#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ow1 s VAL 3496N 0.00 0.12 0.06 0.52 -7.23 -1.26 -5.17 120.40 107.44 1ow1 s VAL 3496Ca 0.00 -1.98 -0.01 0.00 -1.81 0.00 0.00 61.98 58.18 1ow1 s VAL 3496Cb 0.00 -2.42 -0.04 0.00 0.56 0.00 0.00 36.38 34.48 1ow1 s VAL 3496CO 0.00 -0.11 -0.02 -0.62 -0.31 0.00 0.00 175.10 174.04 1ow1 s ASP 3497N -3.16 0.47 0.29 4.85 2.15 -1.26 -5.15 116.67 114.86 1ow1 s ASP 3497Ca 0.35 -1.01 -0.15 0.00 0.43 0.00 0.00 52.55 52.17 1ow1 s ASP 3497Cb 0.07 0.21 -0.09 0.00 -0.30 0.00 0.00 42.92 42.81 1ow1 s ASP 3497CO 0.10 -0.61 0.71 -0.04 -0.17 0.00 0.00 175.17 175.16 1ow1 s MET 3498N -3.93 4.02 0.07 4.34 -1.94 -1.26 -5.00 119.30 115.61 1ow1 s MET 3498Ca 0.08 0.66 -0.17 0.00 -1.71 0.00 0.00 55.69 54.56 1ow1 s MET 3498Cb 0.08 -2.53 -0.12 0.00 2.01 0.00 0.00 34.83 34.27 1ow1 s MET 3498CO -0.09 0.21 1.35 0.28 -0.01 0.00 0.00 175.02 176.77 1ow1 h VAL 3499N 2.10 1.33 -3.77 -6.03 2.07 -2.01 -3.42 116.25 106.52 1ow1 h VAL 3499Ca -0.48 -1.53 -0.64 0.00 0.82 0.00 0.00 66.70 64.87 1ow1 h VAL 3499Cb 1.18 1.80 -0.20 0.00 -1.52 0.00 0.00 31.29 32.55 1ow1 h VAL 3499CO 0.66 0.47 -0.57 -1.10 0.02 0.00 0.00 177.57 177.05 1ow1 s GLN 3500N -4.16 3.81 0.22 1.57 -0.21 -1.26 -4.99 119.66 114.64 1ow1 s GLN 3500Ca -0.13 -0.39 -0.08 0.00 0.02 0.00 0.00 55.36 54.78 1ow1 s GLN 3500Cb 0.07 -3.49 0.32 0.00 1.00 0.00 0.00 33.01 30.90 1ow1 s GLN 3500CO 0.81 -0.18 1.77 1.25 -2.12 0.00 0.00 175.29 176.82 1ow1 h LEU 3501N 8.28 0.38 -2.18 2.90 5.85 -2.00 -0.91 115.31 127.62 1ow1 h LEU 3501Ca -0.37 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 1ow1 h LEU 3501Cb 1.18 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 1ow1 h LEU 3501CO 0.57 0.21 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.77 1ow1 h LEU 3502N 0.53 0.00 -0.06 2.25 3.38 -1.94 -0.85 115.31 118.62 1ow1 h LEU 3502Ca 0.34 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.12 1ow1 h LEU 3502Cb 0.38 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1ow1 h LEU 3502CO -0.28 0.04 -0.90 0.11 0.09 0.00 0.00 178.44 177.50 1ow1 h LYS 3503N 0.00 0.00 0.00 1.13 1.79 -1.60 -3.23 116.57 114.67 1ow1 h LYS 3503Ca -0.00 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 1ow1 h LYS 3503Cb 0.26 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 1ow1 h LYS 3503CO 0.00 0.90 -0.68 -0.22 -1.08 0.00 0.00 179.45 178.37 1ow1 h LYS 3504N 0.00 0.00 -2.82 3.15 3.64 -0.81 -3.36 116.57 116.37 1ow1 h LYS 3504Ca -0.01 0.00 -0.61 0.00 -1.27 0.00 0.00 60.65 58.76 1ow1 h LYS 3504Cb 1.66 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 33.07 1ow1 h LYS 3504CO 0.12 0.68 -0.72 0.71 -2.27 0.00 0.00 179.45 177.97 1ow1 s TYR 3505N -3.26 2.67 0.52 1.91 1.51 -0.87 -4.95 117.35 114.88 1ow1 s TYR 3505Ca 0.00 -2.98 -0.22 0.00 -1.01 0.00 0.00 57.07 52.87 1ow1 s TYR 3505Cb 0.11 -2.05 -0.06 0.00 -0.11 0.00 0.00 41.96 39.85 1ow1 s TYR 3505CO 0.77 -0.65 1.25 -1.25 -1.11 0.00 0.00 175.55 174.56 1ow1 s PRO 3506N -0.92 3.34 -0.07 -1.71 0.04 -1.22 -4.41 135.00 130.04 1ow1 s PRO 3506Ca 0.28 1.98 -0.30 0.00 0.04 0.00 0.00 61.00 63.00 1ow1 s PRO 3506Cb -0.01 -2.24 -0.03 0.00 0.04 0.00 0.00 34.50 32.26 1ow1 s PRO 3506CO -0.18 -0.95 1.13 0.42 0.04 0.00 0.00 177.00 177.45 1ow1 s ILE 3507N -1.45 4.45 -0.44 0.56 1.01 -1.26 -0.19 121.20 123.87 1ow1 s ILE 3507Ca 0.70 1.75 0.06 0.00 0.00 0.00 0.00 60.65 63.16 1ow1 s ILE 3507Cb -0.34 -4.12 -0.02 0.00 0.01 0.00 0.00 42.46 37.98 1ow1 s ILE 3507CO 0.40 0.01 0.39 1.33 0.00 0.00 0.00 174.94 177.07 1ow1 n VAL 3508N 4.55 0.00 -3.60 2.92 0.24 -0.14 -4.93 118.33 117.36 1ow1 n VAL 3508Ca 0.10 -0.41 -0.16 0.00 -2.04 0.00 0.00 64.34 61.83 1ow1 n VAL 3508Cb 0.47 1.04 -0.07 0.00 -1.47 0.00 0.00 33.84 33.82 1ow1 n VAL 3508CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 1ow1 s TRP 3509N -1.18 -0.67 -0.03 6.34 -0.00 -1.22 -4.97 118.94 117.20 1ow1 s TRP 3509Ca 0.04 1.43 -0.01 0.00 -0.00 0.00 0.00 56.10 57.56 1ow1 s TRP 3509Cb 0.05 0.31 0.03 0.00 -0.00 0.00 0.00 33.47 33.85 1ow1 s TRP 3509CO 0.18 -0.46 0.07 -1.14 -0.00 0.00 0.00 176.95 175.59 1ow1 s GLN 3510N -0.38 0.01 0.00 5.86 0.74 -1.26 -0.51 119.66 124.12 1ow1 s GLN 3510Ca -0.05 0.24 0.00 0.00 0.05 0.00 0.00 55.36 55.60 1ow1 s GLN 3510Cb -0.03 -0.21 0.00 0.00 1.10 0.00 0.00 33.01 33.87 1ow1 s GLN 3510CO 0.05 -0.16 0.00 0.41 -0.55 0.00 0.00 175.29 175.04 1ow1 n GLY 3511N 4.13 -0.61 3.44 2.59 0.00 -0.82 -4.67 105.19 109.26 1ow1 n GLY 3511Ca -0.27 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 1ow1 n GLY 3511CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ow1 s LEU 3512N 0.00 2.55 0.07 0.99 1.43 -1.26 -1.33 118.68 121.14 1ow1 s LEU 3512Ca 0.00 -0.34 0.02 0.00 -1.03 0.00 0.00 54.13 52.78 1ow1 s LEU 3512Cb 0.00 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.68 1ow1 s LEU 3512CO 0.00 0.30 0.10 -0.76 0.23 0.00 0.00 176.35 176.22 1ow1 s LEU 3513N -1.01 3.89 0.01 1.79 1.43 -0.03 -0.60 118.68 124.17 1ow1 s LEU 3513Ca 0.13 0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.29 1ow1 s LEU 3513Cb -0.10 -2.55 -0.01 0.00 0.03 0.00 0.00 46.19 43.56 1ow1 s LEU 3513CO 0.02 0.18 -0.09 0.00 0.23 0.00 0.00 176.35 176.69 1ow1 s ALA 3514N -1.40 0.73 -0.19 4.21 0.00 0.28 -1.44 121.76 123.95 1ow1 s ALA 3514Ca 0.30 -0.48 -0.05 0.00 0.00 0.00 0.00 51.96 51.73 1ow1 s ALA 3514Cb -0.12 -0.14 0.09 0.00 0.00 0.00 0.00 23.12 22.95 1ow1 s ALA 3514CO 0.23 0.14 0.34 -1.17 0.00 0.00 0.00 175.76 175.30 1ow1 s LEU 3515N -0.55 -0.47 0.00 0.00 2.96 -0.51 -0.28 118.68 119.83 1ow1 s LEU 3515Ca 0.01 0.51 0.00 0.00 -0.22 0.00 0.00 54.13 54.43 1ow1 s LEU 3515Cb -0.05 0.97 0.00 0.00 0.50 0.00 0.00 46.19 47.61 1ow1 s LEU 3515CO 0.00 -0.26 0.00 0.29 -1.32 0.00 0.00 176.35 175.06 1ow1 n LYS 3516N 5.36 0.00 -0.66 1.98 5.02 -1.26 -1.16 118.16 