#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 4.49 -0.02 -5.58 2.15 -1.26 -4.99 116.67 111.46 2wvz s ASP 21 Ca 0.00 -0.24 0.19 0.00 0.43 0.00 0.00 52.55 52.93 2wvz s ASP 21 Cb 0.00 -1.73 -0.27 0.00 -0.30 0.00 0.00 42.92 40.62 2wvz s ASP 21 CO 0.00 0.13 0.49 0.79 -0.17 0.00 0.00 175.17 176.41 2wvz n TRP 22 N 3.80 0.00 0.25 -5.34 7.02 -1.26 -4.50 117.44 117.40 2wvz n TRP 22 Ca -0.18 0.00 0.10 0.00 -1.02 0.00 0.00 57.50 56.40 2wvz n TRP 22 Cb 0.52 -0.33 0.69 0.00 -2.42 0.00 0.00 31.31 29.77 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 0.90 0.00 -0.99 1.35 -1.94 -1.67 112.91 110.57 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 0.75 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.15 2wvz h THR 23 CO 0.00 0.00 0.07 0.06 -0.25 0.00 0.00 175.52 175.40 2wvz h GLN 24 N 0.00 0.00 -0.02 4.72 3.07 -2.02 0.21 115.11 121.07 2wvz h GLN 24 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.76 2wvz h GLN 24 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.63 2wvz h GLN 24 CO -0.00 0.00 -0.37 0.66 0.09 0.00 0.00 178.83 179.21 2wvz n TYR 25 N -2.58 0.00 -3.00 0.06 4.01 -0.63 -4.92 117.16 110.10 2wvz n TYR 25 Ca -0.02 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.32 2wvz n TYR 25 Cb 0.11 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 39.07 2wvz n TYR 25 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2wvz s VAL 26 N -2.41 4.99 -0.43 -0.72 1.01 0.06 -4.17 120.40 118.72 2wvz s VAL 26 Ca 0.21 1.49 -0.02 0.00 0.00 0.00 0.00 61.98 63.66 2wvz s VAL 26 Cb 0.19 -4.07 0.12 0.00 0.00 0.00 0.00 36.38 32.61 2wvz s VAL 26 CO 0.52 0.17 0.22 0.21 0.00 0.00 0.00 175.10 176.22 2wvz s ASN 27 N 0.96 5.19 0.00 3.32 2.47 -1.26 -4.86 114.94 120.77 2wvz s ASN 27 Ca 0.37 -2.17 0.05 0.00 0.42 0.00 0.00 52.86 51.53 2wvz s ASN 27 Cb -0.17 -1.81 0.23 0.00 -1.45 0.00 0.00 41.25 38.05 2wvz s ASN 27 CO 0.16 -0.50 1.00 -2.65 -3.72 0.00 0.00 177.10 171.38 2wvz n PRO 28 N 4.39 0.06 0.00 0.43 -0.02 -1.26 -1.69 135.00 136.91 2wvz n PRO 28 Ca -0.00 0.26 0.12 0.00 -2.02 0.00 0.00 63.50 61.85 2wvz n PRO 28 Cb 0.41 -1.50 0.20 0.00 -0.02 0.00 0.00 33.50 32.59 2wvz n PRO 28 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wvz n LEU 29 N -1.30 0.84 -4.66 2.45 4.77 -1.26 -3.37 117.00 114.46 2wvz n LEU 29 Ca 0.02 -0.21 -0.42 0.00 -0.03 0.00 0.00 56.01 55.37 2wvz n LEU 29 Cb 0.04 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 2wvz n LEU 29 CO 0.04 0.18 1.54 -0.32 -1.33 0.00 0.00 177.39 177.50 2wvz s MET 30 N -2.83 4.12 0.00 3.23 1.75 -0.68 -1.24 119.30 123.65 2wvz s MET 30 Ca 0.14 2.47 0.00 0.00 -1.25 0.00 0.00 55.69 57.05 2wvz s MET 30 Cb 0.18 -4.12 0.00 0.00 2.84 0.00 0.00 34.83 33.73 2wvz s MET 30 CO 0.67 -0.96 0.00 0.41 -0.65 0.00 0.00 175.02 174.49 2wvz n GLY 31 N 4.47 0.37 0.10 2.11 0.00 0.99 -4.77 105.19 108.46 2wvz n GLY 31 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 2wvz n GLY 31 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wvz h SER 32 N 0.00 0.00 -0.71 1.61 4.64 -0.17 -1.20 113.55 117.73 2wvz h SER 32 Ca 0.00 -0.11 -0.73 0.00 -0.47 0.00 0.00 61.79 60.48 2wvz h SER 32 Cb 0.00 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 61.99 2wvz h SER 32 CO 0.00 0.06 2.56 1.67 -0.87 0.00 0.00 176.83 180.24 2wvz n GLN 33 N -2.37 3.22 -4.62 4.77 7.27 -0.57 -2.29 117.38 122.78 2wvz n GLN 33 Ca 0.03 -3.07 -0.23 0.00 0.07 0.00 0.00 57.00 53.80 2wvz n GLN 33 Cb 0.47 -3.13 -0.15 0.00 2.41 0.00 0.00 30.24 29.84 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 2.23 1.85 0.29 1.69 0.01 -1.26 -4.35 113.70 114.16 2wvz s SER 34 Ca 0.44 -0.35 0.10 0.00 1.31 0.00 0.00 55.95 57.45 2wvz s SER 34 Cb 0.11 -0.18 -0.06 0.00 0.21 0.00 0.00 66.02 66.11 2wvz s SER 34 CO -0.04 0.15 -0.14 0.42 0.41 0.00 0.00 173.24 174.04 2wvz s THR 35 N -0.53 2.19 0.35 1.44 -4.23 -1.01 -4.97 115.64 108.88 2wvz s THR 35 Ca 0.05 -2.28 0.15 0.00 -1.18 0.00 0.00 61.69 58.43 2wvz s THR 35 Cb -0.07 -2.39 0.34 0.00 1.34 0.00 0.00 72.50 71.72 2wvz s THR 35 CO 0.00 -0.35 1.67 0.15 -0.54 0.00 0.00 174.62 175.55 2wvz h PHE 36 N 2.24 0.92 0.00 3.99 3.57 -2.02 -1.97 116.94 123.67 2wvz h PHE 36 Ca -0.40 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.13 2wvz h PHE 36 Cb 1.25 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.74 2wvz h PHE 36 CO 0.77 -0.14 -0.61 0.93 -2.23 0.00 0.00 178.31 177.03 2wvz h GLU 37 N 0.35 0.00 -1.42 1.11 3.07 -1.95 -3.40 114.58 112.33 2wvz h GLU 37 Ca 0.72 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 59.49 2wvz h GLU 37 Cb 1.65 0.00 -0.25 0.00 -0.84 0.00 0.00 28.75 29.31 2wvz h GLU 37 CO -0.57 0.00 -0.46 -1.17 -1.40 0.00 0.00 179.01 175.41 2wvz s LEU 38 N -4.41 -1.12 0.29 1.33 2.96 -0.74 -4.34 118.68 112.65 2wvz s LEU 38 Ca 0.06 -0.08 -0.28 0.00 -0.22 0.00 0.00 54.13 53.61 2wvz s LEU 38 Cb 0.13 1.50 -0.09 0.00 0.50 0.00 0.00 46.19 48.22 2wvz s LEU 38 CO 0.72 -0.33 1.00 -0.55 -1.32 0.00 0.00 176.35 175.88 2wvz s SER 39 N 2.66 7.35 -0.16 3.68 0.15 -1.21 -2.41 113.70 123.77 2wvz s SER 39 Ca 0.11 2.04 0.14 0.00 0.70 0.00 0.00 55.95 58.94 2wvz s SER 39 Cb -0.12 -2.61 0.36 0.00 -1.71 0.00 0.00 66.02 61.94 2wvz s SER 39 CO -0.27 -0.06 1.18 0.35 1.20 0.00 0.00 173.24 175.63 2wvz n THR 40 N 1.01 1.85 0.00 6.45 -2.24 -1.26 -3.65 114.28 116.44 2wvz n THR 40 Ca -0.00 -2.62 0.00 0.00 -2.27 0.00 0.00 64.05 59.16 2wvz n THR 40 Cb 0.47 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 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 -1.06 2.72 3.78 3.38 0.00 -1.18 -0.82 105.19 112.00 2wvz n GLY 41 Ca 0.16 -0.33 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.56 -4.59 1.61 3.02 -0.96 -0.53 115.26 111.25 2wvz n ASN 42 Ca 0.00 -0.96 -0.27 0.00 -0.03 0.00 0.00 54.58 53.32 2wvz n ASN 42 Cb 0.00 -3.45 -0.11 0.00 -0.61 0.00 0.00 39.78 35.61 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 -3.69 2.04 0.38 3.41 -4.23 -0.49 -4.63 115.64 108.43 2wvz s THR 43 Ca 0.19 -2.06 0.07 0.00 -1.18 0.00 0.00 61.69 58.71 2wvz s THR 43 Cb -0.07 -2.88 -0.07 0.00 1.34 0.00 0.00 72.50 70.82 2wvz s THR 43 CO 0.86 -0.07 -0.01 -0.72 -0.54 0.00 0.00 174.62 174.15 2wvz s TYR 44 N -2.70 2.41 -0.76 3.99 1.13 -1.26 -4.02 117.35 116.14 2wvz s TYR 44 Ca 0.34 -0.68 -0.26 0.00 -1.41 0.00 0.00 57.07 55.07 2wvz s TYR 44 Cb 0.08 -1.63 0.02 0.00 -1.10 0.00 0.00 41.96 39.32 2wvz s TYR 44 CO 0.17 0.42 1.49 -2.14 -2.51 0.00 0.00 175.55 172.98 2wvz s PRO 45 N -3.71 3.08 -0.65 -3.49 0.02 -1.22 -4.88 135.00 124.15 2wvz s PRO 45 Ca 0.35 -0.18 -0.27 0.00 0.02 0.00 0.00 61.00 60.92 2wvz s PRO 45 Cb 0.08 -4.47 0.00 0.00 0.02 0.00 0.00 34.50 30.14 2wvz s PRO 45 CO 0.17 -2.38 1.60 0.00 -0.33 0.00 0.00 177.00 176.07 2wvz s ALA 46 N 6.70 2.45 -0.36 -1.55 0.00 -1.26 -4.45 121.76 123.29 2wvz s ALA 46 Ca 0.47 -0.91 -0.20 0.00 0.00 0.00 0.00 51.96 51.31 2wvz s ALA 46 Cb -0.08 -4.27 0.00 0.00 0.00 0.00 0.00 23.12 18.78 2wvz s ALA 46 CO 0.11 -3.57 0.61 0.42 0.00 0.00 0.00 175.76 173.34 2wvz s ILE 47 N 7.53 4.91 0.01 0.00 -1.09 0.18 -4.81 121.20 127.94 2wvz s ILE 47 Ca 0.54 0.53 -0.29 0.00 -2.23 0.00 0.00 60.65 59.20 2wvz s ILE 47 Cb -0.11 -4.06 0.11 0.00 -1.58 0.00 0.00 42.46 36.82 2wvz s ILE 47 CO 0.19 -0.30 1.18 0.00 -1.23 0.00 0.00 174.94 174.78 2wvz s ALA 48 N 2.65 -2.05 0.44 9.38 0.00 -0.25 -1.64 121.76 130.28 2wvz s ALA 48 Ca 0.23 0.67 -0.07 0.00 0.00 0.00 0.00 51.96 52.79 2wvz s ALA 48 Cb -0.15 0.38 -0.05 0.00 0.00 0.00 0.00 23.12 23.30 2wvz s ALA 48 CO 0.15 -0.98 0.76 1.03 0.00 0.00 0.00 175.76 176.71 2wvz s ARG 49 N -2.67 3.64 0.12 0.00 1.81 -1.26 -4.59 118.95 116.01 2wvz s ARG 49 Ca 0.13 0.29 -0.35 0.00 -1.72 0.00 0.00 55.73 54.08 2wvz s ARG 49 Cb 0.02 -2.40 -0.16 0.00 -0.45 0.00 0.00 34.95 31.96 2wvz s ARG 49 CO -0.03 -0.11 1.28 -2.30 -0.68 0.00 0.00 175.30 173.47 2wvz n PRO 50 N -1.77 1.20 -1.56 3.54 -0.02 -1.26 -0.57 135.00 134.54 2wvz n PRO 50 Ca 0.01 0.43 -0.10 0.00 -2.02 0.00 0.00 63.50 61.82 2wvz n PRO 50 Cb 0.55 -2.02 -0.03 0.00 -0.02 0.00 0.00 33.50 31.97 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 2.13 -0.75 -1.63 6.00 8.01 -0.17 -4.89 117.44 126.15 2wvz n TRP 51 Ca 0.17 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.95 2wvz n TRP 51 Cb 0.22 -2.26 0.01 0.00 -2.01 0.00 0.00 31.31 27.27 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 -0.32 -0.07 0.11 6.99 0.00 0.26 -0.42 105.19 111.74 2wvz n GLY 52 Ca -0.11 0.13 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 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 1.57 0.27 -5.30 1.61 4.05 -1.51 -3.39 114.93 112.23 2wvz h MET 53 Ca -0.45 -0.02 -0.66 0.00 -0.28 0.00 0.00 59.70 58.28 2wvz h MET 53 Cb 1.33 -0.06 -0.28 0.00 -0.80 0.00 0.00 31.60 31.79 2wvz h MET 53 CO 0.57 0.22 -0.78 -0.80 0.23 0.00 0.00 176.91 176.35 2wvz s ASN 54 N -5.43 3.87 0.09 1.39 0.01 -1.00 -4.91 114.94 108.96 2wvz s ASN 54 Ca -0.13 -0.37 0.02 0.00 -0.71 0.00 0.00 52.86 51.66 2wvz s ASN 54 Cb 0.08 -1.59 -0.04 0.00 0.41 0.00 0.00 41.25 40.12 2wvz s ASN 54 CO 0.70 0.15 0.18 -0.36 -1.51 0.00 0.00 177.10 176.25 2wvz s PHE 55 N 0.42 3.39 -0.05 2.20 0.08 -0.75 -4.76 117.98 118.51 2wvz s PHE 55 Ca -0.11 0.16 0.05 0.00 0.12 0.00 0.00 56.93 57.15 2wvz s PHE 55 Cb -0.16 -1.69 -0.01 0.00 -0.57 0.00 0.00 43.02 40.60 2wvz s PHE 55 CO 0.05 0.55 -0.22 -1.58 -0.10 0.00 0.00 175.22 173.93 2wvz s TRP 56 N -1.53 2.13 -0.04 0.36 0.52 -0.65 -0.80 118.94 118.92 2wvz s TRP 56 Ca 0.33 -0.62 -0.04 0.00 0.02 0.00 0.00 56.10 55.79 2wvz s TRP 56 Cb -0.12 -1.41 0.01 0.00 -1.15 0.00 0.00 33.47 30.80 2wvz s TRP 56 CO 0.26 -0.19 0.12 -0.08 0.02 0.00 0.00 176.95 177.08 2wvz s THR 57 N -0.10 0.00 0.44 2.01 -1.32 -0.32 -0.64 115.64 115.71 2wvz s THR 57 Ca -0.03 -0.02 -0.25 0.00 -1.21 0.00 0.00 61.69 60.18 2wvz s THR 57 Cb -0.13 -0.18 -0.08 0.00 -1.51 0.00 0.00 72.50 70.60 2wvz s THR 57 CO 0.03 -0.01 1.40 -2.16 -2.21 0.00 0.00 174.62 171.67 2wvz s PRO 58 N 0.03 3.76 -0.22 7.08 0.04 -1.26 -1.52 135.00 142.89 2wvz s PRO 58 Ca -0.00 2.36 -0.01 0.00 0.04 0.00 0.00 61.00 63.39 2wvz s PRO 58 Cb -0.01 -2.68 0.02 0.00 0.04 0.00 0.00 34.50 31.87 2wvz s PRO 58 CO 0.00 -0.74 -0.11 -1.14 0.04 0.00 0.00 177.00 175.06 2wvz s GLN 59 N -2.40 2.95 -0.17 4.56 0.74 -0.40 -4.57 119.66 120.37 2wvz s GLN 59 Ca 0.60 -0.88 0.16 0.00 0.05 0.00 0.00 55.36 55.29 2wvz s GLN 59 Cb -0.42 -2.85 -0.22 0.00 1.10 0.00 0.00 33.01 30.61 2wvz s GLN 59 CO 0.55 -0.31 0.07 0.25 -0.55 0.00 0.00 175.29 175.30 2wvz n THR 60 N 4.66 1.19 -1.87 -0.34 -2.24 0.17 -1.20 114.28 114.65 2wvz n THR 60 Ca -0.18 -0.75 -0.31 0.00 -2.27 0.00 0.00 64.05 60.53 2wvz n THR 60 Cb 0.48 -0.50 0.02 0.00 -2.10 0.00 0.00 70.33 68.23 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 -5.17 1.81 0.43 3.38 0.00 0.38 -4.75 107.32 103.40 2wvz s GLY 61 Ca -0.09 0.11 -0.23 0.00 0.00 0.00 0.00 44.72 44.51 2wvz s GLY 61 CO 0.74 0.40 1.13 0.54 0.00 0.00 0.00 173.10 175.91 2wvz s LYS 62 N -4.75 3.92 -0.39 2.90 1.02 -1.26 -4.90 119.74 116.27 2wvz s LYS 62 Ca 0.58 1.69 -0.37 0.00 0.02 0.00 0.00 55.97 57.90 2wvz s LYS 62 Cb -0.13 -2.47 -0.16 0.00 -0.52 0.00 0.00 37.83 34.55 2wvz s LYS 62 CO 0.48 -0.40 1.32 -0.12 -0.92 0.00 0.00 175.35 175.71 2wvz n MET 63 N -0.30 0.00 0.00 1.68 0.00 -1.26 -1.36 117.12 115.88 2wvz n MET 63 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.76 2wvz n MET 63 Cb 0.48 -1.18 0.00 0.00 0.00 0.00 0.00 33.22 32.52 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 3.50 3.08 3.69 -5.12 0.00 -1.26 -5.06 105.19 104.01 2wvz n GLY 64 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.27 6.98 0.57 1.61 -1.08 -0.46 -4.86 116.67 118.15 2wvz s ASP 65 Ca 0.00 1.90 0.28 0.00 -0.52 0.00 0.00 52.55 54.21 2wvz s ASP 65 Cb 0.00 -2.56 1.50 0.00 -1.46 0.00 0.00 42.92 40.41 2wvz s ASP 65 CO 0.00 -0.64 1.99 1.23 0.52 0.00 0.00 175.17 178.27 2wvz h GLY 66 N 8.38 0.00 -7.09 2.66 0.00 -1.90 -3.01 103.07 102.12 2wvz h GLY 66 Ca -0.35 0.00 -0.75 0.00 0.00 0.00 0.00 47.33 46.23 2wvz h GLY 66 CO 0.89 0.00 1.62 0.79 0.00 0.00 0.00 176.54 179.84 2wvz n TRP 67 N -3.97 3.93 0.17 5.60 8.01 -1.26 -4.35 117.44 125.56 2wvz n TRP 67 Ca 0.07 -3.08 0.02 0.00 -1.31 0.00 0.00 57.50 53.20 2wvz n TRP 67 Cb 0.55 -2.02 0.28 0.00 -2.01 0.00 0.00 31.31 28.10 2wvz n TRP 67 CO 0.00 0.00 0.00 -0.56 -1.01 0.00 0.00 177.69 176.12 2wvz h GLN 68 N 6.40 0.00 -3.85 -0.99 3.07 -1.89 -3.32 115.11 114.53 2wvz h GLN 68 Ca 0.35 0.00 -0.38 0.00 0.09 0.00 0.00 58.65 58.71 2wvz h GLN 68 Cb 0.75 0.00 -0.34 0.00 0.08 0.00 0.00 27.48 27.97 2wvz h GLN 68 CO 1.42 0.48 -0.76 -0.47 0.09 0.00 0.00 178.83 179.59 2wvz s TYR 69 N -3.76 0.52 -0.04 0.06 5.04 -1.26 0.43 117.35 118.34 2wvz s TYR 69 Ca -0.01 -0.10 0.01 0.00 -2.44 0.00 0.00 57.07 54.53 2wvz s TYR 69 Cb 0.13 -0.54 0.02 0.00 0.35 0.00 0.00 41.96 41.92 2wvz s TYR 69 CO 0.73 -0.16 -0.04 0.95 -1.34 0.00 0.00 175.55 175.68 2wvz s THR 70 N 1.01 0.51 0.56 4.34 -4.23 -1.26 -4.76 115.64 111.80 2wvz s THR 70 Ca -0.10 -0.12 0.35 0.00 -1.18 0.00 0.00 61.69 60.64 2wvz s THR 70 Cb -0.14 -0.54 0.51 0.00 1.34 0.00 0.00 72.50 73.68 2wvz s THR 70 CO -0.01 0.22 1.79 0.22 -0.54 0.00 0.00 174.62 176.29 2wvz h TYR 71 N 7.13 0.00 -0.01 3.99 5.03 -1.84 0.47 116.97 131.74 2wvz h TYR 71 Ca -0.39 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.92 2wvz h TYR 71 Cb 1.15 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.43 2wvz h TYR 71 CO 0.50 0.00 -0.44 2.41 -1.32 0.00 0.00 178.16 179.31 2wvz n THR 72 N -4.04 0.00 -2.21 1.81 -1.04 -1.26 -4.90 114.28 102.64 2wvz n THR 72 Ca 0.22 -0.14 -0.41 0.00 -2.04 0.00 0.00 64.05 61.69 2wvz n THR 72 Cb 1.17 0.72 -0.03 0.00 -1.82 0.00 0.00 70.33 70.37 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 -2.61 3.49 -0.02 2.41 0.00 0.15 -4.94 121.76 120.24 2wvz s ALA 73 Ca 0.19 1.15 0.11 0.00 0.00 0.00 0.00 51.96 53.42 2wvz s ALA 73 Cb 0.18 -3.45 -0.09 0.00 0.00 0.00 0.00 23.12 19.76 2wvz s ALA 73 CO 0.60 -0.52 1.30 -0.91 0.00 0.00 0.00 175.76 176.23 2wvz h ASN 74 N 3.90 0.00 -4.26 0.00 2.35 -1.90 -3.48 115.58 112.19 2wvz h ASN 74 Ca -0.48 0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 54.79 2wvz h ASN 74 Cb 1.22 0.00 -0.27 0.00 0.05 0.00 0.00 38.32 39.32 2wvz h ASN 74 CO 0.68 0.77 -0.81 -0.54 -1.65 0.00 0.00 177.43 175.88 2wvz s LYS 75 N -2.82 1.11 -0.16 0.81 1.02 -1.26 -1.72 119.74 116.71 2wvz s LYS 75 Ca 0.02 -0.65 -0.05 0.00 0.02 0.00 0.00 55.97 55.31 2wvz s LYS 75 Cb 0.09 -1.11 -0.03 0.00 -0.52 0.00 0.00 37.83 36.26 2wvz s LYS 75 CO 0.79 0.29 0.00 0.42 -0.92 0.00 0.00 175.35 175.93 2wvz s ILE 76 N -0.57 4.26 0.00 2.17 1.01 -0.84 -4.36 121.20 122.87 2wvz s ILE 76 Ca 0.04 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.47 2wvz s ILE 76 Cb -0.07 -2.89 0.00 0.00 0.01 0.00 0.00 42.46 39.51 2wvz s ILE 76 CO 0.00 0.48 0.33 -2.11 0.00 0.00 0.00 174.94 173.65 2wvz n ARG 77 N 3.49 1.58 -3.58 2.79 1.85 -0.34 -1.84 116.66 120.62 2wvz n ARG 77 Ca -0.17 -0.33 0.03 0.00 -1.00 0.00 0.00 57.85 56.37 2wvz n ARG 77 Cb 0.52 -0.83 -0.00 0.00 -1.05 0.00 0.00 32.46 31.10 2wvz n ARG 77 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2wvz s GLY 78 N -0.32 -0.45 -0.19 2.89 0.00 -1.22 -4.75 107.32 103.28 2wvz s GLY 78 Ca 0.00 1.02 0.00 0.00 0.00 0.00 0.00 44.72 45.75 2wvz s GLY 78 CO 0.00 0.22 -0.18 -1.36 0.00 0.00 0.00 173.10 171.78 2wvz s PHE 79 N -2.12 2.81 -0.07 1.90 0.40 0.75 -1.28 117.98 120.37 2wvz s PHE 79 Ca 0.14 -1.57 0.05 0.00 -0.60 0.00 0.00 56.93 54.96 2wvz s PHE 79 Cb 0.06 -1.94 -0.01 0.00 0.51 0.00 0.00 43.02 41.64 2wvz s PHE 79 CO -0.06 -0.78 -0.24 0.21 0.70 0.00 0.00 175.22 175.05 2wvz s LYS 80 N 1.31 2.64 0.06 0.44 2.20 -0.58 -0.54 119.74 125.28 2wvz s LYS 80 Ca 0.05 -0.88 -0.30 0.00 -0.36 0.00 0.00 55.97 54.48 2wvz s LYS 80 Cb -0.13 -2.16 -0.05 0.00 -1.51 0.00 0.00 37.83 33.98 2wvz s LYS 80 CO -0.12 0.32 1.04 -1.14 -0.36 0.00 0.00 175.35 175.09 2wvz s GLN 81 N -0.01 4.57 0.00 4.03 0.74 -0.44 -1.17 119.66 127.38 2wvz s GLN 81 Ca -0.08 1.54 -0.06 0.00 0.05 0.00 0.00 55.36 56.81 2wvz s GLN 81 Cb -0.15 -3.39 -0.00 0.00 1.10 0.00 0.00 33.01 30.57 2wvz s GLN 81 CO 0.05 -0.01 0.10 -0.08 -0.55 0.00 0.00 175.29 174.80 2wvz s THR 82 N 0.62 0.08 -0.03 -0.34 -1.32 0.02 -3.49 115.64 111.18 2wvz s THR 82 Ca 0.52 -0.70 0.04 0.00 -1.21 0.00 0.00 61.69 60.34 2wvz s THR 82 Cb -0.24 -0.39 0.06 0.00 -1.51 0.00 0.00 72.50 70.42 2wvz s THR 82 CO 0.30 -0.38 0.95 1.41 -2.21 0.00 0.00 174.62 174.69 2wvz n HIS 83 N 1.56 0.00 -2.06 9.09 8.25 -1.25 -1.81 115.22 129.00 2wvz n HIS 83 Ca -0.22 -0.50 -0.42 0.00 -0.26 0.00 0.00 57.72 56.32 2wvz n HIS 83 Cb 0.56 -0.06 -0.03 0.00 1.12 0.00 0.00 29.99 31.57 2wvz n HIS 83 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2wvz s GLN 84 N -1.18 4.28 0.19 -0.41 0.74 -1.26 -4.85 119.66 117.17 2wvz s GLN 84 Ca 0.07 2.21 0.22 0.00 0.05 0.00 0.00 55.36 57.91 2wvz s GLN 84 Cb 0.06 -3.19 -0.02 0.00 1.10 0.00 0.00 33.01 30.95 2wvz s GLN 84 CO 0.01 -0.49 1.01 -0.35 -0.55 0.00 0.00 175.29 174.92 2wvz n PRO 85 N 3.74 0.61 -3.62 1.67 -0.04 -1.26 -5.00 135.00 131.09 2wvz n PRO 85 Ca 0.12 0.12 -0.03 0.00 -0.04 0.00 0.00 63.50 63.66 2wvz n PRO 85 Cb 0.41 -1.82 -0.02 0.00 -0.04 0.00 0.00 33.50 32.03 2wvz n PRO 85 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2wvz s SER 86 N -5.36 -0.07 0.45 3.54 1.04 -1.26 -4.52 113.70 107.51 2wvz s SER 86 Ca -0.01 -0.00 0.31 0.00 0.48 0.00 0.00 55.95 56.72 2wvz s SER 86 Cb 0.10 0.08 1.58 0.00 0.10 0.00 0.00 66.02 67.88 2wvz s SER 86 CO 0.80 -0.13 1.93 1.55 0.98 0.00 0.00 173.24 178.36 2wvz h PRO 87 N 2.00 0.00 0.08 4.02 0.13 -1.82 -1.29 132.00 135.12 2wvz h PRO 87 Ca -0.06 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.74 2wvz h PRO 87 Cb 1.15 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 2wvz h PRO 87 CO 0.21 0.00 -1.76 -1.49 -0.23 0.00 0.00 178.00 174.73 2wvz h TRP 88 N 0.00 0.30 0.04 1.56 4.06 -1.94 -3.33 115.95 116.64 2wvz h TRP 88 Ca 0.00 -0.22 -0.23 0.00 2.06 0.00 0.00 58.89 60.50 2wvz h TRP 88 Cb 0.10 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.23 2wvz h TRP 88 CO 0.00 1.40 -1.06 0.82 -3.56 0.00 0.00 178.44 176.04 2wvz h ILE 89 N 0.05 1.62 -0.59 1.49 1.08 -1.90 -3.50 117.51 115.75 2wvz h ILE 89 Ca -0.32 -3.21 0.00 0.00 -0.39 0.00 0.00 64.86 60.93 2wvz h ILE 89 Cb 2.02 2.83 0.00 0.00 -3.07 0.00 0.00 36.82 38.60 2wvz h ILE 89 CO 0.11 0.93 0.00 -3.20 -0.69 0.00 0.00 178.15 175.29 2wvz n ASN 90 N -3.45 -1.78 -4.57 1.72 2.85 -0.51 -4.82 115.26 104.71 2wvz n ASN 90 Ca -0.03 0.00 -0.26 0.00 -0.11 0.00 0.00 54.58 54.18 2wvz n ASN 90 Cb 0.95 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 41.86 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 3.43 0.17 1.20 2.15 -1.26 -4.17 116.67 114.19 2wvz s ASP 91 Ca 0.00 -1.38 -0.22 0.00 0.43 0.00 0.00 52.55 51.38 2wvz s ASP 91 Cb 0.00 -0.30 0.06 0.00 -0.30 0.00 0.00 42.92 42.38 2wvz s ASP 91 CO 0.00 -0.50 0.60 -0.72 -0.17 0.00 0.00 175.17 174.38 2wvz s TYR 92 N -2.89 -0.47 -1.19 -5.34 1.13 -1.26 -2.71 117.35 104.63 2wvz s TYR 92 Ca 0.35 0.22 -0.03 0.00 -1.41 0.00 0.00 57.07 56.20 2wvz s TYR 92 Cb 0.10 0.55 -0.02 0.00 -1.10 0.00 0.00 41.96 41.49 2wvz s TYR 92 CO 0.17 -0.88 0.89 0.41 -2.51 0.00 0.00 175.55 173.63 2wvz n GLY 93 N -0.38 -0.57 3.21 5.49 0.00 -1.24 -3.86 105.19 107.85 2wvz n GLY 93 Ca -0.15 0.24 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 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 -5.34 2.88 0.14 1.61 -2.07 -1.26 -4.44 119.66 111.19 2wvz s GLN 94 Ca 0.14 -0.85 -0.07 0.00 -1.82 0.00 0.00 55.36 52.75 2wvz s GLN 94 Cb -0.02 -2.22 -0.01 0.00 -1.09 0.00 0.00 33.01 29.66 2wvz s GLN 94 CO 0.76 0.20 0.22 -0.59 -1.32 0.00 0.00 175.29 174.56 2wvz s PHE 95 N 0.28 0.45 0.05 9.60 -0.71 -1.23 -4.62 117.98 121.81 2wvz s PHE 95 Ca -0.16 -0.83 -0.00 0.00 -1.04 0.00 0.00 56.93 54.89 2wvz s PHE 95 Cb -0.17 -0.15 -0.04 0.00 -1.21 0.00 0.00 43.02 41.46 2wvz s PHE 95 CO 0.08 -0.65 -0.04 -1.54 -1.34 0.00 0.00 175.22 171.73 2wvz s SER 96 N -2.97 0.57 -0.01 1.98 1.04 -0.65 -1.33 113.70 112.33 2wvz s SER 96 Ca 0.16 -0.93 0.07 0.00 0.48 0.00 0.00 55.95 55.74 2wvz s SER 96 Cb 0.04 0.17 -0.02 0.00 0.10 0.00 0.00 66.02 66.31 2wvz s SER 96 CO -0.02 -0.53 -0.23 -0.51 0.98 0.00 0.00 173.24 172.93 2wvz s ILE 97 N -3.50 1.81 -0.04 -1.02 2.07 0.30 -0.59 121.20 120.23 2wvz s ILE 97 Ca 0.04 -1.00 -0.02 0.00 -1.41 0.00 0.00 60.65 58.26 2wvz s ILE 97 Cb 0.05 -1.51 0.03 0.00 0.13 0.00 0.00 42.46 41.16 2wvz s ILE 97 CO -0.08 0.49 0.07 -0.32 -1.91 0.00 0.00 174.94 173.19 2wvz s MET 98 N -0.59 -0.06 0.20 3.50 -2.45 0.12 -0.18 119.30 119.85 2wvz s MET 98 Ca 0.09 0.38 -0.21 0.00 -1.25 0.00 0.00 55.69 54.70 2wvz s MET 98 Cb -0.09 -0.45 -0.08 0.00 1.25 0.00 0.00 34.83 35.46 2wvz s MET 98 CO -0.01 -0.31 0.73 -1.25 1.05 0.00 0.00 175.02 175.23 2wvz s PRO 99 N 2.04 4.31 0.25 4.11 0.04 -1.26 0.52 135.00 145.02 2wvz s PRO 99 Ca 0.03 0.92 -0.06 0.00 0.04 0.00 0.00 61.00 61.93 2wvz s PRO 99 Cb -0.12 -2.97 -0.02 0.00 0.04 0.00 0.00 34.50 31.43 2wvz s PRO 99 CO -0.03 0.44 0.34 0.96 0.04 0.00 0.00 177.00 178.74 2wvz s ILE 100 N -1.43 0.00 0.04 0.56 -4.36 -0.12 -4.94 121.20 110.95 2wvz s ILE 100 Ca 0.41 -1.69 0.00 0.00 -0.26 0.00 0.00 60.65 59.11 2wvz s ILE 100 Cb -0.18 -2.40 -0.03 0.00 1.25 0.00 0.00 42.46 41.10 2wvz s ILE 100 CO 0.22 0.00 -0.04 0.68 0.24 0.00 0.00 174.94 176.04 2wvz s VAL 101 N -3.89 0.27 0.00 8.37 -7.23 -1.26 -0.11 120.40 116.55 2wvz s VAL 101 Ca 0.31 -1.36 0.00 0.00 -1.81 0.00 0.00 61.98 59.12 2wvz s VAL 101 Cb 0.02 -0.90 0.00 0.00 0.56 0.00 0.00 36.38 36.06 2wvz s VAL 101 CO 0.13 -0.70 0.00 0.61 -0.31 0.00 0.00 175.10 174.83 2wvz n GLY 102 N 0.88 0.72 3.78 2.32 0.00 -0.17 -4.98 105.19 107.74 2wvz n GLY 102 Ca -0.19 -1.58 -0.36 0.00 0.00 0.00 0.00 46.02 43.89 2wvz n GLY 102 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wvz s GLN 103 N 0.00 3.98 -0.50 1.61 -1.52 -1.26 -4.79 119.66 117.17 2wvz s GLN 103 Ca 0.00 1.51 -0.28 0.00 -1.95 0.00 0.00 55.36 54.64 2wvz s GLN 103 Cb 0.00 -2.38 0.02 0.00 -0.22 0.00 0.00 33.01 30.43 2wvz s GLN 103 CO 0.00 -0.30 1.30 -1.25 -0.25 0.00 0.00 175.29 174.79 2wvz s PRO 104 N -2.75 3.52 -0.09 2.91 0.04 -1.26 -4.99 135.00 132.38 2wvz s PRO 104 Ca 0.62 0.57 0.04 0.00 0.04 0.00 0.00 61.00 62.27 2wvz s PRO 104 Cb -0.21 -4.02 -0.00 0.00 0.04 0.00 0.00 34.50 30.30 2wvz s PRO 104 CO 0.26 -1.66 -0.24 0.14 0.04 0.00 0.00 177.00 175.55 2wvz s VAL 105 N 5.29 2.01 -0.04 -0.36 -7.23 -1.26 -5.02 120.40 113.79 2wvz s VAL 105 Ca 0.52 -1.00 0.01 0.00 -1.81 0.00 0.00 61.98 59.70 2wvz s VAL 105 Cb -0.10 -1.73 -0.26 0.00 0.56 0.00 0.00 36.38 34.86 2wvz s VAL 105 CO 0.29 0.55 0.68 0.15 -0.31 0.00 0.00 175.10 176.46 2wvz h PHE 106 N 6.54 0.30 -1.29 2.82 3.57 -1.94 -3.42 116.94 123.51 2wvz h PHE 106 Ca -0.23 -0.22 -0.74 0.00 3.53 0.00 0.00 57.97 60.31 2wvz h PHE 106 Cb 1.22 -0.01 0.05 0.00 2.79 0.00 0.00 35.95 40.00 2wvz h PHE 106 CO 0.46 1.36 0.23 -3.47 -2.23 0.00 0.00 178.31 174.66 2wvz n ASP 107 N -3.32 0.71 0.26 0.41 -0.08 -1.26 -4.79 116.55 108.48 2wvz n ASP 107 Ca -0.20 1.14 0.13 0.00 -1.51 0.00 0.00 54.79 54.35 2wvz n ASP 107 Cb 1.04 -1.04 0.73 0.00 2.34 0.00 0.00 41.12 44.20 2wvz n ASP 107 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 2wvz h GLU 108 N 3.68 0.00 0.10 -0.67 4.11 -1.93 -0.84 114.58 119.04 2wvz h GLU 108 Ca -0.50 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 58.62 2wvz h GLU 108 Cb 1.39 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.62 2wvz h GLU 108 CO 0.71 0.11 -1.68 0.93 0.07 0.00 0.00 179.01 179.15 2wvz h GLU 109 N 0.00 0.21 0.00 1.06 5.08 -1.95 -3.33 114.58 115.65 2wvz h GLU 109 Ca -0.00 -0.36 -0.10 0.00 -1.00 0.00 0.00 59.36 57.90 2wvz h GLU 109 Cb 0.34 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2wvz h GLU 109 CO 0.01 1.03 -0.46 0.87 -1.00 0.00 0.00 179.01 179.46 2wvz h LYS 110 N 0.06 0.00 0.00 2.33 1.57 -1.74 -3.11 116.57 115.67 2wvz h LYS 110 Ca -0.30 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.46 2wvz h LYS 110 Cb 2.02 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.33 2wvz h LYS 110 CO 0.13 0.46 -0.59 0.07 -0.57 0.00 0.00 179.45 178.95 2wvz h ARG 111 N 0.00 0.00 -7.04 3.15 0.11 -1.36 -3.48 114.38 105.76 2wvz h ARG 111 Ca -0.00 0.00 -0.55 0.00 0.10 0.00 0.00 59.98 59.52 2wvz h ARG 111 Cb 1.15 0.00 0.14 0.00 1.11 0.00 0.00 29.97 32.36 2wvz h ARG 111 CO 0.06 0.06 0.63 0.00 0.10 0.00 0.00 179.97 180.82 2wvz n ALA 112 N -2.17 1.70 -2.93 0.08 0.00 -1.18 -4.94 120.51 111.07 2wvz n ALA 112 Ca 0.01 0.14 -0.24 0.00 0.00 0.00 0.00 53.44 53.35 2wvz n ALA 112 Cb 0.58 -2.37 -0.16 0.00 0.00 0.00 0.00 19.45 17.50 2wvz n ALA 112 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2wvz s SER 113 N -0.86 1.83 0.89 0.00 0.15 -0.77 -4.95 113.70 