 319 Ca 0.45 0.00 -0.42 0.00 0.00 0.00 0.00 54.91 54.94 2ajc h ALA 319 Cb 0.44 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 2ajc h ALA 319 CO -0.26 0.00 -0.51 1.04 0.00 0.00 0.00 179.25 179.52 2ajc n GLN 320 N -2.85 -1.63 -0.01 0.00 6.02 0.15 -4.68 117.38 114.37 2ajc n GLN 320 Ca -0.02 1.07 0.00 0.00 -0.01 0.00 0.00 57.00 58.04 2ajc n GLN 320 Cb 0.08 -5.67 0.01 0.00 1.02 0.00 0.00 30.24 25.68 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 -1.88 2.05 -3.64 1.08 0.23 -1.26 -1.74 115.26 110.10 2ajc n ASN 321 Ca -0.24 -1.98 -0.17 0.00 -0.53 0.00 0.00 54.58 51.67 2ajc n ASN 321 Cb 0.69 -0.02 -0.15 0.00 -2.08 0.00 0.00 39.78 38.22 2ajc n ASN 321 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 2ajc s TYR 322 N -0.98 -0.23 0.16 -2.53 6.14 -1.26 -1.13 117.35 117.52 2ajc s TYR 322 Ca 0.02 0.61 0.05 0.00 0.64 0.00 0.00 57.07 58.38 2ajc s TYR 322 Cb 0.01 -0.24 -0.04 0.00 0.42 0.00 0.00 41.96 42.10 2ajc s TYR 322 CO 0.01 -0.34 -0.10 -1.54 0.64 0.00 0.00 175.55 174.23 2ajc s SER 323 N 2.32 1.87 -0.11 4.32 1.04 0.35 -1.61 113.70 121.89 2ajc s SER 323 Ca 0.03 -1.03 -0.11 0.00 0.48 0.00 0.00 55.95 55.33 2ajc s SER 323 Cb -0.13 -0.02 0.03 0.00 0.10 0.00 0.00 66.02 66.00 2ajc s SER 323 CO -0.07 -0.33 0.31 -0.51 0.98 0.00 0.00 173.24 173.62 2ajc s ILE 324 N -3.30 0.01 -0.15 -1.02 2.07 -0.10 -1.17 121.20 117.53 2ajc s ILE 324 Ca 0.18 -0.05 -0.07 0.00 -1.41 0.00 0.00 60.65 59.30 2ajc s ILE 324 Cb 0.02 -0.45 -0.04 0.00 0.13 0.00 0.00 42.46 42.12 2ajc s ILE 324 CO 0.02 -0.03 0.08 -0.63 -1.91 0.00 0.00 174.94 172.47 2ajc s ILE 325 N 0.02 4.94 -0.20 2.00 1.01 -0.16 -0.95 121.20 127.86 2ajc s ILE 325 Ca -0.01 0.01 0.01 0.00 0.00 0.00 0.00 60.65 60.65 2ajc s ILE 325 Cb -0.02 -3.19 0.05 0.00 0.01 0.00 0.00 42.46 39.30 2ajc s ILE 325 CO 0.01 0.52 -0.09 -0.62 0.00 0.00 0.00 174.94 174.76 2ajc s ASP 326 N -0.15 3.39 -0.45 3.58 2.15 0.82 -1.44 116.67 124.57 2ajc s ASP 326 Ca 0.08 -0.90 -0.15 0.00 0.43 0.00 0.00 52.55 52.00 2ajc s ASP 326 Cb -0.12 -1.18 0.06 0.00 -0.30 0.00 0.00 42.92 41.38 2ajc s ASP 326 CO 0.01 -0.17 0.37 -0.63 -0.17 0.00 0.00 175.17 174.59 2ajc s ILE 327 N 1.43 5.23 -0.13 4.11 1.01 -1.11 -1.34 121.20 130.40 2ajc s ILE 327 Ca -0.02 -0.93 -0.08 0.00 0.00 0.00 0.00 60.65 59.62 2ajc s ILE 327 Cb -0.17 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 2ajc s ILE 327 CO -0.08 -0.51 0.15 0.00 0.00 0.00 0.00 174.94 174.51 2ajc s ASP 329 N -0.71 4.43 0.14 0.00 1.01 0.49 -1.65 116.67 120.38 2ajc s ASP 329 Ca 0.14 -0.13 -0.31 0.00 0.71 0.00 0.00 52.55 52.95 2ajc s ASP 329 Cb -0.12 -1.30 -0.08 0.00 1.01 0.00 0.00 42.92 42.43 2ajc s ASP 329 CO 0.03 0.29 1.41 -0.47 0.21 0.00 0.00 175.17 176.64 2ajc s TYR 330 N -0.36 3.21 -0.49 4.23 5.04 -0.12 -0.21 117.35 128.66 2ajc s TYR 330 Ca 0.05 0.94 -0.15 0.00 -2.44 0.00 0.00 57.07 55.46 2ajc s TYR 330 Cb -0.12 -3.72 0.09 0.00 0.35 0.00 0.00 41.96 38.56 2ajc s TYR 330 CO 0.02 -2.49 0.42 0.34 -1.34 0.00 0.00 175.55 172.50 2ajc s ASP 331 N 0.98 6.14 0.54 4.32 -1.08 0.77 -4.93 116.67 123.41 2ajc s ASP 331 Ca 0.64 -1.46 0.26 0.00 -0.52 0.00 0.00 52.55 51.47 2ajc s ASP 331 Cb -0.38 -2.18 1.43 0.00 -1.46 0.00 0.00 42.92 40.33 2ajc s ASP 331 CO 0.32 -0.70 2.00 -0.33 0.52 0.00 0.00 175.17 176.98 2ajc h GLU 332 N 8.78 0.00 0.00 4.34 5.08 -1.94 0.20 114.58 131.04 2ajc h GLU 332 Ca -0.29 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.05 2ajc h GLU 332 Cb 1.11 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 2ajc h GLU 332 CO 0.92 0.00 -0.22 0.66 -1.00 0.00 0.00 179.01 179.37 2ajc h SER 333 N 0.00 0.00 0.00 1.42 4.64 -1.97 -3.37 113.55 114.28 2ajc h SER 333 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2ajc h SER 333 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2ajc h SER 333 CO -0.00 0.10 0.00 0.35 -0.87 0.00 0.00 176.83 176.40 2ajc n THR 334 N -3.07 0.00 -0.95 2.95 -2.24 -0.88 -5.01 114.28 105.07 2ajc n THR 334 Ca 0.03 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 2ajc n THR 334 Cb 0.57 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.82 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 0.74 0.83 3.86 3.38 0.00 0.66 -5.02 105.19 109.65 2ajc n GLY 335 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2ajc n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ajc s ARG 336 N -0.13 3.41 -0.22 1.61 0.52 -1.24 -4.79 118.95 118.10 2ajc s ARG 336 Ca 0.00 0.76 -0.03 0.00 -0.52 0.00 0.00 55.73 55.93 2ajc s ARG 336 Cb 0.00 -2.06 -0.00 0.00 0.52 0.00 0.00 34.95 33.41 2ajc s ARG 336 CO 0.00 -0.71 -0.05 -1.58 0.02 0.00 0.00 175.30 172.98 2ajc s TRP 337 N -3.17 2.96 -0.12 -0.53 0.52 -1.26 -0.16 118.94 117.17 2ajc s TRP 337 Ca 0.56 -1.06 -0.03 0.00 0.02 0.00 0.00 56.10 55.58 2ajc s TRP 337 Cb -0.12 -2.09 -0.03 0.00 -1.15 0.00 0.00 33.47 30.08 2ajc s TRP 337 CO 0.54 -0.59 0.01 0.42 0.02 0.00 0.00 176.95 177.34 2ajc s ILE 338 N 1.45 4.32 0.23 2.03 1.01 0.71 -4.81 121.20 126.15 2ajc s ILE 338 Ca 0.05 -0.23 0.07 0.00 0.00 0.00 0.00 60.65 60.54 2ajc s ILE 338 Cb -0.14 -2.86 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 2ajc s ILE 338 CO -0.04 0.56 0.14 -0.94 0.00 0.00 0.00 174.94 174.66 2ajc s SER 339 N -0.40 5.34 -0.01 3.58 1.04 -1.26 -0.38 113.70 121.61 2ajc s SER 339 Ca 0.08 -0.29 -0.03 0.00 0.48 0.00 0.00 55.95 56.18 2ajc s SER 339 Cb -0.12 -1.31 -0.00 0.00 0.10 0.00 0.00 66.02 64.69 2ajc s SER 339 CO 0.02 -0.00 0.07 -0.94 0.98 0.00 0.00 173.24 173.36 2ajc s SER 340 N -3.62 0.04 0.44 7.02 1.04 -1.26 -5.03 113.70 112.33 2ajc s SER 340 Ca 0.32 -0.14 0.14 0.00 0.48 0.00 0.00 55.95 56.75 2ajc s SER 340 Cb -0.08 0.16 1.03 0.00 0.10 0.00 0.00 66.02 67.23 2ajc s SER 340 CO 0.24 -0.21 1.98 0.58 0.98 0.00 0.00 173.24 176.81 2ajc h VAL 341 N 4.69 0.90 0.00 5.02 2.07 -1.98 0.71 116.25 127.65 2ajc h VAL 341 Ca -0.29 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 2ajc h VAL 341 Cb 1.20 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2ajc h VAL 341 CO 0.43 0.07 -0.06 0.00 0.02 0.00 0.00 177.57 178.03 2ajc h ALA 342 N 1.70 1.18 -0.56 1.67 0.00 -1.95 -2.18 119.26 119.12 2ajc h ALA 342 Ca 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2ajc h ALA 342 Cb 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2ajc h ALA 342 CO -0.07 0.08 0.00 0.54 0.00 0.00 0.00 179.25 179.80 2ajc n ARG 343 N -3.43 4.20 -4.41 0.00 1.74 0.23 -3.81 116.66 111.19 2ajc n ARG 343 Ca -0.02 -3.00 -0.34 0.00 -0.77 0.00 0.00 57.85 53.72 2ajc n ARG 343 Cb 0.20 -2.06 -0.11 0.00 -1.02 0.00 0.00 32.46 29.48 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 3.21 -0.16 5.56 -0.21 -0.82 -2.75 119.66 122.09 2ajc s GLN 344 Ca 0.51 -0.46 -0.00 0.00 0.02 0.00 0.00 55.36 55.43 2ajc s GLN 344 Cb 0.37 -2.82 0.04 0.00 1.00 0.00 0.00 33.01 31.60 2ajc s GLN 344 CO 0.18 0.53 -0.07 -1.01 -2.12 0.00 0.00 175.29 172.81 2ajc s HIS 345 N -0.42 1.80 0.10 0.91 3.76 -0.52 -4.89 115.29 116.02 2ajc s HIS 345 Ca 0.07 -1.11 -0.16 0.00 -0.15 0.00 0.00 55.06 53.72 2ajc s HIS 345 Cb -0.12 -1.37 -0.07 0.00 1.11 0.00 0.00 32.58 32.14 2ajc s HIS 345 CO 0.02 -0.62 0.52 0.42 -0.85 0.00 0.00 174.74 174.23 2ajc s ILE 346 N 1.60 4.86 -0.04 0.60 1.01 -1.26 -0.99 121.20 126.98 2ajc s ILE 346 Ca 0.01 0.92 -0.01 0.00 0.00 0.00 0.00 60.65 61.58 2ajc s ILE 346 Cb -0.15 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 38.58 2ajc s ILE 346 CO -0.08 0.40 0.01 -0.70 0.00 0.00 0.00 174.94 174.57 2ajc s GLU 347 N -1.55 0.29 0.22 2.79 2.12 -0.31 -5.00 118.70 117.26 2ajc s GLU 347 Ca 0.32 0.15 0.04 0.00 0.36 0.00 0.00 54.97 55.84 2ajc s GLU 347 Cb -0.17 -0.62 -0.05 0.00 0.26 0.00 0.00 34.13 33.56 2ajc s GLU 347 CO 0.18 -0.22 -0.02 0.96 -0.54 0.00 0.00 175.26 175.62 2ajc s ILE 348 N 1.53 1.03 -0.05 -3.70 -4.36 -1.26 -0.49 121.20 113.90 2ajc s ILE 348 Ca -0.03 -2.04 0.00 0.00 -0.26 0.00 0.00 60.65 58.33 2ajc s ILE 348 Cb -0.13 -2.27 0.02 0.00 1.25 0.00 0.00 42.46 41.34 2ajc s ILE 348 CO -0.03 -0.39 -0.02 -0.55 0.24 0.00 0.00 174.94 174.19 2ajc s SER 349 N -3.28 1.02 0.01 4.36 0.15 -0.28 -4.95 113.70 110.73 2ajc s SER 349 Ca 0.27 -0.10 0.22 0.00 0.70 0.00 0.00 55.95 57.04 2ajc s SER 349 Cb 0.05 -0.41 -0.16 0.00 -1.71 0.00 0.00 66.02 63.80 2ajc s SER 349 CO 0.07 -0.10 0.82 0.35 1.20 0.00 0.00 173.24 175.58 2ajc n THR 350 N 4.35 0.08 0.44 6.45 -2.24 -1.26 -4.31 114.28 117.78 2ajc n THR 350 Ca -0.21 -0.26 0.05 0.00 -2.27 0.00 0.00 64.05 61.37 2ajc n THR 350 Cb 0.51 0.36 0.03 0.00 -2.10 0.00 0.00 70.33 69.13 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 -1.94 0.00 0.00 4.28 -2.24 -1.26 -5.07 114.28 108.05 2ajc n THR 351 Ca 0.01 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 2ajc n THR 351 Cb 0.45 1.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.87 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 0.66 0.83 3.76 3.38 0.00 -1.26 -4.82 105.19 107.74 2ajc n GLY 352 Ca 0.06 0.23 -0.23 0.00 0.00 0.00 0.00 46.02 46.08 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 2.66 -0.09 1.61 -2.14 -1.26 -4.63 118.94 116.68 2ajc s TRP 353 Ca 0.00 -0.49 -0.24 0.00 2.66 0.00 0.00 56.10 58.03 2ajc s TRP 353 Cb 0.00 -1.86 -0.03 0.00 -3.10 0.00 0.00 33.47 28.48 2ajc s TRP 353 CO 0.00 0.20 0.75 0.08 -2.66 0.00 0.00 176.95 175.32 2ajc s VAL 354 N -2.51 5.00 0.02 -0.66 1.01 -0.71 -4.79 120.40 117.76 2ajc s VAL 354 Ca 0.41 1.52 0.00 0.00 0.00 0.00 0.00 61.98 63.91 2ajc s VAL 354 Cb 0.00 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.30 2ajc s VAL 354 CO 0.23 0.19 0.00 0.61 0.00 0.00 0.00 175.10 176.14 2ajc n GLY 355 N 3.19 -1.89 0.08 4.51 0.00 -1.26 -3.48 105.19 106.34 2ajc n GLY 355 Ca 0.01 -1.35 -0.06 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.05 0.00 1.61 3.08 -1.93 -3.42 114.38 113.67 2ajc h ARG 356 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2ajc h ARG 356 Cb 0.09 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2ajc h ARG 356 CO 0.00 0.32 -0.51 1.19 -1.07 0.00 0.00 179.97 179.90 2ajc n PHE 357 N -4.76 0.00 -3.50 3.04 3.72 -1.26 -4.88 117.46 109.82 2ajc n PHE 357 Ca -0.04 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.27 2ajc n PHE 357 Cb 0.19 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.71 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 -1.33 0.83 0.55 -1.08 1.70 -1.25 -5.01 118.95 113.37 2ajc s ARG 358 Ca 0.00 -0.30 -0.21 0.00 -0.47 0.00 0.00 55.73 54.75 2ajc s ARG 358 Cb 0.00 0.38 -0.06 0.00 -0.57 0.00 0.00 34.95 34.71 2ajc s ARG 358 CO 0.00 -0.36 1.17 -0.35 -1.08 0.00 0.00 175.30 174.68 2ajc n PRO 359 N -0.24 1.35 -1.67 3.89 -0.04 -1.23 -4.36 135.00 132.71 2ajc n PRO 359 Ca -0.09 0.50 -0.33 0.00 -0.04 0.00 0.00 63.50 63.55 2ajc n PRO 359 Cb 0.62 -2.35 0.05 0.00 -0.04 0.00 0.00 33.50 31.78 2ajc n PRO 359 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ajc s ALA 360 N -1.36 2.44 0.19 0.55 0.00 -1.26 -4.97 121.76 117.35 2ajc s ALA 360 Ca 0.72 0.48 -0.23 0.00 0.00 0.00 0.00 51.96 52.94 2ajc s ALA 360 Cb -0.44 -3.30 -0.08 0.00 0.00 0.00 0.00 23.12 19.30 2ajc s ALA 360 CO 0.49 -1.35 0.75 -1.21 0.00 0.00 0.00 175.76 174.45 2ajc s GLU 361 N -4.26 4.42 0.29 0.00 0.41 -1.26 -4.86 118.70 113.44 2ajc s GLU 361 Ca 0.66 1.03 -0.28 0.00 -0.41 0.00 0.00 54.97 55.97 2ajc s GLU 361 Cb -0.20 -3.08 -0.09 0.00 -1.78 0.00 0.00 34.13 28.98 2ajc s GLU 361 CO 0.44 0.49 1.01 -1.25 -0.49 0.00 0.00 175.26 175.46 2ajc s PRO 362 N -1.53 4.63 -0.35 0.39 0.04 -1.26 -4.62 135.00 132.30 2ajc s PRO 362 Ca 0.39 1.56 -0.01 0.00 0.04 0.00 0.00 61.00 62.98 2ajc s PRO 362 Cb -0.20 -3.05 0.08 0.00 0.04 0.00 0.00 34.50 31.37 2ajc s PRO 362 CO 0.24 0.27 0.08 -1.01 0.04 0.00 0.00 177.00 176.62 2ajc s HIS 363 N -1.33 3.47 0.47 0.56 3.76 0.89 -4.93 115.29 118.17 2ajc s HIS 363 Ca 0.46 -2.28 -0.18 0.00 -0.15 0.00 0.00 55.06 52.91 2ajc s HIS 363 Cb -0.26 -2.65 -0.09 0.00 1.11 0.00 0.00 32.58 30.69 2ajc s HIS 363 CO 0.33 -0.89 0.95 -0.06 -0.85 0.00 0.00 174.74 174.21 2ajc s PHE 364 N 1.15 3.39 0.66 1.40 0.40 -1.26 -0.58 117.98 123.13 2ajc s PHE 364 Ca 0.02 1.49 -0.11 0.00 -0.60 0.00 0.00 56.93 57.74 2ajc s PHE 364 Cb -0.21 -2.79 -0.02 0.00 0.51 0.00 0.00 43.02 40.52 2ajc s PHE 364 CO -0.04 -0.23 1.05 0.95 0.70 0.00 0.00 175.22 177.65 2ajc s THR 365 N -2.41 4.32 0.29 0.64 -4.23 -0.64 -4.89 115.64 108.73 2ajc s THR 365 Ca 0.60 0.75 0.02 0.00 -1.18 0.00 0.00 61.69 61.88 2ajc s THR 365 Cb -0.10 -3.65 0.34 0.00 1.34 0.00 0.00 72.50 70.43 2ajc s THR 365 CO 0.23 -0.98 1.62 -1.28 -0.54 0.00 0.00 174.62 173.67 2ajc h SER 366 N -0.51 -0.17 1.18 3.99 0.87 -1.93 0.28 113.55 117.27 2ajc h SER 366 Ca -0.44 0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2ajc h SER 366 Cb 1.21 0.34 0.00 0.00 -0.44 0.00 0.00 62.40 63.51 2ajc h SER 366 CO 0.60 -0.24 -0.00 -0.90 -0.53 0.00 0.00 176.83 175.76 2ajc n ASP 367 N -5.32 0.32 0.00 6.23 5.75 -1.26 -4.90 116.55 117.37 2ajc n ASP 367 Ca 0.22 0.52 0.00 0.00 -0.01 0.00 0.00 54.79 55.53 2ajc n ASP 367 Cb 0.72 -0.61 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 2ajc n ASP 367 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ajc n GLY 368 N 1.43 0.51 0.15 6.12 0.00 0.99 -4.90 105.19 109.49 2ajc n GLY 368 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 2ajc n GLY 368 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2ajc h ASN 369 N 0.00 0.00 -5.35 1.61 -0.26 -1.92 -3.45 115.58 106.22 2ajc h ASN 369 Ca 0.00 -0.02 -0.12 0.00 -0.56 0.00 0.00 56.30 55.60 2ajc h ASN 369 Cb 0.14 0.00 -0.10 0.00 -1.06 0.00 0.00 38.32 37.29 2ajc h ASN 369 CO 0.00 0.01 -0.23 -0.94 -1.06 0.00 0.00 177.43 175.21 2ajc s SER 370 N -5.25 0.08 0.16 5.81 1.04 -1.26 -0.37 113.70 113.90 2ajc s SER 370 Ca 0.08 -1.10 -0.16 0.00 0.48 0.00 0.00 55.95 55.25 2ajc s SER 370 Cb 0.09 0.55 0.03 0.00 0.10 0.00 0.00 66.02 66.80 2ajc s SER 370 CO 0.66 -1.10 0.44 0.72 0.98 0.00 0.00 173.24 174.94 2ajc s PHE 371 N -3.92 -0.13 -0.06 5.02 -0.12 0.16 -1.62 117.98 117.31 2ajc s PHE 371 Ca 0.27 -0.20 0.06 0.00 -0.05 0.00 0.00 56.93 57.01 2ajc s PHE 371 Cb 0.01 0.29 -0.01 0.00 -0.63 0.00 0.00 43.02 42.68 2ajc s PHE 371 CO 0.11 -0.79 -0.24 0.71 -0.05 0.00 0.00 175.22 174.96 2ajc s TYR 372 N -3.84 2.47 -0.09 3.49 1.51 0.25 0.21 117.35 121.35 2ajc s TYR 372 Ca 0.06 -0.66 -0.12 0.00 -1.01 0.00 0.00 57.07 55.34 2ajc s TYR 372 Cb 0.01 -1.61 0.03 0.00 -0.11 0.00 0.00 41.96 40.28 2ajc s TYR 372 CO -0.07 -0.18 0.31 0.21 -1.11 0.00 0.00 175.55 174.71 2ajc s LYS 373 N -0.20 0.46 -0.05 -0.62 2.20 -0.45 -0.08 119.74 121.01 2ajc s LYS 373 Ca -0.02 0.23 -0.29 0.00 -0.36 0.00 0.00 55.97 55.53 2ajc s LYS 373 Cb -0.13 0.22 -0.02 0.00 -1.51 0.00 0.00 37.83 36.38 2ajc s LYS 373 CO 0.03 -0.09 0.97 0.42 -0.36 0.00 0.00 175.35 176.33 2ajc s ILE 374 N -0.32 4.85 0.14 5.43 1.01 -1.26 -0.87 121.20 130.18 2ajc s ILE 374 Ca -0.04 2.01 -0.06 0.00 0.00 0.00 0.00 60.65 62.56 2ajc s ILE 374 Cb -0.03 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.12 2ajc s ILE 374 CO 0.02 0.10 0.19 0.27 0.00 0.00 0.00 174.94 175.52 2ajc s ILE 375 N 1.39 0.09 0.20 2.92 -4.36 -0.39 -4.49 121.20 116.57 2ajc s ILE 375 Ca 0.50 -1.55 -0.30 0.00 -0.26 0.00 0.00 60.65 59.04 2ajc s ILE 375 Cb -0.20 -1.83 -0.08 0.00 1.25 0.00 0.00 42.46 41.60 2ajc s ILE 375 CO 0.23 -0.42 1.19 -0.44 0.24 0.00 0.00 174.94 175.74 2ajc s SER 376 N -2.98 7.10 1.30 4.36 0.01 -1.26 -1.20 113.70 121.03 2ajc s SER 376 Ca 0.17 2.25 -0.21 0.00 1.31 0.00 0.00 55.95 59.47 2ajc s SER 376 Cb 0.05 -2.61 0.32 0.00 0.21 0.00 0.00 66.02 63.99 2ajc s SER 376 CO -0.01 -0.35 1.04 0.21 0.41 0.00 0.00 173.24 174.53 2ajc s ASN 377 N 0.00 0.00 0.47 2.44 3.84 0.78 -4.86 114.94 117.61 2ajc s ASN 377 Ca 0.52 0.69 0.27 0.00 0.21 0.00 0.00 52.86 54.54 2ajc s ASN 377 Cb -0.33 -0.95 0.75 0.00 -0.55 0.00 0.00 41.25 40.17 2ajc s ASN 377 CO 0.38 -4.69 1.76 -0.33 -2.79 0.00 0.00 177.10 171.42 2ajc h GLU 378 N -2.97 0.00 -0.19 0.43 3.07 -1.96 -2.40 114.58 110.56 2ajc h GLU 378 Ca -0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.42 2ajc h GLU 378 Cb 1.