#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k9t s ALA 25 N 0.00 1.29 1.03 0.00 0.00 -1.26 -4.70 121.76 118.11 1k9t s ALA 25 Ca 0.00 0.43 -0.12 0.00 0.00 0.00 0.00 51.96 52.27 1k9t s ALA 25 Cb 0.00 -3.39 0.21 0.00 0.00 0.00 0.00 23.12 19.93 1k9t s ALA 25 CO 0.00 -2.79 1.08 -2.14 0.00 0.00 0.00 175.76 171.90 1k9t s PRO 26 N -4.66 0.18 0.89 0.00 0.02 -1.26 -4.80 135.00 125.37 1k9t s PRO 26 Ca 0.66 0.97 -0.12 0.00 0.02 0.00 0.00 61.00 62.53 1k9t s PRO 26 Cb -0.22 -1.67 0.12 0.00 0.02 0.00 0.00 34.50 32.75 1k9t s PRO 26 CO 0.59 -3.02 1.10 0.20 -0.33 0.00 0.00 177.00 175.54 1k9t s GLY 27 N -2.86 1.60 -0.31 0.52 0.00 0.20 -4.69 107.32 101.78 1k9t s GLY 27 Ca 0.66 -0.23 -0.26 0.00 0.00 0.00 0.00 44.72 44.90 1k9t s GLY 27 CO 0.61 0.27 0.91 1.25 0.00 0.00 0.00 173.10 176.14 1k9t s LYS 28 N -5.06 3.99 0.65 2.90 2.20 -1.26 -4.77 119.74 118.39 1k9t s LYS 28 Ca 0.63 0.78 -0.15 0.00 -0.36 0.00 0.00 55.97 56.87 1k9t s LYS 28 Cb -0.17 -3.74 -0.00 0.00 -1.51 0.00 0.00 37.83 32.41 1k9t s LYS 28 CO 0.56 -0.78 1.09 -1.25 -0.36 0.00 0.00 175.35 174.61 1k9t s PRO 29 N 3.25 2.89 -0.20 4.03 0.04 -1.26 -4.67 135.00 139.08 1k9t s PRO 29 Ca 0.38 1.30 -0.03 0.00 0.04 0.00 0.00 61.00 62.69 1k9t s PRO 29 Cb -0.13 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 1k9t s PRO 29 CO 0.14 -1.17 -0.06 0.99 0.04 0.00 0.00 177.00 176.94 1k9t s THR 30 N -2.45 3.29 0.19 1.26 2.01 0.03 -4.30 115.64 115.67 1k9t s THR 30 Ca 0.65 -0.53 -0.30 0.00 0.31 0.00 0.00 61.69 61.81 1k9t s THR 30 Cb -0.19 -2.47 -0.09 0.00 0.01 0.00 0.00 72.50 69.76 1k9t s THR 30 CO 0.42 0.45 1.37 -0.63 -0.69 0.00 0.00 174.62 175.54 1k9t s ILE 31 N 1.24 3.08 0.39 1.82 1.01 -1.26 -1.43 121.20 126.05 1k9t s ILE 31 Ca 0.03 0.85 -0.25 0.00 0.00 0.00 0.00 60.65 61.28 1k9t s ILE 31 Cb -0.14 -3.55 -0.09 0.00 0.01 0.00 0.00 42.46 38.69 1k9t s ILE 31 CO -0.02 0.11 1.15 0.00 0.00 0.00 0.00 174.94 176.18 1k9t s ALA 32 N 0.40 3.17 0.33 9.38 0.00 0.09 -4.88 121.76 130.26 1k9t s ALA 32 Ca 0.60 0.94 -0.29 0.00 0.00 0.00 0.00 51.96 53.20 1k9t s ALA 32 Cb -0.38 -3.37 -0.11 0.00 0.00 0.00 0.00 23.12 19.26 1k9t s ALA 32 CO 0.37 -0.47 1.56 0.91 0.00 0.00 0.00 175.76 178.13 1k9t n TRP 33 N 0.15 2.96 0.00 0.00 7.02 -1.26 -4.73 117.44 121.58 1k9t n TRP 33 Ca 0.04 0.33 0.00 0.00 -1.02 0.00 0.00 57.50 56.85 1k9t n TRP 33 Cb 0.47 -2.58 0.00 0.00 -2.42 0.00 0.00 31.31 26.78 1k9t n TRP 33 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1k9t n GLY 34 N 1.38 -0.37 3.77 6.99 0.00 -1.26 -5.00 105.19 110.69 1k9t n GLY 34 Ca 0.05 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.67 1k9t n GLY 34 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1k9t s ASN 35 N 0.00 6.52 0.00 1.61 2.47 -1.26 -4.90 114.94 119.37 1k9t s ASN 35 Ca 0.00 2.87 0.00 0.00 0.42 0.00 0.00 52.86 56.15 1k9t s ASN 35 Cb 0.00 -2.65 0.00 0.00 -1.45 0.00 0.00 41.25 37.15 1k9t s ASN 35 CO 0.00 -0.75 0.82 0.35 -3.72 0.00 0.00 177.10 173.79 1k9t n THR 36 N 1.08 0.67 -4.04 -5.21 -2.24 -1.26 -4.91 114.28 98.37 1k9t n THR 36 Ca 0.03 -0.76 -0.35 0.00 -2.27 0.00 0.00 64.05 60.70 1k9t n THR 36 Cb 0.40 0.70 -0.14 0.00 -2.10 0.00 0.00 70.33 69.19 1k9t n THR 36 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1k9t s LYS 37 N -0.67 3.43 0.12 -0.78 1.02 -1.26 -0.39 119.74 121.21 1k9t s LYS 37 Ca 0.00 -0.61 0.02 0.00 0.02 0.00 0.00 55.97 55.40 1k9t s LYS 37 Cb 0.00 -2.98 -0.04 0.00 -0.52 0.00 0.00 37.83 34.28 1k9t s LYS 37 CO 0.00 -0.11 -0.04 -0.06 -0.92 0.00 0.00 175.35 174.22 1k9t s PHE 38 N 1.25 0.97 0.01 3.18 0.08 0.05 -4.99 117.98 118.52 1k9t s PHE 38 Ca 0.03 -0.95 0.00 0.00 0.12 0.00 0.00 56.93 56.13 1k9t s PHE 38 Cb -0.14 -0.56 -0.01 0.00 -0.57 0.00 0.00 43.02 41.74 1k9t s PHE 38 CO -0.01 -0.18 -0.02 0.00 -0.10 0.00 0.00 175.22 174.91 1k9t s ALA 39 N -3.65 0.12 0.02 5.36 0.00 -1.26 -0.29 121.76 122.06 1k9t s ALA 39 Ca 0.15 -0.29 -0.13 0.00 0.00 0.00 0.00 51.96 51.69 1k9t s ALA 39 Cb 0.06 0.05 -0.34 0.00 0.00 0.00 0.00 23.12 22.89 1k9t s ALA 39 CO -0.02 -0.05 0.94 0.82 0.00 0.00 0.00 175.76 177.45 1k9t h ILE 40 N 4.91 1.23 -3.55 0.00 2.04 -1.34 -3.40 117.51 117.41 1k9t h ILE 40 Ca -0.28 -2.71 -0.70 0.00 1.00 0.00 0.00 64.86 62.17 1k9t h ILE 40 Cb 1.21 2.97 -0.29 0.00 -0.74 0.00 0.00 36.82 39.96 1k9t h ILE 40 CO 0.46 0.83 -0.54 -0.69 0.00 0.00 0.00 178.15 178.21 1k9t s VAL 41 N -2.60 3.87 0.36 1.67 1.01 -1.26 -1.42 120.40 122.03 1k9t s VAL 41 Ca -0.10 -1.40 -0.22 0.00 0.00 0.00 0.00 61.98 60.26 1k9t s VAL 41 Cb 0.05 -3.34 -0.10 0.00 0.00 0.00 0.00 36.38 32.99 1k9t s VAL 41 CO 0.92 -0.40 0.91 -1.61 0.00 0.00 0.00 175.10 174.92 1k9t s GLU 42 N 1.37 4.35 -0.14 2.72 2.02 -0.20 -4.88 118.70 123.94 1k9t s GLU 42 Ca 0.02 1.14 0.02 0.00 0.02 0.00 0.00 54.97 56.17 1k9t s GLU 42 Cb -0.22 -2.50 0.01 0.00 0.10 0.00 0.00 34.13 31.52 1k9t s GLU 42 CO 0.01 0.14 -0.21 0.08 0.02 0.00 0.00 175.26 175.31 1k9t s VAL 43 N -1.89 2.20 -0.29 2.63 1.01 -1.26 -0.75 120.40 122.04 1k9t s VAL 43 Ca 0.55 -0.94 -0.26 0.00 0.00 0.00 0.00 61.98 61.33 1k9t s VAL 43 Cb -0.13 -1.88 0.01 0.00 0.00 0.00 0.00 36.38 34.37 1k9t s VAL 43 CO 0.18 0.54 0.92 -0.62 0.00 0.00 0.00 175.10 176.13 1k9t s ASP 44 N 0.73 6.83 0.00 3.32 -1.08 0.41 -4.92 116.67 121.96 1k9t s ASP 44 Ca -0.09 0.92 0.22 0.00 -0.52 0.00 0.00 52.55 53.08 1k9t s ASP 44 Cb -0.16 -2.47 0.98 0.00 -1.46 0.00 0.00 42.92 39.81 1k9t s ASP 44 CO 0.00 -0.70 1.70 0.00 0.52 0.00 0.00 175.17 176.69 1k9t n GLN 45 N 6.42 0.10 -2.86 4.34 1.13 -1.26 -3.43 117.38 121.83 1k9t n GLN 45 Ca 0.08 0.11 -0.22 0.00 -1.94 0.00 0.00 57.00 55.03 1k9t n GLN 45 Cb 0.47 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.31 1k9t n GLN 45 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1k9t n ALA 46 N -1.43 3.87 -3.15 -1.58 0.00 -1.26 -5.03 120.51 111.92 1k9t n ALA 46 Ca 0.07 -4.02 -0.15 0.00 0.00 0.00 0.00 53.44 49.34 1k9t n ALA 46 Cb 0.23 -0.77 -0.15 0.00 0.00 0.00 0.00 19.45 18.75 1k9t n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k9t s ALA 47 N -3.16 0.22 -0.22 0.00 0.00 -1.22 -5.02 121.76 112.36 1k9t s ALA 47 Ca 0.43 0.01 0.07 0.00 0.00 0.00 0.00 51.96 52.47 1k9t s ALA 47 Cb 0.35 -0.14 -0.09 0.00 0.00 0.00 0.00 23.12 23.24 1k9t s ALA 47 CO -0.11 0.00 0.25 0.25 0.00 0.00 0.00 175.76 176.16 1k9t n THR 48 N 3.43 0.00 -3.29 0.00 -2.24 -1.26 -4.79 114.28 106.13 1k9t n THR 48 Ca -0.18 -0.28 -0.38 0.00 -2.27 0.00 0.00 64.05 60.94 1k9t n THR 48 Cb 0.56 0.77 -0.06 0.00 -2.10 0.00 0.00 70.33 69.50 1k9t n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k9t s ALA 49 N -1.96 3.50 0.30 6.98 0.00 -1.26 -4.02 121.76 125.31 1k9t s ALA 49 Ca 0.01 -0.10 0.03 0.00 0.00 0.00 0.00 51.96 51.89 1k9t s ALA 49 Cb 0.05 -2.66 0.60 0.00 0.00 0.00 0.00 23.12 21.11 1k9t s ALA 49 CO 0.29 0.12 1.87 -0.92 0.00 0.00 0.00 175.76 177.12 1k9t h TYR 50 N 6.06 1.05 -0.83 0.00 3.20 -0.74 -0.73 116.97 124.97 1k9t h TYR 50 Ca -0.44 0.03 0.12 0.00 3.14 0.00 0.00 58.73 61.58 1k9t h TYR 50 Cb 1.19 -0.34 -0.06 0.00 1.54 0.00 0.00 36.73 39.07 1k9t h TYR 50 CO 0.65 0.45 0.54 -0.91 -1.64 0.00 0.00 178.16 177.25 1k9t h ASN 51 N 0.95 0.63 0.58 -2.11 2.35 -1.84 -2.76 115.58 113.37 1k9t h ASN 51 Ca 0.45 0.03 -0.17 0.00 -0.55 0.00 0.00 56.30 56.06 1k9t h ASN 51 Cb 0.44 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.68 1k9t h ASN 51 CO -0.21 0.35 -1.54 0.59 -1.65 0.00 0.00 177.43 174.96 1k9t n ASN 52 N -4.53 0.70 -0.31 5.81 3.02 -0.56 -4.49 115.26 114.90 1k9t n ASN 52 Ca 0.15 0.31 -0.03 0.00 -0.03 0.00 0.00 54.58 54.98 1k9t n ASN 52 Cb 0.41 0.41 0.12 0.00 -0.61 0.00 0.00 39.78 40.11 1k9t n ASN 52 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1k9t h LEU 53 N 0.00 1.08 -8.29 3.41 5.85 -0.87 -3.38 115.31 113.10 1k9t h LEU 53 Ca -0.18 -0.08 -0.51 0.00 0.84 0.00 0.00 57.88 57.95 1k9t h LEU 53 Cb 1.57 -0.27 -0.28 0.00 0.37 0.00 0.00 40.66 42.05 1k9t h LEU 53 CO 0.04 0.85 -0.82 -0.69 -0.34 0.00 0.00 178.44 177.48 1k9t s VAL 54 N -5.84 1.25 -0.20 1.05 1.01 -1.22 -0.44 120.40 116.00 1k9t s VAL 54 Ca -0.12 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1k9t s VAL 54 Cb 0.17 -1.05 0.05 0.00 0.00 0.00 0.00 36.38 35.55 1k9t s VAL 54 CO 0.82 0.28 -0.05 -0.75 0.00 0.00 0.00 175.10 175.40 1k9t s LYS 55 N -0.55 1.55 -0.20 2.72 2.20 0.07 -4.92 119.74 120.61 1k9t s LYS 55 Ca 0.05 -0.76 -0.24 0.00 -0.36 0.00 0.00 55.97 54.66 1k9t s LYS 55 Cb -0.06 -2.33 -0.01 0.00 -1.51 0.00 0.00 37.83 33.91 1k9t s LYS 55 CO -0.00 -0.52 0.80 0.08 -0.36 0.00 0.00 175.35 175.35 1k9t s VAL 56 N 1.51 4.88 0.31 4.02 1.01 -1.26 -1.04 120.40 129.84 1k9t s VAL 56 Ca -0.02 1.54 0.08 0.00 0.00 0.00 0.00 61.98 63.58 1k9t s VAL 56 Cb -0.17 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 1k9t s VAL 56 CO -0.07 -0.00 0.20 -0.54 0.00 0.00 0.00 175.10 174.69 1k9t s LYS 57 N 2.39 2.62 0.15 2.72 1.02 -0.51 -5.00 119.74 123.13 1k9t s LYS 57 Ca 0.35 -1.33 0.27 0.00 0.02 0.00 0.00 55.97 55.28 1k9t s LYS 57 Cb -0.16 -2.38 0.94 0.00 -0.52 0.00 0.00 37.83 35.71 1k9t s LYS 57 CO 0.10 0.19 1.82 0.09 -0.92 0.00 0.00 175.35 176.63 1k9t n ASN 58 N -1.22 0.56 -3.49 2.83 3.02 -1.26 -4.74 115.26 110.97 1k9t n ASN 58 Ca -0.04 0.55 -0.13 0.00 -0.03 0.00 0.00 54.58 54.94 1k9t n ASN 58 Cb 0.60 -0.71 -0.03 0.00 -0.61 0.00 0.00 39.78 39.03 1k9t n ASN 58 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k9t s ALA 59 N -3.07 -1.74 0.24 5.41 0.00 -1.26 -4.69 121.76 116.64 1k9t s ALA 59 Ca 0.11 0.98 -0.25 0.00 0.00 0.00 0.00 51.96 52.80 1k9t s ALA 59 Cb 0.14 0.33 -0.09 0.00 0.00 0.00 0.00 23.12 23.51 1k9t s ALA 59 CO 0.57 -0.58 0.84 0.00 0.00 0.00 0.00 175.76 176.59 1k9t s ALA 60 N -2.57 3.35 -0.35 0.00 0.00 0.71 -4.80 121.76 118.12 1k9t s ALA 60 Ca -0.02 0.42 -0.25 0.00 0.00 0.00 0.00 51.96 52.11 1k9t s ALA 60 Cb -0.01 -3.04 0.01 0.00 0.00 0.00 0.00 23.12 20.08 1k9t s ALA 60 CO -0.04 0.25 0.88 -0.51 0.00 0.00 0.00 175.76 176.35 1k9t s ASP 61 N -1.39 6.68 0.10 0.00 1.01 -1.26 -1.36 116.67 120.46 1k9t s ASP 61 Ca 0.42 0.61 0.08 0.00 0.71 0.00 0.00 52.55 54.37 1k9t s ASP 61 Cb -0.21 -2.45 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 1k9t s ASP 61 CO 0.26 -0.78 -0.13 -0.69 0.21 0.00 0.00 175.17 174.04 1k9t s VAL 62 N 3.30 3.20 0.03 -1.27 1.01 0.20 -4.85 120.40 122.02 1k9t s VAL 62 Ca 0.36 -1.33 0.02 0.00 0.00 0.00 0.00 61.98 61.04 1k9t s VAL 62 Cb -0.13 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 1k9t s VAL 62 CO 0.16 0.12 -0.08 -0.94 0.00 0.00 0.00 175.10 174.37 1k9t s SER 63 N -2.16 0.85 -0.06 3.32 1.04 -1.26 -1.24 113.70 114.19 1k9t s SER 63 Ca 0.20 -0.42 -0.07 0.00 0.48 0.00 0.00 55.95 56.14 1k9t s SER 63 Cb -0.11 -0.00 0.02 0.00 0.10 0.00 0.00 66.02 66.02 1k9t s SER 63 CO 0.12 -0.11 0.19 -0.69 0.98 0.00 0.00 173.24 173.73 1k9t s VAL 64 N -0.99 0.02 0.26 5.02 1.01 -0.67 -4.95 120.40 120.09 1k9t s VAL 64 Ca -0.06 -0.13 0.06 0.00 0.00 0.00 0.00 61.98 61.85 1k9t s VAL 64 Cb -0.08 -0.32 -0.06 0.00 0.00 0.00 0.00 36.38 35.93 1k9t s VAL 64 CO 0.00 -0.07 -0.06 -0.44 0.00 0.00 0.00 175.10 174.54 1k9t s SER 65 N -0.19 2.55 0.11 3.32 0.01 -1.26 -0.68 113.70 117.56 1k9t s SER 65 Ca -0.03 -1.18 -0.18 0.00 1.31 0.00 0.00 55.95 55.88 1k9t s SER 65 Cb -0.03 -0.13 0.04 0.00 0.21 0.00 0.00 66.02 66.12 1k9t s SER 65 CO 0.01 -0.36 0.43 -1.66 0.41 0.00 0.00 173.24 172.07 1k9t s TRP 66 N -3.09 -0.26 0.10 2.43 -2.14 -0.56 -0.73 118.94 114.69 1k9t s TRP 66 Ca 0.28 0.03 0.07 0.00 2.66 0.00 0.00 56.10 59.14 1k9t s TRP 66 Cb 0.04 0.29 -0.03 0.00 -3.10 0.00 0.00 33.47 30.66 1k9t s TRP 66 CO 0.11 -0.69 -0.17 -0.80 -2.66 0.00 0.00 176.95 172.73 1k9t s ASN 67 N -2.62 2.19 -0.25 -2.66 0.01 -0.51 -1.78 114.94 109.32 1k9t s ASN 67 Ca 0.01 -0.70 0.03 0.00 -0.71 0.00 0.00 52.86 51.48 1k9t s ASN 67 Cb 0.01 -0.10 0.06 0.00 0.41 0.00 0.00 41.25 41.62 1k9t s ASN 67 CO -0.10 -0.03 -0.12 -0.22 -1.51 0.00 0.00 177.10 175.13 1k9t s LEU 68 N -2.02 3.31 0.22 0.60 2.96 0.10 -0.79 118.68 123.06 1k9t s LEU 68 Ca 0.05 -1.32 0.24 0.00 -0.22 0.00 0.00 54.13 52.88 1k9t s LEU 68 Cb -0.09 -1.54 0.34 0.00 0.50 0.00 0.00 46.19 45.40 1k9t s LEU 68 CO 0.04 -0.17 1.39 -0.50 -1.32 0.00 0.00 176.35 175.78 1k9t h TRP 69 N 7.79 0.00 -2.90 5.38 4.06 -1.87 -3.47 115.95 124.94 1k9t h TRP 69 Ca -0.22 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 60.56 1k9t h TRP 69 Cb 1.05 0.00 -0.29 0.00 -1.00 0.00 0.00 29.16 28.92 1k9t h TRP 69 CO 0.62 0.00 -0.43 -0.80 -3.56 0.00 0.00 178.44 174.27 1k9t s ASN 70 N -4.93 -0.33 0.00 -3.49 0.01 -1.26 -5.15 114.94 99.80 1k9t s ASN 70 Ca 0.05 0.64 0.00 0.00 -0.71 0.00 0.00 52.86 52.84 1k9t s ASN 70 Cb 0.11 0.53 0.00 0.00 0.41 0.00 0.00 41.25 42.29 1k9t s ASN 70 CO 0.71 -0.18 0.00 0.61 -1.51 0.00 0.00 177.10 176.73 1k9t n GLY 71 N 4.27 -1.91 3.73 0.66 0.00 -1.26 -4.24 105.19 106.45 1k9t n GLY 71 Ca -0.24 -2.11 -0.41 0.00 0.00 0.00 0.00 46.02 43.25 1k9t n GLY 71 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k9t s ASP 72 N -3.01 7.38 0.00 1.61 -1.08 -1.26 -4.73 116.67 115.57 1k9t s ASP 72 Ca 0.00 1.90 0.27 0.00 -0.52 0.00 0.00 52.55 54.20 1k9t s ASP 72 Cb 0.00 -2.59 1.60 0.00 -1.46 0.00 0.00 42.92 40.47 1k9t s ASP 72 CO 0.00 -0.16 1.99 0.35 0.52 0.00 0.00 175.17 177.87 1k9t n THR 73 N 2.82 0.00 -0.26 1.71 -2.24 -1.26 -0.63 114.28 114.42 1k9t n THR 73 Ca 0.03 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.83 1k9t n THR 73 Cb 0.48 -0.49 -0.00 0.00 -2.10 0.00 0.00 70.33 68.22 1k9t n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k9t n GLY 74 N 0.81 -2.23 0.00 3.38 0.00 -1.26 -4.75 105.19 101.14 1k9t n GLY 74 Ca 0.20 -1.50 0.03 0.00 0.00 0.00 0.00 46.02 44.75 1k9t n GLY 74 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k9t n THR 75 N -1.26 0.00 -4.49 2.61 -2.24 -0.05 -4.65 114.28 104.21 1k9t n THR 75 Ca 0.00 -0.21 -0.21 0.00 -2.27 0.00 0.00 64.05 61.36 1k9t n THR 75 Cb 0.06 0.59 -0.16 0.00 -2.10 0.00 0.00 70.33 68.72 1k9t n THR 75 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1k9t s THR 76 N -2.07 0.92 -0.02 4.28 2.01 -0.84 -0.46 115.64 119.46 1k9t s THR 76 Ca -0.01 -0.44 0.03 0.00 0.31 0.00 0.00 61.69 61.58 1k9t s THR 76 Cb 0.04 -0.81 -0.03 0.00 0.01 0.00 0.00 72.50 71.71 1k9t s THR 76 CO 0.22 0.28 -0.09 0.00 -0.69 0.00 0.00 174.62 174.35 1k9t s ALA 77 N 0.11 2.93 0.06 7.40 0.00 0.15 -0.72 121.76 131.69 1k9t s ALA 77 Ca -0.02 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 50.98 1k9t s ALA 77 Cb -0.09 -1.11 -0.03 0.00 0.00 0.00 0.00 23.12 21.89 1k9t s ALA 77 CO 0.01 0.59 -0.10 0.15 0.00 0.00 0.00 175.76 176.41 1k9t s LYS 78 N -1.14 0.68 -0.20 0.00 1.02 0.48 -1.23 119.74 119.35 1k9t s LYS 78 Ca 0.15 -0.91 -0.04 0.00 0.02 0.00 0.00 55.97 55.20 1k9t s LYS 78 Cb -0.11 -0.49 -0.01 0.00 -0.52 0.00 0.00 37.83 36.69 1k9t s LYS 78 CO 0.05 0.09 -0.04 0.08 -0.92 0.00 0.00 175.35 174.61 1k9t s VAL 79 N -1.60 3.49 -0.01 3.17 1.01 -0.31 -0.71 120.40 125.43 1k9t s VAL 79 Ca -0.04 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1k9t s VAL 79 Cb -0.08 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.69 1k9t s VAL 79 CO 0.01 0.44 -0.01 -0.76 0.00 0.00 0.00 175.10 174.78 1k9t s LEU 80 N 1.16 3.45 -0.22 3.92 1.43 0.14 -0.57 118.68 127.99 1k9t s LEU 80 Ca 0.02 -0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.12 1k9t s LEU 80 Cb -0.14 -1.96 0.04 0.00 0.03 0.00 0.00 46.19 44.16 1k9t s LEU 80 CO -0.01 0.29 -0.14 -0.76 0.23 0.00 0.00 176.35 175.97 1k9t s LEU 81 N -1.45 2.83 -1.49 1.79 1.43 0.54 -0.69 118.68 121.64 1k9t s LEU 81 Ca 0.18 -1.07 -0.12 0.00 -1.03 0.00 0.00 54.13 52.09 1k9t s LEU 81 Cb -0.11 -1.48 0.07 0.00 0.03 0.00 0.00 46.19 44.70 1k9t s LEU 81 CO 0.09 -0.12 0.90 0.59 0.23 0.00 0.00 176.35 178.04 1k9t n ASN 82 N 4.53 -5.02 0.00 2.29 3.02 0.11 -1.55 115.26 118.64 1k9t n ASN 82 Ca -0.16 -0.64 0.00 0.00 -0.03 0.00 0.00 54.58 53.74 1k9t n ASN 82 Cb 0.45 -4.02 0.00 0.00 -0.61 0.00 0.00 39.78 35.61 1k9t n ASN 82 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k9t n GLY 83 N -1.64 2.04 3.70 7.41 0.00 -1.26 -5.03 105.19 110.41 1k9t n GLY 83 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 1k9t n GLY 83 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1k9t s LYS 84 N -0.25 3.99 0.10 1.61 2.20 -0.59 -4.97 119.74 121.82 1k9t s LYS 84 Ca 0.00 -0.28 -0.31 0.00 -0.36 0.00 0.00 55.97 55.03 1k9t s LYS 84 Cb 0.00 -3.28 -0.09 0.00 -1.51 0.00 0.00 37.83 32.94 1k9t s LYS 84 CO 0.00 0.34 1.70 -2.00 -0.36 0.00 0.00 175.35 175.03 1k9t s GLU 85 N 0.21 4.18 -0.01 4.03 2.12 -1.26 -0.34 118.70 127.62 1k9t s GLU 85 Ca 0.06 2.42 0.13 0.00 0.36 0.00 0.00 54.97 57.94 1k9t s GLU 85 Cb -0.12 -3.54 -0.17 0.00 0.26 0.00 0.00 34.13 30.56 1k9t s GLU 85 CO -0.00 -0.76 0.39 0.00 -0.54 0.00 0.00 175.26 174.35 1k9t n ALA 86 N 5.44 2.96 -3.52 6.30 0.00 0.27 -4.91 120.51 127.06 1k9t n ALA 86 Ca 0.16 -0.33 -0.16 0.00 0.00 0.00 0.00 53.44 53.12 1k9t n ALA 86 Cb 0.39 -0.45 -0.05 0.00 0.00 0.00 0.00 19.45 19.35 1k9t n ALA 86 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1k9t s TRP 87 N -2.59 -0.58 -0.10 0.00 -0.00 -1.16 -4.80 118.94 109.70 1k9t s TRP 87 Ca -0.01 0.91 -0.21 0.00 -0.00 0.00 0.00 56.10 56.79 1k9t s TRP 87 Cb 0.09 0.44 0.05 0.00 -0.00 0.00 0.00 33.47 34.05 1k9t s TRP 87 CO 0.53 -0.59 0.50 -1.54 -0.00 0.00 0.00 176.95 175.85 1k9t s SER 88 N -1.43 -0.47 0.18 5.86 1.04 -1.26 -1.17 113.70 116.45 1k9t s SER 88 Ca -0.07 0.65 -0.24 0.00 0.48 0.00 0.00 55.95 56.77 1k9t s SER 88 Cb -0.00 0.68 0.07 0.00 0.10 0.00 0.00 66.02 66.86 1k9t s SER 88 CO 0.05 -0.39 0.97 -0.83 0.98 0.00 0.00 173.24 174.02 1k9t s GLY 89 N -0.66 -0.10 0.33 7.32 0.00 -0.36 -4.99 107.32 108.86 1k9t s GLY 89 Ca -0.08 -0.06 -0.29 0.00 0.00 0.00 0.00 44.72 44.30 1k9t s GLY 89 CO 0.05 0.63 1.41 -4.14 0.00 0.00 0.00 173.10 171.04 1k9t s PRO 90 N -2.93 4.24 -0.41 2.90 0.02 -1.26 0.29 135.00 137.86 1k9t s PRO 90 Ca 0.15 2.38 -0.19 0.00 0.02 0.00 0.00 61.00 63.36 1k9t s PRO 90 Cb -0.02 -3.04 0.02 0.00 0.02 0.00 0.00 34.50 31.48 1k9t s PRO 90 CO 0.04 -0.37 0.55 0.45 -0.33 0.00 0.00 177.00 177.33 1k9t s SER 91 N -0.16 6.28 0.00 2.53 0.15 0.40 -4.51 113.70 118.39 1k9t s SER 91 Ca 0.53 -0.37 0.08 0.00 0.70 0.00 0.00 55.95 56.89 1k9t s SER 91 Cb -0.43 -2.28 0.16 0.00 -1.71 0.00 0.00 66.02 61.77 1k9t s SER 91 CO 0.54 -0.65 1.03 0.35 1.20 0.00 0.00 173.24 175.71 1k9t n THR 92 N 5.62 0.63 -3.86 6.45 -2.24 -1.26 -4.64 114.28 114.98 1k9t n THR 92 Ca -0.04 -0.81 0.01 0.00 -2.27 0.00 0.00 64.05 60.93 1k9t n THR 92 Cb 0.48 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 