#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j6r s TRP 1 N 0.00 1.79 -0.08 7.33 0.52 -1.26 -5.14 118.94 122.10 2j6r s TRP 1 Ca 0.00 -0.34 0.01 0.00 0.02 0.00 0.00 56.10 55.79 2j6r s TRP 1 Cb 0.00 -1.15 -0.02 0.00 -1.15 0.00 0.00 33.47 31.15 2j6r s TRP 1 CO 0.00 -0.03 -0.11 -1.64 0.02 0.00 0.00 176.95 175.19 2j6r s MET 2 N -0.48 2.87 0.57 4.98 -1.94 -1.26 -5.13 119.30 118.91 2j6r s MET 2 Ca 0.08 -0.63 0.09 0.00 -1.71 0.00 0.00 55.69 53.52 2j6r s MET 2 Cb -0.08 -2.55 0.08 0.00 2.01 0.00 0.00 34.83 34.30 2j6r s MET 2 CO -0.01 0.52 0.78 -0.08 -0.01 0.00 0.00 175.02 176.23 2j6r s THR 3 N -0.43 2.19 0.00 2.05 -1.32 -1.26 -4.80 115.64 112.07 2j6r s THR 3 Ca 0.06 -0.99 0.00 0.00 -1.21 0.00 0.00 61.69 59.55 2j6r s THR 3 Cb -0.12 -2.20 0.00 0.00 -1.51 0.00 0.00 72.50 68.67 2j6r s THR 3 CO 0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 2j6r n GLY 4 N -2.24 0.66 2.75 6.08 0.00 -1.26 -4.10 105.19 107.08 2j6r n GLY 4 Ca 0.15 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 2j6r n GLY 4 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2j6r n ASP 5 N -0.84 3.83 -4.71 1.61 8.00 -1.26 -4.86 116.55 118.31 2j6r n ASP 5 Ca 0.00 -2.83 -0.43 0.00 0.71 0.00 0.00 54.79 52.24 2j6r n ASP 5 Cb 0.00 -1.63 -0.02 0.00 -0.02 0.00 0.00 41.12 39.45 2j6r n ASP 5 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2j6r n PHE 6 N 6.16 2.46 -4.74 1.24 7.35 -1.24 -4.67 117.46 124.01 2j6r n PHE 6 Ca 0.52 0.39 -0.24 0.00 -0.76 0.00 0.00 57.45 57.36 2j6r n PHE 6 Cb 0.39 -2.50 -0.15 0.00 0.35 0.00 0.00 39.48 37.56 2j6r n PHE 6 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 2j6r s ASN 7 N 0.24 1.87 0.30 -2.13 -0.87 -1.26 -0.13 114.94 112.97 2j6r s ASN 7 Ca 0.64 -0.29 -0.20 0.00 -1.57 0.00 0.00 52.86 51.44 2j6r s ASN 7 Cb -0.57 -0.30 0.03 0.00 -0.02 0.00 0.00 41.25 40.38 2j6r s ASN 7 CO 0.52 0.18 0.74 -0.83 -2.57 0.00 0.00 177.10 175.14 2j6r s GLY 8 N -0.24 0.01 0.02 0.66 0.00 -0.63 -5.01 107.32 102.13 2j6r s GLY 8 Ca 0.03 -0.40 -0.12 0.00 0.00 0.00 0.00 44.72 44.24 2j6r s GLY 8 CO 0.00 -0.12 0.24 -1.35 0.00 0.00 0.00 173.10 171.87 2j6r s SER 9 N -2.95 -0.07 -0.19 1.64 1.04 -1.26 -0.86 113.70 111.05 2j6r s SER 9 Ca 0.12 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.38 2j6r s SER 9 Cb -0.06 0.30 0.05 0.00 0.10 0.00 0.00 66.02 66.41 2j6r s SER 9 CO 0.08 -0.51 -0.07 -0.69 0.98 0.00 0.00 173.24 173.03 2j6r s VAL 10 N -2.02 1.35 -0.02 5.02 1.01 0.30 -5.00 120.40 121.04 2j6r s VAL 10 Ca -0.09 -0.86 -0.28 0.00 0.00 0.00 0.00 61.98 60.76 2j6r s VAL 10 Cb -0.03 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 2j6r s VAL 10 CO -0.01 0.10 0.88 -1.81 0.00 0.00 0.00 175.10 174.26 2j6r s ASP 11 N 1.52 7.24 -0.15 3.32 1.01 -1.26 -1.03 116.67 127.31 2j6r s ASP 11 Ca -0.01 1.49 0.01 0.00 0.71 0.00 0.00 52.55 54.76 2j6r s ASP 11 Cb -0.16 -2.51 0.02 0.00 1.01 0.00 0.00 42.92 41.27 2j6r s ASP 11 CO -0.08 -0.21 -0.18 -0.63 0.21 0.00 0.00 175.17 174.28 2j6r s ILE 12 N 0.94 1.83 -4.02 0.77 1.01 -1.23 -3.36 121.20 117.15 2j6r s ILE 12 Ca 0.47 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 60.30 2j6r s ILE 12 Cb -0.20 -1.66 0.00 0.00 0.01 0.00 0.00 42.46 40.61 2j6r s ILE 12 CO 0.24 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.30 2j6r n GLY 13 N 4.39 -1.31 0.00 6.18 0.00 0.01 0.32 105.19 114.79 2j6r n GLY 13 Ca -0.19 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.69 2j6r n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j6r n GLY 14 N 0.00 -0.75 3.25 -0.02 0.00 -0.59 -2.69 105.19 104.38 2j6r n GLY 14 Ca 0.00 -0.69 -0.22 0.00 0.00 0.00 0.00 46.02 45.11 2j6r n GLY 14 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2j6r s SER 15 N -4.00 2.25 -0.08 1.61 1.04 -0.40 -0.67 113.70 113.46 2j6r s SER 15 Ca 0.00 -0.68 0.04 0.00 0.48 0.00 0.00 55.95 55.79 2j6r s SER 15 Cb 0.00 -0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.01 2j6r s SER 15 CO 0.00 0.00 -0.22 -0.63 0.98 0.00 0.00 173.24 173.38 2j6r s ILE 16 N -1.28 1.85 0.03 -1.02 1.01 0.21 -1.33 121.20 120.67 2j6r s ILE 16 Ca 0.04 -0.91 0.08 0.00 0.00 0.00 0.00 60.65 59.87 2j6r s ILE 16 Cb -0.10 -1.60 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 2j6r s ILE 16 CO 0.04 0.51 -0.24 0.42 0.00 0.00 0.00 174.94 175.67 2j6r s THR 17 N 0.28 1.95 -0.34 2.92 -4.23 -0.48 -0.52 115.64 115.22 2j6r s THR 17 Ca -0.14 -1.25 -0.06 0.00 -1.18 0.00 0.00 61.69 59.06 2j6r s THR 17 Cb -0.16 -1.66 -0.17 0.00 1.34 0.00 0.00 72.50 71.85 2j6r s THR 17 CO 0.07 0.37 3.33 0.00 -0.54 0.00 0.00 174.62 177.84 2j6r n ALA 18 N 1.98 6.56 0.00 3.99 0.00 -1.26 -2.54 120.51 129.24 2j6r n ALA 18 Ca -0.17 -2.37 0.00 0.00 0.00 0.00 0.00 53.44 50.90 2j6r n ALA 18 Cb 0.52 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.54 2j6r n ALA 18 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2j6r n TYR 21 N 2.27 0.00 1.38 0.00 0.18 -1.26 -4.95 117.16 114.79 2j6r n TYR 21 Ca 0.49 0.00 0.14 0.00 1.88 0.00 0.00 57.90 60.41 2j6r n TYR 21 Cb 0.73 0.00 0.43 0.00 -0.38 0.00 0.00 39.34 40.13 2j6r n TYR 21 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2j6r n ARG 22 N -0.33 1.66 -3.12 -3.48 5.12 -1.26 -4.88 116.66 110.36 2j6r n ARG 22 Ca 0.00 -1.05 -0.40 0.00 -1.93 0.00 0.00 57.85 54.47 2j6r n ARG 22 Cb 0.00 -1.48 -0.06 0.00 -1.16 0.00 0.00 32.46 29.77 2j6r n ARG 22 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2j6r s GLN 23 N -2.07 4.26 -0.00 5.56 -1.52 -1.26 -4.95 119.66 119.68 2j6r s GLN 23 Ca 0.34 0.65 0.07 0.00 -1.95 0.00 0.00 55.36 54.48 2j6r s GLN 23 Cb 0.21 -3.54 -0.09 0.00 -0.22 0.00 0.00 33.01 29.37 2j6r s GLN 23 CO 0.36 -0.16 0.31 1.63 -0.25 0.00 0.00 175.29 177.17 2j6r n LYS 24 N 4.74 4.15 -4.41 2.91 4.76 -1.26 -5.03 118.16 124.02 2j6r n LYS 24 Ca -0.02 -0.01 -0.24 0.00 -2.87 0.00 0.00 58.31 55.18 2j6r n LYS 24 Cb 0.50 -0.88 -0.13 0.00 -1.84 0.00 0.00 35.03 32.68 2j6r n LYS 24 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2j6r s TRP 25 N -1.78 1.74 0.07 2.13 0.52 -1.26 -5.15 118.94 115.21 2j6r s TRP 25 Ca 0.02 -0.40 0.02 0.00 0.02 0.00 0.00 56.10 55.76 2j6r s TRP 25 Cb 0.06 -0.99 -0.03 0.00 -1.15 0.00 0.00 33.47 31.35 2j6r s TRP 25 CO 0.31 0.15 -0.07 -1.83 0.02 0.00 0.00 176.95 175.53 2j6r s GLU 26 N -1.59 0.70 0.05 4.98 -1.05 -1.26 -5.16 118.70 115.37 2j6r s GLU 26 Ca 0.06 -1.08 -0.01 0.00 -0.15 0.00 0.00 54.97 53.79 2j6r s GLU 26 Cb -0.09 -0.26 -0.04 0.00 -0.44 0.00 0.00 34.13 33.30 2j6r s GLU 26 CO 0.03 0.02 -0.02 -1.58 0.95 0.00 0.00 175.26 174.66 2j6r s TRP 27 N -2.62 0.48 0.00 4.83 0.52 -1.26 -5.16 118.94 115.74 2j6r s TRP 27 Ca 0.02 -1.01 -0.29 0.00 0.02 0.00 0.00 56.10 54.84 2j6r s TRP 27 Cb -0.02 -0.36 0.07 0.00 -1.15 0.00 0.00 33.47 32.01 2j6r s TRP 27 CO -0.02 -0.38 0.66 -1.59 0.02 0.00 0.00 176.95 175.64 2j6r s LYS 28 N -3.75 1.11 0.06 4.98 -2.85 -1.26 -5.07 119.74 112.97 2j6r s LYS 28 Ca 0.05 0.07 0.08 0.00 -1.00 0.00 0.00 55.97 55.18 2j6r s LYS 28 Cb 0.07 0.52 -0.03 0.00 -2.06 0.00 0.00 37.83 36.32 2j6r s LYS 28 CO -0.09 -0.39 -0.19 0.14 0.10 0.00 0.00 175.35 174.92 2j6r s VAL 29 N -1.84 2.74 0.00 1.79 -7.23 -1.26 -5.07 120.40 109.54 2j6r s VAL 29 Ca -0.08 -1.30 0.00 0.00 -1.81 0.00 0.00 61.98 58.79 2j6r s VAL 29 Cb -0.00 -2.18 0.00 0.00 0.56 0.00 0.00 36.38 34.76 2j6r s VAL 29 CO 0.04 0.27 0.00 0.61 -0.31 0.00 0.00 175.10 175.71 2j6r n GLY 30 N 1.36 0.91 2.70 2.32 0.00 -1.26 -4.66 105.19 106.57 2j6r n GLY 30 Ca -0.16 -0.81 -0.22 0.00 0.00 0.00 0.00 46.02 44.82 2j6r n GLY 30 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2j6r s THR 31 N 0.00 0.10 0.00 2.61 -4.23 -1.26 -5.12 115.64 107.74 2j6r s THR 31 Ca 0.00 0.19 0.00 0.00 -1.18 0.00 0.00 61.69 60.70 2j6r s THR 31 Cb 0.00 -0.39 0.00 0.00 1.34 0.00 0.00 72.50 73.45 2j6r s THR 31 CO 0.00 0.13 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 2j6r n GLY 32 N 5.23 1.69 0.36 3.99 0.00 -1.26 -5.02 105.19 110.17 2j6r n GLY 32 Ca -0.05 -0.51 0.09 0.00 0.00 0.00 0.00 46.02 45.55 2j6r n GLY 32 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2j6r n LEU 33 N 0.00 2.88 -0.18 0.99 4.77 -1.25 -4.62 117.00 119.58 2j6r n LEU 33 Ca 0.00 -3.03 0.03 0.00 -0.03 0.00 0.00 56.01 52.98 2j6r n LEU 33 Cb 0.00 -0.46 0.06 0.00 -2.33 0.00 0.00 43.42 40.70 2j6r n LEU 33 CO 0.00 0.69 0.55 -3.20 -1.33 0.00 0.00 177.39 174.10 2j6r n ASN 34 N -1.07 2.32 -0.20 -1.43 5.15 -1.21 -0.81 115.26 118.01 2j6r n ASN 34 Ca 0.17 -2.20 0.04 0.00 -0.60 0.00 0.00 54.58 51.99 2j6r n ASN 34 Cb 0.71 -0.13 0.07 0.00 -0.53 0.00 0.00 39.78 39.91 2j6r n ASN 34 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2j6r n GLY 35 N -0.43 3.38 3.77 8.20 0.00 -1.20 -4.40 105.19 114.50 2j6r n GLY 35 Ca 0.06 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 