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.22 2ajc h GLU 378 CO 0.30 0.05 0.00 0.39 -1.40 0.00 0.00 179.01 178.35 2ajc n GLU 379 N -3.13 2.24 -0.70 2.33 1.02 -1.26 -4.96 120.64 116.18 2ajc n GLU 379 Ca 0.02 -1.84 0.00 0.00 -0.02 0.00 0.00 57.16 55.32 2ajc n GLU 379 Cb 0.45 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 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 1.36 0.78 3.77 0.62 0.00 -0.90 -4.77 105.19 106.05 2ajc n GLY 380 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.91 3.58 -0.20 1.61 1.51 -1.26 -0.26 117.35 119.42 2ajc s TYR 381 Ca 0.00 0.85 -0.29 0.00 -1.01 0.00 0.00 57.07 56.62 2ajc s TYR 381 Cb 0.00 -2.40 -0.02 0.00 -0.11 0.00 0.00 41.96 39.44 2ajc s TYR 381 CO 0.00 0.37 1.39 0.15 -1.11 0.00 0.00 175.55 176.34 2ajc s LYS 382 N -0.06 4.06 0.19 -0.62 -0.14 -1.26 -0.16 119.74 121.75 2ajc s LYS 382 Ca 0.23 1.61 0.01 0.00 -1.36 0.00 0.00 55.97 56.45 2ajc s LYS 382 Cb -0.15 -3.87 -0.05 0.00 -1.68 0.00 0.00 37.83 32.08 2ajc s LYS 382 CO 0.10 -0.95 0.06 -1.01 -0.76 0.00 0.00 175.35 172.79 2ajc s HIS 383 N 4.13 1.23 -0.13 3.18 3.76 -0.34 -1.74 115.29 125.38 2ajc s HIS 383 Ca 0.60 -1.16 -0.26 0.00 -0.15 0.00 0.00 55.06 54.09 2ajc s HIS 383 Cb -0.22 -0.69 -0.02 0.00 1.11 0.00 0.00 32.58 32.76 2ajc s HIS 383 CO 0.21 -0.37 0.87 0.42 -0.85 0.00 0.00 174.74 175.02 2ajc s ILE 384 N -3.84 4.88 -0.07 0.60 1.01 -1.26 -1.26 121.20 121.25 2ajc s ILE 384 Ca 0.30 1.74 0.01 0.00 0.00 0.00 0.00 60.65 62.70 2ajc s ILE 384 Cb 0.07 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.33 2ajc s ILE 384 CO 0.08 0.06 -0.10 0.00 0.00 0.00 0.00 174.94 174.98 2ajc s HIS 386 N -0.55 3.23 0.06 0.00 2.46 0.71 -1.34 115.29 119.85 2ajc s HIS 386 Ca 0.08 0.27 0.04 0.00 0.47 0.00 0.00 55.06 55.92 2ajc s HIS 386 Cb -0.12 -2.66 -0.04 0.00 -0.13 0.00 0.00 32.58 29.64 2ajc s HIS 386 CO 0.02 -0.33 -0.03 -0.06 -2.47 0.00 0.00 174.74 171.87 2ajc s PHE 387 N 2.11 2.95 -0.12 3.88 0.40 0.13 -1.49 117.98 125.84 2ajc s PHE 387 Ca 0.15 -0.03 -0.17 0.00 -0.60 0.00 0.00 56.93 56.28 2ajc s PHE 387 Cb -0.16 -1.56 -0.04 0.00 0.51 0.00 0.00 43.02 41.77 2ajc s PHE 387 CO 0.11 0.45 0.42 -0.65 0.70 0.00 0.00 175.22 176.25 2ajc s GLN 388 N -2.01 4.28 0.36 0.44 -1.52 -1.26 -0.67 119.66 119.29 2ajc s GLN 388 Ca 0.22 0.35 0.13 0.00 -1.95 0.00 0.00 55.36 54.12 2ajc s GLN 388 Cb -0.11 -3.41 0.96 0.00 -0.22 0.00 0.00 33.01 30.22 2ajc s GLN 388 CO 0.14 0.23 1.79 1.15 -0.25 0.00 0.00 175.29 178.35 2ajc h THR 389 N 4.62 0.62 -0.40 -0.19 2.02 -1.01 -2.24 112.91 116.32 2ajc h THR 389 Ca -0.42 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.58 2ajc h THR 389 Cb 1.18 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2ajc h THR 389 CO 0.74 0.10 0.00 -0.90 0.37 0.00 0.00 175.52 175.83 2ajc n ASP 390 N -4.67 4.16 -4.37 4.18 5.68 -1.26 -4.36 116.55 115.90 2ajc n ASP 390 Ca 0.24 -2.69 -0.26 0.00 -0.50 0.00 0.00 54.79 51.58 2ajc n ASP 390 Cb 0.73 -0.51 -0.12 0.00 -1.14 0.00 0.00 41.12 40.08 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 -2.26 1.38 -0.02 0.11 -0.14 -0.84 -4.71 119.74 113.26 2ajc s LYS 391 Ca 0.42 -1.41 0.14 0.00 -1.36 0.00 0.00 55.97 53.76 2ajc s LYS 391 Cb 0.31 -1.66 -0.20 0.00 -1.68 0.00 0.00 37.83 34.59 2ajc s LYS 391 CO 0.14 0.37 0.70 -1.13 -0.76 0.00 0.00 175.35 174.67 2ajc n SER 392 N 0.52 0.85 -4.81 2.83 3.41 -1.26 -4.49 113.62 110.67 2ajc n SER 392 Ca -0.15 0.40 -0.37 0.00 -0.26 0.00 0.00 58.87 58.49 2ajc n SER 392 Cb 0.55 0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.47 2ajc n SER 392 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2ajc s ASN 393 N -5.98 7.14 0.38 4.04 -0.87 -1.26 -5.00 114.94 113.39 2ajc s ASN 393 Ca -0.04 1.48 0.08 0.00 -1.57 0.00 0.00 52.86 52.80 2ajc s ASN 393 Cb 0.08 -2.44 -0.07 0.00 -0.02 0.00 0.00 41.25 38.80 2ajc s ASN 393 CO 0.82 0.07 -0.04 0.00 -2.57 0.00 0.00 177.10 175.39 2ajc s THR 395 N -2.68 1.64 0.19 0.00 2.01 -0.56 -4.90 115.64 111.34 2ajc s THR 395 Ca 0.34 -0.70 -0.31 0.00 0.31 0.00 0.00 61.69 61.33 2ajc s THR 395 Cb 0.06 -1.50 -0.09 0.00 0.01 0.00 0.00 72.50 70.98 2ajc s THR 395 CO 0.17 0.47 1.42 -0.36 -0.69 0.00 0.00 174.62 175.63 2ajc s PHE 396 N 1.20 3.14 -1.13 4.92 0.08 -1.26 -0.21 117.98 124.73 2ajc s PHE 396 Ca -0.01 0.98 0.13 0.00 0.12 0.00 0.00 56.93 58.16 2ajc s PHE 396 Cb -0.14 -3.75 -0.02 0.00 -0.57 0.00 0.00 43.02 38.54 2ajc s PHE 396 CO -0.06 -2.53 0.72 0.44 -0.10 0.00 0.00 175.22 173.68 2ajc n ILE 397 N 3.11 0.00 -4.13 0.64 -5.35 0.48 -4.91 119.36 109.21 2ajc n ILE 397 Ca 0.09 -0.34 -0.11 0.00 -0.27 0.00 0.00 62.75 62.12 2ajc n ILE 397 Cb 0.41 1.13 -0.10 0.00 -1.74 0.00 0.00 39.64 39.34 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 -1.71 0.60 0.11 7.28 -4.23 -1.23 -4.91 115.64 111.55 2ajc s THR 398 Ca 0.10 -1.64 -0.25 0.00 -1.18 0.00 0.00 61.69 58.72 2ajc s THR 398 Cb 0.10 -1.30 0.08 0.00 1.34 0.00 0.00 72.50 72.72 2ajc s THR 398 CO 0.36 -0.72 0.74 -1.59 -0.54 0.00 0.00 174.62 172.87 2ajc s LYS 399 N -3.08 1.15 0.00 3.99 0.00 -1.26 -4.54 119.74 116.00 2ajc s LYS 399 Ca 0.04 -0.47 0.00 0.00 0.00 0.00 0.00 55.97 55.54 2ajc s LYS 399 Cb 0.00 0.50 0.00 0.00 0.00 0.00 0.00 37.83 38.34 2ajc s LYS 399 CO -0.03 -0.51 0.00 0.41 0.00 0.00 0.00 175.35 175.22 2ajc n GLY 400 N -0.34 3.68 2.42 0.59 0.00 -1.26 -4.91 105.19 105.36 2ajc n GLY 400 Ca -0.12 -1.67 -0.40 0.00 0.00 0.00 0.00 46.02 43.83 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 -1.89 7.11 -3.83 4.61 0.00 -1.26 -4.74 120.51 120.51 2ajc n ALA 401 Ca 0.00 -3.74 -0.05 0.00 0.00 0.00 0.00 53.44 49.65 2ajc n ALA 401 Cb 0.00 -3.22 0.01 0.00 0.00 0.00 0.00 19.45 16.24 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 1.30 0.02 0.05 0.00 1.48 -1.26 -5.05 118.94 115.48 2ajc s TRP 402 Ca 0.62 -0.49 0.03 0.00 -1.06 0.00 0.00 56.10 55.21 2ajc s TRP 402 Cb 0.17 0.73 -0.02 0.00 -1.16 0.00 0.00 33.47 33.19 2ajc s TRP 402 CO -0.07 -1.13 -0.10 -1.21 -4.06 0.00 0.00 176.95 170.38 2ajc s GLU 403 N -2.60 0.64 -0.07 3.25 2.02 -1.26 -4.57 118.70 116.11 2ajc s GLU 403 Ca 0.17 -0.78 -0.26 0.00 0.02 0.00 0.00 54.97 54.11 2ajc s GLU 403 Cb -0.03 -0.52 -0.03 0.00 0.10 0.00 0.00 34.13 33.65 2ajc s GLU 403 CO 0.07 0.11 0.83 0.08 0.02 0.00 0.00 175.26 176.37 2ajc s VAL 404 N -1.23 4.94 -0.09 2.63 1.01 -0.71 -2.26 120.40 124.68 2ajc s VAL 404 Ca -0.06 1.71 -0.19 0.00 0.00 0.00 0.00 61.98 63.44 2ajc s VAL 404 Cb -0.09 -4.16 -0.28 0.00 0.00 0.00 0.00 36.38 31.84 2ajc s VAL 404 CO 0.01 0.16 0.66 0.40 0.00 0.00 0.00 175.10 176.33 2ajc h ILE 405 N 4.88 1.22 -2.09 2.22 1.08 -0.10 -3.45 117.51 121.28 2ajc h ILE 405 Ca -0.38 -2.43 0.10 0.00 -0.39 0.00 0.00 64.86 61.76 2ajc h ILE 405 Cb 1.19 2.88 -0.17 0.00 -3.07 0.00 0.00 36.82 37.65 2ajc h ILE 405 CO 0.78 0.69 0.51 -0.83 -0.69 0.00 0.00 178.15 178.60 2ajc s GLY 406 N -4.75 -0.42 -0.23 5.37 0.00 -1.15 -5.00 107.32 101.14 2ajc s GLY 406 Ca -0.18 1.26 -0.16 0.00 0.00 0.00 0.00 44.72 45.64 2ajc s GLY 406 CO 0.78 0.51 0.41 -0.42 0.00 0.00 0.00 173.10 174.37 2ajc s ILE 407 N -2.62 5.17 -0.17 0.90 1.01 -1.26 -1.23 121.20 123.01 2ajc s ILE 407 Ca 0.03 0.70 0.05 0.00 0.00 0.00 0.00 60.65 61.43 2ajc s ILE 407 Cb -0.01 -3.74 -0.23 0.00 0.01 0.00 0.00 42.46 38.50 2ajc s ILE 407 CO -0.06 0.19 0.18 -0.62 0.00 0.00 0.00 174.94 174.63 2ajc n GLU 408 N 4.93 0.69 -3.57 2.79 -0.58 -0.03 -4.98 120.64 119.89 2ajc n GLU 408 Ca -0.08 0.17 -0.16 0.00 -0.42 0.00 0.00 57.16 56.67 2ajc n GLU 408 Cb 0.51 -1.62 -0.06 0.00 -0.57 0.00 0.00 31.44 29.69 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 -2.54 -1.52 -0.02 0.62 0.00 -1.13 -4.89 121.76 112.28 2ajc s ALA 409 Ca -0.20 1.00 0.00 0.00 0.00 0.00 0.00 51.96 52.76 2ajc s ALA 409 Cb 0.07 0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.33 2ajc s ALA 409 CO 0.74 -0.39 0.01 -1.17 0.00 0.00 0.00 175.76 174.96 2ajc s LEU 410 N -1.40 1.29 0.00 0.00 2.96 -1.26 -0.64 118.68 119.63 2ajc s LEU 410 Ca -0.10 0.00 0.02 0.00 -0.22 0.00 0.00 54.13 53.83 2ajc s LEU 410 Cb -0.01 -0.12 -0.01 0.00 0.50 0.00 0.00 46.19 46.55 2ajc s LEU 410 CO 0.06 -0.09 0.07 0.35 -1.32 0.00 0.00 176.35 175.42 2ajc n THR 411 N 3.94 0.00 0.25 3.68 -2.24 0.54 -4.94 114.28 115.51 2ajc n THR 411 Ca -0.25 -2.29 0.11 0.00 -2.27 0.00 0.00 64.05 59.35 2ajc n THR 411 Cb 0.52 0.63 0.66 0.00 -2.10 0.00 0.00 70.33 70.04 2ajc n THR 411 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2ajc h SER 412 N 1.35 0.00 0.00 3.42 4.64 -2.01 -3.28 113.55 117.67 2ajc h SER 412 Ca -0.36 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.89 2ajc h SER 412 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 2ajc h SER 412 CO 0.58 0.15 -1.56 0.47 -0.87 0.00 0.00 176.83 175.59 2ajc n ASP 413 N -3.78 2.58 -4.23 4.97 8.00 -1.26 -4.87 116.55 117.95 2ajc n ASP 413 Ca -0.02 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.35 2ajc n ASP 413 Cb 0.25 1.17 -0.10 0.00 -0.02 0.00 0.00 41.12 42.43 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 -2.53 1.17 -0.05 1.24 1.51 -1.24 -0.50 117.35 116.95 2ajc s TYR 414 Ca -0.04 -0.95 0.01 0.00 -1.01 0.00 0.00 57.07 55.08 2ajc s TYR 414 Cb 0.05 -0.66 0.02 0.00 -0.11 0.00 0.00 41.96 41.27 2ajc s TYR 414 CO 0.42 -0.14 -0.05 -1.17 -1.11 0.00 0.00 175.55 173.50 2ajc s LEU 415 N -3.15 1.34 -0.10 -1.29 1.98 -0.85 -0.34 118.68 116.28 2ajc s LEU 415 Ca 0.20 -0.15 -0.02 0.00 -2.89 0.00 0.00 54.13 51.28 2ajc s LEU 415 Cb 0.05 -0.49 -0.03 0.00 0.66 0.00 0.00 46.19 46.38 2ajc s LEU 415 CO 0.02 -0.05 -0.03 -0.31 -1.89 0.00 0.00 176.35 174.09 2ajc s TYR 416 N 0.92 3.06 0.13 5.38 1.51 0.19 -1.16 117.35 127.38 2ajc s TYR 416 Ca -0.11 0.02 -0.09 0.00 -1.01 0.00 0.00 57.07 55.88 2ajc s TYR 416 Cb -0.14 -1.81 -0.01 0.00 -0.11 0.00 0.00 41.96 39.88 2ajc s TYR 416 CO 0.00 0.29 0.24 1.52 -1.11 0.00 0.00 175.55 176.49 2ajc s TYR 417 N -0.52 0.31 -0.11 2.71 -0.85 -0.67 -0.85 117.35 117.36 2ajc s TYR 417 Ca 0.08 -0.70 -0.01 0.00 -0.52 0.00 0.00 57.07 55.92 2ajc s TYR 417 Cb -0.12 -0.07 -0.03 0.00 0.38 0.00 0.00 41.96 42.12 2ajc s TYR 417 CO 0.02 -0.64 -0.07 0.42 -1.52 0.00 0.00 175.55 173.76 2ajc s ILE 418 N -3.92 3.66 0.15 -3.49 1.01 -0.36 -0.43 121.20 117.82 2ajc s ILE 418 Ca 0.12 -0.47 -0.04 0.00 0.00 0.00 0.00 60.65 60.26 2ajc s ILE 418 Cb 0.04 -2.54 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 2ajc s ILE 418 CO -0.05 0.55 0.16 -0.94 0.00 0.00 0.00 174.94 174.66 2ajc s SER 419 N -0.17 0.18 -0.51 3.58 1.04 -0.84 0.67 113.70 117.66 2ajc s SER 419 Ca 0.02 -1.09 0.02 0.00 0.48 0.00 0.00 55.95 55.38 2ajc s SER 419 Cb -0.13 0.36 0.48 0.00 0.10 0.00 0.00 66.02 66.84 2ajc s SER 419 CO 0.03 -0.81 1.74 -0.46 0.98 0.00 0.00 173.24 174.71 2ajc n ASN 420 N -0.16 5.99 -0.06 7.02 0.23 -0.96 -1.82 115.26 125.49 2ajc n ASN 420 Ca -0.05 -3.76 -0.13 0.00 -0.53 0.00 0.00 54.58 50.10 2ajc n ASN 420 Cb 0.64 -0.76 -0.06 0.00 -2.08 0.00 0.00 39.78 37.51 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 1.84 0.47 -6.22 -3.83 4.81 -1.85 -3.35 114.58 106.44 2ajc h GLU 421 Ca 0.51 -0.26 -0.70 0.00 -0.13 0.00 0.00 59.36 58.78 2ajc h GLU 421 Cb 1.31 0.01 0.04 0.00 0.63 0.00 0.00 28.75 30.74 2ajc h GLU 421 CO 1.19 0.84 0.67 1.58 -0.73 0.00 0.00 179.01 182.57 2ajc n HIS 422 N -4.44 1.79 -1.14 0.92 -0.00 -1.26 -0.87 115.22 110.20 2ajc n HIS 422 Ca -0.06 0.56 -0.05 0.00 0.46 0.00 0.00 57.72 58.63 2ajc n HIS 422 Cb 0.41 -2.40 -0.02 0.00 -0.12 0.00 0.00 29.99 27.86 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 3.87 -1.85 -2.22 1.57 4.01 -1.26 -2.37 118.16 119.91 2ajc n LYS 423 Ca 0.22 0.68 -0.21 0.00 -0.51 0.00 0.00 58.31 58.50 2ajc n LYS 423 Cb 0.17 -5.12 -0.03 0.00 -0.51 0.00 0.00 35.03 29.54 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 0.62 0.05 3.36 0.72 0.00 -0.05 -4.96 105.19 104.93 2ajc n GLY 424 Ca -0.05 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 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 -4.75 2.96 0.27 1.61 0.23 -1.00 -4.94 119.30 113.68 2ajc s MET 425 Ca 0.00 -0.97 0.21 0.00 -1.03 0.00 0.00 55.69 53.90 2ajc s MET 425 Cb 0.00 -3.56 1.03 0.00 -1.53 0.00 0.00 34.83 30.78 2ajc s MET 425 CO 0.00 -0.57 1.65 -0.35 -2.03 0.00 0.00 175.02 173.72 2ajc n PRO 426 N 4.93 0.15 -0.29 3.16 -0.04 -1.26 -1.74 135.00 139.90 2ajc n PRO 426 Ca -0.13 0.54 0.07 0.00 -0.04 0.00 0.00 63.50 63.94 2ajc n PRO 426 Cb 0.47 -1.89 0.21 0.00 -0.04 0.00 0.00 33.50 32.25 2ajc n PRO 426 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ajc n GLY 427 N -0.77 1.39 3.72 0.55 0.00 -1.26 -4.86 105.19 103.96 2ajc n GLY 427 Ca 0.00 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.91 1.76 -0.09 -0.02 0.00 -0.71 -2.10 107.32 105.24 2ajc s GLY 428 Ca 0.32 -1.70 -0.05 0.00 0.00 0.00 0.00 44.72 43.28 2ajc s GLY 428 CO 0.19 -1.69 0.22 0.50 0.00 0.00 0.00 173.10 172.32 2ajc s ARG 429 N -3.80 0.20 0.04 2.90 1.81 -0.20 -4.23 118.95 115.67 2ajc s ARG 429 Ca 0.35 0.46 -0.02 0.00 -1.72 0.00 0.00 55.73 54.80 2ajc s ARG 429 Cb -0.05 -0.09 -0.03 0.00 -0.45 0.00 0.00 34.95 34.34 2ajc s ARG 429 CO 0.22 -0.14 0.02 -0.80 -0.68 0.00 0.00 175.30 173.92 2ajc s ASN 430 N 1.04 0.33 -0.11 0.23 0.01 -0.76 -1.11 114.94 114.57 2ajc s ASN 430 Ca -0.08 -0.74 -0.13 0.00 -0.71 0.00 0.00 52.86 51.20 2ajc s ASN 430 Cb -0.09 0.19 -0.05 0.00 0.41 0.00 0.00 41.25 41.72 2ajc s ASN 430 CO -0.07 -0.52 0.31 -0.22 -1.51 0.00 0.00 177.10 175.10 2ajc s LEU 431 N -2.38 4.33 0.20 0.60 2.96 -1.26 -1.99 118.68 121.13 2ajc s LEU 431 Ca -0.01 0.64 0.07 0.00 -0.22 0.00 0.00 54.13 54.60 2ajc s LEU 431 Cb 0.01 -2.40 -0.05 0.00 0.50 0.00 0.00 46.19 44.26 2ajc s LEU 431 CO -0.07 0.20 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.73 2ajc s TYR 432 N -0.15 1.64 -0.05 5.38 1.51 0.43 -0.66 117.35 125.46 2ajc s TYR 432 Ca 0.19 -0.63 0.01 0.00 -1.01 0.00 0.00 57.07 55.63 2ajc s TYR 432 Cb -0.14 -0.79 0.02 0.00 -0.11 0.00 0.00 41.96 40.94 2ajc s TYR 432 CO 0.07 0.29 -0.06 0.50 -1.11 0.00 0.00 175.55 175.23 2ajc s ARG 433 N -3.68 0.95 -0.06 -0.62 3.52 0.06 -1.68 118.95 117.45 2ajc s ARG 433 Ca 0.22 -0.16 0.06 0.00 -0.13 0.00 0.00 55.73 55.72 2ajc s ARG 433 Cb 0.00 -0.91 -0.01 0.00 -1.56 0.00 0.00 34.95 32.48 2ajc s ARG 433 CO 0.06 -0.05 -0.24 -1.50 -0.81 0.00 0.00 175.30 172.76 2ajc s ILE 434 N 0.83 1.94 -0.11 4.11 2.07 -0.31 -0.30 121.20 129.43 2ajc s ILE 434 Ca -0.12 -1.00 -0.30 0.00 -1.41 0.00 0.00 60.65 57.82 2ajc s ILE 434 Cb -0.14 -1.64 -0.02 0.00 0.13 0.00 0.00 42.46 40.78 2ajc s ILE 434 CO 0.01 0.54 1.10 -1.58 -1.91 0.00 0.00 174.94 173.10 2ajc s GLN 435 N -0.10 4.36 0.56 3.50 0.74 -0.40 -2.01 119.66 126.31 2ajc s GLN 435 Ca -0.04 1.52 0.29 0.00 0.05 0.00 0.00 55.36 57.17 2ajc s GLN 435 Cb -0.14 -3.58 1.63 0.00 1.10 0.00 0.00 33.01 32.03 2ajc s GLN 435 CO 0.04 -0.44 2.16 -0.07 -0.55 0.00 0.00 175.29 176.43 2ajc h LEU 436 N 8.41 0.00 -2.60 3.68 4.07 -1.13 -2.13 115.31 125.60 2ajc h LEU 436 Ca -0.30 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.66 2ajc h LEU 436 Cb 1.14 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.88 2ajc h LEU 436 CO 0.89 0.07 0.00 -0.46 -1.08 0.00 0.00 178.44 177.86 2ajc n ASN 437 N -3.71 3.80 -3.01 -0.43 0.23 -1.26 -4.71 115.26 106.16 2ajc n ASN 437 Ca -0.02 -2.00 0.01 0.00 -0.53 0.00 0.00 54.58 52.04 2ajc n ASN 437 Cb 0.17 -0.45 -0.00 0.00 -2.08 0.00 0.00 39.78 37.42 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 -1.07 -0.99 0.00 0.53 -1.08 -0.80 -5.01 116.67 108.24 2ajc s ASP 438 Ca 0.47 -0.48 0.06 0.00 -0.52 0.00 0.00 52.55 52.08 2ajc s ASP 438 Cb 0.25 1.27 0.37 0.00 -1.46 0.00 0.00 42.92 43.35 2ajc s ASP 438 CO 0.33 -0.11 0.83 -1.22 0.52 0.00 0.00 175.17 175.52 2ajc n TYR 439 N 4.12 0.00 0.10 -5.34 4.01 -1.21 -0.79 117.16 118.05 2ajc n TYR 439 Ca 0.08 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.86 2ajc n TYR 439 Cb 0.60 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.62 2ajc n TYR 439 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2ajc h THR 440 N 0.00 0.54 -2.61 -0.72 2.02 -1.92 -3.41 112.91 106.81 2ajc h THR 440 Ca 0.00 -1.87 -0.71 0.00 0.77 0.00 0.00 66.41 64.60 2ajc h THR 440 Cb 0.00 2.13 -0.19 0.00 -1.74 0.00 0.00 68.15 68.35 2ajc h THR 440 CO 0.00 0.31 0.76 -0.54 0.37 0.00 0.00 175.52 176.42 2ajc s LYS 441 N -3.02 3.65 -0.09 6.66 1.02 0.03 -4.98 119.74 123.00 2ajc s LYS 441 Ca 0.01 -1.96 0.03 0.00 0.02 0.00 0.00 55.97 54.08 2ajc s LYS 441 Cb 0.08 -4.85 0.01 0.00 -0.52 0.00 0.00 37.83 32.54 2ajc s LYS 441 CO 0.77 -1.69 -0.18 0.54 -0.92 0.00 0.00 175.35 173.86 2ajc s VAL 442 N 2.16 1.65 -0.05 3.17 0.11 -1.26 -1.27 120.40 124.90 2ajc s VAL 442 Ca 0.31 -0.77 0.06 0.00 -2.93 0.00 0.00 61.98 58.66 2ajc s VAL 442 Cb -0.05 -1.46 -0.01 0.00 -1.53 0.00 0.00 36.38 33.33 2ajc s VAL 442 CO -0.09 0.47 -0.25 0.28 -3.33 0.00 0.00 175.10 172.18 2ajc s THR 443 N 0.59 2.02 -0.28 5.04 -1.32 0.59 -4.95 115.64 117.33 2ajc s THR 443 Ca -0.15 -1.06 -0.22 0.00 -1.21 0.00 0.00 61.69 59.06 2ajc s THR 443 Cb -0.17 -1.70 -0.01 0.00 -1.51 0.00 0.00 72.50 69.11 2ajc s THR 443 CO 0.05 0.56 0.70 0.00 -2.21 0.00 0.00 174.62 173.72 2ajc h LEU 445 N 9.18 0.00 0.00 0.00 3.38 -1.24 -3.39 115.31 123.24 2ajc h LEU 445 Ca -0.26 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.67 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 0.82 0.02 -1.10 -1.54 0.09 0.00 0.00 178.44 176.73 2ajc n SER 446 N -2.67 3.24 -0.28 -0.43 3.41 -1.22 -4.74 113.62 110.92 2ajc n SER 446 Ca 0.02 -0.09 0.08 0.00 -0.26 0.00 0.00 58.87 58.62 2ajc n SER 446 Cb 0.51 1.21 0.21 0.00 -0.26 0.00 0.00 64.21 65.88 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 -5.33 2.19 -0.07 0.00 4.71 -1.26 -4.34 120.64 116.55 2ajc n GLU 448 Ca 0.17 -1.81 -0.07 0.00 -0.01 0.00 0.00 57.16 55.44 2ajc n GLU 448 Cb 0.56 -1.46 -0.01 0.00 -1.01 0.00 0.00 31.44 29.52 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 4.41 -0.27 -5.27 -4.62 3.38 -1.77 -3.37 115.31 107.80 2ajc h LEU 449 Ca 0.00 0.08 -0.27 0.00 0.09 0.00 0.00 57.88 57.79 2ajc h LEU 449 Cb 0.96 0.17 -0.20 0.00 0.09 0.00 0.00 40.66 41.68 2ajc h LEU 449 CO 0.00 -0.10 -0.61 0.59 0.09 0.00 0.00 178.44 178.41 2ajc n ASN 450 N -5.24 -2.57 -0.30 -0.43 4.13 -1.26 -5.07 115.26 104.51 2ajc n ASN 450 Ca -0.01 -2.95 0.14 0.00 1.68 0.00 0.00 54.58 53.44 2ajc n ASN 450 Cb 0.16 1.26 0.31 0.00 -1.54 0.00 0.00 39.78 39.98 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 4.68 0.36 0.14 3.52 0.13 -1.76 0.45 132.00 139.53 2ajc h PRO 451 Ca 0.02 -0.02 -0.29 0.00 -0.87 0.00 0.00 66.00 64.84 2ajc h PRO 451 Cb 1.04 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2ajc h PRO 451 CO 0.20 0.24 -1.36 0.93 -0.23 0.00 0.00 178.00 177.78 2ajc h GLU 452 N 0.37 0.29 0.05 0.86 4.39 -1.97 -3.37 114.58 115.20 2ajc h GLU 452 Ca 0.57 -0.50 -0.28 0.00 0.34 0.00 0.00 59.36 59.48 2ajc h GLU 452 Cb 1.09 0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 29.90 2ajc h GLU 452 CO -0.55 1.21 -1.49 -0.09 -1.16 0.00 0.00 179.01 176.93 2ajc h ARG 453 N 0.08 0.11 -4.46 2.33 2.43 -1.85 -3.41 114.38 109.61 2ajc h ARG 453 Ca -0.18 -0.18 -0.63 0.00 -0.81 0.00 0.00 59.98 58.17 2ajc h ARG 453 Cb 2.01 0.07 -0.39 0.00 -0.42 0.00 0.00 29.97 31.24 2ajc h ARG 453 CO 0.20 0.89 -0.77 0.00 -1.51 0.00 0.00 179.97 178.78 2ajc n GLN 455 N 4.52 -0.44 -3.69 0.00 6.02 0.48 -4.51 117.38 119.75 2ajc n GLN 455 Ca -0.06 -0.41 -0.28 0.00 -0.01 0.00 0.00 57.00 56.24 2ajc n GLN 455 Cb 0.43 -0.84 -0.16 0.00 1.02 0.00 0.00 30.24 30.69 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 -0.06 0.97 0.20 1.08 6.14 -1.06 -1.03 117.35 123.59 2ajc s TYR 456 Ca 0.00 -0.99 0.10 0.00 0.64 0.00 0.00 57.07 56.81 2ajc s TYR 456 Cb 0.00 -1.12 -0.04 0.00 0.42 0.00 0.00 41.96 41.22 2ajc s TYR 456 CO 0.00 -0.69 -0.19 0.71 0.64 0.00 0.00 175.55 176.02 2ajc s TYR 457 N 1.87 2.00 0.21 4.97 1.51 -0.27 -0.72 117.35 126.93 2ajc s TYR 457 Ca 0.03 -0.44 0.03 0.00 -1.01 0.00 0.00 57.07 55.68 2ajc s TYR 457 Cb -0.17 -0.95 -0.05 0.00 -0.11 0.00 0.00 41.96 40.68 2ajc s TYR 457 CO -0.16 0.46 0.01 -1.54 -1.11 0.00 0.00 175.55 173.20 2ajc s SER 458 N -2.98 1.50 0.05 2.29 1.04 -0.80 -4.52 113.70 110.29 2ajc s SER 458 Ca 0.21 -1.21 -0.01 0.00 0.48 0.00 0.00 55.95 55.42 2ajc s SER 458 Cb -0.05 0.07 -0.04 0.00 0.10 0.00 0.00 66.02 66.10 2ajc s SER 458 CO 0.09 -0.55 -0.02 0.00 0.98 0.00 0.00 173.24 173.73 2ajc s ALA 459 N -3.55 0.49 -0.12 5.32 0.00 -1.26 -1.57 121.76 121.07 2ajc s ALA 459 Ca 0.27 -1.20 -0.04 0.00 0.00 0.00 0.00 51.96 51.00 2ajc s ALA 459 Cb 0.06 0.28 0.05 0.00 0.00 0.00 0.00 23.12 23.51 2ajc s ALA 459 CO 0.07 -0.38 0.10 0.45 0.00 0.00 0.00 175.76 176.01 2ajc s SER 460 N -2.92 1.58 0.05 0.00 0.15 -0.77 -4.98 113.70 106.81 2ajc s SER 460 Ca 0.07 -0.19 -0.05 0.00 0.70 0.00 0.00 55.95 56.48 2ajc s SER 460 Cb 0.08 -0.06 -0.05 0.00 -1.71 0.00 0.00 66.02 64.28 2ajc s SER 460 CO -0.10 -0.30 0.28 -0.36 1.20 0.00 0.00 173.24 173.96 2ajc s PHE 461 N 2.19 3.54 1.09 3.44 0.40 -1.26 -0.68 117.98 126.70 2ajc s PHE 461 Ca 0.04 0.51 -0.16 0.00 -0.60 0.00 0.00 56.93 56.71 2ajc s PHE 461 Cb -0.14 -1.95 0.23 0.00 0.51 0.00 0.00 43.02 41.68 2ajc s PHE 461 CO -0.07 0.57 1.13 -1.54 0.70 0.00 0.00 175.22 176.01 2ajc s SER 462 N -2.02 1.90 0.35 1.36 1.04 0.06 -4.86 113.70 111.53 2ajc s SER 462 Ca 0.32 0.79 0.15 0.00 0.48 0.00 0.00 55.95 57.69 2ajc s SER 462 Cb -0.13 -1.19 1.06 0.00 0.10 0.00 0.00 66.02 65.86 2ajc s SER 462 CO 0.20 -3.54 1.70 0.78 0.98 0.00 0.00 173.24 173.37 2ajc h ASN 463 N -2.18 0.53 -0.05 7.02 -0.26 -1.73 -1.29 115.58 117.62 2ajc h ASN 463 Ca -0.49 0.15 -0.04 0.00 -0.56 0.00 0.00 56.30 55.36 2ajc h ASN 463 Cb 1.31 0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 38.61 2ajc h ASN 463 CO 0.45 -0.02 -0.53 0.29 -1.06 0.00 0.00 177.43 176.57 2ajc n LYS 464 N -4.88 1.70 -2.33 0.81 5.02 -1.26 -4.93 118.16 112.29 2ajc n LYS 464 Ca 0.29 -3.35 -0.19 0.00 -2.02 0.00 0.00 58.31 53.04 2ajc n LYS 464 Cb 0.93 -1.64 -0.02 0.00 -0.02 0.00 0.00 35.03 34.28 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 -1.08 -0.62 0.10 7.82 0.00 -0.49 -4.87 120.51 121.38 2ajc n ALA 465 Ca 0.20 0.17 -0.04 0.00 0.00 0.00 0.00 53.44 53.77 2ajc n ALA 465 Cb 0.71 -2.05 0.07 0.00 0.00 0.00 0.00 19.45 18.18 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 0.00 0.06 -4.45 0.00 1.57 -1.77 -3.42 116.57 108.56 2ajc h LYS 466 Ca -0.45 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 58.08 2ajc h LYS 466 Cb 1.33 0.02 -0.16 0.00 0.08 0.00 0.00 32.23 33.50 2ajc h LYS 466 CO 0.54 0.78 -0.69 0.71 -0.57 0.00 0.00 179.45 180.22 2ajc s TYR 467 N -3.35 0.70 -0.10 -1.35 2.02 -1.26 0.40 117.35 114.40 2ajc s TYR 467 Ca -0.01 -0.91 -0.16 0.00 -0.37 0.00 0.00 57.07 55.62 2ajc s TYR 467 Cb 0.11 -0.44 0.04 0.00 -0.40 0.00 0.00 41.96 41.27 2ajc s TYR 467 CO 0.79 -0.23 0.40 1.52 -1.57 0.00 0.00 175.55 176.46 2ajc s TYR 468 N -3.39 -0.38 -0.08 2.71 1.13 -0.59 -0.76 117.35 116.00 2ajc s TYR 468 Ca 0.06 0.83 -0.14 0.00 -1.41 0.00 0.00 57.07 56.41 2ajc s TYR 468 Cb 0.04 0.15 -0.05 0.00 -1.10 0.00 0.00 41.96 41.00 2ajc s TYR 468 CO -0.06 -0.30 0.36 -1.14 -2.51 0.00 0.00 175.55 171.90 2ajc s GLN 469 N -0.40 4.04 -0.13 -3.49 0.74 0.14 -0.77 119.66 119.79 2ajc s GLN 469 Ca -0.05 0.28 -0.03 0.00 0.05 0.00 0.00 55.36 55.60 2ajc s GLN 469 Cb -0.03 -3.31 -0.03 0.00 1.10 0.00 0.00 33.01 30.73 2ajc s GLN 469 CO 0.02 0.48 -0.01 -0.51 -0.55 0.00 0.00 175.29 174.73 2ajc s LEU 470 N -0.36 3.43 -0.27 3.68 1.43 0.14 -1.85 118.68 124.87 2ajc s LEU 470 Ca 0.21 -0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.32 2ajc s LEU 470 Cb -0.15 -1.82 0.05 0.00 0.03 0.00 0.00 46.19 44.31 2ajc s LEU 470 CO 0.09 0.24 -0.07 -0.13 0.23 0.00 0.00 176.35 176.71 2ajc s ARG 471 N -0.08 2.33 -0.18 1.70 0.52 -0.61 -1.73 118.95 120.90 2ajc s ARG 471 Ca 0.03 -1.30 -0.16 0.00 -0.52 0.00 0.00 55.73 53.77 2ajc s ARG 471 Cb -0.13 -2.98 -0.04 0.00 0.52 0.00 0.00 34.95 32.32 2ajc s ARG 471 CO 0.02 -0.57 0.42 0.00 0.02 0.00 0.00 175.30 175.19 2ajc n PHE 473 N 4.29 0.00 -0.13 0.00 3.01 0.11 -1.36 117.46 123.37 2ajc n PHE 473 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.38 2ajc n PHE 473 Cb 0.51 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.98 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 0.86 -1.57 0.11 1.37 0.00 -1.26 -0.84 105.19 103.87 2ajc n GLY 474 Ca 0.08 -1.53 0.11 0.00 0.00 0.00 0.00 46.02 44.68 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 -1.27 0.16 -0.54 1.61 -0.04 -0.25 -0.39 135.00 134.28 2ajc n PRO 475 Ca 0.00 0.40 -0.04 0.00 -0.04 0.00 0.00 63.50 63.82 2ajc n PRO 475 Cb 0.00 -1.81 0.02 0.00 -0.04 0.00 0.00 33.50 31.67 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 -0.02 -0.37 3.77 0.55 0.00 0.15 -4.51 105.19 104.76 2ajc n GLY 476 Ca 0.02 -1.80 -0.40 0.00 0.00 0.00 0.00 46.02 43.84 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 4.28 0.38 0.99 1.43 -1.26 -4.57 118.68 119.93 2ajc s LEU 477 Ca 0.10 2.92 -0.26 0.00 -1.03 0.00 0.00 54.13 55.87 2ajc s LEU 477 Cb -0.00 -3.75 -0.12 0.00 0.03 0.00 0.00 46.19 42.35 2ajc s LEU 477 CO 0.07 -0.88 1.02 -2.65 0.23 0.00 0.00 176.35 174.14 2ajc n PRO 478 N 0.33 1.41 -3.75 1.29 -0.02 -1.26 -4.74 135.00 128.26 2ajc n PRO 478 Ca 0.02 0.50 -0.17 0.00 -2.02 0.00 0.00 63.50 61.83 2ajc n PRO 478 Cb 0.41 -2.00 -0.17 0.00 -0.02 0.00 0.00 33.50 31.71 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 -0.25 0.73 -0.13 2.45 2.96 -0.47 -4.28 118.68 119.69 2ajc s LEU 479 Ca 0.61 0.04 -0.01 0.00 -0.22 0.00 0.00 54.13 54.55 2ajc s LEU 479 Cb -0.60 -0.13 -0.02 0.00 0.50 0.00 0.00 46.19 45.94 2ajc s LEU 479 CO 0.58 -0.17 -0.09 -0.31 -1.32 0.00 0.00 176.35 175.04 2ajc s TYR 480 N 1.50 2.89 0.05 5.38 1.51 0.63 -0.83 117.35 128.48 2ajc s TYR 480 Ca -0.04 -0.42 -0.01 0.00 -1.01 0.00 0.00 57.07 55.60 2ajc s TYR 480 Cb -0.13 -1.85 -0.04 0.00 -0.11 0.00 0.00 41.96 39.83 2ajc s TYR 480 CO -0.03 -0.06 -0.03 0.95 -1.11 0.00 0.00 175.55 175.26 2ajc s THR 481 N 0.16 0.27 -0.12 -0.71 -4.23 -0.71 0.01 115.64 110.32 2ajc s THR 481 Ca -0.05 -1.80 0.01 0.00 -1.18 0.00 0.00 61.69 58.68 2ajc s THR 481 Cb -0.14 -1.50 -0.01 0.00 1.34 0.00 0.00 72.50 72.18 2ajc s THR 481 CO 0.04 -0.97 -0.15 -0.22 -0.54 0.00 0.00 174.62 172.79 2ajc s LEU 482 N -2.89 2.64 0.17 4.79 2.96 -0.29 -0.69 118.68 125.38 2ajc s LEU 482 Ca 0.07 -0.34 0.06 0.00 -0.22 0.00 0.00 54.13 53.70 2ajc s LEU 482 Cb 0.07 -1.58 -0.04 0.00 0.50 0.00 0.00 46.19 45.14 2ajc s LEU 482 CO -0.09 0.19 -0.12 -1.00 -1.32 0.00 0.00 176.35 174.00 2ajc s HIS 483 N 0.21 1.46 -0.11 5.38 3.76 0.05 -2.97 115.29 123.08 2ajc s HIS 483 Ca -0.09 -0.66 -0.02 0.00 -0.15 0.00 0.00 55.06 54.14 2ajc s HIS 483 Cb -0.15 -0.71 -0.03 0.00 1.11 0.00 0.00 32.58 32.79 2ajc s HIS 483 CO 0.05 0.21 -0.04 0.45 -0.85 0.00 0.00 174.74 174.56 2ajc s SER 484 N -3.18 4.82 0.28 1.40 0.15 -1.08 -1.54 113.70 114.56 2ajc s SER 484 Ca 0.19 -0.03 0.05 0.00 0.70 0.00 0.00 55.95 56.85 2ajc s SER 484 Cb 0.01 -1.49 0.41 0.00 -1.71 0.00 0.00 66.02 63.23 2ajc s SER 484 CO 0.03 0.28 1.68 0.28 1.20 0.00 0.00 173.24 176.71 2ajc h SER 485 N 5.85 0.29 -0.70 5.45 0.02 -0.31 0.79 113.55 124.94 2ajc h SER 485 Ca -0.41 -0.13 0.14 0.00 -0.84 0.00 0.00 61.79 60.54 2ajc h SER 485 Cb 1.18 -0.08 -0.13 0.00 0.14 0.00 0.00 62.40 63.51 2ajc h SER 485 CO 0.57 0.69 -0.23 0.77 -1.14 0.00 0.00 176.83 177.49 2ajc h SER 486 N 0.23 -0.84 0.00 3.07 4.64 -1.91 -3.24 113.55 115.51 2ajc h SER 486 Ca 0.02 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2ajc h SER 486 Cb 0.85 0.50 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2ajc h SER 486 CO 0.07 -0.26 0.00 -1.54 -0.87 0.00 0.00 176.83 174.23 2ajc n SER 487 N -5.47 0.60 -3.04 4.97 3.41 -1.25 -5.01 113.62 107.84 2ajc n SER 487 Ca 0.08 -1.03 -0.20 0.00 -0.26 0.00 0.00 58.87 57.47 2ajc n SER 487 Cb 0.37 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.39 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 -0.01 -5.59 -4.76 4.04 10.43 0.27 -4.96 116.55 115.96 2ajc n ASP 488 Ca 0.00 -0.44 -0.40 0.00 2.57 0.00 0.00 54.79 56.52 2ajc n ASP 488 Cb 0.12 -4.22 -0.05 0.00 1.84 0.00 0.00 41.12 38.81 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 -6.08 4.68 0.59 -1.24 2.47 -1.21 -4.85 119.74 114.11 2ajc s LYS 489 Ca 0.48 1.70 0.30 0.00 -1.56 0.00 0.00 55.97 56.89 2ajc s LYS 489 Cb -0.21 -3.18 1.84 0.00 -1.46 0.00 0.00 37.83 34.82 2ajc s LYS 489 CO 0.60 0.28 2.26 1.49 0.16 0.00 0.00 175.35 180.14 2ajc h GLU 490 N 3.84 0.00 0.00 4.03 4.57 -1.93 -2.87 114.58 122.22 2ajc h GLU 490 Ca -0.46 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 2ajc h GLU 490 Cb 1.