#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n4f n ILE 5 N 0.00 0.43 0.29 -1.44 -5.35 -1.26 -4.46 119.36 107.57 3n4f n ILE 5 Ca 0.00 -0.71 0.17 0.00 -0.27 0.00 0.00 62.75 61.94 3n4f n ILE 5 Cb 0.00 1.03 0.72 0.00 -1.74 0.00 0.00 39.64 39.65 3n4f n ILE 5 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 3n4f h THR 6 N 3.91 0.00 -0.12 7.28 1.35 -2.04 -2.29 112.91 121.01 3n4f h THR 6 Ca 0.00 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 3n4f h THR 6 Cb 0.89 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 3n4f h THR 6 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3n4f n GLY 7 N -0.06 0.62 3.62 5.82 0.00 -1.26 -4.82 105.19 109.11 3n4f n GLY 7 Ca 0.00 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.04 3n4f n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n4f s ILE 8 N -1.87 4.27 0.44 -0.61 1.01 -0.86 -5.01 121.20 118.57 3n4f s ILE 8 Ca 0.34 1.40 -0.24 0.00 0.00 0.00 0.00 60.65 62.15 3n4f s ILE 8 Cb 0.20 -4.39 -0.08 0.00 0.01 0.00 0.00 42.46 38.21 3n4f s ILE 8 CO 0.31 -0.66 1.18 -1.10 0.00 0.00 0.00 174.94 174.67 3n4f s GLN 9 N 4.13 3.87 0.01 2.79 -1.52 -1.26 -4.93 119.66 122.75 3n4f s GLN 9 Ca 0.50 1.83 0.24 0.00 -1.95 0.00 0.00 55.36 55.98 3n4f s GLN 9 Cb -0.12 -2.52 1.02 0.00 -0.22 0.00 0.00 33.01 31.17 3n4f s GLN 9 CO 0.24 -0.47 1.77 -1.13 -0.25 0.00 0.00 175.29 175.44 3n4f n SER 10 N -0.25 0.03 -0.92 5.90 3.41 -1.26 -2.60 113.62 117.93 3n4f n SER 10 Ca 0.06 0.50 0.12 0.00 -0.26 0.00 0.00 58.87 59.29 3n4f n SER 10 Cb 0.47 -0.51 0.10 0.00 -0.26 0.00 0.00 64.21 64.01 3n4f n SER 10 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3n4f n ASP 11 N -1.53 2.90 -4.64 4.04 5.75 -1.26 -4.89 116.55 116.92 3n4f n ASP 11 Ca 0.06 -1.95 -0.43 0.00 -0.01 0.00 0.00 54.79 52.46 3n4f n ASP 11 Cb 0.28 0.04 -0.02 0.00 -1.03 0.00 0.00 41.12 40.39 3n4f n ASP 11 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3n4f s TRP 12 N -2.04 2.30 0.19 2.11 0.51 -1.07 -4.96 118.94 115.97 3n4f s TRP 12 Ca 0.27 0.59 0.11 0.00 -2.12 0.00 0.00 56.10 54.95 3n4f s TRP 12 Cb 0.20 -3.85 -0.04 0.00 -0.81 0.00 0.00 33.47 28.97 3n4f s TRP 12 CO 0.32 -2.78 -0.24 0.15 -0.51 0.00 0.00 176.95 173.90 3n4f s LYS 13 N 4.19 1.49 -0.46 4.98 1.02 -1.26 -0.97 119.74 128.72 3n4f s LYS 13 Ca 0.67 -1.50 -0.28 0.00 0.02 0.00 0.00 55.97 54.87 3n4f s LYS 13 Cb -0.26 -1.80 0.01 0.00 -0.52 0.00 0.00 37.83 35.26 3n4f s LYS 13 CO 0.25 0.39 1.48 0.08 -0.92 0.00 0.00 175.35 176.63 3n4f s VAL 14 N -1.66 3.79 -0.07 3.17 1.01 -0.04 -2.64 120.40 123.97 3n4f s VAL 14 Ca 0.20 0.76 0.06 0.00 0.00 0.00 0.00 61.98 63.00 3n4f s VAL 14 Cb -0.08 -4.21 -0.24 0.00 0.00 0.00 0.00 36.38 31.85 3n4f s VAL 14 CO 0.09 -0.87 0.57 -0.62 0.00 0.00 0.00 175.10 174.28 3n4f n GLU 15 N 8.36 0.67 -3.67 2.72 1.02 0.73 -0.24 120.64 130.25 3n4f n GLU 15 Ca 0.16 0.29 -0.13 0.00 -0.02 0.00 0.00 57.16 57.46 3n4f n GLU 15 Cb 0.48 -1.77 -0.08 0.00 -0.02 0.00 0.00 31.44 30.05 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 -2.59 0.69 -0.08 3.49 2.20 -1.08 -2.30 119.74 120.08 3n4f s LYS 16 Ca -0.10 0.88 0.02 0.00 -0.36 0.00 0.00 55.97 56.41 3n4f s LYS 16 Cb 0.08 0.30 0.01 0.00 -1.51 0.00 0.00 37.83 36.71 3n4f s LYS 16 CO 0.81 -0.10 -0.13 0.42 -0.36 0.00 0.00 175.35 175.99 3n4f s ILE 17 N 0.52 1.22 0.03 5.43 1.01 -0.08 -0.44 121.20 128.91 3n4f s ILE 17 Ca -0.02 -0.51 0.05 0.00 0.00 0.00 0.00 60.65 60.17 3n4f s ILE 17 Cb -0.05 -1.12 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 3n4f s ILE 17 CO -0.02 0.38 -0.15 -1.61 0.00 0.00 0.00 174.94 173.54 3n4f s GLU 18 N 0.77 0.99 -0.02 2.79 2.02 0.05 -0.33 118.70 124.96 3n4f s GLU 18 Ca -0.12 -0.75 0.03 0.00 0.02 0.00 0.00 54.97 54.15 3n4f s GLU 18 Cb -0.16 -1.00 -0.00 0.00 0.10 0.00 0.00 34.13 33.07 3n4f s GLU 18 CO 0.02 0.25 -0.12 0.12 0.02 0.00 0.00 175.26 175.56 3n4f s PHE 19 N -0.80 1.15 0.04 1.61 2.19 -0.00 -0.27 117.98 121.91 3n4f s PHE 19 Ca 0.02 -0.26 -0.15 0.00 0.33 0.00 0.00 56.93 56.87 3n4f s PHE 19 Cb -0.08 -0.77 0.02 0.00 -1.31 0.00 0.00 43.02 40.88 3n4f s PHE 19 CO 0.01 -0.07 0.33 0.00 1.83 0.00 0.00 175.22 177.32 3n4f s ALA 20 N -0.07 -0.76 -0.25 11.12 0.00 -0.35 -2.18 121.76 129.27 3n4f s ALA 20 Ca 0.01 0.07 -0.08 0.00 0.00 0.00 0.00 51.96 51.96 3n4f s ALA 20 Cb -0.07 0.33 -0.03 0.00 0.00 0.00 0.00 23.12 23.35 3n4f s ALA 20 CO 0.00 -0.43 0.09 0.21 0.00 0.00 0.00 175.76 175.64 3n4f s LYS 21 N -2.55 3.72 0.19 0.00 2.20 -1.26 -0.93 119.74 121.11 3n4f s LYS 21 Ca -0.05 -0.44 0.00 0.00 -0.36 0.00 0.00 55.97 55.12 3n4f s LYS 21 Cb -0.01 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 3n4f s LYS 21 CO -0.03 -0.17 0.36 -0.51 -0.36 0.00 0.00 175.35 174.65 3n4f s LEU 22 N 1.58 4.25 0.08 5.43 1.43 -0.27 -4.95 118.68 126.23 3n4f s LEU 22 Ca 0.06 0.34 0.03 0.00 -1.03 0.00 0.00 54.13 53.52 3n4f s LEU 22 Cb -0.15 -3.10 -0.03 0.00 0.03 0.00 0.00 46.19 42.94 3n4f s LEU 22 CO 0.05 -0.02 -0.08 0.42 0.23 0.00 0.00 176.35 176.95 3n4f s THR 23 N -1.84 0.72 0.00 5.49 -4.23 -1.26 -1.21 115.64 113.30 3n4f s THR 23 Ca 0.37 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 3n4f s THR 23 Cb -0.11 -1.19 0.00 0.00 1.34 0.00 0.00 72.50 72.54 3n4f s THR 23 CO 0.29 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.39 3n4f n GLY 24 N 0.70 1.83 3.06 3.99 0.00 0.98 -1.59 105.19 114.16 3n4f n GLY 24 Ca -0.17 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.16 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 1.29 0.30 0.54 1.61 2.02 -0.52 -0.30 118.70 123.65 3n4f s GLU 25 Ca 0.00 -0.06 -0.20 0.00 0.02 0.00 0.00 54.97 54.73 3n4f s GLU 25 Cb 0.00 0.13 -0.06 0.00 0.10 0.00 0.00 34.13 34.30 3n4f s GLU 25 CO 0.00 -0.06 1.13 1.03 0.02 0.00 0.00 175.26 177.38 3n4f s ARG 26 N -0.56 3.37 0.42 1.61 0.52 0.12 -0.87 118.95 123.56 3n4f s ARG 26 Ca -0.06 1.62 0.09 0.00 -0.52 0.00 0.00 55.73 56.86 3n4f s ARG 26 Cb -0.04 -2.02 0.92 0.00 0.52 0.00 0.00 34.95 34.32 3n4f s ARG 26 CO 0.01 -0.84 2.05 0.00 0.02 0.00 0.00 175.30 176.54 3n4f h ALA 27 N 1.24 1.78 -3.51 2.13 0.00 -1.43 -3.42 119.26 116.05 3n4f h ALA 27 Ca -0.50 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.12 3n4f h ALA 27 Cb 1.26 -0.14 -0.32 0.00 0.00 0.00 0.00 17.79 18.59 3n4f h ALA 27 CO 0.57 0.18 -0.70 0.50 0.00 0.00 0.00 179.25 179.80 3n4f s ARG 28 N -5.45 0.00 0.20 0.00 3.52 -1.26 -5.13 118.95 110.83 3n4f s ARG 28 Ca -0.08 0.18 -0.33 0.00 -0.13 0.00 0.00 55.73 55.38 3n4f s ARG 28 Cb 0.18 -0.17 -0.14 0.00 -1.56 0.00 0.00 34.95 33.26 3n4f s ARG 28 CO 0.73 -0.13 1.51 0.45 -0.81 0.00 0.00 175.30 177.05 3n4f n SER 29 N 3.91 2.98 -4.65 -2.12 2.88 -1.26 -4.87 113.62 110.50 3n4f n SER 29 Ca -0.24 1.11 -0.38 0.00 -1.33 0.00 0.00 58.87 58.03 3n4f n SER 29 Cb 0.53 -1.43 -0.08 0.00 -0.75 0.00 0.00 64.21 62.47 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 0.49 3.57 1.00 -1.46 0.00 -0.09 -4.87 121.76 120.40 3n4f s ALA 30 Ca 0.74 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 52.04 3n4f s ALA 30 Cb -0.66 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 19.82 3n4f s ALA 30 CO 0.43 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 176.18 3n4f n GLY 31 N 4.22 -1.20 3.72 0.00 0.00 -1.26 -0.21 105.19 110.46 3n4f n GLY 31 Ca -0.09 -1.48 -0.29 0.00 0.00 0.00 0.00 46.02 44.17 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 -3.47 1.25 0.17 4.61 0.00 -1.25 -2.42 121.76 120.64 3n4f s ALA 32 Ca 0.00 -0.48 0.01 0.00 0.00 0.00 0.00 51.96 51.50 3n4f s ALA 32 Cb 0.00 -3.07 -0.00 0.00 0.00 0.00 0.00 23.12 20.05 3n4f s ALA 32 CO 0.00 -2.67 0.05 0.27 0.00 0.00 0.00 175.76 173.41 3n4f n ASN 33 N -4.05 1.34 -0.33 0.00 0.23 -0.74 -0.71 115.26 111.00 3n4f n ASN 33 Ca 0.06 -1.87 0.27 0.00 -0.53 0.00 0.00 54.58 52.51 3n4f n ASN 33 Cb 0.58 0.36 0.58 0.00 -2.08 0.00 0.00 39.78 39.23 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 0.62 0.90 0.00 4.83 0.00 -1.78 -3.25 103.07 104.39 3n4f h GLY 34 Ca -0.14 -0.14 -0.16 0.00 0.00 0.00 0.00 47.33 46.89 3n4f h GLY 34 CO 0.22 -0.12 -1.61 -0.96 0.00 0.00 0.00 176.54 174.06 3n4f n ARG 35 N -4.52 2.22 -4.42 4.80 1.85 -1.26 -4.13 116.66 111.20 3n4f n ARG 35 Ca 0.26 0.01 -0.21 0.00 -1.00 0.00 0.00 57.85 56.91 3n4f n ARG 35 Cb 1.01 -1.23 -0.09 0.00 -1.05 0.00 0.00 32.46 31.10 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 0.71 0.00 8.89 -4.36 -1.23 -5.05 121.20 117.94 3n4f s ILE 36 Ca -0.06 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.33 3n4f s ILE 36 Cb 0.03 -2.57 0.00 0.00 1.25 0.00 0.00 42.46 41.17 3n4f s ILE 36 CO 0.35 0.00 0.00 0.61 0.24 0.00 0.00 174.94 176.14 3n4f n GLY 37 N -0.69 -0.68 3.56 6.27 0.00 -1.26 -1.79 105.19 110.61 3n4f n GLY 37 Ca -0.02 -1.72 -0.53 0.00 0.00 0.00 0.00 46.02 43.75 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 -1.57 0.20 0.01 1.61 0.31 -1.26 -4.26 118.33 113.37 3n4f n VAL 38 Ca 0.00 -0.05 -0.13 0.00 -0.01 0.00 0.00 64.34 64.15 3n4f n VAL 38 Cb 0.00 -0.63 -0.14 0.00 -0.91 0.00 0.00 33.84 32.16 3n4f n VAL 38 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 3n4f h HIS 39 N 3.94 0.22 0.00 3.52 -0.00 -0.34 -3.46 115.15 119.03 3n4f h HIS 39 Ca -0.47 -0.16 0.00 0.00 -0.00 0.00 0.00 60.37 59.73 3n4f h HIS 39 Cb 1.36 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.76 3n4f h HIS 39 CO 0.58 1.28 0.00 0.41 -0.00 0.00 0.00 177.93 180.20 3n4f n GLY 40 N 1.67 -1.80 0.03 2.45 0.00 0.70 -4.77 105.19 103.48 3n4f n GLY 40 Ca -0.19 -1.83 -0.04 0.00 0.00 0.00 0.00 46.02 43.96 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 2.28 -2.08 1.61 4.81 -1.26 -0.91 118.16 122.62 3n4f n LYS 41 Ca 0.00 0.01 -0.41 0.00 -0.87 0.00 0.00 58.31 57.04 3n4f n LYS 41 Cb 0.00 -1.17 -0.02 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 -4.04 6.73 0.02 3.14 0.15 -1.26 -0.71 113.70 117.72 3n4f s SER 42 Ca -0.05 2.64 0.02 0.00 0.70 0.00 0.00 55.95 59.27 3n4f s SER 42 Cb 0.02 -2.63 -0.01 0.00 -1.71 0.00 0.00 66.02 61.69 3n4f s SER 42 CO 0.25 -0.62 -0.08 0.00 1.20 0.00 0.00 173.24 173.99 3n4f s THR 44 N -0.69 0.83 -0.04 0.00 -4.23 -1.26 -0.01 115.64 110.24 3n4f s THR 44 Ca -0.02 -1.66 -0.02 0.00 -1.18 0.00 0.00 61.69 58.81 3n4f s THR 44 Cb -0.06 -1.36 0.03 0.00 1.34 0.00 0.00 72.50 72.45 3n4f s THR 44 CO 0.00 -0.63 0.06 -0.69 -0.54 0.00 0.00 174.62 172.82 3n4f s VAL 45 N -2.65 -0.10 -0.21 2.29 1.01 -0.35 -4.63 120.40 115.75 3n4f s VAL 45 Ca 0.05 0.42 -0.29 0.00 0.00 0.00 0.00 61.98 62.16 3n4f s VAL 45 Cb -0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 36.38 36.21 3n4f s VAL 45 CO -0.01 0.18 1.19 -1.81 0.00 0.00 0.00 175.10 174.65 3n4f s ASP 46 N 2.14 6.95 0.02 3.32 1.01 -1.26 -1.11 116.67 127.74 3n4f s ASP 46 Ca 0.05 1.50 0.09 0.00 0.71 0.00 0.00 52.55 54.89 3n4f s ASP 46 Cb -0.12 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.25 3n4f s ASP 46 CO -0.03 -0.79 -0.25 0.27 0.21 0.00 0.00 175.17 174.58 3n4f s ILE 47 N 3.54 2.03 0.09 0.77 -4.36 -0.11 -2.10 121.20 121.06 3n4f s ILE 47 Ca 0.51 -1.25 0.05 0.00 -0.26 0.00 0.00 60.65 59.70 3n4f s ILE 47 Cb -0.18 -1.72 -0.04 0.00 1.25 0.00 0.00 42.46 41.77 3n4f s ILE 47 CO 0.13 0.42 -0.02 0.00 0.24 0.00 0.00 174.94 175.71 3n4f s ALA 48 N -0.72 3.23 -0.17 2.27 0.00 0.33 -1.21 121.76 125.48 3n4f s ALA 48 Ca 0.11 -1.13 0.01 0.00 0.00 0.00 0.00 51.96 50.94 3n4f s ALA 48 Cb -0.10 -1.14 0.01 0.00 0.00 0.00 0.00 23.12 21.89 3n4f s ALA 48 CO 0.01 0.69 -0.19 0.50 0.00 0.00 0.00 175.76 176.77 3n4f s ARG 49 N -2.25 3.04 -0.08 0.00 3.52 0.63 -1.58 118.95 122.23 3n4f s ARG 49 Ca 0.25 -0.82 -0.00 0.00 -0.13 0.00 0.00 55.73 55.03 3n4f s ARG 49 Cb -0.12 -2.57 -0.03 0.00 -1.56 0.00 0.00 34.95 30.67 3n4f s ARG 49 CO 0.17 -0.14 -0.04 -1.50 -0.81 0.00 0.00 175.30 172.98 3n4f s ILE 50 N 1.14 3.94 -0.21 4.11 2.07 0.38 -0.77 121.20 131.86 3n4f s ILE 50 Ca 0.01 -0.39 -0.02 0.00 -1.41 0.00 0.00 60.65 58.84 3n4f s ILE 50 Cb -0.14 -2.63 0.01 0.00 0.13 0.00 0.00 42.46 39.82 3n4f s ILE 50 CO -0.08 0.60 -0.09 -0.89 -1.91 0.00 0.00 174.94 172.56 3n4f s THR 51 N -0.78 2.89 -0.07 4.00 2.01 0.42 -0.65 115.64 123.47 3n4f s THR 51 Ca 0.12 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.43 3n4f s THR 51 Cb -0.11 -2.32 0.01 0.00 0.01 0.00 0.00 72.50 70.09 3n4f s THR 51 CO 0.02 0.42 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.59 3n4f s ILE 52 N 1.40 1.30 -1.55 1.82 1.01 -0.23 -0.19 121.20 124.76 3n4f s ILE 52 Ca 0.05 -0.58 -0.05 0.00 0.00 0.00 0.00 60.65 60.06 3n4f s ILE 52 Cb -0.14 -1.17 0.05 0.00 0.01 0.00 0.00 42.46 41.20 3n4f s ILE 52 CO -0.06 0.39 0.32 -0.67 0.00 0.00 0.00 174.94 174.91 3n4f n ASP 53 N 3.71 -0.35 -0.01 3.58 2.03 -1.08 -1.07 116.55 123.37 3n4f n ASP 53 Ca -0.22 -1.14 -0.00 0.00 0.52 0.00 0.00 54.79 53.95 3n4f n ASP 53 Cb 0.52 -2.28 -0.00 0.00 -0.72 0.00 0.00 41.12 38.64 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 -2.06 0.31 3.29 0.27 0.00 -1.26 -5.01 105.19 100.73 3n4f n GLY 54 Ca -0.22 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.84 1.30 0.03 1.61 0.74 -0.23 -4.99 119.66 117.28 3n4f s GLN 55 Ca 0.00 -1.11 0.01 0.00 0.05 0.00 0.00 55.36 54.31 3n4f s GLN 55 Cb 0.00 -1.54 -0.04 0.00 1.10 0.00 0.00 33.01 32.53 3n4f s GLN 55 CO 0.00 0.37 0.07 0.95 -0.55 0.00 0.00 175.29 176.13 3n4f s THR 56 N -1.00 4.57 0.03 -0.34 -4.23 -1.26 -1.06 115.64 112.35 3n4f s THR 56 Ca 0.08 -0.57 0.04 0.00 -1.18 0.00 0.00 61.69 60.06 3n4f s THR 56 Cb -0.10 -3.12 -0.02 0.00 1.34 0.00 0.00 72.50 70.60 3n4f s THR 56 CO 0.03 0.27 -0.13 -0.83 -0.54 0.00 0.00 174.62 173.43 3n4f s GLY 57 N -1.95 0.72 0.06 3.99 0.00 0.18 -4.71 107.32 105.61 3n4f s GLY 57 Ca 0.25 -0.76 0.09 0.00 0.00 0.00 0.00 44.72 44.30 3n4f s GLY 57 CO 0.16 -0.73 -0.25 -0.19 0.00 0.00 0.00 173.10 172.09 3n4f s TYR 58 N -0.79 2.22 -0.05 1.90 2.02 -1.26 -0.47 117.35 120.91 3n4f s TYR 58 Ca 0.01 -0.40 -0.31 0.00 -0.37 0.00 0.00 57.07 56.00 3n4f s TYR 58 Cb -0.07 -1.30 0.12 0.00 -0.40 0.00 0.00 41.96 40.30 3n4f s TYR 58 CO 0.01 0.16 1.23 0.20 -1.57 0.00 0.00 175.55 175.58 3n4f s GLY 59 N -1.39 -0.37 0.21 0.71 0.00 -0.62 -4.14 107.32 101.71 3n4f s GLY 59 Ca 0.11 0.90 -0.30 0.00 0.00 0.00 0.00 44.72 45.44 3n4f s GLY 59 CO 0.03 0.23 0.86 -1.26 0.00 0.00 0.00 173.10 172.95 3n4f n SER 60 N -0.38 0.22 -3.76 1.64 2.88 -1.26 -0.51 113.62 112.45 3n4f n SER 60 Ca -0.06 1.15 -0.14 0.00 -1.33 0.00 0.00 58.87 58.49 3n4f n SER 60 Cb 0.61 -1.11 -0.15 0.00 -0.75 0.00 0.00 64.21 62.81 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 -0.57 -0.01 0.13 -3.46 0.15 -0.89 -4.31 113.70 104.74 3n4f s SER 61 Ca 0.66 0.15 0.04 0.00 0.70 0.00 0.00 55.95 57.51 3n4f s SER 61 Cb -0.87 0.04 -0.04 0.00 -1.71 0.00 0.00 66.02 63.44 3n4f s SER 61 CO 0.57 -0.14 -0.11 0.27 1.20 0.00 0.00 173.24 175.03 3n4f s ILE 62 N 1.12 1.11 -0.29 6.45 -4.36 -0.81 -4.60 121.20 119.82 3n4f s ILE 62 Ca -0.09 -1.87 -0.08 0.00 -0.26 0.00 0.00 60.65 58.35 3n4f s ILE 62 Cb -0.12 -1.63 0.01 0.00 1.25 0.00 0.00 42.46 41.96 3n4f s ILE 62 CO -0.04 -0.63 0.31 1.41 0.24 0.00 0.00 174.94 176.23 3n4f n HIS 63 N 0.17 -2.70 -3.57 1.37 8.25 -1.26 -3.30 115.22 114.17 3n4f n HIS 63 Ca -0.13 1.12 -0.07 0.00 -0.26 0.00 0.00 57.72 58.39 3n4f n HIS 63 Cb 0.59 -3.41 -0.02 0.00 1.12 0.00 0.00 29.99 28.27 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 -1.90 0.00 0.28 1.59 -4.23 -1.26 -4.88 115.64 105.24 3n4f s THR 65 Ca 0.13 -0.18 0.01 0.00 -1.18 0.00 0.00 61.69 60.47 3n4f s THR 65 Cb -0.04 -1.28 0.28 0.00 1.34 0.00 0.00 72.50 72.80 3n4f s THR 65 CO 0.57 0.00 1.81 -0.65 -0.54 0.00 0.00 174.62 175.82 3n4f h PRO 66 N 2.00 0.87 -0.76 3.99 0.11 -1.98 -1.23 132.00 134.99 3n4f h PRO 66 Ca -0.23 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.77 3n4f h PRO 66 Cb 1.24 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 3n4f h PRO 66 CO 0.29 0.58 0.26 0.93 -0.21 0.00 0.00 178.00 179.86 3n4f h GLU 67 N 0.90 1.17 -0.19 1.05 3.07 -2.00 0.05 114.58 118.62 3n4f h GLU 67 Ca 0.50 -0.23 -0.01 0.00 -0.50 0.00 0.00 59.36 59.12 3n4f h GLU 67 Cb 0.57 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.30 3n4f h GLU 67 CO -0.30 0.97 0.08 2.35 -1.40 0.00 0.00 179.01 180.72 3n4f h TRP 68 N 1.13 0.28 -0.33 4.33 7.01 -1.85 -3.24 115.95 123.28 3n4f h TRP 68 Ca 0.25 -0.02 -0.11 0.00 2.11 0.00 0.00 58.89 61.12 3n4f h TRP 68 Cb 0.27 -0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 27.23 3n4f h TRP 68 CO 0.02 0.32 -0.26 0.00 -2.79 0.00 0.00 178.44 175.73 3n4f h ALA 69 N 0.94 0.93 -0.97 2.65 0.00 -0.82 -2.99 119.26 118.99 3n4f h ALA 69 Ca 0.06 -0.37 0.16 0.00 0.00 0.00 0.00 54.91 54.76 3n4f h ALA 69 Cb 0.15 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 17.72 3n4f h ALA 69 CO -0.01 0.61 0.61 1.49 0.00 0.00 0.00 179.25 181.96 3n4f h GLU 70 N 0.58 0.78 0.00 0.00 4.81 -1.02 0.58 114.58 120.30 3n4f h GLU 70 Ca 0.08 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3n4f h GLU 70 Cb 0.74 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.95 3n4f h GLU 70 CO 0.06 0.51 0.00 -0.44 -0.73 0.00 0.00 179.01 178.41 3n4f h ASP 71 N 0.80 0.00 0.42 1.04 5.19 -1.57 -3.15 116.42 119.15 3n4f h ASP 71 Ca 0.51 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.73 3n4f h ASP 71 Cb 0.74 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.21 3n4f h ASP 71 CO -0.28 0.00 -1.74 0.52 -3.12 0.00 0.00 179.24 174.62 3n4f n VAL 72 N -2.53 1.04 -1.69 -1.35 0.31 0.17 -4.85 118.33 109.43 3n4f n VAL 72 Ca 0.01 -0.70 -0.44 0.00 -0.01 0.00 0.00 64.34 63.20 3n4f n VAL 72 Cb 0.22 -0.56 -0.03 0.00 -0.91 0.00 0.00 33.84 32.56 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 -2.75 0.38 -0.05 2.52 2.08 -1.03 -1.69 119.36 118.82 3n4f n ILE 73 Ca -0.14 -0.09 0.00 0.00 0.56 0.00 0.00 62.75 63.07 3n4f n ILE 73 Cb 0.87 -1.68 0.00 0.00 -0.75 0.00 0.00 39.64 38.08 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 3.04 1.25 3.81 7.39 0.00 0.67 -5.01 105.19 116.34 3n4f n GLY 74 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 3n4f n GLY 74 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3n4f s ARG 75 N -0.56 3.85 0.27 1.61 0.52 -0.68 -4.76 118.95 119.19 3n4f s ARG 75 Ca 0.00 1.26 -0.23 0.00 -0.52 0.00 0.00 55.73 56.23 3n4f s ARG 75 Cb 0.00 -2.11 -0.09 0.00 0.52 0.00 0.00 34.95 33.27 3n4f s ARG 75 CO 0.00 -0.38 0.84 1.03 0.02 0.00 0.00 175.30 176.82 3n4f s ARG 76 N -3.39 4.45 0.27 3.54 0.52 -1.26 -0.86 118.95 122.21 3n4f s ARG 76 Ca 0.65 1.13 -0.01 0.00 -0.52 0.00 0.00 55.73 56.98 3n4f s ARG 76 Cb -0.14 -2.86 0.50 0.00 0.52 0.00 0.00 34.95 32.97 3n4f s ARG 76 CO 0.21 0.34 1.81 1.25 0.02 0.00 0.00 175.30 178.94 3n4f h LEU 77 N 3.34 0.78 -1.32 2.53 5.85 -1.38 -0.43 115.31 124.68 3n4f h LEU 77 Ca -0.47 0.05 0.19 0.00 0.84 0.00 0.00 57.88 58.49 3n4f h LEU 77 Cb 1.19 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 42.05 3n4f h LEU 77 CO 0.65 0.41 0.60 -0.07 -0.34 0.00 0.00 178.44 179.70 3n4f h LEU 78 N 0.87 0.56 -2.54 2.25 3.38 -1.86 -1.14 115.31 116.83 3n4f h LEU 78 Ca 0.46 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.50 3n4f h LEU 78 Cb 0.48 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 3n4f h LEU 78 CO -0.27 0.22 0.07 0.44 0.09 0.00 0.00 178.44 178.99 3n4f h ASP 79 N 0.56 0.00 0.94 -0.43 3.32 -1.45 -2.18 116.42 117.18 3n4f h ASP 79 Ca 0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.55 3n4f h ASP 79 Cb 1.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.58 3n4f h ASP 79 CO -0.24 0.00 -0.11 0.18 -1.72 0.00 0.00 179.24 177.34 3n4f n LEU 80 N -3.54 0.19 -4.62 1.55 4.77 -0.43 -4.84 117.00 110.08 3n4f n LEU 80 Ca -0.02 0.40 -0.33 0.00 -0.03 0.00 0.00 56.01 56.03 3n4f n LEU 80 Cb 0.15 -0.43 -0.10 0.00 -2.33 0.00 0.00 43.42 40.71 3n4f n LEU 80 CO 0.24 0.01 -0.36 -0.36 -1.33 0.00 0.00 177.39 175.59 3n4f s PHE 81 N -3.01 2.98 1.01 -1.77 0.08 -0.82 -0.21 117.98 116.23 3n4f s PHE 81 Ca 0.13 0.04 -0.16 0.00 0.12 0.00 0.00 56.93 57.06 3n4f s PHE 81 Cb 0.18 -1.69 0.21 0.00 -0.57 0.00 0.00 43.02 41.15 3n4f s PHE 81 CO 0.57 0.39 1.24 0.16 -0.10 0.00 0.00 175.22 177.48 3n4f s ASP 82 N -1.10 2.70 0.00 1.36 3.84 0.12 -4.87 116.67 118.72 3n4f s ASP 82 Ca 0.15 0.47 0.13 0.00 -0.00 0.00 0.00 52.55 53.30 3n4f s ASP 82 Cb -0.11 -0.65 0.74 0.00 -1.38 0.00 0.00 42.92 41.51 3n4f s ASP 82 CO 0.05 -3.01 1.28 -0.90 -0.00 0.00 0.00 175.17 172.59 3n4f n ASP 83 N -3.99 0.00 -0.79 2.11 5.68 -1.26 -1.56 116.55 116.74 3n4f n ASP 83 Ca 0.13 -0.18 0.10 0.00 -0.50 0.00 0.00 54.79 54.34 3n4f n ASP 83 Cb 0.60 -0.13 0.08 0.00 -1.14 0.00 0.00 41.12 40.53 3n4f n ASP 83 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3n4f n ARG 84 N -1.13 1.75 -1.14 0.11 1.74 -1.26 -4.97 116.66 111.76 3n4f n ARG 84 Ca 0.08 -1.68 -0.01 0.00 -0.77 0.00 0.00 57.85 55.47 3n4f n ARG 84 Cb 0.07 -1.38 -0.00 0.00 -1.02 0.00 0.00 32.46 30.13 3n4f n ARG 84 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3n4f n GLY 85 N 1.11 0.43 3.77 -0.13 0.00 -0.60 -5.05 105.19 104.73 3n4f n GLY 85 Ca 0.12 -1.04 -0.36 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.30 4.00 0.27 1.61 0.52 -1.26 -4.89 118.95 116.90 3n4f s ARG 86 Ca 0.00 -0.15 -0.30 0.00 -0.52 0.00 0.00 55.73 54.76 3n4f s ARG 86 Cb 0.00 -3.36 -0.11 0.00 0.52 0.00 0.00 34.95 32.00 3n4f s ARG 86 CO 0.00 0.42 1.62 -1.17 0.02 0.00 0.00 175.30 176.19 3n4f s LEU 87 N -0.01 4.35 0.53 2.53 2.96 -1.26 -0.70 118.68 127.07 3n4f s LEU 87 Ca 0.11 2.92 -0.22 0.00 -0.22 0.00 0.00 54.13 56.73 3n4f s LEU 87 Cb -0.12 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 42.89 3n4f s LEU 87 CO 0.01 -0.92 1.29 -0.13 -1.32 0.00 0.00 176.35 175.27 3n4f s ARG 88 N -0.09 3.29 0.28 1.98 0.52 0.70 -4.83 118.95 120.81 3n4f s ARG 88 Ca 0.66 2.06 -0.03 0.00 -0.52 0.00 0.00 55.73 57.89 3n4f s ARG 88 Cb -0.48 -2.26 0.59 0.00 0.52 0.00 0.00 34.95 33.32 3n4f s ARG 88 CO 0.44 -1.01 1.59 1.49 0.02 0.00 0.00 175.30 177.83 3n4f h GLU 89 N 1.56 0.04 0.00 3.54 4.81 -1.91 -2.11 114.58 120.51 3n4f h GLU 89 Ca -0.50 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3n4f h GLU 89 Cb 1.29 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.66 3n4f h GLU 89 CO 0.58 0.02 0.00 0.00 -0.73 0.00 0.00 179.01 178.88 3n4f h ALA 90 N 1.89 1.00 -0.01 2.92 0.00 -1.96 -2.83 119.26 120.27 3n4f h ALA 90 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.42 3n4f h ALA 90 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3n4f h ALA 90 CO -0.86 0.00 -0.24 0.66 0.00 0.00 0.00 179.25 178.81 3n4f n TYR 91 N -2.51 0.00 0.34 0.00 4.01 -0.80 -4.82 117.16 113.39 3n4f n TYR 91 Ca -0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.57 3n4f n TYR 91 Cb 0.13 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.08 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 0.85 -0.84 -0.38 -0.72 3.08 -1.49 -0.59 114.38 114.29 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 0.30 0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 3n4f h ARG 92 CO 0.00 -0.52 0.10 -0.07 -1.07 0.00 0.00 179.97 178.41 3n4f h LEU 93 N -1.04 0.50 0.15 3.04 3.38 -1.85 -1.83 115.31 117.66 3n4f h LEU 93 Ca -0.09 -0.07 -0.31 0.00 0.09 0.00 0.00 57.88 57.51 3n4f h LEU 93 Cb 0.71 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.33 3n4f h LEU 93 CO 0.15 0.50 -1.47 1.56 0.09 0.00 0.00 178.44 179.27 3n4f h GLN 94 N 0.54 0.32 0.00 1.13 7.50 -1.53 -2.16 115.11 120.91 3n4f h GLN 94 Ca 0.13 -0.55 0.00 0.00 0.50 0.00 0.00 58.65 58.73 3n4f h GLN 94 Cb 0.20 0.20 0.00 0.00 0.05 0.00 0.00 27.48 27.93 3n4f h GLN 94 CO -0.00 1.22 0.00 1.28 -1.50 0.00 0.00 178.83 179.83 3n4f n LEU 95 N -3.53 0.00 -0.23 1.46 4.77 -0.24 -4.53 117.00 114.70 3n4f n LEU 95 Ca -0.15 -0.09 0.04 0.00 -0.03 0.00 0.00 56.01 55.77 3n4f n LEU 95 Cb 1.05 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 42.30 3n4f n LEU 95 CO 0.53 0.00 0.93 1.05 -1.33 0.00 0.00 177.39 178.57 3n4f h GLU 96 N 0.00 0.26 -0.03 3.23 4.11 -1.30 0.12 114.58 120.97 3n4f h GLU 96 Ca 0.00 -0.02 -0.03 0.00 0.07 0.00 0.00 59.36 59.39 3n4f h GLU 96 Cb 0.00 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3n4f h GLU 96 CO 0.00 0.17 -0.08 1.88 0.07 0.00 0.00 179.01 181.05 3n4f h TYR 97 N 0.26 0.13 -0.37 2.06 0.05 -1.81 1.00 116.97 118.30 3n4f h TYR 97 Ca 0.38 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 59.10 3n4f h TYR 97 Cb 0.63 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.33 3n4f h TYR 97 CO -0.26 0.70 0.16 -1.35 -1.05 0.00 0.00 178.16 176.37 3n4f h PRO 98 N -0.48 0.51 -0.24 4.88 0.11 -1.69 0.28 132.00 135.38 3n4f h PRO 98 Ca -0.00 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.98 3n4f h PRO 98 Cb 0.71 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.71 3n4f h PRO 98 CO 0.02 0.41 -0.12 0.28 -0.21 0.00 0.00 178.00 178.38 3n4f h VAL 99 N 0.51 1.30 -0.53 3.15 2.07 -0.64 0.11 116.25 122.22 3n4f h VAL 99 Ca 0.13 -1.20 -0.04 0.00 0.82 0.00 0.00 66.70 66.40 3n4f h VAL 99 Cb 0.08 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 3n4f h VAL 99 CO -0.02 0.37 0.16 -0.07 0.02 0.00 0.00 177.57 178.04 3n4f h LEU 100 N 0.22 0.78 -0.58 2.57 3.38 -0.60 -0.39 115.31 120.69 3n4f h LEU 100 Ca 0.05 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.82 3n4f h LEU 100 Cb 0.63 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 3n4f h LEU 100 CO 0.04 0.78 0.38 -0.78 0.09 0.00 0.00 178.44 178.95 3n4f h ASP 101 N 0.73 0.68 -0.21 -0.43 3.58 -0.86 -1.94 116.42 