2j6r n GLY 35 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2j6r s PHE 36 N -1.48 2.78 -0.09 1.61 0.40 -1.10 -4.90 117.98 115.22 2j6r s PHE 36 Ca 0.13 1.38 0.00 0.00 -0.60 0.00 0.00 56.93 57.85 2j6r s PHE 36 Cb 0.10 -3.72 0.02 0.00 0.51 0.00 0.00 43.02 39.93 2j6r s PHE 36 CO 0.04 -2.22 -0.08 0.20 0.70 0.00 0.00 175.22 173.86 2j6r s GLY 37 N -0.65 0.73 0.29 4.36 0.00 -1.26 -1.27 107.32 109.52 2j6r s GLY 37 Ca 0.56 -0.40 0.03 0.00 0.00 0.00 0.00 44.72 44.92 2j6r s GLY 37 CO 0.51 0.58 0.18 -1.31 0.00 0.00 0.00 173.10 173.06 2j6r s ASN 38 N 1.31 1.29 0.24 1.64 -0.87 -0.44 -4.99 114.94 113.12 2j6r s ASN 38 Ca -0.03 -1.57 0.06 0.00 -1.57 0.00 0.00 52.86 49.75 2j6r s ASN 38 Cb -0.14 0.42 -0.05 0.00 -0.02 0.00 0.00 41.25 41.47 2j6r s ASN 38 CO -0.03 -0.92 -0.08 0.68 -2.57 0.00 0.00 177.10 174.18 2j6r s VAL 39 N -3.68 1.50 0.32 1.60 -7.23 -1.26 -1.38 120.40 110.26 2j6r s VAL 39 Ca 0.37 -2.12 0.08 0.00 -1.81 0.00 0.00 61.98 58.50 2j6r s VAL 39 Cb 0.05 -2.25 0.31 0.00 0.56 0.00 0.00 36.38 35.04 2j6r s VAL 39 CO 0.19 -0.43 1.77 -0.07 -0.31 0.00 0.00 175.10 176.24 2j6r h LEU 40 N 2.45 0.73 -0.38 1.32 3.38 -1.85 -0.69 115.31 120.27 2j6r h LEU 40 Ca -0.39 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2j6r h LEU 40 Cb 1.22 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2j6r h LEU 40 CO 0.65 0.22 0.00 0.59 0.09 0.00 0.00 178.44 179.99 2j6r n ASN 41 N -4.77 0.33 0.21 -0.43 5.03 -1.26 -1.99 115.26 112.37 2j6r n ASN 41 Ca 0.24 0.59 0.09 0.00 0.87 0.00 0.00 54.58 56.36 2j6r n ASN 41 Cb 0.63 -0.65 0.38 0.00 -1.02 0.00 0.00 39.78 39.11 2j6r n ASN 41 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 2j6r h ASP 42 N 0.00 0.00 -3.91 6.41 3.32 -1.52 -3.45 116.42 117.26 2j6r h ASP 42 Ca 0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 2j6r h ASP 42 Cb 0.28 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.85 2j6r h ASP 42 CO 0.00 0.26 0.44 -0.76 -1.72 0.00 0.00 179.24 177.46 2j6r s LEU 43 N -6.73 4.28 0.50 1.55 1.43 -0.84 -4.71 118.68 114.17 2j6r s LEU 43 Ca 0.01 2.14 0.02 0.00 -1.03 0.00 0.00 54.13 55.27 2j6r s LEU 43 Cb 0.10 -3.98 -0.02 0.00 0.03 0.00 0.00 46.19 42.32 2j6r s LEU 43 CO 0.66 -0.39 0.02 0.42 0.23 0.00 0.00 176.35 177.28 2j6r s THR 44 N -1.47 1.24 -1.20 5.49 -4.23 0.11 -4.61 115.64 110.97 2j6r s THR 44 Ca 0.53 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 59.05 2j6r s THR 44 Cb -0.26 -2.22 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 2j6r s THR 44 CO 0.33 0.00 0.92 0.59 -0.54 0.00 0.00 174.62 175.92 2j6r n ASN 45 N -1.26 -2.46 -2.60 3.99 3.02 -1.26 -1.16 115.26 113.53 2j6r n ASN 45 Ca -0.18 -0.68 -0.16 0.00 -0.03 0.00 0.00 54.58 53.53 2j6r n ASN 45 Cb 0.67 -4.89 0.05 0.00 -0.61 0.00 0.00 39.78 35.01 2j6r n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2j6r n GLY 46 N -1.24 -0.08 2.25 7.41 0.00 -1.26 -3.11 105.19 109.15 2j6r n GLY 46 Ca -0.26 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 2j6r n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j6r n GLY 47 N -1.53 0.50 0.00 -0.02 0.00 -1.18 -4.47 105.19 98.50 2j6r n GLY 47 Ca 0.00 -0.49 0.02 0.00 0.00 0.00 0.00 46.02 45.55 2j6r n GLY 47 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2j6r n THR 48 N -3.42 0.00 -4.71 2.61 -2.24 -0.71 -0.36 114.28 105.45 2j6r n THR 48 Ca -0.12 -0.24 -0.27 0.00 -2.27 0.00 0.00 64.05 61.16 2j6r n THR 48 Cb 0.48 0.67 -0.17 0.00 -2.10 0.00 0.00 70.33 69.22 2j6r n THR 48 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2j6r s LYS 49 N -1.91 2.13 -0.15 -0.78 2.20 -0.31 0.37 119.74 121.29 2j6r s LYS 49 Ca -0.00 -0.55 0.00 0.00 -0.36 0.00 0.00 55.97 55.06 2j6r s LYS 49 Cb 0.03 -1.72 -0.00 0.00 -1.51 0.00 0.00 37.83 34.63 2j6r s LYS 49 CO 0.18 0.04 -0.15 -1.17 -0.36 0.00 0.00 175.35 173.90 2j6r s LEU 50 N 0.66 2.47 -0.20 5.43 2.96 0.01 0.08 118.68 130.10 2j6r s LEU 50 Ca -0.14 -0.47 -0.02 0.00 -0.22 0.00 0.00 54.13 53.27 2j6r s LEU 50 Cb -0.16 -1.56 -0.01 0.00 0.50 0.00 0.00 46.19 44.96 2j6r s LEU 50 CO 0.04 0.08 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.18 2j6r s THR 51 N 0.82 3.11 -0.18 3.68 2.01 -1.26 -0.64 115.64 123.19 2j6r s THR 51 Ca -0.05 -0.59 -0.04 0.00 0.31 0.00 0.00 61.69 61.32 2j6r s THR 51 Cb -0.15 -2.38 -0.02 0.00 0.01 0.00 0.00 72.50 69.95 2j6r s THR 51 CO -0.00 0.46 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.73 2j6r s ILE 52 N 1.23 3.80 -0.35 1.82 1.01 0.17 -4.98 121.20 123.91 2j6r s ILE 52 Ca 0.03 -0.38 -0.14 0.00 0.00 0.00 0.00 60.65 60.16 2j6r s ILE 52 Cb -0.14 -2.69 -0.01 0.00 0.01 0.00 0.00 42.46 39.63 2j6r s ILE 52 CO -0.03 0.47 0.32 -0.89 0.00 0.00 0.00 174.94 174.80 2j6r s THR 53 N 0.70 5.21 0.23 2.92 2.01 -1.26 -0.92 115.64 124.53 2j6r s THR 53 Ca -0.02 -0.09 -0.30 0.00 0.31 0.00 0.00 61.69 61.59 2j6r s THR 53 Cb -0.14 -3.79 -0.09 0.00 0.01 0.00 0.00 72.50 68.48 2j6r s THR 53 CO 0.02 -0.08 1.15 -0.69 -0.69 0.00 0.00 174.62 174.33 2j6r s VAL 54 N 1.90 3.50 -0.23 3.82 1.01 -0.52 -4.92 120.40 124.97 2j6r s VAL 54 Ca 0.09 1.38 -0.09 0.00 0.00 0.00 0.00 61.98 63.36 2j6r s VAL 54 Cb -0.17 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 2j6r s VAL 54 CO 0.11 0.28 0.13 -0.89 0.00 0.00 0.00 175.10 174.73 2j6r s THR 55 N -0.62 5.11 0.00 3.92 2.01 -1.26 -0.96 115.64 123.84 2j6r s THR 55 Ca 0.49 0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.58 2j6r s THR 55 Cb -0.32 -3.36 0.00 0.00 0.01 0.00 0.00 72.50 68.82 2j6r s THR 55 CO 0.40 0.37 0.00 0.61 -0.69 0.00 0.00 174.62 175.31 2j6r n GLY 56 N 4.18 -1.39 3.33 4.40 0.00 -1.26 -4.83 105.19 109.62 2j6r n GLY 56 Ca -0.15 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 2j6r n GLY 56 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2j6r s ASN 57 N -3.42 5.88 -0.31 1.61 0.02 -1.26 -2.66 114.94 114.80 2j6r s ASN 57 Ca 0.00 -1.40 -0.12 0.00 -1.02 0.00 0.00 52.86 50.32 2j6r s ASN 57 Cb 0.00 -2.08 -0.03 0.00 0.02 0.00 0.00 41.25 39.16 2j6r s ASN 57 CO 0.00 -0.58 0.22 -0.54 0.02 0.00 0.00 177.10 176.21 2j6r s LYS 58 N 1.53 3.67 0.29 -0.60 -0.14 0.29 -4.90 119.74 119.88 2j6r s LYS 58 Ca 0.03 -0.52 -0.29 0.00 -1.36 0.00 0.00 55.97 53.84 2j6r s LYS 58 Cb -0.23 -3.74 -0.10 0.00 -1.68 0.00 0.00 37.83 32.08 2j6r s LYS 58 CO 0.04 -0.34 1.11 -1.25 -0.76 0.00 0.00 175.35 174.15 2j6r s PRO 59 N 1.73 4.59 -0.21 -1.68 0.04 -1.26 -0.34 135.00 137.86 2j6r s PRO 59 Ca 0.06 1.81 -0.16 0.00 0.04 0.00 0.00 61.00 62.75 2j6r s PRO 59 Cb -0.17 -3.13 -0.08 0.00 0.04 0.00 0.00 34.50 31.16 2j6r s PRO 59 CO 0.10 0.16 -0.34 -0.89 0.04 0.00 0.00 177.00 176.07 2j6r n ILE 60 N 1.07 1.49 -3.94 0.56 5.41 0.12 -4.88 119.36 119.18 2j6r n ILE 60 Ca -0.01 -0.05 -0.16 0.00 1.00 0.00 0.00 62.75 63.54 2j6r n ILE 60 Cb 0.45 -2.16 -0.15 0.00 -0.71 0.00 0.00 39.64 37.07 2j6r n ILE 60 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 2j6r s LEU 61 N -7.73 1.47 0.03 1.39 2.96 -0.65 -4.96 118.68 111.20 2j6r s LEU 61 Ca -0.32 -0.03 0.06 0.00 -0.22 0.00 0.00 54.13 53.63 2j6r s LEU 61 Cb 0.08 -0.17 -0.02 0.00 0.50 0.00 0.00 46.19 46.58 2j6r s LEU 61 CO 0.44 -0.05 -0.19 -0.76 -1.32 0.00 0.00 176.35 174.46 2j6r s LEU 62 N 0.62 2.13 0.05 -0.68 1.43 -1.26 -0.85 118.68 120.12 2j6r s LEU 62 Ca -0.06 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.59 2j6r s LEU 62 Cb -0.09 -0.92 -0.03 0.00 0.03 0.00 0.00 46.19 45.18 2j6r s LEU 62 CO -0.01 0.16 -0.06 -0.83 0.23 0.00 0.00 176.35 175.84 2j6r s GLY 63 N -0.96 0.52 0.01 -3.19 0.00 -0.38 -4.96 107.32 98.36 2j6r s GLY 63 Ca 0.07 -0.96 -0.23 0.00 0.00 0.00 0.00 44.72 43.60 2j6r s GLY 63 CO 0.01 -1.04 0.51 1.09 0.00 0.00 0.00 173.10 173.67 2j6r s ARG 64 N -2.51 0.96 0.37 2.90 1.70 -1.26 -0.85 118.95 120.25 2j6r s ARG 64 Ca -0.03 -0.10 -0.27 0.00 -0.47 0.00 0.00 55.73 54.86 2j6r s ARG 64 Cb -0.03 0.44 -0.09 0.00 -0.57 0.00 0.00 34.95 34.69 2j6r s ARG 64 CO -0.03 -0.32 1.30 0.95 -1.08 0.00 0.00 175.30 176.12 2j6r s THR 65 N -1.88 2.70 0.17 4.99 -4.23 -0.43 -4.95 115.64 112.02 2j6r s THR 65 Ca -0.08 0.67 -0.01 0.00 -1.18 0.00 0.00 61.69 61.09 2j6r s THR 65 Cb -0.01 -3.41 -0.12 0.00 1.34 0.00 0.00 72.50 70.29 2j6r s THR 65 CO 0.03 0.13 1.41 0.11 -0.54 0.00 0.00 174.62 175.75 2j6r h LYS 66 N 3.03 0.34 -3.74 3.99 1.57 -1.98 -3.46 116.57 116.31 2j6r h LYS 66 Ca -0.49 -0.31 -0.08 0.00 -1.87 0.00 0.00 60.65 57.90 2j6r h LYS 66 Cb 1.24 0.07 -0.12 0.00 0.08 0.00 0.00 32.23 33.50 2j6r h LYS 66 CO 0.64 0.97 -0.25 -1.21 -0.57 0.00 0.00 179.45 179.03 2j6r s GLU 67 N -3.47 1.13 0.31 3.15 2.02 -1.26 -5.11 118.70 115.47 2j6r s GLU 67 Ca -0.05 -1.05 -0.28 0.00 0.02 0.00 0.00 54.97 53.61 2j6r s GLU 67 Cb 0.10 0.40 -0.10 0.00 0.10 0.00 0.00 34.13 34.64 2j6r s GLU 67 CO 0.84 -0.42 