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 2ajc h GLU 490 CO 0.67 0.01 0.00 1.28 -1.18 0.00 0.00 179.01 179.78 2ajc n LEU 491 N -3.80 0.00 -3.60 1.64 4.32 -1.22 -4.13 117.00 110.20 2ajc n LEU 491 Ca -0.03 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 55.92 2ajc n LEU 491 Cb 0.09 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 41.87 2ajc n LEU 491 CO 0.27 0.00 1.04 0.00 -1.22 0.00 0.00 177.39 177.48 2ajc s ARG 492 N 0.00 0.27 -0.25 3.23 1.70 -1.16 -5.01 118.95 117.73 2ajc s ARG 492 Ca 0.00 -0.10 -0.15 0.00 -0.47 0.00 0.00 55.73 55.00 2ajc s ARG 492 Cb 0.00 0.12 -0.04 0.00 -0.57 0.00 0.00 34.95 34.46 2ajc s ARG 492 CO 0.00 -0.12 0.39 0.08 -1.08 0.00 0.00 175.30 174.58 2ajc s VAL 493 N -2.36 5.17 -0.10 4.99 1.01 -1.26 -1.13 120.40 126.73 2ajc s VAL 493 Ca 0.10 0.64 -0.16 0.00 0.00 0.00 0.00 61.98 62.56 2ajc s VAL 493 Cb -0.01 -3.72 -0.28 0.00 0.00 0.00 0.00 36.38 32.38 2ajc s VAL 493 CO -0.04 0.18 0.60 -0.07 0.00 0.00 0.00 175.10 175.77 2ajc h LEU 494 N 8.29 0.39 -7.14 3.92 3.38 -0.74 -3.47 115.31 119.94 2ajc h LEU 494 Ca -0.33 -0.86 -0.09 0.00 0.09 0.00 0.00 57.88 56.68 2ajc h LEU 494 Cb 1.16 -0.13 -0.27 0.00 0.09 0.00 0.00 40.66 41.51 2ajc h LEU 494 CO 0.68 1.59 -0.34 -0.70 0.09 0.00 0.00 178.44 179.76 2ajc s GLU 495 N -2.47 0.35 0.00 1.13 2.56 -0.89 -4.99 118.70 114.39 2ajc s GLU 495 Ca -0.19 0.99 0.07 0.00 0.00 0.00 0.00 54.97 55.84 2ajc s GLU 495 Cb 0.04 0.26 0.07 0.00 2.00 0.00 0.00 34.13 36.50 2ajc s GLU 495 CO 0.77 -0.23 0.78 -0.40 -0.56 0.00 0.00 175.26 175.62 2ajc n ASP 496 N 5.12 1.70 -2.36 -1.70 5.75 -1.26 -0.27 116.55 123.54 2ajc n ASP 496 Ca -0.12 -1.39 -0.18 0.00 -0.01 0.00 0.00 54.79 53.09 2ajc n ASP 496 Cb 0.51 -0.02 -0.01 0.00 -1.03 0.00 0.00 41.12 40.56 2ajc n ASP 496 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2ajc n ASN 497 N 0.33 -5.33 0.18 -1.12 3.02 -1.26 -4.85 115.26 106.23 2ajc n ASN 497 Ca 0.04 0.07 0.12 0.00 -0.03 0.00 0.00 54.58 54.78 2ajc n ASN 497 Cb 0.19 -4.47 0.66 0.00 -0.61 0.00 0.00 39.78 35.56 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 0.00 0.00 -0.30 6.41 4.64 -1.95 -1.14 113.55 121.22 2ajc h SER 498 Ca -0.44 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.83 2ajc h SER 498 Cb 1.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 2ajc h SER 498 CO 0.52 0.00 -0.04 0.00 -0.87 0.00 0.00 176.83 176.44 2ajc h ALA 499 N 1.91 0.40 -0.60 5.18 0.00 -1.97 -1.28 119.26 122.91 2ajc h ALA 499 Ca 0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 2ajc h ALA 499 Cb 0.32 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2ajc h ALA 499 CO -0.00 0.20 0.27 1.25 0.00 0.00 0.00 179.25 180.97 2ajc h LEU 500 N 0.33 0.80 -0.46 0.00 5.85 -1.55 -2.15 115.31 118.13 2ajc h LEU 500 Ca 0.08 -0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.72 2ajc h LEU 500 Cb 0.51 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 2ajc h LEU 500 CO 0.02 0.72 0.15 -0.78 -0.34 0.00 0.00 178.44 178.22 2ajc h ASP 501 N 0.83 0.15 -0.53 1.25 3.58 -1.03 -0.04 116.42 120.62 2ajc h ASP 501 Ca 0.20 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.71 2ajc h ASP 501 Cb 0.15 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.22 2ajc h ASP 501 CO -0.02 0.12 0.33 0.50 -2.88 0.00 0.00 179.24 177.29 2ajc h LYS 502 N 0.32 0.71 -0.75 0.28 1.63 -0.93 -2.76 116.57 115.08 2ajc h LYS 502 Ca 0.22 -0.06 -0.05 0.00 -0.85 0.00 0.00 60.65 59.91 2ajc h LYS 502 Cb 0.23 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.67 2ajc h LYS 502 CO -0.23 0.50 0.27 0.52 -3.45 0.00 0.00 179.45 177.07 2ajc h MET 503 N 0.72 1.13 0.00 1.90 2.86 -0.76 -3.09 114.93 117.69 2ajc h MET 503 Ca 0.19 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2ajc h MET 503 Cb -0.04 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.44 2ajc h MET 503 CO -0.04 0.94 0.00 1.28 1.06 0.00 0.00 176.91 180.15 2ajc n LEU 504 N -4.27 0.59 0.26 1.22 4.77 -0.09 -3.13 117.00 116.35 2ajc n LEU 504 Ca 0.07 0.61 0.17 0.00 -0.03 0.00 0.00 56.01 56.82 2ajc n LEU 504 Cb 0.20 -0.48 0.67 0.00 -2.33 0.00 0.00 43.42 41.48 2ajc n LEU 504 CO 0.41 -0.37 0.98 0.06 -1.33 0.00 0.00 177.39 177.14 2ajc h GLN 505 N 0.00 0.00 -0.02 3.23 3.07 -1.41 -2.46 115.11 117.52 2ajc h GLN 505 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2ajc h GLN 505 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.04 2ajc h GLN 505 CO 0.00 0.00 -0.06 -3.47 0.09 0.00 0.00 178.83 175.39 2ajc n ASP 506 N -2.99 1.93 -4.51 0.06 4.64 -1.18 -4.89 116.55 109.61 2ajc n ASP 506 Ca 0.01 -1.58 -0.33 0.00 -1.38 0.00 0.00 54.79 51.51 2ajc n ASP 506 Cb 0.29 0.05 -0.12 0.00 -1.04 0.00 0.00 41.12 40.30 2ajc n ASP 506 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 2ajc s VAL 507 N -2.09 3.24 -1.05 5.18 0.11 -0.93 -3.95 120.40 120.91 2ajc s VAL 507 Ca 0.32 -0.67 -0.23 0.00 -2.93 0.00 0.00 61.98 58.47 2ajc s VAL 507 Cb 0.20 -2.29 0.01 0.00 -1.53 0.00 0.00 36.38 32.77 2ajc s VAL 507 CO 0.36 0.58 1.72 -1.10 -3.33 0.00 0.00 175.10 173.33 2ajc s GLN 508 N -0.80 3.19 0.28 1.54 -0.21 1.00 -4.96 119.66 119.70 2ajc s GLN 508 Ca 0.12 -1.02 -0.23 0.00 0.02 0.00 0.00 55.36 54.25 2ajc s GLN 508 Cb -0.11 -5.28 -0.09 0.00 1.00 0.00 0.00 33.01 28.53 2ajc s GLN 508 CO 0.01 -2.82 0.84 -1.64 -2.12 0.00 0.00 175.29 169.57 2ajc s MET 509 N 5.67 4.43 0.81 2.91 -1.94 -1.26 -4.35 119.30 125.57 2ajc s MET 509 Ca 0.58 1.11 -0.12 0.00 -1.71 0.00 0.00 55.69 55.55 2ajc s MET 509 Cb -0.01 -2.83 0.08 0.00 2.01 0.00 0.00 34.83 34.08 2ajc s MET 509 CO -0.01 0.33 1.16 -1.25 -0.01 0.00 0.00 175.02 175.24 2ajc s PRO 510 N -2.04 1.96 0.04 2.03 0.04 -1.26 -4.33 135.00 131.44 2ajc s PRO 510 Ca 0.47 0.19 0.07 0.00 0.04 0.00 0.00 61.00 61.77 2ajc s PRO 510 Cb -0.18 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 2ajc s PRO 510 CO 0.22 -1.61 -0.19 -1.54 0.04 0.00 0.00 177.00 173.92 2ajc s SER 511 N -4.46 3.72 -0.23 6.66 1.04 -0.65 -4.92 113.70 114.86 2ajc s SER 511 Ca 0.62 -0.44 -0.07 0.00 0.48 0.00 0.00 55.95 56.54 2ajc s SER 511 Cb -0.12 -0.58 -0.03 0.00 0.10 0.00 0.00 66.02 65.39 2ajc s SER 511 CO 0.50 0.26 0.06 -0.75 0.98 0.00 0.00 173.24 174.29 2ajc s LYS 512 N -1.38 3.75 -0.03 4.02 2.20 -1.26 -0.53 119.74 126.51 2ajc s LYS 512 Ca 0.14 -0.44 0.05 0.00 -0.36 0.00 0.00 55.97 55.36 2ajc s LYS 512 Cb -0.10 -3.28 -0.01 0.00 -1.51 0.00 0.00 37.83 32.93 2ajc s LYS 512 CO 0.05 -0.03 -0.19 0.21 -0.36 0.00 0.00 175.35 175.02 2ajc s LYS 513 N 1.19 1.75 0.14 4.03 2.20 -0.26 -4.97 119.74 123.83 2ajc s LYS 513 Ca 0.04 -0.68 0.06 0.00 -0.36 0.00 0.00 55.97 55.03 2ajc s LYS 513 Cb -0.14 -1.60 -0.04 0.00 -1.51 0.00 0.00 37.83 34.54 2ajc s LYS 513 CO 0.03 0.35 0.01 -0.51 -0.36 0.00 0.00 175.35 174.87 2ajc s LEU 514 N -0.23 3.40 0.00 5.43 1.02 -1.26 -0.61 118.68 126.42 2ajc s LEU 514 Ca 0.02 -0.30 -0.14 0.00 0.02 0.00 0.00 54.13 53.74 2ajc s LEU 514 Cb -0.10 -2.08 0.05 0.00 0.02 0.00 0.00 46.19 44.08 2ajc s LEU 514 CO 0.01 0.12 0.66 -0.67 0.02 0.00 0.00 176.35 176.49 2ajc n ASP 515 N 0.13 -1.17 -4.28 2.29 4.64 -0.55 -5.00 116.55 112.61 2ajc n ASP 515 Ca -0.10 -1.64 -0.20 0.00 -1.38 0.00 0.00 54.79 51.47 2ajc n ASP 515 Cb 0.54 1.91 -0.11 0.00 -1.04 0.00 0.00 41.12 42.42 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 -2.25 1.56 0.07 5.18 1.01 -1.26 -0.95 120.40 123.76 2ajc s VAL 516 Ca 0.15 -1.76 0.03 0.00 0.00 0.00 0.00 61.98 60.40 2ajc s VAL 516 Cb -0.02 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 2ajc s VAL 516 CO 0.04 -0.32 -0.09 0.27 0.00 0.00 0.00 175.10 174.99 2ajc s ILE 517 N -1.94 0.76 -0.27 2.22 -4.36 -0.14 -4.95 121.20 112.51 2ajc s ILE 517 Ca 0.11 -1.39 -0.11 0.00 -0.26 0.00 0.00 60.65 59.00 2ajc s ILE 517 Cb -0.06 -1.04 -0.05 0.00 1.25 0.00 0.00 42.46 42.56 2ajc s ILE 517 CO 0.05 -0.47 0.20 0.21 0.24 0.00 0.00 174.94 175.16 2ajc s ASN 518 N -2.05 6.06 -0.15 4.36 2.47 -1.26 -0.64 114.94 123.74 2ajc s ASN 518 Ca -0.01 0.04 0.01 0.00 0.42 0.00 0.00 52.86 53.32 2ajc s ASN 518 Cb -0.06 -2.13 0.00 0.00 -1.45 0.00 0.00 41.25 37.62 2ajc s ASN 518 CO -0.00 -0.04 -0.18 -0.76 -3.72 0.00 0.00 177.10 172.40 2ajc s LEU 519 N 1.67 2.35 -1.32 3.21 1.43 0.45 -4.76 118.68 121.70 2ajc s LEU 519 Ca 0.08 -0.51 -0.02 0.00 -1.03 0.00 0.00 54.13 52.65 2ajc s LEU 519 Cb -0.16 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.56 2ajc s LEU 519 CO 0.10 0.09 0.05 0.00 0.23 0.00 0.00 176.35 176.82 2ajc n HIS 520 N 4.03 -1.04 -0.15 0.29 1.44 -1.26 -0.00 115.22 118.53 2ajc n HIS 520 Ca -0.19 0.52 0.00 0.00 -2.01 0.00 0.00 57.72 56.03 2ajc n HIS 520 Cb 0.52 -2.26 0.00 0.00 0.12 0.00 0.00 29.99 28.37 2ajc n HIS 520 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2ajc n GLY 521 N -2.19 1.77 3.54 -1.39 0.00 -1.26 -5.03 105.19 100.63 2ajc n GLY 521 Ca -0.24 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.83 3.41 -0.11 2.61 2.01 1.00 -5.10 115.64 116.62 2ajc s THR 522 Ca 0.00 -0.72 -0.26 0.00 0.31 0.00 0.00 61.69 61.02 2ajc s THR 522 Cb 0.00 -2.41 -0.02 0.00 0.01 0.00 0.00 72.50 70.08 2ajc s THR 522 CO 0.00 0.50 0.84 -1.59 -0.69 0.00 0.00 174.62 173.68 2ajc s LYS 523 N -1.05 4.39 0.06 4.92 -2.85 -1.26 -0.41 119.74 123.54 2ajc s LYS 523 Ca 0.14 1.08 0.06 0.00 -1.00 0.00 0.00 55.97 56.25 2ajc s LYS 523 Cb -0.11 -3.52 -0.03 0.00 -2.06 0.00 0.00 37.83 32.11 2ajc s LYS 523 CO 0.03 -0.18 -0.17 -0.06 0.10 0.00 0.00 175.35 175.08 2ajc s PHE 524 N 1.60 1.44 0.25 1.78 0.40 0.19 -4.96 117.98 118.68 2ajc s PHE 524 Ca 0.41 -0.40 -0.07 0.00 -0.60 0.00 0.00 56.93 56.27 2ajc s PHE 524 Cb -0.18 -0.83 -0.06 0.00 0.51 0.00 0.00 43.02 42.46 2ajc s PHE 524 CO 0.17 0.09 0.54 -1.58 0.70 0.00 0.00 175.22 175.13 2ajc s TRP 525 N -1.02 3.45 0.14 0.36 0.52 -1.26 -0.97 118.94 120.16 2ajc s TRP 525 Ca 0.03 0.75 -0.07 0.00 0.02 0.00 0.00 56.10 56.83 2ajc s TRP 525 Cb -0.09 -2.17 -0.02 0.00 -1.15 0.00 0.00 33.47 30.04 2ajc s TRP 525 CO 0.02 0.24 0.20 1.52 0.02 0.00 0.00 176.95 178.95 2ajc s TYR 526 N -1.92 0.47 0.04 -1.98 -0.85 -0.12 -1.77 117.35 111.22 2ajc s TYR 526 Ca 0.45 -0.86 0.02 0.00 -0.52 0.00 0.00 57.07 56.17 2ajc s TYR 526 Cb -0.11 -0.17 -0.02 0.00 0.38 0.00 0.00 41.96 42.03 2ajc s TYR 526 CO 0.25 -0.63 -0.08 1.14 -1.52 0.00 0.00 175.55 174.72 2ajc s GLN 527 N -3.97 0.54 -0.03 -3.49 -2.07 -0.32 -1.49 119.66 108.85 2ajc s GLN 527 Ca 0.16 -0.79 0.02 0.00 -1.82 0.00 0.00 55.36 52.93 2ajc s GLN 527 Cb 0.05 -0.29 0.01 0.00 -1.09 0.00 0.00 33.01 31.69 2ajc s GLN 527 CO -0.02 0.05 -0.07 -1.64 -1.32 0.00 0.00 175.29 172.29 2ajc s MET 528 N -1.70 0.81 -0.38 9.60 -1.94 0.22 -1.43 119.30 124.48 2ajc s MET 528 Ca -0.09 -0.23 -0.12 0.00 -1.71 0.00 0.00 55.69 53.55 2ajc s MET 528 Cb -0.09 -0.77 0.03 0.00 2.01 0.00 0.00 34.83 36.00 2ajc s MET 528 CO 0.00 0.07 0.22 0.42 -0.01 0.00 0.00 175.02 175.72 2ajc s ILE 529 N 0.30 4.69 -0.13 2.53 -1.09 0.71 -1.11 121.20 127.10 2ajc s ILE 529 Ca -0.04 -0.81 -0.10 0.00 -2.23 0.00 0.00 60.65 57.47 2ajc s ILE 529 Cb -0.09 -3.61 -0.05 0.00 -1.58 0.00 0.00 42.46 37.14 2ajc s ILE 529 CO 0.00 -0.24 0.20 -0.76 -1.23 0.00 0.00 174.94 172.92 2ajc s LEU 530 N 1.58 4.33 0.65 2.97 1.43 0.32 -2.29 118.68 127.67 2ajc s LEU 530 Ca 0.03 0.49 -0.18 0.00 -1.03 0.00 0.00 54.13 53.44 2ajc s LEU 530 Cb -0.19 -2.20 -0.01 0.00 0.03 0.00 0.00 46.19 43.82 2ajc s LEU 530 CO 0.07 0.29 1.19 -2.65 0.23 0.00 0.00 176.35 175.48 2ajc n PRO 531 N 2.61 0.96 -1.04 1.29 -0.02 -1.26 -1.63 135.00 135.92 2ajc n PRO 531 Ca -0.17 0.38 -0.32 0.00 -2.02 0.00 0.00 63.50 61.38 2ajc n PRO 531 Cb 0.53 -2.42 0.13 0.00 -0.02 0.00 0.00 33.50 31.72 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 -3.28 1.61 -1.44 0.52 0.02 -1.26 -3.23 135.00 127.94 2ajc s PRO 532 Ca 0.80 1.55 -0.00 0.00 0.02 0.00 0.00 61.00 63.37 2ajc s PRO 532 Cb -0.38 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.35 2ajc s PRO 532 CO 0.43 -2.19 0.32 0.72 -0.33 0.00 0.00 177.00 175.95 2ajc n HIS 533 N -3.61 -1.56 -1.68 6.54 8.25 -1.26 -4.79 115.22 117.10 2ajc n HIS 533 Ca 0.12 0.72 -0.44 0.00 -0.26 0.00 0.00 57.72 57.85 2ajc n HIS 533 Cb 0.52 -3.53 -0.04 0.00 1.12 0.00 0.00 29.99 28.06 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 -4.44 2.51 -3.56 4.41 7.35 -1.20 -4.95 117.46 117.58 2ajc n PHE 534 Ca -0.32 -0.05 -0.41 0.00 -0.76 0.00 0.00 57.45 55.92 2ajc n PHE 534 Cb 0.69 -2.69 -0.09 0.00 0.35 0.00 0.00 39.48 37.74 2ajc n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2ajc s ASP 535 N 2.63 5.73 0.66 -2.13 3.68 -1.26 -4.95 116.67 121.02 2ajc s ASP 535 Ca 0.83 -1.62 0.34 0.00 2.13 0.00 0.00 52.55 54.24 2ajc s ASP 535 Cb -0.56 -2.02 1.88 0.00 -1.45 0.00 0.00 42.92 40.77 2ajc s ASP 535 CO 0.40 -0.61 2.07 0.11 0.13 0.00 0.00 175.17 177.27 2ajc h LYS 536 N 8.47 0.00 0.00 4.34 6.56 -1.98 -0.25 116.57 133.71 2ajc h LYS 536 Ca -0.23 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.36 2ajc h LYS 536 Cb 1.08 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.74 2ajc h LYS 536 CO 0.81 0.00 -0.24 -1.13 -2.06 0.00 0.00 179.45 176.83 2ajc n SER 537 N -2.99 0.35 -4.90 0.86 3.41 -1.26 -4.46 113.62 104.63 2ajc n SER 537 Ca -0.02 0.22 -0.29 0.00 -0.26 0.00 0.00 58.87 58.52 2ajc n SER 537 Cb 0.29 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 63.99 2ajc n SER 537 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2ajc s LYS 538 N -3.03 3.66 -0.42 4.33 2.20 -0.11 -5.04 119.74 121.32 2ajc s LYS 538 Ca 0.12 0.06 -0.08 0.00 -0.36 0.00 0.00 55.97 55.71 2ajc s LYS 538 Cb 0.17 -2.63 0.09 0.00 -1.51 0.00 0.00 37.83 33.95 2ajc s LYS 538 CO 0.62 0.20 0.25 0.15 -0.36 0.00 0.00 175.35 176.21 2ajc s LYS 539 N -3.51 2.48 0.22 4.03 1.02 -1.26 -4.40 119.74 118.32 2ajc s LYS 539 Ca 0.45 -1.56 -0.21 0.00 0.02 0.00 0.00 55.97 54.66 2ajc s LYS 539 Cb -0.11 -3.75 -0.08 0.00 -0.52 0.00 0.00 37.83 33.37 2ajc s LYS 539 CO 0.29 -1.00 0.74 0.71 -0.92 0.00 0.00 175.35 175.18 2ajc s TYR 540 N 1.36 3.69 0.70 3.18 1.51 -0.46 -4.28 117.35 123.05 2ajc s TYR 540 Ca 0.04 1.45 -0.13 0.00 -1.01 0.00 0.00 57.07 57.42 2ajc s TYR 540 Cb -0.23 -2.66 0.02 0.00 -0.11 0.00 0.00 41.96 38.98 2ajc s TYR 540 CO 0.00 0.36 1.10 -1.25 -1.11 0.00 0.00 175.55 174.66 2ajc s PRO 541 N -1.84 2.59 -0.04 -1.71 0.04 -1.26 -0.06 135.00 132.71 2ajc s PRO 541 Ca 0.42 1.30 0.03 0.00 0.04 0.00 0.00 61.00 62.79 2ajc s PRO 541 Cb -0.18 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.44 2ajc s PRO 541 CO 0.22 -1.41 -0.13 -1.17 0.04 0.00 0.00 177.00 174.56 2ajc s LEU 542 N -5.28 1.77 -0.14 -3.56 0.20 -0.52 -1.46 118.68 109.69 2ajc s LEU 542 Ca 0.65 -0.28 0.02 0.00 0.69 0.00 0.00 54.13 55.21 2ajc s LEU 542 Cb -0.19 -0.78 0.01 0.00 -0.43 0.00 0.00 46.19 44.79 2ajc s LEU 542 CO 0.47 0.08 -0.21 -0.22 -0.29 0.00 0.00 176.35 176.19 2ajc s LEU 543 N 0.31 2.18 -0.23 -0.68 0.20 0.97 -1.22 118.68 120.21 2ajc s LEU 543 Ca -0.07 -0.57 -0.14 0.00 0.69 0.00 0.00 54.13 54.03 2ajc s LEU 543 Cb -0.12 -1.47 -0.04 0.00 -0.43 0.00 0.00 46.19 44.13 2ajc s LEU 543 CO 0.02 0.09 0.32 -0.63 -0.29 0.00 0.00 176.35 175.85 2ajc s ILE 544 N 0.78 5.24 -0.25 6.68 -1.09 -0.25 -0.20 121.20 