#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u1u s SER 3 N 0.00 3.70 0.05 0.00 1.04 -1.26 -0.51 113.70 116.72 1u1u s SER 3 Ca 0.00 -0.43 0.06 0.00 0.48 0.00 0.00 55.95 56.06 1u1u s SER 3 Cb 0.00 -1.55 -0.03 0.00 0.10 0.00 0.00 66.02 64.54 1u1u s SER 3 CO 0.00 0.14 -0.17 -2.28 0.98 0.00 0.00 173.24 171.91 1u1u s HIS 4 N 0.51 1.44 -0.20 5.02 5.04 0.26 -0.81 115.29 126.55 1u1u s HIS 4 Ca -0.11 -0.38 -0.01 0.00 -1.54 0.00 0.00 55.06 53.02 1u1u s HIS 4 Cb -0.16 -0.84 0.05 0.00 0.04 0.00 0.00 32.58 31.68 1u1u s HIS 4 CO 0.04 0.08 -0.01 0.42 -2.34 0.00 0.00 174.74 172.93 1u1u s ILE 5 N -0.95 0.93 0.57 0.89 1.01 -1.24 -2.40 121.20 120.00 1u1u s ILE 5 Ca 0.03 -0.74 0.32 0.00 0.00 0.00 0.00 60.65 60.26 1u1u s ILE 5 Cb -0.09 -1.29 0.36 0.00 0.01 0.00 0.00 42.46 41.46 1u1u s ILE 5 CO 0.02 -0.09 2.24 -0.37 0.00 0.00 0.00 174.94 176.74 1u1u h VAL 6 N 6.53 0.44 -2.34 2.92 -1.51 -1.86 -3.39 116.25 117.05 1u1u h VAL 6 Ca -0.18 -0.10 0.14 0.00 -1.23 0.00 0.00 66.70 65.33 1u1u h VAL 6 Cb 1.10 1.07 -0.02 0.00 -2.13 0.00 0.00 31.29 31.31 1u1u h VAL 6 CO 0.37 0.02 0.49 0.61 -1.23 0.00 0.00 177.57 177.83 1u1u n GLY 7 N -1.16 0.71 3.50 5.19 0.00 -1.26 -4.88 105.19 107.28 1u1u n GLY 7 Ca -0.03 -1.10 -0.15 0.00 0.00 0.00 0.00 46.02 44.74 1u1u n GLY 7 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1u1u s TYR 8 N -2.84 -0.58 0.54 1.61 5.04 -1.26 -3.54 117.35 116.32 1u1u s TYR 8 Ca 0.19 0.80 -0.22 0.00 -2.44 0.00 0.00 57.07 55.40 1u1u s TYR 8 Cb -0.02 0.46 -0.05 0.00 0.35 0.00 0.00 41.96 42.70 1u1u s TYR 8 CO 0.04 -0.65 1.31 -2.14 -1.34 0.00 0.00 175.55 172.77 1u1u s PRO 9 N -2.02 3.22 -0.56 4.97 0.02 -1.23 -4.66 135.00 134.76 1u1u s PRO 9 Ca -0.06 2.11 0.07 0.00 0.02 0.00 0.00 61.00 63.13 1u1u s PRO 9 Cb -0.00 -2.24 0.29 0.00 0.02 0.00 0.00 34.50 32.56 1u1u s PRO 9 CO 0.02 -1.09 0.77 2.89 -0.33 0.00 0.00 177.00 179.26 1u1u n ARG 10 N -1.01 2.31 -4.03 5.54 0.00 -1.26 -4.99 116.66 113.22 1u1u n ARG 10 Ca 0.10 -4.38 -0.08 0.00 -0.00 0.00 0.00 57.85 53.50 1u1u n ARG 10 Cb 0.46 -2.03 -0.10 0.00 -0.00 0.00 0.00 32.46 30.79 1u1u n ARG 10 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1u1u s GLY 12 N -2.58 0.37 0.00 2.89 0.00 -1.26 -4.75 107.32 101.99 1u1u s GLY 12 Ca 0.42 -1.00 0.13 0.00 0.00 0.00 0.00 44.72 44.26 1u1u s GLY 12 CO -0.07 -1.12 1.36 -1.05 0.00 0.00 0.00 173.10 172.22 1u1u n PRO 13 N 0.32 0.84 -0.60 2.90 -0.02 -1.26 -2.55 135.00 134.63 1u1u n PRO 13 Ca -0.16 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.32 1u1u n PRO 13 Cb 0.60 -1.24 -0.00 0.00 -0.02 0.00 0.00 33.50 32.84 1u1u n PRO 13 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1u1u n LYS 14 N -0.74 0.00 -3.35 -0.52 4.76 -1.26 -4.98 118.16 112.08 1u1u n LYS 14 Ca 0.09 -0.64 -0.21 0.00 -2.87 0.00 0.00 58.31 54.69 1u1u n LYS 14 Cb 0.04 -0.18 0.06 0.00 -1.84 0.00 0.00 35.03 33.11 1u1u n LYS 14 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1u1u n ARG 15 N 0.03 -6.44 0.07 1.97 1.74 -1.06 -4.96 116.66 108.02 1u1u n ARG 15 Ca -0.01 0.74 -0.09 0.00 -0.77 0.00 0.00 57.85 57.71 1u1u n ARG 15 Cb 0.65 -5.45 -0.06 0.00 -1.02 0.00 0.00 32.46 26.58 1u1u n ARG 15 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1u1u h GLU 16 N -2.14 -0.42 -1.18 5.56 3.07 -1.96 -2.16 114.58 115.35 1u1u h GLU 16 Ca -0.49 0.03 0.35 0.00 -0.50 0.00 0.00 59.36 58.75 1u1u h GLU 16 Cb 1.32 0.10 -0.11 0.00 -0.84 0.00 0.00 28.75 29.22 1u1u h GLU 16 CO 0.49 -0.28 0.76 1.25 -1.40 0.00 0.00 179.01 179.83 1u1u h LEU 17 N -0.44 0.33 -1.08 1.33 5.85 -1.93 0.41 115.31 119.78 1u1u h LEU 17 Ca -0.01 0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.92 1u1u h LEU 17 Cb 0.43 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.45 1u1u h LEU 17 CO -0.15 -0.04 0.62 0.50 -0.34 0.00 0.00 178.44 179.03 1u1u h LYS 18 N 0.23 0.97 0.08 1.25 3.64 -1.70 -0.67 116.57 120.37 1u1u h LYS 18 Ca 0.70 -0.06 -0.32 0.00 -1.27 0.00 0.00 60.65 59.70 1u1u h LYS 18 Cb 2.03 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 33.61 1u1u h LYS 18 CO -0.34 0.64 -1.73 1.19 -2.27 0.00 0.00 179.45 176.95 1u1u n PHE 19 N -4.56 1.18 0.30 1.91 3.72 0.12 -3.16 117.46 116.98 1u1u n PHE 19 Ca 0.17 0.33 0.19 0.00 -0.05 0.00 0.00 57.45 58.09 1u1u n PHE 19 Cb 0.30 -1.14 1.03 0.00 -0.94 0.00 0.00 39.48 38.72 1u1u n PHE 19 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1u1u h ALA 20 N -0.15 1.06 0.13 4.37 0.00 -0.95 0.63 119.26 124.36 1u1u h ALA 20 Ca -0.40 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.33 1u1u h ALA 20 Cb 1.76 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.57 1u1u h ALA 20 CO -0.02 -0.06 -0.78 -0.07 0.00 0.00 0.00 179.25 178.32 1u1u h LEU 21 N 0.00 0.46 -0.13 0.00 3.38 -1.21 -2.77 115.31 115.04 1u1u h LEU 21 Ca 0.00 -0.95 -0.22 0.00 0.09 0.00 0.00 57.88 56.80 1u1u h LEU 21 Cb 0.13 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1u1u h LEU 21 CO 0.00 1.37 -0.99 -0.33 0.09 0.00 0.00 178.44 178.58 1u1u h GLU 22 N -0.38 0.21 0.17 1.13 5.08 -1.04 1.37 114.58 121.13 1u1u h GLU 22 Ca -0.13 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 57.94 1u1u h GLU 22 Cb 1.61 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.94 1u1u h GLU 22 CO 0.15 1.04 -0.12 1.03 -1.00 0.00 0.00 179.01 180.11 1u1u h SER 23 N 0.10 -0.32 0.00 1.42 0.87 0.06 -2.67 113.55 113.01 1u1u h SER 23 Ca -0.07 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 1u1u h SER 23 Cb 1.66 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.72 1u1u h SER 23 CO 0.15 -0.18 0.00 0.33 -0.53 0.00 0.00 176.83 176.61 1u1u n PHE 24 N -2.99 0.00 -0.04 2.24 7.35 -1.04 -2.55 117.46 120.42 1u1u n PHE 24 Ca -0.03 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.67 1u1u n PHE 24 Cb 0.12 -0.20 0.03 0.00 0.35 0.00 0.00 39.48 39.77 1u1u n PHE 24 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 1u1u n TRP 25 N -1.66 0.06 1.41 -5.13 8.01 0.47 0.72 117.44 121.32 1u1u n TRP 25 Ca 0.00 0.15 0.14 0.00 -1.31 0.00 0.00 57.50 56.47 1u1u n TRP 25 Cb 0.00 -0.58 0.45 0.00 -2.01 0.00 0.00 31.31 29.17 1u1u n TRP 25 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1u1u n ASP 26 N -4.00 1.69 -0.64 -0.99 8.00 -1.01 -4.95 116.55 114.63 1u1u n ASP 26 Ca 0.03 -1.53 0.00 0.00 0.71 0.00 0.00 54.79 53.99 1u1u n ASP 26 Cb 0.08 0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 1u1u n ASP 26 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1u1u n GLY 27 N 1.21 0.71 1.95 0.44 0.00 0.22 -5.04 105.19 104.68 1u1u n GLY 27 Ca 0.18 -0.41 0.01 0.00 0.00 0.00 0.00 46.02 45.81 1u1u n GLY 27 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u1u n LYS 28 N -0.64 0.63 0.00 1.61 5.02 -1.06 -5.04 118.16 118.67 1u1u n LYS 28 Ca 0.00 -2.36 0.00 0.00 -2.02 0.00 0.00 58.31 53.93 1u1u n LYS 28 Cb 0.25 -0.45 0.00 0.00 -0.02 0.00 0.00 35.03 34.81 1u1u n LYS 28 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1u1u n SER 29 N -0.01 0.00 -4.73 4.39 3.41 -1.26 -4.66 113.62 110.76 1u1u n SER 29 Ca 0.02 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.25 1u1u n SER 29 Cb 0.98 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.99 1u1u n SER 29 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1u1u n THR 30 N -0.01 4.29 0.00 6.66 -2.24 -1.26 -4.67 114.28 117.05 1u1u n THR 30 Ca 0.00 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 1u1u n THR 30 Cb 0.00 -1.57 0.00 0.00 -2.10 0.00 0.00 70.33 66.66 1u1u n THR 30 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1u1u n ALA 31 N -1.43 1.13 -0.04 6.98 0.00 -1.26 0.57 120.51 126.45 1u1u n ALA 31 Ca 0.13 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.60 1u1u n ALA 31 Cb 0.46 -0.75 -0.14 0.00 0.00 0.00 0.00 19.45 19.02 1u1u n ALA 31 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1u1u n GLU 32 N -0.68 0.78 0.19 0.00 1.02 -1.26 -3.91 120.64 116.77 1u1u n GLU 32 Ca 0.00 -0.11 -0.14 0.00 -0.02 0.00 0.00 57.16 56.88 1u1u n GLU 32 Cb 0.00 -1.45 -0.07 0.00 -0.02 0.00 0.00 31.44 29.90 1u1u n GLU 32 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1u1u h ASP 33 N 0.00 -0.55 0.00 1.62 3.45 -0.19 0.85 116.42 121.60 1u1u h ASP 33 Ca -0.17 0.04 0.00 0.00 0.43 0.00 0.00 57.03 57.33 1u1u h ASP 33 Cb 1.31 0.17 0.00 0.00 -0.56 0.00 0.00 39.33 40.26 1u1u h ASP 33 CO 0.01 -0.33 0.00 0.18 -1.57 0.00 0.00 179.24 177.53 1u1u n LEU 34 N -5.34 0.00 -0.37 1.55 4.77 -1.24 -0.73 117.00 115.63 1u1u n LEU 34 Ca -0.09 0.96 0.30 0.00 -0.03 0.00 0.00 56.01 57.15 1u1u n LEU 34 Cb 0.25 -0.46 0.59 0.00 -2.33 0.00 0.00 43.42 41.47 1u1u n LEU 34 CO 0.32 -0.46 1.24 1.56 -1.33 0.00 0.00 177.39 178.72 1u1u h GLN 35 N 0.00 0.22 -0.06 3.23 1.08 -1.64 3.24 115.11 121.18 1u1u h GLN 35 Ca 0.00 -0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.10 1u1u h GLN 35 Cb 0.00 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 1u1u h GLN 35 CO 0.00 0.15 -0.37 -0.22 -0.95 0.00 0.00 178.83 177.44 1u1u h LYS 36 N 0.23 0.11 0.00 1.46 1.63 0.39 -2.14 116.57 118.26 1u1u h LYS 36 Ca 0.68 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.44 1u1u h LYS 36 Cb 2.02 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.65 1u1u h LYS 36 CO -0.31 0.47 0.00 0.28 -3.45 0.00 0.00 179.45 176.44 1u1u n VAL 37 N -4.08 0.00 -0.27 2.00 0.31 1.02 -2.73 118.33 114.58 1u1u n VAL 37 Ca -0.02 0.62 -0.07 0.00 -0.01 0.00 0.00 64.34 64.87 1u1u n VAL 37 Cb 0.43 -1.59 -0.07 0.00 -0.91 0.00 0.00 33.84 31.70 1u1u n VAL 37 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1u1u n SER 38 N -1.94 -0.69 -0.33 4.52 7.64 0.19 0.16 113.62 123.17 1u1u n SER 38 Ca 0.00 1.19 0.11 0.00 1.01 0.00 0.00 58.87 61.18 1u1u n SER 38 Cb 0.00 -0.17 0.31 0.00 -1.01 0.00 0.00 64.21 63.35 1u1u n SER 38 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u1u h ALA 39 N 0.29 1.69 0.00 -0.43 0.00 -1.55 0.45 119.26 119.70 1u1u h ALA 39 Ca 0.10 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1u1u h ALA 39 Cb 0.27 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1u1u h ALA 39 CO -0.61 0.03 0.00 -0.25 0.00 0.00 0.00 179.25 178.42 1u1u n ASP 40 N -4.63 0.41 -0.08 0.00 9.92 0.43 -1.71 116.55 120.89 1u1u n ASP 40 Ca 0.20 0.62 -0.06 0.00 -0.53 0.00 0.00 54.79 55.01 1u1u n ASP 40 Cb 0.46 -0.70 -0.02 0.00 -0.64 0.00 0.00 41.12 40.23 1u1u n ASP 40 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1u1u n LEU 41 N -1.97 1.82 -0.39 0.64 4.77 0.14 -4.01 117.00 118.01 1u1u n LEU 41 Ca 0.02 0.53 -0.03 0.00 -0.03 0.00 0.00 56.01 56.50 1u1u n LEU 41 Cb 0.17 -0.82 0.01 0.00 -2.33 0.00 0.00 43.42 40.44 1u1u n LEU 41 CO 0.15 -0.41 0.56 0.54 -1.33 0.00 0.00 177.39 176.90 1u1u n ARG 42 N -4.53 -0.28 -0.32 3.23 1.74 -0.33 0.62 116.66 116.79 1u1u n ARG 42 Ca -0.09 1.53 0.18 0.00 -0.77 0.00 0.00 57.85 58.70 1u1u n ARG 42 Cb 0.34 -2.27 0.38 0.00 -1.02 0.00 0.00 32.46 29.90 1u1u n ARG 42 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1u1u h SER 43 N 0.00 0.34 -0.25 0.55 4.64 -1.55 -1.71 113.55 115.57 1u1u h SER 43 Ca 0.31 0.18 -0.16 0.00 -0.47 0.00 0.00 61.79 61.65 1u1u h SER 43 Cb 0.56 0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1u1u h SER 43 CO -0.98 -0.10 -0.48 -1.28 -0.87 0.00 0.00 176.83 173.12 1u1u h SER 44 N 0.32 0.85 -0.03 4.97 0.87 0.05 -2.47 113.55 118.10 1u1u h SER 44 Ca 0.64 -0.54 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 1u1u h SER 44 Cb 1.35 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1u1u h SER 44 CO -0.60 1.23 -0.02 0.40 -0.53 0.00 0.00 176.83 177.31 1u1u h ILE 45 N 0.50 1.35 0.10 2.23 1.08 -0.80 0.63 117.51 122.59 1u1u h ILE 45 Ca 0.01 -1.07 0.01 0.00 -0.39 0.00 0.00 64.86 63.43 1u1u h ILE 45 Cb 1.09 1.99 -0.02 0.00 -3.07 0.00 0.00 36.82 36.81 1u1u h ILE 45 CO 0.11 0.29 -0.17 -0.50 -0.69 0.00 0.00 178.15 177.18 1u1u h TRP 46 N -0.34 -0.45 -0.27 1.37 6.55 -1.46 -2.82 115.95 118.52 1u1u h TRP 46 Ca 0.01 0.01 0.03 0.00 0.95 0.00 0.00 58.89 59.88 1u1u h TRP 46 Cb 0.47 0.19 -0.03 0.00 -0.86 0.00 0.00 29.16 28.93 1u1u h TRP 46 CO 0.08 -0.26 0.10 0.87 -1.05 0.00 0.00 178.44 178.18 1u1u h LYS 47 N -0.34 0.22 -1.39 0.49 1.57 -1.43 -0.89 116.57 114.81 1u1u h LYS 47 Ca 0.02 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1u1u h LYS 47 Cb 0.35 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1u1u h LYS 47 CO -0.09 0.14 0.00 0.94 -0.57 0.00 0.00 179.45 179.87 1u1u n GLN 48 N -5.02 0.49 0.00 3.15 7.27 0.22 -1.61 117.38 121.88 1u1u n GLN 48 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.06 1u1u n GLN 48 Cb 0.09 -1.25 0.00 0.00 2.41 0.00 0.00 30.24 31.49 1u1u n GLN 48 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1u1u n SER 50 N 0.69 0.00 0.23 1.69 3.41 -0.34 -4.01 113.62 115.29 1u1u n SER 50 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.74 1u1u n SER 50 Cb 0.23 0.00 0.69 0.00 -0.26 0.00 0.00 64.21 64.88 1u1u n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u1u h ALA 51 N 0.00 1.10 0.00 7.33 0.00 -1.53 0.19 119.26 126.35 1u1u h ALA 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1u1u h ALA 51 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1u1u h ALA 51 CO 0.00 -0.10 -0.83 0.00 0.00 0.00 0.00 179.25 178.32 1u1u n ALA 52 N -1.80 3.37 0.00 0.00 0.00 -1.26 -4.92 120.51 115.90 1u1u n ALA 52 Ca -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1u1u n ALA 52 Cb 0.17 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1u1u n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u1u n GLY 53 N 1.39 1.16 3.62 0.00 0.00 0.06 -4.95 105.19 106.47 1u1u n GLY 53 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1u1u n GLY 53 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u1u s THR 54 N -2.00 3.05 0.00 2.61 2.01 -1.24 -4.78 115.64 115.29 1u1u s THR 54 Ca 0.00 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.05 1u1u s THR 54 Cb 0.00 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 69.46 1u1u s THR 54 CO 0.00 -0.03 0.67 1.17 -0.69 0.00 0.00 174.62 175.75 1u1u n LYS 55 N 8.40 0.00 -3.15 4.92 3.00 -1.07 -4.56 118.16 125.70 1u1u n LYS 55 Ca 0.27 0.32 -0.41 0.00 -0.00 0.00 0.00 58.31 58.48 1u1u n LYS 55 Cb 0.44 -1.23 -0.07 0.00 0.00 0.00 0.00 35.03 34.17 1u1u n LYS 55 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 1u1u s PHE 56 N -1.98 3.18 -0.31 5.64 0.08 0.01 -4.99 117.98 119.61 1u1u s PHE 56 Ca 0.00 0.38 0.01 0.00 0.12 0.00 0.00 56.93 57.44 1u1u s PHE 56 Cb 0.00 -3.02 0.07 0.00 -0.57 0.00 0.00 43.02 39.50 1u1u s PHE 56 CO 0.00 -0.55 -0.01 0.42 -0.10 0.00 0.00 175.22 174.99 1u1u s ILE 57 N 2.58 2.54 0.30 0.64 1.01 -1.26 -3.61 121.20 123.39 1u1u s ILE 57 Ca 0.23 -1.80 -0.30 0.00 0.00 0.00 0.00 60.65 58.78 1u1u s ILE 57 Cb -0.15 -2.61 -0.12 0.00 0.01 0.00 0.00 42.46 39.59 1u1u s ILE 57 CO 0.13 -0.27 1.51 -0.81 0.00 0.00 0.00 174.94 175.50 1u1u n PRO 58 N 4.45 2.49 -5.13 2.79 -0.04 -1.26 -1.60 135.00 136.70 1u1u n PRO 58 Ca -0.08 0.88 -0.29 0.00 -0.04 0.00 0.00 63.50 63.97 1u1u n PRO 58 Cb 0.42 -2.61 -0.16 0.00 -0.04 0.00 0.00 33.50 31.11 1u1u n PRO 58 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1u1u s SER 59 N 0.30 2.70 0.00 3.54 1.04 0.34 -4.68 113.70 116.95 1u1u s SER 59 Ca 0.63 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.63 1u1u s SER 59 Cb -0.54 -0.43 0.00 0.00 0.10 0.00 0.00 66.02 65.15 1u1u s SER 59 CO 0.52 0.26 0.00 -3.20 0.98 0.00 0.00 173.24 171.80 1u1u n ASN 60 N 2.66 -0.63 -0.28 7.02 5.15 -1.26 -1.75 115.26 126.17 1u1u n ASN 60 Ca -0.16 0.00 0.09 0.00 -0.60 0.00 0.00 54.58 53.91 1u1u n ASN 60 Cb 0.52 -0.30 -0.03 0.00 -0.53 0.00 0.00 39.78 39.44 1u1u n ASN 60 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1u1u n THR 61 N -2.73 0.00 -0.69 -0.44 -2.24 -1.26 -4.75 114.28 102.16 1u1u n THR 61 Ca 0.00 -0.24 -0.03 0.00 -2.27 0.00 0.00 64.05 61.51 1u1u n THR 61 Cb 0.30 1.15 0.03 0.00 -2.10 0.00 0.00 70.33 69.70 1u1u n THR 61 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1u1u n PHE 62 N -0.50 -3.32 0.00 4.78 -0.00 -1.26 -4.76 117.46 112.40 1u1u n PHE 62 Ca 0.06 -0.12 0.00 0.00 -0.00 0.00 0.00 57.45 57.40 1u1u n PHE 62 Cb 0.35 -0.12 0.00 0.00 -0.00 0.00 0.00 39.48 39.71 1u1u n PHE 62 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1u1u n ALA 63 N -3.18 0.00 0.21 3.13 0.00 -1.26 -4.79 120.51 114.61 1u1u n ALA 63 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.50 1u1u n ALA 63 Cb 0.07 0.00 0.39 0.00 0.00 0.00 0.00 19.45 19.91 1u1u n ALA 63 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1u1u h HIS 64 N 0.00 0.00 0.00 0.00 3.86 -1.99 -3.44 115.15 113.58 1u1u h HIS 64 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1u1u h HIS 64 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1u1u h HIS 64 CO 0.00 0.28 0.00 0.98 0.86 0.00 0.00 177.93 180.05 1u1u n TYR 65 N -3.41 0.00 -4.19 2.45 4.19 -1.26 -4.93 117.16 110.01 1u1u n TYR 65 Ca 0.00 0.00 -0.18 0.00 3.31 0.00 0.00 57.90 61.03 1u1u n TYR 65 Cb 0.47 0.00 -0.15 0.00 0.49 0.00 0.00 39.34 40.15 1u1u n TYR 65 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 1u1u s ASP 66 N 1.01 0.82 0.31 2.98 2.15 -1.26 -4.65 116.67 118.02 1u1u s ASP 66 Ca 0.00 -0.12 0.07 0.00 0.43 0.00 0.00 52.55 52.93 1u1u s ASP 66 Cb 0.00 -0.26 0.83 0.00 -0.30 0.00 0.00 42.92 43.19 1u1u s ASP 66 CO 0.00 0.01 1.70 0.06 -0.17 0.00 0.00 175.17 176.77 1u1u h GLN 67 N 6.60 0.42 0.00 4.34 -0.00 -1.95 0.45 115.11 124.96 1u1u h GLN 67 Ca -0.34 -0.03 -0.11 0.00 -0.00 0.00 0.00 58.65 58.18 1u1u h GLN 67 Cb 1.17 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.48 28.54 1u1u h GLN 67 CO 0.49 0.28 -0.51 0.28 -0.00 0.00 0.00 178.83 179.37 1u1u h VAL 68 N 0.43 1.20 0.23 1.86 2.07 -1.96 -2.59 116.25 117.49 1u1u h VAL 68 Ca 0.61 -1.84 -0.32 0.00 0.82 0.00 0.00 66.70 65.97 1u1u h VAL 68 Cb 1.20 2.03 0.04 0.00 -1.52 0.00 0.00 31.29 33.04 1u1u h VAL 68 CO -0.53 0.50 -1.39 0.25 0.02 0.00 0.00 177.57 176.41 1u1u h LEU 69 N 0.00 0.83 -1.35 2.57 6.46 -0.52 -1.99 115.31 121.31 1u1u h LEU 69 Ca -0.01 -0.91 0.16 0.00 -0.12 0.00 0.00 57.88 57.01 1u1u h LEU 69 Cb 0.99 -0.27 -0.07 0.00 -0.73 0.00 0.00 40.66 40.59 1u1u h LEU 69 CO 0.07 1.68 0.57 0.44 -0.62 0.00 0.00 178.44 180.57 1u1u h ASP 70 N 0.13 0.58 -0.10 1.25 3.32 -0.50 0.20 116.42 121.29 1u1u h ASP 70 Ca -0.24 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 56.81 1u1u h ASP 70 Cb 2.09 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 41.57 1u1u h ASP 70 CO 0.26 0.28 -0.11 0.74 -1.72 0.00 0.00 179.24 178.69 1u1u h THR 71 N 0.60 1.36 -0.23 0.35 2.02 -1.39 -3.02 112.91 112.60 1u1u h THR 71 Ca 0.45 -1.28 0.07 0.00 0.77 0.00 0.00 66.41 66.42 1u1u h THR 71 Cb 0.84 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 1u1u h THR 71 CO -0.20 0.37 0.18 0.74 0.37 0.00 0.00 175.52 176.97 1u1u h THR 72 N -0.15 0.80 -0.11 3.16 2.02 -0.08 -2.87 112.91 115.68 1u1u h THR 72 Ca 0.02 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.10 1u1u h THR 72 Cb 0.64 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.88 1u1u h THR 72 CO 0.03 0.00 0.02 0.00 0.37 0.00 0.00 175.52 175.94 1u1u n ALA 73 N -2.54 4.60 0.00 6.16 0.00 0.45 -1.38 120.51 127.80 1u1u n ALA 73 Ca 0.03 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.84 1u1u n ALA 73 Cb 0.32 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1u1u n ALA 73 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1u1u n LEU 75 N 1.44 0.00 -2.48 0.00 4.77 -1.09 -3.15 117.00 116.50 1u1u n LEU 75 Ca 0.12 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.94 1u1u n LEU 75 Cb 0.57 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.66 1u1u n LEU 75 CO 0.09 0.00 -0.19 0.61 -1.33 0.00 0.00 177.39 176.57 1u1u n GLY 76 N 0.00 -0.50 0.00 -0.72 0.00 -0.05 0.16 105.19 104.08 1u1u n GLY 76 Ca 0.00 0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1u1u n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u1u n ALA 77 N -2.24 1.92 -0.91 4.61 0.00 -0.48 -4.54 120.51 118.87 1u1u n ALA 77 Ca -0.18 -0.08 -0.35 0.00 0.00 0.00 0.00 53.44 52.83 1u1u n ALA 77 Cb 0.64 -1.25 -0.05 0.00 0.00 0.00 0.00 19.45 18.79 1u1u n ALA 77 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1u1u n VAL 78 N -1.21 0.00 -0.63 0.00 3.14 -1.26 -4.86 118.33 113.52 1u1u n VAL 78 Ca 0.08 0.00 -0.04 0.00 -2.96 0.00 0.00 64.34 61.43 1u1u n VAL 78 Cb 0.10 -0.25 0.04 0.00 -1.06 0.00 0.00 33.84 32.67 1u1u n VAL 78 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1u1u n PRO 79 N 2.03 1.14 -0.04 1.45 -0.02 -1.26 -4.87 135.00 133.43 1u1u n PRO 79 Ca 0.16 -0.17 -0.00 0.00 -2.02 0.00 0.00 63.50 61.47 1u1u n PRO 79 Cb -0.03 -1.03 -0.15 0.00 -0.02 0.00 0.00 33.50 32.28 1u1u n PRO 79 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1u1u n PRO 80 N 1.68 0.67 0.00 0.52 -0.04 -1.26 -4.36 135.00 132.21 1u1u n PRO 80 Ca 0.02 -0.04 0.12 0.00 -0.04 0.00 0.00 63.50 63.55 1u1u n PRO 80 Cb 0.07 -1.57 0.63 0.00 -0.04 0.00 0.00 33.50 32.59 1u1u n PRO 80 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1u1u n ARG 81 N -2.58 0.40 0.02 0.54 1.85 -1.26 -2.62 116.66 113.00 1u1u n ARG 81 Ca -0.18 0.05 0.11 0.00 -1.00 0.00 0.00 57.85 56.84 1u1u n ARG 81 Cb 0.87 -1.50 -0.12 0.00 -1.05 0.00 0.00 32.46 30.67 1u1u n ARG 81 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1u1u n TYR 82 N -1.25 0.21 -2.17 2.89 4.01 -1.26 -4.84 117.16 114.75 1u1u n TYR 82 Ca 0.12 0.06 -0.01 0.00 -0.16 0.00 0.00 57.90 57.91 1u1u n TYR 82 Cb 0.18 -0.55 0.00 0.00 -0.31 0.00 0.00 39.34 38.66 1u1u n TYR 82 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1u1u n GLY 83 N 1.27 -0.83 3.48 2.72 0.00 -1.08 -5.04 105.19 105.72 1u1u n GLY 83 Ca -0.02 0.27 -0.36 0.00 0.00 0.00 0.00 46.02 45.91 1u1u n GLY 83 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1u1u s TYR 84 N -2.49 3.11 -0.18 1.61 5.04 -1.26 -4.97 117.35 118.21 1u1u s TYR 84 Ca 0.05 -0.32 -0.18 0.00 -2.44 0.00 0.00 57.07 54.18 1u1u s TYR 84 Cb -0.01 -2.20 -0.22 0.00 0.35 0.00 0.00 41.96 39.88 1u1u s TYR 84 CO 0.34 -0.25 0.29 1.79 -1.34 0.00 0.00 175.55 176.38 1u1u h THR 85 N 5.41 0.86 0.00 4.34 1.35 -1.98 -3.51 112.91 119.38 1u1u h THR 85 Ca -0.37 -2.24 0.00 0.00 -0.55 0.00 0.00 66.41 63.25 1u1u h THR 85 Cb 1.18 2.34 0.00 0.00 -1.73 0.00 0.00 68.15 69.94 1u1u h THR 85 CO 0.60 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.97 1u1u n GLY 86 N 1.60 1.59 0.00 5.82 0.00 -1.26 -5.18 105.19 107.75 1u1u n GLY 86 Ca -0.31 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.41 1u1u n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u1u n GLY 87 N -1.22 0.61 3.55 -0.02 0.00 -1.26 -4.88 105.19 101.97 1u1u n GLY 87 Ca 0.00 -2.18 -0.31 0.00 0.00 0.00 0.00 46.02 43.53 1u1u n GLY 87 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1u1u s GLU 88 N -1.04 2.36 0.99 1.61 2.56 -1.26 -4.74 118.70 119.18 1u1u s GLU 88 Ca 0.00 0.50 -0.15 0.00 0.00 0.00 0.00 54.97 55.32 1u1u s GLU 88 Cb 0.00 -4.67 -0.02 0.00 2.00 0.00 0.00 34.13 31.44 1u1u s GLU 88 CO 0.00 -3.26 -0.08 -0.89 -0.56 0.00 0.00 175.26 170.47 1u1u n ILE 89 N 7.77 0.00 0.00 -3.70 5.41 -0.79 -5.01 119.36 123.03 1u1u n ILE 89 Ca 0.33 -0.28 0.00 0.00 1.00 0.00 0.00 62.75 63.80 1u1u n ILE 89 Cb 0.50 -0.42 0.00 0.00 -0.71 0.00 0.00 39.64 39.01 1u1u n ILE 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1u1u n GLY 90 N 2.21 1.26 4.70 7.39 0.00 -1.26 -4.92 105.19 114.58 1u1u n GLY 90 Ca 0.03 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1u1u n GLY 90 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u1u n LEU 91 N 0.00 0.00 -0.46 0.99 4.77 -1.26 -2.72 117.00 118.32 1u1u n LEU 91 Ca 0.00 0.00 0.38 0.00 -0.03 0.00 0.00 56.01 56.36 1u1u n LEU 91 Cb 0.00 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 41.78 1u1u n LEU 91 CO 0.00 0.00 1.31 0.44 -1.33 0.00 0.00 177.39 177.81 1u1u h ASP 92 N 0.00 0.17 0.00 -1.43 3.32 -1.99 -1.31 116.42 115.19 1u1u h ASP 92 Ca 0.00 0.08 -0.20 0.00 0.02 0.00 0.00 57.03 56.92 1u1u h ASP 92 Cb 0.00 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 1u1u h ASP 92 CO 0.00 -0.08 -2.09 0.52 -1.72 0.00 0.00 179.24 175.88 1u1u n VAL 93 N -4.43 0.76 -0.04 -1.35 0.31 -1.10 -3.27 118.33 109.22 1u1u n VAL 93 Ca 0.35 -0.63 -0.13 0.00 -0.01 0.00 0.00 64.34 63.92 1u1u n VAL 93 Cb 1.46 -0.30 -0.08 0.00 -0.91 0.00 0.00 33.84 34.00 1u1u n VAL 93 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1u1u h TYR 94 N 0.00 0.25 0.00 3.52 3.20 -1.49 -3.27 116.97 119.17 1u1u h TYR 94 Ca -0.30 -0.08 -0.21 0.00 3.14 0.00 0.00 58.73 61.28 1u1u h TYR 94 Cb 1.63 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.82 1u1u h TYR 94 CO 0.00 0.65 -1.09 0.74 -1.64 0.00 0.00 178.16 176.83 1u1u h PHE 95 N -0.23 0.00 0.00 -3.82 0.04 -1.56 -2.06 116.94 109.31 1u1u h PHE 95 Ca 0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.78 1u1u h PHE 95 Cb 0.62 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.77 1u1u h PHE 95 CO 0.09 0.95 0.00 -1.13 -0.60 0.00 0.00 178.31 177.62 1u1u n SER 96 N -3.28 0.00 0.00 2.17 3.41 -1.20 0.25 113.62 114.97 1u1u n SER 96 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1u1u n SER 96 Cb 0.94 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.89 1u1u n SER 96 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u1u n ALA 98 N -0.34 0.00 0.36 7.33 0.00 -0.77 0.52 120.51 127.61 1u1u n ALA 98 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1u1u n