110.00 2wvz s SER 113 Ca 0.71 -0.30 -0.14 0.00 0.70 0.00 0.00 55.95 56.92 2wvz s SER 113 Cb -0.42 -0.49 -0.02 0.00 -1.71 0.00 0.00 66.02 63.38 2wvz s SER 113 CO 0.50 0.13 0.22 0.79 1.20 0.00 0.00 173.24 176.07 2wvz n TRP 114 N 3.17 -1.97 -3.82 3.44 7.02 -1.26 -1.98 117.44 122.04 2wvz n TRP 114 Ca -0.18 0.22 -0.06 0.00 -1.02 0.00 0.00 57.50 56.47 2wvz n TRP 114 Cb 0.53 -1.76 -0.01 0.00 -2.42 0.00 0.00 31.31 27.65 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 -2.19 -0.15 0.24 -5.99 -0.71 -0.70 -2.08 117.98 106.41 2wvz s PHE 115 Ca 0.56 -0.27 0.04 0.00 -1.04 0.00 0.00 56.93 56.23 2wvz s PHE 115 Cb -0.25 0.69 -0.05 0.00 -1.21 0.00 0.00 43.02 42.20 2wvz s PHE 115 CO 0.68 -1.10 -0.02 0.00 -1.34 0.00 0.00 175.22 173.44 2wvz s ALA 116 N -3.57 1.96 -0.00 1.99 0.00 -1.26 -4.81 121.76 116.07 2wvz s ALA 116 Ca 0.12 -1.81 0.30 0.00 0.00 0.00 0.00 51.96 50.57 2wvz s ALA 116 Cb -0.04 0.41 1.08 0.00 0.00 0.00 0.00 23.12 24.57 2wvz s ALA 116 CO 0.06 -0.20 1.88 0.45 0.00 0.00 0.00 175.76 177.94 2wvz h HIS 117 N 2.42 0.00 0.00 0.00 3.86 -1.95 -1.36 115.15 118.12 2wvz h HIS 117 Ca -0.39 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.82 2wvz h HIS 117 Cb 1.23 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.70 2wvz h HIS 117 CO 0.60 0.04 0.00 1.63 0.86 0.00 0.00 177.93 181.07 2wvz n LYS 118 N -3.14 0.41 -0.50 2.45 5.02 -1.26 -2.42 118.16 118.72 2wvz n LYS 118 Ca 0.01 0.01 0.08 0.00 -2.02 0.00 0.00 58.31 56.39 2wvz n LYS 118 Cb 0.38 -1.50 0.28 0.00 -0.02 0.00 0.00 35.03 34.17 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 1.22 3.38 2.97 0.72 0.00 -0.52 -4.98 105.19 107.98 2wvz n GLY 119 Ca 0.14 -0.86 -0.18 0.00 0.00 0.00 0.00 46.02 45.11 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 -2.27 0.70 -0.20 1.61 2.12 -1.02 -0.87 118.70 118.77 2wvz s GLU 120 Ca 0.42 -0.23 0.01 0.00 0.36 0.00 0.00 54.97 55.53 2wvz s GLU 120 Cb 0.31 -0.68 0.04 0.00 0.26 0.00 0.00 34.13 34.06 2wvz s GLU 120 CO 0.15 0.10 -0.09 0.08 -0.54 0.00 0.00 175.26 174.96 2wvz s VAL 121 N 0.12 1.53 -0.23 3.70 1.01 0.22 -4.96 120.40 121.79 2wvz s VAL 121 Ca -0.01 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 2wvz s VAL 121 Cb -0.06 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.68 2wvz s VAL 121 CO -0.00 0.14 -0.07 0.00 0.00 0.00 0.00 175.10 175.17 2wvz s ALA 122 N 1.44 2.70 0.23 5.51 0.00 -1.26 -0.46 121.76 129.93 2wvz s ALA 122 Ca -0.01 -1.30 0.03 0.00 0.00 0.00 0.00 51.96 50.68 2wvz s ALA 122 Cb -0.16 -1.63 -0.05 0.00 0.00 0.00 0.00 23.12 21.27 2wvz s ALA 122 CO -0.08 -0.58 0.02 0.95 0.00 0.00 0.00 175.76 176.07 2wvz s THR 123 N 1.39 0.90 0.45 0.00 -4.23 0.54 -4.44 115.64 110.25 2wvz s THR 123 Ca 0.03 -2.02 0.22 0.00 -1.18 0.00 0.00 61.69 58.74 2wvz s THR 123 Cb -0.15 -2.38 0.25 0.00 1.34 0.00 0.00 72.50 71.56 2wvz s THR 123 CO -0.05 -0.28 2.05 -0.65 -0.54 0.00 0.00 174.62 175.15 2wvz h PRO 124 N 2.48 0.00 -0.01 3.99 0.11 -1.89 -2.99 132.00 133.70 2wvz h PRO 124 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2wvz h PRO 124 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2wvz h PRO 124 CO 0.64 0.14 -0.48 2.48 -0.21 0.00 0.00 178.00 180.56 2wvz n TYR 125 N -3.97 0.00 -3.64 0.65 4.11 -1.26 -1.09 117.16 111.96 2wvz n TYR 125 Ca -0.02 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.79 2wvz n TYR 125 Cb 0.23 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.50 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 -2.06 -0.98 -0.03 -3.48 5.04 -1.13 -4.17 117.35 110.55 2wvz s TYR 126 Ca 0.09 2.06 0.04 0.00 -2.44 0.00 0.00 57.07 56.82 2wvz s TYR 126 Cb 0.11 0.52 -0.00 0.00 0.35 0.00 0.00 41.96 42.94 2wvz s TYR 126 CO 0.47 -0.48 -0.15 -0.47 -1.34 0.00 0.00 175.55 173.59 2wvz s TYR 127 N 1.25 1.42 -0.02 4.97 5.04 -0.84 -0.34 117.35 128.84 2wvz s TYR 127 Ca -0.07 -0.35 -0.02 0.00 -2.44 0.00 0.00 57.07 54.19 2wvz s TYR 127 Cb -0.05 -0.95 0.00 0.00 0.35 0.00 0.00 41.96 41.31 2wvz s TYR 127 CO -0.14 -0.10 0.05 0.21 -1.34 0.00 0.00 175.55 174.24 2wvz s LYS 128 N -0.07 0.11 0.01 4.97 2.20 0.40 -1.53 119.74 125.83 2wvz s LYS 128 Ca -0.00 -0.02 -0.11 0.00 -0.36 0.00 0.00 55.97 55.49 2wvz s LYS 128 Cb -0.09 0.05 0.01 0.00 -1.51 0.00 0.00 37.83 36.29 2wvz s LYS 128 CO 0.01 -0.02 0.22 0.54 -0.36 0.00 0.00 175.35 175.74 2wvz s VAL 129 N -0.19 0.08 -0.30 4.02 0.11 -0.64 0.69 120.40 124.16 2wvz s VAL 129 Ca -0.02 -0.68 -0.11 0.00 -2.93 0.00 0.00 61.98 58.24 2wvz s VAL 129 Cb -0.02 -0.65 -0.03 0.00 -1.53 0.00 0.00 36.38 34.15 2wvz s VAL 129 CO 0.00 -0.37 0.20 -0.47 -3.33 0.00 0.00 175.10 171.12 2wvz s TYR 130 N -1.74 3.21 -0.82 1.54 5.04 -0.05 -1.52 117.35 123.01 2wvz s TYR 130 Ca -0.11 -0.09 -0.18 0.00 -2.44 0.00 0.00 57.07 54.25 2wvz s TYR 130 Cb -0.05 -2.40 0.14 0.00 0.35 0.00 0.00 41.96 40.01 2wvz s TYR 130 CO 0.01 -0.27 0.94 -0.51 -1.34 0.00 0.00 175.55 174.38 2wvz s LEU 131 N 1.73 5.50 0.41 6.97 1.43 -0.14 -4.58 118.68 130.00 2wvz s LEU 131 Ca 0.06 -2.01 0.17 0.00 -1.03 0.00 0.00 54.13 51.33 2wvz s LEU 131 Cb -0.16 -2.33 1.07 0.00 0.03 0.00 0.00 46.19 44.79 2wvz s LEU 131 CO 0.10 -0.98 1.84 0.00 0.23 0.00 0.00 176.35 177.54 2wvz h ALA 132 N 8.70 2.19 -0.00 4.21 0.00 -1.71 -1.12 119.26 131.53 2wvz h ALA 132 Ca 0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2wvz h ALA 132 Cb 1.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2wvz h ALA 132 CO 1.02 -0.49 -0.11 0.39 0.00 0.00 0.00 179.25 180.06 2wvz n GLU 133 N -4.53 0.68 0.00 0.00 1.02 -1.26 -3.36 120.64 113.20 2wvz n GLU 133 Ca 0.20 -0.24 0.01 0.00 -0.02 0.00 0.00 57.16 57.11 2wvz n GLU 133 Cb 0.71 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 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 -0.95 0.00 -3.95 -0.32 8.25 -0.78 -4.95 115.22 112.52 2wvz n HIS 134 Ca 0.14 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.30 2wvz n HIS 134 Cb 0.28 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.40 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 -0.36 -3.60 -4.20 0.41 2.03 -0.49 -4.68 116.55 105.65 2wvz n ASP 135 Ca 0.01 -0.85 -0.29 0.00 0.52 0.00 0.00 54.79 54.17 2wvz n ASP 135 Cb 0.03 -3.60 -0.16 0.00 -0.72 0.00 0.00 41.12 36.66 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 -3.41 1.80 -0.18 5.18 1.01 -1.13 -3.88 121.20 120.58 2wvz s ILE 136 Ca 0.53 -0.91 -0.15 0.00 0.00 0.00 0.00 60.65 60.11 2wvz s ILE 136 Cb -0.27 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 2wvz s ILE 136 CO 0.85 0.50 0.36 -0.69 0.00 0.00 0.00 174.94 175.97 2wvz s VAL 137 N 0.00 5.24 -0.14 2.92 1.01 -0.77 -0.97 120.40 127.70 2wvz s VAL 137 Ca -0.06 0.66 -0.04 0.00 0.00 0.00 0.00 61.98 62.54 2wvz s VAL 137 Cb -0.14 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2wvz s VAL 137 CO 0.04 0.31 -0.00 -0.89 0.00 0.00 0.00 175.10 174.55 2wvz s THR 138 N 0.94 4.22 0.06 3.92 2.01 -0.58 -0.85 115.64 125.36 2wvz s THR 138 Ca 0.19 -0.25 0.07 0.00 0.31 0.00 0.00 61.69 62.01 2wvz s THR 138 Cb -0.14 -2.84 -0.03 0.00 0.01 0.00 0.00 72.50 69.50 2wvz s THR 138 CO 0.07 0.52 -0.20 -1.61 -0.69 0.00 0.00 174.62 172.70 2wvz s GLU 139 N 0.02 1.25 -0.10 4.92 2.02 -0.51 -1.62 118.70 124.69 2wvz s GLU 139 Ca 0.02 -0.98 -0.09 0.00 0.02 0.00 0.00 54.97 53.94 2wvz s GLU 139 Cb -0.13 -1.40 0.03 0.00 0.10 0.00 0.00 34.13 32.73 2wvz s GLU 139 CO 0.02 0.35 0.25 0.00 0.02 0.00 0.00 175.26 175.90 2wvz s MET 140 N -1.39 0.29 -0.21 1.61 0.23 -0.58 -0.69 119.30 118.56 2wvz s MET 140 Ca 0.06 0.37 -0.04 0.00 -1.03 0.00 0.00 55.69 55.05 2wvz s MET 140 Cb -0.09 0.12 0.07 0.00 -1.53 0.00 0.00 34.83 33.40 2wvz s MET 140 CO 0.02 -0.05 0.08 0.95 -2.03 0.00 0.00 175.02 174.00 2wvz s THR 141 N 0.23 0.13 0.44 3.16 -4.23 -0.58 -1.98 115.64 112.80 2wvz s THR 141 Ca -0.01 -0.44 -0.04 0.00 -1.18 0.00 0.00 61.69 60.02 2wvz s THR 141 Cb -0.02 -0.83 -0.04 0.00 1.34 0.00 0.00 72.50 72.95 2wvz s THR 141 CO -0.00 -0.36 0.72 -2.16 -0.54 0.00 0.00 174.62 172.28 2wvz s PRO 142 N 2.03 3.55 0.00 3.99 0.04 -1.26 -1.88 135.00 141.48 2wvz s PRO 142 Ca 0.03 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.17 2wvz s PRO 142 Cb -0.16 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 31.93 2wvz s PRO 142 CO -0.15 -0.10 0.00 0.25 0.04 0.00 0.00 177.00 177.05 2wvz n THR 143 N -2.01 0.00 -0.29 1.26 -2.24 0.48 -4.68 114.28 106.79 2wvz n THR 143 Ca -0.01 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.79 2wvz n THR 143 Cb 0.55 -0.17 0.15 0.00 -2.10 0.00 0.00 70.33 68.76 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 0.82 0.00 -0.78 5.08 -1.93 -3.36 114.58 114.41 2wvz h GLU 144 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2wvz h GLU 144 Cb 0.00 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2wvz h GLU 144 CO 0.00 0.54 0.00 0.54 -1.00 0.00 0.00 179.01 179.09 2wvz n ARG 145 N -4.70 1.29 -4.50 2.33 1.74 -1.26 -1.83 116.66 109.73 2wvz n ARG 145 Ca 0.13 -0.14 -0.23 0.00 -0.77 0.00 0.00 57.85 56.84 2wvz n ARG 145 Cb 0.23 -0.53 -0.11 0.00 -1.02 0.00 0.00 32.46 31.04 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 -0.22 2.58 0.00 7.54 0.00 -1.26 -3.18 121.76 127.23 2wvz s ALA 146 Ca 0.00 -2.13 -0.11 0.00 0.00 0.00 0.00 51.96 49.73 2wvz s ALA 146 Cb 0.00 0.51 0.01 0.00 0.00 0.00 0.00 23.12 23.64 2wvz s ALA 146 CO 0.00 -0.25 0.22 0.54 0.00 0.00 0.00 175.76 176.27 2wvz s VAL 147 N -3.12 0.08 -0.17 0.00 0.11 0.11 -0.38 120.40 117.02 2wvz s VAL 147 Ca 0.36 -0.64 -0.04 0.00 -2.93 0.00 0.00 61.98 58.74 2wvz s VAL 147 Cb 0.09 -0.58 -0.02 0.00 -1.53 0.00 0.00 36.38 34.33 2wvz s VAL 147 CO 0.16 -0.35 -0.04 -0.22 -3.33 0.00 0.00 175.10 171.32 2wvz s LEU 148 N -1.48 3.16 -0.03 2.54 2.96 -0.79 -1.68 118.68 123.36 2wvz s LEU 148 Ca -0.13 -0.19 -0.02 0.00 -0.22 0.00 0.00 54.13 53.57 2wvz s LEU 148 Cb -0.06 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.83 2wvz s LEU 148 CO 0.02 0.13 0.09 -0.36 -1.32 0.00 0.00 176.35 174.90 2wvz s PHE 149 N 0.61 3.33 -0.12 5.38 0.40 0.03 -1.53 117.98 126.09 2wvz s PHE 149 Ca -0.03 0.26 -0.02 0.00 -0.60 0.00 0.00 56.93 56.54 2wvz s PHE 149 Cb -0.14 -1.78 0.04 0.00 0.51 0.00 0.00 43.02 41.64 2wvz s PHE 149 CO 0.02 0.57 0.02 0.50 0.70 0.00 0.00 175.22 177.04 2wvz s ARG 150 N -1.53 0.54 -0.26 0.44 3.52 0.14 -0.87 118.95 120.94 2wvz s ARG 150 Ca 0.21 -0.06 -0.09 0.00 -0.13 0.00 0.00 55.73 55.66 2wvz s ARG 150 Cb -0.12 -1.38 -0.04 0.00 -1.56 0.00 0.00 34.95 31.85 2wvz s ARG 150 CO 0.11 -0.44 0.12 -0.06 -0.81 0.00 0.00 175.30 174.22 2wvz s PHE 151 N 1.96 3.16 -0.49 5.12 2.99 0.78 -1.43 117.98 130.07 2wvz s PHE 151 Ca 0.03 -0.13 -0.17 0.00 0.00 0.00 0.00 56.93 56.66 2wvz s PHE 151 Cb -0.14 -2.28 0.07 0.00 0.00 0.00 0.00 43.02 40.67 2wvz s PHE 151 CO -0.06 -0.22 0.48 0.99 -0.00 0.00 0.00 175.22 176.41 2wvz s THR 152 N 1.55 5.11 0.47 0.64 2.01 -0.03 -1.06 115.64 124.33 2wvz s THR 152 Ca 0.06 -0.91 -0.02 0.00 0.31 0.00 0.00 61.69 61.14 2wvz s THR 152 Cb -0.15 -4.20 -0.01 0.00 0.01 0.00 0.00 72.50 68.14 2wvz s THR 152 CO 0.06 -0.68 0.72 -0.36 -0.69 0.00 0.00 174.62 173.67 2wvz s PHE 153 N 1.98 3.34 0.75 4.92 0.08 -0.81 -1.84 117.98 126.40 2wvz s PHE 153 Ca 0.08 0.45 -0.01 0.00 0.12 0.00 0.00 56.93 57.56 2wvz s PHE 153 Cb -0.23 -2.34 0.14 0.00 -0.57 0.00 0.00 43.02 40.02 2wvz s PHE 153 CO 0.08 -0.37 1.03 -1.25 -0.10 0.00 0.00 175.22 174.61 2wvz s PRO 154 N -4.65 1.53 -0.06 0.24 0.04 -1.25 -1.71 135.00 129.14 2wvz s PRO 154 Ca 0.48 -1.14 -0.30 0.00 0.04 0.00 0.00 61.00 60.08 2wvz s PRO 154 Cb -0.10 -2.30 -0.05 0.00 0.04 0.00 0.00 34.50 32.09 2wvz s PRO 154 CO 0.40 -1.57 1.56 -2.00 0.04 0.00 0.00 177.00 175.44 2wvz s GLU 155 N -5.21 4.20 -0.28 4.56 2.12 -1.26 -4.35 118.70 118.48 2wvz s GLU 155 Ca 0.68 2.09 -0.23 0.00 0.36 0.00 0.00 54.97 57.86 2wvz s GLU 155 Cb -0.05 -3.87 0.13 0.00 0.26 0.00 0.00 34.13 30.60 2wvz s GLU 155 CO 0.45 -0.78 1.06 1.21 -0.54 0.00 0.00 175.26 176.66 2wvz s ASN 156 N 2.88 -0.43 0.35 -1.70 3.84 0.35 -4.92 114.94 115.31 2wvz s ASN 156 Ca 0.69 0.80 0.17 0.00 0.21 0.00 0.00 52.86 54.73 2wvz s ASN 156 Cb -0.32 0.87 0.57 0.00 -0.55 0.00 0.00 41.25 41.83 2wvz s ASN 156 CO 0.27 -0.13 1.69 0.44 -2.79 0.00 0.00 177.10 176.57 2wvz h ASP 157 N 4.45 0.00 -2.99 -4.21 5.19 -1.87 0.40 116.42 117.39 2wvz h ASP 157 Ca -0.28 0.00 -0.62 0.00 -0.62 0.00 0.00 57.03 55.51 2wvz h ASP 157 Cb 1.18 0.00 -0.42 0.00 0.18 0.00 0.00 39.33 40.27 2wvz h ASP 157 CO 0.13 0.43 -0.59 1.41 -3.12 0.00 0.00 179.24 177.50 2wvz n HIS 158 N -3.54 3.11 -4.07 4.55 8.25 -1.26 -4.30 115.22 117.96 2wvz n HIS 158 Ca -0.00 -4.26 -0.34 0.00 -0.26 0.00 0.00 57.72 52.85 2wvz n HIS 158 Cb 0.55 -0.59 -0.10 0.00 1.12 0.00 0.00 29.99 30.97 2wvz n HIS 158 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2wvz s SER 159 N -1.49 5.48 0.24 0.41 0.01 -1.07 -1.00 113.70 116.29 2wvz s SER 159 Ca 0.26 0.04 0.05 0.00 1.31 0.00 0.00 55.95 57.62 2wvz s SER 159 Cb -0.02 -1.93 -0.05 0.00 0.21 0.00 0.00 66.02 64.22 2wvz s SER 159 CO -0.16 0.17 -0.05 -0.31 0.41 0.00 0.00 173.24 173.30 2wvz s TYR 160 N 0.38 1.73 -0.13 2.43 1.51 0.85 -1.77 117.35 122.35 2wvz s TYR 160 Ca 0.02 -0.77 -0.00 0.00 -1.01 0.00 0.00 57.07 55.30 2wvz s TYR 160 Cb -0.13 -0.97 0.02 0.00 -0.11 0.00 0.00 41.96 40.78 2wvz s TYR 160 CO 0.01 0.15 -0.10 0.08 -1.11 0.00 0.00 175.55 174.58 2wvz s VAL 161 N -3.18 1.24 -0.01 0.71 1.01 0.30 -0.95 120.40 119.52 2wvz s VAL 161 Ca 0.27 -0.44 -0.16 0.00 0.00 0.00 0.00 61.98 61.65 2wvz s VAL 161 Cb 0.04 -1.23 -0.06 0.00 0.00 0.00 0.00 36.38 35.14 2wvz s VAL 161 CO 0.09 0.39 0.45 -0.69 0.00 0.00 0.00 175.10 175.34 2wvz s VAL 162 N 1.62 5.01 -0.12 2.92 1.01 0.19 -2.14 120.40 128.88 2wvz s VAL 162 Ca 0.05 0.92 0.00 0.00 0.00 0.00 0.00 61.98 62.95 2wvz s VAL 162 Cb -0.13 -3.76 0.02 0.00 0.00 0.00 0.00 36.38 32.51 2wvz s VAL 162 CO -0.09 0.53 -0.11 -0.69 0.00 0.00 0.00 175.10 174.73 2wvz s VAL 163 N -0.76 1.27 -0.30 2.92 1.01 -0.18 0.14 120.40 124.51 2wvz s VAL 163 Ca 0.25 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.76 2wvz s VAL 163 Cb -0.17 -1.22 0.05 0.00 0.00 0.00 0.00 36.38 35.04 2wvz s VAL 163 CO 0.14 0.41 -0.01 -0.62 0.00 0.00 0.00 175.10 175.01 2wvz s ASP 164 N 1.43 4.82 0.00 3.32 -1.08 0.24 -1.16 116.67 124.25 2wvz s ASP 164 Ca 0.01 -1.33 0.30 0.00 -0.52 0.00 0.00 52.55 51.01 2wvz s ASP 164 Cb -0.13 -1.68 1.50 0.00 -1.46 0.00 0.00 42.92 41.14 2wvz s ASP 164 CO -0.07 -0.26 2.05 0.00 0.52 0.00 0.00 175.17 177.41 2wvz n ALA 165 N 4.58 2.47 -0.28 3.66 0.00 -0.32 -1.64 120.51 128.98 2wvz n ALA 165 Ca -0.13 -0.14 0.04 0.00 0.00 0.00 0.00 53.44 53.21 2wvz n ALA 165 Cb 0.43 -1.49 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 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 -1.30 -0.73 -1.91 0.00 3.01 -1.26 -4.49 117.46 110.78 2wvz n PHE 166 Ca 0.14 0.38 0.00 0.00 1.01 0.00 0.00 57.45 58.98 2wvz n PHE 166 Cb 0.25 -0.67 0.00 0.00 -0.01 0.00 0.00 39.48 39.05 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 -2.76 0.00 -2.33 4.37 5.75 -1.26 -3.96 116.55 116.37 2wvz n ASP 167 Ca -0.01 0.00 -0.21 0.00 -0.01 0.00 0.00 54.79 54.57 2wvz n ASP 167 Cb 0.13 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.20 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 0.00 -1.68 0.00 0.11 4.76 -0.86 -3.80 118.16 116.69 2wvz n LYS 168 Ca 0.00 1.02 0.00 0.00 -2.87 0.00 0.00 58.31 56.46 2wvz n LYS 168 Cb 0.00 -5.66 0.00 0.00 -1.84 0.00 0.00 35.03 27.53 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 -0.95 0.62 3.32 0.72 0.00 -0.38 -4.67 105.19 103.85 2wvz n GLY 169 Ca -0.24 -0.81 -0.15 0.00 0.00 0.00 0.00 46.02 44.82 2wvz n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wvz s SER 170 N 0.00 0.82 -0.11 1.61 1.04 0.29 -3.36 113.70 113.98 2wvz s SER 170 Ca 0.00 -1.49 -0.12 0.00 0.48 0.00 0.00 55.95 54.81 2wvz s SER 170 Cb 0.00 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.67 2wvz s SER 170 CO 0.00 -1.04 0.33 -0.47 0.98 0.00 0.00 173.24 173.05 2wvz s TYR 171 N -3.68 -0.34 -0.08 5.02 5.04 -0.85 -2.10 117.35 120.36 2wvz s TYR 171 Ca 0.36 0.81 -0.08 0.00 -2.44 0.00 0.00 57.07 55.73 2wvz s TYR 171 Cb 0.03 0.12 0.02 0.00 0.35 0.00 0.00 41.96 42.48 2wvz s TYR 171 CO 0.19 -0.21 0.22 -1.50 -1.34 0.00 0.00 175.55 172.91 2wvz s ILE 172 N -0.04 0.00 -0.02 3.14 1.10 -0.54 -0.99 121.20 123.86 2wvz s ILE 172 Ca -0.02 -0.03 0.00 0.00 -0.51 0.00 0.00 60.65 60.09 2wvz s ILE 172 Cb -0.03 -0.32 0.02 0.00 0.15 0.00 0.00 42.46 42.28 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 0.04 0.06 -0.10 3.50 2.20 -0.37 -0.73 119.74 124.33 2wvz s LYS 173 Ca -0.01 0.10 -0.14 0.00 -0.36 0.00 0.00 55.97 55.56 2wvz s LYS 173 Cb -0.02 -0.23 -0.05 0.00 -1.51 0.00 0.00 37.83 36.02 2wvz s LYS 173 CO 0.00 -0.10 0.34 0.42 -0.36 0.00 0.00 175.35 175.65 2wvz s ILE 174 N 0.72 5.23 -0.59 5.43 1.01 0.20 -1.35 121.20 131.85 2wvz s ILE 174 Ca -0.06 0.66 0.04 0.00 0.00 0.00 0.00 60.65 61.29 2wvz s ILE 174 Cb -0.09 -3.66 0.15 0.00 0.01 0.00 0.00 42.46 38.87 2wvz s ILE 174 CO -0.02 0.46 0.37 -0.63 0.00 0.00 0.00 174.94 175.12 2wvz s ILE 175 N -0.11 2.56 0.20 2.92 1.01 0.26 -4.89 121.20 123.15 2wvz s ILE 175 Ca 0.20 -3.68 -0.10 0.00 0.00 0.00 0.00 60.65 57.07 2wvz s ILE 175 Cb -0.14 -2.73 0.13 0.00 0.01 0.00 0.00 42.46 39.72 2wvz s ILE 175 CO 0.08 -0.91 1.80 -0.65 0.00 0.00 0.00 174.94 175.25 2wvz h PRO 176 N 5.99 0.60 0.00 2.79 0.11 -1.96 -1.61 132.00 137.92 2wvz h PRO 176 Ca 0.04 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2wvz h PRO 176 Cb 0.83 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.81 2wvz h PRO 176 CO 0.68 0.40 0.00 -0.85 -0.21 0.00 0.00 178.00 178.02 2wvz n GLU 177 N -4.82 0.58 0.00 1.05 0.00 -1.26 -1.16 120.64 115.02 2wvz n GLU 177 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.23 2wvz n GLU 177 Cb 0.17 -1.19 0.00 0.00 0.00 0.00 0.00 31.44 30.42 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 -0.69 0.21 -3.63 3.44 1.02 -0.71 -5.02 120.64 115.26 2wvz n GLU 178 Ca 0.05 -0.41 -0.21 0.00 -0.02 0.00 0.00 57.16 56.57 2wvz n GLU 178 Cb 0.02 -0.62 0.04 0.00 -0.02 0.00 0.00 31.44 30.87 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 -0.06 -1.92 -4.00 1.62 3.02 -0.31 -4.67 115.26 108.95 2wvz n ASN 179 Ca 0.00 -0.80 -0.19 0.00 -0.03 0.00 0.00 54.58 53.56 2wvz n ASN 179 Cb 0.31 -4.24 -0.15 0.00 -0.61 0.00 0.00 39.78 35.09 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 -5.78 0.83 -0.08 3.52 2.20 -0.69 -1.46 119.74 118.27 2wvz s LYS 180 Ca 0.06 -0.30 0.03 0.00 -0.36 0.00 0.00 55.97 55.41 2wvz s LYS 180 Cb -0.02 -0.79 0.01 0.00 -1.51 0.00 0.00 37.83 35.52 2wvz s LYS 180 CO 0.80 0.14 -0.18 0.42 -0.36 0.00 0.00 175.35 176.17 2wvz s ILE 181 N 0.04 1.58 0.32 5.43 1.01 0.22 0.89 121.20 130.68 2wvz s ILE 181 Ca -0.00 -0.74 0.07 0.00 0.00 0.00 0.00 60.65 59.98 2wvz s ILE 181 Cb -0.06 -1.39 -0.06 0.00 0.01 0.00 0.00 42.46 40.95 2wvz s ILE 181 CO 0.00 0.45 -0.06 0.27 0.00 0.00 0.00 174.94 175.61 2wvz s ILE 182 N 0.52 1.84 0.00 2.92 -4.36 -0.46 0.04 121.20 121.70 2wvz s ILE 182 Ca -0.16 -2.13 0.00 0.00 -0.26 0.00 0.00 60.65 58.09 2wvz s ILE 182 Cb -0.17 -2.59 0.00 0.00 1.25 0.00 0.00 42.46 40.95 2wvz s ILE 182 CO 0.06 -0.22 0.00 0.61 0.24 0.00 0.00 174.94 175.63 2wvz n GLY 183 N -0.69 -0.77 3.03 6.27 0.00 -0.96 -1.24 105.19 110.82 2wvz n GLY 183 Ca -0.05 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 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 0.56 0.20 1.61 -0.85 -0.17 -1.05 117.35 115.65 2wvz s TYR 184 Ca 0.00 -0.41 0.06 0.00 -0.52 0.00 0.00 57.07 56.20 2wvz s TYR 184 Cb 0.00 -0.34 -0.04 0.00 0.38 0.00 0.00 41.96 41.96 2wvz s TYR 184 CO 0.00 -0.08 0.14 -0.08 -1.52 0.00 0.00 175.55 174.01 2wvz s THR 185 N -1.10 4.37 0.00 -3.49 -1.32 -0.27 -2.01 115.64 111.81 2wvz s THR 185 Ca -0.08 -1.26 0.00 0.00 -1.21 0.00 0.00 61.69 59.14 2wvz s THR 185 Cb -0.08 -3.28 0.00 0.00 -1.51 0.00 0.00 72.50 67.63 2wvz s THR 185 CO 0.00 -0.20 0.01 0.35 -2.21 0.00 0.00 174.62 172.57 2wvz n THR 186 N -0.64 0.00 -1.68 5.08 -2.24 -1.21 -2.17 114.28 111.42 2wvz n THR 186 Ca -0.08 -0.03 -0.48 0.00 -2.27 0.00 0.00 64.05 61.20 2wvz n THR 186 Cb 0.56 1.44 -0.05 0.00 -2.10 0.00 0.00 70.33 70.19 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 -0.03 2.22 -4.18 -0.78 0.63 -1.25 -4.82 116.66 108.46 2wvz n ARG 187 Ca 0.00 0.81 -0.15 0.00 -0.92 0.00 0.00 57.85 57.59 2wvz n ARG 187 Cb 0.11 -2.66 -0.07 0.00 0.45 0.00 0.00 32.46 30.29 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 3.63 0.94 -0.10 6.15 4.22 -1.26 -3.67 114.94 124.85 2wvz s ASN 188 Ca 0.90 -1.52 0.14 0.00 -2.14 0.00 0.00 52.86 50.24 2wvz s ASN 188 Cb -0.67 0.55 0.28 0.00 1.28 0.00 0.00 41.25 42.69 2wvz s ASN 188 CO 0.49 -1.09 1.18 -1.20 -2.04 0.00 0.00 177.10 174.44 2wvz n SER 189 N -1.11 2.64 0.00 3.54 7.64 -1.10 -4.98 113.62 120.25 2wvz n SER 189 Ca 0.03 -2.73 0.00 0.00 1.01 0.00 0.00 58.87 57.18 2wvz n SER 189 Cb 0.63 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 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 -0.86 1.05 3.32 0.23 0.00 -1.26 -5.04 105.19 102.62 2wvz n GLY 190 Ca 0.13 -2.20 -0.21 0.00 0.00 0.00 0.00 46.02 43.74 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 -0.32 -0.37 3.10 -0.02 0.00 -1.26 -4.46 105.19 101.85 2wvz n GLY 191 Ca 0.00 0.14 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.27 0.75 0.73 1.61 -7.23 -1.26 -0.45 120.40 111.27 2wvz s VAL 192 Ca 0.50 -1.10 -0.14 0.00 -1.81 0.00 0.00 61.98 59.43 2wvz s VAL 192 Cb -0.22 -0.76 0.04 0.00 0.56 0.00 0.00 36.38 35.99 2wvz s VAL 192 CO 0.62 -0.28 1.17 -2.84 -0.31 0.00 0.00 175.10 173.46 2wvz s PRO 193 N -1.52 2.24 0.53 4.82 0.02 -1.25 -4.93 135.00 134.91 2wvz s PRO 193 Ca -0.06 1.62 0.30 0.00 0.02 0.00 0.00 61.00 62.88 2wvz s PRO 193 Cb -0.09 -1.86 1.44 0.00 0.02 0.00 0.00 34.50 34.01 2wvz s PRO 193 CO 0.01 -1.73 1.90 0.93 -0.33 0.00 0.00 177.00 177.78 2wvz h GLU 194 N -0.35 0.03 -0.68 5.54 5.08 -1.97 -1.96 114.58 120.27 2wvz h GLU 194 Ca -0.47 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2wvz h GLU 194 Cb 1.28 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2wvz h GLU 194 CO 0.50 0.02 0.00 0.27 -1.00 0.00 0.00 179.01 178.81 2wvz n ASN 195 N -4.30 4.57 -4.69 1.42 6.94 -1.26 -4.99 115.26 112.95 2wvz n ASN 195 Ca 0.18 -2.70 -0.44 0.00 -0.02 0.00 0.00 54.58 51.60 2wvz n ASN 195 Cb 0.90 -0.64 -0.04 0.00 -2.36 0.00 0.00 39.78 37.64 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 0.48 2.51 -3.72 -2.53 7.35 -0.74 -4.99 117.46 115.82 2wvz n PHE 196 Ca 0.21 0.10 -0.13 0.00 -0.76 0.00 0.00 57.45 56.87 2wvz n PHE 196 Cb 0.96 -2.63 -0.10 0.00 0.35 0.00 0.00 39.48 38.06 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 1.50 0.49 -0.22 -4.13 1.02 -1.26 -4.80 119.74 112.33 2wvz s LYS 197 Ca 0.79 0.63 -0.04 0.00 0.02 0.00 0.00 55.97 57.36 2wvz s LYS 197 Cb -0.58 0.21 -0.01 0.00 -0.52 0.00 0.00 37.83 36.93 2wvz s LYS 197 CO 0.37 -0.07 -0.03 1.21 -0.92 0.00 0.00 175.35 175.90 2wvz s ASN 198 N 0.37 4.36 -0.14 2.83 3.84 -0.92 -4.46 114.94 120.82 2wvz s ASN 198 Ca -0.01 -0.40 -0.12 0.00 0.21 0.00 0.00 52.86 52.53 2wvz s ASN 198 Cb -0.04 -1.75 -0.05 0.00 -0.55 0.00 0.00 41.25 38.87 2wvz s ASN 198 CO -0.01 -0.03 0.25 -0.31 -2.79 0.00 0.00 177.10 174.21 2wvz s TYR 199 N 1.48 3.52 0.07 0.43 1.51 0.43 -1.12 117.35 123.68 2wvz s TYR 199 Ca 0.06 0.60 0.03 0.00 -1.01 0.00 0.00 57.07 56.75 2wvz s TYR 199 Cb -0.14 -2.23 -0.03 0.00 -0.11 0.00 0.00 41.96 39.45 2wvz s TYR 199 CO -0.03 0.40 -0.10 -0.59 -1.11 0.00 0.00 175.55 174.12 2wvz s PHE 200 N -0.06 0.97 -0.03 2.71 -0.12 -0.22 -0.60 117.98 120.64 2wvz s PHE 200 Ca 0.16 -0.58 0.03 0.00 -0.05 0.00 0.00 56.93 56.49 2wvz s PHE 200 Cb -0.13 -0.55 0.00 0.00 -0.63 0.00 0.00 43.02 41.71 2wvz s PHE 200 CO 0.04 -0.02 -0.11 0.42 -0.05 0.00 0.00 175.22 175.50 2wvz s ILE 201 N -1.90 0.93 -0.10 -4.49 1.01 0.72 -2.25 121.20 115.11 2wvz s ILE 201 Ca -0.01 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.20 2wvz s ILE 201 Cb -0.06 -0.81 0.02 0.00 0.01 0.00 0.00 42.46 41.61 2wvz s ILE 201 CO 0.00 0.28 -0.10 -0.63 0.00 0.00 0.00 174.94 174.49 2wvz s ILE 202 N 0.13 1.14 -0.18 2.92 1.01 0.11 -2.16 121.20 124.17 2wvz s ILE 202 Ca -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.23 2wvz s ILE 202 Cb -0.09 -1.11 0.01 0.00 0.01 0.00 0.00 42.46 41.29 2wvz s ILE 202 CO 0.01 0.38 -0.18 -1.61 0.00 0.00 0.00 174.94 173.54 2wvz s GLU 203 N 1.33 3.05 0.01 2.79 2.02 0.83 -0.61 118.70 128.13 2wvz s GLU 203 Ca -0.01 -0.80 -0.01 0.00 0.02 0.00 0.00 54.97 54.16 2wvz s GLU 203 Cb -0.14 -2.62 -0.04 0.00 0.10 0.00 0.00 34.13 31.44 2wvz s GLU 203 CO -0.05 -0.18 0.14 -0.06 0.02 0.00 0.00 175.26 175.13 2wvz s PHE 204 N 1.26 3.41 -0.38 1.61 0.40 -0.54 -0.13 117.98 123.61 2wvz s PHE 204 Ca 0.04 0.26 0.08 0.00 -0.60 0.00 0.00 56.93 