1k9t n THR 92 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k9t n GLY 93 N 0.32 0.57 0.22 3.38 0.00 -1.26 -5.00 105.19 103.42 1k9t n GLY 93 Ca 0.07 -0.89 0.15 0.00 0.00 0.00 0.00 46.02 45.35 1k9t n GLY 93 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1k9t h SER 94 N 0.48 0.00 -4.09 1.61 4.64 -1.96 -3.44 113.55 110.79 1k9t h SER 94 Ca -0.05 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.94 1k9t h SER 94 Cb 0.29 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.22 1k9t h SER 94 CO 0.08 0.00 -0.72 -0.44 -0.87 0.00 0.00 176.83 174.88 1k9t s SER 95 N -5.11 1.71 0.19 4.97 0.01 -1.26 0.02 113.70 114.23 1k9t s SER 95 Ca 0.03 -0.95 -0.20 0.00 1.31 0.00 0.00 55.95 56.14 1k9t s SER 95 Cb 0.09 -0.01 0.04 0.00 0.21 0.00 0.00 66.02 66.35 1k9t s SER 95 CO 0.49 -0.31 0.57 -0.83 0.41 0.00 0.00 173.24 173.57 1k9t s GLY 96 N -2.94 -0.28 -0.00 3.44 0.00 -0.73 -4.85 107.32 101.96 1k9t s GLY 96 Ca 0.13 0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.86 1k9t s GLY 96 CO 0.00 -0.10 -0.01 -1.59 0.00 0.00 0.00 173.10 171.41 1k9t s THR 97 N -3.84 0.11 -0.04 0.90 2.01 -1.26 -1.50 115.64 112.02 1k9t s THR 97 Ca 0.06 -0.03 0.04 0.00 0.31 0.00 0.00 61.69 62.07 1k9t s THR 97 Cb -0.02 -0.11 -0.00 0.00 0.01 0.00 0.00 72.50 72.38 1k9t s THR 97 CO -0.05 0.05 -0.15 0.00 -0.69 0.00 0.00 174.62 173.78 1k9t s ALA 98 N 0.13 1.35 -0.11 7.40 0.00 0.14 -5.01 121.76 125.67 1k9t s ALA 98 Ca -0.01 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 51.39 1k9t s ALA 98 Cb -0.03 -0.46 0.01 0.00 0.00 0.00 0.00 23.12 22.64 1k9t s ALA 98 CO -0.00 0.24 -0.21 -0.80 0.00 0.00 0.00 175.76 174.98 1k9t s ASN 99 N 0.10 2.91 0.29 0.00 0.01 -1.26 -1.67 114.94 115.32 1k9t s ASN 99 Ca -0.04 -0.54 -0.14 0.00 -0.71 0.00 0.00 52.86 51.43 1k9t s ASN 99 Cb -0.11 -1.33 0.01 0.00 0.41 0.00 0.00 41.25 40.23 1k9t s ASN 99 CO 0.02 0.10 0.59 0.72 -1.51 0.00 0.00 177.10 177.03 1k9t s PHE 100 N 0.61 0.28 0.02 2.20 -0.71 -0.38 -4.99 117.98 115.01 1k9t s PHE 100 Ca -0.13 -0.70 0.03 0.00 -1.04 0.00 0.00 56.93 55.09 1k9t s PHE 100 Cb -0.17 0.40 -0.04 0.00 -1.21 0.00 0.00 43.02 42.01 1k9t s PHE 100 CO 0.04 -1.18 -0.04 0.15 -1.34 0.00 0.00 175.22 172.85 1k9t s LYS 101 N -3.57 2.58 -0.15 1.99 1.02 -1.26 0.58 119.74 120.93 1k9t s LYS 101 Ca 0.19 -0.73 0.00 0.00 0.02 0.00 0.00 55.97 55.45 1k9t s LYS 101 Cb -0.03 -2.53 0.03 0.00 -0.52 0.00 0.00 37.83 34.78 1k9t s LYS 101 CO 0.10 0.59 -0.11 0.08 -0.92 0.00 0.00 175.35 175.10 1k9t s VAL 102 N -1.07 1.36 -1.09 3.17 1.01 -0.46 -4.93 120.40 118.39 1k9t s VAL 102 Ca 0.19 -0.58 0.18 0.00 0.00 0.00 0.00 61.98 61.77 1k9t s VAL 102 Cb -0.11 -1.36 0.70 0.00 0.00 0.00 0.00 36.38 35.61 1k9t s VAL 102 CO 0.10 0.35 1.61 -0.46 0.00 0.00 0.00 175.10 176.70 1k9t n ASN 103 N 4.82 4.67 -3.85 3.32 6.94 -1.26 -0.20 115.26 129.70 1k9t n ASN 103 Ca -0.15 -2.45 -0.19 0.00 -0.02 0.00 0.00 54.58 51.77 1k9t n ASN 103 Cb 0.49 -0.56 -0.16 0.00 -2.36 0.00 0.00 39.78 37.18 1k9t n ASN 103 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1k9t s LYS 104 N -1.85 0.59 0.64 -3.83 2.20 -1.26 -4.89 119.74 111.34 1k9t s LYS 104 Ca 0.50 -0.01 -0.16 0.00 -0.36 0.00 0.00 55.97 55.94 1k9t s LYS 104 Cb 0.32 -0.71 -0.01 0.00 -1.51 0.00 0.00 37.83 35.92 1k9t s LYS 104 CO 0.24 -0.13 1.15 0.20 -0.36 0.00 0.00 175.35 176.45 1k9t s GLY 105 N 1.07 2.36 0.00 5.54 0.00 -1.26 -4.88 107.32 110.15 1k9t s GLY 105 Ca -0.09 0.73 0.00 0.00 0.00 0.00 0.00 44.72 45.36 1k9t s GLY 105 CO -0.01 1.09 0.00 0.61 0.00 0.00 0.00 173.10 174.79 1k9t n GLY 106 N -0.07 0.12 3.47 0.20 0.00 -0.03 -4.79 105.19 104.10 1k9t n GLY 106 Ca 0.12 -1.67 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 1k9t n GLY 106 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k9t s ARG 107 N -1.96 2.84 0.09 1.61 0.52 -1.26 -0.83 118.95 119.96 1k9t s ARG 107 Ca 0.00 -0.65 0.07 0.00 -0.52 0.00 0.00 55.73 54.63 1k9t s ARG 107 Cb 0.00 -2.52 -0.03 0.00 0.52 0.00 0.00 34.95 32.92 1k9t s ARG 107 CO 0.00 0.51 -0.20 0.71 0.02 0.00 0.00 175.30 176.34 1k9t s TYR 108 N -0.41 1.69 -0.53 -0.53 1.51 -0.34 -4.97 117.35 113.77 1k9t s TYR 108 Ca 0.05 -0.41 -0.22 0.00 -1.01 0.00 0.00 57.07 55.48 1k9t s TYR 108 Cb -0.12 -0.94 0.05 0.00 -0.11 0.00 0.00 41.96 40.83 1k9t s TYR 108 CO 0.02 0.16 0.80 -0.65 -1.11 0.00 0.00 175.55 174.77 1k9t s GLN 109 N -1.75 3.24 -0.18 -0.62 -1.52 -1.26 -1.03 119.66 116.54 1k9t s GLN 109 Ca 0.05 -0.54 -0.09 0.00 -1.95 0.00 0.00 55.36 52.83 1k9t s GLN 109 Cb -0.10 -4.07 -0.05 0.00 -0.22 0.00 0.00 33.01 28.57 1k9t s GLN 109 CO 0.03 -1.37 0.12 1.41 -0.25 0.00 0.00 175.29 175.24 1k9t s MET 110 N 3.36 4.02 0.15 2.91 -2.45 0.07 -0.72 119.30 126.64 1k9t s MET 110 Ca 0.24 -0.22 0.07 0.00 -1.25 0.00 0.00 55.69 54.52 1k9t s MET 110 Cb -0.15 -3.35 -0.04 0.00 1.25 0.00 0.00 34.83 32.53 1k9t s MET 110 CO 0.16 0.39 -0.15 -0.65 1.05 0.00 0.00 175.02 175.82 1k9t s GLN 111 N 0.10 1.14 -0.19 4.11 -0.21 0.13 -1.19 119.66 123.56 1k9t s GLN 111 Ca 0.09 -1.36 -0.03 0.00 0.02 0.00 0.00 55.36 54.08 1k9t s GLN 111 Cb -0.11 -1.02 -0.01 0.00 1.00 0.00 0.00 33.01 32.86 1k9t s GLN 111 CO -0.01 0.19 -0.06 0.08 -2.12 0.00 0.00 175.29 173.38 1k9t s VAL 112 N -2.37 3.40 -0.03 1.09 1.01 -1.26 0.27 120.40 122.51 1k9t s VAL 112 Ca 0.14 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.68 1k9t s VAL 112 Cb -0.04 -2.52 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 1k9t s VAL 112 CO 0.04 0.45 -0.21 0.00 0.00 0.00 0.00 175.10 175.38 1k9t s ALA 113 N 1.10 2.37 -0.16 5.51 0.00 0.11 -1.08 121.76 129.61 1k9t s ALA 113 Ca 0.01 -1.06 -0.04 0.00 0.00 0.00 0.00 51.96 50.88 1k9t s ALA 113 Cb -0.15 -0.73 -0.03 0.00 0.00 0.00 0.00 23.12 22.22 1k9t s ALA 113 CO -0.01 0.53 -0.04 -0.51 0.00 0.00 0.00 175.76 175.74 1k9t s LEU 114 N -0.63 3.20 0.17 0.00 1.43 -0.54 -0.39 118.68 121.91 1k9t s LEU 114 Ca 0.10 -0.17 0.10 0.00 -1.03 0.00 0.00 54.13 53.13 1k9t s LEU 114 Cb -0.10 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 1k9t s LEU 114 CO -0.00 0.15 -0.21 0.00 0.23 0.00 0.00 176.35 176.52 1k9t s ASN 116 N -2.57 0.99 0.55 0.00 2.20 -0.32 -0.87 114.94 114.92 1k9t s ASN 116 Ca 0.16 -1.52 0.27 0.00 -0.94 0.00 0.00 52.86 50.84 1k9t s ASN 116 Cb -0.07 0.68 1.46 0.00 -2.00 0.00 0.00 41.25 41.32 1k9t s ASN 116 CO 0.07 -1.34 1.98 0.00 -2.94 0.00 0.00 177.10 174.87 1k9t h ALA 117 N 2.08 2.38 -0.00 3.54 0.00 -2.01 -2.05 119.26 123.19 1k9t h ALA 117 Ca -0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1k9t h ALA 117 Cb 1.24 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1k9t h ALA 117 CO 0.38 -0.67 -0.19 -0.25 0.00 0.00 0.00 179.25 178.52 1k9t n ASP 118 N -4.14 0.41 0.00 0.00 8.00 -1.26 -5.03 116.55 114.52 1k9t n ASP 118 Ca 0.09 -0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1k9t n ASP 118 Cb 0.62 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 1k9t n ASP 118 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k9t n GLY 119 N 1.39 1.92 3.42 0.44 0.00 -0.77 -4.33 105.19 107.25 1k9t n GLY 119 Ca 0.10 -1.56 -0.32 0.00 0.00 0.00 0.00 46.02 44.25 1k9t n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k9t s THR 121 N -0.73 1.33 -0.00 0.00 2.01 -0.18 -4.96 115.64 113.10 1k9t s THR 121 Ca 0.12 -0.57 -0.02 0.00 0.31 0.00 0.00 61.69 61.53 1k9t s THR 121 Cb -0.10 -1.33 -0.04 0.00 0.01 0.00 0.00 72.50 71.03 1k9t s THR 121 CO 0.01 0.34 0.14 0.00 -0.69 0.00 0.00 174.62 174.42 1k9t s ALA 122 N 1.57 3.81 0.98 7.40 0.00 -1.26 -1.47 121.76 132.79 1k9t s ALA 122 Ca 0.03 -0.81 -0.12 0.00 0.00 0.00 0.00 51.96 51.06 1k9t s ALA 122 Cb -0.14 -1.75 0.18 0.00 0.00 0.00 0.00 23.12 21.41 1k9t s ALA 122 CO -0.09 0.73 1.10 -1.54 0.00 0.00 0.00 175.76 175.95 1k9t s SER 123 N -1.88 2.77 0.87 0.00 1.04 -0.24 -4.77 113.70 111.48 1k9t s SER 123 Ca 0.26 1.20 -0.11 0.00 0.48 0.00 0.00 55.95 57.78 1k9t s SER 123 Cb -0.12 -1.86 0.11 0.00 0.10 0.00 0.00 66.02 64.25 1k9t s SER 123 CO 0.17 -3.04 1.11 -1.81 0.98 0.00 0.00 173.24 170.65 1k9t s ASP 124 N -3.50 3.53 0.34 7.02 1.01 -1.26 -4.73 116.67 119.08 1k9t s ASP 124 Ca 0.65 1.93 -0.18 0.00 0.71 0.00 0.00 52.55 55.66 1k9t s ASP 124 Cb -0.18 -2.49 -0.10 0.00 1.01 0.00 0.00 42.92 41.16 1k9t s ASP 124 CO 0.57 -2.67 0.82 0.00 0.21 0.00 0.00 175.17 174.10 1k9t s ALA 125 N -2.78 3.23 -0.09 5.23 0.00 -1.26 -4.74 121.76 121.35 1k9t s ALA 125 Ca 0.64 0.21 0.03 0.00 0.00 0.00 0.00 51.96 52.84 1k9t s ALA 125 Cb -0.20 -2.93 0.01 0.00 0.00 0.00 0.00 23.12 20.00 1k9t s ALA 125 CO 0.57 0.25 -0.18 0.99 0.00 0.00 0.00 175.76 177.40 1k9t s THR 126 N -1.96 1.64 0.21 0.00 2.01 -0.33 -4.91 115.64 112.30 1k9t s THR 126 Ca 0.55 -0.76 -0.30 0.00 0.31 0.00 0.00 61.69 61.49 1k9t s THR 126 Cb -0.11 -1.45 -0.08 0.00 0.01 0.00 0.00 72.50 70.86 1k9t s THR 126 CO 0.17 0.47 1.16 -0.70 -0.69 0.00 0.00 174.62 175.03 1k9t s GLU 127 N 0.59 4.54 0.09 4.92 2.12 -1.26 -0.75 118.70 128.94 1k9t s GLU 127 Ca -0.15 1.84 0.09 0.00 0.36 0.00 0.00 54.97 57.12 1k9t s GLU 127 Cb -0.17 -3.23 -0.03 0.00 0.26 0.00 0.00 34.13 30.96 1k9t s GLU 127 CO 0.05 0.00 -0.24 0.96 -0.54 0.00 0.00 175.26 175.49 1k9t s ILE 128 N -0.35 1.98 -0.17 -3.70 -4.36 -0.19 -4.91 121.20 109.50 1k9t s ILE 128 Ca 0.50 -1.51 -0.04 0.00 -0.26 0.00 0.00 60.65 59.35 1k9t s ILE 128 Cb -0.32 -1.74 -0.03 0.00 1.25 0.00 0.00 42.46 41.62 1k9t s ILE 128 CO 0.38 0.15 -0.03 -0.69 0.24 0.00 0.00 174.94 174.98 1k9t s VAL 129 N -0.97 3.87 -0.34 8.37 1.01 0.47 -1.19 120.40 131.62 1k9t s VAL 129 Ca 0.10 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 61.76 1k9t s VAL 129 Cb -0.10 -2.71 0.10 0.00 0.00 0.00 0.00 36.38 33.67 1k9t s VAL 129 CO 0.04 0.48 0.05 -0.69 0.00 0.00 0.00 175.10 174.98 1k9t s VAL 130 N 0.52 2.36 0.40 2.92 1.01 -0.01 -0.77 120.40 126.83 1k9t s VAL 130 Ca -0.03 -2.27 -0.24 0.00 0.00 0.00 0.00 61.98 59.44 1k9t s VAL 130 Cb -0.14 -2.71 -0.09 0.00 0.00 0.00 0.00 36.38 33.44 1k9t s VAL 130 CO 0.03 -0.57 1.05 0.00 0.00 0.00 0.00 175.10 175.61 1k9t s ALA 131 N 0.94 3.08 0.17 5.51 0.00 0.61 -0.85 121.76 131.22 1k9t s ALA 131 Ca 0.09 0.70 -0.09 0.00 0.00 0.00 0.00 51.96 52.66 1k9t s ALA 131 Cb -0.19 -3.27 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 1k9t s ALA 131 CO -0.07 -0.21 0.30 0.34 0.00 0.00 0.00 175.76 176.11 1k9t s ASP 132 N -1.57 0.02 0.00 0.00 -1.08 -1.26 -0.91 116.67 111.86 1k9t s ASP 132 Ca 0.58 -0.85 0.13 0.00 -0.52 0.00 0.00 52.55 51.89 1k9t s ASP 132 Cb -0.22 0.44 0.54 0.00 -1.46 0.00 0.00 42.92 42.22 1k9t s ASP 132 CO 0.27 -0.90 1.38 0.35 0.52 0.00 0.00 175.17 176.79 1k9t n THR 133 N -0.22 0.18 1.18 1.71 -2.24 -1.26 -1.58 114.28 112.04 1k9t n THR 133 Ca -0.08 -0.21 0.13 0.00 -2.27 0.00 0.00 64.05 61.63 1k9t n THR 133 Cb 0.63 0.09 0.46 0.00 -2.10 0.00 0.00 70.33 69.40 1k9t n THR 133 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1k9t n ASP 134 N -0.09 0.50 0.00 3.42 5.75 -1.26 -1.58 116.55 123.29 1k9t n ASP 134 Ca 0.10 -0.35 0.00 0.00 -0.01 0.00 0.00 54.79 54.53 1k9t n ASP 134 Cb 0.18 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 1k9t n ASP 134 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1k9t n GLY 135 N 1.40 0.50 0.31 6.12 0.00 -0.61 -4.75 105.19 108.15 1k9t n GLY 135 Ca 0.10 -0.63 0.20 0.00 0.00 0.00 0.00 46.02 45.69 1k9t n GLY 135 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1k9t h SER 136 N 0.00 0.00 0.40 1.61 4.64 -1.90 -1.26 113.55 117.04 1k9t h SER 136 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1k9t h SER 136 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1k9t h SER 136 CO 0.00 0.01 -0.39 0.00 -0.87 0.00 0.00 176.83 175.58 1k9t n HIS 137 N -3.14 0.00 -3.90 4.77 1.44 -1.26 -4.15 115.22 108.98 1k9t n HIS 137 Ca -0.02 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.37 1k9t n HIS 137 Cb 0.17 -0.20 -0.05 0.00 0.12 0.00 0.00 29.99 30.03 1k9t n HIS 137 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1k9t s LEU 138 N -2.79 4.37 0.55 2.39 1.43 -0.48 -4.91 118.68 119.25 1k9t s LEU 138 Ca 0.17 0.34 -0.19 0.00 -1.03 0.00 0.00 54.13 53.42 1k9t s LEU 138 Cb 0.18 -2.72 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 1k9t s LEU 138 CO 0.62 0.23 1.12 0.00 0.23 0.00 0.00 176.35 178.55 1k9t s ALA 139 N -1.38 2.68 0.18 4.21 0.00 -1.26 -4.93 121.76 121.26 1k9t s ALA 139 Ca 0.30 0.77 -0.32 0.00 0.00 0.00 0.00 51.96 52.71 1k9t s ALA 139 Cb -0.13 -3.34 -0.10 0.00 0.00 0.00 0.00 23.12 19.55 1k9t s ALA 139 CO 0.21 -0.80 1.58 -2.14 0.00 0.00 0.00 175.76 174.62 1k9t s PRO 140 N -3.39 4.20 -0.82 0.00 0.02 -1.26 -4.77 135.00 128.97 1k9t s PRO 140 Ca 0.71 2.39 -0.20 0.00 0.02 0.00 0.00 61.00 63.93 1k9t s PRO 140 Cb -0.23 -3.14 0.11 0.00 0.02 0.00 0.00 34.50 31.26 1k9t s PRO 140 CO 0.28 -0.62 1.06 -1.17 -0.33 0.00 0.00 177.00 176.22 1k9t s LEU 141 N 1.05 4.78 -0.78 -5.54 2.96 -0.41 -4.88 118.68 115.87 1k9t s LEU 141 Ca 0.70 -1.62 0.03 0.00 -0.22 0.00 0.00 54.13 53.01 1k9t s LEU 141 Cb -0.45 -2.41 0.19 0.00 0.50 0.00 0.00 46.19 44.03 1k9t s LEU 141 CO 0.32 -1.21 0.61 1.17 -1.32 0.00 0.00 176.35 175.92 1k9t n LYS 142 N 7.02 2.16 -3.50 1.98 4.81 -1.26 -4.54 118.16 124.83 1k9t n LYS 142 Ca 0.13 -4.50 -0.28 0.00 -0.87 0.00 0.00 58.31 52.79 1k9t n LYS 142 Cb 0.48 -2.33 -0.03 0.00 0.02 0.00 0.00 35.03 33.16 1k9t n LYS 142 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1k9t s GLU 143 N -1.50 3.59 0.51 1.64 0.41 -1.26 -5.07 118.70 117.02 1k9t s GLU 143 Ca 0.26 -0.14 -0.23 0.00 -0.41 0.00 0.00 54.97 54.46 1k9t s GLU 143 Cb -0.04 -2.74 -0.06 0.00 -1.78 0.00 0.00 34.13 29.51 1k9t s GLU 143 CO -0.15 0.31 1.35 -2.14 -0.49 0.00 0.00 175.26 174.14 1k9t s PRO 144 N -3.40 3.35 0.32 0.39 0.02 -1.26 -4.96 135.00 129.44 1k9t s PRO 144 Ca 0.42 2.22 -0.29 0.00 0.02 0.00 0.00 61.00 63.37 1k9t s PRO 144 Cb -0.11 -2.37 -0.10 0.00 0.02 0.00 0.00 34.50 31.94 1k9t s PRO 144 CO 0.29 -1.02 1.30 -0.51 -0.33 0.00 0.00 177.00 176.73 1k9t s LEU 145 N -3.27 4.43 0.47 -5.54 1.43 -1.26 -5.00 118.68 109.94 1k9t s LEU 145 Ca 0.68 2.64 0.06 0.00 -1.03 0.00 0.00 54.13 56.48 1k9t s LEU 145 Cb -0.40 -3.64 -0.01 0.00 0.03 0.00 0.00 46.19 42.17 1k9t s LEU 145 CO 0.48 -0.51 0.30 -0.76 0.23 0.00 0.00 176.35 176.09 1k9t s LEU 146 N -1.60 2.97 0.00 1.79 1.43 -1.26 -4.93 118.68 117.07 1k9t s LEU 146 Ca 0.50 -1.11 0.00 0.00 -1.03 0.00 0.00 54.13 52.49 1k9t s LEU 146 Cb -0.39 -1.43 0.00 0.00 0.03 0.00 0.00 46.19 44.40 1k9t s LEU 146 CO 0.51 -0.80 0.00 -0.62 0.23 0.00 0.00 176.35 175.66 1k9t n GLU 147 N -1.51 0.00 -0.39 1.70 1.02 -1.26 -2.08 120.64 118.11 1k9t n GLU 147 Ca -0.01 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.23 1k9t n GLU 147 Cb 0.64 0.00 0.31 0.00 -0.02 0.00 0.00 31.44 32.37 1k9t n GLU 147 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1k9t n LYS 148 N 14.00 2.77 -2.04 3.49 5.02 0.67 -4.97 118.16 137.09 1k9t n LYS 148 Ca 0.00 -2.54 -0.42 0.00 -2.02 0.00 0.00 58.31 53.34 1k9t n LYS 148 Cb 0.00 -1.59 -0.03 0.00 -0.02 0.00 0.00 35.03 33.39 1k9t n LYS 148 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1k9t s ASN 149 N -0.98 6.69 0.14 4.39 0.01 -0.89 -4.68 114.94 119.63 1k9t s ASN 149 Ca 0.47 2.56 0.10 0.00 -0.71 0.00 0.00 52.86 55.28 1k9t s ASN 149 Cb 0.25 -2.61 -0.04 0.00 0.41 0.00 0.00 41.25 39.26 1k9t s ASN 149 CO 0.30 -0.70 -0.21 -0.54 -1.51 0.00 0.00 177.10 174.44 1k9t s LYS 150 N 0.31 1.63 0.12 -0.60 1.02 -1.26 -4.69 119.74 116.27 1k9t s LYS 150 Ca 0.63 -1.31 -0.30 0.00 0.02 0.00 0.00 55.97 55.00 1k9t s LYS 150 Cb -0.41 -1.99 -0.07 0.00 -0.52 0.00 0.00 37.83 34.84 1k9t s LYS 150 CO 0.37 0.45 1.25 -1.25 -0.92 0.00 0.00 175.35 175.25 1k9t s PRO 151 N -2.29 4.42 0.09 -1.68 0.04 -1.26 -4.94 135.00 129.38 1k9t s PRO 151 Ca 0.18 1.90 0.07 0.00 0.04 0.00 0.00 61.00 63.18 1k9t s PRO 151 Cb -0.10 -3.28 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 1k9t s PRO 151 CO 0.09 -0.25 -0.18 0.71 0.04 0.00 0.00 177.00 177.42 1k9t s TYR 152 N 0.67 1.51 -0.28 0.56 1.51 -1.17 -0.05 117.35 120.09 1k9t s TYR 152 Ca 0.58 -0.44 -0.12 0.00 -1.01 0.00 0.00 57.07 56.09 1k9t s TYR 152 Cb -0.33 -0.83 -0.05 0.00 -0.11 0.00 0.00 41.96 40.64 1k9t s TYR 152 CO 0.32 0.13 0.22 0.15 -1.11 0.00 0.00 175.55 175.27 1k9t s LYS 153 N -1.81 3.92 -0.92 -0.62 1.02 0.60 -4.58 119.74 117.34 1k9t s LYS 153 Ca 0.02 -0.30 -0.25 0.00 0.02 0.00 0.00 55.97 55.47 1k9t s LYS 153 Cb -0.10 -3.67 -0.18 0.00 -0.52 0.00 0.00 37.83 33.36 1k9t s LYS 153 CO 0.03 -0.22 1.93 1.04 -0.92 0.00 0.00 175.35 177.21 1k9t n GLN 154 N 5.11 0.98 -0.00 1.68 1.13 -1.26 -3.77 117.38 121.24 1k9t n GLN 154 Ca -0.13 -1.96 0.00 0.00 -1.94 0.00 0.00 57.00 52.98 1k9t n GLN 154 Cb 0.52 -3.47 0.00 0.00 0.11 0.00 0.00 30.24 27.40 1k9t n GLN 154 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 1k9t n ASN 155 N 13.80 1.94 0.20 1.08 6.94 -1.26 -4.63 115.26 133.32 1k9t n ASN 155 Ca 0.45 -1.92 0.10 0.00 -0.02 0.00 0.00 54.58 53.19 1k9t n ASN 155 Cb 0.45 -0.00 0.14 0.00 -2.36 0.00 0.00 39.78 38.00 1k9t n ASN 155 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1k9t h SER 156 N 0.03 0.00 0.00 0.53 4.64 -1.81 -3.47 113.55 113.47 1k9t h SER 156 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1k9t h SER 156 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1k9t h SER 156 CO 0.00 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 176.69 1k9t n GLY 157 N 1.13 0.64 3.74 -0.77 0.00 -1.26 -5.03 105.19 103.64 1k9t n GLY 157 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1k9t n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k9t s LYS 158 N -0.16 2.73 0.29 1.61 -0.14 -1.26 -5.02 119.74 117.79 1k9t s LYS 158 Ca 0.00 -0.82 -0.29 0.00 -1.36 0.00 0.00 55.97 53.50 1k9t s LYS 158 Cb 0.00 -2.61 -0.10 0.00 -1.68 0.00 0.00 37.83 33.44 1k9t s LYS 158 CO 0.00 0.53 1.22 0.08 -0.76 0.00 0.00 175.35 176.42 1k9t s VAL 159 N -1.48 3.10 -0.32 3.17 1.01 -0.08 -4.89 120.40 120.91 1k9t s VAL 159 Ca 0.28 1.08 -0.01 0.00 0.00 0.00 0.00 61.98 63.33 1k9t s VAL 159 Cb -0.11 -3.69 0.11 0.00 0.00 0.00 0.00 36.38 32.68 1k9t s VAL 159 CO 0.21 0.25 0.13 -0.69 0.00 0.00 0.00 175.10 174.99 1k9t s VAL 160 N -0.99 0.60 0.31 2.92 1.01 -1.24 -0.80 120.40 122.21 1k9t s VAL 160 Ca 0.48 -1.35 0.10 0.00 0.00 0.00 0.00 61.98 61.21 1k9t s VAL 160 Cb -0.36 -1.46 -0.05 0.00 0.00 0.00 0.00 36.38 34.51 1k9t s VAL 160 CO 0.46 -0.74 -0.06 -0.83 0.00 0.00 0.00 175.10 173.94 1k9t s GLY 161 N 1.59 1.96 -0.02 4.51 0.00 0.05 -0.03 107.32 115.39 1k9t s GLY 161 Ca 0.11 -1.90 -0.26 0.00 0.00 0.00 0.00 44.72 42.67 1k9t s GLY 161 CO -0.24 -1.90 0.59 -0.45 