#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n4f s TRP 12 N 0.00 2.85 0.07 -0.67 0.51 -1.26 -5.00 118.94 115.44 3n4f s TRP 12 Ca 0.00 0.89 0.04 0.00 -2.12 0.00 0.00 56.10 54.91 3n4f s TRP 12 Cb 0.00 -3.60 -0.03 0.00 -0.81 0.00 0.00 33.47 29.03 3n4f s TRP 12 CO 0.00 -2.18 -0.12 0.15 -0.51 0.00 0.00 176.95 174.29 3n4f s LYS 13 N 2.68 0.74 -0.25 4.98 1.02 -1.26 -1.61 119.74 126.05 3n4f s LYS 13 Ca 0.61 -0.95 -0.29 0.00 0.02 0.00 0.00 55.97 55.37 3n4f s LYS 13 Cb -0.28 -0.62 -0.02 0.00 -0.52 0.00 0.00 37.83 36.39 3n4f s LYS 13 CO 0.24 0.12 1.63 0.08 -0.92 0.00 0.00 175.35 176.50 3n4f s VAL 14 N -1.56 3.68 -0.24 3.17 1.01 -0.24 -3.56 120.40 122.67 3n4f s VAL 14 Ca -0.03 0.76 0.01 0.00 0.00 0.00 0.00 61.98 62.72 3n4f s VAL 14 Cb -0.08 -3.73 -0.19 0.00 0.00 0.00 0.00 36.38 32.38 3n4f s VAL 14 CO 0.01 -0.33 -0.14 -0.62 0.00 0.00 0.00 175.10 174.02 3n4f n GLU 15 N 7.78 0.67 -3.76 2.72 1.02 -0.17 0.92 120.64 129.81 3n4f n GLU 15 Ca 0.19 0.16 -0.13 0.00 -0.02 0.00 0.00 57.16 57.37 3n4f n GLU 15 Cb 0.46 -1.55 -0.11 0.00 -0.02 0.00 0.00 31.44 30.22 3n4f n GLU 15 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3n4f s LYS 16 N -2.53 0.39 -0.14 3.49 2.20 -1.15 -4.46 119.74 117.54 3n4f s LYS 16 Ca -0.33 0.40 0.00 0.00 -0.36 0.00 0.00 55.97 55.69 3n4f s LYS 16 Cb 0.09 0.19 0.02 0.00 -1.51 0.00 0.00 37.83 36.61 3n4f s LYS 16 CO 0.63 -0.05 -0.13 0.42 -0.36 0.00 0.00 175.35 175.86 3n4f s ILE 17 N 0.08 1.47 0.13 5.43 1.01 0.12 0.18 121.20 129.63 3n4f s ILE 17 Ca -0.01 -0.57 0.09 0.00 0.00 0.00 0.00 60.65 60.16 3n4f s ILE 17 Cb -0.02 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 41.01 3n4f s ILE 17 CO 0.01 0.44 -0.15 -1.61 0.00 0.00 0.00 174.94 173.63 3n4f s GLU 18 N 1.51 1.91 -0.01 2.79 2.02 0.18 -0.81 118.70 126.28 3n4f s GLU 18 Ca 0.05 -1.18 0.02 0.00 0.02 0.00 0.00 54.97 53.88 3n4f s GLU 18 Cb -0.13 -2.16 -0.00 0.00 0.10 0.00 0.00 34.13 31.94 3n4f s GLU 18 CO -0.10 0.47 -0.06 0.12 0.02 0.00 0.00 175.26 175.72 3n4f s PHE 19 N -1.30 0.54 -0.05 1.61 2.19 0.02 -0.52 117.98 120.47 3n4f s PHE 19 Ca 0.20 -0.10 -0.24 0.00 0.33 0.00 0.00 56.93 57.12 3n4f s PHE 19 Cb -0.10 -0.36 0.05 0.00 -1.31 0.00 0.00 43.02 41.30 3n4f s PHE 19 CO 0.12 -0.02 0.53 0.00 1.83 0.00 0.00 175.22 177.67 3n4f s ALA 20 N -0.06 -1.35 -0.35 11.12 0.00 -0.35 -2.04 121.76 128.72 3n4f s ALA 20 Ca 0.01 0.97 -0.12 0.00 0.00 0.00 0.00 51.96 52.82 3n4f s ALA 20 Cb -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.01 3n4f s ALA 20 CO -0.00 -0.32 0.23 0.21 0.00 0.00 0.00 175.76 175.88 3n4f s LYS 21 N -1.07 3.24 0.22 0.00 2.20 -1.26 -0.32 119.74 122.74 3n4f s LYS 21 Ca -0.11 -0.81 -0.17 0.00 -0.36 0.00 0.00 55.97 54.52 3n4f s LYS 21 Cb -0.02 -3.78 -0.08 0.00 -1.51 0.00 0.00 37.83 32.44 3n4f s LYS 21 CO 0.07 -0.55 0.68 -0.51 -0.36 0.00 0.00 175.35 174.68 3n4f s LEU 22 N 1.66 4.30 0.13 5.43 1.02 0.54 -4.93 118.68 126.84 3n4f s LEU 22 Ca 0.05 1.30 0.08 0.00 0.02 0.00 0.00 54.13 55.58 3n4f s LEU 22 Cb -0.18 -3.58 -0.04 0.00 0.02 0.00 0.00 46.19 42.41 3n4f s LEU 22 CO 0.09 0.01 -0.19 0.42 0.02 0.00 0.00 176.35 176.70 3n4f s THR 23 N -1.58 1.74 0.00 5.49 -4.23 -1.26 -1.08 115.64 114.71 3n4f s THR 23 Ca 0.43 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 3n4f s THR 23 Cb -0.15 -1.70 0.00 0.00 1.34 0.00 0.00 72.50 71.99 3n4f s THR 23 CO 0.20 -0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 3n4f n GLY 24 N 0.66 1.93 3.07 3.99 0.00 0.14 -1.45 105.19 113.53 3n4f n GLY 24 Ca -0.16 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.12 3n4f n GLY 24 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3n4f s GLU 25 N 1.16 0.34 0.50 1.61 2.02 -0.42 -1.29 118.70 122.62 3n4f s GLU 25 Ca 0.00 -0.11 -0.20 0.00 0.02 0.00 0.00 54.97 54.68 3n4f s GLU 25 Cb 0.00 0.15 -0.08 0.00 0.10 0.00 0.00 34.13 34.30 3n4f s GLU 25 CO 0.00 -0.07 1.06 1.03 0.02 0.00 0.00 175.26 177.30 3n4f s ARG 26 N -0.68 3.70 0.46 1.61 0.52 0.30 -0.57 118.95 124.28 3n4f s ARG 26 Ca -0.08 1.42 0.11 0.00 -0.52 0.00 0.00 55.73 56.67 3n4f s ARG 26 Cb -0.05 -2.08 1.05 0.00 0.52 0.00 0.00 34.95 34.39 3n4f s ARG 26 CO 0.01 -0.53 2.09 0.00 0.02 0.00 0.00 175.30 176.89 3n4f h ALA 27 N 1.48 1.86 -3.21 2.13 0.00 -1.23 -3.42 119.26 116.88 3n4f h ALA 27 Ca -0.50 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.18 3n4f h ALA 27 Cb 1.23 -0.09 -0.30 0.00 0.00 0.00 0.00 17.79 18.63 3n4f h ALA 27 CO 0.59 0.12 -0.55 0.50 0.00 0.00 0.00 179.25 179.90 3n4f s ARG 28 N -5.31 0.15 0.32 0.00 3.52 -1.26 -5.13 118.95 111.23 3n4f s ARG 28 Ca -0.07 0.38 -0.29 0.00 -0.13 0.00 0.00 55.73 55.62 3n4f s ARG 28 Cb 0.17 -0.10 -0.12 0.00 -1.56 0.00 0.00 34.95 33.35 3n4f s ARG 28 CO 0.71 -0.13 1.56 0.45 -0.81 0.00 0.00 175.30 177.08 3n4f n SER 29 N 3.93 3.81 -4.77 -2.12 2.88 -1.26 -4.88 113.62 111.21 3n4f n SER 29 Ca -0.23 1.17 -0.37 0.00 -1.33 0.00 0.00 58.87 58.11 3n4f n SER 29 Cb 0.54 -1.60 -0.06 0.00 -0.75 0.00 0.00 64.21 62.34 3n4f n SER 29 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3n4f s ALA 30 N -0.32 3.63 0.73 -1.46 0.00 -0.05 -4.89 121.76 119.39 3n4f s ALA 30 Ca 0.61 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.22 3n4f s ALA 30 Cb -0.49 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.23 3n4f s ALA 30 CO 0.53 0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.94 3n4f n GLY 31 N 2.77 1.15 3.87 0.00 0.00 -1.26 -0.50 105.19 111.22 3n4f n GLY 31 Ca -0.12 -1.61 -0.29 0.00 0.00 0.00 0.00 46.02 44.00 3n4f n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n4f s ALA 32 N -3.72 2.55 0.21 4.61 0.00 -1.18 -2.24 121.76 121.98 3n4f s ALA 32 Ca 0.00 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 51.48 3n4f s ALA 32 Cb 0.00 -3.00 -0.01 0.00 0.00 0.00 0.00 23.12 20.11 3n4f s ALA 32 CO 0.00 -1.62 0.06 0.27 0.00 0.00 0.00 175.76 174.46 3n4f n ASN 33 N -3.31 1.45 0.13 0.00 0.23 -0.96 -0.21 115.26 112.59 3n4f n ASN 33 Ca 0.07 -2.07 0.16 0.00 -0.53 0.00 0.00 54.58 52.22 3n4f n ASN 33 Cb 0.59 0.43 0.73 0.00 -2.08 0.00 0.00 39.78 39.45 3n4f n ASN 33 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 3n4f h GLY 34 N 0.75 0.00 0.00 4.83 0.00 -1.78 -3.24 103.07 103.63 3n4f h GLY 34 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.04 3n4f h GLY 34 CO 0.27 0.00 -1.50 -0.96 0.00 0.00 0.00 176.54 174.35 3n4f n ARG 35 N -4.21 2.54 -4.38 4.80 1.85 -1.26 -4.09 116.66 111.91 3n4f n ARG 35 Ca 0.04 -0.01 -0.21 0.00 -1.00 0.00 0.00 57.85 56.66 3n4f n ARG 35 Cb 0.39 -1.19 -0.08 0.00 -1.05 0.00 0.00 32.46 30.53 3n4f n ARG 35 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 3n4f s ILE 36 N -2.22 0.27 0.00 8.89 -4.36 -1.22 -5.04 121.20 117.53 3n4f s ILE 36 Ca -0.04 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.35 3n4f s ILE 36 Cb 0.02 -2.44 0.00 0.00 1.25 0.00 0.00 42.46 41.30 3n4f s ILE 36 CO 0.31 0.00 0.00 0.61 0.24 0.00 0.00 174.94 176.10 3n4f n GLY 37 N -0.72 -0.91 3.73 6.27 0.00 -1.26 -2.26 105.19 110.04 3n4f n GLY 37 Ca 0.01 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 3n4f n GLY 37 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3n4f n VAL 38 N -0.37 1.25 -0.01 1.61 0.31 -1.26 -4.12 118.33 115.75 3n4f n VAL 38 Ca 0.00 -0.31 -0.01 0.00 -0.01 0.00 0.00 64.34 64.00 3n4f n VAL 38 Cb 0.00 -1.84 -0.11 0.00 -0.91 0.00 0.00 33.84 30.97 3n4f n VAL 38 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3n4f n HIS 39 N 1.68 0.66 -2.02 3.52 -0.00 -0.42 -4.91 115.22 113.73 3n4f n HIS 39 Ca 0.08 0.22 0.00 0.00 -0.00 0.00 0.00 57.72 58.02 3n4f n HIS 39 Cb 0.36 -1.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.35 3n4f n HIS 39 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3n4f n GLY 40 N 1.46 -1.81 0.02 -1.41 0.00 0.34 -4.73 105.19 99.07 3n4f n GLY 40 Ca -0.14 -1.70 -0.00 0.00 0.00 0.00 0.00 46.02 44.17 3n4f n GLY 40 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3n4f n LYS 41 N 0.00 1.81 -2.51 1.61 4.81 -1.26 -0.87 118.16 121.75 3n4f n LYS 41 Ca 0.00 -0.03 -0.42 0.00 -0.87 0.00 0.00 58.31 57.00 3n4f n LYS 41 Cb 0.00 -1.16 -0.03 0.00 0.02 0.00 0.00 35.03 33.86 3n4f n LYS 41 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3n4f s SER 42 N -3.34 7.20 0.04 3.14 0.15 -1.26 -0.54 113.70 119.09 3n4f s SER 42 Ca -0.03 1.98 0.05 0.00 0.70 0.00 0.00 55.95 58.65 3n4f s SER 42 Cb 0.03 -2.59 -0.02 0.00 -1.71 0.00 0.00 66.02 61.73 3n4f s SER 42 CO 0.26 -0.34 -0.15 0.00 1.20 0.00 0.00 173.24 174.21 3n4f s THR 44 N -0.85 0.42 -0.14 0.00 -4.23 -1.26 0.28 115.64 109.85 3n4f s THR 44 Ca 0.02 -1.93 -0.05 0.00 -1.18 0.00 0.00 61.69 58.56 3n4f s THR 44 Cb -0.08 -1.95 0.07 0.00 1.34 0.00 0.00 72.50 71.88 3n4f s THR 44 CO 0.01 -0.60 0.28 -0.69 -0.54 0.00 0.00 174.62 173.09 3n4f s VAL 45 N -3.83 -0.44 -0.12 2.29 1.01 -0.24 -4.60 120.40 114.47 3n4f s VAL 45 Ca 0.20 0.25 -0.29 0.00 0.00 0.00 0.00 61.98 62.14 3n4f s VAL 45 Cb 0.07 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.95 3n4f s VAL 45 CO 0.00 0.10 1.04 -1.81 0.00 0.00 0.00 175.10 174.43 3n4f s ASP 46 N 2.44 7.19 0.12 3.32 1.01 -1.26 -0.34 116.67 129.15 3n4f s ASP 46 Ca 0.01 1.54 0.09 0.00 0.71 0.00 0.00 52.55 54.91 3n4f s ASP 46 Cb -0.12 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.22 3n4f s ASP 46 CO -0.09 -0.51 -0.23 0.27 0.21 0.00 0.00 175.17 174.82 3n4f s ILE 47 N 2.28 1.95 -0.08 0.77 -4.36 0.56 -1.81 121.20 120.50 3n4f s ILE 47 Ca 0.49 -1.67 0.03 0.00 -0.26 0.00 0.00 60.65 59.24 3n4f s ILE 47 Cb -0.19 -1.76 -0.02 0.00 1.25 0.00 0.00 42.46 41.75 3n4f s ILE 47 CO 0.16 -0.03 -0.17 0.00 0.24 0.00 0.00 174.94 175.14 3n4f s ALA 48 N -1.21 2.48 -0.31 2.27 0.00 -0.02 -1.21 121.76 123.76 3n4f s ALA 48 Ca 0.10 -0.96 -0.09 0.00 0.00 0.00 0.00 51.96 51.01 3n4f s ALA 48 Cb -0.10 -0.97 0.00 0.00 0.00 0.00 0.00 23.12 22.06 3n4f s ALA 48 CO 0.05 0.39 0.14 0.50 0.00 0.00 0.00 175.76 176.84 3n4f s ARG 49 N -0.11 3.21 -0.04 0.00 3.52 0.32 -1.99 118.95 123.87 3n4f s ARG 49 Ca -0.03 -0.80 -0.00 0.00 -0.13 0.00 0.00 55.73 54.77 3n4f s ARG 49 Cb -0.14 -3.53 -0.04 0.00 -1.56 0.00 0.00 34.95 29.68 3n4f s ARG 49 CO 0.04 -0.46 0.02 -1.50 -0.81 0.00 0.00 175.30 172.59 3n4f s ILE 50 N 1.58 4.36 -0.21 4.11 2.07 -0.10 0.48 121.20 133.49 3n4f s ILE 50 Ca 0.04 -0.41 -0.02 0.00 -1.41 0.00 0.00 60.65 58.85 3n4f s ILE 50 Cb -0.17 -2.91 0.00 0.00 0.13 0.00 0.00 42.46 39.51 3n4f s ILE 50 CO 0.05 0.47 -0.09 -0.89 -1.91 0.00 0.00 174.94 172.57 3n4f s THR 51 N -1.02 2.95 -0.11 4.00 2.01 0.13 -0.67 115.64 122.93 3n4f s THR 51 Ca 0.18 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.52 3n4f s THR 51 Cb -0.12 -2.33 0.02 0.00 0.01 0.00 0.00 72.50 70.08 3n4f s THR 51 CO 0.08 0.44 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.69 3n4f s ILE 52 N 1.41 1.31 -1.22 1.82 1.01 0.39 -1.00 121.20 124.92 3n4f s ILE 52 Ca 0.05 -0.51 -0.18 0.00 0.00 0.00 0.00 60.65 60.01 3n4f s ILE 52 Cb -0.14 -1.24 0.00 0.00 0.01 0.00 0.00 42.46 41.10 3n4f s ILE 52 CO -0.06 0.41 0.68 -0.67 0.00 0.00 0.00 174.94 175.30 3n4f n ASP 53 N 4.45 -3.89 0.00 3.58 2.03 -1.23 -2.06 116.55 119.42 3n4f n ASP 53 Ca -0.17 -1.07 0.00 0.00 0.52 0.00 0.00 54.79 54.07 3n4f n ASP 53 Cb 0.51 -3.01 0.00 0.00 -0.72 0.00 0.00 41.12 37.90 3n4f n ASP 53 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3n4f n GLY 54 N -1.83 0.34 3.49 0.27 0.00 -1.26 -4.96 105.19 101.24 3n4f n GLY 54 Ca -0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 3n4f n GLY 54 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3n4f s GLN 55 N -0.68 2.09 0.10 1.61 0.74 -0.87 -5.12 119.66 117.53 3n4f s GLN 55 Ca 0.00 -0.99 0.05 0.00 0.05 0.00 0.00 55.36 54.48 3n4f s GLN 55 Cb 0.00 -2.22 -0.04 0.00 1.10 0.00 0.00 33.01 31.85 3n4f s GLN 55 CO 0.00 0.53 -0.01 0.95 -0.55 0.00 0.00 175.29 176.21 3n4f s THR 56 N -0.99 3.91 0.02 -0.34 -4.23 -1.26 -0.46 115.64 112.28 3n4f s THR 56 Ca 0.16 -1.08 0.02 0.00 -1.18 0.00 0.00 61.69 59.61 3n4f s THR 56 Cb -0.11 -2.87 -0.02 0.00 1.34 0.00 0.00 72.50 70.84 3n4f s THR 56 CO 0.07 0.08 -0.08 -0.83 -0.54 0.00 0.00 174.62 173.33 3n4f s GLY 57 N -2.39 0.45 0.28 3.99 0.00 0.16 -4.72 107.32 105.08 3n4f s GLY 57 Ca 0.26 -0.56 0.09 0.00 0.00 0.00 0.00 44.72 44.51 3n4f s GLY 57 CO 0.18 -0.56 0.01 -0.19 0.00 0.00 0.00 173.10 172.53 3n4f s TYR 58 N -0.80 2.68 0.00 1.90 2.02 -1.26 -0.92 117.35 120.97 3n4f s TYR 58 Ca -0.03 -0.25 0.00 0.00 -0.37 0.00 0.00 57.07 56.41 3n4f s TYR 58 Cb -0.06 -1.25 0.00 0.00 -0.40 0.00 0.00 41.96 40.24 3n4f s TYR 58 CO 0.00 0.59 0.00 0.41 -1.57 0.00 0.00 175.55 174.98 3n4f n GLY 59 N -0.92 1.92 3.56 0.71 0.00 -0.84 -3.52 105.19 106.11 3n4f n GLY 59 Ca -0.06 -0.81 -0.47 0.00 0.00 0.00 0.00 46.02 44.67 3n4f n GLY 59 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3n4f n