#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vlj s ILE 6 N 0.00 5.43 0.17 -0.61 1.09 -1.26 -2.84 121.20 123.17 2vlj s ILE 6 Ca 0.00 0.27 0.09 0.00 -1.10 0.00 0.00 60.65 59.91 2vlj s ILE 6 Cb 0.00 -3.47 -0.04 0.00 -1.06 0.00 0.00 42.46 37.89 2vlj s ILE 6 CO 0.00 0.53 -0.18 0.42 -0.10 0.00 0.00 174.94 175.60 2vlj s THR 7 N -0.37 1.86 -0.08 2.92 -4.23 0.52 -4.64 115.64 111.62 2vlj s THR 7 Ca 0.13 -1.95 -0.06 0.00 -1.18 0.00 0.00 61.69 58.63 2vlj s THR 7 Cb -0.12 -1.88 0.03 0.00 1.34 0.00 0.00 72.50 71.87 2vlj s THR 7 CO 0.02 -0.32 0.20 0.00 -0.54 0.00 0.00 174.62 173.99 2vlj s GLN 8 N -2.84 0.21 0.17 3.99 -2.07 -1.26 -1.38 119.66 116.48 2vlj s GLN 8 Ca 0.17 0.33 0.09 0.00 -1.82 0.00 0.00 55.36 54.13 2vlj s GLN 8 Cb -0.06 0.04 -0.04 0.00 -1.09 0.00 0.00 33.01 31.86 2vlj s GLN 8 CO 0.07 -0.07 -0.18 -1.12 -1.32 0.00 0.00 175.29 172.67 2vlj s SER 9 N 0.42 2.77 0.76 12.60 0.01 -1.25 -4.67 113.70 124.34 2vlj s SER 9 Ca -0.03 -0.88 -0.06 0.00 1.31 0.00 0.00 55.95 56.29 2vlj s SER 9 Cb -0.04 -0.17 0.12 0.00 0.21 0.00 0.00 66.02 66.14 2vlj s SER 9 CO -0.02 -0.03 1.06 -2.16 0.41 0.00 0.00 173.24 172.50 2vlj s PRO 10 N -2.88 1.66 0.05 12.44 0.05 -1.26 -3.85 135.00 141.21 2vlj s PRO 10 Ca 0.17 -0.66 -0.24 0.00 0.05 0.00 0.00 61.00 60.32 2vlj s PRO 10 Cb -0.05 -2.18 -0.16 0.00 0.05 0.00 0.00 34.50 32.16 2vlj s PRO 10 CO 0.07 -1.56 1.54 -0.22 0.05 0.00 0.00 177.00 176.89 2vlj h LYS 11 N -0.77 0.05 -5.54 4.56 3.64 -1.83 -3.41 116.57 113.28 2vlj h LYS 11 Ca -0.41 -0.01 -0.67 0.00 -1.27 0.00 0.00 60.65 58.29 2vlj h LYS 11 Cb 1.28 -0.01 -0.28 0.00 -0.41 0.00 0.00 32.23 32.81 2vlj h LYS 11 CO 0.47 0.25 -0.80 0.71 -2.27 0.00 0.00 179.45 177.81 2vlj s TYR 12 N -5.33 2.71 0.04 1.91 2.02 -1.26 -1.59 117.35 115.85 2vlj s TYR 12 Ca -0.14 -0.65 0.05 0.00 -0.37 0.00 0.00 57.07 55.96 2vlj s TYR 12 Cb 0.05 -1.76 -0.02 0.00 -0.40 0.00 0.00 41.96 39.82 2vlj s TYR 12 CO 0.68 -0.19 -0.15 -0.51 -1.57 0.00 0.00 175.55 173.80 2vlj s LEU 13 N 0.13 2.18 -0.03 -1.29 1.43 -0.56 -4.97 118.68 115.59 2vlj s LEU 13 Ca -0.08 -0.49 -0.00 0.00 -1.03 0.00 0.00 54.13 52.53 2vlj s LEU 13 Cb -0.15 -0.66 0.03 0.00 0.03 0.00 0.00 46.19 45.43 2vlj s LEU 13 CO 0.05 0.04 0.03 0.12 0.23 0.00 0.00 176.35 176.83 2vlj s PHE 14 N -0.88 0.08 0.08 0.29 5.36 -1.26 -2.04 117.98 119.61 2vlj s PHE 14 Ca 0.02 0.13 0.00 0.00 -0.96 0.00 0.00 56.93 56.13 2vlj s PHE 14 Cb -0.08 -0.31 -0.04 0.00 -0.34 0.00 0.00 43.02 42.24 2vlj s PHE 14 CO 0.01 -0.12 -0.03 1.03 -1.46 0.00 0.00 175.22 174.65 2vlj s ARG 15 N 1.29 0.76 0.02 10.12 1.81 -0.42 -5.00 118.95 127.54 2vlj s ARG 15 Ca -0.06 -1.30 -0.14 0.00 -1.72 0.00 0.00 55.73 52.51 2vlj s ARG 15 Cb -0.13 0.03 -0.06 0.00 -0.45 0.00 0.00 34.95 34.34 2vlj s ARG 15 CO -0.03 -0.09 0.41 0.21 -0.68 0.00 0.00 175.30 175.12 2vlj s LYS 16 N -3.90 3.88 0.19 3.54 2.20 -1.26 -0.27 119.74 124.12 2vlj s LYS 16 Ca 0.12 0.36 -0.33 0.00 -0.36 0.00 0.00 55.97 55.76 2vlj s LYS 16 Cb 0.07 -3.16 -0.14 0.00 -1.51 0.00 0.00 37.83 33.09 2vlj s LYS 16 CO -0.06 0.66 1.36 -1.91 -0.36 0.00 0.00 175.35 175.03 2vlj n GLU 17 N 1.57 1.73 0.00 4.03 0.00 -0.53 -2.27 120.64 125.17 2vlj n GLU 17 Ca -0.12 0.62 0.00 0.00 0.00 0.00 0.00 57.16 57.65 2vlj n GLU 17 Cb 0.52 -2.25 0.00 0.00 0.00 0.00 0.00 31.44 29.72 2vlj n GLU 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2vlj n GLY 18 N 2.34 0.30 3.86 8.31 0.00 -1.26 -5.06 105.19 113.68 2vlj n GLY 18 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 2vlj n GLY 18 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2vlj s GLN 19 N -0.86 3.76 0.31 1.61 -0.21 -0.96 -4.83 119.66 118.47 2vlj s GLN 19 Ca 0.00 0.19 -0.17 0.00 0.02 0.00 0.00 55.36 55.39 2vlj s GLN 19 Cb 0.00 -3.07 -0.09 0.00 1.00 0.00 0.00 33.01 30.85 2vlj s GLN 19 CO 0.00 0.62 0.77 -0.80 -2.12 0.00 0.00 175.29 173.75 2vlj s ASN 20 N -1.54 6.89 0.00 5.90 -0.87 -1.26 -4.57 114.94 119.50 2vlj s ASN 20 Ca 0.29 1.39 -0.02 0.00 -1.57 0.00 0.00 52.86 52.95 2vlj s ASN 20 Cb -0.14 -2.41 -0.01 0.00 -0.02 0.00 0.00 41.25 38.67 2vlj s ASN 20 CO 0.16 -0.15 0.04 0.54 -2.57 0.00 0.00 177.10 175.11 2vlj s VAL 21 N -1.87 0.06 -0.14 1.60 0.11 -0.29 -5.01 120.40 114.87 2vlj s VAL 21 Ca 0.52 -0.54 0.02 0.00 -2.93 0.00 0.00 61.98 59.06 2vlj s VAL 21 Cb -0.12 -0.24 0.01 0.00 -1.53 0.00 0.00 36.38 34.50 2vlj s VAL 21 CO 0.18 -0.29 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.55 2vlj s THR 22 N -0.91 2.13 -0.10 5.04 2.01 -1.26 -0.72 115.64 121.82 2vlj s THR 22 Ca -0.10 -0.96 -0.09 0.00 0.31 0.00 0.00 61.69 60.85 2vlj s THR 22 Cb -0.06 -1.85 -0.04 0.00 0.01 0.00 0.00 72.50 70.55 2vlj s THR 22 CO -0.00 0.55 0.19 -0.76 -0.69 0.00 0.00 174.62 173.91 2vlj s LEU 23 N 0.78 4.39 -0.05 4.42 1.43 0.18 -4.91 118.68 124.92 2vlj s LEU 23 Ca -0.08 0.55 -0.15 0.00 -1.03 0.00 0.00 54.13 53.42 2vlj s LEU 23 Cb -0.16 -2.17 -0.05 0.00 0.03 0.00 0.00 46.19 43.84 2vlj s LEU 23 CO -0.01 0.38 0.40 -0.55 0.23 0.00 0.00 176.35 176.79 2vlj s SER 24 N -0.94 6.72 -0.16 2.29 0.15 -1.25 -1.41 113.70 119.10 2vlj s SER 24 Ca 0.16 0.85 -0.04 0.00 0.70 0.00 0.00 55.95 57.63 2vlj s SER 24 Cb -0.13 -2.24 0.08 0.00 -1.71 0.00 0.00 66.02 62.01 2vlj s SER 24 CO 0.05 0.23 0.19 0.00 1.20 0.00 0.00 173.24 174.92 2vlj s GLU 26 N 2.30 0.95 -0.10 0.00 0.41 -0.48 -2.06 118.70 119.73 2vlj s GLU 26 Ca 0.05 -0.95 -0.10 0.00 -0.41 0.00 0.00 54.97 53.56 2vlj s GLU 26 Cb -0.15 -1.02 0.03 0.00 -1.78 0.00 0.00 34.13 31.21 2vlj s GLU 26 CO -0.10 0.24 0.28 1.14 -0.49 0.00 0.00 175.26 176.33 2vlj s GLN 27 N -1.58 0.35 -0.37 1.61 1.03 -0.63 -0.36 119.66 119.71 2vlj s GLN 27 Ca 0.01 0.33 0.05 0.00 0.04 0.00 0.00 55.36 55.79 2vlj s GLN 27 Cb -0.09 0.17 0.46 0.00 0.03 0.00 0.00 33.01 33.57 2vlj s GLN 27 CO 0.02 -0.05 1.40 0.27 -2.54 0.00 0.00 175.29 174.39 2vlj n ASN 28 N 2.78 5.34 -0.11 12.60 0.23 -1.13 -4.67 115.26 130.30 2vlj n ASN 28 Ca -0.14 -3.77 0.12 0.00 -0.53 0.00 0.00 54.58 50.26 2vlj n ASN 28 Cb 0.58 -0.51 0.16 0.00 -2.08 0.00 0.00 39.78 37.93 2vlj n ASN 28 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2vlj n LEU 29 N -0.79 0.91 -1.29 -4.53 4.77 -1.26 -4.71 117.00 110.10 2vlj n LEU 29 Ca 0.47 -0.26 -0.06 0.00 -0.03 0.00 0.00 56.01 56.12 2vlj n LEU 29 Cb 0.90 -0.13 0.02 0.00 -2.33 0.00 0.00 43.42 41.87 2vlj n LEU 29 CO 0.47 0.20 0.06 -3.20 -1.33 0.00 0.00 177.39 173.59 2vlj n ASN 30 N -1.15 -3.12 -4.81 -1.43 5.15 -1.26 -4.99 115.26 103.65 2vlj n ASN 30 Ca 0.07 -0.14 -0.37 0.00 -0.60 0.00 0.00 54.58 53.54 2vlj n ASN 30 Cb 0.35 -1.66 -0.06 0.00 -0.53 0.00 0.00 39.78 37.88 2vlj n ASN 30 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2vlj s HIS 31 N -3.08 3.59 0.16 1.20 3.76 -1.26 -4.85 115.29 114.81 2vlj s HIS 31 Ca 0.15 0.73 0.10 0.00 -0.15 0.00 0.00 55.06 55.89 2vlj s HIS 31 Cb -0.07 -2.22 0.11 0.00 1.11 0.00 0.00 32.58 31.51 2vlj s HIS 31 CO 0.19 0.51 1.46 -0.44 -0.85 0.00 0.00 174.74 175.61 2vlj h ASP 32 N 5.53 0.00 -3.35 1.40 3.32 -1.37 -3.46 116.42 118.48 2vlj h ASP 32 Ca -0.48 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 55.90 2vlj h ASP 32 Cb 1.20 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 40.45 2vlj h ASP 32 CO 0.66 0.76 -0.83 0.00 -1.72 0.00 0.00 179.24 178.11 2vlj s ALA 33 N -3.16 2.37 0.10 3.45 0.00 -1.06 -3.42 121.76 120.04 2vlj s ALA 33 Ca 0.00 -0.94 0.05 0.00 0.00 0.00 0.00 51.96 51.08 2vlj s ALA 33 Cb 0.11 -0.99 -0.03 0.00 0.00 0.00 0.00 23.12 22.21 2vlj s ALA 33 CO 0.78 0.28 -0.13 -1.64 0.00 0.00 0.00 175.76 175.04 2vlj s MET 34 N 0.32 0.91 -0.01 0.00 -1.94 0.13 -1.49 119.30 117.22 2vlj s MET 34 Ca -0.15 -1.11 -0.04 0.00 -1.71 0.00 0.00 55.69 52.68 2vlj s MET 34 Cb -0.17 -0.81 -0.00 0.00 2.01 0.00 0.00 34.83 35.86 2vlj s MET 34 CO 0.07 0.16 0.08 0.71 -0.01 0.00 0.00 175.02 176.04 2vlj s TYR 35 N -1.85 0.03 -0.04 -0.03 1.51 -0.67 -0.38 117.35 115.92 2vlj s TYR 35 Ca 0.04 -0.05 0.03 0.00 -1.01 0.00 0.00 57.07 56.07 2vlj s TYR 35 Cb -0.07 -0.04 0.01 0.00 -0.11 0.00 0.00 41.96 41.75 2vlj s TYR 35 CO 0.02 -0.16 -0.11 -1.58 -1.11 0.00 0.00 175.55 172.61 2vlj s TRP 36 N -0.78 1.23 0.12 2.71 0.52 -0.64 -1.80 118.94 120.29 2vlj s TRP 36 Ca -0.09 -0.36 0.10 0.00 0.02 0.00 0.00 56.10 55.78 