#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ozk s ASN 28 N 0.00 2.15 -0.38 7.28 2.47 -1.26 -5.05 114.94 120.15 2ozk s ASN 28 Ca 0.00 -0.85 0.13 0.00 0.42 0.00 0.00 52.86 52.56 2ozk s ASN 28 Cb 0.00 -0.08 0.42 0.00 -1.45 0.00 0.00 41.25 40.13 2ozk s ASN 28 CO 0.00 -0.14 0.93 -0.46 -3.72 0.00 0.00 177.10 173.71 2ozk n ASN 29 N 0.38 2.17 -4.63 -4.21 0.23 -1.26 -5.10 115.26 102.83 2ozk n ASN 29 Ca -0.14 -3.05 -0.30 0.00 -0.53 0.00 0.00 54.58 50.56 2ozk n ASN 29 Cb 0.57 -0.54 -0.09 0.00 -2.08 0.00 0.00 39.78 37.65 2ozk n ASN 29 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ozk s ALA 30 N -3.07 3.13 -0.07 -2.53 0.00 -1.26 -1.31 121.76 116.64 2ozk s ALA 30 Ca 0.36 -1.17 0.04 0.00 0.00 0.00 0.00 51.96 51.19 2ozk s ALA 30 Cb 0.41 -1.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 2ozk s ALA 30 CO -0.04 0.67 -0.20 0.08 0.00 0.00 0.00 175.76 176.26 2ozk s VAL 31 N -1.25 2.47 0.20 0.00 1.01 0.92 -5.00 120.40 118.75 2ozk s VAL 31 Ca 0.23 -0.91 0.05 0.00 0.00 0.00 0.00 61.98 61.35 2ozk s VAL 31 Cb -0.11 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 2ozk s VAL 31 CO 0.16 0.57 -0.08 -0.31 0.00 0.00 0.00 175.10 175.43 2ozk s TYR 32 N -0.18 1.53 0.08 5.22 1.51 -1.26 -1.35 117.35 122.89 2ozk s TYR 32 Ca -0.02 -0.76 0.03 0.00 -1.01 0.00 0.00 57.07 55.32 2ozk s TYR 32 Cb -0.14 -0.80 -0.03 0.00 -0.11 0.00 0.00 41.96 40.88 2ozk s TYR 32 CO 0.03 0.13 -0.10 -0.08 -1.11 0.00 0.00 175.55 174.43 2ozk s THR 33 N -3.24 0.83 -0.26 -0.71 -1.32 -0.93 -4.86 115.64 105.14 2ozk s THR 33 Ca 0.23 -1.49 -0.09 0.00 -1.21 0.00 0.00 61.69 59.12 2ozk s THR 33 Cb 0.03 -1.17 -0.04 0.00 -1.51 0.00 0.00 72.50 69.81 2ozk s THR 33 CO 0.05 -0.51 0.14 -0.75 -2.21 0.00 0.00 174.62 171.34 2ozk s LYS 34 N -2.48 3.84 -0.38 7.08 2.20 -1.26 -1.91 119.74 126.84 2ozk s LYS 34 Ca 0.01 -0.38 0.04 0.00 -0.36 0.00 0.00 55.97 55.28 2ozk s LYS 34 Cb -0.05 -3.51 0.11 0.00 -1.51 0.00 0.00 37.83 32.87 2ozk s LYS 34 CO -0.00 -0.16 0.10 0.08 -0.36 0.00 0.00 175.35 175.00 2ozk s VAL 35 N 1.64 2.30 0.00 4.02 1.01 -0.68 -4.92 120.40 123.77 2ozk s VAL 35 Ca 0.07 -2.53 0.00 0.00 0.00 0.00 0.00 61.98 59.52 2ozk s VAL 35 Cb -0.15 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.55 2ozk s VAL 35 CO 0.08 -0.65 0.00 0.47 0.00 0.00 0.00 175.10 175.00 2ozk n ASP 36 N 4.02 -0.13 -1.78 3.32 9.92 -1.26 -3.60 116.55 127.05 2ozk n ASP 36 Ca 0.04 0.00 -0.09 0.00 -0.53 0.00 0.00 54.79 54.21 2ozk n ASP 36 Cb 0.40 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.86 2ozk n ASP 36 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ozk n GLY 37 N 0.00 3.21 2.85 0.44 0.00 -1.26 -4.82 105.19 105.60 2ozk n GLY 37 Ca 0.00 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.10 2ozk n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ozk s ILE 38 N -0.72 0.73 -0.42 -0.61 1.01 -1.24 -5.09 121.20 114.85 2ozk s ILE 38 Ca 0.24 -0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.50 2ozk s ILE 38 Cb 0.15 -0.81 0.01 0.00 0.01 0.00 0.00 42.46 41.83 2ozk s ILE 38 CO -0.02 0.32 1.37 -1.81 0.00 0.00 0.00 174.94 174.80 2ozk s ASP 39 N 1.80 6.38 -0.13 3.58 -0.00 -1.26 -1.68 116.67 125.36 2ozk s ASP 39 Ca 0.04 0.78 -0.05 0.00 -0.00 0.00 0.00 52.55 53.32 2ozk s ASP 39 Cb -0.12 -2.54 -0.04 0.00 -0.00 0.00 0.00 42.92 40.22 2ozk s ASP 39 CO -0.07 -1.41 0.07 0.68 -0.00 0.00 0.00 175.17 174.44 2ozk s VAL 40 N 5.30 4.85 -0.52 -1.27 -7.23 -0.80 -4.97 120.40 115.75 2ozk s VAL 40 Ca 0.59 -0.03 -0.28 0.00 -1.81 0.00 0.00 61.98 60.45 2ozk s VAL 40 Cb -0.13 -3.12 0.02 0.00 0.56 0.00 0.00 36.38 33.71 2ozk s VAL 40 CO 0.32 0.56 1.34 -0.70 -0.31 0.00 0.00 175.10 176.31 2ozk s GLU 41 N -0.45 3.45 0.33 4.82 2.12 -1.26 -2.20 118.70 125.51 2ozk s GLU 41 Ca 0.10 0.55 0.17 0.00 0.36 0.00 0.00 54.97 56.15 2ozk s GLU 41 Cb -0.12 -4.06 0.40 0.00 0.26 0.00 0.00 34.13 30.61 2ozk s GLU 41 CO 0.02 -1.74 1.60 -0.84 -0.54 0.00 0.00 175.26 173.75 2ozk h ILE 42 N 6.35 0.87 -1.65 -3.70 3.07 -1.55 -3.47 117.51 117.44 2ozk h ILE 42 Ca -0.26 -1.87 0.08 0.00 1.55 0.00 0.00 64.86 64.36 2ozk h ILE 42 Cb 1.09 2.17 -0.26 0.00 -0.27 0.00 0.00 36.82 39.55 2ozk h ILE 42 CO 1.15 0.43 0.33 0.12 -1.05 0.00 0.00 178.15 179.13 2ozk s PHE 43 N -3.29 -0.65 -0.07 0.16 5.36 -1.05 -5.03 117.98 113.41 2ozk s PHE 43 Ca 0.02 1.35 0.02 0.00 -0.96 0.00 0.00 56.93 57.35 2ozk s PHE 43 Cb 0.09 0.40 -0.03 0.00 -0.34 0.00 0.00 43.02 43.14 2ozk s PHE 43 CO 0.71 -0.32 -0.10 -2.00 -1.46 0.00 0.00 175.22 172.05 2ozk s GLU 44 N 1.11 2.78 -0.34 10.12 2.12 -1.26 -0.06 118.70 133.18 2ozk s GLU 44 Ca -0.06 -0.62 -0.21 0.00 0.36 0.00 0.00 54.97 54.43 2ozk s GLU 44 Cb -0.04 -2.53 0.00 0.00 0.26 0.00 0.00 34.13 31.82 2ozk s GLU 44 CO -0.13 0.57 0.69 1.21 -0.54 0.00 0.00 175.26 177.06 2ozk s ASN 45 N -0.57 6.51 -0.14 -1.70 3.04 -0.42 -4.90 114.94 116.75 2ozk s ASN 45 Ca 0.08 0.35 0.17 0.00 0.04 0.00 0.00 52.86 53.50 2ozk s ASN 45 Cb -0.12 -2.36 0.31 0.00 -1.54 0.00 0.00 41.25 37.55 2ozk s ASN 45 CO 0.02 -0.60 1.16 0.29 -3.04 0.00 0.00 177.10 174.93 2ozk n LYS 46 N 6.11 1.32 -3.64 0.43 5.02 -1.26 -4.92 118.16 121.22 2ozk n LYS 46 Ca 0.01 -2.70 -0.25 0.00 -2.02 0.00 0.00 58.31 53.35 2ozk n LYS 46 Cb 0.48 -1.51 0.02 0.00 -0.02 0.00 0.00 35.03 34.01 2ozk n LYS 46 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2ozk s THR 47 N -2.91 1.66 -0.18 -0.18 -4.23 -1.26 -4.90 115.64 103.65 2ozk s THR 47 Ca 0.33 -1.34 0.18 0.00 -1.18 0.00 0.00 61.69 59.67 2ozk s THR 47 Cb 0.29 -2.01 -0.02 0.00 1.34 0.00 0.00 72.50 72.11 2ozk s THR 47 CO 0.01 0.00 1.11 0.71 -0.54 0.00 0.00 174.62 175.91 2ozk h THR 48 N 0.51 0.49 -3.10 3.99 1.35 -2.01 -3.48 112.91 110.66 2ozk h THR 48 Ca -0.34 -1.82 -0.58 0.00 -0.55 0.00 0.00 66.41 63.13 2ozk h THR 48 Cb 1.30 2.06 0.17 0.00 -1.73 0.00 0.00 68.15 69.96 2ozk h THR 48 CO 0.51 0.28 -0.32 0.18 -0.25 0.00 0.00 175.52 175.92 2ozk n LEU 49 N -2.97 1.23 -4.73 3.87 7.99 -1.26 -4.94 117.00 116.19 2ozk n LEU 49 Ca -0.03 0.72 -0.40 0.00 -0.01 0.00 0.00 56.01 56.29 2ozk n LEU 49 Cb 0.73 -1.21 0.02 0.00 -0.11 0.00 0.00 43.42 42.86 2ozk n LEU 49 CO 0.41 -2.89 0.95 -0.81 -1.51 0.00 0.00 177.39 173.54 2ozk n PRO 50 N -0.32 1.93 -0.08 3.23 -0.04 -1.26 -4.75 135.00 133.70 2ozk n PRO 50 Ca 0.12 0.69 -0.10 0.00 -0.04 0.00 0.00 63.50 64.17 2ozk n PRO 50 Cb 0.48 -2.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.37 2ozk n PRO 50 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 2ozk h VAL 51 N 1.92 0.00 0.00 0.52 3.04 -1.95 -1.62 116.25 118.16 2ozk h VAL 51 Ca -0.50 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.15 2ozk h VAL 51 Cb 1.29 0.00 -0.01 0.00 -2.01 0.00 0.00 31.29 30.57 2ozk h VAL 51 CO 0.59 0.00 -0.20 -0.55 -1.01 0.00 0.00 177.57 176.40 2ozk h ASN 52 N -0.30 0.00 -0.28 3.17 -1.07 -1.98 -0.69 115.58 114.43 2ozk h ASN 52 Ca 0.05 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.41 2ozk h ASN 52 Cb 0.43 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.67 2ozk h ASN 52 CO -0.40 0.20 0.14 0.58 0.07 0.00 0.00 177.43 178.02 2ozk h VAL 53 N 0.00 1.14 -0.96 6.14 2.07 -1.70 -1.53 116.25 121.41 2ozk h VAL 53 Ca -0.00 -0.38 0.02 0.00 0.82 0.00 0.00 66.70 67.16 2ozk h VAL 53 Cb 0.40 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 2ozk h VAL 53 CO 0.03 0.14 0.63 0.00 0.02 0.00 0.00 177.57 178.39 2ozk h ALA 54 N 1.01 1.35 -0.44 1.67 0.00 -0.37 -2.34 119.26 120.14 2ozk h ALA 54 Ca 0.10 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2ozk h ALA 54 Cb 0.09 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2ozk h ALA 54 CO -0.01 0.58 -0.08 0.35 0.00 0.00 0.00 179.25 180.08 2ozk h PHE 55 N 1.25 0.85 0.10 0.00 3.57 -0.87 -0.99 116.94 120.84 2ozk h PHE 55 Ca 0.36 -0.15 0.01 0.00 3.53 0.00 0.00 57.97 61.73 2ozk h PHE 55 Cb -0.08 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.42 2ozk h PHE 55 CO -0.00 0.83 -0.16 1.49 -2.23 0.00 0.00 178.31 178.23 2ozk h GLU 56 N 0.71 -0.31 -0.17 1.11 4.81 -0.96 0.10 114.58 119.87 2ozk h GLU 56 Ca 0.12 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.43 2ozk h GLU 56 Cb 0.56 0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.95 2ozk h GLU 56 CO 0.03 -0.21 -0.23 -0.07 -0.73 0.00 0.00 179.01 177.81 2ozk h LEU 57 N -0.32 -0.72 0.28 1.64 3.38 -0.82 -2.12 115.31 116.64 2ozk h LEU 57 Ca 0.02 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 2ozk h LEU 57 Cb 0.34 0.33 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 2ozk h LEU 57 CO -0.09 -0.27 -0.41 -0.25 0.09 0.00 0.00 178.44 177.51 2ozk h TRP 58 N -0.27 -1.15 0.00 1.13 7.01 -1.15 -2.41 115.95 119.11 2ozk h TRP 58 Ca 0.11 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.13 2ozk h TRP 58 Cb 0.44 0.47 0.00 0.00 -2.10 0.00 0.00 29.16 27.97 2ozk h TRP 58 CO -0.35 -0.51 0.00 0.00 -2.79 0.00 0.00 178.44 174.79 2ozk n ALA 59 N -2.75 1.24 -0.33 2.65 0.00 0.01 0.87 120.51 122.20 2ozk n ALA 59 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2ozk n ALA 59 Cb 0.35 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.94 2ozk n ALA 59 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ozk n LYS 60 N -0.34 1.00 -0.35 0.00 5.02 -0.93 -5.02 118.16 117.53 2ozk n LYS 60 Ca 0.00 -0.13 -0.13 0.00 -2.02 0.00 0.00 58.31 56.03 2ozk n LYS 60 Cb 0.00 -0.51 -0.01 0.00 -0.02 0.00 0.00 35.03 34.49 2ozk n LYS 60 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2ozk n ARG 61 N -0.18 0.00 -2.14 1.97 1.74 0.25 -3.97 116.66 114.32 2ozk n ARG 61 Ca 0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 2ozk n ARG 61 Cb 0.08 -0.30 -0.03 0.00 -1.02 0.00 0.00 32.46 31.20 2ozk n ARG 61 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2ozk s ASN 62 N -0.13 6.62 -0.04 0.55 3.84 -0.46 -4.87 114.94 120.46 2ozk s ASN 62 Ca 0.19 1.87 0.18 0.00 0.21 0.00 0.00 52.86 55.31 2ozk s ASN 62 Cb -0.26 -2.53 0.57 0.00 -0.55 0.00 0.00 41.25 38.47 2ozk s ASN 62 CO 0.14 -1.02 1.48 2.30 -2.79 0.00 0.00 177.10 177.21 2ozk n ILE 63 N 5.81 1.27 -2.17 -5.21 -5.35 -1.26 -4.69 119.36 107.76 2ozk n ILE 63 Ca 0.17 -1.09 -0.28 0.00 -0.27 0.00 0.00 62.75 61.28 2ozk n ILE 63 Cb 0.44 0.37 0.18 0.00 -1.74 0.00 0.00 39.64 38.89 2ozk n ILE 63 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 2ozk s LYS 64 N -1.30 0.74 0.07 6.28 1.02 -1.26 -3.98 119.74 121.30 2ozk s LYS 64 Ca 0.42 -0.78 -0.30 0.00 0.02 0.00 0.00 55.97 55.33 2ozk s LYS 64 Cb 0.24 -1.99 -0.09 0.00 -0.52 0.00 0.00 37.83 35.47 2ozk s LYS 64 CO 0.25 -2.25 1.87 -2.14 -0.92 0.00 0.00 175.35 172.16 2ozk s PRO 65 N -5.70 4.15 0.24 -1.68 0.02 -1.26 -4.39 135.00 126.37 2ozk s PRO 65 Ca 0.74 2.56 0.10 0.00 0.02 0.00 0.00 61.00 64.41 2ozk s PRO 65 Cb -0.03 -3.89 -0.04 0.00 0.02 0.00 0.00 34.50 30.56 2ozk s PRO 65 CO 0.51 -0.89 -0.06 0.14 -0.33 0.00 0.00 177.00 176.37 2ozk s VAL 66 N 3.65 3.22 1.05 3.83 -7.23 -0.77 -4.88 120.40 119.27 2ozk s VAL 66 Ca 0.83 -1.89 -0.12 0.00 -1.81 0.00 0.00 61.98 58.99 2ozk s VAL 66 Cb -0.43 -2.67 0.22 0.00 0.56 0.00 0.00 36.38 34.06 2ozk s VAL 66 CO 0.38 -0.28 1.07 -2.16 -0.31 0.00 0.00 175.10 173.80 2ozk s PRO 67 N -3.35 -0.04 0.40 4.82 0.04 -1.26 0.85 135.00 136.46 2ozk s PRO 67 Ca 0.29 0.97 -0.09 0.00 0.04 0.00 0.00 61.00 62.21 2ozk s PRO 67 Cb -0.07 -1.65 -0.06 0.00 0.04 0.00 0.00 34.50 32.76 2ozk s PRO 67 CO 0.17 -3.17 0.74 -1.21 0.04 0.00 0.00 177.00 173.58 2ozk s GLU 68 N -4.62 3.73 0.29 4.56 2.02 -1.26 -4.49 118.70 118.93 2ozk s GLU 68 Ca 0.67 0.37 0.03 0.00 0.02 0.00 0.00 54.97 56.06 2ozk s GLU 68 Cb -0.23 -2.42 0.61 0.00 0.10 0.00 0.00 34.13 32.19 2ozk s GLU 68 CO 0.61 -0.02 1.81 0.82 0.02 0.00 0.00 175.26 178.50 2ozk h ILE 69 N 1.02 0.84 -0.34 -1.63 1.08 -1.94 -1.61 117.51 114.93 2ozk h ILE 69 Ca -0.47 -0.31 0.01 0.00 -0.39 0.00 0.00 64.86 63.70 2ozk h ILE 69 Cb 1.19 -0.14 -0.02 0.00 -3.07 0.00 0.00 36.82 34.78 2ozk h ILE 69 CO 0.64 0.16 0.21 0.07 -0.69 0.00 0.00 178.15 178.55 2ozk h LYS 70 N 0.90 0.42 -0.04 2.37 2.10 -1.93 -0.08 116.57 120.31 2ozk h LYS 70 Ca 0.52 -0.03 0.01 0.00 -2.00 0.00 0.00 60.65 59.16 2ozk h LYS 70 Cb 0.64 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 31.86 2ozk h LYS 70 CO -0.31 0.28 -0.01 0.82 -2.00 0.00 0.00 179.45 178.23 2ozk h ILE 71 N 0.44 0.95 -0.32 0.07 1.08 -1.63 -0.78 117.51 117.32 2ozk h ILE 71 Ca 0.13 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.54 2ozk h ILE 71 Cb -0.03 0.95 -0.02 0.00 -3.07 0.00 0.00 36.82 34.65 2ozk h ILE 71 CO -0.04 0.00 -0.06 -0.07 -0.69 0.00 0.00 178.15 177.29 2ozk h LEU 72 N -0.00 0.49 0.21 1.44 3.38 -1.13 -0.34 115.31 119.36 2ozk h LEU 72 Ca 0.02 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2ozk h LEU 72 Cb 0.04 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2ozk h LEU 72 CO -0.05 0.61 -0.10 0.78 0.09 0.00 0.00 178.44 179.77 2ozk h ASN 73 N 0.49 -0.23 -0.82 -0.43 4.21 -0.83 -1.86 115.58 116.10 2ozk h ASN 73 Ca 0.10 -0.16 0.16 0.00 1.21 0.00 0.00 56.30 57.61 2ozk h ASN 73 Cb 0.41 0.06 -0.06 0.00 -1.12 0.00 0.00 38.32 37.62 2ozk h ASN 73 CO 0.02 0.03 0.54 0.78 -1.29 0.00 0.00 177.43 177.52 2ozk h ASN 74 N -0.51 0.45 1.05 5.81 4.21 -0.71 0.23 115.58 126.12 2ozk h ASN 74 Ca -0.03 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2ozk h ASN 74 Cb 0.38 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.52 2ozk h ASN 74 CO 0.05 0.22 -0.01 0.18 -1.29 0.00 0.00 177.43 176.57 2ozk n LEU 75 N -4.50 0.12 -0.65 1.61 7.99 -0.18 -4.84 117.00 116.55 2ozk n LEU 75 Ca 0.16 0.50 -0.02 0.00 -0.01 0.00 0.00 56.01 56.64 2ozk n LEU 75 Cb 0.56 -0.47 0.01 0.00 -0.11 0.00 0.00 43.42 43.40 2ozk n LEU 75 CO 0.31 -0.02 0.01 0.61 -1.51 0.00 0.00 177.39 176.80 2ozk n GLY 76 N 1.47 0.75 3.77 -0.72 0.00 0.80 -5.03 105.19 106.24 2ozk n GLY 76 Ca 0.07 -0.64 -0.38 0.00 0.00 0.00 0.00 46.02 45.06 2ozk n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ozk s VAL 77 N -2.87 5.04 0.00 1.61 1.01 -0.73 -4.43 120.40 120.03 2ozk s VAL 77 Ca 0.04 1.02 0.00 0.00 0.00 0.00 0.00 61.98 63.04 2ozk s VAL 77 Cb -0.02 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.54 2ozk s VAL 77 CO 0.05 0.43 0.00 0.47 0.00 0.00 0.00 175.10 176.05 2ozk n ASP 78 N 2.82 1.65 -3.64 3.32 8.00 -0.42 -4.72 116.55 123.56 2ozk n ASP 78 Ca -0.09 -0.24 -0.11 0.00 0.71 0.00 0.00 54.79 55.06 2ozk n ASP 78 Cb 0.52 0.81 -0.07 0.00 -0.02 0.00 0.00 41.12 42.35 2ozk n ASP 78 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2ozk s ILE 79 N -1.14 -0.00 0.15 0.53 2.07 -1.20 -4.18 121.20 117.43 2ozk s ILE 79 Ca 0.00 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.17 2ozk s ILE 79 Cb 0.00 -0.97 -0.06 0.00 0.13 0.00 0.00 42.46 41.56 2ozk s ILE 79 CO 0.00 0.00 0.42 0.00 -1.91 0.00 0.00 174.94 173.45 2ozk s ALA 80 N 0.90 3.72 -0.48 1.50 0.00 -1.26 -0.70 121.76 125.44 2ozk s ALA 80 Ca -0.04 -0.45 -0.26 0.00 0.00 0.00 0.00 51.96 51.21 2ozk s ALA 80 Cb -0.05 -2.24 0.03 0.00 0.00 0.00 0.00 23.12 20.86 2ozk s ALA 80 CO -0.08 0.61 0.98 0.00 0.00 0.00 0.00 175.76 177.27 2ozk s ALA 81 N -1.63 3.20 0.00 0.00 0.00 0.18 -4.16 121.76 119.35 2ozk s ALA 81 Ca 0.41 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.57 2ozk s ALA 81 Cb -0.12 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.28 2ozk s ALA 81 CO 0.22 -2.17 0.00 0.09 0.00 0.00 0.00 175.76 173.90 2ozk n ASN 82 N 7.39 -2.55 -2.07 0.00 4.13 -1.01 -4.72 115.26 116.43 2ozk n ASN 82 Ca 0.07 0.00 -0.09 0.00 1.68 0.00 0.00 54.58 56.24 2ozk n ASN 82 Cb 0.48 -1.18 -0.03 0.00 -1.54 0.00 0.00 39.78 37.51 2ozk n ASN 82 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61 2ozk n THR 83 N -2.46 0.00 -4.46 3.41 5.66 -1.26 -4.85 114.28 110.32 2ozk n THR 83 Ca 0.00 -1.00 -0.27 0.00 -3.05 0.00 0.00 64.05 59.73 2ozk n THR 83 Cb 0.10 0.46 -0.17 0.00 -1.55 0.00 0.00 70.33 69.17 2ozk n THR 83 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2ozk s VAL 84 N -2.46 1.36 -0.26 1.08 1.01 -1.26 -4.65 120.40 115.23 2ozk s VAL 84 Ca 0.14 -0.57 -0.18 0.00 0.00 0.00 0.00 61.98 61.38 2ozk s VAL 84 Cb 0.01 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 2ozk s VAL 84 CO 0.10 0.41 0.51 -0.63 0.00 0.00 0.00 175.10 175.49 2ozk s ILE 85 N 0.94 5.08 -0.06 2.22 -1.09 -1.26 -1.35 121.20 125.68 2ozk s ILE 85 Ca -0.08 0.87 -0.16 0.00 -2.23 0.00 0.00 60.65 59.05 2ozk s ILE 85 Cb -0.15 -3.82 -0.05 0.00 -1.58 0.00 0.00 42.46 36.86 2ozk s ILE 85 CO -0.00 0.10 0.41 0.86 -1.23 0.00 0.00 174.94 175.07 2ozk s TRP 86 N 2.24 3.62 -0.44 3.97 -0.11 -1.26 -0.52 118.94 126.43 2ozk s TRP 86 Ca 0.21 0.89 -0.19 0.00 1.22 0.00 0.00 56.10 58.23 2ozk s TRP 86 Cb -0.16 -2.38 0.03 0.00 -1.50 0.00 0.00 33.47 29.46 2ozk s TRP 86 CO 0.09 0.43 0.55 0.34 -4.62 0.00 0.00 176.95 173.74 2ozk s ASP 87 N -0.29 6.25 0.32 5.86 3.68 -0.19 -4.77 116.67 127.53 2ozk s ASP 87 Ca 0.23 -0.57 0.24 0.00 2.13 0.00 0.00 52.55 54.58 2ozk s ASP 87 Cb -0.16 -2.27 0.45 0.00 -1.45 0.00 0.00 42.92 39.49 2ozk s ASP 87 CO 0.11 -0.71 1.58 1.88 0.13 0.00 0.00 175.17 178.16 2ozk h TYR 88 N 8.83 0.00 0.00 -5.34 -1.99 -1.94 -0.71 116.97 115.83 2ozk h TYR 88 Ca -0.26 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.39 2ozk h TYR 88 Cb 1.10 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.82 2ozk h TYR 88 CO 0.69 0.00 -0.41 0.87 -0.00 0.00 0.00 178.16 179.30 2ozk h LYS 89 N 0.00 0.01 0.00 4.88 6.56 -1.91 -3.26 116.57 122.85 2ozk h LYS 89 Ca 0.00 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.58 2ozk h LYS 89 Cb 0.90 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.57 2ozk h LYS 89 CO 0.00 1.01 0.00 0.54 -2.06 0.00 0.00 179.45 178.94 2ozk n ARG 90 N -4.54 0.09 -3.03 3.15 1.74 -1.23 -4.89 116.66 107.95 2ozk n ARG 90 Ca -0.17 0.47 -0.21 0.00 -0.77 0.00 0.00 57.85 57.17 2ozk n ARG 90 Cb 0.55 -1.73 0.01 0.00 -1.02 0.00 0.00 32.46 30.27 2ozk n ARG 90 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2ozk n GLU 91 N -1.92 -3.79 -3.83 5.56 1.02 -0.33 -4.97 120.64 112.38 2ozk n GLU 91 Ca 0.01 0.71 -0.10 0.00 -0.02 0.00 0.00 57.16 57.77 2ozk n GLU 91 Cb 0.10 -5.47 -0.05 0.00 -0.02 0.00 0.00 31.44 26.00 2ozk n GLU 91 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ozk s ALA 92 N -3.00 -0.54 0.44 0.62 0.00 -0.84 -4.32 121.76 114.12 2ozk s ALA 92 Ca 0.28 -0.50 -0.25 0.00 0.00 0.00 0.00 51.96 51.49 2ozk s ALA 92 Cb -0.14 0.85 -0.08 0.00 0.00 0.00 0.00 23.12 23.75 2ozk s ALA 92 CO 0.35 -0.74 1.28 -1.25 0.00 0.00 0.00 175.76 175.40 2ozk s PRO 93 N -3.91 3.77 0.44 0.00 0.04 -1.26 -1.02 135.00 133.05 2ozk s PRO 93 Ca 0.12 2.08 0.30 0.00 0.04 0.00 0.00 61.00 63.54 2ozk s PRO 93 Cb 0.01 -2.59 1.35 0.00 0.04 0.00 0.00 34.50 33.32 2ozk s PRO 93 CO -0.02 -0.63 1.90 0.00 0.04 0.00 0.00 177.00 178.30 2ozk h ALA 94 N 2.32 1.00 -2.51 8.56 0.00 -1.11 -3.44 119.26 124.07 2ozk h ALA 94 Ca -0.50 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.11 2ozk h ALA 94 Cb 1.26 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.88 2ozk h ALA 94 CO 0.61 0.00 -0.72 -1.01 0.00 0.00 0.00 179.25 178.13 2ozk s HIS 95 N -3.59 1.08 0.01 0.00 3.76 -1.26 -5.02 115.29 110.27 2ozk s HIS 95 Ca 0.01 -0.73 -0.17 0.00 -0.15 0.00 0.00 55.06 54.03 2ozk s HIS 95 Cb 0.09 -0.59 -0.09 0.00 1.11 0.00 0.00 32.58 33.10 2ozk s HIS 95 CO 0.43 -0.00 0.97 0.28 -0.85 0.00 0.00 174.74 175.57 2ozk h VAL 96 N 3.26 0.00 -3.03 -0.90 2.07 -1.88 -3.47 116.25 112.30 2ozk h VAL 96 Ca -0.37 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2ozk h VAL 96 Cb 1.19 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2ozk h VAL 96 CO 0.58 0.00 0.00 -1.20 0.02 0.00 0.00 177.57 176.97 2ozk n SER 97 N -4.12 0.00 -3.60 0.57 7.64 -1.26 -5.06 113.62 107.79 2ozk n SER 97 Ca -0.08 -0.06 -0.14 0.00 1.01 0.00 0.00 58.87 59.61 2ozk n SER 97 Cb 0.24 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.38 2ozk n SER 97 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2ozk s THR 98 N 1.92 0.00 -0.17 0.44 -4.23 -0.94 -4.86 115.64 107.81 2ozk s THR 98 Ca 0.00 -1.74 -0.04 0.00 -1.18 0.00 0.00 61.69 58.73 2ozk s THR 98 Cb 0.00 -2.51 0.07 0.00 1.34 0.00 0.00 72.50 71.40 2ozk s THR 98 CO 0.00 0.00 0.15 -0.63 -0.54 0.00 0.00 174.62 173.60 2ozk s ILE 99 N -3.53 -0.21 -1.29 2.99 1.01 -1.26 -1.89 121.20 117.03 2ozk s ILE 99 Ca 0.33 -0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.88 2ozk s ILE 99 Cb 0.02 -0.56 0.01 0.00 0.01 0.00 0.00 42.46 41.93 2ozk s ILE 99 CO 0.18 -0.18 1.08 0.61 0.00 0.00 0.00 174.94 176.63 2ozk n GLY 100 N 5.30 -0.45 1.60 6.18 0.00 -0.78 -2.40 105.19 114.65 2ozk n GLY 100 Ca -0.06 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2ozk n GLY 100 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ozk n VAL 101 N -4.55 0.48 -3.66 1.61 0.31 -1.26 -4.78 118.33 106.48 2ozk n VAL 101 Ca -0.15 0.16 -0.28 0.00 -0.01 0.00 0.00 64.34 64.06 2ozk n VAL 101 Cb 0.62 -0.92 -0.16 0.00 -0.91 0.00 0.00 33.84 32.47 2ozk n VAL 101 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ozk h THR 103 N 6.47 0.45 0.00 0.00 1.35 -1.97 0.17 112.91 119.37 2ozk h THR 103 Ca -0.16 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 2ozk h THR 103 Cb 1.08 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 