#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxd n SER 3 N 0.00 0.00 -3.69 2.55 3.41 -1.26 -5.11 113.62 109.51 1gxd n SER 3 Ca 0.00 -0.43 0.00 0.00 -0.26 0.00 0.00 58.87 58.18 1gxd n SER 3 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1gxd n SER 3 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1gxd n PRO 4 N -0.43 1.80 -3.94 4.33 -0.02 -1.26 -5.09 135.00 130.39 1gxd n PRO 4 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.39 1gxd n PRO 4 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 33.50 33.38 1gxd n PRO 4 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1gxd s ILE 5 N 0.00 0.13 0.02 4.25 -4.36 -1.26 -5.11 121.20 114.87 1gxd s ILE 5 Ca 0.00 -1.10 -0.02 0.00 -0.26 0.00 0.00 60.65 59.26 1gxd s ILE 5 Cb 0.00 -0.86 -0.02 0.00 1.25 0.00 0.00 42.46 42.84 1gxd s ILE 5 CO 0.00 -0.61 0.02 -0.63 0.24 0.00 0.00 174.94 173.97 1gxd s ILE 6 N -2.54 0.11 0.00 8.37 1.01 -1.25 -3.23 121.20 123.68 1gxd s ILE 6 Ca -0.06 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.67 1gxd s ILE 6 Cb -0.02 -0.43 0.00 0.00 0.01 0.00 0.00 42.46 42.03 1gxd s ILE 6 CO -0.04 -0.51 0.00 1.17 0.00 0.00 0.00 174.94 175.56 1gxd n LYS 7 N 1.41 0.00 -3.22 2.79 4.81 -0.99 -5.03 118.16 117.93 1gxd n LYS 7 Ca -0.23 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.25 1gxd n LYS 7 Cb 0.56 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.59 1gxd n LYS 7 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1gxd s PHE 8 N -1.21 -0.85 0.76 5.64 0.08 -1.26 -4.71 117.98 116.44 1gxd s PHE 8 Ca 0.00 1.03 -0.14 0.00 0.12 0.00 0.00 56.93 57.94 1gxd s PHE 8 Cb 0.00 0.35 0.06 0.00 -0.57 0.00 0.00 43.02 42.85 1gxd s PHE 8 CO 0.00 -0.45 1.18 -2.14 -0.10 0.00 0.00 175.22 173.71 1gxd s PRO 9 N 2.81 1.97 -0.50 0.24 0.02 -1.26 -4.29 135.00 134.00 1gxd s PRO 9 Ca 0.04 1.67 -0.02 0.00 0.02 0.00 0.00 61.00 62.70 1gxd s PRO 9 Cb -0.11 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.59 1gxd s PRO 9 CO -0.15 -1.94 0.43 0.41 -0.33 0.00 0.00 177.00 175.41 1gxd n GLY 10 N 0.21 0.27 0.00 0.52 0.00 -1.26 -4.90 105.19 100.03 1gxd n GLY 10 Ca 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1gxd n GLY 10 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gxd n ASP 11 N -0.94 0.00 -4.02 1.61 5.75 -1.26 -4.76 116.55 112.93 1gxd n ASP 11 Ca -0.05 0.00 -0.31 0.00 -0.01 0.00 0.00 54.79 54.43 1gxd n ASP 11 Cb 0.54 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.47 1gxd n ASP 11 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gxd s VAL 12 N -2.00 1.66 0.00 2.12 0.11 -1.26 -4.92 120.40 116.11 1gxd s VAL 12 Ca 0.00 -0.82 0.00 0.00 -2.93 0.00 0.00 61.98 58.23 1gxd s VAL 12 Cb 0.00 -1.62 0.00 0.00 -1.53 0.00 0.00 36.38 33.23 1gxd s VAL 12 CO 0.00 0.36 0.25 0.00 -3.33 0.00 0.00 175.10 172.38 1gxd n ALA 13 N 4.72 1.81 -1.74 1.54 0.00 -1.26 -4.97 120.51 120.61 1gxd n ALA 13 Ca -0.17 -0.25 -0.37 0.00 0.00 0.00 0.00 53.44 52.66 1gxd n ALA 13 Cb 0.49 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 1gxd n ALA 13 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1gxd s PRO 14 N -0.29 2.30 -0.37 0.00 0.02 -1.26 -4.91 135.00 130.49 1gxd s PRO 14 Ca 0.00 1.11 -0.07 0.00 0.02 0.00 0.00 61.00 62.05 1gxd s PRO 14 Cb 0.00 -4.51 0.05 0.00 0.02 0.00 0.00 34.50 30.06 1gxd s PRO 14 CO 0.00 -3.08 0.17 0.15 -0.33 0.00 0.00 177.00 173.91 1gxd s LYS 15 N 7.80 2.59 0.13 5.54 1.02 -1.26 -5.06 119.74 130.51 1gxd s LYS 15 Ca 0.86 -1.30 -0.35 0.00 0.02 0.00 0.00 55.97 55.20 1gxd s LYS 15 Cb -0.15 -3.59 -0.16 0.00 -0.52 0.00 0.00 37.83 33.41 1gxd s LYS 15 CO 0.24 -0.78 1.32 2.41 -0.92 0.00 0.00 175.35 177.62 1gxd n THR 16 N 4.84 0.31 -0.14 2.17 -1.04 -1.26 -4.72 114.28 114.43 1gxd n THR 16 Ca -0.11 -0.08 -0.10 0.00 -2.04 0.00 0.00 64.05 61.73 1gxd n THR 16 Cb 0.44 -0.94 -0.05 0.00 -1.82 0.00 0.00 70.33 67.97 1gxd n THR 16 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1gxd h ASP 17 N 4.34 -1.46 -0.29 8.00 3.58 -1.99 0.46 116.42 129.06 1gxd h ASP 17 Ca -0.46 0.22 -0.02 0.00 0.42 0.00 0.00 57.03 57.20 1gxd h ASP 17 Cb 1.33 0.64 -0.01 0.00 1.72 0.00 0.00 39.33 43.00 1gxd h ASP 17 CO 0.77 -0.36 0.11 0.11 -2.88 0.00 0.00 179.24 176.99 1gxd h LYS 18 N -0.31 0.44 -1.05 0.28 1.57 -2.00 -1.65 116.57 113.85 1gxd h LYS 18 Ca 0.14 -0.08 0.27 0.00 -1.87 0.00 0.00 60.65 59.11 1gxd h LYS 18 Cb 0.58 -0.07 -0.10 0.00 0.08 0.00 0.00 32.23 32.72 1gxd h LYS 18 CO -0.60 0.46 0.66 1.49 -0.57 0.00 0.00 179.45 180.89 1gxd h GLU 19 N 0.32 0.41 -0.48 3.15 4.57 -1.55 0.62 114.58 121.61 1gxd h GLU 19 Ca 0.10 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.21 1gxd h GLU 19 Cb 0.19 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 1gxd h GLU 19 CO -0.01 0.27 0.13 1.25 -1.18 0.00 0.00 179.01 179.47 1gxd h LEU 20 N 0.42 0.72 0.30 1.64 5.85 0.77 -1.94 115.31 123.06 1gxd h LEU 20 Ca 0.62 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 59.11 1gxd h LEU 20 Cb 1.50 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1gxd h LEU 20 CO -0.35 0.75 -0.14 0.00 -0.34 0.00 0.00 178.44 178.36 1gxd h ALA 21 N 1.00 -0.40 -0.91 1.25 0.00 0.68 0.10 119.26 120.98 1gxd h ALA 21 Ca 0.15 -0.10 0.25 0.00 0.00 0.00 0.00 54.91 55.22 1gxd h ALA 21 Cb 0.30 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 1gxd h ALA 21 CO -0.00 -0.71 0.64 0.28 0.00 0.00 0.00 179.25 179.46 1gxd h VAL 22 N -0.43 0.57 0.03 0.00 2.07 -0.53 0.75 116.25 118.70 1gxd h VAL 22 Ca -0.04 -0.03 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 1gxd h VAL 22 Cb 0.33 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1gxd h VAL 22 CO 0.07 0.02 -0.30 -0.61 0.02 0.00 0.00 177.57 176.77 1gxd h GLN 23 N 0.10 0.06 0.00 1.57 4.15 -1.06 -2.71 115.11 117.22 1gxd h GLN 23 Ca 0.45 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.77 1gxd h GLN 23 Cb 1.61 0.04 0.00 0.00 0.21 0.00 0.00 27.48 29.34 1gxd h GLN 23 CO -0.05 1.05 0.00 0.98 -1.93 0.00 0.00 178.83 178.87 1gxd n TYR 24 N -4.49 0.00 -0.11 3.99 4.19 0.62 -1.46 117.16 119.89 1gxd n TYR 24 Ca -0.13 0.00 -0.20 0.00 3.31 0.00 0.00 57.90 60.87 1gxd n TYR 24 Cb 0.57 -0.30 -0.12 0.00 0.49 0.00 0.00 39.34 39.98 1gxd n TYR 24 CO 0.00 0.00 0.00 1.28 0.91 0.00 0.00 176.86 179.05 1gxd n LEU 25 N -1.30 2.75 0.00 2.98 4.77 0.23 -4.19 117.00 122.23 1gxd n LEU 25 Ca 0.06 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1gxd n LEU 25 Cb 0.11 -0.92 0.00 0.00 -2.33 0.00 0.00 43.42 40.28 1gxd n LEU 25 CO 0.10 0.86 0.22 -3.20 -1.33 0.00 0.00 177.39 174.04 1gxd n ASN 26 N -3.47 0.00 -0.27 -1.43 5.15 -0.54 0.18 115.26 114.89 1gxd n ASN 26 Ca -0.45 0.44 -0.05 0.00 -0.60 0.00 0.00 54.58 53.92 1gxd n ASN 26 Cb 0.97 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 40.19 1gxd n ASN 26 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 1gxd n THR 27 N -0.60 -0.41 0.11 -0.44 -1.04 -1.02 -1.90 114.28 108.98 1gxd n THR 27 Ca 0.00 1.56 0.06 0.00 -2.04 0.00 0.00 64.05 63.64 1gxd n THR 27 Cb 0.00 -1.97 0.01 0.00 -1.82 0.00 0.00 70.33 66.55 1gxd n THR 27 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 1gxd h PHE 28 N 0.00 0.00 -2.99 -1.42 0.04 -1.72 -3.41 116.94 107.44 1gxd h PHE 28 Ca 0.15 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.56 1gxd h PHE 28 Cb 0.31 0.00 -0.38 0.00 2.20 0.00 0.00 35.95 38.08 1gxd h PHE 28 CO -0.64 0.27 -0.68 0.71 -0.60 0.00 0.00 178.31 177.37 1gxd s TYR 29 N -3.13 -0.07 0.10 -0.55 1.51 0.49 -1.66 117.35 114.04 1gxd s TYR 29 Ca 0.01 0.24 -0.36 0.00 -1.01 0.00 0.00 57.07 55.95 1gxd s TYR 29 Cb 0.08 -0.43 -0.17 0.00 -0.11 0.00 0.00 41.96 41.33 1gxd s TYR 29 CO 0.76 -0.39 1.21 0.41 -1.11 0.00 0.00 175.55 176.43 1gxd n GLY 30 N 5.31 0.14 2.66 0.71 0.00 -1.12 -2.63 105.19 110.26 1gxd n GLY 30 Ca -0.05 0.65 -0.03 0.00 0.00 0.00 0.00 46.02 46.59 1gxd n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gxd n PRO 32 N 0.57 0.00 0.14 0.00 -0.02 -1.26 -4.21 135.00 130.21 1gxd n PRO 32 Ca -0.05 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.49 1gxd n PRO 32 Cb 0.76 0.00 0.35 0.00 -0.02 0.00 0.00 33.50 34.59 1gxd n PRO 32 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1gxd n LYS 33 N 0.00 0.09 -0.70 -0.52 3.00 -1.26 -0.09 118.16 118.68 1gxd n LYS 33 Ca 0.00 0.55 -0.10 0.00 -0.00 0.00 0.00 58.31 58.76 1gxd n LYS 33 Cb 0.00 -1.98 0.15 0.00 0.00 0.00 0.00 35.03 33.19 1gxd n LYS 33 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1gxd n GLU 34 N -1.98 2.18 0.00 1.64 4.07 -1.26 -4.89 120.64 120.40 1gxd n GLU 34 Ca -0.01 -1.86 0.00 0.00 -0.06 0.00 0.00 57.16 55.23 1gxd n GLU 34 Cb 0.22 -1.78 0.00 0.00 -0.06 0.00 0.00 31.44 29.82 1gxd n GLU 34 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1gxd n SER 35 N -0.27 0.00 -3.55 4.31 2.88 0.88 -4.51 113.62 113.36 1gxd n SER 35 Ca 0.31 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.77 1gxd n SER 35 Cb 1.12 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.55 1gxd n SER 35 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gxd h ASN 37 N 2.23 0.20 -0.86 0.00 2.35 -1.86 -3.37 115.58 114.27 1gxd h ASN 37 Ca -0.19 -0.15 0.08 0.00 -0.55 0.00 0.00 56.30 55.50 1gxd h ASN 37 Cb 1.20 -0.06 -0.11 0.00 0.05 0.00 0.00 38.32 39.40 1gxd h ASN 37 CO 0.30 0.89 -0.49 -0.11 -1.65 0.00 0.00 177.43 176.36 1gxd n LEU 38 N -3.72 -0.88 -4.69 1.61 7.94 -1.26 -3.24 117.00 112.74 1gxd n LEU 38 Ca -0.03 1.53 -0.42 0.00 -1.11 0.00 0.00 56.01 55.98 1gxd n LEU 38 Cb 0.73 -0.21 -0.03 0.00 0.53 0.00 0.00 43.42 44.44 1gxd n LEU 38 CO 0.46 -1.26 0.91 0.72 -1.11 0.00 0.00 177.39 177.10 1gxd s PHE 39 N -5.46 3.30 0.00 1.96 -0.12 -1.26 -0.88 117.98 115.51 1gxd s PHE 39 Ca -0.10 1.29 0.00 0.00 -0.05 0.00 0.00 56.93 58.07 1gxd s PHE 39 Cb 0.10 -3.38 0.00 0.00 -0.63 0.00 0.00 43.02 39.11 1gxd s PHE 39 CO 0.54 -1.14 0.00 1.55 -0.05 0.00 0.00 175.22 176.12 1gxd n VAL 40 N 4.40 0.00 -0.06 -2.49 3.14 -1.26 -4.73 118.33 117.34 1gxd n VAL 40 Ca 0.10 0.00 -0.07 0.00 -2.96 0.00 0.00 64.34 61.41 1gxd n VAL 40 Cb 0.47 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 33.18 1gxd n VAL 40 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1gxd n LEU 41 N 0.00 1.62 -0.20 6.55 4.77 -1.12 -4.99 117.00 123.61 1gxd n LEU 41 Ca 0.00 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1gxd n LEU 41 Cb 0.00 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1gxd n LEU 41 CO 0.00 0.50 0.00 0.29 -1.33 0.00 0.00 177.39 176.85 1gxd n LYS 42 N -2.64 0.00 0.00 3.23 5.02 -0.06 -5.02 118.16 118.69 1gxd n LYS 42 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 1gxd n LYS 42 Cb 0.78 -2.20 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 1gxd n LYS 42 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1gxd n ASP 43 N 1.28 0.00 -4.47 4.39 8.00 -1.07 -4.96 116.55 119.73 1gxd n ASP 43 Ca 0.00 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.24 1gxd n ASP 43 Cb 0.37 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 41.61 1gxd n ASP 43 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1gxd s THR 44 N 0.02 2.06 -1.15 -3.53 2.01 -1.26 -3.91 115.64 109.87 1gxd s THR 44 Ca 0.00 -0.40 -0.01 0.00 0.31 0.00 0.00 61.69 61.59 1gxd s THR 44 Cb 0.00 -2.66 0.00 0.00 0.01 0.00 0.00 72.50 69.85 1gxd s THR 44 CO 0.00 0.00 0.17 -0.11 -0.69 0.00 0.00 174.62 173.99 1gxd n LEU 45 N -3.17 -1.93 0.00 4.42 7.94 -1.26 -4.49 117.00 118.51 1gxd n LEU 45 Ca 0.16 -0.09 0.00 0.00 -1.11 0.00 0.00 56.01 54.97 1gxd n LEU 45 Cb 0.60 -2.18 0.00 0.00 0.53 0.00 0.00 43.42 42.38 1gxd n LEU 45 CO 0.43 -0.02 0.00 0.29 -1.11 0.00 0.00 177.39 176.98 1gxd n LYS 46 N -2.62 0.00 -0.08 1.96 5.02 -1.26 -3.67 118.16 117.51 1gxd n LYS 46 Ca -0.13 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.05 1gxd n LYS 46 Cb 0.61 -0.06 -0.04 0.00 -0.02 0.00 0.00 35.03 35.52 1gxd n LYS 46 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1gxd h LYS 47 N 0.00 0.40 0.20 1.97 1.57 -1.79 0.35 116.57 119.28 1gxd h LYS 47 Ca 0.00 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1gxd h LYS 47 Cb 0.00 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 1gxd h LYS 47 CO 0.00 0.49 -0.17 1.98 -0.57 0.00 0.00 179.45 181.19 1gxd h MET 48 N 0.24 -0.37 -0.19 3.15 4.05 -1.89 -0.77 114.93 119.15 1gxd h MET 48 Ca 0.08 0.03 0.05 0.00 -0.28 0.00 0.00 59.70 59.57 1gxd h MET 48 Cb 0.27 0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 31.10 1gxd h MET 48 CO -0.00 -0.25 -0.13 1.96 0.23 0.00 0.00 176.91 178.73 1gxd h GLN 49 N -0.38 -0.12 -0.65 0.39 4.20 -1.77 -0.86 115.11 115.92 1gxd h GLN 49 Ca -0.01 0.01 0.13 0.00 0.06 0.00 0.00 58.65 58.84 1gxd h GLN 49 Cb 0.34 0.03 -0.09 0.00 0.30 0.00 0.00 27.48 28.06 1gxd h GLN 49 CO -0.02 -0.08 0.15 -0.22 -0.67 0.00 0.00 178.83 177.99 1gxd h LYS 50 N -0.12 0.26 -0.45 1.46 3.64 -0.02 0.42 116.57 121.76 1gxd h LYS 50 Ca 0.11 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.56 1gxd h LYS 50 Cb 0.29 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.97 1gxd h LYS 50 CO -0.26 0.17 -0.01 0.35 -2.27 0.00 0.00 179.45 177.44 1gxd h PHE 51 N 0.27 -0.04 0.00 1.91 3.04 0.30 0.03 116.94 122.45 1gxd h PHE 51 Ca 0.35 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.33 1gxd h PHE 51 Cb 0.54 0.09 0.00 0.00 2.56 0.00 0.00 35.95 39.14 1gxd h PHE 51 CO -0.25 -0.10 -0.36 0.74 -2.02 0.00 0.00 178.31 176.31 1gxd h PHE 52 N 0.11 0.00 -2.74 0.41 0.04 -0.87 -3.45 116.94 110.43 1gxd h PHE 52 Ca 0.23 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.00 1gxd h PHE 52 Cb 0.33 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.48 1gxd h PHE 52 CO -0.30 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 177.82 1gxd n GLY 53 N 1.25 -2.61 3.75 -1.45 0.00 0.14 -5.01 105.19 101.25 1gxd n GLY 53 Ca 0.04 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 1gxd n GLY 53 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gxd s LEU 54 N 0.00 0.22 -0.01 0.99 1.43 -1.16 -4.94 118.68 115.21 1gxd s LEU 54 Ca 0.00 -1.26 -0.30 0.00 -1.03 0.00 0.00 54.13 51.54 1gxd s LEU 54 Cb 0.00 2.62 -0.07 0.00 0.03 0.00 0.00 46.19 48.77 1gxd s LEU 54 CO 0.00 -1.66 1.86 -2.84 0.23 0.00 0.00 176.35 173.94 1gxd s PRO 55 N -2.29 4.11 -1.50 1.29 0.02 -1.26 -4.70 135.00 130.67 1gxd s PRO 55 Ca 0.18 2.42 -0.09 0.00 0.02 0.00 0.00 61.00 63.53 1gxd s PRO 55 Cb -0.04 -4.11 -0.00 0.00 0.02 0.00 0.00 34.50 30.37 1gxd s PRO 55 CO 0.14 -0.97 2.66 1.04 -0.33 0.00 0.00 177.00 179.54 1gxd n GLN 56 N 7.45 3.87 0.12 5.54 6.02 -1.26 -4.62 117.38 134.50 1gxd n GLN 56 Ca 0.19 -2.68 -0.02 0.00 -0.01 0.00 0.00 57.00 54.48 1gxd n GLN 56 Cb 0.42 -2.81 0.14 0.00 1.02 0.00 0.00 30.24 29.01 1gxd n GLN 56 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 1gxd h THR 57 N 3.03 1.45 0.00 5.09 1.35 -1.89 -3.47 112.91 118.47 1gxd h THR 57 Ca 0.77 -2.16 0.00 0.00 -0.55 0.00 0.00 66.41 64.47 1gxd h THR 57 Cb 0.34 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 1gxd h THR 57 CO 1.70 0.62 0.00 0.61 -0.25 0.00 0.00 175.52 178.20 1gxd n GLY 58 N 0.31 0.82 2.12 5.82 0.00 -1.24 -4.71 105.19 108.30 1gxd n GLY 58 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 1gxd n GLY 58 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gxd n ASP 59 N 0.00 -1.00 -1.64 1.61 5.68 -1.26 -4.94 116.55 115.00 1gxd n ASP 59 Ca 0.00 -1.80 -0.13 0.00 -0.50 0.00 0.00 54.79 52.36 1gxd n ASP 59 Cb 0.00 0.45 0.09 0.00 -1.14 0.00 0.00 41.12 40.53 1gxd n ASP 59 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 1gxd n LEU 60 N -0.95 4.96 -0.38 -2.12 -0.00 -1.26 -4.72 117.00 112.53 1gxd n LEU 60 Ca -0.14 -2.60 -0.05 0.00 -0.00 0.00 0.00 56.01 53.22 1gxd n LEU 60 Cb 0.74 -0.68 -0.02 0.00 -0.00 0.00 0.00 43.42 43.47 1gxd n LEU 60 CO -0.11 0.79 0.51 0.47 -0.00 0.00 0.00 177.39 179.04 1gxd n ASP 61 N -0.36 -0.78 -0.18 1.96 9.92 -1.26 -1.06 116.55 124.80 1gxd n ASP 61 Ca 0.31 1.66 -0.05 0.00 -0.53 0.00 0.00 54.79 56.18 1gxd n ASP 61 Cb 1.12 -0.31 -0.04 0.00 -0.64 0.00 0.00 41.12 41.25 1gxd n ASP 61 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1gxd n GLN 62 N -5.30 -0.19 0.03 -1.24 10.64 -1.26 0.45 117.38 120.51 1gxd n GLN 62 Ca 0.06 0.75 -0.08 0.00 -1.83 0.00 0.00 57.00 55.90 1gxd n GLN 62 Cb 0.32 -1.10 -0.13 0.00 -0.86 0.00 0.00 30.24 28.47 1gxd n GLN 62 CO 0.00 0.00 0.00 -0.97 -1.83 0.00 0.00 177.06 174.26 1gxd h ASN 63 N 