127.44 1ow1 n LYS 3516Ca -0.06 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.31 1ow1 n LYS 3516Cb 0.50 0.00 0.35 0.00 -0.02 0.00 0.00 35.03 35.86 1ow1 n LYS 3516CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ow1 n ASN 3517N 6.06 4.79 -4.62 4.39 3.02 -1.26 -4.95 115.26 122.69 1ow1 n ASN 3517Ca 0.00 -2.56 -0.26 0.00 -0.03 0.00 0.00 54.58 51.73 1ow1 n ASN 3517Cb 0.00 -0.60 -0.08 0.00 -0.61 0.00 0.00 39.78 38.49 1ow1 n ASN 3517CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1ow1 s ASP 3518N -0.82 4.51 0.08 6.41 1.01 -0.31 -5.14 116.67 122.42 1ow1 s ASP 3518Ca 0.49 -0.50 0.01 0.00 0.71 0.00 0.00 52.55 53.26 1ow1 s ASP 3518Cb 0.33 -0.87 -0.04 0.00 1.01 0.00 0.00 42.92 43.36 1ow1 s ASP 3518CO 0.21 0.09 -0.06 0.42 0.21 0.00 0.00 175.17 176.04 1ow1 s THR 3519N -1.75 0.56 -0.18 -1.27 -4.23 -1.26 -1.42 115.64 106.09 1ow1 s THR 3519Ca 0.26 -1.78 -0.10 0.00 -1.18 0.00 0.00 61.69 58.90 1ow1 s THR 3519Cb -0.09 -1.49 0.06 0.00 1.34 0.00 0.00 72.50 72.33 1ow1 s THR 3519CO 0.17 -0.83 0.43 0.00 -0.54 0.00 0.00 174.62 173.84 1ow1 s ALA 3520N -3.37 -1.10 -0.09 3.99 0.00 -0.52 -4.79 121.76 115.88 1ow1 s ALA 3520Ca 0.08 1.59 -0.25 0.00 0.00 0.00 0.00 51.96 53.37 1ow1 s ALA 3520Cb 0.04 -0.97 -0.03 0.00 0.00 0.00 0.00 23.12 22.15 1ow1 s ALA 3520CO -0.05 -0.29 0.78 0.00 0.00 0.00 0.00 175.76 176.20 1ow1 s ALA 3521N 1.46 3.36 0.11 0.00 0.00 -1.26 -0.85 121.76 124.58 1ow1 s ALA 3521Ca -0.09 0.16 -0.01 0.00 0.00 0.00 0.00 51.96 52.02 1ow1 s ALA 3521Cb -0.08 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 1ow1 s ALA 3521CO -0.13 -0.30 0.03 0.14 0.00 0.00 0.00 175.76 175.50 1ow1 s VAL 3522N 1.26 0.14 -0.05 0.00 -7.23 -0.44 -2.23 120.40 111.85 1ow1 s VAL 3522Ca 0.40 -1.87 0.06 0.00 -1.81 0.00 0.00 61.98 58.76 1ow1 s VAL 3522Cb -0.18 -1.88 -0.01 0.00 0.56 0.00 0.00 36.38 34.87 1ow1 s VAL 3522CO 0.18 -0.63 -0.23 -1.10 -0.31 0.00 0.00 175.10 173.01 1ow1 s GLN 3523N -4.01 2.26 -0.22 4.82 -0.21 0.34 -1.94 119.66 120.71 1ow1 s GLN 3523Ca 0.19 -0.82 -0.08 0.00 0.02 0.00 0.00 55.36 54.66 1ow1 s GLN 3523Cb 0.08 -1.96 -0.04 0.00 1.00 0.00 0.00 33.01 32.08 1ow1 s GLN 3523CO -0.02 0.37 0.09 -0.51 -2.12 0.00 0.00 175.29 173.10 1ow1 s LEU 3524N -0.18 3.75 -0.17 2.90 1.43 0.34 -1.43 118.68 125.33 1ow1 s LEU 3524Ca -0.02 -0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 52.98 1ow1 s LEU 3524Cb -0.12 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.06 1ow1 s LEU 3524CO 0.03 0.07 0.14 -1.00 0.23 0.00 0.00 176.35 175.82 1ow1 s HIS 3525N 1.01 3.49 -0.01 0.29 3.76 0.74 -0.97 115.29 123.60 1ow1 s HIS 3525Ca 0.05 0.42 -0.30 0.00 -0.15 0.00 0.00 55.06 55.08 1ow1 s HIS 3525Cb -0.14 -2.08 -0.05 0.00 1.11 0.00 0.00 32.58 31.42 1ow1 s HIS 3525CO 0.03 0.46 1.28 0.12 -0.85 0.00 0.00 174.74 175.78 1ow1 s PHE 3526N -0.17 3.11 -0.17 1.40 5.36 0.73 -0.78 117.98 127.46 1ow1 s PHE 3526Ca 0.11 1.07 -0.08 0.00 -0.96 0.00 0.00 56.93 57.07 1ow1 s PHE 3526Cb -0.11 -3.52 -0.07 0.00 -0.34 0.00 0.00 43.02 38.97 1ow1 s PHE 3526CO 0.01 -1.76 -0.21 0.28 -1.46 0.00 0.00 175.22 172.07 1ow1 n VAL 3527N 4.49 0.91 -3.78 3.12 0.31 0.13 -4.14 118.33 119.37 1ow1 n VAL 3527Ca 0.11 -0.24 -0.04 0.00 -0.01 0.00 0.00 64.34 64.17 1ow1 n VAL 3527Cb 0.45 -1.71 -0.01 0.00 -0.91 0.00 0.00 33.84 31.66 1ow1 n VAL 3527CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1ow1 s SER 3528N -6.47 -0.16 0.00 4.52 1.04 -1.09 -4.97 113.70 106.57 1ow1 s SER 3528Ca -0.23 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 55.71 1ow1 s SER 3528Cb 0.09 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1ow1 s SER 3528CO 0.29 -0.99 0.00 0.61 0.98 0.00 0.00 173.24 174.14 1ow1 n GLY 3529N -0.50 -0.11 3.35 7.32 0.00 -1.26 -0.15 105.19 113.84 1ow1 n GLY 3529Ca -0.06 -1.65 -0.43 0.00 0.00 0.00 0.00 46.02 43.88 1ow1 n GLY 3529CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ow1 s ASN 3530N -4.00 5.94 0.59 1.61 3.84 0.25 -4.88 114.94 118.30 1ow1 s ASN 3530Ca 0.00 -1.36 0.32 0.00 0.21 0.00 0.00 52.86 52.03 1ow1 s ASN 3530Cb 0.00 -2.10 1.84 0.00 -0.55 0.00 0.00 41.25 40.43 1ow1 s ASN 3530CO 0.00 -0.59 2.22 -0.55 -2.79 0.00 0.00 177.10 175.40 1ow1 h ASN 3531N 8.61 0.00 -0.30 -4.21 7.08 -1.87 -1.99 115.58 122.90 1ow1 h ASN 3531Ca -0.26 0.00 -0.00 0.00 -3.08 0.00 0.00 56.30 52.96 1ow1 h ASN 3531Cb 1.10 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 37.33 1ow1 h ASN 3531CO 0.82 0.03 0.19 0.58 -2.08 0.00 0.00 177.43 176.97 1ow1 h VAL 3532N 0.00 1.09 -0.08 6.14 2.07 -1.96 -0.41 116.25 123.10 1ow1 h VAL 3532Ca -0.00 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.30 1ow1 h VAL 3532Cb 0.11 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1ow1 h VAL 3532CO 0.00 0.09 -0.14 -0.07 0.02 0.00 0.00 177.57 177.47 1ow1 h LEU 3533N 0.42 0.12 -0.28 2.57 3.38 -1.73 -1.27 115.31 118.51 1ow1 h LEU 3533Ca 0.11 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1ow1 h LEU 3533Cb -0.02 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1ow1 h LEU 3533CO -0.02 0.27 -0.11 0.00 0.09 0.00 0.00 178.44 178.67 1ow1 h ALA 3534N 1.74 0.39 -0.23 1.53 0.00 -1.21 -0.66 119.26 120.82 1ow1 h ALA 3534Ca 0.03 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1ow1 h ALA 3534Cb 0.32 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1ow1 h ALA 3534CO 0.02 0.25 0.12 1.25 0.00 0.00 0.00 179.25 180.88 1ow1 h HIS 3535N 0.32 0.22 0.00 0.00 -0.00 -1.09 -0.51 115.15 114.09 1ow1 h HIS 3535Ca 0.07 0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.40 1ow1 h HIS 3535Cb 0.61 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.95 1ow1 h HIS 3535CO 0.06 0.12 -0.22 0.00 -0.00 0.00 0.00 177.93 177.90 1ow1 h ARG 3536N 0.25 0.00 0.00 5.26 3.08 -1.24 -3.35 114.38 118.38 1ow1 h ARG 3536Ca 0.09 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.99 