SER 60 N 0.00 1.00 -3.70 1.61 2.88 -1.26 -0.84 113.62 113.30 3n4f n SER 60 Ca 0.00 1.15 -0.15 0.00 -1.33 0.00 0.00 58.87 58.54 3n4f n SER 60 Cb 0.00 -1.20 -0.15 0.00 -0.75 0.00 0.00 64.21 62.11 3n4f n SER 60 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3n4f s SER 61 N -0.32 0.36 0.18 -3.46 0.15 -0.75 -4.40 113.70 105.46 3n4f s SER 61 Ca 0.67 0.32 0.04 0.00 0.70 0.00 0.00 55.95 57.69 3n4f s SER 61 Cb -0.82 0.24 -0.05 0.00 -1.71 0.00 0.00 66.02 63.68 3n4f s SER 61 CO 0.55 -0.20 -0.07 0.27 1.20 0.00 0.00 173.24 175.00 3n4f s ILE 62 N 1.79 1.17 -0.35 6.45 -4.36 -0.93 -4.55 121.20 120.42 3n4f s ILE 62 Ca -0.03 -2.06 -0.07 0.00 -0.26 0.00 0.00 60.65 58.24 3n4f s ILE 62 Cb -0.12 -2.05 0.01 0.00 1.25 0.00 0.00 42.46 41.55 3n4f s ILE 62 CO -0.06 -0.58 0.24 1.41 0.24 0.00 0.00 174.94 176.20 3n4f n HIS 63 N -0.30 -3.64 -3.58 1.37 8.25 -1.26 -3.30 115.22 112.75 3n4f n HIS 63 Ca -0.08 1.56 -0.07 0.00 -0.26 0.00 0.00 57.72 58.86 3n4f n HIS 63 Cb 0.62 -3.95 -0.02 0.00 1.12 0.00 0.00 29.99 27.76 3n4f n HIS 63 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3n4f s THR 65 N -1.98 0.00 0.43 1.59 -4.23 -1.26 -4.87 115.64 105.32 3n4f s THR 65 Ca 0.10 -0.26 0.10 0.00 -1.18 0.00 0.00 61.69 60.46 3n4f s THR 65 Cb -0.03 -1.35 0.23 0.00 1.34 0.00 0.00 72.50 72.70 3n4f s THR 65 CO 0.75 0.00 2.04 -0.65 -0.54 0.00 0.00 174.62 176.22 3n4f h PRO 66 N 2.00 0.31 -0.07 3.99 0.11 -2.00 -1.91 132.00 134.43 3n4f h PRO 66 Ca -0.24 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.82 3n4f h PRO 66 Cb 1.25 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 3n4f h PRO 66 CO 0.30 0.27 0.01 0.93 -0.21 0.00 0.00 178.00 179.30 3n4f h GLU 67 N 0.31 0.11 -0.51 1.05 3.07 -2.03 -2.52 114.58 114.08 3n4f h GLU 67 Ca 0.08 -0.03 0.08 0.00 -0.50 0.00 0.00 59.36 58.99 3n4f h GLU 67 Cb 0.08 -0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 27.91 3n4f h GLU 67 CO -0.01 0.35 0.13 2.35 -1.40 0.00 0.00 179.01 180.43 3n4f h TRP 68 N -0.14 0.21 0.00 4.33 7.01 -1.94 -2.43 115.95 123.00 3n4f h TRP 68 Ca 0.02 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.02 3n4f h TRP 68 Cb 0.29 -0.02 -0.00 0.00 -2.10 0.00 0.00 29.16 27.33 3n4f h TRP 68 CO 0.02 0.02 -0.15 0.00 -2.79 0.00 0.00 178.44 175.54 3n4f h ALA 69 N 1.38 1.32 -0.47 2.65 0.00 -1.28 -2.92 119.26 119.94 3n4f h ALA 69 Ca 0.25 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3n4f h ALA 69 Cb 0.32 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3n4f h ALA 69 CO -0.31 0.19 0.17 0.93 0.00 0.00 0.00 179.25 180.23 3n4f h GLU 70 N 0.00 0.72 0.00 0.00 5.08 -0.98 -2.89 114.58 116.52 3n4f h GLU 70 Ca -0.00 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3n4f h GLU 70 Cb 0.38 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3n4f h GLU 70 CO 0.02 0.66 0.00 -0.25 -1.00 0.00 0.00 179.01 178.44 3n4f n ASP 71 N -4.56 0.00 -0.07 1.42 9.92 -1.10 -2.41 116.55 119.75 3n4f n ASP 71 Ca 0.01 0.26 -0.05 0.00 -0.53 0.00 0.00 54.79 54.48 3n4f n ASP 71 Cb 0.17 -0.37 -0.15 0.00 -0.64 0.00 0.00 41.12 40.13 3n4f n ASP 71 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 3n4f n VAL 72 N -1.37 1.01 -1.68 2.53 0.31 -1.10 -4.88 118.33 113.14 3n4f n VAL 72 Ca 0.05 -0.73 -0.44 0.00 -0.01 0.00 0.00 64.34 63.20 3n4f n VAL 72 Cb 0.11 -0.37 -0.04 0.00 -0.91 0.00 0.00 33.84 32.63 3n4f n VAL 72 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3n4f n ILE 73 N -2.59 0.29 -0.44 2.52 2.08 -1.01 -1.50 119.36 118.70 3n4f n ILE 73 Ca -0.25 -0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.01 3n4f n ILE 73 Cb 0.99 -1.91 0.00 0.00 -0.75 0.00 0.00 39.64 37.96 3n4f n ILE 73 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3n4f n GLY 74 N 4.03 0.73 3.80 7.39 0.00 0.26 -5.00 105.19 116.41 3n4f n GLY 74 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 3n4f n GLY 74 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3n4f s ARG 75 N -0.56 4.40 0.34 1.61 3.52 -0.56 -4.76 118.95 122.94 3n4f s ARG 75 Ca 0.00 1.14 -0.29 0.00 -0.13 0.00 0.00 55.73 56.45 3n4f s ARG 75 Cb 0.00 -2.65 -0.10 0.00 -1.56 0.00 0.00 34.95 30.64 3n4f s ARG 75 CO 0.00 0.22 1.35 1.03 -0.81 0.00 0.00 175.30 177.10 3n4f s ARG 76 N -2.36 4.30 0.27 5.12 0.52 -1.26 -1.08 118.95 124.46 3n4f s ARG 76 Ca 0.52 2.30 -0.02 0.00 -0.52 0.00 0.00 55.73 58.01 3n4f s ARG 76 Cb -0.15 -3.05 0.37 0.00 0.52 0.00 0.00 34.95 32.64 3n4f s ARG 76 CO 0.20 -0.27 1.81 1.25 0.02 0.00 0.00 175.30 178.31 3n4f h LEU 77 N 3.37 0.79 -1.69 2.53 5.85 -1.66 -2.55 115.31 121.96 3n4f h LEU 77 Ca -0.49 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.08 3n4f h LEU 77 Cb 1.23 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.05 3n4f h LEU 77 CO 0.66 0.79 -0.00 0.25 -0.34 0.00 0.00 178.44 179.79 3n4f h LEU 78 N 0.81 0.00 -0.45 2.25 6.46 -1.92 -1.95 115.31 120.51 3n4f h LEU 78 Ca 0.18 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.88 3n4f h LEU 78 Cb 0.32 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.24 3n4f h LEU 78 CO 0.00 0.00 -0.28 0.44 -0.62 0.00 0.00 178.44 177.98 3n4f h ASP 79 N 0.00 0.00 1.19 1.25 3.32 -1.84 -3.14 116.42 117.19 3n4f h ASP 79 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3n4f h ASP 79 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 3n4f h ASP 79 CO 0.00 0.28 0.00 -0.07 -1.72 0.00 0.00 179.24 177.73 3n4f h LEU 80 N 0.00 0.00-10.27 1.55 3.38 -1.33 -3.45 115.31 105.19 3n4f h LEU 80 Ca -0.00 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.52 3n4f h LEU 80 Cb 1.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 3n4f h LEU 80 CO 0.04 0.00 -0.37 -0.36 0.09 0.00 0.00 178.44 177.83 3n4f s PHE 81 N -3.50 3.24 0.47 1.13 0.08 -1.19 -1.16 117.98 117.05 3n4f s PHE 81 Ca 0.03 -0.15 0.07 0.00 0.12 0.00 0.00 56.93 57.01 3n4f s PHE 81 Cb 0.08 -1.84 0.01 0.00 -0.57 0.00 0.00 43.02 40.71 3n4f s PHE 81 CO 0.55 0.16 0.45 0.34 -0.10 0.00 0.00 175.22 176.61 3n4f s ASP 82 N -4.10 4.97 0.33 1.36 2.15 -0.71 -4.78 116.67 115.89 3n4f s ASP 82 Ca 0.41 -0.87 0.20 0.00 0.43 0.00 0.00 52.55 52.71 3n4f s ASP 82 Cb -0.09 -0.21 1.08 0.00 -0.30 0.00 0.00 42.92 43.40 3n4f s ASP 82 CO 0.30 -0.86 1.58 -0.90 -0.17 0.00 0.00 175.17 175.12 3n4f n ASP 83 N -1.71 0.52 -0.22 -0.34 5.75 -1.26 -1.04 116.55 118.25 3n4f n ASP 83 Ca 0.04 0.71 0.13 0.00 -0.01 0.00 0.00 54.79 55.67 3n4f n ASP 83 Cb 0.62 -0.75 0.40 0.00 -1.03 0.00 0.00 41.12 40.36 3n4f n ASP 83 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3n4f n ARG 84 N -2.23 0.78 -2.13 0.11 5.12 -1.26 -4.93 116.66 112.12 3n4f n ARG 84 Ca -0.01 -0.44 -0.02 0.00 -1.93 0.00 0.00 57.85 55.44 3n4f n ARG 84 Cb 0.12 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 29.93 3n4f n ARG 84 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3n4f n GLY 85 N 1.34 0.36 3.24 -0.13 0.00 -0.20 -5.06 105.19 104.74 3n4f n GLY 85 Ca 0.12 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 3n4f n GLY 85 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3n4f s ARG 86 N -4.27 2.97 0.15 1.61 0.52 -1.25 -4.94 118.95 113.73 3n4f s ARG 86 Ca 0.01 -0.87 -0.34 0.00 -0.52 0.00 0.00 55.73 54.01 3n4f s ARG 86 Cb -0.00 -2.30 -0.15 0.00 0.52 0.00 0.00 34.95 33.02 3n4f s ARG 86 CO 0.01 0.23 1.39 1.28 0.02 0.00 0.00 175.30 178.22 3n4f n LEU 87 N 3.40 2.29 -4.74 2.53 4.32 -1.26 -1.74 117.00 121.80 3n4f n LEU 87 Ca -0.19 1.12 -0.37 0.00 -0.02 0.00 0.00 56.01 56.55 3n4f n LEU 87 Cb 0.53 -1.30 0.05 0.00 -1.62 0.00 0.00 43.42 41.08 3n4f n LEU 87 CO 0.28 -0.78 0.89 -0.13 -1.22 0.00 0.00 177.39 176.42 3n4f s ARG 88 N 0.29 2.77 0.48 3.23 0.52 -0.31 -4.82 118.95 121.10 3n4f s ARG 88 Ca 0.78 2.00 0.23 0.00 -0.52 0.00 0.00 55.73 58.22 3n4f s ARG 88 Cb -0.80 -1.92 1.27 0.00 0.52 0.00 0.00 34.95 34.02 3n4f s ARG 88 CO 0.46 -1.41 1.90 1.05 0.02 0.00 0.00 175.30 177.31 3n4f h GLU 89 N 0.77 0.20 0.00 3.54 4.11 -1.91 -0.93 114.58 120.36 3n4f h GLU 89 Ca -0.51 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.91 3n4f h GLU 89 Cb 1.32 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3n4f h GLU 89 CO 0.54 0.13 0.00 0.00 0.07 0.00 0.00 179.01 179.75 3n4f n ALA 90 N -2.60 2.02 0.58 1.06 0.00 -1.26 -3.49 120.51 116.81 3n4f n ALA 90 Ca 0.17 0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.69 3n4f n ALA 90 Cb 0.76 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.73 3n4f n ALA 90 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3n4f n TYR 91 N -2.24 0.00 0.38 0.00 4.01 -0.36 -4.84 117.16 114.11 3n4f n TYR 91 Ca 0.04 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.63 3n4f n TYR 91 Cb 0.34 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.30 3n4f n TYR 91 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3n4f h ARG 92 N 0.60 -0.94 -0.21 -0.72 3.08 -1.58 0.59 114.38 115.21 3n4f h ARG 92 Ca 0.00 0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 3n4f h ARG 92 Cb 0.35 0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 3n4f h ARG 92 CO 0.00 -0.62 -0.01 -0.07 -1.07 0.00 0.00 179.97 178.19 3n4f h LEU 93 N -1.09 0.28 0.16 3.04 3.38 -1.87 -1.36 115.31 117.85 3n4f h LEU 93 Ca -0.10 -0.04 -0.34 0.00 0.09 0.00 0.00 57.88 57.49 3n4f h LEU 93 Cb 0.74 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3n4f h LEU 93 CO 0.16 0.34 -1.71 1.56 0.09 0.00 0.00 178.44 178.89 3n4f h GLN 94 N 0.30 0.33 0.00 1.13 7.50 -1.57 -2.47 115.11 120.33 3n4f h GLN 94 Ca 0.07 -0.57 0.00 0.00 0.50 0.00 0.00 58.65 58.65 3n4f h GLN 94 Cb 0.23 0.21 0.00 0.00 0.05 0.00 0.00 27.48 27.97 3n4f h GLN 94 CO 0.01 1.23 0.00 1.28 -1.50 0.00 0.00 178.83 179.84 3n4f n LEU 95 N -3.52 0.12 -0.25 1.46 4.77 0.19 -4.52 117.00 115.24 3n4f n LEU 95 Ca -0.23 -0.31 -0.01 0.00 -0.03 0.00 0.00 56.01 55.43 3n4f n LEU 95 Cb 1.06 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 42.26 3n4f n LEU 95 CO 0.50 0.03 1.12 1.05 -1.33 0.00 0.00 177.39 178.76 3n4f h GLU 96 N 0.00 0.74 0.04 3.23 4.11 -1.08 -0.05 114.58 121.57 3n4f h GLU 96 Ca 0.00 -0.04 -0.00 0.00 0.07 0.00 0.00 59.36 59.38 3n4f h GLU 96 Cb 0.06 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.14 3n4f h GLU 96 CO 0.00 0.49 -0.02 1.88 0.07 0.00 0.00 179.01 181.43 3n4f h TYR 97 N 0.76 -0.06 -0.99 2.06 0.05 -1.79 -0.70 116.97 116.30 3n4f h TYR 97 Ca 0.31 -0.00 0.10 0.00 0.05 0.00 0.00 58.73 59.19 3n4f h TYR 97 Cb 0.17 0.02 -0.08 0.00 1.01 0.00 0.00 36.73 37.86 3n4f h TYR 97 CO -0.07 0.40 0.63 -1.35 -1.05 0.00 0.00 178.16 176.73 3n4f h PRO 98 N -0.54 1.02 -0.21 4.88 0.11 -1.58 -1.21 132.00 134.48 3n4f h PRO 98 Ca -0.01 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 65.92 3n4f h PRO 98 Cb 0.48 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 31.36 3n4f h PRO 98 CO 0.01 0.68 -0.35 0.28 -0.21 0.00 0.00 178.00 178.41 3n4f h VAL 99 N 1.06 1.33 -0.66 3.15 2.07 -0.94 -0.66 116.25 121.59 3n4f h VAL 99 Ca 0.47 -1.56 -0.05 0.00 0.82 0.00 0.00 66.70 66.37 3n4f h VAL 99 Cb 0.36 1.