117.97 3n4f h ASP 101 Ca 0.17 -0.03 0.05 0.00 0.42 0.00 0.00 57.03 57.64 3n4f h ASP 101 Cb 0.29 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.12 3n4f h ASP 101 CO -0.00 0.50 -0.08 -0.25 -2.88 0.00 0.00 179.24 176.52 3n4f h TRP 102 N 0.79 -0.18 -0.81 0.28 7.01 -0.31 -1.01 115.95 121.72 3n4f h TRP 102 Ca 0.21 0.02 0.05 0.00 2.11 0.00 0.00 58.89 61.28 3n4f h TRP 102 Cb -0.08 0.11 -0.05 0.00 -2.10 0.00 0.00 29.16 27.04 3n4f h TRP 102 CO -0.03 -0.13 0.50 -0.07 -2.79 0.00 0.00 178.44 175.92 3n4f h LEU 103 N -0.04 0.80 -0.49 0.65 3.38 -0.80 0.27 115.31 119.09 3n4f h LEU 103 Ca 0.11 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 3n4f h LEU 103 Cb 0.21 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3n4f h LEU 103 CO -0.24 0.53 0.30 1.23 0.09 0.00 0.00 178.44 180.35 3n4f h GLY 104 N 0.94 0.71 1.00 0.83 0.00 -1.01 0.90 103.07 106.44 3n4f h GLY 104 Ca 0.34 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 3n4f h GLY 104 CO -0.15 0.28 0.36 1.46 0.00 0.00 0.00 176.54 178.50 3n4f h GLN 105 N 0.65 0.87 -0.15 4.80 1.08 -0.52 0.16 115.11 122.00 3n4f h GLN 105 Ca 0.18 -0.09 -0.03 0.00 -1.45 0.00 0.00 58.65 57.25 3n4f h GLN 105 Cb -0.02 -0.18 -0.00 0.00 -0.05 0.00 0.00 27.48 27.23 3n4f h GLN 105 CO -0.03 0.64 -0.03 -0.09 -0.95 0.00 0.00 178.83 178.37 3n4f h ARG 106 N 0.86 0.29 -0.00 1.46 9.65 -0.62 -3.17 114.38 122.85 3n4f h ARG 106 Ca 0.23 -0.11 0.00 0.00 -1.10 0.00 0.00 59.98 59.00 3n4f h ARG 106 Cb 0.01 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.57 3n4f h ARG 106 CO -0.04 0.57 -0.22 1.04 2.80 0.00 0.00 179.97 184.11 3n4f n GLN 107 N -4.70 0.17 -3.23 0.20 6.02 0.28 -4.95 117.38 111.17 3n4f n GLN 107 Ca -0.05 -0.06 -0.16 0.00 -0.01 0.00 0.00 57.00 56.71 3n4f n GLN 107 Cb 0.26 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 30.07 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 1.45 -0.05 3.08 1.08 0.00 0.46 -5.04 105.19 106.16 3n4f n GLY 108 Ca 0.08 -0.05 -0.16 0.00 0.00 0.00 0.00 46.02 45.89 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 -5.87 0.66 0.59 1.61 1.02 -0.61 -4.80 119.74 112.34 3n4f s LYS 109 Ca 0.39 -0.65 -0.18 0.00 0.02 0.00 0.00 55.97 55.55 3n4f s LYS 109 Cb -0.17 -0.58 -0.03 0.00 -0.52 0.00 0.00 37.83 36.53 3n4f s LYS 109 CO 0.49 0.13 1.12 -1.25 -0.92 0.00 0.00 175.35 174.93 3n4f s PRO 110 N -1.13 3.10 0.30 -1.68 0.04 -1.23 -1.34 135.00 133.06 3n4f s PRO 110 Ca -0.03 1.53 0.04 0.00 0.04 0.00 0.00 61.00 62.58 3n4f s PRO 110 Cb -0.08 -1.98 0.65 0.00 0.04 0.00 0.00 34.50 33.13 3n4f s PRO 110 CO 0.01 -1.03 1.82 0.28 0.04 0.00 0.00 177.00 178.11 3n4f h VAL 111 N 0.69 0.84 -0.24 -0.36 2.07 -1.39 -0.37 116.25 117.49 3n4f h VAL 111 Ca -0.49 -0.30 0.07 0.00 0.82 0.00 0.00 66.70 66.80 3n4f h VAL 111 Cb 1.26 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 3n4f h VAL 111 CO 0.56 0.16 0.18 0.10 0.02 0.00 0.00 177.57 178.59 3n4f h TYR 112 N 0.88 0.00 -0.62 1.57 -0.00 -1.85 0.41 116.97 117.37 3n4f h TYR 112 Ca 0.52 0.00 -0.10 0.00 0.00 0.00 0.00 58.73 59.15 3n4f h TYR 112 Cb 0.65 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.36 3n4f h TYR 112 CO -0.00 0.00 0.01 0.22 -0.00 0.00 0.00 178.16 178.39 3n4f h ASP 113 N 0.00 1.06 0.70 0.10 1.82 -1.42 -2.92 116.42 115.75 3n4f h ASP 113 Ca 0.12 -0.30 -0.15 0.00 -0.39 0.00 0.00 57.03 56.30 3n4f h ASP 113 Cb 0.48 -0.28 -0.02 0.00 0.68 0.00 0.00 39.33 40.18 3n4f h ASP 113 CO -0.00 1.10 -0.71 -0.07 -1.61 0.00 0.00 179.24 177.95 3n4f h LEU 114 N 0.99 0.01 -0.40 2.28 4.07 -0.12 -3.37 115.31 118.78 3n4f h LEU 114 Ca 0.18 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.13 3n4f h LEU 114 Cb 0.55 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.29 3n4f h LEU 114 CO 0.03 0.72 -0.33 1.33 -1.08 0.00 0.00 178.44 179.11 3n4f n VAL 115 N -3.70 0.00 -2.63 1.22 0.24 -0.42 -4.94 118.33 108.11 3n4f n VAL 115 Ca -0.01 -0.33 -0.34 0.00 -2.04 0.00 0.00 64.34 61.61 3n4f n VAL 115 Cb 0.69 1.06 -0.05 0.00 -1.47 0.00 0.00 33.84 34.08 3n4f n VAL 115 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3n4f s SER 116 N -1.64 6.61 0.00 -1.34 1.04 -1.11 -4.61 113.70 112.66 3n4f s SER 116 Ca 0.06 1.88 0.00 0.00 0.48 0.00 0.00 55.95 58.38 3n4f s SER 116 Cb 0.08 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.64 3n4f s SER 116 CO 0.33 -0.59 0.59 0.61 0.98 0.00 0.00 173.24 175.15 3n4f n GLY 117 N -0.21 -0.46 3.67 7.32 0.00 -1.26 -4.93 105.19 109.31 3n4f n GLY 117 Ca 0.08 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.43 1.09 -0.03 4.61 0.00 -1.26 -4.91 120.51 119.58 3n4f n ALA 118 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.87 3n4f n ALA 118 Cb 0.02 -2.35 -0.09 0.00 0.00 0.00 0.00 19.45 17.02 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 3.85 0.00 -2.47 0.00 1.44 -1.26 -5.01 115.22 111.77 3n4f n HIS 119 Ca 0.18 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.53 3n4f n HIS 119 Cb 0.28 -0.42 -0.03 0.00 0.12 0.00 0.00 29.99 29.93 3n4f n HIS 119 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3n4f s LEU 120 N -4.35 4.07 0.03 2.39 1.43 -1.26 -4.94 118.68 116.05 3n4f s LEU 120 Ca -0.05 2.09 -0.36 0.00 -1.03 0.00 0.00 54.13 54.77 3n4f s LEU 120 Cb 0.06 -4.25 -0.16 0.00 0.03 0.00 0.00 46.19 41.87 3n4f s LEU 120 CO 0.49 -0.63 1.49 1.21 0.23 0.00 0.00 176.35 179.14 3n4f n GLU 121 N -0.29 1.43 -2.12 1.70 2.13 -1.26 -4.95 120.64 117.27 3n4f n GLU 121 Ca 0.06 0.52 -0.28 0.00 0.66 0.00 0.00 57.16 58.11 3n4f n GLU 121 Cb 0.50 -2.21 0.04 0.00 0.27 0.00 0.00 31.44 30.04 3n4f n GLU 121 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 3n4f s THR 122 N 1.29 3.47 0.00 6.31 -4.23 -1.26 -4.81 115.64 116.41 3n4f s THR 122 Ca 0.86 0.23 0.00 0.00 -1.18 0.00 0.00 61.69 61.60 3n4f s THR 122 Cb -0.90 -3.43 0.00 0.00 1.34 0.00 0.00 72.50 69.51 3n4f s THR 122 CO 0.48 -0.52 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 3n4f n GLY 123 N -2.83 0.67 3.76 3.99 0.00 -1.26 -5.14 105.19 104.38 3n4f n GLY 123 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 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 0.00 3.32 0.24 4.61 0.00 -1.26 -5.01 121.76 123.66 3n4f s ALA 124 Ca 0.00 0.73 -0.30 0.00 0.00 0.00 0.00 51.96 52.39 3n4f s ALA 124 Cb 0.00 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.77 3n4f s ALA 124 CO 0.00 0.01 1.35 0.45 0.00 0.00 0.00 175.76 177.57 3n4f s SER 125 N -1.16 6.80 -0.37 0.00 0.15 -1.26 -5.00 113.70 112.86 3n4f s SER 125 Ca 0.46 2.54 -0.20 0.00 0.70 0.00 0.00 55.95 59.44 3n4f s SER 125 Cb -0.27 -2.62 0.01 0.00 -1.71 0.00 0.00 66.02 61.42 3n4f s SER 125 CO 0.34 -0.58 0.63 -0.22 1.20 0.00 0.00 173.24 174.61 3n4f s LEU 126 N -0.53 4.30 -0.14 3.45 2.96 -1.26 -5.03 118.68 122.43 3n4f s LEU 126 Ca 0.56 0.05 0.02 0.00 -0.22 0.00 0.00 54.13 54.54 3n4f s LEU 126 Cb -0.39 -2.76 0.01 0.00 0.50 0.00 0.00 46.19 43.55 3n4f s LEU 126 CO 0.43 -0.62 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.96 3n4f s VAL 127 N 2.71 1.84 -0.05 1.68 1.01 -1.26 -1.05 120.40 125.27 3n4f s VAL 127 Ca 0.24 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.43 3n4f s VAL 127 Cb -0.14 -1.65 -0.00 0.00 0.00 0.00 0.00 36.38 34.58 3n4f s VAL 127 CO 0.15 0.51 -0.20 -0.69 0.00 0.00 0.00 175.10 174.87 3n4f s VAL 128 N 1.01 1.64 0.49 2.92 1.01 -0.36 -4.96 120.40 122.15 3n4f s VAL 128 Ca -0.04 -0.83 -0.24 0.00 0.00 0.00 0.00 61.98 60.88 3n4f s VAL 128 Cb -0.15 -1.40 -0.07 0.00 0.00 0.00 0.00 36.38 34.75 3n4f s VAL 128 CO -0.04 0.47 1.32 -2.65 0.00 0.00 0.00 175.10 174.19 3n4f n PRO 129 N 3.13 1.85 -4.13 2.72 -0.02 -1.26 0.29 135.00 137.58 3n4f n PRO 129 Ca -0.18 0.67 -0.09 0.00 -2.02 0.00 0.00 63.50 61.87 3n4f n PRO 129 Cb 0.53 -2.49 -0.10 0.00 -0.02 0.00 0.00 33.50 31.41 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 -3.51 1.22 -0.41 0.00 -0.85 -0.69 -4.45 117.35 108.66 3n4f s TYR 131 Ca 0.08 -0.71 -0.26 0.00 -0.52 0.00 0.00 57.07 55.66 3n4f s TYR 131 Cb 0.05 -0.64 0.02 0.00 0.38 0.00 0.00 41.96 41.77 3n4f s TYR 131 CO -0.06 0.07 0.93 0.34 -1.52 0.00 0.00 175.55 175.31 3n4f s ASP 132 N -2.88 6.61 0.00 -0.18 2.15 -0.11 -0.87 116.67 121.39 3n4f s ASP 132 Ca 0.13 0.40 0.23 0.00 0.43 0.00 0.00 52.55 53.74 3n4f s ASP 132 Cb 0.00 -2.46 0.52 0.00 -0.30 0.00 0.00 42.92 40.68 3n4f s ASP 132 CO 0.01 -0.94 1.44 1.07 -0.17 0.00 0.00 175.17 176.57 3n4f n THR 133 N 6.18 0.36 1.44 1.71 5.66 -0.83 -1.41 114.28 127.39 3n4f n THR 133 Ca 0.07 -0.59 0.02 0.00 -3.05 0.00 0.00 64.05 60.50 3n4f n THR 133 Cb 0.48 0.82 0.07 0.00 -1.55 0.00 0.00 70.33 70.15 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 1.10 0.89 -4.33 1.09 3.41 -1.26 -4.69 113.62 109.83 3n4f n SER 134 Ca 0.18 -2.02 -0.44 0.00 -0.26 0.00 0.00 58.87 56.33 3n4f n SER 134 Cb 0.52 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 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 -0.06 5.55 0.00 1.04 4.77 -1.26 -4.93 117.00 122.11 3n4f n LEU 135 Ca 0.05 -4.71 -0.07 0.00 -0.03 0.00 0.00 56.01 51.25 3n4f n LEU 135 Cb 0.15 -1.54 0.04 0.00 -2.33 0.00 0.00 43.42 39.75 3n4f n LEU 135 CO 0.04 1.05 0.20 -1.22 -1.33 0.00 0.00 177.39 176.13 3n4f n TYR 136 N 4.25 -3.60 -1.25 -1.77 4.02 -1.26 -1.66 117.16 115.89 3n4f n TYR 136 Ca 0.33 -0.42 -0.36 0.00 -0.01 0.00 0.00 57.90 57.44 3n4f n TYR 136 Cb 0.40 -0.24 -0.02 0.00 -0.02 0.00 0.00 39.34 39.46 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 -2.13 2.36 1.21 -0.72 3.72 0.11 -4.62 117.46 117.39 3n4f n PHE 137 Ca 0.05 -2.70 0.14 0.00 -0.05 0.00 0.00 57.45 54.88 3n4f n PHE 137 Cb 0.16 -2.25 0.67 0.00 -0.94 0.00 0.00 39.48 37.13 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 4.59 0.00 -0.78 4.37 8.00 -1.26 -3.52 116.55 127.95 3n4f n ASP 138 Ca 0.63 0.09 0.13 0.00 0.71 0.00 0.00 54.79 56.35 3n4f n ASP 138 Cb 0.26 -0.36 0.27 0.00 -0.02 0.00 0.00 41.12 41.27 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 -1.36 2.43 0.30 -2.24 5.75 -1.26 -4.58 116.55 115.59 3n4f n ASP 139 Ca 0.11 -1.81 0.17 0.00 -0.01 0.00 0.00 54.79 53.26 3n4f n ASP 139 Cb 0.26 -0.02 0.96 0.00 -1.03 0.00 0.00 41.12 41.29 3n4f n ASP 139 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 3n4f h LEU 140 N 3.75 0.00 -0.26 -2.12 3.38 -1.97 0.97 115.31 119.06 3n4f h LEU 140 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3n4f h LEU 140 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3n4f h LEU 140 CO 0.00 0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.56 3n4f n HIS 141 N -3.48 0.56 -3.41 1.13 1.44 -1.26 -4.80 115.22 105.39 3n4f n HIS 141 Ca -0.02 0.19 -0.38 0.00 -2.01 0.00 0.00 57.72 55.50 3n4f n HIS 141 Cb 0.13 -0.81 -0.07 0.00 0.12 0.00 0.00 29.99 29.36 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 -3.97 4.19 0.13 2.39 1.43 0.33 -4.98 118.68 118.21 3n4f s LEU 142 Ca 0.08 0.55 -0.01 0.00 -1.03 0.00 0.00 54.13 53.73 3n4f s LEU 142 Cb 0.12 -2.50 -0.12 0.00 0.03 0.00 0.00 46.19 43.71 3n4f s LEU 142 CO 0.44 -0.02 1.29 0.00 0.23 0.00 0.00 176.35 178.28 3n4f h ALA 143 N 7.12 0.35 -2.84 4.21 0.00 -1.87 -3.46 119.26 122.77 3n4f h ALA 143 Ca -0.38 -0.78 -0.60 0.00 0.00 0.00 0.00 54.91 53.15 3n4f h ALA 143 Cb 1.16 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 3n4f h ALA 143 CO 0.73 0.94 -0.21 0.34 0.00 0.00 0.00 179.25 181.05 3n4f s ASP 144 N -7.01 6.70 0.21 0.00 2.15 -1.26 -5.00 116.67 112.46 3n4f s ASP 144 Ca -0.03 0.83 -0.10 0.00 0.43 0.00 0.00 52.55 53.67 3n4f s ASP 144 Cb 0.09 -2.25 0.18 0.00 -0.30 0.00 0.00 42.92 40.64 3n4f s ASP 144 CO 0.85 0.18 1.86 -0.08 -0.17 0.00 0.00 175.17 177.81 3n4f h GLU 145 N 5.74 0.87 -0.50 4.34 4.81 -1.99 -1.81 114.58 126.04 3n4f h GLU 145 Ca -0.46 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 58.61 3n4f h GLU 145 Cb 1.20 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 3n4f h GLU 145 CO 0.69 0.58 -0.10 0.00 -0.73 0.00 0.00 179.01 179.45 3n4f h ARG 146 N 0.90 0.91 -0.54 1.92 3.08 -1.99 -1.00 114.38 117.65 3n4f h ARG 146 Ca 0.28 -0.31 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 3n4f h ARG 146 Cb -0.02 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 3n4f h ARG 146 CO -0.09 0.96 0.19 0.00 -1.07 0.00 0.00 179.97 179.96 3n4f h ALA 147 N 1.07 0.71 -0.44 0.04 0.00 -1.94 -1.93 119.26 116.76 3n4f h ALA 147 Ca 0.13 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3n4f h ALA 147 Cb 0.62 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3n4f h ALA 147 CO 0.04 0.35 0.21 0.00 0.00 0.00 0.00 179.25 179.85 3n4f h ALA 148 N 1.05 0.57 -0.23 0.00 0.00 -1.15 -2.13 119.26 117.37 3n4f h ALA 148 Ca 0.18 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3n4f h ALA 148 Cb 0.