56.71 2wvz s PHE 204 Cb -0.13 -1.77 0.61 0.00 0.51 0.00 0.00 43.02 42.24 2wvz s PHE 204 CO -0.10 0.59 1.60 -0.40 0.70 0.00 0.00 175.22 177.61 2wvz n ASP 205 N 0.89 4.34 -3.67 1.36 5.75 -0.95 -4.79 116.55 119.48 2wvz n ASP 205 Ca -0.11 -2.96 -0.09 0.00 -0.01 0.00 0.00 54.79 51.62 2wvz n ASP 205 Cb 0.52 -0.70 -0.10 0.00 -1.03 0.00 0.00 41.12 39.82 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 -2.51 0.37 0.45 0.11 2.20 -1.26 -4.92 119.74 114.18 2wvz s LYS 206 Ca 0.45 0.95 -0.25 0.00 -0.36 0.00 0.00 55.97 56.76 2wvz s LYS 206 Cb 0.35 0.18 -0.08 0.00 -1.51 0.00 0.00 37.83 36.78 2wvz s LYS 206 CO 0.11 -0.21 1.32 -2.14 -0.36 0.00 0.00 175.35 174.08 2wvz s PRO 207 N 2.07 3.73 0.34 4.03 0.02 -1.26 -4.97 135.00 138.96 2wvz s PRO 207 Ca -0.05 2.17 -0.27 0.00 0.02 0.00 0.00 61.00 62.87 2wvz s PRO 207 Cb -0.10 -2.60 -0.09 0.00 0.02 0.00 0.00 34.50 31.73 2wvz s PRO 207 CO -0.13 -0.70 1.05 -0.06 -0.33 0.00 0.00 177.00 176.83 2wvz s PHE 208 N -1.29 3.48 -0.11 6.54 0.08 -1.26 -4.88 117.98 120.54 2wvz s PHE 208 Ca 0.61 1.70 0.09 0.00 0.12 0.00 0.00 56.93 59.45 2wvz s PHE 208 Cb -0.38 -3.15 -0.13 0.00 -0.57 0.00 0.00 43.02 38.79 2wvz s PHE 208 CO 0.48 -0.43 0.02 2.41 -0.10 0.00 0.00 175.22 177.61 2wvz n THR 209 N 0.56 0.74 -4.31 0.64 -1.04 0.12 -4.97 114.28 106.02 2wvz n THR 209 Ca 0.02 -0.44 -0.26 0.00 -2.04 0.00 0.00 64.05 61.33 2wvz n THR 209 Cb 0.48 -0.74 -0.09 0.00 -1.82 0.00 0.00 70.33 68.16 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 -2.26 2.62 -0.28 -1.42 6.14 -1.00 -4.97 117.35 116.17 2wvz s TYR 210 Ca -0.06 -0.23 -0.20 0.00 0.64 0.00 0.00 57.07 57.22 2wvz s TYR 210 Cb 0.03 -1.24 0.13 0.00 0.42 0.00 0.00 41.96 41.30 2wvz s TYR 210 CO 0.43 0.55 0.96 -1.59 0.64 0.00 0.00 175.55 176.55 2wvz s LYS 211 N -3.09 0.48 -0.07 4.97 -2.85 -1.26 -2.86 119.74 115.06 2wvz s LYS 211 Ca 0.27 0.70 -0.12 0.00 -1.00 0.00 0.00 55.97 55.82 2wvz s LYS 211 Cb -0.08 0.16 0.03 0.00 -2.06 0.00 0.00 37.83 35.88 2wvz s LYS 211 CO 0.16 -0.08 0.30 0.00 0.10 0.00 0.00 175.35 175.83 2wvz s ALA 212 N 0.89 -0.74 0.59 0.59 0.00 0.05 -0.47 121.76 122.68 2wvz s ALA 212 Ca -0.04 0.58 -0.01 0.00 0.00 0.00 0.00 51.96 52.49 2wvz s ALA 212 Cb -0.04 -0.23 0.04 0.00 0.00 0.00 0.00 23.12 22.89 2wvz s ALA 212 CO -0.11 -0.20 0.84 0.95 0.00 0.00 0.00 175.76 177.24 2wvz s THR 213 N -0.55 2.55 -0.01 0.00 -4.23 -1.16 -0.52 115.64 111.72 2wvz s THR 213 Ca -0.07 -0.57 0.04 0.00 -1.18 0.00 0.00 61.69 59.92 2wvz s THR 213 Cb -0.04 -2.98 -0.01 0.00 1.34 0.00 0.00 72.50 70.81 2wvz s THR 213 CO 0.02 0.00 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.27 2wvz s VAL 214 N -2.89 1.10 -0.26 2.29 1.01 0.19 -1.23 120.40 120.61 2wvz s VAL 214 Ca 0.58 -0.63 -0.03 0.00 0.00 0.00 0.00 61.98 61.90 2wvz s VAL 214 Cb -0.10 -0.93 0.09 0.00 0.00 0.00 0.00 36.38 35.44 2wvz s VAL 214 CO 0.40 0.29 0.10 -0.70 0.00 0.00 0.00 175.10 175.18 2wvz s GLU 215 N -0.40 0.42 -1.26 2.72 -6.30 0.07 -2.04 118.70 111.91 2wvz s GLU 215 Ca 0.05 -0.61 -0.21 0.00 -2.50 0.00 0.00 54.97 51.70 2wvz s GLU 215 Cb -0.06 -1.67 0.02 0.00 0.00 0.00 0.00 34.13 32.42 2wvz s GLU 215 CO -0.00 -0.89 0.60 0.09 0.02 0.00 0.00 175.26 175.08 2wvz n ASN 216 N 5.10 -3.36 0.00 -1.70 5.03 -0.94 -1.46 115.26 117.94 2wvz n ASN 216 Ca -0.06 -1.16 0.00 0.00 0.87 0.00 0.00 54.58 54.23 2wvz n ASN 216 Cb 0.44 -2.42 0.00 0.00 -1.02 0.00 0.00 39.78 36.78 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 -2.00 0.68 3.55 7.41 0.00 -1.26 -4.99 105.19 108.57 2wvz n GLY 217 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.63 6.07 0.09 1.61 0.01 -0.54 -4.92 114.94 114.64 2wvz s ASN 218 Ca 0.00 -0.28 -0.31 0.00 -0.71 0.00 0.00 52.86 51.56 2wvz s ASN 218 Cb 0.00 -2.14 -0.09 0.00 0.41 0.00 0.00 41.25 39.43 2wvz s ASN 218 CO 0.00 -0.20 1.65 -0.22 -1.51 0.00 0.00 177.10 176.82 2wvz s LEU 219 N 1.78 4.37 -0.61 0.60 2.96 -1.26 -0.75 118.68 125.76 2wvz s LEU 219 Ca 0.07 2.53 0.05 0.00 -0.22 0.00 0.00 54.13 56.57 2wvz s LEU 219 Cb -0.17 -3.57 0.19 0.00 0.50 0.00 0.00 46.19 43.15 2wvz s LEU 219 CO 0.11 -0.88 0.53 0.00 -1.32 0.00 0.00 176.35 174.78 2wvz n GLN 220 N 5.30 1.60 -1.66 1.98 1.13 -0.36 -4.96 117.38 120.41 2wvz n GLN 220 Ca 0.16 -4.19 -0.46 0.00 -1.94 0.00 0.00 57.00 50.56 2wvz n GLN 220 Cb 0.40 -2.08 -0.04 0.00 0.11 0.00 0.00 30.24 28.63 2wvz n GLN 220 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2wvz n GLU 221 N 1.82 2.01 -0.54 -1.09 2.13 -1.26 -2.06 120.64 121.65 2wvz n GLU 221 Ca 0.24 0.72 0.00 0.00 0.66 0.00 0.00 57.16 58.78 2wvz n GLU 221 Cb 0.40 -2.46 0.00 0.00 0.27 0.00 0.00 31.44 29.66 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 3.09 0.00 -4.72 4.31 3.02 0.39 -4.94 115.26 116.41 2wvz n ASN 222 Ca 0.16 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.30 2wvz n ASN 222 Cb 0.28 -0.62 -0.03 0.00 -0.61 0.00 0.00 39.78 38.80 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 -2.87 4.17 0.16 2.41 1.01 -0.87 -4.96 120.40 119.45 2wvz s VAL 223 Ca 0.00 1.68 0.05 0.00 0.00 0.00 0.00 61.98 63.71 2wvz s VAL 223 Cb 0.00 -4.07 -0.17 0.00 0.00 0.00 0.00 36.38 32.14 2wvz s VAL 223 CO 0.00 0.20 1.35 0.00 0.00 0.00 0.00 175.10 176.65 2wvz h ALA 224 N 6.11 0.48 -2.83 5.51 0.00 -1.91 -3.27 119.26 123.35 2wvz h ALA 224 Ca -0.43 -0.79 -0.12 0.00 0.00 0.00 0.00 54.91 53.58 2wvz h ALA 224 Cb 1.21 -0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.81 2wvz h ALA 224 CO 0.76 1.03 -0.18 -1.83 0.00 0.00 0.00 179.25 179.03 2wvz s GLU 225 N -3.03 1.60 -0.22 0.00 -1.05 -1.26 -0.62 118.70 114.12 2wvz s GLU 225 Ca -0.01 -1.40 -0.17 0.00 -0.15 0.00 0.00 54.97 53.24 2wvz s GLU 225 Cb 0.10 0.45 0.06 0.00 -0.44 0.00 0.00 34.13 34.30 2wvz s GLU 225 CO 0.82 -0.66 0.57 -0.65 0.95 0.00 0.00 175.26 176.30 2wvz s GLN 226 N -3.79 0.62 -0.23 -4.83 -1.52 0.10 -4.98 119.66 105.02 2wvz s GLN 226 Ca 0.26 0.92 0.01 0.00 -1.95 0.00 0.00 55.36 54.59 2wvz s GLN 226 Cb 0.00 0.20 0.06 0.00 -0.22 0.00 0.00 33.01 33.05 2wvz s GLN 226 CO 0.12 -0.12 -0.05 0.99 -0.25 0.00 0.00 175.29 175.98 2wvz s THR 227 N 0.91 1.47 0.06 -0.19 2.01 -1.26 -1.46 115.64 117.17 2wvz s THR 227 Ca -0.05 -1.18 -0.09 0.00 0.31 0.00 0.00 61.69 60.68 2wvz s THR 227 Cb -0.05 -1.75 0.03 0.00 0.01 0.00 0.00 72.50 70.74 2wvz s THR 227 CO -0.08 -0.11 0.42 1.07 -0.69 0.00 0.00 174.62 175.23 2wvz n THR 228 N 4.69 0.00 -0.13 -0.82 5.66 -0.89 -5.03 114.28 117.76 2wvz n THR 228 Ca -0.12 -0.20 -0.06 0.00 -3.05 0.00 0.00 64.05 60.63 2wvz n THR 228 Cb 0.44 0.29 0.02 0.00 -1.55 0.00 0.00 70.33 69.54 2wvz n THR 228 CO 0.00 0.00 0.00 -0.78 -3.05 0.00 0.00 175.07 171.24 2wvz h ASP 229 N 0.77 0.28 -3.03 1.09 3.58 -1.94 0.83 116.42 118.00 2wvz h ASP 229 Ca -0.10 0.03 -0.59 0.00 0.42 0.00 0.00 57.03 56.79 2wvz h ASP 229 Cb 0.47 -0.03 -0.40 0.00 1.72 0.00 0.00 39.33 41.09 2wvz h ASP 229 CO 0.14 0.20 -0.79 -2.28 -2.88 0.00 0.00 179.24 173.64 2wvz s HIS 230 N -6.15 1.29 0.27 0.28 2.46 -1.26 -1.25 115.29 110.93 2wvz s HIS 230 Ca -0.13 -1.83 -0.16 0.00 0.47 0.00 0.00 55.06 53.41 2wvz s HIS 230 Cb 0.12 -1.40 -0.08 0.00 -0.13 0.00 0.00 32.58 31.09 2wvz s HIS 230 CO 0.72 -0.82 0.70 0.00 -2.47 0.00 0.00 174.74 172.87 2wvz s ALA 231 N 1.06 3.39 0.25 1.58 0.00 -1.25 -2.20 121.76 124.58 2wvz s ALA 231 Ca 0.15 0.05 -0.11 0.00 0.00 0.00 0.00 51.96 52.05 2wvz s ALA 231 Cb -0.22 -2.74 -0.01 0.00 0.00 0.00 0.00 23.12 20.15 2wvz s ALA 231 CO -0.09 0.35 0.44 0.20 0.00 0.00 0.00 175.76 176.66 2wvz s GLY 232 N -2.02 0.70 -0.13 0.00 0.00 -0.87 -1.18 107.32 103.82 2wvz s GLY 232 Ca 0.49 -1.02 -0.07 0.00 0.00 0.00 0.00 44.72 44.12 2wvz s GLY 232 CO 0.19 -0.74 0.32 0.00 0.00 0.00 0.00 173.10 172.87 2wvz s ALA 233 N -3.97 -0.78 -0.08 3.20 0.00 -0.31 0.56 121.76 120.38 2wvz s ALA 233 Ca 0.25 1.24 0.03 0.00 0.00 0.00 0.00 51.96 53.49 2wvz s ALA 233 Cb 0.00 -0.77 -0.01 0.00 0.00 0.00 0.00 23.12 22.34 2wvz s ALA 233 CO 0.10 -0.23 -0.19 0.42 0.00 0.00 0.00 175.76 175.86 2wvz s ILE 234 N 1.32 2.59 0.19 0.00 1.01 0.32 -1.01 121.20 125.61 2wvz s ILE 234 Ca -0.09 -0.86 0.06 0.00 0.00 0.00 0.00 60.65 59.75 2wvz s ILE 234 Cb -0.09 -2.01 -0.05 0.00 0.01 0.00 0.00 42.46 40.32 2wvz s ILE 234 CO -0.10 0.56 -0.10 0.27 0.00 0.00 0.00 174.94 175.56 2wvz s ILE 235 N -0.09 1.39 0.35 2.92 -5.25 -0.91 -0.77 121.20 118.85 2wvz s ILE 235 Ca -0.04 -2.12 -0.15 0.00 -0.99 0.00 0.00 60.65 57.35 2wvz s ILE 235 Cb -0.14 -2.01 0.04 0.00 2.95 0.00 0.00 42.46 43.30 2wvz s ILE 235 CO 0.04 -0.62 0.73 -0.83 -1.79 0.00 0.00 174.94 172.47 2wvz s GLY 236 N -3.25 0.40 -0.00 6.27 0.00 -1.13 -0.54 107.32 109.06 2wvz s GLY 236 Ca 0.21 -0.75 -0.12 0.00 0.00 0.00 0.00 44.72 44.07 2wvz s GLY 236 CO 0.04 -0.35 0.53 1.97 0.00 0.00 0.00 173.10 175.29 2wvz n PHE 237 N -0.51 -0.32 -3.82 1.90 -0.00 -0.73 0.16 117.46 114.14 2wvz n PHE 237 Ca -0.06 -0.32 -0.36 0.00 -0.00 0.00 0.00 57.45 56.70 2wvz n PHE 237 Cb 0.60 0.15 -0.07 0.00 -0.00 0.00 0.00 39.48 40.16 2wvz n PHE 237 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.76 176.97 2wvz s LYS 238 N -2.01 3.71 -0.07 3.97 2.20 -1.26 -2.61 119.74 123.67 2wvz s LYS 238 Ca 0.12 -0.15 0.03 0.00 -0.36 0.00 0.00 55.97 55.62 2wvz s LYS 238 Cb -0.00 -3.27 0.01 0.00 -1.51 0.00 0.00 37.83 33.05 2wvz s LYS 238 CO -0.00 0.61 -0.17 0.95 -0.36 0.00 0.00 175.35 176.38 2wvz s THR 239 N -0.55 1.48 0.39 3.43 -4.23 0.13 -5.00 115.64 111.29 2wvz s THR 239 Ca 0.13 -0.69 -0.06 0.00 -1.18 0.00 0.00 61.69 59.89 2wvz s THR 239 Cb -0.12 -1.31 -0.05 0.00 1.34 0.00 0.00 72.50 72.37 2wvz s THR 239 CO 0.02 0.43 0.68 0.00 -0.54 0.00 0.00 174.62 175.21 2wvz s ARG 240 N 0.46 3.62 -0.21 3.99 1.70 -1.26 -0.50 118.95 126.75 2wvz s ARG 240 Ca -0.14 0.13 -0.39 0.00 -0.47 0.00 0.00 55.73 54.86 2wvz s ARG 240 Cb -0.16 -2.50 -0.15 0.00 -0.57 0.00 0.00 34.95 31.57 2wvz s ARG 240 CO 0.05 0.01 1.73 1.17 -1.08 0.00 0.00 175.30 177.18 2wvz n LYS 241 N -1.58 1.36 -0.77 3.89 4.81 -1.26 -1.13 118.16 123.48 2wvz n LYS 241 Ca -0.00 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 57.93 2wvz n LYS 241 Cb 0.55 -2.21 0.00 0.00 0.02 0.00 0.00 35.03 33.39 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 4.08 0.78 3.69 3.14 0.00 -0.70 -4.90 105.19 111.28 2wvz n GLY 242 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.23 4.22 -0.20 1.61 2.12 -0.28 -4.72 118.70 121.21 2wvz s GLU 243 Ca 0.00 2.25 -0.13 0.00 0.36 0.00 0.00 54.97 57.45 2wvz s GLU 243 Cb 0.00 -3.55 -0.05 0.00 0.26 0.00 0.00 34.13 30.79 2wvz s GLU 243 CO 0.00 -0.69 0.28 -0.65 -0.54 0.00 0.00 175.26 173.66 2wvz s GLN 244 N 2.45 4.17 -0.16 4.30 -0.21 -1.26 -1.93 119.66 127.02 2wvz s GLN 244 Ca 0.71 0.00 -0.04 0.00 0.02 0.00 0.00 55.36 56.05 2wvz s GLN 244 Cb -0.38 -3.50 -0.03 0.00 1.00 0.00 0.00 33.01 30.10 2wvz s GLN 244 CO 0.31 0.09 -0.03 0.08 -2.12 0.00 0.00 175.29 173.62 2wvz s VAL 245 N 0.93 3.95 -0.09 1.09 1.01 -0.23 -4.95 120.40 122.12 2wvz s VAL 245 Ca 0.14 -0.34 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 2wvz s VAL 245 Cb -0.14 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.47 2wvz s VAL 245 CO 0.05 0.49 0.03 0.20 0.00 0.00 0.00 175.10 175.87 2wvz s ASN 246 N 0.39 5.48 -0.15 3.32 0.01 -1.26 -0.16 114.94 122.57 2wvz s ASN 246 Ca -0.03 0.20 -0.01 0.00 -0.71 0.00 0.00 52.86 52.31 2wvz s ASN 246 Cb -0.14 -1.59 0.04 0.00 0.41 0.00 0.00 41.25 39.97 2wvz s ASN 246 CO 0.03 0.38 -0.04 0.00 -1.51 0.00 0.00 177.10 175.95 2wvz s ALA 247 N -0.94 1.33 -0.00 0.60 0.00 -0.05 -2.24 121.76 120.46 2wvz s ALA 247 Ca 0.14 -0.69 -0.21 0.00 0.00 0.00 0.00 51.96 51.20 2wvz s ALA 247 Cb -0.11 -1.05 -0.05 0.00 0.00 0.00 0.00 23.12 21.90 2wvz s ALA 247 CO 0.03 -0.72 0.60 1.03 0.00 0.00 0.00 175.76 176.70 2wvz s ARG 248 N 1.70 4.32 -0.03 0.00 0.52 0.81 -0.79 118.95 125.48 2wvz s ARG 248 Ca 0.02 0.74 -0.03 0.00 -0.52 0.00 0.00 55.73 55.94 2wvz s ARG 248 Cb -0.15 -3.34 0.01 0.00 0.52 0.00 0.00 34.95 31.99 2wvz s ARG 248 CO -0.08 0.37 0.09 0.42 0.02 0.00 0.00 175.30 176.12 2wvz s ILE 249 N -0.18 -0.01 0.06 1.52 1.01 -0.68 -0.12 121.20 122.80 2wvz s ILE 249 Ca 0.31 0.03 -0.18 0.00 0.00 0.00 0.00 60.65 60.81 2wvz s ILE 249 Cb -0.18 -0.13 0.04 0.00 0.01 0.00 0.00 42.46 42.19 2wvz s ILE 249 CO 0.17 0.01 0.41 0.00 0.00 0.00 0.00 174.94 175.53 2wvz s ALA 250 N 0.21 -0.99 0.17 9.38 0.00 -0.92 0.04 121.76 129.66 2wvz s ALA 250 Ca -0.01 0.23 -0.04 0.00 0.00 0.00 0.00 51.96 52.14 2wvz s ALA 250 Cb -0.02 0.42 -0.03 0.00 0.00 0.00 0.00 23.12 23.48 2wvz s ALA 250 CO -0.01 -0.49 0.17 -1.54 0.00 0.00 0.00 175.76 173.89 2wvz s SER 251 N -2.17 0.16 -0.03 0.00 1.04 -1.19 -0.20 113.70 111.31 2wvz s SER 251 Ca -0.04 -1.18 -0.26 0.00 0.48 0.00 0.00 55.95 54.95 2wvz s SER 251 Cb -0.00 0.38 0.06 0.00 0.10 0.00 0.00 66.02 66.56 2wvz s SER 251 CO -0.04 -0.84 0.58 -0.55 0.98 0.00 0.00 173.24 173.37 2wvz s SER 252 N -3.07 -0.53 0.00 7.02 0.15 0.23 -4.78 113.70 112.71 2wvz s SER 252 Ca 0.28 0.52 0.26 0.00 0.70 0.00 0.00 55.95 57.70 2wvz s SER 252 Cb 0.06 0.48 0.54 0.00 -1.71 0.00 0.00 66.02 65.39 2wvz s SER 252 CO 0.06 -0.59 1.45 0.49 1.20 0.00 0.00 173.24 175.85 2wvz n PHE 253 N 0.94 0.00 -0.06 3.44 3.01 -1.26 -0.43 117.46 123.09 2wvz n PHE 253 Ca -0.20 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.22 2wvz n PHE 253 Cb 0.57 -0.01 -0.02 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 0.61 1.17 -3.53 4.37 5.41 -1.26 -4.76 119.36 121.36 2wvz n ILE 254 Ca 0.15 0.25 -0.07 0.00 1.00 0.00 0.00 62.75 64.08 2wvz n ILE 254 Cb 0.47 -2.21 -0.02 0.00 -0.71 0.00 0.00 39.64 37.17 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 -5.39 -0.32 0.22 4.38 1.04 -1.26 -4.98 113.70 107.39 2wvz s SER 255 Ca -0.16 -0.03 -0.13 0.00 0.48 0.00 0.00 55.95 56.11 2wvz s SER 255 Cb 0.02 0.35 0.26 0.00 0.10 0.00 0.00 66.02 66.76 2wvz s SER 255 CO 0.23 -0.58 1.61 -0.26 0.98 0.00 0.00 173.24 175.23 2wvz h PHE 256 N 2.00 -0.40 -0.87 5.02 0.04 -1.91 0.41 116.94 121.22 2wvz h PHE 256 Ca -0.21 0.06 0.14 0.00 2.80 0.00 0.00 57.97 60.77 2wvz h PHE 256 Cb 1.23 0.28 -0.09 0.00 2.20 0.00 0.00 35.95 39.57 2wvz h PHE 256 CO 0.27 -0.30 0.47 1.49 -0.60 0.00 0.00 178.31 179.64 2wvz h GLU 257 N -0.01 0.67 0.01 1.51 4.81 -1.99 0.28 114.58 119.85 2wvz h GLU 257 Ca 0.32 -0.04 -0.19 0.00 -0.13 0.00 0.00 59.36 59.32 2wvz h GLU 257 Cb 0.51 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 2wvz h GLU 257 CO -0.71 0.44 -0.90 0.37 -0.73 0.00 0.00 179.01 177.49 2wvz h GLN 258 N 0.69 0.03 -0.33 1.92 5.75 -1.49 -2.11 115.11 119.57 2wvz h GLN 258 Ca 0.47 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.90 2wvz h GLN 258 Cb 0.62 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.17 2wvz h GLN 258 CO -0.34 0.91 0.12 0.00 -2.65 0.00 0.00 178.83 176.87 2wvz h ALA 259 N 1.08 0.43 -0.90 3.38 0.00 0.10 0.13 119.26 123.48 2wvz h ALA 259 Ca -0.02 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 54.87 2wvz h ALA 259 Cb 1.57 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 19.15 2wvz h ALA 259 CO 0.12 0.04 0.52 0.00 0.00 0.00 0.00 179.25 179.93 2wvz h ALA 260 N 0.96 1.33 0.00 0.00 0.00 -0.41 -1.46 119.26 119.69 2wvz h ALA 260 Ca 0.11 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2wvz h ALA 260 Cb 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2wvz h ALA 260 CO -0.01 0.08 -0.00 0.00 0.00 0.00 0.00 179.25 179.32 2wvz h ALA 261 N 1.52 -0.00 -0.96 0.00 0.00 -0.66 -2.93 119.26 116.23 2wvz h ALA 261 Ca 0.46 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.46 2wvz h ALA 261 Cb 0.51 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.22 2wvz h ALA 261 CO -0.29 -0.47 0.61 -0.91 0.00 0.00 0.00 179.25 178.19 2wvz h ASN 262 N -0.06 0.83 -1.47 0.00 2.35 0.10 -0.09 115.58 117.24 2wvz h ASN 262 Ca -0.00 0.05 0.43 0.00 -0.55 0.00 0.00 56.30 56.22 2wvz h ASN 262 Cb 0.06 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 38.24 2wvz h ASN 262 CO 0.00 0.44 1.05 -0.03 -1.65 0.00 0.00 177.43 177.24 2wvz h MET 263 N 0.89 0.01 0.00 0.81 4.05 -1.10 0.13 114.93 119.73 2wvz h MET 263 Ca 0.48 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.90 2wvz h MET 263 Cb 0.56 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.36 2wvz h MET 263 CO -0.24 0.01 0.00 0.09 0.23 0.00 0.00 176.91 176.99 2wvz n ASN 264 N -4.12 0.47 0.12 1.39 5.03 -0.05 -1.45 115.26 116.65 2wvz n ASN 264 Ca 0.33 0.64 0.19 0.00 0.87 0.00 0.00 54.58 56.60 2wvz n ASN 264 Cb 1.52 -0.73 0.77 0.00 -1.02 0.00 0.00 39.78 40.31 2wvz n ASN 264 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 2wvz h GLU 265 N 0.00 0.00 0.00 3.52 5.08 -1.16 -2.10 114.58 119.93 2wvz h GLU 265 Ca 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 2wvz h GLU 265 Cb 0.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2wvz h GLU 265 CO 0.00 0.00 -0.45 -0.07 -1.00 0.00 0.00 179.01 177.49 2wvz h LEU 266 N 0.00 0.00 0.00 1.33 3.38 -1.48 -3.50 115.31 115.05 2wvz h LEU 266 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2wvz h LEU 266 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2wvz h LEU 266 CO -0.00 0.45 0.00 0.61 0.09 0.00 0.00 178.44 179.59 2wvz n GLY 267 N 1.21 2.36 0.29 0.83 0.00 -0.79 -2.53 105.19 106.56 2wvz n GLY 267 Ca 0.02 -0.38 0.03 0.00 0.00 0.00 0.00 46.02 45.68 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 13.32 2.76 -1.63 1.61 4.76 -1.26 -5.00 118.16 132.72 2wvz n LYS 268 Ca 0.00 -1.70 -0.42 0.00 -2.87 0.00 0.00 58.31 53.31 2wvz n LYS 268 Cb 0.00 -1.12 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 2wvz n LYS 268 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2wvz n ASP 269 N -0.01 1.68 -4.68 4.39 8.00 -1.05 -5.04 116.55 119.84 2wvz n ASP 269 Ca 0.05 1.11 -0.24 0.00 0.71 0.00 0.00 54.79 56.42 2wvz n ASP 269 Cb 0.32 -1.37 0.10 0.00 -0.02 0.00 0.00 41.12 40.15 2wvz n ASP 269 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2wvz s ASN 270 N -0.59 4.37 0.16 -2.24 2.20 -1.26 -4.88 114.94 112.71 2wvz s ASN 270 Ca 0.60 -0.11 -0.22 0.00 -0.94 0.00 0.00 52.86 52.19 2wvz s ASN 270 Cb -0.59 -0.32 0.07 0.00 -2.00 0.00 0.00 41.25 38.40 2wvz s ASN 270 CO 0.59 -1.85 1.61 0.40 -2.94 0.00 0.00 177.10 174.91 2wvz h ILE 271 N -0.61 0.31 -0.63 0.54 1.08 -1.96 -2.18 117.51 114.06 2wvz h ILE 271 Ca -0.39 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.19 2wvz h ILE 271 Cb 1.27 0.31 -0.08 0.00 -3.07 0.00 0.00 36.82 35.25 2wvz h ILE 271 CO 0.44 0.00 0.19 -0.33 -0.69 0.00 0.00 178.15 177.76 2wvz h GLU 272 N -0.22 0.33 -0.11 2.37 3.07 -1.99 0.16 114.58 118.19 2wvz h GLU 272 Ca 0.17 -0.02 -0.14 0.00 -0.50 0.00 0.00 59.36 58.87 2wvz h GLU 272 Cb 0.50 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 2wvz h GLU 272 CO -0.49 0.22 -0.54 1.96 -1.40 0.00 0.00 179.01 178.75 2wvz h GLN 273 N 0.34 0.32 -0.25 2.33 4.20 -1.83 -2.24 115.11 117.97 2wvz h GLN 273 Ca 0.33 -0.20 -0.18 0.00 0.06 0.00 0.00 58.65 58.67 2wvz h GLN 273 Cb 0.47 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.27 2wvz h GLN 273 CO -0.37 0.78 -0.53 -0.07 -0.67 0.00 0.00 178.83 177.97 2wvz h LEU 274 N 0.25 0.90 -0.30 1.46 3.38 -0.74 -2.46 115.31 117.81 2wvz h LEU 274 Ca 0.00 -0.55 0.05 0.00 0.09 0.00 0.00 57.88 57.47 2wvz h LEU 274 Cb 1.04 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 2wvz h LEU 274 CO 0.09 1.28 0.04 0.00 0.09 0.00 0.00 178.44 179.95 2wvz h ALA 275 N 0.65 0.30 -0.41 1.53 0.00 -0.64 -0.38 119.26 120.31 2wvz h ALA 275 Ca 0.01 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2wvz h ALA 275 Cb 1.14 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2wvz h ALA 275 CO 0.12 -0.36 0.01 0.37 0.00 0.00 0.00 179.25 179.38 2wvz h GLN 276 N 0.15 0.66 -0.59 0.00 5.75 -1.36 0.48 115.11 120.20 2wvz h GLN 276 Ca 0.14 -0.15 -0.10 0.00 -0.15 0.00 0.00 58.65 58.39 2wvz h GLN 276 Cb 0.16 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 2wvz h GLN 276 CO -0.20 0.67 -0.01 0.87 -2.65 0.00 0.00 178.83 177.51 2wvz h LYS 277 N 0.62 1.06 -0.14 1.69 1.57 -0.96 0.11 116.57 120.52 2wvz h LYS 277 Ca 0.13 -0.34 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 2wvz h LYS 277 Cb 0.38 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2wvz h LYS 277 CO 0.01 1.04 0.03 0.78 -0.57 0.00 0.00 179.45 180.75 2wvz h GLY 278 N 0.95 0.25 0.34 3.86 0.00 -0.24 0.49 103.07 108.72 2wvz h GLY 278 Ca 0.17 -0.16 0.10 0.00 0.00 0.00 0.00 47.33 47.44 2wvz h GLY 278 CO 0.03 0.15 0.18 1.70 0.00 0.00 0.00 176.54 178.60 2wvz h LYS 279 N 0.03 0.33 0.01 4.80 3.64 0.09 0.02 116.57 125.48 2wvz h LYS 279 Ca 0.05 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2wvz h LYS 279 Cb 0.26 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 2wvz h LYS 279 CO 0.00 0.22 -0.00 -0.44 -2.27 0.00 0.00 179.45 176.96 2wvz h ASP 280 N 0.34 -0.01 -0.72 4.20 3.32 -0.56 -1.19 116.42 121.80 2wvz h ASP 280 Ca 0.30 -0.02 0.11 0.00 0.02 0.00 0.00 57.03 57.44 2wvz h ASP 280 Cb 0.39 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.86 2wvz h ASP 280 CO -0.33 0.02 0.32 0.00 -1.72 0.00 0.00 179.24 177.53 2wvz h ALA 281 N 0.96 1.00 -0.13 3.45 0.00 -0.01 0.11 119.26 124.65 2wvz h ALA 281 Ca -0.00 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2wvz h ALA 281 Cb 0.03 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2wvz h ALA 281 CO 0.00 -0.13 -0.23 -1.49 0.00 0.00 0.00 179.25 177.40 2wvz h TRP 282 N 0.52 0.48 0.00 0.00 4.06 -0.83 -3.01 115.95 117.17 2wvz h TRP 282 Ca 0.37 -0.17 -0.00 0.00 2.06 0.00 0.00 58.89 61.15 2wvz h TRP 282 Cb 0.48 -0.09 -0.00 0.00 -1.00 0.00 0.00 29.16 28.55 2wvz h TRP 282 CO -0.14 0.85 -0.01 -0.91 -3.56 0.00 0.00 178.44 174.67 2wvz h ASN 283 N -0.03 0.00 -0.78 -3.49 -0.26 -0.83 0.56 115.58 110.75 2wvz h ASN 283 Ca 0.01 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.72 2wvz h ASN 283 Cb 0.81 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 38.04 2wvz h ASN 283 CO 0.05 0.01 0.39 -0.61 -1.06 0.00 0.00 177.43 176.21 2wvz h GLN 284 N 0.00 1.11 0.07 0.81 5.75 -0.66 -0.98 115.11 121.22 2wvz h GLN 284 Ca -0.00 -0.16 -0.33 0.00 -0.15 0.00 0.00 58.65 58.01 2wvz h GLN 284 Cb 0.02 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 28.33 2wvz h GLN 284 CO 0.00 0.85 -1.85 1.33 -2.65 0.00 0.00 178.83 176.51 2wvz n VAL 285 N -4.38 1.71 0.18 2.39 0.24 -0.62 -4.11 118.33 113.74 2wvz n VAL 285 Ca 0.07 -0.72 0.02 0.00 -2.04 0.00 0.00 64.34 61.67 2wvz n VAL 285 Cb 0.13 -1.42 0.33 0.00 -1.47 0.00 0.00 33.84 31.41 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 0.04 0.00 -0.06 1.34 3.38 0.09 -2.98 115.31 117.12 2wvz h LEU 286 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2wvz h LEU 286 Cb 2.