#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1br4 s GLN 3 N 0.00 2.24 1.01 0.00 -1.52 -1.26 -5.13 119.66 115.01 1br4 s GLN 3 Ca 0.00 -2.05 -0.22 0.00 -1.95 0.00 0.00 55.36 51.13 1br4 s GLN 3 Cb 0.00 -1.94 -0.12 0.00 -0.22 0.00 0.00 33.01 30.73 1br4 s GLN 3 CO 0.00 -0.42 -0.97 1.17 -0.25 0.00 0.00 175.29 174.82 1br4 n LYS 4 N -1.51 -0.27 -4.05 2.91 4.81 -1.26 -4.90 118.16 113.89 1br4 n LYS 4 Ca -0.06 -0.07 -0.36 0.00 -0.87 0.00 0.00 58.31 56.95 1br4 n LYS 4 Cb 0.65 -1.17 -0.08 0.00 0.02 0.00 0.00 35.03 34.45 1br4 n LYS 4 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1br4 s PRO 5 N -2.35 3.40 -0.13 1.64 0.04 -1.26 -4.94 135.00 131.41 1br4 s PRO 5 Ca 0.42 -0.25 0.01 0.00 0.04 0.00 0.00 61.00 61.21 1br4 s PRO 5 Cb -0.03 -3.08 0.02 0.00 0.04 0.00 0.00 34.50 31.45 1br4 s PRO 5 CO 0.71 0.66 -0.14 -0.48 0.04 0.00 0.00 177.00 177.79 1br4 s LEU 6 N -0.73 1.65 1.04 -3.56 0.05 -1.26 -5.12 118.68 110.75 1br4 s LEU 6 Ca 0.12 -0.44 -0.22 0.00 0.05 0.00 0.00 54.13 53.64 1br4 s LEU 6 Cb -0.12 -1.10 -0.04 0.00 -2.05 0.00 0.00 46.19 42.88 1br4 s LEU 6 CO 0.03 -0.03 -0.75 -1.54 -0.55 0.00 0.00 176.35 173.51 1br4 n SER 7 N 4.52 -2.70 0.02 1.48 3.41 -1.26 -4.42 113.62 114.67 1br4 n SER 7 Ca -0.18 -0.08 0.20 0.00 -0.26 0.00 0.00 58.87 58.55 1br4 n SER 7 Cb 0.51 -0.70 0.70 0.00 -0.26 0.00 0.00 64.21 64.45 1br4 n SER 7 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1br4 h ASP 8 N -1.59 0.00 0.08 4.04 3.04 -2.00 -0.78 116.42 119.20 1br4 h ASP 8 Ca -0.43 0.00 -0.22 0.00 -3.24 0.00 0.00 57.03 53.14 1br4 h ASP 8 Cb 1.30 0.00 0.02 0.00 -1.04 0.00 0.00 39.33 39.61 1br4 h ASP 8 CO 0.27 0.00 -0.92 0.44 -2.04 0.00 0.00 179.24 177.00 1br4 h ASP 9 N 0.00 0.68 0.63 4.15 5.19 -1.95 -3.05 116.42 122.07 1br4 h ASP 9 Ca 0.24 -0.82 0.00 0.00 -0.62 0.00 0.00 57.03 55.82 1br4 h ASP 9 Cb 0.98 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 40.28 1br4 h ASP 9 CO -0.00 1.43 0.00 -0.62 -3.12 0.00 0.00 179.24 176.93 1br4 n GLU 10 N -4.02 0.01 -0.05 3.56 4.71 -0.61 -1.85 120.64 122.40 1br4 n GLU 10 Ca -0.12 0.21 0.00 0.00 -0.01 0.00 0.00 57.16 57.24 1br4 n GLU 10 Cb 0.84 -1.52 0.02 0.00 -1.01 0.00 0.00 31.44 29.77 1br4 n GLU 10 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1br4 n LYS 11 N -1.55 1.22 0.00 3.49 5.02 -0.40 -1.48 118.16 124.46 1br4 n LYS 11 Ca 0.04 -0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1br4 n LYS 11 Cb 0.21 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.69 1br4 n LYS 11 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1br4 n PHE 12 N 0.03 0.00 -0.04 2.13 3.72 -0.77 -4.81 117.46 117.72 1br4 n PHE 12 Ca 0.02 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.35 1br4 n PHE 12 Cb 0.30 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.82 1br4 n PHE 12 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1br4 n LEU 13 N -0.86 1.61 0.00 4.37 4.77 -1.00 -4.28 117.00 121.61 1br4 n LEU 13 Ca 0.00 0.26 -0.20 0.00 -0.03 0.00 0.00 56.01 56.04 1br4 n LEU 13 Cb 0.00 -0.59 0.11 0.00 -2.33 0.00 0.00 43.42 40.62 1br4 n LEU 13 CO 0.00 -0.39 0.51 0.49 -1.33 0.00 0.00 177.39 176.67 1br4 n PHE 14 N -4.09 -3.29 -4.40 -1.77 3.01 -0.55 -4.84 117.46 101.54 1br4 n PHE 14 Ca -0.11 -1.28 -0.29 0.00 1.01 0.00 0.00 57.45 56.79 1br4 n PHE 14 Cb 0.36 -0.65 -0.07 0.00 -0.01 0.00 0.00 39.48 39.12 1br4 n PHE 14 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1br4 s VAL 15 N -2.66 1.71 -0.62 -4.37 1.01 -1.26 -4.62 120.40 109.59 1br4 s VAL 15 Ca 0.55 -1.82 -0.11 0.00 0.00 0.00 0.00 61.98 60.60 1br4 s VAL 15 Cb -0.03 -2.53 0.16 0.00 0.00 0.00 0.00 36.38 33.98 1br4 s VAL 15 CO 0.37 0.00 0.51 -1.81 0.00 0.00 0.00 175.10 174.17 1br4 s ASP 16 N -3.94 6.01 -0.22 3.32 1.01 -1.26 -4.84 116.67 116.75 1br4 s ASP 16 Ca 0.26 -2.29 0.07 0.00 0.71 0.00 0.00 52.55 51.30 1br4 s ASP 16 Cb 0.03 -2.07 -0.19 0.00 1.01 0.00 0.00 42.92 41.70 1br4 s ASP 16 CO 0.14 -0.63 -0.12 1.17 0.21 0.00 0.00 175.17 175.95 1br4 n LYS 17 N 4.43 0.71 -1.59 8.23 4.81 -1.26 -4.81 118.16 128.69 1br4 n LYS 17 Ca 0.00 0.09 -0.14 0.00 -0.87 0.00 0.00 58.31 57.39 1br4 n LYS 17 Cb 0.42 -1.49 -0.12 0.00 0.02 0.00 0.00 35.03 33.87 1br4 n LYS 17 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1br4 s ASN 18 N -6.00 3.37 0.36 3.14 0.01 -1.26 -4.79 114.94 109.76 1br4 s ASN 18 Ca -0.25 -0.91 0.05 0.00 -0.71 0.00 0.00 52.86 51.04 1br4 s ASN 18 Cb 0.07 -2.60 -0.03 0.00 0.41 0.00 0.00 41.25 39.11 1br4 s ASN 18 CO 0.64 -4.82 0.19 -0.36 -1.51 0.00 0.00 177.10 171.24 1br4 s PHE 19 N 17.25 1.73 0.28 2.20 0.08 -1.26 -4.94 117.98 133.32 1br4 s PHE 19 Ca 0.83 -1.45 -0.29 0.00 0.12 0.00 0.00 56.93 56.13 1br4 s PHE 19 Cb -0.05 -0.92 -0.10 0.00 -0.57 0.00 0.00 43.02 41.38 1br4 s PHE 19 CO 0.18 -0.57 1.19 0.54 -0.10 0.00 0.00 175.22 176.46 1br4 s VAL 20 N -3.39 3.23 0.00 -0.44 0.11 -1.26 -4.86 120.40 113.79 1br4 s VAL 20 Ca 0.32 1.20 -0.02 0.00 -2.93 0.00 0.00 61.98 60.55 1br4 s VAL 20 Cb 0.03 -3.76 -0.09 0.00 -1.53 0.00 0.00 36.38 31.03 1br4 s VAL 20 CO 0.20 0.27 1.82 0.59 -3.33 0.00 0.00 175.10 174.64 1br4 n ASN 21 N 1.32 3.08 -4.32 3.54 3.02 -1.26 -4.88 115.26 115.76 1br4 n ASN 21 Ca 0.00 -1.96 -0.59 0.00 -0.03 0.00 0.00 54.58 52.00 1br4 n ASN 21 Cb 0.44 -0.75 -0.08 0.00 -0.61 0.00 0.00 39.78 38.77 1br4 n ASN 21 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1br4 n ASN 22 N 2.27 0.47 -0.59 6.41 0.23 -1.26 -4.84 115.26 117.96 1br4 n ASN 22 Ca 0.14 1.10 0.12 0.00 -0.53 0.00 0.00 54.58 55.41 1br4 n ASN 22 Cb 0.43 -0.85 0.40 0.00 -2.08 0.00 0.00 39.78 37.68 1br4 n ASN 22 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1br4 n PRO 23 N 2.40 1.79 0.19 -0.53 -0.04 -1.26 -4.14 135.00 133.41 1br4 n PRO 23 Ca 0.23 -1.18 -0.08 0.00 -0.04 0.00 0.00 63.50 62.43 1br4 n PRO 23 Cb 0.02 -1.43 -0.04 0.00 -0.04 0.00 0.00 33.50 32.01 1br4 n PRO 23 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1br4 h LEU 24 N 2.53 -0.43 -1.66 1.53 -0.00 -1.98 0.70 115.31 116.00 1br4 h LEU 24 Ca 0.00 0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.87 1br4 h LEU 24 Cb 0.55 0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 41.31 1br4 h LEU 24 CO 0.00 -0.19 -0.02 0.00 -0.00 0.00 0.00 178.44 178.23 1br4 h ALA 25 N -1.51 1.73 0.09 1.53 0.00 -1.99 -2.32 119.26 116.78 1br4 h ALA 25 Ca -0.05 -0.10 -0.26 0.00 0.00 0.00 0.00 54.91 54.50 1br4 h ALA 25 Cb 0.39 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1br4 h ALA 25 CO 0.09 0.21 -1.16 1.96 0.00 0.00 0.00 179.25 180.34 1br4 h GLN 26 N 0.18 0.21 0.55 0.00 1.08 -1.71 -3.33 115.11 112.09 1br4 h GLN 26 Ca 0.04 -0.35 -0.03 0.00 -1.45 0.00 0.00 58.65 56.87 1br4 h GLN 26 Cb 0.17 0.13 0.01 0.00 -0.05 0.00 0.00 27.48 27.73 1br4 h GLN 26 CO 0.01 1.16 -0.26 0.00 -0.95 0.00 0.00 178.83 178.78 1br4 h ALA 27 N 0.70 -0.73 0.00 3.87 0.00 0.95 -2.22 119.26 121.82 1br4 h ALA 27 Ca -0.10 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1br4 h ALA 27 Cb 1.90 0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.97 1br4 h ALA 27 CO 0.18 -0.84 0.53 0.22 0.00 0.00 0.00 179.25 179.34 1br4 h ASP 28 N -0.88 0.00 -0.95 0.00 1.82 -1.59 -1.87 116.42 112.95 1br4 h ASP 28 Ca -0.07 0.00 0.28 0.00 -0.39 0.00 0.00 57.03 56.84 1br4 h ASP 28 Cb 0.61 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.59 1br4 h ASP 28 CO 0.12 0.00 0.88 4.11 -1.61 0.00 0.00 179.24 182.75 1br4 h TRP 29 N 0.00 0.00 -0.44 0.28 5.08 -1.50 0.22 115.95 119.60 1br4 h TRP 29 Ca 0.00 0.00 0.04 0.00 1.08 0.00 0.00 58.89 60.01 1br4 h TRP 29 Cb 1.05 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 27.17 1br4 h TRP 29 CO 0.00 0.00 0.21 0.77 -1.28 0.00 0.00 178.44 178.14 1br4 h SER 30 N 0.00 0.29 0.00 0.11 0.02 -1.56 -2.16 113.55 110.24 1br4 h SER 30 Ca 0.45 0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 61.34 1br4 h SER 30 Cb 2.22 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 64.70 1br4 h SER 30 CO -0.00 0.21 -0.10 0.00 -1.14 0.00 0.00 176.83 175.79 1br4 n ALA 31 N -2.32 4.40 0.00 3.77 0.00 0.79 -4.45 120.51 122.70 1br4 n ALA 31 Ca 0.03 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 52.61 1br4 n ALA 31 Cb 0.12 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1br4 n ALA 31 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1br4 n LYS 32 N 2.26 0.00 0.00 0.00 5.02 -0.81 -0.19 118.16 124.43 1br4 n LYS 32 Ca 0.20 0.25 0.02 0.00 -2.02 0.00 0.00 58.31 56.76 1br4 n LYS 32 Cb 0.57 -1.72 0.11 0.00 -0.02 0.00 0.00 35.03 33.98 1br4 n LYS 32 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1br4 n LYS 33 N -1.24 0.64 -2.80 1.97 4.76 -1.26 -4.64 118.16 115.59 1br4 n LYS 33 Ca 0.00 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.02 1br4 n LYS 33 Cb 0.22 -1.09 -0.03 0.00 -1.84 0.00 0.00 35.03 32.28 1br4 n LYS 33 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1br4 s LEU 34 N -1.18 4.07 0.00 -0.35 0.20 0.73 -1.37 118.68 120.77 1br4 s LEU 34 Ca 0.06 1.08 0.00 0.00 0.69 0.00 0.00 54.13 55.95 1br4 s LEU 34 Cb 0.03 -3.32 0.00 0.00 -0.43 0.00 0.00 46.19 42.47 1br4 s LEU 34 CO 0.04 -0.62 0.00 1.33 -0.29 0.00 0.00 176.35 176.81 1br4 n VAL 35 N 5.40 0.00 -4.01 1.68 0.24 0.38 -4.35 118.33 117.68 1br4 n VAL 35 Ca 0.08 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.15 1br4 n VAL 35 Cb 0.47 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.78 1br4 n VAL 35 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1br4 s TRP 36 N -0.58 2.74 -0.00 6.34 0.52 0.18 -0.06 118.94 128.08 1br4 s TRP 36 Ca 0.00 -0.39 -0.29 0.00 0.02 0.00 0.00 56.10 55.44 1br4 s TRP 36 Cb 0.00 -1.74 0.10 0.00 -1.15 0.00 0.00 33.47 30.68 1br4 s TRP 36 CO 0.00 0.26 0.95 0.14 0.02 0.00 0.00 176.95 178.32 1br4 s VAL 37 N -2.42 0.00 0.77 4.03 -7.23 0.03 -2.08 120.40 113.50 1br4 s VAL 37 Ca 0.39 -0.11 -0.11 0.00 -1.81 0.00 0.00 61.98 60.35 1br4 s VAL 37 Cb -0.03 -1.18 -0.00 0.00 0.56 0.00 0.00 36.38 35.73 1br4 s VAL 37 CO 0.24 0.00 -0.32 -0.81 -0.31 0.00 0.00 175.10 173.90 1br4 n PRO 38 N -0.27 -0.61 0.00 4.82 -0.04 -1.26 -1.92 135.00 135.72 1br4 n PRO 38 Ca -0.07 -0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.21 1br4 n PRO 38 Cb 0.61 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.93 1br4 n PRO 38 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1br4 n SER 39 N 1.89 0.00 -0.08 3.54 2.88 -0.99 -4.34 113.62 116.52 1br4 n SER 39 Ca 0.01 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.49 1br4 n SER 39 Cb 0.30 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.61 1br4 n SER 39 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1br4 n GLU 40 N -0.18 0.68 -0.03 -1.46 1.02 -1.26 -3.44 120.64 115.97 1br4 n GLU 40 Ca 0.00 -0.01 -0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1br4 n GLU 40 Cb 0.00 -1.55 -0.09 0.00 -0.02 0.00 0.00 31.44 29.78 1br4 n GLU 40 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1br4 n LYS 41 N -2.69 1.33 -0.01 3.49 4.76 -1.26 -4.67 118.16 119.11 1br4 n LYS 41 Ca -0.27 -0.05 0.06 0.00 -2.87 0.00 0.00 58.31 55.18 1br4 n LYS 41 Cb 1.05 -1.28 -0.10 0.00 -1.84 0.00 0.00 35.03 32.86 1br4 n LYS 41 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1br4 n HIS 42 N -2.17 0.00 0.00 2.13 8.25 -1.26 -4.86 115.22 117.31 1br4 n HIS 42 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 1br4 n HIS 42 Cb 0.60 -0.30 0.00 0.00 1.12 0.00 0.00 29.99 31.41 1br4 n HIS 42 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1br4 n GLY 43 N 1.79 1.60 3.24 -1.41 0.00 -1.22 -4.82 105.19 104.37 1br4 n GLY 43 Ca -0.03 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 1br4 n GLY 43 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1br4 s PHE 44 N 0.00 1.26 -0.27 1.61 0.08 -1.26 -2.34 117.98 117.05 1br4 s PHE 44 Ca 0.00 -1.26 -0.31 0.00 0.12 0.00 0.00 56.93 55.47 1br4 s PHE 44 Cb 0.00 -0.68 0.18 0.00 -0.57 0.00 0.00 43.02 41.95 1br4 s PHE 44 CO 0.00 -0.48 1.33 -1.83 -0.10 0.00 0.00 175.22 174.13 1br4 s GLU 45 N -4.08 0.11 0.52 0.44 -1.05 -0.81 -4.86 118.70 108.97 1br4 s GLU 45 Ca 0.35 0.01 -0.17 0.00 -0.15 0.00 0.00 54.97 55.01 1br4 s GLU 45 Cb 0.07 0.05 -0.07 0.00 -0.44 0.00 0.00 34.13 33.74 1br4 s GLU 45 CO 0.11 -0.04 1.00 0.00 0.95 0.00 0.00 175.26 177.28 1br4 s ALA 46 N -1.30 2.96 -0.19 -0.84 0.00 -1.25 -0.79 121.76 120.34 1br4 s ALA 46 Ca 0.09 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 52.07 1br4 s ALA 46 Cb -0.01 -3.17 0.13 0.00 0.00 0.00 0.00 23.12 20.08 1br4 s ALA 46 CO -0.06 -0.34 1.03 0.00 0.00 0.00 0.00 175.76 176.39 1br4 s ALA 47 N -2.45 -1.96 -0.08 0.00 0.00 0.92 -2.79 121.76 115.40 1br4 s ALA 47 Ca 0.61 1.66 0.01 0.00 0.00 0.00 0.00 51.96 54.24 1br4 s ALA 47 Cb -0.12 -0.91 -0.03 0.00 0.00 0.00 0.00 23.12 22.06 1br4 s ALA 47 CO 0.29 -0.29 -0.08 0.45 0.00 0.00 0.00 175.76 176.13 1br4 s SER 48 N -0.83 4.53 -0.08 0.00 0.15 -1.17 0.14 113.70 116.43 1br4 s SER 48 Ca -0.00 -0.08 -0.29 0.00 0.70 0.00 0.00 55.95 56.28 1br4 s SER 48 Cb -0.01 -1.21 -0.06 0.00 -1.71 0.00 0.00 66.02 63.03 1br4 s SER 48 CO -0.01 0.33 1.82 -0.63 1.20 0.00 0.00 173.24 175.95 1br4 s ILE 49 N -0.61 3.35 -0.13 6.45 1.01 -0.47 -2.93 121.20 127.87 1br4 s ILE 49 Ca 0.09 0.41 0.18 0.00 0.00 0.00 0.00 60.65 61.33 1br4 s ILE 49 Cb -0.12 -3.31 -0.24 0.00 0.01 0.00 0.00 42.46 38.81 1br4 s ILE 49 CO 0.02 -0.09 0.39 0.29 0.00 0.00 0.00 174.94 175.55 1br4 n LYS 50 N 7.60 0.66 -3.42 2.79 4.76 -0.06 -4.93 118.16 125.56 1br4 n LYS 50 Ca 0.20 0.06 0.01 0.00 -2.87 0.00 0.00 58.31 55.71 1br4 n LYS 50 Cb 0.43 -1.62 -0.03 0.00 -1.84 0.00 0.00 35.03 31.96 1br4 n LYS 50 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1br4 s GLU 51 N -2.77 0.42 -0.65 1.97 2.12 -1.05 -5.00 118.70 113.75 1br4 s GLU 51 Ca -0.07 0.99 -0.23 0.00 0.36 0.00 0.00 54.97 56.01 1br4 s GLU 51 Cb 0.08 0.59 0.06 0.00 0.26 0.00 0.00 34.13 35.12 1br4 s GLU 51 CO 0.84 -0.23 1.00 -1.21 -0.54 0.00 0.00 175.26 175.13 1br4 s GLU 52 N 2.72 3.16 -0.14 4.30 2.02 -1.26 0.12 118.70 129.62 1br4 s GLU 52 Ca 0.00 -0.65 0.01 0.00 0.02 0.00 0.00 54.97 54.35 1br4 s GLU 52 Cb -0.10 -4.19 0.20 0.00 0.10 0.00 0.00 34.13 30.14 1br4 s GLU 52 CO -0.18 -1.81 1.35 1.63 0.02 0.00 0.00 175.26 176.28 1br4 n LYS 53 N 7.90 1.40 0.00 1.61 4.76 0.89 -4.94 118.16 129.77 1br4 n LYS 53 Ca -0.02 -0.93 0.00 0.00 -2.87 0.00 0.00 58.31 54.49 1br4 n LYS 53 Cb 0.46 -1.36 0.00 0.00 -1.84 0.00 0.00 35.03 32.29 1br4 n LYS 53 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1br4 n GLY 54 N 0.07 1.03 0.00 0.72 0.00 -1.26 -4.00 105.19 101.75 1br4 n GLY 54 Ca 0.18 -1.04 0.03 0.00 0.00 0.00 0.00 46.02 45.19 1br4 n GLY 54 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1br4 n ASP 55 N 2.70 0.00 -3.93 1.61 -0.08 -1.26 -4.42 116.55 111.16 1br4 n ASP 55 Ca 0.00 0.50 -0.21 0.00 -1.51 0.00 0.00 54.79 53.57 1br4 n ASP 55 Cb 0.00 -0.50 -0.16 0.00 2.34 0.00 0.00 41.12 42.80 1br4 n ASP 55 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1br4 s GLU 56 N -3.00 0.99 -0.03 -0.67 8.01 -1.26 0.28 118.70 123.03 1br4 s GLU 56 Ca 0.03 -0.19 0.07 0.00 0.01 0.00 0.00 54.97 54.89 1br4 s GLU 56 Cb 0.04 -0.93 -0.02 0.00 -4.31 0.00 0.00 34.13 28.91 1br4 s GLU 56 CO 0.10 -0.03 -0.24 0.08 0.01 0.00 0.00 175.26 175.18 1br4 s VAL 57 N 0.75 2.16 -0.06 2.63 1.01 0.11 -0.08 120.40 126.92 1br4 s VAL 57 Ca -0.11 -1.06 -0.26 0.00 0.00 0.00 0.00 61.98 60.55 1br4 s VAL 57 Cb -0.14 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1br4 s VAL 57 CO 0.01 0.58 0.81 0.42 0.00 0.00 0.00 175.10 176.92 1br4 s THR 58 N -0.51 4.96 0.11 3.92 -4.23 0.34 -1.89 115.64 118.33 1br4 s THR 58 Ca 0.07 1.67 -0.00 0.00 -1.18 0.00 0.00 61.69 62.25 1br4 s THR 58 Cb -0.11 -4.15 -0.04 0.00 1.34 0.00 0.00 72.50 69.54 1br4 s THR 58 CO 0.00 0.18 0.01 -0.69 -0.54 0.00 0.00 174.62 173.59 1br4 s VAL 59 N 1.09 0.28 -0.12 2.29 1.01 -1.25 -0.88 120.40 122.82 1br4 s VAL 59 Ca 0.42 -1.89 -0.04 0.00 0.00 0.00 0.00 61.98 60.48 1br4 s VAL 59 Cb -0.19 -1.84 0.05 0.00 0.00 0.00 0.00 36.38 34.40 1br4 s VAL 59 CO 0.20 -0.69 0.07 -0.70 0.00 0.00 0.00 175.10 173.99 1br4 s GLU 60 N -3.97 0.04 0.20 2.72 2.12 -1.15 -1.34 118.70 117.33 1br4 s GLU 60 Ca 0.17 0.10 -0.33 0.00 0.36 0.00 0.00 54.97 55.27 1br4 s GLU 60 Cb 0.07 -1.28 -0.13 0.00 0.26 0.00 0.00 34.13 33.05 1br4 s GLU 60 CO -0.03 -0.52 1.59 1.47 -0.54 0.00 0.00 175.26 177.24 1br4 n LEU 61 N 5.27 3.43 -1.23 2.70 -0.00 -0.13 -3.04 117.00 124.00 1br4 n LEU 61 Ca -0.05 1.09 0.00 0.00 -0.00 0.00 0.00 56.01 57.05 1br4 n LEU 61 Cb 0.49 -1.48 0.00 0.00 -0.00 0.00 0.00 43.42 42.44 1br4 n LEU 61 CO 0.09 -0.16 0.54 0.00 -0.00 0.00 0.00 177.39 177.85 1br4 n GLN 62 N 3.24 0.78 0.03 1.47 10.64 -1.12 -2.39 117.38 130.02 1br4 n GLN 62 Ca 0.15 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.32 1br4 n GLN 62 Cb 0.31 -1.11 0.00 0.00 -0.86 0.00 0.00 30.24 28.58 1br4 n GLN 62 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 1br4 n GLU 63 N 0.99 0.00 -0.64 2.61 4.07 -1.26 -4.81 120.64 121.60 1br4 n GLU 63 Ca 0.00 0.00 0.09 0.00 -0.06 0.00 0.00 57.16 57.19 1br4 n GLU 63 Cb 0.39 -0.25 0.35 0.00 -0.06 0.00 0.00 31.44 31.87 1br4 n GLU 63 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1br4 n ASN 64 N -3.00 4.80 0.00 4.31 3.02 -1.25 -4.88 115.26 118.26 1br4 n ASN 64 Ca 0.00 -2.59 0.00 0.00 -0.03 0.00 0.00 54.58 51.96 1br4 n ASN 64 Cb 0.00 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 38.59 1br4 n ASN 64 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1br4 n GLY 65 N 0.80 0.00 3.73 7.41 0.00 -1.01 -4.84 105.19 111.28 1br4 n GLY 65 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 1br4 n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1br4 s LYS 66 N -1.37 4.24 -1.16 1.61 2.36 -1.25 -4.80 119.74 119.37 1br4 s LYS 66 Ca 0.00 2.32 -0.12 0.00 -2.55 0.00 0.00 55.97 55.62 1br4 s LYS 66 Cb 0.00 -3.14 0.20 0.00 -1.05 0.00 0.00 37.83 33.84 1br4 s LYS 66 CO 0.00 -0.53 1.32 0.21 1.55 0.00 0.00 175.35 177.89 1br4 s LYS 67 N 0.61 4.10 -0.45 4.03 2.47 -1.26 -0.96 119.74 128.28 1br4 s LYS 67 Ca 0.66 -2.75 -0.16 0.00 -1.56 0.00 0.00 55.97 52.15 1br4 s LYS 67 Cb -0.43 -4.89 0.05 0.00 -1.46 0.00 0.00 37.83 31.10 1br4 s LYS 67 CO 0.35 -1.60 0.42 0.08 0.16 0.00 0.00 175.35 174.77 1br4 s VAL 68 N 0.71 5.15 0.26 4.02 1.01 -0.45 -4.89 120.40 126.22 1br4 s VAL 68 Ca 0.38 -0.74 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 1br4 s VAL 68 Cb -0.05 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 1br4 s VAL 68 CO -0.03 -0.53 0.53 -0.89 0.00 0.00 0.00 175.10 174.18 1br4 s THR 69 N 1.91 5.04 0.35 3.92 2.01 -1.23 -3.80 115.64 123.84 1br4 s THR 69 Ca 0.08 0.08 -0.10 0.00 0.31 0.00 0.00 61.69 62.06 1br4 s THR 69 Cb -0.21 -3.71 0.03 0.00 0.01 0.00 0.00 72.50 68.62 1br4 s THR 69 CO 0.10 -0.25 0.63 -0.76 -0.69 0.00 0.00 174.62 173.65 1br4 s LEU 70 N -3.37 0.45 0.95 4.42 1.43 -0.79 -4.90 118.68 116.88 1br4 s LEU 70 Ca 0.44 -1.26 -0.11 0.00 -1.03 0.00 0.00 54.13 52.17 1br4 s LEU 70 Cb -0.11 2.18 0.17 0.00 0.03 0.00 0.00 46.19 48.46 1br4 s LEU 70 CO 0.28 -1.47 1.11 -0.55 0.23 0.00 0.00 176.35 175.95 1br4 s SER 71 N -3.13 2.66 0.00 2.29 0.15 -1.26 0.07 113.70 114.47 1br4 s SER 71 Ca 0.22 1.98 0.00 0.00 0.70 0.00 0.00 55.95 58.86 1br4 s SER 71 Cb -0.03 -2.49 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 1br4 s SER 71 CO 0.15 -3.23 0.52 1.17 1.20 0.00 0.00 173.24 173.05 1br4 n LYS 72 N -4.30 0.93 -1.00 5.44 4.81 0.82 -2.59 118.16 122.26 1br4 n LYS 72 Ca 0.09 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.55 1br4 n LYS 72 Cb 0.53 -1.41 0.01 0.00 0.02 0.00 0.00 35.03 34.17 1br4 n LYS 72 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1br4 n ASP 73 N -0.03 0.43 0.00 3.14 5.68 -1.26 -4.76 116.55 119.75 1br4 n ASP 73 Ca 0.00 -1.96 0.00 0.00 -0.50 0.00 0.00 54.79 52.33 1br4 n ASP 73 Cb 0.21 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 1br4 n ASP 73 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1br4 n ASP 74 N 0.24 0.19 -2.56 -1.12 9.92 -1.07 -5.04 116.55 117.11 1br4 n ASP 74 Ca 0.02 -0.45 -0.08 0.00 -0.53 0.00 0.00 54.79 53.75 1br4 n ASP 74 Cb 0.91 0.93 0.05 0.00 -0.64 0.00 0.00 41.12 42.37 1br4 n ASP 74 CO 0.00 0.00 0.00 2.30 0.13 0.00 0.00 177.20 179.63 1br4 n ILE 75 N -0.95 0.00 -3.63 0.53 -5.35 -1.26 -4.32 119.36 104.38 1br4 n ILE 75 Ca 0.00 -0.30 -0.04 0.00 -0.27 0.00 0.00 62.75 62.14 1br4 n ILE 75 Cb 0.00 -1.76 -0.06 0.00 -1.74 0.00 0.00 39.64 36.08 1br4 n ILE 75 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1br4 s GLN 76 N -3.69 0.49 -0.15 6.28 0.74 -0.88 -4.86 119.66 117.59 1br4 s GLN 76 Ca 0.21 0.89 -0.35 0.00 0.05 0.00 0.00 55.36 56.15 1br4 s GLN 76 Cb -0.01 0.16 -0.12 0.00 1.10 0.00 0.00 33.01 34.15 1br4 s GLN 76 CO 0.14 -0.11 1.89 1.63 -0.55 0.00 0.00 175.29 178.29 1br4 n LYS 77 N 4.09 1.91 -3.17 1.67 5.02 -1.26 0.51 118.16 126.93 1br4 n LYS 77 Ca -0.18 0.69 -0.35 0.00 -2.02 0.00 0.00 58.31 56.45 1br4 n LYS 77 Cb 0.57 -2.55 -0.06 0.00 -0.02 0.00 0.00 35.03 32.97 1br4 n LYS 77 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1br4 s MET 78 N 4.20 4.15 0.05 1.97 1.75 -1.26 -4.84 119.30 125.32 1br4 s MET 78 Ca 0.95 0.75 -0.11 0.00 -1.25 0.00 0.00 55.69 56.03 1br4 s MET 78 Cb -0.77 -2.82 -0.06 0.00 2.84 0.00 0.00 34.83 34.02 1br4 s MET 78 CO 0.54 0.38 0.39 1.21 -0.65 0.00 0.00 175.02 176.89 1br4 s ASN 79 N -1.77 6.69 0.50 1.11 3.84 -1.26 -4.92 114.94 119.13 1br4 s ASN 79 Ca 0.43 0.84 -0.20 0.00 0.21 0.00 0.00 52.86 54.14 1br4 s ASN 79 Cb -0.15 -2.20 -0.11 0.00 -0.55 0.00 0.00 41.25 38.24 1br4 s ASN 79 CO 0.20 0.23 0.48 -2.65 -2.79 0.00 0.00 177.10 172.57 1br4 n PRO 80 N 1.24 0.51 0.00 0.43 -0.02 -1.26 -4.78 135.00 131.12 1br4 n PRO 80 Ca -0.10 0.19 0.05 0.00 -2.02 0.00 0.00 63.50 61.62 1br4 n PRO 80 Cb 0.52 -1.56 0.32 0.00 -0.02 0.00 0.00 33.50 32.76 1br4 n PRO 80 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1br4 n PRO 81 N 0.38 0.41 0.00 0.52 -0.04 -1.26 -1.96 135.00 133.05 1br4 n PRO 81 Ca 0.11 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.70 1br4 n PRO 81 Cb 0.44 -1.40 0.66 0.00 -0.04 0.00 0.00 33.50 33.16 1br4 n PRO 81 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1br4 n LYS 82 N -0.90 0.45 0.00 0.54 4.81 -1.26 -3.19 118.16 118.61 1br4 n LYS 82 Ca 0.08 0.04 0.02 0.00 -0.87 0.00 0.00 58.31 57.58 1br4 n LYS 82 Cb 0.04 -1.50 -0.01 0.00 0.02 0.00 0.00 35.03 33.57 1br4 n LYS 82 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1br4 n PHE 83 N -1.23 0.00 -1.44 5.64 3.72 -0.83 -5.03 117.46 118.30 1br4 n PHE 83 Ca 0.13 0.00 -0.62 0.00 -0.05 0.00 0.00 57.45 56.91 1br4 n PHE 83 Cb 0.18 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.61 1br4 n PHE 83 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1br4 n SER 84 N -0.74 0.99 -3.05 4.37 2.88 -1.19 -1.43 113.62 115.45 1br4 n SER 84 Ca 0.01 0.85 -0.12 0.00 -1.33 0.00 0.00 58.87 58.28 1br4 n SER 84 Cb 0.08 -0.91 0.06 0.00 -0.75 0.00 0.00 64.21 62.68 1br4 n SER 84 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1br4 n LYS 85 N 6.29 -1.94 -2.88 -1.46 5.02 -1.26 -5.01 118.16 116.92 1br4 n LYS 85 Ca 0.46 0.82 -0.34 0.00 -2.02 0.00 0.00 58.31 57.23 1br4 n LYS 85 Cb -0.03 -5.36 -0.07 0.00 -0.02 0.00 0.00 35.03 29.55 1br4 n LYS 85 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1br4 s VAL 86 N -3.32 4.42 0.01 -0.18 0.11 -0.52 -4.99 120.40 115.93 1br4 s VAL 86 Ca 0.38 1.45 -0.25 0.00 -2.93 0.00 0.00 61.98 60.63 1br4 s VAL 86 Cb -0.05 -3.68 -0.14 0.00 -1.53 0.00 0.00 36.38 30.98 1br4 s VAL 86 CO 0.66 -0.19 1.08 -0.33 -3.33 0.00 0.00 175.10 172.99 1br4 h GLU 87 N 2.25 -0.87 -4.21 1.54 4.39 -1.95 -3.40 114.58 112.34 1br4 h GLU 87 Ca -0.48 0.06 -0.74 0.00 0.34 0.00 0.00 59.36 58.54 1br4 h GLU 87 Cb 1.18 0.20 -0.28 0.00 -0.10 0.00 0.00 28.75 29.75 1br4 h GLU 87 CO 0.63 -0.58 -0.33 0.34 -1.16 0.00 0.00 179.01 177.91 1br4 s ASP 88 N -4.31 5.86 0.00 1.42 -1.08 -1.26 -1.92 116.67 115.39 1br4 s ASP 88 Ca -0.13 -1.94 0.00 0.00 -0.52 0.00 0.00 52.55 49.96 1br4 s ASP 88 Cb 0.01 -2.07 0.00 0.00 -1.46 0.00 0.00 42.92 39.41 1br4 s ASP 88 CO 0.40 -0.73 0.73 0.23 0.52 0.00 0.00 175.17 176.32 1br4 n MET 89 N 4.93 0.00 0.20 4.34 2.81 0.09 0.03 117.12 129.51 1br4 n MET 89 Ca -0.08 0.26 0.14 0.00 -1.81 0.00 0.00 57.70 56.21 1br4 n MET 89 Cb 0.41 -1.67 0.48 0.00 -0.71 0.00 0.00 33.22 31.74 1br4 n MET 89 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1br4 h ALA 90 N 1.22 1.00 0.00 3.04 0.00 -1.93 -2.86 119.26 119.74 1br4 h ALA 90 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1br4 h ALA 90 Cb 0.33 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1br4 h ALA 90 CO 0.00 0.00 -0.45 0.93 0.00 0.00 0.00 179.25 179.73 1br4 h GLU 91 N 0.00 0.00 -6.34 0.00 5.08 -0.79 -3.46 114.58 109.08 1br4 h GLU 91 Ca 0.00 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.71 1br4 h GLU 91 Cb 0.61 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.90 1br4 h GLU 91 CO 0.00 0.45 0.68 1.28 -1.00 0.00 0.00 179.01 180.42 1br4 n LEU 92 N -3.32 2.39 0.21 1.33 4.77 -1.08 -4.83 117.00 116.47 1br4 n LEU 92 Ca 0.01 1.09 0.09 0.00 -0.03 0.00 0.00 56.01 57.17 1br4 n LEU 92 Cb 0.65 -1.28 0.38 0.00 -2.33 0.00 0.00 43.42 40.84 1br4 n LEU 92 CO 0.39 -0.63 0.75 0.71 -1.33 0.00 0.00 177.39 177.28 1br4 h THR 93 N 3.85 0.57 -3.73 -5.08 1.35 -1.91 -3.39 112.91 104.56 1br4 h THR 93 Ca -0.47 -1.29 -0.66 0.00 -0.55 0.00 0.00 66.41 63.45 1br4 h THR 93 Cb 1.30 1.88 -0.37 0.00 -1.73 0.00 0.00 68.15 69.23 1br4 h THR 93 CO 0.85 0.25 -0.80 0.00 -0.25 0.00 0.00 175.52 175.57 1br4 s LEU 95 N 1.18 4.34 0.17 0.00 0.20 -1.26 -4.79 118.68 118.53 1br4 s LEU 95 Ca -0.07 -0.10 0.00 0.00 0.69 0.00 0.00 54.13 54.66 1br4 s LEU 95 Cb -0.19 -2.38 -0.04 0.00 -0.43 0.00 0.00 46.19 43.14 1br4 s LEU 95 CO -0.06 -0.32 0.04 0.20 -0.29 0.00 0.00 176.35 175.92 1br4 s ASN 96 N 1.72 0.80 0.43 3.68 -0.87 -1.26 -4.98 114.94 114.46 1br4 s ASN 96 Ca 0.13 -1.23 0.22 0.00 -1.57 0.00 0.00 52.86 50.41 1br4 s ASN 96 Cb -0.16 0.21 0.94 0.00 -0.02 0.00 0.00 41.25 42.22 1br4 s ASN 96 CO 0.12 -0.67 1.85 -0.08 -2.57 0.00 0.00 177.10 175.75 1br4 h GLU 97 N 2.71 0.00 0.03 -0.60 4.22 -1.98 -2.85 114.58 116.11 1br4 h GLU 97 Ca -0.36 0.00 -0.25 0.00 0.08 0.00 0.00 59.36 58.83 1br4 h GLU 97 Cb 1.21 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 1br4 h GLU 97 CO 0.60 0.27 -1.33 0.00 -2.18 0.00 0.00 179.01 176.37 1br4 h ALA 98 N 1.73 0.27 -0.28 2.92 0.00 -1.97 -3.28 119.26 118.65 1br4 h ALA 98 Ca -0.00 -1.20 0.03 0.00 0.00 0.00 0.00 54.91 53.74 1br4 h ALA 98 Cb 0.69 0.68 -0.05 0.00 0.00 0.00 0.00 17.79 19.12 1br4 h ALA 98 CO 0.03 0.78 -0.33 0.77 0.00 0.00 0.00 179.25 180.50 1br4 h SER 99 N -0.78 -1.12 -0.81 0.00 0.02 -1.87 0.59 113.55 109.58 1br4 h SER 99 Ca -0.34 0.15 0.13 0.00 -0.84 0.00 0.00 61.79 60.89 1br4 h SER 99 Cb 1.44 0.46 -0.06 0.00 0.14 0.00 0.00 62.40 64.39 1br4 h SER 99 CO -0.13 -0.23 0.53 0.58 -1.14 0.00 0.00 176.83 176.44 1br4 h VAL 100 N -0.21 0.86 -0.61 2.27 2.07 -1.72 -0.11 116.25 118.80 1br4 h VAL 100 Ca 0.05 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.36 1br4 h VAL 100 Cb 0.34 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 1br4 h VAL 100 CO -0.37 0.11 0.40 0.25 0.02 