1ow1 h ARG 3536Cb 0.02 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 1ow1 h ARG 3536CO -0.06 0.22 -2.13 -1.13 -1.07 0.00 0.00 179.97 175.80 1ow1 n SER 3537N -3.22 0.18 -4.87 7.04 3.41 -0.26 -4.98 113.62 110.92 1ow1 n SER 3537Ca 0.02 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.29 1ow1 n SER 3537Cb 0.54 1.54 -0.05 0.00 -0.26 0.00 0.00 64.21 65.97 1ow1 n SER 3537CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ow1 s LEU 3538N -4.89 4.31 1.13 1.04 1.43 -0.21 -4.94 118.68 116.55 1ow1 s LEU 3538Ca -0.09 0.86 -0.14 0.00 -1.03 0.00 0.00 54.13 53.73 1ow1 s LEU 3538Cb 0.10 -3.21 0.26 0.00 0.03 0.00 0.00 46.19 43.38 1ow1 s LEU 3538CO 0.84 0.10 1.05 -2.84 0.23 0.00 0.00 176.35 175.74 1ow1 s PRO 3539N -2.16 -0.66 0.38 1.29 0.02 -1.26 -4.89 135.00 127.73 1ow1 s PRO 3539Ca 0.37 0.53 -0.26 0.00 0.02 0.00 0.00 61.00 61.66 1ow1 s PRO 3539Cb -0.14 -1.61 -0.11 0.00 0.02 0.00 0.00 34.50 32.66 1ow1 s PRO 3539CO 0.20 -3.47 1.22 1.47 -0.33 0.00 0.00 177.00 176.09 1ow1 n LEU 3540N -4.69 3.48 -3.69 -5.54 -0.00 -1.26 -5.04 117.00 100.26 1ow1 n LEU 3540Ca 0.05 1.14 -0.42 0.00 -0.00 0.00 0.00 56.01 56.78 1ow1 n LEU 3540Cb 0.57 -1.46 -0.00 0.00 -0.00 0.00 0.00 43.42 42.53 1ow1 n LEU 3540CO 0.55 -0.77 2.67 -0.24 -0.00 0.00 0.00 177.39 179.60 1ow1 n SER 3541N 0.52 4.80 0.00 1.45 2.88 -1.26 -4.98 113.62 117.04 1ow1 n SER 3541Ca 0.07 -2.85 0.00 0.00 -1.33 0.00 0.00 58.87 54.75 1ow1 n SER 3541Cb 0.38 -1.61 0.00 0.00 -0.75 0.00 0.00 64.21 62.22 1ow1 n SER 3541CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1ow1 n PRO 3545N 5.32 0.00 -1.33 -1.46 -0.02 -1.26 -4.96 135.00 131.30 1ow1 n PRO 3545Ca 0.54 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.71 1ow1 n PRO 3545Cb 0.36 0.00 0.09 0.00 -0.02 0.00 0.00 33.50 33.93 1ow1 n PRO 3545CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1ow1 s PRO 3546N 0.00 2.30 -0.54 0.52 0.04 -1.26 -4.93 135.00 131.13 1ow1 s PRO 3546Ca 0.00 1.07 -0.28 0.00 0.04 0.00 0.00 61.00 61.83 1ow1 s PRO 3546Cb 0.00 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1ow1 s PRO 3546CO 0.00 -1.59 1.54 -0.51 0.04 0.00 0.00 177.00 176.48 1ow1 s LEU 3547N -5.87 3.40 -0.16 -3.56 1.43 0.24 -4.80 118.68 109.36 1ow1 s LEU 3547Ca 0.61 0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 53.98 1ow1 s LEU 3547Cb -0.16 -3.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.98 1ow1 s LEU 3547CO 0.56 -1.81 0.38 -0.60 0.23 0.00 0.00 176.35 175.10 1ow1 s ARG 3548N 5.77 4.26 -0.47 1.70 3.52 -1.26 -0.56 118.95 131.91 1ow1 s ARG 3548Ca 0.58 0.23 -0.20 0.00 -0.13 0.00 0.00 55.73 56.21 1ow1 s ARG 3548Cb -0.13 -3.46 0.03 0.00 -1.56 0.00 0.00 34.95 29.84 1ow1 s ARG 3548CO 0.25 0.13 0.65 0.42 -0.81 0.00 0.00 175.30 175.95 1ow1 s ILE 3549N 0.76 4.82 -0.31 4.11 1.01 0.62 -4.84 121.20 127.37 1ow1 s ILE 3549Ca 0.20 -0.07 0.05 0.00 0.00 0.00 0.00 60.65 60.83 1ow1 s ILE 3549Cb -0.14 -4.25 -0.03 0.00 0.01 0.00 0.00 42.46 38.04 1ow1 s ILE 3549CO 0.07 -0.69 0.29 0.00 0.00 0.00 0.00 174.94 174.61 1ow1 n ALA 3550N 6.30 2.60 -2.33 9.38 0.00 -1.26 -4.41 120.51 130.79 1ow1 n ALA 3550Ca -0.03 -0.21 -0.17 0.00 0.00 0.00 0.00 53.44 53.03 1ow1 n ALA 3550Cb 0.47 -0.17 -0.10 0.00 0.00 0.00 0.00 19.45 19.64 1ow1 n ALA 3550CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ow1 s GLN 3551N -1.26 1.33 0.03 0.00 -0.21 -1.22 -5.05 119.66 113.28 1ow1 s GLN 3551Ca 0.03 -1.67 -0.10 0.00 0.02 0.00 0.00 55.36 53.64 1ow1 s GLN 3551Cb 0.04 -0.65 0.01 0.00 1.00 0.00 0.00 33.01 33.40 1ow1 s GLN 3551CO 0.17 -0.08 0.20 -0.98 -2.12 0.00 0.00 175.29 172.48 1ow1 s ARG 3552N -3.85 0.65 -0.01 2.91 1.70 -1.26 -0.99 118.95 118.10 1ow1 s ARG 3552Ca 0.28 -0.53 0.07 0.00 -0.47 0.00 0.00 55.73 55.08 1ow1 s ARG 3552Cb 0.05 0.27 -0.02 0.00 -0.57 0.00 0.00 34.95 34.69 1ow1 s ARG 3552CO 0.08 -0.18 -0.24 1.41 -1.08 0.00 0.00 175.30 175.29 1ow1 s MET 3553N -2.18 1.90 0.30 3.89 -2.45 0.21 -4.87 119.30 116.09 1ow1 s MET 3553Ca -0.08 -0.87 -0.29 0.00 -1.25 0.00 0.00 55.69 53.20 1ow1 s MET 3553Cb -0.03 -1.85 -0.10 0.00 1.25 0.00 0.00 34.83 34.10 1ow1 s MET 3553CO -0.02 0.51 1.17 1.03 1.05 0.00 0.00 175.02 178.76 1ow1 s ARG 3554N -0.62 4.53 -1.48 4.11 0.52 -1.26 -0.67 118.95 124.08 1ow1 s ARG 3554Ca 0.09 1.94 -0.10 0.00 -0.52 0.00 0.00 55.73 57.14 1ow1 s ARG 3554Cb -0.09 -3.13 0.02 0.00 0.52 0.00 0.00 34.95 32.26 1ow1 s ARG 3554CO -0.01 0.07 2.54 1.28 0.02 0.00 0.00 175.30 179.20 1ow1 n LEU 3555N 1.02 7.93 -4.64 2.53 4.77 -0.27 -4.61 117.00 123.74 1ow1 n LEU 3555Ca -0.01 -4.46 -0.27 0.00 -0.03 0.00 0.00 56.01 51.24 1ow1 n LEU 3555Cb 0.44 -1.53 -0.10 0.00 -2.33 0.00 0.00 43.42 39.89 1ow1 n LEU 3555CO 0.56 1.77 -0.27 -1.61 -1.33 0.00 0.00 177.39 176.50 1ow1 s GLU 3556N 1.49 2.00 0.00 3.23 2.02 -1.26 -4.98 118.70 121.21 1ow1 s GLU 3556Ca 0.58 -2.07 0.00 0.00 0.02 0.00 0.00 54.97 53.50 1ow1 s GLU 3556Cb 0.16 -1.69 0.00 0.00 0.10 0.00 0.00 34.13 32.70 1ow1 s GLU 3556CO -0.07 -0.06 0.83 0.00 0.02 0.00 0.00 175.26 175.98 1ow1 n ALA 3557N -1.01 0.00 -0.06 5.21 0.00 -1.26 -1.17 120.51 122.22 1ow1 n ALA 3557Ca -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.39 1ow1 n ALA 3557Cb 0.67 0.41 0.27 0.00 0.00 0.00 0.00 19.45 20.80 1ow1 n ALA 3557CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1ow1 h THR 3558N 0.00 1.20 -0.07 0.00 1.35 -1.98 0.39 112.91 113.80 1ow1 h THR 3558Ca 0.00 -0.71 -0.00 0.00 -0.55 0.00 0.00 66.41 65.15 1ow1 h THR 3558Cb 0.00 0.76 -0.00 0.00 -1.73 0.00 0.00 68.15 67.17 1ow1 h THR 3558CO 0.00 0.26 0.03 1.56 -0.25 0.00 0.00 175.52 177.12 1ow1 h GLN 3559N 0.64 0.10 -0.32 4.72 7.50 -1.78 -1.05 115.11 124.92 1ow1 h GLN 3559Ca 0.15 -0.01 -0.09 0.00 0.50 0.00 0.00 58.65 59.19 1ow1 h GLN 3559Cb 0.25 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.75 