2ozk h THR 103 CO 0.37 0.07 0.00 0.23 -0.25 0.00 0.00 175.52 175.94 2ozk n MET 104 N -4.71 0.58 0.00 4.72 2.81 -1.26 -3.43 117.12 115.83 2ozk n MET 104 Ca 0.28 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 56.19 2ozk n MET 104 Cb 0.95 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.96 2ozk n MET 104 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2ozk n THR 105 N -1.09 0.00 -1.70 2.03 -2.24 0.47 -5.07 114.28 106.68 2ozk n THR 105 Ca 0.15 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.49 2ozk n THR 105 Cb 0.10 1.49 -0.03 0.00 -2.10 0.00 0.00 70.33 69.79 2ozk n THR 105 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2ozk n ASP 106 N 0.00 3.29 -0.36 3.42 10.43 -0.45 -2.21 116.55 130.67 2ozk n ASP 106 Ca 0.00 1.12 0.09 0.00 2.57 0.00 0.00 54.79 58.57 2ozk n ASP 106 Cb 0.13 -1.49 -0.02 0.00 1.84 0.00 0.00 41.12 41.58 2ozk n ASP 106 CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 2ozk n ILE 107 N 2.64 0.00 -3.37 0.53 -5.35 -0.79 -4.86 119.36 108.17 2ozk n ILE 107 Ca 0.13 -0.26 -0.03 0.00 -0.27 0.00 0.00 62.75 62.32 2ozk n ILE 107 Cb 0.32 1.19 0.01 0.00 -1.74 0.00 0.00 39.64 39.42 2ozk n ILE 107 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2ozk n ALA 108 N -0.29 -0.77 0.06 -1.28 0.00 -1.26 -4.84 120.51 112.12 2ozk n ALA 108 Ca 0.07 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2ozk n ALA 108 Cb 0.38 0.37 0.00 0.00 0.00 0.00 0.00 19.45 20.20 2ozk n ALA 108 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ozk n LYS 109 N -0.23 0.00 -3.48 0.00 5.02 -1.26 -1.87 118.16 116.34 2ozk n LYS 109 Ca -0.03 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.88 2ozk n LYS 109 Cb 0.23 -0.29 -0.06 0.00 -0.02 0.00 0.00 35.03 34.90 2ozk n LYS 109 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2ozk s LYS 110 N -2.00 3.98 -0.01 1.97 1.02 -1.26 -3.31 119.74 120.13 2ozk s LYS 110 Ca 0.00 0.40 -0.00 0.00 0.02 0.00 0.00 55.97 56.39 2ozk s LYS 110 Cb 0.00 -3.26 0.01 0.00 -0.52 0.00 0.00 37.83 34.06 2ozk s LYS 110 CO 0.00 0.61 1.96 -0.35 -0.92 0.00 0.00 175.35 176.65 2ozk n PRO 111 N 2.12 1.03 0.00 -1.68 -0.04 -1.26 -3.07 135.00 132.10 2ozk n PRO 111 Ca -0.13 -0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2ozk n PRO 111 Cb 0.52 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 32.96 2ozk n PRO 111 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2ozk n THR 112 N 1.43 0.00 -1.87 0.52 -2.24 -1.26 -4.86 114.28 105.99 2ozk n THR 112 Ca 0.01 -0.16 -0.41 0.00 -2.27 0.00 0.00 64.05 61.22 2ozk n THR 112 Cb 0.50 1.68 -0.02 0.00 -2.10 0.00 0.00 70.33 70.39 2ozk n THR 112 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2ozk s GLU 113 N -0.00 4.18 0.09 -0.78 2.02 -1.17 -4.83 118.70 118.21 2ozk s GLU 113 Ca 0.00 2.46 0.03 0.00 0.02 0.00 0.00 54.97 57.48 2ozk s GLU 113 Cb 0.00 -3.06 0.28 0.00 0.10 0.00 0.00 34.13 31.44 2ozk s GLU 113 CO 0.00 -0.56 0.44 0.45 0.02 0.00 0.00 175.26 175.61 2ozk n SER 114 N 2.40 0.02 0.25 -0.19 2.88 -1.26 -0.28 113.62 117.44 2ozk n SER 114 Ca 0.08 0.47 0.10 0.00 -1.33 0.00 0.00 58.87 58.19 2ozk n SER 114 Cb 0.38 -0.19 0.54 0.00 -0.75 0.00 0.00 64.21 64.19 2ozk n SER 114 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ozk h ALA 115 N 0.55 1.31 -0.04 -1.46 0.00 -1.88 -2.54 119.26 115.20 2ozk h ALA 115 Ca 0.20 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.93 2ozk h ALA 115 Cb 0.46 0.00 -0.34 0.00 0.00 0.00 0.00 17.79 17.92 2ozk h ALA 115 CO -0.24 -0.31 -0.88 0.00 0.00 0.00 0.00 179.25 177.82 2ozk h SER 117 N 0.94 0.18 -2.14 0.00 4.64 -1.55 -3.25 113.55 112.37 2ozk h SER 117 Ca -0.29 -0.07 -0.80 0.00 -0.47 0.00 0.00 61.79 60.16 2ozk h SER 117 Cb 1.74 -0.05 -0.26 0.00 -0.31 0.00 0.00 62.40 63.52 2ozk h SER 117 CO 0.02 0.54 1.15 -1.54 -0.87 0.00 0.00 176.83 176.13 2ozk n SER 118 N -4.07 7.43 -3.60 4.97 3.41 -1.26 -3.48 113.62 117.02 2ozk n SER 118 Ca -0.01 -3.65 -0.02 0.00 -0.26 0.00 0.00 58.87 54.93 2ozk n SER 118 Cb 0.44 -1.18 -0.05 0.00 -0.26 0.00 0.00 64.21 63.16 2ozk n SER 118 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2ozk s LEU 119 N -4.14 -0.94 -0.27 1.04 1.43 -1.23 -5.10 118.68 109.47 2ozk s LEU 119 Ca 0.41 1.34 -0.29 0.00 -1.03 0.00 0.00 54.13 54.56 2ozk s LEU 119 Cb 0.21 2.14 -0.03 0.00 0.03 0.00 0.00 46.19 48.54 2ozk s LEU 119 CO -0.14 -0.19 1.78 -0.89 0.23 0.00 0.00 176.35 177.13 2ozk s THR 120 N 2.44 3.49 -0.23 5.49 2.01 -1.26 -4.42 115.64 123.16 2ozk s THR 120 Ca -0.06 0.52 -0.07 0.00 0.31 0.00 0.00 61.69 62.39 2ozk s THR 120 Cb -0.09 -3.59 -0.03 0.00 0.01 0.00 0.00 72.50 68.81 2ozk s THR 120 CO -0.19 -0.33 0.05 -0.69 -0.69 0.00 0.00 174.62 172.78 2ozk s VAL 121 N 6.37 4.32 0.09 3.82 1.01 -1.02 -1.31 120.40 133.68 2ozk s VAL 121 Ca 0.79 -0.18 -0.31 0.00 0.00 0.00 0.00 61.98 62.29 2ozk s VAL 121 Cb -0.25 -2.99 -0.08 0.00 0.00 0.00 0.00 36.38 33.06 2ozk s VAL 121 CO 0.33 0.38 1.54 -0.22 0.00 0.00 0.00 175.10 177.13 2ozk s LEU 122 N 1.27 4.36 -0.14 3.92 1.98 0.13 -2.18 118.68 128.01 2ozk s LEU 122 Ca 0.05 2.43 0.01 0.00 -2.89 0.00 0.00 54.13 53.72 2ozk s LEU 122 Cb -0.15 -3.57 0.02 0.00 0.66 0.00 0.00 46.19 43.15 2ozk s LEU 122 CO 0.03 -0.80 -0.17 -0.36 -1.89 0.00 0.00 176.35 173.15 2ozk s PHE 123 N 1.97 2.33 -0.55 5.38 0.40 -0.30 0.51 117.98 127.73 2ozk s PHE 123 Ca 0.70 -1.23 -0.18 0.00 -0.60 0.00 0.00 56.93 55.62 2ozk s PHE 123 Cb -0.39 -1.65 0.09 0.00 0.51 0.00 0.00 43.02 41.59 2ozk s PHE 123 CO 0.31 -0.62 0.61 0.34 0.70 0.00 0.00 175.22 176.56 2ozk s ASP 124 N 1.14 6.19 0.00 1.36 -1.08 -1.26 -1.36 116.67 121.66 2ozk s ASP 124 Ca -0.01 -1.36 0.16 0.00 -0.52 0.00 0.00 52.55 50.82 2ozk s ASP 124 Cb -0.14 -2.27 0.76 0.00 -1.46 0.00 0.00 42.92 39.81 2ozk s ASP 124 CO -0.06 -0.96 1.48 0.61 0.52 0.00 0.00 175.17 176.76 2ozk n GLY 125 N 5.24 -0.91 0.17 2.66 0.00 0.96 -2.63 105.19 110.68 2ozk n GLY 125 Ca -0.10 -0.07 0.03 0.00 0.00 0.00 0.00 46.02 45.88 2ozk n GLY 125 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2ozk h ARG 126 N 0.00 0.00 -6.29 1.61 3.08 -1.92 -3.43 114.38 107.42 2ozk h ARG 126 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 2ozk h ARG 126 Cb 0.20 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 2ozk h ARG 126 CO 0.00 0.45 -0.20 0.14 -1.07 0.00 0.00 179.97 179.28 2ozk s VAL 127 N -3.73 5.04 0.55 2.04 -7.23 -1.08 -5.05 120.40 110.94 2ozk s VAL 127 Ca -0.01 0.31 -0.21 0.00 -1.81 0.00 0.00 61.98 60.26 2ozk s VAL 127 Cb 0.12 -3.63 -0.05 0.00 0.56 0.00 0.00 36.38 33.39 2ozk s VAL 127 CO 0.71 0.02 1.29 -1.61 -0.31 0.00 0.00 175.10 175.21 2ozk s GLU 128 N -2.62 3.15 0.00 4.82 0.41 -1.26 -3.36 118.70 119.84 2ozk s GLU 128 Ca 0.43 2.06 0.00 0.00 -0.41 0.00 0.00 54.97 57.05 2ozk s GLU 128 Cb -0.12 -2.18 0.00 0.00 -1.78 0.00 0.00 34.13 30.05 2ozk s GLU 128 CO 0.22 -1.13 0.00 0.41 -0.49 0.00 0.00 175.26 174.27 2ozk n GLY 129 N 0.66 0.37 0.13 -1.39 0.00 -1.26 -4.84 105.19 98.87 2ozk n GLY 129 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 2ozk n GLY 129 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2ozk h GLN 130 N 1.04 0.33 -0.14 1.61 4.20 -1.84 -2.79 115.11 117.52 2ozk h GLN 130 Ca 0.00 -0.42 0.05 0.00 0.06 0.00 0.00 58.65 58.34 2ozk h GLN 130 Cb 0.18 0.13 -0.06 0.00 0.30 0.00 0.00 27.48 28.03 2ozk h GLN 130 CO 0.00 1.12 -0.25 0.28 -0.67 0.00 0.00 178.83 179.32 2ozk h VAL 131 N 0.16 0.41 0.00 -0.54 2.07 -1.87 -0.47 116.25 116.00 2ozk h VAL 131 Ca -0.09 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.37 2ozk h VAL 131 Cb 1.70 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 2ozk h VAL 131 CO 0.17 0.00 -0.29 -2.24 0.02 0.00 0.00 177.57 175.24 2ozk h ASP 132 N -0.31 0.00 -1.01 0.57 2.03 -1.97 0.19 116.42 115.93 2ozk h ASP 132 Ca 0.10 0.00 0.03 0.00 -0.73 0.00 0.00 57.03 56.43 2ozk h ASP 132 Cb 0.46 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.91 2ozk h ASP 132 CO -0.32 0.29 0.66 -0.07 -1.03 0.00 0.00 179.24 178.77 2ozk h LEU 133 N 0.00 1.12 -0.23 0.15 3.38 -1.12 -1.20 115.31 117.41 2ozk h LEU 133 Ca -0.00 -0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.74 2ozk h LEU 133 Cb 0.80 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 2ozk h LEU 133 CO 0.04 0.78 -0.91 0.15 0.09 0.00 0.00 178.44 178.59 2ozk h PHE 134 N 1.30 0.44 -0.30 1.13 3.57 0.31 -0.89 116.94 122.51 2ozk h PHE 134 Ca 0.39 -0.24 0.01 0.00 3.53 0.00 0.00 57.97 61.66 2ozk h PHE 134 Cb -0.05 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 2ozk h PHE 134 CO -0.00 1.06 0.20 0.00 -2.23 0.00 0.00 178.31 177.34 2ozk h ARG 135 N 0.16 0.37 -0.02 1.11 3.08 -0.31 -2.78 114.38 115.99 2ozk h ARG 135 Ca -0.06 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2ozk h ARG 135 Cb 1.54 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.51 2ozk h ARG 135 CO 0.15 0.24 -0.35 0.09 -1.07 0.00 0.00 179.97 179.03 2ozk n ASN 136 N -4.49 1.92 -4.85 7.04 3.02 -0.49 -4.94 115.26 112.47 2ozk n ASN 136 Ca 0.02 -1.45 -0.32 0.00 -0.03 0.00 0.00 54.58 52.80 2ozk n ASN 136 Cb 0.09 0.33 -0.04 0.00 -0.61 0.00 0.00 39.78 39.55 2ozk n ASN 136 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ozk s ALA 137 N -2.40 3.14 -0.10 5.41 0.00 -0.36 -5.00 121.76 122.44 2ozk s ALA 137 Ca 0.22 0.10 -0.21 0.00 0.00 0.00 0.00 51.96 52.07 2ozk s ALA 137 Cb 0.19 -3.01 -0.27 0.00 0.00 0.00 0.00 23.12 20.02 2ozk s ALA 137 CO 0.52 -0.15 0.66 0.00 0.00 0.00 0.00 175.76 176.79 2ozk h ARG 138 N 1.08 0.20 -4.63 0.00 2.47 -1.87 -3.44 114.38 108.18 2ozk h ARG 138 Ca -0.47 -0.33 -0.55 0.00 -1.26 0.00 0.00 59.98 57.37 2ozk h ARG 138 Cb 1.18 0.12 -0.34 0.00 -1.65 0.00 0.00 29.97 29.29 2ozk h ARG 138 CO 0.62 1.16 -0.82 -0.80 0.56 0.00 0.00 179.97 180.69 2ozk s ASN 139 N -6.86 2.07 0.00 7.04 0.01 -1.23 -2.80 114.94 113.17 2ozk s ASN 139 Ca -0.19 -0.35 0.00 0.00 -0.71 0.00 0.00 52.86 51.61 2ozk s ASN 139 Cb 0.02 -0.94 0.00 0.00 0.41 0.00 0.00 41.25 40.75 2ozk s ASN 139 CO 0.76 0.03 0.00 0.61 -1.51 0.00 0.00 177.10 176.98 2ozk n GLY 140 N 3.97 0.69 3.16 0.66 0.00 -1.11 -2.44 105.19 110.12 2ozk n GLY 140 Ca -0.21 -0.90 -0.26 0.00 0.00 0.00 0.00 46.02 44.65 2ozk n GLY 140 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ozk s VAL 141 N -2.00 1.43 -0.16 1.61 -7.23 -0.93 -1.38 120.40 111.74 2ozk s VAL 141 Ca 0.00 -0.75 -0.01 0.00 -1.81 0.00 0.00 61.98 59.41 2ozk s VAL 141 Cb 0.00 -1.20 -0.01 0.00 0.56 0.00 0.00 36.38 35.73 2ozk s VAL 141 CO 0.00 0.41 -0.12 -0.22 -0.31 0.00 0.00 175.10 174.86 2ozk s LEU 142 N -0.26 2.66 0.00 1.32 2.96 -0.68 -1.15 