#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w0p s LEU 26 N 0.00 2.49 -0.21 0.00 2.96 -1.26 -1.01 118.68 121.65 1w0p s LEU 26 Ca 0.00 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.55 1w0p s LEU 26 Cb 0.00 -1.52 0.04 0.00 0.50 0.00 0.00 46.19 45.21 1w0p s LEU 26 CO 0.00 0.22 -0.11 -0.36 -1.32 0.00 0.00 176.35 174.77 1w0p s PHE 27 N 0.03 2.59 0.28 5.38 0.08 0.25 -4.99 117.98 121.61 1w0p s PHE 27 Ca -0.06 -1.72 -0.05 0.00 0.12 0.00 0.00 56.93 55.22 1w0p s PHE 27 Cb -0.15 -1.72 -0.01 0.00 -0.57 0.00 0.00 43.02 40.57 1w0p s PHE 27 CO 0.05 -0.77 0.39 0.16 -0.10 0.00 0.00 175.22 174.94 1w0p s ASP 28 N 1.34 0.46 -0.03 1.36 -4.77 -1.26 -0.54 116.67 113.22 1w0p s ASP 28 Ca -0.02 -1.30 -0.00 0.00 -3.30 0.00 0.00 52.55 47.93 1w0p s ASP 28 Cb -0.16 0.57 0.03 0.00 -1.09 0.00 0.00 42.92 42.26 1w0p s ASP 28 CO -0.08 -1.13 0.03 -0.47 0.70 0.00 0.00 175.17 174.22 1w0p s TYR 29 N -3.64 0.14 -0.18 2.11 5.04 -0.20 -4.91 117.35 115.71 1w0p s TYR 29 Ca 0.30 0.12 0.01 0.00 -2.44 0.00 0.00 57.07 55.06 1w0p s TYR 29 Cb 0.01 -0.37 0.03 0.00 0.35 0.00 0.00 41.96 41.99 1w0p s TYR 29 CO 0.15 -0.14 -0.12 -0.80 -1.34 0.00 0.00 175.55 173.31 1w0p s ASN 30 N 1.38 3.11 0.11 4.32 -0.87 -1.26 -1.12 114.94 120.61 1w0p s ASN 30 Ca -0.05 -0.73 -0.31 0.00 -1.57 0.00 0.00 52.86 50.20 1w0p s ASN 30 Cb -0.13 -1.20 -0.09 0.00 -0.02 0.00 0.00 41.25 39.81 1w0p s ASN 30 CO -0.03 -0.11 1.55 0.00 -2.57 0.00 0.00 177.10 175.94 1w0p s ALA 31 N 1.44 3.70 0.08 0.60 0.00 -0.68 -5.00 121.76 121.90 1w0p s ALA 31 Ca 0.01 1.24 -0.16 0.00 0.00 0.00 0.00 51.96 53.05 1w0p s ALA 31 Cb -0.15 -3.63 0.03 0.00 0.00 0.00 0.00 23.12 19.37 1w0p s ALA 31 CO -0.09 -0.87 0.37 -0.08 0.00 0.00 0.00 175.76 175.08 1w0p s THR 32 N 1.75 0.07 -1.37 0.00 -1.32 -1.26 -4.75 115.64 108.76 1w0p s THR 32 Ca 0.70 -0.60 0.25 0.00 -1.21 0.00 0.00 61.69 60.82 1w0p s THR 32 Cb -0.40 -1.06 0.08 0.00 -1.51 0.00 0.00 72.50 69.60 1w0p s THR 32 CO 0.31 -0.33 1.39 0.61 -2.21 0.00 0.00 174.62 174.38 1w0p n GLY 33 N 0.21 -0.87 3.68 6.08 0.00 -1.26 -4.22 105.19 108.80 1w0p n GLY 33 Ca -0.17 -0.42 -0.46 0.00 0.00 0.00 0.00 46.02 44.97 1w0p n GLY 33 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w0p n ASP 34 N -1.05 3.71 -0.28 1.61 8.00 -1.26 -4.75 116.55 122.53 1w0p n ASP 34 Ca 0.08 0.96 0.08 0.00 0.71 0.00 0.00 54.79 56.62 1w0p n ASP 34 Cb 0.35 -1.44 0.20 0.00 -0.02 0.00 0.00 41.12 40.22 1w0p n ASP 34 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1w0p h THR 35 N 5.31 0.31 -0.01 -3.53 2.02 -1.97 0.10 112.91 115.14 1w0p h THR 35 Ca -0.48 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 66.65 1w0p h THR 35 Cb 1.26 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.83 1w0p h THR 35 CO 0.94 0.02 0.01 -0.08 0.37 0.00 0.00 175.52 176.79 1w0p h GLU 36 N 0.13 0.00 0.00 6.66 4.81 -1.99 -3.02 114.58 121.17 1w0p h GLU 36 Ca 0.47 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.57 1w0p h GLU 36 Cb 0.87 0.00 -0.28 0.00 0.63 0.00 0.00 28.75 29.97 1w0p h GLU 36 CO -0.69 0.00 -0.89 1.19 -0.73 0.00 0.00 179.01 177.89 1w0p n PHE 37 N -3.77 0.00 0.89 0.92 3.72 -0.33 -4.87 117.46 114.02 1w0p n PHE 37 Ca -0.03 -0.75 0.00 0.00 -0.05 0.00 0.00 57.45 56.62 1w0p n PHE 37 Cb 0.09 -0.17 0.00 0.00 -0.94 0.00 0.00 39.48 38.46 1w0p n PHE 37 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1w0p n ASP 38 N 0.07 0.63 -3.49 4.37 3.85 0.20 -4.50 116.55 117.68 1w0p n ASP 38 Ca 0.09 -1.52 -0.15 0.00 -0.71 0.00 0.00 54.79 52.51 1w0p n ASP 38 Cb 1.02 -0.31 -0.04 0.00 -1.35 0.00 0.00 41.12 40.44 1w0p n ASP 38 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 1w0p s SER 39 N -0.41 -0.59 0.52 -1.12 0.15 -1.26 -4.84 113.70 106.15 1w0p s SER 39 Ca 0.00 0.42 0.19 0.00 0.70 0.00 0.00 55.95 57.25 1w0p s SER 39 Cb 0.00 0.53 1.34 0.00 -1.71 0.00 0.00 66.02 66.17 1w0p s SER 39 CO 0.00 -0.70 2.14 -0.65 1.20 0.00 0.00 173.24 175.23 1w0p h PRO 40 N 2.58 0.00 -0.07 5.44 0.11 -1.93 -1.52 132.00 136.61 1w0p h PRO 40 Ca -0.28 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.80 1w0p h PRO 40 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1w0p h PRO 40 CO 0.37 0.03 -0.09 0.00 -0.21 0.00 0.00 178.00 178.10 1w0p h ALA 41 N 1.97 1.71 -0.03 -0.75 0.00 -1.95 -0.15 119.26 120.05 1w0p h ALA 41 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1w0p h ALA 41 Cb 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1w0p h ALA 41 CO 0.00 0.22 0.00 1.63 0.00 0.00 0.00 179.25 181.10 1w0p n LYS 42 N -4.37 1.42 -0.31 0.00 5.02 -0.58 -3.40 118.16 115.95 1w0p n LYS 42 Ca -0.02 -0.62 0.08 0.00 -2.02 0.00 0.00 58.31 55.73 1w0p n LYS 42 Cb 0.20 -1.46 0.18 0.00 -0.02 0.00 0.00 35.03 33.93 1w0p n LYS 42 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1w0p n GLN 43 N -0.23 1.62 -0.23 1.97 6.02 -0.18 -4.80 117.38 121.55 1w0p n GLN 43 Ca 0.20 -2.84 0.00 0.00 -0.01 0.00 0.00 57.00 54.34 1w0p n GLN 43 Cb 0.26 -1.60 0.00 0.00 1.02 0.00 0.00 30.24 29.92 1w0p n GLN 43 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1w0p n GLY 44 N -1.21 0.99 3.87 1.08 0.00 -1.13 -4.85 105.19 103.94 1w0p n GLY 44 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1w0p n GLY 44 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1w0p s TRP 45 N -2.67 3.44 -0.17 1.61 0.52 -0.56 -4.89 118.94 116.22 1w0p s TRP 45 Ca 0.00 0.98 -0.04 0.00 0.02 0.00 0.00 56.10 57.06 1w0p s TRP 45 Cb 0.00 -2.37 -0.03 0.00 -1.15 0.00 0.00 33.47 29.92 1w0p s TRP 45 CO 0.00 0.06 -0.02 -1.64 0.02 0.00 0.00 176.95 175.37 1w0p s MET 46 N -3.39 3.67 0.20 4.98 -1.94 -0.17 -3.98 119.30 118.67 1w0p s MET 46 Ca 0.50 -0.51 -0.30 0.00 -1.71 0.00 0.00 55.69 53.67 1w0p s MET 46 Cb -0.10 -2.98 -0.09 0.00 2.01 0.00 0.00 34.83 33.67 1w0p s MET 46 CO 0.26 0.18 1.35 -1.14 -0.01 0.00 0.00 175.02 175.66 1w0p s GLN 47 N 0.54 4.35 -0.39 2.03 0.74 -1.26 -1.18 119.66 124.49 1w0p s GLN 47 Ca -0.02 2.11 0.07 0.00 0.05 0.00 0.00 55.36 57.57 1w0p s GLN 47 Cb -0.14 -3.18 0.24 0.00 1.10 0.00 0.00 33.01 31.02 1w0p s GLN 47 CO 0.02 -0.32 0.49 -3.47 -0.55 0.00 0.00 175.29 171.47 1w0p n ASP 48 N 2.78 0.07 -4.90 6.67 2.03 -0.39 -4.93 116.55 117.88 1w0p n ASP 48 Ca 0.07 -2.64 -0.21 0.00 0.52 0.00 0.00 54.79 52.53 1w0p n ASP 48 Cb 0.42 -0.62 -0.02 0.00 -0.72 0.00 0.00 41.12 40.17 1w0p n ASP 48 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 1w0p s ASN 49 N -0.97 5.06 0.03 1.67 0.01 -1.26 -3.35 114.94 116.14 1w0p s ASN 49 Ca 0.35 -0.77 -0.03 0.00 -0.71 0.00 0.00 52.86 51.70 1w0p s ASN 49 Cb 0.15 -0.45 -0.02 0.00 0.41 0.00 0.00 41.25 41.34 1w0p s ASN 49 CO -0.13 -0.73 0.04 0.42 -1.51 0.00 0.00 177.10 175.19 1w0p s THR 50 N -2.50 0.13 0.00 1.60 -4.23 -0.55 -4.90 115.64 105.20 1w0p s THR 50 Ca 0.48 -1.10 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 1w0p s THR 50 Cb -0.04 -0.73 0.00 0.00 1.34 0.00 0.00 72.50 73.07 1w0p s THR 50 CO 0.28 -0.61 0.00 0.59 -0.54 0.00 0.00 174.62 174.35 1w0p n ASN 51 N 1.01 0.00 -0.50 3.99 3.02 -1.26 -0.98 115.26 120.53 1w0p n ASN 51 Ca -0.20 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.43 1w0p n ASN 51 Cb 0.57 0.00 0.32 0.00 -0.61 0.00 0.00 39.78 40.06 1w0p n ASN 51 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1w0p n ASN 52 N 4.04 1.49 -4.77 6.41 3.02 -0.38 -4.94 115.26 120.12 1w0p n ASN 52 Ca 0.00 -1.77 -0.41 0.00 -0.03 0.00 0.00 54.58 52.37 1w0p n ASN 52 Cb 0.00 -0.13 -0.01 0.00 -0.61 0.00 0.00 39.78 39.04 1w0p n ASN 52 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1w0p s GLY 53 N -1.39 2.89 0.00 7.41 0.00 -0.16 -4.72 107.32 111.35 1w0p s GLY 53 Ca 0.28 1.51 0.00 0.00 0.00 0.00 0.00 44.72 46.51 1w0p s GLY 53 CO 0.22 2.21 0.00 -1.26 0.00 0.00 0.00 173.10 174.27 1w0p n SER 54 N 0.69 0.00 -3.55 1.64 2.88 -0.60 -4.67 113.62 110.01 1w0p n SER 54 Ca 0.01 -0.43 -0.07 0.00 -1.33 0.00 0.00 58.87 57.06 1w0p n SER 54 Cb 0.40 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.84 1w0p n SER 54 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1w0p s GLY 55 N -0.43 -0.40 -0.05 0.46 0.00 -1.26 -1.16 107.32 104.48 1w0p s GLY 55 Ca 0.00 1.10 -0.30 0.00 0.00 0.00 0.00 44.72 45.52 1w0p s GLY 55 CO 0.00 0.36 0.71 0.54 0.00 0.00 0.00 173.10 174.71 1w0p s VAL 56 N -2.92 0.00 0.02 1.40 0.11 -0.80 -4.99 120.40 113.22 1w0p s VAL 56 Ca 0.07 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.82 1w0p s VAL 56 Cb -0.01 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.80 1w0p s VAL 56 CO -0.07 0.00 1.09 -0.22 -3.33 0.00 0.00 175.10 172.57 1w0p s LEU 57 N -1.28 4.36 0.12 2.54 2.96 -1.26 -0.44 118.68 125.69 1w0p s LEU 57 Ca -0.09 1.82 0.10 0.00 -0.22 0.00 0.00 54.13 55.74 1w0p s LEU 57 Cb -0.00 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.08 1w0p s LEU 57 CO 0.08 -0.37 -0.20 0.28 -1.32 0.00 0.00 176.35 174.81 1w0p s THR 58 N 1.10 2.69 -0.10 3.68 -1.32 0.82 -4.90 115.64 117.61 1w0p s THR 58 Ca 0.55 -1.59 0.04 0.00 -1.21 0.00 0.00 61.69 59.48 1w0p s THR 58 Cb -0.25 -2.23 -0.00 0.00 -1.51 0.00 0.00 72.50 68.51 1w0p s THR 58 CO 0.28 0.09 -0.23 0.20 -2.21 0.00 0.00 174.62 172.74 1w0p s ASN 59 N -2.16 3.17 0.00 8.08 -0.87 -1.26 -1.38 114.94 120.52 1w0p s ASN 59 Ca 0.17 -0.53 0.00 0.00 -1.57 0.00 0.00 52.86 50.93 1w0p s ASN 59 Cb -0.10 -1.34 0.00 0.00 -0.02 0.00 0.00 41.25 39.79 1w0p s ASN 59 CO 0.09 0.17 0.00 0.00 -2.57 0.00 0.00 177.10 174.80 1w0p n ALA 60 N 3.43 0.00 -1.26 0.60 0.00 -1.25 -4.92 120.51 117.11 1w0p n ALA 60 Ca -0.19 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.05 1w0p n ALA 60 Cb 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.89 1w0p n ALA 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1w0p n ASP 61 N 0.00 6.04 0.00 0.00 8.00 -1.26 -4.62 116.55 124.71 1w0p n ASP 61 Ca 0.00 -2.94 0.00 0.00 0.71 0.00 0.00 54.79 52.56 1w0p n ASP 61 Cb 0.00 -1.28 0.00 0.00 -0.02 0.00 0.00 41.12 39.82 1w0p n ASP 61 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1w0p n GLY 62 N 1.38 0.50 3.03 0.44 0.00 -1.26 -4.99 105.19 104.29 1w0p n GLY 62 Ca 0.44 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.15 1w0p n GLY 62 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1w0p s MET 63 N -0.36 2.08 0.72 1.61 -1.94 -1.26 -5.12 119.30 115.03 1w0p s MET 63 Ca 0.00 -1.25 -0.14 0.00 -1.71 0.00 0.00 55.69 52.59 1w0p s MET 63 Cb 0.00 -2.80 0.04 0.00 2.01 0.00 0.00 34.83 34.07 1w0p s MET 63 CO 0.00 -0.57 1.17 -1.25 -0.01 0.00 0.00 175.02 174.36 1w0p s PRO 64 N 1.18 2.26 0.05 2.03 0.04 -1.26 -3.85 135.00 135.46 1w0p s PRO 64 Ca -0.08 1.61 -0.20 0.00 0.04 0.00 0.00 61.00 62.37 1w0p s PRO 64 Cb -0.20 -1.86 0.04 0.00 0.04 0.00 0.00 34.50 32.53 1w0p s PRO 64 CO -0.05 -1.71 0.47 0.00 0.04 0.00 0.00 177.00 175.75 1w0p s ALA 65 N -2.17 -1.18 -0.25 8.56 0.00 -0.48 -4.74 121.76 121.50 1w0p s ALA 65 Ca 0.71 0.44 -0.15 0.00 0.00 0.00 0.00 51.96 52.96 1w0p s ALA 65 Cb -0.26 0.39 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1w0p s ALA 65 CO 0.45 -0.50 0.38 -0.46 0.00 0.00 0.00 175.76 175.63 1w0p s TRP 66 N -2.56 3.28 -0.39 0.00 -0.11 0.28 -0.13 118.94 119.32 1w0p s TRP 66 Ca -0.05 0.47 -0.20 0.00 1.22 0.00 0.00 56.10 57.54 1w0p s TRP 66 Cb -0.01 -2.56 0.01 0.00 -1.50 0.00 0.00 33.47 29.42 1w0p s TRP 66 CO -0.03 -0.17 0.61 -1.17 -4.62 0.00 0.00 176.95 171.58 1w0p s LEU 67 N 1.86 4.38 -0.25 5.86 2.96 0.42 -0.27 118.68 133.64 1w0p s LEU 67 Ca 0.16 -0.09 -0.22 0.00 -0.22 0.00 0.00 54.13 53.76 1w0p s LEU 67 Cb -0.15 -2.72 -0.01 0.00 0.50 0.00 0.00 46.19 43.81 1w0p s LEU 67 CO 0.09 -0.64 0.73 -0.69 -1.32 0.00 0.00 176.35 174.52 1w0p s VAL 68 N 2.68 4.91 -0.72 1.68 1.01 0.17 -1.90 120.40 128.22 1w0p s VAL 68 Ca 0.22 1.35 -0.05 0.00 0.00 0.00 0.00 61.98 63.50 1w0p s VAL 68 Cb -0.15 -4.03 0.19 0.00 0.00 0.00 0.00 36.38 32.39 1w0p s VAL 68 CO 0.16 -0.02 0.58 -1.10 0.00 0.00 0.00 175.10 174.72 1w0p s GLN 69 N 2.66 2.95 -0.83 2.72 -0.21 -0.31 -2.43 119.66 124.20 1w0p s GLN 69 Ca 0.31 -2.66 -0.02 0.00 0.02 0.00 0.00 55.36 53.01 1w0p s GLN 69 Cb -0.15 -3.94 0.29 0.00 1.00 0.00 0.00 33.01 30.21 1w0p s GLN 69 CO 0.08 -1.22 2.13 0.41 -2.12 0.00 0.00 175.29 174.57 1w0p n GLY 70 N 3.38 5.43 3.53 3.09 0.00 0.30 -1.56 105.19 119.35 1w0p n GLY 70 Ca 0.12 -2.39 -0.38 0.00 0.00 0.00 0.00 46.02 43.37 1w0p n GLY 70 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1w0p s ILE 71 N -4.38 4.99 -0.53 -0.61 -0.00 -1.26 -1.66 121.20 117.75 1w0p s ILE 71 Ca 0.51 -0.06 -0.01 0.00 -0.00 0.00 0.00 60.65 61.09 1w0p s ILE 71 Cb 0.38 -3.43 0.00 0.00 -0.00 0.00 0.00 42.46 39.41 1w0p s ILE 71 CO -0.33 0.19 0.13 0.61 -0.00 0.00 0.00 174.94 175.55 1w0p n GLY 72 N 5.03 0.22 0.00 6.27 0.00 -1.26 -4.33 105.19 111.12 1w0p n GLY 72 Ca -0.14 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1w0p n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w0p n GLY 73 N -1.00 2.32 3.80 -0.02 0.00 -1.19 -1.25 105.19 107.86 1w0p n GLY 73 Ca -0.05 -1.14 -0.36 0.00 0.00 0.00 0.00 46.02 44.47 1w0p n GLY 73 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1w0p s ARG 74 N -2.01 4.37 -0.26 1.61 3.52 -1.18 -4.48 118.95 120.52 1w0p s ARG 74 Ca 0.00 1.06 -0.03 0.00 -0.13 0.00 0.00 55.73 56.64 1w0p s ARG 74 Cb 0.00 -2.76 0.11 0.00 -1.56 0.00 0.00 34.95 30.73 1w0p s ARG 74 CO 0.00 0.30 0.21 0.00 -0.81 0.00 0.00 175.30 175.00 1w0p s ALA 75 N -1.64 -0.02 0.21 6.12 0.00 -0.82 -1.48 121.76 124.13 1w0p s ALA 75 Ca 0.48 -0.40 -0.12 0.00 0.00 0.00 0.00 51.96 51.92 1w0p s ALA 75 Cb -0.16 -1.50 -0.00 0.00 0.00 0.00 0.00 23.12 21.46 1w0p s ALA 75 CO 0.21 -1.52 0.40 1.14 0.00 0.00 0.00 175.76 175.99 1w0p s GLN 76 N 2.26 1.37 -0.00 0.00 -2.07 -1.21 -0.03 119.66 119.98 1w0p s GLN 76 Ca 0.08 -1.18 0.07 0.00 -1.82 0.00 0.00 55.36 52.51 1w0p s GLN 76 Cb -0.15 0.44 -0.02 0.00 -1.09 0.00 0.00 33.01 32.19 1w0p s GLN 76 CO -0.27 -0.55 -0.22 -1.58 -1.32 0.00 0.00 175.29 171.35 1w0p s TRP 77 N -3.98 1.95 0.13 9.60 0.52 -0.20 -1.26 118.94 125.69 1w0p s TRP 77 Ca 0.19 -0.37 0.05 0.00 0.02 0.00 0.00 56.10 55.99 1w0p s TRP 77 Cb 0.01 -1.23 -0.04 0.00 -1.15 0.00 0.00 33.47 31.06 1w0p s TRP 77 CO 0.04 -0.00 -0.12 0.95 0.02 0.00 0.00 176.95 177.84 1w0p s THR 78 N -0.57 1.20 -0.05 2.01 -4.23 -0.32 -2.08 115.64 111.60 1w0p s THR 78 Ca 0.08 -1.81 -0.01 0.00 -1.18 0.00 0.00 61.69 58.77 1w0p s THR 78 Cb -0.09 -1.59 0.03 0.00 1.34 0.00 0.00 72.50 72.19 1w0p s THR 78 CO -0.00 -0.55 0.01 -0.47 -0.54 0.00 0.00 174.62 173.07 1w0p s TYR 79 N -2.58 0.38 0.07 3.99 6.14 -0.45 -1.00 117.35 123.90 1w0p s TYR 79 Ca 0.11 0.00 -0.14 0.00 0.64 0.00 0.00 57.07 57.68 1w0p s TYR 79 Cb -0.02 -0.57 -0.06 0.00 0.42 0.00 0.00 41.96 41.73 1w0p s TYR 79 CO 0.02 -0.21 0.46 -1.12 0.64 0.00 0.00 175.55 175.34 1w0p s SER 80 N 1.61 6.79 0.18 4.32 0.01 -1.26 -1.39 113.70 123.96 1w0p s SER 80 Ca -0.01 0.98 0.10 0.00 1.31 0.00 0.00 55.95 58.32 1w0p s SER 80 Cb -0.13 -2.25 -0.04 0.00 0.21 0.00 0.00 66.02 63.81 1w0p s SER 80 CO -0.03 0.21 -0.18 -0.76 0.41 0.00 0.00 173.24 172.90 1w0p s LEU 81 N -1.57 2.68 0.83 2.44 1.43 -1.26 -5.01 118.68 118.22 1w0p s LEU 81 Ca 0.31 -0.71 -0.11 0.00 -1.03 0.00 0.00 54.13 52.58 1w0p s LEU 81 Cb -0.16 -1.41 0.09 0.00 0.03 0.00 0.00 46.19 44.74 1w0p s LEU 81 CO 0.17 0.12 1.10 -0.94 0.23 0.00 0.00 176.35 177.03 1w0p s SER 82 N -2.65 4.12 0.42 2.29 1.04 -1.26 -4.84 113.70 112.81 1w0p s SER 82 Ca 0.22 1.38 0.09 0.00 0.48 0.00 0.00 55.95 58.11 1w0p s SER 82 Cb -0.09 -2.09 0.91 0.00 0.10 0.00 0.00 66.02 64.86 1w0p s SER 82 CO 0.12 -2.22 2.05 0.74 0.98 0.00 0.00 173.24 174.92 1w0p h THR 83 N -1.26 1.07 -0.39 2.02 2.02 -2.00 -2.03 112.91 112.33 1w0p h THR 83 Ca -0.48 -0.17 -0.13 0.00 0.77 0.00 0.00 66.41 66.40 1w0p h THR 83 Cb 1.27 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1w0p h THR 83 CO 0.57 0.09 -0.27 0.78 0.37 0.00 0.00 175.52 177.06 1w0p h ASN 84 N 0.50 0.86 -0.34 4.18 4.21 -1.99 -2.50 115.58 120.51 1w0p h ASN 84 Ca 0.16 -0.34 -0.16 0.00 1.21 0.00 0.00 56.30 57.17 1w0p h ASN 84 Cb 0.03 -0.24 -0.00 0.00 -1.12 0.00 0.00 38.32 36.99 1w0p h ASN 84 CO -0.04 1.08 -0.42 1.56 -1.29 0.00 0.00 177.43 178.33 1w0p h GLN 85 N 0.71 0.88 -0.79 0.81 4.20 -1.74 -1.54 115.11 117.64 1w0p h GLN 85 Ca 0.09 -0.49 -0.02 0.00 0.06 0.00 0.00 58.65 58.28 1w0p h GLN 85 Cb 0.82 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.59 1w0p h GLN 85 CO 0.07 1.14 0.40 0.45 -0.67 0.00 0.00 178.83 180.22 1w0p h HIS 86 N 0.67 1.12 -0.46 2.96 3.86 -1.43 -0.51 115.15 121.36 1w0p h HIS 86 Ca 0.04 -0.04 -0.04 0.00 -1.16 0.00 0.00 60.37 59.17 1w0p h HIS 86 Cb 1.02 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 29.11 1w0p h HIS 86 CO 0.07 0.81 0.11 0.00 0.86 0.00 0.00 177.93 179.78 1w0p h ALA 87 N 1.21 1.33 -0.31 2.45 0.00 -1.29 -1.87 119.26 120.78 1w0p h ALA 87 Ca 0.27 -0.18 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 1w0p h ALA 87 Cb 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1w0p h ALA 87 CO -0.04 0.48 -0.50 0.37 0.00 0.00 0.00 179.25 179.55 1w0p h GLN 88 N 0.67 0.88 -0.47 0.00 4.15 -0.47 -1.89 115.11 117.99 1w0p h GLN 88 Ca 0.15 -0.53 -0.04 0.00 0.77 0.00 0.00 58.65 59.01 1w0p h GLN 88 Cb 0.25 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.97 1w0p h GLN 88 CO -0.00 1.17 0.15 0.00 -1.93 0.00 0.00 178.83 178.22 1w0p h ALA 89 N 0.73 0.62 -0.40 3.38 0.00 -0.81 0.12 119.26 122.89 1w0p h ALA 89 Ca 0.03 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1w0p h ALA 89 Cb 1.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1w0p h ALA 89 CO 0.11 0.26 -0.12 0.77 0.00 0.00 0.00 179.25 180.28 1w0p h SER 90 N 0.63 0.71 0.15 0.00 0.02 -1.34 0.33 113.55 114.05 1w0p h SER 90 Ca 0.15 -0.21 -0.27 0.00 -0.84 0.00 0.00 61.79 60.62 1w0p h SER 90 Cb 0.26 -0.19 0.02 0.00 0.14 0.00 0.00 62.40 62.63 1w0p h SER 90 CO -0.01 0.85 -1.10 0.28 -1.14 0.00 0.00 176.83 175.72 1w0p h SER 91 N 0.65 0.79 -0.00 3.07 0.02 -1.06 -3.39 113.55 113.63 1w0p h SER 91 Ca 0.11 -0.68 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1w0p h SER 91 Cb 0.58 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1w0p h SER 91 CO 0.04 1.48 -0.19 0.49 -1.14 0.00 0.00 176.83 177.51 1w0p n PHE 92 N -3.79 0.00 0.00 3.45 3.72 0.38 -4.23 117.46 116.99 1w0p n PHE 92 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1w0p n PHE 92 Cb 0.91 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.45 1w0p n PHE 92 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1w0p n GLY 93 N 0.88 1.31 3.66 1.37 0.00 0.11 -4.64 105.19 107.88 1w0p n GLY 93 Ca 0.02 -1.94 -0.09 0.00 0.00 0.00 0.00 46.02 44.01 1w0p n GLY 93 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1w0p s TRP 94 N -2.27 0.29 -0.11 1.61 1.48 -1.06 -1.55 118.94 117.32 1w0p s TRP 94 Ca 0.00 -0.69 -0.09 0.00 -1.06 0.00 0.00 56.10 54.27 1w0p s TRP 94 Cb 0.00 0.34 0.03 0.00 -1.16 0.00 0.00 33.47 32.68 1w0p s TRP 94 CO 0.00 -1.12 0.28 0.50 -4.06 0.00 0.00 176.95 172.56 1w0p s ARG 95 N -3.74 0.30 -0.10 3.25 3.52 -0.52 -1.41 118.95 120.26 1w0p s ARG 95 Ca 0.20 0.45 0.01 0.00 -0.13 0.00 0.00 55.73 56.26 1w0p s ARG 95 Cb -0.02 0.08 0.02 0.00 -1.56 0.00 0.00 34.95 33.46 1w0p s ARG 95 CO 0.10 -0.08 -0.11 1.41 -0.81 0.00 0.00 175.30 175.81 1w0p s MET 96 N 0.51 1.78 -0.05 5.12 -2.45 -0.25 -0.49 119.30 123.47 1w0p s MET 96 Ca -0.03 -0.39 0.06 0.00 -1.25 0.00 0.00 55.69 54.07 1w0p s MET 96 Cb -0.04 -1.61 -0.01 0.00 1.25 0.00 0.00 34.83 34.41 1w0p s MET 96 CO -0.03 -0.12 -0.23 0.99 1.05 0.00 0.00 175.02 176.69 1w0p s THR 97 N 1.17 1.86 -0.02 10.11 2.01 0.42 -1.00 115.64 130.19 1w0p s THR 97 Ca -0.04 -0.96 0.01 0.00 0.31 0.00 0.00 61.69 61.01 1w0p s THR 97 Cb -0.14 -1.58 0.01 0.00 0.01 0.00 0.00 72.50 70.80 1w0p s THR 97 CO -0.03 0.52 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.49 1w0p s THR 98 N -0.14 0.43 -0.31 -0.82 2.01 -0.08 -0.72 115.64 116.00 1w0p s THR 98 Ca -0.03 -0.16 0.00 0.00 0.31 0.00 0.00 61.69 61.82 1w0p s THR 98 Cb -0.13 -0.41 0.07 0.00 0.01 0.00 0.00 72.50 72.05 1w0p s THR 98 CO 0.03 0.15 0.01 -1.61 -0.69 0.00 0.00 174.62 172.51 1w0p s GLU 99 N 0.30 2.16 0.22 4.92 2.02 -0.38 -0.12 118.70 127.82 1w0p s GLU 99 Ca -0.03 -1.47 -0.10 0.00 0.02 0.00 0.00 54.97 53.39 1w0p s GLU 99 Cb -0.07 -3.16 -0.01 0.00 0.10 0.00 0.00 34.13 30.98 1w0p s GLU 99 CO -0.00 -0.73 0.37 0.00 0.02 0.00 0.00 175.26 174.92 1w0p s MET 100 N 1.13 1.39 -0.05 1.61 0.23 -0.84 -0.85 119.30 121.93 1w0p s MET 100 Ca -0.02 -1.31 0.03 0.00 -1.03 0.00 0.00 55.69 53.36 1w0p s MET 100 Cb -0.20 0.41 0.01 0.00 -1.53 0.00 0.00 34.83 33.52 1w0p s MET 100 CO -0.04 -0.55 -0.12 0.21 -2.03 0.00 0.00 175.02 172.49 1w0p s LYS 101 N -4.03 1.54 -0.24 3.16 2.20 -0.15 -1.30 119.74 120.91 1w0p s LYS 101 Ca 0.25 -0.42 -0.14 0.00 -0.36 0.00 0.00 55.97 55.29 1w0p s LYS 101 Cb 0.02 -1.31 -0.04 0.00 -1.51 0.00 0.00 37.83 34.98 1w0p s LYS 101 CO 0.08 0.09 0.33 0.08 -0.36 0.00 0.00 175.35 175.57 1w0p s VAL 102 N 0.44 5.22 -0.09 4.02 1.01 -1.26 -0.62 120.40 129.12 1w0p s VAL 102 Ca -0.10 0.53 -0.06 0.00 0.00 0.00 0.00 61.98 62.35 1w0p s VAL 102 Cb -0.13 -3.66 -0.27 0.00 0.00 0.00 0.00 36.38 32.31 1w0p s VAL 102 CO 0.03 0.23 0.50 -0.07 0.00 0.00 0.00 175.10 175.79 1w0p h LEU 103 N 8.08 0.42 -7.16 3.92 3.38 -1.43 -3.40 115.31 119.11 1w0p h LEU 103 Ca -0.34 -0.83 0.21 0.00 0.09 0.00 0.00 57.88 57.01 1w0p h LEU 103 Cb 1.16 -0.14 -0.14 0.00 0.09 0.00 0.00 40.66 41.63 1w0p h LEU 103 CO 0.66 1.73 0.66 -0.94 0.09 0.00 0.00 178.44 180.65 1w0p s SER 104 N -7.00 -0.20 0.19 -0.43 1.04 -1.05 -4.99 113.70 101.25 1w0p s SER 104 Ca -0.18 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.15 1w0p s SER 104 Cb 0.06 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1w0p s SER 104 CO 0.80 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 175.15 1w0p n GLY 105 N -0.29 -0.68 0.00 7.32 0.00 -1.26 -1.22 105.19 109.07 1w0p n GLY 105 Ca -0.05 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1w0p n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w0p n GLY 106 N 0.00 4.42 3.87 -0.02 0.00 -0.40 -1.56 105.19 111.50 1w0p n GLY 106 Ca 0.00 -1.23 -0.28 0.00 0.00 0.00 0.00 46.02 44.51 1w0p n GLY 106 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1w0p n MET 107 N 0.00 -5.14 -2.94 1.61 2.81 -1.19 -4.10 117.12 108.17 1w0p n MET 107 Ca 0.00 0.58 -0.43 0.00 -1.81 0.00 0.00 57.70 56.04 1w0p n MET 107 Cb 0.00 -5.33 -0.04 0.00 -0.71 0.00 0.00 33.22 27.14 1w0p n MET 107 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1w0p s ILE 108 N -3.44 4.51 -0.35 2.02 -1.09 -0.52 -2.26 121.20 120.06 1w0p s ILE 108 Ca 0.44 -0.31 -0.04 0.00 -2.23 0.00 0.00 60.65 58.52 1w0p s ILE 108 Cb -0.22 -4.55 0.07 0.00 -1.58 0.00 0.00 42.46 36.17 1w0p s ILE 108 CO 0.83 -1.21 0.11 0.42 -1.23 0.00 0.00 174.94 173.87 1w0p s THR 109 N 3.59 3.41 -0.29 2.92 -4.23 -0.15 -1.69 115.64 119.20 1w0p s THR 109 Ca 0.21 -1.51 -0.01 0.00 -1.18 0.00 0.00 61.69 59.20 1w0p s THR 109 Cb -0.17 -3.07 0.05 0.00 1.34 0.00 0.00 72.50 70.65 1w0p s THR 109 CO 0.12 -0.33 -0.02 0.20 -0.54 0.00 0.00 174.62 174.05 1w0p s ASN 110 N 1.55 4.81 0.35 3.99 0.01 -1.26 -3.29 114.94 121.10 1w0p s ASN 110 Ca 0.00 -1.28 -0.10 0.00 -0.71 0.00 0.00 52.86 50.77 1w0p s ASN 110 Cb -0.21 -1.69 0.04 0.00 0.41 0.00 0.00 41.25 39.81 1w0p s ASN 110 CO -0.01 -0.25 0.65 0.00 -1.51 0.00 0.00 177.10 175.98 1w0p n TYR 111 N 4.60 -2.01 -4.31 2.20 4.11 0.18 -4.64 117.16 117.29 1w0p n TYR 111 Ca -0.13 -1.81 -0.21 0.00 -0.00 0.00 0.00 57.90 55.74 1w0p n TYR 111 Cb 0.43 0.75 -0.16 0.00 -0.00 0.00 0.00 39.34 40.36 1w0p n TYR 111 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.86 176.39 1w0p s TYR 112 N -2.89 0.97 -0.02 -3.48 5.04 -1.26 -0.64 117.35 115.07 1w0p s TYR 112 Ca 0.18 -0.31 0.05 0.00 -2.44 0.00 0.00 57.07 54.55 1w0p s TYR 112 Cb -0.04 -0.78 -0.01 0.00 0.35 0.00 0.00 41.96 41.48 1w0p s TYR 112 CO 0.13 -0.21 -0.17 0.00 -1.34 0.00 0.00 175.55 173.96 1w0p s ALA 113 N 0.80 1.39 0.56 3.97 0.00 -0.85 -3.80 121.76 123.84 1w0p s ALA 113 Ca -0.13 -0.70 0.04 0.00 0.00 0.00 0.00 51.96 51.17 1w0p s ALA 113 Cb -0.15 -0.38 0.04 0.00 0.00 0.00 0.00 23.12 22.64 1w0p s ALA 113 CO 0.01 0.32 0.34 0.54 0.00 0.00 0.00 175.76 176.98 1w0p s ASN 114 N -0.31 4.52 0.00 0.00 2.20 -0.82 -0.71 114.94 119.82 1w0p s ASN 114 Ca 0.05 -1.38 0.00 0.00 -0.94 0.00 0.00 52.86 50.58 1w0p s ASN 114 Cb -0.07 0.59 0.00 0.00 -2.00 0.00 0.00 41.25 39.77 1w0p s ASN 114 CO -0.00 -1.14 0.86 0.61 -2.94 0.00 0.00 177.10 174.49 1w0p n GLY 115 N -1.72 1.36 0.58 0.45 0.00 -1.26 -3.61 105.19 100.98 1w0p n GLY 115 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1w0p n GLY 115 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1w0p n THR 116 N 1.63 0.00 -4.04 2.61 -1.04 -1.16 -4.93 114.28 107.35 1w0p n THR 116 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 1w0p n THR 116 Cb 0.23 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.70 1w0p n THR 116 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1w0p s GLN 117 N -1.35 1.77 0.15 -2.82 -2.07 -1.19 -1.74 119.66 112.41 1w0p s GLN 117 Ca 0.00 -1.54 -0.22 0.00 -1.82 0.00 0.00 55.36 51.78 1w0p s GLN 117 Cb 0.00 0.46 0.06 0.00 -1.09 0.00 0.00 33.01 32.44 1w0p s GLN 117 CO 0.00 -0.74 0.56 -0.98 -1.32 0.00 0.00 175.29 172.81 1w0p s ARG 118 N -3.40 1.23 -0.28 9.60 1.70 -0.03 -1.94 118.95 125.83 1w0p s ARG 118 Ca 0.27 -0.51 -0.01 0.00 -0.47 0.00 0.00 55.73 55.00 1w0p s ARG 118 Cb -0.00 0.56 0.05 0.00 -0.57 0.00 0.00 34.95 34.98 1w0p s ARG 118 CO 0.15 -0.53 -0.04 0.08 -1.08 0.00 0.00 175.30 173.89 1w0p s VAL 119 N -3.73 2.81 -0.33 4.99 1.01 -1.25 -0.68 120.40 123.22 1w0p s VAL 119 Ca 0.01 -1.34 0.01 0.00 0.00 0.00 0.00 61.98 60.67 1w0p s VAL 119 Cb -0.00 -2.57 0.09 0.00 0.00 0.00 0.00 36.38 33.89 1w0p s VAL 119 CO -0.13 -0.01 0.05 -0.22 0.00 0.00 0.00 175.10 174.79 1w0p s LEU 120 N 1.24 4.48 0.11 3.92 2.96 -1.26 -4.35 118.68 125.79 1w0p s LEU 120 Ca -0.05 -1.82 -0.21 0.00 -0.22 0.00 0.00 54.13 51.83 1w0p s LEU 120 Cb -0.19 -1.68 -0.07 0.00 0.50 0.00 0.00 46.19 44.75 1w0p s LEU 120 CO -0.03 -0.36 0.64 -2.84 -1.32 0.00 0.00 176.35 172.44 1w0p s PRO 121 N 1.06 4.31 -0.23 0.98 0.02 -1.26 -1.76 135.00 138.11 1w0p s PRO 