1.17 0.00 0.02 0.00 0.00 175.26 176.86 2j6r s ALA 68 N -3.92 3.39 0.28 5.21 0.00 -1.26 -4.83 121.76 120.63 2j6r s ALA 68 Ca 0.12 1.00 -0.20 0.00 0.00 0.00 0.00 51.96 52.89 2j6r s ALA 68 Cb 0.03 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.79 2j6r s ALA 68 CO -0.03 -0.35 0.68 -0.59 0.00 0.00 0.00 175.76 175.47 2j6r s PHE 69 N -1.21 -0.09 0.07 0.00 -0.71 -0.59 -4.80 117.98 110.66 2j6r s PHE 69 Ca 0.48 -0.36 0.03 0.00 -1.04 0.00 0.00 56.93 56.04 2j6r s PHE 69 Cb -0.34 0.63 -0.03 0.00 -1.21 0.00 0.00 43.02 42.07 2j6r s PHE 69 CO 0.44 -1.21 -0.09 0.00 -1.34 0.00 0.00 175.22 173.01 2j6r s ALA 70 N -3.88 0.91 -0.11 1.99 0.00 -1.26 -0.99 121.76 118.42 2j6r s ALA 70 Ca 0.13 -1.03 -0.22 0.00 0.00 0.00 0.00 51.96 50.83 2j6r s ALA 70 Cb -0.05 0.03 0.05 0.00 0.00 0.00 0.00 23.12 23.15 2j6r s ALA 70 CO 0.07 -0.03 0.54 -0.08 0.00 0.00 0.00 175.76 176.26 2j6r s THR 71 N -2.06 0.01 0.54 0.00 -1.32 -0.09 -4.96 115.64 107.77 2j6r s THR 71 Ca -0.00 -0.12 -0.21 0.00 -1.21 0.00 0.00 61.69 60.15 2j6r s THR 71 Cb -0.05 -0.81 -0.06 0.00 -1.51 0.00 0.00 72.50 70.07 2j6r s THR 71 CO -0.00 -0.06 1.22 -2.65 -2.21 0.00 0.00 174.62 170.92 2j6r n PRO 72 N 1.79 1.48 -0.35 7.08 -0.02 -1.26 -3.48 135.00 140.24 2j6r n PRO 72 Ca -0.17 0.55 -0.02 0.00 -2.02 0.00 0.00 63.50 61.83 2j6r n PRO 72 Cb 0.56 -2.41 0.11 0.00 -0.02 0.00 0.00 33.50 31.74 2j6r n PRO 72 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2j6r h VAL 73 N 1.25 1.21 -3.59 -1.45 2.07 -1.94 -3.38 116.25 110.43 2j6r h VAL 73 Ca -0.49 -0.42 -0.61 0.00 0.82 0.00 0.00 66.70 65.99 2j6r h VAL 73 Cb 1.32 -0.14 -0.13 0.00 -1.52 0.00 0.00 31.29 30.82 2j6r h VAL 73 CO 0.56 0.23 -0.27 -0.89 0.02 0.00 0.00 177.57 177.21 2j6r s THR 74 N -6.11 5.22 -2.80 2.57 2.01 -1.26 -4.99 115.64 110.28 2j6r s THR 74 Ca -0.13 0.55 0.00 0.00 0.31 0.00 0.00 61.69 62.42 2j6r s THR 74 Cb 0.18 -3.67 0.00 0.00 0.01 0.00 0.00 72.50 69.01 2j6r s THR 74 CO 0.81 0.24 0.00 0.61 -0.69 0.00 0.00 174.62 175.58 2j6r n GLY 75 N 4.27 -1.63 0.82 4.40 0.00 -1.26 -5.00 105.19 106.78 2j6r n GLY 75 Ca -0.10 -1.10 0.08 0.00 0.00 0.00 0.00 46.02 44.91 2j6r n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j6r n GLY 76 N -0.21 1.52 3.80 -0.02 0.00 -1.26 -4.99 105.19 104.04 2j6r n GLY 76 Ca 0.00 -0.52 -0.35 0.00 0.00 0.00 0.00 46.02 45.15 2j6r n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j6r s VAL 77 N -1.18 4.34 -1.18 1.61 1.01 -1.26 -4.96 120.40 118.79 2j6r s VAL 77 Ca 0.27 1.59 -0.21 0.00 0.00 0.00 0.00 61.98 63.63 2j6r s VAL 77 Cb 0.16 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 2j6r s VAL 77 CO 0.22 -0.04 1.90 0.47 0.00 0.00 0.00 175.10 177.65 2j6r n ASP 78 N 0.09 3.51 -0.10 3.32 8.00 -1.26 -4.71 116.55 125.40 2j6r n ASP 78 Ca 0.03 -2.76 -0.19 0.00 0.71 0.00 0.00 54.79 52.59 2j6r n ASP 78 Cb 0.52 -1.66 -0.10 0.00 -0.02 0.00 0.00 41.12 39.86 2j6r n ASP 78 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2j6r h GLY 79 N 15.62 0.00 -7.65 0.44 0.00 -1.93 -3.46 103.07 106.09 2j6r h GLY 79 Ca 0.32 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.97 2j6r h GLY 79 CO 1.41 0.00 -0.67 -0.42 0.00 0.00 0.00 176.54 176.86 2j6r s ILE 80 N -2.34 2.72 0.29 2.60 1.01 -1.26 -4.91 121.20 119.31 2j6r s ILE 80 Ca -0.26 -2.03 -0.29 0.00 0.00 0.00 0.00 60.65 58.07 2j6r s ILE 80 Cb 0.05 -2.84 -0.10 0.00 0.01 0.00 0.00 42.46 39.58 2j6r s ILE 80 CO 0.53 -0.50 1.36 -2.84 0.00 0.00 0.00 174.94 173.49 2j6r s PRO 81 N 1.06 4.32 -0.14 2.79 0.02 -1.26 -1.01 135.00 140.78 2j6r s PRO 81 Ca 0.05 2.24 -0.02 0.00 0.02 0.00 0.00 61.00 63.30 2j6r s PRO 81 Cb -0.21 -3.09 -0.02 0.00 0.02 0.00 0.00 34.50 31.20 2j6r s PRO 81 CO -0.05 -0.28 -0.09 -1.01 -0.33 0.00 0.00 177.00 175.23 2j6r s HIS 82 N -0.62 2.90 -0.28 6.54 3.76 0.71 -0.72 115.29 127.58 2j6r s HIS 82 Ca 0.53 -0.47 -0.06 0.00 -0.15 0.00 0.00 55.06 54.91 2j6r s HIS 82 Cb -0.40 -1.88 0.01 0.00 1.11 0.00 0.00 32.58 31.41 2j6r s HIS 82 CO 0.48 -0.11 0.05 0.42 -0.85 0.00 0.00 174.74 174.73 2j6r s ILE 83 N 0.30 3.83 -0.17 0.60 1.01 0.47 -2.20 121.20 125.04 2j6r s ILE 83 Ca -0.07 -0.67 -0.05 0.00 0.00 0.00 0.00 60.65 59.85 2j6r s ILE 83 Cb -0.15 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.35 2j6r s ILE 83 CO 0.04 0.14 0.01 0.00 0.00 0.00 0.00 174.94 175.13 2j6r s ALA 84 N 1.49 3.19 -0.10 9.38 0.00 -0.39 -4.30 121.76 131.02 2j6r s ALA 84 Ca 0.03 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.21 2j6r s ALA 84 Cb -0.17 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.21 2j6r s ALA 84 CO 0.01 0.21 -0.10 -0.06 0.00 0.00 0.00 175.76 175.82 2j6r s PHE 85 N 0.33 2.85 0.11 0.00 0.08 -1.26 -0.99 117.98 119.10 2j6r s PHE 85 Ca -0.01 -0.34 0.03 0.00 0.12 0.00 0.00 56.93 56.73 2j6r s PHE 85 Cb -0.13 -1.79 -0.04 0.00 -0.57 0.00 0.00 43.02 40.48 2j6r s PHE 85 CO 0.02 0.01 -0.08 0.95 -0.10 0.00 0.00 175.22 176.02 2j6r s THR 86 N -0.11 0.86 0.42 0.64 -4.23 -0.02 -0.49 115.64 112.72 2j6r s THR 86 Ca -0.00 -1.91 -0.01 0.00 -1.18 0.00 0.00 61.69 58.58 2j6r s THR 86 Cb -0.13 -1.66 0.09 0.00 1.34 0.00 0.00 72.50 72.13 2j6r s THR 86 CO 0.03 -0.78 0.58 -0.90 -0.54 0.00 0.00 174.62 173.00 2j6r n ASP 87 N 0.03 0.65 0.06 3.99 5.68 -0.04 -0.49 116.55 126.44 2j6r n ASP 87 Ca -0.12 -1.58 0.08 0.00 -0.50 0.00 0.00 54.79 52.67 2j6r n ASP 87 Cb 0.60 -0.38 0.37 0.00 -1.14 0.00 0.00 41.12 40.57 2j6r n ASP 87 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2j6r n TYR 88 N -2.31 0.38 0.35 2.11 0.18 -1.24 -1.69 117.16 114.94 2j6r n TYR 88 Ca 0.09 0.16 0.11 0.00 1.88 0.00 0.00 57.90 60.14 2j6r n TYR 88 Cb 0.32 -0.75 0.18 0.00 -0.38 0.00 0.00 39.34 38.71 2j6r n TYR 88 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2j6r n GLU 89 N -1.85 2.33 -0.95 -3.48 1.02 -1.26 -4.96 120.64 111.49 2j6r n GLU 89 Ca 0.02 -2.13 0.00 0.00 -0.02 0.00 0.00 57.16 55.03 2j6r n GLU 89 Cb 0.16 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 2j6r n GLU 89 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2j6r n GLY 90 N 1.33 0.59 3.84 0.62 0.00 -0.68 -5.04 105.19 105.84 2j6r n GLY 90 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 2j6r n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j6r s ALA 91 N -2.27 3.22 0.24 4.61 0.00 -1.26 -4.77 121.76 121.53 2j6r s ALA 91 Ca 0.00 0.14 -0.31 0.00 0.00 0.00 0.00 51.96 51.79 2j6r s ALA 91 Cb 0.00 -2.91 -0.13 0.00 0.00 0.00 0.00 23.12 20.08 2j6r s ALA 91 CO 0.00 0.20 1.46 0.45 0.00 0.00 0.00 175.76 177.87 2j6r n SER 92 N -0.63 3.00 -4.49 0.00 2.88 -1.26 -0.86 113.62 112.26 2j6r n SER 92 Ca 0.05 1.14 -0.33 0.00 -1.33 0.00 0.00 58.87 58.39 2j6r n SER 92 Cb 0.54 -1.46 -0.13 0.00 -0.75 0.00 0.00 64.21 62.41 2j6r n SER 92 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2j6r s VAL 93 N 0.07 3.22 -0.09 2.46 1.01 0.36 -4.76 120.40 122.66 2j6r s VAL 93 Ca 0.69 -0.65 0.04 0.00 0.00 0.00 0.00 61.98 62.05 2j6r s VAL 93 Cb -0.62 -2.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.46 2j6r s VAL 93 CO 0.48 0.58 -0.22 -0.69 0.00 0.00 0.00 175.10 175.25 2j6r s VAL 94 N -0.57 2.29 -0.28 2.92 1.01 -1.26 -4.34 120.40 120.16 2j6r s VAL 94 Ca 0.08 -0.95 -0.28 0.00 0.00 0.00 0.00 61.98 60.83 2j6r s VAL 94 Cb -0.12 -1.88 0.01 0.00 0.00 0.00 0.00 36.38 34.39 2j6r s VAL 94 CO 0.01 0.56 1.03 -0.22 0.00 0.00 0.00 175.10 176.48 2j6r s LEU 95 N 0.18 4.01 -0.02 3.92 2.96 -1.26 -4.33 118.68 124.14 2j6r s LEU 95 Ca -0.13 1.13 0.06 0.00 -0.22 0.00 0.00 54.13 54.98 2j6r s LEU 95 Cb -0.16 -3.48 -0.02 0.00 0.50 0.00 0.00 46.19 43.02 2j6r s LEU 95 CO 0.07 -0.76 -0.21 -0.13 -1.32 0.00 0.00 176.35 174.00 2j6r s ARG 96 N 3.39 2.22 0.56 1.98 0.52 0.19 -4.72 118.95 123.09 2j6r s ARG 96 Ca 0.43 -0.87 -0.19 0.00 -0.52 0.00 0.00 55.73 54.58 2j6r s ARG 96 Cb -0.13 -2.18 -0.05 0.00 0.52 0.00 0.00 34.95 33.11 2j6r s ARG 96 CO 0.11 0.58 1.16 -0.80 0.02 0.00 0.00 175.30 176.37 2j6r s ASN 97 N -0.82 5.55 -0.15 0.23 0.02 -1.26 -0.94 114.94 117.57 2j6r s ASN 97 Ca 0.11 2.25 -0.16 0.00 -1.02 0.00 0.00 52.86 54.04 2j6r s ASN 97 Cb -0.10 -2.59 -0.24 0.00 0.02 0.00 0.00 41.25 38.34 2j6r s ASN 97 CO 0.01 -1.34 0.37 -0.55 0.02 0.00 0.00 177.10 175.61 2j6r h ASN 98 N 1.11 0.23 -1.10 -1.22 -1.07 -1.92 -3.45 115.58 108.15 2j6r h ASN 98 Ca -0.50 -0.75 -0.66 0.00 0.07 0.00 0.00 56.30 54.46 2j6r h ASN 98 Cb 1.27 -0.07 -0.14 0.00 -2.07 0.00 0.00 38.32 37.31 2j6r h ASN 98 CO 0.56 1.62 1.79 0.29 0.07 0.00 0.00 177.43 181.76 2j6r n LYS 104 N -4.02 3.91 -0.02 4.14 5.02 -1.26 -5.10 118.16 120.83 2j6r n LYS 104 Ca -0.30 -3.09 0.07 0.00 -2.02 0.00 0.00 58.31 52.97 2j6r n LYS 104 Cb 0.84 -2.48 0.07 0.00 -0.02 0.00 0.00 35.03 33.44 2j6r n LYS 104 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2j6r n LYS 105 