0.00 0.02 -0.02 2.61 -0.00 -1.77 -3.32 115.58 113.11 1gxd h ASN 63 Ca 0.07 -0.02 -0.15 0.00 -0.00 0.00 0.00 56.30 56.19 1gxd h ASN 63 Cb 0.17 -0.01 0.01 0.00 -0.00 0.00 0.00 38.32 38.50 1gxd h ASN 63 CO -0.40 1.02 -0.59 0.00 -0.00 0.00 0.00 177.43 177.46 1gxd h THR 64 N 0.00 1.41 -0.42 -3.57 1.03 0.14 -3.25 112.91 108.26 1gxd h THR 64 Ca -0.13 -2.04 0.07 0.00 -0.01 0.00 0.00 66.41 64.30 1gxd h THR 64 Cb 1.88 2.52 -0.02 0.00 -1.07 0.00 0.00 68.15 71.46 1gxd h THR 64 CO 0.11 0.60 0.29 -0.29 -0.01 0.00 0.00 175.52 176.22 1gxd h ILE 65 N -0.06 0.91 0.59 0.00 2.10 0.96 0.44 117.51 122.47 1gxd h ILE 65 Ca -0.07 -0.09 -0.03 0.00 1.08 0.00 0.00 64.86 65.76 1gxd h ILE 65 Cb 1.29 0.64 0.01 0.00 -1.09 0.00 0.00 36.82 37.67 1gxd h ILE 65 CO 0.12 0.05 -0.29 -0.08 -1.08 0.00 0.00 178.15 176.87 1gxd h GLU 66 N 0.25 -0.77 -0.99 2.19 4.81 -1.65 -2.06 114.58 116.36 1gxd h GLU 66 Ca 0.19 0.05 0.17 0.00 -0.13 0.00 0.00 59.36 59.65 1gxd h GLU 66 Cb 0.44 0.17 -0.09 0.00 0.63 0.00 0.00 28.75 29.90 1gxd h GLU 66 CO -0.04 -0.49 0.61 1.15 -0.73 0.00 0.00 179.01 179.51 1gxd h THR 67 N -0.84 0.76 0.00 0.32 2.02 -1.07 0.35 112.91 114.44 1gxd h THR 67 Ca -0.08 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.84 1gxd h THR 67 Cb 0.63 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1gxd h THR 67 CO 0.13 0.14 0.00 0.24 0.37 0.00 0.00 175.52 176.40 1gxd h MET 68 N 0.76 0.00 0.00 6.66 2.86 -0.30 -2.49 114.93 122.42 1gxd h MET 68 Ca 0.54 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.97 1gxd h MET 68 Cb 0.84 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.46 1gxd h MET 68 CO -0.32 0.00 -1.67 0.54 1.06 0.00 0.00 176.91 176.52 1gxd n ARG 69 N -2.85 0.64 -1.64 1.72 1.74 0.12 -4.93 116.66 111.46 1gxd n ARG 69 Ca -0.02 0.17 -0.47 0.00 -0.77 0.00 0.00 57.85 56.76 1gxd n ARG 69 Cb 0.09 -1.74 -0.04 0.00 -1.02 0.00 0.00 32.46 29.75 1gxd n ARG 69 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1gxd n LYS 70 N -2.85 1.75 -1.62 5.56 4.76 -0.94 -4.73 118.16 120.08 1gxd n LYS 70 Ca -0.14 0.63 -0.52 0.00 -2.87 0.00 0.00 58.31 55.41 1gxd n LYS 70 Cb 0.91 -2.28 -0.06 0.00 -1.84 0.00 0.00 35.03 31.77 1gxd n LYS 70 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 1gxd n PRO 71 N 2.45 1.36 -4.24 1.97 -0.04 -1.26 -4.85 135.00 130.39 1gxd n PRO 71 Ca 0.15 0.49 -0.15 0.00 -0.04 0.00 0.00 63.50 63.95 1gxd n PRO 71 Cb 0.27 -2.17 -0.09 0.00 -0.04 0.00 0.00 33.50 31.47 1gxd n PRO 71 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1gxd s ARG 72 N 1.14 1.44 0.65 0.54 1.70 -0.33 -2.30 118.95 121.79 1gxd s ARG 72 Ca 0.86 -1.80 -0.15 0.00 -0.47 0.00 0.00 55.73 54.16 1gxd s ARG 72 Cb -0.91 0.27 -0.00 0.00 -0.57 0.00 0.00 34.95 33.74 1gxd s ARG 72 CO 0.48 -0.50 1.12 0.00 -1.08 0.00 0.00 175.30 175.32 1gxd n GLY 74 N -0.39 -0.52 3.86 0.00 0.00 0.16 -4.79 105.19 103.51 1gxd n GLY 74 Ca 0.11 -0.34 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 1gxd n GLY 74 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gxd s ASN 75 N -2.14 6.35 0.92 1.61 -0.87 -1.26 -4.95 114.94 114.60 1gxd s ASN 75 Ca 0.38 1.45 -0.12 0.00 -1.57 0.00 0.00 52.86 52.99 1gxd s ASN 75 Cb 0.21 -2.47 0.14 0.00 -0.02 0.00 0.00 41.25 39.11 1gxd s ASN 75 CO 0.39 -0.77 1.12 -2.84 -2.57 0.00 0.00 177.10 172.43 1gxd s PRO 76 N -4.81 1.04 -0.14 -0.60 0.02 -1.26 -4.83 135.00 124.42 1gxd s PRO 76 Ca 0.56 0.39 0.13 0.00 0.02 0.00 0.00 61.00 62.11 1gxd s PRO 76 Cb -0.11 -1.82 -0.19 0.00 0.02 0.00 0.00 34.50 32.41 1gxd s PRO 76 CO 0.47 -2.29 0.08 -0.25 -0.33 0.00 0.00 177.00 174.68 1gxd n ASP 77 N -3.85 1.35 -4.67 2.53 8.00 -0.66 -4.68 116.55 114.57 1gxd n ASP 77 Ca 0.06 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.14 1gxd n ASP 77 Cb 0.58 0.94 -0.03 0.00 -0.02 0.00 0.00 41.12 42.59 1gxd n ASP 77 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1gxd s VAL 78 N -2.42 3.68 0.41 2.53 1.01 -0.89 -4.88 120.40 119.83 1gxd s VAL 78 Ca -0.07 0.94 -0.25 0.00 0.00 0.00 0.00 61.98 62.60 1gxd s VAL 78 Cb 0.05 -3.61 -0.11 0.00 0.00 0.00 0.00 36.38 32.72 1gxd s VAL 78 CO 0.61 -0.05 1.10 0.00 0.00 0.00 0.00 175.10 176.77 1gxd n ALA 79 N 6.31 0.54 -3.04 5.51 0.00 -1.26 -4.22 120.51 124.35 1gxd n ALA 79 Ca 0.15 0.26 -0.04 0.00 0.00 0.00 0.00 53.44 53.81 1gxd n ALA 79 Cb 0.43 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1gxd n ALA 79 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1gxd n ASN 80 N 0.48 -7.07 -2.72 0.00 4.05 -1.26 -5.01 115.26 103.74 1gxd n ASN 80 Ca 0.08 0.72 -0.05 0.00 0.45 0.00 0.00 54.58 55.78 1gxd n ASN 80 Cb 0.38 -3.13 0.04 0.00 1.23 0.00 0.00 39.78 38.31 1gxd n ASN 80 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1gxd n TYR 81 N 0.85 -2.37 -4.29 1.20 9.36 -1.26 -5.16 117.16 115.49 1gxd n TYR 81 Ca -0.00 -1.21 -0.15 0.00 3.32 0.00 0.00 57.90 59.86 1gxd n TYR 81 Cb 0.34 1.35 -0.10 0.00 -0.63 0.00 0.00 39.34 40.30 1gxd n TYR 81 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1gxd s ASN 82 N -0.19 0.94 -0.17 2.98 3.84 -1.26 -4.92 114.94 116.16 1gxd s ASN 82 Ca 0.29 -1.39 0.11 0.00 0.21 0.00 0.00 52.86 52.07 1gxd s ASN 82 Cb 0.14 0.22 -0.23 0.00 -0.55 0.00 0.00 41.25 40.83 1gxd s ASN 82 CO -0.13 -0.76 0.16 0.33 -2.79 0.00 0.00 177.10 173.91 1gxd n PHE 83 N -0.42 0.34 -3.07 0.43 -0.00 -1.26 -4.95 117.46 108.53 1gxd n PHE 83 Ca 0.01 0.10 -0.33 0.00 -0.00 0.00 0.00 57.45 57.23 1gxd n PHE 83 Cb 0.66 -1.06 -0.06 0.00 -0.00 0.00 0.00 39.48 39.02 1gxd n PHE 83 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.76 176.70 1gxd s PHE 84 N -2.53 3.38 0.77 -5.13 0.08 -1.26 -5.04 117.98 108.25 1gxd s PHE 84 Ca -0.16 1.31 -0.13 0.00 0.12 0.00 0.00 56.93 58.07 1gxd s PHE 84 Cb 0.07 -2.61 0.06 0.00 -0.57 0.00 0.00 43.02 39.98 1gxd s PHE 84 CO 0.77 0.07 1.15 -2.14 -0.10 0.00 0.00 175.22 174.96 1gxd s PRO 85 N -2.96 2.02 0.20 0.24 0.02 -1.26 -5.04 135.00 128.22 1gxd s PRO 85 Ca 0.55 1.50 -0.22 0.00 0.02 0.00 0.00 61.00 62.85 1gxd s PRO 85 Cb -0.10 -1.84 0.05 0.00 0.02 0.00 0.00 34.50 32.62 1gxd s PRO 85 CO 0.17 -1.87 0.65 -0.98 -0.33 0.00 0.00 177.00 174.63 1gxd s ARG 86 N -4.35 1.47 0.32 5.54 1.70 -1.26 -4.62 118.95 117.75 1gxd s ARG 86 Ca 0.68 -0.67 0.06 0.00 -0.47 0.00 0.00 55.73 55.33 1gxd s ARG 86 Cb -0.23 0.59 -0.06 0.00 -0.57 0.00 0.00 34.95 34.68 1gxd s ARG 86 CO 0.50 -0.66 -0.01 0.15 -1.08 0.00 0.00 175.30 174.20 1gxd s LYS 87 N -3.81 1.68 0.38 3.89 3.01 0.55 -4.96 119.74 120.49 1gxd s LYS 87 Ca 0.05 -1.90 0.08 0.00 -1.01 0.00 0.00 55.97 53.19 1gxd s LYS 87 Cb -0.03 -1.20 0.78 0.00 -1.01 0.00 0.00 37.83 36.37 1gxd s LYS 87 CO -0.05 -0.04 1.95 -1.35 0.51 0.00 0.00 175.35 176.36 1gxd h PRO 88 N 2.11 0.37 -1.98 -1.68 0.11 -1.97 -3.40 132.00 125.56 1gxd h PRO 88 Ca -0.41 -0.06 0.21 0.00 0.11 0.00 0.00 66.00 65.84 1gxd h PRO 88 Cb 1.24 -0.06 -0.12 0.00 0.11 0.00 0.00 31.00 32.17 1gxd h PRO 88 CO 0.71 0.40 0.62 -1.59 -0.21 0.00 0.00 178.00 177.93 1gxd s LYS 89 N -4.98 0.79 0.11 1.05 -2.85 -1.26 -4.62 119.74 107.97 1gxd s LYS 89 Ca -0.07 -0.39 -0.31 0.00 -1.00 0.00 0.00 55.97 54.20 1gxd s LYS 89 Cb 0.16 0.30 -0.09 0.00 -2.06 0.00 0.00 37.83 36.14 1gxd s LYS 89 CO 0.74 -0.35 1.53 -1.58 0.10 0.00 0.00 175.35 175.79 1gxd s TRP 90 N -2.91 2.91 -1.71 1.78 0.52 -1.26 -4.88 118.94 113.39 1gxd s TRP 90 Ca 0.11 0.63 0.10 0.00 0.02 0.00 0.00 56.10 56.96 1gxd s TRP 90 Cb 0.00 -3.86 0.56 0.00 -1.15 0.00 0.00 33.47 29.03 1gxd s TRP 90 CO -0.03 -3.21 1.13 -0.25 0.02 0.00 0.00 176.95 174.61 1gxd n ASP 91 N 4.55 0.00 -4.35 2.95 8.00 -1.26 -4.69 116.55 121.75 1gxd n ASP 91 Ca 0.14 -0.08 -0.24 0.00 0.71 0.00 0.00 54.79 55.32 1gxd n ASP 91 Cb 0.40 -0.15 -0.10 0.00 -0.02 0.00 0.00 41.12 41.26 1gxd n ASP 91 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 1gxd s LYS 92 N -2.29 1.78 0.00 -1.24 -2.85 -1.26 -5.04 119.74 108.83 1gxd s LYS 92 Ca 0.12 -2.03 0.05 0.00 -1.00 0.00 0.00 55.97 53.11 1gxd s LYS 92 Cb 0.07 -0.81 -0.05 0.00 -2.06 0.00 0.00 37.83 34.98 1gxd s LYS 92 CO 0.14 -0.30 0.24 0.09 0.10 0.00 0.00 175.35 175.61 1gxd n ASN 93 N -0.94 0.29 -4.16 0.03 3.02 -1.26 -4.85 115.26 107.39 1gxd n ASN 93 Ca -0.05 -0.64 -0.39 0.00 -0.03 0.00 0.00 54.58 53.47 1gxd n ASN 93 Cb 0.66 0.97 -0.08 0.00 -0.61 0.00 0.00 39.78 40.72 1gxd n ASN 93 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1gxd s GLN 94 N -1.46 2.75 0.25 3.52 -0.21 -1.26 -0.57 119.66 122.67 1gxd s GLN 94 Ca 0.02 -2.37 -0.04 0.00 0.02 0.00 0.00 55.36 52.99 1gxd s GLN 94 Cb 0.04 -3.91 -0.05 0.00 1.00 0.00 0.00 33.01 30.09 1gxd s GLN 94 CO 0.21 -1.20 0.50 0.42 -2.12 0.00 0.00 175.29 173.10 1gxd s ILE 95 N 0.26 5.07 -0.03 1.08 -1.09 -0.59 -4.99 121.20 120.91 1gxd s ILE 95 Ca 0.15 -0.02 0.02 0.00 -2.23 0.00 0.00 60.65 58.58 1gxd s ILE 95 Cb -0.19 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 36.98 1gxd s ILE 95 CO -0.04 -0.23 -0.10 0.42 -1.23 0.00 0.00 174.94 173.76 1gxd s THR 96 N -1.97 0.84 0.30 2.92 -4.23 -1.26 -2.26 115.64 109.98 1gxd s THR 96 Ca 0.43 -0.38 0.04 0.00 -1.18 0.00 0.00 61.69 60.59 1gxd s THR 96 Cb -0.11 -0.75 -0.06 0.00 1.34 0.00 0.00 72.50 72.92 1gxd s THR 96 CO 0.28 0.26 0.04 -0.72 -0.54 0.00 0.00 174.62 173.95 1gxd s TYR 97 N 0.26 1.87 -0.13 3.99 1.13 -0.86 0.48 117.35 124.09 1gxd s TYR 97 Ca -0.05 -0.95 -0.20 0.00 -1.41 0.00 0.00 57.07 54.46 1gxd s TYR 97 Cb -0.10 -1.18 0.05 0.00 -1.10 0.00 0.00 41.96 39.63 1gxd s TYR 97 CO 0.01 -0.01 0.52 0.50 -2.51 0.00 0.00 175.55 174.06 1gxd s ARG 98 N -3.89 0.73 -0.48 -3.49 3.52 -0.05 -2.26 118.95 113.03 1gxd s ARG 98 Ca 0.35 0.46 -0.17 0.00 -0.13 0.00 0.00 55.73 56.24 1gxd s ARG 98 Cb 0.08 0.34 0.07 0.00 -1.56 0.00 0.00 34.95 33.88 1gxd s ARG 98 CO 0.14 -0.15 0.46 0.42 -0.81 0.00 0.00 175.30 175.36 1gxd s ILE 99 N -0.34 5.12 -0.33 4.11 1.01 -1.26 0.66 121.20 130.17 1gxd s ILE 99 Ca -0.05 -0.86 0.23 0.00 0.00 0.00 0.00 60.65 59.97 1gxd s ILE 99 Cb -0.03 -4.17 -0.11 0.00 0.01 0.00 0.00 42.46 38.16 1gxd s ILE 99 CO 0.03 -0.63 0.92 -0.38 0.00 0.00 0.00 174.94 174.88 1gxd n ILE 100 N 5.33 0.32 -3.93 2.92 5.41 0.19 -4.73 119.36 124.88 1gxd n ILE 100 Ca -0.10 -0.43 -0.08 0.00 1.00 0.00 0.00 62.75 63.13 1gxd n ILE 100 Cb 0.44 -0.07 -0.08 0.00 -0.71 0.00 0.00 39.64 39.22 1gxd n ILE 100 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1gxd s GLY 101 N -4.14 0.20 0.06 7.39 0.00 -1.21 -4.27 107.32 105.35 1gxd s GLY 101 Ca -0.01 -0.75 -0.00 0.00 0.00 0.00 0.00 44.72 43.96 1gxd s GLY 101 CO 0.82 -0.91 -0.04 -0.19 0.00 0.00 0.00 173.10 172.78 1gxd s TYR 102 N -3.66 0.61 -0.13 1.90 2.02 -1.26 -4.54 117.35 112.29 1gxd s TYR 102 Ca 0.04 -1.03 -0.08 0.00 -0.37 0.00 0.00 57.07 55.62 1gxd s TYR 102 Cb 0.05 -0.42 -0.04 0.00 -0.40 0.00 0.00 41.96 41.14 1gxd s TYR 102 CO -0.10 -0.33 0.16 -0.08 -1.57 0.00 0.00 175.55 173.64 1gxd s THR 103 N -3.85 5.45 -1.65 -0.71 -1.32 -1.26 -4.90 115.64 107.39 1gxd s THR 103 Ca 0.08 0.27 0.01 0.00 -1.21 0.00 0.00 61.69 60.84 1gxd s THR 103 Cb 0.07 -3.45 0.02 0.00 -1.51 0.00 0.00 72.50 67.64 1gxd s THR 103 CO -0.09 0.57 0.72 -2.65 -2.21 0.00 0.00 174.62 170.97 1gxd n PRO 104 N 2.36 0.02 -0.05 7.08 -0.02 -1.26 -2.51 135.00 140.62 1gxd n PRO 104 Ca -0.18 0.17 0.12 0.00 -2.02 0.00 0.00 63.50 61.58 1gxd n PRO 104 Cb 0.54 -1.50 0.41 0.00 -0.02 0.00 0.00 33.50 32.93 1gxd n PRO 104 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1gxd n ASP 105 N -1.17 1.74 -3.66 2.55 8.00 -1.26 -0.81 116.55 121.94 1gxd n ASP 105 Ca 0.01 -1.66 -0.07 0.00 0.71 0.00 0.00 54.79 53.77 1gxd n ASP 105 Cb 0.01 -0.07 -0.08 0.00 -0.02 0.00 0.00 41.12 40.96 1gxd n ASP 105 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1gxd s LEU 106 N -1.73 -0.71 0.87 0.64 1.43 -1.04 -4.51 118.68 113.63 1gxd s LEU 106 Ca 0.34 1.31 -0.12 0.00 -1.03 0.00 0.00 54.13 54.63 1gxd s LEU 106 Cb 0.19 2.00 0.10 0.00 0.03 0.00 0.00 46.19 48.51 1gxd s LEU 106 CO 0.29 -0.22 1.05 -0.90 0.23 0.00 0.00 176.35 176.80 1gxd n ASP 107 N 4.54 0.24 -0.31 2.29 5.75 -1.26 -4.64 116.55 123.17 1gxd n ASP 107 Ca -0.19 0.48 0.00 0.00 -0.01 0.00 0.00 54.79 55.07 1gxd n ASP 107 Cb 0.56 -1.45 0.13 0.00 -1.03 0.00 0.00 41.12 39.34 1gxd n ASP 107 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 1gxd h PRO 108 N -1.41 0.95 -0.88 0.11 0.11 -1.92 -1.39 132.00 127.56 1gxd h PRO 108 Ca -0.44 -0.06 0.08 0.00 0.11 0.00 0.00 66.00 65.69 1gxd h PRO 108 Cb 1.29 -0.21 -0.07 0.00 0.11 0.00 0.00 31.00 32.11 1gxd h PRO 108 CO 0.42 0.63 0.53 0.93 -0.21 0.00 0.00 178.00 180.30 1gxd h GLU 109 N 0.98 0.90 0.53 1.05 5.08 -1.97 -1.61 114.58 119.54 1gxd h GLU 109 Ca 0.37 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.65 1gxd h GLU 109 Cb 0.15 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.20 1gxd h GLU 109 CO -0.16 0.60 -0.26 1.15 -1.00 0.00 0.00 179.01 179.34 1gxd h THR 110 N 0.93 0.00 -0.81 1.13 2.02 -1.62 -2.33 112.91 112.23 1gxd h THR 110 Ca 0.40 -0.41 0.08 0.00 0.77 0.00 0.00 66.41 67.25 1gxd h THR 110 Cb 0.28 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.58 1gxd h THR 110 CO -0.21 0.00 -0.57 0.58 0.37 0.00 0.00 175.52 175.69 1gxd h VAL 111 N -1.13 0.00 -0.25 3.16 2.07 -1.32 0.50 116.25 119.29 1gxd h VAL 111 Ca -0.07 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.48 1gxd h VAL 111 Cb 0.55 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.27 1gxd h VAL 111 CO 0.12 0.00 -0.33 0.44 0.02 0.00 0.00 177.57 177.82 1gxd h ASP 112 N -0.13 -1.11 -0.69 0.57 5.19 -1.36 0.27 116.42 119.17 1gxd h ASP 112 Ca 0.14 0.15 0.14 0.00 -0.62 0.00 0.00 57.03 56.84 1gxd h ASP 112 Cb 0.48 0.46 -0.10 0.00 0.18 0.00 0.00 39.33 40.34 1gxd h ASP 112 CO -0.83 -0.24 0.13 -0.78 -3.12 0.00 0.00 179.24 174.40 1gxd h ASP 113 N -0.23 -0.06 -0.94 6.45 1.82 -0.69 0.18 116.42 122.95 1gxd h ASP 113 Ca 0.04 0.14 0.10 0.00 -0.39 0.00 0.00 57.03 56.93 1gxd h ASP 113 Cb 0.35 0.21 -0.08 0.00 0.68 0.00 0.00 39.33 40.49 1gxd h ASP 113 CO -0.36 -0.05 0.58 0.00 -1.61 0.00 0.00 179.24 177.81 1gxd h ALA 114 N 1.58 1.38 0.02 -0.78 0.00 0.18 0.29 119.26 121.93 1gxd h ALA 114 Ca 0.38 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.30 1gxd h ALA 114 Cb 0.62 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1gxd h ALA 114 CO -0.50 0.22 -0.01 0.74 0.00 0.00 0.00 179.25 179.70 1gxd h PHE 115 N 0.95 -0.02 -0.56 0.00 0.04 0.11 -2.39 116.94 115.07 1gxd h PHE 115 Ca 0.45 -0.00 0.10 0.00 2.80 0.00 0.00 57.97 61.32 1gxd h PHE 115 Cb 0.40 0.01 -0.11 0.00 2.20 0.00 0.00 35.95 38.44 1gxd h PHE 115 CO -0.02 0.34 -0.35 0.00 -0.60 0.00 0.00 178.31 177.68 1gxd h ALA 116 N 0.58 -0.10 -0.09 2.45 0.00 0.51 0.24 119.26 122.85 1gxd h ALA 116 Ca -0.00 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.08 1gxd h ALA 116 Cb 0.38 0.80 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1gxd h ALA 116 CO 0.00 -0.70 0.07 0.00 0.00 0.00 0.00 179.25 178.62 1gxd h ARG 117 N -0.18 0.00 -0.41 0.00 3.08 -0.95 -2.05 114.38 113.87 1gxd h ARG 117 Ca 0.22 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.19 1gxd h ARG 117 Cb 0.55 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1gxd h ARG 117 CO -0.66 0.00 -0.03 0.00 -1.07 0.00 0.00 179.97 178.21 1gxd h ALA 118 N 1.94 0.55 -0.50 0.04 0.00 0.00 -2.61 119.26 118.69 1gxd h ALA 118 Ca 0.04 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1gxd h ALA 118 Cb 0.18 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1gxd h ALA 118 CO -0.00 0.36 0.01 0.74 0.00 0.00 0.00 179.25 180.36 1gxd h PHE 119 N 0.56 0.89 -1.00 0.00 0.04 -0.96 -2.11 116.94 114.36 1gxd h PHE 119 Ca 0.11 -0.13 0.10 0.00 2.80 0.00 0.00 57.97 60.86 1gxd h PHE 119 Cb 0.53 -0.24 -0.08 0.00 2.20 0.00 0.00 35.95 38.35 1gxd h PHE 119 CO 0.04 0.81 0.63 0.37 -0.60 0.00 0.00 178.31 179.56 1gxd h GLN 120 N 0.78 1.02 -1.11 1.51 4.15 -1.12 -0.29 115.11 120.05 1gxd h GLN 120 Ca 0.15 -0.06 0.31 0.00 0.77 0.00 0.00 58.65 59.82 1gxd h GLN 120 Cb 0.46 -0.23 -0.10 0.00 0.21 0.00 0.00 27.48 27.82 1gxd h GLN 120 CO 0.02 0.67 0.72 0.28 -1.93 0.00 0.00 178.83 178.59 1gxd h VAL 121 N 1.05 0.42 0.10 2.39 2.07 -1.01 -1.78 116.25 119.49 1gxd h VAL 121 Ca 0.47 -0.10 -0.37 0.00 0.82 0.00 0.00 66.70 67.53 1gxd h VAL 121 Cb 0.38 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 1gxd h VAL 121 CO -0.24 0.05 -2.07 0.79 0.02 0.00 0.00 177.57 176.13 1gxd n TRP 122 N -4.62 1.00 