#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rdx s LEU 1 N 0.00 0.58 -0.04 2.46 2.96 -1.26 -4.96 118.68 118.43 2rdx s LEU 1 Ca 0.00 0.72 0.05 0.00 -0.22 0.00 0.00 54.13 54.68 2rdx s LEU 1 Cb 0.00 1.21 -0.01 0.00 0.50 0.00 0.00 46.19 47.89 2rdx s LEU 1 CO 0.00 -0.13 -0.18 -0.13 -1.32 0.00 0.00 176.35 174.59 2rdx s ARG 2 N 0.32 1.78 -0.12 1.98 0.52 -1.26 -3.72 118.95 118.45 2rdx s ARG 2 Ca -0.01 -0.64 -0.30 0.00 -0.52 0.00 0.00 55.73 54.26 2rdx s ARG 2 Cb -0.03 -1.58 -0.02 0.00 0.52 0.00 0.00 34.95 33.84 2rdx s ARG 2 CO -0.01 0.29 1.22 0.42 0.02 0.00 0.00 175.30 177.24 2rdx s ILE 3 N -0.08 4.29 -0.04 1.52 1.01 -0.19 -1.90 121.20 125.81 2rdx s ILE 3 Ca -0.01 1.58 0.15 0.00 0.00 0.00 0.00 60.65 62.37 2rdx s ILE 3 Cb -0.11 -4.02 -0.23 0.00 0.01 0.00 0.00 42.46 38.11 2rdx s ILE 3 CO 0.02 -0.08 0.29 0.35 0.00 0.00 0.00 174.94 175.52 2rdx n THR 4 N 5.03 0.15 -3.71 2.92 -2.24 -0.15 -0.50 114.28 115.78 2rdx n THR 4 Ca 0.12 -0.39 -0.12 0.00 -2.27 0.00 0.00 64.05 61.40 2rdx n THR 4 Cb 0.45 0.03 -0.10 0.00 -2.10 0.00 0.00 70.33 68.61 2rdx n THR 4 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2rdx s ARG 5 N -2.96 0.47 -0.11 -0.78 3.52 -1.17 -0.91 118.95 117.00 2rdx s ARG 5 Ca -0.06 0.73 0.02 0.00 -0.13 0.00 0.00 55.73 56.29 2rdx s ARG 5 Cb 0.09 0.11 0.01 0.00 -1.56 0.00 0.00 34.95 33.60 2rdx s ARG 5 CO 0.64 -0.11 -0.19 0.42 -0.81 0.00 0.00 175.30 175.25 2rdx s ILE 6 N 0.86 1.74 0.01 4.11 1.01 0.68 -1.22 121.20 128.39 2rdx s ILE 6 Ca -0.05 -0.80 0.06 0.00 0.00 0.00 0.00 60.65 59.86 2rdx s ILE 6 Cb -0.06 -1.55 -0.02 0.00 0.01 0.00 0.00 42.46 40.84 2rdx s ILE 6 CO -0.07 0.49 -0.19 -0.13 0.00 0.00 0.00 174.94 175.04 2rdx s ARG 7 N 0.77 1.38 -0.09 2.79 0.52 -0.59 0.25 118.95 123.97 2rdx s ARG 7 Ca -0.10 -0.77 0.02 0.00 -0.52 0.00 0.00 55.73 54.35 2rdx s ARG 7 Cb -0.16 -1.40 -0.02 0.00 0.52 0.00 0.00 34.95 33.90 2rdx s ARG 7 CO 0.01 0.37 -0.14 -1.17 0.02 0.00 0.00 175.30 174.39 2rdx s LEU 8 N -0.79 2.67 0.16 2.53 2.96 -0.46 -1.30 118.68 124.46 2rdx s LEU 8 Ca 0.07 -0.29 0.11 0.00 -0.22 0.00 0.00 54.13 53.80 2rdx s LEU 8 Cb -0.08 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 45.00 2rdx s LEU 8 CO 0.00 0.24 -0.25 -0.31 -1.32 0.00 0.00 176.35 174.71 2rdx s TYR 9 N -0.10 2.29 -0.02 5.38 2.02 0.62 -0.90 117.35 126.63 2rdx s TYR 9 Ca -0.02 -0.37 0.01 0.00 -0.37 0.00 0.00 57.07 56.32 2rdx s TYR 9 Cb -0.14 -1.18 0.02 0.00 -0.40 0.00 0.00 41.96 40.25 2rdx s TYR 9 CO 0.04 0.42 -0.02 0.15 -1.57 0.00 0.00 175.55 174.57 2rdx s LYS 10 N -2.38 0.37 0.02 -0.62 1.02 -1.26 -1.16 119.74 115.73 2rdx s LYS 10 Ca 0.17 -0.03 -0.13 0.00 0.02 0.00 0.00 55.97 56.00 2rdx s LYS 10 Cb -0.09 -0.45 0.02 0.00 -0.52 0.00 0.00 37.83 36.78 2rdx s LYS 10 CO 0.08 -0.05 0.28 -0.08 -0.92 0.00 0.00 175.35 174.67 2rdx s THR 11 N 0.58 0.08 -0.07 2.17 -1.32 -0.88 -4.85 115.64 111.35 2rdx s THR 11 Ca -0.06 -0.63 -0.20 0.00 -1.21 0.00 0.00 61.69 59.59 2rdx s THR 11 Cb -0.09 -0.78 -0.04 0.00 -1.51 0.00 0.00 72.50 70.07 2rdx s THR 11 CO -0.01 -0.35 0.57 -1.81 -2.21 0.00 0.00 174.62 170.82 2rdx s ASP 12 N -1.75 6.85 -0.39 8.08 1.01 -1.26 -0.61 116.67 128.61 2rdx s ASP 12 Ca -0.09 1.02 -0.00 0.00 0.71 0.00 0.00 52.55 54.19 2rdx s ASP 12 Cb -0.03 -2.34 0.11 0.00 1.01 0.00 0.00 42.92 41.67 2rdx s ASP 12 CO -0.00 0.00 0.15 -0.76 0.21 0.00 0.00 175.17 174.77 2rdx s LEU 13 N 0.41 5.07 0.40 1.23 1.43 0.40 -4.87 118.68 122.75 2rdx s LEU 13 Ca 0.31 -2.11 -0.24 0.00 -1.03 0.00 0.00 54.13 51.06 2rdx s LEU 13 Cb -0.17 -1.75 -0.09 0.00 0.03 0.00 0.00 46.19 44.21 2rdx s LEU 13 CO 0.14 -0.48 1.10 -2.84 0.23 0.00 0.00 176.35 174.50 2rdx s PRO 14 N 1.01 4.09 0.29 1.29 0.02 -1.26 -1.19 135.00 139.26 2rdx s PRO 14 Ca 0.10 1.64 -0.29 0.00 0.02 0.00 0.00 61.00 62.47 2rdx s PRO 14 Cb -0.21 -2.57 -0.09 0.00 0.02 0.00 0.00 34.50 31.64 2rdx s PRO 14 CO -0.06 -0.24 1.08 -0.47 -0.33 0.00 0.00 177.00 176.99 2rdx s TYR 15 N -1.56 3.57 0.39 6.54 5.04 -0.40 -1.80 117.35 129.13 2rdx s TYR 15 Ca 0.58 1.71 0.16 0.00 -2.44 0.00 0.00 57.07 57.08 2rdx s TYR 15 Cb -0.25 -3.24 0.91 0.00 0.35 0.00 0.00 41.96 39.73 2rdx s TYR 15 CO 0.32 -0.48 1.90 -0.24 -1.34 0.00 0.00 175.55 175.71 2rdx h VAL 16 N 2.99 1.09 -0.71 3.14 3.04 -1.31 -3.11 116.25 121.38 2rdx h VAL 16 Ca -0.47 -1.00 -0.49 0.00 -1.01 0.00 0.00 66.70 63.73 2rdx h VAL 16 Cb 1.21 1.55 -0.32 0.00 -2.01 0.00 0.00 31.29 31.73 2rdx h VAL 16 CO 0.66 0.27 -0.23 0.47 -1.01 0.00 0.00 177.57 177.73 2rdx n ASP 17 N -4.04 5.04 0.00 3.17 8.00 -1.26 -4.99 116.55 122.47 2rdx n ASP 17 Ca -0.02 -3.77 0.00 0.00 0.71 0.00 0.00 54.79 51.71 2rdx n ASP 17 Cb 0.34 -0.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.88 2rdx n ASP 17 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rdx n GLY 18 N -0.86 2.31 3.16 0.44 0.00 -1.17 -4.78 105.19 104.30 2rdx n GLY 18 Ca 0.46 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 46.15 2rdx n GLY 18 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rdx s SER 19 N -4.00 2.73 -0.31 1.61 0.15 -1.26 -4.38 113.70 108.24 2rdx s SER 19 Ca 0.00 -0.49 -0.10 0.00 0.70 0.00 0.00 55.95 56.06 2rdx s SER 19 Cb 0.00 -1.25 -0.01 0.00 -1.71 0.00 0.00 66.02 63.04 2rdx s SER 19 CO 0.00 0.12 0.17 -0.47 1.20 0.00 0.00 173.24 174.26 2rdx s TYR 20 N 0.45 3.19 -0.32 3.44 6.14 -0.22 -4.94 117.35 125.08 2rdx s TYR 20 Ca -0.17 -0.44 -0.16 0.00 0.64 0.00 0.00 57.07 56.94 2rdx s TYR 20 Cb -0.17 -2.38 -0.02 0.00 0.42 0.00 0.00 41.96 39.81 2rdx s TYR 20 CO 0.07 -0.41 0.42 0.20 0.64 0.00 0.00 175.55 176.48 2rdx s GLY 21 N 1.65 1.86 0.02 8.97 0.00 -1.26 -1.75 107.32 116.82 2rdx s GLY 21 Ca 0.05 -0.98 0.06 0.00 0.00 0.00 0.00 44.72 43.85 2rdx s GLY 21 CO 0.07 1.09 -0.17 0.66 0.00 0.00 0.00 173.10 174.75 2rdx s TRP 22 N 2.17 1.54 0.00 1.90 1.48 -0.75 -4.93 118.94 120.35 2rdx s TRP 22 Ca 0.16 -0.33 0.00 0.00 -1.06 0.00 0.00 56.10 54.86 2rdx s TRP 22 Cb -0.16 -0.94 0.00 0.00 -1.16 0.00 0.00 33.47 31.21 2rdx s TRP 22 CO 0.11 0.03 0.00 0.41 -4.06 0.00 0.00 176.95 173.45 2rdx n GLY 23 N 2.16 1.68 3.00 3.67 0.00 -1.25 -2.58 105.19 111.87 2rdx n GLY 23 Ca -0.16 -0.64 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 2rdx n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdx n ALA 24 N 8.27 4.95 -0.97 4.61 0.00 -1.24 -2.18 120.51 133.95 2rdx n ALA 24 Ca 0.00 -4.02 0.00 0.00 0.00 0.00 0.00 53.44 49.42 2rdx n ALA 24 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 19.45 16.09 2rdx n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rdx n GLY 25 N 4.01 0.44 3.77 0.00 0.00 -1.26 -4.94 105.19 107.21 2rdx n GLY 25 Ca 0.47 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.10 2rdx n GLY 25 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2rdx s ASN 26 N -2.16 7.10 -0.05 1.61 0.01 -1.07 -4.94 114.94 115.45 2rdx s ASN 26 Ca 0.00 2.14 0.01 0.00 -0.71 0.00 0.00 52.86 54.30 2rdx s ASN 26 Cb 0.00 -2.61 0.02 0.00 0.41 0.00 0.00 41.25 39.07 2rdx s ASN 26 CO 0.00 -0.25 -0.07 0.00 -1.51 0.00 0.00 177.10 175.27 2rdx s ALA 27 N -1.37 0.87 -0.17 0.60 0.00 -1.26 -1.81 121.76 118.62 2rdx s ALA 27 Ca 0.49 -0.18 -0.01 0.00 0.00 0.00 0.00 51.96 52.27 2rdx s ALA 27 Cb -0.27 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.35 2rdx s ALA 27 CO 0.35 -0.01 -0.13 -1.50 0.00 0.00 0.00 175.76 174.46 2rdx s ILE 28 N 0.91 2.74 -0.08 0.00 -1.16 -0.72 -4.95 121.20 117.95 2rdx s ILE 28 Ca -0.11 -0.73 0.07 0.00 -0.51 0.00 0.00 60.65 59.37 2rdx s ILE 28 Cb -0.15 -2.18 -0.10 0.00 0.61 0.00 0.00 42.46 40.65 2rdx s ILE 28 CO 0.01 0.50 0.03 1.07 -2.81 0.00 0.00 174.94 173.73 2rdx n THR 29 N 4.31 0.53 -4.08 4.00 5.66 -1.26 -1.05 114.28 122.38 2rdx n THR 29 Ca -0.19 -0.33 -0.20 0.00 -3.05 0.00 0.00 64.05 60.29 2rdx n THR 29 Cb 0.51 -0.79 -0.16 0.00 -1.55 0.00 0.00 70.33 68.33 2rdx n THR 29 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2rdx s VAL 30 N -2.19 0.45 0.00 1.08 1.01 -1.26 -1.28 120.40 118.22 2rdx s VAL 30 Ca -0.04 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 61.89 2rdx s VAL 30 Cb 0.02 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 2rdx s VAL 30 CO 0.32 0.21 0.05 0.00 0.00 0.00 0.00 175.10 175.67 2rdx s ALA 31 N 1.02 3.45 -0.36 5.51 0.00 -0.33 -4.94 121.76 126.11 2rdx s ALA 31 Ca -0.10 -0.92 -0.10 0.00 0.00 0.00 0.00 51.96 50.84 2rdx s ALA 31 Cb -0.14 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 21.54 2rdx s ALA 31 CO -0.01 0.68 0.19 0.50 0.00 0.00 0.00 175.76 177.12 2rdx s ARG 32 N -1.72 2.88 0.14 0.00 3.00 -1.26 -0.45 118.95 121.54 2rdx s ARG 32 Ca 0.22 -1.04 -0.22 0.00 -1.00 0.00 0.00 55.73 53.68 2rdx s ARG 32 Cb -0.12 -3.69 -0.08 0.00 0.00 0.00 0.00 34.95 31.06 2rdx s ARG 32 CO 0.13 -0.66 0.70 0.00 0.00 0.00 0.00 175.30 175.47 2rdx s ALA 33 N 1.55 3.50 -0.15 6.12 0.00 0.22 -4.33 121.76 128.67 2rdx s ALA 33 Ca 0.02 0.22 0.01 0.00 0.00 0.00 0.00 51.96 52.21 2rdx s ALA 33 Cb -0.19 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 20.11 2rdx s ALA 33 CO 0.06 0.34 -0.17 -1.12 0.00 0.00 0.00 175.76 174.87 2rdx s SER 34 N -1.20 3.51 -0.11 0.00 0.01 -0.73 -2.07 113.70 113.11 2rdx s SER 34 Ca 0.34 -0.50 0.04 0.00 1.31 0.00 0.00 55.95 57.13 2rdx s SER 34 Cb -0.21 -1.53 0.00 0.00 0.21 0.00 0.00 66.02 64.49 2rdx s SER 34 CO 0.23 0.09 -0.23 -0.69 0.41 0.00 0.00 173.24 173.05 2rdx s VAL 35 N 0.80 2.12 -0.19 3.43 1.01 -0.31 -1.94 120.40 125.32 2rdx s VAL 35 Ca -0.06 -0.99 -0.07 0.00 0.00 0.00 0.00 61.98 60.85 2rdx s VAL 35 Cb -0.15 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 2rdx s VAL 35 CO -0.00 0.56 0.06 -0.69 0.00 0.00 0.00 175.10 175.02 2rdx s VAL 36 N 0.41 4.72 -0.13 2.92 1.01 0.10 -0.27 120.40 129.14 2rdx s VAL 36 Ca -0.17 -0.06 0.02 0.00 0.00 0.00 0.00 61.98 61.78 2rdx s VAL 36 Cb -0.18 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.08 2rdx s VAL 36 CO 0.07 0.45 -0.21 -0.69 0.00 0.00 0.00 175.10 174.72 2rdx s VAL 37 N 0.50 2.24 -0.19 2.92 1.01 -0.42 -1.57 120.40 124.89 2rdx s VAL 37 Ca 0.03 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.09 2rdx s VAL 37 Cb -0.13 -1.90 0.04 0.00 0.00 0.00 0.00 36.38 34.39 2rdx s VAL 37 CO 0.01 0.54 -0.13 -0.63 0.00 0.00 0.00 175.10 174.89 2rdx s ILE 38 N 0.67 1.81 0.09 2.22 1.01 0.54 -1.55 121.20 125.99 2rdx s ILE 38 Ca -0.10 -1.01 -0.03 0.00 0.00 0.00 0.00 60.65 59.51 2rdx s ILE 38 Cb -0.16 -1.79 -0.05 0.00 0.01 0.00 0.00 42.46 40.47 2rdx s ILE 38 CO 0.02 0.28 0.30 -1.81 0.00 0.00 0.00 174.94 173.73 2rdx s ASP 39 N 1.34 6.44 0.28 3.58 1.01 -0.35 -0.95 116.67 128.02 2rdx s ASP 39 Ca 0.00 0.46 0.05 0.00 0.71 0.00 0.00 52.55 53.77 2rdx s ASP 39 Cb -0.15 -2.04 -0.06 0.00 1.01 0.00 0.00 42.92 41.68 2rdx s ASP 39 CO -0.09 0.12 -0.02 0.42 0.21 0.00 0.00 175.17 175.80 2rdx s THR 40 N -1.56 1.43 -0.09 -1.27 -4.23 -0.94 -0.97 115.64 108.01 2rdx s THR 40 Ca 0.37 -2.08 0.30 0.00 -1.18 0.00 0.00 61.69 59.11 2rdx s THR 40 Cb -0.13 -2.50 0.37 0.00 1.34 0.00 0.00 72.50 71.58 2rdx s THR 40 CO 0.25 -0.25 1.87 -2.24 -0.54 0.00 0.00 174.62 173.72 2rdx h ASP 41 N 2.28 0.00 -0.58 3.99 3.04 -1.71 -2.60 116.42 120.84 2rdx h ASP 41 Ca -0.40 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.39 2rdx h ASP 41 Cb 1.23 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.52 2rdx h ASP 41 CO 0.67 0.00 0.00 0.00 -2.04 0.00 0.00 179.24 177.87 2rdx n ALA 42 N -2.06 2.74 -1.07 4.15 0.00 -1.26 -4.94 120.51 118.06 2rdx n ALA 42 Ca 0.02 -1.21 -0.01 0.00 0.00 0.00 0.00 53.44 52.24 2rdx n ALA 42 Cb 0.36 -0.99 -0.00 0.00 0.00 0.00 0.00 19.45 18.81 2rdx n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rdx n GLY 43 N 1.22 0.42 3.72 0.00 0.00 -0.98 -5.03 105.19 104.54 2rdx n GLY 43 Ca 0.21 -1.06 -0.37 0.00 0.00 0.00 0.00 46.02 44.81 2rdx n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2rdx s LEU 44 N -0.14 4.23 -0.12 0.99 1.43 -1.26 -4.92 118.68 118.88 2rdx s LEU 44 Ca 0.00 0.49 0.01 0.00 -1.03 0.00 0.00 54.13 53.60 2rdx s LEU 44 Cb 0.00 -2.38 -0.01 0.00 0.03 0.00 0.00 46.19 43.83 2rdx s LEU 44 CO 0.00 0.08 -0.16 -1.58 0.23 0.00 0.00 176.35 174.92 2rdx s GLN 45 N 0.60 3.27 0.23 1.70 0.74 -1.26 -2.21 119.66 122.74 2rdx s GLN 45 Ca 0.16 -0.74 0.09 0.00 0.05 0.00 0.00 55.36 54.93 2rdx s GLN 45 Cb -0.13 -2.54 -0.04 0.00 1.10 0.00 0.00 33.01 31.40 2rdx s GLN 45 CO 0.04 0.22 -0.01 0.20 -0.55 0.00 0.00 175.29 175.19 2rdx s GLY 46 N 0.31 1.67 0.02 2.59 0.00 -0.12 -4.75 107.32 107.05 2rdx s GLY 46 Ca -0.12 -1.55 -0.08 0.00 0.00 0.00 0.00 44.72 42.97 2rdx s GLY 46 CO 0.06 -1.59 0.16 0.00 0.00 0.00 0.00 173.10 171.74 2rdx s GLY 48 N -1.78 -0.32 -0.06 0.00 0.00 -0.61 -3.03 107.32 101.52 2rdx s GLY 48 Ca -0.09 0.23 -0.04 0.00 0.00 0.00 0.00 44.72 44.81 2rdx s GLY 48 CO -0.01 -0.05 0.14 1.85 0.00 0.00 0.00 173.10 175.03 2rdx s GLU 49 N -3.10 0.14 -0.11 2.90 2.12 -1.26 -0.72 118.70 118.66 2rdx s GLU 49 Ca -0.01 0.25 0.02 0.00 0.36 0.00 0.00 54.97 55.58 2rdx s GLU 49 Cb 0.00 -0.00 0.01 0.00 0.26 0.00 0.00 34.13 34.41 2rdx s GLU 49 CO -0.07 -0.06 -0.16 0.12 -0.54 0.00 0.00 175.26 174.55 2rdx s PHE 50 N 0.41 2.04 -0.08 5.30 5.36 -0.82 -4.53 117.98 125.65 2rdx s PHE 50 Ca -0.03 -0.95 -0.01 0.00 -0.96 0.00 0.00 56.93 54.98 2rdx s PHE 50 Cb -0.04 -1.45 0.03 0.00 -0.34 0.00 0.00 43.02 41.21 2rdx s PHE 50 CO -0.02 -0.48 -0.01 0.99 -1.46 0.00 0.00 175.22 174.25 2rdx s THR 51 N 0.92 0.49 0.56 0.12 2.01 -1.26 -1.78 115.64 116.71 2rdx s THR 51 Ca -0.08 0.03 -0.15 0.00 0.31 0.00 0.00 61.69 61.80 2rdx s THR 51 Cb -0.15 -0.64 -0.06 0.00 0.01 0.00 0.00 72.50 71.67 2rdx s THR 51 CO -0.01 0.26 1.02 -2.16 -0.69 0.00 0.00 174.62 173.04 2rdx s PRO 52 N 1.93 3.67 -0.07 4.92 0.04 -1.26 -2.97 135.00 141.26 2rdx s PRO 52 Ca 0.05 1.00 -0.14 0.00 0.04 0.00 0.00 61.00 61.95 2rdx s PRO 52 Cb -0.12 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.23 2rdx s PRO 52 CO -0.06 -0.51 0.53 0.00 0.04 0.00 0.00 177.00 177.00 2rdx s GLY 54 N -3.32 1.68 0.49 0.00 0.00 -1.26 -4.82 107.32 100.09 2rdx s GLY 54 Ca -0.08 -1.70 0.29 0.00 0.00 0.00 0.00 44.72 43.23 2rdx s GLY 54 CO 0.27 -1.77 1.82 0.83 0.00 0.00 0.00 173.10 174.26 2rdx h GLU 55 N 2.78 0.00 -0.40 2.90 4.39 -1.90 -3.11 114.58 119.24 2rdx h GLU 55 Ca -0.42 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.28 2rdx h GLU 55 Cb 1.