1ow1 h GLN 3559CO -0.00 0.18 -0.17 -0.07 -1.50 0.00 0.00 178.83 177.27 1ow1 h LEU 3560N -0.00 0.58 -1.06 1.46 3.38 -0.89 -2.32 115.31 116.45 1ow1 h LEU 3560Ca 0.02 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1ow1 h LEU 3560Cb 0.11 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1ow1 h LEU 3560CO -0.00 0.76 0.40 -0.33 0.09 0.00 0.00 178.44 179.36 1ow1 h GLU 3561N 0.53 1.06 -0.62 1.13 5.08 -0.68 -0.66 114.58 120.41 1ow1 h GLU 3561Ca 0.09 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 1ow1 h GLU 3561Cb 0.59 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1ow1 h GLU 3561CO 0.04 0.78 0.10 0.78 -1.00 0.00 0.00 179.01 179.72 1ow1 h GLY 3562N 1.10 1.09 0.78 -3.84 0.00 -0.67 -0.44 103.07 101.09 1ow1 h GLY 3562Ca 0.27 -0.70 -0.05 0.00 0.00 0.00 0.00 47.33 46.85 1ow1 h GLY 3562CO -0.04 0.65 -0.07 -2.08 0.00 0.00 0.00 176.54 175.00 1ow1 h VAL 3563N 0.95 1.30 -0.69 4.60 2.07 -1.00 -2.99 116.25 120.50 1ow1 h VAL 3563Ca 0.19 -1.10 0.04 0.00 0.82 0.00 0.00 66.70 66.66 1ow1 h VAL 3563Cb 0.41 1.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.80 1ow1 h VAL 3563CO 0.01 0.33 0.46 0.00 0.02 0.00 0.00 177.57 178.38 1ow1 h ALA 3564N 0.70 1.65 -0.68 1.67 0.00 -0.92 -1.95 119.26 119.72 1ow1 h ALA 3564Ca 0.04 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1ow1 h ALA 3564Cb 0.54 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1ow1 h ALA 3564CO 0.02 0.26 0.43 -0.09 0.00 0.00 0.00 179.25 179.87 1ow1 h ARG 3565N 0.79 0.81 0.00 0.00 2.43 -0.94 -1.48 114.38 115.99 1ow1 h ARG 3565Ca 0.28 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1ow1 h ARG 3565Cb 0.14 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1ow1 h ARG 3565CO -0.09 0.54 0.00 0.54 -1.51 0.00 0.00 179.97 179.45 1ow1 n ARG 3566N -4.68 0.02 -0.31 0.20 1.74 -0.75 -2.81 116.66 110.08 1ow1 n ARG 3566Ca 0.07 0.15 0.11 0.00 -0.77 0.00 0.00 57.85 57.41 1ow1 n ARG 3566Cb 0.09 -1.50 0.29 0.00 -1.02 0.00 0.00 32.46 30.31 1ow1 n ARG 3566CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1ow1 n MET 3567N -1.48 2.57 0.11 5.56 2.81 -0.56 -4.11 117.12 122.02 1ow1 n MET 3567Ca 0.05 -2.43 0.12 0.00 -1.81 0.00 0.00 57.70 53.64 1ow1 n MET 3567Cb 0.23 -1.53 0.28 0.00 -0.71 0.00 0.00 33.22 31.49 1ow1 n MET 3567CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1ow1 h THR 3568N 4.15 0.00 -3.68 2.03 1.35 -1.50 -3.42 112.91 111.84 1ow1 h THR 3568Ca 0.00 -0.59 -0.62 0.00 -0.55 0.00 0.00 66.41 64.65 1ow1 h THR 3568Cb 0.94 1.44 -0.38 0.00 -1.73 0.00 0.00 68.15 68.42 1ow1 h THR 3568CO 0.00 0.00 -0.79 -0.69 -0.25 0.00 0.00 175.52 173.79 1ow1 s VAL 3569N -3.15 1.64 0.63 6.82 1.01 -1.26 -5.01 120.40 121.08 1ow1 s VAL 3569Ca 0.08 -1.30 0.24 0.00 0.00 0.00 0.00 61.98 61.01 1ow1 s VAL 3569Cb 0.11 -1.88 0.30 0.00 0.00 0.00 0.00 36.38 34.91 1ow1 s VAL 3569CO 0.65 -0.09 1.65 -0.33 0.00 0.00 0.00 175.10 176.99 1ow1 h GLU 3570N 7.92 0.00 0.00 2.72 5.08 -1.90 0.17 114.58 128.57 1ow1 h GLU 3570Ca -0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1ow1 h GLU 3570Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1ow1 h GLU 3570CO 0.42 0.00 -0.51 1.79 -1.00 0.00 0.00 179.01 179.71 1ow1 h THR 3571N 0.00 0.00 -0.02 1.13 1.35 -1.95 -1.11 112.91 112.32 1ow1 h THR 3571Ca 0.17 -0.87 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 1ow1 h THR 3571Cb 1.49 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 1ow1 h THR 3571CO -0.00 0.00 -0.17 0.47 -0.25 0.00 0.00 175.52 175.57 1ow1 n ASP 3572N -2.69 1.94 -4.05 5.36 8.00 0.58 -4.72 116.55 120.97 1ow1 n ASP 3572Ca 0.02 -1.51 -0.10 0.00 0.71 0.00 0.00 54.79 53.91 1ow1 n ASP 3572Cb 0.51 0.14 -0.08 0.00 -0.02 0.00 0.00 41.12 41.68 1ow1 n ASP 3572CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1ow1 s TYR 3573N -2.22 0.62 -0.09 1.24 -0.85 -1.23 -2.47 117.35 112.36 1ow1 s TYR 3573Ca 0.28 -0.96 -0.03 0.00 -0.52 0.00 0.00 57.07 55.83 1ow1 s TYR 3573Cb 0.20 -0.20 0.05 0.00 0.38 0.00 0.00 41.96 42.38 1ow1 s TYR 3573CO 0.42 -0.70 0.17 0.00 -1.52 0.00 0.00 175.55 173.92 1ow1 s LEU 3575N 1.97 3.79 0.12 0.00 2.96 0.78 -0.63 118.68 127.68 1ow1 s LEU 3575Ca -0.01 0.00 0.08 0.00 -0.22 0.00 0.00 54.13 53.99 1ow1 s LEU 3575Cb -0.12 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 1ow1 s LEU 3575CO -0.06 0.08 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.09 1ow1 s LEU 3576N 0.93 2.35 -0.18 -0.68 1.43 0.64 -0.70 118.68 122.48 1ow1 s LEU 3576Ca 0.05 -0.75 -0.02 0.00 -1.03 0.00 0.00 54.13 52.38 1ow1 s LEU 3576Cb -0.14 -0.87 -0.01 0.00 0.03 0.00 0.00 46.19 45.20 1ow1 s LEU 3576CO 0.03 0.03 -0.10 -0.22 0.23 0.00 0.00 176.35 176.32 1ow1 s LEU 3577N -2.18 2.74 -0.21 1.79 2.96 0.04 -0.44 118.68 123.39 1ow1 s LEU 3577Ca 0.10 -0.39 -0.13 0.00 -0.22 0.00 0.00 54.13 53.49 1ow1 s LEU 3577Cb -0.09 -1.66 -0.05 0.00 0.50 0.00 0.00 46.19 44.90 1ow1 s LEU 3577CO 0.05 0.06 0.26 0.00 -1.32 0.00 0.00 176.35 175.40 1ow1 s ALA 3578N 0.96 3.60 0.09 5.97 0.00 0.27 -0.19 121.76 132.45 1ow1 s ALA 3578Ca -0.02 -0.67 0.07 0.00 0.00 0.00 0.00 51.96 51.34 1ow1 s ALA 3578Cb -0.15 -2.42 -0.03 0.00 0.00 0.00 0.00 23.12 20.52 1ow1 s ALA 3578CO -0.01 -0.14 -0.19 -0.51 0.00 0.00 0.00 175.76 174.91 1ow1 s LEU 3579N 0.97 2.27 0.70 0.00 1.43 -0.51 -2.18 118.68 121.35 1ow1 s LEU 3579Ca 0.13 -0.64 -0.13 0.00 -1.03 0.00 0.00 54.13 52.46 1ow1 s LEU 3579Cb -0.14 -0.80 0.02 0.00 0.03 0.00 0.00 46.19 45.31 1ow1 s LEU 3579CO 0.05 0.04 1.09 -2.16 0.23 0.00 0.00 176.35 175.59 1ow1 s PRO 3580N -1.74 2.70 0.19 1.29 0.04 -1.26 -0.50 135.00 135.71 1ow1 s PRO 3580Ca 0.04 1.20 -0.12 0.00 0.04 0.00 0.00 61.00 62.16 1ow1 s PRO 3580Cb -0.10 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1ow1 s PRO 3580CO 0.03 -1.30 0.40 0.00 0.04 0.00 0.00 177.00 176.17 1ow1 s GLY 3582N -2.95 -0.03 0.28 0.00 