#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wvz s ASP 21 N 0.00 4.37 -0.02 3.14 2.15 -1.26 -4.96 116.67 120.10 2wvz s ASP 21 Ca 0.00 -0.32 0.22 0.00 0.43 0.00 0.00 52.55 52.88 2wvz s ASP 21 Cb 0.00 -1.73 -0.32 0.00 -0.30 0.00 0.00 42.92 40.57 2wvz s ASP 21 CO 0.00 0.05 0.55 0.79 -0.17 0.00 0.00 175.17 176.40 2wvz n TRP 22 N 4.30 0.01 0.02 -5.34 7.02 -1.26 -4.42 117.44 117.77 2wvz n TRP 22 Ca -0.18 0.00 0.21 0.00 -1.02 0.00 0.00 57.50 56.52 2wvz n TRP 22 Cb 0.52 -0.42 0.72 0.00 -2.42 0.00 0.00 31.31 29.71 2wvz n TRP 22 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 2wvz h THR 23 N 0.00 0.57 -0.01 -0.99 1.35 -1.92 -0.02 112.91 111.89 2wvz h THR 23 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2wvz h THR 23 Cb 0.92 0.69 -0.00 0.00 -1.73 0.00 0.00 68.15 68.02 2wvz h THR 23 CO 0.00 0.00 0.05 0.06 -0.25 0.00 0.00 175.52 175.38 2wvz h GLN 24 N 0.00 0.00 0.00 4.72 3.07 -2.02 -1.50 115.11 119.38 2wvz h GLN 24 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.99 2wvz h GLN 24 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.66 2wvz h GLN 24 CO -0.00 0.00 -0.88 1.88 0.09 0.00 0.00 178.83 179.92 2wvz h TYR 25 N 0.00 0.00 -3.14 0.06 0.05 -1.31 -3.47 116.97 109.17 2wvz h TYR 25 Ca 0.00 0.00 -0.55 0.00 0.05 0.00 0.00 58.73 58.24 2wvz h TYR 25 Cb 0.10 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.82 2wvz h TYR 25 CO 0.00 0.00 0.64 0.08 -1.05 0.00 0.00 178.16 177.83 2wvz s VAL 26 N -3.32 4.25 -0.34 -2.88 1.01 -0.57 -4.33 120.40 114.22 2wvz s VAL 26 Ca 0.01 1.59 0.01 0.00 0.00 0.00 0.00 61.98 63.59 2wvz s VAL 26 Cb 0.10 -4.02 0.09 0.00 0.00 0.00 0.00 36.38 32.55 2wvz s VAL 26 CO 0.77 0.04 0.07 0.21 0.00 0.00 0.00 175.10 176.19 2wvz s ASN 27 N 1.34 4.88 0.41 3.32 2.47 -1.26 -4.82 114.94 121.28 2wvz s ASN 27 Ca 0.56 -1.92 0.29 0.00 0.42 0.00 0.00 52.86 52.21 2wvz s ASN 27 Cb -0.25 -1.69 1.40 0.00 -1.45 0.00 0.00 41.25 39.26 2wvz s ASN 27 CO 0.24 -0.39 1.87 -0.65 -3.72 0.00 0.00 177.10 174.46 2wvz h PRO 28 N 7.80 0.00 0.00 0.43 0.11 -1.92 -2.50 132.00 135.93 2wvz h PRO 28 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2wvz h PRO 28 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2wvz h PRO 28 CO 0.56 0.00 -0.36 1.28 -0.21 0.00 0.00 178.00 179.28 2wvz n LEU 29 N -2.56 0.55 -4.61 2.35 4.77 -1.26 -3.67 117.00 112.57 2wvz n LEU 29 Ca -0.00 0.29 -0.43 0.00 -0.03 0.00 0.00 56.01 55.84 2wvz n LEU 29 Cb 0.15 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 2wvz n LEU 29 CO 0.18 -0.03 1.77 -0.32 -1.33 0.00 0.00 177.39 177.66 2wvz s MET 30 N -3.08 3.27 0.00 3.23 1.75 -0.94 -1.07 119.30 122.45 2wvz s MET 30 Ca 0.10 1.98 0.00 0.00 -1.25 0.00 0.00 55.69 56.52 2wvz s MET 30 Cb 0.15 -4.32 0.00 0.00 2.84 0.00 0.00 34.83 33.50 2wvz s MET 30 CO 0.66 -1.95 0.00 0.41 -0.65 0.00 0.00 175.02 173.49 2wvz n GLY 31 N 5.57 1.05 0.04 2.11 0.00 0.48 -4.79 105.19 109.66 2wvz n GLY 31 Ca 0.28 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.42 2wvz n GLY 31 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wvz n SER 32 N 0.00 0.61 -3.30 1.61 3.41 -0.23 -1.47 113.62 114.24 2wvz n SER 32 Ca 0.00 -0.04 -0.38 0.00 -0.26 0.00 0.00 58.87 58.20 2wvz n SER 32 Cb 0.00 0.25 -0.02 0.00 -0.26 0.00 0.00 64.21 64.18 2wvz n SER 32 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2wvz n GLN 33 N -1.87 4.12 -5.16 4.33 7.27 -0.99 -0.57 117.38 124.51 2wvz n GLN 33 Ca 0.04 -2.98 -0.29 0.00 0.07 0.00 0.00 57.00 53.84 2wvz n GLN 33 Cb 0.40 -2.61 -0.16 0.00 2.41 0.00 0.00 30.24 30.28 2wvz n GLN 33 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2wvz s SER 34 N 0.86 2.79 0.25 1.69 0.01 -1.26 -4.52 113.70 113.52 2wvz s SER 34 Ca 0.59 -0.44 0.10 0.00 1.31 0.00 0.00 55.95 57.51 2wvz s SER 34 Cb 0.20 -0.31 -0.05 0.00 0.21 0.00 0.00 66.02 66.08 2wvz s SER 34 CO -0.09 0.29 -0.18 0.42 0.41 0.00 0.00 173.24 174.08 2wvz s THR 35 N -0.57 2.18 0.23 1.44 -4.23 -1.03 -4.94 115.64 108.72 2wvz s THR 35 Ca 0.09 -2.32 -0.08 0.00 -1.18 0.00 0.00 61.69 58.19 2wvz s THR 35 Cb -0.09 -2.19 0.22 0.00 1.34 0.00 0.00 72.50 71.77 2wvz s THR 35 CO -0.01 -0.47 1.67 0.15 -0.54 0.00 0.00 174.62 175.42 2wvz h PHE 36 N 2.40 0.07 0.00 3.99 3.57 -2.02 -2.06 116.94 122.89 2wvz h PHE 36 Ca -0.39 0.05 -0.10 0.00 3.53 0.00 0.00 57.97 61.05 2wvz h PHE 36 Cb 1.24 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 2wvz h PHE 36 CO 0.77 -0.15 -0.47 0.93 -2.23 0.00 0.00 178.31 177.17 2wvz h GLU 37 N 0.17 0.00 -2.28 1.11 3.07 -1.95 -3.40 114.58 111.30 2wvz h GLU 37 Ca 0.36 0.00 -0.28 0.00 -0.50 0.00 0.00 59.36 58.94 2wvz h GLU 37 Cb 0.61 0.00 -0.34 0.00 -0.84 0.00 0.00 28.75 28.18 2wvz h GLU 37 CO -0.54 0.47 -0.60 -1.17 -1.40 0.00 0.00 179.01 175.78 2wvz s LEU 38 N -7.86 -0.26 0.21 1.33 2.96 -0.78 -4.19 118.68 110.10 2wvz s LEU 38 Ca -0.02 -0.27 -0.30 0.00 -0.22 0.00 0.00 54.13 53.32 2wvz s LEU 38 Cb 0.13 0.58 -0.08 0.00 0.50 0.00 0.00 46.19 47.32 2wvz s LEU 38 CO 0.74 -0.34 1.02 -0.55 -1.32 0.00 0.00 176.35 175.89 2wvz s SER 39 N 2.38 7.45 -0.14 3.68 0.15 -1.22 -2.47 113.70 123.54 2wvz s SER 39 Ca 0.09 2.03 0.18 0.00 0.70 0.00 0.00 55.95 58.95 2wvz s SER 39 Cb -0.15 -2.61 0.32 0.00 -1.71 0.00 0.00 66.02 61.87 2wvz s SER 39 CO -0.19 -0.03 1.18 0.35 1.20 0.00 0.00 173.24 175.75 2wvz n THR 40 N 1.85 1.94 0.00 6.45 -2.24 -1.26 -3.64 114.28 117.38 2wvz n THR 40 Ca 0.00 -2.28 0.00 0.00 -2.27 0.00 0.00 64.05 59.50 2wvz n THR 40 Cb 0.47 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 2wvz n THR 40 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wvz n GLY 41 N -1.34 1.67 4.15 3.38 0.00 -0.91 -1.07 105.19 111.06 2wvz n GLY 41 Ca 0.17 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 2wvz n GLY 41 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wvz n ASN 42 N 0.00 0.09 -4.78 1.61 3.02 -1.08 -1.18 115.26 112.95 2wvz n ASN 42 Ca 0.00 -1.17 -0.24 0.00 -0.03 0.00 0.00 54.58 53.14 2wvz n ASN 42 Cb 0.00 -2.20 -0.06 0.00 -0.61 0.00 0.00 39.78 36.91 2wvz n ASN 42 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2wvz s THR 43 N -4.16 2.34 0.23 3.41 -4.23 -0.54 -4.62 115.64 108.07 2wvz s THR 43 Ca 0.03 -1.61 0.07 0.00 -1.18 0.00 0.00 61.69 59.01 2wvz s THR 43 Cb -0.02 -2.95 -0.05 0.00 1.34 0.00 0.00 72.50 70.82 2wvz s THR 43 CO 0.95 0.00 -0.10 -0.72 -0.54 0.00 0.00 174.62 174.21 2wvz s TYR 44 N -2.58 1.78 -0.42 3.99 1.13 -1.26 -3.95 117.35 116.04 2wvz s TYR 44 Ca 0.42 -0.65 -0.27 0.00 -1.41 0.00 0.00 57.07 55.15 2wvz s TYR 44 Cb 0.02 -0.92 -0.04 0.00 -1.10 0.00 0.00 41.96 39.92 2wvz s TYR 44 CO 0.23 0.29 2.03 -2.14 -2.51 0.00 0.00 175.55 173.45 2wvz s PRO 45 N -3.70 2.84 -0.66 -3.49 0.02 -1.24 -4.92 135.00 123.85 2wvz s PRO 45 Ca 0.26 1.33 -0.19 0.00 0.02 0.00 0.00 61.00 62.42 2wvz s PRO 45 Cb 0.02 -4.37 0.12 0.00 0.02 0.00 0.00 34.50 30.29 2wvz s PRO 45 CO 0.09 -2.45 0.78 0.00 -0.33 0.00 0.00 177.00 175.09 2wvz s ALA 46 N 8.91 3.46 -0.45 -1.55 0.00 -1.26 -4.45 121.76 126.42 2wvz s ALA 46 Ca 0.84 -2.39 -0.23 0.00 0.00 0.00 0.00 51.96 50.18 2wvz s ALA 46 Cb -0.21 -3.62 0.02 0.00 0.00 0.00 0.00 23.12 19.32 2wvz s ALA 46 CO 0.29 -2.45 0.79 0.42 0.00 0.00 0.00 175.76 174.80 2wvz s ILE 47 N 2.51 4.65 0.18 0.00 -1.09 -0.57 -4.84 121.20 122.04 2wvz s ILE 47 Ca 0.15 0.46 -0.24 0.00 -2.23 0.00 0.00 60.65 58.80 2wvz s ILE 47 Cb -0.20 -4.32 0.06 0.00 -1.58 0.00 0.00 42.46 36.42 2wvz s ILE 47 CO 0.03 -0.71 0.93 0.00 -1.23 0.00 0.00 174.94 173.96 2wvz s ALA 48 N 3.29 -1.57 0.48 9.38 0.00 -0.92 -1.49 121.76 130.93 2wvz s ALA 48 Ca 0.30 0.01 -0.04 0.00 0.00 0.00 0.00 51.96 52.23 2wvz s ALA 48 Cb -0.12 0.68 -0.03 0.00 0.00 0.00 0.00 23.12 23.65 2wvz s ALA 48 CO 0.22 -1.05 0.76 1.03 0.00 0.00 0.00 175.76 176.73 2wvz s ARG 49 N -3.26 3.44 -0.21 0.00 1.81 -1.26 -4.52 118.95 114.94 2wvz s ARG 49 Ca 0.13 0.07 -0.41 0.00 -1.72 0.00 0.00 55.73 53.80 2wvz s ARG 49 Cb -0.02 -2.41 -0.18 0.00 -0.45 0.00 0.00 34.95 31.89 2wvz s ARG 49 CO 0.03 -0.22 1.49 -2.30 -0.68 0.00 0.00 175.30 173.62 2wvz n PRO 50 N -2.23 0.61 -1.92 3.54 -0.02 -1.26 -0.64 135.00 133.08 2wvz n PRO 50 Ca 0.00 0.22 -0.18 0.00 -2.02 0.00 0.00 63.50 61.52 2wvz n PRO 50 Cb 0.56 -1.81 -0.05 0.00 -0.02 0.00 0.00 33.50 32.18 2wvz n PRO 50 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2wvz n TRP 51 N 3.64 -0.58 -1.56 6.00 8.01 0.02 -4.90 117.44 128.07 2wvz n TRP 51 Ca 0.25 0.00 -0.47 0.00 -1.31 0.00 0.00 57.50 55.97 2wvz n TRP 51 Cb 0.08 -3.36 -0.03 0.00 -2.01 0.00 0.00 31.31 25.99 2wvz n TRP 51 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2wvz n GLY 52 N -0.61 -0.29 0.21 6.99 0.00 0.18 -0.80 105.19 110.89 2wvz n GLY 52 Ca -0.20 0.42 0.02 0.00 0.00 0.00 0.00 46.02 46.26 2wvz n GLY 52 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2wvz h MET 53 N 2.46 0.12 -4.08 1.61 4.05 -1.44 -3.38 114.93 114.28 2wvz h MET 53 Ca -0.40 -0.04 -0.50 0.00 -0.28 0.00 0.00 59.70 58.49 2wvz h MET 53 Cb 1.35 -0.01 -0.37 0.00 -0.80 0.00 0.00 31.60 31.77 2wvz h MET 53 CO 0.64 0.37 -0.79 -0.80 0.23 0.00 0.00 176.91 176.56 2wvz s ASN 54 N -6.92 1.95 0.21 1.39 0.01 -0.93 -4.91 114.94 105.74 2wvz s ASN 54 Ca -0.04 -0.23 0.03 0.00 -0.71 0.00 0.00 52.86 51.90 2wvz s ASN 54 Cb 0.15 -0.71 -0.03 0.00 0.41 0.00 0.00 41.25 41.06 2wvz s ASN 54 CO 0.73 -0.13 0.36 -0.36 -1.51 0.00 0.00 177.10 176.19 2wvz s PHE 55 N 1.71 3.47 0.05 2.20 0.08 -1.09 -4.75 117.98 119.65 2wvz s PHE 55 Ca 0.04 0.14 0.06 0.00 0.12 0.00 0.00 56.93 57.28 2wvz s PHE 55 Cb -0.13 -1.69 -0.03 0.00 -0.57 0.00 0.00 43.02 40.61 2wvz s PHE 55 CO -0.07 0.42 -0.16 -1.58 -0.10 0.00 0.00 175.22 173.73 2wvz s TRP 56 N -1.91 1.42 -0.16 0.36 0.52 -0.55 -1.75 118.94 116.88 2wvz s TRP 56 Ca 0.36 -0.38 -0.25 0.00 0.02 0.00 0.00 56.10 55.84 2wvz s TRP 56 Cb -0.10 -0.83 0.06 0.00 -1.15 0.00 0.00 33.47 31.45 2wvz s TRP 56 CO 0.30 0.07 0.64 -0.08 0.02 0.00 0.00 176.95 177.90 2wvz s THR 57 N -0.94 0.00 0.46 2.01 -1.32 -0.33 -1.51 115.64 114.01 2wvz s THR 57 Ca 0.03 -0.03 -0.23 0.00 -1.21 0.00 0.00 61.69 60.24 2wvz s THR 57 Cb -0.09 -0.93 -0.09 0.00 -1.51 0.00 0.00 72.50 69.88 2wvz s THR 57 CO 0.02 -0.02 1.01 -0.81 -2.21 0.00 0.00 174.62 172.61 2wvz n PRO 58 N 1.95 1.31 -4.11 7.08 -0.04 -1.26 -1.42 135.00 138.50 2wvz n PRO 58 Ca -0.16 0.47 -0.33 0.00 -0.04 0.00 0.00 63.50 63.44 2wvz n PRO 58 Cb 0.56 -2.09 -0.16 0.00 -0.04 0.00 0.00 33.50 31.77 2wvz n PRO 58 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2wvz s GLN 59 N -2.16 2.82 -0.21 0.54 0.74 -0.16 -4.63 119.66 116.60 2wvz s GLN 59 Ca 0.65 -0.94 0.09 0.00 0.05 0.00 0.00 55.36 55.21 2wvz s GLN 59 Cb -0.52 -2.63 -0.22 0.00 1.10 0.00 0.00 33.01 30.74 2wvz s GLN 59 CO 0.55 -0.29 0.01 0.25 -0.55 0.00 0.00 175.29 175.26 2wvz n THR 60 N 4.58 1.48 -1.91 -0.34 -2.24 0.83 -0.82 114.28 115.86 2wvz n THR 60 Ca -0.19 -0.72 -0.30 0.00 -2.27 0.00 0.00 64.05 60.57 2wvz n THR 60 Cb 0.48 -1.00 0.04 0.00 -2.10 0.00 0.00 70.33 67.75 2wvz n THR 60 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2wvz s GLY 61 N -5.91 1.63 0.60 3.38 0.00 -0.55 -4.69 107.32 101.78 2wvz s GLY 61 Ca -0.21 -0.32 -0.14 0.00 0.00 0.00 0.00 44.72 44.04 2wvz s GLY 61 CO 0.73 0.03 1.04 0.54 0.00 0.00 0.00 173.10 175.43 2wvz s LYS 62 N -5.31 3.38 0.23 2.90 1.02 -1.26 -4.92 119.74 115.78 2wvz s LYS 62 Ca 0.57 1.06 -0.31 0.00 0.02 0.00 0.00 55.97 57.31 2wvz s LYS 62 Cb -0.11 -2.05 -0.13 0.00 -0.52 0.00 0.00 37.83 35.02 2wvz s LYS 62 CO 0.52 -0.75 1.48 -0.12 -0.92 0.00 0.00 175.35 175.56 2wvz n MET 63 N -2.24 2.20 0.00 1.68 0.00 -1.26 -1.71 117.12 115.79 2wvz n MET 63 Ca 0.08 0.78 0.00 0.00 -0.00 0.00 0.00 57.70 58.56 2wvz n MET 63 Cb 0.53 -2.49 0.00 0.00 0.00 0.00 0.00 33.22 31.26 2wvz n MET 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2wvz n GLY 64 N 2.44 2.91 3.73 -5.12 0.00 -1.26 -5.04 105.19 102.84 2wvz n GLY 64 Ca 0.12 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2wvz n GLY 64 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wvz s ASP 65 N 0.81 6.71 0.45 1.61 -1.08 -0.69 -4.90 116.67 119.58 2wvz s ASP 65 Ca 0.00 2.54 0.23 0.00 -0.52 0.00 0.00 52.55 54.80 2wvz s ASP 65 Cb 0.00 -2.61 1.04 0.00 -1.46 0.00 0.00 42.92 39.90 2wvz s ASP 65 CO 0.00 -0.69 1.89 1.23 0.52 0.00 0.00 175.17 178.12 2wvz h GLY 66 N 5.91 0.00 -7.66 2.66 0.00 -1.89 -3.31 103.07 98.78 2wvz h GLY 66 Ca -0.44 0.00 -0.71 0.00 0.00 0.00 0.00 47.33 46.18 2wvz h GLY 66 CO 0.83 0.00 1.40 -0.98 0.00 0.00 0.00 176.54 177.79 2wvz s TRP 67 N -3.88 3.28 -0.32 5.60 0.51 -1.26 -4.38 118.94 118.50 2wvz s TRP 67 Ca -0.01 -1.87 0.21 0.00 -2.12 0.00 0.00 56.10 52.31 2wvz s TRP 67 Cb 0.12 -4.39 0.18 0.00 -0.81 0.00 0.00 33.47 28.56 2wvz s TRP 67 CO 0.63 -1.50 1.39 -0.56 -0.51 0.00 0.00 176.95 176.41 2wvz h GLN 68 N 7.62 0.00 -2.79 4.98 3.07 -1.93 -3.34 115.11 122.72 2wvz h GLN 68 Ca 0.30 0.00 -0.28 0.00 0.09 0.00 0.00 58.65 58.76 2wvz h GLN 68 Cb 0.90 0.00 -0.35 0.00 0.08 0.00 0.00 27.48 28.12 2wvz h GLN 68 CO 1.26 0.11 -0.60 -0.47 0.09 0.00 0.00 178.83 179.22 2wvz s TYR 69 N -3.18 -0.29 -0.08 0.06 5.04 -1.26 -0.12 117.35 117.52 2wvz s TYR 69 Ca 0.04 0.55 0.03 0.00 -2.44 0.00 0.00 57.07 55.25 2wvz s TYR 69 Cb 0.07 -0.24 -0.02 0.00 0.35 0.00 0.00 41.96 42.12 2wvz s TYR 69 CO 0.72 -0.44 -0.17 0.95 -1.34 0.00 0.00 175.55 175.28 2wvz s THR 70 N 2.34 2.76 0.63 4.34 -4.23 -1.26 -4.71 115.64 115.51 2wvz s THR 70 Ca 0.04 -0.80 0.34 0.00 -1.18 0.00 0.00 61.69 60.09 2wvz s THR 70 Cb -0.14 -2.09 0.38 0.00 1.34 0.00 0.00 72.50 71.99 2wvz s THR 70 CO -0.09 0.56 2.20 0.22 -0.54 0.00 0.00 174.62 176.97 2wvz h TYR 71 N 6.00 0.00 0.00 3.99 5.03 -1.20 -0.42 116.97 130.37 2wvz h TYR 71 Ca -0.35 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.96 2wvz h TYR 71 Cb 1.18 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.46 2wvz h TYR 71 CO 0.48 0.00 -0.46 2.41 -1.32 0.00 0.00 178.16 179.27 2wvz n THR 72 N -3.46 0.02 -2.03 1.81 -1.04 -1.26 -4.91 114.28 103.40 2wvz n THR 72 Ca -0.01 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.58 2wvz n THR 72 Cb 0.20 0.16 -0.02 0.00 -1.82 0.00 0.00 70.33 68.85 2wvz n THR 72 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wvz s ALA 73 N -3.01 3.53 -0.12 2.41 0.00 -0.17 -4.94 121.76 119.46 2wvz s ALA 73 Ca 0.11 1.34 0.14 0.00 0.00 0.00 0.00 51.96 53.56 2wvz s ALA 73 Cb 0.17 -3.52 -0.01 0.00 0.00 0.00 0.00 23.12 19.77 2wvz s ALA 73 CO 0.68 -0.75 1.29 -0.91 0.00 0.00 0.00 175.76 176.08 2wvz h ASN 74 N 3.46 0.00 -4.32 0.00 2.35 -1.90 -3.48 115.58 111.69 2wvz h ASN 74 Ca -0.49 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 54.98 2wvz h ASN 74 Cb 1.23 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 39.35 2wvz h ASN 74 CO 0.66 0.58 -0.74 -0.54 -1.65 0.00 0.00 177.43 175.74 2wvz s LYS 75 N -2.92 0.39 -0.13 0.81 1.02 -1.26 -1.95 119.74 115.70 2wvz s LYS 75 Ca 0.02 -0.41 -0.06 0.00 0.02 0.00 0.00 55.97 55.54 2wvz s LYS 75 Cb 0.08 -0.25 -0.04 0.00 -0.52 0.00 0.00 37.83 37.10 2wvz s LYS 75 CO 0.77 0.05 0.09 0.42 -0.92 0.00 0.00 175.35 175.76 2wvz s ILE 76 N -0.71 5.03 -0.01 2.17 1.01 -0.73 -4.38 121.20 123.57 2wvz s ILE 76 Ca -0.05 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.64 2wvz s ILE 76 Cb -0.06 -3.20 0.00 0.00 0.01 0.00 0.00 42.46 39.22 2wvz s ILE 76 CO -0.00 0.57 0.54 -2.11 0.00 0.00 0.00 174.94 173.93 2wvz n ARG 77 N 2.49 -0.72 0.00 2.79 1.85 0.00 -1.66 116.66 121.41 2wvz n ARG 77 Ca -0.19 -0.57 0.00 0.00 -1.00 0.00 0.00 57.85 56.09 2wvz n ARG 77 Cb 0.54 -1.00 0.00 0.00 -1.05 0.00 0.00 32.46 30.95 2wvz n ARG 77 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wvz n GLY 78 N -0.03 0.88 3.19 2.89 0.00 -1.23 -4.81 105.19 106.08 2wvz n GLY 78 Ca 0.00 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.81 2wvz n GLY 78 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wvz s PHE 79 N -2.00 2.87 -0.05 1.61 0.40 0.76 -0.99 117.98 120.57 2wvz s PHE 79 Ca 0.00 -1.42 0.05 0.00 -0.60 0.00 0.00 56.93 54.96 2wvz s PHE 79 Cb 0.00 -1.99 -0.02 0.00 0.51 0.00 0.00 43.02 41.52 2wvz s PHE 79 CO 0.00 -0.72 -0.19 0.21 0.70 0.00 0.00 175.22 175.23 2wvz s LYS 80 N 1.35 2.49 -0.06 0.44 2.20 -0.51 -1.02 119.74 124.63 2wvz s LYS 80 Ca 0.05 -0.78 -0.23 0.00 -0.36 0.00 0.00 55.97 54.65 2wvz s LYS 80 Cb -0.14 -2.29 -0.04 0.00 -1.51 0.00 0.00 37.83 33.86 2wvz s LYS 80 CO -0.09 0.54 0.69 -1.14 -0.36 0.00 0.00 175.35 174.98 2wvz s GLN 81 N -0.53 4.43 0.03 4.03 0.74 0.01 -1.19 119.66 127.18 2wvz s GLN 81 Ca 0.07 0.86 -0.03 0.00 0.05 0.00 0.00 55.36 56.31 2wvz s GLN 81 Cb -0.11 -3.44 -0.02 0.00 1.10 0.00 0.00 33.01 30.54 2wvz s GLN 81 CO 0.01 0.10 0.03 -0.08 -0.55 0.00 0.00 175.29 174.80 2wvz s THR 82 N 0.68 0.14 0.00 -0.34 -1.32 -0.71 -3.09 115.64 110.99 2wvz s THR 82 Ca 0.37 -1.12 0.00 0.00 -1.21 0.00 0.00 61.69 59.73 2wvz s THR 82 Cb -0.18 -0.72 0.00 0.00 -1.51 0.00 0.00 72.50 70.09 2wvz s THR 82 CO 0.18 -0.61 0.53 1.41 -2.21 0.00 0.00 174.62 173.92 2wvz n HIS 83 N 1.03 0.00 -1.67 9.09 8.25 -1.25 -2.69 115.22 127.98 2wvz n HIS 83 Ca -0.20 -0.13 -0.49 0.00 -0.26 0.00 0.00 57.72 56.64 2wvz n HIS 83 Cb 0.57 -0.01 -0.05 0.00 1.12 0.00 0.00 29.99 31.62 2wvz n HIS 83 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2wvz n GLN 84 N -0.13 1.97 0.12 -0.41 7.27 -1.26 -4.89 117.38 120.06 2wvz n GLN 84 Ca 0.00 0.72 0.12 0.00 0.07 0.00 0.00 57.00 57.91 2wvz n GLN 84 Cb 0.17 -2.50 0.19 0.00 2.41 0.00 0.00 30.24 30.50 2wvz n GLN 84 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 2wvz h PRO 85 N 7.52 0.00 -1.81 3.69 0.13 -1.89 -3.49 132.00 136.15 2wvz h PRO 85 Ca -0.47 0.00 0.16 0.00 -0.87 0.00 0.00 66.00 64.82 2wvz h PRO 85 Cb 1.28 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.22 2wvz h PRO 85 CO 0.92 0.00 0.63 -1.54 -0.23 0.00 0.00 178.00 177.78 2wvz s SER 86 N -5.10 -0.28 0.59 1.44 1.04 -1.26 -4.63 113.70 105.51 2wvz s SER 86 Ca 0.06 0.09 0.39 0.00 0.48 0.00 0.00 55.95 56.97 2wvz s SER 86 Cb 0.10 0.27 2.06 0.00 0.10 0.00 0.00 66.02 68.55 2wvz s SER 86 CO 0.69 -0.41 2.20 1.55 0.98 0.00 0.00 173.24 178.26 2wvz h PRO 87 N 2.12 0.00 0.08 4.02 0.13 -1.82 0.83 132.00 137.37 2wvz h PRO 87 Ca -0.16 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.82 2wvz h PRO 87 Cb 1.20 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 2wvz h PRO 87 CO 0.28 0.00 -0.72 -1.49 -0.23 0.00 0.00 178.00 175.84 2wvz h TRP 88 N 0.00 0.32 -0.24 1.56 4.06 -1.94 -3.35 115.95 116.36 2wvz h TRP 88 Ca 0.00 -0.24 -0.15 0.00 2.06 0.00 0.00 58.89 60.56 2wvz h TRP 88 Cb 0.10 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.24 2wvz h TRP 88 CO 0.00 1.28 -0.49 0.82 -3.56 0.00 0.00 178.44 176.49 2wvz h ILE 89 N -0.59 1.30 -0.30 1.49 1.08 -1.87 -3.49 117.51 115.13 2wvz h ILE 89 Ca -0.15 -1.69 0.00 0.00 -0.39 0.00 0.00 64.86 62.63 2wvz h ILE 89 Cb 1.45 1.64 0.00 0.00 -3.07 0.00 0.00 36.82 36.84 2wvz h ILE 89 CO 0.06 0.54 0.00 -3.20 -0.69 0.00 0.00 178.15 174.86 2wvz n ASN 90 N -4.00 -0.89 -4.30 1.72 2.85 0.26 -4.82 115.26 106.09 2wvz n ASN 90 Ca -0.03 0.00 -0.17 0.00 -0.11 0.00 0.00 54.58 54.27 2wvz n ASN 90 Cb 0.57 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 41.49 2wvz n ASN 90 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2wvz s ASP 91 N -4.00 2.23 0.14 1.20 -1.08 -1.26 -4.17 116.67 109.73 2wvz s ASP 91 Ca 0.00 -0.99 -0.15 0.00 -0.52 0.00 0.00 52.55 50.89 2wvz s ASP 91 Cb 0.00 -0.08 0.03 0.00 -1.46 0.00 0.00 42.92 41.40 2wvz s ASP 91 CO 0.00 -0.22 0.40 -0.72 0.52 0.00 0.00 175.17 175.15 2wvz s TYR 92 N -2.97 -0.09 -1.11 -5.34 1.13 -1.26 -2.73 117.35 104.98 2wvz s TYR 92 Ca 0.19 -0.25 -0.04 0.00 -1.41 0.00 0.00 57.07 55.56 2wvz s TYR 92 Cb -0.00 0.23 -0.04 0.00 -1.10 0.00 0.00 41.96 41.05 2wvz s TYR 92 CO 0.04 -0.75 0.95 0.41 -2.51 0.00 0.00 175.55 173.69 2wvz n GLY 93 N -0.24 -0.86 2.93 5.49 0.00 -1.24 -3.85 105.19 107.42 2wvz n GLY 93 Ca -0.13 0.40 -0.23 0.00 0.00 0.00 0.00 46.02 46.06 2wvz n GLY 93 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2wvz s GLN 94 N -4.78 1.21 0.23 1.61 -2.07 -1.26 -4.41 119.66 110.19 2wvz s GLN 94 Ca 0.29 -0.22 -0.13 0.00 -1.82 0.00 0.00 55.36 53.48 2wvz s GLN 94 Cb -0.04 -1.13 -0.00 0.00 -1.09 0.00 0.00 33.01 30.75 2wvz s GLN 94 CO 0.74 -0.07 0.46 -0.59 -1.32 0.00 0.00 175.29 174.51 2wvz s PHE 95 N 0.97 0.31 0.12 9.60 -0.71 -1.18 -4.56 117.98 122.52 2wvz s PHE 95 Ca -0.10 -0.67 -0.07 0.00 -1.04 0.00 0.00 56.93 55.05 2wvz s PHE 95 Cb -0.15 0.19 -0.01 0.00 -1.21 0.00 0.00 43.02 41.84 2wvz s PHE 95 CO 0.00 -0.95 0.19 -1.54 -1.34 0.00 0.00 175.22 171.58 2wvz s SER 96 N -2.99 0.14 0.04 1.98 1.04 -0.36 -0.81 113.70 112.74 2wvz s SER 96 Ca 0.20 -0.81 0.04 0.00 0.48 0.00 0.00 55.95 55.87 2wvz s SER 96 Cb -0.00 0.36 -0.02 0.00 0.10 0.00 0.00 66.02 66.45 2wvz s SER 96 CO 0.07 -0.78 -0.13 -0.51 0.98 0.00 0.00 173.24 172.87 2wvz s ILE 97 N -3.92 1.02 -0.25 -1.02 2.07 -0.19 0.12 121.20 119.04 2wvz s ILE 97 Ca 0.11 -0.96 -0.06 0.00 -1.41 0.00 0.00 60.65 58.33 2wvz s ILE 97 Cb 0.05 -0.93 0.12 0.00 0.13 0.00 0.00 42.46 41.83 2wvz s ILE 97 CO -0.06 -0.02 0.50 -0.32 -1.91 0.00 0.00 174.94 173.13 2wvz s MET 98 N -1.11 0.43 0.27 3.50 -2.45 0.78 -0.17 119.30 120.55 2wvz s MET 98 Ca 0.01 1.07 -0.20 0.00 -1.25 0.00 0.00 55.69 55.32 2wvz s MET 98 Cb -0.08 0.39 -0.09 0.00 1.25 0.00 0.00 34.83 36.30 2wvz s MET 98 CO 0.01 -0.34 0.78 -1.25 1.05 0.00 0.00 175.02 175.27 2wvz s PRO 99 N 2.71 4.27 0.23 4.11 0.04 -1.26 0.73 135.00 145.83 2wvz s PRO 99 Ca 0.02 0.94 -0.06 0.00 0.04 0.00 0.00 61.00 61.94 2wvz s PRO 99 Cb -0.13 -2.73 -0.02 0.00 0.04 0.00 0.00 34.50 31.65 2wvz s PRO 99 CO -0.16 0.30 0.29 0.96 0.04 0.00 0.00 177.00 178.43 2wvz s ILE 100 N -1.67 0.00 0.04 0.56 -4.36 0.71 -4.91 121.20 111.57 2wvz s ILE 100 Ca 0.48 -1.75 0.00 0.00 -0.26 0.00 0.00 60.65 59.12 2wvz s ILE 100 Cb -0.15 -2.38 -0.03 0.00 1.25 0.00 0.00 42.46 41.15 2wvz s ILE 100 CO 0.20 0.00 -0.04 0.68 0.24 0.00 0.00 174.94 176.02 2wvz s VAL 101 N -4.06 0.29 0.00 8.37 -7.23 -1.26 -1.02 120.40 115.49 2wvz s VAL 101 Ca 0.32 -1.28 0.00 0.00 -1.81 0.00 0.00 61.98 59.21 2wvz s VAL 101 Cb 0.04 -0.80 0.00 0.00 0.56 0.00 0.00 36.38 36.18 2wvz s VAL 101 CO 0.11 -0.64 0.00 0.61 -0.31 0.00 0.00 175.10 174.87 2wvz n GLY 102 N 1.02 0.28 3.73 2.32 0.00 -0.49 -4.96 105.19 107.10 2wvz n GLY 102 Ca -0.20 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 2wvz n GLY 102 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wvz n GLN 103 N 0.00 2.35 -2.39 1.61 1.13 -1.26 -4.79 117.38 114.02 2wvz n GLN 103 Ca 0.00 0.82 -0.40 0.00 -1.94 0.00 0.00 57.00 55.48 2wvz n GLN 103 Cb 0.00 -2.48 -0.03 0.00 0.11 0.00 0.00 30.24 27.84 2wvz n GLN 103 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2wvz s PRO 104 N -2.01 3.07 -0.07 -1.09 0.04 -1.26 -5.00 135.00 128.68 2wvz s PRO 104 Ca 0.55 0.10 0.03 0.00 0.04 0.00 0.00 61.00 61.72 2wvz s PRO 104 Cb -0.52 -4.22 -0.02 0.00 0.04 0.00 0.00 34.50 29.77 2wvz s PRO 104 CO 0.63 -2.25 -0.15 0.14 0.04 0.00 0.00 177.00 175.40 2wvz s VAL 105 N 6.63 2.95 -0.13 -0.36 -7.23 -1.26 -5.00 120.40 115.99 2wvz s VAL 105 Ca 0.46 -0.74 0.11 0.00 -1.81 0.00 0.00 61.98 60.00 2wvz s VAL 105 Cb -0.10 -2.17 -0.23 0.00 0.56 0.00 0.00 36.38 34.44 2wvz s VAL 105 CO 0.18 0.57 0.31 0.33 -0.31 0.00 0.00 175.10 176.18 2wvz n PHE 106 N 2.72 0.56 -1.46 2.82 7.35 -1.26 -4.63 117.46 123.57 2wvz n PHE 106 Ca -0.17 0.18 -0.52 0.00 -0.76 0.00 0.00 57.45 56.18 2wvz n PHE 106 Cb 0.52 -1.10 -0.05 0.00 0.35 0.00 0.00 39.48 39.21 2wvz n PHE 106 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2wvz n ASP 107 N -3.02 -0.52 0.07 -2.13 -0.08 -1.26 -4.83 116.55 104.78 2wvz n ASP 107 Ca -0.28 1.14 0.13 0.00 -1.51 0.00 0.00 54.79 54.27 2wvz n ASP 107 Cb 1.08 -0.97 0.48 0.00 2.34 0.00 0.00 41.12 44.05 2wvz n ASP 107 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 2wvz n GLU 108 N 1.23 0.16 -0.02 -0.67 0.28 -1.26 -2.37 120.64 117.98 2wvz n GLU 108 Ca 0.18 0.16 -0.20 0.00 -0.16 0.00 0.00 57.16 57.15 2wvz n GLU 108 Cb 0.19 -1.70 -0.14 0.00 1.43 0.00 0.00 31.44 31.23 2wvz n GLU 108 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2wvz n GLU 109 N -1.99 0.73 0.06 3.44 1.02 -1.26 -4.06 120.64 118.58 2wvz n GLU 109 Ca 0.06 0.24 -0.09 0.00 -0.02 0.00 0.00 57.16 57.34 2wvz n GLU 109 Cb 0.38 -1.68 0.04 0.00 -0.02 0.00 0.00 31.44 30.16 2wvz n GLU 109 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2wvz h LYS 110 N 0.05 0.38 0.00 3.49 1.57 -1.91 -2.95 116.57 117.20 2wvz h LYS 110 Ca -0.45 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.03 2wvz h LYS 110 Cb 2.01 0.06 0.00 0.00 0.08 0.00 0.00 32.23 34.39 2wvz h LYS 110 CO 0.05 0.95 0.00 0.07 -0.57 0.00 0.00 179.45 179.95 2wvz h ARG 111 N 0.26 0.00 -7.06 3.15 0.11 -1.69 -3.47 114.38 105.68 2wvz h ARG 111 Ca -0.03 0.00 -0.54 0.00 0.10 0.00 0.00 59.98 59.51 2wvz h ARG 111 Cb 1.29 0.00 0.12 0.00 1.11 0.00 0.00 29.97 32.49 2wvz h ARG 111 CO 0.12 0.00 0.54 0.00 0.10 0.00 0.00 179.97 180.73 2wvz s ALA 112 N -3.28 2.72 -0.03 0.08 0.00 -1.12 -4.94 121.76 115.20 2wvz s ALA 112 Ca 0.06 1.17 0.03 0.00 0.00 0.00 0.00 51.96 53.23 2wvz s ALA 112 Cb 0.10 -3.51 -0.00 0.00 0.00 0.00 0.00 23.12 19.71 2wvz s ALA 112 CO 0.48 -1.23 -0.12 0.45 0.00 0.00 0.00 175.76 175.34 2wvz s SER 113 N -1.23 1.58 0.79 0.00 0.15 -0.67 -4.97 113.70 109.34 2wvz s SER 113 Ca 0.73 -0.25 -0.15 0.00 0.70 0.00 0.00 55.95 56.98 2wvz s SER 113 Cb -0.36 -0.37 -0.01 0.00 -1.71 0.00 0.00 66.02 63.58 2wvz s SER 113 CO 0.41 0.12 0.56 0.79 1.20 0.00 0.00 173.24 176.32 2wvz n TRP 114 N 3.12 -0.75 -3.81 3.44 7.02 -1.26 -1.77 117.44 123.42 2wvz n TRP 114 Ca -0.17 0.32 -0.06 0.00 -1.02 0.00 0.00 