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 3n4f h VAL 99 CO -0.22 0.48 0.21 -0.07 0.02 0.00 0.00 177.57 177.99 3n4f h LEU 100 N 0.28 0.96 -0.67 2.57 3.38 -0.97 -1.01 115.31 119.85 3n4f h LEU 100 Ca 0.02 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.72 3n4f h LEU 100 Cb 0.94 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 3n4f h LEU 100 CO 0.08 0.91 0.17 -0.78 0.09 0.00 0.00 178.44 178.91 3n4f h ASP 101 N 0.96 1.00 -0.12 -0.43 3.58 -1.19 -1.84 116.42 118.39 3n4f h ASP 101 Ca 0.21 -0.23 0.02 0.00 0.42 0.00 0.00 57.03 57.46 3n4f h ASP 101 Cb 0.29 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 3n4f h ASP 101 CO -0.01 0.97 -0.02 -0.25 -2.88 0.00 0.00 179.24 177.05 3n4f h TRP 102 N 0.99 -0.05 -0.94 0.28 7.01 -0.83 -0.83 115.95 121.58 3n4f h TRP 102 Ca 0.21 0.01 0.09 0.00 2.11 0.00 0.00 58.89 61.31 3n4f h TRP 102 Cb 0.35 0.04 -0.07 0.00 -2.10 0.00 0.00 29.16 27.38 3n4f h TRP 102 CO 0.03 -0.04 0.58 -0.07 -2.79 0.00 0.00 178.44 176.15 3n4f h LEU 103 N 0.01 0.89 -0.43 0.65 3.38 -0.96 -1.24 115.31 117.61 3n4f h LEU 103 Ca 0.05 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 3n4f h LEU 103 Cb 0.08 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3n4f h LEU 103 CO -0.11 0.53 0.11 1.23 0.09 0.00 0.00 178.44 180.29 3n4f h GLY 104 N 1.00 0.74 0.79 0.83 0.00 -1.10 -2.05 103.07 103.29 3n4f h GLY 104 Ca 0.43 -0.46 0.01 0.00 0.00 0.00 0.00 47.33 47.31 3n4f h GLY 104 CO -0.21 0.43 -0.14 1.46 0.00 0.00 0.00 176.54 178.07 3n4f h GLN 105 N 0.57 -0.28 -0.08 4.80 1.08 -0.27 0.14 115.11 121.07 3n4f h GLN 105 Ca 0.14 0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.36 3n4f h GLN 105 Cb 0.30 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.79 3n4f h GLN 105 CO -0.00 -0.19 0.05 -0.09 -0.95 0.00 0.00 178.83 177.65 3n4f h ARG 106 N -0.29 0.11 -0.00 1.46 9.65 -1.28 -2.91 114.38 121.12 3n4f h ARG 106 Ca 0.01 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3n4f h ARG 106 Cb 0.29 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 3n4f h ARG 106 CO -0.06 0.14 -0.00 1.04 2.80 0.00 0.00 179.97 183.88 3n4f n GLN 107 N -5.00 0.29 -3.32 0.20 6.02 -0.77 -4.92 117.38 109.88 3n4f n GLN 107 Ca -0.06 -0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.75 3n4f n GLN 107 Cb 0.06 -1.50 0.06 0.00 1.02 0.00 0.00 30.24 29.88 3n4f n GLN 107 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3n4f n GLY 108 N 1.36 -0.21 2.89 1.08 0.00 0.39 -5.02 105.19 105.68 3n4f n GLY 108 Ca 0.12 0.04 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 3n4f n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n4f s LYS 109 N -5.91 0.07 0.53 1.61 1.02 -0.58 -4.75 119.74 111.73 3n4f s LYS 109 Ca 0.40 -0.11 -0.20 0.00 0.02 0.00 0.00 55.97 56.09 3n4f s LYS 109 Cb -0.18 -0.00 -0.06 0.00 -0.52 0.00 0.00 37.83 37.07 3n4f s LYS 109 CO 0.57 -0.00 1.12 -1.25 -0.92 0.00 0.00 175.35 174.87 3n4f s PRO 110 N -0.24 3.42 0.25 -1.68 0.04 -1.24 -1.54 135.00 134.02 3n4f s PRO 110 Ca -0.02 1.60 -0.03 0.00 0.04 0.00 0.00 61.00 62.59 3n4f s PRO 110 Cb -0.02 -2.04 0.48 0.00 0.04 0.00 0.00 34.50 32.97 3n4f s PRO 110 CO -0.00 -0.79 1.77 0.28 0.04 0.00 0.00 177.00 178.29 3n4f h VAL 111 N 1.27 0.76 -0.92 -0.36 2.07 -0.56 -1.02 116.25 117.49 3n4f h VAL 111 Ca -0.50 -0.21 0.17 0.00 0.82 0.00 0.00 66.70 66.98 3n4f h VAL 111 Cb 1.26 0.09 -0.08 0.00 -1.52 0.00 0.00 31.29 31.04 3n4f h VAL 111 CO 0.57 0.11 0.59 0.10 0.02 0.00 0.00 177.57 178.96 3n4f h TYR 112 N 0.61 0.81 -0.39 1.57 -0.00 -1.83 -0.29 116.97 117.45 3n4f h TYR 112 Ca 0.43 0.02 -0.04 0.00 0.00 0.00 0.00 58.73 59.15 3n4f h TYR 112 Cb 0.58 -0.25 -0.02 0.00 0.00 0.00 0.00 36.73 37.04 3n4f h TYR 112 CO -0.10 0.26 0.08 0.22 -0.00 0.00 0.00 178.16 178.61 3n4f h ASP 113 N 0.64 0.60 0.34 0.10 1.82 -1.55 -0.67 116.42 117.70 3n4f h ASP 113 Ca 0.48 -0.25 -0.03 0.00 -0.39 0.00 0.00 57.03 56.84 3n4f h ASP 113 Cb 0.86 -0.16 -0.00 0.00 0.68 0.00 0.00 39.33 40.71 3n4f h ASP 113 CO -0.23 0.69 -0.14 -0.07 -1.61 0.00 0.00 179.24 177.88 3n4f h LEU 114 N 0.48 0.00 -2.77 2.28 3.38 -0.96 -3.14 115.31 114.58 3n4f h LEU 114 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3n4f h LEU 114 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3n4f h LEU 114 CO 0.00 0.14 0.00 1.33 0.09 0.00 0.00 178.44 180.00 3n4f n VAL 115 N -3.75 0.90 -1.60 1.22 0.24 -0.77 -5.06 118.33 109.51 3n4f n VAL 115 Ca -0.02 -0.95 -0.47 0.00 -2.04 0.00 0.00 64.34 60.86 3n4f n VAL 115 Cb 0.25 0.56 -0.03 0.00 -1.47 0.00 0.00 33.84 33.14 3n4f n VAL 115 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3n4f n SER 116 N 0.09 1.59 -3.50 -1.34 7.64 -0.27 -4.14 113.62 113.70 3n4f n SER 116 Ca 0.06 1.15 -0.13 0.00 1.01 0.00 0.00 58.87 60.96 3n4f n SER 116 Cb 0.33 -1.27 0.06 0.00 -1.01 0.00 0.00 64.21 62.33 3n4f n SER 116 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3n4f n GLY 117 N 1.93 0.90 0.00 0.23 0.00 0.04 -4.90 105.19 103.38 3n4f n GLY 117 Ca 0.14 -2.03 0.09 0.00 0.00 0.00 0.00 46.02 44.22 3n4f n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n4f n ALA 118 N -2.89 1.92 0.87 4.61 0.00 -1.26 -2.76 120.51 121.00 3n4f n ALA 118 Ca -0.09 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.39 3n4f n ALA 118 Cb 0.34 -1.31 0.21 0.00 0.00 0.00 0.00 19.45 18.69 3n4f n ALA 118 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 3n4f n HIS 119 N -1.43 0.14 -4.32 0.00 1.44 -1.26 -4.73 115.22 105.05 3n4f n HIS 119 Ca 0.06 0.04 -0.30 0.00 -2.01 0.00 0.00 57.72 55.51 3n4f n HIS 119 Cb 0.20 -0.35 -0.17 0.00 0.12 0.00 0.00 29.99 29.80 3n4f n HIS 119 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 3n4f s LEU 120 N -3.34 1.80 -0.08 2.39 2.96 -1.11 -5.13 118.68 116.16 3n4f s LEU 120 Ca 0.09 -0.49 -0.03 0.00 -0.22 0.00 0.00 54.13 53.49 3n4f s LEU 120 Cb 0.16 -1.20 -0.04 0.00 0.50 0.00 0.00 46.19 45.62 3n4f s LEU 120 CO 0.71 0.00 0.04 -0.70 -1.32 0.00 0.00 176.35 175.08 3n4f s GLU 121 N 1.15 3.07 0.40 1.98 2.56 -1.26 -4.54 118.70 122.06 3n4f s GLU 121 Ca -0.02 -0.37 -0.23 0.00 0.00 0.00 0.00 54.97 54.35 3n4f s GLU 121 Cb -0.14 -2.87 -0.13 0.00 2.00 0.00 0.00 34.13 32.99 3n4f s GLU 121 CO -0.05 0.71 0.63 0.25 -0.56 0.00 0.00 175.26 176.23 3n4f n THR 122 N 1.95 1.88 0.00 -1.70 -2.24 -1.26 -3.05 114.28 109.86 3n4f n THR 122 Ca -0.18 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 3n4f n THR 122 Cb 0.54 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 3n4f n THR 122 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n4f n GLY 123 N 1.69 2.44 3.71 3.38 0.00 -1.26 -5.03 105.19 110.12 3n4f n GLY 123 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 3n4f n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n4f s ALA 124 N -2.33 3.35 0.29 4.61 0.00 -1.17 -5.00 121.76 121.51 3n4f s ALA 124 Ca 0.00 0.76 -0.30 0.00 0.00 0.00 0.00 51.96 52.42 3n4f s ALA 124 Cb 0.00 -3.43 -0.11 0.00 0.00 0.00 0.00 23.12 19.58 3n4f s ALA 124 CO 0.00 -0.42 1.59 0.45 0.00 0.00 0.00 175.76 177.38 3n4f s SER 125 N 1.08 6.37 -0.37 0.00 0.15 -1.26 -4.98 113.70 114.69 3n4f s SER 125 Ca 0.57 2.95 -0.16 0.00 0.70 0.00 0.00 55.95 60.01 3n4f s SER 125 Cb -0.27 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.40 3n4f s SER 125 CO 0.28 -0.91 0.38 -0.22 1.20 0.00 0.00 173.24 173.97 3n4f s LEU 126 N -0.54 4.63 -0.15 3.45 2.96 -1.26 -5.04 118.68 122.73 3n4f s LEU 126 Ca 0.63 -0.43 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 3n4f s LEU 126 Cb -0.48 -2.34 0.03 0.00 0.50 0.00 0.00 46.19 43.90 3n4f s LEU 126 CO 0.48 -0.43 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.27 3n4f s VAL 127 N 2.03 1.47 -0.07 1.68 1.01 -1.26 -0.62 120.40 124.65 3n4f s VAL 127 Ca 0.11 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.53 3n4f s VAL 127 Cb -0.17 -1.42 -0.00 0.00 0.00 0.00 0.00 36.38 34.79 3n4f s VAL 127 CO 0.12 0.40 -0.22 -0.69 0.00 0.00 0.00 175.10 174.71 3n4f s VAL 128 N 1.52 1.87 0.43 2.92 1.01 0.33 -4.93 120.40 123.54 3n4f s VAL 128 Ca 0.04 -0.94 -0.26 0.00 0.00 0.00 0.00 61.98 60.83 3n4f s VAL 128 Cb -0.13 -1.60 -0.09 0.00 0.00 0.00 0.00 36.38 34.55 3n4f s VAL 128 CO -0.10 0.52 1.38 -2.65 0.00 0.00 0.00 175.10 174.25 3n4f n PRO 129 N 3.25 2.18 -4.10 2.72 -0.02 -1.26 0.78 135.00 138.55 3n4f n PRO 129 Ca -0.19 0.78 -0.07 0.00 -2.02 0.00 0.00 63.50 62.00 3n4f n PRO 129 Cb 0.52 -2.53 -0.10 0.00 -0.02 0.00 0.00 33.50 31.37 3n4f n PRO 129 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3n4f s TYR 131 N -3.85 0.76 -0.42 0.00 -0.85 -0.75 -4.51 117.35 107.74 3n4f s TYR 131 Ca 0.07 -0.68 -0.28 0.00 -0.52 0.00 0.00 57.07 55.67 3n4f s TYR 131 Cb 0.07 -0.45 0.02 0.00 0.38 0.00 0.00 41.96 41.99 3n4f s TYR 131 CO -0.09 -0.12 1.04 0.34 -1.52 0.00 0.00 175.55 175.20 3n4f s ASP 132 N -2.20 6.68 0.00 -0.18 2.15 -0.47 -0.98 116.67 121.67 3n4f s ASP 132 Ca -0.01 0.55 0.24 0.00 0.43 0.00 0.00 52.55 53.77 3n4f s ASP 132 Cb -0.03 -2.51 0.49 0.00 -0.30 0.00 0.00 42.92 40.57 3n4f s ASP 132 CO -0.02 -1.05 1.43 1.07 -0.17 0.00 0.00 175.17 176.43 3n4f n THR 133 N 6.37 0.15 1.48 1.71 5.66 -0.82 -1.26 114.28 127.58 3n4f n THR 133 Ca 0.10 -0.49 0.04 0.00 -3.05 0.00 0.00 64.05 60.64 3n4f n THR 133 Cb 0.48 1.02 0.13 0.00 -1.55 0.00 0.00 70.33 70.42 3n4f n THR 133 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 3n4f n SER 134 N 1.02 0.90 -4.05 1.09 3.41 -1.26 -4.68 113.62 110.04 3n4f n SER 134 Ca 0.17 -1.94 -0.43 0.00 -0.26 0.00 0.00 58.87 56.41 3n4f n SER 134 Cb 0.52 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 3n4f n SER 134 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3n4f n LEU 135 N -0.04 6.21 0.00 1.04 4.77 -1.25 -4.91 117.00 122.82 3n4f n LEU 135 Ca 0.07 -4.55 -0.09 0.00 -0.03 0.00 0.00 56.01 51.41 3n4f n LEU 135 Cb 0.15 -1.53 0.06 0.00 -2.33 0.00 0.00 43.42 39.77 3n4f n LEU 135 CO 0.05 1.15 0.26 -1.22 -1.33 0.00 0.00 177.39 176.30 3n4f n TYR 136 N 4.60 -3.83 -2.37 -1.77 4.02 -1.26 -1.62 117.16 114.94 3n4f n TYR 136 Ca 0.40 -0.42 -0.37 0.00 -0.01 0.00 0.00 57.90 57.50 3n4f n TYR 136 Cb 0.38 -0.31 -0.02 0.00 -0.02 0.00 0.00 39.34 39.37 3n4f n TYR 136 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 3n4f n PHE 137 N -2.43 3.89 0.07 -0.72 3.72 0.71 -4.70 117.46 118.01 3n4f n PHE 137 Ca 0.05 -2.29 0.09 0.00 -0.05 0.00 0.00 57.45 55.26 3n4f n PHE 137 Cb 0.19 -2.63 0.27 0.00 -0.94 0.00 0.00 39.48 36.36 3n4f n PHE 137 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3n4f n ASP 138 N 10.81 3.26 -0.18 4.37 8.00 -1.26 -3.12 116.55 138.43 3n4f n ASP 138 Ca 0.47 -2.04 0.02 0.00 0.71 0.00 0.00 54.79 53.96 3n4f n ASP 138 Cb 0.46 -0.41 0.02 0.00 -0.02 0.00 0.00 41.12 41.18 3n4f n ASP 138 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3n4f n ASP 139 N 1.21 1.52 0.11 -2.24 5.75 -1.26 -4.73 116.55 116.91 3n4f n ASP 139 Ca 0.20 -1.31 0.08 0.00 -0.01 0.00 0.00 54.79 53.75 3n4f n ASP 139 Cb 0.53 -0.01 0.43 0.00 -1.03 0.00 0.00 41.12 41.03 3n4f n ASP 139 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3n4f n LEU 140 N 0.18 0.42 -0.03 -2.12 4.77 -1.26 -1.15 117.00 117.80 3n4f n LEU 140 Ca 0.03 0.68 0.14 0.00 -0.03 0.00 0.00 56.01 56.82 3n4f n LEU 140 Cb 0.14 -0.71 0.53 0.00 -2.33 0.00 0.00 43.42 41.05 3n4f n LEU 140 CO 0.03 -0.77 0.81 0.00 -1.33 0.00 0.00 177.39 176.13 3n4f n HIS 141 N -2.04 0.00 -3.77 -1.77 1.44 -1.26 -4.87 115.22 102.94 3n4f n HIS 141 Ca -0.00 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.34 3n4f n HIS 141 Cb 0.05 -0.34 -0.10 0.00 0.12 0.00 0.00 29.99 29.72 3n4f n HIS 141 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3n4f s LEU 142 N -2.84 3.88 0.09 2.39 1.43 -0.30 -4.98 118.68 118.34 3n4f s LEU 142 Ca 0.18 0.02 -0.13 0.00 -1.03 0.00 0.00 54.13 53.17 3n4f s LEU 142 Cb 0.19 -2.03 -0.18 0.00 0.03 0.00 0.00 46.19 44.20 3n4f s LEU 142 CO 0.56 0.06 1.27 0.00 0.23 0.00 0.00 176.35 178.47 3n4f h ALA 143 N 7.55 0.26 -2.36 4.21 0.00 -1.89 -3.45 119.26 123.57 3n4f h ALA 143 Ca -0.37 -0.61 -0.60 0.00 0.00 0.00 0.00 54.91 53.32 3n4f h ALA 143 Cb 1.17 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.87 3n4f h ALA 143 CO 0.64 0.66 0.34 0.34 0.00 0.00 0.00 179.25 181.23 3n4f s ASP 144 N -7.12 6.72 0.24 0.00 2.15 -1.26 -4.96 116.67 112.45 3n4f s ASP 144 Ca -0.10 0.89 -0.04 0.00 0.43 0.00 0.00 52.55 53.72 3n4f s ASP 144 Cb 0.08 -2.39 0.47 0.00 -0.30 0.00 0.00 42.92 40.77 3n4f s ASP 144 CO 0.90 -0.46 1.70 -0.08 -0.17 0.00 0.00 175.17 177.07 3n4f h GLU 145 N 7.78 0.33 -0.92 4.34 4.81 -2.00 -1.07 114.58 127.85 3n4f h GLU 145 Ca -0.25 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.01 3n4f h GLU 145 Cb 1.10 -0.08 -0.06 0.00 0.63 0.00 0.00 28.75 30.35 3n4f h GLU 145 CO 0.83 0.22 0.60 0.00 -0.73 0.00 0.00 179.01 179.94 3n4f h ARG 146 N 0.34 1.09 -0.43 1.92 3.08 -1.99 -1.04 114.38 117.34 3n4f h ARG 146 Ca 0.42 -0.07 -0.13 0.00 0.07 0.00 0.00 59.98 60.27 3n4f h ARG 146 Cb 0.68 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 3n4f h ARG 146 CO -0.46 0.72 -0.26 0.00 -1.07 0.00 0.00 179.97 178.90 3n4f h ALA 147 N 1.48 0.61 0.10 0.04 0.00 -1.63 -2.45 119.26 117.41 3n4f h ALA 147 Ca 0.38 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3n4f h ALA 147 Cb 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3n4f h ALA 147 CO -0.12 0.63 -0.05 0.00 0.00 0.00 0.00 179.25 179.70 3n4f h ALA 148 N 0.82 -0.13 -0.82 0.00 0.00 -1.04 -1.69 119.26 116.41 3n4f h ALA 148 Ca 0.09 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.07 3n4f h ALA 148 Cb 0.84 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 3n4f h ALA 148 CO 0.07 -0.55 0.43 0.28 0.00 0.00 0.00 179.25 179.48 3n4f h VAL 149 N -0.18 0.80 -0.03 0.00 2.07 -1.22 -2.57 116.25 115.12 3n4f h VAL 149 Ca -0.01 -0.23 -0.14 0.00 0.82 0.00 0.00 66.70 67.14 3n4f h VAL 149 Cb 0.15 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 3n4f h VAL 149 CO 0.02 0.12 -0.64 0.00 0.02 0.00 0.00 177.57 177.10 3n4f h ALA 150 N 1.51 0.87 0.00 1.67 0.00 -1.22 0.82 119.26 122.90 3n4f h ALA 150 Ca 0.42 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3n4f h ALA 150 Cb 0.52 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3n4f h ALA 150 CO -0.31 0.77 0.00 -0.11 0.00 0.00 0.00 179.25 179.59 3n4f n LEU 151 N -3.82 0.25 0.00 0.00 7.94 -0.65 -1.71 117.00 119.01 3n4f n LEU 151 Ca -0.02 -0.12 0.00 0.00 -1.11 0.00 0.00 56.01 54.76 3n4f n LEU 151 Cb 0.63 -0.12 0.00 0.00 0.53 0.00 0.00 43.42 44.46 3n4f n LEU 151 CO 0.44 0.06 0.00 0.00 -1.11 0.00 0.00 177.39 176.78 3n4f n GLN 153 N 0.13 0.00 -0.25 1.96 6.02 0.28 -1.52 117.38 124.00 3n4f n GLN 153 