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3n4f h ALA 148 CO -0.01 0.14 0.15 0.28 0.00 0.00 0.00 179.25 179.81 3n4f h VAL 149 N 0.58 1.06 -0.82 0.00 2.07 -1.09 -2.89 116.25 115.16 3n4f h VAL 149 Ca 0.15 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.59 3n4f h VAL 149 Cb 0.13 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 30.57 3n4f h VAL 149 CO -0.02 0.06 0.52 0.00 0.02 0.00 0.00 177.57 178.15 3n4f h ALA 150 N 1.08 1.08 0.00 1.67 0.00 -1.26 0.80 119.26 122.63 3n4f h ALA 150 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3n4f h ALA 150 Cb -0.03 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.48 3n4f h ALA 150 CO -0.02 0.35 0.00 -0.11 0.00 0.00 0.00 179.25 179.47 3n4f n LEU 151 N -4.58 0.15 0.00 0.00 7.94 -0.81 -1.08 117.00 118.62 3n4f n LEU 151 Ca 0.10 -0.08 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 3n4f n LEU 151 Cb 0.09 -0.08 0.00 0.00 0.53 0.00 0.00 43.42 43.96 3n4f n LEU 151 CO 0.34 0.04 0.00 0.00 -1.11 0.00 0.00 177.39 176.65 3n4f n GLN 153 N 0.42 0.00 -0.12 1.96 6.02 0.27 -1.07 117.38 124.87 3n4f n GLN 153 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.89 3n4f n GLN 153 Cb 0.04 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.28 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 0.55 -0.78 -1.09 4.22 -1.36 -2.92 114.58 113.20 3n4f h GLU 154 Ca 0.00 -0.13 0.02 0.00 0.08 0.00 0.00 59.36 59.33 3n4f h GLU 154 Cb 0.00 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 3n4f h GLU 154 CO 0.00 0.59 0.51 0.93 -2.18 0.00 0.00 179.01 178.86 3n4f h GLU 155 N 0.41 0.99 -0.71 1.92 5.08 -1.38 -0.67 114.58 120.22 3n4f h GLU 155 Ca 0.11 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3n4f h GLU 155 Cb 0.28 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3n4f h GLU 155 CO -0.00 0.65 0.00 0.00 -1.00 0.00 0.00 179.01 178.66 3n4f n ALA 156 N -2.32 1.11 0.00 3.43 0.00 -1.11 -2.49 120.51 119.14 3n4f n ALA 156 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3n4f n ALA 156 Cb 0.05 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 0.65 0.00 -0.20 0.00 6.02 -0.26 -0.79 117.38 122.81 3n4f n GLN 158 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.90 3n4f n GLN 158 Cb 0.00 0.00 0.02 0.00 1.02 0.00 0.00 30.24 31.28 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 1.08 1.00 1.08 0.00 -1.77 -3.05 103.07 101.42 3n4f h GLY 159 Ca 0.00 -0.80 0.01 0.00 0.00 0.00 0.00 47.33 46.54 3n4f h GLY 159 CO 0.00 0.73 0.48 -1.82 0.00 0.00 0.00 176.54 175.93 3n4f h TYR 160 N 0.89 0.90 0.00 5.60 5.03 -1.11 -1.31 116.97 126.97 3n4f h TYR 160 Ca 0.16 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.48 3n4f h TYR 160 Cb 0.54 -0.30 -0.00 0.00 1.55 0.00 0.00 36.73 38.52 3n4f h TYR 160 CO 0.04 0.57 -0.05 0.00 -1.32 0.00 0.00 178.16 177.40 3n4f h ALA 161 N 1.26 1.44 -0.54 1.82 0.00 -1.81 -1.60 119.26 119.83 3n4f h ALA 161 Ca 0.26 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 3n4f h ALA 161 Cb -0.11 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3n4f h ALA 161 CO -0.06 0.06 0.06 1.63 0.00 0.00 0.00 179.25 180.94 3n4f n LYS 162 N -3.78 4.16 -0.53 0.00 5.02 -0.59 -4.93 118.16 117.52 3n4f n LYS 162 Ca -0.03 -2.72 0.00 0.00 -2.02 0.00 0.00 58.31 53.54 3n4f n LYS 162 Cb 0.14 -2.16 0.00 0.00 -0.02 0.00 0.00 35.03 33.00 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 0.39 0.76 3.77 0.72 0.00 -0.60 -4.76 105.19 105.47 3n4f n GLY 163 Ca 0.27 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.47 4.56 0.00 1.61 -1.52 -0.66 -0.45 119.66 122.74 3n4f s GLN 164 Ca 0.00 1.45 0.00 0.00 -1.95 0.00 0.00 55.36 54.86 3n4f s GLN 164 Cb 0.00 -2.89 0.00 0.00 -0.22 0.00 0.00 33.01 29.90 3n4f s GLN 164 CO 0.00 0.24 0.00 0.54 -0.25 0.00 0.00 175.29 175.82 3n4f n ARG 165 N 0.70 3.12 -5.11 2.91 5.12 -1.26 -4.11 116.66 118.03 3n4f n ARG 165 Ca 0.01 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.64 3n4f n ARG 165 Cb 0.49 -0.66 -0.15 0.00 -1.16 0.00 0.00 32.46 30.97 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 -1.19 2.18 -0.02 -1.55 3.76 -1.26 -3.91 115.29 113.30 3n4f s HIS 166 Ca 0.00 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.51 3n4f s HIS 166 Cb 0.00 -1.37 0.01 0.00 1.11 0.00 0.00 32.58 32.33 3n4f s HIS 166 CO 0.00 0.00 -0.01 -0.06 -0.85 0.00 0.00 174.74 173.83 3n4f s PHE 167 N -0.63 0.22 -0.25 1.40 0.40 -0.51 -0.93 117.98 117.67 3n4f s PHE 167 Ca 0.10 0.00 -0.07 0.00 -0.60 0.00 0.00 56.93 56.36 3n4f s PHE 167 Cb -0.09 -0.25 -0.02 0.00 0.51 0.00 0.00 43.02 43.17 3n4f s PHE 167 CO -0.00 -0.07 0.05 0.21 0.70 0.00 0.00 175.22 176.11 3n4f s LYS 168 N 0.54 3.46 -0.23 0.44 2.20 -0.50 -4.27 119.74 121.38 3n4f s LYS 168 Ca -0.05 -0.60 -0.07 0.00 -0.36 0.00 0.00 55.97 54.89 3n4f s LYS 168 Cb -0.08 -3.27 -0.03 0.00 -1.51 0.00 0.00 37.83 32.94 3n4f s LYS 168 CO -0.01 -0.25 0.07 0.42 -0.36 0.00 0.00 175.35 175.22 3n4f s ILE 169 N 1.56 4.45 0.17 5.43 1.01 -1.26 -4.03 121.20 128.53 3n4f s ILE 169 Ca 0.05 -0.13 -0.31 0.00 0.00 0.00 0.00 60.65 60.26 3n4f s ILE 169 Cb -0.15 -3.07 -0.10 0.00 0.01 0.00 0.00 42.46 39.15 3n4f s ILE 169 CO 0.02 0.36 1.52 -0.54 0.00 0.00 0.00 174.94 176.30 3n4f s LYS 170 N 1.33 4.24 0.36 2.79 -0.14 -0.66 -1.54 119.74 126.12 3n4f s LYS 170 Ca 0.05 2.30 0.04 0.00 -1.36 0.00 0.00 55.97 57.00 3n4f s LYS 170 Cb -0.15 -3.16 -0.01 0.00 -1.68 0.00 0.00 37.83 32.83 3n4f s LYS 170 CO 0.04 -0.55 0.13 1.33 -0.76 0.00 0.00 175.35 175.54 3n4f n VAL 171 N 3.70 0.00 -0.21 3.17 0.24 0.72 -4.83 118.33 121.13 3n4f n VAL 171 Ca 0.12 -2.12 0.00 0.00 -2.04 0.00 0.00 64.34 60.30 3n4f n VAL 171 Cb 0.39 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 -0.46 0.88 0.42 7.63 0.00 -1.26 -4.10 105.19 108.29 3n4f n GLY 172 Ca -0.05 -0.17 0.27 0.00 0.00 0.00 0.00 46.02 46.07 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 0.87 0.28 0.00 1.61 3.08 -1.91 -0.50 114.38 117.81 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 0.00 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 29.99 3n4f h ARG 173 CO 0.00 0.18 0.00 0.41 -1.07 0.00 0.00 179.97 179.49 3n4f n GLY 174 N -1.46 -1.57 0.17 0.04 0.00 -1.26 -2.74 105.19 98.37 3n4f n GLY 174 Ca 0.30 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 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 4.27 0.53 0.00 -0.02 0.00 -1.29 -3.31 103.07 103.25 3n4f h GLY 175 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3n4f h GLY 175 CO 0.00 0.24 -0.19 -2.13 0.00 0.00 0.00 176.54 174.47 3n4f n ARG 176 N -4.75 0.00 -0.05 4.80 0.63 -1.25 -5.03 116.66 111.01 3n4f n ARG 176 Ca -0.01 0.00 0.05 0.00 -0.92 0.00 0.00 57.85 56.97 3n4f n ARG 176 Cb 0.10 -0.17 0.21 0.00 0.45 0.00 0.00 32.46 33.05 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 -2.46 0.13 -2.71 -0.14 8.25 -1.11 -5.08 115.22 112.09 3n4f n HIS 177 Ca 0.00 -0.06 -0.36 0.00 -0.26 0.00 0.00 57.72 57.04 3n4f n HIS 177 Cb 0.09 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.15 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 -1.87 4.34 0.13 -0.41 0.02 -1.26 -5.04 135.00 130.92 3n4f s PRO 179 Ca 0.16 1.33 -0.22 0.00 0.02 0.00 0.00 61.00 62.28 3n4f s PRO 179 Cb 0.08 -2.54 -0.02 0.00 0.02 0.00 0.00 34.50 32.04 3n4f s PRO 179 CO 0.12 0.05 1.66 1.25 -0.33 0.00 0.00 177.00 179.75 3n4f h LEU 180 N 2.59 -0.49 0.18 -5.54 5.85 -1.92 0.14 115.31 116.12 3n4f h LEU 180 Ca -0.48 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.32 3n4f h LEU 180 Cb 1.20 0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.46 3n4f h LEU 180 CO 0.63 -0.21 -0.09 -0.25 -0.34 0.00 0.00 178.44 178.18 3n4f h TRP 181 N -0.20 -0.23 -0.34 1.25 2.91 -1.99 -0.82 115.95 116.53 3n4f h TRP 181 Ca 0.09 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.09 3n4f h TRP 181 Cb 0.34 0.08 -0.02 0.00 -0.51 0.00 0.00 29.16 29.05 3n4f h TRP 181 CO -0.27 0.05 0.15 0.93 -1.03 0.00 0.00 178.44 178.27 3n4f h GLU 182 N -0.51 0.49 -0.61 2.65 3.07 -1.98 -0.97 114.58 116.72 3n4f h GLU 182 Ca -0.03 -0.08 0.09 0.00 -0.50 0.00 0.00 59.36 58.85 3n4f h GLU 182 Cb 0.38 -0.09 -0.07 0.00 -0.84 0.00 0.00 28.75 28.14 3n4f h GLU 182 CO 0.04 0.46 0.24 0.78 -1.40 0.00 0.00 179.01 179.13 3n4f h GLY 183 N 0.40 0.86 1.26 -3.84 0.00 -0.71 0.99 103.07 102.04 3n4f h GLY 183 Ca 0.11 -0.14 -0.14 0.00 0.00 0.00 0.00 47.33 47.17 3n4f h GLY 183 CO -0.01 -0.00 -0.32 -0.84 0.00 0.00 0.00 176.54 175.36 3n4f h THR 184 N 0.44 1.28 -0.36 4.70 2.02 -0.78 0.08 112.91 120.29 3n4f h THR 184 Ca 0.31 -1.48 -0.03 0.00 0.77 0.00 0.00 66.41 65.97 3n4f h THR 184 Cb 0.36 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 3n4f h THR 184 CO -0.29 0.49 0.10 0.50 0.37 0.00 0.00 175.52 176.69 3n4f h LYS 185 N 0.69 0.56 -0.59 6.66 3.64 -0.89 -2.41 116.57 124.24 3n4f h LYS 185 Ca 0.07 -0.13 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 3n4f h LYS 185 Cb 0.88 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.59 3n4f h LYS 185 CO 0.08 0.60 0.38 -0.09 -2.27 0.00 0.00 179.45 178.15 3n4f h ARG 186 N 0.42 0.75 -0.30 1.90 9.65 -0.64 -1.56 114.38 124.60 3n4f h ARG 186 Ca 0.11 -0.05 0.07 0.00 -1.10 0.00 0.00 59.98 59.02 3n4f h ARG 186 Cb 0.28 -0.17 -0.08 0.00 -1.39 0.00 0.00 29.97 28.61 3n4f h ARG 186 CO -0.00 0.50 -0.30 -0.44 2.80 0.00 0.00 179.97 182.52 3n4f h ASP 187 N 0.77 -0.97 -0.41 -3.80 3.32 -0.70 0.12 116.42 114.74 3n4f h ASP 187 Ca 0.22 0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.44 3n4f h ASP 187 Cb -0.05 0.45 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 3n4f h ASP 187 CO -0.07 -0.32 0.23 0.40 -1.72 0.00 0.00 179.24 177.77 3n4f h ILE 188 N -0.28 1.15 -0.32 0.35 2.04 -1.24 -1.13 117.51 118.08 3n4f h ILE 188 Ca 0.15 -0.38 0.04 0.00 1.00 0.00 0.00 64.86 65.67 3n4f h ILE 188 Cb 0.52 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 3n4f h ILE 188 CO -0.46 0.16 0.08 0.00 0.00 0.00 0.00 178.15 177.93 3n4f h ALA 189 N 1.09 0.35 -0.46 1.87 0.00 -0.91 -1.27 119.26 119.92 3n4f h ALA 189 Ca 0.15 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.12 3n4f h ALA 189 Cb 0.04 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3n4f h ALA 189 CO -0.02 -0.32 0.28 0.82 0.00 0.00 0.00 179.25 180.00 3n4f h ILE 190 N 0.21 1.06 -0.37 0.00 1.08 -0.69 -1.37 117.51 117.42 3n4f h ILE 190 Ca 0.15 -0.19 -0.02 0.00 -0.39 0.00 0.00 64.86 64.41 3n4f h ILE 190 Cb 0.14 0.45 -0.02 0.00 -3.07 0.00 0.00 36.82 34.32 3n4f h ILE 190 CO -0.17 0.10 0.17 0.58 -0.69 0.00 0.00 178.15 178.14 3n4f h VAL 191 N 0.56 1.17 -0.84 1.67 2.07 -0.93 -0.99 116.25 118.96 3n4f h VAL 191 Ca 0.18 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.20 3n4f h VAL 191 Cb 0.00 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 3n4f h VAL 191 CO -0.08 0.19 0.56 0.03 0.02 0.00 0.00 177.57 178.29 3n4f h ARG 192 N 0.46 1.11 -0.42 1.57 3.08 -1.12 -1.15 114.38 117.91 3n4f h ARG 192 Ca 0.13 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 3n4f h ARG 192 Cb 0.14 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 3n4f h ARG 192 CO -0.01 0.74 0.16 0.78 -1.07 0.00 0.00 179.97 180.56 3n4f h GLY 193 N 1.14 0.68 1.46 0.04 0.00 -0.86 -1.99 103.07 103.55 3n4f h GLY 193 Ca 0.31 -0.38 -0.13 0.00 0.00 0.00 0.00 47.33 47.13 3n4f h GLY 193 CO -0.07 0.36 -0.37 -2.22 0.00 0.00 0.00 176.54 174.25 3n4f h ILE 194 N 0.54 1.29 -0.58 2.60 2.04 -1.05 -2.98 117.51 119.36 3n4f h ILE 194 Ca 0.14 -1.51 0.06 0.00 1.00 0.00 0.00 64.86 64.55 3n4f h ILE 194 Cb 0.21 1.48 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 3n4f h ILE 194 CO -0.01 0.48 0.28 -1.28 0.00 0.00 0.00 178.15 177.63 3n4f h SER 195 N 0.50 0.39 -0.04 1.72 0.87 -1.03 0.20 113.55 116.17 3n4f h SER 195 Ca 0.05 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.60 3n4f h SER 195 Cb 0.87 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.79 3n4f h SER 195 CO 0.07 0.25 -0.11 -0.08 -0.53 0.00 0.00 176.83 176.44 3n4f h GLU 196 N 0.53 0.33 0.00 2.24 4.81 -1.25 -3.04 114.58 118.20 3n4f h GLU 196 Ca 0.27 -0.08 -0.19 0.00 -0.13 0.00 0.00 59.36 59.23 3n4f h GLU 196 Cb 0.21 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 3n4f h GLU 196 CO -0.20 0.45 -1.62 1.55 -0.73 0.00 0.00 179.01 178.46 3n4f n VAL 197 N -4.26 1.16 0.23 0.32 3.14 -1.02 -4.02 118.33 113.89 3n4f n VAL 197 Ca -0.00 -0.71 0.13 0.00 -2.96 0.00 0.00 64.34 60.80 3n4f n VAL 197 Cb 0.28 -0.67 0.37 0.00 -1.06 0.00 0.00 33.84 32.75 3n4f n VAL 197 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3n4f h ALA 198 N 1.37 0.98 0.00 1.55 0.00 -0.89 -3.50 119.26 118.77 3n4f h ALA 198 Ca -0.21 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3n4f h ALA 198 Cb 1.