0.00 0.00 177.57 177.97 1br4 h LEU 101 N 0.61 0.71 0.00 2.57 6.46 -1.13 -2.40 115.31 122.13 1br4 h LEU 101 Ca 0.40 -0.03 0.00 0.00 -0.12 0.00 0.00 57.88 58.13 1br4 h LEU 101 Cb 0.67 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.43 1br4 h LEU 101 CO -0.16 0.52 0.00 1.57 -0.62 0.00 0.00 178.44 179.76 1br4 n HIS 102 N -4.65 0.00 -0.24 1.25 -0.00 0.02 -0.56 115.22 111.04 1br4 n HIS 102 Ca 0.04 0.00 -0.01 0.00 0.46 0.00 0.00 57.72 58.21 1br4 n HIS 102 Cb 0.03 -0.43 0.02 0.00 -0.12 0.00 0.00 29.99 29.48 1br4 n HIS 102 CO 0.00 0.00 0.00 -1.71 0.46 0.00 0.00 176.34 175.09 1br4 n ASN 103 N -1.98 -0.43 -0.11 0.26 5.15 -0.94 0.40 115.26 117.61 1br4 n ASN 103 Ca 0.00 1.08 0.01 0.00 -0.60 0.00 0.00 54.58 55.08 1br4 n ASN 103 Cb 0.00 -0.24 0.31 0.00 -0.53 0.00 0.00 39.78 39.32 1br4 n ASN 103 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1br4 h LEU 104 N 0.00 0.67 0.54 1.20 3.38 -1.32 -2.19 115.31 117.60 1br4 h LEU 104 Ca 0.20 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1br4 h LEU 104 Cb 0.36 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1br4 h LEU 104 CO -0.61 0.53 -0.39 -0.09 0.09 0.00 0.00 178.44 177.98 1br4 h ARG 105 N 0.78 -0.86 0.00 1.13 2.43 1.02 -2.17 114.38 116.70 1br4 h ARG 105 Ca 0.20 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1br4 h ARG 105 Cb -0.00 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1br4 h ARG 105 CO -0.04 -0.58 0.00 0.39 -1.51 0.00 0.00 179.97 178.24 1br4 n GLU 106 N -5.51 0.00 -0.45 0.20 4.71 -0.33 -1.81 120.64 117.45 1br4 n GLU 106 Ca -0.12 0.13 0.39 0.00 -0.01 0.00 0.00 57.16 57.55 1br4 n GLU 106 Cb 0.40 -0.84 0.67 0.00 -1.01 0.00 0.00 31.44 30.65 1br4 n GLU 106 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1br4 h ARG 107 N 0.00 0.02 0.55 3.49 3.08 -1.55 0.10 114.38 120.07 1br4 h ARG 107 Ca 0.00 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1br4 h ARG 107 Cb 0.00 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.05 1br4 h ARG 107 CO 0.00 0.01 -0.26 -0.92 -1.07 0.00 0.00 179.97 177.73 1br4 h TYR 108 N 0.02 -0.68 0.00 3.04 3.20 -0.61 1.07 116.97 123.01 1br4 h TYR 108 Ca 0.87 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.72 1br4 h TYR 108 Cb 2.73 0.23 0.00 0.00 1.54 0.00 0.00 36.73 41.23 1br4 h TYR 108 CO -0.01 -0.42 0.00 1.19 -1.64 0.00 0.00 178.16 177.28 1br4 n PHE 109 N -4.25 0.00 -0.04 -3.82 3.72 0.14 -0.52 117.46 112.68 1br4 n PHE 109 Ca -0.09 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.36 1br4 n PHE 109 Cb 0.29 -0.22 0.13 0.00 -0.94 0.00 0.00 39.48 38.74 1br4 n PHE 109 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1br4 n SER 110 N -1.22 2.69 0.00 4.37 7.64 0.02 -4.97 113.62 122.15 1br4 n SER 110 Ca 0.00 -1.89 0.00 0.00 1.01 0.00 0.00 58.87 57.99 1br4 n SER 110 Cb 0.00 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 1br4 n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1br4 n GLY 111 N 0.50 0.95 3.64 0.23 0.00 0.32 -4.77 105.19 106.05 1br4 n GLY 111 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1br4 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1br4 s LEU 112 N 0.00 3.99 -0.03 0.99 1.43 0.36 -4.83 118.68 120.59 1br4 s LEU 112 Ca 0.00 0.08 -0.09 0.00 -1.03 0.00 0.00 54.13 53.09 1br4 s LEU 112 Cb 0.00 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 1br4 s LEU 112 CO 0.00 0.08 -0.17 2.30 0.23 0.00 0.00 176.35 178.80 1br4 n ILE 113 N 4.16 1.36 -1.52 -0.59 -5.35 -1.26 -1.60 119.36 114.57 1br4 n ILE 113 Ca -0.15 0.28 -0.41 0.00 -0.27 0.00 0.00 62.75 62.20 1br4 n ILE 113 Cb 0.52 -1.95 -0.07 0.00 -1.74 0.00 0.00 39.64 36.40 1br4 n ILE 113 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1br4 n TYR 114 N -3.95 1.25 -3.63 4.28 4.02 -1.26 -4.32 117.16 113.55 1br4 n TYR 114 Ca -0.07 0.21 -0.18 0.00 -0.01 0.00 0.00 57.90 57.85 1br4 n TYR 114 Cb 0.25 -2.55 0.01 0.00 -0.02 0.00 0.00 39.34 37.03 1br4 n TYR 114 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1br4 n THR 115 N 7.70 0.00 -4.73 -0.72 -1.04 -0.69 -4.57 114.28 110.22 1br4 n THR 115 Ca 0.45 -1.54 -0.25 0.00 -2.04 0.00 0.00 64.05 60.67 1br4 n THR 115 Cb 0.34 -0.26 -0.16 0.00 -1.82 0.00 0.00 70.33 68.44 1br4 n THR 115 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1br4 s TYR 116 N -1.90 1.52 -0.28 -1.42 1.51 -0.81 -3.18 117.35 112.79 1br4 s TYR 116 Ca 0.27 -0.40 -0.02 0.00 -1.01 0.00 0.00 57.07 55.90 1br4 s TYR 116 Cb -0.02 -1.02 0.09 0.00 -0.11 0.00 0.00 41.96 40.90 1br4 s TYR 116 CO 0.17 -0.13 0.10 -1.54 -1.11 0.00 0.00 175.55 173.04 1br4 s SER 117 N 0.00 3.67 1.73 2.29 1.04 -0.90 -0.73 113.70 120.81 1br4 s SER 117 Ca -0.02 -1.39 0.00 0.00 0.48 0.00 0.00 55.95 55.02 1br4 s SER 117 Cb -0.10 -0.63 0.00 0.00 0.10 0.00 0.00 66.02 65.39 1br4 s SER 117 CO 0.01 -0.41 0.00 0.61 0.98 0.00 0.00 173.24 174.43 1br4 n GLY 118 N 5.03 3.69 0.11 7.32 0.00 -1.26 -2.07 105.19 118.00 1br4 n GLY 118 Ca -0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.82 1br4 n GLY 118 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1br4 h LEU 119 N 0.00 0.39 0.00 0.99 3.38 -1.96 -3.46 115.31 114.65 1br4 h LEU 119 Ca 0.00 -0.46 -0.37 0.00 0.09 0.00 0.00 57.88 57.14 1br4 h LEU 119 Cb 0.00 -0.13 0.11 0.00 0.09 0.00 0.00 40.66 40.73 1br4 h LEU 119 CO 0.00 1.37 0.23 2.22 0.09 0.00 0.00 178.44 182.35 1br4 n PHE 120 N -3.49 -3.56 -3.79 1.13 -1.74 -0.88 -4.90 117.46 100.24 1br4 n PHE 120 Ca -0.11 -1.18 -0.13 0.00 -0.56 0.00 0.00 57.45 55.46 1br4 n PHE 120 Cb 1.03 -0.73 -0.14 0.00 1.52 0.00 0.00 39.48 41.15 1br4 n PHE 120 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1br4 s VAL 122 N 0.74 4.24 -0.42 0.00 1.01 -1.19 -1.99 120.40 122.79 1br4 s VAL 122 Ca -0.06 1.00 0.08 0.00 0.00 0.00 0.00 61.98 63.00 1br4 s VAL 122 Cb -0.08 -3.58 0.36 0.00 0.00 0.00 0.00 36.38 33.08 1br4 s VAL 122 CO -0.03 -0.68 1.17 0.52 0.00 0.00 0.00 175.10 176.07 1br4 n VAL 123 N -2.01 0.05 -1.17 2.92 0.31 -0.90 -1.70 118.33 115.82 1br4 n VAL 123 Ca 0.07 -1.87 -0.38 0.00 -0.01 0.00 0.00 64.34 62.16 1br4 n VAL 123 Cb 0.54 1.11 -0.00 0.00 -0.91 0.00 0.00 33.84 34.57 1br4 n VAL 123 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1br4 n ILE 124 N -0.03 0.59 -2.72 2.52 -0.00 -1.26 -3.52 119.36 114.95 1br4 n ILE 124 Ca 0.04 -0.45 -0.42 0.00 -0.00 0.00 0.00 62.75 61.93 1br4 n ILE 124 Cb 0.76 0.00 -0.04 0.00 -0.00 0.00 0.00 39.64 40.37 1br4 n ILE 124 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.55 176.76 1br4 s ASN 125 N -0.90 7.42 -0.04 4.38 3.84 0.66 -4.79 114.94 125.50 1br4 s ASN 125 Ca 0.54 1.71 -0.17 0.00 0.21 0.00 0.00 52.86 55.15 1br4 s ASN 125 Cb -0.58 -2.58 -0.32 0.00 -0.55 0.00 0.00 41.25 37.23 1br4 s ASN 125 CO 0.57 -0.19 0.80 1.55 -2.79 0.00 0.00 177.10 177.04 1br4 h PRO 126 N 6.35 0.38 -0.07 0.43 0.13 -1.91 -3.41 132.00 133.90 1br4 h PRO 126 Ca -0.42 -0.65 -0.03 0.00 -0.87 0.00 0.00 66.00 64.04 1br4 h PRO 126 Cb 1.22 0.24 -0.01 0.00 0.13 0.00 0.00 31.00 32.57 1br4 h PRO 126 CO 0.74 1.31 -0.03 0.66 -0.23 0.00 0.00 178.00 180.45 1br4 n TYR 127 N -3.86 0.00 -4.59 1.56 4.01 -1.26 -4.17 117.16 108.85 1br4 n TYR 127 Ca -0.19 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.28 1br4 n TYR 127 Cb 0.97 -1.10 -0.10 0.00 -0.31 0.00 0.00 39.34 38.80 1br4 n TYR 127 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1br4 s LYS 128 N -1.24 1.90 -1.05 -0.72 2.20 -1.26 -4.66 119.74 114.91 1br4 s LYS 128 Ca 0.00 -2.09 -0.05 0.00 -0.36 0.00 0.00 55.97 53.47 1br4 s LYS 128 Cb 0.00 -1.38 0.29 0.00 -1.51 0.00 0.00 37.83 35.23 1br4 s LYS 128 CO 0.00 -0.14 1.27 1.04 -0.36 0.00 0.00 175.35 177.16 1br4 n GLN 129 N -0.92 3.93 -2.25 4.03 3.00 -1.26 -5.04 117.38 118.87 1br4 n GLN 129 Ca -0.06 -4.53 -0.41 0.00 -0.01 0.00 0.00 57.00 51.99 1br4 n GLN 129 Cb 0.67 -2.50 -0.03 0.00 0.00 0.00 0.00 30.24 28.38 1br4 n GLN 129 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1br4 s LEU 130 N -2.22 4.46 -1.38 1.08 1.43 -1.26 -4.93 118.68 115.86 1br4 s LEU 130 Ca 0.31 2.48 -0.10 0.00 -1.03 0.00 0.00 54.13 55.80 1br4 s LEU 130 Cb 0.00 -3.63 0.09 0.00 0.03 0.00 0.00 46.19 42.69 1br4 s LEU 130 CO 0.02 -0.42 2.21 -0.81 0.23 0.00 0.00 176.35 177.59 1br4 n PRO 131 N 1.45 3.68 -0.08 1.29 -0.04 -1.26 -4.39 135.00 135.65 1br4 n PRO 131 Ca 0.01 -3.13 0.03 0.00 -0.04 0.00 0.00 63.50 60.37 1br4 n PRO 131 Cb 0.43 -2.92 0.04 0.00 -0.04 0.00 0.00 33.50 31.00 1br4 n PRO 131 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1br4 n ILE 132 N 3.39 0.91 -3.85 0.52 -0.00 -1.26 -4.95 119.36 114.11 1br4 n ILE 132 Ca 0.53 -1.01 -0.26 0.00 -0.00 0.00 0.00 62.75 62.00 1br4 n ILE 132 Cb 0.32 0.40 -0.17 0.00 -0.00 0.00 0.00 39.64 40.20 1br4 n ILE 132 CO 0.00 0.00 0.00 -0.31 -0.00 0.00 0.00 176.55 176.24 1br4 s TYR 133 N -1.18 1.28 0.02 4.28 2.02 -1.26 -4.90 117.35 117.60 1br4 s TYR 133 Ca 0.09 -0.67 -0.29 0.00 -0.37 0.00 0.00 57.07 55.82 1br4 s TYR 133 Cb 0.07 -1.12 0.11 0.00 -0.40 0.00 0.00 41.96 40.62 1br4 s TYR 133 CO 0.01 -0.49 1.20 -1.54 -1.57 0.00 0.00 175.55 173.15 1br4 s SER 134 N 1.77 -0.09 0.49 2.29 1.04 -1.26 -4.94 113.70 113.00 1br4 s SER 134 Ca 0.04 -0.19 0.21 0.00 0.48 0.00 0.00 55.95 56.49 1br4 s SER 134 Cb -0.13 0.24 1.26 0.00 0.10 0.00 0.00 66.02 67.49 1br4 s SER 134 CO -0.07 -0.45 1.97 -0.08 0.98 0.00 0.00 173.24 175.59 1br4 h GLU 135 N 2.00 0.16 0.55 4.02 4.57 -1.96 -1.49 114.58 122.42 1br4 h GLU 135 Ca -0.28 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 57.86 1br4 h GLU 135 Cb 1.21 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.77 1br4 h GLU 135 CO 0.27 0.10 -0.26 -0.22 -1.18 0.00 0.00 179.01 177.73 1br4 h LYS 136 N 0.16 -0.71 -0.68 1.92 3.64 -2.00 -2.66 116.57 116.25 1br4 h LYS 136 Ca 0.29 0.05 0.14 0.00 -1.27 0.00 0.00 60.65 59.86 1br4 h LYS 136 Cb 0.92 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.86 1br4 h LYS 136 CO -0.04 -0.47 0.46 0.82 -2.27 0.00 0.00 179.45 177.95 1br4 h ILE 137 N -0.95 0.79 -0.51 2.00 1.08 -1.84 0.37 117.51 118.45 1br4 h ILE 137 Ca -0.07 -0.11 -0.00 0.00 -0.39 0.00 0.00 64.86 64.29 1br4 h ILE 137 Cb 0.56 0.46 -0.02 0.00 -3.07 0.00 0.00 36.82 34.74 1br4 h ILE 137 CO 0.12 0.06 0.32 0.40 -0.69 0.00 0.00 178.15 178.36 1br4 h ILE 138 N 0.31 1.15 0.48 -0.67 1.08 -1.27 -2.70 117.51 115.89 1br4 h ILE 138 Ca 0.33 -0.32 -0.02 0.00 -0.39 0.00 0.00 64.86 64.46 1br4 h ILE 138 Cb 0.85 0.44 0.00 0.00 -3.07 0.00 0.00 36.82 35.05 1br4 h ILE 138 CO -0.08 0.15 -0.23 0.44 -0.69 0.00 0.00 178.15 177.73 1br4 h ASP 139 N 0.69 -0.55 -0.79 1.72 5.19 0.02 -2.81 116.42 119.88 1br4 h ASP 139 Ca 0.18 -0.05 0.23 0.00 -0.62 0.00 0.00 57.03 56.77 1br4 h ASP 139 Cb -0.03 0.14 -0.03 0.00 0.18 0.00 0.00 39.33 39.59 1br4 h ASP 139 CO -0.04 -0.27 0.88 0.24 -3.12 0.00 0.00 179.24 176.93 1br4 h MET 140 N -0.82 0.00 0.00 3.56 2.86 -0.91 -0.63 114.93 118.99 1br4 h MET 140 Ca -0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1br4 h MET 140 Cb 0.57 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.23 1br4 h MET 140 CO 0.11 0.00 -1.86 0.66 1.06 0.00 0.00 176.91 176.88 1br4 n TYR 141 N -3.49 0.00 -1.61 -0.22 4.01 -1.03 -4.73 117.16 110.09 1br4 n TYR 141 Ca 0.17 0.00 -0.51 0.00 -0.16 0.00 0.00 57.90 57.40 1br4 n TYR 141 Cb 1.14 -0.43 -0.06 0.00 -0.31 0.00 0.00 39.34 39.68 1br4 n TYR 141 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1br4 n LYS 142 N -2.15 1.54 0.00 -0.72 4.81 -0.25 -0.00 118.16 121.39 1br4 n LYS 142 Ca -0.03 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 57.93 1br4 n LYS 142 Cb 0.50 -2.48 0.00 0.00 0.02 0.00 0.00 35.03 33.07 1br4 n LYS 142 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1br4 n GLY 143 N 5.16 2.99 3.67 3.14 0.00 -1.26 -4.97 105.19 113.92 1br4 n GLY 143 Ca 0.30 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.90 1br4 n GLY 143 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1br4 s LYS 144 N -0.03 4.18 0.15 1.61 2.47 1.00 -4.98 119.74 124.14 1br4 s LYS 144 Ca 0.00 2.28 -0.02 0.00 -1.56 0.00 0.00 55.97 56.67 1br4 s LYS 144 Cb 0.00 -3.94 0.04 0.00 -1.46 0.00 0.00 37.83 32.46 1br4 s LYS 144 CO 0.00 -0.84 0.08 1.17 0.16 0.00 0.00 175.35 175.92 1br4 n LYS 145 N 6.90 -1.38 0.13 4.03 4.81 -1.26 -4.90 118.16 126.49 1br4 n LYS 145 Ca 0.17 -0.13 -0.12 0.00 -0.87 0.00 0.00 58.31 57.36 1br4 n LYS 145 Cb 0.42 -0.20 -0.07 0.00 0.02 0.00 0.00 35.03 35.20 1br4 n LYS 145 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1br4 h ARG 146 N 0.00 -0.37 0.00 1.64 -0.00 -1.94 -3.33 114.38 110.39 1br4 h ARG 146 Ca -0.04 0.02 -0.07 0.00 -0.50 0.00 0.00 59.98 59.40 1br4 h ARG 146 Cb 0.12 0.08 -0.01 0.00 0.00 0.00 0.00 29.97 30.16 1br4 h ARG 146 CO 0.02 -0.02 -0.50 1.12 0.00 0.00 0.00 179.97 180.59 1br4 h HIS 147 N -0.85 0.00 0.00 3.04 2.07 -1.99 -3.32 115.15 114.11 1br4 h HIS 147 Ca -0.04 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.48 1br4 h HIS 147 Cb 0.52 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.50 1br4 h HIS 147 CO 0.04 0.32 0.00 0.39 -3.07 0.00 0.00 177.93 175.61 1br4 n GLU 148 N -3.10 0.38 0.00 5.12 1.02 -1.25 -4.71 120.64 118.10 1br4 n GLU 148 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1br4 n GLU 148 Cb 0.67 -1.19 0.00 0.00 -0.02 0.00 0.00 31.44 30.90 1br4 n GLU 148 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1br4 n MET 149 N 0.29 0.00 -2.44 3.49 2.81 -1.25 -4.72 117.12 115.29 1br4 n MET 149 Ca 0.00 0.00 -0.31 0.00 -1.81 0.00 0.00 57.70 55.58 1br4 n MET 149 Cb 0.09 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.58 1br4 n MET 149 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1br4 s PRO 150 N -2.00 3.79 0.08 0.03 0.04 -1.26 -4.91 135.00 130.77 1br4 s PRO 150 Ca 0.00 0.71 -0.34 0.00 0.04 0.00 0.00 61.00 61.41 1br4 s PRO 150 Cb 0.00 -2.22 -0.13 0.00 0.04 0.00 0.00 34.50 32.19 1br4 s PRO 150 CO 0.00 -0.26 1.71 -2.30 0.04 0.00 0.00 177.00 176.19 1br4 n PRO 151 N -1.80 2.24 -3.50 0.56 -0.01 -1.26 -4.87 135.00 126.35 1br4 n PRO 151 Ca 0.05 0.81 -0.15 0.00 -0.01 0.00 0.00 63.50 64.20 1br4 n PRO 151 Cb 0.54 -2.62 -0.05 0.00 -0.01 0.00 0.00 33.50 31.36 1br4 n PRO 151 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 175.50 173.91 1br4 s HIS 152 N 2.12 -0.57 0.27 6.00 2.46 -1.26 -4.71 115.29 119.60 1br4 s HIS 152 Ca 0.83 0.82 -0.00 0.00 0.47 0.00 0.00 55.06 57.18 1br4 s HIS 152 Cb -0.66 0.46 0.50 0.00 -0.13 0.00 0.00 32.58 32.75 1br4 s HIS 152 CO 0.42 -0.62 1.84 0.97 -2.47 0.00 0.00 174.74 174.88 1br4 h ILE 153 N 2.65 0.95 0.00 0.89 6.09 -1.96 0.39 117.51 126.52 1br4 h ILE 153 Ca -0.27 -0.34 -0.03 0.00 -1.37 0.00 0.00 64.86 62.85 1br4 h ILE 153 Cb 1.19 -0.13 -0.00 0.00 0.47 0.00 0.00 36.82 38.34 1br4 h ILE 153 CO 0.37 0.18 -0.12 1.88 -3.07 0.00 0.00 178.15 177.39 1br4 h TYR 154 N 0.99 0.00 -0.04 2.19 0.05 -1.95 -2.23 116.97 115.98 1br4 h TYR 154 Ca 0.47 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.24 1br4 h TYR 154 Cb 0.41 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.15 1br4 h TYR 154 CO -0.01 0.12 0.00 0.00 -1.05 0.00 0.00 178.16 177.22 1br4 h ALA 155 N 1.88 0.06 -0.51 3.88 0.00 -0.57 -2.52 119.26 121.47 1br4 h ALA 155 Ca -0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1br4 h ALA 155 Cb 0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1br4 h ALA 155 CO 0.02 -0.28 0.02 0.82 0.00 0.00 0.00 179.25 179.83 1br4 h ILE 156 N -0.21 1.24 -0.37 0.00 5.03 -1.02 -1.58 117.51 120.61 1br4 h ILE 156 Ca 0.01 -1.00 0.02 0.00 -0.12 0.00 0.00 64.86 63.77 1br4 h ILE 156 Cb 0.31 0.83 -0.03 0.00 -3.03 0.00 0.00 36.82 34.91 1br4 h ILE 156 CO 0.00 0.36 0.21 0.00 -0.68 0.00 0.00 178.15 178.04 1br4 h ALA 157 N 1.23 0.47 -0.23 1.87 0.00 -1.36 -0.48 119.26 120.76 1br4 h ALA 157 Ca 0.16 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.86 1br4 h ALA 157 Cb 0.44 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1br4 h ALA 157 CO 0.02 -0.14 -0.63 0.22 0.00 0.00 0.00 179.25 178.72 1br4 h ASP 158 N 0.43 0.94 -0.59 0.00 3.58 -1.29 -1.71 116.42 117.77 1br4 h ASP 158 Ca 0.15 -0.54 -0.01 0.00 0.42 0.00 0.00 57.03 57.05 1br4 h ASP 158 Cb 0.02 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 40.77 1br4 h ASP 158 CO -0.08 1.34 0.34 0.74 -2.88 0.00 0.00 179.24 178.70 1br4 h THR 159 N 0.61 1.18 -0.25 2.25 2.02 -1.11 -0.98 112.91 116.64 1br4 h THR 159 Ca -0.01 -0.44 -0.06 0.00 0.77 0.00 0.00 66.41 66.66 1br4 h THR 159 Cb 1.24 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 1br4 h THR 159 CO 0.13 0.20 -0.09 0.00 0.37 0.00 0.00 175.52 176.13 1br4 h ALA 160 N 1.16 0.34 -0.32 6.16 0.00 -1.09 -2.30 119.26 123.21 1br4 h ALA 160 Ca 0.21 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1br4 h ALA 160 Cb 0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1br4 h ALA 160 CO -0.04 0.17 0.18 -0.92 0.00 0.00 0.00 179.25 178.65 1br4 h TYR 161 N 0.23 0.43 0.00 0.00 3.20 -1.13 -2.08 116.97 117.62 1br4 h TYR 161 Ca 0.06 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.78 1br4 h TYR 161 Cb 0.57 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 1br4 h TYR 161 CO 0.06 0.33 -0.69 -0.09 -1.64 0.00 0.00 178.16 176.13 1br4 h ARG 162 N 0.40 0.00 -0.69 1.82 9.65 -1.24 -2.54 114.38 121.78 1br4 h ARG 162 Ca 0.11 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.99 1br4 h ARG 162 Cb 0.03 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 1br4 h ARG 162 CO -0.02 0.69 0.40 0.77 2.80 0.00 0.00 179.97 184.61 1br4 h SER 163 N 0.00 0.84 -0.09 -3.80 0.02 -1.21 0.13 113.55 109.44 1br4 h SER 163 Ca -0.01 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1br4 h SER 163 Cb 1.22 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 63.54 1br4 h SER 163 CO 0.09 0.67 0.03 -0.03 -1.14 0.00 0.00 176.83 176.45 1br4 h MET 164 N 0.94 0.13 0.00 3.45 1.85 -1.26 -1.68 114.93 118.37 1br4 h MET 164 Ca 0.25 -0.03 -0.05 0.00 -0.61 0.00 0.00 59.70 59.26 1br4 h MET 164 Cb -0.00 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.00 1br4 h MET 164 CO -0.04 0.26 -0.25 -0.07 -0.40 0.00 0.00 176.91 176.41 1br4 h LEU 165 N -0.02 0.00 0.02 3.39 3.38 -1.20 -1.37 115.31 119.50 1br4 h LEU 165 Ca 0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1br4 h LEU 165 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1br4 h LEU 165 CO -0.00 0.25 -0.01 1.56 0.09 0.00 0.00 178.44 180.33 1br4 h GLN 166 N 0.00 -0.03 -0.46 1.13 1.08 -0.56 -3.37 115.11 112.90 1br4 h GLN 166 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1br4 h GLN 166 Cb 0.46 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 1br4 h GLN 166 CO 0.03 -0.02 0.00 -0.40 -0.95 0.00 0.00 178.83 177.50 1br4 n ASP 167 N -2.77 1.72 -3.23 1.46 5.68 -0.65 -4.95 116.55 113.81 1br4 n ASP 167 Ca -0.00 -2.11 -0.22 0.00 -0.50 0.00 0.00 54.79 51.96 1br4 n ASP 167 Cb 0.01 -0.30 0.02 0.00 -1.14 0.00 0.00 41.12 39.71 1br4 n ASP 167 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1br4 n ARG 168 N 0.20 -1.15 -3.15 0.11 1.74 -0.53 -4.97 116.66 108.91 1br4 n ARG 168 Ca 0.08 1.07 0.04 0.00 -0.77 0.00 0.00 57.85 58.28 1br4 n ARG 168 Cb 0.33 -1.46 -0.00 0.00 -1.02 0.00 0.00 32.46 30.30 1br4 n ARG 168 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1br4 s GLU 169 N -1.73 0.43 0.47 5.56 2.12 -1.12 -5.06 118.70 119.37 1br4 s GLU 169 Ca 0.21 0.50 -0.20 0.00 0.36 0.00 0.00 54.97 55.85 1br4 s GLU 169 Cb -0.02 0.25 -0.14 0.00 0.26 0.00 0.00 34.13 34.48 1br4 s GLU 169 CO 0.48 -0.71 0.13 -0.25 -0.54 0.00 0.00 175.26 174.36 1br4 n ASP 170 N 5.35 -2.65 -4.51 -1.70 8.00 -1.26 -4.47 116.55 115.31 1br4 n ASP 170 Ca 0.04 0.76 -0.24 0.00 0.71 0.00 0.00 54.79 56.06 1br4 n ASP 170 Cb 0.54 -0.94 -0.11 0.00 -0.02 0.00 0.00 41.12 40.60 1br4 n ASP 170 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1br4 s GLN 171 N -1.23 1.77 -0.13 -1.24 -1.52 -1.14 -1.80 119.66 114.37 1br4 s GLN 171 Ca 0.60 -1.99 -0.08 0.00 -1.95 0.00 0.00 55.36 51.94 1br4 s GLN 171 Cb -0.55 -1.16 0.05 0.00 -0.22 0.00 0.00 33.01 31.13 1br4 s GLN 171 CO 0.62 -0.14 0.31 -1.54 -0.25 0.00 0.00 175.29 174.29 1br4 s SER 172 N -3.57 -0.35 -0.24 5.90 1.04 0.67 0.40 113.70 117.55 1br4 s SER 172 Ca 0.36 0.65 -0.02 0.00 0.48 0.00 0.00 55.95 57.42 1br4 s SER 172 Cb 0.09 0.56 0.02 0.00 0.10 0.00 0.00 66.02 66.79 1br4 s SER 172 CO 0.16 -0.16 -0.07 -0.63 0.98 0.00 0.00 173.24 173.52 1br4 s ILE 173 N 1.05 2.89 -0.21 -1.02 1.01 0.40 0.18 121.20 125.50 1br4 s ILE 173 Ca -0.07 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.68 1br4 s ILE 173 Cb -0.08 -2.41 0.03 0.00 0.01 0.00 0.00 42.46 40.01 1br4 s ILE 173 CO -0.08 0.28 -0.16 -0.76 0.00 0.00 0.00 174.94 174.22 1br4 s LEU 174 N 1.35 2.55 -0.32 2.97 1.43 0.34 -2.59 118.68 124.40 1br4 s LEU 174 Ca 0.02 -0.80 -0.23 0.00 -1.03 0.00 0.00 54.13 52.09 1br4 s LEU 174 Cb -0.16 -1.53 0.00 0.00 0.03 0.00 0.00 46.19 44.54 1br4 s LEU 174 CO -0.05 -0.05 0.75 0.00 0.23 0.00 0.00 176.35 177.23 1br4 n THR 176 N 5.58 0.00 0.00 0.00 -2.24 -1.00 -4.80 114.28 111.82 1br4 n THR 176 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1br4 n THR 176 Cb 0.48 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1br4 n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1br4 n GLY 177 N 5.00 -1.67 3.90 3.38 0.00 -1.25 -4.13 105.19 110.42 1br4 n GLY 177 Ca 0.00 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.25 1br4 n GLY 177 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1br4 s GLU 178 N -3.38 2.27 -0.03 1.61 -1.05 -1.26 -4.48 118.70 112.38 1br4 s GLU 178 Ca 0.00 0.16 -0.34 0.00 -0.15 0.00 0.00 54.97 54.65 1br4 s GLU 178 Cb 0.00 -2.01 -0.12 0.00 -0.44 0.00 0.00 34.13 31.57 1br4 s GLU 178 CO 0.00 -1.37 1.84 0.45 0.95 0.00 0.00 175.26 177.13 1br4 n SER 179 N -3.16 3.50 0.00 0.83 2.88 -1.25 -2.18 113.62 114.23 1br4 n SER 179 Ca 0.08 0.98 0.00 0.00 -1.33 0.00 0.00 58.87 58.60 1br4 n SER 179 Cb 0.60 -1.40 0.00 0.00 -0.75 0.00 0.00 64.21 62.65 1br4 n SER 179 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1br4 n GLY 180 N 4.26 1.40 0.21 0.46 0.00 -1.26 -4.98 105.19 105.29 1br4 n GLY 180 Ca 0.21 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.38 1br4 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1br4 h ALA 181 N 0.00 1.00 0.00 4.61 0.00 -1.79 -3.47 119.26 119.62 1br4 h ALA 181 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1br4 h ALA 181 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1br4 h ALA 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1br4 n GLY 182 N 0.49 1.19 0.00 0.00 0.00 -1.26 -4.31 105.19 101.30 1br4 n GLY 182 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1br4 n GLY 182 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1br4 n LYS 183 N 0.00 0.00 0.00 1.61 4.01 -1.26 -0.87 118.16 121.64 1br4 n LYS 183 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 1br4 n LYS 183 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 1br4 n LYS 183 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 1br4 n THR 184 N -1.08 0.00 -0.27 -0.18 -1.04 -1.26 -2.92 114.28 107.53 1br4 n THR 184 Ca 0.00 1.37 0.13 0.00 -2.04 0.00 0.00 64.05 63.51 1br4 n THR 184 Cb 0.00 -2.25 0.25 0.00 -1.82 0.00 0.00 70.33 66.51 1br4 n THR 184 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1br4 n GLU 185 N -1.81 -0.06 -0.10 -2.82 -0.58 -0.05 0.20 120.64 115.41 1br4 n GLU 185 Ca 0.00 1.18 0.00 0.00 -0.42 0.00 0.00 57.16 57.92 1br4 n GLU 185 Cb 0.00 -1.89 0.28 0.00 -0.57 0.00 0.00 31.44 29.26 1br4 n GLU 185 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 1br4 h ASN 186 N 0.00 0.68 -0.31 1.62 -0.26 -1.57 -0.69 115.58 115.04 1br4 h ASN 186 Ca 0.49 -0.07 -0.12 0.00 -0.56 0.00 0.00 56.30 56.04 1br4 h ASN 186 Cb 1.04 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 38.13 1br4 h ASN 186 CO -0.74 0.59 -0.29 0.74 -1.06 0.00 0.00 177.43 176.67 1br4 h THR 187 N 0.76 1.29 -0.84 2.81 2.02 0.24 -2.36 112.91 116.84 1br4 h THR 187 Ca 0.19 -1.45 -0.03 0.00 0.77 0.00 0.00 66.41 65.88 1br4 h THR 187 Cb 0.09 1.52 -0.04 0.00 -1.74 0.00 0.00 68.15 67.99 1br4 h THR 187 CO -0.02 0.47 0.39 0.11 0.37 0.00 0.00 175.52 176.84 1br4 h LYS 188 N 0.51 1.21 -0.64 6.66 1.57 -0.68 -1.46 116.57 123.74 1br4 h LYS 188 Ca 0.05 -0.18 -0.08 0.00 -1.87 0.00 0.00 60.65 58.57 1br4 h LYS 188 Cb 0.86 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.93 1br4 h LYS 188 CO 0.07 0.94 0.10 0.87 -0.57 0.00 0.00 179.45 180.86 1br4 h LYS 189 N 1.20 1.07 -0.67 3.15 1.79 -1.08 0.20 116.57 122.23 1br4 h LYS 189 Ca 0.29 -0.29 -0.06 0.00 -2.18 0.00 0.00 60.65 58.40 1br4 h LYS 189 Cb 0.13 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.63 1br4 h LYS 189 CO -0.03 0.99 0.17 0.28 -1.08 0.00 0.00 179.45 179.78 1br4 h VAL 190 N 0.98 1.25 -0.02 0.50 2.07 -1.02 -1.34 116.25 118.67 1br4 h VAL 190 Ca 0.19 -0.93 -0.18 0.00 0.82 0.00 0.00 66.70 66.61 1br4 h VAL 190 Cb 0.45 0.55 0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1br4 h VAL 190 CO 0.01 0.36 -0.70 0.40 0.02 0.00 0.00 177.57 177.66 1br4 h ILE 191 N 1.01 1.38 -0.97 4.57 2.04 -1.01 -2.49 117.51 122.03 1br4 h ILE 191 Ca 0.21 -2.07 0.04 0.00 1.00 0.00 0.00 64.86 64.05 1br4 h ILE 191 Cb 0.34 2.45 -0.06 0.00 -0.74 0.00 0.00 36.82 38.82 1br4 h ILE 191 CO -0.00 0.62 0.63 -0.61 0.00 0.00 0.00 178.15 178.79 1br4 h GLN 192 N 0.08 1.17 -0.16 2.37 4.15 -0.50 0.92 115.11 123.14 1br4 h GLN 192 Ca -0.08 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.21 1br4 h GLN 192 Cb 1.38 -0.26 -0.00 0.00 0.21 0.00 0.00 27.48 28.80 1br4 h GLN 192 CO 0.14 0.77 -0.14 -0.92 -1.93 0.00 0.00 178.83 176.75 1br4 h TYR 193 N 1.20 0.45 -0.02 3.99 5.03 -1.29 -3.20 116.97 123.13 1br4 h TYR 193 Ca 0.39 -0.13 -0.10 0.00 2.58 0.00 0.00 58.73 61.47 1br4 h TYR 193 Cb 0.04 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.21 1br4 h TYR 193 CO -0.01 0.75 -0.47 -0.07 -1.32 0.00 0.00 178.16 177.04 1br4 h LEU 194 N 0.02 0.06 -2.17 2.82 3.38 -1.17 0.15 115.31 118.39 1br4 h LEU 194 Ca 0.03 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1br4 h LEU 194 Cb 0.66 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1br4 h LEU 194 CO 0.04 0.53 -0.03 0.00 0.09 0.00 0.00 178.44 179.06 1br4 h ALA 195 N 1.48 1.69 0.00 1.53 0.00 -0.81 -2.09 119.26 121.05 1br4 h ALA 195 Ca -0.00 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1br4 h ALA 195 Cb 0.86 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1br4 h ALA 195 CO 0.06 0.04 -1.52 1.33 0.00 0.00 0.00 179.25 179.16 1br4 n VAL 196 N -4.12 0.46 1.52 0.00 0.24 -1.10 -3.93 118.33 111.40 1br4 n VAL 196 Ca -0.03 -0.31 0.15 0.00 -2.04 0.00 0.00 64.34 62.11 1br4 n VAL 196 Cb 0.11 -0.62 0.70 0.00 -1.47 0.00 0.00 33.84 32.57 1br4 n VAL 196 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1br4 n VAL 197 N -2.22 0.00 -1.15 3.34 0.31 0.52 -3.76 118.33 115.37 1br4 n VAL 197 Ca -0.11 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1br4 n VAL 197 Cb 0.67 -0.23 0.00 0.00 -0.91 0.00 0.00 33.84 33.37 1br4 n VAL 197 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1br4 n ALA 198 N -0.98 1.04 -1.48 3.52 0.00 -0.79 -5.00 120.51 116.83 1br4 n ALA 198 Ca 0.16 -0.46 -0.29 0.00 0.00 0.00 0.00 53.44 52.85 1br4 n ALA 198 Cb 0.24 -0.02 0.14 0.00 0.00 0.00 0.00 19.45 19.81 1br4 n ALA 198 