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.96 3n4f n GLN 153 Cb 0.06 0.00 0.08 0.00 1.02 0.00 0.00 30.24 31.41 3n4f n GLN 153 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 3n4f h GLU 154 N 0.00 0.82 -0.47 -1.09 4.22 -1.58 -2.83 114.58 113.64 3n4f h GLU 154 Ca 0.00 -0.05 -0.04 0.00 0.08 0.00 0.00 59.36 59.36 3n4f h GLU 154 Cb 0.00 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 3n4f h GLU 154 CO 0.00 0.54 0.16 0.93 -2.18 0.00 0.00 179.01 178.46 3n4f h GLU 155 N 0.84 0.73 -1.63 1.92 5.08 -1.55 -1.26 114.58 118.71 3n4f h GLU 155 Ca 0.29 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3n4f h GLU 155 Cb 0.05 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3n4f h GLU 155 CO -0.12 0.68 0.00 0.00 -1.00 0.00 0.00 179.01 178.57 3n4f n ALA 156 N -2.35 1.24 0.00 3.43 0.00 -1.07 -2.45 120.51 119.31 3n4f n ALA 156 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3n4f n ALA 156 Cb 0.18 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.77 3n4f n ALA 156 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3n4f n GLN 158 N 0.87 0.00 -0.12 0.00 6.02 -0.48 -0.87 117.38 122.80 3n4f n GLN 158 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.89 3n4f n GLN 158 Cb 0.00 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.24 3n4f n GLN 158 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 3n4f h GLY 159 N 0.00 0.64 0.78 1.08 0.00 -1.77 -3.19 103.07 100.62 3n4f h GLY 159 Ca 0.00 -0.43 0.07 0.00 0.00 0.00 0.00 47.33 46.98 3n4f h GLY 159 CO 0.00 0.40 0.60 -1.82 0.00 0.00 0.00 176.54 175.72 3n4f h TYR 160 N 0.43 1.08 0.00 5.60 5.03 -1.11 -1.02 116.97 126.97 3n4f h TYR 160 Ca 0.11 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.45 3n4f h TYR 160 Cb 0.36 -0.35 0.00 0.00 1.55 0.00 0.00 36.73 38.29 3n4f h TYR 160 CO 0.02 0.54 0.00 0.00 -1.32 0.00 0.00 178.16 177.41 3n4f h ALA 161 N 1.51 1.00 -0.59 1.82 0.00 -1.83 -2.10 119.26 119.06 3n4f h ALA 161 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3n4f h ALA 161 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3n4f h ALA 161 CO -0.16 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.72 3n4f n LYS 162 N -2.96 4.07 -0.21 0.00 5.02 -0.50 -4.94 118.16 118.65 3n4f n LYS 162 Ca 0.01 -2.97 0.00 0.00 -2.02 0.00 0.00 58.31 53.33 3n4f n LYS 162 Cb 0.30 -2.00 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 3n4f n LYS 162 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3n4f n GLY 163 N 0.84 0.65 3.75 0.72 0.00 -0.79 -4.70 105.19 105.66 3n4f n GLY 163 Ca 0.26 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.88 3n4f n GLY 163 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3n4f s GLN 164 N -0.79 4.70 0.00 1.61 -1.52 -0.56 -0.18 119.66 122.92 3n4f s GLN 164 Ca 0.00 1.68 0.00 0.00 -1.95 0.00 0.00 55.36 55.09 3n4f s GLN 164 Cb 0.00 -3.24 0.00 0.00 -0.22 0.00 0.00 33.01 29.55 3n4f s GLN 164 CO 0.00 0.29 0.03 0.54 -0.25 0.00 0.00 175.29 175.90 3n4f n ARG 165 N 1.52 3.74 -4.59 2.91 5.12 -1.26 -3.89 116.66 120.21 3n4f n ARG 165 Ca -0.01 -0.03 -0.24 0.00 -1.93 0.00 0.00 57.85 55.64 3n4f n ARG 165 Cb 0.46 -0.36 -0.14 0.00 -1.16 0.00 0.00 32.46 31.26 3n4f n ARG 165 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 3n4f s HIS 166 N -0.54 1.64 -0.01 -1.55 3.76 -1.26 -3.78 115.29 113.55 3n4f s HIS 166 Ca 0.00 -0.36 0.00 0.00 -0.15 0.00 0.00 55.06 54.55 3n4f s HIS 166 Cb 0.00 -0.99 0.02 0.00 1.11 0.00 0.00 32.58 32.72 3n4f s HIS 166 CO 0.00 0.07 0.01 -0.06 -0.85 0.00 0.00 174.74 173.90 3n4f s PHE 167 N -0.77 0.11 -0.18 1.40 0.40 -0.27 -1.37 117.98 117.29 3n4f s PHE 167 Ca 0.06 0.05 -0.04 0.00 -0.60 0.00 0.00 56.93 56.40 3n4f s PHE 167 Cb -0.08 -0.21 -0.02 0.00 0.51 0.00 0.00 43.02 43.22 3n4f s PHE 167 CO 0.01 -0.07 -0.04 0.21 0.70 0.00 0.00 175.22 176.04 3n4f s LYS 168 N 0.67 3.54 -0.19 0.44 2.20 -0.39 -4.24 119.74 121.77 3n4f s LYS 168 Ca -0.06 -0.57 -0.02 0.00 -0.36 0.00 0.00 55.97 54.96 3n4f s LYS 168 Cb -0.09 -2.95 -0.00 0.00 -1.51 0.00 0.00 37.83 33.28 3n4f s LYS 168 CO -0.02 0.05 -0.11 0.42 -0.36 0.00 0.00 175.35 175.34 3n4f s ILE 169 N 0.85 2.95 0.17 5.43 1.01 -1.26 -3.95 121.20 126.40 3n4f s ILE 169 Ca -0.01 -0.65 -0.31 0.00 0.00 0.00 0.00 60.65 59.68 3n4f s ILE 169 Cb -0.15 -2.29 -0.09 0.00 0.01 0.00 0.00 42.46 39.94 3n4f s ILE 169 CO 0.01 0.48 1.50 -0.54 0.00 0.00 0.00 174.94 176.39 3n4f s LYS 170 N 1.14 4.25 0.41 2.79 -0.14 -0.64 -1.85 119.74 125.70 3n4f s LYS 170 Ca 0.01 2.27 0.03 0.00 -1.36 0.00 0.00 55.97 56.93 3n4f s LYS 170 Cb -0.14 -3.17 -0.01 0.00 -1.68 0.00 0.00 37.83 32.82 3n4f s LYS 170 CO -0.03 -0.53 0.12 1.33 -0.76 0.00 0.00 175.35 175.48 3n4f n VAL 171 N 3.68 0.00 -0.19 3.17 0.24 -0.13 -4.79 118.33 120.32 3n4f n VAL 171 Ca 0.12 -2.28 0.00 0.00 -2.04 0.00 0.00 64.34 60.14 3n4f n VAL 171 Cb 0.40 0.76 0.00 0.00 -1.47 0.00 0.00 33.84 33.53 3n4f n VAL 171 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3n4f n GLY 172 N -0.69 1.22 0.35 7.63 0.00 -1.26 -4.16 105.19 108.29 3n4f n GLY 172 Ca -0.08 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 45.93 3n4f n GLY 172 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3n4f h ARG 173 N 0.00 0.32 -0.00 1.61 3.08 -1.91 -1.59 114.38 115.89 3n4f h ARG 173 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3n4f h ARG 173 Cb 0.05 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.03 3n4f h ARG 173 CO 0.00 0.21 -0.03 0.41 -1.07 0.00 0.00 179.97 179.49 3n4f n GLY 174 N -1.54 -1.43 0.15 0.04 0.00 -1.26 -2.90 105.19 98.25 3n4f n GLY 174 Ca 0.09 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 3n4f n GLY 174 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3n4f h GLY 175 N 5.00 0.45 0.00 -0.02 0.00 -1.51 -3.31 103.07 103.68 3n4f h GLY 175 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 3n4f h GLY 175 CO 0.00 0.38 -0.25 -2.13 0.00 0.00 0.00 176.54 174.54 3n4f n ARG 176 N -4.55 0.00 -0.13 4.80 0.63 -1.25 -5.04 116.66 111.11 3n4f n ARG 176 Ca -0.05 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 56.92 3n4f n ARG 176 Cb 0.33 -0.40 0.13 0.00 0.45 0.00 0.00 32.46 32.98 3n4f n ARG 176 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 3n4f n HIS 177 N -2.15 0.34 -2.56 -0.14 8.25 -1.14 -5.11 115.22 112.71 3n4f n HIS 177 Ca 0.00 -0.17 -0.35 0.00 -0.26 0.00 0.00 57.72 56.94 3n4f n HIS 177 Cb 0.12 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.19 3n4f n HIS 177 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 3n4f s PRO 179 N -1.66 4.02 0.10 -0.41 0.02 -1.26 -5.03 135.00 130.78 3n4f s PRO 179 Ca 0.18 1.42 -0.27 0.00 0.02 0.00 0.00 61.00 62.35 3n4f s PRO 179 Cb 0.09 -2.33 -0.11 0.00 0.02 0.00 0.00 34.50 32.17 3n4f s PRO 179 CO 0.12 -0.25 1.65 1.25 -0.33 0.00 0.00 177.00 179.45 3n4f h LEU 180 N 2.07 -0.60 -0.17 -5.54 5.85 -1.92 0.25 115.31 115.24 3n4f h LEU 180 Ca -0.49 0.06 -0.14 0.00 0.84 0.00 0.00 57.88 58.15 3n4f h LEU 180 Cb 1.21 0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.46 3n4f h LEU 180 CO 0.61 -0.32 -0.44 -0.50 -0.34 0.00 0.00 178.44 177.45 3n4f h TRP 181 N -0.46 0.77 -0.62 1.25 4.06 -1.99 -1.62 115.95 117.34 3n4f h TRP 181 Ca 0.01 -0.30 -0.08 0.00 2.06 0.00 0.00 58.89 60.58 3n4f h TRP 181 Cb 0.44 -0.14 -0.02 0.00 -1.00 0.00 0.00 29.16 28.44 3n4f h TRP 181 CO -0.17 1.06 0.08 0.93 -3.56 0.00 0.00 178.44 176.78 3n4f h GLU 182 N 0.26 1.04 -0.70 0.49 3.07 -1.97 -1.13 114.58 115.64 3n4f h GLU 182 Ca -0.01 -0.29 -0.05 0.00 -0.50 0.00 0.00 59.36 58.52 3n4f h GLU 182 Cb 1.05 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 28.81 3n4f h GLU 182 CO 0.09 0.98 0.25 0.78 -1.40 0.00 0.00 179.01 179.72 3n4f h GLY 183 N 0.95 1.13 1.22 -3.84 0.00 -0.48 -0.91 103.07 101.14 3n4f h GLY 183 Ca 0.19 -0.62 -0.20 0.00 0.00 0.00 0.00 47.33 46.70 3n4f h GLY 183 CO 0.02 0.58 -0.64 -0.84 0.00 0.00 0.00 176.54 175.66 3n4f h THR 184 N 1.02 1.28 -0.83 4.70 2.02 -1.09 -0.23 112.91 119.78 3n4f h THR 184 Ca 0.23 -1.85 0.02 0.00 0.77 0.00 0.00 66.41 65.59 3n4f h THR 184 Cb 0.24 1.79 -0.05 0.00 -1.74 0.00 0.00 68.15 68.39 3n4f h THR 184 CO -0.01 0.59 0.54 0.50 0.37 0.00 0.00 175.52 177.51 3n4f h LYS 185 N 0.58 1.04 -0.45 6.66 3.64 -1.11 -1.93 116.57 125.01 3n4f h LYS 185 Ca -0.01 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.25 3n4f h LYS 185 Cb 1.25 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 3n4f h LYS 185 CO 0.13 0.69 0.09 -0.09 -2.27 0.00 0.00 179.45 178.00 3n4f h ARG 186 N 1.08 0.74 -0.27 1.90 9.65 -0.94 -1.49 114.38 125.04 3n4f h ARG 186 Ca 0.32 -0.19 0.07 0.00 -1.10 0.00 0.00 59.98 59.08 3n4f h ARG 186 Cb -0.05 -0.09 -0.07 0.00 -1.39 0.00 0.00 29.97 28.37 3n4f h ARG 186 CO -0.09 0.75 -0.23 -0.44 2.80 0.00 0.00 179.97 182.76 3n4f h ASP 187 N 0.60 -0.74 -0.70 -3.80 3.32 -0.78 -0.92 116.42 113.41 3n4f h ASP 187 Ca 0.14 0.14 -0.05 0.00 0.02 0.00 0.00 57.03 57.28 3n4f h ASP 187 Cb 0.36 0.36 -0.03 0.00 0.22 0.00 0.00 39.33 40.24 3n4f h ASP 187 CO 0.01 -0.26 0.25 0.40 -1.72 0.00 0.00 179.24 177.91 3n4f h ILE 188 N -0.22 1.25 -0.56 0.35 2.04 -1.09 -1.54 117.51 117.74 3n4f h ILE 188 Ca 0.15 -0.82 -0.01 0.00 1.00 0.00 0.00 64.86 65.18 3n4f h ILE 188 Cb 0.45 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 3n4f h ILE 188 CO -0.40 0.33 0.32 0.00 0.00 0.00 0.00 178.15 178.40 3n4f h ALA 189 N 1.11 0.71 -0.32 1.87 0.00 -1.06 -1.51 119.26 120.07 3n4f h ALA 189 Ca 0.23 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3n4f h ALA 189 Cb 0.25 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3n4f h ALA 189 CO -0.01 0.21 0.06 0.82 0.00 0.00 0.00 179.25 180.32 3n4f h ILE 190 N 0.75 1.23 -0.20 0.00 1.08 -0.76 -1.22 117.51 118.39 3n4f h ILE 190 Ca 0.20 -0.80 -0.01 0.00 -0.39 0.00 0.00 64.86 63.87 3n4f h ILE 190 Cb 0.01 1.14 -0.01 0.00 -3.07 0.00 0.00 36.82 34.89 3n4f h ILE 190 CO -0.04 0.26 0.10 0.58 -0.69 0.00 0.00 178.15 178.37 3n4f h VAL 191 N 0.36 1.13 -0.78 1.67 2.07 -1.20 -0.76 116.25 118.73 3n4f h VAL 191 Ca 0.10 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.30 3n4f h VAL 191 Cb 0.33 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.06 3n4f h VAL 191 CO 0.00 0.12 0.48 0.03 0.02 0.00 0.00 177.57 178.23 3n4f h ARG 192 N 0.19 0.87 -0.09 1.57 3.08 -1.21 0.55 114.38 119.34 3n4f h ARG 192 Ca 0.07 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 3n4f h ARG 192 Cb 0.11 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 3n4f h ARG 192 CO -0.01 0.58 0.04 0.78 -1.07 0.00 0.00 179.97 180.28 3n4f h GLY 193 N 0.90 0.15 1.15 0.04 0.00 -0.95 -1.95 103.07 102.41 3n4f h GLY 193 Ca 0.33 -0.08 -0.08 0.00 0.00 0.00 0.00 47.33 47.49 3n4f h GLY 193 CO -0.15 0.08 0.05 -2.22 0.00 0.00 0.00 176.54 174.30 3n4f h ILE 194 N -0.01 1.26 -0.70 2.60 2.04 -0.89 -2.38 117.51 119.43 3n4f h ILE 194 Ca 0.03 -1.08 0.03 0.00 1.00 0.00 0.00 64.86 64.84 3n4f h ILE 194 Cb 0.18 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 3n4f h ILE 194 CO -0.00 0.39 0.46 0.77 0.00 0.00 0.00 178.15 179.77 3n4f h SER 195 N 0.95 0.74 -0.19 1.72 4.64 -0.81 1.00 113.55 121.61 3n4f h SER 195 Ca 0.18 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.41 3n4f h SER 195 Cb 0.49 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.38 3n4f h SER 195 CO 0.02 0.52 -0.12 -0.33 -0.87 0.00 0.00 176.83 176.05 3n4f h GLU 196 N 0.87 0.56 -0.19 4.77 5.08 -0.99 -2.85 114.58 121.84 3n4f h GLU 196 Ca 0.27 -0.17 -0.15 0.00 -1.00 0.00 0.00 59.36 58.31 3n4f h GLU 196 Cb 0.02 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3n4f h GLU 196 CO -0.07 0.68 -0.48 0.28 -1.00 0.00 0.00 179.01 178.41 3n4f h VAL 197 N 0.52 1.32 0.00 3.13 2.07 -0.75 -3.32 116.25 119.22 3n4f h VAL 197 Ca 0.09 -1.71 -0.09 0.00 0.82 0.00 0.00 66.70 65.81 3n4f h VAL 197 Cb 0.52 1.89 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 3n4f h VAL 197 CO 0.03 0.53 -0.42 0.00 0.02 0.00 0.00 177.57 177.73 3n4f h ALA 198 N 0.59 1.18 0.00 1.67 0.00 -0.76 -3.50 119.26 118.44 3n4f h ALA 198 Ca -0.01 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3n4f h ALA 198 Cb 1.09 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3n4f h ALA 198 CO 0.10 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.29 3n4f n GLY 199 N -0.13 -0.17 0.28 0.00 0.00 -1.08 -4.06 105.19 100.02 3n4f n GLY 199 Ca -0.01 -1.76 0.01 0.00 0.00 0.00 0.00 46.02 44.26 3n4f n GLY 199 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3n4f h PRO 200 N 0.00 0.51 0.00 1.61 0.13 -1.93 -2.70 132.00 129.62 3n4f h PRO 200 Ca 0.00 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 3n4f h PRO 200 Cb 0.00 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.04 3n4f h PRO 200 CO 0.00 0.48 0.00 0.00 -0.23 0.00 0.00 178.00 178.25 3n4f h ALA 201 N 1.59 1.00 -2.29 -0.56 