0.00 -1.26 -4.62 107.32 98.75 1ow1 s GLY 3582Ca 0.16 -0.19 0.15 0.00 0.00 0.00 0.00 44.72 44.83 1ow1 s GLY 3582CO 0.01 0.60 1.52 0.07 0.00 0.00 0.00 173.10 175.30 1ow1 h ARG 3583N 2.00 0.00 -3.73 2.90 0.11 -1.99 -3.44 114.38 110.22 1ow1 h ARG 3583Ca -0.26 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.63 1ow1 h ARG 3583Cb 1.23 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 32.26 1ow1 h ARG 3583CO 0.30 0.54 -0.02 0.16 0.10 0.00 0.00 179.97 181.06 1ow1 s ASP 3584N -6.50 0.65 0.18 0.08 1.47 -1.26 -5.02 116.67 106.26 1ow1 s ASP 3584Ca 0.02 -1.40 -0.14 0.00 1.18 0.00 0.00 52.55 52.21 1ow1 s ASP 3584Cb 0.09 0.74 0.16 0.00 -0.34 0.00 0.00 42.92 43.57 1ow1 s ASP 3584CO 0.74 -1.46 1.70 -0.61 0.68 0.00 0.00 175.17 176.22 1ow1 h GLN 3585N 2.05 0.14 -0.62 2.11 5.75 -1.99 0.48 115.11 123.03 1ow1 h GLN 3585Ca -0.30 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.19 1ow1 h GLN 3585Cb 1.24 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.73 1ow1 h GLN 3585CO 0.39 0.09 0.36 1.49 -2.65 0.00 0.00 178.83 178.52 1ow1 h GLU 3586N 0.14 0.86 -0.52 1.69 4.81 -2.00 -1.24 114.58 118.33 1ow1 h GLU 3586Ca 0.23 -0.09 -0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1ow1 h GLU 3586Cb 0.33 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1ow1 h GLU 3586CO -0.36 0.63 0.05 0.22 -0.73 0.00 0.00 179.01 178.82 1ow1 h ASP 3587N 0.85 0.87 -0.81 1.04 3.58 -1.82 -2.04 116.42 118.07 1ow1 h ASP 3587Ca 0.22 -0.28 0.04 0.00 0.42 0.00 0.00 57.03 57.43 1ow1 h ASP 3587Cb 0.01 -0.23 -0.05 0.00 1.72 0.00 0.00 39.33 40.78 1ow1 h ASP 3587CO -0.04 0.93 0.52 0.58 -2.88 0.00 0.00 179.24 178.35 1ow1 h VAL 3588N 0.77 1.11 -0.56 2.25 2.07 -0.58 0.12 116.25 121.43 1ow1 h VAL 3588Ca 0.15 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1ow1 h VAL 3588Cb 0.46 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 1ow1 h VAL 3588CO 0.02 0.18 0.31 0.58 0.02 0.00 0.00 177.57 178.68 1ow1 h VAL 3589N 1.00 1.18 -0.51 2.57 2.07 -0.92 0.60 116.25 122.24 1ow1 h VAL 3589Ca 0.33 -0.45 -0.08 0.00 0.82 0.00 0.00 66.70 67.33 1ow1 h VAL 3589Cb 0.04 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 1ow1 h VAL 3589CO -0.12 0.19 0.02 -1.28 0.02 0.00 0.00 177.57 176.39 1ow1 h SER 3590N 0.75 0.87 -0.06 0.57 0.87 -0.64 -0.39 113.55 115.52 1ow1 h SER 3590Ca 0.20 -0.30 -0.11 0.00 -1.23 0.00 0.00 61.79 60.35 1ow1 h SER 3590Cb 0.03 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1ow1 h SER 3590CO -0.03 0.95 -0.31 1.56 -0.53 0.00 0.00 176.83 178.47 1ow1 h GLN 3591N 0.76 0.53 -0.44 2.24 1.08 -0.59 -1.53 115.11 117.15 1ow1 h GLN 3591Ca 0.15 -0.23 -0.13 0.00 -1.45 0.00 0.00 58.65 56.99 1ow1 h GLN 3591Cb 0.50 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 1ow1 h GLN 3591CO 0.02 0.78 -0.22 1.15 -0.95 0.00 0.00 178.83 179.62 1ow1 h THR 3592N 0.46 1.27 -0.82 -0.54 2.02 -0.68 -1.36 112.91 113.27 1ow1 h THR 3592Ca 0.06 -1.38 -0.03 0.00 0.77 0.00 0.00 66.41 65.83 1ow1 h THR 3592Cb 0.77 1.21 -0.04 0.00 -1.74 0.00 0.00 68.15 68.35 1ow1 h THR 3592CO 0.06 0.47 0.37 -0.08 0.37 0.00 0.00 175.52 176.71 1ow1 h GLU 3593N 0.76 1.19 -0.17 6.66 4.57 -0.86 -1.42 114.58 125.30 1ow1 h GLU 3593Ca 0.10 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 1ow1 h GLU 3593Cb 0.79 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 1ow1 h GLU 3593CO 0.07 0.92 0.07 1.03 -1.18 0.00 0.00 179.01 179.92 1ow1 h SER 3594N 1.17 0.24 -0.69 1.04 0.87 -1.03 0.13 113.55 115.27 1ow1 h SER 3594Ca 0.28 -0.16 0.06 0.00 -1.23 0.00 0.00 61.79 60.75 1ow1 h SER 3594Cb 0.14 -0.06 -0.06 0.00 -0.44 0.00 0.00 62.40 61.99 1ow1 h SER 3594CO -0.03 0.33 0.39 0.25 -0.53 0.00 0.00 176.83 177.23 1ow1 h LEU 3595N 0.13 0.57 0.16 2.23 5.85 -0.94 0.25 115.31 123.57 1ow1 h LEU 3595Ca 0.06 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1ow1 h LEU 3595Cb 0.16 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1ow1 h LEU 3595CO -0.01 0.37 -0.08 0.11 -0.34 0.00 0.00 178.44 178.49 1ow1 h LYS 3596N 0.71 -0.21 -0.09 1.25 1.57 -1.02 0.11 116.57 118.89 1ow1 h LYS 3596Ca 0.31 0.01 -0.23 0.00 -1.87 0.00 0.00 60.65 58.87 1ow1 h LYS 3596Cb 0.20 0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.57 1ow1 h LYS 3596CO -0.19 0.18 -0.87 0.00 -0.57 0.00 0.00 179.45 178.00 1ow1 h ALA 3597N 0.03 0.29 0.00 3.86 0.00 -0.62 -0.31 119.26 122.52 1ow1 h ALA 3597Ca -0.02 -0.64 -0.23 0.00 0.00 0.00 0.00 54.91 54.01 1ow1 h ALA 3597Cb 0.49 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1ow1 h ALA 3597CO 0.04 0.71 -1.96 0.00 0.00 0.00 0.00 179.25 178.04 1ow1 n ALA 3598N -2.60 1.87 -0.03 0.00 0.00 0.86 -4.32 120.51 116.29 1ow1 n ALA 3598Ca -0.08 -0.89 -0.04 0.00 0.00 0.00 0.00 53.44 52.43 1ow1 n ALA 3598Cb 0.79 -0.59 -0.01 0.00 0.00 0.00 0.00 19.45 19.64 1ow1 n ALA 3598CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ow1 n PHE 3599N -2.73 0.00 0.10 0.00 3.01 -1.00 -4.33 117.46 112.51 1ow1 n PHE 3599Ca -0.19 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.14 1ow1 n PHE 3599Cb 0.94 -0.24 -0.07 0.00 -0.01 0.00 0.00 39.48 40.10 1ow1 n PHE 3599CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1ow1 h ILE 3600N -0.48 0.88 -0.54 4.37 2.04 -0.85 -0.78 117.51 122.15 1ow1 h ILE 3600Ca 0.00 -0.01 0.04 0.00 1.00 0.00 0.00 64.86 65.89 1ow1 h ILE 3600Cb 0.48 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 37.40 1ow1 h ILE 3600CO 0.00 0.00 0.29 0.74 0.00 0.00 0.00 178.15 179.18 1ow1 h THR 3601N -0.18 0.98 0.23 -0.27 2.02 -1.26 -0.22 112.91 114.22 1ow1 h THR 3601Ca -0.02 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 1ow1 h THR 3601Cb 0.14 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1ow1 h THR 3601CO 0.03 0.10 -0.12 0.22 0.37 0.00 0.00 175.52 176.12 1ow1 h TYR 3602N 0.56 -0.31 -0.82 3.16 3.20 -1.71 -0.56 116.97 120.49 