N 1.49 1.01 -3.49 1.97 5.02 -0.98 -4.11 118.16 119.06 2j6r n LYS 105 Ca 0.58 -1.36 -0.25 0.00 -2.02 0.00 0.00 58.31 55.26 2j6r n LYS 105 Cb 0.35 -1.26 0.04 0.00 -0.02 0.00 0.00 35.03 34.13 2j6r n LYS 105 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2j6r n GLY 106 N 0.75 -0.52 3.83 0.72 0.00 0.29 -4.72 105.19 105.55 2j6r n GLY 106 Ca 0.08 0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.93 2j6r n GLY 106 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2j6r s LEU 107 N -7.01 4.29 0.26 0.99 1.43 -1.26 -0.84 118.68 116.54 2j6r s LEU 107 Ca 0.51 1.27 -0.05 0.00 -1.03 0.00 0.00 54.13 54.82 2j6r s LEU 107 Cb -0.24 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.41 2j6r s LEU 107 CO 0.62 0.02 0.36 0.00 0.23 0.00 0.00 176.35 177.58 2j6r s ALA 108 N -1.58 0.56 0.07 4.21 0.00 0.03 -4.32 121.76 120.73 2j6r s ALA 108 Ca 0.43 -1.36 -0.06 0.00 0.00 0.00 0.00 51.96 50.97 2j6r s ALA 108 Cb -0.15 1.21 -0.01 0.00 0.00 0.00 0.00 23.12 24.17 2j6r s ALA 108 CO 0.20 -0.75 0.11 1.52 0.00 0.00 0.00 175.76 176.84 2j6r s TYR 109 N -3.77 0.27 0.02 0.00 -0.85 -0.12 -0.12 117.35 112.79 2j6r s TYR 109 Ca 0.31 -0.74 0.00 0.00 -0.52 0.00 0.00 57.07 56.12 2j6r s TYR 109 Cb 0.02 -0.17 -0.01 0.00 0.38 0.00 0.00 41.96 42.17 2j6r s TYR 109 CO 0.14 -0.48 -0.03 -0.59 -1.52 0.00 0.00 175.55 173.06 2j6r s PHE 110 N -3.83 0.27 -0.10 -3.49 -0.12 -0.65 -0.63 117.98 109.44 2j6r s PHE 110 Ca 0.05 -0.37 0.01 0.00 -0.05 0.00 0.00 56.93 56.57 2j6r s PHE 110 Cb 0.06 -0.18 -0.02 0.00 -0.63 0.00 0.00 43.02 42.24 2j6r s PHE 110 CO -0.10 -0.12 -0.13 0.08 -0.05 0.00 0.00 175.22 174.90 2j6r s VAL 111 N -1.02 3.09 0.01 -2.49 1.01 -1.26 -0.74 120.40 119.00 2j6r s VAL 111 Ca -0.10 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.09 2j6r s VAL 111 Cb -0.07 -2.27 0.01 0.00 0.00 0.00 0.00 36.38 34.06 2j6r s VAL 111 CO -0.00 0.55 0.25 -1.48 0.00 0.00 0.00 175.10 174.42 2j6r s LEU 112 N -0.08 1.11 0.61 3.92 2.34 -0.50 -4.64 118.68 121.44 2j6r s LEU 112 Ca -0.02 -0.11 -0.17 0.00 0.06 0.00 0.00 54.13 53.89 2j6r s LEU 112 Cb -0.14 1.10 -0.02 0.00 -0.56 0.00 0.00 46.19 46.56 2j6r s LEU 112 CO 0.04 -0.48 1.12 -2.16 -1.06 0.00 0.00 176.35 173.80 2j6r s PRO 113 N -1.79 3.04 0.15 1.48 0.04 -1.26 -0.38 135.00 136.28 2j6r s PRO 113 Ca -0.11 1.47 0.11 0.00 0.04 0.00 0.00 61.00 62.51 2j6r s PRO 113 Cb -0.04 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 2j6r s PRO 113 CO 0.01 -1.07 -0.24 0.00 0.04 0.00 0.00 177.00 175.74 2j6r s MET 114 N -3.77 1.53 0.22 4.56 0.23 -0.60 -4.45 119.30 117.02 2j6r s MET 114 Ca 0.69 -1.38 0.09 0.00 -1.03 0.00 0.00 55.69 54.06 2j6r s MET 114 Cb -0.22 -1.93 -0.05 0.00 -1.53 0.00 0.00 34.83 31.11 2j6r s MET 114 CO 0.35 0.44 -0.16 -1.59 -2.03 0.00 0.00 175.02 172.03 2j6r s LYS 115 N -2.32 1.40 0.20 3.16 -2.85 0.23 -0.63 119.74 118.92 2j6r s LYS 115 Ca 0.17 -1.60 -0.00 0.00 -1.00 0.00 0.00 55.97 53.54 2j6r s LYS 115 Cb -0.09 -1.31 0.04 0.00 -2.06 0.00 0.00 37.83 34.41 2j6r s LYS 115 CO 0.08 0.23 0.27 0.27 0.10 0.00 0.00 175.35 176.31 2j6r n ASN 116 N -0.33 0.33 0.28 0.03 0.23 -0.23 -0.88 115.26 114.68 2j6r n ASN 116 Ca -0.08 -1.28 0.16 0.00 -0.53 0.00 0.00 54.58 52.84 2j6r n ASN 116 Cb 0.60 -0.18 0.76 0.00 -2.08 0.00 0.00 39.78 38.88 2j6r n ASN 116 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2j6r h ALA 117 N -0.61 1.08 -0.00 -2.53 0.00 -1.91 -0.96 119.26 114.33 2j6r h ALA 117 Ca -0.09 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2j6r h ALA 117 Cb 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2j6r h ALA 117 CO 0.09 0.09 -0.22 0.39 0.00 0.00 0.00 179.25 179.60 2j6r n GLU 118 N -3.30 0.22 -0.40 0.00 4.71 -1.26 -4.92 120.64 115.69 2j6r n GLU 118 Ca -0.01 -0.08 0.00 0.00 -0.01 0.00 0.00 57.16 57.06 2j6r n GLU 118 Cb 0.27 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.20 2j6r n GLU 118 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2j6r n GLY 119 N 1.43 0.78 3.74 0.62 0.00 -0.36 -5.05 105.19 106.35 2j6r n GLY 119 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2j6r n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j6r s THR 120 N -2.17 4.45 0.14 2.61 2.01 -1.26 -4.78 115.64 116.63 2j6r s THR 120 Ca 0.00 1.98 -0.31 0.00 0.31 0.00 0.00 61.69 63.67 2j6r s THR 120 Cb 0.00 -4.28 -0.08 0.00 0.01 0.00 0.00 72.50 68.15 2j6r s THR 120 CO 0.00 0.37 1.38 -0.75 -0.69 0.00 0.00 174.62 174.93 2j6r s LYS 121 N -0.30 4.33 0.00 4.92 2.20 -1.26 -1.07 119.74 128.56 2j6r s LYS 121 Ca 0.44 2.09 0.00 0.00 -0.36 0.00 0.00 55.97 58.14 2j6r s LYS 121 Cb -0.23 -3.23 0.00 0.00 -1.51 0.00 0.00 37.83 32.86 2j6r s LYS 121 CO 0.29 -0.41 0.17 1.33 -0.36 0.00 0.00 175.35 176.37 2j6r n VAL 122 N 3.63 0.00 -0.34 4.02 0.24 0.19 -4.92 118.33 121.15 2j6r n VAL 122 Ca 0.10 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 2j6r n VAL 122 Cb 0.42 1.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 2j6r n VAL 122 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2j6r n GLY 123 N 0.66 -0.35 3.18 7.63 0.00 -1.21 -0.04 105.19 115.06 2j6r n GLY 123 Ca 0.00 -0.90 -0.14 0.00 0.00 0.00 0.00 46.02 44.98 2j6r n GLY 123 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2j6r s SER 124 N -4.00 1.43 -0.07 1.61 1.04 -0.60 -1.56 113.70 111.56 2j6r s SER 124 Ca 0.00 -0.84 0.05 0.00 0.48 0.00 0.00 55.95 55.63 2j6r s SER 124 Cb 0.00 0.02 -0.00 0.00 0.10 0.00 0.00 66.02 66.13 2j6r s SER 124 CO 0.00 -0.29 -0.21 -0.69 0.98 0.00 0.00 173.24 173.03 2j6r s VAL 125 N -2.62 1.80 -0.21 5.02 1.01 0.49 -0.64 120.40 125.25 2j6r s VAL 125 Ca 0.07 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.08 2j6r s VAL 125 Cb -0.02 -1.55 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 2j6r s VAL 125 CO -0.00 0.51 0.03 -0.75 0.00 0.00 0.00 175.10 174.88 2j6r s LYS 126 N 0.13 3.69 -0.22 2.72 2.20 0.80 -1.40 119.74 127.67 2j6r s LYS 126 Ca -0.10 -0.48 -0.06 0.00 -0.36 0.00 0.00 55.97 54.97 2j6r s LYS 126 Cb -0.15 -3.17 -0.03 0.00 -1.51 0.00 0.00 37.83 32.97 2j6r s LYS 126 CO 0.05 0.01 0.04 0.08 -0.36 0.00 0.00 175.35 175.17 2j6r s VAL 127 N 1.05 4.23 -0.02 4.02 1.01 0.08 -0.14 120.40 130.62 2j6r s VAL 127 Ca 0.03 -0.21 -0.23 0.00 0.00 0.00 0.00 61.98 61.57 2j6r s VAL 127 Cb -0.14 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 2j6r s VAL 127 CO 0.02 0.40 0.68 0.20 0.00 0.00 0.00 175.10 176.40 2j6r s ASN 128 N 1.14 7.04 0.26 3.32 0.01 -0.42 -1.63 114.94 124.66 2j6r s ASN 128 Ca 0.04 1.25 -0.02 0.00 -0.71 0.00 0.00 52.86 53.41 2j6r s ASN 128 Cb -0.14 -2.41 -0.02 0.00 0.41 0.00 0.00 41.25 39.08 2j6r s ASN 128 CO 0.02 -0.01 0.29 0.00 -1.51 0.00 0.00 177.10 175.90 2j6r s ALA 129 N 0.25 0.93 -0.02 0.60 0.00 0.84 -4.58 121.76 119.78 2j6r s ALA 129 Ca 0.36 -1.57 0.03 0.00 0.00 0.00 0.00 51.96 50.78 2j6r s ALA 129 Cb -0.19 1.30 -0.01 0.00 0.00 0.00 0.00 23.12 24.23 2j6r s ALA 129 CO 0.19 -0.69 -0.12 -1.12 0.00 0.00 0.00 175.76 174.02 2j6r s SER 130 N -3.18 1.42 0.06 0.00 0.01 0.42 -0.79 113.70 111.64 2j6r s SER 130 Ca 0.34 -0.22 0.01 0.00 1.31 0.00 0.00 55.95 57.39 2j6r s SER 130 Cb 0.03 -0.24 -0.03 0.00 0.21 0.00 0.00 66.02 65.99 2j6r s SER 130 CO 0.16 0.13 -0.06 -0.72 0.41 0.00 0.00 173.24 173.16 2j6r s TYR 131 N -0.13 0.68 -0.12 2.43 1.13 -0.02 -1.47 117.35 119.85 2j6r s TYR 131 Ca 0.02 -0.81 -0.19 0.00 -1.41 0.00 0.00 57.07 54.67 2j6r s TYR 131 Cb -0.06 -0.42 0.05 0.00 -1.10 0.00 0.00 41.96 40.42 2j6r s TYR 131 CO -0.00 -0.20 0.48 0.00 -2.51 0.00 0.00 175.55 173.33 2j6r s ALA 132 N -2.94 -1.21 -0.02 9.51 0.00 -0.24 -4.68 121.76 122.18 2j6r s ALA 132 Ca 0.02 1.10 0.07 0.00 0.00 0.00 0.00 51.96 53.16 2j6r s ALA 132 Cb 0.01 -0.43 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 2j6r s ALA 132 CO -0.04 -0.27 -0.24 0.20 0.00 0.00 0.00 175.76 175.41 2j6r s GLY 133 N -0.43 1.16 -0.01 0.00 0.00 -1.26 -1.18 107.32 105.60 2j6r s GLY 133 Ca -0.06 -1.02 -0.07 0.00 0.00 0.00 0.00 44.72 43.58 2j6r s GLY 133 CO 0.03 -0.83 0.14 0.54 0.00 0.00 0.00 173.10 172.98 2j6r s VAL 134 N -0.53 0.07 0.04 1.40 0.11 -0.45 -1.15 120.40 119.89 2j6r s VAL 134 Ca 0.08 -0.55 -0.01 0.00 -2.93 0.00 0.00 61.98 58.57 2j6r s VAL 134 Cb -0.09 -0.39 -0.04 0.00 -1.53 0.00 0.00 36.38 34.33 2j6r s VAL 134 CO -0.01 -0.30 -0.03 -1.48 -3.33 0.00 0.00 175.10 169.95 2j6r s LEU 135 N -1.08 2.42 0.07 2.54 0.05 -0.43 -0.93 118.68 121.32 2j6r s LEU 135 Ca -0.12 -0.89 0.05 0.00 0.05 0.00 0.00 54.13 53.22 2j6r s LEU 135 Cb -0.06 0.19 -0.04 0.00 -2.05 0.00 0.00 46.19 44.23 2j6r s LEU 135 CO 0.01 -0.54 -0.03 -0.83 -0.55 0.00 0.00 176.35 174.42 2j6r s GLY 136 N -2.60 1.87 -0.02 -3.48 0.00 0.24 -0.42 107.32 102.91 2j6r s GLY 136 Ca 0.02 -1.10 -0.03 0.00 0.00 0.00 0.00 44.72 43.61 2j6r s GLY 136 