0.00 -1.97 -3.45 119.26 113.58 3n4f h ALA 201 Ca 0.12 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.47 3n4f h ALA 201 Cb 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3n4f h ALA 201 CO -0.00 0.00 0.74 0.20 0.00 0.00 0.00 179.25 180.19 3n4f s GLY 202 N -4.05 2.01 0.20 0.00 0.00 -1.02 -5.00 107.32 99.46 3n4f s GLY 202 Ca 0.04 0.62 -0.30 0.00 0.00 0.00 0.00 44.72 45.08 3n4f s GLY 202 CO 0.56 2.29 1.00 0.54 0.00 0.00 0.00 173.10 177.48 3n4f s LYS 203 N 2.43 4.74 0.48 2.90 1.02 -1.25 -4.76 119.74 125.29 3n4f s LYS 203 Ca 0.56 1.57 0.01 0.00 0.02 0.00 0.00 55.97 58.13 3n4f s LYS 203 Cb -0.25 -3.29 0.01 0.00 -0.52 0.00 0.00 37.83 33.78 3n4f s LYS 203 CO 0.21 0.31 0.08 -0.89 -0.92 0.00 0.00 175.35 174.14 3n4f n ILE 204 N 1.95 0.00 -3.63 2.17 2.08 -0.73 -1.12 119.36 120.08 3n4f n ILE 204 Ca 0.00 -2.18 -0.12 0.00 0.56 0.00 0.00 62.75 61.02 3n4f n ILE 204 Cb 0.47 0.34 -0.07 0.00 -0.75 0.00 0.00 39.64 39.63 3n4f n ILE 204 CO 0.00 0.00 0.00 0.27 0.56 0.00 0.00 176.55 177.38 3n4f s ILE 206 N -2.66 0.00 -0.16 1.39 -4.36 -0.97 0.69 121.20 115.12 3n4f s ILE 206 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.45 3n4f s ILE 206 Cb -0.00 -1.00 0.03 0.00 1.25 0.00 0.00 42.46 42.74 3n4f s ILE 206 CO 0.04 0.00 -0.11 -0.62 0.24 0.00 0.00 174.94 174.48 3n4f s ASP 207 N 0.55 2.83 0.00 4.36 -1.08 -0.77 -1.05 116.67 121.51 3n4f s ASP 207 Ca -0.01 -0.59 0.24 0.00 -0.52 0.00 0.00 52.55 51.67 3n4f s ASP 207 Cb -0.05 -1.12 0.33 0.00 -1.46 0.00 0.00 42.92 40.61 3n4f s ASP 207 CO -0.04 -0.10 1.29 0.00 0.52 0.00 0.00 175.17 176.84 3n4f n ALA 208 N 4.78 3.77 -4.24 3.66 0.00 -0.71 -0.95 120.51 126.82 3n4f n ALA 208 Ca -0.15 -0.45 -0.34 0.00 0.00 0.00 0.00 53.44 52.50 3n4f n ALA 208 Cb 0.49 -1.01 -0.05 0.00 0.00 0.00 0.00 19.45 18.89 3n4f n ALA 208 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3n4f n ASN 209 N -1.21 -1.77 -0.18 0.00 4.13 -1.16 -1.49 115.26 113.58 3n4f n ASN 209 Ca 0.07 -1.09 -0.02 0.00 1.68 0.00 0.00 54.58 55.21 3n4f n ASN 209 Cb 0.35 -2.45 -0.01 0.00 -1.54 0.00 0.00 39.78 36.13 3n4f n ASN 209 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3n4f n ASN 210 N -2.73 -4.28 0.00 6.41 3.02 0.40 -4.37 115.26 113.71 3n4f n ASN 210 Ca -0.06 0.06 0.13 0.00 -0.03 0.00 0.00 54.58 54.68 3n4f n ASN 210 Cb 0.56 -1.99 0.59 0.00 -0.61 0.00 0.00 39.78 38.32 3n4f n ASN 210 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3n4f n ALA 211 N 1.04 2.24 -2.03 5.41 0.00 -0.55 -4.57 120.51 122.05 3n4f n ALA 211 Ca -0.02 -0.10 -0.19 0.00 0.00 0.00 0.00 53.44 53.13 3n4f n ALA 211 Cb 0.24 -1.43 0.04 0.00 0.00 0.00 0.00 19.45 18.30 3n4f n ALA 211 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3n4f s TYR 212 N -2.93 1.95 0.29 0.00 2.02 -0.62 -4.48 117.35 113.58 3n4f s TYR 212 Ca 0.15 -0.60 0.00 0.00 -0.37 0.00 0.00 57.07 56.25 3n4f s TYR 212 Cb 0.18 -2.27 -0.00 0.00 -0.40 0.00 0.00 41.96 39.46 3n4f s TYR 212 CO 0.47 -0.87 0.02 0.27 -1.57 0.00 0.00 175.55 173.87 3n4f n ASN 213 N -2.09 2.52 -0.05 2.29 0.23 -1.26 -4.49 115.26 112.41 3n4f n ASN 213 Ca 0.13 -2.31 -0.10 0.00 -0.53 0.00 0.00 54.58 51.76 3n4f n ASN 213 Cb 0.61 0.28 -0.04 0.00 -2.08 0.00 0.00 39.78 38.55 3n4f n ASN 213 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 3n4f h LEU 214 N 0.00 0.25 -0.73 -4.53 5.85 -1.98 -1.08 115.31 113.09 3n4f h LEU 214 Ca -0.24 -0.12 -0.11 0.00 0.84 0.00 0.00 57.88 58.26 3n4f h LEU 214 Cb 0.75 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 3n4f h LEU 214 CO 0.39 0.30 -0.21 0.78 -0.34 0.00 0.00 178.44 179.36 3n4f h ASN 215 N 0.19 0.75 -0.54 1.25 2.35 -1.99 -1.26 115.58 116.32 3n4f h ASN 215 Ca 0.07 -0.26 0.02 0.00 -0.55 0.00 0.00 56.30 55.57 3n4f h ASN 215 Cb 0.11 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 3n4f h ASN 215 CO -0.01 0.95 0.34 -0.07 -1.65 0.00 0.00 177.43 176.99 3n4f h LEU 216 N 0.65 0.57 -0.40 1.61 3.38 -1.94 -1.66 115.31 117.52 3n4f h LEU 216 Ca 0.09 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.09 3n4f h LEU 216 Cb 0.71 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 3n4f h LEU 216 CO 0.05 0.41 0.19 0.74 0.09 0.00 0.00 178.44 179.92 3n4f h THR 217 N 0.69 0.95 -0.85 0.22 2.02 -0.90 -1.94 112.91 113.10 3n4f h THR 217 Ca 0.21 -0.13 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 3n4f h THR 217 Cb -0.03 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 66.88 3n4f h THR 217 CO -0.07 0.07 0.42 0.11 0.37 0.00 0.00 175.52 176.42 3n4f h LYS 218 N 0.38 1.22 -0.59 6.66 1.57 -1.02 0.21 116.57 125.00 3n4f h LYS 218 Ca 0.18 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 3n4f h LYS 218 Cb 0.10 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 3n4f h LYS 218 CO -0.14 0.93 0.26 1.49 -0.57 0.00 0.00 179.45 181.42 3n4f h GLU 219 N 1.21 0.86 0.09 3.15 4.81 -1.16 0.45 114.58 123.99 3n4f h GLU 219 Ca 0.29 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3n4f h GLU 219 Cb 0.10 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.34 3n4f h GLU 219 CO -0.04 0.72 -0.04 0.28 -0.73 0.00 0.00 179.01 179.20 3n4f h VAL 220 N 0.80 1.06 -0.53 0.32 2.07 -1.03 -1.82 116.25 117.12 3n4f h VAL 220 Ca 0.20 -0.55 0.03 0.00 0.82 0.00 0.00 66.70 67.19 3n4f h VAL 220 Cb 0.16 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 3n4f h VAL 220 CO -0.02 0.14 0.31 -0.07 0.02 0.00 0.00 177.57 177.95 3n4f h LEU 221 N -0.38 0.50 -0.80 2.57 3.38 -0.94 -1.87 115.31 117.77 3n4f h LEU 221 Ca -0.01 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.04 3n4f h LEU 221 Cb 0.32 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 3n4f h LEU 221 CO 0.02 0.35 0.47 0.00 0.09 0.00 0.00 178.44 179.37 3n4f h ALA 222 N 1.24 1.12 0.00 1.53 0.00 -0.87 -1.88 119.26 120.41 3n4f h ALA 222 Ca 0.22 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3n4f h ALA 222 Cb 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3n4f h ALA 222 CO -0.10 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.29 3n4f n ALA 223 N -2.37 1.98 -1.35 0.00 0.00 -0.69 -3.12 120.51 114.97 3n4f n ALA 223 Ca 0.12 -0.04 -0.03 0.00 0.00 0.00 0.00 53.44 53.49 3n4f n ALA 223 Cb 0.23 -1.37 0.21 0.00 0.00 0.00 0.00 19.45 18.51 3n4f n ALA 223 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3n4f n LEU 224 N -1.72 4.26 -0.36 0.00 4.77 -0.72 -4.80 117.00 118.43 3n4f n LEU 224 Ca 0.05 -3.61 0.06 0.00 -0.03 0.00 0.00 56.01 52.47 3n4f n LEU 224 Cb 0.27 -0.63 0.22 0.00 -2.33 0.00 0.00 43.42 40.95 3n4f n LEU 224 CO 0.21 1.13 1.25 0.28 -1.33 0.00 0.00 177.39 178.93 3n4f h SER 225 N 1.15 0.96 0.01 -1.43 0.02 -1.47 -2.35 113.55 110.45 3n4f h SER 225 Ca 0.21 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 3n4f h SER 225 Cb 1.70 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 64.08 3n4f h SER 225 CO 0.41 0.55 -0.05 0.47 -1.14 0.00 0.00 176.83 177.06 3n4f n ASP 226 N -4.57 1.81 -4.78 3.07 10.43 -1.26 -4.90 116.55 116.35 3n4f n ASP 226 Ca 0.18 -1.54 -0.39 0.00 2.57 0.00 0.00 54.79 55.60 3n4f n ASP 226 Cb 0.30 0.04 -0.06 0.00 1.84 0.00 0.00 41.12 43.24 3n4f n ASP 226 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3n4f s VAL 227 N -2.08 4.52 -1.14 2.53 1.01 -0.88 -4.96 120.40 119.39 3n4f s VAL 227 Ca 0.33 1.55 -0.12 0.00 0.00 0.00 0.00 61.98 63.74 3n4f s VAL 227 Cb 0.20 -4.07 -0.07 0.00 0.00 0.00 0.00 36.38 32.45 3n4f s VAL 227 CO 0.36 0.51 2.28 -3.20 0.00 0.00 0.00 175.10 175.05 3n4f n ASN 228 N 1.80 5.03 -4.65 3.32 5.15 -1.26 -4.91 115.26 119.73 3n4f n ASN 228 Ca -0.07 -2.56 -0.43 0.00 -0.60 0.00 0.00 54.58 50.93 3n4f n ASN 228 Cb 0.49 -1.31 -0.02 0.00 -0.53 0.00 0.00 39.78 38.41 3n4f n ASN 228 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3n4f s LEU 229 N 0.76 4.15 -0.18 1.20 1.43 -1.26 -1.77 118.68 123.02 3n4f s LEU 229 Ca 0.52 1.78 -0.23 0.00 -1.03 0.00 0.00 54.13 55.17 3n4f s LEU 229 Cb 0.14 -3.54 -0.22 0.00 0.03 0.00 0.00 46.19 42.60 3n4f s LEU 229 CO -0.01 -0.90 0.39 0.22 0.23 0.00 0.00 176.35 176.27 3n4f h TYR 230 N 9.01 0.04 -3.72 0.29 3.20 -0.05 -3.42 116.97 122.33 3n4f h TYR 230 Ca -0.31 -0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.45 3n4f h TYR 230 Cb 1.13 -0.00 -0.14 0.00 1.54 0.00 0.00 36.73 39.25 3n4f h TYR 230 CO 0.85 1.37 -0.34 1.67 -1.64 0.00 0.00 178.16 180.07 3n4f s TRP 231 N -2.34 0.09 -0.21 -3.82 -2.14 -1.25 -1.83 118.94 107.45 3n4f s TRP 231 Ca -0.25 -0.48 -0.02 0.00 2.66 0.00 0.00 56.10 58.00 3n4f s TRP 231 Cb 0.03 -0.02 -0.00 0.00 -3.10 0.00 0.00 33.47 30.39 3n4f s TRP 231 CO 0.63 -0.55 -0.09 -1.17 -2.66 0.00 0.00 176.95 173.12 3n4f s LEU 232 N -2.74 2.68 -0.17 -4.66 2.96 0.21 -2.30 118.68 114.66 3n4f s LEU 232 Ca 0.03 -0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 53.45 3n4f s LEU 232 Cb 0.04 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 45.04 3n4f s LEU 232 CO -0.10 -0.01 -0.06 -0.70 -1.32 0.00 0.00 176.35 174.15 3n4f s GLU 233 N 1.42 3.51 -1.32 1.98 2.12 -0.21 -0.88 118.70 125.32 3n4f s GLU 233 Ca 0.05 -0.59 -0.11 0.00 0.36 0.00 0.00 54.97 54.68 3n4f s GLU 233 Cb -0.14 -2.87 0.00 0.00 0.26 0.00 0.00 34.13 31.38 3n4f s GLU 233 CO -0.06 0.10 0.52 0.39 -0.54 0.00 0.00 175.26 175.67 3n4f n GLU 234 N 3.91 -2.03 -0.28 4.30 1.02 -0.92 -1.73 120.64 124.92 3n4f n GLU 234 Ca -0.18 0.34 -0.01 0.00 -0.02 0.00 0.00 57.16 57.29 3n4f n GLU 234 Cb 0.52 -4.03 0.11 0.00 -0.02 0.00 0.00 31.44 28.02 3n4f n GLU 234 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3n4f h ALA 235 N 0.94 1.05 -2.86 0.62 0.00 -1.87 0.12 119.26 117.27 3n4f h ALA 235 Ca -0.66 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.21 3n4f h ALA 235 Cb 1.38 -0.22 -0.11 0.00 0.00 0.00 0.00 17.79 18.84 3n4f h ALA 235 CO 0.58 0.23 0.03 -0.59 0.00 0.00 0.00 179.25 179.49 3n4f s PHE 236 N -6.09 -0.20 0.26 0.00 -0.71 -1.26 -1.58 117.98 108.41 3n4f s PHE 236 Ca -0.13 -0.12 -0.31 0.00 -1.04 0.00 0.00 56.93 55.33 3n4f s PHE 236 Cb 0.17 0.38 -0.12 0.00 -1.21 0.00 0.00 43.02 42.23 3n4f s PHE 236 CO 0.78 -0.85 1.56 1.58 -1.34 0.00 0.00 175.22 176.95 3n4f n HIS 237 N -0.31 2.63 -1.61 3.49 -0.00 -1.26 -4.80 115.22 113.36 3n4f n HIS 237 Ca -0.13 0.28 -0.47 0.00 -0.00 0.00 0.00 57.72 57.40 3n4f n HIS 237 Cb 0.63 -2.57 -0.03 0.00 -0.00 0.00 0.00 29.99 28.02 3n4f n HIS 237 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49 3n4f n GLU 238 N 2.38 1.45 -3.67 1.57 0.00 -1.26 -4.98 120.64 116.13 3n4f n GLU 238 Ca 0.11 0.52 -0.09 0.00 0.00 0.00 0.00 57.16 57.70 3n4f n GLU 238 Cb 0.35 -2.05 -0.09 0.00 0.00 0.00 0.00 31.44 29.64 3n4f n GLU 238 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 3n4f s ASP 239 N 0.03 -0.46 0.17 -1.84 -1.08 -1.26 -4.93 116.67 107.30 3n4f s ASP 239 Ca 0.70 1.03 -0.14 0.00 -0.52 0.00 0.00 52.55 53.62 3n4f s ASP 239 Cb -0.77 1.19 0.10 0.00 -1.46 0.00 0.00 42.92 41.97 3n4f s ASP 239 CO 0.52 -0.22 1.79 -0.08 0.52 0.00 0.00 175.17 177.71 3n4f h GLU 240 N 7.67 0.50 -0.51 4.34 4.81 -1.99 -1.93 114.58 127.47 3n4f h GLU 240 Ca -0.25 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.92 3n4f h GLU 240 Cb 1.15 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.39 3n4f h GLU 240 CO 0.19 0.33 0.20 0.00 -0.73 0.00 0.00 179.01 179.00 3n4f h ALA 241 N 1.23 0.66 -0.22 2.92 0.00 -1.99 -0.53 119.26 121.33 3n4f h ALA 241 Ca 0.20 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 3n4f h ALA 241 Cb 0.07 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3n4f h ALA 241 CO -0.12 0.27 -0.55 -0.07 0.00 0.00 0.00 179.25 178.78 3n4f h LEU 242 N 0.68 0.74 -0.86 0.00 3.38 -1.96 -2.53 115.31 114.76 3n4f h LEU 242 Ca 0.17 -0.40 -0.12 0.00 0.09 0.00 0.00 57.88 57.63 3n4f h LEU 242 Cb 0.20 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 3n4f h LEU 242 CO -0.01 1.14 -0.56 1.88 0.09 0.00 0.00 178.44 180.98 3n4f h TYR 243 N 0.51 0.00 -0.08 1.13 0.05 -1.20 -0.58 116.97 116.80 3n4f h TYR 243 Ca 0.01 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 3n4f h TYR 243 Cb 1.12 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.86 3n4f h TYR 243 CO 0.05 0.56 0.03 1.49 -1.05 0.00 0.00 178.16 179.24 3n4f h GLU 244 N 0.00 0.13 0.03 4.88 4.81 -0.99 -1.05 114.58 122.38 3n4f h GLU 244 Ca -0.01 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.21 3n4f h GLU 244 Cb 1.01 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 3n4f h GLU 244 CO 0.07 0.29 -0.11 0.22 -0.73 0.00 0.00 179.01 178.75 3n4f h ASP 245 N -0.06 -0.32 -0.69 1.04 1.82 -1.30 -1.59 116.42 115.32 3n4f h ASP 245 Ca 0.03 0.04 0.03 0.00 -0.39 0.00 0.00 57.03 56.74 3n4f h ASP 245 Cb 0.22 0.13 -0.04 0.00 0.68 0.00 0.00 39.33 40.31 3n4f h ASP 245 CO -0.00 -0.16 0.43 0.25 -1.61 0.00 0.00 179.24 178.15 3n4f h LEU 246 N -0.20 0.71 -0.55 2.28 5.85 -1.07 0.20 115.31 122.52 3n4f h LEU 246 Ca 0.03 