2vlj s TRP 36 Cb -0.05 -0.88 -0.04 0.00 -1.15 0.00 0.00 33.47 31.35 2vlj s TRP 36 CO 0.00 -0.16 -0.26 0.71 0.02 0.00 0.00 176.95 177.26 2vlj s TYR 37 N 0.33 2.22 0.22 -1.98 1.51 -0.33 -0.35 117.35 118.98 2vlj s TYR 37 Ca -0.07 -0.39 0.07 0.00 -1.01 0.00 0.00 57.07 55.68 2vlj s TYR 37 Cb -0.11 -1.21 -0.04 0.00 -0.11 0.00 0.00 41.96 40.48 2vlj s TYR 37 CO 0.02 0.31 0.12 -0.98 -1.11 0.00 0.00 175.55 173.90 2vlj s ARG 38 N -1.99 2.72 -0.07 -0.62 1.70 -0.27 -1.43 118.95 118.98 2vlj s ARG 38 Ca 0.13 -1.09 -0.03 0.00 -0.47 0.00 0.00 55.73 54.27 2vlj s ARG 38 Cb -0.10 -2.48 0.04 0.00 -0.57 0.00 0.00 34.95 31.85 2vlj s ARG 38 CO 0.06 0.42 0.15 -1.14 -1.08 0.00 0.00 175.30 173.71 2vlj s GLN 39 N -3.51 0.05 0.27 3.89 0.74 0.02 -0.77 119.66 120.35 2vlj s GLN 39 Ca 0.31 0.48 -0.03 0.00 0.05 0.00 0.00 55.36 56.17 2vlj s GLN 39 Cb -0.08 -0.24 -0.05 0.00 1.10 0.00 0.00 33.01 33.74 2vlj s GLN 39 CO 0.23 -0.25 0.51 -0.51 -0.55 0.00 0.00 175.29 174.72 2vlj s ASP 40 N 1.85 6.42 0.18 6.67 1.01 -1.26 -2.44 116.67 129.09 2vlj s ASP 40 Ca -0.02 0.62 -0.33 0.00 0.71 0.00 0.00 52.55 53.53 2vlj s ASP 40 Cb -0.12 -2.10 -0.14 0.00 1.01 0.00 0.00 42.92 41.57 2vlj s ASP 40 CO -0.06 -0.16 1.46 -2.65 0.21 0.00 0.00 175.17 173.96 2vlj n PRO 41 N -0.93 1.89 -0.94 8.23 -0.02 -1.26 -0.69 135.00 141.28 2vlj n PRO 41 Ca -0.03 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 2vlj n PRO 41 Cb 0.54 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2vlj n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vlj n GLY 42 N 2.77 0.11 3.97 -1.23 0.00 -1.26 -5.00 105.19 104.55 2vlj n GLY 42 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 2vlj n GLY 42 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2vlj s GLN 43 N -1.51 2.49 0.03 1.61 -0.21 0.13 -5.15 119.66 117.05 2vlj s GLN 43 Ca 0.00 -1.58 -0.00 0.00 0.02 0.00 0.00 55.36 53.80 2vlj s GLN 43 Cb 0.00 -2.51 0.01 0.00 1.00 0.00 0.00 33.01 31.50 2vlj s GLN 43 CO 0.00 -0.50 0.04 0.41 -2.12 0.00 0.00 175.29 173.12 2vlj n GLY 44 N -1.89 0.43 3.81 3.09 0.00 -1.26 -4.75 105.19 104.62 2vlj n GLY 44 Ca 0.08 -1.91 -0.37 0.00 0.00 0.00 0.00 46.02 43.82 2vlj n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vlj s LEU 45 N 0.00 4.44 -0.09 0.99 1.43 -1.26 -4.30 118.68 119.89 2vlj s LEU 45 Ca 0.03 1.35 0.04 0.00 -1.03 0.00 0.00 54.13 54.51 2vlj s LEU 45 Cb -0.00 -3.27 0.00 0.00 0.03 0.00 0.00 46.19 42.95 2vlj s LEU 45 CO 0.02 0.15 -0.21 -0.13 0.23 0.00 0.00 176.35 176.41 2vlj s ARG 46 N -1.57 2.69 -0.13 1.70 0.52 0.05 -4.98 118.95 117.24 2vlj s ARG 46 Ca 0.36 -0.77 -0.27 0.00 -0.52 0.00 0.00 55.73 54.53 2vlj s ARG 46 Cb -0.18 -2.08 -0.01 0.00 0.52 0.00 0.00 34.95 33.19 2vlj s ARG 46 CO 0.21 0.16 0.92 -1.17 0.02 0.00 0.00 175.30 175.44 2vlj s LEU 47 N 0.37 4.22 -0.13 2.53 2.96 -1.26 -1.12 118.68 126.25 2vlj s LEU 47 Ca -0.17 1.37 -0.10 0.00 -0.22 0.00 0.00 54.13 55.01 2vlj s LEU 47 Cb -0.17 -3.40 -0.03 0.00 0.50 0.00 0.00 46.19 43.09 2vlj s LEU 47 CO 0.07 -0.41 -0.19 -0.38 -1.32 0.00 0.00 176.35 174.13 2vlj n ILE 48 N 4.57 1.28 -3.75 6.68 5.41 0.53 -1.07 119.36 133.00 2vlj n ILE 48 Ca 0.06 0.24 -0.13 0.00 1.00 0.00 0.00 62.75 63.92 2vlj n ILE 48 Cb 0.49 -2.29 -0.10 0.00 -0.71 0.00 0.00 39.64 37.03 2vlj n ILE 48 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 2vlj s TYR 49 N -2.22 -0.31 0.33 1.39 2.02 -1.20 -0.32 117.35 117.04 2vlj s TYR 49 Ca -0.16 0.68 0.04 0.00 -0.37 0.00 0.00 57.07 57.25 2vlj s TYR 49 Cb 0.02 0.12 -0.04 0.00 -0.40 0.00 0.00 41.96 41.66 2vlj s TYR 49 CO 0.23 -0.27 0.15 1.52 -1.57 0.00 0.00 175.55 175.61 2vlj s TYR 50 N -0.42 1.67 -0.26 2.71 -0.85 -0.73 -1.62 117.35 117.85 2vlj s TYR 50 Ca -0.05 -1.33 -0.02 0.00 -0.52 0.00 0.00 57.07 55.14 2vlj s TYR 50 Cb -0.04 -0.94 0.15 0.00 0.38 0.00 0.00 41.96 41.51 2vlj s TYR 50 CO 0.02 -0.45 0.41 0.45 -1.52 0.00 0.00 175.55 174.46 2vlj s SER 51 N -3.43 0.05 0.42 -0.18 0.15 0.49 -1.25 113.70 109.95 2vlj s SER 51 Ca 0.34 0.20 0.23 0.00 0.70 0.00 0.00 55.95 57.41 2vlj s SER 51 Cb 0.05 1.25 0.74 0.00 -1.71 0.00 0.00 66.02 66.35 2vlj s SER 51 CO 0.17 -0.30 1.75 1.56 1.20 0.00 0.00 173.24 177.62 2vlj h GLN 52 N 8.16 0.00 -1.80 5.44 4.20 -1.83 0.36 115.11 129.64 2vlj h GLN 52 Ca -0.18 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.54 2vlj h GLN 52 Cb 1.15 0.00 -0.22 0.00 0.30 0.00 0.00 27.48 28.71 2vlj h GLN 52 CO 0.27 0.25 0.34 -1.50 -0.67 0.00 0.00 178.83 177.51 2vlj s ILE 53 N -3.50 0.00 0.25 2.54 1.10 -1.22 -3.95 121.20 116.41 2vlj s ILE 53 Ca 0.02 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 59.87 2vlj s ILE 53 Cb 0.09 -1.00 -0.15 0.00 0.15 0.00 0.00 42.46 41.55 2vlj s ILE 53 CO 0.65 0.00 0.90 0.55 -2.11 0.00 0.00 174.94 174.94 2vlj n VAL 54 N 1.32 1.81 -1.21 4.00 3.14 -1.26 -2.29 118.33 123.85 2vlj n VAL 54 Ca -0.14 -0.45 -0.04 0.00 -2.96 0.00 0.00 64.34 60.74 2vlj n VAL 54 Cb 0.57 -0.70 -0.02 0.00 -1.06 0.00 0.00 33.84 32.63 2vlj n VAL 54 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2vlj n ASN 55 N 1.53 -3.40 -3.66 6.55 3.02 0.13 -5.00 115.26 114.43 2vlj n ASN 55 Ca 0.13 0.10 -0.09 0.00 -0.03 0.00 0.00 54.58 54.69 2vlj n ASN 55 Cb 0.29 -1.41 -0.08 0.00 -0.61 0.00 0.00 39.78 37.96 2vlj n ASN 55 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2vlj s ASP 56 N -2.94 -0.78 0.20 6.41 -1.08 -0.97 -5.04 116.67 112.47 2vlj s ASP 56 Ca 0.00 1.28 -0.01 0.00 -0.52 0.00 0.00 52.55 53.30 2vlj s ASP 56 Cb 0.00 1.16 -0.04 0.00 -1.46 0.00 0.00 42.92 42.58 2vlj s ASP 56 CO 0.00 -0.22 0.13 0.72 0.52 0.00 0.00 175.17 176.32 2vlj s PHE 57 N 1.50 1.18 0.01 -5.34 -0.71 -1.26 -4.15 117.98 109.20 2vlj s PHE 57 Ca -0.09 -1.37 -0.27 0.00 -1.04 0.00 0.00 56.93 54.16 2vlj s PHE 57 Cb -0.06 -0.58 0.06 0.00 -1.21 0.00 0.00 43.02 41.23 2vlj s PHE 57 CO -0.16 -0.62 0.62 1.14 -1.34 0.00 0.00 175.22 174.85 2vlj s GLN 58 N -4.15 1.08 0.48 1.99 -2.07 -0.38 -4.98 119.66 111.63 2vlj s GLN 58 Ca 0.39 0.00 -0.21 0.00 -1.82 0.00 0.00 55.36 53.72 2vlj s GLN 58 Cb 0.07 0.50 -0.08 0.00 -1.09 0.00 0.00 33.01 32.41 2vlj s GLN 58 CO 0.12 -0.37 1.06 0.15 -1.32 0.00 0.00 175.29 174.92 2vlj s LYS 59 N -1.92 3.78 0.00 9.60 1.02 -1.26 -1.77 119.74 129.19 2vlj s LYS 59 Ca -0.08 1.44 0.00 0.00 0.02 0.00 0.00 55.97 57.35 2vlj s LYS 59 Cb -0.01 -2.16 0.00 0.00 -0.52 0.00 0.00 37.83 35.15 2vlj s LYS 59 CO 0.03 -0.46 0.00 0.41 -0.92 0.00 0.00 175.35 174.41 2vlj n GLY 60 N -0.08 1.45 0.18 -3.33 0.00 0.57 -4.80 105.19 99.19 2vlj n GLY 60 Ca 0.09 -1.90 0.06 0.00 0.00 0.00 0.00 46.02 44.27 2vlj n GLY 60 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2vlj h ASP 61 N 0.00 0.00 -1.57 1.61 3.32 -1.32 -3.38 116.42 115.08 2vlj h ASP 61 Ca 0.00 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.60 2vlj h ASP 61 Cb 0.00 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.15 2vlj h ASP 61 CO 0.00 0.37 -1.10 0.00 -1.72 0.00 0.00 179.24 176.79 2vlj n ILE 62 N -3.38 0.89 -0.00 0.35 0.00 -1.03 -4.92 119.36 111.26 2vlj n ILE 62 Ca 0.01 -4.10 -0.09 0.00 0.00 0.00 0.00 62.75 58.57 2vlj n ILE 62 Cb 0.56 -0.10 -0.14 0.00 0.00 0.00 0.00 39.64 39.96 2vlj n ILE 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2vlj h ALA 63 N 2.95 0.68 -1.57 1.51 0.00 -1.75 -3.43 119.26 117.65 2vlj h ALA 63 Ca 0.04 -1.35 -0.69 0.00 0.00 0.00 0.00 54.91 52.91 2vlj h ALA 63 Cb 1.00 0.37 0.06 0.00 0.00 0.00 0.00 17.79 19.22 2vlj h ALA 63 CO 0.57 1.51 0.34 0.39 0.00 0.00 0.00 179.25 182.05 2vlj n GLU 64 N -3.12 0.94 -0.63 0.00 -0.58 -1.26 -1.92 120.64 114.07 2vlj n GLU 64 Ca -0.14 0.34 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 2vlj n GLU 64 Cb 1.03 -1.92 0.00 0.00 -0.57 0.00 0.00 31.44 29.98 2vlj n GLU 64 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2vlj n GLY 65 N 2.26 0.98 3.51 0.62 0.00 -1.26 -4.48 105.19 106.81 2vlj n GLY 65 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2vlj n GLY 65 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vlj s TYR 66 N -3.33 2.69 0.22 1.61 1.51 -0.81 -2.29 117.35 116.96 2vlj s TYR 66 Ca 0.00 -0.17 0.05 0.00 -1.01 0.00 0.00 57.07 55.94 2vlj s TYR 66 Cb 0.00 -1.53 -0.05 0.00 -0.11 0.00 0.00 41.96 40.27 2vlj s TYR 66 CO 0.00 0.29 -0.04 -1.54 -1.11 0.00 0.00 175.55 173.15 2vlj s SER 67 N -1.40 2.07 0.12 2.29 1.04 -0.65 -5.02 113.70 112.15 2vlj s SER 67 Ca 0.15 -1.16 -0.01 0.00 0.48 0.00 0.00 55.95 55.42 2vlj s SER 67 Cb -0.11 -0.04 -0.04 0.00 0.10 0.00 0.00 66.02 65.93 2vlj s SER 67 CO 0.06 -0.42 0.04 0.68 0.98 0.00 0.00 173.24 174.58 2vlj s VAL 68 N -3.28 0.16 0.02 5.02 -7.23 -1.26 -1.58 120.40 112.24 2vlj s VAL 68 Ca 0.26 -1.90 -0.02 0.00 -1.81 0.00 0.00 61.98 58.51 2vlj s VAL 68 Cb 0.04 -1.96 -0.01 0.00 0.56 0.00 0.00 36.38 35.01 2vlj s VAL 68 CO 0.08 -0.56 0.02 -0.94 -0.31 0.00 0.00 175.10 173.39 2vlj s SER 69 N -3.03 0.19 -0.46 4.85 1.04 -1.25 -5.06 113.70 109.98 2vlj s SER 69 Ca 0.21 -0.45 0.05 0.00 0.48 0.00 0.00 55.95 56.24 2vlj s SER 69 Cb 0.07 0.14 0.19 0.00 0.10 0.00 0.00 66.02 66.52 2vlj s SER 69 CO -0.00 -0.34 0.41 -1.14 0.98 0.00 0.00 173.24 173.15 2vlj n ARG 70 N 1.47 0.61 0.10 4.02 3.00 -1.26 -4.09 116.66 120.52 2vlj n ARG 70 Ca -0.23 -3.43 0.11 0.00 -0.00 0.00 0.00 57.85 54.30 2vlj n ARG 70 Cb 0.55 -1.70 0.00 0.00 0.00 0.00 0.00 32.46 31.31 2vlj n ARG 70 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2vlj h GLU 71 N 5.25 0.00 -4.45 -0.14 5.08 -1.97 0.36 114.58 118.71 2vlj h GLU 71 Ca 0.21 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.24 2vlj h GLU 71 Cb 0.87 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.85 2vlj h GLU 71 CO 0.46 0.01 -0.76 0.15 -1.00 0.00 0.00 179.01 177.87 2vlj s LYS 72 N -3.34 0.50 0.46 2.33 -0.14 -1.26 -4.82 119.74 113.47 2vlj s LYS 72 Ca -0.00 -0.33 0.25 0.00 -1.36 0.00 0.00 55.97 54.53 2vlj s LYS 72 Cb 0.09 -0.45 1.27 0.00 -1.68 0.00 0.00 37.83 37.06 2vlj s LYS 72 CO 0.79 0.12 1.81 -0.22 -0.76 0.00 0.00 175.35 177.09 2vlj h LYS 73 N 5.70 0.23 0.00 1.68 3.64 -1.94 -2.90 116.57 122.98 2vlj h LYS 73 Ca -0.30 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 2vlj h LYS 73 Cb 1.19 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 2vlj h LYS 73 CO 0.48 0.15 -0.70 0.39 -2.27 0.00 0.00 179.45 177.50 2vlj n GLU 74 N -4.44 0.26 -4.22 1.90 4.71 -1.26 -4.89 120.64 112.69 2vlj n GLU 74 Ca 0.23 0.06 -0.17 0.00 -0.01 0.00 0.00 57.16 57.27 2vlj n GLU 74 Cb 0.95 -1.65 -0.14 0.00 -1.01 0.00 0.00 31.44 29.59 2vlj n GLU 74 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2vlj s SER 75 N -4.04 0.76 -0.42 1.62 0.15 -1.10 -1.61 113.70 109.08 2vlj s SER 75 Ca 0.06 -0.13 0.04 0.00 0.70 0.00 0.00 55.95 56.62 2vlj s SER 75 Cb 0.14 -0.08 0.17 0.00 -1.71 0.00 0.00 66.02 64.54 2vlj s SER 75 CO 0.74 0.07 0.37 0.12 1.20 0.00 0.00 173.24 175.74 2vlj s PHE 76 N -0.20 0.67 0.34 3.44 5.36 -0.87 -4.58 117.98 122.15 2vlj s PHE 76 Ca 0.02 -2.00 -0.27 0.00 -0.96 0.00 0.00 56.93 53.72 2vlj s PHE 76 Cb -0.03 -0.75 -0.09 0.00 -0.34 0.00 0.00 43.02 41.81 2vlj s PHE 76 CO -0.00 -0.89 1.09 -1.25 -1.46 0.00 0.00 175.22 172.71 2vlj s PRO 77 N 0.31 4.39 -0.16 10.12 0.05 -1.26 -4.19 135.00 144.25 2vlj s PRO 77 Ca 0.31 1.72 0.01 0.00 0.05 0.00 0.00 61.00 63.08 2vlj s PRO 77 Cb 0.00 -2.89 0.02 0.00 0.05 0.00 0.00 34.50 31.68 2vlj s PRO 77 CO -0.16 0.01 -0.19 -1.17 0.05 0.00 0.00 177.00 175.54 2vlj s LEU 78 N -2.01 2.02 -0.25 -3.56 2.96 -0.50 -3.86 118.68 113.49 2vlj s LEU 78 Ca 0.51 -0.60 -0.10 0.00 -0.22 0.00 0.00 54.13 53.72 2vlj s LEU 78 Cb -0.28 -1.40 -0.05 0.00 0.50 0.00 0.00 46.19 44.96 2vlj s LEU 78 CO 0.36 0.00 0.14 -0.89 -1.32 0.00 0.00 176.35 174.65 2vlj s THR 79 N 1.24 5.09 -0.42 3.68 2.01 -0.61 0.47 115.64 127.09 2vlj s THR 79 Ca 0.03 0.09 -0.18 0.00 0.31 0.00 0.00 61.69 61.94 2vlj s THR 79 Cb -0.13 -3.38 0.02 0.00 0.01 0.00 0.00 72.50 69.02 2vlj s THR 79 CO -0.10 0.33 0.46 -0.69 -0.69 0.00 0.00 174.62 173.93 2vlj s VAL 80 N 1.26 5.06 0.68 3.82 1.01 0.10 -1.63 120.40 130.70 2vlj s VAL 80 Ca 0.07 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2vlj s VAL 80 Cb -0.14 -4.05 0.11 0.00 0.00 0.00 0.00 36.38 32.30 2vlj s VAL 80 CO 0.06 -0.42 0.94 0.42 0.00 0.00 0.00 175.10 176.09 2vlj s THR 81 N 2.22 2.18 -0.85 3.92 -4.23 -0.97 -1.14 115.64 116.77 2vlj s THR 81 Ca 0.14 -0.68 -0.26 0.00 -1.18 0.00 0.00 61.69 59.71 2vlj s THR 81 Cb -0.17 -2.50 -0.14 0.00 1.34 0.00 0.00 72.50 71.03 2vlj s THR 81 CO 0.14 0.00 2.32 -0.94 -0.54 0.00 0.00 174.62 175.60 2vlj s SER 82 N -4.70 3.92 0.00 3.99 1.04 -1.26 -4.75 113.70 111.94 2vlj s SER 82 Ca 0.65 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.88 2vlj s SER 82 Cb -0.06 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.50 2vlj s SER 82 CO 0.43 -3.94 0.00 0.00 0.98 0.00 0.00 173.24 170.71 2vlj n ALA 83 N 18.44 0.00 -2.10 5.32 0.00 -1.26 -4.96 120.51 135.95 2vlj n ALA 83 Ca 0.45 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.85 2vlj n ALA 83 Cb 0.44 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.92 2vlj n ALA 83 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2vlj n GLN 84 N 0.00 0.32 -1.62 0.00 -0.06 -1.26 -4.83 117.38 109.92 2vlj n GLN 84 Ca 0.00 -0.55 -0.31 0.00 -2.00 0.00 0.00 57.00 54.14 2vlj n GLN 84 Cb 0.00 -0.17 0.06 0.00 -4.06 0.00 0.00 30.24 26.07 2vlj n GLN 84 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 2vlj n LYS 85 N -1.43 3.02 -2.79 3.69 4.76 -1.26 -4.33 118.16 119.81 2vlj n LYS 85 Ca 0.03 -3.63 -0.11 0.00 -2.87 0.00 0.00 58.31 51.74 2vlj n LYS 85 Cb 0.12 -2.28 0.03 0.00 -1.84 0.00 0.00 35.03 31.06 2vlj n LYS 85 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2vlj n ASN 86 N -0.82 0.84 0.22 4.39 6.94 -1.26 -4.98 115.26 120.58 2vlj n ASN 86 Ca 0.56 -2.79 0.10 0.00 -0.02 0.00 0.00 54.58 52.42 2vlj n ASN 86 Cb 0.74 -0.31 0.39 0.00 -2.36 0.00 0.00 39.78 38.23 2vlj n ASN 86 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 2vlj h PRO 87 N 2.90 0.00 -6.17 -0.53 0.13 -1.97 -3.43 132.00 122.93 2vlj h PRO 87 Ca -0.07 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.48 2vlj h PRO 87 Cb 1.14 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.28 2vlj h PRO 87 CO 0.43 0.22 1.34 2.41 -0.23 0.00 0.00 178.00 182.17 2vlj n THR 88 N -3.30 0.54 -3.76 1.56 -1.04 -1.26 -4.91 114.28 102.10 2vlj n THR 88 Ca 0.01 -0.28 -0.03 0.00 -2.04 0.00 0.00 64.05 61.71 2vlj n THR 88 Cb 0.47 -2.33 -0.01 0.00 -1.82 0.00 0.00 70.33 66.65 2vlj n THR 88 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2vlj s ALA 89 N 6.19 -1.70 -0.20 2.41 0.00 -0.74 -4.98 121.76 122.74 2vlj s ALA 89 Ca 0.96 0.11 -0.20 0.00 0.00 0.00 0.00 51.96 52.83 2vlj s ALA 89 Cb -0.45 0.63 -0.03 0.00 0.00 0.00 0.00 23.12 23.27 2vlj s ALA 89 CO 0.41 -1.05 0.57 0.12 0.00 0.00 0.00 175.76 175.81 2vlj s PHE 90 N -3.03 3.37 -0.13 0.00 5.99 -1.02 -1.07 117.98 122.08 2vlj s PHE 90 Ca 0.14 0.85 -0.01 0.00 0.00 0.00 0.00 56.93 57.90 2vlj s PHE 90 Cb -0.01 -2.73 -0.02 0.00 0.00 0.00 0.00 43.02 40.26 2vlj s PHE 90 CO 0.02 -0.14 -0.09 0.71 -0.00 0.00 0.00 175.22 175.72 2vlj s TYR 91 N 1.77 2.90 -0.07 10.12 1.51 0.11 -0.80 117.35 132.87 2vlj s TYR 91 Ca 0.26 -0.44 0.02 0.00 -1.01 0.00 0.00 57.07 55.91 2vlj s TYR 91 Cb -0.16 -1.87 0.01 0.00 -0.11 0.00 0.00 41.96 39.84 2vlj s TYR 91 CO 0.10 -0.08 -0.14 -0.51 -1.11 0.00 0.00 175.55 173.80 2vlj s LEU 92 N 0.22 1.71 0.09 -1.29 1.43 -0.52 -0.63 118.68 119.69 2vlj s LEU 92 Ca -0.06 -0.35 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 2vlj s LEU 92 Cb -0.15 -0.94 -0.04 0.00 0.03 0.00 0.00 46.19 45.10 2vlj s LEU 92 CO 0.04 0.05 0.16 0.00 0.23 0.00 0.00 176.35 176.83 2vlj s ALA 94 N -1.52 0.41 0.24 0.00 0.00 -0.75 -0.32 121.76 119.83 2vlj s ALA 94 Ca 0.32 -1.15 0.01 0.00 0.00 0.00 0.00 51.96 51.14 2vlj s ALA 94 Cb -0.12 0.80 -0.05 0.00 0.00 0.00 0.00 23.12 23.75 2vlj s ALA 94 CO 0.25 -0.55 0.12 -1.54 0.00 0.00 0.00 175.76 174.05 2vlj s SER 95 N -2.99 0.88 -0.04 0.00 1.04 -0.69 -1.67 113.70 110.23 2vlj s SER 95 Ca 0.19 -1.41 -0.13 0.00 0.48 0.00 0.00 55.95 55.07 2vlj s SER 95 Cb 0.06 0.27 0.02 0.00 0.10 0.00 0.00 66.02 66.47 2vlj s SER 95 CO -0.01 -0.79 0.30 -0.94 0.98 0.00 0.00 173.24 172.78 2vlj s SER 96 N -3.27 -0.20 0.26 7.02 1.04 -0.55 -1.10 113.70 116.89 2vlj s SER 96 Ca 0.38 0.18 -0.09 0.00 0.48 0.00 0.00 55.95 56.90 2vlj s SER 96 Cb 0.07 0.38 0.40 0.00 0.10 0.00 0.00 66.02 66.97 2vlj s SER 96 CO 0.14 -0.37 1.58 0.77 0.98 0.00 0.00 173.24 176.34 