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.78 2wvz h LEU 286 CO 0.09 0.41 -0.01 0.61 0.09 0.00 0.00 178.44 179.63 2wvz n GLY 287 N -0.25 -1.04 0.24 0.83 0.00 -0.38 -2.94 105.19 101.66 2wvz n GLY 287 Ca -0.02 -0.20 0.16 0.00 0.00 0.00 0.00 46.02 45.97 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 0.15 0.00 -4.24 1.61 1.79 -1.69 -3.37 116.57 110.82 2wvz h LYS 288 Ca 0.00 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.87 2wvz h LYS 288 Cb 0.14 0.00 -0.38 0.00 -1.58 0.00 0.00 32.23 30.40 2wvz h LYS 288 CO 0.00 0.00 -0.78 0.42 -1.08 0.00 0.00 179.45 178.01 2wvz s ILE 289 N -3.65 1.38 -0.28 1.86 1.01 -1.15 -0.35 121.20 120.02 2wvz s ILE 289 Ca 0.01 -1.11 -0.09 0.00 0.00 0.00 0.00 60.65 59.45 2wvz s ILE 289 Cb 0.09 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 2wvz s ILE 289 CO 0.46 -0.11 0.14 -1.61 0.00 0.00 0.00 174.94 173.82 2wvz s GLU 290 N 1.47 3.71 0.05 2.79 2.02 -0.29 -4.92 118.70 123.53 2wvz s GLU 290 Ca -0.05 -0.46 0.06 0.00 0.02 0.00 0.00 54.97 54.53 2wvz s GLU 290 Cb -0.18 -3.52 -0.04 0.00 0.10 0.00 0.00 34.13 30.49 2wvz s GLU 290 CO -0.06 -0.24 -0.11 0.14 0.02 0.00 0.00 175.26 175.01 2wvz s VAL 291 N 1.68 3.34 0.26 2.63 -7.23 -1.26 0.40 120.40 120.21 2wvz s VAL 291 Ca 0.06 -1.07 -0.09 0.00 -1.81 0.00 0.00 61.98 59.07 2wvz s VAL 291 Cb -0.16 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.29 2wvz s VAL 291 CO 0.07 0.27 0.44 -1.83 -0.31 0.00 0.00 175.10 173.74 2wvz s GLU 292 N -1.74 1.58 -0.33 4.82 -1.05 -0.42 -4.98 118.70 116.58 2wvz s GLU 292 Ca 0.18 -1.39 -0.02 0.00 -0.15 0.00 0.00 54.97 53.59 2wvz s GLU 292 Cb -0.11 0.44 0.00 0.00 -0.44 0.00 0.00 34.13 34.02 2wvz s GLU 292 CO 0.10 -0.64 0.29 0.41 0.95 0.00 0.00 175.26 176.36 2wvz n GLY 293 N -0.40 0.56 0.00 -3.83 0.00 -1.26 -2.28 105.19 97.97 2wvz n GLY 293 Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.89 4.48 3.83 -0.02 0.00 -1.26 -2.51 105.19 108.82 2wvz n GLY 294 Ca -0.00 -1.63 -0.22 0.00 0.00 0.00 0.00 46.02 44.17 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 -0.36 4.89 0.41 1.61 2.20 -1.26 -4.97 114.94 117.47 2wvz s ASN 295 Ca 0.00 -0.81 0.13 0.00 -0.94 0.00 0.00 52.86 51.24 2wvz s ASN 295 Cb 0.00 -0.59 0.97 0.00 -2.00 0.00 0.00 41.25 39.63 2wvz s ASN 295 CO 0.00 -0.58 1.95 0.25 -2.94 0.00 0.00 177.10 175.78 2wvz h LEU 296 N 1.17 0.44 0.16 3.54 5.85 -2.02 0.46 115.31 124.91 2wvz h LEU 296 Ca -0.42 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 2wvz h LEU 296 Cb 1.26 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.21 2wvz h LEU 296 CO 0.61 0.26 -0.08 0.44 -0.34 0.00 0.00 178.44 179.33 2wvz h ASP 297 N 0.49 -0.18 -0.35 1.25 3.32 -1.99 0.28 116.42 119.24 2wvz h ASP 297 Ca 0.32 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.34 2wvz h ASP 297 Cb 0.59 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 2wvz h ASP 297 CO -0.10 -0.11 0.14 1.56 -1.72 0.00 0.00 179.24 179.00 2wvz h GLN 298 N -0.24 0.52 -0.17 3.56 4.20 -1.42 0.13 115.11 121.70 2wvz h GLN 298 Ca -0.02 -0.10 0.05 0.00 0.06 0.00 0.00 58.65 58.64 2wvz h GLN 298 Cb 0.18 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 2wvz h GLN 298 CO 0.04 0.52 -0.13 1.88 -0.67 0.00 0.00 178.83 180.46 2wvz h TYR 299 N 0.42 -0.33 -0.80 2.96 0.05 -0.85 0.48 116.97 118.89 2wvz h TYR 299 Ca 0.12 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 2wvz h TYR 299 Cb 0.19 0.17 -0.04 0.00 1.01 0.00 0.00 36.73 38.06 2wvz h TYR 299 CO -0.00 -0.20 0.48 0.00 -1.05 0.00 0.00 178.16 177.39 2wvz h ARG 300 N -0.14 1.09 -0.04 4.88 3.08 -0.59 -1.88 114.38 120.79 2wvz h ARG 300 Ca 0.10 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2wvz h ARG 300 Cb 0.30 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 2wvz h ARG 300 CO -0.25 0.77 -0.02 1.15 -1.07 0.00 0.00 179.97 180.55 2wvz h THR 301 N 1.10 1.33 -0.19 2.04 2.02 -0.55 -1.67 112.91 117.00 2wvz h THR 301 Ca 0.29 -1.03 0.05 0.00 0.77 0.00 0.00 66.41 66.49 2wvz h THR 301 Cb -0.04 1.95 -0.07 0.00 -1.74 0.00 0.00 68.15 68.26 2wvz h THR 301 CO -0.05 0.28 -0.29 0.15 0.37 0.00 0.00 175.52 175.97 2wvz h PHE 302 N -0.32 -0.80 0.00 3.16 3.57 -0.70 -0.34 116.94 121.51 2wvz h PHE 302 Ca 0.01 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 2wvz h PHE 302 Cb 0.46 0.38 -0.00 0.00 2.79 0.00 0.00 35.95 39.58 2wvz h PHE 302 CO 0.07 -0.37 -0.11 1.88 -2.23 0.00 0.00 178.31 177.55 2wvz h TYR 303 N -0.34 0.00 -0.40 0.41 0.05 -1.33 0.12 116.97 115.49 2wvz h TYR 303 Ca 0.11 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.79 2wvz h TYR 303 Cb 0.51 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.24 2wvz h TYR 303 CO -0.41 0.11 -0.16 0.77 -1.05 0.00 0.00 178.16 177.42 2wvz h SER 304 N 0.00 0.83 -0.23 3.88 0.02 -1.00 0.99 113.55 118.03 2wvz h SER 304 Ca -0.00 -0.39 -0.07 0.00 -0.84 0.00 0.00 61.79 60.49 2wvz h SER 304 Cb 1.08 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.37 2wvz h SER 304 CO 0.01 1.03 -0.08 0.00 -1.14 0.00 0.00 176.83 176.66 2wvz h LEU 306 N 0.56 0.72 -0.54 0.00 5.85 -0.62 -1.70 115.31 119.58 2wvz h LEU 306 Ca 0.11 -0.45 0.04 0.00 0.84 0.00 0.00 57.88 58.42 2wvz h LEU 306 Cb 0.48 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 2wvz h LEU 306 CO 0.03 1.01 0.29 0.22 -0.34 0.00 0.00 178.44 179.65 2wvz h TYR 307 N 0.42 0.53 0.00 1.25 3.20 -0.60 -0.01 116.97 121.76 2wvz h TYR 307 Ca 0.05 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 2wvz h TYR 307 Cb 0.79 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.90 2wvz h TYR 307 CO 0.07 0.26 -0.00 0.00 -1.64 0.00 0.00 178.16 176.85 2wvz h ARG 308 N 0.55 0.00 -0.23 1.82 2.47 -0.65 -0.57 114.38 117.77 2wvz h ARG 308 Ca 0.24 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.96 2wvz h ARG 308 Cb 0.13 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.45 2wvz h ARG 308 CO -0.15 0.00 0.00 0.43 0.56 0.00 0.00 179.97 180.81 2wvz n SER 309 N -3.09 1.70 -1.35 7.04 7.64 -0.02 -3.79 113.62 121.75 2wvz n SER 309 Ca -0.02 -1.80 -0.00 0.00 1.01 0.00 0.00 58.87 58.05 2wvz n SER 309 Cb 0.12 -0.15 0.11 0.00 -1.01 0.00 0.00 64.21 63.28 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 0.37 2.47 -0.01 -3.43 4.77 -0.22 -4.77 117.00 116.18 2wvz n LEU 310 Ca 0.15 -3.41 -0.02 0.00 -0.03 0.00 0.00 56.01 52.70 2wvz n LEU 310 Cb 0.31 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 2wvz n LEU 310 CO 0.11 1.23 -0.57 0.18 -1.33 0.00 0.00 177.39 177.01 2wvz n LEU 311 N -0.53 2.29 -4.36 2.23 4.77 -1.26 -1.00 117.00 119.15 2wvz n LEU 311 Ca 0.18 -0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.87 2wvz n LEU 311 Cb 0.88 -0.07 -0.14 0.00 -2.33 0.00 0.00 43.42 41.77 2wvz n LEU 311 CO 0.05 0.41 -0.56 -0.36 -1.33 0.00 0.00 177.39 175.60 2wvz s PHE 312 N -2.04 2.25 0.77 -1.77 0.40 -1.26 -3.55 117.98 112.78 2wvz s PHE 312 Ca -0.03 -0.39 -0.11 0.00 -0.60 0.00 0.00 56.93 55.80 2wvz s PHE 312 Cb 0.01 -1.28 0.06 0.00 0.51 0.00 0.00 43.02 42.32 2wvz s PHE 312 CO 0.04 0.24 1.10 -1.25 0.70 0.00 0.00 175.22 176.05 2wvz s PRO 313 N -1.70 2.21 0.29 0.24 0.04 -1.26 -4.92 135.00 129.90 2wvz s PRO 313 Ca 0.12 1.23 -0.09 0.00 0.04 0.00 0.00 61.00 62.31 2wvz s PRO 313 Cb -0.10 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.49 2wvz s PRO 313 CO 0.04 -1.68 0.60 -0.98 0.04 0.00 0.00 177.00 175.02 2wvz s ARG 314 N -4.79 3.76 0.25 4.56 1.70 0.49 -4.80 118.95 120.12 2wvz s ARG 314 Ca 0.62 0.25 -0.30 0.00 -0.47 0.00 0.00 55.73 55.83 2wvz s ARG 314 Cb -0.18 -2.58 -0.14 0.00 -0.57 0.00 0.00 34.95 31.47 2wvz s ARG 314 CO 0.55 0.21 1.17 1.63 -1.08 0.00 0.00 175.30 177.77 2wvz n LYS 315 N -0.62 1.54 -0.46 3.89 5.02 0.44 -1.76 118.16 126.21 2wvz n LYS 315 Ca 0.00 0.54 0.05 0.00 -2.02 0.00 0.00 58.31 56.89 2wvz n LYS 315 Cb 0.53 -2.04 0.09 0.00 -0.02 0.00 0.00 35.03 33.59 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 0.94 0.00 -4.44 2.13 7.35 0.26 -4.09 117.46 119.61 2wvz n PHE 316 Ca 0.11 -0.66 -0.25 0.00 -0.76 0.00 0.00 57.45 55.88 2wvz n PHE 316 Cb 0.30 -0.13 -0.11 0.00 0.35 0.00 0.00 39.48 39.90 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 -1.59 2.32 0.13 -5.13 -0.85 -1.21 -4.43 117.35 106.60 2wvz s TYR 317 Ca 0.22 -0.34 0.07 0.00 -0.52 0.00 0.00 57.07 56.50 2wvz s TYR 317 Cb 0.21 -1.08 -0.04 0.00 0.38 0.00 0.00 41.96 41.43 2wvz s TYR 317 CO -0.02 0.61 -0.15 -1.21 -1.52 0.00 0.00 175.55 173.26 2wvz s GLU 318 N -3.11 1.10 -0.19 -3.49 2.02 0.23 -4.93 118.70 110.34 2wvz s GLU 318 Ca 0.26 -1.29 -0.20 0.00 0.02 0.00 0.00 54.97 53.76 2wvz s GLU 318 Cb -0.07 -1.03 -0.03 0.00 0.10 0.00 0.00 34.13 33.10 2wvz s GLU 318 CO 0.13 0.20 0.58 -0.51 0.02 0.00 0.00 175.26 175.68 2wvz s LEU 319 N -2.51 4.16 0.00 1.80 1.02 -1.26 0.05 118.68 121.95 2wvz s LEU 319 Ca 0.11 0.79 0.00 0.00 0.02 0.00 0.00 54.13 55.05 2wvz s LEU 319 Cb -0.05 -2.81 0.00 0.00 0.02 0.00 0.00 46.19 43.34 2wvz s LEU 319 CO 0.04 -0.21 0.00 -0.90 0.02 0.00 0.00 176.35 175.30 2wvz n ASP 320 N 4.78 0.00 -0.33 2.29 5.68 -0.67 -4.80 116.55 123.51 2wvz n ASP 320 Ca -0.03 -0.89 0.23 0.00 -0.50 0.00 0.00 54.79 53.60 2wvz n ASP 320 Cb 0.50 0.00 0.51 0.00 -1.14 0.00 0.00 41.12 40.99 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 -1.67 2.24 -0.27 2.12 0.00 -1.98 -0.54 119.26 119.17 2wvz h ALA 321 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2wvz h ALA 321 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2wvz h ALA 321 CO 0.00 -0.66 0.00 0.09 0.00 0.00 0.00 179.25 178.68 2wvz n ASN 322 N -4.63 2.63 -0.25 0.00 3.02 -1.26 -4.91 115.26 109.86 2wvz n ASN 322 Ca 0.26 -1.87 -0.03 0.00 -0.03 0.00 0.00 54.58 52.90 2wvz n ASN 322 Cb 0.89 -0.17 -0.01 0.00 -0.61 0.00 0.00 39.78 39.88 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 1.33 0.64 3.76 7.41 0.00 -0.21 -5.03 105.19 113.09 2wvz n GLY 323 Ca 0.18 -0.85 -0.38 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.16 4.22 0.12 1.61 -1.52 -1.26 -4.77 119.66 115.89 2wvz s GLN 324 Ca 0.00 0.50 -0.31 0.00 -1.95 0.00 0.00 55.36 53.60 2wvz s GLN 324 Cb 0.00 -3.35 -0.11 0.00 -0.22 0.00 0.00 33.01 29.33 2wvz s GLN 324 CO 0.00 0.36 1.83 -0.35 -0.25 0.00 0.00 175.29 176.89 2wvz n PRO 325 N 2.91 2.76 -4.26 2.91 -0.04 -1.26 -1.66 135.00 136.35 2wvz n PRO 325 Ca -0.09 1.00 -0.15 0.00 -0.04 0.00 0.00 63.50 64.22 2wvz n PRO 325 Cb 0.52 -2.89 -0.10 0.00 -0.04 0.00 0.00 33.50 30.98 2wvz n PRO 325 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2wvz s ILE 326 N 2.72 1.24 -0.01 0.52 -4.36 0.11 0.11 121.20 121.54 2wvz s ILE 326 Ca 0.82 -2.02 -0.07 0.00 -0.26 0.00 0.00 60.65 59.12 2wvz s ILE 326 Cb -0.49 -1.81 0.00 0.00 1.25 0.00 0.00 42.46 41.41 2wvz s ILE 326 CO 0.38 -0.68 0.14 -1.38 0.24 0.00 0.00 174.94 173.64 2wvz s HIS 327 N -3.11 0.01 0.04 1.37 -3.43 -0.27 0.76 115.29 110.66 2wvz s HIS 327 Ca 0.16 -0.05 -0.30 0.00 -0.80 0.00 0.00 55.06 54.07 2wvz s HIS 327 Cb 0.01 -0.03 -0.05 0.00 -1.43 0.00 0.00 32.58 31.08 2wvz s HIS 327 CO 0.02 -0.26 1.19 -0.47 -2.00 0.00 0.00 174.74 173.22 2wvz s TYR 328 N -1.17 3.40 -0.36 0.38 5.04 -1.26 -1.39 117.35 121.99 2wvz s TYR 328 Ca -0.13 1.30 -0.29 0.00 -2.44 0.00 0.00 57.07 55.51 2wvz s TYR 328 Cb -0.07 -3.41 0.02 0.00 0.35 0.00 0.00 41.96 38.85 2wvz s TYR 328 CO 0.01 -1.26 1.08 0.45 -1.34 0.00 0.00 175.55 174.49 2wvz s SER 329 N 1.13 6.84 0.00 4.32 0.15 0.56 -4.86 113.70 121.84 2wvz s SER 329 Ca 0.58 0.87 0.19 0.00 0.70 0.00 0.00 55.95 58.29 2wvz s SER 329 Cb -0.29 -2.54 1.02 0.00 -1.71 0.00 0.00 66.02 62.51 2wvz s SER 329 CO 0.28 -0.96 1.54 -0.81 1.20 0.00 0.00 173.24 174.49 2wvz n PRO 330 N 7.08 0.41 -0.12 5.44 -0.04 -1.26 -1.29 135.00 145.22 2wvz n PRO 330 Ca 0.12 0.06 -0.26 0.00 -0.04 0.00 0.00 63.50 63.38 2wvz n PRO 330 Cb 0.48 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.33 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 -1.16 0.53 0.12 0.54 4.01 -1.26 -3.82 117.16 116.12 2wvz n TYR 331 Ca 0.11 0.22 0.02 0.00 -0.16 0.00 0.00 57.90 58.09 2wvz n TYR 331 Cb 0.11 -1.05 -0.02 0.00 -0.31 0.00 0.00 39.34 38.06 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 -4.28 1.15 0.00 7.72 0.23 -1.24 -4.77 115.26 114.07 2wvz n ASN 332 Ca -0.43 -0.44 0.00 0.00 -0.53 0.00 0.00 54.58 53.18 2wvz n ASN 332 Cb 0.80 1.04 0.00 0.00 -2.08 0.00 0.00 39.78 39.54 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 1.38 0.75 3.96 4.83 0.00 -0.41 -4.99 105.19 110.71 2wvz n GLY 333 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.37 1.67 -0.34 1.61 -0.21 -1.26 -4.73 119.66 116.02 2wvz s GLN 334 Ca 0.00 -0.67 -0.01 0.00 0.02 0.00 0.00 55.36 54.70 2wvz s GLN 334 Cb 0.00 -2.19 0.08 0.00 1.00 0.00 0.00 33.01 31.90 2wvz s GLN 334 CO 0.00 -1.55 0.08 0.08 -2.12 0.00 0.00 175.29 171.78 2wvz s VAL 335 N -3.31 3.00 0.17 1.09 1.01 -1.26 -0.32 120.40 120.77 2wvz s VAL 335 Ca 0.65 -1.73 0.10 0.00 0.00 0.00 0.00 61.98 61.00 2wvz s VAL 335 Cb -0.07 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 2wvz s VAL 335 CO 0.46 -0.37 -0.16 -0.76 0.00 0.00 0.00 175.10 174.27 2wvz s LEU 336 N 1.17 2.75 0.74 3.92 1.43 -0.49 -4.91 118.68 123.29 2wvz s LEU 336 Ca 0.01 -0.65 -0.12 0.00 -1.03 0.00 0.00 54.13 52.34 2wvz s LEU 336 Cb -0.21 -1.49 0.04 0.00 0.03 0.00 0.00 46.19 44.56 2wvz s LEU 336 CO -0.03 0.13 1.11 -2.16 0.23 0.00 0.00 176.35 175.63 2wvz s PRO 337 N -2.60 2.37 0.00 1.29 0.04 -1.26 -1.12 135.00 133.72 2wvz s PRO 337 Ca 0.22 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.56 2wvz s PRO 337 Cb -0.09 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.55 2wvz s PRO 337 CO 0.12 -1.57 0.00 0.41 0.04 0.00 0.00 177.00 176.00 2wvz n GLY 338 N -0.79 -3.27 3.81 0.56 0.00 0.31 -4.75 105.19 101.06 2wvz n GLY 338 Ca 0.10 -2.16 -0.33 0.00 0.00 0.00 0.00 46.02 43.62 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 -0.99 3.16 -0.22 1.61 2.02 -1.26 -3.94 117.35 117.73 2wvz s TYR 339 Ca 0.00 1.58 -0.20 0.00 -0.37 0.00 0.00 57.07 58.08 2wvz s TYR 339 Cb 0.00 -2.95 0.06 0.00 -0.40 0.00 0.00 41.96 38.67 2wvz s TYR 339 CO 0.00 -0.50 0.59 1.41 -1.57 0.00 0.00 175.55 175.48 2wvz s MET 340 N -3.30 0.68 0.13 -0.62 -2.45 -1.26 -4.09 119.30 108.39 2wvz s MET 340 Ca 0.64 0.85 -0.00 0.00 -1.25 0.00 0.00 55.69 55.93 2wvz s MET 340 Cb -0.13 0.31 -0.04 0.00 1.25 0.00 0.00 34.83 36.22 2wvz s MET 340 CO 0.18 -0.09 0.03 -0.06 1.05 0.00 0.00 175.02 176.13 2wvz s PHE 341 N 0.45 0.91 0.16 4.11 0.40 -1.26 -0.57 117.98 122.18 2wvz s PHE 341 Ca -0.01 -1.15 -0.09 0.00 -0.60 0.00 0.00 56.93 55.08 2wvz s PHE 341 Cb -0.04 -0.53 0.03 0.00 0.51 0.00 0.00 43.02 42.99 2wvz s PHE 341 CO -0.01 -0.41 0.47 -2.37 0.70 0.00 0.00 175.22 173.60 2wvz n THR 342 N -0.11 0.00 -2.38 0.64 5.66 -0.72 -4.85 114.28 112.52 2wvz n THR 342 Ca -0.07 -0.42 -0.05 0.00 -3.05 0.00 0.00 64.05 60.46 2wvz n THR 342 Cb 0.63 0.47 0.02 0.00 -1.55 0.00 0.00 70.33 69.90 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 -1.13 -4.66 -3.57 1.09 8.00 -0.64 -0.38 116.55 115.26 2wvz n ASP 343 Ca -0.03 -0.25 -0.16 0.00 0.71 0.00 0.00 54.79 55.05 2wvz n ASP 343 Cb 0.31 -3.08 -0.06 0.00 -0.02 0.00 0.00 41.12 38.26 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 -3.13 0.00 -0.31 -3.53 -1.32 -1.03 -4.30 115.64 102.03 2wvz s THR 344 Ca 0.15 -0.02 -0.07 0.00 -1.21 0.00 0.00 61.69 60.55 2wvz s THR 344 Cb -0.02 -0.98 0.01 0.00 -1.51 0.00 0.00 72.50 70.00 2wvz s THR 344 CO 0.39 -0.01 0.09 -0.83 -2.21 0.00 0.00 174.62 172.05 2wvz s GLY 345 N -0.67 1.81 0.61 6.08 0.00 -1.26 -2.53 107.32 111.36 2wvz s GLY 345 Ca -0.07 -1.50 0.36 0.00 0.00 0.00 0.00 44.72 43.50 2wvz s GLY 345 CO 0.07 0.68 2.26 0.74 0.00 0.00 0.00 173.10 176.84 2wvz h PHE 346 N 8.25 0.00 -0.20 1.90 0.04 -0.71 -0.11 116.94 126.10 2wvz h PHE 346 Ca -0.30 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.42 2wvz h PHE 346 Cb 1.12 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.26 2wvz h PHE 346 CO 0.61 0.02 -0.08 2.35 -0.60 0.00 0.00 178.31 180.61 2wvz h TRP 347 N 0.00 0.32 0.02 -0.55 7.01 -1.84 -0.95 115.95 119.95 2wvz h TRP 347 Ca -0.00 -0.03 -0.00 0.00 2.11 0.00 0.00 58.89 60.97 2wvz h TRP 347 Cb 0.10 -0.09 0.00 0.00 -2.10 0.00 0.00 29.16 27.06 2wvz h TRP 347 CO 0.00 0.39 -0.01 -0.44 -2.79 0.00 0.00 178.44 175.60 2wvz h ASP 348 N 0.30 -0.02 0.15 2.65 3.45 -1.43 -3.42 116.42 118.09 2wvz h ASP 348 Ca 0.06 -0.24 0.00 0.00 0.43 0.00 0.00 57.03 57.28 2wvz h ASP 348 Cb 0.33 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.11 2wvz h ASP 348 CO 0.02 0.60 -0.12 0.35 -1.57 0.00 0.00 179.24 178.52 2wvz n THR 349 N -4.75 0.00 0.23 0.35 -2.24 -0.80 -3.38 114.28 103.69 2wvz n THR 349 Ca -0.03 -0.15 0.11 0.00 -2.27 0.00 0.00 64.05 61.71 2wvz n THR 349 Cb 0.13 0.29 0.49 0.00 -2.10 0.00 0.00 70.33 69.14 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 1.46 0.00 0.22 4.78 -0.00 -1.43 -1.76 116.94 120.21 2wvz h PHE 350 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 57.96 2wvz h PHE 350 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.40 2wvz h PHE 350 CO 0.00 0.17 -0.11 0.00 -0.00 0.00 0.00 178.31 178.37 2wvz h ARG 351 N 0.00 -0.29 0.00 6.09 3.08 -1.80 -3.42 114.38 118.03 2wvz h ARG 351 Ca -0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2wvz h ARG 351 Cb 0.72 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.83 2wvz h ARG 351 CO 0.02 0.08 0.00 0.00 -1.07 0.00 0.00 179.97 179.00 2wvz h LEU 353 N 0.00 -0.19 -1.00 0.00 7.12 -1.77 -2.16 115.31 117.31 2wvz h LEU 353 Ca 0.00 -0.26 -0.04 0.00 0.13 0.00 0.00 57.88 57.71 2wvz h LEU 353 Cb 0.30 0.05 -0.03 0.00 -0.53 0.00 0.00 40.66 40.45 2wvz h LEU 353 CO 0.00 0.37 0.28 -0.26 -0.13 0.00 0.00 178.44 178.70 2wvz h PHE 354 N -0.97 1.01 -0.67 1.25 0.04 -1.60 -1.17 116.94 114.84 2wvz h PHE 354 Ca -0.02 -0.06 0.11 0.00 2.80 0.00 0.00 57.97 60.79 2wvz h PHE 354 Cb 0.44 -0.31 -0.04 0.00 2.20 0.00 0.00 35.95 38.24 2wvz h PHE 354 CO 0.07 0.77 0.45 -1.35 -0.60 0.00 0.00 178.31 177.64 2wvz h PRO 355 N 0.99 0.46 -0.51 1.51 0.11 -1.81 -0.79 132.00 131.95 2wvz h PRO 355 Ca 0.23 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.25 2wvz h PRO 355 Cb 0.17 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 2wvz h PRO 355 CO -0.02 0.31 0.04 1.25 -0.21 0.00 0.00 178.00 179.37 2wvz h LEU 356 N 0.48 0.78 -0.51 2.35 5.85 -0.52 -1.96 115.31 121.78 2wvz h LEU 356 Ca 0.31 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 2wvz h LEU 356 Cb 0.58 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 2wvz h LEU 356 CO -0.10 0.82 0.08 -0.07 -0.34 0.00 0.00 178.44 178.83 2wvz h LEU 357 N 0.78 0.81 -1.96 2.25 3.38 -1.04 0.13 115.31 119.65 2wvz h LEU 357 Ca 0.16 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2wvz h LEU 357 Cb 0.40 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2wvz h LEU 357 CO 0.01 0.87 -0.11 0.78 0.09 0.00 0.00 178.44 180.08 2wvz h ASN 358 N 0.72 0.00 0.00 -0.43 -0.26 -0.48 0.30 115.58 115.44 2wvz h ASN 358 Ca 0.15 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 55.76 2wvz h ASN 358 Cb 0.41 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.65 2wvz h ASN 358 CO 0.01 0.11 -0.77 0.25 -1.06 0.00 0.00 177.43 175.97 2wvz h LEU 359 N 0.00 0.00 0.00 1.61 5.85 -0.99 -3.39 115.31 118.39 2wvz h LEU 359 Ca -0.00 -0.59 -0.02 0.00 0.84 0.00 0.00 57.88 58.11 2wvz h LEU 359 Cb 0.28 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 2wvz h LEU 359 CO 0.01 1.24 -1.69 0.23 -0.34 0.00 0.00 178.44 177.90 2wvz n MET 360 N -4.52 0.55 -3.08 1.25 2.81 0.41 -4.68 117.12 109.86 2wvz n MET 360 Ca -0.22 -0.12 -0.17 0.00 -1.81 0.00 0.00 57.70 55.38 2wvz n MET 360 Cb 0.56 -1.35 -0.02 0.00 -0.71 0.00 0.00 33.22 31.70 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 -2.05 0.45 -0.03 2.03 4.01 0.97 -4.57 117.16 117.98 2wvz n TYR 361 Ca -0.04 -3.63 -0.02 0.00 -0.16 0.00 0.00 57.90 54.05 2wvz n TYR 361 Cb 0.42 -0.41 0.24 0.00 -0.31 0.00 0.00 39.34 39.28 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 3.00 0.59 0.00 -0.72 0.11 -1.47 -2.05 132.00 131.45 2wvz h PRO 362 Ca 0.06 -0.15 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 2wvz h PRO 362 Cb 1.00 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 2wvz h PRO 362 CO 0.51 0.65 -0.03 0.66 -0.21 0.00 0.00 178.00 179.58 2wvz h SER 363 N 0.55 0.00 0.09 -2.05 4.64 -1.93 0.15 113.55 115.00 2wvz h SER 363 Ca 0.11 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.19 2wvz h SER 363 Cb 0.44 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 2wvz h SER 363 CO 0.02 0.03 -1.20 0.58 -0.87 0.00 0.00 176.83 175.39 2wvz h VAL 364 N 0.00 1.13 -0.04 0.95 2.07 -1.75 -3.26 116.25 115.35 2wvz h VAL 364 Ca -0.00 -2.38 0.01 0.00 0.82 0.00 0.00 66.70 65.15 2wvz h VAL 364 Cb 0.11 2.75 -0.00 0.00 -1.52 0.00 0.00 31.29 32.63 2wvz h VAL 364 CO 0.00 0.64 0.03 -1.13 0.02 0.00 0.00 177.57 177.13 2wvz h ASN 365 N -0.48 0.00 -0.04 0.57 -1.24 -0.86 -1.44 115.58 112.09 2wvz h ASN 365 Ca -0.27 0.00 0.04 0.00 0.71 0.00 0.00 56.30 56.78 2wvz h ASN 365 Cb 1.61 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 40.60 2wvz h ASN 365 CO 0.02 0.00 -0.37 0.50 -1.29 0.00 0.00 177.43 176.29 2wvz h LYS 366 N 0.00 -0.48 -0.51 6.67 1.63 -0.81 0.55 116.57 123.63 2wvz h LYS 366 Ca 0.02 0.03 0.08 0.00 -0.85 0.00 0.00 60.65 59.93 2wvz h LYS 366 Cb 0.07 0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 31.75 2wvz h LYS 366 CO -0.00 -0.32 0.16 0.93 -3.45 0.00 0.00 179.45 176.77 2wvz h GLU 367 N -0.50 0.31 -0.15 1.90 5.08 -1.33 0.18 114.58 120.07 2wvz h GLU 367 Ca 0.06 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2wvz h GLU 367 Cb 0.60 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2wvz h GLU 367 CO -0.32 0.20 0.09 0.52 -1.00 0.00 0.00 179.01 178.51 2wvz h MET 368 N 0.32 0.20 -0.52 2.33 2.86 -0.65 0.45 114.93 119.92 2wvz h MET 368 Ca 0.25 -0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.96 2wvz h MET 368 Cb 0.30 -0.04 -0.07 0.00 0.06 0.00 0.00 31.60 31.84 2wvz h MET 368 CO -0.28 0.18 0.10 1.96 1.06 0.00 0.00 176.91 179.92 2wvz h GLN 369 N 0.17 0.22 -0.56 1.72 1.08 0.66 0.30 115.11 118.70 2wvz h GLN 369 Ca 0.05 -0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.27 2wvz h GLN 369 Cb 0.03 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.37 2wvz h GLN 369 CO -0.01 0.15 0.33 0.93 -0.95 0.00 0.00 178.83 179.28 2wvz h GLU 370 N 0.23 0.64 -1.00 1.46 4.39 -0.26 -0.69 114.58 119.34 2wvz h GLU 370 Ca 0.26 -0.04 0.22 0.00 0.34 0.00 0.00 59.36 60.14 2wvz h GLU 370 Cb 0.36 -0.14 -0.11 0.00 -0.10 0.00 0.00 28.75 28.76 2wvz h GLU 370 CO -0.35 0.42 0.61 0.78 -1.16 0.00 0.00 179.01 179.32 2wvz h GLY 371 N 0.66 1.75 1.79 -3.84 0.00 0.24 -1.61 103.07 102.06 2wvz h GLY 371 Ca 0.23 -0.32 -0.15 0.00 0.00 0.00 0.00 47.33 47.08 2wvz h GLY 371 CO -0.11 -0.14 -0.64 1.41 0.00 0.00 0.00 176.54 177.07 2wvz h LEU 372 N 0.65 0.24 -0.25 3.11 3.38 0.98 -2.62 115.31 120.81 2wvz h LEU 372 Ca 0.60 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.42 2wvz h LEU 372 Cb 1.09 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 2wvz h LEU 372 CO -0.40 0.81 0.14 0.40 0.09 0.00 0.00 178.44 179.48 2wvz h ILE 373 N 0.15 1.10 -0.61 1.22 1.08 -0.72 -2.56 117.51 117.18 2wvz h ILE 373 Ca -0.01 -0.26 0.05 0.00 -0.39 0.00 0.00 64.86 64.25 2wvz h ILE 373 Cb 1.15 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 35.70 2wvz h ILE 373 CO 0.10 0.10 0.40 0.78 -0.69 0.00 0.00 178.15 178.84 2wvz h ASN 374 N 0.30 0.54 -0.17 1.72 -0.26 -1.27 0.13 115.58 116.58 2wvz h ASN 374 Ca 0.09 -0.00 0.01 0.00 -0.56 0.00 0.00 56.30 55.83 2wvz h ASN 374 Cb 0.04 -0.12 -0.01 0.00 -1.06 0.00 0.00 38.32 37.17 2wvz h ASN 374 CO -0.02 0.36 0.09 0.74 -1.06 0.00 0.00 177.43 177.55 2wvz h THR 375 N 0.62 1.02 -0.36 2.81 2.02 -1.16 0.63 112.91 118.49 2wvz h THR 375 Ca 0.26 -0.07 -0.16 0.00 0.77 0.00 0.00 66.41 67.22 2wvz h THR 375 Cb 0.23 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 2wvz h THR 375 CO -0.08 0.04 -0.39 0.22 0.37 0.00 0.00 175.52 175.68 2wvz h TYR 376 N 0.20 1.04 -0.55 3.16 3.20 -0.96 -0.18 116.97 122.88 2wvz h TYR 376 Ca 0.06 -0.31 0.05 0.00 3.14 0.00 0.00 58.73 61.68 2wvz h TYR 376 Cb -0.00 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.00 2wvz h TYR 376 CO -0.08 1.12 0.27 -0.07 -1.64 0.00 0.00 178.16 177.76 2wvz h LEU 377 N 0.71 0.38 0.00 2.82 3.38 -0.46 0.37 115.31 122.51 2wvz h LEU 377 Ca 0.06 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2wvz h LEU 377 Cb 0.97 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2wvz h LEU 377 CO 0.09 0.25 -0.44 -0.33 0.09 0.00 0.00 178.44 178.10 2wvz h GLU 378 N 0.52 0.00 0.00 1.13 5.08 0.70 -3.36 114.58 118.64 2wvz h GLU 378 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2wvz h GLU 378 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2wvz h GLU 378 CO -0.18 0.05 -0.97 -1.13 -1.00 0.00 0.00 179.01 175.78 2wvz n SER 379 N -2.96 4.86 0.00 1.42 3.41 -0.12 -4.31 113.62 115.93 2wvz n SER 379 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2wvz n SER 379 Cb 0.57 0.75 0.00 0.00 -0.26 0.00 0.00 64.21 65.26 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 2.66 1.23 3.20 5.00 0.00 0.13 -5.04 105.19 112.37 2wvz n GLY 380 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.50 1.28 0.44 1.61 0.40 -1.25 -4.95 117.98 113.01 2wvz s PHE 381 Ca 0.00 -0.50 -0.23 0.00 -0.60 0.00 0.00 56.93 55.60 2wvz s PHE 381 Cb 0.00 -0.70 -0.08 0.00 0.51 0.00 0.00 43.02 42.75 2wvz s PHE 381 CO 0.00 0.08 1.11 -0.06 0.70 0.00 0.00 175.22 177.05 2wvz s PHE 382 N -1.60 3.05 0.62 0.36 0.08 -1.26 -3.32 117.98 115.91 2wvz s PHE 382 Ca 0.02 1.58 -0.10 0.00 0.12 0.00 0.00 56.93 58.55 2wvz s PHE 382 Cb -0.08 -3.25 -0.03 0.00 -0.57 0.00 0.00 43.02 39.08 2wvz s PHE 382 CO 0.02 -1.09 1.01 -1.25 -0.10 0.00 0.00 175.22 173.81 2wvz s PRO 383 N -2.65 3.49 0.11 0.24 0.04 -1.26 -4.45 135.00 130.51 2wvz s PRO 383 Ca 0.61 0.64 0.00 0.00 0.04 0.00 0.00 61.00 62.30 2wvz s PRO 383 Cb -0.25 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.18 2wvz s PRO 383 CO 0.31 -0.59 0.00 0.39 0.04 0.00 0.00 177.00 177.14 2wvz n GLU 384 N -2.73 0.00 -3.87 4.56 -0.58 -1.26 -4.52 120.64 112.24 2wvz n GLU 384 Ca 0.06 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.44 2wvz n GLU 384 Cb 0.55 -0.42 -0.14 0.00 -0.57 0.00 0.00 31.44 30.86 2wvz n GLU 384 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2wvz s TRP 385 N -2.00 3.04 -0.09 -0.32 0.52 -1.26 0.08 118.94 118.90 2wvz s TRP 385 Ca 0.00 -1.02 0.03 0.00 0.02 0.00 0.00 56.10 55.13 2wvz s TRP 385 Cb 0.00 -2.15 0.01 0.00 -1.15 0.00 0.00 33.47 30.18 2wvz s TRP 385 CO 0.00 -0.57 -0.18 0.00 0.02 0.00 0.00 176.95 176.22 2wvz s ALA 386 N 1.47 1.76 -0.40 0.98 0.00 -1.05 -0.70 121.76 123.82 2wvz s ALA 386 Ca 0.04 -0.74 -0.02 0.00 0.00 0.00 0.00 51.96 51.25 2wvz s ALA 386 Cb -0.16 -0.74 0.21 0.00 0.00 0.00 0.00 23.12 22.44 2wvz s ALA 386 CO -0.01 0.14 0.99 0.45 0.00 0.00 0.00 175.76 177.33 2wvz n SER 387 N 3.78 -2.13 -0.01 0.00 2.88 -1.26 -1.62 113.62 115.25 2wvz n SER 387 Ca -0.20 -1.73 -0.15 0.00 -1.33 