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1br4 s SER 199 N -0.04 3.41 -0.28 0.00 0.01 -1.25 -2.79 113.70 112.77 1br4 s SER 199 Ca 0.00 1.02 0.20 0.00 1.31 0.00 0.00 55.95 58.48 1br4 s SER 199 Cb 0.00 -1.62 0.48 0.00 0.21 0.00 0.00 66.02 65.09 1br4 s SER 199 CO 0.00 -2.62 1.22 -1.20 0.41 0.00 0.00 173.24 171.06 1br4 n SER 200 N -3.82 0.73 0.00 2.44 7.64 -1.26 -4.93 113.62 114.42 1br4 n SER 200 Ca 0.06 -2.10 0.00 0.00 1.01 0.00 0.00 58.87 57.84 1br4 n SER 200 Cb 0.59 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.63 1br4 n SER 200 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1br4 n PRO 213 N -0.84 0.00 -2.47 1.43 -0.02 -1.26 -4.97 135.00 126.87 1br4 n PRO 213 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.06 1br4 n PRO 213 Cb 0.82 -0.08 -0.03 0.00 -0.02 0.00 0.00 33.50 34.19 1br4 n PRO 213 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1br4 s SER 214 N -1.11 7.10 -0.04 2.55 0.15 -1.26 -4.88 113.70 116.22 1br4 s SER 214 Ca 0.00 1.90 -0.30 0.00 0.70 0.00 0.00 55.95 58.26 1br4 s SER 214 Cb 0.00 -2.57 0.08 0.00 -1.71 0.00 0.00 66.02 61.82 1br4 s SER 214 CO 0.00 -0.48 0.73 0.12 1.20 0.00 0.00 173.24 174.81 1br4 s PHE 215 N 1.45 -0.58 -1.15 3.44 2.19 -1.26 -5.04 117.98 117.02 1br4 s PHE 215 Ca 0.57 0.90 -0.14 0.00 0.33 0.00 0.00 56.93 58.59 1br4 s PHE 215 Cb -0.27 0.44 0.18 0.00 -1.31 0.00 0.00 43.02 42.07 1br4 s PHE 215 CO 0.27 -0.59 1.34 -1.12 1.83 0.00 0.00 175.22 176.94 1br4 s SER 216 N -1.44 7.05 1.03 6.13 0.01 -1.26 -5.04 113.70 120.17 1br4 s SER 216 Ca -0.07 -2.96 -0.07 0.00 1.31 0.00 0.00 55.95 54.16 1br4 s SER 216 Cb -0.00 -2.37 0.10 0.00 0.21 0.00 0.00 66.02 63.96 1br4 s SER 216 CO 0.05 -0.72 0.53 -1.22 0.41 0.00 0.00 173.24 172.29 1br4 n TYR 217 N 5.32 -3.83 -0.27 2.43 4.02 -1.26 -5.07 117.16 118.50 1br4 n TYR 217 Ca 0.33 -0.48 0.00 0.00 -0.01 0.00 0.00 57.90 57.74 1br4 n TYR 217 Cb 0.43 -0.45 0.00 0.00 -0.02 0.00 0.00 39.34 39.30 1br4 n TYR 217 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1br4 n GLY 218 N 0.80 -2.16 0.13 2.72 0.00 -1.26 -4.88 105.19 100.54 1br4 n GLY 218 Ca 0.07 -1.45 -0.22 0.00 0.00 0.00 0.00 46.02 44.42 1br4 n GLY 218 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1br4 h GLU 219 N 0.00 0.26 0.01 1.61 4.39 -1.99 -3.22 114.58 115.64 1br4 h GLU 219 Ca 0.00 -0.44 -0.20 0.00 0.34 0.00 0.00 59.36 59.07 1br4 h GLU 219 Cb 0.00 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 1br4 h GLU 219 CO 0.00 1.21 -0.88 1.37 -1.16 0.00 0.00 179.01 179.55 1br4 h LEU 220 N -0.10 0.19 -1.51 1.33 8.10 -1.95 -2.88 115.31 118.48 1br4 h LEU 220 Ca -0.39 -0.16 -0.05 0.00 0.11 0.00 0.00 57.88 57.39 1br4 h LEU 220 Cb 1.93 -0.06 -0.01 0.00 -0.44 0.00 0.00 40.66 42.08 1br4 h LEU 220 CO 0.07 0.98 -0.25 -0.33 -4.11 0.00 0.00 178.44 174.79 1br4 h GLU 221 N 0.08 0.00 -0.38 0.17 3.07 -1.93 2.10 114.58 117.69 1br4 h GLU 221 Ca -0.04 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.73 1br4 h GLU 221 Cb 1.52 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.42 1br4 h GLU 221 CO 0.13 0.25 -0.15 0.87 -1.40 0.00 0.00 179.01 178.71 1br4 h LYS 222 N 0.00 0.69 0.08 2.33 1.57 -1.51 -2.58 116.57 117.14 1br4 h LYS 222 Ca -0.00 -0.24 -0.28 0.00 -1.87 0.00 0.00 60.65 58.26 1br4 h LYS 222 Cb 0.50 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1br4 h LYS 222 CO 0.03 0.81 -1.52 1.96 -0.57 0.00 0.00 179.45 180.16 1br4 h GLN 223 N 0.62 0.16 0.00 3.15 4.20 -1.22 -3.29 115.11 118.72 1br4 h GLN 223 Ca 0.10 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1br4 h GLN 223 Cb 0.61 0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.49 1br4 h GLN 223 CO 0.04 1.13 0.44 1.25 -0.67 0.00 0.00 178.83 181.02 1br4 h LEU 224 N -0.44 0.00 0.00 1.46 5.85 0.34 2.68 115.31 125.20 1br4 h LEU 224 Ca -0.35 0.00 -0.24 0.00 0.84 0.00 0.00 57.88 58.12 1br4 h LEU 224 Cb 1.68 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.67 1br4 h LEU 224 CO -0.03 0.00 -1.46 -0.07 -0.34 0.00 0.00 178.44 176.54 1br4 h LEU 225 N 0.00 0.00 -3.16 2.25 4.07 -1.53 -3.33 115.31 113.61 1br4 h LEU 225 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1br4 h LEU 225 Cb 0.87 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.61 1br4 h LEU 225 CO 0.00 0.89 0.00 0.00 -1.08 0.00 0.00 178.44 178.25 1br4 n GLN 226 N -3.08 4.29 0.03 1.13 3.00 0.89 -4.45 117.38 119.19 1br4 n GLN 226 Ca -0.11 -2.69 -0.05 0.00 -0.01 0.00 0.00 57.00 54.14 1br4 n GLN 226 Cb 0.97 -2.14 -0.03 0.00 0.00 0.00 0.00 30.24 29.05 1br4 n GLN 226 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1br4 h ALA 227 N 3.74 -0.18 0.00 -1.58 0.00 -1.53 -3.36 119.26 116.36 1br4 h ALA 227 Ca 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1br4 h ALA 227 Cb 1.74 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.60 1br4 h ALA 227 CO 0.41 -0.17 -0.09 -0.91 0.00 0.00 0.00 179.25 178.48 1br4 h ASN 228 N -1.03 0.00 0.40 0.00 2.35 -1.84 -2.91 115.58 112.55 1br4 h ASN 228 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1br4 h ASN 228 Cb 0.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1br4 h ASN 228 CO 0.03 0.09 0.00 -0.81 -1.65 0.00 0.00 177.43 175.09 1br4 n PRO 229 N -3.21 0.28 -0.12 0.81 -0.04 -1.26 -2.19 135.00 129.28 1br4 n PRO 229 Ca 0.01 0.10 -0.20 0.00 -0.04 0.00 0.00 63.50 63.36 1br4 n PRO 229 Cb 0.39 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.28 1br4 n PRO 229 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1br4 n ILE 230 N -1.29 1.51 0.26 0.52 5.41 -1.11 -4.07 119.36 120.60 1br4 n ILE 230 Ca 0.09 -0.14 0.15 0.00 1.00 0.00 0.00 62.75 63.86 1br4 n ILE 230 Cb 0.17 -2.10 0.77 0.00 -0.71 0.00 0.00 39.64 37.77 1br4 n ILE 230 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1br4 h LEU 231 N -1.00 0.00 0.12 1.39 3.38 -1.56 -0.15 115.31 117.48 1br4 h LEU 231 Ca -0.38 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.32 1br4 h LEU 231 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1br4 h LEU 231 CO -0.23 0.00 -1.25 -0.33 0.09 0.00 0.00 178.44 176.72 1br4 h GLU 232 N 0.00 0.25 0.00 1.13 5.08 -1.65 -3.26 114.58 116.13 1br4 h GLU 232 Ca 0.00 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1br4 h GLU 232 Cb 0.11 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1br4 h GLU 232 CO 0.00 1.19 0.00 0.00 -1.00 0.00 0.00 179.01 179.20 1br4 n ALA 233 N -2.53 0.00 -2.87 3.43 0.00 -0.07 -0.67 120.51 117.80 1br4 n ALA 233 Ca -0.08 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 52.92 1br4 n ALA 233 Cb 1.02 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.45 1br4 n ALA 233 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1br4 s PHE 234 N 0.00 3.12 0.00 0.00 -0.12 -1.23 -3.14 117.98 116.60 1br4 s PHE 234 Ca 0.00 -1.50 0.00 0.00 -0.05 0.00 0.00 56.93 55.38 1br4 s PHE 234 Cb 0.00 -4.36 0.00 0.00 -0.63 0.00 0.00 43.02 38.03 1br4 s PHE 234 CO 0.00 -1.53 0.00 0.41 -0.05 0.00 0.00 175.22 174.05 1br4 n GLY 235 N 5.36 0.88 3.79 1.99 0.00 -1.23 -4.87 105.19 111.11 1br4 n GLY 235 Ca 0.29 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 1br4 n GLY 235 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1br4 s ASN 236 N 0.00 5.78 0.01 1.61 -0.87 0.16 -2.37 114.94 119.26 1br4 s ASN 236 Ca 0.00 0.24 -0.28 0.00 -1.57 0.00 0.00 52.86 51.25 1br4 s ASN 236 Cb 0.00 -1.72 0.07 0.00 -0.02 0.00 0.00 41.25 39.58 1br4 s ASN 236 CO 0.00 0.33 0.64 0.00 -2.57 0.00 0.00 177.10 175.50 1br4 s ALA 237 N -1.08 -1.67 0.01 0.60 0.00 -0.15 -2.90 121.76 116.57 1br4 s ALA 237 Ca 0.19 1.02 -0.30 0.00 0.00 0.00 0.00 51.96 52.87 1br4 s ALA 237 Cb -0.12 0.27 -0.07 0.00 0.00 0.00 0.00 23.12 23.20 1br4 s ALA 237 CO 0.09 -0.49 1.70 0.21 0.00 0.00 0.00 175.76 177.27 1br4 s LYS 238 N -1.98 4.18 0.36 0.00 2.20 -1.15 -1.97 119.74 121.39 1br4 s LYS 238 Ca -0.07 2.31 0.00 0.00 -0.36 0.00 0.00 55.97 57.85 1br4 s LYS 238 Cb -0.00 -3.87 -0.00 0.00 -1.51 0.00 0.00 37.83 32.44 1br4 s LYS 238 CO 0.03 -0.82 0.00 0.25 -0.36 0.00 0.00 175.35 174.45 1br4 n THR 239 N 5.21 0.00 0.49 3.43 -2.24 0.64 -2.47 114.28 119.34 1br4 n THR 239 Ca 0.17 -1.72 -0.03 0.00 -2.27 0.00 0.00 64.05 60.20 1br4 n THR 239 Cb 0.42 0.35 0.06 0.00 -2.10 0.00 0.00 70.33 69.06 1br4 n THR 239 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1br4 n VAL 240 N -0.90 1.22 -1.92 2.28 0.24 -1.26 -3.16 118.33 114.82 1br4 n VAL 240 Ca -0.15 -0.42 -0.03 0.00 -2.04 0.00 0.00 64.34 61.71 1br4 n VAL 240 Cb 0.46 -0.71 -0.03 0.00 -1.47 0.00 0.00 33.84 32.09 1br4 n VAL 240 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1br4 n LYS 241 N 0.12 0.00 0.00 7.34 2.85 -1.26 -5.07 118.16 122.13 1br4 n LYS 241 Ca 0.12 -0.38 0.00 0.00 -1.05 0.00 0.00 58.31 57.00 1br4 n LYS 241 Cb 0.67 0.21 0.00 0.00 -0.65 0.00 0.00 35.03 35.26 1br4 n LYS 241 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1br4 n ASN 242 N 0.00 0.00 -0.00 -5.58 2.85 -1.19 -4.18 115.26 107.16 1br4 n ASN 242 Ca -0.11 0.00 0.16 0.00 -0.11 0.00 0.00 54.58 54.52 1br4 n ASN 242 Cb 0.54 0.00 0.62 0.00 1.24 0.00 0.00 39.78 42.17 1br4 n ASN 242 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 1br4 h ASP 243 N 0.00 0.13 -2.33 1.20 3.32 -1.90 0.18 116.42 117.03 1br4 h ASP 243 Ca 0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 1br4 h ASP 243 Cb 0.00 -0.02 -0.37 0.00 0.22 0.00 0.00 39.33 39.16 1br4 h ASP 243 CO 0.00 0.08 -0.92 0.21 -1.72 0.00 0.00 179.24 176.88 1br4 s ASN 244 N -6.31 1.57 -0.04 6.45 2.47 -1.26 -2.92 114.94 114.90 1br4 s ASN 244 Ca -0.06 -2.79 -0.20 0.00 0.42 0.00 0.00 52.86 50.23 1br4 s ASN 244 Cb 0.19 -0.29 -0.05 0.00 -1.45 0.00 0.00 41.25 39.65 1br4 s ASN 244 CO 0.73 -0.20 0.56 -0.55 -3.72 0.00 0.00 177.10 173.92 1br4 s SER 245 N 0.34 6.89 -0.58 -4.21 0.15 -0.83 -4.82 113.70 110.63 1br4 s SER 245 Ca 0.29 1.06 -0.27 0.00 0.70 0.00 0.00 55.95 57.74 1br4 s SER 245 Cb -0.02 -2.34 -0.02 0.00 -1.71 0.00 0.00 66.02 61.93 1br4 s SER 245 CO -0.15 0.08 1.87 -0.44 1.20 0.00 0.00 173.24 175.81 1br4 s SER 246 N 0.01 5.29 -0.19 5.45 0.01 -1.26 -0.97 113.70 122.03 1br4 s SER 246 Ca 0.30 0.44 -0.00 0.00 1.31 0.00 0.00 55.95 57.99 1br4 s SER 246 Cb -0.17 -2.53 0.14 0.00 0.21 0.00 0.00 66.02 63.67 1br4 s SER 246 CO 0.15 -2.34 1.97 -1.14 0.41 0.00 0.00 173.24 172.29 1br4 n ARG 247 N 9.11 1.49 -3.56 12.44 3.00 -1.00 -4.85 116.66 133.30 1br4 n ARG 247 Ca 0.21 -0.96 0.04 0.00 -0.00 0.00 0.00 57.85 57.14 1br4 n ARG 247 Cb 0.52 -1.38 -0.00 0.00 0.00 0.00 0.00 32.46 31.60 1br4 n ARG 247 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.63 177.04 1br4 s PHE 248 N -1.11 -0.00 0.36 -0.14 -0.71 -1.26 -2.78 117.98 112.34 1br4 s PHE 248 Ca 0.19 -0.00 -0.15 0.00 -1.04 0.00 0.00 56.93 55.93 1br4 s PHE 248 Cb 0.15 0.50 -0.09 0.00 -1.21 0.00 0.00 43.02 42.37 1br4 s PHE 248 CO -0.00 -0.01 0.78 0.20 -1.34 0.00 0.00 175.22 174.85 1br4 s GLY 249 N -2.95 2.26 -0.10 1.99 0.00 0.81 -4.44 107.32 104.90 1br4 s GLY 249 Ca 0.15 0.05 -0.06 0.00 0.00 0.00 0.00 44.72 44.86 1br4 s GLY 249 CO -0.07 0.27 0.25 1.25 0.00 0.00 0.00 173.10 174.80 1br4 s LYS 250 N -3.20 0.24 -0.36 2.90 2.20 0.14 -0.99 119.74 120.67 1br4 s LYS 250 Ca 0.55 0.46 -0.00 0.00 -0.36 0.00 0.00 55.97 56.62 1br4 s LYS 250 Cb -0.10 -0.02 0.13 0.00 -1.51 0.00 0.00 37.83 36.33 1br4 s LYS 250 CO 0.20 -0.11 0.20 0.12 -0.36 0.00 0.00 175.35 175.39 1br4 s PHE 251 N 0.84 0.99 -0.01 4.03 2.19 -1.19 0.19 117.98 125.01 1br4 s PHE 251 Ca -0.06 -1.71 -0.27 0.00 0.33 0.00 0.00 56.93 55.22 1br4 s PHE 251 Cb -0.07 -1.15 -0.04 0.00 -1.31 0.00 0.00 43.02 40.45 1br4 s PHE 251 CO -0.05 -0.82 0.84 0.42 1.83 0.00 0.00 175.22 177.44 1br4 s ILE 252 N 1.06 4.89 -0.19 3.12 1.09 -0.57 -2.38 121.20 128.21 1br4 s ILE 252 Ca 0.17 1.77 0.01 0.00 -1.10 0.00 0.00 60.65 61.49 1br4 s ILE 252 Cb -0.22 -4.18 0.04 0.00 -1.06 0.00 0.00 42.46 37.03 1br4 s ILE 252 CO -0.04 0.24 -0.10 -0.60 -0.10 0.00 0.00 174.94 174.33 1br4 s ARG 253 N 0.71 1.97 -0.14 2.79 3.52 0.44 -0.11 118.95 128.13 1br4 s ARG 253 Ca 0.44 -0.80 -0.11 0.00 -0.13 0.00 0.00 55.73 55.13 1br4 s ARG 253 Cb -0.20 -2.37 -0.05 0.00 -1.56 0.00 0.00 34.95 30.78 1br4 s ARG 253 CO 0.24 -0.43 0.22 0.42 -0.81 0.00 0.00 175.30 174.94 1br4 s ILE 254 N 1.42 5.35 -0.32 4.11 1.09 0.31 -0.41 121.20 132.75 1br4 s ILE 254 Ca -0.01 0.40 -0.09 0.00 -1.10 0.00 0.00 60.65 59.85 1br4 s ILE 254 Cb -0.16 -3.54 0.01 0.00 -1.06 0.00 0.00 42.46 37.71 1br4 s ILE 254 CO -0.08 0.48 0.14 0.20 -0.10 0.00 0.00 174.94 175.58 1br4 s ASN 255 N -0.09 5.45 0.33 3.58 0.01 0.86 0.28 114.94 125.36 1br4 s ASN 255 Ca 0.15 -0.75 -0.01 0.00 -0.71 0.00 0.00 52.86 51.54 1br4 s ASN 255 Cb -0.13 -1.96 -0.04 0.00 0.41 0.00 0.00 41.25 39.54 1br4 s ASN 255 CO 0.03 -0.25 0.55 -0.36 -1.51 0.00 0.00 177.10 175.56 1br4 s PHE 256 N 1.55 3.50 0.00 2.20 0.08 -0.01 -1.69 117.98 123.60 1br4 s PHE 256 Ca 0.03 0.42 0.00 0.00 0.12 0.00 0.00 56.93 57.50 1br4 s PHE 256 Cb -0.18 -1.95 0.00 0.00 -0.57 0.00 0.00 43.02 40.32 1br4 s PHE 256 CO 0.05 0.13 0.00 -0.40 -0.10 0.00 0.00 175.22 174.90 1br4 n ASP 257 N -1.58 0.00 0.00 1.36 5.75 -0.20 -2.62 116.55 119.26 1br4 n ASP 257 Ca -0.04 -0.71 0.10 0.00 -0.01 0.00 0.00 54.79 54.13 1br4 n ASP 257 Cb 0.56 0.00 0.54 0.00 -1.03 0.00 0.00 41.12 41.19 1br4 n ASP 257 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 1br4 n VAL 258 N -0.86 0.20 -1.78 2.12 0.24 -1.26 -2.35 118.33 114.63 1br4 n VAL 258 Ca 0.00 0.05 -0.05 0.00 -2.04 0.00 0.00 64.34 62.30 1br4 n VAL 258 Cb 0.00 -0.73 0.14 0.00 -1.47 0.00 0.00 33.84 31.77 1br4 n VAL 258 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1br4 n THR 259 N -1.13 2.27 -2.37 3.34 -1.04 -1.26 -4.98 114.28 109.10 1br4 n THR 259 Ca 0.12 -3.55 -0.08 0.00 -2.04 0.00 0.00 64.05 58.51 1br4 n THR 259 Cb 0.11 -0.52 -0.01 0.00 -1.82 0.00 0.00 70.33 68.09 1br4 n THR 259 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1br4 n GLY 260 N -0.94 -0.41 3.72 3.41 0.00 -0.99 -4.95 105.19 105.03 1br4 n GLY 260 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.98 1br4 n GLY 260 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1br4 s TYR 261 N -2.34 3.13 0.40 1.61 2.02 -1.26 -4.80 117.35 116.10 1br4 s TYR 261 Ca 0.00 0.09 -0.25 0.00 -0.37 0.00 0.00 57.07 56.54 1br4 s TYR 261 Cb 0.00 -1.66 -0.09 0.00 -0.40 0.00 0.00 41.96 39.82 1br4 s TYR 261 CO 0.00 0.49 1.12 0.42 -1.57 0.00 0.00 175.55 176.02 1br4 s ILE 262 N -1.19 3.36 0.00 2.71 1.01 -1.12 -1.03 121.20 124.93 1br4 s ILE 262 Ca 0.23 1.10 0.00 0.00 0.00 0.00 0.00 60.65 61.98 1br4 s ILE 262 Cb -0.12 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.75 1br4 s ILE 262 CO 0.14 0.07 0.00 0.55 0.00 0.00 0.00 174.94 175.70 1br4 n VAL 263 N 0.04 0.00 -3.66 2.92 3.14 -0.68 -4.91 118.33 115.18 1br4 n VAL 263 Ca 0.04 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.32 1br4 n VAL 263 Cb 0.48 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 33.20 1br4 n VAL 263 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1br4 s GLY 264 N -0.56 -0.25 -0.18 7.55 0.00 -1.21 -4.73 107.32 107.94 1br4 s GLY 264 Ca 0.00 -0.03 -0.16 0.00 0.00 0.00 0.00 44.72 44.53 1br4 s GLY 264 CO 0.00 -0.28 0.47 0.00 0.00 0.00 0.00 173.10 173.29 1br4 s ALA 265 N -3.57 -1.17 0.02 3.20 0.00 1.16 -0.10 121.76 121.30 1br4 s ALA 265 Ca 0.02 1.35 0.01 0.00 0.00 0.00 0.00 51.96 53.34 1br4 s ALA 265 Cb 0.02 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 22.33 1br4 s ALA 265 CO -0.10 -0.23 -0.05 -0.80 0.00 0.00 0.00 175.76 174.58 1br4 s ASN 266 N 0.32 0.55 -0.07 0.00 -0.87 0.45 -3.87 114.94 111.45 1br4 s ASN 266 Ca -0.01 -0.36 0.03 0.00 -1.57 0.00 0.00 52.86 50.95 1br4 s ASN 266 Cb -0.04 0.02 0.01 0.00 -0.02 0.00 0.00 41.25 41.22 1br4 s ASN 266 CO -0.00 -0.14 -0.17 -0.63 -2.57 0.00 0.00 177.10 173.59 1br4 s ILE 267 N -0.93 1.46 -0.43 0.60 1.01 -1.26 0.17 121.20 121.83 1br4 s ILE 267 Ca -0.07 -0.68 -0.02 0.00 0.00 0.00 0.00 60.65 59.87 1br4 s ILE 267 Cb -0.07 -1.29 0.11 0.00 0.01 0.00 0.00 42.46 41.23 1br4 s ILE 267 CO -0.00 0.43 0.21 -0.70 0.00 0.00 0.00 174.94 174.88 1br4 s GLU 268 N 0.43 2.01 0.22 2.79 2.56 -1.00 -4.94 118.70 120.76 1br4 s GLU 268 Ca -0.13 -1.91 -0.30 0.00 0.00 0.00 0.00 54.97 52.63 1br4 s GLU 268 Cb -0.15 -3.56 -0.09 0.00 2.00 0.00 0.00 34.13 32.33 1br4 s GLU 268 CO 0.05 -1.07 1.23 -0.08 -0.56 0.00 0.00 175.26 174.83 1br4 s THR 269 N 0.98 3.36 0.01 -1.70 -1.32 -1.26 -3.14 115.64 112.57 1br4 s THR 269 Ca 0.09 1.18 0.03 0.00 -1.21 0.00 0.00 61.69 61.78 1br4 s THR 269 Cb -0.22 -3.75 -0.01 0.00 -1.51 0.00 0.00 72.50 67.00 1br4 s THR 269 CO -0.04 0.21 -0.09 -0.31 -2.21 0.00 0.00 174.62 172.17 1br4 s TYR 270 N -0.24 0.80 -0.73 9.09 1.51 -0.16 -4.94 117.35 122.68 1br4 s TYR 270 Ca 0.53 -0.24 -0.10 0.00 -1.01 0.00 0.00 57.07 56.25 1br4 s TYR 270 Cb -0.34 -0.50 0.01 0.00 -0.11 0.00 0.00 41.96 41.02 1br4 s TYR 270 CO 0.39 -0.01 0.62 1.28 -1.11 0.00 0.00 175.55 176.72 1br4 n LEU 271 N 2.44 -2.37 -4.55 -1.29 4.77 -1.26 0.28 117.00 115.02 1br4 n LEU 271 Ca -0.16 -0.71 -0.40 0.00 -0.03 0.00 0.00 56.01 54.72 1br4 n LEU 271 Cb 0.56 -1.73 -0.03 0.00 -2.33 0.00 0.00 43.42 39.89 1br4 n LEU 271 CO 0.24 0.17 1.32 -0.22 -1.33 0.00 0.00 177.39 177.57 1br4 s LEU 272 N -4.28 3.25 -0.53 2.23 2.96 -1.26 -4.13 118.68 116.91 1br4 s LEU 272 Ca 0.10 -0.48 -0.24 0.00 -0.22 0.00 0.00 54.13 53.28 1br4 s LEU 272 Cb -0.01 -2.56 -0.22 0.00 0.50 0.00 0.00 46.19 43.90 1br4 s LEU 272 CO 0.88 -1.94 1.82 1.21 -1.32 0.00 0.00 176.35 177.00 1br4 n GLU 273 N 9.22 1.04 0.21 1.98 2.13 -1.12 -4.55 120.64 129.57 1br4 n GLU 273 Ca 0.14 -1.58 0.09 0.00 0.66 0.00 0.00 57.16 56.48 1br4 n GLU 273 Cb 0.50 -2.78 0.40 0.00 0.27 0.00 0.00 31.44 29.83 1br4 n GLU 273 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 1br4 h LYS 274 N 8.52 0.00 0.00 5.31 5.09 -1.89 -3.24 116.57 130.35 1br4 h LYS 274 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.11 1br4 h LYS 274 Cb 0.67 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.00 1br4 h LYS 274 CO 1.98 0.24 0.32 0.43 -2.09 0.00 0.00 179.45 180.34 1br4 n SER 275 N -3.36 0.00 -0.19 7.07 7.64 -1.26 0.32 113.62 123.83 1br4 n SER 275 Ca 0.00 0.13 0.09 0.00 1.01 0.00 0.00 58.87 60.11 1br4 n SER 275 Cb 0.47 -0.13 -0.06 0.00 -1.01 0.00 0.00 64.21 63.47 1br4 n SER 275 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1br4 n ARG 276 N -1.10 1.13 0.21 1.43 1.85 -1.22 -4.33 116.66 114.63 1br4 n ARG 276 Ca 0.00 -0.41 0.06 0.00 -1.00 0.00 0.00 57.85 56.50 1br4 n ARG 276 Cb 0.32 -1.38 0.48 0.00 -1.05 0.00 0.00 32.46 30.83 1br4 n ARG 276 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1br4 h ALA 277 N 2.96 1.41 0.05 2.89 0.00 0.48 -3.08 119.26 123.97 1br4 h ALA 277 Ca 0.00 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.51 1br4 h ALA 277 Cb 0.54 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1br4 h ALA 277 CO 0.00 0.33 -0.86 -0.84 0.00 0.00 0.00 179.25 177.88 1br4 h ILE 278 N 0.00 1.29 -1.82 0.00 3.07 -1.75 -3.46 117.51 114.84 1br4 h ILE 278 Ca -0.00 -2.33 -0.20 0.00 1.55 0.00 0.00 64.86 63.87 1br4 h ILE 278 Cb 0.51 2.84 -0.30 0.00 -0.27 0.00 0.00 36.82 39.60 1br4 h ILE 278 CO 0.03 0.56 -0.54 -0.13 -1.05 0.00 0.00 178.15 177.03 1br4 s ARG 279 N -2.36 0.38 0.24 0.16 0.52 -1.21 -4.65 118.95 112.05 1br4 s ARG 279 Ca -0.22 0.17 -0.27 0.00 -0.52 0.00 0.00 55.73 54.89 1br4 s ARG 279 Cb 0.02 -0.40 -0.09 0.00 0.52 0.00 0.00 34.95 35.00 1br4 s ARG 279 CO 0.70 -0.95 0.89 -0.65 0.02 0.00 0.00 175.30 175.31 1br4 s GLN 280 N 2.51 4.70 1.15 3.54 1.11 -1.17 -4.74 119.66 126.76 1br4 s GLN 280 Ca 0.10 1.34 -0.18 0.00 0.01 0.00 0.00 55.36 56.63 1br4 s GLN 280 Cb -0.13 -3.15 0.28 0.00 -1.01 0.00 0.00 33.01 29.00 1br4 s GLN 280 CO -0.28 0.47 0.64 0.00 0.01 0.00 0.00 175.29 176.14 1br4 n ALA 281 N 1.26 -3.90 -2.00 6.09 0.00 -1.26 -4.68 120.51 116.02 1br4 n ALA 281 Ca -0.02 -1.14 -0.42 0.00 0.00 0.00 0.00 53.44 51.86 1br4 n ALA 281 Cb 0.48 -0.10 -0.03 0.00 0.00 0.00 0.00 19.45 19.80 1br4 n ALA 281 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1br4 s LYS 282 N -4.35 4.21 -1.02 0.00 2.20 -1.26 -2.91 119.74 116.61 1br4 s LYS 282 Ca 0.50 2.23 -0.05 0.00 -0.36 0.00 0.00 55.97 58.28 1br4 s LYS 282 Cb -0.09 -3.72 0.01 0.00 -1.51 0.00 0.00 37.83 32.52 1br4 s LYS 282 CO 0.42 -0.74 0.88 -0.25 -0.36 0.00 0.00 175.35 175.30 1br4 n ASP 283 N 6.04 -4.54 -4.12 1.43 9.92 -1.26 -4.83 116.55 119.20 1br4 n ASP 283 Ca 0.16 -0.43 -0.12 0.00 -0.53 0.00 0.00 54.79 53.87 1br4 n ASP 283 Cb 0.42 -4.03 -0.09 0.00 -0.64 0.00 0.00 41.12 36.78 1br4 n ASP 283 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1br4 s GLU 284 N -5.77 1.29 0.26 -1.24 2.02 -1.15 -4.42 118.70 109.69 1br4 s GLU 284 Ca 0.34 -1.58 0.02 0.00 0.02 0.00 0.00 54.97 53.76 1br4 s GLU 284 Cb -0.15 0.31 -0.05 0.00 0.10 0.00 0.00 34.13 34.34 1br4 s GLU 284 CO 0.56 -0.45 0.09 1.03 0.02 0.00 0.00 175.26 176.51 1br4 s ARG 285 N -4.09 1.42 0.00 1.61 0.52 -1.03 -4.78 118.95 112.59 1br4 s ARG 285 Ca 0.36 -1.76 0.00 0.00 -0.52 0.00 0.00 55.73 53.81 1br4 s ARG 285 Cb 0.05 -0.32 0.00 0.00 0.52 0.00 0.00 34.95 35.20 1br4 s ARG 285 CO 0.12 -0.27 0.00 0.25 0.02 0.00 0.00 175.30 175.42 1br4 n THR 286 N -0.47 0.00 -1.62 0.02 -2.24 -1.26 -4.45 114.28 104.26 1br4 n THR 286 Ca -0.01 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.41 1br4 n THR 286 Cb 0.66 -1.70 -0.03 0.00 -2.10 0.00 0.00 70.33 67.16 1br4 n THR 286 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1br4 s PHE 287 N -0.11 1.15 0.00 4.78 0.40 -1.26 -4.49 117.98 118.45 1br4 s PHE 287 Ca 0.00 1.45 0.00 0.00 -0.60 0.00 0.00 56.93 57.78 1br4 s PHE 287 Cb 0.00 -3.66 0.00 0.00 0.51 0.00 0.00 43.02 39.87 1br4 s PHE 287 CO 0.00 -2.54 0.00 0.72 0.70 0.00 0.00 175.22 174.10 1br4 n HIS 288 N 15.42 0.00 -0.56 0.36 8.25 -1.14 -0.61 115.22 136.93 1br4 n HIS 288 Ca 0.34 0.00 0.45 0.00 -0.26 0.00 0.00 57.72 58.25 1br4 n HIS 288 Cb 0.54 -0.25 0.75 0.00 1.12 0.00 0.00 29.99 32.14 1br4 n HIS 288 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 1br4 h ILE 289 N 0.00 0.07 0.24 1.59 6.09 -1.86 0.79 117.51 124.43 1br4 h ILE 289 Ca 0.00 -0.01 0.00 0.00 -1.37 0.00 0.00 64.86 63.48 1br4 h ILE 289 Cb 0.00 0.05 -0.02 0.00 0.47 0.00 0.00 36.82 37.32 1br4 h ILE 289 CO 0.00 0.00 -0.23 -0.26 -3.07 0.00 0.00 178.15 174.59 1br4 h PHE 290 N 0.03 -0.62 -0.32 2.19 0.04 -1.22 -1.75 116.94 115.30 1br4 h PHE 290 Ca 0.87 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 61.50 1br4 h PHE 290 Cb 3.15 0.24 -0.01 0.00 2.20 0.00 0.00 35.95 41.53 1br4 h PHE 290 CO -0.00 -0.35 -0.36 1.88 -0.60 0.00 0.00 178.31 178.88 1br4 h TYR 291 N -0.50 0.86 -0.48 -0.55 -1.99 -1.10 -1.71 116.97 111.50 1br4 h TYR 291 Ca -0.00 -0.24 0.08 0.00 2.00 0.00 0.00 58.73 60.56 1br4 h TYR 291 Cb 0.47 -0.19 -0.03 0.00 2.00 0.00 0.00 36.73 38.98 1br4 h TYR 291 CO -0.16 0.99 0.32 1.88 -0.00 0.00 0.00 178.16 181.19 1br4 h TYR 292 N 0.61 0.33 0.00 4.88 -1.99 -1.20 -0.85 116.97 118.75 1br4 h TYR 292 Ca 0.06 0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.78 1br4 h TYR 292 Cb 0.90 -0.11 -0.00 0.00 2.00 0.00 0.00 36.73 39.52 1br4 h TYR 292 CO 0.05 0.17 -0.12 1.25 -0.00 0.00 0.00 178.16 179.50 1br4 h LEU 293 N 0.33 0.00 -1.82 3.88 5.85 -1.15 0.79 115.31 123.18 1br4 h LEU 293 Ca 0.21 -0.65 0.10 0.00 0.84 0.00 0.00 57.88 58.39 1br4 h LEU 293 Cb 0.43 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1br4 h LEU 293 CO -0.05 0.89 0.51 0.40 -0.34 0.00 0.00 178.44 179.86 1br4 h ILE 294 N -1.00 0.23 0.00 4.05 2.04 -0.96 0.26 117.51 122.13 1br4 h ILE 294 Ca -0.03 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.73 1br4 h ILE 294 Cb 0.73 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 1br4 h ILE 294 CO -0.02 0.00 -1.38 0.00 0.00 0.00 0.00 178.15 176.75 1br4 n ALA 295 N -2.18 1.88 0.65 1.87 0.00 -0.36 -4.65 120.51 117.72 1br4 n ALA 295 Ca 0.06 -0.36 0.12 0.00 0.00 0.00 0.00 53.44 53.27 1br4 n ALA 295 Cb 0.66 0.12 0.28 0.00 0.00 0.00 0.00 19.45 20.51 1br4 n ALA 295 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1br4 n GLY 296 N 2.63 -1.50 3.74 0.00 0.00 0.27 -4.78 105.19 105.56 1br4 n GLY 296 Ca -0.09 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 1br4 n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1br4 s ALA 297 N -3.12 1.81 0.16 4.61 0.00 0.88 -4.89 121.76 121.20 1br4 s ALA 297 Ca 0.08 0.04 0.05 0.00 0.00 0.00 0.00 51.96 52.13 1br4 s ALA 297 Cb 0.14 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 20.01 1br4 s ALA 297 CO 0.67 -2.13 0.14 -1.54 0.00 0.00 0.00 175.76 172.90 1br4 s SER 298 N -3.44 5.57 0.32 0.00 1.04 -1.26 -4.85 113.70 111.08 1br4 s SER 298 Ca 0.62 -0.10 0.10 0.00 0.48 0.00 0.00 55.95 57.06 1br4 s SER 298 Cb -0.17 -1.47 0.94 0.00 0.10 0.00 0.00 66.02 65.41 1br4 s SER 298 CO 0.56 0.08 1.70 -0.08 0.98 0.00 0.00 173.24 176.48 1br4 h GLU 299 N 2.46 0.44 0.05 4.02 4.81 -1.96 3.58 114.58 127.98 1br4 h GLU 299 Ca -0.48 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1br4 h GLU 299 Cb 1.20 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1br4 h GLU 299 CO 0.64 0.29 -0.03 0.37 -0.73 0.00 0.00 179.01 179.55 1br4 h GLN 300 N 0.45 -0.07 -0.97 1.92 4.15 -1.98 -2.34 115.11 116.28 1br4 h GLN 300 Ca 0.67 0.00 0.24 0.00 0.77 0.00 0.00 58.65 60.33 1br4 h GLN 300 Cb 1.37 0.02 -0.12 0.00 0.21 0.00 0.00 27.48 28.95 1br4 h GLN 300 CO -0.54 -0.05 0.54 0.00 -1.93 0.00 0.00 178.83 176.86 1br4 h MET 301 N -0.16 0.51 -0.72 1.69 -0.00 -1.81 0.88 114.93 115.33 1br4 h MET 301 Ca -0.01 -0.03 0.05 0.00 -0.00 0.00 0.00 59.70 59.71 1br4 h MET 301 Cb 0.06 -0.12 -0.04 0.00 -0.00 0.00 0.00 31.60 31.50 1br4 h MET 301 CO 0.01 0.34 0.48 0.07 -0.00 0.00 0.00 176.91 177.81 1br4 h ARG 302 N 0.53 0.80 0.00 -0.10 0.11 0.67 0.31 114.38 116.69 1br4 h ARG 302 Ca 0.62 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.65 1br4 h ARG 302 Cb 1.19 -0.18 0.00 0.00 1.11 0.00 0.00 29.97 32.09 1br4 h ARG 302 CO -0.49 0.53 -0.02 0.27 0.10 0.00 0.00 179.97 180.36 1br4 n ASN 303 N -4.47 0.40 -0.40 0.08 6.94 0.29 -2.75 115.26 115.36 1br4 n ASN 303 Ca 0.10 0.51 0.13 0.00 -0.02 0.00 0.00 54.58 55.31 1br4 n ASN 303 Cb 0.17 -0.61 0.43 0.00 -2.36 0.00 0.00 39.78 37.40 1br4 n ASN 303 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1br4 n ASP 304 N -1.87 1.37 0.00 0.53 9.92 0.11 -4.20 116.55 122.41 1br4 n ASP 304 Ca 0.06 -1.26 0.00 0.00 -0.53 0.00 0.00 54.79 53.06 1br4 n ASP 304 Cb 0.38 0.07 0.00 0.00 -0.64 0.00 0.00 41.12 40.94 1br4 n ASP 304 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1br4 n LEU 305 N -0.14 0.11 -3.09 0.64 4.77 -1.05 -5.01 117.00 113.24 1br4 n LEU 305 Ca 0.16 -0.11 -0.07 0.00 -0.03 0.00 0.00 56.01 55.95 1br4 n LEU 305 Cb 0.37 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.49 1br4 n LEU 305 CO 0.21 0.03 0.19 0.18 -1.33 0.00 0.00 177.39 176.67 1br4 n LEU 306 N -0.02 -6.10 -4.18 2.23 4.77 -1.11 -4.49 117.00 108.10 1br4 n LEU 306 Ca 0.00 -0.36 -0.33 0.00 -0.03 0.00 0.00 56.01 55.29 1br4 n LEU 306 Cb 0.36 -3.18 -0.16 0.00 -2.33 0.00 0.00 43.42 38.11 1br4 n LEU 306 CO 0.00 -0.52 -0.52 -1.48 -1.33 0.00 0.00 177.39 173.54 1br4 s LEU 307 N -4.59 2.21 0.00 2.23 2.34 -1.12 -4.78 118.68 114.98 1br4 s LEU 307 Ca 0.21 -0.59 0.00 0.00 0.06 0.00 0.00 