121 Ca 0.04 0.86 0.02 0.00 0.02 0.00 0.00 61.00 61.94 1w0p s PRO 121 Cb -0.20 -3.21 0.04 0.00 0.02 0.00 0.00 34.50 31.15 1w0p s PRO 121 CO -0.05 0.60 -0.14 0.42 -0.33 0.00 0.00 177.00 177.49 1w0p s ILE 122 N -1.16 2.11 -0.08 2.83 1.01 0.84 -4.36 121.20 122.39 1w0p s ILE 122 Ca 0.32 -1.36 -0.06 0.00 0.00 0.00 0.00 60.65 59.55 1w0p s ILE 122 Cb -0.20 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.12 1w0p s ILE 122 CO 0.21 0.18 0.16 -0.63 0.00 0.00 0.00 174.94 174.87 1w0p s ILE 123 N 1.18 5.47 0.26 2.92 1.01 -0.68 -1.32 121.20 130.04 1w0p s ILE 123 Ca -0.04 0.12 -0.21 0.00 0.00 0.00 0.00 60.65 60.52 1w0p s ILE 123 Cb -0.17 -3.45 0.05 0.00 0.01 0.00 0.00 42.46 38.89 1w0p s ILE 123 CO -0.08 0.53 0.84 -0.94 0.00 0.00 0.00 174.94 175.28 1w0p s SER 124 N -1.31 -0.14 -0.15 3.58 1.04 -0.55 -1.44 113.70 114.72 1w0p s SER 124 Ca 0.19 -0.70 -0.03 0.00 0.48 0.00 0.00 55.95 55.89 1w0p s SER 124 Cb -0.12 0.67 -0.03 0.00 0.10 0.00 0.00 66.02 66.64 1w0p s SER 124 CO 0.09 -1.28 -0.05 -0.76 0.98 0.00 0.00 173.24 172.21 1w0p s LEU 125 N -3.02 3.16 0.00 2.42 1.43 -0.60 -0.54 118.68 121.52 1w0p s LEU 125 Ca 0.14 -0.16 -0.13 0.00 -1.03 0.00 0.00 54.13 52.95 1w0p s LEU 125 Cb -0.04 -1.75 0.17 0.00 0.03 0.00 0.00 46.19 44.60 1w0p s LEU 125 CO 0.07 0.17 1.01 -0.90 0.23 0.00 0.00 176.35 176.93 1w0p n ASP 126 N 3.51 0.08 0.33 2.29 5.68 0.08 -4.73 116.55 123.79 1w0p n ASP 126 Ca -0.17 -1.37 0.21 0.00 -0.50 0.00 0.00 54.79 52.96 1w0p n ASP 126 Cb 0.52 -0.77 1.11 0.00 -1.14 0.00 0.00 41.12 40.84 1w0p n ASP 126 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1w0p h SER 127 N -1.33 0.00 0.04 -1.12 4.64 -2.00 -0.24 113.55 113.55 1w0p h SER 127 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1w0p h SER 127 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1w0p h SER 127 CO 0.23 0.00 -0.29 -1.20 -0.87 0.00 0.00 176.83 174.71 1w0p n SER 128 N -3.13 1.92 0.00 4.97 7.64 -1.26 -4.95 113.62 118.81 1w0p n SER 128 Ca -0.03 -1.46 0.00 0.00 1.01 0.00 0.00 58.87 58.40 1w0p n SER 128 Cb 0.14 0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 1w0p n SER 128 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1w0p n GLY 129 N 1.36 0.74 3.78 0.23 0.00 -0.10 -4.98 105.19 106.22 1w0p n GLY 129 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1w0p n GLY 129 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1w0p s ASN 130 N -2.54 7.10 -0.20 1.61 0.01 -1.26 -4.70 114.94 114.96 1w0p s ASN 130 Ca 0.00 1.98 -0.25 0.00 -0.71 0.00 0.00 52.86 53.88 1w0p s ASN 130 Cb 0.00 -2.59 -0.01 0.00 0.41 0.00 0.00 41.25 39.06 1w0p s ASN 130 CO 0.00 -0.24 0.81 -0.22 -1.51 0.00 0.00 177.10 175.94 1w0p s LEU 131 N -2.19 4.13 0.15 0.60 2.96 -0.10 -0.74 118.68 123.49 1w0p s LEU 131 Ca 0.52 1.08 0.02 0.00 -0.22 0.00 0.00 54.13 55.54 1w0p s LEU 131 Cb -0.22 -3.18 -0.04 0.00 0.50 0.00 0.00 46.19 43.24 1w0p s LEU 131 CO 0.28 -0.44 -0.04 0.68 -1.32 0.00 0.00 176.35 175.51 1w0p s VAL 132 N 2.42 0.79 0.00 1.68 -7.23 0.30 -0.10 120.40 118.26 1w0p s VAL 132 Ca 0.36 -1.98 0.03 0.00 -1.81 0.00 0.00 61.98 58.57 1w0p s VAL 132 Cb -0.16 -1.94 -0.01 0.00 0.56 0.00 0.00 36.38 34.84 1w0p s VAL 132 CO 0.10 -0.65 -0.09 0.54 -0.31 0.00 0.00 175.10 174.69 1w0p s VAL 133 N -3.58 0.67 0.18 1.32 0.11 -0.43 -1.48 120.40 117.20 1w0p s VAL 133 Ca 0.19 -0.45 0.06 0.00 -2.93 0.00 0.00 61.98 58.85 1w0p s VAL 133 Cb 0.05 -0.58 -0.05 0.00 -1.53 0.00 0.00 36.38 34.27 1w0p s VAL 133 CO 0.01 0.13 -0.12 -1.61 -3.33 0.00 0.00 175.10 170.17 1w0p s GLU 134 N -0.37 1.23 -0.06 1.54 2.02 -0.44 -1.53 118.70 121.10 1w0p s GLU 134 Ca 0.02 -1.54 0.02 0.00 0.02 0.00 0.00 54.97 53.49 1w0p s GLU 134 Cb -0.04 -0.93 0.01 0.00 0.10 0.00 0.00 34.13 33.27 1w0p s GLU 134 CO -0.00 0.14 -0.12 -0.06 0.02 0.00 0.00 175.26 175.24 1w0p s PHE 135 N -3.11 1.38 0.19 1.61 0.40 -1.26 -0.11 117.98 117.08 1w0p s PHE 135 Ca 0.21 -0.49 -0.32 0.00 -0.60 0.00 0.00 56.93 55.73 1w0p s PHE 135 Cb 0.01 -1.02 -0.12 0.00 0.51 0.00 0.00 43.02 42.40 1w0p s PHE 135 CO 0.05 -0.25 1.74 -1.91 0.70 0.00 0.00 175.22 175.54 1w0p n GLU 136 N 3.76 2.76 0.00 0.44 2.13 -0.72 -1.18 120.64 127.82 1w0p n GLU 136 Ca -0.23 1.00 0.00 0.00 0.66 0.00 0.00 57.16 58.59 1w0p n GLU 136 Cb 0.52 -2.85 0.00 0.00 0.27 0.00 0.00 31.44 29.38 1w0p n GLU 136 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1w0p n GLY 137 N 3.99 0.50 3.24 8.31 0.00 -1.26 -4.77 105.19 115.20 1w0p n GLY 137 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1w0p n GLY 137 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1w0p s GLN 138 N -0.92 1.37 0.36 1.61 -0.21 -0.33 -5.08 119.66 116.47 1w0p s GLN 138 Ca 0.00 -0.91 -0.04 0.00 0.02 0.00 0.00 55.36 54.43 1w0p s GLN 138 Cb 0.00 -1.47 -0.04 0.00 1.00 0.00 0.00 33.01 32.50 1w0p s GLN 138 CO 0.00 0.38 0.62 -0.08 -2.12 0.00 0.00 175.29 174.09 1w0p s THR 139 N -0.78 5.00 0.00 -0.19 -1.32 -1.26 -4.52 115.64 112.57 1w0p s THR 139 Ca 0.07 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.55 1w0p s THR 139 Cb -0.09 -3.80 0.00 0.00 -1.51 0.00 0.00 72.50 67.11 1w0p s THR 139 CO 0.02 -0.52 0.00 0.61 -2.21 0.00 0.00 174.62 172.52 1w0p n GLY 140 N -1.48 -1.79 3.82 6.08 0.00 -1.26 -4.99 105.19 105.56 1w0p n GLY 140 Ca -0.02 -1.61 -0.07 0.00 0.00 0.00 0.00 46.02 44.32 1w0p n GLY 140 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1w0p s ARG 141 N 0.00 1.76 -0.06 1.61 1.70 -1.26 -4.71 118.95 117.98 1w0p s ARG 141 Ca 0.00 -1.04 0.01 0.00 -0.47 0.00 0.00 55.73 54.23 1w0p s ARG 141 Cb 0.00 0.59 0.02 0.00 -0.57 0.00 0.00 34.95 34.99 1w0p s ARG 141 CO 0.00 -0.80 -0.06 0.99 -1.08 0.00 0.00 175.30 174.35 1w0p s THR 142 N -3.91 0.71 -0.16 4.99 2.01 -0.58 -4.99 115.64 113.70 1w0p s THR 142 Ca 0.13 -0.19 -0.28 0.00 0.31 0.00 0.00 61.69 61.66 1w0p s THR 142 Cb -0.05 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.73 1w0p s THR 142 CO 0.07 0.27 0.96 -0.69 -0.69 0.00 0.00 174.62 174.54 1w0p s VAL 143 N 1.07 4.79 -0.15 3.82 1.01 -1.26 -1.32 120.40 128.36 1w0p s VAL 143 Ca -0.08 1.90 -0.02 0.00 0.00 0.00 0.00 61.98 63.78 1w0p s VAL 143 Cb -0.14 -4.25 -0.24 0.00 0.00 0.00 0.00 36.38 31.75 1w0p s VAL 143 CO -0.01 -0.03 0.24 0.18 0.00 0.00 0.00 175.10 175.48 1w0p n LEU 144 N 5.41 2.48 -3.55 3.92 4.77 0.85 -4.99 117.00 125.89 1w0p n LEU 144 Ca 0.08 0.14 -0.14 0.00 -0.03 0.00 0.00 56.01 56.06 1w0p n LEU 144 Cb 0.48 -0.91 -0.05 0.00 -2.33 0.00 0.00 43.42 40.61 1w0p n LEU 144 CO 0.51 0.82 0.31 0.00 -1.33 0.00 0.00 177.39 177.70 1w0p s ALA 145 N -2.55 -1.42 0.30 -1.18 0.00 -1.09 -5.01 121.76 110.82 1w0p s ALA 145 Ca -0.23 0.69 0.02 0.00 0.00 0.00 0.00 51.96 52.44 1w0p s ALA 145 Cb 0.07 0.38 -0.05 0.00 0.00 0.00 0.00 23.12 23.52 1w0p s ALA 145 CO 0.74 -0.51 0.10 0.95 0.00 0.00 0.00 175.76 177.03 1w0p s THR 146 N -2.39 0.71 0.00 0.00 -4.23 -1.26 -0.92 115.64 107.54 1w0p s THR 146 Ca -0.06 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 1w0p s THR 146 Cb -0.01 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.20 1w0p s THR 146 CO -0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 1w0p n GLY 147 N -0.58 0.75 0.32 3.99 0.00 -1.26 -3.02 105.19 105.39 1w0p n GLY 147 Ca -0.01 -0.73 0.10 0.00 0.00 0.00 0.00 46.02 45.38 1w0p n GLY 147 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1w0p h THR 148 N 0.00 0.96 -0.06 2.61 2.02 -1.98 -1.84 112.91 114.61 1w0p h THR 148 Ca 0.00 -0.10 0.02 0.00 0.77 0.00 0.00 66.41 67.10 1w0p h THR 148 Cb 0.00 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 67.04 1w0p h THR 148 CO 0.00 0.05 0.05 0.00 0.37 0.00 0.00 175.52 176.00 1w0p h ALA 149 N 1.79 1.90 -0.33 6.16 0.00 -1.93 -2.43 119.26 124.42 1w0p h ALA 149 Ca 0.17 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1w0p h ALA 149 Cb 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1w0p h ALA 149 CO -0.04 -0.09 0.22 0.00 0.00 0.00 0.00 179.25 179.35 1w0p h ALA 150 N 1.95 2.01 -0.38 0.00 0.00 -1.35 -2.62 119.26 118.88 1w0p h ALA 150 Ca 0.03 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 1w0p h ALA 150 Cb 0.14 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 17.76 1w0p h ALA 150 CO -0.00 -0.07 -0.04 0.25 0.00 0.00 0.00 179.25 179.38 1w0p n THR 151 N -4.48 2.57 -3.64 0.00 -2.24 -0.91 -4.58 114.28 100.99 1w0p n THR 151 Ca 0.04 -2.66 -0.22 0.00 -2.27 0.00 0.00 64.05 58.94 1w0p n THR 151 Cb 0.23 -0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 1w0p n THR 151 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1w0p s GLU 152 N -3.23 2.47 0.35 -0.78 2.02 -0.99 -4.69 118.70 113.85 1w0p s GLU 152 Ca 0.45 -1.61 -0.27 0.00 0.02 0.00 0.00 54.97 53.56 1w0p s GLU 152 Cb 0.41 -2.32 -0.09 0.00 0.10 0.00 0.00 34.13 32.23 1w0p s GLU 152 CO 0.01 -0.23 1.15 0.71 0.02 0.00 0.00 175.26 176.92 1w0p s TYR 153 N -2.51 3.26 0.07 1.61 2.02 -1.26 -4.46 117.35 116.08 1w0p s TYR 153 Ca 0.47 1.59 -0.05 0.00 -0.37 0.00 0.00 57.07 58.70 1w0p s TYR 153 Cb -0.02 -3.37 -0.02 0.00 -0.40 0.00 0.00 41.96 38.15 1w0p s TYR 153 CO 0.27 -1.06 0.09 -1.01 -1.57 0.00 0.00 175.55 172.27 1w0p s HIS 154 N -1.31 0.29 -0.22 2.71 3.76 -0.42 -4.98 115.29 115.13 1w0p s HIS 154 Ca 0.52 -0.75 -0.06 0.00 -0.15 0.00 0.00 55.06 54.61 1w0p s HIS 154 Cb -0.32 -0.19 -0.03 0.00 1.11 0.00 0.00 32.58 33.15 1w0p s HIS 154 CO 0.40 -0.46 0.04 0.21 -0.85 0.00 0.00 174.74 174.09 1w0p s LYS 155 N -3.69 3.70 -0.07 1.40 2.20 -1.26 -1.99 119.74 120.03 1w0p s LYS 155 Ca 0.04 -0.47 0.01 0.00 -0.36 0.00 0.00 55.97 55.20 1w0p s LYS 155 Cb 0.05 -3.20 -0.03 0.00 -1.51 0.00 0.00 37.83 33.14 1w0p s LYS 155 CO -0.10 -0.01 -0.10 -0.06 -0.36 0.00 0.00 175.35 174.72 1w0p s PHE 156 N 1.11 2.86 -0.02 4.03 0.40 0.83 -0.56 117.98 126.62 1w0p s PHE 156 Ca 0.03 -0.09 0.01 0.00 -0.60 0.00 0.00 56.93 56.29 1w0p s PHE 156 Cb -0.14 -1.70 0.01 0.00 0.51 0.00 0.00 43.02 41.70 1w0p s PHE 156 CO 0.02 0.24 -0.04 -1.21 0.70 0.00 0.00 175.22 174.94 1w0p s GLU 157 N -0.66 0.52 -0.15 0.44 2.02 -0.39 -0.90 118.70 119.57 1w0p s GLU 157 Ca 0.10 -0.09 0.01 0.00 0.02 0.00 0.00 54.97 55.01 1w0p s GLU 157 Cb -0.11 -0.56 0.02 0.00 0.10 0.00 0.00 34.13 33.58 1w0p s GLU 157 CO 0.01 -0.01 -0.17 -1.17 0.02 0.00 0.00 175.26 173.94 1w0p s LEU 158 N 0.49 1.89 -0.13 1.80 2.96 -0.17 -0.22 118.68 125.30 1w0p s LEU 158 Ca -0.06 -0.54 0.03 0.00 -0.22 0.00 0.00 54.13 53.34 1w0p s LEU 158 Cb -0.09 -1.30 0.01 0.00 0.50 0.00 0.00 46.19 45.31 1w0p s LEU 158 CO -0.00 -0.01 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.10 1w0p s VAL 159 N 1.24 2.07 -0.21 1.68 1.01 -0.23 -1.09 120.40 124.87 1w0p s VAL 159 Ca 0.01 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 60.97 1w0p s VAL 159 Cb -0.14 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 1w0p s VAL 159 CO -0.09 0.55 -0.06 0.12 0.00 0.00 0.00 175.10 175.63 1w0p s PHE 160 N 0.70 2.94 -0.14 5.22 5.36 -0.50 -0.85 117.98 130.71 1w0p s PHE 160 Ca -0.10 -0.94 -0.05 0.00 -0.96 0.00 0.00 56.93 54.88 1w0p s PHE 160 Cb -0.16 -2.08 -0.04 0.00 -0.34 0.00 0.00 43.02 40.41 1w0p s PHE 160 CO 0.01 -0.53 0.04 -0.51 -1.46 0.00 0.00 175.22 172.76 1w0p s LEU 161 N 1.37 3.72 0.77 6.12 1.43 -1.09 -2.57 118.68 128.44 1w0p s LEU 161 Ca 0.05 0.11 -0.11 0.00 -1.03 0.00 0.00 54.13 53.14 1w0p s LEU 161 Cb -0.14 -1.90 0.05 0.00 0.03 0.00 0.00 46.19 44.23 1w0p s LEU 161 CO -0.03 0.26 1.09 -2.16 0.23 0.00 0.00 176.35 175.73 1w0p s PRO 162 N -0.15 2.30 0.00 1.29 0.04 -1.26 -3.57 135.00 133.64 1w0p s PRO 162 Ca 0.06 0.74 0.00 0.00 0.04 0.00 0.00 61.00 61.84 1w0p s PRO 162 Cb -0.12 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.48 1w0p s PRO 162 CO 0.02 -1.50 0.00 0.41 0.04 0.00 0.00 177.00 175.97 1w0p n GLY 163 N -2.03 -2.07 0.28 0.56 0.00 -1.26 -4.71 105.19 95.97 1w0p n GLY 163 Ca 0.07 -1.45 -0.02 0.00 0.00 0.00 0.00 46.02 44.62 1w0p n GLY 163 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1w0p h SER 164 N 0.00 0.66 -2.23 1.61 4.64 -1.98 -3.21 113.55 113.04 1w0p h SER 164 Ca 0.00 -0.13 -0.60 0.00 -0.47 0.00 0.00 61.79 60.59 1w0p h SER 164 Cb 0.00 -0.17 -0.42 0.00 -0.31 0.00 0.00 62.40 61.50 1w0p h SER 164 CO 0.00 0.70 -0.63 0.59 -0.87 0.00 0.00 176.83 176.63 1w0p n ASN 165 N -4.26 3.47 -4.73 4.97 3.02 -1.26 -5.09 115.26 111.39 1w0p n ASN 165 Ca 0.03 -3.38 -0.42 0.00 -0.03 0.00 0.00 54.58 50.78 1w0p n ASN 165 Cb 0.26 -0.67 -0.03 0.00 -0.61 0.00 0.00 39.78 38.73 1w0p n ASN 165 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1w0p s PRO 166 N -2.33 4.17 0.17 3.52 0.04 -1.21 -5.01 135.00 134.33 1w0p s PRO 166 Ca 0.39 2.50 -0.06 0.00 0.04 0.00 0.00 61.00 63.86 1w0p s PRO 166 Cb 0.14 -3.09 -0.02 0.00 0.04 0.00 0.00 34.50 31.57 1w0p s PRO 166 CO -0.03 -0.64 0.22 -1.54 0.04 0.00 0.00 177.00 175.05 1w0p s SER 167 N 0.89 0.12 0.27 6.66 1.04 -1.23 -4.61 113.70 116.82 1w0p s SER 167 Ca 0.69 -1.03 0.12 0.00 0.48 0.00 0.00 55.95 56.20 1w0p s SER 167 Cb -0.47 0.40 -0.05 0.00 0.10 0.00 0.00 66.02 66.01 1w0p s SER 167 CO 0.37 -0.86 -0.19 0.00 0.98 0.00 0.00 173.24 173.54 1w0p s ALA 168 N -4.02 2.75 -0.01 5.32 0.00 -0.40 -2.67 121.76 122.74 1w0p s ALA 168 Ca 0.22 -1.83 0.05 0.00 0.00 0.00 0.00 51.96 50.41 1w0p s ALA 168 Cb 0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1w0p s ALA 168 CO 0.03 0.30 -0.16 -1.54 0.00 0.00 0.00 175.76 174.39 1w0p s SER 169 N -3.40 1.94 -0.11 0.00 1.04 -0.03 -0.56 113.70 112.59 1w0p s SER 169 Ca 0.29 -0.31 -0.00 0.00 0.48 0.00 0.00 55.95 56.40 1w0p s SER 169 Cb -0.06 -0.21 -0.02 0.00 0.10 0.00 0.00 66.02 65.83 1w0p s SER 169 CO 0.15 0.19 -0.09 0.12 0.98 0.00 0.00 173.24 174.59 1w0p s PHE 170 N -0.42 2.89 0.03 5.02 5.36 0.27 -1.06 117.98 130.07 1w0p s PHE 170 Ca 0.06 -0.30 0.06 0.00 -0.96 0.00 0.00 56.93 55.79 1w0p s PHE 170 Cb -0.06 -1.81 -0.02 0.00 -0.34 0.00 0.00 43.02 40.78 1w0p s PHE 170 CO -0.00 0.04 -0.17 0.71 -1.46 0.00 0.00 175.22 174.34 1w0p s TYR 171 N -0.11 1.50 -0.21 10.12 1.51 0.69 -0.50 117.35 130.35 1w0p s TYR 171 Ca 0.00 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 55.74 1w0p s TYR 171 Cb -0.13 -0.91 0.05 0.00 -0.11 0.00 0.00 41.96 40.85 1w0p s TYR 171 CO 0.03 0.04 -0.10 0.12 -1.11 0.00 0.00 175.55 174.53 1w0p s PHE 172 N -0.70 2.50 -1.53 2.71 5.36 0.10 -1.26 117.98 125.17 1w0p s PHE 172 Ca 0.05 -1.68 -0.13 0.00 -0.96 0.00 0.00 56.93 54.21 1w0p s PHE 172 Cb -0.08 -1.67 0.08 0.00 -0.34 0.00 0.00 43.02 41.02 1w0p s PHE 172 CO 0.01 -0.76 0.97 -0.25 -1.46 0.00 0.00 175.22 173.73 1w0p n ASP 173 N 4.66 -4.66 0.00 6.13 8.00 0.27 -1.51 116.55 129.44 1w0p n ASP 173 Ca -0.14 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.57 1w0p n ASP 173 Cb 0.46 -3.88 0.00 0.00 -0.02 0.00 0.00 41.12 37.68 1w0p n ASP 173 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1w0p n GLY 174 N -1.69 1.43 3.64 0.44 0.00 -1.26 -5.04 105.19 102.71 1w0p n GLY 174 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 1w0p n GLY 174 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1w0p s LYS 175 N -0.34 3.72 0.08 1.61 2.20 -0.57 -4.85 119.74 121.58 1w0p s LYS 175 Ca 0.00 -0.37 -0.31 0.00 -0.36 0.00 0.00 55.97 54.94 1w0p s LYS 175 Cb 0.00 -3.09 -0.09 0.00 -1.51 0.00 0.00 37.83 33.15 1w0p s LYS 175 CO 0.00 0.38 1.68 -1.17 -0.36 0.00 0.00 175.35 175.89 1w0p s LEU 176 N 0.04 4.37 -0.18 5.43 2.96 -1.26 -0.72 118.68 129.32 1w0p s LEU 176 Ca 0.04 2.53 -0.05 0.00 -0.22 0.00 0.00 54.13 56.43 1w0p s LEU 176 Cb -0.12 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 42.91 1w0p s LEU 176 CO 0.01 -0.91 -0.20 -0.38 -1.32 0.00 0.00 176.35 173.56 1w0p n ILE 177 N 4.74 0.98 -3.77 6.68 2.08 0.35 -4.92 119.36 125.49 1w0p n ILE 177 Ca 0.16 -0.30 -0.14 0.00 0.56 0.00 0.00 62.75 63.04 1w0p n ILE 177 Cb 0.40 -1.49 -0.14 0.00 -0.75 0.00 0.00 39.64 37.66 1w0p n ILE 177 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 1w0p s ARG 178 N -2.33 0.07 0.35 0.38 6.06 -1.16 -5.01 118.95 117.31 1w0p s ARG 178 Ca -0.24 0.29 0.09 0.00 -2.50 0.00 0.00 55.73 53.37 1w0p s ARG 178 Cb 0.08 -0.15 -0.06 0.00 0.06 0.00 0.00 34.95 34.88 1w0p s ARG 178 CO 0.34 -0.14 -0.05 0.34 -2.50 0.00 0.00 175.30 173.29 1w0p s ASP 179 N 0.95 3.88 -1.48 -2.12 2.15 -1.26 -0.56 116.67 118.22 1w0p s ASP 179 Ca -0.07 -1.17 -0.12 0.00 0.43 0.00 0.00 52.55 51.62 1w0p s ASP 179 Cb -0.10 -0.40 0.07 0.00 -0.30 0.00 0.00 42.92 42.18 1w0p s ASP 179 CO -0.04 -0.25 0.89 0.59 -0.17 0.00 0.00 175.17 176.19 1w0p n ASN 180 N -0.86 -5.04 -4.67 -0.34 3.02 -1.09 -4.91 115.26 101.37 1w0p n ASN 180 Ca -0.05 -0.63 -0.42 0.00 -0.03 0.00 0.00 54.58 53.45 1w0p n ASN 180 Cb 0.64 -4.03 -0.03 0.00 -0.61 0.00 0.00 39.78 35.75 1w0p n ASN 180 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1w0p s ILE 181 N -3.23 3.85 0.02 2.41 1.01 0.28 -4.78 121.20 120.76 1w0p s ILE 181 Ca 0.57 1.11 -0.22 0.00 0.00 0.00 0.00 60.65 62.12 1w0p s ILE 181 Cb -0.28 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.41 1w0p s ILE 181 CO 0.71 -0.06 0.64 -1.10 0.00 0.00 0.00 174.94 175.13 1w0p s GLN 182 N 3.25 4.37 0.57 2.79 -1.52 -1.26 -1.27 119.66 126.59 1w0p s GLN 182 Ca 0.64 0.83 -0.20 0.00 -1.95 0.00 0.00 55.36 54.68 1w0p s GLN 182 Cb -0.29 -3.34 -0.04 0.00 -0.22 0.00 0.00 33.01 29.12 1w0p s GLN 182 CO 0.24 0.36 1.27 -2.14 -0.25 0.00 0.00 175.29 174.77 1w0p s PRO 183 N -0.22 3.02 0.17 2.91 0.02 -1.26 -4.92 135.00 134.73 1w0p s PRO 183 Ca 0.33 1.99 0.10 0.00 0.02 0.00 0.00 61.00 63.44 1w0p s PRO 183 Cb -0.19 -2.06 -0.04 0.00 0.02 0.00 0.00 34.50 32.22 1w0p s PRO 183 CO 0.19 -1.21 -0.15 0.95 -0.33 0.00 0.00 177.00 176.46 1w0p s THR 184 N -1.46 2.92 0.30 0.99 -4.23 0.14 -4.88 115.64 109.42 1w0p s THR 184 Ca 0.75 -1.73 -0.30 0.00 -1.18 0.00 0.00 61.69 59.23 1w0p s THR 184 Cb -0.35 -2.42 -0.11 0.00 1.34 0.00 0.00 72.50 70.96 1w0p s THR 184 CO 0.39 -0.08 1.57 0.00 -0.54 0.00 0.00 174.62 175.95 1w0p s ALA 185 N -1.62 3.72 -0.26 3.99 0.00 -1.26 -0.85 121.76 125.49 1w0p s ALA 185 Ca 0.23 1.54 -0.26 0.00 0.00 0.00 0.00 51.96 53.47 1w0p s ALA 185 Cb -0.09 -3.63 0.11 0.00 0.00 0.00 0.00 23.12 19.50 1w0p s ALA 185 CO 0.13 -0.96 0.93 0.45 0.00 0.00 0.00 175.76 176.30 1w0p s SER 186 N 0.42 -0.54 0.00 0.00 0.15 -0.71 -4.80 113.70 108.22 1w0p s SER 186 Ca 0.62 0.98 0.23 0.00 0.70 0.00 0.00 55.95 58.48 1w0p s SER 186 Cb -0.47 0.97 0.21 0.00 -1.71 0.00 0.00 66.02 65.02 1w0p s SER 186 CO 0.49 -0.22 1.21 0.29 1.20 0.00 0.00 173.24 176.21 1w0p n LYS 187 N 2.14 0.01 -1.68 5.44 4.76 -1.26 -2.98 118.16 124.59 1w0p n LYS 187 Ca -0.13 -0.01 -0.36 0.00 -2.87 0.00 0.00 58.31 54.94 1w0p n LYS 187 Cb 0.56 -1.50 0.07 0.00 -1.84 0.00 0.00 35.03 32.32 1w0p n LYS 187 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1w0p s GLN 188 N -2.99 2.48 -0.39 1.97 -0.21 -1.26 -4.76 119.66 114.49 1w0p s GLN 188 Ca 0.10 1.93 0.03 0.00 0.02 0.00 0.00 55.36 57.44 1w0p s GLN 188 Cb 0.17 -1.85 0.16 0.00 1.00 0.00 0.00 33.01 32.49 1w0p s GLN 188 CO 0.77 -1.62 0.38 1.21 -2.12 0.00 0.00 175.29 173.91 1w0p s ASN 189 N -1.63 1.17 0.00 5.90 3.84 -1.26 -3.50 114.94 119.46 1w0p s ASN 189 Ca 0.79 -1.97 0.00 0.00 0.21 0.00 0.00 52.86 51.89 1w0p s ASN 189 Cb -0.34 0.38 0.00 0.00 -0.55 0.00 0.00 41.25 40.75 1w0p s ASN 189 CO 0.40 -0.23 0.00 1.15 -2.79 0.00 0.00 177.10 175.64 1w0p n MET 190 N 3.81 0.00 -3.12 0.43 0.00 0.11 -4.75 117.12 113.59 1w0p n MET 190 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 57.70 57.47 1w0p n MET 190 Cb 0.46 0.00 -0.05 0.00 0.00 0.00 0.00 33.22 33.63 1w0p n MET 190 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 1w0p s ILE 191 N -2.00 5.00 0.01 3.17 1.01 -0.49 -2.00 121.20 125.90 1w0p s ILE 191 Ca 0.00 1.34 0.01 0.00 0.00 0.00 0.00 60.65 62.00 1w0p s ILE 191 Cb 0.00 -3.99 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 1w0p s ILE 191 CO 0.00 0.32 -0.05 -0.69 0.00 0.00 0.00 174.94 174.52 1w0p s VAL 192 N 0.41 0.34 -0.06 2.92 1.01 0.19 -1.34 120.40 123.87 1w0p s VAL 192 Ca 0.34 -0.50 -0.10 0.00 0.00 0.00 0.00 61.98 61.72 1w0p s VAL 192 Cb -0.18 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 35.87 1w0p s VAL 192 CO 0.17 -0.12 0.24 -1.66 0.00 0.00 0.00 175.10 173.73 1w0p s TRP 193 N -0.61 -0.19 -1.99 5.22 1.48 -0.88 -0.65 118.94 121.32 1w0p s TRP 193 Ca -0.04 0.41 0.00 0.00 -1.06 0.00 0.00 56.10 55.42 1w0p s TRP 193 Cb -0.05 0.06 0.00 0.00 -1.16 0.00 0.00 33.47 32.32 1w0p s TRP 193 CO -0.00 -0.22 0.00 0.41 -4.06 0.00 0.00 176.95 173.08 1w0p n GLY 194 N 2.30 0.58 3.31 3.67 0.00 -1.21 -1.03 105.19 112.81 1w0p n GLY 194 Ca -0.17 -2.00 -0.46 0.00 0.00 0.00 0.00 46.02 43.40 1w0p n GLY 194 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1w0p s ASN 195 N -4.00 6.20 -0.95 1.61 2.47 0.96 -0.98 114.94 120.26 1w0p s ASN 195 Ca 0.00 -1.81 -0.06 0.00 0.42 0.00 0.00 52.86 51.42 1w0p s ASN 195 Cb 0.00 -2.21 0.02 0.00 -1.45 0.00 0.00 41.25 37.61 1w0p s ASN 195 CO 0.00 -0.85 2.74 0.61 -3.72 0.00 0.00 177.10 175.88 1w0p n GLY 196 N 5.22 4.55 3.64 1.21 0.00 -0.96 -1.95 105.19 116.90 1w0p n GLY 196 Ca -0.13 -1.82 -0.08 0.00 0.00 0.00 0.00 46.02 43.98 1w0p n GLY 196 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1w0p s SER 197 N 0.83 -0.91 0.10 1.61 0.15 -1.26 -5.00 113.70 109.22 1w0p s SER 197 Ca 0.60 1.51 0.02 0.00 0.70 0.00 0.00 55.95 58.77 1w0p s SER 197 Cb 0.26 1.40 -0.24 0.00 -1.71 0.00 0.00 66.02 65.73 1w0p s SER 197 CO -0.12 -0.24 1.22 0.28 1.20 0.00 0.00 173.24 175.58 1w0p h SER 198 N 6.65 0.18 0.42 5.45 0.02 -1.89 -3.26 113.55 121.12 1w0p h SER 198 Ca -0.30 -0.20 -0.31 0.00 -0.84 0.00 0.00 61.79 60.15 1w0p h SER 198 Cb 1.22 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.67 1w0p h SER 198 CO 0.14 1.15 -1.71 -0.55 -1.14 0.00 0.00 176.83 174.73 1w0p h ASN 199 N 0.03 0.19 -3.58 3.07 7.08 -1.96 -3.14 115.58 117.27 1w0p h ASN 199 Ca -0.06 -0.36 -0.62 0.00 -3.08 0.00 0.00 56.30 52.17 1w0p h ASN 199 Cb 1.86 -0.06 -0.13 0.00 -2.08 0.00 0.00 38.32 37.90 1w0p h ASN 199 CO 0.16 1.32 0.01 -0.89 -2.08 0.00 0.00 177.43 175.95 1w0p s THR 200 N -2.60 5.03 0.26 6.14 2.01 -1.26 -4.94 115.64 120.29 1w0p s THR 200 Ca -0.10 0.77 -0.29 0.00 0.31 0.00 0.00 61.69 62.38 1w0p s THR 200 Cb 0.07 -3.89 -0.09 0.00 0.01 0.00 0.00 72.50 68.61 1w0p s THR 200 CO 0.82 -0.01 1.17 -1.81 -0.69 0.00 0.00 174.62 174.09 1w0p s ASP 201 N 1.61 7.11 -0.21 3.53 1.01 -1.26 -4.66 116.67 123.80 1w0p s ASP 201 Ca 0.21 2.34 -0.17 0.00 0.71 0.00 0.00 52.55 55.64 1w0p s ASP 201 Cb -0.15 -2.63 0.06 0.00 1.01 0.00 0.00 42.92 41.21 1w0p s ASP 201 CO 0.10 -0.29 0.55 -0.83 0.21 0.00 0.00 175.17 174.91 1w0p s GLY 202 N -0.49 -0.43 -0.04 0.21 0.00 -0.66 -1.28 107.32 104.64 1w0p s GLY 202 Ca 0.48 1.65 0.01 0.00 0.00 0.00 0.00 44.72 46.86 1w0p s GLY 202 CO 0.42 1.50 -0.04 0.14 0.00 0.00 0.00 173.10 175.12 1w0p s VAL 203 N 0.59 0.52 -0.05 1.40 1.01 -0.36 -0.54 120.40 122.98 1w0p s VAL 203 Ca -0.02 -0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.68 1w0p s VAL 203 Cb -0.05 -0.55 0.03 0.00 0.00 0.00 0.00 36.38 35.82 1w0p s VAL 203 CO -0.03 0.22 0.37 0.00 0.00 0.00 0.00 175.10 175.66 1w0p s ALA 204 N 0.90 -0.94 -0.15 5.51 0.00 -1.02 -1.04 121.76 125.02 1w0p s ALA 204 Ca -0.11 0.64 -0.03 0.00 0.00 0.00 0.00 51.96 52.46 1w0p s ALA 204 Cb -0.14 -0.