1ow1 h TYR 3602Ca 0.23 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.06 1ow1 h TYR 3602Cb 0.11 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.45 1ow1 h TYR 3602CO -0.09 -0.19 0.38 -0.07 -1.64 0.00 0.00 178.16 176.55 1ow1 h LEU 3603N -0.33 1.09 -0.59 2.82 3.38 -0.89 -1.48 115.31 119.30 1ow1 h LEU 3603Ca -0.03 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.66 1ow1 h LEU 3603Cb 0.26 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1ow1 h LEU 3603CO 0.04 0.92 -0.39 1.56 0.09 0.00 0.00 178.44 180.67 1ow1 h GLN 3604N 1.17 0.69 -0.41 1.13 4.20 -0.94 0.10 115.11 121.05 1ow1 h GLN 3604Ca 0.28 -0.35 -0.09 0.00 0.06 0.00 0.00 58.65 58.55 1ow1 h GLN 3604Cb 0.13 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 1ow1 h GLN 3604CO -0.03 0.96 -0.10 0.00 -0.67 0.00 0.00 178.83 178.98 1ow1 h ALA 3605N 1.00 1.05 -0.01 3.87 0.00 -0.83 -2.42 119.26 121.92 1ow1 h ALA 3605Ca 0.05 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1ow1 h ALA 3605Cb 0.92 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1ow1 h ALA 3605CO 0.08 0.58 -0.21 1.63 0.00 0.00 0.00 179.25 181.34 1ow1 n LYS 3606N -4.17 0.92 -3.68 0.00 4.76 -0.58 -4.95 118.16 110.46 1ow1 n LYS 3606Ca 0.01 -0.52 -0.26 0.00 -2.87 0.00 0.00 58.31 54.67 1ow1 n LYS 3606Cb 0.35 -1.49 0.03 0.00 -1.84 0.00 0.00 35.03 32.09 1ow1 n LYS 3606CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1ow1 n GLN 3607N -0.58 -2.63 -4.09 1.97 6.02 0.20 -4.86 117.38 113.41 1ow1 n GLN 3607Ca 0.13 0.54 -0.10 0.00 -0.01 0.00 0.00 57.00 57.56 1ow1 n GLN 3607Cb 0.34 -4.65 -0.08 0.00 1.02 0.00 0.00 30.24 26.87 1ow1 n GLN 3607CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ow1 s ALA 3608N -3.59 0.53 0.02 -1.58 0.00 -0.28 -1.12 121.76 115.75 1ow1 s ALA 3608Ca 0.27 -1.28 0.07 0.00 0.00 0.00 0.00 51.96 51.02 1ow1 s ALA 3608Cb -0.09 1.08 -0.03 0.00 0.00 0.00 0.00 23.12 24.09 1ow1 s ALA 3608CO 0.84 -0.64 -0.19 0.00 0.00 0.00 0.00 175.76 175.77 1ow1 s ALA 3609N -4.06 2.53 0.55 0.00 0.00 0.15 -4.60 121.76 116.33 1ow1 s ALA 3609Ca 0.27 -1.16 -0.18 0.00 0.00 0.00 0.00 51.96 50.89 1ow1 s ALA 3609Cb 0.05 -0.73 -0.05 0.00 0.00 0.00 0.00 23.12 22.38 1ow1 s ALA 3609CO 0.06 0.56 1.07 0.20 0.00 0.00 0.00 175.76 177.66 1ow1 s GLY 3610N -1.22 2.38 -0.07 0.00 0.00 0.82 -0.62 107.32 108.61 1ow1 s GLY 3610Ca 0.13 0.58 0.01 0.00 0.00 0.00 0.00 44.72 45.44 1ow1 s GLY 3610CO 0.04 0.91 -0.08 -0.42 0.00 0.00 0.00 173.10 173.55 1ow1 s ILE 3611N -2.12 0.86 -0.13 0.90 -1.09 -0.17 -0.63 121.20 118.81 1ow1 s ILE 3611Ca 0.67 -0.28 -0.01 0.00 -2.23 0.00 0.00 60.65 58.81 1ow1 s ILE 3611Cb -0.18 -0.84 0.03 0.00 -1.58 0.00 0.00 42.46 39.89 1ow1 s ILE 3611CO 0.29 0.31 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.63 1ow1 s ILE 3612N 1.05 0.93 -0.10 2.92 1.01 -0.54 -3.42 121.20 123.06 1ow1 s ILE 3612Ca -0.08 -0.38 -0.19 0.00 0.00 0.00 0.00 60.65 59.99 1ow1 s ILE 3612Cb -0.14 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.22 1ow1 s ILE 3612CO -0.00 0.22 0.52 0.20 0.00 0.00 0.00 174.94 175.88 1ow1 s ASN 3613N 1.73 6.76 -0.25 3.58 0.01 -1.26 -0.33 114.94 125.18 1ow1 s ASN 3613Ca 0.03 0.91 -0.03 0.00 -0.71 0.00 0.00 52.86 53.05 1ow1 s ASN 3613Cb -0.14 -2.31 0.01 0.00 0.41 0.00 0.00 41.25 39.22 1ow1 s ASN 3613CO -0.08 -0.00 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.79 1ow1 s VAL 3614N 0.55 3.25 0.37 1.60 1.01 -0.23 -5.00 120.40 121.96 1ow1 s VAL 3614Ca 0.28 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.45 1ow1 s VAL 3614Cb -0.16 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 1ow1 s VAL 3614CO 0.12 0.26 0.65 -2.16 0.00 0.00 0.00 175.10 173.97 1ow1 s PRO 3615N 1.41 3.59 -0.01 2.72 0.04 -1.26 -2.65 135.00 138.84 1ow1 s PRO 3615Ca 0.03 0.04 -0.16 0.00 0.04 0.00 0.00 61.00 60.95 1ow1 s PRO 3615Cb -0.16 -2.54 -0.06 0.00 0.04 0.00 0.00 34.50 31.79 1ow1 s PRO 3615CO -0.03 0.05 0.44 -0.80 0.04 0.00 0.00 177.00 176.70 1ow1 s ASN 3616N -3.64 6.82 0.23 6.66 0.01 -1.26 -4.99 114.94 118.77 1ow1 s ASN 3616Ca 0.45 0.97 -0.32 0.00 -0.71 0.00 0.00 52.86 53.25 1ow1 s ASN 3616Cb -0.10 -2.27 -0.13 0.00 0.41 0.00 0.00 41.25 39.16 1ow1 s ASN 3616CO 0.36 0.26 1.56 -2.65 -1.51 0.00 0.00 177.10 175.12 1ow1 n PRO 3617N 2.15 2.39 0.00 -0.60 -0.02 -1.26 -1.93 135.00 135.74 1ow1 n PRO 3617Ca -0.12 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1ow1 n PRO 3617Cb 0.52 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1ow1 n PRO 3617CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ow1 n GLY 3618N 2.76 3.26 3.31 -1.23 0.00 -1.26 -5.04 105.19 106.99 1ow1 n GLY 3618Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 1ow1 n GLY 3618CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ow1 s SER 3619N -1.07 3.17 -0.05 1.61 0.15 -0.81 -5.00 113.70 111.69 1ow1 s SER 3619Ca 0.00 -0.46 0.21 0.00 0.70 0.00 0.00 55.95 56.40 1ow1 s SER 3619Cb 0.00 -0.65 0.69 0.00 -1.71 0.00 0.00 66.02 64.35 1ow1 s SER 3619CO 0.00 0.28 1.59 -0.46 1.20 0.00 0.00 173.24 175.85 1ow1 n ASN 3620N 2.70 4.36 -4.86 5.45 0.23 -1.26 -4.24 115.26 117.63 1ow1 n ASN 3620Ca -0.17 -2.20 -0.33 0.00 -0.53 0.00 0.00 54.58 51.34 1ow1 n ASN 3620Cb 0.52 -0.54 -0.05 0.00 -2.08 0.00 0.00 39.78 37.62 1ow1 n ASN 3620CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ow1 s GLN 3621N -1.39 3.86 0.20 -3.83 -2.07 -1.26 -5.02 119.66 110.15 1ow1 s GLN 3621Ca 0.51 0.34 -0.33 0.00 -1.82 0.00 0.00 55.36 54.06 1ow1 s GLN 3621Cb 0.29 -2.79 -0.13 0.00 -1.09 0.00 0.00 33.01 29.30 1ow1 s GLN 3621CO 0.30 0.40 1.64 -0.35 -1.32 0.00 0.00 175.29 175.96 1ow1 n PRO 3622N 0.30 2.49 0.00 9.60 -0.04 -1.26 -4.63 135.00 141.46 1ow1 n PRO 3622Ca -0.02 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.33 1ow1 n PRO 3622Cb 0.52 -2.70 0.00 0.00 -0.04 0.00 0.00 33.50 31.28 1ow1 n