0.03 1.57 7.02 -0.22 -4.44 117.44 117.78 1gxd n TRP 122 Ca 0.28 0.22 -0.02 0.00 -1.02 0.00 0.00 57.50 56.96 1gxd n TRP 122 Cb 1.03 -1.13 -0.01 0.00 -2.42 0.00 0.00 31.31 28.78 1gxd n TRP 122 CO 0.00 0.00 0.00 0.77 -2.02 0.00 0.00 177.69 176.44 1gxd h SER 123 N 0.01 -0.16 0.00 -0.99 0.02 -0.58 -2.54 113.55 109.30 1gxd h SER 123 Ca -0.45 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1gxd h SER 123 Cb 1.98 0.06 0.00 0.00 0.14 0.00 0.00 62.40 64.57 1gxd h SER 123 CO 0.04 -0.07 0.00 0.47 -1.14 0.00 0.00 176.83 176.13 1gxd n ASP 124 N -2.66 0.00 -0.41 3.07 8.00 -0.74 0.25 116.55 124.05 1gxd n ASP 124 Ca -0.01 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.56 1gxd n ASP 124 Cb 0.05 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 41.29 1gxd n ASP 124 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1gxd n VAL 125 N -2.05 1.67 -3.83 2.53 0.24 -0.97 -4.98 118.33 110.95 1gxd n VAL 125 Ca 0.00 -2.29 -0.07 0.00 -2.04 0.00 0.00 64.34 59.93 1gxd n VAL 125 Cb 0.00 -0.07 0.01 0.00 -1.47 0.00 0.00 33.84 32.31 1gxd n VAL 125 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1gxd s THR 126 N -2.50 0.00 -1.90 3.34 -4.23 0.68 -4.26 115.64 106.77 1gxd s THR 126 Ca 0.31 -0.93 0.12 0.00 -1.18 0.00 0.00 61.69 60.01 1gxd s THR 126 Cb 0.29 -2.55 0.35 0.00 1.34 0.00 0.00 72.50 71.93 1gxd s THR 126 CO -0.02 0.00 1.28 -0.81 -0.54 0.00 0.00 174.62 174.52 1gxd n PRO 127 N -0.52 1.99 -2.18 3.99 -0.04 -1.00 -4.65 135.00 132.58 1gxd n PRO 127 Ca -0.06 -1.42 -0.41 0.00 -0.04 0.00 0.00 63.50 61.57 1gxd n PRO 127 Cb 0.60 -1.35 -0.03 0.00 -0.04 0.00 0.00 33.50 32.68 1gxd n PRO 127 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1gxd s LEU 128 N -1.03 4.45 -0.17 1.53 1.43 -1.26 -4.78 118.68 118.85 1gxd s LEU 128 Ca 0.26 2.61 -0.02 0.00 -1.03 0.00 0.00 54.13 55.95 1gxd s LEU 128 Cb 0.14 -3.64 0.05 0.00 0.03 0.00 0.00 46.19 42.77 1gxd s LEU 128 CO 0.17 -0.46 0.01 -0.13 0.23 0.00 0.00 176.35 176.17 1gxd s ARG 129 N -1.71 0.80 0.13 1.70 0.52 0.26 -4.57 118.95 116.09 1gxd s ARG 129 Ca 0.48 -0.36 -0.07 0.00 -0.52 0.00 0.00 55.73 55.26 1gxd s ARG 129 Cb -0.38 -1.90 -0.06 0.00 0.52 0.00 0.00 34.95 33.13 1gxd s ARG 129 CO 0.51 -0.54 0.40 -0.06 0.02 0.00 0.00 175.30 175.62 1gxd s PHE 130 N 1.83 3.50 -0.12 -0.53 0.08 -1.26 -1.54 117.98 119.94 1gxd s PHE 130 Ca 0.00 0.67 -0.07 0.00 0.12 0.00 0.00 56.93 57.65 1gxd s PHE 130 Cb -0.16 -2.08 0.04 0.00 -0.57 0.00 0.00 43.02 40.25 1gxd s PHE 130 CO -0.07 0.45 0.28 -1.12 -0.10 0.00 0.00 175.22 174.66 1gxd s SER 131 N -2.19 -0.32 -0.17 1.36 0.01 -0.96 -4.98 113.70 106.45 1gxd s SER 131 Ca 0.39 0.60 -0.24 0.00 1.31 0.00 0.00 55.95 58.01 1gxd s SER 131 Cb -0.13 0.51 -0.02 0.00 0.21 0.00 0.00 66.02 66.60 1gxd s SER 131 CO 0.22 -0.16 0.79 -0.60 0.41 0.00 0.00 173.24 173.90 1gxd s ARG 132 N 1.03 4.29 -0.12 12.44 3.52 -1.26 -2.03 118.95 136.82 1gxd s ARG 132 Ca -0.07 0.94 0.01 0.00 -0.13 0.00 0.00 55.73 56.48 1gxd s ARG 132 Cb -0.08 -3.57 -0.01 0.00 -1.56 0.00 0.00 34.95 29.73 1gxd s ARG 132 CO -0.07 -0.30 -0.17 0.96 -0.81 0.00 0.00 175.30 174.91 1gxd s ILE 133 N 2.06 2.71 -2.08 4.11 -4.36 -0.96 -4.97 121.20 117.71 1gxd s ILE 133 Ca 0.36 -0.79 0.15 0.00 -0.26 0.00 0.00 60.65 60.12 1gxd s ILE 133 Cb -0.16 -2.11 0.40 0.00 1.25 0.00 0.00 42.46 41.84 1gxd s ILE 133 CO 0.12 0.54 1.50 1.41 0.24 0.00 0.00 174.94 178.75 1gxd n HIS 134 N 3.46 0.12 -3.77 1.37 8.25 -1.26 -4.61 115.22 118.76 1gxd n HIS 134 Ca -0.18 -0.06 -0.13 0.00 -0.26 0.00 0.00 57.72 57.09 1gxd n HIS 134 Cb 0.53 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.52 1gxd n HIS 134 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1gxd s ASP 135 N -1.42 -0.27 0.00 0.41 2.15 -1.26 -4.96 116.67 111.32 1gxd s ASP 135 Ca 0.24 0.52 0.00 0.00 0.43 0.00 0.00 52.55 53.74 1gxd s ASP 135 Cb 0.12 0.50 0.00 0.00 -0.30 0.00 0.00 42.92 43.24 1gxd s ASP 135 CO 0.19 -0.10 0.00 0.61 -0.17 0.00 0.00 175.17 175.70 1gxd n GLY 136 N 3.21 -2.03 3.62 2.66 0.00 -1.26 -4.81 105.19 106.57 1gxd n GLY 136 Ca -0.15 -1.52 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 1gxd n GLY 136 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gxd s GLU 137 N 0.00 4.06 0.56 1.61 0.41 -1.26 -5.05 118.70 119.04 1gxd s GLU 137 Ca 0.00 0.62 -0.03 0.00 -0.41 0.00 0.00 54.97 55.16 1gxd s GLU 137 Cb 0.00 -3.68 0.02 0.00 -1.78 0.00 0.00 34.13 28.69 1gxd s GLU 137 CO 0.00 -0.53 0.83 0.00 -0.49 0.00 0.00 175.26 175.07 1gxd s ALA 138 N 2.72 3.52 0.06 5.21 0.00 -1.26 -5.00 121.76 127.02 1gxd s ALA 138 Ca 0.30 -0.96 -0.19 0.00 0.00 0.00 0.00 51.96 51.10 1gxd s ALA 138 Cb -0.15 -2.37 -0.12 0.00 0.00 0.00 0.00 23.12 20.49 1gxd s ALA 138 CO 0.10 -0.76 1.42 -0.44 0.00 0.00 0.00 175.76 176.08 1gxd h ASP 139 N -0.04 0.41 -3.64 0.00 5.19 -0.33 -3.40 116.42 114.61 1gxd h ASP 139 Ca -0.45 -0.41 -0.69 0.00 -0.62 0.00 0.00 57.03 54.87 1gxd h ASP 139 Cb 1.27 -0.11 -0.33 0.00 0.18 0.00 0.00 39.33 40.34 1gxd h ASP 139 CO 0.58 0.73 -0.63 -0.63 -3.12 0.00 0.00 179.24 176.17 1gxd s ILE 140 N -4.59 3.21 -0.26 0.35 1.01 0.13 -4.22 121.20 116.83 1gxd s ILE 140 Ca -0.14 -1.63 -0.16 0.00 0.00 0.00 0.00 60.65 58.72 1gxd s ILE 140 Cb 0.06 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.50 1gxd s ILE 140 CO 0.75 -0.36 0.43 -0.04 0.00 0.00 0.00 174.94 175.72 1gxd s MET 141 N 1.22 4.06 -0.18 2.79 -1.94 -1.26 -0.87 119.30 123.12 1gxd s MET 141 Ca 0.01 0.17 -0.07 0.00 -1.71 0.00 0.00 55.69 54.08 1gxd s MET 141 Cb -0.21 -3.64 -0.04 0.00 2.01 0.00 0.00 34.83 32.95 1gxd s MET 141 CO -0.02 -0.28 0.07 0.42 -0.01 0.00 0.00 175.02 175.20 1gxd s ILE 142 N 2.07 4.86 0.21 2.53 1.01 0.21 -1.84 121.20 130.25 1gxd s ILE 142 Ca 0.18 -0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.71 1gxd s ILE 142 Cb -0.16 -3.18 -0.01 0.00 0.01 0.00 0.00 42.46 39.13 1gxd s ILE 142 CO 0.09 0.47 0.38 0.21 0.00 0.00 0.00 174.94 176.10 1gxd s ASN 143 N 0.24 -0.04 0.25 3.58 3.04 -0.93 0.55 114.94 121.63 1gxd s ASN 143 Ca 0.04 -0.91 0.11 0.00 0.04 0.00 0.00 52.86 52.14 1gxd s ASN 143 Cb -0.12 0.51 -0.05 0.00 -1.54 0.00 0.00 41.25 40.06 1gxd s ASN 143 CO 0.00 -1.02 -0.13 -0.36 -3.04 0.00 0.00 177.10 172.56 1gxd s PHE 144 N -4.00 2.47 -0.18 0.43 0.40 -1.26 -1.38 117.98 114.47 1gxd s PHE 144 Ca 0.21 -0.28 -0.34 0.00 -0.60 0.00 0.00 56.93 55.92 1gxd s PHE 144 Cb 0.01 -1.12 0.14 0.00 0.51 0.00 0.00 43.02 42.56 1gxd s PHE 144 CO 0.05 0.63 1.18 0.20 0.70 0.00 0.00 175.22 177.97 1gxd s GLY 145 N -3.33 -0.27 0.61 4.36 0.00 0.53 -4.86 107.32 104.37 1gxd s GLY 145 Ca 0.28 1.68 0.06 0.00 0.00 0.00 0.00 44.72 46.74 1gxd s GLY 145 CO 0.16 0.60 0.85 0.50 0.00 0.00 0.00 173.10 175.20 1gxd s ARG 146 N -2.28 2.13 0.23 2.90 0.52 -1.26 -0.52 118.95 120.67 1gxd s ARG 146 Ca 0.08 -1.44 -0.22 0.00 -0.52 0.00 0.00 55.73 53.63 1gxd s ARG 146 Cb -0.01 -2.55 -0.14 0.00 0.52 0.00 0.00 34.95 32.77 1gxd s ARG 146 CO -0.05 -1.02 0.31 0.91 0.02 0.00 0.00 175.30 175.47 1gxd n TRP 147 N -2.42 -0.91 -3.88 -0.53 7.02 -1.26 -1.59 117.44 113.88 1gxd n TRP 147 Ca 0.15 0.72 -0.28 0.00 -1.02 0.00 0.00 57.50 57.07 1gxd n TRP 147 Cb 0.61 -1.61 -0.00 0.00 -2.42 0.00 0.00 31.31 27.89 1gxd n TRP 147 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1gxd n GLU 148 N 0.95 -2.56 -1.11 -0.99 4.07 -1.26 -4.71 120.64 115.02 1gxd n GLU 148 Ca 0.13 0.40 -0.18 0.00 -0.06 0.00 0.00 57.16 57.46 1gxd n GLU 148 Cb 0.26 -4.31 -0.14 0.00 -0.06 0.00 0.00 31.44 27.19 1gxd n GLU 148 CO 0.00 0.00 0.00 -2.39 -0.06 0.00 0.00 177.13 174.68 1gxd n HIS 149 N -4.37 0.54 0.00 4.31 1.44 -0.62 -4.76 115.22 111.76 1gxd n HIS 149 Ca -0.24 -1.78 0.00 0.00 -2.01 0.00 0.00 57.72 53.69 1gxd n HIS 149 Cb 0.65 -1.70 0.00 0.00 0.12 0.00 0.00 29.99 29.06 1gxd n HIS 149 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1gxd n GLY 150 N 2.45 2.81 0.99 -1.39 0.00 -1.26 -4.87 105.19 103.92 1gxd n GLY 150 Ca 0.49 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.62 1gxd n GLY 150 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gxd n ASP 151 N 0.00 3.09 0.00 1.61 5.68 -1.26 -4.94 116.55 120.73 1gxd n ASP 151 Ca 0.00 -1.96 0.00 0.00 -0.50 0.00 0.00 54.79 52.33 1gxd n ASP 151 Cb 0.00 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 39.89 1gxd n ASP 151 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gxd n GLY 152 N 1.34 2.01 3.06 6.12 0.00 -1.26 -4.94 105.19 111.52 1gxd n GLY 152 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1gxd n GLY 152 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gxd s TYR 153 N -3.29 3.75 0.73 1.61 2.02 -1.26 -5.06 117.35 115.85 1gxd s TYR 153 Ca 0.00 -3.07 -0.15 0.00 -0.37 0.00 0.00 57.07 53.48 1gxd s TYR 153 Cb 0.00 -3.11 0.04 0.00 -0.40 0.00 0.00 41.96 38.49 1gxd s TYR 153 CO 0.00 -0.71 1.21 -1.25 -1.57 0.00 0.00 175.55 173.24 1gxd s PRO 154 N -1.21 2.14 0.68 -1.71 0.04 -1.26 -4.66 135.00 129.03 1gxd s PRO 154 Ca 0.25 1.78 0.03 0.00 0.04 0.00 0.00 61.00 63.11 1gxd s PRO 154 Cb -0.09 -1.83 0.12 0.00 0.04 0.00 0.00 34.50 32.75 1gxd s PRO 154 CO -0.12 -1.84 0.94 -0.06 0.04 0.00 0.00 177.00 175.96 1gxd s PHE 155 N -1.95 1.34 -0.47 0.56 0.08 -1.26 -4.68 117.98 111.60 1gxd s PHE 155 Ca 0.75 -0.49 0.07 0.00 0.12 0.00 0.00 56.93 57.37 1gxd s PHE 155 Cb -0.30 -2.70 0.24 0.00 -0.57 0.00 0.00 43.02 39.69 1gxd s PHE 155 CO 0.45 -1.59 0.57 -0.40 -0.10 0.00 0.00 175.22 174.14 1gxd n ASP 156 N -2.66 1.17 -0.44 1.36 5.68 -1.26 -4.23 116.55 116.17 1gxd n ASP 156 Ca 0.16 -2.88 0.00 0.00 -0.50 0.00 0.00 54.79 51.57 1gxd n ASP 156 Cb 0.61 -0.64 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 1gxd n ASP 156 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gxd n GLY 157 N 1.39 -0.10 3.74 6.12 0.00 -1.26 -4.73 105.19 110.35 1gxd n GLY 157 Ca 0.24 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 1gxd n GLY 157 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1gxd n LYS 158 N -0.87 2.63 0.00 1.61 4.81 -1.26 -4.73 118.16 120.35 1gxd n LYS 158 Ca 0.00 0.94 0.00 0.00 -0.87 0.00 0.00 58.31 58.38 1gxd n LYS 158 Cb 0.00 -2.70 0.00 0.00 0.02 0.00 0.00 35.03 32.35 1gxd n LYS 158 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1gxd n ASP 159 N 1.96 -2.78 0.00 3.14 8.00 -1.26 -4.91 116.55 120.70 1gxd n ASP 159 Ca 0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.58 1gxd n ASP 159 Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 1gxd n ASP 159 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gxd n GLY 160 N 0.00 2.01 3.75 0.44 0.00 -1.26 -4.64 105.19 105.48 1gxd n GLY 160 Ca 0.00 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 1gxd n GLY 160 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gxd s LEU 161 N 0.00 4.56 -0.17 0.99 1.43 -1.26 -1.19 118.68 123.04 1gxd s LEU 161 Ca 0.00 2.06 0.05 0.00 -1.03 0.00 0.00 54.13 55.21 1gxd s LEU 161 Cb 0.00 -3.61 -0.14 0.00 0.03 0.00 0.00 46.19 42.47 1gxd s LEU 161 CO 0.00 -0.06 -0.10 0.18 0.23 0.00 0.00 176.35 176.60 1gxd n LEU 162 N 1.80 2.15 0.00 1.79 4.77 -0.74 -4.73 117.00 122.04 1gxd n LEU 162 Ca 0.00 -0.07 -0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1gxd n LEU 162 Cb 0.46 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1gxd n LEU 162 CO 0.52 0.68 0.02 0.00 -1.33 0.00 0.00 177.39 177.29 1gxd n ALA 163 N -2.90 -0.08 -3.58 -1.18 0.00 -1.26 -1.14 120.51 110.37 1gxd n ALA 163 Ca -0.30 -0.03 -0.05 0.00 0.00 0.00 0.00 53.44 53.06 1gxd n ALA 163 Cb 0.88 0.02 -0.02 0.00 0.00 0.00 0.00 19.45 20.33 1gxd n ALA 163 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1gxd s HIS 164 N -5.89 -0.18 -0.21 0.00 -3.43 -0.42 0.37 115.29 105.54 1gxd s HIS 164 Ca 0.01 0.10 -0.17 0.00 -0.80 0.00 0.00 55.06 54.19 1gxd s HIS 164 Cb -0.00 0.52 0.06 0.00 -1.43 0.00 0.00 32.58 31.73 1gxd s HIS 164 CO 0.00 -0.30 0.55 0.00 -2.00 0.00 0.00 174.74 172.99 1gxd s ALA 165 N -2.61 -1.40 0.05 -1.38 0.00 -1.26 -0.82 121.76 114.34 1gxd s ALA 165 Ca 0.09 1.70 -0.22 0.00 0.00 0.00 0.00 51.96 53.53 1gxd s ALA 165 Cb -0.01 -1.00 -0.06 0.00 0.00 0.00 0.00 23.12 22.05 1gxd s ALA 165 CO -0.06 -0.28 0.64 -0.06 0.00 0.00 0.00 175.76 176.00 1gxd s PHE 166 N 0.69 3.76 0.90 0.00 0.08 -0.65 -4.71 117.98 118.06 1gxd s PHE 166 Ca -0.03 1.32 -0.14 0.00 0.12 0.00 0.00 56.93 58.21 1gxd s PHE 166 Cb -0.05 -2.64 0.01 0.00 -0.57 0.00 0.00 43.02 39.77 1gxd s PHE 166 CO -0.05 0.42 0.36 0.00 -0.10 0.00 0.00 175.22 175.86 1gxd n ALA 167 N 2.32 -2.53 -1.72 5.36 0.00 -1.26 -0.19 120.51 122.49 1gxd n ALA 167 Ca -0.07 -0.53 -0.43 0.00 0.00 0.00 0.00 53.44 52.42 1gxd n ALA 167 Cb 0.50 -1.77 -0.02 0.00 0.00 0.00 0.00 19.45 18.17 1gxd n ALA 167 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1gxd n PRO 168 N -1.22 2.50 -3.31 0.00 -0.02 -1.25 -2.07 135.00 129.64 1gxd n PRO 168 Ca 0.07 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 1gxd n PRO 168 Cb 0.53 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 1gxd n PRO 168 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gxd n GLY 169 N 2.09 -0.96 3.99 -1.23 0.00 -1.26 -0.33 105.19 107.49 1gxd n GLY 169 Ca 0.09 -0.85 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 1gxd n GLY 169 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gxd s THR 170 N -3.00 2.17 0.00 2.61 2.01 -1.26 -4.24 115.64 113.93 1gxd s THR 170 Ca 0.00 -0.63 0.00 0.00 0.31 0.00 0.00 61.69 61.37 1gxd s THR 170 Cb 0.00 -2.54 0.00 0.00 0.01 0.00 0.00 72.50 69.97 1gxd s THR 170 CO 0.00 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.54 1gxd n GLY 171 N -2.75 2.09 0.27 4.40 0.00 -1.26 -0.42 105.19 107.53 1gxd n GLY 171 Ca 0.15 0.40 0.16 0.00 0.00 0.00 0.00 46.02 46.73 1gxd n GLY 171 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1gxd h VAL 172 N 0.00 0.18 -0.94 1.61 2.07 -1.96 -3.46 116.25 113.75 1gxd h VAL 172 Ca 0.00 -0.58 -0.72 0.00 0.82 0.00 0.00 66.70 66.22 1gxd h VAL 172 Cb 0.00 1.48 0.06 0.00 -1.52 0.00 0.00 31.29 31.31 1gxd h VAL 172 CO 0.00 0.06 -0.07 0.61 0.02 0.00 0.00 177.57 178.19 1gxd n GLY 173 N -0.16 -0.57 2.77 2.17 0.00 0.44 -1.46 105.19 108.39 1gxd n GLY 173 Ca -0.00 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.64 1gxd n GLY 173 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gxd n GLY 174 N 1.51 2.66 3.57 -0.02 0.00 0.73 -4.56 105.19 109.08 1gxd n GLY 174 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.77 1gxd n GLY 174 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gxd n ASP 175 N 0.69 0.90 -4.02 1.61 8.00 -0.54 -4.51 116.55 118.69 1gxd n ASP 175 Ca 0.00 1.11 -0.28 0.00 0.71 0.00 0.00 54.79 56.33 1gxd n ASP 175 Cb 0.00 -1.27 -0.17 0.00 -0.02 0.00 0.00 41.12 39.67 1gxd n ASP 175 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1gxd s SER 176 N -0.67 2.27 -0.03 -2.24 0.01 -0.77 -1.63 113.70 110.64 1gxd s SER 176 Ca 0.60 -0.38 0.04 0.00 1.31 0.00 0.00 55.95 57.53 1gxd s SER 176 Cb -0.66 -1.00 -0.03 0.00 0.21 0.00 0.00 66.02 64.54 1gxd s SER 176 CO 0.59 -0.01 -0.15 -1.00 0.41 0.00 0.00 173.24 173.08 1gxd s HIS 177 N 1.10 2.67 0.10 2.43 3.76 0.00 -2.18 115.29 123.18 1gxd s HIS 177 Ca -0.05 -0.18 0.10 0.00 -0.15 0.00 0.00 55.06 54.78 1gxd s HIS 177 Cb -0.14 -1.59 -0.04 0.00 1.11 0.00 0.00 32.58 31.92 1gxd s HIS 177 CO -0.03 0.20 -0.26 -0.06 -0.85 0.00 0.00 174.74 173.75 1gxd s PHE 178 N -0.78 2.34 -0.04 1.40 0.40 -0.48 -1.30 117.98 119.53 1gxd s PHE 178 Ca 0.12 -0.37 -0.30 0.00 -0.60 0.00 0.00 56.93 55.78 1gxd s PHE 178 Cb -0.11 -1.31 -0.03 0.00 0.51 0.00 0.00 43.02 42.08 1gxd s PHE 178 CO 0.02 0.28 1.14 0.34 0.70 0.00 0.00 175.22 177.70 1gxd s ASP 179 N -1.81 7.12 0.37 1.36 -1.08 -0.29 -0.34 116.67 121.99 1gxd s ASP 179 Ca 0.14 1.79 0.26 0.00 -0.52 0.00 0.00 52.55 54.22 1gxd s ASP 179 Cb -0.10 -2.56 0.77 0.00 -1.46 0.00 0.00 42.92 39.56 1gxd s ASP 179 CO 0.05 -0.50 1.75 -0.78 0.52 0.00 0.00 175.17 176.21 1gxd h ASP 180 N 7.20 0.00 -0.16 -0.34 3.58 -1.14 -3.04 116.42 122.52 1gxd h ASP 180 Ca -0.36 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.09 1gxd h ASP 180 Cb 1.18 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.23 1gxd h ASP 180 CO 0.85 0.00 0.00 0.47 -2.88 0.00 0.00 179.24 177.68 1gxd n ASP 181 N -2.72 1.13 -4.45 2.28 8.00 -1.26 -4.83 116.55 114.70 1gxd n ASP 181 Ca 0.04 -1.76 -0.27 0.00 0.71 0.00 0.00 54.79 53.50 1gxd n ASP 181 Cb 0.41 -0.10 0.14 0.00 -0.02 0.00 0.00 41.12 41.55 1gxd n ASP 181 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1gxd s GLU 182 N -1.80 1.24 -0.63 -1.24 0.41 -1.15 -4.10 118.70 111.43 1gxd s GLU 182 Ca 0.25 -0.61 0.01 0.00 -0.41 0.00 0.00 54.97 54.20 1gxd s GLU 182 Cb 0.13 -2.06 0.16 0.00 -1.78 0.00 0.00 34.13 30.58 1gxd s GLU 182 CO 0.19 -1.91 0.43 -1.17 -0.49 0.00 0.00 175.26 172.31 1gxd s LEU 183 N -5.54 4.91 0.26 1.80 2.96 -1.26 -5.06 118.68 116.75 1gxd s LEU 183 Ca 0.69 -3.14 -0.30 0.00 -0.22 0.00 0.00 54.13 51.16 1gxd s LEU 183 Cb -0.05 -1.76 -0.09 0.00 0.50 0.00 0.00 46.19 44.78 1gxd s LEU 183 CO 0.49 -0.26 1.15 0.26 -1.32 0.00 0.00 176.35 176.67 1gxd s TRP 184 N -0.48 3.47 0.37 5.38 0.52 -1.26 -1.92 118.94 125.03 1gxd s TRP 184 Ca 0.19 1.59 -0.05 0.00 0.02 0.00 0.00 56.10 57.84 1gxd s TRP 184 Cb -0.19 -3.37 0.02 0.00 -1.15 0.00 0.00 33.47 28.78 1gxd s TRP 184 CO -0.05 -0.89 0.58 0.95 0.02 0.00 0.00 176.95 177.57 1gxd s THR 185 N -0.83 0.00 -1.30 2.01 -4.23 -0.62 -4.74 115.64 105.93 1gxd s THR 185 Ca 0.47 -1.42 0.06 0.00 -1.18 0.00 0.00 61.69 59.62 1gxd s THR 185 Cb -0.33 -2.78 0.24 0.00 1.34 0.00 0.00 72.50 70.97 1gxd s THR 185 CO 0.41 0.00 1.02 0.18 -0.54 0.00 0.00 174.62 175.69 1gxd n LEU 186 N -0.58 1.96 0.00 4.79 4.77 -1.26 -0.83 117.00 125.85 1gxd n LEU 186 Ca -0.02 -0.99 0.00 0.00 -0.03 0.00 0.00 56.01 54.97 1gxd n LEU 186 Cb 0.61 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1gxd n LEU 186 CO 0.30 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 1gxd n GLY 187 N 0.49 3.11 2.77 -0.72 0.00 -1.26 -4.71 105.19 104.87 1gxd n GLY 187 Ca 0.08 -1.01 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 1gxd n GLY 187 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1gxd n GLU 188 N 0.00 3.62 0.00 1.61 1.02 -1.26 -4.61 120.64 121.02 1gxd n GLU 188 Ca 0.00 -4.11 0.00 0.00 -0.02 0.00 0.00 57.16 53.03 1gxd n GLU 188 Cb 0.00 -2.32 0.00 0.00 -0.02 0.00 0.00 31.44 29.10 1gxd n GLU 188 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gxd n GLY 189 N -0.38 1.22 3.55 0.62 0.00 -0.09 -4.97 105.19 105.14 1gxd n GLY 189 Ca 0.47 -2.04 -0.38 0.00 0.00 0.00 0.00 46.02 44.08 1gxd n GLY 189 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1gxd n GLN 190 N 1.30 0.66 -4.85 1.61 7.27 -1.26 -4.40 117.38 117.72 1gxd n GLN 190 Ca 0.00 0.26 -0.28 0.00 0.07 0.00 0.00 57.00 57.05 1gxd n GLN 190 Cb 0.00 -1.96 -0.17 0.00 2.41 0.00 0.00 30.24 30.52 1gxd n GLN 190 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 1gxd s VAL 191 N -1.64 1.59 -0.12 1.69 1.01 -1.26 -4.92 120.40 116.75 1gxd s VAL 191 Ca 0.73 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1gxd s VAL 191 Cb -0.42 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.57 1gxd s VAL 191 CO 0.50 0.46 -0.11 -0.69 0.00 0.00 0.00 175.10 175.26 1gxd s VAL 192 N 0.56 1.30 -0.30 2.92 1.01 -1.26 -4.69 120.40 119.94 1gxd s VAL 192 Ca -0.15 -0.47 -0.20 0.00 0.00 0.00 0.00 61.98 61.15 1gxd s VAL 192 Cb -0.17 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.95 1gxd s VAL 192 CO 0.05 0.41 0.61 -0.60 0.00 0.00 0.00 175.10 175.58 1gxd s ARG 193 N 1.47 3.91 0.62 2.72 3.52 -1.26 -0.16 118.95 129.77 1gxd s ARG 193 Ca 0.02 0.28 -0.09 0.00 -0.13 0.00 0.00 55.73 55.82 1gxd s ARG 193 Cb -0.13 -3.72 -0.01 0.00 -1.56 0.00 0.00 34.95 29.52 1gxd s ARG 193 CO -0.08 -0.55 0.99 0.08 -0.81 0.00 0.00 175.30 174.93 1gxd s VAL 194 N 2.57 4.18 0.01 7.11 1.01 -1.05 -4.57 120.40 129.66 1gxd s VAL 194 Ca 0.24 0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.72 1gxd s VAL 194 Cb -0.15 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1gxd s VAL 194 CO 0.11 -0.82 0.00 2.29 0.00 0.00 0.00 175.10 176.68 1gxd n LYS 195 N -2.72 0.00 -2.93 2.72 2.85 -0.96 -4.22 118.16 112.90 1gxd n LYS 195 Ca 0.05 0.00 -0.40 0.00 -1.05 0.00 0.00 58.31 56.91 1gxd n LYS 195 Cb 0.56 -0.01 -0.04 0.00 -0.65 0.00 0.00 35.03 34.89 1gxd n LYS 195 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 177.40 178.87 1gxd s TYR 196 N -2.00 3.60 0.00 5.58 1.13 -1.26 -4.29 117.35 120.11 1gxd s TYR 196 Ca 0.00 1.40 0.00 0.00 -1.41 0.00 0.00 57.07 57.06 1gxd s TYR 196 Cb 0.00 -2.91 0.00 0.00 -1.10 0.00 0.00 41.96 37.95 1gxd s TYR 196 CO 0.00 0.05 0.00 0.41 -2.51 0.00 0.00 175.55 173.50 1gxd n GLY 197 N 3.04 2.36 3.51 5.49 0.00 -1.26 -2.04 105.19 116.29 1gxd n GLY 197 Ca 0.01 -2.03 -0.40 0.00 0.00 0.00 0.00 46.02 43.61 1gxd n GLY 197 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gxd n ASN 198 N 0.00 -0.29 -1.28 1.61 0.23 -1.25 -2.23 115.26 112.05 1gxd n ASN 198 Ca 0.00 0.86 -0.09 0.00 -0.53 0.00 0.00 54.58 54.82 1gxd n ASN 198 Cb 0.00 -1.22 0.01 0.00 -2.08 0.00 0.00 39.78 36.49 1gxd n ASN 198 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1gxd n ALA 199 N -1.20 -0.36 0.30 -2.53 0.00 -1.26 -3.78 120.51 111.68 1gxd n ALA 199 Ca 0.11 0.11 0.16 0.00 0.00 0.00 0.00 53.44 53.82 1gxd n ALA 199 Cb 0.43 -1.71 0.94 0.00 0.00 0.00 0.00 19.45 19.11 1gxd n ALA 199 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1gxd h ASP 200 N -0.41 0.00 0.46 0.00 1.82 -1.63 -3.16 116.42 113.50 1gxd h ASP 200 Ca -0.22 0.00 -0.12 0.00 -0.39 0.00 0.00 57.03 56.30 1gxd h ASP 200 Cb 1.15 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.14 1gxd h ASP 200 CO 0.24 0.00 -1.64 0.61 -1.61 0.00 0.00 179.24 176.84 1gxd n GLY 201 N -1.31 -1.17 3.80 -0.78 0.00 -1.26 -3.36 105.19 101.12 1gxd n GLY 201 Ca -0.03 -0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 1gxd n GLY 201 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gxd s GLU 202 N -3.11 2.95 0.51 1.61 8.01 -1.20 -4.61 118.70 122.86 1gxd s GLU 202 Ca -0.05 1.10 -0.20 0.00 0.01 0.00 0.00 54.97 55.83 1gxd s GLU 202 Cb 0.10 -1.99 -0.07 0.00 -4.31 0.00 0.00 34.13 27.86 1gxd s GLU 202 CO 0.84 -1.10 1.10 0.71 0.01 0.00 0.00 175.26 176.82 1gxd s TYR 203 N -2.78 2.82 1.02 1.61 2.02 -1.26 -2.53 117.35 118.25 1gxd s TYR 203 Ca 0.61 1.56 -0.11 0.00 -0.37 0.00 0.00 57.07 58.75 1gxd s TYR 203 Cb -0.16 -3.22 0.20 0.00 -0.40 0.00 0.00 41.96 38.38 1gxd s TYR 203 CO 0.48 -1.30 1.10 0.00 -1.57 0.00 0.00 175.55 174.26 1gxd s LYS 205 N -4.57 1.69 -0.14 0.00 2.47 -0.90 -4.79 119.74 113.50 1gxd s LYS 205 Ca 0.67 -2.27 -0.07 0.00 -1.56 0.00 0.00 55.97 52.75 1gxd s LYS 205 Cb -0.24 -3.08 -0.04 0.00 -1.46 0.00 0.00 37.83 33.01 1gxd s LYS 205 CO 0.61 -1.07 0.11 -0.06 0.16 0.00 0.00 175.35 175.10 1gxd s PHE 206 N 0.20 3.45 0.63 4.03 0.08 -1.26 -2.93 117.98 122.18 1gxd s PHE 206 Ca 0.15 0.38 -0.11 0.00 0.12 0.00 0.00 56.93 57.47 1gxd s PHE 206 Cb -0.24 -1.97 -0.04 0.00 -0.57 0.00 0.00 43.02 40.21 1gxd s PHE 206 CO -0.03 0.54 1.03 -1.25 -0.10 0.00 0.00 175.22 175.41 1gxd s PRO 207 N -0.59 3.53 0.16 0.24 0.04 -1.26 -5.04 135.00 132.09 1gxd s PRO 207 Ca 0.12 0.72 0.05 0.00 0.04 0.00 0.00 61.00 61.93 1gxd s PRO 207 Cb -0.12 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 1gxd s PRO 207 CO 0.02 -0.61 -0.10 -0.59 0.04 0.00 0.00 177.00 175.76 1gxd s PHE 208 N -3.19 1.36 -0.27 0.56 -0.12 -0.27 -4.53 117.98 111.51 1gxd s PHE 208 Ca 0.55 -0.74 0.01 0.00 -0.05 0.00 0.00 56.93 56.70 1gxd s PHE 208 Cb -0.11 -0.69 0.05 0.00 -0.63 0.00 0.00 43.02 41.64 1gxd s PHE 208 CO 0.54 0.12 -0.07 -1.17 -0.05 0.00 0.00 175.22 174.58 1gxd s LEU 209 N -3.20 3.51 -0.05 -1.99 2.96 0.00 -0.40 118.68 119.51 1gxd s LEU 209 Ca 0.19 -1.28 0.02 0.00 -0.22 0.00 0.00 54.13 52.84 1gxd s LEU 209 Cb 0.02 -1.61 0.01 0.00 0.50 0.00 0.00 46.19 45.11 1gxd s LEU 209 CO 0.02 -0.20 -0.11 0.12 -1.32 0.00 0.00 176.35 174.86 1gxd s PHE 210 N 1.18 1.31 -1.42 5.38 5.36 -0.85 -3.41 117.98 125.53 1gxd s PHE 210 Ca -0.06 -0.44 -0.06 0.00 -0.96 0.00 0.00 56.93 55.41 1gxd s PHE 210 Cb -0.19 -0.96 0.04 0.00 -0.34 0.00 0.00 43.02 41.56 1gxd s PHE 210 CO -0.04 -0.22 0.76 0.09 -1.46 0.00 0.00 175.22 174.35 1gxd n ASN 211 N 3.66 -2.39 -3.83 6.13 3.02 -1.26 -1.99 115.26 118.60 1gxd n ASN 211 Ca -0.22 -0.84 -0.26 0.00 -0.03 0.00 0.00 54.58 53.23 1gxd n ASN 211 Cb 0.52 -3.78 0.03 0.00 -0.61 0.00 0.00 39.78 35.93 1gxd n ASN 211 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gxd n GLY 212 N -1.67 -0.40 3.54 7.41 0.00 -1.26 -4.97 105.19 107.84 1gxd n GLY 212 Ca -0.17 0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1gxd n GLY 212 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1gxd s LYS 213 N -6.35 0.68 -0.02 1.61 2.20 -0.84 -5.15 119.74 111.86 1gxd s LYS 213 Ca 0.36 1.00 -0.10 0.00 -0.36 0.00 0.00 55.97 56.88 1gxd s LYS 213 Cb -0.18 0.22 -0.05 0.00 -1.51 0.00 0.00 37.83 36.31 1gxd s LYS 213 CO 0.83 -0.12 0.29 -1.21 -0.36 0.00 0.00 175.35 174.78 1gxd s GLU 214 N 0.99 3.67 -0.20 4.03 2.02 -1.26 -2.00 118.70 125.95 1gxd s GLU 214 Ca -0.05 0.10 0.01 0.00 0.02 0.00 0.00 54.97 55.05 1gxd s GLU 214 Cb -0.05 -3.15 0.03 0.00 0.10 0.00 0.00 34.13 31.06 1gxd s GLU 214 CO -0.09 0.69 -0.17 0.71 0.02 0.00 0.00 175.26 176.41 1gxd s TYR 215 N -1.17 2.82 -2.49 1.61 2.02 0.47 -4.92 117.35 115.70 1gxd s TYR 215 Ca 0.23 -1.76 0.23 0.00 -0.37 0.00 0.00 57.07 55.41 1gxd s TYR 215 Cb -0.14 -1.88 0.45 0.00 -0.40 0.00 0.00 41.96 39.98 1gxd s TYR 215 CO 0.12 -0.81 1.41 0.09 -1.57 0.00 0.00 175.55 174.79 1gxd n ASN 216 N 4.60 3.33 -3.72 2.29 3.02 -1.26 -1.12 115.26 122.40 1gxd n ASN 216 Ca -0.19 -1.98 -0.12 0.00 -0.03 0.00 0.00 54.58 52.26 1gxd n ASN 216 Cb 0.48 -0.23 -0.06 0.00 -0.61 0.00 0.00 39.78 39.36 1gxd n ASN 216 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1gxd s SER 217 N -1.51 0.41 0.56 6.41 1.04 -1.26 -4.82 113.70 114.53 1gxd s SER 217 Ca 0.38 -1.27 -0.20 0.00 0.48 0.00 0.00 55.95 55.35 1gxd s SER 217 Cb 0.22 0.57 -0.05 0.00 0.10 0.00 0.00 66.02 66.87 1gxd s SER 217 CO 0.31 -1.14 1.19 0.00 0.98 0.00 0.00 173.24 174.59 1gxd s THR 219 N -1.62 0.29 -0.42 0.00 -1.32 -0.83 -4.87 115.64 106.86 1gxd s THR 219 Ca 0.75 -1.93 0.12 0.00 -1.21 0.00 0.00 61.69 59.41 1gxd s THR 219 Cb -0.29 -2.09 0.33 0.00 -1.51 0.00 0.00 72.50 68.94 1gxd s THR 219 CO 0.32 -0.45 1.26 -0.90 -2.21 0.00 0.00 174.62 172.65 1gxd n ASP 220 N -0.15 3.04 -4.75 8.08 5.75 -1.26 -0.80 116.55 126.46 1gxd n ASP 220 Ca -0.05 -2.49 -0.42 0.00 -0.01 0.00 0.00 54.79 51.82 1gxd n ASP 220 Cb 0.64 -0.33 -0.01 0.00 -1.03 0.00 0.00 41.12 40.39 1gxd n ASP 220 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 1gxd n THR 221 N -0.25 1.80 0.00 2.12 5.66 -1.26 -0.35 114.28 122.01 1gxd n THR 221 Ca 0.14 -0.45 0.00 0.00 -3.05 0.00 0.00 64.05 60.69 1gxd n THR 221 Cb 0.59 -1.87 0.00 0.00 -1.55 0.00 0.00 70.33 67.49 1gxd n THR 221 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1gxd n GLY 222 N 0.86 2.12 3.75 1.09 0.00 -1.26 -4.99 105.19 106.76 1gxd n GLY 222 Ca 0.04 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 1gxd n GLY 222 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gxd s ARG 223 N 0.00 2.74 -0.04 1.61 1.81 0.53 -4.95 118.95 120.65 1gxd s ARG 223 Ca 0.00 1.70 0.11 0.00 -1.72 0.00 0.00 55.73 55.82 1gxd s ARG 223 Cb 0.00 -1.91 -0.16 0.00 -0.45 0.00 0.00 34.95 32.42 1gxd s ARG 223 CO 0.00 -1.36 0.19 -1.13 -0.68 0.00 0.00 175.30 172.32 1gxd n SER 224 N -2.04 2.40 -1.62 0.23 3.41 -1.26 -4.73 113.62 110.02 1gxd n SER 224 Ca 0.13 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.61 1gxd n SER 224 Cb 0.50 1.30 0.19 0.00 -0.26 0.00 0.00 64.21 65.94 1gxd n SER 224 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1gxd n ASP 225 N -2.04 3.04 0.00 4.04 5.75 -1.26 -4.96 116.55 121.12 1gxd n ASP 225 Ca -0.06 -3.73 0.00 0.00 -0.01 0.00 0.00 54.79 50.99 1gxd n ASP 225 Cb 0.45 -0.72 0.00 0.00 -1.03 0.00 0.00 41.12 39.82 1gxd n ASP 225 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gxd n GLY 226 N -1.13 2.17 3.76 6.12 0.00 -1.26 -4.98 105.19 109.86 1gxd n GLY 226 Ca 0.45 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.08 1gxd n GLY 226 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gxd s PHE 227 N -1.16 2.48 0.05 1.61 0.08 -1.26 -4.87 117.98 114.90 1gxd s PHE 227 Ca 0.00 1.36 -0.03 0.00 0.12 0.00 0.00 56.93 58.38 1gxd s PHE 227 Cb 0.00 -3.78 -0.04 0.00 -0.57 0.00 0.00 43.02 38.62 1gxd s PHE 227 CO 0.00 -2.66 0.25 -0.51 -0.10 0.00 0.00 175.22 172.20 1gxd s LEU 228 N -3.03 4.35 0.27 -0.37 1.02 -1.26 -4.16 118.68 115.49 1gxd s LEU 228 Ca 0.65 0.41 -0.11 0.00 0.02 0.00 0.00 54.13 55.11 1gxd s LEU 228 Cb -0.40 -2.89 -0.00 0.00 0.02 0.00 0.00 46.19 42.92 1gxd s LEU 228 CO 0.50 0.18 0.48 -1.66 0.02 0.00 0.00 176.35 175.87 1gxd s TRP 229 N -1.45 0.51 0.08 0.29 1.48 0.01 -1.59 118.94 118.27 1gxd s TRP 229 Ca 0.33 -0.86 -0.26 0.00 -1.06 0.00 0.00 56.10 54.25 1gxd s TRP 229 Cb -0.13 0.14 0.07 0.00 -1.16 0.00 0.00 33.47 32.39 1gxd s TRP 229 CO 0.23 -1.03 0.63 0.00 -4.06 0.00 0.00 176.95 172.72 1gxd s SER 231 N -2.17 6.76 0.04 0.00 1.04 -1.26 -3.10 113.70 115.01 1gxd s SER 231 Ca -0.03 1.19 0.28 0.00 0.48 0.00 0.00 55.95 57.86 1gxd s SER 231 Cb -0.01 -2.34 0.98 0.00 0.10 0.00 0.00 66.02 64.76 1gxd s SER 231 CO -0.04 -0.15 1.77 0.41 0.98 0.00 0.00 173.24 176.21 1gxd n THR 232 N -0.19 0.10 -4.05 2.02 -1.04 0.17 -2.12 114.28 109.16 1gxd n THR 232 Ca 0.02 -0.05 -0.09 0.00 -2.04 0.00 0.00 64.05 61.89 1gxd n THR 232 Cb 0.53 -0.34 -0.09 0.00 -1.82 0.00 0.00 70.33 68.61 1gxd n THR 232 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1gxd s THR 233 N -3.02 0.14 0.10 12.58 -4.23 -1.26 -4.27 115.64 115.69 1gxd s THR 233 Ca 0.12 -1.68 -0.32 0.00 -1.18 0.00 0.00 61.69 58.64 1gxd s THR 233 Cb 0.17 -1.72 -0.13 0.00 1.34 0.00 0.00 72.50 72.17 1gxd s THR 233 CO 0.58 -0.65 1.51 0.22 -0.54 0.00 0.00 174.62 175.75 1gxd h TYR 234 N 2.89 -1.49 -2.64 3.99 3.20 -1.82 -3.37 116.97 117.74 1gxd h TYR 234 Ca -0.34 0.05 -0.65 0.00 3.14 0.00 0.00 58.73 60.93 1gxd h TYR 234 Cb 1.18 0.66 -0.16 0.00 1.54 0.00 0.00 36.73 39.95 1gxd h TYR 234 CO 0.46 -0.53 0.54 1.21 -1.64 0.00 0.00 178.16 178.20 1gxd s ASN 235 N -4.63 6.25 0.21 -2.11 3.04 -1.26 -0.82 114.94 115.62 1gxd s ASN 235 Ca -0.15 -1.23 -0.05 0.00 0.04 0.00 0.00 52.86 51.47 1gxd s ASN 235 Cb 0.06 -2.40 0.16 0.00 -1.54 0.00 0.00 41.25 37.53 1gxd s ASN 235 CO 0.57 -1.33 1.59 0.15 -3.04 0.00 0.00 177.10 175.04 1gxd h PHE 236 N 9.39 0.86 0.01 0.43 3.57 -1.72 -0.93 116.94 128.55 1gxd h PHE 236 Ca -0.21 -0.22 0.03 0.00 3.53 0.00 0.00 57.97 61.10 1gxd h PHE 236 Cb 1.06 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 39.56 1gxd h PHE 236 CO 0.98 0.95 -0.39 1.49 -2.23 0.00 0.00 178.31 179.12 1gxd h GLU 237 N 0.63 -0.53 -0.01 1.11 4.81 -1.89 0.52 114.58 119.21 1gxd h GLU 237 Ca 0.07 0.04 -0.25 0.00 -0.13 0.00 0.00 59.36 59.09 1gxd h GLU 237 Cb 0.82 0.12 0.02 0.00 0.63 0.00 0.00 28.75 30.34 1gxd h GLU 237 CO 0.07 -0.36 -0.98 -0.22 -0.73 0.00 0.00 179.01 176.80 1gxd h LYS 238 N -0.55 0.68 0.03 1.92 1.63 -1.94 -3.37 116.57 114.96 1gxd h LYS 238 Ca 0.05 -0.72 -0.15 0.00 -0.85 0.00 0.00 60.65 58.98 1gxd h LYS 238 Cb 0.63 0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 32.45 1gxd h LYS 238 CO -0.29 1.30 -0.82 -0.44 -3.45 0.00 0.00 179.45 175.75 1gxd h ASP 239 N 0.35 0.09 -1.60 4.20 3.32 -1.15 -3.49 116.42 118.15 1gxd h ASP 239 Ca -0.12 -0.77 -0.20 0.00 0.02 0.00 0.00 57.03 55.96 1gxd h ASP 239 Cb 1.64 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 41.15 1gxd h ASP 239 CO 0.19 1.33 -0.26 0.61 -1.72 0.00 0.00 179.24 179.39 1gxd n GLY 240 N 1.57 -0.02 3.46 2.75 0.00 0.18 -5.02 105.19 108.11 1gxd n GLY 240 Ca -0.22 -0.45 -0.33 0.00 0.00 0.00 0.00 46.02 45.02 1gxd n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gxd s LYS 241 N -4.60 3.55 0.38 1.61 1.02 -1.26 -5.06 119.74 115.38 1gxd s LYS 241 Ca 0.03 -0.57 -0.09 0.00 0.02 0.00 0.00 55.97 55.35 1gxd s LYS 241 Cb -0.01 -2.81 0.04 0.00 -0.52 0.00 0.00 37.83 34.52 1gxd s LYS 241 CO 0.03 0.25 0.66 1.52 -0.92 0.00 0.00 175.35 176.89 1gxd s TYR 242 N 0.31 0.57 0.25 3.18 1.13 -1.25 0.42 117.35 121.97 1gxd s TYR 242 Ca -0.06 -1.06 -0.11 0.00 -1.41 0.00 0.00 57.07 54.43 1gxd s TYR 242 Cb -0.15 0.44 0.04 0.00 -1.10 0.00 0.00 41.96 41.20 1gxd s TYR 242 CO 0.04 -1.42 0.58 0.41 -2.51 0.00 0.00 175.55 172.65 1gxd n GLY 243 N -0.56 1.21 3.84 5.49 0.00 -1.18 -3.85 105.19 110.14 1gxd n GLY 243 Ca -0.04 -1.17 -0.31 0.00 0.00 0.00 0.00 46.02 44.50 1gxd n GLY 243 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gxd s PHE 244 N -4.06 