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.88 2rdx h GLU 55 CO 0.55 0.00 0.00 0.27 -1.16 0.00 0.00 179.01 178.67 2rdx n ASN 56 N -3.04 3.64 0.01 1.42 6.94 -1.26 -4.50 115.26 118.47 2rdx n ASN 56 Ca 0.02 -2.39 -0.19 0.00 -0.02 0.00 0.00 54.58 52.00 2rdx n ASN 56 Cb 0.39 -0.41 -0.09 0.00 -2.36 0.00 0.00 39.78 37.31 2rdx n ASN 56 CO 0.00 0.00 0.00 0.22 -1.03 0.00 0.00 177.26 176.45 2rdx h TYR 57 N 2.48 0.95 -3.57 -2.53 3.20 -1.82 -3.47 116.97 112.21 2rdx h TYR 57 Ca 0.00 -0.48 -0.26 0.00 3.14 0.00 0.00 58.73 61.13 2rdx h TYR 57 Cb 1.10 -0.12 -0.07 0.00 1.54 0.00 0.00 36.73 39.18 2rdx h TYR 57 CO 0.43 1.31 -0.25 0.00 -1.64 0.00 0.00 178.16 178.01 2rdx n MET 58 N -3.98 0.23 -2.36 1.82 0.00 -1.26 -5.02 117.12 106.55 2rdx n MET 58 Ca -0.10 -1.84 -0.40 0.00 0.00 0.00 0.00 57.70 55.36 2rdx n MET 58 Cb 0.78 1.52 -0.01 0.00 0.00 0.00 0.00 33.22 35.51 2rdx n MET 58 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 175.97 175.08 2rdx n ILE 59 N -0.35 3.51 -3.65 3.17 5.41 -1.26 -4.75 119.36 121.44 2rdx n ILE 59 Ca 0.04 -3.57 -0.04 0.00 1.00 0.00 0.00 62.75 60.17 2rdx n ILE 59 Cb 0.34 -2.35 -0.07 0.00 -0.71 0.00 0.00 39.64 36.85 2rdx n ILE 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2rdx s ALA 60 N 5.25 -2.18 0.12 -1.39 0.00 -1.26 -4.82 121.76 117.47 2rdx s ALA 60 Ca 0.56 1.77 -0.16 0.00 0.00 0.00 0.00 51.96 54.12 2rdx s ALA 60 Cb 0.05 -1.70 0.03 0.00 0.00 0.00 0.00 23.12 21.50 2rdx s ALA 60 CO 0.07 -0.16 0.39 -3.38 0.00 0.00 0.00 175.76 172.69 2rdx s HIS 61 N 0.18 -0.19 0.37 0.00 -3.43 -1.26 -4.58 115.29 106.38 2rdx s HIS 61 Ca 0.05 -0.12 0.12 0.00 -0.80 0.00 0.00 55.06 54.31 2rdx s HIS 61 Cb -0.05 0.25 0.72 0.00 -1.43 0.00 0.00 32.58 32.07 2rdx s HIS 61 CO -0.13 -0.69 1.83 0.66 -2.00 0.00 0.00 174.74 174.41 2rdx h SER 62 N 2.40 0.03 1.65 7.38 4.64 -1.91 -2.93 113.55 124.81 2rdx h SER 62 Ca -0.34 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2rdx h SER 62 Cb 1.25 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2rdx h SER 62 CO 0.47 0.38 -0.02 -0.33 -0.87 0.00 0.00 176.83 176.46 2rdx h GLU 63 N 0.02 0.00 0.00 4.77 4.39 -1.98 -3.27 114.58 118.51 2rdx h GLU 63 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2rdx h GLU 63 Cb 0.63 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.28 2rdx h GLU 63 CO 0.05 0.02 -0.12 0.78 -1.16 0.00 0.00 179.01 178.57 2rdx h GLY 64 N 3.33 0.00 0.99 -3.84 0.00 -1.95 -2.96 103.07 98.64 2rdx h GLY 64 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 2rdx h GLY 64 CO 0.00 0.00 -0.10 -2.08 0.00 0.00 0.00 176.54 174.37 2rdx h VAL 65 N 0.00 1.27 -0.35 4.60 2.07 -1.73 -2.55 116.25 119.57 2rdx h VAL 65 Ca -0.00 -1.19 0.04 0.00 0.82 0.00 0.00 66.70 66.36 2rdx h VAL 65 Cb 0.45 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 2rdx h VAL 65 CO 0.02 0.40 0.13 0.44 0.02 0.00 0.00 177.57 178.58 2rdx h ASP 66 N 0.63 0.15 -0.68 0.57 3.45 -1.73 -1.19 116.42 117.61 2rdx h ASP 66 Ca 0.11 0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.59 2rdx h ASP 66 Cb 0.62 0.01 -0.03 0.00 -0.56 0.00 0.00 39.33 39.38 2rdx h ASP 66 CO 0.04 0.12 0.39 0.00 -1.57 0.00 0.00 179.24 178.23 2rdx h ALA 67 N 1.21 0.87 -0.13 3.45 0.00 -1.49 -0.07 119.26 123.11 2rdx h ALA 67 Ca 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2rdx h ALA 67 Cb 0.12 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 2rdx h ALA 67 CO -0.15 0.36 -0.03 0.35 0.00 0.00 0.00 179.25 179.78 2rdx h PHE 68 N 0.93 0.28 -0.65 0.00 3.57 -1.34 -2.98 116.94 116.75 2rdx h PHE 68 Ca 0.24 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2rdx h PHE 68 Cb 0.00 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.64 2rdx h PHE 68 CO -0.01 0.54 0.42 0.00 -2.23 0.00 0.00 178.31 177.04 2rdx h ALA 69 N 0.70 1.53 -0.45 2.41 0.00 -1.01 0.16 119.26 122.59 2rdx h ALA 69 Ca 0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2rdx h ALA 69 Cb 0.45 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2rdx h ALA 69 CO 0.01 0.44 0.18 0.00 0.00 0.00 0.00 179.25 179.87 2rdx h ARG 70 N 0.88 0.65 0.08 0.00 3.08 -0.98 -1.49 114.38 116.60 2rdx h ARG 70 Ca 0.24 -0.09 -0.11 0.00 0.07 0.00 0.00 59.98 60.09 2rdx h ARG 70 Cb -0.09 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 29.85 2rdx h ARG 70 CO -0.05 0.54 -0.49 1.25 -1.07 0.00 0.00 179.97 180.15 2rdx h LEU 71 N 0.64 0.28 0.04 3.04 6.46 -1.16 -3.43 115.31 121.18 2rdx h LEU 71 Ca 0.16 -0.97 -0.35 0.00 -0.12 0.00 0.00 57.88 56.59 2rdx h LEU 71 Cb 0.14 -0.09 -0.05 0.00 -0.73 0.00 0.00 40.66 39.93 2rdx h LEU 71 CO -0.01 1.23 -2.09 0.00 -0.62 0.00 0.00 178.44 176.95 2rdx n ALA 72 N -2.65 1.29 -0.21 1.25 0.00 0.49 -4.43 120.51 116.25 2rdx n ALA 72 Ca -0.12 -0.89 0.07 0.00 0.00 0.00 0.00 53.44 52.50 2rdx n ALA 72 Cb 0.69 -0.52 0.34 0.00 0.00 0.00 0.00 19.45 19.96 2rdx n ALA 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rdx h ALA 73 N 0.50 1.70 -0.54 0.00 0.00 -1.47 0.40 119.26 119.86 2rdx h ALA 73 Ca -0.44 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.49 2rdx h ALA 73 Cb 2.04 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.61 2rdx h ALA 73 CO 0.04 0.16 0.36 -1.35 0.00 0.00 0.00 179.25 178.46 2rdx h PRO 74 N 0.78 0.60 0.00 0.00 0.11 -1.78 -2.93 132.00 128.79 2rdx h PRO 74 Ca 0.35 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.42 2rdx h PRO 74 Cb 0.33 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.30 2rdx h PRO 74 CO -0.13 0.40 -0.00 1.96 -0.21 0.00 0.00 178.00 180.02 2rdx h GLN 75 N 0.62 0.00 0.00 1.05 1.08 -1.18 -3.29 115.11 113.39 2rdx h GLN 75 Ca 0.22 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.42 2rdx h GLN 75 Cb 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 2rdx h GLN 75 CO -0.06 0.00 -1.07 1.28 -0.95 0.00 0.00 178.83 178.03 2rdx n LEU 76 N -2.38 0.61 -4.76 1.46 4.77 -0.75 -4.87 117.00 111.09 2rdx n LEU 76 Ca 0.05 0.09 -0.41 0.00 -0.03 0.00 0.00 56.01 55.71 2rdx n LEU 76 Cb 0.44 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.43 2rdx n LEU 76 CO 0.31 -0.03 1.07 -0.76 -1.33 0.00 0.00 177.39 176.65 2rdx s LEU 77 N -4.35 4.39 0.00 2.23 1.43 -1.19 -2.72 118.68 118.47 2rdx s LEU 77 Ca 0.02 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 55.84 2rdx s LEU 77 Cb 0.13 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.71 2rdx s LEU 77 CO 0.80 -0.67 0.00 0.61 0.23 0.00 0.00 176.35 177.32 2rdx n GLY 78 N 1.51 2.09 3.90 -3.19 0.00 0.34 -4.91 105.19 104.93 2rdx n GLY 78 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2rdx n GLY 78 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rdx s GLN 79 N -0.50 2.69 -0.49 1.61 -1.52 -1.10 -4.36 119.66 115.99 2rdx s GLN 79 Ca 0.00 0.22 -0.17 0.00 -1.95 0.00 0.00 55.36 53.46 2rdx s GLN 79 Cb 0.00 -2.09 0.07 0.00 -0.22 0.00 0.00 33.01 30.76 2rdx s GLN 79 CO 0.00 -1.04 0.50 0.34 -0.25 0.00 0.00 175.29 174.84 2rdx s ASP 80 N -4.39 6.18 0.03 5.90 -1.08 -1.24 -1.03 116.67 121.04 2rdx s ASP 80 Ca 0.58 -1.13 0.18 0.00 -0.52 0.00 0.00 52.55 51.66 2rdx s ASP 80 Cb -0.11 -2.23 0.76 0.00 -1.46 0.00 0.00 42.92 39.87 2rdx s ASP 80 CO 0.49 -0.76 1.57 -0.81 0.52 0.00 0.00 175.17 176.18 2rdx n PRO 81 N 5.66 0.02 0.13 4.34 -0.04 -1.26 -2.74 135.00 141.10 2rdx n PRO 81 Ca -0.10 0.22 -0.02 0.00 -0.04 0.00 0.00 63.50 63.57 2rdx n PRO 81 Cb 0.44 -1.54 0.14 0.00 -0.04 0.00 0.00 33.50 32.50 2rdx n PRO 81 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rdx h ARG 82 N 0.00 0.01 -4.76 0.54 3.08 -1.92 -3.38 114.38 107.94 2rdx h ARG 82 Ca 0.00 -0.01 -0.72 0.00 0.07 0.00 0.00 59.98 59.33 2rdx h ARG 82 Cb 0.31 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.25 2rdx h ARG 82 CO 0.00 0.67 2.11 1.04 -1.07 0.00 0.00 179.97 182.71 2rdx n GLN 83 N -3.76 3.26 -0.21 0.04 6.02 -1.11 -4.79 117.38 116.83 2rdx n GLN 83 Ca -0.01 -3.36 0.07 0.00 -0.01 0.00 0.00 57.00 53.69 2rdx n GLN 83 Cb 0.65 -3.22 0.34 0.00 1.02 0.00 0.00 30.24 29.03 2rdx n GLN 83 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 177.06 175.66 2rdx h VAL 84 N 4.67 1.00 0.00 5.09 -1.51 -1.86 -0.84 116.25 122.80 2rdx h VAL 84 Ca 0.42 -0.27 -0.12 0.00 -1.23 0.00 0.00 66.70 65.51 2rdx h VAL 84 Cb 0.78 0.14 -0.02 0.00 -2.13 0.00 0.00 31.29 30.07 2rdx h VAL 84 CO 1.51 0.14 -0.55 0.00 -1.23 0.00 0.00 177.57 177.44 2rdx h ALA 85 N 1.59 0.76 -0.28 5.19 0.00 -1.96 -0.26 119.26 124.30 2rdx h ALA 85 Ca 0.35 -0.50 -0.19 0.00 0.00 0.00 0.00 54.91 54.56 2rdx h ALA 85 Cb 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2rdx h ALA 85 CO -0.13 0.69 -0.57 -0.09 0.00 0.00 0.00 179.25 179.15 2rdx h ARG 86 N 0.00 0.88 -0.30 0.00 2.43 -1.59 -2.40 114.38 113.39 2rdx h ARG 86 Ca -0.01 -0.57 -0.09 0.00 -0.81 0.00 0.00 59.98 58.50 2rdx h ARG 86 Cb 1.25 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.87 2rdx h ARG 86 CO 0.07 1.21 -0.16 0.52 -1.51 0.00 0.00 179.97 180.10 2rdx h MET 87 N 0.67 0.65 -0.26 0.20 2.86 -1.12 -1.24 114.93 116.68 2rdx h MET 87 Ca 0.01 -0.29 0.06 0.00 -2.06 0.00 0.00 59.70 57.42 2rdx h MET 87 Cb 1.18 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.77 2rdx h MET 87 CO 0.13 0.88 -0.10 1.49 1.06 0.00 0.00 176.91 180.36 2rdx h GLU 88 N 0.40 -0.05 -0.00 1.72 4.81 -1.10 0.77 114.58 121.12 2rdx h GLU 88 Ca 0.07 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.19 2rdx h GLU 88 Cb 0.69 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 2rdx h GLU 88 CO 0.05 -0.04 -0.50 0.00 -0.73 0.00 0.00 179.01 177.80 2rdx h ARG 89 N -0.06 0.01 -0.12 1.92 3.08 -1.38 -0.75 114.38 117.08 2rdx h ARG 89 Ca 0.13 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 2rdx h ARG 89 Cb 0.26 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 2rdx h ARG 89 CO -0.30 0.50 -0.06 1.25 -1.07 0.00 0.00 179.97 180.30 2rdx h LEU 90 N 0.01 0.26 -0.47 3.04 5.85 -0.92 -0.91 115.31 122.17 2rdx h LEU 90 Ca -0.00 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.31 2rdx h LEU 90 Cb 0.88 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 2rdx h LEU 90 CO 0.06 0.61 0.31 0.24 -0.34 0.00 0.00 178.44 179.32 2rdx h MET 91 N -0.10 0.62 0.00 1.25 2.86 -0.68 -0.87 114.93 118.00 2rdx h MET 91 Ca 0.03 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 2rdx h MET 91 Cb 0.51 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.03 2rdx h MET 91 CO 0.02 0.41 -0.08 -0.44 1.06 0.00 0.00 176.91 177.87 2rdx h ASP 92 N 0.63 0.00 0.49 1.22 3.32 -1.14 -1.74 116.42 119.20 2rdx h ASP 92 Ca 0.17 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 57.00 2rdx h ASP 92 Cb -0.07 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 2rdx h ASP 92 CO -0.04 0.08 -0.98 -0.74 -1.72 0.00 0.00 179.24 175.85 2rdx h HIS 93 N 0.00 0.47 -0.06 4.55 2.76 -0.27 -3.36 115.15 119.24 2rdx h HIS 93 Ca -0.00 -0.27 -0.14 0.00 -2.20 0.00 0.00 60.37 57.76 2rdx h HIS 93 Cb 0.21 -0.05 0.01 0.00 1.55 0.00 0.00 27.41 29.13 2rdx h HIS 93 CO 0.00 1.11 -0.50 -0.07 -1.30 0.00 0.00 177.93 177.17 2rdx h LEU 94 N 0.15 0.54 -8.22 0.26 3.38 -0.45 -3.46 115.31 107.52 2rdx h LEU 94 Ca -0.08 -0.69 -0.25 0.00 0.09 0.00 0.00 57.88 56.95 2rdx h LEU 94 Cb 1.63 -0.16 -0.20 0.00 0.09 0.00 0.00 40.66 42.02 2rdx h LEU 94 CO 0.16 1.15 -0.72 0.68 0.09 0.00 0.00 178.44 179.80 2rdx s VAL 95 N -3.49 0.54 0.12 1.22 -7.23 -0.73 -5.08 120.40 105.75 2rdx s VAL 95 Ca -0.13 -1.28 -0.10 0.00 -1.81 0.00 0.00 61.98 58.66 2rdx s VAL 95 Cb 0.04 -0.85 -0.06 0.00 0.56 0.00 0.00 36.38 36.07 2rdx s VAL 95 CO 0.81 -0.51 0.45 -1.10 -0.31 0.00 0.00 175.10 174.44 2rdx s GLN 96 N -2.13 3.80 3.70 4.82 -0.21 -1.26 -4.11 119.66 124.28 2rdx s GLN 96 Ca -0.05 0.24 0.00 0.00 0.02 0.00 0.00 55.36 55.57 2rdx s GLN 96 Cb -0.06 -2.93 0.00 0.00 1.00 0.00 0.00 33.01 31.01 2rdx s GLN 96 CO -0.01 0.51 0.00 0.41 -2.12 0.00 0.00 175.29 174.08 2rdx n GLY 97 N 0.71 0.58 3.82 3.09 0.00 -1.26 -4.93 105.19 107.19 2rdx n GLY 97 Ca -0.06 -0.78 -0.26 0.00 0.00 0.00 0.00 46.02 44.92 2rdx n GLY 97 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2rdx n HIS 98 N 0.51 -2.15 -0.16 1.61 8.25 -1.26 -4.89 115.22 117.13 2rdx n HIS 98 Ca 0.00 0.88 -0.06 0.00 -0.26 0.00 0.00 57.72 58.28 2rdx n HIS 98 Cb 0.00 -4.17 0.11 0.00 1.12 0.00 0.00 29.99 27.05 2rdx n HIS 98 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2rdx h GLY 99 N -2.01 1.00 1.23 -1.41 0.00 -1.89 -2.20 103.07 97.79 2rdx h GLY 99 Ca -0.59 -0.66 0.07 0.00 0.00 0.00 0.00 47.33 46.15 2rdx h GLY 99 CO 0.62 0.61 0.35 0.10 0.00 0.00 0.00 176.54 178.23 2rdx h TYR 100 N 0.87 0.42 0.01 5.60 -0.00 -1.85 0.09 116.97 122.11 2rdx h TYR 100 Ca 0.17 0.01 -0.20 0.00 0.00 0.00 0.00 58.73 58.71 2rdx h TYR 100 Cb 0.44 -0.14 -0.03 0.00 0.00 0.00 0.00 36.73 37.01 2rdx h TYR 100 CO 0.03 0.22 -0.97 0.00 -0.00 0.00 0.00 178.16 177.44 2rdx h ALA 101 N 1.73 0.41 0.00 0.10 0.00 -1.73 -3.19 119.26 116.58 2rdx h ALA 101 Ca 0.23 -0.86 -0.11 0.00 0.00 0.00 0.00 54.91 54.17 2rdx h ALA 101 Cb 0.38 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2rdx h ALA 101 CO -0.06 1.16 -0.53 0.87 0.00 0.00 0.00 179.25 180.69 2rdx h LYS 102 N 0.01 0.00 -0.82 0.00 1.57 -1.10 -3.38 116.57 112.85 2rdx h LYS 102 Ca -0.02 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 58.89 2rdx h LYS 102 Cb 1.69 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.92 2rdx h LYS 102 CO 0.13 0.52 0.42 0.00 -0.57 0.00 0.00 179.45 179.95 2rdx h ALA 103 N 1.48 1.22 -0.00 3.86 0.00 -0.98 -1.99 119.26 122.85 2rdx h ALA 103 Ca -0.01 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2rdx h ALA 103 Cb 1.40 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 2rdx h ALA 103 CO 0.07 -0.07 -0.42 -1.35 0.00 0.00 0.00 179.25 177.47 2rdx h PRO 104 N 0.62 0.00 -0.16 0.00 0.11 -1.74 -2.43 132.00 128.39 2rdx h PRO 104 Ca 0.44 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.51 2rdx h PRO 104 Cb 0.59 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.69 2rdx h PRO 104 CO -0.34 0.42 -0.05 0.74 -0.21 0.00 0.00 178.00 178.55 2rdx h PHE 105 N 0.00 0.36 -0.84 0.65 0.04 -1.67 -2.56 116.94 112.93 2rdx h PHE 105 Ca -0.00 -0.08 0.07 0.00 2.80 0.00 0.00 57.97 60.75 2rdx h PHE 105 Cb 0.74 -0.09 -0.06 0.00 2.20 0.00 0.00 35.95 38.74 2rdx h PHE 105 CO 0.00 0.61 0.51 0.22 -0.60 0.00 0.00 178.31 179.05 2rdx h ASP 106 N 0.01 0.79 -0.18 2.17 3.58 -1.35 -1.47 116.42 119.98 2rdx h ASP 106 Ca 0.04 0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.44 2rdx h ASP 106 Cb 0.50 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.39 2rdx h ASP 106 CO 0.02 0.50 -0.12 0.00 -2.88 0.00 0.00 179.24 176.76 2rdx h ALA 107 N 1.41 1.19 -0.37 -0.78 0.00 -1.43 -2.13 119.26 117.15 2rdx h ALA 107 Ca 0.37 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2rdx h ALA 107 Cb 0.21 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2rdx h ALA 107 CO -0.19 0.52 -0.18 0.00 0.00 0.00 0.00 179.25 179.40 2rdx h ALA 108 N 1.36 0.98 -0.43 0.00 0.00 -0.92 -2.24 119.26 118.02 2rdx h ALA 108 Ca 0.09 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.52 2rdx h ALA 108 Cb 0.51 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2rdx h ALA 108 CO 0.03 0.60 -0.30 0.74 0.00 0.00 0.00 179.25 180.32 2rdx h PHE 109 N 0.63 1.12 -0.57 0.00 0.04 -1.06 -1.85 116.94 115.25 2rdx h PHE 109 Ca 0.10 -0.30 -0.08 0.00 2.80 0.00 0.00 57.97 60.49 2rdx h PHE 109 Cb 0.65 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.53 2rdx h PHE 109 CO 0.03 1.13 0.03 -1.49 -0.60 0.00 0.00 178.31 177.41 2rdx h TRP 110 N 0.81 1.02 0.00 -0.55 4.06 -1.37 -1.74 115.95 118.18 2rdx h TRP 110 Ca 0.09 -0.15 -0.00 0.00 2.06 0.00 0.00 58.89 60.89 2rdx h TRP 110 Cb 0.88 -0.28 0.00 0.00 -1.00 0.00 0.00 29.16 28.76 2rdx h TRP 110 CO 0.06 0.90 -0.00 0.22 -3.56 0.00 0.00 178.44 176.05 2rdx h ASP 111 N 0.89 -0.00 -0.72 -3.49 3.58 -1.25 -0.22 116.42 115.20 2rdx h ASP 111 Ca 0.17 -0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 2rdx h ASP 111 Cb 0.47 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.49 2rdx h ASP 111 CO 0.02 0.02 0.44 0.40 -2.88 0.00 0.00 179.24 177.24 2rdx h ILE 112 N -0.03 1.20 -0.38 2.25 2.04 -1.28 -1.55 117.51 119.77 2rdx h ILE 112 Ca -0.00 -0.43 -0.00 0.00 1.00 0.00 0.00 64.86 65.43 2rdx h ILE 112 Cb 0.02 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.28 2rdx h ILE 112 CO 0.00 0.21 0.23 0.25 0.00 0.00 0.00 178.15 178.84 2rdx h LEU 113 N 0.98 0.46 -0.15 1.44 5.85 -1.13 0.58 115.31 123.34 2rdx h LEU 113 Ca 0.26 -0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.98 2rdx h LEU 113 Cb -0.05 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.81 2rdx h LEU 113 CO -0.05 0.37 -0.28 1.23 -0.34 0.00 0.00 178.44 179.37 2rdx h GLY 114 N 0.50 -0.33 1.01 3.75 0.00 -0.68 -1.47 103.07 105.86 2rdx h GLY 114 Ca 0.14 0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.82 2rdx h GLY 114 CO -0.03 -0.21 0.60 1.46 0.00 0.00 0.00 176.54 178.36 2rdx h GLN 115 N -0.34 1.23 0.00 4.80 4.20 -1.10 0.89 115.11 124.79 2rdx h GLN 115 Ca 0.11 -0.09 -0.04 0.00 0.06 0.00 0.00 58.65 58.69 2rdx h GLN 115 Cb 0.50 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 2rdx h GLN 115 CO -0.35 0.83 -0.20 0.00 -0.67 0.00 0.00 178.83 178.44 2rdx h ALA 116 N 1.33 1.26 -0.01 3.87 0.00 -0.55 -3.05 119.26 122.12 2rdx h ALA 116 Ca 0.34 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2rdx h ALA 116 Cb -0.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2rdx h ALA 116 CO -0.07 0.25 -0.57 0.25 0.00 0.00 0.00 179.25 179.11 2rdx n THR 117 N -3.71 0.00 -2.32 0.00 -2.24 -0.58 -4.99 114.28 100.44 2rdx n THR 117 Ca -0.01 -0.21 -0.14 0.00 -2.27 0.00 0.00 64.05 61.42 2rdx n THR 117 Cb 0.32 1.11 -0.00 0.00 -2.10 0.00 0.00 70.33 69.65 2rdx n THR 117 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rdx n GLY 118 N 1.30 -0.18 3.09 3.38 0.00 0.16 -5.03 105.19 107.90 2rdx n GLY 118 Ca 0.05 -0.30 -0.18 0.00 0.00 0.00 0.00 46.02 45.59 2rdx n GLY 118 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rdx s GLN 119 N -4.76 0.80 0.62 1.61 -1.52 -0.31 -4.63 119.66 111.48 2rdx s GLN 119 Ca 0.03 -0.59 -0.18 0.00 -1.95 0.00 0.00 55.36 52.67 2rdx s GLN 119 Cb -0.01 -0.76 -0.02 0.00 -0.22 0.00 0.00 33.01 32.00 2rdx s GLN 119 CO 0.03 0.19 1.20 -1.25 -0.25 0.00 0.00 175.29 175.21 2rdx s PRO 120 N -0.85 2.80 0.43 2.91 0.04 -1.24 -1.13 135.00 137.96 2rdx s PRO 120 Ca 0.01 1.77 0.12 0.00 0.04 0.00 0.00 61.00 62.94 2rdx s PRO 120 Cb -0.07 -1.91 1.00 0.00 0.04 0.00 0.00 34.50 33.56 2rdx s PRO 120 CO 0.01 -1.33 2.01 0.28 0.04 0.00 0.00 177.00 178.01 2rdx h VAL 121 N 0.58 0.96 -0.55 -0.36 2.07 -1.60 -1.23 116.25 116.13 2rdx h VAL 121 Ca -0.50 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 66.94 2rdx h VAL 121 Cb 1.29 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 2rdx h VAL 121 CO 0.54 0.08 0.36 4.11 0.02 0.00 0.00 177.57 182.68 2rdx h TRP 122 N 0.42 0.52 -0.41 1.57 5.08 -1.87 -1.46 115.95 119.80 2rdx h TRP 122 Ca 0.22 0.01 -0.02 0.00 1.08 0.00 0.00 58.89 60.19 2rdx h TRP 122 Cb 0.34 -0.17 -0.02 0.00 -3.00 0.00 0.00 29.16 26.31 2rdx h TRP 122 CO -0.00 0.29 0.18 1.98 -1.28 0.00 0.00 178.44 179.60 2rdx h MET 123 N 0.53 0.60 0.00 0.12 4.05 -1.49 -1.12 114.93 117.62 2rdx h MET 123 Ca 0.23 -0.10 0.00 0.00 -0.28 0.00 0.00 59.70 59.56 2rdx h MET 123 Cb 0.26 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.96 2rdx h MET 123 CO -0.06 0.54 0.00 -0.07 0.23 0.00 0.00 176.91 177.55 2rdx h LEU 124 N 0.51 0.00 -1.54 3.39 3.38 -1.39 -1.92 115.31 117.75 2rdx h LEU 124 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2rdx h LEU 124 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2rdx h LEU 124 CO -0.01 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.70 2rdx n LEU 125 N -2.71 2.31 0.00 1.67 4.77 -0.62 -4.93 117.00 117.49 2rdx n LEU 125 Ca 0.02 -0.96 0.00 0.00 -0.03 0.00 0.00 56.01 55.03 2rdx n LEU 125 Cb 0.29 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2rdx n LEU 125 CO 0.24 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 2rdx n GLY 126 N 1.26 1.63 0.00 -0.72 0.00 -0.73 -4.94 105.19 101.70 2rdx n GLY 126 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2rdx n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rdx n GLY 127 N 0.00 1.62 3.44 -0.02 0.00 -0.46 -4.97 105.19 104.80 2rdx n GLY 127 Ca 0.00 -2.06 -0.44 0.00 0.00 0.00 0.00 46.02 43.52 2rdx n GLY 127 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2rdx s LYS 128 N -1.34 3.44 0.03 1.61 2.20 -1.26 -4.03 119.74 120.39 2rdx s LYS 128 Ca 0.00 -1.50 0.22 0.00 -0.36 0.00 0.00 55.97 54.33 2rdx s LYS 128 Cb 0.00 -4.69 -0.04 0.00 -1.51 0.00 0.00 37.83 31.59 2rdx s LYS 128 CO 0.00 -1.76 0.95 1.28 -0.36 0.00 0.00 175.35 175.45 2rdx n LEU 129 N 6.80 0.61 -3.59 5.43 4.32 0.75 -4.65 117.00 126.66 2rdx n LEU 129 Ca 0.14 -0.11 -0.25 0.00 -0.02 0.00 0.00 56.01 55.78 2rdx n LEU 129 Cb 0.48 -0.07 -0.16 0.00 -1.62 0.00 0.00 43.42 42.04 2rdx n LEU 129 CO 0.54 0.08 -0.31 0.00 -1.22 0.00 0.00 177.39 176.48 2rdx s ASP 131 N 2.17 6.31 0.00 0.00 2.15 -1.26 -4.51 116.67 121.53 2rdx s ASP 131 Ca 0.03 -1.27 0.00 0.00 0.43 0.00 0.00 52.55 51.73 2rdx s ASP 131 Cb -0.16 -2.43 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 2rdx s ASP 131 CO -0.09 -1.36 0.00 0.61 -0.17 0.00 0.00 175.17 174.16 2rdx n GLY 132 N 5.46 -1.38 3.74 2.66 0.00 -1.26 -5.04 105.19 109.37 2rdx n GLY 132 Ca 0.06 -0.70 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 2rdx n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdx s ALA 133 N 0.00 3.32 0.67 4.61 0.00 -0.66 -4.77 121.76 124.92 2rdx s ALA 133 Ca 0.00 0.50 -0.16 0.00 0.00 0.00 0.00 51.96 52.30 2rdx s ALA 133 Cb 0.00 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.96 2rdx s ALA 133 CO 0.00 0.09 1.16 -2.14 0.00 0.00 0.00 175.76 174.87 2rdx s PRO 134 N -0.43 2.61 0.30 0.00 0.02 -1.26 -0.89 135.00 135.34 2rdx s PRO 134 Ca 0.42 1.61 0.06 0.00 0.02 0.00 0.00 61.00 63.11 2rdx s PRO 134 Cb -0.23 -1.91 -0.06 0.00 0.02 0.00 0.00 34.50 32.32 2rdx s PRO 134 CO 0.29 -1.44 -0.02 -1.64 -0.33 0.00 0.00 177.00 173.85 2rdx s MET 135 N -3.85 1.59 0.29 5.54 -1.94 -1.06 -0.27 119.30 119.59 2rdx s MET 135 Ca 0.72 -1.83 0.09 0.00 -1.71 0.00 0.00 55.69 52.96 2rdx s MET 135 Cb -0.25 -1.07 -0.06 0.00 2.01 0.00 0.00 34.83 35.46 2rdx s MET 135 CO 0.41 -0.04 -0.12 1.52 -0.01 0.00 0.00 175.02 176.78 2rdx s TYR 136 N -3.09 2.15 0.13 -0.03 -0.85 -1.26 -4.13 117.35 110.27 2rdx s TYR 136 Ca 0.32 -0.51 0.08 0.00 -0.52 0.00 0.00 57.07 56.44 2rdx s TYR 136 Cb 0.06 -1.12 -0.04 0.00 0.38 0.00 0.00 41.96 41.24 2rdx s TYR 136 CO 0.13 0.51 -0.12 1.03 -1.52 0.00 0.00 175.55 175.58 2rdx s ARG 137 N -3.62 2.00 -0.39 -3.49 1.81 -0.12 -4.98 118.95 110.17 2rdx s ARG 137 Ca 0.30 -1.15 0.02 0.00 -1.72 0.00 0.00 55.73 53.17 2rdx s ARG 137 Cb 0.00 -2.20 0.46 0.00 -0.45 0.00 0.00 34.95 32.76 2rdx s ARG 137 CO 0.13 0.47 1.80 0.28 -0.68 0.00 0.00 175.30 177.31 2rdx n VAL 138 N 0.50 2.85 -4.42 3.52 0.31 -1.26 -0.88 118.33 118.95 2rdx n VAL 138 Ca -0.13 -1.73 -0.20 0.00 -0.01 0.00 0.00 64.34 62.27 2rdx n VAL 138 Cb 0.53 -0.80 -0.10 0.00 -0.91 0.00 0.00 33.84 32.56 2rdx n VAL 138 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2rdx s ALA 139 N -2.63 2.21 0.33 3.52 0.00 -1.16 -4.79 121.76 119.25 2rdx s ALA 139 Ca 0.45 -1.99 0.01 0.00 0.00 0.00 0.00 51.96 50.44 2rdx s ALA 139 Cb 0.37 0.66 -0.00 0.00 0.00 0.00 0.00 23.12 24.14 2rdx s ALA 139 CO 0.06 -0.30 0.40 -0.35 0.00 0.00 0.00 175.76 175.56 2rdx n PRO 140 N -0.62 0.58 -3.86 0.00 -0.04 -1.26 -4.60 135.00 125.21 2rdx n PRO 140 Ca -0.02 -2.88 -0.30 0.00 -0.04 0.00 0.00 63.50 60.26 2rdx n PRO 140 Cb 0.66 2.61 -0.14 0.00 -0.04 0.00 0.00 33.50 36.60 2rdx n PRO 140 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2rdx s GLN 141 N -2.96 1.69 0.00 0.54 -0.21 -1.26 -4.97 119.66 112.49 2rdx s GLN 141 Ca 0.32 -2.36 0.00 0.00 0.02 0.00 0.00 55.36 53.33 2rdx s GLN 141 Cb 0.00 -2.92 0.00 0.00 1.00 0.00 0.00 33.01 31.09 2rdx s GLN 141 CO 0.23 -1.13 0.00 2.89 -2.12 0.00 0.00 175.29 175.16 2rdx n ARG 142 N 3.30 0.00 -0.97 2.91 1.85 -1.26 -5.11 116.66 117.39 2rdx n ARG 142 Ca 0.06 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.62 2rdx n ARG 142 Cb 0.33 0.00 0.17 0.00 -1.05 0.00 0.00 32.46 31.91 2rdx n ARG 142 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2rdx s SER 143 N 1.97 2.80 0.14 2.89 0.15 -1.26 -4.80 113.70 115.59 2rdx s SER 143 Ca 0.00 1.61 -0.16 0.00 0.70 0.00 0.00 55.95 58.10 2rdx s SER 143 Cb 0.00 -2.26 0.01 0.00 -1.71 0.00 0.00 66.02 62.05 2rdx s SER 143 CO 0.00 -3.08 1.75 -0.08 1.20 0.00 0.00 173.24 173.02 2rdx h GLU 144 N -1.85 0.57 -0.18 5.44 4.81 -1.99 0.44 114.58 121.80 2rdx h GLU 144 Ca -0.51 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 58.54 2rdx h GLU 144 Cb 1.29 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 2rdx h GLU 144 CO 0.51 0.46 -0.35 0.00 -0.73 0.00 0.00 179.01 178.91 2rdx h ALA 145 N 1.07 1.07 0.00 2.92 0.00 -1.99 -0.17 119.26 122.17 2rdx h ALA 145 Ca 0.14 -0.39 -0.15 0.00 0.00 0.00 0.00 54.91 54.52 2rdx h ALA 145 Cb 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2rdx h ALA 145 CO -0.02 0.58 -0.71 0.93 0.00 0.00 0.00 179.25 180.02 2rdx h GLU 146 N 0.32 0.00 -0.02 0.00 5.08 -1.91 -2.18 114.58 115.88 2rdx h GLU 146 Ca 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2rdx h GLU 146 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2rdx h GLU 146 CO 0.06 0.71 -0.04 1.15 -1.00 0.00 0.00 179.01 179.89 2rdx h THR 147 N 0.00 1.47 -0.96 1.13 2.02 -0.73 -2.66 112.91 113.18 2rdx h THR 147 Ca -0.01 -1.43 0.11 0.00 0.77 0.00 0.00 66.41 65.85 2rdx h THR 147 Cb 1.47 2.39 -0.08 0.00 -1.74 0.00 0.00 68.15 70.19 2rdx h THR 147 CO 0.09 0.38 0.59 0.03 0.37 0.00 0.00 175.52 176.99 2rdx h ARG 148 N -0.52 0.93 -0.16 6.66 3.08 -1.06 -0.59 114.38 122.72 2rdx h ARG 148 Ca -0.00 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 59.95 2rdx h ARG 148 Cb 0.64 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 2rdx h ARG 148 CO 0.01 0.62 -0.06 0.00 -1.07 0.00 0.00 179.97 179.47 2rdx h ALA 149 N 1.51 0.22 -0.07 0.04 0.00 -1.46 -2.04 119.26 117.47 2rdx h ALA 149 Ca 0.47 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 2rdx h ALA 149 Cb 0.43 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2rdx h ALA 149 CO -0.25 0.01 -0.52 1.49 0.00 0.00 0.00 179.25 179.97 2rdx h GLU 150 N 0.01 0.19 -0.02 0.00 4.81 -1.23 -2.45 114.58 115.88 2rdx h GLU 150 Ca 0.04 -0.11 -0.17 0.00 -0.13 0.00 0.00 59.36 58.99 2rdx h GLU 150 Cb 0.51 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2rdx h GLU 150 CO 0.02 0.66 -0.77 -0.07 -0.73 0.00 0.00 179.01 178.12 2rdx h LEU 151 N 0.15 0.21 -0.85 1.64 3.38 -1.14 -2.55 115.31 116.14 2rdx h LEU 151 Ca 0.00 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 2rdx h LEU 151 Cb 0.97 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 2rdx h LEU 151 CO 0.08 0.89 -0.40 0.00 0.09 0.00 0.00 178.44 179.11 2rdx h ALA 152 N 1.10 1.02 -0.34 1.53 0.00 -1.19 0.35 119.26 121.72 2rdx h ALA 152 Ca -0.03 -0.42 -0.15 0.00 0.00 0.00 0.00 54.91 54.32 2rdx h ALA 152 Cb 1.35 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2rdx h ALA 152 CO 0.11 0.61 -0.38 0.00 0.00 0.00 0.00 179.25 179.59 2rdx h ARG 153 N 0.31 0.83 -0.40 0.00 3.08 -1.43 -0.93 114.38 115.83 2rdx h ARG 153 Ca 0.03 -0.43 -0.09 0.00 0.07 0.00 0.00 59.98 59.56 2rdx h ARG 153 Cb 0.83 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.88 2rdx h ARG 153 CO 0.07 1.06 -0.12 0.45 -1.07 0.00 0.00 179.97 180.36 2rdx h HIS 154 N 0.68 0.88 -0.63 3.04 3.86 -1.31 -0.45 115.15 121.22 2rdx h HIS 154 Ca 0.06 -0.20 0.05 0.00 -1.16 0.00 0.00 60.37 59.12 2rdx h HIS 154 Cb 0.95 -0.21 -0.05 0.00 1.06 0.00 0.00 27.41 29.16 2rdx h HIS 154 CO 0.05 0.92 0.35 -0.09 0.86 0.00 0.00 177.93 180.03 2rdx h ARG 155 N 0.59 0.65 -0.06 2.45 2.43 -0.89 0.60 114.38 120.15 2rdx h ARG 155 Ca 0.10 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 2rdx h ARG 155 Cb 0.65 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 2rdx h ARG 155 CO 0.04 0.43 -0.38 0.00 -1.51 0.00 0.00 179.97 178.55 2rdx h ALA 156 N 1.31 1.25 0.00 2.80 0.00 -1.08 -2.77 119.26 120.78 2rdx h ALA 156 Ca 0.27 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2rdx h ALA 156 Cb 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2rdx h ALA 156 CO -0.16 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.62 2rdx n ALA 157 N -2.47 1.95 0.00 0.00 0.00 -0.19 -4.88 120.51 114.92 2rdx n ALA 157 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2rdx n ALA 157 Cb 0.44 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2rdx n ALA 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rdx n GLY 158 N 0.63 1.25 3.78 0.00 0.00 -0.66 -2.67 105.19 107.52 2rdx n GLY 158 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 2rdx n GLY 158 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2rdx s TYR 159 N -2.00 3.60 0.00 1.61 1.51 0.11 -4.56 117.35 117.63 2rdx s TYR 159 Ca 0.00 0.86 0.00 0.00 -1.01 0.00 0.00 57.07 56.92 2rdx s TYR 159 Cb 0.00 -2.36 0.00 0.00 -0.11 0.00 0.00 41.96 39.49 2rdx s TYR 159 CO 0.00 0.42 0.54 -2.13 -1.11 0.00 0.00 175.55 173.27 2rdx n ARG 160 N 2.75 0.57 -4.68 -0.62 0.63 -1.26 -3.91 116.66 110.14 2rdx n ARG 160 Ca -0.12 -0.64 -0.25 0.00 -0.92 0.00 0.00 57.85 55.93 2rdx n ARG 160 Cb 0.52 -0.63 -0.16 0.00 0.45 0.00 0.00 32.46 32.64 2rdx n ARG 160 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2rdx s GLN 161 N -0.21 1.60 -0.04 -0.14 -0.21 -1.26 -1.70 119.66 117.70 2rdx s GLN 161 Ca 0.00 -0.50 0.01 0.00 0.02 0.00 0.00 55.36 54.89 2rdx s GLN 161 Cb 0.00 -1.38 0.02 0.00 1.00 0.00 0.00 33.01 32.65 2rdx s GLN 161 CO 0.00 0.16 -0.05 -0.06 -2.12 0.00 0.00 175.29 173.22 2rdx s PHE 162 N 0.22 0.78 -0.25 0.91 0.40 -0.10 -0.94 117.98 119.00 2rdx s PHE 162 Ca -0.06 -0.22 -0.11 0.00 -0.60 0.00 0.00 56.93 55.94 2rdx s PHE 162 Cb -0.12 -0.66 -0.05 0.00 0.51 0.00 0.00 43.02 42.70 2rdx s PHE 162 CO 0.02 -0.18 0.17 -1.14 0.70 0.00 0.00 175.22 174.79 2rdx s GLN 163 N 0.79 4.02 -0.44 0.44 0.74 -0.06 -0.99 119.66 124.17 2rdx s GLN 163 Ca -0.11 -0.29 -0.17 0.00 0.05 0.00 0.00 55.36 54.84 2rdx s GLN 163 Cb -0.14 -3.57 0.03 0.00 1.10 0.00 0.00 33.01 30.44 2rdx s GLN 163 CO 0.01 -0.02 0.42 0.42 -0.55 0.00 0.00 175.29 175.56 2rdx s ILE 164 N 1.29 5.13 -0.35 -2.34 1.01 0.14 -2.98 121.20 123.09 2rdx s ILE 164 Ca 0.07 -0.56 -0.28 0.00 0.00 0.00 0.00 60.65 59.88 2rdx s ILE 164 Cb -0.14 -4.06 -0.02 0.00 0.01 0.00 0.00 42.46 38.25 2rdx s ILE 164 CO 0.07 -0.46 1.78 -0.54 0.00 0.00 0.00 174.94 175.78 2rdx s LYS 165 N 1.99 3.31 0.24 2.79 3.01 -1.26 -1.62 119.74 128.20 2rdx s LYS 165 Ca 0.09 1.35 0.03 0.00 -1.01 0.00 0.00 55.97 56.44 2rdx s LYS 165 Cb -0.19 -4.20 -0.01 0.00 -1.01 0.00 0.00 37.83 32.42 2rdx s LYS 165 CO 0.11 -1.89 0.12 1.33 0.51 0.00 0.00 175.35 175.53 2rdx n VAL 166 N 7.38 0.00 0.00 3.17 0.24 -0.78 -4.98 118.33 123.36 2rdx n VAL 166 Ca 0.22 -1.49 0.00 0.00 -2.04 0.00 0.00 64.34 61.04 2rdx n VAL 166 Cb 0.47 0.60 0.00 0.00 -1.47 0.00 0.00 33.84 33.45 2rdx n VAL 166 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2rdx n GLY 167 N 0.12 1.20 0.10 7.63 0.00 -1.26 -3.83 105.19 109.14 2rdx n GLY 167 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 2rdx n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdx n ALA 168 N -0.33 2.58 -3.10 4.61 0.00 -0.93 -3.62 120.51 119.73 2rdx n ALA 168 Ca 0.00 -0.27 0.04 0.00 0.00 0.00 0.00 53.44 53.20 2rdx n ALA 168 Cb 0.00 -1.06 -0.00 0.00 0.00 0.00 0.00 19.45 18.39 2rdx n ALA 168 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2rdx s ASP 169 N -5.20 -1.01 0.45 0.00 2.15 -1.26 -4.77 116.67 107.03 2rdx s ASP 169 Ca -0.01 -0.09 0.29 0.00 0.43 0.00 0.00 52.55 53.16 2rdx s ASP 169 Cb 0.10 1.51 1.36 0.00 -0.30 0.00 0.00 42.92 45.59 2rdx s ASP 169 CO 0.81 -0.16 1.71 4.11 -0.17 0.00 0.00 175.17 181.46 2rdx h TRP 170 N 7.16 0.43 -0.05 -5.34 5.08 -1.92 -0.82 115.95 120.49 2rdx h TRP 170 Ca -0.03 0.02 -0.12 0.00 1.08 0.00 0.00 58.89 59.84 2rdx h TRP 170 Cb 1.19 -0.12 0.01 0.00 -3.00 0.00 0.00 29.16 27.24 2rdx h TRP 170 CO 0.05 -0.05 -0.44 0.37 -1.28 0.00 0.00 178.44 177.09 2rdx h GLN 171 N 0.18 0.39 0.00 0.12 4.15 -1.97 -2.14 115.11 115.84 2rdx h GLN 171 Ca 0.70 -0.35 0.00 0.00 0.77 0.00 0.00 58.65 59.77 2rdx h GLN 171 Cb 2.21 0.08 0.00 0.00 0.21 0.00 0.00 27.48 29.98 2rdx h GLN 171 CO -0.26 1.00 -0.55 0.66 -1.93 0.00 0.00 178.83 177.74 2rdx h SER 172 N -0.10 0.00 0.12 -0.69 4.64 -1.93 -3.23 113.55 112.36 2rdx h SER 172 Ca -0.04 -0.12 -0.10 0.00 -0.47 0.00 0.00 61.79 61.05 2rdx h SER 172 Cb 1.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 2rdx h SER 172 CO 0.09 0.06 -0.35 0.44 -0.87 0.00 0.00 176.83 176.20 2rdx h ASP 173 N 0.00 0.33 -0.17 4.97 3.45 -1.10 -1.19 116.42 122.71 2rdx h ASP 173 Ca 0.00 -0.13 0.01 0.00 0.43 0.00 0.00 57.03 57.34 2rdx h ASP 173 Cb 0.82 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 39.48 2rdx h ASP 173 CO 0.00 0.67 0.08 0.40 -1.57 0.00 0.00 179.24 178.82 2rdx h ILE 174 N 0.28 1.00 -0.50 0.35 2.04 -1.40 -1.98 117.51 117.30 2rdx h ILE 174 Ca 0.03 -0.06 -0.05 0.00 1.00 0.00 0.00 64.86 65.78 2rdx h ILE 174 Cb 0.75 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 2rdx h ILE 174 CO 0.06 0.03 0.12 0.44 0.00 0.00 0.00 178.15 178.80 2rdx h ASP 175 N 0.18 0.77 -0.46 1.72 3.32 -1.61 -1.21 116.42 119.13 2rdx h ASP 175 Ca 0.07 -0.24 0.09 0.00 0.02 0.00 0.00 57.03 56.97 2rdx h ASP 175 Cb 0.01 -0.20 -0.08 0.00 0.22 0.00 0.00 39.33 39.29 2rdx h ASP 175 CO -0.05 0.80 -0.00 -0.09 -1.72 0.00 0.00 179.24 178.18 2rdx h ARG 176 N 0.69 0.10 -0.05 3.56 9.65 -1.09 0.29 114.38 127.54 2rdx h ARG 176 Ca 0.16 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.03 2rdx h ARG 176 Cb 0.34 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 28.89 2rdx h ARG 176 CO 0.00 0.07 0.02 0.82 2.80 0.00 0.00 179.97 183.68 2rdx h ILE 177 N 0.11 1.12 0.00 1.20 2.04 -1.12 -2.60 117.51 118.25 2rdx h ILE 177 Ca 0.23 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 2rdx h ILE 177 Cb 0.34 1.26 -0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2rdx h ILE 177 CO -0.39 0.10 -0.09 0.03 0.00 0.00 0.00 178.15 177.80 2rdx h ARG 178 N -0.06 0.00 0.04 2.37 3.08 -0.86 -2.51 114.38 116.44 2rdx h ARG 178 Ca 0.02 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.79 2rdx h ARG 178 Cb 0.14 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.21 2rdx h ARG 178 CO -0.00 0.09 -1.10 0.00 -1.07 0.00 0.00 179.97 177.89 2rdx h ALA 179 N 1.91 0.12 0.05 0.04 0.00 -0.83 -3.39 119.26 117.16 2rdx h ALA 179 Ca -0.00 -0.73 -0.12 0.00 0.00 0.00 0.00 54.91 54.06 2rdx h ALA 179 Cb 0.18 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.05 2rdx h ALA 179 CO 0.01 0.71 -0.52 0.00 0.00 0.00 0.00 179.25 179.45 2rdx h LEU 181 N -0.42 0.28 0.00 0.00 3.38 -1.65 -1.42 115.31 115.48 2rdx h LEU 181 Ca -0.08 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2rdx h LEU 181 Cb 1.33 0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.14 2rdx h LEU 181 CO 0.10 0.14 0.00 -2.65 0.09 0.00 0.00 178.44 176.12 2rdx n PRO 182 N -4.98 0.42 0.00 1.13 -0.02 -1.26 -1.56 135.00 128.73 2rdx n PRO 182 Ca 0.11 0.06 0.11 0.00 -2.02 0.00 0.00 63.50 61.75 2rdx n PRO 182 Cb 0.32 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.27 2rdx n PRO 182 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2rdx n LEU 183 N -1.13 1.66 -4.90 2.45 4.32 -0.54 -4.92 117.00 113.95 2rdx n LEU 183 Ca 0.11 -0.65 -0.29 0.00 -0.02 0.00 0.00 56.01 55.16 2rdx n LEU 183 Cb 0.09 -0.01 -0.03 0.00 -1.62 0.00 0.00 43.42 41.86 2rdx n LEU 183 CO 0.11 0.33 0.25 -0.76 -1.22 0.00 0.00 177.39 176.11 2rdx s LEU 184 N -2.65 4.01 0.40 2.23 1.02 -0.60 -4.98 118.68 118.11 2rdx s LEU 184 Ca 0.15 0.80 -0.00 0.00 0.02 0.00 0.00 54.13 55.10 2rdx s LEU 184 Cb 0.17 -3.63 -0.02 0.00 0.02 0.00 0.00 46.19 42.73 2rdx s LEU 184 CO 0.67 -0.23 0.62 -1.61 0.02 0.00 0.00 176.35 175.82 2rdx s GLU 185 N -3.60 3.31 0.00 1.70 2.02 -1.26 -5.03 118.70 115.84 2rdx s GLU 185 Ca 0.45 -0.35 0.00 0.00 0.02 0.00 0.00 54.97 55.10 2rdx s GLU 185 Cb -0.11 -2.59 0.00 0.00 0.10 0.00 0.00 34.13 31.53 2rdx s GLU 185 CO 0.30 -0.06 0.23 -2.30 0.02 0.00 0.00 175.26 173.45 2rdx n PRO 186 N -1.96 0.00 -0.35 0.39 -0.02 -1.26 -2.45 135.00 129.35 2rdx n PRO 186 Ca -0.02 0.23 0.04 0.00 -2.02 0.00 0.00 63.50 61.73 2rdx n PRO 186 Cb 0.57 -0.38 0.18 0.00 -0.02 0.00 0.00 33.50 33.84 2rdx n PRO 186 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rdx n GLY 187 N -0.83 1.81 3.77 -1.23 0.00 -1.26 -4.91 105.19 102.55 2rdx n GLY 187 Ca 0.00 -0.40 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 2rdx n GLY 187 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2rdx s GLU 188 N -1.74 4.64 -0.08 1.61 2.02 -1.02 -5.02 118.70 119.10 2rdx s GLU 188 Ca 0.24 1.28 -0.14 0.00 0.02 0.00 0.00 54.97 56.37 2rdx s GLU 188 Cb 0.17 -3.13 -0.05 0.00 0.10 0.00 0.00 34.13 31.22 2rdx s GLU 188 CO 0.09 0.48 0.34 0.15 0.02 0.00 0.00 175.26 176.33 2rdx s LYS 189 N -1.43 3.98 -0.11 1.61 1.02 -0.69 -4.95 119.74 119.17 2rdx s LYS 189 Ca 0.41 0.23 0.03 0.00 0.02 0.00 0.00 55.97 56.66 2rdx s LYS 189 Cb -0.23 -3.30 0.01 0.00 -0.52 0.00 0.00 37.83 33.80 2rdx s LYS 189 CO 0.27 0.52 -0.20 0.00 -0.92 0.00 0.00 175.35 175.02 2rdx s ALA 190 N -0.44 2.02 -0.22 5.17 0.00 -1.26 -0.93 121.76 126.11 2rdx s ALA 190 Ca 0.20 -0.92 -0.05 0.00 0.00 0.00 0.00 51.96 51.20 2rdx s ALA 190 Cb -0.15 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.09 2rdx s ALA 190 CO 0.09 0.08 -0.01 0.00 0.00 0.00 0.00 175.76 175.91 2rdx s MET 191 N 0.69 3.50 -0.68 0.00 0.23 -0.16 0.41 119.30 123.29 2rdx s MET 191 Ca -0.11 -0.57 -0.21 0.00 -1.03 0.00 0.00 55.69 53.77 2rdx s MET 191 Cb -0.16 -3.08 0.09 0.00 -1.53 0.00 0.00 34.83 30.15 2rdx s MET 191 CO 0.02 -0.13 0.91 0.00 -2.03 0.00 0.00 175.02 173.79 2rdx s ALA 192 N 1.34 3.25 -0.47 3.16 0.00 0.44 0.25 121.76 129.74 2rdx s ALA 192 Ca 0.04 -2.10 -0.17 0.00 0.00 0.00 0.00 51.96 49.73 2rdx s ALA 192 Cb -0.15 -3.79 0.05 0.00 0.00 0.00 0.00 23.12 19.24 2rdx s ALA 192 CO -0.00 -2.68 0.48 0.34 0.00 0.00 0.00 175.76 173.90 2rdx s ASP 193 N 3.64 6.18 0.00 0.00 -1.08 -0.64 -0.76 116.67 124.02 2rdx s ASP 193 Ca 0.20 -1.00 0.29 0.00 -0.52 0.00 0.00 52.55 51.52 2rdx s ASP 193 Cb -0.17 -2.23 1.16 0.00 -1.46 0.00 0.00 42.92 40.21 2rdx s ASP 193 CO 0.06 -0.70 1.87 0.00 0.52 0.00 0.00 175.17 176.92 2rdx n ALA 194 N 5.63 2.48 -4.02 3.66 0.00 -0.93 -1.86 120.51 125.48 2rdx n ALA 194 Ca -0.09 -0.13 -0.28 0.00 0.00 0.00 0.00 53.44 52.93 2rdx n ALA 194 Cb 0.45 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.45 2rdx n ALA 194 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2rdx n ASN 195 N -1.49 -0.71 -0.34 0.00 5.03 -1.23 -1.35 115.26 115.17 2rdx n ASN 195 Ca 0.07 -1.09 -0.04 0.00 0.87 0.00 0.00 54.58 54.39 2rdx n ASN 195 Cb 0.34 -2.67 -0.02 0.00 -1.02 0.00 0.00 39.78 36.41 2rdx n ASN 195 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2rdx n GLN 196 N -4.46 -0.84 0.04 3.52 6.02 -0.61 -4.50 117.38 116.54 2rdx n GLN 196 Ca -0.28 0.51 -0.06 0.00 -0.01 0.00 0.00 57.00 57.16 2rdx n GLN 196 Cb 0.67 -4.32 -0.11 0.00 1.02 0.00 0.00 30.24 27.51 2rdx n GLN 196 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2rdx h GLY 197 N 0.00 0.00 -3.36 1.08 0.00 -1.25 -3.18 103.07 96.37 2rdx h GLY 197 Ca -0.09 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.74 2rdx h GLY 197 CO 0.13 0.00 0.19 -0.98 0.00 0.00 0.00 176.54 175.89 2rdx s TRP 198 N -2.73 3.64 0.46 5.60 0.51 -0.62 -4.71 118.94 121.10 2rdx s TRP 198 Ca -0.01 1.52 -0.21 0.00 -2.12 0.00 0.00 56.10 55.29 2rdx s TRP 198 Cb 0.09 -2.72 -0.09 0.00 -0.81 0.00 0.00 33.47 29.94 2rdx s TRP 198 CO 0.81 0.27 1.02 0.50 -0.51 0.00 0.00 176.95 179.05 2rdx s ARG 199 N -2.08 3.92 0.27 4.98 3.52 -1.26 -4.46 118.95 123.85 2rdx s ARG 199 Ca 0.46 1.34 -0.01 0.00 -0.13 0.00 0.00 55.73 57.39 2rdx s ARG 199 Cb -0.17 -2.17 0.47 0.00 -1.56 0.00 0.00 34.95 31.52 2rdx s ARG 199 CO 0.22 -0.32 1.87 -0.24 -0.81 0.00 0.00 175.30 176.01 2rdx h VAL 200 N 1.70 1.03 -0.33 7.11 3.04 -1.94 -1.10 116.25 125.76 2rdx h VAL 200 Ca -0.49 -0.38 -0.12 0.00 -1.01 0.00 0.00 66.70 64.70 2rdx h VAL 200 Cb 1.21 -0.18 -0.01 0.00 -2.01 0.00 0.00 31.29 30.30 2rdx h VAL 200 CO 0.60 0.20 -0.28 -2.24 -1.01 0.00 0.00 177.57 174.84 2rdx h ASP 201 N 1.11 0.69 0.34 3.17 2.03 -1.99 -2.48 116.42 119.28 2rdx h ASP 201 Ca 0.46 -0.26 -0.20 0.00 -0.73 0.00 0.00 57.03 56.29 2rdx h ASP 201 Cb 0.29 -0.19 -0.00 0.00 -0.83 0.00 0.00 39.33 38.60 2rdx h ASP 201 CO -0.21 0.93 -0.84 0.78 -1.03 0.00 0.00 179.24 178.88 2rdx h ASN 202 N 0.58 0.47 -0.62 4.15 2.35 -1.75 -1.76 115.58 118.99 2rdx h ASN 202 Ca 0.07 -0.35 -0.06 0.00 -0.55 0.00 0.00 56.30 55.41 2rdx h ASN 202 Cb 0.77 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.97 2rdx h ASN 202 CO 0.06 1.12 0.15 0.00 -1.65 0.00 0.00 177.43 177.11 2rdx h ALA 203 N 0.86 1.04 -0.42 -0.83 0.00 -1.17 -2.05 119.26 116.69 2rdx h ALA 203 Ca -0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 2rdx h ALA 203 Cb 1.45 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 2rdx h ALA 203 CO 0.14 0.63 0.14 0.82 0.00 0.00 0.00 179.25 180.98 2rdx h ILE 204 N 0.98 1.22 -0.50 0.00 2.04 -1.30 -1.01 117.51 118.93 2rdx h ILE 204 Ca 0.21 -0.70 0.07 0.00 1.00 0.00 0.00 64.86 65.43 2rdx h ILE 204 Cb 0.35 0.89 -0.06 0.00 -0.74 0.00 0.00 36.82 37.26 2rdx h ILE 204 CO 0.00 0.25 0.16 0.03 0.00 0.00 0.00 178.15 178.59 2rdx h ARG 205 N 0.53 0.31 -0.52 2.37 3.08 -1.11 -0.19 114.38 118.86 2rdx h ARG 205 Ca 0.14 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 2rdx h ARG 205 Cb 0.25 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 2rdx h ARG 205 CO -0.01 0.21 0.31 1.25 -1.07 0.00 0.00 179.97 180.66 2rdx h LEU 206 N 0.32 0.62 -0.74 3.04 6.46 -1.22 -0.86 115.31 122.92 2rdx h LEU 206 Ca 0.24 -0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.93 2rdx h LEU 206 Cb 0.28 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 40.02 2rdx h LEU 206 CO -0.27 0.49 0.40 0.00 -0.62 0.00 0.00 178.44 178.45 2rdx h ALA 207 N 1.15 0.95 -0.50 1.25 0.00 -0.71 -1.85 119.26 119.56 2rdx h ALA 207 Ca 0.19 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2rdx h ALA 207 Cb -0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2rdx h ALA 207 CO -0.03 0.48 -0.18 0.00 0.00 0.00 0.00 179.25 179.51 2rdx h ARG 208 N 1.03 1.01 0.00 0.00 3.08 -0.83 -2.10 114.38 116.57 2rdx h ARG 208 Ca 0.26 -0.41 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2rdx h ARG 208 Cb 0.05 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.06 2rdx h ARG 208 CO -0.04 1.10 0.00 0.00 -1.07 0.00 0.00 179.97 179.96 2rdx n ALA 209 N -2.51 2.19 -1.20 0.04 0.00 -0.35 -3.27 120.51 115.42 2rdx n ALA 209 Ca 0.01 -0.01 0.07 0.00 0.00 0.00 0.00 53.44 53.51 2rdx n ALA 209 Cb 0.44 -1.46 0.19 0.00 0.00 0.00 0.00 19.45 18.62 2rdx n ALA 209 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2rdx n THR 210 N -2.26 2.12 0.32 0.00 -2.24 -0.71 -4.78 114.28 106.74 2rdx n THR 210 Ca 0.05 -2.42 0.14 0.00 -2.27 0.00 0.00 64.05 59.55 2rdx n THR 210 Cb 0.40 -0.25 0.62 0.00 -2.10 0.00 0.00 70.33 69.00 2rdx n THR 210 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 2rdx h ARG 211 N 0.72 0.00 -0.38 -0.78 0.11 -1.36 -2.54 114.38 110.14 2rdx h ARG 211 Ca 0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.11 2rdx h ARG 211 Cb 1.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.27 2rdx h ARG 211 CO 0.10 0.00 0.00 -0.40 0.10 0.00 0.00 179.97 179.77 2rdx n ASP 212 N -2.52 1.83 -4.32 0.08 5.75 -1.26 -4.93 116.55 111.18 2rdx n ASP 212 Ca 0.01 -2.06 -0.28 0.00 -0.01 0.00 0.00 54.79 52.45 2rdx n ASP 212 Cb 0.20 -0.26 -0.14 0.00 -1.03 0.00 0.00 41.12 39.89 2rdx n ASP 212 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2rdx s LEU 213 N -1.02 2.21 -0.53 -2.12 1.43 -0.96 -5.09 118.68 112.60 2rdx s LEU 213 Ca 0.21 -0.61 -0.15 0.00 -1.03 0.00 0.00 54.13 52.55 2rdx s LEU 213 Cb 0.12 -1.14 0.13 0.00 0.03 0.00 0.00 46.19 45.33 2rdx s LEU 213 CO 0.13 0.19 0.48 -0.62 0.23 0.00 0.00 176.35 176.76 2rdx s ASP 214 N -1.46 6.11 0.25 2.29 2.15 -1.26 -4.93 116.67 119.82 2rdx s ASP 214 Ca 0.10 -1.82 -0.15 0.00 0.43 0.00 0.00 52.55 51.12 2rdx s ASP 214 Cb -0.10 -2.18 0.00 0.00 -0.30 0.00 0.00 42.92 40.35 2rdx s ASP 214 CO 0.03 -0.83 0.53 -0.72 -0.17 0.00 0.00 175.17 174.01 2rdx s TYR 215 N 1.55 0.24 -0.23 -5.34 -0.85 -1.26 -4.73 117.35 106.72 2rdx s TYR 215 Ca 0.04 -0.62 -0.15 0.00 -0.52 0.00 0.00 57.07 55.82 2rdx s TYR 215 Cb -0.29 0.30 -0.04 0.00 0.38 0.00 0.00 41.96 42.31 2rdx s TYR 215 CO 0.02 -1.04 0.35 0.42 -1.52 0.00 0.00 175.55 173.78 2rdx s ILE 216 N -4.00 5.22 -0.38 -3.49 1.01 0.16 -4.03 121.20 115.70 2rdx s ILE 216 Ca 0.20 0.57 -0.24 0.00 0.00 0.00 0.00 60.65 61.18 2rdx s ILE 216 Cb -0.02 -3.68 0.01 0.00 0.01 0.00 0.00 42.46 38.79 2rdx s ILE 216 CO 0.08 0.23 0.81 -0.22 0.00 0.00 0.00 174.94 175.85 2rdx s LEU 217 N 1.54 4.11 -0.18 2.97 2.96 0.43 -0.42 118.68 130.10 2rdx s LEU 217 Ca 0.16 0.34 -0.02 0.00 -0.22 0.00 0.00 54.13 54.38 2rdx s LEU 217 Cb -0.15 -3.07 -0.01 0.00 0.50 0.00 0.00 46.19 43.46 2rdx s LEU 217 CO 0.08 -0.78 -0.09 -0.70 -1.32 0.00 0.00 176.35 173.54 2rdx s GLU 218 N 3.21 3.38 -0.73 1.98 2.12 0.06 -1.01 118.70 127.71 2rdx s GLU 218 Ca 0.33 -0.65 -0.16 0.00 0.36 0.00 0.00 54.97 54.85 2rdx s GLU 218 Cb -0.13 -2.82 0.02 0.00 0.26 0.00 0.00 34.13 31.47 2rdx s GLU 218 CO 0.18 0.01 0.44 0.94 -0.54 0.00 0.00 175.26 176.29 2rdx n GLN 219 N 4.16 -0.67 0.24 4.30 -0.06 0.17 -2.19 117.38 123.33 2rdx n GLN 219 Ca -0.18 0.08 0.10 0.00 -2.00 0.00 0.00 57.00 55.00 2rdx n GLN 219 Cb 0.52 -1.37 0.59 0.00 -4.06 0.00 0.00 30.24 25.92 2rdx n GLN 219 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 2rdx h PRO 220 N -0.46 0.00 -4.94 3.69 0.13 -1.86 -1.63 132.00 126.93 2rdx h PRO 220 Ca -0.47 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.31 2rdx h PRO 220 Cb 0.94 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.93 2rdx h PRO 220 CO 0.31 0.19 -0.63 0.00 -0.23 0.00 0.00 178.00 177.64 2rdx h ARG 222 N 2.43 -0.49 -7.10 0.00 2.43 -1.80 -3.39 114.38 106.46 2rdx h ARG 222 Ca -0.38 0.03 -0.50 0.00 -0.81 0.00 0.00 59.98 58.32 2rdx h ARG 222 Cb 1.23 0.11 0.04 0.00 -0.42 0.00 0.00 29.97 30.93 2rdx h ARG 222 CO 0.63 -0.33 0.25 -1.54 -1.51 0.00 0.00 179.97 177.47 2rdx s SER 223 N -3.20 6.32 0.16 -3.80 1.04 -1.26 -4.66 113.70 108.29 2rdx s SER 223 Ca -0.07 1.19 -0.15 0.00 0.48 0.00 0.00 55.95 57.40 2rdx s SER 223 Cb 0.01 -2.36 0.06 0.00 0.10 0.00 0.00 66.02 63.82 2rdx s SER 223 CO 0.22 -0.67 1.79 0.22 0.98 0.00 0.00 173.24 175.79 2rdx h TYR 224 N 0.21 0.43 -0.50 5.02 3.20 -1.94 -2.33 116.97 121.07 2rdx h TYR 224 Ca -0.46 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.47 2rdx h TYR 224 Cb 1.20 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 39.29 2rdx h TYR 224 CO 0.62 0.24 0.26 0.93 -1.64 0.00 0.00 178.16 178.57 2rdx h GLU 225 N 0.47 0.49 -0.32 1.82 3.07 -1.99 0.28 114.58 118.41 2rdx h GLU 225 Ca 0.17 -0.03 0.05 0.00 -0.50 0.00 0.00 59.36 59.05 2rdx h GLU 225 Cb 0.04 -0.11 -0.05 0.00 -0.84 0.00 0.00 28.75 27.79 2rdx h GLU 225 CO -0.09 0.33 0.03 0.93 -1.40 0.00 0.00 179.01 178.80 2rdx h GLU 226 N 0.51 0.13 -0.86 2.33 5.08 -1.93 -0.12 114.58 119.71 2rdx h GLU 226 Ca 0.21 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.58 2rdx h GLU 226 Cb 0.10 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 2rdx h GLU 226 CO -0.14 0.08 0.57 0.00 -1.00 0.00 0.00 179.01 178.52 2rdx h GLN 228 N 1.14 0.88 -0.22 0.00 1.08 -0.50 -0.11 115.11 117.36 2rdx h GLN 228 Ca 0.32 -0.22 -0.05 0.00 -1.45 0.00 0.00 58.65 57.25 2rdx h GLN 228 Cb -0.10 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.21 2rdx h GLN 228 CO -0.08 0.84 -0.10 0.37 -0.95 0.00 0.00 178.83 178.91 2rdx h GLN 229 N 0.83 0.36 -0.29 1.46 4.15 -0.31 -2.23 115.11 119.07 2rdx h GLN 229 Ca 0.17 -0.09 -0.18 0.00 0.77 0.00 0.00 58.65 59.32 2rdx h GLN 229 Cb 0.41 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.05 2rdx h GLN 229 CO 0.01 0.47 -0.52 0.28 -1.93 0.00 0.00 178.83 177.14 2rdx h VAL 230 N 0.34 1.28 0.00 2.39 2.07 -0.80 -3.22 116.25 118.31 2rdx h VAL 230 Ca 0.07 -1.71 -0.00 0.00 0.82 0.00 0.00 66.70 65.88 2rdx h VAL 230 Cb 0.40 1.