ALA 98 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 1u1u n ALA 98 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1u1u n ARG 99 N 0.00 0.75 -0.73 0.00 1.85 0.71 -4.82 116.66 114.42 1u1u n ARG 99 Ca 0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 57.85 56.75 1u1u n ARG 99 Cb 0.00 -1.41 0.00 0.00 -1.05 0.00 0.00 32.46 30.00 1u1u n ARG 99 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1u1u n GLY 100 N 1.43 -3.94 3.96 2.89 0.00 0.19 -4.40 105.19 105.33 1u1u n GLY 100 Ca -0.01 -0.70 -0.23 0.00 0.00 0.00 0.00 46.02 45.09 1u1u n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u1u s ASN 101 N -0.22 4.99 -0.57 1.61 6.03 -0.90 -4.74 114.94 121.14 1u1u s ASN 101 Ca 0.00 0.08 -0.28 0.00 -1.03 0.00 0.00 52.86 51.63 1u1u s ASN 101 Cb 0.00 -0.82 0.02 0.00 -3.03 0.00 0.00 41.25 37.42 1u1u s ASN 101 CO 0.00 -1.39 1.36 0.00 -2.03 0.00 0.00 177.10 175.03 1u1u s ALA 102 N -2.97 2.85 0.00 3.54 0.00 -1.26 -2.92 121.76 121.00 1u1u s ALA 102 Ca 0.60 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.82 1u1u s ALA 102 Cb -0.10 -4.09 0.00 0.00 0.00 0.00 0.00 23.12 18.93 1u1u s ALA 102 CO 0.41 -2.88 0.00 -1.13 0.00 0.00 0.00 175.76 172.16 1u1u n SER 103 N 9.30 0.00 -3.90 0.00 3.41 -1.26 -5.09 113.62 116.08 1u1u n SER 103 Ca 0.11 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.55 1u1u n SER 103 Cb 0.49 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.29 1u1u n SER 103 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1u1u s VAL 104 N 0.00 0.34 0.72 -3.33 1.01 -1.15 -5.17 120.40 112.83 1u1u s VAL 104 Ca 0.00 -0.09 -0.12 0.00 0.00 0.00 0.00 61.98 61.76 1u1u s VAL 104 Cb 0.00 -0.35 0.03 0.00 0.00 0.00 0.00 36.38 36.06 1u1u s VAL 104 CO 0.00 0.14 1.10 -2.16 0.00 0.00 0.00 175.10 174.18 1u1u s PRO 105 N 0.47 2.51 0.00 2.72 0.04 -1.26 -2.11 135.00 137.37 1u1u s PRO 105 Ca -0.05 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.24 1u1u s PRO 105 Cb -0.08 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1u1u s PRO 105 CO -0.01 -1.46 0.00 0.00 0.04 0.00 0.00 177.00 175.58 1u1u n ALA 106 N -3.04 0.00 -3.37 8.56 0.00 -1.26 -4.67 120.51 116.73 1u1u n ALA 106 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.44 1u1u n ALA 106 Cb 0.53 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.99 1u1u n ALA 106 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1u1u n GLU 108 N 0.00 1.04 -3.12 0.00 2.13 -1.26 -4.89 120.64 114.54 1u1u n GLU 108 Ca 0.00 -1.22 0.00 0.00 0.66 0.00 0.00 57.16 56.60 1u1u n GLU 108 Cb 0.00 0.04 0.00 0.00 0.27 0.00 0.00 31.44 31.75 1u1u n GLU 108 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1u1u n THR 110 N -1.19 0.00 -2.83 6.31 5.66 -0.10 -3.07 114.28 119.06 1u1u n THR 110 Ca 0.02 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.64 1u1u n THR 110 Cb 0.23 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.94 1u1u n THR 110 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1u1u s LYS 111 N -1.22 4.61 -1.55 1.09 3.01 -1.26 0.48 119.74 124.90 1u1u s LYS 111 Ca 0.00 1.30 -0.12 0.00 -1.01 0.00 0.00 55.97 56.14 1u1u s LYS 111 Cb 0.00 -2.96 -0.04 0.00 -1.01 0.00 0.00 37.83 33.82 1u1u s LYS 111 CO 0.00 0.37 2.65 1.87 0.51 0.00 0.00 175.35 180.76 1u1u n TRP 112 N 0.88 2.85 0.00 3.18 -0.00 -0.06 -4.74 117.44 119.55 1u1u n TRP 112 Ca -0.00 -3.03 0.00 0.00 -0.00 0.00 0.00 57.50 54.47 1u1u n TRP 112 Cb 0.49 -2.51 0.00 0.00 -0.00 0.00 0.00 31.31 29.30 1u1u n TRP 112 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 1u1u n PHE 113 N 4.63 0.00 -0.02 5.87 3.01 -1.26 -3.25 117.46 126.44 1u1u n PHE 113 Ca 0.67 0.00 0.01 0.00 1.01 0.00 0.00 57.45 59.15 1u1u n PHE 113 Cb 0.29 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.79 1u1u n PHE 113 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1u1u n ASP 114 N 6.77 2.07 -4.89 4.37 5.75 -1.26 -5.04 116.55 124.32 1u1u n ASP 114 Ca 0.00 -1.89 -0.27 0.00 -0.01 0.00 0.00 54.79 52.62 1u1u n ASP 114 Cb 0.00 -0.04 0.08 0.00 -1.03 0.00 0.00 41.12 40.13 1u1u n ASP 114 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1u1u s THR 115 N -0.90 2.14 -0.32 2.12 -4.23 -1.20 -4.97 115.64 108.28 1u1u s THR 115 Ca 0.05 -0.15 0.03 0.00 -1.18 0.00 0.00 61.69 60.44 1u1u s THR 115 Cb 0.03 -3.00 0.48 0.00 1.34 0.00 0.00 72.50 71.35 1u1u s THR 115 CO 0.03 0.00 1.63 0.59 -0.54 0.00 0.00 174.62 176.33 1u1u n ASN 116 N -3.12 3.58 -4.62 3.99 3.02 -1.26 -4.31 115.26 112.53 1u1u n ASN 116 Ca 0.08 -3.10 -0.25 0.00 -0.03 0.00 0.00 54.58 51.28 1u1u n ASN 116 Cb 0.61 -0.73 -0.08 0.00 -0.61 0.00 0.00 39.78 38.96 1u1u n ASN 116 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1u1u s TYR 117 N -2.31 2.70 -0.03 3.10 5.04 -1.26 -4.51 117.35 120.08 1u1u s TYR 117 Ca 0.40 -0.20 0.05 0.00 -2.44 0.00 0.00 57.07 54.87 1u1u s TYR 117 Cb 0.33 -1.26 -0.01 0.00 0.35 0.00 0.00 41.96 41.38 1u1u s TYR 117 CO 0.08 0.57 -0.18 -1.01 -1.34 0.00 0.00 175.55 173.67 1u1u s HIS 118 N -2.01 1.71 0.39 4.97 3.76 -1.25 -0.88 115.29 121.98 1u1u s HIS 118 Ca 0.28 -0.41 0.08 0.00 -0.15 0.00 0.00 55.06 54.86 1u1u s HIS 118 Cb -0.08 -1.13 -0.06 0.00 1.11 0.00 0.00 32.58 32.43 1u1u s HIS 118 CO 0.18 -0.10 0.10 1.52 -0.85 0.00 0.00 174.74 175.59 1u1u s TYR 119 N -0.19 2.58 -0.50 1.40 -0.85 0.18 -4.56 117.35 115.41 1u1u s TYR 119 Ca 0.01 -0.56 -0.19 0.00 -0.52 0.00 0.00 57.07 55.81 1u1u s TYR 119 Cb -0.10 -1.80 0.05 0.00 0.38 0.00 0.00 41.96 40.50 1u1u s TYR 119 CO 0.01 0.32 0.61 0.42 -1.52 0.00 0.00 175.55 175.39 1u1u s ILE 120 N -2.60 4.88 -0.12 -3.49 -1.09 -1.26 -0.92 121.20 116.60 1u1u s ILE 120 Ca 0.38 -0.44 -0.29 0.00 -2.23 0.00 0.00 60.65 58.07 1u1u s ILE 120 Cb 0.04 -4.28 -0.06 0.00 -1.58 0.00 0.00 42.46 36.58 1u1u s ILE 120 CO 0.21 -0.77 2.02 -0.69 -1.23 0.00 0.00 174.94 174.48 1u1u s VAL 121 N 2.61 3.14 0.29 2.92 1.01 -1.17 -4.52 120.40 124.67 1u1u s VAL 121 Ca 0.15 0.15 -0.30 0.00 0.00 0.00 0.00 61.98 61.99 1u1u s VAL 121 Cb -0.19 -3.14 -0.13 0.00 0.00 0.00 0.00 36.38 32.93 1u1u s VAL 121 CO 0.13 -0.06 1.37 -2.65 0.00 0.00 0.00 175.10 173.89 1u1u n PRO 122 N 8.10 2.13 -3.58 2.72 -0.02 -1.26 -4.78 135.00 138.32 1u1u n PRO 122 Ca 0.24 0.76 -0.40 0.00 -2.02 0.00 0.00 63.50 62.07 1u1u n PRO 122 Cb 0.44 -2.39 -0.07 0.00 -0.02 0.00 0.00 33.50 31.45 1u1u n PRO 122 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1u1u s GLU 123 N -1.03 2.90 0.41 -0.52 2.02 -1.23 0.00 118.70 121.26 1u1u s GLU 123 Ca 0.62 -2.47 0.06 0.00 0.02 0.00 0.00 54.97 53.20 1u1u s GLU 123 Cb -0.60 -3.97 0.06 0.00 0.10 0.00 0.00 34.13 29.71 1u1u s GLU 123 CO 0.55 -1.21 0.46 1.28 0.02 0.00 0.00 175.26 176.35 1u1u n LEU 124 N 3.73 0.00 0.00 1.80 4.77 0.14 -4.59 117.00 122.84 1u1u n LEU 124 Ca 0.09 -1.95 0.00 0.00 -0.03 0.00 0.00 56.01 54.12 1u1u n LEU 124 Cb 0.41 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1u1u n LEU 124 CO 0.34 -0.58 0.00 0.61 -1.33 0.00 0.00 177.39 176.43 1u1u n GLY 125 N -0.02 -1.78 0.00 -0.72 0.00 -1.26 -1.71 105.19 99.70 1u1u n GLY 125 Ca 0.06 -1.17 0.13 0.00 0.00 0.00 0.00 46.02 45.04 1u1u n GLY 125 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1u1u n PRO 126 N -0.28 0.82 0.00 1.61 -0.02 -1.26 -3.84 135.00 132.03 1u1u n PRO 126 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.49 1u1u n PRO 126 Cb 0.00 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 31.99 1u1u n PRO 126 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1u1u n GLU 127 N -1.00 -0.26 -2.78 -0.52 4.07 -1.26 -5.03 120.64 113.87 1u1u n GLU 127 Ca 0.20 -0.56 -0.41 0.00 -0.06 0.00 0.00 57.16 56.32 1u1u n GLU 127 Cb 0.09 -1.00 -0.05 0.00 -0.06 0.00 0.00 31.44 30.42 1u1u n GLU 127 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1u1u s VAL 128 N -0.22 4.53 -0.49 6.31 0.11 -1.25 -5.02 120.40 124.38 1u1u s VAL 128 Ca 0.02 1.98 -0.12 0.00 -2.93 0.00 0.00 61.98 60.93 1u1u s VAL 128 Cb 0.01 -4.28 0.12 0.00 -1.53 0.00 0.00 36.38 30.70 1u1u s VAL 128 CO 0.02 0.33 0.39 0.21 -3.33 0.00 0.00 175.10 172.73 1u1u s ASN 129 N -0.06 5.88 0.57 3.54 2.47 -1.26 -5.02 114.94 121.06 1u1u s ASN 129 Ca 0.45 -1.81 -0.19 0.00 0.42 0.00 0.00 52.86 51.72 1u1u s ASN 129 Cb -0.23 -2.08 -0.05 0.00 -1.45 0.00 0.00 41.25 37.44 1u1u s ASN 129 CO 0.28 -0.74 1.18 -0.36 -3.72 0.00 0.00 177.10 173.75 1u1u s PHE 130 N 1.46 2.50 -0.19 0.43 0.08 -1.26 -4.77 117.98 116.23 1u1u s PHE 130 Ca 0.05 1.52 -0.17 0.00 0.12 0.00 0.00 56.93 58.45 1u1u s PHE 130 Cb -0.27 -3.41 0.05 0.00 -0.57 0.00 0.00 43.02 38.82 1u1u s PHE 130 CO 0.01 -1.96 0.51 0.45 -0.10 0.00 0.00 175.22 174.12 1u1u s SER 131 N -1.65 -0.55 -0.96 1.36 0.15 0.43 -4.95 113.70 107.54 1u1u s SER 131 Ca 0.75 1.03 -0.24 0.00 0.70 0.00 0.00 55.95 58.19 1u1u s SER 131 Cb -0.28 1.02 -0.04 0.00 -1.71 0.00 0.00 66.02 65.01 1u1u s SER 131 CO 0.31 -0.18 1.91 -0.47 1.20 0.00 0.00 173.24 176.00 1u1u s TYR 132 N 0.46 1.89 -0.23 3.44 6.14 -1.26 -0.87 117.35 126.92 1u1u s TYR 132 Ca -0.02 0.47 0.13 0.00 0.64 0.00 0.00 57.07 58.30 1u1u s TYR 132 Cb -0.04 -4.09 0.45 0.00 0.42 0.00 0.00 41.96 38.70 1u1u s TYR 132 CO -0.02 -1.68 1.18 0.00 0.64 0.00 0.00 175.55 175.68 1u1u n ALA 133 N 13.61 3.91 -2.93 3.97 0.00 -1.25 -4.93 120.51 132.88 1u1u n ALA 133 Ca 0.40 -3.31 -0.00 0.00 0.00 0.00 0.00 53.44 50.54 1u1u n ALA 133 Cb 0.47 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1u1u n ALA 133 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1u1u s SER 134 N -3.35 -0.99 0.00 0.00 0.15 -1.19 -1.89 113.70 106.43 1u1u s SER 134 Ca 0.41 -0.70 0.00 0.00 0.70 0.00 0.00 55.95 56.36 1u1u s SER 134 Cb 0.38 1.28 0.00 0.00 -1.71 0.00 0.00 66.02 65.97 1u1u s SER 134 CO -0.03 -0.09 0.61 1.41 1.20 0.00 0.00 173.24 176.34 1u1u n HIS 135 N 3.71 0.00 0.00 3.44 -0.00 -1.26 -4.36 115.22 116.75 1u1u n HIS 135 Ca 0.11 -0.22 -0.10 0.00 -0.00 0.00 0.00 57.72 57.50 1u1u n HIS 135 Cb 0.60 -0.16 -0.04 0.00 -0.00 0.00 0.00 29.99 30.39 1u1u n HIS 135 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.34 176.12 1u1u h LYS 136 N 0.34 -0.37 0.00 -0.41 3.64 -1.96 -0.03 116.57 117.78 1u1u h LYS 136 Ca 0.00 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1u1u h LYS 136 Cb 0.61 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1u1u h LYS 136 CO 0.00 -0.24 0.00 0.00 -2.27 0.00 0.00 179.45 176.94 1u1u n ALA 137 N -2.82 0.00 -0.34 5.00 0.00 -1.26 -1.60 120.51 119.49 1u1u n ALA 137 Ca -0.03 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.63 1u1u n ALA 137 Cb 0.32 0.22 0.45 0.00 0.00 0.00 0.00 19.45 20.44 1u1u n ALA 137 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1u1u h VAL 138 N 0.00 0.36 0.58 0.00 3.04 -1.89 -2.73 116.25 115.61 1u1u h VAL 138 Ca 0.00 -0.13 -0.03 0.00 -1.01 0.00 0.00 66.70 65.53 1u1u h VAL 138 Cb 0.00 -0.06 0.01 0.00 -2.01 0.00 0.00 31.29 29.22 1u1u h VAL 138 CO 0.00 0.07 -0.28 0.78 -1.01 0.00 0.00 177.57 177.13 1u1u h ASN 139 N 0.39 -0.66 -0.16 3.17 2.35 -0.55 -2.90 115.58 117.22 1u1u h ASN 139 Ca 0.71 -0.03 0.05 0.00 -0.55 0.00 0.00 56.30 56.48 1u1u h ASN 139 Cb 1.55 0.17 -0.01 0.00 0.05 0.00 0.00 38.32 40.08 1u1u h ASN 139 CO -0.57 -0.36 0.27 -0.33 -1.65 0.00 0.00 177.43 174.79 1u1u h GLU 140 N -0.95 0.00 0.25 0.81 5.08 -0.98 -0.82 114.58 117.97 1u1u h GLU 140 Ca -0.08 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1u1u h GLU 140 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1u1u h GLU 140 CO 0.13 0.00 -0.12 -0.92 -1.00 0.00 0.00 179.01 177.10 1u1u h TYR 141 N 0.00 -0.31 -0.20 4.33 3.20 -1.42 -2.48 116.97 120.09 1u1u h TYR 141 Ca 0.08 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.97 1u1u h TYR 141 Cb 0.62 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 1u1u h TYR 141 CO 0.00 0.06 0.14 0.87 -1.64 0.00 0.00 178.16 177.59 1u1u h LYS 142 N -0.78 0.15 0.00 1.82 1.57 -1.07 0.50 116.57 118.76 1u1u h LYS 142 Ca -0.03 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1u1u h LYS 142 Cb 0.51 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1u1u h LYS 142 CO 0.06 0.10 0.00 -1.91 -0.57 0.00 0.00 179.45 177.13 1u1u n GLU 143 N -4.50 0.00 -0.33 3.15 2.13 -0.43 0.09 120.64 120.75 1u1u n GLU 143 Ca 0.01 0.13 0.25 0.00 0.66 0.00 0.00 57.16 58.21 1u1u n GLU 143 Cb 0.16 -1.06 0.48 0.00 0.27 0.00 0.00 31.44 31.30 1u1u n GLU 143 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1u1u h ALA 144 N -2.00 1.85 -0.56 4.31 0.00 -1.36 0.98 119.26 122.48 1u1u h ALA 144 Ca 0.00 0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1u1u h ALA 144 Cb 0.00 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1u1u h ALA 144 CO 0.00 -0.76 0.18 -0.22 0.00 0.00 0.00 179.25 178.45 1u1u h LYS 145 N 0.08 0.87 0.00 0.00 1.63 -0.40 0.02 116.57 118.78 1u1u h LYS 145 Ca 0.75 -0.18 0.00 0.00 -0.85 0.00 0.00 60.65 60.37 1u1u h LYS 145 Cb 1.83 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 33.33 1u1u h LYS 145 CO -0.76 0.78 0.00 0.00 -3.45 0.00 0.00 179.45 176.03 1u1u n ALA 146 N -2.38 1.93 -0.60 5.00 0.00 0.33 -1.45 120.51 123.35 1u1u n ALA 146 Ca 0.03 -0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.46 1u1u n ALA 146 Cb 0.20 -1.20 0.20 0.00 0.00 0.00 0.00 19.45 18.65 1u1u n ALA 146 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1u1u n LEU 147 N -1.02 3.33 0.00 0.00 4.32 -0.02 -4.98 117.00 118.62 1u1u n LEU 147 Ca 0.09 -2.53 0.00 0.00 -0.02 0.00 0.00 56.01 53.55 1u1u n LEU 147 Cb 0.05 -0.38 0.00 0.00 -1.62 0.00 0.00 43.42 41.47 1u1u n LEU 147 CO 0.07 0.69 0.00 0.61 -1.22 0.00 0.00 177.39 177.54 1u1u n GLY 148 N -0.10 3.24 3.69 -0.72 0.00 -0.53 -5.03 105.19 105.74 1u1u n GLY 148 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1u1u n GLY 148 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u1u s VAL 149 N -2.14 4.44 -0.16 1.61 0.11 -1.11 -5.00 120.40 118.13 1u1u s VAL 149 Ca 0.00 -0.20 -0.13 0.00 -2.93 0.00 0.00 61.98 58.73 1u1u s VAL 149 Cb 0.00 -2.88 -0.05 0.00 -1.53 0.00 0.00 36.38 31.92 1u1u s VAL 149 CO 0.00 0.59 0.26 -0.62 -3.33 0.00 0.00 175.10 172.00 1u1u s ASP 150 N -0.75 6.40 0.51 3.54 2.15 -1.26 -2.19 116.67 125.06 1u1u s ASP 150 Ca 0.12 0.46 0.03 0.00 0.43 0.00 0.00 52.55 53.59 1u1u s ASP 150 Cb -0.12 -2.16 -0.01 0.00 -0.30 0.00 0.00 42.92 40.34 1u1u s ASP 150 CO 0.02 0.13 0.13 0.42 -0.17 0.00 0.00 175.17 175.70 1u1u s THR 151 N 0.35 1.43 -0.26 1.71 -4.23 -1.26 -4.70 115.64 108.68 1u1u s THR 151 Ca 0.15 -1.84 -0.05 0.00 -1.18 0.00 0.00 61.69 58.78 1u1u s THR 151 Cb -0.13 -2.27 0.01 0.00 1.34 0.00 0.00 72.50 71.46 1u1u s THR 151 CO 0.03 0.00 0.01 -0.69 -0.54 0.00 0.00 174.62 173.43 1u1u s VAL 152 N -2.82 3.52 -1.09 2.29 1.01 -0.63 -4.82 120.40 117.86 1u1u s VAL 152 Ca 0.18 -0.73 -0.24 0.00 0.00 0.00 0.00 61.98 61.19 1u1u s VAL 152 Cb 0.01 -2.75 -0.11 0.00 0.00 0.00 0.00 36.38 33.53 1u1u s VAL 152 CO 0.10 0.20 2.00 -2.84 0.00 0.00 0.00 175.10 174.56 1u1u s PRO 153 N 1.45 2.23 0.38 2.72 0.02 -1.26 -0.50 135.00 140.04 1u1u s PRO 153 Ca 0.03 -0.77 -0.28 0.00 0.02 0.00 0.00 61.00 60.00 1u1u s PRO 153 Cb -0.16 -5.14 -0.11 0.00 0.02 0.00 0.00 34.50 29.11 1u1u s PRO 153 CO -0.01 -4.15 1.48 0.08 -0.33 0.00 0.00 177.00 174.07 1u1u s VAL 154 N 12.08 2.05 0.05 3.83 1.01 -0.72 -2.52 120.40 136.18 1u1u s VAL 154 Ca 0.72 0.05 -0.15 0.00 0.00 0.00 0.00 61.98 62.61 1u1u s VAL 154 Cb -0.03 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.34 1u1u s VAL 154 CO 0.11 0.01 0.33 -0.76 0.00 0.00 0.00 175.10 174.79 1u1u s LEU 155 N -2.13 0.77 0.07 3.92 1.43 0.88 -4.78 118.68 118.84 1u1u s LEU 155 Ca 0.53 -0.17 -0.30 0.00 -1.03 0.00 0.00 54.13 53.16 1u1u s LEU 155 Cb -0.46 1.45 -0.05 0.00 0.03 0.00 0.00 46.19 47.16 1u1u s LEU 155 CO 0.63 -0.64 0.99 -0.69 0.23 0.00 0.00 176.35 176.87 1u1u s VAL 156 N -2.61 4.58 0.28 -1.59 1.01 -1.26 -0.80 120.40 120.00 1u1u s VAL 156 Ca -0.04 2.00 -0.30 0.00 0.00 0.00 0.00 61.98 63.63 1u1u s VAL 156 Cb -0.01 -4.28 -0.12 0.00 0.00 0.00 0.00 36.38 31.98 1u1u s VAL 156 CO -0.04 0.24 1.62 0.61 0.00 0.00 0.00 175.10 177.53 1u1u n GLY 157 N 2.55 1.38 0.00 4.51 0.00 0.83 -4.84 105.19 109.63 1u1u n GLY 157 Ca 0.04 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.55 1u1u n GLY 157 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1u1u n PRO 158 N 2.48 0.00 -0.34 1.61 -0.04 -1.26 -0.03 135.00 137.41 1u1u n PRO 158 Ca 0.10 0.35 -0.11 0.00 -0.04 0.00 0.00 63.50 63.79 1u1u n PRO 158 Cb 0.36 -0.96 -0.10 0.00 -0.04 0.00 0.00 33.50 32.76 1u1u n PRO 158 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1u1u h VAL 159 N 0.00 0.00 -1.00 0.52 3.04 -1.92 0.45 116.25 117.34 1u1u h VAL 159 Ca 0.00 0.00 0.33 0.00 -1.01 0.00 0.00 66.70 66.02 1u1u h VAL 159 Cb 0.00 0.00 -0.15 0.00 -2.01 0.00 0.00 31.29 29.13 1u1u h VAL 159 CO 0.00 0.00 0.56 0.28 -1.01 0.00 0.00 177.57 177.40 1u1u h SER 160 N -0.10 0.50 0.15 3.17 0.02 -1.86 0.50 113.55 115.93 1u1u h SER 160 Ca 0.13 0.19 0.02 0.00 -0.84 0.00 0.00 61.79 61.30 1u1u h SER 160 Cb 0.45 0.15 -0.04 0.00 0.14 0.00 0.00 62.40 63.10 1u1u h SER 160 CO -0.83 -0.15 -0.33 0.22 -1.14 0.00 0.00 176.83 174.60 1u1u h TYR 161 N 0.31 -0.90 0.05 3.45 3.20 0.36 -0.85 116.97 122.58 1u1u h TYR 161 Ca 0.74 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.62 1u1u h TYR 161 Cb 1.69 0.38 -0.00 0.00 1.54 0.00 0.00 36.73 40.34 1u1u h TYR 161 CO -0.01 -0.44 -0.03 -0.07 -1.64 0.00 0.00 178.16 175.97 1u1u h LEU 162 N -0.58 -0.06 -0.78 2.82 4.07 0.19 0.20 115.31 121.17 1u1u h LEU 162 Ca 0.02 0.00 0.18 0.00 0.08 0.00 0.00 57.88 58.17 1u1u h LEU 162 Cb 0.59 0.02 -0.13 0.00 1.08 0.00 0.00 40.66 42.22 1u1u h LEU 162 CO -0.17 -0.04 0.04 -0.07 -1.08 0.00 0.00 178.44 177.11 1u1u h LEU 163 N -0.07 -0.30 -0.11 1.67 3.38 -0.91 1.39 115.31 120.36 1u1u h LEU 163 Ca -0.00 0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1u1u h LEU 163 Cb 0.06 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1u1u h LEU 163 CO 0.01 -0.18 0.00 0.18 0.09 0.00 0.00 178.44 178.54 1u1u n LEU 164 N -5.33 0.34 -4.86 1.67 4.77 -0.35 -4.82 117.00 108.42 1u1u n LEU 164 Ca 0.15 0.55 -0.29 0.00 -0.03 0.00 0.00 56.01 56.38 1u1u n LEU 164 Cb 0.51 -0.46 0.09 0.00 -2.33 0.00 0.00 43.42 41.22 1u1u n LEU 164 CO 0.05 -0.19 0.75 -0.44 -1.33 0.00 0.00 177.39 176.23 1u1u s SER 165 N -3.64 4.60 -0.04 -1.43 0.01 0.48 -4.53 113.70 109.15 1u1u s SER 165 Ca 0.10 1.01 -0.02 0.00 1.31 0.00 0.00 55.95 58.35 1u1u s SER 165 Cb 0.14 -1.65 0.02 0.00 0.21 0.00 0.00 66.02 64.74 1u1u s SER 165 CO 0.48 -1.86 0.09 -0.54 0.41 0.00 0.00 173.24 171.81 1u1u s LYS 166 N -5.39 0.06 -0.48 12.44 -0.14 0.10 -4.90 119.74 121.44 1u1u s LYS 166 Ca 0.61 0.20 -0.27 0.00 -1.36 0.00 0.00 55.97 55.15 1u1u s LYS 166 Cb -0.12 -0.08 0.03 0.00 -1.68 0.00 0.00 37.83 35.97 1u1u s LYS 166 CO 0.51 -0.09 1.02 0.00 -0.76 0.00 0.00 175.35 176.04 1u1u s ALA 167 N 0.58 3.19 0.90 5.17 0.00 -1.25 0.24 121.76 130.58 1u1u s ALA 167 Ca -0.04 -0.69 -0.11 0.00 0.00 0.00 0.00 51.96 51.11 1u1u s ALA 167 Cb -0.06 -3.76 0.13 0.00 0.00 0.00 0.00 23.12 19.42 1u1u s ALA 167 CO -0.02 -2.18 1.09 0.00 0.00 0.00 0.00 175.76 174.65 1u1u s ALA 168 N 4.10 1.50 0.08 0.00 0.00 -0.69 -4.85 121.76 121.90 1u1u s ALA 168 Ca 0.41 0.11 -0.02 0.00 0.00 0.00 0.00 51.96 52.46 1u1u s ALA 168 Cb -0.09 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.76 1u1u s ALA 168 CO 0.28 -2.43 -0.03 0.36 0.00 0.00 0.00 175.76 173.94 1u1u n LYS 169 N -3.96 0.00 0.00 0.00 2.85 -1.26 -3.97 118.16 111.82 1u1u n LYS 169 Ca 0.08 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 1u1u n LYS 169 Cb 0.54 -0.13 0.00 0.00 -0.65 0.00 0.00 35.03 34.79 1u1u n LYS 169 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1u1u n GLY 170 N 0.36 1.47 0.00 2.58 0.00 -1.26 -5.00 105.19 103.34 1u1u n GLY 170 Ca 0.01 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1u1u n GLY 170 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1u1u n VAL 171 N 0.00 0.00 -1.52 1.61 0.31 -1.25 -4.75 118.33 112.73 1u1u n VAL 171 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.94 1u1u n VAL 171 Cb 0.00 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 32.96 1u1u n VAL 171 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1u1u n ASP 172 N 0.00 -0.31 -0.34 4.52 5.75 -1.26 -4.85 116.55 120.06 1u1u n ASP 172 Ca 0.00 0.81 0.03 0.00 -0.01 0.00 0.00 54.79 55.62 1u1u n ASP 172 Cb 0.00 -1.24 0.17 0.00 -1.03 0.00 0.00 41.12 39.03 1u1u n ASP 172 CO 0.00 0.00 0.00 0.07 -0.11 0.00 0.00 177.20 177.16 1u1u h LYS 173 N 0.54 0.99 -0.86 0.11 2.10 -2.03 -2.72 116.57 114.71 1u1u h LYS 173 Ca -0.45 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.14 1u1u h LYS 173 Cb 1.38 -0.22 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 1u1u h LYS 173 CO 0.50 0.66 0.00 0.43 -2.00 0.00 0.00 179.45 179.04 1u1u n SER 174 N -4.59 0.67 -4.83 7.07 7.64 -1.26 -4.82 113.62 113.49 1u1u n SER 174 Ca 0.15 -0.75 -0.35 0.00 1.01 0.00 0.00 58.87 58.92 1u1u n SER 174 Cb 0.22 -0.19 -0.06 0.00 -1.01 0.00 0.00 64.21 63.18 1u1u n SER 174 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1u1u s PHE 175 N -0.36 3.62 -0.88 1.43 5.36 -1.03 -5.03 117.98 121.09 1u1u s PHE 175 Ca 0.00 1.17 -0.14 0.00 -0.96 0.00 0.00 56.93 57.00 1u1u s PHE 175 Cb 0.00 -2.45 0.21 0.00 -0.34 0.00 0.00 43.02 40.44 1u1u s PHE 175 CO 0.00 0.39 0.86 -1.21 -1.46 0.00 0.00 175.22 173.81 1u1u s GLU 176 N -1.98 3.67 0.00 10.12 0.41 -1.26 -4.90 118.70 124.76 1u1u s GLU 176 Ca 0.40 -2.44 0.00 0.00 -0.41 0.00 0.00 54.97 52.52 1u1u s GLU 176 Cb -0.15 -4.52 0.00 0.00 -1.78 0.00 0.00 34.13 27.67 1u1u s GLU 176 CO 0.20 -1.36 0.47 1.28 -0.49 0.00 0.00 175.26 175.36 1u1u n LEU 177 N 4.25 0.00 -0.44 1.80 4.77 -1.26 0.79 117.00 126.91 1u1u n LEU 177 Ca 0.17 0.11 0.07 0.00 -0.03 0.00 0.00 56.01 56.33 1u1u n LEU 177 Cb 0.47 -0.11 0.15 0.00 -2.33 0.00 0.00 43.42 41.59 1u1u n LEU 177 CO 0.37 -0.11 0.61 -0.11 -1.33 0.00 0.00 177.39 176.82 1u1u n LEU 178 N -0.97 2.88 0.04 2.23 7.94 -1.26 -4.47 117.00 123.39 1u1u n LEU 178 Ca 0.00 -2.60 0.12 0.00 -1.11 0.00 0.00 56.01 52.42 1u1u n LEU 178 Cb 0.13 -0.33 0.25 0.00 0.53 0.00 0.00 43.42 43.99 1u1u n LEU 178 CO 0.00 0.66 0.47 -1.54 -1.11 0.00 0.00 177.39 175.87 1u1u n SER 179 N -0.53 0.60 0.00 1.96 3.41 0.24 -3.60 113.62 115.70 1u1u n SER 179 Ca 0.13 0.10 0.13 0.00 -0.26 0.00 0.00 58.87 58.98 1u1u n SER 179 Cb 0.59 0.04 0.66 0.00 -0.26 0.00 0.00 64.21 65.25 1u1u n SER 179 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1u1u n LEU 180 N -1.93 0.00 -0.29 1.04 4.77 -1.26 -4.25 117.00 115.08 1u1u n LEU 180 Ca 0.04 0.32 0.06 0.00 -0.03 0.00 0.00 56.01 56.40 1u1u n LEU 180 Cb 0.41 -0.32 0.15 0.00 -2.33 0.00 0.00 43.42 41.33 1u1u n LEU 180 CO 0.35 -0.03 0.75 -0.07 -1.33 0.00 0.00 177.39 177.06 1u1u h LEU 181 N 0.00 -0.60 -0.05 2.23 3.38 -1.90 0.13 115.31 118.49 1u1u h LEU 181 Ca 0.00 0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1u1u h LEU 181 Cb 0.29 0.46 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1u1u h LEU 181 CO 0.00 -0.26 0.00 -0.65 0.09 0.00 0.00 178.44 177.62 1u1u h PRO 182 N 0.03 0.00 0.00 1.13 0.11 -1.90 -0.70 132.00 130.67 1u1u h PRO 182 Ca 0.44 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 66.36 1u1u h PRO 182 Cb 0.76 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.84 1u1u h PRO 182 CO -0.82 0.00 -1.05 -0.22 -0.21 0.00 0.00 178.00 175.70 1u1u h LYS 183 N 0.00 0.00 0.00 1.05 3.64 -1.07 -3.33 116.57 116.86 1u1u h LYS 183 Ca 0.00 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 1u1u h LYS 183 Cb 0.81 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.61 1u1u h LYS 183 CO 0.00 0.71 -2.03 0.44 -2.27 0.00 0.00 179.45 176.30 1u1u n ILE 184 N -3.21 0.58 0.25 2.00 -5.35 -0.47 -4.44 119.36 108.72 1u1u n ILE 184 Ca -0.04 -0.64 0.14 0.00 -0.27 0.00 0.00 62.75 61.94 1u1u n ILE 184 Cb 0.90 -0.23 0.80 0.00 -1.74 0.00 0.00 39.64 39.37 1u1u n ILE 184 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 1u1u h LEU 185 N 0.00 0.00 0.20 7.28 5.85 -1.23 -2.78 115.31 124.63 1u1u h LEU 185 Ca -0.19 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.23 1u1u h LEU 185 Cb 1.46 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.51 1u1u h LEU 185 CO 0.01 0.00 -1.36 -0.65 -0.34 0.00 0.00 178.44 176.10 1u1u h PRO 186 N 0.00 0.42 0.00 5.25 0.11 -1.78 -2.87 132.00 133.14 1u1u h PRO 186 Ca 0.03 -0.72 0.00 0.00 0.11 0.00 0.00 66.00 65.42 1u1u h PRO 186 Cb 0.15 0.27 0.00 0.00 0.11 0.00 0.00 31.00 31.53 1u1u h PRO 186 CO -0.00 1.34 0.12 0.82 -0.21 0.00 0.00 178.00 180.08 1u1u h ILE 187 N -0.05 0.00 0.16 4.15 2.04 -1.74 0.83 117.51 122.90 1u1u h ILE 187 Ca -0.25 0.00 -0.31 0.00 1.00 0.00 0.00 64.86 65.30 1u1u h ILE 187 Cb 1.98 0.72 0.03 0.00 -0.74 0.00 0.00 36.82 38.81 1u1u h ILE 187 CO 0.20 0.00 -1.31 1.88 0.00 0.00 0.00 178.15 178.92 1u1u h TYR 188 N 0.00 0.96 0.61 1.37 -1.99 -1.44 -3.26 116.97 113.22 1u1u h TYR 188 Ca 0.00 -0.64 -0.03 0.00 2.00 0.00 0.00 58.73 60.06 1u1u h TYR 188 Cb 0.25 -0.06 0.01 0.00 2.00 0.00 0.00 36.73 38.92 1u1u h TYR 188 CO 0.00 1.48 -0.29 0.87 -0.00 0.00 0.00 178.16 180.22 1u1u h LYS 189 N 0.22 -0.79 -0.79 4.88 1.57 0.83 -2.02 116.57 120.47 1u1u h LYS 189 Ca -0.20 0.05 0.26 0.00 -1.87 0.00 0.00 60.65 58.89 1u1u h LYS 189 Cb 1.99 0.18 -0.15 0.00 0.08 0.00 0.00 32.23 34.34 1u1u h LYS 189 CO 0.25 -0.52 0.17 0.39 -0.57 0.00 0.00 179.45 179.17 1u1u n GLU 190 N -4.39 -0.06 0.00 3.15 -0.58 -0.26 -0.42 120.64 118.08 1u1u n GLU 190 Ca -0.10 1.15 0.00 0.00 -0.42 0.00 0.00 57.16 57.79 1u1u n GLU 190 Cb 0.32 -1.92 0.00 0.00 -0.57 0.00 0.00 31.44 29.27 1u1u n GLU 190 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1u1u n VAL 191 N -5.00 0.00 -0.12 2.62 0.31 -1.07 -2.25 118.33 112.83 1u1u n VAL 191 Ca 0.23 1.24 -0.03 0.00 -0.01 0.00 0.00 64.34 65.77 1u1u n VAL 191 Cb 0.77 -2.21 -0.03 0.00 -0.91 0.00 0.00 33.84 31.46 1u1u n VAL 191 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1u1u n ILE 192 N -1.69 -0.19 -0.23 2.52 2.08 0.44 0.83 119.36 123.13 1u1u n ILE 192 Ca 0.00 0.79 -0.00 0.00 0.56 0.00 0.00 62.75 64.10 1u1u n ILE 192 Cb 0.00 -0.99 0.22 0.00 -0.75 0.00 0.00 39.64 38.12 1u1u n ILE 192 CO 0.00 0.00 0.00 0.71 0.56 0.00 0.00 176.55 177.82 1u1u h THR 193 N 0.00 1.21 -0.76 1.39 1.35 -1.45 1.17 112.91 115.82 1u1u h THR 193 Ca 0.04 -0.41 -0.02 0.00 -0.55 0.00 0.00 66.41 65.47 1u1u h THR 193 Cb 0.11 0.09 -0.04 0.00 -1.73 0.00 0.00 68.15 66.59 1u1u h THR 193 CO -0.26 0.21 0.40 -0.33 -0.25 0.00 0.00 175.52 175.29 1u1u h GLU 194 N 1.05 1.07 0.08 4.72 5.08 0.90 0.26 114.58 127.74 1u1u h GLU 194 Ca 0.28 -0.14 -0.27 0.00 -1.00 0.00 0.00 59.36 58.23 1u1u h GLU 194 Cb -0.08 -0.20 0.02 0.00 0.50 0.00 0.00 28.75 28.98 1u1u h GLU 194 CO -0.06 0.81 -1.15 -0.07 -1.00 0.00 0.00 179.01 177.54 1u1u h LEU 195 N 1.06 0.68 -0.28 1.33 4.07 -0.65 -1.01 115.31 120.52 1u1u h LEU 195 Ca 0.26 -0.62 0.07 0.00 0.08 0.00 0.00 57.88 57.67 1u1u h LEU 195 Cb 0.06 -0.21 -0.08 0.00 1.08 0.00 0.00 40.66 41.51 1u1u h LEU 195 CO -0.04 1.44 -0.26 0.50 -1.08 0.00 0.00 178.44 179.00 1u1u h LYS 196 N 0.23 -0.24 0.00 1.13 3.64 0.17 1.23 116.57 122.73 1u1u h LYS 196 Ca -0.14 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1u1u h LYS 196 Cb 1.82 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.69 1u1u h LYS 196 CO 0.21 -0.16 0.00 0.00 -2.27 0.00 0.00 179.45 177.23 1u1u n ALA 197 N -2.85 2.31 0.00 5.00 0.00 0.88 -2.78 120.51 123.08 1u1u n ALA 197 Ca -0.00 -0.11 -0.12 0.00 0.00 0.00 0.00 53.44 53.21 1u1u n ALA 197 Cb 0.30 -1.28 -0.14 0.00 0.00 0.00 0.00 19.45 18.33 1u1u n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u1u h ALA 198 N 3.18 0.60 0.00 0.00 0.00 0.29 -3.48 119.26 119.86 1u1u h ALA 198 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 54.91 53.57 1u1u h ALA 198 Cb 0.00 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1u1u h ALA 198 CO 0.00 1.44 0.00 0.41 0.00 0.00 0.00 179.25 181.10 1u1u n GLY 199 N 1.62 -0.59 3.76 0.00 0.00 -0.85 -5.01 105.19 104.12 1u1u n GLY 199 Ca -0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1u1u n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u1u s ALA 200 N -0.41 3.59 -0.03 4.61 0.00 -1.08 -4.95 121.76 123.49 1u1u s ALA 200 Ca 0.00 1.43 0.08 0.00 0.00 0.00 0.00 51.96 53.47 1u1u s ALA 200 Cb 0.00 -3.57 -0.12 0.00 0.00 0.00 0.00 23.12 19.43 1u1u s ALA 200 CO 0.00 -0.86 0.13 0.25 0.00 0.00 0.00 175.76 175.28 1u1u n THR 201 N 1.26 0.18 -4.20 0.00 -2.24 -1.26 -4.78 114.28 103.24 1u1u n THR 201 Ca 0.03 -0.24 -0.12 0.00 -2.27 0.00 0.00 64.05 61.45 1u1u n THR 201 Cb 0.40 -0.06 -0.10 0.00 -2.10 0.00 0.00 70.33 68.47 1u1u n THR 201 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1u1u s TRP 202 N -2.46 1.07 0.06 4.78 0.52 -1.26 -3.79 118.94 117.87 1u1u s TRP 202 Ca -0.03 -1.21 -0.17 0.00 0.02 0.00 0.00 56.10 54.70 1u1u s TRP 202 Cb 0.04 -0.59 0.03 0.00 -1.15 0.00 0.00 33.47 31.81 1u1u s TRP 202 CO 0.34 -0.46 0.39 -1.50 0.02 0.00 0.00 176.95 175.75 1u1u s ILE 203 N -3.95 0.06 -0.06 2.03 2.07 -1.09 -4.38 121.20 115.88 1u1u s ILE 203 Ca 0.29 -0.53 0.05 0.00 -1.41 0.00 0.00 60.65 59.05 1u1u s ILE 203 Cb 0.07 -1.01 -0.01 0.00 0.13 0.00 0.00 42.46 41.65 1u1u s ILE 203 CO 0.06 -0.29 -0.21 -1.58 -1.91 0.00 0.00 174.94 171.00 1u1u s GLN 204 N -2.81 2.29 -0.24 3.50 0.74 -1.05 -1.94 119.66 120.14 1u1u s GLN 204 Ca -0.03 -0.77 0.01 0.00 0.05 0.00 0.00 55.36 54.61 1u1u s GLN 204 Cb -0.00 -1.92 0.07 0.00 1.10 0.00 0.00 33.01 32.26 1u1u s GLN 204 CO -0.05 0.29 -0.03 -0.51 -0.55 0.00 0.00 175.29 174.44 1u1u s LEU 205 N 0.01 2.63 -0.15 3.68 1.43 0.30 -0.09 118.68 126.49 1u1u s LEU 205 Ca -0.06 -1.26 -0.28 0.00 -1.03 0.00 0.00 54.13 51.50 1u1u s LEU 205 Cb -0.14 -1.16 -0.01 0.00 0.03 0.00 0.00 46.19 44.92 1u1u s LEU 205 CO 0.04 -0.26 0.96 -1.81 0.23 0.00 0.00 176.35 175.51 1u1u s ASP 206 N 1.40 7.14 -0.38 2.29 1.11 0.02 0.87 116.67 129.11 1u1u s ASP 206 Ca -0.03 1.41 0.11 0.00 0.18 0.00 0.00 52.55 54.22 1u1u s ASP 206 Cb -0.19 -2.52 0.34 0.00 1.07 0.00 0.00 42.92 41.62 1u1u s ASP 206 CO -0.08 -0.47 0.73 -0.62 1.18 0.00 0.00 175.17 175.90 1u1u n GLU 207 N 5.31 1.05 -0.05 8.23 -0.58 0.69 -0.12 120.64 135.16 1u1u n GLU 207 Ca 0.08 -3.43 0.14 0.00 -0.42 0.00 0.00 57.16 53.53 1u1u n GLU 207 Cb 0.48 -1.70 0.55 0.00 -0.57 0.00 0.00 31.44 30.20 1u1u n GLU 207 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1u1u h PRO 208 N 3.07 0.30 -0.20 3.49 0.13 -1.91 -2.77 132.00 134.11 1u1u h PRO 208 Ca 0.10 -0.02 0.06 0.00 -0.87 0.00 0.00 66.00 65.27 1u1u h PRO 208 Cb 0.95 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 1u1u h PRO 208 CO 0.51 0.20 0.35 0.28 -0.23 0.00 0.00 178.00 179.10 1u1u h VAL 209 N 0.30 0.23 0.00 1.56 2.07 -1.92 0.19 116.25 118.68 1u1u h VAL 209 Ca 0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.78 1u1u h VAL 209 Cb 0.63 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1u1u h VAL 209 CO -0.06 0.00 0.00 -0.07 0.02 0.00 0.00 177.57 177.46 1u1u h LEU 210 N 0.00 0.00 -4.27 2.57 3.38 -1.88 -3.41 115.31 111.70 1u1u h LEU 210 Ca 0.09 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.59 1u1u h LEU 210 Cb 0.79 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.37 1u1u h LEU 210 CO -0.00 0.00 0.43 1.33 0.09 0.00 0.00 178.44 180.29 1u1u n VAL 211 N -2.98 3.21 -3.84 1.22 0.24 0.66 -4.62 118.33 112.22 1u1u n VAL 211 Ca -0.03 -2.70 -0.31 0.00 -2.04 0.00 0.00 64.34 59.26 1u1u n VAL 211 Cb 0.09 -1.51 -0.11 0.00 -1.47 0.00 0.00 33.84 30.83 1u1u n VAL 211 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1u1u s ASP 213 N 0.21 4.97 0.04 -1.34 1.01 -1.26 -4.72 116.67 115.58 1u1u s ASP 213 Ca 0.52 -3.52 -0.24 0.00 0.71 0.00 0.00 52.55 50.02 1u1u s ASP 213 Cb 0.36 -1.71 -0.06 0.00 1.01 0.00 0.00 42.92 42.52 1u1u s ASP 213 CO -0.17 -0.17 0.73 -0.76 0.21 0.00 0.00 175.17 175.01 1u1u s LEU 214 N -1.01 4.45 0.81 1.23 2.01 -1.26 -5.04 118.68 119.86 1u1u s LEU 214 Ca 0.23 1.39 -0.12 0.00 0.01 0.00 0.00 54.13 55.64 1u1u s LEU 214 Cb -0.12 -3.17 0.08 0.00 0.01 0.00 0.00 46.19 42.99 1u1u s LEU 214 CO -0.10 0.04 1.12 -1.83 1.01 0.00 0.00 176.35 176.59 1u1u s GLU 215 N -0.13 1.99 0.50 1.70 -1.05 -1.26 -4.69 118.70 115.76 1u1u s GLU 215 Ca 0.37 0.43 0.32 0.00 -0.15 0.00 0.00 54.97 55.93 1u1u s GLU 215 Cb -0.20 -1.93 1.43 0.00 -0.44 0.00 0.00 34.13 32.99 1u1u s GLU 215 CO 0.22 -1.64 1.78 0.78 0.95 0.00 0.00 175.26 177.35 1u1u h GLY 216 N -1.10 0.40 0.50 -3.83 0.00 -2.00 -1.93 103.07 95.11 1u1u h GLY 216 Ca -0.47 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 1u1u h GLY 216 CO 0.62 -0.06 -0.10 1.46 0.00 0.00 0.00 176.54 178.46 1u1u h GLN 217 N 0.11 -0.28 -0.36 4.80 7.50 -2.02 -3.23 115.11 121.64 1u1u h GLN 217 Ca 0.59 0.02 0.01 0.00 0.50 0.00 0.00 58.65 59.77 1u1u h GLN 217 Cb 2.10 0.06 -0.02 0.00 0.05 0.00 0.00 27.48 29.67 1u1u h GLN 217 CO -0.11 0.10 0.22 0.87 -1.50 0.00 0.00 178.83 178.42 1u1u h LYS 218 N -0.80 0.44 -0.64 1.46 1.57 -1.72 -3.04 116.57 113.84 1u1u h LYS 218 Ca -0.03 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.79 1u1u h LYS 218 Cb 0.51 -0.10 -0.09 0.00 0.08 0.00 0.00 32.23 32.63 1u1u h LYS 218 CO 0.05 0.29 -0.49 -0.07 -0.57 0.00 0.00 179.45 178.66 1u1u h LEU 219 N 0.46 -1.73 -0.51 2.94 3.38 -1.50 -0.54 115.31 117.81 1u1u h LEU 219 Ca 0.14 0.25 0.06 0.00 0.09 0.00 0.00 57.88 58.42 1u1u h LEU 219 Cb -0.03 0.74 -0.07 0.00 0.09 0.00 0.00 40.66 41.39 1u1u h LEU 219 CO -0.05 -0.25 -0.24 1.67 0.09 0.00 0.00 178.44 179.66 1u1u n GLN 220 N -4.92 -0.16 -0.15 1.13 -0.06 -1.15 0.54 117.38 112.61 1u1u n GLN 220 Ca -0.00 0.78 0.13 0.00 -2.00 0.00 0.00 57.00 55.91 1u1u n GLN 220 Cb 0.25 -1.15 0.25 0.00 -4.06 0.00 0.00 30.24 25.53 1u1u n GLN 220 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1u1u n ALA 221 N -3.68 0.43 0.20 1.69 0.00 -0.21 0.25 120.51 119.18 1u1u n ALA 221 Ca 0.03 0.47 -0.15 0.00 0.00 0.00 0.00 53.44 53.80 1u1u n ALA 221 Cb 0.17 -0.45 -0.07 0.00 0.00 0.00 0.00 19.45 19.10 1u1u n ALA 221 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1u1u h PHE 222 N 0.00 -0.55 0.66 0.00 -1.00 -0.03 -2.90 116.94 113.12 1u1u h PHE 222 Ca 0.37 -0.00 -0.03 0.00 2.81 0.00 0.00 57.97 61.12 1u1u h PHE 222 Cb 0.95 0.20 -0.01 0.00 3.61 0.00 0.00 35.95 40.70 1u1u h PHE 222 CO -0.04 -0.32 -0.45 1.15 -1.61 0.00 0.00 178.31 177.03 1u1u h THR 223 N -0.51 0.00 0.00 -1.55 2.02 0.32 -1.69 112.91 111.50 1u1u h THR 223 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1u1u h THR 223 Cb 0.43 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 1u1u h THR 223 CO 0.01 0.00 0.28 0.61 0.37 0.00 0.00 175.52 176.80 1u1u n GLY 224 N -1.56 -0.38 0.03 2.16 0.00 -1.01 -0.04 105.19 104.39 1u1u n GLY 224 Ca -0.13 0.04 0.03 0.00 0.00 0.00 0.00 46.02 45.96 1u1u n GLY 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u1u n ALA 225 N -1.36 2.29 0.83 4.61 0.00 -0.89 -4.28 120.51 121.71 1u1u n ALA 225 Ca -0.00 -0.53 0.12 0.00 0.00 0.00 0.00 53.44 53.02 1u1u n ALA 225 Cb 0.29 -0.38 0.13 0.00 0.00 0.00 0.00 19.45 19.49 1u1u n ALA 225 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1u1u n TYR 226 N -2.17 0.14 1.27 0.00 4.02 0.94 -3.15 117.16 118.21 1u1u n TYR 226 Ca -0.09 0.04 0.13 0.00 -0.01 0.00 0.00 57.90 57.97 1u1u n TYR 226 Cb 0.56 -0.31 0.39 0.00 -0.02 0.00 0.00 39.34 39.96 1u1u n TYR 226 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1u1u n ALA 227 N -1.63 3.03 0.50 -0.72 0.00 -0.18 -2.93 120.51 118.57 1u1u n ALA 227 Ca 0.04 -0.41 0.11 0.00 0.00 0.00 0.00 53.44 53.18 1u1u n ALA 227 Cb 0.37 -1.14 -0.06 0.00 0.00 0.00 0.00 19.45 18.63 1u1u n ALA 227 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1u1u n GLU 228 N -0.57 0.33 -0.10 0.00 4.07 -1.19 -4.41 120.64 118.78 1u1u n GLU 228 Ca 0.13 -0.05 -0.11 0.00 -0.06 0.00 0.00 57.16 57.07 1u1u n GLU 228 Cb 0.35 -1.56 -0.16 0.00 -0.06 0.00 0.00 31.44 30.01 1u1u n GLU 228 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1u1u n LEU 229 N -1.96 0.30 -0.23 4.31 4.32 -1.21 -4.53 117.00 118.00 1u1u n LEU 229 Ca 0.01 -0.00 0.23 0.00 -0.02 0.00 0.00 56.01 56.22 1u1u n LEU 229 Cb 0.45 0.36 0.42 0.00 -1.62 0.00 0.00 43.42 43.03 1u1u n LEU 229 CO 0.42 0.54 0.75 1.21 -1.22 0.00 0.00 177.39 179.09 1u1u n GLU 230 N -2.81 -0.04 0.09 3.23 2.13 -1.15 0.24 120.64 122.33 1u1u n GLU 230 Ca -0.34 0.98 -0.13 0.00 0.66 0.00 0.00 57.16 58.33 1u1u n GLU 230 Cb 1.14 -1.76 -0.08 0.00 0.27 0.00 0.00 31.44 31.01 1u1u n GLU 230 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1u1u h SER 231 N 0.00 -0.15 -0.63 4.31 0.87 -1.87 -3.12 113.55 112.96 1u1u h SER 231 Ca 0.60 -0.14 -0.04 0.00 -1.23 0.00 0.00 61.79 60.98 1u1u h SER 231 Cb 1.59 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 63.56 1u1u h SER 231 CO -0.55 0.04 0.23 0.74 -0.53 0.00 0.00 176.83 176.77 1u1u h THR 232 N -0.35 1.24 -0.09 2.23 2.02 0.28 -2.93 112.91 115.31 1u1u h THR 232 Ca -0.02 -0.78 -0.04 0.00 0.77 0.00 0.00 66.41 66.34 1u1u h THR 232 Cb 0.28 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 1u1u h THR 232 CO 0.03 0.31 0.05 0.18 0.37 0.00 0.00 175.52 176.46 1u1u n LEU 233 N -4.29 2.93 -4.69 2.58 7.99 -0.32 -4.89 117.00 116.31 1u1u n LEU 233 Ca 0.06 -1.48 -0.42 0.00 -0.01 0.00 0.00 56.01 54.15 1u1u n LEU 233 Cb 0.19 -0.53 -0.03 0.00 -0.11 0.00 0.00 43.42 42.95 1u1u n LEU 233 CO 0.40 0.49 1.48 -0.44 -1.51 0.00 0.00 177.39 177.81 1u1u s SER 234 N 0.58 6.41 -1.31 -1.43 0.01 -1.11 -2.91 113.70 113.94 1u1u s SER 234 Ca 0.05 2.78 -0.09 0.00 1.31 0.00 0.00 55.95 60.01 1u1u s SER 234 Cb 0.05 -2.57 -0.00 0.00 0.21 0.00 0.00 66.02 63.71 1u1u s SER 234 CO 0.01 -1.01 0.55 0.61 0.41 0.00 0.00 173.24 173.81 1u1u n GLY 235 N 4.24 -0.50 3.24 3.44 0.00 -1.26 -4.97 105.19 109.38 1u1u n GLY 235 Ca 0.18 0.25 -0.01 0.00 0.00 0.00 0.00 46.02 46.44 1u1u n GLY 235 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1u1u s LEU 236 N -6.84 -1.08 0.32 0.99 2.96 -1.15 -5.08 118.68 108.81 1u1u s LEU 236 Ca 0.18 0.94 -0.29 0.00 -0.22 0.00 0.00 54.13 54.74 1u1u s LEU 236 Cb -0.07 1.89 -0.11 0.00 0.50 0.00 0.00 46.19 48.40 1u1u s LEU 236 CO 0.88 -0.25 1.41 0.20 -1.32 0.00 0.00 176.35 177.27 1u1u s ASN 237 N 2.78 6.59 -0.04 3.68 0.01 -1.25 -4.92 114.94 121.80 1u1u s ASN 237 Ca 0.10 2.81 0.07 0.00 -0.71 0.00 0.00 52.86 55.12 1u1u s ASN 237 Cb -0.14 -2.65 -0.02 0.00 0.41 0.00 0.00 41.25 38.86 1u1u s ASN 237 CO -0.18 -0.70 -0.25 -0.69 -1.51 0.00 0.00 177.10 173.77 1u1u s VAL 238 N -0.81 1.98 -0.31 1.60 1.01 -1.26 -2.66 120.40 119.95 1u1u s VAL 238 Ca 0.53 -1.05 0.03 0.00 0.00 0.00 0.00 61.98 61.49 1u1u s VAL 238 Cb -0.43 -1.66 0.09 0.00 0.00 0.00 0.00 36.38 34.38 1u1u s VAL 238 CO 0.54 0.56 0.01 -0.22 0.00 0.00 0.00 175.10 175.98 1u1u s LEU 239 N -0.39 4.02 -0.17 3.92 1.98 -0.82 -2.02 118.68 125.19 1u1u s LEU 239 Ca 0.04 -1.85 -0.25 0.00 -2.89 0.00 0.00 54.13 49.18 1u1u s LEU 239 Cb -0.11 -1.49 -0.02 0.00 0.66 0.00 0.00 46.19 45.23 1u1u s LEU 239 CO 0.01 -0.33 0.81 0.68 -1.89 0.00 0.00 176.35 175.63 1u1u s VAL 240 N 1.07 4.90 0.22 1.68 -7.23 -0.93 -0.54 120.40 119.56 1u1u s VAL 240 Ca 0.05 1.59 -0.00 0.00 -1.81 0.00 0.00 61.98 61.81 1u1u s VAL 240 Cb -0.19 -4.12 -0.04 0.00 0.56 0.00 0.00 36.38 32.59 1u1u s VAL 240 CO -0.09 0.04 0.41 -1.61 -0.31 0.00 0.00 175.10 173.53 1u1u s GLU 241 N 2.11 3.51 -0.02 4.82 0.41 0.25 -2.19 118.70 127.59 1u1u s GLU 241 Ca 0.37 -0.37 -0.17 0.00 -0.41 0.00 0.00 54.97 54.39 1u1u s GLU 241 Cb -0.16 -2.82 0.03 0.00 -1.78 0.00 0.00 34.13 29.39 1u1u s GLU 241 CO 0.12 0.38 0.36 0.95 -0.49 0.00 0.00 175.26 176.57 1u1u s THR 242 N -1.93 0.05 -0.06 3.63 -4.23 -0.93 -0.22 115.64 111.95 1u1u s THR 242 Ca 0.38 -0.42 -0.31 0.00 -1.18 0.00 0.00 61.69 60.17 1u1u s THR 242 Cb -0.11 -0.66 0.11 0.00 1.34 0.00 0.00 72.50 73.18 1u1u s THR 242 CO 0.30 -0.23 1.07 -0.72 -0.54 0.00 0.00 174.62 174.50 1u1u s TYR 243 N -1.32 -0.20 0.00 3.99 -0.85 -1.26 -3.37 117.35 114.34 1u1u s TYR 243 Ca -0.13 0.08 0.00 0.00 -0.52 0.00 0.00 57.07 56.50 1u1u s TYR 243 Cb -0.05 0.54 0.00 0.00 0.38 0.00 0.00 41.96 42.84 1u1u s TYR 243 CO 0.05 -0.42 0.00 1.19 -1.52 0.00 0.00 175.55 174.85 1u1u n PHE 244 N -0.25 0.00 0.00 -3.49 3.72 -1.26 -4.91 117.46 111.27 1u1u n PHE 244 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 1u1u n PHE 244 Cb 0.60 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 1u1u n PHE 244 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1u1u n ALA 245 N 0.21 0.00 -2.79 4.37 0.00 -1.26 -4.92 120.51 116.12 1u1u n ALA 245 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1u1u n ALA 245 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 1u1u n ALA 245 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1u1u s ASP 246 N 0.00 5.76 -0.22 0.00 -4.77 -1.26 -3.89 116.67 112.30 1u1u s ASP 246 Ca 0.00 0.24 -0.24 0.00 -3.30 0.00 0.00 52.55 49.25 1u1u s ASP 246 Cb 0.00 -1.82 -0.01 0.00 -1.09 0.00 0.00 42.92 40.00 1u1u s ASP 246 CO 0.00 0.33 0.81 -0.63 0.70 0.00 0.00 175.17 176.38 1u1u s ILE 247 N -0.58 4.87 0.35 2.11 1.09 -1.26 -4.88 121.20 122.90 1u1u s ILE 247 Ca 0.11 1.54 -0.28 0.00 -1.10 0.00 0.00 60.65 60.92 1u1u s ILE 247 Cb -0.12 -4.10 -0.12 0.00 -1.06 0.00 0.00 42.46 37.06 1u1u s ILE 247 CO 0.02 -0.03 1.40 -2.65 -0.10 0.00 0.00 174.94 173.58 1u1u n PRO 248 N 5.73 2.41 -0.16 2.79 -0.02 -1.26 -4.40 135.00 140.10 1u1u n PRO 248 Ca 0.05 0.84 -0.03 0.00 -2.02 0.00 0.00 63.50 62.34 1u1u n PRO 248 Cb 0.48 -2.51 -0.02 0.00 -0.02 0.00 0.00 33.50 31.44 1u1u n PRO 248 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1u1u n ALA 249 N 0.50 -0.16 0.08 3.55 0.00 -1.26 0.13 120.51 123.34 1u1u n ALA 249 Ca 0.03 0.35 -0.05 0.00 0.00 0.00 0.00 53.44 53.77 1u1u n ALA 249 Cb 0.37 -0.10 -0.03 0.00 0.00 0.00 0.00 19.45 19.69 1u1u n ALA 249 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1u1u h GLU 250 N 0.00 -0.27 -1.04 0.00 4.39 -1.99 0.70 114.58 116.37 1u1u h GLU 250 Ca 0.09 0.02 0.28 0.00 0.34 0.00 0.00 59.36 60.08 1u1u h GLU 250 Cb 0.19 0.06 -0.11 0.00 -0.10 0.00 0.00 28.75 28.79 1u1u h GLU 250 CO -0.37 -0.18 0.64 0.00 -1.16 0.00 0.00 179.01 177.95 1u1u h ALA 251 N -1.50 2.07 -0.56 3.43 0.00 -0.77 0.36 119.26 122.29 1u1u h ALA 251 Ca -0.02 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1u1u h ALA 251 Cb 0.24 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1u1u h ALA 251 CO -0.02 -0.54 0.19 -0.92 0.00 0.00 0.00 179.25 177.96 1u1u h TYR 252 N 0.44 0.89 0.00 0.00 3.20 0.12 -2.52 116.97 119.10 1u1u h TYR 252 Ca 0.64 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.43 1u1u h TYR 252 Cb 1.49 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.50 1u1u h TYR 252 CO -0.00 0.74 0.00 1.17 -1.64 0.00 0.00 178.16 178.42 1u1u n LYS 253 N -4.46 0.00 -0.22 1.82 4.81 0.12 -1.80 118.16 118.43 1u1u n LYS 253 Ca 0.03 0.33 0.15 0.00 -0.87 0.00 0.00 58.31 57.95 1u1u n LYS 253 Cb 0.19 -1.30 0.29 0.00 0.02 0.00 0.00 35.03 34.22 1u1u n LYS 253 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1u1u n THR 254 N -1.49 -0.28 0.16 3.15 -1.04 -0.55 -1.51 114.28 112.72 1u1u n THR 254 Ca 0.00 1.41 -0.07 0.00 -2.04 0.00 0.00 64.05 63.35 1u1u n THR 254 Cb 0.00 -2.16 -0.03 0.00 -1.82 0.00 0.00 70.33 66.32 1u1u n THR 254 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1u1u h LEU 255 N 0.00 -0.37 0.00 -4.42 7.12 -1.42 -2.68 115.31 113.54 1u1u h LEU 255 Ca 0.48 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.50 1u1u h LEU 255 Cb 1.14 0.10 0.00 0.00 -0.53 0.00 0.00 40.66 41.37 1u1u h LEU 255 CO -0.57 -0.17 0.00 0.35 -0.13 0.00 0.00 178.44 177.91 1u1u n THR 256 N -3.69 0.00 0.08 1.05 -2.24 -0.57 0.48 114.28 109.38 1u1u n THR 256 Ca -0.05 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.74 1u1u n THR 256 Cb 0.17 -0.89 -0.01 0.00 -2.10 0.00 0.00 70.33 67.50 1u1u n THR 256 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1u1u n SER 257 N -0.85 0.95 -4.56 3.42 3.41 -0.99 -4.67 113.62 110.35 1u1u n SER 257 Ca 0.00 -0.44 -0.47 0.00 -0.26 0.00 0.00 58.87 57.70 1u1u n SER 257 Cb 0.00 1.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.94 1u1u n SER 257 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1u1u n LEU 258 N -1.15 1.21 -4.73 1.04 4.77 0.18 -4.92 117.00 113.39 1u1u n LEU 258 Ca 0.00 1.16 -0.41 0.00 -0.03 0.00 0.00 56.01 56.73 1u1u n LEU 258 Cb 0.04 -1.20 -0.04 0.00 -2.33 0.00 0.00 43.42 39.89 1u1u n LEU 258 CO 0.04 -1.60 0.82 -0.54 -1.33 0.00 0.00 177.39 174.78 1u1u s LYS 259 N -0.97 4.56 0.00 3.23 -0.14 -1.26 -3.53 119.74 121.63 1u1u s LYS 259 Ca 0.66 1.74 0.00 0.00 -1.36 0.00 0.00 55.97 57.01 1u1u s LYS 259 Cb -0.81 -3.28 0.00 0.00 -1.68 0.00 0.00 37.83 32.06 1u1u s LYS 259 CO 0.56 0.00 0.00 0.41 -0.76 0.00 0.00 175.35 175.57 1u1u n GLY 260 N 2.23 2.88 3.69 -3.33 0.00 -1.26 -4.62 105.19 104.78 1u1u n GLY 260 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1u1u n GLY 260 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u1u s VAL 261 N -1.95 4.44 -1.30 1.61 1.01 -1.23 -4.31 120.40 118.68 1u1u s VAL 261 Ca 0.00 1.75 0.11 0.00 0.00 0.00 0.00 61.98 63.84 1u1u s VAL 261 Cb 0.00 -4.12 0.15 0.00 0.00 0.00 0.00 36.38 32.41 1u1u s VAL 261 CO 0.00 0.02 0.97 0.35 0.00 0.00 0.00 175.10 176.44 1u1u n THR 262 N 4.51 0.27 -3.61 3.92 -2.24 -1.06 -4.94 114.28 111.13 1u1u n THR 262 Ca 0.10 -0.64 -0.12 0.00 -2.27 0.00 0.00 64.05 61.12 1u1u n THR 262 Cb 0.47 1.04 -0.07 0.00 -2.10 0.00 0.00 70.33 69.67 1u1u n THR 262 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1u1u s ALA 263 N -0.97 -1.89 0.05 6.98 0.00 -0.86 -1.86 121.76 123.22 1u1u s ALA 263 Ca 0.16 1.80 0.05 0.00 0.00 0.00 0.00 51.96 53.98 1u1u s ALA 263 Cb 0.10 -1.07 -0.02 0.00 0.00 0.00 0.00 23.12 22.13 1u1u s ALA 263 CO 0.15 -0.29 -0.15 -0.06 0.00 0.00 0.00 175.76 175.41 1u1u s PHE 264 N -0.12 1.27 -0.11 0.00 0.08 -0.76 -2.20 117.98 116.15 1u1u s PHE 264 Ca -0.00 -0.38 0.01 0.00 0.12 0.00 0.00 56.93 56.68 1u1u s PHE 264 Cb -0.04 -0.74 0.02 0.00 -0.57 0.00 0.00 43.02 41.69 1u1u s PHE 264 CO -0.01 0.05 -0.12 0.20 -0.10 0.00 0.00 175.22 175.24 1u1u s GLY 265 N -1.31 0.94 -0.06 4.36 0.00 -0.93 -2.10 107.32 108.22 1u1u s GLY 265 Ca 0.01 -0.64 0.03 0.00 0.00 0.00 0.00 44.72 44.12 1u1u s GLY 265 CO 0.02 0.45 -0.15 -1.36 0.00 0.00 0.00 173.10 172.06 1u1u s PHE 266 N 1.25 2.70 -1.07 1.90 0.08 -1.25 -2.20 117.98 119.39 1u1u s PHE 266 Ca -0.02 -0.23 -0.23 0.00 0.12 0.00 0.00 56.93 56.57 1u1u s PHE 266 Cb -0.14 -1.65 -0.03 0.00 -0.57 0.00 0.00 43.02 40.63 1u1u s PHE 266 CO -0.04 0.13 1.84 0.34 -0.10 0.00 0.00 175.22 177.38 1u1u s ASP 267 N -0.60 5.54 0.00 1.36 -1.08 -1.22 -3.17 116.67 117.51 1u1u s ASP 267 Ca 0.09 -1.38 0.00 0.00 -0.52 0.00 0.00 52.55 50.74 1u1u s ASP 267 Cb -0.11 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.77 1u1u s ASP 267 CO 0.01 -2.46 0.70 0.18 0.52 0.00 0.00 175.17 174.13 1u1u n LEU 268 N 12.57 0.49 -0.09 -1.34 4.77 -1.04 -0.33 117.00 132.04 1u1u n LEU 268 Ca 0.42 -0.25 -0.22 0.00 -0.03 0.00 0.00 56.01 55.94 1u1u n LEU 268 Cb 0.47 -0.25 -0.12 0.00 -2.33 0.00 0.00 43.42 41.20 1u1u n LEU 268 CO 0.66 0.12 -1.11 0.52 -1.33 0.00 0.00 177.39 176.25 1u1u n VAL 269 N -0.23 1.59 0.70 4.08 0.31 -1.24 -4.32 118.33 119.23 1u1u n VAL 269 Ca 0.00 -0.50 0.07 0.00 -0.01 0.00 0.00 64.34 63.91 1u1u n VAL 269 Cb 0.12 -1.67 -0.04 0.00 -0.91 0.00 0.00 33.84 31.34 1u1u n VAL 269 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1u1u n ARG 270 N -3.64 1.87 -3.22 5.55 1.74 -1.12 -4.65 116.66 113.18 1u1u n ARG 270 Ca -0.42 -0.44 -0.24 0.00 -0.77 0.00 0.00 57.85 55.98 1u1u n ARG 270 Cb 0.95 -1.24 -0.06 0.00 -1.02 0.00 0.00 32.46 31.09 1u1u n ARG 270 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1u1u n GLY 271 N 1.23 3.90 0.72 -0.13 0.00 0.56 -4.02 105.19 107.46 1u1u n GLY 271 Ca 0.05 -2.09 0.04 0.00 0.00 0.00 0.00 46.02 44.02 1u1u n GLY 271 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1u1u n THR 272 N 0.83 0.64 -0.04 2.61 -2.24 -1.26 -3.12 114.28 111.70 1u1u n THR 272 Ca 0.26 -0.46 -0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1u1u n THR 272 Cb 0.50 0.02 -0.14 0.00 -2.10 0.00 0.00 70.33 68.61 1u1u n THR 272 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1u1u n LYS 273 N 0.36 0.66 0.26 -0.78 5.02 -1.26 -3.92 118.16 118.50 1u1u n LYS 273 Ca 0.11 -0.01 0.12 0.00 -2.02 0.00 0.00 58.31 56.50 1u1u n LYS 273 Cb 0.38 -1.59 0.76 0.00 -0.02 0.00 0.00 35.03 34.55 1u1u n LYS 273 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1u1u h THR 274 N 0.00 0.78 -0.48 -0.18 2.02 -1.85 -1.98 112.91 111.21 1u1u h THR 274 Ca -0.27 0.00 0.05 0.00 0.77 0.00 0.00 66.41 66.97 1u1u h THR 274 Cb 1.66 0.98 -0.05 0.00 -1.74 0.00 0.00 68.15 69.00 1u1u h THR 274 CO 0.02 0.00 0.20 -0.07 0.37 0.00 0.00 175.52 176.05 1u1u h LEU 275 N 0.00 0.25 -2.11 2.58 4.07 -1.77 -1.82 115.31 116.51 1u1u h LEU 275 Ca 0.02 0.04 0.09 0.00 0.08 0.00 0.00 57.88 58.11 1u1u h LEU 275 Cb 0.08 0.01 -0.01 0.00 1.08 0.00 0.00 40.66 41.82 1u1u h LEU 275 CO -0.00 0.18 0.30 0.44 -1.08 0.00 0.00 178.44 178.28 1u1u h ASP 276 N 0.40 0.00 1.50 -0.43 3.32 -1.60 0.32 116.42 119.94 1u1u h ASP 276 Ca 0.22 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.21 1u1u h ASP 276 Cb 0.19 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1u1u h ASP 276 CO -0.20 0.00 -0.51 -0.07 -1.72 0.00 0.00 179.24 176.74 1u1u h LEU 277 N 0.00 0.00 0.12 1.55 3.38 -1.43 -2.87 115.31 116.06 1u1u h LEU 277 Ca 0.14 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.80 1u1u h LEU 277 Cb 0.75 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 1u1u h LEU 277 CO -0.00 0.26 -1.63 0.58 0.09 0.00 0.00 178.44 177.74 1u1u h VAL 278 N 0.00 0.88 -0.87 1.22 2.07 -0.55 -2.02 116.25 116.97 1u1u h VAL 278 Ca -0.02 -2.37 0.16 0.00 0.82 0.00 0.00 66.70 65.29 1u1u h VAL 278 Cb 1.22 2.60 -0.10 0.00 -1.52 0.00 0.00 31.29 33.49 1u1u h VAL 278 CO 0.03 0.75 0.45 0.11 0.02 0.00 0.00 177.57 178.92 1u1u h LYS 279 N -0.20 0.58 0.37 1.57 1.57 -0.61 -2.52 116.57 117.33 1u1u h LYS 279 Ca -0.35 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.37 1u1u h LYS 279 Cb 1.85 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 34.03 1u1u h LYS 279 CO 0.06 0.38 -0.18 0.00 -0.57 0.00 0.00 179.45 179.14 1u1u h ALA 280 N 1.59 -0.49 -2.94 3.86 0.00 -1.59 -3.47 119.26 116.23 1u1u h ALA 280 Ca 0.49 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 55.06 1u1u h ALA 280 Cb 0.75 0.19 -0.22 0.00 0.00 0.00 0.00 17.79 18.51 1u1u h ALA 280 CO -0.39 -0.56 -0.51 0.20 0.00 0.00 0.00 179.25 177.99 1u1u s GLY 281 N -2.82 -0.00 0.08 0.00 0.00 -0.76 -5.10 107.32 98.71 1u1u s GLY 281 Ca -0.13 0.04 -0.15 0.00 0.00 0.00 0.00 44.72 44.49 1u1u s GLY 281 CO 0.46 -0.07 0.34 -0.12 0.00 0.00 0.00 173.10 