57.50 56.57 2wvz n TRP 114 Cb 0.54 -1.90 -0.02 0.00 -2.42 0.00 0.00 31.31 27.51 2wvz n TRP 114 CO 0.00 0.00 0.00 -0.59 -2.02 0.00 0.00 177.69 175.08 2wvz s PHE 115 N -2.04 -0.20 0.12 -5.99 -0.71 -0.82 -1.96 117.98 106.38 2wvz s PHE 115 Ca 0.64 -0.21 -0.03 0.00 -1.04 0.00 0.00 56.93 56.29 2wvz s PHE 115 Cb -0.31 0.69 -0.03 0.00 -1.21 0.00 0.00 43.02 42.15 2wvz s PHE 115 CO 0.59 -1.12 0.09 0.00 -1.34 0.00 0.00 175.22 173.44 2wvz s ALA 116 N -3.76 0.53 -0.22 1.99 0.00 -1.26 -4.82 121.76 114.22 2wvz s ALA 116 Ca 0.11 -1.23 0.22 0.00 0.00 0.00 0.00 51.96 51.05 2wvz s ALA 116 Cb -0.05 0.71 0.45 0.00 0.00 0.00 0.00 23.12 24.23 2wvz s ALA 116 CO 0.05 -0.49 1.63 0.45 0.00 0.00 0.00 175.76 177.40 2wvz h HIS 117 N 2.86 0.00 0.00 0.00 -0.00 -1.96 -1.96 115.15 114.08 2wvz h HIS 117 Ca -0.34 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.03 2wvz h HIS 117 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.60 2wvz h HIS 117 CO 0.45 0.18 0.00 1.63 -0.00 0.00 0.00 177.93 180.18 2wvz n LYS 118 N -3.17 0.06 -0.71 2.45 5.02 -1.26 -1.30 118.16 119.25 2wvz n LYS 118 Ca 0.03 0.17 0.07 0.00 -2.02 0.00 0.00 58.31 56.55 2wvz n LYS 118 Cb 0.55 -1.58 0.33 0.00 -0.02 0.00 0.00 35.03 34.31 2wvz n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wvz n GLY 119 N 0.77 3.56 3.00 0.72 0.00 -0.74 -4.98 105.19 107.52 2wvz n GLY 119 Ca 0.05 -0.99 -0.21 0.00 0.00 0.00 0.00 46.02 44.86 2wvz n GLY 119 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wvz s GLU 120 N -2.83 1.08 -0.21 1.61 2.12 -0.42 -1.70 118.70 118.35 2wvz s GLU 120 Ca 0.49 -0.32 0.01 0.00 0.36 0.00 0.00 54.97 55.51 2wvz s GLU 120 Cb 0.39 -0.99 0.04 0.00 0.26 0.00 0.00 34.13 33.84 2wvz s GLU 120 CO 0.12 0.10 -0.10 0.08 -0.54 0.00 0.00 175.26 174.92 2wvz s VAL 121 N 0.28 1.70 -0.25 3.70 1.01 0.14 -4.94 120.40 122.03 2wvz s VAL 121 Ca -0.05 -1.08 -0.02 0.00 0.00 0.00 0.00 61.98 60.84 2wvz s VAL 121 Cb -0.10 -1.78 0.02 0.00 0.00 0.00 0.00 36.38 34.53 2wvz s VAL 121 CO 0.01 0.15 -0.06 0.00 0.00 0.00 0.00 175.10 175.20 2wvz s ALA 122 N 1.36 2.71 0.35 5.51 0.00 -1.26 -0.13 121.76 130.30 2wvz s ALA 122 Ca -0.02 -1.45 0.05 0.00 0.00 0.00 0.00 51.96 50.54 2wvz s ALA 122 Cb -0.17 -1.70 -0.07 0.00 0.00 0.00 0.00 23.12 21.19 2wvz s ALA 122 CO -0.08 -0.80 0.03 0.95 0.00 0.00 0.00 175.76 175.86 2wvz s THR 123 N 1.33 1.53 -0.49 0.00 -4.23 -0.18 -4.53 115.64 109.08 2wvz s THR 123 Ca 0.00 -2.01 0.22 0.00 -1.18 0.00 0.00 61.69 58.73 2wvz s THR 123 Cb -0.17 -2.84 0.23 0.00 1.34 0.00 0.00 72.50 71.07 2wvz s THR 123 CO -0.04 -0.03 1.68 -2.65 -0.54 0.00 0.00 174.62 173.04 2wvz n PRO 124 N -0.78 0.17 0.00 3.99 -0.02 -1.26 -3.40 135.00 133.71 2wvz n PRO 124 Ca -0.03 0.44 0.02 0.00 -2.02 0.00 0.00 63.50 61.90 2wvz n PRO 124 Cb 0.66 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 2wvz n PRO 124 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2wvz n TYR 125 N -2.19 0.00 -3.64 6.00 4.11 -1.26 -2.17 117.16 118.02 2wvz n TYR 125 Ca 0.02 0.00 -0.07 0.00 -0.00 0.00 0.00 57.90 57.85 2wvz n TYR 125 Cb 0.20 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.47 2wvz n TYR 125 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.86 176.39 2wvz s TYR 126 N -0.56 -0.76 -0.04 -3.48 5.04 -1.22 -4.25 117.35 112.07 2wvz s TYR 126 Ca 0.03 1.63 0.03 0.00 -2.44 0.00 0.00 57.07 56.31 2wvz s TYR 126 Cb 0.03 0.44 0.00 0.00 0.35 0.00 0.00 41.96 42.78 2wvz s TYR 126 CO 0.06 -0.38 -0.12 -0.47 -1.34 0.00 0.00 175.55 173.31 2wvz s TYR 127 N 1.07 1.27 -0.01 4.97 5.04 -0.46 -1.01 117.35 128.23 2wvz s TYR 127 Ca -0.06 -0.37 0.02 0.00 -2.44 0.00 0.00 57.07 54.23 2wvz s TYR 127 Cb -0.05 -0.90 -0.00 0.00 0.35 0.00 0.00 41.96 41.36 2wvz s TYR 127 CO -0.12 -0.16 -0.08 0.21 -1.34 0.00 0.00 175.55 174.06 2wvz s LYS 128 N 0.27 0.69 -0.02 4.97 2.20 0.81 -1.22 119.74 127.44 2wvz s LYS 128 Ca -0.06 -0.28 -0.14 0.00 -0.36 0.00 0.00 55.97 55.12 2wvz s LYS 128 Cb -0.11 -0.66 0.02 0.00 -1.51 0.00 0.00 37.83 35.57 2wvz s LYS 128 CO 0.02 0.16 0.31 0.54 -0.36 0.00 0.00 175.35 176.02 2wvz s VAL 129 N -0.12 0.05 -0.29 4.02 0.11 0.71 0.23 120.40 125.11 2wvz s VAL 129 Ca 0.02 -0.44 -0.10 0.00 -2.93 0.00 0.00 61.98 58.52 2wvz s VAL 129 Cb -0.04 -0.60 -0.03 0.00 -1.53 0.00 0.00 36.38 34.18 2wvz s VAL 129 CO -0.00 -0.24 0.17 -0.47 -3.33 0.00 0.00 175.10 171.23 2wvz s TYR 130 N -1.22 3.19 -0.85 1.54 5.04 -0.69 -0.73 117.35 123.64 2wvz s TYR 130 Ca -0.13 -0.17 -0.18 0.00 -2.44 0.00 0.00 57.07 54.15 2wvz s TYR 130 Cb -0.05 -2.37 0.13 0.00 0.35 0.00 0.00 41.96 40.03 2wvz s TYR 130 CO 0.04 -0.29 1.01 -0.51 -1.34 0.00 0.00 175.55 174.46 2wvz s LEU 131 N 1.70 5.28 0.29 6.97 1.43 0.12 -4.63 118.68 129.84 2wvz s LEU 131 Ca 0.06 -1.96 0.00 0.00 -1.03 0.00 0.00 54.13 51.21 2wvz s LEU 131 Cb -0.16 -2.36 0.69 0.00 0.03 0.00 0.00 46.19 44.38 2wvz s LEU 131 CO 0.09 -1.04 1.60 0.00 0.23 0.00 0.00 176.35 177.23 2wvz h ALA 132 N 8.80 1.12 -0.00 4.21 0.00 -1.68 -1.18 119.26 130.53 2wvz h ALA 132 Ca 0.05 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2wvz h ALA 132 Cb 1.04 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.33 2wvz h ALA 132 CO 1.06 -0.53 -0.13 0.39 0.00 0.00 0.00 179.25 180.04 2wvz n GLU 133 N -5.40 0.14 0.00 0.00 1.02 -1.26 -2.96 120.64 112.17 2wvz n GLU 133 Ca 0.21 -0.03 0.04 0.00 -0.02 0.00 0.00 57.16 57.36 2wvz n GLU 133 Cb 0.69 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.60 2wvz n GLU 133 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2wvz n HIS 134 N -1.40 0.00 -4.10 -0.32 8.25 -0.56 -4.94 115.22 112.15 2wvz n HIS 134 Ca 0.08 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.20 2wvz n HIS 134 Cb 0.32 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.43 2wvz n HIS 134 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2wvz n ASP 135 N -0.54 -3.89 -4.38 0.41 2.03 -0.55 -4.71 116.55 104.91 2wvz n ASP 135 Ca 0.03 -0.92 -0.32 0.00 0.52 0.00 0.00 54.79 54.10 2wvz n ASP 135 Cb 0.16 -3.20 -0.15 0.00 -0.72 0.00 0.00 41.12 37.21 2wvz n ASP 135 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2wvz s ILE 136 N -3.29 2.56 -0.19 5.18 1.01 -1.18 -3.93 121.20 121.35 2wvz s ILE 136 Ca 0.71 -0.90 -0.10 0.00 0.00 0.00 0.00 60.65 60.36 2wvz s ILE 136 Cb -0.38 -1.96 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 2wvz s ILE 136 CO 0.89 0.58 0.13 -0.69 0.00 0.00 0.00 174.94 175.84 2wvz s VAL 137 N -0.49 5.37 -0.10 2.92 1.01 -0.80 -0.70 120.40 127.62 2wvz s VAL 137 Ca 0.06 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.22 2wvz s VAL 137 Cb -0.11 -3.44 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 2wvz s VAL 137 CO 0.01 0.45 -0.09 -0.89 0.00 0.00 0.00 175.10 174.58 2wvz s THR 138 N 0.26 3.46 0.08 3.92 2.01 0.09 -0.91 115.64 124.56 2wvz s THR 138 Ca 0.08 -0.54 0.05 0.00 0.31 0.00 0.00 61.69 61.59 2wvz s THR 138 Cb -0.11 -2.44 -0.03 0.00 0.01 0.00 0.00 72.50 69.93 2wvz s THR 138 CO -0.01 0.55 -0.15 -1.61 -0.69 0.00 0.00 174.62 172.71 2wvz s GLU 139 N -0.23 0.86 -0.16 4.92 2.02 -0.52 -0.21 118.70 125.39 2wvz s GLU 139 Ca 0.02 -1.00 -0.17 0.00 0.02 0.00 0.00 54.97 53.85 2wvz s GLU 139 Cb -0.13 -0.89 0.05 0.00 0.10 0.00 0.00 34.13 33.26 2wvz s GLU 139 CO 0.03 0.20 0.47 0.00 0.02 0.00 0.00 175.26 175.97 2wvz s MET 140 N -1.82 0.58 -0.07 1.61 0.23 -0.36 -0.73 119.30 118.74 2wvz s MET 140 Ca -0.00 0.59 -0.02 0.00 -1.03 0.00 0.00 55.69 55.23 2wvz s MET 140 Cb -0.10 0.28 0.03 0.00 -1.53 0.00 0.00 34.83 33.51 2wvz s MET 140 CO 0.02 -0.08 0.01 0.95 -2.03 0.00 0.00 175.02 173.90 2wvz s THR 141 N 0.09 0.28 0.31 3.16 -4.23 -0.34 -1.36 115.64 113.54 2wvz s THR 141 Ca -0.01 0.18 -0.01 0.00 -1.18 0.00 0.00 61.69 60.66 2wvz s THR 141 Cb -0.03 -0.46 -0.04 0.00 1.34 0.00 0.00 72.50 73.31 2wvz s THR 141 CO 0.01 0.24 0.53 -2.16 -0.54 0.00 0.00 174.62 172.69 2wvz s PRO 142 N 2.01 3.53 0.00 3.99 0.04 -1.26 -1.28 135.00 142.03 2wvz s PRO 142 Ca 0.05 -0.23 0.00 0.00 0.04 0.00 0.00 61.00 60.86 2wvz s PRO 142 Cb -0.12 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 31.73 2wvz s PRO 142 CO -0.05 0.20 0.00 0.25 0.04 0.00 0.00 177.00 177.45 2wvz n THR 143 N -1.36 0.00 -0.31 1.26 -2.24 0.79 -4.67 114.28 107.75 2wvz n THR 143 Ca -0.04 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.70 2wvz n THR 143 Cb 0.55 -0.64 0.10 0.00 -2.10 0.00 0.00 70.33 68.24 2wvz n THR 143 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2wvz h GLU 144 N 0.00 1.22 0.00 -0.78 5.08 -1.94 -3.36 114.58 114.79 2wvz h GLU 144 Ca 0.00 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2wvz h GLU 144 Cb 0.00 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.02 2wvz h GLU 144 CO 0.00 0.91 0.00 0.54 -1.00 0.00 0.00 179.01 179.46 2wvz n ARG 145 N -4.32 4.02 -4.49 2.33 1.74 -1.26 -1.66 116.66 113.02 2wvz n ARG 145 Ca 0.09 -0.06 -0.24 0.00 -0.77 0.00 0.00 57.85 56.87 2wvz n ARG 145 Cb 0.11 -0.44 -0.09 0.00 -1.02 0.00 0.00 32.46 31.02 2wvz n ARG 145 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wvz s ALA 146 N -0.59 2.71 -0.13 7.54 0.00 -1.26 -3.04 121.76 126.98 2wvz s ALA 146 Ca 0.00 -1.56 -0.22 0.00 0.00 0.00 0.00 51.96 50.18 2wvz s ALA 146 Cb 0.00 0.68 0.05 0.00 0.00 0.00 0.00 23.12 23.86 2wvz s ALA 146 CO 0.00 -0.31 0.55 0.54 0.00 0.00 0.00 175.76 176.54 2wvz s VAL 147 N -3.25 0.01 -0.23 0.00 0.11 0.28 -0.15 120.40 117.17 2wvz s VAL 147 Ca 0.29 -0.09 -0.10 0.00 -2.93 0.00 0.00 61.98 59.15 2wvz s VAL 147 Cb 0.05 -0.81 -0.05 0.00 -1.53 0.00 0.00 36.38 34.05 2wvz s VAL 147 CO 0.14 -0.05 0.13 -0.22 -3.33 0.00 0.00 175.10 171.77 2wvz s LEU 148 N -0.41 3.97 0.04 2.54 2.96 -0.41 -1.44 118.68 125.93 2wvz s LEU 148 Ca -0.05 0.06 -0.00 0.00 -0.22 0.00 0.00 54.13 53.92 2wvz s LEU 148 Cb -0.03 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 2wvz s LEU 148 CO 0.04 0.07 0.15 -0.36 -1.32 0.00 0.00 176.35 174.93 2wvz s PHE 149 N 1.02 3.41 -0.08 5.38 0.40 -0.22 -1.20 117.98 126.69 2wvz s PHE 149 Ca 0.06 0.23 0.00 0.00 -0.60 0.00 0.00 56.93 56.62 2wvz s PHE 149 Cb -0.14 -1.74 0.02 0.00 0.51 0.00 0.00 43.02 41.68 2wvz s PHE 149 CO 0.04 0.58 -0.06 0.50 0.70 0.00 0.00 175.22 176.98 2wvz s ARG 150 N -2.20 1.15 -0.17 0.44 3.52 0.09 -1.25 118.95 120.53 2wvz s ARG 150 Ca 0.30 -0.15 -0.05 0.00 -0.13 0.00 0.00 55.73 55.70 2wvz s ARG 150 Cb -0.13 -1.22 -0.03 0.00 -1.56 0.00 0.00 34.95 32.02 2wvz s ARG 150 CO 0.22 -0.18 -0.00 -0.06 -0.81 0.00 0.00 175.30 174.46 2wvz s PHE 151 N 1.41 3.08 -0.37 5.12 0.40 0.13 -1.43 117.98 126.32 2wvz s PHE 151 Ca -0.02 -0.25 -0.13 0.00 -0.60 0.00 0.00 56.93 55.93 2wvz s PHE 151 Cb -0.13 -2.02 0.01 0.00 0.51 0.00 0.00 43.02 41.39 2wvz s PHE 151 CO -0.03 -0.04 0.25 0.99 0.70 0.00 0.00 175.22 177.09 2wvz s THR 152 N 0.52 5.05 0.16 0.64 2.01 -0.09 -0.55 115.64 123.39 2wvz s THR 152 Ca -0.01 -0.57 -0.02 0.00 0.31 0.00 0.00 61.69 61.41 2wvz s THR 152 Cb -0.14 -3.74 -0.05 0.00 0.01 0.00 0.00 72.50 68.59 2wvz s THR 152 CO 0.02 -0.18 0.36 -0.36 -0.69 0.00 0.00 174.62 173.77 2wvz s PHE 153 N 1.66 3.49 0.83 4.92 0.08 0.37 -1.90 117.98 127.43 2wvz s PHE 153 Ca 0.05 0.38 -0.09 0.00 0.12 0.00 0.00 56.93 57.38 2wvz s PHE 153 Cb -0.18 -1.87 0.15 0.00 -0.57 0.00 0.00 43.02 40.54 2wvz s PHE 153 CO 0.09 0.43 1.16 -1.25 -0.10 0.00 0.00 175.22 175.55 2wvz s PRO 154 N -3.02 1.32 0.17 0.24 0.04 -1.25 -0.21 135.00 132.28 2wvz s PRO 154 Ca 0.39 -0.56 -0.31 0.00 0.04 0.00 0.00 61.00 60.55 2wvz s PRO 154 Cb -0.12 -2.06 -0.10 0.00 0.04 0.00 0.00 34.50 32.27 2wvz s PRO 154 CO 0.28 -1.86 1.55 -2.00 0.04 0.00 0.00 177.00 175.00 2wvz s GLU 155 N -5.53 4.23 -0.28 4.56 2.12 -1.26 -4.33 118.70 118.21 2wvz s GLU 155 Ca 0.68 2.34 -0.27 0.00 0.36 0.00 0.00 54.97 58.08 2wvz s GLU 155 Cb -0.06 -3.16 0.18 0.00 0.26 0.00 0.00 34.13 31.36 2wvz s GLU 155 CO 0.49 -0.58 1.36 1.21 -0.54 0.00 0.00 175.26 177.20 2wvz s ASN 156 N 1.09 -0.08 0.21 -1.70 3.84 0.45 -4.87 114.94 113.88 2wvz s ASN 156 Ca 0.69 0.13 0.08 0.00 0.21 0.00 0.00 52.86 53.97 2wvz s ASN 156 Cb -0.43 0.12 0.12 0.00 -0.55 0.00 0.00 41.25 40.51 2wvz s ASN 156 CO 0.32 -0.05 1.47 0.44 -2.79 0.00 0.00 177.10 176.49 2wvz h ASP 157 N 2.70 0.06 -3.25 -4.21 3.32 -1.85 0.78 116.42 113.97 2wvz h ASP 157 Ca -0.19 -0.04 -0.62 0.00 0.02 0.00 0.00 57.03 56.20 2wvz h ASP 157 Cb 1.19 -0.02 -0.42 0.00 0.22 0.00 0.00 39.33 40.31 2wvz h ASP 157 CO 0.20 0.80 -0.61 -1.00 -1.72 0.00 0.00 179.24 176.92 2wvz s HIS 158 N -3.29 3.35 -0.17 4.55 3.76 -1.26 -3.90 115.29 118.34 2wvz s HIS 158 Ca -0.01 -3.25 -0.04 0.00 -0.15 0.00 0.00 55.06 51.62 2wvz s HIS 158 Cb 0.11 -2.61 -0.02 0.00 1.11 0.00 0.00 32.58 31.17 2wvz s HIS 158 CO 0.79 -0.59 -0.04 -1.12 -0.85 0.00 0.00 174.74 172.93 2wvz s SER 159 N -1.18 4.70 0.26 1.40 0.01 -1.02 -1.39 113.70 116.48 2wvz s SER 159 Ca 0.24 -0.18 0.03 0.00 1.31 0.00 0.00 55.95 57.35 2wvz s SER 159 Cb -0.07 -1.77 -0.05 0.00 0.21 0.00 0.00 66.02 64.33 2wvz s SER 159 CO -0.14 0.13 0.04 -0.31 0.41 0.00 0.00 173.24 173.37 2wvz s TYR 160 N 0.57 1.62 -0.11 2.43 1.51 -0.19 -1.16 117.35 122.03 2wvz s TYR 160 Ca -0.03 -1.00 0.01 0.00 -1.01 0.00 0.00 57.07 55.03 2wvz s TYR 160 Cb -0.14 -0.97 0.02 0.00 -0.11 0.00 0.00 41.96 40.75 2wvz s TYR 160 CO 0.03 -0.12 -0.11 0.08 -1.11 0.00 0.00 175.55 174.32 2wvz s VAL 161 N -3.50 1.22 -0.04 0.71 1.01 0.14 -0.21 120.40 119.73 2wvz s VAL 161 Ca 0.32 -0.45 -0.16 0.00 0.00 0.00 0.00 61.98 61.69 2wvz s VAL 161 Cb 0.07 -1.16 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 2wvz s VAL 161 CO 0.11 0.39 0.44 -0.69 0.00 0.00 0.00 175.10 175.35 2wvz s VAL 162 N 1.28 5.07 -0.15 2.92 1.01 0.22 -1.97 120.40 128.79 2wvz s VAL 162 Ca -0.02 0.90 0.01 0.00 0.00 0.00 0.00 61.98 62.87 2wvz s VAL 162 Cb -0.14 -3.76 0.02 0.00 0.00 0.00 0.00 36.38 32.50 2wvz s VAL 162 CO -0.04 0.47 -0.16 -0.69 0.00 0.00 0.00 175.10 174.68 2wvz s VAL 163 N -0.38 1.74 -0.23 2.92 1.01 -0.28 -0.15 120.40 125.03 2wvz s VAL 163 Ca 0.25 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.45 2wvz s VAL 163 Cb -0.16 -1.60 0.01 0.00 0.00 0.00 0.00 36.38 34.62 2wvz s VAL 163 CO 0.12 0.49 -0.05 -0.62 0.00 0.00 0.00 175.10 175.04 2wvz s ASP 164 N 1.35 4.26 0.00 3.32 -1.08 0.12 -2.10 116.67 122.53 2wvz s ASP 164 Ca 0.03 -0.60 0.27 0.00 -0.52 0.00 0.00 52.55 51.73 2wvz s ASP 164 Cb -0.13 -1.70 0.88 0.00 -1.46 0.00 0.00 42.92 40.50 2wvz s ASP 164 CO -0.10 -0.07 1.64 0.00 0.52 0.00 0.00 175.17 177.16 2wvz n ALA 165 N 4.74 2.85 -0.57 3.66 0.00 -0.81 -1.22 120.51 129.16 2wvz n ALA 165 Ca -0.18 -0.43 0.08 0.00 0.00 0.00 0.00 53.44 52.92 2wvz n ALA 165 Cb 0.49 -1.14 -0.02 0.00 0.00 0.00 0.00 19.45 18.78 2wvz n ALA 165 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2wvz n PHE 166 N -0.26 -1.44 -2.55 0.00 3.01 -1.26 -4.46 117.46 110.50 2wvz n PHE 166 Ca 0.15 0.73 0.00 0.00 1.01 0.00 0.00 57.45 59.34 2wvz n PHE 166 Cb 0.35 -1.31 0.00 0.00 -0.01 0.00 0.00 39.48 38.51 2wvz n PHE 166 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2wvz n ASP 167 N -2.50 0.33 -1.83 4.37 5.75 -1.26 -3.68 116.55 117.73 2wvz n ASP 167 Ca -0.00 -0.39 -0.18 0.00 -0.01 0.00 0.00 54.79 54.21 2wvz n ASP 167 Cb 0.26 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.32 2wvz n ASP 167 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2wvz n LYS 168 N -0.32 -1.40 0.00 0.11 4.76 -0.82 -3.52 118.16 116.97 2wvz n LYS 168 Ca 0.00 1.00 0.00 0.00 -2.87 0.00 0.00 58.31 56.44 2wvz n LYS 168 Cb 0.00 -5.42 0.00 0.00 -1.84 0.00 0.00 35.03 27.77 2wvz n LYS 168 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wvz n GLY 169 N -0.90 0.24 3.17 0.72 0.00 0.13 -4.66 105.19 103.90 2wvz n GLY 169 Ca -0.21 -0.83 -0.20 0.00 0.00 0.00 0.00 46.02 44.79 2wvz n GLY 169 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wvz n SER 170 N 0.00 -0.35 -3.83 1.61 3.41 -0.47 -3.62 113.62 110.37 2wvz n SER 170 Ca 0.00 -3.15 -0.11 0.00 -0.26 0.00 0.00 58.87 55.35 2wvz n SER 170 Cb 0.00 1.53 -0.09 0.00 -0.26 0.00 0.00 64.21 65.39 2wvz n SER 170 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2wvz s TYR 171 N -3.28 -0.00 -0.19 7.33 5.04 -0.13 -2.90 117.35 123.21 2wvz s TYR 171 Ca 0.36 -0.13 -0.12 0.00 -2.44 0.00 0.00 57.07 54.74 2wvz s TYR 171 Cb 0.02 -0.00 0.06 0.00 0.35 0.00 0.00 41.96 42.39 2wvz s TYR 171 CO 0.25 -0.40 0.47 -1.50 -1.34 0.00 0.00 175.55 173.04 2wvz s ILE 172 N -2.09 -0.01 -0.06 3.14 1.10 -0.71 -1.48 121.20 121.08 2wvz s ILE 172 Ca -0.09 0.05 -0.01 0.00 -0.51 0.00 0.00 60.65 60.10 2wvz s ILE 172 Cb -0.03 -0.69 0.03 0.00 0.15 0.00 0.00 42.46 41.91 2wvz s ILE 172 CO -0.01 0.02 -0.01 -0.75 -2.11 0.00 0.00 174.94 172.08 2wvz s LYS 173 N 1.15 0.62 -0.04 3.50 2.20 0.20 -1.21 119.74 126.16 2wvz s LYS 173 Ca -0.07 0.06 -0.23 0.00 -0.36 0.00 0.00 55.97 55.36 2wvz s LYS 173 Cb -0.07 -0.89 -0.04 0.00 -1.51 0.00 0.00 37.83 35.32 2wvz s LYS 173 CO -0.11 -0.24 0.70 0.42 -0.36 0.00 0.00 175.35 175.77 2wvz s ILE 174 N 1.64 4.97 -0.58 5.43 1.01 0.23 -0.94 121.20 132.96 2wvz s ILE 174 Ca -0.00 1.46 0.05 0.00 0.00 0.00 0.00 60.65 62.16 2wvz s ILE 174 Cb -0.13 -4.04 0.20 0.00 0.01 0.00 0.00 42.46 38.50 2wvz s ILE 174 CO -0.04 0.30 0.51 -0.38 0.00 0.00 0.00 174.94 175.33 2wvz n ILE 175 N 3.44 0.77 -0.30 2.92 5.41 0.73 -4.86 119.36 127.47 2wvz n ILE 175 Ca -0.02 -4.47 0.09 0.00 1.00 0.00 0.00 62.75 59.35 2wvz n ILE 175 Cb 0.51 -2.00 0.32 0.00 -0.71 0.00 0.00 39.64 37.75 2wvz n ILE 175 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 2wvz h PRO 176 N 5.01 0.80 0.00 0.38 0.13 -1.96 -1.01 132.00 135.36 2wvz h PRO 176 Ca 0.18 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2wvz h PRO 176 Cb 0.79 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.74 2wvz h PRO 176 CO 0.62 0.53 0.00 -0.85 -0.23 0.00 0.00 178.00 178.07 2wvz n GLU 177 N -4.58 0.52 -0.40 0.86 0.00 -1.26 -1.14 120.64 114.64 2wvz n GLU 177 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 57.16 57.35 2wvz n GLU 177 Cb 0.40 -1.27 0.02 0.00 0.00 0.00 0.00 31.44 30.59 2wvz n GLU 177 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2wvz n GLU 178 N -0.77 0.21 -4.25 3.44 1.02 -0.41 -5.00 120.64 114.88 2wvz n GLU 178 Ca 0.07 -1.18 -0.32 0.00 -0.02 0.00 0.00 57.16 55.71 2wvz n GLU 178 Cb 0.03 -0.64 -0.07 0.00 -0.02 0.00 0.00 31.44 30.74 2wvz n GLU 178 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2wvz n ASN 179 N -0.20 -0.22 -4.23 1.62 3.02 -0.29 -4.73 115.26 110.22 2wvz n ASN 179 Ca 0.02 -1.18 -0.24 0.00 -0.03 0.00 0.00 54.58 53.16 2wvz n ASN 179 Cb 0.67 -2.08 -0.13 0.00 -0.61 0.00 0.00 39.78 37.62 2wvz n ASN 179 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2wvz s LYS 180 N -7.11 1.21 -0.03 3.52 2.20 -1.06 -1.11 119.74 117.36 2wvz s LYS 180 Ca 0.20 -0.95 0.05 0.00 -0.36 0.00 0.00 55.97 54.91 2wvz s LYS 180 Cb -0.12 -1.33 -0.01 0.00 -1.51 0.00 0.00 37.83 34.87 2wvz s LYS 180 CO 0.97 0.33 -0.18 0.42 -0.36 0.00 0.00 175.35 176.53 2wvz s ILE 181 N -0.91 1.44 0.30 5.43 1.01 -0.06 -0.20 121.20 128.21 2wvz s ILE 181 Ca 0.06 -0.75 0.05 0.00 0.00 0.00 0.00 60.65 60.00 2wvz s ILE 181 Cb -0.09 -1.21 -0.06 0.00 0.01 0.00 0.00 42.46 41.11 2wvz s ILE 181 CO 0.02 0.41 0.01 0.27 0.00 0.00 0.00 174.94 175.65 2wvz s ILE 182 N -0.22 1.34 0.00 2.92 -4.36 -0.11 -1.00 121.20 119.77 2wvz s ILE 182 Ca 0.02 -2.04 0.00 0.00 -0.26 0.00 0.00 60.65 58.37 2wvz s ILE 182 Cb -0.09 -2.63 0.00 0.00 1.25 0.00 0.00 42.46 40.99 2wvz s ILE 182 CO 0.01 -0.14 0.00 0.61 0.24 0.00 0.00 174.94 175.65 2wvz n GLY 183 N -0.62 -1.04 3.06 6.27 0.00 -0.39 -0.63 105.19 111.83 2wvz n GLY 183 Ca -0.04 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 44.88 2wvz n GLY 183 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2wvz s TYR 184 N -2.00 0.23 0.07 1.61 -0.85 -0.55 -0.87 117.35 114.99 2wvz s TYR 184 Ca 0.00 -0.52 0.10 0.00 -0.52 0.00 0.00 57.07 56.13 2wvz s TYR 184 Cb 0.00 -0.17 -0.03 0.00 0.38 0.00 0.00 41.96 42.13 2wvz s TYR 184 CO 0.00 -0.29 -0.26 -0.08 -1.52 0.00 0.00 175.55 173.40 2wvz s THR 185 N -2.12 2.16 0.00 -3.49 -1.32 -0.58 -0.96 115.64 109.34 2wvz s THR 185 Ca -0.09 -1.50 0.00 0.00 -1.21 0.00 0.00 61.69 58.88 2wvz s THR 185 Cb -0.05 -1.87 0.00 0.00 -1.51 0.00 0.00 72.50 69.07 2wvz s THR 185 CO -0.03 0.28 0.00 0.35 -2.21 0.00 0.00 174.62 173.01 2wvz n THR 186 N 1.51 0.00 -1.65 5.08 -2.24 -1.24 -1.31 114.28 114.43 2wvz n THR 186 Ca -0.17 -0.08 -0.58 0.00 -2.27 0.00 0.00 64.05 60.95 2wvz n THR 186 Cb 0.52 0.48 -0.07 0.00 -2.10 0.00 0.00 70.33 69.16 2wvz n THR 186 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2wvz n ARG 187 N -0.87 0.77 -3.85 -0.78 0.63 -1.23 -4.78 116.66 106.54 2wvz n ARG 187 Ca 0.00 0.28 -0.09 0.00 -0.92 0.00 0.00 57.85 57.11 2wvz n ARG 187 Cb 0.00 -1.89 -0.05 0.00 0.45 0.00 0.00 32.46 30.97 2wvz n ARG 187 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2wvz s ASN 188 N 1.95 -0.14 -0.31 6.15 4.22 -1.26 -3.67 114.94 121.89 2wvz s ASN 188 Ca 0.94 -0.67 0.09 0.00 -2.14 0.00 0.00 52.86 51.08 2wvz s ASN 188 Cb -1.14 0.53 0.56 0.00 1.28 0.00 0.00 41.25 42.48 2wvz s ASN 188 CO 0.61 -1.02 1.57 -1.20 -2.04 0.00 0.00 177.10 175.03 2wvz n SER 189 N -0.31 3.08 0.00 3.54 7.64 -1.10 -4.96 113.62 121.51 2wvz n SER 189 Ca -0.08 -3.61 0.00 0.00 1.01 0.00 0.00 58.87 56.20 2wvz n SER 189 Cb 0.62 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 63.15 2wvz n SER 189 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wvz n GLY 190 N -0.98 0.81 1.96 0.23 0.00 -1.26 -5.00 105.19 100.95 2wvz n GLY 190 Ca 0.38 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.38 2wvz n GLY 190 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvz n GLY 191 N 1.04 0.39 3.22 -0.02 0.00 -1.26 -4.41 105.19 104.16 2wvz n GLY 191 Ca 0.00 -1.03 -0.23 0.00 0.00 0.00 0.00 46.02 44.75 2wvz n GLY 191 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wvz s VAL 192 N -2.00 1.48 0.89 1.61 -7.23 -1.26 -0.22 120.40 113.67 2wvz s VAL 192 Ca 0.00 -1.17 -0.11 0.00 -1.81 0.00 0.00 61.98 58.89 2wvz s VAL 192 Cb 0.00 -1.31 0.13 0.00 0.56 0.00 0.00 36.38 35.76 2wvz s VAL 192 CO 0.00 0.10 1.09 -2.84 -0.31 0.00 0.00 175.10 173.15 2wvz s PRO 193 N -1.25 1.27 0.43 4.82 0.02 -1.25 -4.92 135.00 134.12 2wvz s PRO 193 Ca 0.05 1.00 0.14 0.00 0.02 0.00 0.00 61.00 62.21 2wvz s PRO 193 Cb -0.09 -1.80 0.94 0.00 0.02 0.00 0.00 34.50 33.58 2wvz s PRO 193 CO 0.02 -2.28 1.96 0.93 -0.33 0.00 0.00 177.00 177.30 2wvz h GLU 194 N -1.59 0.02 -0.47 5.54 5.08 -1.97 -1.72 114.58 119.47 2wvz h GLU 194 Ca -0.48 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2wvz h GLU 194 Cb 1.27 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2wvz h GLU 194 CO 0.52 0.22 0.00 0.27 -1.00 0.00 0.00 179.01 179.02 2wvz n ASN 195 N -4.29 1.94 -4.68 1.42 6.94 -1.26 -4.97 115.26 110.37 2wvz n ASN 195 Ca -0.02 -2.12 -0.43 0.00 -0.02 0.00 0.00 54.58 51.99 2wvz n ASN 195 Cb 0.27 -0.32 -0.03 0.00 -2.36 0.00 0.00 39.78 37.34 2wvz n ASN 195 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 2wvz n PHE 196 N 0.30 2.53 -3.75 -2.53 7.35 -0.65 -4.99 117.46 115.71 2wvz n PHE 196 Ca 0.10 -0.17 -0.13 0.00 -0.76 0.00 0.00 57.45 56.49 2wvz n PHE 196 Cb 0.36 -2.73 -0.10 0.00 0.35 0.00 0.00 39.48 37.36 2wvz n PHE 196 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 2wvz s LYS 197 N 3.32 0.45 -0.35 -4.13 1.02 -1.26 -4.77 119.74 114.01 2wvz s LYS 197 Ca 0.85 0.39 -0.12 0.00 0.02 0.00 0.00 55.97 57.11 2wvz s LYS 197 Cb -0.51 0.21 0.00 0.00 -0.52 0.00 0.00 37.83 37.01 2wvz s LYS 197 CO 0.41 -0.07 0.22 1.21 -0.92 0.00 0.00 175.35 176.20 2wvz s ASN 198 N -0.03 5.87 -0.24 2.83 3.84 -0.43 -4.56 114.94 122.22 2wvz s ASN 198 Ca -0.02 -0.65 -0.19 0.00 0.21 0.00 0.00 52.86 52.21 2wvz s ASN 198 Cb -0.03 -2.08 -0.03 0.00 -0.55 0.00 0.00 41.25 38.56 2wvz s ASN 198 CO 0.01 -0.29 0.55 -0.31 -2.79 0.00 0.00 177.10 174.27 2wvz s TYR 199 N 1.65 3.30 0.06 0.43 1.51 0.26 -1.52 117.35 123.04 2wvz s TYR 199 Ca 0.05 0.73 0.07 0.00 -1.01 0.00 0.00 57.07 56.91 2wvz s TYR 199 Cb -0.18 -2.75 -0.03 0.00 -0.11 0.00 0.00 41.96 38.90 2wvz s TYR 199 CO 0.09 -0.25 -0.19 -0.59 -1.11 0.00 0.00 175.55 173.50 2wvz s PHE 200 N 2.20 1.61 0.04 2.71 -0.12 -0.05 -1.38 117.98 122.99 2wvz s PHE 200 Ca 0.24 -0.39 0.08 0.00 -0.05 0.00 0.00 56.93 56.80 2wvz s PHE 200 Cb -0.16 -0.93 -0.03 0.00 -0.63 0.00 0.00 43.02 41.28 2wvz s PHE 200 CO 0.09 0.11 -0.22 0.42 -0.05 0.00 0.00 175.22 175.57 2wvz s ILE 201 N -0.98 1.77 -0.09 -4.49 1.01 -0.33 -1.26 121.20 116.82 2wvz s ILE 201 Ca 0.05 -1.22 -0.02 0.00 0.00 0.00 0.00 60.65 59.45 2wvz s ILE 201 Cb -0.09 -1.53 0.04 0.00 0.01 0.00 0.00 42.46 40.89 2wvz s ILE 201 CO 0.03 0.26 0.04 -0.63 0.00 0.00 0.00 174.94 174.64 2wvz s ILE 202 N -0.78 0.13 -0.18 2.92 1.01 -0.17 -1.95 121.20 122.18 2wvz s ILE 202 Ca 0.08 0.12 -0.04 0.00 0.00 0.00 0.00 60.65 60.82 2wvz s ILE 202 Cb -0.09 -0.45 -0.02 0.00 0.01 0.00 0.00 42.46 41.91 2wvz s ILE 202 CO 0.02 0.09 -0.04 -1.61 0.00 0.00 0.00 174.94 173.40 2wvz s GLU 203 N 2.06 3.57 0.19 2.79 2.02 0.44 -0.88 118.70 128.89 2wvz s GLU 203 Ca 0.04 -0.56 0.01 0.00 0.02 0.00 0.00 54.97 54.48 2wvz s GLU 203 Cb -0.13 -2.95 -0.04 0.00 0.10 0.00 0.00 34.13 31.11 2wvz s GLU 203 CO -0.05 0.10 0.35 -0.06 0.02 0.00 0.00 175.26 175.61 2wvz s PHE 204 N 0.74 3.48 -1.38 1.61 0.40 -0.27 -0.59 117.98 121.97 2wvz s PHE 204 Ca -0.02 0.21 0.17 0.00 -0.60 0.00 0.00 56.93 56.70 2wvz s PHE 204 Cb -0.14 -1.75 0.64 0.00 0.51 0.00 0.00 43.02 42.28 2wvz s PHE 204 CO 0.02 0.44 1.54 -0.40 0.70 0.00 0.00 175.22 177.51 2wvz n ASP 205 N -0.71 4.18 -3.93 1.36 5.75 -0.90 -4.81 116.55 117.50 2wvz n ASP 205 Ca -0.06 -2.31 -0.18 0.00 -0.01 0.00 0.00 54.79 52.23 2wvz n ASP 205 