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 1w0p s ALA 204 CO 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 175.76 175.47 1w0p s ALA 205 N -0.90 3.00 -0.17 0.00 0.00 0.21 -0.66 121.76 123.25 1w0p s ALA 205 Ca -0.10 -0.82 -0.02 0.00 0.00 0.00 0.00 51.96 51.02 1w0p s ALA 205 Cb -0.04 -1.52 -0.01 0.00 0.00 0.00 0.00 23.12 21.54 1w0p s ALA 205 CO 0.04 0.25 -0.09 0.71 0.00 0.00 0.00 175.76 176.67 1w0p s TYR 206 N 0.24 2.89 -0.09 0.00 1.51 0.62 -0.98 117.35 121.55 1w0p s TYR 206 Ca -0.03 -0.77 0.06 0.00 -1.01 0.00 0.00 57.07 55.32 1w0p s TYR 206 Cb -0.14 -1.96 -0.24 0.00 -0.11 0.00 0.00 41.96 39.51 1w0p s TYR 206 CO 0.03 -0.35 0.49 0.54 -1.11 0.00 0.00 175.55 175.14 1w0p n ARG 207 N 4.08 0.68 -3.57 -0.62 1.74 -0.03 -0.55 116.66 118.38 1w0p n ARG 207 Ca -0.18 0.26 -0.15 0.00 -0.77 0.00 0.00 57.85 57.01 1w0p n ARG 207 Cb 0.52 -1.74 -0.06 0.00 -1.02 0.00 0.00 32.46 30.16 1w0p n ARG 207 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1w0p s ASP 208 N -6.37 -0.64 -0.04 0.55 -1.08 -1.17 -1.68 116.67 106.24 1w0p s ASP 208 Ca -0.12 0.94 0.00 0.00 -0.52 0.00 0.00 52.55 52.85 1w0p s ASP 208 Cb 0.07 0.86 0.02 0.00 -1.46 0.00 0.00 42.92 42.41 1w0p s ASP 208 CO 0.80 -0.41 -0.02 -0.63 0.52 0.00 0.00 175.17 175.43 1w0p s ILE 209 N -0.52 0.36 -0.06 4.11 -1.09 -0.28 -1.25 121.20 122.47 1w0p s ILE 209 Ca -0.05 0.01 -0.01 0.00 -2.23 0.00 0.00 60.65 58.36 1w0p s ILE 209 Cb -0.02 -0.44 0.03 0.00 -1.58 0.00 0.00 42.46 40.45 1w0p s ILE 209 CO 0.04 0.20 0.01 -0.54 -1.23 0.00 0.00 174.94 173.42 1w0p s LYS 210 N 1.14 0.48 -0.19 2.79 1.02 0.10 -1.04 119.74 124.05 1w0p s LYS 210 Ca -0.08 0.15 -0.00 0.00 0.02 0.00 0.00 55.97 56.06 1w0p s LYS 210 Cb -0.14 -0.87 0.01 0.00 -0.52 0.00 0.00 37.83 36.31 1w0p s LYS 210 CO -0.01 -0.30 -0.15 0.12 -0.92 0.00 0.00 175.35 174.09 1w0p s PHE 211 N 1.95 2.83 -0.09 3.18 5.36 0.30 -0.44 117.98 131.07 1w0p s PHE 211 Ca 0.04 -1.33 0.04 0.00 -0.96 0.00 0.00 56.93 54.72 1w0p s PHE 211 Cb -0.12 -1.97 -0.00 0.00 -0.34 0.00 0.00 43.02 40.59 1w0p s PHE 211 CO -0.05 -0.67 -0.23 -2.00 -1.46 0.00 0.00 175.22 170.81 1w0p s GLU 212 N 1.26 2.81 -0.22 10.12 2.12 0.36 -0.58 118.70 134.56 1w0p s GLU 212 Ca 0.03 -0.84 -0.12 0.00 0.36 0.00 0.00 54.97 54.40 1w0p s GLU 212 Cb -0.14 -2.18 -0.05 0.00 0.26 0.00 0.00 34.13 32.02 1w0p s GLU 212 CO -0.08 0.21 0.22 0.42 -0.54 0.00 0.00 175.26 175.49 1w0p s ILE 213 N 0.25 5.33 0.67 -3.70 1.01 -0.18 -1.43 121.20 123.15 1w0p s ILE 213 Ca -0.15 0.32 -0.09 0.00 0.00 0.00 0.00 60.65 60.73 1w0p s ILE 213 Cb -0.17 -3.55 0.02 0.00 0.01 0.00 0.00 42.46 38.77 1w0p s ILE 213 CO 0.07 0.34 1.03 -1.10 0.00 0.00 0.00 174.94 175.29 1w0p s GLN 214 N 0.96 2.77 0.00 2.79 -1.52 -0.60 -1.33 119.66 122.74 1w0p s GLN 214 Ca 0.11 0.24 0.00 0.00 -1.95 0.00 0.00 55.36 53.75 1w0p s GLN 214 Cb -0.13 -2.11 0.00 0.00 -0.22 0.00 0.00 33.01 30.55 1w0p s GLN 214 CO 0.04 -0.98 0.00 0.41 -0.25 0.00 0.00 175.29 174.52 1w0p n GLY 215 N -2.88 0.64 3.76 3.09 0.00 -0.33 -4.71 105.19 104.75 1w0p n GLY 215 Ca 0.06 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 1w0p n GLY 215 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w0p n ASP 216 N 0.74 3.70 -4.70 1.61 8.00 -1.23 -4.50 116.55 120.16 1w0p n ASP 216 Ca 0.00 1.20 -0.42 0.00 0.71 0.00 0.00 54.79 56.28 1w0p n ASP 216 Cb 0.00 -1.60 -0.03 0.00 -0.02 0.00 0.00 41.12 39.48 1w0p n ASP 216 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1w0p s VAL 217 N -0.73 4.67 -0.16 2.53 1.01 -1.26 -1.38 120.40 125.08 1w0p s VAL 217 Ca 0.57 1.92 0.07 0.00 0.00 0.00 0.00 61.98 64.55 1w0p s VAL 217 Cb -0.50 -4.23 -0.15 0.00 0.00 0.00 0.00 36.38 31.50 1w0p s VAL 217 CO 0.58 0.11 -0.05 0.00 0.00 0.00 0.00 175.10 175.75 1w0p n ILE 218 N 4.08 1.00 -4.08 2.22 3.06 0.30 -4.98 119.36 120.96 1w0p n ILE 218 Ca 0.07 -0.50 -0.16 0.00 -2.50 0.00 0.00 62.75 59.66 1w0p n ILE 218 Cb 0.49 -0.86 -0.15 0.00 0.54 0.00 0.00 39.64 39.66 1w0p n ILE 218 CO 0.00 0.00 0.00 -0.36 -2.50 0.00 0.00 176.55 173.69 1w0p s PHE 219 N -2.35 0.41 -0.04 9.51 0.08 -1.18 -5.03 117.98 119.38 1w0p s PHE 219 Ca -0.15 -0.07 -0.03 0.00 0.12 0.00 0.00 56.93 56.80 1w0p s PHE 219 Cb 0.05 -0.32 -0.04 0.00 -0.57 0.00 0.00 43.02 42.14 1w0p s PHE 219 CO 0.50 -0.05 0.15 1.03 -0.10 0.00 0.00 175.22 176.76 1w0p s ARG 220 N 0.20 3.36 0.81 0.44 0.52 -1.26 -0.75 118.95 122.27 1w0p s ARG 220 Ca -0.02 -0.31 -0.12 0.00 -0.52 0.00 0.00 55.73 54.77 1w0p s ARG 220 Cb -0.05 -3.07 0.09 0.00 0.52 0.00 0.00 34.95 32.44 1w0p s ARG 220 CO -0.00 0.70 1.14 0.20 0.02 0.00 0.00 175.30 177.35 1w0p s GLY 221 N -1.65 1.86 0.00 -3.53 0.00 -1.26 -1.91 107.32 100.83 1w0p s GLY 221 Ca 0.23 0.56 0.02 0.00 0.00 0.00 0.00 44.72 45.53 1w0p s GLY 221 CO 0.14 0.94 0.59 -1.55 0.00 0.00 0.00 173.10 173.22 1w0p n PRO 222 N -3.56 0.47 -1.70 2.90 -0.04 -1.26 -4.95 135.00 126.86 1w0p n PRO 222 Ca 0.11 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.23 1w0p n PRO 222 Cb 0.52 -1.07 0.06 0.00 -0.04 0.00 0.00 33.50 32.97 1w0p n PRO 222 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1w0p s ASP 223 N -1.59 4.83 0.30 3.54 1.01 -0.80 -4.60 116.67 119.36 1w0p s ASP 223 Ca 0.03 2.18 -0.08 0.00 0.71 0.00 0.00 52.55 55.39 1w0p s ASP 223 Cb 0.01 -2.57 0.03 0.00 1.01 0.00 0.00 42.92 41.41 1w0p s ASP 223 CO 0.02 -1.82 0.54 0.54 0.21 0.00 0.00 175.17 174.66 1w0p n ARG 224 N -2.36 0.77 -2.79 8.23 1.74 -0.99 -4.78 116.66 116.48 1w0p n ARG 224 Ca 0.12 -1.93 -0.01 0.00 -0.77 0.00 0.00 57.85 55.25 1w0p n ARG 224 Cb 0.51 2.18 0.00 0.00 -1.02 0.00 0.00 32.46 34.13 1w0p n ARG 224 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1w0p n ILE 225 N -0.44 -9.02 -2.80 0.55 2.08 -1.26 -0.21 119.36 108.26 1w0p n ILE 225 Ca -0.04 0.00 -0.33 0.00 0.56 0.00 0.00 62.75 62.94 1w0p n ILE 225 Cb 0.47 -6.51 -0.06 0.00 -0.75 0.00 0.00 39.64 32.79 1w0p n ILE 225 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1w0p s PRO 226 N -2.87 4.09 0.08 0.38 0.04 -1.26 -4.08 135.00 131.39 1w0p s PRO 226 Ca 0.04 0.95 -0.13 0.00 0.04 0.00 0.00 61.00 61.90 1w0p s PRO 226 Cb -0.01 -2.24 0.02 0.00 0.04 0.00 0.00 34.50 32.31 1w0p s PRO 226 CO 0.64 -0.04 0.31 -1.54 0.04 0.00 0.00 177.00 176.41 1w0p s SER 227 N -2.45 -0.11 -0.06 6.66 1.04 -0.84 -4.34 113.70 113.60 1w0p s SER 227 Ca 0.59 -0.33 -0.28 0.00 0.48 0.00 0.00 55.95 56.41 1w0p s SER 227 Cb -0.10 0.39 0.06 0.00 0.10 0.00 0.00 66.02 66.48 1w0p s SER 227 CO 0.19 -0.72 0.63 -0.51 0.98 0.00 0.00 173.24 173.81 1w0p s ILE 228 N -3.24 0.01 0.08 -1.02 2.07 -1.26 -1.23 121.20 116.61 1w0p s ILE 228 Ca -0.00 -0.07 -0.08 0.00 -1.41 0.00 0.00 60.65 59.09 1w0p s ILE 228 Cb 0.01 -0.94 -0.00 0.00 0.13 0.00 0.00 42.46 41.66 1w0p s ILE 228 CO -0.08 -0.04 0.17 0.54 -1.91 0.00 0.00 174.94 173.63 1w0p s VAL 229 N -1.08 0.15 0.05 4.00 0.11 -0.87 -4.75 120.40 118.00 1w0p s VAL 229 Ca -0.10 -1.19 0.02 0.00 -2.93 0.00 0.00 61.98 57.77 1w0p s VAL 229 Cb -0.01 -1.30 -0.03 0.00 -1.53 0.00 0.00 36.38 33.51 1w0p s VAL 229 CO 0.08 -0.66 -0.08 0.00 -3.33 0.00 0.00 175.10 171.12 1w0p s ALA 230 N -3.71 0.61 0.04 1.54 0.00 -1.26 -1.25 121.76 117.72 1w0p s ALA 230 Ca 0.04 -0.83 -0.22 0.00 0.00 0.00 0.00 51.96 50.95 1w0p s ALA 230 Cb 0.04 0.06 -0.06 0.00 0.00 0.00 0.00 23.12 23.16 1w0p s ALA 230 CO -0.10 -0.05 0.66 0.45 0.00 0.00 0.00 175.76 176.72 1w0p s SER 231 N -1.75 7.09 -0.04 0.00 0.15 -0.02 -4.96 113.70 114.17 1w0p s SER 231 Ca -0.08 1.30 0.19 0.00 0.70 0.00 0.00 55.95 58.06 1w0p s SER 231 Cb -0.08 -2.41 -0.22 0.00 -1.71 0.00 0.00 66.02 61.60 1w0p s SER 231 CO -0.00 0.11 0.50 -1.54 1.20 0.00 0.00 173.24 173.51 1w0p n SER 232 N 2.50 0.35 0.05 5.45 3.41 -1.26 -3.92 113.62 120.20 1w0p n SER 232 Ca -0.06 0.15 -0.14 0.00 -0.26 0.00 0.00 58.87 58.56 1w0p n SER 232 Cb 0.50 0.93 -0.04 0.00 -0.26 0.00 0.00 64.21 65.34 1w0p n SER 232 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1w0p h VAL 233 N 0.00 1.36 -3.12 -3.33 2.07 -1.93 -3.37 116.25 107.94 1w0p h VAL 233 Ca -0.24 -2.31 -0.62 0.00 0.82 0.00 0.00 66.70 64.35 1w0p h VAL 233 Cb 1.62 2.31 -0.41 0.00 -1.52 0.00 0.00 31.29 33.29 1w0p h VAL 233 CO 0.03 0.70 -0.62 -0.89 0.02 0.00 0.00 177.57 176.81 1w0p s THR 234 N -3.38 2.60 0.10 2.57 2.01 -1.26 -5.09 115.64 113.19 1w0p s THR 234 Ca -0.07 -3.85 -0.36 0.00 0.31 0.00 0.00 61.69 57.72 1w0p s THR 234 Cb 0.09 -2.74 -0.17 0.00 0.01 0.00 0.00 72.50 69.69 1w0p s THR 234 CO 0.88 -0.96 1.25 -2.65 -0.69 0.00 0.00 174.62 172.45 1w0p n PRO 235 N 2.40 1.02 0.00 4.92 -0.02 -1.25 -2.23 135.00 139.84 1w0p n PRO 235 Ca 0.16 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1w0p n PRO 235 Cb 0.35 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1w0p n PRO 235 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1w0p n GLY 236 N 2.27 2.88 3.66 -1.23 0.00 -1.26 -4.90 105.19 106.61 1w0p n GLY 236 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1w0p n GLY 236 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w0p s VAL 237 N -2.76 4.88 -0.03 1.61 1.01 -0.95 -0.48 120.40 123.68 1w0p s VAL 237 Ca 0.00 1.58 0.03 0.00 0.00 0.00 0.00 61.98 63.59 1w0p s VAL 237 Cb 0.00 -4.12 -0.00 0.00 0.00 0.00 0.00 36.38 32.26 1w0p s VAL 237 CO 0.00 0.00 -0.13 -0.69 0.00 0.00 0.00 175.10 174.29 1w0p s VAL 238 N 2.34 1.06 -0.12 2.92 1.01 -0.03 -0.84 120.40 126.74 1w0p s VAL 238 Ca 0.37 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.84 1w0p s VAL 238 Cb -0.16 -0.92 0.01 0.00 0.00 0.00 0.00 36.38 35.31 1w0p s VAL 238 CO 0.11 0.31 -0.16 -0.89 0.00 0.00 0.00 175.10 174.47 1w0p s THR 239 N 0.08 1.62 0.17 3.92 2.01 -0.38 -0.88 115.64 122.19 1w0p s THR 239 Ca -0.02 -0.71 0.09 0.00 0.31 0.00 0.00 61.69 61.35 1w0p s THR 239 Cb -0.09 -1.48 -0.04 0.00 0.01 0.00 0.00 72.50 70.90 1w0p s THR 239 CO 0.01 0.47 -0.09 0.00 -0.69 0.00 0.00 174.62 174.31 1w0p s ALA 240 N 1.02 2.94 0.07 7.40 0.00 -0.55 -2.05 121.76 130.59 1w0p s ALA 240 Ca -0.05 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 50.46 1w0p s ALA 240 Cb -0.15 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 1w0p s ALA 240 CO -0.03 0.48 -0.04 -0.06 0.00 0.00 0.00 175.76 176.11 1w0p s PHE 241 N -1.66 0.65 0.25 0.00 0.40 -0.37 -1.81 117.98 115.45 1w0p s PHE 241 Ca 0.25 -0.99 -0.21 0.00 -0.60 0.00 0.00 56.93 55.38 1w0p s PHE 241 Cb -0.09 -0.43 0.06 0.00 0.51 0.00 0.00 43.02 43.07 1w0p s PHE 241 CO 0.15 -0.28 0.90 0.00 0.70 0.00 0.00 175.22 176.68 1w0p s ALA 242 N -3.69 -1.29 -0.25 5.36 0.00 -0.88 -1.99 121.76 119.03 1w0p s ALA 242 Ca 0.08 -0.35 -0.10 0.00 0.00 0.00 0.00 51.96 51.58 1w0p s ALA 242 Cb 0.06 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.85 1w0p s ALA 242 CO -0.08 -1.03 0.15 -1.21 0.00 0.00 0.00 175.76 173.59 1w0p s GLU 243 N -2.73 3.97 -0.43 0.00 2.02 0.71 -1.55 118.70 120.71 1w0p s GLU 243 Ca 0.16 -0.32 -0.26 0.00 0.02 0.00 0.00 54.97 54.57 1w0p s GLU 243 Cb -0.04 -3.51 0.02 0.00 0.10 0.00 0.00 34.13 30.71 1w0p s GLU 243 CO 0.07 -0.02 0.97 0.21 0.02 0.00 0.00 175.26 176.51 1w0p s LYS 244 N 1.26 3.69 -0.72 1.61 2.47 0.69 -2.35 119.74 126.38 1w0p s LYS 244 Ca 0.07 0.40 -0.04 0.00 -1.56 0.00 0.00 55.97 54.84 1w0p s LYS 244 Cb -0.14 -3.87 0.18 0.00 -1.46 0.00 0.00 37.83 32.54 1w0p s LYS 244 CO 0.06 -1.15 0.56 1.03 0.16 0.00 0.00 175.35 176.01 1w0p s ARG 245 N 3.78 2.87 -0.41 4.03 0.52 -1.26 -0.88 118.95 127.59 1w0p s ARG 245 Ca 0.40 -2.71 -0.29 0.00 -0.52 0.00 0.00 55.73 52.61 1w0p s ARG 245 Cb -0.10 -3.87 0.01 0.00 0.52 0.00 0.00 34.95 31.51 1w0p s ARG 245 CO 0.24 -1.21 1.36 0.08 0.02 0.00 0.00 175.30 175.79 1w0p s VAL 246 N -0.35 3.97 0.00 3.52 1.01 -1.01 -0.92 120.40 126.63 1w0p s VAL 246 Ca 0.20 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.18 1w0p s VAL 246 Cb -0.16 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 31.96 1w0p s VAL 246 CO -0.06 -0.76 0.00 0.61 0.00 0.00 0.00 175.10 174.89 1w0p n GLY 247 N 4.95 1.62 0.56 4.51 0.00 -1.26 -1.32 105.19 114.26 1w0p n GLY 247 Ca 0.16 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.25 1w0p n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w0p n GLY 248 N -1.18 -2.47 0.00 -0.02 0.00 -0.10 -4.81 105.19 96.62 1w0p n GLY 248 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1w0p n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w0p n GLY 249 N -3.11 0.24 3.73 -0.02 0.00 -1.26 -4.67 105.19 100.10 1w0p n GLY 249 Ca -0.02 -1.76 -0.33 0.00 0.00 0.00 0.00 46.02 43.91 1w0p n GLY 249 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w0p s ASP 250 N -1.71 4.21 0.73 1.61 1.01 -1.26 -4.96 116.67 116.30 1w0p s ASP 250 Ca 0.00 2.11 -0.16 0.00 0.71 0.00 0.00 52.55 55.22 1w0p s ASP 250 Cb 0.00 -2.56 0.04 0.00 1.01 0.00 0.00 42.92 41.41 1w0p s ASP 250 CO 0.00 -2.24 1.25 -2.16 0.21 0.00 0.00 175.17 172.23 1w0p s PRO 251 N -4.34 2.08 0.00 8.23 0.04 -1.26 -3.78 135.00 135.96 1w0p s PRO 251 Ca 0.68 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.64 1w0p s PRO 251 Cb -0.23 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1w0p s PRO 251 CO 0.49 -1.92 0.00 0.41 0.04 0.00 0.00 177.00 176.02 1w0p n GLY 252 N 0.70 0.42 3.79 0.56 0.00 -1.25 -4.51 105.19 104.90 1w0p n GLY 252 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1w0p n GLY 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w0p s ALA 253 N -2.00 3.54 0.40 4.61 0.00 -1.07 -2.62 121.76 124.63 1w0p s ALA 253 Ca 0.00 0.02 0.19 0.00 0.00 0.00 0.00 51.96 52.17 1w0p s ALA 253 Cb 0.00 -2.68 1.09 0.00 0.00 0.00 0.00 23.12 21.53 1w0p s ALA 253 CO 0.00 0.28 1.97 1.25 0.00 0.00 0.00 175.76 179.26 1w0p h LEU 254 N 5.11 0.00 -0.16 0.00 5.85 -1.87 -2.59 115.31 121.65 1w0p h LEU 254 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1w0p h LEU 254 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1w0p h LEU 254 CO 0.67 0.21 0.00 -1.54 -0.34 0.00 0.00 178.44 177.44 1w0p n SER 255 N -3.97 0.24 -4.14 1.25 3.41 -1.26 -4.87 113.62 104.28 1w0p n SER 255 Ca -0.02 -1.35 -0.10 0.00 -0.26 0.00 0.00 58.87 57.14 1w0p n SER 255 Cb 0.29 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.13 1w0p n SER 255 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1w0p s ASN 256 N -1.70 0.93 -0.22 4.04 2.20 -0.98 -4.46 114.94 114.76 1w0p s ASN 256 Ca 0.34 -0.95 -0.02 0.00 -0.94 0.00 0.00 52.86 51.28 1w0p s ASN 256 Cb 0.16 0.12 0.07 0.00 -2.00 0.00 0.00 41.25 39.59 1w0p s ASN 256 CO 0.26 -0.47 0.04 -0.89 -2.94 0.00 0.00 177.10 173.09 1w0p s THR 257 N -3.46 0.68 -0.10 0.54 2.01 -0.43 -4.77 115.64 110.11 1w0p s THR 257 Ca 0.08 -0.76 -0.03 0.00 0.31 0.00 0.00 61.69 61.28 1w0p s THR 257 Cb 0.04 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.30 1w0p s THR 257 CO -0.06 -0.27 0.04 0.20 -0.69 0.00 0.00 174.62 173.83 1w0p s ASN 258 N 1.77 5.51 0.34 3.53 0.01 -1.26 -2.39 114.94 122.45 1w0p s ASN 258 Ca 0.00 0.21 0.03 0.00 -0.71 0.00 0.00 52.86 52.40 1w0p s ASN 258 Cb -0.17 -1.64 -0.04 0.00 0.41 0.00 0.00 41.25 39.81 1w0p s ASN 258 CO -0.11 0.37 0.11 -1.81 -1.51 0.00 0.00 177.10 174.16 1w0p s ASP 259 N -0.84 2.13 -0.19 -1.22 1.01 -0.06 -0.51 116.67 116.99 1w0p s ASP 259 Ca 0.13 -1.52 -0.11 0.00 0.71 0.00 0.00 52.55 51.77 1w0p s ASP 259 Cb -0.12 0.26 -0.05 0.00 1.01 0.00 0.00 42.92 44.02 1w0p s ASP 259 CO 0.03 -0.80 0.15 -0.63 0.21 0.00 0.00 175.17 174.13 1w0p s ILE 260 N -3.41 5.40 0.25 0.77 -1.09 -1.26 -0.22 121.20 121.63 1w0p s ILE 260 Ca 0.32 0.24 0.12 0.00 -2.23 0.00 0.00 60.65 59.10 1w0p s ILE 260 Cb 0.06 -3.49 -0.05 0.00 -1.58 0.00 0.00 42.46 37.40 1w0p s ILE 260 CO 0.15 0.43 -0.21 0.27 -1.23 0.00 0.00 174.94 174.36 1w0p s ILE 261 N 0.38 2.39 0.06 2.92 -4.36 -0.59 -0.71 121.20 121.28 1w0p s ILE 261 Ca 0.09 -2.30 -0.11 0.00 -0.26 0.00 0.00 60.65 58.07 1w0p s ILE 261 Cb -0.11 -2.23 0.01 0.00 1.25 0.00 0.00 42.46 41.37 1w0p s ILE 261 CO -0.01 -0.34 0.25 0.28 0.24 0.00 0.00 174.94 175.35 1w0p s THR 262 N -2.33 0.10 -0.01 8.37 -1.32 -0.36 -2.06 115.64 118.03 1w0p s THR 262 Ca 0.27 -0.86 -0.02 0.00 -1.21 0.00 0.00 61.69 59.87 1w0p s THR 262 Cb -0.05 -1.03 -0.00 0.00 -1.51 0.00 0.00 72.50 69.90 1w0p s THR 262 CO 0.13 -0.47 0.05 -0.13 -2.21 0.00 0.00 174.62 171.99 1w0p s ARG 263 N -2.92 0.19 0.05 7.08 0.52 -0.75 -1.10 118.95 122.02 1w0p s ARG 263 Ca -0.02 -0.15 0.09 0.00 -0.52 0.00 0.00 55.73 55.13 1w0p s ARG 263 Cb 0.01 0.08 -0.03 0.00 0.52 0.00 0.00 34.95 35.53 1w0p s ARG 263 CO -0.06 -0.03 -0.26 0.99 0.02 0.00 0.00 175.30 175.96 1w0p s THR 264 N -0.54 2.07 0.05 0.02 2.01 -1.26 -1.48 115.64 116.51 1w0p s THR 264 Ca -0.06 -1.38 0.08 0.00 0.31 0.00 0.00 61.69 60.64 1w0p s THR 264 Cb -0.04 -1.78 -0.03 0.00 0.01 0.00 0.00 72.50 70.67 1w0p s THR 264 CO 0.00 0.33 -0.23 -0.55 -0.69 0.00 0.00 174.62 173.48 1w0p s SER 265 N -1.26 2.74 0.00 3.53 0.15 -0.06 -0.91 113.70 117.89 1w0p s SER 265 Ca 0.11 -0.55 0.01 0.00 0.70 0.00 0.00 55.95 56.22 1w0p s SER 265 Cb -0.10 -0.24 0.03 0.00 -1.71 0.00 0.00 66.02 64.01 1w0p s SER 265 CO 0.02 0.20 0.86 0.54 1.20 0.00 0.00 173.24 176.05 1w0p n ARG 266 N 1.81 1.60 -1.02 5.44 1.74 -1.25 -0.85 116.66 124.13 1w0p n ARG 266 Ca -0.17 -1.21 -0.01 0.00 -0.77 0.00 0.00 57.85 55.68 1w0p n ARG 266 Cb 0.53 -1.03 0.15 0.00 -1.02 0.00 0.00 32.46 31.09 1w0p n ARG 266 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1w0p n ASP 267 N -0.20 2.44 0.00 0.55 5.68 -1.13 -4.42 116.55 119.47 1w0p n ASP 267 Ca 0.01 -3.74 0.00 0.00 -0.50 0.00 0.00 54.79 50.56 1w0p n ASP 267 Cb 0.19 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 39.69 1w0p n ASP 267 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1w0p n GLY 268 N -0.93 0.53 0.53 6.12 0.00 0.37 -3.95 105.19 107.87 1w0p n GLY 268 Ca 0.24 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1w0p n GLY 268 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w0p n GLY 269 N -2.80 0.85 0.08 -0.02 0.00 -1.26 -5.00 105.19 97.04 1w0p n GLY 269 Ca 0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 1w0p n GLY 269 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1w0p h ILE 270 N 0.00 0.73 -3.74 -0.61 1.08 -1.95 -3.47 117.51 109.54 1w0p h ILE 270 Ca 0.00 -1.76 -0.68 0.00 -0.39 0.00 0.00 64.86 62.03 1w0p h ILE 270 Cb 0.00 1.59 -0.19 0.00 -3.07 0.00 0.00 36.82 35.16 1w0p h ILE 270 CO 0.00 0.25 -0.78 0.42 -0.69 0.00 0.00 178.15 177.35 1w0p s THR 271 N -2.21 3.01 0.09 -0.27 -4.23 -1.26 -4.82 115.64 105.95 1w0p s THR 271 Ca -0.20 -1.32 0.07 0.00 -1.18 0.00 0.00 61.69 59.06 1w0p s THR 271 Cb 0.03 -2.35 -0.03 0.00 1.34 0.00 0.00 72.50 71.48 1w0p s THR 271 CO 0.44 0.18 -0.17 0.26 -0.54 0.00 0.00 174.62 174.80 1w0p s TRP 272 N -1.09 1.47 0.42 3.99 0.52 -1.26 -4.29 118.94 118.70 1w0p s TRP 272 Ca 0.18 -0.45 -0.05 0.00 0.02 0.00 0.00 56.10 55.80 1w0p s TRP 272 Cb -0.11 -0.81 0.09 0.00 -1.15 0.00 0.00 33.47 31.49 1w0p s TRP 272 CO 0.10 0.13 0.57 -0.40 0.02 0.00 0.00 176.95 177.37 1w0p n ASP 273 N 1.11 0.28 -4.75 2.95 5.68 -0.09 -4.97 116.55 116.77 1w0p n ASP 273 Ca -0.20 -1.35 -0.41 0.00 -0.50 0.00 0.00 54.79 52.33 1w0p n ASP 273 Cb 0.54 -0.41 -0.02 0.00 -1.14 0.00 0.00 41.12 40.09 1w0p n ASP 273 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1w0p s THR 274 N -1.98 2.17 0.14 2.12 2.01 -1.26 -4.62 115.64 114.22 1w0p s THR 274 Ca 0.34 0.14 -0.32 0.00 0.31 0.00 0.00 61.69 62.16 1w0p s THR 274 Cb -0.01 -3.09 -0.12 0.00 0.01 0.00 0.00 72.50 69.29 1w0p s THR 274 CO 0.23 0.02 1.76 1.21 -0.69 0.00 0.00 174.62 177.15 1w0p n GLU 275 N 2.08 2.60 -4.84 4.92 2.13 -1.26 -4.74 120.64 121.53 1w0p n GLU 275 Ca 0.07 0.94 -0.33 0.00 0.66 0.00 0.00 57.16 58.51 1w0p n GLU 275 Cb 0.38 -2.79 -0.16 0.00 0.27 0.00 0.00 31.44 29.14 1w0p n GLU 275 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1w0p s LEU 276 N 2.04 2.39 -0.46 4.31 2.96 -0.26 -4.95 118.68 124.70 1w0p s LEU 276 Ca 0.80 -0.47 -0.22 0.00 -0.22 0.00 0.00 54.13 54.02 1w0p s LEU 276 Cb -0.55 -1.52 0.03 0.00 0.50 0.00 0.00 46.19 44.65 1w0p s LEU 276 CO 0.37 0.13 0.75 0.21 -1.32 0.00 0.00 176.35 176.50 1w0p s ASN 277 N 0.52 6.37 0.34 3.68 3.84 -1.26 -1.23 114.94 127.20 1w0p s ASN 277 Ca -0.12 -0.25 0.19 0.00 0.21 0.00 0.00 52.86 52.90 1w0p s ASN 277 Cb -0.16 -2.37 0.18 0.00 -0.55 0.00 0.00 41.25 38.35 1w0p s ASN 277 CO 0.04 -0.91 1.48 -0.07 -2.79 0.00 0.00 177.10 174.86 1w0p h LEU 278 N 10.07 0.00 -0.31 3.21 3.38 -1.29 -3.37 115.31 126.99 1w0p h LEU 278 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1w0p h LEU 278 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1w0p h LEU 278 CO 0.95 0.25 -0.46 0.35 0.09 0.00 0.00 178.44 179.62 1w0p n THR 279 N -3.13 0.00 -0.33 0.22 -2.24 -1.25 -4.53 114.28 103.02 1w0p n THR 279 Ca 0.02 -0.27 0.14 0.00 -2.27 0.00 0.00 64.05 61.67 1w0p n THR 279 Cb 0.64 1.06 0.36 0.00 -2.10 0.00 0.00 70.33 70.28 1w0p n THR 279 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1w0p h GLU 280 N 0.56 0.69 0.00 -0.78 4.81 -1.90 -0.14 114.58 117.82 1w0p h GLU 280 Ca 0.00 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1w0p h GLU 280 Cb 0.35 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1w0p h GLU 280 CO 0.00 0.46 -0.03 0.37 -0.73 0.00 0.00 179.01 179.07 1w0p h GLN 281 N 0.71 0.00 -0.15 1.92 4.15 -1.85 -1.72 115.11 118.17 1w0p h GLN 281 Ca 0.54 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.90 1w0p h GLN 281 Cb 0.91 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.56 1w0p h GLN 281 CO -0.31 0.03 -0.19 0.44 -1.93 0.00 0.00 178.83 176.87 1w0p n ILE 282 N -3.64 2.27 -2.71 2.39 -5.35 -0.10 -4.51 119.36 107.71 1w0p n ILE 282 Ca -0.03 -2.69 -0.06 0.00 -0.27 0.00 0.00 62.75 59.70 1w0p n ILE 282 Cb 0.13 -0.27 0.06 0.00 -1.74 0.00 0.00 39.64 37.82 1w0p n ILE 282 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1w0p n ASN 283 N -1.11 0.76 0.12 7.28 5.15 -0.65 -4.97 115.26 121.84 1w0p n ASN 283 Ca 0.23 -2.46 0.18 0.00 -0.60 0.00 0.00 54.58 51.93 1w0p n ASN 283 Cb 0.82 -0.19 0.75 0.00 -0.53 0.00 0.00 39.78 40.62 1w0p n ASN 283 CO 0.00 0.00 0.00 -0.37 1.40 0.00 0.00 177.26 178.29 1w0p h VAL 284 N 3.59 0.60 0.00 3.44 -1.51 -1.78 -2.43 116.25 118.17 1w0p h VAL 284 Ca -0.16 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.30 1w0p h VAL 284 Cb 1.23 0.78 -0.01 0.00 -2.13 0.00 0.00 31.29 31.16 1w0p h VAL 284 CO 0.28 0.00 -0.23 -1.54 -1.23 0.00 0.00 177.57 174.85 1w0p n SER 285 N -4.07 1.98 -3.84 4.19 3.41 -1.26 -4.98 113.62 109.05 1w0p n SER 285 Ca 0.05 -3.30 -0.29 0.00 -0.26 0.00 0.00 58.87 55.07 1w0p n SER 285 Cb 0.45 -0.45 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 1w0p n SER 285 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1w0p n ASP 286 N -1.21 -5.06 -0.06 4.04 8.00 -0.91 -4.88 116.55 116.47 1w0p n ASP 286 Ca 0.16 -0.72 0.13 0.00 0.71 0.00 0.00 54.79 55.06 1w0p n ASP 286 Cb 0.67 -4.03 0.35 0.00 -0.02 0.00 0.00 41.12 38.09 1w0p n ASP 286 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1w0p n GLU 287 N -4.69 0.23 -4.35 -1.24 1.02 -1.26 -4.85 120.64 105.50 1w0p n GLU 287 Ca 0.04 -0.12 -0.18 0.00 -0.02 0.00 0.00 57.16 56.87 1w0p n GLU 287 Cb 0.53 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.35 1w0p n GLU 287 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1w0p s PHE 288 N -2.85 1.65 -0.02 -0.32 0.08 -1.26 -1.11 117.98 114.15 1w0p s PHE 288 Ca 0.16 -0.87 0.07 0.00 0.12 0.00 0.00 56.93 56.40 1w0p s PHE 288 Cb 0.18 -0.96 -0.02 0.00 -0.57 0.00 0.00 43.02 41.66 1w0p s PHE 288 CO 0.62 0.04 -0.22 -0.51 -0.10 0.00 0.00 175.22 175.05 1w0p s ASP 289 N -3.34 2.63 0.11 1.36 1.01 -0.10 -4.23 116.67 114.12 1w0p s ASP 289 Ca 0.29 -0.41 0.09 0.00 0.71 0.00 0.00 52.55 53.23 1w0p s ASP 289 Cb 0.05 -0.35 -0.04 0.00 1.01 0.00 0.00 42.92 43.59 1w0p s ASP 289 CO 0.09 0.27 -0.20 -0.36 0.21 0.00 0.00 175.17 175.18 1w0p s PHE 290 N -0.46 2.48 0.30 4.23 0.40 0.34 -0.22 117.98 125.04 1w0p s PHE 290 Ca 0.07 -0.29 -0.10 0.00 -0.60 0.00 0.00 56.93 56.01 1w0p s PHE 290 Cb -0.09 -1.34 0.01 0.00 0.51 0.00 0.00 43.02 42.10 1w0p s PHE 290 CO -0.00 0.35 0.51 -1.54 0.70 0.00 0.00 175.22 175.24 1w0p s SER 291 N -2.01 0.26 -0.69 1.36 1.04 -0.37 -4.18 113.70 109.10 1w0p s SER 291 Ca 0.16 -1.14 -0.10 0.00 0.48 0.00 0.00 55.95 55.35 1w0p s SER 291 Cb -0.10 0.64 0.01 0.00 0.10 0.00 0.00 66.02 66.67 1w0p s SER 291 CO 0.08 -1.26 0.64 0.47 0.98 0.00 0.00 173.24 174.15 1w0p n ASP 292 N -0.85 -5.84 -4.66 7.02 9.92 -1.26 -1.40 116.55 119.48 1w0p n ASP 292 Ca -0.02 -0.49 -0.42 0.00 -0.53 0.00 0.00 54.79 53.33 1w0p n ASP 292 Cb 0.62 -2.71 -0.03 0.00 -0.64 0.00 0.00 41.12 38.36 1w0p n ASP 292 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 1w0p s PRO 293 N -3.82 4.22 -0.54 -0.24 0.02 -1.26 -4.37 135.00 129.00 1w0p s PRO 293 Ca 0.11 1.97 0.04 0.00 0.02 0.00 0.00 61.00 63.13 1w0p s PRO 293 Cb -0.01 -3.84 0.14 0.00 0.02 0.00 0.00 34.50 30.80 1w0p s PRO 293 CO 0.85 -0.75 0.29 0.50 -0.33 0.00 0.00 177.00 177.56 1w0p s ARG 294 N 3.57 2.05 0.36 5.54 3.52 0.55 -4.12 118.95 130.42 1w0p s ARG 294 Ca 0.65 -2.72 -0.22 0.00 -0.13 0.00 0.00 55.73 53.30 1w0p s ARG 294 Cb -0.29 -3.34 -0.10 0.00 -1.56 0.00 0.00 34.95 29.66 1w0p s ARG 294 CO 0.24 -1.13 0.91 -1.25 -0.81 0.00 0.00 175.30 173.25 1w0p s PRO 295 N -0.45 4.36 -0.05 5.12 0.04 -1.25 -1.94 135.00 140.83 1w0p s PRO 295 Ca 0.18 1.15 0.02 0.00 0.04 0.00 0.00 61.00 62.38 1w0p s PRO 295 Cb -0.23 -2.52 0.02 0.00 0.04 0.00 0.00 34.50 31.81 1w0p s PRO 295 CO -0.02 0.15 -0.08 0.42 0.04 0.00 0.00 177.00 177.51 1w0p s ILE 296 N -1.87 0.79 -0.19 0.56 1.01 0.05 -0.37 121.20 121.17 1w0p s ILE 296 Ca 0.55 -0.29 -0.12 0.00 0.00 0.00 0.00 60.65 60.79 1w0p s ILE 296 Cb -0.14 -0.76 -0.05 0.00 0.01 0.00 0.00 42.46 41.53 1w0p s ILE 296 CO 0.18 0.28 0.22 -0.47 0.00 0.00 0.00 174.94 175.15 1w0p s TYR 297 N 0.71 3.40 -0.34 3.97 5.04 -1.26 -0.83 117.35 128.04 1w0p s TYR 297 Ca -0.12 0.43 -0.04 0.00 -2.44 0.00 0.00 57.07 54.90 1w0p s TYR 297 Cb -0.14 -2.28 0.06 0.00 0.35 0.00 0.00 41.96 39.95 1w0p s TYR 297 CO 0.02 0.20 0.09 0.34 -1.34 0.00 0.00 175.55 174.86 1w0p s ASP 298 N 0.61 5.15 0.49 4.32 -1.08 -0.37 -4.46 116.67 121.33 1w0p s ASP 298 Ca 0.12 -1.41 0.26 0.00 -0.52 0.00 0.00 52.55 51.00 1w0p s ASP 298 Cb -0.13 -1.80 1.28 0.00 -1.46 0.00 0.00 42.92 40.81 1w0p s ASP 298 CO 0.02 -0.36 2.00 -0.65 0.52 0.00 0.00 175.17 176.70 1w0p h PRO 299 N 8.10 0.00 0.00 4.34 0.11 -1.97 0.13 132.00 142.71 1w0p h PRO 299 Ca -0.20 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.86 1w0p h PRO 299 Cb 1.07 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1w0p h PRO 299 CO 0.60 0.16 -0.22 0.66 -0.21 0.00 0.00 178.00 178.99 1w0p h SER 300 N 0.00 0.00 0.00 -2.05 4.64 -1.96 -3.17 113.55 111.00 1w0p h SER 300 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1w0p h SER 300 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1w0p h SER 300 CO 0.02 0.22 0.00 -1.54 -0.87 0.00 0.00 176.83 174.66 1w0p n SER 301 N -4.05 0.33 -3.50 4.97 3.41 -1.13 -5.03 113.62 108.62 1w0p n SER 301 Ca -0.02 -0.65 -0.20 0.00 -0.26 0.00 0.00 58.87 57.74 1w0p n SER 301 Cb 0.29 0.61 0.06 0.00 -0.26 0.00 0.00 64.21 64.91 1w0p n SER 301 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1w0p n ASN 302 N -0.61 -3.52 -4.22 4.04 5.15 0.42 -4.89 115.26 111.63 1w0p n ASN 302 Ca 0.00 -0.77 -0.13 0.00 -0.60 0.00 0.00 54.58 53.09 1w0p n ASN 302 Cb 0.01 -4.57 -0.10 0.00 -0.53 0.00 0.00 39.78 34.59 1w0p n ASN 302 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1w0p s THR 303 N -3.48 0.78 -0.14 -0.44 -4.23 -1.07 -2.62 115.64 104.43 1w0p s THR 303 Ca 0.20 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 58.74 1w0p s THR 303 Cb -0.04 -1.93 0.00 0.00 1.34 0.00 0.00 72.50 71.87 1w0p s THR 303 CO 0.78 -0.65 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.34 1w0p s VAL 304 N -3.58 2.50 -0.26 2.29 1.01 -0.55 -1.24 120.40 120.58 1w0p s VAL 304 Ca 0.19 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.31 1w0p s VAL 304 Cb 0.05 -2.04 0.02 0.00 0.00 0.00 0.00 36.38 34.42 1w0p s VAL 304 CO 0.01 0.53 -0.03 -0.22 0.00 0.00 0.00 175.10 175.39 1w0p s LEU 305 N 0.74 3.37 -0.18 3.92 1.98 -0.01 -0.34 118.68 128.17 1w0p s LEU 305 Ca -0.07 -0.86 -0.04 0.00 -2.89 0.00 0.00 54.13 50.27 1w0p s LEU 305 Cb -0.16 -1.71 -0.03 0.00 0.66 0.00 0.00 46.19 44.95 1w0p s LEU 305 CO 0.01 -0.15 -0.02 0.54 -1.89 0.00 0.00 176.35 174.84 1w0p s VAL 306 N 1.36 3.94 0.06 1.68 0.11 -0.42 -0.77 120.40 126.35 1w0p s VAL 306 Ca 0.00 -0.33 0.03 0.00 -2.93 0.00 0.00 61.98 58.75 1w0p s VAL 306 Cb -0.17 -2.75 -0.04 0.00 -1.53 0.00 0.00 36.38 31.89 1w0p s VAL 306 CO -0.03 0.46 0.06 -0.44 -3.33 0.00 0.00 175.10 171.83 1w0p s SER 307 N 0.64 5.46 0.14 3.54 0.01 -0.82 -1.20 113.70 121.47 1w0p s SER 307 Ca -0.01 -0.01 -0.18 0.00 1.31 0.00 0.00 55.95 57.06 1w0p s SER 307 Cb -0.14 -1.46 0.04 0.00 0.21 0.00 0.00 66.02 64.67 1w0p s SER 307 CO 0.02 0.20 0.46 -0.72 0.41 0.00 0.00 173.24 173.61 1w0p s TYR 308 N -1.33 -0.27 0.15 2.43 1.13 -0.19 -0.33 117.35 118.94 1w0p s TYR 308 Ca 0.27 -0.02 -0.05 0.00 -1.41 0.00 0.00 57.07 55.86 1w0p s TYR 308 Cb -0.12 0.34 -0.06 0.00 -1.10 0.00 0.00 41.96 41.02 1w0p s TYR 308 CO 0.19 -0.76 0.40 0.00 -2.51 0.00 0.00 175.55 172.88 1w0p s ALA 309 