54.13 53.82 1br4 s LEU 307 Cb -0.03 -1.49 0.00 0.00 -0.56 0.00 0.00 46.19 44.11 1br4 s LEU 307 CO 0.72 0.05 0.00 -0.62 -1.06 0.00 0.00 176.35 175.44 1br4 n GLU 308 N 4.27 3.78 -1.11 1.48 1.02 -1.26 -4.83 120.64 123.98 1br4 n GLU 308 Ca -0.20 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.64 1br4 n GLU 308 Cb 0.51 0.00 0.24 0.00 -0.02 0.00 0.00 31.44 32.17 1br4 n GLU 308 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1br4 s GLY 309 N -0.18 1.60 0.03 0.62 0.00 -1.26 -4.97 107.32 103.15 1br4 s GLY 309 Ca 0.00 -1.02 0.06 0.00 0.00 0.00 0.00 44.72 43.76 1br4 s GLY 309 CO 0.00 -0.11 0.94 0.74 0.00 0.00 0.00 173.10 174.67 1br4 h PHE 310 N -2.61 0.14 -0.64 1.90 0.04 -1.96 -3.33 116.94 110.48 1br4 h PHE 310 Ca -0.44 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.23 1br4 h PHE 310 Cb 1.29 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.43 1br4 h PHE 310 CO -2.35 1.12 0.00 0.09 -0.60 0.00 0.00 178.31 176.57 1br4 n ASN 311 N -3.28 4.30 -0.01 2.17 5.03 -1.26 -4.23 115.26 117.98 1br4 n ASN 311 Ca -0.11 -2.27 -0.13 0.00 0.87 0.00 0.00 54.58 52.94 1br4 n ASN 311 Cb 1.01 -0.52 -0.14 0.00 -1.02 0.00 0.00 39.78 39.11 1br4 n ASN 311 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1br4 n ASN 312 N 1.20 1.32 -4.74 6.41 5.03 -1.25 -4.87 115.26 118.36 1br4 n ASN 312 Ca 0.24 0.35 -0.39 0.00 0.87 0.00 0.00 54.58 55.66 1br4 n ASN 312 Cb 0.76 -0.36 -0.05 0.00 -1.02 0.00 0.00 39.78 39.11 1br4 n ASN 312 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1br4 s TYR 313 N -2.59 3.61 -2.11 3.10 1.51 -1.26 -4.93 117.35 114.68 1br4 s TYR 313 Ca -0.11 1.15 0.30 0.00 -1.01 0.00 0.00 57.07 57.41 1br4 s TYR 313 Cb 0.07 -2.67 1.47 0.00 -0.11 0.00 0.00 41.96 40.72 1br4 s TYR 313 CO 0.81 0.22 1.98 2.41 -1.11 0.00 0.00 175.55 179.86 1br4 n THR 314 N 3.31 0.00 0.58 -0.71 -1.04 -1.26 -2.87 114.28 112.29 1br4 n THR 314 Ca -0.05 -0.10 0.12 0.00 -2.04 0.00 0.00 64.05 61.98 1br4 n THR 314 Cb 0.51 -0.06 0.26 0.00 -1.82 0.00 0.00 70.33 69.23 1br4 n THR 314 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1br4 n PHE 315 N -0.56 0.74 -3.55 -1.42 3.72 -1.26 -4.48 117.46 110.64 1br4 n PHE 315 Ca 0.20 0.22 -0.41 0.00 -0.05 0.00 0.00 57.45 57.41 1br4 n PHE 315 Cb 0.23 -0.79 -0.06 0.00 -0.94 0.00 0.00 39.48 37.92 1br4 n PHE 315 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1br4 s LEU 316 N -4.40 5.90 0.76 4.37 1.43 -1.14 -4.62 118.68 120.99 1br4 s LEU 316 Ca 0.08 -2.83 -0.11 0.00 -1.03 0.00 0.00 54.13 50.24 1br4 s LEU 316 Cb 0.13 -2.01 0.05 0.00 0.03 0.00 0.00 46.19 44.39 1br4 s LEU 316 CO 0.67 -0.44 1.09 -0.44 0.23 0.00 0.00 176.35 177.46 1br4 s SER 317 N 1.27 4.58 -1.89 2.29 0.01 -1.26 -2.59 113.70 116.11 1br4 s SER 317 Ca 0.18 1.82 0.00 0.00 1.31 0.00 0.00 55.95 59.26 1br4 s SER 317 Cb -0.15 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.56 1br4 s SER 317 CO -0.06 -1.98 0.00 0.59 0.41 0.00 0.00 173.24 172.20 1br4 n ASN 318 N -3.45 -5.16 0.00 2.44 3.02 -1.26 -4.56 115.26 106.28 1br4 n ASN 318 Ca 0.09 0.42 0.00 0.00 -0.03 0.00 0.00 54.58 55.06 1br4 n ASN 318 Cb 0.53 -4.24 0.00 0.00 -0.61 0.00 0.00 39.78 35.46 1br4 n ASN 318 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1br4 n GLY 319 N -0.78 0.80 2.96 7.41 0.00 -1.07 -4.25 105.19 110.26 1br4 n GLY 319 Ca -0.18 0.60 -0.26 0.00 0.00 0.00 0.00 46.02 46.19 1br4 n GLY 319 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1br4 s HIS 320 N 0.00 1.46 -0.12 1.61 5.65 -1.26 -4.78 115.29 117.85 1br4 s HIS 320 Ca 0.00 -0.64 -0.02 0.00 0.25 0.00 0.00 55.06 54.65 1br4 s HIS 320 Cb 0.00 -1.14 -0.03 0.00 -1.18 0.00 0.00 32.58 30.23 1br4 s HIS 320 CO 0.00 -0.40 -0.04 0.08 -0.65 0.00 0.00 174.74 173.73 1br4 s VAL 321 N 1.18 3.87 -0.09 0.89 1.01 -1.26 -5.10 120.40 120.90 1br4 s VAL 321 Ca -0.05 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.40 1br4 s VAL 321 Cb -0.14 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 1br4 s VAL 321 CO -0.02 0.54 0.36 -2.16 0.00 0.00 0.00 175.10 173.82 1br4 s PRO 322 N -0.13 4.09 -0.26 2.72 0.04 -1.26 -5.05 135.00 135.14 1br4 s PRO 322 Ca 0.02 0.27 -0.10 0.00 0.04 0.00 0.00 61.00 61.23 1br4 s PRO 322 Cb -0.13 -3.34 -0.05 0.00 0.04 0.00 0.00 34.50 31.03 1br4 s PRO 322 CO 0.03 0.43 0.16 -1.50 0.04 0.00 0.00 177.00 176.15 1br4 s ILE 323 N -0.17 5.14 0.32 0.56 2.07 -1.26 -5.06 121.20 122.79 1br4 s ILE 323 Ca 0.21 0.11 -0.27 0.00 -1.41 0.00 0.00 60.65 59.29 1br4 s ILE 323 Cb -0.15 -3.43 -0.13 0.00 0.13 0.00 0.00 42.46 38.88 1br4 s ILE 323 CO 0.09 0.29 1.05 -0.81 -1.91 0.00 0.00 174.94 173.65 1br4 n PRO 324 N 4.84 1.49 -2.14 3.50 -0.04 -1.26 -2.35 135.00 139.03 1br4 n PRO 324 Ca -0.15 0.52 -0.15 0.00 -0.04 0.00 0.00 63.50 63.68 1br4 n PRO 324 Cb 0.52 -1.95 -0.02 0.00 -0.04 0.00 0.00 33.50 32.00 1br4 n PRO 324 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1br4 n ALA 325 N 0.14 -0.58 -3.55 0.55 0.00 -1.26 -4.94 120.51 110.86 1br4 n ALA 325 Ca 0.09 0.16 -0.14 0.00 0.00 0.00 0.00 53.44 53.55 1br4 n ALA 325 Cb 0.34 -1.71 -0.15 0.00 0.00 0.00 0.00 19.45 17.93 1br4 n ALA 325 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1br4 s GLN 326 N -4.53 0.04 -0.46 0.00 0.74 -0.99 -5.10 119.66 109.35 1br4 s GLN 326 Ca 0.00 0.23 0.03 0.00 0.05 0.00 0.00 55.36 55.68 1br4 s GLN 326 Cb 0.00 -0.15 0.12 0.00 1.10 0.00 0.00 33.01 34.08 1br4 s GLN 326 CO 0.00 -0.13 0.20 -1.14 -0.55 0.00 0.00 175.29 173.68 1br4 s GLN 327 N 0.85 1.69 0.63 1.67 0.74 -1.26 -4.60 119.66 119.39 1br4 s GLN 327 Ca -0.07 -2.29 0.16 0.00 0.05 0.00 0.00 55.36 53.21 1br4 s GLN 327 Cb -0.09 -3.07 0.88 0.00 1.10 0.00 0.00 33.01 31.83 1br4 s GLN 327 CO -0.03 -1.08 1.48 -0.44 -0.55 0.00 0.00 175.29 174.67 1br4 h ASP 328 N 6.85 0.00 -0.01 6.67 3.32 -1.93 0.90 116.42 132.21 1br4 h ASP 328 Ca -0.06 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 1br4 h ASP 328 Cb 0.93 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.48 1br4 h ASP 328 CO 0.61 0.00 0.00 0.44 -1.72 0.00 0.00 179.24 178.57 1br4 h ASP 329 N 0.00 0.02 0.75 6.45 5.19 -1.86 -0.34 116.42 126.62 1br4 h ASP 329 Ca 0.00 -0.22 -0.21 0.00 -0.62 0.00 0.00 57.03 55.97 1br4 h ASP 329 Cb 1.22 -0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.69 1br4 h ASP 329 CO 0.00 0.24 -1.36 1.05 -3.12 0.00 0.00 179.24 176.04 1br4 h GLU 330 N -0.21 0.00 -0.96 3.56 4.11 -0.53 -3.32 114.58 117.24 1br4 h GLU 330 Ca 0.00 0.00 0.06 0.00 0.07 0.00 0.00 59.36 59.50 1br4 h GLU 330 Cb 0.23 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.41 1br4 h GLU 330 CO 0.00 0.48 0.62 0.52 0.07 0.00 0.00 179.01 180.71 1br4 h MET 331 N 0.00 1.09 0.32 1.06 2.86 0.61 -0.78 114.93 120.09 1br4 h MET 331 Ca -0.17 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.39 1br4 h MET 331 Cb 1.75 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 33.16 1br4 h MET 331 CO 0.07 0.72 -0.18 0.35 1.06 0.00 0.00 176.91 178.93 1br4 h PHE 332 N 1.12 -0.46 -0.84 -0.22 3.57 -1.15 -0.77 116.94 118.18 1br4 h PHE 332 Ca 0.41 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 62.03 1br4 h PHE 332 Cb 0.16 0.16 -0.09 0.00 2.79 0.00 0.00 35.95 38.98 1br4 h PHE 332 CO -0.00 -0.28 0.46 0.37 -2.23 0.00 0.00 178.31 176.62 1br4 h GLN 333 N -0.47 0.68 0.03 1.11 5.75 -1.52 0.21 115.11 120.91 1br4 h GLN 333 Ca -0.04 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.42 1br4 h GLN 333 Cb 0.37 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 28.77 1br4 h GLN 333 CO 0.05 0.45 -0.02 1.49 -2.65 0.00 0.00 178.83 178.16 1br4 h GLU 334 N 0.70 -0.04 -0.19 1.69 4.81 -0.82 0.02 114.58 120.75 1br4 h GLU 334 Ca 0.44 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.60 1br4 h GLU 334 Cb 0.53 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 1br4 h GLU 334 CO -0.31 0.05 -0.19 1.79 -0.73 0.00 0.00 179.01 179.61 1br4 h THR 335 N -0.12 1.23 -0.38 0.32 1.35 -0.46 -1.91 112.91 112.93 1br4 h THR 335 Ca -0.00 -1.03 -0.06 0.00 -0.55 0.00 0.00 66.41 64.77 1br4 h THR 335 Cb 0.11 1.30 -0.01 0.00 -1.73 0.00 0.00 68.15 67.81 1br4 h THR 335 CO 0.01 0.32 0.02 -0.07 -0.25 0.00 0.00 175.52 175.55 1br4 h LEU 336 N 0.30 0.64 -1.19 3.87 -0.00 -0.29 -2.80 115.31 115.83 1br4 h LEU 336 Ca 0.05 -0.29 -0.01 0.00 -0.00 0.00 0.00 57.88 57.63 1br4 h LEU 336 Cb 0.52 -0.17 -0.03 0.00 -0.00 0.00 0.00 40.66 40.97 1br4 h LEU 336 CO 0.03 0.77 0.36 -0.33 -0.00 0.00 0.00 178.44 179.27 1br4 h GLU 337 N 0.48 0.92 -0.23 1.13 5.08 -0.58 -2.80 114.58 118.57 1br4 h GLU 337 Ca 0.11 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1br4 h GLU 337 Cb 0.43 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1br4 h GLU 337 CO 0.02 0.68 0.13 0.00 -1.00 0.00 0.00 179.01 178.84 1br4 h ALA 338 N 1.47 0.29 -0.32 3.43 0.00 -1.13 -2.42 119.26 120.58 1br4 h ALA 338 Ca 0.24 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.16 1br4 h ALA 338 Cb 0.03 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 1br4 h ALA 338 CO -0.04 -0.20 -0.01 0.52 0.00 0.00 0.00 179.25 179.52 1br4 h MET 339 N 0.27 0.08 -0.05 0.00 2.86 -1.25 -2.76 114.93 114.08 1br4 h MET 339 Ca 0.08 -0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.74 1br4 h MET 339 Cb 0.03 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 1br4 h MET 339 CO -0.01 0.05 -0.11 1.79 1.06 0.00 0.00 176.91 179.69 1br4 h THR 340 N 0.08 0.72 -0.93 2.22 1.35 -1.40 -1.62 112.91 113.33 1br4 h THR 340 Ca 0.15 0.00 0.27 0.00 -0.55 0.00 0.00 66.41 66.28 1br4 h THR 340 Cb 0.21 0.72 -0.15 0.00 -1.73 0.00 0.00 68.15 67.20 1br4 h THR 340 CO -0.27 0.00 0.35 0.40 -0.25 0.00 0.00 175.52 175.75 1br4 h ILE 341 N -0.16 0.30 0.00 6.82 1.08 -1.15 -3.25 117.51 121.14 1br4 h ILE 341 Ca 0.06 -0.08 0.00 0.00 -0.39 0.00 0.00 64.86 64.44 1br4 h ILE 341 Cb 0.23 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.02 1br4 h ILE 341 CO -0.14 0.04 0.00 0.23 -0.69 0.00 0.00 178.15 177.59 1br4 n MET 342 N -5.17 0.00 0.00 2.37 2.81 -0.65 -4.81 117.12 111.66 1br4 n MET 342 Ca 0.25 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.14 1br4 n MET 342 Cb 0.79 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.30 1br4 n MET 342 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1br4 n GLY 343 N 1.14 0.80 3.56 3.03 0.00 -0.94 -5.06 105.19 107.72 1br4 n GLY 343 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1br4 n GLY 343 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1br4 s PHE 344 N 0.00 1.49 1.03 1.61 0.40 -1.07 -4.93 117.98 116.51 1br4 s PHE 344 Ca 0.00 1.18 -0.19 0.00 -0.60 0.00 0.00 56.93 57.32 1br4 s PHE 344 Cb 0.00 -3.81 -0.03 0.00 0.51 0.00 0.00 43.02 39.68 1br4 s PHE 344 CO 0.00 -1.89 -0.45 2.41 0.70 0.00 0.00 175.22 175.99 1br4 n THR 345 N 8.05 0.00 -0.06 0.64 -1.04 -1.26 -4.36 114.28 116.25 1br4 n THR 345 Ca 0.38 -0.24 -0.08 0.00 -2.04 0.00 0.00 64.05 62.07 1br4 n THR 345 Cb 0.48 -0.35 -0.02 0.00 -1.82 0.00 0.00 70.33 68.62 1br4 n THR 345 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 1br4 h GLU 346 N -1.50 -0.26 -0.09 -2.82 9.09 -2.01 -1.20 114.58 115.80 1br4 h GLU 346 Ca -0.46 0.02 -0.03 0.00 0.05 0.00 0.00 59.36 58.94 1br4 h GLU 346 Cb 1.34 0.06 -0.00 0.00 -1.65 0.00 0.00 28.75 28.50 1br4 h GLU 346 CO 0.30 -0.17 -0.06 1.05 0.05 0.00 0.00 179.01 180.18 1br4 h GLU 347 N -0.27 0.20 -0.50 1.06 4.11 -1.99 -2.91 114.58 114.28 1br4 h GLU 347 Ca 0.14 -0.10 0.15 0.00 0.07 0.00 0.00 59.36 59.62 1br4 h GLU 347 Cb 0.49 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1br4 h GLU 347 CO -0.42 0.60 0.80 0.93 0.07 0.00 0.00 179.01 180.98 1br4 h GLU 348 N -0.20 0.00 0.00 1.06 5.08 -1.71 0.15 114.58 118.95 1br4 h GLU 348 Ca 0.02 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.21 1br4 h GLU 348 Cb 0.55 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 1br4 h GLU 348 CO 0.02 0.00 -1.07 1.04 -1.00 0.00 0.00 179.01 178.00 1br4 n GLN 349 N -3.21 0.53 -0.23 2.33 6.02 -0.51 -4.12 117.38 118.20 1br4 n GLN 349 Ca 0.10 0.55 0.13 0.00 -0.01 0.00 0.00 57.00 57.78 1br4 n GLN 349 Cb 0.97 -1.72 0.42 0.00 1.02 0.00 0.00 30.24 30.93 1br4 n GLN 349 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 1br4 h THR 350 N -1.00 0.83 -0.87 5.09 1.35 -0.86 -0.48 112.91 116.97 1br4 h THR 350 Ca -0.25 -0.20 0.01 0.00 -0.55 0.00 0.00 66.41 65.41 1br4 h THR 350 Cb 1.07 0.18 -0.04 0.00 -1.73 0.00 0.00 68.15 67.63 1br4 h THR 350 CO -0.15 0.11 0.58 0.28 -0.25 0.00 0.00 175.52 176.08 1br4 h SER 351 N 0.60 0.99 0.04 5.36 0.02 -0.99 -1.93 113.55 117.64 1br4 h SER 351 Ca 0.41 -0.02 -0.23 0.00 -0.84 0.00 0.00 61.79 61.12 1br4 h SER 351 Cb 0.75 -0.25 0.01 0.00 0.14 0.00 0.00 62.40 63.05 1br4 h SER 351 CO -0.17 0.71 -0.85 0.40 -1.14 0.00 0.00 176.83 175.78 1br4 h ILE 352 N 1.17 1.32 0.17 3.27 2.04 -1.27 -3.29 117.51 120.92 1br4 h ILE 352 Ca 0.32 -2.14 0.01 0.00 1.00 0.00 0.00 64.86 64.05 1br4 h ILE 352 Cb -0.12 2.16 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 1br4 h ILE 352 CO -0.07 0.66 -0.22 -0.07 0.00 0.00 0.00 178.15 178.45 1br4 h LEU 353 N 0.41 -0.59 -1.08 1.44 3.38 -0.74 -2.66 115.31 115.47 1br4 h LEU 353 Ca -0.07 0.06 0.14 0.00 0.09 0.00 0.00 57.88 58.10 1br4 h LEU 353 Cb 1.48 0.21 -0.08 0.00 0.09 0.00 0.00 40.66 42.36 1br4 h LEU 353 CO 0.16 -0.31 0.62 0.08 0.09 0.00 0.00 178.44 179.08 1br4 h ARG 354 N -0.44 0.86 -0.74 1.13 0.11 -1.48 -0.40 114.38 113.41 1br4 h ARG 354 Ca 0.01 -0.05 0.08 0.00 0.10 0.00 0.00 59.98 60.12 1br4 h ARG 354 Cb 0.43 -0.19 -0.07 0.00 1.11 0.00 0.00 29.97 31.25 1br4 h ARG 354 CO -0.08 0.57 0.40 0.28 0.10 0.00 0.00 179.97 181.24 1br4 h VAL 355 N 0.88 0.91 -0.21 0.08 2.07 -1.54 -0.76 116.25 117.68 1br4 h VAL 355 Ca 0.50 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.78 1br4 h VAL 355 Cb 0.61 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1br4 h VAL 355 CO -0.27 0.13 0.14 0.58 0.02 0.00 0.00 177.57 178.17 1br4 h VAL 356 N 0.70 1.05 -0.25 2.57 2.07 -0.90 -0.24 116.25 121.25 1br4 h VAL 356 Ca 0.35 -0.10 -0.08 0.00 0.82 0.00 0.00 66.70 67.69 1br4 h VAL 356 Cb 0.31 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1br4 h VAL 356 CO -0.23 0.05 -0.19 0.77 0.02 0.00 0.00 177.57 177.99 1br4 h SER 357 N 0.29 0.43 -0.49 0.57 4.64 -1.23 -1.62 113.55 116.14 1br4 h SER 357 Ca 0.08 -0.12 -0.10 0.00 -0.47 0.00 0.00 61.79 61.17 1br4 h SER 357 Cb -0.03 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 61.93 1br4 h SER 357 CO -0.02 0.64 -0.10 0.77 -0.87 0.00 0.00 176.83 177.25 1br4 h SER 358 N 0.40 0.94 -0.51 4.97 4.64 -0.77 -1.68 113.55 121.54 1br4 h SER 358 Ca 0.07 -0.35 -0.09 0.00 -0.47 0.00 0.00 61.79 60.94 1br4 h SER 358 Cb 0.56 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.37 1br4 h SER 358 CO 0.04 1.07 -0.01 0.58 -0.87 0.00 0.00 176.83 177.64 1br4 h VAL 359 N 0.78 1.26 -0.50 0.95 2.07 -0.73 -1.77 116.25 118.31 1br4 h VAL 359 Ca 0.13 -1.11 -0.07 0.00 0.82 0.00 0.00 66.70 66.46 1br4 h VAL 359 Cb 0.66 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1br4 h VAL 359 CO 0.05 0.40 0.02 -0.07 0.02 0.00 0.00 177.57 177.98 1br4 h LEU 360 N 0.87 0.79 0.10 2.57 3.38 -1.13 -3.13 115.31 118.77 1br4 h LEU 360 Ca 0.16 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1br4 h LEU 360 Cb 0.53 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1br4 h LEU 360 CO 0.03 0.85 -0.05 1.56 0.09 0.00 0.00 178.44 180.92 1br4 h GLN 361 N 0.78 -0.14 0.00 1.13 4.20 -0.89 -2.56 115.11 117.62 1br4 h GLN 361 Ca 0.15 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1br4 h GLN 361 Cb 0.44 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1br4 h GLN 361 CO 0.02 0.08 0.77 -0.07 -0.67 0.00 0.00 178.83 178.96 1br4 h LEU 362 N -0.34 0.00 -0.86 1.46 3.38 -1.27 1.27 115.31 118.95 1br4 h LEU 362 Ca -0.01 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1br4 h LEU 362 Cb 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1br4 h LEU 362 CO 0.02 0.00 -0.29 1.23 0.09 0.00 0.00 178.44 179.50 1br4 h GLY 363 N 0.00 0.00 1.42 0.83 0.00 -1.54 -3.04 103.07 100.74 1br4 h GLY 363 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1br4 h GLY 363 CO 0.00 0.00 -0.38 0.70 0.00 0.00 0.00 176.54 176.86 1br4 n ASN 364 N -3.38 0.60 -4.55 0.19 3.02 0.44 -4.65 115.26 106.92 1br4 n ASN 364 Ca 0.01 0.20 -0.36 0.00 -0.03 0.00 0.00 54.58 54.40 1br4 n ASN 364 Cb 0.50 -0.12 -0.04 0.00 -0.61 0.00 0.00 39.78 39.51 1br4 n ASN 364 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1br4 s ILE 365 N -3.10 3.56 0.00 2.41 1.01 -1.15 -4.96 121.20 118.97 1br4 s ILE 365 Ca 0.09 -0.10 0.05 0.00 0.00 0.00 0.00 60.65 60.69 1br4 s ILE 365 Cb 0.15 -4.37 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 1br4 s ILE 365 CO 0.66 -1.30 -0.14 -0.69 0.00 0.00 0.00 174.94 173.47 1br4 s VAL 366 N 7.94 3.11 0.06 2.92 1.01 -1.26 -4.99 120.40 129.19 1br4 s VAL 366 Ca 0.58 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.66 1br4 s VAL 366 Cb -0.08 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 1br4 s VAL 366 CO 0.08 0.44 0.05 -0.36 0.00 0.00 0.00 175.10 175.30 1br4 s PHE 367 N -0.88 3.14 -0.87 5.22 0.08 -1.26 -4.87 117.98 118.53 1br4 s PHE 367 Ca 0.14 0.07 -0.08 0.00 0.12 0.00 0.00 56.93 57.18 1br4 s PHE 367 Cb -0.11 -1.63 0.22 0.00 -0.57 0.00 0.00 43.02 40.94 1br4 s PHE 367 CO 0.04 0.51 0.79 0.15 -0.10 0.00 0.00 175.22 176.61 1br4 s LYS 368 N -2.16 3.49 -0.66 0.44 1.02 -1.07 -4.84 119.74 115.96 1br4 s LYS 368 Ca 0.26 -2.83 -0.33 0.00 0.02 0.00 0.00 55.97 53.09 1br4 s LYS 368 Cb -0.12 -4.23 -0.16 0.00 -0.52 0.00 0.00 37.83 32.80 1br4 s LYS 368 CO 0.18 -1.25 2.44 1.17 -0.92 0.00 0.00 175.35 176.97 1br4 n LYS 369 N 3.23 0.49 -1.65 1.68 4.81 -1.26 -2.94 118.16 122.52 1br4 n LYS 369 Ca 0.17 0.07 -0.49 0.00 -0.87 0.00 0.00 58.31 57.19 1br4 n LYS 369 Cb 0.41 -2.16 -0.05 0.00 0.02 0.00 0.00 35.03 33.25 1br4 n LYS 369 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1br4 n GLU 370 N 8.40 1.77 0.02 1.64 1.02 -1.01 -4.87 120.64 127.62 1br4 n GLU 370 Ca 0.52 0.64 -0.10 0.00 -0.02 0.00 0.00 57.16 58.21 1br4 n GLU 370 Cb 0.18 -2.37 0.05 0.00 -0.02 0.00 0.00 31.44 29.28 1br4 n GLU 370 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1br4 h ARG 371 N 5.89 0.51 0.32 3.49 3.08 -1.90 0.22 114.38 125.99 1br4 h ARG 371 Ca -0.46 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.22 1br4 h ARG 371 Cb 1.29 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1br4 h ARG 371 CO 0.86 0.96 -0.16 -0.91 -1.07 0.00 0.00 179.97 179.66 1br4 h ASN 372 N 0.38 -0.37 -0.00 7.04 2.35 -1.97 -3.37 115.58 119.64 1br4 h ASN 372 Ca -0.01 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 1br4 h ASN 372 Cb 1.16 0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.63 1br4 h ASN 372 CO 0.11 -0.11 -0.29 0.41 -1.65 0.00 0.00 177.43 175.90 1br4 n THR 373 N -5.20 0.00 -0.93 2.81 -1.04 -1.25 -4.99 114.28 103.68 1br4 n THR 373 Ca -0.10 -0.36 0.00 0.00 -2.04 0.00 0.00 64.05 61.55 1br4 n THR 373 Cb 0.24 1.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.75 1br4 n THR 373 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1br4 n ASP 374 N -1.12 -0.89 -4.70 8.00 9.92 0.78 -4.99 116.55 123.55 1br4 n ASP 374 Ca 0.01 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 53.88 1br4 n ASP 374 Cb 0.10 -0.64 -0.06 0.00 -0.64 0.00 0.00 41.12 39.88 1br4 n ASP 374 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1br4 s GLN 375 N -0.25 4.31 1.00 -1.24 -0.21 -1.26 -4.13 119.66 117.89 1br4 s GLN 375 Ca 0.00 0.54 -0.18 0.00 0.02 0.00 0.00 55.36 55.74 1br4 s GLN 375 Cb 0.00 -3.48 -0.07 0.00 1.00 0.00 0.00 33.01 30.46 1br4 s GLN 375 CO 0.00 0.03 -0.46 0.00 -2.12 0.00 0.00 175.29 172.74 1br4 n ALA 376 N 4.09 -4.53 -2.96 6.09 0.00 -1.24 -2.41 120.51 119.55 1br4 n ALA 376 Ca -0.05 -0.84 -0.11 0.00 0.00 0.00 0.00 53.44 52.45 1br4 n ALA 376 Cb 0.51 -1.33 -0.12 0.00 0.00 0.00 0.00 19.45 18.51 1br4 n ALA 376 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1br4 s SER 377 N -1.40 0.10 -0.86 0.00 1.04 -1.15 -4.71 113.70 106.71 1br4 s SER 377 Ca 0.46 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.66 1br4 s SER 377 Cb -0.14 0.10 0.25 0.00 0.10 0.00 0.00 66.02 66.33 1br4 s SER 377 CO 0.74 -0.19 0.93 0.80 0.98 0.00 0.00 173.24 176.50 1br4 n MET 378 N 2.18 3.02 0.00 4.02 0.00 -1.26 -2.61 117.12 122.46 1br4 n MET 378 Ca -0.19 -4.55 0.00 0.00 0.00 0.00 0.00 57.70 52.96 1br4 n MET 378 Cb 0.57 -2.39 0.00 0.00 0.00 0.00 0.00 33.22 31.40 1br4 n MET 378 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1br4 n PRO 379 N 1.65 0.00 -3.09 2.12 -0.02 -1.26 -4.19 135.00 130.21 1br4 n PRO 379 Ca 0.25 0.47 -0.44 0.00 -2.02 0.00 0.00 63.50 61.76 1br4 n PRO 379 Cb 0.37 -1.35 -0.05 0.00 -0.02 0.00 0.00 33.50 32.45 1br4 n PRO 379 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1br4 s ASP 380 N -2.22 6.20 0.00 2.55 2.15 -1.26 -4.90 116.67 119.18 1br4 s ASP 380 Ca 0.00 -1.17 0.18 0.00 0.43 0.00 0.00 52.55 51.99 1br4 s ASP 380 Cb 0.00 -2.31 0.79 0.00 -0.30 0.00 0.00 42.92 41.10 1br4 s ASP 380 CO 0.00 -1.07 1.57 0.59 -0.17 0.00 0.00 175.17 176.09 1br4 n ASN 381 N 6.45 0.00 -0.27 -0.34 3.02 -1.26 -4.00 115.26 118.86 1br4 n ASN 381 Ca -0.08 0.42 0.03 0.00 -0.03 0.00 0.00 54.58 54.92 1br4 n ASN 381 Cb 0.44 -0.47 0.08 0.00 -0.61 0.00 0.00 39.78 39.22 1br4 n ASN 381 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1br4 n THR 382 N -1.47 -0.34 0.02 3.41 -1.04 -1.26 -1.09 114.28 112.52 1br4 n THR 382 Ca 0.05 1.69 -0.03 0.00 -2.04 0.00 0.00 64.05 63.72 1br4 n THR 382 Cb 0.20 -2.31 -0.02 0.00 -1.82 0.00 0.00 70.33 66.39 1br4 n THR 382 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1br4 h ALA 383 N 1.30 -0.66 -0.77 2.41 0.00 -1.94 -2.52 119.26 117.08 1br4 h ALA 383 Ca 0.32 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.34 1br4 h ALA 383 Cb 0.50 0.51 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 1br4 h ALA 383 CO -0.75 -0.68 0.34 0.00 0.00 0.00 0.00 179.25 178.17 1br4 h ALA 384 N -1.40 1.10 -0.97 0.00 0.00 -1.54 -1.83 119.26 114.63 1br4 h ALA 384 Ca -0.00 0.10 0.12 0.00 0.00 0.00 0.00 54.91 55.12 1br4 h ALA 384 Cb 0.14 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.89 1br4 h ALA 384 CO -0.05 -0.15 0.60 1.96 0.00 0.00 0.00 179.25 181.60 1br4 h GLN 385 N 0.51 0.92 0.00 0.00 4.20 -1.01 -1.32 115.11 118.42 1br4 h GLN 385 Ca 0.42 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 59.07 1br4 h GLN 385 Cb 0.59 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1br4 h GLN 385 CO -0.37 0.61 0.00 0.87 -0.67 0.00 0.00 178.83 179.27 1br4 h LYS 386 N 0.95 0.00 0.02 1.46 1.57 -0.89 -3.24 116.57 116.44 1br4 h LYS 386 Ca 0.48 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.92 1br4 h LYS 386 Cb 0.47 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.72 1br4 h LYS 386 CO -0.26 0.00 -2.07 0.28 -0.57 0.00 0.00 179.45 176.82 1br4 n VAL 387 N -2.34 1.55 -0.15 0.50 0.31 -0.58 -4.28 118.33 113.34 1br4 n VAL 387 Ca 0.05 -0.77 -0.11 0.00 -0.01 0.00 0.00 64.34 63.50 1br4 n VAL 387 Cb 0.39 -1.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.31 1br4 n VAL 387 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1br4 n HIS 389 N -4.29 0.00 0.18 0.00 -0.00 -1.22 -0.12 115.22 109.77 1br4 n HIS 389 Ca -0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.80 1br4 n HIS 389 Cb 0.37 -0.34 -0.12 0.00 -0.00 0.00 0.00 29.99 29.90 1br4 n HIS 389 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1br4 n LEU 390 N -1.34 0.18 -0.07 0.27 4.77 -0.95 -4.48 117.00 115.38 1br4 n LEU 390 Ca 0.03 -0.12 -0.14 0.00 -0.03 0.00 0.00 56.01 55.75 1br4 n LEU 390 Cb 0.06 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.01 1br4 n LEU 390 CO 0.05 0.05 -1.00 0.23 -1.33 0.00 0.00 177.39 175.39 1br4 n MET 391 N -1.89 0.68 -0.46 3.23 2.81 0.36 -4.76 117.12 117.09 1br4 n MET 391 Ca -0.01 0.15 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 1br4 n MET 391 Cb 0.38 -1.62 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 1br4 n MET 391 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1br4 n GLY 392 N 1.87 0.76 3.98 3.03 0.00 0.83 -3.41 105.19 112.24 1br4 n GLY 392 Ca -0.32 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.48 1br4 n GLY 392 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1br4 s ILE 393 N -2.22 2.57 0.09 -0.61 -5.25 -1.21 -0.85 121.20 113.72 1br4 s ILE 393 Ca 0.00 -0.66 -0.27 0.00 -0.99 0.00 0.00 60.65 58.72 1br4 s ILE 393 Cb 0.00 -2.91 -0.06 0.00 2.95 0.00 0.00 42.46 42.44 1br4 s ILE 393 CO 0.00 0.00 0.86 0.21 -1.79 0.00 0.00 174.94 174.22 1br4 s ASN 394 N -4.48 7.37 0.00 4.36 3.84 -1.26 -4.67 114.94 120.10 1br4 s ASN 394 Ca 0.59 1.64 0.00 0.00 0.21 0.00 0.00 52.86 55.30 1br4 s ASN 394 Cb -0.09 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.08 1br4 s ASN 394 CO 0.39 0.00 0.48 1.33 -2.79 0.00 0.00 177.10 176.51 1br4 n VAL 395 N 2.64 0.00 -0.34 -5.21 0.24 -1.26 -0.94 118.33 113.46 1br4 n VAL 395 Ca -0.01 0.98 0.17 0.00 -2.04 0.00 0.00 64.34 63.44 1br4 n VAL 395 Cb 0.49 -1.85 0.33 0.00 -1.47 0.00 0.00 33.84 31.35 1br4 n VAL 395 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1br4 n THR 396 N -0.60 -0.42 0.36 3.34 -2.24 -1.26 -0.68 114.28 112.79 1br4 n THR 396 Ca 0.00 2.17 -0.18 0.00 -2.27 0.00 0.00 64.05 63.77 1br4 n THR 396 Cb 0.00 -3.21 -0.09 0.00 -2.10 0.00 0.00 70.33 64.93 1br4 n THR 396 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1br4 h ASP 397 N 0.00 -0.91 -0.74 3.42 3.32 -1.97 -1.63 116.42 117.92 1br4 h ASP 397 Ca 0.63 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.72 1br4 h ASP 397 Cb 1.37 0.26 -0.04 0.00 0.22 0.00 0.00 39.33 41.14 1br4 h ASP 397 CO -0.92 -0.59 0.43 0.15 -1.72 0.00 0.00 179.24 176.59 1br4 h PHE 398 N -0.95 1.00 -0.20 4.55 3.57 0.66 -0.49 116.94 125.08 1br4 h PHE 398 Ca -0.08 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.41 1br4 h PHE 398 Cb 0.75 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 1br4 h PHE 398 CO -0.08 0.68 0.12 1.15 -2.23 0.00 0.00 178.31 177.96 1br4 h THR 399 N 1.04 1.04 -0.22 4.41 2.02 -0.76 -0.93 112.91 119.51 1br4 h THR 399 Ca 0.27 -0.09 -0.20 0.00 0.77 0.00 0.00 66.41 67.16 1br4 h THR 399 Cb -0.00 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1br4 h THR 399 CO -0.05 0.05 -0.64 -0.09 0.37 0.00 0.00 175.52 175.16 1br4 h ARG 400 N 0.26 0.79 -0.24 6.66 2.43 -1.06 -2.02 114.38 121.19 1br4 h ARG 400 Ca 0.08 -0.56 -0.01 0.00 -0.81 0.00 0.00 59.98 58.68 1br4 h ARG 400 Cb -0.02 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1br4 h ARG 400 CO -0.03 1.18 0.11 0.77 -1.51 0.00 0.00 179.97 180.50 1br4 h SER 401 N 0.58 0.32 0.85 -3.80 0.02 -0.96 3.60 113.55 114.15 1br4 h SER 401 Ca -0.01 -0.13 -0.12 0.00 -0.84 0.00 0.00 61.79 60.69 1br4 h SER 401 Cb 1.25 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.69 1br4 h SER 401 CO 0.13 0.36 -0.55 -0.29 -1.14 0.00 0.00 176.83 175.35 1br4 h ILE 402 N 0.26 1.18 0.00 3.27 6.09 -1.25 -3.22 117.51 123.84 1br4 h ILE 402 Ca 0.08 -2.03 0.00 0.00 -1.37 0.00 0.00 64.86 61.54 1br4 h ILE 402 Cb 0.13 2.16 0.00 0.00 0.47 0.00 0.00 36.82 39.58 1br4 h ILE 402 CO -0.01 0.54 0.00 0.18 -3.07 0.00 0.00 178.15 175.79 1br4 n LEU 403 N -3.58 0.73 -4.30 2.19 4.77 -0.76 -4.74 117.00 111.31 1br4 