Cb 0.54 -0.53 -0.16 0.00 -1.03 0.00 0.00 41.12 39.95 2wvz n ASP 205 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2wvz s LYS 206 N -1.66 0.68 0.60 0.11 2.20 -1.26 -4.97 119.74 115.44 2wvz s LYS 206 Ca 0.46 -0.15 -0.19 0.00 -0.36 0.00 0.00 55.97 55.73 2wvz s LYS 206 Cb 0.28 -0.68 -0.03 0.00 -1.51 0.00 0.00 37.83 35.89 2wvz s LYS 206 CO 0.24 0.01 1.23 -2.14 -0.36 0.00 0.00 175.35 174.34 2wvz s PRO 207 N 0.47 2.91 0.11 4.03 0.02 -1.26 -4.92 135.00 136.36 2wvz s PRO 207 Ca -0.06 1.90 -0.28 0.00 0.02 0.00 0.00 61.00 62.58 2wvz s PRO 207 Cb -0.10 -1.94 -0.06 0.00 0.02 0.00 0.00 34.50 32.42 2wvz s PRO 207 CO -0.00 -1.27 0.88 -0.06 -0.33 0.00 0.00 177.00 176.21 2wvz s PHE 208 N -1.53 3.82 -0.91 6.54 0.08 -1.26 -4.86 117.98 119.85 2wvz s PHE 208 Ca 0.78 1.69 0.12 0.00 0.12 0.00 0.00 56.93 59.64 2wvz s PHE 208 Cb -0.32 -2.94 -0.04 0.00 -0.57 0.00 0.00 43.02 39.15 2wvz s PHE 208 CO 0.35 0.29 0.63 2.41 -0.10 0.00 0.00 175.22 178.80 2wvz n THR 209 N 2.52 0.00 -3.75 0.64 -1.04 0.77 -4.92 114.28 108.50 2wvz n THR 209 Ca -0.01 -0.34 -0.13 0.00 -2.04 0.00 0.00 64.05 61.54 2wvz n THR 209 Cb 0.49 1.10 -0.11 0.00 -1.82 0.00 0.00 70.33 69.99 2wvz n THR 209 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2wvz s TYR 210 N -1.68 -0.39 -0.19 -1.42 6.14 -0.99 -4.92 117.35 113.91 2wvz s TYR 210 Ca 0.08 0.95 -0.14 0.00 0.64 0.00 0.00 57.07 58.60 2wvz s TYR 210 Cb 0.09 0.13 0.05 0.00 0.42 0.00 0.00 41.96 42.66 2wvz s TYR 210 CO 0.35 -0.19 0.48 -1.59 0.64 0.00 0.00 175.55 175.23 2wvz s LYS 211 N 0.20 0.52 -0.20 4.97 -2.85 -1.26 -2.27 119.74 118.85 2wvz s LYS 211 Ca -0.00 0.77 -0.19 0.00 -1.00 0.00 0.00 55.97 55.55 2wvz s LYS 211 Cb -0.03 0.15 0.05 0.00 -2.06 0.00 0.00 37.83 35.95 2wvz s LYS 211 CO 0.00 -0.11 0.53 0.00 0.10 0.00 0.00 175.35 175.88 2wvz s ALA 212 N 0.80 -1.31 0.33 0.59 0.00 -0.66 0.14 121.76 121.64 2wvz s ALA 212 Ca -0.04 1.49 0.04 0.00 0.00 0.00 0.00 51.96 53.44 2wvz s ALA 212 Cb -0.05 -0.85 -0.02 0.00 0.00 0.00 0.00 23.12 22.19 2wvz s ALA 212 CO -0.06 -0.25 0.49 0.95 0.00 0.00 0.00 175.76 176.88 2wvz s THR 213 N 0.25 4.69 -0.01 0.00 -4.23 -0.92 -0.67 115.64 114.76 2wvz s THR 213 Ca -0.00 -0.78 0.05 0.00 -1.18 0.00 0.00 61.69 59.78 2wvz s THR 213 Cb -0.04 -3.68 -0.03 0.00 1.34 0.00 0.00 72.50 70.10 2wvz s THR 213 CO 0.01 -0.34 -0.15 -0.69 -0.54 0.00 0.00 174.62 172.91 2wvz s VAL 214 N -2.21 3.01 -0.15 2.29 1.01 0.10 -0.30 120.40 124.14 2wvz s VAL 214 Ca 0.41 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.45 2wvz s VAL 214 Cb -0.09 -2.22 0.05 0.00 0.00 0.00 0.00 36.38 34.11 2wvz s VAL 214 CO 0.33 0.47 0.03 -0.70 0.00 0.00 0.00 175.10 175.23 2wvz s GLU 215 N -1.07 0.55 -1.32 2.72 -6.30 0.13 -2.70 118.70 110.72 2wvz s GLU 215 Ca 0.13 -0.20 -0.23 0.00 -2.50 0.00 0.00 54.97 52.18 2wvz s GLU 215 Cb -0.11 -1.69 0.03 0.00 0.00 0.00 0.00 34.13 32.36 2wvz s GLU 215 CO 0.03 -0.53 0.48 0.09 0.02 0.00 0.00 175.26 175.35 2wvz n ASN 216 N 5.12 -2.58 0.00 -1.70 5.03 -1.09 -0.54 115.26 119.50 2wvz n ASN 216 Ca -0.08 -1.27 0.00 0.00 0.87 0.00 0.00 54.58 54.10 2wvz n ASN 216 Cb 0.48 -1.78 0.00 0.00 -1.02 0.00 0.00 39.78 37.46 2wvz n ASN 216 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2wvz n GLY 217 N -2.22 3.14 3.69 7.41 0.00 -1.26 -5.02 105.19 110.93 2wvz n GLY 217 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 2wvz n GLY 217 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wvz s ASN 218 N -0.74 7.09 -0.21 1.61 0.01 0.30 -4.90 114.94 118.10 2wvz s ASN 218 Ca 0.00 1.33 -0.27 0.00 -0.71 0.00 0.00 52.86 53.21 2wvz s ASN 218 Cb 0.00 -2.48 -0.00 0.00 0.41 0.00 0.00 41.25 39.18 2wvz s ASN 218 CO 0.00 -0.30 0.94 -0.22 -1.51 0.00 0.00 177.10 176.01 2wvz s LEU 219 N 1.53 4.12 -0.70 0.60 2.96 -1.26 -0.69 118.68 125.24 2wvz s LEU 219 Ca 0.42 1.25 0.02 0.00 -0.22 0.00 0.00 54.13 55.61 2wvz s LEU 219 Cb -0.18 -3.38 0.17 0.00 0.50 0.00 0.00 46.19 43.30 2wvz s LEU 219 CO 0.18 -0.56 0.50 -1.10 -1.32 0.00 0.00 176.35 174.05 2wvz s GLN 220 N 2.83 2.55 0.25 1.98 -1.52 0.58 -4.99 119.66 121.34 2wvz s GLN 220 Ca 0.41 -3.07 -0.31 0.00 -1.95 0.00 0.00 55.36 50.43 2wvz s GLN 220 Cb -0.16 -3.56 -0.12 0.00 -0.22 0.00 0.00 33.01 28.95 2wvz s GLN 220 CO 0.08 -1.23 1.63 -1.91 -0.25 0.00 0.00 175.29 173.62 2wvz n GLU 221 N 2.49 2.67 -1.54 2.91 2.13 -1.26 -2.17 120.64 125.87 2wvz n GLU 221 Ca 0.15 0.95 -0.18 0.00 0.66 0.00 0.00 57.16 58.75 2wvz n GLU 221 Cb 0.35 -2.75 -0.08 0.00 0.27 0.00 0.00 31.44 29.23 2wvz n GLU 221 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2wvz n ASN 222 N 2.91 -5.17 -4.56 4.31 3.02 0.12 -4.92 115.26 110.97 2wvz n ASN 222 Ca 0.12 0.44 -0.40 0.00 -0.03 0.00 0.00 54.58 54.71 2wvz n ASN 222 Cb 0.35 -4.25 -0.09 0.00 -0.61 0.00 0.00 39.78 35.18 2wvz n ASN 222 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2wvz s VAL 223 N -2.67 5.18 0.41 2.41 1.01 -0.96 -5.01 120.40 120.77 2wvz s VAL 223 Ca 0.00 0.17 0.09 0.00 0.00 0.00 0.00 61.98 62.24 2wvz s VAL 223 Cb 0.00 -3.77 0.21 0.00 0.00 0.00 0.00 36.38 32.82 2wvz s VAL 223 CO 0.00 -0.01 2.00 0.00 0.00 0.00 0.00 175.10 177.09 2wvz h ALA 224 N 8.40 1.63 -2.36 5.51 0.00 -1.89 -3.27 119.26 127.28 2wvz h ALA 224 Ca -0.31 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 2wvz h ALA 224 Cb 1.15 -0.11 -0.17 0.00 0.00 0.00 0.00 17.79 18.66 2wvz h ALA 224 CO 0.67 0.28 0.04 -1.83 0.00 0.00 0.00 179.25 178.42 2wvz s GLU 225 N -5.09 1.00 -0.00 0.00 -1.05 -1.26 -0.60 118.70 111.69 2wvz s GLU 225 Ca -0.07 -0.08 0.01 0.00 -0.15 0.00 0.00 54.97 54.68 2wvz s GLU 225 Cb 0.16 0.46 0.00 0.00 -0.44 0.00 0.00 34.13 34.31 2wvz s GLU 225 CO 0.73 -0.34 -0.02 -0.65 0.95 0.00 0.00 175.26 175.93 2wvz s GLN 226 N -1.93 0.18 -0.26 -4.83 -1.52 -0.35 -5.01 119.66 105.94 2wvz s GLN 226 Ca -0.08 -0.06 0.02 0.00 -1.95 0.00 0.00 55.36 53.29 2wvz s GLN 226 Cb -0.01 -0.20 0.06 0.00 -0.22 0.00 0.00 33.01 32.65 2wvz s GLN 226 CO 0.02 0.03 -0.08 0.99 -0.25 0.00 0.00 175.29 176.00 2wvz s THR 227 N 0.06 1.93 0.35 -0.19 2.01 -1.26 -1.74 115.64 116.80 2wvz s THR 227 Ca -0.00 -1.53 -0.16 0.00 0.31 0.00 0.00 61.69 60.31 2wvz s THR 227 Cb -0.02 -2.12 0.04 0.00 0.01 0.00 0.00 72.50 70.41 2wvz s THR 227 CO -0.00 -0.10 0.74 0.28 -0.69 0.00 0.00 174.62 174.85 2wvz s THR 228 N 1.20 0.00 0.16 -0.82 -1.32 -1.14 -5.02 115.64 108.70 2wvz s THR 228 Ca -0.07 -1.06 -0.18 0.00 -1.21 0.00 0.00 61.69 59.17 2wvz s THR 228 Cb -0.20 -2.63 0.08 0.00 -1.51 0.00 0.00 72.50 68.24 2wvz s THR 228 CO -0.06 0.00 1.65 -0.78 -2.21 0.00 0.00 174.62 173.23 2wvz h ASP 229 N 2.02 -0.50 -3.40 8.08 3.58 -1.94 -1.25 116.42 123.01 2wvz h ASP 229 Ca -0.29 0.13 -0.61 0.00 0.42 0.00 0.00 57.03 56.69 2wvz h ASP 229 Cb 1.25 0.29 -0.40 0.00 1.72 0.00 0.00 39.33 42.19 2wvz h ASP 229 CO 0.36 -0.18 -0.75 -2.28 -2.88 0.00 0.00 179.24 173.52 2wvz s HIS 230 N -6.18 1.85 0.39 0.28 2.46 -1.26 0.22 115.29 113.05 2wvz s HIS 230 Ca -0.14 -2.31 -0.13 0.00 0.47 0.00 0.00 55.06 52.95 2wvz s HIS 230 Cb 0.14 -1.79 -0.08 0.00 -0.13 0.00 0.00 32.58 30.72 2wvz s HIS 230 CO 0.70 -0.79 0.79 0.00 -2.47 0.00 0.00 174.74 172.97 2wvz s ALA 231 N 0.51 3.29 0.28 1.58 0.00 -1.24 -2.67 121.76 123.51 2wvz s ALA 231 Ca 0.17 -0.05 -0.18 0.00 0.00 0.00 0.00 51.96 51.90 2wvz s ALA 231 Cb -0.24 -2.80 0.02 0.00 0.00 0.00 0.00 23.12 20.10 2wvz s ALA 231 CO -0.01 0.08 0.65 0.20 0.00 0.00 0.00 175.76 176.68 2wvz s GLY 232 N -2.82 0.16 -0.16 0.00 0.00 -1.10 -1.93 107.32 101.48 2wvz s GLY 232 Ca 0.54 -0.54 -0.24 0.00 0.00 0.00 0.00 44.72 44.48 2wvz s GLY 232 CO 0.26 -0.28 0.62 0.00 0.00 0.00 0.00 173.10 173.70 2wvz s ALA 233 N -3.78 -1.55 -0.05 3.20 0.00 -0.89 0.03 121.76 118.72 2wvz s ALA 233 Ca 0.15 1.50 -0.01 0.00 0.00 0.00 0.00 51.96 53.60 2wvz s ALA 233 Cb -0.04 -0.61 0.03 0.00 0.00 0.00 0.00 23.12 22.49 2wvz s ALA 233 CO 0.08 -0.32 0.02 0.42 0.00 0.00 0.00 175.76 175.97 2wvz s ILE 234 N -0.29 0.14 0.16 0.00 1.01 0.16 -1.12 121.20 121.25 2wvz s ILE 234 Ca -0.05 0.22 0.09 0.00 0.00 0.00 0.00 60.65 60.91 2wvz s ILE 234 Cb -0.03 -0.31 -0.04 0.00 0.01 0.00 0.00 42.46 42.08 2wvz s ILE 234 CO 0.04 0.19 -0.20 0.27 0.00 0.00 0.00 174.94 175.24 2wvz s ILE 235 N 1.73 1.91 0.17 2.92 -5.25 -0.83 -1.66 121.20 120.19 2wvz s ILE 235 Ca 0.00 -1.85 -0.08 0.00 -0.99 0.00 0.00 60.65 57.72 2wvz s ILE 235 Cb -0.13 -1.84 0.03 0.00 2.95 0.00 0.00 42.46 43.48 2wvz s ILE 235 CO -0.03 -0.21 0.43 0.61 -1.79 0.00 0.00 174.94 173.95 2wvz n GLY 236 N 0.48 1.33 3.83 6.27 0.00 -0.96 0.29 105.19 116.42 2wvz n GLY 236 Ca -0.15 -1.11 0.02 0.00 0.00 0.00 0.00 46.02 44.79 2wvz n GLY 236 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2wvz s PHE 237 N -5.14 0.00 0.21 1.61 -0.00 -0.31 -0.16 117.98 114.20 2wvz s PHE 237 Ca 0.09 -0.14 -0.30 0.00 -0.00 0.00 0.00 56.93 56.58 2wvz s PHE 237 Cb -0.02 0.57 -0.08 0.00 -0.00 0.00 0.00 43.02 43.49 2wvz s PHE 237 CO 0.05 -0.34 1.01 0.15 -0.00 0.00 0.00 175.22 176.08 2wvz s LYS 238 N -2.21 4.74 0.00 1.99 1.02 -1.25 -2.43 119.74 121.60 2wvz s LYS 238 Ca 0.23 1.59 0.05 0.00 0.02 0.00 0.00 55.97 57.85 2wvz s LYS 238 Cb 0.01 -3.28 -0.01 0.00 -0.52 0.00 0.00 37.83 34.03 2wvz s LYS 238 CO -0.01 0.32 -0.16 0.95 -0.92 0.00 0.00 175.35 175.53 2wvz s THR 239 N -0.78 1.24 0.34 2.17 -4.23 0.27 -5.00 115.64 109.65 2wvz s THR 239 Ca 0.44 -0.76 -0.00 0.00 -1.18 0.00 0.00 61.69 60.19 2wvz s THR 239 Cb -0.27 -1.05 -0.04 0.00 1.34 0.00 0.00 72.50 72.48 2wvz s THR 239 CO 0.34 0.28 0.56 0.00 -0.54 0.00 0.00 174.62 175.26 2wvz s ARG 240 N -0.56 3.50 -0.31 3.99 1.70 -1.26 -0.41 118.95 125.61 2wvz s ARG 240 Ca 0.05 -0.27 -0.40 0.00 -0.47 0.00 0.00 55.73 54.64 2wvz s ARG 240 Cb -0.06 -2.65 -0.16 0.00 -0.57 0.00 0.00 34.95 31.51 2wvz s ARG 240 CO -0.00 0.14 1.79 1.17 -1.08 0.00 0.00 175.30 177.32 2wvz n LYS 241 N -1.69 1.04 -0.75 3.89 4.81 -1.26 -1.60 118.16 122.60 2wvz n LYS 241 Ca -0.04 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 57.77 2wvz n LYS 241 Cb 0.56 -2.08 0.00 0.00 0.02 0.00 0.00 35.03 33.53 2wvz n LYS 241 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2wvz n GLY 242 N 4.52 0.65 3.71 3.14 0.00 0.71 -4.87 105.19 113.05 2wvz n GLY 242 Ca 0.29 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 2wvz n GLY 242 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wvz s GLU 243 N -1.54 4.53 -0.29 1.61 2.12 -0.63 -4.78 118.70 119.72 2wvz s GLU 243 Ca 0.00 1.37 -0.11 0.00 0.36 0.00 0.00 54.97 56.59 2wvz s GLU 243 Cb 0.00 -3.47 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 2wvz s GLU 243 CO 0.00 -0.07 0.18 -0.65 -0.54 0.00 0.00 175.26 174.18 2wvz s GLN 244 N 1.10 3.80 -0.18 4.30 -0.21 -1.26 -0.48 119.66 126.74 2wvz s GLN 244 Ca 0.50 -0.42 -0.06 0.00 0.02 0.00 0.00 55.36 55.41 2wvz s GLN 244 Cb -0.20 -3.62 -0.03 0.00 1.00 0.00 0.00 33.01 30.15 2wvz s GLN 244 CO 0.26 -0.23 0.02 0.08 -2.12 0.00 0.00 175.29 173.30 2wvz s VAL 245 N 1.72 4.35 -0.04 1.09 1.01 0.29 -4.94 120.40 123.88 2wvz s VAL 245 Ca 0.07 -0.19 -0.00 0.00 0.00 0.00 0.00 61.98 61.86 2wvz s VAL 245 Cb -0.16 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 2wvz s VAL 245 CO 0.09 0.45 0.01 0.20 0.00 0.00 0.00 175.10 175.85 2wvz s ASN 246 N 0.58 5.21 -0.15 3.32 0.01 -1.26 0.23 114.94 122.87 2wvz s ASN 246 Ca 0.01 0.08 0.01 0.00 -0.71 0.00 0.00 52.86 52.25 2wvz s ASN 246 Cb -0.14 -1.42 0.02 0.00 0.41 0.00 0.00 41.25 40.12 2wvz s ASN 246 CO 0.02 0.33 -0.18 0.00 -1.51 0.00 0.00 177.10 175.76 2wvz s ALA 247 N -0.99 2.06 -0.16 0.60 0.00 -0.38 -2.12 121.76 120.77 2wvz s ALA 247 Ca 0.17 -1.02 -0.20 0.00 0.00 0.00 0.00 51.96 50.91 2wvz s ALA 247 Cb -0.11 -1.05 -0.03 0.00 0.00 0.00 0.00 23.12 21.92 2wvz s ALA 247 CO 0.07 -0.26 0.57 1.03 0.00 0.00 0.00 175.76 177.16 2wvz s ARG 248 N 1.22 4.26 -0.02 0.00 0.52 0.24 -1.05 118.95 124.12 2wvz s ARG 248 Ca 0.01 0.55 0.04 0.00 -0.52 0.00 0.00 55.73 55.81 2wvz s ARG 248 Cb -0.14 -3.52 -0.01 0.00 0.52 0.00 0.00 34.95 31.80 2wvz s ARG 248 CO -0.08 -0.08 -0.15 0.42 0.02 0.00 0.00 175.30 175.43 2wvz s ILE 249 N 1.38 1.20 0.08 1.52 1.01 -0.52 -0.42 121.20 125.44 2wvz s ILE 249 Ca 0.28 -0.63 -0.09 0.00 0.00 0.00 0.00 60.65 60.21 2wvz s ILE 249 Cb -0.16 -1.02 0.00 0.00 0.01 0.00 0.00 42.46 41.30 2wvz s ILE 249 CO 0.11 0.35 0.19 0.00 0.00 0.00 0.00 174.94 175.59 2wvz s ALA 250 N -0.17 -0.27 0.25 9.38 0.00 -0.82 -0.56 121.76 129.56 2wvz s ALA 250 Ca 0.02 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.44 2wvz s ALA 250 Cb -0.08 0.43 -0.03 0.00 0.00 0.00 0.00 23.12 23.45 2wvz s ALA 250 CO 0.00 -0.47 0.27 -1.54 0.00 0.00 0.00 175.76 174.02 2wvz s SER 251 N -2.65 0.45 0.10 0.00 1.04 -1.17 -1.19 113.70 110.28 2wvz s SER 251 Ca 0.02 -1.37 -0.16 0.00 0.48 0.00 0.00 55.95 54.92 2wvz s SER 251 Cb 0.03 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.68 2wvz s SER 251 CO -0.09 -1.00 0.39 -0.55 0.98 0.00 0.00 173.24 172.97 2wvz s SER 252 N -3.18 -0.23 0.00 7.02 0.15 -0.48 -4.71 113.70 112.28 2wvz s SER 252 Ca 0.35 -0.23 0.22 0.00 0.70 0.00 0.00 55.95 56.98 2wvz s SER 252 Cb 0.04 0.45 0.15 0.00 -1.71 0.00 0.00 66.02 64.95 2wvz s SER 252 CO 0.15 -0.79 1.18 0.49 1.20 0.00 0.00 173.24 175.47 2wvz n PHE 253 N 0.01 0.00 -0.11 3.44 3.01 -1.26 -0.58 117.46 121.98 2wvz n PHE 253 Ca -0.17 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.08 2wvz n PHE 253 Cb 0.62 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 40.01 2wvz n PHE 253 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 2wvz n ILE 254 N 1.07 1.51 -3.60 4.37 5.41 -1.26 -4.75 119.36 122.11 2wvz n ILE 254 Ca 0.12 -0.11 0.02 0.00 1.00 0.00 0.00 62.75 63.78 2wvz n ILE 254 Cb 0.54 -2.07 -0.00 0.00 -0.71 0.00 0.00 39.64 37.40 2wvz n ILE 254 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 2wvz s SER 255 N -6.83 -0.04 0.18 4.38 1.04 -1.26 -4.99 113.70 106.17 2wvz s SER 255 Ca -0.31 -0.08 -0.11 0.00 0.48 0.00 0.00 55.95 55.93 2wvz s SER 255 Cb 0.09 0.11 0.08 0.00 0.10 0.00 0.00 66.02 66.40 2wvz s SER 255 CO 0.48 -0.20 1.73 -0.26 0.98 0.00 0.00 173.24 175.98 2wvz h PHE 256 N 2.00 0.96 -0.75 5.02 0.04 -1.94 -0.38 116.94 121.89 2wvz h PHE 256 Ca -0.29 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.39 2wvz h PHE 256 Cb 1.19 -0.29 -0.04 0.00 2.20 0.00 0.00 35.95 39.02 2wvz h PHE 256 CO 0.31 0.77 0.43 1.49 -0.60 0.00 0.00 178.31 180.71 2wvz h GLU 257 N 0.88 1.03 -0.13 1.51 4.81 -1.99 -0.14 114.58 120.55 2wvz h GLU 257 Ca 0.21 -0.10 -0.17 0.00 -0.13 0.00 0.00 59.36 59.17 2wvz h GLU 257 Cb 0.23 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 2wvz h GLU 257 CO -0.01 0.74 -0.63 0.37 -0.73 0.00 0.00 179.01 178.75 2wvz h GLN 258 N 1.04 0.45 -0.72 1.92 5.75 -1.89 -2.28 115.11 119.39 2wvz h GLN 258 Ca 0.27 -0.32 0.01 0.00 -0.15 0.00 0.00 58.65 58.46 2wvz h GLN 258 Cb -0.01 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.56 2wvz h GLN 258 CO -0.05 0.93 0.47 0.00 -2.65 0.00 0.00 178.83 177.54 2wvz h ALA 259 N 0.99 1.49 -0.36 3.38 0.00 -0.32 0.67 119.26 125.12 2wvz h ALA 259 Ca -0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2wvz h ALA 259 Cb 1.17 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2wvz h ALA 259 CO 0.11 0.47 -0.20 0.00 0.00 0.00 0.00 179.25 179.64 2wvz h ALA 260 N 1.55 0.99 -0.49 0.00 0.00 -0.78 -2.28 119.26 118.25 2wvz h ALA 260 Ca 0.26 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 2wvz h ALA 260 Cb -0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2wvz h ALA 260 CO -0.06 0.60 -0.12 0.00 0.00 0.00 0.00 179.25 179.67 2wvz h ALA 261 N 1.18 0.87 0.00 0.00 0.00 -0.78 -2.88 119.26 117.65 2wvz h ALA 261 Ca 0.09 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2wvz h ALA 261 Cb 0.67 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2wvz h ALA 261 CO 0.05 0.64 -0.13 -0.91 0.00 0.00 0.00 179.25 178.90 2wvz h ASN 262 N 0.81 0.00 0.77 0.00 2.35 -0.33 -1.93 115.58 117.25 2wvz h ASN 262 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2wvz h ASN 262 Cb 0.65 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.02 2wvz h ASN 262 CO 0.04 0.13 0.00 -0.03 -1.65 0.00 0.00 177.43 175.93 2wvz h MET 263 N 0.00 0.00 0.00 0.81 4.05 -1.23 -1.76 114.93 116.80 2wvz h MET 263 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2wvz h MET 263 Cb 0.32 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.12 2wvz h MET 263 CO 0.02 0.00 0.00 -0.91 0.23 0.00 0.00 176.91 176.25 2wvz h ASN 264 N 0.00 0.00 -1.25 1.39 -0.26 -1.46 -2.24 115.58 111.77 2wvz h ASN 264 Ca 0.00 0.00 0.36 0.00 -0.56 0.00 0.00 56.30 56.10 2wvz h ASN 264 Cb 0.38 0.00 -0.07 0.00 -1.06 0.00 0.00 38.32 37.57 2wvz h ASN 264 CO 0.00 0.00 0.87 -0.33 -1.06 0.00 0.00 177.43 176.91 2wvz h GLU 265 N 0.00 0.09 0.00 0.81 5.08 -1.49 0.99 114.58 120.06 2wvz h GLU 265 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2wvz h GLU 265 Cb 0.41 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2wvz h GLU 265 CO 0.00 0.06 0.00 1.28 -1.00 0.00 0.00 179.01 179.35 2wvz n LEU 266 N -4.31 0.16 0.00 1.33 4.77 -0.84 -4.99 117.00 113.12 2wvz n LEU 266 Ca 0.29 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.79 2wvz n LEU 266 Cb 1.27 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.88 2wvz n LEU 266 CO 0.35 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2wvz n GLY 267 N 1.09 2.38 0.41 -0.72 0.00 0.34 -2.59 105.19 106.10 2wvz n GLY 267 Ca 0.06 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 46.00 2wvz n GLY 267 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wvz n LYS 268 N 14.00 2.02 -1.96 1.61 4.76 -1.26 -4.99 118.16 132.34 2wvz n LYS 268 Ca 0.00 -2.65 -0.35 0.00 -2.87 0.00 0.00 58.31 52.44 2wvz n LYS 268 Cb 0.00 -1.62 0.04 0.00 -1.84 0.00 0.00 35.03 31.61 2wvz n LYS 268 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2wvz s ASP 269 N -2.41 5.14 0.58 4.39 1.01 -1.07 -5.08 116.67 119.24 2wvz s ASP 269 Ca 0.35 2.33 0.10 0.00 0.71 0.00 0.00 52.55 56.03 2wvz s ASP 269 Cb 0.29 -2.59 0.10 0.00 1.01 0.00 0.00 42.92 41.73 2wvz s ASP 269 CO 0.06 -1.62 0.80 -0.46 0.21 0.00 0.00 175.17 174.15 2wvz n ASN 270 N -1.75 2.13 -0.06 0.27 6.94 -1.26 -4.91 115.26 116.62 2wvz n ASN 270 Ca 0.13 -2.55 -0.10 0.00 -0.02 0.00 0.00 54.58 52.04 2wvz n ASN 270 Cb 0.50 -0.42 -0.04 0.00 -2.36 0.00 0.00 39.78 37.46 2wvz n ASN 270 CO 0.00 0.00 0.00 0.40 -1.03 0.00 0.00 177.26 176.63 2wvz h ILE 271 N 0.11 0.17 -0.89 1.53 1.08 -1.96 -1.80 117.51 115.75 2wvz h ILE 271 Ca -0.27 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.18 2wvz h ILE 271 Cb 1.25 0.17 -0.04 0.00 -3.07 0.00 0.00 36.82 35.13 2wvz h ILE 271 CO 0.39 0.00 0.51 -0.33 -0.69 0.00 0.00 178.15 178.03 2wvz h GLU 272 N -0.38 1.23 -0.25 2.37 3.07 -1.98 0.85 114.58 119.49 2wvz h GLU 272 Ca 0.12 -0.13 -0.15 0.00 -0.50 0.00 0.00 59.36 58.70 2wvz h GLU 272 Cb 0.59 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 2wvz h GLU 272 CO -0.47 0.88 -0.46 1.96 -1.40 0.00 0.00 179.01 179.51 2wvz h GLN 273 N 1.24 0.64 -0.09 2.33 4.20 -1.83 -2.71 115.11 118.89 2wvz h GLN 273 Ca 0.32 -0.36 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 2wvz h GLN 273 Cb -0.01 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 2wvz h GLN 273 CO -0.05 0.97 -0.12 -0.07 -0.67 0.00 0.00 178.83 178.88 2wvz h LEU 274 N 0.51 0.26 -0.83 1.46 3.38 -0.98 -2.65 115.31 116.47 2wvz h LEU 274 Ca 0.03 -0.51 0.20 0.00 0.09 0.00 0.00 57.88 57.69 2wvz h LEU 274 Cb 1.00 -0.08 -0.12 0.00 0.09 0.00 0.00 40.66 41.55 2wvz h LEU 274 CO 0.09 0.72 0.27 0.00 0.09 0.00 0.00 178.44 179.61 2wvz h ALA 275 N 0.55 1.20 -0.04 1.53 0.00 -0.86 0.16 119.26 121.80 2wvz h ALA 275 Ca 0.01 0.18 -0.18 0.00 0.00 0.00 0.00 54.91 54.92 2wvz h ALA 275 Cb 0.66 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2wvz h ALA 275 CO 0.03 -0.36 -0.77 0.37 0.00 0.00 0.00 179.25 178.51 2wvz h GLN 276 N 0.31 0.31 -0.24 0.00 5.75 -1.45 0.18 115.11 119.96 2wvz h GLN 276 Ca 0.50 -0.27 -0.11 0.00 -0.15 0.00 0.00 58.65 58.61 2wvz h GLN 276 Cb 0.92 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.52 2wvz h GLN 276 CO -0.55 0.94 -0.32 0.87 -2.65 0.00 0.00 178.83 177.11 2wvz h LYS 277 N 0.20 0.51 -0.39 1.69 1.57 -0.95 -0.55 116.57 118.66 2wvz h LYS 277 Ca -0.04 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 2wvz h LYS 277 Cb 1.35 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.63 2wvz h LYS 277 CO 0.13 0.77 0.19 0.78 -0.57 0.00 0.00 179.45 180.75 2wvz h GLY 278 N 1.05 0.60 1.35 3.86 0.00 -0.32 -0.87 103.07 108.74 2wvz h GLY 278 Ca 0.05 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 47.01 2wvz h GLY 278 CO 0.06 0.28 -0.03 1.70 0.00 0.00 0.00 176.54 178.55 2wvz h LYS 279 N 0.49 0.79 -0.46 4.80 3.64 -0.43 -1.87 116.57 123.52 2wvz h LYS 279 Ca 0.13 -0.23 -0.10 0.00 -1.27 0.00 0.00 60.65 59.19 2wvz h LYS 279 Cb 0.11 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2wvz h LYS 279 CO -0.02 0.82 -0.09 -0.44 -2.27 0.00 0.00 179.45 177.45 2wvz h ASP 280 N 0.73 0.88 -0.32 4.20 3.32 -1.01 -1.06 116.42 123.16 2wvz h ASP 280 Ca 0.14 -0.35 0.04 0.00 0.02 0.00 0.00 57.03 56.87 2wvz h ASP 280 Cb 0.49 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.77 2wvz h ASP 280 CO 0.02 1.03 0.09 0.00 -1.72 0.00 0.00 179.24 178.66 2wvz h ALA 281 N 0.88 0.35 -0.49 3.45 0.00 -0.61 0.16 119.26 123.00 2wvz h ALA 281 Ca 0.12 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2wvz h ALA 281 Cb 0.63 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2wvz h ALA 281 CO 0.04 -0.32 0.04 -1.49 0.00 0.00 0.00 179.25 177.53 2wvz h TRP 282 N 0.21 0.91 -0.05 0.00 4.06 -1.25 -2.52 115.95 117.30 2wvz h TRP 282 Ca 0.15 -0.14 -0.04 0.00 2.06 0.00 0.00 58.89 60.92 2wvz h TRP 282 Cb 0.14 -0.24 -0.01 0.00 -1.00 0.00 0.00 29.16 28.05 2wvz h TRP 282 CO -0.16 0.84 -0.14 -0.91 -3.56 0.00 0.00 178.44 174.52 2wvz h ASN 283 N 0.71 0.07 0.39 -3.49 -0.26 -0.94 0.11 115.58 112.17 2wvz h ASN 283 Ca 0.14 -0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.85 2wvz h ASN 283 Cb 0.45 -0.02 -0.00 0.00 -1.06 0.00 0.00 38.32 37.69 2wvz h ASN 283 CO 0.02 0.22 -0.13 -0.61 -1.06 0.00 0.00 177.43 175.87 2wvz h GLN 284 N 0.07 0.00 0.00 0.81 5.75 -0.51 -1.69 115.11 119.54 2wvz h GLN 284 Ca 0.01 0.00 -0.36 0.00 -0.15 0.00 0.00 58.65 58.15 2wvz h GLN 284 Cb 0.29 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.78 2wvz h GLN 284 CO 0.02 0.13 -2.32 1.33 -2.65 0.00 0.00 178.83 175.33 2wvz n VAL 285 N -3.64 1.32 0.04 2.39 0.24 -0.75 -4.43 118.33 113.50 2wvz n VAL 285 Ca -0.02 -0.46 0.04 0.00 -2.04 0.00 0.00 64.34 61.87 2wvz n VAL 285 Cb 0.25 -1.45 0.45 0.00 -1.47 0.00 0.00 33.84 31.63 2wvz n VAL 285 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2wvz h LEU 286 N -0.23 0.40 0.00 1.34 3.38 -0.88 -2.72 115.31 116.62 2wvz h LEU 286 Ca -0.54 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.42 2wvz h LEU 286 Cb 1.73 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.38 2wvz h LEU 286 CO -0.16 0.29 0.00 0.61 0.09 0.00 0.00 178.44 179.28 2wvz n GLY 287 N -1.48 -0.91 0.15 0.83 0.00 -0.63 -2.41 105.19 100.73 2wvz n GLY 287 Ca 0.02 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.05 2wvz n GLY 287 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wvz h LYS 288 N 0.00 0.00 -4.48 1.61 1.79 -1.69 -3.40 116.57 110.39 2wvz h LYS 288 Ca 0.00 0.00 -0.63 0.00 -2.18 0.00 0.00 60.65 57.84 2wvz h LYS 288 Cb 0.00 0.00 -0.38 0.00 -1.58 0.00 0.00 32.23 30.27 2wvz h LYS 288 CO 0.00 0.00 -0.79 0.42 -1.08 0.00 0.00 179.45 178.00 2wvz s ILE 289 N -3.17 1.71 -0.28 1.86 1.01 -1.01 -0.37 121.20 120.95 2wvz s ILE 289 Ca 0.09 -1.38 -0.10 0.00 0.00 0.00 0.00 60.65 59.26 2wvz s ILE 289 Cb 0.10 -1.95 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 2wvz s ILE 289 CO 0.60 -0.12 0.16 -1.61 0.00 0.00 0.00 174.94 173.98 2wvz s GLU 290 N 1.30 3.75 0.05 2.79 2.02 -0.30 -4.95 118.70 123.37 2wvz s GLU 290 Ca -0.06 -0.44 0.05 0.00 0.02 0.00 0.00 54.97 54.54 2wvz s GLU 290 Cb -0.19 -3.58 -0.04 0.00 0.10 0.00 0.00 34.13 30.42 2wvz s GLU 290 CO -0.06 -0.24 -0.07 0.14 0.02 0.00 0.00 175.26 175.04 2wvz s VAL 291 N 1.70 3.57 0.24 2.63 -7.23 -1.26 0.21 120.40 120.26 2wvz s VAL 291 Ca 0.06 -0.97 -0.07 0.00 -1.81 0.00 0.00 61.98 59.19 2wvz s VAL 291 Cb -0.16 -2.61 -0.02 0.00 0.56 0.00 0.00 36.38 34.15 2wvz s VAL 291 CO 0.09 0.27 0.33 -1.83 -0.31 0.00 0.00 175.10 173.65 2wvz s GLU 292 N -1.78 1.44 -0.21 4.82 -1.05 -0.04 -4.96 118.70 116.92 2wvz s GLU 292 Ca 0.19 -1.46 -0.00 0.00 -0.15 0.00 0.00 54.97 53.55 2wvz s GLU 292 Cb -0.11 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 33.96 2wvz s GLU 292 CO 0.11 -0.55 0.03 0.41 0.95 0.00 0.00 175.26 176.20 2wvz n GLY 293 N -0.36 0.37 1.62 -3.83 0.00 -1.26 -2.52 105.19 99.21 2wvz n GLY 293 Ca 0.00 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.19 2wvz n GLY 293 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvz n GLY 294 N -0.94 3.36 3.94 -0.02 0.00 -1.26 -3.36 105.19 106.92 2wvz n GLY 294 Ca -0.02 -1.74 -0.24 0.00 0.00 0.00 0.00 46.02 44.01 2wvz n GLY 294 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvz s ASN 295 N -2.16 5.08 0.43 1.61 2.20 -1.26 -4.89 114.94 115.95 2wvz s ASN 295 Ca 0.19 0.31 0.11 0.00 -0.94 0.00 0.00 52.86 52.53 2wvz s ASN 295 Cb 0.01 -1.09 0.92 0.00 -2.00 0.00 0.00 41.25 39.09 2wvz s ASN 295 CO 0.14 -1.36 2.01 0.25 -2.94 0.00 0.00 177.10 175.19 2wvz h LEU 296 N -0.30 0.22 -0.55 3.54 5.85 -2.02 -1.00 115.31 121.05 2wvz h LEU 296 Ca -0.44 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.27 2wvz h LEU 296 Cb 1.30 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 2wvz h LEU 296 CO 0.57 0.28 0.35 0.44 -0.34 0.00 0.00 