2vlj h SER 97 N 4.29 -0.81 -4.30 7.02 4.64 -1.87 -2.81 113.55 119.71 2vlj h SER 97 Ca -0.29 0.26 -0.37 0.00 -0.47 0.00 0.00 61.79 60.92 2vlj h SER 97 Cb 1.18 0.54 -0.25 0.00 -0.31 0.00 0.00 62.40 63.56 2vlj h SER 97 CO 0.38 -0.29 -0.77 0.00 -0.87 0.00 0.00 176.83 175.28 2vlj s ARG 98 N -6.24 0.70 0.18 4.77 1.70 -1.26 -1.98 118.95 116.82 2vlj s ARG 98 Ca -0.15 -0.57 -0.29 0.00 -0.47 0.00 0.00 55.73 54.25 2vlj s ARG 98 Cb 0.25 -0.64 -0.17 0.00 -0.57 0.00 0.00 34.95 33.81 2vlj s ARG 98 CO 0.77 0.16 0.59 -1.13 -1.08 0.00 0.00 175.30 174.60 2vlj n SER 99 N 2.16 -1.08 0.00 -2.89 3.41 -1.26 -2.24 113.62 111.72 2vlj n SER 99 Ca -0.17 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.57 2vlj n SER 99 Cb 0.56 -0.95 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 2vlj n SER 99 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2vlj n SER 100 N 1.94 0.00 -4.72 4.04 7.64 -1.26 -5.05 113.62 116.21 2vlj n SER 100 Ca 0.18 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.88 2vlj n SER 100 Cb 0.23 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.50 2vlj n SER 100 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vlj n TYR 101 N -2.00 -2.37 -1.69 1.43 9.36 -0.95 -5.03 117.16 115.91 2vlj n TYR 101 Ca 0.00 -1.95 -0.43 0.00 3.32 0.00 0.00 57.90 58.84 2vlj n TYR 101 Cb 0.00 -0.52 -0.01 0.00 -0.63 0.00 0.00 39.34 38.18 2vlj n TYR 101 CO 0.00 0.00 0.00 -0.85 0.22 0.00 0.00 176.86 176.23 2vlj n GLU 102 N -2.20 2.12 -4.42 2.98 0.28 -1.26 -4.89 120.64 113.24 2vlj n GLU 102 Ca 0.15 0.75 -0.34 0.00 -0.16 0.00 0.00 57.16 57.56 2vlj n GLU 102 Cb 0.56 -2.35 -0.10 0.00 1.43 0.00 0.00 31.44 30.98 2vlj n GLU 102 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2vlj s GLN 103 N -1.44 2.89 -0.21 3.44 -0.21 -1.26 -4.42 119.66 118.46 2vlj s GLN 103 Ca 0.59 -0.48 -0.06 0.00 0.02 0.00 0.00 55.36 55.44 2vlj s GLN 103 Cb -0.59 -2.72 -0.03 0.00 1.00 0.00 0.00 33.01 30.68 2vlj s GLN 103 CO 0.58 0.68 0.02 0.71 -2.12 0.00 0.00 175.29 175.16 2vlj s TYR 104 N -0.90 3.07 0.31 0.91 2.02 -0.26 -4.93 117.35 117.57 2vlj s TYR 104 Ca 0.14 -0.40 -0.09 0.00 -0.37 0.00 0.00 57.07 56.35 2vlj s TYR 104 Cb -0.11 -2.11 -0.07 0.00 -0.40 0.00 0.00 41.96 39.27 2vlj s TYR 104 CO 0.03 -0.22 0.64 -0.06 -1.57 0.00 0.00 175.55 174.37 2vlj s PHE 105 N 1.05 3.45 0.87 2.71 0.40 -1.26 -1.71 117.98 123.49 2vlj s PHE 105 Ca 0.03 0.89 -0.11 0.00 -0.60 0.00 0.00 56.93 57.14 2vlj s PHE 105 Cb -0.14 -2.30 0.17 0.00 0.51 0.00 0.00 43.02 41.26 2vlj s PHE 105 CO 0.02 0.11 1.20 0.20 0.70 0.00 0.00 175.22 177.45 2vlj s GLY 106 N -2.83 1.77 0.22 4.36 0.00 0.57 -4.84 107.32 106.58 2vlj s GLY 106 Ca 0.48 -1.38 0.22 0.00 0.00 0.00 0.00 44.72 44.04 2vlj s GLY 106 CO 0.26 -0.69 1.66 -1.55 0.00 0.00 0.00 173.10 172.78 2vlj n PRO 107 N -3.43 0.16 0.00 2.90 -0.04 -1.26 -4.82 135.00 128.51 2vlj n PRO 107 Ca 0.15 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 64.03 2vlj n PRO 107 Cb 0.60 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 2vlj n PRO 107 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2vlj n GLY 108 N -0.15 -0.04 3.23 0.55 0.00 -1.26 -5.02 105.19 102.51 2vlj n GLY 108 Ca 0.02 -1.53 -0.32 0.00 0.00 0.00 0.00 46.02 44.19 2vlj n GLY 108 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vlj s THR 109 N -2.77 2.15 -0.48 2.61 2.01 0.20 -4.62 115.64 114.75 2vlj s THR 109 Ca 0.00 -0.99 -0.19 0.00 0.31 0.00 0.00 61.69 60.82 2vlj s THR 109 Cb 0.00 -1.82 0.04 0.00 0.01 0.00 0.00 72.50 70.73 2vlj s THR 109 CO 0.00 0.56 0.61 -0.13 -0.69 0.00 0.00 174.62 174.96 2vlj s ARG 110 N 0.34 3.16 -0.22 4.92 0.52 -0.62 0.05 118.95 127.09 2vlj s ARG 110 Ca -0.18 -0.73 -0.06 0.00 -0.52 0.00 0.00 55.73 54.24 2vlj s ARG 110 Cb -0.18 -4.04 -0.02 0.00 0.52 0.00 0.00 34.95 31.23 2vlj s ARG 110 CO 0.09 -1.12 0.02 -1.17 0.02 0.00 0.00 175.30 173.14 2vlj s LEU 111 N 2.62 3.24 -0.09 2.53 2.96 -0.24 -1.49 118.68 128.21 2vlj s LEU 111 Ca 0.17 -0.25 0.00 0.00 -0.22 0.00 0.00 54.13 53.83 2vlj s LEU 111 Cb -0.17 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.65 2vlj s LEU 111 CO 0.14 0.00 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.20 2vlj s THR 112 N 1.36 3.50 -0.19 3.68 2.01 -0.87 -1.79 115.64 123.34 2vlj s THR 112 Ca 0.05 -0.54 0.01 0.00 0.31 0.00 0.00 61.69 61.52 2vlj s THR 112 Cb -0.15 -2.45 0.02 0.00 0.01 0.00 0.00 72.50 69.94 2vlj s THR 112 CO 0.01 0.57 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.64 2vlj s VAL 113 N -0.39 2.16 0.28 3.82 1.01 -1.26 -1.30 120.40 124.72 2vlj s VAL 113 Ca 0.05 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.04 2vlj s VAL 113 Cb -0.12 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 2vlj s VAL 113 CO 0.02 0.46 0.47 0.28 0.00 0.00 0.00 175.10 176.33 2vlj s THR 114 N 1.28 5.16 -0.48 3.92 -1.32 0.63 -4.82 115.64 120.01 2vlj s THR 114 Ca 0.03 -0.50 0.24 0.00 -1.21 0.00 0.00 61.69 60.25 2vlj s THR 114 Cb -0.14 -3.82 0.18 0.00 -1.51 0.00 0.00 72.50 67.21 2vlj s THR 114 CO -0.11 -0.39 1.42 -0.33 -2.21 0.00 0.00 174.62 173.00 2vlj h GLU 115 N 1.26 0.00 -1.75 7.08 4.39 -1.97 -1.41 114.58 122.18 2vlj h GLU 115 Ca -0.50 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.24 2vlj h GLU 115 Cb 1.21 0.00 -0.24 0.00 -0.10 0.00 0.00 28.75 29.62 2vlj h GLU 115 CO 0.64 0.00 0.31 0.34 -1.16 0.00 0.00 179.01 179.13 2vlj s ASP 116 N -5.28 -0.59 0.31 1.42 3.68 -1.26 -4.80 116.67 110.15 2vlj s ASP 116 Ca 0.05 1.10 0.22 0.00 2.13 0.00 0.00 52.55 56.05 2vlj s ASP 116 Cb 0.09 1.14 1.13 0.00 -1.45 0.00 0.00 42.92 43.84 2vlj s ASP 116 CO 0.70 -0.19 1.66 0.18 0.13 0.00 0.00 175.17 177.66 2vlj n LEU 117 N 2.72 0.58 0.01 -1.34 4.77 -1.26 -1.71 117.00 120.77 2vlj n LEU 117 Ca -0.14 0.75 0.06 0.00 -0.03 0.00 0.00 56.01 56.64 2vlj n LEU 117 Cb 0.56 -0.79 0.27 0.00 -2.33 0.00 0.00 43.42 41.13 2vlj n LEU 117 CO 0.02 -0.89 0.70 0.29 -1.33 0.00 0.00 177.39 176.18 2vlj n LYS 118 N -2.25 0.01 0.00 3.23 4.76 -1.26 -2.70 118.16 119.95 2vlj n LYS 118 Ca -0.01 0.31 0.14 0.00 -2.87 0.00 0.00 58.31 55.88 2vlj n LYS 118 Cb 0.07 -1.53 0.57 0.00 -1.84 0.00 0.00 35.03 32.30 2vlj n LYS 118 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2vlj n ASN 119 N -1.56 0.50 -4.65 4.39 3.02 -0.70 -4.84 115.26 111.43 2vlj n ASN 119 Ca 0.03 -0.53 -0.42 0.00 -0.03 0.00 0.00 54.58 53.63 2vlj n ASN 119 Cb 0.14 -0.06 -0.04 0.00 -0.61 0.00 0.00 39.78 39.21 2vlj n ASN 119 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2vlj s VAL 120 N -2.53 4.83 -0.01 2.41 1.01 -1.10 -4.62 120.40 120.39 2vlj s VAL 120 Ca 0.27 1.62 0.05 0.00 0.00 0.00 0.00 61.98 63.92 2vlj s VAL 120 Cb 0.20 -4.14 -0.01 0.00 0.00 0.00 0.00 36.38 32.43 2vlj s VAL 120 CO 0.49 -0.06 -0.16 -0.36 0.00 0.00 0.00 175.10 175.01 2vlj s PHE 121 N 2.72 1.44 0.83 5.22 0.08 -1.05 -4.77 117.98 122.45 2vlj s PHE 121 Ca 0.36 -0.28 -0.11 0.00 0.12 0.00 0.00 56.93 57.02 2vlj s PHE 121 Cb -0.16 -0.93 0.09 0.00 -0.57 0.00 0.00 43.02 41.46 2vlj s PHE 121 CO 0.08 -0.02 1.10 -1.25 -0.10 0.00 0.00 175.22 175.03 2vlj s PRO 122 N -0.42 1.83 0.58 0.24 0.04 -1.26 -1.77 135.00 134.24 2vlj s PRO 122 Ca 0.06 0.70 -0.17 0.00 0.04 0.00 0.00 61.00 61.63 2vlj s PRO 122 Cb -0.06 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 2vlj s PRO 122 CO -0.00 -1.81 1.09 -1.25 0.04 0.00 0.00 177.00 175.06 2vlj s PRO 123 N -5.09 3.25 -0.07 0.56 0.04 -1.26 -4.21 135.00 128.23 2vlj s PRO 123 Ca 0.62 1.38 -0.08 0.00 0.04 0.00 0.00 61.00 62.95 2vlj s PRO 123 Cb -0.15 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 2vlj s PRO 123 CO 0.55 -0.89 0.22 -1.21 0.04 0.00 0.00 177.00 175.72 2vlj s GLU 124 N -3.76 3.57 -0.07 4.56 2.02 0.08 -4.89 118.70 120.20 2vlj s GLU 124 Ca 0.67 -0.01 0.03 0.00 0.02 0.00 0.00 54.97 55.68 2vlj s GLU 124 Cb -0.19 -3.17 0.01 0.00 0.10 0.00 0.00 34.13 30.87 2vlj s GLU 124 CO 0.33 0.73 -0.15 0.08 0.02 0.00 0.00 175.26 176.28 2vlj s VAL 125 N -1.10 1.31 0.05 2.63 1.01 -1.26 -0.45 120.40 122.60 2vlj s VAL 125 Ca 0.20 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.60 2vlj s VAL 125 Cb -0.13 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.04 2vlj s VAL 125 CO 0.09 0.39 -0.06 0.00 0.00 0.00 0.00 175.10 175.53 2vlj