3.34 -0.12 1.61 0.40 -0.86 -3.02 117.98 115.27 1gxd s PHE 244 Ca 0.12 0.16 -0.21 0.00 -0.60 0.00 0.00 56.93 56.40 1gxd s PHE 244 Cb -0.03 -1.69 -0.03 0.00 0.51 0.00 0.00 43.02 41.78 1gxd s PHE 244 CO 0.08 0.55 0.62 0.00 0.70 0.00 0.00 175.22 177.17 1gxd n PRO 246 N 4.10 0.29 0.00 0.00 -0.02 -1.26 -4.51 135.00 133.60 1gxd n PRO 246 Ca -0.03 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1gxd n PRO 246 Cb 0.51 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1gxd n PRO 246 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1gxd n HIS 247 N -3.04 0.00 0.33 6.00 -0.00 -1.26 -2.24 115.22 115.01 1gxd n HIS 247 Ca 0.13 0.00 0.06 0.00 0.46 0.00 0.00 57.72 58.38 1gxd n HIS 247 Cb 0.50 0.00 0.28 0.00 -0.12 0.00 0.00 29.99 30.65 1gxd n HIS 247 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 1gxd n GLU 248 N 0.00 0.04 0.00 1.57 0.00 -1.24 0.74 120.64 121.75 1gxd n GLU 248 Ca 0.00 0.37 0.15 0.00 0.00 0.00 0.00 57.16 57.68 1gxd n GLU 248 Cb 0.00 -1.59 0.74 0.00 0.00 0.00 0.00 31.44 30.58 1gxd n GLU 248 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1gxd n ALA 249 N -1.57 2.63 -0.01 -1.84 0.00 -1.26 -0.88 120.51 117.58 1gxd n ALA 249 Ca 0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 53.44 53.22 1gxd n ALA 249 Cb 0.12 -1.43 -0.01 0.00 0.00 0.00 0.00 19.45 18.14 1gxd n ALA 249 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1gxd n LEU 250 N -1.05 0.22 -3.84 0.00 4.77 0.23 -4.87 117.00 112.46 1gxd n LEU 250 Ca 0.17 0.04 -0.07 0.00 -0.03 0.00 0.00 56.01 56.11 1gxd n LEU 250 Cb 0.23 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1gxd n LEU 250 CO 0.22 0.01 0.51 0.72 -1.33 0.00 0.00 177.39 177.52 1gxd s PHE 251 N -2.05 -0.11 0.20 -1.77 -0.71 -0.27 -4.00 117.98 109.28 1gxd s PHE 251 Ca -0.03 -0.39 0.01 0.00 -1.04 0.00 0.00 56.93 55.48 1gxd s PHE 251 Cb 0.01 0.73 -0.05 0.00 -1.21 0.00 0.00 43.02 42.51 1gxd s PHE 251 CO 0.04 -1.28 0.04 0.95 -1.34 0.00 0.00 175.22 173.63 1gxd s THR 252 N -3.48 0.60 0.23 -4.49 -4.23 0.18 -3.74 115.64 100.71 1gxd s THR 252 Ca 0.12 -1.99 0.07 0.00 -1.18 0.00 0.00 61.69 58.72 1gxd s THR 252 Cb -0.05 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.43 1gxd s THR 252 CO 0.08 -0.29 0.15 -0.32 -0.54 0.00 0.00 174.62 173.70 1gxd s MET 253 N -3.97 2.82 0.38 3.99 1.75 -0.24 -4.28 119.30 119.75 1gxd s MET 253 Ca 0.29 -1.07 0.00 0.00 -1.25 0.00 0.00 55.69 53.67 1gxd s MET 253 Cb 0.07 -2.52 0.00 0.00 2.84 0.00 0.00 34.83 35.22 1gxd s MET 253 CO 0.08 0.42 0.00 0.41 -0.65 0.00 0.00 175.02 175.27 1gxd n GLY 254 N -0.93 0.80 6.57 2.11 0.00 -1.26 -0.16 105.19 112.33 1gxd n GLY 254 Ca -0.08 -0.65 0.01 0.00 0.00 0.00 0.00 46.02 45.30 1gxd n GLY 254 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gxd n GLY 255 N 0.00 -1.38 0.01 -0.02 0.00 -1.26 -4.41 105.19 98.13 1gxd n GLY 255 Ca 0.00 -1.15 0.09 0.00 0.00 0.00 0.00 46.02 44.96 1gxd n GLY 255 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gxd n ASN 256 N -1.72 0.70 0.01 1.61 0.23 -0.44 -4.48 115.26 111.17 1gxd n ASN 256 Ca 0.00 -0.41 0.01 0.00 -0.53 0.00 0.00 54.58 53.65 1gxd n ASN 256 Cb 0.03 1.50 0.03 0.00 -2.08 0.00 0.00 39.78 39.26 1gxd n ASN 256 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1gxd n ALA 257 N -1.86 0.50 -3.03 -2.53 0.00 0.30 -4.78 120.51 109.12 1gxd n ALA 257 Ca -0.00 0.01 -0.23 0.00 0.00 0.00 0.00 53.44 53.22 1gxd n ALA 257 Cb 0.41 -0.51 0.04 0.00 0.00 0.00 0.00 19.45 19.39 1gxd n ALA 257 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1gxd n GLU 258 N -1.32 -5.00 0.00 0.00 1.02 -1.26 -2.84 120.64 111.24 1gxd n GLU 258 Ca -0.00 0.92 0.00 0.00 -0.02 0.00 0.00 57.16 58.06 1gxd n GLU 258 Cb 0.26 -5.79 0.00 0.00 -0.02 0.00 0.00 31.44 25.89 1gxd n GLU 258 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gxd n GLY 259 N -1.54 2.66 3.36 0.62 0.00 -1.26 -5.06 105.19 103.97 1gxd n GLY 259 Ca -0.11 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 1gxd n GLY 259 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1gxd n GLN 260 N 0.00 0.26 -1.74 1.61 1.13 -1.13 -0.65 117.38 116.86 1gxd n GLN 260 Ca 0.00 0.10 -0.31 0.00 -1.94 0.00 0.00 57.00 54.85 1gxd n GLN 260 Cb 0.00 -1.33 0.03 0.00 0.11 0.00 0.00 30.24 29.04 1gxd n GLN 260 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 1gxd s PRO 261 N -1.50 3.28 0.67 -1.09 0.02 -1.26 -3.33 135.00 131.80 1gxd s PRO 261 Ca 0.63 0.87 -0.16 0.00 0.02 0.00 0.00 61.00 62.35 1gxd s PRO 261 Cb -0.49 -2.04 0.01 0.00 0.02 0.00 0.00 34.50 32.00 1gxd s PRO 261 CO 0.60 -0.82 1.18 0.00 -0.33 0.00 0.00 177.00 177.63 1gxd s LYS 263 N -3.80 3.85 -0.13 0.00 2.47 -1.23 -4.88 119.74 116.02 1gxd s LYS 263 Ca 0.73 -0.38 0.02 0.00 -1.56 0.00 0.00 55.97 54.78 1gxd s LYS 263 Cb -0.27 -3.51 0.01 0.00 -1.46 0.00 0.00 37.83 32.60 1gxd s LYS 263 CO 0.41 -0.15 -0.18 -0.06 0.16 0.00 0.00 175.35 175.52 1gxd s PHE 264 N 1.62 2.33 0.45 4.03 0.08 -1.26 -2.24 117.98 122.98 1gxd s PHE 264 Ca 0.07 -1.19 -0.05 0.00 0.12 0.00 0.00 56.93 55.88 1gxd s PHE 264 Cb -0.15 -1.64 -0.04 0.00 -0.57 0.00 0.00 43.02 40.62 1gxd s PHE 264 CO 0.08 -0.59 0.74 -2.14 -0.10 0.00 0.00 175.22 173.21 1gxd s PRO 265 N 1.03 3.57 0.08 0.24 0.02 -1.26 -5.07 135.00 133.62 1gxd s PRO 265 Ca -0.04 0.16 0.10 0.00 0.02 0.00 0.00 61.00 61.24 1gxd s PRO 265 Cb -0.15 -2.42 -0.03 0.00 0.02 0.00 0.00 34.50 31.92 1gxd s PRO 265 CO -0.04 -0.12 -0.26 -0.59 -0.33 0.00 0.00 177.00 175.66 1gxd s PHE 266 N -2.61 2.24 -0.21 6.54 -0.71 0.32 -4.70 117.98 118.85 1gxd s PHE 266 Ca 0.47 -0.40 -0.08 0.00 -1.04 0.00 0.00 56.93 55.88 1gxd s PHE 266 Cb -0.10 -1.28 -0.04 0.00 -1.21 0.00 0.00 43.02 40.38 1gxd s PHE 266 CO 0.41 0.21 0.08 0.50 -1.34 0.00 0.00 175.22 175.09 1gxd s ARG 267 N -1.60 3.94 0.00 1.99 3.52 -0.20 0.63 118.95 127.23 1gxd s ARG 267 Ca 0.12 -0.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.36 1gxd s ARG 267 Cb -0.10 -3.30 0.00 0.00 -1.56 0.00 0.00 34.95 29.99 1gxd s ARG 267 CO 0.04 0.15 0.00 0.34 -0.81 0.00 0.00 175.30 175.01 1gxd n PHE 268 N 3.93 0.00 0.00 5.12 7.35 0.08 -0.95 117.46 132.99 1gxd n PHE 268 Ca -0.16 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.53 1gxd n PHE 268 Cb 0.52 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.35 1gxd n PHE 268 CO 0.00 0.00 0.00 1.04 -0.76 0.00 0.00 176.76 177.04 1gxd n GLN 269 N 0.00 0.00 -0.67 -4.13 1.13 -1.26 -4.44 117.38 108.02 1gxd n GLN 269 Ca 0.00 0.00 0.08 0.00 -1.94 0.00 0.00 57.00 55.14 1gxd n GLN 269 Cb 0.00 -0.06 0.33 0.00 0.11 0.00 0.00 30.24 30.62 1gxd n GLN 269 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1gxd n GLY 270 N 2.42 3.50 3.15 1.08 0.00 -1.26 -4.99 105.19 109.10 1gxd n GLY 270 Ca 0.00 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 1gxd n GLY 270 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gxd s THR 271 N -2.76 0.03 -0.24 2.61 2.01 -1.26 -5.14 115.64 110.89 1gxd s THR 271 Ca 0.48 -0.25 -0.09 0.00 0.31 0.00 0.00 61.69 62.14 1gxd s THR 271 Cb 0.38 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 72.42 1gxd s THR 271 CO 0.13 -0.14 0.12 -0.44 -0.69 0.00 0.00 174.62 173.60 1gxd s SER 272 N -0.50 5.74 0.08 3.53 0.01 -1.26 -0.74 113.70 120.55 1gxd s SER 272 Ca -0.06 0.00 -0.04 0.00 1.31 0.00 0.00 55.95 57.16 1gxd s SER 272 Cb -0.04 -2.03 -0.05 0.00 0.21 0.00 0.00 66.02 64.12 1gxd s SER 272 CO 0.01 0.05 0.29 -0.31 0.41 0.00 0.00 173.24 173.69 1gxd s TYR 273 N 1.16 3.52 -0.10 2.43 1.51 0.21 -4.86 117.35 121.22 1gxd s TYR 273 Ca 0.06 0.46 0.08 0.00 -1.01 0.00 0.00 57.07 56.66 1gxd s TYR 273 Cb -0.14 -1.92 0.14 0.00 -0.11 0.00 0.00 41.96 39.93 1gxd s TYR 273 CO 0.05 0.54 1.08 -3.47 -1.11 0.00 0.00 175.55 172.64 1gxd n ASP 274 N 0.45 2.24 -3.68 2.29 2.03 -1.26 -0.52 116.55 118.11 1gxd n ASP 274 Ca -0.06 -2.45 -0.01 0.00 0.52 0.00 0.00 54.79 52.79 1gxd n ASP 274 Cb 0.52 -0.19 -0.01 0.00 -0.72 0.00 0.00 41.12 40.72 1gxd n ASP 274 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1gxd s SER 275 N -1.75 -0.11 0.08 1.67 1.04 -1.26 -4.94 113.70 108.43 1gxd s SER 275 Ca 0.15 -0.26 -0.31 0.00 0.48 0.00 0.00 55.95 56.01 1gxd s SER 275 Cb 0.12 0.31 -0.07 0.00 0.10 0.00 0.00 66.02 66.48 1gxd s SER 275 CO 0.02 -0.57 1.43 0.00 0.98 0.00 0.00 173.24 175.10 1gxd s THR 277 N 1.65 1.88 -2.35 0.00 -1.32 0.05 -4.70 115.64 110.84 1gxd s THR 277 Ca 0.66 -2.07 0.28 0.00 -1.21 0.00 0.00 61.69 59.35 1gxd s THR 277 Cb -0.36 -1.96 0.57 0.00 -1.51 0.00 0.00 72.50 69.24 1gxd s THR 277 CO 0.29 -0.41 1.79 0.35 -2.21 0.00 0.00 174.62 174.44 1gxd n THR 278 N -0.02 0.00 -1.32 5.08 -2.24 -1.26 -2.31 114.28 112.21 1gxd n THR 278 Ca -0.11 -0.20 -0.52 0.00 -2.27 0.00 0.00 64.05 60.95 1gxd n THR 278 Cb 0.58 0.35 -0.07 0.00 -2.10 0.00 0.00 70.33 69.09 1gxd n THR 278 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1gxd n GLU 279 N -0.07 0.00 -0.73 -0.78 4.07 -1.26 -0.43 120.64 121.44 1gxd n GLU 279 Ca 0.19 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.29 1gxd n GLU 279 Cb 0.32 -1.30 0.00 0.00 -0.06 0.00 0.00 31.44 30.40 1gxd n GLU 279 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1gxd n GLY 280 N 1.46 0.67 3.31 8.31 0.00 -1.26 -5.04 105.19 112.64 1gxd n GLY 280 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 1gxd n GLY 280 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gxd s ARG 281 N -0.27 1.23 -0.09 1.61 0.52 0.43 -5.03 118.95 117.34 1gxd s ARG 281 Ca 0.00 -1.42 0.10 0.00 -0.52 0.00 0.00 55.73 53.89 1gxd s ARG 281 Cb 0.00 -1.17 -0.13 0.00 0.52 0.00 0.00 34.95 34.16 1gxd s ARG 281 CO 0.00 0.22 0.06 0.25 0.02 0.00 0.00 175.30 175.85 1gxd n THR 282 N 0.17 0.64 0.38 0.02 -2.24 -1.26 -4.58 114.28 107.40 1gxd n THR 282 Ca -0.12 -0.42 0.06 0.00 -2.27 0.00 0.00 64.05 61.29 1gxd n THR 282 Cb 0.58 -0.61 0.24 0.00 -2.10 0.00 0.00 70.33 68.44 1gxd n THR 282 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1gxd n ASP 283 N -2.33 0.02 0.00 3.42 5.68 -1.26 -4.88 116.55 117.20 1gxd n ASP 283 Ca -0.15 0.51 0.00 0.00 -0.50 0.00 0.00 54.79 54.64 1gxd n ASP 283 Cb 0.78 -0.51 0.00 0.00 -1.14 0.00 0.00 41.12 40.25 1gxd n ASP 283 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gxd n GLY 284 N -0.36 2.54 3.64 6.12 0.00 -1.26 -4.87 105.19 111.00 1gxd n GLY 284 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1gxd n GLY 284 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gxd s TYR 285 N -2.85 2.47 0.60 1.61 2.02 -1.26 -4.51 117.35 115.43 1gxd s TYR 285 Ca 0.00 0.73 -0.20 0.00 -0.37 0.00 0.00 57.07 57.24 1gxd s TYR 285 Cb 0.00 -3.84 -0.03 0.00 -0.40 0.00 0.00 41.96 37.69 1gxd s TYR 285 CO 0.00 -2.30 1.29 0.54 -1.57 0.00 0.00 175.55 173.51 1gxd n ARG 286 N 7.24 1.33 -4.10 -0.62 1.74 -1.26 -4.70 116.66 116.29 1gxd n ARG 286 Ca 0.16 0.50 -0.15 0.00 -0.77 0.00 0.00 57.85 57.59 1gxd n ARG 286 Cb 0.45 -2.52 -0.04 0.00 -1.02 0.00 0.00 32.46 29.33 1gxd n ARG 286 CO 0.00 0.00 0.00 1.67 -1.52 0.00 0.00 177.63 177.78 1gxd s TRP 287 N -1.35 1.14 0.16 -1.55 1.48 -0.98 -2.42 118.94 115.42 1gxd s TRP 287 Ca 0.78 -1.34 -0.24 0.00 -1.06 0.00 0.00 56.10 54.23 1gxd s TRP 287 Cb -0.40 -0.12 0.06 0.00 -1.16 0.00 0.00 33.47 31.85 1gxd s TRP 287 CO 0.44 -1.14 0.82 0.00 -4.06 0.00 0.00 176.95 173.01 1gxd n GLY 289 N -0.41 -2.46 0.00 0.00 0.00 -1.26 -3.19 105.19 97.87 1gxd n GLY 289 Ca -0.08 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1gxd n GLY 289 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1gxd n THR 290 N -4.42 0.00 -4.53 2.61 5.66 -0.86 -3.48 114.28 109.27 1gxd n THR 290 Ca 0.14 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.88 1gxd n THR 290 Cb 0.53 1.55 -0.08 0.00 -1.55 0.00 0.00 70.33 70.78 1gxd n THR 290 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1gxd s THR 291 N 0.00 0.56 -0.23 1.09 -1.32 -1.26 -4.30 115.64 110.17 1gxd s THR 291 Ca 0.00 -2.00 0.18 0.00 -1.21 0.00 0.00 61.69 58.66 1gxd s THR 291 Cb 0.00 -2.30 0.11 0.00 -1.51 0.00 0.00 72.50 68.80 1gxd s THR 291 CO 0.00 0.00 1.40 1.05 -2.21 0.00 0.00 174.62 174.86 1gxd h GLU 292 N 1.74 0.00 -3.41 7.08 4.11 -1.90 -3.41 114.58 118.80 1gxd h GLU 292 Ca -0.35 0.00 -0.60 0.00 0.07 0.00 0.00 59.36 58.48 1gxd h GLU 292 Cb 1.28 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.13 1gxd h GLU 292 CO 0.55 0.32 -0.74 0.34 0.07 0.00 0.00 179.01 179.55 1gxd s ASP 293 N -6.26 3.94 0.32 3.06 -1.08 -1.26 -1.03 116.67 114.36 1gxd s ASP 293 Ca 0.04 -2.17 0.04 0.00 -0.52 0.00 0.00 52.55 49.94 1gxd s ASP 293 Cb 0.07 -1.03 0.63 0.00 -1.46 0.00 0.00 42.92 41.13 1gxd s ASP 293 CO 0.73 -0.34 1.88 0.22 0.52 0.00 0.00 175.17 178.19 1gxd h TYR 294 N 7.39 0.99 -0.62 -5.34 3.20 -1.29 -2.04 116.97 119.26 1gxd h TYR 294 Ca -0.07 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.79 1gxd h TYR 294 Cb 0.97 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.90 1gxd h TYR 294 CO 0.43 0.44 0.23 -0.44 -1.64 0.00 0.00 178.16 177.18 1gxd h ASP 295 N 0.90 0.84 -0.00 -2.11 3.32 -1.77 0.20 116.42 117.80 1gxd h ASP 295 Ca 0.43 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.31 1gxd h ASP 295 Cb 0.43 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1gxd h ASP 295 CO -0.19 0.77 -0.17 -0.09 -1.72 0.00 0.00 179.24 177.83 1gxd h ARG 296 N 0.90 0.12 0.00 3.56 2.43 -1.72 -3.37 114.38 116.30 1gxd h ARG 296 Ca 0.21 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1gxd h ARG 296 Cb 0.20 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1gxd h ARG 296 CO -0.02 0.87 -0.96 -0.25 -1.51 0.00 0.00 179.97 178.10 1gxd n ASP 297 N -4.57 0.85 -4.27 -3.80 8.00 -0.96 -5.00 116.55 106.81 1gxd n ASP 297 Ca -0.10 -0.85 -0.37 0.00 0.71 0.00 0.00 54.79 54.18 1gxd n ASP 297 Cb 0.46 1.08 -0.04 0.00 -0.02 0.00 0.00 41.12 42.61 1gxd n ASP 297 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1gxd n LYS 298 N -1.50 -2.74 -3.97 -1.24 5.02 0.70 -4.94 118.16 109.49 1gxd n LYS 298 Ca 0.03 0.33 -0.35 0.00 -2.02 0.00 0.00 58.31 56.30 1gxd n LYS 298 Cb 0.31 -5.04 -0.12 0.00 -0.02 0.00 0.00 35.03 30.16 1gxd n LYS 298 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1gxd s LYS 299 N -6.97 3.76 0.18 1.97 3.01 -1.26 -4.95 119.74 115.47 1gxd s LYS 299 Ca 0.76 -0.44 -0.13 0.00 -1.01 0.00 0.00 55.97 55.15 1gxd s LYS 299 Cb -0.42 -3.21 0.01 0.00 -1.01 0.00 0.00 37.83 33.20 1gxd s LYS 299 CO 0.94 0.04 0.40 1.52 0.51 0.00 0.00 175.35 178.76 1gxd s TYR 300 N 0.97 0.12 0.22 3.18 1.13 -1.26 -2.04 117.35 119.67 1gxd s TYR 300 Ca 0.03 -0.48 -0.06 0.00 -1.41 0.00 0.00 57.07 55.16 1gxd s TYR 300 Cb -0.14 0.17 -0.03 0.00 -1.10 0.00 0.00 41.96 40.87 1gxd s TYR 300 CO 0.03 -0.81 0.27 0.20 -2.51 0.00 0.00 175.55 172.73 1gxd s GLY 301 N -2.91 1.07 0.33 5.49 0.00 -1.19 -0.53 107.32 109.57 1gxd s GLY 301 Ca 0.12 -1.36 0.07 0.00 0.00 0.00 0.00 44.72 43.55 1gxd s GLY 301 CO -0.02 -1.09 0.31 -1.36 0.00 0.00 0.00 173.10 170.94 1gxd s PHE 302 N -4.10 2.93 -0.58 1.90 0.40 0.78 -2.60 117.98 116.70 1gxd s PHE 302 Ca 0.32 -0.29 0.06 0.00 -0.60 0.00 0.00 56.93 56.42 1gxd s PHE 302 Cb 0.04 -1.80 0.21 0.00 0.51 0.00 0.00 43.02 41.98 1gxd s PHE 302 CO 0.11 0.18 0.57 0.00 0.70 0.00 0.00 175.22 176.78 1gxd h PRO 304 N 4.72 0.62 -3.36 0.00 0.11 -1.95 -3.43 132.00 128.71 1gxd h PRO 304 Ca 0.17 -0.04 -0.16 0.00 0.11 0.00 0.00 66.00 66.08 1gxd h PRO 304 Cb 0.76 -0.14 -0.23 0.00 0.11 0.00 0.00 31.00 31.50 1gxd h PRO 304 CO 0.67 0.41 -0.48 -2.00 -0.21 0.00 0.00 178.00 176.39 1gxd s GLU 305 N -6.09 0.36 -0.29 1.05 2.12 -1.26 -4.35 118.70 110.23 1gxd s GLU 305 Ca -0.13 -0.04 0.03 0.00 0.36 0.00 0.00 54.97 55.19 1gxd s GLU 305 Cb 0.16 0.16 0.08 0.00 0.26 0.00 0.00 34.13 34.79 1gxd s GLU 305 CO 0.76 -0.07 -0.04 -0.08 -0.54 0.00 0.00 175.26 175.28 1gxd s THR 306 N -0.61 2.25 0.19 -1.70 -1.32 0.01 -4.03 115.64 110.42 1gxd s THR 306 Ca -0.07 -1.90 -0.30 0.00 -1.21 0.00 0.00 61.69 58.21 1gxd s THR 306 Cb -0.04 -2.46 -0.09 0.00 -1.51 0.00 0.00 72.50 68.41 1gxd s THR 306 CO 0.01 -0.25 1.30 0.00 -2.21 0.00 0.00 174.62 173.47 1gxd s ALA 307 N 1.03 3.52 -0.03 11.08 0.00 -0.95 -4.70 121.76 131.71 1gxd s ALA 307 Ca -0.01 1.09 0.03 0.00 0.00 0.00 0.00 51.96 53.07 1gxd s ALA 307 Cb -0.20 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1gxd s ALA 307 CO -0.06 -0.53 -0.11 -1.64 0.00 0.00 0.00 175.76 173.43 1gxd s MET 308 N -0.05 1.14 -0.18 0.00 -1.94 -1.26 -4.90 