n LEU 403 Ca -0.00 0.29 -0.45 0.00 -0.03 0.00 0.00 56.01 55.81 1br4 n LEU 403 Cb 0.62 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 41.33 1br4 n LEU 403 CO 0.40 -0.35 0.46 0.42 -1.33 0.00 0.00 177.39 176.99 1br4 s THR 404 N -0.70 5.47 -0.08 -5.08 -4.23 1.19 -3.84 115.64 108.36 1br4 s THR 404 Ca 0.00 -2.75 -0.29 0.00 -1.18 0.00 0.00 61.69 57.47 1br4 s THR 404 Cb 0.00 -4.37 -0.07 0.00 1.34 0.00 0.00 72.50 69.40 1br4 s THR 404 CO 0.00 -1.05 2.09 -0.81 -0.54 0.00 0.00 174.62 174.31 1br4 n PRO 405 N 3.62 2.46 -1.02 3.99 -0.04 -0.93 -4.25 135.00 138.83 1br4 n PRO 405 Ca 0.15 0.82 -0.13 0.00 -0.04 0.00 0.00 63.50 64.30 1br4 n PRO 405 Cb 0.44 -3.10 -0.12 0.00 -0.04 0.00 0.00 33.50 30.69 1br4 n PRO 405 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1br4 n ARG 406 N 8.06 1.93 -0.87 0.54 0.63 -1.26 -1.36 116.66 124.34 1br4 n ARG 406 Ca 0.25 -1.15 -0.31 0.00 -0.92 0.00 0.00 57.85 55.71 1br4 n ARG 406 Cb 0.42 -1.87 0.03 0.00 0.45 0.00 0.00 32.46 31.49 1br4 n ARG 406 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1br4 n ILE 407 N 1.94 0.00 -3.34 5.15 -0.00 -1.24 -4.87 119.36 117.00 1br4 n ILE 407 Ca 0.38 -0.42 -0.22 0.00 -0.00 0.00 0.00 62.75 62.48 1br4 n ILE 407 Cb 0.77 0.00 -0.09 0.00 -0.00 0.00 0.00 39.64 40.33 1br4 n ILE 407 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 1br4 s LYS 408 N -1.63 0.73 0.00 0.38 2.20 -1.26 -4.00 119.74 116.16 1br4 s LYS 408 Ca 0.35 -1.38 0.00 0.00 -0.36 0.00 0.00 55.97 54.58 1br4 s LYS 408 Cb -0.18 -1.02 0.00 0.00 -1.51 0.00 0.00 37.83 35.12 1br4 s LYS 408 CO 0.69 -1.27 0.57 0.28 -0.36 0.00 0.00 175.35 175.26 1br4 n VAL 409 N 3.65 0.00 0.00 4.02 0.31 -1.20 -4.85 118.33 120.26 1br4 n VAL 409 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1br4 n VAL 409 Cb 0.45 -0.21 0.00 0.00 -0.91 0.00 0.00 33.84 33.17 1br4 n VAL 409 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1br4 n GLY 410 N 0.14 1.03 0.00 2.92 0.00 -1.26 -4.16 105.19 103.85 1br4 n GLY 410 Ca 0.00 -0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.08 1br4 n GLY 410 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1br4 n ARG 411 N 0.00 0.42 -1.08 1.61 1.85 -1.26 -4.80 116.66 113.40 1br4 n ARG 411 Ca 0.00 0.02 0.00 0.00 -1.00 0.00 0.00 57.85 56.87 1br4 n ARG 411 Cb 0.00 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 29.91 1br4 n ARG 411 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1br4 n ASP 412 N -1.04 0.00 -2.68 2.89 5.68 -1.26 -5.07 116.55 115.06 1br4 n ASP 412 Ca 0.10 -0.76 -0.09 0.00 -0.50 0.00 0.00 54.79 53.54 1br4 n ASP 412 Cb 0.06 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.07 1br4 n ASP 412 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 1br4 n VAL 413 N 0.00 0.88 -1.62 2.12 0.31 -1.26 -3.28 118.33 115.48 1br4 n VAL 413 Ca 0.00 -3.01 -0.38 0.00 -0.01 0.00 0.00 64.34 60.94 1br4 n VAL 413 Cb 0.00 0.66 -0.03 0.00 -0.91 0.00 0.00 33.84 33.56 1br4 n VAL 413 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1br4 s VAL 414 N -2.87 3.05 -0.14 2.52 1.01 -1.26 -4.85 120.40 117.86 1br4 s VAL 414 Ca 0.27 0.04 -0.24 0.00 0.00 0.00 0.00 61.98 62.05 1br4 s VAL 414 Cb 0.45 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 1br4 s VAL 414 CO 0.03 -0.10 0.76 -1.58 0.00 0.00 0.00 175.10 174.21 1br4 s GLN 415 N 7.65 4.32 0.29 2.72 0.74 -1.26 -3.69 119.66 130.43 1br4 s GLN 415 Ca 0.95 0.91 0.02 0.00 0.05 0.00 0.00 55.36 57.29 1br4 s GLN 415 Cb -0.21 -3.54 -0.01 0.00 1.10 0.00 0.00 33.01 30.36 1br4 s GLN 415 CO 0.28 -0.20 0.07 1.17 -0.55 0.00 0.00 175.29 176.05 1br4 n LYS 416 N 4.79 0.86 -3.82 1.67 4.81 -0.46 -4.96 118.16 121.05 1br4 n LYS 416 Ca 0.02 -2.33 -0.12 0.00 -0.87 0.00 0.00 58.31 55.00 1br4 n LYS 416 Cb 0.50 1.06 -0.12 0.00 0.02 0.00 0.00 35.03 36.48 1br4 n LYS 416 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1br4 s ALA 417 N -2.68 -0.42 0.24 3.14 0.00 -1.26 -2.18 121.76 118.59 1br4 s ALA 417 Ca 0.09 0.44 0.07 0.00 0.00 0.00 0.00 51.96 52.57 1br4 s ALA 417 Cb 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 1br4 s ALA 417 CO 0.07 -0.09 0.12 -0.65 0.00 0.00 0.00 175.76 175.20 1br4 s GLN 418 N -0.04 2.71 0.00 0.00 -0.21 -1.25 -5.01 119.66 115.86 1br4 s GLN 418 Ca -0.01 -1.13 0.00 0.00 0.02 0.00 0.00 55.36 54.23 1br4 s GLN 418 Cb -0.02 -2.45 0.00 0.00 1.00 0.00 0.00 33.01 31.55 1br4 s GLN 418 CO 0.00 0.41 0.00 2.41 -2.12 0.00 0.00 175.29 175.99 1br4 n THR 419 N -0.90 0.00 0.10 -0.19 -1.04 -1.26 -3.65 114.28 107.34 1br4 n THR 419 Ca -0.08 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.75 1br4 n THR 419 Cb 0.58 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.94 1br4 n THR 419 CO 0.00 0.00 0.00 0.07 -0.64 0.00 0.00 175.07 174.50 1br4 h LYS 420 N 0.00 0.32 0.00 -2.82 -0.00 -1.89 -2.92 116.57 109.26 1br4 h LYS 420 Ca 0.00 -0.55 0.00 0.00 -0.00 0.00 0.00 60.65 60.10 1br4 h LYS 420 Cb 0.00 0.20 0.00 0.00 -0.00 0.00 0.00 32.23 32.43 1br4 h LYS 420 CO 0.00 1.24 0.00 0.39 -0.00 0.00 0.00 179.45 181.08 1br4 n GLU 421 N -3.55 0.00 0.30 0.07 1.02 -1.26 0.11 120.64 117.33 1br4 n GLU 421 Ca -0.13 0.30 0.15 0.00 -0.02 0.00 0.00 57.16 57.45 1br4 n GLU 421 Cb 1.05 -1.18 0.73 0.00 -0.02 0.00 0.00 31.44 32.02 1br4 n GLU 421 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1br4 h GLN 422 N 0.00 0.00 -0.12 3.49 1.08 -1.91 2.36 115.11 120.01 1br4 h GLN 422 Ca 0.00 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 56.98 1br4 h GLN 422 Cb 0.00 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.44 1br4 h GLN 422 CO 0.00 0.00 -0.80 0.00 -0.95 0.00 0.00 178.83 177.08 1br4 h ALA 423 N 1.23 0.26 0.05 3.87 0.00 -1.16 -2.58 119.26 120.93 1br4 h ALA 423 Ca 0.03 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 1br4 h ALA 423 Cb 0.86 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1br4 h ALA 423 CO -0.00 0.65 -0.02 -0.44 0.00 0.00 0.00 179.25 179.44 1br4 h ASP 424 N 0.48 -0.06 -0.02 0.00 3.32 1.09 -3.05 116.42 118.19 1br4 h ASP 424 Ca -0.07 -0.60 0.01 0.00 0.02 0.00 0.00 57.03 56.39 1br4 h ASP 424 Cb 1.44 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 41.00 1br4 h ASP 424 CO 0.16 0.64 0.43 0.15 -1.72 0.00 0.00 179.24 178.90 1br4 h PHE 425 N -0.82 0.00 0.07 4.55 3.04 0.59 -0.07 116.94 124.30 1br4 h PHE 425 Ca -0.01 0.00 -0.33 0.00 3.98 0.00 0.00 57.97 61.61 1br4 h PHE 425 Cb 0.65 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.13 1br4 h PHE 425 CO 0.15 0.00 -1.84 0.00 -2.02 0.00 0.00 178.31 174.60 1br4 n ALA 426 N -1.86 1.17 0.19 2.41 0.00 -0.97 -2.85 120.51 118.60 1br4 n ALA 426 Ca -0.01 -0.66 0.07 0.00 0.00 0.00 0.00 53.44 52.84 1br4 n ALA 426 Cb 0.47 -0.78 0.19 0.00 0.00 0.00 0.00 19.45 19.33 1br4 n ALA 426 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1br4 h ILE 427 N 0.04 0.51 -0.01 0.00 2.10 -0.97 -2.72 117.51 116.46 1br4 h ILE 427 Ca -0.35 -1.56 -0.07 0.00 1.08 0.00 0.00 64.86 63.96 1br4 h ILE 427 Cb 2.03 2.12 0.00 0.00 -1.09 0.00 0.00 36.82 39.88 1br4 h ILE 427 CO 0.09 0.27 -0.26 -0.08 -1.08 0.00 0.00 178.15 177.09 1br4 h GLU 428 N 0.00 0.21 0.00 2.19 4.22 -1.24 -1.79 114.58 118.16 1br4 h GLU 428 Ca -0.00 -0.20 0.00 0.00 0.08 0.00 0.00 59.36 59.24 1br4 h GLU 428 Cb 1.10 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1br4 h GLU 428 CO 0.04 0.91 0.00 0.00 -2.18 0.00 0.00 179.01 177.77 1br4 n ALA 429 N -2.52 2.50 -0.10 2.92 0.00 -1.13 -1.59 120.51 120.58 1br4 n ALA 429 Ca -0.09 -0.02 -0.18 0.00 0.00 0.00 0.00 53.44 53.15 1br4 n ALA 429 Cb 0.50 -1.05 -0.06 0.00 0.00 0.00 0.00 19.45 18.84 1br4 n ALA 429 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1br4 n LEU 430 N -0.55 1.85 0.31 0.00 7.94 -1.03 -3.94 117.00 121.58 1br4 n LEU 430 Ca 0.02 0.32 -0.17 0.00 -1.11 0.00 0.00 56.01 55.07 1br4 n LEU 430 Cb 0.01 -0.74 -0.09 0.00 0.53 0.00 0.00 43.42 43.14 1br4 n LEU 430 CO 0.02 0.11 0.69 0.00 -1.11 0.00 0.00 177.39 177.10 1br4 h ALA 431 N -0.93 -0.73 -0.48 1.96 0.00 -1.29 0.24 119.26 118.03 1br4 h ALA 431 Ca -0.33 -0.16 0.14 0.00 0.00 0.00 0.00 54.91 54.56 1br4 h ALA 431 Cb 1.25 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 1br4 h ALA 431 CO -0.20 -0.91 0.54 1.57 0.00 0.00 0.00 179.25 180.25 1br4 h LYS 432 N -0.75 0.00 0.00 0.00 2.10 -1.54 0.72 116.57 117.10 1br4 h LYS 432 Ca -0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 1br4 h LYS 432 Cb 0.57 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.90 1br4 h LYS 432 CO 0.12 0.00 -1.12 0.00 -2.00 0.00 0.00 179.45 176.46 1br4 n ALA 433 N -2.32 3.65 0.66 0.07 0.00 -0.95 -3.85 120.51 117.76 1br4 n ALA 433 Ca 0.09 -0.45 0.13 0.00 0.00 0.00 0.00 53.44 53.21 1br4 n ALA 433 Cb 0.73 -0.60 0.45 0.00 0.00 0.00 0.00 19.45 20.03 1br4 n ALA 433 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1br4 n LYS 434 N -1.63 0.21 -0.08 0.00 4.81 0.81 -1.16 118.16 121.12 1br4 n LYS 434 Ca 0.01 0.20 -0.20 0.00 -0.87 0.00 0.00 58.31 57.45 1br4 n LYS 434 Cb 0.32 -1.76 -0.12 0.00 0.02 0.00 0.00 35.03 33.49 1br4 n LYS 434 CO 0.00 0.00 0.00 0.35 1.17 0.00 0.00 177.40 178.92 1br4 h PHE 435 N 0.00 0.05 0.00 5.64 3.57 -1.56 -3.23 116.94 121.41 1br4 h PHE 435 Ca 0.00 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1br4 h PHE 435 Cb 0.66 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.39 1br4 h PHE 435 CO 0.00 1.37 -0.14 1.49 -2.23 0.00 0.00 178.31 178.80 1br4 h GLU 436 N -0.92 0.00 0.00 1.11 4.81 -1.66 0.84 114.58 118.76 1br4 h GLU 436 Ca -0.25 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.95 1br4 h GLU 436 Cb 1.28 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.65 1br4 h GLU 436 CO -0.12 0.14 -0.13 0.00 -0.73 0.00 0.00 179.01 178.16 1br4 h ARG 437 N 0.00 0.00 0.09 1.92 2.47 -1.23 -2.84 114.38 114.80 1br4 h ARG 437 Ca -0.00 0.00 -0.27 0.00 -1.26 0.00 0.00 59.98 58.44 1br4 h ARG 437 Cb 0.32 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.63 1br4 h ARG 437 CO 0.02 0.13 -1.44 1.25 0.56 0.00 0.00 179.97 180.49 1br4 h LEU 438 N 0.00 0.31 -0.38 3.04 5.85 0.46 -3.29 115.31 121.30 1br4 h LEU 438 Ca -0.00 -0.81 0.07 0.00 0.84 0.00 0.00 57.88 57.98 1br4 h LEU 438 Cb 0.23 -0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.07 1br4 h LEU 438 CO 0.02 1.62 -0.39 0.15 -0.34 0.00 0.00 178.44 179.50 1br4 h PHE 439 N -0.39 -1.10 0.00 1.25 3.57 -0.20 0.63 116.94 120.70 1br4 h PHE 439 Ca -0.32 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.24 1br4 h PHE 439 Cb 1.70 0.54 0.00 0.00 2.79 0.00 0.00 35.95 40.98 1br4 h PHE 439 CO 0.12 -0.42 0.00 0.00 -2.23 0.00 0.00 178.31 175.78 1br4 h ARG 440 N -0.31 0.00 0.39 1.11 2.47 -1.70 -2.13 114.38 114.21 1br4 h ARG 440 Ca 0.15 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.85 1br4 h ARG 440 Cb 0.57 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.89 1br4 h ARG 440 CO -0.55 0.00 -0.19 2.35 0.56 0.00 0.00 179.97 182.15 1br4 h TRP 441 N 0.00 -0.49 0.61 3.04 7.01 0.16 -2.89 115.95 123.40 1br4 h TRP 441 Ca 0.00 -0.01 -0.03 0.00 2.11 0.00 0.00 58.89 60.96 1br4 h TRP 441 Cb 0.21 0.16 -0.00 0.00 -2.10 0.00 0.00 29.16 27.43 1br4 h TRP 441 CO 0.00 -0.17 -0.38 0.82 -2.79 0.00 0.00 178.44 175.92 1br4 h ILE 442 N -0.83 0.00 -1.53 2.65 1.08 -0.98 -1.63 117.51 116.27 1br4 h ILE 442 Ca -0.05 0.00 0.49 0.00 -0.39 0.00 0.00 64.86 64.91 1br4 h ILE 442 Cb 0.54 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 34.17 1br4 h ILE 442 CO 0.09 0.00 1.02 0.25 -0.69 0.00 0.00 178.15 178.82 1br4 h LEU 443 N -0.93 0.15 -1.07 1.44 6.46 -1.48 2.82 115.31 122.69 1br4 h LEU 443 Ca -0.08 0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.78 1br4 h LEU 443 Cb 0.75 0.10 0.00 0.00 -0.73 0.00 0.00 40.66 40.78 1br4 h LEU 443 CO 0.08 -0.16 -0.23 0.41 -0.62 0.00 0.00 178.44 177.92 1br4 n THR 444 N -4.49 0.00 0.01 1.05 -1.04 -1.05 -1.46 114.28 107.31 1br4 n THR 444 Ca 0.40 -0.28 -0.22 0.00 -2.04 0.00 0.00 64.05 61.92 1br4 n THR 444 Cb 1.65 0.95 -0.14 0.00 -1.82 0.00 0.00 70.33 70.97 1br4 n THR 444 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 1br4 h ARG 445 N 2.61 0.28 0.24 -2.82 1.12 0.57 -3.30 114.38 113.08 1br4 h ARG 445 Ca 0.00 -0.49 -0.01 0.00 -1.11 0.00 0.00 59.98 58.37 1br4 h ARG 445 Cb 0.70 0.18 0.00 0.00 -0.01 0.00 0.00 29.97 30.84 1br4 h ARG 445 CO 0.00 1.23 -0.11 0.28 -3.11 0.00 0.00 179.97 178.26 1br4 h VAL 446 N 0.07 0.00 0.00 0.20 2.07 -0.27 -3.20 116.25 115.12 1br4 h VAL 446 Ca -0.41 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 66.73 1br4 h VAL 446 Cb 2.04 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1br4 h VAL 446 CO 0.10 0.00 0.55 0.59 0.02 0.00 0.00 177.57 178.83 1br4 n ASN 447 N -3.92 0.08 0.09 0.57 3.02 -0.53 0.11 115.26 114.68 1br4 n ASN 447 Ca -0.04 0.28 -0.15 0.00 -0.03 0.00 0.00 54.58 54.64 1br4 n ASN 447 Cb 0.13 -0.14 -0.14 0.00 -0.61 0.00 0.00 39.78 39.02 1br4 n ASN 447 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1br4 h LYS 448 N 0.00 0.23 0.07 3.52 3.64 -1.63 -3.32 116.57 119.09 1br4 h LYS 448 Ca 0.00 -0.40 -0.20 0.00 -1.27 0.00 0.00 60.65 58.78 1br4 h LYS 448 Cb 1.10 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 1br4 h LYS 448 CO 0.00 1.18 -1.02 0.00 -2.27 0.00 0.00 179.45 177.34 1br4 h ALA 449 N 0.63 0.12 0.00 5.00 0.00 0.73 -3.29 119.26 122.45 1br4 h ALA 449 Ca -0.13 -0.94 0.00 0.00 0.00 0.00 0.00 54.91 53.84 1br4 h ALA 449 Cb 1.95 0.38 0.00 0.00 0.00 0.00 0.00 17.79 20.12 1br4 h ALA 449 CO 0.19 0.57 0.00 1.28 0.00 0.00 0.00 179.25 181.29 1br4 n LEU 450 N -4.19 0.30 -3.61 0.00 4.77 -1.08 -4.96 117.00 108.23 1br4 n LEU 450 Ca -0.22 -0.15 -0.16 0.00 -0.03 0.00 0.00 56.01 55.45 1br4 n LEU 450 Cb 0.76 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.64 1br4 n LEU 450 CO 0.36 0.07 0.27 -0.62 -1.33 0.00 0.00 177.39 176.15 1br4 s ASP 451 N -0.89 -0.47 0.27 -1.43 2.15 -1.24 0.37 116.67 115.43 1br4 s ASP 451 Ca 0.00 0.41 -0.10 0.00 0.43 0.00 0.00 52.55 53.29 1br4 s ASP 451 Cb 0.00 0.46 0.40 0.00 -0.30 0.00 0.00 42.92 43.48 1br4 s ASP 451 CO 0.00 -0.58 1.56 0.00 -0.17 0.00 0.00 175.17 175.98 1br4 h ALA 458 N 3.25 0.54 -1.95 3.66 0.00 -1.88 -3.48 119.26 119.40 1br4 h ALA 458 Ca -0.29 0.36 -0.45 0.00 0.00 0.00 0.00 54.91 54.54 1br4 h ALA 458 Cb 1.16 0.81 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1br4 h ALA 458 CO 0.40 -0.43 -0.34 -1.54 0.00 0.00 0.00 179.25 177.33 1br4 s SER 459 N -5.28 6.07 -0.28 0.00 1.04 -1.08 -4.99 113.70 109.18 1br4 s SER 459 Ca -0.15 -0.05 -0.21 0.00 0.48 0.00 0.00 55.95 56.02 1br4 s SER 459 Cb 0.25 -1.47 0.12 0.00 0.10 0.00 0.00 66.02 65.02 1br4 s SER 459 CO 0.76 -0.35 0.93 0.72 0.98 0.00 0.00 173.24 176.28 1br4 s PHE 460 N -2.16 -0.63 -0.13 5.02 -0.12 -1.25 -0.83 117.98 117.89 1br4 s PHE 460 Ca 0.42 1.39 -0.05 0.00 -0.05 0.00 0.00 56.93 58.65 1br4 s PHE 460 Cb -0.09 0.38 -0.04 0.00 -0.63 0.00 0.00 43.02 42.64 1br4 s PHE 460 CO 0.31 -0.31 0.04 -1.17 -0.05 0.00 0.00 175.22 174.05 1br4 s LEU 461 N 0.77 3.76 -0.16 -1.99 2.96 0.14 -2.90 118.68 121.26 1br4 s LEU 461 Ca -0.03 0.16 -0.02 0.00 -0.22 0.00 0.00 54.13 54.02 1br4 s LEU 461 Cb -0.05 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.72 1br4 s LEU 461 CO -0.10 0.31 -0.08 -0.83 -1.32 0.00 0.00 176.35 174.33 1br4 s GLY 462 N -0.43 1.62 -0.36 7.98 0.00 0.16 -0.53 107.32 115.76 1br4 s GLY 462 Ca 0.09 -0.92 0.01 0.00 0.00 0.00 0.00 44.72 43.90 1br4 s GLY 462 CO 0.02 -0.02 0.09 -0.42 0.00 0.00 0.00 173.10 172.77 1br4 s ILE 463 N 0.58 2.65 -0.58 0.90 1.01 0.85 -0.46 121.20 126.15 1br4 s ILE 463 Ca -0.05 -2.16 -0.21 0.00 0.00 0.00 0.00 60.65 58.23 1br4 s ILE 463 Cb -0.15 -2.86 0.07 0.00 0.01 0.00 0.00 42.46 39.53 1br4 s ILE 463 CO 0.03 -0.57 0.83 -0.22 0.00 0.00 0.00 174.94 175.01 1br4 s LEU 464 N 1.01 4.65 -1.05 2.97 2.96 -1.07 -1.52 118.68 126.64 1br4 s LEU 464 Ca 0.08 -0.91 -0.06 0.00 -0.22 0.00 0.00 54.13 53.02 1br4 s LEU 464 Cb -0.20 -2.50 0.27 0.00 0.50 0.00 0.00 46.19 44.26 1br4 s LEU 464 CO -0.06 -1.20 1.10 -0.67 -1.32 0.00 0.00 176.35 174.20 1br4 n ASP 465 N 7.01 5.34 -2.24 3.68 2.03 0.50 -3.90 116.55 128.97 1br4 n ASP 465 Ca -0.04 -3.14 0.00 0.00 0.52 0.00 0.00 54.79 52.13 1br4 n ASP 465 Cb 0.45 -1.27 0.00 0.00 -0.72 0.00 0.00 41.12 39.59 1br4 n ASP 465 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1br4 n ILE 466 N 2.29 0.00 -4.17 5.18 -5.35 -1.25 0.28 119.36 116.33 1br4 n ILE 466 Ca 0.24 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.43 1br4 n ILE 466 Cb 0.38 -1.92 -0.08 0.00 -1.74 0.00 0.00 39.64 36.27 1br4 n ILE 466 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1br4 s ALA 467 N -3.85 3.21 0.19 -1.28 0.00 -1.26 -4.75 121.76 114.01 1br4 s ALA 467 Ca 0.00 -1.23 -0.12 0.00 0.00 0.00 0.00 51.96 50.62 1br4 s ALA 467 Cb 0.00 -1.07 -0.07 0.00 0.00 0.00 0.00 23.12 21.98 1br4 s ALA 467 CO 0.00 0.61 0.55 0.20 0.00 0.00 0.00 175.76 177.12 1br4 s GLY 468 N -2.53 2.36 -0.91 0.00 0.00 -1.26 -4.63 107.32 100.35 1br4 s GLY 468 Ca 0.26 -0.21 -0.15 0.00 0.00 0.00 0.00 44.72 44.62 1br4 s GLY 468 CO 0.18 -0.01 2.21 0.33 0.00 0.00 0.00 173.10 175.81 1br4 n PHE 469 N 0.29 0.40 -3.91 1.90 7.35 -1.26 -3.91 117.46 118.33 1br4 n PHE 469 Ca -0.02 -0.01 -0.33 0.00 -0.76 0.00 0.00 57.45 56.33 1br4 n PHE 469 Cb 0.52 -1.24 -0.05 0.00 0.35 0.00 0.00 39.48 39.07 1br4 n PHE 469 CO 0.00 0.00 0.00 -1.83 -0.76 0.00 0.00 176.76 174.17 1br4 s GLU 470 N 7.62 3.44 -0.24 -4.13 -1.05 -1.26 -4.01 118.70 119.06 1br4 s GLU 470 Ca 1.15 -0.32 -0.03 0.00 -0.15 0.00 0.00 54.97 55.61 1br4 s GLU 470 Cb -0.58 -3.09 0.13 0.00 -0.44 0.00 0.00 34.13 30.15 1br4 s GLU 470 CO 0.39 0.67 0.40 -1.50 0.95 0.00 0.00 175.26 176.17 1br4 s ILE 471 N -1.33 -0.63 0.00 1.83 2.07 -1.26 -4.84 121.20 117.05 1br4 s ILE 471 Ca 0.27 -0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.49 1br4 s ILE 471 Cb -0.13 -0.80 0.00 0.00 0.13 0.00 0.00 42.46 41.66 1br4 s ILE 471 CO 0.19 -0.08 0.00 0.49 -1.91 0.00 0.00 174.94 173.62 1br4 n PHE 472 N 5.37 0.00 -0.02 3.50 3.01 -1.26 -5.05 117.46 123.02 1br4 n PHE 472 Ca -0.04 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.46 1br4 n PHE 472 Cb 0.50 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.86 1br4 n PHE 472 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1br4 n GLU 473 N 0.00 0.70 -3.78 -1.08 1.02 -1.26 -4.82 120.64 111.42 1br4 n GLU 473 Ca 0.00 -0.11 -0.29 0.00 -0.02 0.00 0.00 57.16 56.74 1br4 n GLU 473 Cb 0.00 -1.35 -0.15 0.00 -0.02 0.00 0.00 31.44 29.91 1br4 n GLU 473 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1br4 s ILE 474 N -2.89 0.99 -1.16 -3.67 1.09 -1.26 -5.03 121.20 109.27 1br4 s ILE 474 Ca -0.06 -1.25 -0.10 0.00 -1.10 0.00 0.00 60.65 58.14 1br4 s ILE 474 Cb 0.08 -1.61 0.24 0.00 -1.06 0.00 0.00 42.46 40.11 1br4 s ILE 474 CO 0.60 -0.48 1.33 0.59 -0.10 0.00 0.00 174.94 176.89 1br4 n ASN 475 N 4.83 5.48 -3.84 3.58 3.02 -1.26 -4.97 115.26 122.10 1br4 n ASN 475 Ca -0.05 -3.06 -0.26 0.00 -0.03 0.00 0.00 54.58 51.18 1br4 n ASN 475 Cb 0.43 -1.44 0.20 0.00 -0.61 0.00 0.00 39.78 38.36 1br4 n ASN 475 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1br4 n SER 476 N 3.67 -2.93 0.08 6.41 2.88 -1.26 -2.93 113.62 119.53 1br4 n SER 476 Ca 0.30 -0.39 -0.12 0.00 -1.33 0.00 0.00 58.87 57.33 1br4 n SER 476 Cb 0.39 -0.92 -0.07 0.00 -0.75 0.00 0.00 64.21 62.86 1br4 n SER 476 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1br4 h PHE 477 N -2.70 -0.13 -0.70 0.66 3.57 -1.92 -3.04 116.94 112.68 1br4 h PHE 477 Ca -0.41 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.20 1br4 h PHE 477 Cb 1.13 0.05 -0.12 0.00 2.79 0.00 0.00 35.95 39.80 1br4 h PHE 477 CO -1.82 -0.08 -0.37 0.93 -2.23 0.00 0.00 178.31 174.74 1br4 h GLU 478 N -0.13 -0.12 0.00 1.11 3.07 -2.01 0.60 114.58 117.10 1br4 h GLU 478 Ca -0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1br4 h GLU 478 Cb 0.11 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 1br4 h GLU 478 CO -0.00 -0.08 0.12 1.96 -1.40 0.00 0.00 179.01 179.61 1br4 h GLN 479 N -0.13 0.00 0.01 2.33 7.50 -1.86 -1.87 115.11 121.09 1br4 h GLN 479 Ca 0.25 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 59.40 1br4 h GLN 479 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.09 1br4 h GLN 479 CO -0.77 0.00 -0.00 1.25 -1.50 0.00 0.00 178.83 177.81 1br4 h LEU 480 N 0.00 -0.01 -1.30 1.46 5.85 0.24 -2.84 115.31 118.70 1br4 h LEU 480 Ca 0.00 -0.80 -0.03 0.00 0.84 0.00 0.00 57.88 57.89 1br4 h LEU 480 Cb 0.25 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 1br4 h LEU 480 CO 0.00 0.86 -0.14 0.00 -0.34 0.00 0.00 178.44 178.82 1br4 h ILE 482 N 0.00 0.00 0.00 0.00 2.04 -1.44 -0.83 117.51 117.29 1br4 h ILE 482 Ca -0.00 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 1br4 h ILE 482 Cb 0.63 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1br4 h ILE 482 CO 0.02 0.00 -0.17 0.78 0.00 0.00 0.00 178.15 178.78 1br4 h ASN 483 N -0.99 0.00 -0.54 1.72 4.21 -1.45 -2.18 115.58 116.35 1br4 h ASN 483 Ca -0.08 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.46 1br4 h ASN 483 Cb 0.57 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.73 1br4 h ASN 483 CO 0.12 0.17 0.33 0.22 -1.29 0.00 0.00 177.43 176.98 1br4 h TYR 484 N 0.00 0.61 -0.61 1.19 3.20 -0.59 -1.61 116.97 119.16 1br4 h TYR 484 Ca -0.00 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 1br4 h TYR 484 Cb 0.33 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 1br4 h TYR 484 CO 0.00 0.35 0.08 1.15 -1.64 0.00 0.00 178.16 178.11 1br4 h THR 485 N 0.65 1.25 0.08 1.81 2.02 -0.51 -2.55 112.91 115.67 1br4 h THR 485 Ca 0.21 -1.01 0.01 0.00 0.77 0.00 0.00 66.41 66.40 1br4 h THR 485 Cb 0.01 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 1br4 h THR 485 CO -0.09 0.37 -0.15 0.78 0.37 0.00 0.00 175.52 176.80 1br4 h ASN 486 N 0.94 -0.42 -0.69 4.18 -0.26 -1.14 -0.83 115.58 117.35 1br4 h ASN 486 Ca 0.19 0.05 0.07 0.00 -0.56 0.00 0.00 56.30 56.05 1br4 h ASN 486 Cb 0.43 0.16 -0.04 0.00 -1.06 0.00 0.00 38.32 37.81 1br4 h ASN 486 CO 0.01 -0.22 0.45 -0.08 -1.06 0.00 0.00 177.43 176.54 1br4 h GLU 487 N -0.29 0.66 -0.15 0.81 4.57 -1.19 0.10 114.58 119.08 1br4 h GLU 487 Ca 0.03 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.15 1br4 h GLU 487 Cb 0.31 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.75 1br4 h GLU 487 CO -0.09 0.43 0.03 0.87 -1.18 0.00 0.00 179.01 179.08 1br4 h LYS 488 N 0.68 0.25 -0.30 1.92 1.79 -0.93 -0.80 116.57 119.19 1br4 h LYS 488 Ca 0.30 -0.06 -0.10 0.00 -2.18 0.00 0.00 60.65 58.61 1br4 h LYS 488 Cb 0.30 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 1br4 h LYS 488 CO -0.10 0.41 -0.22 1.25 -1.08 0.00 0.00 179.45 179.71 1br4 h LEU 489 N 0.05 0.56 -0.60 2.94 5.85 -0.39 -2.18 115.31 121.54 1br4 h LEU 489 Ca 0.05 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 1br4 h LEU 489 Cb 0.27 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1br4 h LEU 489 CO 0.00 0.78 0.31 -0.61 -0.34 0.00 0.00 178.44 178.58 1br4 h GLN 490 N 0.50 0.85 -0.61 1.25 5.75 -0.63 -2.09 115.11 120.13 1br4 h GLN 490 Ca 0.08 -0.12 -0.03 0.00 -0.15 0.00 0.00 58.65 58.44 1br4 h GLN 490 Cb 0.66 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 29.02 1br4 h GLN 490 CO 0.05 0.67 0.28 0.37 -2.65 0.00 0.00 178.83 177.55 1br4 h GLN 491 N 0.82 0.89 -0.60 1.69 5.75 -0.87 -2.68 115.11 120.10 1br4 h GLN 491 Ca 0.21 -0.14 0.10 0.00 -0.15 0.00 0.00 58.65 58.67 1br4 h GLN 491 Cb 0.09 -0.16 -0.08 0.00 1.07 0.00 0.00 27.48 28.41 1br4 h GLN 491 CO -0.03 0.72 0.19 1.25 -2.65 0.00 0.00 178.83 178.31 1br4 h LEU 492 N 0.84 0.14 0.43 -2.39 5.85 -0.98 -0.18 115.31 119.01 1br4 h LEU 492 Ca 0.21 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 59.00 1br4 h LEU 492 Cb 0.14 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1br4 h LEU 492 CO -0.02 0.08 -0.28 0.15 -0.34 0.00 0.00 178.44 178.03 1br4 h PHE 493 N 0.35 -0.73 -0.66 1.25 3.57 -1.08 -0.41 116.94 119.23 1br4 h PHE 493 Ca 0.31 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.88 1br4 h PHE 493 Cb 0.41 0.26 -0.07 0.00 2.79 0.00 0.00 35.95 39.34 1br4 h PHE 493 CO -0.20 -0.42 0.32 -0.91 -2.23 0.00 0.00 178.31 174.87 1br4 h ASN 494 N -0.68 0.41 0.66 0.41 -0.26 -1.18 0.20 115.58 115.14 1br4 h ASN 494 Ca -0.05 0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 55.72 1br4 h ASN 494 Cb 0.56 -0.01 0.01 0.00 -1.06 0.00 0.00 38.32 37.82 1br4 h ASN 494 CO 0.04 0.25 -0.33 -0.74 -1.06 0.00 0.00 177.43 175.59 1br4 h HIS 495 N 0.56 -0.86 0.00 1.19 2.76 -0.81 -0.94 115.15 117.06 1br4 h HIS 495 Ca 0.32 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.46 1br4 h HIS 495 Cb 0.31 0.29 -0.00 0.00 1.55 0.00 0.00 27.41 29.56 1br4 h HIS 495 CO -0.12 -0.53 -0.02 1.79 -1.30 0.00 0.00 177.93 177.76 1br4 h THR 496 N -0.91 0.62 0.00 6.26 1.35 -1.01 0.50 112.91 119.73 1br4 h THR 496 Ca -0.09 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1br4 h THR 496 Cb 0.70 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1br4 h THR 496 CO 0.14 0.02 0.00 0.23 -0.25 0.00 0.00 175.52 175.66 1br4 n MET 497 N -3.94 0.00 0.18 4.72 2.00 0.05 -3.89 117.12 116.24 1br4 n MET 497 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 57.70 57.57 1br4 n MET 497 Cb 0.11 -0.23 -0.05 0.00 0.00 0.00 0.00 33.22 33.04 1br4 n MET 497 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 175.97 176.71 1br4 h PHE 498 N 0.00 -0.49 0.00 2.03 0.04 -1.30 -3.33 116.94 113.89 1br4 h PHE 498 Ca 0.00 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.76 1br4 h PHE 498 Cb 0.00 0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.31 1br4 h PHE 498 CO 0.00 -0.23 0.00 -0.89 -0.60 0.00 0.00 178.31 176.59 1br4 n ILE 499 N -5.13 0.00 -0.05 -0.55 5.41 -0.99 -2.94 119.36 115.11 1br4 n ILE 499 Ca -0.08 0.28 -0.01 0.00 1.00 0.00 0.00 62.75 63.94 1br4 n ILE 499 Cb 0.24 -1.02 -0.01 0.00 -0.71 0.00 0.00 39.64 38.14 1br4 n ILE 499 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1br4 n LEU 500 N 0.00 -0.12 -0.34 1.39 4.77 0.17 -1.21 117.00 121.66 1br4 n LEU 500 Ca 0.00 0.48 -0.02 0.00 -0.03 0.00 0.00 56.01 56.43 1br4 n LEU 500 Cb 0.00 -0.16 0.03 0.00 -2.33 0.00 0.00 43.42 40.96 1br4 n LEU 500 CO 0.00 -0.30 0.59 -0.08 -1.33 0.00 0.00 177.39 176.27 1br4 h GLU 501 N 0.00 -0.04 -1.01 3.23 4.57 -1.68 0.61 114.58 120.27 1br4 h GLU 501 Ca 0.02 0.00 0.22 0.00 -1.18 0.00 0.00 59.36 58.42 1br4 h GLU 501 Cb 0.05 0.01 -0.11 0.00 -0.16 0.00 0.00 28.75 28.53 1br4 h GLU 501 CO -0.11 -0.02 0.61 0.37 -1.18 0.00 0.00 179.01 178.68 1br4 h GLN 502 N -0.04 0.64 -0.51 1.92 4.15 -1.04 0.25 115.11 120.49 1br4 h GLN 502 Ca 0.32 -0.04 0.10 0.00 0.77 0.00 0.00 58.65 59.80 1br4 h GLN 502 Cb 0.58 -0.14 -0.08 0.00 0.21 0.00 0.00 27.48 28.05 1br4 h GLN 502 CO -0.92 0.42 -0.00 0.93 -1.93 0.00 0.00 178.83 177.33 1br4 h GLU 503 N 0.66 0.11 0.00 1.69 4.39 0.31 0.17 114.58 121.91 1br4 h GLU 503 Ca 0.61 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 60.29 1br4 h GLU 503 Cb 1.08 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1br4 h GLU 503 CO -0.41 0.07 -0.04 1.49 -1.16 0.00 0.00 179.01 178.96 1br4 h GLU 504 N 0.11 0.00 -0.10 2.33 4.57 -0.85 0.16 114.58 120.81 1br4 h GLU 504 Ca 0.26 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.37 1br4 h GLU 504 Cb 0.39 