132.12 2ajc s ILE 544 Ca -0.07 0.51 -0.09 0.00 -2.23 0.00 0.00 60.65 58.76 2ajc s ILE 544 Cb -0.16 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 37.03 2ajc s ILE 544 CO -0.01 0.26 0.13 -0.70 -1.23 0.00 0.00 174.94 173.38 2ajc s GLU 545 N 1.41 3.86 0.11 2.79 2.12 -0.02 -0.64 118.70 128.33 2ajc s GLU 545 Ca 0.14 -0.38 0.09 0.00 0.36 0.00 0.00 54.97 55.19 2ajc s GLU 545 Cb -0.15 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.74 2ajc s GLU 545 CO 0.07 -0.09 -0.24 0.54 -0.54 0.00 0.00 175.26 175.00 2ajc s VAL 546 N 1.44 1.97 0.00 3.70 0.11 0.43 -4.45 120.40 123.60 2ajc s VAL 546 Ca 0.06 -1.61 0.00 0.00 -2.93 0.00 0.00 61.98 57.50 2ajc s VAL 546 Cb -0.15 -1.75 0.00 0.00 -1.53 0.00 0.00 36.38 32.95 2ajc s VAL 546 CO 0.06 0.04 0.00 0.00 -3.33 0.00 0.00 175.10 171.87 2ajc n TYR 547 N 1.08 0.00 -1.19 1.54 -0.00 -1.26 -4.22 117.16 113.12 2ajc n TYR 547 Ca -0.19 0.00 -0.07 0.00 -0.00 0.00 0.00 57.90 57.65 2ajc n TYR 547 Cb 0.53 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.84 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 -1.15 -0.10 -1.62 2.98 0.00 -1.26 -3.06 120.51 116.30 2ajc n ALA 548 Ca 0.00 0.11 -0.30 0.00 0.00 0.00 0.00 53.44 53.25 2ajc n ALA 548 Cb 0.00 -1.20 0.09 0.00 0.00 0.00 0.00 19.45 18.34 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 1.61 0.03 0.00 0.00 -1.26 -4.84 107.32 100.42 2ajc s GLY 549 Ca 0.00 -0.32 -0.33 0.00 0.00 0.00 0.00 44.72 44.07 2ajc s GLY 549 CO 0.00 0.13 1.78 -1.55 0.00 0.00 0.00 173.10 173.46 2ajc n PRO 550 N -3.43 2.30 -1.10 2.90 -0.04 -1.26 -0.40 135.00 133.96 2ajc n PRO 550 Ca 0.07 0.84 -0.03 0.00 -0.04 0.00 0.00 63.50 64.33 2ajc n PRO 550 Cb 0.57 -2.67 -0.01 0.00 -0.04 0.00 0.00 33.50 31.35 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 -2.41 4.90 -0.28 0.00 1.04 0.46 -3.69 113.70 113.73 2ajc s SER 552 Ca 0.00 1.79 -0.02 0.00 0.48 0.00 0.00 55.95 58.20 2ajc s SER 552 Cb 0.00 -2.52 0.12 0.00 0.10 0.00 0.00 66.02 63.72 2ajc s SER 552 CO 0.00 -1.77 0.23 -1.58 0.98 0.00 0.00 173.24 171.10 2ajc s GLN 553 N -4.80 0.26 0.11 4.02 0.74 -1.26 -0.78 119.66 117.95 2ajc s GLN 553 Ca 0.61 -0.21 0.21 0.00 0.05 0.00 0.00 55.36 56.02 2ajc s GLN 553 Cb -0.17 -0.90 -0.11 0.00 1.10 0.00 0.00 33.01 32.93 2ajc s GLN 553 CO 0.53 -0.97 0.84 1.63 -0.55 0.00 0.00 175.29 176.76 2ajc n LYS 554 N 5.29 0.62 -3.50 1.67 4.76 -1.26 -4.82 118.16 120.93 2ajc n LYS 554 Ca -0.04 0.05 -0.41 0.00 -2.87 0.00 0.00 58.31 55.04 2ajc n LYS 554 Cb 0.45 -1.74 -0.10 0.00 -1.84 0.00 0.00 35.03 31.81 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 -3.32 5.27 0.32 -0.18 1.01 -1.26 -4.93 120.40 117.30 2ajc s VAL 555 Ca -0.03 -0.29 -0.08 0.00 0.00 0.00 0.00 61.98 61.57 2ajc s VAL 555 Cb 0.10 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.71 2ajc s VAL 555 CO 0.83 -0.09 0.53 1.51 0.00 0.00 0.00 175.10 177.87 2ajc s ASP 556 N 1.72 0.40 -0.34 3.32 1.47 -1.26 -4.44 116.67 117.54 2ajc s ASP 556 Ca 0.06 -1.23 0.07 0.00 1.18 0.00 0.00 52.55 52.63 2ajc s ASP 556 Cb -0.18 0.67 0.66 0.00 -0.34 0.00 0.00 42.92 43.73 2ajc s ASP 556 CO 0.11 -1.31 1.76 0.35 0.68 0.00 0.00 175.17 176.76 2ajc n THR 557 N -0.49 2.83 -2.80 2.11 -2.24 -0.89 -4.95 114.28 107.84 2ajc n THR 557 Ca -0.02 -1.57 -0.40 0.00 -2.27 0.00 0.00 64.05 59.79 2ajc n THR 557 Cb 0.61 -0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 68.35 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 -2.85 4.18 -0.11 2.28 1.01 -1.26 -1.09 120.40 122.55 2ajc s VAL 558 Ca 0.51 2.00 -0.24 0.00 0.00 0.00 0.00 61.98 64.25 2ajc s VAL 558 Cb 0.42 -4.29 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 2ajc s VAL 558 CO 0.12 0.49 0.76 0.12 0.00 0.00 0.00 175.10 176.58 2ajc s PHE 559 N -1.05 3.50 0.01 5.22 5.36 -0.02 -4.90 117.98 126.10 2ajc s PHE 559 Ca 0.40 1.25 0.01 0.00 -0.96 0.00 0.00 56.93 57.63 2ajc s PHE 559 Cb -0.25 -2.90 -0.01 0.00 -0.34 0.00 0.00 43.02 39.52 2ajc s PHE 559 CO 0.30 -0.06 -0.03 1.03 -1.46 0.00 0.00 175.22 175.00 2ajc s ARG 560 N 1.42 0.24 -0.54 10.12 0.52 -1.26 -4.92 118.95 124.53 2ajc s ARG 560 Ca 0.38 -0.23 -0.10 0.00 -0.52 0.00 0.00 55.73 55.26 2ajc s ARG 560 Cb -0.17 -0.15 0.14 0.00 0.52 0.00 0.00 34.95 35.28 2ajc s ARG 560 CO 0.16 0.04 0.43 -0.51 0.02 0.00 0.00 175.30 175.43 2ajc s LEU 561 N -0.41 5.84 0.00 2.53 1.02 -1.26 -4.87 118.68 121.54 2ajc s LEU 561 Ca -0.03 -2.09 0.01 0.00 0.02 0.00 0.00 54.13 52.05 2ajc s LEU 561 Cb -0.03 -2.04 -0.00 0.00 0.02 0.00 0.00 46.19 44.13 2ajc s LEU 561 CO -0.00 -0.67 0.04 -1.54 0.02 0.00 0.00 176.35 174.20 2ajc n SER 562 N 4.69 2.14 -0.36 2.29 3.41 -1.26 -4.98 113.62 119.56 2ajc n SER 562 Ca -0.04 -2.46 -0.02 0.00 -0.26 0.00 0.00 58.87 56.09 2ajc n SER 562 Cb 0.41 0.43 0.13 0.00 -0.26 0.00 0.00 64.21 64.92 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 1.29 1.23 -0.54 7.33 7.01 -1.96 -1.65 115.95 128.67 2ajc h TRP 563 Ca -0.25 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.77 2ajc h TRP 563 Cb 0.83 -0.41 -0.03 0.00 -2.10 0.00 0.00 29.16 27.45 2ajc h TRP 563 CO 0.00 0.78 0.28 0.00 -2.79 0.00 0.00 178.44 176.71 2ajc h ALA 564 N 1.39 1.49 -0.57 2.65 0.00 -1.98 -0.41 119.26 121.82 2ajc h ALA 564 Ca 0.36 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.22 2ajc h ALA 564 Cb -0.15 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.37 2ajc h ALA 564 CO -0.08 0.42 0.30 1.15 0.00 0.00 0.00 179.25 181.04 2ajc h THR 565 N 0.75 0.96 -0.24 0.00 2.02 -1.64 -0.81 112.91 113.95 2ajc h THR 565 Ca 0.19 -0.20 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 2ajc h THR 565 Cb 0.04 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 66.77 2ajc h THR 565 CO -0.03 0.10 0.04 0.22 0.37 0.00 0.00 175.52 176.22 2ajc h TYR 566 N 0.57 0.42 -0.87 3.16 3.20 -1.19 0.16 116.97 122.43 2ajc h TYR 566 Ca 0.26 -0.06 0.07 0.00 3.14 0.00 0.00 58.73 62.13 2ajc h TYR 566 Cb 0.16 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.25 2ajc h TYR 566 CO -0.09 0.52 0.54 -0.07 -1.64 0.00 0.00 178.16 177.41 2ajc h LEU 567 N 0.20 0.83 0.00 2.82 3.38 -0.57 -0.45 115.31 121.53 2ajc h LEU 567 Ca 0.07 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2ajc h LEU 567 Cb 0.32 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2ajc h LEU 567 CO 0.00 0.52 -0.03 0.00 0.09 0.00 0.00 178.44 179.03 2ajc h ALA 568 N 1.42 0.00 -0.11 1.53 0.00 -1.06 -1.70 119.26 119.34 2ajc h ALA 568 Ca 0.39 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2ajc h ALA 568 Cb 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2ajc h ALA 568 CO -0.18 -0.05 0.06 1.03 0.00 0.00 0.00 179.25 180.10 2ajc h SER 569 N -0.82 0.14 0.05 0.00 0.87 -0.52 -2.91 113.55 110.35 2ajc h SER 569 Ca -0.00 -0.09 -0.38 0.00 -1.23 0.00 0.00 61.79 60.09 2ajc h SER 569 Cb 0.88 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.75 2ajc h SER 569 CO 0.01 0.19 -2.30 0.41 -0.53 0.00 0.00 176.83 174.61 2ajc n THR 570 N -4.96 1.60 0.98 2.23 -1.04 -0.19 -4.55 114.28 108.35 2ajc n THR 570 Ca -0.05 -0.59 0.12 0.00 -2.04 0.00 0.00 64.05 61.49 2ajc n THR 570 Cb 0.07 -1.55 0.24 0.00 -1.82 0.00 0.00 70.33 67.28 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 -3.37 2.17 -3.74 -2.82 -0.58 -0.90 -4.97 120.64 106.42 2ajc n GLU 571 Ca -0.41 -1.72 -0.24 0.00 -0.42 0.00 0.00 57.16 54.37 2ajc n GLU 571 Cb 1.01 -1.47 0.04 0.00 -0.57 0.00 0.00 31.44 30.44 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 1.03 -2.66 -4.41 1.62 5.03 -0.76 -4.94 115.26 110.16 2ajc n ASN 572 Ca 0.16 -0.78 -0.33 0.00 0.87 0.00 0.00 54.58 54.51 2ajc n ASN 572 Cb 0.52 -4.14 -0.14 0.00 -1.02 0.00 0.00 39.78 35.00 2ajc n ASN 572 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2ajc s ILE 573 N -3.52 3.30 0.04 2.41 1.01 -0.72 -4.28 121.20 119.45 2ajc s ILE 573 Ca 0.24 -0.58 -0.27 0.00 0.00 0.00 0.00 60.65 60.05 2ajc s ILE 573 Cb -0.12 -2.40 -0.05 0.00 0.01 0.00 0.00 42.46 39.90 2ajc s ILE 573 CO 0.81 0.52 0.83 -0.63 0.00 0.00 0.00 174.94 176.47 2ajc s ILE 574 N 0.28 4.73 -0.16 2.92 1.01 -0.53 -3.29 121.20 126.15 2ajc s ILE 574 Ca -0.08 1.77 -0.00 0.00 0.00 0.00 0.00 60.65 62.34 2ajc s ILE 574 Cb -0.15 -4.18 -0.00 0.00 0.01 0.00 0.00 42.46 38.13 2ajc s ILE 574 CO 0.05 0.31 -0.14 -0.69 0.00 0.00 0.00 174.94 174.47 2ajc s VAL 575 N 0.19 2.80 0.17 2.92 1.01 -0.97 -0.02 120.40 126.49 2ajc s VAL 575 Ca 0.42 -0.72 0.09 0.00 0.00 0.00 0.00 61.98 61.76 2ajc s VAL 575 Cb -0.21 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 2ajc s VAL 575 CO 0.25 0.51 -0.18 0.00 0.00 0.00 0.00 175.10 175.67 2ajc s ALA 576 N 0.83 2.06 0.03 5.51 0.00 0.72 -0.21 121.76 130.69 2ajc s ALA 576 Ca -0.04 -1.52 0.01 0.00 0.00 0.00 0.00 51.96 50.41 2ajc s ALA 576 Cb -0.15 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 2ajc s ALA 576 CO 0.00 0.24 -0.05 -1.12 0.00 0.00 0.00 175.76 174.83 2ajc s SER 577 N -2.72 0.52 -0.02 0.00 0.01 -0.51 -0.84 113.70 110.14 2ajc s SER 577 Ca 0.17 -0.55 -0.01 0.00 1.31 0.00 0.00 55.95 56.88 2ajc s SER 577 Cb -0.06 0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.27 2ajc s SER 577 CO 0.07 -0.27 0.04 0.12 0.41 0.00 0.00 173.24 173.60 2ajc s PHE 578 N -1.54 -0.01 -0.36 2.43 5.36 -1.26 -1.18 117.98 121.42 2ajc s PHE 578 Ca -0.12 0.13 -0.10 0.00 -0.96 0.00 0.00 56.93 55.87 2ajc s PHE 578 Cb -0.09 -0.11 0.02 0.00 -0.34 0.00 0.00 43.02 42.50 2ajc s PHE 578 CO -0.01 -0.06 0.18 -0.51 -1.46 0.00 0.00 175.22 173.36 2ajc s ASP 579 N 0.59 5.60 0.00 6.13 1.01 -0.73 -4.84 116.67 124.44 2ajc s ASP 579 Ca -0.05 -0.95 0.00 0.00 0.71 0.00 0.00 52.55 52.27 2ajc s ASP 579 Cb -0.07 -1.99 0.00 0.00 1.01 0.00 0.00 42.92 41.88 2ajc s ASP 579 CO -0.02 -0.34 0.00 0.61 0.21 0.00 0.00 175.17 175.63 2ajc n GLY 580 N 4.96 3.64 3.77 0.21 0.00 -1.26 -4.07 105.19 112.44 2ajc n GLY 580 Ca -0.12 -1.81 -0.41 0.00 0.00 0.00 0.00 46.02 43.68 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 3.40 4.13 0.00 1.61 0.52 -1.26 -1.64 118.95 125.71 2ajc s ARG 581 Ca 0.00 2.55 0.00 0.00 -0.52 0.00 0.00 55.73 57.76 2ajc s ARG 581 Cb 0.00 -2.99 0.00 0.00 0.52 0.00 0.00 34.95 32.48 2ajc s ARG 581 CO 0.00 -0.54 0.00 0.41 0.02 0.00 0.00 175.30 175.19 2ajc n GLY 582 N 0.95 2.74 3.76 -3.53 0.00 0.93 -4.03 105.19 106.01 2ajc n GLY 582 Ca 0.03 0.00 -0.30 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 -1.27 4.19 0.57 1.61 1.04 -0.65 0.08 113.70 119.26 2ajc s SER 583 Ca 0.00 1.65 0.07 0.00 0.48 0.00 0.00 55.95 58.15 2ajc s SER 583 Cb 0.00 -2.36 0.06 0.00 0.10 0.00 0.00 66.02 63.83 2ajc s SER 583 CO 0.00 -2.21 0.56 -0.83 0.98 0.00 0.00 173.24 171.74 2ajc s GLY 584 N -3.47 2.12 -1.11 7.32 0.00 0.04 -3.53 107.32 108.70 2ajc s GLY 584 Ca 0.62 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.75 2ajc s GLY 584 CO 0.56 -1.85 0.00 -1.72 0.00 0.00 0.00 173.10 170.09 2ajc n TYR 585 N -1.97 0.00 -1.79 1.90 4.01 -1.26 -4.85 117.16 113.19 2ajc n TYR 585 Ca 0.05 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.84 2ajc n TYR 585 Cb 0.63 -2.13 0.08 0.00 -0.31 0.00 0.00 39.34 37.61 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 -2.22 0.62 0.00 -0.72 6.02 -1.26 -4.47 117.38 115.35 2ajc n GLN 586 Ca -0.10 -2.05 0.00 0.00 -0.01 0.00 0.00 57.00 54.84 2ajc n GLN 586 Cb 0.40 -0.85 0.00 0.00 1.02 0.00 0.00 30.24 30.81 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 -0.47 0.99 0.23 1.08 0.00 -1.26 -4.59 105.19 101.17 2ajc n GLY 587 Ca 0.09 -1.71 0.09 0.00 0.00 0.00 0.00 46.02 44.49 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 -0.72 1.61 3.32 -0.93 -2.37 116.42 117.33 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 0.21 0.40 0.11 -1.72 0.00 0.00 179.24 178.24 2ajc h LYS 589 N 0.00 1.00 -0.01 3.56 1.57 -1.86 0.67 116.57 121.50 2ajc h LYS 589 Ca -0.00 -0.11 -0.10 0.00 -1.87 0.00 0.00 60.65 58.57 2ajc h LYS 589 Cb 0.47 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 32.59 2ajc h LYS 589 CO 0.03 0.74 -0.37 0.82 -0.57 0.00 0.00 179.45 180.10 2ajc h ILE 590 N 0.99 1.49 -0.32 1.86 2.04 -1.78 -3.14 117.51 118.65 2ajc h ILE 590 Ca 0.26 -1.94 -0.06 0.00 1.00 0.00 0.00 64.86 64.11 2ajc h ILE 590 Cb 0.02 2.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.73 2ajc h ILE 590 CO -0.04 0.55 -0.03 -0.03 0.00 0.00 0.00 178.15 178.60 2ajc h MET 591 N -0.32 0.58 0.00 2.37 4.05 -1.20 0.27 114.93 120.68 2ajc h MET 591 Ca -0.04 -0.20 0.00 0.00 -0.28 0.00 0.00 59.70 59.18 2ajc h MET 591 Cb 1.09 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.85 2ajc h MET 591 CO 0.07 0.73 0.00 0.72 0.23 0.00 0.00 176.91 178.66 2ajc n HIS 592 N -4.52 0.00 -0.05 1.39 8.25 0.23 -3.85 115.22 116.68 2ajc n HIS 592 Ca -0.02 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 57.61 2ajc n HIS 592 Cb 0.29 0.00 0.61 0.00 1.12 0.00 0.00 29.99 32.00 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 3.87 2.30 -0.61 -1.41 0.00 -1.45 -1.07 119.26 120.89 2ajc h ALA 593 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ajc h ALA 593 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2ajc h ALA 593 CO 0.00 -0.45 0.00 0.44 0.00 0.00 0.00 179.25 179.24 2ajc n ILE 594 N -4.43 1.32 -1.66 0.00 -5.35 -1.25 -4.93 119.36 103.06 2ajc n ILE 594 Ca 0.10 -0.98 -0.46 0.00 -0.27 0.00 0.00 62.75 61.15 2ajc n ILE 594 Cb 0.53 0.22 -0.04 0.00 -1.74 0.00 0.00 39.64 38.61 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 1.16 2.86 -0.76 7.28 4.05 -0.41 -1.05 115.26 128.40 2ajc n ASN 595 Ca 0.23 1.11 -0.09 0.00 0.45 0.00 0.00 54.58 56.27 2ajc n ASN 595 Cb 0.70 -1.41 -0.04 0.00 1.23 0.00 0.00 39.78 40.26 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 2.85 -1.72 -2.74 1.20 1.74 0.19 -4.82 116.66 113.36 2ajc n ARG 596 Ca 0.15 0.80 -0.10 0.00 -0.77 0.00 0.00 57.85 57.93 2ajc n ARG 596 Cb 0.29 -5.16 0.05 0.00 -1.02 0.00 0.00 32.46 26.61 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 -0.63 1.13 -1.78 5.56 1.85 -0.21 -4.87 116.66 117.70 2ajc n ARG 597 Ca -0.09 -2.87 -0.38 0.00 -1.00 0.00 0.00 57.85 53.51 2ajc n ARG 597 Cb 0.55 -1.01 0.05 0.00 -1.05 0.00 0.00 32.46 30.99 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 -3.00 3.80 0.00 2.89 1.43 -1.21 -2.83 118.68 119.75 2ajc s LEU 598 Ca 0.27 2.74 0.00 0.00 -1.03 0.00 0.00 54.13 56.11 2ajc s LEU 598 Cb 0.42 -4.33 0.00 0.00 0.03 0.00 0.00 46.19 42.31 2ajc s LEU 598 CO -0.01 -1.65 0.00 0.61 0.23 0.00 0.00 176.35 175.53 2ajc n GLY 599 N 0.75 0.73 0.00 -3.19 0.00 -1.26 -4.83 105.19 97.39 2ajc n GLY 599 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -2.40 0.00 -0.06 2.61 -2.24 -1.13 -4.65 114.28 106.41 2ajc n THR 600 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2ajc n THR 600 Cb 0.00 -0.33 0.29 0.00 -2.10 0.00 0.00 70.33 68.19 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 0.67 -0.23 4.78 0.04 -1.93 -0.02 116.94 120.25 2ajc h PHE 601 Ca 0.00 -0.04 -0.12 0.00 2.80 0.00 0.00 57.97 60.61 2ajc h PHE 601 Cb 0.00 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 37.93 