0.00 0.00 58.87 55.46 2wvz n SER 387 Cb 0.52 1.10 -0.14 0.00 -0.75 0.00 0.00 64.21 64.94 2wvz n SER 387 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2wvz n PRO 388 N 2.56 0.69 -0.12 -1.46 -0.05 -1.25 -4.75 135.00 130.62 2wvz n PRO 388 Ca 0.13 0.28 0.00 0.00 -0.05 0.00 0.00 63.50 63.85 2wvz n PRO 388 Cb 0.63 -1.75 0.00 0.00 -0.05 0.00 0.00 33.50 32.33 2wvz n PRO 388 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 2wvz n GLY 389 N 1.77 -0.01 3.70 0.55 0.00 0.40 -4.69 105.19 106.91 2wvz n GLY 389 Ca -0.24 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 2wvz n GLY 389 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wvz s HIS 390 N 0.24 2.63 0.01 1.61 3.76 -1.26 -4.25 115.29 118.02 2wvz s HIS 390 Ca 0.00 0.42 0.06 0.00 -0.15 0.00 0.00 55.06 55.39 2wvz s HIS 390 Cb 0.00 -3.95 -0.02 0.00 1.11 0.00 0.00 32.58 29.72 2wvz s HIS 390 CO 0.00 -3.72 -0.18 1.03 -0.85 0.00 0.00 174.74 171.02 2wvz s ARG 391 N 2.17 1.35 -0.56 1.40 1.81 0.12 -4.34 118.95 120.90 2wvz s ARG 391 Ca 0.73 -0.73 -0.22 0.00 -1.72 0.00 0.00 55.73 53.79 2wvz s ARG 391 Cb -0.41 -1.35 0.06 0.00 -0.45 0.00 0.00 34.95 32.80 2wvz s ARG 391 CO 0.32 0.36 0.82 0.20 -0.68 0.00 0.00 175.30 176.32 2wvz s GLY 392 N -0.71 1.55 -0.29 -3.53 0.00 -1.26 -4.39 107.32 98.68 2wvz s GLY 392 Ca 0.06 -1.57 -0.16 0.00 0.00 0.00 0.00 44.72 43.05 2wvz s GLY 392 CO 0.00 1.83 1.01 0.00 0.00 0.00 0.00 173.10 175.94 2wvz n MET 394 N 3.71 0.00 -4.25 0.00 2.81 -1.26 -4.62 117.12 113.51 2wvz n MET 394 Ca -0.18 0.00 -0.17 0.00 -1.81 0.00 0.00 57.70 55.54 2wvz n MET 394 Cb 0.57 0.00 -0.09 0.00 -0.71 0.00 0.00 33.22 32.99 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 -4.68 120.40 109.26 2wvz s VAL 395 Ca 0.00 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 2wvz s VAL 395 Cb 0.00 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.44 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 -0.51 0.24 2.42 2.32 0.00 -1.26 -4.71 105.19 103.69 2wvz n GLY 396 Ca 0.06 -1.90 -0.22 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.52 4.05 -0.03 1.61 4.05 -1.26 -4.86 115.26 118.30 2wvz n ASN 397 Ca 0.00 -3.46 0.15 0.00 0.45 0.00 0.00 54.58 51.72 2wvz n ASN 397 Cb 0.00 -0.44 0.75 0.00 1.23 0.00 0.00 39.78 41.32 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 -0.48 0.13 -0.32 1.20 4.13 -1.26 -2.19 115.26 116.47 2wvz n ASN 398 Ca 0.33 -0.38 0.14 0.00 1.68 0.00 0.00 54.58 56.36 2wvz n ASN 398 Cb 0.77 -0.19 0.33 0.00 -1.54 0.00 0.00 39.78 39.15 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 0.15 0.47 -0.89 6.41 4.64 -1.89 0.59 113.55 123.02 2wvz h SER 399 Ca 0.00 0.14 0.13 0.00 -0.47 0.00 0.00 61.79 61.60 2wvz h SER 399 Cb 0.26 0.09 -0.07 0.00 -0.31 0.00 0.00 62.40 62.37 2wvz h SER 399 CO 0.00 0.05 0.57 0.00 -0.87 0.00 0.00 176.83 176.58 2wvz h ALA 400 N 1.71 1.78 -0.26 5.18 0.00 -1.81 -0.14 119.26 125.73 2wvz h ALA 400 Ca 0.59 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.37 2wvz h ALA 400 Cb 1.10 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2wvz h ALA 400 CO -0.50 -0.02 -0.36 1.03 0.00 0.00 0.00 179.25 179.40 2wvz h SER 401 N 0.74 0.77 0.32 0.00 0.87 -1.12 -1.82 113.55 113.31 2wvz h SER 401 Ca 0.44 -0.51 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 2wvz h SER 401 Cb 0.65 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.37 2wvz h SER 401 CO -0.20 1.13 -0.36 0.40 -0.53 0.00 0.00 176.83 177.26 2wvz h ILE 402 N 0.44 0.00 -0.30 2.23 1.08 -0.35 -0.65 117.51 119.95 2wvz h ILE 402 Ca 0.03 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.57 2wvz h ILE 402 Cb 0.95 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.62 2wvz h ILE 402 CO 0.08 0.00 -0.23 -0.07 -0.69 0.00 0.00 178.15 177.25 2wvz h LEU 403 N -0.69 -0.75 -0.51 1.44 3.38 -1.15 -2.15 115.31 114.89 2wvz h LEU 403 Ca -0.04 0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 2wvz h LEU 403 Cb 0.61 0.37 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 2wvz h LEU 403 CO -0.06 -0.26 0.17 0.58 0.09 0.00 0.00 178.44 178.95 2wvz h VAL 404 N -0.21 1.23 -0.53 1.22 2.07 -1.29 -1.88 116.25 116.86 2wvz h VAL 404 Ca 0.16 -0.75 -0.10 0.00 0.82 0.00 0.00 66.70 66.82 2wvz h VAL 404 Cb 0.45 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2wvz h VAL 404 CO -0.42 0.28 -0.07 -0.78 0.02 0.00 0.00 177.57 176.60 2wvz h ASP 405 N 0.68 0.95 0.25 0.57 3.58 -0.95 -1.03 116.42 120.48 2wvz h ASP 405 Ca 0.16 -0.29 -0.00 0.00 0.42 0.00 0.00 57.03 57.32 2wvz h ASP 405 Cb 0.26 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.03 2wvz h ASP 405 CO -0.01 1.04 -0.36 0.00 -2.88 0.00 0.00 179.24 177.04 2wvz h ALA 406 N 1.05 -0.97 -0.70 -0.78 0.00 -1.21 -2.16 119.26 114.47 2wvz h ALA 406 Ca 0.15 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.07 2wvz h ALA 406 Cb 0.60 0.66 -0.09 0.00 0.00 0.00 0.00 17.79 18.96 2wvz h ALA 406 CO 0.04 -1.02 0.27 -0.92 0.00 0.00 0.00 179.25 177.62 2wvz h TYR 407 N -0.64 0.46 0.00 0.00 5.03 -1.09 0.49 116.97 121.22 2wvz h TYR 407 Ca -0.03 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.31 2wvz h TYR 407 Cb 0.58 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 38.76 2wvz h TYR 407 CO -0.28 0.08 0.00 0.52 -1.32 0.00 0.00 178.16 177.16 2wvz h MET 408 N 0.43 0.00 -0.64 1.82 2.86 -1.19 -2.43 114.93 115.78 2wvz h MET 408 Ca 0.38 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.02 2wvz h MET 408 Cb 0.53 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.19 2wvz h MET 408 CO -0.37 0.00 0.00 1.63 1.06 0.00 0.00 176.91 179.23 2wvz n LYS 409 N -2.96 2.92 -0.15 1.72 5.02 0.06 -4.94 118.16 119.83 2wvz n LYS 409 Ca 0.01 -2.59 0.00 0.00 -2.02 0.00 0.00 58.31 53.71 2wvz n LYS 409 Cb 0.33 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 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 1.32 0.91 3.16 0.72 0.00 -0.76 -5.03 105.19 105.51 2wvz n GLY 410 Ca 0.22 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 3.78 -0.17 1.61 1.01 -0.58 -5.00 120.40 119.06 2wvz s VAL 411 Ca 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 61.98 59.85 2wvz s VAL 411 Cb 0.00 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.87 2wvz s VAL 411 CO 0.00 -0.77 -0.16 -0.54 0.00 0.00 0.00 175.10 173.63 2wvz s LYS 412 N 0.97 3.14 0.67 2.72 1.02 -1.26 -2.62 119.74 124.38 2wvz s LYS 412 Ca 0.09 -0.78 -0.15 0.00 0.02 0.00 0.00 55.97 55.15 2wvz s LYS 412 Cb -0.23 -2.62 0.01 0.00 -0.52 0.00 0.00 37.83 34.46 2wvz s LYS 412 CO -0.03 -0.08 1.13 0.14 -0.92 0.00 0.00 175.35 175.60 2wvz s VAL 413 N 1.02 3.04 0.14 3.17 -7.23 -1.26 -4.95 120.40 114.32 2wvz s VAL 413 Ca -0.02 0.50 -0.14 0.00 -1.81 0.00 0.00 61.98 60.51 2wvz s VAL 413 Cb -0.15 -3.03 0.01 0.00 0.56 0.00 0.00 36.38 33.77 2wvz s VAL 413 CO -0.04 -0.29 1.61 0.44 -0.31 0.00 0.00 175.10 176.51 2wvz h ASP 414 N 0.02 0.74 -3.50 4.85 3.32 -1.98 -3.36 116.42 116.51 2wvz h ASP 414 Ca -0.47 -0.27 -0.79 0.00 0.02 0.00 0.00 57.03 55.52 2wvz h ASP 414 Cb 1.26 -0.20 -0.27 0.00 0.22 0.00 0.00 39.33 40.34 2wvz h ASP 414 CO 0.53 0.82 0.46 -0.62 -1.72 0.00 0.00 179.24 178.71 2wvz s ASP 415 N -6.19 7.19 0.31 6.45 2.15 -1.26 -4.83 116.67 120.49 2wvz s ASP 415 Ca -0.13 -3.35 0.10 0.00 0.43 0.00 0.00 52.55 49.60 2wvz s ASP 415 Cb 0.11 -2.23 0.51 0.00 -0.30 0.00 0.00 42.92 41.01 2wvz s ASP 415 CO 0.80 -0.39 1.71 0.40 -0.17 0.00 0.00 175.17 177.51 2wvz h ILE 416 N 3.99 1.35 -0.88 4.11 2.04 -1.99 -2.81 117.51 123.32 2wvz h ILE 416 Ca 0.17 -1.70 0.02 0.00 1.00 0.00 0.00 64.86 64.35 2wvz h ILE 416 Cb 0.91 1.90 -0.05 0.00 -0.74 0.00 0.00 36.82 38.84 2wvz h ILE 416 CO 0.98 0.49 0.58 0.50 0.00 0.00 0.00 178.15 180.70 2wvz h LYS 417 N 0.04 1.14 -0.18 2.37 3.64 -1.96 -2.19 116.57 119.43 2wvz h LYS 417 Ca -0.00 -0.07 -0.19 0.00 -1.27 0.00 0.00 60.65 59.12 2wvz h LYS 417 Cb 0.89 -0.26 0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2wvz h LYS 417 CO 0.07 0.75 -0.64 1.15 -2.27 0.00 0.00 179.45 178.51 2wvz h THR 418 N 1.17 1.30 -0.19 1.00 2.02 -1.93 -2.43 112.91 113.85 2wvz h THR 418 Ca 0.33 -1.86 0.04 0.00 0.77 0.00 0.00 66.41 65.70 2wvz h THR 418 Cb -0.10 1.93 -0.07 0.00 -1.74 0.00 0.00 68.15 68.17 2wvz h THR 418 CO -0.08 0.59 -0.46 0.25 0.37 0.00 0.00 175.52 176.19 2wvz h LEU 419 N 0.47 -1.45 -0.76 2.58 5.85 -1.24 0.11 115.31 120.86 2wvz h LEU 419 Ca -0.03 0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.84 2wvz h LEU 419 Cb 1.27 0.59 -0.03 0.00 0.37 0.00 0.00 40.66 42.86 2wvz h LEU 419 CO 0.14 -0.43 0.30 0.22 -0.34 0.00 0.00 178.44 178.32 2wvz h TYR 420 N -0.49 1.16 -0.70 1.25 3.20 -1.38 -0.94 116.97 119.08 2wvz h TYR 420 Ca 0.08 -0.09 -0.03 0.00 3.14 0.00 0.00 58.73 61.83 2wvz h TYR 420 Cb 0.63 -0.35 -0.03 0.00 1.54 0.00 0.00 36.73 38.53 2wvz h TYR 420 CO -0.54 0.89 0.34 0.93 -1.64 0.00 0.00 178.16 178.13 2wvz h GLU 421 N 1.10 1.00 -0.64 1.82 5.08 -1.01 -1.51 114.58 120.43 2wvz h GLU 421 Ca 0.25 -0.15 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 2wvz h GLU 421 Cb 0.22 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 2wvz h GLU 421 CO -0.02 0.79 0.25 0.78 -1.00 0.00 0.00 179.01 179.81 2wvz h GLY 422 N 0.97 1.04 1.00 -3.84 0.00 -0.34 -0.43 103.07 101.48 2wvz h GLY 422 Ca 0.24 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 2wvz h GLY 422 CO -0.03 0.54 0.44 1.41 0.00 0.00 0.00 176.54 178.90 2wvz h LEU 423 N 0.90 0.85 -0.47 3.11 3.38 -0.68 -2.49 115.31 119.90 2wvz h LEU 423 Ca 0.21 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 58.00 2wvz h LEU 423 Cb 0.22 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2wvz h LEU 423 CO -0.02 0.64 -0.22 0.40 0.09 0.00 0.00 178.44 179.34 2wvz h ILE 424 N 0.97 1.27 -0.43 1.22 1.08 -0.87 -3.07 117.51 117.68 2wvz h ILE 424 Ca 0.26 -1.39 0.08 0.00 -0.39 0.00 0.00 64.86 63.43 2wvz h ILE 424 Cb -0.06 1.15 -0.08 0.00 -3.07 0.00 0.00 36.82 34.76 2wvz h ILE 424 CO -0.05 0.48 -0.08 -0.74 -0.69 0.00 0.00 178.15 177.06 2wvz h HIS 425 N 0.84 -0.18 0.00 1.37 2.76 -0.66 -1.32 115.15 117.96 2wvz h HIS 425 Ca 0.11 0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.31 2wvz h HIS 425 Cb 0.80 0.15 -0.00 0.00 1.55 0.00 0.00 27.41 29.91 2wvz h HIS 425 CO 0.05 -0.16 -0.04 0.78 -1.30 0.00 0.00 177.93 177.26 2wvz h GLY 426 N 0.02 0.00 2.00 5.26 0.00 -1.38 -1.77 103.07 107.21 2wvz h GLY 426 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 2wvz h GLY 426 CO -0.42 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 174.82 2wvz n THR 427 N -3.99 0.81 -2.24 4.70 -2.24 -0.50 -3.24 114.28 107.57 2wvz n THR 427 Ca -0.03 0.19 0.01 0.00 -2.27 0.00 0.00 64.05 61.95 2wvz n THR 427 Cb 0.13 -0.94 -0.00 0.00 -2.10 0.00 0.00 70.33 67.42 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 -1.64 0.00 -3.79 -0.78 0.28 -0.72 -4.93 120.64 109.07 2wvz n GLU 428 Ca 0.04 -1.40 -0.11 0.00 -0.16 0.00 0.00 57.16 55.53 2wvz n GLU 428 Cb 0.21 -0.04 -0.08 0.00 1.43 0.00 0.00 31.44 32.96 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 -1.40 -0.08 0.03 -1.84 0.01 -0.89 -5.04 114.94 105.72 2wvz s ASN 429 Ca 0.17 -0.21 0.06 0.00 -0.71 0.00 0.00 52.86 52.17 2wvz s ASN 429 Cb 0.19 0.33 -0.02 0.00 0.41 0.00 0.00 41.25 42.15 2wvz s ASN 429 CO -0.08 -0.57 -0.18 0.54 -1.51 0.00 0.00 177.10 175.30 2wvz s VAL 430 N -2.35 1.47 0.29 1.60 0.11 -1.26 -1.94 120.40 118.31 2wvz s VAL 430 Ca -0.06 -1.04 -0.30 0.00 -2.93 0.00 0.00 61.98 57.65 2wvz s VAL 430 Cb -0.02 -1.27 -0.11 0.00 -1.53 0.00 0.00 36.38 33.45 2wvz s VAL 430 CO -0.02 0.21 1.51 -2.28 -3.33 0.00 0.00 175.10 171.19 2wvz s HIS 431 N -0.71 2.84 -0.59 1.54 2.46 -0.30 -4.89 115.29 115.64 2wvz s HIS 431 Ca 0.06 0.94 0.24 0.00 0.47 0.00 0.00 55.06 56.77 2wvz s HIS 431 Cb -0.08 -3.96 0.92 0.00 -0.13 0.00 0.00 32.58 29.33 2wvz s HIS 431 CO 0.01 -3.12 1.73 -0.35 -2.47 0.00 0.00 174.74 170.53 2wvz n PRO 432 N 2.00 0.20 -0.00 2.88 -0.04 -1.26 -3.47 135.00 135.30 2wvz n PRO 432 Ca 0.07 0.34 0.02 0.00 -0.04 0.00 0.00 63.50 63.88 2wvz n PRO 432 Cb 0.39 -1.82 -0.03 0.00 -0.04 0.00 0.00 33.50 32.00 2wvz n PRO 432 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2wvz n GLU 433 N -2.19 1.33 -3.73 0.54 0.00 -1.26 -4.95 120.64 110.38 2wvz n GLU 433 Ca 0.03 -0.03 -0.37 0.00 0.00 0.00 0.00 57.16 56.80 2wvz n GLU 433 Cb 0.29 -0.99 -0.11 0.00 0.00 0.00 0.00 31.44 30.62 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 -2.05 3.52 -0.53 3.84 1.01 -1.23 -4.96 120.40 120.00 2wvz s VAL 434 Ca -0.01 -1.88 0.22 0.00 0.00 0.00 0.00 61.98 60.31 2wvz s VAL 434 Cb 0.02 -3.33 0.23 0.00 0.00 0.00 0.00 36.38 33.30 2wvz s VAL 434 CO 0.15 -0.64 1.68 -1.54 0.00 0.00 0.00 175.10 174.75 2wvz n SER 435 N 4.68 0.59 -0.61 3.32 3.41 -1.26 -1.51 113.62 122.25 2wvz n SER 435 Ca -0.05 0.65 0.13 0.00 -0.26 0.00 0.00 58.87 59.34 2wvz n SER 435 Cb 0.42 -0.77 0.41 0.00 -0.26 0.00 0.00 64.21 64.00 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 -2.16 1.89 -4.60 4.04 3.41 -1.26 -3.93 113.62 111.02 2wvz n SER 436 Ca 0.02 -1.64 -0.34 0.00 -0.26 0.00 0.00 58.87 56.65 2wvz n SER 436 Cb 0.22 -0.02 -0.10 0.00 -0.26 0.00 0.00 64.21 64.05 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 -1.96 4.48 0.00 6.66 2.01 -0.57 -4.60 115.64 121.67 2wvz s THR 437 Ca 0.35 -0.15 0.00 0.00 0.31 0.00 0.00 61.69 62.21 2wvz s THR 437 Cb 0.20 -2.99 0.00 0.00 0.01 0.00 0.00 72.50 69.72 2wvz s THR 437 CO 0.32 0.48 0.00 0.61 -0.69 0.00 0.00 174.62 175.34 2wvz n GLY 438 N 3.41 -0.70 3.07 4.40 0.00 -1.26 -1.15 105.19 112.96 2wvz n GLY 438 Ca -0.17 -1.12 -0.35 0.00 0.00 0.00 0.00 46.02 44.38 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 0.09 1.61 0.52 -0.82 -4.79 118.95 118.24 2wvz s ARG 439 Ca 0.00 -2.79 -0.36 0.00 -0.52 0.00 0.00 55.73 52.05 2wvz s ARG 439 Cb 0.00 -3.72 -0.17 0.00 0.52 0.00 0.00 34.95 31.58 2wvz s ARG 439 CO 0.00 -1.20 1.25 -0.11 0.02 0.00 0.00 175.30 175.26 2wvz n LEU 440 N 3.04 1.34 0.00 2.53 7.94 -1.25 -1.88 117.00 128.71 2wvz n LEU 440 Ca 0.12 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 56.15 2wvz n LEU 440 Cb 0.37 -1.15 0.00 0.00 0.53 0.00 0.00 43.42 43.16 2wvz n LEU 440 CO 0.34 -1.25 0.00 0.61 -1.11 0.00 0.00 177.39 175.98 2wvz n GLY 441 N 2.27 0.62 0.36 -3.96 0.00 -1.26 -4.97 105.19 98.25 2wvz n GLY 441 Ca 0.18 -0.32 -0.03 0.00 0.00 0.00 0.00 46.02 45.84 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 1.22 -0.17 1.61 -0.00 -1.74 -1.50 116.97 116.39 2wvz h TYR 442 Ca 0.00 -0.02 0.05 0.00 -0.00 0.00 0.00 58.73 58.76 2wvz h TYR 442 Cb 0.00 -0.40 -0.05 0.00 -0.00 0.00 0.00 36.73 36.28 2wvz h TYR 442 CO 0.00 0.83 -0.15 0.93 -0.00 0.00 0.00 178.16 179.77 2wvz h GLU 443 N 1.26 -0.16 -0.05 0.10 3.07 -1.93 0.27 114.58 117.14 2wvz h GLU 443 Ca 0.32 0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 59.19 2wvz h GLU 443 Cb -0.01 0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 27.94 2wvz h GLU 443 CO -0.06 -0.10 0.03 1.88 -1.40 0.00 0.00 179.01 179.36 2wvz h TYR 444 N -0.16 0.07 -0.57 4.33 0.05 -1.83 -2.06 116.97 116.79 2wvz h TYR 444 Ca 0.11 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.85 2wvz h TYR 444 Cb 0.32 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.01 2wvz h TYR 444 CO -0.28 0.08 0.19 -0.92 -1.05 0.00 0.00 178.16 176.18 2wvz h TYR 445 N 0.04 0.91 0.00 4.88 3.20 -0.52 1.26 116.97 126.74 2wvz h TYR 445 Ca 0.02 -0.09 -0.07 0.00 3.14 0.00 0.00 58.73 61.73 2wvz h TYR 445 Cb 0.03 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.02 2wvz h TYR 445 CO -0.06 0.75 -0.34 -0.91 -1.64 0.00 0.00 178.16 175.96 2wvz h ASN 446 N 0.80 0.00 0.00 -2.11 -0.26 -0.48 0.41 115.58 113.94 2wvz h ASN 446 Ca 0.19 0.00 -0.14 0.00 -0.56 0.00 0.00 56.30 55.78 2wvz h ASN 446 Cb 0.26 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.50 2wvz h ASN 446 CO -0.01 0.34 -0.92 0.50 -1.06 0.00 0.00 177.43 176.28 2wvz h LYS 447 N 0.00 0.00 0.00 0.81 3.64 -0.68 -3.42 116.57 116.93 2wvz h LYS 447 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2wvz h LYS 447 Cb 0.61 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 2wvz h LYS 447 CO 0.04 0.69 -1.01 1.28 -2.27 0.00 0.00 179.45 178.19 2wvz n LEU 448 N -4.51 0.63 0.00 5.20 4.77 0.43 -4.95 117.00 118.57 2wvz n LEU 448 Ca -0.23 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 2wvz n LEU 448 Cb 0.53 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2wvz n LEU 448 CO 0.17 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 2wvz n GLY 449 N 1.32 0.57 3.56 -0.72 0.00 0.14 -5.02 105.19 105.03 2wvz n GLY 449 Ca 0.01 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.00 -0.32 -0.39 1.61 1.13 -1.24 -4.73 117.35 111.42 2wvz s TYR 450 Ca 0.00 0.41 -0.25 0.00 -1.41 0.00 0.00 57.07 55.82 2wvz s TYR 450 Cb 0.00 0.49 0.02 0.00 -1.10 0.00 0.00 41.96 41.36 2wvz s TYR 450 CO 0.00 -0.37 0.91 0.08 -2.51 0.00 0.00 175.55 173.66 2wvz s VAL 451 N -1.85 4.57 0.90 -3.49 1.01 -1.26 -3.66 120.40 116.62 2wvz s VAL 451 Ca 0.02 1.07 -0.11 0.00 0.00 0.00 0.00 61.98 62.96 2wvz s VAL 451 Cb -0.01 -4.34 0.13 0.00 0.00 0.00 0.00 36.38 32.16 2wvz s VAL 451 CO -0.03 -0.59 1.09 -2.65 0.00 0.00 0.00 175.10 172.92 2wvz n PRO 452 N 6.83 -0.34 0.21 2.72 -0.02 -1.26 -4.41 135.00 138.73 2wvz n PRO 452 Ca 0.06 -0.03 0.12 0.00 -2.02 0.00 0.00 63.50 61.64 2wvz n PRO 452 Cb 0.48 -2.34 0.20 0.00 -0.02 0.00 0.00 33.50 31.82 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 -1.69 0.00 -0.98 6.00 5.03 -0.18 -3.38 116.97 121.76 2wvz h TYR 453 Ca -0.44 0.00 -0.57 0.00 2.58 0.00 0.00 58.73 60.31 2wvz h TYR 453 Cb 1.28 0.00 -0.42 0.00 1.55 0.00 0.00 36.73 39.14 2wvz h TYR 453 CO 0.48 0.00 -0.72 -0.40 -1.32 0.00 0.00 178.16 176.20 2wvz n ASP 454 N -3.04 4.99 -0.59 -2.11 5.75 -1.26 -4.69 116.55 115.60 2wvz n ASP 454 Ca 0.04 -3.74 0.04 0.00 -0.01 0.00 0.00 54.79 51.11 2wvz n ASP 454 Cb 0.52 -0.40 0.06 0.00 -1.03 0.00 0.00 41.12 40.27 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 -0.65 0.70 -2.53 2.12 0.24 -1.26 -4.88 118.33 112.07 2wvz n VAL 455 Ca 0.43 -1.08 -0.19 0.00 -2.04 0.00 0.00 64.34 61.46 2wvz n VAL 455 Cb 0.87 0.33 0.00 0.00 -1.47 0.00 0.00 33.84 33.57 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 -0.38 -2.39 -3.97 7.34 5.02 -1.26 -4.98 118.16 117.54 2wvz n LYS 456 Ca 0.07 0.88 -0.30 0.00 -2.02 0.00 0.00 58.31 56.93 2wvz n LYS 456 Cb 0.77 -5.45 -0.15 0.00 -0.02 0.00 0.00 35.03 30.18 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 -2.99 2.31 0.76 -0.18 1.01 -1.26 -5.12 121.20 115.74 2wvz s ILE 457 Ca 0.08 -2.71 -0.15 0.00 0.00 0.00 0.00 60.65 57.87 2wvz s ILE 457 Cb -0.04 -2.66 0.06 0.00 0.01 0.00 0.00 42.46 39.82 2wvz s ILE 457 CO 0.10 -0.70 1.24 0.20 0.00 0.00 0.00 174.94 175.79 2wvz s ASN 458 N 0.43 3.86 -1.69 3.58 -0.87 -1.26 -3.24 114.94 115.74 2wvz s ASN 458 Ca 0.14 2.46 0.00 0.00 -1.57 0.00 0.00 52.86 53.89 2wvz s ASN 458 Cb -0.22 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 38.41 2wvz s ASN 458 CO -0.05 -2.49 0.00 -0.62 -2.57 0.00 0.00 177.10 171.36 2wvz n GLU 459 N -2.89 -1.57 -0.27 -0.60 1.02 0.42 -4.89 120.64 111.86 2wvz n GLU 459 Ca 0.14 0.96 0.04 0.00 -0.02 0.00 0.00 57.16 58.28 2wvz n GLU 459 Cb 0.50 -5.55 0.26 0.00 -0.02 0.00 0.00 31.44 26.63 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 0.00 0.85 -0.23 1.62 -1.07 -1.48 -0.86 115.58 114.41 2wvz h ASN 460 Ca -0.47 0.00 -0.10 0.00 0.07 0.00 0.00 56.30 55.81 2wvz h ASN 460 Cb 1.35 -0.18 -0.00 0.00 -2.07 0.00 0.00 38.32 37.41 2wvz h ASN 460 CO 0.55 0.56 -0.23 0.00 0.07 0.00 0.00 177.43 178.38 2wvz h ALA 461 N 1.53 0.34 -0.58 4.14 0.00 -1.33 -2.16 119.26 121.20 2wvz h ALA 461 Ca 0.36 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wvz h ALA 461 Cb 0.17 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2wvz h ALA 461 CO -0.13 0.30 0.37 0.00 0.00 0.00 0.00 179.25 179.79 2wvz h ALA 462 N 0.67 0.73 -0.83 0.00 0.00 -0.67 -1.66 119.26 117.49 2wvz h ALA 462 Ca 0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2wvz h ALA 462 Cb 0.79 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2wvz h ALA 462 CO 0.06 0.19 0.38 0.00 0.00 0.00 0.00 179.25 179.88 2wvz h ARG 463 N 0.78 1.22 -0.53 0.00 3.08 -1.21 -2.18 114.38 115.54 2wvz h ARG 463 Ca 0.21 -0.19 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 2wvz h ARG 463 Cb -0.06 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.76 2wvz h ARG 463 CO -0.04 0.95 0.22 1.15 -1.07 0.00 0.00 179.97 181.18 2wvz h THR 464 N 1.20 1.21 -0.39 2.04 2.02 -0.91 0.46 112.91 118.54 2wvz h THR 464 Ca 0.28 -0.66 -0.11 0.00 0.77 0.00 0.00 66.41 66.70 2wvz h THR 464 Cb 0.15 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2wvz h THR 464 CO -0.03 0.25 -0.16 -0.07 0.37 0.00 0.00 175.52 175.88 2wvz h LEU 465 N 0.71 0.83 -0.28 2.58 3.38 -1.10 -1.88 115.31 119.55 2wvz h LEU 465 Ca 0.18 -0.39 -0.11 0.00 0.09 0.00 0.00 57.88 57.64 2wvz h LEU 465 Cb 0.19 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2wvz h LEU 465 CO -0.02 1.04 -0.27 -0.33 0.09 0.00 0.00 178.44 178.95 2wvz h GLU 466 N 0.62 0.68 -0.78 1.13 5.08 -1.29 -2.71 114.58 117.31 2wvz h GLU 466 Ca 0.09 -0.36 0.16 0.00 -1.00 0.00 0.00 59.36 58.26 2wvz h GLU 466 Cb 0.71 0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.87 2wvz h GLU 466 CO 0.05 0.97 0.27 1.88 -1.00 0.00 0.00 179.01 181.18 2wvz h TYR 467 N 0.42 0.45 -0.40 4.33 -1.99 -0.81 0.25 116.97 119.22 2wvz h TYR 467 Ca 0.05 0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.81 2wvz h TYR 467 Cb 0.83 -0.08 -0.02 0.00 2.00 0.00 0.00 36.73 39.46 2wvz h TYR 467 CO 0.07 -0.01 0.21 0.00 -0.00 0.00 0.00 178.16 178.43 2wvz h ALA 468 N 1.60 0.52 -0.42 3.88 0.00 -1.07 0.29 119.26 124.05 2wvz h ALA 468 Ca 0.44 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 2wvz h ALA 468 Cb 0.74 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2wvz h ALA 468 CO -0.47 0.06 0.12 -0.92 0.00 0.00 0.00 179.25 178.04 2wvz h TYR 469 N 0.51 0.70 -0.65 0.00 3.20 -1.02 -0.71 116.97 119.00 2wvz h TYR 469 Ca 0.14 -0.08 0.09 0.00 3.14 0.00 0.00 58.73 62.02 2wvz h TYR 469 Cb 0.09 -0.20 -0.07 0.00 1.54 0.00 0.00 36.73 38.09 2wvz h TYR 469 CO -0.02 0.65 0.29 -0.44 -1.64 0.00 0.00 178.16 177.00 2wvz h ASP 470 N 0.54 0.36 -0.24 -2.11 3.32 -0.19 -0.48 116.42 117.62 2wvz h ASP 470 Ca 0.13 0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.20 2wvz h ASP 470 Cb 0.29 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 2wvz h ASP 470 CO -0.00 0.21 -0.00 0.44 -1.72 0.00 0.00 179.24 178.17 2wvz h ASP 471 N 0.51 0.50 -0.62 6.45 3.32 -0.09 -0.53 116.42 125.96 2wvz h ASP 471 Ca 0.32 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 2wvz h ASP 471 Cb 0.35 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 2wvz h ASP 471 CO -0.27 0.57 0.39 -0.25 -1.72 0.00 0.00 179.24 177.96 2wvz h TRP 472 N 0.51 0.82 0.14 4.55 7.01 0.26 0.77 115.95 130.00 2wvz h TRP 472 Ca 0.11 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.11 2wvz h TRP 472 Cb 0.34 -0.27 0.00 0.00 -2.10 0.00 0.00 29.16 27.12 2wvz h TRP 472 CO 0.01 0.54 -0.07 0.00 -2.79 0.00 0.00 178.44 176.13 2wvz h ILE 474 N -0.54 0.66 -0.23 0.00 2.04 -0.94 -0.33 117.51 118.17 2wvz h ILE 474 Ca -0.02 -0.13 0.06 0.00 1.00 0.00 0.00 64.86 65.77 2wvz h ILE 474 Cb 0.42 0.26 -0.07 0.00 -0.74 0.00 0.00 36.82 36.69 2wvz h ILE 474 CO 0.03 0.07 -0.23 0.22 0.00 0.00 0.00 178.15 178.24 2wvz h TYR 475 N 0.37 -0.60 -0.96 1.37 5.03 -0.72 0.20 116.97 121.67 2wvz h TYR 475 Ca 0.37 0.04 0.15 0.00 2.58 0.00 0.00 58.73 61.87 2wvz h TYR 475 Cb 0.54 0.30 -0.08 0.00 1.55 0.00 0.00 36.73 39.04 2wvz h TYR 475 CO -0.20 -0.30 0.61 0.00 -1.32 0.00 0.00 178.16 176.94 2wvz h ARG 476 N -0.24 0.75 0.20 1.82 2.47 0.08 0.12 114.38 119.59 2wvz h ARG 476 Ca 0.13 -0.05 -0.31 0.00 -1.26 0.00 0.00 59.98 58.50 2wvz h ARG 476 Cb 0.44 -0.17 0.02 0.00 -1.65 0.00 0.00 29.97 28.61 2wvz h ARG 476 CO -0.37 0.50 -1.39 1.25 0.56 0.00 0.00 179.97 180.52 2wvz h LEU 477 N 0.78 0.66 -0.19 3.04 5.85 -0.84 -2.34 115.31 122.28 2wvz h LEU 477 Ca 0.50 -0.71 0.04 0.00 0.84 0.00 0.00 57.88 58.55 2wvz h LEU 477 Cb 0.74 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.51 2wvz h LEU 477 CO -0.27 1.56 -0.10 0.00 -0.34 0.00 0.00 178.44 179.29 2wvz h ALA 478 N 0.34 0.05 -0.65 1.25 0.00 0.68 -0.05 119.26 120.88 2wvz h ALA 478 Ca -0.21 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2wvz h ALA 478 Cb 2.09 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 20.07 2wvz h ALA 478 CO 0.24 -0.53 0.40 -0.22 0.00 0.00 0.00 179.25 179.15 2wvz h LYS 479 N -0.09 0.77 -0.72 0.00 3.64 -0.89 -0.76 116.57 118.53 2wvz h LYS 479 Ca 0.10 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.38 2wvz h LYS 479 Cb 0.24 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 2wvz h LYS 479 CO -0.24 0.51 0.24 1.49 -2.27 0.00 0.00 179.45 179.18 2wvz h GLU 480 N 0.79 1.10 -0.33 1.90 4.57 -0.81 -2.63 114.58 119.17 2wvz h GLU 480 Ca 0.26 -0.23 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 2wvz h GLU 480 Cb 0.01 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.44 2wvz h GLU 480 CO -0.10 0.94 0.00 1.28 -1.18 0.00 0.00 179.01 179.95 2wvz n LEU 481 N -4.30 1.24 -4.12 1.64 4.32 -0.09 -4.91 117.00 110.78 2wvz n LEU 481 Ca 0.06 -0.62 -0.28 0.00 -0.02 0.00 0.00 56.01 55.14 2wvz n LEU 481 Cb 0.21 -0.21 -0.05 0.00 -1.62 0.00 0.00 43.42 41.75 2wvz n LEU 481 CO 0.41 0.27 -0.31 0.29 -1.22 0.00 0.00 177.39 176.83 2wvz n LYS 482 N 0.07 -2.38 -0.85 3.23 4.01 -0.99 -4.98 118.16 116.27 2wvz n LYS 482 Ca 0.06 0.28 -0.29 0.00 -0.51 0.00 0.00 58.31 57.86 2wvz n LYS 482 Cb 0.22 -4.22 0.20 0.00 -0.51 0.00 0.00 35.03 30.72 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 -6.89 0.14 0.34 1.97 1.81 -0.30 -4.95 118.95 111.06 2wvz s ARG 483 Ca 0.06 0.87 -0.28 0.00 -1.72 0.00 0.00 55.73 54.67 2wvz s ARG 483 Cb -0.04 -1.67 -0.13 0.00 -0.45 0.00 0.00 34.95 32.66 2wvz s ARG 483 CO 0.93 -3.02 1.18 -2.30 -0.68 0.00 0.00 175.30 171.42 2wvz n PRO 484 N -4.43 1.83 -0.17 3.54 -0.02 -1.26 -4.79 135.00 129.69 2wvz n PRO 484 Ca 0.06 0.64 0.20 0.00 -2.02 0.00 0.00 63.50 62.38 2wvz n PRO 484 Cb 0.55 -2.16 0.58 0.00 -0.02 0.00 0.00 33.50 32.44 2wvz n PRO 484 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2wvz h LYS 485 N 2.28 0.27 0.00 -0.52 1.79 -1.99 -1.64 116.57 116.75 2wvz h LYS 485 Ca -0.44 -0.02 -0.10 0.00 -2.18 0.00 0.00 60.65 57.91 2wvz h LYS 485 Cb 1.30 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.88 2wvz h LYS 485 CO 0.61 0.18 -0.50 1.57 -1.08 0.00 0.00 179.45 180.23 2wvz h LYS 486 N 0.27 0.00 0.08 3.15 2.10 -1.98 0.17 116.57 120.36 2wvz h LYS 486 Ca 0.40 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 59.05 2wvz h LYS 486 Cb 1.