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 2rdx h VAL 230 CO 0.02 0.56 -0.02 -0.09 0.02 0.00 0.00 177.57 178.06 2rdx h ARG 231 N 0.66 0.00 -0.08 1.57 2.43 -0.47 -0.69 114.38 117.79 2rdx h ARG 231 Ca 0.02 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.16 2rdx h ARG 231 Cb 1.12 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 2rdx h ARG 231 CO 0.12 0.02 -0.08 -0.09 -1.51 0.00 0.00 179.97 178.43 2rdx h ARG 232 N 0.00 0.12 0.00 0.20 2.43 -1.42 -3.25 114.38 112.45 2rdx h ARG 232 Ca -0.00 -0.02 -0.27 0.00 -0.81 0.00 0.00 59.98 58.89 2rdx h ARG 232 Cb 0.08 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.56 2rdx h ARG 232 CO 0.00 0.21 -2.00 0.28 -1.51 0.00 0.00 179.97 176.94 2rdx n VAL 233 N -4.38 1.01 -2.90 0.20 0.31 -0.76 -4.98 118.33 106.83 2rdx n VAL 233 Ca -0.02 -0.49 -0.42 0.00 -0.01 0.00 0.00 64.34 63.40 2rdx n VAL 233 Cb 0.19 -0.89 -0.04 0.00 -0.91 0.00 0.00 33.84 32.19 2rdx n VAL 233 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2rdx s ALA 234 N -2.35 3.64 -0.65 3.52 0.00 -0.34 -4.93 121.76 120.65 2rdx s ALA 234 Ca -0.16 -0.13 0.24 0.00 0.00 0.00 0.00 51.96 51.91 2rdx s ALA 234 Cb 0.05 -3.27 0.31 0.00 0.00 0.00 0.00 23.12 20.21 2rdx s ALA 234 CO 0.50 -0.90 1.29 -0.25 0.00 0.00 0.00 175.76 176.39 2rdx n ASP 235 N 5.93 0.68 -4.66 0.00 8.00 -1.26 -4.68 116.55 120.55 2rdx n ASP 235 Ca 0.05 0.07 -0.38 0.00 0.71 0.00 0.00 54.79 55.24 2rdx n ASP 235 Cb 0.48 0.25 0.05 0.00 -0.02 0.00 0.00 41.12 41.88 2rdx n ASP 235 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2rdx n GLN 236 N -2.07 1.12 -1.69 -1.24 3.00 -1.26 -4.88 117.38 110.36 2rdx n GLN 236 Ca 0.03 0.43 -0.44 0.00 -0.01 0.00 0.00 57.00 57.00 2rdx n GLN 236 Cb 0.44 -2.32 -0.03 0.00 0.00 0.00 0.00 30.24 28.32 2rdx n GLN 236 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 2rdx n PRO 237 N -1.16 2.28 -4.07 -1.09 -0.02 -1.26 -4.76 135.00 124.92 2rdx n PRO 237 Ca 0.13 0.82 -0.34 0.00 -2.02 0.00 0.00 63.50 62.09 2rdx n PRO 237 Cb 0.46 -2.57 -0.10 0.00 -0.02 0.00 0.00 33.50 31.28 2rdx n PRO 237 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2rdx s MET 238 N 0.33 3.90 -0.19 -0.52 1.75 -1.26 -0.43 119.30 122.88 2rdx s MET 238 Ca 0.73 -0.37 -0.05 0.00 -1.25 0.00 0.00 55.69 54.75 2rdx s MET 238 Cb -0.62 -3.16 -0.02 0.00 2.84 0.00 0.00 34.83 33.87 2rdx s MET 238 CO 0.42 0.29 -0.01 0.21 -0.65 0.00 0.00 175.02 175.28 2rdx s LYS 239 N 0.31 3.62 -0.11 4.11 2.20 -0.18 -0.46 119.74 129.22 2rdx s LYS 239 Ca 0.02 -0.52 -0.05 0.00 -0.36 0.00 0.00 55.97 55.06 2rdx s LYS 239 Cb -0.13 -3.03 -0.04 0.00 -1.51 0.00 0.00 37.83 33.12 2rdx s LYS 239 CO 0.01 0.06 0.08 -0.51 -0.36 0.00 0.00 175.35 174.63 2rdx s LEU 240 N 0.86 4.04 0.00 5.43 1.43 -0.44 -0.65 118.68 129.35 2rdx s LEU 240 Ca 0.00 0.32 0.00 0.00 -1.03 0.00 0.00 54.13 53.42 2rdx s LEU 240 Cb -0.14 -1.97 0.00 0.00 0.03 0.00 0.00 46.19 44.11 2rdx s LEU 240 CO 0.02 0.38 0.00 -0.67 0.23 0.00 0.00 176.35 176.31 2rdx n ASP 241 N 2.17 0.00 0.23 2.29 -0.08 -1.26 0.32 116.55 120.23 2rdx n ASP 241 Ca -0.19 0.00 0.16 0.00 -1.51 0.00 0.00 54.79 53.25 2rdx n ASP 241 Cb 0.54 0.00 0.68 0.00 2.34 0.00 0.00 41.12 44.69 2rdx n ASP 241 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2rdx h GLU 242 N 0.00 0.00 0.00 -0.67 3.07 -1.94 -0.31 114.58 114.73 2rdx h GLU 242 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2rdx h GLU 242 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2rdx h GLU 242 CO 0.00 0.00 -0.27 0.00 -1.40 0.00 0.00 179.01 177.34 2rdx s VAL 244 N -3.06 4.10 -2.04 0.00 1.01 -0.13 -4.75 120.40 115.53 2rdx s VAL 244 Ca 0.11 -1.51 0.23 0.00 0.00 0.00 0.00 61.98 60.81 2rdx s VAL 244 Cb 0.16 -5.13 0.05 0.00 0.00 0.00 0.00 36.38 31.47 2rdx s VAL 244 CO 0.63 -1.97 1.18 0.35 0.00 0.00 0.00 175.10 175.30 2rdx n THR 245 N 6.48 0.00 -2.52 3.92 -2.24 -1.26 -4.63 114.28 114.03 2rdx n THR 245 Ca 0.42 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.95 2rdx n THR 245 Cb 0.48 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.83 2rdx n THR 245 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rdx n GLY 246 N 1.40 -1.62 0.34 3.38 0.00 -1.26 -4.38 105.19 103.05 2rdx n GLY 246 Ca 0.10 -1.11 -0.05 0.00 0.00 0.00 0.00 46.02 44.96 2rdx n GLY 246 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2rdx h LEU 247 N 0.00 1.04 -0.97 0.99 5.85 -1.93 -1.33 115.31 118.96 2rdx h LEU 247 Ca 0.00 -0.16 -0.10 0.00 0.84 0.00 0.00 57.88 58.45 2rdx h LEU 247 Cb 0.00 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 2rdx h LEU 247 CO 0.00 0.93 -0.50 0.45 -0.34 0.00 0.00 178.44 178.98 2rdx h HIS 248 N 1.10 0.00 -0.09 1.25 3.86 -1.99 0.15 115.15 119.44 2rdx h HIS 248 Ca 0.25 0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 59.25 2rdx h HIS 248 Cb 0.22 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.70 2rdx h HIS 248 CO 0.02 0.50 -0.79 1.98 0.86 0.00 0.00 177.93 180.50 2rdx h MET 249 N 0.00 0.68 -0.71 2.45 1.85 -1.89 -3.07 114.93 114.24 2rdx h MET 249 Ca -0.00 -0.62 0.13 0.00 -0.61 0.00 0.00 59.70 58.59 2rdx h MET 249 Cb 0.91 0.15 -0.09 0.00 0.43 0.00 0.00 31.60 33.00 2rdx h MET 249 CO 0.06 1.23 0.28 0.00 -0.40 0.00 0.00 176.91 178.08 2rdx h ALA 250 N 0.47 0.98 -0.37 0.39 0.00 -0.63 -0.73 119.26 119.37 2rdx h ALA 250 Ca -0.07 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2rdx h ALA 250 Cb 1.44 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 2rdx h ALA 250 CO 0.16 -0.20 -0.04 1.96 0.00 0.00 0.00 179.25 181.13 2rdx h GLN 251 N 0.44 0.60 0.00 0.00 4.20 -0.76 -1.54 115.11 118.05 2rdx h GLN 251 Ca 0.38 -0.15 -0.13 0.00 0.06 0.00 0.00 58.65 58.81 2rdx h GLN 251 Cb 0.54 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 2rdx h GLN 251 CO -0.37 0.65 -0.85 0.07 -0.67 0.00 0.00 178.83 177.66 2rdx h ARG 252 N 0.56 0.00 -0.30 1.46 0.11 -1.29 -1.83 114.38 113.09 2rdx h ARG 252 Ca 0.11 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.16 2rdx h ARG 252 Cb 0.43 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.49 2rdx h ARG 252 CO 0.02 0.42 0.07 0.82 0.10 0.00 0.00 179.97 181.40 2rdx h ILE 253 N 0.00 1.22 -0.23 0.08 2.04 -0.94 -2.31 117.51 117.37 2rdx h ILE 253 Ca -0.06 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 65.04 2rdx h ILE 253 Cb 1.45 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 38.66 2rdx h ILE 253 CO 0.06 0.25 0.12 0.58 0.00 0.00 0.00 178.15 179.16 2rdx h VAL 254 N 0.32 1.12 -0.77 1.67 2.07 -1.31 0.18 116.25 119.52 2rdx h VAL 254 Ca 0.09 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 2rdx h VAL 254 Cb 0.31 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 30.96 2rdx h VAL 254 CO 0.00 0.12 0.46 0.00 0.02 0.00 0.00 177.57 178.17 2rdx h ALA 255 N 1.00 1.35 -0.00 1.67 0.00 -1.30 -1.68 119.26 120.30 2rdx h ALA 255 Ca 0.08 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2rdx h ALA 255 Cb 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2rdx h ALA 255 CO -0.01 0.55 -0.18 -0.25 0.00 0.00 0.00 179.25 179.36 2rdx n ASP 256 N -4.38 0.65 -4.09 0.00 8.00 -0.87 -4.93 116.55 110.93 2rdx n ASP 256 Ca 0.08 -0.63 -0.45 0.00 0.71 0.00 0.00 54.79 54.50 2rdx n ASP 256 Cb 0.07 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.19 2rdx n ASP 256 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2rdx n ARG 257 N -0.89 -0.33 0.00 -1.24 5.12 -0.58 -4.89 116.66 113.84 2rdx n ARG 257 Ca 0.13 0.08 0.14 0.00 -1.93 0.00 0.00 57.85 56.27 2rdx n ARG 257 Cb 0.31 -2.65 0.63 0.00 -1.16 0.00 0.00 32.46 29.60 2rdx n ARG 257 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2rdx n GLY 258 N -2.12 -1.07 3.41 -0.13 0.00 0.52 -4.90 105.19 100.91 2rdx n GLY 258 Ca -0.13 -0.23 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 2rdx n GLY 258 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdx s ALA 259 N -2.54 -1.07 -0.13 4.61 0.00 -1.26 -4.94 121.76 116.42 2rdx s ALA 259 Ca 0.27 -0.00 0.21 0.00 0.00 0.00 0.00 51.96 52.44 2rdx s ALA 259 Cb 0.20 0.79 -0.19 0.00 0.00 0.00 0.00 23.12 23.92 2rdx s ALA 259 CO 0.48 -0.73 0.67 0.39 0.00 0.00 0.00 175.76 176.57 2rdx n GLU 260 N -0.30 0.64 -3.80 0.00 4.71 0.40 -4.92 120.64 117.36 2rdx n GLU 260 Ca -0.14 -0.01 -0.13 0.00 -0.01 0.00 0.00 57.16 56.87 2rdx n GLU 260 Cb 0.64 -1.66 -0.14 0.00 -1.01 0.00 0.00 31.44 29.26 2rdx n GLU 260 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2rdx s ILE 261 N -3.26 -0.02 -0.20 -3.67 1.01 -0.93 -4.20 121.20 109.93 2rdx s ILE 261 Ca -0.05 0.08 -0.03 0.00 0.00 0.00 0.00 60.65 60.65 2rdx s ILE 261 Cb 0.11 -0.16 -0.01 0.00 0.01 0.00 0.00 42.46 42.41 2rdx s ILE 261 CO 0.85 0.03 -0.06 0.00 0.00 0.00 0.00 174.94 175.76 2rdx s LEU 264 N 0.93 4.84 -0.26 0.00 1.43 0.92 -4.57 118.68 121.97 2rdx s LEU 264 Ca 0.29 -1.98 -0.17 0.00 -1.03 0.00 0.00 54.13 51.24 2rdx s LEU 264 Cb -0.16 -1.72 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 2rdx s LEU 264 CO 0.12 -0.43 0.50 -0.54 0.23 0.00 0.00 176.35 176.22 2rdx s LYS 265 N 1.05 4.06 0.18 1.70 1.02 -1.26 -0.65 119.74 125.85 2rdx s LYS 265 Ca 0.07 0.28 -0.14 0.00 0.02 0.00 0.00 55.97 56.20 2rdx s LYS 265 Cb -0.21 -3.65 0.17 0.00 -0.52 0.00 0.00 37.83 33.62 2rdx s LYS 265 CO -0.05 -0.34 1.68 0.82 -0.92 0.00 0.00 175.35 176.53 2rdx h ILE 266 N 5.40 0.59 0.00 2.17 2.04 -1.45 -1.12 117.51 125.14 2rdx h ILE 266 Ca -0.29 -0.03 -0.12 0.00 1.00 0.00 0.00 64.86 65.42 2rdx h ILE 266 Cb 1.14 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 2rdx h ILE 266 CO 0.70 0.01 -0.55 0.77 0.00 0.00 0.00 178.15 179.09 2rdx h SER 267 N 0.08 0.00 0.52 1.72 4.64 -1.88 -0.74 113.55 117.89 2rdx h SER 267 Ca 0.24 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.48 2rdx h SER 267 Cb 0.36 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 2rdx h SER 267 CO -0.43 0.55 -0.39 -1.13 -0.87 0.00 0.00 176.83 174.56 2rdx h ASN 268 N 0.00 0.00 0.40 4.97 -1.24 -1.63 -2.91 115.58 115.17 2rdx h ASN 268 Ca -0.01 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.00 2rdx h ASN 268 Cb 1.02 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.07 2rdx h ASN 268 CO 0.07 0.39 -0.36 0.18 -1.29 0.00 0.00 177.43 176.43 2rdx n LEU 269 N -3.87 0.69 0.00 0.34 4.77 -0.56 -4.65 117.00 113.72 2rdx n LEU 269 Ca -0.01 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2rdx n LEU 269 Cb 0.45 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2rdx n LEU 269 CO 0.38 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 2rdx n GLY 270 N 1.42 1.05 0.00 -0.72 0.00 -0.86 -4.47 105.19 101.61 2rdx n GLY 270 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2rdx n GLY 270 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rdx n GLY 271 N -1.95 3.07 0.38 -0.02 0.00 -0.34 -4.20 105.19 102.13 2rdx n GLY 271 Ca 0.00 -2.02 0.15 0.00 0.00 0.00 0.00 46.02 44.15 2rdx n GLY 271 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2rdx h LEU 272 N 0.00 0.43 -0.20 0.99 5.85 -1.83 -0.71 115.31 119.85 2rdx h LEU 272 Ca 0.00 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 2rdx h LEU 272 Cb 0.00 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 2rdx h LEU 272 CO 0.00 0.22 0.05 0.28 -0.34 0.00 0.00 178.44 178.65 2rdx h SER 273 N 0.46 0.30 0.34 1.25 0.02 -1.90 -1.63 113.55 112.39 2rdx h SER 273 Ca 0.38 -0.23 -0.21 0.00 -0.84 0.00 0.00 61.79 60.89 2rdx h SER 273 Cb 0.81 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.27 2rdx h SER 273 CO -0.13 0.45 -0.86 0.11 -1.14 0.00 0.00 176.83 175.27 2rdx h LYS 274 N 0.13 0.38 -0.52 3.45 1.57 -1.79 -3.10 116.57 116.69 2rdx h LYS 274 Ca 0.06 -0.37 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 2rdx h LYS 274 Cb 0.27 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 2rdx h LYS 274 CO 0.00 1.04 0.30 0.00 -0.57 0.00 0.00 179.45 180.22 2rdx h ALA 275 N 0.84 0.66 -0.40 3.86 0.00 -1.13 -1.45 119.26 121.65 2rdx h ALA 275 Ca -0.06 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2rdx h ALA 275 Cb 1.47 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 2rdx h ALA 275 CO 0.15 0.17 0.18 -0.09 0.00 0.00 0.00 179.25 179.65 2rdx h ARG 276 N 0.69 0.35 -0.15 0.00 1.12 -1.37 -1.03 114.38 114.00 2rdx h ARG 276 Ca 0.18 -0.02 -0.10 0.00 -1.11 0.00 0.00 59.98 58.93 2rdx h ARG 276 Cb 0.02 -0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 29.89 2rdx h ARG 276 CO -0.03 0.23 -0.36 0.00 -3.11 0.00 0.00 179.97 176.70 2rdx h ARG 277 N 0.36 0.33 -0.08 0.20 3.08 -1.39 -1.89 114.38 114.99 2rdx h ARG 277 Ca 0.18 -0.14 -0.22 0.00 0.07 0.00 0.00 59.98 59.86 2rdx h ARG 277 Cb 0.11 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.17 2rdx h ARG 277 CO -0.15 0.65 -0.82 1.15 -1.07 0.00 0.00 179.97 179.73 2rdx h THR 278 N 0.28 1.30 -0.40 2.04 2.02 -1.11 -2.54 112.91 114.50 2rdx h THR 278 Ca 