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 3n4f h LEU 246 Cb 0.24 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 3n4f h LEU 246 CO -0.09 0.49 0.34 0.11 -0.34 0.00 0.00 178.44 178.94 3n4f h LYS 247 N 0.84 0.74 -0.27 1.25 1.79 -1.05 -0.59 116.57 119.28 3n4f h LYS 247 Ca 0.28 -0.06 0.01 0.00 -2.18 0.00 0.00 60.65 58.70 3n4f h LYS 247 Cb 0.03 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 3n4f h LYS 247 CO -0.11 0.53 0.15 1.49 -1.08 0.00 0.00 179.45 180.43 3n4f h GLU 248 N 0.74 0.30 0.05 3.15 4.81 -0.81 0.29 114.58 123.11 3n4f h GLU 248 Ca 0.20 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.41 3n4f h GLU 248 Cb -0.03 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.29 3n4f h GLU 248 CO -0.04 0.20 -0.02 2.35 -0.73 0.00 0.00 179.01 180.77 3n4f h TRP 249 N 0.31 -0.06 -0.61 0.92 7.01 -0.80 -1.72 115.95 121.00 3n4f h TRP 249 Ca 0.11 -0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.19 3n4f h TRP 249 Cb 0.00 0.02 -0.07 0.00 -2.10 0.00 0.00 29.16 27.02 3n4f h TRP 249 CO -0.08 0.07 0.25 -0.07 -2.79 0.00 0.00 178.44 175.82 3n4f h LEU 250 N -0.18 0.28 -0.82 0.65 3.38 -1.06 -2.76 115.31 114.80 3n4f h LEU 250 Ca -0.01 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3n4f h LEU 250 Cb 0.16 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 3n4f h LEU 250 CO 0.01 0.17 0.48 1.23 0.09 0.00 0.00 178.44 180.42 3n4f h GLY 251 N 0.45 1.19 2.00 0.83 0.00 -0.69 -1.54 103.07 105.32 3n4f h GLY 251 Ca 0.30 -0.51 -0.06 0.00 0.00 0.00 0.00 47.33 47.06 3n4f h GLY 251 CO -0.28 0.49 -0.30 1.46 0.00 0.00 0.00 176.54 177.91 3n4f h GLN 252 N 1.12 0.00 0.00 4.80 4.20 -1.17 -2.72 115.11 121.35 3n4f h GLN 252 Ca 0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.00 3n4f h GLN 252 Cb -0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 3n4f h GLN 252 CO -0.05 0.30 -0.50 0.54 -0.67 0.00 0.00 178.83 178.44 3n4f n ARG 253 N -3.69 0.11 -1.42 1.46 1.74 -0.97 -4.94 116.66 108.96 3n4f n ARG 253 Ca -0.01 0.03 -0.13 0.00 -0.77 0.00 0.00 57.85 56.97 3n4f n ARG 253 Cb 0.41 -1.57 -0.05 0.00 -1.02 0.00 0.00 32.46 30.22 3n4f n ARG 253 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3n4f n GLY 254 N 1.44 1.33 3.57 -0.13 0.00 -0.66 -4.97 105.19 105.77 3n4f n GLY 254 Ca 0.05 -0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.23 3n4f n GLY 254 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3n4f s GLN 255 N -3.17 3.59 -0.89 1.61 0.74 -0.75 -4.99 119.66 115.80 3n4f s GLN 255 Ca 0.00 0.21 -0.18 0.00 0.05 0.00 0.00 55.36 55.44 3n4f s GLN 255 Cb 0.00 -3.89 0.15 0.00 1.10 0.00 0.00 33.01 30.36 3n4f s GLN 255 CO 0.00 -1.12 1.02 -0.80 -0.55 0.00 0.00 175.29 173.84 3n4f s ASN 256 N 2.14 6.63 -0.08 6.67 0.02 -1.26 -4.56 114.94 124.49 3n4f s ASN 256 Ca 0.36 -2.14 0.01 0.00 -1.02 0.00 0.00 52.86 50.07 3n4f s ASN 256 Cb -0.11 -2.35 0.02 0.00 0.02 0.00 0.00 41.25 38.83 3n4f s ASN 256 CO 0.24 -0.96 -0.10 -0.69 0.02 0.00 0.00 177.10 175.60 3n4f s VAL 257 N 2.15 1.07 0.50 1.60 1.01 -1.26 -4.78 120.40 120.69 3n4f s VAL 257 Ca 0.28 -0.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.67 3n4f s VAL 257 Cb -0.07 -1.02 -0.08 0.00 0.00 0.00 0.00 36.38 35.21 3n4f s VAL 257 CO -0.08 0.35 1.02 -0.76 0.00 0.00 0.00 175.10 175.63 3n4f s LEU 258 N 1.03 3.76 -0.24 3.92 1.43 -0.76 -4.87 118.68 122.95 3n4f s LEU 258 Ca -0.08 1.83 -0.11 0.00 -1.03 0.00 0.00 54.13 54.75 3n4f s LEU 258 Cb -0.15 -4.55 -0.05 0.00 0.03 0.00 0.00 46.19 41.48 3n4f s LEU 258 CO -0.01 -0.78 0.16 -0.63 0.23 0.00 0.00 176.35 175.33 3n4f s ILE 259 N -2.18 5.35 -0.06 -0.59 -1.09 -1.26 -0.62 121.20 120.75 3n4f s ILE 259 Ca 0.65 0.18 0.06 0.00 -2.23 0.00 0.00 60.65 59.30 3n4f s ILE 259 Cb -0.14 -3.50 -0.01 0.00 -1.58 0.00 0.00 42.46 37.23 3n4f s ILE 259 CO 0.24 0.34 -0.25 0.00 -1.23 0.00 0.00 174.94 174.04 3n4f s ALA 260 N 1.13 2.13 0.29 9.38 0.00 -0.06 -0.72 121.76 133.91 3n4f s ALA 260 Ca 0.07 -1.03 -0.18 0.00 0.00 0.00 0.00 51.96 50.83 3n4f s ALA 260 Cb -0.14 -0.67 0.02 0.00 0.00 0.00 0.00 23.12 22.34 3n4f s ALA 260 CO 0.05 0.41 0.67 0.34 0.00 0.00 0.00 175.76 177.22 3n4f s ASP 261 N -0.14 -0.14 0.00 0.00 -1.08 -0.72 -2.16 116.67 112.43 3n4f s ASP 261 Ca -0.04 -0.79 0.00 0.00 -0.52 0.00 0.00 52.55 51.20 3n4f s ASP 261 Cb -0.14 0.71 0.00 0.00 -1.46 0.00 0.00 42.92 42.04 3n4f s ASP 261 CO 0.04 -1.35 0.00 0.61 0.52 0.00 0.00 175.17 174.99 3n4f n GLY 262 N -0.46 1.18 3.77 2.66 0.00 -1.26 -0.93 105.19 110.14 3n4f n GLY 262 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 3n4f n GLY 262 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3n4f s GLU 263 N 0.00 1.77 4.75 1.61 -1.05 -1.23 -4.06 118.70 120.49 3n4f s GLU 263 Ca 0.00 0.75 0.00 0.00 -0.15 0.00 0.00 54.97 55.57 3n4f s GLU 263 Cb 0.00 -1.87 0.00 0.00 -0.44 0.00 0.00 34.13 31.82 3n4f s GLU 263 CO 0.00 -1.87 0.00 0.41 0.95 0.00 0.00 175.26 174.75 3n4f n GLY 264 N -1.64 1.56 3.23 -3.83 0.00 -1.26 -3.96 105.19 99.29 3n4f n GLY 264 Ca 0.07 -0.64 -0.43 0.00 0.00 0.00 0.00 46.02 45.02 3n4f n GLY 264 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3n4f n LEU 265 N 0.00 5.77 -4.76 0.99 4.32 -1.26 -4.99 117.00 117.07 3n4f n LEU 265 Ca 0.00 -4.33 -0.34 0.00 -0.02 0.00 0.00 56.01 51.32 3n4f n LEU 265 Cb 0.00 -1.62 0.05 0.00 -1.62 0.00 0.00 43.42 40.23 3n4f n LEU 265 CO 0.00 0.82 0.76 0.00 -1.22 0.00 0.00 177.39 177.74 3n4f s ALA 266 N 2.15 2.45 0.29 -1.18 0.00 -1.25 -4.98 121.76 119.22 3n4f s ALA 266 Ca 0.45 0.64 -0.30 0.00 0.00 0.00 0.00 51.96 52.75 3n4f s ALA 266 Cb 0.05 -3.35 -0.12 0.00 0.00 0.00 0.00 23.12 19.70 3n4f s ALA 266 CO 0.01 -1.30 1.53 0.45 0.00 0.00 0.00 175.76 176.45 3n4f n SER 267 N -2.30 3.53 0.33 0.00 2.88 -1.26 -4.89 113.62 111.91 3n4f n SER 267 Ca 0.11 1.15 0.22 0.00 -1.33 0.00 0.00 58.87 59.02 3n4f n SER 267 Cb 0.52 -1.55 1.11 0.00 -0.75 0.00 0.00 64.21 63.54 3n4f n SER 267 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3n4f h PRO 268 N 4.47 0.00 -0.58 -1.46 0.11 -2.01 -2.38 132.00 130.15 3n4f h PRO 268 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3n4f h PRO 268 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3n4f h PRO 268 CO 0.77 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 179.28 3n4f n HIS 269 N -3.12 1.25 -0.24 0.65 8.25 -1.26 -4.68 115.22 116.07 3n4f n HIS 269 Ca -0.02 -0.62 -0.06 0.00 -0.26 0.00 0.00 57.72 56.76 3n4f n HIS 269 Cb 0.12 -0.20 0.05 0.00 1.12 0.00 0.00 29.99 31.07 3n4f n HIS 269 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3n4f h LEU 270 N 3.59 0.84 -0.28 2.41 5.85 -1.81 -1.38 115.31 124.54 3n4f h LEU 270 Ca 0.00 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.63 3n4f h LEU 270 Cb 1.32 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 3n4f h LEU 270 CO 0.18 0.68 0.17 0.40 -0.34 0.00 0.00 178.44 179.54 3n4f h ILE 271 N 0.93 1.09 -0.36 4.05 1.08 -1.84 -0.92 117.51 121.53 3n4f h ILE 271 Ca 0.24 -0.20 0.06 0.00 -0.39 0.00 0.00 64.86 64.57 3n4f h ILE 271 Cb 0.02 0.73 -0.05 0.00 -3.07 0.00 0.00 36.82 34.44 3n4f h ILE 271 CO -0.04 0.09 0.03 -0.08 -0.69 0.00 0.00 178.15 177.46 3n4f h GLU 272 N 0.36 0.14 -0.67 2.37 4.81 -1.82 -0.03 114.58 119.73 3n4f h GLU 272 Ca 0.10 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.33 3n4f h GLU 272 Cb -0.01 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 3n4f h GLU 272 CO -0.02 0.09 0.44 -1.49 -0.73 0.00 0.00 179.01 177.30 3n4f h TRP 273 N 0.14 0.83 -0.90 0.92 6.55 -1.00 -2.35 115.95 120.14 3n4f h TRP 273 Ca 0.18 0.02 -0.02 0.00 0.95 0.00 0.00 58.89 60.02 3n4f h TRP 273 Cb 0.23 -0.28 -0.04 0.00 -0.86 0.00 0.00 29.16 28.20 3n4f h TRP 273 CO -0.22 0.52 0.49 0.00 -1.05 0.00 0.00 178.44 178.17 3n4f h ALA 274 N 1.25 1.16 0.00 1.49 0.00 -0.49 -2.20 119.26 120.47 3n4f h ALA 274 Ca 0.25 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3n4f h ALA 274 Cb -0.09 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.34 3n4f h ALA 274 CO -0.06 0.67 -0.07 1.79 0.00 0.00 0.00 179.25 181.58 3n4f h THR 275 N 1.26 0.32 -0.19 0.00 1.35 -0.52 -0.72 112.91 114.41 3n4f h THR 275 Ca 0.32 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 3n4f h THR 275 Cb 0.03 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 3n4f h THR 275 CO -0.05 0.07 0.00 0.54 -0.25 0.00 0.00 175.52 175.83 3n4f n ARG 276 N -3.39 1.81 -0.54 4.72 1.74 -0.88 -4.94 116.66 115.18 3n4f n ARG 276 Ca -0.01 -1.22 0.00 0.00 -0.77 0.00 0.00 57.85 55.85 3n4f n ARG 276 Cb 0.22 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 3n4f n ARG 276 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3n4f n GLY 277 N 1.17 0.71 0.09 -0.13 0.00 -0.28 -4.97 105.19 101.78 3n4f n GLY 277 Ca 0.16 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3n4f n GLY 277 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3n4f h ARG 278 N 1.48 0.00 -4.84 1.61 -0.00 -1.58 -3.47 114.38 107.58 3n4f h ARG 278 Ca 0.00 0.00 -0.40 0.00 -0.50 0.00 0.00 59.98 59.08 3n4f h ARG 278 Cb 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 29.97 29.69 3n4f h ARG 278 CO 0.00 0.29 -0.78 0.08 0.00 0.00 0.00 179.97 179.56 3n4f s VAL 279 N -2.93 0.78 -0.15 2.04 1.01 -1.26 -4.72 120.40 115.18 3n4f s VAL 279 Ca -0.03 -0.53 0.08 0.00 0.00 0.00 0.00 61.98 61.50 3n4f s VAL 279 Cb 0.09 -0.68 -0.14 0.00 0.00 0.00 0.00 36.38 35.65 3n4f s VAL 279 CO 0.81 0.14 -0.03 0.47 0.00 0.00 0.00 175.10 176.49 3n4f n ASP 280 N 2.63 2.08 -4.03 3.32 8.00 0.10 -4.49 116.55 124.16 3n4f n ASP 280 Ca -0.15 -0.04 -0.29 0.00 0.71 0.00 0.00 54.79 55.03 3n4f n ASP 280 Cb 0.56 0.41 -0.17 0.00 -0.02 0.00 0.00 41.12 41.90 3n4f n ASP 280 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3n4f s VAL 281 N -2.33 1.46 -0.13 2.53 1.01 -0.63 -1.65 120.40 120.66 3n4f s VAL 281 Ca -0.13 -0.60 -0.13 0.00 0.00 0.00 0.00 61.98 61.12 3n4f s VAL 281 Cb 0.05 -1.36 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 3n4f s VAL 281 CO 0.49 0.44 0.29 -0.76 0.00 0.00 0.00 175.10 175.55 3n4f s LEU 282 N 1.19 4.30 -0.22 3.92 2.01 -0.07 -1.76 118.68 128.06 3n4f s LEU 282 Ca -0.02 0.58 0.12 0.00 0.01 0.00 0.00 54.13 54.81 3n4f s LEU 282 Cb -0.14 -2.36 0.44 0.00 0.01 0.00 0.00 46.19 44.13 3n4f s LEU 282 CO -0.05 0.18 1.20 0.00 1.01 0.00 0.00 176.35 178.70 3n4f n GLN 283 N 3.04 2.05 -1.71 1.70 6.02 -0.11 -0.73 117.38 127.63 3n4f n GLN 283 Ca -0.13 -3.45 -0.39 0.00 -0.01 0.00 0.00 57.00 53.01 3n4f n GLN 283 Cb 0.52 -1.67 0.04 0.00 1.02 0.00 0.00 30.24 30.15 3n4f n GLN 283 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3n4f n TYR 284 N -0.84 1.99 -2.37 1.08 4.01 -1.26 -3.04 117.16 116.74 3n4f n TYR 284 Ca 0.25 0.44 -0.35 0.00 -0.16 0.00 0.00 57.90 58.07 3n4f n TYR 284 Cb 0.81 -2.32 -0.02 0.00 -0.31 0.00 0.00 39.34 37.51 3n4f n TYR 284 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3n4f s ASP 285 N -0.94 6.13 0.38 7.72 2.15 -1.23 -2.22 116.67 128.65 3n4f s ASP 285 Ca 0.71 2.13 0.27 0.00 0.43 0.00 0.00 52.55 56.09 3n4f s ASP 285 Cb -0.43 -2.58 0.84 0.00 -0.30 0.00 0.00 42.92 40.45 3n4f s ASP 285 CO 0.50 -0.94 1.77 -0.29 -0.17 0.00 0.00 175.17 176.04 3n4f h ILE 286 N 1.59 0.00 0.00 4.11 6.09 -1.56 -3.10 117.51 124.65 3n4f h ILE 286 Ca -0.49 -0.60 -0.40 0.00 -1.37 0.00 0.00 64.86 61.99 3n4f h ILE 286 Cb 1.24 1.55 -0.07 0.00 0.47 0.00 0.00 36.82 40.01 3n4f h ILE 286 CO 0.59 0.00 -2.48 -0.38 -3.07 0.00 0.00 178.15 172.81 3n4f n ILE 287 N -2.73 1.48 -3.77 2.19 2.08 -1.26 -3.20 119.36 114.15 3n4f n ILE 287 Ca 0.03 -0.52 -0.28 0.00 0.56 0.00 0.00 62.75 62.54 3n4f n ILE 287 Cb 0.39 -1.52 -0.16 0.00 -0.75 0.00 0.00 39.64 37.60 3n4f n ILE 287 CO 0.00 0.00 0.00 0.86 0.56 0.00 0.00 176.55 177.97 3n4f s TRP 288 N -2.51 1.21 -0.83 1.39 -0.00 -1.24 -3.02 118.94 113.95 3n4f s TRP 288 Ca -0.36 -0.93 0.26 0.00 -0.00 0.00 0.00 56.10 55.07 3n4f s TRP 288 Cb 0.10 -1.10 0.97 0.00 -0.00 0.00 0.00 33.47 33.44 3n4f s TRP 288 CO 0.57 -0.61 1.80 -0.35 -0.00 0.00 0.00 176.95 178.35 3n4f n PRO 289 N 5.00 0.13 0.00 5.86 -0.04 -1.21 -3.53 135.00 141.21 3n4f n PRO 289 Ca -0.09 0.16 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 3n4f n PRO 289 Cb 0.47 -1.67 0.00 0.00 -0.04 0.00 0.00 33.50 32.26 3n4f n PRO 289 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3n4f n GLY 290 N 1.11 -1.85 0.08 0.55 0.00 -1.17 -4.51 105.19 99.39 3n4f n GLY 290 Ca 0.06 -2.01 -0.13 0.00 0.00 0.00 0.00 46.02 43.93 3n4f n GLY 290 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3n4f h PHE 291 N 0.00 0.12 -0.24 1.61 3.57 -1.83 -1.41 116.94 118.76 3n4f h PHE 291 Ca 0.00 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.40 3n4f h PHE 291 Cb 0.00 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 3n4f h PHE 291 CO 0.00 0.51 -0.11 1.15 -2.23 0.00 0.00 178.31 177.63 