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.45 3n4f h ALA 198 CO 0.04 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.78 3n4f n GLY 199 N 0.65 -1.35 0.25 0.00 0.00 -1.16 -3.83 105.19 99.75 3n4f n GLY 199 Ca 0.02 -1.58 0.13 0.00 0.00 0.00 0.00 46.02 44.60 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 0.00 0.00 1.61 0.13 -1.94 -2.77 132.00 129.03 3n4f h PRO 200 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3n4f h PRO 200 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3n4f h PRO 200 CO 0.00 0.10 -0.37 0.00 -0.23 0.00 0.00 178.00 177.51 3n4f n ALA 201 N -2.15 2.77 -2.64 -0.56 0.00 -1.26 -4.86 120.51 111.80 3n4f n ALA 201 Ca 0.01 -0.18 -0.43 0.00 0.00 0.00 0.00 53.44 52.84 3n4f n ALA 201 Cb 0.38 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.53 3n4f n ALA 201 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3n4f s GLY 202 N -3.47 1.61 0.27 0.00 0.00 -1.05 -4.93 107.32 99.74 3n4f s GLY 202 Ca 0.09 -0.08 -0.30 0.00 0.00 0.00 0.00 44.72 44.44 3n4f s GLY 202 CO 0.66 2.16 1.09 0.54 0.00 0.00 0.00 173.10 177.56 3n4f s LYS 203 N 3.44 4.64 0.39 2.90 1.02 -1.25 -4.88 119.74 126.00 3n4f s LYS 203 Ca 0.43 1.78 0.05 0.00 0.02 0.00 0.00 55.97 58.25 3n4f s LYS 203 Cb -0.13 -3.20 -0.07 0.00 -0.52 0.00 0.00 37.83 33.91 3n4f s LYS 203 CO 0.13 0.21 0.03 0.42 -0.92 0.00 0.00 175.35 175.22 3n4f s ILE 204 N -1.05 1.62 -0.24 2.17 -1.09 -1.09 -1.42 121.20 120.09 3n4f s ILE 204 Ca 0.45 -2.00 -0.26 0.00 -2.23 0.00 0.00 60.65 56.61 3n4f s ILE 204 Cb -0.31 -2.84 0.10 0.00 -1.58 0.00 0.00 42.46 37.82 3n4f s ILE 204 CO 0.40 0.00 0.86 0.27 -1.23 0.00 0.00 174.94 175.24 3n4f s ILE 206 N -2.93 0.00 -0.17 2.92 -4.36 -0.81 0.35 121.20 116.20 3n4f s ILE 206 Ca 0.33 0.00 -0.01 0.00 -0.26 0.00 0.00 60.65 60.71 3n4f s ILE 206 Cb 0.09 -1.00 0.05 0.00 1.25 0.00 0.00 42.46 42.84 3n4f s ILE 206 CO 0.16 0.00 -0.04 -0.62 0.24 0.00 0.00 174.94 174.68 3n4f s ASP 207 N 0.04 2.91 0.00 4.36 -1.08 -0.59 -0.75 116.67 121.56 3n4f s ASP 207 Ca 0.00 -0.72 0.26 0.00 -0.52 0.00 0.00 52.55 51.57 3n4f s ASP 207 Cb -0.04 -0.88 0.73 0.00 -1.46 0.00 0.00 42.92 41.26 3n4f s ASP 207 CO -0.01 -0.21 1.56 0.00 0.52 0.00 0.00 175.17 177.03 3n4f n ALA 208 N 4.88 3.21 -4.24 3.66 0.00 -0.87 -0.20 120.51 126.95 3n4f n ALA 208 Ca -0.11 -0.33 -0.34 0.00 0.00 0.00 0.00 53.44 52.66 3n4f n ALA 208 Cb 0.47 -1.18 -0.05 0.00 0.00 0.00 0.00 19.45 18.69 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 -1.22 -1.46 -0.13 0.00 4.13 -1.13 -1.64 115.26 113.82 3n4f n ASN 209 Ca 0.08 -1.11 -0.02 0.00 1.68 0.00 0.00 54.58 55.22 3n4f n ASN 209 Cb 0.33 -2.37 -0.01 0.00 -1.54 0.00 0.00 39.78 36.19 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 -2.74 -4.44 -0.00 6.41 3.02 0.10 -4.41 115.26 113.20 3n4f n ASN 210 Ca -0.09 0.04 0.15 0.00 -0.03 0.00 0.00 54.58 54.65 3n4f n ASN 210 Cb 0.57 -2.09 0.73 0.00 -0.61 0.00 0.00 39.78 38.38 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 1.03 2.48 -2.04 5.41 0.00 -0.65 -4.53 120.51 122.21 3n4f n ALA 211 Ca -0.02 -0.14 -0.20 0.00 0.00 0.00 0.00 53.44 53.08 3n4f n ALA 211 Cb 0.26 -1.48 0.07 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 -2.64 1.22 0.11 0.00 2.02 -0.64 -4.42 117.35 113.00 3n4f s TYR 212 Ca 0.26 -0.73 0.01 0.00 -0.37 0.00 0.00 57.07 56.23 3n4f s TYR 212 Cb 0.20 -2.26 -0.00 0.00 -0.40 0.00 0.00 41.96 39.50 3n4f s TYR 212 CO 0.47 -1.32 0.02 0.27 -1.57 0.00 0.00 175.55 173.43 3n4f n ASN 213 N -2.35 1.50 -0.03 2.29 0.23 -1.26 -4.54 115.26 111.10 3n4f n ASN 213 Ca 0.17 -1.54 -0.11 0.00 -0.53 0.00 0.00 54.58 52.56 3n4f n ASN 213 Cb 0.62 0.19 -0.06 0.00 -2.08 0.00 0.00 39.78 38.46 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 0.18 -0.72 -4.53 5.85 -1.97 -1.93 115.31 112.19 3n4f h LEU 214 Ca -0.09 -0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.39 3n4f h LEU 214 Cb 0.31 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 3n4f h LEU 214 CO 0.14 0.31 0.21 0.78 -0.34 0.00 0.00 178.44 179.54 3n4f h ASN 215 N 0.04 1.07 -0.89 1.25 2.35 -1.99 -0.55 115.58 116.85 3n4f h ASN 215 Ca 0.04 -0.22 0.03 0.00 -0.55 0.00 0.00 56.30 55.60 3n4f h ASN 215 Cb 0.19 -0.28 -0.05 0.00 0.05 0.00 0.00 38.32 38.23 3n4f h ASN 215 CO -0.00 1.01 0.58 -0.07 -1.65 0.00 0.00 177.43 177.30 3n4f h LEU 216 N 1.08 0.98 -0.07 1.61 3.38 -1.96 -0.90 115.31 119.43 3n4f h LEU 216 Ca 0.23 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 3n4f h LEU 216 Cb 0.34 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3n4f h LEU 216 CO -0.00 0.68 0.02 0.74 0.09 0.00 0.00 178.44 179.97 3n4f h THR 217 N 1.14 1.16 -0.97 0.22 2.02 -0.96 -0.75 112.91 114.77 3n4f h THR 217 Ca 0.35 -0.48 0.07 0.00 0.77 0.00 0.00 66.41 67.11 3n4f h THR 217 Cb -0.03 1.36 -0.07 0.00 -1.74 0.00 0.00 68.15 67.68 3n4f h THR 217 CO -0.11 0.14 0.62 0.11 0.37 0.00 0.00 175.52 176.65 3n4f h LYS 218 N -0.07 1.09 -0.82 6.66 1.57 -1.02 -0.66 116.57 123.32 3n4f h LYS 218 Ca 0.02 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3n4f h LYS 218 Cb 0.20 -0.25 -0.04 0.00 0.08 0.00 0.00 32.23 32.23 3n4f h LYS 218 CO -0.00 0.72 0.35 1.49 -0.57 0.00 0.00 179.45 181.44 3n4f h GLU 219 N 1.12 1.21 -0.03 3.15 4.81 -0.81 -0.85 114.58 123.19 3n4f h GLU 219 Ca 0.42 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 3n4f h GLU 219 Cb 0.18 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.35 3n4f h GLU 219 CO -0.18 0.96 -0.07 0.28 -0.73 0.00 0.00 179.01 179.27 3n4f h VAL 220 N 1.19 1.46 -1.00 0.32 2.07 -0.85 -2.35 116.25 117.09 3n4f h VAL 220 Ca 0.28 -1.48 0.07 0.00 0.82 0.00 0.00 66.70 66.39 3n4f h VAL 220 Cb 0.19 2.38 -0.07 0.00 -1.52 0.00 0.00 31.29 32.27 3n4f h VAL 220 CO -0.03 0.40 0.65 -0.07 0.02 0.00 0.00 177.57 178.54 3n4f h LEU 221 N -0.47 1.02 -0.58 2.57 3.38 -1.10 -1.08 115.31 119.05 3n4f h LEU 221 Ca -0.00 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3n4f h LEU 221 Cb 0.69 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3n4f h LEU 221 CO 0.02 0.63 0.17 0.00 0.09 0.00 0.00 178.44 179.35 3n4f h ALA 222 N 1.47 0.76 0.00 1.53 0.00 -1.14 -2.53 119.26 119.34 3n4f h ALA 222 Ca 0.44 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3n4f h ALA 222 Cb 0.22 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3n4f h ALA 222 CO -0.19 0.44 0.00 0.00 0.00 0.00 0.00 179.25 179.50 3n4f h ALA 223 N 1.04 1.00 -0.53 0.00 0.00 -0.84 -2.90 119.26 117.03 3n4f h ALA 223 Ca 0.18 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 3n4f h ALA 223 Cb 0.31 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.98 3n4f h ALA 223 CO -0.00 0.00 0.14 1.28 0.00 0.00 0.00 179.25 180.67 3n4f n LEU 224 N -2.87 4.98 0.19 0.00 4.77 -0.47 -4.69 117.00 118.92 3n4f n LEU 224 Ca 0.00 -3.41 0.12 0.00 -0.03 0.00 0.00 56.01 52.69 3n4f n LEU 224 Cb 0.25 -0.67 0.67 0.00 -2.33 0.00 0.00 43.42 41.34 3n4f n LEU 224 CO 0.24 0.96 1.11 -1.28 -1.33 0.00 0.00 177.39 177.09 3n4f h SER 225 N 1.67 0.00 1.06 -1.43 0.87 -1.33 -1.94 113.55 112.45 3n4f h SER 225 Ca 0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 3n4f h SER 225 Cb 1.97 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.93 3n4f h SER 225 CO 0.55 0.00 -0.45 0.44 -0.53 0.00 0.00 176.83 176.84 3n4f h ASP 226 N 0.00 0.00 -4.07 6.23 3.32 -1.87 -3.48 116.42 116.55 3n4f h ASP 226 Ca 0.07 -0.15 -0.47 0.00 0.02 0.00 0.00 57.03 56.50 3n4f h ASP 226 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 3n4f h ASP 226 CO -0.00 0.07 0.31 -0.69 -1.72 0.00 0.00 179.24 177.22 3n4f s VAL 227 N -3.15 4.55 -1.14 -1.35 1.01 -0.73 -4.94 120.40 114.64 3n4f s VAL 227 Ca 0.07 1.17 -0.08 0.00 0.00 0.00 0.00 61.98 63.15 3n4f s VAL 227 Cb 0.13 -3.69 -0.09 0.00 0.00 0.00 0.00 36.38 32.73 3n4f s VAL 227 CO 0.69 -0.56 2.63 -3.20 0.00 0.00 0.00 175.10 174.65 3n4f n ASN 228 N -1.27 6.66 -4.59 3.32 5.15 -1.26 -4.92 115.26 118.34 3n4f n ASN 228 Ca 0.06 -2.43 -0.42 0.00 -0.60 0.00 0.00 54.58 51.18 3n4f n ASN 228 Cb 0.54 -1.32 -0.02 0.00 -0.53 0.00 0.00 39.78 38.45 3n4f n ASN 228 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3n4f s LEU 229 N 0.12 3.51 -0.15 1.20 2.96 -1.26 -2.68 118.68 122.37 3n4f s LEU 229 Ca 0.56 0.46 -0.22 0.00 -0.22 0.00 0.00 54.13 54.70 3n4f s LEU 229 Cb 0.16 -3.31 -0.20 0.00 0.50 0.00 0.00 46.19 43.34 3n4f s LEU 229 CO -0.04 -1.51 0.50 0.22 -1.32 0.00 0.00 176.35 174.19 3n4f h TYR 230 N 10.42 0.00 -4.17 5.38 3.20 -0.42 -3.40 116.97 127.99 3n4f h TYR 230 Ca -0.26 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.49 3n4f h TYR 230 Cb 1.09 0.00 -0.15 0.00 1.54 0.00 0.00 36.73 39.21 3n4f h TYR 230 CO 1.00 0.93 -0.59 1.67 -1.64 0.00 0.00 178.16 179.53 3n4f s TRP 231 N -2.16 0.50 -0.18 -3.82 -2.14 -1.25 -2.05 118.94 107.84 3n4f s TRP 231 Ca -0.18 -0.98 -0.02 0.00 2.66 0.00 0.00 56.10 57.57 3n4f s TRP 231 Cb -0.00 -0.32 -0.01 0.00 -3.10 0.00 0.00 33.47 30.04 3n4f s TRP 231 CO 0.55 -0.46 -0.09 -1.17 -2.66 0.00 0.00 176.95 173.12 3n4f s LEU 232 N -2.94 2.76 -0.12 -4.66 2.96 0.56 -1.93 118.68 115.32 3n4f s LEU 232 Ca 0.10 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 53.63 3n4f s LEU 232 Cb 0.07 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 45.07 3n4f s LEU 232 CO -0.07 0.05 -0.12 -0.70 -1.32 0.00 0.00 176.35 174.19 3n4f s GLU 233 N 1.02 3.25 -1.24 1.98 2.12 0.07 -0.54 118.70 125.36 3n4f s GLU 233 Ca -0.00 -0.67 -0.30 0.00 0.36 0.00 0.00 54.97 54.36 3n4f s GLU 233 Cb -0.15 -2.61 0.04 0.00 0.26 0.00 0.00 34.13 31.67 3n4f s GLU 233 CO -0.01 0.30 0.57 0.39 -0.54 0.00 0.00 175.26 175.96 3n4f n GLU 234 N 3.29 -0.31 -0.13 4.30 1.02 -0.88 -2.05 120.64 125.89 3n4f n GLU 234 Ca -0.18 0.04 -0.05 0.00 -0.02 0.00 0.00 57.16 56.95 3n4f n GLU 234 Cb 0.53 -2.51 0.03 0.00 -0.02 0.00 0.00 31.44 29.47 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 1.60 0.50 -2.82 0.62 0.00 -1.86 0.30 119.26 117.60 3n4f h ALA 235 Ca -0.69 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.22 3n4f h ALA 235 Cb 1.37 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 19.07 3n4f h ALA 235 CO 0.53 -0.23 -0.06 -0.59 0.00 0.00 0.00 179.25 178.91 3n4f s PHE 236 N -6.15 0.06 0.22 0.00 -0.71 -1.26 -1.63 117.98 108.51 3n4f s PHE 236 Ca -0.13 -0.41 -0.32 0.00 -1.04 0.00 0.00 56.93 55.03 3n4f s PHE 236 Cb 0.13 0.28 -0.12 0.00 -1.21 0.00 0.00 43.02 42.09 3n4f s PHE 236 CO 0.72 -0.90 1.66 1.58 -1.34 0.00 0.00 175.22 176.94 3n4f n HIS 237 N -0.32 2.66 -1.59 3.49 -0.00 -1.26 -4.78 115.22 113.42 3n4f n HIS 237 Ca -0.08 0.13 -0.55 0.00 -0.00 0.00 0.00 57.72 57.22 3n4f n HIS 237 Cb 0.62 -2.63 -0.07 0.00 -0.00 0.00 0.00 29.99 27.92 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 3.46 0.82 -3.70 1.57 0.00 -1.26 -4.97 120.64 116.55 3n4f n GLU 238 Ca 0.15 0.30 -0.14 0.00 0.00 0.00 0.00 57.16 57.46 3n4f n GLU 238 Cb 0.34 -1.90 -0.14 0.00 0.00 0.00 0.00 31.44 29.73 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 0.80 0.21 0.17 -1.84 -1.08 -1.26 -4.92 116.67 108.75 3n4f s ASP 239 Ca 0.88 0.40 -0.13 0.00 -0.52 0.00 0.00 52.55 53.18 3n4f s ASP 239 Cb -1.07 0.34 0.06 0.00 -1.46 0.00 0.00 42.92 40.79 3n4f s ASP 239 CO 0.53 -0.20 1.75 -0.08 0.52 0.00 0.00 175.17 177.69 3n4f h GLU 240 N 7.77 0.78 -0.35 4.34 4.81 -1.99 -1.22 114.58 128.72 3n4f h GLU 240 Ca -0.28 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 58.81 3n4f h GLU 240 Cb 1.13 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 3n4f h GLU 240 CO 0.28 0.64 0.11 0.00 -0.73 0.00 0.00 179.01 179.30 3n4f h ALA 241 N 1.10 0.47 -0.56 2.92 0.00 -1.99 -0.85 119.26 120.35 3n4f h ALA 241 Ca 0.19 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3n4f h ALA 241 Cb 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3n4f h ALA 241 CO -0.02 0.11 0.08 -0.07 0.00 0.00 0.00 179.25 179.34 3n4f h LEU 242 N 0.42 0.91 -0.93 0.00 3.38 -1.96 -1.76 115.31 115.37 3n4f h LEU 242 Ca 0.11 -0.27 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 3n4f h LEU 242 Cb 0.26 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3n4f h LEU 242 CO -0.00 0.94 -0.53 1.88 0.09 0.00 0.00 178.44 180.82 3n4f h TYR 243 N 0.83 0.00 0.11 1.13 0.05 -1.17 -0.87 116.97 117.06 3n4f h TYR 243 Ca 0.17 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.94 3n4f h TYR 243 Cb 0.43 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.17 3n4f h TYR 243 CO 0.03 0.53 -0.05 1.49 -1.05 0.00 0.00 178.16 179.11 3n4f h GLU 244 N 0.00 -0.14 -0.19 4.88 4.81 -0.87 -1.33 114.58 121.73 3n4f h GLU 244 Ca -0.01 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.28 3n4f h GLU 244 Cb 0.95 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.32 3n4f h GLU 244 CO 0.07 0.07 -0.09 0.22 -0.73 0.00 0.00 179.01 178.55 3n4f h ASP 245 N -0.34 -0.29 -0.27 1.04 1.82 -1.27 -1.84 116.42 115.26 3n4f h ASP 245 Ca -0.02 0.07 0.05 0.00 -0.39 0.00 0.00 57.03 56.75 3n4f h ASP 245 Cb 0.28 0.17 -0.05 0.00 0.68 0.00 0.00 39.33 40.41 3n4f h ASP 245 CO 0.03 -0.11 -0.07 0.25 -1.61 0.00 0.00 179.24 177.72 3n4f h LEU 246 N -0.06 -0.27 -0.64 2.28 5.85 -1.12 -0.92 115.31 120.43 3n4f h LEU 246 Ca 0.10 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.97 3n4f h LEU 246 Cb 0.22 0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.37 3n4f h LEU 246 CO -0.23 -0.10 0.35 0.11 -0.34 0.00 0.00 178.44 178.23 3n4f h LYS 247 N -0.01 0.62 -0.45 1.25 1.79 -1.04 0.71 116.57 119.44 3n4f h LYS 247 Ca 0.13 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.55 3n4f h LYS 247 Cb 0.21 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.70 3n4f h LYS 247 CO -0.28 0.41 0.23 1.49 -1.08 0.00 0.00 179.45 180.22 3n4f h GLU 248 N 0.64 0.64 -0.71 3.15 4.81 -1.02 -0.51 114.58 121.59 3n4f h GLU 248 Ca 0.29 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 3n4f h GLU 248 Cb 0.19 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 3n4f h GLU 248 CO -0.18 0.53 0.28 2.35 -0.73 0.00 0.00 179.01 181.26 3n4f h TRP 249 N 0.59 1.07 -0.39 0.92 7.01 -0.66 -0.13 115.95 124.37 3n4f h TRP 249 Ca 0.16 -0.08 -0.04 0.00 2.11 0.00 0.00 58.89 61.04 3n4f h TRP 249 Cb 0.09 -0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 26.81 3n4f h TRP 249 CO -0.01 0.83 0.10 -0.07 -2.79 0.00 0.00 178.44 176.49 3n4f h LEU 250 N 1.01 0.59 0.30 0.65 3.38 -0.59 -2.65 115.31 118.00 3n4f h LEU 250 Ca 0.24 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3n4f h LEU 250 Cb 0.21 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3n4f h LEU 250 CO -0.02 0.67 -0.21 1.23 0.09 0.00 0.00 178.44 180.19 3n4f h GLY 251 N 0.49 -0.53 -0.08 0.83 0.00 -0.81 -1.55 103.07 101.42 3n4f h GLY 251 Ca 0.12 0.24 0.28 0.00 0.00 0.00 0.00 47.33 47.97 3n4f h GLY 251 CO 0.00 -0.21 0.71 1.46 0.00 0.00 0.00 176.54 178.50 3n4f h GLN 252 N -0.51 0.19 0.00 4.80 1.08 -0.98 -0.39 115.11 119.29 3n4f h GLN 252 Ca -0.02 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 3n4f h GLN 252 Cb 0.44 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 3n4f h GLN 252 CO 0.01 0.12 -0.50 0.54 -0.95 0.00 0.00 178.83 178.05 3n4f n ARG 253 N -4.40 0.03 -1.85 1.46 1.74 -0.95 -4.94 116.66 107.74 3n4f n ARG 253 Ca 0.23 0.01 -0.16 0.00 -0.77 0.00 0.00 57.85 57.16 3n4f n ARG 253 Cb 0.99 -1.52 -0.04 0.00 -1.02 0.00 0.00 32.46 30.87 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 1.48 0.75 3.55 -0.13 0.00 -0.16 -4.98 105.19 105.71 3n4f n GLY 254 Ca 0.05 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 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 -4.03 3.55 -1.24 1.61 0.74 -0.65 -5.00 119.66 114.65 3n4f s GLN 255 Ca 0.00 -0.18 -0.07 0.00 0.05 0.00 0.00 55.36 55.17 3n4f s GLN 255 Cb 0.00 -3.84 0.19 0.00 1.10 0.00 0.00 33.01 30.46 3n4f s GLN 255 CO 0.00 -0.73 1.95 0.09 -0.55 0.00 0.00 175.29 176.05 3n4f n ASN 256 N 5.88 6.32 -4.46 6.67 5.03 -1.26 -4.57 115.26 128.87 3n4f n ASN 256 Ca -0.04 -3.22 -0.34 0.00 0.87 0.00 0.00 54.58 51.85 3n4f n ASN 256 Cb 0.49 -1.38 -0.12 0.00 -1.02 0.00 0.00 39.78 37.74 3n4f n ASN 256 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3n4f s VAL 257 N -0.97 3.90 0.48 2.41 1.01 -1.26 -4.82 120.40 121.14 3n4f s VAL 257 Ca 0.42 -0.34 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 3n4f s VAL 257 Cb 0.12 -2.74 -0.08 0.00 0.00 0.00 0.00 36.38 33.68 3n4f s VAL 257 CO -0.01 0.45 1.05 -0.76 0.00 0.00 0.00 175.10 175.83 3n4f s LEU 258 N 0.76 3.88 -0.24 3.92 1.43 -0.87 -4.86 118.68 122.70 3n4f s LEU 258 Ca -0.01 1.98 -0.10 0.00 -1.03 0.00 0.00 54.13 54.98 3n4f s LEU 258 Cb -0.14 -4.50 -0.05 0.00 0.03 0.00 0.00 46.19 41.53 3n4f s LEU 258 CO 0.02 -0.79 0.15 -0.63 0.23 0.00 0.00 176.35 175.33 3n4f s ILE 259 N -1.90 5.20 0.02 -0.59 -1.09 -1.26 -0.32 121.20 121.26 3n4f s ILE 259 Ca 0.66 0.12 0.09 0.00 -2.23 0.00 0.00 60.65 59.29 3n4f s ILE 259 Cb -0.18 -3.43 -0.03 0.00 -1.58 0.00 0.00 42.46 37.25 3n4f s ILE 259 CO 0.22 0.34 -0.26 0.00 -1.23 0.00 0.00 174.94 174.01 3n4f s ALA 260 N 1.17 2.17 0.02 9.38 0.00 0.29 -0.81 121.76 133.98 3n4f s ALA 260 Ca 0.07 -1.20 -0.29 0.00 0.00 0.00 0.00 51.96 50.54 3n4f s ALA 260 Cb -0.14 -0.48 0.10 0.00 0.00 0.00 0.00 23.12 22.60 3n4f s ALA 260 CO 0.05 0.52 1.15 0.34 0.00 0.00 0.00 175.76 177.81 3n4f s ASP 261 N -1.03 -0.12 0.00 0.00 -1.08 -0.55 -2.07 116.67 111.81 3n4f s ASP 261 Ca 0.11 -0.20 0.00 0.00 -0.52 0.00 0.00 52.55 51.94 3n4f s ASP 261 Cb -0.10 0.28 0.00 0.00 -1.46 0.00 0.00 42.92 41.64 3n4f s ASP 261 CO 0.01 -0.51 0.00 0.61 0.52 0.00 0.00 175.17 175.80 3n4f n GLY 262 N -0.43 1.22 3.75 2.66 0.00 -1.26 -1.08 105.19 110.05 3n4f n GLY 262 Ca -0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 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 1.70 5.33 1.61 -1.05 -1.22 -4.05 118.70 121.01 3n4f s GLU 263 Ca 0.00 0.82 0.00 0.00 -0.15 0.00 0.00 54.97 55.64 3n4f s GLU 263 Cb 0.00 -1.86 0.00 0.00 -0.44 0.00 0.00 34.13 31.83 3n4f s GLU 263 CO 0.00 -1.94 0.00 0.41 0.95 0.00 0.00 175.26 174.68 3n4f n GLY 264 N -1.45 2.18 3.47 -3.83 0.00 -1.26 -4.13 105.19 100.17 3n4f n GLY 264 Ca 0.07 -0.53 -0.44 0.00 0.00 0.00 0.00 46.02 45.12 3n4f n GLY 264 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3n4f s LEU 265 N 0.00 4.93 0.63 0.99 1.02 -1.26 -4.98 118.68 120.01 3n4f s LEU 265 Ca 0.00 -2.77 -0.15 0.00 0.02 0.00 0.00 54.13 51.23 3n4f s LEU 265 Cb 0.00 -2.42 -0.02 0.00 0.02 0.00 0.00 46.19 43.78 3n4f s LEU 265 CO 0.00 -0.84 1.08 0.00 0.02 0.00 0.00 176.35 176.61 3n4f s ALA 266 N 2.02 2.61 0.36 4.21 0.00 -1.26 -4.98 121.76 124.72 3n4f s ALA 266 Ca 0.42 0.44 -0.29 0.00 0.00 0.00 0.00 51.96 52.53 3n4f s ALA 266 Cb -0.03 -3.27 -0.11 0.00 0.00 0.00 0.00 23.12 19.72 3n4f s ALA 266 CO -0.01 -1.05 1.53 0.45 0.00 0.00 0.00 175.76 176.68 3n4f s SER 267 N -2.77 6.32 0.65 0.00 0.15 -1.26 -4.88 113.70 111.91 3n4f s SER 267 Ca 0.65 3.05 0.42 0.00 0.70 0.00 0.00 55.95 60.77 3n4f s SER 267 Cb -0.18 -2.66 2.25 0.00 -1.71 0.00 0.00 66.02 63.72 3n4f s SER 267 CO 0.40 -0.91 2.32 -0.65 1.20 0.00 0.00 173.24 175.60 3n4f h PRO 268 N 3.48 0.00 -0.64 5.44 0.11 -2.01 -2.44 132.00 135.94 3n4f h PRO 268 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3n4f h PRO 268 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3n4f h PRO 268 CO 0.68 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 179.20 3n4f n HIS 269 N -3.15 1.04 -0.15 0.65 8.25 -1.26 -4.67 115.22 115.93 3n4f n HIS 269 Ca -0.03 -0.54 -0.05 0.00 -0.26 0.00 0.00 57.72 56.84 3n4f n HIS 269 Cb 0.10 -0.08 0.04 0.00 1.12 0.00 0.00 29.99 31.17 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 3.83 0.30 -0.48 2.41 5.85 -1.81 -1.67 115.31 123.73 3n4f h LEU 270 Ca 0.00 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3n4f h LEU 270 Cb 1.09 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 3n4f h LEU 270 CO 0.07 0.21 0.24 0.40 -0.34 0.00 0.00 178.44 179.02 3n4f h ILE 271 N 0.43 1.18 -0.53 4.05 1.08 -1.85 -0.71 117.51 121.17 3n4f h ILE 271 Ca 0.20 -0.51 0.06 0.00 -0.39 0.00 0.00 64.86 64.23 3n4f h ILE 271 Cb 0.13 0.63 -0.05 0.00 -3.07 0.00 0.00 36.82 34.46 3n4f h ILE 271 CO -0.16 0.20 0.23 -0.08 -0.69 0.00 0.00 178.15 177.66 3n4f h GLU 272 N 0.64 0.43 -0.24 2.37 4.81 -1.80 -0.38 114.58 120.41 3n4f h GLU 272 Ca 0.17 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.38 3n4f h GLU 272 Cb 0.10 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 3n4f h GLU 272 CO -0.02 0.29 0.14 -1.49 -0.73 0.00 0.00 179.01 177.19 3n4f h TRP 273 N 0.45 0.26 -0.63 0.92 6.55 -0.75 -2.16 115.95 120.59 3n4f h TRP 273 Ca 0.25 0.01 0.12 0.00 0.95 0.00 0.00 58.89 60.22 3n4f h TRP 273 Cb 0.22 -0.08 -0.09 0.00 -0.86 0.00 0.00 29.16 28.34 3n4f h TRP 273 CO -0.13 0.16 0.12 0.00 -1.05 0.00 0.00 178.44 177.54 3n4f h ALA 274 N 1.11 0.74 0.00 1.49 0.00 -0.74 -0.78 119.26 121.07 3n4f h ALA 274 Ca 0.09 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 3n4f h ALA 274 Cb -0.01 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3n4f h ALA 274 CO -0.04 -0.32 -0.01 1.79 0.00 0.00 0.00 179.25 180.66 3n4f h THR 275 N 0.25 0.10 -0.34 0.00 1.35 -0.44 -0.11 112.91 113.73 3n4f h THR 275 Ca 0.33 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 66.02 3n4f h THR 275 Cb 0.52 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.09 3n4f h THR 275 CO -0.44 0.01 0.00 0.54 -0.25 0.00 0.00 175.52 175.39 3n4f n ARG 276 N -3.20 2.19 -0.47 4.72 1.74 -0.34 -4.95 116.66 116.34 3n4f n ARG 276 Ca -0.02 -1.80 0.00 0.00 -0.77 0.00 0.00 57.85 55.26 3n4f n ARG 276 Cb 0.14 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 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 1.35 0.75 0.10 -0.13 0.00 -0.05 -4.97 105.19 102.23 3n4f n GLY 277 Ca 0.18 -0.15 -0.03 0.00 0.00 0.00 0.00 46.02 46.03 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 1.85 0.00 -3.98 1.61 2.47 -1.59 -3.46 114.38 111.28 3n4f h ARG 278 Ca 0.00 0.00 -0.30 0.00 -1.26 0.00 0.00 59.98 58.42 3n4f h ARG 278 Cb 0.00 0.00 -0.30 0.00 -1.65 0.00 0.00 29.97 28.02 3n4f h ARG 278 CO 0.00 0.74 -0.74 0.08 0.56 0.00 0.00 179.97 180.61 3n4f s VAL 279 N -2.83 0.22 -0.20 2.04 1.01 -1.26 -4.76 120.40 114.62 3n4f s VAL 279 Ca 0.02 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 61.98 3n4f s VAL 279 Cb 0.09 -0.22 -0.16 0.00 0.00 0.00 0.00 36.38 36.09 3n4f s VAL 279 CO 0.79 0.09 -0.12 0.47 0.00 0.00 0.00 175.10 176.32 3n4f n ASP 280 N 3.27 1.90 -4.03 3.32 8.00 0.01 -4.47 116.55 124.56 3n4f n ASP 280 Ca -0.16 -0.08 -0.30 0.00 0.71 0.00 0.00 54.79 54.95 3n4f n ASP 280 Cb 0.57 0.02 -0.16 0.00 -0.02 0.00 0.00 41.12 41.52 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 -2.42 1.61 -0.17 2.53 1.01 -0.50 -1.75 120.40 120.71 3n4f s VAL 281 Ca -0.23 -0.66 -0.13 0.00 0.00 0.00 0.00 61.98 60.96 3n4f s VAL 281 Cb 0.07 -1.50 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 3n4f s VAL 281 CO 0.55 0.47 0.25 -0.76 0.00 0.00 0.00 175.10 175.61 3n4f s LEU 282 N 1.44 4.24 -0.25 3.92 2.01 -0.59 -1.49 118.68 127.97 3n4f s LEU 282 Ca 0.04 0.44 0.10 0.00 0.01 0.00 0.00 54.13 54.72 3n4f s LEU 282 Cb -0.13 -2.30 0.44 0.00 0.01 0.00 0.00 46.19 44.21 3n4f s LEU 282 CO -0.10 0.13 1.25 0.00 1.01 0.00 0.00 176.35 178.64 3n4f n GLN 283 N 3.49 2.13 -1.70 1.70 6.02 -0.24 -0.86 117.38 127.91 3n4f n GLN 283 Ca -0.13 -3.51 -0.41 0.00 -0.01 0.00 0.00 57.00 52.94 3n4f n GLN 283 Cb 0.52 -1.81 0.01 0.00 1.02 0.00 0.00 30.24 29.98 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 -1.02 2.17 -1.92 1.08 4.01 -1.26 -2.81 117.16 117.41 3n4f n TYR 284 Ca 0.27 0.51 -0.41 0.00 -0.16 0.00 0.00 57.90 58.11 3n4f n TYR 284 Cb 0.80 -2.38 -0.01 0.00 -0.31 0.00 0.00 39.34 37.44 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 -0.50 6.48 0.61 7.72 2.15 -1.23 -2.31 116.67 129.59 3n4f s ASP 285 Ca 0.60 2.91 0.39 0.00 0.43 0.00 0.00 52.55 56.88 3n4f s ASP 285 Cb -0.51 -2.66 1.92 0.00 -0.30 0.00 0.00 42.92 41.36 3n4f s ASP 285 CO 0.59 -0.76 2.19 -0.29 -0.17 0.00 0.00 175.17 176.72 3n4f h ILE 286 N 2.96 0.02 0.00 4.11 6.09 -1.50 -3.09 117.51 126.10 3n4f h ILE 286 Ca -0.50 -0.25 -0.37 0.00 -1.37 0.00 0.00 64.86 62.37 3n4f h ILE 286 Cb 1.24 1.25 -0.06 0.00 0.47 0.00 0.00 36.82 39.71 3n4f h ILE 286 CO 0.64 0.00 -2.34 -0.38 -3.07 0.00 0.00 178.15 173.00 3n4f n ILE 287 N -3.10 1.34 -3.72 2.19 2.08 -1.26 -3.57 119.36 113.31 3n4f n ILE 287 Ca -0.01 -0.48 -0.28 0.00 0.56 0.00 0.00 62.75 62.54 3n4f n ILE 287 Cb 0.18 -1.44 -0.16 0.00 -0.75 0.00 0.00 39.64 37.47 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 -2.46 0.99 -1.41 1.39 -0.00 -1.21 -2.44 118.94 113.80 3n4f s TRP 288 Ca -0.32 -0.87 0.29 0.00 -0.00 0.00 0.00 56.10 55.20 3n4f s TRP 288 Cb 0.09 -1.04 1.35 0.00 -0.00 0.00 0.00 33.47 33.87 3n4f s TRP 288 CO 0.52 -0.63 1.95 -0.35 -0.00 0.00 0.00 176.95 178.44 3n4f n PRO 289 N 5.06 0.42 0.00 5.86 -0.04 -1.20 -3.51 135.00 141.59 3n4f n PRO 289 Ca -0.08 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 3n4f n PRO 289 Cb 0.47 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 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 1.32 -2.76 0.08 0.55 0.00 -1.02 -4.49 105.19 98.87 3n4f n GLY 290 Ca 0.13 -1.97 -0.14 0.00 0.00 0.00 0.00 46.02 44.04 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 0.13 -0.37 1.61 3.57 -1.84 -0.73 116.94 119.30 3n4f h PHE 291 Ca 0.00 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.44 3n4f h PHE 291 Cb 0.00 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 3n4f h PHE 291 CO 