178.44 179.74 2wvz h ASP 297 N 0.24 0.60 -0.21 1.25 3.32 -1.99 -1.22 116.42 118.40 2wvz h ASP 297 Ca 0.06 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.97 2wvz h ASP 297 Cb 0.18 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 2wvz h ASP 297 CO 0.00 0.43 -0.35 1.56 -1.72 0.00 0.00 179.24 179.16 2wvz h GLN 298 N 0.71 0.62 -0.61 3.56 4.20 -1.59 0.39 115.11 122.39 2wvz h GLN 298 Ca 0.21 -0.38 0.06 0.00 0.06 0.00 0.00 58.65 58.60 2wvz h GLN 298 Cb -0.04 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.72 2wvz h GLN 298 CO -0.06 0.99 0.31 1.88 -0.67 0.00 0.00 178.83 181.28 2wvz h TYR 299 N 0.31 0.57 -0.12 2.96 0.05 -1.15 0.33 116.97 119.92 2wvz h TYR 299 Ca 0.02 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.80 2wvz h TYR 299 Cb 0.94 -0.17 -0.00 0.00 1.01 0.00 0.00 36.73 38.51 2wvz h TYR 299 CO 0.09 0.26 -0.01 0.00 -1.05 0.00 0.00 178.16 177.45 2wvz h ARG 300 N 0.58 0.22 -0.86 4.88 3.08 -1.00 -0.06 114.38 121.22 2wvz h ARG 300 Ca 0.28 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 2wvz h ARG 300 Cb 0.20 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 2wvz h ARG 300 CO -0.19 0.47 0.48 1.15 -1.07 0.00 0.00 179.97 180.81 2wvz h THR 301 N -0.06 1.25 0.27 2.04 2.02 -0.72 0.67 112.91 118.38 2wvz h THR 301 Ca 0.03 -0.60 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 2wvz h THR 301 Cb 0.38 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 2wvz h THR 301 CO 0.01 0.27 -0.13 0.15 0.37 0.00 0.00 175.52 176.19 2wvz h PHE 302 N 1.19 -0.34 0.00 3.16 3.57 -0.13 -2.07 116.94 122.32 2wvz h PHE 302 Ca 0.30 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.73 2wvz h PHE 302 Cb 0.01 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 2wvz h PHE 302 CO 0.01 0.01 -0.30 1.88 -2.23 0.00 0.00 178.31 177.67 2wvz h TYR 303 N -0.75 0.00 -0.40 0.41 0.05 -0.97 0.28 116.97 115.59 2wvz h TYR 303 Ca -0.04 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.60 2wvz h TYR 303 Cb 0.50 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.23 2wvz h TYR 303 CO 0.03 0.30 -0.30 0.77 -1.05 0.00 0.00 178.16 177.92 2wvz h SER 304 N 0.00 0.96 -0.63 3.88 0.02 -0.87 -1.62 113.55 115.29 2wvz h SER 304 Ca -0.00 -0.44 -0.07 0.00 -0.84 0.00 0.00 61.79 60.44 2wvz h SER 304 Cb 0.74 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 2wvz h SER 304 CO 0.04 1.19 0.12 0.00 -1.14 0.00 0.00 176.83 177.04 2wvz h LEU 306 N 0.99 0.37 -0.60 0.00 5.85 -0.69 -2.14 115.31 119.08 2wvz h LEU 306 Ca 0.20 -0.14 0.11 0.00 0.84 0.00 0.00 57.88 58.89 2wvz h LEU 306 Cb 0.41 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.26 2wvz h LEU 306 CO 0.01 0.41 0.16 0.22 -0.34 0.00 0.00 178.44 178.90 2wvz h TYR 307 N 0.31 0.27 0.00 1.25 3.20 -1.21 -0.60 116.97 120.20 2wvz h TYR 307 Ca 0.10 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.00 2wvz h TYR 307 Cb 0.14 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.38 2wvz h TYR 307 CO -0.02 0.01 0.00 0.00 -1.64 0.00 0.00 178.16 176.52 2wvz h ARG 308 N 0.31 0.00 -0.09 1.82 2.47 -0.71 -1.58 114.38 116.60 2wvz h ARG 308 Ca 0.31 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.03 2wvz h ARG 308 Cb 0.45 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.77 2wvz h ARG 308 CO -0.37 0.00 0.00 0.43 0.56 0.00 0.00 179.97 180.59 2wvz n SER 309 N -2.76 1.72 -0.07 7.04 7.64 -0.24 -3.75 113.62 123.20 2wvz n SER 309 Ca -0.00 -1.63 0.04 0.00 1.01 0.00 0.00 58.87 58.29 2wvz n SER 309 Cb 0.18 -0.05 0.06 0.00 -1.01 0.00 0.00 64.21 63.39 2wvz n SER 309 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2wvz n LEU 310 N 0.34 1.82 -0.12 -3.43 4.77 -0.60 -4.72 117.00 115.06 2wvz n LEU 310 Ca 0.18 -2.23 -0.23 0.00 -0.03 0.00 0.00 56.01 53.70 2wvz n LEU 310 Cb 0.37 -0.19 -0.11 0.00 -2.33 0.00 0.00 43.42 41.16 2wvz n LEU 310 CO 0.15 0.53 -1.32 0.18 -1.33 0.00 0.00 177.39 175.60 2wvz n LEU 311 N -0.83 2.54 -4.23 2.23 4.77 -1.24 -0.80 117.00 119.45 2wvz n LEU 311 Ca 0.07 0.08 -0.25 0.00 -0.03 0.00 0.00 56.01 55.88 2wvz n LEU 311 Cb 0.48 -0.89 -0.15 0.00 -2.33 0.00 0.00 43.42 40.53 2wvz n LEU 311 CO 0.00 0.77 -0.52 -0.36 -1.33 0.00 0.00 177.39 175.96 2wvz s PHE 312 N -2.51 1.75 0.55 -1.77 0.40 -1.26 -3.89 117.98 111.24 2wvz s PHE 312 Ca -0.35 -0.36 -0.17 0.00 -0.60 0.00 0.00 56.93 55.45 2wvz s PHE 312 Cb 0.11 -1.07 -0.06 0.00 0.51 0.00 0.00 43.02 42.51 2wvz s PHE 312 CO 0.57 0.04 1.03 -1.25 0.70 0.00 0.00 175.22 176.32 2wvz s PRO 313 N -0.92 3.59 0.46 0.24 0.04 -1.26 -4.86 135.00 132.30 2wvz s PRO 313 Ca 0.07 1.17 -0.20 0.00 0.04 0.00 0.00 61.00 62.08 2wvz s PRO 313 Cb -0.08 -2.07 -0.10 0.00 0.04 0.00 0.00 34.50 32.29 2wvz s PRO 313 CO 0.01 -0.58 0.97 -0.98 0.04 0.00 0.00 177.00 176.46 2wvz s ARG 314 N -3.89 4.07 0.19 4.56 1.70 0.52 -4.74 118.95 121.37 2wvz s ARG 314 Ca 0.63 1.11 -0.33 0.00 -0.47 0.00 0.00 55.73 56.67 2wvz s ARG 314 Cb -0.14 -2.15 -0.14 0.00 -0.57 0.00 0.00 34.95 31.94 2wvz s ARG 314 CO 0.31 -0.17 1.46 1.63 -1.08 0.00 0.00 175.30 177.46 2wvz n LYS 315 N -0.96 1.95 -0.11 3.89 5.02 0.02 -2.00 118.16 125.97 2wvz n LYS 315 Ca 0.07 0.70 0.06 0.00 -2.02 0.00 0.00 58.31 57.12 2wvz n LYS 315 Cb 0.54 -2.39 0.08 0.00 -0.02 0.00 0.00 35.03 33.23 2wvz n LYS 315 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2wvz n PHE 316 N 2.60 0.00 -4.07 2.13 7.35 0.16 -3.96 117.46 121.68 2wvz n PHE 316 Ca 0.15 -0.67 -0.23 0.00 -0.76 0.00 0.00 57.45 55.93 2wvz n PHE 316 Cb 0.29 -0.10 -0.06 0.00 0.35 0.00 0.00 39.48 39.95 2wvz n PHE 316 CO 0.00 0.00 0.00 1.52 -0.76 0.00 0.00 176.76 177.52 2wvz s TYR 317 N -1.83 2.67 0.25 -5.13 -0.85 -1.17 -4.50 117.35 106.79 2wvz s TYR 317 Ca 0.18 -0.45 0.03 0.00 -0.52 0.00 0.00 57.07 56.31 2wvz s TYR 317 Cb 0.16 -1.76 -0.05 0.00 0.38 0.00 0.00 41.96 40.68 2wvz s TYR 317 CO 0.02 0.27 0.04 -1.21 -1.52 0.00 0.00 175.55 173.14 2wvz s GLU 318 N -3.88 1.38 -0.16 -3.49 2.02 0.11 -4.93 118.70 109.76 2wvz s GLU 318 Ca 0.39 -1.72 -0.09 0.00 0.02 0.00 0.00 54.97 53.57 2wvz s GLU 318 Cb -0.01 -0.50 -0.05 0.00 0.10 0.00 0.00 34.13 33.68 2wvz s GLU 318 CO 0.23 -0.18 0.15 -0.51 0.02 0.00 0.00 175.26 174.97 2wvz s LEU 319 N -3.32 4.30 0.00 1.80 1.02 -1.26 -0.10 118.68 121.11 2wvz s LEU 319 Ca 0.32 0.38 -0.04 0.00 0.02 0.00 0.00 54.13 54.81 2wvz s LEU 319 Cb 0.07 -2.11 0.11 0.00 0.02 0.00 0.00 46.19 44.28 2wvz s LEU 319 CO 0.11 0.28 0.70 -0.90 0.02 0.00 0.00 176.35 176.56 2wvz n ASP 320 N 2.78 0.53 0.16 2.29 5.68 0.84 -4.84 116.55 123.98 2wvz n ASP 320 Ca -0.17 -1.54 0.16 0.00 -0.50 0.00 0.00 54.79 52.73 2wvz n ASP 320 Cb 0.53 -0.49 0.75 0.00 -1.14 0.00 0.00 41.12 40.77 2wvz n ASP 320 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wvz h ALA 321 N -1.08 2.05 -0.60 2.12 0.00 -1.98 0.89 119.26 120.65 2wvz h ALA 321 Ca -0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2wvz h ALA 321 Cb 0.75 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2wvz h ALA 321 CO 0.21 -0.32 0.00 0.09 0.00 0.00 0.00 179.25 179.23 2wvz n ASN 322 N -4.15 4.76 -0.68 0.00 3.02 -1.26 -4.92 115.26 112.03 2wvz n ASN 322 Ca 0.03 -2.53 -0.08 0.00 -0.03 0.00 0.00 54.58 51.96 2wvz n ASN 322 Cb 0.34 -0.59 -0.03 0.00 -0.61 0.00 0.00 39.78 38.88 2wvz n ASN 322 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wvz n GLY 323 N 0.98 0.92 3.87 7.41 0.00 0.31 -5.02 105.19 113.66 2wvz n GLY 323 Ca 0.25 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 2wvz n GLY 323 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wvz s GLN 324 N -2.91 3.72 0.12 1.61 -1.52 -1.26 -4.76 119.66 114.66 2wvz s GLN 324 Ca 0.00 0.11 -0.31 0.00 -1.95 0.00 0.00 55.36 53.21 2wvz s GLN 324 Cb 0.00 -2.97 -0.07 0.00 -0.22 0.00 0.00 33.01 29.75 2wvz s GLN 324 CO 0.00 0.54 1.27 -1.25 -0.25 0.00 0.00 175.29 175.61 2wvz s PRO 325 N -2.06 4.40 0.24 2.91 0.04 -1.26 -0.12 135.00 139.16 2wvz s PRO 325 Ca 0.34 1.93 0.01 0.00 0.04 0.00 0.00 61.00 63.32 2wvz s PRO 325 Cb -0.13 -3.27 -0.04 0.00 0.04 0.00 0.00 34.50 31.09 2wvz s PRO 325 CO 0.19 -0.28 0.14 0.96 0.04 0.00 0.00 177.00 178.05 2wvz s ILE 326 N 0.71 0.19 -0.08 0.56 -4.36 0.85 -1.39 121.20 117.67 2wvz s ILE 326 Ca 0.59 -2.00 -0.31 0.00 -0.26 0.00 0.00 60.65 58.67 2wvz s ILE 326 Cb -0.33 -2.53 0.09 0.00 1.25 0.00 0.00 42.46 40.93 2wvz s ILE 326 CO 0.32 0.00 0.78 -1.38 0.24 0.00 0.00 174.94 174.90 2wvz s HIS 327 N -3.91 -0.57 -0.03 1.37 -3.43 -0.20 0.05 115.29 108.58 2wvz s HIS 327 Ca 0.38 0.99 -0.30 0.00 -0.80 0.00 0.00 55.06 55.33 2wvz s HIS 327 Cb 0.06 0.42 -0.03 0.00 -1.43 0.00 0.00 32.58 31.60 2wvz s HIS 327 CO 0.15 -0.53 1.08 -0.47 -2.00 0.00 0.00 174.74 172.97 2wvz s TYR 328 N -1.15 3.47 -0.19 0.38 5.04 -1.26 -0.53 117.35 123.11 2wvz s TYR 328 Ca -0.08 1.48 -0.27 0.00 -2.44 0.00 0.00 57.07 55.76 2wvz s TYR 328 Cb -0.00 -3.27 -0.01 0.00 0.35 0.00 0.00 41.96 39.03 2wvz s TYR 328 CO 0.07 -0.63 0.91 0.45 -1.34 0.00 0.00 175.55 175.02 2wvz s SER 329 N 1.15 7.01 0.00 4.32 0.15 0.36 -4.86 113.70 121.82 2wvz s SER 329 Ca 0.53 1.25 0.25 0.00 0.70 0.00 0.00 55.95 58.68 2wvz s SER 329 Cb -0.23 -2.49 1.50 0.00 -1.71 0.00 0.00 66.02 63.09 2wvz s SER 329 CO 0.24 -0.50 1.95 -0.81 1.20 0.00 0.00 173.24 175.32 2wvz n PRO 330 N 5.66 0.97 -0.12 5.44 -0.04 -1.26 -0.71 135.00 144.94 2wvz n PRO 330 Ca 0.07 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.33 2wvz n PRO 330 Cb 0.48 -1.41 -0.12 0.00 -0.04 0.00 0.00 33.50 32.41 2wvz n PRO 330 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2wvz n TYR 331 N -0.91 0.14 -0.02 0.54 4.01 -1.26 -3.93 117.16 115.74 2wvz n TYR 331 Ca 0.19 0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.96 2wvz n TYR 331 Cb 0.09 -1.02 0.00 0.00 -0.31 0.00 0.00 39.34 38.10 2wvz n TYR 331 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2wvz n ASN 332 N -3.50 0.10 0.00 7.72 0.23 -1.23 -4.85 115.26 113.74 2wvz n ASN 332 Ca -0.46 -0.48 0.00 0.00 -0.53 0.00 0.00 54.58 53.11 2wvz n ASN 332 Cb 0.97 0.72 0.00 0.00 -2.08 0.00 0.00 39.78 39.39 2wvz n ASN 332 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wvz n GLY 333 N 0.72 0.97 3.82 4.83 0.00 0.12 -4.99 105.19 110.67 2wvz n GLY 333 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2wvz n GLY 333 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wvz s GLN 334 N -0.28 1.53 -0.21 1.61 -0.21 -1.26 -4.67 119.66 116.17 2wvz s GLN 334 Ca 0.00 0.28 -0.05 0.00 0.02 0.00 0.00 55.36 55.61 2wvz s GLN 334 Cb 0.00 -1.89 -0.02 0.00 1.00 0.00 0.00 33.01 32.11 2wvz s GLN 334 CO 0.00 -1.93 -0.01 0.08 -2.12 0.00 0.00 175.29 171.31 2wvz s VAL 335 N -3.36 3.74 0.06 1.09 1.01 -1.26 -0.49 120.40 121.20 2wvz s VAL 335 Ca 0.63 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 62.26 2wvz s VAL 335 Cb -0.13 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 2wvz s VAL 335 CO 0.52 0.42 -0.10 -0.76 0.00 0.00 0.00 175.10 175.18 2wvz s LEU 336 N 1.21 2.29 0.67 3.92 1.43 0.32 -4.95 118.68 123.58 2wvz s LEU 336 Ca 0.03 -0.63 -0.12 0.00 -1.03 0.00 0.00 54.13 52.38 2wvz s LEU 336 Cb -0.15 -0.28 -0.00 0.00 0.03 0.00 0.00 46.19 45.80 2wvz s LEU 336 CO 0.00 -0.19 1.06 -2.16 0.23 0.00 0.00 176.35 175.30 2wvz s PRO 337 N -1.90 2.97 0.00 1.29 0.04 -1.26 -1.03 135.00 135.11 2wvz s PRO 337 Ca -0.05 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.06 2wvz s PRO 337 Cb -0.08 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2wvz s PRO 337 CO 0.01 -1.08 0.00 0.41 0.04 0.00 0.00 177.00 176.38 2wvz n GLY 338 N -1.56 0.90 3.82 0.56 0.00 -0.49 -4.81 105.19 103.62 2wvz n GLY 338 Ca 0.08 -2.20 -0.31 0.00 0.00 0.00 0.00 46.02 43.60 2wvz n GLY 338 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wvz s TYR 339 N -1.20 3.03 -0.29 1.61 2.02 -1.26 -3.87 117.35 117.39 2wvz s TYR 339 Ca 0.00 1.33 -0.23 0.00 -0.37 0.00 0.00 57.07 57.80 2wvz s TYR 339 Cb 0.00 -2.96 0.14 0.00 -0.40 0.00 0.00 41.96 38.74 2wvz s TYR 339 CO 0.00 -1.40 1.09 1.41 -1.57 0.00 0.00 175.55 175.07 2wvz s MET 340 N -5.08 0.40 0.26 -0.62 -2.45 -1.26 -4.21 119.30 106.33 2wvz s MET 340 Ca 0.59 0.52 0.01 0.00 -1.25 0.00 0.00 55.69 55.56 2wvz s MET 340 Cb -0.14 0.17 -0.04 0.00 1.25 0.00 0.00 34.83 36.06 2wvz s MET 340 CO 0.55 -0.06 0.12 -0.06 1.05 0.00 0.00 175.02 176.62 2wvz s PHE 341 N 0.49 1.49 0.13 4.11 0.40 -1.26 -0.66 117.98 122.67 2wvz s PHE 341 Ca 0.01 -1.28 -0.13 0.00 -0.60 0.00 0.00 56.93 54.93 2wvz s PHE 341 Cb -0.05 -0.83 0.05 0.00 0.51 0.00 0.00 43.02 42.70 2wvz s PHE 341 CO -0.10 -0.45 0.61 -2.37 0.70 0.00 0.00 175.22 173.61 2wvz n THR 342 N -0.47 0.00 -2.49 0.64 5.66 -0.85 -4.81 114.28 111.97 2wvz n THR 342 Ca 0.01 -0.38 -0.05 0.00 -3.05 0.00 0.00 64.05 60.58 2wvz n THR 342 Cb 0.66 0.49 0.02 0.00 -1.55 0.00 0.00 70.33 69.95 2wvz n THR 342 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2wvz n ASP 343 N -1.06 -2.28 -3.88 1.09 8.00 -0.85 -0.35 116.55 117.22 2wvz n ASP 343 Ca -0.02 -0.17 -0.11 0.00 0.71 0.00 0.00 54.79 55.20 2wvz n ASP 343 Cb 0.36 -1.78 -0.11 0.00 -0.02 0.00 0.00 41.12 39.56 2wvz n ASP 343 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2wvz s THR 344 N -3.10 0.06 -0.33 -3.53 -1.32 -1.18 -4.56 115.64 101.69 2wvz s THR 344 Ca 0.04 -0.54 -0.06 0.00 -1.21 0.00 0.00 61.69 59.92 2wvz s THR 344 Cb -0.02 -0.33 0.04 0.00 -1.51 0.00 0.00 72.50 70.68 2wvz s THR 344 CO 0.20 -0.30 0.10 -0.83 -2.21 0.00 0.00 174.62 171.59 2wvz s GLY 345 N -0.99 1.83 0.26 6.08 0.00 -1.26 -2.32 107.32 110.93 2wvz s GLY 345 Ca -0.11 -1.72 0.18 0.00 0.00 0.00 0.00 44.72 43.07 2wvz s GLY 345 CO 0.01 0.76 1.55 0.69 0.00 0.00 0.00 173.10 176.10 2wvz n PHE 346 N 4.81 0.61 0.06 1.90 3.72 0.79 -1.07 117.46 128.28 2wvz n PHE 346 Ca -0.13 0.32 -0.04 0.00 -0.05 0.00 0.00 57.45 57.54 2wvz n PHE 346 Cb 0.45 -1.01 0.16 0.00 -0.94 0.00 0.00 39.48 38.14 2wvz n PHE 346 CO 0.00 0.00 0.00 2.35 -0.05 0.00 0.00 176.76 179.06 2wvz h TRP 347 N 0.00 0.39 0.06 1.38 7.01 -1.85 -1.40 115.95 121.55 2wvz h TRP 347 Ca 0.00 -0.12 -0.00 0.00 2.11 0.00 0.00 58.89 60.87 2wvz h TRP 347 Cb 0.00 -0.08 0.00 0.00 -2.10 0.00 0.00 29.16 26.98 2wvz h TRP 347 CO 0.00 0.74 -0.03 -0.44 -2.79 0.00 0.00 178.44 175.93 2wvz h ASP 348 N 0.26 -0.06 0.87 2.65 3.45 -1.47 -3.43 116.42 118.69 2wvz h ASP 348 Ca 0.01 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.37 2wvz h ASP 348 Cb 0.94 0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.72 2wvz h ASP 348 CO 0.08 0.48 -0.14 0.35 -1.57 0.00 0.00 179.24 178.44 2wvz n THR 349 N -4.81 0.01 0.21 0.35 -2.24 -0.91 -2.93 114.28 103.95 2wvz n THR 349 Ca -0.02 -0.01 0.06 0.00 -2.27 0.00 0.00 64.05 61.82 2wvz n THR 349 Cb 0.08 -0.30 0.46 0.00 -2.10 0.00 0.00 70.33 68.47 2wvz n THR 349 CO 0.00 0.00 0.00 2.19 -0.57 0.00 0.00 175.07 176.69 2wvz h PHE 350 N 0.00 0.00 0.53 4.78 -0.00 -1.52 -1.65 116.94 119.08 2wvz h PHE 350 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 57.94 2wvz h PHE 350 Cb 0.50 0.00 0.01 0.00 -0.00 0.00 0.00 35.95 36.46 2wvz h PHE 350 CO 0.00 0.30 -0.26 0.00 -0.00 0.00 0.00 178.31 178.35 2wvz h ARG 351 N 0.00 -0.69 0.00 6.09 3.08 -1.78 -3.42 114.38 117.67 2wvz h ARG 351 Ca -0.00 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2wvz h ARG 351 Cb 0.63 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.83 2wvz h ARG 351 CO 0.04 -0.40 0.00 0.00 -1.07 0.00 0.00 179.97 178.53 2wvz h LEU 353 N 0.00 -0.14 -1.41 0.00 7.12 -1.76 -2.06 115.31 117.06 2wvz h LEU 353 Ca 0.00 -0.34 -0.02 0.00 0.13 0.00 0.00 57.88 57.64 2wvz h LEU 353 Cb 0.19 0.04 -0.02 0.00 -0.53 0.00 0.00 40.66 40.34 2wvz h LEU 353 CO 0.00 0.46 0.13 -0.26 -0.13 0.00 0.00 178.44 178.64 2wvz h PHE 354 N -0.95 0.52 -1.00 1.25 0.04 -1.58 -1.42 116.94 113.81 2wvz h PHE 354 Ca -0.02 -0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.76 2wvz h PHE 354 Cb 0.47 -0.16 -0.06 0.00 2.20 0.00 0.00 35.95 38.40 2wvz h PHE 354 CO 0.09 0.43 0.66 -1.35 -0.60 0.00 0.00 178.31 177.53 2wvz h PRO 355 N 0.52 1.25 -0.77 1.51 0.11 -1.82 -0.60 132.00 132.20 2wvz h PRO 355 Ca 0.13 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 66.15 2wvz h PRO 355 Cb 0.14 -0.28 -0.04 0.00 0.11 0.00 0.00 31.00 30.93 2wvz h PRO 355 CO -0.01 0.83 0.45 1.25 -0.21 0.00 0.00 178.00 180.30 2wvz h LEU 356 N 1.28 0.93 -0.51 2.35 5.85 -0.51 -0.05 115.31 124.65 2wvz h LEU 356 Ca 0.39 -0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.93 2wvz h LEU 356 Cb -0.03 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 2wvz h LEU 356 CO -0.11 0.73 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.47 2wvz h LEU 357 N 1.06 1.03 -1.86 2.25 3.38 -0.93 0.13 115.31 120.37 2wvz h LEU 357 Ca 0.27 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2wvz h LEU 357 Cb -0.02 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 2wvz h LEU 357 CO -0.05 1.17 -0.11 0.78 0.09 0.00 0.00 178.44 180.32 2wvz h ASN 358 N 0.87 0.00 0.00 -0.43 -0.26 -0.37 0.16 115.58 115.55 2wvz h ASN 358 Ca 0.12 0.00 -0.07 0.00 -0.56 0.00 0.00 56.30 55.80 2wvz h ASN 358 Cb 0.75 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.00 2wvz h ASN 358 CO 0.06 0.11 -0.46 0.25 -1.06 0.00 0.00 177.43 176.33 2wvz h LEU 359 N 0.00 0.00 0.00 1.61 5.85 -0.40 -3.40 115.31 118.97 2wvz h LEU 359 Ca -0.00 -0.43 0.00 0.00 0.84 0.00 0.00 57.88 58.29 2wvz h LEU 359 Cb 0.37 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.40 2wvz h LEU 359 CO 0.01 0.98 -1.34 0.23 -0.34 0.00 0.00 178.44 177.98 2wvz n MET 360 N -4.60 0.35 -2.70 1.25 2.81 0.41 -4.64 117.12 109.99 2wvz n MET 360 Ca -0.13 -0.06 -0.09 0.00 -1.81 0.00 0.00 57.70 55.60 2wvz n MET 360 Cb 0.39 -1.56 0.05 0.00 -0.71 0.00 0.00 33.22 31.38 2wvz n MET 360 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2wvz n TYR 361 N -1.98 0.27 -0.34 2.03 4.01 0.46 -4.58 117.16 117.03 2wvz n TYR 361 Ca 0.00 -2.66 0.09 0.00 -0.16 0.00 0.00 57.90 55.17 2wvz n TYR 361 Cb 0.46 0.06 0.28 0.00 -0.31 0.00 0.00 39.34 39.84 2wvz n TYR 361 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2wvz h PRO 362 N 2.79 0.87 0.00 -0.72 0.11 -1.52 -0.16 132.00 133.37 2wvz h PRO 362 Ca -0.12 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.87 2wvz h PRO 362 Cb 1.19 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 2wvz h PRO 362 CO 0.38 0.57 -0.32 0.66 -0.21 0.00 0.00 178.00 179.08 2wvz h SER 363 N 0.89 0.00 -0.07 -2.05 4.64 -1.93 -0.66 113.55 114.38 2wvz h SER 363 Ca 0.50 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.78 2wvz h SER 363 Cb 0.61 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2wvz h SER 363 CO -0.27 0.32 -0.11 0.58 -0.87 0.00 0.00 176.83 176.48 2wvz h VAL 364 N 0.00 1.40 0.00 0.95 2.07 -1.39 -3.18 116.25 116.11 2wvz h VAL 364 Ca -0.00 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.13 2wvz h VAL 364 Cb 0.63 2.16 -0.00 0.00 -1.52 0.00 0.00 31.29 32.56 2wvz h VAL 364 CO 0.04 0.38 -0.03 -1.13 0.02 0.00 0.00 177.57 176.86 2wvz h ASN 365 N -0.28 0.00 -0.27 0.57 -1.24 -1.21 -1.01 115.58 112.13 2wvz h ASN 365 Ca 0.00 0.00 0.03 0.00 0.71 0.00 0.00 56.30 57.04 2wvz h ASN 365 Cb 0.68 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.70 2wvz h ASN 365 CO 0.03 0.03 0.09 0.50 -1.29 0.00 0.00 177.43 176.79 2wvz h LYS 366 N 0.00 0.21 -0.23 6.67 1.63 -1.10 0.19 116.57 123.94 2wvz h LYS 366 Ca -0.00 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.73 2wvz h LYS 366 Cb 0.26 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.83 2wvz h LYS 366 CO 0.00 0.14 -0.09 0.93 -3.45 0.00 0.00 179.45 176.98 2wvz h GLU 367 N 0.21 0.36 -0.48 1.90 5.08 -1.22 -0.89 114.58 119.55 2wvz h GLU 367 Ca 0.12 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 2wvz h GLU 367 Cb 0.09 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2wvz h GLU 367 CO -0.12 0.47 -0.07 0.52 -1.00 0.00 0.00 179.01 178.80 2wvz h MET 368 N 0.35 0.89 -0.14 2.33 2.86 -1.07 -0.12 114.93 120.03 2wvz h MET 368 Ca 0.07 -0.32 -0.08 0.00 -2.06 0.00 0.00 59.70 57.32 2wvz h MET 368 Cb 0.38 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 2wvz h MET 368 CO 0.02 0.96 -0.21 1.96 1.06 0.00 0.00 176.91 180.70 2wvz h GLN 369 N 0.74 0.39 -0.75 1.72 1.08 -0.60 0.81 115.11 118.50 2wvz h GLN 369 Ca 0.13 -0.23 0.16 0.00 -1.45 0.00 0.00 58.65 57.25 2wvz h GLN 369 Cb 0.61 0.02 -0.11 0.00 -0.05 0.00 0.00 27.48 27.95 2wvz h GLN 369 CO 0.04 0.81 0.23 0.93 -0.95 0.00 0.00 178.83 179.89 2wvz h GLU 370 N -0.01 0.32 -0.80 1.46 4.39 -1.12 0.13 114.58 118.96 2wvz h GLU 370 Ca 0.01 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 59.76 2wvz h GLU 370 Cb 0.78 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.30 2wvz h GLU 370 CO 0.05 0.21 0.52 0.78 -1.16 0.00 0.00 179.01 179.42 2wvz h GLY 371 N 0.33 1.11 0.98 -3.84 0.00 -0.05 -1.47 103.07 100.12 2wvz h GLY 371 Ca 0.42 -0.35 -0.12 0.00 0.00 0.00 0.00 47.33 47.28 2wvz h GLY 371 CO -0.47 0.25 -0.29 1.41 0.00 0.00 0.00 176.54 177.44 2wvz h LEU 372 N 0.86 0.76 -0.60 3.11 3.38 0.16 -0.04 115.31 122.95 2wvz h LEU 372 Ca 0.35 -0.47 0.11 0.00 0.09 0.00 0.00 57.88 57.95 2wvz h LEU 372 Cb 0.24 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 40.70 2wvz h LEU 372 CO -0.12 1.08 0.15 0.40 0.09 0.00 0.00 178.44 180.04 2wvz h ILE 373 N 0.46 0.68 -0.87 1.22 1.08 -0.77 -0.46 117.51 118.85 2wvz h ILE 373 Ca 0.05 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 64.40 2wvz h ILE 373 Cb 0.86 0.36 -0.04 0.00 -3.07 0.00 0.00 36.82 34.93 2wvz h ILE 373 CO 0.07 0.05 0.50 0.78 -0.69 0.00 0.00 178.15 178.86 2wvz h ASN 374 N 0.30 1.06 -0.65 1.72 -0.26 -0.42 -0.86 115.58 116.47 2wvz h ASN 374 Ca 0.31 -0.08 0.07 0.00 -0.56 0.00 0.00 56.30 56.04 2wvz h ASN 374 Cb 0.44 -0.27 -0.06 0.00 -1.06 0.00 0.00 38.32 37.37 2wvz h ASN 374 CO -0.37 0.83 0.33 0.74 -1.06 0.00 0.00 177.43 177.91 2wvz h THR 375 N 1.20 0.92 -0.40 2.81 2.02 0.52 -0.79 112.91 119.19 2wvz h THR 375 Ca 0.31 -0.21 -0.12 0.00 0.77 0.00 0.00 66.41 67.16 2wvz h THR 375 Cb -0.01 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 2wvz h THR 375 CO -0.05 0.11 -0.22 0.22 0.37 0.00 0.00 175.52 175.95 2wvz h TYR 376 N 0.61 0.99 -0.52 3.16 3.20 -0.54 0.69 116.97 124.56 2wvz h TYR 376 Ca 0.30 -0.25 0.01 0.00 3.14 0.00 0.00 58.73 61.92 2wvz h TYR 376 Cb 0.24 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 2wvz h TYR 376 CO -0.10 1.03 0.34 -0.07 -1.64 0.00 0.00 178.16 177.72 2wvz h LEU 377 N 0.67 0.58 0.00 2.82 3.38 -0.86 -0.58 115.31 121.33 2wvz h LEU 377 Ca 0.09 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2wvz h LEU 377 Cb 0.78 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2wvz h LEU 377 CO 0.06 0.42 -1.03 -0.62 0.09 0.00 0.00 178.44 177.37 2wvz n GLU 378 N -4.46 0.52 0.00 1.13 1.02 -0.33 -4.50 120.64 114.01 2wvz n GLU 378 Ca 0.05 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 2wvz n GLU 378 Cb 0.06 -1.75 0.00 0.00 -0.02 0.00 0.00 31.44 29.73 2wvz n GLU 378 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2wvz n SER 379 N -2.46 3.38 0.00 1.62 3.41 0.20 -4.32 113.62 115.45 2wvz n SER 379 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2wvz n SER 379 Cb 0.52 0.65 0.00 0.00 -0.26 0.00 0.00 64.21 65.12 2wvz n SER 379 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wvz n GLY 380 N 1.72 2.51 3.11 5.00 0.00 -0.23 -5.05 105.19 112.25 2wvz n GLY 380 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2wvz n GLY 380 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wvz s PHE 381 N -2.47 1.06 0.55 1.61 0.40 -1.26 -4.93 117.98 112.94 2wvz s PHE 381 Ca 0.00 -0.33 -0.21 0.00 -0.60 0.00 0.00 56.93 55.79 2wvz s PHE 381 Cb 0.00 -0.64 -0.05 0.00 0.51 0.00 0.00 43.02 42.84 2wvz s PHE 381 CO 0.00 0.01 1.34 -0.06 0.70 0.00 0.00 175.22 177.21 2wvz s PHE 382 N -0.78 2.30 0.64 0.36 0.08 -1.26 -3.75 117.98 115.56 2wvz s PHE 382 Ca 0.00 1.40 -0.08 0.00 0.12 0.00 0.00 56.93 58.37 2wvz s PHE 382 Cb -0.07 -3.76 0.01 0.00 -0.57 0.00 0.00 43.02 38.63 2wvz s PHE 382 CO 0.01 -2.80 0.99 -1.25 -0.10 0.00 0.00 175.22 172.06 2wvz s PRO 383 N -2.95 2.90 0.07 0.24 0.04 -1.26 -4.52 135.00 129.51 2wvz s PRO 383 Ca 0.72 0.20 0.00 0.00 0.04 0.00 0.00 61.00 61.96 2wvz s PRO 383 Cb -0.39 -2.16 0.00 0.00 0.04 0.00 0.00 34.50 31.99 2wvz s PRO 383 CO 0.46 -0.84 0.00 0.39 0.04 0.00 0.00 177.00 177.05 2wvz n GLU 384 N -2.76 0.00 -4.41 4.56 -0.58 -1.26 -4.56 120.64 111.63 2wvz n GLU 384 Ca 0.05 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.46 2wvz n GLU 384 Cb 0.57 -0.32 -0.11 0.00 -0.57 0.00 0.00 31.44 31.01 2wvz n GLU 384 CO 0.00 0.00 0.00 -0.46 -0.48 0.00 0.00 177.13 176.19 2wvz s TRP 385 N -1.67 3.05 -0.03 -0.32 -0.00 -1.26 -0.15 118.94 118.56 2wvz s TRP 385 Ca 0.00 -0.14 0.01 0.00 -0.00 0.00 0.00 56.10 55.97 2wvz s TRP 385 Cb 0.00 -1.90 0.02 0.00 -0.00 0.00 0.00 33.47 31.59 2wvz s TRP 385 CO 0.00 0.12 -0.04 0.00 -0.00 0.00 0.00 176.95 177.03 2wvz s ALA 386 N -0.03 0.55 -0.32 5.86 0.00 -0.98 -1.96 121.76 124.87 2wvz s ALA 386 Ca 0.02 -0.06 -0.08 0.00 0.00 0.00 0.00 51.96 51.84 2wvz s ALA 386 Cb -0.13 -0.31 0.22 0.00 0.00 0.00 0.00 23.12 22.89 2wvz s ALA 386 CO 0.02 0.02 1.14 0.45 0.00 0.00 0.00 175.76 177.40 2wvz n SER 387 N 3.75 -1.26 0.04 0.00 2.88 -1.26 -2.02 113.62 115.74 2wvz n SER 387 Ca -0.23 -0.77 -0.04 0.00 -1.33 0.00 0.00 58.87 56.51 2wvz n SER 387 Cb 0.53 0.63 -0.09 0.00 -0.75 0.00 0.00 64.21 64.53 2wvz n SER 387 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2wvz h PRO 388 N 4.10 0.00 0.00 -1.46 0.13 -1.77 -3.42 132.00 129.58 2wvz h PRO 388 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2wvz h PRO 388 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2wvz h PRO 388 CO -0.12 0.53 0.00 0.41 -0.23 0.00 0.00 178.00 178.59 2wvz n GLY 389 N 1.41 