s ALA 126 N 0.59 0.58 -0.07 5.51 0.00 -0.93 -4.38 121.76 123.06 2vlj s ALA 126 Ca -0.15 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 50.88 2vlj s ALA 126 Cb -0.16 0.14 -0.00 0.00 0.00 0.00 0.00 23.12 23.10 2vlj s ALA 126 CO 0.05 -0.17 -0.20 0.08 0.00 0.00 0.00 175.76 175.52 2vlj s VAL 127 N -2.48 1.67 -0.16 0.00 1.01 -1.26 -2.46 120.40 116.72 2vlj s VAL 127 Ca -0.02 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.12 2vlj s VAL 127 Cb -0.03 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.89 2vlj s VAL 127 CO -0.03 0.47 -0.09 -0.36 0.00 0.00 0.00 175.10 175.09 2vlj s PHE 128 N 0.21 2.89 0.33 5.22 0.40 -0.31 -5.00 117.98 121.72 2vlj s PHE 128 Ca -0.10 -0.66 -0.26 0.00 -0.60 0.00 0.00 56.93 55.32 2vlj s PHE 128 Cb -0.15 -1.93 -0.10 0.00 0.51 0.00 0.00 43.02 41.36 2vlj s PHE 128 CO 0.05 -0.26 0.95 -1.21 0.70 0.00 0.00 175.22 175.45 2vlj s GLU 129 N 0.62 4.54 0.29 0.44 2.02 -1.26 -2.72 118.70 122.63 2vlj s GLU 129 Ca -0.05 1.32 -0.30 0.00 0.02 0.00 0.00 54.97 55.96 2vlj s GLU 129 Cb -0.15 -2.75 -0.12 0.00 0.10 0.00 0.00 34.13 31.21 2vlj s GLU 129 CO 0.03 0.24 1.44 -2.30 0.02 0.00 0.00 175.26 174.69 2vlj n PRO 130 N 0.45 2.31 -1.97 0.39 -0.02 -1.24 -4.91 135.00 130.01 2vlj n PRO 130 Ca 0.02 0.82 -0.42 0.00 -2.02 0.00 0.00 63.50 61.90 2vlj n PRO 130 Cb 0.50 -2.50 -0.03 0.00 -0.02 0.00 0.00 33.50 31.45 2vlj n PRO 130 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2vlj s SER 131 N 0.18 6.61 0.29 2.55 1.04 -1.26 -4.90 113.70 118.21 2vlj s SER 131 Ca 0.63 2.62 0.03 0.00 0.48 0.00 0.00 55.95 59.71 2vlj s SER 131 Cb -0.57 -2.60 0.62 0.00 0.10 0.00 0.00 66.02 63.57 2vlj s SER 131 CO 0.53 -0.78 1.81 1.05 0.98 0.00 0.00 173.24 176.84 2vlj h GLU 132 N 6.20 0.87 -0.89 4.02 9.09 -2.00 -1.93 114.58 129.94 2vlj h GLU 132 Ca -0.44 -0.05 0.24 0.00 0.05 0.00 0.00 59.36 59.16 2vlj h GLU 132 Cb 1.21 -0.20 -0.14 0.00 -1.65 0.00 0.00 28.75 27.97 2vlj h GLU 132 CO 0.87 0.57 0.26 0.00 0.05 0.00 0.00 179.01 180.76 2vlj h ALA 133 N 1.58 1.32 -0.23 1.06 0.00 -2.01 0.73 119.26 121.72 2vlj h ALA 133 Ca 0.53 0.22 -0.11 0.00 0.00 0.00 0.00 54.91 55.55 2vlj h ALA 133 Cb 0.65 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2vlj h ALA 133 CO -0.31 -0.47 -0.32 1.49 0.00 0.00 0.00 179.25 179.63 2vlj h GLU 134 N 0.22 0.48 -0.45 0.00 4.81 -1.69 -3.05 114.58 114.90 2vlj h GLU 134 Ca 0.56 -0.21 -0.07 0.00 -0.13 0.00 0.00 59.36 59.52 2vlj h GLU 134 Cb 1.15 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 2vlj h GLU 134 CO -0.65 0.75 0.02 0.82 -0.73 0.00 0.00 179.01 179.21 2vlj h ILE 135 N 0.41 1.26 0.00 2.32 2.04 -0.75 -1.01 117.51 121.78 2vlj h ILE 135 Ca 0.05 -1.02 -0.18 0.00 1.00 0.00 0.00 64.86 64.71 2vlj h ILE 135 Cb 0.77 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 2vlj h ILE 135 CO 0.06 0.35 -1.08 0.77 0.00 0.00 0.00 178.15 178.25 2vlj h SER 136 N 0.64 0.00 0.27 1.72 4.64 -1.55 0.14 113.55 119.40 2vlj h SER 136 Ca 0.13 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.12 2vlj h SER 136 Cb 0.47 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.60 2vlj h SER 136 CO 0.02 0.76 -1.43 -0.74 -0.87 0.00 0.00 176.83 174.56 2vlj h HIS 137 N 0.00 0.97 0.00 4.77 -0.00 -1.51 -3.41 115.15 115.97 2vlj h HIS 137 Ca -0.09 -0.69 0.00 0.00 -0.00 0.00 0.00 60.37 59.59 2vlj h HIS 137 Cb 1.66 -0.05 0.00 0.00 -0.00 0.00 0.00 27.41 29.02 2vlj h HIS 137 CO 0.00 1.53 -0.11 0.25 -0.00 0.00 0.00 177.93 179.60 2vlj n THR 138 N -3.72 0.00 -0.57 6.26 -2.24 -0.39 -5.00 114.28 108.63 2vlj n THR 138 Ca -0.16 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2vlj n THR 138 Cb 1.08 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 70.30 2vlj n THR 138 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2vlj n GLN 139 N -1.06 0.00 -3.47 -0.78 1.13 0.48 -4.94 117.38 108.75 2vlj n GLN 139 Ca 0.00 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.85 2vlj n GLN 139 Cb 0.03 -4.02 0.00 0.00 0.11 0.00 0.00 30.24 26.36 2vlj n GLN 139 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2vlj s LYS 140 N -0.73 2.43 -0.29 -1.09 1.02 -1.26 -0.55 119.74 119.27 2vlj s LYS 140 Ca 0.00 -1.67 0.03 0.00 0.02 0.00 0.00 55.97 54.35 2vlj s LYS 140 Cb 0.00 -2.40 0.19 0.00 -0.52 0.00 0.00 37.83 35.09 2vlj s LYS 140 CO 0.00 -0.48 0.56 0.00 -0.92 0.00 0.00 175.35 174.51 2vlj s ALA 141 N -2.59 -2.13 -0.08 5.17 0.00 0.45 -3.82 121.76 118.77 2vlj s ALA 141 Ca 0.48 1.21 -0.26 0.00 0.00 0.00 0.00 51.96 53.39 2vlj s ALA 141 Cb -0.04 -2.31 -0.03 0.00 0.00 0.00 0.00 23.12 20.74 2vlj s ALA 141 CO 0.29 -1.62 0.84 0.99 0.00 0.00 0.00 175.76 176.26 2vlj s THR 142 N 2.79 4.93 -0.00 0.00 2.01 -1.26 -2.21 115.64 121.89 2vlj s THR 142 Ca 0.14 1.71 -0.05 0.00 0.31 0.00 0.00 61.69 63.80 2vlj s THR 142 Cb -0.12 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.18 2vlj s THR 142 CO -0.24 0.15 0.23 -0.76 -0.69 0.00 0.00 174.62 173.30 2vlj s LEU 143 N 1.32 4.37 -0.06 4.42 1.02 0.60 -3.66 118.68 126.68 2vlj s LEU 143 Ca 0.42 0.47 0.05 0.00 0.02 0.00 0.00 54.13 55.10 2vlj s LEU 143 Cb -0.18 -2.63 -0.01 0.00 0.02 0.00 0.00 46.19 43.38 2vlj s LEU 143 CO 0.19 0.26 -0.23 -0.69 0.02 0.00 0.00 176.35 175.90 2vlj s VAL 144 N -1.30 2.23 -0.20 -1.59 1.01 -1.10 -1.22 120.40 118.21 2vlj s VAL 144 Ca 0.27 -1.00 -0.05 0.00 0.00 0.00 0.00 61.98 61.20 2vlj s VAL 144 Cb -0.13 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 2vlj s VAL 144 CO 0.17 0.57 -0.00 0.00 0.00 0.00 0.00 175.10 175.83 2vlj s LEU 146 N 1.08 3.09 -0.26 0.00 1.43 -1.03 -1.28 118.68 121.71 2vlj s LEU 146 Ca 0.02 -0.49 -0.07 0.00 -1.03 0.00 0.00 54.13 52.56 2vlj s LEU 146 Cb -0.14 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 2vlj s LEU 146 CO 0.01 -0.06 0.07 0.00 0.23 0.00 0.00 176.35 176.60 2vlj s ALA 147 N 1.47 3.12 0.10 4.21 0.00 0.18 -2.18 121.76 128.66 2vlj s ALA 147 Ca 0.05 -1.23 0.07 0.00 0.00 0.00 0.00 51.96 50.86 2vlj s ALA 147 Cb -0.15 -2.09 -0.03 0.00 0.00 0.00 0.00 23.12 20.85 2vlj s ALA 147 CO -0.02 -0.61 -0.19 0.95 0.00 0.00 0.00 175.76 175.89 2vlj s THR 148 N 1.58 1.56 0.00 0.00 -4.23 0.41 -0.54 115.64 114.41 2vlj s THR 148 Ca 0.05 -1.51 0.00 0.00 -1.18 0.00 0.00 61.69 59.06 2vlj s THR 148 Cb -0.16 -1.45 0.00 0.00 1.34 0.00 0.00 72.50 72.24 2vlj s THR 148 CO 0.03 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 2vlj n GLY 149 N 1.08 0.48 3.88 3.99 0.00 0.77 -0.74 105.19 114.64 2vlj n GLY 149 Ca -0.20 -0.93 -0.34 0.00 0.00 0.00 0.00 46.02 44.55 2vlj n GLY 149 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2vlj s PHE 150 N -2.00 3.52 -0.10 1.61 -0.71 -1.07 -4.60 117.98 114.63 2vlj s PHE 150 Ca 0.00 0.38 -0.06 0.00 -1.04 0.00 0.00 56.93 56.21 2vlj s PHE 150 Cb 0.00 -1.84 0.04 0.00 -1.21 0.00 0.00 43.02 40.01 2vlj s PHE 150 CO 0.00 0.65 0.25 -0.47 -1.34 0.00 0.00 175.22 174.31 2vlj s TYR 151 N -1.23 -0.32 0.87 3.49 6.14 -0.73 -0.19 117.35 125.37 2vlj s TYR 151 Ca 0.24 0.76 -0.13 0.00 0.64 0.00 0.00 57.07 58.58 2vlj s TYR 151 Cb -0.12 0.06 0.12 0.00 0.42 0.00 0.00 41.96 42.44 2vlj s TYR 151 CO 0.14 -0.21 1.21 -1.25 0.64 0.00 0.00 175.55 176.08 2vlj s PRO 152 N 1.01 1.46 -0.16 4.97 0.04 -1.26 -2.53 135.00 138.52 2vlj s PRO 152 Ca -0.07 0.01 -0.04 0.00 0.04 0.00 0.00 61.00 60.94 2vlj s PRO 152 Cb -0.08 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.43 2vlj s PRO 152 CO -0.07 -1.93 2.16 -3.47 0.04 0.00 0.00 177.00 173.73 2vlj n ASP 153 N -3.52 3.16 -3.99 6.66 4.64 -1.26 -4.68 116.55 117.56 2vlj n ASP 153 Ca 0.10 -2.08 -0.32 0.00 -1.38 0.00 0.00 54.79 51.11 2vlj n ASP 153 Cb 0.60 -0.82 -0.11 0.00 -1.04 0.00 0.00 41.12 39.76 2vlj n ASP 153 CO 0.00 0.00 0.00 -1.00 -0.82 0.00 0.00 177.20 175.38 2vlj s HIS 154 N 2.21 3.52 0.05 -0.67 3.76 -1.26 -5.08 115.29 117.82 2vlj s HIS 154 Ca 0.36 -3.14 -0.02 0.00 -0.15 0.00 0.00 55.06 52.12 2vlj s HIS 154 Cb 0.16 -2.93 -0.04 0.00 1.11 0.00 0.00 32.58 30.88 2vlj s HIS 154 CO -0.01 -0.68 -0.01 0.14 -0.85 0.00 0.00 174.74 173.33 2vlj s VAL 155 N -0.94 0.21 -0.06 -0.90 -7.23 -1.26 -1.50 120.40 108.71 2vlj s VAL 155 Ca 0.22 -1.69 -0.00 0.00 -1.81 0.00 0.00 61.98 58.70 2vlj s VAL 155 Cb -0.13 -1.41 0.03 0.00 0.56 0.00 0.00 36.38 35.43 2vlj s VAL 155 CO -0.10 -0.93 -0.02 -1.61 -0.31 0.00 0.00 175.10 172.13 2vlj s GLU 156 N -3.73 0.73 -0.08 4.82 2.02 -0.28 -4.99 118.70 117.19 2vlj s GLU 156 Ca 0.05 0.01 -0.01 0.00 0.02 0.00 0.00 54.97 55.05 2vlj s GLU 156 Cb 0.06 -0.95 -0.03 0.00 0.10 0.00 0.00 34.13 33.31 2vlj s GLU 156 CO -0.09 -0.22 -0.04 -1.17 0.02 0.00 0.00 175.26 173.75 2vlj s LEU 157 N 1.57 3.33 0.04 1.80 0.20 -1.26 -0.43 118.68 123.93 2vlj s LEU 157 Ca -0.01 0.03 -0.05 0.00 0.69 0.00 0.00 54.13 54.79 2vlj s LEU 157 Cb -0.13 -1.74 -0.01 0.00 -0.43 0.00 0.00 46.19 43.87 2vlj s LEU 157 CO -0.04 0.35 0.09 -0.94 -0.29 0.00 0.00 176.35 175.52 2vlj s SER 158 N -0.73 0.19 0.05 3.68 1.04 0.33 -5.00 113.70 113.26 2vlj s SER 158 Ca 0.11 -0.54 0.05 0.00 0.48 0.00 0.00 55.95 56.05 2vlj s SER 158 Cb -0.11 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 66.19 2vlj s SER 158 CO 0.02 -0.50 -0.06 0.26 0.98 0.00 0.00 173.24 173.93 2vlj s TRP 159 N -2.61 2.87 -0.01 5.02 0.52 -1.26 -0.80 118.94 122.67 2vlj s TRP 159 Ca -0.05 -0.07 0.00 0.00 0.02 0.00 0.00 56.10 56.00 2vlj s TRP 159 Cb -0.01 -1.54 0.02 0.00 -1.15 0.00 0.00 33.47 30.78 2vlj s TRP 159 CO -0.05 0.41 0.01 -1.58 0.02 0.00 0.00 176.95 175.76 2vlj s TRP 160 N -1.13 0.13 -0.07 -1.98 0.52 -0.67 -1.98 118.94 113.75 2vlj s TRP 160 Ca 0.20 0.04 -0.01 0.00 0.02 0.00 0.00 56.10 56.35 2vlj s TRP 160 Cb -0.11 -0.21 0.03 0.00 -1.15 0.00 0.00 33.47 32.02 2vlj s TRP 160 CO 0.12 -0.07 -0.01 0.08 0.02 0.00 0.00 176.95 177.09 2vlj s VAL 161 N 0.64 0.43 -1.32 4.03 1.01 -0.62 -1.61 120.40 122.97 2vlj s VAL 161 Ca -0.06 0.08 -0.10 0.00 0.00 0.00 0.00 61.98 61.90 2vlj s VAL 161 Cb -0.08 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.73 2vlj s VAL 161 CO -0.02 0.27 0.52 0.59 0.00 0.00 0.00 175.10 176.46 2vlj n ASN 162 N 5.06 -2.05 -1.09 3.32 3.02 -1.06 -2.81 115.26 119.65 2vlj n ASN 162 Ca -0.09 -1.06 -0.13 0.00 -0.03 0.00 0.00 54.58 53.27 2vlj n ASN 162 Cb 0.50 -2.90 -0.04 0.00 -0.61 0.00 0.00 39.78 36.73 2vlj n ASN 162 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vlj n GLY 163 N -1.95 1.02 2.90 7.41 0.00 -1.26 -5.01 105.19 108.29 2vlj n GLY 163 Ca -0.23 -0.41 -0.13 0.00 0.00 0.00 0.00 46.02 45.25 2vlj n GLY 163 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vlj s LYS 164 N -3.44 0.06 0.21 1.61 2.36 -1.12 -5.13 119.74 114.29 2vlj s LYS 164 Ca 0.00 0.20 -0.30 0.00 -2.55 0.00 0.00 55.97 53.32 2vlj s LYS 164 Cb 0.00 -0.09 -0.08 0.00 -1.05 0.00 0.00 37.83 36.61 2vlj s LYS 164 CO 0.00 -0.09 1.15 -2.00 1.55 0.00 0.00 175.35 175.95 2vlj s GLU 165 N 0.60 4.56 0.02 4.03 2.12 -1.26 -1.58 118.70 127.18 2vlj s GLU 165 Ca -0.05 1.82 0.06 0.00 0.36 0.00 0.00 54.97 57.17 2vlj s GLU 165 Cb -0.07 -3.23 -0.03 0.00 0.26 0.00 0.00 34.13 31.06 2vlj s GLU 165 CO -0.02 0.04 -0.17 0.14 -0.54 0.00 0.00 175.26 174.71 2vlj s VAL 166 N -0.46 2.85 -0.01 3.70 -7.23 -0.84 -4.94 120.40 113.47 2vlj s VAL 166 Ca 0.49 -1.07 0.01 0.00 -1.81 0.00 0.00 61.98 59.60 2vlj s VAL 166 Cb -0.32 -2.17 -0.01 0.00 0.56 0.00 0.00 36.38 34.43 2vlj s VAL 166 CO 0.38 0.40 0.01 1.41 -0.31 0.00 0.00 175.10 176.99 2vlj n HIS 167 N 1.75 0.00 -2.32 2.82 8.25 -1.26 -4.47 115.22 119.99 2vlj n HIS 167 Ca -0.16 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.88 2vlj n HIS 167 Cb 0.52 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.55 2vlj n HIS 167 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2vlj s SER 168 N -3.06 6.99 0.00 0.41 0.15 -1.26 -3.27 113.70 113.66 2vlj s SER 168 Ca -0.01 2.23 0.00 0.00 0.70 0.00 0.00 55.95 58.87 2vlj s SER 168 Cb 0.00 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 2vlj s SER 168 CO 0.04 -0.48 0.00 0.61 1.20 0.00 0.00 173.24 174.61 2vlj n GLY 169 N 2.76 0.44 3.57 9.45 0.00 -1.26 -4.84 105.19 115.30 2vlj n GLY 169 Ca 0.07 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 45.09 2vlj n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vlj s VAL 170 N -2.00 3.76 -0.10 1.61 1.01 -1.20 -1.11 120.40 122.36 2vlj s VAL 170 Ca 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 2vlj s VAL 170 Cb 0.00 -2.56 0.05 0.00 0.00 0.00 0.00 36.38 33.87 2vlj s VAL 170 CO 0.00 0.58 0.13 -0.55 0.00 0.00 0.00 175.10 175.26 2vlj s SER 171 N -0.60 1.17 -0.07 3.32 0.15 -0.61 -4.99 113.70 112.08 2vlj s SER 171 Ca 0.09 0.06 -0.01 0.00 0.70 0.00 0.00 55.95 56.79 2vlj s SER 171 Cb -0.12 0.10 -0.03 0.00 -1.71 0.00 0.00 66.02 64.25 2vlj s SER 171 CO 0.02 -0.27 0.01 -0.89 1.20 0.00 0.00 173.24 173.30 2vlj s THR 172 N 2.24 4.32 -0.02 6.45 2.01 -1.26 -1.03 115.64 128.34 2vlj s THR 172 Ca 0.04 -0.30 -0.37 0.00 0.31 0.00 0.00 61.69 61.38 2vlj s THR 172 Cb -0.13 -2.84 -0.15 0.00 0.01 0.00 0.00 72.50 69.39 2vlj s THR 172 CO -0.06 0.57 1.58 0.47 -0.69 0.00 0.00 174.62 176.49 2vlj n ASP 173 N 2.00 2.44 -0.18 3.53 8.00 -0.79 -4.92 116.55 126.63 2vlj n ASP 173 Ca -0.18 1.08 -0.04 0.00 0.71 0.00 0.00 54.79 56.36 2vlj n ASP 173 Cb 0.53 -1.26 0.06 0.00 -0.02 0.00 0.00 41.12 40.44 2vlj n ASP 173 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2vlj h PRO 174 N 6.30 0.56 -6.29 -0.24 0.13 -1.98 -3.44 132.00 127.04 2vlj h PRO 174 Ca -0.47 -0.03 -0.61 0.00 -0.87 0.00 0.00 66.00 64.02 2vlj h PRO 174 Cb 1.30 -0.13 -0.16 0.00 0.13 0.00 0.00 31.00 32.15 2vlj h PRO 174 CO 0.88 0.37 -0.79 -0.65 -0.23 0.00 0.00 178.00 177.58 2vlj s GLN 175 N -6.13 1.54 0.72 0.86 1.11 -1.26 -5.16 119.66 111.34 2vlj s GLN 175 Ca -0.13 -1.62 -0.09 0.00 0.01 0.00 0.00 55.36 53.53 2vlj s GLN 175 Cb 0.14 -1.70 0.05 0.00 -1.01 0.00 0.00 33.01 30.49 2vlj s GLN 175 CO 0.74 0.34 1.06 -1.25 0.01 0.00 0.00 175.29 176.20 2vlj s PRO 176 N -3.11 2.43 -0.05 2.91 0.04 -1.26 -4.95 135.00 131.00 2vlj s PRO 176 Ca 0.24 0.08 -0.07 0.00 0.04 0.00 0.00 61.00 61.29 2vlj s PRO 176 Cb -0.06 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 2vlj s PRO 176 CO 0.11 -1.20 0.22 -0.51 0.04 0.00 0.00 177.00 175.67 2vlj s LEU 177 N -5.33 4.39 -0.32 -3.56 1.43 -0.86 -4.96 118.68 109.46 2vlj s LEU 177 Ca 0.59 0.55 -0.29 0.00 -1.03 0.00 0.00 54.13 53.95 2vlj s LEU 177 Cb -0.11 -2.41 0.02 0.00 0.03 0.00 0.00 46.19 43.72 2vlj s LEU 177 CO 0.48 0.33 1.06 -0.54 0.23 0.00 0.00 176.35 177.91 2vlj s LYS 178 N -1.40 4.05 0.61 1.70 1.02 -1.26 -1.64 119.74 122.82 2vlj s LYS 178 Ca 0.22 1.03 0.39 0.00 0.02 0.00 0.00 55.97 57.63 2vlj s LYS 178 Cb -0.13 -3.74 1.90 0.00 -0.52 0.00 0.00 37.83 35.34 2vlj s LYS 178 CO 0.11 -0.90 2.18 0.93 -0.92 0.00 0.00 175.35 176.75 2vlj h GLU 179 N 8.12 0.00 -1.04 1.68 5.08 -1.31 -3.36 114.58 123.75 2vlj h GLU 179 Ca -0.21 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.07 2vlj h GLU 179 Cb 1.06 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.12 2vlj h GLU 179 CO 1.03 0.01 -0.47 1.14 -1.00 0.00 0.00 179.01 179.72 2vlj s GLN 180 N -3.95 0.85 0.34 2.33 -2.07 -1.26 -5.02 119.66 110.88 2vlj s GLN 180 Ca -0.02 -0.39 0.29 0.00 -1.82 0.00 0.00 55.36 53.41 2vlj s GLN 180 Cb 0.11 0.04 1.12 0.00 -1.09 0.00 0.00 33.01 33.19 2vlj s GLN 180 CO 0.48 -1.21 1.08 -2.30 -1.32 0.00 0.00 175.29 172.03 2vlj n PRO 181 N 4.22 -0.01 0.09 9.60 -0.01 -1.26 -1.54 135.00 146.09 2vlj n PRO 181 Ca 0.12 0.81 0.12 0.00 -0.01 0.00 0.00 63.50 64.55 2vlj n PRO 181 Cb 0.56 -1.73 0.45 0.00 -0.01 0.00 0.00 33.50 32.78 2vlj n PRO 181 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 2vlj n ALA 182 N -2.59 2.06 -2.71 3.55 0.00 -1.26 -4.76 120.51 114.79 2vlj n ALA 182 Ca 0.29 -0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.35 2vlj n ALA 182 Cb 1.24 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 19.20 2vlj n ALA 182 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2vlj s LEU 183 N -4.21 4.25 0.42 0.00 1.98 -0.59 -4.99 118.68 115.54 2vlj s LEU 183 Ca 0.09 0.78 0.10 0.00 -2.89 0.00 0.00 54.13 52.21 2vlj s LEU 183 Cb 0.12 -2.69 0.94 0.00 0.66 0.00 0.00 46.19 45.22 2vlj s LEU 183 CO 0.50 -0.03 2.03 -1.13 -1.89 0.00 0.00 176.35 175.84 2vlj h ASN 184 N 6.85 0.41 -1.47 3.68 -1.24 -1.86 -3.05 115.58 118.90 2vlj h ASN 184 Ca -0.40 -0.00 -0.53 0.00 0.71 0.00 0.00 56.30 56.08 2vlj h ASN 184 Cb 1.17 -0.09 -0.41 0.00 0.73 0.00 0.00 38.32 39.72 2vlj h ASN 184 CO 0.75 0.28 -0.86 0.47 -1.29 0.00 0.00 177.43 176.78 