N -3.80 3.76 0.04 9.51 0.00 -0.49 -1.28 121.76 129.51 1w0p s ALA 309 Ca 0.03 -0.52 0.06 0.00 0.00 0.00 0.00 51.96 51.52 1w0p s ALA 309 Cb 0.01 -2.17 -0.03 0.00 0.00 0.00 0.00 23.12 20.93 1w0p s ALA 309 CO -0.11 0.65 -0.12 0.50 0.00 0.00 0.00 175.76 176.68 1w0p s ARG 310 N -2.67 2.26 0.01 0.00 3.52 -0.11 -1.24 118.95 120.73 1w0p s ARG 310 Ca 0.42 -0.90 -0.07 0.00 -0.13 0.00 0.00 55.73 55.06 1w0p s ARG 310 Cb -0.12 -2.33 -0.00 0.00 -1.56 0.00 0.00 34.95 30.94 1w0p s ARG 310 CO 0.24 0.56 0.12 -1.58 -0.81 0.00 0.00 175.30 173.83 1w0p s TRP 311 N -1.02 0.09 0.51 5.12 0.52 0.69 -2.36 118.94 122.50 1w0p s TRP 311 Ca 0.17 -0.26 -0.21 0.00 0.02 0.00 0.00 56.10 55.82 1w0p s TRP 311 Cb -0.11 -0.08 -0.06 0.00 -1.15 0.00 0.00 33.47 32.07 1w0p s TRP 311 CO 0.08 -0.31 1.21 -1.25 0.02 0.00 0.00 176.95 176.70 1w0p s PRO 312 N -1.76 3.43 0.54 4.98 0.04 -1.25 -0.92 135.00 140.06 1w0p s PRO 312 Ca -0.12 1.85 0.37 0.00 0.04 0.00 0.00 61.00 63.14 1w0p s PRO 312 Cb -0.06 -2.23 1.98 0.00 0.04 0.00 0.00 34.50 34.23 1w0p s PRO 312 CO -0.00 -0.85 2.12 0.00 0.04 0.00 0.00 177.00 178.31 1w0p h THR 313 N 1.50 0.00 -0.41 1.26 1.03 -1.37 -2.90 112.91 112.03 1w0p h THR 313 Ca -0.50 -0.01 0.00 0.00 -0.01 0.00 0.00 66.41 65.89 1w0p h THR 313 Cb 1.27 0.83 0.00 0.00 -1.07 0.00 0.00 68.15 69.18 1w0p h THR 313 CO 0.58 0.00 0.00 -0.90 -0.01 0.00 0.00 175.52 175.19 1w0p n ASP 314 N -2.79 3.50 -3.64 0.00 5.75 -1.26 -2.60 116.55 115.51 1w0p n ASP 314 Ca -0.02 -2.28 -0.07 0.00 -0.01 0.00 0.00 54.79 52.40 1w0p n ASP 314 Cb 0.06 -0.37 -0.07 0.00 -1.03 0.00 0.00 41.12 39.71 1w0p n ASP 314 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1w0p s ALA 315 N -1.51 -1.97 0.00 2.12 0.00 -1.08 -4.75 121.76 114.57 1w0p s ALA 315 Ca 0.34 2.26 0.00 0.00 0.00 0.00 0.00 51.96 54.56 1w0p s ALA 315 Cb 0.21 -1.46 0.00 0.00 0.00 0.00 0.00 23.12 21.87 1w0p s ALA 315 CO 0.17 -0.35 0.00 0.00 0.00 0.00 0.00 175.76 175.58 1w0p n ALA 316 N 3.73 0.00 -0.20 0.00 0.00 -1.26 -3.77 120.51 119.01 1w0p n ALA 316 Ca -0.18 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.19 1w0p n ALA 316 Cb 0.58 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.06 1w0p n ALA 316 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1w0p h GLN 317 N 0.00 0.81 -6.53 0.00 4.15 -1.96 -1.56 115.11 110.02 1w0p h GLN 317 Ca 0.00 -0.10 -0.58 0.00 0.77 0.00 0.00 58.65 58.73 1w0p h GLN 317 Cb 0.00 -0.16 0.06 0.00 0.21 0.00 0.00 27.48 27.60 1w0p h GLN 317 CO 0.00 0.63 0.75 0.09 -1.93 0.00 0.00 178.83 178.37 1w0p n ASN 318 N -4.58 3.01 -0.35 -0.69 3.02 -1.26 -1.21 115.26 113.20 1w0p n ASN 318 Ca 0.03 1.10 -0.05 0.00 -0.03 0.00 0.00 54.58 55.64 1w0p n ASN 318 Cb 0.10 -1.43 -0.02 0.00 -0.61 0.00 0.00 39.78 37.82 1w0p n ASN 318 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1w0p n GLY 319 N 3.05 0.60 2.74 7.41 0.00 -1.26 -2.89 105.19 114.84 1w0p n GLY 319 Ca 0.15 -0.14 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 1w0p n GLY 319 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w0p n ASP 320 N -0.47 -4.75 0.17 1.61 8.00 -0.35 -4.87 116.55 115.90 1w0p n ASP 320 Ca -0.05 -0.07 0.03 0.00 0.71 0.00 0.00 54.79 55.42 1w0p n ASP 320 Cb 0.36 -3.94 0.30 0.00 -0.02 0.00 0.00 41.12 37.82 1w0p n ASP 320 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1w0p h ARG 321 N -0.49 0.00 -6.91 -1.24 3.08 -1.44 -3.44 114.38 103.94 1w0p h ARG 321 Ca -0.41 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.12 1w0p h ARG 321 Cb 1.29 0.00 0.07 0.00 0.08 0.00 0.00 29.97 31.41 1w0p h ARG 321 CO 0.48 0.44 0.61 -1.50 -1.07 0.00 0.00 179.97 178.94 1w0p s ILE 322 N -3.73 2.72 0.16 2.04 1.10 -0.60 -4.77 121.20 118.12 1w0p s ILE 322 Ca -0.01 0.68 0.07 0.00 -0.51 0.00 0.00 60.65 60.88 1w0p s ILE 322 Cb 0.12 -3.41 -0.04 0.00 0.15 0.00 0.00 42.46 39.28 1w0p s ILE 322 CO 0.71 0.13 -0.16 -0.54 -2.11 0.00 0.00 174.94 172.97 1w0p s LYS 323 N -2.02 1.22 0.60 3.50 -0.14 -1.26 -4.86 119.74 116.77 1w0p s LYS 323 Ca 0.53 -1.41 0.29 0.00 -1.36 0.00 0.00 55.97 54.02 1w0p s LYS 323 Cb -0.38 -1.14 1.62 0.00 -1.68 0.00 0.00 37.83 36.25 1w0p s LYS 323 CO 0.50 0.21 2.02 -1.35 -0.76 0.00 0.00 175.35 175.97 1w0p h PRO 324 N 3.11 0.00 -0.03 -1.68 0.11 -1.78 -1.31 132.00 130.42 1w0p h PRO 324 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1w0p h PRO 324 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1w0p h PRO 324 CO 0.54 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.66 1w0p n TRP 325 N -3.62 0.02 -3.47 0.65 2.14 -1.26 -4.66 117.44 107.25 1w0p n TRP 325 Ca 0.03 -0.01 -0.26 0.00 2.07 0.00 0.00 57.50 59.33 1w0p n TRP 325 Cb 0.43 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.91 1w0p n TRP 325 CO 0.00 0.00 0.00 -1.64 2.07 0.00 0.00 177.69 178.12 1w0p s MET 326 N -1.98 3.54 0.00 -2.67 -1.94 -0.50 -4.95 119.30 110.81 1w0p s MET 326 Ca 0.39 -0.23 0.00 0.00 -1.71 0.00 0.00 55.69 54.13 1w0p s MET 326 Cb 0.21 -2.71 0.00 0.00 2.01 0.00 0.00 34.83 34.33 1w0p s MET 326 CO 0.33 0.25 0.10 -2.30 -0.01 0.00 0.00 175.02 173.39 1w0p n PRO 327 N -1.18 0.12 -2.42 2.03 -0.02 -1.26 -4.88 135.00 127.39 1w0p n PRO 327 Ca -0.04 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.07 1w0p n PRO 327 Cb 0.55 -1.31 -0.03 0.00 -0.02 0.00 0.00 33.50 32.69 1w0p n PRO 327 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1w0p s ASN 328 N 0.37 6.58 0.01 2.55 2.47 -1.26 -4.32 114.94 121.34 1w0p s ASN 328 Ca 0.00 2.17 -0.09 0.00 0.42 0.00 0.00 52.86 55.36 1w0p s ASN 328 Cb 0.00 -2.60 0.03 0.00 -1.45 0.00 0.00 41.25 37.23 1w0p s ASN 328 CO 0.00 -0.63 0.42 0.61 -3.72 0.00 0.00 177.10 173.78 1w0p n GLY 329 N 0.45 0.65 3.04 1.21 0.00 -1.00 -4.95 105.19 104.59 1w0p n GLY 329 Ca 0.05 -0.93 -0.21 0.00 0.00 0.00 0.00 46.02 44.93 1w0p n GLY 329 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1w0p s ILE 330 N -2.18 0.93 0.25 -0.61 1.01 -1.26 -0.93 121.20 118.40 1w0p s ILE 330 Ca 0.10 -0.45 0.06 0.00 0.00 0.00 0.00 60.65 60.35 1w0p s ILE 330 Cb -0.00 -0.81 -0.05 0.00 0.01 0.00 0.00 42.46 41.60 1w0p s ILE 330 CO 0.00 0.28 -0.05 -0.36 0.00 0.00 0.00 174.94 174.81 1w0p s PHE 331 N 0.10 1.78 0.04 3.97 0.40 -0.40 -1.46 117.98 122.40 1w0p s PHE 331 Ca -0.02 -0.76 -0.03 0.00 -0.60 0.00 0.00 56.93 55.52 1w0p s PHE 331 Cb -0.09 -1.00 -0.02 0.00 0.51 0.00 0.00 43.02 42.42 1w0p s PHE 331 CO 0.01 0.18 0.03 1.52 0.70 0.00 0.00 175.22 177.66 1w0p s TYR 332 N -3.15 0.29 0.03 0.36 -0.85 -0.36 -1.03 117.35 112.64 1w0p s TYR 332 Ca 0.28 -0.63 0.05 0.00 -0.52 0.00 0.00 57.07 56.25 1w0p s TYR 332 Cb 0.04 -0.21 -0.02 0.00 0.38 0.00 0.00 41.96 42.15 1w0p s TYR 332 CO 0.10 -0.32 -0.14 -1.12 -1.52 0.00 0.00 175.55 172.54 1w0p s SER 333 N -2.11 1.70 -0.09 -0.18 0.01 -0.34 -0.85 113.70 111.83 1w0p s SER 333 Ca -0.05 -0.44 0.01 0.00 1.31 0.00 0.00 55.95 56.77 1w0p s SER 333 Cb -0.02 -0.12 -0.02 0.00 0.21 0.00 0.00 66.02 66.07 1w0p s SER 333 CO -0.05 0.06 -0.10 -0.69 0.41 0.00 0.00 173.24 172.87 1w0p s VAL 334 N -0.79 3.39 -0.17 3.43 1.01 -1.26 -1.31 120.40 124.70 1w0p s VAL 334 Ca 0.02 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 1w0p s VAL 334 Cb -0.08 -2.40 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 1w0p s VAL 334 CO 0.01 0.56 -0.10 -0.47 0.00 0.00 0.00 175.10 175.10 1w0p s TYR 335 N -0.30 2.87 -0.53 5.22 5.04 0.54 -0.83 117.35 129.36 1w0p s TYR 335 Ca 0.03 -0.84 -0.21 0.00 -2.44 0.00 0.00 57.07 53.61 1w0p s TYR 335 Cb -0.13 -1.95 0.05 0.00 0.35 0.00 0.00 41.96 40.29 1w0p s TYR 335 CO 0.03 -0.39 0.76 0.34 -1.34 0.00 0.00 175.55 174.94 1w0p s ASP 336 N 0.85 6.27 0.17 4.32 2.15 0.02 -1.48 116.67 128.97 1w0p s ASP 336 Ca -0.03 -0.70 -0.14 0.00 0.43 0.00 0.00 52.55 52.11 1w0p s ASP 336 Cb -0.15 -2.35 0.07 0.00 -0.30 0.00 0.00 42.92 40.19 1w0p s ASP 336 CO 0.00 -1.04 1.82 0.58 -0.17 0.00 0.00 175.17 176.37 1w0p h VAL 337 N 5.93 1.09 0.04 1.11 2.07 -1.81 0.29 116.25 124.97 1w0p h VAL 337 Ca -0.27 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.05 1w0p h VAL 337 Cb 1.09 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1w0p h VAL 337 CO 1.02 0.12 -0.16 0.00 0.02 0.00 0.00 177.57 178.57 1w0p h ALA 338 N 1.20 -0.22 -0.00 1.67 0.00 -1.93 -2.99 119.26 116.99 1w0p h ALA 338 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1w0p h ALA 338 Cb -0.03 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1w0p h ALA 338 CO -0.06 -0.67 -0.54 0.43 0.00 0.00 0.00 179.25 178.41 1w0p n SER 339 N -5.29 0.75 -1.96 0.00 7.64 -1.21 -4.98 113.62 108.57 1w0p n SER 339 Ca -0.06 -0.55 -0.14 0.00 1.01 0.00 0.00 58.87 59.13 1w0p n SER 339 Cb 0.21 0.37 0.02 0.00 -1.01 0.00 0.00 64.21 63.80 1w0p n SER 339 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1w0p n GLY 340 N 1.47 -0.08 3.43 0.23 0.00 0.98 -5.03 105.19 106.19 1w0p n GLY 340 Ca 0.07 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1w0p n GLY 340 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1w0p s ASN 341 N -2.80 3.85 0.31 1.61 0.01 -1.04 -4.94 114.94 111.94 1w0p s ASN 341 Ca 0.18 -0.27 -0.03 0.00 -0.71 0.00 0.00 52.86 52.03 1w0p s ASN 341 Cb -0.08 -0.92 -0.05 0.00 0.41 0.00 0.00 41.25 40.61 1w0p s ASN 341 CO 0.22 0.31 0.55 0.26 -1.51 0.00 0.00 177.10 176.93 1w0p s TRP 342 N -0.50 3.49 0.22 2.20 0.52 -1.26 -0.80 118.94 122.80 1w0p s TRP 342 Ca 0.06 0.56 0.10 0.00 0.02 0.00 0.00 56.10 56.85 1w0p s TRP 342 Cb -0.12 -2.04 -0.04 0.00 -1.15 0.00 0.00 33.47 30.11 1w0p s TRP 342 CO 0.01 0.15 -0.14 -0.65 0.02 0.00 0.00 176.95 176.34 1w0p s GLN 343 N -3.78 1.86 0.68 4.98 -0.21 -0.01 -4.97 119.66 118.22 1w0p s GLN 343 Ca 0.43 -1.47 -0.16 0.00 0.02 0.00 0.00 55.36 54.18 1w0p s GLN 343 Cb -0.10 -1.99 0.01 0.00 1.00 0.00 0.00 33.01 31.93 1w0p s GLN 343 CO 0.32 0.39 1.19 0.00 -2.12 0.00 0.00 175.29 175.08 1w0p s ALA 344 N -1.96 2.30 0.44 6.09 0.00 -1.26 -4.13 121.76 123.25 1w0p s ALA 344 Ca 0.26 0.87 -0.25 0.00 0.00 0.00 0.00 51.96 52.84 1w0p s ALA 344 Cb -0.07 -3.44 -0.09 0.00 0.00 0.00 0.00 23.12 19.51 1w0p s ALA 344 CO 0.14 -1.57 1.35 -2.30 0.00 0.00 0.00 175.76 173.39 1w0p n PRO 345 N -2.33 2.08 -4.96 0.00 -0.02 -1.26 -4.70 135.00 123.82 1w0p n PRO 345 Ca 0.13 0.74 -0.28 0.00 -2.02 0.00 0.00 63.50 62.07 1w0p n PRO 345 Cb 0.50 -2.51 -0.17 0.00 -0.02 0.00 0.00 33.50 31.30 1w0p n PRO 345 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1w0p s ILE 346 N -1.20 1.65 -0.12 4.25 1.01 -0.03 -4.94 121.20 121.82 1w0p s ILE 346 Ca 0.61 -0.80 -0.24 0.00 0.00 0.00 0.00 60.65 60.23 1w0p s ILE 346 Cb -0.48 -1.44 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 1w0p s ILE 346 CO 0.58 0.47 0.73 -0.62 0.00 0.00 0.00 174.94 176.09 1w0p s ASP 347 N 0.30 6.93 -0.06 3.58 -1.08 -1.26 -1.23 116.67 123.85 1w0p s ASP 347 Ca -0.12 1.12 0.08 0.00 -0.52 0.00 0.00 52.55 53.11 1w0p s ASP 347 Cb -0.15 -2.41 0.13 0.00 -1.46 0.00 0.00 42.92 39.02 1w0p s ASP 347 CO 0.05 -0.22 1.02 1.33 0.52 0.00 0.00 175.17 177.87 1w0p n VAL 348 N 4.21 1.20 -0.19 1.11 0.24 -0.53 -4.86 118.33 119.50 1w0p n VAL 348 Ca 0.00 -1.37 -0.00 0.00 -2.04 0.00 0.00 64.34 60.94 1w0p n VAL 348 Cb 0.50 0.22 0.09 0.00 -1.47 0.00 0.00 33.84 33.17 1w0p n VAL 348 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1w0p h THR 349 N 1.04 0.49 -0.01 3.34 2.02 -1.90 -0.89 112.91 117.01 1w0p h THR 349 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1w0p h THR 349 Cb 0.87 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1w0p h THR 349 CO 0.00 0.02 0.02 0.44 0.37 0.00 0.00 175.52 176.37 1w0p h ASP 350 N 0.09 0.00 0.71 4.18 3.32 -1.89 -0.11 116.42 122.73 1w0p h ASP 350 Ca 0.30 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 57.12 1w0p h ASP 350 Cb 0.48 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.99 1w0p h ASP 350 CO -0.52 0.00 -1.42 1.56 -1.72 0.00 0.00 179.24 177.14 1w0p h GLN 351 N 0.00 0.00 -0.00 3.56 4.20 -1.50 -3.41 115.11 117.96 1w0p h GLN 351 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1w0p h GLN 351 Cb 0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1w0p h GLN 351 CO -0.00 0.53 -0.17 1.33 -0.67 0.00 0.00 178.83 179.85 1w0p n VAL 352 N -3.07 0.00 -3.53 -0.54 0.24 -0.91 -4.66 118.33 105.87 1w0p n VAL 352 Ca -0.11 -0.41 -0.42 0.00 -2.04 0.00 0.00 64.34 61.36 1w0p n VAL 352 Cb 0.95 1.01 -0.08 0.00 -1.47 0.00 0.00 33.84 34.25 1w0p n VAL 352 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1w0p s LYS 353 N -1.29 2.58 0.36 7.34 2.20 -0.10 -4.96 119.74 125.86 1w0p s LYS 353 Ca 0.02 -1.69 -0.27 0.00 -0.36 0.00 0.00 55.97 53.66 1w0p s LYS 353 Cb 0.03 -3.95 -0.09 0.00 -1.51 0.00 0.00 37.83 32.30 1w0p s LYS 353 CO 0.15 -1.16 1.23 -2.00 -0.36 0.00 0.00 175.35 173.21 1w0p s GLU 354 N 1.41 4.25 -0.23 4.03 2.12 -1.26 -4.82 118.70 124.20 1w0p s GLU 354 Ca 0.05 2.02 0.01 0.00 0.36 0.00 0.00 54.97 57.40 1w0p s GLU 354 Cb -0.26 -2.92 0.06 0.00 0.26 0.00 0.00 34.13 31.27 1w0p s GLU 354 CO 0.00 -0.20 -0.06 1.03 -0.54 0.00 0.00 175.26 175.49 1w0p s ARG 355 N -1.96 1.67 0.19 4.30 3.00 -1.26 -2.11 118.95 122.78 1w0p s ARG 355 Ca 0.52 -0.96 -0.24 0.00 0.00 0.00 0.00 55.73 55.05 1w0p s ARG 355 Cb -0.35 -2.55 0.05 0.00 0.00 0.00 0.00 34.95 32.10 1w0p s ARG 355 CO 0.46 -0.57 0.90 -1.54 0.00 0.00 0.00 175.30 174.55 1w0p s SER 356 N 1.40 -0.19 -0.19 0.23 1.04 -1.26 -4.38 113.70 110.34 1w0p s SER 356 Ca -0.05 -0.47 -0.12 0.00 0.48 0.00 0.00 55.95 55.79 1w0p s SER 356 Cb -0.18 0.55 -0.05 0.00 0.10 0.00 0.00 66.02 66.44 1w0p s SER 356 CO -0.06 -1.02 0.22 0.12 0.98 0.00 0.00 173.24 173.47 1w0p s PHE 357 N -3.40 3.41 -0.09 5.02 5.36 -0.06 0.53 117.98 128.75 1w0p s PHE 357 Ca 0.12 0.43 0.02 0.00 -0.96 0.00 0.00 56.93 56.55 1w0p s PHE 357 Cb -0.03 -2.28 -0.02 0.00 -0.34 0.00 0.00 43.02 40.36 1w0p s PHE 357 CO 0.04 0.21 -0.16 -0.65 -1.46 0.00 0.00 175.22 173.19 1w0p s GLN 358 N 0.59 2.98 -0.20 10.12 -0.21 0.19 -0.57 119.66 132.56 1w0p s GLN 358 Ca 0.12 -0.74 0.01 0.00 0.02 0.00 0.00 55.36 54.77 1w0p s GLN 358 Cb -0.12 -2.46 0.04 0.00 1.00 0.00 0.00 33.01 31.47 1w0p s GLN 358 CO 0.02 0.35 -0.14 0.42 -2.12 0.00 0.00 175.29 173.83 1w0p s ILE 359 N -0.04 1.83 -0.51 1.08 1.01 -0.61 -1.19 121.20 122.77 1w0p s ILE 359 Ca -0.04 -1.03 -0.11 0.00 0.00 0.00 0.00 60.65 59.47 1w0p s ILE 359 Cb -0.14 -1.81 0.13 0.00 0.01 0.00 0.00 42.46 40.65 1w0p s ILE 359 CO 0.04 0.28 0.41 0.00 0.00 0.00 0.00 174.94 175.67 1w0p s ALA 360 N 1.33 3.49 -1.33 9.38 0.00 0.29 -1.97 121.76 132.97 1w0p s ALA 360 Ca 0.00 -2.62 -0.06 0.00 0.00 0.00 0.00 51.96 49.29 1w0p s ALA 360 Cb -0.15 -2.95 0.12 0.00 0.00 0.00 0.00 23.12 20.13 1w0p s ALA 360 CO -0.09 -1.96 2.39 0.41 0.00 0.00 0.00 175.76 176.50 1w0p n GLY 361 N 4.86 5.20 3.30 0.00 0.00 0.53 -2.63 105.19 116.45 1w0p n GLY 361 Ca -0.07 -2.05 -0.45 0.00 0.00 0.00 0.00 46.02 43.45 1w0p n GLY 361 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1w0p s TRP 362 N -1.09 3.45 0.00 1.61 0.51 -1.26 -2.38 118.94 119.78 1w0p s TRP 362 Ca 0.54 -1.65 0.00 0.00 -2.12 0.00 0.00 56.10 52.87 1w0p s TRP 362 Cb 0.18 -3.75 0.00 0.00 -0.81 0.00 0.00 33.47 29.10 1w0p s TRP 362 CO -0.09 -1.00 0.00 0.41 -0.51 0.00 0.00 176.95 175.76 1w0p n GLY 363 N 4.71 0.99 1.14 0.98 0.00 -1.25 -4.63 105.19 107.13 1w0p n GLY 363 Ca -0.03 -0.01 0.01 0.00 0.00 0.00 0.00 46.02 45.99 1w0p n GLY 363 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w0p n GLY 364 N -2.02 0.38 3.20 -0.02 0.00 -0.89 -1.26 105.19 104.58 1w0p n GLY 364 Ca 0.00 -0.87 -0.22 0.00 0.00 0.00 0.00 46.02 44.93 1w0p n GLY 364 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1w0p s SER 365 N -1.83 2.02 -0.21 1.61 1.04 -0.19 -4.17 113.70 111.98 1w0p s SER 365 Ca 0.09 -0.52 -0.04 0.00 0.48 0.00 0.00 55.95 55.96 1w0p s SER 365 Cb -0.00 -0.13 0.10 0.00 0.10 0.00 0.00 66.02 66.09 1w0p s SER 365 CO -0.01 0.06 0.29 -0.70 0.98 0.00 0.00 173.24 173.87 1w0p s GLU 366 N -1.32 0.25 0.16 4.02 2.12 -0.13 -1.49 118.70 122.32 1w0p s GLU 366 Ca 0.04 0.44 0.10 0.00 0.36 0.00 0.00 54.97 55.91 1w0p s GLU 366 Cb -0.09 -0.70 -0.04 0.00 0.26 0.00 0.00 34.13 33.56 1w0p s GLU 366 CO 0.02 -0.58 -0.23 -0.51 -0.54 0.00 0.00 175.26 173.42 1w0p s LEU 367 N 2.43 2.40 -0.11 2.70 1.43 -0.11 -1.47 118.68 125.95 1w0p s LEU 367 Ca 0.08 -0.82 0.02 0.00 -1.03 0.00 0.00 54.13 52.37 1w0p s LEU 367 Cb -0.15 -1.07 0.01 0.00 0.03 0.00 0.00 46.19 45.01 1w0p s LEU 367 CO -0.13 0.09 -0.15 -0.31 0.23 0.00 0.00 176.35 176.08 1w0p s TYR 368 N -1.58 2.00 -0.04 0.29 2.02 -0.21 -0.68 117.35 119.14 1w0p s TYR 368 Ca 0.17 -0.94 0.04 0.00 -0.37 0.00 0.00 57.07 55.97 1w0p s TYR 368 Cb -0.08 -1.44 -0.00 0.00 -0.40 0.00 0.00 41.96 40.04 1w0p s TYR 368 CO 0.08 -0.48 -0.15 0.50 -1.57 0.00 0.00 175.55 173.93 1w0p s ARG 369 N 0.98 1.61 -0.21 -0.62 3.52 -0.25 -1.83 118.95 122.15 1w0p s ARG 369 Ca -0.07 -0.53 0.01 0.00 -0.13 0.00 0.00 55.73 55.01 1w0p s ARG 369 Cb -0.15 -1.41 0.05 0.00 -1.56 0.00 0.00 34.95 31.88 1w0p s ARG 369 CO -0.02 0.20 -0.10 0.50 -0.81 0.00 0.00 175.30 175.08 1w0p s ARG 370 N 0.12 2.02 0.34 5.12 3.52 -0.56 -0.36 118.95 129.15 1w0p s ARG 370 Ca -0.05 -0.91 -0.28 0.00 -0.13 0.00 0.00 55.73 54.36 1w0p s ARG 370 Cb -0.11 -2.49 -0.10 0.00 -1.56 0.00 0.00 34.95 30.69 1w0p s ARG 370 CO 0.02 -0.46 1.31 -0.80 -0.81 0.00 0.00 175.30 174.56 1w0p s ASN 371 N 1.36 6.72 0.40 -2.12 0.01 -1.26 -2.17 114.94 117.88 1w0p s ASN 371 Ca -0.02 2.69 0.04 0.00 -0.71 0.00 0.00 52.86 54.85 1w0p s ASN 371 Cb -0.17 -2.65 -0.01 0.00 0.41 0.00 0.00 41.25 38.83 1w0p s ASN 371 CO -0.08 -0.57 0.13 0.35 -1.51 0.00 0.00 177.10 175.42 1w0p n THR 372 N 0.72 0.00 -2.53 1.60 -2.24 -0.28 -4.93 114.28 106.63 1w0p n THR 372 Ca 0.00 -2.31 -0.17 0.00 -2.27 0.00 0.00 64.05 59.30 1w0p n THR 372 Cb 0.42 0.80 0.02 0.00 -2.10 0.00 0.00 70.33 69.47 1w0p n THR 372 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1w0p n SER 373 N -1.52 3.23 -4.75 3.42 7.64 -1.26 -4.64 113.62 115.74 1w0p n SER 373 Ca -0.07 -3.18 -0.37 0.00 1.01 0.00 0.00 58.87 56.26 1w0p n SER 373 Cb 0.60 -0.47 0.03 0.00 -1.01 0.00 0.00 64.21 63.36 1w0p n SER 373 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1w0p s LEU 374 N -3.43 3.81 -0.35 -3.43 1.43 -1.26 -4.99 118.68 110.46 1w0p s LEU 374 Ca 0.39 2.60 -0.09 0.00 -1.03 0.00 0.00 54.13 56.00 1w0p s LEU 374 Cb 0.41 -4.37 0.03 0.00 0.03 0.00 0.00 46.19 42.29 1w0p s LEU 374 CO -0.06 -1.51 0.15 0.21 0.23 0.00 0.00 176.35 175.36 1w0p s ASN 375 N -1.20 5.50 0.01 2.29 3.84 -1.26 -4.72 114.94 119.40 1w0p s ASN 375 Ca 0.73 -1.04 0.10 0.00 0.21 0.00 0.00 52.86 52.86 1w0p s ASN 375 Cb -0.36 -1.94 0.42 0.00 -0.55 0.00 0.00 41.25 38.81 1w0p s ASN 375 CO 0.42 -0.34 1.31 -1.54 -2.79 0.00 0.00 177.10 174.15 1w0p n SER 376 N 4.90 0.03 -0.27 -4.21 3.41 -1.25 -1.79 113.62 114.44 1w0p n SER 376 Ca -0.12 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.12 1w0p n SER 376 Cb 0.46 -0.51 0.61 0.00 -0.26 0.00 0.00 64.21 64.50 1w0p n SER 376 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w0p n GLN 377 N -1.53 1.36 -4.02 4.33 6.02 -1.26 -4.77 117.38 117.51 1w0p n GLN 377 Ca 0.02 -0.53 -0.08 0.00 -0.01 0.00 0.00 57.00 56.40 1w0p n GLN 377 Cb 0.11 -1.43 -0.10 0.00 1.02 0.00 0.00 30.24 29.84 1w0p n GLN 377 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 1w0p s GLN 378 N -1.95 0.54 0.67 -1.09 -2.07 -0.74 -4.86 119.66 110.16 1w0p s GLN 378 Ca 0.37 -0.98 -0.17 0.00 -1.82 0.00 0.00 55.36 52.76 1w0p s GLN 378 Cb 0.19 0.19 0.00 0.00 -1.09 0.00 0.00 33.01 32.31 1w0p s GLN 378 CO 0.30 -0.11 1.28 -0.51 -1.32 0.00 0.00 175.29 174.93 1w0p s ASP 379 N -2.42 4.43 0.12 12.60 1.11 -1.26 -4.59 116.67 126.66 1w0p s ASP 379 Ca -0.01 2.58 -0.14 0.00 0.18 0.00 0.00 52.55 55.17 1w0p s ASP 379 Cb 0.02 -2.61 0.02 0.00 1.07 0.00 0.00 42.92 41.42 1w0p s ASP 379 CO -0.07 -2.12 0.34 -1.66 1.18 0.00 0.00 175.17 172.84 1w0p s TRP 380 N -1.52 -0.08 -0.01 4.23 1.48 -1.14 -4.22 118.94 117.68 1w0p s TRP 380 Ca 0.81 -0.28 -0.04 0.00 -1.06 0.00 0.00 56.10 55.53 1w0p s TRP 380 Cb -0.36 0.16 0.00 0.00 -1.16 0.00 0.00 33.47 32.11 1w0p s TRP 380 CO 0.41 -0.66 0.08 -0.65 -4.06 0.00 0.00 176.95 172.08 1w0p s GLN 381 N -3.83 0.28 0.03 3.25 1.11 -0.33 -0.97 119.66 119.21 1w0p s GLN 381 Ca 0.04 -0.20 0.04 0.00 0.01 0.00 0.00 55.36 55.25 1w0p s GLN 381 Cb 0.03 0.12 -0.02 0.00 -1.01 0.00 0.00 33.01 32.12 1w0p s GLN 381 CO -0.11 -0.06 -0.11 -1.54 0.01 0.00 0.00 175.29 173.49 1w0p s SER 382 N -0.75 1.24 -0.02 5.90 1.04 -0.30 -0.63 113.70 120.18 1w0p s SER 382 Ca -0.08 -0.41 0.03 0.00 0.48 0.00 0.00 55.95 55.96 1w0p s SER 382 Cb -0.05 -0.06 -0.00 0.00 0.10 0.00 0.00 66.02 66.01 1w0p s SER 382 CO 0.00 -0.03 -0.10 0.20 0.98 0.00 0.00 173.24 174.30 1w0p s ASN 383 N -1.07 1.25 -0.14 7.02 -0.87 -0.22 -0.65 114.94 120.26 1w0p s ASN 383 Ca -0.02 -0.19 -0.04 0.00 -1.57 0.00 0.00 52.86 51.04 1w0p s ASN 383 Cb -0.07 -0.24 0.06 0.00 -0.02 0.00 0.00 41.25 40.98 1w0p s ASN 383 CO 0.01 0.10 0.17 0.00 -2.57 0.00 0.00 177.10 174.81 1w0p s ALA 384 N -0.02 -0.12 -0.44 0.60 0.00 -0.05 -0.92 121.76 120.81 1w0p s ALA 384 Ca 0.00 0.34 -0.21 0.00 0.00 0.00 0.00 51.96 52.10 1w0p s ALA 384 Cb -0.06 -1.02 0.02 0.00 0.00 0.00 0.00 23.12 22.06 1w0p s ALA 384 CO 0.00 -0.87 0.64 0.21 0.00 0.00 0.00 175.76 175.74 1w0p s LYS 385 N 2.29 3.27 0.06 0.00 2.20 -0.24 -0.56 119.74 126.75 1w0p s LYS 385 Ca 0.04 -0.39 0.05 0.00 -0.36 0.00 0.00 55.97 55.31 1w0p s LYS 385 Cb -0.14 -3.95 -0.03 0.00 -1.51 0.00 0.00 37.83 32.20 1w0p s LYS 385 CO -0.08 -1.01 -0.14 0.42 -0.36 0.00 0.00 175.35 174.17 1w0p s ILE 386 N 2.80 1.13 -0.05 5.43 1.01 -0.47 -1.46 121.20 129.59 1w0p s ILE 386 Ca 0.22 -1.19 0.03 0.00 0.00 0.00 0.00 60.65 59.72 1w0p s ILE 386 Cb -0.14 -1.06 0.00 0.00 0.01 0.00 0.00 42.46 41.27 1w0p s ILE 386 CO 0.19 -0.12 -0.14 -0.60 0.00 0.00 0.00 174.94 174.26 1w0p s ARG 387 N -1.49 1.70 -0.34 2.79 3.52 -0.16 -1.52 118.95 123.44 1w0p s ARG 387 Ca -0.00 -0.50 -0.13 0.00 -0.13 0.00 0.00 55.73 54.96 1w0p s ARG 387 Cb -0.09 -1.44 -0.02 0.00 -1.56 0.00 0.00 34.95 31.84 1w0p s ARG 387 CO 0.02 0.14 0.24 0.42 -0.81 0.00 0.00 175.30 175.31 1w0p s ILE 388 N 0.32 5.27 -0.01 4.11 -1.09 -1.26 -0.88 121.20 127.66 1w0p s ILE 388 Ca -0.09 -0.24 -0.20 0.00 -2.23 0.00 0.00 60.65 57.89 1w0p s ILE 388 Cb -0.13 -3.72 -0.27 0.00 -1.58 0.00 0.00 42.46 36.76 1w0p s ILE 388 CO 0.03 -0.02 1.03 0.58 -1.23 0.00 0.00 174.94 175.33 1w0p h VAL 389 N 5.50 1.44 -1.78 2.92 2.07 -1.41 -3.41 116.25 121.58 1w0p h VAL 389 Ca -0.31 -2.28 0.29 0.00 0.82 0.00 0.00 66.70 65.22 1w0p h VAL 389 Cb 1.16 2.81 -0.10 0.00 -1.52 0.00 0.00 31.29 33.64 1w0p h VAL 389 CO 0.64 0.66 0.76 1.51 0.02 0.00 0.00 177.57 181.16 1w0p s ASP 390 N -6.91 -0.06 0.35 0.57 3.84 -1.16 -4.97 116.67 108.32 1w0p s ASP 390 Ca -0.13 -0.24 0.00 0.00 -0.00 0.00 0.00 52.55 52.19 1w0p s ASP 390 Cb 0.03 0.24 0.00 0.00 -1.38 0.00 0.00 42.92 41.81 1w0p s ASP 390 CO 0.84 -0.46 0.00 0.61 -0.00 0.00 0.00 175.17 176.16 1w0p n GLY 391 N -0.56 -0.11 0.00 2.12 0.00 -1.26 -1.60 105.19 103.77 1w0p n GLY 391 Ca -0.06 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.96 1w0p n GLY 391 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w0p n ALA 392 N 4.19 0.00 -1.83 4.61 0.00 -0.38 -1.48 120.51 125.62 1w0p n ALA 392 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1w0p n ALA 392 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1w0p n ALA 392 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1w0p n ALA 393 N -3.00 -0.39 -2.64 0.00 0.00 -1.26 -4.07 120.51 109.15 1w0p n ALA 393 Ca 0.00 0.26 -0.39 0.00 0.00 0.00 0.00 53.44 53.31 1w0p n ALA 393 Cb 0.00 -1.98 -0.08 0.00 0.00 0.00 0.00 19.45 17.39 1w0p n ALA 393 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1w0p s ASN 394 N -2.57 6.42 0.17 0.00 0.02 -1.20 -0.79 114.94 116.98 1w0p s ASN 394 Ca 0.00 0.50 -0.05 0.00 -1.02 0.00 0.00 52.86 52.30 1w0p s ASN 394 Cb 0.00 -2.25 -0.03 0.00 0.02 0.00 0.00 41.25 38.99 1w0p s ASN 394 CO 0.00 -0.18 0.18 0.00 0.02 0.00 0.00 177.10 177.12 1w0p s GLN 395 N 1.84 1.11 -0.04 -0.60 -2.07 -0.27 0.20 119.66 119.83 1w0p s GLN 395 Ca 0.20 -1.37 0.01 0.00 -1.82 0.00 0.00 55.36 52.38 1w0p s GLN 395 Cb -0.15 0.31 0.02 0.00 -1.09 0.00 0.00 33.01 32.09 1w0p s GLN 395 CO 0.09 -0.37 -0.05 -1.50 -1.32 0.00 0.00 175.29 172.13 1w0p s ILE 396 N -4.04 0.57 0.03 3.63 1.10 -0.88 -1.93 121.20 119.68 1w0p s ILE 396 Ca 0.25 -0.17 -0.02 0.00 -0.51 0.00 0.00 60.65 60.20 1w0p s ILE 396 Cb 0.05 -0.57 -0.02 0.00 0.15 0.00 0.00 42.46 42.07 1w0p s ILE 396 CO 0.04 0.22 -0.00 0.00 -2.11 0.00 0.00 174.94 173.08 1w0p s GLN 397 N 0.69 0.45 -0.03 3.50 -2.07 0.55 -1.39 119.66 121.37 1w0p s GLN 397 Ca -0.09 -0.80 -0.00 0.00 -1.82 0.00 0.00 55.36 52.64 1w0p s GLN 397 Cb -0.13 0.16 0.03 0.00 -1.09 0.00 0.00 33.01 31.99 1w0p s GLN 397 CO 0.00 -0.09 0.05 0.08 -1.32 0.00 0.00 175.29 174.02 1w0p s VAL 398 N -2.37 -0.06 -0.06 3.63 1.01 -0.55 -1.22 120.40 120.76 1w0p s VAL 398 Ca -0.07 0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.17 1w0p s VAL 398 Cb -0.03 -0.11 -0.00 0.00 0.00 0.00 0.00 36.38 36.24 1w0p s VAL 398 CO -0.04 0.09 -0.20 0.00 0.00 0.00 0.00 175.10 174.95 1w0p s ALA 399 N 1.12 1.81 -0.17 5.51 0.00 0.51 -0.65 121.76 129.89 1w0p s ALA 399 Ca -0.09 -0.81 0.17 0.00 0.00 0.00 0.00 51.96 51.23 1w0p s ALA 399 Cb -0.13 -0.63 0.50 0.00 0.00 0.00 0.00 23.12 22.86 1w0p s ALA 399 CO -0.03 0.29 1.39 -0.40 0.00 0.00 0.00 175.76 177.00 1w0p n ASP 400 N 3.29 3.69 0.00 0.00 5.68 -0.69 -1.05 116.55 127.47 1w0p n ASP 400 Ca -0.19 -3.03 0.00 0.00 -0.50 0.00 0.00 54.79 51.07 1w0p n ASP 400 Cb 0.53 -0.53 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 1w0p n ASP 400 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1w0p n GLY 401 N -0.64 1.37 0.00 6.12 0.00 0.88 -3.87 105.19 109.06 1w0p n GLY 401 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1w0p n GLY 401 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1w0p n SER 402 N 0.00 2.35 -3.93 1.61 7.64 -1.06 -4.43 113.62 115.80 1w0p n SER 402 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 1w0p n SER 402 Cb 0.00 0.04 -0.09 0.00 -1.01 0.00 0.00 64.21 63.15 1w0p n SER 402 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1w0p