CO -0.08 -1.05 0.07 -1.60 0.00 0.00 0.00 173.10 170.45 2j6r s ARG 137 N -2.05 0.17 -0.23 2.90 3.52 -0.56 -1.18 118.95 121.52 2j6r s ARG 137 Ca 0.23 -0.04 -0.19 0.00 -0.13 0.00 0.00 55.73 55.60 2j6r s ARG 137 Cb -0.11 0.07 0.06 0.00 -1.56 0.00 0.00 34.95 33.41 2j6r s ARG 137 CO 0.15 -0.03 0.59 0.20 -0.81 0.00 0.00 175.30 175.40 2j6r s GLY 138 N -0.31 -0.46 0.00 8.12 0.00 -0.90 -1.11 107.32 112.66 2j6r s GLY 138 Ca -0.04 1.76 0.00 0.00 0.00 0.00 0.00 44.72 46.44 2j6r s GLY 138 CO 0.00 1.58 0.00 0.61 0.00 0.00 0.00 173.10 175.29 2j6r n GLY 139 N 3.06 2.58 0.58 0.20 0.00 -1.26 -1.61 105.19 108.73 2j6r n GLY 139 Ca -0.15 -2.08 0.09 0.00 0.00 0.00 0.00 46.02 43.88 2j6r n GLY 139 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2j6r n VAL 140 N -0.33 0.00 -0.05 1.61 0.24 -1.26 -4.68 118.33 113.86 2j6r n VAL 140 Ca 0.00 -0.42 -0.07 0.00 -2.04 0.00 0.00 64.34 61.82 2j6r n VAL 140 Cb 0.00 1.30 -0.05 0.00 -1.47 0.00 0.00 33.84 33.62 2j6r n VAL 140 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2j6r n THR 141 N 0.51 0.58 -3.34 3.34 -2.24 -1.26 -4.92 114.28 106.95 2j6r n THR 141 Ca 0.09 -0.25 -0.25 0.00 -2.27 0.00 0.00 64.05 61.37 2j6r n THR 141 Cb 0.41 -0.85 -0.01 0.00 -2.10 0.00 0.00 70.33 67.78 2j6r n THR 141 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2j6r s SER 142 N -4.81 6.32 0.02 3.42 0.15 -1.26 -4.99 113.70 112.55 2j6r s SER 142 Ca -0.12 0.52 0.29 0.00 0.70 0.00 0.00 55.95 57.33 2j6r s SER 142 Cb 0.03 -2.06 1.17 0.00 -1.71 0.00 0.00 66.02 63.46 2j6r s SER 142 CO 0.26 -0.29 1.90 0.00 1.20 0.00 0.00 173.24 176.31 2j6r n ALA 143 N -1.64 2.36 -2.87 5.45 0.00 -1.26 -4.20 120.51 118.35 2j6r n ALA 143 Ca -0.04 -0.10 -0.34 0.00 0.00 0.00 0.00 53.44 52.96 2j6r n ALA 143 Cb 0.56 -1.46 -0.12 0.00 0.00 0.00 0.00 19.45 18.43 2j6r n ALA 143 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2j6r s ASP 144 N -3.16 4.73 0.00 0.00 1.01 -1.26 -0.21 116.67 117.78 2j6r s ASP 144 Ca 0.14 -0.10 0.00 0.00 0.71 0.00 0.00 52.55 53.29 2j6r s ASP 144 Cb 0.18 -1.63 0.00 0.00 1.01 0.00 0.00 42.92 42.49 2j6r s ASP 144 CO 0.54 0.22 0.00 0.61 0.21 0.00 0.00 175.17 176.75 2j6r n GLY 145 N 3.17 3.66 3.14 0.21 0.00 -0.08 -4.77 105.19 110.52 2j6r n GLY 145 Ca -0.18 -2.13 -0.20 0.00 0.00 0.00 0.00 46.02 43.51 2j6r n GLY 145 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j6r s GLU 146 N -0.76 0.94 -0.18 1.61 8.01 -0.27 -0.86 118.70 127.20 2j6r s GLU 146 Ca 0.00 -0.75 0.00 0.00 0.01 0.00 0.00 54.97 54.23 2j6r s GLU 146 Cb 0.00 -0.95 0.02 0.00 -4.31 0.00 0.00 34.13 28.88 2j6r s GLU 146 CO 0.00 0.24 -0.18 -1.17 0.01 0.00 0.00 175.26 174.15 2j6r s LEU 147 N -1.12 2.22 -0.04 1.80 2.96 0.59 -1.50 118.68 123.59 2j6r s LEU 147 Ca 0.02 -0.62 0.06 0.00 -0.22 0.00 0.00 54.13 53.37 2j6r s LEU 147 Cb -0.08 -1.51 -0.01 0.00 0.50 0.00 0.00 46.19 45.09 2j6r s LEU 147 CO 0.01 -0.00 -0.22 -0.76 -1.32 0.00 0.00 176.35 174.06 2j6r s LEU 148 N 1.30 2.02 0.22 -0.68 1.43 0.44 -1.18 118.68 122.24 2j6r s LEU 148 Ca 0.05 -0.44 -0.19 0.00 -1.03 0.00 0.00 54.13 52.51 2j6r s LEU 148 Cb -0.13 -1.22 -0.08 0.00 0.03 0.00 0.00 46.19 44.79 2j6r s LEU 148 CO -0.12 0.23 0.71 -0.55 0.23 0.00 0.00 176.35 176.86 2j6r s SER 149 N -0.23 7.04 0.11 2.29 0.15 -1.26 -1.31 113.70 120.48 2j6r s SER 149 Ca 0.00 1.39 0.09 0.00 0.70 0.00 0.00 55.95 58.14 2j6r s SER 149 Cb -0.12 -2.41 -0.04 0.00 -1.71 0.00 0.00 66.02 61.74 2j6r s SER 149 CO 0.02 0.03 -0.21 -0.76 1.20 0.00 0.00 173.24 173.52 2j6r s LEU 150 N -1.99 2.56 0.50 3.45 1.43 -0.30 -1.54 118.68 122.79 2j6r s LEU 150 Ca 0.43 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.95 2j6r s LEU 150 Cb -0.16 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.60 2j6r s LEU 150 CO 0.21 0.19 0.03 0.72 0.23 0.00 0.00 176.35 177.73 2j6r s PHE 151 N -1.08 1.91 -0.23 0.29 -0.12 -0.38 -4.31 117.98 114.06 2j6r s PHE 151 Ca 0.16 -0.92 -0.05 0.00 -0.05 0.00 0.00 56.93 56.07 2j6r s PHE 151 Cb -0.10 -1.65 0.11 0.00 -0.63 0.00 0.00 43.02 40.75 2j6r s PHE 151 CO 0.08 0.20 0.44 0.00 -0.05 0.00 0.00 175.22 175.89 2j6r s ALA 152 N -2.85 -1.29 -0.02 1.99 0.00 -0.56 -4.31 121.76 114.72 2j6r s ALA 152 Ca 0.11 1.42 0.03 0.00 0.00 0.00 0.00 51.96 53.52 2j6r s ALA 152 Cb 0.02 -1.53 0.05 0.00 0.00 0.00 0.00 23.12 21.66 2j6r s ALA 152 CO 0.06 -0.96 0.90 -0.40 0.00 0.00 0.00 175.76 175.36 2j6r n ASP 153 N 5.39 1.39 -3.86 0.00 5.75 -1.26 -4.59 116.55 119.36 2j6r n ASP 153 Ca -0.07 -1.94 -0.09 0.00 -0.01 0.00 0.00 54.79 52.69 2j6r n ASP 153 Cb 0.50 -0.09 -0.04 0.00 -1.03 0.00 0.00 41.12 40.45 2j6r n ASP 153 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2j6r s GLY 154 N -1.07 0.17 0.48 6.12 0.00 -1.26 -5.04 107.32 106.72 2j6r s GLY 154 Ca 0.05 -0.52 0.20 0.00 0.00 0.00 0.00 44.72 44.45 2j6r s GLY 154 CO 0.01 -0.44 1.98 1.41 0.00 0.00 0.00 173.10 176.06 2j6r h LEU 155 N 2.25 0.19 -3.05 0.66 3.38 -2.00 -1.14 115.31 115.60 2j6r h LEU 155 Ca -0.27 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.58 2j6r h LEU 155 Cb 1.25 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.90 2j6r h LEU 155 CO 0.37 0.11 0.15 -1.54 0.09 0.00 0.00 178.44 177.62 2j6r n SER 156 N -4.43 4.16 -4.61 -0.43 3.41 -1.26 -4.81 113.62 105.65 2j6r n SER 156 Ca 0.10 -2.83 -0.35 0.00 -0.26 0.00 0.00 58.87 55.53 2j6r n SER 156 Cb 0.51 -0.67 -0.10 0.00 -0.26 0.00 0.00 64.21 63.68 2j6r n SER 156 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2j6r s SER 157 N -0.59 5.69 0.30 4.04 0.01 -0.43 -3.88 113.70 118.83 2j6r s SER 157 Ca 0.40 0.04 -0.30 0.00 1.31 0.00 0.00 55.95 57.40 2j6r s SER 157 Cb 0.32 -2.00 -0.12 0.00 0.21 0.00 0.00 66.02 64.43 2j6r s SER 157 CO 0.10 0.10 1.59 2.30 0.41 0.00 0.00 173.24 177.75 2j6r n ILE 158 N 4.02 1.07 -1.12 1.44 -5.35 -0.03 -2.14 119.36 117.23 2j6r n ILE 158 Ca -0.16 -0.27 -0.04 0.00 -0.27 0.00 0.00 62.75 62.01 2j6r n ILE 158 Cb 0.52 -1.95 -0.02 0.00 -1.74 0.00 0.00 39.64 36.45 2j6r n ILE 158 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2j6r n PHE 159 N 2.06 0.00 -1.59 4.28 3.72 0.10 -4.69 117.46 121.33 2j6r n PHE 159 Ca 0.08 0.00 -0.53 0.00 -0.05 0.00 0.00 57.45 56.96 2j6r n PHE 159 Cb 0.37 -1.18 -0.06 0.00 -0.94 0.00 0.00 39.48 37.67 2j6r n PHE 159 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 2j6r n TYR 160 N -2.75 1.50 0.00 1.38 9.36 -0.91 -0.13 117.16 125.61 2j6r n TYR 160 Ca -0.04 0.65 0.00 0.00 3.32 0.00 0.00 57.90 61.83 2j6r n TYR 160 Cb 0.21 -2.33 0.00 0.00 -0.63 0.00 0.00 39.34 36.59 2j6r n TYR 160 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2j6r n GLY 161 N 2.54 2.72 0.19 2.98 0.00 -1.26 -0.40 105.19 111.95 2j6r n GLY 161 Ca 0.19 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.24 2j6r n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j6r n GLY 162 N -0.44 -0.25 2.30 -0.02 0.00 0.81 -4.59 105.19 103.01 2j6r n GLY 162 Ca 0.00 -0.22 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 2j6r n GLY 162 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2j6r n LEU 163 N -0.23 0.88 -4.67 0.99 4.77 -1.22 -4.88 117.00 112.64 2j6r n LEU 163 Ca 0.03 -4.81 -0.45 0.00 -0.03 0.00 0.00 56.01 50.75 2j6r n LEU 163 Cb 0.16 0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 2j6r n LEU 163 CO 0.09 2.02 1.11 -0.81 -1.33 0.00 0.00 177.39 178.47 2j6r n PRO 164 N 1.56 2.12 -3.09 3.23 -0.04 -1.26 -1.50 135.00 136.02 2j6r n PRO 164 Ca 0.24 0.76 -0.39 0.00 -0.04 0.00 0.00 63.50 64.07 2j6r n PRO 164 Cb 0.49 -2.47 -0.05 0.00 -0.04 0.00 0.00 33.50 31.42 2j6r n PRO 164 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2j6r s ARG 165 N 0.20 4.41 0.00 0.54 3.52 -1.26 -4.44 118.95 121.91 2j6r s ARG 165 Ca 0.73 0.90 0.00 0.00 -0.13 0.00 0.00 55.73 57.23 2j6r s ARG 165 Cb -0.66 -3.35 0.00 0.00 -1.56 0.00 0.00 34.95 29.38 2j6r s ARG 165 CO 0.44 0.32 0.00 0.41 -0.81 0.00 0.00 175.30 175.66 2j6r n GLY 166 N 2.42 1.71 0.79 8.12 0.00 -1.26 -4.93 105.19 112.03 2j6r n GLY 166 Ca -0.05 -0.15 0.05 0.00 0.00 0.00 0.00 46.02 45.88 2j6r n GLY 166 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2j6r n SER 167 N 0.00 1.45 -4.73 1.61 7.64 -1.26 -4.92 113.62 113.41 2j6r n SER 167 Ca 0.00 -3.08 -0.32 0.00 1.01 0.00 0.00 58.87 56.48 2j6r n SER 167 Cb 0.00 -0.42 0.10 0.00 -1.01 0.00 0.00 64.21 62.88 2j6r n SER 167 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2j6r s GLU 168 N -1.97 1.99 0.40 1.43 1.03 -1.26 -0.54 118.70 119.77 2j6r s GLU 168 Ca 0.33 1.48 -0.24 0.00 0.03 0.00 0.00 54.97 56.56 2j6r s GLU 168 Cb 0.33 -1.84 -0.11 0.00 -0.80 0.00 0.00 34.13 31.71 2j6r s GLU 168 CO -0.08 -1.89 0.91 1.28 -1.33 0.00 0.00 175.26 174.14 2j6r n LEU 169 N -3.29 1.95 -0.72 1.83 4.77 -1.26 -4.45 117.00 115.84 2j6r n LEU 169 Ca 0.11 1.02 