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 2wvz h LYS 486 CO -0.10 0.50 -0.04 0.93 -2.00 0.00 0.00 179.45 178.74 2wvz h GLU 487 N 0.00 -0.10 -0.97 0.07 5.08 -1.67 -1.04 114.58 115.94 2wvz h GLU 487 Ca -0.00 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.52 2wvz h GLU 487 Cb 1.28 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 30.47 2wvz h GLU 487 CO 0.06 0.33 0.61 0.82 -1.00 0.00 0.00 179.01 179.84 2wvz h ILE 488 N -0.57 0.81 -0.31 3.13 2.04 -1.30 -1.37 117.51 119.94 2wvz h ILE 488 Ca -0.01 -0.28 -0.11 0.00 1.00 0.00 0.00 64.86 65.47 2wvz h ILE 488 Cb 0.48 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 2wvz h ILE 488 CO 0.02 0.15 -0.23 0.28 0.00 0.00 0.00 178.15 178.37 2wvz h SER 489 N 0.80 0.73 -0.04 1.72 0.02 -0.61 -2.20 113.55 113.98 2wvz h SER 489 Ca 0.51 -0.44 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 2wvz h SER 489 Cb 0.73 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.03 2wvz h SER 489 CO -0.28 1.02 -0.14 0.25 -1.14 0.00 0.00 176.83 176.54 2wvz h LEU 490 N 0.45 -0.43 -0.88 5.07 5.85 -0.09 -1.79 115.31 123.50 2wvz h LEU 490 Ca 0.06 0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 2wvz h LEU 490 Cb 0.78 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.99 2wvz h LEU 490 CO 0.06 -0.20 -0.44 -0.26 -0.34 0.00 0.00 178.44 177.26 2wvz h PHE 491 N -0.22 0.30 -0.81 1.25 0.04 -1.46 -0.90 116.94 115.14 2wvz h PHE 491 Ca 0.06 -0.09 0.07 0.00 2.80 0.00 0.00 57.97 60.82 2wvz h PHE 491 Cb 0.31 -0.06 -0.06 0.00 2.20 0.00 0.00 35.95 38.33 2wvz h PHE 491 CO -0.22 0.66 0.48 0.00 -0.60 0.00 0.00 178.31 178.63 2wvz h ALA 492 N 1.33 1.12 -0.09 2.45 0.00 -1.15 -1.21 119.26 121.71 2wvz h ALA 492 Ca 0.02 0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.69 2wvz h ALA 492 Cb 0.87 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.49 2wvz h ALA 492 CO 0.07 0.18 -0.89 -0.22 0.00 0.00 0.00 179.25 178.39 2wvz h LYS 493 N 0.86 0.76 -0.53 0.00 3.64 -0.73 -3.22 116.57 117.35 2wvz h LYS 493 Ca 0.37 -0.69 -0.02 0.00 -1.27 0.00 0.00 60.65 59.04 2wvz h LYS 493 Cb 0.23 0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 2wvz h LYS 493 CO -0.20 1.28 0.25 0.00 -2.27 0.00 0.00 179.45 178.52 2wvz h ARG 494 N 0.48 0.74 0.00 1.90 3.08 -0.94 -2.09 114.38 117.55 2wvz h ARG 494 Ca -0.08 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.88 2wvz h ARG 494 Cb 1.53 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.43 2wvz h ARG 494 CO 0.18 0.57 0.15 0.00 -1.07 0.00 0.00 179.97 179.81 2wvz h ALA 495 N 1.54 1.15 -0.30 0.04 0.00 -1.23 0.25 119.26 120.71 2wvz h ALA 495 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2wvz h ALA 495 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2wvz h ALA 495 CO -0.02 -0.15 0.00 -1.33 0.00 0.00 0.00 179.25 177.75 2wvz n MET 496 N -2.81 2.11 0.28 0.00 2.81 -0.79 -4.31 117.12 114.43 2wvz n MET 496 Ca -0.02 -1.69 0.13 0.00 -1.81 0.00 0.00 57.70 54.32 2wvz n MET 496 Cb 0.21 -1.44 0.83 0.00 -0.71 0.00 0.00 33.22 32.11 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 3.27 0.00 -0.17 7.83 2.35 -0.58 -2.04 115.58 126.23 2wvz h ASN 497 Ca 0.00 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 55.80 2wvz h ASN 497 Cb 0.72 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.09 2wvz h ASN 497 CO 0.00 0.04 0.16 0.10 -1.65 0.00 0.00 177.43 176.08 2wvz h TYR 498 N 0.00 0.00 0.00 1.19 -0.00 -1.80 0.14 116.97 116.51 2wvz h TYR 498 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.72 2wvz h TYR 498 Cb 0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.82 2wvz h TYR 498 CO 0.00 0.00 -0.04 0.87 -0.00 0.00 0.00 178.16 178.99 2wvz h LYS 499 N 0.00 0.00 0.00 0.10 1.57 -1.71 -2.75 116.57 113.78 2wvz h LYS 499 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2wvz h LYS 499 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2wvz h LYS 499 CO -0.00 0.04 0.00 -0.91 -0.57 0.00 0.00 179.45 178.00 2wvz h ASN 500 N 0.00 0.00 -0.24 0.86 2.35 -0.90 -2.87 115.58 114.78 2wvz h ASN 500 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2wvz h ASN 500 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2wvz h ASN 500 CO 0.00 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.96 2wvz n LEU 501 N -2.86 2.59 -4.65 1.61 4.77 -1.04 -4.95 117.00 112.48 2wvz n LEU 501 Ca -0.00 -1.80 -0.42 0.00 -0.03 0.00 0.00 56.01 53.76 2wvz n LEU 501 Cb 0.22 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.11 2wvz n LEU 501 CO 0.23 0.63 0.69 0.12 -1.33 0.00 0.00 177.39 177.72 2wvz s PHE 502 N -0.96 3.35 -0.31 -1.77 5.36 -1.09 0.37 117.98 122.95 2wvz s PHE 502 Ca 0.18 1.24 -0.14 0.00 -0.96 0.00 0.00 56.93 57.25 2wvz s PHE 502 Cb 0.10 -3.08 -0.03 0.00 -0.34 0.00 0.00 43.02 39.67 2wvz s PHE 502 CO 0.13 -0.36 0.30 0.34 -1.46 0.00 0.00 175.22 174.17 2wvz s ASP 503 N 1.26 6.14 0.25 6.13 2.15 -0.91 -4.95 116.67 126.73 2wvz s ASP 503 Ca 0.38 -0.08 -0.04 0.00 0.43 0.00 0.00 52.55 53.24 2wvz s ASP 503 Cb -0.16 -2.17 0.46 0.00 -0.30 0.00 0.00 42.92 40.75 2wvz s ASP 503 CO 0.09 -0.21 1.75 0.11 -0.17 0.00 0.00 175.17 176.73 2wvz h LYS 504 N 8.37 0.50 0.11 4.34 1.57 -1.95 0.62 116.57 130.14 2wvz h LYS 504 Ca -0.32 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.43 2wvz h LYS 504 Cb 1.16 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.36 2wvz h LYS 504 CO 0.63 0.33 -0.06 0.93 -0.57 0.00 0.00 179.45 180.72 2wvz h GLU 505 N 0.51 -0.15 -0.02 3.15 5.08 -1.96 -3.19 114.58 118.00 2wvz h GLU 505 Ca 0.42 0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.68 2wvz h GLU 505 Cb 0.59 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 2wvz h GLU 505 CO -0.37 0.22 -0.50 0.66 -1.00 0.00 0.00 179.01 178.02 2wvz h SER 506 N -0.55 0.06 -2.26 1.42 4.64 -1.98 -3.47 113.55 111.42 2wvz h SER 506 Ca -0.02 -0.03 -0.33 0.00 -0.47 0.00 0.00 61.79 60.94 2wvz h SER 506 Cb 0.44 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.49 2wvz h SER 506 CO 0.03 0.55 -0.42 0.29 -0.87 0.00 0.00 176.83 176.41 2wvz n LYS 507 N -3.95 -1.32 -4.20 4.77 5.02 0.20 -5.03 118.16 113.65 2wvz n LYS 507 Ca -0.02 0.83 -0.12 0.00 -2.02 0.00 0.00 58.31 56.99 2wvz n LYS 507 Cb 0.52 -5.24 -0.10 0.00 -0.02 0.00 0.00 35.03 30.19 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 -4.72 2.45 0.41 -0.35 1.43 -1.22 -4.95 118.68 111.73 2wvz s LEU 508 Ca 0.00 -1.04 -0.25 0.00 -1.03 0.00 0.00 54.13 51.81 2wvz s LEU 508 Cb 0.00 -0.13 -0.08 0.00 0.03 0.00 0.00 46.19 46.01 2wvz s LEU 508 CO 0.00 -0.45 1.28 -0.04 0.23 0.00 0.00 176.35 177.36 2wvz s MET 509 N -3.83 3.93 -0.12 1.70 -1.94 -1.26 -2.15 119.30 115.63 2wvz s MET 509 Ca 0.15 2.09 -0.08 0.00 -1.71 0.00 0.00 55.69 56.13 2wvz s MET 509 Cb 0.05 -2.70 0.04 0.00 2.01 0.00 0.00 34.83 34.23 2wvz s MET 509 CO -0.02 -0.51 0.30 0.50 -0.01 0.00 0.00 175.02 175.28 2wvz s ARG 510 N -2.31 0.30 0.44 2.03 3.52 0.16 -4.86 118.95 118.23 2wvz s ARG 510 Ca 0.58 0.51 -0.26 0.00 -0.13 0.00 0.00 55.73 56.43 2wvz s ARG 510 Cb -0.36 0.04 -0.09 0.00 -1.56 0.00 0.00 34.95 32.98 2wvz s ARG 510 CO 0.46 -0.10 1.42 0.41 -0.81 0.00 0.00 175.30 176.69 2wvz n GLY 511 N 3.56 0.99 3.19 8.12 0.00 -1.26 -4.71 105.19 115.09 2wvz n GLY 511 Ca -0.19 0.21 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.37 2.77 0.73 1.61 3.52 -1.26 -1.77 118.95 122.18 2wvz s ARG 512 Ca 0.60 -0.81 -0.14 0.00 -0.13 0.00 0.00 55.73 55.25 2wvz s ARG 512 Cb -0.46 -2.14 0.04 0.00 -1.56 0.00 0.00 34.95 30.83 2wvz s ARG 512 CO 0.59 0.18 1.13 -0.80 -0.81 0.00 0.00 175.30 175.59 2wvz s ASN 513 N 0.32 4.54 0.23 -2.12 0.01 0.20 0.56 114.94 118.69 2wvz s ASN 513 Ca -0.16 2.07 -0.06 0.00 -0.71 0.00 0.00 52.86 53.99 2wvz s ASN 513 Cb -0.17 -2.56 0.40 0.00 0.41 0.00 0.00 41.25 39.33 2wvz s ASN 513 CO 0.07 -2.02 1.71 -0.08 -1.51 0.00 0.00 177.10 175.28 2wvz h GLU 514 N -0.48 0.32 0.00 -0.60 4.81 -1.89 0.18 114.58 116.91 2wvz h GLU 514 Ca -0.46 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2wvz h GLU 514 Cb 1.26 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2wvz h GLU 514 CO 0.51 0.21 0.00 -0.40 -0.73 0.00 0.00 179.01 178.60 2wvz n ASP 515 N -5.09 0.00 0.00 1.04 5.68 -1.26 -4.77 116.55 112.15 2wvz n ASP 515 Ca 0.12 -0.51 0.00 0.00 -0.50 0.00 0.00 54.79 53.91 2wvz n ASP 515 Cb 0.39 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.37 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 -0.21 0.77 3.77 6.12 0.00 0.62 -5.02 105.19 111.24 2wvz n GLY 516 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 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 -3.02 4.20 0.61 2.61 -4.23 -1.26 -4.78 115.64 109.78 2wvz s THR 517 Ca 0.00 1.89 -0.18 0.00 -1.18 0.00 0.00 61.69 62.22 2wvz s THR 517 Cb 0.00 -4.19 -0.03 0.00 1.34 0.00 0.00 72.50 69.62 2wvz s THR 517 CO 0.00 0.41 1.22 -0.36 -0.54 0.00 0.00 174.62 175.35 2wvz s PHE 518 N -1.28 2.34 0.58 3.99 0.08 -1.26 0.63 117.98 123.06 2wvz s PHE 518 Ca 0.42 1.52 -0.17 0.00 0.12 0.00 0.00 56.93 58.81 2wvz s PHE 518 Cb -0.23 -3.50 -0.04 0.00 -0.57 0.00 0.00 43.02 38.68 2wvz s PHE 518 CO 0.28 -2.30 1.08 1.14 -0.10 0.00 0.00 175.22 175.32 2wvz s GLN 519 N -3.37 3.26 -0.08 0.44 1.03 -0.73 -4.72 119.66 115.49 2wvz s GLN 519 Ca 0.78 1.36 -0.08 0.00 0.04 0.00 0.00 55.36 57.45 2wvz s GLN 519 Cb -0.31 -2.01 0.02 0.00 0.03 0.00 0.00 33.01 30.74 2wvz s GLN 519 CO 0.34 -0.88 0.23 -1.12 -2.54 0.00 0.00 175.29 171.32 2wvz s SER 520 N -2.41 -0.23 0.69 12.60 0.01 -1.26 -3.93 113.70 119.17 2wvz s SER 520 Ca 0.67 0.43 -0.11 0.00 1.31 0.00 0.00 55.95 58.25 2wvz s SER 520 Cb -0.19 0.46 0.00 0.00 0.21 0.00 0.00 66.02 66.50 2wvz s SER 520 CO 0.34 -0.10 1.06 -2.16 0.41 0.00 0.00 173.24 172.79 2wvz s PRO 521 N 0.04 2.99 -0.13 12.44 0.04 -1.26 -5.16 135.00 143.97 2wvz s PRO 521 Ca -0.01 0.78 -0.03 0.00 0.04 0.00 0.00 61.00 61.78 2wvz s PRO 521 Cb -0.02 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 2wvz s PRO 521 CO 0.00 -1.02 -0.02 0.12 0.04 0.00 0.00 177.00 176.13 2wvz s PHE 522 N -3.14 3.08 -0.13 0.56 5.36 -1.25 -5.09 117.98 117.37 2wvz s PHE 522 Ca 0.58 -0.08 -0.01 0.00 -0.96 0.00 0.00 56.93 56.46 2wvz s PHE 522 Cb -0.13 -1.90 0.04 0.00 -0.34 0.00 0.00 43.02 40.69 2wvz s PHE 522 CO 0.54 0.17 -0.02 0.45 -1.46 0.00 0.00 175.22 174.91 2wvz s SER 523 N -0.13 2.28 0.05 6.13 0.15 -1.26 -5.01 113.70 115.92 2wvz s SER 523 Ca 0.03 -0.42 0.03 0.00 0.70 0.00 0.00 55.95 56.29 2wvz s SER 523 Cb -0.13 -0.66 0.17 0.00 -1.71 0.00 0.00 66.02 63.69 2wvz s SER 523 CO 0.02 -0.20 1.03 -0.81 1.20 0.00 0.00 173.24 174.48 2wvz n PRO 524 N 5.03 0.02 0.00 5.44 -0.04 -1.26 -2.47 135.00 141.71 2wvz n PRO 524 Ca -0.10 0.46 0.08 0.00 -0.04 0.00 0.00 63.50 63.91 2wvz n PRO 524 Cb 0.49 -1.64 0.04 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.55 2.05 -4.71 1.53 4.77 -1.26 -1.94 117.00 115.89 2wvz n LEU 525 Ca -0.00 -0.90 -0.42 0.00 -0.03 0.00 0.00 56.01 54.66 2wvz n LEU 525 Cb 0.08 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 2wvz n LEU 525 CO 0.01 0.37 0.67 -0.75 -1.33 0.00 0.00 177.39 176.36 2wvz s LYS 526 N -1.60 4.56 0.37 3.23 2.20 -1.03 -2.66 119.74 124.80 2wvz s LYS 526 Ca 0.17 1.39 0.01 0.00 -0.36 0.00 0.00 55.97 57.18 2wvz s LYS 526 Cb 0.13 -3.46 -0.02 0.00 -1.51 0.00 0.00 37.83 32.97 2wvz s LYS 526 CO 0.29 -0.04 0.57 -1.58 -0.36 0.00 0.00 175.35 174.23 2wvz s TRP 527 N 0.97 3.39 0.00 4.03 0.52 -0.85 -4.29 118.94 122.70 2wvz s TRP 527 Ca 0.51 0.25 0.00 0.00 0.02 0.00 0.00 56.10 56.88 2wvz s TRP 527 Cb -0.21 -2.00 0.00 0.00 -1.15 0.00 0.00 33.47 30.11 2wvz s TRP 527 CO 0.28 -0.00 0.00 0.41 0.02 0.00 0.00 176.95 177.65 2wvz n GLY 528 N -1.84 -0.21 6.44 0.98 0.00 -0.94 -4.61 105.19 105.01 2wvz n GLY 528 Ca -0.03 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.90 0.00 0.15 1.61 2.03 -1.26 0.48 116.55 118.66 2wvz n ASP 529 Ca 0.00 0.00 0.01 0.00 0.52 0.00 0.00 54.79 55.32 2wvz n ASP 529 Cb 0.00 0.00 0.16 0.00 -0.72 0.00 0.00 41.12 40.56 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 -0.82 0.82 -0.79 -1.67 0.00 -1.91 1.22 119.26 116.10 2wvz h ALA 530 Ca 0.00 -0.50 -0.59 0.00 0.00 0.00 0.00 54.91 53.82 2wvz h ALA 530 Cb 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 2wvz h ALA 530 CO 0.00 0.69 -0.37 -0.06 0.00 0.00 0.00 179.25 179.51 2wvz s PHE 531 N -3.34 1.92 -0.36 0.00 0.08 0.18 -1.12 117.98 115.33 2wvz s PHE 531 Ca 0.01 -0.78 -0.04 0.00 0.12 0.00 0.00 56.93 56.23 2wvz s PHE 531 Cb 0.11 -1.90 0.07 0.00 -0.57 0.00 0.00 43.02 40.72 2wvz s PHE 531 CO 0.74 -0.24 0.13 0.99 -0.10 0.00 0.00 175.22 176.74 2wvz s THR 532 N -2.73 3.42 -1.50 0.64 2.01 -1.26 -3.94 115.64 112.28 2wvz s THR 532 Ca 0.33 -1.58 -0.05 0.00 0.31 0.00 0.00 61.69 60.70 2wvz s THR 532 Cb -0.01 -3.11 0.04 0.00 0.01 0.00 0.00 72.50 69.43 2wvz s THR 532 CO 0.20 -0.39 0.49 -0.62 -0.69 0.00 0.00 174.62 173.61 2wvz n GLU 533 N 4.69 -3.14 -3.71 4.92 1.02 -1.26 -4.86 120.64 118.30 2wvz n GLU 533 Ca -0.09 0.38 0.02 0.00 -0.02 0.00 0.00 57.16 57.45 2wvz n GLU 533 Cb 0.43 -4.63 0.00 0.00 -0.02 0.00 0.00 31.44 27.22 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 -4.07 -0.35 0.00 0.62 0.00 -1.26 -4.95 107.32 97.31 2wvz s GLY 534 Ca 0.21 0.57 0.00 0.00 0.00 0.00 0.00 44.72 45.50 2wvz s GLY 534 CO 0.91 1.70 0.00 1.16 0.00 0.00 0.00 173.10 176.86 2wvz n ASN 535 N -0.65 1.97 0.06 1.64 0.23 -1.26 -2.22 115.26 115.02 2wvz n ASN 535 Ca -0.05 -0.35 -0.06 0.00 -0.53 0.00 0.00 54.58 53.58 2wvz n ASN 535 Cb 0.62 0.00 0.11 0.00 -2.08 0.00 0.00 39.78 38.43 2wvz n ASN 535 CO 0.00 0.00 0.00 -1.28 -0.93 0.00 0.00 177.26 175.05 2wvz h SER 536 N 0.00 0.38 0.13 0.53 0.87 -1.58 -2.17 113.55 111.70 2wvz h SER 536 Ca 0.00 -0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.34 2wvz h SER 536 Cb 0.00 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 61.85 2wvz h SER 536 CO 0.00 0.87 -0.05 -0.50 -0.53 0.00 0.00 176.83 176.62 2wvz h TRP 537 N 0.26 0.00 0.07 2.24 4.06 -1.93 -2.19 115.95 118.45 2wvz h TRP 537 Ca -0.00 0.00 -0.27 0.00 2.06 0.00 0.00 58.89 60.68 2wvz h TRP 537 Cb 1.08 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.22 2wvz h TRP 537 CO 0.03 0.05 -1.44 0.45 -3.56 0.00 0.00 178.44 173.97 2wvz h HIS 538 N 0.00 0.27 0.00 0.49 3.86 -1.75 -3.41 115.15 114.61 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 0.13 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 2wvz h HIS 538 CO 0.00 1.56 -0.61 1.88 0.86 0.00 0.00 177.93 181.62 2wvz h TYR 539 N -0.50 0.00 -1.15 2.45 -1.99 -1.42 -3.33 116.97 111.04 2wvz h TYR 539 Ca -0.34 0.00 0.33 0.00 2.00 0.00 0.00 58.73 60.72 2wvz h TYR 539 Cb 1.63 0.00 -0.07 0.00 2.00 0.00 0.00 36.73 40.29 2wvz h TYR 539 CO 0.11 0.42 0.80 1.15 -0.00 0.00 0.00 178.16 180.63 2wvz h THR 540 N 0.00 0.42 -0.10 -2.88 2.02 -1.62 0.99 112.91 111.75 2wvz h THR 540 Ca -0.03 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.10 2wvz h THR 540 Cb 1.34 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 2wvz h THR 540 CO 0.05 0.02 0.00 0.79 0.37 0.00 0.00 175.52 176.75 2wvz n TRP 541 N -4.36 0.13 -1.64 3.16 7.02 -1.25 -4.57 117.44 115.92 2wvz n TRP 541 Ca 0.26 -0.06 -0.41 0.00 -1.02 0.00 0.00 57.50 56.27 2wvz n TRP 541 Cb 1.14 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 30.02 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 -0.21 5.16 -2.86 -0.99 7.64 0.34 -4.36 113.62 118.34 2wvz n SER 542 Ca 0.12 -2.78 -0.12 0.00 1.01 0.00 0.00 58.87 57.10 2wvz n SER 542 Cb 0.17 -1.63 0.01 0.00 -1.01 0.00 0.00 64.21 61.76 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 4.65 0.48 -0.34 0.44 0.31 -1.26 -4.75 118.33 117.85 2wvz n VAL 543 Ca 0.58 -3.50 0.31 0.00 -0.01 0.00 0.00 64.34 61.72 2wvz n VAL 543 Cb 0.35 0.37 0.57 0.00 -0.91 0.00 0.00 33.84 34.21 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 2.95 0.81 0.00 3.52 -1.00 -1.87 -0.93 116.94 120.43 2wvz h PHE 544 Ca -0.03 0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2wvz h PHE 544 Cb 1.10 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 40.47 2wvz h PHE 544 CO 0.46 -0.36 -0.57 1.12 -1.61 0.00 0.00 178.31 177.36 2wvz h HIS 545 N 0.10 0.00 -1.88 -0.55 2.07 -1.91 -3.41 115.15 109.57 2wvz h HIS 545 Ca 0.82 0.00 -0.47 0.00 -2.85 0.00 0.00 60.37 57.87 2wvz h HIS 545 Cb 2.16 0.00 -0.40 0.00 2.57 0.00 0.00 27.41 31.74 2wvz h HIS 545 CO -0.01 0.00 -1.17 -3.47 -3.07 0.00 0.00 177.93 170.21 2wvz n ASP 546 N -2.59 1.13 -0.36 3.10 2.03 -0.36 -0.44 116.55 119.06 2wvz n ASP 546 Ca 0.02 -3.01 -0.01 0.00 0.52 0.00 0.00 54.79 52.31 2wvz n ASP 546 Cb 0.50 -0.60 0.13 0.00 -0.72 0.00 0.00 41.12 40.43 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 3.00 1.29 -0.54 -0.67 0.11 -1.76 -1.48 132.00 131.94 2wvz h PRO 547 Ca 0.08 -0.08 0.01 0.00 0.11 0.00 0.00 66.00 66.12 2wvz h PRO 547 Cb 0.97 -0.29 -0.03 0.00 0.11 0.00 0.00 31.00 31.76 2wvz h PRO 547 CO 0.52 0.85 0.34 0.37 -0.21 0.00 0.00 178.00 179.87 2wvz h GLN 548 N 1.32 0.67 -0.84 1.05 5.75 -1.91 0.62 115.11 121.77 2wvz h GLN 548 Ca 0.37 -0.04 0.16 0.00 -0.15 0.00 0.00 58.65 58.98 2wvz h GLN 548 Cb -0.13 -0.15 -0.10 0.00 1.07 0.00 0.00 27.48 28.17 2wvz h GLN 548 CO -0.08 0.44 0.41 0.78 -2.65 0.00 0.00 178.83 177.73 2wvz h GLY 549 N 0.69 1.36 1.10 2.39 0.00 -1.70 0.12 103.07 107.03 2wvz h GLY 549 Ca 0.21 -0.22 -0.15 0.00 0.00 0.00 0.00 47.33 47.17 2wvz h GLY 549 CO -0.07 -0.08 -0.34 -2.00 0.00 0.00 0.00 176.54 174.05 2wvz h LEU 550 N 0.55 0.96 -0.19 3.11 5.85 -0.33 0.35 115.31 125.62 2wvz h LEU 550 Ca 0.47 -0.46 0.02 0.00 0.84 0.00 0.00 57.88 58.76 2wvz h LEU 550 Cb 0.71 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 2wvz h LEU 550 CO -0.40 1.22 0.03 0.40 -0.34 0.00 0.00 178.44 179.35 2wvz h ILE 551 N 0.72 0.91 -0.33 4.05 2.04 -0.36 -0.77 117.51 123.77 2wvz h ILE 551 Ca 0.07 -0.04 0.04 0.00 1.00 0.00 0.00 64.86 65.93 2wvz h ILE 551 Cb 0.93 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.77 2wvz h ILE 551 CO 0.09 0.02 0.10 0.44 0.00 0.00 0.00 178.15 178.80 2wvz h ASP 552 N 0.11 0.10 -1.01 1.72 3.32 -0.61 -1.27 116.42 118.78 2wvz h ASP 552 Ca 0.08 0.04 0.23 0.00 0.02 0.00 0.00 57.03 57.40 2wvz h ASP 552 Cb 0.08 0.04 -0.11 0.00 0.22 0.00 0.00 39.33 39.56 2wvz h ASP 552 CO -0.12 0.09 0.62 -0.07 -1.72 0.00 0.00 179.24 178.04 2wvz h LEU 553 N 0.24 0.64 0.00 1.55 3.38 -0.45 -1.78 115.31 118.89 2wvz h LEU 553 Ca 0.15 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2wvz h LEU 553 Cb 0.13 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2wvz h LEU 553 CO -0.17 0.16 -0.23 0.23 0.09 0.00 0.00 178.44 178.53 2wvz n MET 554 N -4.76 0.23 0.00 1.13 2.81 -0.34 -4.90 117.12 111.30 2wvz n MET 554 Ca 0.25 0.14 0.00 0.00 -1.81 0.00 0.00 57.70 56.28 2wvz n MET 554 Cb 0.72 -1.72 0.00 0.00 -0.71 0.00 0.00 33.22 31.51 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 1.35 1.42 0.00 3.03 0.00 -0.67 -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 -0.32 2.29 0.29 -0.02 0.00 -0.58 -4.52 105.19 102.34 2wvz n GLY 556 Ca 0.00 -1.91 0.14 0.00 0.00 0.00 0.00 46.02 44.26 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 0.00 -0.07 1.61 2.10 -1.92 -1.71 116.57 116.59 2wvz h LYS 557 Ca 0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.61 2wvz h LYS 557 Cb 0.00 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2wvz h LYS 557 CO 0.00 0.02 -0.11 1.49 -2.00 0.00 0.00 179.45 178.86 2wvz h GLU 558 N 0.00 0.19 -0.57 0.07 4.81 -1.90 -1.26 114.58 115.92 2wvz h GLU 558 Ca -0.00 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 59.08 2wvz h GLU 558 Cb 0.06 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2wvz h GLU 558 CO 0.00 0.68 0.20 1.98 -0.73 0.00 0.00 179.01 181.15 2wvz h MET 559 N -0.29 0.87 -0.14 1.92 4.05 -1.65 -0.82 114.93 118.88 2wvz h MET 559 Ca 0.01 -0.17 0.05 0.00 -0.28 0.00 0.00 59.70 59.30 2wvz h MET 559 Cb 0.67 -0.13 -0.06 0.00 -0.80 0.00 0.00 31.60 31.27 2wvz h MET 559 CO 0.02 0.77 -0.33 0.35 0.23 0.00 0.00 176.91 177.95 2wvz h PHE 560 N 0.79 -0.92 -0.97 1.39 3.04 -1.35 0.05 116.94 118.98 2wvz h PHE 560 Ca 0.19 0.04 0.07 0.00 3.98 0.00 0.00 57.97 62.25 2wvz h PHE 560 Cb 0.24 0.42 -0.07 0.00 2.56 0.00 0.00 35.95 39.11 2wvz h PHE 560 CO 0.01 -0.41 0.63 0.28 -2.02 0.00 0.00 178.31 176.80 2wvz h VAL 561 N -0.40 1.05 -0.69 1.41 2.07 -0.84 0.18 116.25 119.03 2wvz h VAL 561 Ca 0.10 -0.38 0.01 0.00 0.82 0.00 0.00 66.70 67.25 2wvz h VAL 561 Cb 0.55 -0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 2wvz h VAL 561 CO -0.36 0.20 0.45 0.74 0.02 0.00 0.00 177.57 178.62 2wvz h THR 562 N 1.09 1.17 -0.27 2.57 2.02 -0.58 0.16 112.91 119.09 2wvz h THR 562 Ca 0.43 -0.32 -0.15 0.00 0.77 0.00 0.00 66.41 67.14 2wvz h THR 562 Cb 0.24 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 2wvz h THR 562 CO -0.18 0.17 -0.45 0.24 0.37 0.00 0.00 175.52 175.68 2wvz h MET 563 N 0.93 0.67 0.23 6.66 2.86 0.36 -1.56 114.93 125.08 2wvz h MET 563 Ca 0.25 -0.37 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 2wvz h MET 563 Cb -0.10 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.58 2wvz h MET 563 CO -0.06 0.98 -0.11 0.52 1.06 0.00 0.00 176.91 179.31 2wvz h MET 564 N 0.54 -0.29 -1.10 1.72 2.07 -0.80 -2.77 114.93 114.30 2wvz h MET 564 Ca 0.04 0.02 0.31 0.00 -2.07 0.00 0.00 59.70 58.00 2wvz h MET 564 Cb 0.99 0.07 -0.11 0.00 -1.87 0.00 0.00 31.60 30.67 2wvz h MET 564 CO 0.09 0.01 0.69 -0.44 1.07 0.00 0.00 176.91 178.34 2wvz h ASP 565 N -0.61 0.43 0.23 1.22 3.32 -0.62 -1.38 116.42 119.01 2wvz h ASP 565 Ca -0.03 0.11 -0.04 0.00 0.02 0.00 0.00 57.03 57.09 2wvz h ASP 565 Cb 0.44 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 2wvz h ASP 565 CO 0.05 -0.00 -0.18 0.28 -1.72 0.00 0.00 179.24 177.66 2wvz h SER 566 N 0.33 0.00 -0.67 6.45 0.02 -0.98 -2.55 113.55 116.15 2wvz h SER 566 Ca 0.67 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.67 2wvz h SER 566 Cb 1.75 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 64.24 2wvz h SER 566 CO -0.38 0.18 0.39 0.58 -1.14 0.00 0.00 176.83 176.47 2wvz h VAL 567 N 0.00 1.02 -0.02 2.27 2.07 -1.23 -1.66 116.25 118.69 2wvz h VAL 567 Ca -0.00 -0.25 -0.16 0.00 0.82 0.00 0.00 66.70 67.10 2wvz h VAL 567 Cb 0.35 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2wvz h VAL 567 CO 0.02 0.14 -0.71 -0.26 0.02 0.00 0.00 177.57 176.77 2wvz h PHE 568 N 0.74 0.16 0.03 1.57 0.04 -1.60 0.28 116.94 118.16 2wvz h PHE 568 Ca 0.29 -0.07 -0.23 0.00 2.80 0.00 0.00 57.97 60.76 2wvz h PHE 568 Cb 0.12 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.25 2wvz h PHE 568 CO -0.06 0.79 -0.99 0.00 -0.60 0.00 0.00 178.31 177.44 2wvz h ALA 569 N 1.19 0.35 -2.71 2.45 0.00 -1.17 -3.15 119.26 116.23 2wvz h ALA 569 Ca -0.02 -0.77 -0.55 0.00 0.00 0.00 0.00 54.91 53.58 2wvz h ALA 569 Cb 1.26 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 2wvz h ALA 569 CO 0.10 0.91 0.08 0.14 0.00 0.00 0.00 179.25 180.48 2wvz s VAL 570 N -3.07 4.70 0.39 0.00 -7.23 -0.68 -4.91 120.40 109.59 2wvz s VAL 570 Ca -0.04 