1.55 3.70 1.56 0.00 0.70 -4.75 105.19 109.36 2wvz n GLY 389 Ca -0.08 -2.04 -0.43 0.00 0.00 0.00 0.00 46.02 43.47 2wvz n GLY 389 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wvz n HIS 390 N -0.71 2.62 -4.48 1.61 8.25 -1.26 -4.31 115.22 116.95 2wvz n HIS 390 Ca 0.00 0.03 -0.24 0.00 -0.26 0.00 0.00 57.72 57.25 2wvz n HIS 390 Cb 0.00 -2.67 -0.13 0.00 1.12 0.00 0.00 29.99 28.31 2wvz n HIS 390 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2wvz s ARG 391 N 1.63 1.21 -0.65 -0.41 1.81 -0.83 -4.37 118.95 117.34 2wvz s ARG 391 Ca 0.78 -0.95 -0.22 0.00 -1.72 0.00 0.00 55.73 53.62 2wvz s ARG 391 Cb -0.53 -1.33 0.07 0.00 -0.45 0.00 0.00 34.95 32.71 2wvz s ARG 391 CO 0.35 0.33 0.94 0.20 -0.68 0.00 0.00 175.30 176.44 2wvz s GLY 392 N -1.35 1.40 -0.29 -3.53 0.00 -1.26 -4.45 107.32 97.84 2wvz s GLY 392 Ca 0.06 -1.82 -0.16 0.00 0.00 0.00 0.00 44.72 42.79 2wvz s GLY 392 CO 0.02 2.03 0.95 0.00 0.00 0.00 0.00 173.10 176.10 2wvz n MET 394 N 3.77 0.00 -4.12 0.00 2.81 -1.26 -4.59 117.12 113.73 2wvz n MET 394 Ca -0.19 0.00 -0.14 0.00 -1.81 0.00 0.00 57.70 55.57 2wvz n MET 394 Cb 0.58 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 33.03 2wvz n MET 394 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2wvz s VAL 395 N 0.00 0.00 0.00 2.03 -7.23 -1.26 -4.75 120.40 109.19 2wvz s VAL 395 Ca 0.00 -1.69 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 2wvz s VAL 395 Cb 0.00 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.43 2wvz s VAL 395 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 2wvz n GLY 396 N -0.48 -0.38 2.43 2.32 0.00 -1.26 -4.72 105.19 103.10 2wvz n GLY 396 Ca 0.01 -1.78 -0.18 0.00 0.00 0.00 0.00 46.02 44.08 2wvz n GLY 396 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wvz n ASN 397 N -0.97 3.60 0.00 1.61 4.05 -1.26 -4.89 115.26 117.40 2wvz n ASN 397 Ca 0.00 -3.22 0.09 0.00 0.45 0.00 0.00 54.58 51.89 2wvz n ASN 397 Cb 0.00 -0.44 0.42 0.00 1.23 0.00 0.00 39.78 41.00 2wvz n ASN 397 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2wvz n ASN 398 N -0.50 0.00 -0.28 1.20 4.13 -1.26 -1.42 115.26 117.12 2wvz n ASN 398 Ca 0.29 0.27 0.22 0.00 1.68 0.00 0.00 54.58 57.04 2wvz n ASN 398 Cb 0.82 -0.39 0.53 0.00 -1.54 0.00 0.00 39.78 39.19 2wvz n ASN 398 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 2wvz h SER 399 N 0.00 0.38 -0.70 6.41 4.64 -1.89 0.23 113.55 122.63 2wvz h SER 399 Ca 0.00 0.05 0.05 0.00 -0.47 0.00 0.00 61.79 61.42 2wvz h SER 399 Cb 0.24 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 62.28 2wvz h SER 399 CO 0.00 0.12 0.46 0.00 -0.87 0.00 0.00 176.83 176.54 2wvz h ALA 400 N 1.60 1.65 -0.14 5.18 0.00 -1.60 0.53 119.26 126.48 2wvz h ALA 400 Ca 0.52 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.33 2wvz h ALA 400 Cb 1.39 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2wvz h ALA 400 CO -0.21 0.26 -0.19 1.03 0.00 0.00 0.00 179.25 180.15 2wvz h SER 401 N 0.80 0.41 -0.08 0.00 0.87 -0.76 -1.76 113.55 113.03 2wvz h SER 401 Ca 0.29 -0.51 0.04 0.00 -1.23 0.00 0.00 61.79 60.38 2wvz h SER 401 Cb 0.14 -0.12 -0.06 0.00 -0.44 0.00 0.00 62.40 61.93 2wvz h SER 401 CO -0.09 0.84 -0.32 0.40 -0.53 0.00 0.00 176.83 177.14 2wvz h ILE 402 N -0.01 0.30 -0.12 2.23 1.08 -0.97 0.13 117.51 120.15 2wvz h ILE 402 Ca 0.02 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 2wvz h ILE 402 Cb 0.74 0.30 -0.01 0.00 -3.07 0.00 0.00 36.82 34.79 2wvz h ILE 402 CO 0.04 0.00 0.08 -0.07 -0.69 0.00 0.00 178.15 177.51 2wvz h LEU 403 N -0.42 0.14 -0.19 1.44 3.38 -0.93 -2.28 115.31 116.45 2wvz h LEU 403 Ca 0.08 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.85 2wvz h LEU 403 Cb 0.55 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.27 2wvz h LEU 403 CO -0.31 0.11 -0.62 0.58 0.09 0.00 0.00 178.44 178.28 2wvz h VAL 404 N 0.16 1.30 -0.34 1.22 2.07 -1.21 -2.66 116.25 116.78 2wvz h VAL 404 Ca 0.04 -1.83 0.00 0.00 0.82 0.00 0.00 66.70 65.73 2wvz h VAL 404 Cb -0.01 1.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 2wvz h VAL 404 CO -0.01 0.58 0.22 -0.78 0.02 0.00 0.00 177.57 177.60 2wvz h ASP 405 N 0.48 0.41 -0.14 0.57 3.58 -0.71 0.22 116.42 120.82 2wvz h ASP 405 Ca -0.02 -0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.42 2wvz h ASP 405 Cb 1.24 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 42.15 2wvz h ASP 405 CO 0.13 0.32 -0.35 0.00 -2.88 0.00 0.00 179.24 176.46 2wvz h ALA 406 N 1.10 -0.69 -0.53 -0.78 0.00 -1.41 -1.52 119.26 115.43 2wvz h ALA 406 Ca 0.12 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.09 2wvz h ALA 406 Cb -0.02 0.89 -0.07 0.00 0.00 0.00 0.00 17.79 18.60 2wvz h ALA 406 CO -0.03 -0.83 0.17 -0.92 0.00 0.00 0.00 179.25 177.64 2wvz h TYR 407 N -0.34 0.30 0.00 0.00 5.03 -1.06 0.15 116.97 121.04 2wvz h TYR 407 Ca 0.03 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.37 2wvz h TYR 407 Cb 0.42 -0.05 0.00 0.00 1.55 0.00 0.00 36.73 38.65 2wvz h TYR 407 CO -0.58 0.07 0.00 0.52 -1.32 0.00 0.00 178.16 176.85 2wvz h MET 408 N 0.34 0.00 -0.63 1.82 2.86 -0.85 -1.65 114.93 116.82 2wvz h MET 408 Ca 0.26 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.90 2wvz h MET 408 Cb 0.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2wvz h MET 408 CO -0.29 0.00 0.00 1.63 1.06 0.00 0.00 176.91 179.31 2wvz n LYS 409 N -2.90 4.29 -0.73 1.72 5.02 0.43 -4.93 118.16 121.07 2wvz n LYS 409 Ca -0.00 -2.84 0.00 0.00 -2.02 0.00 0.00 58.31 53.44 2wvz n LYS 409 Cb 0.21 -2.10 0.00 0.00 -0.02 0.00 0.00 35.03 33.12 2wvz n LYS 409 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wvz n GLY 410 N 0.74 0.85 3.37 0.72 0.00 -0.62 -4.98 105.19 105.26 2wvz n GLY 410 Ca 0.25 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.82 2wvz n GLY 410 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wvz s VAL 411 N -3.35 4.95 -0.15 1.61 1.01 -0.69 -4.98 120.40 118.79 2wvz s VAL 411 Ca 0.00 -1.27 -0.02 0.00 0.00 0.00 0.00 61.98 60.70 2wvz s VAL 411 Cb 0.00 -4.49 -0.02 0.00 0.00 0.00 0.00 36.38 31.87 2wvz s VAL 411 CO 0.00 -1.11 -0.09 -0.54 0.00 0.00 0.00 175.10 173.35 2wvz s LYS 412 N 2.27 3.47 0.72 2.72 1.02 -1.26 -2.56 119.74 126.12 2wvz s LYS 412 Ca 0.13 -0.63 -0.11 0.00 0.02 0.00 0.00 55.97 55.37 2wvz s LYS 412 Cb -0.22 -2.75 0.02 0.00 -0.52 0.00 0.00 37.83 34.36 2wvz s LYS 412 CO 0.03 0.19 1.08 0.14 -0.92 0.00 0.00 175.35 175.86 2wvz s VAL 413 N 0.44 3.70 0.19 3.17 -7.23 -1.26 -4.96 120.40 114.46 2wvz s VAL 413 Ca -0.07 0.55 -0.09 0.00 -1.81 0.00 0.00 61.98 60.56 2wvz s VAL 413 Cb -0.15 -3.40 0.09 0.00 0.56 0.00 0.00 36.38 33.48 2wvz s VAL 413 CO 0.04 -0.72 1.68 0.44 -0.31 0.00 0.00 175.10 176.23 2wvz h ASP 414 N -0.75 1.08 -3.53 4.85 3.32 -1.98 -3.38 116.42 116.02 2wvz h ASP 414 Ca -0.45 -0.27 -0.75 0.00 0.02 0.00 0.00 57.03 55.57 2wvz h ASP 414 Cb 1.24 -0.29 -0.31 0.00 0.22 0.00 0.00 39.33 40.19 2wvz h ASP 414 CO 0.60 1.08 0.15 -0.62 -1.72 0.00 0.00 179.24 178.73 2wvz s ASP 415 N -6.52 6.62 0.38 6.45 2.15 -1.26 -4.82 116.67 119.67 2wvz s ASP 415 Ca -0.12 -3.53 0.11 0.00 0.43 0.00 0.00 52.55 49.44 2wvz s ASP 415 Cb 0.14 -2.07 0.74 0.00 -0.30 0.00 0.00 42.92 41.43 2wvz s ASP 415 CO 0.85 -0.27 1.86 0.40 -0.17 0.00 0.00 175.17 177.84 2wvz h ILE 416 N 4.02 1.23 0.20 4.11 2.04 -2.00 -2.00 117.51 125.11 2wvz h ILE 416 Ca 0.15 -1.09 -0.00 0.00 1.00 0.00 0.00 64.86 64.93 2wvz h ILE 416 Cb 0.87 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 2wvz h ILE 416 CO 0.91 0.32 -0.17 0.50 0.00 0.00 0.00 178.15 179.71 2wvz h LYS 417 N 0.09 -0.37 -0.51 2.37 3.64 -1.97 -0.34 116.57 119.48 2wvz h LYS 417 Ca 0.01 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 2wvz h LYS 417 Cb 0.56 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.44 2wvz h LYS 417 CO 0.04 -0.24 0.11 1.15 -2.27 0.00 0.00 179.45 178.23 2wvz h THR 418 N -0.38 1.22 0.05 1.00 2.02 -1.92 -2.15 112.91 112.76 2wvz h THR 418 Ca -0.01 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.36 2wvz h THR 418 Cb 0.34 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 2wvz h THR 418 CO -0.02 0.30 -0.11 0.25 0.37 0.00 0.00 175.52 176.32 2wvz h LEU 419 N 0.76 -0.29 -0.76 2.58 5.85 -0.94 -0.30 115.31 122.22 2wvz h LEU 419 Ca 0.17 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 2wvz h LEU 419 Cb 0.31 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 2wvz h LEU 419 CO 0.00 -0.16 0.46 0.22 -0.34 0.00 0.00 178.44 178.63 2wvz h TYR 420 N -0.21 0.99 -0.40 1.25 3.20 -0.74 -2.09 116.97 118.98 2wvz h TYR 420 Ca 0.02 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.78 2wvz h TYR 420 Cb 0.23 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 2wvz h TYR 420 CO -0.14 0.66 -0.20 0.93 -1.64 0.00 0.00 178.16 177.77 2wvz h GLU 421 N 1.03 0.77 -0.38 1.82 5.08 -1.00 -2.34 114.58 119.56 2wvz h GLU 421 Ca 0.27 -0.30 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 2wvz h GLU 421 Cb -0.05 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2wvz h GLU 421 CO -0.05 0.91 -0.18 0.78 -1.00 0.00 0.00 179.01 179.46 2wvz h GLY 422 N 0.97 0.78 0.94 -3.84 0.00 -0.83 0.07 103.07 101.15 2wvz h GLY 422 Ca 0.10 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 2wvz h GLY 422 CO 0.05 0.57 -0.19 1.41 0.00 0.00 0.00 176.54 178.38 2wvz h LEU 423 N 0.64 -0.45 -0.65 3.11 3.38 -1.05 -2.73 115.31 117.56 2wvz h LEU 423 Ca 0.10 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.11 2wvz h LEU 423 Cb 0.66 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.47 2wvz h LEU 423 CO 0.05 -0.27 0.34 0.40 0.09 0.00 0.00 178.44 179.04 2wvz h ILE 424 N -0.60 0.91 -0.90 1.22 1.08 -1.32 -2.48 117.51 115.43 2wvz h ILE 424 Ca -0.05 -0.21 0.11 0.00 -0.39 0.00 0.00 64.86 64.32 2wvz h ILE 424 Cb 0.45 0.25 -0.08 0.00 -3.07 0.00 0.00 36.82 34.37 2wvz h ILE 424 CO 0.09 0.11 0.53 -0.74 -0.69 0.00 0.00 178.15 177.45 2wvz h HIS 425 N 0.61 0.96 0.00 1.37 2.76 -0.82 -0.79 115.15 119.24 2wvz h HIS 425 Ca 0.30 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.50 2wvz h HIS 425 Cb 0.25 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 28.91 2wvz h HIS 425 CO -0.10 0.37 0.00 0.78 -1.30 0.00 0.00 177.93 177.69 2wvz h GLY 426 N 0.86 0.00 1.99 5.26 0.00 -1.14 -2.97 103.07 107.07 2wvz h GLY 426 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 2wvz h GLY 426 CO -0.26 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 174.98 2wvz n THR 427 N -2.60 0.56 -2.44 4.70 -2.24 -0.30 -2.68 114.28 109.28 2wvz n THR 427 Ca 0.04 0.14 0.04 0.00 -2.27 0.00 0.00 64.05 62.00 2wvz n THR 427 Cb 0.40 -0.78 0.04 0.00 -2.10 0.00 0.00 70.33 67.88 2wvz n THR 427 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2wvz n GLU 428 N -1.49 0.20 -3.70 -0.78 0.28 -1.13 -4.89 120.64 109.14 2wvz n GLU 428 Ca 0.05 -2.17 -0.14 0.00 -0.16 0.00 0.00 57.16 54.74 2wvz n GLU 428 Cb 0.24 -0.20 -0.09 0.00 1.43 0.00 0.00 31.44 32.83 2wvz n GLU 428 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 2wvz s ASN 429 N -2.17 -0.44 0.18 -1.84 0.01 -1.20 -5.03 114.94 104.46 2wvz s ASN 429 Ca 0.34 0.69 0.08 0.00 -0.71 0.00 0.00 52.86 53.26 2wvz s ASN 429 Cb 0.39 0.73 -0.04 0.00 0.41 0.00 0.00 41.25 42.73 2wvz s ASN 429 CO -0.16 -0.31 -0.06 0.54 -1.51 0.00 0.00 177.10 175.61 2wvz s VAL 430 N -0.39 3.39 0.27 1.60 0.11 -1.26 -0.90 120.40 123.22 2wvz s VAL 430 Ca -0.05 -1.58 -0.30 0.00 -2.93 0.00 0.00 61.98 57.12 2wvz s VAL 430 Cb -0.03 -2.69 -0.09 0.00 -1.53 0.00 0.00 36.38 32.03 2wvz s VAL 430 CO 0.03 -0.12 1.08 -2.28 -3.33 0.00 0.00 175.10 170.48 2wvz s HIS 431 N -1.73 3.63 0.04 1.54 2.46 0.13 -4.92 115.29 116.43 2wvz s HIS 431 Ca 0.26 1.72 0.25 0.00 0.47 0.00 0.00 55.06 57.76 2wvz s HIS 431 Cb -0.09 -3.25 0.84 0.00 -0.13 0.00 0.00 32.58 29.95 2wvz s HIS 431 CO 0.17 -0.44 1.79 -1.00 -2.47 0.00 0.00 174.74 172.79 2wvz h PRO 432 N 3.89 0.00 -0.00 2.88 0.13 -1.99 -3.23 132.00 133.68 2wvz h PRO 432 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2wvz h PRO 432 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2wvz h PRO 432 CO 0.67 0.19 -0.21 -0.85 -0.23 0.00 0.00 178.00 177.58 2wvz n GLU 433 N -3.29 3.06 -3.72 0.86 0.00 -1.26 -4.89 120.64 111.40 2wvz n GLU 433 Ca 0.01 -0.35 -0.30 0.00 0.00 0.00 0.00 57.16 56.52 2wvz n GLU 433 Cb 0.45 -0.94 -0.15 0.00 0.00 0.00 0.00 31.44 30.81 2wvz n GLU 433 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2wvz s VAL 434 N -1.29 0.94 -0.99 3.84 1.01 -1.22 -4.96 120.40 117.74 2wvz s VAL 434 Ca 0.05 -1.62 0.14 0.00 0.00 0.00 0.00 61.98 60.55 2wvz s VAL 434 Cb 0.06 -1.70 0.11 0.00 0.00 0.00 0.00 36.38 34.85 2wvz s VAL 434 CO 0.21 -0.73 1.44 -1.54 0.00 0.00 0.00 175.10 174.48 2wvz n SER 435 N 4.58 0.01 -0.94 3.32 3.41 -1.26 -1.97 113.62 120.77 2wvz n SER 435 Ca 0.01 0.50 0.10 0.00 -0.26 0.00 0.00 58.87 59.22 2wvz n SER 435 Cb 0.40 -0.51 0.27 0.00 -0.26 0.00 0.00 64.21 64.12 2wvz n SER 435 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2wvz n SER 436 N -1.51 2.77 -4.28 4.04 3.41 -1.26 -3.96 113.62 112.82 2wvz n SER 436 Ca 0.03 -1.92 -0.32 0.00 -0.26 0.00 0.00 58.87 56.40 2wvz n SER 436 Cb 0.16 -0.26 -0.16 0.00 -0.26 0.00 0.00 64.21 63.69 2wvz n SER 436 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2wvz s THR 437 N -1.48 2.23 0.00 6.66 2.01 -0.83 -4.59 115.64 119.63 2wvz s THR 437 Ca 0.36 -0.99 0.00 0.00 0.31 0.00 0.00 61.69 61.37 2wvz s THR 437 Cb 0.20 -1.83 0.00 0.00 0.01 0.00 0.00 72.50 70.88 2wvz s THR 437 CO 0.28 0.57 0.00 0.61 -0.69 0.00 0.00 174.62 175.38 2wvz n GLY 438 N 3.07 -1.02 3.31 4.40 0.00 -1.26 0.20 105.19 113.89 2wvz n GLY 438 Ca -0.18 -1.09 -0.39 0.00 0.00 0.00 0.00 46.02 44.36 2wvz n GLY 438 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wvz s ARG 439 N 0.00 2.68 0.23 1.61 0.52 -0.08 -4.80 118.95 119.11 2wvz s ARG 439 Ca 0.00 -1.23 -0.32 0.00 -0.52 0.00 0.00 55.73 53.66 2wvz s ARG 439 Cb 0.00 -3.65 -0.12 0.00 0.52 0.00 0.00 34.95 31.70 2wvz s ARG 439 CO 0.00 -0.77 1.68 -0.11 0.02 0.00 0.00 175.30 176.12 2wvz n LEU 440 N 4.91 4.02 -0.70 2.53 7.94 -1.25 -2.75 117.00 131.68 2wvz n LEU 440 Ca -0.11 1.08 -0.07 0.00 -1.11 0.00 0.00 56.01 55.80 2wvz n LEU 440 Cb 0.45 -1.57 -0.01 0.00 0.53 0.00 0.00 43.42 42.82 2wvz n LEU 440 CO 0.35 0.13 -0.08 0.61 -1.11 0.00 0.00 177.39 177.30 2wvz n GLY 441 N 3.46 0.35 0.34 -3.96 0.00 -1.26 -4.94 105.19 99.18 2wvz n GLY 441 Ca 0.14 -0.64 0.06 0.00 0.00 0.00 0.00 46.02 45.57 2wvz n GLY 441 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2wvz h TYR 442 N 0.00 0.67 0.38 1.61 -0.00 -1.86 -2.49 116.97 115.29 2wvz h TYR 442 Ca -0.16 0.02 -0.00 0.00 -0.00 0.00 0.00 58.73 58.58 2wvz h TYR 442 Cb 0.90 -0.22 -0.02 0.00 -0.00 0.00 0.00 36.73 37.39 2wvz h TYR 442 CO 0.19 0.38 -0.36 0.93 -0.00 0.00 0.00 178.16 179.30 2wvz h GLU 443 N 0.68 -0.73 -0.96 0.10 3.07 -1.92 0.51 114.58 115.34 2wvz h GLU 443 Ca 0.25 0.05 0.09 0.00 -0.50 0.00 0.00 59.36 59.25 2wvz h GLU 443 Cb 0.14 0.17 -0.07 0.00 -0.84 0.00 0.00 28.75 28.14 2wvz h GLU 443 CO -0.07 -0.49 0.61 1.88 -1.40 0.00 0.00 179.01 179.55 2wvz h TYR 444 N -0.76 1.09 -0.07 4.33 0.05 -1.84 -1.64 116.97 118.13 2wvz h TYR 444 Ca -0.03 0.03 -0.17 0.00 0.05 0.00 0.00 58.73 58.61 2wvz h TYR 444 Cb 0.67 -0.35 0.01 0.00 1.01 0.00 0.00 36.73 38.07 2wvz h TYR 444 CO -0.19 0.50 -0.64 -0.92 -1.05 0.00 0.00 178.16 175.86 2wvz h TYR 445 N 1.01 0.77 -0.11 4.88 3.20 -0.79 0.38 116.97 126.31 2wvz h TYR 445 Ca 0.44 -0.37 -0.07 0.00 3.14 0.00 0.00 58.73 61.87 2wvz h TYR 445 Cb 0.35 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 2wvz h TYR 445 CO -0.00 1.18 -0.26 -0.91 -1.64 0.00 0.00 178.16 176.53 2wvz h ASN 446 N 0.14 0.18 0.00 -2.11 -0.26 0.19 0.32 115.58 114.04 2wvz h ASN 446 Ca -0.06 -0.05 -0.03 0.00 -0.56 0.00 0.00 56.30 55.60 2wvz h ASN 446 Cb 1.30 -0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 38.51 2wvz h ASN 446 CO 0.13 0.44 -0.25 0.50 -1.06 0.00 0.00 177.43 177.20 2wvz h LYS 447 N 0.17 0.00 0.00 0.81 3.64 -1.18 -3.40 116.57 116.61 2wvz h LYS 447 Ca 0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2wvz h LYS 447 Cb 0.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2wvz h LYS 447 CO 0.04 0.42 -0.73 1.28 -2.27 0.00 0.00 179.45 178.18 2wvz n LEU 448 N -4.66 0.62 -0.04 5.20 4.77 0.13 -4.94 117.00 118.08 2wvz n LEU 448 Ca -0.08 0.07 -0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2wvz n LEU 448 Cb 0.27 -0.17 -0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2wvz n LEU 448 CO 0.14 0.03 -0.01 0.61 -1.33 0.00 0.00 177.39 176.84 2wvz n GLY 449 N 1.40 0.40 3.61 -0.72 0.00 0.10 -5.01 105.19 104.97 2wvz n GLY 449 Ca 0.03 -1.02 -0.03 0.00 0.00 0.00 0.00 46.02 45.00 2wvz n GLY 449 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2wvz s TYR 450 N -2.02 -0.08 -0.33 1.61 1.13 -1.21 -4.78 117.35 111.67 2wvz s TYR 450 Ca 0.00 0.05 -0.17 0.00 -1.41 0.00 0.00 57.07 55.53 2wvz s TYR 450 Cb 0.00 0.51 -0.01 0.00 -1.10 0.00 0.00 41.96 41.36 2wvz s TYR 450 CO 0.00 -0.13 0.48 0.08 -2.51 0.00 0.00 175.55 173.47 2wvz s VAL 451 N -2.27 5.06 0.60 -3.49 1.01 -1.26 -3.56 120.40 116.48 2wvz s VAL 451 Ca 0.10 0.41 -0.18 0.00 0.00 0.00 0.00 61.98 62.31 2wvz s VAL 451 Cb -0.01 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 2wvz s VAL 451 CO -0.04 -0.12 0.89 -2.65 0.00 0.00 0.00 175.10 173.19 2wvz n PRO 452 N 5.63 0.82 0.15 2.72 -0.02 -1.26 -4.35 135.00 138.69 2wvz n PRO 452 Ca -0.05 0.32 0.02 0.00 -2.02 0.00 0.00 63.50 61.77 2wvz n PRO 452 Cb 0.49 -2.09 0.16 0.00 -0.02 0.00 0.00 33.50 32.04 2wvz n PRO 452 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2wvz h TYR 453 N 0.42 0.00 -0.33 6.00 5.03 -0.32 -3.36 116.97 124.40 2wvz h TYR 453 Ca -0.48 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.83 2wvz h TYR 453 Cb 1.37 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.65 2wvz h TYR 453 CO 0.36 0.52 0.00 -0.40 -1.32 0.00 0.00 178.16 177.32 2wvz n ASP 454 N -3.42 3.63 -1.59 -2.11 5.75 -1.26 -4.54 116.55 113.01 2wvz n ASP 454 Ca 0.01 -2.57 0.08 0.00 -0.01 0.00 0.00 54.79 52.29 2wvz n ASP 454 Cb 0.65 -0.43 0.36 0.00 -1.03 0.00 0.00 41.12 40.68 2wvz n ASP 454 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 2wvz n VAL 455 N 0.05 2.38 -2.53 2.12 0.24 -1.26 -4.94 118.33 114.39 2wvz n VAL 455 Ca 0.18 -1.43 -0.18 0.00 -2.04 0.00 0.00 64.34 60.87 2wvz n VAL 455 Cb 0.72 -0.14 0.01 0.00 -1.47 0.00 0.00 33.84 32.95 2wvz n VAL 455 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2wvz n LYS 456 N 0.54 -2.34 -3.82 7.34 5.02 -1.26 -4.98 118.16 118.66 2wvz n LYS 456 Ca 0.26 0.81 -0.35 0.00 -2.02 0.00 0.00 58.31 57.01 2wvz n LYS 456 Cb 1.04 -5.30 -0.12 0.00 -0.02 0.00 0.00 35.03 30.63 2wvz n LYS 456 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wvz s ILE 457 N -2.94 3.15 0.78 -0.18 1.01 -1.26 -5.11 121.20 116.65 2wvz s ILE 457 Ca 0.09 -2.51 -0.14 0.00 0.00 0.00 0.00 60.65 58.09 2wvz s ILE 457 Cb -0.04 -3.15 0.06 0.00 0.01 0.00 0.00 42.46 39.34 2wvz s ILE 457 CO 0.11 -0.74 1.21 0.59 0.00 0.00 0.00 174.94 176.11 2wvz n ASN 458 N 4.05 1.19 -2.56 3.58 3.02 -1.26 -3.48 115.26 119.79 2wvz n ASN 458 Ca 0.02 0.63 -0.18 0.00 -0.03 0.00 0.00 54.58 55.03 2wvz n ASN 458 Cb 0.39 -1.51 0.04 0.00 -0.61 0.00 0.00 39.78 38.09 2wvz n ASN 458 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2wvz n GLU 459 N -3.00 -4.70 -0.04 3.52 1.02 0.32 -4.89 120.64 112.86 2wvz n GLU 459 Ca 0.14 0.67 -0.16 0.00 -0.02 0.00 0.00 57.16 57.80 2wvz n GLU 459 Cb 0.50 -5.10 -0.07 0.00 -0.02 0.00 0.00 31.44 26.75 2wvz n GLU 459 CO 0.00 0.00 0.00 -2.95 1.18 0.00 0.00 177.13 175.36 2wvz h ASN 460 N -1.47 0.69 -0.74 1.62 -1.07 -1.48 -0.18 115.58 112.96 2wvz h ASN 460 Ca -0.42 -0.60 -0.04 0.00 0.07 0.00 0.00 56.30 55.31 2wvz h ASN 460 Cb 1.28 -0.20 -0.03 0.00 -2.07 0.00 0.00 38.32 37.29 2wvz h ASN 460 CO 0.43 1.17 0.30 0.00 0.07 0.00 0.00 177.43 179.41 2wvz h ALA 461 N 0.54 1.11 -0.26 4.14 0.00 -1.38 -0.56 119.26 122.85 2wvz h ALA 461 Ca -0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2wvz h ALA 461 Cb 1.12 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2wvz h ALA 461 CO 0.10 0.63 0.05 0.00 0.00 0.00 0.00 179.25 180.04 2wvz h ALA 462 N 1.24 0.34 -0.89 0.00 0.00 -1.17 -2.02 119.26 116.75 2wvz h ALA 462 Ca 0.25 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2wvz h ALA 462 Cb 0.20 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 2wvz h ALA 462 CO -0.02 0.02 0.58 0.00 0.00 0.00 0.00 179.25 179.83 2wvz h ARG 463 N 0.24 1.01 -0.30 0.00 3.08 -0.81 -2.28 114.38 115.31 2wvz h ARG 463 Ca 0.08 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 2wvz h ARG 463 Cb 0.32 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2wvz h ARG 463 CO 0.00 0.67 0.05 1.15 -1.07 0.00 0.00 179.97 180.78 2wvz h THR 464 N 1.04 1.23 -0.20 2.04 2.02 -0.65 0.40 112.91 118.78 2wvz h THR 464 Ca 0.37 -0.79 -0.11 0.00 0.77 0.00 0.00 66.41 66.65 2wvz h THR 464 Cb 0.14 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 2wvz h THR 464 CO -0.13 0.26 -0.35 -0.07 0.37 0.00 0.00 175.52 175.60 2wvz h LEU 465 N 0.33 0.44 -0.01 2.58 3.38 -0.96 -1.02 115.31 120.04 2wvz h LEU 465 Ca 0.09 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 2wvz h LEU 465 Cb 0.33 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 40.97 2wvz h LEU 465 CO 0.01 0.76 -0.43 -0.33 0.09 0.00 0.00 178.44 178.54 2wvz h GLU 466 N 0.36 0.30 -0.66 1.13 5.08 -1.24 -2.62 114.58 116.93 2wvz h GLU 466 Ca 0.04 -0.31 0.14 0.00 -1.00 0.00 0.00 59.36 58.23 2wvz h GLU 466 Cb 0.79 0.09 -0.11 0.00 0.50 0.00 0.00 28.75 30.02 2wvz h GLU 466 CO 0.06 1.01 0.07 1.88 -1.00 0.00 0.00 179.01 181.03 2wvz h TYR 467 N -0.29 0.07 0.05 4.33 -1.99 -0.82 0.79 116.97 119.12 2wvz h TYR 467 Ca -0.05 0.04 0.02 0.00 2.00 0.00 0.00 58.73 60.74 2wvz h TYR 467 Cb 1.16 0.07 -0.03 0.00 2.00 0.00 0.00 36.73 39.92 2wvz h TYR 467 CO 0.16 -0.14 -0.21 0.00 -0.00 0.00 0.00 178.16 177.98 2wvz h ALA 468 N 1.58 -0.31 -0.59 3.88 0.00 -1.20 0.56 119.26 123.19 2wvz h ALA 468 Ca 0.36 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.29 2wvz h ALA 468 Cb 0.59 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 2wvz h ALA 468 CO -0.52 -0.72 0.35 -0.92 0.00 0.00 0.00 179.25 177.43 2wvz h TYR 469 N -0.36 0.64 -0.83 0.00 3.20 -0.95 -1.16 116.97 117.51 2wvz h TYR 469 Ca 0.04 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.95 2wvz h TYR 469 Cb 0.41 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 2wvz h TYR 469 CO -0.23 0.35 0.55 -0.44 -1.64 0.00 0.00 178.16 176.75 2wvz h ASP 470 N 0.67 0.93 0.27 -2.11 3.32 0.16 0.12 116.42 119.79 2wvz h ASP 470 Ca 0.25 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.17 2wvz h ASP 470 Cb 0.07 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 2wvz h ASP 470 CO -0.13 0.66 -0.42 0.44 -1.72 0.00 0.00 179.24 178.08 2wvz h ASP 471 N 1.09 0.20 -0.81 6.45 3.32 0.54 -1.95 116.42 125.27 2wvz h ASP 471 Ca 0.31 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 2wvz h ASP 471 Cb -0.08 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.38 2wvz h ASP 471 CO -0.08 0.61 0.43 -0.25 -1.72 0.00 0.00 179.24 178.23 2wvz h TRP 472 N 0.16 1.13 -0.31 4.55 7.01 0.46 0.18 115.95 129.13 2wvz h TRP 472 Ca 0.01 -0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.97 2wvz h TRP 472 Cb 0.81 -0.36 -0.01 0.00 -2.10 0.00 0.00 29.16 27.50 2wvz h TRP 472 CO 0.01 0.79 0.15 0.00 -2.79 0.00 0.00 178.44 176.61 2wvz h ILE 474 N 0.37 1.26 -0.37 0.00 2.04 -0.91 -0.29 117.51 119.61 2wvz h ILE 474 Ca 0.11 -0.63 0.07 0.00 1.00 0.00 0.00 64.86 65.40 2wvz h ILE 474 Cb 0.11 0.02 -0.07 0.00 -0.74 0.00 0.00 36.82 36.14 2wvz h ILE 474 CO -0.01 0.29 -0.05 0.22 0.00 0.00 0.00 178.15 178.59 2wvz h TYR 475 N 1.28 -0.12 -0.55 1.37 5.03 -0.09 0.59 116.97 124.48 2wvz h TYR 475 Ca 0.32 0.03 0.06 0.00 2.58 0.00 0.00 58.73 61.72 2wvz h TYR 475 Cb 0.01 0.11 -0.05 0.00 1.55 0.00 0.00 36.73 38.35 2wvz h TYR 475 CO 0.01 -0.12 0.25 0.00 -1.32 0.00 0.00 178.16 176.98 2wvz h ARG 476 N 0.04 0.46 -0.27 1.82 2.47 0.21 0.97 114.38 120.09 2wvz h ARG 476 Ca 0.18 -0.03 -0.12 0.00 -1.26 0.00 0.00 59.98 58.75 2wvz h ARG 476 Cb 0.27 -0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 28.48 2wvz h ARG 476 CO -0.35 0.31 -0.30 1.25 0.56 0.00 0.00 179.97 181.44 2wvz h LEU 477 N 0.48 0.73 -0.51 3.04 5.85 -0.13 -1.09 115.31 123.67 2wvz h LEU 477 Ca 0.25 -0.48 0.10 0.00 0.84 0.00 0.00 57.88 58.58 2wvz h LEU 477 Cb 0.21 -0.20 -0.08 0.00 0.37 0.00 0.00 40.66 40.96 2wvz h LEU 477 CO -0.21 1.06 0.05 0.00 -0.34 0.00 0.00 178.44 179.01 2wvz h ALA 478 N 0.68 0.54 -0.12 1.25 0.00 0.64 -1.24 119.26 121.01 2wvz h ALA 478 Ca 0.04 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2wvz h ALA 478 Cb 0.87 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2wvz h ALA 478 CO 0.07 -0.35 0.06 -0.22 0.00 0.00 0.00 179.25 178.81 2wvz h LYS 479 N 0.18 0.13 0.00 0.00 3.64 -0.66 -2.50 116.57 117.36 2wvz h LYS 479 Ca 0.26 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.60 2wvz h LYS 479 Cb 0.38 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2wvz h LYS 479 CO -0.38 0.08 -0.14 1.49 -2.27 0.00 0.00 179.45 178.24 2wvz h GLU 480 N 0.13 0.00 -0.01 1.90 4.57 -0.44 -2.55 114.58 118.18 2wvz h GLU 480 Ca 0.05 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 2wvz h GLU 480 Cb 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 2wvz h GLU 480 CO -0.03 0.14 -0.04 1.28 -1.18 0.00 0.00 179.01 179.17 2wvz n LEU 481 N -4.32 1.45 -3.50 1.64 4.32 -0.54 -4.95 117.00 111.10 2wvz n LEU 481 Ca -0.03 -0.47 -0.19 0.00 -0.02 0.00 0.00 56.01 55.31 2wvz n LEU 481 Cb 0.21 -0.02 0.08 0.00 -1.62 0.00 0.00 43.42 