0.06 0.00 -0.03 0.00 0.00 56.01 57.17 2j6r n LEU 169 Cb 0.52 -1.29 0.18 0.00 -2.33 0.00 0.00 43.42 40.50 2j6r n LEU 169 CO 0.50 -1.78 0.32 -1.54 -1.33 0.00 0.00 177.39 173.55 2j6r n SER 170 N 0.75 1.62 -3.72 -1.43 3.41 -1.26 -4.70 113.62 108.28 2j6r n SER 170 Ca 0.10 -3.61 -0.13 0.00 -0.26 0.00 0.00 58.87 54.98 2j6r n SER 170 Cb 0.38 -0.49 -0.10 0.00 -0.26 0.00 0.00 64.21 63.74 2j6r n SER 170 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2j6r s ALA 171 N -2.75 -1.04 0.27 7.33 0.00 -1.23 -0.65 121.76 123.68 2j6r s ALA 171 Ca 0.37 1.26 -0.00 0.00 0.00 0.00 0.00 51.96 53.59 2j6r s ALA 171 Cb 0.37 -0.74 0.56 0.00 0.00 0.00 0.00 23.12 23.31 2j6r s ALA 171 CO -0.08 -0.21 1.76 0.78 0.00 0.00 0.00 175.76 178.00 2j6r h GLY 172 N 5.85 1.41 0.89 0.00 0.00 -1.51 -1.97 103.07 107.74 2j6r h GLY 172 Ca -0.29 -0.25 0.02 0.00 0.00 0.00 0.00 47.33 46.81 2j6r h GLY 172 CO 0.25 -0.06 0.25 1.48 0.00 0.00 0.00 176.54 178.47 2j6r h SER 173 N 0.61 0.40 -0.46 0.19 4.64 -1.86 -0.21 113.55 116.86 2j6r h SER 173 Ca 0.48 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.79 2j6r h SER 173 Cb 0.70 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.69 2j6r h SER 173 CO -0.38 0.29 0.24 0.00 -0.87 0.00 0.00 176.83 176.11 2j6r h ALA 174 N 1.19 0.59 -0.54 5.18 0.00 -1.86 -1.07 119.26 122.76 2j6r h ALA 174 Ca 0.17 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2j6r h ALA 174 Cb 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2j6r h ALA 174 CO -0.08 0.12 0.14 0.00 0.00 0.00 0.00 179.25 179.43 2j6r h ALA 175 N 1.09 0.70 0.00 0.00 0.00 -1.04 -2.35 119.26 117.66 2j6r h ALA 175 Ca 0.16 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 2j6r h ALA 175 Cb 0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2j6r h ALA 175 CO -0.02 0.39 -0.50 0.00 0.00 0.00 0.00 179.25 179.11 2j6r h ALA 176 N 1.02 1.13 -0.56 0.00 0.00 -0.87 -1.30 119.26 118.68 2j6r h ALA 176 Ca 0.17 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 2j6r h ALA 176 Cb 0.32 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2j6r h ALA 176 CO -0.00 0.63 0.14 0.93 0.00 0.00 0.00 179.25 180.95 2j6r h GLU 177 N 0.00 0.86 -0.10 0.00 4.39 -0.88 -1.21 114.58 117.64 2j6r h GLU 177 Ca -0.01 -0.18 -0.11 0.00 0.34 0.00 0.00 59.36 59.41 2j6r h GLU 177 Cb 0.91 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 2j6r h GLU 177 CO 0.07 0.77 -0.38 -0.09 -1.16 0.00 0.00 179.01 178.21 2j6r h ARG 178 N 0.83 0.43 -0.93 2.33 2.43 -0.94 -0.05 114.38 118.48 2j6r h ARG 178 Ca 0.18 -0.33 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 2j6r h ARG 178 Cb 0.29 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 2j6r h ARG 178 CO -0.00 0.96 0.59 1.79 -1.51 0.00 0.00 179.97 181.80 2j6r h THR 179 N -0.00 1.25 -0.13 0.20 1.35 -1.22 -2.44 112.91 111.91 2j6r h THR 179 Ca -0.02 -0.50 0.01 0.00 -0.55 0.00 0.00 66.41 65.34 2j6r h THR 179 Cb 1.02 -0.10 -0.01 0.00 -1.73 0.00 0.00 68.15 67.33 2j6r h THR 179 CO 0.08 0.25 0.06 0.50 -0.25 0.00 0.00 175.52 176.17 2j6r h LYS 180 N 1.28 0.14 -0.61 4.72 3.64 -1.17 0.39 116.57 124.96 2j6r h LYS 180 Ca 0.34 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.76 2j6r h LYS 180 Cb -0.10 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.64 2j6r h LYS 180 CO -0.07 0.09 0.33 1.25 -2.27 0.00 0.00 179.45 178.78 2j6r h LEU 181 N 0.14 0.48 -0.02 5.20 5.85 -0.71 -1.90 115.31 124.35 2j6r h LEU 181 Ca 0.05 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2j6r h LEU 181 Cb 0.01 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 40.97 2j6r h LEU 181 CO -0.03 0.32 0.00 0.49 -0.34 0.00 0.00 178.44 178.87 2j6r n PHE 182 N -4.83 0.22 0.00 1.25 3.72 -0.95 -4.93 117.46 111.95 2j6r n PHE 182 Ca 0.07 0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 2j6r n PHE 182 Cb 0.16 -0.61 0.00 0.00 -0.94 0.00 0.00 39.48 38.09 2j6r n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2j6r n GLY 183 N 1.27 1.42 0.00 1.37 0.00 -0.71 -4.60 105.19 103.93 2j6r n GLY 183 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2j6r n GLY 183 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2j6r n SER 184 N 0.00 0.00 -4.77 1.61 2.88 0.13 -4.98 113.62 108.49 2j6r n SER 184 Ca 0.00 -0.26 -0.41 0.00 -1.33 0.00 0.00 58.87 56.88 2j6r n SER 184 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 2j6r n SER 184 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2j6r s LEU 185 N 0.00 4.32 0.67 2.46 1.43 -1.26 -3.93 118.68 122.37 2j6r s LEU 185 Ca 0.00 2.86 -0.02 0.00 -1.03 0.00 0.00 54.13 55.94 2j6r s LEU 185 Cb 0.00 -3.72 0.08 0.00 0.03 0.00 0.00 46.19 42.59 2j6r s LEU 185 CO 0.00 -0.78 0.94 -0.94 0.23 0.00 0.00 176.35 175.80 2j6r s SER 186 N -0.37 4.72 0.17 2.29 1.04 -1.26 -3.16 113.70 117.13 2j6r s SER 186 Ca 0.53 -0.02 -0.15 0.00 0.48 0.00 0.00 55.95 56.79 2j6r s SER 186 Cb -0.43 -0.59 0.12 0.00 0.10 0.00 0.00 66.02 65.23 2j6r s SER 186 CO 0.57 -1.60 1.73 -0.09 0.98 0.00 0.00 173.24 174.83 2j6r h ARG 187 N -0.39 0.22 -0.62 4.02 2.43 -1.96 -1.15 114.38 116.92 2j6r h ARG 187 Ca -0.41 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 58.78 2j6r h ARG 187 Cb 1.29 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.75 2j6r h ARG 187 CO 0.49 0.15 0.38 -0.91 -1.51 0.00 0.00 179.97 178.56 2j6r h ASN 188 N 0.23 0.61 -0.65 -3.80 2.35 -1.98 0.26 115.58 112.59 2j6r h ASN 188 Ca 0.20 0.01 0.04 0.00 -0.55 0.00 0.00 56.30 55.99 2j6r h ASN 188 Cb 0.24 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.44 2j6r h ASN 188 CO -0.26 0.42 0.39 0.44 -1.65 0.00 0.00 177.43 176.77 2j6r h ASP 189 N 0.74 0.62 -0.24 5.81 3.32 -1.82 -0.62 116.42 124.24 2j6r h ASP 189 Ca 0.25 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.29 2j6r h ASP 189 Cb 0.04 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2j6r h ASP 189 CO -0.11 0.43 0.05 0.40 -1.72 0.00 0.00 179.24 178.29 2j6r h ILE 190 N 0.75 1.21 -0.57 0.35 2.04 -0.84 -0.76 117.51 119.70 2j6r h ILE 190 Ca 0.27 -0.70 0.06 0.00 1.00 0.00 0.00 64.86 65.49 2j6r h ILE 190 Cb 0.06 1.22 -0.06 0.00 -0.74 0.00 0.00 36.82 37.31 2j6r h ILE 190 CO -0.12 0.22 0.27 0.25 0.00 0.00 0.00 178.15 178.77 2j6r h LEU 191 N 0.21 0.36 -0.70 1.44 5.85 -0.76 -1.23 115.31 120.47 2j6r h LEU 191 Ca 0.07 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2j6r h LEU 191 Cb 0.29 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 2j6r h LEU 191 CO 0.00 0.24 0.44 1.23 -0.34 0.00 0.00 178.44 180.00 2j6r h GLY 192 N 0.51 1.01 0.98 3.75 0.00 -0.81 0.30 103.07 108.81 2j6r h GLY 192 Ca 0.27 -0.41 0.01 0.00 0.00 0.00 0.00 47.33 47.19 2j6r h GLY 192 CO -0.21 0.40 0.23 1.46 0.00 0.00 0.00 176.54 178.42 2j6r h GLN 193 N 0.96 0.46 -0.30 4.80 4.20 -0.66 -1.87 115.11 122.69 2j6r h GLN 193 Ca 0.25 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.95 2j6r h GLN 193 Cb -0.05 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.61 2j6r h GLN 193 CO -0.05 0.30 0.18 0.82 -0.67 0.00 0.00 178.83 179.42 2j6r h ILE 194 N 0.47 1.04 -0.41 2.54 1.08 -0.69 -3.12 117.51 118.43 2j6r h ILE 194 Ca 0.13 -0.13 -0.05 0.00 -0.39 0.00 0.00 64.86 64.43 2j6r h ILE 194 Cb -0.04 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 34.33 2j6r h ILE 194 CO -0.04 0.07 0.04 1.56 -0.69 0.00 0.00 178.15 179.09 2j6r h GLN 195 N 0.37 0.63 0.00 2.37 4.20 -0.83 0.11 115.11 121.96 2j6r h GLN 195 Ca 0.12 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 2j6r h GLN 195 Cb -0.01 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.68 2j6r h GLN 195 CO -0.05 0.63 -0.00 0.00 -0.67 0.00 0.00 178.83 178.74 2j6r h ARG 196 N 0.61 0.00 0.00 1.46 3.08 -1.27 -2.96 114.38 115.30 2j6r h ARG 196 Ca 0.13 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.97 2j6r h ARG 196 Cb 0.33 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 2j6r h ARG 196 CO 0.01 0.00 -1.61 0.28 -1.07 0.00 0.00 179.97 177.58 2j6r n VAL 197 N -3.32 1.51 -3.77 2.04 0.31 -0.73 -4.86 118.33 109.51 2j6r n VAL 197 Ca -0.03 -0.08 -0.36 0.00 -0.01 0.00 0.00 64.34 63.86 2j6r n VAL 197 Cb 0.08 -2.14 -0.11 0.00 -0.91 0.00 0.00 33.84 30.75 2j6r n VAL 197 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2j6r s ASN 198 N -6.62 5.23 0.55 4.52 0.01 0.29 -4.96 114.94 113.97 2j6r s ASN 198 Ca -0.32 -2.23 0.34 0.00 -0.71 0.00 0.00 52.86 49.94 2j6r s ASN 198 Cb 0.08 -1.83 1.46 0.00 0.41 0.00 0.00 41.25 41.38 2j6r s ASN 198 CO 0.45 -0.50 2.01 0.00 -1.51 0.00 0.00 177.10 177.55 2j6r h ALA 199 N 7.80 1.00 0.00 0.60 0.00 -1.78 -2.57 119.26 124.31 2j6r h ALA 199 Ca -0.10 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2j6r h ALA 199 Cb 1.02 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2j6r h ALA 199 CO 0.70 0.00 -0.04 -2.95 0.00 0.00 0.00 