173.70 1u1u s PHE 282 N -0.93 -0.13 0.59 1.90 5.36 -1.26 -3.88 117.98 119.64 1u1u s PHE 282 Ca -0.10 -0.09 -0.10 0.00 -0.96 0.00 0.00 56.93 55.68 1u1u s PHE 282 Cb -0.06 0.15 0.15 0.00 -0.34 0.00 0.00 43.02 42.92 1u1u s PHE 282 CO 0.01 -0.59 0.55 -2.30 -1.46 0.00 0.00 175.22 171.44 1u1u n PRO 283 N 0.21 -1.92 0.00 10.12 -0.02 -1.26 -5.03 135.00 137.10 1u1u n PRO 283 Ca -0.17 -0.88 0.00 0.00 -2.02 0.00 0.00 63.50 60.43 1u1u n PRO 283 Cb 0.61 -0.79 0.00 0.00 -0.02 0.00 0.00 33.50 33.30 1u1u n PRO 283 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1u1u n GLU 284 N -3.07 0.00 -3.82 -0.52 -0.58 -1.26 -4.57 120.64 106.81 1u1u n GLU 284 Ca 0.08 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.50 1u1u n GLU 284 Cb 0.29 0.00 -0.11 0.00 -0.57 0.00 0.00 31.44 31.05 1u1u n GLU 284 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1u1u s GLY 285 N 0.00 2.81 0.46 0.62 0.00 -1.26 -5.06 107.32 104.89 1u1u s GLY 285 Ca 0.00 -3.64 0.06 0.00 0.00 0.00 0.00 44.72 41.14 1u1u s GLY 285 CO 0.00 1.10 0.50 0.28 0.00 0.00 0.00 173.10 174.98 1u1u n LYS 286 N 2.53 0.75 -3.98 2.90 4.76 -1.26 -5.05 118.16 118.80 1u1u n LYS 286 Ca 0.15 -2.67 -0.32 0.00 -2.87 0.00 0.00 58.31 52.61 1u1u n LYS 286 Cb 0.35 0.04 -0.05 0.00 -1.84 0.00 0.00 35.03 33.53 1u1u n LYS 286 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1u1u s TYR 287 N -2.07 3.40 -0.15 2.13 1.51 -0.78 -4.72 117.35 116.68 1u1u s TYR 287 Ca 0.38 0.23 -0.00 0.00 -1.01 0.00 0.00 57.07 56.67 1u1u s TYR 287 Cb -0.03 -1.74 0.03 0.00 -0.11 0.00 0.00 41.96 40.11 1u1u s TYR 287 CO 0.24 0.58 -0.08 -1.17 -1.11 0.00 0.00 175.55 174.01 1u1u s LEU 288 N -2.16 1.53 -1.02 -1.29 0.20 -0.88 -1.82 118.68 113.24 1u1u s LEU 288 Ca 0.29 -0.52 -0.11 0.00 0.69 0.00 0.00 54.13 54.48 1u1u s LEU 288 Cb -0.12 -0.96 0.26 0.00 -0.43 0.00 0.00 46.19 44.93 1u1u s LEU 288 CO 0.21 -0.13 1.00 -0.36 -0.29 0.00 0.00 176.35 176.78 1u1u s PHE 289 N 1.61 4.12 -0.54 5.38 0.40 -0.89 0.14 117.98 128.20 1u1u s PHE 289 Ca 0.03 -2.48 -0.28 0.00 -0.60 0.00 0.00 56.93 53.60 1u1u s PHE 289 Cb -0.14 -3.83 -0.10 0.00 0.51 0.00 0.00 43.02 39.47 1u1u s PHE 289 CO -0.08 -0.96 2.43 0.00 0.70 0.00 0.00 175.22 177.30 1u1u n ALA 290 N 3.09 0.82 -2.55 5.36 0.00 0.20 -3.82 120.51 123.61 1u1u n ALA 290 Ca 0.21 -0.70 -0.43 0.00 0.00 0.00 0.00 53.44 52.51 1u1u n ALA 290 Cb 0.42 -2.98 0.00 0.00 0.00 0.00 0.00 19.45 16.89 1u1u n ALA 290 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u1u n GLY 291 N 6.11 4.26 0.89 0.00 0.00 -1.19 -1.17 105.19 114.09 1u1u n GLY 291 Ca 0.42 -2.06 0.12 0.00 0.00 0.00 0.00 46.02 44.50 1u1u n GLY 291 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1u1u n VAL 292 N 3.80 0.10 -3.43 1.61 0.24 -1.11 -2.51 118.33 117.03 1u1u n VAL 292 Ca 0.39 -0.49 -0.44 0.00 -2.04 0.00 0.00 64.34 61.76 1u1u n VAL 292 Cb 0.39 1.17 -0.05 0.00 -1.47 0.00 0.00 33.84 33.88 1u1u n VAL 292 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1u1u s VAL 293 N -1.90 4.91 0.02 3.34 1.01 -1.21 -4.81 120.40 121.76 1u1u s VAL 293 Ca 0.32 -2.11 -0.31 0.00 0.00 0.00 0.00 61.98 59.88 1u1u s VAL 293 Cb 0.21 -4.12 -0.16 0.00 0.00 0.00 0.00 36.38 32.30 1u1u s VAL 293 CO 0.31 -0.90 0.80 -0.67 0.00 0.00 0.00 175.10 174.63 1u1u n ASP 294 N 4.48 -0.12 -0.13 3.32 -0.08 -1.26 -0.96 116.55 121.80 1u1u n ASP 294 Ca 0.00 0.92 0.05 0.00 -1.51 0.00 0.00 54.79 54.25 1u1u n ASP 294 Cb 0.42 -0.73 0.07 0.00 2.34 0.00 0.00 41.12 43.23 1u1u n ASP 294 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1u1u n GLY 295 N 1.23 3.03 0.53 0.27 0.00 -1.26 -4.65 105.19 104.33 1u1u n GLY 295 Ca 0.16 -0.59 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 1u1u n GLY 295 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u1u n ARG 296 N -0.85 0.24 0.00 1.61 1.74 -1.26 -2.27 116.66 115.86 1u1u n ARG 296 Ca 0.08 0.09 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 1u1u n ARG 296 Cb 0.56 -0.96 0.00 0.00 -1.02 0.00 0.00 32.46 31.04 1u1u n ARG 296 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1u1u n ASN 297 N -3.35 0.00 -1.57 0.55 3.02 -1.26 -4.47 115.26 108.18 1u1u n ASN 297 Ca -0.21 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.34 1u1u n ASN 297 Cb 0.66 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.84 1u1u n ASN 297 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1u1u n ILE 298 N 0.00 0.14 -5.02 2.41 0.13 -1.26 -4.62 119.36 111.13 1u1u n ILE 298 Ca 0.00 -0.93 -0.29 0.00 -1.10 0.00 0.00 62.75 60.43 1u1u n ILE 298 Cb 0.00 0.90 -0.15 0.00 -0.84 0.00 0.00 39.64 39.54 1u1u n ILE 298 CO 0.00 0.00 0.00 0.26 2.80 0.00 0.00 176.55 179.61 1u1u s TRP 299 N -0.40 2.18 -0.31 9.51 0.52 -1.26 -2.63 118.94 126.56 1u1u s TRP 299 Ca 0.23 -0.41 -0.29 0.00 0.02 0.00 0.00 56.10 55.65 1u1u s TRP 299 Cb 0.28 -1.35 -0.07 0.00 -1.15 0.00 0.00 33.47 31.18 1u1u s TRP 299 CO -0.11 0.04 2.27 0.00 0.02 0.00 0.00 176.95 179.18 1u1u n ALA 300 N 2.13 1.46 -1.64 0.98 0.00 -1.26 -4.66 120.51 117.52 1u1u n ALA 300 Ca -0.16 -0.37 -0.62 0.00 0.00 0.00 0.00 53.44 52.29 1u1u n ALA 300 Cb 0.52 -2.92 -0.09 0.00 0.00 0.00 0.00 19.45 16.96 1u1u n ALA 300 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1u1u n ASN 301 N 12.30 1.58 -4.52 0.00 2.85 -1.26 -4.67 115.26 121.53 1u1u n ASN 301 Ca 0.34 1.02 -0.17 0.00 -0.11 0.00 0.00 54.58 55.66 1u1u n ASN 301 Cb 0.43 -0.99 -0.15 0.00 1.24 0.00 0.00 39.78 40.31 1u1u n ASN 301 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1u1u n ASP 302 N 5.39 0.06 -0.17 1.20 2.03 -1.26 -4.74 116.55 119.06 1u1u n ASP 302 Ca 0.34 -1.03 -0.07 0.00 0.52 0.00 0.00 54.79 54.55 1u1u n ASP 302 Cb 0.02 -1.07 -0.06 0.00 -0.72 0.00 0.00 41.12 39.29 1u1u n ASP 302 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 1u1u h PHE 303 N 11.74 -1.05 -0.68 -0.67 -1.00 -1.96 -1.40 116.94 121.92 1u1u h PHE 303 Ca 0.02 0.06 0.06 0.00 2.81 0.00 0.00 57.97 60.92 1u1u h PHE 303 Cb 1.07 0.51 -0.08 0.00 3.61 0.00 0.00 35.95 41.06 1u1u h PHE 303 CO 1.28 -0.25 -0.40 0.00 -1.61 0.00 0.00 178.31 177.34 1u1u n ALA 304 N -3.04 -0.43 0.02 2.45 0.00 -1.26 -0.71 120.51 117.53 1u1u n ALA 304 Ca -0.00 0.58 -0.06 0.00 0.00 0.00 0.00 53.44 53.95 1u1u n ALA 304 Cb 0.17 -0.03 -0.04 0.00 0.00 0.00 0.00 19.45 19.55 1u1u n ALA 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u1u h ALA 305 N 0.21 -0.67 -1.82 0.00 0.00 -1.79 -1.75 119.26 113.44 1u1u h ALA 305 Ca 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1u1u h ALA 305 Cb 0.28 0.69 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1u1u h ALA 305 CO -0.64 -0.74 0.00 0.43 0.00 0.00 0.00 179.25 178.30 1u1u n SER 306 N -3.68 0.00 -0.46 0.00 7.64 -0.01 0.11 113.62 117.22 1u1u n SER 306 Ca -0.03 0.49 0.41 0.00 1.01 0.00 0.00 58.87 60.75 1u1u n SER 306 Cb 0.16 -0.09 0.64 0.00 -1.01 0.00 0.00 64.21 63.90 1u1u n SER 306 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1u1u h LEU 307 N 0.00 0.00 -0.01 -3.43 6.46 -0.85 1.42 115.31 118.90 1u1u h LEU 307 Ca 0.00 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.72 1u1u h LEU 307 Cb 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.93 1u1u h LEU 307 CO 0.00 0.00 -0.14 -1.28 -0.62 0.00 0.00 178.44 176.40 1u1u h SER 308 N 0.00 0.14 0.11 1.25 0.87 0.17 -2.01 113.55 114.07 1u1u h SER 308 Ca 0.71 -0.74 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1u1u h SER 308 Cb 3.31 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 65.23 1u1u h SER 308 CO -0.01 0.86 -0.05 0.74 -0.53 0.00 0.00 176.83 177.84 1u1u h THR 309 N -0.57 1.10 -0.92 2.23 2.02 0.29 -1.19 112.91 115.86 1u1u h THR 309 Ca -0.01 -1.15 0.27 0.00 0.77 0.00 0.00 66.41 66.28 1u1u h THR 309 Cb 0.87 1.79 -0.04 0.00 -1.74 0.00 0.00 68.15 69.03 1u1u h THR 309 CO 0.03 0.26 0.83 -0.07 0.37 0.00 0.00 175.52 176.94 1u1u h LEU 310 N -0.72 0.00 0.05 2.58 3.38 0.13 0.54 115.31 121.27 1u1u h LEU 310 Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1u1u h LEU 310 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1u1u h LEU 310 CO 0.02 0.00 -0.03 1.56 0.09 0.00 0.00 178.44 180.09 1u1u h GLN 311 N 0.00 -0.07 -1.32 1.13 4.20 -1.11 -3.27 115.11 114.67 1u1u h GLN 311 Ca 0.44 0.00 0.46 0.00 0.06 0.00 0.00 58.65 59.61 1u1u h GLN 311 Cb 2.09 0.02 -0.14 0.00 0.30 0.00 0.00 27.48 29.75 1u1u h GLN 311 CO -0.00 0.48 0.84 0.00 -0.67 0.00 0.00 178.83 179.48 1u1u n ALA 312 N -2.63 1.31 -0.03 3.87 0.00 0.18 0.18 120.51 123.39 1u1u n ALA 312 Ca -0.07 0.84 -0.09 0.00 0.00 0.00 0.00 53.44 54.13 1u1u n ALA 312 Cb 0.28 -1.02 0.07 0.00 0.00 0.00 0.00 19.45 18.78 1u1u n ALA 312 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1u1u h LEU 313 N 0.00 0.70 -1.97 0.00 3.38 -1.41 -2.57 115.31 113.43 1u1u h LEU 313 Ca 0.85 -0.32 0.36 0.00 0.09 0.00 0.00 57.88 58.86 1u1u h LEU 313 Cb 2.72 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 43.22 1u1u h LEU 313 CO -0.46 1.03 0.89 -0.33 0.09 0.00 0.00 178.44 179.66 1u1u h GLU 314 N 0.53 0.01 -0.01 1.13 4.39 0.19 1.10 114.58 121.92 1u1u h GLU 314 Ca 0.04 -0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.65 1u1u h GLU 314 Cb 0.95 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.59 1u1u h GLU 314 CO 0.09 0.01 -0.40 0.78 -1.16 0.00 0.00 179.01 178.32 1u1u h GLY 315 N 0.01 0.02 1.54 -3.84 0.00 -1.46 -2.85 103.07 96.49 1u1u h GLY 315 Ca 0.60 -0.02 -0.23 0.00 0.00 0.00 0.00 47.33 47.67 1u1u h GLY 315 CO -0.02 0.02 -0.99 -2.22 0.00 0.00 0.00 176.54 173.33 1u1u h ILE 316 N 0.02 1.41 0.00 2.60 1.08 0.11 -3.46 117.51 119.26 1u1u h ILE 316 Ca -0.00 -2.52 0.00 0.00 -0.39 0.00 0.00 64.86 61.95 1u1u h ILE 316 Cb 0.72 2.49 0.00 0.00 -3.07 0.00 0.00 36.82 36.96 1u1u h ILE 316 CO 0.05 0.75 0.00 0.52 -0.69 0.00 0.00 178.15 178.78 1u1u n VAL 317 N -3.72 0.00 0.00 1.67 0.31 -0.97 -5.03 118.33 110.58 1u1u n VAL 317 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1u1u n VAL 317 Cb 0.86 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.79 1u1u n VAL 317 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1u1u n GLY 318 N 2.47 3.08 0.72 2.92 0.00 -1.09 -4.86 105.19 108.42 1u1u n GLY 318 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1u1u n GLY 318 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u1u n LYS 319 N -0.83 0.17 -0.22 1.61 5.02 -1.26 -4.43 118.16 118.21 1u1u n LYS 319 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1u1u n LYS 319 Cb 0.00 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1u1u n LYS 319 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1u1u n ASP 320 N 0.64 -0.66 -1.91 4.39 10.43 -1.26 -5.03 116.55 123.16 1u1u n ASP 320 Ca 0.00 0.00 -0.22 0.00 2.57 0.00 0.00 54.79 57.14 1u1u n ASP 320 Cb 0.06 -0.11 0.04 0.00 1.84 0.00 0.00 41.12 42.95 1u1u n ASP 320 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1u1u n LYS 321 N -2.22 3.45 -4.60 -1.24 5.02 -1.26 -4.99 118.16 112.31 1u1u n LYS 321 Ca 0.00 -4.09 -0.33 0.00 -2.02 0.00 0.00 58.31 51.87 1u1u n LYS 321 Cb 0.00 -2.23 -0.13 0.00 -0.02 0.00 0.00 35.03 32.65 1u1u n LYS 321 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1u1u s LEU 322 N -3.57 2.99 -0.05 -0.35 1.98 -1.26 -2.07 118.68 116.35 1u1u s LEU 322 Ca 0.50 -0.21 0.00 0.00 -2.89 0.00 0.00 54.13 51.53 1u1u s LEU 322 Cb 0.41 -1.69 0.02 0.00 0.66 0.00 0.00 46.19 45.59 1u1u s LEU 322 CO 0.03 0.19 -0.03 -0.69 -1.89 0.00 0.00 176.35 173.96 1u1u s VAL 323 N 0.22 0.47 0.39 1.68 1.01 0.12 -4.89 120.40 119.40 1u1u s VAL 323 Ca -0.05 -0.04 -0.25 0.00 0.00 0.00 0.00 61.98 61.64 1u1u s VAL 323 Cb -0.15 -0.54 -0.09 0.00 0.00 0.00 0.00 36.38 35.61 1u1u s VAL 323 CO 0.04 0.23 1.15 -0.69 0.00 0.00 0.00 175.10 175.83 1u1u s VAL 324 N 1.25 3.26 0.21 2.92 1.01 0.33 -0.62 120.40 128.76 1u1u s VAL 324 Ca -0.06 1.06 -0.16 0.00 0.00 0.00 0.00 61.98 62.82 1u1u s VAL 324 Cb -0.14 -3.59 0.02 0.00 0.00 0.00 0.00 36.38 32.67 1u1u s VAL 324 CO -0.02 0.10 0.52 -0.55 0.00 0.00 0.00 175.10 175.15 1u1u s SER 325 N -1.18 -0.20 0.82 3.32 0.15 -0.32 0.90 113.70 117.20 1u1u s SER 325 Ca 0.56 -0.62 -0.12 0.00 0.70 0.00 0.00 55.95 56.47 1u1u s SER 325 Cb -0.29 0.59 0.09 0.00 -1.71 0.00 0.00 66.02 64.69 1u1u s SER 325 CO 0.37 -1.10 1.16 0.42 1.20 0.00 0.00 173.24 175.29 1u1u s THR 326 N -3.92 2.22 -0.06 6.45 -4.23 -1.01 -2.74 115.64 112.35 1u1u s THR 326 Ca 0.13 0.07 -0.01 0.00 -1.18 0.00 0.00 61.69 60.70 1u1u s THR 326 Cb -0.01 -2.99 -0.01 0.00 1.34 0.00 0.00 72.50 70.83 1u1u s THR 326 CO 0.01 -0.09 0.08 0.77 -0.54 0.00 0.00 174.62 174.85 1u1u h SER 327 N -1.13 -0.04 -0.93 3.99 4.64 -1.11 -3.37 113.55 115.60 1u1u h SER 327 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1u1u h SER 327 Cb 1.32 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1u1u h SER 327 CO 0.64 0.28 0.00 0.00 -0.87 0.00 0.00 176.83 176.88 1u1u s SER 329 N 0.65 6.90 0.00 0.00 0.15 -1.26 -4.54 113.70 115.60 1u1u s SER 329 Ca 0.00 1.09 0.00 0.00 0.70 0.00 0.00 55.95 57.74 1u1u s SER 329 Cb 0.00 -2.40 0.00 0.00 -1.71 0.00 0.00 66.02 61.91 1u1u s SER 329 CO 0.00 -0.18 0.67 0.18 1.20 0.00 0.00 173.24 175.11 1u1u n LEU 330 N 4.22 1.84 -0.09 3.45 4.77 -1.23 -1.05 117.00 128.90 1u1u n LEU 330 Ca -0.01 -0.85 -0.12 0.00 -0.03 0.00 0.00 56.01 55.00 1u1u n LEU 330 Cb 0.51 -0.37 -0.10 0.00 -2.33 0.00 0.00 43.42 41.13 1u1u n LEU 330 CO 0.46 0.34 -1.12 -0.11 -1.33 0.00 0.00 177.39 175.63 1u1u n LEU 331 N 1.41 2.44 0.00 2.23 -0.00 -1.26 -3.49 117.00 118.32 1u1u n LEU 331 Ca 0.00 -0.09 0.11 0.00 -0.00 0.00 0.00 56.01 56.04 1u1u n LEU 331 Cb 0.21 -0.49 0.58 0.00 -0.00 0.00 0.00 43.42 43.72 1u1u n LEU 331 CO 0.00 0.75 0.87 1.41 -0.00 0.00 0.00 177.39 180.42 1u1u n HIS 332 N -2.98 0.00 -1.95 1.96 8.25 -0.21 -4.66 115.22 115.62 1u1u n HIS 332 Ca -0.33 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.13 1u1u n HIS 332 Cb 0.89 -0.28 0.00 0.00 1.12 0.00 0.00 29.99 31.73 1u1u n HIS 332 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1u1u n THR 333 N -1.28 0.00 -0.59 1.59 5.66 -0.96 -4.65 114.28 114.05 1u1u n THR 333 Ca 0.11 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.11 1u1u n THR 333 Cb 0.18 -0.64 0.00 0.00 -1.55 0.00 0.00 70.33 68.32 1u1u n THR 333 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1u1u n ALA 334 N -3.00 0.00 -2.00 1.79 0.00 -1.26 -4.64 120.51 111.40 1u1u n ALA 334 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1u1u n ALA 334 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1u1u n ALA 334 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1u1u n VAL 335 N 0.00 0.00 -3.49 0.00 0.31 -1.26 -3.31 118.33 110.58 1u1u n VAL 335 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.91 1u1u n VAL 335 Cb 0.00 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 32.83 1u1u n VAL 335 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1u1u s ASP 336 N 1.00 6.03 0.58 4.52 -1.08 -1.26 0.52 116.67 126.98 1u1u s ASP 336 Ca 0.00 -0.88 0.28 0.00 -0.52 0.00 0.00 52.55 51.43 1u1u s ASP 336 Cb 0.00 -2.13 1.52 0.00 -1.46 0.00 0.00 42.92 40.85 1u1u s ASP 336 CO 0.00 -0.42 1.98 0.25 0.52 0.00 0.00 175.17 177.50 1u1u h LEU 337 N 8.58 0.00 -1.60 -1.34 6.46 -1.94 -2.42 115.31 123.05 1u1u h LEU 337 Ca -0.27 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.49 1u1u h LEU 337 Cb 1.12 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.05 1u1u h LEU 337 CO 0.71 0.00 0.00 0.00 -0.62 0.00 0.00 178.44 178.53 1u1u n ILE 338 N -3.89 0.35 -1.75 4.05 0.13 -1.26 -1.94 119.36 115.05 1u1u n ILE 338 Ca 0.07 0.00 0.06 0.00 -1.10 0.00 0.00 62.75 61.77 1u1u n ILE 338 Cb 0.55 -0.59 0.17 0.00 -0.84 0.00 0.00 39.64 38.93 1u1u n ILE 338 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 1u1u n ASN 339 N 0.52 1.58 -3.89 9.51 5.03 -0.91 -4.98 115.26 122.11 1u1u n ASN 339 Ca 0.00 -3.47 -0.27 0.00 0.87 0.00 0.00 54.58 51.72 1u1u n ASN 339 Cb 0.23 -0.47 -0.17 0.00 -1.02 0.00 0.00 39.78 38.35 1u1u n ASN 339 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1u1u s GLU 340 N -2.54 1.45 0.00 3.52 0.41 -0.82 -3.96 118.70 116.75 1u1u s GLU 340 Ca 0.36 -0.27 0.00 0.00 -0.41 0.00 0.00 54.97 54.65 1u1u s GLU 340 Cb 0.36 -1.62 0.00 0.00 -1.78 0.00 0.00 34.13 31.10 1u1u s GLU 340 CO -0.08 -0.30 0.00 -2.37 -0.49 0.00 0.00 175.26 172.02 1u1u n THR 341 N 4.95 0.00 -0.52 3.63 5.66 -1.26 -4.68 114.28 122.05 1u1u n THR 341 Ca -0.12 0.00 0.45 0.00 -3.05 0.00 0.00 64.05 61.33 1u1u n THR 341 Cb 0.50 -1.03 0.75 0.00 -1.55 0.00 0.00 70.33 68.99 1u1u n THR 341 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 1u1u h LYS 342 N 0.00 0.00 -5.99 1.09 1.79 -1.97 -3.30 116.57 108.20 1u1u h LYS 342 Ca 0.00 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.88 1u1u h LYS 342 Cb 0.67 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 31.25 1u1u h LYS 342 CO 0.00 0.00 0.68 -0.51 -1.08 0.00 0.00 179.45 178.54 1u1u s LEU 343 N -7.73 4.08 0.28 2.94 1.43 -1.26 -4.98 118.68 113.43 1u1u s LEU 343 Ca -0.05 1.21 -0.30 0.00 -1.03 0.00 0.00 54.13 53.96 1u1u s LEU 343 Cb 0.24 -3.40 -0.13 0.00 0.03 0.00 0.00 46.19 42.93 1u1u s LEU 343 CO 0.80 -0.63 1.44 -0.90 0.23 0.00 0.00 176.35 177.29 1u1u n ASP 344 N 6.25 3.12 -0.39 2.29 5.75 -1.24 -4.74 116.55 127.60 1u1u n ASP 344 Ca 0.09 1.16 -0.06 0.00 -0.01 0.00 0.00 54.79 55.98 1u1u n ASP 344 Cb 0.47 -1.50 -0.03 0.00 -1.03 0.00 0.00 41.12 39.03 1u1u n ASP 344 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1u1u n ASP 345 N 1.79 -0.82 -0.36 -1.12 8.00 -1.26 -0.86 116.55 121.93 1u1u n ASP 345 Ca 0.09 1.69 0.29 0.00 0.71 0.00 0.00 54.79 57.57 1u1u n ASP 345 Cb 0.34 -0.30 0.48 0.00 -0.02 0.00 0.00 41.12 41.62 1u1u n ASP 345 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1u1u n GLU 346 N -5.31 -0.02 -0.01 -1.24 2.13 -1.26 -0.01 120.64 114.92 1u1u n GLU 346 Ca 0.06 0.82 -0.22 0.00 0.66 0.00 0.00 57.16 58.49 1u1u n GLU 346 Cb 0.32 -1.68 -0.14 0.00 0.27 0.00 0.00 31.44 30.22 1u1u n GLU 346 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1u1u n ILE 347 N -3.87 1.75 0.23 6.31 0.13 -0.03 -3.88 119.36 120.00 1u1u n ILE 347 Ca 0.28 -0.55 0.15 0.00 -1.10 0.00 0.00 62.75 61.53 1u1u n ILE 347 Cb 1.13 -1.79 0.83 0.00 -0.84 0.00 0.00 39.64 38.97 1u1u n ILE 347 CO 0.00 0.00 0.00 0.11 2.80 0.00 0.00 176.55 179.46 1u1u h LYS 348 N -0.11 0.00 0.00 9.51 1.57 -0.38 2.39 116.57 129.54 1u1u h LYS 348 Ca -0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1u1u h LYS 348 Cb 1.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.22 1u1u h LYS 348 CO 0.04 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.58 1u1u h SER 349 N 0.00 0.00 -0.95 0.86 4.64 -1.49 -3.41 113.55 113.20 1u1u h SER 349 Ca 0.00 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.70 1u1u h SER 349 Cb 0.02 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 61.81 1u1u h SER 349 CO 0.00 0.00 0.64 0.79 -0.87 0.00 0.00 176.83 177.39 1u1u n TRP 350 N -2.60 3.07 0.00 4.77 7.02 0.80 -4.73 117.44 125.77 1u1u n TRP 350 Ca 0.04 -2.68 0.00 0.00 -1.02 0.00 0.00 57.50 53.84 1u1u n TRP 350 Cb 0.40 -1.22 0.00 0.00 -2.42 0.00 0.00 31.31 28.07 1u1u n TRP 350 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1u1u n ALA 352 N -0.95 0.00 -3.36 6.99 0.00 -1.08 -4.26 120.51 117.85 1u1u n ALA 352 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 53.44 54.03 1u1u n ALA 352 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.34 1u1u n ALA 352 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1u1u n PHE 353 N 0.00 -1.30 0.00 0.00 3.01 -1.26 -4.02 117.46 113.89 1u1u n PHE 353 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1u1u n PHE 353 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1u1u n PHE 353 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1u1u n ALA 354 N -3.00 0.00 -0.32 4.37 0.00 0.18 -0.15 120.51 121.60 1u1u n ALA 354 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1u1u n ALA 354 Cb 0.00 0.34 0.11 0.00 0.00 0.00 0.00 19.45 19.90 1u1u n ALA 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u1u n ALA 355 N -1.88 0.18 -0.17 0.00 0.00 0.13 0.12 120.51 118.89 1u1u n ALA 355 Ca 0.00 0.95 -0.05 0.00 0.00 0.00 0.00 53.44 54.34 1u1u n ALA 355 Cb 0.00 -0.56 0.04 0.00 0.00 0.00 0.00 19.45 18.93 1u1u n ALA 355 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1u1u h GLN 356 N 0.00 0.56 -0.67 0.00 7.50 -1.35 -2.91 115.11 118.25 1u1u h GLN 356 Ca 0.41 -0.03 0.01 0.00 0.50 0.00 0.00 58.65 59.54 1u1u h GLN 356 Cb 0.63 -0.13 -0.04 0.00 0.05 0.00 0.00 27.48 28.00 1u1u h GLN 356 CO -0.90 0.37 0.43 0.87 -1.50 0.00 0.00 178.83 178.10 1u1u h LYS 357 N 0.58 0.85 -0.56 1.46 1.57 0.44 0.54 116.57 121.44 1u1u h LYS 357 Ca 0.21 -0.05 0.10 0.00 -1.87 0.00 0.00 60.65 59.03 1u1u h LYS 357 Cb 0.04 -0.19 -0.11 0.00 0.08 0.00 0.00 32.23 32.05 1u1u h LYS 357 CO -0.10 0.56 -0.35 0.28 -0.57 0.00 0.00 179.45 179.27 1u1u h VAL 358 N 0.88 0.17 0.19 0.50 2.07 -0.85 -0.32 116.25 118.89 1u1u h VAL 358 Ca 0.25 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.76 1u1u h VAL 358 Cb -0.07 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 1u1u h VAL 358 CO -0.07 0.00 -0.09 0.58 0.02 0.00 0.00 177.57 178.01 1u1u h VAL 359 N -0.19 0.85 -0.74 2.57 2.07 -1.40 -2.79 116.25 116.62 1u1u h VAL 359 Ca 0.21 -0.18 0.10 0.00 0.82 0.00 0.00 66.70 67.65 1u1u h VAL 359 Cb 0.55 0.96 -0.11 0.00 -1.52 0.00 0.00 31.29 31.17 1u1u h VAL 359 CO -0.66 0.04 -0.34 -0.62 0.02 0.00 0.00 177.57 176.01 1u1u n GLU 360 N -5.16 -0.23 -0.26 1.57 -0.58 0.13 0.23 120.64 116.35 1u1u n GLU 360 Ca -0.09 1.13 0.16 0.00 -0.42 0.00 0.00 57.16 57.94 1u1u n GLU 360 Cb 0.16 -1.67 0.46 0.00 -0.57 0.00 0.00 31.44 29.81 1u1u n GLU 360 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1u1u h VAL 361 N 0.00 0.73 0.00 2.62 2.07 -0.84 -2.34 116.25 118.49 1u1u h VAL 361 Ca 0.21 -0.18 -0.19 0.00 0.82 0.00 0.00 66.70 67.36 1u1u h VAL 361 Cb 0.39 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1u1u h VAL 361 CO -0.72 0.10 -0.90 0.78 0.02 0.00 0.00 177.57 176.84 1u1u h ASN 362 N 0.52 0.00 0.61 0.57 2.35 0.30 -0.90 115.58 119.03 1u1u h ASN 362 Ca 0.47 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 56.04 1u1u h ASN 362 Cb 1.00 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.36 1u1u h ASN 362 CO -0.20 0.90 -0.79 0.00 -1.65 0.00 0.00 177.43 175.68 1u1u h ALA 363 N 1.10 0.65 0.00 -0.83 0.00 -0.70 0.28 119.26 119.75 1u1u h ALA 363 Ca -0.01 -0.69 -0.13 0.00 0.00 0.00 0.00 54.91 54.08 1u1u h ALA 363 Cb 1.64 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 1u1u h ALA 363 CO 0.12 0.90 -0.79 -0.07 0.00 0.00 0.00 179.25 179.41 1u1u h LEU 364 N 0.08 0.00 0.30 0.00 3.38 -1.57 0.50 115.31 117.99 1u1u h LEU 364 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1u1u h LEU 364 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1u1u h LEU 364 CO 0.12 0.57 -0.14 0.00 0.09 0.00 0.00 178.44 179.07 1u1u h ALA 365 N 1.43 -0.40 0.63 1.53 0.00 -0.92 -2.89 119.26 118.64 1u1u h ALA 365 Ca -0.05 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1u1u h ALA 365 Cb 1.47 0.15 0.01 0.00 0.00 0.00 0.00 17.79 19.42 1u1u h ALA 365 CO 0.07 -0.57 -0.30 0.87 0.00 0.00 0.00 179.25 179.31 1u1u h LYS 366 N -0.69 -0.82 0.00 0.00 1.79 -0.46 -3.16 116.57 113.23 1u1u h LYS 366 Ca -0.04 0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1u1u h LYS 366 Cb 0.48 0.19 0.00 0.00 -1.58 0.00 0.00 32.23 31.32 1u1u h LYS 366 CO 0.07 -0.55 0.50 0.00 -1.08 0.00 0.00 179.45 178.39 1u1u h ALA 367 N -1.52 1.45 -0.62 3.86 0.00 -0.91 0.64 119.26 122.17 1u1u h ALA 367 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1u1u h ALA 367 Cb 0.65 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 1u1u h ALA 367 CO 0.14 -0.45 0.16 1.28 0.00 0.00 0.00 179.25 180.38 1u1u n LEU 368 N -2.48 5.59 0.00 0.00 4.77 -1.09 -4.27 117.00 119.52 1u1u n LEU 368 Ca -0.01 -2.88 0.00 0.00 -0.03 0.00 0.00 56.01 53.09 1u1u n LEU 368 Cb 0.53 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1u1u n LEU 368 CO 0.07 0.70 0.00 0.00 -1.33 0.00 0.00 177.39 176.83 1u1u n ALA 369 N 0.14 0.00 0.00 -1.18 0.00 0.22 -5.05 120.51 114.64 1u1u n ALA 369 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1u1u n ALA 369 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.68 1u1u n ALA 369 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u1u n GLY 370 N 0.00 0.29 0.90 0.00 0.00 -0.69 -5.07 105.19 100.62 1u1u n GLY 370 Ca 0.00 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 1u1u n GLY 370 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1u1u n GLN 371 N 0.00 0.00 -3.98 1.61 3.00 -1.26 -4.28 117.38 112.47 1u1u n GLN 371 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.68 1u1u n GLN 371 Cb 0.00 -0.36 -0.15 0.00 0.00 0.00 0.00 30.24 29.73 1u1u n GLN 371 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 1u1u s LYS 372 N 2.22 1.44 -0.81 -1.09 2.20 -1.26 -3.41 119.74 119.03 1u1u s LYS 372 Ca 0.35 -1.86 -0.26 0.00 -0.36 0.00 0.00 55.97 53.84 1u1u s LYS 372 Cb -0.30 -3.09 -0.14 0.00 -1.51 0.00 0.00 37.83 32.79 1u1u s LYS 372 CO 0.13 -0.96 2.39 0.34 -0.36 0.00 0.00 175.35 176.89 1u1u s ASP 373 N 0.87 3.84 0.00 1.43 2.15 -1.26 -4.64 116.67 119.06 1u1u s ASP 373 Ca 0.11 -0.02 0.00 0.00 0.43 0.00 0.00 52.55 53.08 1u1u s ASP 373 Cb -0.19 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.87 1u1u s ASP 373 CO -0.09 -3.96 0.58 