118.68 123.54 2ozk s LEU 142 Ca 0.03 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.55 2ozk s LEU 142 Cb -0.09 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 44.94 2ozk s LEU 142 CO 0.00 0.09 0.05 0.27 -1.32 0.00 0.00 176.35 175.43 2ozk s ILE 143 N 0.82 4.46 0.13 6.68 -4.36 -0.46 -2.03 121.20 126.44 2ozk s ILE 143 Ca -0.04 -0.52 -0.11 0.00 -0.26 0.00 0.00 60.65 59.72 2ozk s ILE 143 Cb -0.15 -3.03 0.00 0.00 1.25 0.00 0.00 42.46 40.54 2ozk s ILE 143 CO 0.01 0.34 0.29 0.42 0.24 0.00 0.00 174.94 176.24 2ozk s THR 144 N -1.16 0.09 -0.86 8.37 -4.23 -1.08 -0.03 115.64 116.75 2ozk s THR 144 Ca 0.22 -1.15 0.26 0.00 -1.18 0.00 0.00 61.69 59.84 2ozk s THR 144 Cb -0.12 -1.54 0.13 0.00 1.34 0.00 0.00 72.50 72.31 2ozk s THR 144 CO 0.13 -0.42 1.59 -0.62 -0.54 0.00 0.00 174.62 174.77 2ozk n GLU 145 N -0.17 0.12 -0.27 3.99 1.02 -1.26 -1.95 120.64 122.12 2ozk n GLU 145 Ca -0.12 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 2ozk n GLU 145 Cb 0.63 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 2ozk n GLU 145 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ozk n GLY 146 N 1.42 2.80 3.70 0.62 0.00 -1.26 -4.90 105.19 107.58 2ozk n GLY 146 Ca 0.05 -0.84 -0.32 0.00 0.00 0.00 0.00 46.02 44.91 2ozk n GLY 146 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ozk s SER 147 N 1.19 3.58 -0.04 1.61 0.15 -1.26 -4.89 113.70 114.04 2ozk s SER 147 Ca 0.00 2.25 0.02 0.00 0.70 0.00 0.00 55.95 58.92 2ozk s SER 147 Cb 0.00 -2.57 0.01 0.00 -1.71 0.00 0.00 66.02 61.75 2ozk s SER 147 CO 0.00 -2.67 -0.08 -0.69 1.20 0.00 0.00 173.24 171.00 2ozk s VAL 148 N -2.36 0.77 0.04 4.45 1.01 -1.26 -5.12 120.40 117.94 2ozk s VAL 148 Ca 0.70 -0.29 -0.36 0.00 0.00 0.00 0.00 61.98 62.02 2ozk s VAL 148 Cb -0.25 -0.73 -0.16 0.00 0.00 0.00 0.00 36.38 35.23 2ozk s VAL 148 CO 0.52 0.27 1.47 2.29 0.00 0.00 0.00 175.10 179.65 2ozk n LYS 149 N 3.75 1.41 -0.82 2.72 0.00 -1.26 -2.95 118.16 121.02 2ozk n LYS 149 Ca -0.23 0.51 0.00 0.00 -0.00 0.00 0.00 58.31 58.59 2ozk n LYS 149 Cb 0.52 -2.20 0.00 0.00 -0.00 0.00 0.00 35.03 33.35 2ozk n LYS 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2ozk n GLY 150 N 3.04 0.34 3.12 2.58 0.00 -1.26 -4.98 105.19 108.03 2ozk n GLY 150 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 2ozk n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ozk s LEU 151 N 0.00 1.91 -0.13 0.99 1.43 -1.15 -5.12 118.68 116.61 2ozk s LEU 151 Ca 0.00 -0.32 -0.29 0.00 -1.03 0.00 0.00 54.13 52.48 2ozk s LEU 151 Cb 0.00 -0.90 -0.01 0.00 0.03 0.00 0.00 46.19 45.31 2ozk s LEU 151 CO 0.00 0.15 1.07 -0.89 0.23 0.00 0.00 176.35 176.90 2ozk s THR 152 N 0.01 4.63 0.81 5.49 2.01 -1.26 -4.61 115.64 122.71 2ozk s THR 152 Ca -0.02 1.92 -0.12 0.00 0.31 0.00 0.00 61.69 63.78 2ozk s THR 152 Cb -0.10 -4.24 0.08 0.00 0.01 0.00 0.00 72.50 68.25 2ozk s THR 152 CO 0.02 -0.05 1.18 -2.16 -0.69 0.00 0.00 174.62 172.91 2ozk s PRO 153 N 2.42 1.98 -0.09 4.92 0.04 -1.26 -4.87 135.00 138.14 2ozk s PRO 153 Ca 0.49 0.11 -0.02 0.00 0.04 0.00 0.00 61.00 61.61 2ozk s PRO 153 Cb -0.19 -1.96 0.04 0.00 0.04 0.00 0.00 34.50 32.43 2ozk s PRO 153 CO 0.16 -1.58 0.04 -1.54 0.04 0.00 0.00 177.00 174.11 2ozk s SER 154 N -4.58 1.75 0.19 6.66 1.04 -1.19 -4.95 113.70 112.62 2ozk s SER 154 Ca 0.62 -0.22 -0.32 0.00 0.48 0.00 0.00 55.95 56.51 2ozk s SER 154 Cb -0.11 -0.33 -0.16 0.00 0.10 0.00 0.00 66.02 65.52 2ozk s SER 154 CO 0.49 -0.25 1.11 0.29 0.98 0.00 0.00 173.24 175.86 2ozk n LYS 155 N 5.20 1.13 -0.37 4.02 5.02 -1.26 -2.14 118.16 129.76 2ozk n LYS 155 Ca -0.06 0.40 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 2ozk n LYS 155 Cb 0.49 -1.85 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 2ozk n LYS 155 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ozk n GLY 156 N 1.88 1.71 3.53 0.72 0.00 -0.16 -4.88 105.19 107.98 2ozk n GLY 156 Ca 0.14 -2.04 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 2ozk n GLY 156 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ozk n PRO 157 N -0.40 0.02 0.22 1.61 -0.02 -1.26 -4.78 135.00 130.39 2ozk n PRO 157 Ca 0.00 0.07 0.05 0.00 -2.02 0.00 0.00 63.50 61.60 2ozk n PRO 157 Cb 0.00 -2.06 0.50 0.00 -0.02 0.00 0.00 33.50 31.92 2ozk n PRO 157 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ozk h ALA 158 N -1.03 1.64 -3.36 3.55 0.00 -1.95 -3.39 119.26 114.73 2ozk h ALA 158 Ca -0.45 -0.18 -0.66 0.00 0.00 0.00 0.00 54.91 53.62 2ozk h ALA 158 Cb 1.31 -0.03 -0.13 0.00 0.00 0.00 0.00 17.79 18.94 2ozk h ALA 158 CO 0.41 0.25 -0.65 1.14 0.00 0.00 0.00 179.25 180.39 2ozk s GLN 159 N -4.56 2.65 0.41 0.00 1.03 -1.26 -3.99 119.66 113.94 2ozk s GLN 159 Ca -0.04 -0.74 0.04 0.00 0.04 0.00 0.00 55.36 54.66 2ozk s GLN 159 Cb 0.15 -2.59 -0.02 0.00 0.03 0.00 0.00 33.01 30.58 2ozk s GLN 159 CO 0.69 0.57 0.16 0.00 -2.54 0.00 0.00 175.29 174.17 2ozk s ALA 160 N -1.22 2.83 -0.50 2.60 0.00 -0.95 -4.80 121.76 119.72 2ozk s ALA 160 Ca 0.23 -1.30 -0.11 0.00 0.00 0.00 0.00 51.96 50.79 2ozk s ALA 160 Cb -0.12 0.85 0.13 0.00 0.00 0.00 0.00 23.12 23.98 2ozk s ALA 160 CO 0.15 -0.38 0.39 0.45 0.00 0.00 0.00 175.76 176.37 2ozk s SER 161 N -3.59 5.83 -0.91 0.00 0.15 0.25 -1.21 113.70 114.22 2ozk s SER 161 Ca 0.25 -1.93 -0.21 0.00 0.70 0.00 0.00 55.95 54.76 2ozk s SER 161 Cb 0.02 -2.06 0.09 0.00 -1.71 0.00 0.00 66.02 62.36 2ozk s SER 161 CO 0.16 -0.72 1.23 -0.69 1.20 0.00 0.00 173.24 174.42 2ozk s VAL 162 N 1.35 4.32 -0.91 4.45 1.01 -0.21 -1.85 120.40 128.57 2ozk s VAL 162 Ca 0.06 -0.99 -0.07 0.00 0.00 0.00 0.00 61.98 60.98 2ozk s VAL 162 Cb -0.26 -4.87 -0.01 0.00 0.00 0.00 0.00 36.38 31.23 2ozk s VAL 162 CO -0.00 -1.68 0.72 -3.20 0.00 0.00 0.00 175.10 170.94 2ozk n ASN 163 N 7.71 -6.22 0.00 3.32 4.05 -1.26 -3.04 115.26 119.83 2ozk n ASN 163 Ca 0.22 -0.64 0.00 0.00 0.45 0.00 0.00 54.58 54.61 2ozk n ASN 163 Cb 0.49 -3.78 0.00 0.00 1.23 0.00 0.00 39.78 37.72 2ozk n ASN 163 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2ozk n GLY 164 N -1.67 2.07 3.68 8.20 0.00 -1.26 -4.98 105.19 111.24 2ozk n GLY 164 Ca -0.12 -0.31 -0.45 0.00 0.00 0.00 0.00 46.02 45.15 2ozk n GLY 164 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ozk n VAL 165 N 0.00 0.18 -3.51 1.61 0.31 -1.17 -4.95 118.33 110.80 2ozk n VAL 165 Ca 0.00 -0.03 -0.38 0.00 -0.01 0.00 0.00 64.34 63.92 2ozk n VAL 165 Cb 0.00 -1.80 -0.06 0.00 -0.91 0.00 0.00 33.84 31.06 2ozk n VAL 165 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2ozk s THR 166 N 1.91 5.16 0.18 2.52 -4.23 -1.26 -1.05 115.64 118.87 2ozk s THR 166 Ca 0.81 0.74 -0.20 0.00 -1.18 0.00 0.00 61.69 61.86 2ozk s THR 166 Cb -0.61 -3.68 0.04 0.00 1.34 0.00 0.00 72.50 69.60 2ozk s THR 166 CO 0.39 0.50 0.55 -1.48 -0.54 0.00 0.00 174.62 174.04 2ozk s LEU 167 N -0.47 -0.15 -0.21 4.79 2.34 -0.35 -4.96 118.68 119.66 2ozk s LEU 167 Ca 0.22 -0.28 -0.08 0.00 0.06 0.00 0.00 54.13 54.05 2ozk s LEU 167 Cb -0.15 2.33 -0.04 0.00 -0.56 0.00 0.00 46.19 47.77 2ozk s LEU 167 CO 0.10 -1.02 0.08 -0.63 -1.06 0.00 0.00 176.35 173.82 2ozk s ILE 168 N -3.82 4.73 0.05 1.48 1.01 -1.26 -2.24 121.20 121.14 2ozk s ILE 168 Ca 0.05 -0.04 0.09 0.00 0.00 0.00 0.00 60.65 60.74 2ozk s ILE 168 Cb -0.01 -3.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.26 2ozk s ILE 168 CO -0.07 0.40 -0.24 -0.83 0.00 0.00 0.00 174.94 174.19 2ozk s GLY 169 N 0.91 1.46 -0.13 6.18 0.00 -1.26 -5.04 107.32 109.44 2ozk s GLY 169 Ca 0.04 -1.26 -0.24 0.00 0.00 0.00 0.00 44.72 43.26 2ozk s GLY 169 CO 0.03 -1.15 0.65 0.83 0.00 0.00 0.00 173.10 173.46 2ozk h GLU 170 N 4.67 0.00 0.00 2.90 3.07 -2.00 -3.43 114.58 119.79 2ozk h GLU 170 Ca -0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.39 2ozk h GLU 170 Cb 1.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.06 2ozk h GLU 170 CO 0.44 0.84 0.00 0.43 -1.40 0.00 0.00 179.01 179.33 2ozk n SER 171 N -4.64 0.00 -4.83 1.42 7.64 -1.26 -4.75 113.62 107.20 2ozk n SER 171 Ca -0.08 0.75 -0.33 0.00 1.01 0.00 0.00 58.87 60.21 2ozk n SER 171 Cb 0.40 -0.43 -0.06 0.00 -1.01 0.00 0.00 64.21 63.11 2ozk n SER 171 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2ozk s VAL 172 N -2.05 4.55 0.04 0.44 0.11 -1.26 -5.05 120.40 117.18 2ozk s VAL 172 Ca 0.00 1.21 -0.29 0.00 -2.93 0.00 0.00 61.98 59.96 2ozk s VAL 172 Cb 0.00 -3.65 -0.04 0.00 -1.53 0.00 0.00 36.38 31.16 2ozk s VAL 172 CO 0.00 -0.18 0.94 -0.75 -3.33 0.00 0.00 175.10 171.78 2ozk s LYS 173 N -2.92 4.60 -0.00 1.54 2.47 -1.26 -4.46 119.74 119.71 2ozk s LYS 173 Ca 0.56 1.37 0.05 0.00 -1.56 0.00 0.00 55.97 56.39 2ozk s LYS 173 Cb -0.11 -3.42 -0.05 0.00 -1.46 0.00 0.00 37.83 32.79 2ozk s LYS 173 CO 0.16 0.07 0.19 0.25 0.16 0.00 0.00 175.35 176.19 2ozk n THR 174 N 3.42 0.00 -3.19 3.43 -2.24 -1.26 -4.87 114.28 109.58 2ozk n THR 174 Ca 0.04 -0.37 -0.40 0.00 -2.27 0.00 0.00 64.05 61.05 2ozk n THR 174 Cb 0.50 0.96 -0.06 0.00 -2.10 0.00 0.00 70.33 69.63 2ozk n THR 174 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2ozk s GLN 175 N -1.51 4.20 0.49 -0.78 0.74 -1.26 -4.06 119.66 117.49 2ozk s GLN 175 Ca 0.02 0.51 0.06 0.00 0.05 0.00 0.00 55.36 55.99 2ozk s GLN 175 Cb 0.04 -3.57 0.00 0.00 1.10 0.00 0.00 33.01 30.58 2ozk s GLN 175 CO 0.19 -0.19 0.29 -0.06 -0.55 0.00 0.00 175.29 174.97 2ozk s PHE 176 N 1.77 2.01 -0.06 1.67 2.99 -1.26 -4.80 117.98 120.30 2ozk s PHE 176 Ca 0.26 -0.76 0.06 0.00 0.00 0.00 0.00 56.93 56.49 2ozk s PHE 176 Cb -0.16 -1.91 -0.01 0.00 0.00 0.00 0.00 43.02 40.94 2ozk s PHE 176 CO 0.10 -0.18 -0.23 -0.80 -0.00 0.00 0.00 175.22 174.11 2ozk s ASN 177 N -4.12 3.23 0.13 1.36 -0.87 -0.82 -0.99 114.94 112.85 2ozk s ASN 177 Ca 0.33 -0.46 0.04 0.00 -1.57 0.00 0.00 52.86 51.20 2ozk s ASN 177 Cb -0.00 -0.83 -0.04 0.00 -0.02 0.00 0.00 41.25 40.36 2ozk s ASN 177 CO 0.20 0.26 0.15 -0.31 -2.57 0.00 0.00 177.10 174.82 2ozk s TYR 178 N -0.25 3.24 0.01 2.20 1.51 -0.91 -2.62 117.35 120.53 2ozk s TYR 178 Ca -0.01 0.05 -0.02 0.00 -1.01 0.00 0.00 57.07 56.08 2ozk s TYR 178 Cb -0.13 -1.59 -0.01 0.00 -0.11 0.00 0.00 41.96 40.12 2ozk s TYR 178 CO 0.03 0.52 0.03 -0.06 -1.11 0.00 0.00 175.55 174.96 2ozk s PHE 179 N -1.62 0.14 0.05 2.71 0.40 -0.86 -3.20 117.98 115.60 2ozk s PHE 179 Ca 0.31 -0.29 0.03 0.00 -0.60 0.00 0.00 56.93 56.38 2ozk s PHE 179 Cb -0.11 -0.11 -0.03 0.00 0.51 0.00 0.00 43.02 43.28 2ozk s PHE 179 CO 0.24 -0.18 -0.09 0.21 0.70 0.00 0.00 175.22 176.11 2ozk s LYS 180 N -1.12 0.58 -0.03 0.44 2.20 -1.26 -1.68 119.74 118.88 2ozk s LYS 180 Ca -0.12 -0.82 0.01 0.00 -0.36 0.00 0.00 55.97 54.68 2ozk s LYS 180 Cb -0.07 -0.36 0.02 0.00 -1.51 0.00 0.00 37.83 35.90 2ozk s LYS 180 CO -0.00 0.07 -0.03 0.15 -0.36 0.00 0.00 175.35 175.17 2ozk s LYS 181 N -1.72 0.58 -0.09 4.03 1.02 -0.48 -0.30 119.74 122.79 2ozk s LYS 181 Ca -0.08 -0.07 0.03 0.00 0.02 0.00 0.00 55.97 55.87 2ozk s LYS 181 Cb -0.09 -0.63 -0.07 0.00 -0.52 0.00 0.00 37.83 36.52 2ozk s LYS 181 CO 0.00 -0.05 -0.05 0.28 -0.92 0.00 0.00 175.35 174.62 2ozk n VAL 182 N 3.80 0.53 -2.77 3.17 0.31 -0.66 -2.76 118.33 119.94 2ozk n VAL 182 Ca -0.23 -0.24 -0.06 0.00 -0.01 0.00 0.00 64.34 63.80 2ozk n VAL 182 Cb 0.52 -0.82 0.02 0.00 -0.91 0.00 0.00 33.84 32.65 2ozk n VAL 182 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2ozk n ASP 183 N -2.61 -3.21 0.00 4.52 10.43 -1.25 -4.74 116.55 119.68 2ozk n ASP 183 Ca -0.15 -3.03 0.00 0.00 2.57 0.00 0.00 54.79 54.18 2ozk n ASP 183 Cb 0.70 1.72 0.00 0.00 1.84 0.00 0.00 41.12 45.38 2ozk n ASP 183 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2ozk n GLY 184 N 2.53 1.99 3.74 0.44 0.00 -1.12 -4.99 105.19 107.78 2ozk n GLY 184 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 2ozk n GLY 184 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ozk s ILE 185 N 0.00 5.37 0.59 -0.61 1.01 -1.26 -5.04 121.20 121.25 2ozk s ILE 185 Ca 0.00 0.35 -0.20 0.00 0.00 0.00 0.00 60.65 60.80 2ozk s ILE 185 Cb 0.00 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 2ozk s ILE 185 CO 0.00 0.43 1.25 2.30 0.00 0.00 0.00 174.94 178.93 2ozk n ILE 186 N 3.42 4.16 -4.18 2.92 -6.64 -1.26 -1.66 119.36 116.12 2ozk n ILE 186 Ca -0.14 -0.50 -0.23 0.00 -1.77 0.00 0.00 62.75 60.10 2ozk n ILE 186 Cb 0.52 -1.49 -0.07 0.00 -1.44 0.00 0.00 39.64 37.16 2ozk n ILE 186 CO 0.00 0.00 0.00 -1.10 -1.77 0.00 0.00 176.55 173.68 2ozk s GLN 187 N -3.00 2.32 -0.33 6.28 -1.52 0.60 -4.89 119.66 119.12 2ozk s GLN 187 Ca 0.76 -1.55 -0.13 0.00 -1.95 0.00 0.00 55.36 52.49 2ozk s GLN 187 Cb -0.41 -2.14 -0.02 0.00 -0.22 0.00 0.00 33.01 30.22 2ozk s GLN 187 CO 0.46 0.17 0.23 -1.14 -0.25 0.00 0.00 175.29 174.76 2ozk s GLN 188 N -3.79 3.58 -0.04 2.91 2.00 -1.26 -4.70 119.66 118.35 2ozk s GLN 188 Ca 0.36 -0.58 -0.27 0.00 -2.00 0.00 0.00 55.36 52.87 2ozk s GLN 188 Cb -0.03 -3.78 -0.03 0.00 0.80 0.00 0.00 33.01 29.97 2ozk s GLN 188 CO 0.22 -0.40 0.84 -0.51 -0.50 0.00 0.00 175.29 174.94 2ozk s LEU 189 N 1.73 4.33 0.50 3.68 1.43 -1.26 -5.01 118.68 124.09 2ozk s LEU 189 Ca 0.06 1.41 -0.20 0.00 -1.03 0.00 0.00 54.13 54.37 2ozk s LEU 189 Cb -0.17 -3.33 -0.09 0.00 0.03 0.00 0.00 46.19 42.63 2ozk s LEU 189 CO 0.11 -0.20 0.70 -2.65 0.23 0.00 0.00 176.35 174.53 2ozk n PRO 190 N 3.92 0.76 -1.99 1.29 -0.02 -1.26 -4.92 135.00 132.77 2ozk n PRO 190 Ca 0.03 0.29 -0.41 0.00 -2.02 0.00 0.00 63.50 61.38 2ozk n PRO 190 Cb 0.51 -1.79 -0.02 0.00 -0.02 0.00 0.00 33.50 32.18 2ozk n PRO 190 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2ozk s GLU 191 N -2.04 4.26 0.12 -0.52 0.41 -1.26 -4.92 118.70 114.75 2ozk s GLU 191 Ca 0.67 2.35 -0.01 0.00 -0.41 0.00 0.00 54.97 57.57 2ozk s GLU 191 Cb -0.50 -3.04 -0.04 0.00 -1.78 0.00 0.00 34.13 28.76 2ozk s GLU 191 CO 0.55 -0.34 0.05 0.95 -0.49 0.00 0.00 175.26 175.97 2ozk s THR 192 N -0.91 0.11 0.35 3.63 -4.23 -1.26 -4.77 115.64 108.56 2ozk s THR 192 Ca 0.52 -1.90 0.07 0.00 -1.18 0.00 0.00 61.69 59.20 2ozk s THR 192 Cb -0.42 -2.00 -0.01 0.00 1.34 0.00 0.00 72.50 71.40 2ozk s THR 192 CO 0.54 -0.51 0.43 -0.31 -0.54 0.00 0.00 174.62 174.24 2ozk s TYR 193 N -4.04 3.00 -0.04 3.99 1.51 -1.08 -4.92 117.35 115.77 2ozk s TYR 193 Ca 0.23 -0.28 0.06 0.00 -1.01 0.00 0.00 57.07 56.07 2ozk s TYR 193 Cb 0.07 -2.01 -0.01 0.00 -0.11 0.00 0.00 41.96 39.91 2ozk s TYR 193 CO 0.01 -0.02 -0.22 -0.06 -1.11 0.00 0.00 175.55 174.15 2ozk s PHE 194 N -2.25 2.05 0.52 2.71 0.40 -1.26 -0.01 117.98 120.14 2ozk s PHE 194 Ca 0.45 -0.50 -0.21 0.00 -0.60 0.00 0.00 56.93 56.07 2ozk s PHE 194 Cb -0.08 -1.34 -0.06 0.00 0.51 0.00 0.00 43.02 42.05 2ozk s PHE 194 CO 0.30 -0.12 1.22 0.95 0.70 0.00 0.00 175.22 178.27 2ozk s THR 195 N -0.28 2.75 -2.31 0.64 -4.23 -1.26 -4.56 115.64 106.39 2ozk s THR 195 Ca 0.02 0.53 0.21 0.00 -1.18 0.00 0.00 61.69 61.27 2ozk s THR 195 Cb -0.11 -3.25 0.46 0.00 1.34 0.00 0.00 72.50 70.94 2ozk s THR 195 CO 0.01 -0.04 1.54 1.67 -0.54 0.00 0.00 174.62 177.27 2ozk n GLN 196 N -0.96 1.79 -4.14 3.99 -0.06 0.39 -4.95 117.38 113.44 2ozk n GLN 196 Ca 0.10 -1.18 -0.31 0.00 -2.00 0.00 0.00 57.00 53.61 2ozk n GLN 196 Cb 0.48 -1.41 -0.05 0.00 -4.06 0.00 0.00 30.24 25.20 2ozk n GLN 196 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 2ozk n SER 197 N 0.41 -0.22 -4.74 1.69 7.64 -1.26 -4.98 113.62 112.15 2ozk n SER 197 Ca 0.16 -1.17 -0.23 0.00 1.01 0.00 0.00 58.87 58.64 2ozk n SER 197 Cb 0.35 -2.19 -0.06 0.00 -1.01 0.00 0.00 64.21 61.31 2ozk n SER 197 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2ozk s ARG 198 N -7.04 2.63 0.46 1.43 0.52 -1.26 -5.03 118.95 110.66 2ozk s ARG 198 Ca 0.07 -1.21 0.06 0.00 -0.52 0.00 0.00 55.73 54.13 2ozk s ARG 198 Cb -0.03 -2.38 -0.03 0.00 0.52 0.00 0.00 34.95 33.03 2ozk s ARG 198 CO 0.95 0.39 0.18 -0.51 0.02 0.00 0.00 175.30 176.33 2ozk s ASP 199 N -3.72 4.37 -0.05 0.23 1.01 -1.26 -4.97 116.67 112.28 2ozk s ASP 199 Ca 0.32 -1.24 -0.01 0.00 0.71 0.00 0.00 52.55 52.33 2ozk s ASP 199 Cb -0.07 -0.11 -0.26 0.00 1.01 0.00 0.00 42.92 43.49 2ozk s ASP 199 CO 0.22 -0.71 0.64 0.25 0.21 0.00 0.00 175.17 175.79 2ozk h LEU 200 N 1.30 0.31 -1.39 1.23 5.85 -1.98 -2.82 115.31 117.81 2ozk h LEU 200 Ca -0.42 -0.56 0.37 0.00 0.84 0.00 0.00 57.88 58.11 2ozk h LEU 200 Cb 1.27 -0.10 -0.11 0.00 0.37 0.00 0.00 40.66 42.09 2ozk h LEU 200 CO 0.69 1.49 0.78 -0.33 -0.34 0.00 0.00 178.44 180.72 2ozk h GLU 201 N 0.05 0.19 0.00 1.25 3.07 -1.97 -3.00 114.58 114.18 2ozk h GLU 201 Ca -0.32 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.51 2ozk h GLU 201 Cb 2.02 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 29.84 2ozk h GLU 201 CO 0.12 0.13 -0.45 -0.40 -1.40 0.00 0.00 179.01 177.01 2ozk n ASP 202 N -4.67 0.85 -4.54 1.42 5.68 -1.25 -5.09 116.55 108.94 2ozk n ASP 202 Ca 0.33 -2.40 -0.51 0.00 -0.50 0.00 0.00 54.79 51.70 2ozk n ASP 202 Cb 1.22 -0.29 -0.07 0.00 -1.14 0.00 0.00 41.12 40.84 2ozk n ASP 202 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 2ozk n PHE 203 N -0.37 1.82 -3.91 2.11 7.35 -1.06 -4.90 117.46 118.50 2ozk n PHE 203 Ca 0.06 0.27 -0.36 0.00 -0.76 0.00 0.00 57.45 56.67 2ozk n PHE 203 Cb 0.75 -2.55 -0.11 0.00 0.35 0.00 0.00 39.48 37.92 2ozk n PHE 203 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 2ozk s LYS 204 N 5.35 3.81 0.13 -4.13 -0.14 -1.26 -5.08 119.74 118.42 2ozk s LYS 204 Ca 1.04 -0.41 -0.35 0.00 -1.36 0.00 0.00 55.97 54.89 2ozk s LYS 204 Cb -0.86 -3.27 -0.15 0.00 -1.68 0.00 0.00 37.83 31.87 2ozk s LYS 204 CO 0.52 0.04 1.50 -2.30 -0.76 0.00 0.00 175.35 174.36 2ozk n PRO 205 N 4.23 1.79 -0.04 -1.68 -0.02 -1.26 -4.94 135.00 133.08 2ozk n PRO 205 Ca -0.16 0.65 0.08 0.00 -2.02 0.00 0.00 63.50 62.04 2ozk n PRO 205 Cb 0.52 -2.37 0.09 0.00 -0.02 0.00 0.00 33.50 31.71 2ozk n PRO 205 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2ozk n ARG 206 N 3.15 1.39 -4.00 -0.52 1.74 -1.26 -4.94 116.66 112.21 2ozk n ARG 206 Ca 0.18 -1.54 -0.10 0.00 -0.77 0.00 0.00 57.85 55.62 2ozk n ARG 206 Cb 0.25 -1.30 -0.05 0.00 -1.02 0.00 0.00 32.46 30.34 2ozk n ARG 206 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2ozk s SER 207 N -1.22 0.05 0.10 0.55 1.04 -1.26 -5.02 113.70 107.94 2ozk s SER 207 Ca 0.20 -1.02 -0.21 0.00 0.48 0.00 0.00 55.95 55.40 2ozk s SER 207 Cb 0.13 0.61 -0.11 0.00 0.10 0.00 0.00 66.02 66.75 2ozk s SER 207 CO 0.19 -1.19 1.75 -0.61 0.98 0.00 0.00 173.24 174.37 2ozk h GLN 208 N 2.23 0.14 -0.57 4.02 5.75 -1.99 0.37 115.11 125.06 2ozk h GLN 208 Ca -0.27 -0.01 0.06 0.00 -0.15 0.00 0.00 58.65 58.28 2ozk h GLN 208 Cb 1.25 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 29.71 2ozk h GLN 208 CO 0.36 0.10 0.27 1.98 -2.65 0.00 0.00 178.83 178.90 2ozk h MET 209 N 0.14 0.49 0.02 1.69 4.05 -1.99 0.61 114.93 119.93 2ozk h MET 209 Ca 0.04 -0.03 0.01 0.00 -0.28 0.00 0.00 59.70 59.44 2ozk h MET 209 Cb -0.01 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 30.67 2ozk h MET 209 CO -0.01 0.33 -0.07 1.49 0.23 0.00 0.00 176.91 178.88 2ozk h GLU 210 N 0.51 -0.12 0.07 0.39 4.81 -1.87 0.14 114.58 118.51 2ozk h GLU 210 Ca 0.26 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.52 2ozk h GLU 210 Cb 0.21 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.57 2ozk h GLU 210 CO -0.20 -0.08 -0.39 1.15 -0.73 0.00 0.00 179.01 178.76 2ozk h THR 211 N -0.12 0.20 -0.27 0.32 2.02 -0.30 -2.29 112.91 112.47 2ozk h THR 211 Ca 0.02 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.25 2ozk h THR 211 Cb 0.15 0.20 -0.08 0.00 -1.74 0.00 0.00 68.15 66.69 2ozk h THR 211 CO -0.06 0.00 -0.46 0.44 0.37 0.00 0.00 175.52 175.82 2ozk h ASP 212 N -0.59 -1.47 -0.75 4.18 5.19 -0.55 0.12 116.42 122.55 2ozk h ASP 212 Ca 0.04 0.20 0.17 0.00 -0.62 0.00 0.00 57.03 56.82 2ozk h ASP 212 Cb 0.64 0.61 -0.13 0.00 0.18 0.00 0.00 39.33 40.63 2ozk h ASP 212 CO -0.26 -0.41 -0.01 0.15 -3.12 0.00 0.00 179.24 175.60 2ozk h PHE 213 N -0.43 -0.08 -0.14 4.55 3.57 -0.36 1.32 116.94 125.37 2ozk h PHE 213 Ca 0.09 0.06 -0.14 0.00 3.53 0.00 0.00 57.97 61.51 2ozk h PHE 213 Cb 0.62 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.50 2ozk h PHE 213 CO -0.58 -0.25 -0.53 -0.07 -2.23 0.00 0.00 178.31 174.65 2ozk h LEU 214 N 0.09 0.45 0.09 0.59 3.38 -0.91 -3.34 115.31 115.66 2ozk h LEU 214 Ca 0.41 -0.23 -0.14 0.00 0.09 0.00 0.00 57.88 58.01 2ozk h LEU 214 Cb 0.71 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 41.35 2ozk h LEU 214 CO -0.67 0.89 -0.59 -0.08 0.09 0.00 0.00 178.44 178.08 2ozk h GLU 215 N 0.32 0.24 -7.43 1.13 4.57 0.23 -3.48 114.58 110.16 2ozk h GLU 215 Ca 0.01 -0.38 -0.46 0.00 -1.18 0.00 0.00 59.36 57.35 2ozk h GLU 215 Cb 1.03 0.14 0.12 0.00 -0.16 0.00 0.00 28.75 29.88 2ozk h GLU 215 CO 0.09 1.16 0.25 -0.51 -1.18 0.00 0.00 179.01 178.82 2ozk s LEU 216 N -8.04 2.86 -0.03 1.64 1.43 0.41 -5.06 118.68 111.90 2ozk s LEU 216 Ca -0.15 -0.17 -0.03 0.00 -1.03 0.00 0.00 54.13 52.75 2ozk s LEU 216 Cb 0.00 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 2ozk s LEU 216 CO 0.80 -2.32 0.15 0.00 0.23 0.00 0.00 176.35 175.21 2ozk s ALA 217 N -3.49 3.87 0.19 4.21 0.00 -1.26 -4.88 121.76 120.39 2ozk s ALA 217 Ca 0.71 -0.76 -0.15 0.00 0.00 0.00 0.00 51.96 51.76 2ozk s ALA 217 Cb -0.04 -1.84 0.19 0.00 0.00 0.00 0.00 