179.25 176.96 2j6r h ASN 200 N 0.00 0.00 -2.95 0.00 -1.07 -1.89 -3.43 115.58 106.24 2j6r h ASN 200 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 56.30 55.80 2j6r h ASN 200 Cb 0.44 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.65 2j6r h ASN 200 CO 0.00 0.04 0.92 -0.63 0.07 0.00 0.00 177.43 177.83 2j6r s ILE 201 N -4.44 4.26 -0.31 6.14 -1.09 -0.97 -4.14 121.20 120.65 2j6r s ILE 201 Ca -0.04 1.50 0.11 0.00 -2.23 0.00 0.00 60.65 59.99 2j6r s ILE 201 Cb 0.14 -4.03 -0.14 0.00 -1.58 0.00 0.00 42.46 36.85 2j6r s ILE 201 CO 0.55 -0.20 0.37 0.35 -1.23 0.00 0.00 174.94 174.79 2j6r n THR 202 N 5.53 0.00 -3.54 2.92 -2.24 0.71 -4.75 114.28 112.91 2j6r n THR 202 Ca 0.14 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.57 2j6r n THR 202 Cb 0.45 0.70 -0.02 0.00 -2.10 0.00 0.00 70.33 69.36 2j6r n THR 202 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2j6r s SER 203 N -2.52 -0.48 -0.14 3.42 1.04 -1.18 -5.07 113.70 108.78 2j6r s SER 203 Ca 0.01 -0.17 -0.01 0.00 0.48 0.00 0.00 55.95 56.25 2j6r s SER 203 Cb 0.08 0.63 -0.02 0.00 0.10 0.00 0.00 66.02 66.81 2j6r s SER 203 CO 0.45 -1.06 -0.11 -0.76 0.98 0.00 0.00 173.24 172.74 2j6r s LEU 204 N -2.80 2.83 0.09 2.42 1.43 -1.26 -0.91 118.68 120.48 2j6r s LEU 204 Ca 0.04 -0.29 -0.30 0.00 -1.03 0.00 0.00 54.13 52.55 2j6r s LEU 204 Cb -0.02 -1.65 -0.05 0.00 0.03 0.00 0.00 46.19 44.50 2j6r s LEU 204 CO -0.08 0.16 0.99 -0.69 0.23 0.00 0.00 176.35 176.96 2j6r s VAL 205 N 0.39 4.49 -0.32 -1.59 1.01 -0.04 -4.73 120.40 119.60 2j6r s VAL 205 Ca -0.09 1.99 -0.29 0.00 0.00 0.00 0.00 61.98 63.60 2j6r s VAL 205 Cb -0.16 -4.27 -0.01 0.00 0.00 0.00 0.00 36.38 31.95 2j6r s VAL 205 CO 0.05 0.27 1.49 -0.62 0.00 0.00 0.00 175.10 176.28 2j6r s ASP 206 N 0.24 6.37 -0.11 3.32 2.15 -1.26 -0.30 116.67 127.08 2j6r s ASP 206 Ca 0.49 1.19 -0.16 0.00 0.43 0.00 0.00 52.55 54.49 2j6r s ASP 206 Cb -0.24 -2.54 -0.05 0.00 -0.30 0.00 0.00 42.92 39.80 2j6r s ASP 206 CO 0.30 -1.33 0.40 -0.69 -0.17 0.00 0.00 175.17 173.67 2j6r s VAL 207 N 5.29 5.21 0.27 1.11 1.01 -0.32 -4.89 120.40 128.08 2j6r s VAL 207 Ca 0.65 0.79 -0.23 0.00 0.00 0.00 0.00 61.98 63.19 2j6r s VAL 207 Cb -0.18 -3.73 -0.09 0.00 0.00 0.00 0.00 36.38 32.37 2j6r s VAL 207 CO 0.29 0.39 0.84 0.00 0.00 0.00 0.00 175.10 176.63 2j6r s ALA 208 N 0.29 3.31 0.00 5.51 0.00 -1.26 -2.04 121.76 127.57 2j6r s ALA 208 Ca 0.22 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2j6r s ALA 208 Cb -0.15 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 19.96 2j6r s ALA 208 CO 0.08 0.25 0.00 0.41 0.00 0.00 0.00 175.76 176.50 2j6r n GLY 209 N 0.69 -0.67 3.36 0.00 0.00 0.17 -4.96 105.19 103.79 2j6r n GLY 209 Ca -0.00 -2.01 -0.11 0.00 0.00 0.00 0.00 46.02 43.90 2j6r n GLY 209 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2j6r s SER 210 N -4.00 -0.37 0.09 1.61 1.04 -1.26 -3.55 113.70 107.26 2j6r s SER 210 Ca 0.00 -0.16 -0.11 0.00 0.48 0.00 0.00 55.95 56.16 2j6r s SER 210 Cb 0.00 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.65 2j6r s SER 210 CO 0.00 -0.88 0.26 -0.31 0.98 0.00 0.00 173.24 173.29 2j6r s TYR 211 N -3.63 0.02 0.28 5.02 1.51 -0.59 -4.91 117.35 115.06 2j6r s TYR 211 Ca 0.01 -0.38 0.10 0.00 -1.01 0.00 0.00 57.07 55.79 2j6r s TYR 211 Cb 0.01 0.05 -0.05 0.00 -0.11 0.00 0.00 41.96 41.86 2j6r s TYR 211 CO -0.11 -0.58 -0.03 -0.98 -1.11 0.00 0.00 175.55 172.74 2j6r s ARG 212 N -3.66 2.15 -0.04 -0.62 1.70 -1.26 -1.25 118.95 115.97 2j6r s ARG 212 Ca 0.03 -1.54 -0.03 0.00 -0.47 0.00 0.00 55.73 53.72 2j6r s ARG 212 Cb 0.03 -2.05 0.02 0.00 -0.57 0.00 0.00 34.95 32.38 2j6r s ARG 212 CO -0.10 0.31 0.10 -2.00 -1.08 0.00 0.00 175.30 172.52 2j6r s GLU 213 N -3.66 0.08 0.00 3.89 2.56 -1.26 -5.03 118.70 115.27 2j6r s GLU 213 Ca 0.32 0.21 0.11 0.00 0.00 0.00 0.00 54.97 55.62 2j6r s GLU 213 Cb -0.05 -0.07 0.09 0.00 2.00 0.00 0.00 34.13 36.11 2j6r s GLU 213 CO 0.19 -0.08 0.87 0.27 -0.56 0.00 0.00 175.26 175.94 2j6r n ASN 214 N 3.57 1.96 0.00 -1.70 0.23 -1.25 -0.86 115.26 117.22 2j6r n ASN 214 Ca -0.19 -1.48 0.00 0.00 -0.53 0.00 0.00 54.58 52.38 2j6r n ASN 214 Cb 0.56 -0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.25 2j6r n ASN 214 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 2j6r n MET 215 N 0.64 -0.09 -3.45 -3.83 2.81 -1.26 -4.75 117.12 107.19 2j6r n MET 215 Ca 0.07 0.02 -0.40 0.00 -1.81 0.00 0.00 57.70 55.58 2j6r n MET 215 Cb 0.29 -2.94 -0.10 0.00 -0.71 0.00 0.00 33.22 29.75 2j6r n MET 215 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2j6r s GLU 216 N -0.19 3.66 0.01 0.03 2.12 -1.23 -0.91 118.70 122.19 2j6r s GLU 216 Ca 0.00 -0.39 0.00 0.00 0.36 0.00 0.00 54.97 54.94 2j6r s GLU 216 Cb 0.00 -3.77 -0.01 0.00 0.26 0.00 0.00 34.13 30.62 2j6r s GLU 216 CO 0.00 -0.43 -0.02 0.71 -0.54 0.00 0.00 175.26 174.98 2j6r s TYR 217 N 1.93 0.19 -0.97 5.30 1.51 -1.26 -4.98 117.35 119.07 2j6r s TYR 217 Ca 0.10 -0.19 0.09 0.00 -1.01 0.00 0.00 57.07 56.06 2j6r s TYR 217 Cb -0.17 -0.12 0.03 0.00 -0.11 0.00 0.00 41.96 41.59 2j6r s TYR 217 CO 0.11 -0.06 0.68 0.25 -1.11 0.00 0.00 175.55 175.43 2j6r n THR 218 N 2.54 0.00 -0.76 -0.71 -2.24 -1.26 -4.65 114.28 107.19 2j6r n THR 218 Ca -0.16 -0.45 0.08 0.00 -2.27 0.00 0.00 64.05 61.24 2j6r n THR 218 Cb 0.58 1.15 0.22 0.00 -2.10 0.00 0.00 70.33 70.18 2j6r n THR 218 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2j6r n ASP 219 N 0.10 3.53 0.00 3.42 5.75 -1.26 -4.94 116.55 123.15 2j6r n ASP 219 Ca 0.04 -2.73 0.00 0.00 -0.01 0.00 0.00 54.79 52.09 2j6r n ASP 219 Cb 0.21 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 39.85 2j6r n ASP 219 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2j6r n GLY 220 N -0.28 0.71 3.77 6.12 0.00 -1.26 -4.64 105.19 109.62 2j6r n GLY 220 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2j6r n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j6r s THR 221 N -2.40 2.49 0.25 2.61 2.01 -1.26 -4.55 115.64 114.79 2j6r s THR 221 Ca 0.00 0.48 0.05 0.00 0.31 0.00 0.00 61.69 62.53 2j6r s THR 221 Cb 0.00 -3.30 -0.05 0.00 0.01 0.00 0.00 72.50 69.15 2j6r s THR 221 CO 0.00 0.11 -0.02 0.68 -0.69 0.00 0.00 174.62 174.70 2j6r s VAL 222 N -1.15 1.24 -0.04 3.82 -7.23 -0.63 -4.50 120.40 111.91 2j6r s VAL 222 Ca 0.51 -2.06 0.02 0.00 -1.81 0.00 0.00 61.98 58.64 2j6r s VAL 222 Cb -0.42 -2.37 0.01 0.00 0.56 0.00 0.00 36.38 34.16 2j6r s VAL 222 CO 0.56 -0.32 -0.09 -0.69 -0.31 0.00 0.00 175.10 174.24 2j6r s VAL 223 N -3.28 0.87 -0.09 1.32 1.01 -0.16 -2.11 120.40 117.97 2j6r s VAL 223 Ca 0.28 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 2j6r s VAL 223 Cb 0.05 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 2j6r s VAL 223 CO 0.10 0.28 -0.04 -0.55 0.00 0.00 0.00 175.10 174.88 2j6r s SER 224 N 0.48 4.83 0.06 3.32 0.15 -0.33 -1.54 113.70 120.67 2j6r s SER 224 Ca -0.09 0.01 -0.08 0.00 0.70 0.00 0.00 55.95 56.49 2j6r s SER 224 Cb -0.12 -1.35 -0.00 0.00 -1.71 0.00 0.00 66.02 62.84 2j6r s SER 224 CO 0.02 0.34 0.17 0.00 1.20 0.00 0.00 173.24 174.96 2j6r s ALA 225 N -0.65 -0.21 -0.00 5.45 0.00 -1.26 -0.59 121.76 124.50 2j6r s ALA 225 Ca 0.10 -0.53 -0.09 0.00 0.00 0.00 0.00 51.96 51.44 2j6r s ALA 225 Cb -0.12 0.37 0.01 0.00 0.00 0.00 0.00 23.12 23.38 2j6r s ALA 225 CO 0.02 -0.43 0.18 0.00 0.00 0.00 0.00 175.76 175.54 2j6r s ALA 226 N -3.27 -0.45 -0.01 0.00 0.00 -0.11 -1.31 121.76 116.61 2j6r s ALA 226 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 51.96 52.01 2j6r s ALA 226 Cb 0.02 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.22 2j6r s ALA 226 CO -0.08 -0.22 -0.14 -0.47 0.00 0.00 0.00 175.76 174.86 2j6r s TYR 227 N -1.33 1.22 -0.06 0.00 6.14 -0.03 -1.34 117.35 121.95 2j6r s TYR 227 Ca -0.14 -0.24 -0.04 0.00 0.64 0.00 0.00 57.07 57.29 2j6r s TYR 227 Cb -0.07 -0.78 0.03 0.00 0.42 0.00 0.00 41.96 41.56 2j6r s TYR 227 CO 0.02 -0.01 0.15 0.00 0.64 0.00 0.00 175.55 176.35 2j6r s ALA 228 N -0.37 -0.34 -0.08 3.97 0.00 -0.32 -1.25 121.76 123.37 2j6r s ALA 228 Ca 0.05 0.56 0.02 0.00 0.00 0.00 0.00 51.96 52.59 2j6r s ALA 228 Cb -0.05 -0.35 0.01 0.00 0.00 0.00 0.00 23.12 22.72 2j6r s ALA 228 CO -0.00 -0.11 -0.15 -1.17 0.00 0.00 0.00 175.76 174.33 2j6r s LEU 229 N 0.59 1.72 0.34 0.00 2.96 -0.03 -1.08 118.68 123.18 2j6r s LEU 229 Ca -0.04 -0.37 -0.16 0.00 -0.22 0.00 0.00 54.13 53.33 2j6r s LEU 229 Cb -0.06 -0.99 0.04 0.00 0.50 0.00 0.00 46.19 45.68 2j6r s LEU 229 CO -0.03 0.04 0.73 -0.83 -1.32 0.00 0.00 176.35 174.94 2j6r s GLY 230 N 0.75 0.32 -0.28 7.98 0.00 -0.54 0.10 107.32 115.65 2j6r s GLY 230 Ca -0.12 -0.68 -0.13 0.00 0.00 0.00 0.00 44.72 43.79 2j6r s GLY 230 CO 0.03 -0.31 0.28 -0.42 0.00 0.00 0.00 173.10 172.68 2j6r s ILE 231 N -2.94 5.24 0.47 0.90 1.01 0.54 -0.44 