PRO 3622CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ow1 n ALA 3623N 3.52 0.97 -2.44 0.55 0.00 -1.24 -4.77 120.51 117.11 1ow1 n ALA 3623Ca 0.16 -0.05 -0.23 0.00 0.00 0.00 0.00 53.44 53.31 1ow1 n ALA 3623Cb 0.32 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.67 1ow1 n ALA 3623CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1ow1 s TYR 3624N -0.37 2.07 -0.01 0.00 1.51 -1.09 -0.05 117.35 119.42 1ow1 s TYR 3624Ca 0.00 -0.41 0.02 0.00 -1.01 0.00 0.00 57.07 55.67 1ow1 s TYR 3624Cb 0.00 -0.98 -0.00 0.00 -0.11 0.00 0.00 41.96 40.87 1ow1 s TYR 3624CO 0.00 0.50 -0.07 0.54 -1.11 0.00 0.00 175.55 175.40 1ow1 s VAL 3625N -2.22 0.61 -0.22 0.71 0.11 -0.48 -1.07 120.40 117.84 1ow1 s VAL 3625Ca 0.22 -0.31 -0.08 0.00 -2.93 0.00 0.00 61.98 58.89 1ow1 s VAL 3625Cb -0.05 -0.53 -0.04 0.00 -1.53 0.00 0.00 36.38 34.23 1ow1 s VAL 3625CO 0.10 0.18 0.08 -0.76 -3.33 0.00 0.00 175.10 171.37 1ow1 s LEU 3626N -0.02 3.72 -0.29 2.54 1.43 0.55 -1.71 118.68 124.90 1ow1 s LEU 3626Ca 0.01 -0.02 -0.03 0.00 -1.03 0.00 0.00 54.13 53.06 1ow1 s LEU 3626Cb -0.05 -1.97 0.04 0.00 0.03 0.00 0.00 46.19 44.24 1ow1 s LEU 3626CO -0.00 0.08 0.01 -1.10 0.23 0.00 0.00 176.35 175.57 1ow1 s GLN 3627N 0.93 2.65 -0.41 1.70 -0.21 0.03 -1.47 119.66 122.89 1ow1 s GLN 3627Ca 0.04 -1.12 -0.12 0.00 0.02 0.00 0.00 55.36 54.18 1ow1 s GLN 3627Cb -0.14 -3.19 0.05 0.00 1.00 0.00 0.00 33.01 30.73 1ow1 s GLN 3627CO 0.03 -0.54 0.27 0.42 -2.12 0.00 0.00 175.29 173.35 1ow1 s ILE 3628N 1.32 4.71 -0.09 1.08 1.01 0.20 -0.84 121.20 128.59 1ow1 s ILE 3628Ca -0.02 -1.02 -0.07 0.00 0.00 0.00 0.00 60.65 59.54 1ow1 s ILE 3628Cb -0.19 -3.73 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 1ow1 s ILE 3628CO -0.01 -0.39 0.17 -0.36 0.00 0.00 0.00 174.94 174.35 1ow1 s PHE 3629N 1.55 3.60 0.72 3.97 0.40 0.62 -0.12 117.98 128.73 1ow1 s PHE 3629Ca 0.03 0.55 -0.05 0.00 -0.60 0.00 0.00 56.93 56.86 1ow1 s PHE 3629Cb -0.21 -1.96 0.10 0.00 0.51 0.00 0.00 43.02 41.46 1ow1 s PHE 3629CO 0.06 0.72 1.01 -1.25 0.70 0.00 0.00 175.22 176.46 1ow1 s PRO 3630N -1.17 1.83 0.17 0.24 0.04 -1.26 -0.79 135.00 134.07 1ow1 s PRO 3630Ca 0.18 -0.67 -0.32 0.00 0.04 0.00 0.00 61.00 60.23 1ow1 s PRO 3630Cb -0.12 -2.23 -0.11 0.00 0.04 0.00 0.00 34.50 32.07 1ow1 s PRO 3630CO 0.07 -1.40 1.78 -2.30 0.04 0.00 0.00 177.00 175.18 1ow1 n PRO 3631N -2.92 2.80 -3.70 0.56 -0.02 -1.26 -4.74 135.00 125.72 1ow1 n PRO 3631Ca 0.12 1.01 -0.07 0.00 -2.02 0.00 0.00 63.50 62.54 1ow1 n PRO 3631Cb 0.60 -2.89 0.03 0.00 -0.02 0.00 0.00 33.50 31.22 1ow1 n PRO 3631CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ow1 h GLU 3633N 0.00 0.84 -0.27 0.00 5.08 -1.99 -0.51 114.58 117.72 1ow1 h GLU 3633Ca -0.31 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 57.99 1ow1 h GLU 3633Cb 1.19 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 1ow1 h GLU 3633CO 0.40 0.55 0.14 0.35 -1.00 0.00 0.00 179.01 179.45 1ow1 h PHE 3634N 0.86 0.39 -0.52 4.33 3.57 -1.96 0.20 116.94 123.80 1ow1 h PHE 3634Ca 0.31 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.69 1ow1 h PHE 3634Cb 0.10 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 1ow1 h PHE 3634CO -0.05 0.34 -0.11 0.66 -2.23 0.00 0.00 178.31 176.93 1ow1 h SER 3635N 0.32 1.00 -0.76 0.41 4.64 -1.79 -2.21 113.55 115.16 1ow1 h SER 3635Ca 0.10 -0.35 -0.04 0.00 -0.47 0.00 0.00 61.79 61.02 1ow1 h SER 3635Cb 0.09 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 61.88 1ow1 h SER 3635CO -0.01 1.12 0.33 -0.33 -0.87 0.00 0.00 176.83 177.07 1ow1 h GLU 3636N 0.86 1.12 0.38 4.77 5.08 -0.93 -0.63 114.58 125.23 1ow1 h GLU 3636Ca 0.13 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1ow1 h GLU 3636Cb 0.67 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ow1 h GLU 3636CO 0.05 0.89 -0.18 1.03 -1.00 0.00 0.00 179.01 179.80 1ow1 h SER 3637N 1.08 -0.43 0.16 1.42 0.87 -0.74 -1.27 113.55 114.64 1ow1 h SER 3637Ca 0.26 -0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 60.65 1ow1 h SER 3637Cb 0.17 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 1ow1 h SER 3637CO -0.03 -0.27 -0.56 0.45 -0.53 0.00 0.00 176.83 175.89 1ow1 h HIS 3638N -0.55 0.53 -0.12 2.24 3.86 -1.35 -2.44 115.15 117.33 1ow1 h HIS 3638Ca -0.05 -0.19 -0.12 0.00 -1.16 0.00 0.00 60.37 58.85 1ow1 h HIS 3638Cb 0.41 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 1ow1 h HIS 3638CO -0.04 0.88 -0.45 -0.07 0.86 0.00 0.00 177.93 179.11 1ow1 h LEU 3639N 0.32 0.30 -0.78 2.43 3.38 -1.12 0.44 115.31 120.28 1ow1 h LEU 3639Ca 0.00 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1ow1 h LEU 3639Cb 1.08 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1ow1 h LEU 3639CO 0.10 0.71 -0.11 0.28 0.09 0.00 0.00 178.44 179.51 1ow1 h SER 3640N 0.23 0.80 0.07 -0.43 0.02 -1.09 0.34 113.55 113.50 1ow1 h SER 3640Ca 0.02 -0.24 -0.27 0.00 -0.84 0.00 0.00 61.79 60.45 1ow1 h SER 3640Cb 0.89 -0.22 0.03 0.00 0.14 0.00 0.00 62.40 63.24 1ow1 h SER 3640CO 0.07 0.93 -1.10 -0.09 -1.14 0.00 0.00 176.83 175.51 1ow1 h ARG 3641N 0.73 0.62 0.00 3.45 2.43 -1.15 -3.26 114.38 117.20 1ow1 h ARG 3641Ca 0.12 -0.76 -0.32 0.00 -0.81 0.00 0.00 59.98 58.22 1ow1 h ARG 3641Cb 0.60 0.24 -0.06 0.00 -0.42 0.00 0.00 29.97 30.34 1ow1 h ARG 3641CO 0.04 1.33 -1.91 1.28 -1.51 0.00 0.00 179.97 179.20 1ow1 n LEU 3642N -3.87 0.70 -2.89 3.80 4.77 0.12 -4.77 117.00 114.86 1ow1 n LEU 3642Ca -0.13 0.29 -0.13 0.00 -0.03 0.00 0.00 56.01 56.02 1ow1 n LEU 3642Cb 0.91 0.22 0.03 0.00 -2.33 0.00 0.00 43.42 42.25 1ow1 n LEU 3642CO 0.56 0.44 0.09 0.00 -1.33 0.00 0.00 177.39 177.15 1ow1 n ALA 3643N -2.63 0.01 -0.23 -1.18 0.00 0.12 -5.00 120.51 111.60 1ow1 n ALA 3643Ca -0.22 -2.09 0.13 0.00 0.00 0.00 0.00 53.44 51.26 1ow1 n ALA 3643Cb 1.08 -1.12 0.42 0.00 0.00 0.00 0.00 19.45 19.83 1ow1 n ALA 