2vlj n ASP 185 N -4.48 3.72 -4.71 1.15 8.00 -1.26 -5.08 116.55 113.89 2vlj n ASP 185 Ca 0.05 -3.43 -0.41 0.00 0.71 0.00 0.00 54.79 51.71 2vlj n ASP 185 Cb 0.18 -0.49 0.01 0.00 -0.02 0.00 0.00 41.12 40.80 2vlj n ASP 185 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2vlj n SER 186 N -0.33 2.72 -4.74 -2.24 2.88 -1.16 -5.02 113.62 105.73 2vlj n SER 186 Ca 0.30 1.13 -0.30 0.00 -1.33 0.00 0.00 58.87 58.67 2vlj n SER 186 Cb 0.68 -1.52 0.13 0.00 -0.75 0.00 0.00 64.21 62.75 2vlj n SER 186 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2vlj s ARG 187 N -2.19 1.40 0.33 -1.46 0.52 -1.26 -4.85 118.95 111.44 2vlj s ARG 187 Ca 0.60 0.75 0.10 0.00 -0.52 0.00 0.00 55.73 56.66 2vlj s ARG 187 Cb -0.51 -1.83 -0.06 0.00 0.52 0.00 0.00 34.95 33.07 2vlj s ARG 187 CO 0.59 -2.13 -0.07 0.71 0.02 0.00 0.00 175.30 174.42 2vlj s TYR 188 N -2.99 2.45 0.17 -0.53 2.02 0.73 -0.82 117.35 118.37 2vlj s TYR 188 Ca 0.63 -0.45 0.07 0.00 -0.37 0.00 0.00 57.07 56.95 2vlj s TYR 188 Cb -0.17 -1.37 -0.04 0.00 -0.40 0.00 0.00 41.96 39.98 2vlj s TYR 188 CO 0.56 0.56 -0.14 -1.12 -1.57 0.00 0.00 175.55 173.85 2vlj s SER 189 N -3.64 2.32 -0.14 2.29 0.01 -0.65 -0.16 113.70 113.73 2vlj s SER 189 Ca 0.33 -0.95 -0.13 0.00 1.31 0.00 0.00 55.95 56.51 2vlj s SER 189 Cb 0.01 -0.10 0.04 0.00 0.21 0.00 0.00 66.02 66.17 2vlj s SER 189 CO 0.17 -0.17 0.38 -0.22 0.41 0.00 0.00 173.24 173.81 2vlj s LEU 190 N -3.01 0.53 0.33 2.44 2.96 0.30 -2.03 118.68 120.19 2vlj s LEU 190 Ca 0.18 0.76 0.10 0.00 -0.22 0.00 0.00 54.13 54.95 2vlj s LEU 190 Cb -0.02 1.29 -0.06 0.00 0.50 0.00 0.00 46.19 47.90 2vlj s LEU 190 CO 0.05 -0.13 -0.11 -0.94 -1.32 0.00 0.00 176.35 173.89 2vlj s SER 191 N 0.28 3.75 0.01 3.68 1.04 -1.26 -0.65 113.70 120.56 2vlj s SER 191 Ca -0.01 -1.13 -0.15 0.00 0.48 0.00 0.00 55.95 55.15 2vlj s SER 191 Cb -0.03 -0.36 0.02 0.00 0.10 0.00 0.00 66.02 65.75 2vlj s SER 191 CO -0.00 -0.14 0.32 -0.55 0.98 0.00 0.00 173.24 173.85 2vlj s SER 192 N -3.60 -0.18 0.02 7.02 0.15 -0.40 -1.88 113.70 114.84 2vlj s SER 192 Ca 0.32 -0.03 0.07 0.00 0.70 0.00 0.00 55.95 57.01 2vlj s SER 192 Cb 0.00 0.34 -0.03 0.00 -1.71 0.00 0.00 66.02 64.62 2vlj s SER 192 CO 0.16 -0.54 -0.19 -0.13 1.20 0.00 0.00 173.24 173.75 2vlj s ARG 193 N -1.93 2.10 -0.15 5.44 3.00 -0.20 -0.80 118.95 126.42 2vlj s ARG 193 Ca -0.09 -0.95 0.00 0.00 0.00 0.00 0.00 55.73 54.69 2vlj s ARG 193 Cb -0.03 -2.18 0.03 0.00 0.00 0.00 0.00 34.95 32.77 2vlj s ARG 193 CO 0.01 0.55 -0.11 -1.17 0.00 0.00 0.00 175.30 174.58 2vlj s LEU 194 N -1.26 1.69 -0.20 2.53 2.96 -0.36 -1.57 118.68 122.47 2vlj s LEU 194 Ca 0.14 -0.54 -0.05 0.00 -0.22 0.00 0.00 54.13 53.45 2vlj s LEU 194 Cb -0.10 -1.09 -0.02 0.00 0.50 0.00 0.00 46.19 45.47 2vlj s LEU 194 CO 0.04 -0.10 -0.01 -0.60 -1.32 0.00 0.00 176.35 174.36 2vlj s ARG 195 N 1.53 3.57 0.36 1.98 3.52 -0.27 -0.29 118.95 129.35 2vlj s ARG 195 Ca 0.03 -0.54 0.08 0.00 -0.13 0.00 0.00 55.73 55.17 2vlj s ARG 195 Cb -0.14 -3.07 -0.07 0.00 -1.56 0.00 0.00 34.95 30.12 2vlj s ARG 195 CO -0.09 -0.03 -0.04 0.14 -0.81 0.00 0.00 175.30 174.47 2vlj s VAL 196 N 1.09 2.03 0.76 7.11 -7.23 -0.94 -4.73 120.40 118.50 2vlj s VAL 196 Ca 0.02 -2.11 -0.12 0.00 -1.81 0.00 0.00 61.98 57.96 2vlj s VAL 196 Cb -0.14 -2.77 0.05 0.00 0.56 0.00 0.00 36.38 34.07 2vlj s VAL 196 CO 0.01 -0.12 1.12 -0.94 -0.31 0.00 0.00 175.10 174.86 2vlj s SER 197 N -3.63 4.38 0.23 4.85 1.04 -1.26 -0.41 113.70 118.90 2vlj s SER 197 Ca 0.33 1.98 -0.06 0.00 0.48 0.00 0.00 55.95 58.68 2vlj s SER 197 Cb 0.06 -2.54 0.32 0.00 0.10 0.00 0.00 66.02 63.96 2vlj s SER 197 CO 0.17 -2.12 1.82 0.00 0.98 0.00 0.00 173.24 174.08 2vlj h ALA 198 N -0.86 1.07 -0.06 5.32 0.00 -1.05 -2.37 119.26 121.31 2vlj h ALA 198 Ca -0.45 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 2vlj h ALA 198 Cb 1.25 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2vlj h ALA 198 CO 0.50 0.13 -0.41 1.79 0.00 0.00 0.00 179.25 181.26 2vlj h THR 199 N 0.80 1.30 0.63 0.00 1.35 -1.93 -1.05 112.91 114.02 2vlj h THR 199 Ca 0.35 -1.46 -0.03 0.00 -0.55 0.00 0.00 66.41 64.72 2vlj h THR 199 Cb 0.24 1.72 0.01 0.00 -1.73 0.00 0.00 68.15 68.39 2vlj h THR 199 CO -0.20 0.43 -0.30 0.15 -0.25 0.00 0.00 175.52 175.34 2vlj h PHE 200 N 0.10 -0.79 -0.91 4.73 3.57 -1.87 -3.17 116.94 118.59 2vlj h PHE 200 Ca 0.01 -0.02 0.25 0.00 3.53 0.00 0.00 57.97 61.74 2vlj h PHE 200 Cb 0.77 0.26 -0.16 0.00 2.79 0.00 0.00 35.95 39.61 2vlj h PHE 200 CO 0.01 -0.49 0.10 2.35 -2.23 0.00 0.00 178.31 178.04 2vlj h TRP 201 N -1.14 0.09 -0.00 0.41 2.91 -1.32 -2.39 115.95 114.52 2vlj h TRP 201 Ca -0.09 0.06 0.00 0.00 1.13 0.00 0.00 58.89 59.99 2vlj h TRP 201 Cb 0.65 0.11 0.00 0.00 -0.51 0.00 0.00 29.16 29.41 2vlj h TRP 201 CO 0.01 -0.34 0.00 1.04 -1.03 0.00 0.00 178.44 178.13 2vlj n GLN 202 N -5.38 1.04 -2.68 2.65 6.02 -0.41 -2.57 117.38 116.05 2vlj n GLN 202 Ca 0.21 -0.06 -0.43 0.00 -0.01 0.00 0.00 57.00 56.71 2vlj n GLN 202 Cb 0.70 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 30.45 2vlj n GLN 202 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2vlj s ASN 203 N -1.98 6.84 0.00 1.08 3.84 -0.90 -4.33 114.94 119.49 2vlj s ASN 203 Ca 0.46 0.88 0.00 0.00 0.21 0.00 0.00 52.86 54.41 2vlj s ASN 203 Cb 0.21 -2.52 0.00 0.00 -0.55 0.00 0.00 41.25 38.39 2vlj s ASN 203 CO 0.36 -0.91 0.40 -0.81 -2.79 0.00 0.00 177.10 173.35 2vlj n PRO 204 N 6.94 0.60 0.00 0.43 -0.04 -1.26 -2.11 135.00 139.56 2vlj n PRO 204 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2vlj n PRO 204 Cb 0.48 -1.20 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 2vlj n PRO 204 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2vlj n ARG 205 N -0.03 0.17 -3.58 0.54 5.12 -1.26 -4.79 116.66 112.83 2vlj n ARG 205 Ca 0.00 -0.43 -0.36 0.00 -1.93 0.00 0.00 57.85 55.13 2vlj n ARG 205 Cb 0.10 -0.93 -0.08 0.00 -1.16 0.00 0.00 32.46 30.39 2vlj n ARG 205 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 2vlj s ASN 206 N -0.15 6.32 -0.17 0.55 0.01 -0.90 -4.99 114.94 115.61 2vlj s ASN 206 Ca 0.00 0.36 -0.01 0.00 -0.71 0.00 0.00 52.86 52.50 2vlj s ASN 206 Cb 0.00 -2.15 -0.00 0.00 0.41 0.00 0.00 41.25 39.50 2vlj s ASN 206 CO 0.00 0.08 -0.12 -2.28 -1.51 0.00 0.00 177.10 173.26 2vlj s HIS 207 N 0.72 2.83 -0.13 2.20 2.46 -1.26 -1.48 115.29 120.64 2vlj s HIS 207 Ca 0.13 -0.99 0.01 0.00 0.47 0.00 0.00 55.06 54.68 2vlj s HIS 207 Cb -0.13 -1.94 -0.00 0.00 -0.13 0.00 0.00 32.58 30.38 2vlj s HIS 207 CO 0.03 -0.47 -0.17 -0.06 -2.47 0.00 0.00 174.74 171.60 2vlj s PHE 208 N 0.93 2.73 -0.01 3.88 0.08 0.11 -2.56 117.98 123.12 2vlj s PHE 208 Ca -0.03 -0.94 0.03 0.00 0.12 0.00 0.00 56.93 56.12 2vlj s PHE 208 Cb -0.15 -1.82 -0.01 0.00 -0.57 0.00 0.00 43.02 40.47 2vlj s PHE 208 CO -0.01 -0.39 -0.11 0.50 -0.10 0.00 0.00 175.22 175.12 2vlj s ARG 209 N 0.55 0.89 -0.18 0.44 3.52 -0.63 -0.42 118.95 123.12 2vlj s ARG 209 Ca -0.11 -0.38 -0.03 0.00 -0.13 0.00 0.00 55.73 55.08 2vlj s ARG 209 Cb -0.16 -0.86 -0.02 0.00 -1.56 0.00 0.00 34.95 32.35 2vlj s ARG 209 CO 0.04 0.22 -0.05 0.00 -0.81 0.00 0.00 175.30 174.70 2vlj s GLN 211 N 0.82 3.28 -0.26 0.00 0.74 0.02 -2.74 119.66 121.52 2vlj s GLN 211 Ca -0.02 -0.74 0.00 0.00 0.05 0.00 0.00 55.36 54.65 2vlj s GLN 211 Cb -0.15 -2.55 0.04 0.00 1.10 0.00 0.00 33.01 31.46 2vlj s GLN 211 CO 0.01 0.17 -0.07 0.08 -0.55 0.00 0.00 175.29 174.93 2vlj s VAL 212 N 0.43 2.60 -0.18 1.34 1.01 0.09 -0.51 120.40 125.18 2vlj s VAL 212 Ca -0.12 -1.34 -0.29 0.00 0.00 0.00 0.00 61.98 60.23 2vlj s VAL 212 Cb -0.16 -2.42 -0.00 0.00 0.00 0.00 0.00 36.38 33.79 2vlj s VAL 212 CO 0.05 0.06 1.06 -1.58 0.00 0.00 0.00 175.10 174.70 2vlj s GLN 213 N 1.22 4.30 -0.10 2.72 2.00 0.43 -0.95 119.66 129.29 2vlj s GLN 213 Ca -0.04 1.42 -0.00 0.00 -2.00 0.00 0.00 55.36 54.73 2vlj s GLN 213 Cb -0.18 -3.62 -0.03 0.00 0.80 0.00 0.00 33.01 29.98 2vlj s GLN 213 CO -0.04 -0.55 -0.08 0.12 -0.50 0.00 0.00 175.29 174.24 2vlj s PHE 214 N 2.87 2.90 -0.37 1.67 5.36 0.53 -1.12 117.98 129.82 2vlj s PHE 214 Ca 0.47 -0.20 -0.10 0.00 -0.96 0.00 0.00 56.93 56.14 2vlj s PHE 214 Cb -0.17 -1.78 0.03 0.00 -0.34 0.00 0.00 43.02 40.76 2vlj s PHE 214 CO 0.11 0.12 0.18 0.71 -1.46 0.00 0.00 175.22 