0.00 0.00 0.00 173.10 171.10 1k9t s SER 162 N -3.64 -0.54 -0.06 1.64 0.15 -0.89 -0.61 113.70 109.75 1k9t s SER 162 Ca 0.33 0.48 -0.10 0.00 0.70 0.00 0.00 55.95 57.35 1k9t s SER 162 Cb -0.02 0.50 -0.05 0.00 -1.71 0.00 0.00 66.02 64.74 1k9t s SER 162 CO 0.18 -0.62 0.27 -0.31 1.20 0.00 0.00 173.24 173.95 1k9t s TYR 163 N -1.58 3.65 -0.12 3.44 1.51 -0.84 -1.01 117.35 122.41 1k9t s TYR 163 Ca -0.10 0.74 0.01 0.00 -1.01 0.00 0.00 57.07 56.71 1k9t s TYR 163 Cb -0.01 -2.10 -0.02 0.00 -0.11 0.00 0.00 41.96 39.73 1k9t s TYR 163 CO 0.06 0.69 -0.14 0.12 -1.11 0.00 0.00 175.55 175.16 1k9t s PHE 164 N -1.08 2.78 -0.16 2.71 2.19 0.11 -1.31 117.98 123.22 1k9t s PHE 164 Ca 0.20 -0.61 -0.08 0.00 0.33 0.00 0.00 56.93 56.77 1k9t s PHE 164 Cb -0.14 -1.81 -0.04 0.00 -1.31 0.00 0.00 43.02 39.72 1k9t s PHE 164 CO 0.09 -0.18 0.12 0.14 1.83 0.00 0.00 175.22 177.22 1k9t s VAL 165 N 0.22 5.31 0.28 3.12 -7.23 -1.26 -1.04 120.40 119.80 1k9t s VAL 165 Ca -0.09 0.14 0.02 0.00 -1.81 0.00 0.00 61.98 60.24 1k9t s VAL 165 Cb -0.15 -3.36 0.28 0.00 0.56 0.00 0.00 36.38 33.70 1k9t s VAL 165 CO 0.05 0.53 1.82 -0.08 -0.31 0.00 0.00 175.10 177.11 1k9t h GLU 166 N 5.89 0.89 -0.03 4.82 4.81 -1.11 -1.56 114.58 128.29 1k9t h GLU 166 Ca -0.47 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1k9t h GLU 166 Cb 1.19 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.37 1k9t h GLU 166 CO 0.67 0.59 0.00 -2.67 -0.73 0.00 0.00 179.01 176.87 1k9t n TRP 167 N -4.67 0.03 0.82 0.92 2.14 -1.26 -3.86 117.44 111.56 1k9t n TRP 167 Ca 0.20 -0.01 0.10 0.00 2.07 0.00 0.00 57.50 59.85 1k9t n TRP 167 Cb 0.40 0.00 0.47 0.00 -0.81 0.00 0.00 31.31 31.37 1k9t n TRP 167 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1k9t n GLY 168 N 1.00 -1.09 0.01 -1.67 0.00 -0.59 -3.00 105.19 99.86 1k9t n GLY 168 Ca 0.19 -0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.28 1k9t n GLY 168 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1k9t n VAL 169 N -1.40 0.00 0.00 1.61 0.24 -1.24 -0.62 118.33 116.92 1k9t n VAL 169 Ca 0.07 -0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.36 1k9t n VAL 169 Cb 0.20 -0.43 0.00 0.00 -1.47 0.00 0.00 33.84 32.14 1k9t n VAL 169 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1k9t n TYR 170 N -1.32 0.00 -0.26 6.34 4.01 -1.16 -4.30 117.16 120.46 1k9t n TYR 170 Ca 0.12 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.90 1k9t n TYR 170 Cb 0.28 0.00 0.17 0.00 -0.31 0.00 0.00 39.34 39.48 1k9t n TYR 170 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1k9t h GLY 171 N 0.00 1.17 2.00 2.72 0.00 -1.82 -0.16 103.07 106.98 1k9t h GLY 171 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.12 1k9t h GLY 171 CO 0.00 -0.01 0.00 3.21 0.00 0.00 0.00 176.54 179.74 1k9t h ARG 172 N 0.57 0.00 -5.94 4.80 3.08 -1.85 -3.46 114.38 111.58 1k9t h ARG 172 Ca 0.40 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 60.01 1k9t h ARG 172 Cb 0.51 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.44 1k9t h ARG 172 CO -0.33 0.00 -0.66 -1.71 -1.07 0.00 0.00 179.97 176.20 1k9t n ASN 173 N -2.78 -3.73 -4.25 7.04 5.15 -0.07 -4.93 115.26 111.68 1k9t n ASN 173 Ca 0.01 -0.62 -0.39 0.00 -0.60 0.00 0.00 54.58 52.99 1k9t n ASN 173 Cb 0.29 -3.06 -0.11 0.00 -0.53 0.00 0.00 39.78 36.36 1k9t n ASN 173 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 1k9t s PHE 174 N -3.07 3.33 0.41 1.20 2.19 0.21 -4.94 117.98 117.31 1k9t s PHE 174 Ca 0.54 -1.59 0.08 0.00 0.33 0.00 0.00 56.93 56.29 1k9t s PHE 174 Cb -0.29 -2.67 -0.01 0.00 -1.31 0.00 0.00 43.02 38.74 1k9t s PHE 174 CO 0.66 -0.81 0.42 0.95 1.83 0.00 0.00 175.22 178.28 1k9t s THR 175 N 1.38 2.90 0.51 0.12 -4.23 -1.26 -3.72 115.64 111.34 1k9t s THR 175 Ca 0.01 -1.24 0.18 0.00 -1.18 0.00 0.00 61.69 59.46 1k9t s THR 175 Cb -0.21 -3.04 0.31 0.00 1.34 0.00 0.00 72.50 70.90 1k9t s THR 175 CO 0.02 -0.03 2.09 0.58 -0.54 0.00 0.00 174.62 176.74 1k9t h VAL 176 N 0.95 0.93 0.00 2.29 2.07 -1.94 -0.62 116.25 119.92 1k9t h VAL 176 Ca -0.42 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1k9t h VAL 176 Cb 1.27 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 1k9t h VAL 176 CO 0.54 0.01 0.00 -0.90 0.02 0.00 0.00 177.57 177.24 1k9t n ASP 177 N -4.49 0.54 -0.14 0.57 5.75 -1.26 -1.43 116.55 116.10 1k9t n ASP 177 Ca 0.02 0.63 0.12 0.00 -0.01 0.00 0.00 54.79 55.55 1k9t n ASP 177 Cb 0.25 -0.75 0.31 0.00 -1.03 0.00 0.00 41.12 39.90 1k9t n ASP 177 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1k9t n LYS 178 N -2.09 0.47 -2.30 0.11 5.02 -0.24 -4.79 118.16 114.33 1k9t n LYS 178 Ca 0.02 -0.28 -0.42 0.00 -2.02 0.00 0.00 58.31 55.62 1k9t n LYS 178 Cb 0.22 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.70 1k9t n LYS 178 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1k9t s ILE 179 N -2.73 3.61 -1.49 -0.18 1.01 -0.51 -4.85 121.20 116.06 1k9t s ILE 179 Ca 0.18 1.20 -0.11 0.00 0.00 0.00 0.00 60.65 61.92 1k9t s ILE 179 Cb 0.18 -3.77 -0.05 0.00 0.01 0.00 0.00 42.46 38.83 1k9t s ILE 179 CO 0.61 0.12 2.65 -0.81 0.00 0.00 0.00 174.94 177.51 1k9t n PRO 180 N 3.52 3.24 -0.09 2.79 -0.04 -1.26 -4.75 135.00 138.41 1k9t n PRO 180 Ca 0.09 -2.23 0.11 0.00 -0.04 0.00 0.00 63.50 61.43 1k9t n PRO 180 Cb 0.44 -2.91 0.49 0.00 -0.04 0.00 0.00 33.50 31.48 1k9t n PRO 180 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1k9t h ALA 181 N 5.50 1.99 0.00 0.55 0.00 -1.93 -0.70 119.26 124.68 1k9t h ALA 181 Ca 0.74 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.64 1k9t h ALA 181 Cb 0.38 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1k9t h ALA 181 CO 1.79 -0.12 0.00 -0.56 0.00 0.00 0.00 179.25 180.37 1k9t h GLN 182 N 0.44 0.00 -0.65 0.00 3.07 -1.93 -2.69 115.11 113.35 1k9t h GLN 182 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.02 1k9t h GLN 182 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.08 1k9t h GLN 182 CO -0.08 0.00 0.00 0.09 0.09 0.00 0.00 178.83 178.93 1k9t n ASN 183 N -2.70 3.92 -4.25 0.06 3.02 -0.27 -4.58 115.26 110.47 1k9t n ASN 183 Ca -0.01 -2.46 -0.19 0.00 -0.03 0.00 0.00 54.58 51.90 1k9t n ASN 183 Cb 0.16 -0.55 -0.11 0.00 -0.61 0.00 0.00 39.78 38.67 1k9t n ASN 183 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1k9t s LEU 184 N -1.67 2.40 -0.19 3.41 1.43 -1.01 -4.91 118.68 118.13 1k9t s LEU 184 Ca 0.38 -0.80 0.16 0.00 -1.03 0.00 0.00 54.13 52.83 1k9t s LEU 184 Cb 0.26 -0.59 -0.23 0.00 0.03 0.00 0.00 46.19 45.67 1k9t s LEU 184 CO 0.15 -0.12 0.04 0.35 0.23 0.00 0.00 176.35 177.00 1k9t n THR 185 N 0.56 1.31 -4.31 5.49 -2.24 0.96 -4.89 114.28 111.16 1k9t n THR 185 Ca -0.16 -0.78 -0.21 0.00 -2.27 0.00 0.00 64.05 60.63 1k9t n THR 185 Cb 0.57 -0.57 -0.16 0.00 -2.10 0.00 0.00 70.33 68.07 1k9t n THR 185 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1k9t s HIS 186 N -2.46 0.96 -0.21 4.78 3.76 -0.99 -1.31 115.29 119.82 1k9t s HIS 186 Ca -0.11 -0.30 0.02 0.00 -0.15 0.00 0.00 55.06 54.52 1k9t s HIS 186 Cb 0.06 -0.77 0.04 0.00 1.11 0.00 0.00 32.58 33.02 1k9t s HIS 186 CO 0.76 -0.20 -0.13 -1.17 -0.85 0.00 0.00 174.74 173.15 1k9t s LEU 187 N 0.73 2.57 -0.11 0.89 2.96 0.13 -2.10 118.68 123.75 1k9t s LEU 187 Ca -0.12 -0.96 -0.04 0.00 -0.22 0.00 0.00 54.13 52.79 1k9t s LEU 187 Cb -0.14 -1.39 -0.04 0.00 0.50 0.00 0.00 46.19 45.12 1k9t s LEU 187 CO 0.01 -0.12 0.05 -0.76 -1.32 0.00 0.00 176.35 174.22 1k9t s LEU 188 N 1.28 3.87 -0.36 -0.68 1.02 -0.18 -0.68 118.68 122.95 1k9t s LEU 188 Ca -0.02 0.23 -0.11 0.00 0.02 0.00 0.00 54.13 54.25 1k9t s LEU 188 Cb -0.16 -1.92 0.01 0.00 0.02 0.00 0.00 46.19 44.14 1k9t s LEU 188 CO -0.09 0.35 0.20 -0.47 0.02 0.00 0.00 176.35 176.37 1k9t s TYR 189 N -0.69 3.22 -0.21 0.29 5.04 0.20 0.06 117.35 125.26 1k9t s TYR 189 Ca 0.12 -0.74 -0.07 0.00 -2.44 0.00 0.00 57.07 53.93 1k9t s TYR 189 Cb -0.12 -2.44 -0.03 0.00 0.35 0.00 0.00 41.96 39.72 1k9t s TYR 189 CO 0.02 -0.56 0.06 0.20 -1.34 0.00 0.00 175.55 173.93 1k9t s GLY 190 N 1.60 1.82 0.02 8.97 0.00 -0.21 -0.70 107.32 118.82 1k9t s GLY 190 Ca 0.03 -0.94 -0.08 0.00 0.00 0.00 0.00 44.72 43.73 1k9t s GLY 190 CO 0.07 0.27 0.16 -1.36 0.00 0.00 0.00 173.10 172.24 1k9t s PHE 191 N 0.97 0.07 -0.26 1.90 0.08 -1.26 -0.41 117.98 119.06 1k9t s PHE 191 Ca 0.03 -0.24 -0.18 0.00 0.12 0.00 0.00 56.93 56.66 1k9t s PHE 191 Cb -0.14 -0.05 -0.02 0.00 -0.57 0.00 0.00 43.02 42.23 1k9t s PHE 191 CO 0.03 -0.36 0.54 0.42 -0.10 0.00 0.00 175.22 175.75 1k9t s ILE 192 N -2.05 5.05 0.48 0.64 1.09 -0.09 -4.60 121.20 121.72 1k9t s ILE 192 Ca -0.09 0.91 -0.09 0.00 -1.10 0.00 0.00 60.65 60.28 1k9t s ILE 192 Cb -0.04 -3.86 -0.05 0.00 -1.06 0.00 0.00 42.46 37.46 1k9t s ILE 192 CO -0.01 0.06 0.84 -2.16 -0.10 0.00 0.00 174.94 173.56 1k9t s PRO 193 N 2.36 3.65 -0.24 2.79 0.04 -1.26 -3.34 135.00 139.00 1k9t s PRO 193 Ca 0.22 0.43 -0.07 0.00 0.04 0.00 0.00 61.00 61.62 1k9t s PRO 193 Cb -0.16 -2.31 -0.03 0.00 0.04 0.00 0.00 34.50 32.04 1k9t s PRO 193 CO 0.09 -0.22 0.05 0.42 0.04 0.00 0.00 177.00 177.39 1k9t s ILE 194 N -2.69 4.20 0.39 0.56 1.01 -1.26 -1.23 121.20 122.17 1k9t s ILE 194 Ca 0.51 -0.21 -0.26 0.00 0.00 0.00 0.00 60.65 60.69 1k9t s ILE 194 Cb -0.10 -2.96 -0.11 0.00 0.01 0.00 0.00 42.46 39.30 1k9t s ILE 194 CO 0.41 0.35 1.18 0.00 0.00 0.00 0.00 174.94 176.89 1k9t n GLY 196 N 0.94 3.43 0.00 0.00 0.00 -1.26 -1.24 105.19 107.05 1k9t n GLY 196 Ca 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1k9t n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k9t n GLY 197 N -0.84 0.69 3.65 -0.02 0.00 -1.26 -3.92 105.19 103.49 1k9t n GLY 197 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 1k9t n GLY 197 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1k9t n ASN 198 N 0.00 2.54 0.00 1.61 3.02 -1.26 -1.00 115.26 120.17 1k9t n ASN 198 Ca 0.00 1.14 0.00 0.00 -0.03 0.00 0.00 54.58 55.69 1k9t n ASN 198 Cb 0.00 -1.39 0.00 0.00 -0.61 0.00 0.00 39.78 37.78 1k9t n ASN 198 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k9t n GLY 199 N 2.27 2.72 0.10 7.41 0.00 -1.26 -4.77 105.19 111.66 1k9t n GLY 199 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 1k9t n GLY 199 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1k9t n ILE 200 N -2.00 0.93 -2.29 -0.61 5.41 -0.17 -4.71 119.36 115.91 1k9t n ILE 200 Ca 0.00 -0.35 -0.14 0.00 1.00 0.00 0.00 62.75 63.27 1k9t n ILE 200 Cb 0.00 -1.11 0.04 0.00 -0.71 0.00 0.00 39.64 37.86 1k9t n ILE 200 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1k9t n ASN 201 N -3.02 3.51 0.17 4.38 3.02 -0.85 -2.96 115.26 119.51 1k9t n ASN 201 Ca -0.29 -3.12 0.14 0.00 -0.03 0.00 0.00 54.58 51.29 1k9t n ASN 201 Cb 0.80 -0.40 0.72 0.00 -0.61 0.00 0.00 39.78 40.29 1k9t n ASN 201 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1k9t h ASP 202 N 2.23 0.00 0.00 6.41 3.32 -1.84 -1.27 116.42 125.27 1k9t h ASP 202 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1k9t h ASP 202 Cb 1.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.98 1k9t h ASP 202 CO 0.51 0.00 0.00 0.28 -1.72 0.00 0.00 179.24 178.31 1k9t h SER 203 N 0.00 0.00 1.19 6.45 0.02 -1.91 -0.69 113.55 118.61 1k9t h SER 203 Ca 0.10 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.99 1k9t h SER 203 Cb 0.43 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 1k9t h SER 203 CO -0.00 0.00 -0.30 -0.07 -1.14 0.00 0.00 176.83 175.32 1k9t h LEU 204 N 0.00 0.00 -1.02 5.07 3.38 -1.34 -3.05 115.31 118.35 1k9t h LEU 204 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1k9t h LEU 204 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1k9t h LEU 204 CO 0.00 0.30 0.00 0.29 0.09 0.00 0.00 178.44 179.12 1k9t n LYS 205 N -3.32 0.14 0.09 1.13 5.02 -0.27 -1.63 118.16 119.33 1k9t n LYS 205 Ca 0.01 0.55 0.12 0.00 -2.02 0.00 0.00 58.31 56.97 1k9t n LYS 205 Cb 0.53 -1.87 0.45 0.00 -0.02 0.00 0.00 35.03 34.13 1k9t n LYS 205 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1k9t n GLU 206 N -2.15 0.18 -3.88 1.97 -0.58 -1.15 -4.61 120.64 110.42 1k9t n GLU 206 Ca -0.00 0.25 -0.36 0.00 -0.42 0.00 0.00 57.16 56.64 1k9t n GLU 206 Cb 0.10 -1.76 -0.14 0.00 -0.57 0.00 0.00 31.44 29.07 1k9t n GLU 206 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1k9t s ILE 207 N -3.15 3.39 -0.02 -3.67 -1.09 -0.64 -5.08 121.20 110.94 1k9t s ILE 207 Ca 0.09 -0.77 -0.37 0.00 -2.23 0.00 0.00 60.65 57.37 1k9t s ILE 207 Cb 0.12 -2.69 -0.15 0.00 -1.58 0.00 0.00 42.46 38.16 1k9t s ILE 207 CO 0.50 0.21 1.59 1.21 -1.23 0.00 0.00 174.94 177.22 1k9t n GLU 208 N 4.77 1.54 0.00 2.79 0.00 -1.26 -1.56 120.64 126.92 1k9t n GLU 208 Ca -0.16 0.56 0.00 0.00 0.00 0.00 0.00 57.16 57.56 1k9t n GLU 208 Cb 0.48 -2.27 0.00 0.00 0.00 0.00 0.00 31.44 29.65 1k9t n GLU 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1k9t n GLY 209 N 3.47 2.52 0.08 8.31 0.00 -1.26 -4.88 105.19 113.44 1k9t n GLY 209 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.11 1k9t n GLY 209 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1k9t h SER 210 N 0.00 0.14 -0.68 1.61 0.87 -1.52 -0.60 113.55 113.37 1k9t h SER 210 Ca 0.00 -0.27 -0.02 0.00 -1.23 0.00 0.00 61.79 60.27 1k9t h SER 210 Cb 0.00 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 61.89 1k9t h SER 210 CO 0.00 0.38 0.37 0.15 -0.53 0.00 0.00 176.83 177.20 1k9t h PHE 211 N -0.10 0.95 -0.60 2.24 3.57 -1.73 -2.05 116.94 119.22 1k9t h PHE 211 Ca 0.03 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 1k9t h PHE 211 Cb 0.30 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 1k9t h PHE 211 CO 0.02 0.68 0.29 1.96 -2.23 0.00 0.00 178.31 179.03 1k9t h GLN 212 N 0.94 0.86 -0.41 1.11 7.50 -1.91 -0.60 115.11 122.60 1k9t h GLN 212 Ca 0.24 -0.13 0.07 0.00 0.50 0.00 0.00 58.65 59.34 1k9t h GLN 212 Cb 0.06 -0.15 -0.06 0.00 0.05 0.00 0.00 27.48 27.37 1k9t h GLN 212 CO -0.04 0.69 0.02 0.00 -1.50 0.00 0.00 178.83 178.01 1k9t h ALA 213 N 1.12 0.40 -0.62 3.87 0.00 -0.77 -0.11 119.26 123.15 1k9t h ALA 213 Ca 0.20 0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 1k9t h ALA 213 Cb 0.12 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1k9t h ALA 213 CO -0.03 -0.37 0.12 1.25 0.00 0.00 0.00 179.25 180.22 1k9t h LEU 214 N 0.13 0.93 -1.31 0.00 5.85 -0.86 -1.53 115.31 118.52 1k9t h LEU 214 Ca 0.20 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1k9t h LEU 214 Cb 0.28 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1k9t h LEU 214 CO -0.32 0.92 0.00 1.56 -0.34 0.00 0.00 178.44 180.26 1k9t h GLN 215 N 0.93 0.46 -0.19 1.25 1.08 0.36 -0.35 115.11 118.65 1k9t h GLN 215 Ca 0.19 -0.09 -0.06 0.00 -1.45 0.00 0.00 58.65 57.24 1k9t h GLN 215 Cb 0.37 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.73 1k9t h GLN 215 CO 0.01 0.49 -0.11 -0.09 -0.95 0.00 0.00 178.83 178.17 1k9t h ARG 216 N 0.45 0.42 -0.79 1.46 2.43 -0.78 -1.92 114.38 115.64 1k9t h ARG 216 Ca 0.10 -0.19 0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1k9t h ARG 216 Cb 0.29 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.80 1k9t h ARG 216 CO 0.01 0.73 0.52 1.03 -1.51 0.00 0.00 179.97 180.75 1k9t h SER 217 N 0.10 0.91 -0.44 -3.80 0.87 -0.79 -2.82 113.55 107.58 1k9t h SER 217 Ca 0.04 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1k9t h SER 217 Cb 0.61 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1k9t h SER 217 CO 0.03 0.66 0.00 0.00 -0.53 0.00 0.00 176.83 176.99 1k9t s GLN 219 N -1.66 4.15 0.00 0.00 0.74 -0.73 -1.21 119.66 120.94 1k9t s GLN 219 Ca 0.33 2.54 0.00 0.00 0.05 0.00 0.00 55.36 58.28 1k9t s GLN 219 Cb 0.21 -3.31 0.00 0.00 1.10 0.00 0.00 33.01 31.01 1k9t s GLN 219 CO 0.17 -0.76 0.00 0.41 -0.55 0.00 0.00 175.29 174.56 1k9t n GLY 220 N 4.03 0.66 3.63 2.59 0.00 -1.26 -4.71 105.19 110.13 1k9t n GLY 220 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1k9t n GLY 220 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1k9t s ARG 221 N -0.23 3.15 0.82 1.61 3.52 -0.35 -5.04 118.95 122.42 1k9t s ARG 221 Ca 0.00 -0.45 -0.12 0.00 -0.13 0.00 0.00 55.73 55.03 1k9t s ARG 221 Cb 0.00 -2.81 0.09 0.00 -1.56 0.00 0.00 34.95 30.67 1k9t s ARG 221 CO 0.00 0.58 1.16 -1.21 -0.81 0.00 0.00 175.30 175.02 1k9t s GLU 222 N -0.54 1.66 0.49 5.12 2.02 -1.26 -4.96 118.70 121.22 1k9t s GLU 222 Ca 0.09 1.56 -0.16 0.00 0.02 0.00 0.00 54.97 56.48 1k9t s GLU 222 Cb -0.12 -1.80 -0.08 0.00 0.10 0.00 0.00 34.13 32.23 1k9t s GLU 222 CO 0.02 -2.16 0.96 -0.51 0.02 0.00 0.00 175.26 173.59 1k9t s ASP 223 N -2.56 6.65 0.00 -0.19 1.01 -1.26 -3.37 116.67 116.95 1k9t s ASP 223 Ca 0.69 1.54 0.00 0.00 0.71 0.00 0.00 52.55 55.48 1k9t s ASP 223 Cb -0.24 -2.49 0.00 0.00 1.01 0.00 0.00 42.92 41.20 1k9t s ASP 223 CO 0.53 -0.54 0.00 0.49 0.21 0.00 0.00 175.17 175.86 1k9t n PHE 224 N -1.43 0.00 -3.56 4.23 3.72 -0.38 -4.97 117.46 115.08 1k9t n PHE 224 Ca 0.06 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.13 1k9t n PHE 224 Cb 0.54 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.03 1k9t n PHE 224 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1k9t s LYS 225 N -0.11 3.74 0.73 -1.08 1.02 -1.22 -3.46 119.74 119.37 1k9t s LYS 225 Ca 0.00 0.14 -0.11 0.00 0.02 0.00 0.00 55.97 56.02 1k9t s LYS 225 Cb 0.00 -2.87 0.03 0.00 -0.52 0.00 0.00 37.83 34.47 1k9t s LYS 225 CO 0.00 0.47 1.07 0.14 -0.92 0.00 0.00 175.35 176.12 1k9t s VAL 226 N -1.57 3.69 0.00 3.17 -7.23 -1.26 -0.85 120.40 116.34 1k9t s VAL 226 Ca 0.39 0.55 0.00 0.00 -1.81 0.00 0.00 61.98 61.11 1k9t s VAL 226 Cb -0.13 -3.23 0.00 0.00 0.56 0.00 0.00 36.38 33.58 1k9t s VAL 226 CO 0.21 -0.72 0.00 -0.24 -0.31 0.00 0.00 175.10 174.04 1k9t n SER 227 N -3.28 0.00 -4.15 4.85 2.88 -0.37 -4.78 113.62 108.77 1k9t n SER 227 Ca 0.08 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.31 1k9t n SER 227 Cb 0.54 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.83 1k9t n SER 227 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1k9t s ILE 228 N -1.86 1.88 0.03 2.46 1.01 -1.26 -4.02 121.20 119.44 1k9t s ILE 228 Ca 0.00 -0.89 -0.21 0.00 0.00 0.00 0.00 60.65 59.55 1k9t s ILE 228 Cb 0.00 -1.66 -0.15 0.00 0.01 0.00 0.00 42.46 40.65 1k9t s ILE 228 CO 0.00 0.52 1.32 -0.74 0.00 0.00 0.00 174.94 176.04 1k9t h HIS 229 N 7.15 0.37 -3.14 3.97 2.76 -1.92 -3.40 115.15 120.94 1k9t h HIS 229 Ca -0.28 -0.12 -0.62 0.00 -2.20 0.00 0.00 60.37 57.15 1k9t h HIS 229 Cb 1.20 -0.08 -0.41 0.00 1.55 0.00 0.00 27.41 29.68 1k9t h HIS 229 CO 0.47 0.73 -0.68 0.34 -1.30 0.00 0.00 177.93 177.49 1k9t s ASP 230 N -6.09 3.97 0.51 3.26 -1.08 -1.26 -4.58 116.67 111.41 1k9t s ASP 230 Ca -0.14 -2.94 0.19 0.00 -0.52 0.00 0.00 52.55 49.14 1k9t