s ARG 403 N -1.57 0.58 -0.08 1.43 6.06 -1.22 -2.21 118.95 121.94 1w0p s ARG 403 Ca 0.00 -0.73 0.04 0.00 -2.50 0.00 0.00 55.73 52.53 1w0p s ARG 403 Cb 0.00 0.23 -0.01 0.00 0.06 0.00 0.00 34.95 35.22 1w0p s ARG 403 CO 0.00 -0.14 -0.19 0.21 -2.50 0.00 0.00 175.30 172.68 1w0p s LYS 404 N -2.53 2.82 -0.18 5.12 2.20 0.40 -1.70 119.74 125.88 1w0p s LYS 404 Ca -0.06 -0.79 0.01 0.00 -0.36 0.00 0.00 55.97 54.77 1w0p s LYS 404 Cb -0.02 -2.36 0.02 0.00 -1.51 0.00 0.00 37.83 33.97 1w0p s LYS 404 CO -0.04 0.37 -0.18 0.71 -0.36 0.00 0.00 175.35 175.85 1w0p s TYR 405 N -0.11 2.69 -0.09 4.03 2.02 0.17 -1.56 117.35 124.51 1w0p s TYR 405 Ca -0.04 -1.62 0.03 0.00 -0.37 0.00 0.00 57.07 55.07 1w0p s TYR 405 Cb -0.14 -1.85 0.01 0.00 -0.40 0.00 0.00 41.96 39.58 1w0p s TYR 405 CO 0.04 -0.79 -0.17 0.08 -1.57 0.00 0.00 175.55 173.15 1w0p s VAL 406 N 1.32 1.52 -0.21 0.71 1.01 -1.26 -1.49 120.40 122.00 1w0p s VAL 406 Ca 0.04 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 1w0p s VAL 406 Cb -0.14 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.87 1w0p s VAL 406 CO -0.12 0.44 -0.04 -0.69 0.00 0.00 0.00 175.10 174.69 1w0p s VAL 407 N 0.69 3.43 -0.20 2.92 1.01 -0.48 -2.34 120.40 125.43 1w0p s VAL 407 Ca -0.13 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 61.33 1w0p s VAL 407 Cb -0.16 -2.55 -0.02 0.00 0.00 0.00 0.00 36.38 33.64 1w0p s VAL 407 CO 0.03 0.43 -0.01 -0.89 0.00 0.00 0.00 175.10 174.66 1w0p s THR 408 N 1.36 3.82 -0.10 3.92 2.01 -0.28 -2.06 115.64 124.30 1w0p s THR 408 Ca 0.04 -0.36 -0.02 0.00 0.31 0.00 0.00 61.69 61.66 1w0p s THR 408 Cb -0.14 -2.72 -0.03 0.00 0.01 0.00 0.00 72.50 69.61 1w0p s THR 408 CO -0.02 0.43 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.58 1w0p s LEU 409 N 1.01 3.49 0.21 4.42 1.43 0.13 -1.24 118.68 128.14 1w0p s LEU 409 Ca 0.01 0.07 -0.10 0.00 -1.03 0.00 0.00 54.13 53.09 1w0p s LEU 409 Cb -0.14 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.26 1w0p s LEU 409 CO 0.01 0.32 0.36 -0.94 0.23 0.00 0.00 176.35 176.33 1w0p s SER 410 N -0.55 -0.02 -0.23 2.29 1.04 -0.48 -3.27 113.70 112.48 1w0p s SER 410 Ca 0.09 -0.98 -0.08 0.00 0.48 0.00 0.00 55.95 55.47 1w0p s SER 410 Cb -0.12 0.50 -0.03 0.00 0.10 0.00 0.00 66.02 66.47 1w0p s SER 410 CO 0.02 -1.01 0.08 -0.63 0.98 0.00 0.00 173.24 172.68 1w0p s ILE 411 N -4.02 4.55 0.69 -1.02 -1.09 -0.55 -0.91 121.20 118.85 1w0p s ILE 411 Ca 0.23 -0.10 -0.10 0.00 -2.23 0.00 0.00 60.65 58.45 1w0p s ILE 411 Cb 0.02 -3.11 0.16 0.00 -1.58 0.00 0.00 42.46 37.94 1w0p s ILE 411 CO 0.06 0.36 0.94 -0.90 -1.23 0.00 0.00 174.94 174.18 1w0p n ASP 412 N 4.57 0.22 0.23 3.58 5.68 -0.30 -4.83 116.55 125.70 1w0p n ASP 412 Ca -0.16 -1.43 0.06 0.00 -0.50 0.00 0.00 54.79 52.75 1w0p n ASP 412 Cb 0.52 -0.71 0.52 0.00 -1.14 0.00 0.00 41.12 40.31 1w0p n ASP 412 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1w0p h GLU 413 N 0.00 0.00 -0.00 0.11 3.07 -1.99 -1.66 114.58 114.11 1w0p h GLU 413 Ca -0.31 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 1w0p h GLU 413 Cb 0.88 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.79 1w0p h GLU 413 CO 0.23 0.17 -0.04 0.43 -1.40 0.00 0.00 179.01 178.40 1w0p n SER 414 N -4.30 0.08 0.00 1.42 7.64 -1.26 -4.88 113.62 112.31 1w0p n SER 414 Ca -0.02 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1w0p n SER 414 Cb 0.23 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 1w0p n SER 414 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1w0p n GLY 415 N 1.37 0.73 3.94 0.23 0.00 -0.62 -5.05 105.19 105.78 1w0p n GLY 415 Ca 0.11 -0.14 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 1w0p n GLY 415 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1w0p s GLY 416 N -2.13 1.67 -0.25 -0.02 0.00 -1.26 -4.75 107.32 100.58 1w0p s GLY 416 Ca 0.00 -0.94 -0.13 0.00 0.00 0.00 0.00 44.72 43.65 1w0p s GLY 416 CO 0.00 -0.63 0.29 -2.27 0.00 0.00 0.00 173.10 170.48 1w0p s LEU 417 N -4.96 4.07 0.01 0.66 2.96 -0.14 -1.15 118.68 120.13 1w0p s LEU 417 Ca 0.56 0.22 0.08 0.00 -0.22 0.00 0.00 54.13 54.76 1w0p s LEU 417 Cb -0.10 -2.30 -0.02 0.00 0.50 0.00 0.00 46.19 44.27 1w0p s LEU 417 CO 0.43 -0.08 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.45 1w0p s VAL 418 N 1.63 1.91 -0.06 1.68 1.01 -0.09 -0.76 120.40 125.72 1w0p s VAL 418 Ca 0.12 -1.17 0.05 0.00 0.00 0.00 0.00 61.98 60.98 1w0p s VAL 418 Cb -0.15 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 1w0p s VAL 418 CO 0.09 0.41 -0.20 0.00 0.00 0.00 0.00 175.10 175.40 1w0p s ALA 419 N -0.68 2.39 -0.09 5.51 0.00 0.61 -1.38 121.76 128.13 1w0p s ALA 419 Ca 0.10 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 51.06 1w0p s ALA 419 Cb -0.09 -0.83 0.01 0.00 0.00 0.00 0.00 23.12 22.21 1w0p s ALA 419 CO 0.01 0.45 -0.15 -0.80 0.00 0.00 0.00 175.76 175.27 1w0p s ASN 420 N -0.33 2.20 -0.10 0.00 0.01 -0.37 -0.18 114.94 116.18 1w0p s ASN 420 Ca 0.02 -0.38 -0.04 0.00 -0.71 0.00 0.00 52.86 51.76 1w0p s ASN 420 Cb -0.13 -1.00 -0.04 0.00 0.41 0.00 0.00 41.25 40.50 1w0p s ASN 420 CO 0.02 0.04 0.05 -0.76 -1.51 0.00 0.00 177.10 174.94 1w0p s LEU 421 N 0.77 3.85 0.07 0.60 1.43 -1.26 -1.12 118.68 123.02 1w0p s LEU 421 Ca -0.12 0.25 -0.31 0.00 -1.03 0.00 0.00 54.13 52.93 1w0p s LEU 421 Cb -0.16 -1.90 -0.09 0.00 0.03 0.00 0.00 46.19 44.07 1w0p s LEU 421 CO 0.02 0.39 1.73 0.54 0.23 0.00 0.00 176.35 179.26 1w0p s ASN 422 N -0.93 6.54 0.00 2.29 4.22 -0.99 -1.76 114.94 124.31 1w0p s ASN 422 Ca 0.14 2.56 0.00 0.00 -2.14 0.00 0.00 52.86 53.42 1w0p s ASN 422 Cb -0.12 -2.56 0.00 0.00 1.28 0.00 0.00 41.25 39.86 1w0p s ASN 422 CO 0.03 -0.94 0.00 0.61 -2.04 0.00 0.00 177.10 174.76 1w0p n GLY 423 N 4.12 0.68 3.14 0.45 0.00 -1.26 -4.37 105.19 107.96 1w0p n GLY 423 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1w0p n GLY 423 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w0p s VAL 424 N -2.61 2.31 0.04 1.61 1.01 -0.72 -5.04 120.40 117.01 1w0p s VAL 424 Ca 0.00 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 1w0p s VAL 424 Cb 0.00 -2.07 -0.18 0.00 0.00 0.00 0.00 36.38 34.14 1w0p s VAL 424 CO 0.00 0.40 1.43 0.77 0.00 0.00 0.00 175.10 177.70 1w0p h SER 425 N 7.94 -0.68 -2.77 3.32 4.64 -1.97 -3.40 113.55 120.63 1w0p h SER 425 Ca -0.40 -0.02 -0.54 0.00 -0.47 0.00 0.00 61.79 60.36 1w0p h SER 425 Cb 1.12 0.18 0.01 0.00 -0.31 0.00 0.00 62.40 63.40 1w0p h SER 425 CO 0.60 -0.40 0.94 0.00 -0.87 0.00 0.00 176.83 177.10 1w0p s ALA 426 N -5.54 3.65 0.70 5.18 0.00 -1.26 -5.00 121.76 119.49 1w0p s ALA 426 Ca -0.16 1.10 -0.11 0.00 0.00 0.00 0.00 51.96 52.79 1w0p s ALA 426 Cb 0.03 -3.66 0.01 0.00 0.00 0.00 0.00 23.12 19.50 1w0p s ALA 426 CO 0.56 -1.03 1.07 -2.14 0.00 0.00 0.00 175.76 174.22 1w0p s PRO 427 N 2.52 2.83 -0.19 0.00 0.02 -1.26 -4.83 135.00 134.09 1w0p s PRO 427 Ca 0.70 1.01 -0.02 0.00 0.02 0.00 0.00 61.00 62.72 1w0p s PRO 427 Cb -0.37 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.18 1w0p s PRO 427 CO 0.30 -1.18 -0.11 0.42 -0.33 0.00 0.00 177.00 176.10 1w0p s ILE 428 N -2.99 2.85 -0.42 2.83 1.01 0.75 -4.96 121.20 120.28 1w0p s ILE 428 Ca 0.59 -0.68 -0.26 0.00 0.00 0.00 0.00 60.65 60.30 1w0p s ILE 428 Cb -0.15 -2.26 0.02 0.00 0.01 0.00 0.00 42.46 40.09 1w0p s ILE 428 CO 0.54 0.48 0.93 -0.63 0.00 0.00 0.00 174.94 176.26 1w0p s ILE 429 N 1.24 4.52 -0.02 2.92 1.01 -1.26 -0.28 121.20 129.33 1w0p s ILE 429 Ca 0.03 0.96 -0.12 0.00 0.00 0.00 0.00 60.65 61.52 1w0p s ILE 429 Cb -0.14 -4.39 -0.32 0.00 0.01 0.00 0.00 42.46 37.62 1w0p s ILE 429 CO -0.05 -0.70 0.80 -0.07 0.00 0.00 0.00 174.94 174.92 1w0p h LEU 430 N 10.35 0.67 -7.52 2.97 4.07 -1.31 -3.48 115.31 121.06 1w0p h LEU 430 Ca -0.24 -0.88 -0.13 0.00 0.08 0.00 0.00 57.88 56.71 1w0p h LEU 430 Cb 1.08 -0.22 -0.22 0.00 1.08 0.00 0.00 40.66 42.38 1w0p h LEU 430 CO 1.01 1.73 -0.33 -1.10 -1.08 0.00 0.00 178.44 178.66 1w0p s GLN 431 N -2.59 0.55 -0.02 1.13 -1.52 -1.16 -5.00 119.66 111.05 1w0p s GLN 431 Ca -0.13 -0.03 0.02 0.00 -1.95 0.00 0.00 55.36 53.27 1w0p s GLN 431 Cb 0.05 0.25 -0.03 0.00 -0.22 0.00 0.00 33.01 33.06 1w0p s GLN 431 CO 0.88 -0.13 0.01 -1.13 -0.25 0.00 0.00 175.29 174.68 1w0p n SER 432 N 1.80 4.48 -4.65 5.90 3.41 -1.26 -0.97 113.62 122.33 1w0p n SER 432 Ca -0.19 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 57.99 1w0p n SER 432 Cb 0.56 0.61 -0.02 0.00 -0.26 0.00 0.00 64.21 65.10 1w0p n SER 432 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1w0p s GLU 433 N -2.06 4.15 0.35 4.33 2.02 -1.26 -4.68 118.70 121.54 1w0p s GLU 433 Ca -0.01 1.76 0.15 0.00 0.02 0.00 0.00 54.97 56.88 1w0p s GLU 433 Cb 0.01 -3.86 1.05 0.00 0.10 0.00 0.00 34.13 31.43 1w0p s GLU 433 CO 0.09 -0.84 1.69 0.45 0.02 0.00 0.00 175.26 176.68 1w0p h HIS 434 N 8.88 0.89 -0.49 1.61 3.86 -1.94 -0.12 115.15 127.85 1w0p h HIS 434 Ca -0.30 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 58.91 1w0p h HIS 434 Cb 1.13 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 29.33 1w0p h HIS 434 CO 0.84 -0.07 0.20 0.00 0.86 0.00 0.00 177.93 179.75 1w0p h ALA 435 N 1.77 0.64 -0.04 2.45 0.00 -1.95 -2.79 119.26 119.34 1w0p h ALA 435 Ca 0.70 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 55.31 1w0p h ALA 435 Cb 1.58 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1w0p h ALA 435 CO -0.51 0.25 -0.64 0.87 0.00 0.00 0.00 179.25 179.21 1w0p h LYS 436 N 0.65 0.15 -0.95 0.00 1.57 -1.50 -3.18 116.57 113.32 1w0p h LYS 436 Ca 0.16 -0.11 0.10 0.00 -1.87 0.00 0.00 60.65 58.93 1w0p h LYS 436 Cb 0.20 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.46 1w0p h LYS 436 CO -0.01 0.74 0.61 0.28 -0.57 0.00 0.00 179.45 180.50 1w0p h VAL 437 N 0.11 0.98 -0.39 0.50 2.07 -0.82 -2.82 116.25 115.88 1w0p h VAL 437 Ca -0.01 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1w0p h VAL 437 Cb 1.16 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1w0p h VAL 437 CO 0.09 0.18 0.00 1.41 0.02 0.00 0.00 177.57 179.27 1w0p n HIS 438 N -4.54 1.35 -2.95 1.57 8.25 -1.16 -4.61 115.22 113.13 1w0p n HIS 438 Ca 0.16 -0.80 -0.18 0.00 -0.26 0.00 0.00 57.72 56.64 1w0p n HIS 438 Cb 0.29 -0.37 0.02 0.00 1.12 0.00 0.00 29.99 31.05 1w0p n HIS 438 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1w0p s SER 439 N -1.45 5.59 0.34 0.41 1.04 -1.07 -4.64 113.70 113.92 1w0p s SER 439 Ca 0.46 -0.27 -0.27 0.00 0.48 0.00 0.00 55.95 56.35 1w0p s SER 439 Cb 0.36 -0.79 -0.09 0.00 0.10 0.00 0.00 66.02 65.60 1w0p s SER 439 CO 0.12 -0.83 1.08 -0.36 0.98 0.00 0.00 173.24 174.24 1w0p s PHE 440 N -2.45 3.42 0.02 5.02 0.08 -1.26 -4.50 117.98 118.31 1w0p s PHE 440 Ca 0.55 1.67 0.01 0.00 0.12 0.00 0.00 56.93 59.27 1w0p s PHE 440 Cb -0.10 -3.23 -0.02 0.00 -0.57 0.00 0.00 43.02 39.11 1w0p s PHE 440 CO 0.34 -0.63 -0.04 -1.01 -0.10 0.00 0.00 175.22 173.78 1w0p s HIS 441 N -1.38 0.34 -0.40 0.36 3.76 -0.58 -4.96 115.29 112.44 1w0p s HIS 441 Ca 0.51 -0.40 -0.18 0.00 -0.15 0.00 0.00 55.06 54.83 1w0p s HIS 441 Cb -0.28 -0.22 0.01 0.00 1.11 0.00 0.00 32.58 33.20 1w0p s HIS 441 CO 0.35 -0.12 0.50 -0.51 -0.85 0.00 0.00 174.74 174.12 1w0p s ASP 442 N -1.15 6.26 -0.38 1.40 1.01 -1.26 -1.37 116.67 121.17 1w0p s ASP 442 Ca -0.10 -0.37 -0.17 0.00 0.71 0.00 0.00 52.55 52.62 1w0p s ASP 442 Cb -0.08 -2.26 0.01 0.00 1.01 0.00 0.00 42.92 41.60 1w0p s ASP 442 CO -0.00 -0.58 0.43 -0.31 0.21 0.00 0.00 175.17 174.91 1w0p s TYR 443 N 2.36 3.18 -0.14 4.23 1.51 0.27 -1.25 117.35 127.52 1w0p s TYR 443 Ca 0.16 -0.17 -0.00 0.00 -1.01 0.00 0.00 57.07 56.05 1w0p s TYR 443 Cb -0.16 -2.83 -0.01 0.00 -0.11 0.00 0.00 41.96 38.85 1w0p s TYR 443 CO 0.15 -0.59 -0.12 -2.00 -1.11 0.00 0.00 175.55 171.87 1w0p s GLU 444 N 2.15 3.37 -0.20 -0.62 2.12 0.23 -0.88 118.70 124.87 1w0p s GLU 444 Ca 0.13 -0.68 -0.04 0.00 0.36 0.00 0.00 54.97 54.74 1w0p s GLU 444 Cb -0.17 -2.67 -0.02 0.00 0.26 0.00 0.00 34.13 31.54 1w0p s GLU 444 CO 0.13 0.15 -0.04 -0.51 -0.54 0.00 0.00 175.26 174.46 1w0p s LEU 445 N 0.50 3.04 -0.29 2.70 1.43 0.17 -0.11 118.68 126.14 1w0p s LEU 445 Ca -0.09 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 52.73 1w0p s LEU 445 Cb -0.16 -1.76 0.06 0.00 0.03 0.00 0.00 46.19 44.36 1w0p s LEU 445 CO 0.04 0.05 -0.04 -1.10 0.23 0.00 0.00 176.35 175.53 1w0p s GLN 446 N 1.07 2.26 -0.09 1.70 -0.21 -0.20 -1.15 119.66 123.04 1w0p s GLN 446 Ca 0.01 -1.37 -0.19 0.00 0.02 0.00 0.00 55.36 53.83 1w0p s GLN 446 Cb -0.15 -3.05 -0.04 0.00 1.00 0.00 0.00 33.01 30.77 1w0p s GLN 446 CO 0.00 -0.63 0.54 -0.47 -2.12 0.00 0.00 175.29 172.61 1w0p s TYR 447 N 1.15 3.56 -0.29 0.91 5.04 -0.14 -0.96 117.35 126.62 1w0p s TYR 447 Ca -0.06 1.01 -0.07 0.00 -2.44 0.00 0.00 57.07 55.52 1w0p s TYR 447 Cb -0.20 -2.60 0.01 0.00 0.35 0.00 0.00 41.96 39.52 1w0p s TYR 447 CO -0.04 0.19 0.07 0.45 -1.34 0.00 0.00 175.55 174.89 1w0p s SER 448 N 0.48 5.07 0.24 4.32 0.15 0.09 -2.87 113.70 121.19 1w0p s SER 448 Ca 0.29 -0.65 -0.02 0.00 0.70 0.00 0.00 55.95 56.26 1w0p s SER 448 Cb -0.16 -1.87 0.27 0.00 -1.71 0.00 0.00 66.02 62.55 1w0p s SER 448 CO 0.13 -0.17 1.69 0.00 1.20 0.00 0.00 173.24 176.09 1w0p h ALA 449 N 8.22 0.99 -0.28 5.45 0.00 -1.86 0.72 119.26 132.52 1w0p h ALA 449 Ca -0.33 -0.33 -0.15 0.00 0.00 0.00 0.00 54.91 54.11 1w0p h ALA 449 Cb 1.13 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1w0p h ALA 449 CO 0.60 0.60 -0.44 -0.07 0.00 0.00 0.00 179.25 179.94 1w0p h LEU 450 N 0.66 0.75 -0.38 0.00 3.38 -1.94 -3.11 115.31 114.68 1w0p h LEU 450 Ca 0.11 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1w0p h LEU 450 Cb 0.62 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1w0p h LEU 450 CO 0.04 1.08 -0.41 0.59 0.09 0.00 0.00 178.44 179.83 1w0p n ASN 451 N -4.02 1.00 -3.84 -0.43 3.02 -1.17 -4.96 115.26 104.85 1w0p n ASN 451 Ca -0.02 -0.80 -0.26 0.00 -0.03 0.00 0.00 54.58 53.47 1w0p n ASN 451 Cb 0.55 0.28 0.02 0.00 -0.61 0.00 0.00 39.78 40.02 1w0p n ASN 451 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1w0p n HIS 452 N -0.88 -2.07 -3.71 3.10 8.25 0.23 -4.97 115.22 115.17 1w0p n HIS 452 Ca 0.09 0.86 -0.10 0.00 -0.26 0.00 0.00 57.72 58.32 1w0p n HIS 452 Cb 0.36 -4.10 -0.06 0.00 1.12 0.00 0.00 29.99 27.31 1w0p n HIS 452 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1w0p s THR 453 N -3.51 0.09 -0.07 1.59 -1.32 -1.10 -4.81 115.64 106.51 1w0p s THR 453 Ca 0.33 -0.77 0.05 0.00 -1.21 0.00 0.00 61.69 60.09 1w0p s THR 453 Cb -0.17 -1.20 -0.01 0.00 -1.51 0.00 0.00 72.50 69.61 1w0p s THR 453 CO 0.83 -0.43 -0.24 -0.89 -2.21 0.00 0.00 174.62 171.69 1w0p s THR 454 N -3.71 2.15 -0.12 5.08 2.01 -0.66 -0.73 115.64 119.65 1w0p s THR 454 Ca 0.03 -1.02 -0.03 0.00 0.31 0.00 0.00 61.69 60.97 1w0p s THR 454 Cb 0.03 -1.79 -0.03 0.00 0.01 0.00 0.00 72.50 70.71 1w0p s THR 454 CO -0.11 0.57 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.49 1w0p s THR 455 N -0.05 4.18 -0.20 -0.82 2.01 -0.13 -1.13 115.64 119.49 1w0p s THR 455 Ca -0.07 -0.28 -0.12 0.00 0.31 0.00 0.00 61.69 61.54 1w0p s THR 455 Cb -0.15 -2.80 -0.05 0.00 0.01 0.00 0.00 72.50 69.52 1w0p s THR 455 CO 0.05 0.55 0.20 -0.22 -0.69 0.00 0.00 174.62 174.51 1w0p s LEU 456 N -0.27 4.19 -0.00 4.42 2.96 0.42 -1.04 118.68 129.35 1w0p s LEU 456 Ca 0.06 0.29 0.07 0.00 -0.22 0.00 0.00 54.13 54.33 1w0p s LEU 456 Cb -0.12 -2.20 -0.02 0.00 0.50 0.00 0.00 46.19 44.34 1w0p s LEU 456 CO 0.02 0.10 -0.23 -0.36 -1.32 0.00 0.00 176.35 174.57 1w0p s PHE 457 N 0.68 2.43 -0.16 5.38 0.40 0.84 -0.83 117.98 126.71 1w0p s PHE 457 Ca 0.11 -0.35 -0.00 0.00 -0.60 0.00 0.00 56.93 56.08 1w0p s PHE 457 Cb -0.13 -1.50 0.04 0.00 0.51 0.00 0.00 43.02 41.95 1w0p s PHE 457 CO 0.02 0.08 -0.06 0.08 0.70 0.00 0.00 175.22 176.04 1w0p s VAL 458 N -0.72 1.17 -1.51 -0.44 1.01 -0.09 -0.60 120.40 119.23 1w0p s VAL 458 Ca 0.11 -0.63 -0.06 0.00 0.00 0.00 0.00 61.98 61.40 1w0p s VAL 458 Cb -0.10 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 34.98 1w0p s VAL 458 CO 0.01 0.17 0.63 0.47 0.00 0.00 0.00 175.10 176.37 1w0p n ASP 459 N 4.86 -5.76 0.00 3.32 8.00 -0.38 -1.65 116.55 124.94 1w0p n ASP 459 Ca -0.12 -0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.05 1w0p n ASP 459 Cb 0.48 -4.66 0.00 0.00 -0.02 0.00 0.00 41.12 36.92 1w0p n ASP 459 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1w0p n GLY 460 N -1.50 1.34 3.73 0.44 0.00 -1.26 -5.03 105.19 102.91 1w0p n GLY 460 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 1w0p n GLY 460 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1w0p s GLN 461 N -0.28 4.19 0.00 1.61 -1.52 -0.66 -5.06 119.66 117.95 1w0p s GLN 461 Ca 0.00 -0.20 -0.30 0.00 -1.95 0.00 0.00 55.36 52.91 1w0p s GLN 461 Cb 0.00 -3.42 -0.06 0.00 -0.22 0.00 0.00 33.01 29.31 1w0p s GLN 461 CO 0.00 0.30 1.43 -1.14 -0.25 0.00 0.00 175.29 175.63 1w0p s GLN 462 N 0.35 4.27 -0.15 2.91 0.74 -1.26 -0.91 119.66 125.61 1w0p s GLN 462 Ca 0.09 2.01 -0.11 0.00 0.05 0.00 0.00 55.36 57.39 1w0p s GLN 462 Cb -0.11 -3.59 -0.06 0.00 1.10 0.00 0.00 33.01 30.35 1w0p s GLN 462 CO -0.02 -0.60 -0.25 -0.89 -0.55 0.00 0.00 175.29 172.99 1w0p n ILE 463 N 4.70 1.22 -3.71 -2.34 2.08 -0.01 -4.95 119.36 116.34 1w0p n ILE 463 Ca 0.14 -0.05 -0.07 0.00 0.56 0.00 0.00 62.75 63.33 1w0p n ILE 463 Cb 0.43 -1.92 -0.02 0.00 -0.75 0.00 0.00 39.64 37.38 1w0p n ILE 463 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1w0p s THR 464 N -2.48 0.00 -0.02 1.39 -1.32 -1.22 -5.01 115.64 106.98 1w0p s THR 464 Ca -0.24 -0.61 0.04 0.00 -1.21 0.00 0.00 61.69 59.67 1w0p s THR 464 Cb 0.07 -1.71 -0.01 0.00 -1.51 0.00 0.00 72.50 69.35 1w0p s THR 464 CO 0.32 0.00 -0.12 -0.89 -2.21 0.00 0.00 174.62 171.72 1w0p s THR 465 N -3.62 0.98 0.19 5.08 2.01 -1.26 -0.44 115.64 118.59 1w0p s THR 465 Ca 0.09 -0.51 -0.13 0.00 0.31 0.00 0.00 61.69 61.45 1w0p s THR 465 Cb -0.03 -0.83 0.00 0.00 0.01 0.00 0.00 72.50 71.65 1w0p s THR 465 CO 0.00 0.28 0.41 -1.66 -0.69 0.00 0.00 174.62 172.96 1w0p s TRP 466 N -0.14 0.22 -1.45 4.92 -2.14 -0.29 -4.97 118.94 115.09 1w0p s TRP 466 Ca 0.02 -0.57 0.24 0.00 2.66 0.00 0.00 56.10 58.45 1w0p s TRP 466 Cb -0.06 0.15 0.39 0.00 -3.10 0.00 0.00 33.47 30.84 1w0p s TRP 466 CO -0.00 -0.84 1.33 0.00 -2.66 0.00 0.00 176.95 174.78 1w0p n ALA 467 N -0.29 3.58 -0.60 2.67 0.00 -1.26 -1.65 120.51 122.96 1w0p n ALA 467 Ca -0.07 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.91 1w0p n ALA 467 Cb 0.63 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1w0p n ALA 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w0p n GLY 468 N 1.43 0.27 3.04 0.00 0.00 -1.26 -4.85 105.19 103.82 1w0p n GLY 468 Ca 0.08 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 45.10 1w0p n GLY 468 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w0p s GLU 469 N 0.00 0.47 0.30 1.61 2.02 -0.60 -4.80 118.70 117.69 1w0p s GLU 469 Ca 0.00 -0.72 -0.30 0.00 0.02 0.00 0.00 54.97 53.97 1w0p s GLU 469 Cb 0.00 -0.17 -0.12 0.00 0.10 0.00 0.00 34.13 33.93 1w0p s GLU 469 CO 0.00 0.02 1.41 0.28 0.02 0.00 0.00 175.26 176.99 1w0p n VAL 470 N 1.48 1.41 -3.59 2.63 0.31 -1.26 -0.45 118.33 118.86 1w0p n VAL 470 Ca -0.23 -0.35 -0.12 0.00 -0.01 0.00 0.00 64.34 63.63 1w0p n VAL 470 Cb 0.55 -1.65 -0.06 0.00 -0.91 0.00 0.00 33.84 31.77 1w0p n VAL 470 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1w0p s SER 471 N 0.10 -0.48 0.00 4.52 0.15 -0.94 -4.71 113.70 112.34 1w0p s SER 471 Ca 0.62 0.69 0.21 0.00 0.70 0.00 0.00 55.95 58.17 1w0p s SER 471 Cb -0.57 0.62 0.33 0.00 -1.71 0.00 0.00 66.02 64.69 1w0p s SER 471 CO 0.55 -0.32 1.31 0.00 1.20 0.00 0.00 173.24 175.97 1w0p n GLN 472 N 1.38 2.30 -2.51 5.44 1.13 -1.26 -2.56 117.38 121.29 1w0p n GLN 472 Ca -0.13 -2.09 -0.34 0.00 -1.94 0.00 0.00 57.00 52.50 1w0p n GLN 472 Cb 0.57 -1.46 -0.03 0.00 0.11 0.00 0.00 30.24 29.43 1w0p n GLN 472 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1w0p s GLU 473 N -1.50 3.81 -0.29 -1.09 2.02 -1.26 -4.55 118.70 115.83 1w0p s GLU 473 Ca 0.33 1.29 -0.03 0.00 0.02 0.00 0.00 54.97 56.58 1w0p s GLU 473 Cb 0.20 -2.10 0.10 0.00 0.10 0.00 0.00 34.13 32.43 1w0p s GLU 473 CO 0.29 -0.42 0.13 1.21 0.02 0.00 0.00 175.26 176.49 1w0p s ASN 474 N -2.15 3.60 0.08 -0.19 3.04 -1.26 -0.08 114.94 117.98 1w0p s ASN 474 Ca 0.66 -1.35 -0.26 0.00 0.04 0.00 0.00 52.86 51.94 1w0p s ASN 474 Cb -0.15 -0.43 0.09 0.00 -1.54 0.00 0.00 41.25 39.22 1w0p s ASN 474 CO 0.22 -0.43 1.16 0.54 -3.04 0.00 0.00 177.10 175.55 1w0p s ASN 475 N 2.01 -0.02 -0.02 -4.21 6.03 -0.22 -1.12 114.94 117.40 1w0p s ASN 475 Ca 0.09 -0.40 0.04 0.00 -1.03 0.00 0.00 52.86 51.56 1w0p s ASN 475 Cb -0.16 0.31 -0.01 0.00 -3.03 0.00 0.00 41.25 38.36 1w0p s ASN 475 CO -0.35 -0.62 -0.13 -0.51 -2.03 0.00 0.00 177.10 173.46 1w0p s ILE 476 N -2.23 1.08 -0.01 0.54 2.07 -0.92 -0.36 121.20 121.37 1w0p s ILE 476 Ca 0.23 -0.56 -0.10 0.00 -1.41 0.00 0.00 60.65 58.81 1w0p s ILE 476 Cb -0.01 -0.92 0.01 0.00 0.13 0.00 0.00 42.46 41.68 1w0p s ILE 476 CO 0.01 0.31 0.21 -1.58 -1.91 0.00 0.00 174.94 171.99 1w0p s GLN 477 N -0.13 0.53 0.12 3.50 0.74 -0.36 -1.49 119.66 122.57 1w0p s GLN 477 Ca 0.02 -0.25 -0.14 0.00 0.05 0.00 0.00 55.36 55.03 1w0p s GLN 477 Cb -0.07 0.23 0.03 0.00 1.10 0.00 0.00 33.01 34.29 1w0p s GLN 477 CO 0.00 -0.13 0.35 -0.59 -0.55 0.00 0.00 175.29 174.37 1w0p s PHE 478 N -1.22 -0.11 -4.15 1.67 -0.12 -0.76 -0.33 117.98 112.96 1w0p s PHE 478 Ca -0.13 -0.24 0.00 0.00 -0.05 0.00 0.00 56.93 56.51 1w0p s PHE 478 Cb -0.06 0.18 0.00 0.00 -0.63 0.00 0.00 43.02 42.51 1w0p s PHE 478 CO 0.02 -0.66 0.00 0.41 -0.05 0.00 0.00 175.22 174.94 1w0p n GLY 479 N -0.19 0.89 3.57 1.99 0.00 -0.81 -1.05 105.19 109.59 1w0p n GLY 479 Ca -0.16 -1.96 -0.37 0.00 0.00 0.00 0.00 46.02 43.54 1w0p n GLY 479 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1w0p s ASN 480 N -4.00 5.67 0.00 1.61 2.47 -0.54 -1.11 114.94 119.04 1w0p s ASN 480 Ca 0.00 -0.03 0.24 0.00 0.42 0.00 0.00 52.86 53.49 1w0p s ASN 480 Cb 0.00 -2.02 0.44 0.00 -1.45 0.00 0.00 41.25 38.22 1w0p s ASN 480 CO 0.00 0.02 1.40 0.00 -3.72 0.00 0.00 177.10 174.80 1w0p n ALA 481 N 4.56 2.47 -3.74 1.71 0.00 0.03 -0.95 120.51 124.59 1w0p n ALA 481 Ca -0.15 -0.75 -0.22 0.00 0.00 0.00 0.00 53.44 52.31 1w0p n ALA 481 Cb 0.52 -0.91 -0.17 0.00 0.00 0.00 0.00 19.45 18.89 1w0p n ALA 481 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1w0p s ASP 482 N -1.77 1.40 0.39 0.00 -1.08 -1.26 -4.95 116.67 109.40 1w0p s ASP 482 Ca 0.34 -0.08 0.28 0.00 -0.52 0.00 0.00 52.55 52.57 1w0p s ASP 482 Cb 0.21 -0.41 1.20 0.00 -1.46 0.00 0.00 42.92 42.46 1w0p s ASP 482 CO 0.31 -0.17 1.84 0.00 0.52 0.00 0.00 175.17 177.67 1w0p h ALA 483 N 8.11 1.00 -0.02 3.66 0.00 -1.91 -2.45 119.26 127.66 1w0p h ALA 483 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1w0p h ALA 483 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1w0p h ALA 483 CO 0.30 0.00 -0.30 1.04 0.00 0.00 0.00 179.25 180.29 1w0p n GLN 484 N -2.62 1.30 -3.94 0.00 6.02 -1.26 -3.65 117.38 113.24 1w0p n GLN 484 Ca 0.01 -0.97 -0.30 0.00 -0.01 0.00 0.00 57.00 55.73 1w0p n GLN 484 Cb 0.25 -1.48 -0.16 0.00 1.02 0.00 0.00 30.24 29.87 1w0p n GLN 484 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1w0p s ILE 485 N -2.37 1.49 0.39 5.09 1.01 -0.92 -5.09 121.20 120.80 1w0p s ILE 485 Ca 0.24 -1.15 -0.26 0.00 0.00 0.00 0.00 60.65 59.47 1w0p s ILE 485 Cb 0.19 -1.74 -0.09 0.00 0.01 0.00 0.00 42.46 40.83 1w0p s ILE 485 CO 0.49 -0.07 1.26 -1.81 0.00 0.00 0.00 174.94 174.81 1w0p s ASP 486 N 1.42 6.43 -0.22 3.58 1.01 -1.26 -4.59 116.67 123.05 1w0p s ASP 486 Ca -0.05 2.56 -0.29 0.00 0.71 0.00 0.00 52.55 55.48 1w0p s ASP 486 Cb -0.18 -2.63 0.15 0.00 1.01 0.00 0.00 42.92 41.27 1w0p s ASP 486 CO -0.06 -0.76 1.15 -0.83 0.21 0.00 0.00 175.17 174.88 1w0p s GLY 487 N -0.83 -0.11 -0.04 0.21 0.00 -1.00 -1.25 107.32 104.30 1w0p s GLY 487 Ca 0.56 2.41 0.00 0.00 0.00 0.00 0.00 44.72 47.70 1w0p s GLY 487 CO 0.46 1.14 -0.02 -1.60 0.00 0.00 0.00 173.10 173.08 1w0p s ARG 488 N -0.96 0.55 0.04 2.90 3.52 -0.63 -0.35 118.95 124.02 1w0p s ARG 488 Ca 0.03 0.01 0.03 0.00 -0.13 0.00 0.00 55.73 55.67 1w0p s ARG 488 Cb -0.01 -0.68 -0.02 0.00 -1.56 0.00 0.00 34.95 32.68 1w0p s ARG 488 CO -0.03 -0.13 -0.10 -0.48 -0.81 0.00 0.00 175.30 173.75 1w0p s LEU 489 N 1.10 2.19 -0.02 -0.88 2.34 -0.83 -1.01 118.68 121.56 1w0p s LEU 489 Ca -0.08 -0.45 0.06 0.00 0.06 0.00 0.00 54.13 53.72 1w0p s LEU 489 Cb -0.14 -0.36 -0.02 0.00 -0.56 0.00 0.00 46.19 45.11 1w0p s LEU 489 CO -0.01 -0.07 -0.20 -1.00 -1.06 0.00 0.00 176.35 174.01 1w0p s HIS 490 N -0.98 2.52 -0.03 3.48 3.76 -0.06 -1.57 115.29 122.40 1w0p s HIS 490 Ca -0.03 -0.29 0.05 0.00 -0.15 0.00 0.00 55.06 54.63 1w0p s HIS 490 Cb -0.08 -1.55 -0.01 0.00 1.11 0.00 0.00 32.58 32.05 1w0p s HIS 490 CO 0.01 0.10 -0.18 0.08 -0.85 0.00 0.00 174.74 173.90 1w0p s VAL 491 N -0.70 1.45 -0.08 -0.90 1.01 0.26 -0.99 120.40 120.45 1w0p s VAL 491 Ca 0.11 -0.76 0.10 0.00 0.00 0.00 0.00 61.98 61.43 1w0p s VAL 491 Cb -0.10 -1.23 -0.15 0.00 0.00 0.00 0.00 36.38 34.90 1w0p s VAL 491 CO 0.00 0.41 0.11 0.00 0.00 0.00 0.00 175.10 175.63 1w0p n GLN 492 N 2.85 1.61 -3.61 2.72 6.02 -0.54 -0.88 117.38 125.55 1w0p n GLN 492 Ca -0.16 -0.04 -0.13 0.00 -0.01 0.00 0.00 57.00 56.66 1w0p n GLN 492 Cb 0.53 -1.28 -0.07 0.00 1.02 0.00 0.00 30.24 30.45 1w0p n GLN 492 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1w0p s LYS 493 N -2.44 0.75 -0.03 -1.09 2.20 -1.25 -1.27 119.74 116.60 1w0p s LYS 493 Ca -0.05 0.71 -0.01 0.00 -0.36 0.00 0.00 55.97 56.27 1w0p s LYS 493 Cb 0.05 0.36 0.03 0.00 -1.51 0.00 0.00 37.83 36.76 1w0p s LYS 493 CO 0.46 -0.13 0.03 0.42 -0.36 0.00 0.00 175.35 175.77 1w0p s ILE 494 N 0.00 0.04 0.02 5.43 1.01 -0.17 -1.08 121.20 126.45 1w0p s ILE 494 Ca -0.01 0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.89 1w0p s ILE 494 Cb -0.04 -0.21 -0.01 0.00 0.01 0.00 0.00 42.46 42.21 1w0p s ILE 494 CO 0.00 0.15 -0.03 -0.69 0.00 0.00 0.00 174.94 174.38 1w0p s VAL 495 N 1.51 0.14 -0.04 2.92 1.01 -0.09 -0.57 120.40 125.27 1w0p s VAL 495 Ca -0.03 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1w0p s VAL 495 Cb -0.13 -0.23 0.02 0.00 0.00 0.00 0.00 36.38 36.05 1w0p s VAL 495 CO -0.03 -0.33 -0.02 -0.22 0.00 0.00 0.00 175.10 174.50 1w0p s LEU 496 N -1.03 1.17 0.05 3.92 2.96 -0.61 -1.05 118.68 124.08 1w0p s LEU 496 Ca -0.10 -0.08 0.02 0.00 -0.22 0.00 0.00 54.13 53.74 1w0p s LEU 496 Cb -0.07 -0.35 -0.03 0.00 0.50 0.00 0.00 46.19 46.24 1w0p s LEU 496 CO -0.01 -0.09 -0.07 0.28 -1.32 0.00 0.00 176.35 175.15 1w0p s THR 497 N 1.09 0.47 -0.18 3.68 -1.32 0.20 -0.23 115.64 119.34 1w0p s THR 497 Ca -0.09 -1.19 -0.10 0.00 -1.21 0.00 0.00 61.69 59.11 1w0p s THR 497 Cb -0.14 -0.72 0.07 0.00 -1.51 0.00 0.00 72.50 70.20 1w0p s THR 497 CO -0.01 -0.49 0.44 -1.58 -2.21 0.00 0.00 174.62 170.77 1w0p s GLN 498 N -1.93 0.41 -1.36 7.08 0.74 -0.56 -1.19 119.66 122.86 1w0p s GLN 498 Ca -0.08 0.86 -0.04 0.00 0.05 0.00 0.00 55.36 56.16 1w0p s GLN 498 Cb -0.07 0.04 0.02 0.00 1.10 0.00 0.00 33.01 34.10 1w0p s GLN 498 CO -0.01 -0.17 0.78 1.04 -0.55 0.00 0.00 175.29 176.39 1w0p n GLN 499 N 4.42 -5.17 -1.59 1.67 6.02 -1.26 -2.19 117.38 119.27 1w0p n GLN 499 Ca -0.21 0.62 -0.13 0.00 -0.01 0.00 0.00 57.00 57.28 1w0p n GLN 499 Cb 0.55 -5.28 -0.04 0.00 1.02 0.00 0.00 30.24 26.49 1w0p n GLN 499 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1w0p n GLY 500 N -1.61 0.96 2.93 1.08 0.00 -1.26 -5.01 105.19 102.28 1w0p n GLY 500 Ca -0.21 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.18 1w0p n GLY 500 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1w0p s HIS 501 N -2.51 0.93 -0.42 1.61 5.04 -0.93 -5.10 115.29 113.91 1w0p s HIS 501 Ca 0.00 -0.29 -0.29 0.00 -1.54 0.00 0.00 55.06 52.94 1w0p s HIS 501 Cb 0.00 -0.76 0.02 0.00 0.04 0.00 0.00 32.58 31.88 1w0p s HIS 501 CO 0.00 -0.21 1.14 -0.80 -2.34 0.00 0.00 174.74 172.53 1w0p s ASN 502 N 0.81 6.71 0.07 9.88 0.02 -1.26 -1.49 114.94 129.68 1w0p s ASN 502 Ca -0.13 0.69 -0.12 0.00 -1.02 0.00 0.00 52.86 52.29 1w0p s ASN 502 Cb -0.15 -2.55 -0.27 0.00 0.02 0.00 0.00 41.25 38.31 1w0p s ASN 502 CO 0.01 -1.14 1.13 -0.07 0.02 0.00 0.00 177.10 177.05 1w0p h LEU 503 N 10.90 0.76 -7.74 0.60 3.38 -0.97 -3.46 115.31 118.78 1w0p h LEU 503 Ca -0.22 -0.72 -0.20 0.00 0.09 0.00 0.00 57.88 56.83 1w0p h LEU 503 Cb 1.06 -0.24 -0.26 0.00 0.09 0.00 0.00 40.66 41.32 1w0p h LEU 503 CO 1.09 1.53 -0.64 0.68 0.09 0.00 0.00 178.44 181.19 1w0p s VAL 504 N -2.93 0.03 -0.18 1.22 -7.23 -1.13 -4.99 120.40 105.18 1w0p s VAL 504 Ca -0.08 -0.24 -0.06 0.00 -1.81 0.00 0.00 61.98 59.78 1w0p s VAL 504 Cb 0.06 -0.16 0.09 0.00 0.56 0.00 0.00 36.38 36.93 1w0p s VAL 504 CO 0.92 -0.13 0.38 -0.70 -0.31 0.00 0.00 175.10 175.26 1w0p s GLU 505 N -0.40 0.28 -0.27 4.82 2.12 -1.26 -1.58 118.70 122.42 1w0p s GLU 505 Ca -0.05 0.95 -0.00 0.00 0.36 0.00 0.00 54.97 56.23 1w0p s GLU 505 Cb -0.03 0.22 0.08 0.00 0.26 0.00 0.00 34.13 34.66 1w0p s GLU 505 CO 0.00 -0.27 0.03 0.12 -0.54 0.00 0.00 175.26 174.60 1w0p s PHE 506 N 2.57 2.06 -0.94 5.30 5.36 0.27 -5.01 117.98 127.59 1w0p s PHE 506 Ca -0.00 -1.74 -0.10 0.00 -0.96 0.00 0.00 56.93 54.12 1w0p s PHE 506 Cb -0.12 -1.70 0.24 0.00 -0.34 0.00 0.00 43.02 41.10 1w0p s PHE 506 CO -0.12 -0.81 0.89 0.34 -1.46 0.00 0.00 175.22 174.07 1w0p s ASP 507 N 1.50 6.85 0.36 6.13 -1.08 -1.26 -1.00 116.67 128.16 1w0p s ASP 507 Ca 0.03 -3.15 0.09 0.00 -0.52 0.00 0.00 52.55 49.00 1w0p s ASP 507 Cb -0.18 -2.17 0.69 0.00 -1.46 0.00 0.00 42.92 39.80 1w0p s ASP 507 CO -0.14 -0.41 1.84 0.00 0.52 0.00 0.00 175.17 176.98 1w0p h ALA 508 N 7.14 1.38 -0.57 3.66 0.00 -1.46 -1.32 119.26 128.10 1w0p h ALA 508 Ca 0.13 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.79 1w0p h ALA 508 Cb 0.95 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 1w0p h ALA 508 CO 0.86 0.43 0.33 0.35 0.00 0.00 0.00 179.25 181.23 1w0p h PHE 509 N 0.18 0.62 -0.01 0.00 3.57 -1.42 -0.61 116.94 119.26 1w0p h PHE 509 Ca 0.03 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 1w0p h PHE 509 Cb 0.54 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.08 1w0p h PHE 509 CO 0.01 0.35 -0.02 -0.92 -2.23 0.00 0.00 178.31 175.50 1w0p h TYR 510 N 0.66 0.04 -0.91 0.41 3.20 -1.74 -3.32 116.97 115.30 1w0p h TYR 510 Ca 0.23 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.11 1w0p h TYR 510 Cb 0.04 -0.01 -0.05 0.00 1.54 0.00 0.00 36.73 38.26 1w0p h TYR 510 CO -0.06 0.57 0.60 -0.07 -1.64 0.00 0.00 178.16 177.56 1w0p h LEU 511 N -0.51 1.01 -1.85 2.82 3.38 -1.11 -2.56 115.31 116.50 1w0p h LEU 511 Ca 0.00 -0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.04 1w0p h LEU 511 Cb 0.57 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1w0p h LEU 511 CO 0.00 0.71 0.28 0.00 0.09 0.00 0.00 178.44 179.53 1w0p h ALA 512 N 1.45 2.14 -0.02 1.53 0.00 -1.20 -1.92 119.26 121.24 1w0p h ALA 512 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1w0p h ALA 512 Cb -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1w0p h ALA 512 CO -0.09 -0.24 0.00 0.94 0.00 0.00 0.00 179.25 179.86 1w0p n GLN 513 N -4.46 1.80 -2.85 0.00 7.27 -0.97 -4.12 117.38 114.05 1w0p n GLN 513 Ca 0.06 -1.16 -0.29 0.00 0.07 0.00 0.00 57.00 55.68 1w0p n GLN 513 Cb 0.35 -1.48 -0.02 0.00 2.41 0.00 0.00 30.24 31.50 1w0p n GLN 513 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 1w0p s GLN 514 N -2.00 3.70 0.88 3.69 -1.52 -0.72 -4.41 119.66 119.28 1w0p s GLN 514 Ca 0.36 0.35 -0.12 0.00 -1.95 0.00 0.00 55.36 54.00 1w0p s GLN 514 Cb 0.21 -2.41 0.12 0.00 -0.22 0.00 0.00 33.01 30.70 1w0p s GLN 514 CO 0.33 -0.05 1.11 0.95 -0.25 0.00 0.00 175.29 177.37 1w0p s THR 515 N -2.44 2.54 0.66 -0.19 -4.23 -1.26 -4.64 115.64 106.07 1w0p s THR 515 Ca 0.49 0.17 0.33 0.00 -1.18 0.00 0.00 61.69 61.51 1w0p s THR 515 Cb -0.10 -2.83 0.34 0.00 1.34 0.00 0.00 72.50 71.25 1w0p s THR 515 CO 0.35 -0.23 2.04 -0.65 -0.54 0.00 0.00 174.62 175.59 1w0p h PRO 516 N -1.42 0.00 -0.23 3.99 0.11 -1.98 -2.27 132.00 130.20 1w0p h PRO 516 Ca -0.50 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 1w0p h PRO 516 Cb 1.30 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 1w0p h PRO 516 CO 0.59 0.00 -0.09 1.05 -0.21 0.00 0.00 178.00 179.33 1w0p h GLU 517 N 0.00 0.37 -6.53 1.05 4.11 -2.04 -3.43 114.58 108.12 1w0p h GLU 517 Ca 0.02 -0.09 -0.53 0.00 0.07 0.00 0.00 59.36 58.83 1w0p h GLU 517 Cb 0.52 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1w0p h GLU 517 CO -0.00 0.48 0.43 0.08 0.07 0.00 0.00 179.01 180.07 1w0p s VAL 518 N -4.79 4.34 0.04 -1.06 1.01 -0.86 -4.99 120.40 114.10 1w0p s VAL 518 Ca -0.06 1.84 -0.31 0.00 0.00 0.00 0.00 61.98 63.45 1w0p s VAL 518 Cb 0.15 -4.18 -0.07 0.00 0.00 0.00 0.00 36.38 32.29 1w0p s VAL 518 CO 0.75 0.23 1.47 -0.70 0.00 0.00 0.00 175.10 176.85 1w0p s GLU 519 N 0.36 4.27 0.00 2.72 2.56 -1.26 -4.87 118.70 122.48 1w0p s GLU 519 Ca 0.51 2.09 0.00 0.00 0.00 0.00 0.00 54.97 57.57 1w0p s GLU 519 Cb -0.25 -3.51 0.00 0.00 2.00 0.00 0.00 34.13 32.37 1w0p s GLU 519 CO 0.31 -0.59 0.00 1.63 -0.56 0.00 0.00 175.26 176.04 1w0p n LYS 520 N 5.13 4.52 -2.05 4.30 5.02 -1.26 -5.03 118.16 128.79 1w0p n LYS 520 Ca 0.14 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 56.00 1w0p n LYS 520 Cb 0.42 -0.42 -0.03 0.00 -0.02 0.00 0.00 35.03 34.99 1w0p n LYS 520 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1w0p s ASP 521 N -0.80 6.35 0.35 4.39 3.68 -1.26 -4.88 116.67 124.50 1w0p s ASP 521 Ca 0.00 1.74 0.06 0.00 2.13 0.00 0.00 52.55 56.48 1w0p s ASP 521 Cb 0.00 -2.53 0.72 0.00 -1.45 0.00 0.00 42.92 39.66 1w0p s ASP 521 CO 0.00 -1.26 1.91 -0.07 0.13 0.00 0.00 175.17 175.88 1w0p h LEU 522 N 11.72 0.72 -0.79 -1.34 3.38 -1.95 0.07 115.31 127.11 1w0p h LEU 522 Ca -0.35 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1w0p h LEU 522 Cb 1.16 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1w0p h LEU 522 CO 0.99 0.43 0.00 -0.62 0.09 0.00 0.00 178.44 179.33 1w0p n GLU 523 N -4.51 0.19 -0.01 1.13 1.02 -1.26 -1.28 120.64 115.92 1w0p n GLU 523 Ca 0.14 0.45 0.10 0.00 -0.02 0.00 0.00 57.16 57.83 1w0p n GLU 523 Cb 0.31 -1.88 0.09 0.00 -0.02 0.00 0.00 31.44 29.94 1w0p n GLU 523 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1w0p n LYS 524 N -2.25 1.73 -0.43 3.49 5.02 -0.04 -4.28 118.16 121.40 1w0p n LYS 524 Ca 0.02 -1.68 0.09 0.00 -2.02 0.00 0.00 58.31 54.71 1w0p n LYS 524 Cb 0.21 -1.37 0.26 0.00 -0.02 0.00 0.00 35.03 34.10 1w0p n LYS 524 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1w0p n LEU 525 N 1.10 3.84 0.00 -0.35 4.77 -0.40 -4.95 117.00 121.00 1w0p n LEU 525 Ca 0.12 -3.02 0.00 0.00 -0.03 0.00 0.00 56.01 53.08 1w0p n LEU 525 Cb 0.49 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 1w0p n LEU 525 CO 0.12 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1w0p n GLY 526 N -0.53 0.63 3.88 -0.72 0.00 -1.20 -5.04 105.19 102.22 1w0p n GLY 526 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 1w0p n GLY 526 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1w0p s TRP 527 N -2.19 3.38 -0.16 1.61 0.52 -0.84 -4.69 118.94 116.57 1w0p s TRP 527 Ca 0.00 0.12 -0.04 0.00 0.02 0.00 0.00 56.10 56.19 1w0p s TRP 527 Cb 0.00 -1.65 -0.03 0.00 -1.15 0.00 0.00 33.47 30.64 1w0p s TRP 527 CO 0.00 0.54 -0.02 0.99 0.02 0.00 0.00 176.95 178.47 1w0p s THR 528 N -1.63 3.97 -0.18 2.01 2.01 0.51 -4.08 115.64 118.24 1w0p s THR 528 Ca 0.33 -0.33 -0.17 0.00 0.31 0.00 0.00 61.69 61.83 1w0p s THR 528 Cb -0.11 -2.75 -0.04 0.00 0.01 0.00 0.00 72.50 69.61 1w0p s THR 528 CO 0.26 0.48 0.47 -0.75 -0.69 0.00 0.00 174.62 174.39 1w0p s LYS 529 N 0.44 4.21 -0.30 4.92 2.20 -1.26 -1.09 119.74 128.87 1w0p s LYS 529 Ca -0.03 0.34 0.02 0.00 -0.36 0.00 0.00 55.97 55.95 1w0p s LYS 529 Cb -0.14 -3.53 0.07 0.00 -1.51 0.00 0.00 37.83 32.73 1w0p s LYS 529 CO 0.03 -0.05 -0.03 0.42 -0.36 0.00 0.00 175.35 175.36 1w0p s ILE 530 N 1.31 2.36 0.02 5.43 1.01 0.14 -4.99 121.20 126.49 1w0p s ILE 530 Ca 0.23 -1.84 0.05 0.00 0.00 0.00 0.00 60.65 59.09 1w0p s ILE 530 Cb -0.15 -2.50 -0.02 0.00 0.01 0.00 0.00 42.46 39.80 1w0p s ILE 530 CO 0.09 -0.24 -0.15 -0.75 0.00 0.00 0.00 174.94 173.89 1w0p s LYS 531 N 1.06 1.05 0.04 2.79 2.20 -1.26 -0.94 119.74 124.69 1w0p s LYS 531 Ca -0.02 -0.68 0.01 0.00 -0.36 0.00 0.00 55.97 54.91 1w0p s LYS 531 Cb -0.20 -1.05 -0.03 0.00 -1.51 0.00 0.00 37.83 35.04 1w0p s LYS 531 CO -0.05 0.27 -0.05 0.95 -0.36 0.00 0.00 175.35 176.11 1w0p s THR 532 N -0.66 0.33 0.00 3.43 -4.23 -0.55 -4.99 115.64 108.97 1w0p s THR 532 Ca 0.03 -1.33 0.00 0.00 -1.18 0.00 0.00 61.69 59.22 1w0p s THR 532 Cb -0.07 -0.87 0.00 0.00 1.34 0.00 0.00 72.50 72.90 1w0p s THR 532 CO 0.01 -0.65 0.00 0.61 -0.54 0.00 0.00 174.62 174.05 1w0p n GLY 533 N 0.95 0.76 3.40 3.99 0.00 -1.26 -1.02 105.19 112.00 1w0p n GLY 533 Ca -0.19 -0.72 -0.34 0.00 0.00 0.00 0.00 46.02 44.76 1w0p n GLY 533 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1w0p s ASN 534 N -4.00 4.47 0.26 1.61 0.01 -0.39 -4.87 114.94 112.03 1w0p s ASN 534 Ca 0.00 -0.28 -0.07 0.00 -0.71 0.00 0.00 52.86 51.81 1w0p s ASN 534 Cb 0.00 -1.74 -0.01 0.00 0.41 0.00 0.00 41.25 39.91 1w0p s ASN 534 CO 0.00 0.08 0.39 0.42 -1.51 0.00 0.00 177.10 176.48 1w0p s THR 535 N 0.88 0.00 -0.09 1.60 -4.23 -1.26 -2.10 115.64 110.44 1w0p s THR 535 Ca -0.01 -1.62 -0.13 0.00 -1.18 0.00 0.00 61.69 58.75 1w0p s THR 535 Cb -0.15 -2.40 0.03 0.00 1.34 0.00 0.00 72.50 71.33 1w0p s THR 535 CO 0.01 0.00 0.34 0.00 -0.54 0.00 0.00 174.62 174.43 1w0p s MET 536 N -3.79 0.51 0.04 3.99 0.23 -1.08 -5.03 119.30 114.17 1w0p s MET 536 Ca 0.29 0.26 -0.00 0.00 -1.03 0.00 0.00 55.69 55.21 1w0p s MET 536 Cb 0.01 0.24 -0.03 0.00 -1.53 0.00 0.00 34.83 33.52 1w0p s MET 536 CO 0.13 -0.10 -0.03 -1.54 -2.03 0.00 0.00 175.02 171.45 1w0p s SER 537 N -0.34 0.44 0.05 -1.18 1.04 -1.26 -0.55 113.70 111.90 1w0p s SER 537 Ca -0.05 -0.75 -0.28 0.00 0.48 0.00 0.00 55.95 55.35 1w0p s SER 537 Cb -0.03 0.14 0.09 0.00 0.10 0.00 0.00 66.02 66.32 1w0p s SER 537 CO 0.02 -0.44 1.00 -1.48 0.98 0.00 0.00 173.24 173.32 1w0p s LEU 538 N -2.20 -0.23 0.01 2.42 0.05 -0.33 -4.99 118.68 113.42 1w0p s LEU 538 Ca -0.04 -0.19 -0.12 0.00 0.05 0.00 0.00 54.13 53.83 1w0p s LEU 538 Cb -0.01 1.94 -0.05 0.00 -2.05 0.00 0.00 46.19 46.02 1w0p s LEU 538 CO -0.05 -0.67 0.37 -0.31 -0.55 0.00 0.00 176.35 175.14 1w0p s TYR 539 N -3.04 3.65 0.00 3.48 2.02 -1.26 0.55 117.35 122.76 1w0p s TYR 539 Ca 0.10 0.84 0.00 0.00 -0.37 0.00 0.00 57.07 57.64 1w0p s TYR 539 Cb -0.00 -2.18 0.00 0.00 -0.40 0.00 0.00 41.96 39.37 1w0p s TYR 539 CO -0.03 0.61 0.00 0.41 -1.57 0.00 0.00 175.55 174.97 1w0p n GLY 540 N 1.47 0.00 3.74 0.71 0.00 2.03 -4.67 105.19 108.47 1w0p n GLY 540 Ca -0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 1w0p n GLY 540 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1w0p s ASN 541 N -0.43 7.48 0.29 1.61 0.01 -0.90 -4.72 114.94 118.27 1w0p s ASN 541 Ca 0.00 1.76 0.03 0.00 -0.71 0.00 0.00 52.86 53.94 1w0p s ASN 541 Cb 0.00 -2.56 0.45 0.00 0.41 0.00 0.00 41.25 39.55 1w0p s ASN 541 CO 0.00 0.02 1.75 0.00 -1.51 0.00 0.00 177.10 177.37 1w0p h ALA 542 N 5.15 1.16 -2.04 0.60 0.00 0.37 -3.40 119.26 121.10 1w0p h ALA 542 Ca -0.44 -0.32 0.16 0.00 0.00 0.00 0.00 54.91 54.31 1w0p h ALA 542 Cb 1.21 -0.13 -0.16 0.00 0.00 0.00 0.00 17.79 18.71 1w0p h ALA 542 CO 0.70 0.53 0.59 -1.54 0.00 0.00 0.00 179.25 179.53 1w0p s SER 543 N -6.80 -0.29 0.03 0.00 1.04 -1.06 -4.20 113.70 102.42 1w0p s SER 543 Ca -0.07 -0.01 0.04 0.00 0.48 0.00 0.00 55.95 56.39 1w0p s SER 543 Cb 0.14 0.32 -0.02 0.00 0.10 0.00 0.00 66.02 66.56 1w0p s SER 543 CO 0.78 -0.51 -0.12 0.68 0.98 0.00 0.00 173.24 175.05 1w0p s VAL 544 N -2.92 0.95 -0.17 5.02 -7.23 -1.26 -1.50 120.40 113.30 1w0p s VAL 544 Ca 0.07 -0.93 -0.08 0.00 -1.81 0.00 0.00 61.98 59.22 1w0p s VAL 544 Cb -0.01 -0.88 0.06 0.00 0.56 0.00 0.00 36.38 36.12 1w0p s VAL 544 CO -0.07 -0.04 0.39 0.21 -0.31 0.00 0.00 175.10 175.27 1w0p s ASN 545 N -1.10 -0.38 0.59 4.85 2.47 -0.08 -4.66 114.94 116.63 1w0p s ASN 545 Ca -0.00 0.86 0.29 0.00 0.42 0.00 0.00 52.86 54.43 1w0p s ASN 545 Cb -0.08 0.85 1.73 0.00 -1.45 0.00 0.00 41.25 42.31 1w0p s ASN 545 CO 0.01 -0.20 2.17 -0.65 -3.72 0.00 0.00 177.10 174.71 1w0p h PRO 546 N 7.43 0.00 0.00 0.43 0.11 -1.86 0.46 132.00 138.57 1w0p h PRO 546 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1w0p h PRO 546 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1w0p h PRO 546 CO 0.26 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.46 1w0p n GLY 547 N -1.37 -1.17 3.67 -0.55 0.00 -1.26 -4.13 105.19 100.38 1w0p n GLY 547 Ca -0.01 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 1w0p n GLY 547 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1w0p s PRO 548 N -2.61 4.28 0.00 1.61 0.04 -1.26 -4.46 135.00 132.60 1w0p s PRO 548 Ca 0.00 0.83 0.00 0.00 0.04 0.00 0.00 61.00 61.87 1w0p s PRO 548 Cb 0.00 -3.56 0.00 0.00 0.04 0.00 0.00 34.50 30.98 1w0p s PRO 548 CO 0.00 -0.23 0.00 0.41 0.04 0.00 0.00 177.00 177.22 1w0p n GLY 549 N 3.54 0.84 3.70 0.56 0.00 -1.26 -4.72 105.19 107.87 1w0p n GLY 549 Ca 0.01 -2.00 -0.23 0.00 0.00 0.00 0.00 46.02 43.79 1w0p n GLY 549 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1w0p s HIS 550 N -2.04 2.67 0.28 1.61 -3.43 -1.26 -3.80 115.29 109.32 1w0p s HIS 550 Ca 0.00 -0.39 0.03 0.00 -0.80 0.00 0.00 55.06 53.90 1w0p s HIS 550 Cb 0.00 -1.57 0.03 0.00 -1.43 0.00 0.00 32.58 29.61 1w0p s HIS 550 CO 0.00 0.39 0.24 0.41 -2.00 0.00 0.00 174.74 173.79 1w0p n GLY 551 N -1.08 2.70 3.13 -1.38 0.00 0.50 -4.72 105.19 104.34 1w0p n GLY 551 Ca -0.04 -2.22 -0.09 0.00 0.00 0.00 0.00 46.02 43.68 1w0p n GLY 551 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1w0p s ILE 552 N -1.23 0.15 -0.20 -0.61 -4.36 -0.52 -4.62 121.20 109.80 1w0p s ILE 552 Ca 0.19 -1.85 -0.02 0.00 -0.26 0.00 0.00 60.65 58.71 1w0p s ILE 552 Cb -0.01 -1.81 -0.00 0.00 1.25 0.00 0.00 42.46 41.89 1w0p s ILE 552 CO 0.12 -0.69 -0.09 -0.89 0.24 0.00 0.00 174.94 173.63 1w0p s THR 553 N -3.99 3.04 0.32 8.37 2.01 -1.26 -1.44 115.64 122.69 1w0p s THR 553 Ca 0.16 -0.61 -0.28 0.00 0.31 0.00 0.00 61.69 61.27 1w0p s THR 553 Cb 0.08 -2.35 -0.09 0.00 0.01 0.00 0.00 72.50 70.14 1w0p s THR 553 CO -0.03 0.46 1.11 -0.76 -0.69 0.00 0.00 174.62 174.71 1w0p s LEU 554 N 1.28 4.41 0.00 4.42 1.43 -0.28 -4.88 118.68 125.06 1w0p s LEU 554 Ca 0.03 2.26 0.00 0.00 -1.03 0.00 0.00 54.13 55.39 1w0p s LEU 554 Cb -0.14 -3.79 0.00 0.00 0.03 0.00 0.00 46.19 42.28 1w0p s LEU 554 CO -0.04 -0.31 0.12 0.35 0.23 0.00 0.00 176.35 176.69 1w0p n THR 555 N 0.76 0.01 -2.38 5.49 -2.24 -1.26 0.02 114.28 114.68 1w0p n THR 555 Ca 0.01 -0.02 -0.16 0.00 -2.27 0.00 0.00 64.05 61.60 1w0p n THR 555 Cb 0.46 1.77 0.03 0.00 -2.10 0.00 0.00 70.33 70.49 1w0p n THR 555 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1w0p n ARG 556 N -0.00 2.84 -0.25 -0.78 1.74 -1.26 -4.81 116.66 114.13 1w0p n ARG 556 Ca 0.00 -3.95 0.12 0.00 -0.77 0.00 0.00 57.85 53.24 1w0p n ARG 556 Cb 0.29 -1.99 0.26 0.00 -1.02 0.00 0.00 32.46 29.99 1w0p n ARG 556 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1w0p n GLN 557 N -0.58 2.55 -0.27 5.56 1.13 -1.26 -3.60 117.38 120.91 1w0p n GLN 557 Ca 0.30 -2.37 0.24 0.00 -1.94 0.00 0.00 57.00 53.22 1w0p n GLN 557 Cb 0.86 -1.53 0.57 0.00 0.11 0.00 0.00 30.24 30.25 1w0p n GLN 557 CO 0.00 0.00 0.00 -0.56 -1.44 0.00 0.00 177.06 175.06 1w0p h GLN 558 N 4.36 0.29 -0.55 -1.09 -0.00 -1.94 -0.74 115.11 115.44 1w0p h GLN 558 Ca 0.00 -0.02 -0.19 0.00 -0.00 0.00 0.00 58.65 58.45 1w0p h GLN 558 Cb 0.97 -0.07 -0.11 0.00 -0.00 0.00 0.00 27.48 28.28 1w0p h GLN 558 CO 0.00 0.19 0.15 0.09 -0.00 0.00 0.00 178.83 179.27 1w0p n ASN 559 N -4.48 3.87 -4.16 0.06 4.13 -1.26 -4.89 115.26 108.53 1w0p n ASN 559 Ca 0.22 -3.36 -0.35 0.00 1.68 0.00 0.00 54.58 52.77 1w0p n ASN 559 Cb 0.87 -0.68 -0.13 0.00 -1.54 0.00 0.00 39.78 38.30 1w0p n ASN 559 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1w0p s ILE 560 N -3.06 3.10 0.20 2.41 -1.09 -0.28 -5.08 121.20 117.39 1w0p s ILE 560 Ca 0.49 -1.59 -0.32 0.00 -2.23 0.00 0.00 60.65 57.01 1w0p s ILE 560 Cb 0.41 -2.89 -0.11 0.00 -1.58 0.00 0.00 42.46 38.28 1w0p s ILE 560 CO 0.08 -0.29 1.70 -0.55 -1.23 0.00 0.00 174.94 174.65 1w0p s SER 561 N 1.40 6.42 0.00 3.58 0.15 -1.26 -2.07 113.70 121.93 1w0p s SER 561 Ca -0.01 2.82 0.00 0.00 0.70 0.00 0.00 55.95 59.46 1w0p s SER 561 Cb -0.20 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.51 1w0p s SER 561 CO -0.02 -0.95 0.00 0.61 1.20 0.00 0.00 173.24 174.08 1w0p n GLY 562 N 3.95 1.95 2.60 9.45 0.00 -1.26 -4.84 105.19 117.04 1w0p n GLY 562 Ca 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 1w0p n GLY 562 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1w0p n SER 563 N 0.00 1.86 -3.51 1.61 2.88 -0.88 -5.00 113.62 110.58 1w0p n SER 563 Ca 0.00 -2.18 -0.15 0.00 -1.33 0.00 0.00 58.87 55.21 1w0p n SER 563 Cb 0.00 -0.14 -0.05 0.00 -0.75 0.00 0.00 64.21 63.27 1w0p n SER 563 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1w0p s GLN 564 N -3.63 1.00 0.36 -1.46 -2.07 -1.26 -4.93 119.66 107.66 1w0p s GLN 564 Ca 0.30 0.08 -0.26 0.00 -1.82 0.00 0.00 55.36 53.66 1w0p s GLN 564 Cb -0.02 0.47 -0.09 0.00 -1.09 0.00 0.00 33.01 32.28 1w0p s GLN 564 CO 0.19 -0.35 1.08 -0.80 -1.32 0.00 0.00 175.29 174.10 1w0p s ASN 565 N -1.52 6.90 0.00 12.60 0.01 -1.26 -3.15 114.94 128.51 1w0p s ASN 565 Ca -0.06 2.16 0.00 0.00 -0.71 0.00 0.00 52.86 54.25 1w0p s ASN 565 Cb -0.00 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.05 1w0p s ASN 565 CO 0.03 -0.40 0.00 0.61 -1.51 0.00 0.00 177.10 175.84 1w0p n GLY 566 N 0.69 0.70 3.72 0.66 0.00 0.10 -4.99 105.19 106.07 1w0p n GLY 566 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1w0p n GLY 566 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1w0p n ARG 567 N -1.87 2.79 -3.57 1.61 0.63 -1.19 -4.68 116.66 110.39 1w0p n ARG 567 Ca 0.00 1.00 -0.37 0.00 -0.92 0.00 0.00 57.85 57.57 1w0p n ARG 567 Cb 0.00 -2.85 -0.07 0.00 0.45 0.00 0.00 32.46 30.00 1w0p n ARG 567 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1w0p s LEU 568 N 0.93 4.29 -0.08 6.15 1.43 -0.62 -1.13 118.68 129.65 1w0p s LEU 568 Ca 0.73 0.57 -0.18 0.00 -1.03 0.00 0.00 54.13 54.22 1w0p s LEU 568 Cb -0.50 -2.37 0.04 0.00 0.03 0.00 0.00 46.19 43.39 1w0p s LEU 568 CO 0.34 0.16 0.43 -0.51 0.23 0.00 0.00 176.35 177.00 1w0p s ILE 569 N 0.10 0.02 0.04 -0.59 2.07 -0.52 -0.95 121.20 121.37 1w0p s ILE 569 Ca 0.17 -0.20 -0.09 0.00 -1.41 0.00 0.00 60.65 59.12 1w0p s ILE 569 Cb -0.13 -0.68 0.00 0.00 0.13 0.00 0.00 42.46 41.78 1w0p s ILE 569 CO 0.05 -0.11 0.18 -0.72 -1.91 0.00 0.00 174.94 172.43 1w0p s TYR 570 N -0.65 0.07 -0.61 3.50 1.13 -0.74 -1.45 117.35 118.60 1w0p s TYR 570 Ca -0.08 -0.29 -0.20 0.00 -1.41 0.00 0.00 57.07 55.09 1w0p s TYR 570 Cb -0.04 -0.04 0.09 0.00 -1.10 0.00 0.00 41.96 40.87 1w0p s TYR 570 CO 0.04 -0.41 0.80 -1.25 -2.51 0.00 0.00 175.55 172.21 1w0p s PRO 571 N -2.48 3.08 0.55 -3.49 0.04 -1.26 -1.43 135.00 130.01 1w0p s PRO 571 Ca -0.06 -1.09 -0.06 0.00 0.04 0.00 0.00 61.00 59.83 1w0p s PRO 571 Cb -0.02 -4.24 -0.02 0.00 0.04 0.00 0.00 34.50 30.27 1w0p s PRO 571 CO -0.03 -1.62 0.87 0.00 0.04 0.00 0.00 177.00 176.26 1w0p s ALA 572 N 3.22 3.30 -0.19 8.56 0.00 0.52 -4.60 121.76 132.58 1w0p s ALA 572 Ca 0.16 -0.51 -0.07 0.00 0.00 0.00 0.00 51.96 51.54 1w0p s ALA 572 Cb -0.21 -2.68 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 1w0p s ALA 572 CO 0.08 -0.59 0.05 0.42 0.00 0.00 0.00 175.76 175.72 1w0p s ILE 573 N -2.92 4.49 -0.06 0.00 1.01 0.16 -1.26 121.20 122.62 1w0p s ILE 573 Ca 0.51 -0.13 0.05 0.00 0.00 0.00 0.00 60.65 61.08 1w0p s ILE 573 Cb -0.10 -3.04 -0.00 0.00 0.01 0.00 0.00 42.46 39.33 1w0p s ILE 573 CO 0.47 0.43 -0.22 0.54 0.00 0.00 0.00 174.94 176.16 1w0p s VAL 574 N 0.69 1.83 -0.27 2.92 0.11 -0.01 -0.90 120.40 124.76 1w0p s VAL 574 Ca 0.02 -0.92 -0.04 0.00 -2.93 0.00 0.00 61.98 58.11 1w0p s VAL 574 Cb -0.13 -1.57 0.02 0.00 -1.53 0.00 0.00 36.38 33.16 1w0p s VAL 574 CO 0.02 0.51 0.01 -0.22 -3.33 0.00 0.00 175.10 172.09 1w0p s LEU 575 N 0.07 3.52 -0.04 2.54 2.96 -0.56 -1.91 118.68 125.26 1w0p s LEU 575 Ca -0.08 -0.79 -0.20 0.00 -0.22 0.00 0.00 54.13 52.83 1w0p s LEU 575 Cb -0.14 -1.77 -0.15 0.00 0.50 0.00 0.00 46.19 44.63 1w0p s LEU 575 CO 0.05 -0.16 0.86 -2.24 -1.32 0.00 0.00 176.35 173.54 1w0p h ASP 576 N 8.12 -0.24 0.00 3.68 3.04 -1.84 0.91 116.42 130.09 1w0p h ASP 576 Ca -0.32 -0.28 0.00 0.00 -3.24 0.00 0.00 57.03 53.19 1w0p h ASP 576 Cb 1.12 0.06 0.00 0.00 -1.04 0.00 0.00 39.33 39.47 1w0p h ASP 576 CO 0.59 0.28 0.00 -1.14 -2.04 0.00 0.00 179.24 176.93 1w0p n ARG 577 N -4.97 0.00 -0.01 4.15 0.63 -1.26 -1.43 116.66 113.77 1w0p n ARG 577 Ca -0.08 0.00 0.01 0.00 -0.92 0.00 0.00 57.85 56.87 1w0p n ARG 577 Cb 0.25 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.12 1w0p n ARG 577 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1w0p n PHE 578 N -3.26 0.00 -4.98 -0.14 3.72 -1.26 -4.85 117.46 106.70 1w0p n PHE 578 Ca 0.00 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.08 1w0p n PHE 578 Cb 0.00 -0.17 -0.14 0.00 -0.94 0.00 0.00 39.48 38.23 1w0p n PHE 578 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1w0p s PHE 579 N -2.33 2.63 0.16 1.38 0.08 -1.26 -4.96 117.98 113.67 1w0p s PHE 579 Ca -0.02 -0.28 -0.09 0.00 0.12 0.00 0.00 56.93 56.67 1w0p s PHE 579 Cb 0.03 -1.62 -0.06 0.00 -0.57 0.00 0.00 43.02 40.80 1w0p s PHE 579 CO 0.24 0.09 0.46 -0.51 -0.10 0.00 0.00 175.22 175.40 1w0p s LEU 580 N -0.60 4.26 0.31 -0.37 1.43 -1.26 -3.11 118.68 119.34 1w0p s LEU 580 Ca 0.09 0.80 -0.14 0.00 -1.03 0.00 0.00 54.13 53.85 1w0p s LEU 580 Cb -0.11 -3.35 0.02 0.00 0.03 0.00 0.00 46.19 42.78 1w0p s LEU 580 CO 0.01 0.05 0.62 0.21 0.23 0.00 0.00 176.35 177.46 1w0p s ASN 581 N -2.16 0.06 0.02 2.29 3.84 -0.80 -3.73 114.94 114.45 1w0p s ASN 581 Ca 0.41 -1.00 0.06 0.00 0.21 0.00 0.00 52.86 52.54 1w0p s ASN 581 Cb -0.13 0.70 -0.03 0.00 -0.55 0.00 0.00 41.25 41.25 1w0p s ASN 581 CO 0.21 -1.36 -0.16 -0.69 -2.79 0.00 0.00 177.10 172.31 1w0p s VAL 582 N -3.41 2.92 0.01 -5.21 1.01 -1.26 -0.83 120.40 113.63 1w0p s VAL 582 Ca 0.19 -1.06 -0.10 0.00 0.00 0.00 0.00 61.98 61.02 1w0p s VAL 582 Cb -0.03 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 34.14 1w0p s VAL 582 CO 0.11 0.39 0.19 0.00 0.00 0.00 0.00 175.10 175.80 1w0p s MET 583 N -1.30 0.58 0.32 2.72 0.23 -0.39 -1.58 119.30 119.89 1w0p s MET 583 Ca 0.14 -0.41 -0.26 0.00 -1.03 0.00 0.00 55.69 54.13 1w0p s MET 583 Cb -0.11 0.25 -0.10 0.00 -1.53 0.00 0.00 34.83 33.34 1w0p s MET 583 CO 0.05 -0.15 0.98 -1.12 -2.03 0.00 0.00 175.02 172.74 1w0p s SER 584 N -1.54 7.26 -0.12 -1.18 0.01 -1.26 -0.35 113.70 116.51 1w0p s SER 584 Ca -0.12 1.93 0.02 0.00 1.31 0.00 0.00 55.95 59.09 1w0p s SER 584 Cb -0.05 -2.59 0.01 0.00 0.21 0.00 0.00 66.02 63.60 1w0p s SER 584 CO 0.01 -0.13 -0.18 -0.63 0.41 0.00 0.00 173.24 172.72 1w0p s ILE 585 N -1.53 1.72 0.16 1.44 1.01 -0.51 -0.43 121.20 123.05 1w0p s ILE 585 Ca 0.50 -0.78 -0.06 0.00 0.00 0.00 0.00 60.65 60.31 1w0p s ILE 585 Cb -0.21 -1.54 -0.02 0.00 0.01 0.00 0.00 42.46 40.70 1w0p s ILE 585 CO 0.27 0.48 0.21 -0.72 0.00 0.00 0.00 174.94 175.19 1w0p s TYR 586 N 0.85 0.56 -0.02 3.97 1.13 -0.36 -1.79 117.35 121.69 1w0p s TYR 586 Ca -0.08 -0.93 0.00 0.00 -1.41 0.00 0.00 57.07 54.65 1w0p s TYR 586 Cb -0.15 -0.20 0.03 0.00 -1.10 0.00 0.00 41.96 40.54 1w0p s TYR 586 CO -0.00 -0.66 0.02 0.45 -2.51 0.00 0.00 175.55 172.84 1w0p s SER 587 N -3.00 0.20 -0.03 -0.18 0.15 -0.13 -0.59 113.70 110.13 1w0p s SER 587 Ca 0.20 0.01 0.19 0.00 0.70 0.00 0.00 55.95 57.05 1w0p s SER 587 Cb 0.05 -0.12 0.58 0.00 -1.71 0.00 0.00 66.02 64.81 1w0p s SER 587 CO 0.01 -0.11 1.49 0.47 1.20 0.00 0.00 173.24 176.30 1w0p n ASP 588 N 4.09 3.87 -1.41 5.45 8.00 -1.26 -1.59 116.55 133.70 1w0p n ASP 588 Ca -0.27 -2.11 -0.00 0.00 0.71 0.00 0.00 54.79 53.12 1w0p n ASP 588 Cb 0.51 -0.45 0.10 0.00 -0.02 0.00 0.00 41.12 41.26 1w0p n ASP 588 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1w0p n ASP 589 N 1.23 1.96 0.00 -2.24 3.85 -1.26 -4.94 116.55 115.15 1w0p n ASP 589 Ca 0.22 -3.01 0.00 0.00 -0.71 0.00 0.00 54.79 51.29 1w0p n ASP 589 Cb 0.64 -0.42 0.00 0.00 -1.35 0.00 0.00 41.12 39.99 1w0p n ASP 589 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1w0p