1.21 -0.17 0.00 0.00 175.17 172.74 1u1u n GLU 374 N 8.78 0.00 0.00 4.34 4.07 -1.26 -0.03 120.64 136.54 1u1u n GLU 374 Ca 0.47 0.09 0.14 0.00 -0.06 0.00 0.00 57.16 57.79 1u1u n GLU 374 Cb 0.43 -1.50 0.55 0.00 -0.06 0.00 0.00 31.44 30.86 1u1u n GLU 374 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1u1u n ALA 375 N -1.08 2.79 -0.11 4.31 0.00 -1.26 -2.82 120.51 122.34 1u1u n ALA 375 Ca 0.00 -0.35 -0.17 0.00 0.00 0.00 0.00 53.44 52.92 1u1u n ALA 375 Cb 0.00 -1.24 -0.10 0.00 0.00 0.00 0.00 19.45 18.11 1u1u n ALA 375 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1u1u n LEU 376 N -0.53 2.81 0.16 0.00 4.77 0.96 -3.76 117.00 121.42 1u1u n LEU 376 Ca 0.16 -0.07 0.03 0.00 -0.03 0.00 0.00 56.01 56.11 1u1u n LEU 376 Cb 0.31 -0.76 0.22 0.00 -2.33 0.00 0.00 43.42 40.85 1u1u n LEU 376 CO 0.22 0.82 0.57 -0.26 -1.33 0.00 0.00 177.39 177.41 1u1u h PHE 377 N -0.11 0.00 0.02 -1.77 -1.00 -1.67 2.58 116.94 114.99 1u1u h PHE 377 Ca -0.51 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.09 1u1u h PHE 377 Cb 1.73 0.00 0.02 0.00 3.61 0.00 0.00 35.95 41.31 1u1u h PHE 377 CO 0.01 0.48 -0.72 0.77 -1.61 0.00 0.00 178.31 177.24 1u1u h SER 378 N 0.00 0.60 0.21 2.17 0.02 -1.75 0.15 113.55 114.96 1u1u h SER 378 Ca -0.00 -0.78 -0.14 0.00 -0.84 0.00 0.00 61.79 60.03 1u1u h SER 378 Cb 1.09 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 1u1u h SER 378 CO 0.06 1.31 -0.51 0.00 -1.14 0.00 0.00 176.83 176.54 1u1u h ALA 379 N 0.31 0.89 0.01 3.77 0.00 -1.60 -3.05 119.26 119.59 1u1u h ALA 379 Ca -0.10 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 1u1u h ALA 379 Cb 1.43 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1u1u h ALA 379 CO 0.14 0.67 -0.01 -0.97 0.00 0.00 0.00 179.25 179.09 1u1u h ASN 380 N 0.27 -0.01 0.00 0.00 -0.00 0.46 -1.36 115.58 114.94 1u1u h ASN 380 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.31 1u1u h ASN 380 Cb 1.00 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.32 1u1u h ASN 380 CO 0.09 -0.01 0.43 0.00 -0.00 0.00 0.00 177.43 177.94 1u1u h ALA 381 N -1.99 1.32 0.00 1.57 0.00 -1.07 0.86 119.26 119.95 1u1u h ALA 381 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1u1u h ALA 381 Cb 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1u1u h ALA 381 CO 0.00 -0.32 -0.17 0.00 0.00 0.00 0.00 179.25 178.76 1u1u h ALA 382 N 0.91 0.03 -1.02 0.00 0.00 -1.40 -0.07 119.26 117.72 1u1u h ALA 382 Ca 0.00 -0.50 0.25 0.00 0.00 0.00 0.00 54.91 54.66 1u1u h ALA 382 Cb 0.87 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.68 1u1u h ALA 382 CO 0.00 0.10 0.66 0.00 0.00 0.00 0.00 179.25 180.02 1u1u h ALA 383 N -0.27 2.26 -1.99 0.00 0.00 0.18 -1.20 119.26 118.25 1u1u h ALA 383 Ca -0.04 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1u1u h ALA 383 Cb 0.85 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1u1u h ALA 383 CO -0.03 -0.64 0.00 1.28 0.00 0.00 0.00 179.25 179.87 1u1u n LEU 384 N -4.58 0.80 0.00 0.00 4.77 -0.13 -3.66 117.00 114.20 1u1u n LEU 384 Ca 0.24 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 1u1u n LEU 384 Cb 0.85 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 1u1u n LEU 384 CO 0.27 -0.17 0.00 0.00 -1.33 0.00 0.00 177.39 176.17 1u1u n ALA 385 N -1.01 0.00 -0.30 -1.18 0.00 -0.04 0.75 120.51 118.73 1u1u n ALA 385 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1u1u n ALA 385 Cb 0.00 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.63 1u1u n ALA 385 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1u1u h SER 386 N 0.00 1.00 0.30 0.00 4.64 -1.41 -3.25 113.55 114.83 1u1u h SER 386 Ca 0.00 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1u1u h SER 386 Cb 0.00 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 61.85 1u1u h SER 386 CO 0.00 0.72 -0.14 -0.09 -0.87 0.00 0.00 176.83 176.44 1u1u h ARG 387 N 1.18 -0.38 -0.48 4.77 2.43 0.26 0.90 114.38 123.05 1u1u h ARG 387 Ca 0.33 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.53 1u1u h ARG 387 Cb -0.10 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1u1u h ARG 387 CO -0.08 -0.08 0.00 0.54 -1.51 0.00 0.00 179.97 178.84 1u1u n ARG 388 N -5.14 0.48 0.05 0.20 1.74 -1.20 -3.60 116.66 109.19 1u1u n ARG 388 Ca -0.10 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 1u1u n ARG 388 Cb 0.25 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.45 1u1u n ARG 388 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1u1u n SER 389 N 0.26 -0.47 -3.25 0.55 3.41 -1.11 -5.01 113.62 107.99 1u1u n SER 389 Ca 0.00 0.19 -0.46 0.00 -0.26 0.00 0.00 58.87 58.34 1u1u n SER 389 Cb 0.12 0.61 -0.08 0.00 -0.26 0.00 0.00 64.21 64.60 1u1u n SER 389 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1u1u n SER 390 N -2.79 0.74 0.00 4.04 2.88 0.31 -4.64 113.62 114.16 1u1u n SER 390 Ca 0.00 0.71 0.00 0.00 -1.33 0.00 0.00 58.87 58.25 1u1u n SER 390 Cb 0.00 -0.63 0.00 0.00 -0.75 0.00 0.00 64.21 62.83 1u1u n SER 390 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1u1u n PRO 391 N 3.80 0.00 0.21 -1.46 -0.02 -1.26 0.27 135.00 136.54 1u1u n PRO 391 Ca 0.29 0.06 0.10 0.00 -2.02 0.00 0.00 63.50 61.92 1u1u n PRO 391 Cb -0.04 -1.51 0.34 0.00 -0.02 0.00 0.00 33.50 32.27 1u1u n PRO 391 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1u1u h ARG 392 N 0.00 0.00 0.00 -0.52 3.08 -1.94 -3.41 114.38 111.60 1u1u h ARG 392 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1u1u h ARG 392 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1u1u h ARG 392 CO 0.00 0.21 0.00 0.28 -1.07 0.00 0.00 179.97 179.39 1u1u n VAL 393 N -3.25 0.00 -1.69 2.04 0.31 0.14 -4.17 118.33 111.71 1u1u n VAL 393 Ca 0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.92 1u1u n VAL 393 Cb 0.50 -0.14 -0.03 0.00 -0.91 0.00 0.00 33.84 33.26 1u1u n VAL 393 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1u1u s THR 394 N 0.11 3.06 0.35 2.52 -4.23 -1.25 -2.99 115.64 113.19 1u1u s THR 394 Ca 0.00 0.07 0.07 0.00 -1.18 0.00 0.00 61.69 60.65 1u1u s THR 394 Cb 0.00 -3.05 -0.07 0.00 1.34 0.00 0.00 72.50 70.73 1u1u s THR 394 CO 0.00 -0.01 -0.02 0.21 -0.54 0.00 0.00 174.62 174.27 1u1u s ASN 395 N 4.47 3.22 0.00 3.99 3.84 -1.26 -4.74 114.94 124.47 1u1u s ASN 395 Ca 0.88 -1.30 0.00 0.00 0.21 0.00 0.00 52.86 52.65 1u1u s ASN 395 Cb -0.42 -0.26 0.00 0.00 -0.55 0.00 0.00 41.25 40.02 1u1u s ASN 395 CO 0.41 -0.41 0.46 -0.62 -2.79 0.00 0.00 177.10 174.14 1u1u n GLU 396 N -0.78 0.74 0.10 0.43 -0.58 -1.26 -1.61 120.64 117.69 1u1u n GLU 396 Ca -0.04 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.81 1u1u n GLU 396 Cb 0.65 -1.31 -0.01 0.00 -0.57 0.00 0.00 31.44 30.21 1u1u n GLU 396 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1u1u n GLY 397 N 0.25 -1.45 0.93 0.62 0.00 -1.26 -3.47 105.19 100.80 1u1u n GLY 397 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1u1u n GLY 397 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1u1u n VAL 398 N -2.69 0.48 -0.05 1.61 0.31 -0.63 -2.98 118.33 114.39 1u1u n VAL 398 Ca -0.01 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 1u1u n VAL 398 Cb 0.56 -0.71 -0.00 0.00 -0.91 0.00 0.00 33.84 32.78 1u1u n VAL 398 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 1u1u h GLN 399 N 0.80 0.00 -4.52 5.55 -0.00 -1.82 -3.40 115.11 111.73 1u1u h GLN 399 Ca 0.00 0.00 -0.70 0.00 -0.00 0.00 0.00 58.65 57.95 1u1u h GLN 399 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 27.48 27.95 1u1u h GLN 399 CO 0.00 0.00 2.87 1.63 0.00 0.00 0.00 178.83 183.33 1u1u n LYS 400 N -4.38 2.94 0.00 1.69 4.76 -1.16 -3.77 118.16 118.23 1u1u n LYS 400 Ca -0.01 -2.78 0.00 0.00 -2.87 0.00 0.00 58.31 52.64 1u1u n LYS 400 Cb 0.05 -3.35 0.00 0.00 -1.84 0.00 0.00 35.03 29.90 1u1u n LYS 400 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1u1u n ALA 401 N 6.76 2.47 0.41 7.82 0.00 -1.26 -4.57 120.51 132.13 1u1u n ALA 401 Ca 0.51 0.00 0.07 0.00 0.00 0.00 0.00 53.44 54.02 1u1u n ALA 401 Cb 0.41 0.00 0.30 0.00 0.00 0.00 0.00 19.45 20.16 1u1u n ALA 401 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u1u n ALA 402 N -2.25 1.55 0.20 0.00 0.00 -1.25 0.64 120.51 119.41 1u1u n ALA 402 Ca 0.00 -0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.51 1u1u n ALA 402 Cb 0.00 -1.23 0.16 0.00 0.00 0.00 0.00 19.45 18.38 1u1u n ALA 402 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u1u n ALA 403 N -1.54 2.37 -0.10 0.00 0.00 -1.26 -4.31 120.51 115.66 1u1u n ALA 403 Ca 0.03 -0.94 -0.16 0.00 0.00 0.00 0.00 53.44 52.37 1u1u n ALA 403 Cb 0.15 -0.62 -0.05 0.00 0.00 0.00 0.00 19.45 18.92 1u1u n ALA 403 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u1u n ALA 404 N 1.01 1.14 0.00 0.00 0.00 0.21 -4.20 120.51 118.67 1u1u n ALA 404 Ca 0.14 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 52.72 1u1u n ALA 404 Cb 0.48 0.09 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1u1u n ALA 404 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1u1u n LEU 405 N -4.31 0.00 -3.79 0.00 7.99 -0.79 -3.70 117.00 112.41 1u1u n LEU 405 Ca -0.27 0.38 -0.42 0.00 -0.01 0.00 0.00 56.01 55.69 1u1u n LEU 405 Cb 0.62 -0.38 -0.02 0.00 -0.11 0.00 0.00 43.42 43.54 1u1u n LEU 405 CO 0.13 -0.38 2.43 1.17 -1.51 0.00 0.00 177.39 179.24 1u1u n LYS 406 N -1.37 2.44 -1.22 3.23 4.81 -1.26 -4.86 118.16 119.93 1u1u n LYS 406 Ca 0.00 -2.42 0.06 0.00 -0.87 0.00 0.00 58.31 55.07 1u1u n LYS 406 Cb 0.07 -3.21 -0.03 0.00 0.02 0.00 0.00 35.03 31.87 1u1u n LYS 406 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1u1u n GLY 407 N 4.38 -3.60 0.00 3.14 0.00 -1.24 -4.95 105.19 102.92 1u1u n GLY 407 Ca 0.51 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1u1u n GLY 407 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u1u n SER 408 N -3.00 0.00 -2.72 1.61 3.41 -1.26 -4.92 113.62 106.74 1u1u n SER 408 Ca -0.03 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.54 1u1u n SER 408 Cb 0.46 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.50 1u1u n SER 408 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1u1u n ASP 409 N 0.00 -0.24 -4.52 4.04 9.92 -1.26 -5.10 116.55 119.38 1u1u n ASP 409 Ca 0.00 -2.28 -0.44 0.00 -0.53 0.00 0.00 54.79 51.55 1u1u n ASP 409 Cb 0.00 0.23 -0.01 0.00 -0.64 0.00 0.00 41.12 40.71 1u1u n ASP 409 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1u1u n HIS 410 N -0.88 0.47 -1.80 1.24 8.25 -1.26 -4.64 115.22 116.60 1u1u n HIS 410 Ca -0.04 0.69 -0.42 0.00 -0.26 0.00 0.00 57.72 57.69 1u1u n HIS 410 Cb 0.84 -2.13 -0.03 0.00 1.12 0.00 0.00 29.99 29.80 1u1u n HIS 410 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1u1u s ARG 411 N -1.55 4.16 0.00 -0.41 3.52 -1.26 -4.31 118.95 119.09 1u1u s ARG 411 Ca 0.61 2.45 0.00 0.00 -0.13 0.00 0.00 55.73 58.66 1u1u s ARG 411 Cb -0.68 -4.06 0.00 0.00 -1.56 0.00 0.00 34.95 28.65 1u1u s ARG 411 CO 0.58 -0.90 0.00 0.54 -0.81 0.00 0.00 175.30 174.71 1u1u n ARG 412 N 7.27 0.00 0.00 5.12 5.12 -1.26 -4.40 116.66 128.52 1u1u n ARG 412 Ca 0.19 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.11 1u1u n ARG 412 Cb 0.42 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.72 1u1u n ARG 412 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1u1u n ALA 413 N 0.00 0.00 -2.72 7.54 0.00 -1.26 -4.93 120.51 119.14 1u1u n ALA 413 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1u1u n ALA 413 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1u1u n ALA 413 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1u1u n THR 414 N 0.00-10.57 -0.52 0.00 -1.04 -1.26 -4.48 114.28 96.41 1u1u n THR 414 Ca 0.00 2.12 -0.41 0.00 -2.04 0.00 0.00 64.05 63.72 1u1u n THR 414 Cb 0.00 -5.89 -0.11 0.00 -1.82 0.00 0.00 70.33 62.51 1u1u n THR 414 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1u1u n ASN 415 N 1.63 0.85 0.00 8.00 4.05 -1.26 -4.68 115.26 123.85 1u1u n ASN 415 Ca -0.27 -2.36 0.00 0.00 0.45 0.00 0.00 54.58 52.40 1u1u n ASN 415 Cb 0.44 -0.47 0.00 0.00 1.23 0.00 0.00 39.78 40.98 1u1u n ASN 415 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 177.26 174.76 1u1u n VAL 416 N 6.72 0.00 0.22 3.44 3.14 -1.26 -1.57 118.33 129.02 1u1u n VAL 416 Ca 0.43 0.00 0.02 0.00 -2.96 0.00 0.00 64.34 61.82 1u1u n VAL 416 Cb 0.40 0.00 0.09 0.00 -1.06 0.00 0.00 33.84 33.27 1u1u n VAL 416 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1u1u n SER 417 N 0.00 0.00 -0.08 6.55 3.41 -1.26 0.80 113.62 123.03 1u1u n SER 417 Ca 0.00 -0.12 -0.07 0.00 -0.26 0.00 0.00 58.87 58.42 1u1u n SER 417 Cb 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 63.79 1u1u n SER 417 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u1u n ALA 418 N -0.94 1.70 -0.06 7.33 0.00 -0.61 -4.21 120.51 123.73 1u1u n ALA 418 Ca 0.02 -1.20 -0.13 0.00 0.00 0.00 0.00 53.44 52.13 1u1u n ALA 418 Cb 0.01 -0.28 -0.14 0.00 0.00 0.00 0.00 19.45 19.03 1u1u n ALA 418 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1u1u n ARG 419 N -2.68 0.68 -0.34 0.00 0.63 0.15 -4.10 116.66 111.00 1u1u n ARG 419 Ca -0.28 0.18 0.14 0.00 -0.92 0.00 0.00 57.85 56.96 1u1u n ARG 419 Cb 1.07 -1.65 0.35 0.00 0.45 0.00 0.00 32.46 32.67 1u1u n ARG 419 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1u1u h LEU 420 N 0.01 0.74 -0.71 6.15 3.38 0.18 0.49 115.31 125.56 1u1u h LEU 420 Ca -0.44 0.09 0.05 0.00 0.09 0.00 0.00 57.88 57.66 1u1u h LEU 420 Cb 2.07 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 42.72 1u1u h LEU 420 CO 0.04 0.27 0.42 0.44 0.09 0.00 0.00 178.44 179.70 1u1u h ASP 421 N 0.72 0.65 0.44 -0.43 3.32 -1.73 -2.80 116.42 116.59 1u1u h ASP 421 Ca 0.56 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.61 1u1u h ASP 421 Cb 0.93 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.36 1u1u h ASP 421 CO -0.34 0.43 -0.21 0.00 -1.72 0.00 0.00 179.24 177.40 1u1u h ALA 422 N 1.34 -0.59 0.00 3.45 0.00 -0.32 -2.55 119.26 120.59 1u1u h ALA 422 Ca 0.30 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1u1u h ALA 422 Cb 0.12 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1u1u h ALA 422 CO -0.15 -0.71 0.00 1.04 0.00 0.00 0.00 179.25 179.43 1u1u n GLN 423 N -5.25 0.00 -0.08 0.00 6.02 0.28 -0.68 117.38 117.67 1u1u n GLN 423 Ca -0.11 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.72 1u1u n GLN 423 Cb 0.29 -1.15 -0.05 0.00 1.02 0.00 0.00 30.24 30.35 1u1u n GLN 423 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1u1u n GLN 424 N -0.49 0.39 -0.13 -1.09 1.13 -0.97 -4.01 117.38 112.20 1u1u n GLN 424 Ca 0.00 0.17 -0.08 0.00 -1.94 0.00 0.00 57.00 55.14 1u1u n GLN 424 Cb 0.00 -1.16 0.00 0.00 0.11 0.00 0.00 30.24 29.19 1u1u n GLN 424 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1u1u h LYS 425 N -0.68 0.55 -0.30 -1.09 3.64 -0.82 -1.66 116.57 116.22 1u1u h LYS 425 Ca -0.33 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1u1u h LYS 425 Cb 1.19 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1u1u h LYS 425 CO -0.20 0.41 0.00 1.17 -2.27 0.00 0.00 179.45 178.56 1u1u n LYS 426 N -4.77 1.65 -3.12 1.90 3.00 -0.77 -4.47 118.16 111.58 1u1u n LYS 426 Ca 0.01 -0.94 0.05 0.00 -0.00 0.00 0.00 58.31 57.42 1u1u n LYS 426 Cb 0.05 -1.24 0.00 0.00 0.00 0.00 0.00 35.03 33.84 1u1u n LYS 426 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1u1u s LEU 427 N -1.00 -0.71 0.00 3.14 1.43 -0.80 -5.01 118.68 115.74 1u1u s LEU 427 Ca 0.17 0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.31 1u1u s LEU 427 Cb 0.09 1.39 0.00 0.00 0.03 0.00 0.00 46.19 47.70 1u1u s LEU 427 CO 0.11 -0.12 0.00 -3.20 0.23 0.00 0.00 176.35 173.37 1u1u n ASN 428 N 5.04 0.00 -0.14 2.29 5.15 -0.69 -3.48 115.26 123.43 1u1u n ASN 428 Ca 0.08 0.00 0.01 0.00 -0.60 0.00 0.00 54.58 54.07 1u1u n ASN 428 Cb 0.57 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.82 1u1u n ASN 428 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1u1u n LEU 429 N 0.00 -0.11 0.00 1.20 4.77 -1.26 -4.82 117.00 116.77 1u1u n LEU 429 Ca 0.00 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1u1u n LEU 429 Cb 0.00 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1u1u n LEU 429 CO 0.00 -0.17 0.00 -0.81 -1.33 0.00 0.00 177.39 175.08 1u1u n PRO 430 N -2.07 1.69 -1.42 3.23 -0.04 -1.26 -5.08 135.00 130.05 1u1u n PRO 430 Ca -0.01 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.13 1u1u n PRO 430 Cb 0.06 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 33.60 1u1u n PRO 430 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1u1u s ILE 431 N 0.97 2.95 -0.43 0.52 1.01 -1.26 -3.89 121.20 121.08 1u1u s ILE 431 Ca 0.00 0.39 -0.04 0.00 0.00 0.00 0.00 60.65 61.00 1u1u s ILE 431 Cb 0.00 -2.85 0.01 0.00 0.01 0.00 0.00 42.46 39.63 1u1u s ILE 431 CO 0.00 -0.33 0.29 0.18 0.00 0.00 0.00 174.94 175.08 1u1u n LEU 432 N -3.02 -0.63 -4.68 2.97 4.32 -1.26 -4.75 117.00 109.96 1u1u n LEU 432 Ca 0.11 -0.50 -0.46 0.00 -0.02 0.00 0.00 56.01 55.14 1u1u n LEU 432 Cb 0.52 -0.74 -0.04 0.00 -1.62 0.00 0.00 43.42 41.54 1u1u n LEU 432 CO 0.50 0.24 1.27 -0.81 -1.22 0.00 0.00 177.39 177.37 1u1u n PRO 433 N -1.85 2.25 -2.88 3.23 -0.04 -1.25 -4.45 135.00 130.01 1u1u n PRO 433 Ca -0.13 0.82 -0.36 0.00 -0.04 0.00 0.00 63.50 63.78 1u1u n PRO 433 Cb 0.31 -2.61 -0.06 0.00 -0.04 0.00 0.00 33.50 31.10 1u1u n PRO 433 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1u1u s THR 434 N 1.45 4.33 0.15 0.52 -4.23 -1.26 -2.75 115.64 113.85 1u1u s THR 434 Ca 0.80 1.64 -0.09 0.00 -1.18 0.00 0.00 61.69 62.86 1u1u s THR 434 Cb -0.65 -3.94 0.03 0.00 1.34 0.00 0.00 72.50 69.28 1u1u s THR 434 CO 0.39 0.13 0.44 1.07 -0.54 0.00 0.00 174.62 176.11 1u1u n THR 435 N 0.52 0.00 0.00 3.99 5.66 -0.48 -1.94 114.28 122.03 1u1u n THR 435 Ca 0.01 -0.39 0.00 0.00 -3.05 0.00 0.00 64.05 60.62 1u1u n THR 435 Cb 0.51 0.44 0.00 0.00 -1.55 0.00 0.00 70.33 69.72 1u1u n THR 435 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1u1u n THR 436 N -0.30 0.00 0.08 1.09 -1.04 -1.26 -4.05 114.28 108.79 1u1u n THR 436 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1u1u n THR 436 Cb 0.29 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.80 1u1u n THR 436 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1u1u n ILE 437 N 0.00 0.03 0.00 12.58 2.08 -1.26 -4.02 119.36 128.76 1u1u n ILE 437 Ca 0.00 0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.32 1u1u n ILE 437 Cb 0.00 -0.54 0.00 0.00 -0.75 0.00 0.00 39.64 38.35 1u1u n ILE 437 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1u1u n GLY 438 N 1.57 0.04 3.34 7.39 0.00 -1.26 -4.90 105.19 111.36 1u1u n GLY 438 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 46.02 45.83 1u1u n GLY 438 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1u1u s SER 439 N -1.04 1.38 0.11 1.61 1.04 -1.26 -4.19 113.70 111.35 1u1u s SER 439 Ca 0.00 -1.39 -0.03 0.00 0.48 0.00 0.00 55.95 55.01 1u1u s SER 439 Cb 0.00 0.13 -0.03 0.00 0.10 0.00 0.00 66.02 66.22 1u1u s SER 439 CO 0.00 -0.71 0.08 -0.36 0.98 0.00 0.00 173.24 173.22 1u1u s PHE 440 N -3.68 0.61 1.08 5.02 0.40 -1.20 -2.71 117.98 117.49 1u1u s PHE 440 Ca 0.38 -1.04 -0.12 0.00 -0.60 0.00 0.00 56.93 55.54 1u1u s PHE 440 Cb 0.08 -0.35 0.23 0.00 0.51 0.00 0.00 43.02 43.50 1u1u s PHE 440 CO 0.14 -0.51 1.06 -2.14 0.70 0.00 0.00 175.22 174.47 1u1u s PRO 441 N -3.98 -0.21 0.00 0.24 0.02 -1.17 -4.70 135.00 125.21 1u1u s PRO 441 Ca 0.16 0.82 0.00 0.00 0.02 0.00 0.00 61.00 62.00 1u1u s PRO 441 Cb 0.07 -1.64 0.00 0.00 0.02 0.00 0.00 34.50 32.95 1u1u s PRO 441 CO -0.04 -3.25 0.00 1.04 -0.33 0.00 0.00 177.00 174.43 1u1u n GLN 442 N -4.58 1.80 0.00 5.54 6.02 -1.26 -5.12 117.38 119.78 1u1u n GLN 442 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 1u1u n GLN 442 Cb 0.55 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.81 1u1u n GLN 442 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1u1u n THR 443 N -0.24 0.00 0.06 5.09 -1.04 -1.26 -5.03 114.28 111.86 1u1u n THR 443 Ca 0.00 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.98 1u1u n THR 443 Cb 0.00 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.50 1u1u n THR 443 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1u1u h VAL 444 N 0.00 0.00 -1.22 12.58 2.07 -2.08 -3.50 116.25 124.10 1u1u h VAL 444 Ca 0.00 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1u1u h VAL 444 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 1u1u h VAL 444 CO 0.00 0.00 -0.31 -0.62 0.02 0.00 0.00 177.57 176.66 1u1u n GLU 445 N -3.47 -1.45 -4.68 1.57 -0.58 -1.26 -5.04 120.64 105.73 1u1u n GLU 445 Ca -0.02 1.09 -0.29 0.00 -0.42 0.00 0.00 57.16 57.52 1u1u n GLU 445 Cb 0.07 -1.28 -0.14 0.00 -0.57 0.00 0.00 31.44 29.52 1u1u n GLU 445 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1u1u s LEU 446 N -3.01 2.22 -0.43 -4.62 2.01 -1.26 -5.27 118.68 108.32 1u1u s LEU 446 Ca 0.00 -0.63 0.08 0.00 0.01 0.00 0.00 54.13 53.59 1u1u s LEU 446 Cb 0.00 -1.19 0.27 0.00 0.01 0.00 0.00 46.19 45.28 1u1u s LEU 446 CO 0.00 0.21 0.76 0.54 1.01 0.00 0.00 176.35 178.87 1u1u n ARG 447 N 1.50 0.82 -0.47 1.70 1.74 -1.26 -5.25 116.66 115.44 1u1u n ARG 447 Ca -0.17 -2.58 -0.23 0.00 -0.77 0.00 0.00 57.85 54.10 1u1u n ARG 447 Cb 0.53 -1.35 0.19 0.00 -1.02 0.00 0.00 32.46 30.80 1u1u n ARG 447 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1u1u n GLU 461 N 1.14 -2.84 -1.63 5.56 -0.58 -1.26 -5.36 120.64 115.67 1u1u n GLU 461 Ca 0.16 -0.84 -0.28 0.00 -0.42 0.00 0.00 57.16 55.78 1u1u n GLU 461 Cb 0.61 -1.63 0.06 0.00 -0.57 0.00 0.00 31.44 29.91 1u1u n GLU 461 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1u1u n ASP 462 N -2.53 6.11 0.00 1.62 10.43 -1.26 -4.22 116.55 126.70 1u1u n ASP 462 Ca 0.07 -3.77 0.00 0.00 2.57 0.00 0.00 54.79 53.66 1u1u n ASP 462 Cb 0.45 -0.66 0.00 0.00 1.84 0.00 0.00 41.12 42.75 1u1u n ASP 462 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1u1u n TYR 463 N -0.83 0.00 0.65 1.24 4.02 -1.26 -3.72 117.16 117.26 1u1u n TYR 463 Ca 0.53 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.54 1u1u n TYR 463 Cb 0.84 0.00 0.46 0.00 -0.02 0.00 0.00 39.34 40.62 1u1u n TYR 463 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 176.86 177.40 1u1u n VAL 464 N -0.87 0.55 0.00 -0.72 3.14 -1.26 -2.77 118.33 116.41 1u1u n VAL 464 Ca 0.00 -0.05 0.00 0.00 -2.96 0.00 0.00 64.34 61.33 1u1u n VAL 464 Cb 0.13 -0.74 0.00 0.00 -1.06 0.00 0.00 33.84 32.17 1u1u n VAL 464 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 1u1u n LYS 465 N -2.00 4.61 0.00 1.45 4.76 -1.26 -4.61 118.16 121.12 1u1u n LYS 465 Ca 0.05 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.49 1u1u n LYS 465 Cb 0.34 -0.45 0.00 0.00 -1.84 0.00 0.00 35.03 33.07 1u1u n LYS 465 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1u1u n ALA 466 N -0.80 0.00 -0.16 7.82 0.00 -1.11 -4.13 120.51 122.12 1u1u n ALA 466 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 1u1u n ALA 466 Cb 0.00 0.00 0.51 0.00 0.00 0.00 0.00 19.45 19.96 1u1u n ALA 466 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1u1u h ILE 467 N 0.00 0.78 -0.30 0.00 2.04 -1.84 -2.80 117.51 115.39 1u1u h ILE 467 Ca 0.00 -0.14 0.05 0.00 1.00 0.00 0.00 64.86 65.78 1u1u h ILE 467 Cb 0.00 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.38 1u1u h ILE 467 CO 0.00 0.07 -0.10 1.17 0.00 0.00 0.00 178.15 179.29 1u1u n LYS 468 N -4.47 -0.05 -0.02 2.37 4.81 -1.26 0.13 118.16 119.67 1u1u n LYS 468 Ca 0.15 0.46 -0.18 0.00 -0.87 0.00 0.00 58.31 57.87 1u1u n LYS 468 Cb 0.55 -0.69 -0.14 0.00 0.02 0.00 0.00 35.03 34.77 1u1u n LYS 468 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1u1u n GLU 469 N -4.46 0.72 -0.07 1.64 4.07 -1.06 -3.52 120.64 117.96 1u1u n GLU 469 Ca 0.04 0.25 0.24 0.00 -0.06 0.00 0.00 57.16 57.62 1u1u n GLU 469 Cb 0.13 -1.70 0.71 0.00 -0.06 0.00 0.00 31.44 30.52 1u1u n GLU 469 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1u1u h GLU 470 N 0.05 0.00 0.07 5.31 5.08 0.11 0.64 114.58 125.85 1u1u h GLU 470 Ca -0.42 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 57.67 1u1u h GLU 470 Cb 2.