s ASP 230 Cb 0.05 -1.33 1.27 0.00 -1.46 0.00 0.00 42.92 41.45 1k9t s ASP 230 CO 0.74 -0.23 2.06 -0.65 0.52 0.00 0.00 175.17 177.61 1k9t h PRO 231 N 6.45 0.08 0.19 4.34 0.11 -1.94 0.33 132.00 141.55 1k9t h PRO 231 Ca -0.01 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1k9t h PRO 231 Cb 0.89 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1k9t h PRO 231 CO 0.59 0.05 -0.09 0.35 -0.21 0.00 0.00 178.00 178.69 1k9t h PHE 232 N 0.08 -0.24 -0.66 0.65 3.57 -1.96 0.14 116.94 118.52 1k9t h PHE 232 Ca 0.15 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.59 1k9t h PHE 232 Cb 0.50 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 1k9t h PHE 232 CO -0.00 0.07 0.17 0.00 -2.23 0.00 0.00 178.31 176.33 1k9t h ALA 233 N 0.16 0.87 -0.04 2.41 0.00 -1.83 0.27 119.26 121.09 1k9t h ALA 233 Ca -0.03 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.51 1k9t h ALA 233 Cb 0.42 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1k9t h ALA 233 CO 0.04 0.57 -0.61 0.00 0.00 0.00 0.00 179.25 179.26 1k9t h ALA 234 N 1.07 0.90 0.00 0.00 0.00 -0.92 -0.61 119.26 119.70 1k9t h ALA 234 Ca 0.21 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1k9t h ALA 234 Cb 0.34 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1k9t h ALA 234 CO -0.00 0.74 -0.22 1.28 0.00 0.00 0.00 179.25 181.05 1k9t n LEU 235 N -3.85 0.00 -0.01 0.00 4.77 0.02 -0.14 117.00 117.80 1k9t n LEU 235 Ca -0.02 -0.01 0.01 0.00 -0.03 0.00 0.00 56.01 55.97 1k9t n LEU 235 Cb 0.61 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.66 1k9t n LEU 235 CO 0.43 0.00 -0.59 0.00 -1.33 0.00 0.00 177.39 175.91 1k9t n GLN 236 N -0.35 0.91 -1.95 3.23 6.02 -0.23 -0.92 117.38 124.08 1k9t n GLN 236 Ca 0.00 -0.04 -0.42 0.00 -0.01 0.00 0.00 57.00 56.54 1k9t n GLN 236 Cb 0.00 -1.13 -0.02 0.00 1.02 0.00 0.00 30.24 30.11 1k9t n GLN 236 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1k9t s LYS 237 N -2.30 4.23 0.30 -1.09 2.20 -0.08 -4.62 119.74 118.37 1k9t s LYS 237 Ca -0.02 2.36 -0.30 0.00 -0.36 0.00 0.00 55.97 57.65 1k9t s LYS 237 Cb 0.03 -3.11 -0.11 0.00 -1.51 0.00 0.00 37.83 33.12 1k9t s LYS 237 CO 0.21 -0.52 1.59 0.00 -0.36 0.00 0.00 175.35 176.27 1k9t s ALA 238 N 0.42 3.73 0.10 3.13 0.00 -1.26 -0.93 121.76 126.95 1k9t s ALA 238 Ca 0.64 1.57 -0.04 0.00 0.00 0.00 0.00 51.96 54.13 1k9t s ALA 238 Cb -0.43 -3.65 -0.02 0.00 0.00 0.00 0.00 23.12 19.02 1k9t s ALA 238 CO 0.39 -0.99 0.11 -0.65 0.00 0.00 0.00 175.76 174.62 1k9t s GLN 239 N -0.64 0.86 0.01 0.00 -1.52 -1.17 -4.85 119.66 112.35 1k9t s GLN 239 Ca 0.62 -1.21 -0.37 0.00 -1.95 0.00 0.00 55.36 52.46 1k9t s GLN 239 Cb -0.48 0.28 -0.15 0.00 -0.22 0.00 0.00 33.01 32.44 1k9t s GLN 239 CO 0.49 -0.25 1.53 1.17 -0.25 0.00 0.00 175.29 177.99 1k9t n LYS 240 N -0.05 1.48 0.00 2.91 4.81 -1.26 -0.60 118.16 125.44 1k9t n LYS 240 Ca -0.11 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 57.87 1k9t n LYS 240 Cb 0.62 -2.24 0.00 0.00 0.02 0.00 0.00 35.03 33.44 1k9t n LYS 240 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1k9t n GLY 241 N 3.27 2.69 2.24 3.14 0.00 -1.26 -4.88 105.19 110.38 1k9t n GLY 241 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 1k9t n GLY 241 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1k9t n VAL 242 N -2.00 -0.11 0.29 1.61 0.24 0.23 -4.89 118.33 113.70 1k9t n VAL 242 Ca 0.00 -4.44 0.05 0.00 -2.04 0.00 0.00 64.34 57.91 1k9t n VAL 242 Cb 0.00 -1.03 -0.07 0.00 -1.47 0.00 0.00 33.84 31.27 1k9t n VAL 242 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1k9t n THR 243 N 0.70 0.00 -2.24 3.34 -2.24 -1.22 -3.05 114.28 109.57 1k9t n THR 243 Ca 0.24 -0.25 -0.38 0.00 -2.27 0.00 0.00 64.05 61.39 1k9t n THR 243 Cb 0.59 0.69 -0.02 0.00 -2.10 0.00 0.00 70.33 69.49 1k9t n THR 243 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k9t s ALA 244 N -2.32 3.15 0.30 6.98 0.00 -1.26 -4.92 121.76 123.70 1k9t s ALA 244 Ca 0.01 1.01 0.02 0.00 0.00 0.00 0.00 51.96 53.00 1k9t s ALA 244 Cb 0.08 -3.40 0.59 0.00 0.00 0.00 0.00 23.12 20.38 1k9t s ALA 244 CO 0.45 -0.60 1.87 0.11 0.00 0.00 0.00 175.76 177.59 1k9t h TRP 245 N 2.59 1.06 -0.46 0.00 5.08 -2.04 -0.37 115.95 121.81 1k9t h TRP 245 Ca -0.49 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.51 1k9t h TRP 245 Cb 1.24 -0.34 0.00 0.00 -3.00 0.00 0.00 29.16 27.06 1k9t h TRP 245 CO 0.54 0.46 0.00 -0.40 -1.28 0.00 0.00 178.44 177.77 1k9t n ASP 246 N -4.56 4.61 -4.63 0.11 5.68 -1.26 -4.83 116.55 111.67 1k9t n ASP 246 Ca 0.17 -2.68 -0.43 0.00 -0.50 0.00 0.00 54.79 51.35 1k9t n ASP 246 Cb 0.32 -0.63 -0.02 0.00 -1.14 0.00 0.00 41.12 39.64 1k9t n ASP 246 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1k9t s ASP 247 N -0.63 6.59 0.23 -1.12 1.01 -0.15 -4.91 116.67 117.68 1k9t s ASP 247 Ca 0.42 1.28 -0.08 0.00 0.71 0.00 0.00 52.55 54.88 1k9t s ASP 247 Cb 0.32 -2.54 0.20 0.00 1.01 0.00 0.00 42.92 41.91 1k9t s ASP 247 CO 0.13 -1.14 1.89 1.55 0.21 0.00 0.00 175.17 177.82 1k9t h PRO 248 N 9.70 1.15 -4.82 8.23 0.13 -1.88 -3.40 132.00 141.11 1k9t h PRO 248 Ca -0.28 -0.08 -0.68 0.00 -0.87 0.00 0.00 66.00 64.09 1k9t h PRO 248 Cb 1.11 -0.25 -0.33 0.00 0.13 0.00 0.00 31.00 31.66 1k9t h PRO 248 CO 1.03 0.77 -0.72 0.71 -0.23 0.00 0.00 178.00 179.56 1k9t s TYR 249 N -6.09 3.20 0.00 1.56 2.02 -1.26 -4.80 117.35 111.98 1k9t s TYR 249 Ca -0.13 -1.81 0.00 0.00 -0.37 0.00 0.00 57.07 54.76 1k9t s TYR 249 Cb 0.16 -2.08 0.00 0.00 -0.40 0.00 0.00 41.96 39.65 1k9t s TYR 249 CO 0.80 -0.79 0.00 1.63 -1.57 0.00 0.00 175.55 175.62 1k9t n LYS 250 N 4.62 3.89 0.00 -0.62 5.02 -0.10 -4.15 118.16 126.82 1k9t n LYS 250 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 1k9t n LYS 250 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.45 1k9t n LYS 250 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k9t n GLY 251 N 5.00 0.97 0.25 0.72 0.00 -0.10 -0.65 105.19 111.37 1k9t n GLY 251 Ca 0.00 -0.71 -0.11 0.00 0.00 0.00 0.00 46.02 45.20 1k9t n GLY 251 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1k9t h ASN 252 N 5.06 0.87 -0.27 1.61 2.35 -0.64 -2.64 115.58 121.91 1k9t h ASN 252 Ca 0.00 -0.38 -0.11 0.00 -0.55 0.00 0.00 56.30 55.26 1k9t h ASN 252 Cb 0.00 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.12 1k9t h ASN 252 CO 0.00 1.05 -0.21 -0.26 -1.65 0.00 0.00 177.43 176.36 1k9t h PHE 253 N 0.68 0.84 -0.59 1.19 -1.00 -0.58 0.11 116.94 117.58 1k9t h PHE 253 Ca 0.10 -0.18 -0.08 0.00 2.81 0.00 0.00 57.97 60.62 1k9t h PHE 253 Cb 0.69 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 40.03 1k9t h PHE 253 CO 0.05 0.89 0.07 0.78 -1.61 0.00 0.00 178.31 178.49 1k9t h GLY 254 N 0.97 1.07 1.66 -1.45 0.00 -0.87 -1.42 103.07 103.03 1k9t h GLY 254 Ca 0.09 -0.73 -0.13 0.00 0.00 0.00 0.00 47.33 46.56 1k9t h GLY 254 CO 0.05 0.68 -0.49 1.46 0.00 0.00 0.00 176.54 178.24 1k9t h GLN 255 N 0.89 0.37 -0.27 4.80 4.20 -1.26 -2.27 115.11 121.57 1k9t h GLN 255 Ca 0.18 -0.21 -0.11 0.00 0.06 0.00 0.00 58.65 58.56 1k9t h GLN 255 Cb 0.46 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1k9t h GLN 255 CO 0.02 0.78 -0.31 -0.07 -0.67 0.00 0.00 178.83 178.58 1k9t h LEU 256 N 0.29 0.56 -0.58 1.46 3.38 -0.67 0.20 115.31 119.96 1k9t h LEU 256 Ca 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1k9t h LEU 256 Cb 0.98 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1k9t h LEU 256 CO 0.08 0.84 0.30 0.24 0.09 0.00 0.00 178.44 179.99 1k9t h MET 257 N 0.47 0.83 -0.05 1.13 2.86 -1.06 -0.44 114.93 118.68 1k9t h MET 257 Ca 0.06 -0.11 -0.11 0.00 -2.06 0.00 0.00 59.70 57.48 1k9t h MET 257 Cb 0.77 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 1k9t h MET 257 CO 0.06 0.66 -0.48 0.00 1.06 0.00 0.00 176.91 178.22 1k9t h ALA 258 N 1.13 1.12 -0.54 6.32 0.00 -0.80 -2.30 119.26 124.18 1k9t h ALA 258 Ca 0.20 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 1k9t h ALA 258 Cb 0.09 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1k9t h ALA 258 CO -0.03 0.62 -0.04 1.25 0.00 0.00 0.00 179.25 181.05 1k9t h LEU 259 N 0.10 0.94 -1.24 0.00 5.85 -0.21 -0.95 115.31 119.80 1k9t h LEU 259 Ca 0.00 -0.27 -0.08 0.00 0.84 0.00 0.00 57.88 58.38 1k9t h LEU 259 Cb 0.88 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 1k9t h LEU 259 CO 0.07 1.02 -0.31 0.11 -0.34 0.00 0.00 178.44 178.98 1k9t h LYS 260 N 0.87 0.11 -0.14 1.25 1.79 -0.83 0.25 116.57 119.87 1k9t h LYS 260 Ca 0.15 -0.04 -0.10 0.00 -2.18 0.00 0.00 60.65 58.49 1k9t h LYS 260 Cb 0.56 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.19 1k9t h LYS 260 CO 0.03 0.42 -0.35 1.96 -1.08 0.00 0.00 179.45 180.43 1k9t h GLN 261 N 0.10 0.28 0.06 3.15 1.08 -0.96 -2.68 115.11 116.14 1k9t h GLN 261 Ca 0.01 -0.12 -0.24 0.00 -1.45 0.00 0.00 58.65 56.86 1k9t h GLN 261 Cb 0.61 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.02 1k9t h GLN 261 CO 0.04 0.60 -1.10 0.00 -0.95 0.00 0.00 178.83 177.43 1k9t h ALA 262 N 1.40 0.25 -2.57 3.87 0.00 -0.84 -3.41 119.26 117.96 1k9t h ALA 262 Ca 0.03 -0.88 -0.60 0.00 0.00 0.00 0.00 54.91 53.46 1k9t h ALA 262 Cb 0.73 -0.07 -0.40 0.00 0.00 0.00 0.00 17.79 18.05 1k9t h ALA 262 CO 0.06 1.09 -0.81 0.72 0.00 0.00 0.00 179.25 180.30 1k9t n HIS 263 N -3.47 1.00 0.32 0.00 8.25 0.79 -4.98 115.22 117.14 1k9t n HIS 263 Ca -0.04 -3.76 0.20 0.00 -0.26 0.00 0.00 57.72 53.86 1k9t n HIS 263 Cb 0.96 -0.18 1.10 0.00 1.12 0.00 0.00 29.99 32.99 1k9t n HIS 263 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1k9t h PRO 264 N 5.26 0.00 -0.01 -0.41 0.11 -1.71 -0.63 132.00 134.60 1k9t h PRO 264 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1k9t h PRO 264 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1k9t h PRO 264 CO 0.54 0.00 -0.66 -0.25 -0.21 0.00 0.00 178.00 177.43 1k9t n ASP 265 N -3.33 1.58 -4.74 -2.05 8.00 -1.26 -4.90 116.55 109.84 1k9t n ASP 265 Ca -0.03 -1.28 -0.41 0.00 0.71 0.00 0.00 54.79 53.78 1k9t n ASP 265 Cb 0.09 0.65 -0.02 0.00 -0.02 0.00 0.00 41.12 41.81 1k9t n ASP 265 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1k9t s LEU 266 N -2.68 4.39 -0.25 0.64 2.96 -0.24 -4.98 118.68 118.51 1k9t s LEU 266 Ca 0.15 2.63 -0.19 0.00 -0.22 0.00 0.00 54.13 56.49 1k9t s LEU 266 Cb 0.17 -3.62 -0.02 0.00 0.50 0.00 0.00 46.19 43.22 1k9t s LEU 266 CO 0.68 -0.68 0.59 -0.54 -1.32 0.00 0.00 176.35 175.08 1k9t s LYS 267 N -0.32 4.10 -0.31 1.98 -0.14 -0.42 -4.99 119.74 119.64 1k9t s LYS 267 Ca 0.59 0.47 -0.07 0.00 -1.36 0.00 0.00 55.97 55.60 1k9t s LYS 267 Cb -0.41 -3.64 0.01 0.00 -1.68 0.00 0.00 37.83 32.11 1k9t s LYS 267 CO 0.42 -0.37 0.10 0.42 -0.76 0.00 0.00 175.35 175.17 1k9t s ILE 268 N 2.37 4.05 -0.08 2.17 1.01 -1.26 -0.69 121.20 128.77 1k9t s ILE 268 Ca 0.24 -0.76 0.02 0.00 0.00 0.00 0.00 60.65 60.15 1k9t s ILE 268 Cb -0.16 -3.14 -0.02 0.00 0.01 0.00 0.00 42.46 39.15 1k9t s ILE 268 CO 0.09 0.00 -0.14 -0.76 0.00 0.00 0.00 174.94 174.13 1k9t s LEU 269 N 1.50 2.75 0.07 2.97 1.43 0.14 -0.54 118.68 127.00 1k9t s LEU 269 Ca 0.02 -0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 1k9t s LEU 269 Cb -0.18 -1.58 -0.05 0.00 0.03 0.00 0.00 46.19 44.41 1k9t s LEU 269 CO 0.03 0.29 1.08 -2.16 0.23 0.00 0.00 176.35 175.82 1k9t s PRO 270 N -0.38 4.54 -0.17 1.29 0.04 -1.26 -0.62 135.00 138.42 1k9t s PRO 270 Ca 0.04 1.60 -0.05 0.00 0.04 0.00 0.00 61.00 62.63 1k9t s PRO 270 Cb -0.12 -3.38 -0.03 0.00 0.04 0.00 0.00 34.50 31.01 1k9t s PRO 270 CO 0.02 -0.07 0.01 -1.54 0.04 0.00 0.00 177.00 175.46 1k9t s SER 271 N 0.71 5.12 -0.24 6.66 1.04 0.12 -1.12 113.70 125.99 1k9t s SER 271 Ca 0.53 -0.06 -0.08 0.00 0.48 0.00 0.00 55.95 56.82 1k9t s SER 271 Cb -0.26 -1.86 -0.04 0.00 0.10 0.00 0.00 66.02 63.96 1k9t s SER 271 CO 0.30 0.15 0.10 -0.63 0.98 0.00 0.00 173.24 174.15 1k9t s ILE 272 N 0.47 4.75 0.00 -1.02 1.01 0.09 -0.91 121.20 125.59 1k9t s ILE 272 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.61 1k9t s ILE 272 Cb -0.14 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.12 1k9t s ILE 272 CO 0.02 0.35 0.00 0.61 0.00 0.00 0.00 174.94 175.91 1k9t n GLY 273 N 4.58 0.11 0.00 6.18 0.00 -1.21 -0.94 105.19 113.90 1k9t n GLY 273 Ca -0.16 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1k9t n GLY 273 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k9t n GLY 274 N 0.00 -0.08 0.28 -0.02 0.00 0.40 -4.01 105.19 101.76 1k9t n GLY 274 Ca 0.00 -1.94 0.03 0.00 0.00 0.00 0.00 46.02 44.12 1k9t n GLY 274 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1k9t h TRP 275 N 0.00 0.63 -0.02 1.61 2.91 -1.92 -3.04 115.95 116.13 1k9t h TRP 275 Ca 0.00 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.05 1k9t h TRP 275 Cb 0.00 -0.17 0.00 0.00 -0.51 0.00 0.00 29.16 28.48 1k9t h TRP 275 CO 0.00 0.18 -0.23 0.25 -1.03 0.00 0.00 178.44 177.62 1k9t n THR 276 N -4.89 0.00 -1.12 2.65 -2.24 -1.26 -4.17 114.28 103.24 1k9t n THR 276 Ca 0.13 -0.39 0.09 0.00 -2.27 0.00 0.00 64.05 61.61 1k9t n THR 276 Cb 0.34 1.27 0.17 0.00 -2.10 0.00 0.00 70.33 70.00 1k9t n THR 276 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1k9t n LEU 277 N 0.31 2.72 0.02 3.22 4.77 -1.17 -3.91 117.00 122.96 1k9t n LEU 277 Ca 0.08 -3.19 0.12 0.00 -0.03 0.00 0.00 56.01 52.99 1k9t n LEU 277 Cb 0.40 -0.47 0.13 0.00 -2.33 0.00 0.00 43.42 41.15 1k9t n LEU 277 CO 0.18 0.79 0.24 -1.20 -1.33 0.00 0.00 177.39 176.07 1k9t n SER 278 N -1.24 0.62 -0.33 -1.43 7.64 -1.16 -4.36 113.62 113.36 1k9t n SER 278 Ca 0.18 -0.19 0.08 0.00 1.01 0.00 0.00 58.87 59.96 1k9t n SER 278 Cb 0.70 0.46 0.25 0.00 -1.01 0.00 0.00 64.21 64.62 1k9t n SER 278 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1k9t h ASP 279 N 0.00 0.72 -0.16 6.43 3.32 -1.83 -2.33 116.42 122.57 1k9t h ASP 279 Ca 0.00 0.08 0.04 0.00 0.02 0.00 0.00 57.03 57.17 1k9t h ASP 279 Cb 0.64 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 1k9t h ASP 279 CO 0.00 0.32 0.11 -0.65 -1.72 0.00 0.00 179.24 177.31 1k9t h PRO 280 N 0.78 0.04 -0.35 3.56 0.11 -1.76 -1.90 132.00 132.48 1k9t h PRO 280 Ca 0.50 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.63 1k9t h PRO 280 Cb 0.65 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.74 1k9t h PRO 280 CO -0.33 0.03 0.23 0.74 -0.21 0.00 0.00 178.00 178.46 1k9t h PHE 281 N 0.04 0.38 0.00 0.65 0.04 -1.74 -1.51 116.94 114.80 1k9t h PHE 281 Ca 0.07 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.85 1k9t h PHE 281 Cb 0.24 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.27 1k9t h PHE 281 CO -0.00 0.23 0.00 1.19 -0.60 0.00 0.00 178.31 179.13 1k9t n PHE 282 N -4.49 0.09 0.95 -0.55 3.72 -0.71 -1.41 117.46 115.06 1k9t n PHE 282 Ca 0.03 0.04 0.11 0.00 -0.05 0.00 0.00 57.45 57.58 1k9t n PHE 282 Cb 0.12 -0.57 0.03 0.00 -0.94 0.00 0.00 39.48 38.12 1k9t n PHE 282 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1k9t n PHE 283 N -1.59 0.00 1.71 1.38 3.01 -0.57 -4.59 117.46 116.80 1k9t n PHE 283 Ca 0.01 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.49 1k9t n PHE 283 Cb 0.08 0.00 0.08 0.00 -0.01 0.00 0.00 39.48 39.63 1k9t n PHE 283 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 1k9t n MET 284 N 0.38 0.85 0.27 -1.08 2.81 -0.50 -2.20 117.12 117.65 1k9t n MET 284 Ca 0.10 0.00 0.16 0.00 -1.81 0.00 0.00 57.70 56.15 1k9t n MET 284 Cb 0.48 -1.05 0.62 0.00 -0.71 0.00 0.00 33.22 32.56 1k9t n MET 284 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1k9t h GLY 285 N 5.04 0.00 -7.01 3.03 0.00 -1.81 -3.39 103.07 98.93 1k9t h GLY 285 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 1k9t h GLY 285 CO 0.00 0.00 0.83 -0.35 0.00 0.00 0.00 176.54 177.02 1k9t s ASP 286 N -5.81 6.41 0.60 0.19 2.15 -0.93 -4.91 116.67 114.37 1k9t s ASP 286 Ca 0.01 -0.05 0.31 0.00 0.43 0.00 0.00 52.55 53.25 1k9t s ASP 286 Cb 0.09 -2.51 1.84 0.00 -0.30 0.00 0.00 42.92 42.04 1k9t s ASP 286 CO 0.57 -1.39 2.24 0.50 -0.17 0.00 0.00 175.17 176.91 1k9t h LYS 287 N 9.46 0.00 -0.49 4.34 3.64 -1.90 -0.61 116.57 131.01 1k9t h LYS 287 Ca -0.25 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.14 1k9t h LYS 287 Cb 1.06 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.85 1k9t h LYS 287 CO 1.15 0.00 0.31 0.28 -2.27 0.00 0.00 179.45 178.92 1k9t h VAL 288 N 0.00 1.08 -0.26 2.00 2.07 -1.92 0.45 116.25 119.67 1k9t h VAL 288 Ca 0.01 -0.21 -0.16 0.00 0.82 0.00 0.00 66.70 67.17 1k9t h VAL 288 Cb 0.09 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1k9t h VAL 288 CO -0.00 0.11 -0.45 0.11 0.02 0.00 0.00 177.57 177.36 1k9t h LYS 289 N 0.62 0.76 -0.51 1.57 1.57 -1.49 -2.65 116.57 116.43 1k9t h LYS 289 Ca 0.19 -0.47 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1k9t h LYS 289 Cb -0.01 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 1k9t h LYS 289 CO -0.07 1.10 0.34 -0.09 -0.57 0.00 0.00 179.45 180.15 1k9t h ARG 290 N 0.50 0.68 -0.55 3.15 2.43 -1.07 -0.79 114.38 118.74 1k9t h ARG 290 Ca 0.02 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 1k9t h ARG 290 Cb 1.05 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.42 1k9t h ARG 290 CO 0.10 0.45 0.14 -0.44 -1.51 0.00 0.00 179.97 178.71 1k9t h ASP 291 N 0.70 0.78 -0.64 -3.80 3.32 -0.93 -0.04 116.42 115.81 1k9t h ASP 291 Ca 0.19 -0.14 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 1k9t h ASP 291 Cb -0.08 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.25 1k9t h ASP 291 CO -0.04 0.76 0.15 -0.09 -1.72 0.00 0.00 179.24 178.30 1k9t h ARG 292 N 0.81 1.02 0.21 3.56 2.43 -1.09 -0.79 114.38 120.52 1k9t h ARG 292 Ca 0.18 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1k9t h ARG 292 Cb 0.29 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1k9t h ARG 292 CO -0.00 0.92 -0.10 0.35 -1.51 0.00 0.00 179.97 179.63 1k9t h PHE 293 N 0.94 -0.26 -0.64 2.20 3.57 -0.55 -0.94 116.94 121.26 1k9t h PHE 293 Ca 0.20 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.74 1k9t h PHE 293 Cb 0.36 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.14 1k9t h PHE 293 CO 0.03 -0.04 0.37 0.28 -2.23 0.00 0.00 178.31 176.72 1k9t h VAL 294 N -0.44 1.00 -0.65 1.41 2.07 -0.90 -0.75 116.25 117.99 1k9t h VAL 294 Ca -0.03 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1k9t h VAL 294 Cb 0.33 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 1k9t h VAL 294 CO 0.05 0.13 0.37 1.23 0.02 0.00 0.00 177.57 179.36 1k9t h GLY 295 N 0.69 0.96 2.00 2.17 0.00 -1.03 -1.75 103.07 106.11 1k9t h GLY 295 Ca 0.28 -0.41 -0.06 0.00 0.00 0.00 0.00 47.33 47.14 1k9t h GLY 295 CO -0.16 0.40 -0.27 1.48 0.00 0.00 0.00 176.54 177.99 1k9t h SER 296 N 0.90 0.00 -0.17 0.19 4.64 0.19 -1.33 113.55 117.97 1k9t h SER 296 Ca 0.23 