n GLY 590 N -0.46 0.67 0.00 6.12 0.00 -1.26 -3.95 105.19 106.31 1w0p n GLY 590 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1w0p n GLY 590 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w0p n GLY 591 N -2.64 1.10 0.13 -0.02 0.00 -1.26 -5.00 105.19 97.50 1w0p n GLY 591 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1w0p n GLY 591 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1w0p h SER 592 N 0.00 0.36 -3.31 1.61 0.87 -1.97 -3.46 113.55 107.65 1w0p h SER 592 Ca 0.00 -0.85 -0.66 0.00 -1.23 0.00 0.00 61.79 59.06 1w0p h SER 592 Cb 0.00 -0.12 -0.33 0.00 -0.44 0.00 0.00 62.40 61.51 1w0p h SER 592 CO 0.00 1.70 -0.87 0.20 -0.53 0.00 0.00 176.83 177.33 1w0p s ASN 593 N -7.04 2.92 0.18 6.23 0.01 -1.26 -5.08 114.94 110.90 1w0p s ASN 593 Ca -0.22 -0.53 0.09 0.00 -0.71 0.00 0.00 52.86 51.49 1w0p s ASN 593 Cb 0.05 -1.34 -0.04 0.00 0.41 0.00 0.00 41.25 40.34 1w0p s ASN 593 CO 0.75 0.12 -0.07 0.26 -1.51 0.00 0.00 177.10 176.65 1w0p s TRP 594 N 0.52 2.68 0.16 2.20 0.52 -1.26 -4.21 118.94 119.55 1w0p s TRP 594 Ca -0.15 -0.20 0.01 0.00 0.02 0.00 0.00 56.10 55.77 1w0p s TRP 594 Cb -0.17 -1.30 -0.04 0.00 -1.15 0.00 0.00 33.47 30.80 1w0p s TRP 594 CO 0.05 0.52 0.03 -0.65 0.02 0.00 0.00 176.95 176.93 1w0p s GLN 595 N -2.89 1.07 0.14 4.98 -0.21 0.24 -4.72 119.66 118.27 1w0p s GLN 595 Ca 0.26 -1.52 0.11 0.00 0.02 0.00 0.00 55.36 54.23 1w0p s GLN 595 Cb -0.09 -0.07 -0.04 0.00 1.00 0.00 0.00 33.01 33.81 1w0p s GLN 595 CO 0.16 -0.20 -0.26 0.95 -2.12 0.00 0.00 175.29 173.83 1w0p s THR 596 N -3.82 2.32 0.10 -0.19 -4.23 -1.26 -1.23 115.64 107.33 1w0p s THR 596 Ca 0.25 -1.79 0.01 0.00 -1.18 0.00 0.00 61.69 58.99 1w0p s THR 596 Cb 0.07 -2.05 0.01 0.00 1.34 0.00 0.00 72.50 71.88 1w0p s THR 596 CO 0.04 0.05 0.12 0.61 -0.54 0.00 0.00 174.62 174.90 1w0p n GLY 597 N 0.78 2.25 3.83 3.99 0.00 0.43 -4.99 105.19 111.48 1w0p n GLY 597 Ca -0.17 -2.16 -0.33 0.00 0.00 0.00 0.00 46.02 43.36 1w0p n GLY 597 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1w0p s SER 598 N -1.59 6.87 0.76 1.61 0.01 0.24 -4.53 113.70 117.07 1w0p s SER 598 Ca 0.09 1.60 -0.11 0.00 1.31 0.00 0.00 55.95 58.83 1w0p s SER 598 Cb -0.01 -2.50 0.05 0.00 0.21 0.00 0.00 66.02 63.77 1w0p s SER 598 CO 0.06 -0.35 1.08 0.42 0.41 0.00 0.00 173.24 174.85 1w0p s THR 599 N -2.19 3.48 0.37 1.44 -4.23 -1.26 -4.37 115.64 108.88 1w0p s THR 599 Ca 0.60 0.48 -0.28 0.00 -1.18 0.00 0.00 61.69 61.31 1w0p s THR 599 Cb -0.09 -3.09 -0.10 0.00 1.34 0.00 0.00 72.50 70.56 1w0p s THR 599 CO 0.16 -0.63 1.37 -0.76 -0.54 0.00 0.00 174.62 174.22 1w0p s LEU 600 N -5.80 4.32 -0.10 4.79 1.43 -0.61 -4.77 118.68 117.95 1w0p s LEU 600 Ca 0.60 2.80 -0.30 0.00 -1.03 0.00 0.00 54.13 56.21 1w0p s LEU 600 Cb -0.16 -3.73 -0.02 0.00 0.03 0.00 0.00 46.19 42.31 1w0p s LEU 600 CO 0.56 -0.75 1.10 -2.16 0.23 0.00 0.00 176.35 175.32 1w0p s PRO 601 N -2.03 4.37 0.05 1.29 0.04 -1.26 -4.93 135.00 132.53 1w0p s PRO 601 Ca 0.53 1.51 0.03 0.00 0.04 0.00 0.00 61.00 63.11 1w0p s PRO 601 Cb -0.42 -3.56 -0.02 0.00 0.04 0.00 0.00 34.50 30.54 1w0p s PRO 601 CO 0.55 -0.41 -0.09 0.96 0.04 0.00 0.00 177.00 178.05 1w0p s ILE 602 N 2.24 0.69 0.66 0.56 -4.36 -1.26 -4.59 121.20 115.14 1w0p s ILE 602 Ca 0.51 -1.09 -0.14 0.00 -0.26 0.00 0.00 60.65 59.68 1w0p s ILE 602 Cb -0.21 -0.72 -0.00 0.00 1.25 0.00 0.00 42.46 42.78 1w0p s ILE 602 CO 0.18 -0.30 1.08 -2.16 0.24 0.00 0.00 174.94 173.98 1w0p s PRO 603 N -1.53 2.94 0.04 0.37 0.04 -1.26 -4.96 135.00 130.66 1w0p s PRO 603 Ca -0.07 1.21 -0.11 0.00 0.04 0.00 0.00 61.00 62.06 1w0p s PRO 603 Cb -0.10 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.47 1w0p s PRO 603 CO 0.01 -1.11 0.24 -0.59 0.04 0.00 0.00 177.00 175.58 1w0p s PHE 604 N -2.60 -0.00 -0.17 0.56 -0.71 -1.26 -3.99 117.98 109.81 1w0p s PHE 604 Ca 0.63 -0.20 -0.18 0.00 -1.04 0.00 0.00 56.93 56.14 1w0p s PHE 604 Cb -0.17 0.02 0.05 0.00 -1.21 0.00 0.00 43.02 41.71 1w0p s PHE 604 CO 0.44 -0.47 0.50 0.50 -1.34 0.00 0.00 175.22 174.86 1w0p s ARG 605 N -2.64 0.62 -0.32 1.99 3.00 -0.21 -4.98 118.95 116.41 1w0p s ARG 605 Ca -0.04 0.64 -0.11 0.00 -1.00 0.00 0.00 55.73 55.21 1w0p s ARG 605 Cb -0.01 0.30 -0.01 0.00 0.00 0.00 0.00 34.95 35.23 1w0p s ARG 605 CO -0.04 -0.09 0.19 -1.58 0.00 0.00 0.00 175.30 173.78 1w0p s TRP 606 N 0.12 3.20 -2.00 5.12 0.52 -1.26 -0.64 118.94 123.99 1w0p s TRP 606 Ca -0.01 -0.39 0.09 0.00 0.02 0.00 0.00 56.10 55.80 1w0p s TRP 606 Cb -0.03 -2.40 0.52 0.00 -1.15 0.00 0.00 33.47 30.40 1w0p s TRP 606 CO 0.01 -0.40 0.94 1.17 0.02 0.00 0.00 176.95 178.69 1w0p n LYS 607 N 5.03 0.41 -3.72 4.98 0.00 0.63 -4.80 118.16 120.70 1w0p n LYS 607 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.18 1w0p n LYS 607 Cb 0.49 -1.33 0.00 0.00 0.00 0.00 0.00 35.03 34.20 1w0p n LYS 607 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1w0p n SER 608 N -0.83 0.00 -1.69 3.14 2.88 -1.26 -4.85 113.62 111.01 1w0p n SER 608 Ca 0.07 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.59 1w0p n SER 608 Cb 0.03 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.46 1w0p n SER 608 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1w0p n SER 609 N 2.17 4.36 0.00 -3.46 7.64 -1.26 -3.92 113.62 119.15 1w0p n SER 609 Ca 0.00 -2.18 0.00 0.00 1.01 0.00 0.00 58.87 57.70 1w0p n SER 609 Cb 0.00 -0.97 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 1w0p n SER 609 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1w0p n SER 610 N 1.79 0.00 -4.51 6.43 3.41 -1.26 -4.97 113.62 114.51 1w0p n SER 610 Ca 0.07 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.26 1w0p n SER 610 Cb 0.48 0.10 -0.10 0.00 -0.26 0.00 0.00 64.21 64.43 1w0p n SER 610 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1w0p s ILE 611 N -1.25 5.21 -0.08 -1.33 1.01 -1.25 -4.97 121.20 118.53 1w0p s ILE 611 Ca 0.00 -0.26 -0.25 0.00 0.00 0.00 0.00 60.65 60.14 1w0p s ILE 611 Cb 0.00 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.59 1w0p s ILE 611 CO 0.00 -0.17 0.78 -0.22 0.00 0.00 0.00 174.94 175.33 1w0p s LEU 612 N 1.87 4.29 -0.23 2.97 2.96 -1.26 -0.27 118.68 129.00 1w0p s LEU 612 Ca 0.09 1.26 0.02 0.00 -0.22 0.00 0.00 54.13 55.28 1w0p s LEU 612 Cb -0.17 -3.20 0.05 0.00 0.50 0.00 0.00 46.19 43.36 1w0p s LEU 612 CO 0.11 -0.22 -0.14 -0.70 -1.32 0.00 0.00 176.35 174.09 1w0p s GLU 613 N 1.20 2.45 0.19 1.98 2.12 0.18 -4.98 118.70 121.84 1w0p s GLU 613 Ca 0.40 -1.17 -0.02 0.00 0.36 0.00 0.00 54.97 54.54 1w0p s GLU 613 Cb -0.18 -2.77 0.01 0.00 0.26 0.00 0.00 34.13 31.45 1w0p s GLU 613 CO 0.18 -0.46 0.29 -2.37 -0.54 0.00 0.00 175.26 172.37 1w0p n THR 614 N 4.50 0.00 -4.00 -1.70 5.66 -1.26 -1.04 114.28 116.44 1w0p n THR 614 Ca -0.16 -0.84 -0.22 0.00 -3.05 0.00 0.00 64.05 59.78 1w0p n THR 614 Cb 0.45 0.56 -0.04 0.00 -1.55 0.00 0.00 70.33 69.75 1w0p n THR 614 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1w0p s LEU 615 N 0.00 3.73 -0.47 1.09 1.43 -1.26 -4.62 118.68 118.58 1w0p s LEU 615 Ca 0.14 -0.35 0.05 0.00 -1.03 0.00 0.00 54.13 52.94 1w0p s LEU 615 Cb -0.01 -2.30 0.18 0.00 0.03 0.00 0.00 46.19 44.09 1w0p s LEU 615 CO 0.10 -0.16 0.40 -0.62 0.23 0.00 0.00 176.35 176.30 1w0p n GLU 616 N -1.26 0.63 -1.95 1.70 1.02 -1.25 -4.87 120.64 114.66 1w0p n GLU 616 Ca -0.05 -3.48 -0.41 0.00 -0.02 0.00 0.00 57.16 53.19 1w0p n GLU 616 Cb 0.59 -1.77 -0.01 0.00 -0.02 0.00 0.00 31.44 30.23 1w0p n GLU 616 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 1w0p s PRO 617 N -0.44 4.22 0.00 3.49 0.02 -1.24 -1.89 135.00 139.14 1w0p s PRO 617 Ca 0.32 2.40 0.00 0.00 0.02 0.00 0.00 61.00 63.74 1w0p s PRO 617 Cb 0.04 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.55 1w0p s PRO 617 CO -0.18 -0.37 0.00 -1.13 -0.33 0.00 0.00 177.00 174.99 1w0p n SER 618 N 0.60 0.00 -4.62 2.53 3.41 -0.37 -3.12 113.62 112.06 1w0p n SER 618 Ca 0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.19 1w0p n SER 618 Cb 0.40 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.33 1w0p n SER 618 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1w0p s GLU 619 N 0.55 3.62 0.22 4.33 2.02 -1.26 -4.73 118.70 123.46 1w0p s GLU 619 Ca 0.00 1.56 0.06 0.00 0.02 0.00 0.00 54.97 56.61 1w0p s GLU 619 Cb 0.00 -4.10 -0.05 0.00 0.10 0.00 0.00 34.13 30.08 1w0p s GLU 619 CO 0.00 -1.50 -0.08 0.00 0.02 0.00 0.00 175.26 173.70 1w0p s ALA 620 N 5.81 1.91 -0.03 5.21 0.00 -1.26 -1.22 121.76 132.17 1w0p s ALA 620 Ca 0.74 -1.70 -0.08 0.00 0.00 0.00 0.00 51.96 50.92 1w0p s ALA 620 Cb -0.24 0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.05 1w0p s ALA 620 CO 0.31 -0.09 0.19 -0.51 0.00 0.00 0.00 175.76 175.66 1w0p s ASP 621 N -3.31 -0.10 0.13 0.00 1.11 -0.58 -4.75 116.67 109.18 1w0p s ASP 621 Ca 0.24 0.09 0.04 0.00 0.18 0.00 0.00 52.55 53.09 1w0p s ASP 621 Cb 0.03 0.31 -0.04 0.00 1.07 0.00 0.00 42.92 44.28 1w0p s ASP 621 CO 0.07 -0.26 -0.09 0.00 1.18 0.00 0.00 175.17 176.07 1w0p s MET 622 N -0.76 0.98 0.00 8.23 0.23 -1.26 -0.84 119.30 125.88 1w0p s MET 622 Ca -0.08 -1.40 -0.05 0.00 -1.03 0.00 0.00 55.69 53.13 1w0p s MET 622 Cb -0.05 -0.48 -0.00 0.00 -1.53 0.00 0.00 34.83 32.77 1w0p s MET 622 CO 0.01 0.04 0.09 0.54 -2.03 0.00 0.00 175.02 173.67 1w0p s VAL 623 N -3.39 0.08 -0.22 5.16 0.11 -0.17 -4.85 120.40 117.13 1w0p s VAL 623 Ca 0.15 -0.69 -0.17 0.00 -2.93 0.00 0.00 61.98 58.34 1w0p s VAL 623 Cb 0.03 -0.36 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 1w0p s VAL 623 CO -0.01 -0.38 0.44 -0.70 -3.33 0.00 0.00 175.10 171.12 1w0p s GLU 624 N -1.26 4.14 0.89 1.54 2.12 -1.26 -0.91 118.70 123.95 1w0p s GLU 624 Ca -0.14 0.25 -0.13 0.00 0.36 0.00 0.00 54.97 55.31 1w0p s GLU 624 Cb -0.08 -3.58 0.13 0.00 0.26 0.00 0.00 34.13 30.86 1w0p s GLU 624 CO 0.01 -0.16 1.18 -0.51 -0.54 0.00 0.00 175.26 175.24 1w0p s LEU 625 N 1.68 2.24 0.40 2.70 1.43 0.26 -4.94 118.68 122.44 1w0p s LEU 625 Ca 0.20 0.79 0.07 0.00 -1.03 0.00 0.00 54.13 54.16 1w0p s LEU 625 Cb -0.15 -3.12 0.83 0.00 0.03 0.00 0.00 46.19 43.77 1w0p s LEU 625 CO 0.09 -2.38 2.02 -0.61 0.23 0.00 0.00 176.35 175.70 1w0p h GLN 626 N -1.38 0.60 -0.42 1.70 5.75 -1.98 -2.35 115.11 117.03 1w0p h GLN 626 Ca -0.48 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 57.99 1w0p h GLN 626 Cb 1.32 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.73 1w0p h GLN 626 CO 0.60 0.40 0.00 0.27 -2.65 0.00 0.00 178.83 177.44 1w0p n ASN 627 N -4.47 2.20 0.00 -0.69 6.94 -1.26 -4.91 115.26 113.07 1w0p n ASN 627 Ca 0.06 -2.02 0.00 0.00 -0.02 0.00 0.00 54.58 52.60 1w0p n ASN 627 Cb 0.14 -0.28 0.00 0.00 -2.36 0.00 0.00 39.78 37.28 1w0p n ASN 627 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1w0p n GLY 628 N 1.11 2.01 3.78 4.83 0.00 -0.89 -4.94 105.19 111.10 1w0p n GLY 628 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1w0p n GLY 628 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w0p s ASP 629 N -1.84 5.44 -0.14 1.61 1.01 -1.26 -4.73 116.67 116.76 1w0p s ASP 629 Ca 0.00 2.02 -0.03 0.00 0.71 0.00 0.00 52.55 55.25 1w0p s ASP 629 Cb 0.00 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.34 1w0p s ASP 629 CO 0.00 -1.41 -0.04 -0.76 0.21 0.00 0.00 175.17 173.17 1w0p s LEU 630 N -4.44 3.25 -0.20 1.23 1.43 -0.29 -0.58 118.68 119.09 1w0p s LEU 630 Ca 0.68 -0.11 -0.07 0.00 -1.03 0.00 0.00 54.13 53.61 1w0p s LEU 630 Cb -0.21 -1.77 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 1w0p s LEU 630 CO 0.36 0.20 0.04 -0.22 0.23 0.00 0.00 176.35 176.96 1w0p s LEU 631 N 0.16 3.56 -0.04 1.79 2.96 -0.09 -1.10 118.68 125.93 1w0p s LEU 631 Ca -0.02 -0.06 0.07 0.00 -0.22 0.00 0.00 54.13 53.90 1w0p s LEU 631 Cb -0.14 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.63 1w0p s LEU 631 CO 0.03 0.10 -0.25 -0.22 -1.32 0.00 0.00 176.35 174.69 1w0p s LEU 632 N 0.81 2.06 -0.13 -0.68 1.98 -0.11 -1.00 118.68 121.61 1w0p s LEU 632 Ca 0.03 -0.49 0.03 0.00 -2.89 0.00 0.00 54.13 50.81 1w0p s LEU 632 Cb -0.14 -1.34 0.01 0.00 0.66 0.00 0.00 46.19 45.38 1w0p s LEU 632 CO 0.02 0.28 -0.22 0.42 -1.89 0.00 0.00 176.35 174.96 1w0p s THR 633 N -0.39 2.11 0.01 3.68 -4.23 -0.02 -0.38 115.64 116.43 1w0p s THR 633 Ca 0.03 -0.97 0.06 0.00 -1.18 0.00 0.00 61.69 59.64 1w0p s THR 633 Cb -0.12 -1.84 -0.02 0.00 1.34 0.00 0.00 72.50 71.87 1w0p s THR 633 CO 0.01 0.55 -0.19 0.00 -0.54 0.00 0.00 174.62 174.45 1w0p s ALA 634 N 0.72 1.57 0.21 3.99 0.00 -0.22 -1.52 121.76 126.51 1w0p s ALA 634 Ca -0.09 -0.88 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 1w0p s ALA 634 Cb -0.16 -0.35 -0.08 0.00 0.00 0.00 0.00 23.12 22.52 1w0p s ALA 634 CO 0.00 0.37 1.10 0.50 0.00 0.00 0.00 175.76 177.73 1w0p s ARG 635 N -0.75 4.61 -0.34 0.00 3.52 -0.36 -1.42 118.95 124.21 1w0p s ARG 635 Ca 0.07 1.75 -0.07 0.00 -0.13 0.00 0.00 55.73 57.36 1w0p s ARG 635 Cb -0.08 -3.24 0.04 0.00 -1.56 0.00 0.00 34.95 30.10 1w0p s ARG 635 CO 0.00 0.12 0.10 -0.51 -0.81 0.00 0.00 175.30 174.21 1w0p s LEU 636 N -0.73 4.29 0.33 -0.88 1.43 -0.51 -1.24 118.68 121.37 1w0p s LEU 636 Ca 0.48 -1.11 0.01 0.00 -1.03 0.00 0.00 54.13 52.48 1w0p s LEU 636 Cb -0.30 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.01 1w0p s LEU 636 CO 0.37 -0.32 0.52 -1.81 0.23 0.00 0.00 176.35 175.34 1w0p s ASP 637 N 1.41 6.27 1.64 2.29 1.01 -0.79 -4.75 116.67 123.75 1w0p s ASP 637 Ca -0.01 0.36 0.00 0.00 0.71 0.00 0.00 52.55 53.61 1w0p s ASP 637 Cb -0.19 -1.96 0.00 0.00 1.01 0.00 0.00 42.92 41.78 1w0p s ASP 637 CO 0.03 -0.28 0.00 0.49 0.21 0.00 0.00 175.17 175.62 1w0p n PHE 638 N -1.73 0.00 -1.84 4.23 3.72 -1.26 -3.91 117.46 116.67 1w0p n PHE 638 Ca -0.05 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.93 1w0p n PHE 638 Cb 0.56 0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 39.09 1w0p n PHE 638 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1w0p s ASN 639 N -4.00 6.49 0.00 4.37 2.47 -1.26 -4.91 114.94 118.11 1w0p s ASN 639 Ca 0.00 2.72 0.02 0.00 0.42 0.00 0.00 52.86 56.01 1w0p s ASN 639 Cb 0.00 -2.59 0.01 0.00 -1.45 0.00 0.00 41.25 37.22 1w0p s ASN 639 CO 0.00 -0.90 0.50 0.00 -3.72 0.00 0.00 177.10 172.98 1w0p n GLN 640 N 4.22 0.14 -4.60 0.43 6.02 -1.26 -4.28 117.38 118.05 1w0p n GLN 640 Ca 0.15 -0.53 -0.33 0.00 -0.01 0.00 0.00 57.00 56.28 1w0p n GLN 640 Cb 0.37 -0.98 -0.15 0.00 1.02 0.00 0.00 30.24 30.51 1w0p n GLN 640 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1w0p s ILE 641 N -0.27 2.84 -0.07 5.09 1.01 -1.26 -1.03 121.20 127.50 1w0p s ILE 641 Ca 0.02 -0.72 -0.01 0.00 0.00 0.00 0.00 60.65 59.95 1w0p s ILE 641 Cb 0.01 -2.20 0.03 0.00 0.01 0.00 0.00 42.46 40.31 1w0p s ILE 641 CO 0.03 0.51 -0.03 -0.69 0.00 0.00 0.00 174.94 174.76 1w0p s VAL 642 N 0.68 0.55 -1.46 2.92 1.01 -0.60 -4.72 120.40 118.78 1w0p s VAL 642 Ca -0.07 -0.02 -0.09 0.00 0.00 0.00 0.00 61.98 61.80 1w0p s VAL 642 Cb -0.16 -0.65 0.06 0.00 0.00 0.00 0.00 36.38 35.63 1w0p s VAL 642 CO 0.02 0.28 0.85 -3.20 0.00 0.00 0.00 175.10 173.05 1w0p n ASN 643 N 4.84 -3.28 0.00 3.32 5.15 -1.26 -1.69 115.26 122.34 1w0p n ASN 643 Ca -0.12 -0.82 0.00 0.00 -0.60 0.00 0.00 54.58 53.04 1w0p n ASN 643 Cb 0.50 -3.84 0.00 0.00 -0.53 0.00 0.00 39.78 35.91 1w0p n ASN 643 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1w0p n GLY 644 N -1.67 1.98 3.65 8.20 0.00 -1.26 -5.01 105.19 111.08 1w0p n GLY 644 Ca -0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1w0p n GLY 644 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w0p s VAL 645 N -3.47 5.34 -0.35 1.61 1.01 -0.68 -5.06 120.40 118.80 1w0p s VAL 645 Ca 0.00 0.20 -0.18 0.00 0.00 0.00 0.00 61.98 62.01 1w0p s VAL 645 Cb 0.00 -3.52 -0.00 0.00 0.00 0.00 0.00 36.38 32.86 1w0p s VAL 645 CO 0.00 0.32 0.50 0.21 0.00 0.00 0.00 175.10 176.14 1w0p s ASN 646 N 1.19 6.30 0.00 3.32 3.84 -1.26 -1.56 114.94 126.77 1w0p s ASN 646 Ca 0.08 -0.06 0.29 0.00 0.21 0.00 0.00 52.86 53.38 1w0p s ASN 646 Cb -0.14 -2.26 1.29 0.00 -0.55 0.00 0.00 41.25 39.58 1w0p s ASN 646 CO 0.06 -0.48 1.88 -1.22 -2.79 0.00 0.00 177.10 174.55 1w0p n TYR 647 N 5.72 0.00 -0.73 0.43 4.02 -0.20 -5.02 117.16 121.38 1w0p n TYR 647 Ca -0.05 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.94 1w0p n TYR 647 Cb 0.49 -0.02 -0.03 0.00 -0.02 0.00 0.00 39.34 39.77 1w0p n TYR 647 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1w0p n SER 648 N -0.26 -4.36 0.00 7.72 3.41 -1.26 -4.27 113.62 114.61 1w0p n SER 648 Ca 0.20 0.30 0.14 0.00 -0.26 0.00 0.00 58.87 59.25 1w0p n SER 648 Cb 0.28 -2.22 0.82 0.00 -0.26 0.00 0.00 64.21 62.83 1w0p n SER 648 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1w0p n PRO 649 N -2.67 0.81 -3.75 4.33 -0.04 -1.26 -4.71 135.00 127.71 1w0p n PRO 649 Ca 0.00 0.01 -0.13 0.00 -0.04 0.00 0.00 63.50 63.34 1w0p n PRO 649 Cb 0.34 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.19 1w0p n PRO 649 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1w0p s ARG 650 N -2.10 0.42 -0.00 0.54 3.52 -1.26 -1.42 118.95 118.64 1w0p s ARG 650 Ca 0.40 0.47 0.00 0.00 -0.13 0.00 0.00 55.73 56.47 1w0p s ARG 650 Cb 0.20 0.21 0.00 0.00 -1.56 0.00 0.00 34.95 33.79 1w0p s ARG 650 CO 0.35 -0.05 -0.00 -1.14 -0.81 0.00 0.00 175.30 173.64 1w0p s GLN 651 N 0.13 0.04 0.01 5.12 2.00 -0.51 -1.80 119.66 124.66 1w0p s GLN 651 Ca -0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 55.36 53.34 1w0p s GLN 651 Cb -0.03 -0.07 -0.04 0.00 0.80 0.00 0.00 33.01 33.68 1w0p s GLN 651 CO 0.01 -0.01 0.18 -0.65 -0.50 0.00 0.00 175.29 174.32 1w0p s GLN 652 N 0.10 3.41 0.15 1.67 1.11 -0.65 -1.06 119.66 124.39 1w0p s GLN 652 Ca -0.01 -0.36 0.04 0.00 0.01 0.00 0.00 55.36 55.04 1w0p s GLN 652 Cb -0.02 -3.07 -0.04 0.00 -1.01 0.00 0.00 33.01 28.87 1w0p s GLN 652 CO -0.00 0.66 -0.09 -0.06 0.01 0.00 0.00 175.29 175.81 1w0p s PHE 653 N -1.36 1.23 -0.00 0.91 0.40 0.49 -2.02 117.98 117.63 1w0p s PHE 653 Ca 0.29 -0.80 0.03 0.00 -0.60 0.00 0.00 56.93 55.85 1w0p s PHE 653 Cb -0.13 -0.64 -0.01 0.00 0.51 0.00 0.00 43.02 42.75 1w0p s PHE 653 CO 0.20 0.03 -0.11 -1.17 0.70 0.00 0.00 175.22 174.87 1w0p s LEU 654 N -3.16 2.04 -0.08 -0.37 2.96 -0.05 -0.93 118.68 119.10 1w0p s LEU 654 Ca 0.17 -0.23 0.04 0.00 -0.22 0.00 0.00 54.13 53.89 1w0p s LEU 654 Cb 0.03 -0.54 0.00 0.00 0.50 0.00 0.00 46.19 46.18 1w0p s LEU 654 CO 0.00 0.11 -0.20 -0.55 -1.32 0.00 0.00 176.35 174.39 1w0p s SER 655 N -0.39 2.64 0.00 3.68 0.15 -0.26 -0.91 113.70 118.62 1w0p s SER 655 Ca 0.03 -0.46 0.12 0.00 0.70 0.00 0.00 55.95 56.34 1w0p s SER 655 Cb -0.05 -1.07 0.29 0.00 -1.71 0.00 0.00 66.02 63.48 1w0p s SER 655 CO -0.00 0.14 1.20 0.29 1.20 0.00 0.00 173.24 176.07 1w0p n LYS 656 N 3.45 2.41 -1.50 5.44 5.02 -1.26 -1.13 118.16 130.59 1w0p n LYS 656 Ca -0.20 -1.92 -0.03 0.00 -2.02 0.00 0.00 58.31 54.14 1w0p n LYS 656 Cb 0.53 -1.28 0.10 0.00 -0.02 0.00 0.00 35.03 34.35 1w0p n LYS 656 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1w0p n ASP 657 N 0.63 2.34 -0.08 4.39 5.68 -1.26 -4.80 116.55 123.45 1w0p n ASP 657 Ca 0.12 -3.16 -0.01 0.00 -0.50 0.00 0.00 54.79 51.24 1w0p n ASP 657 Cb 0.41 -0.42 -0.00 0.00 -1.14 0.00 0.00 41.12 39.97 1w0p n ASP 657 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1w0p n GLY 658 N -0.58 0.49 0.39 6.12 0.00 -1.26 -3.72 105.19 106.63 1w0p n GLY 658 Ca 0.21 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1w0p n GLY 658 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w0p n GLY 659 N -2.79 0.79 0.09 -0.02 0.00 -1.26 -4.98 105.19 97.02 1w0p n GLY 659 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 1w0p n GLY 659 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1w0p h ILE 660 N 0.00 1.54 -3.28 -0.61 1.08 -1.95 -3.41 117.51 110.89 1w0p h ILE 660 Ca 0.00 -1.84 -0.47 0.00 -0.39 0.00 0.00 64.86 62.16 1w0p h ILE 660 Cb 0.00 2.71 -0.17 0.00 -3.07 0.00 0.00 36.82 36.29 1w0p h ILE 660 CO 0.00 0.50 -0.76 0.42 -0.69 0.00 0.00 178.15 177.62 1w0p s THR 661 N -3.25 1.63 0.26 -0.27 -4.23 -1.26 -0.59 115.64 107.93 1w0p s THR 661 Ca -0.16 -1.94 0.04 0.00 -1.18 0.00 0.00 61.69 58.45 1w0p s THR 661 Cb 0.01 -1.80 -0.06 0.00 1.34 0.00 0.00 72.50 71.99 1w0p s THR 661 CO 0.73 -0.43 0.02 0.26 -0.54 0.00 0.00 174.62 174.65 1w0p s TRP 662 N -2.34 1.70 -0.01 3.99 0.52 -1.26 -4.27 118.94 117.26 1w0p s TRP 662 Ca 0.15 -0.93 0.01 0.00 0.02 0.00 0.00 56.10 55.35 1w0p s TRP 662 Cb -0.04 -1.02 0.01 0.00 -1.15 0.00 0.00 33.47 31.27 1w0p s TRP 662 CO 0.05 -0.03 -0.02 0.45 0.02 0.00 0.00 176.95 177.43 1w0p s SER 663 N -3.36 0.38 -0.07 2.95 0.15 -0.09 -4.54 113.70 109.12 1w0p s SER 663 Ca 0.31 -0.05 -0.30 0.00 0.70 0.00 0.00 55.95 56.62 1w0p s SER 663 Cb 0.06 -0.10 -0.02 0.00 -1.71 0.00 0.00 66.02 64.25 1w0p s SER 663 CO 0.11 -0.00 1.11 -0.22 1.20 0.00 0.00 173.24 175.44 1w0p s LEU 664 N 0.26 4.27 -0.55 3.45 0.20 -1.26 -0.87 118.68 124.18 1w0p s LEU 664 Ca -0.02 1.69 -0.27 0.00 0.69 0.00 0.00 54.13 56.22 1w0p s LEU 664 Cb -0.05 -3.56 0.03 0.00 -0.43 0.00 0.00 46.19 42.18 1w0p s LEU 664 CO -0.01 -0.52 1.09 -0.76 -0.29 0.00 0.00 176.35 175.87 1w0p s LEU 665 N 2.08 3.71 0.23 -0.68 1.43 -0.86 -4.95 118.68 119.64 1w0p s LEU 665 Ca 0.53 0.01 -0.32 0.00 -1.03 0.00 0.00 54.13 53.32 1w0p s LEU 665 Cb -0.22 -3.11 -0.13 0.00 0.03 0.00 0.00 46.19 42.76 1w0p s LEU 665 CO 0.20 -1.34 1.56 1.21 0.23 0.00 0.00 176.35 178.22 1w0p n GLU 666 N 7.97 2.40 -1.03 1.70 2.13 -1.26 -1.86 120.64 130.70 1w0p n GLU 666 Ca 0.07 0.86 -0.01 0.00 0.66 0.00 0.00 57.16 58.74 1w0p n GLU 666 Cb 0.49 -2.62 -0.00 0.00 0.27 0.00 0.00 31.44 29.57 1w0p n GLU 666 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1w0p n ALA 667 N 2.71 -0.01 -3.65 4.31 0.00 -1.26 -4.92 120.51 117.68 1w0p n ALA 667 Ca 0.13 0.02 -0.36 0.00 0.00 0.00 0.00 53.44 53.22 1w0p n ALA 667 Cb 0.33 -1.08 -0.07 0.00 0.00 0.00 0.00 19.45 18.63 1w0p n ALA 667 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1w0p s ASN 668 N -2.05 5.90 0.00 0.00 3.04 -0.78 -4.79 114.94 116.27 1w0p s ASN 668 Ca 0.00 -3.65 0.00 0.00 0.04 0.00 0.00 52.86 49.25 1w0p s ASN 668 Cb 0.00 -1.90 0.00 0.00 -1.54 0.00 0.00 41.25 37.81 1w0p s ASN 668 CO 0.00 -0.20 0.00 -0.46 -3.04 0.00 0.00 177.10 173.40 1w0p n ASN 669 N 2.42 0.00 0.20 -4.21 0.23 -1.26 -1.64 115.26 111.01 1w0p n ASN 669 Ca 0.20 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.37 1w0p n ASN 669 Cb 0.37 0.00 0.68 0.00 -2.08 0.00 0.00 39.78 38.75 1w0p n ASN 669 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1w0p h ALA 670 N 1.00 2.06 0.00 -2.53 0.00 -1.61 -2.57 119.26 115.62 1w0p h ALA 670 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1w0p h ALA 670 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1w0p h ALA 670 CO 0.00 -0.16 0.00 -0.91 0.00 0.00 0.00 179.25 178.18 1w0p h ASN 671 N 0.00 0.00 1.40 0.00 2.35 -1.91 -1.86 115.58 115.55 1w0p h ASN 671 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1w0p h ASN 671 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1w0p h ASN 671 CO -0.00 0.00 0.00 1.62 -1.65 0.00 0.00 177.43 177.40 1w0p h VAL 672 N 0.00 0.00 -3.58 2.81 3.04 -1.76 -3.39 116.25 113.37 1w0p h VAL 672 Ca 0.00 -0.48 -0.76 0.00 -1.01 0.00 0.00 66.70 64.46 1w0p h VAL 672 Cb 0.10 1.44 -0.28 0.00 -2.01 0.00 0.00 31.29 30.54 1w0p h VAL 672 CO 0.00 0.00 -0.12 -0.36 -1.01 0.00 0.00 177.57 176.08 1w0p s PHE 673 N -3.15 3.56 0.24 3.17 0.08 -0.70 -4.11 117.98 117.07 1w0p s PHE 673 Ca 0.09 -2.03 -0.31 0.00 0.12 0.00 0.00 56.93 54.80 1w0p s PHE 673 Cb 0.11 -3.64 -0.13 0.00 -0.57 0.00 0.00 43.02 38.79 1w0p s PHE 673 CO 0.57 -0.96 1.41 0.43 -0.10 0.00 0.00 175.22 176.57 1w0p n SER 674 N 4.20 2.76 -1.28 1.36 7.64 -1.26 -2.25 113.62 124.79 1w0p n SER 674 Ca 0.05 1.14 -0.16 0.00 1.01 0.00 0.00 58.87 60.91 1w0p n SER 674 Cb 0.43 -1.43 -0.06 0.00 -1.01 0.00 0.00 64.21 62.14 1w0p n SER 674 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1w0p n ASN 675 N 2.18 -4.93 -4.81 6.43 3.02 -1.26 -4.31 115.26 111.59 1w0p n ASN 675 Ca 0.12 0.37 -0.33 0.00 -0.03 0.00 0.00 54.58 54.71 1w0p n ASN 675 Cb 0.31 -3.86 -0.01 0.00 -0.61 0.00 0.00 39.78 35.62 1w0p n ASN 675 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1w0p s ILE 676 N -2.61 3.89 0.61 2.41 2.07 -0.95 -2.89 121.20 123.72 1w0p s ILE 676 Ca 0.00 0.97 -0.19 0.00 -1.41 0.00 0.00 60.65 60.02 1w0p s ILE 676 Cb 0.00 -3.44 -0.03 0.00 0.13 0.00 0.00 42.46 39.12 1w0p s ILE 676 CO 0.00 -0.46 1.28 -0.55 -1.91 0.00 0.00 174.94 173.30 1w0p s SER 677 N -2.61 4.95 0.00 4.50 0.15 -0.61 -3.96 113.70 116.12 1w0p s SER 677 Ca 0.64 2.58 0.25 0.00 0.70 0.00 0.00 55.95 60.12 1w0p s SER 677 Cb -0.15 -2.62 0.81 0.00 -1.71 0.00 0.00 66.02 62.35 1w0p s SER 677 CO 0.32 -1.77 1.60 0.35 1.20 0.00 0.00 173.24 174.94 1w0p n THR 678 N -1.59 0.10 -3.75 6.45 -2.24 -0.91 -4.90 114.28 107.44 1w0p n THR 678 Ca 0.14 -0.34 -0.35 0.00 -2.27 0.00 0.00 64.05 61.23 1w0p n THR 678 Cb 0.48 0.61 -0.05 0.00 -2.10 0.00 0.00 70.33 69.27 1w0p n THR 678 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1w0p s GLY 679 N -1.84 2.26 0.23 3.38 0.00 -1.26 -4.82 107.32 105.27 1w0p s GLY 679 Ca 0.35 -0.56 -0.30 0.00 0.00 0.00 0.00 44.72 44.21 1w0p s GLY 679 CO 0.31 -0.35 1.44 -0.51 0.00 0.00 0.00 173.10 173.98 1w0p s THR 680 N -1.27 2.73 -0.00 0.90 -4.23 -1.26 -4.93 115.64 107.58 1w0p s THR 680 Ca 0.26 0.60 -0.29 0.00 -1.18 0.00 0.00 61.69 61.09 1w0p s THR 680 Cb -0.13 -3.38 0.10 0.00 1.34 0.00 0.00 72.50 70.43 1w0p s THR 680 CO 0.15 0.09 0.89 0.54 -0.54 0.00 0.00 174.62 175.74 1w0p s VAL 681 N 0.16 0.00 0.37 2.29 0.11 -1.26 -5.09 120.40 116.99 1w0p s VAL 681 Ca 0.60 -0.01 -0.25 0.00 -2.93 0.00 0.00 61.98 59.40 1w0p s VAL 681 Cb -0.41 -1.02 -0.09 0.00 -1.53 0.00 0.00 36.38 33.32 1w0p s VAL 681 CO 0.41 0.00 1.01 -0.62 -3.33 0.00 0.00 175.10 172.57 1w0p s ASP 682 N -2.49 6.99 0.24 3.54 2.15 -1.26 -4.83 116.67 121.00 1w0p s ASP 682 Ca 0.05 1.95 0.01 0.00 0.43 0.00 0.00 52.55 54.99 1w0p s ASP 682 Cb -0.01 -2.58 -0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1w0p s ASP 682 CO -0.09 -0.33 0.03 0.00 -0.17 0.00 0.00 175.17 174.61 1w0p n ALA 683 N 0.13 0.25 -3.07 3.66 0.00 -1.26 -4.28 120.51 115.94 1w0p n ALA 683 Ca 0.04 -1.12 -0.11 0.00 0.00 0.00 0.00 53.44 52.26 1w0p n ALA 683 Cb 0.50 