2ajc h PHE 601 CO 0.00 0.54 -0.36 1.05 -0.60 0.00 0.00 178.31 178.94 2ajc h GLU 602 N 0.66 0.50 0.01 1.51 9.09 -1.91 -0.21 114.58 124.22 2ajc h GLU 602 Ca 0.16 -0.23 -0.00 0.00 0.05 0.00 0.00 59.36 59.33 2ajc h GLU 602 Cb 0.18 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.27 2ajc h GLU 602 CO -0.01 0.79 -0.00 0.28 0.05 0.00 0.00 179.01 180.12 2ajc h VAL 603 N 0.42 1.34 -0.97 -1.06 2.07 -1.69 -2.75 116.25 113.61 2ajc h VAL 603 Ca 0.04 -1.04 0.04 0.00 0.82 0.00 0.00 66.70 66.57 2ajc h VAL 603 Cb 0.83 2.04 -0.06 0.00 -1.52 0.00 0.00 31.29 32.58 2ajc h VAL 603 CO 0.07 0.27 0.63 -0.33 0.02 0.00 0.00 177.57 178.22 2ajc h GLU 604 N -0.45 1.17 -0.04 1.57 5.08 -0.96 -2.22 114.58 118.73 2ajc h GLU 604 Ca -0.00 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 2ajc h GLU 604 Cb 0.45 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2ajc h GLU 604 CO 0.00 0.78 -0.31 -0.44 -1.00 0.00 0.00 179.01 178.03 2ajc h ASP 605 N 1.21 0.08 -0.50 1.42 3.32 -1.04 -0.51 116.42 120.41 2ajc h ASP 605 Ca 0.39 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.30 2ajc h ASP 605 Cb 0.02 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2ajc h ASP 605 CO -0.13 0.40 -0.15 1.56 -1.72 0.00 0.00 179.24 179.19 2ajc h GLN 606 N 0.07 0.98 -0.08 3.56 1.08 -1.10 -0.91 115.11 118.72 2ajc h GLN 606 Ca 0.01 -0.39 -0.01 0.00 -1.45 0.00 0.00 58.65 56.81 2ajc h GLN 606 Cb 0.60 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.97 2ajc h GLN 606 CO 0.04 1.06 0.02 0.82 -0.95 0.00 0.00 178.83 179.82 2ajc h ILE 607 N 0.84 1.20 -0.72 2.54 2.04 -0.99 -1.64 117.51 120.78 2ajc h ILE 607 Ca 0.12 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 2ajc h ILE 607 Cb 0.72 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 2ajc h ILE 607 CO 0.06 0.18 0.40 -0.08 0.00 0.00 0.00 178.15 178.70 2ajc h GLU 608 N -0.10 1.00 -0.50 2.37 4.81 -1.08 -0.48 114.58 120.60 2ajc h GLU 608 Ca 0.02 -0.12 -0.04 0.00 -0.13 0.00 0.00 59.36 59.09 2ajc h GLU 608 Cb 0.26 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 2ajc h GLU 608 CO 0.00 0.75 0.14 0.00 -0.73 0.00 0.00 179.01 179.17 2ajc h ALA 609 N 1.20 0.66 -0.68 2.92 0.00 -1.13 -2.34 119.26 119.90 2ajc h ALA 609 Ca 0.25 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2ajc h ALA 609 Cb 0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2ajc h ALA 609 CO -0.04 0.34 0.12 1.15 0.00 0.00 0.00 179.25 180.81 2ajc h THR 610 N 0.69 1.26 -0.40 0.00 2.02 -0.92 -0.68 112.91 114.88 2ajc h THR 610 Ca 0.16 -1.03 0.05 0.00 0.77 0.00 0.00 66.41 66.36 2ajc h THR 610 Cb 0.30 0.62 -0.05 0.00 -1.74 0.00 0.00 68.15 67.28 2ajc h THR 610 CO -0.00 0.39 0.12 -0.09 0.37 0.00 0.00 175.52 176.31 2ajc h ARG 611 N 1.04 0.26 -0.41 6.66 2.43 -0.92 0.46 114.38 123.90 2ajc h ARG 611 Ca 0.21 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.37 2ajc h ARG 611 Cb 0.43 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 2ajc h ARG 611 CO 0.01 0.17 0.26 1.96 -1.51 0.00 0.00 179.97 180.87 2ajc h GLN 612 N 0.27 0.52 -0.99 0.20 4.20 -0.91 -2.28 115.11 116.12 2ajc h GLN 612 Ca 0.19 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.88 2ajc h GLN 612 Cb 0.19 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.80 2ajc h GLN 612 CO -0.21 0.35 0.66 0.74 -0.67 0.00 0.00 178.83 179.69 2ajc h PHE 613 N 0.54 1.24 -0.07 2.96 0.04 -0.06 -2.03 116.94 119.55 2ajc h PHE 613 Ca 0.15 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.97 2ajc h PHE 613 Cb -0.05 -0.42 -0.00 0.00 2.20 0.00 0.00 35.95 37.68 2ajc h PHE 613 CO -0.05 0.77 0.15 0.66 -0.60 0.00 0.00 178.31 179.23 2ajc h SER 614 N 1.33 0.00 1.19 2.17 4.64 0.46 -1.01 113.55 122.32 2ajc h SER 614 Ca 0.37 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.62 2ajc h SER 614 Cb -0.13 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 2ajc h SER 614 CO -0.09 0.00 -0.33 0.11 -0.87 0.00 0.00 176.83 175.66 2ajc h LYS 615 N 0.00 0.00 -6.66 4.77 1.79 -1.22 -3.41 116.57 111.84 2ajc h LYS 615 Ca 0.04 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.95 2ajc h LYS 615 Cb 0.33 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 31.05 2ajc h LYS 615 CO -0.00 0.33 0.80 -1.33 -1.08 0.00 0.00 179.45 178.17 2ajc n MET 616 N -3.33 2.41 0.29 3.15 2.81 -0.39 -4.85 117.12 117.22 2ajc n MET 616 Ca 0.01 0.86 0.17 0.00 -1.81 0.00 0.00 57.70 56.93 2ajc n MET 616 Cb 0.55 -2.61 0.96 0.00 -0.71 0.00 0.00 33.22 31.41 2ajc n MET 616 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 2ajc h GLY 617 N 5.07 0.00 -1.82 3.03 0.00 -1.89 -2.16 103.07 105.30 2ajc h GLY 617 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 2ajc h GLY 617 CO 0.82 0.00 0.00 1.97 0.00 0.00 0.00 176.54 179.33 2ajc n PHE 618 N -3.67 0.75 -4.76 5.60 1.16 -1.26 -4.69 117.46 110.58 2ajc n PHE 618 Ca -0.02 -0.32 -0.33 0.00 -1.87 0.00 0.00 57.45 54.91 2ajc n PHE 618 Cb 0.13 -0.09 -0.14 0.00 -1.61 0.00 0.00 39.48 37.77 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 -1.59 3.17 -0.65 1.97 1.01 -0.81 -1.36 120.40 122.13 2ajc s VAL 619 Ca 0.29 -0.64 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 2ajc s VAL 619 Cb 0.17 -2.31 0.07 0.00 0.00 0.00 0.00 36.38 34.31 2ajc s VAL 619 CO 0.17 0.54 0.96 -0.62 0.00 0.00 0.00 175.10 176.14 2ajc s ASP 620 N 0.06 6.18 0.02 3.32 -1.08 0.91 -4.69 116.67 121.38 2ajc s ASP 620 Ca -0.04 -0.98 0.10 0.00 -0.52 0.00 0.00 52.55 51.11 2ajc s ASP 620 Cb -0.14 -2.42 0.42 0.00 -1.46 0.00 0.00 42.92 39.32 2ajc s ASP 620 CO 0.04 -1.43 1.31 -0.90 0.52 0.00 0.00 175.17 174.71 2ajc n ASP 621 N 7.67 0.04 -0.55 -0.34 5.75 -1.26 -0.76 116.55 127.09 2ajc n ASP 621 Ca -0.04 0.51 0.13 0.00 -0.01 0.00 0.00 54.79 55.38 2ajc n ASP 621 Cb 0.45 -0.52 0.44 0.00 -1.03 0.00 0.00 41.12 40.47 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 -1.54 1.74 -3.23 0.11 4.01 -1.26 -4.39 118.16 113.60 2ajc n LYS 622 Ca 0.02 -1.10 -0.24 0.00 -0.51 0.00 0.00 58.31 56.48 2ajc n LYS 622 Cb 0.11 -1.45 -0.07 0.00 -0.51 0.00 0.00 35.03 33.11 2ajc n LYS 622 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2ajc n ARG 623 N 0.32 1.12 -5.03 1.97 1.74 0.06 -4.85 116.66 111.98 2ajc n ARG 623 Ca 0.18 -3.54 -0.32 0.00 -0.77 0.00 0.00 57.85 53.40 2ajc n ARG 623 Cb 0.36 -1.46 -0.15 0.00 -1.02 0.00 0.00 32.46 30.19 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 -1.58 2.56 0.31 0.55 1.01 -1.26 -1.44 121.20 121.34 2ajc s ILE 624 Ca 0.37 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 60.19 2ajc s ILE 624 Cb 0.18 -2.00 -0.06 0.00 0.01 0.00 0.00 42.46 40.59 2ajc s ILE 624 CO -0.09 0.56 0.03 0.00 0.00 0.00 0.00 174.94 175.44 2ajc s ALA 625 N -0.02 2.30 -0.10 9.38 0.00 -0.36 -0.41 121.76 132.54 2ajc s ALA 625 Ca -0.06 -2.00 -0.11 0.00 0.00 0.00 0.00 51.96 49.79 2ajc s ALA 625 Cb -0.15 0.55 0.03 0.00 0.00 0.00 0.00 23.12 23.56 2ajc s ALA 625 CO 0.05 -0.26 0.31 -1.50 0.00 0.00 0.00 175.76 174.36 2ajc s ILE 626 N -3.25 0.01 0.06 0.00 2.07 -0.93 -1.09 121.20 118.07 2ajc s ILE 626 Ca 0.34 -0.07 -0.09 0.00 -1.41 0.00 0.00 60.65 59.43 2ajc s ILE 626 Cb 0.08 -0.46 -0.00 0.00 0.13 0.00 0.00 42.46 42.20 2ajc s ILE 626 CO 0.14 -0.04 0.18 -1.66 -1.91 0.00 0.00 174.94 171.65 2ajc s TRP 627 N -0.04 0.12 0.06 3.50 1.48 0.19 -1.74 118.94 122.50 2ajc s TRP 627 Ca -0.02 -0.42 -0.27 0.00 -1.06 0.00 0.00 56.10 54.32 2ajc s TRP 627 Cb -0.03 -0.06 0.09 0.00 -1.16 0.00 0.00 33.47 32.31 2ajc s TRP 627 CO 0.01 -0.46 0.96 0.20 -4.06 0.00 0.00 176.95 173.60 2ajc s GLY 628 N -2.37 -0.35 -0.02 3.67 0.00 -0.99 -0.43 107.32 106.83 2ajc s GLY 628 Ca -0.01 0.62 0.08 0.00 0.00 0.00 0.00 44.72 45.41 2ajc s GLY 628 CO -0.06 0.18 -0.26 0.86 0.00 0.00 0.00 173.10 173.82 2ajc s TRP 629 N -3.12 2.34 0.00 1.90 -0.11 -1.26 -1.24 118.94 117.45 2ajc s TRP 629 Ca 0.09 -0.47 0.00 0.00 1.22 0.00 0.00 56.10 56.94 2ajc s TRP 629 Cb -0.01 -1.51 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 0.43 -4.62 0.00 0.00 176.95 172.66 2ajc n SER 630 N 2.50 0.00 -0.20 5.86 7.64 -0.14 -1.31 113.62 127.96 2ajc n SER 630 Ca -0.16 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.73 2ajc n SER 630 Cb 0.51 0.00 0.26 0.00 -1.01 0.00 0.00 64.21 63.97 2ajc n SER 630 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2ajc h TYR 631 N 0.00 0.91 -0.09 1.43 5.03 -1.86 0.12 116.97 122.51 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 -0.31 -0.01 0.00 1.55 0.00 0.00 36.73 37.96 2ajc h TYR 631 CO 0.00 0.57 -0.14 0.78 -1.32 0.00 0.00 178.16 178.05 2ajc h GLY 632 N 0.98 0.15 1.10 1.82 0.00 -1.12 0.43 103.07 106.42 2ajc h GLY 632 Ca 0.27 -0.08 -0.15 0.00 0.00 0.00 0.00 47.33 47.37 2ajc h GLY 632 CO -0.06 0.08 -0.31 -1.33 0.00 0.00 0.00 176.54 174.92 2ajc h GLY 633 N 0.63 1.01 0.95 4.60 0.00 -0.73 0.56 103.07 110.10 2ajc h GLY 633 Ca 0.03 -0.99 -0.01 0.00 0.00 0.00 0.00 47.33 46.36 2ajc h GLY 633 CO 0.02 0.89 -0.05 -1.82 0.00 0.00 0.00 176.54 175.58 2ajc h TYR 634 N 0.76 -0.14 -0.56 5.60 3.20 -0.56 -0.95 116.97 124.32 2ajc h TYR 634 Ca 0.08 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.89 2ajc h TYR 634 Cb 0.90 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 39.20 2ajc h TYR 634 CO 0.06 -0.04 0.14 0.28 -1.64 0.00 0.00 178.16 176.96 2ajc h VAL 635 N -0.20 1.25 -0.62 1.81 2.07 -0.88 0.77 116.25 120.44 2ajc h VAL 635 Ca -0.02 -0.87 0.09 0.00 0.82 0.00 0.00 66.70 66.72 2ajc h VAL 635 Cb 0.16 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 30.60 2ajc h VAL 635 CO 0.03 0.32 0.26 0.74 0.02 0.00 0.00 177.57 178.94 2ajc h THR 636 N 0.80 0.80 -0.25 2.57 2.02 -0.81 0.19 112.91 118.23 2ajc h THR 636 Ca 0.18 -0.16 -0.06 0.00 0.77 0.00 0.00 66.41 67.14 2ajc h THR 636 Cb 0.34 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2ajc h THR 636 CO 0.00 0.08 -0.09 0.28 0.37 0.00 0.00 175.52 176.17 2ajc h SER 637 N 0.46 0.52 -0.78 4.18 0.02 -0.65 -0.60 113.55 116.70 2ajc h SER 637 Ca 0.31 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2ajc h SER 637 Cb 0.36 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.71 2ajc h SER 637 CO -0.28 0.79 0.49 0.24 -1.14 0.00 0.00 176.83 176.93 2ajc h MET 638 N 0.24 1.05 -0.15 3.45 2.86 -0.48 0.05 114.93 121.96 2ajc h MET 638 Ca 0.06 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2ajc h MET 638 Cb 0.58 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 2ajc h MET 638 CO 0.03 0.72 0.00 0.28 1.06 0.00 0.00 176.91 179.00 2ajc h VAL 639 N 1.08 1.25 -0.20 -2.22 2.07 -0.39 -2.45 116.25 115.39 2ajc h VAL 639 Ca 0.29 -0.83 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 2ajc h VAL 639 Cb -0.08 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2ajc h VAL 639 CO -0.06 0.25 -0.02 -0.07 0.02 0.00 0.00 177.57 177.68 2ajc h LEU 640 N 0.00 0.28 -0.70 2.57 3.38 -0.87 -1.92 115.31 118.06 2ajc h LEU 640 Ca 0.04 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ajc h LEU 640 Cb 0.37 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2ajc h LEU 640 CO 0.01 0.35 0.00 0.61 0.09 0.00 0.00 178.44 179.50 2ajc n GLY 641 N -1.06 -0.14 0.08 0.83 0.00 -0.02 -3.98 105.19 100.89 2ajc n GLY 641 Ca -0.00 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 45.90 2ajc n GLY 641 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ajc n ALA 642 N -0.01 2.61 -2.81 4.61 0.00 -0.72 -4.66 120.51 119.53 2ajc n ALA 642 Ca 0.10 -0.14 -0.16 0.00 0.00 0.00 0.00 53.44 53.24 2ajc n ALA 642 Cb 0.19 -1.32 0.03 0.00 0.00 0.00 0.00 19.45 18.34 2ajc n ALA 642 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ajc n GLY 643 N 1.34 -0.18 0.18 0.00 0.00 -1.26 -4.91 105.19 100.36 2ajc n GLY 643 Ca 0.05 -0.13 0.07 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.02 0.00 0.00 1.61 4.64 -1.88 -3.47 113.55 113.43 2ajc h SER 644 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2ajc h SER 644 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2ajc h SER 644 CO 0.41 0.27 0.00 0.61 -0.87 0.00 0.00 176.83 177.25 2ajc n GLY 645 N 1.17 0.90 0.12 -0.77 0.00 -1.26 -4.89 105.19 100.46 2ajc n GLY 645 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 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 1.35 -3.25 1.61 2.07 -1.96 -3.46 116.25 112.61 2ajc h VAL 646 Ca 0.00 -2.91 -0.64 0.00 0.82 0.00 0.00 66.70 63.97 2ajc h VAL 646 Cb 0.00 2.91 -0.16 0.00 -1.52 0.00 0.00 31.29 32.53 2ajc h VAL 646 CO 0.00 0.86 -0.59 -0.36 0.02 0.00 0.00 177.57 177.49 2ajc s PHE 647 N -2.63 3.21 0.06 1.57 0.40 -1.26 -4.58 117.98 114.74 2ajc s PHE 647 Ca -0.07 0.07 -0.02 0.00 -0.60 0.00 0.00 56.93 56.31 2ajc s PHE 647 Cb 0.06 -1.96 -0.27 0.00 0.51 0.00 0.00 43.02 41.36 2ajc s PHE 647 CO 0.89 0.26 1.08 -0.22 0.70 0.00 0.00 175.22 177.93 2ajc h LYS 648 N 6.10 0.23 -2.90 0.44 3.64 -1.07 -3.46 116.57 119.56 2ajc h LYS 648 Ca -0.41 -0.39 0.08 0.00 -1.27 0.00 0.00 60.65 58.66 2ajc h LYS 648 Cb 1.18 0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 33.09 2ajc h LYS 648 CO 0.63 1.15 0.27 0.00 -2.27 0.00 0.00 179.45 179.23 2ajc s GLY 650 N -2.91 -0.40 -0.06 0.00 0.00 -0.75 -2.18 107.32 101.02 2ajc s GLY 650 Ca 0.11 0.62 0.01 0.00 0.00 0.00 0.00 44.72 45.46 2ajc s GLY 650 CO 0.05 0.19 -0.08 -0.42 0.00 0.00 0.00 173.10 172.84 2ajc s ILE 651 N -3.30 0.84 -0.14 0.90 1.01 -0.71 -1.86 121.20 117.94 2ajc s ILE 651 Ca 0.07 -0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.44 2ajc s ILE 651 Cb -0.01 -0.81 0.00 0.00 0.01 0.00 0.00 42.46 41.65 2ajc s ILE 651 CO -0.06 0.29 -0.18 0.00 0.00 0.00 0.00 174.94 175.00 2ajc s ALA 652 N 0.86 2.41 -0.19 9.38 0.00 -0.48 -2.34 121.76 131.41 2ajc s ALA 652 Ca -0.12 -1.04 -0.02 0.00 0.00 0.00 0.00 51.96 50.79 2ajc s ALA 652 Cb -0.15 -1.13 -0.00 0.00 0.00 0.00 0.00 23.12 21.84 2ajc s ALA 652 CO 0.01 0.02 -0.11 0.08 0.00 0.00 0.00 175.76 175.76 2ajc s VAL 653 N 0.74 2.93 -1.37 0.00 1.01 -0.37 -1.08 120.40 122.26 2ajc s VAL 653 Ca -0.07 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.21 2ajc s VAL 653 Cb -0.16 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 33.94 2ajc s VAL 653 CO 0.01 0.48 0.46 0.00 0.00 0.00 0.00 175.10 176.04 2ajc n ALA 654 N 4.44 -2.10 -1.80 5.51 0.00 0.82 -0.97 120.51 126.40 2ajc n ALA 654 Ca -0.19 -0.28 -0.33 0.00 0.00 0.00 0.00 53.44 52.64 2ajc n ALA 654 Cb 0.51 -1.82 -0.04 0.00 0.00 0.00 0.00 19.45 18.10 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 -6.53 3.95 0.34 0.00 0.04 -1.26 -3.04 135.00 128.50 2ajc s PRO 655 Ca 0.08 1.16 -0.26 0.00 0.04 0.00 0.00 61.00 62.02 2ajc s PRO 655 Cb -0.03 -2.13 -0.09 0.00 0.04 0.00 0.00 34.50 32.29 2ajc s PRO 655 CO 0.89 -0.28 1.03 0.08 0.04 0.00 0.00 177.00 178.76 2ajc s VAL 656 N -2.25 3.80 0.00 -0.36 1.01 -1.24 -4.58 120.40 116.78 2ajc s VAL 656 Ca 0.63 1.53 0.00 0.00 0.00 0.00 0.00 61.98 64.13 2ajc s VAL 656 Cb -0.12 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.40 2ajc s VAL 656 CO 0.22 0.15 0.00 -1.54 0.00 0.00 0.00 175.10 173.92 2ajc n SER 657 N 0.46 4.47 -3.66 3.32 3.41 -1.26 -4.16 113.62 116.20 2ajc n SER 657 Ca 0.02 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.56 2ajc n SER 657 Cb 0.48 0.89 -0.08 0.00 -0.26 0.00 0.00 64.21 65.24 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 -1.79 0.46 0.55 4.33 2.20 -1.26 -1.05 119.74 123.17 2ajc s LYS 658 Ca 0.00 1.10 0.23 0.00 -0.36 0.00 0.00 55.97 56.94 2ajc s LYS 658 Cb 0.00 0.34 1.51 0.00 -1.51 0.00 0.00 37.83 38.18 2ajc s LYS 658 CO 0.00 -0.20 2.19 -1.49 -0.36 0.00 0.00 175.35 175.48 2ajc h TRP 659 N 7.71 0.00 0.00 4.03 4.06 -1.88 -1.03 115.95 128.84 2ajc h TRP 659 Ca -0.23 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.72 2ajc h TRP 659 Cb 1.14 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.30 2ajc h TRP 659 CO 0.21 0.02 0.00 0.39 -3.56 0.00 0.00 178.44 175.50 2ajc n GLU 660 N -4.17 0.17 0.00 0.49 1.02 -1.26 -1.53 120.64 115.36 2ajc n GLU 660 Ca -0.03 0.53 0.12 0.00 -0.02 0.00 0.00 57.16 57.76 2ajc n GLU 660 Cb 0.10 -1.92 0.20 0.00 -0.02 0.00 0.00 31.44 29.80 2ajc n GLU 660 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2ajc n TYR 661 N -2.26 0.01 -2.60 -0.32 4.01 -0.39 -3.76 117.16 111.85 2ajc n TYR 661 Ca 0.00 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.53 2ajc n TYR 661 Cb 0.13 -0.22 0.05 0.00 -0.31 0.00 0.00 39.34 38.99 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 -3.00 2.64 0.61 -0.72 5.04 -0.58 -4.81 117.35 116.52 2ajc s TYR 662 Ca 0.10 -0.03 -0.16 0.00 -2.44 0.00 0.00 57.07 54.54 2ajc s TYR 662 Cb 0.17 -2.83 -0.03 0.00 0.35 0.00 0.00 41.96 39.63 2ajc s TYR 662 CO 0.72 -1.06 1.10 0.16 -1.34 0.00 0.00 175.55 175.13 2ajc s ASP 663 N -4.49 5.43 0.14 4.32 1.47 -1.26 -1.17 116.67 121.11 2ajc s ASP 663 Ca 0.59 2.01 -0.18 0.00 1.18 0.00 0.00 52.55 56.16 2ajc s ASP 663 Cb -0.09 -2.56 -0.00 0.00 -0.34 0.00 0.00 42.92 39.93 2ajc s ASP 663 CO 0.40 -1.41 1.76 0.77 0.68 0.00 0.00 175.17 177.37 2ajc h SER 664 N 0.47 0.18 0.35 2.11 4.64 -0.76 -1.87 113.55 118.67 2ajc h SER 664 Ca -0.48 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 60.85 2ajc h SER 664 Cb 1.24 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2ajc h SER 664 CO 0.56 0.14 -0.21 0.58 -0.87 0.00 0.00 176.83 177.03 2ajc h VAL 665 N 0.28 0.56 0.21 0.95 2.07 -1.93 -0.75 116.25 117.64 2ajc h VAL 665 Ca 0.12 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 2ajc h VAL 665 Cb 0.05 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 2ajc h VAL 665 CO -0.09 0.00 -0.10 0.22 0.02 0.00 0.00 177.57 177.61 2ajc h TYR 666 N -0.54 -0.27 -0.07 1.57 5.03 -1.91 -2.88 116.97 117.91 2ajc h TYR 666 Ca -0.04 -0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.28 2ajc h TYR 666 Cb 0.44 0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.80 2ajc h TYR 666 CO -0.09 0.07 -0.02 1.15 -1.32 0.00 0.00 178.16 177.95 2ajc h THR 667 N -0.64 0.92 0.00 1.81 2.02 -1.35 -2.64 112.91 113.04 2ajc h THR 667 Ca -0.03 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.09 2ajc h THR 667 Cb 0.46 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 2ajc h THR 667 CO 0.05 0.00 -0.30 -0.33 0.37 0.00 0.00 175.52 175.31 2ajc h GLU 668 N -0.00 0.00 -0.99 6.66 5.08 -1.24 0.15 114.58 124.24 2ajc h GLU 668 Ca 0.04 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.51 2ajc h GLU 668 Cb 0.06 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.23 2ajc h GLU 668 CO -0.08 0.30 0.62 -0.09 -1.00 0.00 0.00 179.01 178.76 2ajc h ARG 669 N 0.00 0.97 0.00 2.33 2.43 -1.23 -0.95 114.38 117.93 2ajc h ARG 669 Ca -0.00 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.05 2ajc h ARG 669 Cb 0.58 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 2ajc h ARG 669 CO 0.04 0.64 -1.99 0.66 -1.51 0.00 0.00 179.97 177.81 2ajc n TYR 670 N -4.62 0.00 0.13 2.20 4.01 -0.91 -4.61 117.16 113.35 2ajc n TYR 670 Ca 0.18 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.93 2ajc n TYR 670 Cb 0.33 -0.54 0.00 0.00 -0.31 0.00 0.00 39.34 38.82 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 -2.29 1.51 0.00 -0.72 2.81 0.48 0.54 117.12 119.45 2ajc n MET 671 Ca -0.08 -0.47 0.00 0.00 -1.81 0.00 0.00 57.70 55.34 2ajc n MET 671 Cb 0.63 -0.93 0.00 0.00 -0.71 0.00 0.00 33.22 32.21 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 0.45 0.14 3.87 3.03 0.00 -0.37 -4.62 105.19 107.69 2ajc n GLY 672 Ca 0.01 -0.95 -0.36 0.00 0.00 0.00 0.00 46.02 44.73 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 4.40 -0.40 0.99 1.43 -1.26 -4.31 118.68 119.53 2ajc s LEU 673 Ca 0.00 0.66 -0.06 0.00 -1.03 0.00 0.00 54.13 53.70 2ajc s LEU 673 Cb 0.00 -2.53 -0.18 0.00 0.03 0.00 0.00 46.19 43.51 2ajc s LEU 673 CO 0.00 0.30 2.96 -0.81 0.23 0.00 0.00 176.35 179.03 2ajc n PRO 674 N 1.49 2.08 -4.37 1.29 -0.04 -1.26 -1.36 135.00 132.82 2ajc n PRO 674 Ca -0.14 -1.15 -0.27 0.00 -0.04 0.00 0.00 63.50 61.90 2ajc n PRO 674 Cb 0.53 -2.14 -0.13 0.00 -0.04 0.00 0.00 33.50 31.73 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 1.73 2.13 0.48 0.52 -4.23 -1.26 -4.62 115.64 110.39 2ajc s THR 675 Ca 0.56 -1.77 0.17 0.00 -1.18 0.00 0.00 61.69 59.47 2ajc s THR 675 Cb 0.23 -1.92 0.33 0.00 1.34 0.00 0.00 72.50 72.49 2ajc s THR 675 CO -0.01 -0.00 2.02 1.55 -0.54 0.00 0.00 174.62 177.63 2ajc h PRO 676 N 3.76 0.22 0.00 3.99 0.13 -1.96 0.29 132.00 138.44 2ajc h PRO 676 Ca -0.49 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2ajc h PRO 676 Cb 1.18 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2ajc h PRO 676 CO 0.41 0.15 0.00 0.39 -0.23 0.00 0.00 178.00 178.72 2ajc n GLU 677 N -4.46 0.22 0.00 0.86 4.71 -1.26 -4.68 120.64 116.04 2ajc n GLU 677 Ca 0.07 0.36 0.00 0.00 -0.01 0.00 0.00 57.16 57.58 2ajc n GLU 677 Cb 0.37 -1.86 0.00 0.00 -1.01 0.00 0.00 31.44 28.94 2ajc n GLU 677 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2ajc n ASP 678 N -2.27 0.00 -0.30 1.62 2.03 0.01 -5.03 116.55 112.61 2ajc n ASP 678 Ca 0.03 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.41 2ajc n ASP 678 Cb 0.30 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 40.82 2ajc n ASP 678 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2ajc n ASN 679 N 0.00 1.75 -0.34 1.67 4.05 -0.47 -4.84 115.26 117.08 2ajc n ASN 679 Ca 0.00 -2.96 0.16 0.00 0.45 0.00 0.00 54.58 52.23 2ajc n ASN 679 Cb 0.00 -0.40 0.37 0.00 1.23 0.00 0.00 39.78 40.98 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 0.20 0.70 -1.07 1.20 5.85 -1.41 -1.84 115.31 118.94 2ajc h LEU 680 Ca -0.01 0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.86 2ajc h LEU 680 Cb 1.12 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 42.08 2ajc h LEU 680 CO 0.00 0.20 0.62 0.44 -0.34 0.00 0.00 178.44 179.37 2ajc h ASP 681 N 0.66 1.02 1.92 1.25 3.32 -1.88 -0.70 116.42 122.00 2ajc h ASP 681 Ca 0.60 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.64 2ajc h ASP 681 Cb 1.07 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.40 2ajc h ASP 681 CO -0.39 0.69 -0.01 1.88 -1.72 0.00 0.00 179.24 179.68 2ajc h TYR 682 N 1.18 0.00 -0.07 4.55 -1.99 -1.68 -2.74 116.97 116.22 2ajc h TYR 682 Ca 0.39 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 60.94 2ajc h TYR 682 Cb 0.05 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.79 2ajc h TYR 682 CO -0.00 0.00 -0.63 1.88 -0.00 0.00 0.00 178.16 179.41 2ajc h TYR 683 N 0.00 0.77 -0.20 4.88 0.05 -1.22 -3.12 116.97 118.14 2ajc h TYR 683 Ca 0.00 -0.37 -0.12 0.00 0.05 0.00 0.00 58.73 58.30 2ajc h TYR 683 Cb 0.97 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 38.59 2ajc h TYR 683 CO 0.00 1.17 -0.37 0.00 -1.05 0.00 0.00 178.16 177.91 2ajc h ARG 684 N 0.15 0.43 -0.62 4.88 3.08 -1.06 -3.13 114.38 118.12 2ajc h ARG 684 Ca -0.06 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.79 2ajc h ARG 684 Cb 1.29 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2ajc h ARG 684 CO 0.13 0.74 0.00 0.27 -1.07 0.00 0.00 179.97 180.04 2ajc n ASN 685 N -4.05 4.71 -0.75 7.04 6.94 -1.04 -4.13 115.26 123.98 2ajc n ASN 685 Ca -0.01 -2.48 0.07 0.00 -0.02 0.00 0.00 54.58 52.14 2ajc n ASN 685 Cb 0.48 -0.57 0.20 0.00 -2.36 0.00 0.00 39.78 37.53 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 1.01 3.38 -4.86 0.53 3.41 -1.18 -5.01 113.62 110.90 2ajc n SER 686 Ca 0.25 -2.51 -0.31 0.00 -0.26 0.00 0.00 58.87 56.05 2ajc n SER 686 Cb 0.89 -0.38 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 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 -1.91 4.71 0.19 6.66 -4.23 -1.26 -4.83 115.64 114.98 2ajc s THR 687 Ca 0.32 0.80 -0.02 0.00 -1.18 0.00 0.00 61.69 61.61 2ajc s THR 687 Cb 0.23 -3.72 -0.07 0.00 1.34 0.00 0.00 72.50 70.27 2ajc s THR 687 CO 0.12 -0.56 1.49 0.58 -0.54 0.00 0.00 174.62 175.71 2ajc h VAL 688 N 1.08 1.34 -0.51 2.29 2.07 -1.44 -3.08 116.25 117.99 2ajc h VAL 688 Ca -0.47 -1.90 0.11 0.00 0.82 0.00 0.00 66.70 65.26 2ajc h VAL 688 Cb 1.19 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.81 2ajc h VAL 688 CO 0.63 0.58 0.35 0.24 0.02 0.00 0.00 177.57 179.39 2ajc h MET 689 N 0.37 0.20 0.00 1.57 2.86 -1.93 0.12 114.93 118.13 2ajc h MET 689 Ca -0.01 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2ajc h MET 689 Cb 1.15 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.77 2ajc h MET 689 CO 0.11 0.14 0.00 0.66 1.06 0.00 0.00 176.91 178.88 2ajc h SER 690 N 0.21 0.00 -0.36 1.22 4.64 -1.89 -2.30 113.55 115.08 2ajc h SER 690 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2ajc h SER 690 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 2ajc h SER 690 CO -0.04 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.46 2ajc n ARG 691 N -2.39 3.10 -0.25 4.77 1.74 0.42 -4.77 116.66 119.29 2ajc n ARG 691 Ca -0.00 -2.57 0.06 0.00 -0.77 0.00 0.00 57.85 54.57 2ajc n ARG 691 Cb 0.12 -1.65 0.18 0.00 -1.02 0.00 0.00 32.46 30.09 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 2.31 0.93 -0.89 7.54 0.00 -1.45 -1.93 119.26 125.78 2ajc h ALA 692 Ca 0.00 0.19 0.13 0.00 0.00 0.00 0.00 54.91 55.23 2ajc h ALA 692 Cb 1.20 0.29 -0.09 0.00 0.00 0.00 0.00 17.79 19.20 2ajc h ALA 692 CO 0.15 -0.38 0.51 1.49 0.00 0.00 0.00 179.25 181.02 2ajc h GLU 693 N 0.21 0.75 0.00 0.00 4.57 -1.86 -1.13 114.58 117.13 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 0.75 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2ajc h GLU 693 CO -0.57 0.50 0.00 -0.91 -1.18 0.00 0.00 179.01 176.85 2ajc h ASN 694 N 0.78 0.00 0.73 1.04 -0.26 -1.61 -2.62 115.58 113.63 2ajc h ASN 694 Ca 0.46 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.20 2ajc h ASN 694 Cb 0.55 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.81 2ajc h ASN 694 CO -0.31 0.00 0.00 0.49 -1.06 0.00 0.00 177.43 176.55 2ajc n PHE 695 N -2.41 0.35 0.29 1.19 3.01 -0.43 -2.37 117.46 117.10 2ajc n PHE 695 Ca -0.00 0.13 0.18 0.00 1.01 0.00 0.00 57.45 58.76 2ajc n PHE 695 Cb 0.12 -0.71 0.88 0.00 -0.01 0.00 0.00 39.48 39.76 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 -0.01 -1.08 1.57 -1.64 -2.38 116.57 113.03 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 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 2ajc h LYS 696 CO 0.00 0.00 -0.15 1.04 -0.57 0.00 0.00 179.45 179.77 2ajc n GLN 697 N -2.80 0.98 -4.22 3.15 6.02 -1.00 -4.96 117.38 114.56 2ajc n GLN 697 Ca -0.01 -0.50 -0.13 0.00 -0.01 0.00 0.00 57.00 56.35 2ajc n GLN 697 Cb 0.13 -1.49 -0.10 0.00 1.02 0.00 0.00 30.24 29.80 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 -2.36 0.23 -0.25 5.09 -7.23 -0.90 -4.94 120.40 110.04 2ajc s VAL 698 Ca 0.30 -1.98 -0.09 0.00 -1.81 0.00 0.00 61.98 58.39 2ajc s VAL 698 Cb 0.20 -2.41 -0.04 0.00 0.56 0.00 0.00 36.38 34.68 2ajc s VAL 698 CO 0.46 -0.13 0.13 -1.61 -0.31 0.00 0.00 175.10 173.64 2ajc s GLU 699 N -4.08 3.88 -0.01 4.82 2.02 -0.94 -4.99 118.70 119.40 2ajc s GLU 699 Ca 0.34 -0.36 0.06 0.00 0.02 0.00 0.00 54.97 55.03 2ajc s GLU 699 Cb 0.07 -3.48 -0.01 0.00 0.10 0.00 0.00 34.13 30.81 2ajc s GLU 699 CO 0.10 -0.09 -0.18 -0.47 0.02 0.00 0.00 175.26 174.64 2ajc s TYR 700 N 1.43 1.64 -0.16 1.61 5.04 -1.26 -1.82 117.35 123.83 2ajc s TYR 700 Ca 0.06 -0.31 0.00 0.00 -2.44 0.00 0.00 57.07 54.39 2ajc s TYR 700 Cb -0.15 -1.05 0.03 0.00 0.35 0.00 0.00 41.96 41.13 2ajc s TYR 700 CO 0.06 -0.03 -0.14 -1.17 -1.34 0.00 0.00 175.55 172.94 2ajc s LEU 701 N -0.42 1.79 -0.19 6.97 0.20 -0.78 -0.84 118.68 125.41 2ajc s LEU 701 Ca 0.07 -0.56 -0.04 0.00 0.69 0.00 0.00 54.13 54.30 2ajc s LEU 701 Cb -0.07 -1.20 -0.02 0.00 -0.43 0.00 0.00 46.19 44.47 2ajc s LEU 701 CO -0.01 -0.07 -0.04 -0.22 -0.29 0.00 0.00 176.35 175.73 2ajc s LEU 702 N 1.47 3.03 -0.02 -0.68 2.96 0.05 -1.38 118.68 124.10 2ajc s LEU 702 Ca 0.04 -0.29 0.07 0.00 -0.22 0.00 0.00 54.13 53.73 2ajc s LEU 702 Cb -0.13 -1.75 -0.02 0.00 0.50 0.00 0.00 46.19 44.79 2ajc s LEU 702 CO -0.10 0.06 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.13 2ajc s ILE 703 N 1.03 1.75 -0.24 6.68 1.01 -0.24 -1.33 121.20 129.86 2ajc s ILE 703 Ca 0.01 -0.94 -0.22 0.00 0.00 0.00 0.00 60.65 59.50 2ajc s ILE 703 Cb -0.15 -1.46 0.06 0.00 0.01 0.00 0.00 42.46 40.93 2ajc s ILE 703 CO 0.00 0.50 0.64 -2.28 0.00 0.00 0.00 174.94 173.80 2ajc s HIS 704 N -0.47 -0.72 -0.01 3.97 2.46 -0.87 -0.13 115.29 119.51 2ajc s HIS 704 Ca 0.07 1.73 -0.28 0.00 0.47 0.00 0.00 55.06 57.05 2ajc s HIS 704 Cb -0.09 0.26 -0.03 0.00 -0.13 0.00 0.00 32.58 32.59 2ajc s HIS 704 CO -0.00 -0.35 0.90 0.20 -2.47 0.00 0.00 174.74 173.02 2ajc s GLY 705 N 0.41 2.83 0.59 1.59 0.00 -1.26 -1.38 107.32 110.10 2ajc s GLY 705 Ca -0.01 0.43 0.37 0.00 0.00 0.00 0.00 44.72 45.51 2ajc s GLY 705 CO -0.00 1.54 2.15 -0.91 0.00 0.00 0.00 173.10 175.87 2ajc h THR 706 N 4.76 0.08 -0.81 0.90 1.35 -1.35 -2.74 112.91 115.10 2ajc h THR 706 Ca -0.41 -0.33 -0.45 0.00 -0.55 0.00 0.00 66.41 64.67 2ajc h THR 706 Cb 1.21 1.30 -0.26 0.00 -1.73 0.00 0.00 68.15 68.67 2ajc h THR 706 CO 0.75 0.02 0.43 0.00 -0.25 0.00 0.00 175.52 176.47 2ajc n ALA 707 N -2.11 5.34 -2.41 6.62 0.00 -0.49 -4.70 120.51 122.76 2ajc n ALA 707 Ca -0.01 -3.07 -0.43 0.00 0.00 0.00 0.00 53.44 49.93 2ajc n ALA 707 Cb 0.21 -1.26 -0.02 0.00 0.00 0.00 0.00 19.45 18.38 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 -1.79 6.52 0.03 0.00 -1.08 -1.03 -4.21 116.67 115.11 2ajc s ASP 708 Ca 0.54 0.95 0.26 0.00 -0.52 0.00 0.00 52.55 53.79 2ajc s ASP 708 Cb 0.46 -2.54 0.72 0.00 -1.46 0.00 0.00 42.92 40.10 2ajc s ASP 708 CO 0.06 -1.25 1.58 -0.90 0.52 0.00 0.00 175.17 175.18 2ajc n ASP 709 N 8.17 0.39 0.00 -0.34 5.75 -1.26 -4.04 116.55 125.21 2ajc n ASP 709 Ca 0.15 0.07 0.00 0.00 -0.01 0.00 0.00 54.79 55.00 2ajc n ASP 709 Cb 0.47 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.52 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 -1.62 0.00 -4.33 -1.12 2.85 -1.26 -4.75 115.26 105.02 2ajc n ASN 710 Ca 0.06 0.07 -0.45 0.00 -0.11 0.00 0.00 54.58 54.15 2ajc n ASN 710 Cb 0.36 -0.48 -0.07 0.00 1.24 0.00 0.00 39.78 40.83 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 -0.97 5.09 0.41 3.44 1.01 -1.26 -4.82 120.40 123.30 2ajc s VAL 711 Ca 0.00 -1.35 -0.26 0.00 0.00 0.00 0.00 61.98 60.37 2ajc s VAL 711 Cb 0.00 -4.17 -0.10 0.00 0.00 0.00 0.00 36.38 32.11 2ajc s VAL 711 CO 0.00 -0.73 1.42 1.41 0.00 0.00 0.00 175.10 177.20 2ajc n HIS 712 N 5.19 2.69 -0.31 5.22 8.25 -1.26 -4.70 115.22 130.30 2ajc n HIS 712 Ca -0.13 0.46 0.22 0.00 -0.26 0.00 0.00 57.72 58.02 2ajc n HIS 712 Cb 0.42 -2.47 0.52 0.00 1.12 0.00 0.00 29.99 29.57 2ajc n HIS 712 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 2ajc h PHE 713 N 2.51 0.62 -0.92 4.41 3.57 -1.79 0.19 116.94 125.53 2ajc h PHE 713 Ca -0.50 0.02 0.33 0.00 3.53 0.00 0.00 57.97 61.35 2ajc h PHE 713 Cb 1.26 -0.18 -0.17 0.00 2.79 0.00 0.00 35.95 39.66 2ajc h PHE 713 CO 0.51 0.08 0.30 0.94 -2.23 0.00 0.00 178.31 177.90 2ajc n GLN 714 N -4.59 -0.06 -0.15 1.11 7.27 -1.26 -0.87 117.38 118.83 2ajc n GLN 714 Ca 0.24 1.31 -0.07 0.00 0.07 0.00 0.00 57.00 58.55 2ajc n GLN 714 Cb 0.86 -2.23 0.02 0.00 2.41 0.00 0.00 30.24 31.29 2ajc n GLN 714 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 2ajc h GLN 715 N 0.00 0.55 0.01 3.69 4.20 -0.95 0.98 115.11 123.59 2ajc h GLN 715 Ca 0.69 -0.03 -0.19 0.00 0.06 0.00 0.00 58.65 59.17 2ajc h GLN 715 Cb 1.69 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 29.32 2ajc h GLN 715 CO -0.77 0.37 -0.90 0.77 -0.67 0.00 0.00 178.83 177.63 2ajc h SER 716 N 0.57 0.09 -0.79 1.46 0.02 -1.15 -2.11 113.55 111.63 2ajc h SER 716 Ca 0.18 -0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 2ajc h SER 716 Cb -0.02 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 2ajc h SER 716 CO -0.06 0.94 0.34 0.00 -1.14 0.00 0.00 176.83 176.91 2ajc h ALA 717 N 1.05 1.10 -0.16 3.77 0.00 -0.58 -0.02 119.26 124.42 2ajc h ALA 717 Ca -0.03 -0.18 -0.19 0.00 0.00 0.00 0.00 54.91 54.52 2ajc h ALA 717 Cb 1.57 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2ajc h ALA 717 CO 0.12 0.66 -0.66 1.96 0.00 0.00 0.00 179.25 181.33 2ajc h GLN 718 N 1.15 0.60 -0.19 0.00 1.08 -0.78 -2.30 115.11 114.67 2ajc h GLN 718 Ca 0.27 -0.44 -0.02 0.00 -1.45 0.00 0.00 58.65 57.01 2ajc h GLN 718 Cb 0.18 0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 2ajc h GLN 718 CO -0.03 1.06 0.03 1.25 -0.95 0.00 0.00 178.83 180.19 2ajc h LEU 719 N 0.44 0.31 -0.83 1.46 5.85 -1.04 -2.53 115.31 118.96 2ajc h LEU 719 Ca -0.02 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 2ajc h LEU 719 Cb 1.24 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.15 2ajc h LEU 719 CO 0.13 0.49 0.51 0.77 -0.34 0.00 0.00 178.44 180.00 2ajc h SER 720 N 0.11 0.99 -0.68 1.25 4.64 -1.00 -1.73 113.55 117.12 2ajc h SER 720 Ca 0.06 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ajc h SER 720 Cb 0.32 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.13 2ajc h SER 720 CO 0.00 0.75 0.44 0.50 -0.87 0.00 0.00 176.83 177.66 2ajc h LYS 721 N 1.14 0.90 -0.24 4.77 3.64 -1.29 0.36 116.57 125.85 2ajc h LYS 721 Ca 0.30 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.47 2ajc h LYS 721 Cb -0.06 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.55 2ajc h LYS 721 CO -0.06 0.61 -0.48 0.00 -2.27 0.00 0.00 179.45 177.25 2ajc h ALA 722 N 1.56 0.71 -0.38 5.00 0.00 -0.96 0.46 119.26 125.65 2ajc h ALA 722 Ca 0.25 -0.48 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2ajc h ALA 722 Cb -0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2ajc h ALA 722 CO -0.05 0.67 -0.22 -0.07 0.00 0.00 0.00 179.25 179.58 2ajc h LEU 723 N 0.51 0.84 -0.33 0.00 3.38 -0.91 -1.76 115.31 117.05 2ajc h LEU 723 Ca 0.03 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 2ajc h LEU 723 Cb 1.02 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 2ajc h LEU 723 CO 0.10 1.08 0.16 0.58 0.09 0.00 0.00 178.44 180.45 2ajc h VAL 724 N 0.61 1.15 0.00 1.22 2.07 -0.82 -1.28 116.25 119.20 2ajc h VAL 724 Ca 0.08 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 2ajc h VAL 724 Cb 0.78 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 2ajc h VAL 724 CO 0.06 0.16 -0.00 0.44 0.02 0.00 0.00 177.57 178.25 2ajc h ASP 725 N 0.40 0.00 -0.58 0.57 3.32 -0.78 -0.99 116.42 118.36 2ajc h ASP 725 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2ajc h ASP 725 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 2ajc h ASP 725 CO -0.02 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.51 2ajc n ALA 726 N -2.27 2.41 -2.16 3.45 0.00 -0.67 -4.94 120.51 116.32 2ajc n ALA 726 Ca -0.03 -1.09 -0.13 0.00 0.00 0.00 0.00 53.44 52.20 2ajc n ALA 726 Cb 0.08 -0.94 -0.01 0.00 0.00 0.00 0.00 19.45 18.58 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 1.51 -0.01 3.76 0.00 0.00 -0.37 -4.92 105.19 105.15 2ajc n GLY 727 Ca 0.21 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.62 5.34 0.13 1.61 1.01 -0.54 -5.04 120.40 120.29 2ajc s VAL 728 Ca 0.00 0.44 -0.12 0.00 0.00 0.00 0.00 61.98 62.30 2ajc s VAL 728 Cb 0.00 -3.57 -0.06 0.00 0.00 0.00 0.00 36.38 32.75 2ajc s VAL 728 CO 0.00 0.44 0.49 -0.62 0.00 0.00 0.00 175.10 175.41 2ajc s ASP 729 N 0.14 6.72 0.22 3.32 2.15 -1.26 -4.45 116.67 123.50 2ajc s ASP 729 Ca 0.15 0.93 -0.21 0.00 0.43 0.00 0.00 52.55 53.84 2ajc s ASP 729 Cb -0.13 -2.23 0.07 0.00 -0.30 0.00 0.00 42.92 40.33 2ajc s ASP 729 CO 0.03 0.10 0.95 0.72 -0.17 0.00 0.00 175.17 176.81 2ajc s PHE 730 N -1.49 0.02 0.20 -5.34 -0.71 -1.26 -4.73 117.98 104.66 2ajc s PHE 730 Ca 0.37 -0.46 0.11 0.00 -1.04 0.00 0.00 56.93 55.91 2ajc s PHE 730 Cb -0.14 0.72 -0.04 0.00 -1.21 0.00 0.00 43.02 42.34 2ajc s PHE 730 CO 0.19 -1.05 -0.18 -0.65 -1.34 0.00 0.00 175.22 172.19 2ajc s GLN 731 N -2.56 1.74 0.18 1.99 -0.21 -0.02 -5.02 119.66 115.76 2ajc s GLN 731 Ca 0.18 -1.46 0.01 0.00 0.02 0.00 0.00 55.36 54.11 2ajc s GLN 731 Cb -0.03 -1.95 -0.04 0.00 1.00 0.00 0.00 33.01 31.98 2ajc s GLN 731 CO 0.06 0.40 0.05 0.95 -2.12 0.00 0.00 175.29 174.63 2ajc s THR 732 N -1.77 0.44 -0.25 -0.19 -4.23 -1.26 -0.77 115.64 107.61 2ajc s THR 732 Ca 0.23 -1.97 -0.03 0.00 -1.18 0.00 0.00 61.69 58.75 2ajc s THR 732 Cb -0.08 -2.23 0.14 0.00 1.34 0.00 0.00 72.50 71.67 2ajc s THR 732 CO 0.12 -0.34 0.40 -0.32 -0.54 0.00 0.00 174.62 173.94 2ajc s MET 733 N -3.99 0.37 0.37 3.99 0.00 -0.44 -4.87 119.30 114.72 2ajc s MET 733 Ca 0.28 0.62 -0.06 0.00 0.00 0.00 0.00 55.69 56.53 2ajc s MET 733 Cb 0.07 -0.32 -0.05 0.00 0.00 0.00 0.00 34.83 34.54 2ajc s MET 733 CO 0.06 -0.61 0.66 1.67 0.00 0.00 0.00 175.02 176.80 2ajc s TRP 734 N 2.58 3.50 -0.31 4.11 -2.14 -1.26 -2.06 118.94 123.36 2ajc s TRP 734 Ca 0.13 0.74 0.02 0.00 2.66 0.00 0.00 56.10 59.64 2ajc s TRP 734 Cb -0.15 -2.21 0.09 0.00 -3.10 0.00 0.00 33.47 28.11 2ajc s TRP 734 CO -0.16 -0.02 0.05 0.71 -2.66 0.00 0.00 176.95 174.88 2ajc s TYR 735 N -2.35 2.76 0.05 1.66 2.02 -0.48 -4.90 117.35 116.10 2ajc s TYR 735 Ca 0.46 -2.33 -0.34 0.00 -0.37 0.00 0.00 57.07 54.49 2ajc s TYR 735 Cb -0.10 -2.25 -0.13 0.00 -0.40 0.00 0.00 41.96 39.07 2ajc s TYR 735 CO 0.35 -0.90 1.69 2.41 -1.57 0.00 0.00 175.55 177.53 2ajc n THR 736 N 4.55 0.24 -0.89 -0.71 -1.04 -1.26 -1.67 114.28 113.49 2ajc n THR 736 Ca -0.01 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 2ajc n THR 736 Cb 0.42 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.31 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 4.70 -3.76 -4.83 8.00 8.00 -1.26 -4.88 116.55 122.52 2ajc n ASP 737 Ca 0.20 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.35 2ajc n ASP 737 Cb 0.28 -2.49 -0.06 0.00 -0.02 0.00 0.00 41.12 38.83 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 -1.28 4.14 0.00 -1.24 0.41 -1.01 -4.63 118.70 115.09 2ajc s GLU 738 Ca 0.00 0.79 0.00 0.00 -0.41 0.00 0.00 54.97 55.35 2ajc s GLU 738 Cb 0.00 -2.66 0.00 0.00 -1.78 0.00 0.00 34.13 29.69 2ajc s GLU 738 CO 0.00 0.28 0.00 -0.40 -0.49 0.00 0.00 175.26 174.65 2ajc n ASP 739 N 0.20 0.00 0.30 -0.19 5.68 -1.26 -1.39 116.55 119.89 2ajc n ASP 739 Ca 0.01 0.00 0.15 0.00 -0.50 0.00 0.00 54.79 54.45 2ajc n ASP 739 Cb 0.52 0.00 0.92 0.00 -1.14 0.00 0.00 41.12 41.42 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 -2.38 115.15 112.96 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 0.00 -0.63 0.41 -0.00 0.00 0.00 177.93 177.71 2ajc n GLY 741 N -1.32 -0.85 4.20 5.26 0.00 -1.26 -4.95 105.19 106.28 2ajc n GLY 741 Ca -0.03 -0.49 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.12 -1.05 1.02 -0.61 5.41 -0.90 -4.82 119.36 117.29 2ajc n ILE 742 Ca 0.07 -0.48 0.11 0.00 1.00 0.00 0.00 62.75 63.45 2ajc n ILE 742 Cb 0.36 -1.03 0.03 0.00 -0.71 0.00 0.00 39.64 38.29 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 -4.42 4.09 -1.47 -1.39 0.00 -1.26 -3.57 120.51 112.49 2ajc n ALA 743 Ca -0.30 -0.53 -0.35 0.00 0.00 0.00 0.00 53.44 52.26 2ajc n ALA 743 Cb 0.65 -0.89 0.09 0.00 0.00 0.00 0.00 19.45 19.30 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 -2.85 4.23 0.16 0.00 1.04 -1.26 -4.70 113.70 110.33 2ajc s SER 744 Ca 0.12 2.48 -0.24 0.00 0.48 0.00 0.00 55.95 58.80 2ajc s SER 744 Cb 0.17 -2.60 0.04 0.00 0.10 0.00 0.00 66.02 63.72 2ajc s SER 744 CO 0.74 -2.24 1.59 0.78 0.98 0.00 0.00 173.24 175.09 2ajc h ASN 745 N -0.05 -1.13 0.11 7.02 -0.26 -2.00 -0.11 115.58 119.17 2ajc h ASN 745 Ca -0.49 0.19 -0.14 0.00 -0.56 0.00 0.00 56.30 55.30 2ajc h ASN 745 Cb 1.32 0.52 -0.01 0.00 -1.06 0.00 0.00 38.32 39.08 2ajc h ASN 745 CO 0.50 -0.34 -0.48 0.24 -1.06 0.00 0.00 177.43 176.30 2ajc h MET 746 N -0.29 0.43 -0.22 0.81 2.86 -1.98 -2.77 114.93 113.76 2ajc h MET 746 Ca 0.15 -0.24 -0.15 0.00 -2.06 0.00 0.00 59.70 57.40 2ajc h MET 746 Cb 0.55 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 2ajc h MET 746 CO -0.52 0.82 -0.49 0.00 1.06 0.00 0.00 176.91 177.78 2ajc h ALA 747 N 1.15 0.71 -0.17 6.32 0.00 -1.81 -0.56 119.26 124.90 2ajc h ALA 747 Ca 0.02 -0.49 0.02 0.00 0.00 0.00 0.00 54.91 54.46 2ajc h ALA 747 Cb 0.97 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2ajc h ALA 747 CO 0.08 0.68 0.05 1.25 0.00 0.00 0.00 179.25 181.31 2ajc h HIS 748 N 0.48 0.08 -0.53 0.00 6.17 -0.98 -0.14 115.15 120.24 2ajc h HIS 748 Ca 0.02 0.01 -0.04 0.00 0.71 0.00 0.00 60.37 61.07 2ajc h HIS 748 Cb 1.04 -0.01 -0.02 0.00 2.52 0.00 0.00 27.41 30.93 2ajc h HIS 748 CO 0.05 0.04 0.18 1.96 0.71 0.00 0.00 177.93 180.87 2ajc h GLN 749 N 0.12 0.81 -0.46 5.26 4.20 -1.35 -3.06 115.11 120.64 2ajc h GLN 749 Ca 0.07 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 2ajc h GLN 749 Cb 0.05 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 2ajc h GLN 749 CO -0.08 0.73 0.22 1.25 -0.67 0.00 0.00 178.83 180.28 2ajc h HIS 750 N 0.73 0.66 -0.34 2.96 2.76 -0.75 -1.69 115.15 119.48 2ajc h HIS 750 Ca 0.17 -0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.27 2ajc h HIS 750 Cb 0.25 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 28.99 2ajc h HIS 750 CO 0.01 0.53 0.04 0.97 -1.30 0.00 0.00 177.93 178.18 2ajc h ILE 751 N 0.60 1.24 -0.25 6.26 2.10 -1.00 0.16 117.51 126.63 2ajc h ILE 751 Ca 0.16 -0.87 -0.11 0.00 1.08 0.00 0.00 64.86 65.12 2ajc h ILE 751 Cb 0.12 1.15 -0.01 0.00 -1.09 0.00 0.00 36.82 36.99 2ajc h ILE 751 CO -0.02 0.29 -0.31 1.88 -1.08 0.00 0.00 178.15 178.91 2ajc h TYR 752 N 0.40 0.58 -0.20 2.19 0.05 -1.57 0.28 116.97 118.70 2ajc h TYR 752 Ca 0.10 -0.14 -0.04 0.00 0.05 0.00 0.00 58.73 58.70 2ajc h TYR 752 Cb 0.38 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 2ajc h TYR 752 CO 0.03 0.76 -0.02 1.15 -1.05 0.00 0.00 178.16 179.03 2ajc h THR 753 N 0.44 1.27 -0.51 -2.88 2.02 -1.11 -0.29 112.91 111.86 2ajc h THR 753 Ca 0.05 -0.95 -0.02 0.00 0.77 0.00 0.00 66.41 66.27 2ajc h THR 753 Cb 0.76 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.65 2ajc h THR 753 CO 0.06 0.29 0.24 -0.74 0.37 0.00 0.00 175.52 175.74 2ajc h HIS 754 N 0.10 0.73 -0.47 3.16 -0.00 -0.37 -2.10 115.15 116.19 2ajc h HIS 754 Ca 0.05 -0.04 -0.07 0.00 -0.00 0.00 0.00 60.37 60.32 2ajc h HIS 754 Cb 0.44 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 27.60 2ajc h HIS 754 CO 0.04 0.58 0.01 0.52 -0.00 0.00 0.00 177.93 179.08 2ajc h MET 755 N 0.67 0.78 -0.69 5.26 2.07 -0.41 -1.67 114.93 120.95 2ajc h MET 755 Ca 0.17 -0.20 -0.03 0.00 -2.07 0.00 0.00 59.70 57.57 2ajc h MET 755 Cb 0.12 -0.09 -0.03 0.00 -1.87 0.00 0.00 31.60 29.73 2ajc h MET 755 CO -0.02 0.78 0.33 0.77 1.07 0.00 0.00 176.91 179.84 2ajc h SER 756 N 0.73 0.90 -0.38 1.22 0.02 -0.74 -0.66 113.55 114.65 2ajc h SER 756 Ca 0.14 -0.13 -0.11 0.00 -0.84 0.00 0.00 61.79 60.85 2ajc h SER 756 Cb 0.44 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 2ajc h SER 756 CO 0.02 0.78 -0.17 0.45 -1.14 0.00 0.00 176.83 176.77 2ajc h HIS 757 N 0.96 0.95 -0.39 3.45 3.86 -1.10 -0.78 115.15 122.10 2ajc h HIS 757 Ca 0.24 -0.20 -0.03 0.00 -1.16 0.00 0.00 60.37 59.22 2ajc h HIS 757 Cb 0.12 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 2ajc h HIS 757 CO 0.01 0.95 0.14 0.35 0.86 0.00 0.00 177.93 180.23 2ajc h PHE 758 N 0.75 0.62 -0.35 2.45 3.57 -0.93 -1.58 116.94 121.47 2ajc h PHE 758 Ca 0.11 -0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 2ajc h PHE 758 Cb 0.69 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 2ajc h PHE 758 CO 0.04 0.57 0.02 -0.07 -2.23 0.00 0.00 178.31 176.63 2ajc h LEU 759 N 0.49 0.60 -1.10 0.59 3.38 -1.00 -1.26 115.31 117.01 2ajc h LEU 759 Ca 0.13 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.82 2ajc h LEU 759 Cb 0.23 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 2ajc h LEU 759 CO -0.01 0.74 0.61 0.11 0.09 0.00 0.00 178.44 179.99 2ajc h LYS 760 N 0.43 1.18 -0.55 1.13 1.57 -1.07 0.19 116.57 119.45 2ajc h LYS 760 Ca 0.10 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.72 2ajc h LYS 760 Cb 0.43 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 2ajc h LYS 760 CO 0.01 0.78 -0.01 0.37 -0.57 0.00 0.00 179.45 180.04 2ajc h GLN 761 N 1.21 0.97 -0.11 3.15 -0.00 -1.17 0.38 115.11 119.55 2ajc h GLN 761 Ca 0.35 -0.31 -0.09 0.00 -0.00 0.00 0.00 58.65 58.60 2ajc h GLN 761 Cb -0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 27.30 2ajc h GLN 761 CO -0.09 0.98 -0.31 0.00 0.00 0.00 0.00 178.83 179.41 2ajc n PHE 763 N -4.11 0.34 -3.61 0.00 3.72 0.57 -4.95 117.46 109.42 2ajc n PHE 763 Ca -0.01 -0.17 -0.22 0.00 -0.05 0.00 0.00 57.45 57.00 2ajc n PHE 763 Cb 0.40 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.01 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 1.18 -3.07 -4.65 4.37 7.64 -0.02 -4.98 113.62 114.09 2ajc n SER 764 Ca 0.18 -0.68 -0.35 0.00 1.01 0.00 0.00 58.87 59.03 2ajc n SER 764 Cb 0.54 -4.63 -0.10 0.00 -1.01 0.00 0.00 64.21 59.01 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 -6.78 3.80 0.00 -3.43 1.43 0.11 -5.03 118.68 108.79 2ajc s LEU 765 Ca 0.21 0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.44 2ajc s LEU 765 Cb -0.10 -1.95 0.17 0.00 0.03 0.00 0.00 46.19 44.34 2ajc s LEU 765 CO 0.77 0.21 0.65 -0.81 0.23 0.00 0.00 176.35 177.40