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.26 1u1u h GLU 470 CO 0.07 0.00 -1.37 0.97 -1.00 0.00 0.00 179.01 177.67 1u1u h ILE 471 N 0.00 1.31 -0.35 3.13 6.09 0.60 -2.93 117.51 125.35 1u1u h ILE 471 Ca 0.32 -2.99 -0.15 0.00 -1.37 0.00 0.00 64.86 60.68 1u1u h ILE 471 Cb 1.30 2.76 -0.01 0.00 0.47 0.00 0.00 36.82 41.35 1u1u h ILE 471 CO -0.00 0.83 -0.37 0.11 -3.07 0.00 0.00 178.15 175.65 1u1u h LYS 472 N 0.04 0.83 -0.45 2.19 1.57 -1.10 0.44 116.57 120.09 1u1u h LYS 472 Ca -0.17 -0.42 0.02 0.00 -1.87 0.00 0.00 60.65 58.22 1u1u h LYS 472 Cb 1.95 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 34.24 1u1u h LYS 472 CO 0.15 1.05 0.30 0.87 -0.57 0.00 0.00 179.45 181.25 1u1u h LYS 473 N 0.68 0.51 0.40 3.15 1.57 -1.03 0.40 116.57 122.26 1u1u h LYS 473 Ca 0.06 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1u1u h LYS 473 Cb 0.93 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1u1u h LYS 473 CO 0.09 0.34 -0.19 0.28 -0.57 0.00 0.00 179.45 179.39 1u1u h VAL 474 N 0.53 0.00 0.00 0.50 2.07 -1.03 0.20 116.25 118.52 1u1u h VAL 474 Ca 0.18 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1u1u h VAL 474 Cb 0.06 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.83 1u1u h VAL 474 CO -0.04 0.00 0.00 0.58 0.02 0.00 0.00 177.57 178.13 1u1u h VAL 475 N -0.83 0.00 0.04 2.57 2.07 0.06 -1.13 116.25 119.03 1u1u h VAL 475 Ca -0.06 -0.01 -0.35 0.00 0.82 0.00 0.00 66.70 67.11 1u1u h VAL 475 Cb 0.41 0.75 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 1u1u h VAL 475 CO 0.09 0.00 -2.06 -0.67 0.02 0.00 0.00 177.57 174.95 1u1u n ASP 476 N -2.66 1.35 0.24 0.57 -0.08 0.14 -3.07 116.55 113.04 1u1u n ASP 476 Ca -0.02 0.18 0.15 0.00 -1.51 0.00 0.00 54.79 53.58 1u1u n ASP 476 Cb 0.06 -0.22 0.47 0.00 2.34 0.00 0.00 41.12 43.77 1u1u n ASP 476 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1u1u h LEU 477 N 0.02 0.00 0.00 -2.67 6.46 0.34 -2.39 115.31 117.07 1u1u h LEU 477 Ca -0.43 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.33 1u1u h LEU 477 Cb 2.04 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.97 1u1u h LEU 477 CO 0.04 0.00 0.00 0.00 -0.62 0.00 0.00 178.44 177.86 1u1u n GLN 478 N -3.03 0.00 -0.49 1.25 6.02 -0.52 -4.21 117.38 116.40 1u1u n GLN 478 Ca 0.02 0.27 0.42 0.00 -0.01 0.00 0.00 57.00 57.70 1u1u n GLN 478 Cb 0.39 -0.75 0.75 0.00 1.02 0.00 0.00 30.24 31.65 1u1u n GLN 478 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 1u1u h GLU 479 N 0.00 0.04 -6.22 -1.09 4.11 -1.68 -2.95 114.58 106.79 1u1u h GLU 479 Ca 0.00 -0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.86 1u1u h GLU 479 Cb 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1u1u h GLU 479 CO 0.00 0.03 1.26 -2.00 0.07 0.00 0.00 179.01 178.37 1u1u s GLU 480 N -5.01 3.60 -0.04 1.06 2.56 -0.90 -3.94 118.70 116.05 1u1u s GLU 480 Ca -0.06 1.86 -0.00 0.00 0.00 0.00 0.00 54.97 56.77 1u1u s GLU 480 Cb 0.26 -4.17 0.00 0.00 2.00 0.00 0.00 34.13 32.22 1u1u s GLU 480 CO 0.84 -1.54 0.01 1.47 -0.56 0.00 0.00 175.26 175.48 1u1u n LEU 481 N 9.44 -0.02 0.00 2.70 -0.00 -1.26 -3.17 117.00 124.69 1u1u n LEU 481 Ca 0.22 0.06 0.00 0.00 -0.00 0.00 0.00 56.01 56.29 1u1u n LEU 481 Cb 0.45 -0.19 0.00 0.00 -0.00 0.00 0.00 43.42 43.68 1u1u n LEU 481 CO 0.66 0.00 0.00 0.47 -0.00 0.00 0.00 177.39 178.52 1u1u n ASP 482 N -0.21 0.00 -1.84 1.45 9.92 -1.11 -4.87 116.55 119.89 1u1u n ASP 482 Ca 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1u1u n ASP 482 Cb 0.09 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.57 1u1u n ASP 482 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1u1u n ILE 483 N 0.00 -4.74 0.00 0.53 5.41 -1.19 -4.36 119.36 115.01 1u1u n ILE 483 Ca 0.00 0.48 0.00 0.00 1.00 0.00 0.00 62.75 64.23 1u1u n ILE 483 Cb 0.00 -4.83 0.00 0.00 -0.71 0.00 0.00 39.64 34.10 1u1u n ILE 483 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1u1u n ASP 484 N 0.11 0.00 -4.87 4.38 8.00 -1.26 -4.47 116.55 118.44 1u1u n ASP 484 Ca 0.00 0.70 -0.32 0.00 0.71 0.00 0.00 54.79 55.88 1u1u n ASP 484 Cb 0.02 -0.20 -0.05 0.00 -0.02 0.00 0.00 41.12 40.86 1u1u n ASP 484 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1u1u s VAL 485 N -1.81 4.94 0.49 2.53 1.01 -0.82 -3.62 120.40 123.12 1u1u s VAL 485 Ca 0.00 0.49 0.02 0.00 0.00 0.00 0.00 61.98 62.49 1u1u s VAL 485 Cb 0.00 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.73 1u1u s VAL 485 CO 0.00 -0.02 0.01 -0.76 0.00 0.00 0.00 175.10 174.33 1u1u s LEU 486 N -2.68 2.37 -0.02 3.92 1.43 0.32 -4.37 118.68 119.67 1u1u s LEU 486 Ca 0.45 -1.61 -0.01 0.00 -1.03 0.00 0.00 54.13 51.93 1u1u s LEU 486 Cb -0.12 -0.74 0.01 0.00 0.03 0.00 0.00 46.19 45.37 1u1u s LEU 486 CO 0.21 -0.79 0.04 0.68 0.23 0.00 0.00 176.35 176.72 1u1u s VAL 487 N -2.86 -0.01 -0.07 -1.59 -7.23 -1.26 -2.96 120.40 104.43 1u1u s VAL 487 Ca 0.11 0.02 -0.25 0.00 -1.81 0.00 0.00 61.98 60.04 1u1u s VAL 487 Cb 0.03 -0.07 -0.21 0.00 0.56 0.00 0.00 36.38 36.69 1u1u s VAL 487 CO 0.05 0.01 1.00 1.12 -0.31 0.00 0.00 175.10 176.97 1u1u h HIS 488 N 6.20 -0.05 0.00 2.82 2.07 -1.92 -3.47 115.15 120.81 1u1u h HIS 488 Ca -0.26 -0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.26 1u1u h HIS 488 Cb 1.20 0.01 0.00 0.00 2.57 0.00 0.00 27.41 31.19 1u1u h HIS 488 CO 0.42 0.58 0.00 0.41 -3.07 0.00 0.00 177.93 176.27 1u1u n GLY 489 N 0.77 1.79 2.40 6.13 0.00 -1.26 -4.84 105.19 110.19 1u1u n GLY 489 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 1u1u n GLY 489 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1u1u n GLU 490 N -0.53 -0.94 -0.08 1.61 1.02 -1.26 -4.24 120.64 116.22 1u1u n GLU 490 Ca 0.00 0.03 -0.13 0.00 -0.02 0.00 0.00 57.16 57.04 1u1u n GLU 490 Cb 0.00 -1.06 -0.05 0.00 -0.02 0.00 0.00 31.44 30.31 1u1u n GLU 490 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1u1u h PRO 491 N -0.08 0.56 -2.96 3.49 0.13 -1.95 -3.29 132.00 127.90 1u1u h PRO 491 Ca -0.15 -0.28 -0.15 0.00 -0.87 0.00 0.00 66.00 64.56 1u1u h PRO 491 Cb 0.33 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.45 1u1u h PRO 491 CO 0.20 0.86 0.87 -0.85 -0.23 0.00 0.00 178.00 178.85 1u1u n GLU 492 N -4.41 1.05 0.00 0.86 -0.00 -1.26 -4.69 120.64 112.20 1u1u n GLU 492 Ca -0.04 -0.68 0.00 0.00 -0.00 0.00 0.00 57.16 56.43 1u1u n GLU 492 Cb 0.40 -1.92 0.00 0.00 -0.00 0.00 0.00 31.44 29.92 1u1u n GLU 492 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1u1u n ARG 493 N 3.38 0.00 0.00 3.44 1.74 -1.24 -5.11 116.66 118.87 1u1u n ARG 493 Ca 0.23 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.31 1u1u n ARG 493 Cb 0.27 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.71 1u1u n ARG 493 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1u1u n ASN 494 N 0.00 0.00 0.00 0.55 2.85 -1.26 -5.08 115.26 112.32 1u1u n ASN 494 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1u1u n ASN 494 Cb 0.00 0.12 0.00 0.00 1.24 0.00 0.00 39.78 41.14 1u1u n ASN 494 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1u1u n ASP 495 N -2.05 0.00 0.00 1.20 2.03 -1.26 -4.99 116.55 111.47 1u1u n ASP 495 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1u1u n ASP 495 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1u1u n ASP 495 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1u1u n VAL 497 N 0.00 0.00 -0.31 5.18 0.31 -1.26 0.22 118.33 122.47 1u1u n VAL 497 Ca 0.00 0.00 0.16 0.00 -0.01 0.00 0.00 64.34 64.49 1u1u n VAL 497 Cb 0.00 0.00 0.35 0.00 -0.91 0.00 0.00 33.84 33.28 1u1u n VAL 497 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1u1u h GLU 498 N 0.00 0.27 0.00 5.55 4.39 -1.97 -3.03 114.58 119.79 1u1u h GLU 498 Ca 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1u1u h GLU 498 Cb 0.00 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 1u1u h GLU 498 CO 0.00 0.18 0.00 0.98 -1.16 0.00 0.00 179.01 179.01 1u1u n TYR 499 N -5.14 0.00 0.22 4.33 9.36 0.13 -3.10 117.16 122.97 1u1u n TYR 499 Ca 0.25 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.52 1u1u n TYR 499 Cb 0.77 0.00 0.08 0.00 -0.63 0.00 0.00 39.34 39.56 1u1u n TYR 499 CO 0.00 0.00 0.00 1.19 0.22 0.00 0.00 176.86 178.27 1u1u n PHE 500 N -0.13 0.00 0.00 2.98 3.72 -1.22 -2.93 117.46 119.88 1u1u n PHE 500 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1u1u n PHE 500 Cb 0.00 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.49 1u1u n PHE 500 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1u1u n GLY 501 N -1.51 -2.85 1.71 1.37 0.00 -1.15 -2.71 105.19 100.05 1u1u n GLY 501 Ca 0.04 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1u1u n GLY 501 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1u1u n GLU 502 N -2.27 0.15 -0.57 1.61 0.00 -1.15 -1.48 120.64 116.93 1u1u n GLU 502 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 57.16 57.16 1u1u n GLU 502 Cb 0.00 -1.43 -0.00 0.00 0.00 0.00 0.00 31.44 30.01 1u1u n GLU 502 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1u1u n GLN 503 N 1.69 0.00 -4.04 3.44 6.02 -1.10 -5.08 117.38 118.32 1u1u n GLN 503 Ca 0.00 -0.68 -0.12 0.00 -0.01 0.00 0.00 57.00 56.19 1u1u n GLN 503 Cb 0.07 -0.25 -0.11 0.00 1.02 0.00 0.00 30.24 30.97 1u1u n GLN 503 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1u1u s LEU 504 N 0.00 2.25 0.00 1.08 1.43 -0.55 -4.35 118.68 118.54 1u1u s LEU 504 Ca 0.02 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 1u1u s LEU 504 Cb 0.02 -0.08 0.00 0.00 0.03 0.00 0.00 46.19 46.16 1u1u s LEU 504 CO -0.01 -0.24 0.00 -1.20 0.23 0.00 0.00 176.35 175.13 1u1u n SER 505 N 1.48 0.00 -3.42 2.29 7.64 0.35 -3.55 113.62 118.41 1u1u n SER 505 Ca -0.23 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.42 1u1u n SER 505 Cb 0.55 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.69 1u1u n SER 505 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1u1u n GLY 506 N 0.00 0.74 2.37 0.23 0.00 -0.94 -4.57 105.19 103.02 1u1u n GLY 506 Ca 0.00 -0.47 -0.26 0.00 0.00 0.00 0.00 46.02 45.29 1u1u n GLY 506 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1u1u n PHE 507 N 6.62 -0.69 -2.47 1.61 7.35 -1.23 -0.57 117.46 128.08 1u1u n PHE 507 Ca 0.24 -3.38 -0.23 0.00 -0.76 0.00 0.00 57.45 53.31 1u1u n PHE 507 Cb 0.24 0.12 0.06 0.00 0.35 0.00 0.00 39.48 40.26 1u1u n PHE 507 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1u1u s ALA 508 N -0.23 3.59 0.07 3.13 0.00 -0.08 -4.56 121.76 123.68 1u1u s ALA 508 Ca 0.33 -1.26 0.03 0.00 0.00 0.00 0.00 51.96 51.06 1u1u s ALA 508 Cb 0.06 -2.25 -0.03 0.00 0.00 0.00 0.00 23.12 20.90 1u1u s ALA 508 CO -0.18 -1.07 -0.09 -0.06 0.00 0.00 0.00 175.76 174.36 1u1u s PHE 509 N -3.00 0.86 0.37 0.00 0.40 -1.26 -2.09 117.98 113.25 1u1u s PHE 509 Ca 0.60 -0.59 0.07 0.00 -0.60 0.00 0.00 56.93 56.41 1u1u s PHE 509 Cb -0.10 -0.50 -0.00 0.00 0.51 0.00 0.00 43.02 42.94 1u1u s PHE 509 CO 0.42 -0.06 0.50 0.99 0.70 0.00 0.00 175.22 177.77 1u1u s THR 510 N -1.93 3.65 -0.09 0.64 2.01 -1.26 -4.79 115.64 113.87 1u1u s THR 510 Ca -0.02 -1.01 -0.06 0.00 0.31 0.00 0.00 61.69 60.90 1u1u s THR 510 Cb -0.06 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.15 1u1u s THR 510 CO -0.00 -0.10 -0.15 0.00 -0.69 0.00 0.00 174.62 173.68 1u1u n ALA 511 N -1.71 2.22 0.30 7.40 0.00 -1.26 -4.87 120.51 122.59 1u1u n ALA 511 Ca 0.03 -0.43 0.03 0.00 0.00 0.00 0.00 53.44 53.07 1u1u n ALA 511 Cb 0.58 0.30 -0.01 0.00 0.00 0.00 0.00 19.45 20.33 1u1u n ALA 511 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1u1u n ASN 512 N -3.62 0.79 -4.56 0.00 3.02 -1.25 -4.94 115.26 104.70 1u1u n ASN 512 Ca -0.19 -0.90 -0.28 0.00 -0.03 0.00 0.00 54.58 53.19 1u1u n ASN 512 Cb 0.55 0.63 -0.05 0.00 -0.61 0.00 0.00 39.78 40.30 1u1u n ASN 512 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1u1u s GLY 513 N -1.23 0.15 0.27 7.41 0.00 -1.26 -4.88 107.32 107.78 1u1u s GLY 513 Ca 0.05 -1.37 0.08 0.00 0.00 0.00 0.00 44.72 43.47 1u1u s GLY 513 CO 0.20 3.50 0.18 -0.98 0.00 0.00 0.00 173.10 176.00 1u1u s TRP 514 N 10.09 3.00 0.08 1.90 0.52 -1.26 -4.68 118.94 128.59 1u1u s TRP 514 Ca 0.70 -0.17 0.02 0.00 0.02 0.00 0.00 56.10 56.67 1u1u s TRP 514 Cb -0.08 -1.44 -0.04 0.00 -1.15 0.00 0.00 33.47 30.76 1u1u s TRP 514 CO 0.02 0.47 -0.07 0.08 0.02 0.00 0.00 176.95 177.48 1u1u s VAL 515 N -2.20 0.62 0.32 4.03 1.01 -0.33 -4.37 120.40 119.47 1u1u s VAL 515 Ca 0.34 -1.68 -0.00 0.00 0.00 0.00 0.00 61.98 60.64 1u1u s VAL 515 Cb -0.07 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 1u1u s VAL 515 CO 0.24 -0.74 0.53 -1.58 0.00 0.00 0.00 175.10 173.55 1u1u s GLN 516 N -3.19 3.51 0.00 2.72 0.74 -1.26 0.15 119.66 122.33 1u1u s GLN 516 Ca 0.05 -0.29 0.00 0.00 0.05 0.00 0.00 55.36 55.17 1u1u s GLN 516 Cb 0.01 -2.68 0.00 0.00 1.10 0.00 0.00 33.01 31.44 1u1u s GLN 516 CO -0.04 0.19 0.87 0.43 -0.55 0.00 0.00 175.29 176.19 1u1u n SER 517 N -1.55 0.00 0.00 6.67 7.64 -0.56 -4.57 113.62 121.26 1u1u n SER 517 Ca -0.04 -1.75 0.00 0.00 1.01 0.00 0.00 58.87 58.08 1u1u n SER 517 Cb 0.56 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 1u1u n SER 517 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u1u n TYR 518 N 0.00 0.00 -1.42 1.43 0.18 -1.24 -3.93 117.16 112.19 1u1u n TYR 518 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1u1u n TYR 518 Cb 0.65 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.61 1u1u n TYR 518 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1u1u n GLY 519 N -0.84 1.05 0.12 -7.48 0.00 -1.26 -1.42 105.19 95.35 1u1u n GLY 519 Ca 0.00 -0.54 0.13 0.00 0.00 0.00 0.00 46.02 45.60 1u1u n GLY 519 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u1u n SER 520 N -3.27 0.76 -4.71 1.61 3.41 -1.26 -4.82 113.62 105.34 1u1u n SER 520 Ca 0.00 0.63 -0.42 0.00 -0.26 0.00 0.00 58.87 58.82 1u1u n SER 520 Cb 0.00 -0.81 -0.03 0.00 -0.26 0.00 0.00 64.21 63.11 1u1u n SER 520 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1u1u s ARG 521 N -3.22 4.16 0.11 4.33 6.06 -0.51 -4.81 118.95 125.07 1u1u s ARG 521 Ca 0.07 2.51 0.01 0.00 -2.50 0.00 0.00 55.73 55.83 1u1u s ARG 521 Cb 0.11 -3.24 -0.04 0.00 0.06 0.00 0.00 34.95 31.83 1u1u s ARG 521 CO 0.49 -0.73 -0.04 0.00 -2.50 0.00 0.00 175.30 172.52 1u1u s VAL 523 N -3.66 0.62 -0.58 0.00 -7.23 0.12 -4.89 120.40 104.78 1u1u s VAL 523 Ca 0.15 -1.43 0.06 0.00 -1.81 0.00 0.00 61.98 58.96 1u1u s VAL 523 Cb 0.06 -1.05 0.27 0.00 0.56 0.00 0.00 36.38 36.22 1u1u s VAL 523 CO -0.03 -0.57 0.74 1.17 -0.31 0.00 0.00 175.10 176.10 1u1u n LYS 524 N 0.86 2.28 -1.58 4.82 4.81 -1.26 -1.19 118.16 126.90 1u1u n LYS 524 Ca -0.19 -4.41 -0.52 0.00 -0.87 0.00 0.00 58.31 52.32 1u1u n LYS 524 Cb 0.57 -2.06 -0.06 0.00 0.02 0.00 0.00 35.03 33.50 1u1u n LYS 524 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1u1u n PRO 525 N 0.75 1.04 -0.68 1.64 -0.02 -1.26 -4.92 135.00 131.55 1u1u n PRO 525 Ca 0.28 0.37 -0.31 0.00 -2.02 0.00 0.00 63.50 61.82 1u1u n PRO 525 Cb 0.44 -1.96 0.17 0.00 -0.02 0.00 0.00 33.50 32.12 1u1u n PRO 525 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1u1u n PRO 526 N 2.24 -1.02 -4.88 0.52 -0.02 -1.26 -4.47 135.00 126.11 1u1u n PRO 526 Ca 0.18 -0.26 -0.33 0.00 -2.02 0.00 0.00 63.50 61.07 1u1u n PRO 526 Cb 0.20 -2.01 -0.15 0.00 -0.02 0.00 0.00 33.50 31.51 1u1u n PRO 526 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1u1u s VAL 527 N -2.43 2.81 -0.35 -1.45 1.01 -0.89 -1.98 120.40 117.12 1u1u s VAL 527 Ca 0.61 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.71 1u1u s VAL 527 Cb -0.20 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 1u1u s VAL 527 CO 0.64 0.53 0.25 -0.63 0.00 0.00 0.00 175.10 175.89 1u1u s ILE 528 N 0.35 5.25 0.00 2.22 1.09 -1.11 -0.90 121.20 128.11 1u1u s ILE 528 Ca -0.13 -0.31 0.00 0.00 -1.10 0.00 0.00 60.65 59.12 1u1u s ILE 528 Cb -0.16 -3.74 0.00 0.00 -1.06 0.00 0.00 42.46 37.50 1u1u s ILE 528 CO 0.06 -0.06 0.00 0.00 -0.10 0.00 0.00 174.94 174.84 1u1u n TYR 529 N 5.11 0.00 -3.11 3.97 0.18 0.26 -3.77 117.16 119.80 1u1u n TYR 529 Ca -0.12 0.00 -0.18 0.00 1.88 0.00 0.00 57.90 59.48 1u1u n TYR 529 Cb 0.49 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.45 1u1u n TYR 529 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1u1u s GLY 530 N -2.53 1.98 -0.91 -7.48 0.00 -1.26 -4.89 107.32 92.23 1u1u s GLY 530 Ca 0.00 -1.71 -0.19 0.00 0.00 0.00 0.00 44.72 42.82 1u1u s GLY 530 CO 0.00 -1.53 2.36 1.22 0.00 0.00 0.00 173.10 175.16 1u1u n ASP 531 N -1.79 -0.07 -4.22 1.64 9.92 -1.16 -2.21 116.55 118.66 1u1u n ASP 531 Ca 0.07 -0.54 -0.39 0.00 -0.53 0.00 0.00 54.79 53.41 1u1u n ASP 531 Cb 0.59 -0.94 0.01 0.00 -0.64 0.00 0.00 41.12 40.15 1u1u n ASP 531 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1u1u n VAL 532 N 6.85 0.00 -3.65 2.53 0.31 -1.26 -4.21 118.33 118.90 1u1u n VAL 532 Ca 0.61 -0.50 -0.01 0.00 -0.01 0.00 0.00 64.34 64.43 1u1u n VAL 532 Cb 0.21 -0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.07 1u1u n VAL 532 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1u1u s SER 533 N -1.00 -0.01 -0.95 4.52 0.15 -1.26 -4.74 113.70 110.41 1u1u s SER 533 Ca 0.55 0.01 -0.05 0.00 0.70 0.00 0.00 55.95 57.16 1u1u s SER 533 Cb -0.46 0.32 0.24 0.00 -1.71 0.00 0.00 66.02 64.41 1u1u s SER 533 CO 0.68 -0.00 0.88 0.00 1.20 0.00 0.00 173.24 176.00 1u1u s ARG 534 N 0.31 3.59 0.32 5.44 1.70 -1.26 0.13 118.95 129.18 1u1u s ARG 534 Ca 0.03 -3.15 0.06 0.00 -0.47 0.00 0.00 55.73 52.21 1u1u s ARG 534 Cb -0.04 -4.20 0.74 0.00 -0.57 0.00 0.00 34.95 30.88 1u1u s ARG 534 CO -0.14 -1.25 1.82 -1.35 -1.08 0.00 0.00 175.30 173.29 1u1u h PRO 535 N 6.45 0.76 -6.24 3.89 0.11 -1.98 -3.42 132.00 131.57 1u1u h PRO 535 Ca 0.15 -0.05 -0.56 0.00 0.11 0.00 0.00 66.00 65.65 1u1u h PRO 535 Cb 0.86 -0.17 -0.08 0.00 0.11 0.00 0.00 31.00 31.72 1u1u h PRO 535 CO 0.90 0.50 -0.59 0.15 -0.21 0.00 0.00 178.00 178.74 1u1u s LYS 536 N -5.81 2.67 1.27 1.05 1.02 -1.26 -5.23 119.74 113.45 1u1u s LYS 536 Ca -0.11 -1.08 -0.21 0.00 0.02 0.00 0.00 55.97 54.59 1u1u s LYS 536 Cb 0.23 -2.46 0.32 0.00 -0.52 0.00 0.00 37.83 35.41 1u1u s LYS 536 CO 0.80 0.43 0.94 0.00 -0.92 0.00 0.00 175.35 176.61 1u1u n ALA 537 N -0.60 -4.04 -0.53 5.17 0.00 -1.26 -5.03 120.51 114.23 1u1u n ALA 537 Ca -0.08 -1.51 0.00 0.00 0.00 0.00 0.00 53.44 51.85 1u1u n ALA 537 Cb 0.56 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1u1u n ALA 537 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1u1u n THR 539 N -5.17 0.00 0.00 0.00 -1.04 -1.26 -5.15 114.28 101.66 1u1u n THR 539 Ca 0.14 0.53 0.00 0.00 -2.04 0.00 0.00 64.05 62.68 1u1u n THR 539 Cb 0.56 -0.80 0.00 0.00 -1.82 0.00 0.00 70.33 68.28 1u1u n THR 539 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1u1u n VAL 540 N -0.78 0.00 0.05 12.58 0.31 -1.26 -1.85 118.33 127.38 1u1u n VAL 540 Ca 0.00 0.00 0.20 0.00 -0.01 0.00 0.00 64.34 64.53 1u1u n VAL 540 Cb 0.00 0.00 0.72 0.00 -0.91 0.00 0.00 33.84 33.65 1u1u n VAL 540 CO 0.00 0.00 0.00 2.19 -1.32 0.00 0.00 176.83 177.70 1u1u h PHE 541 N 0.00 0.00 0.00 3.52 -5.15 -1.97 0.32 116.94 113.66 1u1u h PHE 541 Ca 0.00 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.76 1u1u h PHE 541 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.17 1u1u h PHE 541 CO 0.00 0.00 -0.06 -1.49 -2.00 0.00 0.00 178.31 174.76 1u1u h TRP 542 N 0.00 0.00 0.02 6.09 -0.00 -1.86 -2.27 115.95 117.93 1u1u h TRP 542 Ca 0.22 0.00 -0.37 0.00 -0.00 0.00 0.00 58.89 58.74 1u1u h TRP 542 Cb 0.97 0.00 -0.06 0.00 -0.00 0.00 0.00 29.16 30.07 1u1u h TRP 542 CO 0.00 0.06 -2.28 0.43 -0.00 0.00 0.00 178.44 176.65 1u1u n SER 543 N -3.51 1.32 -2.76 -3.49 7.64 0.98 -4.34 113.62 109.46 1u1u n SER 543 Ca -0.02 0.02 -0.22 0.00 1.01 0.00 0.00 58.87 59.67 1u1u n SER 543 Cb 0.19 -0.06 -0.07 0.00 -1.01 0.00 0.00 64.21 63.26 1u1u n SER 543 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u1u n ALA 544 N -2.99 5.77 0.00 -0.43 0.00 -0.31 -2.03 120.51 120.52 1u1u n ALA 544 Ca -0.37 -2.21 0.00 0.00 0.00 0.00 0.00 53.44 50.87 1u1u n ALA 544 Cb 1.06 -2.82 0.00 0.00 0.00 0.00 0.00 19.45 17.69 1u1u n ALA 544 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u1u n ALA 546 N 3.35 0.00 -1.43 0.00 0.00 -1.26 -4.11 120.51 117.06 1u1u n ALA 546 Ca 0.50 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.55 1u1u n ALA 546 Cb 0.41 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.80 1u1u n ALA 546 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1u1u n GLN 547 N -0.21 1.50 -0.16 0.00 -0.06 -0.86 -2.91 117.38 114.68 1u1u n GLN 547 Ca 0.00 -2.03 -0.00 0.00 -2.00 0.00 0.00 57.00 52.97 1u1u n GLN 547 Cb 0.00 -3.17 -0.00 0.00 -4.06 0.00 0.00 30.24 23.01 1u1u n GLN 547 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 1u1u n SER 548 N 9.73 -0.00 0.00 1.69 3.41 -1.26 -4.97 113.62 122.22 1u1u n SER 548 Ca 0.48 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.77 1u1u n SER 548 Cb 0.42 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 1u1u n SER 548 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1u1u n THR 550 N 0.00 0.00 -0.28 6.66 5.66 -1.14 -5.19 114.28 119.99 1u1u n THR 550 Ca -0.00 0.00 0.10 0.00 -3.05 0.00 0.00 64.05 61.10 1u1u n THR 550 Cb 0.16 0.00 0.28 0.00 -1.55 0.00 0.00 70.33 69.22 1u1u n THR 550 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1u1u n SER 551 N 0.00 3.69 -4.60 1.09 3.41 -1.26 -4.96 113.62 110.98 1u1u n SER 551 Ca 0.00 -1.99 -0.28 0.00 -0.26 0.00 0.00 58.87 56.34 1u1u n SER 551 Cb 0.00 -0.41 -0.09 0.00 -0.26 0.00 0.00 64.21 63.45 1u1u n SER 551 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1u1u s ARG 552 N -1.03 2.19 0.59 4.33 0.52 -1.26 -5.17 118.95 119.12 1u1u s ARG 552 Ca 0.42 -1.14 -0.03 0.00 -0.52 0.00 0.00 55.73 54.46 1u1u s ARG 552 Cb 0.22 -2.27 0.05 0.00 0.52 0.00 0.00 34.95 33.48 1u1u s ARG 552 CO 0.29 0.46 0.12 -2.30 0.02 0.00 0.00 175.30 173.90 1u1u n PRO 553 N 0.19 0.97 -3.64 3.54 -0.02 -1.24 -4.70 135.00 130.11 1u1u n PRO 553 Ca -0.11 -0.21 -0.09 0.00 -2.02 0.00 0.00 63.50 61.08 1u1u n PRO 553 Cb 0.54 -1.04 -0.07 0.00 -0.02 0.00 0.00 33.50 32.91 1u1u n PRO 553 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1u1u s LYS 555 N -2.29 0.70 0.00 -0.52 -2.85 -1.15 0.12 119.74 113.74 1u1u s LYS 555 Ca 0.09 1.07 0.00 0.00 -1.00 0.00 0.00 55.97 56.14 1u1u s LYS 555 Cb -0.02 0.22 0.00 0.00 -2.06 0.00 0.00 37.83 35.97 1u1u s LYS 555 CO 0.08 -0.12 0.00 0.41 0.10 0.00 0.00 175.35 175.82 1u1u n GLY 556 N 3.68 -2.57 0.00 0.59 0.00 0.13 -4.55 105.19 102.47 1u1u n GLY 556 Ca -0.18 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1u1u n GLY 556 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u1u n LEU 558 N 0.00 0.00 -3.87 0.99 4.77 -0.85 -3.59 117.00 114.45 1u1u n LEU 558 Ca 0.00 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.68 1u1u n LEU 558 Cb 0.00 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 1u1u n LEU 558 CO 0.00 0.00 -0.21 -0.89 -1.33 0.00 0.00 177.39 174.96 1u1u s THR 559 N -2.00 2.18 0.01 -5.08 2.01 -1.26 -2.94 115.64 108.56 1u1u s THR 559 Ca 0.00 -3.03 -0.01 0.00 0.31 0.00 0.00 61.69 58.96 1u1u s THR 559 Cb 0.00 -2.52 -0.01 0.00 0.01 0.00 0.00 72.50 69.98 1u1u s THR 559 CO 0.00 -0.82 0.01 0.61 -0.69 0.00 0.00 174.62 173.72 1u1u n GLY 560 N 3.30 -0.10 0.25 4.40 0.00 -0.15 -4.55 105.19 108.34 1u1u n GLY 560 Ca 0.06 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.25 1u1u n GLY 560 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1u1u h PRO 561 N 0.02 0.00 0.00 1.61 0.13 -1.88 -2.60 132.00 129.28 1u1u h PRO 561 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1u1u h PRO 561 Cb 0.