119.30 112.11 1gxd s MET 308 Ca 0.57 -0.37 -0.12 0.00 -1.71 0.00 0.00 55.69 54.06 1gxd s MET 308 Cb -0.36 -1.04 -0.22 0.00 2.01 0.00 0.00 34.83 35.22 1gxd s MET 308 CO 0.38 0.14 0.21 0.43 -0.01 0.00 0.00 175.02 176.16 1gxd n SER 309 N 3.28 2.01 -4.57 3.03 7.64 -1.10 -4.78 113.62 119.13 1gxd n SER 309 Ca -0.18 0.27 -0.24 0.00 1.01 0.00 0.00 58.87 59.73 1gxd n SER 309 Cb 0.54 -0.87 -0.09 0.00 -1.01 0.00 0.00 64.21 62.79 1gxd n SER 309 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1gxd s THR 310 N -2.48 3.03 0.09 0.44 2.01 -0.54 -4.53 115.64 113.67 1gxd s THR 310 Ca -0.27 -2.09 0.05 0.00 0.31 0.00 0.00 61.69 59.69 1gxd s THR 310 Cb 0.07 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.95 1gxd s THR 310 CO 0.67 -0.36 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.42 1gxd s VAL 311 N -2.33 1.10 0.00 3.82 1.01 -0.60 -4.20 120.40 119.19 1gxd s VAL 311 Ca 0.30 -1.50 0.00 0.00 0.00 0.00 0.00 61.98 60.79 1gxd s VAL 311 Cb -0.06 -1.25 0.00 0.00 0.00 0.00 0.00 36.38 35.07 1gxd s VAL 311 CO 0.17 -0.37 0.00 0.61 0.00 0.00 0.00 175.10 175.51 1gxd n GLY 312 N 0.89 0.96 7.00 4.51 0.00 -1.26 -0.44 105.19 116.85 1gxd n GLY 312 Ca -0.18 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1gxd n GLY 312 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gxd n GLY 313 N 0.00 -0.19 0.15 -0.02 0.00 -1.26 -4.40 105.19 99.47 1gxd n GLY 313 Ca 0.00 -1.02 0.04 0.00 0.00 0.00 0.00 46.02 45.04 1gxd n GLY 313 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gxd n ASN 314 N -0.80 1.31 -1.03 1.61 2.04 -0.83 -4.78 115.26 112.79 1gxd n ASN 314 Ca 0.00 -2.22 0.04 0.00 -0.44 0.00 0.00 54.58 51.95 1gxd n ASN 314 Cb 0.00 -0.20 0.24 0.00 -2.53 0.00 0.00 39.78 37.29 1gxd n ASN 314 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62 1gxd n SER 315 N -0.63 3.51 -2.79 0.53 7.64 -1.13 -4.83 113.62 115.92 1gxd n SER 315 Ca 0.06 -3.25 -0.08 0.00 1.01 0.00 0.00 58.87 56.61 1gxd n SER 315 Cb 0.54 -0.58 -0.01 0.00 -1.01 0.00 0.00 64.21 63.14 1gxd n SER 315 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1gxd n GLU 316 N -0.70 -2.65 0.00 1.43 1.02 -1.26 -0.35 120.64 118.13 1gxd n GLU 316 Ca 0.26 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.50 1gxd n GLU 316 Cb 0.97 -4.63 0.00 0.00 -0.02 0.00 0.00 31.44 27.76 1gxd n GLU 316 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gxd n GLY 317 N -0.63 1.54 3.39 0.62 0.00 -1.26 -5.01 105.19 103.85 1gxd n GLY 317 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1gxd n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gxd n ALA 318 N -1.63 -2.52 -1.42 4.61 0.00 0.53 -1.46 120.51 118.62 1gxd n ALA 318 Ca 0.00 0.30 -0.31 0.00 0.00 0.00 0.00 53.44 53.43 1gxd n ALA 318 Cb 0.00 -1.62 0.07 0.00 0.00 0.00 0.00 19.45 17.90 1gxd n ALA 318 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1gxd s PRO 319 N -1.12 2.60 0.91 0.00 0.02 -1.26 -3.72 135.00 132.42 1gxd s PRO 319 Ca 0.62 1.05 -0.11 0.00 0.02 0.00 0.00 61.00 62.58 1gxd s PRO 319 Cb -0.78 -1.94 0.14 0.00 0.02 0.00 0.00 34.50 31.94 1gxd s PRO 319 CO 0.59 -1.37 1.12 0.00 -0.33 0.00 0.00 177.00 177.01 1gxd s VAL 321 N -2.72 0.10 0.09 0.00 1.01 -0.61 -4.95 120.40 113.33 1gxd s VAL 321 Ca 0.65 -0.03 0.08 0.00 0.00 0.00 0.00 61.98 62.69 1gxd s VAL 321 Cb -0.21 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 1gxd s VAL 321 CO 0.58 -0.05 -0.18 -0.36 0.00 0.00 0.00 175.10 175.09 1gxd s PHE 322 N 2.07 2.55 0.54 5.22 0.08 -1.26 -3.54 117.98 123.63 1gxd s PHE 322 Ca 0.03 -0.26 -0.11 0.00 0.12 0.00 0.00 56.93 56.71 1gxd s PHE 322 Cb -0.14 -1.38 -0.05 0.00 -0.57 0.00 0.00 43.02 40.87 1gxd s PHE 322 CO -0.07 0.35 0.94 -1.25 -0.10 0.00 0.00 175.22 175.09 1gxd s PRO 323 N -1.94 3.69 0.04 0.24 0.04 -1.26 -5.07 135.00 130.73 1gxd s PRO 323 Ca 0.17 0.65 0.05 0.00 0.04 0.00 0.00 61.00 61.90 1gxd s PRO 323 Cb -0.11 -2.19 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 1gxd s PRO 323 CO 0.09 -0.36 -0.13 -0.59 0.04 0.00 0.00 177.00 176.04 1gxd s PHE 324 N -2.86 1.18 -0.15 0.56 -0.12 -0.13 -4.66 117.98 111.79 1gxd s PHE 324 Ca 0.54 -0.35 -0.07 0.00 -0.05 0.00 0.00 56.93 57.00 1gxd s PHE 324 Cb -0.11 -0.70 -0.04 0.00 -0.63 0.00 0.00 43.02 41.54 1gxd s PHE 324 CO 0.44 0.03 0.09 0.95 -0.05 0.00 0.00 175.22 176.67 1gxd s THR 325 N -0.82 5.03 -0.09 -4.49 -4.23 0.47 0.14 115.64 111.65 1gxd s THR 325 Ca 0.01 0.04 -0.01 0.00 -1.18 0.00 0.00 61.69 60.56 1gxd s THR 325 Cb -0.08 -3.23 0.03 0.00 1.34 0.00 0.00 72.50 70.56 1gxd s THR 325 CO 0.01 0.53 -0.04 0.12 -0.54 0.00 0.00 174.62 174.70 1gxd s PHE 326 N -0.27 1.03 -1.59 3.99 5.36 0.45 -0.84 117.98 126.12 1gxd s PHE 326 Ca 0.09 -0.41 0.00 0.00 -0.96 0.00 0.00 56.93 55.65 1gxd s PHE 326 Cb -0.12 -0.97 0.00 0.00 -0.34 0.00 0.00 43.02 41.59 1gxd s PHE 326 CO 0.01 -0.39 0.00 1.28 -1.46 0.00 0.00 175.22 174.67 1gxd n LEU 327 N 4.90 -1.53 0.00 6.12 4.77 -1.26 -2.72 117.00 127.28 1gxd n LEU 327 Ca -0.12 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1gxd n LEU 327 Cb 0.50 -2.59 0.00 0.00 -2.33 0.00 0.00 43.42 39.00 1gxd n LEU 327 CO 0.15 -0.38 0.00 0.61 -1.33 0.00 0.00 177.39 176.44 1gxd n GLY 328 N -0.77 0.81 3.27 -0.72 0.00 -1.26 -5.08 105.19 101.44 1gxd n GLY 328 Ca -0.20 -0.11 -0.19 0.00 0.00 0.00 0.00 46.02 45.53 1gxd n GLY 328 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gxd s ASN 329 N -2.10 2.19 0.02 1.61 0.01 -1.10 -5.12 114.94 110.45 1gxd s ASN 329 Ca 0.00 -0.84 -0.05 0.00 -0.71 0.00 0.00 52.86 51.26 1gxd s ASN 329 Cb 0.00 -0.09 -0.05 0.00 0.41 0.00 0.00 41.25 41.52 1gxd s ASN 329 CO 0.00 -0.12 0.24 -1.59 -1.51 0.00 0.00 177.10 174.12 1gxd s LYS 330 N -2.78 3.53 -0.03 -0.60 -2.85 -1.26 -0.41 119.74 115.33 1gxd s LYS 330 Ca 0.11 -0.18 0.05 0.00 -1.00 0.00 0.00 55.97 54.96 1gxd s LYS 330 Cb -0.05 -3.06 -0.01 0.00 -2.06 0.00 0.00 37.83 32.65 1gxd s LYS 330 CO 0.04 0.64 -0.18 0.71 0.10 0.00 0.00 175.35 176.66 1gxd s TYR 331 N -1.35 1.74 -1.18 1.78 1.51 0.36 -4.92 117.35 115.30 1gxd s TYR 331 Ca 0.29 -0.43 0.16 0.00 -1.01 0.00 0.00 57.07 56.08 1gxd s TYR 331 Cb -0.13 -1.15 -0.08 0.00 -0.11 0.00 0.00 41.96 40.49 1gxd s TYR 331 CO 0.18 -0.11 0.79 -0.85 -1.11 0.00 0.00 175.55 174.45 1gxd n GLU 332 N 2.92 1.66 -3.78 -0.62 0.00 -1.26 -0.96 120.64 118.60 1gxd n GLU 332 Ca -0.17 -0.45 -0.13 0.00 0.00 0.00 0.00 57.16 56.42 1gxd n GLU 332 Cb 0.53 -1.28 -0.09 0.00 0.00 0.00 0.00 31.44 30.60 1gxd n GLU 332 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 1gxd s SER 333 N -2.22 -0.16 0.24 -1.84 0.01 -1.26 -4.91 113.70 103.56 1gxd s SER 333 Ca 0.10 0.07 -0.28 0.00 1.31 0.00 0.00 55.95 57.15 1gxd s SER 333 Cb 0.13 0.32 -0.16 0.00 0.21 0.00 0.00 66.02 66.52 1gxd s SER 333 CO 0.53 -0.40 0.72 0.00 0.41 0.00 0.00 173.24 174.50 1gxd s THR 335 N -1.03 0.33 -1.22 0.00 -1.32 0.62 -4.80 115.64 108.22 1gxd s THR 335 Ca 0.62 -2.00 0.11 0.00 -1.21 0.00 0.00 61.69 59.21 1gxd s THR 335 Cb -0.83 -2.42 0.04 0.00 -1.51 0.00 0.00 72.50 67.78 1gxd s THR 335 CO 0.58 0.00 0.76 -1.54 -2.21 0.00 0.00 174.62 172.21 1gxd n SER 336 N -1.33 1.61 -4.17 8.08 3.41 -1.26 0.22 113.62 120.17 1gxd n SER 336 Ca -0.00 -1.30 -0.55 0.00 -0.26 0.00 0.00 58.87 56.75 1gxd n SER 336 Cb 0.64 0.24 -0.08 0.00 -0.26 0.00 0.00 64.21 64.75 1gxd n SER 336 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gxd n ALA 337 N 0.20 -3.22 0.00 7.33 0.00 -1.26 0.68 120.51 124.24 1gxd n ALA 337 Ca 0.06 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1gxd n ALA 337 Cb 0.26 -1.64 0.00 0.00 0.00 0.00 0.00 19.45 18.07 1gxd n ALA 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gxd n GLY 338 N 1.60 2.34 3.82 0.00 0.00 -1.20 -5.00 105.19 106.74 1gxd n GLY 338 Ca 0.19 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1gxd n GLY 338 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gxd s ARG 339 N 0.00 4.27 -0.01 1.61 0.52 0.21 -2.36 118.95 123.20 1gxd s ARG 339 Ca 0.00 0.98 0.22 0.00 -0.52 0.00 0.00 55.73 56.41 1gxd s ARG 339 Cb 0.00 -2.62 0.64 0.00 0.52 0.00 0.00 34.95 33.49 1gxd s ARG 339 CO 0.00 0.23 1.54 -1.13 0.02 0.00 0.00 175.30 175.96 1gxd n SER 340 N 0.17 3.98 -0.41 0.23 3.41 -1.26 -4.51 113.62 115.23 1gxd n SER 340 Ca 0.02 -2.03 0.05 0.00 -0.26 0.00 0.00 58.87 56.65 1gxd n SER 340 Cb 0.52 -0.49 0.08 0.00 -0.26 0.00 0.00 64.21 64.06 1gxd n SER 340 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1gxd n ASP 341 N 1.57 1.24 0.00 4.04 5.68 -1.26 -4.99 116.55 122.83 1gxd n ASP 341 Ca 0.24 -2.64 0.00 0.00 -0.50 0.00 0.00 54.79 51.90 1gxd n ASP 341 Cb 0.63 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 40.28 1gxd n ASP 341 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gxd n GLY 342 N -0.68 0.74 3.63 6.12 0.00 -1.26 -4.95 105.19 108.80 1gxd n GLY 342 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1gxd n GLY 342 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gxd s LYS 343 N -0.37 3.84 0.01 1.61 1.02 -1.26 -4.85 119.74 119.74 1gxd s LYS 343 Ca 0.00 1.74 -0.30 0.00 0.02 0.00 0.00 55.97 57.43 1gxd s LYS 343 Cb 0.00 -4.03 -0.07 0.00 -0.52 0.00 0.00 37.83 33.21 1gxd s LYS 343 CO 0.00 -1.24 1.66 -1.64 -0.92 0.00 0.00 175.35 173.21 1gxd s MET 344 N 4.61 4.19 0.11 1.68 -1.94 -1.26 -4.47 119.30 122.21 1gxd s MET 344 Ca 0.72 2.27 0.08 0.00 -1.71 0.00 0.00 55.69 57.04 1gxd s MET 344 Cb -0.26 -3.80 -0.03 0.00 2.01 0.00 0.00 34.83 32.75 1gxd s MET 344 CO 0.29 -0.78 -0.19 1.67 -0.01 0.00 0.00 175.02 176.00 1gxd s TRP 345 N 3.33 1.68 0.40 -0.03 1.48 0.59 -1.90 118.94 124.50 1gxd s TRP 345 Ca 0.74 -0.44 0.03 0.00 -1.06 0.00 0.00 56.10 55.38 1gxd s TRP 345 Cb -0.37 -0.91 -0.04 0.00 -1.16 0.00 0.00 33.47 30.99 1gxd s TRP 345 CO 0.31 0.19 0.09 0.00 -4.06 0.00 0.00 176.95 173.48 1gxd s ALA 347 N -3.18 2.99 -2.01 0.00 0.00 -1.26 -2.32 121.76 115.98 1gxd s ALA 347 Ca 0.26 -1.37 0.21 0.00 0.00 0.00 0.00 51.96 51.06 1gxd s ALA 347 Cb 0.05 -0.84 0.60 0.00 0.00 0.00 0.00 23.12 22.92 1gxd s ALA 347 CO 0.13 0.54 1.50 0.25 0.00 0.00 0.00 175.76 178.18 1gxd n THR 348 N 0.27 0.89 -4.10 0.00 -2.24 -0.89 -1.57 114.28 106.64 1gxd n THR 348 Ca -0.12 -0.90 -0.13 0.00 -2.27 0.00 0.00 64.05 60.63 1gxd n THR 348 Cb 0.54 0.47 -0.06 0.00 -2.10 0.00 0.00 70.33 69.18 1gxd n THR 348 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1gxd s THR 349 N -1.11 0.00 -0.40 4.28 -4.23 -1.26 -4.80 115.64 108.13 1gxd s THR 349 Ca 0.45 -1.66 0.27 0.00 -1.18 0.00 0.00 61.69 59.57 1gxd s THR 349 Cb 0.24 -2.49 0.30 0.00 1.34 0.00 0.00 72.50 71.89 1gxd s THR 349 CO 0.31 0.00 1.78 0.00 -0.54 0.00 0.00 174.62 176.17 1gxd h ALA 350 N 2.25 1.00 -3.28 3.99 0.00 -1.86 -3.42 119.26 117.94 1gxd h ALA 350 Ca -0.29 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.08 1gxd h ALA 350 Cb 1.24 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.64 1gxd h ALA 350 CO 0.40 0.00 -0.77 1.21 0.00 0.00 0.00 179.25 180.10 1gxd s ASN 351 N -4.92 3.21 0.14 0.00 3.84 -1.26 -0.40 114.94 115.56 1gxd s ASN 351 Ca 0.05 -1.00 -0.11 0.00 0.21 0.00 0.00 52.86 52.01 1gxd s ASN 351 Cb 0.09 -0.70 -0.03 0.00 -0.55 0.00 0.00 41.25 40.06 1gxd s ASN 351 CO 0.51 -0.32 1.49 0.22 -2.79 0.00 0.00 177.10 176.22 1gxd h TYR 352 N 8.19 1.08 -0.58 0.43 3.20 -1.24 -2.40 116.97 125.65 1gxd h TYR 352 Ca -0.16 -0.30 0.07 0.00 3.14 0.00 0.00 58.73 61.48 1gxd h TYR 352 Cb 1.10 -0.24 -0.06 0.00 1.54 0.00 0.00 36.73 39.07 1gxd h TYR 352 CO 0.32 1.11 0.25 -0.44 -1.64 0.00 0.00 178.16 177.77 1gxd h ASP 353 N 0.74 0.31 0.08 -2.11 3.32 -1.95 0.39 116.42 117.20 1gxd h ASP 353 Ca 0.08 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1gxd h ASP 353 Cb 0.88 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1gxd h ASP 353 CO 0.08 0.20 -0.04 0.44 -1.72 0.00 0.00 179.24 178.20 1gxd h ASP 354 N 0.47 -0.09 0.46 6.45 3.32 -1.92 -3.39 116.42 121.72 1gxd h ASP 354 Ca 0.28 -0.49 -0.30 0.00 0.02 0.00 0.00 57.03 56.54 1gxd h ASP 354 Cb 0.28 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1gxd h ASP 354 CO -0.24 0.58 -1.56 0.44 -1.72 0.00 0.00 179.24 176.74 1gxd h ASP 355 N -0.91 0.32 -5.56 6.45 3.32 -1.41 -3.48 116.42 115.15 1gxd h ASP 355 Ca -0.01 -0.48 -0.31 0.00 0.02 0.00 0.00 57.03 56.25 1gxd h ASP 355 Cb 0.57 -0.10 0.17 0.00 0.22 0.00 0.00 39.33 40.19 1gxd h ASP 355 CO 0.02 1.40 -0.77 0.54 -1.72 0.00 0.00 179.24 178.71 1gxd n ARG 356 N -3.40 -5.92 -4.95 3.56 5.12 0.14 -5.02 116.66 106.19 1gxd n ARG 356 Ca -0.17 0.84 -0.28 0.00 -1.93 0.00 0.00 57.85 56.31 1gxd n ARG 356 Cb 1.04 -5.80 -0.16 0.00 -1.16 0.00 0.00 32.46 26.37 1gxd n ARG 356 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1gxd s LYS 357 N -5.20 2.21 0.35 5.56 -0.14 -1.26 -5.00 119.74 116.25 1gxd s LYS 357 Ca 0.06 -0.69 -0.17 0.00 -1.36 0.00 0.00 55.97 53.82 1gxd s LYS 357 Cb -0.01 -1.81 0.06 0.00 -1.68 0.00 0.00 37.83 34.39 1gxd s LYS 357 CO 0.72 0.21 0.83 1.67 -0.76 0.00 0.00 175.35 178.01 1gxd s TRP 358 N 0.21 0.09 0.06 3.18 1.48 -1.26 -2.10 118.94 120.60 1gxd s TRP 358 Ca -0.10 -0.71 -0.28 0.00 -1.06 0.00 0.00 56.10 53.95 1gxd s TRP 358 Cb -0.14 0.81 0.09 0.00 -1.16 0.00 0.00 33.47 33.07 1gxd s TRP 358 CO 0.04 -1.45 1.02 0.20 -4.06 0.00 0.00 176.95 172.70 1gxd s GLY 359 N -3.11 -0.33 0.41 3.67 0.00 -0.98 -1.97 107.32 105.01 1gxd s GLY 359 Ca 0.16 0.55 -0.07 0.00 0.00 0.00 0.00 44.72 45.36 1gxd s GLY 359 CO 0.10 0.14 0.72 -1.36 0.00 0.00 0.00 173.10 172.70 1gxd s PHE 360 N -3.04 3.51 -0.35 1.90 0.08 0.41 -1.68 117.98 118.81 1gxd s PHE 360 Ca 0.11 0.83 -0.14 0.00 0.12 0.00 0.00 56.93 57.85 1gxd s PHE 360 Cb -0.00 -2.29 -0.01 0.00 -0.57 0.00 0.00 43.02 40.15 1gxd s PHE 360 CO -0.02 -0.10 0.30 0.00 -0.10 0.00 0.00 175.22 175.30 1gxd n PRO 362 N 5.23 1.04 0.00 0.00 -0.02 -1.26 -4.87 135.00 135.11 1gxd n PRO 362 Ca -0.11 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1gxd n PRO 362 Cb 0.49 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 1gxd n PRO 362 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1gxd n ASP 363 N 4.42 0.00 0.28 2.55 5.75 -1.26 -4.91 116.55 123.39 1gxd n ASP 363 Ca 0.24 0.00 0.17 0.00 -0.01 0.00 0.00 54.79 55.20 1gxd n ASP 363 Cb 0.13 0.00 0.78 0.00 -1.03 0.00 0.00 41.12 41.00 1gxd n ASP 363 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 1gxd h GLN 364 N 0.00 0.00 0.00 0.11 7.50 -1.93 -3.36 115.11 117.43 1gxd h GLN 364 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1gxd h GLN 364 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.53 1gxd h GLN 364 CO 0.00 0.03 0.00 0.41 -1.50 0.00 0.00 178.83 177.77 1gxd n GLY 365 N -0.25 -1.32 3.14 3.46 0.00 -1.26 -0.92 105.19 108.03 1gxd n GLY 365 Ca -0.00 -1.19 -0.28 0.00 0.00 0.00 0.00 46.02 44.55 1gxd n GLY 365 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gxd s TYR 366 N 0.00 2.00 -0.30 1.61 2.02 -0.81 -4.84 117.35 117.04 1gxd s TYR 366 Ca 0.00 -0.75 -0.28 0.00 -0.37 0.00 0.00 57.07 55.67 1gxd s TYR 366 Cb 0.00 -1.37 -0.03 0.00 -0.40 0.00 0.00 41.96 40.16 1gxd s TYR 366 CO 0.00 -0.31 1.94 0.45 -1.57 0.00 0.00 175.55 176.06 1gxd s SER 367 N 0.38 5.73 0.32 2.29 0.15 -1.24 -1.59 113.70 119.75 1gxd s SER 367 Ca -0.14 1.48 0.07 0.00 0.70 0.00 0.00 55.95 58.06 1gxd s SER 367 Cb -0.16 -2.52 0.75 0.00 -1.71 0.00 0.00 66.02 62.39 1gxd s SER 367 CO 0.06 -1.81 1.82 0.25 1.20 0.00 0.00 173.24 174.76 1gxd h LEU 368 N 14.21 0.75 0.39 3.45 5.85 -1.31 -0.57 115.31 138.07 1gxd h LEU 368 Ca -0.36 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.42 1gxd h LEU 368 Cb 1.19 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 1gxd h LEU 368 CO 1.01 0.33 -0.37 0.15 -0.34 0.00 0.00 178.44 179.22 1gxd h PHE 369 N 0.76 -0.99 -0.42 1.25 3.57 -1.83 0.18 116.94 119.47 1gxd h PHE 369 Ca 0.52 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.96 1gxd h PHE 369 Cb 0.80 0.38 -0.01 0.00 2.79 0.00 0.00 35.95 39.90 1gxd h PHE 369 CO -0.00 -0.52 0.00 -0.07 -2.23 0.00 0.00 178.31 175.49 1gxd h LEU 370 N -0.77 0.72 -1.33 0.59 3.38 -1.82 0.12 115.31 116.20 1gxd h LEU 370 Ca -0.03 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.60 1gxd h LEU 370 Cb 0.69 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1gxd h LEU 370 CO -0.05 0.85 0.08 0.58 0.09 0.00 0.00 178.44 179.99 1gxd h VAL 371 N 0.57 1.17 -0.26 1.22 2.07 -1.03 -1.83 116.25 118.16 1gxd h VAL 371 Ca 0.12 -0.61 -0.13 0.00 0.82 