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 1br4 h GLU 504 CO -0.43 0.04 -0.21 1.88 -1.18 0.00 0.00 179.01 179.12 1br4 h TYR 505 N 0.00 0.41 -0.21 0.92 0.05 -0.56 -2.52 116.97 115.06 1br4 h TYR 505 Ca -0.00 -0.15 -0.02 0.00 0.05 0.00 0.00 58.73 58.61 1br4 h TYR 505 Cb 0.17 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.83 1br4 h TYR 505 CO 0.00 0.82 0.06 1.96 -1.05 0.00 0.00 178.16 179.95 1br4 h GLN 506 N -0.12 0.34 -0.19 4.88 4.20 -0.49 -1.40 115.11 122.32 1br4 h GLN 506 Ca 0.00 -0.07 0.04 0.00 0.06 0.00 0.00 58.65 58.68 1br4 h GLN 506 Cb 0.80 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.50 1br4 h GLN 506 CO 0.05 0.44 -0.04 0.00 -0.67 0.00 0.00 178.83 178.60 1br4 h ARG 507 N 0.17 0.00 0.00 1.46 3.08 -0.78 -2.50 114.38 115.82 1br4 h ARG 507 Ca 0.07 -0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.01 1br4 h ARG 507 Cb 0.24 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1br4 h ARG 507 CO -0.00 0.00 -0.50 0.93 -1.07 0.00 0.00 179.97 179.33 1br4 h GLU 508 N 0.00 0.00 0.00 0.04 4.39 -1.47 -3.48 114.58 114.06 1br4 h GLU 508 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1br4 h GLU 508 Cb 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1br4 h GLU 508 CO -0.19 0.50 0.00 0.41 -1.16 0.00 0.00 179.01 178.57 1br4 n GLY 509 N 0.39 0.95 2.81 -3.84 0.00 -0.54 -3.24 105.19 101.71 1br4 n GLY 509 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1br4 n GLY 509 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1br4 n ILE 510 N -2.00 0.77 -1.58 -0.61 -6.64 -1.12 -4.53 119.36 103.64 1br4 n ILE 510 Ca 0.00 -0.42 -0.18 0.00 -1.77 0.00 0.00 62.75 60.38 1br4 n ILE 510 Cb 0.00 0.00 -0.11 0.00 -1.44 0.00 0.00 39.64 38.09 1br4 n ILE 510 CO 0.00 0.00 0.00 1.21 -1.77 0.00 0.00 176.55 175.99 1br4 n GLU 511 N 1.08 0.31 -3.19 6.28 2.13 -1.26 -4.79 120.64 121.19 1br4 n GLU 511 Ca 0.11 -1.77 -0.16 0.00 0.66 0.00 0.00 57.16 55.99 1br4 n GLU 511 Cb 0.31 -3.83 -0.03 0.00 0.27 0.00 0.00 31.44 28.17 1br4 n GLU 511 CO 0.00 0.00 0.00 1.87 -0.41 0.00 0.00 177.13 178.59 1br4 n TRP 512 N 18.57 0.18 -3.63 4.31 -0.00 -1.26 -5.13 117.44 130.49 1br4 n TRP 512 Ca 0.42 -1.26 -0.13 0.00 -0.00 0.00 0.00 57.50 56.53 1br4 n TRP 512 Cb 0.47 -0.19 -0.07 0.00 -0.00 0.00 0.00 31.31 31.52 1br4 n TRP 512 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1br4 s ASN 513 N -2.48 -0.66 0.48 5.87 4.22 -1.26 -5.08 114.94 116.03 1br4 s ASN 513 Ca 0.04 1.25 -0.21 0.00 -2.14 0.00 0.00 52.86 51.80 1br4 s ASN 513 Cb -0.00 1.26 -0.08 0.00 1.28 0.00 0.00 41.25 43.70 1br4 s ASN 513 CO 0.03 -0.24 1.05 0.12 -2.04 0.00 0.00 177.10 176.02 1br4 s PHE 514 N 0.26 3.00 -0.08 1.54 5.36 -1.26 -5.05 117.98 121.75 1br4 s PHE 514 Ca 0.00 1.58 -0.03 0.00 -0.96 0.00 0.00 56.93 57.53 1br4 s PHE 514 Cb -0.05 -3.10 0.04 0.00 -0.34 0.00 0.00 43.02 39.57 1br4 s PHE 514 CO -0.01 -0.88 0.06 0.42 -1.46 0.00 0.00 175.22 173.36 1br4 s ILE 515 N -1.91 -0.07 -0.42 3.12 1.01 -1.26 -5.12 121.20 116.55 1br4 s ILE 515 Ca 0.66 0.24 -0.25 0.00 0.00 0.00 0.00 60.65 61.31 1br4 s ILE 515 Cb -0.18 -0.30 0.02 0.00 0.01 0.00 0.00 42.46 42.02 1br4 s ILE 515 CO 0.22 0.06 0.88 -0.62 0.00 0.00 0.00 174.94 175.47 1br4 s ASP 516 N 2.15 6.53 0.00 3.58 -1.08 -1.26 -4.91 116.67 121.68 1br4 s ASP 516 Ca 0.04 0.21 0.07 0.00 -0.52 0.00 0.00 52.55 52.35 1br4 s ASP 516 Cb -0.13 -2.43 0.41 0.00 -1.46 0.00 0.00 42.92 39.30 1br4 s ASP 516 CO -0.05 -0.93 1.26 0.49 0.52 0.00 0.00 175.17 176.46 1br4 n PHE 517 N 6.88 0.01 -3.73 -5.34 3.01 -1.26 -4.92 117.46 112.11 1br4 n PHE 517 Ca 0.05 -0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.23 1br4 n PHE 517 Cb 0.48 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.98 1br4 n PHE 517 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1br4 n GLY 518 N 0.61 -0.73 2.72 1.37 0.00 -1.26 -4.97 105.19 102.93 1br4 n GLY 518 Ca 0.05 0.35 -0.19 0.00 0.00 0.00 0.00 46.02 46.23 1br4 n GLY 518 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1br4 s LEU 519 N -6.57 -0.06 -0.26 0.99 1.43 -1.26 -5.10 118.68 107.85 1br4 s LEU 519 Ca 0.31 -0.98 -0.14 0.00 -1.03 0.00 0.00 54.13 52.28 1br4 s LEU 519 Cb -0.10 0.35 0.08 0.00 0.03 0.00 0.00 46.19 46.54 1br4 s LEU 519 CO 0.86 -0.38 0.63 -0.62 0.23 0.00 0.00 176.35 177.07 1br4 s ASP 520 N 2.18 -0.87 -0.00 2.29 2.15 -1.26 -4.78 116.67 116.37 1br4 s ASP 520 Ca 0.10 1.40 0.02 0.00 0.43 0.00 0.00 52.55 54.51 1br4 s ASP 520 Cb -0.15 1.31 0.06 0.00 -0.30 0.00 0.00 42.92 43.84 1br4 s ASP 520 CO -0.29 -0.23 1.05 0.18 -0.17 0.00 0.00 175.17 175.71 1br4 n LEU 521 N 4.36 2.19 -0.29 -1.34 4.77 -1.26 -4.74 117.00 120.69 1br4 n LEU 521 Ca -0.20 -2.02 0.02 0.00 -0.03 0.00 0.00 56.01 53.78 1br4 n LEU 521 Cb 0.58 -0.05 0.09 0.00 -2.33 0.00 0.00 43.42 41.71 1br4 n LEU 521 CO -0.00 0.55 0.68 -0.61 -1.33 0.00 0.00 177.39 176.68 1br4 h GLN 522 N 0.40 -0.01 0.14 3.23 5.75 -1.95 -1.43 115.11 121.23 1br4 h GLN 522 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1br4 h GLN 522 Cb 0.55 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.08 1br4 h GLN 522 CO 0.00 -0.01 -0.33 -1.00 -2.65 0.00 0.00 178.83 174.84 1br4 h PRO 523 N -0.02 -0.51 0.00 -2.39 0.13 -2.00 0.81 132.00 128.03 1br4 h PRO 523 Ca 0.38 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.54 1br4 h PRO 523 Cb 0.60 0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1br4 h PRO 523 CO -0.84 -0.34 0.13 0.00 -0.23 0.00 0.00 178.00 176.72 1br4 n ILE 525 N -1.31 1.46 -0.34 0.00 5.41 0.07 -4.23 119.36 120.41 1br4 n ILE 525 Ca 0.00 0.11 0.15 0.00 1.00 0.00 0.00 62.75 64.01 1br4 n ILE 525 Cb 0.13 -2.27 0.36 0.00 -0.71 0.00 0.00 39.64 37.15 1br4 n ILE 525 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1br4 h GLU 526 N -1.00 0.65 0.00 0.38 4.39 0.63 2.08 114.58 121.72 1br4 h GLU 526 Ca -0.13 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.53 1br4 h GLU 526 Cb 0.83 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1br4 h GLU 526 CO -0.08 0.43 0.19 -0.11 -1.16 0.00 0.00 179.01 178.28 1br4 n LEU 527 N -4.77 0.20 0.00 1.33 0.00 -0.20 -0.22 117.00 113.34 1br4 n LEU 527 Ca 0.24 0.48 0.00 0.00 0.00 0.00 0.00 56.01 56.73 1br4 n LEU 527 Cb 0.65 -0.47 0.00 0.00 0.00 0.00 0.00 43.42 43.60 1br4 n LEU 527 CO 0.21 -0.54 0.08 0.00 0.00 0.00 0.00 177.39 177.13 1br4 n ILE 528 N -1.72 0.00 0.00 1.96 0.13 0.35 -1.13 119.36 118.95 1br4 n ILE 528 Ca -0.01 -0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.64 1br4 n ILE 528 Cb 0.20 1.69 0.00 0.00 -0.84 0.00 0.00 39.64 40.69 1br4 n ILE 528 CO 0.00 0.00 0.00 1.21 2.80 0.00 0.00 176.55 180.56 1br4 n GLU 529 N -0.00 0.00 -1.67 9.51 2.13 0.62 -4.31 120.64 126.91 1br4 n GLU 529 Ca 0.00 0.00 -0.62 0.00 0.66 0.00 0.00 57.16 57.20 1br4 n GLU 529 Cb 0.33 -0.05 -0.09 0.00 0.27 0.00 0.00 31.44 31.90 1br4 n GLU 529 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1br4 n ARG 530 N -1.52 0.37 -0.06 5.31 0.63 -1.15 -4.56 116.66 115.68 1br4 n ARG 530 Ca 0.00 0.13 -0.04 0.00 -0.92 0.00 0.00 57.85 57.03 1br4 n ARG 530 Cb 0.00 -1.69 -0.01 0.00 0.45 0.00 0.00 32.46 31.21 1br4 n ARG 530 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1br4 h PRO 531 N 5.03 0.00 -7.33 -0.14 0.13 -1.91 -0.86 132.00 126.93 1br4 h PRO 531 Ca -0.46 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.19 1br4 h PRO 531 Cb 1.37 0.00 0.15 0.00 0.13 0.00 0.00 31.00 32.65 1br4 h PRO 531 CO 0.89 0.00 0.24 0.95 -0.23 0.00 0.00 178.00 179.84 1br4 s THR 532 N -2.05 2.57 0.00 1.56 -4.23 -1.26 -3.88 115.64 108.35 1br4 s THR 532 Ca -0.11 0.19 0.00 0.00 -1.18 0.00 0.00 61.69 60.58 1br4 s THR 532 Cb 0.02 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.22 1br4 s THR 532 CO 0.17 -0.24 0.00 0.59 -0.54 0.00 0.00 174.62 174.60 1br4 n ASN 533 N -3.96 -5.37 -4.65 3.99 3.02 -1.26 -4.44 115.26 102.59 1br4 n ASN 533 Ca 0.07 0.00 -0.64 0.00 -0.03 0.00 0.00 54.58 53.98 1br4 n ASN 533 Cb 0.55 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.63 1br4 n ASN 533 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1br4 n PRO 534 N -1.64 0.11 -1.84 3.52 -0.02 -1.26 -4.86 135.00 129.00 1br4 n PRO 534 Ca 0.00 0.04 -0.31 0.00 -2.02 0.00 0.00 63.50 61.21 1br4 n PRO 534 Cb 0.00 -1.56 0.02 0.00 -0.02 0.00 0.00 33.50 31.95 1br4 n PRO 534 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1br4 s PRO 535 N 1.89 3.35 0.17 0.52 0.04 -1.25 -4.48 135.00 135.23 1br4 s PRO 535 Ca 0.99 0.91 0.05 0.00 0.04 0.00 0.00 61.00 63.00 1br4 s PRO 535 Cb -1.37 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 31.08 1br4 s PRO 535 CO 0.71 -0.77 0.13 0.20 0.04 0.00 0.00 177.00 177.31 1br4 s GLY 536 N -3.71 1.71 0.25 0.56 0.00 -0.33 -4.88 107.32 100.93 1br4 s GLY 536 Ca 0.58 -1.22 0.17 0.00 0.00 0.00 0.00 44.72 44.25 1br4 s GLY 536 CO 0.49 -1.23 0.96 -0.62 0.00 0.00 0.00 173.10 172.70 1br4 n VAL 537 N -0.34 -0.20 0.04 1.40 0.31 -0.28 0.12 118.33 119.38 1br4 n VAL 537 Ca -0.08 1.16 -0.22 0.00 -0.01 0.00 0.00 64.34 65.18 1br4 n VAL 537 Cb 0.55 -1.89 -0.14 0.00 -0.91 0.00 0.00 33.84 31.44 1br4 n VAL 537 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1br4 h LEU 538 N 0.00 0.49 -0.34 7.52 6.46 -1.85 -3.16 115.31 124.43 1br4 h LEU 538 Ca 0.53 -0.89 0.08 0.00 -0.12 0.00 0.00 57.88 57.47 1br4 h LEU 538 Cb 1.59 -0.16 -0.08 0.00 -0.73 0.00 0.00 40.66 41.28 1br4 h LEU 538 CO -0.36 1.68 -0.24 0.00 -0.62 0.00 0.00 178.44 178.90 1br4 h ALA 539 N 0.02 -0.03 0.50 1.25 0.00 0.65 0.78 119.26 122.44 1br4 h ALA 539 Ca -0.31 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1br4 h ALA 539 Cb 1.89 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 20.19 1br4 h ALA 539 CO 0.11 -0.63 -0.47 -0.07 0.00 0.00 0.00 179.25 178.20 1br4 h LEU 540 N -0.19 -1.26 -0.79 0.00 3.38 -1.34 -2.54 115.31 112.57 1br4 h LEU 540 Ca 0.17 0.10 0.18 0.00 0.09 0.00 0.00 57.88 58.42 1br4 h LEU 540 Cb 0.46 0.41 -0.14 0.00 0.09 0.00 0.00 40.66 41.48 1br4 h LEU 540 CO -0.46 -0.63 -0.01 0.25 0.09 0.00 0.00 178.44 177.68 1br4 h LEU 541 N -0.96 -0.40 0.00 1.67 5.85 -1.40 -2.49 115.31 117.58 1br4 h LEU 541 Ca -0.06 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1br4 h LEU 541 Cb 0.82 0.37 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1br4 h LEU 541 CO -0.04 -0.21 0.00 0.47 -0.34 0.00 0.00 178.44 178.33 1br4 n ASP 542 N -5.38 0.00 -0.09 1.25 8.00 0.23 -1.35 116.55 119.21 1br4 n ASP 542 Ca 0.14 0.29 -0.13 0.00 0.71 0.00 0.00 54.79 55.80 1br4 n ASP 542 Cb 0.50 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.55 1br4 n ASP 542 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1br4 h GLU 543 N 0.00 0.63 -0.18 -1.24 9.09 -1.60 -2.95 114.58 118.33 1br4 h GLU 543 Ca 0.00 -0.31 0.05 0.00 0.05 0.00 0.00 59.36 59.15 1br4 h GLU 543 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.09 1br4 h GLU 543 CO 0.00 0.91 0.65 1.49 0.05 0.00 0.00 179.01 182.11 1br4 h GLU 544 N 0.37 0.00 0.00 1.06 4.22 -1.28 1.85 114.58 120.79 1br4 h GLU 544 Ca 0.05 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.43 1br4 h GLU 544 Cb 0.77 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1br4 h GLU 544 CO 0.06 0.00 -0.70 0.00 -2.18 0.00 0.00 179.01 176.19 1br4 h TRP 546 N 0.00 0.00 -3.92 0.00 4.06 0.28 -3.45 115.95 112.92 1br4 h TRP 546 Ca -0.04 0.00 -0.50 0.00 2.06 0.00 0.00 58.89 60.41 1br4 h TRP 546 Cb 1.22 0.00 0.04 0.00 -1.00 0.00 0.00 29.16 29.42 1br4 h TRP 546 CO 0.00 0.00 0.49 0.12 -3.56 0.00 0.00 178.44 175.49 1br4 s PHE 547 N -3.52 3.18 0.03 0.49 2.19 -1.20 -5.01 117.98 114.14 1br4 s PHE 547 Ca 0.02 1.58 -0.26 0.00 0.33 0.00 0.00 56.93 58.60 1br4 s PHE 547 Cb 0.09 -3.35 -0.17 0.00 -1.31 0.00 0.00 43.02 38.28 1br4 s PHE 547 CO 0.48 -1.12 1.41 -1.00 1.83 0.00 0.00 175.22 176.82 1br4 h PRO 548 N 2.84 -0.39 -1.75 10.12 0.13 -1.90 -3.06 132.00 137.99 1br4 h PRO 548 Ca -0.48 0.03 -0.38 0.00 -0.87 0.00 0.00 66.00 64.29 1br4 h PRO 548 Cb 1.23 0.09 -0.15 0.00 0.13 0.00 0.00 31.00 32.30 1br4 h PRO 548 CO 0.63 -0.12 0.35 1.17 -0.23 0.00 0.00 178.00 179.80 1br4 n LYS 549 N -5.17 2.04 -3.90 0.86 4.81 -1.26 -4.89 118.16 110.64 1br4 n LYS 549 Ca -0.10 -1.81 -0.36 0.00 -0.87 0.00 0.00 58.31 55.17 1br4 n LYS 549 Cb 0.24 -1.84 -0.07 0.00 0.02 0.00 0.00 35.03 33.38 1br4 n LYS 549 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1br4 s ALA 550 N -1.58 3.73 0.10 3.14 0.00 -1.16 -5.00 121.76 121.00 1br4 s ALA 550 Ca 0.44 -0.68 -0.06 0.00 0.00 0.00 0.00 51.96 51.66 1br4 s ALA 550 Cb 0.30 -1.97 -0.02 0.00 0.00 0.00 0.00 23.12 21.43 1br4 s ALA 550 CO -0.09 0.46 0.13 0.95 0.00 0.00 0.00 175.76 177.22 1br4 s THR 551 N -0.55 0.14 0.20 0.00 -4.23 -1.26 -5.02 115.64 104.91 1br4 s THR 551 Ca 0.12 -1.50 -0.20 0.00 -1.18 0.00 0.00 61.69 58.93 1br4 s THR 551 Cb -0.12 -1.61 0.15 0.00 1.34 0.00 0.00 72.50 72.27 1br4 s THR 551 CO 0.02 -0.63 1.58 0.44 -0.54 0.00 0.00 174.62 175.49 1br4 h ASP 552 N 2.82 -1.19 0.00 3.99 3.32 -1.98 -2.32 116.42 121.07 1br4 h ASP 552 Ca -0.34 0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.96 1br4 h ASP 552 Cb 1.19 0.60 0.00 0.00 0.22 0.00 0.00 39.33 41.34 1br4 h ASP 552 CO 0.57 -0.30 0.00 0.41 -1.72 0.00 0.00 179.24 178.20 1br4 n THR 553 N -5.44 0.00 0.00 0.35 -1.04 -1.26 -2.85 114.28 104.04 1br4 n THR 553 Ca 0.06 0.71 0.00 0.00 -2.04 0.00 0.00 64.05 62.77 1br4 n THR 553 Cb 0.36 -1.46 0.00 0.00 -1.82 0.00 0.00 70.33 67.41 1br4 n THR 553 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1br4 n SER 554 N -0.31 0.00 0.06 8.00 3.41 -1.12 0.15 113.62 123.82 1br4 n SER 554 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 1br4 n SER 554 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 1br4 n SER 554 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1br4 h PHE 555 N 0.00 -0.87 -0.94 7.33 3.57 -1.27 -2.65 116.94 122.11 1br4 h PHE 555 Ca 0.00 0.02 0.21 0.00 3.53 0.00 0.00 57.97 61.73 1br4 h PHE 555 Cb 0.00 0.37 -0.18 0.00 2.79 0.00 0.00 35.95 38.93 1br4 h PHE 555 CO 0.00 -0.34 -0.16 0.28 -2.23 0.00 0.00 178.31 175.87 1br4 n VAL 556 N -4.15 -0.40 -0.15 1.41 0.31 0.38 0.35 118.33 116.08 1br4 n VAL 556 Ca -0.05 2.13 -0.02 0.00 -0.01 0.00 0.00 64.34 66.40 1br4 n VAL 556 Cb 0.23 -3.00 0.21 0.00 -0.91 0.00 0.00 33.84 30.37 1br4 n VAL 556 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1br4 h GLU 557 N 0.00 0.87 -0.43 5.55 9.09 -1.55 -2.17 114.58 125.94 1br4 h GLU 557 Ca 0.49 -0.14 0.00 0.00 0.05 0.00 0.00 59.36 59.76 1br4 h GLU 557 Cb 0.84 -0.15 -0.02 0.00 -1.65 0.00 0.00 28.75 27.77 1br4 h GLU 557 CO -0.95 0.72 0.27 -0.22 0.05 0.00 0.00 179.01 178.89 1br4 h LYS 558 N 0.85 0.58 -0.78 1.06 3.64 0.24 0.78 116.57 122.94 1br4 h LYS 558 Ca 0.20 -0.04 0.16 0.00 -1.27 0.00 0.00 60.65 59.70 1br4 h LYS 558 Cb 0.19 -0.13 -0.10 0.00 -0.41 0.00 0.00 32.23 31.78 1br4 h LYS 558 CO -0.02 0.40 0.31 1.25 -2.27 0.00 0.00 179.45 179.13 1br4 h LEU 559 N 0.58 0.27 -0.11 5.20 5.85 -0.71 0.82 115.31 127.21 1br4 h LEU 559 Ca 0.16 0.12 -0.21 0.00 0.84 0.00 0.00 57.88 58.79 1br4 h LEU 559 Cb -0.04 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1br4 h LEU 559 CO -0.03 0.08 -0.97 0.40 -0.34 0.00 0.00 178.44 177.58 1br4 h ILE 560 N 0.43 1.62 0.00 4.05 2.04 -1.28 -0.38 117.51 123.99 1br4 h ILE 560 Ca 0.44 -3.09 0.00 0.00 1.00 0.00 0.00 64.86 63.21 1br4 h ILE 560 Cb 0.71 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 39.51 1br4 h ILE 560 CO -0.44 0.89 0.14 0.00 0.00 0.00 0.00 178.15 178.74 1br4 n GLN 561 N -3.48 0.00 0.00 2.37 6.02 0.27 -1.93 117.38 120.63 1br4 n GLN 561 Ca -0.02 0.37 0.00 0.00 -0.01 0.00 0.00 57.00 57.34 1br4 n GLN 561 Cb 0.89 -1.64 0.00 0.00 1.02 0.00 0.00 30.24 30.51 1br4 n GLN 561 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1br4 n GLU 562 N -1.37 0.00 0.00 -1.09 4.71 -1.16 -4.90 120.64 116.82 1br4 n GLU 562 Ca -0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.16 57.27 1br4 n GLU 562 Cb 0.14 -0.42 0.16 0.00 -1.01 0.00 0.00 31.44 30.31 1br4 n GLU 562 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1br4 n GLN 563 N -1.12 1.02 0.00 3.49 3.00 -0.16 -4.42 117.38 119.19 1br4 n GLN 563 Ca 0.00 -0.76 0.00 0.00 -0.01 0.00 0.00 57.00 56.23 1br4 n GLN 563 Cb 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 30.24 28.76 1br4 n GLN 563 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1br4 n GLY 564 N 1.39 -0.18 1.75 1.08 0.00 -0.81 -0.71 105.19 107.70 1br4 n GLY 564 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 1br4 n GLY 564 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1br4 n ASN 565 N -1.15 4.54 -4.34 1.61 3.02 -1.26 -5.00 115.26 112.68 1br4 n ASN 565 Ca 0.00 -3.78 -0.33 0.00 -0.03 0.00 0.00 54.58 50.43 1br4 n ASN 565 Cb 0.27 -0.55 -0.14 0.00 -0.61 0.00 0.00 39.78 38.75 1br4 n ASN 565 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1br4 s HIS 566 N -3.53 2.83 0.09 3.10 2.46 0.11 -5.03 115.29 115.32 1br4 s HIS 566 Ca 0.51 -0.75 -0.32 0.00 0.47 0.00 0.00 55.06 54.96 1br4 s HIS 566 Cb 0.43 -1.88 -0.14 0.00 -0.13 0.00 0.00 32.58 30.85 1br4 s HIS 566 CO 0.01 -0.30 1.51 0.00 -2.47 0.00 0.00 174.74 173.49 1br4 h ALA 567 N 6.98 -0.98 0.00 1.58 0.00 -1.94 0.23 119.26 125.13 1br4 h ALA 567 Ca -0.29 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1br4 h ALA 567 Cb 1.20 0.86 0.00 0.00 0.00 0.00 0.00 17.79 19.85 1br4 h ALA 567 CO 0.57 -1.10 0.00 1.63 0.00 0.00 0.00 179.25 180.35 1br4 n LYS 568 N -5.26 0.00 -4.33 0.00 4.76 -1.26 -4.51 118.16 107.56 1br4 n LYS 568 Ca -0.08 0.03 -0.31 0.00 -2.87 0.00 0.00 58.31 55.08 1br4 n LYS 568 Cb 0.39 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 31.98 1br4 n LYS 568 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1br4 s PHE 569 N -2.03 2.85 -0.20 2.13 5.36 0.81 -0.05 117.98 126.87 1br4 s PHE 569 Ca 0.00 -0.08 -0.15 0.00 -0.96 0.00 0.00 56.93 55.74 1br4 s PHE 569 Cb 0.00 -1.53 0.06 0.00 -0.34 0.00 0.00 43.02 41.20 1br4 s PHE 569 CO 0.00 0.41 0.50 -0.65 -1.46 0.00 0.00 175.22 174.02 1br4 s GLN 570 N -1.84 0.55 -0.04 10.12 -0.21 -1.07 -4.69 119.66 122.48 1br4 s GLN 570 Ca 0.20 0.79 -0.30 0.00 0.02 0.00 0.00 55.36 56.08 1br4 s GLN 570 Cb -0.11 0.18 -0.05 0.00 1.00 0.00 0.00 33.01 34.03 1br4 s GLN 570 CO 0.12 -0.11 1.54 0.21 -2.12 0.00 0.00 175.29 174.93 1br4 s LYS 571 N 0.76 4.22 0.17 2.91 2.20 -1.26 -3.22 119.74 125.52 1br4 s LYS 571 Ca -0.04 2.08 -0.30 0.00 -0.36 0.00 0.00 55.97 57.35 1br4 s LYS 571 Cb -0.05 -3.80 -0.17 0.00 -1.51 0.00 0.00 37.83 32.29 1br4 s LYS 571 CO -0.06 -0.74 0.62 0.45 -0.36 0.00 0.00 175.35 175.26 1br4 n SER 572 N 6.41 -1.02 0.02 1.43 2.88 -1.26 -4.89 113.62 117.20 1br4 n SER 572 Ca 0.16 1.14 -0.19 0.00 -1.33 0.00 0.00 58.87 58.64 1br4 n SER 572 Cb 0.43 -0.95 -0.14 0.00 -0.75 0.00 0.00 64.21 62.80 1br4 n SER 572 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1br4 h LYS 573 N 1.35 0.24 -5.18 -1.46 1.57 -1.91 -3.45 116.57 107.72 1br4 h LYS 573 Ca -0.32 -0.40 -0.65 0.00 -1.87 0.00 0.00 60.65 57.41 1br4 h LYS 573 Cb 1.44 0.15 -0.26 0.00 0.08 0.00 0.00 32.23 33.64 1br4 h LYS 573 CO 0.58 1.19 -0.72 -0.65 -0.57 0.00 0.00 179.45 179.29 1br4 s GLN 574 N -2.40 3.47 -0.36 3.15 -1.52 -1.26 -4.96 119.66 115.78 1br4 s GLN 574 Ca -0.16 -0.61 0.06 0.00 -1.95 0.00 0.00 55.36 52.69 1br4 s GLN 574 Cb 0.01 -2.86 0.46 0.00 -0.22 0.00 0.00 33.01 30.39 1br4 s GLN 574 CO 0.79 0.06 1.36 1.28 -0.25 0.00 0.00 175.29 178.53 1br4 n LEU 575 N 4.04 5.35 0.00 2.90 4.77 -1.26 -4.74 117.00 128.05 1br4 n LEU 575 Ca -0.18 -4.60 0.00 0.00 -0.03 0.00 0.00 56.01 51.20 1br4 n LEU 575 Cb 0.52 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1br4 n LEU 575 CO 0.31 1.94 0.00 2.29 -1.33 0.00 0.00 177.39 180.59 1br4 n LYS 576 N -0.78 0.00 0.00 3.23 2.85 -1.26 -3.86 118.16 118.34 1br4 n LYS 576 Ca 0.46 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.72 1br4 n LYS 576 Cb 0.91 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.29 1br4 n LYS 576 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1br4 n ASP 577 N -2.02 0.00 -0.93 -5.58 8.00 -1.26 -5.13 116.55 109.63 1br4 n ASP 577 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1br4 n ASP 577 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1br4 n ASP 577 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1br4 n LYS 578 N -1.36 2.09 -4.95 -1.24 4.81 -1.25 -5.13 118.16 111.13 1br4 n LYS 578 Ca 0.00 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.17 1br4 n LYS 578 Cb 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 35.03 34.89 1br4 n LYS 578 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1br4 s THR 579 N 1.44 1.59 0.32 3.15 -4.23 -1.26 -4.60 115.64 112.04 1br4 s THR 579 Ca 0.00 -0.81 -0.05 0.00 -1.18 0.00 0.00 61.69 59.65 1br4 s THR 579 Cb 0.00 -1.35 0.00 0.00 1.34 0.00 0.00 72.50 72.49 1br4 s THR 579 CO 0.00 0.45 0.49 -1.83 -0.54 0.00 0.00 174.62 173.19 1br4 s GLU 580 N -0.05 1.84 0.03 3.99 -1.05 -1.26 -3.44 118.70 118.76 1br4 s GLU 580 Ca -0.03 -1.63 -0.27 0.00 -0.15 0.00 0.00 54.97 52.89 1br4 s GLU 580 Cb -0.12 0.46 0.07 0.00 -0.44 0.00 0.00 34.13 34.10 1br4 s GLU 580 CO 0.02 -0.77 0.63 -0.59 0.95 0.00 0.00 175.26 175.50 1br4 s PHE 581 N -3.22 -0.59 0.09 4.83 -0.71 -0.19 -4.15 117.98 114.04 1br4 s PHE 581 Ca 0.28 0.78 0.08 0.00 -1.04 0.00 0.00 56.93 57.03 1br4 s PHE 581 Cb -0.01 0.45 -0.03 0.00 -1.21 0.00 0.00 43.02 42.22 1br4 s PHE 581 CO 0.17 -0.69 -0.22 0.00 -1.34 0.00 0.00 175.22 173.14 1br4 s ILE 583 N -1.04 2.75 -1.26 0.00 1.01 -1.07 -2.59 121.20 119.00 1br4 s ILE 583 Ca 0.08 -1.37 -0.06 0.00 0.00 0.00 0.00 60.65 59.30 1br4 s ILE 583 Cb -0.10 -2.20 0.18 0.00 0.01 0.00 0.00 42.46 40.35 1br4 s ILE 583 CO 0.04 0.22 2.04 0.18 0.00 0.00 0.00 174.94 177.42 1br4 n LEU 584 N 1.20 7.28 -4.25 2.97 4.77 0.93 -2.52 117.00 127.38 1br4 n LEU 584 Ca -0.16 -4.87 -0.28 0.00 -0.03 0.00 0.00 56.01 50.67 1br4 n LEU 584 Cb 0.52 -1.38 0.25 0.00 -2.33 0.00 0.00 43.42 40.48 1br4 n LEU 584 CO 0.27 1.76 0.23 1.41 -1.33 0.00 0.00 177.39 179.73 1br4 n HIS 585 N 2.36 -2.66 0.10 -1.77 8.25 0.34 -4.80 115.22 117.04 1br4 n HIS 585 Ca 0.48 -0.41 -0.03 0.00 -0.26 0.00 0.00 57.72 57.51 1br4 n HIS 585 Cb 0.30 -1.46 -0.01 0.00 1.12 0.00 0.00 29.99 29.94 1br4 n HIS 585 CO 0.00 0.00 0.00 0.10 0.64 0.00 0.00 176.34 177.08 1br4 h TYR 586 N -3.09 0.00 -0.00 4.41 -0.00 -1.97 -3.19 116.97 113.13 1br4 h TYR 586 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.28 1br4 h TYR 586 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.97 1br4 h TYR 586 CO -2.21 0.77 -0.59 0.00 -0.00 0.00 0.00 178.16 176.13 1br4 n ALA 587 N -2.32 3.80 0.00 0.10 0.00 -1.26 -4.85 120.51 115.97 1br4 n ALA 587 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1br4 n ALA 587 Cb 0.81 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1br4 n ALA 587 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1br4 n GLY 588 N 1.46 0.61 3.26 0.00 0.00 -1.21 -5.11 105.19 104.21 1br4 n GLY 588 Ca 0.07 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.14 1br4 n GLY 588 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1br4 s LYS 589 N -2.00 1.93 -0.06 1.61 2.36 -1.25 0.13 119.74 122.46 1br4 s LYS 589 Ca 0.00 -0.84 -0.01 0.00 -2.55 0.00 0.00 55.97 52.58 1br4 s LYS 589 Cb 0.00 -1.85 0.03 0.00 -1.05 0.00 0.00 37.83 34.96 1br4 s LYS 589 CO 0.00 0.49 -0.00 0.08 1.55 0.00 0.00 175.35 177.47 1br4 s VAL 590 N -0.52 0.33 -1.10 4.02 1.01 -1.05 -4.92 120.40 118.17 1br4 s VAL 590 Ca 0.08 0.10 -0.17 0.00 0.00 0.00 0.00 61.98 61.98 1br4 s VAL 590 Cb -0.09 -0.46 0.12 0.00 0.00 0.00 0.00 36.38 35.95 1br4 s VAL 590 CO -0.01 0.22 1.39 -0.89 0.00 0.00 0.00 175.10 175.81 1br4 s THR 591 N 1.61 4.62 0.56 3.92 2.01 -1.26 -2.60 115.64 124.50 1br4 s THR 591 Ca -0.01 -1.89 -0.19 0.00 0.31 0.00 0.00 61.69 59.92 1br4 s THR 591 Cb -0.13 -4.94 -0.05 0.00 0.01 0.00 0.00 72.50 67.40 1br4 s THR 591 CO -0.03 -1.70 1.12 -0.31 -0.69 0.00 0.00 174.62 173.01 1br4 s TYR 592 N 2.89 2.68 -0.46 4.92 1.51 0.19 -4.16 117.35 124.91 1br4 s TYR 592 Ca 0.42 1.55 -0.05 0.00 -1.01 0.00 0.00 57.07 57.98 1br4 s TYR 592 Cb -0.02 -3.26 0.12 0.00 -0.11 0.00 0.00 41.96 38.70 1br4 s TYR 592 CO -0.03 -1.56 0.28 1.21 -1.11 0.00 0.00 175.55 174.34 1br4 s ASN 593 N -1.94 5.40 0.00 2.29 3.84 -1.15 -1.02 114.94 122.36 1br4 s ASN 593 Ca 0.71 -2.12 0.00 0.00 0.21 0.00 0.00 52.86 51.66 1br4 s ASN 593 Cb -0.23 -1.89 0.00 0.00 -0.55 0.00 0.00 41.25 38.58 1br4 s ASN 593 CO 0.29 -0.56 0.63 0.00 -2.79 0.00 0.00 177.10 174.68 1br4 n ALA 594 N 4.52 0.90 -1.67 1.71 0.00 -1.22 -4.72 120.51 120.02 1br4 n ALA 594 Ca -0.02 0.00 -0.48 0.00 0.00 0.00 0.00 53.44 52.94 1br4 n ALA 594 Cb 0.41 -0.73 -0.05 0.00 0.00 0.00 0.00 19.45 19.08 1br4 n ALA 594 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1br4 n SER 595 N -1.13 3.18 -1.38 0.00 2.88 -1.26 -1.37 113.62 114.53 1br4 n SER 595 Ca 0.00 1.03 -0.14 0.00 -1.33 0.00 0.00 58.87 58.43 1br4 n SER 595 Cb 0.07 -1.38 -0.03 0.00 -0.75 0.00 0.00 64.21 62.12 1br4 n SER 595 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1br4 n ALA 596 N 5.02 -0.33 0.17 -1.46 0.00 -1.26 -4.93 120.51 117.72 1br4 n ALA 596 Ca 0.20 0.17 -0.08 0.00 0.00 0.00 0.00 53.44 53.74 1br4 n ALA 596 Cb 0.28 -1.63 -0.04 0.00 0.00 0.00 0.00 19.45 18.07 1br4 n ALA 596 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1br4 h TRP 597 N 0.00 -0.47 0.00 0.00 4.06 -1.55 -3.02 115.95 114.97 1br4 h TRP 597 Ca -0.32 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.62 1br4 h TRP 597 Cb 1.10 0.15 0.00 0.00 -1.00 0.00 0.00 29.16 29.42 1br4 h TRP 597 CO 0.39 -0.29 0.00 1.37 -3.56 0.00 0.00 178.44 176.35 1br4 h LEU 598 N -1.05 0.00 -1.72 -4.49 8.10 -1.92 0.11 115.31 114.34 1br4 h LEU 598 Ca -0.05 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.93 1br4 h LEU 598 Cb 0.39 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.61 1br4 h LEU 598 CO 0.08 0.00 -0.05 0.74 -4.11 0.00 0.00 178.44 175.10 1br4 h THR 599 N 0.00 0.17 0.00 0.15 2.02 -1.90 -3.26 112.91 110.09 1br4 h THR 599 Ca 0.00 -0.53 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 1br4 h THR 599 Cb 0.06 1.44 -0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1br4 h THR 599 CO 0.00 0.05 -1.06 0.29 0.37 0.00 0.00 175.52 175.17 1br4 n LYS 600 N -3.22 1.08 0.28 6.66 5.02 -0.06 -4.40 118.16 123.51 1br4 n LYS 600 Ca -0.00 -0.01 0.16 0.00 -2.02 0.00 0.00 58.31 56.44 1br4 n LYS 600 Cb 0.28 -1.03 0.84 0.00 -0.02 0.00 0.00 35.03 35.10 1br4 n LYS 600 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 1br4 h ASN 601 N 0.00 0.00 0.00 4.39 -0.73 -1.35 -0.07 115.58 117.82 1br4 h ASN 601 Ca -0.01 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.16 1br4 h ASN 601 Cb 0.33 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.92 1br4 h ASN 601 CO 0.00 0.00 -1.73 0.80 -0.37 0.00 0.00 177.43 176.13 1br4 n MET 602 N -2.71 0.48 -2.94 6.67 1.56 -1.25 -1.89 117.12 117.03 1br4 n MET 602 Ca -0.02 -0.15 -0.12 0.00 -0.27 0.00 0.00 57.70 57.14 1br4 n MET 602 Cb 0.20 -1.38 0.06 0.00 2.15 0.00 0.00 33.22 34.25 1br4 n MET 602 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 1br4 n ASP 603 N -2.06 -5.44 -4.74 6.12 2.03 -0.04 -4.95 116.55 107.47 1br4 n ASP 603 Ca -0.03 -0.57 -0.36 0.00 0.52 0.00 