0.00 0.75 0.21 1.15 -2.23 0.00 0.00 178.31 178.19 3n4f h THR 292 N -0.53 1.14 -0.90 4.41 2.02 -1.94 -2.18 112.91 114.93 3n4f h THR 292 Ca -0.01 -0.36 0.04 0.00 0.77 0.00 0.00 66.41 66.85 3n4f h THR 292 Cb 0.76 0.71 -0.05 0.00 -1.74 0.00 0.00 68.15 67.83 3n4f h THR 292 CO 0.02 0.15 0.59 -0.74 0.37 0.00 0.00 175.52 175.91 3n4f h HIS 293 N 0.47 1.08 0.00 3.16 -0.00 -1.78 -3.00 115.15 115.08 3n4f h HIS 293 Ca 0.13 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.53 3n4f h HIS 293 Cb 0.05 -0.36 0.00 0.00 -0.00 0.00 0.00 27.41 27.10 3n4f h HIS 293 CO -0.03 0.61 0.00 0.91 -0.00 0.00 0.00 177.93 179.42 3n4f n TRP 294 N -4.45 0.00 0.00 5.26 7.02 -0.28 -1.02 117.44 123.96 3n4f n TRP 294 Ca 0.12 -0.37 0.00 0.00 -1.02 0.00 0.00 57.50 56.23 3n4f n TRP 294 Cb 0.13 -0.29 0.00 0.00 -2.42 0.00 0.00 31.31 28.72 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 1.43 0.00 -0.11 -0.99 1.02 -1.14 0.21 120.64 121.06 3n4f n GLU 296 Ca 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 3n4f n GLU 296 Cb 0.22 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.61 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 0.55 -0.62 -4.62 5.85 -1.37 -2.65 115.31 112.46 3n4f h LEU 297 Ca 0.00 -0.31 0.09 0.00 0.84 0.00 0.00 57.88 58.49 3n4f h LEU 297 Cb 0.00 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 40.81 3n4f h LEU 297 CO 0.00 0.73 0.26 1.23 -0.34 0.00 0.00 178.44 180.32 3n4f h GLY 298 N 0.36 0.88 0.57 3.75 0.00 -0.49 0.27 103.07 108.41 3n4f h GLY 298 Ca 0.09 -0.15 0.04 0.00 0.00 0.00 0.00 47.33 47.30 3n4f h GLY 298 CO 0.02 0.02 -0.11 -2.09 0.00 0.00 0.00 176.54 174.38 3n4f h GLU 299 N 0.47 -0.12 -0.59 4.80 4.81 -1.77 0.12 114.58 122.30 3n4f h GLU 299 Ca 0.30 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.51 3n4f h GLU 299 Cb 0.33 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 3n4f h GLU 299 CO -0.27 -0.08 0.26 -0.22 -0.73 0.00 0.00 179.01 177.97 3n4f h LYS 300 N -0.12 0.88 -0.32 1.92 3.64 -0.92 -1.67 116.57 119.99 3n4f h LYS 300 Ca 0.08 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 3n4f h LYS 300 Cb 0.24 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3n4f h LYS 300 CO -0.20 0.73 0.05 -0.07 -2.27 0.00 0.00 179.45 177.70 3n4f h LEU 301 N 0.82 0.50 -0.82 5.20 3.38 -0.26 -2.57 115.31 121.56 3n4f h LEU 301 Ca 0.20 -0.26 0.15 0.00 0.09 0.00 0.00 57.88 58.06 3n4f h LEU 301 Cb 0.17 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.69 3n4f h LEU 301 CO -0.02 0.63 0.40 0.44 0.09 0.00 0.00 178.44 179.98 3n4f h ASP 302 N 0.35 0.45 0.06 -0.43 3.32 -0.64 0.64 116.42 120.17 3n4f h ASP 302 Ca 0.10 0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 3n4f h ASP 302 Cb 0.34 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.92 3n4f h ASP 302 CO 0.01 0.18 -0.05 0.00 -1.72 0.00 0.00 179.24 177.66 3n4f h ALA 303 N 1.55 1.86 -0.25 3.45 0.00 -0.90 -1.53 119.26 123.44 3n4f h ALA 303 Ca 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3n4f h ALA 303 Cb 0.65 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3n4f h ALA 303 CO -0.37 0.07 0.00 0.72 0.00 0.00 0.00 179.25 179.66 3n4f n HIS 304 N -4.40 0.31 -1.95 0.00 8.25 -0.78 -4.96 115.22 111.69 3n4f n HIS 304 Ca -0.03 -0.15 -0.11 0.00 -0.26 0.00 0.00 57.72 57.17 3n4f n HIS 304 Cb 0.14 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.23 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 1.42 0.30 3.95 -1.41 0.00 -0.58 -5.02 105.19 103.85 3n4f n GLY 305 Ca 0.18 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.95 4.02 0.04 0.99 1.43 0.13 -4.99 118.68 117.35 3n4f s LEU 306 Ca 0.00 0.28 0.02 0.00 -1.03 0.00 0.00 54.13 53.40 3n4f s LEU 306 Cb 0.00 -3.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.04 3n4f s LEU 306 CO 0.00 -0.32 0.06 -0.13 0.23 0.00 0.00 176.35 176.19 3n4f s ARG 307 N -4.27 2.88 -0.16 1.70 0.52 -0.72 -4.01 118.95 114.89 3n4f s ARG 307 Ca 0.40 -0.63 -0.01 0.00 -0.52 0.00 0.00 55.73 54.97 3n4f s ARG 307 Cb -0.09 -2.73 -0.01 0.00 0.52 0.00 0.00 34.95 32.63 3n4f s ARG 307 CO 0.34 0.60 -0.10 -1.12 0.02 0.00 0.00 175.30 175.04 3n4f s SER 308 N -2.03 4.10 -0.41 0.23 0.01 -0.18 -1.55 113.70 113.86 3n4f s SER 308 Ca 0.25 -0.35 0.05 0.00 1.31 0.00 0.00 55.95 57.21 3n4f s SER 308 Cb -0.12 -1.65 0.18 0.00 0.21 0.00 0.00 66.02 64.64 3n4f s SER 308 CO 0.17 0.10 0.37 0.00 0.41 0.00 0.00 173.24 174.30 3n4f n ALA 309 N 3.95 2.64 -1.67 1.44 0.00 -0.04 -0.66 120.51 126.17 3n4f n ALA 309 Ca -0.18 -3.06 -0.46 0.00 0.00 0.00 0.00 53.44 49.74 3n4f n ALA 309 Cb 0.52 -0.78 -0.04 0.00 0.00 0.00 0.00 19.45 19.14 3n4f n ALA 309 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3n4f n PRO 310 N 2.69 2.12 -1.77 0.00 -0.02 -1.26 -4.22 135.00 132.53 3n4f n PRO 310 Ca 0.29 0.76 -0.41 0.00 -2.02 0.00 0.00 63.50 62.12 3n4f n PRO 310 Cb 0.49 -2.54 -0.01 0.00 -0.02 0.00 0.00 33.50 31.42 3n4f n PRO 310 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3n4f s HIS 311 N 1.26 2.71 -0.22 6.00 5.65 -0.98 -4.53 115.29 125.18 3n4f s HIS 311 Ca 0.81 0.83 -0.04 0.00 0.25 0.00 0.00 55.06 56.91 3n4f s HIS 311 Cb -0.69 -4.08 0.11 0.00 -1.18 0.00 0.00 32.58 26.74 3n4f s HIS 311 CO 0.40 -3.55 0.28 0.00 -0.65 0.00 0.00 174.74 171.22 3n4f s TYR 313 N 2.40 -0.89 0.00 0.00 5.04 -1.26 -4.78 117.35 117.86 3n4f s TYR 313 Ca 0.09 1.92 0.00 0.00 -2.44 0.00 0.00 57.07 56.64 3n4f s TYR 313 Cb -0.16 0.46 0.00 0.00 0.35 0.00 0.00 41.96 42.61 3n4f s TYR 313 CO -0.13 -0.43 0.00 0.41 -1.34 0.00 0.00 175.55 174.05 3n4f n GLY 314 N 3.50 0.70 2.79 8.97 0.00 -1.26 -5.00 105.19 114.88 3n4f n GLY 314 Ca -0.17 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.88 1.43 0.39 1.61 3.84 -1.26 -4.69 114.94 113.38 3n4f s ASN 315 Ca 0.00 -0.75 0.10 0.00 0.21 0.00 0.00 52.86 52.42 3n4f s ASN 315 Cb 0.00 0.61 0.88 0.00 -0.55 0.00 0.00 41.25 42.19 3n4f s ASN 315 CO 0.00 -0.37 1.93 0.00 -2.79 0.00 0.00 177.10 175.86 3n4f h ALA 316 N 8.16 1.89 -0.97 1.71 0.00 -1.95 -2.44 119.26 125.66 3n4f h ALA 316 Ca -0.11 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.84 3n4f h ALA 316 Cb 1.08 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 3n4f h ALA 316 CO 0.31 -0.06 0.63 -0.92 0.00 0.00 0.00 179.25 179.21 3n4f h TYR 317 N 0.60 1.18 -0.19 0.00 5.03 -1.95 -2.44 116.97 119.20 3n4f h TYR 317 Ca 0.36 0.03 0.06 0.00 2.58 0.00 0.00 58.73 61.76 3n4f h TYR 317 Cb 0.58 -0.39 -0.01 0.00 1.55 0.00 0.00 36.73 38.46 3n4f h TYR 317 CO -0.00 0.66 0.20 0.78 -1.32 0.00 0.00 178.16 178.48 3n4f h GLY 318 N 1.20 0.00 0.79 1.82 0.00 -1.83 -2.22 103.07 102.83 3n4f h GLY 318 Ca 0.40 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.74 3n4f h GLY 318 CO -0.14 0.00 -0.05 -2.22 0.00 0.00 0.00 176.54 174.13 3n4f h ILE 319 N 0.00 0.84 -0.06 2.60 2.04 -1.58 -0.54 117.51 120.81 3n4f h ILE 319 Ca 0.09 0.00 -0.21 0.00 1.00 0.00 0.00 64.86 65.74 3n4f h ILE 319 Cb 0.50 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 3n4f h ILE 319 CO -0.00 0.00 -0.82 1.88 0.00 0.00 0.00 178.15 179.21 3n4f h TYR 320 N -0.07 0.69 -0.40 1.37 0.05 -1.56 -2.69 116.97 114.35 3n4f h TYR 320 Ca 0.04 -0.33 0.04 0.00 0.05 0.00 0.00 58.73 58.54 3n4f h TYR 320 Cb 0.13 -0.10 -0.04 0.00 1.01 0.00 0.00 36.73 37.73 3n4f h TYR 320 CO -0.15 1.12 0.16 0.00 -1.05 0.00 0.00 178.16 178.24 3n4f h ALA 321 N 0.78 0.48 -0.94 3.88 0.00 -1.41 -2.67 119.26 119.38 3n4f h ALA 321 Ca -0.06 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3n4f h ALA 321 Cb 1.43 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.17 3n4f h ALA 321 CO 0.15 -0.23 0.61 0.77 0.00 0.00 0.00 179.25 180.55 3n4f h SER 322 N 0.33 1.02 -0.22 0.00 0.02 -0.91 -1.05 113.55 112.75 3n4f h SER 322 Ca 0.18 -0.01 0.06 0.00 -0.84 0.00 0.00 61.79 61.18 3n4f h SER 322 Cb 0.15 -0.24 -0.07 0.00 0.14 0.00 0.00 62.40 62.38 3n4f h SER 322 CO -0.17 0.71 -0.25 1.23 -1.14 0.00 0.00 176.83 177.20 3n4f h GLY 323 N 1.19 -0.22 1.01 -3.77 0.00 -1.15 -2.32 103.07 97.81 3n4f h GLY 323 Ca 0.37 0.32 -0.07 0.00 0.00 0.00 0.00 47.33 47.95 3n4f h GLY 323 CO -0.11 -0.20 0.08 0.45 0.00 0.00 0.00 176.54 176.75 3n4f h HIS 324 N -0.28 0.97 -0.68 5.60 3.86 -1.26 -2.94 115.15 120.42 3n4f h HIS 324 Ca 0.13 -0.14 0.12 0.00 -1.16 0.00 0.00 60.37 59.32 3n4f h HIS 324 Cb 0.47 -0.26 -0.04 0.00 1.06 0.00 0.00 27.41 28.64 3n4f h HIS 324 CO -0.39 0.86 0.45 1.25 0.86 0.00 0.00 177.93 180.96 3n4f h LEU 325 N 0.79 0.40 -1.20 2.43 5.85 -0.88 -2.36 115.31 120.34 3n4f h LEU 325 Ca 0.16 0.01 0.24 0.00 0.84 0.00 0.00 57.88 59.14 3n4f h LEU 325 Cb 0.42 -0.07 -0.10 0.00 0.37 0.00 0.00 40.66 41.28 3n4f h LEU 325 CO 0.01 0.23 0.63 0.77 -0.34 0.00 0.00 178.44 179.74 3n4f h SER 326 N 0.44 0.57 0.20 1.25 4.64 -1.23 0.17 113.55 119.58 3n4f h SER 326 Ca 0.32 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 3n4f h SER 326 Cb 0.66 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 3n4f h SER 326 CO -0.10 0.13 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 3n4f h ALA 327 N 1.66 1.00 -0.02 5.18 0.00 -1.59 -2.77 119.26 122.72 3n4f h ALA 327 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.51 3n4f h ALA 327 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3n4f h ALA 327 CO -0.36 0.00 -0.14 0.00 0.00 0.00 0.00 179.25 178.75 3n4f n ALA 328 N -1.96 2.78 -3.79 0.00 0.00 0.58 -4.52 120.51 113.60 3n4f n ALA 328 Ca -0.02 -0.66 -0.24 0.00 0.00 0.00 0.00 53.44 52.53 3n4f n ALA 328 Cb 0.11 -0.74 -0.17 0.00 0.00 0.00 0.00 19.45 18.64 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 -2.00 0.63 0.10 0.00 1.01 -1.04 -4.73 120.40 114.37 3n4f s VAL 329 Ca 0.23 -0.06 -0.18 0.00 0.00 0.00 0.00 61.98 61.97 3n4f s VAL 329 Cb 0.18 -0.72 -0.06 0.00 0.00 0.00 0.00 36.38 35.78 3n4f s VAL 329 CO 0.36 0.29 1.64 -0.09 0.00 0.00 0.00 175.10 177.30 3n4f h ARG 330 N 8.09 0.41 -1.24 2.72 2.43 -1.87 -3.22 114.38 121.70 3n4f h ARG 330 Ca -0.26 -0.08 -0.49 0.00 -0.81 0.00 0.00 59.98 58.35 3n4f h ARG 330 Cb 1.13 -0.06 -0.21 0.00 -0.42 0.00 0.00 29.97 30.40 3n4f h ARG 330 CO 0.34 0.46 0.63 0.09 -1.51 0.00 0.00 179.97 179.98 3n4f n ASN 331 N -4.75 6.71 -4.71 -3.80 3.02 -1.26 -4.96 115.26 105.51 3n4f n ASN 331 Ca -0.03 -3.40 -0.42 0.00 -0.03 0.00 0.00 54.58 50.71 3n4f n ASN 331 Cb 0.14 -0.99 -0.03 0.00 -0.61 0.00 0.00 39.78 38.29 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 -2.78 3.40 0.00 3.10 2.19 -1.22 -1.02 117.98 121.66 3n4f s PHE 332 Ca 0.47 1.24 0.00 0.00 0.33 0.00 0.00 56.93 58.97 3n4f s PHE 332 Cb 0.37 -3.47 0.00 0.00 -1.31 0.00 0.00 43.02 38.61 3n4f s PHE 332 CO 0.00 -1.48 0.00 0.39 1.83 0.00 0.00 175.22 175.96 3n4f n GLU 333 N 3.91 0.00 -3.78 10.12 -0.58 0.17 -4.90 120.64 125.58 3n4f n GLU 333 Ca 0.09 0.23 -0.13 0.00 -0.42 0.00 0.00 57.16 56.93 3n4f n GLU 333 Cb 0.46 -0.71 -0.09 0.00 -0.57 0.00 0.00 31.44 30.52 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 -0.93 -0.17 -0.06 -0.32 0.08 -1.26 -4.58 117.98 110.74 3n4f s PHE 334 Ca 0.00 0.28 -0.29 0.00 0.12 0.00 0.00 56.93 57.04 3n4f s PHE 334 Cb 0.00 0.08 -0.02 0.00 -0.57 0.00 0.00 43.02 42.51 3n4f s PHE 334 CO 0.00 -0.35 0.96 0.08 -0.10 0.00 0.00 175.22 175.82 3n4f s VAL 335 N -1.15 4.84 -0.45 -0.44 1.01 0.09 -4.54 120.40 119.76 3n4f s VAL 335 Ca -0.12 1.99 -0.28 0.00 0.00 0.00 0.00 61.98 63.56 3n4f s VAL 335 Cb -0.05 -4.29 0.03 0.00 0.00 0.00 0.00 36.38 32.07 3n4f s VAL 335 CO 0.03 0.09 1.08 -0.70 0.00 0.00 0.00 175.10 175.60 3n4f s GLU 336 N 1.52 3.73 -0.18 2.72 2.12 -1.26 -1.71 118.70 125.63 3n4f s GLU 336 Ca 0.49 0.54 -0.05 0.00 0.36 0.00 0.00 54.97 56.31 3n4f s GLU 336 Cb -0.19 -3.89 -0.03 0.00 0.26 0.00 0.00 34.13 30.28 3n4f s GLU 336 CO 0.22 -1.28 -0.00 -0.47 -0.54 0.00 0.00 175.26 173.19 3n4f s TYR 337 N 4.18 3.07 -0.07 5.30 6.14 -0.05 -4.75 117.35 131.16 3n4f s TYR 337 Ca 0.45 -0.32 0.04 0.00 0.64 0.00 0.00 57.07 57.88 3n4f s TYR 337 Cb -0.08 -2.04 0.00 0.00 0.42 0.00 0.00 41.96 40.25 3n4f s TYR 337 CO 0.28 -0.11 -0.19 0.34 0.64 0.00 0.00 175.55 176.51 3n4f s ASP 338 N 0.70 2.48 -0.56 4.32 2.15 -1.26 -1.97 116.67 122.52 3n4f s ASP 338 Ca -0.00 -0.43 -0.26 0.00 0.43 0.00 0.00 52.55 52.28 3n4f s ASP 338 Cb -0.14 -1.02 0.03 0.00 -0.30 0.00 0.00 42.92 41.50 3n4f s ASP 338 CO 0.02 0.12 1.08 -0.62 -0.17 0.00 0.00 175.17 175.60 3n4f s ASP 339 N 0.35 6.40 -0.00 -0.34 2.15 -1.26 -4.99 116.67 118.97 3n4f s ASP 339 Ca -0.13 -0.09 0.04 0.00 0.43 0.00 0.00 52.55 52.80 3n4f s ASP 339 Cb -0.16 -2.50 -0.01 0.00 -0.30 0.00 0.00 42.92 39.95 3n4f s ASP 339 CO 0.06 -1.36 -0.13 -0.63 -0.17 0.00 0.00 175.17 172.93 3n4f s ILE 340 N 4.49 1.06 -0.30 4.11 1.01 -1.26 -1.04 121.20 129.26 3n4f s ILE 340 Ca 0.37 -0.62 -0.03 0.00 0.00 0.00 0.00 