3n4f h THR 292 N -0.31 1.30 -0.66 4.41 2.02 -1.93 -2.56 112.91 115.19 3n4f h THR 292 Ca 0.01 -1.19 0.11 0.00 0.77 0.00 0.00 66.41 66.11 3n4f h THR 292 Cb 0.48 1.57 -0.08 0.00 -1.74 0.00 0.00 68.15 68.38 3n4f h THR 292 CO 0.01 0.37 0.25 -0.74 0.37 0.00 0.00 175.52 175.78 3n4f h HIS 293 N 0.22 0.44 0.00 3.16 -0.00 -1.79 -2.84 115.15 114.34 3n4f h HIS 293 Ca 0.05 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.46 3n4f h HIS 293 Cb 0.61 -0.10 0.00 0.00 -0.00 0.00 0.00 27.41 27.93 3n4f h HIS 293 CO 0.06 0.10 0.00 0.91 -0.00 0.00 0.00 177.93 179.00 3n4f n TRP 294 N -4.99 0.00 0.00 5.26 7.02 -0.53 -0.90 117.44 123.30 3n4f n TRP 294 Ca 0.10 -0.10 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 3n4f n TRP 294 Cb 0.31 -0.16 0.00 0.00 -2.42 0.00 0.00 31.31 29.04 3n4f n TRP 294 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 3n4f n GLU 296 N 1.11 0.00 -0.13 -0.99 1.02 -1.07 0.58 120.64 121.16 3n4f n GLU 296 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 3n4f n GLU 296 Cb 0.08 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.49 3n4f n GLU 296 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3n4f h LEU 297 N 0.00 0.63 -1.03 -4.62 5.85 -1.31 -2.85 115.31 111.99 3n4f h LEU 297 Ca 0.00 -0.30 0.11 0.00 0.84 0.00 0.00 57.88 58.53 3n4f h LEU 297 Cb 0.00 -0.17 -0.08 0.00 0.37 0.00 0.00 40.66 40.78 3n4f h LEU 297 CO 0.00 0.77 0.63 1.23 -0.34 0.00 0.00 178.44 180.73 3n4f h GLY 298 N 0.46 1.60 0.96 3.75 0.00 -0.10 0.10 103.07 109.85 3n4f h GLY 298 Ca 0.11 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 47.01 3n4f h GLY 298 CO 0.02 0.19 0.04 0.83 0.00 0.00 0.00 176.54 177.62 3n4f h GLU 299 N 1.02 0.10 -0.33 4.80 5.08 -1.76 0.61 114.58 124.09 3n4f h GLU 299 Ca 0.48 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.83 3n4f h GLU 299 Cb 0.44 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 3n4f h GLU 299 CO -0.24 0.11 0.20 -0.22 -1.00 0.00 0.00 179.01 177.86 3n4f h LYS 300 N 0.06 0.45 -0.42 2.33 3.64 -1.13 -2.27 116.57 119.23 3n4f h LYS 300 Ca 0.03 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.31 3n4f h LYS 300 Cb 0.04 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 3n4f h LYS 300 CO -0.00 0.35 0.04 -0.07 -2.27 0.00 0.00 179.45 177.49 3n4f h LEU 301 N 0.43 0.70 -0.83 5.20 3.38 -0.75 -2.73 115.31 120.71 3n4f h LEU 301 Ca 0.12 -0.28 0.16 0.00 0.09 0.00 0.00 57.88 57.97 3n4f h LEU 301 Cb 0.01 -0.19 -0.10 0.00 0.09 0.00 0.00 40.66 40.48 3n4f h LEU 301 CO -0.02 0.81 0.38 0.44 0.09 0.00 0.00 178.44 180.14 3n4f h ASP 302 N 0.57 0.41 0.20 -0.43 3.32 -0.81 0.37 116.42 120.05 3n4f h ASP 302 Ca 0.13 0.11 -0.04 0.00 0.02 0.00 0.00 57.03 57.25 3n4f h ASP 302 Cb 0.42 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 3n4f h ASP 302 CO 0.01 0.14 -0.17 0.00 -1.72 0.00 0.00 179.24 177.50 3n4f h ALA 303 N 1.58 1.64 -0.31 3.45 0.00 -1.11 -2.68 119.26 121.83 3n4f h ALA 303 Ca 0.46 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3n4f h ALA 303 Cb 0.72 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3n4f h ALA 303 CO -0.40 0.22 0.00 0.72 0.00 0.00 0.00 179.25 179.78 3n4f n HIS 304 N -4.23 0.41 -1.48 0.00 8.25 -0.54 -4.94 115.22 112.69 3n4f n HIS 304 Ca -0.02 -0.20 -0.09 0.00 -0.26 0.00 0.00 57.72 57.14 3n4f n HIS 304 Cb 0.24 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.32 3n4f n HIS 304 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n4f n GLY 305 N 1.33 0.82 3.94 -1.41 0.00 -0.91 -5.02 105.19 103.94 3n4f n GLY 305 Ca 0.18 -0.60 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 3n4f n GLY 305 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3n4f s LEU 306 N -2.18 4.14 0.07 0.99 1.43 0.01 -5.00 118.68 118.13 3n4f s LEU 306 Ca 0.00 0.38 0.03 0.00 -1.03 0.00 0.00 54.13 53.51 3n4f s LEU 306 Cb 0.00 -3.19 -0.04 0.00 0.03 0.00 0.00 46.19 42.99 3n4f s LEU 306 CO 0.00 -0.17 0.06 -0.13 0.23 0.00 0.00 176.35 176.34 3n4f s ARG 307 N -3.89 2.83 -0.17 1.70 0.52 -0.66 -4.15 118.95 115.14 3n4f s ARG 307 Ca 0.39 -0.69 -0.00 0.00 -0.52 0.00 0.00 55.73 54.91 3n4f s ARG 307 Cb -0.10 -2.70 0.00 0.00 0.52 0.00 0.00 34.95 32.67 3n4f s ARG 307 CO 0.32 0.57 -0.15 -1.12 0.02 0.00 0.00 175.30 174.95 3n4f s SER 308 N -2.25 3.63 -0.36 0.23 0.01 0.39 -0.89 113.70 114.45 3n4f s SER 308 Ca 0.27 -0.50 0.00 0.00 1.31 0.00 0.00 55.95 57.03 3n4f s SER 308 Cb -0.12 -1.57 0.13 0.00 0.21 0.00 0.00 66.02 64.68 3n4f s SER 308 CO 0.20 0.05 0.20 0.00 0.41 0.00 0.00 173.24 174.10 3n4f s ALA 309 N 1.00 1.19 0.19 1.44 0.00 0.09 -0.25 121.76 125.41 3n4f s ALA 309 Ca -0.02 -1.93 -0.31 0.00 0.00 0.00 0.00 51.96 49.70 3n4f s ALA 309 Cb -0.15 -1.64 -0.10 0.00 0.00 0.00 0.00 23.12 21.23 3n4f s ALA 309 CO -0.03 -2.03 1.57 -2.14 0.00 0.00 0.00 175.76 173.12 3n4f s PRO 310 N 1.05 4.21 0.33 0.00 0.02 -1.26 -3.94 135.00 135.41 3n4f s PRO 310 Ca 0.17 2.39 -0.29 0.00 0.02 0.00 0.00 61.00 63.29 3n4f s PRO 310 Cb -0.22 -3.13 -0.10 0.00 0.02 0.00 0.00 34.50 31.06 3n4f s PRO 310 CO -0.04 -0.60 1.36 -1.58 -0.33 0.00 0.00 177.00 175.81 3n4f s HIS 311 N 0.91 2.96 -0.26 6.54 2.46 -0.94 -4.59 115.29 122.36 3n4f s HIS 311 Ca 0.68 1.32 -0.01 0.00 0.47 0.00 0.00 55.06 57.53 3n4f s HIS 311 Cb -0.44 -3.76 0.14 0.00 -0.13 0.00 0.00 32.58 28.38 3n4f s HIS 311 CO 0.34 -2.17 0.36 0.00 -2.47 0.00 0.00 174.74 170.80 3n4f s TYR 313 N 2.50 -0.64 0.00 0.00 5.04 -1.26 -4.81 117.35 118.17 3n4f s TYR 313 Ca 0.11 1.50 0.00 0.00 -2.44 0.00 0.00 57.07 56.24 3n4f s TYR 313 Cb -0.14 0.25 0.00 0.00 0.35 0.00 0.00 41.96 42.41 3n4f s TYR 313 CO -0.23 -0.36 0.00 0.41 -1.34 0.00 0.00 175.55 174.03 3n4f n GLY 314 N 2.43 1.16 2.71 8.97 0.00 -1.26 -5.00 105.19 114.20 3n4f n GLY 314 Ca -0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.67 3n4f n GLY 314 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3n4f s ASN 315 N -2.97 2.06 0.43 1.61 3.84 -1.26 -4.72 114.94 113.93 3n4f s ASN 315 Ca 0.00 -0.82 0.16 0.00 0.21 0.00 0.00 52.86 52.40 3n4f s ASN 315 Cb 0.00 0.31 1.06 0.00 -0.55 0.00 0.00 41.25 42.07 3n4f s ASN 315 CO 0.00 -0.39 1.94 0.00 -2.79 0.00 0.00 177.10 175.86 3n4f h ALA 316 N 8.30 2.11 -0.83 1.71 0.00 -1.95 -2.07 119.26 126.52 3n4f h ALA 316 Ca -0.15 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3n4f h ALA 316 Cb 1.07 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 3n4f h ALA 316 CO 0.35 -0.29 0.48 -0.92 0.00 0.00 0.00 179.25 178.88 3n4f h TYR 317 N 0.39 1.11 0.00 0.00 5.03 -1.95 -2.92 116.97 118.63 3n4f h TYR 317 Ca 0.34 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.63 3n4f h TYR 317 Cb 0.77 -0.36 -0.00 0.00 1.55 0.00 0.00 36.73 38.69 3n4f h TYR 317 CO -0.00 0.75 -0.04 0.78 -1.32 0.00 0.00 178.16 178.33 3n4f h GLY 318 N 1.17 0.00 0.09 1.82 0.00 -1.78 -2.44 103.07 101.94 3n4f h GLY 318 Ca 0.30 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.69 3n4f h GLY 318 CO -0.05 0.00 -0.29 -2.22 0.00 0.00 0.00 176.54 173.97 3n4f h ILE 319 N 0.00 0.31 0.01 2.60 1.08 -1.63 0.42 117.51 120.31 3n4f h ILE 319 Ca -0.00 0.00 -0.20 0.00 -0.39 0.00 0.00 64.86 64.27 3n4f h ILE 319 Cb 0.08 0.31 -0.02 0.00 -3.07 0.00 0.00 36.82 34.12 3n4f h ILE 319 CO 0.01 0.00 -0.96 1.88 -0.69 0.00 0.00 178.15 178.38 3n4f h TYR 320 N -0.32 0.06 -0.61 1.37 0.05 -1.62 -2.85 116.97 113.05 3n4f h TYR 320 Ca 0.13 -0.04 0.02 0.00 0.05 0.00 0.00 58.73 58.88 3n4f h TYR 320 Cb 0.51 -0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.22 3n4f h TYR 320 CO -0.43 0.97 0.39 0.00 -1.05 0.00 0.00 178.16 178.05 3n4f h ALA 321 N 1.01 0.78 -0.80 3.88 0.00 -1.30 -3.03 119.26 119.81 3n4f h ALA 321 Ca -0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3n4f h ALA 321 Cb 1.68 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 19.22 3n4f h ALA 321 CO 0.13 0.16 0.39 0.77 0.00 0.00 0.00 179.25 180.71 3n4f h SER 322 N 0.79 1.03 -0.61 0.00 0.02 -0.69 -2.56 113.55 111.54 3n4f h SER 322 Ca 0.23 -0.11 0.06 0.00 -0.84 0.00 0.00 61.79 61.13 3n4f h SER 322 Cb -0.04 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 62.18 3n4f h SER 322 CO -0.07 0.86 0.31 1.23 -1.14 0.00 0.00 176.83 178.02 3n4f h GLY 323 N 1.16 0.87 1.32 -3.77 0.00 -1.40 -2.55 103.07 98.70 3n4f h GLY 323 Ca 0.28 -0.20 -0.07 0.00 0.00 0.00 0.00 47.33 47.33 3n4f h GLY 323 CO -0.04 0.10 0.04 0.45 0.00 0.00 0.00 176.54 177.09 3n4f h HIS 324 N 0.57 0.89 -0.21 5.60 3.86 -1.43 -2.95 115.15 121.47 3n4f h HIS 324 Ca 0.28 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.38 3n4f h HIS 324 Cb 0.22 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 3n4f h HIS 324 CO -0.10 0.79 0.14 1.25 0.86 0.00 0.00 177.93 180.87 3n4f h LEU 325 N 0.79 0.23 -1.55 2.43 5.85 -1.07 -2.78 115.31 119.21 3n4f h LEU 325 Ca 0.16 -0.01 0.20 0.00 0.84 0.00 0.00 57.88 59.07 3n4f h LEU 325 Cb 0.42 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 3n4f h LEU 325 CO 0.01 0.17 0.58 0.77 -0.34 0.00 0.00 178.44 179.64 3n4f h SER 326 N 0.28 0.38 0.30 1.25 4.64 -1.43 0.85 113.55 119.81 3n4f h SER 326 Ca 0.08 0.04 -0.05 0.00 -0.47 0.00 0.00 61.79 61.39 3n4f h SER 326 Cb -0.02 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 3n4f h SER 326 CO -0.02 0.16 -0.22 0.00 -0.87 0.00 0.00 176.83 175.88 3n4f h ALA 327 N 1.61 1.49 0.00 5.18 0.00 -1.68 -2.92 119.26 122.95 3n4f h ALA 327 Ca 0.45 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3n4f h ALA 327 Cb 1.15 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3n4f h ALA 327 CO -0.16 0.28 -0.83 0.00 0.00 0.00 0.00 179.25 178.53 3n4f n ALA 328 N -2.43 3.91 -3.98 0.00 0.00 0.24 -0.78 120.51 117.46 3n4f n ALA 328 Ca -0.02 -0.45 -0.30 0.00 0.00 0.00 0.00 53.44 52.67 3n4f n ALA 328 Cb 0.29 -0.96 -0.16 0.00 0.00 0.00 0.00 19.45 18.62 3n4f n ALA 328 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3n4f s VAL 329 N -3.06 1.46 0.11 0.00 1.01 -0.86 -4.69 120.40 114.36 3n4f s VAL 329 Ca 0.08 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.20 3n4f s VAL 329 Cb 0.16 -1.45 -0.06 0.00 0.00 0.00 0.00 36.38 35.03 3n4f s VAL 329 CO 0.79 0.35 1.66 -0.09 0.00 0.00 0.00 175.10 177.81 3n4f h ARG 330 N 8.06 0.37 -1.68 2.72 2.43 -1.86 -3.12 114.38 121.30 3n4f h ARG 330 Ca -0.33 -0.06 -0.58 0.00 -0.81 0.00 0.00 59.98 58.19 3n4f h ARG 330 Cb 1.12 -0.06 -0.22 0.00 -0.42 0.00 0.00 29.97 30.39 3n4f h ARG 330 CO 0.49 0.39 0.70 0.09 -1.51 0.00 0.00 179.97 180.13 3n4f n ASN 331 N -4.80 7.07 -4.74 -3.80 3.02 -1.26 -4.96 115.26 105.78 3n4f n ASN 331 Ca -0.03 -3.49 -0.41 0.00 -0.03 0.00 0.00 54.58 50.62 3n4f n ASN 331 Cb 0.11 -1.09 -0.04 0.00 -0.61 0.00 0.00 39.78 38.15 3n4f n ASN 331 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3n4f s PHE 332 N -2.90 3.63 0.00 3.10 2.19 -1.18 -0.47 117.98 122.36 3n4f s PHE 332 Ca 0.53 1.65 0.00 0.00 0.33 0.00 0.00 56.93 59.44 3n4f s PHE 332 Cb 0.40 -3.25 0.00 0.00 -1.31 0.00 0.00 43.02 38.87 3n4f s PHE 332 CO -0.19 -0.48 0.00 0.39 1.83 0.00 0.00 175.22 176.77 3n4f n GLU 333 N 2.15 0.00 -3.84 10.12 -0.58 0.65 -4.89 120.64 124.26 3n4f n GLU 333 Ca 0.02 0.05 -0.12 0.00 -0.42 0.00 0.00 57.16 56.69 3n4f n GLU 333 Cb 0.46 -0.42 -0.10 0.00 -0.57 0.00 0.00 31.44 30.81 3n4f n GLU 333 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 3n4f s PHE 334 N -0.71 -0.07 -0.01 -0.32 0.08 -1.26 -4.56 117.98 111.13 3n4f s PHE 334 Ca 0.00 0.12 -0.30 0.00 0.12 0.00 0.00 56.93 56.87 3n4f s PHE 334 Cb 0.00 0.01 -0.04 0.00 -0.57 0.00 0.00 43.02 42.42 3n4f s PHE 334 CO 0.00 -0.25 1.13 0.08 -0.10 0.00 0.00 175.22 176.08 3n4f s VAL 335 N -0.94 4.38 -0.47 -0.44 1.01 0.02 -4.50 120.40 119.46 3n4f s VAL 335 Ca -0.10 1.70 -0.25 0.00 0.00 0.00 0.00 61.98 63.33 3n4f s VAL 335 Cb -0.05 -4.09 0.03 0.00 0.00 0.00 0.00 36.38 32.26 3n4f s VAL 335 CO 0.02 0.07 0.89 -0.70 0.00 0.00 0.00 175.10 175.37 3n4f s GLU 336 N 1.57 3.47 -0.21 2.72 2.12 -1.26 -1.81 118.70 125.30 3n4f s GLU 336 Ca 0.55 0.03 -0.06 0.00 0.36 0.00 0.00 54.97 55.84 3n4f s GLU 336 Cb -0.25 -3.95 -0.03 0.00 0.26 0.00 0.00 34.13 30.17 3n4f s GLU 336 CO 0.25 -1.23 0.04 -0.47 -0.54 0.00 0.00 175.26 173.31 3n4f s TYR 337 N 3.64 3.09 -0.07 5.30 6.14 -0.15 -4.78 117.35 130.52 3n4f s TYR 337 Ca 0.34 -0.34 0.04 0.00 0.64 0.00 0.00 57.07 57.75 3n4f s TYR 337 Cb -0.11 -2.13 -0.01 0.00 0.42 0.00 0.00 41.96 40.12 3n4f s TYR 337 CO 0.24 -0.20 -0.21 0.34 0.64 0.00 0.00 175.55 176.36 3n4f s ASP 338 N 1.09 3.44 -0.67 4.32 2.15 -1.26 -1.95 116.67 123.79 3n4f s ASP 338 Ca 0.03 -0.42 -0.25 0.00 0.43 0.00 0.00 52.55 52.34 3n4f s ASP 338 Cb -0.14 -1.01 0.05 0.00 -0.30 0.00 0.00 42.92 41.52 3n4f s ASP 338 CO 0.02 0.25 1.11 -0.62 -0.17 0.00 0.00 175.17 175.76 3n4f s ASP 339 N -0.16 6.22 -0.03 -0.34 2.15 -1.26 -4.99 116.67 118.25 3n4f s ASP 339 Ca -0.03 -0.56 0.04 0.00 0.43 0.00 0.00 