3643CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ow1 h PRO 3644N 3.48 0.58 -0.60 0.00 0.13 -1.48 -1.00 132.00 133.10 1ow1 h PRO 3644Ca -0.05 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 64.95 1ow1 h PRO 3644Cb 1.02 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 32.00 1ow1 h PRO 3644CO 0.31 0.38 0.03 0.38 -0.23 0.00 0.00 178.00 178.87 1ow1 h ASP 3645N 0.59 0.99 -0.35 1.44 2.03 -1.91 0.12 116.42 119.33 1ow1 h ASP 3645Ca 0.42 -0.26 -0.09 0.00 -0.73 0.00 0.00 57.03 56.37 1ow1 h ASP 3645Cb 0.77 -0.26 -0.01 0.00 -0.83 0.00 0.00 39.33 39.00 1ow1 h ASP 3645CO -0.18 1.03 -0.14 0.25 -1.03 0.00 0.00 179.24 179.17 1ow1 h LEU 3646N 0.94 0.73 -0.38 0.15 5.85 -1.58 -2.87 115.31 118.15 1ow1 h LEU 3646Ca 0.17 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.51 1ow1 h LEU 3646Cb 0.51 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1ow1 h LEU 3646CO 0.02 0.96 0.24 0.25 -0.34 0.00 0.00 178.44 179.58 1ow1 h LEU 3647N 0.50 0.41 -1.85 2.25 5.85 -1.01 -1.99 115.31 119.47 1ow1 h LEU 3647Ca 0.08 -0.01 0.12 0.00 0.84 0.00 0.00 57.88 58.92 1ow1 h LEU 3647Cb 0.67 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 1ow1 h LEU 3647CO 0.05 0.30 0.36 0.00 -0.34 0.00 0.00 178.44 178.80 1ow1 h ALA 3648N 1.15 2.26 0.00 1.25 0.00 -0.88 0.53 119.26 123.58 1ow1 h ALA 3648Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ow1 h ALA 3648Cb -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1ow1 h ALA 3648CO -0.05 -0.40 -0.12 -1.13 0.00 0.00 0.00 179.25 177.56 1ow1 n SER 3649N -4.43 0.41 0.00 0.00 3.41 -0.77 -4.32 113.62 107.91 1ow1 n SER 3649Ca 0.09 0.40 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 1ow1 n SER 3649Cb 0.47 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1ow1 n SER 3649CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1ow1 n ILE 3650N -1.83 0.00 -1.68 -1.33 -5.35 -0.21 -4.73 119.36 104.23 1ow1 n ILE 3650Ca 0.06 0.00 -0.50 0.00 -0.27 0.00 0.00 62.75 62.04 1ow1 n ILE 3650Cb 0.38 -0.34 -0.05 0.00 -1.74 0.00 0.00 39.64 37.89 1ow1 n ILE 3650CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1ow1 n SER 3651N -1.44 3.06 -1.76 7.28 2.88 0.17 -0.49 113.62 123.31 1ow1 n SER 3651Ca 0.00 1.02 -0.15 0.00 -1.33 0.00 0.00 58.87 58.41 1ow1 n SER 3651Cb 0.24 -1.32 -0.04 0.00 -0.75 0.00 0.00 64.21 62.33 1ow1 n SER 3651CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1ow1 n ASN 3652N 5.54 -4.11 0.00 -3.46 5.03 -1.26 -4.72 115.26 112.29 1ow1 n ASN 3652Ca 0.22 0.29 0.00 0.00 0.87 0.00 0.00 54.58 55.96 1ow1 n ASN 3652Cb 0.25 -3.66 0.00 0.00 -1.02 0.00 0.00 39.78 35.35 1ow1 n ASN 3652CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1ow1 n ILE 3653N -2.51 0.00 -3.82 2.41 5.41 0.36 -5.09 119.36 116.12 1ow1 n ILE 3653Ca -0.16 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.46 1ow1 n ILE 3653Cb 0.54 -0.73 -0.14 0.00 -0.71 0.00 0.00 39.64 38.60 1ow1 n ILE 3653CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1ow1 s SER 3654N -4.24 -0.05 0.43 4.38 1.04 -0.38 -5.05 113.70 109.84 1ow1 s SER 3654Ca 0.00 0.13 -0.25 0.00 0.48 0.00 0.00 55.95 56.31 1ow1 s SER 3654Cb 0.00 0.10 -0.09 0.00 0.10 0.00 0.00 66.02 66.13 1ow1 s SER 3654CO 0.00 -0.06 1.33 -2.65 0.98 0.00 0.00 173.24 172.85 1ow1 n PRO 3655N 3.42 2.05 -3.81 4.02 -0.02 -1.26 -4.80 135.00 134.60 1ow1 n PRO 3655Ca -0.17 0.73 -0.05 0.00 -2.02 0.00 0.00 63.50 61.99 1ow1 n PRO 3655Cb 0.57 -2.48 -0.00 0.00 -0.02 0.00 0.00 33.50 31.57 1ow1 n PRO 3655CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1ow1 s HIS 3656N -1.20 -0.06 0.04 6.00 -3.43 -1.26 -4.58 115.29 110.80 1ow1 s HIS 3656Ca 0.61 -0.36 0.02 0.00 -0.80 0.00 0.00 55.06 54.53 1ow1 s HIS 3656Cb -0.48 0.70 -0.02 0.00 -1.43 0.00 0.00 32.58 31.34 1ow1 s HIS 3656CO 0.58 -1.05 -0.07 -0.51 -2.00 0.00 0.00 174.74 171.69 1ow1 s LEU 3657N -3.06 2.27 -0.17 5.38 1.43 -0.93 -4.12 118.68 119.49 1ow1 s LEU 3657Ca 0.15 -0.58 -0.01 0.00 -1.03 0.00 0.00 54.13 52.66 1ow1 s LEU 3657Cb -0.03 -0.11 -0.00 0.00 0.03 0.00 0.00 46.19 46.07 1ow1 s LEU 3657CO 0.05 -0.24 -0.12 -0.32 0.23 0.00 0.00 176.35 175.95 1ow1 s MET 3658N -1.74 3.29 -0.17 1.70 -2.45 0.03 -0.56 119.30 119.40 1ow1 s MET 3658Ca -0.09 -0.70 -0.02 0.00 -1.25 0.00 0.00 55.69 53.62 1ow1 s MET 3658Cb -0.09 -2.74 -0.02 0.00 1.25 0.00 0.00 34.83 33.24 1ow1 s MET 3658CO -0.00 -0.02 -0.08 0.42 1.05 0.00 0.00 175.02 176.39 1ow1 s ILE 3659N 0.94 3.38 -0.24 10.11 1.01 0.42 -0.28 121.20 136.54 1ow1 s ILE 3659Ca -0.02 -0.53 -0.04 0.00 0.00 0.00 0.00 60.65 60.06 1ow1 s ILE 3659Cb -0.15 -2.47 -0.00 0.00 0.01 0.00 0.00 42.46 39.85 1ow1 s ILE 3659CO -0.01 0.48 -0.02 -0.69 0.00 0.00 0.00 174.94 174.70 1ow1 s VAL 3660N 0.71 3.41 -0.17 2.92 1.01 -0.02 -0.26 120.40 127.99 1ow1 s VAL 3660Ca -0.04 -0.60 -0.08 0.00 0.00 0.00 0.00 61.98 61.26 1ow1 s VAL 3660Cb -0.15 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 1ow1 s VAL 3660CO 0.02 0.33 0.11 -0.63 0.00 0.00 0.00 175.10 174.94 1ow1 s ILE 3661N 1.46 5.26 0.00 2.22 1.01 0.20 -0.79 121.20 130.57 1ow1 s ILE 3661Ca 0.04 0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.84 1ow1 s ILE 3661Cb -0.15 -3.36 -0.01 0.00 0.01 0.00 0.00 42.46 38.95 1ow1 s ILE 3661CO -0.02 0.50 -0.06 0.00 0.00 0.00 0.00 174.94 175.36 1ow1 s ALA 3662N -0.04 0.45 -0.65 9.38 0.00 -0.69 -0.99 121.76 129.21 1ow1 s ALA 3662Ca 0.09 -0.30 -0.24 0.00 0.00 0.00 0.00 51.96 51.50 1ow1 s ALA 3662Cb -0.12 -0.09 0.05 0.00 0.00 0.00 0.00 23.12 22.97 1ow1 s ALA 3662CO 0.00 0.09 1.06 -1.54 0.00 0.00 0.00 175.76 175.37 1ow1 s SER 3663N -0.33 6.22 0.00 0.00 1.04 -1.03 -1.39 113.70 118.21 1ow1 s SER 3663Ca 0.00 -0.64 0.30 0.00 0.48 0.00 0.00 55.95 56.09 1ow1 s SER 3663Cb -0.03 -2.47 1.47 0.00 0.10 0.00 0.00 66.02 65.09 1ow1 s SER 3663CO -0.00 -1.51 1.98 0.55 0.98 0.00 0.00 173.24 175.25