174.88 2vlj s TYR 215 N -0.31 3.25 0.00 10.12 2.02 -0.56 -2.03 117.35 129.85 2vlj s TYR 215 Ca 0.04 -1.14 0.00 0.00 -0.37 0.00 0.00 57.07 55.60 2vlj s TYR 215 Cb -0.13 -2.42 0.00 0.00 -0.40 0.00 0.00 41.96 39.01 2vlj s TYR 215 CO 0.02 -0.69 0.00 0.41 -1.57 0.00 0.00 175.55 173.73 2vlj n GLY 216 N 4.94 4.04 3.79 0.71 0.00 -1.26 -4.62 105.19 112.79 2vlj n GLY 216 Ca -0.12 -0.60 -0.34 0.00 0.00 0.00 0.00 46.02 44.96 2vlj n GLY 216 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vlj s LEU 217 N 0.00 3.62 0.19 0.99 1.43 -0.10 -4.60 118.68 120.20 2vlj s LEU 217 Ca 0.00 1.98 0.01 0.00 -1.03 0.00 0.00 54.13 55.09 2vlj s LEU 217 Cb 0.00 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.63 2vlj s LEU 217 CO 0.00 -1.20 0.35 -0.44 0.23 0.00 0.00 176.35 175.29 2vlj s SER 218 N -2.30 6.36 0.00 2.29 0.01 -1.26 -3.15 113.70 115.66 2vlj s SER 218 Ca 0.68 0.28 -0.04 0.00 1.31 0.00 0.00 55.95 58.18 2vlj s SER 218 Cb -0.19 -1.96 -0.19 0.00 0.21 0.00 0.00 66.02 63.89 2vlj s SER 218 CO 0.32 -0.01 2.77 -1.84 0.41 0.00 0.00 173.24 174.88 2vlj n GLU 219 N -0.70 1.46 0.00 12.44 0.00 -1.26 -0.82 120.64 131.76 2vlj n GLU 219 Ca -0.06 -0.69 0.00 0.00 0.00 0.00 0.00 57.16 56.41 2vlj n GLU 219 Cb 0.54 -1.81 0.00 0.00 0.00 0.00 0.00 31.44 30.17 2vlj n GLU 219 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 2vlj n ASN 220 N 2.52 0.00 -4.77 -1.84 6.94 -1.26 -5.09 115.26 111.76 2vlj n ASN 220 Ca 0.30 -0.46 -0.39 0.00 -0.02 0.00 0.00 54.58 54.01 2vlj n ASN 220 Cb 0.67 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 38.06 2vlj n ASN 220 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2vlj s ASP 221 N 0.00 6.86 -0.16 0.53 1.01 0.00 -5.03 116.67 119.88 2vlj s ASP 221 Ca 0.00 2.33 -0.23 0.00 0.71 0.00 0.00 52.55 55.37 2vlj s ASP 221 Cb 0.00 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.28 2vlj s ASP 221 CO 0.00 -0.44 0.70 -1.61 0.21 0.00 0.00 175.17 174.03 2vlj s GLU 222 N -1.94 4.29 -0.15 8.23 0.41 -1.26 -4.91 118.70 123.36 2vlj s GLU 222 Ca 0.51 0.79 -0.00 0.00 -0.41 0.00 0.00 54.97 55.86 2vlj s GLU 222 Cb -0.31 -3.54 -0.01 0.00 -1.78 0.00 0.00 34.13 28.49 2vlj s GLU 222 CO 0.40 -0.19 -0.14 -0.46 -0.49 0.00 0.00 175.26 174.38 2vlj s TRP 223 N 1.71 2.81 -0.00 1.61 -0.11 -1.26 -4.98 118.94 118.71 2vlj s TRP 223 Ca 0.33 -0.92 0.02 0.00 1.22 0.00 0.00 56.10 56.75 2vlj s TRP 223 Cb -0.16 -1.90 -0.03 0.00 -1.50 0.00 0.00 33.47 29.88 2vlj s TRP 223 CO 0.13 -0.41 0.04 2.41 -4.62 0.00 0.00 176.95 174.50 2vlj n THR 224 N 3.98 0.00 -0.81 5.86 -1.04 -1.26 -5.10 114.28 115.91 2vlj n THR 224 Ca -0.19 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.05 61.48 2vlj n THR 224 Cb 0.52 0.48 0.23 0.00 -1.82 0.00 0.00 70.33 69.74 2vlj n THR 224 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2vlj s GLN 225 N -2.09 -0.86 0.20 -2.82 -1.52 -1.26 -4.97 119.66 106.34 2vlj s GLN 225 Ca -0.01 0.47 0.12 0.00 -1.95 0.00 0.00 55.36 54.00 2vlj s GLN 225 Cb 0.01 -1.59 -0.05 0.00 -0.22 0.00 0.00 33.01 31.17 2vlj s GLN 225 CO 0.07 -3.59 1.33 -0.44 -0.25 0.00 0.00 175.29 172.41 2vlj h ASP 226 N -2.51 0.00 -4.25 5.90 5.19 -2.06 -3.46 116.42 115.23 2vlj h ASP 226 Ca -0.55 0.00 -0.50 0.00 -0.62 0.00 0.00 57.03 55.35 2vlj h ASP 226 Cb 1.33 0.00 0.09 0.00 0.18 0.00 0.00 39.33 40.93 2vlj h ASP 226 CO 0.48 0.68 0.36 0.00 -3.12 0.00 0.00 179.24 177.64 2vlj s ARG 227 N -2.87 2.92 0.55 3.56 1.70 -1.26 -5.00 118.95 118.55 2vlj s ARG 227 Ca 0.02 1.19 -0.22 0.00 -0.47 0.00 0.00 55.73 56.25 2vlj s ARG 227 Cb 0.08 -1.98 -0.05 0.00 -0.57 0.00 0.00 34.95 32.44 2vlj s ARG 227 CO 0.78 -1.13 1.35 0.00 -1.08 0.00 0.00 175.30 175.22 2vlj n ALA 228 N -2.64 1.56 -1.68 7.88 0.00 -1.26 -4.91 120.51 119.47 2vlj n ALA 228 Ca 0.09 0.12 -0.44 0.00 0.00 0.00 0.00 53.44 53.21 2vlj n ALA 228 Cb 0.53 -2.35 -0.04 0.00 0.00 0.00 0.00 19.45 17.59 2vlj n ALA 228 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2vlj n LYS 229 N -1.03 2.61 -1.99 0.00 4.81 -1.26 -4.87 118.16 116.44 2vlj n LYS 229 Ca 0.11 0.95 -0.42 0.00 -0.87 0.00 0.00 58.31 58.08 2vlj n LYS 229 Cb 0.45 -2.85 0.00 0.00 0.02 0.00 0.00 35.03 32.65 2vlj n LYS 229 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2vlj n PRO 230 N 6.24 2.99 -1.68 1.64 -0.04 -1.26 -4.94 135.00 137.95 2vlj n PRO 230 Ca 0.20 -2.84 -0.30 0.00 -0.04 0.00 0.00 63.50 60.52 2vlj n PRO 230 Cb 0.36 -3.31 0.07 0.00 -0.04 0.00 0.00 33.50 30.59 2vlj n PRO 230 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2vlj s VAL 231 N 3.20 3.18 0.25 0.52 -7.23 -1.26 -0.93 120.40 118.13 2vlj s VAL 231 Ca 0.48 0.38 -0.31 0.00 -1.81 0.00 0.00 61.98 60.73 2vlj s VAL 231 Cb 0.11 -3.23 -0.14 0.00 0.56 0.00 0.00 36.38 33.69 2vlj s VAL 231 CO -0.04 -0.50 1.26 0.41 -0.31 0.00 0.00 175.10 175.92 2vlj n THR 232 N -3.28 1.26 0.00 5.32 -1.04 -1.19 -4.44 114.28 110.92 2vlj n THR 232 Ca 0.07 -0.32 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 2vlj n THR 232 Cb 0.57 -1.26 0.00 0.00 -1.82 0.00 0.00 70.33 67.82 2vlj n THR 232 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2vlj n GLN 233 N 1.54 0.00 -4.47 -2.82 10.64 -0.86 -4.92 117.38 116.48 2vlj n GLN 233 Ca 0.11 0.00 -0.34 0.00 -1.83 0.00 0.00 57.00 54.94 2vlj n GLN 233 Cb 0.31 0.00 -0.13 0.00 -0.86 0.00 0.00 30.24 29.55 2vlj n GLN 233 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2vlj s ILE 234 N -2.00 3.43 -0.05 -0.39 1.01 -1.26 -0.35 121.20 121.59 2vlj s ILE 234 Ca 0.00 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.17 2vlj s ILE 234 Cb 0.00 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 39.96 2vlj s ILE 234 CO 0.00 0.49 -0.15 -0.69 0.00 0.00 0.00 174.94 174.59 2vlj s VAL 235 N 0.57 2.98 0.08 2.92 1.01 -0.12 -4.98 120.40 122.86 2vlj s VAL 235 Ca -0.05 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.19 2vlj s VAL 235 Cb -0.15 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 2vlj s VAL 235 CO 0.03 0.59 -0.05 -0.44 0.00 0.00 0.00 175.10 175.22 2vlj s SER 236 N -0.65 0.91 0.03 3.32 0.01 -1.26 -0.73 113.70 115.33 2vlj s SER 236 Ca 0.10 -1.01 -0.00 0.00 1.31 0.00 0.00 55.95 56.35 2vlj s SER 236 Cb -0.11 0.13 -0.02 0.00 0.21 0.00 0.00 66.02 66.23 2vlj s SER 236 CO 0.01 -0.51 -0.03 0.00 0.41 0.00 0.00 173.24 173.11 2vlj s ALA 237 N -3.73 0.19 0.27 1.44 0.00 -1.11 -4.79 121.76 114.03 2vlj s ALA 237 Ca 0.10 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 51.39 2vlj s ALA 237 Cb 0.06 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 2vlj s ALA 237 CO -0.07 -0.19 0.13 -1.83 0.00 0.00 0.00 175.76 173.81 2vlj s GLU 238 N -1.81 1.45 0.11 0.00 -1.05 -1.26 -1.77 118.70 114.36 2vlj s GLU 238 Ca -0.13 -1.80 -0.16 0.00 -0.15 0.00 0.00 54.97 52.74 2vlj s GLU 238 Cb -0.07 -0.09 0.03 0.00 -0.44 0.00 0.00 34.13 33.55 2vlj s GLU 238 CO -0.02 -0.38 0.38 0.00 0.95 0.00 0.00 175.26 176.19 2vlj s ALA 239 N -3.77 -0.87 0.09 -0.84 0.00 0.44 -4.87 121.76 111.93 2vlj s ALA 239 Ca 0.37 -0.06 0.10 0.00 0.00 0.00 0.00 51.96 52.37 2vlj s ALA 239 Cb 0.07 0.64 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 2vlj s ALA 239 CO 0.15 -0.61 -0.26 -1.58 0.00 0.00 0.00 175.76 173.46 2vlj s TRP 240 N -3.67 2.28 0.57 0.00 0.51 -1.26 0.04 118.94 117.41 2vlj s TRP 240 Ca 0.02 -0.40 -0.19 0.00 -2.12 0.00 0.00 56.10 53.42 2vlj s TRP 240 Cb 0.02 -1.30 -0.06 0.00 -0.81 0.00 0.00 33.47 31.31 2vlj s TRP 240 CO -0.11 0.23 0.87 0.41 -0.51 0.00 0.00 176.95 177.83 2vlj n GLY 241 N 1.35 -0.58 3.56 0.98 0.00 -0.55 -4.98 105.19 104.97 2vlj n GLY 241 Ca -0.17 -0.11 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 2vlj n GLY 241 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2vlj s ARG 242 N -2.51 3.85 -0.56 1.61 3.52 -1.06 -4.19 118.95 119.60 2vlj s ARG 242 Ca 0.73 -0.40 -0.26 0.00 -0.13 0.00 0.00 55.73 55.67 2vlj s ARG 242 Cb -0.44 -3.29 -0.05 0.00 -1.56 0.00 0.00 34.95 29.61 2vlj s ARG 242 CO 0.50 0.06 2.19 0.00 -0.81 0.00 0.00 175.30 177.24 2vlj s ALA 243 N 0.96 1.78 -2.00 6.12 0.00 -1.26 -4.59 121.76 122.78 2vlj s ALA 243 Ca 0.04 -0.32 0.22 0.00 0.00 0.00 0.00 51.96 51.90 2vlj s ALA 243 Cb -0.14 -4.35 1.31 0.00 0.00 0.00 0.00 23.12 19.94 2vlj s ALA 243 CO 0.03 -4.34 1.69 -0.40 0.00 0.00 0.00 175.76 172.73