0.00 54.79 54.35 1br4 n ASP 603 Cb 0.42 -4.33 0.05 0.00 -0.72 0.00 0.00 41.12 36.55 1br4 n ASP 603 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1br4 s PRO 604 N -4.22 2.70 -0.30 -0.67 0.04 -1.26 -4.68 135.00 126.61 1br4 s PRO 604 Ca 0.34 1.89 -0.22 0.00 0.04 0.00 0.00 61.00 63.05 1br4 s PRO 604 Cb -0.04 -1.89 0.19 0.00 0.04 0.00 0.00 34.50 32.80 1br4 s PRO 604 CO 0.60 -1.43 1.37 -0.48 0.04 0.00 0.00 177.00 177.10 1br4 s LEU 605 N -4.34 -0.07 -0.84 -3.56 2.34 -1.26 -4.92 118.68 106.02 1br4 s LEU 605 Ca 0.79 0.13 -0.25 0.00 0.06 0.00 0.00 54.13 54.86 1br4 s LEU 605 Cb -0.32 1.13 -0.17 0.00 -0.56 0.00 0.00 46.19 46.27 1br4 s LEU 605 CO 0.37 -0.02 2.34 -3.20 -1.06 0.00 0.00 176.35 174.78 1br4 n ASN 606 N 2.06 1.51 0.00 1.48 2.85 -1.26 -4.40 115.26 117.50 1br4 n ASN 606 Ca -0.12 -1.60 0.08 0.00 -0.11 0.00 0.00 54.58 52.82 1br4 n ASN 606 Cb 0.57 -1.61 0.38 0.00 1.24 0.00 0.00 39.78 40.36 1br4 n ASN 606 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1br4 n ASP 607 N 18.12 0.00 0.26 1.20 5.75 -1.24 -3.12 116.55 137.53 1br4 n ASP 607 Ca 0.47 0.20 -0.16 0.00 -0.01 0.00 0.00 54.79 55.29 1br4 n ASP 607 Cb 0.42 -0.35 -0.08 0.00 -1.03 0.00 0.00 41.12 40.08 1br4 n ASP 607 CO 0.00 0.00 0.00 -1.13 -0.11 0.00 0.00 177.20 175.96 1br4 h ASN 608 N 0.00 -0.74 0.39 -1.12 -0.00 -1.87 -2.48 115.58 109.76 1br4 h ASN 608 Ca 0.00 0.05 -0.17 0.00 -0.00 0.00 0.00 56.30 56.18 1br4 h ASN 608 Cb 0.19 0.23 -0.01 0.00 -0.00 0.00 0.00 38.32 38.72 1br4 h ASN 608 CO 0.00 -0.45 -0.70 1.62 -0.00 0.00 0.00 177.43 177.90 1br4 h VAL 609 N -0.70 1.41 -0.65 2.57 3.04 -1.81 -3.24 116.25 116.88 1br4 h VAL 609 Ca -0.05 -2.17 0.09 0.00 -1.01 0.00 0.00 66.70 63.56 1br4 h VAL 609 Cb 0.59 2.14 -0.11 0.00 -2.01 0.00 0.00 31.29 31.90 1br4 h VAL 609 CO 0.03 0.64 -0.48 0.74 -1.01 0.00 0.00 177.57 177.49 1br4 h THR 610 N 0.19 0.05 0.00 3.17 2.02 -1.41 0.45 112.91 117.37 1br4 h THR 610 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1br4 h THR 610 Cb 1.25 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 1br4 h THR 610 CO 0.11 0.00 0.00 -1.20 0.37 0.00 0.00 175.52 174.80 1br4 n SER 611 N -5.38 0.36 0.17 4.18 7.64 -0.97 -1.15 113.62 118.46 1br4 n SER 611 Ca 0.02 0.55 0.06 0.00 1.01 0.00 0.00 58.87 60.50 1br4 n SER 611 Cb 0.34 -0.64 0.18 0.00 -1.01 0.00 0.00 64.21 63.07 1br4 n SER 611 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1br4 h LEU 612 N 0.00 0.00 0.06 -3.43 5.85 -0.29 -3.04 115.31 114.46 1br4 h LEU 612 Ca 0.00 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.51 1br4 h LEU 612 Cb 0.49 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 1br4 h LEU 612 CO 0.00 0.37 -1.07 -0.07 -0.34 0.00 0.00 178.44 177.33 1br4 h LEU 613 N 0.00 0.20 -1.81 2.25 3.38 0.27 -3.28 115.31 116.33 1br4 h LEU 613 Ca -0.00 -0.79 0.41 0.00 0.09 0.00 0.00 57.88 57.59 1br4 h LEU 613 Cb 1.14 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.77 1br4 h LEU 613 CO 0.05 1.45 1.13 -1.13 0.09 0.00 0.00 178.44 180.02 1br4 h ASN 614 N -0.64 0.00 -1.41 -0.43 -1.24 -1.07 0.89 115.58 111.68 1br4 h ASN 614 Ca -0.25 0.00 -0.55 0.00 0.71 0.00 0.00 56.30 56.21 1br4 h ASN 614 Cb 1.48 0.00 -0.42 0.00 0.73 0.00 0.00 38.32 40.11 1br4 h ASN 614 CO -0.03 0.00 -0.81 0.00 -1.29 0.00 0.00 177.43 175.31 1br4 n GLN 615 N -3.85 3.08 -3.26 6.67 6.02 -1.16 -4.77 117.38 120.11 1br4 n GLN 615 Ca 0.31 -4.30 -0.23 0.00 -0.01 0.00 0.00 57.00 52.77 1br4 n GLN 615 Cb 1.57 -2.09 -0.00 0.00 1.02 0.00 0.00 30.24 30.73 1br4 n GLN 615 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1br4 s SER 616 N -3.48 6.07 0.23 1.08 0.15 0.31 -4.97 113.70 113.09 1br4 s SER 616 Ca 0.45 0.29 0.04 0.00 0.70 0.00 0.00 55.95 57.43 1br4 s SER 616 Cb 0.41 -1.73 0.23 0.00 -1.71 0.00 0.00 66.02 63.22 1br4 s SER 616 CO -0.15 -0.46 1.55 0.77 1.20 0.00 0.00 173.24 176.15 1br4 h SER 617 N 0.65 0.26 -0.43 5.45 4.64 -1.22 -3.40 113.55 119.50 1br4 h SER 617 Ca -0.48 -0.15 -0.22 0.00 -0.47 0.00 0.00 61.79 60.47 1br4 h SER 617 Cb 1.24 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 63.22 1br4 h SER 617 CO 0.59 0.82 0.66 -0.62 -0.87 0.00 0.00 176.83 177.40 1br4 s ASP 618 N -6.90 4.56 0.25 4.97 -1.08 -1.22 -4.78 116.67 112.48 1br4 s ASP 618 Ca -0.04 -1.13 -0.11 0.00 -0.52 0.00 0.00 52.55 50.75 1br4 s ASP 618 Cb 0.12 -2.58 0.37 0.00 -1.46 0.00 0.00 42.92 39.36 1br4 s ASP 618 CO 0.80 -3.49 1.51 1.17 0.52 0.00 0.00 175.17 175.68 1br4 n LYS 619 N 8.43 -0.14 -0.20 4.34 0.00 -1.26 0.16 118.16 129.49 1br4 n LYS 619 Ca 0.43 1.51 0.00 0.00 0.00 0.00 0.00 58.31 60.26 1br4 n LYS 619 Cb 0.46 -2.25 0.09 0.00 0.00 0.00 0.00 35.03 33.34 1br4 n LYS 619 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.40 177.75 1br4 h PHE 620 N 0.00 -0.06 0.00 5.64 3.57 -1.96 2.45 116.94 126.58 1br4 h PHE 620 Ca 0.42 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.95 1br4 h PHE 620 Cb 0.66 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.52 1br4 h PHE 620 CO -0.79 -0.17 -0.04 0.28 -2.23 0.00 0.00 178.31 175.36 1br4 h VAL 621 N 0.11 0.08 -0.04 1.41 2.07 0.35 -0.89 116.25 119.33 1br4 h VAL 621 Ca 0.31 -0.97 -0.17 0.00 0.82 0.00 0.00 66.70 66.69 1br4 h VAL 621 Cb 0.50 1.91 0.01 0.00 -1.52 0.00 0.00 31.29 32.19 1br4 h VAL 621 CO -0.52 0.04 -0.64 0.00 0.02 0.00 0.00 177.57 176.47 1br4 h ALA 622 N 1.96 0.13 0.00 1.67 0.00 0.63 -2.84 119.26 120.80 1br4 h ALA 622 Ca -0.00 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.29 1br4 h ALA 622 Cb 0.90 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1br4 h ALA 622 CO 0.01 0.42 -0.25 -0.44 0.00 0.00 0.00 179.25 178.98 1br4 h ASP 623 N 0.05 0.00 0.03 0.00 5.19 0.40 0.44 116.42 122.54 1br4 h ASP 623 Ca -0.07 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.34 1br4 h ASP 623 Cb 1.32 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.83 1br4 h ASP 623 CO 0.13 0.25 -0.01 0.25 -3.12 0.00 0.00 179.24 176.73 1br4 h LEU 624 N 0.00 -0.03 -3.09 1.55 5.85 -1.07 -3.25 115.31 115.26 1br4 h LEU 624 Ca -0.00 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1br4 h LEU 624 Cb 0.79 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1br4 h LEU 624 CO 0.03 0.28 0.00 0.79 -0.34 0.00 0.00 178.44 179.21 1br4 n TRP 625 N -4.96 1.05 -0.34 1.25 7.02 -1.08 -4.71 117.44 115.67 1br4 n TRP 625 Ca -0.08 -0.64 0.19 0.00 -1.02 0.00 0.00 57.50 55.94 1br4 n TRP 625 Cb 0.18 -0.19 0.41 0.00 -2.42 0.00 0.00 31.31 29.29 1br4 n TRP 625 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 1br4 h LYS 626 N 2.94 0.53 -3.57 -0.99 1.63 -0.15 -3.15 116.57 113.81 1br4 h LYS 626 Ca 0.00 -0.03 -0.73 0.00 -0.85 0.00 0.00 60.65 59.04 1br4 h LYS 626 Cb 1.24 -0.12 -0.32 0.00 -0.60 0.00 0.00 32.23 32.43 1br4 h LYS 626 CO 0.16 0.35 -0.10 -0.51 -3.45 0.00 0.00 179.45 175.90 1br4 s ASP 627 N -5.21 6.01 -0.53 4.20 1.11 -1.26 -4.93 116.67 116.06 1br4 s ASP 627 Ca -0.10 -3.10 0.04 0.00 0.18 0.00 0.00 52.55 49.56 1br4 s ASP 627 Cb 0.27 -1.99 0.40 0.00 1.07 0.00 0.00 42.92 42.66 1br4 s ASP 627 CO 0.80 -0.37 1.23 0.55 1.18 0.00 0.00 175.17 178.56 1br4 n VAL 628 N 3.25 2.74 -0.91 -1.27 3.14 -1.19 -4.75 118.33 119.34 1br4 n VAL 628 Ca 0.14 -4.97 0.07 0.00 -2.96 0.00 0.00 64.34 56.62 1br4 n VAL 628 Cb 0.40 -1.29 0.39 0.00 -1.06 0.00 0.00 33.84 32.28 1br4 n VAL 628 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1br4 n ASP 629 N -0.44 5.49 0.00 6.55 9.92 -1.26 -4.21 116.55 132.60 1br4 n ASP 629 Ca 0.40 -2.93 0.00 0.00 -0.53 0.00 0.00 54.79 51.73 1br4 n ASP 629 Cb 0.55 -0.67 0.00 0.00 -0.64 0.00 0.00 41.12 40.37 1br4 n ASP 629 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1br4 n ARG 630 N 0.50 2.70 -0.73 -1.24 0.00 -1.26 -5.09 116.66 111.54 1br4 n ARG 630 Ca 0.27 -0.16 -0.32 0.00 -0.00 0.00 0.00 57.85 57.64 1br4 n ARG 630 Cb 1.15 -0.59 0.15 0.00 0.00 0.00 0.00 32.46 33.17 1br4 n ARG 630 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1br4 n ILE 631 N -0.43 0.05 -3.57 5.15 2.08 -1.26 -4.86 119.36 116.51 1br4 n ILE 631 Ca 0.00 -0.09 -0.37 0.00 0.56 0.00 0.00 62.75 62.86 1br4 n ILE 631 Cb 0.03 -0.84 -0.08 0.00 -0.75 0.00 0.00 39.64 37.99 1br4 n ILE 631 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1br4 s VAL 632 N -2.52 5.31 0.00 1.39 1.01 -1.26 -4.90 120.40 119.43 1br4 s VAL 632 Ca 0.63 0.39 0.00 0.00 0.00 0.00 0.00 61.98 63.00 1br4 s VAL 632 Cb -0.22 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1br4 s VAL 632 CO 0.62 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.67 1br4 n GLY 633 N 3.92 0.41 0.00 4.51 0.00 -1.26 -3.61 105.19 109.16 1br4 n GLY 633 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1br4 n GLY 633 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1br4 n LEU 634 N -0.78 2.01 0.00 0.99 7.94 -1.26 -4.82 117.00 121.08 1br4 n LEU 634 Ca 0.00 0.11 0.00 0.00 -1.11 0.00 0.00 56.01 55.01 1br4 n LEU 634 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1br4 n LEU 634 CO 0.00 0.00 0.00 0.33 -1.11 0.00 0.00 177.39 176.61 1br4 n PHE 656 N -0.44 0.00 -4.29 1.96 7.35 -1.26 -5.11 117.46 115.67 1br4 n PHE 656 Ca 0.00 0.00 -0.30 0.00 -0.76 0.00 0.00 57.45 56.39 1br4 n PHE 656 Cb 0.00 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 39.73 1br4 n PHE 656 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1br4 s ARG 657 N 0.00 2.23 0.17 -4.13 6.06 -1.26 -5.11 118.95 116.91 1br4 s ARG 657 Ca 0.00 -0.96 -0.29 0.00 -2.50 0.00 0.00 55.73 51.98 1br4 s ARG 657 Cb 0.00 -2.35 -0.07 0.00 0.06 0.00 0.00 34.95 32.59 1br4 s ARG 657 CO 0.00 0.53 0.91 -0.08 -2.50 0.00 0.00 175.30 174.16 1br4 s THR 658 N -1.17 4.31 0.20 4.11 -1.32 -1.26 -4.91 115.64 115.60 1br4 s THR 658 Ca 0.21 1.99 -0.19 0.00 -1.21 0.00 0.00 61.69 62.48 1br4 s THR 658 Cb -0.11 -4.28 0.17 0.00 -1.51 0.00 0.00 72.50 66.77 1br4 s THR 658 CO 0.12 0.43 1.57 0.58 -2.21 0.00 0.00 174.62 175.12 1br4 h VAL 659 N 3.56 0.11 -0.57 5.08 2.07 -1.71 0.32 116.25 125.11 1br4 h VAL 659 Ca -0.44 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.13 1br4 h VAL 659 Cb 1.20 0.11 -0.08 0.00 -1.52 0.00 0.00 31.29 31.00 1br4 h VAL 659 CO 0.69 0.00 -0.47 1.23 0.02 0.00 0.00 177.57 179.04 1br4 h GLY 660 N -0.10 -1.18 1.80 2.17 0.00 -1.93 0.26 103.07 104.09 1br4 h GLY 660 Ca 0.28 0.80 -0.15 0.00 0.00 0.00 0.00 47.33 48.26 1br4 h GLY 660 CO -0.79 -0.19 -0.63 -1.61 0.00 0.00 0.00 176.54 173.32 1br4 h GLN 661 N -0.17 0.21 -0.82 4.80 5.75 -1.82 -1.16 115.11 121.89 1br4 h GLN 661 Ca 0.09 -0.15 0.05 0.00 -0.15 0.00 0.00 58.65 58.50 1br4 h GLN 661 Cb 0.42 0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.95 1br4 h GLN 661 CO -0.63 0.77 0.54 1.25 -2.65 0.00 0.00 178.83 178.11 1br4 h LEU 662 N 0.15 0.83 0.02 -2.39 5.85 0.83 0.10 115.31 120.70 1br4 h LEU 662 Ca -0.01 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1br4 h LEU 662 Cb 1.15 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.00 1br4 h LEU 662 CO 0.10 0.55 -0.01 0.22 -0.34 0.00 0.00 178.44 178.96 1br4 h TYR 663 N 0.95 -0.02 0.00 1.25 3.20 -0.15 -3.13 116.97 119.08 1br4 h TYR 663 Ca 0.34 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.21 1br4 h TYR 663 Cb 0.14 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.42 1br4 h TYR 663 CO -0.00 -0.01 0.16 1.17 -1.64 0.00 0.00 178.16 177.83 1br4 n LYS 664 N -2.12 0.00 0.08 1.82 0.00 -0.47 0.22 118.16 117.69 1br4 n LYS 664 Ca -0.00 0.22 0.12 0.00 0.00 0.00 0.00 58.31 58.64 1br4 n LYS 664 Cb 0.01 -1.66 0.02 0.00 0.00 0.00 0.00 35.03 33.40 1br4 n LYS 664 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1br4 n GLU 665 N -1.17 0.51 -0.05 1.64 2.13 0.36 -3.29 120.64 120.77 1br4 n GLU 665 Ca 0.00 0.08 -0.05 0.00 0.66 0.00 0.00 57.16 57.85 1br4 n GLU 665 Cb 0.16 -1.76 -0.07 0.00 0.27 0.00 0.00 31.44 30.04 1br4 n GLU 665 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1br4 n GLN 666 N -2.47 2.01 0.00 5.31 7.27 0.61 -4.07 117.38 126.04 1br4 n GLN 666 Ca 0.01 0.01 0.04 0.00 0.07 0.00 0.00 57.00 57.13 1br4 n GLN 666 Cb 0.52 -1.24 0.24 0.00 2.41 0.00 0.00 30.24 32.17 1br4 n GLN 666 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1br4 n LEU 667 N -2.45 0.00 -0.06 1.69 7.94 0.19 -0.99 117.00 123.31 1br4 n LEU 667 Ca -0.17 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 54.69 1br4 n LEU 667 Cb 0.79 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.64 1br4 n LEU 667 CO 0.19 0.00 -0.88 0.35 -1.11 0.00 0.00 177.39 175.93 1br4 n THR 668 N -0.64 0.76 0.19 1.96 -2.24 -1.21 -4.13 114.28 108.97 1br4 n THR 668 Ca 0.06 -0.51 -0.14 0.00 -2.27 0.00 0.00 64.05 61.18 1br4 n THR 668 Cb 0.03 -0.54 -0.08 0.00 -2.10 0.00 0.00 70.33 67.63 1br4 n THR 668 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1br4 h LYS 669 N 0.00 -0.45 0.00 -0.78 3.64 -1.21 -2.93 116.57 114.84 1br4 h LYS 669 Ca -0.30 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1br4 h LYS 669 Cb 1.63 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.56 1br4 h LYS 669 CO 0.02 -0.20 0.00 -0.11 -2.27 0.00 0.00 179.45 176.89 1br4 n LEU 670 N -5.22 0.00 0.00 5.20 7.94 -0.83 -0.75 117.00 123.34 1br4 n LEU 670 Ca -0.10 0.67 0.00 0.00 -1.11 0.00 0.00 56.01 55.47 1br4 n LEU 670 Cb 0.25 -0.17 0.00 0.00 0.53 0.00 0.00 43.42 44.03 1br4 n LEU 670 CO 0.33 -0.17 0.35 0.80 -1.11 0.00 0.00 177.39 177.59 1br4 n MET 671 N -1.67 0.00 0.03 1.96 1.56 -1.24 -0.40 117.12 117.36 1br4 n MET 671 Ca 0.00 0.16 -0.22 0.00 -0.27 0.00 0.00 57.70 57.37 1br4 n MET 671 Cb 0.00 -1.63 -0.14 0.00 2.15 0.00 0.00 33.22 33.60 1br4 n MET 671 CO 0.00 0.00 0.00 1.15 -0.73 0.00 0.00 175.97 176.39 1br4 h THR 672 N 0.00 0.77 0.21 1.12 2.02 -0.74 -3.22 112.91 113.07 1br4 h THR 672 Ca 0.00 -2.40 -0.32 0.00 0.77 0.00 0.00 66.41 64.46 1br4 h THR 672 Cb 0.26 2.61 0.03 0.00 -1.74 0.00 0.00 68.15 69.31 1br4 h THR 672 CO 0.00 0.86 -1.40 0.00 0.37 0.00 0.00 175.52 175.35 1br4 h THR 673 N 0.03 1.36 0.05 3.16 1.03 -0.45 -3.25 112.91 114.83 1br4 h THR 673 Ca -0.39 -2.83 0.03 0.00 -0.01 0.00 0.00 66.41 63.21 1br4 h THR 673 Cb 2.02 3.01 -0.04 0.00 -1.07 0.00 0.00 68.15 72.07 1br4 h THR 673 CO 0.11 0.84 -0.29 -0.07 -0.01 0.00 0.00 175.52 176.11 1br4 h LEU 674 N 0.12 -0.85 -0.14 0.00 3.38 -1.49 0.33 115.31 116.67 1br4 h LEU 674 Ca -0.21 0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1br4 h LEU 674 Cb 2.10 0.33 0.00 0.00 0.09 0.00 0.00 40.66 43.19 1br4 h LEU 674 CO 0.25 -0.36 0.00 0.54 0.09 0.00 0.00 178.44 178.96 1br4 n ARG 675 N -5.40 0.01 -0.09 1.13 1.74 -1.22 0.04 116.66 112.87 1br4 n ARG 675 Ca -0.06 0.51 0.12 0.00 -0.77 0.00 0.00 57.85 57.65 1br4 n ARG 675 Cb 0.31 -1.54 0.15 0.00 -1.02 0.00 0.00 32.46 30.36 1br4 n ARG 675 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1br4 n ASN 676 N -1.57 3.17 -2.41 0.55 3.02 0.11 -4.96 115.26 113.18 1br4 n ASN 676 Ca -0.00 -1.97 -0.07 0.00 -0.03 0.00 0.00 54.58 52.51 1br4 n ASN 676 Cb 0.00 -0.12 -0.02 0.00 -0.61 0.00 0.00 39.78 39.03 1br4 n ASN 676 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1br4 n THR 677 N 1.37 0.00 -3.76 3.41 -2.24 0.11 -4.85 114.28 108.33 1br4 n THR 677 Ca 0.16 -0.57 -0.37 0.00 -2.27 0.00 0.00 64.05 61.00 1br4 n THR 677 Cb 0.59 0.15 -0.12 0.00 -2.10 0.00 0.00 70.33 68.84 1br4 n THR 677 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1br4 s ASN 678 N -1.64 5.17 0.49 3.42 3.04 -0.74 -4.92 114.94 119.76 1br4 s ASN 678 Ca 0.02 -0.80 -0.22 0.00 0.04 0.00 0.00 52.86 51.90 1br4 s ASN 678 Cb 0.00 -1.88 -0.07 0.00 -1.54 0.00 0.00 41.25 37.76 1br4 s ASN 678 CO 0.01 -0.22 1.23 -2.16 -3.04 0.00 0.00 177.10 172.92 1br4 s PRO 679 N 1.48 3.55 -0.33 0.43 0.04 -1.26 -0.24 135.00 138.67 1br4 s PRO 679 Ca 0.02 1.93 0.01 0.00 0.04 0.00 0.00 61.00 62.99 1br4 s PRO 679 Cb -0.18 -2.36 0.14 0.00 0.04 0.00 0.00 34.50 32.15 1br4 s PRO 679 CO 0.03 -0.77 0.29 -0.80 0.04 0.00 0.00 177.00 175.79 1br4 s ASN 680 N -1.22 1.92 0.12 6.66 0.01 0.47 -4.85 114.94 118.04 1br4 s ASN 680 Ca 0.66 -1.36 -0.29 0.00 -0.71 0.00 0.00 52.86 51.16 1br4 s ASN 680 Cb -0.33 0.28 -0.06 0.00 0.41 0.00 0.00 41.25 41.55 1br4 s ASN 680 CO 0.39 -0.33 0.93 -0.36 -1.51 0.00 0.00 177.10 176.21 1br4 s PHE 681 N 1.78 3.83 -0.59 2.20 0.08 -1.26 -0.51 117.98 123.52 1br4 s PHE 681 Ca 0.14 1.77 0.04 0.00 0.12 0.00 0.00 56.93 59.00 1br4 s PHE 681 Cb -0.16 -3.01 0.16 0.00 -0.57 0.00 0.00 43.02 39.44 1br4 s PHE 681 CO -0.17 0.26 0.38 0.08 -0.10 0.00 0.00 175.22 175.68 1br4 s VAL 682 N -0.22 2.27 -1.12 -0.44 1.01 -0.79 -3.21 120.40 117.89 1br4 s VAL 682 Ca 0.45 -3.59 -0.22 0.00 0.00 0.00 0.00 61.98 58.61 1br4 s VAL 682 Cb -0.23 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1br4 s VAL 682 CO 0.29 -0.97 1.87 -0.13 0.00 0.00 0.00 175.10 176.16 1br4 s ARG 683 N -0.72 2.84 0.08 2.72 0.52 -0.84 -2.37 118.95 121.17 1br4 s ARG 683 Ca 0.23 -1.09 -0.31 0.00 -0.52 0.00 0.00 55.73 54.04 1br4 s ARG 683 Cb -0.11 -5.26 -0.06 0.00 0.52 0.00 0.00 34.95 30.04 1br4 s ARG 683 CO -0.11 -3.42 1.23 0.00 0.02 0.00 0.00 175.30 173.03 1br4 s ILE 685 N 1.02 1.86 0.34 0.00 1.01 -1.23 -3.81 121.20 120.38 1br4 s ILE 685 Ca 0.60 -0.85 -0.28 0.00 0.00 0.00 0.00 60.65 60.11 1br4 s ILE 685 Cb -0.31 -1.66 -0.10 0.00 0.01 0.00 0.00 42.46 40.40 1br4 s ILE 685 CO 0.30 0.51 1.27 -0.51 0.00 0.00 0.00 174.94 176.51 1br4 s ILE 686 N 0.93 2.82 -0.13 2.92 -1.16 -1.26 -0.25 121.20 125.07 1br4 s ILE 686 Ca -0.06 0.81 -0.17 0.00 -0.51 0.00 0.00 60.65 60.72 1br4 s ILE 686 Cb -0.15 -3.50 -0.25 0.00 0.61 0.00 0.00 42.46 39.17 1br4 s ILE 686 CO -0.03 0.18 0.47 1.55 -2.81 0.00 0.00 174.94 174.30 1br4 h PRO 687 N 3.29 0.17 -3.01 3.50 0.13 -1.89 -3.43 132.00 130.75 1br4 h PRO 687 Ca -0.49 -0.28 -0.01 0.00 -0.87 0.00 0.00 66.00 64.35 1br4 h PRO 687 Cb 1.23 0.11 -0.11 0.00 0.13 0.00 0.00 31.00 32.35 1br4 h PRO 687 CO 0.65 1.14 0.20 0.54 -0.23 0.00 0.00 178.00 180.30 1br4 s ASN 688 N -6.92 -0.51 0.00 1.44 2.20 -1.26 -0.35 114.94 109.53 1br4 s ASN 688 Ca -0.22 -0.10 0.16 0.00 -0.94 0.00 0.00 52.86 51.75 1br4 s ASN 688 Cb 0.04 0.62 0.45 0.00 -2.00 0.00 0.00 41.25 40.36 1br4 s ASN 688 CO 0.72 -1.02 1.37 1.41 -2.94 0.00 0.00 177.10 176.64 1br4 n HIS 689 N -0.39 0.65 1.16 1.54 8.25 -1.26 -3.91 115.22 121.27 1br4 n HIS 689 Ca -0.15 -0.33 0.13 0.00 -0.26 0.00 0.00 57.72 57.11 1br4 n HIS 689 Cb 0.64 0.00 0.34 0.00 1.12 0.00 0.00 29.99 32.09 1br4 n HIS 689 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1br4 n GLU 690 N 0.96 0.53 -1.41 -0.41 1.02 -1.26 -4.89 120.64 115.18 1br4 n GLU 690 Ca 0.17 -0.31 -0.14 0.00 -0.02 0.00 0.00 57.16 56.86 1br4 n GLU 690 Cb 0.42 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.29 1br4 n GLU 690 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1br4 n LYS 691 N -0.96 -1.44 -4.26 3.49 5.02 -1.25 -4.95 118.16 113.81 1br4 n LYS 691 Ca 0.10 0.98 -0.35 0.00 -2.02 0.00 0.00 58.31 57.03 1br4 n LYS 691 Cb 0.34 -5.30 -0.10 0.00 -0.02 0.00 0.00 35.03 29.95 1br4 n LYS 691 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1br4 s ARG 692 N -3.15 3.43 0.80 1.97 0.52 -1.26 -5.12 118.95 116.15 1br4 s ARG 692 Ca 0.00 -0.40 -0.11 0.00 -0.52 0.00 0.00 55.73 54.70 1br4 s ARG 692 Cb 0.00 -2.95 0.09 0.00 0.52 0.00 0.00 34.95 32.61 1br4 s ARG 692 CO 0.00 0.48 1.15 0.00 0.02 0.00 0.00 175.30 176.95 1br4 s ALA 693 N -0.26 2.76 0.00 2.13 0.00 -1.26 -3.92 121.76 121.21 1br4 s ALA 693 Ca 0.06 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.18 1br4 s ALA 693 Cb -0.12 -2.80 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1br4 s ALA 693 CO 0.02 -1.69 0.00 0.41 0.00 0.00 0.00 175.76 174.50 1br4 n GLY 694 N -3.26 2.07 3.72 0.00 0.00 -1.26 -4.95 105.19 101.52 1br4 n GLY 694 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 1br4 n GLY 694 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1br4 s LYS 695 N 0.00 3.43 -0.28 1.61 2.20 -1.25 -5.04 119.74 120.41 1br4 s LYS 695 Ca 0.00 -0.31 -0.02 0.00 -0.36 0.00 0.00 55.97 55.28 1br4 s LYS 695 Cb 0.00 -3.04 0.09 0.00 -1.51 0.00 0.00 37.83 33.37 1br4 s LYS 695 CO 0.00 0.59 0.09 -1.17 -0.36 0.00 0.00 175.35 174.50 1br4 s LEU 696 N -0.53 1.65 0.18 5.43 2.96 -1.26 -4.41 118.68 122.70 1br4 s LEU 696 Ca 0.10 -1.36 -0.32 0.00 -0.22 0.00 0.00 54.13 52.33 1br4 s LEU 696 Cb -0.12 -0.70 -0.12 0.00 0.50 0.00 0.00 46.19 45.75 1br4 s LEU 696 CO 0.02 -0.39 1.74 -0.67 -1.32 0.00 0.00 176.35 175.73 1br4 n ASP 697 N 4.97 3.95 0.00 3.68 -0.08 0.52 -4.96 116.55 124.63 1br4 n ASP 697 Ca -0.05 1.04 0.00 0.00 -1.51 0.00 0.00 54.79 54.28 1br4 n ASP 697 Cb 0.43 -1.56 0.00 0.00 2.34 0.00 0.00 41.12 42.34 1br4 n ASP 697 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1br4 n ALA 698 N 4.36 0.00 -0.16 -1.67 0.00 -1.26 -2.89 120.51 118.89 1br4 n ALA 698 Ca 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.55 1br4 n ALA 698 Cb 0.35 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.81 1br4 n ALA 698 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1br4 h HIS 699 N 0.00 -0.76 -0.89 0.00 3.86 -1.93 -0.10 115.15 115.33 1br4 h HIS 699 Ca 0.00 0.06 0.14 0.00 -1.16 0.00 0.00 60.37 59.41 1br4 h HIS 699 Cb 0.00 0.41 -0.15 0.00 1.06 0.00 0.00 27.41 28.73 1br4 h HIS 699 CO 0.00 -0.35 -0.38 1.25 0.86 0.00 0.00 177.93 179.31 1br4 h LEU 700 N -0.17 -1.38 -1.04 2.43 6.46 -1.95 1.79 115.31 121.44 1br4 h LEU 700 Ca 0.22 0.29 -0.06 0.00 -0.12 0.00 0.00 57.88 58.21 1br4 h LEU 700 Cb 0.52 0.71 -0.02 0.00 -0.73 0.00 0.00 40.66 41.14 1br4 h LEU 700 CO -0.59 -0.29 0.03 0.58 -0.62 0.00 0.00 178.44 177.55 1br4 h VAL 701 N -0.04 1.22 -0.28 1.05 2.07 -1.20 -1.61 116.25 117.45 1br4 h VAL 701 Ca 0.31 -0.89 -0.05 0.00 0.82 0.00 0.00 66.70 66.89 1br4 h VAL 701 Cb 0.58 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1br4 h VAL 701 CO -0.91 0.31 -0.04 0.25 0.02 0.00 0.00 177.57 177.21 1br4 h LEU 702 N 0.68 0.52 -0.27 2.57 5.85 0.27 -2.97 115.31 121.96 1br4 h LEU 702 Ca 0.14 -0.34 -0.20 0.00 0.84 0.00 0.00 57.88 58.32 1br4 h LEU 702 Cb 0.37 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1br4 h LEU 702 CO 0.01 0.74 -0.66 -0.08 -0.34 0.00 0.00 178.44 178.11 1br4 h GLU 703 N 0.30 0.77 -0.96 1.25 4.22 0.24 -2.92 114.58 117.48 1br4 h GLU 703 Ca 0.08 -0.56 0.11 0.00 0.08 0.00 0.00 59.36 59.07 1br4 h GLU 703 Cb 0.49 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.76 1br4 h GLU 703 CO 0.02 1.18 0.61 1.96 -2.18 0.00 0.00 179.01 180.60 1br4 h GLN 704 N 0.56 0.91 -0.39 1.92 4.20 -1.33 0.51 115.11 121.49 1br4 h GLN 704 Ca -0.02 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 1br4 h GLN 704 Cb 1.27 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.82 1br4 h GLN 704 CO 0.14 0.60 0.03 -0.07 -0.67 0.00 0.00 178.83 178.86 1br4 h LEU 705 N 0.94 0.57 0.10 1.46 3.38 -1.39 -2.12 115.31 118.26 1br4 h LEU 705 Ca 0.47 -0.11 -0.22 0.00 0.09 0.00 0.00 57.88 58.11 1br4 h LEU 705 Cb 0.49 -0.15 0.02 0.00 0.09 0.00 0.00 40.66 41.11 1br4 h LEU 705 CO -0.23 0.62 -0.92 0.03 0.09 0.00 0.00 178.44 178.03 1br4 h ARG 706 N 0.59 0.44 -0.89 1.13 3.08 -0.49 -1.96 114.38 116.28 1br4 h ARG 706 Ca 0.13 -0.61 -0.00 0.00 0.07 0.00 0.00 59.98 59.56 1br4 h ARG 706 Cb 0.32 0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.58 1br4 h ARG 706 CO 0.01 1.26 0.00 0.00 -1.07 0.00 0.00 179.97 180.17 1br4 n ASN 708 N 0.16 0.56 -3.86 0.00 3.02 -0.81 -4.84 115.26 109.48 1br4 n ASN 708 Ca 0.07 -1.14 -0.25 0.00 -0.03 0.00 0.00 54.58 53.23 1br4 n ASN 708 Cb 0.50 0.00 -0.00 0.00 -0.61 0.00 0.00 39.78 39.67 1br4 n ASN 708 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1br4 n GLY 709 N -0.07 -0.34 0.00 7.41 0.00 -1.04 -4.94 105.19 106.21 1br4 n GLY 709 Ca 0.00 0.18 -0.00 0.00 0.00 0.00 0.00 46.02 46.20 1br4 n GLY 709 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1br4 h VAL 710 N -1.85 0.00 -0.91 1.61 2.07 -1.60 -2.92 116.25 112.64 1br4 h VAL 710 Ca -0.63 -0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.13 1br4 h VAL 710 Cb 1.37 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.98 1br4 h VAL 710 CO 0.59 0.00 0.09 -0.07 0.02 0.00 0.00 177.57 178.20 1br4 h LEU 711 N -0.00 -0.32 -1.10 2.57 -0.00 -1.93 0.73 115.31 115.27 1br4 h LEU 711 Ca -0.00 0.24 -0.06 0.00 -0.00 0.00 0.00 57.88 58.06 1br4 h LEU 711 Cb 0.00 0.40 -0.02 0.00 -0.00 0.00 0.00 40.66 41.04 1br4 h LEU 711 CO 0.00 -0.27 0.01 -0.33 -0.00 0.00 0.00 178.44 177.85 1br4 h GLU 712 N 0.08 0.65 -0.58 1.13 3.07 -1.94 -1.71 114.58 115.27 1br4 h GLU 712 Ca 0.56 -0.15 -0.02 0.00 -0.50 0.00 0.00 59.36 59.25 1br4 h GLU 712 Cb 1.13 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.92 1br4 h GLU 712 CO -0.80 0.66 0.28 0.78 -1.40 0.00 0.00 179.01 178.53 1br4 h GLY 713 N 0.91 0.89 1.91 -3.84 0.00 0.65 -2.18 103.07 101.40 1br4 h GLY 713 Ca 0.13 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 46.92 1br4 h GLY 713 CO 0.01 0.42 -0.42 -2.22 0.00 0.00 0.00 176.54 174.33 1br4 h ILE 714 N 0.79 1.31 0.17 2.60 2.04 -0.99 -2.68 117.51 120.75 1br4 h ILE 714 Ca 0.20 -1.51 -0.01 0.00 1.00 0.00 0.00 64.86 64.54 1br4 h ILE 714 Cb 0.11 1.