121.20 125.98 2j6r s ILE 231 Ca 0.15 0.34 -0.20 0.00 0.00 0.00 0.00 60.65 60.95 2j6r s ILE 231 Cb -0.05 -3.62 -0.09 0.00 0.01 0.00 0.00 42.46 38.70 2j6r s ILE 231 CO 0.11 0.19 0.99 0.00 0.00 0.00 0.00 174.94 176.22 2j6r s ALA 232 N 1.91 2.97 -0.02 9.38 0.00 -1.26 -0.55 121.76 134.19 2j6r s ALA 232 Ca 0.11 0.44 -0.37 0.00 0.00 0.00 0.00 51.96 52.14 2j6r s ALA 232 Cb -0.16 -3.19 -0.16 0.00 0.00 0.00 0.00 23.12 19.62 2j6r s ALA 232 CO 0.11 -0.13 1.50 -1.71 0.00 0.00 0.00 175.76 175.53 2j6r n ASN 233 N -0.96 2.07 0.00 0.00 5.15 -1.09 -1.18 115.26 119.25 2j6r n ASN 233 Ca 0.08 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 55.15 2j6r n ASN 233 Cb 0.53 -1.20 0.00 0.00 -0.53 0.00 0.00 39.78 38.58 2j6r n ASN 233 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2j6r n GLY 234 N 3.17 1.40 3.83 8.20 0.00 -0.13 -4.94 105.19 116.72 2j6r n GLY 234 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 2j6r n GLY 234 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j6r s GLN 235 N -0.75 3.23 0.22 1.61 -0.21 -0.33 -4.68 119.66 118.75 2j6r s GLN 235 Ca 0.00 0.95 0.09 0.00 0.02 0.00 0.00 55.36 56.43 2j6r s GLN 235 Cb 0.00 -2.03 -0.04 0.00 1.00 0.00 0.00 33.01 31.94 2j6r s GLN 235 CO 0.00 -0.87 -0.05 0.95 -2.12 0.00 0.00 175.29 173.20 2j6r s THR 236 N -2.94 3.31 -0.11 -0.19 -4.23 -1.26 -1.44 115.64 108.79 2j6r s THR 236 Ca 0.58 -1.79 0.01 0.00 -1.18 0.00 0.00 61.69 59.31 2j6r s THR 236 Cb -0.13 -2.71 -0.02 0.00 1.34 0.00 0.00 72.50 70.98 2j6r s THR 236 CO 0.50 -0.24 -0.13 -0.63 -0.54 0.00 0.00 174.62 173.57 2j6r s ILE 237 N -2.02 3.09 -0.20 2.99 1.01 -0.10 -1.30 121.20 124.67 2j6r s ILE 237 Ca 0.28 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 60.28 2j6r s ILE 237 Cb -0.08 -2.28 0.04 0.00 0.01 0.00 0.00 42.46 40.16 2j6r s ILE 237 CO 0.18 0.54 -0.11 -1.61 0.00 0.00 0.00 174.94 173.94 2j6r s GLU 238 N 0.06 2.11 -0.23 2.79 2.02 0.80 -0.65 118.70 125.60 2j6r s GLU 238 Ca -0.05 -0.89 -0.11 0.00 0.02 0.00 0.00 54.97 53.95 2j6r s GLU 238 Cb -0.14 -2.47 -0.05 0.00 0.10 0.00 0.00 34.13 31.57 2j6r s GLU 238 CO 0.04 -0.43 0.16 0.00 0.02 0.00 0.00 175.26 175.06 2j6r s ALA 239 N 1.36 3.62 -0.30 5.21 0.00 0.19 -0.14 121.76 131.71 2j6r s ALA 239 Ca -0.02 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.12 2j6r s ALA 239 Cb -0.16 -2.31 0.07 0.00 0.00 0.00 0.00 23.12 20.72 2j6r s ALA 239 CO -0.08 -0.12 -0.01 0.99 0.00 0.00 0.00 175.76 176.53 2j6r s THR 240 N 0.91 2.63 0.19 0.00 2.01 0.18 -0.81 115.64 120.76 2j6r s THR 240 Ca 0.08 -1.66 -0.23 0.00 0.31 0.00 0.00 61.69 60.19 2j6r s THR 240 Cb -0.13 -2.61 -0.08 0.00 0.01 0.00 0.00 72.50 69.69 2j6r s THR 240 CO 0.03 -0.20 0.76 -0.36 -0.69 0.00 0.00 174.62 174.17 2j6r s PHE 241 N 1.14 3.82 0.35 4.92 0.40 0.16 -1.55 117.98 127.21 2j6r s PHE 241 Ca -0.03 1.56 0.06 0.00 -0.60 0.00 0.00 56.93 57.91 2j6r s PHE 241 Cb -0.20 -2.72 0.72 0.00 0.51 0.00 0.00 43.02 41.33 2j6r s PHE 241 CO -0.04 0.45 1.94 -0.91 0.70 0.00 0.00 175.22 177.36 2j6r h ASN 242 N 4.00 0.69 -4.26 1.36 2.35 -0.78 -3.44 115.58 115.51 2j6r h ASN 242 Ca -0.47 0.01 -0.33 0.00 -0.55 0.00 0.00 56.30 54.95 2j6r h ASN 242 Cb 1.20 -0.14 -0.17 0.00 0.05 0.00 0.00 38.32 39.26 2j6r h ASN 242 CO 0.66 0.44 -0.73 -1.10 -1.65 0.00 0.00 177.43 175.04 2j6r s GLN 243 N -5.70 0.91 0.19 0.81 -1.52 -1.26 -5.10 119.66 107.99 2j6r s GLN 243 Ca -0.10 -1.23 -0.31 0.00 -1.95 0.00 0.00 55.36 51.77 2j6r s GLN 243 Cb 0.20 -0.60 -0.16 0.00 -0.22 0.00 0.00 33.01 32.23 2j6r s GLN 243 CO 0.78 0.09 1.01 0.00 -0.25 0.00 0.00 175.29 176.92 2j6r n ALA 244 N 0.41 -1.19 -2.61 6.09 0.00 -1.26 -4.76 120.51 117.19 2j6r n ALA 244 Ca -0.15 0.45 -0.40 0.00 0.00 0.00 0.00 53.44 53.34 2j6r n ALA 244 Cb 0.58 -1.94 -0.07 0.00 0.00 0.00 0.00 19.45 18.02 2j6r n ALA 244 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2j6r s VAL 245 N -0.53 5.04 0.00 0.00 1.01 0.51 -4.88 120.40 121.54 2j6r s VAL 245 Ca 0.69 0.80 0.00 0.00 0.00 0.00 0.00 61.98 63.47 2j6r s VAL 245 Cb -0.86 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 31.65 2j6r s VAL 245 CO 0.55 0.00 0.21 0.35 0.00 0.00 0.00 175.10 176.22 2j6r n THR 246 N 5.24 0.00 -4.31 3.92 -2.24 -1.26 -4.86 114.28 110.77 2j6r n THR 246 Ca -0.04 -0.31 -0.16 0.00 -2.27 0.00 0.00 64.05 61.27 2j6r n THR 246 Cb 0.49 1.26 -0.10 0.00 -2.10 0.00 0.00 70.33 69.88 2j6r n THR 246 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2j6r s THR 247 N -0.19 0.61 0.27 4.28 -4.23 -1.26 -4.97 115.64 110.15 2j6r s THR 247 Ca 0.00 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.21 2j6r s THR 247 Cb 0.00 -2.56 -0.11 0.00 1.34 0.00 0.00 72.50 71.17 2j6r s THR 247 CO 0.00 -0.08 1.53 -0.44 -0.54 0.00 0.00 174.62 175.09 2j6r s SER 248 N -3.30 6.49 0.01 3.99 0.01 -1.26 -4.73 113.70 114.92 2j6r s SER 248 Ca 0.36 2.83 -0.12 0.00 1.31 0.00 0.00 55.95 60.33 2j6r s SER 248 Cb 0.08 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.69 2j6r s SER 248 CO 0.12 -0.83 0.24 0.28 0.41 0.00 0.00 173.24 173.46 2j6r s THR 249 N 0.01 0.08 0.12 1.44 -1.32 0.32 -4.97 115.64 111.31 2j6r s THR 249 Ca 0.62 -0.67 0.02 0.00 -1.21 0.00 0.00 61.69 60.45 2j6r s THR 249 Cb -0.45 -0.71 -0.04 0.00 -1.51 0.00 0.00 72.50 69.79 2j6r s THR 249 CO 0.46 -0.37 0.21 -1.10 -2.21 0.00 0.00 174.62 171.61 2j6r s GLN 250 N -1.88 3.28 0.01 7.08 -0.21 -1.26 0.64 119.66 127.33 2j6r s GLN 250 Ca -0.10 -0.60 0.03 0.00 0.02 0.00 0.00 55.36 54.70 2j6r s GLN 250 Cb -0.04 -2.91 -0.01 0.00 1.00 0.00 0.00 33.01 31.05 2j6r s GLN 250 CO 0.00 0.55 -0.08 1.67 -2.12 0.00 0.00 175.29 175.31 2j6r s TRP 251 N -1.63 0.73 -0.12 0.91 1.48 0.16 -4.19 118.94 116.29 2j6r s TRP 251 Ca 0.33 -0.24 -0.05 0.00 -1.06 0.00 0.00 56.10 55.08 2j6r s TRP 251 Cb -0.12 -0.46 0.05 0.00 -1.16 0.00 0.00 33.47 31.79 2j6r s TRP 251 CO 0.27 -0.02 0.27 0.45 -4.06 0.00 0.00 176.95 173.85 2j6r s SER 252 N -0.62 -0.11 -0.59 -2.66 0.15 -0.06 -1.55 113.70 108.27 2j6r s SER 252 Ca -0.00 0.58 0.05 0.00 0.70 0.00 0.00 55.95 57.28 2j6r s SER 252 Cb -0.05 0.53 0.19 0.00 -1.71 0.00 0.00 66.02 64.98 2j6r s SER 252 CO 0.00 -0.19 0.49 0.00 1.20 0.00 0.00 173.24 174.74 2j6r n ALA 253 N 4.56 3.27 -1.79 5.45 0.00 0.15 -0.60 120.51 131.55 2j6r n ALA 253 Ca -0.20 -4.06 -0.41 0.00 0.00 0.00 0.00 53.44 48.78 2j6r n ALA 253 Cb 0.52 -0.91 -0.01 0.00 0.00 0.00 0.00 19.45 19.05 2j6r n ALA 253 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2j6r s PRO 254 N -1.15 4.19 -0.21 0.00 0.02 -1.26 -3.48 135.00 133.11 2j6r s PRO 254 Ca 0.30 2.46 -0.04 0.00 0.02 0.00 0.00 61.00 63.74 2j6r s PRO 254 Cb 0.03 -3.02 -0.01 0.00 0.02 0.00 0.00 34.50 31.51 2j6r s PRO 254 CO -0.15 -0.47 -0.04 -1.17 -0.33 0.00 0.00 177.00 174.84 2j6r s LEU 255 N -1.42 2.98 -0.05 -5.54 2.96 -0.20 -3.69 118.68 113.72 2j6r s LEU 255 Ca 0.55 -0.33 -0.02 0.00 -0.22 0.00 0.00 54.13 54.11 2j6r s LEU 255 Cb -0.45 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 2j6r s LEU 255 CO 0.55 0.02 0.06 0.20 -1.32 0.00 0.00 176.35 175.86 2j6r s ASN 256 N 1.23 5.63 -0.07 3.68 0.01 0.36 -0.54 114.94 125.24 2j6r s ASN 256 Ca 0.03 0.19 0.05 0.00 -0.71 0.00 0.00 52.86 52.42 2j6r s ASN 256 Cb -0.14 -1.64 -0.00 0.00 0.41 0.00 0.00 41.25 39.87 2j6r s ASN 256 CO -0.01 0.33 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.99 2j6r s VAL 257 N -1.07 1.91 -0.08 1.60 1.01 -0.04 -0.84 120.40 122.90 2j6r s VAL 257 Ca 0.18 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 2j6r s VAL 257 Cb -0.12 -1.64 0.03 0.00 0.00 0.00 0.00 36.38 34.65 2j6r s VAL 257 CO 0.08 0.53 -0.01 0.00 0.00 0.00 0.00 175.10 175.71 2j6r s ALA 258 N 0.09 0.80 -0.18 5.51 0.00 -0.16 -1.60 121.76 126.21 2j6r s ALA 258 Ca -0.10 -0.19 -0.13 0.00 0.00 0.00 0.00 51.96 51.54 2j6r s ALA 258 Cb -0.15 -0.77 -0.05 0.00 0.00 0.00 0.00 23.12 22.16 2j6r s ALA 258 CO 0.05 -0.44 0.25 0.42 0.00 0.00 0.00 175.76 176.04 2j6r s ILE 259 N 1.91 5.32 0.34 0.00 -1.09 0.82 -1.26 121.20 127.24 2j6r s ILE 259 Ca 0.05 0.44 0.04 0.00 -2.23 0.00 0.00 60.65 58.95 2j6r s ILE 259 Cb -0.12 -3.59 -0.02 0.00 -1.58 0.00 0.00 42.46 37.15 2j6r s ILE 259 CO -0.06 0.38 0.15 0.35 -1.23 0.00 0.00 174.94 174.54 2j6r n THR 260 N 3.74 0.00 -4.06 2.92 -2.24 -0.94 -3.70 114.28 110.00 2j6r n THR 260 Ca -0.13 -2.06 -0.13 0.00 -2.27 0.00 0.00 64.05 59.46 2j6r n THR 260 Cb 0.52 0.81 -0.12 0.00 -2.10 0.00 0.00 70.33 69.44 2j6r n THR 260 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2j6r s TYR 261 N -2.94 0.54 -1.75 4.78 2.02 -1.26 -0.21 117.35 118.52 2j6r s TYR 261 Ca 0.22 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.54 2j6r s TYR 261 Cb 0.01 -0.33 0.00 0.00 -0.40 0.00 0.00 41.96 41.24 2j6r s TYR 261 CO 0.15 -0.08 0.44 0.98 -1.57 0.00 0.00 175.55 175.48