0.66 -0.10 0.00 0.00 0.00 0.00 19.45 20.51 1w0p n ALA 683 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1w0p s SER 684 N -2.36 0.07 -0.03 0.00 0.15 -1.02 -4.78 113.70 105.73 1w0p s SER 684 Ca 0.04 -0.25 -0.05 0.00 0.70 0.00 0.00 55.95 56.38 1w0p s SER 684 Cb 0.00 0.18 0.01 0.00 -1.71 0.00 0.00 66.02 64.50 1w0p s SER 684 CO 0.03 -0.33 0.13 -0.51 1.20 0.00 0.00 173.24 173.76 1w0p s ILE 685 N -1.30 0.03 0.14 6.45 2.07 -1.26 -1.72 121.20 125.61 1w0p s ILE 685 Ca -0.14 -0.28 -0.24 0.00 -1.41 0.00 0.00 60.65 58.58 1w0p s ILE 685 Cb -0.08 -0.29 0.07 0.00 0.13 0.00 0.00 42.46 42.30 1w0p s ILE 685 CO 0.01 -0.15 0.67 0.28 -1.91 0.00 0.00 174.94 173.83 1w0p s THR 686 N -0.50 0.00 0.08 4.00 -1.32 -0.49 -4.77 115.64 112.64 1w0p s THR 686 Ca -0.06 -0.10 -0.14 0.00 -1.21 0.00 0.00 61.69 60.18 1w0p s THR 686 Cb -0.04 -1.11 -0.06 0.00 -1.51 0.00 0.00 72.50 69.78 1w0p s THR 686 CO 0.01 0.00 0.47 -0.60 -2.21 0.00 0.00 174.62 172.28 1w0p s ARG 687 N -3.64 3.92 -0.11 7.08 3.52 -1.26 -1.03 118.95 127.43 1w0p s ARG 687 Ca 0.03 0.40 0.01 0.00 -0.13 0.00 0.00 55.73 56.04 1w0p s ARG 687 Cb -0.01 -3.06 0.02 0.00 -1.56 0.00 0.00 34.95 30.33 1w0p s ARG 687 CO -0.10 0.58 -0.13 0.12 -0.81 0.00 0.00 175.30 174.95 1w0p s PHE 688 N -1.30 1.83 -0.13 5.12 5.36 -0.10 -4.55 117.98 124.20 1w0p s PHE 688 Ca 0.32 -0.87 0.02 0.00 -0.96 0.00 0.00 56.93 55.43 1w0p s PHE 688 Cb -0.16 -1.36 0.00 0.00 -0.34 0.00 0.00 43.02 41.17 1w0p s PHE 688 CO 0.17 -0.48 -0.20 -2.00 -1.46 0.00 0.00 175.22 171.26 1w0p s GLU 689 N 1.14 3.12 0.71 10.12 2.12 -1.26 -1.60 118.70 133.05 1w0p s GLU 689 Ca -0.04 -0.81 -0.06 0.00 0.36 0.00 0.00 54.97 54.42 1w0p s GLU 689 Cb -0.14 -2.48 0.08 0.00 0.26 0.00 0.00 34.13 31.85 1w0p s GLU 689 CO -0.03 0.07 1.01 -0.65 -0.54 0.00 0.00 175.26 175.12 1w0p s GLN 690 N 0.64 2.04 0.22 4.30 -0.21 -0.15 -4.69 119.66 121.81 1w0p s GLN 690 Ca -0.10 -0.41 -0.08 0.00 0.02 0.00 0.00 55.36 54.79 1w0p s GLN 690 Cb -0.16 -2.19 0.18 0.00 1.00 0.00 0.00 33.01 31.83 1w0p s GLN 690 CO 0.02 -1.31 1.82 0.66 -2.12 0.00 0.00 175.29 174.37 1w0p h SER 691 N -0.61 1.07 0.20 5.90 4.64 -1.87 -2.25 113.55 120.62 1w0p h SER 691 Ca -0.43 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 1w0p h SER 691 Cb 1.30 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1w0p h SER 691 CO 0.55 0.89 0.00 -0.90 -0.87 0.00 0.00 176.83 176.50 1w0p n ASP 692 N -4.35 0.00 0.00 4.97 5.68 -1.26 -4.82 116.55 116.77 1w0p n ASP 692 Ca 0.08 0.26 0.00 0.00 -0.50 0.00 0.00 54.79 54.63 1w0p n ASP 692 Cb 0.12 -0.35 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 1w0p n ASP 692 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1w0p n GLY 693 N -0.56 2.78 3.68 6.12 0.00 -0.85 -5.07 105.19 111.29 1w0p n GLY 693 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1w0p n GLY 693 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1w0p s SER 694 N -1.30 3.10 0.18 1.61 1.04 -1.26 -4.73 113.70 112.35 1w0p s SER 694 Ca 0.00 1.91 -0.16 0.00 0.48 0.00 0.00 55.95 58.19 1w0p s SER 694 Cb 0.00 -2.47 0.02 0.00 0.10 0.00 0.00 66.02 63.68 1w0p s SER 694 CO 0.00 -2.94 0.47 -1.38 0.98 0.00 0.00 173.24 170.37 1w0p s HIS 695 N -2.73 -0.03 0.23 5.02 -3.43 -1.26 -0.97 115.29 112.12 1w0p s HIS 695 Ca 0.65 -0.32 -0.22 0.00 -0.80 0.00 0.00 55.06 54.38 1w0p s HIS 695 Cb -0.21 0.30 0.06 0.00 -1.43 0.00 0.00 32.58 31.30 1w0p s HIS 695 CO 0.58 -0.87 0.90 -0.59 -2.00 0.00 0.00 174.74 172.77 1w0p s PHE 696 N -3.89 -0.04 0.08 0.38 -0.12 -0.63 -4.94 117.98 108.82 1w0p s PHE 696 Ca 0.10 -0.40 0.03 0.00 -0.05 0.00 0.00 56.93 56.62 1w0p s PHE 696 Cb 0.00 0.71 -0.04 0.00 -0.63 0.00 0.00 43.02 43.06 1w0p s PHE 696 CO -0.03 -1.08 0.07 -0.51 -0.05 0.00 0.00 175.22 173.62 1w0p s LEU 697 N -3.08 3.77 0.02 -1.99 1.43 -0.58 -0.92 118.68 117.34 1w0p s LEU 697 Ca 0.15 -0.02 0.07 0.00 -1.03 0.00 0.00 54.13 53.30 1w0p s LEU 697 Cb -0.03 -2.44 -0.02 0.00 0.03 0.00 0.00 46.19 43.72 1w0p s LEU 697 CO 0.06 0.18 -0.22 -0.76 0.23 0.00 0.00 176.35 175.83 1w0p s LEU 698 N -2.35 2.13 -0.03 1.79 1.43 -0.19 -1.54 118.68 119.91 1w0p s LEU 698 Ca 0.29 -0.49 -0.02 0.00 -1.03 0.00 0.00 54.13 52.88 1w0p s LEU 698 Cb -0.12 -1.08 0.02 0.00 0.03 0.00 0.00 46.19 45.04 1w0p s LEU 698 CO 0.21 0.21 0.07 0.12 0.23 0.00 0.00 176.35 177.20 1w0p s PHE 699 N -0.71 -0.06 0.03 0.29 5.36 -0.57 -1.40 117.98 120.93 1w0p s PHE 699 Ca 0.09 0.23 0.08 0.00 -0.96 0.00 0.00 56.93 56.36 1w0p s PHE 699 Cb -0.09 -0.09 -0.02 0.00 -0.34 0.00 0.00 43.02 42.48 1w0p s PHE 699 CO 0.01 -0.08 -0.23 0.95 -1.46 0.00 0.00 175.22 174.41 1w0p s THR 700 N 0.66 1.85 -0.20 0.12 -4.23 -0.70 -0.82 115.64 112.33 1w0p s THR 700 Ca -0.05 -1.22 -0.32 0.00 -1.18 0.00 0.00 61.69 58.92 1w0p s THR 700 Cb -0.07 -1.58 0.15 0.00 1.34 0.00 0.00 72.50 72.33 1w0p s THR 700 CO -0.02 0.32 1.17 0.21 -0.54 0.00 0.00 174.62 175.75 1w0p s ASN 701 N -1.08 -0.19 0.65 3.99 2.47 -1.13 -2.42 114.94 117.24 1w0p s ASN 701 Ca 0.09 0.12 -0.17 0.00 0.42 0.00 0.00 52.86 53.33 1w0p s ASN 701 Cb -0.09 0.17 -0.00 0.00 -1.45 0.00 0.00 41.25 39.88 1w0p s ASN 701 CO 0.01 -0.23 1.18 -2.84 -3.72 0.00 0.00 177.10 171.50 1w0p s PRO 702 N -1.71 2.69 -0.07 0.43 0.02 -1.26 -0.56 135.00 134.54 1w0p s PRO 702 Ca 0.06 1.68 0.19 0.00 0.02 0.00 0.00 61.00 62.95 1w0p s PRO 702 Cb -0.01 -1.91 -0.26 0.00 0.02 0.00 0.00 34.50 32.35 1w0p s PRO 702 CO -0.04 -1.39 0.40 1.04 -0.33 0.00 0.00 177.00 176.68 1w0p n GLN 703 N -2.14 0.66 0.00 5.54 6.02 -0.47 -1.57 117.38 125.41 1w0p n GLN 703 Ca 0.13 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1w0p n GLN 703 Cb 0.50 -1.58 0.00 0.00 1.02 0.00 0.00 30.24 30.18 1w0p n GLN 703 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1w0p n GLY 704 N 1.48 -0.07 2.74 1.08 0.00 -0.33 -0.43 105.19 109.65 1w0p n GLY 704 Ca -0.16 -1.78 -0.19 0.00 0.00 0.00 0.00 46.02 43.89 1w0p n GLY 704 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1w0p s ASN 705 N -2.13 1.59 0.87 1.61 3.04 -1.26 -3.12 114.94 115.54 1w0p s ASN 705 Ca 0.00 -0.40 -0.12 0.00 0.04 0.00 0.00 52.86 52.38 1w0p s ASN 705 Cb 0.00 0.36 0.11 0.00 -1.54 0.00 0.00 41.25 40.18 1w0p s ASN 705 CO 0.00 -0.35 1.11 -2.65 -3.04 0.00 0.00 177.10 172.17 1w0p n PRO 706 N 5.31 -0.18 -1.75 0.43 -0.02 -1.26 -4.98 135.00 132.56 1w0p n PRO 706 Ca -0.05 0.02 -0.42 0.00 -2.02 0.00 0.00 63.50 61.04 1w0p n PRO 706 Cb 0.48 -2.36 -0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1w0p n PRO 706 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1w0p n ALA 707 N -3.79 2.10 -0.61 3.55 0.00 -1.18 -2.22 120.51 118.36 1w0p n ALA 707 Ca 0.12 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1w0p n ALA 707 Cb 0.51 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1w0p n ALA 707 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w0p n GLY 708 N 0.71 0.72 3.84 0.00 0.00 0.43 -4.98 105.19 105.91 1w0p n GLY 708 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 1w0p n GLY 708 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1w0p s THR 709 N -2.32 1.89 -0.34 2.61 -4.23 -0.94 -4.48 115.64 107.84 1w0p s THR 709 Ca 0.00 -1.60 -0.26 0.00 -1.18 0.00 0.00 61.69 58.65 1w0p s THR 709 Cb 0.00 -2.49 0.01 0.00 1.34 0.00 0.00 72.50 71.36 1w0p s THR 709 CO 0.00 0.00 0.94 0.21 -0.54 0.00 0.00 174.62 175.23 1w0p s ASN 710 N -4.10 6.76 0.00 3.99 3.84 -1.26 -2.14 114.94 122.03 1w0p s ASN 710 Ca 0.34 0.76 0.00 0.00 0.21 0.00 0.00 52.86 54.17 1w0p s ASN 710 Cb -0.00 -2.48 0.00 0.00 -0.55 0.00 0.00 41.25 38.22 1w0p s ASN 710 CO 0.20 -0.80 0.00 0.61 -2.79 0.00 0.00 177.10 174.32 1w0p n GLY 711 N 4.16 2.79 3.06 1.21 0.00 -1.26 -4.82 105.19 110.32 1w0p n GLY 711 Ca 0.08 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 1w0p n GLY 711 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w0p n ARG 712 N -0.57 3.43 -4.09 1.61 1.74 -1.26 -3.50 116.66 114.03 1w0p n ARG 712 Ca 0.00 -3.48 -0.10 0.00 -0.77 0.00 0.00 57.85 53.49 1w0p n ARG 712 Cb 0.00 -3.04 -0.11 0.00 -1.02 0.00 0.00 32.46 28.29 1w0p n ARG 712 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1w0p s GLN 713 N 1.31 0.60 -0.50 5.56 -1.52 -1.19 -1.22 119.66 122.70 1w0p s GLN 713 Ca 0.42 -0.99 -0.26 0.00 -1.95 0.00 0.00 55.36 52.59 1w0p s GLN 713 Cb 0.06 -0.10 0.04 0.00 -0.22 0.00 0.00 33.01 32.79 1w0p s GLN 713 CO -0.00 -0.02 0.64 0.09 -0.25 0.00 0.00 175.29 175.75 1w0p n ASN 714 N 0.79 -6.37 -4.68 5.90 3.02 0.76 -1.19 115.26 113.49 1w0p n ASN 714 Ca -0.18 -0.01 -0.44 0.00 -0.03 0.00 0.00 54.58 53.91 1w0p n ASN 714 Cb 0.58 -3.09 -0.03 0.00 -0.61 0.00 0.00 39.78 36.63 1w0p n ASN 714 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1w0p n LEU 715 N -0.56 3.33 -4.56 3.41 7.94 -1.23 -1.37 117.00 123.94 1w0p n LEU 715 Ca -0.04 1.13 -0.24 0.00 -1.11 0.00 0.00 56.01 55.75 1w0p n LEU 715 Cb 0.60 -1.46 -0.09 0.00 0.53 0.00 0.00 43.42 43.00 1w0p n LEU 715 CO 0.54 -0.34 -0.38 -0.83 -1.11 0.00 0.00 177.39 175.27 1w0p s GLY 716 N 0.44 1.94 -0.13 -3.96 0.00 0.28 -0.78 107.32 105.11 1w0p s GLY 716 Ca 0.69 -1.89 0.01 0.00 0.00 0.00 0.00 44.72 43.54 1w0p s GLY 716 CO 0.47 -1.91 -0.16 -2.27 0.00 0.00 0.00 173.10 169.23 1w0p s LEU 717 N -3.62 1.81 0.12 0.66 2.96 -0.08 -2.82 118.68 117.71 1w0p s LEU 717 Ca 0.32 -0.50 0.07 0.00 -0.22 0.00 0.00 54.13 53.80 1w0p s LEU 717 Cb -0.03 -1.22 -0.04 0.00 0.50 0.00 0.00 46.19 45.40 1w0p s LEU 717 CO 0.18 -0.00 -0.05 0.26 -1.32 0.00 0.00 176.35 175.41 1w0p s TRP 718 N 1.17 2.83 0.04 5.38 0.51 -0.00 -1.27 118.94 127.60 1w0p s TRP 718 Ca -0.01 -0.12 0.08 0.00 -2.12 0.00 0.00 56.10 53.92 1w0p s TRP 718 Cb -0.14 -1.44 -0.03 0.00 -0.81 0.00 0.00 33.47 31.05 1w0p s TRP 718 CO -0.06 0.46 -0.22 -0.06 -0.51 0.00 0.00 176.95 176.57 1w0p s PHE 719 N -1.37 1.92 -0.13 -1.98 0.40 -1.22 -1.50 117.98 114.09 1w0p s PHE 719 Ca 0.24 -0.38 -0.00 0.00 -0.60 0.00 0.00 56.93 56.18 1w0p s PHE 719 Cb -0.11 -1.14 0.03 0.00 0.51 0.00 0.00 43.02 42.31 1w0p s PHE 719 CO 0.16 0.10 -0.08 0.45 0.70 0.00 0.00 175.22 176.55 1w0p s SER 720 N -1.20 2.37 0.00 1.36 0.15 -0.59 -0.12 113.70 115.67 1w0p s SER 720 Ca 0.08 -0.39 0.20 0.00 0.70 0.00 0.00 55.95 56.54 1w0p s SER 720 Cb -0.09 -0.90 0.47 0.00 -1.71 0.00 0.00 66.02 63.79 1w0p s SER 720 CO 0.02 -0.12 1.40 0.49 1.20 0.00 0.00 173.24 176.22 1w0p n PHE 721 N 4.91 0.66 -2.48 3.44 3.72 -1.26 -1.52 117.46 124.92 1w0p n PHE 721 Ca -0.13 -0.39 -0.08 0.00 -0.05 0.00 0.00 57.45 56.80 1w0p n PHE 721 Cb 0.50 -0.01 0.04 0.00 -0.94 0.00 0.00 39.48 39.07 1w0p n PHE 721 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1w0p n ASP 722 N 1.31 2.78 -2.46 4.37 5.68 -1.26 -4.99 116.55 121.97 1w0p n ASP 722 Ca 0.19 -2.72 -0.18 0.00 -0.50 0.00 0.00 54.79 51.58 1w0p n ASP 722 Cb 0.56 -0.42 0.03 0.00 -1.14 0.00 0.00 41.12 40.14 1w0p n ASP 722 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1w0p n GLU 723 N -0.60 -3.75 -0.72 0.11 4.07 -1.26 -3.10 120.64 115.39 1w0p n GLU 723 Ca 0.21 0.77 0.00 0.00 -0.06 0.00 0.00 57.16 58.08 1w0p n GLU 723 Cb 0.88 -5.30 0.00 0.00 -0.06 0.00 0.00 31.44 26.96 1w0p n GLU 723 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1w0p n GLY 724 N -1.35 0.68 0.14 8.31 0.00 -1.26 -4.94 105.19 106.77 1w0p n GLY 724 Ca -0.11 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.74 1w0p n GLY 724 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1w0p h VAL 725 N 0.00 1.44 -3.99 1.61 2.07 -1.96 -3.47 116.25 111.96 1w0p h VAL 725 Ca 0.00 -2.08 -0.20 0.00 0.82 0.00 0.00 66.70 65.25 1w0p h VAL 725 Cb 0.00 2.63 -0.15 0.00 -1.52 0.00 0.00 31.29 32.25 1w0p h VAL 725 CO 0.00 0.60 -0.68 0.42 0.02 0.00 0.00 177.57 177.93 1w0p s THR 726 N -3.18 0.50 0.01 2.57 -4.23 -1.26 -5.06 115.64 104.99 1w0p s THR 726 Ca -0.13 -1.90 0.04 0.00 -1.18 0.00 0.00 61.69 58.51 1w0p s THR 726 Cb 0.03 -1.71 -0.01 0.00 1.34 0.00 0.00 72.50 72.15 1w0p s THR 726 CO 0.81 -0.84 -0.12 0.26 -0.54 0.00 0.00 174.62 174.19 1w0p s TRP 727 N -3.75 1.07 -0.17 3.99 0.52 -1.26 -4.37 118.94 114.96 1w0p s TRP 727 Ca 0.13 -0.27 -0.18 0.00 0.02 0.00 0.00 56.10 55.79 1w0p s TRP 727 Cb 0.06 -0.66 -0.04 0.00 -1.15 0.00 0.00 33.47 31.69 1w0p s TRP 727 CO -0.05 0.00 0.50 0.15 0.02 0.00 0.00 176.95 177.57 1w0p s LYS 728 N -0.70 4.24 0.00 4.98 -0.14 0.83 -4.81 119.74 124.14 1w0p s LYS 728 Ca 0.02 0.42 0.00 0.00 -1.36 0.00 0.00 55.97 55.05 1w0p s LYS 728 Cb -0.06 -3.52 0.00 0.00 -1.68 0.00 0.00 37.83 32.57 1w0p s LYS 728 CO 0.00 -0.05 0.00 0.41 -0.76 0.00 0.00 175.35 174.96 1w0p n GLY 729 N 3.69 0.00 3.81 -3.33 0.00 -1.26 -3.46 105.19 104.64 1w0p n GLY 729 Ca -0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 1w0p n GLY 729 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1w0p s PRO 730 N 0.00 4.23 -0.22 1.61 0.04 -1.26 -4.68 135.00 134.72 1w0p s PRO 730 Ca 0.00 1.16 -0.08 0.00 0.04 0.00 0.00 61.00 62.12 1w0p s PRO 730 Cb 0.00 -2.23 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 1w0p s PRO 730 CO 0.00 -0.04 0.09 0.42 0.04 0.00 0.00 177.00 177.52 1w0p s ILE 731 N -2.10 4.74 -0.02 0.56 1.01 -0.40 -4.84 121.20 120.15 1w0p s ILE 731 Ca 0.61 -0.04 -0.30 0.00 0.00 0.00 0.00 60.65 60.93 1w0p s ILE 731 Cb -0.11 -3.19 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1w0p s ILE 731 CO 0.15 0.38 1.29 -1.58 0.00 0.00 0.00 174.94 175.17 1w0p s GLN 732 N 1.07 4.33 -0.09 2.79 0.74 -1.26 -0.90 119.66 126.33 1w0p s GLN 732 Ca 0.05 1.81 0.17 0.00 0.05 0.00 0.00 55.36 57.44 1w0p s GLN 732 Cb -0.14 -3.55 -0.26 0.00 1.10 0.00 0.00 33.01 30.17 1w0p s GLN 732 CO 0.04 -0.49 0.25 1.28 -0.55 0.00 0.00 175.29 175.81 1w0p n LEU 733 N 5.19 0.00 -4.03 3.68 4.77 0.04 -4.69 117.00 121.96 1w0p n LEU 733 Ca 0.12 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.91 1w0p n LEU 733 Cb 0.45 0.19 -0.15 0.00 -2.33 0.00 0.00 43.42 41.59 1w0p n LEU 733 CO 0.57 0.19 -0.43 -0.69 -1.33 0.00 0.00 177.39 175.70 1w0p s VAL 734 N -2.90 0.73 -0.61 4.08 1.01 -1.14 -4.69 120.40 116.89 1w0p s VAL 734 Ca -0.08 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.46 1w0p s VAL 734 Cb 0.09 -0.62 0.15 0.00 0.00 0.00 0.00 36.38 36.00 1w0p s VAL 734 CO 0.75 0.18 0.40 0.21 0.00 0.00 0.00 175.10 176.63 1w0p s ASN 735 N -0.29 4.97 0.00 3.32 2.47 -1.26 -3.55 114.94 120.60 1w0p s ASN 735 Ca 0.03 -2.95 0.00 0.00 0.42 0.00 0.00 52.86 50.36 1w0p s ASN 735 Cb -0.04 -1.79 0.00 0.00 -1.45 0.00 0.00 41.25 37.97 1w0p s ASN 735 CO -0.00 -0.32 0.00 0.61 -3.72 0.00 0.00 177.10 173.67 1w0p n GLY 736 N 3.30 0.61 3.65 1.21 0.00 -1.26 -4.95 105.19 107.75 1w0p n GLY 736 Ca 0.08 -1.65 -0.46 0.00 0.00 0.00 0.00 46.02 43.99 1w0p n GLY 736 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w0p n ALA 737 N -0.77 0.66 -3.41 4.61 0.00 -1.26 -0.17 120.51 120.16 1w0p n ALA 737 Ca 0.00 0.43 -0.05 0.00 0.00 0.00 0.00 53.44 53.82 1w0p n ALA 737 Cb 0.00 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.17 1w0p n ALA 737 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1w0p s SER 738 N 0.29 -0.44 0.00 0.00 0.01 -0.36 -4.40 113.70 108.80 1w0p s SER 738 Ca 0.71 0.74 0.00 0.00 1.31 0.00 0.00 55.95 58.70 1w0p s SER 738 Cb -0.71 1.57 0.00 0.00 0.21 0.00 0.00 66.02 67.09 1w0p s SER 738 CO 0.49 -0.26 0.00 0.00 0.41 0.00 0.00 173.24 173.88 1w0p n ALA 739 N 5.40 0.00 -1.76 1.44 0.00 -0.30 -3.15 120.51 122.14 1w0p n ALA 739 Ca -0.05 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.02 1w0p n ALA 739 Cb 0.50 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.97 1w0p n ALA 739 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1w0p s TYR 740 N 2.71 2.53 0.17 0.00 1.51 -1.26 -4.60 117.35 118.40 1w0p s TYR 740 Ca 0.00 1.49 -0.15 0.00 -1.01 0.00 0.00 57.07 57.40 1w0p s TYR 740 Cb 0.00 -3.53 0.02 0.00 -0.11 0.00 0.00 41.96 38.35 1w0p s TYR 740 CO 0.00 -2.14 0.43 -1.54 -1.11 0.00 0.00 175.55 171.18 1w0p s SER 741 N -1.36 -0.17 -0.11 2.29 1.04 -1.26 -0.98 113.70 113.15 1w0p s SER 741 Ca 0.71 -0.54 -0.09 0.00 0.48 0.00 0.00 55.95 56.51 1w0p s SER 741 Cb -0.32 0.51 0.03 0.00 0.10 0.00 0.00 66.02 66.34 1w0p s SER 741 CO 0.37 -0.96 0.29 -0.62 0.98 0.00 0.00 173.24 173.30 1w0p s ASP 742 N -2.88 -0.31 0.02 7.02 2.15 -0.45 -4.21 116.67 118.02 1w0p s ASP 742 Ca 0.09 0.59 0.05 0.00 0.43 0.00 0.00 52.55 53.71 1w0p s ASP 742 Cb 0.01 0.57 -0.02 0.00 -0.30 0.00 0.00 42.92 43.18 1w0p s ASP 742 CO -0.05 -0.11 -0.16 -0.51 -0.17 0.00 0.00 175.17 174.16 1w0p s ILE 743 N 0.38 1.31 -0.05 4.11 2.07 -1.26 -1.29 121.20 126.45 1w0p s ILE 743 Ca -0.02 -0.93 -0.15 0.00 -1.41 0.00 0.00 60.65 58.15 1w0p s ILE 743 Cb -0.04 -1.13 0.03 0.00 0.13 0.00 0.00 42.46 41.45 1w0p s ILE 743 CO -0.02 0.19 0.34 -0.47 -1.91 0.00 0.00 174.94 173.07 1w0p s TYR 744 N -0.65 -0.27 0.07 3.50 6.14 -0.53 -4.68 117.35 120.92 1w0p s TYR 744 Ca 0.05 0.52 -0.31 0.00 0.64 0.00 0.00 57.07 57.98 1w0p s TYR 744 Cb -0.07 0.12 -0.06 0.00 0.42 0.00 0.00 41.96 42.36 1w0p s TYR 744 CO 0.01 -0.34 1.29 -1.14 0.64 0.00 0.00 175.55 176.01 1w0p s GLN 745 N -0.84 4.37 -0.18 4.97 0.74 -1.26 -0.57 119.66 126.89 1w0p s GLN 745 Ca -0.09 1.90 -0.13 0.00 0.05 0.00 0.00 55.36 57.08 1w0p s GLN 745 Cb -0.04 -3.35 -0.21 0.00 1.10 0.00 0.00 33.01 30.51 1w0p s GLN 745 CO 0.03 -0.37 0.19 -0.11 -0.55 0.00 0.00 175.29 174.48 1w0p n LEU 746 N 4.17 2.27 0.00 3.68 7.94 -0.07 -4.66 117.00 130.33 1w0p n LEU 746 Ca 0.10 0.29 -0.05 0.00 -1.11 0.00 0.00 56.01 55.24 1w0p n LEU 746 Cb 0.45 -1.01 0.01 0.00 0.53 0.00 0.00 43.42 43.39 1w0p n LEU 746 CO 0.57 0.59 0.23 -0.90 -1.11 0.00 0.00 177.39 176.77 1w0p n ASP 747 N -3.94 -1.04 0.24 1.96 5.68 -0.99 -4.71 116.55 113.75 1w0p n ASP 747 Ca -0.35 -1.77 0.15 0.00 -0.50 0.00 0.00 54.79 52.31 1w0p n ASP 747 Cb 0.87 1.75 0.79 0.00 -1.14 0.00 0.00 41.12 43.40 1w0p n ASP 747 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1w0p h SER 748 N 0.94 0.00 0.00 -1.12 4.64 -1.97 -3.03 113.55 113.01 1w0p h SER 748 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1w0p h SER 748 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1w0p h SER 748 CO 0.20 0.00 -0.15 -0.62 -0.87 0.00 0.00 176.83 175.39 1w0p n GLU 749 N -2.56 4.94 -4.22 4.77 1.02 -1.26 -4.44 120.64 118.89 1w0p n GLU 749 Ca -0.02 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.95 1w0p n GLU 749 Cb 0.11 -0.51 -0.11 0.00 -0.02 0.00 0.00 31.44 30.91 1w0p n GLU 749 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1w0p s ASN 750 N -0.98 1.82 0.07 1.62 -0.87 -1.14 -1.83 114.94 113.62 1w0p s ASN 750 Ca 0.00 -0.80 0.07 0.00 -1.57 0.00 0.00 52.86 50.56 1w0p s ASN 750 Cb 0.00 -0.05 -0.03 0.00 -0.02 0.00 0.00 41.25 41.16 1w0p s ASN 750 CO 0.00 -0.17 -0.19 0.00 -2.57 0.00 0.00 177.10 174.16 1w0p s ALA 751 N -2.16 1.65 -0.06 0.60 0.00 -0.40 -0.89 121.76 120.50 1w0p s ALA 751 Ca 0.07 -1.09 0.01 0.00 0.00 0.00 0.00 51.96 50.96 1w0p s ALA 751 Cb -0.05 -0.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.78 1w0p s ALA 751 CO 0.02 0.34 -0.06 -1.50 0.00 0.00 0.00 175.76 174.56 1w0p s ILE 752 N -0.97 3.77 -0.04 0.00 2.07 0.26 -0.96 121.20 125.33 1w0p s ILE 752 Ca 0.06 -0.50 0.04 0.00 -1.41 0.00 0.00 60.65 58.83 1w0p s ILE 752 Cb -0.09 -2.56 0.00 0.00 0.13 0.00 0.00 42.46 39.94 1w0p s ILE 752 CO 0.03 0.56 -0.15 -0.69 -1.91 0.00 0.00 174.94 172.78 1w0p s VAL 753 N -0.85 1.28 -0.11 4.00 1.01 0.32 -1.45 120.40 124.59 1w0p s VAL 753 Ca 0.13 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.51 1w0p s VAL 753 Cb -0.11 -1.11 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 1w0p s VAL 753 CO 0.03 0.38 -0.17 -0.51 0.00 0.00 0.00 175.10 174.82 1w0p s ILE 754 N 0.16 2.72 -0.06 2.22 2.07 -0.42 -0.64 121.20 127.26 1w0p s ILE 754 Ca -0.05 -0.79 -0.06 0.00 -1.41 0.00 0.00 60.65 58.33 1w0p s ILE 754 Cb -0.12 -2.10 0.02 0.00 0.13 0.00 0.00 42.46 40.39 1w0p s ILE 754 CO 0.02 0.54 0.17 0.68 -1.91 0.00 0.00 174.94 174.45 1w0p s VAL 755 N 0.23 0.01 -0.01 4.00 -7.23 -0.32 -1.34 120.40 115.73 1w0p s VAL 755 Ca -0.11 -0.09 -0.30 0.00 -1.81 0.00 0.00 61.98 59.67 1w0p s VAL 755 Cb -0.16 -0.28 -0.04 0.00 0.56 0.00 0.00 36.38 36.47 1w0p s VAL 755 CO 0.06 -0.05 1.11 -1.61 -0.31 0.00 0.00 175.10 174.31 1w0p s GLU 756 N -0.09 4.44 0.00 4.82 2.02 -0.15 -1.03 118.70 128.70 1w0p s GLU 756 Ca -0.02 1.60 0.00 0.00 0.02 0.00 0.00 54.97 56.57 1w0p s GLU 756 Cb -0.02 -3.47 0.00 0.00 0.10 0.00 0.00 34.13 30.74 1w0p s GLU 756 CO 0.00 -0.27 0.00 0.25 0.02 0.00 0.00 175.26 175.27 1w0p n THR 757 N 4.21 0.00 -1.69 3.63 -2.24 0.69 -1.14 114.28 117.74 1w0p n THR 757 Ca 0.09 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.44 1w0p n THR 757 Cb 0.48 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 1w0p n THR 757 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1w0p n ASP 758 N 0.00 3.87 -2.64 3.42 5.75 -1.26 -1.37 116.55 124.32 1w0p n ASP 758 Ca 0.00 1.01 -0.16 0.00 -0.01 0.00 0.00 54.79 55.63 1w0p n ASP 758 Cb 0.00 -1.52 -0.00 0.00 -1.03 0.00 0.00 41.12 38.57 1w0p n ASP 758 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1w0p n ASN 759 N 5.13 -4.29 0.00 -1.12 3.02 -1.26 -0.72 115.26 116.02 1w0p n ASN 759 Ca 0.18 0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.76 1w0p n ASN 759 Cb 0.35 -3.60 0.00 0.00 -0.61 0.00 0.00 39.78 35.92 1w0p n ASN 759 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1w0p n SER 760 N -1.97 -2.69 -4.67 6.41 7.64 -0.47 -4.02 113.62 113.85 1w0p n SER 760 Ca -0.13 0.00 -0.47 0.00 1.01 0.00 0.00 58.87 59.28 1w0p n SER 760 Cb 0.61 -1.71 -0.04 0.00 -1.01 0.00 0.00 64.21 62.06 1w0p n SER 760 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1w0p n ASN 761 N -0.30 3.13 -4.67 6.43 3.02 0.10 -4.19 115.26 118.79 1w0p n ASN 761 Ca 0.00 1.06 -0.39 0.00 -0.03 0.00 0.00 54.58 55.22 1w0p n ASN 761 Cb 0.15 -1.41 -0.07 0.00 -0.61 0.00 0.00 39.78 37.84 1w0p n ASN 761 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1w0p s MET 762 N 1.61 4.19 0.23 3.52 -1.94 0.07 -0.22 119.30 126.77 1w0p s MET 762 Ca 0.82 0.36 0.10 0.00 -1.71 0.00 0.00 55.69 55.27 1w0p s MET 762 Cb -0.69 -3.55 -0.04 0.00 2.01 0.00 0.00 34.83 32.56 1w0p s MET 762 CO 0.41 -0.10 -0.13 1.03 -0.01 0.00 0.00 175.02 176.22 1w0p s ARG 763 N 1.50 1.91 -0.13 2.03 0.52 -0.20 -0.54 118.95 124.03 1w0p s ARG 763 Ca 0.23 -1.50 -0.04 0.00 -0.52 0.00 0.00 55.73 53.90 1w0p s ARG 763 Cb -0.15 -1.99 -0.03 0.00 0.52 0.00 0.00 34.95 33.29 1w0p s ARG 763 CO 0.09 0.38 0.02 0.42 0.02 0.00 0.00 175.30 176.23 1w0p s ILE 764 N -2.08 4.45 -0.06 1.52 -1.09 -0.48 -1.18 121.20 122.28 1w0p s ILE 764 Ca 0.27 -0.18 0.04 0.00 -2.23 0.00 0.00 60.65 58.56 1w0p s ILE 764 Cb -0.07 -2.93 -0.00 0.00 -1.58 0.00 0.00 42.46 37.88 1w0p s ILE 764 CO 0.15 0.54 -0.18 -0.76 -1.23 0.00 0.00 174.94 173.46 1w0p s LEU 765 N -0.23 1.90 -0.32 2.97 1.43 0.19 -1.19 118.68 123.43 1w0p s LEU 765 Ca 0.06 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 52.80 1w0p s LEU 765 Cb -0.12 -1.04 0.09 0.00 0.03 0.00 0.00 46.19 45.14 1w0p s LEU 765 CO 0.02 0.14 0.02 -0.13 0.23 0.00 0.00 176.35 176.63 1w0p s ARG 766 N 0.18 1.81 -0.17 1.70 0.52 -1.26 -0.52 118.95 121.21 1w0p s ARG 766 Ca -0.08 -1.69 -0.09 0.00 -0.52 0.00 0.00 55.73 53.34 1w0p s ARG 766 Cb -0.13 -3.17 -0.05 0.00 0.52 0.00 0.00 34.95 32.12 1w0p s ARG 766 CO 0.04 -0.84 0.15 -1.64 0.02 0.00 0.00 175.30 173.03 1w0p s MET 767 N 1.01 3.94 -1.21 3.54 -1.94 -0.14 -4.94 119.30 119.56 1w0p s MET 767 Ca 0.04 -0.15 -0.19 0.00 -1.71 0.00 0.00 55.69 53.69 1w0p s MET 767 Cb -0.20 -3.34 0.08 0.00 2.01 0.00 0.00 34.83 33.38 1w0p s MET 767 CO -0.06 0.46 1.62 -1.25 -0.01 0.00 0.00 175.02 175.78 1w0p s PRO 768 N -0.12 3.89 0.23 2.03 0.04 -1.26 -1.27 135.00 138.54 1w0p s PRO 768 Ca 0.11 -1.85 -0.06 0.00 0.04 0.00 0.00 61.00 59.24 1w0p s PRO 768 Cb -0.12 -5.42 0.35 0.00 0.04 0.00 0.00 34.50 29.35 1w0p s PRO 768 CO 0.01 -2.18 1.80 0.82 0.04 0.00 0.00 177.00 177.49 1w0p h ILE 769 N 5.77 0.90 0.00 0.56 1.08 -1.71 -0.50 117.51 123.60 1w0p h ILE 769 Ca 0.37 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 64.60 1w0p h ILE 769 Cb 0.91 0.13 0.00 0.00 -3.07 0.00 0.00 36.82 34.79 1w0p h ILE 769 CO 1.42 0.13 0.00 0.71 -0.69 0.00 0.00 178.15 179.71 1w0p h THR 770 N 0.70 0.00 0.04 -0.27 1.35 -1.88 -1.29 112.91 111.57 1w0p h THR 770 Ca 0.36 -0.24 -0.34 0.00 -0.55 0.00 0.00 66.41 65.64 1w0p h THR 770 Cb 0.33 1.08 -0.04 0.00 -1.73 0.00 0.00 68.15 67.79 1w0p h THR 770 CO -0.24 0.00 -1.90 0.18 -0.25 0.00 0.00 175.52 173.31 1w0p n LEU 771 N -2.70 2.28 -0.02 3.87 4.77 -0.61 -4.31 117.00 120.29 1w0p n LEU 771 Ca 0.00 0.26 0.04 0.00 -0.03 0.00 0.00 56.01 56.28 1w0p n LEU 771 Cb 0.19 -0.98 0.41 0.00 -2.33 0.00 0.00 43.42 40.71 1w0p n LEU 771 CO 0.21 0.61 1.17 -0.07 -1.33 0.00 0.00 177.39 177.97 1w0p h LEU 772 N -0.52 0.50 -2.20 2.23 3.38 -0.92 -1.93 115.31 115.85 1w0p h LEU 772 Ca -0.47 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 57.55 1w0p h LEU 772 Cb 1.68 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.30 1w0p h LEU 772 CO -0.14 0.37 0.24 0.50 0.09 0.00 0.00 178.44 179.50 1w0p h LYS 773 N 0.60 0.00 -0.00 1.13 3.64 -1.43 -0.46 116.57 120.05 1w0p h LYS 773 Ca 0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1w0p h LYS 773 Cb -0.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1w0p h LYS 773 CO -0.03 0.00 -0.01 1.04 -2.27 0.00 0.00 179.45 178.18 1w0p n GLN 774 N -3.73 0.07 0.00 1.90 6.02 -0.72 -3.14 117.38 117.78 1w0p n GLN 774 Ca 0.02 -0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.14 1w0p n GLN 774 Cb 0.36 -1.50 0.43 0.00 1.02 0.00 0.00 30.24 30.55 1w0p n GLN 774 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1w0p n LYS 775 N -1.46 0.48 0.15 -1.09 5.02 -0.18 -4.23 118.16 116.84 1w0p n LYS 775 Ca 0.08 -0.23 -0.08 0.00 -2.02 0.00 0.00 58.31 56.06 1w0p n LYS 775 Cb 0.32 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.80 1w0p n LYS 775 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1w0p h LEU 776 N 0.56 -0.38 -0.29 -0.35 3.38 -1.67 -3.52 115.31 113.04 1w0p h LEU 776 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1w0p h LEU 776 Cb 0.46 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1w0p h LEU 776 CO 0.00 0.07 0.00 0.41 0.09 0.00 0.00 178.44 179.01