42.07 2wvz n LEU 481 CO 0.35 0.25 0.10 0.29 -1.22 0.00 0.00 177.39 177.15 2wvz n LYS 482 N 0.06 -6.48 -1.43 3.23 4.01 -0.96 -5.01 118.16 111.58 2wvz n LYS 482 Ca 0.18 0.81 -0.30 0.00 -0.51 0.00 0.00 58.31 58.49 2wvz n LYS 482 Cb 0.36 -5.76 0.19 0.00 -0.51 0.00 0.00 35.03 29.31 2wvz n LYS 482 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2wvz s ARG 483 N -5.57 0.01 0.36 1.97 1.81 -0.97 -4.98 118.95 111.57 2wvz s ARG 483 Ca 0.07 -0.03 -0.27 0.00 -1.72 0.00 0.00 55.73 53.78 2wvz s ARG 483 Cb -0.03 -1.74 -0.09 0.00 -0.45 0.00 0.00 34.95 32.64 2wvz s ARG 483 CO 0.74 -2.90 1.22 -2.14 -0.68 0.00 0.00 175.30 171.54 2wvz s PRO 484 N -5.47 4.21 0.61 3.54 0.02 -1.26 -4.85 135.00 131.80 2wvz s PRO 484 Ca 0.69 1.99 0.31 0.00 0.02 0.00 0.00 61.00 64.01 2wvz s PRO 484 Cb -0.10 -2.88 1.77 0.00 0.02 0.00 0.00 34.50 33.31 2wvz s PRO 484 CO 0.55 -0.23 2.13 0.87 -0.33 0.00 0.00 177.00 179.99 2wvz h LYS 485 N 3.03 0.00 -0.02 5.54 1.79 -1.99 -0.10 116.57 124.82 2wvz h LYS 485 Ca -0.49 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 57.89 2wvz h LYS 485 Cb 1.23 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.87 2wvz h LYS 485 CO 0.64 0.00 -0.45 1.57 -1.08 0.00 0.00 179.45 180.13 2wvz h LYS 486 N 0.00 0.04 0.09 3.15 2.10 -1.99 0.18 116.57 120.15 2wvz h LYS 486 Ca 0.06 -0.02 -0.23 0.00 -2.00 0.00 0.00 60.65 58.46 2wvz h LYS 486 Cb 0.41 -0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.77 2wvz h LYS 486 CO -0.00 0.48 -0.96 0.93 -2.00 0.00 0.00 179.45 177.90 2wvz h GLU 487 N 0.04 0.49 -0.15 0.07 5.08 -1.38 -2.51 114.58 116.21 2wvz h GLU 487 Ca -0.00 -0.65 0.04 0.00 -1.00 0.00 0.00 59.36 57.75 2wvz h GLU 487 Cb 0.81 0.21 -0.04 0.00 0.50 0.00 0.00 28.75 30.23 2wvz h GLU 487 CO 0.06 1.27 -0.09 0.82 -1.00 0.00 0.00 179.01 180.07 2wvz h ILE 488 N 0.01 0.71 -0.64 3.13 2.04 -1.25 -2.30 117.51 119.21 2wvz h ILE 488 Ca -0.15 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.67 2wvz h ILE 488 Cb 1.68 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 38.44 2wvz h ILE 488 CO 0.18 0.00 0.23 0.28 0.00 0.00 0.00 178.15 178.84 2wvz h SER 489 N -0.09 0.88 -0.33 1.72 0.02 -0.73 0.21 113.55 115.24 2wvz h SER 489 Ca 0.09 -0.13 -0.11 0.00 -0.84 0.00 0.00 61.79 60.80 2wvz h SER 489 Cb 0.23 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 2wvz h SER 489 CO -0.21 0.80 -0.17 0.25 -1.14 0.00 0.00 176.83 176.37 2wvz h LEU 490 N 0.93 0.79 0.13 5.07 5.85 -1.19 -0.75 115.31 126.13 2wvz h LEU 490 Ca 0.21 -0.26 -0.28 0.00 0.84 0.00 0.00 57.88 58.39 2wvz h LEU 490 Cb 0.22 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.04 2wvz h LEU 490 CO -0.01 0.95 -1.32 -0.26 -0.34 0.00 0.00 178.44 177.46 2wvz h PHE 491 N 0.70 0.51 -0.47 1.25 0.04 -1.10 -1.90 116.94 115.96 2wvz h PHE 491 Ca 0.11 -0.37 0.10 0.00 2.80 0.00 0.00 57.97 60.60 2wvz h PHE 491 Cb 0.67 -0.02 -0.10 0.00 2.20 0.00 0.00 35.95 38.70 2wvz h PHE 491 CO 0.03 1.32 -0.23 0.00 -0.60 0.00 0.00 178.31 178.83 2wvz h ALA 492 N 0.54 0.10 0.24 2.45 0.00 -0.82 0.21 119.26 121.98 2wvz h ALA 492 Ca -0.16 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2wvz h ALA 492 Cb 1.99 0.56 0.00 0.00 0.00 0.00 0.00 17.79 20.34 2wvz h ALA 492 CO 0.20 -0.58 -0.12 -0.22 0.00 0.00 0.00 179.25 178.54 2wvz h LYS 493 N -0.13 -0.31 -0.54 0.00 3.64 -1.14 -3.01 116.57 115.08 2wvz h LYS 493 Ca 0.22 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.67 2wvz h LYS 493 Cb 0.47 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.33 2wvz h LYS 493 CO -0.55 -0.15 0.36 0.00 -2.27 0.00 0.00 179.45 176.84 2wvz h ARG 494 N -0.41 0.54 -0.50 1.90 3.08 -1.09 -0.90 114.38 117.01 2wvz h ARG 494 Ca -0.03 -0.03 0.14 0.00 0.07 0.00 0.00 59.98 60.13 2wvz h ARG 494 Cb 0.31 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2wvz h ARG 494 CO 0.05 0.36 0.50 0.00 -1.07 0.00 0.00 179.97 179.81 2wvz h ALA 495 N 1.70 2.25 -0.42 0.04 0.00 -0.44 0.10 119.26 122.50 2wvz h ALA 495 Ca 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2wvz h ALA 495 Cb 0.21 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2wvz h ALA 495 CO -0.06 -0.75 0.00 -1.33 0.00 0.00 0.00 179.25 177.10 2wvz n MET 496 N -3.79 2.07 0.32 0.00 2.81 -0.34 -4.36 117.12 113.83 2wvz n MET 496 Ca 0.09 -1.65 0.18 0.00 -1.81 0.00 0.00 57.70 54.51 2wvz n MET 496 Cb 0.70 -1.38 0.95 0.00 -0.71 0.00 0.00 33.22 32.77 2wvz n MET 496 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2wvz h ASN 497 N 2.82 0.00 -0.26 7.83 2.35 -0.91 -0.53 115.58 126.89 2wvz h ASN 497 Ca 0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 2wvz h ASN 497 Cb 0.64 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.99 2wvz h ASN 497 CO 0.00 0.00 0.11 0.10 -1.65 0.00 0.00 177.43 175.99 2wvz h TYR 498 N 0.00 0.43 -0.99 1.19 -0.00 -1.82 -1.44 116.97 114.35 2wvz h TYR 498 Ca 0.00 -0.01 0.25 0.00 -0.00 0.00 0.00 58.73 58.96 2wvz h TYR 498 Cb 0.37 -0.14 -0.07 0.00 -0.00 0.00 0.00 36.73 36.89 2wvz h TYR 498 CO 0.00 0.36 0.65 0.87 -0.00 0.00 0.00 178.16 180.04 2wvz h LYS 499 N 0.44 0.33 0.00 0.10 1.57 -1.45 -2.43 116.57 115.14 2wvz h LYS 499 Ca 0.11 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2wvz h LYS 499 Cb 0.11 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2wvz h LYS 499 CO -0.01 0.22 0.00 0.09 -0.57 0.00 0.00 179.45 179.18 2wvz n ASN 500 N -4.52 0.21 -0.20 0.86 3.02 -0.54 -2.00 115.26 112.10 2wvz n ASN 500 Ca 0.22 0.56 0.04 0.00 -0.03 0.00 0.00 54.58 55.38 2wvz n ASN 500 Cb 0.84 -0.60 0.01 0.00 -0.61 0.00 0.00 39.78 39.41 2wvz n ASN 500 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2wvz n LEU 501 N -1.75 1.17 -4.69 3.41 4.77 -0.91 -4.97 117.00 114.03 2wvz n LEU 501 Ca 0.02 -0.81 -0.42 0.00 -0.03 0.00 0.00 56.01 54.77 2wvz n LEU 501 Cb 0.14 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 2wvz n LEU 501 CO 0.12 0.24 1.02 0.12 -1.33 0.00 0.00 177.39 177.57 2wvz s PHE 502 N -1.06 3.05 -0.44 -1.77 5.36 -0.85 -0.98 117.98 121.30 2wvz s PHE 502 Ca 0.07 1.04 -0.15 0.00 -0.96 0.00 0.00 56.93 56.93 2wvz s PHE 502 Cb 0.06 -3.53 0.05 0.00 -0.34 0.00 0.00 43.02 39.26 2wvz s PHE 502 CO 0.18 -1.80 0.34 0.34 -1.46 0.00 0.00 175.22 172.82 2wvz s ASP 503 N 1.65 6.11 0.39 6.13 -1.08 0.52 -4.95 116.67 125.44 2wvz s ASP 503 Ca 0.59 -1.12 0.12 0.00 -0.52 0.00 0.00 52.55 51.63 2wvz s ASP 503 Cb -0.28 -2.16 0.93 0.00 -1.46 0.00 0.00 42.92 39.95 2wvz s ASP 503 CO 0.24 -0.54 1.90 0.11 0.52 0.00 0.00 175.17 177.39 2wvz h LYS 504 N 8.68 0.54 0.09 4.34 1.57 -1.93 -0.64 116.57 129.22 2wvz h LYS 504 Ca -0.28 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.47 2wvz h LYS 504 Cb 1.11 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2wvz h LYS 504 CO 0.80 0.36 -0.04 0.93 -0.57 0.00 0.00 179.45 180.93 2wvz h GLU 505 N 0.56 -0.11 0.00 3.15 5.08 -1.95 -3.27 114.58 118.04 2wvz h GLU 505 Ca 0.40 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 2wvz h GLU 505 Cb 0.76 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2wvz h GLU 505 CO -0.16 0.23 -0.56 0.66 -1.00 0.00 0.00 179.01 178.18 2wvz h SER 506 N -0.46 0.00 -1.62 1.42 4.64 -1.98 -3.47 113.55 112.08 2wvz h SER 506 Ca -0.01 -0.17 -0.28 0.00 -0.47 0.00 0.00 61.79 60.86 2wvz h SER 506 Cb 0.39 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.44 2wvz h SER 506 CO 0.02 0.08 -0.33 0.29 -0.87 0.00 0.00 176.83 176.02 2wvz n LYS 507 N -2.20 -1.07 -4.41 4.77 5.02 -0.26 -5.01 118.16 115.00 2wvz n LYS 507 Ca 0.03 0.75 -0.20 0.00 -2.02 0.00 0.00 58.31 56.88 2wvz n LYS 507 Cb 0.45 -4.97 -0.10 0.00 -0.02 0.00 0.00 35.03 30.38 2wvz n LYS 507 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wvz s LEU 508 N -3.76 2.12 0.34 -0.35 1.43 -1.21 -4.95 118.68 112.31 2wvz s LEU 508 Ca 0.00 -1.35 -0.19 0.00 -1.03 0.00 0.00 54.13 51.56 2wvz s LEU 508 Cb 0.00 -0.32 -0.10 0.00 0.03 0.00 0.00 46.19 45.80 2wvz s LEU 508 CO 0.00 -0.60 0.82 -0.04 0.23 0.00 0.00 176.35 176.77 2wvz s MET 509 N -3.90 4.17 -0.09 1.70 -1.94 -1.26 -0.35 119.30 117.63 2wvz s MET 509 Ca 0.35 0.91 -0.11 0.00 -1.71 0.00 0.00 55.69 55.13 2wvz s MET 509 Cb 0.08 -2.45 0.03 0.00 2.01 0.00 0.00 34.83 34.50 2wvz s MET 509 CO 0.14 0.14 0.29 0.50 -0.01 0.00 0.00 175.02 176.08 2wvz s ARG 510 N -2.82 0.41 0.38 2.03 3.52 -0.15 -4.84 118.95 117.49 2wvz s ARG 510 Ca 0.55 0.25 -0.26 0.00 -0.13 0.00 0.00 55.73 56.14 2wvz s ARG 510 Cb -0.12 0.19 -0.11 0.00 -1.56 0.00 0.00 34.95 33.36 2wvz s ARG 510 CO 0.17 -0.07 1.18 0.41 -0.81 0.00 0.00 175.30 176.18 2wvz n GLY 511 N 2.54 0.27 3.02 8.12 0.00 -1.26 -4.77 105.19 113.10 2wvz n GLY 511 Ca -0.15 0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 2wvz n GLY 511 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wvz s ARG 512 N -2.00 1.95 0.70 1.61 3.52 -1.26 -1.87 118.95 121.61 2wvz s ARG 512 Ca 0.60 -0.47 -0.15 0.00 -0.13 0.00 0.00 55.73 55.58 2wvz s ARG 512 Cb -0.56 -1.70 0.02 0.00 -1.56 0.00 0.00 34.95 31.16 2wvz s ARG 512 CO 0.59 -0.07 1.15 -0.80 -0.81 0.00 0.00 175.30 175.36 2wvz s ASN 513 N 1.02 4.59 0.39 -2.12 0.01 0.64 0.43 114.94 119.89 2wvz s ASN 513 Ca -0.07 2.16 0.16 0.00 -0.71 0.00 0.00 52.86 54.40 2wvz s ASN 513 Cb -0.15 -2.57 1.03 0.00 0.41 0.00 0.00 41.25 39.98 2wvz s ASN 513 CO -0.01 -1.98 1.80 -0.08 -1.51 0.00 0.00 177.10 175.31 2wvz h GLU 514 N -0.22 0.45 0.00 -0.60 4.81 -1.91 -0.43 114.58 116.67 2wvz h GLU 514 Ca -0.47 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2wvz h GLU 514 Cb 1.27 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.55 2wvz h GLU 514 CO 0.51 0.30 0.00 -0.40 -0.73 0.00 0.00 179.01 178.69 2wvz n ASP 515 N -4.61 0.00 0.00 1.04 5.68 -1.26 -4.91 116.55 112.49 2wvz n ASP 515 Ca 0.23 0.46 0.00 0.00 -0.50 0.00 0.00 54.79 54.98 2wvz n ASP 515 Cb 0.77 -0.49 0.00 0.00 -1.14 0.00 0.00 41.12 40.26 2wvz n ASP 515 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wvz n GLY 516 N 1.19 2.35 3.78 6.12 0.00 -0.17 -5.09 105.19 113.37 2wvz n GLY 516 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 2wvz n GLY 516 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wvz s THR 517 N -2.42 4.08 0.70 2.61 -4.23 -1.26 -4.76 115.64 110.36 2wvz s THR 517 Ca 0.00 1.69 -0.14 0.00 -1.18 0.00 0.00 61.69 62.07 2wvz s THR 517 Cb 0.00 -3.92 0.02 0.00 1.34 0.00 0.00 72.50 69.94 2wvz s THR 517 CO 0.00 0.10 1.11 -0.36 -0.54 0.00 0.00 174.62 174.93 2wvz s PHE 518 N -1.63 2.56 0.32 3.99 0.08 -1.26 -0.26 117.98 121.77 2wvz s PHE 518 Ca 0.52 1.56 -0.27 0.00 0.12 0.00 0.00 56.93 58.86 2wvz s PHE 518 Cb -0.20 -3.15 -0.10 0.00 -0.57 0.00 0.00 43.02 39.00 2wvz s PHE 518 CO 0.25 -1.79 0.96 1.14 -0.10 0.00 0.00 175.22 175.68 2wvz s GLN 519 N -4.32 4.59 0.05 0.44 1.03 -0.78 -4.71 119.66 115.96 2wvz s GLN 519 Ca 0.66 1.38 0.04 0.00 0.04 0.00 0.00 55.36 57.47 2wvz s GLN 519 Cb -0.20 -2.86 -0.03 0.00 0.03 0.00 0.00 33.01 29.96 2wvz s GLN 519 CO 0.46 0.28 -0.11 -1.12 -2.54 0.00 0.00 175.29 172.25 2wvz s SER 520 N -1.53 1.32 0.63 12.60 0.01 -1.26 -4.03 113.70 121.44 2wvz s SER 520 Ca 0.49 -0.55 -0.12 0.00 1.31 0.00 0.00 55.95 57.08 2wvz s SER 520 Cb -0.20 -0.02 -0.02 0.00 0.21 0.00 0.00 66.02 65.98 2wvz s SER 520 CO 0.26 -0.11 1.04 -2.16 0.41 0.00 0.00 173.24 172.68 2wvz s PRO 521 N -1.54 3.31 -0.24 12.44 0.04 -1.26 -5.14 135.00 142.60 2wvz s PRO 521 Ca -0.04 0.94 -0.07 0.00 0.04 0.00 0.00 61.00 61.87 2wvz s PRO 521 Cb -0.09 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 2wvz s PRO 521 CO 0.01 -0.80 0.05 0.12 0.04 0.00 0.00 177.00 176.42 2wvz s PHE 522 N -2.92 3.07 -0.28 0.56 5.36 -1.26 -5.07 117.98 117.44 2wvz s PHE 522 Ca 0.58 -0.49 -0.00 0.00 -0.96 0.00 0.00 56.93 56.06 2wvz s PHE 522 Cb -0.13 -2.21 0.05 0.00 -0.34 0.00 0.00 43.02 40.38 2wvz s PHE 522 CO 0.49 -0.38 -0.05 0.45 -1.46 0.00 0.00 175.22 174.27 2wvz s SER 523 N 1.57 4.64 0.05 6.13 0.15 -1.26 -4.98 113.70 120.00 2wvz s SER 523 Ca 0.06 -1.25 0.10 0.00 0.70 0.00 0.00 55.95 55.55 2wvz s SER 523 Cb -0.15 -1.65 0.44 0.00 -1.71 0.00 0.00 66.02 62.95 2wvz s SER 523 CO 0.03 -0.22 1.31 -0.81 1.20 0.00 0.00 173.24 174.75 2wvz n PRO 524 N 4.56 0.03 -0.02 5.44 -0.04 -1.26 -1.54 135.00 142.17 2wvz n PRO 524 Ca -0.14 0.41 0.12 0.00 -0.04 0.00 0.00 63.50 63.85 2wvz n PRO 524 Cb 0.43 -1.57 0.13 0.00 -0.04 0.00 0.00 33.50 32.45 2wvz n PRO 524 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2wvz n LEU 525 N -1.63 2.99 -4.71 1.53 4.77 -1.26 -2.71 117.00 115.98 2wvz n LEU 525 Ca 0.01 -1.04 -0.42 0.00 -0.03 0.00 0.00 56.01 54.54 2wvz n LEU 525 Cb 0.09 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2wvz n LEU 525 CO 0.08 0.52 0.74 -0.75 -1.33 0.00 0.00 177.39 176.65 2wvz s LYS 526 N -1.94 4.51 0.25 3.23 2.20 -0.59 -1.52 119.74 125.89 2wvz s LYS 526 Ca 0.30 1.48 -0.10 0.00 -0.36 0.00 0.00 55.97 57.29 2wvz s LYS 526 Cb 0.20 -3.46 -0.07 0.00 -1.51 0.00 0.00 37.83 32.99 2wvz s LYS 526 CO 0.30 -0.13 0.57 -1.58 -0.36 0.00 0.00 175.35 174.15 2wvz s TRP 527 N 1.21 3.43 0.00 4.03 0.52 -0.83 -4.24 118.94 123.05 2wvz s TRP 527 Ca 0.53 0.89 0.00 0.00 0.02 0.00 0.00 56.10 57.53 2wvz s TRP 527 Cb -0.22 -2.27 0.00 0.00 -1.15 0.00 0.00 33.47 29.83 2wvz s TRP 527 CO 0.27 0.23 0.00 0.41 0.02 0.00 0.00 176.95 177.88 2wvz n GLY 528 N -0.26 -0.48 6.83 0.98 0.00 -0.50 -4.56 105.19 107.19 2wvz n GLY 528 Ca 0.01 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 2wvz n GLY 528 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2wvz n ASP 529 N -0.22 0.00 0.19 1.61 2.03 -1.26 -0.47 116.55 118.42 2wvz n ASP 529 Ca 0.00 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.36 2wvz n ASP 529 Cb 0.00 0.00 0.34 0.00 -0.72 0.00 0.00 41.12 40.74 2wvz n ASP 529 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wvz h ALA 530 N -0.79 1.07 -1.18 -1.67 0.00 -1.93 0.91 119.26 115.66 2wvz h ALA 530 Ca 0.00 -0.36 -0.63 0.00 0.00 0.00 0.00 54.91 53.92 2wvz h ALA 530 Cb 0.00 -0.06 -0.11 0.00 0.00 0.00 0.00 17.79 17.61 2wvz h ALA 530 CO 0.00 0.49 -0.53 -0.06 0.00 0.00 0.00 179.25 179.15 2wvz s PHE 531 N -3.73 2.28 -0.29 0.00 0.08 0.38 -1.28 117.98 115.41 2wvz s PHE 531 Ca -0.01 -0.75 -0.03 0.00 0.12 0.00 0.00 56.93 56.26 2wvz s PHE 531 Cb 0.12 -1.78 0.03 0.00 -0.57 0.00 0.00 43.02 40.82 2wvz s PHE 531 CO 0.70 0.26 0.02 0.99 -0.10 0.00 0.00 175.22 177.08 2wvz s THR 532 N -2.74 3.28 -1.55 0.64 2.01 -1.26 -3.59 115.64 112.43 2wvz s THR 532 Ca 0.28 -1.12 -0.02 0.00 0.31 0.00 0.00 61.69 61.13 2wvz s THR 532 Cb 0.05 -2.79 0.02 0.00 0.01 0.00 0.00 72.50 69.80 2wvz s THR 532 CO 0.15 -0.01 0.17 -0.62 -0.69 0.00 0.00 174.62 173.62 2wvz n GLU 533 N 4.71 -1.56 -3.85 4.92 1.02 -1.26 -4.85 120.64 119.78 2wvz n GLU 533 Ca -0.14 0.18 -0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2wvz n GLU 533 Cb 0.45 -3.94 0.01 0.00 -0.02 0.00 0.00 31.44 27.94 2wvz n GLU 533 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2wvz s GLY 534 N -4.27 -0.12 0.46 0.62 0.00 -1.26 -4.92 107.32 97.84 2wvz s GLY 534 Ca 0.09 0.07 0.02 0.00 0.00 0.00 0.00 44.72 44.90 2wvz s GLY 534 CO 0.97 2.87 0.06 0.54 0.00 0.00 0.00 173.10 177.54 2wvz s ASN 535 N -3.42 3.51 0.28 1.64 2.20 -1.26 -1.41 114.94 116.48 2wvz s ASN 535 Ca 0.22 -1.67 0.02 0.00 -0.94 0.00 0.00 52.86 50.48 2wvz s ASN 535 Cb -0.00 0.53 0.63 0.00 -2.00 0.00 0.00 41.25 40.41 2wvz s ASN 535 CO 0.01 -0.90 1.74 -1.28 -2.94 0.00 0.00 177.10 173.73 2wvz h SER 536 N 1.55 0.50 -0.00 3.54 0.87 -1.70 0.29 113.55 118.59 2wvz h SER 536 Ca -0.40 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 2wvz h SER 536 Cb 1.30 0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 63.30 2wvz h SER 536 CO 0.66 0.15 0.00 -0.50 -0.53 0.00 0.00 176.83 176.61 2wvz h TRP 537 N 0.56 0.00 0.07 2.24 4.06 -1.93 0.18 115.95 121.12 2wvz h TRP 537 Ca 0.51 0.00 -0.27 0.00 2.06 0.00 0.00 58.89 61.20 2wvz h TRP 537 Cb 0.84 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.98 2wvz h TRP 537 CO -0.09 0.00 -1.43 0.45 -3.56 0.00 0.00 178.44 173.81 2wvz h HIS 538 N 0.00 0.27 0.00 0.49 3.86 -0.83 -3.40 115.15 115.54 2wvz h HIS 538 Ca 0.00 -0.20 -0.10 0.00 -1.16 0.00 0.00 60.37 58.92 2wvz h HIS 538 Cb 0.00 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 2wvz h HIS 538 CO 0.00 1.56 -0.47 1.88 0.86 0.00 0.00 177.93 181.76 2wvz h TYR 539 N -0.51 0.00 -0.28 2.45 -1.99 -0.47 -3.31 116.97 112.86 2wvz h TYR 539 Ca -0.33 0.00 0.08 0.00 2.00 0.00 0.00 58.73 60.48 2wvz h TYR 539 Cb 1.62 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.34 2wvz h TYR 539 CO 0.11 0.47 0.38 1.15 -0.00 0.00 0.00 178.16 180.27 2wvz h THR 540 N 0.00 0.30 -0.01 -2.88 2.02 -0.90 0.22 112.91 111.66 2wvz h THR 540 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2wvz h THR 540 Cb 1.31 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 2wvz h THR 540 CO 0.06 0.00 -0.02 0.79 0.37 0.00 0.00 175.52 176.72 2wvz n TRP 541 N -3.54 0.00 -1.30 3.16 7.02 -1.25 -4.61 117.44 116.92 2wvz n TRP 541 Ca 0.04 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.12 2wvz n TRP 541 Cb 0.51 -0.01 -0.03 0.00 -2.42 0.00 0.00 31.31 29.36 2wvz n TRP 541 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 2wvz n SER 542 N -0.09 3.74 -2.90 -0.99 7.64 0.06 -4.34 113.62 116.74 2wvz n SER 542 Ca 0.19 -2.68 -0.15 0.00 1.01 0.00 0.00 58.87 57.24 2wvz n SER 542 Cb 0.31 -1.33 -0.00 0.00 -1.01 0.00 0.00 64.21 62.18 2wvz n SER 542 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2wvz n VAL 543 N 5.29 0.70 -0.28 0.44 0.31 -1.26 -4.76 118.33 118.77 2wvz n VAL 543 Ca 0.52 -4.03 0.30 0.00 -0.01 0.00 0.00 64.34 61.12 2wvz n VAL 543 Cb 0.35 -0.01 0.68 0.00 -0.91 0.00 0.00 33.84 33.96 2wvz n VAL 543 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2wvz h PHE 544 N 2.97 0.17 -0.00 3.52 -1.00 -1.87 -1.36 116.94 119.37 2wvz h PHE 544 Ca 0.03 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.82 2wvz h PHE 544 Cb 1.02 -0.05 0.00 0.00 3.61 0.00 0.00 35.95 40.54 2wvz h PHE 544 CO 0.53 0.02 -0.49 -2.39 -1.61 0.00 0.00 178.31 174.36 2wvz n HIS 545 N -4.31 0.00 -2.94 -0.55 1.44 -1.26 -4.51 115.22 103.09 2wvz n HIS 545 Ca 0.24 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.81 2wvz n HIS 545 Cb 1.08 -0.15 0.02 0.00 0.12 0.00 0.00 29.99 31.06 2wvz n HIS 545 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 2wvz n ASP 546 N -1.10 -1.15 0.05 4.39 2.03 -0.52 -0.23 116.55 120.02 2wvz n ASP 546 Ca 0.08 -3.27 0.04 0.00 0.52 0.00 0.00 54.79 52.16 2wvz n ASP 546 Cb 0.35 0.78 0.44 0.00 -0.72 0.00 0.00 41.12 41.98 2wvz n ASP 546 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2wvz h PRO 547 N 3.35 0.44 -0.64 -0.67 0.11 -1.78 -2.08 132.00 130.73 2wvz h PRO 547 Ca -0.03 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.99 2wvz h PRO 547 Cb 1.02 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.00 2wvz h PRO 547 CO 0.33 0.32 0.17 0.37 -0.21 0.00 0.00 178.00 178.98 2wvz h GLN 548 N 0.45 0.98 -0.12 1.05 5.75 -1.92 0.27 115.11 121.57 2wvz h GLN 548 Ca 0.12 -0.21 0.04 0.00 -0.15 0.00 0.00 58.65 58.44 2wvz h GLN 548 Cb 0.01 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 28.41 2wvz h GLN 548 CO -0.02 0.86 0.10 0.78 -2.65 0.00 0.00 178.83 177.90 2wvz h GLY 549 N 1.04 0.00 1.03 2.39 0.00 -1.78 0.31 103.07 106.06 2wvz h GLY 549 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.21 2wvz h GLY 549 CO -0.00 0.00 -1.68 -2.00 0.00 0.00 0.00 176.54 172.86 2wvz h LEU 550 N 0.00 0.47 0.50 3.11 5.85 -0.54 -1.74 115.31 122.97 2wvz h LEU 550 Ca 0.06 -0.71 -0.01 0.00 0.84 0.00 0.00 57.88 58.05 2wvz h LEU 550 Cb 0.25 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 2wvz h LEU 550 CO -0.00 1.60 -0.50 0.40 -0.34 0.00 0.00 178.44 179.60 2wvz h ILE 551 N 0.08 0.00 -0.74 4.05 2.04 -0.25 -2.41 117.51 120.28 2wvz h ILE 551 Ca -0.30 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.69 2wvz h ILE 551 Cb 2.05 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 38.00 2wvz h ILE 551 CO 0.16 0.00 -0.26 0.44 0.00 0.00 0.00 178.15 178.49 2wvz h ASP 552 N -1.00 -0.92 -0.68 1.72 3.32 -0.44 0.27 116.42 118.69 2wvz h ASP 552 Ca -0.06 0.24 0.17 0.00 0.02 0.00 0.00 57.03 57.39 2wvz h ASP 552 Cb 0.87 0.54 -0.04 0.00 0.22 0.00 0.00 39.33 40.91 2wvz h ASP 552 CO -0.06 -0.27 0.47 -0.07 -1.72 0.00 0.00 179.24 177.59 2wvz h LEU 553 N -0.05 0.18 0.00 1.55 3.38 -1.07 -2.38 115.31 116.91 2wvz h LEU 553 Ca 0.33 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.31 2wvz h LEU 553 Cb 0.56 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2wvz h LEU 553 CO -0.78 0.09 -0.59 0.23 0.09 0.00 0.00 178.44 177.48 2wvz n MET 554 N -4.41 0.00 0.00 1.13 2.81 0.92 -4.93 117.12 112.64 2wvz n MET 554 Ca 0.13 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 2wvz n MET 554 Cb 0.63 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.63 2wvz n MET 554 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wvz n GLY 555 N 1.50 1.50 0.00 3.03 0.00 -0.90 -4.73 105.19 105.59 2wvz n GLY 555 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2wvz n GLY 555 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvz n GLY 556 N -0.83 2.29 0.34 -0.02 0.00 -0.99 -4.67 105.19 101.30 2wvz n GLY 556 Ca 0.00 -1.94 0.14 0.00 0.00 0.00 0.00 46.02 44.22 2wvz n GLY 556 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2wvz h LYS 557 N 0.00 0.57 -0.34 1.61 2.10 -1.92 -1.11 116.57 117.47 2wvz h LYS 557 Ca 0.00 -0.03 -0.02 0.00 -2.00 0.00 0.00 60.65 58.59 2wvz h LYS 557 Cb 0.00 -0.13 -0.01 0.00 -0.90 0.00 0.00 32.23 31.19 2wvz h LYS 557 CO 0.00 0.38 0.12 0.93 -2.00 0.00 0.00 179.45 178.87 2wvz h GLU 558 N 0.58 0.53 -0.56 0.07 3.07 -1.91 0.64 114.58 117.00 2wvz h GLU 558 Ca 0.59 -0.11 -0.09 0.00 -0.50 0.00 0.00 59.36 59.25 2wvz h GLU 558 Cb 1.05 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.86 2wvz h GLU 558 CO -0.45 0.54 -0.01 0.52 -1.40 0.00 0.00 179.01 178.20 2wvz h MET 559 N 0.40 1.00 0.46 2.33 2.86 -1.50 -1.07 114.93 119.42 2wvz h MET 559 Ca 0.11 -0.33 -0.01 0.00 -2.06 0.00 0.00 59.70 57.42 2wvz h MET 559 Cb 0.23 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 2wvz h MET 559 CO -0.01 1.01 -0.40 0.35 1.06 0.00 0.00 176.91 178.92 2wvz h PHE 560 N 0.89 -1.09 -0.94 -0.22 3.04 -0.98 -0.34 116.94 117.30 2wvz h PHE 560 Ca 0.16 0.00 0.23 0.00 3.98 0.00 0.00 57.97 62.34 2wvz h PHE 560 Cb 0.56 0.41 -0.12 0.00 2.56 0.00 0.00 35.95 39.36 2wvz h PHE 560 CO 0.04 -0.57 0.49 0.28 -2.02 0.00 0.00 178.31 176.53 2wvz h VAL 561 N -0.86 0.52 -0.20 1.41 2.07 -0.81 0.30 116.25 118.69 2wvz h VAL 561 Ca -0.05 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.26 2wvz h VAL 561 Cb 0.75 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2wvz h VAL 561 CO -0.03 0.09 -0.08 0.74 0.02 0.00 0.00 177.57 178.31 2wvz h THR 562 N 0.50 1.17 0.00 2.57 2.02 0.23 -0.67 112.91 118.73 2wvz h THR 562 Ca 0.59 -0.72 -0.11 0.00 0.77 0.00 0.00 66.41 66.94 2wvz h THR 562 Cb 1.11 1.11 0.01 0.00 -1.74 0.00 0.00 68.15 68.64 2wvz h THR 562 CO -0.49 0.23 -0.43 0.24 0.37 0.00 0.00 175.52 175.43 2wvz h MET 563 N 0.29 0.29 -0.34 6.66 2.86 0.56 -3.00 114.93 122.25 2wvz h MET 563 Ca 0.06 -0.32 0.06 0.00 -2.06 0.00 0.00 59.70 57.45 2wvz h MET 563 Cb 0.33 0.09 -0.06 0.00 0.06 0.00 0.00 31.60 32.02 2wvz h MET 563 CO 0.02 1.02 -0.02 0.52 1.06 0.00 0.00 176.91 179.51 2wvz h MET 564 N -0.31 0.07 -0.84 1.72 2.86 -0.79 -2.00 114.93 115.64 2wvz h MET 564 Ca -0.05 -0.00 0.13 0.00 -2.06 0.00 0.00 59.70 57.71 2wvz h MET 564 Cb 1.17 -0.02 -0.09 0.00 0.06 0.00 0.00 31.60 32.73 2wvz h MET 564 CO 0.09 0.05 0.45 -0.44 1.06 0.00 0.00 176.91 178.12 2wvz h ASP 565 N 0.07 0.58 -0.94 1.22 3.32 -1.20 -2.50 116.42 116.97 2wvz h ASP 565 Ca 0.17 0.08 0.13 0.00 0.02 0.00 0.00 57.03 57.43 2wvz h ASP 565 Cb 0.23 -0.02 -0.08 0.00 0.22 0.00 0.00 39.33 39.69 2wvz h ASP 565 CO -0.29 0.27 0.60 0.28 -1.72 0.00 0.00 179.24 178.38 2wvz h SER 566 N 0.68 0.78 -0.99 6.45 0.02 -1.21 -0.73 113.55 118.55 2wvz h SER 566 Ca 0.44 0.05 0.11 0.00 -0.84 0.00 0.00 61.79 61.55 2wvz h SER 566 Cb 0.57 -0.11 -0.08 0.00 0.14 0.00 0.00 62.40 62.92 2wvz h SER 566 CO -0.33 0.40 0.63 0.58 -1.14 0.00 0.00 176.83 176.97 2wvz h VAL 567 N 0.83 0.94 0.00 2.27 2.07 -1.36 0.82 116.25 121.82 2wvz h VAL 567 Ca 0.47 -0.34 -0.15 0.00 0.82 0.00 0.00 66.70 67.50 2wvz h VAL 567 Cb 0.61 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 2wvz h VAL 567 CO -0.24 0.18 -0.72 -0.26 0.02 0.00 0.00 177.57 176.56 2wvz h PHE 568 N 0.99 0.00 0.00 1.57 0.04 -1.26 0.77 116.94 119.05 2wvz h PHE 568 Ca 0.48 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.22 2wvz h PHE 568 Cb 0.46 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.61 2wvz h PHE 568 CO -0.00 0.71 -1.41 0.00 -0.60 0.00 0.00 178.31 177.01 2wvz n ALA 569 N -2.28 2.52 -1.81 2.45 0.00 -0.36 -3.37 120.51 117.66 2wvz n ALA 569 Ca 0.01 -0.39 -0.37 0.00 0.00 0.00 0.00 53.44 52.69 2wvz n ALA 569 Cb 0.82 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 19.26 2wvz n ALA 569 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2wvz s VAL 570 N -3.34 4.24 0.68 0.00 -7.23 0.14 -4.94 120.40 109.95 2wvz s VAL 570 Ca -0.03 1.79 -0.17 0.00 -1.81 0.00 0.00 61.98 61.76 2wvz s VAL 570 Cb 0.11 -4.01 -0.06 0.00 0.56 0.00 0.00 36.38 32.97 2wvz s VAL 570 CO 0.83 0.17 0.42 -2.65 -0.31 0.00 0.00 175.10 173.56 2wvz n PRO 571 N 0.63 0.31 -1.40 4.82 -0.02 -1.26 -3.69 135.00 134.39 2wvz n PRO 571 Ca 0.01 0.14 -0.32 0.00 -2.02 0.00 0.00 63.50 61.31 2wvz n PRO 571 Cb 0.50 -1.70 -0.06 0.00 -0.02 0.00 0.00 33.50 32.22 2wvz n PRO 571 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2wvz n PRO 572 N -0.27 3.39 -1.73 0.52 -0.04 -1.26 -4.53 135.00 131.09 2wvz n PRO 572 Ca 