1.47 -0.23 0.00 -1.81 0.00 0.00 61.98 61.36 2wvz s VAL 570 Cb 0.09 -4.03 -0.13 0.00 0.56 0.00 0.00 36.38 32.87 2wvz s VAL 570 CO 0.85 0.45 0.59 -2.65 -0.31 0.00 0.00 175.10 174.04 2wvz n PRO 571 N 2.31 0.62 -0.90 4.82 -0.02 -1.26 -3.19 135.00 137.38 2wvz n PRO 571 Ca -0.06 0.22 -0.10 0.00 -2.02 0.00 0.00 63.50 61.54 2wvz n PRO 571 Cb 0.50 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.33 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 0.65 1.80 -2.05 0.52 -0.04 -1.26 -4.67 135.00 129.95 2wvz n PRO 572 Ca 0.12 -0.86 -0.33 0.00 -0.04 0.00 0.00 63.50 62.39 2wvz n PRO 572 Cb 0.38 -1.89 0.01 0.00 -0.04 0.00 0.00 33.50 31.96 2wvz n PRO 572 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2wvz s ILE 573 N 1.04 3.71 0.19 0.52 -1.09 -1.26 -4.82 121.20 119.48 2wvz s ILE 573 Ca 0.57 0.83 -0.22 0.00 -2.23 0.00 0.00 60.65 59.61 2wvz s ILE 573 Cb 0.27 -3.35 0.05 0.00 -1.58 0.00 0.00 42.46 37.86 2wvz s ILE 573 CO 0.00 -0.46 0.61 0.72 -1.23 0.00 0.00 174.94 174.59 2wvz s PHE 574 N -2.38 -0.41 -0.17 3.97 -0.12 -1.26 -4.91 117.98 112.69 2wvz s PHE 574 Ca 0.65 0.13 0.01 0.00 -0.05 0.00 0.00 56.93 57.66 2wvz s PHE 574 Cb -0.17 0.57 0.03 0.00 -0.63 0.00 0.00 43.02 42.82 2wvz s PHE 574 CO 0.36 -0.94 -0.13 0.34 -0.05 0.00 0.00 175.22 174.80 2wvz s ASP 575 N -2.80 3.01 0.00 1.98 -1.08 -1.09 -5.00 116.67 111.69 2wvz s ASP 575 Ca 0.04 -0.67 0.20 0.00 -0.52 0.00 0.00 52.55 51.61 2wvz s ASP 575 Cb -0.02 -1.21 0.17 0.00 -1.46 0.00 0.00 42.92 40.39 2wvz s ASP 575 CO -0.07 -0.09 1.15 -0.90 0.52 0.00 0.00 175.17 175.77 2wvz n ASP 576 N 4.73 2.71 -0.27 -0.34 5.68 -1.26 -2.02 116.55 125.79 2wvz n ASP 576 Ca -0.16 -1.85 0.16 0.00 -0.50 0.00 0.00 54.79 52.44 2wvz n ASP 576 Cb 0.48 -0.00 0.31 0.00 -1.14 0.00 0.00 41.12 40.77 2wvz n ASP 576 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2wvz n SER 577 N 1.15 0.03 -0.22 -1.12 3.41 -1.26 0.23 113.62 115.85 2wvz n SER 577 Ca 0.12 1.33 0.21 0.00 -0.26 0.00 0.00 58.87 60.28 2wvz n SER 577 Cb 0.51 -0.54 0.57 0.00 -0.26 0.00 0.00 64.21 64.49 2wvz n SER 577 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2wvz h TYR 578 N 0.00 0.40 0.00 7.33 3.20 -1.85 -2.56 116.97 123.50 2wvz h TYR 578 Ca 0.54 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.42 2wvz h TYR 578 Cb 1.25 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 39.40 2wvz h TYR 578 CO -0.27 0.10 -1.29 0.66 -1.64 0.00 0.00 178.16 175.72 2wvz n TYR 579 N -4.46 0.70 -1.10 -3.82 4.01 0.64 -4.95 117.16 108.19 2wvz n TYR 579 Ca 0.19 0.20 -0.03 0.00 -0.16 0.00 0.00 57.90 58.10 2wvz n TYR 579 Cb 0.76 -0.83 -0.01 0.00 -0.31 0.00 0.00 39.34 38.94 2wvz n TYR 579 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wvz n GLY 580 N 1.21 0.53 3.63 2.72 0.00 -0.94 -4.93 105.19 107.41 2wvz n GLY 580 Ca -0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.68 0.51 -1.05 1.61 -2.07 -1.26 -5.05 119.66 110.66 2wvz s GLN 581 Ca 0.00 -0.26 -0.19 0.00 -1.82 0.00 0.00 55.36 53.09 2wvz s GLN 581 Cb 0.00 0.18 0.11 0.00 -1.09 0.00 0.00 33.01 32.21 2wvz s GLN 581 CO 0.00 -0.23 1.34 0.08 -1.32 0.00 0.00 175.29 175.16 2wvz s VAL 582 N -2.57 4.52 0.97 3.63 1.01 -1.26 -4.85 120.40 121.85 2wvz s VAL 582 Ca 0.13 -1.63 -0.11 0.00 0.00 0.00 0.00 61.98 60.36 2wvz s VAL 582 Cb 0.03 -4.93 0.14 0.00 0.00 0.00 0.00 36.38 31.62 2wvz s VAL 582 CO -0.03 -1.70 0.89 2.30 0.00 0.00 0.00 175.10 176.56 2wvz n ILE 583 N 5.77 0.00 0.20 2.22 -5.35 -1.26 -4.73 119.36 116.21 2wvz n ILE 583 Ca 0.32 -0.12 0.03 0.00 -0.27 0.00 0.00 62.75 62.71 2wvz n ILE 583 Cb 0.48 -0.88 0.39 0.00 -1.74 0.00 0.00 39.64 37.89 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 -1.93 0.00 -0.54 4.28 2.07 -1.77 -2.29 115.15 114.96 2wvz h HIS 584 Ca -0.46 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.03 2wvz h HIS 584 Cb 1.29 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.24 2wvz h HIS 584 CO 0.43 0.33 0.23 0.93 -3.07 0.00 0.00 177.93 176.77 2wvz h GLU 585 N 0.00 0.77 -0.25 5.12 3.07 -1.90 0.48 114.58 121.88 2wvz h GLU 585 Ca -0.00 -0.11 -0.11 0.00 -0.50 0.00 0.00 59.36 58.64 2wvz h GLU 585 Cb 0.58 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 28.34 2wvz h GLU 585 CO 0.04 0.62 -0.26 0.82 -1.40 0.00 0.00 179.01 178.84 2wvz h ILE 586 N 0.76 1.31 -0.62 3.13 2.04 -1.78 -3.01 117.51 119.36 2wvz h ILE 586 Ca 0.19 -1.43 -0.02 0.00 1.00 0.00 0.00 64.86 64.60 2wvz h ILE 586 Cb 0.13 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 2wvz h ILE 586 CO -0.02 0.45 0.30 -0.09 0.00 0.00 0.00 178.15 178.79 2wvz h ARG 587 N 0.33 0.88 -0.71 2.37 9.65 -0.80 -1.47 114.38 124.64 2wvz h ARG 587 Ca 0.04 -0.13 0.10 0.00 -1.10 0.00 0.00 59.98 58.90 2wvz h ARG 587 Cb 0.82 -0.16 -0.08 0.00 -1.39 0.00 0.00 29.97 29.16 2wvz h ARG 587 CO 0.06 0.71 0.33 0.93 2.80 0.00 0.00 179.97 184.80 2wvz h GLU 588 N 0.84 0.53 -0.67 0.20 5.08 -0.11 -1.30 114.58 119.14 2wvz h GLU 588 Ca 0.21 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.50 2wvz h GLU 588 Cb 0.11 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2wvz h GLU 588 CO -0.03 0.35 0.26 1.98 -1.00 0.00 0.00 179.01 180.57 2wvz h MET 589 N 0.54 1.01 -0.15 2.33 4.05 -1.15 -3.15 114.93 118.40 2wvz h MET 589 Ca 0.36 -0.19 -0.09 0.00 -0.28 0.00 0.00 59.70 59.50 2wvz h MET 589 Cb 0.43 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 2wvz h MET 589 CO -0.30 0.84 -0.32 1.79 0.23 0.00 0.00 176.91 179.15 2wvz h THR 590 N 0.95 1.28 0.00 -0.77 1.35 -0.52 -2.84 112.91 112.36 2wvz h THR 590 Ca 0.22 -1.33 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 2wvz h THR 590 Cb 0.22 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 2wvz h THR 590 CO -0.02 0.41 -0.25 1.33 -0.25 0.00 0.00 175.52 176.73 2wvz n VAL 591 N -4.09 0.03 0.16 6.82 0.24 -1.09 -3.69 118.33 116.70 2wvz n VAL 591 Ca -0.01 -0.02 0.04 0.00 -2.04 0.00 0.00 64.34 62.31 2wvz n VAL 591 Cb 0.42 -0.14 0.16 0.00 -1.47 0.00 0.00 33.84 32.82 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 -5.71 7.34 2.86 -1.53 -3.48 114.93 114.41 2wvz h MET 592 Ca 0.00 0.00 -0.35 0.00 -2.06 0.00 0.00 59.70 57.29 2wvz h MET 592 Cb 0.51 0.00 0.16 0.00 0.06 0.00 0.00 31.60 32.33 2wvz h MET 592 CO 0.00 0.45 -0.75 -1.71 1.06 0.00 0.00 176.91 175.96 2wvz n ASN 593 N -3.34 -3.08 -2.63 1.22 4.05 -1.24 -4.93 115.26 105.30 2wvz n ASN 593 Ca 0.01 -0.61 -0.09 0.00 0.45 0.00 0.00 54.58 54.35 2wvz n ASN 593 Cb 0.64 -5.08 0.04 0.00 1.23 0.00 0.00 39.78 36.61 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 -4.35 2.03 0.00 1.20 2.81 -1.26 -5.11 117.12 112.45 2wvz n MET 594 Ca -0.22 -3.64 0.00 0.00 -1.81 0.00 0.00 57.70 52.04 2wvz n MET 594 Cb 0.64 -1.68 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 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 -0.47 3.46 1.31 3.03 0.00 -1.19 -1.27 105.19 110.05 2wvz n GLY 595 Ca 0.16 0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.43 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 5.50 3.79 -4.57 1.61 3.02 1.00 -4.02 115.26 121.58 2wvz n ASN 596 Ca 0.00 -2.01 -0.30 0.00 -0.03 0.00 0.00 54.58 52.24 2wvz n ASN 596 Cb 0.00 -0.47 -0.05 0.00 -0.61 0.00 0.00 39.78 38.65 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 -1.08 2.00 -1.50 3.10 5.04 -0.39 -4.84 117.35 119.67 2wvz s TYR 597 Ca 0.47 0.25 -0.11 0.00 -2.44 0.00 0.00 57.07 55.24 2wvz s TYR 597 Cb 0.25 -4.17 0.00 0.00 0.35 0.00 0.00 41.96 38.39 2wvz s TYR 597 CO 0.32 -1.64 2.56 0.00 -1.34 0.00 0.00 175.55 175.44 2wvz n ALA 598 N 13.03 6.63 0.33 3.97 0.00 -1.26 -4.76 120.51 138.45 2wvz n ALA 598 Ca 0.41 -3.78 0.18 0.00 0.00 0.00 0.00 53.44 50.24 2wvz n ALA 598 Cb 0.47 -3.32 0.95 0.00 0.00 0.00 0.00 19.45 17.55 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 5.34 0.00 0.00 0.00 2.76 -1.92 -0.97 115.15 120.36 2wvz h HIS 599 Ca 0.71 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.88 2wvz h HIS 599 Cb 0.43 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.39 2wvz h HIS 599 CO 1.66 0.00 0.00 0.41 -1.30 0.00 0.00 177.93 178.70 2wvz n GLY 600 N -1.19 -0.85 3.11 5.26 0.00 -1.26 -4.76 105.19 105.50 2wvz n GLY 600 Ca -0.02 -0.13 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.78 0.85 0.28 1.61 2.47 -0.37 -4.09 114.94 113.91 2wvz s ASN 601 Ca 0.30 -0.85 0.03 0.00 0.42 0.00 0.00 52.86 52.76 2wvz s ASN 601 Cb 0.14 0.10 0.42 0.00 -1.45 0.00 0.00 41.25 40.46 2wvz s ASN 601 CO 0.23 -0.42 1.73 1.56 -3.72 0.00 0.00 177.10 176.48 2wvz h GLN 602 N 3.53 0.48 -0.35 0.43 7.50 -1.85 -3.29 115.11 121.55 2wvz h GLN 602 Ca -0.35 -0.18 0.03 0.00 0.50 0.00 0.00 58.65 58.66 2wvz h GLN 602 Cb 1.17 -0.03 -0.02 0.00 0.05 0.00 0.00 27.48 28.66 2wvz h GLN 602 CO 0.57 0.69 0.23 -1.35 -1.50 0.00 0.00 178.83 177.48 2wvz h PRO 603 N 0.42 0.33 -0.71 1.46 0.11 -1.91 -2.14 132.00 129.56 2wvz h PRO 603 Ca 0.06 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.15 2wvz h PRO 603 Cb 0.66 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.70 2wvz h PRO 603 CO 0.05 0.22 0.00 1.51 -0.21 0.00 0.00 178.00 179.57 2wvz n ILE 604 N -4.49 0.94 0.26 4.15 3.06 -1.24 -4.58 119.36 117.46 2wvz n ILE 604 Ca 0.03 -0.97 0.15 0.00 -2.50 0.00 0.00 62.75 59.46 2wvz n ILE 604 Cb 0.17 0.54 0.62 0.00 0.54 0.00 0.00 39.64 41.51 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 4.34 0.00 0.00 9.51 4.20 -1.55 -2.19 115.11 129.42 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 0.99 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.77 2wvz h GLN 605 CO 0.00 0.08 -1.44 -2.39 -0.67 0.00 0.00 178.83 174.41 2wvz n HIS 606 N -3.23 0.51 -0.35 2.96 1.44 -1.26 -4.56 115.22 110.73 2wvz n HIS 606 Ca 0.00 0.15 0.10 0.00 -2.01 0.00 0.00 57.72 55.96 2wvz n HIS 606 Cb 0.34 -0.73 0.21 0.00 0.12 0.00 0.00 29.99 29.93 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 0.00 -0.81 -1.40 -1.53 -1.70 -1.14 114.93 108.35 2wvz h MET 607 Ca 0.00 -0.00 0.10 0.00 -3.44 0.00 0.00 59.70 56.36 2wvz h MET 607 Cb 0.98 -0.00 -0.06 0.00 -0.55 0.00 0.00 31.60 31.98 2wvz h MET 607 CO 0.00 0.00 0.53 0.82 0.14 0.00 0.00 176.91 178.40 2wvz h ILE 608 N 0.00 0.93 0.00 1.77 2.04 -1.80 0.95 117.51 121.41 2wvz h ILE 608 Ca 0.53 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 66.13 2wvz h ILE 608 Cb 0.95 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2wvz h ILE 608 CO -0.97 0.13 -0.04 1.88 0.00 0.00 0.00 178.15 179.15 2wvz h TYR 609 N 0.73 0.00 -0.04 1.37 -1.99 -1.55 -2.00 116.97 113.51 2wvz h TYR 609 Ca 0.38 0.00 0.01 0.00 2.00 0.00 0.00 58.73 61.12 2wvz h TYR 609 Cb 0.48 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.21 2wvz h TYR 609 CO -0.00 0.04 0.03 -0.07 -0.00 0.00 0.00 178.16 178.16 2wvz h LEU 610 N 0.00 0.00 -1.83 3.88 3.38 -0.89 -0.60 115.31 119.25 2wvz h LEU 610 Ca -0.00 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.16 2wvz h LEU 610 Cb 0.29 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2wvz h LEU 610 CO 0.01 0.00 0.64 1.88 0.09 0.00 0.00 178.44 181.06 2wvz h TYR 611 N 0.00 0.00 -0.32 1.13 0.05 -1.51 0.20 116.97 116.52 2wvz h TYR 611 Ca 0.02 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.71 2wvz h TYR 611 Cb 0.08 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.80 2wvz h TYR 611 CO 0.00 0.00 -0.18 -0.44 -1.05 0.00 0.00 178.16 176.49 2wvz h ASP 612 N 0.00 0.59 1.46 3.88 5.19 -1.32 -1.02 116.42 125.19 2wvz h ASP 612 Ca 0.31 -0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.54 2wvz h ASP 612 Cb 1.59 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.94 2wvz h ASP 612 CO -0.00 0.78 0.00 1.88 -3.12 0.00 0.00 179.24 178.77 2wvz h TYR 613 N 0.53 0.00 -0.61 4.55 -1.99 -0.78 -2.44 116.97 116.24 2wvz h TYR 613 Ca 0.09 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.82 2wvz h TYR 613 Cb 0.61 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.34 2wvz h TYR 613 CO 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 178.16 178.18 2wvz n ALA 614 N -1.90 2.34 -1.64 3.88 0.00 -1.13 -4.94 120.51 117.11 2wvz n ALA 614 Ca 0.04 -1.23 -0.05 0.00 0.00 0.00 0.00 53.44 52.20 2wvz n ALA 614 Cb 0.41 -0.81 -0.01 0.00 0.00 0.00 0.00 19.45 19.04 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 1.39 0.45 2.60 0.00 0.00 -0.92 -4.90 105.19 103.82 2wvz n GLY 615 Ca 0.21 -0.76 -0.26 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.13 2.56 0.26 1.61 6.02 -0.40 -4.61 117.38 120.69 2wvz n GLN 616 Ca -0.05 -4.53 0.13 0.00 -0.01 0.00 0.00 57.00 52.54 2wvz n GLN 616 Cb 0.36 -2.12 0.73 0.00 1.02 0.00 0.00 30.24 30.23 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 3.54 0.00 -0.70 -1.09 0.13 -1.84 -1.72 132.00 130.32 2wvz h PRO 617 Ca 0.15 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2wvz h PRO 617 Cb 0.64 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.73 2wvz h PRO 617 CO 0.77 0.11 0.42 0.11 -0.23 0.00 0.00 178.00 179.19 2wvz h TRP 618 N 0.00 0.92 -0.35 1.56 0.09 -1.90 -0.65 115.95 115.62 2wvz h TRP 618 Ca -0.00 0.00 0.01 0.00 0.09 0.00 0.00 58.89 58.99 2wvz h TRP 618 Cb 0.32 -0.30 -0.02 0.00 0.08 0.00 0.00 29.16 29.24 2wvz h TRP 618 CO 0.00 0.62 0.22 0.87 0.09 0.00 0.00 178.44 180.24 2wvz h LYS 619 N 0.97 0.44 -0.88 0.12 1.57 -1.68 -0.70 116.57 116.40 2wvz h LYS 619 Ca 0.25 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 2wvz h LYS 619 Cb -0.03 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.14 2wvz h LYS 619 CO -0.05 0.29 0.50 0.00 -0.57 0.00 0.00 179.45 179.62 2wvz h ALA 620 N 1.14 1.13 -0.70 3.86 0.00 -1.48 -1.76 119.26 121.45 2wvz h ALA 620 Ca 0.13 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2wvz h ALA 620 Cb -0.03 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.37 2wvz h ALA 620 CO -0.04 0.62 0.46 1.96 0.00 0.00 0.00 179.25 182.24 2wvz h GLN 621 N 1.22 0.89 0.31 0.00 4.20 -0.32 0.15 115.11 121.55 2wvz h GLN 621 Ca 0.31 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.95 2wvz h GLN 621 Cb -0.00 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 27.58 2wvz h GLN 621 CO -0.05 0.59 -0.15 -0.92 -0.67 0.00 0.00 178.83 177.62 2wvz h TYR 622 N 0.91 -0.39 -0.61 2.96 3.20 -0.94 -2.78 116.97 119.32 2wvz h TYR 622 Ca 0.27 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.05 2wvz h TYR 622 Cb -0.06 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 2wvz h TYR 622 CO -0.03 -0.09 0.08 -1.49 -1.64 0.00 0.00 178.16 174.98 2wvz h TRP 623 N -0.67 1.08 -0.75 -3.82 4.06 -1.15 -1.97 115.95 112.73 2wvz h TRP 623 Ca -0.04 -0.15 -0.02 0.00 2.06 0.00 0.00 58.89 60.74 2wvz h TRP 623 Cb 0.47 -0.30 -0.04 0.00 -1.00 0.00 0.00 29.16 28.30 2wvz h TRP 623 CO 0.01 0.93 0.39 -0.07 -3.56 0.00 0.00 178.44 176.13 2wvz h LEU 624 N 0.95 0.97 -0.96 -4.49 3.38 -0.78 -1.61 115.31 112.77 2wvz h LEU 624 Ca 0.19 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2wvz h LEU 624 Cb 0.45 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2wvz h LEU 624 CO 0.02 0.81 0.29 -0.09 0.09 0.00 0.00 178.44 179.55 2wvz h ARG 625 N 1.05 1.04 -0.89 1.13 9.65 -1.29 -0.49 114.38 124.58 2wvz h ARG 625 Ca 0.26 -0.17 0.04 0.00 -1.10 0.00 0.00 59.98 59.01 2wvz h ARG 625 Cb 0.08 -0.18 -0.05 0.00 -1.39 0.00 0.00 29.97 28.43 2wvz h ARG 625 CO -0.04 0.84 0.57 1.96 2.80 0.00 0.00 179.97 186.10 2wvz h GLN 626 N 1.02 1.07 -0.01 0.20 1.08 -0.61 -1.69 115.11 116.16 2wvz h GLN 626 Ca 0.24 -0.06 -0.11 0.00 -1.45 0.00 0.00 58.65 57.26 2wvz h GLN 626 Cb 0.19 -0.24 0.01 0.00 -0.05 0.00 0.00 27.48 27.38 2wvz h GLN 626 CO -0.02 0.71 -0.43 0.28 -0.95 0.00 0.00 178.83 178.42 2wvz h VAL 627 N 1.11 1.47 -0.85 -0.54 2.07 -0.94 -0.72 116.25 117.85 2wvz h VAL 627 Ca 0.36 -1.99 0.11 0.00 0.82 0.00 0.00 66.70 66.00 2wvz h VAL 627 Cb 0.01 2.63 -0.08 0.00 -1.52 0.00 0.00 31.29 32.33 2wvz h VAL 627 CO -0.12 0.56 0.48 0.24 0.02 0.00 0.00 177.57 178.75 2wvz h MET 628 N -0.26 0.74 0.18 1.57 2.86 -1.10 -0.76 114.93 118.15 2wvz h MET 628 Ca -0.05 -0.04 -0.31 0.00 -2.06 0.00 0.00 59.70 57.24 2wvz h MET 628 Cb 1.15 -0.17 0.03 0.00 0.06 0.00 0.00 31.60 32.68 2wvz h MET 628 CO 0.09 0.49 -1.34 -0.44 1.06 0.00 0.00 176.91 176.76 2wvz h ASP 629 N 0.76 0.75 0.00 1.22 3.32 -1.23 -3.37 116.42 117.87 2wvz h ASP 629 Ca 0.43 -0.76 -0.36 0.00 0.02 0.00 0.00 57.03 56.35 2wvz h ASP 629 Cb 0.47 -0.24 -0.07 0.00 0.22 0.00 0.00 39.33 39.71 2wvz h ASP 629 CO -0.28 1.58 -2.38 0.54 -1.72 0.00 0.00 179.24 176.98 2wvz n ARG 630 N -3.70 0.73 -0.07 3.56 1.74 -0.28 -4.49 116.66 114.15 2wvz n ARG 630 Ca -0.14 0.06 0.12 0.00 -0.77 0.00 0.00 57.85 57.12 2wvz n ARG 630 Cb 1.04 -1.50 0.35 0.00 -1.02 0.00 0.00 32.46 31.33 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 -2.96 1.93 -3.69 5.56 2.81 -0.30 -4.72 117.12 115.75 2wvz n MET 631 Ca -0.38 -1.38 -0.23 0.00 -1.81 0.00 0.00 57.70 53.91 2wvz n MET 631 Cb 1.06 -1.44 -0.18 0.00 -0.71 0.00 0.00 33.22 31.95 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 -1.81 0.34 0.30 2.03 1.51 -1.25 -3.31 117.35 115.16 2wvz s TYR 632 Ca 0.34 -0.08 0.11 0.00 -1.01 0.00 0.00 57.07 56.44 2wvz s TYR 632 Cb 0.20 -0.66 -0.06 0.00 -0.11 0.00 0.00 41.96 41.33 2wvz s TYR 632 CO 0.29 -0.33 -0.16 0.95 -1.11 0.00 0.00 175.55 175.20 2wvz s THR 633 N 2.08 2.42 -2.07 -0.71 -4.23 -0.41 -4.78 115.64 107.93 2wvz s THR 633 Ca 0.04 -2.32 0.30 0.00 -1.18 0.00 0.00 61.69 58.52 2wvz s THR 633 Cb -0.13 -2.44 0.66 0.00 1.34 0.00 0.00 72.50 71.92 2wvz s THR 633 CO -0.05 -0.33 1.96 -0.81 -0.54 0.00 0.00 174.62 174.85 2wvz n PRO 634 N -0.69 1.14 -1.01 3.99 -0.04 -1.26 -4.27 135.00 132.86 2wvz n PRO 634 Ca -0.05 -0.40 -0.17 0.00 -0.04 0.00 0.00 63.50 62.85 2wvz n PRO 634 Cb 0.61 -1.49 0.12 0.00 -0.04 0.00 0.00 33.50 32.70 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 1.14 -1.51 0.24 0.55 0.00 -1.26 -4.73 105.19 99.63 2wvz n GLY 635 Ca 0.20 -1.66 0.10 0.00 0.00 0.00 0.00 46.02 44.65 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 0.00 -1.68 1.61 0.11 -1.92 -2.05 132.00 128.06 2wvz h PRO 636 Ca -0.24 0.00 -0.74 0.00 0.11 0.00 0.00 66.00 65.13 2wvz h PRO 636 Cb 0.67 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 31.51 2wvz h PRO 636 CO 0.17 0.17 0.99 -0.40 -0.21 0.00 0.00 178.00 178.72 2wvz n ASP 637 N -3.73 7.56 0.14 -2.05 3.85 -1.26 -0.01 116.55 121.04 2wvz n ASP 637 Ca -0.02 -3.82 0.12 0.00 -0.71 0.00 0.00 54.79 50.37 2wvz n ASP 637 Cb 0.28 -1.03 0.28 0.00 -1.35 0.00 0.00 41.12 39.30 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 2.68 0.00 -2.54 6.12 0.00 -1.37 -3.46 103.07 104.50 2wvz h GLY 638 Ca 0.58 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 47.48 2wvz h GLY 638 CO 1.48 0.00 -0.27 -0.19 0.00 0.00 0.00 176.54 177.56 2wvz s TYR 639 N -3.16 2.98 -1.46 5.60 1.51 0.00 -1.29 117.35 121.53 2wvz s TYR 639 Ca 0.08 -0.25 0.19 0.00 -1.01 0.00 0.00 57.07 56.09 2wvz s TYR 639 Cb 0.10 -2.23 0.63 0.00 -0.11 0.00 0.00 41.96 40.34 2wvz s TYR 639 CO 0.64 -0.27 1.53 0.00 -1.11 0.00 0.00 175.55 176.35 2wvz n GLY 641 N 1.24 -1.04 3.56 0.00 0.00 -1.24 -4.50 105.19 103.20 2wvz n GLY 641 Ca 0.23 -1.10 -0.46 0.00 0.00 0.00 0.00 46.02 44.69 2wvz n GLY 641 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wvz n ASP 642 N 0.00 0.86 0.10 1.61 9.92 -1.26 -3.12 116.55 124.67 2wvz n ASP 642 Ca 0.00 1.17 -0.16 0.00 -0.53 0.00 0.00 54.79 55.27 2wvz n ASP 642 Cb 0.00 -1.22 -0.13 0.00 -0.64 0.00 0.00 41.12 39.13 2wvz n ASP 642 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 2wvz h GLU 643 N 1.95 0.30 -5.75 -1.24 4.22 -1.11 -3.44 114.58 109.50 2wvz h GLU 643 Ca -0.38 -0.48 -0.33 0.00 0.08 0.00 0.00 59.36 58.25 2wvz h GLU 643 Cb 1.36 0.17 0.15 0.00 0.50 0.00 0.00 28.75 30.93 2wvz h GLU 643 CO 0.61 1.21 -0.86 -0.25 -2.18 0.00 0.00 179.01 177.54 2wvz n ASP 644 N -3.57 -4.83 -1.81 1.04 8.00 -1.26 -2.54 116.55 111.59 2wvz n ASP 644 Ca -0.08 -0.78 -0.19 0.00 0.71 0.00 0.00 54.79 54.44 2wvz n ASP 644 Cb 1.00 -4.61 -0.04 0.00 -0.02 0.00 0.00 41.12 37.45 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 -3.06 -5.35 0.00 -2.24 4.13 -1.26 -2.54 115.26 104.94 2wvz n ASN 645 Ca -0.14 0.21 0.00 0.00 1.68 0.00 0.00 54.58 56.33 2wvz n ASN 645 Cb 0.63 -4.44 0.00 0.00 -1.54 0.00 0.00 39.78 34.42 2wvz n ASN 645 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wvz n GLY 646 N -0.85 1.94 0.10 7.41 0.00 -1.23 -4.49 105.19 108.06 2wvz n GLY 646 Ca -0.21 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.70 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 0.03 0.21 0.00 1.61 5.75 -1.46 1.05 115.11 122.29 2wvz h GLN 647 Ca 0.00 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.39 2wvz h GLN 647 Cb 0.00 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.50 2wvz h GLN 647 CO 0.00 0.28 -0.34 1.15 -2.65 0.00 0.00 178.83 177.27 2wvz h THR 648 N 0.10 0.74 0.01 2.39 2.02 -1.75 -1.42 112.91 114.99 2wvz h THR 648 Ca 0.05 -1.50 -0.06 0.00 0.77 0.00 0.00 66.41 65.67 2wvz h THR 648 Cb 0.14 1.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 2wvz h THR 648 CO -0.01 0.33 -0.23 0.28 0.37 0.00 0.00 175.52 176.27 2wvz h SER 649 N 0.00 0.18 0.18 4.18 0.02 -1.55 -3.23 113.55 113.32 2wvz h SER 649 Ca -0.00 -0.81 -0.03 0.00 -0.84 0.00 0.00 61.79 60.10 2wvz h SER 649 Cb 0.94 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.42 2wvz h SER 649 CO 0.04 0.98 -0.15 0.00 -1.14 0.00 0.00 176.83 176.56 2wvz h ALA 650 N 0.21 1.68 -0.42 3.77 0.00 0.12 -1.44 119.26 123.19 2wvz h ALA 650 Ca -0.03 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.79 2wvz h ALA 650 Cb 1.02 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 2wvz h ALA 650 CO 0.04 0.19 0.15 2.35 0.00 0.00 0.00 179.25 181.98 2wvz h TRP 651 N 0.00 0.26 -0.40 0.00 7.01 -1.29 -0.33 115.95 121.20 2wvz h TRP 651 Ca -0.00 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 60.93 2wvz h TRP 651 Cb 0.28 -0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.27 2wvz h TRP 651 CO 0.00 0.10 -0.11 -0.92 -2.79 0.00 0.00 178.44 174.72 2wvz h TYR 652 N 0.31 0.77 -0.46 2.65 5.03 -1.36 -0.67 116.97 123.24 2wvz h TYR 652 Ca 0.19 -0.13 -0.03 0.00 2.58 0.00 0.00 58.73 61.34 2wvz h TYR 652 Cb 0.18 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.24 2wvz h TYR 652 CO -0.15 0.78 0.16 0.28 -1.32 0.00 0.00 178.16 177.91 2wvz h VAL 653 N 0.64 1.22 0.20 1.81 2.07 -0.63 -1.36 116.25 120.20 2wvz h VAL 653 Ca 0.11 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 2wvz h VAL 653 Cb 0.56 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2wvz h VAL 653 CO 0.03 0.25 -0.10 -0.26 0.02 0.00 0.00 177.57 177.52 2wvz h PHE 654 N 0.60 -0.25 -0.59 1.57 0.04 -0.99 -2.82 116.94 114.50 2wvz h PHE 654 Ca 0.15 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.90 2wvz h PHE 654 Cb 0.24 0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.44 2wvz h PHE 654 CO 0.01 0.10 0.30 0.77 -0.60 0.00 0.00 178.31 178.88 2wvz h SER 655 N -0.63 0.73 0.18 2.17 0.02 -1.07 0.11 113.55 115.07 2wvz h SER 655 Ca -0.03 -0.06 -0.09 0.00 -0.84 0.00 0.00 61.79 60.77 2wvz h SER 655 Cb 0.46 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2wvz h SER 655 CO 0.05 0.61 -0.33 0.00 -1.14 0.00 0.00 176.83 176.02 2wvz h ALA 656 N 1.51 1.24 -0.41 3.77 0.00 -1.28 -2.25 119.26 121.83 2wvz h ALA 656 Ca 0.21 -0.35 -0.15 0.00 0.00 0.00 0.00 54.91 54.61 2wvz h ALA 656 Cb 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2wvz h ALA 656 CO -0.03 0.52 -0.34 -0.07 0.00 0.00 0.00 179.25 179.33 2wvz h LEU 657 N 0.20 1.01 0.00 0.00 3.38 -0.60 0.45 115.31 119.75 2wvz h LEU 657 Ca 0.03 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2wvz h LEU 657 Cb 0.68 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2wvz h LEU 657 CO 0.05 1.24 0.00 0.61 0.09 0.00 0.00 178.44 180.43 2wvz n GLY 658 N 0.06 1.03 3.47 0.83 0.00 -0.16 -4.40 105.19 106.03 2wvz n GLY 658 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.28 -0.44 -0.10 1.61 -0.12 -1.13 -0.65 117.98 115.87 2wvz s PHE 659 Ca 0.00 0.32 -0.10 0.00 -0.05 0.00 0.00 56.93 57.10 2wvz s PHE 659 Cb 0.00 0.54 0.03 0.00 -0.63 0.00 0.00 43.02 42.95 2wvz s PHE 659 CO 0.00 -0.66 0.28 -0.47 -0.05 0.00 0.00 175.22 174.32 2wvz s TYR 660 N -3.19 -0.30 -1.32 3.49 6.14 -0.04 -4.01 117.35 118.11 2wvz s TYR 660 Ca 0.02 0.74 -0.16 0.00 0.64 0.00 0.00 57.07 58.31 2wvz s TYR 660 Cb -0.01 0.10 0.08 0.00 0.42 0.00 0.00 41.96 42.56 2wvz s TYR 660 CO -0.09 -0.15 1.81 -0.35 0.64 0.00 0.00 175.55 177.41 2wvz n PRO 661 N 2.95 3.17 -0.17 4.97 -0.04 -1.26 0.50 135.00 145.12 2wvz n PRO 661 Ca -0.13 -3.22 0.01 0.00 -0.04 0.00 0.00 63.50 60.12 2wvz n PRO 661 Cb 0.58 -3.37 0.28 0.00 -0.04 0.00 0.00 33.50 30.95 2wvz n PRO 661 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2wvz h VAL 662 N 5.04 1.18 -2.59 0.52 2.07 -1.87 -3.31 116.25 117.30 2wvz h VAL 662 Ca 0.46 -0.33 -0.60 0.00 0.82 0.00 0.00 66.70 67.04 2wvz h VAL 662 Cb 