23.12 21.43 2ozk s ALA 217 CO 0.49 0.71 1.28 -0.12 0.00 0.00 0.00 175.76 178.12 2ozk n MET 218 N 1.18 -0.20 0.01 0.00 1.56 -1.26 -1.34 117.12 117.06 2ozk n MET 218 Ca -0.13 1.27 -0.13 0.00 -0.27 0.00 0.00 57.70 58.44 2ozk n MET 218 Cb 0.53 -1.88 -0.09 0.00 2.15 0.00 0.00 33.22 33.93 2ozk n MET 218 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 2ozk h ASP 219 N 0.00 -0.00 -0.89 6.12 5.19 -1.99 0.19 116.42 125.03 2ozk h ASP 219 Ca 0.28 -0.33 0.20 0.00 -0.62 0.00 0.00 57.03 56.56 2ozk h ASP 219 Cb 0.49 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.93 2ozk h ASP 219 CO -0.82 0.33 0.59 -0.08 -3.12 0.00 0.00 179.24 176.15 2ozk h GLU 220 N -0.34 0.37 0.32 3.56 4.57 -1.70 -0.68 114.58 120.67 2ozk h GLU 220 Ca -0.00 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.14 2ozk h GLU 220 Cb 0.34 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 2ozk h GLU 220 CO 0.00 0.25 -0.15 0.35 -1.18 0.00 0.00 179.01 178.28 2ozk h PHE 221 N 0.39 -0.39 -0.98 0.92 3.57 -0.03 -1.69 116.94 118.72 2ozk h PHE 221 Ca 0.46 -0.01 0.31 0.00 3.53 0.00 0.00 57.97 62.27 2ozk h PHE 221 Cb 1.18 0.13 -0.15 0.00 2.79 0.00 0.00 35.95 39.90 2ozk h PHE 221 CO -0.00 -0.25 0.50 0.82 -2.23 0.00 0.00 178.31 177.15 2ozk h ILE 222 N -0.75 0.28 0.40 1.41 2.04 -0.90 0.90 117.51 120.89 2ozk h ILE 222 Ca -0.04 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.71 2ozk h ILE 222 Cb 0.33 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 2ozk h ILE 222 CO 0.07 0.05 -0.29 -0.61 0.00 0.00 0.00 178.15 177.37 2ozk h GLN 223 N 0.28 -0.63 -0.95 2.37 -0.00 -1.16 -0.86 115.11 114.16 2ozk h GLN 223 Ca 0.71 0.04 0.16 0.00 -0.00 0.00 0.00 58.65 59.56 2ozk h GLN 223 Cb 1.60 0.14 -0.08 0.00 0.00 0.00 0.00 27.48 29.14 2ozk h GLN 223 CO -0.63 -0.42 0.60 -0.09 0.00 0.00 0.00 178.83 178.29 2ozk h ARG 224 N -0.66 0.72 -0.38 1.69 9.65 0.12 -2.03 114.38 123.49 2ozk h ARG 224 Ca -0.05 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.78 2ozk h ARG 224 Cb 0.54 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.96 2ozk h ARG 224 CO 0.03 0.47 0.00 0.66 2.80 0.00 0.00 179.97 183.93 2ozk n TYR 225 N -4.63 0.49 -2.94 2.20 4.02 -0.52 -4.99 117.16 110.80 2ozk n TYR 225 Ca 0.20 -0.25 -0.07 0.00 -0.01 0.00 0.00 57.90 57.78 2ozk n TYR 225 Cb 0.51 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.84 2ozk n TYR 225 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2ozk n LYS 226 N 1.25 -2.06 -0.21 -0.72 5.02 -0.76 -4.99 118.16 115.69 2ozk n LYS 226 Ca 0.19 1.91 0.02 0.00 -2.02 0.00 0.00 58.31 58.41 2ozk n LYS 226 Cb 0.54 -5.58 0.02 0.00 -0.02 0.00 0.00 35.03 30.00 2ozk n LYS 226 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2ozk n LEU 227 N -0.75 0.63 -4.65 -0.35 4.77 -0.40 -5.05 117.00 111.20 2ozk n LEU 227 Ca 0.07 -1.13 -0.48 0.00 -0.03 0.00 0.00 56.01 54.44 2ozk n LEU 227 Cb 0.48 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.46 2ozk n LEU 227 CO 0.50 0.27 1.14 -0.62 -1.33 0.00 0.00 177.39 177.35 2ozk n GLU 228 N -0.29 1.91 -3.29 3.23 4.71 -1.26 -2.29 120.64 123.36 2ozk n GLU 228 Ca 0.03 0.69 -0.18 0.00 -0.01 0.00 0.00 57.16 57.68 2ozk n GLU 228 Cb 0.57 -2.43 0.06 0.00 -1.01 0.00 0.00 31.44 28.62 2ozk n GLU 228 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2ozk n GLY 229 N 3.26 -0.19 0.04 0.62 0.00 -1.26 -4.90 105.19 102.75 2ozk n GLY 229 Ca 0.18 0.02 0.05 0.00 0.00 0.00 0.00 46.02 46.27 2ozk n GLY 229 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ozk n TYR 230 N -4.40 0.00 -3.19 1.61 4.01 -0.97 -4.99 117.16 109.24 2ozk n TYR 230 Ca -0.00 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.59 2ozk n TYR 230 Cb 0.55 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.64 2ozk n TYR 230 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2ozk n ALA 231 N -1.12 -1.05 0.10 -0.72 0.00 -1.26 -4.98 120.51 111.47 2ozk n ALA 231 Ca 0.02 0.19 -0.04 0.00 0.00 0.00 0.00 53.44 53.62 2ozk n ALA 231 Cb 0.18 -3.39 -0.02 0.00 0.00 0.00 0.00 19.45 16.22 2ozk n ALA 231 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2ozk h PHE 232 N -1.73 -0.23 -1.16 0.00 3.57 -1.94 -2.60 116.94 112.85 2ozk h PHE 232 Ca -0.40 -0.01 0.43 0.00 3.53 0.00 0.00 57.97 61.52 2ozk h PHE 232 Cb 1.25 0.08 -0.14 0.00 2.79 0.00 0.00 35.95 39.93 2ozk h PHE 232 CO 0.34 -0.15 0.71 -1.91 -2.23 0.00 0.00 178.31 175.07 2ozk n GLU 233 N -2.71 -0.04 -0.08 1.11 2.13 -1.26 0.04 120.64 119.84 2ozk n GLU 233 Ca -0.03 1.21 -0.10 0.00 0.66 0.00 0.00 57.16 58.90 2ozk n GLU 233 Cb 0.10 -2.30 -0.03 0.00 0.27 0.00 0.00 31.44 29.48 2ozk n GLU 233 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2ozk h HIS 234 N 0.00 0.37 0.02 4.31 2.76 -1.86 -3.26 115.15 117.48 2ozk h HIS 234 Ca 0.81 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.96 2ozk h HIS 234 Cb 2.45 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 31.30 2ozk h HIS 234 CO -0.01 0.34 -0.01 0.82 -1.30 0.00 0.00 177.93 177.77 2ozk h ILE 235 N 0.29 0.19 -0.97 6.26 2.04 -0.16 -1.18 117.51 123.98 2ozk h ILE 235 Ca 0.09 -1.12 0.30 0.00 1.00 0.00 0.00 64.86 65.14 2ozk h ILE 235 Cb 0.10 0.35 -0.17 0.00 -0.74 0.00 0.00 36.82 36.36 2ozk h ILE 235 CO -0.01 0.06 0.24 -0.37 0.00 0.00 0.00 178.15 178.07 2ozk h VAL 236 N -1.00 0.10 0.00 1.67 -1.51 -1.65 0.63 116.25 114.48 2ozk h VAL 236 Ca -0.00 -0.02 -0.01 0.00 -1.23 0.00 0.00 66.70 65.43 2ozk h VAL 236 Cb 0.12 0.02 -0.00 0.00 -2.13 0.00 0.00 31.29 29.30 2ozk h VAL 236 CO 0.00 0.01 -0.89 1.88 -1.23 0.00 0.00 177.57 177.35 2ozk h TYR 237 N 0.07 0.00 -4.61 5.19 0.05 -1.69 -3.39 116.97 112.58 2ozk h TYR 237 Ca 0.66 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 59.09 2ozk h TYR 237 Cb 1.50 0.00 0.08 0.00 1.01 0.00 0.00 36.73 39.32 2ozk h TYR 237 CO -0.29 0.04 0.15 0.41 -1.05 0.00 0.00 178.16 177.43 2ozk n GLY 238 N 1.18 0.13 3.54 3.88 0.00 0.22 -4.98 105.19 109.16 2ozk n GLY 238 Ca -0.00 -1.93 -0.41 0.00 0.00 0.00 0.00 46.02 43.68 2ozk n GLY 238 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ozk s ASP 239 N -4.31 6.12 -0.24 1.61 3.68 -1.26 -4.56 116.67 117.72 2ozk s ASP 239 Ca 0.53 -0.34 0.14 0.00 2.13 0.00 0.00 52.55 55.01 2ozk s ASP 239 Cb -0.03 -2.17 0.61 0.00 -1.45 0.00 0.00 42.92 39.88 2ozk s ASP 239 CO 0.36 -0.30 1.55 2.22 0.13 0.00 0.00 175.17 179.14 2ozk n PHE 240 N 5.26 1.44 -1.73 -5.34 1.16 -0.74 -4.84 117.46 112.66 2ozk n PHE 240 Ca -0.11 -1.06 -0.42 0.00 -1.87 0.00 0.00 57.45 54.00 2ozk n PHE 240 Cb 0.49 -0.45 -0.02 0.00 -1.61 0.00 0.00 39.48 37.89 2ozk n PHE 240 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 2ozk n SER 241 N -0.42 3.87 -3.99 5.98 3.41 -1.26 0.05 113.62 121.26 2ozk n SER 241 Ca 0.29 1.11 -0.41 0.00 -0.26 0.00 0.00 58.87 59.59 2ozk n SER 241 Cb 1.06 -1.58 -0.00 0.00 -0.26 0.00 0.00 64.21 63.43 2ozk n SER 241 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2ozk n HIS 242 N 2.89 2.92 0.00 7.33 -0.00 -1.25 -4.32 115.22 122.79 2ozk n HIS 242 Ca 0.12 -3.01 0.00 0.00 0.46 0.00 0.00 57.72 55.29 2ozk n HIS 242 Cb 0.36 -1.24 0.00 0.00 -0.12 0.00 0.00 29.99 28.99 2ozk n HIS 242 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2ozk n GLY 243 N 1.50 3.22 3.70 1.57 0.00 -1.26 -4.94 105.19 108.98 2ozk n GLY 243 Ca 0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.95 2ozk n GLY 243 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ozk s GLN 244 N -0.75 1.60 -0.05 1.61 0.00 -1.26 -4.89 119.66 115.92 2ozk s GLN 244 Ca 0.00 1.67 -0.30 0.00 -0.00 0.00 0.00 55.36 56.74 2ozk s GLN 244 Cb 0.00 -1.78 -0.03 0.00 0.00 0.00 0.00 33.01 31.20 2ozk s GLN 244 CO 0.00 -2.22 1.04 -1.17 0.00 0.00 0.00 175.29 172.94 2ozk s LEU 245 N -5.85 4.31 0.30 2.60 1.98 -1.26 -4.60 118.68 116.15 2ozk s LEU 245 Ca 0.71 1.66 0.00 0.00 -2.89 0.00 0.00 54.13 53.61 2ozk s LEU 245 Cb -0.27 -3.56 0.00 0.00 0.66 0.00 0.00 46.19 43.02 2ozk s LEU 245 CO 0.52 -0.40 0.00 0.61 -1.89 0.00 0.00 176.35 175.18 2ozk n GLY 246 N 3.08 -1.97 3.49 7.98 0.00 -1.24 -3.22 105.19 113.30 2ozk n GLY 246 Ca 0.08 -1.22 -0.32 0.00 0.00 0.00 0.00 46.02 44.56 2ozk n GLY 246 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ozk n GLY 247 N -3.64 -1.53 3.37 -0.02 0.00 -1.26 -4.44 105.19 97.66 2ozk n GLY 247 Ca -0.00 -0.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.79 2ozk n GLY 247 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ozk s LEU 248 N -3.87 5.09 0.27 0.99 0.20 -1.26 -0.69 118.68 119.42 2ozk s LEU 248 Ca 0.62 -1.18 0.08 0.00 0.69 0.00 0.00 54.13 54.34 2ozk s LEU 248 Cb -0.21 -2.07 -0.04 0.00 -0.43 0.00 0.00 46.19 43.44 2ozk s LEU 248 CO 0.64 -0.49 0.15 -1.00 -0.29 0.00 0.00 176.35 175.35 2ozk s HIS 249 N 1.56 2.93 -0.12 5.38 3.76 -0.11 -1.80 115.29 126.90 2ozk s HIS 249 Ca 0.03 -0.19 -0.02 0.00 -0.15 0.00 0.00 55.06 54.73 2ozk s HIS 249 Cb -0.21 -1.42 -0.03 0.00 1.11 0.00 0.00 32.58 32.03 2ozk s HIS 249 CO 0.06 0.49 -0.04 -1.17 -0.85 0.00 0.00 174.74 173.23 2ozk s LEU 250 N -3.82 3.26 0.11 0.89 2.96 -1.26 -1.88 118.68 118.95 2ozk s LEU 250 Ca 0.34 -0.07 -0.26 0.00 -0.22 0.00 0.00 54.13 53.92 2ozk s LEU 250 Cb -0.07 -1.76 -0.08 0.00 0.50 0.00 0.00 46.19 44.79 2ozk s LEU 250 CO 0.24 0.25 1.65 -0.03 -1.32 0.00 0.00 176.35 177.13 2ozk h MET 251 N 6.13 -0.37 -0.44 1.98 1.85 -1.76 -0.37 114.93 121.94 2ozk h MET 251 Ca -0.38 0.03 0.11 0.00 -0.61 0.00 0.00 59.70 58.84 2ozk h MET 251 Cb 1.19 0.08 -0.02 0.00 0.43 0.00 0.00 31.60 33.28 2ozk h MET 251 CO 0.59 -0.25 0.31 0.97 -0.40 0.00 0.00 176.91 178.13 2ozk h ILE 252 N -0.38 0.83 -0.10 1.77 6.09 -1.85 0.34 117.51 124.21 2ozk h ILE 252 Ca 0.04 -0.04 -0.17 0.00 -1.37 0.00 0.00 64.86 63.32 2ozk h ILE 252 Cb 0.43 0.71 -0.01 0.00 0.47 0.00 0.00 36.82 38.42 2ozk h ILE 252 CO -0.15 0.02 -0.67 1.23 -3.07 0.00 0.00 178.15 175.51 2ozk h GLY 253 N 0.11 0.43 1.75 8.18 0.00 -1.38 -2.32 103.07 109.86 2ozk h GLY 253 Ca 0.21 -0.58 -0.11 0.00 0.00 0.00 0.00 47.33 46.85 2ozk h GLY 253 CO -0.02 0.52 -0.43 1.41 0.00 0.00 0.00 176.54 178.02 2ozk h LEU 254 N 0.28 0.29 -0.84 3.11 4.07 0.73 -3.15 115.31 119.80 2ozk h LEU 254 Ca -0.02 -0.12 -0.11 0.00 0.08 0.00 0.00 57.88 57.71 2ozk h LEU 254 Cb 1.22 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.87 2ozk h LEU 254 CO 0.11 0.69 -0.31 0.00 -1.08 0.00 0.00 178.44 177.85 2ozk h ALA 255 N 1.33 1.01 -0.32 1.53 0.00 -0.26 -2.99 119.26 119.56 2ozk h ALA 255 Ca 0.02 -0.38 -0.16 0.00 0.00 0.00 0.00 54.91 54.39 2ozk h ALA 255 Cb 0.85 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2ozk h ALA 255 CO 0.07 0.59 -0.43 -0.22 0.00 0.00 0.00 179.25 179.27 2ozk h LYS 256 N 0.43 0.81 -3.41 0.00 3.64 -1.39 -3.16 116.57 113.48 2ozk h LYS 256 Ca 0.05 -0.44 -0.59 0.00 -1.27 0.00 0.00 60.65 58.40 2ozk h LYS 256 Cb 0.76 0.02 0.02 0.00 -0.41 0.00 0.00 32.23 32.62 2ozk h LYS 256 CO 0.06 1.07 3.27 0.54 -2.27 0.00 0.00 179.45 182.12 2ozk n ARG 257 N -4.03 2.93 0.00 1.90 1.74 -1.13 -3.93 116.66 114.14 2ozk n ARG 257 Ca -0.02 -2.03 0.00 0.00 -0.77 0.00 0.00 57.85 55.03 2ozk n ARG 257 Cb 0.56 -2.79 0.00 0.00 -1.02 0.00 0.00 32.46 29.20 2ozk n ARG 257 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2ozk n SER 258 N 4.50 0.00 0.03 0.55 7.64 -1.19 -4.69 113.62 120.46 2ozk n SER 258 Ca 0.62 -1.