0.10 -2.21 -0.31 0.00 -0.04 0.00 0.00 63.50 61.03 2wvz n PRO 572 Cb 0.49 -2.53 0.04 0.00 -0.04 0.00 0.00 33.50 31.46 2wvz n PRO 572 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2wvz s ILE 573 N 0.80 4.01 0.31 0.52 -0.00 -1.26 -4.80 121.20 120.78 2wvz s ILE 573 Ca 0.65 0.74 -0.16 0.00 -0.00 0.00 0.00 60.65 61.88 2wvz s ILE 573 Cb 0.23 -3.42 0.02 0.00 -0.00 0.00 0.00 42.46 39.30 2wvz s ILE 573 CO -0.07 -0.77 0.67 0.72 -0.00 0.00 0.00 174.94 175.49 2wvz s PHE 574 N -2.88 0.14 -0.21 1.37 -0.12 -1.26 -4.97 117.98 110.05 2wvz s PHE 574 Ca 0.59 -0.63 -0.03 0.00 -0.05 0.00 0.00 56.93 56.82 2wvz s PHE 574 Cb -0.14 0.57 0.07 0.00 -0.63 0.00 0.00 43.02 42.88 2wvz s PHE 574 CO 0.49 -1.28 0.06 0.34 -0.05 0.00 0.00 175.22 174.79 2wvz s ASP 575 N -3.02 2.97 0.00 1.98 -1.08 -0.57 -4.95 116.67 112.00 2wvz s ASP 575 Ca 0.17 -0.91 0.23 0.00 -0.52 0.00 0.00 52.55 51.52 2wvz s ASP 575 Cb -0.04 -0.53 0.22 0.00 -1.46 0.00 0.00 42.92 41.11 2wvz s ASP 575 CO 0.10 -0.34 1.25 -0.90 0.52 0.00 0.00 175.17 175.80 2wvz n ASP 576 N 5.10 2.98 -0.31 -0.34 5.75 -1.26 -1.97 116.55 126.49 2wvz n ASP 576 Ca -0.08 -1.95 0.09 0.00 -0.01 0.00 0.00 54.79 52.84 2wvz n ASP 576 Cb 0.46 -0.04 0.20 0.00 -1.03 0.00 0.00 41.12 40.71 2wvz n ASP 576 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2wvz h SER 577 N 4.43 -0.56 -0.84 -1.12 4.64 -1.92 0.36 113.55 118.55 2wvz h SER 577 Ca 0.00 0.25 0.19 0.00 -0.47 0.00 0.00 61.79 61.77 2wvz h SER 577 Cb 0.95 0.47 -0.12 0.00 -0.31 0.00 0.00 62.40 63.39 2wvz h SER 577 CO 0.00 -0.29 0.32 0.22 -0.87 0.00 0.00 176.83 176.21 2wvz h TYR 578 N 0.04 0.52 0.00 4.77 3.20 -1.81 -2.41 116.97 121.27 2wvz h TYR 578 Ca 0.50 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 62.35 2wvz h TYR 578 Cb 0.91 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.08 2wvz h TYR 578 CO -0.54 -0.05 -0.97 1.88 -1.64 0.00 0.00 178.16 176.84 2wvz h TYR 579 N 0.37 0.00 0.00 -3.82 0.05 -0.61 -3.49 116.97 109.47 2wvz h TYR 579 Ca 0.50 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.28 2wvz h TYR 579 Cb 0.91 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.65 2wvz h TYR 579 CO -0.18 0.21 0.00 0.41 -1.05 0.00 0.00 178.16 177.54 2wvz n GLY 580 N 1.24 0.62 3.46 3.88 0.00 -0.69 -4.96 105.19 108.74 2wvz n GLY 580 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 2wvz n GLY 580 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2wvz s GLN 581 N -0.26 1.16 -1.15 1.61 -2.07 -1.26 -5.05 119.66 112.64 2wvz s GLN 581 Ca 0.00 -0.44 -0.21 0.00 -1.82 0.00 0.00 55.36 52.89 2wvz s GLN 581 Cb 0.00 0.53 0.01 0.00 -1.09 0.00 0.00 33.01 32.46 2wvz s GLN 581 CO 0.00 -0.51 1.74 0.08 -1.32 0.00 0.00 175.29 175.28 2wvz s VAL 582 N -3.57 3.84 0.79 3.63 1.01 -1.26 -4.92 120.40 119.92 2wvz s VAL 582 Ca 0.03 -1.18 -0.14 0.00 0.00 0.00 0.00 61.98 60.69 2wvz s VAL 582 Cb -0.01 -4.85 0.06 0.00 0.00 0.00 0.00 36.38 31.57 2wvz s VAL 582 CO -0.11 -1.62 1.07 2.30 0.00 0.00 0.00 175.10 176.74 2wvz n ILE 583 N 7.05 2.10 -0.12 2.22 -5.35 -1.26 -4.66 119.36 119.35 2wvz n ILE 583 Ca 0.43 -0.25 0.07 0.00 -0.27 0.00 0.00 62.75 62.72 2wvz n ILE 583 Cb 0.48 -1.13 0.40 0.00 -1.74 0.00 0.00 39.64 37.65 2wvz n ILE 583 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 2wvz h HIS 584 N -0.77 0.64 -0.70 4.28 2.07 -1.77 -0.54 115.15 118.36 2wvz h HIS 584 Ca -0.46 0.02 0.02 0.00 -2.85 0.00 0.00 60.37 57.09 2wvz h HIS 584 Cb 1.31 -0.21 -0.04 0.00 2.57 0.00 0.00 27.41 31.04 2wvz h HIS 584 CO 0.44 0.35 0.46 0.93 -3.07 0.00 0.00 177.93 177.04 2wvz h GLU 585 N 0.64 0.89 0.14 5.12 3.07 -1.89 0.38 114.58 122.93 2wvz h GLU 585 Ca 0.26 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.06 2wvz h GLU 585 Cb 0.22 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 2wvz h GLU 585 CO -0.08 0.59 -0.07 0.82 -1.40 0.00 0.00 179.01 178.88 2wvz h ILE 586 N 0.92 1.02 0.02 3.13 2.04 -1.45 -2.72 117.51 120.46 2wvz h ILE 586 Ca 0.26 -0.82 0.03 0.00 1.00 0.00 0.00 64.86 65.34 2wvz h ILE 586 Cb -0.06 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 2wvz h ILE 586 CO -0.06 0.19 -0.31 -0.09 0.00 0.00 0.00 178.15 177.88 2wvz h ARG 587 N -0.59 -0.45 -0.95 2.37 9.65 -0.72 -0.15 114.38 123.54 2wvz h ARG 587 Ca -0.02 0.03 0.25 0.00 -1.10 0.00 0.00 59.98 59.14 2wvz h ARG 587 Cb 0.45 0.10 -0.18 0.00 -1.39 0.00 0.00 29.97 28.96 2wvz h ARG 587 CO 0.03 -0.30 -0.00 0.93 2.80 0.00 0.00 179.97 183.43 2wvz h GLU 588 N -0.47 0.03 -0.03 0.20 5.08 -0.34 0.85 114.58 119.90 2wvz h GLU 588 Ca 0.06 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2wvz h GLU 588 Cb 0.55 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 2wvz h GLU 588 CO -0.25 0.02 0.01 1.98 -1.00 0.00 0.00 179.01 179.77 2wvz h MET 589 N 0.03 0.04 -0.90 2.33 4.05 -0.74 -3.21 114.93 116.54 2wvz h MET 589 Ca 0.56 -0.01 0.10 0.00 -0.28 0.00 0.00 59.70 60.07 2wvz h MET 589 Cb 1.09 -0.01 -0.07 0.00 -0.80 0.00 0.00 31.60 31.82 2wvz h MET 589 CO -0.89 0.26 0.58 1.79 0.23 0.00 0.00 176.91 178.88 2wvz h THR 590 N -0.18 0.95 0.00 -0.77 1.35 0.35 -2.56 112.91 112.05 2wvz h THR 590 Ca 0.01 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 2wvz h THR 590 Cb 0.24 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 66.67 2wvz h THR 590 CO 0.00 0.16 0.00 1.33 -0.25 0.00 0.00 175.52 176.76 2wvz n VAL 591 N -4.54 0.65 0.13 6.82 0.24 -0.92 -3.58 118.33 117.13 2wvz n VAL 591 Ca 0.16 -0.05 0.01 0.00 -2.04 0.00 0.00 64.34 62.42 2wvz n VAL 591 Cb 0.33 -0.81 0.03 0.00 -1.47 0.00 0.00 33.84 31.93 2wvz n VAL 591 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 2wvz h MET 592 N 0.00 0.00 -5.10 7.34 2.86 -1.57 -3.47 114.93 114.99 2wvz h MET 592 Ca 0.00 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.39 2wvz h MET 592 Cb 0.56 0.00 0.16 0.00 0.06 0.00 0.00 31.60 32.38 2wvz h MET 592 CO 0.00 0.56 -0.70 -1.71 1.06 0.00 0.00 176.91 176.13 2wvz n ASN 593 N -3.27 -4.01 -2.50 1.22 4.05 -1.23 -4.92 115.26 104.59 2wvz n ASN 593 Ca 0.01 -0.57 0.01 0.00 0.45 0.00 0.00 54.58 54.48 2wvz n ASN 593 Cb 0.74 -4.49 0.04 0.00 1.23 0.00 0.00 39.78 37.30 2wvz n ASN 593 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 177.26 174.44 2wvz n MET 594 N -3.32 1.34 0.00 1.20 2.81 -1.26 -5.11 117.12 112.77 2wvz n MET 594 Ca -0.15 -3.16 0.00 0.00 -1.81 0.00 0.00 57.70 52.58 2wvz n MET 594 Cb 0.62 -1.23 0.00 0.00 -0.71 0.00 0.00 33.22 31.90 2wvz n MET 594 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wvz n GLY 595 N -0.34 3.36 1.01 3.03 0.00 -1.22 -1.68 105.19 109.36 2wvz n GLY 595 Ca 0.07 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 46.01 2wvz n GLY 595 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wvz n ASN 596 N 4.46 2.94 -4.56 1.61 3.02 0.27 -4.07 115.26 118.93 2wvz n ASN 596 Ca 0.00 -2.01 -0.38 0.00 -0.03 0.00 0.00 54.58 52.17 2wvz n ASN 596 Cb 0.00 -0.37 -0.03 0.00 -0.61 0.00 0.00 39.78 38.77 2wvz n ASN 596 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2wvz s TYR 597 N -1.28 2.20 -1.21 3.10 5.04 -0.68 -4.87 117.35 119.66 2wvz s TYR 597 Ca 0.37 -0.12 -0.11 0.00 -2.44 0.00 0.00 57.07 54.76 2wvz s TYR 597 Cb 0.19 -4.46 0.20 0.00 0.35 0.00 0.00 41.96 38.24 2wvz s TYR 597 CO 0.25 -1.98 1.50 0.00 -1.34 0.00 0.00 175.55 173.98 2wvz n ALA 598 N 10.61 4.38 0.30 3.97 0.00 -1.26 -4.79 120.51 133.73 2wvz n ALA 598 Ca 0.26 -4.37 0.19 0.00 0.00 0.00 0.00 53.44 49.52 2wvz n ALA 598 Cb 0.50 -2.90 0.94 0.00 0.00 0.00 0.00 19.45 17.99 2wvz n ALA 598 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2wvz h HIS 599 N 6.60 0.00 0.00 0.00 2.76 -1.94 -2.19 115.15 120.38 2wvz h HIS 599 Ca 0.31 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.48 2wvz h HIS 599 Cb 0.79 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.75 2wvz h HIS 599 CO 1.08 0.02 0.01 0.41 -1.30 0.00 0.00 177.93 178.15 2wvz n GLY 600 N -0.61 -0.66 3.11 5.26 0.00 -1.26 -4.64 105.19 106.39 2wvz n GLY 600 Ca -0.01 0.09 -0.17 0.00 0.00 0.00 0.00 46.02 45.92 2wvz n GLY 600 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2wvz s ASN 601 N -3.47 1.37 0.47 1.61 2.47 -0.83 -3.89 114.94 112.68 2wvz s ASN 601 Ca -0.01 -0.50 0.14 0.00 0.42 0.00 0.00 52.86 52.92 2wvz s ASN 601 Cb 0.03 -0.05 1.12 0.00 -1.45 0.00 0.00 41.25 40.90 2wvz s ASN 601 CO 0.09 -0.06 2.07 1.56 -3.72 0.00 0.00 177.10 177.04 2wvz h GLN 602 N 4.73 0.23 -0.16 0.43 7.50 -1.86 -3.23 115.11 122.75 2wvz h GLN 602 Ca -0.37 -0.01 -0.07 0.00 0.50 0.00 0.00 58.65 58.69 2wvz h GLN 602 Cb 1.19 -0.05 -0.01 0.00 0.05 0.00 0.00 27.48 28.65 2wvz h GLN 602 CO 0.42 0.15 -0.21 -1.35 -1.50 0.00 0.00 178.83 176.35 2wvz h PRO 603 N 0.24 0.28 -0.01 1.46 0.11 -1.93 -2.47 132.00 129.67 2wvz h PRO 603 Ca 0.14 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.16 2wvz h PRO 603 Cb 0.24 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.32 2wvz h PRO 603 CO -0.03 0.48 -0.26 1.51 -0.21 0.00 0.00 178.00 179.50 2wvz n ILE 604 N -4.19 0.00 0.21 4.15 3.06 -1.22 -4.54 119.36 116.83 2wvz n ILE 604 Ca -0.01 -0.24 0.13 0.00 -2.50 0.00 0.00 62.75 60.13 2wvz n ILE 604 Cb 0.34 0.86 0.67 0.00 0.54 0.00 0.00 39.64 42.06 2wvz n ILE 604 CO 0.00 0.00 0.00 1.56 -2.50 0.00 0.00 176.55 175.61 2wvz h GLN 605 N 2.30 0.00 0.00 9.51 4.20 -1.58 0.89 115.11 130.42 2wvz h GLN 605 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2wvz h GLN 605 Cb 0.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.44 2wvz h GLN 605 CO 0.00 0.00 -1.19 -2.39 -0.67 0.00 0.00 178.83 174.58 2wvz n HIS 606 N -2.39 0.14 -0.30 2.96 1.44 -1.26 -4.68 115.22 111.13 2wvz n HIS 606 Ca -0.01 0.04 0.12 0.00 -2.01 0.00 0.00 57.72 55.85 2wvz n HIS 606 Cb 0.06 -0.33 0.28 0.00 0.12 0.00 0.00 29.99 30.12 2wvz n HIS 606 CO 0.00 0.00 0.00 1.98 -2.81 0.00 0.00 176.34 175.51 2wvz h MET 607 N 0.00 0.44 -0.39 -1.40 -1.53 -1.13 -0.95 114.93 109.97 2wvz h MET 607 Ca 0.00 -0.03 -0.08 0.00 -3.44 0.00 0.00 59.70 56.15 2wvz h MET 607 Cb 0.71 -0.10 -0.02 0.00 -0.55 0.00 0.00 31.60 31.65 2wvz h MET 607 CO 0.00 0.29 -0.10 0.82 0.14 0.00 0.00 176.91 178.07 2wvz h ILE 608 N 0.46 1.25 0.00 1.77 2.04 -1.83 0.22 117.51 121.41 2wvz h ILE 608 Ca 0.53 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 65.30 2wvz h ILE 608 Cb 0.95 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 2wvz h ILE 608 CO -0.48 0.37 0.00 1.88 0.00 0.00 0.00 178.15 179.91 2wvz h TYR 609 N 0.62 0.00 -0.09 1.37 -1.99 -1.52 -1.99 116.97 113.38 2wvz h TYR 609 Ca 0.11 0.00 0.03 0.00 2.00 0.00 0.00 58.73 60.87 2wvz h TYR 609 Cb 0.53 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.26 2wvz h TYR 609 CO 0.02 0.00 0.06 -0.07 -0.00 0.00 0.00 178.16 178.18 2wvz h LEU 610 N 0.00 0.00 -1.59 3.88 3.38 -1.00 -0.64 115.31 119.34 2wvz h LEU 610 Ca 0.00 0.00 0.23 0.00 0.09 0.00 0.00 57.88 58.20 2wvz h LEU 610 Cb 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.84 2wvz h LEU 610 CO 0.00 0.00 0.63 1.88 0.09 0.00 0.00 178.44 181.04 2wvz h TYR 611 N 0.00 0.45 -0.42 1.13 0.05 -1.51 0.76 116.97 117.43 2wvz h TYR 611 Ca 0.04 0.01 0.05 0.00 0.05 0.00 0.00 58.73 58.89 2wvz h TYR 611 Cb 0.17 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.75 2wvz h TYR 611 CO 0.00 0.10 0.28 -0.44 -1.05 0.00 0.00 178.16 177.05 2wvz h ASP 612 N 0.32 0.31 1.45 3.88 5.19 -1.32 -1.50 116.42 124.75 2wvz h ASP 612 Ca 0.49 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.90 2wvz h ASP 612 Cb 1.36 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.80 2wvz h ASP 612 CO -0.16 0.20 0.00 1.88 -3.12 0.00 0.00 179.24 178.04 2wvz h TYR 613 N 0.35 0.00 -0.42 4.55 -1.99 0.40 -2.93 116.97 116.93 2wvz h TYR 613 Ca 0.18 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.91 2wvz h TYR 613 Cb 0.27 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.00 2wvz h TYR 613 CO -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 178.16 178.16 2wvz n ALA 614 N -1.94 2.79 -2.45 3.88 0.00 -0.60 -4.95 120.51 117.24 2wvz n ALA 614 Ca 0.04 -1.71 -0.12 0.00 0.00 0.00 0.00 53.44 51.65 2wvz n ALA 614 Cb 0.41 -0.73 0.01 0.00 0.00 0.00 0.00 19.45 19.13 2wvz n ALA 614 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wvz n GLY 615 N 0.37 -0.06 2.54 0.00 0.00 -1.11 -4.92 105.19 102.01 2wvz n GLY 615 Ca 0.20 -0.33 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 2wvz n GLY 615 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wvz n GLN 616 N -2.37 2.02 0.31 1.61 6.02 -0.99 -4.65 117.38 119.33 2wvz n GLN 616 Ca -0.10 -3.94 0.19 0.00 -0.01 0.00 0.00 57.00 53.14 2wvz n GLN 616 Cb 0.59 -1.84 1.05 0.00 1.02 0.00 0.00 30.24 31.05 2wvz n GLN 616 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2wvz h PRO 617 N 2.93 0.00 0.00 -1.09 0.13 -1.85 0.66 132.00 132.78 2wvz h PRO 617 Ca 0.10 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.15 2wvz h PRO 617 Cb 0.88 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 2wvz h PRO 617 CO 0.64 0.00 -0.39 0.11 -0.23 0.00 0.00 178.00 178.13 2wvz h TRP 618 N 0.00 0.00 -0.44 1.56 0.09 -1.90 -1.66 115.95 113.61 2wvz h TRP 618 Ca 0.01 0.00 -0.14 0.00 0.09 0.00 0.00 58.89 58.85 2wvz h TRP 618 Cb 0.15 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 29.38 2wvz h TRP 618 CO 0.00 0.39 -0.28 0.87 0.09 0.00 0.00 178.44 179.52 2wvz h LYS 619 N 0.00 0.94 -0.08 0.12 1.57 -1.25 -1.17 116.57 116.70 2wvz h LYS 619 Ca -0.00 -0.43 0.01 0.00 -1.87 0.00 0.00 60.65 58.35 2wvz h LYS 619 Cb 0.74 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 2wvz h LYS 619 CO 0.05 1.09 0.02 0.00 -0.57 0.00 0.00 179.45 180.05 2wvz h ALA 620 N 0.88 0.09 -0.44 3.86 0.00 -1.56 -1.00 119.26 121.08 2wvz h ALA 620 Ca 0.09 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.09 2wvz h ALA 620 Cb 0.85 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.58 2wvz h ALA 620 CO 0.08 -0.44 0.04 1.96 0.00 0.00 0.00 179.25 180.88 2wvz h GLN 621 N 0.06 0.15 0.41 0.00 4.20 -1.11 0.40 115.11 119.23 2wvz h GLN 621 Ca 0.03 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 2wvz h GLN 621 Cb 0.02 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.74 2wvz h GLN 621 CO -0.04 0.10 -0.44 -0.92 -0.67 0.00 0.00 178.83 176.86 2wvz h TYR 622 N 0.16 -1.21 -0.46 2.96 3.20 -0.89 -2.78 116.97 117.94 2wvz h TYR 622 Ca 0.22 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.98 2wvz h TYR 622 Cb 0.31 0.47 -0.02 0.00 1.54 0.00 0.00 36.73 39.03 2wvz h TYR 622 CO -0.26 -0.59 -0.18 -1.49 -1.64 0.00 0.00 178.16 174.00 2wvz h TRP 623 N -0.87 1.03 -0.75 -3.82 4.06 -0.25 -2.24 115.95 113.11 2wvz h TRP 623 Ca -0.04 -0.23 0.02 0.00 2.06 0.00 0.00 58.89 60.70 2wvz h TRP 623 Cb 0.78 -0.25 -0.04 0.00 -1.00 0.00 0.00 29.16 28.65 2wvz h TRP 623 CO -0.25 1.01 0.48 -0.07 -3.56 0.00 0.00 178.44 176.06 2wvz h LEU 624 N 0.80 0.82 -0.97 -4.49 3.38 -0.25 -1.16 115.31 113.44 2wvz h LEU 624 Ca 0.11 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 2wvz h LEU 624 Cb 0.72 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2wvz h LEU 624 CO 0.06 0.58 0.04 -0.09 0.09 0.00 0.00 178.44 179.12 2wvz h ARG 625 N 0.97 0.79 -0.89 1.13 9.65 -1.27 0.17 114.38 124.93 2wvz h ARG 625 Ca 0.28 -0.19 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 2wvz h ARG 625 Cb -0.06 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.38 2wvz h ARG 625 CO -0.08 0.77 0.57 1.96 2.80 0.00 0.00 179.97 185.99 2wvz h GLN 626 N 0.75 1.19 -0.12 0.20 1.08 -0.66 0.19 115.11 117.74 2wvz h GLN 626 Ca 0.15 -0.09 -0.08 0.00 -1.45 0.00 0.00 58.65 57.19 2wvz h GLN 626 Cb 0.39 -0.26 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 2wvz h GLN 626 CO 0.01 0.81 -0.24 0.28 -0.95 0.00 0.00 178.83 178.74 2wvz h VAL 627 N 1.22 1.38 -1.00 -0.54 2.07 -0.70 0.70 116.25 119.37 2wvz h VAL 627 Ca 0.32 -1.52 0.01 0.00 0.82 0.00 0.00 66.70 66.34 2wvz h VAL 627 Cb -0.10 2.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.70 2wvz h VAL 627 CO -0.07 0.44 0.65 0.24 0.02 0.00 0.00 177.57 178.86 2wvz h MET 628 N -0.06 1.32 -0.12 1.57 2.86 -0.56 -0.98 114.93 118.95 2wvz h MET 628 Ca 0.00 -0.09 -0.18 0.00 -2.06 0.00 0.00 59.70 57.38 2wvz h MET 628 Cb 0.83 -0.29 0.01 0.00 0.06 0.00 0.00 31.60 32.20 2wvz h MET 628 CO 0.05 0.88 -0.62 -0.44 1.06 0.00 0.00 176.91 177.85 2wvz h ASP 629 N 1.36 0.75 0.00 1.22 3.32 -0.92 -3.38 116.42 118.77 2wvz h ASP 629 Ca 0.36 -0.64 -0.36 0.00 0.02 0.00 0.00 57.03 56.42 2wvz h ASP 629 Cb -0.14 -0.22 -0.07 0.00 0.22 0.00 0.00 39.33 39.12 2wvz h ASP 629 CO -0.08 1.27 -2.35 0.54 -1.72 0.00 0.00 179.24 176.90 2wvz n ARG 630 N -4.11 0.76 -0.01 3.56 1.74 0.23 -4.54 116.66 114.30 2wvz n ARG 630 Ca -0.08 0.05 0.13 0.00 -0.77 0.00 0.00 57.85 57.19 2wvz n ARG 630 Cb 0.66 -1.49 0.46 0.00 -1.02 0.00 0.00 32.46 31.07 2wvz n ARG 630 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2wvz n MET 631 N -2.91 1.76 -3.84 5.56 2.81 -0.38 -4.77 117.12 115.35 2wvz n MET 631 Ca -0.36 -1.11 -0.19 0.00 -1.81 0.00 0.00 57.70 54.23 2wvz n MET 631 Cb 1.06 -1.47 -0.17 0.00 -0.71 0.00 0.00 33.22 31.93 2wvz n MET 631 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 2wvz s TYR 632 N -1.98 0.34 0.11 2.03 1.51 -1.25 -3.12 117.35 114.98 2wvz s TYR 632 Ca 0.36 0.02 0.03 0.00 -1.01 0.00 0.00 57.07 56.47 2wvz s TYR 632 Cb 0.21 -0.52 -0.04 0.00 -0.11 0.00 0.00 41.96 41.50 2wvz s TYR 632 CO 0.33 -0.19 -0.09 0.95 -1.11 0.00 0.00 175.55 175.44 2wvz s THR 633 N 1.49 0.88 -1.43 -0.71 -4.23 0.31 -4.83 115.64 107.13 2wvz s THR 633 Ca -0.03 -1.83 0.29 0.00 -1.18 0.00 0.00 61.69 58.93 2wvz s THR 633 Cb -0.13 -1.57 0.39 0.00 1.34 0.00 0.00 72.50 72.52 2wvz s THR 633 CO -0.03 -0.72 1.86 -0.81 -0.54 0.00 0.00 174.62 174.38 2wvz n PRO 634 N 0.18 0.45 -0.71 3.99 -0.04 -1.26 -4.24 135.00 133.36 2wvz n PRO 634 Ca -0.13 -0.12 -0.11 0.00 -0.04 0.00 0.00 63.50 63.09 2wvz n PRO 634 Cb 0.59 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.63 2wvz n PRO 634 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wvz n GLY 635 N 1.34 -1.24 0.26 0.55 0.00 -1.26 -4.71 105.19 100.13 2wvz n GLY 635 Ca 0.12 -1.69 0.06 0.00 0.00 0.00 0.00 46.02 44.51 2wvz n GLY 635 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wvz h PRO 636 N 0.00 0.13 -1.52 1.61 0.11 -1.92 -2.00 132.00 128.41 2wvz h PRO 636 Ca -0.16 -0.01 -0.63 0.00 0.11 0.00 0.00 66.00 65.31 2wvz h PRO 636 Cb 0.43 -0.03 -0.24 0.00 0.11 0.00 0.00 31.00 31.27 2wvz h PRO 636 CO 0.11 0.16 0.80 -0.40 -0.21 0.00 0.00 178.00 178.45 2wvz n ASP 637 N -4.44 7.30 0.13 -2.05 3.85 -1.26 -0.39 116.55 119.69 2wvz n ASP 637 Ca -0.02 -3.61 -0.02 0.00 -0.71 0.00 0.00 54.79 50.44 2wvz n ASP 637 Cb 0.14 -1.05 0.14 0.00 -1.35 0.00 0.00 41.12 39.00 2wvz n ASP 637 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 2wvz h GLY 638 N 2.64 0.00 -2.53 6.12 0.00 -1.39 -3.46 103.07 104.45 2wvz h GLY 638 Ca 0.52 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 47.39 2wvz h GLY 638 CO 1.32 0.00 -0.35 -0.19 0.00 0.00 0.00 176.54 177.32 2wvz s TYR 639 N -3.47 2.91 -2.06 5.60 1.51 -0.24 -0.53 117.35 121.08 2wvz s TYR 639 Ca -0.01 -0.33 0.22 0.00 -1.01 0.00 0.00 57.07 55.94 2wvz s TYR 639 Cb 0.12 -2.08 0.57 0.00 -0.11 0.00 0.00 41.96 40.46 2wvz s TYR 639 CO 0.77 -0.09 1.48 0.00 -1.11 0.00 0.00 175.55 176.60 2wvz n GLY 641 N 1.55 0.61 3.76 0.00 0.00 -1.24 -4.45 105.19 105.42 2wvz n GLY 641 Ca 0.22 -0.85 -0.38 0.00 0.00 0.00 0.00 46.02 45.02 2wvz n GLY 641 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wvz s ASP 642 N -1.18 5.50 0.01 1.61 1.11 -1.25 -2.14 116.67 120.33 2wvz s ASP 642 Ca 0.02 2.57 -0.18 0.00 0.18 0.00 0.00 52.55 55.14 2wvz s ASP 642 Cb -0.00 -2.62 -0.26 0.00 1.07 0.00 0.00 42.92 41.11 2wvz s ASP 642 CO -0.00 -1.39 1.07 -0.08 1.18 0.00 0.00 175.17 175.95 2wvz h GLU 643 N 1.53 0.47 -5.59 8.23 4.22 -1.47 -3.43 114.58 118.53 2wvz h GLU 643 Ca -0.50 -0.58 -0.27 0.00 0.08 0.00 0.00 59.36 58.08 2wvz h GLU 643 Cb 1.29 0.18 0.17 0.00 0.50 0.00 0.00 28.75 30.88 2wvz h GLU 643 CO 0.58 1.22 -0.82 -0.25 -2.18 0.00 0.00 179.01 177.56 2wvz n ASP 644 N -4.06 -6.49 -2.57 1.04 8.00 -1.26 -1.76 116.55 109.44 2wvz n ASP 644 Ca -0.12 -0.73 -0.21 0.00 0.71 0.00 0.00 54.79 54.44 2wvz n ASP 644 Cb 0.80 -4.87 0.01 0.00 -0.02 0.00 0.00 41.12 37.04 2wvz n ASP 644 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2wvz n ASN 645 N -3.03 -5.95 0.00 -2.24 5.03 -1.26 -2.10 115.26 105.72 2wvz n ASN 645 Ca -0.07 -0.11 0.00 0.00 0.87 0.00 0.00 54.58 55.27 2wvz n ASN 645 Cb 0.61 -4.89 0.00 0.00 -1.02 0.00 0.00 39.78 34.48 2wvz n ASN 645 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2wvz n GLY 646 N -1.20 1.89 0.13 7.41 0.00 -1.25 -4.53 105.19 107.64 2wvz n GLY 646 Ca -0.20 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 2wvz n GLY 646 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2wvz h GLN 647 N 0.38 -0.21 0.00 1.61 5.75 -1.42 0.50 115.11 121.72 2wvz h GLN 647 Ca 0.00 0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.47 2wvz h GLN 647 Cb 0.00 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 2wvz h GLN 647 CO 0.00 0.05 -0.22 1.15 -2.65 0.00 0.00 178.83 177.16 2wvz h THR 648 N -0.47 0.60 0.03 2.39 2.02 -1.58 -1.89 112.91 114.01 2wvz h THR 648 Ca -0.02 -1.01 -0.11 0.00 0.77 0.00 0.00 66.41 66.04 2wvz h THR 648 Cb 0.36 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 2wvz h THR 648 CO 0.04 0.21 -0.54 0.28 0.37 0.00 0.00 175.52 175.88 2wvz h SER 649 N 0.00 0.10 -0.06 4.18 0.02 -1.71 -3.26 113.55 112.81 2wvz h SER 649 Ca -0.00 -0.86 0.02 0.00 -0.84 0.00 0.00 61.79 60.10 2wvz h SER 649 Cb 0.65 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 2wvz h SER 649 CO 0.03 1.23 0.05 0.00 -1.14 0.00 0.00 176.83 177.00 2wvz h ALA 650 N -0.11 1.92 -0.01 3.77 0.00 0.07 -0.35 119.26 124.54 2wvz h ALA 650 Ca -0.13 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2wvz h ALA 650 Cb 1.23 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2wvz h ALA 650 CO -0.02 -0.08 -0.15 2.35 0.00 0.00 0.00 179.25 181.34 2wvz h TRP 651 N 0.00 -0.38 -0.64 0.00 7.01 -1.41 0.88 115.95 121.40 2wvz h TRP 651 Ca 0.03 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.07 2wvz h TRP 651 Cb 0.13 0.17 -0.04 0.00 -2.10 0.00 0.00 29.16 27.33 2wvz h TRP 651 CO 0.00 -0.22 0.39 -0.92 -2.79 0.00 0.00 178.44 174.91 2wvz h TYR 652 N -0.24 0.74 0.10 2.65 5.03 -1.16 0.13 116.97 124.22 2wvz h TYR 652 Ca 0.05 0.02 0.01 0.00 2.58 0.00 0.00 58.73 61.40 2wvz h TYR 652 Cb 0.31 -0.24 -0.02 0.00 1.55 0.00 0.00 36.73 38.33 2wvz h TYR 652 CO -0.21 0.42 -0.14 0.28 -1.32 0.00 0.00 178.16 177.20 2wvz h VAL 653 N 0.78 0.68 0.69 1.81 2.07 -0.74 0.36 116.25 121.90 2wvz h VAL 653 Ca 0.26 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.74 2wvz h VAL 653 Cb 0.02 0.68 0.01 0.00 -1.52 0.00 0.00 31.29 30.47 2wvz h VAL 653 CO -0.10 0.00 -0.33 -0.26 0.02 0.00 0.00 177.57 176.90 2wvz h PHE 654 N -0.28 -0.86 -0.99 1.57 0.04 -0.70 -2.42 116.94 113.30 2wvz h PHE 654 Ca 0.02 -0.02 0.08 0.00 2.80 0.00 0.00 57.97 60.85 2wvz h PHE 654 Cb 0.29 0.29 -0.07 0.00 2.20 0.00 0.00 35.95 38.65 2wvz h PHE 654 CO -0.15 -0.53 0.64 0.77 -0.60 0.00 0.00 178.31 178.43 2wvz h SER 655 N -0.94 0.99 0.57 2.17 0.02 -0.63 -0.16 113.55 115.57 2wvz h SER 655 Ca -0.10 0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 60.80 2wvz h SER 655 Cb 0.72 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 2wvz h SER 655 CO 0.16 0.60 -0.37 0.00 -1.14 0.00 0.00 176.83 176.08 2wvz h ALA 656 N 1.49 1.18 0.00 3.77 0.00 -0.16 -0.43 119.26 125.10 2wvz h ALA 656 Ca 0.44 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 2wvz h ALA 656 Cb 0.27 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2wvz h ALA 656 CO -0.19 0.46 -0.56 -0.07 0.00 0.00 0.00 179.25 178.89 2wvz h LEU 657 N 0.00 0.00 0.00 0.00 3.38 -0.59 0.12 115.31 118.23 2wvz h LEU 657 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wvz h LEU 657 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2wvz h LEU 657 CO 0.05 0.56 0.00 0.61 0.09 0.00 0.00 178.44 179.74 2wvz n GLY 658 N 0.38 1.76 3.71 0.83 0.00 -0.17 -4.45 105.19 107.24 2wvz n GLY 658 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 2wvz n GLY 658 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2wvz s PHE 659 N -2.00 -0.13 -0.20 1.61 -0.12 -1.15 -1.11 117.98 114.87 2wvz s PHE 659 Ca 0.00 -0.12 -0.17 0.00 -0.05 0.00 0.00 56.93 56.59 2wvz s PHE 659 Cb 0.00 0.62 0.06 0.00 -0.63 0.00 0.00 43.02 43.06 2wvz s PHE 659 CO 0.00 -0.71 0.53 -0.47 -0.05 0.00 0.00 175.22 174.51 2wvz s TYR 660 N -3.13 -0.63 -1.13 3.49 6.14 -0.36 -3.76 117.35 117.97 2wvz s TYR 660 Ca 0.12 1.47 -0.21 0.00 0.64 0.00 0.00 57.07 59.09 2wvz s TYR 660 Cb -0.00 0.26 0.03 0.00 0.42 0.00 0.00 41.96 42.67 2wvz s TYR 660 CO 0.00 -0.32 1.65 -1.25 0.64 0.00 0.00 175.55 176.28 2wvz s PRO 661 N 0.61 3.53 0.20 4.97 0.04 -1.26 0.43 135.00 143.51 2wvz s PRO 661 Ca -0.03 -1.36 -0.09 0.00 0.04 0.00 0.00 61.00 59.56 2wvz s PRO 661 Cb -0.05 -5.38 0.13 0.00 0.04 0.00 0.00 34.50 29.24 2wvz s PRO 661 CO -0.04 -2.52 1.76 0.28 0.04 0.00 0.00 177.00 176.52 2wvz h VAL 662 N 6.34 1.25 -3.08 -0.36 2.07 -1.88 -3.36 116.25 117.23 2wvz h VAL 662 Ca 0.28 -0.80 -0.62 0.00 0.82 0.00 0.00 66.70 66.38 2wvz h VAL 662 Cb 0.95 0.41 -0.41 0.00 -1.52 0.00 0.00 31.29 30.73 2wvz h VAL 662 CO 1.40 0.32 -0.68 0.00 0.02 0.00 0.00 177.57 178.63 2wvz n PRO 664 N 2.89 0.91 0.00 0.00 -0.02 -1.26 -1.97 135.00 135.55 2wvz n PRO 664 Ca 0.13 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2wvz n PRO 664 Cb 0.35 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 2wvz n PRO 664 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wvz n GLY 665 N 1.33 2.55 