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.34 1k9t h SER 296 Cb 0.01 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1k9t h SER 296 CO -0.04 0.27 -0.72 0.58 -0.87 0.00 0.00 176.83 176.04 1k9t h VAL 297 N 0.00 1.28 -0.18 0.95 2.07 -0.58 0.08 116.25 119.88 1k9t h VAL 297 Ca -0.00 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.60 1k9t h VAL 297 Cb 0.76 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 1k9t h VAL 297 CO 0.03 0.61 0.12 0.50 0.02 0.00 0.00 177.57 178.86 1k9t h LYS 298 N 0.52 0.24 -0.96 1.57 3.64 -1.07 -0.49 116.57 120.02 1k9t h LYS 298 Ca -0.04 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1k9t h LYS 298 Cb 1.35 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 33.07 1k9t h LYS 298 CO 0.15 0.16 0.61 1.49 -2.27 0.00 0.00 179.45 179.59 1k9t h GLU 299 N 0.25 1.28 -0.79 1.90 4.81 -1.11 -0.77 114.58 120.14 1k9t h GLU 299 Ca 0.07 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1k9t h GLU 299 Cb -0.02 -0.28 -0.04 0.00 0.63 0.00 0.00 28.75 29.04 1k9t h GLU 299 CO -0.01 0.86 0.44 0.35 -0.73 0.00 0.00 179.01 179.92 1k9t h PHE 300 N 1.31 1.08 -0.02 0.92 3.57 -0.38 -0.28 116.94 123.13 1k9t h PHE 300 Ca 0.35 -0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.69 1k9t h PHE 300 Cb -0.11 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.27 1k9t h PHE 300 CO 0.00 0.75 -0.60 -0.07 -2.23 0.00 0.00 178.31 176.16 1k9t h LEU 301 N 1.09 0.06 -0.95 0.59 3.38 -0.62 0.03 115.31 118.90 1k9t h LEU 301 Ca 0.28 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 58.11 1k9t h LEU 301 Cb 0.02 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1k9t h LEU 301 CO -0.05 0.65 -0.50 1.56 0.09 0.00 0.00 178.44 180.20 1k9t h GLN 302 N 0.04 0.00 0.12 1.13 4.20 -0.85 -3.28 115.11 116.48 1k9t h GLN 302 Ca -0.01 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.50 1k9t h GLN 302 Cb 1.08 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.88 1k9t h GLN 302 CO 0.08 0.50 -0.87 1.15 -0.67 0.00 0.00 178.83 179.02 1k9t h THR 303 N 0.00 1.46 -3.46 -0.54 2.02 -0.65 -3.40 112.91 108.34 1k9t h THR 303 Ca -0.00 -2.46 -0.69 0.00 0.77 0.00 0.00 66.41 64.03 1k9t h THR 303 Cb 0.93 3.04 -0.36 0.00 -1.74 0.00 0.00 68.15 70.01 1k9t h THR 303 CO 0.06 0.71 -0.33 0.26 0.37 0.00 0.00 175.52 176.59 1k9t s TRP 304 N -2.64 3.51 -0.52 3.16 0.52 -0.04 -4.73 118.94 118.20 1k9t s TRP 304 Ca -0.13 -2.86 0.24 0.00 0.02 0.00 0.00 56.10 53.36 1k9t s TRP 304 Cb 0.02 -3.15 0.95 0.00 -1.15 0.00 0.00 33.47 30.14 1k9t s TRP 304 CO 0.85 -0.79 1.71 1.63 0.02 0.00 0.00 176.95 180.37 1k9t n LYS 305 N 3.08 0.20 0.15 4.98 5.02 -1.21 -2.49 118.16 127.89 1k9t n LYS 305 Ca 0.12 0.39 0.13 0.00 -2.02 0.00 0.00 58.31 56.93 1k9t n LYS 305 Cb 0.37 -1.85 0.49 0.00 -0.02 0.00 0.00 35.03 34.02 1k9t n LYS 305 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1k9t h PHE 306 N 0.00 0.00 -3.81 2.13 -0.00 -1.59 -3.44 116.94 110.23 1k9t h PHE 306 Ca 0.00 0.00 -0.48 0.00 -0.00 0.00 0.00 57.97 57.49 1k9t h PHE 306 Cb 0.40 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 36.33 1k9t h PHE 306 CO 0.00 0.00 0.30 -0.06 -0.00 0.00 0.00 178.31 178.55 1k9t s PHE 307 N -3.33 3.73 -0.23 6.09 0.08 -1.04 -4.62 117.98 118.67 1k9t s PHE 307 Ca 0.05 1.73 0.13 0.00 0.12 0.00 0.00 56.93 58.97 1k9t s PHE 307 Cb 0.10 -2.88 0.50 0.00 -0.57 0.00 0.00 43.02 40.17 1k9t s PHE 307 CO 0.47 0.27 1.43 -0.25 -0.10 0.00 0.00 175.22 177.04 1k9t n ASP 308 N 0.73 3.16 0.00 1.36 8.00 0.30 -4.98 116.55 125.12 1k9t n ASP 308 Ca 0.01 -3.36 0.00 0.00 0.71 0.00 0.00 54.79 52.15 1k9t n ASP 308 Cb 0.50 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 1k9t n ASP 308 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k9t n GLY 309 N -0.86 0.29 3.30 0.44 0.00 -1.26 -0.49 105.19 106.61 1k9t n GLY 309 Ca 0.26 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 1k9t n GLY 309 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k9t s VAL 310 N -3.96 0.00 -0.16 1.61 0.11 -0.06 -4.20 120.40 113.73 1k9t s VAL 310 Ca 0.00 -0.02 -0.04 0.00 -2.93 0.00 0.00 61.98 58.98 1k9t s VAL 310 Cb 0.00 -0.58 -0.03 0.00 -1.53 0.00 0.00 36.38 34.24 1k9t s VAL 310 CO 0.00 -0.01 -0.02 -0.62 -3.33 0.00 0.00 175.10 171.11 1k9t s ASP 311 N 0.12 4.89 -0.33 3.54 2.15 -0.28 -1.32 116.67 125.44 1k9t s ASP 311 Ca -0.01 -0.11 -0.10 0.00 0.43 0.00 0.00 52.55 52.76 1k9t s ASP 311 Cb -0.03 -1.80 0.00 0.00 -0.30 0.00 0.00 42.92 40.79 1k9t s ASP 311 CO 0.01 0.16 0.17 -0.63 -0.17 0.00 0.00 175.17 174.72 1k9t s ILE 312 N 0.40 4.66 -0.80 4.11 -1.09 0.29 -0.73 121.20 128.04 1k9t s ILE 312 Ca -0.03 -0.52 0.02 0.00 -2.23 0.00 0.00 60.65 57.89 1k9t s ILE 312 Cb -0.14 -3.44 0.25 0.00 -1.58 0.00 0.00 42.46 37.56 1k9t s ILE 312 CO 0.03 -0.02 0.92 -0.67 -1.23 0.00 0.00 174.94 173.97 1k9t n ASP 313 N 5.00 4.47 -4.56 3.58 2.03 -0.12 -1.76 116.55 125.20 1k9t n ASP 313 Ca -0.13 -3.37 -0.43 0.00 0.52 0.00 0.00 54.79 51.38 1k9t n ASP 313 Cb 0.48 -0.89 -0.05 0.00 -0.72 0.00 0.00 41.12 39.94 1k9t n ASP 313 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 1k9t s TRP 314 N -2.31 3.05 -0.50 -0.67 -0.11 -1.26 -0.45 118.94 116.69 1k9t s TRP 314 Ca 0.34 0.32 -0.03 0.00 1.22 0.00 0.00 56.10 57.95 1k9t s TRP 314 Cb 0.07 -3.53 0.13 0.00 -1.50 0.00 0.00 33.47 28.65 1k9t s TRP 314 CO -0.01 -0.87 0.30 -1.21 -4.62 0.00 0.00 176.95 170.55 1k9t s GLU 315 N 3.17 2.25 0.02 5.86 2.02 -1.26 -4.23 118.70 126.54 1k9t s GLU 315 Ca 0.30 -2.09 -0.15 0.00 0.02 0.00 0.00 54.97 53.05 1k9t s GLU 315 Cb -0.13 -3.67 0.02 0.00 0.10 0.00 0.00 34.13 30.46 1k9t s GLU 315 CO 0.20 -1.12 0.33 -0.06 0.02 0.00 0.00 175.26 174.63 1k9t s PHE 316 N 0.70 -0.17 -0.02 1.61 0.08 -1.26 -4.30 117.98 114.62 1k9t s PHE 316 Ca 0.11 0.13 -0.36 0.00 0.12 0.00 0.00 56.93 56.94 1k9t s PHE 316 Cb -0.22 0.12 -0.14 0.00 -0.57 0.00 0.00 43.02 42.21 1k9t s PHE 316 CO -0.04 -0.48 1.66 -2.30 -0.10 0.00 0.00 175.22 173.97 1k9t n PRO 317 N 0.80 1.76 0.00 0.24 -0.02 -1.26 -0.62 135.00 135.90 1k9t n PRO 317 Ca -0.20 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1k9t n PRO 317 Cb 0.58 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1k9t n PRO 317 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k9t n GLY 318 N 3.71 1.61 1.97 -1.23 0.00 -1.26 -4.94 105.19 105.06 1k9t n GLY 318 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1k9t n GLY 318 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k9t n GLY 319 N -1.68 -1.52 2.31 -0.02 0.00 0.21 -4.19 105.19 100.30 1k9t n GLY 319 Ca 0.00 -1.78 -0.12 0.00 0.00 0.00 0.00 46.02 44.12 1k9t n GLY 319 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k9t n LYS 320 N 0.00 -0.89 0.00 1.61 5.02 -1.26 -4.23 118.16 118.41 1k9t n LYS 320 Ca 0.00 0.80 0.00 0.00 -2.02 0.00 0.00 58.31 57.09 1k9t n LYS 320 Cb 0.00 -4.87 0.00 0.00 -0.02 0.00 0.00 35.03 30.14 1k9t n LYS 320 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k9t n GLY 321 N -1.31 1.76 0.23 0.72 0.00 -1.26 -4.85 105.19 100.48 1k9t n GLY 321 Ca -0.13 -1.80 -0.02 0.00 0.00 0.00 0.00 46.02 44.07 1k9t n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k9t h ALA 322 N -1.15 1.17 -2.57 4.61 0.00 -1.76 -3.41 119.26 116.14 1k9t h ALA 322 Ca 0.00 -0.33 -0.68 0.00 0.00 0.00 0.00 54.91 53.89 1k9t h ALA 322 Cb 0.00 -0.11 -0.19 0.00 0.00 0.00 0.00 17.79 17.49 1k9t h ALA 322 CO 0.00 0.53 -0.35 1.21 0.00 0.00 0.00 179.25 180.64 1k9t s ASN 323 N -6.83 6.14 0.00 0.00 3.84 -1.26 -4.96 114.94 111.87 1k9t s ASN 323 Ca -0.06 -0.51 0.14 0.00 0.21 0.00 0.00 52.86 52.64 1k9t s ASN 323 Cb 0.14 -2.18 0.70 0.00 -0.55 0.00 0.00 41.25 39.36 1k9t s ASN 323 CO 0.78 -0.38 1.37 -0.81 -2.79 0.00 0.00 177.10 175.27 1k9t n PRO 324 N 5.30 0.20 -0.04 0.43 -0.04 -1.26 -2.65 135.00 136.94 1k9t n PRO 324 Ca -0.10 0.15 0.09 0.00 -0.04 0.00 0.00 63.50 63.60 1k9t n PRO 324 Cb 0.49 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.54 1k9t n PRO 324 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1k9t n ASN 325 N -1.29 2.60 -4.58 3.54 3.02 -1.26 -4.95 115.26 112.34 1k9t n ASN 325 Ca 0.07 -1.77 -0.28 0.00 -0.03 0.00 0.00 54.58 52.57 1k9t n ASN 325 Cb 0.11 -0.05 -0.09 0.00 -0.61 0.00 0.00 39.78 39.14 1k9t n ASN 325 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1k9t s LEU 326 N -1.40 3.02 0.00 3.41 1.43 -1.08 -5.06 118.68 119.00 1k9t s LEU 326 Ca 0.23 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.82 1k9t s LEU 326 Cb 0.15 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.64 1k9t s LEU 326 CO 0.22 0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.54 1k9t n GLY 327 N 0.23 4.13 3.20 -3.19 0.00 -1.26 -4.31 105.19 103.99 1k9t n GLY 327 Ca -0.12 -1.02 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 1k9t n GLY 327 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1k9t s SER 328 N 0.00 -0.14 0.41 1.61 0.15 -1.26 -4.83 113.70 109.64 1k9t s SER 328 Ca 0.00 0.02 0.27 0.00 0.70 0.00 0.00 55.95 56.95 1k9t s SER 328 Cb 0.00 0.29 1.49 0.00 -1.71 0.00 0.00 66.02 66.09 1k9t s SER 328 CO 0.00 -0.42 1.84 -0.65 1.20 0.00 0.00 173.24 175.21 1k9t h PRO 329 N 4.01 0.00 -0.00 5.44 0.11 -2.01 -0.81 132.00 138.74 1k9t h PRO 329 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1k9t h PRO 329 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1k9t h PRO 329 CO 0.40 0.00 -0.13 0.94 -0.21 0.00 0.00 178.00 179.00 1k9t n GLN 330 N -2.46 0.25 -0.20 1.05 7.27 -1.26 -4.32 117.38 117.70 1k9t n GLN 330 Ca -0.02 -0.06 0.01 0.00 0.07 0.00 0.00 57.00 56.99 1k9t n GLN 330 Cb 0.05 -1.50 0.25 0.00 2.41 0.00 0.00 30.24 31.45 1k9t n GLN 330 CO 0.00 0.00 0.00 -0.44 0.07 0.00 0.00 177.06 176.69 1k9t h ASP 331 N 0.16 0.85 -0.70 1.69 3.32 -1.51 -2.63 116.42 117.60 1k9t h ASP 331 Ca 0.00 -0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.05 1k9t h ASP 331 Cb 0.43 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 1k9t h ASP 331 CO 0.00 0.62 0.44 1.23 -1.72 0.00 0.00 179.24 179.81 1k9t h GLY 332 N 1.00 1.01 0.94 2.75 0.00 -1.75 -1.10 103.07 105.92 1k9t h GLY 332 Ca 0.27 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 1k9t h GLY 332 CO -0.06 0.29 0.14 -2.09 0.00 0.00 0.00 176.54 174.83 1k9t h GLU 333 N 0.87 0.41 -0.86 4.80 4.81 -1.77 -1.67 114.58 121.17 1k9t h GLU 333 Ca 0.28 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.49 1k9t h GLU 333 Cb 0.00 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.26 1k9t h GLU 333 CO -0.10 0.38 0.57 1.15 -0.73 0.00 0.00 179.01 180.27 1k9t h THR 334 N 0.34 1.15 -0.37 0.32 2.02 -1.23 -0.83 112.91 114.30 1k9t h THR 334 Ca 0.10 -0.37 -0.09 0.00 0.77 0.00 0.00 66.41 66.82 1k9t h THR 334 Cb 0.10 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.48 1k9t h THR 334 CO -0.01 0.20 -0.11 0.22 0.37 0.00 0.00 175.52 176.18 1k9t h TYR 335 N 1.08 0.82 -0.45 3.16 5.03 -0.89 0.28 116.97 126.00 1k9t h TYR 335 Ca 0.34 -0.18 -0.13 0.00 2.58 0.00 0.00 58.73 61.34 1k9t h TYR 335 Cb 0.02 -0.20 -0.01 0.00 1.55 0.00 0.00 36.73 38.09 1k9t h TYR 335 CO -0.00 0.88 -0.22 0.28 -1.32 0.00 0.00 178.16 177.78 1k9t h VAL 336 N 0.52 1.27 -0.25 1.81 2.07 -0.92 -1.51 116.25 119.25 1k9t h VAL 336 Ca 0.09 -1.37 -0.02 0.00 0.82 0.00 0.00 66.70 66.22 1k9t h VAL 336 Cb 0.63 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1k9t h VAL 336 CO 0.04 0.47 0.08 -0.07 0.02 0.00 0.00 177.57 178.11 1k9t h LEU 337 N 0.79 0.35 -0.56 2.57 3.38 -1.05 -1.34 115.31 119.44 1k9t h LEU 337 Ca 0.10 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 57.94 1k9t h LEU 337 Cb 0.77 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.38 1k9t h LEU 337 CO 0.06 0.45 0.28 0.25 0.09 0.00 0.00 178.44 179.57 1k9t h LEU 338 N 0.24 0.38 -0.25 1.67 5.85 -0.71 -0.18 115.31 122.32 1k9t h LEU 338 Ca 0.08 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1k9t h LEU 338 Cb 0.22 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1k9t h LEU 338 CO -0.00 0.25 0.07 0.24 -0.34 0.00 0.00 178.44 178.66 1k9t h MET 339 N 0.52 0.39 -0.89 1.25 2.86 -1.13 0.84 114.93 118.77 1k9t h MET 339 Ca 0.26 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.80 1k9t h MET 339 Cb 0.19 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 1k9t h MET 339 CO -0.19 0.47 0.53 -0.22 1.06 0.00 0.00 176.91 178.56 1k9t h LYS 340 N 0.23 1.21 -0.10 1.72 3.64 -0.89 -0.06 116.57 122.32 1k9t h LYS 340 Ca 0.08 -0.11 -0.18 0.00 -1.27 0.00 0.00 60.65 59.17 1k9t h LYS 340 Cb 0.25 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1k9t h LYS 340 CO -0.00 0.85 -0.69 0.93 -2.27 0.00 0.00 179.45 178.27 1k9t h GLU 341 N 1.23 0.44 -0.19 1.90 5.08 -0.94 -0.76 114.58 121.33 1k9t h GLU 341 Ca 0.32 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1k9t h GLU 341 Cb -0.04 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1k9t h GLU 341 CO -0.06 0.96 0.10 -0.07 -1.00 0.00 0.00 179.01 178.95 1k9t h LEU 342 N 0.31 0.24 -0.71 1.33 3.38 -0.68 -1.33 115.31 117.85 1k9t h LEU 342 Ca -0.02 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 57.89 1k9t h LEU 342 Cb 1.25 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.89 1k9t h LEU 342 CO 0.12 0.27 0.43 -0.09 0.09 0.00 0.00 178.44 179.26 1k9t h ARG 343 N 0.20 0.80 -0.81 1.13 9.65 -0.83 0.94 114.38 125.46 1k9t h ARG 343 Ca 0.07 -0.05 -0.02 0.00 -1.10 0.00 0.00 59.98 58.88 1k9t h ARG 343 Cb 0.08 -0.18 -0.04 0.00 -1.39 0.00 0.00 29.97 28.45 1k9t h ARG 343 CO -0.01 0.53 0.43 0.00 2.80 0.00 0.00 179.97 183.72 1k9t h ALA 344 N 1.32 1.03 -0.56 2.80 0.00 -0.90 0.33 119.26 123.28 1k9t h ALA 344 Ca 0.29 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1k9t h ALA 344 Cb 0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1k9t h ALA 344 CO -0.13 0.56 -0.01 1.98 0.00 0.00 0.00 179.25 181.65 1k9t h MET 345 N 1.13 0.97 -0.12 0.00 1.85 -0.68 -2.12 114.93 115.95 1k9t h MET 345 Ca 0.28 -0.30 -0.17 0.00 -0.61 0.00 0.00 59.70 58.90 1k9t h MET 345 Cb 0.05 -0.09 -0.01 0.00 0.43 0.00 0.00 31.60 31.98 1k9t h MET 345 CO -0.04 0.96 -0.64 -0.07 -0.40 0.00 0.00 176.91 176.72 1k9t h LEU 346 N 0.89 0.52 -0.98 3.39 3.38 -0.29 -1.13 115.31 121.09 1k9t h LEU 346 Ca 0.16 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 1k9t h LEU 346 Cb 0.54 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1k9t h LEU 346 CO 0.03 1.02 0.11 0.44 0.09 0.00 0.00 178.44 180.13 1k9t h ASP 347 N 0.33 0.79 -0.27 -0.43 3.32 -0.21 0.30 116.42 120.25 1k9t h ASP 347 Ca -0.01 -0.15 -0.10 0.00 0.02 0.00 0.00 57.03 56.79 1k9t h ASP 347 Cb 1.19 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 1k9t h ASP 347 CO 0.11 0.79 -0.20 -0.61 -1.72 0.00 0.00 179.24 177.61 1k9t h GLN 348 N 0.81 0.62 -0.77 3.56 5.75 -1.12 -2.10 115.11 121.85 1k9t h GLN 348 Ca 0.17 -0.30 -0.00 0.00 -0.15 0.00 0.00 58.65 58.37 1k9t h GLN 348 Cb 0.33 -0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.84 1k9t h GLN 348 CO 0.00 0.89 0.47 1.25 -2.65 0.00 0.00 178.83 178.79 1k9t h LEU 349 N 0.35 0.93 -0.38 -2.39 5.85 -0.88 -1.52 115.31 117.27 1k9t h LEU 349 Ca 0.05 -0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.76 1k9t h LEU 349 Cb 0.74 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.50 1k9t h LEU 349 CO 0.05 0.71 0.13 -1.28 -0.34 0.00 0.00 178.44 177.72 1k9t h SER 350 N 1.06 0.14 1.52 1.25 0.87 -0.24 -1.29 113.55 116.86 1k9t h SER 350 Ca 0.28 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.87 1k9t h SER 350 Cb -0.05 0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 1k9t h SER 350 CO -0.05 0.12 -0.07 -0.37 -0.53 0.00 0.00 176.83 175.93 1k9t h VAL 351 N 0.29 0.13 -0.14 2.23 -1.51 -1.13 0.26 116.25 116.39 1k9t h VAL 351 Ca 0.18 -0.96 -0.16 0.00 -1.23 0.00 0.00 66.70 64.52 1k9t h VAL 351 Cb 0.16 1.85 -0.01 0.00 -2.13 0.00 0.00 31.29 31.16 1k9t h VAL 351 CO -0.18 0.07 -0.60 -0.33 -1.23 0.00 0.00 177.57 175.29 1k9t h GLU 352 N 0.00 0.48 0.00 5.19 5.08 -0.79 -3.33 114.58 121.21 1k9t h GLU 352 Ca -0.00 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1k9t h GLU 352 Cb 0.85 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1k9t h GLU 352 CO 0.01 0.94 -0.84 0.25 -1.00 0.00 0.00 179.01 178.37 1k9t n THR 353 N -3.92 0.00 -0.98 1.13 -2.24 -0.53 -4.97 114.28 102.77 1k9t n THR 353 Ca -0.03 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1k9t n THR 353 Cb 0.63 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 69.80 1k9t n THR 353 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k9t n GLY 354 N 1.40 0.89 3.94 3.38 0.00 0.91 -5.02 105.19 110.68 1k9t n GLY 354 Ca 0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 1k9t n GLY 354 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k9t s ARG 355 N -0.06 3.49 -0.20 1.61 0.52 -1.07 -5.01 118.95 118.23 1k9t s ARG 355 Ca 0.00 -0.42 -0.13 0.00 -0.52 0.00 0.00 55.73 54.66 1k9t s ARG 355 Cb 0.00 -2.77 -0.04 0.00 0.52 0.00 0.00 34.95 32.66 1k9t s ARG 355 CO 0.00 0.29 0.29 0.15 0.02 0.00 0.00 175.30 176.05 1k9t s LYS 356 N -3.90 4.18 -0.00 3.54 -0.14 -1.26 -4.44 119.74 117.73 1k9t s LYS 356 Ca 0.38 0.02 0.04 0.00 -1.36 0.00 0.00 55.97 55.06 1k9t s LYS 356 Cb -0.10 -3.49 -0.03 0.00 -1.68 0.00 0.00 37.83 32.53 1k9t s LYS 356 CO 0.32 0.11 -0.10 0.71 -0.76 0.00 0.00 175.35 175.62 1k9t s TYR 357 N 0.88 2.79 0.07 3.18 2.02 -1.26 -4.89 117.35 120.14 1k9t s TYR 357 Ca 0.15 -0.10 0.06 0.00 -0.37 0.00 0.00 57.07 56.80 1k9t s TYR 357 Cb -0.14 -1.59 -0.04 0.00 -0.40 0.00 0.00 41.96 39.80 1k9t s TYR 357 CO 0.05 0.31 -0.07 -1.21 -1.57 0.00 0.00 175.55 173.06 1k9t s GLU 358 N -1.27 2.32 -0.20 -0.62 2.02 0.35 -4.95 118.70 116.35 1k9t s GLU 358 Ca 0.15 -0.91 0.01 0.00 0.02 0.00 0.00 54.97 54.25 1k9t s GLU 358 Cb -0.11 -2.40 0.04 0.00 0.10 0.00 0.00 34.13 31.76 1k9t s GLU 358 CO 0.05 0.54 -0.14 -1.17 0.02 0.00 0.00 175.26 174.56 1k9t s LEU 359 N -2.01 2.39 0.36 1.80 2.96 -1.26 -0.88 118.68 122.03 1k9t s LEU 359 Ca 0.21 -0.86 0.04 0.00 -0.22 0.00 0.00 54.13 53.30 1k9t s LEU 359 Cb -0.11 -1.37 -0.06 0.00 0.50 0.00 0.00 46.19 45.15 1k9t s LEU 359 CO 0.13 -0.09 0.06 0.42 -1.32 0.00 0.00 176.35 175.55 1k9t s THR 360 N 1.31 1.17 -0.18 3.68 -4.23 -0.44 -0.23 115.64 116.73 1k9t s THR 360 Ca 0.00 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.35 1k9t s THR 360 Cb -0.15 -2.70 0.05 0.00 1.34 0.00 0.00 72.50 71.03 1k9t s THR 360 CO -0.10 0.00 0.47 -0.55 -0.54 0.00 0.00 174.62 173.91 1k9t s SER 361 N -3.55 -0.51 -0.21 3.99 0.15 -1.09 -0.54 113.70 111.94 1k9t s SER 361 Ca 0.32 0.96 -0.15 0.00 0.70 0.00 0.00 55.95 57.79 1k9t s SER 361 Cb 0.07 0.96 -0.04 0.00 -1.71 0.00 