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.32 2ozk n SER 258 Cb 0.24 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.36 2ozk n SER 258 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2ozk h GLN 259 N 0.00 0.69 0.00 1.43 7.50 -1.83 -3.39 115.11 119.52 2ozk h GLN 259 Ca 0.00 -0.68 -0.17 0.00 0.50 0.00 0.00 58.65 58.30 2ozk h GLN 259 Cb 0.59 0.18 0.09 0.00 0.05 0.00 0.00 27.48 28.39 2ozk h GLN 259 CO 0.00 1.28 0.02 -0.40 -1.50 0.00 0.00 178.83 178.22 2ozk n ASP 260 N -3.86 -1.87 -4.62 1.46 5.75 -1.26 -4.87 116.55 107.27 2ozk n ASP 260 Ca -0.09 -0.68 -0.47 0.00 -0.01 0.00 0.00 54.79 53.53 2ozk n ASP 260 Cb 0.84 -0.44 -0.05 0.00 -1.03 0.00 0.00 41.12 40.44 2ozk n ASP 260 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2ozk n SER 261 N -3.93 3.23 -4.85 -1.12 2.88 -1.26 -4.93 113.62 103.64 2ozk n SER 261 Ca 0.06 0.70 -0.24 0.00 -1.33 0.00 0.00 58.87 58.07 2ozk n SER 261 Cb 0.26 -1.40 0.07 0.00 -0.75 0.00 0.00 64.21 62.39 2ozk n SER 261 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2ozk s PRO 262 N 5.00 2.13 -0.03 -1.46 0.05 -1.26 -4.78 135.00 134.65 2ozk s PRO 262 Ca 0.97 -0.62 0.06 0.00 0.05 0.00 0.00 61.00 61.46 2ozk s PRO 262 Cb -0.63 -2.30 -0.02 0.00 0.05 0.00 0.00 34.50 31.60 2ozk s PRO 262 CO 0.47 -1.16 -0.21 -0.51 0.05 0.00 0.00 177.00 175.64 2ozk s LEU 263 N -5.09 2.32 0.03 -3.56 1.43 -1.26 -1.31 118.68 111.24 2ozk s LEU 263 Ca 0.61 -0.36 -0.19 0.00 -1.03 0.00 0.00 54.13 53.15 2ozk s LEU 263 Cb -0.09 -1.42 -0.06 0.00 0.03 0.00 0.00 46.19 44.64 2ozk s LEU 263 CO 0.43 0.33 0.56 -0.75 0.23 0.00 0.00 176.35 177.15 2ozk s LYS 264 N -0.65 4.23 0.39 1.70 2.20 -0.12 -4.73 119.74 122.77 2ozk s LYS 264 Ca 0.10 0.70 0.08 0.00 -0.36 0.00 0.00 55.97 56.49 2ozk s LYS 264 Cb -0.10 -3.29 -0.02 0.00 -1.51 0.00 0.00 37.83 32.91 2ozk s LYS 264 CO -0.00 0.52 0.38 -0.51 -0.36 0.00 0.00 175.35 175.38 2ozk s LEU 265 N -0.68 3.50 -0.30 5.43 1.02 -1.26 -2.36 118.68 124.03 2ozk s LEU 265 Ca 0.29 -0.62 -0.15 0.00 0.02 0.00 0.00 54.13 53.67 2ozk s LEU 265 Cb -0.19 -2.20 0.16 0.00 0.02 0.00 0.00 46.19 43.99 2ozk s LEU 265 CO 0.17 -0.57 0.98 -0.70 0.02 0.00 0.00 176.35 176.25 2ozk s GLU 266 N -4.12 0.32 0.01 1.70 2.12 -1.18 -4.93 118.70 112.62 2ozk s GLU 266 Ca 0.47 0.73 -0.34 0.00 0.36 0.00 0.00 54.97 56.18 2ozk s GLU 266 Cb -0.05 0.36 -0.13 0.00 0.26 0.00 0.00 34.13 34.58 2ozk s GLU 266 CO 0.28 -0.10 1.76 -0.25 -0.54 0.00 0.00 175.26 176.41 2ozk n ASP 267 N 4.67 3.27 0.08 -1.70 10.43 -1.26 -1.21 116.55 130.83 2ozk n ASP 267 Ca -0.11 1.02 -0.12 0.00 2.57 0.00 0.00 54.79 58.14 2ozk n ASP 267 Cb 0.54 -1.39 -0.08 0.00 1.84 0.00 0.00 41.12 42.03 2ozk n ASP 267 CO 0.00 0.00 0.00 0.15 -1.07 0.00 0.00 177.20 176.28 2ozk h PHE 268 N 7.87 -0.23 -3.68 1.24 3.57 -1.73 -3.44 116.94 120.54 2ozk h PHE 268 Ca -0.47 -0.01 -0.67 0.00 3.53 0.00 0.00 57.97 60.35 2ozk h PHE 268 Cb 1.27 0.08 -0.18 0.00 2.79 0.00 0.00 35.95 39.91 2ozk h PHE 268 CO 0.78 0.18 -0.76 0.96 -2.23 0.00 0.00 178.31 177.24 2ozk s ILE 269 N -4.06 3.18 0.18 1.41 -4.36 -1.26 -5.06 121.20 111.24 2ozk s ILE 269 Ca -0.14 -1.24 -0.13 0.00 -0.26 0.00 0.00 60.65 58.88 2ozk s ILE 269 Cb 0.01 -2.44 0.09 0.00 1.25 0.00 0.00 42.46 41.37 2ozk s ILE 269 CO 0.54 0.19 1.81 1.55 0.24 0.00 0.00 174.94 179.27 2ozk h PRO 270 N 3.92 0.62 -6.20 0.37 0.13 -1.91 -3.45 132.00 125.47 2ozk h PRO 270 Ca -0.49 -0.04 -0.67 0.00 -0.87 0.00 0.00 66.00 63.94 2ozk h PRO 270 Cb 1.16 -0.14 0.09 0.00 0.13 0.00 0.00 31.00 32.24 2ozk h PRO 270 CO 0.50 0.41 -0.03 -0.12 -0.23 0.00 0.00 178.00 178.53 2ozk n MET 271 N -4.79 0.66 -3.26 0.86 0.00 -1.26 -4.44 117.12 104.89 2ozk n MET 271 Ca 0.05 0.23 -0.37 0.00 0.00 0.00 0.00 57.70 57.61 2ozk n MET 271 Cb 0.09 -1.56 -0.06 0.00 0.00 0.00 0.00 33.22 31.70 2ozk n MET 271 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2ozk s ASP 272 N -0.40 7.00 0.27 6.12 2.15 -1.26 -5.02 116.67 125.53 2ozk s ASP 272 Ca 0.71 1.24 -0.21 0.00 0.43 0.00 0.00 52.55 54.72 2ozk s ASP 272 Cb -0.91 -2.35 0.02 0.00 -0.30 0.00 0.00 42.92 39.38 2ozk s ASP 272 CO 0.55 0.18 0.70 -0.94 -0.17 0.00 0.00 175.17 175.49 2ozk s SER 273 N -1.40 -0.27 0.01 -0.34 1.04 -1.26 -4.37 113.70 107.11 2ozk s SER 273 Ca 0.34 -0.58 -0.24 0.00 0.48 0.00 0.00 55.95 55.95 2ozk s SER 273 Cb -0.18 0.71 -0.18 0.00 0.10 0.00 0.00 66.02 66.48 2ozk s SER 273 CO 0.20 -1.31 1.37 0.74 0.98 0.00 0.00 173.24 175.21 2ozk h THR 274 N 2.01 1.31 -3.18 2.02 2.02 -1.97 -3.40 112.91 111.73 2ozk h THR 274 Ca -0.20 -0.95 -0.59 0.00 0.77 0.00 0.00 66.41 65.44 2ozk h THR 274 Cb 1.25 1.89 -0.07 0.00 -1.74 0.00 0.00 68.15 69.48 2ozk h THR 274 CO 0.25 0.25 -0.18 -0.69 0.37 0.00 0.00 175.52 175.52 2ozk s VAL 275 N -4.64 5.10 -0.07 3.16 1.01 -1.26 -4.60 120.40 119.10 2ozk s VAL 275 Ca -0.15 0.88 0.02 0.00 0.00 0.00 0.00 61.98 62.73 2ozk s VAL 275 Cb 0.03 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.67 2ozk s VAL 275 CO 0.68 0.46 -0.12 -0.75 0.00 0.00 0.00 175.10 175.37 2ozk s LYS 276 N -0.26 1.68 0.20 2.72 2.36 -0.88 -4.98 119.74 120.58 2ozk s LYS 276 Ca 0.24 -0.40 -0.30 0.00 -2.55 0.00 0.00 55.97 52.96 2ozk s LYS 276 Cb -0.16 -1.39 -0.08 0.00 -1.05 0.00 0.00 37.83 35.15 2ozk s LYS 276 CO 0.12 0.02 0.94 -0.80 1.55 0.00 0.00 175.35 177.18 2ozk s ASN 277 N 0.68 7.61 0.11 1.43 0.01 -1.26 -1.71 114.94 121.81 2ozk s ASN 277 Ca -0.14 1.90 0.02 0.00 -0.71 0.00 0.00 52.86 53.93 2ozk s ASN 277 Cb -0.16 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 38.86 2ozk s ASN 277 CO 0.04 0.10 -0.05 -0.31 -1.51 0.00 0.00 177.10 175.37 2ozk s TYR 278 N -0.86 0.96 -0.44 2.20 1.51 -0.19 -2.04 117.35 118.48 2ozk s TYR 278 Ca 0.42 -0.95 -0.22 0.00 -1.01 0.00 0.00 57.07 55.32 2ozk s TYR 278 Cb -0.25 -0.55 0.02 0.00 -0.11 0.00 0.00 41.96 41.07 2ozk s TYR 278 CO 0.31 -0.17 0.71 -0.06 -1.11 0.00 0.00 175.55 175.23 2ozk s PHE 279 N -3.64 3.03 -0.14 2.71 0.40 -0.35 -2.26 117.98 117.73 2ozk s PHE 279 Ca 0.15 0.05 -0.16 0.00 -0.60 0.00 0.00 56.93 56.36 2ozk s PHE 279 Cb 0.05 -3.50 -0.04 0.00 0.51 0.00 0.00 43.02 40.04 2ozk s PHE 279 CO -0.03 -0.93 0.40 0.42 0.70 0.00 0.00 175.22 175.78 2ozk s ILE 280 N 3.04 5.24 0.03 0.64 1.01 -0.14 -3.09 121.20 127.94 2ozk s ILE 280 Ca 0.26 0.77 -0.03 0.00 0.00 0.00 0.00 60.65 61.66 2ozk s ILE 280 Cb -0.13 -3.74 -0.02 0.00 0.01 0.00 0.00 42.46 38.58 2ozk s ILE 280 CO 0.21 0.36 0.03 0.42 0.00 0.00 0.00 174.94 175.96 2ozk s THR 281 N 0.54 0.14 0.34 2.92 -4.23 -0.99 -2.06 115.64 112.29 2ozk s THR 281 Ca 0.22 -1.17 -0.29 0.00 -1.18 0.00 0.00 61.69 59.27 2ozk s THR 281 Cb -0.14 -0.81 -0.11 0.00 1.34 0.00 0.00 72.50 72.78 2ozk s THR 281 CO 0.07 -0.64 1.50 -0.62 -0.54 0.00 0.00 174.62 174.40 2ozk s ASP 282 N -2.05 6.41 0.00 3.99 -1.08 0.06 -0.94 116.67 123.06 2ozk s ASP 282 Ca -0.06 2.96 -0.24 0.00 -0.52 0.00 0.00 52.55 54.68 2ozk s ASP 282 Cb -0.02 -2.65 -0.14 0.00 -1.46 0.00 0.00 42.92 38.64 2ozk s ASP 282 CO -0.04 -0.85 1.06 0.00 0.52 0.00 0.00 175.17 175.86 2ozk h ALA 283 N 3.79 -0.72 -0.60 3.66 0.00 -1.49 -0.42 119.26 123.49 2ozk h ALA 283 Ca -0.49 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 54.36 2ozk h ALA 283 Cb 1.23 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 19.26 2ozk h ALA 283 CO 0.70 -0.72 0.41 0.37 0.00 0.00 0.00 179.25 180.01 2ozk h GLN 284 N -1.08 0.23 0.00 0.00 5.75 -1.92 -3.33 115.11 114.76 2ozk h GLN 284 Ca -0.07 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.41 2ozk h GLN 284 Cb 0.61 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.11 2ozk h GLN 284 CO 0.12 0.15 0.00 0.25 -2.65 0.00 0.00 178.83 176.70 2ozk n THR 285 N -4.44 0.00 0.00 2.39 -2.24 -1.25 -5.04 114.28 103.70 2ozk n THR 285 Ca 0.11 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 2ozk n THR 285 Cb 0.51 1.65 0.00 0.00 -2.10 0.00 0.00 70.33 70.38 2ozk n THR 285 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ozk n GLY 286 N 0.00 2.57 3.70 3.38 0.00 -0.17 -4.96 105.19 109.71 2ozk n GLY 286 Ca 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 46.02 45.38 2ozk n GLY 286 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ozk n SER 287 N 0.00 1.24 -4.58 1.61 7.64 -1.26 -4.20 113.62 114.07 2ozk n SER 287 Ca 0.00 1.16 -0.36 0.00 1.01 0.00 0.00 58.87 60.68 2ozk n SER 287 Cb 0.00 -0.94 0.07 0.00 -1.01 0.00 0.00 64.21 62.33 2ozk n SER 287 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2ozk n SER 288 N 3.79 0.18 0.00 6.43 2.88 -1.26 -0.76 113.62 124.88 2ozk n SER 288 Ca 0.28 0.69 0.00 0.00 -1.33 0.00 0.00 58.87 58.51 2ozk n SER 288 Cb 0.00 -1.36 0.00 0.00 -0.75 0.00 0.00 64.21 62.10 2ozk n SER 288 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2ozk n LYS 289 N -1.40 0.00 -4.73 -1.46 4.76 -0.88 -4.76 118.16 109.69 2ozk n LYS 289 Ca 0.13 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.23 2ozk n LYS 289 Cb 0.49 0.00 -0.07 0.00 -1.84 0.00 0.00 35.03 33.61 2ozk n LYS 289 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ozk s VAL 291 N -2.89 3.56 0.23 0.00 1.01 -1.26 -0.97 120.40 120.08 2ozk s VAL 291 Ca 0.04 -0.79 -0.17 0.00 0.00 0.00 0.00 61.98 61.06 2ozk s VAL 291 Cb 0.00 -2.81 0.02 0.00 0.00 0.00 0.00 36.38 33.59 2ozk s VAL 291 CO 0.02 0.14 0.56 0.00 0.00 0.00 0.00 175.10 175.82 2ozk s SER 293 N -2.93 4.59 0.09 0.00 0.01 0.13 -1.02 113.70 114.57 2ozk s SER 293 Ca 0.14 -0.06 0.08 0.00 1.31 0.00 0.00 55.95 57.41 2ozk s SER 293 Cb -0.02 -1.24 -0.04 0.00 0.21 0.00 0.00 66.02 64.94 2ozk s SER 293 CO 0.03 0.33 -0.16 -0.69 0.41 0.00 0.00 173.24 173.16 2ozk s VAL 294 N -0.62 2.98 -0.11 3.43 1.01 -0.69 -0.93 120.40 125.47 2ozk s VAL 294 Ca 0.09 -1.35 0.01 0.00 0.00 0.00 0.00 61.98 60.74 2ozk s VAL 294 Cb -0.12 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 33.94 2ozk s VAL 294 CO 0.02 0.17 -0.13 -0.51 0.00 0.00 0.00 175.10 174.65 2ozk s ILE 295 N -1.10 1.34 -0.53 2.22 2.07 -0.79 -2.07 121.20 122.33 2ozk s ILE 295 Ca 0.18 -0.53 -0.20 0.00 -1.41 0.00 0.00 60.65 58.69 2ozk s ILE 295 Cb -0.11 -1.26 0.07 0.00 0.13 0.00 0.00 42.46 41.29 2ozk s ILE 295 CO 0.10 0.41 0.69 -0.62 -1.91 0.00 0.00 174.94 173.61 2ozk s ASP 296 N 1.21 6.22 0.14 4.50 3.68 -1.26 -2.03 116.67 129.13 2ozk s ASP 296 Ca -0.03 -0.96 0.10 0.00 2.13 0.00 0.00 52.55 53.80 2ozk s ASP 296 Cb -0.14 -2.31 -0.04 0.00 -1.45 0.00 0.00 42.92 38.98 2ozk s ASP 296 CO -0.04 -0.99 -0.25 -0.76 0.13 0.00 0.00 175.17 173.26 2ozk s LEU 297 N 2.84 2.34 0.06 -1.34 1.43 -1.26 -0.46 118.68 122.29 2ozk s LEU 297 Ca 0.16 -0.77 -0.31 0.00 -1.03 0.00 0.00 54.13 52.19 2ozk s LEU 297 Cb -0.19 -1.13 -0.08 0.00 0.03 0.00 0.00 46.19 44.82 2ozk s LEU 297 CO 0.11 0.13 1.62 -0.22 0.23 0.00 0.00 176.35 178.23 2ozk s LEU 298 N -2.18 4.36 0.39 1.79 2.96 -1.26 -4.74 118.68 120.00 2ozk s LEU 298 Ca 0.14 2.43 0.19 0.00 -0.22 0.00 0.00 54.13 56.67 2ozk s LEU 298 Cb -0.09 -3.56 1.12 0.00 0.50 0.00 0.00 46.19 44.15 2ozk s LEU 298 CO 0.06 -0.86 1.75 0.25 -1.32 0.00 0.00 176.35 176.23 2ozk h LEU 299 N 8.53 0.45 -0.53 -0.68 6.46 -1.98 0.58 115.31 128.14 2ozk h LEU 299 Ca -0.42 0.10 -0.02 0.00 -0.12 0.00 0.00 57.88 57.41 2ozk h LEU 299 Cb 1.20 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 41.13 2ozk h LEU 299 CO 0.93 0.05 0.24 0.44 -0.62 0.00 0.00 178.44 179.47 2ozk h ASP 300 N 0.38 0.71 0.40 1.25 3.32 -1.97 0.92 116.42 121.42 2ozk h ASP 300 Ca 0.63 -0.15 -0.08 0.00 0.02 0.00 0.00 57.03 57.46 2ozk h ASP 300 Cb 1.60 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.95 2ozk h ASP 300 CO -0.34 0.66 -0.36 0.44 -1.72 0.00 0.00 179.24 177.92 2ozk h ASP 301 N 0.71 0.00 0.09 6.45 3.32 -1.33 -1.63 116.42 124.03 2ozk h ASP 301 Ca 0.18 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 2ozk h ASP 301 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2ozk h ASP 301 CO -0.02 0.36 -0.05 0.15 -1.72 0.00 0.00 179.24 177.96 2ozk h PHE 302 N 0.00 -0.12 -0.48 4.55 3.57 -0.06 -2.55 116.94 121.85 2ozk h PHE 302 Ca -0.00 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.59 2ozk h PHE 302 Cb 0.65 0.04 -0.08 0.00 2.79 0.00 0.00 35.95 39.35 2ozk h PHE 302 CO 0.00 0.37 -0.04 0.28 -2.23 0.00 0.00 178.31 176.69 2ozk h VAL 303 N -0.70 0.58 -0.76 1.41 2.07 -0.83 0.30 116.25 118.32 2ozk h VAL 303 Ca -0.01 -0.02 0.17 0.00 0.82 0.00 0.00 66.70 67.65 2ozk h VAL 303 Cb 0.54 0.50 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 2ozk h VAL 303 CO 0.02 0.01 0.52 -0.08 0.02 0.00 0.00 177.57 178.06 2ozk h GLU 304 N 0.07 0.30 0.21 1.57 4.81 -1.26 -0.68 114.58 119.61 2ozk h GLU 304 Ca 0.24 -0.02 -0.34 0.00 -0.13 0.00 0.00 59.36 59.12 2ozk h GLU 304 Cb 0.37 -0.07 0.02 0.00 0.63 0.00 0.00 28.75 29.70 2ozk h GLU 304 CO -0.44 0.20 -1.60 -0.84 -0.73 0.00 0.00 179.01 175.60 2ozk h ILE 305 N 0.31 1.09 -0.61 2.32 3.07 -0.54 -1.81 117.51 121.34 2ozk h ILE 305 Ca 0.38 -2.57 0.09 0.00 1.55 0.00 0.00 64.86 64.31 2ozk h ILE 305 Cb 1.02 2.88 -0.07 0.00 -0.27 0.00 0.00 36.82 40.38 2ozk h ILE 305 CO -0.10 0.83 0.23 -0.29 -1.05 0.00 0.00 178.15 177.77 2ozk h ILE 306 N 0.08 0.78 0.00 0.16 6.09 -0.85 -0.20 117.51 123.57 2ozk h ILE 306 Ca -0.30 -0.14 0.00 0.00 -1.37 0.00 0.00 64.86 63.04 2ozk h ILE 306 Cb 2.09 0.32 0.00 0.00 0.47 0.00 0.00 36.82 39.70 2ozk h ILE 306 CO 0.21 0.08 0.00 0.11 -3.07 0.00 0.00 178.15 175.47 2ozk h LYS 307 N 0.42 0.00 -0.07 2.19 1.57 -1.18 -2.84 116.57 116.65 2ozk h LYS 307 Ca 0.31 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.95 2ozk h LYS 307 Cb 0.37 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 2ozk h LYS 307 CO -0.30 0.00 -0.57 0.66 -0.57 0.00 0.00 179.45 178.67 2ozk h SER 308 N 0.00 0.25 -2.72 0.86 4.64 -0.12 -3.45 113.55 113.00 2ozk h SER 308 Ca 0.00 -0.13 -0.54 0.00 -0.47 0.00 0.00 61.79 60.64 2ozk h SER 308 Cb 0.40 -0.07 0.07 0.00 -0.31 0.00 0.00 62.40 62.49 2ozk h SER 308 CO 0.00 0.76 0.89 1.67 -0.87 0.00 0.00 176.83 179.29 2ozk n GLN 309 N -3.90 2.55 -3.08 4.77 7.27 -1.07 -4.97 117.38 118.94 2ozk n GLN 309 Ca -0.02 0.91 -0.41 0.00 0.07 0.00 0.00 57.00 57.56 2ozk n GLN 309 Cb 0.59 -2.71 -0.06 0.00 2.41 0.00 0.00 30.24 30.47 2ozk n GLN 309 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2ozk s ASP 310 N 0.86 6.64 0.00 1.69 -1.08 -1.26 -4.97 116.67 118.55 2ozk s ASP 310 Ca 0.72 0.79 0.17 0.00 -0.52 0.00 0.00 52.55 53.71 2ozk s ASP 310 Cb -0.56 -2.35 0.48 0.00 -1.46 0.00 0.00 42.92 39.03 2ozk s ASP 310 CO 0.39 -0.36 1.39 0.18 0.52 0.00 0.00 175.17 177.30 2ozk n LEU 311 N 5.55 2.50 -0.40 -1.34 4.32 -1.26 -3.88 117.00 122.49 2ozk n LEU 311 Ca -0.00 -1.20 0.09 0.00 -0.02 0.00 0.00 56.01 54.88 2ozk n LEU 311 Cb 0.49 -0.28 -0.01 0.00 -1.62 0.00 0.00 43.42 42.01 2ozk n LEU 311 CO 0.44 0.60 0.26 -1.20 -1.22 0.00 0.00 177.39 176.27 2ozk n SER 312 N 0.86 1.74 -4.92 -1.43 7.64 -1.26 -4.94 113.62 111.31 2ozk n SER 312 Ca 0.16 -1.37 -0.21 0.00 1.01 0.00 0.00 58.87 58.47 2ozk n SER 312 Cb 0.41 0.49 -0.02 0.00 -1.01 0.00 0.00 64.21 64.08 2ozk n SER 312 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2ozk s VAL 313 N -2.12 4.40 0.08 0.44 -7.23 -1.25 -5.03 120.40 109.69 2ozk s VAL 313 Ca 0.15 -1.17 -0.29 0.00 -1.81 0.00 0.00 61.98 58.86 2ozk s VAL 313 Cb 0.15 -3.49 -0.17 0.00 0.56 0.00 0.00 36.38 33.42 2ozk s VAL 313 CO 0.47 -0.26 1.67 0.40 -0.31 0.00 0.00 175.10 177.07 2ozk h ILE 314 N 1.19 0.58 -3.57 -0.62 2.04 -1.93 -3.43 117.51 111.77 2ozk h ILE 314 Ca -0.48 0.00 -0.52 0.00 1.00 0.00 0.00 64.86 64.86 2ozk h ILE 314 Cb 1.24 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 2ozk h ILE 314 CO 0.58 0.00 0.41 -0.55 0.00 0.00 0.00 178.15 178.59 2ozk s SER 315 N -4.71 7.42 -0.04 1.72 0.15 -1.26 -4.94 113.70 112.04 2ozk s SER 315 Ca -0.16 1.91 0.15 0.00 0.70 0.00 0.00 55.95 58.55 2ozk s SER 315 Cb 0.05 -2.60 0.46 0.00 -1.71 0.00 0.00 66.02 62.22 2ozk s SER 315 CO 0.64 -0.11 1.39 0.29 1.20 0.00 0.00 173.24 176.64 2ozk n LYS 316 N 2.58 2.98 -2.89 5.44 4.76 -1.26 -4.94 118.16 124.84 2ozk n LYS 316 Ca 0.02 -2.40 -0.41 0.00 -2.87 0.00 0.00 58.31 52.66 2ozk n LYS 316 Cb 0.48 -1.49 -0.04 0.00 -1.84 0.00 0.00 35.03 32.14 2ozk n LYS 316 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2ozk s VAL 317 N -1.36 4.93 -0.21 -0.18 1.01 -1.26 -1.87 120.40 121.46 2ozk s VAL 317 Ca 0.35 1.70 -0.03 0.00 0.00 0.00 0.00 61.98 64.00 2ozk s VAL 317 Cb 0.21 -4.16 -0.00 0.00 0.00 0.00 0.00 36.38 32.42 2ozk s VAL 317 CO 0.20 0.14 -0.08 -0.69 0.00 0.00 0.00 175.10 174.67 2ozk s VAL 318 N 1.35 3.09 -0.38 2.92 1.01 0.16 -4.94 120.40 123.61 2ozk s VAL 318 Ca 0.42 -0.59 -0.18 0.00 0.00 0.00 0.00 61.98 61.63 2ozk s VAL 318 Cb -0.18 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 33.81 2ozk s VAL 318 CO 0.19 0.44 0.52 -0.54 0.00 0.00 0.00 175.10 175.71 2ozk s LYS 319 N 1.44 3.44 0.07 2.72 1.02 -1.26 0.48 119.74 127.65 2ozk s LYS 319 Ca 0.06 -0.34 0.05 0.00 0.02 0.00 0.00 55.97 55.76 2ozk s LYS 319 Cb -0.14 -3.87 -0.04 0.00 -0.52 0.00 0.00 37.83 33.26 2ozk s LYS 319 CO -0.05 -0.75 -0.07 0.14 -0.92 0.00 0.00 175.35 173.70 2ozk s VAL 320 N 2.41 3.60 -0.42 3.17 -7.23 -0.11 -4.97 120.40 116.86 2ozk s VAL 320 Ca 0.18 -1.06 -0.16 0.00 -1.81 0.00 0.00 61.98 59.12 2ozk s VAL 320 Cb -0.16 -2.66 0.03 0.00 0.56 0.00 0.00 36.38 34.15 2ozk s VAL 320 CO 0.14 0.19 0.36 0.28 -0.31 0.00 0.00 175.10 175.77 2ozk s THR 321 N -1.18 5.19 -0.06 5.32 -1.32 -1.26 -0.36 115.64 121.97 2ozk s THR 321 Ca 0.21 -0.58 0.03 0.00 -1.21 0.00 0.00 61.69 60.14 2ozk s THR 321 Cb -0.11 -3.99 0.00 0.00 -1.51 0.00 0.00 72.50 66.89 2ozk s THR 321 CO 0.13 -0.38 -0.16 -0.63 -2.21 0.00 0.00 174.62 171.36 2ozk s ILE 322 N 1.86 1.42 -1.05 5.08 1.01 0.40 -2.65 121.20 127.27 2ozk s ILE 322 Ca 0.08 -0.67 -0.06 0.00 0.00 0.00 0.00 60.65 59.99 2ozk s ILE 322 Cb -0.19 -1.25 0.01 0.00 0.01 0.00 0.00 42.46 41.04 2ozk s ILE 322 CO 0.11 0.42 0.92 0.47 0.00 0.00 0.00 174.94 176.85 2ozk n ASP 323 N 3.48 -5.16 0.00 3.58 8.00 0.99 -1.68 116.55 125.75 2ozk n ASP 323 Ca -0.20 -0.43 0.00 0.00 0.71 0.00 0.00 54.79 54.87 2ozk n ASP 323 Cb 0.52 -4.05 0.00 0.00 -0.02 0.00 0.00 41.12 37.57 2ozk n ASP 323 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2ozk n TYR 324 N -4.39 0.00 -4.27 1.24 4.02 -1.26 -4.84 117.16 107.67 2ozk n TYR 324 Ca -0.01 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.60 2ozk n TYR 324 Cb 0.55 -1.57 -0.10 0.00 -0.02 0.00 0.00 39.34 38.21 2ozk n TYR 324 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2ozk s ALA 325 N -0.80 2.92 -0.33 -0.72 0.00 -0.68 -4.91 121.76 117.25 2ozk s ALA 325 Ca 0.00 -1.37 -0.24 0.00 0.00 0.00 0.00 51.96 50.35 2ozk s ALA 325 Cb 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 23.12 22.34 2ozk s ALA 325 CO 0.00 0.55 0.80 -1.21 0.00 0.00 0.00 175.76 175.89 2ozk s GLU 326 N -2.52 3.88 -0.13 0.00 2.02 -1.26 -0.45 118.70 120.24 2ozk s GLU 326 Ca 0.23 0.49 -0.04 0.00 0.02 0.00 0.00 54.97 55.68 2ozk s GLU 326 Cb -0.10 -3.76 -0.03 0.00 0.10 0.00 0.00 34.13 30.34 2ozk s GLU 326 CO 0.14 -0.76 -0.00 0.42 0.02 0.00 0.00 175.26 175.08 2ozk s ILE 327 N 3.05 4.22 -0.20 -1.63 -1.09 0.51 -4.99 121.20 121.08 2ozk s ILE 327 Ca 0.32 -0.25 -0.15 0.00 -2.23 0.00 0.00 60.65 58.34 2ozk s ILE 327 Cb -0.14 -2.83 -0.04 0.00 -1.58 0.00 0.00 42.46 37.87 2ozk s ILE 327 CO 0.14 0.53 0.34 -0.44 -1.23 0.00 0.00 174.94 174.28 2ozk s SER 328 N -0.12 6.38 0.20 3.58 0.01 -1.26 -0.93 113.70 121.56 2ozk s SER 328 Ca 0.04 0.45 0.06 0.00 1.31 0.00 0.00 55.95 57.81 2ozk s SER 328 Cb -0.13 -2.20 -0.04 0.00 0.21 0.00 0.00 66.02 63.87 2ozk s SER 328 CO 0.02 -0.01 0.16 -0.36 0.41 0.00 0.00 173.24 173.45 2ozk s PHE 329 N 1.07 3.13 -0.45 2.43 2.99 0.18 -3.83 117.98 123.50 2ozk s PHE 329 Ca 0.17 -0.05 -0.03 0.00 0.00 0.00 0.00 56.93 57.02 2ozk s PHE 329 Cb -0.14 -1.47 0.12 0.00 0.00 0.00 0.00 43.02 41.53 2ozk s PHE 329 CO 0.06 0.52 0.24 -1.64 -0.00 0.00 0.00 175.22 174.41 2ozk s MET 330 N -3.36 2.08 -0.27 0.44 -1.94 0.11 -0.67 119.30 115.69 2ozk s MET 330 Ca 0.32 -1.96 -0.08 0.00 -1.71 0.00 0.00 55.69 52.25 2ozk s MET 330 Cb -0.09 -3.59 -0.02 0.00 2.01 0.00 0.00 34.83 33.13 2ozk s MET 330 CO 0.24 -1.09 0.10 -0.51 -0.01 0.00 0.00 175.02 173.75 2ozk s LEU 331 N 0.89 3.68 0.00 -0.03 1.43 -0.78 -4.47 118.68 119.41 2ozk s LEU 331 Ca 0.10 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 2ozk s LEU 331 Cb -0.22 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.03 2ozk s LEU 331 CO -0.04 -0.08 0.00 -2.67 0.23 0.00 0.00 176.35 173.79