60.65 60.37 3n4f s ILE 340 Cb -0.10 -0.89 0.04 0.00 0.01 0.00 0.00 42.46 41.52 3n4f s ILE 340 CO 0.23 0.26 0.01 -0.89 0.00 0.00 0.00 174.94 174.55 3n4f s THR 341 N -0.38 3.19 -0.24 2.92 2.01 -0.05 -4.99 115.64 118.10 3n4f s THR 341 Ca 0.05 -1.22 -0.11 0.00 0.31 0.00 0.00 61.69 60.71 3n4f s THR 341 Cb -0.05 -2.78 -0.05 0.00 0.01 0.00 0.00 72.50 69.63 3n4f s THR 341 CO -0.00 -0.05 0.18 -0.63 -0.69 0.00 0.00 174.62 173.43 3n4f s ILE 342 N 1.31 5.34 0.16 1.82 -1.09 -1.26 -1.44 121.20 126.05 3n4f s ILE 342 Ca -0.03 0.21 -0.32 0.00 -2.23 0.00 0.00 60.65 58.29 3n4f s ILE 342 Cb -0.19 -3.52 -0.10 0.00 -1.58 0.00 0.00 42.46 37.07 3n4f s ILE 342 CO -0.01 0.32 1.59 -1.61 -1.23 0.00 0.00 174.94 174.00 3n4f s GLU 343 N 1.20 4.21 0.00 2.79 2.02 -0.62 -4.70 118.70 123.60 3n4f s GLU 343 Ca 0.08 2.38 0.00 0.00 0.02 0.00 0.00 54.97 57.46 3n4f s GLU 343 Cb -0.14 -3.18 0.00 0.00 0.10 0.00 0.00 34.13 30.91 3n4f s GLU 343 CO 0.06 -0.63 0.00 0.41 0.02 0.00 0.00 175.26 175.12 3n4f n GLY 344 N 3.79 0.78 3.20 -1.39 0.00 -1.26 -4.60 105.19 105.72 3n4f n GLY 344 Ca 0.14 -0.44 0.04 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.44 -0.73 -0.11 1.61 -1.08 -0.14 -0.46 116.67 113.32 3n4f s ASP 346 Ca 0.00 0.56 0.16 0.00 -0.52 0.00 0.00 52.55 52.75 3n4f s ASP 346 Cb 0.00 1.65 0.58 0.00 -1.46 0.00 0.00 42.92 43.70 3n4f s ASP 346 CO 0.00 -0.14 1.50 1.33 0.52 0.00 0.00 175.17 178.38 3n4f n VAL 347 N 5.37 1.79 0.29 1.11 0.24 -1.26 -1.99 118.33 123.89 3n4f n VAL 347 Ca -0.06 -1.33 0.16 0.00 -2.04 0.00 0.00 64.34 61.08 3n4f n VAL 347 Cb 0.53 0.11 0.79 0.00 -1.47 0.00 0.00 33.84 33.80 3n4f n VAL 347 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3n4f h SER 348 N 3.04 0.00 0.37 -1.34 4.64 -1.97 -0.77 113.55 117.52 3n4f h SER 348 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3n4f h SER 348 Cb 1.30 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3n4f h SER 348 CO 0.18 0.00 -0.14 1.23 -0.87 0.00 0.00 176.83 177.23 3n4f h GLY 349 N 0.95 0.00 -3.41 -0.77 0.00 -1.84 -3.43 103.07 94.58 3n4f h GLY 349 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 3n4f h GLY 349 CO 0.00 0.00 0.18 -0.19 0.00 0.00 0.00 176.54 176.53 3n4f s TYR 350 N -4.22 3.65 0.01 5.60 1.51 -0.30 -4.16 117.35 119.44 3n4f s TYR 350 Ca -0.03 1.51 -0.03 0.00 -1.01 0.00 0.00 57.07 57.51 3n4f s TYR 350 Cb 0.13 -2.71 -0.01 0.00 -0.11 0.00 0.00 41.96 39.26 3n4f s TYR 350 CO 0.61 0.28 0.05 -0.98 -1.11 0.00 0.00 175.55 174.40 3n4f s ARG 351 N -2.05 0.35 -0.19 -0.62 1.70 -1.05 -4.99 118.95 112.11 3n4f s ARG 351 Ca 0.46 -0.44 -0.08 0.00 -0.47 0.00 0.00 55.73 55.20 3n4f s ARG 351 Cb -0.17 0.14 -0.04 0.00 -0.57 0.00 0.00 34.95 34.31 3n4f s ARG 351 CO 0.22 -0.07 0.08 0.42 -1.08 0.00 0.00 175.30 174.86 3n4f s ILE 352 N -1.24 4.91 -0.17 4.99 -1.09 -1.26 -0.12 121.20 127.22 3n4f s ILE 352 Ca -0.13 0.01 -0.10 0.00 -2.23 0.00 0.00 60.65 58.20 3n4f s ILE 352 Cb -0.08 -3.22 0.06 0.00 -1.58 0.00 0.00 42.46 37.64 3n4f s ILE 352 CO 0.00 0.45 0.42 -0.70 -1.23 0.00 0.00 174.94 173.88 3n4f s GLU 353 N 0.40 0.41 -1.51 2.79 2.12 -0.10 -4.63 118.70 118.18 3n4f s GLU 353 Ca 0.04 0.78 -0.13 0.00 0.36 0.00 0.00 54.97 56.02 3n4f s GLU 353 Cb -0.12 0.00 0.09 0.00 0.26 0.00 0.00 34.13 34.35 3n4f s GLU 353 CO -0.00 -0.15 0.87 0.09 -0.54 0.00 0.00 175.26 175.53 3n4f n ASN 354 N 4.14 -4.64 -0.22 -1.70 3.02 -1.17 -1.14 115.26 113.55 3n4f n ASN 354 Ca -0.22 -0.70 -0.03 0.00 -0.03 0.00 0.00 54.58 53.60 3n4f n ASN 354 Cb 0.55 -3.73 -0.01 0.00 -0.61 0.00 0.00 39.78 35.98 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 -1.57 0.61 3.13 7.41 0.00 0.41 -4.80 105.19 110.37 3n4f n GLY 355 Ca 0.03 -0.68 -0.20 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.85 0.90 -0.24 1.61 2.02 -0.29 -1.83 118.70 119.01 3n4f s GLU 356 Ca 0.00 -0.71 -0.13 0.00 0.02 0.00 0.00 54.97 54.15 3n4f s GLU 356 Cb 0.00 -0.89 -0.05 0.00 0.10 0.00 0.00 34.13 33.30 3n4f s GLU 356 CO 0.00 0.22 0.26 -1.50 0.02 0.00 0.00 175.26 174.26 3n4f s ILE 357 N -0.81 5.28 -0.35 -1.63 2.07 0.15 -0.92 121.20 124.98 3n4f s ILE 357 Ca 0.01 0.37 -0.22 0.00 -1.41 0.00 0.00 60.65 59.40 3n4f s ILE 357 Cb -0.08 -3.59 0.00 0.00 0.13 0.00 0.00 42.46 38.93 3n4f s ILE 357 CO 0.01 0.27 0.74 -1.00 -1.91 0.00 0.00 174.94 173.05 3n4f s HIS 358 N 1.43 3.15 -0.20 3.50 3.76 0.83 -1.22 115.29 126.53 3n4f s HIS 358 Ca 0.11 0.56 -0.15 0.00 -0.15 0.00 0.00 55.06 55.43 3n4f s HIS 358 Cb -0.15 -3.28 -0.04 0.00 1.11 0.00 0.00 32.58 30.23 3n4f s HIS 358 CO 0.07 -0.66 0.38 0.08 -0.85 0.00 0.00 174.74 173.77 3n4f s VAL 359 N 2.95 5.21 0.55 -0.90 1.01 -0.22 -2.54 120.40 126.46 3n4f s VAL 359 Ca 0.30 0.67 -0.19 0.00 0.00 0.00 0.00 61.98 62.76 3n4f s VAL 359 Cb -0.14 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.48 3n4f s VAL 359 CO 0.15 0.26 1.10 -2.16 0.00 0.00 0.00 175.10 174.45 3n4f s PRO 360 N 1.25 3.38 -0.13 2.72 0.04 -1.26 -4.17 135.00 136.84 3n4f s PRO 360 Ca 0.18 1.47 0.04 0.00 0.04 0.00 0.00 61.00 62.73 3n4f s PRO 360 Cb -0.15 -2.02 0.29 0.00 0.04 0.00 0.00 34.50 32.66 3n4f s PRO 360 CO 0.08 -0.80 1.14 0.00 0.04 0.00 0.00 177.00 177.46 3n4f n ALA 361 N -1.46 3.31 -2.21 8.56 0.00 -1.26 -4.88 120.51 122.57 3n4f n ALA 361 Ca 0.11 -0.89 -0.27 0.00 0.00 0.00 0.00 53.44 52.39 3n4f n ALA 361 Cb 0.52 -1.10 0.01 0.00 0.00 0.00 0.00 19.45 18.88 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 -1.50 4.39 0.58 0.00 -4.23 -1.26 -4.37 115.64 109.25 3n4f s THR 362 Ca 0.21 0.07 -0.20 0.00 -1.18 0.00 0.00 61.69 60.59 3n4f s THR 362 Cb 0.17 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 70.28 3n4f s THR 362 CO 0.05 -0.67 1.29 -2.84 -0.54 0.00 0.00 174.62 171.91 3n4f s PRO 363 N -4.81 2.98 6.02 3.99 0.02 -1.26 -3.50 135.00 138.44 3n4f s PRO 363 Ca 0.50 2.06 0.00 0.00 0.02 0.00 0.00 61.00 63.57 3n4f s PRO 363 Cb -0.10 -2.08 0.00 0.00 0.02 0.00 0.00 34.50 32.34 3n4f s PRO 363 CO 0.44 -1.26 0.00 0.41 -0.33 0.00 0.00 177.00 176.27 3n4f n GLY 364 N 0.71 2.42 0.51 0.52 0.00 -0.45 -2.22 105.19 106.67 3n4f n GLY 364 Ca 0.12 -0.44 0.09 0.00 0.00 0.00 0.00 46.02 45.79 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 13.46 0.25 -1.02 1.61 3.72 -1.26 -1.12 117.46 133.09 3n4f n PHE 365 Ca 0.00 -0.12 -0.01 0.00 -0.05 0.00 0.00 57.45 57.27 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 1.06 0.38 3.75 1.37 0.00 -0.94 -4.97 105.19 105.84 3n4f n GLY 366 Ca 0.14 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.68 5.33 -0.38 -0.61 1.01 -1.26 -4.67 121.20 118.94 3n4f s ILE 367 Ca 0.00 0.46 -0.09 0.00 0.00 0.00 0.00 60.65 61.03 3n4f s ILE 367 Cb 0.00 -3.58 0.05 0.00 0.01 0.00 0.00 42.46 38.94 3n4f s ILE 367 CO 0.00 0.44 0.19 -0.69 0.00 0.00 0.00 174.94 174.87 3n4f s VAL 368 N 0.19 4.16 0.20 2.92 1.01 -0.84 -4.97 120.40 123.06 3n4f s VAL 368 Ca 0.15 -1.16 -0.19 0.00 0.00 0.00 0.00 61.98 60.78 3n4f s VAL 368 Cb -0.13 -3.42 -0.08 0.00 0.00 0.00 0.00 36.38 32.76 3n4f s VAL 368 CO 0.03 -0.32 0.69 -0.36 0.00 0.00 0.00 175.10 175.15 3n4f s PHE 369 N 1.45 3.67 -0.70 5.22 0.08 -1.26 -0.97 117.98 125.47 3n4f s PHE 369 Ca 0.01 1.35 -0.27 0.00 0.12 0.00 0.00 56.93 58.14 3n4f s PHE 369 Cb -0.21 -2.58 0.02 0.00 -0.57 0.00 0.00 43.02 39.68 3n4f s PHE 369 CO 0.04 0.38 1.41 0.34 -0.10 0.00 0.00 175.22 177.29 3n4f s ASP 370 N -1.59 5.97 0.14 1.36 -1.08 0.40 -4.90 116.67 116.97 3n4f s ASP 370 Ca 0.41 -0.23 -0.22 0.00 -0.52 0.00 0.00 52.55 51.99 3n4f s ASP 370 Cb -0.17 -2.55 0.02 0.00 -1.46 0.00 0.00 42.92 38.76 3n4f s ASP 370 CO 0.21 -1.95 1.64 0.44 0.52 0.00 0.00 175.17 176.03 3n4f h ASP 371 N 11.17 -0.67 -0.64 -0.34 3.32 -1.95 -0.95 116.42 126.36 3n4f h ASP 371 Ca -0.27 0.12 0.01 0.00 0.02 0.00 0.00 57.03 56.91 3n4f h ASP 371 Cb 1.08 0.32 -0.03 0.00 0.22 0.00 0.00 39.33 40.91 3n4f h ASP 371 CO 1.26 -0.25 0.42 -0.33 -1.72 0.00 0.00 179.24 178.62 3n4f h GLU 372 N -0.23 0.83 -0.43 3.56 3.07 -1.99 -0.22 114.58 119.17 3n4f h GLU 372 Ca 0.13 -0.05 -0.08 0.00 -0.50 0.00 0.00 59.36 58.86 3n4f h GLU 372 Cb 0.42 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 3n4f h GLU 372 CO -0.34 0.55 -0.04 1.25 -1.40 0.00 0.00 179.01 179.03 3n4f h LEU 373 N 0.85 0.78 -0.48 1.33 5.85 -1.89 -1.02 115.31 120.73 3n4f h LEU 373 Ca 0.24 -0.33 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 3n4f h LEU 373 Cb -0.08 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 3n4f h LEU 373 CO -0.06 0.92 0.18 0.58 -0.34 0.00 0.00 178.44 179.72 3n4f h VAL 374 N 0.61 1.21 -0.66 1.05 2.07 -0.94 -0.58 116.25 119.03 3n4f h VAL 374 Ca 0.12 -0.68 0.08 0.00 0.82 0.00 0.00 66.70 67.04 3n4f h VAL 374 Cb 0.55 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 31.01 3n4f h VAL 374 CO 0.03 0.25 0.32 0.74 0.02 0.00 0.00 177.57 178.93 3n4f h THR 375 N 0.64 0.86 -0.49 2.57 2.02 -0.86 0.18 112.91 117.82 3n4f h THR 375 Ca 0.16 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.16 3n4f h THR 375 Cb 0.22 0.25 -0.03 0.00 -1.74 0.00 0.00 68.15 66.85 3n4f h THR 375 CO -0.01 0.10 0.31 0.22 0.37 0.00 0.00 175.52 176.51 3n4f h TYR 376 N 0.57 0.58 -0.13 3.16 3.20 -0.59 -0.44 116.97 123.31 3n4f h TYR 376 Ca 0.32 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 62.03 3n4f h TYR 376 Cb 0.31 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.39 3n4f h TYR 376 CO -0.11 0.35 -0.66 -0.07 -1.64 0.00 0.00 178.16 176.03 3n4f h LEU 377 N 0.62 0.58 0.05 2.82 3.38 -0.45 0.20 115.31 122.51 3n4f h LEU 377 Ca 0.19 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 57.84 3n4f h LEU 377 Cb -0.02 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 3n4f h LEU 377 CO -0.07 1.08 -0.29 0.40 0.09 0.00 0.00 178.44 179.65 3n4f h ILE 378 N 0.37 0.35 -0.44 1.22 2.04 -0.56 -1.04 117.51 119.45 3n4f h ILE 378 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 3n4f h ILE 378 Cb 1.22 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 3n4f h ILE 378 CO 0.12 0.00 0.18 0.78 0.00 0.00 0.00 178.15 179.23 3n4f h ASN 379 N -0.47 0.60 0.15 1.72 2.35 -0.83 -1.44 115.58 117.66 3n4f h ASN 379 Ca 0.05 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 3n4f h ASN 379 Cb 0.53 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.75 3n4f h ASN 379 CO -0.22 0.59 -0.07 -0.09 -1.65 0.00 0.00 177.43 175.99 3n4f h ARG 380 N 0.57 -0.20 0.00 0.81 2.43 -0.57 -3.42 114.38 113.99 3n4f h ARG 380 Ca 0.15 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3n4f h ARG 380 Cb 0.18 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 3n4f h ARG 380 CO -0.01 0.20 -0.06 0.43 -1.51 0.00 0.00 179.97 179.01 3n4f n SER 381 N -4.98 0.30 0.00 -3.80 7.64 -0.49 -5.08 113.62 107.20 3n4f n SER 381 Ca -0.09 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.64 3n4f n SER 381 Cb 0.25 0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 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 0.46 2.26 3.50 0.23 0.00 -0.55 -4.96 105.19 106.14 3n4f n GLY 382 Ca 0.00 -1.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.08 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 3.44 0.11 -0.06 1.61 1.48 -0.93 -4.79 118.94 119.80 3n4f s TRP 383 Ca 0.00 -0.47 -0.06 0.00 -1.06 0.00 0.00 56.10 54.52 3n4f s TRP 383 Cb 0.00 0.25 0.02 0.00 -1.16 0.00 0.00 33.47 32.57 3n4f s TRP 383 CO 0.00 -0.89 0.16 0.45 -4.06 0.00 0.00 176.95 172.61 3n4f s SER 384 N -2.93 -0.17 -0.02 -2.66 0.15 -1.26 -0.82 113.70 106.00 3n4f s SER 384 Ca 0.14 0.32 0.03 0.00 0.70 0.00 0.00 55.95 57.14 3n4f s SER 384 Cb 0.00 0.33 -0.00 0.00 -1.71 0.00 0.00 66.02 64.63 3n4f s SER 384 CO 0.01 -0.06 -0.11 -1.61 1.20 0.00 0.00 173.24 172.67 3n4f s GLU 385 N 0.08 1.01 0.35 5.44 0.41 0.55 -5.01 118.70 121.53 3n4f s GLU 385 Ca -0.00 -0.39 0.00 0.00 -0.41 0.00 0.00 54.97 54.17 3n4f s GLU 385 Cb -0.01 -0.95 0.00 0.00 -1.78 0.00 0.00 34.13 31.39 3n4f s GLU 385 CO 0.00 0.21 0.00 0.41 -0.49 0.00 0.00 175.26 175.39 3n4f n GLY 386 N 2.97 -2.00 3.11 -1.39 0.00 -1.26 -0.90 105.19 105.72 3n4f n GLY 386 Ca -0.15 -1.82 -0.08 0.00 0.00 0.00 0.00 46.02 43.96 3n4f n GLY 386 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3n4f s HIS 387 N -0.09 0.61 0.00 1.61 0.09 -0.97 -4.93 115.29 111.60 3n4f s HIS 387 Ca 0.00 -1.09 0.00 0.00 -0.00 0.00 0.00 55.06 53.97 3n4f s HIS 387 Cb 0.00 -0.42 0.00 0.00 -0.00 0.00 0.00 32.58 32.16 3n4f s HIS 387 CO 0.00 -0.39 0.00 1.58 -0.00 0.00 0.00 174.74 175.93 3n4f n HIS 388 N 0.06 0.00 1.57 1.40 -0.00 -1.26 -4.44 115.22 112.55 3n4f n HIS 388 Ca -0.12 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.72 3n4f n HIS 388 Cb 0.61 0.00 0.74 0.00 -0.00 0.00 0.00 29.99 31.35 3n4f n HIS 388 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95