0.00 66.02 65.31 1k9t s SER 361 CO 0.15 -0.17 0.34 0.00 1.20 0.00 0.00 173.24 174.76 1k9t s ALA 362 N 0.36 3.57 0.21 5.45 0.00 -0.72 -0.00 121.76 130.63 1k9t s ALA 362 Ca -0.01 -0.61 0.07 0.00 0.00 0.00 0.00 51.96 51.41 1k9t s ALA 362 Cb -0.04 -2.55 -0.05 0.00 0.00 0.00 0.00 23.12 20.48 1k9t s ALA 362 CO -0.01 -0.26 -0.11 0.96 0.00 0.00 0.00 175.76 176.34 1k9t s ILE 363 N 1.22 1.59 0.52 0.00 -4.36 -0.29 -4.19 121.20 115.70 1k9t s ILE 363 Ca 0.16 -2.16 -0.22 0.00 -0.26 0.00 0.00 60.65 58.17 1k9t s ILE 363 Cb -0.14 -2.11 -0.06 0.00 1.25 0.00 0.00 42.46 41.41 1k9t s ILE 363 CO 0.07 -0.55 1.25 -0.55 0.24 0.00 0.00 174.94 175.40 1k9t s SER 364 N -3.32 5.61 0.00 4.36 0.15 -1.26 -1.22 113.70 118.03 1k9t s SER 364 Ca 0.23 2.50 0.23 0.00 0.70 0.00 0.00 55.95 59.61 1k9t s SER 364 Cb 0.01 -2.61 0.41 0.00 -1.71 0.00 0.00 66.02 62.11 1k9t s SER 364 CO 0.07 -1.31 1.38 0.00 1.20 0.00 0.00 173.24 174.57 1k9t n ALA 365 N -0.93 2.41 -2.42 5.45 0.00 -1.26 -4.62 120.51 119.14 1k9t n ALA 365 Ca 0.10 -0.99 -0.40 0.00 0.00 0.00 0.00 53.44 52.15 1k9t n ALA 365 Cb 0.47 -0.84 -0.05 0.00 0.00 0.00 0.00 19.45 19.03 1k9t n ALA 365 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1k9t s GLY 366 N -1.46 2.77 0.58 0.00 0.00 -1.26 -3.89 107.32 104.05 1k9t s GLY 366 Ca 0.37 0.26 0.31 0.00 0.00 0.00 0.00 44.72 45.67 1k9t s GLY 366 CO 0.31 1.08 2.20 1.70 0.00 0.00 0.00 173.10 178.38 1k9t h LYS 367 N 5.72 0.00 -0.35 2.90 3.64 -1.89 -0.96 116.57 125.63 1k9t h LYS 367 Ca -0.44 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 58.84 1k9t h LYS 367 Cb 1.20 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1k9t h LYS 367 CO 0.71 0.04 -0.22 0.38 -2.27 0.00 0.00 179.45 178.10 1k9t h ASP 368 N 0.00 0.69 0.50 4.20 2.03 -1.99 -2.46 116.42 119.39 1k9t h ASP 368 Ca -0.00 -0.24 -0.30 0.00 -0.73 0.00 0.00 57.03 55.76 1k9t h ASP 368 Cb 0.14 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 38.45 1k9t h ASP 368 CO 0.01 0.90 -1.42 0.11 -1.03 0.00 0.00 179.24 177.81 1k9t h LYS 369 N 0.60 0.29 -0.69 4.15 1.57 -1.66 -3.34 116.57 117.49 1k9t h LYS 369 Ca 0.09 -0.49 0.03 0.00 -1.87 0.00 0.00 60.65 58.41 1k9t h LYS 369 Cb 0.70 0.18 -0.04 0.00 0.08 0.00 0.00 32.23 33.14 1k9t h LYS 369 CO 0.05 1.19 0.43 0.82 -0.57 0.00 0.00 179.45 181.37 1k9t h ILE 370 N 0.08 1.08 0.00 1.86 2.04 -1.21 -2.29 117.51 119.07 1k9t h ILE 370 Ca -0.20 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.37 1k9t h ILE 370 Cb 2.01 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 38.27 1k9t h ILE 370 CO 0.19 0.15 0.00 0.47 0.00 0.00 0.00 178.15 178.96 1k9t n ASP 371 N -4.68 0.00 -0.14 1.72 8.00 -0.93 -2.25 116.55 118.27 1k9t n ASP 371 Ca 0.08 0.45 0.13 0.00 0.71 0.00 0.00 54.79 56.15 1k9t n ASP 371 Cb 0.10 -0.45 0.35 0.00 -0.02 0.00 0.00 41.12 41.09 1k9t n ASP 371 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1k9t n LYS 372 N -1.45 0.50 -4.78 -1.24 5.02 -0.86 -4.86 118.16 110.47 1k9t n LYS 372 Ca 0.01 -0.28 -0.25 0.00 -2.02 0.00 0.00 58.31 55.76 1k9t n LYS 372 Cb 0.02 -1.49 -0.15 0.00 -0.02 0.00 0.00 35.03 33.39 1k9t n LYS 372 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1k9t s VAL 373 N -2.70 1.48 -1.24 -0.18 1.01 -0.95 -3.82 120.40 114.00 1k9t s VAL 373 Ca 0.19 -0.91 -0.13 0.00 0.00 0.00 0.00 61.98 61.13 1k9t s VAL 373 Cb 0.19 -1.25 0.16 0.00 0.00 0.00 0.00 36.38 35.47 1k9t s VAL 373 CO 0.59 0.33 1.56 0.00 0.00 0.00 0.00 175.10 177.58 1k9t n ALA 374 N 2.37 4.17 0.28 5.51 0.00 -1.26 -4.79 120.51 126.79 1k9t n ALA 374 Ca -0.16 -4.22 0.15 0.00 0.00 0.00 0.00 53.44 49.21 1k9t n ALA 374 Cb 0.54 -3.09 0.81 0.00 0.00 0.00 0.00 19.45 17.71 1k9t n ALA 374 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1k9t h TYR 375 N 6.87 0.00 0.00 0.00 0.05 -1.95 -1.24 116.97 120.70 1k9t h TYR 375 Ca 0.35 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.12 1k9t h TYR 375 Cb 0.82 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.56 1k9t h TYR 375 CO 1.16 0.08 -0.04 -2.95 -1.05 0.00 0.00 178.16 175.36 1k9t h ASN 376 N 0.00 0.00 0.02 3.88 -1.07 -1.86 0.12 115.58 116.66 1k9t h ASN 376 Ca -0.00 0.00 -0.32 0.00 0.07 0.00 0.00 56.30 56.04 1k9t h ASN 376 Cb 0.26 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.47 1k9t h ASN 376 CO 0.01 0.04 -1.79 0.52 0.07 0.00 0.00 177.43 176.28 1k9t n VAL 377 N -3.31 1.57 0.14 6.14 0.31 -0.56 -4.40 118.33 118.23 1k9t n VAL 377 Ca -0.02 -0.25 0.06 0.00 -0.01 0.00 0.00 64.34 64.12 1k9t n VAL 377 Cb 0.20 -1.91 0.53 0.00 -0.91 0.00 0.00 33.84 31.74 1k9t n VAL 377 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1k9t h ALA 378 N -0.51 1.84 -0.48 3.52 0.00 -1.11 -2.42 119.26 120.09 1k9t h ALA 378 Ca -0.47 -0.03 0.14 0.00 0.00 0.00 0.00 54.91 54.55 1k9t h ALA 378 Cb 1.54 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 1k9t h ALA 378 CO -0.22 0.14 0.38 -0.56 0.00 0.00 0.00 179.25 179.00 1k9t h GLN 379 N 0.24 0.00 0.00 0.00 3.07 -0.97 0.12 115.11 117.57 1k9t h GLN 379 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.80 1k9t h GLN 379 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.57 1k9t h GLN 379 CO -0.01 0.00 0.00 -0.91 0.09 0.00 0.00 178.83 178.00 1k9t h ASN 380 N 0.00 0.00 -0.01 0.06 2.35 -1.68 -1.65 115.58 114.65 1k9t h ASN 380 Ca 0.23 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 1k9t h ASN 380 Cb 0.99 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.36 1k9t h ASN 380 CO -0.00 0.00 -0.71 -1.20 -1.65 0.00 0.00 177.43 173.87 1k9t n SER 381 N -2.40 1.41 -4.50 5.81 7.64 0.41 -5.00 113.62 116.99 1k9t n SER 381 Ca 0.01 -1.20 -0.32 0.00 1.01 0.00 0.00 58.87 58.36 1k9t n SER 381 Cb 0.17 0.76 -0.12 0.00 -1.01 0.00 0.00 64.21 64.00 1k9t n SER 381 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1k9t s MET 382 N -2.63 2.32 0.04 1.43 -1.94 -0.62 -4.73 119.30 113.17 1k9t s MET 382 Ca 0.12 -0.83 -0.15 0.00 -1.71 0.00 0.00 55.69 53.12 1k9t s MET 382 Cb 0.16 -2.32 -0.34 0.00 2.01 0.00 0.00 34.83 34.34 1k9t s MET 382 CO 0.69 0.58 1.03 -0.44 -0.01 0.00 0.00 175.02 176.87 1k9t h ASP 383 N 4.78 0.83 -4.64 3.03 3.32 -0.89 -3.48 116.42 119.37 1k9t h ASP 383 Ca -0.47 -0.86 -0.11 0.00 0.02 0.00 0.00 57.03 55.61 1k9t h ASP 383 Cb 1.16 -0.27 -0.21 0.00 0.22 0.00 0.00 39.33 40.23 1k9t h ASP 383 CO 0.50 1.67 -0.19 -1.00 -1.72 0.00 0.00 179.24 178.50 1k9t s HIS 384 N -2.68 -0.34 -0.31 4.55 3.76 -1.22 -4.84 115.29 114.21 1k9t s HIS 384 Ca -0.09 0.67 -0.06 0.00 -0.15 0.00 0.00 55.06 55.44 1k9t s HIS 384 Cb 0.05 0.16 0.03 0.00 1.11 0.00 0.00 32.58 33.93 1k9t s HIS 384 CO 0.94 -0.37 0.07 0.42 -0.85 0.00 0.00 174.74 174.95 1k9t s ILE 385 N -0.82 3.67 -0.81 0.60 1.01 0.32 -2.68 121.20 122.49 1k9t s ILE 385 Ca -0.09 -1.01 -0.21 0.00 0.00 0.00 0.00 60.65 59.34 1k9t s ILE 385 Cb -0.04 -3.01 0.10 0.00 0.01 0.00 0.00 42.46 39.52 1k9t s ILE 385 CO 0.04 -0.06 1.08 -0.36 0.00 0.00 0.00 174.94 175.64 1k9t s PHE 386 N 1.41 2.86 -0.33 3.97 0.08 1.00 -0.63 117.98 126.35 1k9t s PHE 386 Ca -0.01 -0.95 -0.29 0.00 0.12 0.00 0.00 56.93 55.80 1k9t s PHE 386 Cb -0.19 -4.32 -0.01 0.00 -0.57 0.00 0.00 43.02 37.94 1k9t s PHE 386 CO 0.02 -1.60 1.50 -1.17 -0.10 0.00 0.00 175.22 173.86 1k9t s LEU 387 N 3.52 3.72 -1.15 -0.37 2.96 -0.18 -1.14 118.68 126.04 1k9t s LEU 387 Ca 0.29 1.19 -0.18 0.00 -0.22 0.00 0.00 54.13 55.21 1k9t s LEU 387 Cb -0.10 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.01 1k9t s LEU 387 CO -0.00 -1.35 2.05 0.23 -1.32 0.00 0.00 176.35 175.96 1k9t n MET 388 N 7.86 2.25 -1.54 1.98 2.81 -0.36 -2.18 117.12 127.95 1k9t n MET 388 Ca 0.18 -2.33 -0.40 0.00 -1.81 0.00 0.00 57.70 53.33 1k9t n MET 388 Cb 0.47 -3.18 -0.02 0.00 -0.71 0.00 0.00 33.22 29.78 1k9t n MET 388 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1k9t n SER 389 N 7.31 7.27 -3.73 7.83 3.41 -1.26 -4.01 113.62 130.43 1k9t n SER 389 Ca 0.50 -2.73 -0.09 0.00 -0.26 0.00 0.00 58.87 56.30 1k9t n SER 389 Cb 0.41 -1.56 -0.03 0.00 -0.26 0.00 0.00 64.21 62.77 1k9t n SER 389 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1k9t s TYR 390 N 2.00 0.16 -1.63 7.33 -0.85 -1.26 -4.61 117.35 118.49 1k9t s TYR 390 Ca 0.61 -0.60 -0.03 0.00 -0.52 0.00 0.00 57.07 56.53 1k9t s TYR 390 Cb 0.17 0.47 0.01 0.00 0.38 0.00 0.00 41.96 42.98 1k9t s TYR 390 CO -0.07 -1.19 0.32 0.00 -1.52 0.00 0.00 175.55 173.10 1k9t n ALA 391 N -0.45 -0.82 0.03 9.51 0.00 -0.79 -4.87 120.51 123.12 1k9t n ALA 391 Ca -0.03 0.22 -0.02 0.00 0.00 0.00 0.00 53.44 53.61 1k9t n ALA 391 Cb 0.60 -3.05 0.23 0.00 0.00 0.00 0.00 19.45 17.24 1k9t n ALA 391 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1k9t h PHE 392 N -0.73 0.48 -4.38 0.00 0.04 -1.42 -3.44 116.94 107.48 1k9t h PHE 392 Ca -0.50 -0.10 -0.17 0.00 2.80 0.00 0.00 57.97 60.00 1k9t h PHE 392 Cb 1.36 -0.12 -0.15 0.00 2.20 0.00 0.00 35.95 39.24 1k9t h PHE 392 CO 0.56 0.64 -0.64 0.71 -0.60 0.00 0.00 178.31 178.98 1k9t s TYR 393 N -4.52 0.79 -3.20 -0.55 1.51 -1.26 -4.97 117.35 105.15 1k9t s TYR 393 Ca -0.06 -1.19 0.00 0.00 -1.01 0.00 0.00 57.07 54.80 1k9t s TYR 393 Cb 0.14 -0.45 0.00 0.00 -0.11 0.00 0.00 41.96 41.54 1k9t s TYR 393 CO 0.78 -0.51 0.00 0.41 -1.11 0.00 0.00 175.55 175.12 1k9t n GLY 394 N -0.07 -1.80 0.00 0.71 0.00 -1.26 -4.62 105.19 98.15 1k9t n GLY 394 Ca -0.07 -1.14 0.03 0.00 0.00 0.00 0.00 46.02 44.84 1k9t n GLY 394 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k9t n ALA 395 N 0.00 1.37 0.35 4.61 0.00 -1.26 -1.49 120.51 124.09 1k9t n ALA 395 Ca 0.00 -0.03 0.14 0.00 0.00 0.00 0.00 53.44 53.56 1k9t n ALA 395 Cb 0.00 -1.10 0.58 0.00 0.00 0.00 0.00 19.45 18.93 1k9t n ALA 395 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1k9t h PHE 396 N 0.00 0.00 -3.20 0.00 -5.15 -1.94 -3.39 116.94 103.27 1k9t h PHE 396 Ca 0.00 0.00 -0.52 0.00 -0.20 0.00 0.00 57.97 57.25 1k9t h PHE 396 Cb 0.09 0.00 -0.40 0.00 0.22 0.00 0.00 35.95 35.86 1k9t h PHE 396 CO 0.00 0.00 -0.76 0.34 -2.00 0.00 0.00 178.31 175.89 1k9t s ASP 397 N -4.91 3.08 0.00 -0.68 -1.08 -0.56 -5.01 116.67 107.51 1k9t s ASP 397 Ca 0.03 -0.96 0.28 0.00 -0.52 0.00 0.00 52.55 51.37 1k9t s ASP 397 Cb 0.09 -0.59 1.01 0.00 -1.46 0.00 0.00 42.92 41.97 1k9t s ASP 397 CO 0.46 -0.34 1.74 0.18 0.52 0.00 0.00 175.17 177.74 1k9t n LEU 398 N 5.05 0.39 -0.10 -1.34 4.77 -1.26 -4.19 117.00 120.33 1k9t n LEU 398 Ca -0.08 0.11 -0.12 0.00 -0.03 0.00 0.00 56.01 55.90 1k9t n LEU 398 Cb 0.46 -0.28 -0.12 0.00 -2.33 0.00 0.00 43.42 41.16 1k9t n LEU 398 CO 0.12 0.08 -1.13 0.29 -1.33 0.00 0.00 177.39 175.42 1k9t n LYS 399 N -1.22 0.90 -3.59 3.23 4.01 -1.26 -0.57 118.16 119.66 1k9t n LYS 399 Ca 0.10 0.06 -0.40 0.00 -0.51 0.00 0.00 58.31 57.56 1k9t n LYS 399 Cb 0.31 -1.44 -0.07 0.00 -0.51 0.00 0.00 35.03 33.33 1k9t n LYS 399 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 1k9t s ASN 400 N -5.57 5.76 0.44 4.39 0.01 -1.26 -4.65 114.94 114.06 1k9t s ASN 400 Ca -0.18 -2.88 -0.14 0.00 -0.71 0.00 0.00 52.86 48.95 1k9t s ASN 400 Cb 0.06 -1.97 -0.07 0.00 0.41 0.00 0.00 41.25 39.68 1k9t s ASN 400 CO 0.60 -0.42 0.86 -0.76 -1.51 0.00 0.00 177.10 175.88 1k9t s LEU 401 N -0.10 3.78 -0.01 0.60 1.43 -1.26 -4.83 118.68 118.28 1k9t s LEU 401 Ca 0.18 1.35 -0.29 0.00 -1.03 0.00 0.00 54.13 54.33 1k9t s LEU 401 Cb -0.16 -4.24 0.11 0.00 0.03 0.00 0.00 46.19 41.93 1k9t s LEU 401 CO -0.06 -0.45 1.29 -0.83 0.23 0.00 0.00 176.35 176.53 1k9t s GLY 402 N -2.99 -0.29 0.12 -3.19 0.00 -1.26 -4.87 107.32 94.84 1k9t s GLY 402 Ca 0.55 0.42 -0.31 0.00 0.00 0.00 0.00 44.72 45.38 1k9t s GLY 402 CO 0.29 2.28 1.42 0.30 0.00 0.00 0.00 173.10 177.39 1k9t s HIS 403 N -2.25 3.19 -0.78 1.90 3.76 -1.26 -4.74 115.29 115.11 1k9t s HIS 403 Ca 0.20 0.89 0.27 0.00 -0.15 0.00 0.00 55.06 56.27 1k9t s HIS 403 Cb 0.03 -3.72 0.87 0.00 1.11 0.00 0.00 32.58 30.87 1k9t s HIS 403 CO -0.02 -2.55 1.78 0.00 -0.85 0.00 0.00 174.74 173.09 1k9t n GLN 404 N 4.05 0.21 -1.06 1.40 10.64 -1.26 -4.17 117.38 127.19 1k9t n GLN 404 Ca 0.12 0.16 -0.00 0.00 -1.83 0.00 0.00 57.00 55.45 1k9t n GLN 404 Cb 0.42 -1.74 -0.01 0.00 -0.86 0.00 0.00 30.24 28.05 1k9t n GLN 404 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 1k9t n THR 405 N -2.10 0.00 -1.58 -0.39 5.66 -1.26 -1.18 114.28 113.43 1k9t n THR 405 Ca 0.06 -0.42 -0.33 0.00 -3.05 0.00 0.00 64.05 60.31 1k9t n THR 405 Cb 0.41 0.65 0.07 0.00 -1.55 0.00 0.00 70.33 69.91 1k9t n THR 405 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1k9t s ALA 406 N 0.00 2.32 0.00 1.79 0.00 -1.26 -4.81 121.76 119.81 1k9t s ALA 406 Ca 0.14 0.59 -0.21 0.00 0.00 0.00 0.00 51.96 52.49 1k9t s ALA 406 Cb 0.16 -3.35 -0.21 0.00 0.00 0.00 0.00 23.12 19.72 1k9t s ALA 406 CO -0.07 -1.53 1.14 1.25 0.00 0.00 0.00 175.76 176.55 1k9t h LEU 407 N -0.25 0.46 -9.62 0.00 5.85 -1.43 -0.79 115.31 109.53 1k9t h LEU 407 Ca -0.46 -0.71 -0.59 0.00 0.84 0.00 0.00 57.88 56.96 1k9t h LEU 407 Cb 1.26 -0.14 -0.13 0.00 0.37 0.00 0.00 40.66 42.02 1k9t h LEU 407 CO 0.52 1.10 -0.54 0.20 -0.34 0.00 0.00 178.44 179.38 1k9t s ASN 408 N -6.56 3.27 0.58 1.25 0.01 -0.33 -1.49 114.94 111.68 1k9t s ASN 408 Ca -0.14 -1.59 -0.16 0.00 -0.71 0.00 0.00 52.86 50.27 1k9t s ASN 408 Cb 0.03 0.32 -0.04 0.00 0.41 0.00 0.00 41.25 41.98 1k9t s ASN 408 CO 0.80 -0.80 1.05 0.00 -1.51 0.00 0.00 177.10 176.63 1k9t s ALA 409 N -3.06 2.79 0.56 0.60 0.00 -1.26 -4.47 121.76 116.91 1k9t s ALA 409 Ca 0.21 0.34 -0.12 0.00 0.00 0.00 0.00 51.96 52.39 1k9t s ALA 409 Cb 0.04 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.90 1k9t s ALA 409 CO 0.11 -0.73 0.97 -1.25 0.00 0.00 0.00 175.76 174.87 1k9t s PRO 410 N -4.12 3.72 0.50 0.00 0.04 -1.26 -3.55 135.00 130.34 1k9t s PRO 410 Ca 0.63 0.75 0.16 0.00 0.04 0.00 0.00 61.00 62.57 1k9t s PRO 410 Cb -0.15 -2.15 1.20 0.00 0.04 0.00 0.00 34.50 33.44 1k9t s PRO 410 CO 0.37 -0.40 2.10 0.00 0.04 0.00 0.00 177.00 179.11 1k9t h ALA 411 N 0.26 1.86 0.00 8.56 0.00 -1.96 -1.99 119.26 125.98 1k9t h ALA 411 Ca -0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1k9t h ALA 411 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1k9t h ALA 411 CO 0.62 0.09 0.00 -2.67 0.00 0.00 0.00 179.25 177.28 1k9t n TRP 412 N -4.41 0.14 -2.89 0.00 2.14 -1.26 -4.33 117.44 106.82 1k9t n TRP 412 Ca -0.03 0.04 -0.11 0.00 2.07 0.00 0.00 57.50 59.47 1k9t n TRP 412 Cb 0.15 -0.57 0.00 0.00 -0.81 0.00 0.00 31.31 30.08 1k9t n TRP 412 CO 0.00 0.00 0.00 1.17 2.07 0.00 0.00 177.69 180.93 1k9t n LYS 413 N -1.61 0.63 0.00 -2.67 4.81 -0.76 -4.99 118.16 113.56 1k9t n LYS 413 Ca 0.06 -2.21 0.06 0.00 -0.87 0.00 0.00 58.31 55.35 1k9t n LYS 413 Cb 0.32 -1.45 0.37 0.00 0.02 0.00 0.00 35.03 34.29 1k9t n LYS 413 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1k9t n PRO 414 N 2.15 0.38 0.00 1.64 -0.04 -1.14 -1.26 135.00 136.73 1k9t n PRO 414 Ca 0.16 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.74 1k9t n PRO 414 Cb 0.58 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.59 1k9t n PRO 414 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1k9t n ASP 415 N -1.02 2.44 -4.70 3.54 5.68 -1.26 -4.93 116.55 116.29 1k9t n ASP 415 Ca 0.09 -1.72 -0.64 0.00 -0.50 0.00 0.00 54.79 52.02 1k9t n ASP 415 Cb 0.05 0.20 -0.09 0.00 -1.14 0.00 0.00 41.12 40.13 1k9t n ASP 415 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 1k9t n THR 416 N 0.70 0.08 -0.05 2.12 -1.04 -0.39 -4.86 114.28 110.83 1k9t n THR 416 Ca 0.11 -0.01 -0.14 0.00 -2.04 0.00 0.00 64.05 61.96 1k9t n THR 416 Cb 0.50 -0.63 -0.08 0.00 -1.82 0.00 0.00 70.33 68.30 1k9t n THR 416 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1k9t h ALA 417 N 5.29 0.20 -2.00 2.41 0.00 -1.94 -3.43 119.26 119.79 1k9t h ALA 417 Ca -0.46 -0.41 -0.70 0.00 0.00 0.00 0.00 54.91 53.34 1k9t h ALA 417 Cb 1.36 -0.03 -0.20 0.00 0.00 0.00 0.00 17.79 18.93 1k9t h ALA 417 CO 0.93 0.22 0.30 0.71 0.00 0.00 0.00 179.25 181.41 1k9t s TYR 418 N -3.94 3.09 0.15 0.00 2.02 -1.26 -4.82 117.35 112.59 1k9t s TYR 418 Ca -0.14 -1.14 0.01 0.00 -0.37 0.00 0.00 57.07 55.43 1k9t s TYR 418 Cb 0.05 -4.07 -0.04 0.00 -0.40 0.00 0.00 41.96 37.49 1k9t s TYR 418 CO 0.78 -1.33 0.01 0.95 -1.57 0.00 0.00 175.55 174.39 1k9t s THR 419 N 2.50 0.50 0.06 -0.71 -4.23 -1.26 -4.87 115.64 107.62 1k9t s THR 419 Ca 0.18 -1.95 -0.28 0.00 -1.18 0.00 0.00 61.69 58.46 1k9t s THR 419 Cb -0.18 -2.06 -0.17 0.00 1.34 0.00 0.00 72.50 71.43 1k9t s THR 419 CO 0.01 -0.51 1.57 0.74 -0.54 0.00 0.00 174.62 175.89 1k9t h THR 420 N 2.77 0.66 -0.98 3.99 2.02 -0.96 -2.73 112.91 117.68 1k9t h THR 420 Ca -0.36 -0.17 0.15 0.00 0.77 0.00 0.00 66.41 66.80 1k9t h THR 420 Cb 1.20 0.75 -0.09 0.00 -1.74 0.00 0.00 68.15 68.27 1k9t h THR 420 CO 0.62 0.03 0.59 0.58 0.37 0.00 0.00 175.52 177.72 1k9t h VAL 421 N -0.57 0.81 -0.33 3.16 2.07 -1.52 -0.79 116.25 119.08 1k9t h VAL 421 Ca -0.05 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 1k9t h VAL 421 Cb 0.42 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.06 1k9t h VAL 421 CO 0.08 0.16 -0.02 0.78 0.02 0.00 0.00 177.57 178.58 1k9t h ASN 422 N 0.85 0.49 -0.13 0.57 2.35 -1.78 0.20 115.58 118.12 1k9t h ASN 422 Ca 0.52 -0.10 -0.17 0.00 -0.55 0.00 0.00 56.30 56.01 1k9t h ASN 422 Cb 0.67 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 38.92 1k9t h ASN 422 CO -0.32 0.57 -0.59 1.23 -1.65 0.00 0.00 177.43 176.67 1k9t h GLY 423 N 0.84 0.70 0.97 2.83 0.00 -0.90 -0.61 103.07 106.90 1k9t h GLY 423 Ca 0.10 -0.97 -0.00 0.00 0.00 0.00 0.00 47.33 46.46 1k9t h GLY 423 CO 0.01 0.86 0.19 -2.08 0.00 0.00 0.00 176.54 175.53 1k9t h VAL 424 N 0.29 1.12 -0.52 4.60 2.07 -1.00 -2.40 116.25 120.41 1k9t h VAL 424 Ca -0.04 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1k9t h VAL 424 Cb 1.22 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 1k9t h VAL 424 CO 0.12 0.13 0.24 0.78 0.02 0.00 0.00 177.57 178.86 1k9t h ASN 425 N 0.43 0.66 -0.64 0.57 2.35 -0.52 0.16 115.58 118.58 1k9t h ASN 425 Ca 0.12 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 1k9t h ASN 425 Cb 0.03 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.20 1k9t h ASN 425 CO -0.02 0.57 0.34 0.00 -1.65 0.00 0.00 177.43 176.66 1k9t h ALA 426 N 1.53 0.82 -0.01 -0.83 0.00 -0.73 0.35 119.26 120.39 1k9t h ALA 426 Ca 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1k9t h ALA 426 Cb 0.09 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1k9t h ALA 426 CO -0.02 0.35 0.00 -0.07 0.00 0.00 0.00 179.25 179.52 1k9t h LEU 427 N 0.87 0.02 -1.28 0.00 3.38 -0.91 -2.63 115.31 114.77 1k9t h LEU 427 Ca 0.22 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 58.03 1k9t h LEU 427 Cb 0.07 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 1k9t h LEU 427 CO -0.03 0.22 0.51 -0.07 0.09 0.00 0.00 178.44 179.16 1k9t h LEU 428 N -0.18 0.79 -1.58 1.67 3.38 -0.82 -1.63 115.31 116.92 1k9t h LEU 428 Ca 0.00 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1k9t h LEU 428 Cb 0.21 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1k9t h LEU 428 CO -0.00 0.53 -0.19 0.00 0.09 0.00 0.00 178.44 178.87 1k9t h ALA 429 N 1.56 1.20 0.00 1.53 0.00 -0.64 -1.03 119.26 121.89 1k9t h ALA 429 Ca 0.32 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1k9t h ALA 429 Cb 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1k9t h ALA 429 CO -0.10 0.23 -0.25 1.96 0.00 0.00 0.00 179.25 181.09 1k9t h GLN 430 N 0.00 0.00 0.00 0.00 4.20 -0.96 -3.47 115.11 114.88 1k9t h GLN 430 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1k9t h GLN 430 Cb 0.