3.95 -1.23 0.00 -1.26 -4.87 105.19 105.66 2wvz n GLY 665 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 2wvz n GLY 665 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wvz s THR 666 N -2.61 2.43 -0.39 2.61 -4.23 -0.83 -4.87 115.64 107.75 2wvz s THR 666 Ca 0.00 -0.45 0.13 0.00 -1.18 0.00 0.00 61.69 60.19 2wvz s THR 666 Cb 0.00 -2.99 0.74 0.00 1.34 0.00 0.00 72.50 71.59 2wvz s THR 666 CO 0.00 0.00 1.62 -0.90 -0.54 0.00 0.00 174.62 174.80 2wvz n ASP 667 N -2.68 5.21 -4.77 3.99 5.75 -1.26 -4.97 116.55 117.83 2wvz n ASP 667 Ca 0.08 -2.80 -0.33 0.00 -0.01 0.00 0.00 54.79 51.73 2wvz n ASP 667 Cb 0.60 -0.66 -0.07 0.00 -1.03 0.00 0.00 41.12 39.96 2wvz n ASP 667 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2wvz s GLU 668 N -2.53 3.01 -0.17 0.11 2.02 -1.26 -0.36 118.70 119.52 2wvz s GLU 668 Ca 0.49 -0.51 0.01 0.00 0.02 0.00 0.00 54.97 54.97 2wvz s GLU 668 Cb 0.37 -2.82 0.03 0.00 0.10 0.00 0.00 34.13 31.80 2wvz s GLU 668 CO 0.15 0.64 -0.16 0.71 0.02 0.00 0.00 175.26 176.62 2wvz s TYR 669 N -1.19 2.50 0.04 1.61 1.51 -0.33 -4.48 117.35 117.01 2wvz s TYR 669 Ca 0.23 -1.49 -0.26 0.00 -1.01 0.00 0.00 57.07 54.53 2wvz s TYR 669 Cb -0.12 -1.75 -0.05 0.00 -0.11 0.00 0.00 41.96 39.94 2wvz s TYR 669 CO 0.14 -0.75 0.82 0.08 -1.11 0.00 0.00 175.55 174.73 2wvz s VAL 670 N 1.38 4.74 0.23 0.71 1.01 0.17 -0.74 120.40 127.91 2wvz s VAL 670 Ca 0.03 1.73 -0.30 0.00 0.00 0.00 0.00 61.98 63.45 2wvz s VAL 670 Cb -0.14 -4.16 -0.09 0.00 0.00 0.00 0.00 36.38 31.99 2wvz s VAL 670 CO -0.11 0.32 1.31 -0.32 0.00 0.00 0.00 175.10 176.30 2wvz s MET 671 N 0.18 4.39 0.00 2.72 1.75 0.20 -1.22 119.30 127.31 2wvz s MET 671 Ca 0.41 2.09 0.00 0.00 -1.25 0.00 0.00 55.69 56.95 2wvz s MET 671 Cb -0.21 -3.16 0.00 0.00 2.84 0.00 0.00 34.83 34.30 2wvz s MET 671 CO 0.24 -0.23 0.00 0.41 -0.65 0.00 0.00 175.02 174.80 2wvz n GLY 672 N 1.97 1.45 3.57 2.11 0.00 -0.27 -4.92 105.19 109.11 2wvz n GLY 672 Ca 0.05 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 2wvz n GLY 672 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2wvz s THR 673 N 1.97 -0.55 0.69 2.61 -1.32 -1.25 -4.71 115.64 113.08 2wvz s THR 673 Ca 0.00 0.03 -0.17 0.00 -1.21 0.00 0.00 61.69 60.34 2wvz s THR 673 Cb 0.00 -0.93 0.01 0.00 -1.51 0.00 0.00 72.50 70.07 2wvz s THR 673 CO 0.00 0.01 1.27 -2.16 -2.21 0.00 0.00 174.62 171.53 2wvz s PRO 674 N 2.33 2.30 -0.21 7.08 0.04 -1.26 -4.52 135.00 140.76 2wvz s PRO 674 Ca -0.07 1.98 0.11 0.00 0.04 0.00 0.00 61.00 63.06 2wvz s PRO 674 Cb -0.09 -1.83 -0.22 0.00 0.04 0.00 0.00 34.50 32.40 2wvz s PRO 674 CO -0.18 -1.77 -0.00 -0.11 0.04 0.00 0.00 177.00 174.98 2wvz n LEU 675 N -2.28 1.22 -4.96 -3.56 7.94 0.03 -4.95 117.00 110.43 2wvz n LEU 675 Ca 0.15 -0.03 -0.22 0.00 -1.11 0.00 0.00 56.01 54.81 2wvz n LEU 675 Cb 0.49 -0.08 -0.01 0.00 0.53 0.00 0.00 43.42 44.34 2wvz n LEU 675 CO 0.47 0.67 0.07 -0.36 -1.11 0.00 0.00 177.39 177.13 2wvz s PHE 676 N -2.51 3.41 0.13 1.96 0.08 -1.26 -4.87 117.98 114.93 2wvz s PHE 676 Ca -0.19 0.10 0.17 0.00 0.12 0.00 0.00 56.93 57.13 2wvz s PHE 676 Cb 0.07 -1.79 0.55 0.00 -0.57 0.00 0.00 43.02 41.28 2wvz s PHE 676 CO 0.74 0.22 1.67 0.87 -0.10 0.00 0.00 175.22 178.62 2wvz h LYS 677 N 0.94 0.00 -2.62 0.44 1.57 -1.52 -3.42 116.57 111.96 2wvz h LYS 677 Ca -0.50 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.17 2wvz h LYS 677 Cb 1.23 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.29 2wvz h LYS 677 CO 0.60 0.43 -0.23 0.21 -0.57 0.00 0.00 179.45 179.88 2wvz s LYS 678 N -3.49 0.47 0.01 3.15 2.20 -1.05 0.96 119.74 121.99 2wvz s LYS 678 Ca 0.01 0.73 0.03 0.00 -0.36 0.00 0.00 55.97 56.37 2wvz s LYS 678 Cb 0.11 0.12 -0.01 0.00 -1.51 0.00 0.00 37.83 36.53 2wvz s LYS 678 CO 0.70 -0.11 -0.10 0.00 -0.36 0.00 0.00 175.35 175.48 2wvz s ALA 679 N 0.85 0.82 -0.11 3.13 0.00 -0.28 -0.86 121.76 125.31 2wvz s ALA 679 Ca -0.05 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.41 2wvz s ALA 679 Cb -0.06 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.91 2wvz s ALA 679 CO -0.07 0.18 -0.11 0.99 0.00 0.00 0.00 175.76 176.75 2wvz s THR 680 N -0.43 1.21 -0.26 0.00 2.01 0.13 -0.03 115.64 118.28 2wvz s THR 680 Ca 0.02 -0.43 -0.12 0.00 0.31 0.00 0.00 61.69 61.47 2wvz s THR 680 Cb -0.05 -1.16 -0.05 0.00 0.01 0.00 0.00 72.50 71.25 2wvz s THR 680 CO -0.00 0.39 0.21 -0.76 -0.69 0.00 0.00 174.62 173.77 2wvz s LEU 681 N 1.39 4.07 -0.33 4.42 1.43 -0.54 -1.14 118.68 127.98 2wvz s LEU 681 Ca -0.00 0.11 -0.11 0.00 -1.03 0.00 0.00 54.13 53.10 2wvz s LEU 681 Cb -0.13 -2.18 -0.01 0.00 0.03 0.00 0.00 46.19 43.90 2wvz s LEU 681 CO -0.06 -0.02 0.19 -1.00 0.23 0.00 0.00 176.35 175.70 2wvz s HIS 682 N 1.46 3.20 0.45 0.29 3.76 0.51 -1.26 115.29 123.70 2wvz s HIS 682 Ca 0.09 -0.48 -0.04 0.00 -0.15 0.00 0.00 55.06 54.48 2wvz s HIS 682 Cb -0.15 -2.41 -0.03 0.00 1.11 0.00 0.00 32.58 31.10 2wvz s HIS 682 CO 0.08 -0.44 0.73 -0.06 -0.85 0.00 0.00 174.74 174.19 2wvz s PHE 683 N 1.65 3.53 0.58 1.40 0.08 -0.20 -4.82 117.98 120.20 2wvz s PHE 683 Ca 0.05 0.67 0.38 0.00 0.12 0.00 0.00 56.93 58.15 2wvz s PHE 683 Cb -0.17 -2.21 2.08 0.00 -0.57 0.00 0.00 43.02 42.15 2wvz s PHE 683 CO 0.08 -0.19 2.29 0.93 -0.10 0.00 0.00 175.22 178.22 2wvz h GLU 684 N 0.35 0.00 -0.04 0.44 5.08 -1.86 -2.52 114.58 116.02 2wvz h GLU 684 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2wvz h GLU 684 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2wvz h GLU 684 CO 0.61 0.01 0.00 0.27 -1.00 0.00 0.00 179.01 178.91 2wvz n ASN 685 N -3.38 0.54 0.00 1.42 2.04 -1.26 -4.87 115.26 109.75 2wvz n ASN 685 Ca -0.03 -1.44 0.00 0.00 -0.44 0.00 0.00 54.58 52.67 2wvz n ASN 685 Cb 0.11 -0.03 0.00 0.00 -2.53 0.00 0.00 39.78 37.33 2wvz n ASN 685 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2wvz n GLY 686 N 0.93 0.77 3.92 4.83 0.00 -0.95 -5.05 105.19 109.64 2wvz n GLY 686 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 2wvz n GLY 686 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wvz s ASN 687 N -2.52 6.16 0.14 1.61 0.01 -1.26 -4.90 114.94 114.18 2wvz s ASN 687 Ca 0.00 0.70 0.03 0.00 -0.71 0.00 0.00 52.86 52.88 2wvz s ASN 687 Cb 0.00 -2.06 -0.04 0.00 0.41 0.00 0.00 41.25 39.56 2wvz s ASN 687 CO 0.00 -0.55 -0.06 -0.44 -1.51 0.00 0.00 177.10 174.53 2wvz s SER 688 N -4.12 1.44 -0.07 -1.22 0.01 -1.26 -1.03 113.70 107.46 2wvz s SER 688 Ca 0.46 -1.05 -0.01 0.00 1.31 0.00 0.00 55.95 56.66 2wvz s SER 688 Cb -0.10 0.05 0.03 0.00 0.21 0.00 0.00 66.02 66.21 2wvz s SER 688 CO 0.42 -0.44 0.00 -0.22 0.41 0.00 0.00 173.24 173.41 2wvz s LEU 689 N -3.13 0.63 -0.22 2.44 2.96 -0.39 -1.58 118.68 119.38 2wvz s LEU 689 Ca 0.17 -0.08 -0.09 0.00 -0.22 0.00 0.00 54.13 53.91 2wvz s LEU 689 Cb 0.04 -0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.27 2wvz s LEU 689 CO -0.00 -0.19 0.12 -0.69 -1.32 0.00 0.00 176.35 174.27 2wvz s VAL 690 N 1.89 5.05 -0.40 1.68 1.01 -0.06 -1.46 120.40 128.11 2wvz s VAL 690 Ca 0.04 0.07 -0.10 0.00 0.00 0.00 0.00 61.98 61.99 2wvz s VAL 690 Cb -0.12 -3.33 0.06 0.00 0.00 0.00 0.00 36.38 32.98 2wvz s VAL 690 CO -0.05 0.38 0.23 -0.63 0.00 0.00 0.00 175.10 175.04 2wvz s ILE 691 N 0.92 4.32 -0.37 2.22 1.01 0.96 0.34 121.20 130.60 2wvz s ILE 691 Ca 0.06 -1.21 -0.13 0.00 0.00 0.00 0.00 60.65 59.37 2wvz s ILE 691 Cb -0.13 -3.55 0.00 0.00 0.01 0.00 0.00 42.46 38.78 2wvz s ILE 691 CO 0.03 -0.40 0.25 -0.62 0.00 0.00 0.00 174.94 174.20 2wvz s ASP 692 N 1.90 6.00 -0.51 3.58 2.15 0.12 -1.13 116.67 128.77 2wvz s ASP 692 Ca 0.02 -0.66 0.07 0.00 0.43 0.00 0.00 52.55 52.42 2wvz s ASP 692 Cb -0.22 -2.12 0.31 0.00 -0.30 0.00 0.00 42.92 40.60 2wvz s ASP 692 CO 0.04 -0.32 0.80 0.00 -0.17 0.00 0.00 175.17 175.52 2wvz n ALA 693 N 5.10 3.60 -0.01 3.66 0.00 0.27 0.29 120.51 133.43 2wvz n ALA 693 Ca -0.12 -4.22 0.19 0.00 0.00 0.00 0.00 53.44 49.29 2wvz n ALA 693 Cb 0.48 -0.82 0.66 0.00 0.00 0.00 0.00 19.45 19.77 2wvz n ALA 693 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2wvz h PRO 694 N 3.34 0.05 -0.16 0.00 0.13 -1.75 0.11 132.00 133.72 2wvz h PRO 694 Ca 0.13 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2wvz h PRO 694 Cb 0.70 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.82 2wvz h PRO 694 CO 0.70 0.04 0.00 -1.71 -0.23 0.00 0.00 178.00 176.79 2wvz n ASN 695 N -4.40 2.02 -4.74 1.44 5.15 -1.26 -4.94 115.26 108.53 2wvz n ASN 695 Ca 0.10 -1.74 -0.41 0.00 -0.60 0.00 0.00 54.58 51.93 2wvz n ASN 695 Cb 0.57 -0.10 0.01 0.00 -0.53 0.00 0.00 39.78 39.74 2wvz n ASN 695 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2wvz n ASN 696 N 0.56 3.02 -3.09 1.20 2.85 0.39 -4.78 115.26 115.41 2wvz n ASN 696 Ca 0.17 1.13 -0.06 0.00 -0.11 0.00 0.00 54.58 55.71 2wvz n ASN 696 Cb 0.40 -1.56 0.02 0.00 1.24 0.00 0.00 39.78 39.89 2wvz n ASN 696 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 2wvz s SER 697 N -0.46 0.03 0.41 1.20 1.04 -1.25 -4.85 113.70 109.81 2wvz s SER 697 Ca 0.60 -0.94 0.08 0.00 0.48 0.00 0.00 55.95 56.18 2wvz s SER 697 Cb -0.48 0.67 0.86 0.00 0.10 0.00 0.00 66.02 67.17 2wvz s SER 697 CO 0.59 -1.34 2.02 0.74 0.98 0.00 0.00 173.24 176.22 2wvz h THR 698 N 2.00 1.12 0.00 2.02 2.02 -1.96 -3.02 112.91 115.08 2wvz h THR 698 Ca -0.30 -0.37 -0.07 0.00 0.77 0.00 0.00 66.41 66.43 2wvz h THR 698 Cb 1.23 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 2wvz h THR 698 CO 0.40 0.14 -1.85 -0.62 0.37 0.00 0.00 175.52 173.96 2wvz n GLU 699 N -4.42 0.65 -2.62 6.66 4.71 -1.26 -4.67 120.64 119.69 2wvz n GLU 699 Ca 0.01 -0.08 -0.43 0.00 -0.01 0.00 0.00 57.16 56.66 2wvz n GLU 699 Cb 0.13 -1.60 0.01 0.00 -1.01 0.00 0.00 31.44 28.97 2wvz n GLU 699 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2wvz n ASN 700 N -2.46 5.51 -0.04 1.62 5.03 -1.14 -4.07 115.26 119.71 2wvz n ASN 700 Ca -0.08 -3.18 0.08 0.00 0.87 0.00 0.00 54.58 52.26 2wvz n ASN 700 Cb 0.69 -1.42 -0.09 0.00 -1.02 0.00 0.00 39.78 37.93 2wvz n ASN 700 CO 0.00 0.00 0.00 2.22 -1.83 0.00 0.00 177.26 177.65 2wvz n PHE 701 N 3.24 0.00 -2.58 3.10 1.16 -0.99 -3.88 117.46 117.51 2wvz n PHE 701 Ca 0.35 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.56 2wvz n PHE 701 Cb 0.36 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.19 2wvz n PHE 701 CO 0.00 0.00 0.00 0.71 -1.87 0.00 0.00 176.76 175.60 2wvz s TYR 702 N -2.59 3.37 -0.38 2.97 2.02 -0.63 -4.79 117.35 117.33 2wvz s TYR 702 Ca 0.07 1.67 -0.19 0.00 -0.37 0.00 0.00 57.07 58.26 2wvz s TYR 702 Cb 0.13 -3.11 0.01 0.00 -0.40 0.00 0.00 41.96 38.59 2wvz s TYR 702 CO 0.69 -0.48 0.56 0.42 -1.57 0.00 0.00 175.55 175.17 2wvz s ILE 703 N -1.60 4.95 0.07 2.71 1.01 -1.26 -1.24 121.20 125.84 2wvz s ILE 703 Ca 0.55 0.23 0.06 0.00 0.00 0.00 0.00 60.65 61.48 2wvz s ILE 703 Cb -0.22 -4.06 -0.23 0.00 0.01 0.00 0.00 42.46 37.96 2wvz s ILE 703 CO 0.28 -0.36 1.08 -0.78 0.00 0.00 0.00 174.94 175.16 2wvz h ASP 704 N 8.61 0.09 -5.01 3.58 3.58 -0.27 -3.42 116.42 123.58 2wvz h ASP 704 Ca -0.27 -0.11 0.16 0.00 0.42 0.00 0.00 57.03 57.23 2wvz h ASP 704 Cb 1.11 -0.03 -0.12 0.00 1.72 0.00 0.00 39.33 42.01 2wvz h ASP 704 CO 0.82 1.09 0.52 -0.94 -2.88 0.00 0.00 179.24 177.85 2wvz s SER 705 N -6.66 -0.25 0.10 2.28 1.04 -1.22 -4.94 113.70 104.04 2wvz s SER 705 Ca -0.02 -0.19 0.04 0.00 0.48 0.00 0.00 55.95 56.26 2wvz s SER 705 Cb 0.09 0.41 -0.04 0.00 0.10 0.00 0.00 66.02 66.58 2wvz s SER 705 CO 0.83 -0.72 -0.10 -0.04 0.98 0.00 0.00 173.24 174.19 2wvz s MET 706 N -3.13 0.85 0.04 4.02 -1.94 -1.26 -0.80 119.30 117.08 2wvz s MET 706 Ca 0.09 -1.16 0.03 0.00 -1.71 0.00 0.00 55.69 52.94 2wvz s MET 706 Cb -0.01 -0.54 -0.02 0.00 2.01 0.00 0.00 34.83 36.27 2wvz s MET 706 CO -0.04 0.08 -0.10 -1.54 -0.01 0.00 0.00 175.02 173.42 2wvz s SER 707 N -2.45 1.15 -0.40 3.03 1.04 -0.17 -1.89 113.70 114.01 2wvz s SER 707 Ca 0.06 -0.48 -0.00 0.00 0.48 0.00 0.00 55.95 56.01 2wvz s SER 707 Cb -0.03 -0.03 0.11 0.00 0.10 0.00 0.00 66.02 66.18 2wvz s SER 707 CO 0.00 -0.09 0.16 0.12 0.98 0.00 0.00 173.24 174.41 2wvz s PHE 708 N -1.07 3.63 -1.16 5.02 2.19 0.58 -0.06 117.98 127.12 2wvz s PHE 708 Ca -0.04 -2.67 -0.02 0.00 0.33 0.00 0.00 56.93 54.53 2wvz s PHE 708 Cb -0.08 -3.11 0.00 0.00 -1.31 0.00 0.00 43.02 38.52 2wvz s PHE 708 CO 0.01 -0.95 0.98 0.09 1.83 0.00 0.00 175.22 177.17 2wvz n ASN 709 N 4.36 -2.98 0.00 6.13 5.03 -0.20 -2.79 115.26 124.81 2wvz n ASN 709 Ca 0.01 -0.56 0.00 0.00 0.87 0.00 0.00 54.58 54.89 2wvz n ASN 709 Cb 0.41 -4.81 0.00 0.00 -1.02 0.00 0.00 39.78 34.36 2wvz n ASN 709 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2wvz n GLY 710 N -1.31 2.86 3.71 7.41 0.00 -1.26 -4.99 105.19 111.62 2wvz n GLY 710 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 2wvz n GLY 710 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wvz s ALA 711 N -1.17 3.31 0.53 4.61 0.00 -1.12 -5.03 121.76 122.89 2wvz s ALA 711 Ca 0.00 0.22 -0.22 0.00 0.00 0.00 0.00 51.96 51.96 2wvz s ALA 711 Cb 0.00 -3.07 -0.06 0.00 0.00 0.00 0.00 23.12 19.99 2wvz s ALA 711 CO 0.00 -0.19 1.33 -3.47 0.00 0.00 0.00 175.76 173.43 2wvz n ASP 712 N 3.95 2.61 -3.77 0.00 2.03 -1.26 -0.31 116.55 119.79 2wvz n ASP 712 Ca 0.01 1.00 -0.29 0.00 0.52 0.00 0.00 54.79 56.03 2wvz n ASP 712 Cb 0.51 -1.56 -0.16 0.00 -0.72 0.00 0.00 41.12 39.19 2wvz n ASP 712 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 2wvz s HIS 713 N -1.28 1.43 -0.25 -0.67 5.65 -0.79 -4.74 115.29 114.63 2wvz s HIS 713 Ca 0.70 -1.22 0.22 0.00 0.25 0.00 0.00 55.06 55.01 2wvz s HIS 713 Cb -0.43 -1.28 -0.31 0.00 -1.18 0.00 0.00 32.58 29.38 2wvz s HIS 713 CO 0.51 -0.70 0.58 0.25 -0.65 0.00 0.00 174.74 174.73 2wvz n THR 714 N 4.94 0.01 -1.45 0.89 -2.24 -1.26 -4.04 114.28 111.12 2wvz n THR 714 Ca -0.08 -0.39 -0.34 0.00 -2.27 0.00 0.00 64.05 60.98 2wvz n THR 714 Cb 0.45 0.22 0.09 0.00 -2.10 0.00 0.00 70.33 68.99 2wvz n THR 714 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2wvz s LYS 715 N -3.40 2.21 -0.34 -0.78 1.02 -1.26 -3.67 119.74 113.51 2wvz s LYS 715 Ca -0.04 1.66 0.04 0.00 0.02 0.00 0.00 55.97 57.65 2wvz s LYS 715 Cb 0.14 -1.85 0.56 0.00 -0.52 0.00 0.00 37.83 36.17 2wvz s LYS 715 CO 0.90 -1.76 1.72 0.09 -0.92 0.00 0.00 175.35 175.38 2wvz n ASN 716 N -2.76 3.79 -3.59 2.83 5.03 -0.54 -4.92 115.26 115.09 2wvz n ASN 716 Ca 0.13 -3.24 -0.11 0.00 0.87 0.00 0.00 54.58 52.23 2wvz n ASN 716 Cb 0.51 -0.76 -0.03 0.00 -1.02 0.00 0.00 39.78 38.47 2wvz n ASN 716 CO 0.00 0.00 0.00 -0.72 -1.83 0.00 0.00 177.26 174.71 2wvz s TYR 717 N -2.66 -0.31 0.03 3.10 1.13 -1.26 -0.63 117.35 116.75 2wvz s TYR 717 Ca 0.46 0.02 0.05 0.00 -1.41 0.00 0.00 57.07 56.19 2wvz s TYR 717 Cb 0.39 0.43 -0.02 0.00 -1.10 0.00 0.00 41.96 41.65 2wvz s TYR 717 CO 0.10 -0.83 -0.14 -0.51 -2.51 0.00 0.00 175.55 171.65 2wvz s LEU 718 N -2.81 2.14 -0.11 -3.49 1.43 0.08 -4.90 118.68 111.03 2wvz s LEU 718 Ca 0.04 -0.42 -0.13 0.00 -1.03 0.00 0.00 54.13 52.59 2wvz s LEU 718 Cb -0.00 -0.65 -0.05 0.00 0.03 0.00 0.00 46.19 45.52 2wvz s LEU 718 CO -0.09 0.07 0.31 -0.13 0.23 0.00 0.00 176.35 176.74 2wvz s ARG 719 N -0.97 4.03 0.16 1.70 0.52 -1.26 -1.18 118.95 121.95 2wvz s ARG 719 Ca 0.03 0.17 -0.26 0.00 -0.52 0.00 0.00 55.73 55.14 2wvz s ARG 719 Cb -0.07 -3.33 0.01 0.00 0.52 0.00 0.00 34.95 32.08 2wvz s ARG 719 CO 0.01 0.45 1.57 1.25 0.02 0.00 0.00 175.30 178.61 2wvz h HIS 720 N 5.83 -1.24 -0.96 -0.53 -0.00 -1.08 -0.42 115.15 116.75 2wvz h HIS 720 Ca -0.46 0.07 0.23 0.00 -0.00 0.00 0.00 60.37 60.20 2wvz h HIS 720 Cb 1.19 0.61 -0.07 0.00 -0.00 0.00 0.00 27.41 29.13 2wvz h HIS 720 CO 0.66 -0.43 0.63 1.49 -0.00 0.00 0.00 177.93 180.28 2wvz h GLU 721 N -0.30 0.39 0.05 5.26 4.81 -1.95 -1.04 114.58 121.80 2wvz h GLU 721 Ca 0.15 -0.02 -0.23 0.00 -0.13 0.00 0.00 59.36 59.13 2wvz h GLU 721 Cb 0.58 -0.09 0.02 0.00 0.63 0.00 0.00 28.75 29.89 2wvz h GLU 721 CO -0.60 0.26 -0.92 -0.44 -0.73 0.00 0.00 179.01 176.57 2wvz h ASP 722 N 0.40 0.73 -0.55 1.04 3.32 -1.52 -3.14 116.42 116.70 2wvz h ASP 722 Ca 0.51 -0.79 0.01 0.00 0.02 0.00 0.00 57.03 56.78 2wvz h ASP 722 Cb 1.30 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.59 2wvz h ASP 722 CO -0.21 1.44 0.35 -0.07 -1.72 0.00 0.00 179.24 179.03 2wvz h LEU 723 N 0.11 0.60 -2.37 1.55 3.38 -0.48 -0.20 115.31 117.90 2wvz h LEU 723 Ca -0.13 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.84 2wvz h LEU 723 Cb 1.62 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.23 2wvz h LEU 723 CO 0.18 0.43 0.20 -0.26 0.09 0.00 0.00 178.44 179.08 2wvz h PHE 724 N 0.71 0.00 0.00 1.13 -1.00 -1.24 -1.75 116.94 114.79 2wvz h PHE 724 Ca 0.21 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.89 2wvz h PHE 724 Cb -0.05 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.50 2wvz h PHE 724 CO -0.04 0.00 -0.48 0.87 -1.61 0.00 0.00 178.31 177.04 2wvz h LYS 725 N 0.00 0.00 0.00 1.51 1.57 -0.97 -3.45 116.57 115.23 2wvz h LYS 725 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2wvz h LYS 725 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2wvz h LYS 725 CO -0.00 0.48 0.00 0.41 -0.57 0.00 0.00 179.45 179.77 2wvz n GLY 726 N 0.68 -1.85 0.00 3.86 0.00 -0.66 -4.81 105.19 102.41 2wvz n GLY 726 Ca 0.01 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2wvz n GLY 726 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvz n GLY 727 N 0.00 0.66 2.94 -0.02 0.00 -0.62 -4.90 105.19 103.25 2wvz n GLY 727 Ca 0.00 -1.72 -0.13 0.00 0.00 0.00 0.00 46.02 44.17 2wvz n GLY 727 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wvz s THR 728 N 0.00 -0.04 -0.13 2.61 2.01 -1.26 -0.88 115.64 117.95 2wvz s THR 728 Ca 0.00 0.15 -0.02 0.00 0.31 0.00 0.00 61.69 62.13 2wvz s THR 728 Cb 0.00 -0.24 -0.02 0.00 0.01 0.00 0.00 72.50 72.25 2wvz s THR 728 CO 0.00 0.06 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.29 2wvz s ILE 729 N 0.98 3.64 -0.17 1.82 1.01 0.15 -1.03 121.20 127.60 2wvz s ILE 729 Ca -0.07 -0.46 -0.04 0.00 0.00 0.00 0.00 60.65 60.08 2wvz s ILE 729 Cb -0.10 -2.56 -0.02 0.00 0.01 0.00 0.00 42.46 39.79 2wvz s ILE 729 CO -0.05 0.52 -0.03 -0.75 0.00 0.00 0.00 174.94 174.63 2wvz s LYS 730 N 0.15 3.63 -0.18 2.79 2.20 0.92 0.13 119.74 129.38 2wvz s LYS 730 Ca -0.03 -0.53 0.01 0.00 -0.36 0.00 0.00 55.97 55.06 2wvz s LYS 730 Cb -0.14 -2.97 0.02 0.00 -1.51 0.00 0.00 37.83 33.23 2wvz s LYS 730 CO 0.03 0.14 -0.19 0.08 -0.36 0.00 0.00 175.35 175.06 2wvz s VAL 731 N 0.63 2.11 -0.62 4.02 1.01 0.15 -1.00 120.40 126.70 2wvz s VAL 731 Ca -0.02 -0.95 -0.22 0.00 0.00 0.00 0.00 61.98 60.79 2wvz s VAL 731 Cb -0.14 -1.90 0.07 0.00 0.00 0.00 0.00 36.38 34.40 2wvz s VAL 731 CO 0.02 0.51 0.91 -1.81 0.00 0.00 0.00 175.10 174.73 2wvz s ASP 732 N 1.29 6.20 0.37 3.32 1.01 0.02 -4.34 116.67 124.54 2wvz s ASP 732 Ca 0.04 -0.93 -0.17 0.00 0.71 0.00 0.00 52.55 52.21 2wvz s ASP 732 Cb -0.13 -2.40 -0.09 0.00 1.01 0.00 0.00 42.92 41.30 2wvz s ASP 732 CO -0.12 -1.33 0.82 -0.04 0.21 0.00 0.00 175.17 174.71 2wvz s MET 733 N 3.79 4.06 0.17 8.23 -1.94 -1.26 0.49 119.30 132.84 2wvz s MET 733 Ca 0.22 0.82 -0.17 0.00 -1.71 0.00 0.00 55.69 54.85 2wvz s MET 733 Cb -0.17 -2.33 0.03 0.00 2.01 0.00 0.00 34.83 34.37 2wvz s MET 733 CO 0.11 0.06 0.49 0.45 -0.01 0.00 0.00 175.02 176.12 2wvz s SER 734 N -2.33 -0.27 0.00 3.03 0.15 -0.37 -4.81 113.70 109.09 2wvz s SER 734 Ca 0.57 -0.41 0.27 0.00 0.70 0.00 0.00 55.95 57.09 2wvz s SER 734 Cb -0.10 0.54 0.95 0.00 -1.71 0.00 0.00 66.02 65.71 2wvz s SER 734 CO 0.17 -0.98 1.68 -0.46 1.20 0.00 0.00 173.24 174.86 2wvz n ASN 735 N -0.31 0.92 -4.67 5.45 6.94 -1.26 -1.60 115.26 120.74 2wvz n ASN 735 Ca -0.12 -0.89 -0.34 0.00 -0.02 0.00 0.00 54.58 53.20 2wvz n ASN 735 Cb 0.63 0.06 -0.10 0.00 -2.36 0.00 0.00 39.78 38.01 2wvz n ASN 735 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2wvz s ARG 736 N -2.41 2.89 0.18 -3.83 1.81 -1.26 -4.88 118.95 111.45 2wvz s ARG 736 Ca 0.28 -0.48 -0.30 0.00 -1.72 0.00 0.00 55.73 53.50 2wvz s ARG 736 Cb 0.20 -2.73 -0.08 0.00 -0.45 0.00 0.00 34.95 31.89 2wvz s ARG 736 CO 0.48 0.68 1.27 -1.25 -0.68 0.00 0.00 175.30 175.79 2wvz s PRO 737 N -1.05 4.42 -0.69 3.54 0.04 -1.26 -4.74 135.00 135.26 2wvz s PRO 737 Ca 0.15 1.98 -0.19 0.00 0.04 0.00 0.00 61.00 62.98 2wvz s PRO 737 Cb -0.11 -3.22 0.11 0.00 0.04 0.00 0.00 34.50 31.32 2wvz s PRO 737 CO 0.04 -0.21 0.83 1.21 0.04 0.00 0.00 177.00 178.92 2wvz s ASN 738 N 0.35 6.32 0.00 6.66 3.84 -1.26 -4.90 114.94 125.95 2wvz s ASN 738 Ca 0.56 -1.59 0.12 0.00 0.21 0.00 0.00 52.86 52.16 2wvz s ASN 738 Cb -0.35 -2.33 0.71 0.00 -0.55 0.00 0.00 41.25 38.73 2wvz s ASN 738 CO 0.37 -1.11 1.17 0.18 -2.79 0.00 0.00 177.10 174.92 2wvz n LEU 739 N 6.38 0.00 -0.01 3.21 7.99 -1.26 -3.17 117.00 130.15 2wvz n LEU 739 Ca -0.00 0.03 0.00 0.00 -0.01 0.00 0.00 56.01 56.03 2wvz n LEU 739 Cb 0.45 -0.03 -0.02 0.00 -0.11 0.00 0.00 43.42 43.70 2wvz n LEU 739 CO 0.56 -0.02 -0.55 0.59 -1.51 0.00 0.00 177.39 176.45 2wvz n ASN 740 N -1.03 4.41 -4.76 -1.43 3.02 -1.26 -4.97 115.26 109.23 2wvz n ASN 740 Ca 0.09 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.23 2wvz n ASN 740 Cb 0.05 0.85 -0.04 0.00 -0.61 0.00 0.00 39.78 40.02 2wvz n ASN 740 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2wvz s ARG 741 N -2.12 4.60 -0.28 3.52 3.52 -1.19 -4.12 118.95 122.88 2wvz s ARG 741 Ca -0.01 1.86 0.00 0.00 -0.13 0.00 0.00 55.73 57.45 2wvz s ARG 741 Cb 0.01 -3.18 0.00 0.00 -1.56 0.00 0.00 34.95 30.22 2wvz s ARG 741 CO 0.10 0.14 0.00 0.41 -0.81 0.00 0.00 175.30 175.15 2wvz n GLY 742 N 1.22 0.53 0.00 8.12 0.00 -1.24 -4.75 105.19 109.08 2wvz n GLY 742 Ca -0.01 -0.93 0.07 0.00 0.00 0.00 0.00 46.02 45.15 2wvz n GLY 742 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wvz n THR 743 N -3.10 0.00 -1.96 2.61 -2.24 -1.26 -4.55 114.28 103.79 2wvz n THR 743 Ca -0.03 -0.25 -0.33 0.00 -2.27 0.00 0.00 64.05 61.18 2wvz n THR 743 Cb 0.16 0.61 0.02 0.00 -2.10 0.00 0.00 70.33 69.02 2wvz n THR 743 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2wvz s LYS 744 N -2.63 3.21 0.24 -0.78 1.02 -1.26 -4.80 119.74 114.73 2wvz s LYS 744 Ca 0.00 1.20 -0.05 0.00 0.02 0.00 0.00 55.97 57.14 2wvz s LYS 744 Cb 0.10 -2.02 0.37 0.00 -0.52 0.00 0.00 37.83 35.76 2wvz s LYS 744 CO 0.58 -0.90 1.80 1.49 -0.92 0.00 0.00 175.35 177.40 2wvz h GLU 745 N 0.26 0.71 0.00 1.68 4.22 -1.99 0.49 114.58 119.94 2wvz h GLU 745 Ca -0.46 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 58.93 2wvz h GLU 745 Cb 1.22 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2wvz h GLU 745 CO 0.57 0.47 0.00 -0.85 -2.18 0.00 0.00 179.01 177.02 2wvz n GLU 746 N -4.78 0.08 0.00 1.92 0.28 -1.26 -2.35 120.64 114.54 2wvz n GLU 746 Ca 0.13 0.23 0.13 0.00 -0.16 0.00 0.00 57.16 57.49 2wvz n GLU 746 Cb 0.27 -1.50 0.33 0.00 1.43 0.00 0.00 31.44 31.97 2wvz n GLU 746 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2wvz n ASP 747 N -1.40 1.56 -4.83 -1.84 8.00 0.16 -4.86 116.55 113.35 2wvz n ASP 747 Ca 0.04 -1.31 -0.36 0.00 0.71 0.00 0.00 54.79 53.88 2wvz n ASP 747 Cb 0.12 0.13 -0.06 0.00 -0.02 0.00 0.00 41.12 41.29 2wvz n ASP 747 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2wvz s MET 748 N -2.28 4.07 1.13 -1.24 -1.94 -0.99 -1.47 119.30 116.57 2wvz s MET 748 Ca 0.28 0.61 -0.18 0.00 -1.71 0.00 0.00 55.69 54.69 2wvz s MET 748 Cb 0.20 -2.95 0.26 0.00 2.01 0.00 0.00 34.83 34.35 2wvz s MET 748 CO 0.45 0.47 1.17 -2.14 -0.01 0.00 0.00 175.02 174.96 2wvz s PRO 749 N -1.87 -0.63 0.15 2.03 0.02 -1.26 -4.92 135.00 128.51 2wvz s PRO 749 Ca 0.38 -0.17 -0.31 0.00 0.02 0.00 0.00 61.00 60.93 2wvz s PRO 749 Cb -0.16 -1.67 -0.08 0.00 0.02 0.00 0.00 34.50 32.61 2wvz s PRO 749 CO 0.20 -3.30 1.34 -0.47 -0.33 0.00 0.00 177.00 174.43 2wvz s TYR 750 N -3.28 3.26 -0.03 6.54 5.04 -1.26 -5.03 117.35 122.60 2wvz s TYR 750 Ca 0.72 1.11 0.03 0.00 -2.44 0.00 0.00 57.07 56.48 2wvz s TYR 750 Cb -0.08 -3.63 0.00 0.00 0.35 0.00 0.00 41.96 38.61 2wvz s TYR 750 CO 0.55 -2.06 -0.10 -1.12 -1.34 0.00 0.00 175.55 171.47 2wvz s SER 751 N 0.72 1.38 0.32 4.32 0.01 -1.26 -4.66 113.70 114.53 2wvz s SER 751 Ca 0.60 -0.22 0.01 0.00 1.31 0.00 0.00 55.95 57.66 2wvz s SER 751 Cb -0.36 -0.37 0.52 0.00 0.21 0.00 0.00 66.02 66.02 2wvz s SER 751 CO 0.34 0.08 1.88 0.15 0.41 0.00 0.00 173.24 176.10 2wvz h PHE 752 N 6.37 0.73 -0.44 2.43 3.57 -0.93 -2.44 116.94 126.22 2wvz h PHE 752 Ca -0.33 -0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.20 2wvz h PHE 752 Cb 1.17 -0.22 -0.07 0.00 2.79 0.00 0.00 35.95 39.62 2wvz h PHE 752 CO 0.44 0.60 0.02 0.77 -2.23 0.00 0.00 178.31 177.92 2wvz h SER 753 N 0.70 -0.14 -3.65 0.41 0.02 -1.90 -3.39 113.55 105.61 2wvz h SER 753 Ca 0.16 0.10 -0.46 0.00 -0.84 0.00 0.00 61.79 60.75 2wvz h SER 753 Cb 0.22 0.16 0.18 0.00 0.14 0.00 0.00 62.40 63.11 2wvz h SER 753 CO -0.01 -0.03 0.12 -0.54 -1.14 0.00 0.00 176.83 175.23 2wvz s LYS 754 N -6.17 -0.06 0.12 3.45 1.02 -0.92 -4.72 119.74 112.47 2wvz s LYS 754 Ca -0.13 0.79 0.00 0.00 0.02 0.00 0.00 55.97 56.65 2wvz s LYS 754 Cb 0.15 -1.66 0.00 0.00 -0.52 0.00 0.00 37.83 35.80 2wvz s LYS 754 CO 0.72 -3.13 0.00 -1.91 -0.92 0.00 0.00 175.35 170.11 2wvz n GLU 755 N -4.49 0.00 0.00 1.68 2.13 -1.26 -4.83 120.64 113.86 2wvz n GLU 755 Ca 0.05 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.87 2wvz n GLU 755 Cb 0.55 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.26 2wvz n GLU 755 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2wvz n LEU 756 N 0.00 0.00 0.00 4.31 4.77 -1.26 -5.13 117.00 119.69 2wvz n LEU 756 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2wvz n LEU 756 Cb 0.00 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 2wvz n LEU 756 CO 0.00 0.00 0.03 -0.62 -1.33 0.00 0.00 177.39 175.47