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 1br4 h ILE 714 CO -0.03 0.44 -0.08 -0.09 0.00 0.00 0.00 178.15 178.39 1br4 h ARG 715 N 0.09 -0.22 -0.82 2.37 2.43 -0.72 -1.77 114.38 115.74 1br4 h ARG 715 Ca 0.01 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 1br4 h ARG 715 Cb 0.79 0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.36 1br4 h ARG 715 CO 0.06 -0.09 0.35 0.82 -1.51 0.00 0.00 179.97 179.60 1br4 h ILE 716 N -0.29 1.26 -0.50 1.20 5.03 -1.36 1.38 117.51 124.22 1br4 h ILE 716 Ca -0.02 -0.80 0.03 0.00 -0.12 0.00 0.00 64.86 63.95 1br4 h ILE 716 Cb 0.23 0.25 -0.04 0.00 -3.03 0.00 0.00 36.82 34.23 1br4 h ILE 716 CO 0.04 0.33 0.28 0.00 -0.68 0.00 0.00 178.15 178.12 1br4 n ARG 718 N -4.84 0.56 -0.05 0.00 1.85 -0.68 -4.43 116.66 109.06 1br4 n ARG 718 Ca 0.04 -0.06 -0.13 0.00 -1.00 0.00 0.00 57.85 56.70 1br4 n ARG 718 Cb 0.10 -1.63 -0.11 0.00 -1.05 0.00 0.00 32.46 29.77 1br4 n ARG 718 CO 0.00 0.00 0.00 1.96 -0.01 0.00 0.00 177.63 179.58 1br4 h GLN 719 N 0.00 -0.01 0.00 2.89 1.08 0.20 -3.48 115.11 115.79 1br4 h GLN 719 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1br4 h GLN 719 Cb 0.94 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.37 1br4 h GLN 719 CO 0.00 0.82 0.00 0.41 -0.95 0.00 0.00 178.83 179.11 1br4 n GLY 720 N 1.35 1.51 2.85 3.46 0.00 -0.16 -5.04 105.19 109.17 1br4 n GLY 720 Ca -0.09 -1.99 -0.34 0.00 0.00 0.00 0.00 46.02 43.59 1br4 n GLY 720 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1br4 n PHE 721 N -0.19 3.55 0.00 1.61 3.01 -1.26 -4.83 117.46 119.35 1br4 n PHE 721 Ca 0.00 -3.81 0.00 0.00 1.01 0.00 0.00 57.45 54.65 1br4 n PHE 721 Cb 0.00 -0.95 0.00 0.00 -0.01 0.00 0.00 39.48 38.52 1br4 n PHE 721 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1br4 n PRO 722 N 1.59 0.00 -3.89 -1.08 -0.04 -1.26 -4.55 135.00 125.77 1br4 n PRO 722 Ca 0.25 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.60 1br4 n PRO 722 Cb 0.37 -0.95 -0.12 0.00 -0.04 0.00 0.00 33.50 32.76 1br4 n PRO 722 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1br4 s ASN 723 N -1.00 0.05 0.08 3.54 0.01 -1.18 -5.00 114.94 111.43 1br4 s ASN 723 Ca 0.00 -0.12 -0.12 0.00 -0.71 0.00 0.00 52.86 51.91 1br4 s ASN 723 Cb 0.00 0.12 0.02 0.00 0.41 0.00 0.00 41.25 41.79 1br4 s ASN 723 CO 0.00 -0.15 0.28 0.00 -1.51 0.00 0.00 177.10 175.72 1br4 s ARG 724 N -0.61 0.88 -0.29 -0.60 1.70 -1.24 -1.69 118.95 117.10 1br4 s ARG 724 Ca -0.07 -0.72 -0.15 0.00 -0.47 0.00 0.00 55.73 54.33 1br4 s ARG 724 Cb -0.04 0.37 0.11 0.00 -0.57 0.00 0.00 34.95 34.83 1br4 s ARG 724 CO -0.00 -0.30 0.79 -1.50 -1.08 0.00 0.00 175.30 173.21 1br4 s ILE 725 N -3.31 -0.23 0.39 4.99 2.07 0.42 -4.89 121.20 120.65 1br4 s ILE 725 Ca 0.00 0.00 -0.27 0.00 -1.41 0.00 0.00 60.65 58.97 1br4 s ILE 725 Cb 0.02 -1.00 -0.10 0.00 0.13 0.00 0.00 42.46 41.51 1br4 s ILE 725 CO -0.08 0.00 1.43 0.54 -1.91 0.00 0.00 174.94 174.92 1br4 s VAL 726 N 1.86 2.20 0.00 4.00 0.11 -1.26 0.14 120.40 127.45 1br4 s VAL 726 Ca -0.08 0.20 0.00 0.00 -2.93 0.00 0.00 61.98 59.16 1br4 s VAL 726 Cb -0.06 -3.12 0.00 0.00 -1.53 0.00 0.00 36.38 31.67 1br4 s VAL 726 CO -0.18 0.04 0.56 0.49 -3.33 0.00 0.00 175.10 172.68 1br4 n PHE 727 N 0.30 0.00 -0.01 1.54 3.72 -1.26 -2.43 117.46 119.31 1br4 n PHE 727 Ca 0.02 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1br4 n PHE 727 Cb 0.41 -0.07 -0.00 0.00 -0.94 0.00 0.00 39.48 38.87 1br4 n PHE 727 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 1br4 n GLN 728 N -1.28 -0.01 -0.22 -1.08 -0.06 -1.26 0.12 117.38 113.59 1br4 n GLN 728 Ca 0.00 0.05 -0.08 0.00 -2.00 0.00 0.00 57.00 54.97 1br4 n GLN 728 Cb 0.00 -0.07 0.03 0.00 -4.06 0.00 0.00 30.24 26.14 1br4 n GLN 728 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 1br4 h GLU 729 N 0.00 0.97 -0.36 3.69 3.07 -1.91 0.65 114.58 120.68 1br4 h GLU 729 Ca 0.00 -0.22 0.02 0.00 -0.50 0.00 0.00 59.36 58.67 1br4 h GLU 729 Cb 0.01 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 27.76 1br4 h GLU 729 CO -0.03 0.87 0.19 0.35 -1.40 0.00 0.00 179.01 178.99 1br4 h PHE 730 N 0.89 0.35 0.00 4.33 3.57 0.13 -0.81 116.94 125.40 1br4 h PHE 730 Ca 0.20 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.62 1br4 h PHE 730 Cb 0.31 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 1br4 h PHE 730 CO 0.02 0.19 -0.43 -0.09 -2.23 0.00 0.00 178.31 175.77 1br4 h ARG 731 N 0.39 0.00 -0.24 1.11 9.65 -1.27 -1.80 114.38 122.21 1br4 h ARG 731 Ca 0.15 0.00 -0.11 0.00 -1.10 0.00 0.00 59.98 58.92 1br4 h ARG 731 Cb 0.05 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 1br4 h ARG 731 CO -0.10 0.43 -0.33 0.37 2.80 0.00 0.00 179.97 183.15 1br4 h GLN 732 N 0.00 0.51 0.00 0.20 5.75 -0.02 -3.36 115.11 118.20 1br4 h GLN 732 Ca -0.00 -0.23 0.00 0.00 -0.15 0.00 0.00 58.65 58.27 1br4 h GLN 732 Cb 1.04 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.58 1br4 h GLN 732 CO 0.06 0.78 -0.21 -2.13 -2.65 0.00 0.00 178.83 174.68 1br4 n ARG 733 N -4.07 0.16 -2.25 1.69 3.00 -0.39 -4.72 116.66 110.07 1br4 n ARG 733 Ca -0.01 0.29 -0.43 0.00 -0.00 0.00 0.00 57.85 57.70 1br4 n ARG 733 Cb 0.46 -1.02 0.00 0.00 0.00 0.00 0.00 32.46 31.90 1br4 n ARG 733 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1br4 n TYR 734 N -3.08 3.96 0.00 -0.14 4.01 -0.68 -4.01 117.16 117.21 1br4 n TYR 734 Ca -0.03 -2.95 0.00 0.00 -0.16 0.00 0.00 57.90 54.76 1br4 n TYR 734 Cb 0.11 -2.43 0.00 0.00 -0.31 0.00 0.00 39.34 36.71 1br4 n TYR 734 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 1br4 n GLU 735 N 6.34 0.97 0.22 -0.72 2.13 -1.26 -4.60 120.64 123.72 1br4 n GLU 735 Ca 0.47 0.00 0.15 0.00 0.66 0.00 0.00 57.16 58.44 1br4 n GLU 735 Cb 0.41 -0.72 0.75 0.00 0.27 0.00 0.00 31.44 32.15 1br4 n GLU 735 CO 0.00 0.00 0.00 0.97 -0.41 0.00 0.00 177.13 177.69 1br4 h ILE 736 N 0.00 0.00 -0.00 6.31 2.10 -1.90 0.84 117.51 124.85 1br4 h ILE 736 Ca 0.00 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.82 1br4 h ILE 736 Cb 0.44 0.86 0.00 0.00 -1.09 0.00 0.00 36.82 37.03 1br4 h ILE 736 CO 0.00 0.00 -0.70 0.18 -1.08 0.00 0.00 178.15 176.55 1br4 n LEU 737 N -2.58 1.02 -3.01 2.19 4.77 -1.26 -4.50 117.00 113.63 1br4 n LEU 737 Ca -0.01 -0.37 -0.16 0.00 -0.03 0.00 0.00 56.01 55.44 1br4 n LEU 737 Cb 0.12 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1br4 n LEU 737 CO 0.17 0.23 -0.07 0.00 -1.33 0.00 0.00 177.39 176.39 1br4 n ALA 738 N -1.18 0.49 0.05 -1.18 0.00 0.27 -4.94 120.51 114.03 1br4 n ALA 738 Ca 0.06 -2.28 -0.12 0.00 0.00 0.00 0.00 53.44 51.11 1br4 n ALA 738 Cb 0.36 -1.09 -0.08 0.00 0.00 0.00 0.00 19.45 18.63 1br4 n ALA 738 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1br4 h ALA 739 N 4.45 -0.20 -1.08 0.00 0.00 -1.29 -3.38 119.26 117.77 1br4 h ALA 739 Ca 0.03 -0.24 -0.75 0.00 0.00 0.00 0.00 54.91 53.96 1br4 h ALA 739 Cb 0.97 0.08 -0.15 0.00 0.00 0.00 0.00 17.79 18.69 1br4 h ALA 739 CO 0.32 -0.31 1.89 0.09 0.00 0.00 0.00 179.25 181.25 1br4 n ASN 740 N -4.92 5.08 0.05 0.00 3.02 -1.26 -4.37 115.26 112.85 1br4 n ASN 740 Ca -0.08 -3.06 0.00 0.00 -0.03 0.00 0.00 54.58 51.41 1br4 n ASN 740 Cb 0.27 -1.51 0.00 0.00 -0.61 0.00 0.00 39.78 37.93 1br4 n ASN 740 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1br4 n ALA 741 N 4.51 3.00 -2.71 5.41 0.00 -1.26 -5.07 120.51 124.38 1br4 n ALA 741 Ca 0.40 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.42 1br4 n ALA 741 Cb 0.38 0.01 -0.03 0.00 0.00 0.00 0.00 19.45 19.81 1br4 n ALA 741 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1br4 s ILE 742 N -1.38 4.87 0.00 0.00 -1.09 -1.26 -4.96 121.20 117.39 1br4 s ILE 742 Ca 0.00 2.04 0.00 0.00 -2.23 0.00 0.00 60.65 60.46 1br4 s ILE 742 Cb 0.00 -4.31 0.00 0.00 -1.58 0.00 0.00 42.46 36.57 1br4 s ILE 742 CO 0.00 0.16 0.00 -2.65 -1.23 0.00 0.00 174.94 171.22 1br4 n PRO 743 N 3.92 -0.43 0.11 2.79 -0.02 -1.26 -4.91 135.00 135.20 1br4 n PRO 743 Ca 0.06 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.61 1br4 n PRO 743 Cb 0.51 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.99 1br4 n PRO 743 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1br4 h LYS 744 N 0.00 0.00 -7.24 -0.52 3.64 -2.01 -3.48 116.57 106.96 1br4 h LYS 744 Ca 0.00 0.00 -0.50 0.00 -1.27 0.00 0.00 60.65 58.88 1br4 h LYS 744 Cb 0.00 0.00 0.07 0.00 -0.41 0.00 0.00 32.23 31.89 1br4 h LYS 744 CO 0.00 0.13 0.38 0.20 -2.27 0.00 0.00 179.45 177.89 1br4 s GLY 745 N -4.47 1.96 -0.78 5.01 0.00 -1.26 -4.99 107.32 102.79 1br4 s GLY 745 Ca 0.00 0.26 -0.23 0.00 0.00 0.00 0.00 44.72 44.75 1br4 s GLY 745 CO 0.77 0.57 1.16 -1.36 0.00 0.00 0.00 173.10 174.23 1br4 s PHE 746 N -2.68 2.61 0.48 1.90 0.40 -1.26 -5.00 117.98 114.44 1br4 s PHE 746 Ca 0.61 -0.59 0.05 0.00 -0.60 0.00 0.00 56.93 56.40 1br4 s PHE 746 Cb -0.14 -4.45 -0.01 0.00 0.51 0.00 0.00 43.02 38.92 1br4 s PHE 746 CO 0.42 -1.79 0.20 -1.64 0.70 0.00 0.00 175.22 173.12 1br4 s MET 747 N 4.45 2.22 -0.11 0.44 -1.94 -1.26 -5.07 119.30 118.03 1br4 s MET 747 Ca 0.31 -2.06 -0.39 0.00 -1.71 0.00 0.00 55.69 51.84 1br4 s MET 747 Cb -0.10 -1.89 -0.17 0.00 2.01 0.00 0.00 34.83 34.68 1br4 s MET 747 CO 0.05 -0.35 1.49 -3.47 -0.01 0.00 0.00 175.02 172.73 1br4 n ASP 748 N -1.42 1.74 0.29 3.03 -0.08 -1.26 -4.82 116.55 114.04 1br4 n ASP 748 Ca -0.06 1.11 0.18 0.00 -1.51 0.00 0.00 54.79 54.51 1br4 n ASP 748 Cb 0.65 -1.12 0.97 0.00 2.34 0.00 0.00 41.12 43.96 1br4 n ASP 748 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1br4 h GLY 749 N 5.47 0.00 0.24 0.27 0.00 -1.98 0.27 103.07 107.35 1br4 h GLY 749 Ca -0.47 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 1br4 h GLY 749 CO 0.85 0.00 -0.05 1.70 0.00 0.00 0.00 176.54 179.05 1br4 h LYS 750 N 0.00 -0.12 0.00 4.80 3.64 -1.91 -2.70 116.57 120.27 1br4 h LYS 750 Ca 0.03 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 1br4 h LYS 750 Cb 0.30 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1br4 h LYS 750 CO -0.00 0.38 -0.40 0.37 -2.27 0.00 0.00 179.45 177.52 1br4 h GLN 751 N -0.89 0.00 -0.18 1.90 -0.00 -1.80 -1.10 115.11 113.03 1br4 h GLN 751 Ca -0.01 0.00 -0.11 0.00 -0.00 0.00 0.00 58.65 58.53 1br4 h GLN 751 Cb 0.56 0.00 -0.00 0.00 0.00 0.00 0.00 27.48 28.04 1br4 h GLN 751 CO 0.02 0.40 -0.31 0.00 0.00 0.00 0.00 178.83 178.94 1br4 h ALA 752 N 1.60 0.28 -0.13 3.38 0.00 -1.07 -2.41 119.26 120.91 1br4 h ALA 752 Ca -0.00 -0.41 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 1br4 h ALA 752 Cb 0.82 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1br4 h ALA 752 CO 0.05 0.31 -0.39 0.00 0.00 0.00 0.00 179.25 179.23 1br4 h ILE 754 N 0.24 1.23 -0.36 0.00 5.03 -1.14 -1.83 117.51 120.69 1br4 h ILE 754 Ca 0.02 -0.78 -0.05 0.00 -0.12 0.00 0.00 64.86 63.93 1br4 h ILE 754 Cb 0.80 0.80 -0.02 0.00 -3.03 0.00 0.00 36.82 35.37 1br4 h ILE 754 CO 0.06 0.29 -0.01 -0.07 -0.68 0.00 0.00 178.15 177.74 1br4 h LEU 755 N 0.67 0.53 0.20 1.44 4.07 -1.24 -1.07 115.31 119.91 1br4 h LEU 755 Ca 0.16 -0.10 -0.01 0.00 0.08 0.00 0.00 57.88 58.01 1br4 h LEU 755 Cb 0.29 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.89 1br4 h LEU 755 CO -0.00 0.60 -0.10 0.24 -1.08 0.00 0.00 178.44 178.10 1br4 h MET 756 N 0.53 -0.26 -0.94 1.13 2.86 -1.18 -2.36 114.93 114.71 1br4 h MET 756 Ca 0.11 0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.82 1br4 h MET 756 Cb 0.35 0.06 -0.06 0.00 0.06 0.00 0.00 31.60 32.01 1br4 h MET 756 CO 0.01 0.08 0.62 0.82 1.06 0.00 0.00 176.91 179.50 1br4 h ILE 757 N -0.64 1.13 -0.25 -1.22 2.04 -1.24 -2.04 117.51 115.29 1br4 h ILE 757 Ca -0.03 -0.40 -0.09 0.00 1.00 0.00 0.00 64.86 65.35 1br4 h ILE 757 Cb 0.46 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1br4 h ILE 757 CO 0.05 0.21 -0.23 0.50 0.00 0.00 0.00 178.15 178.67 1br4 h LYS 758 N 1.15 0.47 -0.45 2.37 3.64 -1.19 -2.03 116.57 120.54 1br4 h LYS 758 Ca 0.39 -0.17 -0.05 0.00 -1.27 0.00 0.00 60.65 59.54 1br4 h LYS 758 Cb 0.07 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1br4 h LYS 758 CO -0.13 0.67 0.07 0.00 -2.27 0.00 0.00 179.45 177.80 1br4 h ALA 759 N 1.34 0.59 -0.14 5.00 0.00 -0.81 -2.07 119.26 123.16 1br4 h ALA 759 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1br4 h ALA 759 Cb 0.64 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1br4 h ALA 759 CO 0.05 0.32 0.00 1.28 0.00 0.00 0.00 179.25 180.89 1br4 n LEU 760 N -4.47 1.17 -4.32 0.00 4.77 -1.07 -4.89 117.00 108.19 1br4 n LEU 760 Ca 0.00 -0.59 -0.31 0.00 -0.03 0.00 0.00 56.01 55.08 1br4 n LEU 760 Cb 0.24 -0.24 -0.10 0.00 -2.33 0.00 0.00 43.42 41.00 1br4 n LEU 760 CO 0.40 0.24 -0.47 -0.62 -1.33 0.00 0.00 177.39 175.60 1br4 n GLU 761 N -0.00 -0.94 -1.94 3.23 1.02 -0.78 -4.84 120.64 116.38 1br4 n GLU 761 Ca 0.05 0.09 -0.42 0.00 -0.02 0.00 0.00 57.16 56.87 1br4 n GLU 761 Cb 0.23 -3.60 -0.02 0.00 -0.02 0.00 0.00 31.44 28.02 1br4 n GLU 761 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1br4 s LEU 762 N -7.39 4.37 -0.09 -4.62 1.43 -0.78 -4.92 118.68 106.69 1br4 s LEU 762 Ca 0.01 2.70 -0.29 0.00 -1.03 0.00 0.00 54.13 55.52 1br4 s LEU 762 Cb -0.01 -3.61 -0.05 0.00 0.03 0.00 0.00 46.19 42.55 1br4 s LEU 762 CO 1.00 -0.78 1.61 -0.62 0.23 0.00 0.00 176.35 177.79 1br4 s ASP 763 N 0.69 6.65 0.00 2.29 2.15 -1.26 -4.82 116.67 122.36 1br4 s ASP 763 Ca 0.64 2.09 0.00 0.00 0.43 0.00 0.00 52.55 55.71 1br4 s ASP 763 Cb -0.44 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.65 1br4 s ASP 763 CO 0.39 -0.96 0.00 -0.81 -0.17 0.00 0.00 175.17 173.62 1br4 n PRO 764 N 7.16 0.00 0.00 4.34 -0.04 -1.26 -1.14 135.00 144.06 1br4 n PRO 764 Ca 0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 1br4 n PRO 764 Cb 0.43 -0.95 0.00 0.00 -0.04 0.00 0.00 33.50 32.95 1br4 n PRO 764 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1br4 n ASN 765 N 0.52 0.13 0.02 3.54 4.05 -1.26 -4.73 115.26 117.53 1br4 n ASN 765 Ca 0.00 -0.54 -0.15 0.00 0.45 0.00 0.00 54.58 54.34 1br4 n ASN 765 Cb 0.00 0.14 -0.14 0.00 1.23 0.00 0.00 39.78 41.01 1br4 n ASN 765 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1br4 h LEU 766 N 0.00 0.25 -9.38 1.20 3.38 -1.52 -3.48 115.31 105.76 1br4 h LEU 766 Ca 0.00 -0.43 -0.59 0.00 0.09 0.00 0.00 57.88 56.95 1br4 h LEU 766 Cb 0.17 -0.08 -0.12 0.00 0.09 0.00 0.00 40.66 40.72 1br4 h LEU 766 CO 0.00 1.37 -0.70 -0.72 0.09 0.00 0.00 178.44 178.48 1br4 s TYR 767 N -2.60 2.55 -0.08 1.13 1.13 -1.26 0.17 117.35 118.38 1br4 s TYR 767 Ca -0.10 -0.26 -0.01 0.00 -1.41 0.00 0.00 57.07 55.29 1br4 s TYR 767 Cb 0.07 -1.15 0.03 0.00 -1.10 0.00 0.00 41.96 39.81 1br4 s TYR 767 CO 0.82 0.62 -0.03 0.50 -2.51 0.00 0.00 175.55 174.96 1br4 s ARG 768 N -3.40 0.93 0.27 -3.49 6.06 0.69 -4.86 118.95 115.15 1br4 s ARG 768 Ca 0.29 -0.02 -0.27 0.00 -2.50 0.00 0.00 55.73 53.22 1br4 s ARG 768 Cb -0.07 -1.18 -0.09 0.00 0.06 0.00 0.00 34.95 33.67 1br4 s ARG 768 CO 0.17 -0.28 0.92 0.42 -2.50 0.00 0.00 175.30 174.03 1br4 s ILE 769 N 1.84 4.18 0.00 4.11 -1.09 -1.26 -1.01 121.20 127.97 1br4 s ILE 769 Ca 0.04 1.91 0.00 0.00 -2.23 0.00 0.00 60.65 60.37 1br4 s ILE 769 Cb -0.12 -4.15 0.00 0.00 -1.58 0.00 0.00 42.46 36.61 1br4 s ILE 769 CO -0.06 0.32 0.00 0.61 -1.23 0.00 0.00 174.94 174.58 1br4 n GLY 770 N 1.02 5.87 0.48 6.18 0.00 -1.07 -4.26 105.19 113.41 1br4 n GLY 770 Ca -0.00 -1.73 -0.19 0.00 0.00 0.00 0.00 46.02 44.10 1br4 n GLY 770 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1br4 h GLN 771 N 0.00 -1.17 -1.38 1.61 5.75 -1.93 -3.40 115.11 114.59 1br4 h GLN 771 Ca 0.00 0.08 -0.41 0.00 -0.15 0.00 0.00 58.65 58.17 1br4 h GLN 771 Cb 0.00 0.27 -0.28 0.00 1.07 0.00 0.00 27.48 28.53 1br4 h GLN 771 CO 0.00 -0.78 -0.82 0.45 -2.65 0.00 0.00 178.83 175.03 1br4 n SER 772 N -5.30 -1.37 0.00 -0.69 2.88 -1.26 -4.93 113.62 102.96 1br4 n SER 772 Ca -0.15 -2.83 0.00 0.00 -1.33 0.00 0.00 58.87 54.56 1br4 n SER 772 Cb 0.48 0.42 0.00 0.00 -0.75 0.00 0.00 64.21 64.36 1br4 n SER 772 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1br4 n LYS 773 N 2.01 0.00 -4.86 -1.46 4.81 -1.26 -4.38 118.16 113.02 1br4 n LYS 773 Ca 0.19 0.00 -0.32 0.00 -0.87 0.00 0.00 58.31 57.31 1br4 n LYS 773 Cb 0.55 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 35.47 1br4 n LYS 773 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1br4 s ILE 774 N -2.00 2.85 -0.81 3.15 -1.09 0.36 -2.60 121.20 121.06 1br4 s ILE 774 Ca 0.00 -0.93 -0.02 0.00 -2.23 0.00 0.00 60.65 57.47 1br4 s ILE 774 Cb 0.00 -2.13 0.20 0.00 -1.58 0.00 0.00 42.46 38.95 1br4 s ILE 774 CO 0.00 0.50 0.67 -0.36 -1.23 0.00 0.00 174.94 174.52 1br4 s PHE 775 N -0.79 3.75 0.65 3.97 0.40 -0.18 -0.44 117.98 125.33 1br4 s PHE 775 Ca 0.13 -2.96 -0.13 0.00 -0.60 0.00 0.00 56.93 53.37 1br4 s PHE 775 Cb -0.10 -3.21 -0.02 0.00 0.51 0.00 0.00 43.02 40.20 1br4 s PHE 775 CO 0.02 -0.75 1.05 -0.06 0.70 0.00 0.00 175.22 176.18 1br4 s PHE 776 N -1.01 3.15 0.92 0.36 0.08 -0.68 -0.22 117.98 120.58 1br4 s PHE 776 Ca 0.24 1.44 -0.14 0.00 0.12 0.00 0.00 56.93 58.59 1br4 s PHE 776 Cb -0.10 -2.90 0.17 0.00 -0.57 0.00 0.00 43.02 39.62 1br4 s PHE 776 CO -0.10 -1.08 1.28 0.50 -0.10 0.00 0.00 175.22 175.71 1br4 s ARG 777 N -4.70 0.98 0.40 0.44 6.06 0.44 -3.12 118.95 119.46 1br4 s ARG 777 Ca 0.59 -0.32 -0.26 0.00 -2.50 0.00 0.00 55.73 53.24 1br4 s ARG 777 Cb -0.14 -1.89 -0.09 0.00 0.06 0.00 0.00 34.95 32.89 1br4 s ARG 777 CO 0.48 -2.19 1.35 0.95 -2.50 0.00 0.00 175.30 173.38 1br4 s THR 778 N -3.79 2.46 0.00 4.11 -4.23 -1.26 -2.64 115.64 110.30 1br4 s THR 778 Ca 0.71 0.42 0.00 0.00 -1.18 0.00 0.00 61.69 61.64 1br4 s THR 778 Cb -0.05 -3.25 0.00 0.00 1.34 0.00 0.00 72.50 70.53 1br4 s THR 778 CO 0.52 0.07 0.00 0.61 -0.54 0.00 0.00 174.62 175.28 1br4 n GLY 779 N 0.64 0.05 0.10 3.99 0.00 -1.26 -4.67 105.19 104.03 1br4 n GLY 779 Ca 0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.14 1br4 n GLY 779 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1br4 n VAL 780 N -2.00 1.08 -0.10 1.61 0.31 -1.08 -1.57 118.33 116.58 1br4 n VAL 780 Ca 0.00 0.40 -0.11 0.00 -0.01 0.00 0.00 64.34 64.62 1br4 n VAL 780 Cb 0.00 -1.33 -0.15 0.00 -0.91 0.00 0.00 33.84 31.45 1br4 n VAL 780 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1br4 n LEU 781 N -2.00 0.49 -0.18 7.52 -0.00 -1.26 -4.13 117.00 117.44 1br4 n LEU 781 Ca 0.01 -0.01 -0.03 0.00 -0.00 0.00 0.00 56.01 55.98 1br4 n LEU 781 Cb 0.14 0.27 0.18 0.00 -0.00 0.00 0.00 43.42 44.00 1br4 n LEU 781 CO 0.13 0.57 1.04 0.00 -0.00 0.00 0.00 177.39 179.13 1br4 h ALA 782 N 0.84 1.23 -0.16 1.96 0.00 -1.66 -0.34 119.26 121.14 1br4 h ALA 782 Ca -0.55 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.18 1br4 h ALA 782 Cb 2.19 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.72 1br4 h ALA 782 CO 0.01 0.56 0.07 1.25 0.00 0.00 0.00 179.25 181.14 1br4 h HIS 783 N 0.91 0.23 -0.96 0.00 -0.00 -1.61 0.05 115.15 113.77 1br4 h HIS 783 Ca 0.21 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.56 1br4 h HIS 783 Cb 0.20 -0.07 -0.05 0.00 -0.00 0.00 0.00 27.41 27.49 1br4 h HIS 783 CO 0.01 0.29 0.59 -0.07 -0.00 0.00 0.00 177.93 178.76 1br4 h LEU 784 N 0.11 1.13 -0.38 0.26 -0.00 -1.64 -0.79 115.31 114.00 1br4 h LEU 784 Ca 0.05 -0.06 -0.03 0.00 -0.00 0.00 0.00 57.88 57.85 1br4 h LEU 784 Cb 0.16 -0.29 -0.02 0.00 -0.00 0.00 0.00 40.66 40.51 1br4 h LEU 784 CO -0.01 0.86 0.14 -0.08 -0.00 0.00 0.00 178.44 179.35 1br4 h GLU 785 N 1.31 0.58 -0.32 1.13 4.57 -0.78 -1.76 114.58 119.31 1br4 h GLU 785 Ca 0.34 -0.11 -0.16 0.00 -1.18 0.00 0.00 59.36 58.25 1br4 h GLU 785 Cb -0.08 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.42 1br4 h GLU 785 CO -0.07 0.57 -0.44 1.49 -1.18 0.00 0.00 179.01 179.38 1br4 h GLU 786 N 0.47 0.87 -0.64 1.92 4.81 -0.72 -1.99 114.58 119.29 1br4 h GLU 786 Ca 0.12 -0.50 -0.03 0.00 -0.13 0.00 0.00 59.36 58.82 1br4 h GLU 786 Cb 0.22 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 1br4 h GLU 786 CO -0.01 1.14 0.29 0.93 -0.73 0.00 0.00 179.01 180.63 1br4 h GLU 787 N 0.66 0.94 -0.61 1.92 4.39 -1.12 -1.33 114.58 119.43 1br4 h GLU 787 Ca 0.04 -0.15 -0.09 0.00 0.34 0.00 0.00 59.36 59.49 1br4 h GLU 787 Cb 1.04 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 29.51 1br4 h GLU 787 CO 0.10 0.77 0.01 -0.09 -1.16 0.00 0.00 179.01 178.64 1br4 h ARG 788 N 0.90 1.06 -0.64 2.33 2.43 -1.29 -2.37 114.38 116.80 1br4 h ARG 788 Ca 0.22 -0.33 -0.08 0.00 -0.81 0.00 0.00 59.98 58.98 1br4 h ARG 788 Cb 0.16 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1br4 h ARG 788 CO -0.02 1.03 0.09 -0.44 -1.51 0.00 0.00 179.97 179.12 1br4 h ASP 789 N 0.97 1.02 -0.70 -3.80 5.19 -1.08 -2.95 116.42 115.07 1br4 h ASP 789 Ca 0.17 -0.24 -0.03 0.00 -0.62 0.00 0.00 57.03 56.31 1br4 h ASP 789 Cb 0.55 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 39.76 1br4 h ASP 789 CO 0.03 1.01 0.32 -0.07 -3.12 0.00 0.00 179.24 177.42 1br4 h LEU 790 N 0.99 0.93 -1.07 1.55 4.07 -1.08 -2.42 115.31 118.29 1br4 h LEU 790 Ca 0.20 -0.14 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1br4 h LEU 790 Cb 0.44 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 41.94 1br4 h LEU 790 CO 0.01 0.82 0.00 0.29 -1.08 0.00 0.00 178.44 178.48 1br4 n LYS 791 N -4.42 0.76 0.00 1.13 5.02 -0.91 -3.21 118.16 116.54 1br4 n LYS 791 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1br4 n LYS 791 Cb 0.14 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 1br4 n LYS 791 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1br4 n ILE 792 N 0.15 0.00 -0.19 -0.18 -6.64 -1.11 -4.97 119.36 106.43 1br4 n ILE 792 Ca 0.00 0.00 -0.07 0.00 -1.77 0.00 0.00 62.75 60.91 1br4 n ILE 792 Cb 0.20 0.26 -0.06 0.00 -1.44 0.00 0.00 39.64 38.61 1br4 n ILE 792 CO 0.00 0.00 0.00 0.71 -1.77 0.00 0.00 176.55 175.49 1br4 h THR 793 N 0.00 0.00 -0.82 7.28 1.35 -1.41 0.12 112.91 119.44 1br4 h THR 793 Ca 0.00 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 65.93 1br4 h THR 793 Cb 0.00 0.00 -0.10 0.00 -1.73 0.00 0.00 68.15 66.32 1br4 h THR 793 CO 0.00 0.00 -0.48 0.47 -0.25 0.00 0.00 175.52 175.26 1br4 n ASP 794 N -4.32 -0.86 -0.35 5.36 9.92 -1.26 0.11 116.55 125.15 1br4 n ASP 794 Ca -0.00 1.62 0.14 0.00 -0.53 0.00 0.00 54.79 56.02 1br4 n ASP 794 Cb 0.17 -0.27 0.34 0.00 -0.64 0.00 0.00 41.12 40.72 1br4 n ASP 794 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 1br4 h VAL 795 N 0.00 0.64 -0.19 2.53 2.07 -1.72 1.15 116.25 120.73 1br4 h VAL 795 Ca 0.13 -0.24 -0.11 0.00 0.82 0.00 0.00 66.70 67.30 1br4 h VAL 795 Cb 0.33 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 1br4 h VAL 795 CO -0.77 0.13 -0.36 0.40 0.02 0.00 0.00 177.57 176.99 1br4 h ILE 796 N 0.69 1.29 -0.08 4.57 1.08 0.35 -0.37 117.51 125.04 1br4 h ILE 796 Ca 0.60 -1.46 -0.21 0.00 -0.39 0.00 0.00 64.86 63.40 1br4 h ILE 796 Cb 1.00 1.54 0.01 0.00 -3.07 0.00 0.00 36.82 36.31 1br4 h ILE 796 CO -0.42 0.45 -0.77 0.40 -0.69 0.00 0.00 178.15 177.12 1br4 h ILE 797 N 0.35 1.32 0.19 -0.67 2.04 0.66 0.24 117.51 121.64 1br4 h ILE 797 Ca 0.04 -2.03 -0.01 0.00 1.00 0.00 0.00 64.86 63.86 1br4 h ILE 797 Cb 0.80 2.23 0.00 0.00 -0.74 0.00 0.00 36.82 39.11 1br4 h ILE 797 CO 0.06 0.63 -0.09 0.00 0.00 0.00 0.00 178.15 178.75 1br4 h ALA 798 N 0.46 -0.26 -0.17 1.87 0.00 0.12 -1.28 119.26 119.99 1br4 h ALA 798 Ca -0.07 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 1br4 h ALA 798 Cb 1.42 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 1br4 h ALA 798 CO 0.16 -0.61 -0.39 0.35 0.00 0.00 0.00 179.25 178.75 1br4 h PHE 799 N -0.33 0.44 -0.96 0.00 3.57 -1.14 -2.42 116.94 116.09 1br4 h PHE 799 Ca -0.03 -0.12 0.03 0.00 3.53 0.00 0.00 57.97 61.38 1br4 h PHE 799 Cb 0.26 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.85 1br4 h PHE 799 CO -0.04 0.72 0.63 1.96 -2.23 0.00 0.00 178.31 179.35 1br4 h GLN 800 N 0.32 1.21 -0.39 1.11 4.20 -0.73 0.14 115.11 120.97 1br4 h GLN 800 Ca 0.03 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.54 1br4 h GLN 800 Cb 0.84 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1br4 h GLN 800 CO 0.07 0.80 -0.26 0.00 -0.67 0.00 0.00 178.83 178.77 1br4 h ALA 801 N 1.38 0.80 -0.58 3.87 0.00 -0.97 -1.47 119.26 122.30 1br4 h ALA 801 Ca 0.37 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1br4 h ALA 801 Cb -0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1br4 h ALA 801 CO -0.11 0.65 -0.03 1.96 0.00 0.00 0.00 179.25 181.72 1br4 h GLN 802 N 0.70 1.04 -0.47 0.00 1.08 -0.83 -1.48 115.11 115.16 1br4 h GLN 802 Ca 0.09 -0.35 -0.10 0.00 -1.45 0.00 0.00 58.65 56.84 1br4 h GLN 802 Cb 0.80 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.12 1br4 h GLN 802 CO 0.07 1.04 -0.11 0.00 -0.95 0.00 0.00 178.83 178.88 1br4 h ARG 804 N 0.76 0.52 -0.45 0.00 3.08 -1.02 -0.91 114.38 116.37 1br4 h ARG 804 Ca 0.13 -0.09 0.05 0.00 0.07 0.00 0.00 59.98 60.13 1br4 h ARG 804 Cb 0.61 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.53 1br4 h ARG 804 CO 0.04 0.51 0.20 0.78 -1.07 0.00 0.00 179.97 180.43 1br4 h GLY 805 N 0.42 0.61 1.00 0.04 0.00 -1.08 0.54 103.07 104.59 1br4 h GLY 805 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1br4 h GLY 805 CO -0.01 0.07 0.25 -1.82 0.00 0.00 0.00 176.54 175.03 1br4 h TYR 806 N 0.40 0.49 -0.10 5.60 3.20 -1.20 -1.03 116.97 124.33 1br4 h TYR 806 Ca 0.20 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.08 1br4 h TYR 806 Cb 0.15 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.25 1br4 h TYR 806 CO -0.12 0.32 0.05 1.25 -1.64 0.00 0.00 178.16 178.02 1br4 h LEU 807 N 0.51 0.13 0.11 2.82 5.85 -0.50 -1.20 115.31 123.04 1br4 h LEU 807 Ca 0.14 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1br4 h LEU 807 Cb -0.04 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1br4 h LEU 807 CO -0.03 0.20 -0.08 0.00 -0.34 0.00 0.00 178.44 178.19 1br4 h ALA 808 N 0.93 -0.18 0.00 1.25 0.00 0.23 -1.68 119.26 119.82 1br4 h ALA 808 Ca 0.03 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1br4 h ALA 808 Cb 0.10 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1br4 h ALA 808 CO -0.00 -0.61 -0.18 0.07 0.00 0.00 0.00 179.25 178.52 1br4 h ARG 809 N -0.20 0.00 0.14 0.00 -0.00 -1.21 -2.98 114.38 110.14 1br4 h ARG 809 Ca -0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 59.98 59.78 1br4 h ARG 809 Cb 0.18 0.00 0.02 0.00 -0.00 0.00 0.00 29.97 30.17 1br4 h ARG 809 CO -0.00 0.18 -0.85 0.87 -0.00 0.00 0.00 179.97 180.17 1br4 h LYS 810 N 0.00 0.31 -0.40 0.08 1.79 -0.97 -3.19 116.57 114.19 1br4 h LYS 810 Ca -0.00 -0.52 -0.11 0.00 -2.18 0.00 0.00 60.65 57.83 1br4 h LYS 810 Cb 0.68 0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 31.52 1br4 h LYS 810 CO 0.02 1.25 -0.19 0.00 -1.08 0.00 0.00 179.45 179.46 1br4 h ALA 811 N 0.08 0.57 0.00 3.86 0.00 -1.36 -2.96 119.26 119.44 1br4 h ALA 811 Ca -0.15 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1br4 h ALA 811 Cb 1.66 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.31 1br4 h ALA 811 CO 0.15 0.52 -0.07 0.35 0.00 0.00 0.00 179.25 180.20 1br4 h PHE 812 N 0.65 0.00 0.00 0.00 3.57 -1.67 -2.06 116.94 117.43 1br4 h PHE 812 Ca 0.09 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.42 1br4 h PHE 812 Cb 0.74 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 1br4 h PHE 812 CO 0.06 0.07 -0.81 0.00 -2.23 0.00 0.00 178.31 175.39 1br4 h ALA 813 N 1.93 0.60 0.15 2.41 0.00 -1.50 -2.98 119.26 119.87 1br4 h ALA 813 Ca -0.00 -0.74 -0.30 0.00 0.00 0.00 0.00 54.91 53.87 1br4 h ALA 813 Cb 0.25 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 17.93 1br4 h ALA 813 CO 0.01 1.02 -1.30 1.57 0.00 0.00 0.00 179.25 180.55 1br4 h LYS 814 N 0.00 0.54 -0.30 0.00 2.10 -1.37 -3.18 116.57 114.35 1br4 h LYS 814 Ca -0.01 -0.79 -0.11 0.00 -2.00 0.00 0.00 60.65 57.74 1br4 h LYS 814 Cb 1.49 0.27 -0.01 0.00 -0.90 0.00 0.00 32.23 33.08 1br4 h LYS 814 CO 0.11 1.36 -0.28 -0.09 -2.00 0.00 0.00 179.45 178.54 1br4 h ARG 815 N 0.21 0.62 -0.30 0.07 9.65 -1.56 -2.60 114.38 120.48 1br4 h ARG 815 Ca -0.19 -0.26 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 1br4 h ARG 815 Cb 1.98 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 30.52 1br4 h ARG 815 CO 0.24 0.84 0.19 1.96 2.80 0.00 0.00 179.97 186.00 1br4 h GLN 816 N 0.54 0.39 -0.15 0.20 4.20 -1.59 -2.32 115.11 116.38 1br4 h GLN 816 Ca 0.07 -0.03 -0.16 0.00 0.06 0.00 0.00 58.65 58.59 1br4 h GLN 816 Cb 0.76 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.45 1br4 h GLN 816 CO 0.06 0.27 -0.59 -0.56 -0.67 0.00 0.00 178.83 177.34 1br4 h GLN 817 N 0.41 0.50 -0.21 1.46 -0.00 -1.44 -3.18 115.11 112.64 1br4 h GLN 817 Ca 0.11 -0.33 -0.01 0.00 -0.00 0.00 0.00 58.65 58.42 1br4 h GLN 817 Cb -0.03 0.05 -0.01 0.00 -0.00 0.00 0.00 27.48 27.49 1br4 h GLN 817 CO -0.02 0.94 0.09 1.96 -0.00 0.00 0.00 178.83 181.80 1br4 h GLN 818 N 0.38 0.31 -0.51 0.06 4.20 -1.29 -2.52 115.11 115.72 1br4 h GLN 818 Ca -0.00 -0.05 0.08 0.00 0.06 0.00 0.00 58.65 58.74 1br4 h GLN 818 Cb 1.13 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.79 1br4 h GLN 818 CO 0.11 0.34 0.16 1.37 -0.67 0.00 0.00 178.83 180.14 1br4 h LEU 819 N 0.20 0.13 -1.47 1.46 8.10 -1.59 -1.90 115.31 120.25 1br4 h LEU 819 Ca 0.07 0.07 -0.06 0.00 0.11 0.00 0.00 57.88 58.08 1br4 h LEU 819 Cb 0.14 0.07 -0.01 0.00 -0.44 0.00 0.00 40.66 40.42 1br4 h LEU 819 CO -0.01 0.10 -0.27 1.23 -4.11 0.00 0.00 178.44 175.38 1br4 h GLY 820 N 0.33 0.00 1.00 0.17 0.00 -1.51 -3.53 103.07 99.53 1br4 h GLY 820 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1br4 h GLY 820 CO -0.28 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.70