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1k9t h GLN 430 CO 0.02 0.25 0.00 0.41 -0.67 0.00 0.00 178.83 178.84 1k9t n GLY 431 N 0.56 1.37 3.74 3.46 0.00 -0.39 -4.62 105.19 109.31 1k9t n GLY 431 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1k9t n GLY 431 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k9t s VAL 432 N -2.00 2.56 0.26 1.61 1.01 -0.89 -4.87 120.40 118.08 1k9t s VAL 432 Ca 0.00 0.45 -0.30 0.00 0.00 0.00 0.00 61.98 62.14 1k9t s VAL 432 Cb 0.00 -3.29 -0.09 0.00 0.00 0.00 0.00 36.38 33.00 1k9t s VAL 432 CO 0.00 0.06 1.26 -0.54 0.00 0.00 0.00 175.10 175.89 1k9t s LYS 433 N -0.07 4.43 0.30 2.72 1.02 -1.26 -4.45 119.74 122.43 1k9t s LYS 433 Ca 0.62 2.05 -0.01 0.00 0.02 0.00 0.00 55.97 58.65 1k9t s LYS 433 Cb -0.43 -3.16 0.48 0.00 -0.52 0.00 0.00 37.83 34.20 1k9t s LYS 433 CO 0.41 -0.13 1.93 -1.00 -0.92 0.00 0.00 175.35 175.64 1k9t h PRO 434 N 4.42 1.06 0.00 -1.68 0.13 -1.91 -2.27 132.00 131.76 1k9t h PRO 434 Ca -0.46 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1k9t h PRO 434 Cb 1.22 -0.24 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1k9t h PRO 434 CO 0.71 0.70 0.00 0.41 -0.23 0.00 0.00 178.00 179.59 1k9t n GLY 435 N -1.40 -0.88 0.14 1.56 0.00 -1.17 -1.69 105.19 101.75 1k9t n GLY 435 Ca 0.12 0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1k9t n GLY 435 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k9t h LYS 436 N 0.00 0.00 -5.56 1.61 1.79 -1.73 -3.29 116.57 109.40 1k9t h LYS 436 Ca 0.00 0.00 -0.61 0.00 -2.18 0.00 0.00 60.65 57.86 1k9t h LYS 436 Cb 0.11 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 30.65 1k9t h LYS 436 CO 0.00 0.00 0.18 0.42 -1.08 0.00 0.00 179.45 178.97 1k9t s ILE 437 N -3.25 4.98 -0.24 1.86 1.01 -0.68 -0.52 121.20 124.35 1k9t s ILE 437 Ca 0.05 1.17 -0.06 0.00 0.00 0.00 0.00 60.65 61.81 1k9t s ILE 437 Cb 0.09 -3.95 -0.01 0.00 0.01 0.00 0.00 42.46 38.59 1k9t s ILE 437 CO 0.71 0.03 0.02 -0.69 0.00 0.00 0.00 174.94 175.02 1k9t s VAL 438 N 2.43 3.83 0.19 2.92 1.01 0.20 -0.14 120.40 130.84 1k9t s VAL 438 Ca 0.27 -0.39 -0.30 0.00 0.00 0.00 0.00 61.98 61.56 1k9t s VAL 438 Cb -0.16 -2.80 -0.08 0.00 0.00 0.00 0.00 36.38 33.35 1k9t s VAL 438 CO 0.09 0.34 0.99 -0.69 0.00 0.00 0.00 175.10 175.83 1k9t s VAL 439 N 1.54 4.13 0.09 2.92 1.01 -0.52 -1.01 120.40 128.55 1k9t s VAL 439 Ca 0.06 1.94 -0.23 0.00 0.00 0.00 0.00 61.98 63.75 1k9t s VAL 439 Cb -0.15 -4.24 -0.07 0.00 0.00 0.00 0.00 36.38 31.92 1k9t s VAL 439 CO 0.00 0.38 0.69 -0.83 0.00 0.00 0.00 175.10 175.35 1k9t s GLY 440 N -0.56 2.78 0.05 4.51 0.00 -0.93 -0.98 107.32 112.20 1k9t s GLY 440 Ca 0.45 0.20 0.09 0.00 0.00 0.00 0.00 44.72 45.47 1k9t s GLY 440 CO 0.33 0.79 -0.26 -0.51 0.00 0.00 0.00 173.10 173.44 1k9t s THR 441 N -0.76 2.14 -0.21 0.90 -4.23 0.47 -4.50 115.64 109.45 1k9t s THR 441 Ca 0.34 -1.41 -0.10 0.00 -1.18 0.00 0.00 61.69 59.33 1k9t s THR 441 Cb -0.21 -1.83 -0.05 0.00 1.34 0.00 0.00 72.50 71.75 1k9t s THR 441 CO 0.22 0.35 0.14 0.00 -0.54 0.00 0.00 174.62 174.79 1k9t s ALA 442 N -0.82 3.66 -0.33 3.99 0.00 -1.26 -2.82 121.76 124.17 1k9t s ALA 442 Ca 0.12 -0.76 0.10 0.00 0.00 0.00 0.00 51.96 51.41 1k9t s ALA 442 Cb -0.10 -2.23 0.76 0.00 0.00 0.00 0.00 23.12 21.55 1k9t s ALA 442 CO 0.02 0.02 1.83 -1.33 0.00 0.00 0.00 175.76 176.31 1k9t n MET 443 N 3.81 3.74 -3.66 0.00 2.81 -0.26 -4.11 117.12 119.45 1k9t n MET 443 Ca -0.16 -3.10 -0.10 0.00 -1.81 0.00 0.00 57.70 52.53 1k9t n MET 443 Cb 0.52 -2.23 -0.05 0.00 -0.71 0.00 0.00 33.22 30.75 1k9t n MET 443 CO 0.00 0.00 0.00 1.52 1.51 0.00 0.00 175.97 179.00 1k9t s TYR 444 N -3.01 -0.17 0.28 2.03 1.13 -1.26 -1.55 117.35 114.80 1k9t s TYR 444 Ca 0.56 -0.16 0.09 0.00 -1.41 0.00 0.00 57.07 56.15 1k9t s TYR 444 Cb 0.45 0.23 -0.04 0.00 -1.10 0.00 0.00 41.96 41.49 1k9t s TYR 444 CO 0.14 -0.68 0.06 0.20 -2.51 0.00 0.00 175.55 172.75 1k9t s GLY 445 N -2.80 1.66 0.18 5.49 0.00 0.12 -4.54 107.32 107.44 1k9t s GLY 445 Ca 0.03 -1.64 0.09 0.00 0.00 0.00 0.00 44.72 43.20 1k9t s GLY 445 CO -0.12 -1.68 -0.09 0.50 0.00 0.00 0.00 173.10 171.71 1k9t s ARG 446 N -3.74 2.07 0.16 2.90 0.52 -0.14 -0.57 118.95 120.16 1k9t s ARG 446 Ca 0.33 -1.28 -0.24 0.00 -0.52 0.00 0.00 55.73 54.02 1k9t s ARG 446 Cb -0.06 -2.16 0.07 0.00 0.52 0.00 0.00 34.95 33.32 1k9t s ARG 446 CO 0.21 0.43 1.02 0.20 0.02 0.00 0.00 175.30 177.18 1k9t s GLY 447 N -2.87 -0.08 0.21 -3.53 0.00 -0.78 -0.70 107.32 99.58 1k9t s GLY 447 Ca 0.25 -0.06 0.04 0.00 0.00 0.00 0.00 44.72 44.95 1k9t s GLY 447 CO 0.15 1.09 -0.03 -0.98 0.00 0.00 0.00 173.10 173.34 1k9t s TRP 448 N -2.71 1.48 0.26 1.90 0.51 -0.42 -1.29 118.94 118.68 1k9t s TRP 448 Ca 0.17 -0.89 0.09 0.00 -2.12 0.00 0.00 56.10 53.35 1k9t s TRP 448 Cb -0.02 -0.84 -0.05 0.00 -0.81 0.00 0.00 33.47 31.75 1k9t s TRP 448 CO 0.03 -0.02 -0.13 -0.08 -0.51 0.00 0.00 176.95 176.25 1k9t s THR 449 N -3.40 1.95 -1.45 2.01 -1.32 -0.02 -0.99 115.64 112.41 1k9t s THR 449 Ca 0.26 -2.24 0.00 0.00 -1.21 0.00 0.00 61.69 58.50 1k9t s THR 449 Cb 0.05 -2.29 0.00 0.00 -1.51 0.00 0.00 72.50 68.75 1k9t s THR 449 CO 0.07 -0.42 0.00 0.61 -2.21 0.00 0.00 174.62 172.67 1k9t n GLY 450 N -0.54 1.09 3.73 6.08 0.00 -0.47 -1.91 105.19 113.17 1k9t n GLY 450 Ca -0.06 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 1k9t n GLY 450 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k9t s VAL 451 N -2.57 2.19 0.22 1.61 1.01 0.30 -3.94 120.40 119.22 1k9t s VAL 451 Ca 0.00 0.14 -0.17 0.00 0.00 0.00 0.00 61.98 61.96 1k9t s VAL 451 Cb 0.00 -3.09 0.02 0.00 0.00 0.00 0.00 36.38 33.31 1k9t s VAL 451 CO 0.00 0.02 0.54 0.54 0.00 0.00 0.00 175.10 176.19 1k9t s ASN 452 N 0.87 -0.21 -0.96 3.32 2.20 -0.27 -4.62 114.94 115.26 1k9t s ASN 452 Ca 0.69 -0.61 -0.04 0.00 -0.94 0.00 0.00 52.86 51.96 1k9t s ASN 452 Cb -0.47 0.60 0.00 0.00 -2.00 0.00 0.00 41.25 39.38 1k9t s ASN 452 CO 0.38 -1.11 0.54 0.61 -2.94 0.00 0.00 177.10 174.57 1k9t n GLY 453 N -0.37 -0.07 3.82 0.45 0.00 -1.26 -1.81 105.19 105.96 1k9t n GLY 453 Ca -0.07 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 1k9t n GLY 453 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1k9t s TYR 454 N -3.05 3.27 0.28 1.61 1.13 -1.26 -4.05 117.35 115.29 1k9t s TYR 454 Ca 0.27 0.09 0.07 0.00 -1.41 0.00 0.00 57.07 56.08 1k9t s TYR 454 Cb -0.12 -1.62 -0.03 0.00 -1.10 0.00 0.00 41.96 39.09 1k9t s TYR 454 CO 0.33 0.53 0.30 -0.65 -2.51 0.00 0.00 175.55 173.55 1k9t s GLN 455 N -2.66 3.01 -1.72 -3.49 1.11 -1.26 -4.72 119.66 109.94 1k9t s GLN 455 Ca 0.31 -1.05 -0.22 0.00 0.01 0.00 0.00 55.36 54.41 1k9t s GLN 455 Cb -0.12 -2.65 0.21 0.00 -1.01 0.00 0.00 33.01 29.45 1k9t s GLN 455 CO 0.24 0.27 0.56 0.09 0.01 0.00 0.00 175.29 176.46 1k9t n ASN 456 N -1.35 -1.86 -1.20 5.90 3.02 -1.26 -0.24 115.26 118.26 1k9t n ASN 456 Ca -0.05 -1.08 -0.16 0.00 -0.03 0.00 0.00 54.58 53.26 1k9t n ASN 456 Cb 0.58 -1.63 -0.07 0.00 -0.61 0.00 0.00 39.78 38.06 1k9t n ASN 456 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1k9t n ASN 457 N -2.39 -5.47 -4.23 6.41 3.02 -1.26 -4.96 115.26 106.38 1k9t n ASN 457 Ca 0.11 0.39 -0.42 0.00 -0.03 0.00 0.00 54.58 54.62 1k9t n ASN 457 Cb 0.46 -4.35 -0.07 0.00 -0.61 0.00 0.00 39.78 35.20 1k9t n ASN 457 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1k9t s ILE 458 N -2.39 4.49 0.52 2.41 -1.09 0.67 -4.94 121.20 120.87 1k9t s ILE 458 Ca 0.00 -1.81 0.27 0.00 -2.23 0.00 0.00 60.65 56.88 1k9t s ILE 458 Cb 0.00 -3.92 0.43 0.00 -1.58 0.00 0.00 42.46 37.39 1k9t s ILE 458 CO 0.00 -0.82 1.94 -0.65 -1.23 0.00 0.00 174.94 174.18 1k9t h PRO 459 N 8.45 0.04 0.00 2.79 0.11 -1.93 -1.48 132.00 139.98 1k9t h PRO 459 Ca -0.21 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1k9t h PRO 459 Cb 1.07 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1k9t h PRO 459 CO 0.89 0.02 0.00 1.19 -0.21 0.00 0.00 178.00 179.89 1k9t n PHE 460 N -4.34 0.00 0.88 0.65 3.72 -1.26 -1.79 117.46 115.33 1k9t n PHE 460 Ca 0.14 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.65 1k9t n PHE 460 Cb 0.77 -0.21 0.01 0.00 -0.94 0.00 0.00 39.48 39.11 1k9t n PHE 460 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1k9t n THR 461 N -1.21 0.03 -0.40 4.37 -2.24 -0.56 -4.39 114.28 109.89 1k9t n THR 461 Ca 0.04 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1k9t n THR 461 Cb 0.05 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 1k9t n THR 461 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k9t n GLY 462 N 1.47 0.72 3.10 3.38 0.00 -0.74 -4.65 105.19 108.47 1k9t n GLY 462 Ca 0.04 -1.66 -0.07 0.00 0.00 0.00 0.00 46.02 44.32 1k9t n GLY 462 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k9t s THR 463 N 0.74 0.27 0.39 2.61 -4.23 -0.75 -4.58 115.64 110.08 1k9t s THR 463 Ca 0.00 -1.83 0.08 0.00 -1.18 0.00 0.00 61.69 58.76 1k9t s THR 463 Cb 0.00 -1.55 -0.05 0.00 1.34 0.00 0.00 72.50 72.25 1k9t s THR 463 CO 0.00 -0.98 0.17 0.00 -0.54 0.00 0.00 174.62 173.28 1k9t s ALA 464 N -3.89 3.57 -0.61 3.99 0.00 0.27 -1.11 121.76 123.97 1k9t s ALA 464 Ca 0.08 -2.00 0.17 0.00 0.00 0.00 0.00 51.96 50.20 1k9t s ALA 464 Cb 0.08 -0.53 -0.20 0.00 0.00 0.00 0.00 23.12 22.46 1k9t s ALA 464 CO -0.09 -0.10 0.63 0.25 0.00 0.00 0.00 175.76 176.45 1k9t n THR 465 N -1.22 0.00 -2.08 0.00 -2.24 -0.80 -4.81 114.28 103.13 1k9t n THR 465 Ca -0.01 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1k9t n THR 465 Cb 0.63 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 1k9t n THR 465 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k9t n GLY 466 N 1.42 -1.40 3.85 3.38 0.00 -1.22 -5.00 105.19 106.21 1k9t n GLY 466 Ca 0.02 -0.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.73 1k9t n GLY 466 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1k9t s PRO 467 N -1.09 3.86 0.55 1.61 0.04 -1.26 -0.84 135.00 137.85 1k9t s PRO 467 Ca 0.00 0.90 -0.17 0.00 0.04 0.00 0.00 61.00 61.77 1k9t s PRO 467 Cb 0.00 -2.12 -0.06 0.00 0.04 0.00 0.00 34.50 32.36 1k9t s PRO 467 CO 0.00 -0.35 1.03 0.54 0.04 0.00 0.00 177.00 178.26 1k9t s VAL 468 N -2.77 4.00 -0.06 -0.36 0.11 -0.41 -3.82 120.40 117.10 1k9t s VAL 468 Ca 0.58 1.02 -0.30 0.00 -2.93 0.00 0.00 61.98 60.35 1k9t s VAL 468 Cb -0.10 -3.48 -0.05 0.00 -1.53 0.00 0.00 36.38 31.21 1k9t s VAL 468 CO 0.37 -0.49 1.63 -0.75 -3.33 0.00 0.00 175.10 172.53 1k9t s LYS 469 N -3.88 4.19 0.60 1.54 2.20 -1.26 -0.14 119.74 122.98 1k9t s LYS 469 Ca 0.63 2.16 0.01 0.00 -0.36 0.00 0.00 55.97 58.41 1k9t s LYS 469 Cb -0.14 -3.96 0.06 0.00 -1.51 0.00 0.00 37.83 32.28 1k9t s LYS 469 CO 0.31 -0.83 0.83 0.20 -0.36 0.00 0.00 175.35 175.51 1k9t s GLY 470 N 3.23 1.81 0.08 5.54 0.00 -1.24 -4.79 107.32 111.94 1k9t s GLY 470 Ca 0.72 -1.49 -0.15 0.00 0.00 0.00 0.00 44.72 43.80 1k9t s GLY 470 CO 0.29 -1.12 1.32 -0.84 0.00 0.00 0.00 173.10 172.74 1k9t h THR 471 N -0.08 1.32 0.00 0.90 2.02 -1.84 -3.41 112.91 111.82 1k9t h THR 471 Ca -0.40 -1.73 0.00 0.00 0.77 0.00 0.00 66.41 65.05 1k9t h THR 471 Cb 1.29 1.92 0.00 0.00 -1.74 0.00 0.00 68.15 69.62 1k9t h THR 471 CO 0.48 0.54 -0.84 0.79 0.37 0.00 0.00 175.52 176.86 1k9t n TRP 472 N -4.17 0.00 -3.80 3.16 7.02 -1.26 -5.06 117.44 113.33 1k9t n TRP 472 Ca -0.06 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.30 1k9t n TRP 472 Cb 0.59 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.40 1k9t n TRP 472 CO 0.00 0.00 0.00 -1.83 -2.02 0.00 0.00 177.69 173.84 1k9t s GLU 473 N -1.84 0.68 0.27 -0.99 -1.05 -1.26 -5.14 118.70 109.37 1k9t s GLU 473 Ca 0.00 -0.41 -0.30 0.00 -0.15 0.00 0.00 54.97 54.11 1k9t s GLU 473 Cb 0.00 0.29 -0.14 0.00 -0.44 0.00 0.00 34.13 33.84 1k9t s GLU 473 CO 0.00 -0.19 1.25 0.09 0.95 0.00 0.00 175.26 177.35 1k9t n ASN 474 N 1.00 2.21 0.00 0.83 5.03 -1.26 -2.72 115.26 120.35 1k9t n ASN 474 Ca -0.20 1.17 0.00 0.00 0.87 0.00 0.00 54.58 56.42 1k9t n ASN 474 Cb 0.57 -1.38 0.00 0.00 -1.02 0.00 0.00 39.78 37.95 1k9t n ASN 474 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1k9t n GLY 475 N 1.53 0.63 2.93 7.41 0.00 0.80 -4.84 105.19 113.65 1k9t n GLY 475 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 1k9t n GLY 475 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k9t s ILE 476 N -2.65 0.55 -0.05 -0.61 1.01 -1.10 -1.86 121.20 116.49 1k9t s ILE 476 Ca 0.00 -0.20 0.02 0.00 0.00 0.00 0.00 60.65 60.47 1k9t s ILE 476 Cb 0.00 -0.53 0.02 0.00 0.01 0.00 0.00 42.46 41.96 1k9t s ILE 476 CO 0.00 0.20 -0.08 -0.69 0.00 0.00 0.00 174.94 174.37 1k9t s VAL 477 N 0.48 0.82 0.48 2.92 1.01 0.27 -2.35 120.40 124.02 1k9t s VAL 477 Ca -0.06 -0.30 -0.24 0.00 0.00 0.00 0.00 61.98 61.37 1k9t s VAL 477 Cb -0.10 -0.78 -0.07 0.00 0.00 0.00 0.00 36.38 35.43 1k9t s VAL 477 CO 0.00 0.28 1.40 0.47 0.00 0.00 0.00 175.10 177.25 1k9t n ASP 478 N 3.84 3.07 -0.13 3.32 8.00 -1.26 0.13 116.55 133.51 1k9t n ASP 478 Ca -0.24 1.07 0.04 0.00 0.71 0.00 0.00 54.79 56.38 1k9t n ASP 478 Cb 0.52 -1.59 0.35 0.00 -0.02 0.00 0.00 41.12 40.38 1k9t n ASP 478 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1k9t h TYR 479 N 2.00 0.72 -0.68 1.24 3.20 -1.07 -0.86 116.97 121.52 1k9t h TYR 479 Ca -0.51 0.02 0.11 0.00 3.14 0.00 0.00 58.73 61.49 1k9t h TYR 479 Cb 1.28 -0.24 -0.08 0.00 1.54 0.00 0.00 36.73 39.23 1k9t h TYR 479 CO 0.48 0.42 0.27 -0.09 -1.64 0.00 0.00 178.16 177.60 1k9t h ARG 480 N 0.75 0.43 -0.06 1.82 2.43 -1.39 0.62 114.38 118.98 1k9t h ARG 480 Ca 0.25 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.25 1k9t h ARG 480 Cb 0.08 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1k9t h ARG 480 CO -0.07 0.28 -0.62 0.37 -1.51 0.00 0.00 179.97 178.42 1k9t h GLN 481 N 0.44 0.21 0.03 0.20 4.15 -1.49 -0.24 115.11 118.42 1k9t h GLN 481 Ca 0.35 -0.15 -0.00 0.00 0.77 0.00 0.00 58.65 59.62 1k9t h GLN 481 Cb 0.47 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.19 1k9t h GLN 481 CO -0.34 0.76 -0.02 0.82 -1.93 0.00 0.00 178.83 178.12 1k9t h ILE 482 N 0.15 1.05 -0.36 2.39 2.04 -0.11 0.98 117.51 123.66 1k9t h ILE 482 Ca -0.01 -0.27 -0.09 0.00 1.00 0.00 0.00 64.86 65.49 1k9t h ILE 482 Cb 1.13 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 1k9t h ILE 482 CO 0.09 0.07 -0.16 0.00 0.00 0.00 0.00 178.15 178.15 1k9t h ALA 483 N 0.80 1.04 0.01 1.87 0.00 -0.92 0.03 119.26 122.09 1k9t h ALA 483 Ca -0.00 -0.32 -0.21 0.00 0.00 0.00 0.00 54.91 54.37 1k9t h ALA 483 Cb 0.15 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1k9t h ALA 483 CO 0.01 0.58 -0.98 0.78 0.00 0.00 0.00 179.25 179.64 1k9t h GLY 484 N 0.98 0.04 0.00 0.00 0.00 -0.85 -3.41 103.07 99.84 1k9t h GLY 484 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1k9t h GLY 484 CO 0.04 0.09 -0.75 -1.06 0.00 0.00 0.00 176.54 174.86 1k9t n GLN 485 N -3.43 2.92 -0.84 4.80 6.02 0.32 -4.83 117.38 122.34 1k9t n GLN 485 Ca -0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 56.96 1k9t n GLN 485 Cb 0.91 -0.88 0.28 0.00 1.02 0.00 0.00 30.24 31.57 1k9t n GLN 485 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1k9t n PHE 486 N -1.60 1.85 -2.18 1.08 3.72 -0.01 -4.29 117.46 116.04 1k9t n PHE 486 Ca 0.00 -1.20 -0.20 0.00 -0.05 0.00 0.00 57.45 56.01 1k9t n PHE 486 Cb 0.35 -0.57 0.03 0.00 -0.94 0.00 0.00 39.48 38.35 1k9t n PHE 486 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1k9t n MET 487 N -0.42 3.27 -3.85 -1.08 2.81 -1.17 -4.83 117.12 111.84 1k9t n MET 487 Ca 0.35 -4.05 -0.08 0.00 -1.81 0.00 0.00 57.70 52.11 1k9t n MET 487 Cb 1.21 -2.15 -0.00 0.00 -0.71 0.00 0.00 33.22 31.56 1k9t n MET 487 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1k9t s SER 488 N -3.64 -0.10 1.02 7.83 1.04 -1.26 -5.06 113.70 113.54 1k9t s SER 488 Ca 0.47 -0.89 0.00 0.00 0.48 0.00 0.00 55.95 56.01 1k9t s SER 488 Cb 0.39 0.77 0.00 0.00 0.10 0.00 0.00 66.02 67.29 1k9t s SER 488 CO 0.02 -1.49 0.00 0.61 0.98 0.00 0.00 173.24 173.36 1k9t n GLY 489 N -0.49 2.40 0.07 7.32 0.00 -1.26 -2.64 105.19 110.58 1k9t n GLY 489 Ca -0.06 -0.45 0.12 0.00 0.00 0.00 0.00 46.02 45.63 1k9t n GLY 489 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1k9t n GLU 490 N 13.45 0.13 -1.90 1.61 2.13 -1.26 -4.85 120.64 129.95 1k9t n GLU 490 Ca 0.00 0.23 -0.42 0.00 0.66 0.00 0.00 57.16 57.63 1k9t n GLU 490 Cb 0.00 -1.69 -0.03 0.00 0.27 0.00 0.00 31.44 29.99 1k9t n GLU 490 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1k9t s TRP 491 N -3.12 2.42 0.32 4.31 0.52 -1.08 -4.66 118.94 117.66 1k9t s TRP 491 Ca 0.09 0.30 -0.20 0.00 0.02 0.00 0.00 56.10 56.30 1k9t s TRP 491 Cb 0.12 -3.99 -0.10 0.00 -1.15 0.00 0.00 33.47 28.36 1k9t s TRP 491 CO 0.46 -3.96 0.84 -0.65 0.02 0.00 0.00 176.95 173.65 1k9t s GLN 492 N 2.57 4.27 -0.10 4.98 -0.21 0.41 -4.63 119.66 126.94 1k9t s GLN 492 Ca 0.75 1.00 0.02 0.00 0.02 0.00 0.00 55.36 57.15 1k9t s GLN 492 Cb -0.41 -2.58 0.01 0.00 1.00 0.00 0.00 33.01 31.04 1k9t s GLN 492 CO 0.33 0.20 -0.17 -0.47 -2.12 0.00 0.00 175.29 173.06 1k9t s TYR 493 N -1.82 2.07 -0.01 0.91 6.14 -1.26 -1.75 117.35 121.62 1k9t s TYR 493 Ca 0.52 -0.94 0.01 0.00 0.64 0.00 0.00 57.07 57.31 1k9t s TYR 493 Cb -0.14 -1.46 0.00 0.00 0.42 0.00 0.00 41.96 40.78 1k9t s TYR 493 CO 0.19 -0.45 -0.05 0.99 0.64 0.00 0.00 175.55 176.87 1k9t s THR 494 N 0.82 0.39 -0.31 4.34 2.01 -0.59 -5.01 115.64 117.29 1k9t s THR 494 Ca -0.10 -0.18 -0.07 0.00 0.31 0.00 0.00 61.69 61.65 1k9t s THR 494 Cb -0.16 -0.35 0.02 0.00 0.01 0.00 0.00 72.50 72.02 1k9t s THR 494 CO 0.01 0.13 0.10 -0.47 -0.69 0.00 0.00 174.62 173.69 1k9t s TYR 495 N 0.07 3.18 -0.51 4.92 5.04 -1.26 -1.14 117.35 127.65 1k9t s TYR 495 Ca -0.00 -1.07 -0.26 0.00 -2.44 0.00 0.00 57.07 53.30 1k9t s TYR 495 Cb -0.04 -2.27 0.03 0.00 0.35 0.00 0.00 41.96 40.03 1k9t s TYR 