0.03 -2.05 0.07 0.00 0.77 0.00 0.00 66.41 65.23 2rdx h THR 278 Cb 0.77 2.19 -0.09 0.00 -1.74 0.00 0.00 68.15 69.29 2rdx h THR 278 CO 0.06 0.64 -0.41 -0.09 0.37 0.00 0.00 175.52 176.09 2rdx h ARG 279 N 0.39 -0.31 -0.78 6.66 1.12 -1.05 -1.53 114.38 118.89 2rdx h ARG 279 Ca -0.08 0.02 -0.05 0.00 -1.11 0.00 0.00 59.98 58.76 2rdx h ARG 279 Cb 1.47 0.07 -0.03 0.00 -0.01 0.00 0.00 29.97 31.46 2rdx h ARG 279 CO 0.17 -0.20 0.28 -0.44 -3.11 0.00 0.00 179.97 176.66 2rdx h ASP 280 N -0.32 1.10 -0.19 -3.80 5.19 -1.38 0.64 116.42 117.66 2rdx h ASP 280 Ca 0.14 -0.19 -0.01 0.00 -0.62 0.00 0.00 57.03 56.35 2rdx h ASP 280 Cb 0.58 -0.29 -0.01 0.00 0.18 0.00 0.00 39.33 39.79 2rdx h ASP 280 CO -0.57 0.99 0.06 0.15 -3.12 0.00 0.00 179.24 176.76 2rdx h PHE 281 N 1.14 0.30 -0.57 4.55 3.57 -1.36 -1.81 116.94 122.77 2rdx h PHE 281 Ca 0.26 -0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.63 2rdx h PHE 281 Cb 0.26 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 2rdx h PHE 281 CO 0.02 0.38 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.37 2rdx h LEU 282 N 0.13 1.00 -0.40 0.59 3.38 -0.83 -2.37 115.31 116.81 2rdx h LEU 282 Ca 0.06 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 2rdx h LEU 282 Cb 0.22 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2rdx h LEU 282 CO -0.00 1.07 0.04 0.40 0.09 0.00 0.00 178.44 180.04 2rdx h ILE 283 N 0.92 1.25 0.00 1.22 1.08 -0.88 0.13 117.51 121.23 2rdx h ILE 283 Ca 0.16 -0.93 0.00 0.00 -0.39 0.00 0.00 64.86 63.70 2rdx h ILE 283 Cb 0.59 1.08 0.00 0.00 -3.07 0.00 0.00 36.82 35.42 2rdx h ILE 283 CO 0.04 0.31 0.00 0.44 -0.69 0.00 0.00 178.15 178.25 2rdx h ASP 284 N 0.51 0.00 -0.73 1.72 3.32 -1.28 0.50 116.42 120.47 2rdx h ASP 284 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2rdx h ASP 284 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 2rdx h ASP 284 CO 0.01 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.12 2rdx n ASN 285 N -2.79 4.15 -3.70 6.45 3.02 -0.90 -4.98 115.26 116.52 2rdx n ASN 285 Ca -0.01 -2.09 -0.25 0.00 -0.03 0.00 0.00 54.58 52.20 2rdx n ASN 285 Cb 0.17 -0.51 0.06 0.00 -0.61 0.00 0.00 39.78 38.88 2rdx n ASN 285 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2rdx n ARG 286 N 1.57 -6.75 -3.63 3.52 1.74 0.17 -4.99 116.66 108.28 2rdx n ARG 286 Ca 0.25 0.73 -0.38 0.00 -0.77 0.00 0.00 57.85 57.69 2rdx n ARG 286 Cb 0.68 -5.69 -0.11 0.00 -1.02 0.00 0.00 32.46 26.32 2rdx n ARG 286 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 2rdx s MET 287 N -6.30 3.88 0.28 5.56 1.75 0.36 -5.01 119.30 119.83 2rdx s MET 287 Ca 0.50 -0.36 -0.30 0.00 -1.25 0.00 0.00 55.69 54.28 2rdx s MET 287 Cb -0.24 -3.57 -0.13 0.00 2.84 0.00 0.00 34.83 33.74 2rdx s MET 287 CO 0.77 -0.18 1.46 -2.30 -0.65 0.00 0.00 175.02 174.12 2rdx n PRO 288 N 5.01 2.31 -4.25 4.11 -0.02 -1.26 -4.18 135.00 136.72 2rdx n PRO 288 Ca -0.15 0.82 -0.16 0.00 -2.02 0.00 0.00 63.50 61.99 2rdx n PRO 288 Cb 0.52 -2.51 -0.11 0.00 -0.02 0.00 0.00 33.50 31.38 2rdx n PRO 288 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2rdx s VAL 289 N -0.24 1.28 -0.14 -1.45 -7.23 0.01 -1.67 120.40 110.97 2rdx s VAL 289 Ca 0.64 -1.88 -0.00 0.00 -1.81 0.00 0.00 61.98 58.93 2rdx s VAL 289 Cb -0.58 -1.67 -0.01 0.00 0.56 0.00 0.00 36.38 34.68 2rdx s VAL 289 CO 0.52 -0.56 -0.13 -0.69 -0.31 0.00 0.00 175.10 173.92 2rdx s VAL 290 N -2.66 2.98 -0.38 1.32 1.01 -0.71 -0.18 120.40 121.78 2rdx s VAL 290 Ca 0.13 -0.68 -0.12 0.00 0.00 0.00 0.00 61.98 61.31 2rdx s VAL 290 Cb -0.02 -2.26 0.03 0.00 0.00 0.00 0.00 36.38 34.13 2rdx s VAL 290 CO 0.02 0.52 0.22 0.00 0.00 0.00 0.00 175.10 175.87 2rdx s ALA 291 N 0.48 3.31 0.00 5.51 0.00 -1.09 -0.06 121.76 129.92 2rdx s ALA 291 Ca -0.09 -1.72 0.00 0.00 0.00 0.00 0.00 51.96 50.14 2rdx s ALA 291 Cb -0.16 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 20.31 2rdx s ALA 291 CO 0.04 -1.40 0.00 -0.85 0.00 0.00 0.00 175.76 173.55 2rdx n GLU 292 N 5.03 0.00 -4.03 0.00 0.28 0.18 -4.32 120.64 117.77 2rdx n GLU 292 Ca -0.12 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.76 2rdx n GLU 292 Cb 0.46 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.30 2rdx n GLU 292 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2rdx s ASP 293 N 1.80 0.59 0.05 -1.84 -1.08 -1.26 -1.07 116.67 113.86 2rdx s ASP 293 Ca 0.00 -1.33 -0.23 0.00 -0.52 0.00 0.00 52.55 50.47 2rdx s ASP 293 Cb 0.00 0.67 -0.15 0.00 -1.46 0.00 0.00 42.92 41.98 2rdx s ASP 293 CO 0.00 -1.32 1.52 0.77 0.52 0.00 0.00 175.17 176.67 2rdx h SER 294 N 2.13 0.10 -5.65 -0.34 4.64 -1.92 -3.47 113.55 109.03 2rdx h SER 294 Ca -0.29 -0.24 0.34 0.00 -0.47 0.00 0.00 61.79 61.13 2rdx h SER 294 Cb 1.24 -0.03 -0.13 0.00 -0.31 0.00 0.00 62.40 63.17 2rdx h SER 294 CO 0.39 0.31 0.88 0.86 -0.87 0.00 0.00 176.83 178.40 2rdx s TRP 295 N -5.24 -0.04 0.00 4.77 -0.11 -1.16 -4.35 118.94 112.83 2rdx s TRP 295 Ca -0.14 -0.03 0.00 0.00 1.22 0.00 0.00 56.10 57.15 2rdx s TRP 295 Cb 0.05 0.53 0.00 0.00 -1.50 0.00 0.00 33.47 32.55 2rdx s TRP 295 CO 0.68 -0.19 0.00 0.41 -4.62 0.00 0.00 176.95 173.23 2rdx n GLY 296 N -0.44 1.18 0.00 5.86 0.00 -1.26 -4.11 105.19 106.42 2rdx n GLY 296 Ca -0.08 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.24 2rdx n GLY 296 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rdx n GLY 297 N -1.70 1.02 0.24 -0.02 0.00 -1.26 -2.86 105.19 100.61 2rdx n GLY 297 Ca 0.00 -1.70 0.02 0.00 0.00 0.00 0.00 46.02 44.35 2rdx n GLY 297 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2rdx h GLU 298 N 0.00 0.26 -0.06 1.61 3.07 -1.91 -0.55 114.58 117.00 2rdx h GLU 298 Ca 0.00 -0.06 -0.07 0.00 -0.50 0.00 0.00 59.36 58.73 2rdx h GLU 298 Cb 0.00 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 2rdx h GLU 298 CO 0.00 0.39 -0.23 0.82 -1.40 0.00 0.00 179.01 178.59 2rdx h ILE 299 N 0.25 1.44 -0.68 3.13 2.04 -1.90 0.32 117.51 122.11 2rdx h ILE 299 Ca 0.05 -1.64 0.02 0.00 1.00 0.00 0.00 64.86 64.30 2rdx h ILE 299 Cb 0.37 2.33 -0.04 0.00 -0.74 0.00 0.00 36.82 38.74 2rdx h ILE 299 CO 0.02 0.46 0.43 0.00 0.00 0.00 0.00 178.15 179.06 2rdx h ALA 300 N 0.43 0.89 -0.17 1.87 0.00 -1.78 -3.07 119.26 117.43 2rdx h ALA 300 Ca -0.01 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2rdx h ALA 300 Cb 0.87 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2rdx h ALA 300 CO 0.05 0.22 -0.25 0.77 0.00 0.00 0.00 179.25 180.03 2rdx h SER 301 N 0.86 0.30 -0.67 0.00 0.02 -1.03 -2.81 113.55 110.22 2rdx h SER 301 Ca 0.27 -0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 61.06 2rdx h SER 301 Cb -0.01 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.42 2rdx h SER 301 CO -0.09 0.56 0.17 0.00 -1.14 0.00 0.00 176.83 176.33 2rdx h ALA 302 N 1.46 0.88 -0.60 3.77 0.00 -0.84 -2.04 119.26 121.89 2rdx h ALA 302 Ca 0.04 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 2rdx h ALA 302 Cb 0.60 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2rdx h ALA 302 CO 0.04 0.59 -0.01 0.00 0.00 0.00 0.00 179.25 179.88 2rdx h ALA 303 N 1.07 0.82 -0.83 0.00 0.00 -1.49 -2.79 119.26 116.03 2rdx h ALA 303 Ca 0.21 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2rdx h ALA 303 Cb 0.36 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2rdx h ALA 303 CO 0.00 0.67 0.50 0.28 0.00 0.00 0.00 179.25 180.70 2rdx h VAL 304 N 0.97 1.23 -0.21 0.00 2.07 -1.28 -1.64 116.25 117.39 2rdx h VAL 304 Ca 0.17 -0.52 -0.16 0.00 0.82 0.00 0.00 66.70 67.01 2rdx h VAL 304 Cb 0.57 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2rdx h VAL 304 CO 0.03 0.25 -0.53 0.00 0.02 0.00 0.00 177.57 177.34 2rdx h ALA 305 N 1.27 0.66 -0.27 1.67 0.00 -1.29 0.79 119.26 122.09 2rdx h ALA 305 Ca 0.30 -0.51 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2rdx h ALA 305 Cb -0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2rdx h ALA 305 CO -0.06 0.68 -0.24 0.45 0.00 0.00 0.00 179.25 180.09 2rdx h HIS 306 N 0.49 0.76 -0.64 0.00 3.86 -1.34 -0.95 115.15 117.32 2rdx h HIS 306 Ca 0.01 -0.22 0.08 0.00 -1.16 0.00 0.00 60.37 59.08 2rdx h HIS 306 Cb 1.09 -0.16 -0.07 0.00 1.06 0.00 0.00 27.41 29.33 2rdx h HIS 306 CO 0.05 0.94 0.30 0.35 0.86 0.00 0.00 177.93 180.43 2rdx h PHE 307 N 0.36 0.55 -0.46 2.45 3.57 -1.18 -2.14 116.94 120.09 2rdx h PHE 307 Ca 0.05 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.49 2rdx h PHE 307 Cb 0.80 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.37 2rdx h PHE 307 CO 0.07 0.20 -0.05 0.00 -2.23 0.00 0.00 178.31 176.31 2rdx h ALA 308 N 1.39 0.62 0.00 2.41 0.00 -0.77 -3.18 119.26 119.73 2rdx h ALA 308 Ca 0.31 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2rdx h ALA 308 Cb 0.31 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2rdx h ALA 308 CO -0.25 0.46 -0.11 0.00 0.00 0.00 0.00 179.25 179.35 2rdx h ALA 309 N 0.90 1.06 -0.61 0.00 0.00 -0.83 -2.37 119.26 117.40 2rdx h ALA 309 Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2rdx h ALA 309 Cb 0.57 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2rdx h ALA 309 CO 0.03 0.14 0.00 -1.13 0.00 0.00 0.00 179.25 178.29 2rdx n SER 310 N -3.31 4.83 -4.69 0.00 3.41 -0.84 -0.18 113.62 112.84 2rdx n SER 310 Ca -0.00 -2.54 -0.35 0.00 -0.26 0.00 0.00 58.87 55.72 2rdx n SER 310 Cb 0.33 -0.58 -0.09 0.00 -0.26 0.00 0.00 64.21 63.61 2rdx n SER 310 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2rdx s THR 311 N -2.02 5.21 -0.22 6.66 2.01 -0.89 -4.78 115.64 121.61 2rdx s THR 311 Ca 0.51 0.12 -0.41 0.00 0.31 0.00 0.00 61.69 62.21 2rdx s THR 311 Cb 0.34 -3.37 -0.17 0.00 0.01 0.00 0.00 72.50 69.30 2rdx s THR 311 CO 0.22 0.44 1.56 -2.65 -0.69 0.00 0.00 174.62 173.50 2rdx n PRO 312 N 3.62 0.79 -0.26 4.92 -0.02 -1.26 -3.46 135.00 139.33 2rdx n PRO 312 Ca -0.16 0.29 0.18 0.00 -2.02 0.00 0.00 63.50 61.79 2rdx n PRO 312 Cb 0.52 -1.91 0.48 0.00 -0.02 0.00 0.00 33.50 32.57 2rdx n PRO 312 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2rdx h GLU 313 N 5.74 0.46 -0.95 -0.52 4.81 -1.85 -0.77 114.58 121.50 2rdx h GLU 313 Ca -0.47 -0.03 0.10 0.00 -0.13 0.00 0.00 59.36 58.84 2rdx h GLU 313 Cb 1.34 -0.10 -0.08 0.00 0.63 0.00 0.00 28.75 30.54 2rdx h GLU 313 CO 0.89 0.31 0.59 1.49 -0.73 0.00 0.00 179.01 181.56 2rdx h GLU 314 N 0.48 0.94 -0.01 1.92 4.81 -1.89 -3.15 114.58 117.68 2rdx h GLU 314 Ca 0.48 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.66 2rdx h GLU 314 Cb 1.11 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.28 2rdx h GLU 314 CO -0.21 0.62 -0.30 1.19 -0.73 0.00 0.00 179.01 179.59 2rdx n PHE 315 N -4.64 0.00 -2.55 0.92 3.72 -0.57 -4.93 117.46 109.42 2rdx n PHE 315 Ca 0.17 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.14 2rdx n PHE 315 Cb 0.30 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.82 2rdx n PHE 315 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2rdx s LEU 316 N -1.89 3.68 -0.04 4.37 2.96 -0.40 -0.81 118.68 126.55 2rdx s LEU 316 Ca 0.08 0.67 -0.24 0.00 -0.22 0.00 0.00 54.13 54.42 2rdx s LEU 316 Cb 0.09 -3.55 -0.18 0.00 0.50 0.00 0.00 46.19 43.05 2rdx s LEU 316 CO 0.32 -1.22 1.03 0.40 -1.32 0.00 0.00 176.35 175.56 2rdx h ILE 317 N 6.19 1.08 -2.64 6.68 1.08 -0.89 -3.46 117.51 125.54 2rdx h ILE 317 Ca -0.24 -1.17 0.12 0.00 -0.39 0.00 0.00 64.86 63.19 2rdx h ILE 317 Cb 1.07 1.77 -0.06 0.00 -3.07 0.00 0.00 36.82 36.53 2rdx h ILE 317 CO 1.10 0.26 0.38 0.54 -0.69 0.00 0.00 178.15 179.74 2rdx s ASN 318 N -5.56 -0.19 0.00 1.72 2.20 -1.26 -4.68 114.94 107.18 2rdx s ASN 318 Ca -0.14 -0.55 0.00 0.00 -0.94 0.00 0.00 52.86 51.23 2rdx s ASN 318 Cb 0.01 0.60 0.00 0.00 -2.00 0.00 0.00 41.25 39.86 2rdx s ASN 318 CO 0.56 -1.13 0.00 -0.24 -2.94 0.00 0.00 177.10 173.35 2rdx n SER 319 N -0.56 0.69 -3.79 3.54 2.88 0.62 -2.67 113.62 114.33 2rdx n SER 319 Ca -0.05 -0.88 -0.13 0.00 -1.33 0.00 0.00 58.87 56.48 2rdx n SER 319 Cb 0.60 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.96 2rdx n SER 319 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2rdx s THR 320 N -1.50 0.04 -1.18 2.46 -1.32 -1.26 -4.16 115.64 108.73 2rdx s THR 320 Ca 0.00 -0.34 -0.10 0.00 -1.21 0.00 0.00 61.69 60.04 2rdx s THR 320 Cb 0.00 -0.50 0.23 0.00 -1.51 0.00 0.00 72.50 70.72 2rdx s THR 320 CO 0.00 -0.19 1.42 -0.90 -2.21 0.00 0.00 174.62 172.74 2rdx n ASP 321 N 1.94 5.48 -0.07 8.08 5.75 -1.26 -4.89 116.55 131.58 2rdx n ASP 321 Ca -0.18 -3.09 0.10 0.00 -0.01 0.00 0.00 54.79 51.61 2rdx n ASP 321 Cb 0.57 -1.45 0.48 0.00 -1.03 0.00 0.00 41.12 39.69 2rdx n ASP 321 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 2rdx h LEU 322 N 7.79 0.39 -1.83 -2.12 3.38 -1.91 -1.71 