0.81 0.19 -0.40 0.00 -1.52 0.00 0.00 31.29 30.37 2wvz h VAL 662 CO 1.53 0.17 -0.77 0.00 0.02 0.00 0.00 177.57 178.52 2wvz n PRO 664 N 2.02 1.13 0.00 0.00 -0.02 -1.25 -1.28 135.00 135.60 2wvz n PRO 664 Ca 0.25 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 2wvz n PRO 664 Cb 0.42 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 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 1.34 2.84 3.96 -1.23 0.00 -1.26 -4.87 105.19 105.96 2wvz n GLY 665 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.71 3.63 -0.82 2.61 -4.23 -0.41 -4.91 115.64 108.80 2wvz s THR 666 Ca 0.00 -0.54 0.09 0.00 -1.18 0.00 0.00 61.69 60.06 2wvz s THR 666 Cb 0.00 -3.34 0.46 0.00 1.34 0.00 0.00 72.50 70.96 2wvz s THR 666 CO 0.00 -0.24 1.24 -0.90 -0.54 0.00 0.00 174.62 174.18 2wvz n ASP 667 N -2.15 3.51 -4.70 3.99 5.75 -1.26 -4.98 116.55 116.70 2wvz n ASP 667 Ca 0.03 -2.45 -0.30 0.00 -0.01 0.00 0.00 54.79 52.06 2wvz n ASP 667 Cb 0.58 -0.55 -0.08 0.00 -1.03 0.00 0.00 41.12 40.04 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 -1.92 2.62 -0.15 0.11 2.02 -1.26 -0.30 118.70 119.82 2wvz s GLU 668 Ca 0.31 -0.80 0.00 0.00 0.02 0.00 0.00 54.97 54.51 2wvz s GLU 668 Cb 0.23 -2.58 0.02 0.00 0.10 0.00 0.00 34.13 31.90 2wvz s GLU 668 CO 0.11 0.55 -0.13 0.71 0.02 0.00 0.00 175.26 176.52 2wvz s TYR 669 N -1.32 2.13 0.30 1.61 1.51 -0.25 -4.52 117.35 116.82 2wvz s TYR 669 Ca 0.26 -1.21 -0.28 0.00 -1.01 0.00 0.00 57.07 54.83 2wvz s TYR 669 Cb -0.12 -1.57 -0.09 0.00 -0.11 0.00 0.00 41.96 40.07 2wvz s TYR 669 CO 0.19 -0.66 1.05 0.08 -1.11 0.00 0.00 175.55 175.09 2wvz s VAL 670 N 1.50 3.69 0.02 0.71 1.01 0.18 -1.38 120.40 126.13 2wvz s VAL 670 Ca 0.05 1.59 -0.30 0.00 0.00 0.00 0.00 61.98 63.31 2wvz s VAL 670 Cb -0.13 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 2wvz s VAL 670 CO -0.10 0.29 1.00 -0.32 0.00 0.00 0.00 175.10 175.97 2wvz s MET 671 N -1.67 4.56 0.00 2.72 1.75 -0.17 -0.86 119.30 125.63 2wvz s MET 671 Ca 0.47 1.46 0.00 0.00 -1.25 0.00 0.00 55.69 56.37 2wvz s MET 671 Cb -0.28 -3.44 0.00 0.00 2.84 0.00 0.00 34.83 33.95 2wvz s MET 671 CO 0.35 -0.04 0.00 0.41 -0.65 0.00 0.00 175.02 175.09 2wvz n GLY 672 N 2.85 1.37 3.12 2.11 0.00 0.17 -4.93 105.19 109.89 2wvz n GLY 672 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 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 2.60 -0.01 0.41 2.61 -1.32 -1.26 -4.67 115.64 114.00 2wvz s THR 673 Ca 0.00 0.05 -0.23 0.00 -1.21 0.00 0.00 61.69 60.30 2wvz s THR 673 Cb 0.00 -0.38 -0.10 0.00 -1.51 0.00 0.00 72.50 70.51 2wvz s THR 673 CO 0.00 0.02 0.98 -2.16 -2.21 0.00 0.00 174.62 171.25 2wvz s PRO 674 N 0.50 4.24 -0.12 7.08 0.04 -1.26 -4.40 135.00 141.09 2wvz s PRO 674 Ca -0.03 1.28 0.13 0.00 0.04 0.00 0.00 61.00 62.42 2wvz s PRO 674 Cb -0.04 -2.39 -0.24 0.00 0.04 0.00 0.00 34.50 31.87 2wvz s PRO 674 CO -0.03 -0.04 0.38 -0.11 0.04 0.00 0.00 177.00 177.24 2wvz n LEU 675 N -0.28 0.79 -4.95 -3.56 7.94 0.15 -4.97 117.00 112.12 2wvz n LEU 675 Ca 0.06 0.22 -0.20 0.00 -1.11 0.00 0.00 56.01 54.98 2wvz n LEU 675 Cb 0.52 0.14 -0.02 0.00 0.53 0.00 0.00 43.42 44.59 2wvz n LEU 675 CO 0.41 0.49 -0.01 -0.36 -1.11 0.00 0.00 177.39 176.81 2wvz s PHE 676 N -2.55 3.16 0.20 1.96 0.08 -1.26 -4.87 117.98 114.69 2wvz s PHE 676 Ca -0.10 -0.18 -0.08 0.00 0.12 0.00 0.00 56.93 56.70 2wvz s PHE 676 Cb 0.07 -1.81 0.12 0.00 -0.57 0.00 0.00 43.02 40.83 2wvz s PHE 676 CO 0.81 0.17 1.69 0.87 -0.10 0.00 0.00 175.22 178.67 2wvz h LYS 677 N 1.07 1.09 -3.42 0.44 1.57 -1.35 -3.41 116.57 112.55 2wvz h LYS 677 Ca -0.47 -0.30 -0.24 0.00 -1.87 0.00 0.00 60.65 57.77 2wvz h LYS 677 Cb 1.25 -0.13 -0.30 0.00 0.08 0.00 0.00 32.23 33.13 2wvz h LYS 677 CO 0.56 1.00 -0.64 0.21 -0.57 0.00 0.00 179.45 180.02 2wvz s LYS 678 N -5.17 0.07 -0.03 3.15 2.20 -0.97 -0.28 119.74 118.71 2wvz s LYS 678 Ca -0.12 0.23 0.03 0.00 -0.36 0.00 0.00 55.97 55.75 2wvz s LYS 678 Cb 0.14 -0.10 0.00 0.00 -1.51 0.00 0.00 37.83 36.37 2wvz s LYS 678 CO 0.85 -0.10 -0.10 0.00 -0.36 0.00 0.00 175.35 175.63 2wvz s ALA 679 N 0.69 0.98 -0.20 3.13 0.00 -0.52 -1.31 121.76 124.52 2wvz s ALA 679 Ca -0.05 -0.39 -0.01 0.00 0.00 0.00 0.00 51.96 51.51 2wvz s ALA 679 Cb -0.07 -0.35 0.05 0.00 0.00 0.00 0.00 23.12 22.75 2wvz s ALA 679 CO -0.03 0.16 -0.03 0.99 0.00 0.00 0.00 175.76 176.86 2wvz s THR 680 N 0.18 1.10 -0.11 0.00 2.01 0.16 -0.05 115.64 118.93 2wvz s THR 680 Ca -0.03 -0.85 -0.17 0.00 0.31 0.00 0.00 61.69 60.95 2wvz s THR 680 Cb -0.09 -1.41 -0.05 0.00 0.01 0.00 0.00 72.50 70.96 2wvz s THR 680 CO 0.01 -0.07 0.43 -0.76 -0.69 0.00 0.00 174.62 173.55 2wvz s LEU 681 N 1.60 4.30 -0.30 4.42 1.43 -0.02 -1.14 118.68 128.97 2wvz s LEU 681 Ca -0.02 0.78 -0.05 0.00 -1.03 0.00 0.00 54.13 53.80 2wvz s LEU 681 Cb -0.17 -2.62 0.02 0.00 0.03 0.00 0.00 46.19 43.45 2wvz s LEU 681 CO -0.07 0.07 0.06 -1.00 0.23 0.00 0.00 176.35 175.63 2wvz s HIS 682 N 0.35 3.18 0.42 0.29 3.76 0.53 -1.23 115.29 122.58 2wvz s HIS 682 Ca 0.24 -1.29 -0.07 0.00 -0.15 0.00 0.00 55.06 53.79 2wvz s HIS 682 Cb -0.15 -2.21 -0.05 0.00 1.11 0.00 0.00 32.58 31.28 2wvz s HIS 682 CO 0.10 -0.67 0.73 -0.06 -0.85 0.00 0.00 174.74 173.99 2wvz s PHE 683 N 1.42 3.51 0.57 1.40 0.08 -0.63 -4.81 117.98 119.52 2wvz s PHE 683 Ca 0.00 0.84 0.27 0.00 0.12 0.00 0.00 56.93 58.17 2wvz s PHE 683 Cb -0.18 -2.30 1.57 0.00 -0.57 0.00 0.00 43.02 41.54 2wvz s PHE 683 CO 0.01 -0.13 2.08 0.93 -0.10 0.00 0.00 175.22 178.01 2wvz h GLU 684 N 0.85 0.00 0.00 0.44 5.08 -1.86 -0.87 114.58 118.22 2wvz h GLU 684 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2wvz h GLU 684 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2wvz h GLU 684 CO 0.63 0.00 0.00 0.27 -1.00 0.00 0.00 179.01 178.91 2wvz n ASN 685 N -3.95 0.00 0.00 1.42 2.04 -1.26 -4.87 115.26 108.64 2wvz n ASN 685 Ca 0.03 -0.32 0.00 0.00 -0.44 0.00 0.00 54.58 53.85 2wvz n ASN 685 Cb 0.37 -0.19 0.00 0.00 -2.53 0.00 0.00 39.78 37.43 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 0.75 0.25 3.91 4.83 0.00 -0.33 -5.07 105.19 109.53 2wvz n GLY 686 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.07 5.65 0.11 1.61 0.01 -1.26 -4.87 114.94 114.11 2wvz s ASN 687 Ca 0.00 0.83 0.05 0.00 -0.71 0.00 0.00 52.86 53.02 2wvz s ASN 687 Cb 0.00 -1.82 -0.04 0.00 0.41 0.00 0.00 41.25 39.81 2wvz s ASN 687 CO 0.00 -1.06 -0.12 -0.44 -1.51 0.00 0.00 177.10 173.97 2wvz s SER 688 N -4.29 1.76 -0.10 -1.22 0.01 -1.26 -1.61 113.70 106.99 2wvz s SER 688 Ca 0.54 -0.81 0.01 0.00 1.31 0.00 0.00 55.95 57.00 2wvz s SER 688 Cb -0.11 -0.04 0.02 0.00 0.21 0.00 0.00 66.02 66.11 2wvz s SER 688 CO 0.46 -0.19 -0.11 -0.22 0.41 0.00 0.00 173.24 173.60 2wvz s LEU 689 N -2.44 1.45 -0.25 2.44 2.96 -0.36 -0.82 118.68 121.66 2wvz s LEU 689 Ca 0.07 -0.33 -0.10 0.00 -0.22 0.00 0.00 54.13 53.55 2wvz s LEU 689 Cb -0.04 -0.89 -0.05 0.00 0.50 0.00 0.00 46.19 45.71 2wvz s LEU 689 CO 0.02 -0.05 0.15 -0.69 -1.32 0.00 0.00 176.35 174.46 2wvz s VAL 690 N 1.25 5.15 -0.43 1.68 1.01 -0.12 -0.84 120.40 128.09 2wvz s VAL 690 Ca -0.03 0.11 -0.11 0.00 0.00 0.00 0.00 61.98 61.95 2wvz s VAL 690 Cb -0.14 -3.41 0.08 0.00 0.00 0.00 0.00 36.38 32.91 2wvz s VAL 690 CO -0.04 0.33 0.30 -0.63 0.00 0.00 0.00 175.10 175.06 2wvz s ILE 691 N 1.24 4.48 -0.45 2.22 1.01 0.93 -0.25 121.20 130.38 2wvz s ILE 691 Ca 0.07 -1.32 -0.13 0.00 0.00 0.00 0.00 60.65 59.27 2wvz s ILE 691 Cb -0.14 -3.73 0.08 0.00 0.01 0.00 0.00 42.46 38.67 2wvz s ILE 691 CO 0.06 -0.53 0.33 -0.62 0.00 0.00 0.00 174.94 174.18 2wvz s ASP 692 N 2.25 5.92 -0.71 3.58 -1.08 0.30 -1.44 116.67 125.50 2wvz s ASP 692 Ca 0.03 -1.41 0.04 0.00 -0.52 0.00 0.00 52.55 50.70 2wvz s ASP 692 Cb -0.23 -2.09 0.24 0.00 -1.46 0.00 0.00 42.92 39.37 2wvz s ASP 692 CO 0.03 -0.60 0.78 0.00 0.52 0.00 0.00 175.17 175.91 2wvz n ALA 693 N 5.07 4.07 -0.24 3.66 0.00 0.62 0.14 120.51 133.83 2wvz n ALA 693 Ca -0.11 -4.73 0.04 0.00 0.00 0.00 0.00 53.44 48.63 2wvz n ALA 693 Cb 0.43 -1.10 0.15 0.00 0.00 0.00 0.00 19.45 18.92 2wvz n ALA 693 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2wvz h PRO 694 N 4.58 0.14 -0.44 0.00 0.11 -1.76 -0.44 132.00 134.20 2wvz h PRO 694 Ca 0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2wvz h PRO 694 Cb 0.68 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.76 2wvz h PRO 694 CO 0.87 0.09 0.00 -1.71 -0.21 0.00 0.00 178.00 177.04 2wvz n ASN 695 N -5.28 1.98 -4.74 -2.05 5.15 -1.26 -4.90 115.26 104.16 2wvz n ASN 695 Ca 0.12 -2.10 -0.39 0.00 -0.60 0.00 0.00 54.58 51.61 2wvz n ASN 695 Cb 0.43 -0.30 0.04 0.00 -0.53 0.00 0.00 39.78 39.42 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 0.36 2.72 -3.37 1.20 2.85 -0.17 -4.76 115.26 114.08 2wvz n ASN 696 Ca 0.11 0.99 -0.05 0.00 -0.11 0.00 0.00 54.58 55.52 2wvz n ASN 696 Cb 0.36 -1.57 0.01 0.00 1.24 0.00 0.00 39.78 39.81 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 -0.86 -0.05 0.36 1.20 1.04 -1.24 -4.86 113.70 109.29 2wvz s SER 697 Ca 0.70 -0.73 0.09 0.00 0.48 0.00 0.00 55.95 56.50 2wvz s SER 697 Cb -0.42 0.60 0.83 0.00 0.10 0.00 0.00 66.02 67.12 2wvz s SER 697 CO 0.50 -1.17 1.88 0.74 0.98 0.00 0.00 173.24 176.18 2wvz h THR 698 N 2.00 0.85 0.04 2.02 2.02 -1.95 -2.86 112.91 115.03 2wvz h THR 698 Ca -0.27 -0.23 -0.27 0.00 0.77 0.00 0.00 66.41 66.40 2wvz h THR 698 Cb 1.23 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 2wvz h THR 698 CO 0.34 0.12 -1.42 -0.33 0.37 0.00 0.00 175.52 174.60 2wvz h GLU 699 N 0.68 0.08 -3.64 6.66 3.07 -1.97 -3.42 114.58 116.04 2wvz h GLU 699 Ca 0.43 -0.14 -0.80 0.00 -0.50 0.00 0.00 59.36 58.35 2wvz h GLU 699 Cb 0.68 0.05 -0.27 0.00 -0.84 0.00 0.00 28.75 28.37 2wvz h GLU 699 CO -0.19 0.87 0.34 -0.80 -1.40 0.00 0.00 179.01 177.83 2wvz s ASN 700 N -6.59 7.14 0.00 1.42 0.02 -1.08 -4.24 114.94 111.61 2wvz s ASN 700 Ca -0.04 -3.34 0.08 0.00 -1.02 0.00 0.00 52.86 48.54 2wvz s ASN 700 Cb 0.08 -2.21 0.10 0.00 0.02 0.00 0.00 41.25 39.25 2wvz s ASN 700 CO 0.83 -0.37 0.85 2.22 0.02 0.00 0.00 177.10 180.65 2wvz n PHE 701 N 3.06 0.07 -3.07 2.20 1.16 -1.10 -3.73 117.46 116.06 2wvz n PHE 701 Ca 0.21 -0.11 -0.31 0.00 -1.87 0.00 0.00 57.45 55.37 2wvz n PHE 701 Cb 0.41 -0.01 -0.04 0.00 -1.61 0.00 0.00 39.48 38.24 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 -0.75 3.44 -0.31 2.97 2.02 -0.60 -4.64 117.35 119.49 2wvz s TYR 702 Ca 0.11 1.00 -0.11 0.00 -0.37 0.00 0.00 57.07 57.70 2wvz s TYR 702 Cb 0.07 -2.39 -0.03 0.00 -0.40 0.00 0.00 41.96 39.22 2wvz s TYR 702 CO 0.10 0.03 0.19 0.42 -1.57 0.00 0.00 175.55 174.73 2wvz s ILE 703 N -2.16 5.05 0.01 2.71 1.01 -1.26 -1.21 121.20 125.35 2wvz s ILE 703 Ca 0.50 -0.15 0.11 0.00 0.00 0.00 0.00 60.65 61.11 2wvz s ILE 703 Cb -0.10 -3.52 -0.19 0.00 0.01 0.00 0.00 42.46 38.66 2wvz s ILE 703 CO 0.26 0.11 1.02 -0.78 0.00 0.00 0.00 174.94 175.56 2wvz h ASP 704 N 8.40 0.00 -4.38 3.58 3.58 -0.96 -3.41 116.42 123.24 2wvz h ASP 704 Ca -0.33 0.00 0.28 0.00 0.42 0.00 0.00 57.03 57.39 2wvz h ASP 704 Cb 1.17 0.00 -0.18 0.00 1.72 0.00 0.00 39.33 42.03 2wvz h ASP 704 CO 0.60 0.92 0.84 -0.94 -2.88 0.00 0.00 179.24 177.78 2wvz s SER 705 N -6.38 -0.11 0.02 2.28 1.04 -1.24 -4.93 113.70 104.38 2wvz s SER 705 Ca -0.01 -0.01 0.01 0.00 0.48 0.00 0.00 55.95 56.41 2wvz s SER 705 Cb 0.09 0.12 -0.01 0.00 0.10 0.00 0.00 66.02 66.32 2wvz s SER 705 CO 0.81 -0.20 -0.04 -0.04 0.98 0.00 0.00 173.24 174.75 2wvz s MET 706 N -2.35 0.32 0.01 4.02 -1.94 -1.26 -1.20 119.30 116.89 2wvz s MET 706 Ca 0.10 -0.47 0.05 0.00 -1.71 0.00 0.00 55.69 53.66 2wvz s MET 706 Cb -0.00 -0.08 -0.02 0.00 2.01 0.00 0.00 34.83 36.74 2wvz s MET 706 CO -0.04 0.01 -0.14 -1.54 -0.01 0.00 0.00 175.02 173.29 2wvz s SER 707 N -1.02 1.67 -0.46 3.03 1.04 -0.32 -0.60 113.70 117.04 2wvz s SER 707 Ca -0.09 -0.35 -0.02 0.00 0.48 0.00 0.00 55.95 55.98 2wvz s SER 707 Cb -0.07 -0.15 0.12 0.00 0.10 0.00 0.00 66.02 66.02 2wvz s SER 707 CO -0.00 0.11 0.24 0.12 0.98 0.00 0.00 173.24 174.69 2wvz s PHE 708 N -0.56 3.54 -1.20 5.02 2.19 0.10 -0.67 117.98 126.41 2wvz s PHE 708 Ca 0.04 -2.60 -0.01 0.00 0.33 0.00 0.00 56.93 54.69 2wvz s PHE 708 Cb -0.06 -3.16 -0.01 0.00 -1.31 0.00 0.00 43.02 38.47 2wvz s PHE 708 CO 0.00 -0.93 0.92 0.09 1.83 0.00 0.00 175.22 177.13 2wvz n ASN 709 N 4.21 -2.63 0.00 6.13 5.03 0.99 -2.90 115.26 126.10 2wvz n ASN 709 Ca 0.01 -0.69 0.00 0.00 0.87 0.00 0.00 54.58 54.78 2wvz n ASN 709 Cb 0.40 -4.87 0.00 0.00 -1.02 0.00 0.00 39.78 34.29 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 -1.25 2.34 3.73 7.41 0.00 -1.26 -5.01 105.19 111.14 2wvz n GLY 710 Ca -0.25 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.80 3.25 0.34 4.61 0.00 -1.14 -4.99 121.76 123.02 2wvz s ALA 711 Ca 0.00 0.61 -0.28 0.00 0.00 0.00 0.00 51.96 52.29 2wvz s ALA 711 Cb 0.00 -3.31 -0.12 0.00 0.00 0.00 0.00 23.12 19.69 2wvz s ALA 711 CO 0.00 -0.11 1.38 -3.47 0.00 0.00 0.00 175.76 173.56 2wvz n ASP 712 N 3.00 3.12 -3.61 0.00 2.03 -1.26 0.02 116.55 119.85 2wvz n ASP 712 Ca 0.03 1.20 -0.29 0.00 0.52 0.00 0.00 54.79 56.25 2wvz n ASP 712 Cb 0.49 -1.52 -0.13 0.00 -0.72 0.00 0.00 41.12 39.23 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 -0.90 1.29 -2.49 -0.67 5.65 0.23 -4.75 115.29 113.65 2wvz s HIS 713 Ca 0.57 -1.83 0.23 0.00 0.25 0.00 0.00 55.06 54.28 2wvz s HIS 713 Cb -0.55 -1.40 0.58 0.00 -1.18 0.00 0.00 32.58 30.03 2wvz s HIS 713 CO 0.60 -0.82 1.47 0.25 -0.65 0.00 0.00 174.74 175.59 2wvz n THR 714 N 4.18 0.25 -2.51 0.89 -2.24 -1.26 -4.14 114.28 109.46 2wvz n THR 714 Ca 0.06 -0.50 -0.34 0.00 -2.27 0.00 0.00 64.05 61.00 2wvz n THR 714 Cb 0.38 0.78 -0.03 0.00 -2.10 0.00 0.00 70.33 69.36 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 -1.75 3.79 -0.18 -0.78 1.02 -1.26 -3.57 119.74 117.01 2wvz s LYS 715 Ca 0.35 1.30 0.05 0.00 0.02 0.00 0.00 55.97 57.69 2wvz s LYS 715 Cb 0.20 -2.10 0.41 0.00 -0.52 0.00 0.00 37.83 35.82 2wvz s LYS 715 CO 0.30 -0.43 1.33 0.09 -0.92 0.00 0.00 175.35 175.71 2wvz n ASN 716 N -1.09 3.51 -3.61 2.83 5.03 0.03 -4.91 115.26 117.05 2wvz n ASN 716 Ca 0.09 -2.68 -0.11 0.00 0.87 0.00 0.00 54.58 52.76 2wvz n ASN 716 Cb 0.53 -0.64 -0.03 0.00 -1.02 0.00 0.00 39.78 38.61 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 -1.88 -0.27 0.12 3.10 1.13 -1.26 -1.00 117.35 117.28 2wvz s TYR 717 Ca 0.30 -0.03 0.08 0.00 -1.41 0.00 0.00 57.07 56.02 2wvz s TYR 717 Cb 0.24 0.40 -0.04 0.00 -1.10 0.00 0.00 41.96 41.46 2wvz s TYR 717 CO 0.07 -0.83 -0.19 -0.51 -2.51 0.00 0.00 175.55 171.59 2wvz s LEU 718 N -2.81 2.35 -0.02 -3.49 1.43 -0.48 -4.92 118.68 110.74 2wvz s LEU 718 Ca 0.05 -0.75 0.01 0.00 -1.03 0.00 0.00 54.13 52.41 2wvz s LEU 718 Cb -0.00 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 45.36 2wvz s LEU 718 CO -0.09 0.01 0.00 -0.13 0.23 0.00 0.00 176.35 176.37 2wvz s ARG 719 N -2.24 2.83 0.09 1.70 0.52 -1.26 -1.09 118.95 119.49 2wvz s ARG 719 Ca 0.09 -0.57 -0.26 0.00 -0.52 0.00 0.00 55.73 54.47 2wvz s ARG 719 Cb -0.08 -2.69 -0.11 0.00 0.52 0.00 0.00 34.95 32.59 2wvz s ARG 719 CO 0.05 0.64 1.42 1.25 0.02 0.00 0.00 175.30 178.68 2wvz h HIS 720 N 4.53 -1.22 -0.45 -0.53 -0.00 -1.04 -1.27 115.15 115.17 2wvz h HIS 720 Ca -0.49 0.04 0.13 0.00 -0.00 0.00 0.00 60.37 60.05 2wvz h HIS 720 Cb 1.18 0.53 -0.02 0.00 -0.00 0.00 0.00 27.41 29.11 2wvz h HIS 720 CO 0.61 -0.44 0.34 1.49 -0.00 0.00 0.00 177.93 179.93 2wvz h GLU 721 N -0.51 0.00 -0.21 5.26 4.81 -1.96 -0.26 114.58 121.71 2wvz h GLU 721 Ca 0.01 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.04 2wvz h GLU 721 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 2wvz h GLU 721 CO -0.29 0.00 -0.67 -0.44 -0.73 0.00 0.00 179.01 176.88 2wvz h ASP 722 N 0.00 0.91 0.10 1.04 3.32 -1.67 -3.10 116.42 117.02 2wvz h ASP 722 Ca 0.21 -0.55 -0.00 0.00 0.02 0.00 0.00 57.03 56.71 2wvz h ASP 722 Cb 0.89 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2wvz h ASP 722 CO -0.00 1.34 -0.05 -0.07 -1.72 0.00 0.00 179.24 178.74 2wvz h LEU 723 N 0.57 -0.11 -1.44 1.55 3.38 -0.18 -2.94 115.31 116.16 2wvz h LEU 723 Ca -0.02 -0.20 0.06 0.00 0.09 0.00 0.00 57.88 57.81 2wvz h LEU 723 Cb 1.29 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 2wvz h LEU 723 CO 0.14 0.14 0.61 -0.26 0.09 0.00 0.00 178.44 179.15 2wvz h PHE 724 N -0.36 0.00 0.00 1.13 -1.00 -1.23 0.45 116.94 115.93 2wvz h PHE 724 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 2wvz h PHE 724 Cb 0.30 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.86 2wvz h PHE 724 CO 0.00 0.00 -0.17 1.63 -1.61 0.00 0.00 178.31 178.16 2wvz n LYS 725 N -3.01 0.16 -0.12 1.51 5.02 -1.11 -4.72 118.16 115.89 2wvz n LYS 725 Ca 0.03 0.10 0.02 0.00 -2.02 0.00 0.00 58.31 56.44 2wvz n LYS 725 Cb 0.70 -1.66 -0.00 0.00 -0.02 0.00 0.00 35.03 34.05 2wvz n LYS 725 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wvz n GLY 726 N 1.39 -1.84 0.00 0.72 0.00 0.16 -4.84 105.19 100.78 2wvz n GLY 726 Ca 0.06 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.51 0.11 2.83 -0.02 0.00 0.00 -4.91 105.19 102.69 2wvz n GLY 727 Ca 0.00 -1.90 -0.14 0.00 0.00 0.00 0.00 46.02 43.98 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 -0.05 -0.08 2.61 2.01 -1.26 -0.94 115.64 117.93 2wvz s THR 728 Ca 0.00 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.20 2wvz s THR 728 Cb 0.00 -0.14 -0.03 0.00 0.01 0.00 0.00 72.50 72.35 2wvz s THR 728 CO 0.00 0.08 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.30 2wvz s ILE 729 N 1.06 3.59 -0.16 1.82 1.01 0.66 -0.00 121.20 129.16 2wvz s ILE 729 Ca -0.09 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 60.06 2wvz s ILE 729 Cb -0.12 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 39.88 2wvz s ILE 729 CO -0.04 0.58 -0.16 -0.54 0.00 0.00 0.00 174.94 174.78 2wvz s LYS 730 N -0.60 3.16 -0.20 2.79 1.02 0.15 -0.54 119.74 125.53 2wvz s LYS 730 Ca 0.09 -0.77 -0.02 0.00 0.02 0.00 0.00 55.97 55.29 2wvz s LYS 730 Cb -0.12 -2.61 -0.00 0.00 -0.52 0.00 0.00 37.83 34.58 2wvz s LYS 730 CO 0.02 -0.04 -0.09 0.08 -0.92 0.00 0.00 175.35 174.40 2wvz s VAL 731 N 0.93 2.99 -0.50 3.17 1.01 0.12 -1.17 120.40 126.95 2wvz s VAL 731 Ca -0.03 -0.63 -0.22 0.00 0.00 0.00 0.00 61.98 61.10 2wvz s VAL 731 Cb -0.15 -2.33 0.04 0.00 0.00 0.00 0.00 36.38 33.94 2wvz s VAL 731 CO -0.03 0.46 0.76 -1.81 0.00 0.00 0.00 175.10 174.49 2wvz s ASP 732 N 1.33 6.32 0.25 3.32 1.01 -0.34 -4.31 116.67 124.24 2wvz s ASP 732 Ca 0.04 -0.47 -0.23 0.00 0.71 0.00 0.00 52.55 52.60 2wvz s ASP 732 Cb -0.14 -2.36 -0.09 0.00 1.01 0.00 0.00 42.92 41.34 2wvz s ASP 732 CO -0.05 -0.98 0.82 -0.04 0.21 0.00 0.00 175.17 175.13 2wvz s MET 733 N 3.22 4.45 0.17 8.23 -1.94 -1.26 -0.27 119.30 131.89 2wvz s MET 733 Ca 0.24 1.10 -0.01 0.00 -1.71 0.00 0.00 55.69 55.32 2wvz s MET 733 Cb -0.15 -2.93 -0.04 0.00 2.01 0.00 0.00 34.83 33.72 2wvz s MET 733 CO 0.18 0.39 0.10 0.45 -0.01 0.00 0.00 175.02 176.12 2wvz s SER 734 N -1.54 0.22 0.00 3.03 0.15 -0.35 -4.83 113.70 110.38 2wvz s SER 734 Ca 0.44 -1.30 0.22 0.00 0.70 0.00 0.00 55.95 56.01 2wvz s SER 734 Cb -0.19 0.34 0.58 0.00 -1.71 0.00 0.00 66.02 65.04 2wvz s SER 734 CO 0.23 -0.79 1.49 -0.46 1.20 0.00 0.00 173.24 174.91 2wvz n ASN 735 N -0.19 3.59 -4.45 5.45 6.94 -1.26 -1.56 115.26 123.80 2wvz n ASN 735 Ca -0.02 -1.99 -0.33 0.00 -0.02 0.00 0.00 54.58 52.23 2wvz n ASN 735 Cb 0.65 -0.42 -0.14 0.00 -2.36 0.00 0.00 39.78 37.52 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 -1.17 2.61 0.28 -3.83 1.81 -1.26 -4.96 118.95 112.43 2wvz s ARG 736 Ca 0.44 -0.71 -0.29 0.00 -1.72 0.00 0.00 55.73 53.45 2wvz s ARG 736 Cb 0.24 -2.39 -0.09 0.00 -0.45 0.00 0.00 34.95 32.25 2wvz s ARG 736 CO 0.31 0.55 1.12 -1.25 -0.68 0.00 0.00 175.30 175.36 2wvz s PRO 737 N -0.55 4.61 -0.50 3.54 0.04 -1.26 -4.73 135.00 136.15 2wvz s PRO 737 Ca 0.08 1.84 -0.16 0.00 0.04 0.00 0.00 61.00 62.79 2wvz s PRO 737 Cb -0.11 -3.18 0.09 0.00 0.04 0.00 0.00 34.50 31.33 2wvz s PRO 737 CO 0.01 0.16 0.46 1.21 0.04 0.00 0.00 177.00 178.89 2wvz s ASN 738 N -0.78 6.17 0.00 6.66 3.84 -1.26 -4.95 114.94 124.62 2wvz s ASN 738 Ca 0.45 -1.46 0.18 0.00 0.21 0.00 0.00 52.86 52.25 2wvz s ASN 738 Cb -0.33 -2.21 0.80 0.00 -0.55 0.00 0.00 41.25 38.97 2wvz s ASN 738 CO 0.42 -0.76 1.57 0.18 -2.79 0.00 0.00 177.10 175.72 2wvz n LEU 739 N 5.34 0.00 -0.11 3.21 7.99 -1.26 -3.35 117.00 128.82 2wvz n LEU 739 Ca -0.12 0.45 -0.16 0.00 -0.01 0.00 0.00 56.01 56.17 2wvz n LEU 739 Cb 0.43 -0.45 -0.11 0.00 -0.11 0.00 0.00 43.42 43.18 2wvz n LEU 739 CO 0.51 -0.17 -1.25 0.59 -1.51 0.00 0.00 177.39 175.55 2wvz n ASN 740 N -1.45 2.21 -4.71 -1.43 3.02 -1.26 -4.91 115.26 106.73 2wvz n ASN 740 Ca 0.05 -0.12 -0.43 0.00 -0.03 0.00 0.00 54.58 54.05 2wvz n ASN 740 Cb 0.20 -0.36 -0.03 0.00 -0.61 0.00 0.00 39.78 38.98 2wvz n ASN 740 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 2wvz n ARG 741 N -3.17 2.55 -2.01 3.52 0.63 -1.21 -3.18 116.66 113.79 2wvz n ARG 741 Ca -0.41 0.91 -0.08 0.00 -0.92 0.00 0.00 57.85 57.36 2wvz n ARG 741 Cb 0.93 -2.71 -0.01 0.00 0.45 0.00 0.00 32.46 31.13 2wvz n ARG 741 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wvz n GLY 742 N 3.13 0.19 0.34 5.14 0.00 -1.23 -4.72 105.19 108.05 2wvz n GLY 742 Ca 0.14 -0.58 0.08 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.82 0.00 -2.97 2.61 -2.24 -1.19 -4.55 114.28 102.11 2wvz n THR 743 Ca -0.09 -0.31 -0.36 0.00 -2.27 0.00 0.00 64.05 61.02 2wvz n THR 743 Cb 0.52 1.18 -0.06 0.00 -2.10 0.00 0.00 70.33 69.87 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 -2.02 4.38 0.34 -0.78 1.02 -1.26 -4.91 119.74 116.51 2wvz s LYS 744 Ca 0.13 1.05 0.11 0.00 0.02 0.00 0.00 55.97 57.28 2wvz s LYS 744 Cb 0.13 -2.84 0.90 0.00 -0.52 0.00 0.00 37.83 35.50 2wvz s LYS 744 CO 0.45 0.35 1.76 1.49 -0.92 0.00 0.00 175.35 178.47 2wvz h GLU 745 N 3.31 0.57 0.00 1.68 4.22 -1.99 0.54 114.58 122.91 2wvz h GLU 745 Ca -0.47 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 58.93 2wvz h GLU 745 Cb 1.19 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2wvz h GLU 745 CO 0.65 0.38 0.00 -0.85 -2.18 0.00 0.00 179.01 177.01 2wvz n GLU 746 N -4.78 0.32 0.01 1.92 0.28 -1.26 -2.46 120.64 114.68 2wvz n GLU 746 Ca 0.25 0.09 0.12 0.00 -0.16 0.00 0.00 57.16 57.46 2wvz n GLU 746 Cb 0.73 -1.50 0.19 0.00 1.43 0.00 0.00 31.44 32.29 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 -1.21 0.57 -4.76 -1.84 8.00 0.19 -4.87 116.55 112.63 2wvz n ASP 747 Ca 0.09 -0.25 -0.39 0.00 0.71 0.00 0.00 54.79 54.95 2wvz n ASP 747 Cb 0.11 0.35 -0.05 0.00 -0.02 0.00 0.00 41.12 41.51 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 -3.04 4.67 1.11 -1.24 -1.94 -1.03 -0.79 119.30 117.04 2wvz s MET 748 Ca 0.09 1.53 -0.17 0.00 -1.71 0.00 0.00 55.69 55.44 2wvz s MET 748 Cb 0.17 -3.08 0.25 0.00 2.01 0.00 0.00 34.83 34.17 2wvz s MET 748 CO 0.72 0.32 1.15 -2.14 -0.01 0.00 0.00 175.02 175.07 2wvz s PRO 749 N -1.57 -0.46 0.37 2.03 0.02 -1.26 -4.91 135.00 129.21 2wvz s PRO 749 Ca 0.46 -0.04 -0.28 0.00 0.02 0.00 0.00 61.00 61.15 2wvz s PRO 749 Cb -0.25 -1.68 -0.10 0.00 0.02 0.00 0.00 34.50 32.48 2wvz s PRO 749 CO 0.32 -3.21 1.40 -0.47 -0.33 0.00 0.00 177.00 174.70 2wvz s TYR 750 N -3.20 2.78 -0.02 6.54 5.04 -1.26 -5.00 117.35 122.22 2wvz s TYR 750 Ca 0.70 1.29 0.01 0.00 -2.44 0.00 0.00 57.07 56.63 2wvz s TYR 750 Cb -0.10 -3.85 0.02 0.00 0.35 0.00 0.00 41.96 38.38 2wvz s TYR 750 CO 0.55 -2.46 -0.02 -1.12 -1.34 0.00 0.00 175.55 171.16 2wvz s SER 751 N -0.35 0.52 0.28 4.32 0.01 -1.26 -4.64 113.70 112.58 2wvz s SER 751 Ca 0.52 -0.06 0.02 0.00 1.31 0.00 0.00 55.95 57.74 2wvz s SER 751 Cb -0.43 -0.21 0.68 0.00 0.21 0.00 0.00 66.02 66.26 2wvz s SER 751 CO 0.57 -0.05 1.70 0.15 0.41 0.00 0.00 173.24 176.03 2wvz h PHE 752 N 6.88 0.64 -1.65 2.43 3.57 -1.11 -1.45 116.94 126.25 2wvz h PHE 752 Ca -0.38 0.04 0.52 0.00 3.53 0.00 0.00 57.97 61.69 2wvz h PHE 752 Cb 1.15 -0.14 -0.11 0.00 2.79 0.00 0.00 35.95 39.64 2wvz h PHE 752 CO 0.48 -0.02 1.13 0.77 -2.23 0.00 0.00 178.31 178.44 2wvz h SER 753 N 0.42 0.11 0.05 0.41 0.02 -1.92 -1.45 113.55 111.18 2wvz h SER 753 Ca 0.53 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.57 2wvz h SER 753 Cb 0.97 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.61 2wvz h SER 753 CO -0.50 -0.15 -0.85 0.29 -1.14 0.00 0.00 176.83 174.48 2wvz n LYS 754 N -4.39 0.23 -1.95 3.45 5.02 -0.55 -4.91 118.16 115.06 2wvz n LYS 754 Ca 0.42 -0.18 -0.42 0.00 -2.02 0.00 0.00 58.31 56.11 2wvz n LYS 754 Cb 1.78 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 35.26 2wvz n LYS 754 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2wvz s GLU 755 N -2.90 4.22 0.00 1.97 2.02 -0.55 -5.07 118.70 118.39 2wvz s GLU 755 Ca 0.10 2.34 0.00 0.00 0.02 0.00 0.00 54.97 57.44 2wvz s GLU 755 Cb 0.17 -3.19 0.00 0.00 0.10 0.00 0.00 34.13 31.21 2wvz s GLU 755 CO 0.80 -0.60 0.00 1.28 0.02 0.00 0.00 175.26 176.75