495 CO -0.00 -0.61 1.03 0.34 -1.34 0.00 0.00 175.55 174.96 1k9t s ASP 496 N 1.48 6.48 0.28 4.32 -1.08 -0.01 -4.89 116.67 123.26 1k9t s ASP 496 Ca 0.02 0.09 0.25 0.00 -0.52 0.00 0.00 52.55 52.39 1k9t s ASP 496 Cb -0.18 -2.49 0.72 0.00 -1.46 0.00 0.00 42.92 39.51 1k9t s ASP 496 CO 0.03 -1.22 1.74 0.00 0.52 0.00 0.00 175.17 176.23 1k9t h ALA 497 N 9.26 1.00 0.05 3.66 0.00 -1.96 0.25 119.26 131.52 1k9t h ALA 497 Ca -0.24 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1k9t h ALA 497 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1k9t h ALA 497 CO 1.09 0.00 -0.03 1.15 0.00 0.00 0.00 179.25 181.47 1k9t h THR 498 N 0.00 1.04 -0.06 0.00 2.02 -1.90 -3.33 112.91 110.67 1k9t h THR 498 Ca 0.00 -1.57 -0.13 0.00 0.77 0.00 0.00 66.41 65.47 1k9t h THR 498 Cb 0.77 1.88 -0.01 0.00 -1.74 0.00 0.00 68.15 69.05 1k9t h THR 498 CO 0.00 0.32 -0.55 0.00 0.37 0.00 0.00 175.52 175.66 1k9t h ALA 499 N -0.32 0.95 -3.69 6.16 0.00 -1.61 -3.42 119.26 117.33 1k9t h ALA 499 Ca -0.01 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 1k9t h ALA 499 Cb 0.59 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.30 1k9t h ALA 499 CO 0.01 0.70 -0.07 0.39 0.00 0.00 0.00 179.25 180.27 1k9t n GLU 500 N -3.90 -0.46 -3.64 0.00 -0.58 0.81 -1.19 120.64 111.67 1k9t n GLU 500 Ca -0.02 0.63 -0.08 0.00 -0.42 0.00 0.00 57.16 57.27 1k9t n GLU 500 Cb 0.58 -2.75 -0.07 0.00 -0.57 0.00 0.00 31.44 28.63 1k9t n GLU 500 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1k9t s ALA 501 N -3.03 -1.92 0.31 0.62 0.00 -0.69 -3.91 121.76 113.14 1k9t s ALA 501 Ca 0.04 2.24 -0.05 0.00 0.00 0.00 0.00 51.96 54.19 1k9t s ALA 501 Cb -0.01 -1.41 -0.05 0.00 0.00 0.00 0.00 23.12 21.66 1k9t s ALA 501 CO 0.22 -0.35 0.58 -1.25 0.00 0.00 0.00 175.76 174.96 1k9t s PRO 502 N 1.13 3.62 -0.10 0.00 0.04 -1.26 -0.83 135.00 137.61 1k9t s PRO 502 Ca -0.06 0.02 -0.24 0.00 0.04 0.00 0.00 61.00 60.76 1k9t s PRO 502 Cb -0.05 -2.61 0.06 0.00 0.04 0.00 0.00 34.50 31.93 1k9t s PRO 502 CO -0.12 0.17 0.58 1.52 0.04 0.00 0.00 177.00 179.18 1k9t s TYR 503 N -2.16 -0.56 0.03 0.56 1.13 -0.29 -3.56 117.35 112.50 1k9t s TYR 503 Ca 0.44 1.10 0.08 0.00 -1.41 0.00 0.00 57.07 57.29 1k9t s TYR 503 Cb -0.11 0.28 -0.03 0.00 -1.10 0.00 0.00 41.96 41.01 1k9t s TYR 503 CO 0.31 -0.47 -0.23 0.14 -2.51 0.00 0.00 175.55 172.80 1k9t s VAL 504 N -0.73 2.40 -0.02 -3.49 -7.23 -0.75 -1.54 120.40 109.05 1k9t s VAL 504 Ca -0.08 -1.23 0.00 0.00 -1.81 0.00 0.00 61.98 58.87 1k9t s VAL 504 Cb -0.02 -1.95 0.02 0.00 0.56 0.00 0.00 36.38 34.99 1k9t s VAL 504 CO 0.06 0.41 0.01 0.12 -0.31 0.00 0.00 175.10 175.39 1k9t s PHE 505 N -0.80 0.12 -0.47 2.82 5.36 -0.72 -1.32 117.98 122.97 1k9t s PHE 505 Ca 0.12 0.06 -0.05 0.00 -0.96 0.00 0.00 56.93 56.10 1k9t s PHE 505 Cb -0.10 -0.25 0.12 0.00 -0.34 0.00 0.00 43.02 42.45 1k9t s PHE 505 CO 0.02 -0.08 0.30 0.21 -1.46 0.00 0.00 175.22 174.21 1k9t s LYS 506 N 0.84 2.28 0.42 10.12 2.20 0.78 -0.44 119.74 135.94 1k9t s LYS 506 Ca -0.07 -1.90 0.15 0.00 -0.36 0.00 0.00 55.97 53.79 1k9t s LYS 506 Cb -0.11 -3.75 1.03 0.00 -1.51 0.00 0.00 37.83 33.49 1k9t s LYS 506 CO -0.02 -1.14 1.94 -1.35 -0.36 0.00 0.00 175.35 174.42 1k9t h PRO 507 N 8.08 0.42 -0.29 4.03 0.11 -1.84 0.40 132.00 142.91 1k9t h PRO 507 Ca -0.14 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.84 1k9t h PRO 507 Cb 1.05 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 1k9t h PRO 507 CO 0.76 0.28 -0.26 0.66 -0.21 0.00 0.00 178.00 179.23 1k9t h SER 508 N 0.43 0.57 0.00 -2.05 4.64 -1.94 -3.13 113.55 112.08 1k9t h SER 508 Ca 0.34 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1k9t h SER 508 Cb 0.74 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1k9t h SER 508 CO -0.11 0.81 -1.38 0.35 -0.87 0.00 0.00 176.83 175.63 1k9t n THR 509 N -4.11 0.00 -1.82 2.95 -2.24 -1.08 -4.99 114.28 102.99 1k9t n THR 509 Ca -0.00 -0.29 -0.03 0.00 -2.27 0.00 0.00 64.05 61.46 1k9t n THR 509 Cb 0.42 0.40 -0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1k9t n THR 509 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k9t n GLY 510 N 1.58 0.34 3.70 3.38 0.00 0.14 -1.37 105.19 112.95 1k9t n GLY 510 Ca -0.01 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 1k9t n GLY 510 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1k9t s ASP 511 N -2.90 7.28 -0.08 1.61 1.01 -0.95 -0.54 116.67 122.11 1k9t s ASP 511 Ca 0.00 1.56 0.02 0.00 0.71 0.00 0.00 52.55 54.84 1k9t s ASP 511 Cb 0.00 -2.55 0.01 0.00 1.01 0.00 0.00 42.92 41.39 1k9t s ASP 511 CO 0.00 -0.35 -0.12 -0.22 0.21 0.00 0.00 175.17 174.68 1k9t s LEU 512 N 1.54 1.60 -0.07 1.23 2.96 -0.16 -0.15 118.68 125.63 1k9t s LEU 512 Ca 0.49 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 54.10 1k9t s LEU 512 Cb -0.19 -0.89 0.01 0.00 0.50 0.00 0.00 46.19 45.62 1k9t s LEU 512 CO 0.22 0.01 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.48 1k9t s ILE 513 N 0.87 1.36 -0.12 6.68 1.01 -0.44 -1.29 121.20 129.27 1k9t s ILE 513 Ca -0.10 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 59.94 1k9t s ILE 513 Cb -0.15 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.08 1k9t s ILE 513 CO 0.01 0.41 -0.14 0.28 0.00 0.00 0.00 174.94 175.50 1k9t s THR 514 N 0.58 2.99 0.27 2.92 -1.32 0.12 -1.81 115.64 119.39 1k9t s THR 514 Ca -0.16 -0.69 -0.09 0.00 -1.21 0.00 0.00 61.69 59.54 1k9t s THR 514 Cb -0.16 -2.24 0.04 0.00 -1.51 0.00 0.00 72.50 68.63 1k9t s THR 514 CO 0.05 0.53 0.52 2.22 -2.21 0.00 0.00 174.62 175.73 1k9t n PHE 515 N 3.39 -1.86 -3.95 9.09 -1.74 -1.23 -0.97 117.46 120.19 1k9t n PHE 515 Ca -0.18 -1.31 -0.31 0.00 -0.56 0.00 0.00 57.45 55.10 1k9t n PHE 515 Cb 0.53 0.61 -0.04 0.00 1.52 0.00 0.00 39.48 42.09 1k9t n PHE 515 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1k9t s ASP 516 N -2.42 6.18 0.40 5.98 1.01 -1.26 -4.03 116.67 122.53 1k9t s ASP 516 Ca 0.12 0.21 0.05 0.00 0.71 0.00 0.00 52.55 53.63 1k9t s ASP 516 Cb -0.03 -1.86 -0.02 0.00 1.01 0.00 0.00 42.92 42.02 1k9t s ASP 516 CO 0.09 0.16 0.18 1.51 0.21 0.00 0.00 175.17 177.33 1k9t s ASP 517 N -2.52 2.57 0.29 0.27 1.47 -1.26 -4.93 116.67 112.56 1k9t s ASP 517 Ca 0.34 -1.74 0.03 0.00 1.18 0.00 0.00 52.55 52.35 1k9t s ASP 517 Cb -0.13 0.59 0.63 0.00 -0.34 0.00 0.00 42.92 43.68 1k9t s ASP 517 CO 0.27 -1.01 1.80 0.00 0.68 0.00 0.00 175.17 176.90 1k9t h ALA 518 N 1.84 1.55 -0.51 2.11 0.00 -1.95 -1.60 119.26 120.70 1k9t h ALA 518 Ca -0.31 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 1k9t h ALA 518 Cb 1.26 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1k9t h ALA 518 CO 0.49 0.05 -0.17 -0.09 0.00 0.00 0.00 179.25 179.53 1k9t h ARG 519 N 0.83 1.01 -0.14 0.00 2.43 -1.96 -1.09 114.38 115.47 1k9t h ARG 519 Ca 0.53 -0.41 -0.14 0.00 -0.81 0.00 0.00 59.98 59.15 1k9t h ARG 519 Cb 0.70 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 1k9t h ARG 519 CO -0.33 1.09 -0.53 0.66 -1.51 0.00 0.00 179.97 179.35 1k9t h SER 520 N 0.88 0.43 -0.63 -3.80 4.64 -1.76 -1.02 113.55 112.28 1k9t h SER 520 Ca 0.12 -0.22 -0.08 0.00 -0.47 0.00 0.00 61.79 61.14 1k9t h SER 520 Cb 0.75 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.69 1k9t h SER 520 CO 0.06 0.88 0.11 0.58 -0.87 0.00 0.00 176.83 177.59 1k9t h VAL 521 N 0.31 1.26 -0.82 0.95 2.07 -1.27 -1.35 116.25 117.40 1k9t h VAL 521 Ca 0.01 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.48 1k9t h VAL 521 Cb 1.03 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 1k9t h VAL 521 CO 0.09 0.38 0.38 -0.61 0.02 0.00 0.00 177.57 177.83 1k9t h GLN 522 N 1.00 1.19 -0.86 1.57 4.15 -0.65 -0.79 115.11 120.72 1k9t h GLN 522 Ca 0.20 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.41 1k9t h GLN 522 Cb 0.43 -0.21 -0.04 0.00 0.21 0.00 0.00 27.48 27.87 1k9t h GLN 522 CO 0.01 0.93 0.44 0.00 -1.93 0.00 0.00 178.83 178.28 1k9t h ALA 523 N 1.20 1.16 -0.67 3.38 0.00 -0.84 -0.74 119.26 122.76 1k9t h ALA 523 Ca 0.28 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1k9t h ALA 523 Cb 0.14 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1k9t h ALA 523 CO -0.03 0.65 0.11 0.87 0.00 0.00 0.00 179.25 180.85 1k9t h LYS 524 N 1.21 1.11 -0.30 0.00 1.57 -0.69 -1.88 116.57 117.60 1k9t h LYS 524 Ca 0.30 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1k9t h LYS 524 Cb 0.07 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 1k9t h LYS 524 CO -0.04 1.02 0.12 0.78 -0.57 0.00 0.00 179.45 180.75 1k9t h GLY 525 N 1.04 0.49 1.23 3.86 0.00 -0.90 0.12 103.07 108.91 1k9t h GLY 525 Ca 0.20 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 1k9t h GLY 525 CO 0.01 0.26 0.25 1.70 0.00 0.00 0.00 176.54 178.76 1k9t h LYS 526 N 0.34 0.98 -0.48 4.80 3.64 -1.08 -1.17 116.57 123.61 1k9t h LYS 526 Ca 0.10 -0.17 -0.04 0.00 -1.27 0.00 0.00 60.65 59.27 1k9t h LYS 526 Cb 0.19 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1k9t h LYS 526 CO -0.01 0.81 0.14 -0.92 -2.27 0.00 0.00 179.45 177.21 1k9t h TYR 527 N 0.96 0.78 -0.26 1.91 3.20 -0.89 0.18 116.97 122.86 1k9t h TYR 527 Ca 0.22 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.02 1k9t h TYR 527 Cb 0.20 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 1k9t h TYR 527 CO 0.02 0.69 0.16 0.28 -1.64 0.00 0.00 178.16 177.67 1k9t h VAL 528 N 0.64 1.05 -0.47 1.81 2.07 -0.31 0.01 116.25 121.06 1k9t h VAL 528 Ca 0.15 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.51 1k9t h VAL 528 Cb 0.28 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1k9t h VAL 528 CO -0.00 0.06 0.11 -0.07 0.02 0.00 0.00 177.57 177.69 1k9t h LEU 529 N 0.34 0.71 -0.48 2.57 3.38 -0.91 0.10 115.31 121.02 1k9t h LEU 529 Ca 0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1k9t h LEU 529 Cb -0.03 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1k9t h LEU 529 CO -0.03 0.76 0.25 0.44 0.09 0.00 0.00 178.44 179.96 1k9t h ASP 530 N 0.63 0.61 -0.13 -0.43 3.32 -0.51 -2.89 116.42 117.03 1k9t h ASP 530 Ca 0.15 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1k9t h ASP 530 Cb 0.33 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1k9t h ASP 530 CO 0.00 0.54 0.00 0.29 -1.72 0.00 0.00 179.24 178.36 1k9t n LYS 531 N -4.65 1.66 -3.14 3.56 4.76 -0.02 -4.94 118.16 115.40 1k9t n LYS 531 Ca 0.02 -0.99 -0.20 0.00 -2.87 0.00 0.00 58.31 54.27 1k9t n LYS 531 Cb 0.09 -1.40 0.05 0.00 -1.84 0.00 0.00 35.03 31.93 1k9t n LYS 531 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1k9t n GLN 532 N 0.21 -5.33 -1.98 1.97 6.02 -0.25 -4.88 117.38 113.14 1k9t n GLN 532 Ca 0.16 0.74 -0.29 0.00 -0.01 0.00 0.00 57.00 57.61 1k9t n GLN 532 Cb 0.31 -5.36 0.17 0.00 1.02 0.00 0.00 30.24 26.39 1k9t n GLN 532 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1k9t s LEU 533 N -6.01 2.72 0.31 1.08 1.43 0.20 -3.06 118.68 115.35 1k9t s LEU 533 Ca 0.36 0.26 0.18 0.00 -1.03 0.00 0.00 54.13 53.91 1k9t s LEU 533 Cb -0.16 -2.36 0.14 0.00 0.03 0.00 0.00 46.19 43.83 1k9t s LEU 533 CO 0.45 -2.60 1.44 1.23 0.23 0.00 0.00 176.35 177.10 1k9t h GLY 534 N -1.51 0.00 0.00 -3.19 0.00 -0.54 -3.44 103.07 94.39 1k9t h GLY 534 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1k9t h GLY 534 CO 0.40 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.55 1k9t n GLY 535 N 1.19 0.31 3.21 4.60 0.00 -1.24 -0.91 105.19 112.36 1k9t n GLY 535 Ca 0.02 -1.55 -0.21 0.00 0.00 0.00 0.00 46.02 44.28 1k9t n GLY 535 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k9t s LEU 536 N 0.00 2.26 0.15 0.99 1.43 0.02 -1.43 118.68 122.10 1k9t s LEU 536 Ca 0.00 -0.61 0.00 0.00 -1.03 0.00 0.00 54.13 52.49 1k9t s LEU 536 Cb 0.00 -0.69 -0.04 0.00 0.03 0.00 0.00 46.19 45.49 1k9t s LEU 536 CO 0.00 0.00 0.03 0.72 0.23 0.00 0.00 176.35 177.34 1k9t s PHE 537 N -1.14 1.03 0.07 0.29 -0.71 -0.15 -0.77 117.98 116.60 1k9t s PHE 537 Ca 0.02 -1.14 0.00 0.00 -1.04 0.00 0.00 56.93 54.77 1k9t s PHE 537 Cb -0.10 -0.58 -0.04 0.00 -1.21 0.00 0.00 43.02 41.09 1k9t s PHE 537 CO 0.03 -0.38 -0.05 -1.54 -1.34 0.00 0.00 175.22 171.94 1k9t s SER 538 N -3.11 0.77 -0.10 1.98 1.04 0.22 -0.39 113.70 114.11 1k9t s SER 538 Ca 0.24 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.75 1k9t s SER 538 Cb 0.07 0.13 0.02 0.00 0.10 0.00 0.00 66.02 66.35 1k9t s SER 538 CO 0.03 -0.49 -0.08 0.86 0.98 0.00 0.00 173.24 174.54 1k9t s TRP 539 N -3.38 1.39 0.11 5.02 -0.11 -1.13 -1.98 118.94 118.86 1k9t s TRP 539 Ca 0.06 -0.63 0.08 0.00 1.22 0.00 0.00 56.10 56.83 1k9t s TRP 539 Cb 0.04 -1.14 -0.04 0.00 -1.50 0.00 0.00 33.47 30.84 1k9t s TRP 539 CO -0.06 -0.43 -0.20 -1.83 -4.62 0.00 0.00 176.95 169.81 1k9t s GLU 540 N 1.44 1.14 0.45 5.86 -1.05 -1.26 -1.11 118.70 124.16 1k9t s GLU 540 Ca -0.00 -1.20 0.11 0.00 -0.15 0.00 0.00 54.97 53.73 1k9t s GLU 540 Cb -0.13 -1.36 1.02 0.00 -0.44 0.00 0.00 34.13 33.21 1k9t s GLU 540 CO -0.05 0.31 2.06 0.97 0.95 0.00 0.00 175.26 179.50 1k9t h ILE 541 N 3.95 1.02 0.00 1.83 6.09 -1.46 -2.89 117.51 126.04 1k9t h ILE 541 Ca -0.45 -0.13 -0.02 0.00 -1.37 0.00 0.00 64.86 62.89 1k9t h ILE 541 Cb 1.18 0.62 -0.00 0.00 0.47 0.00 0.00 36.82 39.09 1k9t h ILE 541 CO 0.41 0.07 -0.08 -2.24 -3.07 0.00 0.00 178.15 173.24 1k9t h ASP 542 N 0.37 0.00 0.68 2.19 2.03 -1.97 -3.03 116.42 116.69 1k9t h ASP 542 Ca 0.15 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.45 1k9t h ASP 542 Cb 0.14 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.64 1k9t h ASP 542 CO -0.03 0.08 -0.30 0.00 -1.03 0.00 0.00 179.24 177.95 1k9t n ALA 543 N -2.20 3.07 -2.00 4.15 0.00 -1.09 -4.90 120.51 117.53 1k9t n ALA 543 Ca -0.01 -0.25 -0.32 0.00 0.00 0.00 0.00 53.44 52.86 1k9t n ALA 543 Cb 0.23 -1.26 -0.04 0.00 0.00 0.00 0.00 19.45 18.38 1k9t n ALA 543 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1k9t s ASP 544 N -2.98 6.65 0.00 0.00 2.15 -1.15 -1.15 116.67 120.19 1k9t s ASP 544 Ca 0.13 1.39 0.21 0.00 0.43 0.00 0.00 52.55 54.71 1k9t s ASP 544 Cb 0.18 -2.43 0.29 0.00 -0.30 0.00 0.00 42.92 40.66 1k9t s ASP 544 CO 0.63 -0.43 1.26 -0.46 -0.17 0.00 0.00 175.17 176.00 1k9t n ASN 545 N -1.17 3.05 0.00 -0.34 0.23 -1.26 -4.79 115.26 110.98 1k9t n ASN 545 Ca 0.05 -1.92 0.00 0.00 -0.53 0.00 0.00 54.58 52.18 1k9t n ASN 545 Cb 0.54 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 38.11 1k9t n ASN 545 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1k9t n GLY 546 N 1.26 0.72 0.29 4.83 0.00 -1.26 -0.24 105.19 110.80 1k9t n GLY 546 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.17 1k9t n GLY 546 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1k9t h ASP 547 N 1.69 0.72 -0.03 1.61 3.32 -1.93 0.30 116.42 122.11 1k9t h ASP 547 Ca 0.00 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1k9t h ASP 547 Cb 0.00 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.42 1k9t h ASP 547 CO 0.00 0.46 -0.04 0.40 -1.72 0.00 0.00 179.24 178.34 1k9t h ILE 548 N 0.85 1.41 -0.08 0.35 1.08 -1.93 -2.36 117.51 116.82 1k9t h ILE 548 Ca 0.34 -1.28 -0.09 0.00 -0.39 0.00 0.00 64.86 63.44 1k9t h ILE 548 Cb 0.17 2.21 -0.01 0.00 -3.07 0.00 0.00 36.82 36.12 1k9t h ILE 548 CO -0.17 0.34 -0.35 0.25 -0.69 0.00 0.00 178.15 177.53 1k9t h LEU 549 N -0.43 0.17 -0.23 1.44 5.85 -1.98 -0.21 115.31 119.93 1k9t h LEU 549 Ca 0.00 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1k9t h LEU 549 Cb 0.57 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 1k9t h LEU 549 CO 0.01 0.51 0.11 0.78 -0.34 0.00 0.00 178.44 179.51 1k9t h ASN 550 N 0.14 0.30 -0.29 1.25 2.35 -0.96 -1.65 115.58 116.72 1k9t h ASN 550 Ca 0.02 -0.12 -0.08 0.00 -0.55 0.00 0.00 56.30 55.57 1k9t h ASN 550 Cb 0.69 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.96 1k9t h ASN 550 CO 0.05 0.33 -0.10 -1.28 -1.65 0.00 0.00 177.43 174.78 1k9t h SER 551 N 0.24 0.69 -0.50 5.81 0.87 -0.96 -0.60 113.55 119.10 1k9t h SER 551 Ca 0.08 -0.19 0.05 0.00 -1.23 0.00 0.00 61.79 60.49 1k9t h SER 551 Cb 0.11 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 61.84 1k9t h SER 551 CO -0.01 0.82 0.24 0.24 -0.53 0.00 0.00 176.83 177.59 1k9t h MET 552 N 0.64 0.46 -0.10 2.24 2.86 -0.67 0.17 114.93 120.53 1k9t h MET 552 Ca 0.11 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 1k9t h MET 552 Cb 0.54 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.10 1k9t h MET 552 CO 0.03 0.31 -0.00 -0.91 1.06 0.00 0.00 176.91 177.40 1k9t h ASN 553 N 0.48 0.18 -0.46 1.22 4.21 -1.05 -2.97 115.58 117.19 1k9t h ASN 553 Ca 0.23 -0.32 -0.05 0.00 1.21 0.00 0.00 56.30 57.36 1k9t h ASN 553 Cb 0.15 -0.05 -0.02 0.00 -1.12 0.00 0.00 38.32 37.28 1k9t h ASN 553 CO -0.17 0.46 0.08 0.00 -1.29 0.00 0.00 177.43 176.51 1k9t h ALA 554 N 0.73 0.62 0.00 -0.83 0.00 -0.96 -2.11 119.26 116.70 1k9t h ALA 554 Ca 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1k9t h ALA 554 Cb 0.37 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1k9t h ALA 554 CO 0.01 0.34 -0.08 0.66 0.00 0.00 0.00 179.25 180.18 1k9t h SER 555 N 0.63 0.00 0.11 0.00 4.64 -1.01 -1.79 113.55 116.14 1k9t h SER 555 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1k9t h SER 555 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1k9t h SER 555 CO 0.01 0.08 -0.15 0.18 -0.87 0.00 0.00 176.83 176.07 1k9t n LEU 556 N -3.31 1.33 0.00 5.97 4.77 -1.12 -4.02 117.00 120.63 1k9t n LEU 556 Ca -0.01 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 1k9t n LEU 556 Cb 0.27 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1k9t n LEU 556 CO 0.28 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1k9t n GLY 557 N 1.28 0.88 3.73 -0.72 0.00 -0.67 -4.78 105.19 104.90 1k9t n GLY 557 Ca 0.15 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1k9t n GLY 557 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1k9t s ASN 558 N -2.07 7.03 0.08 1.61 0.01 -0.81 -4.58 114.94 116.21 1k9t s ASN 558 Ca 0.00 2.21 -0.30 0.00 -0.71 0.00 0.00 52.86 54.06 1k9t s ASN 558 Cb 0.00 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 39.01 1k9t s ASN 558 CO 0.00 -0.45 1.09 -0.44 -1.51 0.00 0.00 177.10 175.78 1k9t s SER 559 N 0.54 7.26 0.60 -1.22 0.01 -1.25 -4.60 113.70 115.04 1k9t s SER 559 Ca 0.56 1.91 -0.19 0.00 1.31 0.00 0.00 55.95 59.55 1k9t s SER 559 Cb -0.33 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.28 1k9t s SER 559 CO 0.34 -0.30 1.08 0.00 0.41 0.00 0.00 173.24 174.77 1k9t n ALA 560 N 3.37 0.52 0.00 1.44 0.00 -1.26 -0.29 120.51 124.29 1k9t n ALA 560 Ca 0.06 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1k9t n ALA 560 Cb 0.48 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1k9t n ALA 560 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91