115.31 119.30 2rdx h LEU 322 Ca 0.27 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.22 2rdx h LEU 322 Cb 0.79 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 2rdx h LEU 322 CO 1.25 0.25 -0.13 0.00 0.09 0.00 0.00 178.44 179.90 2rdx h MET 323 N 0.44 0.00 -0.02 1.13 -0.00 -1.71 -2.80 114.93 111.96 2rdx h MET 323 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.95 2rdx h MET 323 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.02 2rdx h MET 323 CO -0.07 0.13 0.00 0.09 -0.00 0.00 0.00 176.91 177.06 2rdx n ASN 324 N -4.14 0.53 -0.28 -0.10 3.02 -0.64 -3.10 115.26 110.55 2rdx n ASN 324 Ca -0.02 -1.30 0.12 0.00 -0.03 0.00 0.00 54.58 53.35 2rdx n ASN 324 Cb 0.21 -0.01 0.24 0.00 -0.61 0.00 0.00 39.78 39.61 2rdx n ASN 324 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2rdx n TYR 325 N -0.53 0.00 -4.37 3.10 4.02 -1.06 -4.94 117.16 113.39 2rdx n TYR 325 Ca 0.20 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.82 2rdx n TYR 325 Cb 0.18 -0.09 -0.11 0.00 -0.02 0.00 0.00 39.34 39.30 2rdx n TYR 325 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 2rdx s ASN 326 N -2.56 3.81 0.00 7.72 0.01 -1.18 -0.87 114.94 121.87 2rdx s ASN 326 Ca 0.21 -0.75 0.26 0.00 -0.71 0.00 0.00 52.86 51.87 2rdx s ASN 326 Cb 0.19 -0.47 0.70 0.00 0.41 0.00 0.00 41.25 42.08 2rdx s ASN 326 CO 0.57 0.11 1.54 0.35 -1.51 0.00 0.00 177.10 178.15 2rdx n THR 327 N 0.10 0.00 -4.40 1.60 -2.24 -0.74 -4.77 114.28 103.82 2rdx n THR 327 Ca -0.11 -0.04 -0.20 0.00 -2.27 0.00 0.00 64.05 61.43 2rdx n THR 327 Cb 0.56 0.20 -0.10 0.00 -2.10 0.00 0.00 70.33 68.88 2rdx n THR 327 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2rdx s ARG 328 N -2.82 1.57 0.09 -0.78 0.52 -1.26 -5.00 118.95 111.26 2rdx s ARG 328 Ca 0.16 -1.86 0.08 0.00 -0.52 0.00 0.00 55.73 53.60 2rdx s ARG 328 Cb 0.18 -0.67 -0.03 0.00 0.52 0.00 0.00 34.95 34.95 2rdx s ARG 328 CO 0.62 -0.22 -0.22 -1.12 0.02 0.00 0.00 175.30 174.38 2rdx s SER 329 N -3.43 2.63 -0.02 0.23 0.01 -1.26 -4.91 113.70 106.95 2rdx s SER 329 Ca 0.37 -0.64 0.17 0.00 1.31 0.00 0.00 55.95 57.16 2rdx s SER 329 Cb 0.08 -0.17 -0.26 0.00 0.21 0.00 0.00 66.02 65.88 2rdx s SER 329 CO 0.15 0.11 0.39 0.35 0.41 0.00 0.00 173.24 174.64 2rdx n THR 330 N 1.33 0.00 -3.95 1.44 -2.24 -1.26 -4.61 114.28 104.99 2rdx n THR 330 Ca -0.19 -0.38 -0.09 0.00 -2.27 0.00 0.00 64.05 61.13 2rdx n THR 330 Cb 0.53 0.14 -0.09 0.00 -2.10 0.00 0.00 70.33 68.82 2rdx n THR 330 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2rdx s GLY 331 N -3.91 0.22 -0.19 3.38 0.00 -1.26 -1.37 107.32 104.19 2rdx s GLY 331 Ca -0.06 -0.75 -0.13 0.00 0.00 0.00 0.00 44.72 43.78 2rdx s GLY 331 CO 0.71 -0.90 0.24 1.08 0.00 0.00 0.00 173.10 174.23 2rdx s LEU 332 N -2.60 4.21 0.00 0.66 1.02 0.18 -4.64 118.68 117.51 2rdx s LEU 332 Ca 0.02 0.38 0.00 0.00 0.02 0.00 0.00 54.13 54.55 2rdx s LEU 332 Cb 0.03 -2.28 0.00 0.00 0.02 0.00 0.00 46.19 43.97 2rdx s LEU 332 CO -0.08 0.10 0.00 0.61 0.02 0.00 0.00 176.35 176.99 2rdx n GLY 333 N 3.61 1.02 2.42 -3.19 0.00 -1.26 -1.30 105.19 106.49 2rdx n GLY 333 Ca -0.13 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.43 2rdx n GLY 333 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rdx n GLY 334 N 0.00 -1.82 3.77 -0.02 0.00 -0.92 -4.96 105.19 101.24 2rdx n GLY 334 Ca 0.00 -1.84 -0.29 0.00 0.00 0.00 0.00 46.02 43.90 2rdx n GLY 334 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2rdx s PRO 335 N 0.00 1.06 0.27 1.61 0.04 -1.26 -4.70 135.00 132.02 2rdx s PRO 335 Ca 0.00 0.35 0.08 0.00 0.04 0.00 0.00 61.00 61.47 2rdx s PRO 335 Cb 0.00 -1.82 -0.05 0.00 0.04 0.00 0.00 34.50 32.66 2rdx s PRO 335 CO 0.00 -2.27 -0.11 0.95 0.04 0.00 0.00 177.00 175.61 2rdx s THR 336 N -3.21 1.91 -0.15 1.26 -4.23 -0.55 -4.99 115.64 105.69 2rdx s THR 336 Ca 0.64 -2.21 0.02 0.00 -1.18 0.00 0.00 61.69 58.96 2rdx s THR 336 Cb -0.15 -2.34 0.01 0.00 1.34 0.00 0.00 72.50 71.35 2rdx s THR 336 CO 0.54 -0.38 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.34 2rdx s VAL 337 N -2.85 2.04 -0.07 2.29 1.01 -1.26 -0.80 120.40 120.76 2rdx s VAL 337 Ca 0.28 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.30 2rdx s VAL 337 Cb 0.01 -1.81 0.03 0.00 0.00 0.00 0.00 36.38 34.60 2rdx s VAL 337 CO 0.12 0.54 -0.01 -2.28 0.00 0.00 0.00 175.10 173.47 2rdx s HIS 338 N 0.97 0.70 -1.38 5.22 5.04 0.07 -4.89 115.29 121.02 2rdx s HIS 338 Ca -0.03 -0.19 -0.04 0.00 -1.54 0.00 0.00 55.06 53.25 2rdx s HIS 338 Cb -0.15 -0.78 0.00 0.00 0.04 0.00 0.00 32.58 31.69 2rdx s HIS 338 CO -0.05 -0.31 0.43 1.04 -2.34 0.00 0.00 174.74 173.51 2rdx n GLN 339 N 4.92 -2.61 -1.28 2.88 6.02 -1.26 -1.35 117.38 124.70 2rdx n GLN 339 Ca -0.11 0.36 -0.10 0.00 -0.01 0.00 0.00 57.00 57.14 2rdx n GLN 339 Cb 0.50 -4.27 -0.04 0.00 1.02 0.00 0.00 30.24 27.45 2rdx n GLN 339 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2rdx n GLY 340 N -2.02 1.12 3.24 1.08 0.00 -1.09 -4.62 105.19 102.90 2rdx n GLY 340 Ca -0.28 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.03 2rdx n GLY 340 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rdx s ARG 341 N -2.72 1.38 -0.26 1.61 0.52 -0.45 -2.55 118.95 116.47 2rdx s ARG 341 Ca 0.00 -0.90 -0.14 0.00 -0.52 0.00 0.00 55.73 54.17 2rdx s ARG 341 Cb 0.00 -1.47 -0.04 0.00 0.52 0.00 0.00 34.95 33.96 2rdx s ARG 341 CO 0.00 0.38 0.32 -1.17 0.02 0.00 0.00 175.30 174.84 2rdx s LEU 342 N -1.09 4.06 -0.14 2.53 2.96 -0.07 -0.75 118.68 126.18 2rdx s LEU 342 Ca 0.07 0.25 -0.02 0.00 -0.22 0.00 0.00 54.13 54.21 2rdx s LEU 342 Cb -0.09 -2.34 -0.02 0.00 0.50 0.00 0.00 46.19 44.24 2rdx s LEU 342 CO 0.01 -0.11 -0.07 -0.31 -1.32 0.00 0.00 176.35 174.55 2rdx s TYR 343 N 1.76 2.94 0.84 5.38 2.02 0.02 -1.66 117.35 128.65 2rdx s TYR 343 Ca 0.13 -0.37 -0.12 0.00 -0.37 0.00 0.00 57.07 56.35 2rdx s TYR 343 Cb -0.15 -1.89 0.10 0.00 -0.40 0.00 0.00 41.96 39.62 2rdx s TYR 343 CO 0.09 -0.04 1.12 0.00 -1.57 0.00 0.00 175.55 175.15 2rdx s ALA 344 N 0.20 2.12 0.42 3.71 0.00 -1.26 -1.48 121.76 125.47 2rdx s ALA 344 Ca -0.04 -0.39 -0.11 0.00 0.00 0.00 0.00 51.96 51.41 2rdx s ALA 344 Cb -0.14 -3.06 -0.07 0.00 0.00 0.00 0.00 23.12 19.85 2rdx s ALA 344 CO 0.04 -1.93 0.80 -1.54 0.00 0.00 0.00 175.76 173.13 2rdx s SER 345 N -4.05 6.54 0.00 0.00 1.04 -1.26 -4.80 113.70 111.17 2rdx s SER 345 Ca 0.62 1.20 0.11 0.00 0.48 0.00 0.00 55.95 58.36 2rdx s SER 345 Cb -0.14 -2.35 0.03 0.00 0.10 0.00 0.00 66.02 63.66 2rdx s SER 345 CO 0.53 -0.42 0.73 0.47 0.98 0.00 0.00 173.24 175.53 2rdx n ASP 346 N -1.31 1.50 -4.85 7.02 8.00 -1.26 -4.82 116.55 120.83 2rdx n ASP 346 Ca 0.03 -1.25 -0.31 0.00 0.71 0.00 0.00 54.79 53.96 2rdx n ASP 346 Cb 0.54 0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.94 2rdx n ASP 346 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2rdx s THR 347 N -1.25 4.50 0.34 -3.53 -4.23 -1.26 -4.31 115.64 105.89 2rdx s THR 347 Ca 0.10 0.95 -0.27 0.00 -1.18 0.00 0.00 61.69 61.29 2rdx s THR 347 Cb 0.09 -3.72 -0.12 0.00 1.34 0.00 0.00 72.50 70.08 2rdx s THR 347 CO 0.22 -0.92 1.18 -2.65 -0.54 0.00 0.00 174.62 171.91 2rdx n PRO 348 N -2.40 1.82 0.00 3.99 -0.02 -1.26 -3.69 135.00 133.44 2rdx n PRO 348 Ca 0.07 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2rdx n PRO 348 Cb 0.54 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 2rdx n PRO 348 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rdx n GLY 349 N 0.94 -0.54 0.22 -1.23 0.00 -0.28 -3.89 105.19 100.41 2rdx n GLY 349 Ca 0.07 -1.27 0.12 0.00 0.00 0.00 0.00 46.02 44.93 2rdx n GLY 349 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2rdx h LEU 350 N 0.00 0.00 0.11 0.99 3.38 -1.86 -1.81 115.31 116.13 2rdx h LEU 350 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2rdx h LEU 350 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2rdx h LEU 350 CO 0.00 0.11 -0.03 0.61 0.09 0.00 0.00 178.44 179.22 2rdx n GLY 351 N 0.70 0.39 2.92 0.83 0.00 -1.25 -4.74 105.19 104.03 2rdx n GLY 351 Ca 0.02 -0.93 -0.12 0.00 0.00 0.00 0.00 46.02 45.00 2rdx n GLY 351 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rdx s VAL 352 N -2.05 0.02 0.16 1.61 0.11 -1.26 -2.16 120.40 116.83 2rdx s VAL 352 Ca 0.00 -0.16 0.10 0.00 -2.93 0.00 0.00 61.98 59.00 2rdx s VAL 352 Cb 0.00 -0.09 -0.04 0.00 -1.53 0.00 0.00 36.38 34.72 2rdx s VAL 352 CO 0.00 -0.09 -0.23 0.42 -3.33 0.00 0.00 175.10 171.87 2rdx s THR 353 N -0.25 2.14 0.33 5.04 -4.23 -0.42 -4.85 115.64 113.40 2rdx s THR 353 Ca -0.03 -1.87 -0.29 0.00 -1.18 0.00 0.00 61.69 58.32 2rdx s THR 353 Cb -0.02 -1.96 -0.11 0.00 1.34 0.00 0.00 72.50 71.76 2rdx s THR 353 CO -0.00 -0.09 1.40 -2.84 -0.54 0.00 0.00 174.62 172.55 2rdx s PRO 354 N -2.42 4.25 -1.19 3.99 0.02 -1.26 0.52 135.00 138.90 2rdx s PRO 354 Ca 0.16 2.36 -0.16 0.00 0.02 0.00 0.00 61.00 63.38 2rdx s PRO 354 Cb -0.08 -3.04 0.13 0.00 0.02 0.00 0.00 34.50 31.52 2rdx s PRO 354 CO 0.07 -0.36 1.49 0.34 -0.33 0.00 0.00 177.00 178.21 2rdx s ASP 355 N -0.17 6.93 0.49 2.53 -1.08 -0.47 -4.50 116.67 120.39 2rdx s ASP 355 Ca 0.53 -2.65 0.14 0.00 -0.52 0.00 0.00 52.55 50.04 2rdx s ASP 355 Cb -0.43 -2.46 1.15 0.00 -1.46 0.00 0.00 42.92 39.72 2rdx s ASP 355 CO 0.54 -0.94 2.11 -0.26 0.52 0.00 0.00 175.17 177.14 2rdx h PHE 356 N 7.60 0.16 -0.38 -5.34 0.04 -1.91 -0.42 116.94 116.69 2rdx h PHE 356 Ca 0.33 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.96 2rdx h PHE 356 Cb 0.90 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.98 2rdx h PHE 356 CO 1.21 0.10 -0.32 -0.91 -0.60 0.00 0.00 178.31 177.79 2rdx h ASN 357 N 0.17 0.94 0.01 2.17 -0.26 -1.89 -1.95 115.58 114.77 2rdx h ASN 357 Ca 0.06 -0.45 -0.22 0.00 -0.56 0.00 0.00 56.30 55.13 2rdx h ASN 357 Cb 0.03 -0.26 0.01 0.00 -1.06 0.00 0.00 38.32 37.04 2rdx h ASN 357 CO -0.01 1.19 -0.84 0.28 -1.06 0.00 0.00 177.43 177.00 2rdx h SER 358 N 0.70 0.80 -0.24 5.81 0.02 -1.72 -3.31 113.55 115.60 2rdx h SER 358 Ca 0.07 -0.56 -0.11 0.00 -0.84 0.00 0.00 61.79 60.34 2rdx h SER 358 Cb 0.91 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.19 2rdx h SER 358 CO 0.08 1.35 -0.24 -0.07 -1.14 0.00 0.00 176.83 176.81 2rdx h LEU 359 N 0.43 0.73 0.00 5.07 3.38 -1.12 -3.48 115.31 120.31 2rdx h LEU 359 Ca -0.07 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2rdx h LEU 359 Cb 1.46 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2rdx h LEU 359 CO 0.16 0.94 0.00 0.61 0.09 0.00 0.00 178.44 180.25 2rdx n GLY 360 N -0.24 -1.67 3.77 0.83 0.00 -0.73 -4.55 105.19 102.59 2rdx n GLY 360 Ca -0.00 -1.43 -0.38 0.00 0.00 0.00 0.00 46.02 44.21 2rdx n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdx s ALA 361 N -1.14 3.13 0.33 4.61 0.00 -1.26 -4.87 121.76 122.55 2rdx s ALA 361 Ca 0.00 0.93 -0.29 0.00 0.00 0.00 0.00 51.96 52.60 2rdx s ALA 361 Cb 0.00 -3.37 -0.10 0.00 0.00 0.00 0.00 23.12 19.65 2rdx s ALA 361 CO 0.00 -0.50 1.37 -1.25 0.00 0.00 0.00 175.76 175.38 2rdx s PRO 362 N -2.35 4.28 0.33 0.00 0.04 -1.26 -4.75 135.00 131.29 2rdx s PRO 362 Ca 0.58 2.31 0.26 0.00 0.04 0.00 0.00 61.00 64.19 2rdx s PRO 362 Cb -0.29 -3.05 0.76 0.00 0.04 0.00 0.00 34.50 31.95 2rdx s PRO 362 CO 0.37 -0.31 1.74 -0.39 0.04 0.00 0.00 177.00 178.45 2rdx h VAL 363 N 3.12 0.00 -2.40 -0.36 -1.51 -1.38 -3.46 116.25 110.26 2rdx h VAL 363 Ca -0.49 -0.61 -0.08 0.00 -1.23 0.00 0.00 66.70 64.29 2rdx h VAL 363 Cb 1.23 1.57 -0.20 0.00 -2.13 0.00 0.00 31.29 31.76 2rdx h VAL 363 CO 0.68 0.00 0.01 0.00 -1.23 0.00 0.00 177.57 177.02 2rdx s ALA 364 N -3.24 -1.39 -0.22 5.19 0.00 -1.20 -5.01 121.76 115.89 2rdx s ALA 364 Ca 0.07 0.96 -0.05 0.00 0.00 0.00 0.00 51.96 52.94 2rdx s ALA 364 Cb 0.09 -0.00 0.11 0.00 0.00 0.00 0.00 23.12 23.32 2rdx s ALA 364 CO 0.58 -0.33 0.41 0.34 0.00 0.00 0.00 175.76 176.76 2rdx s ASP 365 N -1.20 -0.08 -0.23 0.00 3.68 -1.26 -1.35 116.67 116.23 2rdx s ASP 365 Ca -0.12 0.64 -0.00 0.00 2.13 0.00 0.00 52.55 55.20 2rdx s ASP 365 Cb -0.02 1.28 0.03 0.00 -1.45 0.00 0.00 42.92 42.75 2rdx s ASP 365 CO 0.08 -0.26 -0.11 0.26 0.13 0.00 0.00 175.17 175.26 2rdx s TRP 366 N 2.59 3.01 0.08 -5.34 0.51 0.14 -5.00 118.94 114.93 2rdx s TRP 366 Ca 0.06 -1.66 0.07 0.00 -2.12 0.00 0.00 56.10 52.45 2rdx s TRP 366 Cb -0.14 -2.00 -0.04 0.00 -0.81 0.00 0.00 33.47 30.48 2rdx s TRP 366 CO -0.14 -0.76 -0.12 0.00 -0.51 0.00 0.00 176.95 175.41 2rdx s ALA 367 N 1.29 2.86 -2.00 0.98 0.00 -1.26 -0.23 121.76 123.40 2rdx s ALA 367 Ca 0.01 -1.23 0.23 0.00 0.00 0.00 0.00 51.96 50.97 2rdx s ALA 367 Cb -0.16 -0.86 1.39 0.00 0.00 0.00 0.00 23.12 23.49 2rdx s ALA 367 CO -0.07 0.62 1.76 -0.11 0.00 0.00 0.00 175.76 177.96