52.55 52.43 3n4f s ASP 339 Cb -0.14 -2.49 -0.00 0.00 -0.30 0.00 0.00 42.92 39.99 3n4f s ASP 339 CO 0.04 -1.57 -0.15 -0.63 -0.17 0.00 0.00 175.17 172.68 3n4f s ILE 340 N 4.80 1.27 -0.27 4.11 1.01 -1.26 -0.65 121.20 130.22 3n4f s ILE 340 Ca 0.31 -0.64 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 3n4f s ILE 340 Cb -0.12 -1.09 0.01 0.00 0.01 0.00 0.00 42.46 41.27 3n4f s ILE 340 CO 0.15 0.37 0.02 -0.89 0.00 0.00 0.00 174.94 174.59 3n4f s THR 341 N -0.01 3.53 -0.22 2.92 2.01 0.26 -4.99 115.64 119.15 3n4f s THR 341 Ca -0.02 -0.76 -0.06 0.00 0.31 0.00 0.00 61.69 61.16 3n4f s THR 341 Cb -0.10 -2.78 -0.03 0.00 0.01 0.00 0.00 72.50 69.61 3n4f s THR 341 CO 0.01 0.18 0.03 -0.63 -0.69 0.00 0.00 174.62 173.52 3n4f s ILE 342 N 1.44 4.14 0.07 1.82 -1.09 -1.26 -1.30 121.20 125.02 3n4f s ILE 342 Ca 0.02 -0.24 -0.30 0.00 -2.23 0.00 0.00 60.65 57.90 3n4f s ILE 342 Cb -0.17 -2.90 -0.09 0.00 -1.58 0.00 0.00 42.46 37.72 3n4f s ILE 342 CO -0.01 0.39 1.85 -1.61 -1.23 0.00 0.00 174.94 174.34 3n4f s GLU 343 N 1.23 4.15 0.00 2.79 0.41 -0.53 -4.67 118.70 122.08 3n4f s GLU 343 Ca 0.04 2.55 0.00 0.00 -0.41 0.00 0.00 54.97 57.14 3n4f s GLU 343 Cb -0.15 -3.85 0.00 0.00 -1.78 0.00 0.00 34.13 28.35 3n4f s GLU 343 CO 0.02 -0.88 0.00 0.41 -0.49 0.00 0.00 175.26 174.32 3n4f n GLY 344 N 4.33 0.85 3.15 -1.39 0.00 -1.26 -4.57 105.19 106.30 3n4f n GLY 344 Ca 0.18 -0.63 0.05 0.00 0.00 0.00 0.00 46.02 45.63 3n4f n GLY 344 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3n4f s ASP 346 N -2.30 -0.48 -0.33 1.61 2.15 -0.40 -1.18 116.67 115.73 3n4f s ASP 346 Ca 0.00 0.25 0.09 0.00 0.43 0.00 0.00 52.55 53.32 3n4f s ASP 346 Cb 0.00 1.39 0.62 0.00 -0.30 0.00 0.00 42.92 44.63 3n4f s ASP 346 CO 0.00 -0.09 1.68 1.33 -0.17 0.00 0.00 175.17 177.92 3n4f n VAL 347 N 5.42 2.82 -0.32 1.11 0.24 -1.26 -1.90 118.33 124.43 3n4f n VAL 347 Ca -0.04 -2.12 0.20 0.00 -2.04 0.00 0.00 64.34 60.34 3n4f n VAL 347 Cb 0.54 -0.37 0.47 0.00 -1.47 0.00 0.00 33.84 33.01 3n4f n VAL 347 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3n4f h SER 348 N 1.51 0.52 -0.85 -1.34 0.02 -1.97 -2.35 113.55 109.10 3n4f h SER 348 Ca 0.33 0.09 0.04 0.00 -0.84 0.00 0.00 61.79 61.41 3n4f h SER 348 Cb 2.17 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 64.66 3n4f h SER 348 CO 0.67 0.12 0.56 1.23 -1.14 0.00 0.00 176.83 178.27 3n4f h GLY 349 N 0.47 1.20 -4.02 -3.77 0.00 -1.84 -3.41 103.07 91.70 3n4f h GLY 349 Ca 0.58 -0.41 -0.51 0.00 0.00 0.00 0.00 47.33 46.99 3n4f h GLY 349 CO -0.32 0.35 0.40 -0.19 0.00 0.00 0.00 176.54 176.78 3n4f s TYR 350 N -5.89 3.76 0.02 5.60 1.51 -0.88 -4.30 117.35 117.17 3n4f s TYR 350 Ca -0.11 1.75 0.05 0.00 -1.01 0.00 0.00 57.07 57.74 3n4f s TYR 350 Cb 0.19 -3.13 -0.02 0.00 -0.11 0.00 0.00 41.96 38.90 3n4f s TYR 350 CO 0.79 -0.05 -0.14 1.03 -1.11 0.00 0.00 175.55 176.07 3n4f s ARG 351 N -0.39 0.95 -0.25 -0.62 0.52 -1.13 -4.97 118.95 113.06 3n4f s ARG 351 Ca 0.47 -0.67 -0.09 0.00 -0.52 0.00 0.00 55.73 54.92 3n4f s ARG 351 Cb -0.26 -0.94 -0.04 0.00 0.52 0.00 0.00 34.95 34.23 3n4f s ARG 351 CO 0.32 0.24 0.12 0.42 0.02 0.00 0.00 175.30 176.42 3n4f s ILE 352 N -0.70 4.83 -0.12 1.52 -1.09 -1.26 -0.53 121.20 123.85 3n4f s ILE 352 Ca 0.02 0.00 -0.06 0.00 -2.23 0.00 0.00 60.65 58.39 3n4f s ILE 352 Cb -0.07 -3.26 0.05 0.00 -1.58 0.00 0.00 42.46 37.60 3n4f s ILE 352 CO 0.01 0.32 0.27 -0.70 -1.23 0.00 0.00 174.94 173.61 3n4f s GLU 353 N 1.44 0.22 -1.53 2.79 2.12 -0.50 -4.53 118.70 118.71 3n4f s GLU 353 Ca 0.06 0.59 -0.12 0.00 0.36 0.00 0.00 54.97 55.86 3n4f s GLU 353 Cb -0.15 -0.10 0.08 0.00 0.26 0.00 0.00 34.13 34.23 3n4f s GLU 353 CO 0.06 -0.18 0.88 0.09 -0.54 0.00 0.00 175.26 175.58 3n4f n ASN 354 N 4.38 -3.86 -0.51 -1.70 3.02 -1.14 -1.74 115.26 113.72 3n4f n ASN 354 Ca -0.23 -0.84 -0.05 0.00 -0.03 0.00 0.00 54.58 53.43 3n4f n ASN 354 Cb 0.53 -3.66 -0.01 0.00 -0.61 0.00 0.00 39.78 36.03 3n4f n ASN 354 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3n4f n GLY 355 N -1.65 0.47 2.94 7.41 0.00 0.74 -4.83 105.19 110.27 3n4f n GLY 355 Ca -0.01 -0.74 -0.11 0.00 0.00 0.00 0.00 46.02 45.15 3n4f n GLY 355 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3n4f s GLU 356 N -3.35 0.19 -0.20 1.61 2.02 -0.71 -1.97 118.70 116.30 3n4f s GLU 356 Ca 0.00 -0.33 -0.13 0.00 0.02 0.00 0.00 54.97 54.54 3n4f s GLU 356 Cb 0.00 0.01 -0.05 0.00 0.10 0.00 0.00 34.13 34.19 3n4f s GLU 356 CO 0.00 -0.01 0.24 -1.50 0.02 0.00 0.00 175.26 174.01 3n4f s ILE 357 N -0.73 5.32 -0.42 -1.63 2.07 0.23 -1.41 121.20 124.64 3n4f s ILE 357 Ca -0.08 0.41 -0.20 0.00 -1.41 0.00 0.00 60.65 59.37 3n4f s ILE 357 Cb -0.05 -3.58 0.02 0.00 0.13 0.00 0.00 42.46 38.98 3n4f s ILE 357 CO -0.00 0.36 0.60 -1.00 -1.91 0.00 0.00 174.94 172.99 3n4f s HIS 358 N 0.74 3.10 -0.17 3.50 3.76 0.31 -0.51 115.29 126.01 3n4f s HIS 358 Ca 0.13 -0.03 -0.22 0.00 -0.15 0.00 0.00 55.06 54.78 3n4f s HIS 358 Cb -0.13 -3.21 -0.02 0.00 1.11 0.00 0.00 32.58 30.33 3n4f s HIS 358 CO 0.03 -0.78 0.69 0.08 -0.85 0.00 0.00 174.74 173.91 3n4f s VAL 359 N 2.66 4.99 0.56 -0.90 1.01 0.21 -2.86 120.40 126.07 3n4f s VAL 359 Ca 0.21 1.33 -0.19 0.00 0.00 0.00 0.00 61.98 63.33 3n4f s VAL 359 Cb -0.15 -4.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 3n4f s VAL 359 CO 0.17 0.11 1.14 -2.16 0.00 0.00 0.00 175.10 174.35 3n4f s PRO 360 N 1.84 3.28 -0.02 2.72 0.04 -1.26 -4.22 135.00 137.37 3n4f s PRO 360 Ca 0.32 1.62 0.05 0.00 0.04 0.00 0.00 61.00 63.02 3n4f s PRO 360 Cb -0.16 -1.99 0.17 0.00 0.04 0.00 0.00 34.50 32.55 3n4f s PRO 360 CO 0.12 -0.91 0.99 0.00 0.04 0.00 0.00 177.00 177.24 3n4f n ALA 361 N -1.41 2.62 -1.70 8.56 0.00 -1.26 -4.88 120.51 122.44 3n4f n ALA 361 Ca 0.12 -0.37 -0.32 0.00 0.00 0.00 0.00 53.44 52.87 3n4f n ALA 361 Cb 0.51 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.96 3n4f n ALA 361 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3n4f s THR 362 N -1.62 3.99 0.47 0.00 -4.23 -1.26 -4.18 115.64 108.81 3n4f s THR 362 Ca 0.12 0.92 -0.22 0.00 -1.18 0.00 0.00 61.69 61.34 3n4f s THR 362 Cb 0.08 -3.46 -0.10 0.00 1.34 0.00 0.00 72.50 70.35 3n4f s THR 362 CO 0.06 -0.58 0.77 -2.65 -0.54 0.00 0.00 174.62 171.69 3n4f n PRO 363 N -2.01 0.90 0.00 3.99 -0.02 -1.26 -3.59 135.00 133.01 3n4f n PRO 363 Ca 0.08 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 3n4f n PRO 363 Cb 0.53 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 3n4f n PRO 363 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3n4f n GLY 364 N 1.49 2.72 0.51 -1.23 0.00 -0.59 -2.21 105.19 105.88 3n4f n GLY 364 Ca 0.11 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 45.96 3n4f n GLY 364 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3n4f n PHE 365 N 13.51 0.09 -0.92 1.61 3.72 -1.26 0.16 117.46 134.38 3n4f n PHE 365 Ca 0.00 -0.05 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 3n4f n PHE 365 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 3n4f n PHE 365 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3n4f n GLY 366 N 1.15 0.66 3.68 1.37 0.00 -0.94 -4.96 105.19 106.15 3n4f n GLY 366 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3n4f n GLY 366 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n4f s ILE 367 N -2.87 5.17 -0.38 -0.61 1.01 -1.26 -4.62 121.20 117.64 3n4f s ILE 367 Ca 0.00 0.84 -0.14 0.00 0.00 0.00 0.00 60.65 61.36 3n4f s ILE 367 Cb 0.00 -3.78 0.01 0.00 0.01 0.00 0.00 42.46 38.69 3n4f s ILE 367 CO 0.00 0.25 0.27 -0.69 0.00 0.00 0.00 174.94 174.76 3n4f s VAL 368 N 1.24 5.18 0.10 2.92 1.01 -0.80 -4.96 120.40 125.09 3n4f s VAL 368 Ca 0.22 -0.54 -0.21 0.00 0.00 0.00 0.00 61.98 61.46 3n4f s VAL 368 Cb -0.15 -3.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.35 3n4f s VAL 368 CO 0.09 -0.20 0.63 -0.36 0.00 0.00 0.00 175.10 175.26 3n4f s PHE 369 N 1.68 3.83 -0.76 5.22 0.08 -1.26 -1.27 117.98 125.50 3n4f s PHE 369 Ca 0.05 1.38 -0.26 0.00 0.12 0.00 0.00 56.93 58.22 3n4f s PHE 369 Cb -0.18 -2.58 0.00 0.00 -0.57 0.00 0.00 43.02 39.68 3n4f s PHE 369 CO 0.10 0.56 1.64 0.34 -0.10 0.00 0.00 175.22 177.75 3n4f s ASP 370 N -1.08 5.70 0.22 1.36 -1.08 -0.33 -4.88 116.67 116.59 3n4f s ASP 370 Ca 0.31 -0.34 -0.07 0.00 -0.52 0.00 0.00 52.55 51.93 3n4f s ASP 370 Cb -0.21 -2.55 0.34 0.00 -1.46 0.00 0.00 42.92 39.05 3n4f s ASP 370 CO 0.21 -2.15 1.75 0.44 0.52 0.00 0.00 175.17 175.94 3n4f h ASP 371 N 12.06 0.28 0.14 -0.34 3.32 -1.95 -0.68 116.42 129.25 3n4f h ASP 371 Ca -0.14 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 3n4f h ASP 371 Cb 1.08 0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.68 3n4f h ASP 371 CO 1.27 0.15 -0.07 -0.33 -1.72 0.00 0.00 179.24 178.54 3n4f h GLU 372 N 0.46 -0.18 -0.66 3.56 3.07 -1.99 -0.38 114.58 118.46 3n4f h GLU 372 Ca 0.35 0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 59.18 3n4f h GLU 372 Cb 0.45 0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.37 3n4f h GLU 372 CO -0.33 -0.10 0.26 1.25 -1.40 0.00 0.00 179.01 178.68 3n4f h LEU 373 N -0.20 0.90 -0.35 1.33 5.85 -1.84 -1.31 115.31 119.69 3n4f h LEU 373 Ca -0.02 -0.13 -0.16 0.00 0.84 0.00 0.00 57.88 58.41 3n4f h LEU 373 Cb 0.15 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 3n4f h LEU 373 CO 0.03 0.81 -0.39 0.58 -0.34 0.00 0.00 178.44 179.13 3n4f h VAL 374 N 0.96 1.28 -0.64 1.05 2.07 -0.98 -1.66 116.25 118.33 3n4f h VAL 374 Ca 0.22 -1.57 0.04 0.00 0.82 0.00 0.00 66.70 66.21 3n4f h VAL 374 Cb 0.20 1.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.39 3n4f h VAL 374 CO -0.02 0.52 0.38 0.74 0.02 0.00 0.00 177.57 179.21 3n4f h THR 375 N 0.69 1.04 -0.12 2.57 2.02 -0.82 0.11 112.91 118.39 3n4f h THR 375 Ca 0.05 -0.25 0.04 0.00 0.77 0.00 0.00 66.41 67.02 3n4f h THR 375 Cb 0.99 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.61 3n4f h THR 375 CO 0.10 0.13 -0.10 1.88 0.37 0.00 0.00 175.52 177.89 3n4f h TYR 376 N 0.73 -0.26 -0.34 3.16 0.05 -0.99 -1.28 116.97 118.04 3n4f h TYR 376 Ca 0.27 0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.99 3n4f h TYR 376 Cb 0.08 0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.93 3n4f h TYR 376 CO -0.06 -0.16 -0.09 -0.07 -1.05 0.00 0.00 178.16 176.73 3n4f h LEU 377 N -0.12 0.56 0.10 3.88 3.38 -0.86 0.26 115.31 122.51 3n4f h LEU 377 Ca 0.08 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3n4f h LEU 377 Cb 0.24 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3n4f h LEU 377 CO -0.20 0.69 -0.05 0.40 0.09 0.00 0.00 178.44 179.38 3n4f h ILE 378 N 0.54 0.95 -0.29 1.22 2.04 -0.59 0.23 117.51 121.61 3n4f h ILE 378 Ca 0.10 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 3n4f h ILE 378 Cb 0.48 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3n4f h ILE 378 CO 0.03 0.05 0.16 0.78 0.00 0.00 0.00 178.15 179.16 3n4f h ASN 379 N -0.22 0.35 0.14 1.72 2.35 -1.01 -2.28 115.58 116.63 3n4f h ASN 379 Ca -0.01 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 3n4f h ASN 379 Cb 0.18 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.46 3n4f h ASN 379 CO 0.02 0.32 -0.07 -0.09 -1.65 0.00 0.00 177.43 175.97 3n4f h ARG 380 N 0.35 -0.18 0.00 0.81 2.43 -0.45 -3.42 114.38 113.92 3n4f h ARG 380 Ca 0.10 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 3n4f h ARG 380 Cb 0.04 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 3n4f h ARG 380 CO -0.02 0.19 -0.22 0.43 -1.51 0.00 0.00 179.97 178.84 3n4f n SER 381 N -4.99 1.08 0.00 -3.80 7.64 0.69 -5.07 113.62 109.16 3n4f n SER 381 Ca -0.09 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.68 3n4f n SER 381 Cb 0.24 0.44 0.00 0.00 -1.01 0.00 0.00 64.21 63.88 3n4f n SER 381 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3n4f n GLY 382 N 0.77 2.63 3.64 0.23 0.00 -0.54 -4.91 105.19 107.01 3n4f n GLY 382 Ca 0.00 -1.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.11 3n4f n GLY 382 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3n4f s TRP 383 N 3.43 -0.03 -0.09 1.61 1.48 -0.87 -4.80 118.94 119.68 3n4f s TRP 383 Ca 0.00 -0.35 -0.04 0.00 -1.06 0.00 0.00 56.10 54.65 3n4f s TRP 383 Cb 0.00 0.44 0.04 0.00 -1.16 0.00 0.00 33.47 32.80 3n4f s TRP 383 CO 0.00 -1.03 0.19 0.45 -4.06 0.00 0.00 176.95 172.49 3n4f s SER 384 N -2.92 0.01 -0.13 -2.66 0.15 -1.26 -0.80 113.70 106.10 3n4f s SER 384 Ca 0.13 0.40 0.02 0.00 0.70 0.00 0.00 55.95 57.19 3n4f s SER 384 Cb -0.02 0.31 -0.00 0.00 -1.71 0.00 0.00 66.02 64.59 3n4f s SER 384 CO 0.03 -0.18 -0.18 -1.61 1.20 0.00 0.00 173.24 172.50 3n4f s GLU 385 N 1.48 3.17 0.00 5.44 0.41 0.01 -5.01 118.70 124.20 3n4f s GLU 385 Ca -0.06 -0.79 0.00 0.00 -0.41 0.00 0.00 54.97 53.70 3n4f s GLU 385 Cb -0.11 -2.50 0.00 0.00 -1.78 0.00 0.00 34.13 29.74 3n4f s GLU 385 CO -0.07 0.10 0.00 0.41 -0.49 0.00 0.00 175.26 175.21