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.19 1u1u h PRO 561 CO 0.02 0.00 0.00 0.28 -0.23 0.00 0.00 178.00 178.07 1u1u n VAL 562 N -2.88 0.00 -0.26 1.56 0.31 -1.26 -2.53 118.33 113.27 1u1u n VAL 562 Ca 0.00 0.96 -0.08 0.00 -0.01 0.00 0.00 64.34 65.22 1u1u n VAL 562 Cb 0.25 -1.87 -0.07 0.00 -0.91 0.00 0.00 33.84 31.24 1u1u n VAL 562 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1u1u h THR 563 N 0.00 0.00 -0.29 2.52 2.02 -1.69 -0.93 112.91 114.53 1u1u h THR 563 Ca 0.00 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 1u1u h THR 563 Cb 0.00 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.38 1u1u h THR 563 CO 0.00 0.00 -0.17 -0.38 0.37 0.00 0.00 175.52 175.34 1u1u n ILE 564 N -4.57 -0.20 -0.08 3.11 5.41 -0.98 -1.41 119.36 120.64 1u1u n ILE 564 Ca 0.01 1.57 -0.11 0.00 1.00 0.00 0.00 62.75 65.22 1u1u n ILE 564 Cb 0.19 -2.03 -0.08 0.00 -0.71 0.00 0.00 39.64 37.02 1u1u n ILE 564 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 1u1u h LEU 565 N 0.00 -1.39 -0.26 1.39 5.85 -1.04 -2.88 115.31 116.98 1u1u h LEU 565 Ca 0.05 0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.97 1u1u h LEU 565 Cb 0.12 0.56 -0.04 0.00 0.37 0.00 0.00 40.66 41.67 1u1u h LEU 565 CO -0.27 -0.32 -0.21 0.78 -0.34 0.00 0.00 178.44 178.08 1u1u h ASN 566 N -0.34 -0.73 0.00 1.25 2.35 -0.27 -2.79 115.58 115.05 1u1u h ASN 566 Ca 0.05 0.10 -0.15 0.00 -0.55 0.00 0.00 56.30 55.75 1u1u h ASN 566 Cb 0.47 0.31 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1u1u h ASN 566 CO -0.42 -0.11 1.35 0.79 -1.65 0.00 0.00 177.43 177.38 1u1u n TRP 567 N -3.74 0.48 -3.58 1.19 8.01 -0.50 -4.73 117.44 114.57 1u1u n TRP 567 Ca -0.00 -0.99 -0.06 0.00 -1.31 0.00 0.00 57.50 55.14 1u1u n TRP 567 Cb 0.11 -1.02 -0.03 0.00 -2.01 0.00 0.00 31.31 28.37 1u1u n TRP 567 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.69 175.56 1u1u s SER 568 N 3.77 -0.20 -0.74 -0.99 0.01 -1.05 -4.12 113.70 110.37 1u1u s SER 568 Ca 0.19 0.05 -0.26 0.00 1.31 0.00 0.00 55.95 57.24 1u1u s SER 568 Cb 0.06 0.20 0.03 0.00 0.21 0.00 0.00 66.02 66.53 1u1u s SER 568 CO -0.01 -0.31 1.26 -0.36 0.41 0.00 0.00 173.24 174.23 1u1u s PHE 569 N -2.28 2.32 -0.10 2.43 0.08 -0.84 -4.99 117.98 114.59 1u1u s PHE 569 Ca 0.07 -0.12 -0.18 0.00 0.12 0.00 0.00 56.93 56.82 1u1u s PHE 569 Cb -0.01 -4.60 -0.04 0.00 -0.57 0.00 0.00 43.02 37.80 1u1u s PHE 569 CO -0.05 -2.04 0.49 0.08 -0.10 0.00 0.00 175.22 173.60 1u1u s VAL 570 N 5.57 5.16 0.93 -0.44 1.01 -1.26 -2.74 120.40 128.63 1u1u s VAL 570 Ca 0.34 0.98 -0.17 0.00 0.00 0.00 0.00 61.98 63.14 1u1u s VAL 570 Cb -0.09 -3.83 -0.14 0.00 0.00 0.00 0.00 36.38 32.32 1u1u s VAL 570 CO 0.14 0.34 -0.67 -2.11 0.00 0.00 0.00 175.10 172.79 1u1u n ARG 571 N 3.54 -0.01 -2.64 2.72 1.85 -1.25 -4.95 116.66 115.93 1u1u n ARG 571 Ca -0.07 -0.00 -0.28 0.00 -1.00 0.00 0.00 57.85 56.49 1u1u n ARG 571 Cb 0.52 -1.03 -0.01 0.00 -1.05 0.00 0.00 32.46 30.88 1u1u n ARG 571 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 1u1u n ASN 572 N 3.20 4.91 0.00 2.89 6.94 -1.26 -4.56 115.26 127.38 1u1u n ASN 572 Ca -0.00 -3.71 0.00 0.00 -0.02 0.00 0.00 54.58 50.84 1u1u n ASN 572 Cb 0.55 -0.57 0.00 0.00 -2.36 0.00 0.00 39.78 37.40 1u1u n ASN 572 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1u1u n ASP 573 N -0.37 0.00 -3.55 0.53 5.75 -1.26 -5.10 116.55 112.55 1u1u n ASP 573 Ca 0.37 -1.00 -0.07 0.00 -0.01 0.00 0.00 54.79 54.08 1u1u n ASP 573 Cb 0.51 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.58 1u1u n ASP 573 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u1u s GLN 574 N 0.00 0.58 0.85 0.11 -2.07 -1.26 -5.18 119.66 112.69 1u1u s GLN 574 Ca 0.00 -0.20 -0.15 0.00 -1.82 0.00 0.00 55.36 53.19 1u1u s GLN 574 Cb 0.00 0.27 -0.06 0.00 -1.09 0.00 0.00 33.01 32.13 1u1u s GLN 574 CO 0.00 -0.25 0.05 -2.30 -1.32 0.00 0.00 175.29 171.47 1u1u n PRO 575 N -0.13 -0.01 -0.09 9.60 -0.02 -1.26 -4.91 135.00 138.18 1u1u n PRO 575 Ca -0.05 0.03 -0.13 0.00 -2.02 0.00 0.00 63.50 61.33 1u1u n PRO 575 Cb 0.60 -1.53 -0.05 0.00 -0.02 0.00 0.00 33.50 32.51 1u1u n PRO 575 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1u1u h ARG 576 N -0.91 0.66 0.07 -0.52 3.08 -1.99 -3.20 114.38 111.57 1u1u h ARG 576 Ca -0.44 -0.35 -0.00 0.00 0.07 0.00 0.00 59.98 59.26 1u1u h ARG 576 Cb 1.32 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.38 1u1u h ARG 576 CO 0.34 0.95 -0.03 1.12 -1.07 0.00 0.00 179.97 181.28 1u1u h HIS 577 N 0.39 -0.08 -0.48 3.04 2.07 -1.97 0.12 115.15 118.24 1u1u h HIS 577 Ca 0.04 -0.00 0.09 0.00 -2.85 0.00 0.00 60.37 57.65 1u1u h HIS 577 Cb 0.83 0.03 -0.10 0.00 2.57 0.00 0.00 27.41 30.73 1u1u h HIS 577 CO 0.07 0.05 -0.31 1.49 -3.07 0.00 0.00 177.93 176.17 1u1u h GLU 578 N -0.20 -0.19 -0.32 5.12 4.81 -1.94 1.17 114.58 123.02 1u1u h GLU 578 Ca -0.01 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1u1u h GLU 578 Cb 0.17 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1u1u h GLU 578 CO 0.01 -0.13 0.13 1.15 -0.73 0.00 0.00 179.01 179.45 1u1u h THR 579 N -0.20 1.18 -0.33 0.32 2.02 -1.54 -2.86 112.91 111.50 1u1u h THR 579 Ca 0.20 -0.54 0.06 0.00 0.77 0.00 0.00 66.41 66.91 1u1u h THR 579 Cb 0.53 0.94 -0.08 0.00 -1.74 0.00 0.00 68.15 67.80 1u1u h THR 579 CO -0.59 0.19 -0.40 0.00 0.37 0.00 0.00 175.52 175.09 1u1u h TYR 581 N -0.35 0.16 -0.62 0.00 0.05 0.13 -1.78 116.97 114.57 1u1u h TYR 581 Ca 0.13 0.02 0.12 0.00 0.05 0.00 0.00 58.73 59.05 1u1u h TYR 581 Cb 0.58 -0.03 -0.12 0.00 1.01 0.00 0.00 36.73 38.18 1u1u h TYR 581 CO -0.56 0.06 -0.15 1.96 -1.05 0.00 0.00 178.16 178.42 1u1u h GLN 582 N 0.22 0.00 0.00 4.88 4.20 -1.24 2.04 115.11 125.21 1u1u h GLN 582 Ca 0.14 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1u1u h GLN 582 Cb 0.12 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1u1u h GLN 582 CO -0.16 0.00 0.00 -0.89 -0.67 0.00 0.00 178.83 177.12 1u1u n ILE 583 N -5.42 0.96 -0.07 2.54 5.41 -0.70 -0.38 119.36 121.70 1u1u n ILE 583 Ca 0.07 0.24 -0.05 0.00 1.00 0.00 0.00 62.75 64.01 1u1u n ILE 583 Cb 0.32 -1.21 -0.15 0.00 -0.71 0.00 0.00 39.64 37.89 1u1u n ILE 583 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1u1u n ALA 584 N -1.26 1.80 -0.01 -1.39 0.00 0.68 -4.25 120.51 116.08 1u1u n ALA 584 Ca 0.01 -1.05 -0.12 0.00 0.00 0.00 0.00 53.44 52.27 1u1u n ALA 584 Cb 0.01 -0.25 -0.08 0.00 0.00 0.00 0.00 19.45 19.13 1u1u n ALA 584 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1u1u h LEU 585 N 0.00 0.07 -1.11 0.00 -0.00 0.79 -2.74 115.31 112.32 1u1u h LEU 585 Ca -0.39 -0.30 0.14 0.00 -0.00 0.00 0.00 57.88 57.33 1u1u h LEU 585 Cb 1.87 -0.02 -0.08 0.00 -0.00 0.00 0.00 40.66 42.43 1u1u h LEU 585 CO 0.02 0.35 0.61 0.00 -0.00 0.00 0.00 178.44 179.43 1u1u h ALA 586 N 0.72 1.66 0.16 1.53 0.00 -1.73 -2.16 119.26 119.44 1u1u h ALA 586 Ca 0.01 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1u1u h ALA 586 Cb 0.31 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1u1u h ALA 586 CO 0.00 0.08 -0.29 0.82 0.00 0.00 0.00 179.25 179.86 1u1u h ILE 587 N 0.85 0.38 -1.03 0.00 1.08 -1.67 0.31 117.51 117.44 1u1u h ILE 587 Ca 0.49 0.00 0.30 0.00 -0.39 0.00 0.00 64.86 65.26 1u1u h ILE 587 Cb 0.63 0.38 -0.04 0.00 -3.07 0.00 0.00 36.82 34.72 1u1u h ILE 587 CO -0.26 0.00 0.80 0.50 -0.69 0.00 0.00 178.15 178.51 1u1u h LYS 588 N -0.53 0.00 -0.32 2.37 3.64 -1.23 0.87 116.57 121.37 1u1u h LYS 588 Ca 0.02 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1u1u h LYS 588 Cb 0.54 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1u1u h LYS 588 CO -0.14 0.00 0.05 -0.44 -2.27 0.00 0.00 179.45 176.65 1u1u h ASP 589 N 0.00 0.52 -0.03 4.20 3.32 -0.78 -2.02 116.42 121.63 1u1u h ASP 589 Ca 0.49 -0.26 -0.04 0.00 0.02 0.00 0.00 57.03 57.24 1u1u h ASP 589 Cb 2.09 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 41.51 1u1u h ASP 589 CO -0.01 0.65 -0.14 -0.33 -1.72 0.00 0.00 179.24 177.69 1u1u h GLU 590 N 0.36 0.14 -0.46 3.56 4.39 0.96 -2.93 114.58 120.61 1u1u h GLU 590 Ca 0.10 -0.12 0.08 0.00 0.34 0.00 0.00 59.36 59.76 1u1u h GLU 590 Cb 0.35 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.96 1u1u h GLU 590 CO 0.01 0.77 0.08 0.28 -1.16 0.00 0.00 179.01 178.99 1u1u h VAL 591 N -0.45 0.74 0.00 3.13 2.07 -1.14 0.74 116.25 121.33 1u1u h VAL 591 Ca -0.01 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1u1u h VAL 591 Cb 0.80 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1u1u h VAL 591 CO 0.03 0.04 0.00 -0.62 0.02 0.00 0.00 177.57 177.04 1u1u n GLU 592 N -5.12 0.03 -0.05 1.57 1.02 -0.76 -1.47 120.64 115.87 1u1u n GLU 592 Ca 0.04 0.33 -0.14 0.00 -0.02 0.00 0.00 57.16 57.38 1u1u n GLU 592 Cb 0.22 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.00 1u1u n GLU 592 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1u1u n ASP 593 N -1.42 1.15 0.07 1.62 8.00 0.25 -2.59 116.55 123.63 1u1u n ASP 593 Ca 0.02 0.17 0.13 0.00 0.71 0.00 0.00 54.79 55.82 1u1u n ASP 593 Cb 0.06 -0.06 0.48 0.00 -0.02 0.00 0.00 41.12 41.58 1u1u n ASP 593 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1u1u n LEU 594 N -3.12 0.48 0.09 0.64 4.32 -0.61 0.24 117.00 119.04 1u1u n LEU 594 Ca -0.29 0.56 -0.05 0.00 -0.02 0.00 0.00 56.01 56.21 1u1u n LEU 594 Cb 1.07 -0.42 -0.02 0.00 -1.62 0.00 0.00 43.42 42.42 1u1u n LEU 594 CO 0.41 -0.18 0.15 -0.08 -1.22 0.00 0.00 177.39 176.47 1u1u h GLU 595 N 0.00 -0.29 -0.04 3.23 4.57 -1.34 -1.91 114.58 118.79 1u1u h GLU 595 Ca 0.00 0.02 -0.15 0.00 -1.18 0.00 0.00 59.36 58.05 1u1u h GLU 595 Cb 0.58 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 1u1u h GLU 595 CO 0.00 -0.19 -0.65 0.87 -1.18 0.00 0.00 179.01 177.86 1u1u h LYS 596 N -0.88 0.16 0.00 1.92 1.57 -1.46 -2.26 116.57 115.62 1u1u h LYS 596 Ca -0.03 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1u1u h LYS 596 Cb 0.23 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1u1u h LYS 596 CO 0.05 0.75 0.00 0.41 -0.57 0.00 0.00 179.45 180.09 1u1u n GLY 597 N 0.35 -0.60 0.00 3.86 0.00 0.64 -4.89 105.19 104.56 1u1u n GLY 597 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1u1u n GLY 597 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u1u n GLY 598 N -0.74 2.29 0.00 -0.02 0.00 -0.85 -4.94 105.19 100.93 1u1u n GLY 598 Ca 0.03 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1u1u n GLY 598 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1u1u n ILE 599 N 0.00 0.00 0.10 -0.61 -0.00 -0.75 -4.61 119.36 113.49 1u1u n ILE 599 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 62.75 62.58 1u1u n ILE 599 Cb 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 39.64 39.52 1u1u n ILE 599 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 1u1u h GLY 600 N 0.00 0.43 -5.87 7.39 0.00 -1.91 -3.37 103.07 99.74 1u1u h GLY 600 Ca 0.00 -0.99 -0.63 0.00 0.00 0.00 0.00 47.33 45.70 1u1u h GLY 600 CO 0.00 0.87 -0.59 0.14 0.00 0.00 0.00 176.54 176.96 1u1u s VAL 601 N -2.83 4.57 -0.26 4.60 1.01 -1.26 -2.36 120.40 123.88 1u1u s VAL 601 Ca -0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 1u1u s VAL 601 Cb 0.07 -3.02 0.08 0.00 0.00 0.00 0.00 36.38 33.51 1u1u s VAL 601 CO 0.90 0.50 0.07 -0.63 0.00 0.00 0.00 175.10 175.94 1u1u s ILE 602 N 0.04 0.65 0.23 2.22 1.01 -1.16 0.20 121.20 124.39 1u1u s ILE 602 Ca 0.04 -0.99 -0.29 0.00 0.00 0.00 0.00 60.65 59.41 1u1u s ILE 602 Cb -0.12 -1.34 -0.09 0.00 0.01 0.00 0.00 42.46 40.91 1u1u s ILE 602 CO 0.01 -0.48 0.92 -1.58 0.00 0.00 0.00 174.94 173.81 1u1u s GLN 603 N 1.76 4.82 -0.01 2.79 0.74 -1.24 -2.90 119.66 125.62 1u1u s GLN 603 Ca 0.05 1.45 0.04 0.00 0.05 0.00 0.00 55.36 56.95 1u1u s GLN 603 Cb -0.17 -3.28 -0.01 0.00 1.10 0.00 0.00 33.01 30.65 1u1u s GLN 603 CO -0.19 0.52 -0.13 0.42 -0.55 0.00 0.00 175.29 175.36 1u1u s ILE 604 N -1.13 0.99 0.07 -2.34 1.01 0.41 -2.00 121.20 118.22 1u1u s ILE 604 Ca 0.41 -0.57 0.08 0.00 0.00 0.00 0.00 60.65 60.57 1u1u s ILE 604 Cb -0.26 -0.84 -0.03 0.00 0.01 0.00 0.00 42.46 41.34 1u1u s ILE 604 CO 0.31 0.25 -0.21 1.51 0.00 0.00 0.00 174.94 176.81 1u1u s ASP 605 N -0.36 3.63 -0.36 3.58 1.47 -1.15 -0.66 116.67 122.81 1u1u s ASP 605 Ca 0.04 -0.53 0.13 0.00 1.18 0.00 0.00 52.55 53.38 1u1u s ASP 605 Cb -0.05 -0.48 0.40 0.00 -0.34 0.00 0.00 42.92 42.45 1u1u s ASP 605 CO -0.00 0.23 1.00 -0.62 0.68 0.00 0.00 175.17 176.45 1u1u n GLU 606 N 1.35 1.10 -0.25 2.11 -0.58 0.49 -0.98 120.64 123.87 1u1u n GLU 606 Ca -0.16 -2.84 -0.04 0.00 -0.42 0.00 0.00 57.16 53.69 1u1u n GLU 606 Cb 0.52 -1.09 0.07 0.00 -0.57 0.00 0.00 31.44 30.37 1u1u n GLU 606 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1u1u h ALA 607 N 2.80 0.90 -0.04 0.62 0.00 -1.79 -2.75 119.26 119.00 1u1u h ALA 607 Ca -0.09 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1u1u h ALA 607 Cb 1.14 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 1u1u h ALA 607 CO 0.34 0.24 -0.15 0.00 0.00 0.00 0.00 179.25 179.69 1u1u n ALA 608 N -2.30 5.20 -0.06 0.00 0.00 -1.26 -4.05 120.51 118.04 1u1u n ALA 608 Ca 0.07 -0.99 -0.06 0.00 0.00 0.00 0.00 53.44 52.45 1u1u n ALA 608 Cb 0.06 -1.65 -0.06 0.00 0.00 0.00 0.00 19.45 17.80 1u1u n ALA 608 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1u1u h LEU 609 N 3.92 0.00 -0.50 0.00 5.85 -1.86 -3.36 115.31 119.35 1u1u h LEU 609 Ca 0.11 -0.45 -0.12 0.00 0.84 0.00 0.00 57.88 58.26 1u1u h LEU 609 Cb 1.22 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 1u1u h LEU 609 CO 0.16 0.73 -0.14 -0.09 -0.34 0.00 0.00 178.44 178.76 1u1u h ARG 610 N -1.00 0.99 0.00 1.25 2.43 -1.87 -3.34 114.38 112.85 1u1u h ARG 610 Ca -0.00 -0.39 0.00 0.00 -0.81 0.00 0.00 59.98 58.78 1u1u h ARG 610 Cb 0.46 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1u1u h ARG 610 CO -0.00 1.07 0.00 0.39 -1.51 0.00 0.00 179.97 179.91 1u1u n GLU 611 N -4.16 0.00 -0.01 0.20 4.71 -1.26 -0.57 120.64 119.55 1u1u n GLU 611 Ca 0.01 0.00 0.05 0.00 -0.01 0.00 0.00 57.16 57.21 1u1u n GLU 611 Cb 0.42 -1.46 0.05 0.00 -1.01 0.00 0.00 31.44 29.44 1u1u n GLU 611 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1u1u n GLY 612 N -0.57 -0.18 3.56 0.62 0.00 -1.25 -4.98 105.19 102.39 1u1u n GLY 612 Ca 0.00 -0.31 -0.47 0.00 0.00 0.00 0.00 46.02 45.24 1u1u n GLY 612 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u1u n LEU 613 N 0.58 2.88 -4.59 0.99 4.77 0.27 -4.89 117.00 117.01 1u1u n LEU 613 Ca 0.06 0.49 -0.42 0.00 -0.03 0.00 0.00 56.01 56.11 1u1u n LEU 613 Cb 0.27 -1.39 -0.03 0.00 -2.33 0.00 0.00 43.42 39.94 1u1u n LEU 613 CO 0.07 -0.53 1.57 -2.84 -1.33 0.00 0.00 177.39 174.32 1u1u s PRO 614 N 5.71 3.22 0.07 3.23 0.02 -1.26 -4.87 135.00 141.11 1u1u s PRO 614 Ca 1.02 1.37 0.02 0.00 0.02 0.00 0.00 61.00 63.43 1u1u s PRO 614 Cb -0.63 -4.23 0.20 0.00 0.02 0.00 0.00 34.50 29.86 1u1u s PRO 614 CO 0.45 -2.00 0.32 1.28 -0.33 0.00 0.00 177.00 176.73 1u1u n LEU 615 N 10.75 0.01 -4.56 -5.54 4.77 -1.26 -3.63 117.00 117.54 1u1u n LEU 615 Ca 0.23 0.35 -0.40 0.00 -0.03 0.00 0.00 56.01 56.16 1u1u n LEU 615 Cb 0.47 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 1u1u n LEU 615 CO 0.69 -0.37 1.44 -0.60 -1.33 0.00 0.00 177.39 177.22 1u1u s ARG 616 N -4.70 2.94 0.20 3.23 6.06 -1.26 -4.81 118.95 120.61 1u1u s ARG 616 Ca -0.02 0.49 -0.21 0.00 -2.50 0.00 0.00 55.73 53.49 1u1u s ARG 616 Cb 0.06 -4.28 0.15 0.00 0.06 0.00 0.00 34.95 30.95 1u1u s ARG 616 CO 0.16 -2.38 1.57 0.87 -2.50 0.00 0.00 175.30 173.02 1u1u h LYS 617 N 13.02 -0.09 0.00 5.12 1.57 -1.99 0.47 116.57 134.68 1u1u h LYS 617 Ca -0.27 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1u1u h LYS 617 Cb 1.13 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1u1u h LYS 617 CO 1.20 -0.06 0.19 -1.13 -0.57 0.00 0.00 179.45 179.08 1u1u n SER 618 N -5.44 0.15 -0.05 0.86 3.41 -1.26 0.16 113.62 111.46 1u1u n SER 618 Ca 0.06 0.44 0.12 0.00 -0.26 0.00 0.00 58.87 59.23 1u1u n SER 618 Cb 0.37 -0.43 0.17 0.00 -0.26 0.00 0.00 64.21 64.06 1u1u n SER 618 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1u1u n GLU 619 N -1.64 0.14 0.00 4.33 1.02 0.17 -4.59 120.64 120.07 1u1u n GLU 619 Ca -0.00 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 1u1u n GLU 619 Cb 0.20 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 1u1u n GLU 619 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1u1u n HIS 620 N -1.35 0.00 -0.01 -0.32 8.25 0.42 -3.55 115.22 118.66 1u1u n HIS 620 Ca 0.06 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.53 1u1u n HIS 620 Cb 0.34 -0.09 0.02 0.00 1.12 0.00 0.00 29.99 31.38 1u1u n HIS 620 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1u1u n ALA 621 N -0.82 0.03 0.03 -1.41 0.00 -1.26 0.30 120.51 117.38 1u1u n ALA 621 Ca 0.00 0.02 -0.20 0.00 0.00 0.00 0.00 53.44 53.26 1u1u n ALA 621 Cb 0.00 -0.02 -0.10 0.00 0.00 0.00 0.00 19.45 19.32 1u1u n ALA 621 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1u1u h PHE 622 N 0.00 0.97 0.43 0.00 -0.00 -1.87 -3.05 116.94 113.42 1u1u h PHE 622 Ca 0.02 -0.52 -0.01 0.00 -0.00 0.00 0.00 57.97 57.46 1u1u h PHE 622 Cb 0.07 -0.11 -0.03 0.00 -0.00 0.00 0.00 35.95 35.88 1u1u h PHE 622 CO -0.00 1.36 -0.46 -0.92 -0.00 0.00 0.00 178.31 178.28 1u1u h TYR 623 N 0.31 -1.27 0.00 0.41 3.20 0.44 0.11 116.97 120.16 1u1u h TYR 623 Ca -0.12 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.76 1u1u h TYR 623 Cb 1.61 0.50 0.00 0.00 1.54 0.00 0.00 36.73 40.38 1u1u h TYR 623 CO 0.11 -0.62 0.19 1.28 -1.64 0.00 0.00 178.16 177.48 1u1u n LEU 624 N -5.53 0.22 0.00 2.82 4.77 -1.21 -0.83 117.00 117.24 1u1u n LEU 624 Ca -0.11 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1u1u n LEU 624 Cb 0.43 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 1u1u n LEU 624 CO 0.26 -0.57 0.00 -0.67 -1.33 0.00 0.00 177.39 175.08 1u1u n ASP 625 N -1.77 0.00 0.09 -1.43 2.03 0.39 -2.47 116.55 113.39 1u1u n ASP 625 Ca -0.01 0.00 0.20 0.00 0.52 0.00 0.00 54.79 55.51 1u1u n ASP 625 Cb 0.20 0.00 0.74 0.00 -0.72 0.00 0.00 41.12 41.34 1u1u n ASP 625 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 1u1u h TRP 626 N 0.00 0.00 0.93 -0.67 5.08 -1.47 -0.43 115.95 119.38 1u1u h TRP 626 Ca 0.00 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 59.92 1u1u h TRP 626 Cb 0.00 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.17 1u1u h TRP 626 CO 0.00 0.00 -0.44 0.00 -1.28 0.00 0.00 178.44 176.72 1u1u h ALA 627 N 1.50 -1.24 0.05 0.11 0.00 -1.13 -2.51 119.26 116.03 1u1u h ALA 627 Ca 0.19 -0.27 -0.21 0.00 0.00 0.00 0.00 54.91 54.62 1u1u h ALA 627 Cb 1.08 0.48 0.02 0.00 0.00 0.00 0.00 17.79 19.37 1u1u h ALA 627 CO -0.00 -1.19 -0.85 0.28 0.00 0.00 0.00 179.25 177.49 1u1u h VAL 628 N -1.26 1.39 -0.74 0.00 2.07 -0.93 -3.13 116.25 113.65 1u1u h VAL 628 Ca -0.13 -2.26 0.17 0.00 0.82 0.00 0.00 66.70 65.30 1u1u h VAL 628 Cb 0.95 2.69 -0.13 0.00 -1.52 0.00 0.00 31.29 33.28 1u1u h VAL 628 CO 0.21 0.67 0.04 -0.74 0.02 0.00 0.00 177.57 177.77 1u1u h HIS 629 N 0.01 0.01 -0.99 1.57 6.17 -1.24 0.21 115.15 120.89 1u1u h HIS 629 Ca -0.12 0.05 0.13 0.00 0.71 0.00 0.00 60.37 61.14 1u1u h HIS 629 Cb 1.56 0.11 -0.09 0.00 2.52 0.00 0.00 27.41 31.51 1u1u h HIS 629 CO 0.14 -0.21 0.61 1.03 0.71 0.00 0.00 177.93 180.21 1u1u h SER 630 N 0.13 0.88 -0.54 3.26 0.87 -1.45 0.19 113.55 116.89 1u1u h SER 630 Ca 0.41 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 61.02 1u1u h SER 630 Cb 0.72 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.54 1u1u h SER 630 CO -0.63 0.45 0.32 0.15 -0.53 0.00 0.00 176.83 176.59 1u1u h PHE 631 N 0.94 0.73 -0.11 2.24 3.57 -0.53 -1.67 116.94 122.11 1u1u h PHE 631 Ca 0.50 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.92 1u1u h PHE 631 Cb 0.54 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.04 1u1u h PHE 631 CO -0.01 0.50 -0.25 0.00 -2.23 0.00 0.00 178.31 176.32 1u1u h ARG 632 N 0.77 0.36 -0.89 1.11 3.08 -0.64 -3.05 114.38 115.13 1u1u h ARG 632 Ca 0.20 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1u1u h ARG 632 Cb -0.01 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1u1u h ARG 632 CO -0.04 0.85 0.00 -0.89 -1.07 0.00 0.00 179.97 178.82 1u1u n ILE 633 N -4.47 0.00 -0.02 2.04 5.41 -0.12 -0.65 119.36 121.56 1u1u n ILE 633 Ca -0.07 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.65 1u1u n ILE 633 Cb 0.45 -0.21 -0.02 0.00 -0.71 0.00 0.00 39.64 39.15 1u1u n ILE 633 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1u1u n THR 634 N 0.68 0.23 -2.32 1.39 -1.04 -1.15 -4.37 114.28 107.71 1u1u n THR 634 Ca 0.00 -0.10 -0.08 0.00 -2.04 0.00 0.00 64.05 61.83 1u1u n THR 634 Cb 0.00 -0.71 0.05 0.00 -1.82 0.00 0.00 70.33 67.85 1u1u n THR 634 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1u1u n ASN 635 N -2.50 2.87 -0.86 8.00 0.23 0.18 -3.68 115.26 119.50 1u1u n ASN 635 Ca -0.07 -2.95 0.03 0.00 -0.53 0.00 0.00 54.58 51.06 1u1u n ASN 635 Cb 0.58 -0.41 0.13 0.00 -2.08 0.00 0.00 39.78 38.00 1u1u n ASN 635 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1u1u n GLY 637 N 0.34 1.88 3.05 0.00 0.00 -1.26 -4.45 105.19 104.74 1u1u n GLY 637 Ca 0.09 -1.11 -0.24 0.00 0.00 0.00 0.00 46.02 44.75 1u1u n GLY 637 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u1u s VAL 638 N -2.24 1.17 0.36 1.61 0.11 -1.23 -4.87 120.40 115.31 1u1u s VAL 638 Ca 0.29 -0.52 -0.26 0.00 -2.93 0.00 0.00 61.98 58.56 1u1u s VAL 638 Cb 0.42 -1.05 -0.12 0.00 -1.53 0.00 0.00 36.38 34.10 1u1u s VAL 638 CO -0.01 0.36 0.93 0.00 -3.33 0.00 0.00 175.10 173.04 1u1u n GLN 639 N 3.60 1.21 0.00 1.54 1.13 -1.26 -4.78 117.38 118.82 1u1u n GLN 639 Ca -0.21 0.43 0.00 0.00 -1.94 0.00 0.00 57.00 55.28 1u1u n GLN 639 Cb 0.52 -1.86 0.00 0.00 0.11 0.00 0.00 30.24 29.02 1u1u n GLN 639 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1u1u n ASP 640 N 0.96 0.09 -0.01 1.08 9.92 -1.26 -0.94 116.55 126.39 1u1u n ASP 640 Ca 0.10 -0.60 0.01 0.00 -0.53 0.00 0.00 54.79 53.77 1u1u n ASP 640 Cb 0.36 -0.04 -0.05 0.00 -0.64 0.00 0.00 41.12 40.74 1u1u n ASP 640 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1u1u n SER 641 N -0.25 3.35 -4.75 -2.24 3.41 -1.26 -3.43 113.62 108.45 1u1u n SER 641 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.21 1u1u n SER 641 Cb 0.02 1.07 -0.04 0.00 -0.26 0.00 0.00 64.21 65.00 1u1u n SER 641 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1u1u s THR 642 N -2.37 3.62 -0.29 6.66 2.01 -0.11 -4.37 115.64 120.79 1u1u s THR 642 Ca -0.03 1.57 0.03 0.00 0.31 0.00 0.00 61.69 63.57 1u1u s THR 642 Cb 0.04 -4.00 0.08 0.00 0.01 0.00 0.00 72.50 68.62 1u1u s THR 642 CO 0.29 0.35 -0.04 -1.58 -0.69 0.00 0.00 174.62 172.95 1u1u s GLN 643 N -1.13 1.96 -0.04 4.92 0.74 -0.99 -4.91 119.66 120.21 1u1u s GLN 643 Ca 0.46 -1.55 -0.18 0.00 0.05 0.00 0.00 55.36 54.13 1u1u s GLN 643 Cb -0.31 -3.03 -0.05 0.00 1.10 0.00 0.00 33.01 30.72 1u1u s GLN 643 CO 0.39 -0.72 0.51 0.42 -0.55 0.00 0.00 175.29 175.34 1u1u s ILE 644 N 1.03 5.03 0.14 -2.34 1.09 -1.26 -2.96 121.20 121.92 1u1u s ILE 644 Ca -0.01 1.04 0.08 0.00 -1.10 0.00 0.00 60.65 60.66 1u1u s ILE 644 Cb -0.20 -3.84 -0.04 0.00 -1.06 0.00 0.00 42.46 37.33 1u1u s ILE 644 CO -0.06 0.43 -0.12 -1.00 -0.10 0.00 0.00 174.94 174.09 1u1u s HIS 645 N -0.16 2.64 0.23 3.97 3.76 -1.14 -2.31 115.29 122.27 1u1u s HIS 645 Ca 0.27 -0.21 0.05 0.00 -0.15 0.00 0.00 55.06 55.02 1u1u s HIS 645 Cb -0.17 -1.35 -0.05 0.00 1.11 0.00 0.00 32.58 32.12 1u1u s HIS 645 CO 0.14 0.45 -0.04 -0.08 -0.85 0.00 0.00 174.74 174.36 1u1u s THR 646 N -1.38 1.23 0.37 1.30 -1.32 -0.13 0.16 115.64 115.86 1u1u s THR 646 Ca 0.22 -2.07 0.04 0.00 -1.21 0.00 0.00 61.69 58.67 1u1u s THR 646 Cb -0.10 -2.28 -0.04 0.00 -1.51 0.00 0.00 72.50 68.57 1u1u s THR 646 CO 0.13 -0.40 0.09 -2.28 -2.21 0.00 0.00 174.62 169.95 1u1u s HIS 647 N -3.29 1.88 -0.37 9.09 5.04 0.16 0.02 115.29 127.81 1u1u s HIS 647 Ca 0.27 -1.10 0.12 0.00 -1.54 0.00 0.00 55.06 52.81 1u1u s HIS 647 Cb 0.04 -1.25 0.37 0.00 0.04 0.00 0.00 32.58 31.78 1u1u s HIS 647 CO 0.08 -0.11 0.85 0.00 -2.34 0.00 0.00 174.74 173.22 1u1u s TYR 650 N -2.11 1.09 -0.17 0.00 2.02 -1.26 -4.70 117.35 112.21 1u1u s TYR 650 Ca 0.34 -0.27 -0.11 0.00 -0.37 0.00 0.00 57.07 56.66 1u1u s TYR 650 Cb 0.37 -0.67 -0.22 0.00 -0.40 0.00 0.00 41.96 41.03 1u1u s TYR 650 CO -0.05 0.00 0.22 -1.13 -1.57 0.00 0.00 175.55 173.01 1u1u n SER 651 N 2.37 2.02 -3.22 2.29 3.41 -1.26 -2.35 113.62 116.87 1u1u n SER 651 Ca -0.16 0.26 -0.26 0.00 -0.26 0.00 0.00 58.87 58.45 1u1u n SER 651 Cb 0.55 -0.86 -0.06 0.00 -0.26 0.00 0.00 64.21 63.58 1u1u n SER 651 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1u1u n HIS 652 N -3.83 2.75 0.68 7.33 8.25 -1.26 -4.80 115.22 124.34 1u1u n HIS 652 Ca -0.35 -3.98 -0.02 0.00 -0.26 0.00 0.00 57.72 53.11 1u1u n HIS 652 Cb 0.91 -0.49 0.04 0.00 1.12 0.00 0.00 29.99 31.57 1u1u n HIS 652 CO 0.00 0.00 0.00 1.97 0.64 0.00 0.00 176.34 178.95 1u1u n PHE 653 N 0.57 0.42 -0.36 4.41 1.16 -1.26 -4.50 117.46 117.90 1u1u n PHE 653 Ca 0.28 -0.54 0.26 0.00 -1.87 0.00 0.00 57.45 55.58 1u1u n PHE 653 Cb 0.45 -0.30 0.52 0.00 -1.61 0.00 0.00 39.48 38.53 1u1u n PHE 653 CO 0.00 0.00 0.00 -0.91 -1.87 0.00 0.00 176.76 173.98 1u1u h ASN 654 N 0.27 0.45 -0.24 5.98 4.21 -1.98 0.25 115.58 124.52 1u1u h ASN 654 Ca 0.07 0.15 0.00 0.00 1.21 0.00 0.00 56.30 57.73 1u1u h ASN 654 Cb 1.13 0.09 0.00 0.00 -1.12 0.00 0.00 38.32 38.42 1u1u h ASN 654 CO 0.14 -0.07 0.00 -0.90 -1.29 0.00 0.00 177.43 175.32 1u1u n ASP 655 N -4.84 2.45 -2.71 5.81 5.75 -1.26 -3.75 116.55 118.00 1u1u n ASP 655 Ca 0.31 -2.25 -0.06 0.00 -0.01 0.00 0.00 54.79 52.78 1u1u n ASP 655 Cb 1.04 -0.46 0.08 0.00 -1.03 0.00 0.00 41.12 40.75 1u1u n ASP 655 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u1u n ILE 656 N 0.27 0.55 0.09 2.12 3.06 0.88 -4.91 119.36 121.42 1u1u n ILE 656 Ca 0.10 -2.17 -0.23 0.00 -2.50 0.00 0.00 62.75 57.95 1u1u n ILE 656 Cb 0.51 0.95 -0.15 0.00 0.54 0.00 0.00 39.64 41.48 1u1u n ILE 656 CO 0.00 0.00 0.00 -0.29 -2.50 0.00 0.00 176.55 173.76 1u1u h ILE 657 N 3.32 1.14 0.00 9.51 2.10 -1.63 -3.29 117.51 128.66 1u1u h ILE 657 Ca -0.23 -2.57 0.00 0.00 1.08 0.00 0.00 64.86 63.14 1u1u h ILE 657 Cb 1.26 2.92 0.00 0.00 -1.09 0.00 0.00 36.82 39.90 1u1u h ILE 657 CO 0.14 0.81 0.00 1.57 -1.08 0.00 0.00 178.15 179.58 1u1u n HIS 658 N -3.75 0.00 -0.42 2.19 -0.00 -1.26 -0.07 115.22 111.92 1u1u n HIS 658 Ca -0.21 0.00 0.37 0.00 0.46 0.00 0.00 57.72 58.34 1u1u n HIS 658 Cb 1.04 -0.31 0.64 0.00 -0.12 0.00 0.00 29.99 31.24 1u1u n HIS 658 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1u1u h SER 659 N 0.00 0.25 0.33 0.26 4.64 -1.96 3.31 113.55 120.38 1u1u h SER 659 Ca 0.00 0.19 -0.10 0.00 -0.47 0.00 0.00 61.79 61.41 1u1u h SER 659 Cb 0.00 0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1u1u h SER 659 CO 0.00 -0.30 -0.41 0.40 -0.87 0.00 0.00 176.83 175.65 1u1u h ILE 660 N 0.02 1.30 0.00 0.95 2.04 -1.37 -2.32 117.51 118.14 1u1u h ILE 660 Ca 0.86 -1.47 -0.03 0.00 1.00 0.00 0.00 64.86 65.22 1u1u h ILE 660 Cb 2.59 1.72 -0.01 0.00 -0.74 0.00 0.00 36.82 40.39 1u1u h ILE 660 CO -0.56 0.43 -0.54 -0.29 0.00 0.00 0.00 178.15 177.19 1u1u h ILE 661 N 0.10 0.18 -0.37 -0.67 2.10 0.95 -3.39 117.51 116.40 1u1u h ILE 661 Ca 0.01 -1.29 -0.49 0.00 1.08 0.00 0.00 64.86 64.17 1u1u h ILE 661 Cb 0.77 1.91 -0.06 0.00 -1.09 0.00 0.00 36.82 38.34 1u1u h ILE 661 CO 0.06 0.10 1.59 0.47 -1.08 0.00 0.00 178.15 179.29 1u1u n ASP 662 N -2.96 7.07 0.00 2.19 8.00 0.11 -4.82 116.55 126.12 1u1u n ASP 662 Ca 0.01 -2.74 0.00 0.00 0.71 0.00 0.00 54.79 52.77 1u1u n ASP 662 Cb 0.60 -1.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.28 1u1u n ASP 662 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1u1u n ASP 664 N 2.44 0.00 -4.40 -2.24 -0.08 -1.26 -4.93 116.55 106.08 1u1u n ASP 664 Ca 0.59 0.00 -0.26 0.00 -1.51 0.00 0.00 54.79 53.61 1u1u n ASP 664 Cb 0.52 0.00 -0.12 0.00 2.34 0.00 0.00 41.12 43.86 1u1u n ASP 664 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1u1u s ALA 665 N 0.00 2.39 0.06 -1.67 0.00 -1.26 -4.95 121.76 116.33 1u1u s ALA 665 Ca 0.00 -1.59 -0.00 0.00 0.00 0.00 0.00 51.96 50.37 1u1u s ALA 665 Cb 0.00 -0.30 -0.26 0.00 0.00 0.00 0.00 23.12 22.56 1u1u s ALA 665 CO 0.00 0.39 1.06 -0.44 0.00 0.00 0.00 175.76 176.77 1u1u h ASP 666 N 3.27 0.29 -5.02 0.00 3.32 -1.87 -3.43 116.42 112.99 1u1u h ASP 666 Ca -0.46 -0.35 -0.07 0.00 0.02 0.00 0.00 57.03 56.18 1u1u h ASP 666 Cb 1.21 -0.09 -0.17 0.00 0.22 0.00 0.00 39.33 40.49 1u1u h ASP 666 CO 0.48 1.28 -0.01 -0.69 -1.72 0.00 0.00 179.24 178.58 1u1u s VAL 667 N -2.65 0.03 0.00 -1.35 1.01 -0.98 -1.46 120.40 115.01 1u1u s VAL 667 Ca -0.04 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1u1u s VAL 667 Cb 0.08 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.53 1u1u s VAL 667 CO 0.86 -0.16 0.00 2.30 0.00 0.00 0.00 175.10 178.10 1u1u n ILE 668 N 0.60 0.00 -3.58 2.22 -5.35 -1.16 -0.96 119.36 111.13 1u1u n ILE 668 Ca -0.19 0.00 -0.06 0.00 -0.27 0.00 0.00 62.75 62.24 1u1u n ILE 668 Cb 0.59 0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 38.47 1u1u n ILE 668 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1u1u s THR 669 N -0.79 0.00 0.34 7.28 -1.32 0.10 -2.82 115.64 118.43 1u1u s THR 669 Ca 0.00 -0.13 -0.15 0.00 -1.21 0.00 0.00 61.69 60.19 1u1u s THR 669 Cb 0.00 -1.27 0.03 0.00 -1.51 0.00 0.00 72.50 69.76 1u1u s THR 669 CO 0.00 0.00 0.70 0.27 -2.21 0.00 0.00 174.62 173.38 1u1u s ILE 670 N -2.90 0.00 -0.25 5.08 -0.00 -1.26 -4.38 121.20 117.49 1u1u s ILE 670 Ca 0.08 -1.12 -0.02 0.00 -0.00 0.00 0.00 60.65 59.60 1u1u s ILE 670 Cb -0.00 -2.54 0.09 0.00 -0.00 0.00 0.00 42.46 40.00 1u1u s ILE 670 CO -0.06 0.00 2.36 1.21 -0.00 0.00 0.00 174.94 178.45 1u1u n GLU 671 N -0.50 1.81 0.00 0.37 2.13 -0.99 -3.85 120.64 119.61 1u1u n GLU 671 Ca -0.05 -1.38 0.00 0.00 0.66 0.00 0.00 57.16 56.38 1u1u n GLU 671 Cb 0.60 -1.66 0.00 0.00 0.27 0.00 0.00 31.44 30.65 1u1u n GLU 671 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1u1u n ASN 672 N 0.91 0.00 0.00 4.31 2.85 -1.26 -4.14 115.26 117.93 1u1u n ASN 672 Ca 0.30 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.77 1u1u n ASN 672 Cb 0.60 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.62 1u1u n ASN 672 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 1u1u n SER 673 N 0.00 0.00 -0.01 1.20 2.88 -1.14 -4.73 113.62 111.81 1u1u n SER 673 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 1u1u n SER 673 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 1u1u n SER 673 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1u1u n ARG 674 N 0.00 2.44 0.00 -1.46 5.12 -1.26 -4.68 116.66 116.81 1u1u n ARG 674 Ca 0.00 -1.45 0.00 0.00 -1.93 0.00 0.00 57.85 54.47 1u1u n ARG 674 Cb 0.00 -0.97 0.00 0.00 -1.16 0.00 0.00 32.46 30.33 1u1u n ARG 674 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1u1u n SER 675 N -0.51 0.00 -4.83 0.55 7.64 -1.26 -5.13 113.62 110.08 1u1u n SER 675 Ca 0.01 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.55 1u1u n SER 675 Cb 0.32 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.46 1u1u n SER 675 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1u1u s ASP 676 N -0.03 5.98 -0.01 6.43 1.01 -1.26 -4.99 116.67 123.80 1u1u s ASP 676 Ca 0.00 0.27 0.21 0.00 0.71 0.00 0.00 52.55 53.74 1u1u s ASP 676 Cb 0.00 -1.81 -0.26 0.00 1.01 0.00 0.00 42.92 41.85 1u1u s ASP 676 CO 0.00 0.31 0.77 -1.84 0.21 0.00 0.00 175.17 174.62 1u1u n GLU 677 N 1.35 0.21 -0.06 8.23 0.28 -1.26 -4.06 120.64 125.33 1u1u n GLU 677 Ca -0.14 -0.06 -0.08 0.00 -0.16 0.00 0.00 57.16 56.72 1u1u n GLU 677 Cb 0.53 -1.51 -0.15 0.00 1.43 0.00 0.00 31.44 31.75 1u1u n GLU 677 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1u1u n LYS 678 N -1.74 0.66 0.00 3.44 5.02 -1.26 -3.78 118.16 120.51 1u1u n LYS 678 Ca 0.02 0.09 0.11 0.00 -2.02 0.00 0.00 58.31 56.51 1u1u n LYS 678 Cb 0.40 -1.63 0.62 0.00 -0.02 0.00 0.00 35.03 34.41 1u1u n LYS 678 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1u1u n LEU 679 N -2.82 0.00 0.20 -0.35 4.77 -1.26 -1.78 117.00 115.75 1u1u n LEU 679 Ca -0.25 0.14 0.14 0.00 -0.03 0.00 0.00 56.01 56.02 1u1u n LEU 679 Cb 1.07 -0.14 0.43 0.00 -2.33 0.00 0.00 43.42 42.44 1u1u n LEU 679 CO 0.44 -0.04 0.89 -0.07 -1.33 0.00 0.00 177.39 177.28 1u1u h LEU 680 N 0.00 0.00 -1.37 2.23 3.38 -1.70 -2.93 115.31 114.92 1u1u h LEU 680 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u1u h LEU 680 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1u1u h LEU 680 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.99 1u1u n SER 681 N -2.78 1.15 -0.49 -0.43 3.41 -0.73 -2.31 113.62 111.45 1u1u n SER 681 Ca 0.03 -1.32 0.12 0.00 -0.26 0.00 0.00 58.87 57.44 1u1u n SER 681 Cb 0.39 -0.33 0.21 0.00 -0.26 0.00 0.00 64.21 64.22 1u1u n SER 681 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1u1u n VAL 682 N 0.35 0.00 -1.77 -3.33 0.24 -1.11 -4.10 118.33 108.62 1u1u n VAL 682 Ca 0.00 -0.25 -0.37 0.00 -2.04 0.00 0.00 64.34 61.68 1u1u n VAL 682 Cb 0.23 0.91 0.05 0.00 -1.47 0.00 0.00 33.84 33.56 1u1u n VAL 682 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1u1u n PHE 683 N 0.03 3.09 0.09 6.34 3.72 -0.98 -4.64 117.46 125.11 1u1u n PHE 683 Ca 0.12 -2.61 0.00 0.00 -0.05 0.00 0.00 57.45 54.91 1u1u n PHE 683 Cb 0.44 -1.17 0.00 0.00 -0.94 0.00 0.00 39.48 37.81 1u1u n PHE 683 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1u1u n ARG 684 N -0.67 0.00 -1.54 -1.08 0.63 -1.26 -3.53 116.66 109.21 1u1u n ARG 684 Ca 0.56 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 57.10 1u1u n ARG 684 Cb 0.43 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.29 1u1u n ARG 684 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1u1u n GLU 685 N -2.85 0.94 -1.17 -0.14 2.13 -1.26 0.20 120.64 118.49 1u1u n GLU 685 Ca 0.00 0.07 -0.01 0.00 0.66 0.00 0.00 57.16 57.87 1u1u n GLU 685 Cb 0.00 -3.00 -0.00 0.00 0.27 0.00 0.00 31.44 28.71 1u1u n GLU 685 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1u1u n GLY 686 N 6.13 0.46 0.00 8.31 0.00 -1.26 -4.90 105.19 113.93 1u1u n GLY 686 Ca 0.42 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1u1u n GLY 686 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1u1u n VAL 687 N -3.10 0.00 -1.21 1.61 0.31 0.53 -5.10 118.33 111.37 1u1u n VAL 687 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1u1u n VAL 687 Cb 0.11 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 1u1u n VAL 687 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1u1u n LYS 688 N 0.00 0.00 -0.49 5.55 5.02 -1.02 -4.82 118.16 122.39 1u1u n LYS 688 Ca 0.00 0.06 0.43 0.00 -2.02 0.00 0.00 58.31 56.78 1u1u n LYS 688 Cb 0.00 -1.21 0.73 0.00 -0.02 0.00 0.00 35.03 34.53 1u1u n LYS 688 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1u1u h TYR 689 N 0.00 0.00 -6.66 2.13 3.20 -1.91 -3.46 116.97 110.26 1u1u h TYR 689 Ca 0.00 0.00 -0.45 0.00 3.14 0.00 0.00 58.73 61.42 1u1u h TYR 689 Cb 0.80 0.00 0.01 0.00 1.54 0.00 0.00 36.73 39.08 1u1u h TYR 689 CO 0.00 0.00 -1.17 0.41 -1.64 0.00 0.00 178.16 175.76 1u1u n GLY 690 N -1.83 -0.56 0.00 1.82 0.00 -1.26 -4.90 105.19 98.46 1u1u n GLY 690 Ca 0.35 0.88 0.00 0.00 0.00 0.00 0.00 46.02 47.25 1u1u n GLY 690 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u1u n ALA 691 N -1.41 0.00 -2.48 4.61 0.00 -1.26 -4.72 120.51 115.26 1u1u n ALA 691 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.92 1u1u n ALA 691 Cb 0.69 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.02 1u1u n ALA 691 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1u1u s GLY 692 N 0.00 1.58 -0.05 0.00 0.00 -0.53 -4.78 107.32 103.53 1u1u s GLY 692 Ca 0.00 -1.11 -0.03 0.00 0.00 0.00 0.00 44.72 43.58 1u1u s GLY 692 CO 0.00 -0.97 0.13 -1.50 0.00 0.00 0.00 173.10 170.76 1u1u s ILE 693 N -0.87 -0.03 -0.70 0.90 2.07 -1.26 -2.98 121.20 118.32 1u1u s ILE 693 Ca 0.14 0.11 0.05 0.00 -1.41 0.00 0.00 60.65 59.53 1u1u s ILE 693 Cb -0.11 -0.20 0.24 0.00 0.13 0.00 0.00 42.46 42.52 1u1u s ILE 693 CO 0.04 0.04 0.77 0.61 -1.91 0.00 0.00 174.94 174.50 1u1u n GLY 694 N 3.70 4.69 3.60 1.50 0.00 -1.13 -3.23 105.19 114.32 1u1u n GLY 694 Ca -0.20 -2.73 -0.43 0.00 0.00 0.00 0.00 46.02 42.65 1u1u n GLY 694 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1u1u s PRO 695 N -2.29 3.22 -0.54 1.61 0.02 -1.26 -4.01 135.00 131.74 1u1u s PRO 695 Ca 0.36 1.77 -0.11 0.00 0.02 0.00 0.00 61.00 63.05 1u1u s PRO 695 Cb 0.10 -4.30 -0.14 0.00 0.02 0.00 0.00 34.50 30.18 1u1u s PRO 695 CO -0.03 -1.99 1.65 0.41 -0.33 0.00 0.00 177.00 176.70 1u1u n GLY 696 N 5.61 -0.23 3.57 0.52 0.00 -1.21 -4.72 105.19 108.73 1u1u n GLY 696 Ca 0.27 0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.98 1u1u n GLY 696 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1u1u s VAL 697 N 5.30 3.80 0.00 1.61 -7.23 -0.65 -2.90 120.40 120.33 1u1u s VAL 697 Ca 0.57 -1.21 0.00 0.00 -1.81 0.00 0.00 61.98 59.54 1u1u s VAL 697 Cb -0.22 -4.80 0.00 0.00 0.56 0.00 0.00 36.38 31.92 1u1u s VAL 697 CO 0.18 -1.50 0.00 0.00 -0.31 0.00 0.00 175.10 173.46 1u1u n TYR 698 N 11.35 0.00 -2.53 2.82 9.36 -1.26 -4.82 117.16 132.07 1u1u n TYR 698 Ca 0.44 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 61.24 1u1u n TYR 698 Cb 0.47 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.15 1u1u n TYR 698 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1u1u s ASP 699 N 0.00 6.33 0.36 2.98 2.15 -1.26 -0.14 116.67 127.09 1u1u s ASP 699 Ca 0.00 0.05 0.07 0.00 0.43 0.00 0.00 52.55 53.10 1u1u s ASP 699 Cb 0.00 -2.55 0.76 0.00 -0.30 0.00 0.00 42.92 40.82 1u1u s ASP 699 CO 0.00 -1.59 1.94 0.16 -0.17 0.00 0.00 175.17 175.51 1u1u h ILE 700 N 6.18 0.99 0.00 4.11 -0.00 -1.86 -2.53 117.51 124.39 1u1u h ILE 700 Ca -0.26 -0.25 0.00 0.00 -0.00 0.00 0.00 64.86 64.35 1u1u h ILE 700 Cb 1.06 0.18 0.00 0.00 -0.00 0.00 0.00 36.82 38.06 1u1u h ILE 700 CO 1.20 0.14 0.06 1.41 -0.00 0.00 0.00 178.15 180.96 1u1u n HIS 701 N -4.49 0.00 -3.93 0.16 8.25 -1.26 -4.44 115.22 109.51 1u1u n HIS 701 Ca 0.12 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.23 1u1u n HIS 701 Cb 0.27 -0.19 -0.14 0.00 1.12 0.00 0.00 29.99 31.06 1u1u n HIS 701 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1u1u s SER 702 N -2.25 4.47 0.61 0.41 1.04 -0.96 -4.98 113.70 112.04 1u1u s SER 702 Ca 0.00 -0.34 0.37 0.00 0.48 0.00 0.00 55.95 56.46 1u1u s SER 702 Cb 0.00 -1.77 1.95 0.00 0.10 0.00 0.00 66.02 66.30 1u1u s SER 702 CO 0.00 -0.01 2.23 1.55 0.98 0.00 0.00 173.24 177.99 1u1u h PRO 703 N 8.02 0.00 -6.37 4.02 0.13 -1.89 -3.41 132.00 132.50 1u1u h PRO 703 Ca -0.40 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.16 1u1u h PRO 703 Cb 1.17 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 1u1u h PRO 703 CO 0.60 0.03 0.90 -0.98 -0.23 0.00 0.00 178.00 178.31 1u1u s ARG 704 N -4.14 3.98 0.43 0.86 1.04 -1.26 -4.86 118.95 114.99 1u1u s ARG 704 Ca -0.03 1.08 -0.25 0.00 -1.04 0.00 0.00 55.73 55.48 1u1u s ARG 704 Cb 0.13 -3.80 -0.08 0.00 -2.04 0.00 0.00 34.95 29.15 1u1u s ARG 704 CO 0.49 -1.03 1.26 0.96 -0.04 0.00 0.00 175.30 176.94 1u1u s ILE 705 N 3.98 2.74 0.27 4.99 -0.00 -1.26 -5.03 121.20 126.88 1u1u s ILE 705 Ca 0.49 0.62 -0.04 0.00 -0.00 0.00 0.00 60.65 61.73 1u1u s ILE 705 Cb -0.13 -3.35 -0.05 0.00 -0.00 0.00 0.00 42.46 38.93 1u1u s ILE 705 CO 0.20 0.06 0.51 -2.16 -0.00 0.00 0.00 174.94 173.55 1u1u s PRO 706 N -2.39 3.60 0.34 0.37 0.04 -1.26 -5.06 135.00 130.63 1u1u s PRO 706 Ca 0.59 -0.10 -0.28 0.00 0.04 0.00 0.00 61.00 61.25 1u1u s PRO 706 Cb -0.35 -2.70 -0.10 0.00 0.04 0.00 0.00 34.50 31.39 1u1u s PRO 706 CO 0.45 0.26 1.26 -1.12 0.04 0.00 0.00 177.00 177.88 1u1u s SER 707 N -3.19 6.79 0.00 6.66 0.01 -1.26 -4.86 113.70 117.85 1u1u s SER 707 Ca 0.42 2.58 0.09 0.00 1.31 0.00 0.00 55.95 60.35 1u1u s SER 707 Cb -0.11 -2.64 0.40 0.00 0.21 0.00 0.00 66.02 63.88 1u1u s SER 707 CO 0.30 -0.51 1.29 -0.24 0.41 0.00 0.00 173.24 174.49 1u1u n SER 708 N 0.73 0.00 -0.58 2.44 2.88 -1.26 -0.37 113.62 117.46 1u1u n SER 708 Ca 0.01 0.48 0.13 0.00 -1.33 0.00 0.00 58.87 58.16 1u1u n SER 708 Cb 0.43 -0.49 0.43 0.00 -0.75 0.00 0.00 64.21 63.83 1u1u n SER 708 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1u1u n GLU 709 N -1.49 1.80 -0.00 -1.46 -0.00 -1.26 -3.76 120.64 114.46 1u1u n GLU 709 Ca 0.02 -1.17 0.07 0.00 -0.00 0.00 0.00 57.16 56.09 1u1u n GLU 709 Cb 0.11 -1.47 -0.10 0.00 -0.00 0.00 0.00 31.44 29.98 1u1u n GLU 709 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1u1u n GLU 710 N 0.41 1.30 -0.03 3.44 1.02 0.51 -4.55 120.64 122.74 1u1u n GLU 710 Ca 0.18 -0.07 -0.12 0.00 -0.02 0.00 0.00 57.16 57.13 1u1u n GLU 710 Cb 0.39 -1.27 -0.14 0.00 -0.02 0.00 0.00 31.44 30.40 1u1u n GLU 710 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1u1u n ILE 711 N -1.69 1.62 0.03 -3.67 5.41 -1.22 -2.75 119.36 117.08 1u1u n ILE 711 Ca -0.00 -0.76 -0.11 0.00 1.00 0.00 0.00 62.75 62.87 1u1u n ILE 711 Cb 0.31 -1.14 -0.06 0.00 -0.71 0.00 0.00 39.64 38.04 1u1u n ILE 711 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1u1u h ALA 712 N 0.74 0.01 -0.13 -1.39 0.00 -1.81 0.23 119.26 116.93 1u1u h ALA 712 Ca -0.37 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 1u1u h ALA 712 Cb 2.05 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.87 1u1u h ALA 712 CO 0.07 -0.50 -0.27 0.22 0.00 0.00 0.00 179.25 178.76 1u1u h ASP 713 N -0.01 0.46 -0.82 0.00 3.58 -1.80 0.36 116.42 118.18 1u1u h ASP 713 Ca 0.02 -0.57 0.20 0.00 0.42 0.00 0.00 57.03 57.10 1u1u h ASP 713 Cb 0.04 -0.13 -0.13 0.00 1.72 0.00 0.00 39.33 40.83 1u1u h ASP 713 CO -0.04 0.94 0.15 0.03 -2.88 0.00 0.00 179.24 177.44 1u1u h ARG 714 N -0.00 0.18 0.03 0.28 2.47 -1.34 0.60 114.38 116.61 1u1u h ARG 714 Ca 0.00 -0.01 -0.22 0.00 -1.26 0.00 0.00 59.98 58.49 1u1u h ARG 714 Cb 0.87 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.14 1u1u h ARG 714 CO 0.06 0.12 -0.98 0.28 0.56 0.00 0.00 179.97 180.01 1u1u h VAL 715 N 0.19 1.50 0.00 2.04 2.07 -0.86 -3.09 116.25 118.11 1u1u h VAL 715 Ca 0.48 -2.77 0.00 0.00 0.82 0.00 0.00 66.70 65.23 1u1u h VAL 715 Cb 0.91 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 33.29 1u1u h VAL 715 CO -0.63 0.81 0.00 0.59 0.02 0.00 0.00 177.57 178.35 1u1u n ASN 716 N -3.61 0.46 -2.06 0.57 3.02 0.14 -0.70 115.26 113.09 1u1u n ASN 716 Ca -0.05 0.63 -0.24 0.00 -0.03 0.00 0.00 54.58 54.89 1u1u n ASN 716 Cb 0.87 -0.72 0.08 0.00 -0.61 0.00 0.00 39.78 39.40 1u1u n ASN 716 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1u1u n LYS 717 N -2.03 2.16 0.00 3.52 4.76 0.16 -3.84 118.16 122.90 1u1u n LYS 717 Ca 0.02 -2.39 0.00 0.00 -2.87 0.00 0.00 58.31 53.07 1u1u n LYS 717 Cb 0.18 -1.94 0.00 0.00 -1.84 0.00 0.00 35.03 31.43 1u1u n LYS 717 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1u1u n LEU 719 N -0.43 0.00 -0.02 -0.35 4.77 0.13 -3.59 117.00 117.51 1u1u n LEU 719 Ca 0.46 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.43 1u1u n LEU 719 Cb 0.85 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.93 1u1u n LEU 719 CO 0.55 0.00 -0.07 0.00 -1.33 0.00 0.00 177.39 176.54 1u1u n ALA 720 N 0.00 0.10 0.31 -1.18 0.00 -1.25 -4.45 120.51 114.04 1u1u n ALA 720 Ca 0.00 -0.19 0.16 0.00 0.00 0.00 0.00 53.44 53.41 1u1u n ALA 720 Cb 0.00 0.00 0.70 0.00 0.00 0.00 0.00 19.45 20.15 1u1u n ALA 720 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1u1u h VAL 721 N -0.22 0.00 -1.96 0.00 -1.51 -1.84 -3.44 116.25 107.29 1u1u h VAL 721 Ca 0.00 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 65.16 1u1u h VAL 721 Cb 0.11 1.18 0.00 0.00 -2.13 0.00 0.00 31.29 30.45 1u1u h VAL 721 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 176.52 1u1u n LEU 722 N -2.76 0.00 -4.52 4.19 4.77 -1.26 -4.44 117.00 112.98 1u1u n LEU 722 Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.74 1u1u n LEU 722 Cb 0.22 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.21 1u1u n LEU 722 CO 0.22 0.00 -0.35 -0.70 -1.33 0.00 0.00 177.39 175.23 1u1u s GLU 723 N 1.74 1.76 -0.01 3.23 2.56 -1.26 -4.75 118.70 121.97 1u1u s GLU 723 Ca 0.00 -1.93 0.10 0.00 0.00 0.00 0.00 54.97 53.14 1u1u s GLU 723 Cb 0.00 -1.48 -0.15 0.00 2.00 0.00 0.00 34.13 34.51 1u1u s GLU 723 CO 0.00 0.05 0.24 0.94 -0.56 0.00 0.00 175.26 175.93 1u1u n GLN 724 N -0.76 0.67 -0.57 4.30 7.27 -1.26 -4.35 117.38 122.68 1u1u n GLN 724 Ca -0.05 -0.08 -0.07 0.00 0.07 0.00 0.00 57.00 56.87 1u1u n GLN 724 Cb 0.64 -1.20 0.12 0.00 2.41 0.00 0.00 30.24 32.21 1u1u n GLN 724 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 177.06 177.40 1u1u n ASN 725 N -1.78 3.38 0.00 1.69 6.94 -1.26 -4.31 115.26 119.93 1u1u n ASN 725 Ca -0.01 -2.71 0.00 0.00 -0.02 0.00 0.00 54.58 51.84 1u1u n ASN 725 Cb 0.25 -0.65 0.00 0.00 -2.36 0.00 0.00 39.78 37.02 1u1u n ASN 725 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 1u1u n ILE 726 N -0.14 0.00 -3.77 1.53 -5.35 -1.26 -5.05 119.36 105.31 1u1u n ILE 726 Ca 0.25 0.00 -0.11 0.00 -0.27 0.00 0.00 62.75 62.63 1u1u n ILE 726 Cb 0.99 0.00 -0.07 0.00 -1.74 0.00 0.00 39.64 38.82 1u1u n ILE 726 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1u1u s LEU 727 N 0.00 1.01 0.04 7.28 2.96 -1.26 -4.47 118.68 124.23 1u1u s LEU 727 Ca 0.00 -0.33 -0.00 0.00 -0.22 0.00 0.00 54.13 53.58 1u1u s LEU 727 Cb 0.00 1.29 -0.03 0.00 0.50 0.00 0.00 46.19 47.95 1u1u s LEU 727 CO 0.00 -0.66 -0.03 0.26 -1.32 0.00 0.00 176.35 174.60 1u1u s TRP 728 N -2.98 0.41 -0.21 5.38 0.52 -1.20 -4.00 118.94 116.87 1u1u s TRP 728 Ca -0.02 -0.79 -0.02 0.00 0.02 0.00 0.00 56.10 55.29 1u1u s TRP 728 Cb 0.01 -0.30 0.00 0.00 -1.15 0.00 0.00 33.47 32.03 1u1u s TRP 728 CO -0.06 -0.27 -0.09 0.08 0.02 0.00 0.00 176.95 176.62 1u1u s VAL 729 N -2.65 2.90 0.20 4.03 1.01 -1.11 -4.65 120.40 120.13 1u1u s VAL 729 Ca -0.04 -0.69 -0.23 0.00 0.00 0.00 0.00 61.98 61.02 1u1u s VAL 729 Cb -0.01 -2.31 0.06 0.00 0.00 0.00 0.00 36.38 34.12 1u1u s VAL 729 CO -0.05 0.44 0.96 0.54 0.00 0.00 0.00 175.10 176.98 1u1u s ASN 730 N 1.40 -0.09 0.94 3.32 4.22 -1.26 -1.38 114.94 122.10 1u1u s ASN 730 Ca 0.05 -0.61 -0.14 0.00 -2.14 0.00 0.00 52.86 50.01 1u1u s ASN 730 Cb -0.14 0.55 0.17 0.00 1.28 0.00 0.00 41.25 43.11 1u1u s ASN 730 CO -0.07 -1.06 1.21 -2.84 -2.04 0.00 0.00 177.10 172.30 1u1u s PRO 731 N -2.78 0.84 0.00 3.55 0.02 -1.26 -1.64 135.00 133.74 1u1u s PRO 731 Ca 0.16 -0.05 0.00 0.00 0.02 0.00 0.00 61.00 61.13 1u1u s PRO 731 Cb -0.03 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.66 1u1u s PRO 731 CO 0.05 -2.34 0.32 -3.47 -0.33 0.00 0.00 177.00 171.23 1u1u n ASP 732 N -3.79 0.00 0.00 2.53 4.64 0.80 -3.34 116.55 117.39 1u1u n ASP 732 Ca 0.11 0.33 0.00 0.00 -1.38 0.00 0.00 54.79 53.85 1u1u n ASP 732 Cb 0.60 -0.04 0.00 0.00 -1.04 0.00 0.00 41.12 40.63 1u1u n ASP 732 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1u1u n GLY 734 N 5.00 -3.04 2.51 0.00 0.00 -1.26 -4.68 105.19 103.73 1u1u n GLY 734 Ca 0.00 -1.36 -0.15 0.00 0.00 0.00 0.00 46.02 44.51 1u1u n GLY 734 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u1u n LEU 735 N 0.00 1.85 -1.57 0.99 4.77 -1.10 -4.74 117.00 117.20 1u1u n LEU 735 Ca 0.02 -4.43 -0.14 0.00 -0.03 0.00 0.00 56.01 51.43 1u1u n LEU 735 Cb 0.09 0.35 0.15 0.00 -2.33 0.00 0.00 43.42 41.68 1u1u n LEU 735 CO 0.06 1.92 0.77 1.17 -1.33 0.00 0.00 177.39 179.98 1u1u n LYS 736 N -0.02 2.27 0.00 3.23 0.00 -1.26 -3.02 118.16 119.36 1u1u n LYS 736 Ca 0.19 -3.35 0.00 0.00 0.00 0.00 0.00 58.31 55.15 1u1u n LYS 736 Cb 0.72 -1.99 0.00 0.00 0.00 0.00 0.00 35.03 33.76 1u1u n LYS 736 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1u1u n THR 737 N -1.04 0.00 -1.47 3.15 -2.24 -1.26 -4.90 114.28 106.52 1u1u n THR 737 Ca 0.42 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.80 1u1u n THR 737 Cb 1.04 -0.07 0.02 0.00 -2.10 0.00 0.00 70.33 69.22 1u1u n THR 737 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1u1u n ARG 738 N -1.71 0.61 0.00 -0.78 3.00 -1.26 -4.98 116.66 111.54 1u1u n ARG 738 Ca 0.00 0.23 0.00 0.00 -0.00 0.00 0.00 57.85 58.08 1u1u n ARG 738 Cb 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 32.46 30.84 1u1u n ARG 738 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1u1u n LYS 739 N 0.32 0.64 0.00 -0.14 4.81 -1.26 -4.72 118.16 117.82 1u1u n LYS 739 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.55 1u1u n LYS 739 Cb 0.43 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.48 1u1u n LYS 739 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1u1u n TYR 740 N 0.00 0.00 1.09 5.64 4.01 -1.26 -4.58 117.16 122.06 1u1u n TYR 740 Ca 0.00 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.86 1u1u n TYR 740 Cb 0.00 0.00 0.22 0.00 -0.31 0.00 0.00 39.34 39.25 1u1u n TYR 740 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1u1u n THR 741 N -0.89 0.00 0.34 -0.72 -2.24 -1.26 -2.98 114.28 106.53 1u1u n THR 741 Ca 0.00 -0.07 0.09 0.00 -2.27 0.00 0.00 64.05 61.79 1u1u n THR 741 Cb 0.13 0.50 0.14 0.00 -2.10 0.00 0.00 70.33 69.00 1u1u n THR 741 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1u1u n GLU 742 N -1.03 1.97 -0.00 -0.78 0.28 -1.26 -4.11 120.64 115.70 1u1u n GLU 742 Ca 0.08 -1.87 0.01 0.00 -0.16 0.00 0.00 57.16 55.23 1u1u n GLU 742 Cb 0.35 -1.37 -0.03 0.00 1.43 0.00 0.00 31.44 31.83 1u1u n GLU 742 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 1u1u n VAL 743 N 1.03 0.02 -0.06 3.84 0.24 -1.22 -4.54 118.33 117.64 1u1u n VAL 743 Ca 0.13 -0.08 -0.03 0.00 -2.04 0.00 0.00 64.34 62.32 1u1u n VAL 743 Cb 0.47 0.31 -0.01 0.00 -1.47 0.00 0.00 33.84 33.14 1u1u n VAL 743 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1u1u h LYS 744 N 0.00 0.00 0.00 7.34 1.79 -1.72 -3.21 116.57 120.77 1u1u h LYS 744 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1u1u h LYS 744 Cb 0.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 1u1u h LYS 744 CO 0.00 0.04 0.00 -0.35 -1.08 0.00 0.00 179.45 178.06 1u1u n PRO 745 N -4.69 0.18 0.00 3.15 -0.04 -1.26 -3.41 135.00 128.93 1u1u n PRO 745 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1u1u n PRO 745 Cb 0.16 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.22 1u1u n PRO 745 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1u1u n ALA 746 N -0.89 0.00 0.08 0.55 0.00 -1.24 -4.46 120.51 114.54 1u1u n ALA 746 Ca 0.03 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.66 1u1u n ALA 746 Cb 0.02 0.00 0.50 0.00 0.00 0.00 0.00 19.45 19.96 1u1u n ALA 746 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1u1u h LEU 747 N 0.00 0.00 -0.47 0.00 3.38 -1.66 0.15 115.31 116.71 1u1u h LEU 747 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u1u h LEU 747 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1u1u h LEU 747 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 178.44 179.70 1u1u n LYS 748 N -3.15 0.06 -3.07 1.13 4.81 -1.22 -4.54 118.16 112.18 1u1u n LYS 748 Ca 0.10 0.00 -0.17 0.00 -0.87 0.00 0.00 58.31 57.36 1u1u n LYS 748 Cb 0.98 -1.01 -0.04 0.00 0.02 0.00 0.00 35.03 34.98 1u1u n LYS 748 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1u1u n ASN 749 N -0.04 -1.41 0.00 3.14 3.02 0.53 -4.92 115.26 115.58 1u1u n ASN 749 Ca 0.00 -2.77 0.00 0.00 -0.03 0.00 0.00 54.58 51.78 1u1u n ASN 749 Cb 0.01 0.39 0.00 0.00 -0.61 0.00 0.00 39.78 39.57 1u1u n ASN 749 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1u1u n VAL 751 N 2.20 0.00 0.00 2.41 3.14 -1.26 -4.74 118.33 120.08 1u1u n VAL 751 Ca 0.21 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.45 1u1u n VAL 751 Cb 0.54 0.00 -0.09 0.00 -1.06 0.00 0.00 33.84 33.23 1u1u n VAL 751 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 1u1u h ASP 752 N 0.00 -1.53 0.04 6.55 3.32 -1.91 0.64 116.42 123.53 1u1u h ASP 752 Ca 0.00 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1u1u h ASP 752 Cb 0.00 0.59 0.00 0.00 0.22 0.00 0.00 39.33 40.14 1u1u h ASP 752 CO 0.00 -0.44 0.00 0.00 -1.72 0.00 0.00 179.24 177.08 1u1u n ALA 753 N -2.95 1.62 -0.08 3.45 0.00 -1.26 -2.68 120.51 118.60 1u1u n ALA 753 Ca -0.06 -0.03 -0.11 0.00 0.00 0.00 0.00 53.44 53.24 1u1u n ALA 753 Cb 0.34 -1.09 -0.04 0.00 0.00 0.00 0.00 19.45 18.66 1u1u n ALA 753 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u1u n ALA 754 N -1.11 1.24 -0.25 0.00 0.00 0.75 -4.46 120.51 116.68 1u1u n ALA 754 Ca 0.04 -0.74 0.25 0.00 0.00 0.00 0.00 53.44 52.99 1u1u n ALA 754 Cb 0.03 0.09 0.46 0.00 0.00 0.00 0.00 19.45 20.03 1u1u n ALA 754 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1u1u n LYS 755 N -4.27 -0.05 0.00 0.00 5.02 0.19 -3.01 118.16 116.04 1u1u n LYS 755 Ca -0.18 1.06 0.00 0.00 -2.02 0.00 0.00 58.31 57.17 1u1u n LYS 755 Cb 0.51 -1.92 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 1u1u n LYS 755 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1u1u n LEU 756 N -4.73 0.00 -0.11 -0.35 4.32 -1.18 -2.87 117.00 112.08 1u1u n LEU 756 Ca 0.30 0.00 0.08 0.00 -0.02 0.00 0.00 56.01 56.37 1u1u n LEU 756 Cb 1.01 0.00 0.13 0.00 -1.62 0.00 0.00 43.42 42.94 1u1u n LEU 756 CO 0.01 0.00 0.24 2.30 -1.22 0.00 0.00 177.39 178.72 1u1u n ILE 757 N 0.00 0.00 0.20 -0.08 -0.00 -1.16 0.11 119.36 118.43 1u1u n ILE 757 Ca 0.00 0.24 0.17 0.00 -0.00 0.00 0.00 62.75 63.16 1u1u n ILE 757 Cb 0.00 -0.40 0.82 0.00 -0.00 0.00 0.00 39.64 40.06 1u1u n ILE 757 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.55 176.46 1u1u h ARG 758 N 0.00 0.00 -1.14 6.28 2.43 -1.58 -3.07 114.38 117.31 1u1u h ARG 758 Ca 0.15 0.00 0.39 0.00 -0.81 0.00 0.00 59.98 59.71 1u1u h ARG 758 Cb 0.61 0.00 -0.14 0.00 -0.42 0.00 0.00 29.97 30.01 1u1u h ARG 758 CO -0.00 0.00 0.69 0.77 -1.51 0.00 0.00 179.97 179.91 1u1u h SER 759 N 0.00 0.35 0.00 -3.80 0.02 0.61 -3.53 113.55 107.21 1u1u h SER 759 Ca 0.08 0.18 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1u1u h SER 759 Cb 0.46 0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1u1u h SER 759 CO -0.00 -0.22 0.00 0.00 -1.14 0.00 0.00 176.83 175.47