0.00 0.00 66.70 66.90 1gxd h VAL 371 Cb 0.48 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1gxd h VAL 371 CO 0.02 0.22 -0.33 0.00 0.02 0.00 0.00 177.57 177.50 1gxd h ALA 372 N 1.57 0.40 -0.23 1.67 0.00 -0.20 -2.31 119.26 120.16 1gxd h ALA 372 Ca 0.12 -0.42 0.02 0.00 0.00 0.00 0.00 54.91 54.63 1gxd h ALA 372 Cb 0.21 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1gxd h ALA 372 CO -0.00 0.45 0.16 0.00 0.00 0.00 0.00 179.25 179.85 1gxd h ALA 373 N 0.67 1.92 -0.16 0.00 0.00 -0.21 -0.22 119.26 121.27 1gxd h ALA 373 Ca 0.03 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 1gxd h ALA 373 Cb 0.91 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1gxd h ALA 373 CO 0.08 0.06 -0.66 1.25 0.00 0.00 0.00 179.25 179.98 1gxd h HIS 374 N 0.25 0.79 0.22 0.00 6.17 -1.12 -2.95 115.15 118.51 1gxd h HIS 374 Ca 0.09 -0.32 -0.01 0.00 0.71 0.00 0.00 60.37 60.85 1gxd h HIS 374 Cb 0.07 -0.13 0.00 0.00 2.52 0.00 0.00 27.41 29.87 1gxd h HIS 374 CO -0.00 1.09 -0.10 0.00 0.71 0.00 0.00 177.93 179.63 1gxd h ALA 375 N 0.83 -0.29 -0.72 5.26 0.00 -0.63 -3.00 119.26 120.70 1gxd h ALA 375 Ca -0.02 -0.21 0.19 0.00 0.00 0.00 0.00 54.91 54.88 1gxd h ALA 375 Cb 1.24 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 1gxd h ALA 375 CO 0.13 -0.37 0.51 0.74 0.00 0.00 0.00 179.25 180.25 1gxd h PHE 376 N -0.88 0.15 -0.66 0.00 0.04 -1.20 0.96 116.94 115.35 1gxd h PHE 376 Ca -0.03 0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.81 1gxd h PHE 376 Cb 0.51 -0.05 -0.06 0.00 2.20 0.00 0.00 35.95 38.56 1gxd h PHE 376 CO 0.06 0.05 0.35 0.78 -0.60 0.00 0.00 178.31 178.96 1gxd h GLY 377 N 0.12 0.97 0.98 -1.45 0.00 -1.44 0.53 103.07 102.78 1gxd h GLY 377 Ca 0.35 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.41 1gxd h GLY 377 CO -0.04 0.13 0.23 0.45 0.00 0.00 0.00 176.54 177.31 1gxd h HIS 378 N 0.65 0.81 0.00 5.60 3.86 0.93 -0.97 115.15 126.04 1gxd h HIS 378 Ca 0.30 -0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.45 1gxd h HIS 378 Cb 0.22 -0.25 -0.00 0.00 1.06 0.00 0.00 27.41 28.44 1gxd h HIS 378 CO -0.09 0.65 -0.01 0.00 0.86 0.00 0.00 177.93 179.34 1gxd h ALA 379 N 1.08 1.23 -0.01 2.45 0.00 0.22 0.36 119.26 124.60 1gxd h ALA 379 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1gxd h ALA 379 Cb 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1gxd h ALA 379 CO -0.02 0.02 -0.28 -1.33 0.00 0.00 0.00 179.25 177.64 1gxd n MET 380 N -3.44 0.63 0.00 0.00 2.81 0.15 -3.86 117.12 113.42 1gxd n MET 380 Ca -0.03 -0.35 0.00 0.00 -1.81 0.00 0.00 57.70 55.51 1gxd n MET 380 Cb 0.10 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 1gxd n MET 380 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1gxd n GLY 381 N 1.37 1.15 3.63 3.03 0.00 0.12 -4.60 105.19 109.89 1gxd n GLY 381 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1gxd n GLY 381 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gxd s LEU 382 N 0.00 1.87 0.07 0.99 1.43 -0.43 -4.97 118.68 117.64 1gxd s LEU 382 Ca 0.00 1.63 0.03 0.00 -1.03 0.00 0.00 54.13 54.76 1gxd s LEU 382 Cb 0.00 -3.86 -0.03 0.00 0.03 0.00 0.00 46.19 42.33 1gxd s LEU 382 CO 0.00 -3.28 -0.10 -0.70 0.23 0.00 0.00 176.35 172.49 1gxd s GLU 383 N -4.72 0.70 0.45 1.70 2.56 -1.26 -4.46 118.70 113.67 1gxd s GLU 383 Ca 0.66 -0.93 -0.24 0.00 0.00 0.00 0.00 54.97 54.46 1gxd s GLU 383 Cb -0.21 -0.52 -0.09 0.00 2.00 0.00 0.00 34.13 35.31 1gxd s GLU 383 CO 0.60 0.10 1.15 0.72 -0.56 0.00 0.00 175.26 177.27 1gxd n HIS 384 N 1.16 1.66 -4.19 5.30 8.25 -1.26 -4.94 115.22 121.21 1gxd n HIS 384 Ca -0.20 0.51 -0.27 0.00 -0.26 0.00 0.00 57.72 57.50 1gxd n HIS 384 Cb 0.55 -2.30 -0.08 0.00 1.12 0.00 0.00 29.99 29.29 1gxd n HIS 384 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1gxd s SER 385 N -0.71 4.87 0.09 0.41 0.15 -1.00 -4.96 113.70 112.54 1gxd s SER 385 Ca 0.64 -0.35 0.24 0.00 0.70 0.00 0.00 55.95 57.18 1gxd s SER 385 Cb -0.51 -1.07 0.27 0.00 -1.71 0.00 0.00 66.02 63.00 1gxd s SER 385 CO 0.56 0.10 1.24 0.00 1.20 0.00 0.00 173.24 176.33 1gxd n GLN 386 N -0.07 0.27 -2.21 5.44 6.02 -1.26 -4.24 117.38 121.32 1gxd n GLN 386 Ca -0.10 0.05 -0.41 0.00 -0.01 0.00 0.00 57.00 56.54 1gxd n GLN 386 Cb 0.55 -1.64 -0.03 0.00 1.02 0.00 0.00 30.24 30.14 1gxd n GLN 386 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1gxd s ASP 387 N -4.04 5.78 0.63 1.08 -1.08 -1.26 -4.84 116.67 112.94 1gxd s ASP 387 Ca 0.06 0.43 0.24 0.00 -0.52 0.00 0.00 52.55 52.76 1gxd s ASP 387 Cb 0.14 -2.54 1.32 0.00 -1.46 0.00 0.00 42.92 40.38 1gxd s ASP 387 CO 0.74 -1.96 1.73 -0.65 0.52 0.00 0.00 175.17 175.55 1gxd h PRO 388 N 12.71 0.00 -0.62 4.34 0.11 -1.88 0.55 132.00 147.21 1gxd h PRO 388 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1gxd h PRO 388 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1gxd h PRO 388 CO 1.17 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.37 1gxd n GLY 389 N -1.26 2.15 3.42 -0.55 0.00 -1.26 -4.75 105.19 102.94 1gxd n GLY 389 Ca -0.02 -0.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.89 1gxd n GLY 389 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gxd s ALA 390 N -1.18 2.97 0.20 4.61 0.00 0.19 -4.62 121.76 123.93 1gxd s ALA 390 Ca 0.45 -1.00 -0.02 0.00 0.00 0.00 0.00 51.96 51.39 1gxd s ALA 390 Cb 0.24 -1.72 0.42 0.00 0.00 0.00 0.00 23.12 22.06 1gxd s ALA 390 CO 0.32 -0.16 1.05 -0.11 0.00 0.00 0.00 175.76 176.87 1gxd n LEU 391 N 4.26 -0.16 0.00 0.00 7.94 -1.26 0.16 117.00 127.95 1gxd n LEU 391 Ca -0.17 1.15 0.06 0.00 -1.11 0.00 0.00 56.01 55.94 1gxd n LEU 391 Cb 0.52 -0.38 0.34 0.00 0.53 0.00 0.00 43.42 44.42 1gxd n LEU 391 CO 0.31 -1.13 0.63 0.23 -1.11 0.00 0.00 177.39 176.32 1gxd n MET 392 N -4.99 0.25 -1.88 1.96 2.81 -1.26 -4.66 117.12 109.35 1gxd n MET 392 Ca 0.13 0.11 -0.35 0.00 -1.81 0.00 0.00 57.70 55.78 1gxd n MET 392 Cb 0.43 -1.50 0.05 0.00 -0.71 0.00 0.00 33.22 31.49 1gxd n MET 392 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1gxd s ALA 393 N -2.38 2.45 0.00 3.04 0.00 0.43 -2.37 121.76 122.93 1gxd s ALA 393 Ca 0.14 0.97 -0.17 0.00 0.00 0.00 0.00 51.96 52.90 1gxd s ALA 393 Cb 0.08 -3.45 -0.34 0.00 0.00 0.00 0.00 23.12 19.41 1gxd s ALA 393 CO 0.18 -1.32 0.94 -1.00 0.00 0.00 0.00 175.76 174.55 1gxd h PRO 394 N 0.59 0.47 -6.21 0.00 0.13 -1.83 -3.45 132.00 121.71 1gxd h PRO 394 Ca -0.50 -0.81 -0.57 0.00 -0.87 0.00 0.00 66.00 63.25 1gxd h PRO 394 Cb 1.30 0.30 -0.01 0.00 0.13 0.00 0.00 31.00 32.71 1gxd h PRO 394 CO 0.54 1.39 1.28 0.42 -0.23 0.00 0.00 178.00 181.39 1gxd s ILE 395 N -2.55 3.36 0.31 -3.56 1.01 -1.26 -2.34 121.20 116.16 1gxd s ILE 395 Ca -0.11 0.40 -0.30 0.00 0.00 0.00 0.00 60.65 60.64 1gxd s ILE 395 Cb 0.03 -3.41 -0.12 0.00 0.01 0.00 0.00 42.46 38.97 1gxd s ILE 395 CO 0.91 -0.21 1.50 0.00 0.00 0.00 0.00 174.94 177.14 1gxd n TYR 396 N 9.68 2.68 -3.71 3.97 4.19 -0.97 -5.00 117.16 128.00 1gxd n TYR 396 Ca 0.23 0.37 -0.12 0.00 3.31 0.00 0.00 57.90 61.69 1gxd n TYR 396 Cb 0.45 -2.53 -0.12 0.00 0.49 0.00 0.00 39.34 37.63 1gxd n TYR 396 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 1gxd s THR 397 N -0.41 -0.10 0.09 2.97 2.01 -1.26 -4.91 115.64 114.02 1gxd s THR 397 Ca 0.61 0.15 -0.25 0.00 0.31 0.00 0.00 61.69 62.50 1gxd s THR 397 Cb -0.53 -0.48 -0.06 0.00 0.01 0.00 0.00 72.50 71.44 1gxd s THR 397 CO 0.54 0.06 0.78 -0.47 -0.69 0.00 0.00 174.62 174.84 1gxd s TYR 398 N 1.49 3.80 -0.05 4.92 5.04 -1.26 -5.05 117.35 126.25 1gxd s TYR 398 Ca -0.08 1.55 0.00 0.00 -2.44 0.00 0.00 57.07 56.10 1gxd s TYR 398 Cb -0.10 -2.81 0.02 0.00 0.35 0.00 0.00 41.96 39.42 1gxd s TYR 398 CO -0.10 0.35 -0.02 0.95 -1.34 0.00 0.00 175.55 175.40 1gxd s THR 399 N -0.43 0.37 0.14 4.34 -4.23 -1.26 -4.81 115.64 109.76 1gxd s THR 399 Ca 0.38 0.01 -0.14 0.00 -1.18 0.00 0.00 61.69 60.76 1gxd s THR 399 Cb -0.22 -0.46 0.02 0.00 1.34 0.00 0.00 72.50 73.19 1gxd s THR 399 CO 0.24 0.21 1.68 0.11 -0.54 0.00 0.00 174.62 176.32 1gxd h LYS 400 N 7.49 0.72 -3.46 3.99 6.56 -1.97 -3.34 116.57 126.55 1gxd h LYS 400 Ca -0.35 -0.15 -0.67 0.00 -1.06 0.00 0.00 60.65 58.42 1gxd h LYS 400 Cb 1.14 -0.11 -0.38 0.00 -0.57 0.00 0.00 32.23 32.32 1gxd h LYS 400 CO 0.42 0.68 -0.45 -0.80 -2.06 0.00 0.00 179.45 177.24 1gxd s ASN 401 N -6.00 4.94 0.29 0.86 -0.87 -1.26 -5.07 114.94 107.83 1gxd s ASN 401 Ca -0.13 -3.02 -0.29 0.00 -1.57 0.00 0.00 52.86 47.85 1gxd s ASN 401 Cb 0.11 -1.77 -0.10 0.00 -0.02 0.00 0.00 41.25 39.47 1gxd s ASN 401 CO 0.77 -0.29 1.15 0.12 -2.57 0.00 0.00 177.10 176.28 1gxd s PHE 402 N -0.30 3.45 -0.03 2.20 5.36 -1.26 -5.03 117.98 122.37 1gxd s PHE 402 Ca 0.18 1.63 -0.00 0.00 -0.96 0.00 0.00 56.93 57.78 1gxd s PHE 402 Cb -0.21 -3.38 0.03 0.00 -0.34 0.00 0.00 43.02 39.13 1gxd s PHE 402 CO -0.03 -0.86 0.05 1.03 -1.46 0.00 0.00 175.22 173.94 1gxd s ARG 403 N -1.55 -0.03 0.06 10.12 0.52 -1.26 -5.11 118.95 121.71 1gxd s ARG 403 Ca 0.46 0.23 -0.35 0.00 -0.52 0.00 0.00 55.73 55.55 1gxd s ARG 403 Cb -0.34 -0.27 -0.14 0.00 0.52 0.00 0.00 34.95 34.73 1gxd s ARG 403 CO 0.44 -0.19 1.63 1.28 0.02 0.00 0.00 175.30 178.48 1gxd n LEU 404 N 4.31 2.96 -4.79 2.53 4.77 -1.26 -4.89 117.00 120.62 1gxd n LEU 404 Ca -0.25 1.06 -0.30 0.00 -0.03 0.00 0.00 56.01 56.49 1gxd n LEU 404 Cb 0.50 -1.37 0.10 0.00 -2.33 0.00 0.00 43.42 40.32 1gxd n LEU 404 CO 0.20 -0.34 0.70 -0.94 -1.33 0.00 0.00 177.39 175.69 1gxd s SER 405 N 1.81 4.36 0.21 -1.43 1.04 -1.26 -3.96 113.70 114.47 1gxd s SER 405 Ca 0.84 1.38 -0.07 0.00 0.48 0.00 0.00 55.95 58.59 1gxd s SER 405 Cb -0.74 -2.12 0.17 0.00 0.10 0.00 0.00 66.02 63.43 1gxd s SER 405 CO 0.44 -2.06 1.71 -0.61 0.98 0.00 0.00 173.24 173.70 1gxd h GLN 406 N -1.15 1.04 -0.98 4.02 5.75 -0.38 -2.33 115.11 121.09 1gxd h GLN 406 Ca -0.47 -0.27 0.25 0.00 -0.15 0.00 0.00 58.65 58.00 1gxd h GLN 406 Cb 1.27 -0.13 -0.07 0.00 1.07 0.00 0.00 27.48 29.62 1gxd h GLN 406 CO 0.58 0.96 0.66 0.22 -2.65 0.00 0.00 178.83 178.60 1gxd h ASP 407 N 0.98 0.31 0.12 -0.69 3.58 -1.92 0.24 116.42 119.04 1gxd h ASP 407 Ca 0.19 0.05 -0.26 0.00 0.42 0.00 0.00 57.03 57.42 1gxd h ASP 407 Cb 0.43 -0.01 0.03 0.00 1.72 0.00 0.00 39.33 41.50 1gxd h ASP 407 CO 0.01 0.09 -1.11 0.44 -2.88 0.00 0.00 179.24 175.80 1gxd h ASP 408 N 0.30 0.76 0.27 2.28 3.32 -1.80 -2.94 116.42 118.60 1gxd h ASP 408 Ca 0.51 -0.85 -0.01 0.00 0.02 0.00 0.00 57.03 56.70 1gxd h ASP 408 Cb 1.48 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1gxd h ASP 408 CO -0.17 1.54 -0.13 0.40 -1.72 0.00 0.00 179.24 179.15 1gxd h ILE 409 N 0.10 0.78 -0.67 0.35 2.04 -0.57 0.23 117.51 119.76 1gxd h ILE 409 Ca -0.17 -0.43 0.14 0.00 1.00 0.00 0.00 64.86 65.39 1gxd h ILE 409 Cb 1.82 1.02 -0.12 0.00 -0.74 0.00 0.00 36.82 38.80 1gxd h ILE 409 CO 0.21 0.09 -0.09 0.50 0.00 0.00 0.00 178.15 178.87 1gxd h LYS 410 N -0.59 0.05 0.00 2.37 3.64 -0.80 0.86 116.57 122.10 1gxd h LYS 410 Ca -0.04 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1gxd h LYS 410 Cb 0.43 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1gxd h LYS 410 CO 0.06 0.03 0.00 0.41 -2.27 0.00 0.00 179.45 177.68 1gxd n GLY 411 N -1.42 -2.97 0.41 5.01 0.00 -0.95 -1.45 105.19 103.81 1gxd n GLY 411 Ca 0.10 0.24 0.21 0.00 0.00 0.00 0.00 46.02 46.56 1gxd n GLY 411 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1gxd h ILE 412 N 0.00 0.61 0.00 -0.61 6.09 -0.18 0.10 117.51 123.52 1gxd h ILE 412 Ca 0.00 -0.14 -0.05 0.00 -1.37 0.00 0.00 64.86 63.31 1gxd h ILE 412 Cb 0.00 0.17 -0.01 0.00 0.47 0.00 0.00 36.82 37.45 1gxd h ILE 412 CO 0.00 0.07 -0.23 1.56 -3.07 0.00 0.00 178.15 176.49 1gxd h GLN 413 N 0.40 0.00 0.00 2.19 4.20 0.92 -2.89 115.11 119.93 1gxd h GLN 413 Ca 0.53 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.24 1gxd h GLN 413 Cb 1.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.12 1gxd h GLN 413 CO -0.22 0.23 0.00 1.49 -0.67 0.00 0.00 178.83 179.65 1gxd h GLU 414 N 0.00 0.00 0.00 1.46 4.81 0.39 -2.15 114.58 119.09 1gxd h GLU 414 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1gxd h GLU 414 Cb 0.70 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1gxd h GLU 414 CO 0.03 0.00 -1.15 1.28 -0.73 0.00 0.00 179.01 178.44 1gxd n LEU 415 N -2.92 0.15 0.00 1.64 4.77 -1.11 -4.87 117.00 114.66 1gxd n LEU 415 Ca 0.00 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 1gxd n LEU 415 Cb 0.23 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1gxd n LEU 415 CO 0.24 0.04 -0.22 -1.22 -1.33 0.00 0.00 177.39 174.89 1gxd n TYR 416 N -1.66 0.00 0.00 -1.77 4.01 -1.12 -4.98 117.16 111.64 1gxd n TYR 416 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1gxd n TYR 416 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.26 1gxd n TYR 416 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gxd n GLY 417 N 2.28 3.58 0.23 2.72 0.00 -0.82 -4.70 105.19 108.48 1gxd n GLY 417 Ca 0.00 -1.59 -0.04 0.00 0.00 0.00 0.00 46.02 44.38 1gxd n GLY 417 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gxd h ALA 418 N 0.00 1.03 -3.00 4.61 0.00 -1.79 -3.35 119.26 116.76 1gxd h ALA 418 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1gxd h ALA 418 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1gxd h ALA 418 CO 0.00 0.59 0.00 0.43 0.00 0.00 0.00 179.25 180.27 1gxd n SER 419 N -4.08 0.67 -4.74 0.00 7.64 -1.26 -2.95 113.62 108.89 1gxd n SER 419 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1gxd n SER 419 Cb 0.45 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.65 1gxd n SER 419 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1gxd n PRO 420 N 0.00 2.43 0.00 1.43 -0.02 -1.26 -2.37 135.00 135.20 1gxd n PRO 420 Ca 0.00 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1gxd n PRO 420 Cb 0.00 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 30.95 1gxd n PRO 420 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1gxd n ASP 421 N 0.54 0.00 0.00 2.55 9.92 -1.26 -4.90 116.55 123.40 1gxd n ASP 421 Ca 0.03 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.29 1gxd n ASP 421 Cb 0.38 -0.17 0.00 0.00 -0.64 0.00 0.00 41.12 40.69 1gxd n ASP 421 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1gxd n THR 429 N -1.30 0.00 -1.47 -3.53 -1.04 -1.26 -4.96 114.28 100.72 1gxd n THR 429 Ca 0.00 0.00 -0.50 0.00 -2.04 0.00 0.00 64.05 61.51 1gxd n THR 429 Cb 0.00 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.47 1gxd n THR 429 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1gxd n PRO 430 N 0.00 0.33 -0.87 -2.82 -0.02 -1.26 -4.90 135.00 125.47 1gxd n PRO 430 Ca 0.00 0.12 -0.32 0.00 -2.02 0.00 0.00 63.50 61.27 1gxd n PRO 430 Cb 0.00 -1.35 0.15 0.00 -0.02 0.00 0.00 33.50 32.28 1gxd n PRO 430 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1gxd n THR 431 N 0.61 0.85 0.00 3.45 5.66 -1.26 -4.43 114.28 119.16 1gxd n THR 431 Ca 0.17 -0.11 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 1gxd n THR 431 Cb 0.22 -1.04 0.00 0.00 -1.55 0.00 0.00 70.33 67.95 1gxd n THR 431 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1gxd n LEU 432 N -3.56 0.00 0.00 1.09 7.94 -1.26 -4.27 117.00 116.94 1gxd n LEU 432 Ca 0.12 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 1gxd n LEU 432 Cb 0.51 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.46 1gxd n LEU 432 CO 0.49 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.38 1gxd n GLY 433 N 0.00 2.05 3.45 -3.96 0.00 -1.26 -4.74 105.19 100.73 1gxd n GLY 433 Ca 0.00 -1.36 -0.28 0.00 0.00 0.00 0.00 46.02 44.38 1gxd n GLY 433 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1gxd n PRO 434 N 2.51 -2.56 -3.70 1.61 -0.02 -1.25 -4.09 135.00 127.50 1gxd n PRO 434 Ca 0.00 -0.72 -0.15 0.00 -2.02 0.00 0.00 63.50 60.62 1gxd n PRO 434 Cb 0.00 -2.14 -0.14 0.00 -0.02 0.00 0.00 33.50 31.19 1gxd n PRO 434 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1gxd s VAL 435 N -2.39 -0.21 0.02 -1.45 0.11 -1.26 0.22 120.40 115.44 1gxd s VAL 435 Ca 0.68 0.26 -0.30 0.00 -2.93 0.00 0.00 61.98 59.69 1gxd s VAL 435 Cb -0.25 -0.33 -0.05 0.00 -1.53 0.00 0.00 36.38 34.22 1gxd s VAL 435 CO 0.66 0.11 1.18 0.42 -3.33 0.00 0.00 175.10 174.13 1gxd s THR 436 N 1.88 4.19 1.02 5.04 -4.23 -1.26 -5.00 115.64 117.28 1gxd s THR 436 Ca -0.02 1.56 -0.22 0.00 -1.18 0.00 0.00 61.69 61.82 1gxd s THR 436 Cb -0.12 -4.00 -0.12 0.00 1.34 0.00 0.00 72.50 69.61 1gxd s THR 436 CO -0.07 0.08 -0.94 -2.65 -0.54 0.00 0.00 174.62 170.50 1gxd n PRO 437 N 4.37 -0.29 -3.54 3.99 -0.02 -1.26 -5.04 135.00 133.21 1gxd n PRO 437 Ca 0.09 -0.08 -0.12 0.00 -2.02 0.00 0.00 63.50 61.38 1gxd n PRO 437 Cb 0.47 -1.18 -0.11 0.00 -0.02 0.00 0.00 33.50 32.65 1gxd n PRO 437 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1gxd s GLU 438 N -2.37 0.25 0.01 -0.52 2.12 -1.26 -5.00 118.70 111.93 1gxd s GLU 438 Ca 0.42 0.67 -0.24 0.00 0.36 0.00 0.00 54.97 56.18 1gxd s GLU 438 Cb -0.03 -0.27 -0.13 0.00 0.26 0.00 0.00 34.13 33.96 1gxd s GLU 438 CO 0.71 -0.44 1.02 -0.84 -0.54 0.00 0.00 175.26 175.17 1gxd h ILE 439 N 6.24 0.00 0.00 -3.70 3.07 -1.97 -2.74 117.51 118.41 1gxd h ILE 439 Ca -0.16 -0.31 -0.01 0.00 1.55 0.00 0.00 64.86 65.92 1gxd h ILE 439 Cb 1.13 0.00 -0.00 0.00 -0.27 0.00 0.00 36.82 37.68 1gxd h ILE 439 CO 0.19 0.00 -0.78 0.00 -1.05 0.00 0.00 178.15 176.52 1gxd h LYS 441 N 0.00 0.00 -4.18 0.00 1.57 -2.02 -3.45 116.57 108.49 1gxd h LYS 441 Ca -0.01 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.32 1gxd h LYS 441 Cb 1.05 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 33.02 1gxd h LYS 441 CO 0.00 0.22 -0.79 1.14 -0.57 0.00 0.00 179.45 179.46 1gxd s GLN 442 N -3.11 1.11 0.03 3.15 -2.07 -1.03 -5.10 119.66 112.65 1gxd s GLN 442 Ca 0.03 -0.20 -0.31 0.00 -1.82 0.00 0.00 55.36 53.07 1gxd s GLN 442 Cb 0.07 -1.04 -0.09 0.00 -1.09 0.00 0.00 33.01 30.85 1gxd s GLN 442 CO 0.74 -0.06 1.96 -0.25 -1.32 0.00 0.00 175.29 176.36 1gxd n ASP 443 N 4.04 4.10 -4.43 12.60 8.00 -1.26 -4.50 116.55 135.10 1gxd n ASP 443 Ca -0.23 0.91 -0.30 0.00 0.71 0.00 0.00 54.79 55.88 1gxd n ASP 443 Cb 0.51 -1.51 -0.13 0.00 -0.02 0.00 0.00 41.12 39.97 1gxd n ASP 443 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1gxd s ILE 444 N 4.34 2.62 -0.37 0.53 1.01 -1.26 -5.09 121.20 122.98 1gxd s ILE 444 Ca 0.89 -1.28 0.03 0.00 0.00 0.00 0.00 60.65 60.29 1gxd s ILE 444 Cb -0.46 -2.09 0.11 0.00 0.01 0.00 0.00 42.46 40.02 1gxd s ILE 444 CO 0.43 0.32 0.10 0.54 0.00 0.00 0.00 174.94 176.32 1gxd s VAL 445 N -0.92 2.50 1.41 2.92 0.11 -1.26 -4.97 120.40 120.19 1gxd s VAL 445 Ca 0.14 -2.39 -0.22 0.00 -2.93 0.00 0.00 61.98 56.58 1gxd s VAL 445 Cb -0.10 -2.81 0.36 0.00 -1.53 0.00 0.00 36.38 32.30 1gxd s VAL 445 CO 0.05 -0.64 0.85 0.49 -3.33 0.00 0.00 175.10 172.52 1gxd n PHE 446 N 4.21 -3.33 -0.02 1.54 3.72 -1.26 -4.99 117.46 117.32 1gxd n PHE 446 Ca 0.03 -0.66 0.00 0.00 -0.05 0.00 0.00 57.45 56.77 1gxd n PHE 446 Cb 0.41 -1.40 -0.07 0.00 -0.94 0.00 0.00 39.48 37.49 1gxd n PHE 446 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1gxd n ASP 447 N -5.35 2.98 -3.52 4.37 8.00 -0.95 -4.99 116.55 117.09 1gxd n ASP 447 Ca 0.11 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.52 1gxd n ASP 447 Cb 0.58 1.05 -0.03 0.00 -0.02 0.00 0.00 41.12 42.70 1gxd n ASP 447 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1gxd s GLY 448 N -3.51 -0.42 0.00 0.44 0.00 -1.26 -4.40 107.32 98.18 1gxd s GLY 448 Ca -0.04 1.31 -0.07 0.00 0.00 0.00 0.00 44.72 45.92 1gxd s GLY 448 CO 0.35 0.57 0.13 -0.42 0.00 0.00 0.00 173.10 173.74 1gxd s ILE 449 N -2.43 0.09 0.00 0.90 1.01 -1.26 -0.70 121.20 118.81 1gxd s ILE 449 Ca 0.02 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 59.96 1gxd s ILE 449 Cb -0.01 -0.44 0.00 0.00 0.01 0.00 0.00 42.46 42.02 1gxd s ILE 449 CO -0.05 -0.39 0.00 0.00 0.00 0.00 0.00 174.94 174.50 1gxd n ALA 450 N 1.42 0.00 -1.98 9.38 0.00 -0.95 -4.58 120.51 123.80 1gxd n ALA 450 Ca -0.23 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.81 1gxd n ALA 450 Cb 0.56 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.95 1gxd n ALA 450 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1gxd s GLN 451 N -1.03 4.72 -0.25 0.00 -0.21 -1.26 -1.08 119.66 120.55 1gxd s GLN 451 Ca 0.00 1.36 -0.03 0.00 0.02 0.00 0.00 55.36 56.71 1gxd s GLN 451 Cb 0.00 -3.30 0.10 0.00 1.00 0.00 0.00 33.01 30.81 1gxd s GLN 451 CO 0.00 0.44 0.19 -1.50 -2.12 0.00 0.00 175.29 172.30 1gxd s ILE 452 N -0.81 -0.22 -0.85 1.08 2.07 0.10 -4.67 121.20 117.90 1gxd s ILE 452 Ca 0.41 -0.43 -0.04 0.00 -1.41 0.00 0.00 60.65 59.18 1gxd s ILE 452 Cb -0.24 -0.84 -0.01 0.00 0.13 0.00 0.00 42.46 41.50 1gxd s ILE 452 CO 0.29 -0.46 0.71 -1.14 -1.91 0.00 0.00 174.94 172.43 1gxd n ARG 453 N 5.29 -1.43 0.00 3.50 0.00 -1.26 -2.86 116.66 119.90 1gxd n ARG 453 Ca -0.05 1.09 0.00 0.00 -0.00 0.00 0.00 57.85 58.89 1gxd n ARG 453 Cb 0.46 -4.58 0.00 0.00 0.00 0.00 0.00 32.46 28.34 1gxd n ARG 453 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1gxd n GLY 454 N -1.68 1.87 3.72 5.14 0.00 -1.26 -4.95 105.19 108.02 1gxd n GLY 454 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 1gxd n GLY 454 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1gxd s GLU 455 N 0.00 3.74 -0.18 1.61 -1.05 -1.13 -4.68 118.70 117.01 1gxd s GLU 455 Ca 0.00 -0.28 -0.19 0.00 -0.15 0.00 0.00 54.97 54.35 1gxd s GLU 455 Cb 0.00 -3.18 -0.03 0.00 -0.44 0.00 0.00 34.13 30.48 1gxd s GLU 455 CO 0.00 0.46 0.55 0.42 0.95 0.00 0.00 175.26 177.65 1gxd s ILE 456 N -0.15 5.09 -0.08 1.83 1.01 0.41 0.00 121.20 129.31 1gxd s ILE 456 Ca 0.08 1.04 -0.01 0.00 0.00 0.00 0.00 60.65 61.77 1gxd s ILE 456 Cb -0.12 -3.88 -0.03 0.00 0.01 0.00 0.00 42.46 38.44 1gxd s ILE 456 CO 0.01 0.19 -0.02 -0.36 0.00 0.00 0.00 174.94 174.76 1gxd s PHE 457 N 1.48 3.08 -0.25 3.97 0.40 -0.24 -1.30 117.98 125.12 1gxd s PHE 457 Ca 0.26 0.12 -0.01 0.00 -0.60 0.00 0.00 56.93 56.70 1gxd s PHE 457 Cb -0.16 -1.77 0.03 0.00 0.51 0.00 0.00 43.02 41.64 1gxd s PHE 457 CO 0.10 0.40 -0.06 -0.06 0.70 0.00 0.00 175.22 176.30 1gxd s PHE 458 N -0.81 3.11 0.32 0.36 0.40 0.28 -2.24 117.98 119.40 1gxd s PHE 458 Ca 0.12 -1.70 0.01 0.00 -0.60 0.00 0.00 56.93 54.76 1gxd s PHE 458 Cb -0.11 -2.04 -0.03 0.00 0.51 0.00 0.00 43.02 41.34 1gxd s PHE 458 CO 0.02 -0.76 0.52 -0.06 0.70 0.00 0.00 175.22 175.63 1gxd s PHE 459 N 1.29 3.49 -0.27 0.36 0.40 0.13 -0.49 117.98 122.88 1gxd s PHE 459 Ca -0.01 0.31 -0.29 0.00 -0.60 0.00 0.00 56.93 56.33 1gxd s PHE 459 Cb -0.17 -1.85 0.18 0.00 0.51 0.00 0.00 43.02 41.68 1gxd s PHE 459 CO -0.04 0.18 1.30 0.21 0.70 0.00 0.00 175.22 177.57 1gxd s LYS 460 N -4.21 0.15 -0.41 0.44 2.20 -0.80 -2.23 119.74 114.88 1gxd s LYS 460 Ca 0.39 0.05 -0.46 0.00 -0.36 0.00 0.00 55.97 55.59 1gxd s LYS 460 Cb -0.10 0.07 -0.20 0.00 -1.51 0.00 0.00 37.83 36.10 1gxd s LYS 460 CO 0.35 -0.04 1.52 -0.40 -0.36 0.00 0.00 175.35 176.41 1gxd n ASP 461 N 0.68 1.05 -1.00 1.43 5.68 -1.26 -0.39 116.55 122.74 1gxd n ASP 461 Ca -0.03 1.18 -0.12 0.00 -0.50 0.00 0.00 54.79 55.33 1gxd n ASP 461 Cb 0.58 -0.89 -0.04 0.00 -1.14 0.00 0.00 41.12 39.63 1gxd n ASP 461 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1gxd n ARG 462 N 3.64 -0.84 -3.63 0.11 5.12 -1.26 -4.89 116.66 114.91 1gxd n ARG 462 Ca 0.29 0.83 -0.07 0.00 -1.93 0.00 0.00 57.85 56.97 1gxd n ARG 462 Cb -0.03 -4.86 -0.06 0.00 -1.16 0.00 0.00 32.46 26.35 1gxd n ARG 462 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1gxd s PHE 463 N -2.47 -0.31 -0.05 -1.55 0.40 0.47 -4.53 117.98 109.95 1gxd s PHE 463 Ca 0.00 0.70 0.01 0.00 -0.60 0.00 0.00 56.93 57.04 1gxd s PHE 463 Cb 0.00 0.42 0.02 0.00 0.51 0.00 0.00 43.02 43.97 1gxd s PHE 463 CO 0.00 -0.18 -0.05 0.96 0.70 0.00 0.00 175.22 176.65 1gxd s ILE 464 N -0.19 0.59 -0.20 0.64 -5.25 0.86 -1.90 121.20 115.74 1gxd s ILE 464 Ca 0.04 -0.14 -0.08 0.00 -0.99 0.00 0.00 60.65 59.47 1gxd s ILE 464 Cb -0.04 -0.61 -0.04 0.00 2.95 0.00 0.00 42.46 44.72 1gxd s ILE 464 CO -0.07 0.24 0.08 0.26 -1.79 0.00 0.00 174.94 173.66 1gxd s TRP 465 N 0.95 3.26 -0.03 1.37 0.51 0.35 -3.02 118.94 122.33 1gxd s TRP 465 Ca -0.10 0.08 0.07 0.00 -2.12 0.00 0.00 56.10 54.02 1gxd s TRP 465 Cb -0.14 -2.13 -0.02 0.00 -0.81 0.00 0.00 33.47 30.37 1gxd s TRP 465 CO 0.00 0.11 -0.24 -0.98 -0.51 0.00 0.00 176.95 175.33 1gxd s ARG 466 N 0.57 2.20 0.01 4.98 1.70 -1.26 1.00 118.95 128.15 1gxd s ARG 466 Ca 0.04 -0.89 -0.11 0.00 -0.47 0.00 0.00 55.73 54.30 1gxd s ARG 466 Cb -0.13 -2.11 0.01 0.00 -0.57 0.00 0.00 34.95 32.16 1gxd s ARG 466 CO 0.01 0.56 0.23 -0.08 -1.08 0.00 0.00 175.30 174.94 1gxd s THR 467 N -0.60 0.08 -0.27 4.99 -1.32 -0.42 0.51 115.64 118.62 1gxd s THR 467 Ca 0.09 -0.67 -0.09 0.00 -1.21 0.00 0.00 61.69 59.82 1gxd s THR 467 Cb -0.10 -0.68 -0.14 0.00 -1.51 0.00 0.00 72.50 70.06 1gxd s THR 467 CO -0.00 -0.37 -0.28 0.55 -2.21 0.00 0.00 174.62 172.31 1gxd n VAL 468 N 1.08 1.52 -3.73 5.08 3.14 -1.26 -0.44 118.33 123.71 1gxd n VAL 468 Ca -0.21 -0.44 -0.15 0.00 -2.96 0.00 0.00 64.34 60.58 1gxd n VAL 468 Cb 0.57 -1.72 -0.15 0.00 -1.06 0.00 0.00 33.84 31.48 1gxd n VAL 468 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 1gxd s THR 469 N -2.51 -0.10 0.62 1.55 -1.32 -1.26 -4.82 115.64 107.80 1gxd s THR 469 Ca -0.37 0.23 0.22 0.00 -1.21 0.00 0.00 61.69 60.56 1gxd s THR 469 Cb 0.12 -0.23 0.29 0.00 -1.51 0.00 0.00 72.50 71.18 1gxd s THR 469 CO 0.54 0.10 1.44 -0.65 -2.21 0.00 0.00 174.62 173.84 1gxd h PRO 470 N 7.54 0.00 0.00 7.08 0.11 -1.87 -2.14 132.00 142.73 1gxd h PRO 470 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1gxd h PRO 470 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1gxd h PRO 470 CO 0.36 0.00 -0.03 0.00 -0.21 0.00 0.00 178.00 178.12 1gxd h ARG 471 N 0.00 -0.04 -7.30 1.05 3.08 -1.95 -3.39 114.38 105.84 1gxd h ARG 471 Ca 0.26 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.80 1gxd h ARG 471 Cb 2.04 0.01 0.15 0.00 0.08 0.00 0.00 29.97 32.25 1gxd h ARG 471 CO -0.00 -0.02 0.28 0.16 -1.07 0.00 0.00 179.97 179.31 1gxd s ASP 472 N -2.59 3.90 0.57 7.04 1.47 -0.80 -5.03 116.67 121.24 1gxd s ASP 472 Ca -0.01 1.89 -0.02 0.00 1.18 0.00 0.00 52.55 55.60 1gxd s ASP 472 Cb 0.00 -2.50 0.03 0.00 -0.34 0.00 0.00 42.92 40.11 1gxd s ASP 472 CO 0.03 -2.43 0.83 -0.75 0.68 0.00 0.00 175.17 173.53 1gxd s LYS 473 N -4.83 2.59 0.47 2.11 2.20 -1.26 -4.77 119.74 116.25 1gxd s LYS 473 Ca 0.63 -0.53 -0.24 0.00 -0.36 0.00 0.00 55.97 55.47 1gxd s LYS 473 Cb -0.19 -2.40 -0.08 0.00 -1.51 0.00 0.00 37.83 33.65 1gxd s LYS 473 CO 0.57 -0.76 1.37 -2.30 -0.36 0.00 0.00 175.35 173.86 1gxd n PRO 474 N -2.46 2.03 0.00 4.03 -0.02 -1.26 -4.84 135.00 132.47 1gxd n PRO 474 Ca 0.07 0.73 0.14 0.00 -2.02 0.00 0.00 63.50 62.41 1gxd n PRO 474 Cb 0.59 -2.55 0.65 0.00 -0.02 0.00 0.00 33.50 32.17 1gxd n PRO 474 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1gxd n MET 475 N -0.33 0.40 0.00 -0.52 2.81 0.18 -4.88 117.12 114.79 1gxd n MET 475 Ca 0.07 -0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 1gxd n MET 475 Cb 0.42 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.43 1gxd n MET 475 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1gxd n GLY 476 N 1.34 -2.21 3.87 3.03 0.00 -1.26 -4.88 105.19 105.07 1gxd n GLY 476 Ca 0.12 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.36 1gxd n GLY 476 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1gxd s PRO 477 N -2.68 3.23 -0.00 1.61 0.02 -1.26 -5.02 135.00 130.90 1gxd s PRO 477 Ca 0.00 0.65 -0.13 0.00 0.02 0.00 0.00 61.00 61.54 1gxd s PRO 477 Cb 0.00 -2.05 0.02 0.00 0.02 0.00 0.00 34.50 32.49 1gxd s PRO 477 CO 0.00 -0.81 0.28 -0.51 -0.33 0.00 0.00 177.00 175.63 1gxd s LEU 478 N -5.29 0.98 0.44 -5.54 1.43 -1.17 -4.84 118.68 104.69 1gxd s LEU 478 Ca 0.57 -0.01 -0.23 0.00 -1.03 0.00 0.00 54.13 53.43 1gxd s LEU 478 Cb -0.11 1.18 -0.08 0.00 0.03 0.00 0.00 46.19 47.20 1gxd s LEU 478 CO 0.53 -0.46 1.09 -0.76 0.23 0.00 0.00 176.35 176.98 1gxd s LEU 479 N -1.45 4.03 0.01 1.79 1.43 -1.26 -0.10 118.68 123.12 1gxd s LEU 479 Ca -0.12 2.12 -0.25 0.00 -1.03 0.00 0.00 54.13 54.84 1gxd s LEU 479 Cb -0.05 -4.29 -0.19 0.00 0.03 0.00 0.00 46.19 41.70 1gxd s LEU 479 CO 0.03 -0.72 1.36 -0.37 0.23 0.00 0.00 176.35 176.88 1gxd h VAL 480 N 1.92 1.20 -0.36 -1.59 -1.51 -1.87 -2.86 116.25 111.19 1gxd h VAL 480 Ca -0.49 -0.82 0.11 0.00 -1.23 0.00 0.00 66.70 64.27 1gxd h VAL 480 Cb 1.23 1.74 -0.01 0.00 -2.13 0.00 0.00 31.29 32.12 1gxd h VAL 480 CO 0.61 0.21 0.85 0.00 -1.23 0.00 0.00 177.57 178.00 1gxd n ALA 481 N -2.31 0.35 0.27 5.19 0.00 -1.26 0.17 120.51 122.92 1gxd n ALA 481 Ca -0.08 0.12 0.16 0.00 0.00 0.00 0.00 53.44 53.64 1gxd n ALA 481 Cb 0.20 -0.21 0.69 0.00 0.00 0.00 0.00 19.45 20.14 1gxd n ALA 481 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1gxd h THR 482 N 0.00 0.15 0.00 0.00 2.02 -1.82 -3.00 112.91 110.26 1gxd h THR 482 Ca 0.17 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.77 1gxd h THR 482 Cb 1.86 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 69.78 1gxd h THR 482 CO -0.00 0.05 -0.79 0.49 0.37 0.00 0.00 175.52 175.64 1gxd n PHE 483 N -3.19 0.00 -3.22 3.16 3.72 0.44 -4.89 117.46 113.48 1gxd n PHE 483 Ca 0.00 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.16 1gxd n PHE 483 Cb 0.30 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.77 1gxd n PHE 483 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 176.76 177.62 1gxd n TRP 484 N -1.56 0.24 -0.20 1.38 8.01 -0.84 -4.92 117.44 119.55 1gxd n TRP 484 Ca 0.00 -3.66 0.03 0.00 -1.31 0.00 0.00 57.50 52.56 1gxd n TRP 484 Cb 0.30 -0.38 0.29 0.00 -2.01 0.00 0.00 31.31 29.51 1gxd n TRP 484 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.69 175.33 1gxd h PRO 485 N 3.98 0.88 0.00 -0.99 0.11 -1.75 0.14 132.00 134.38 1gxd h PRO 485 Ca 0.09 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1gxd h PRO 485 Cb 0.85 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.76 1gxd h PRO 485 CO 0.52 0.58 0.00 1.05 -0.21 0.00 0.00 178.00 179.94 1gxd h GLU 486 N 0.91 0.00 -6.42 1.05 9.09 -1.93 -3.44 114.58 113.83 1gxd h GLU 486 Ca 0.29 0.00 -0.54 0.00 0.05 0.00 0.00 59.36 59.16 1gxd h GLU 486 Cb 0.02 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.12 1gxd h GLU 486 CO -0.08 0.00 0.58 -1.17 0.05 0.00 0.00 179.01 178.39 1gxd s LEU 487 N -5.41 4.34 0.98 3.06 2.96 0.04 -5.02 118.68 119.63 1gxd s LEU 487 Ca 0.04 1.92 -0.12 0.00 -0.22 0.00 0.00 54.13 55.74 1gxd s LEU 487 Cb 0.09 -3.57 0.18 0.00 0.50 0.00 0.00 46.19 43.38 1gxd s LEU 487 CO 0.50 -0.48 1.10 -2.84 -1.32 0.00 0.00 176.35 173.31 1gxd s PRO 488 N 1.39 0.60 0.25 0.98 0.02 -1.26 -4.85 135.00 132.13 1gxd s PRO 488 Ca 0.57 0.55 -0.30 0.00 0.02 0.00 0.00 61.00 61.84 1gxd s PRO 488 Cb -0.27 -1.75 -0.09 0.00 0.02 0.00 0.00 34.50 32.40 1gxd s PRO 488 CO 0.27 -2.63 1.02 -2.00 -0.33 0.00 0.00 177.00 173.34 1gxd s GLU 489 N -4.98 4.74 -0.41 5.54 2.12 -1.26 -4.12 118.70 120.33 1gxd s GLU 489 Ca 0.65 1.64 -0.00 0.00 0.36 0.00 0.00 54.97 57.62 1gxd s GLU 489 Cb -0.18 -3.24 -0.00 0.00 0.26 0.00 0.00 34.13 30.96 1gxd s GLU 489 CO 0.57 0.35 0.34 1.17 -0.54 0.00 0.00 175.26 177.15 1gxd n LYS 490 N 1.45 -2.12 -0.86 4.30 4.81 -1.26 -4.97 118.16 119.50 1gxd n LYS 490 Ca -0.01 0.29 -0.32 0.00 -0.87 0.00 0.00 58.31 57.40 1gxd n LYS 490 Cb 0.46 -3.59 0.15 0.00 0.02 0.00 0.00 35.03 32.07 1gxd n LYS 490 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 1gxd s ILE 491 N -3.12 2.05 -0.45 3.15 -4.36 -1.26 -4.73 121.20 112.48 1gxd s ILE 491 Ca 0.02 0.02 0.09 0.00 -0.26 0.00 0.00 60.65 60.52 1gxd s ILE 491 Cb -0.00 -2.19 -0.10 0.00 1.25 0.00 0.00 42.46 41.42 1gxd s ILE 491 CO 0.25 -0.02 0.40 0.47 0.24 0.00 0.00 174.94 176.28 1gxd n ASP 492 N -3.86 0.46 -3.57 4.36 8.00 0.69 -4.57 116.55 118.05 1gxd n ASP 492 Ca 0.13 -0.73 -0.05 0.00 0.71 0.00 0.00 54.79 54.84 1gxd n ASP 492 Cb 0.51 0.99 -0.02 0.00 -0.02 0.00 0.00 41.12 42.58 1gxd n ASP 492 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gxd s ALA 493 N -1.86 -1.99 -0.21 2.24 0.00 -1.00 -4.28 121.76 114.66 1gxd s ALA 493 Ca 0.04 1.34 -0.05 0.00 0.00 0.00 0.00 51.96 53.28 1gxd s ALA 493 Cb 0.07 0.10 0.10 0.00 0.00 0.00 0.00 23.12 23.39 1gxd s ALA 493 CO 0.38 -0.66 0.38 0.08 0.00 0.00 0.00 175.76 175.94 1gxd s VAL 494 N -2.67 -0.60 -0.01 0.00 1.01 -1.26 -0.70 120.40 116.18 1gxd s VAL 494 Ca 0.08 0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.21 1gxd s VAL 494 Cb -0.01 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 1gxd s VAL 494 CO -0.06 0.00 -0.15 -0.72 0.00 0.00 0.00 175.10 174.18 1gxd s TYR 495 N 2.56 2.66 0.00 5.22 1.13 0.44 -4.67 117.35 124.70 1gxd s TYR 495 Ca 0.04 -0.19 -0.30 0.00 -1.41 0.00 0.00 57.07 55.21 1gxd s TYR 495 Cb -0.13 -1.56 -0.05 0.00 -1.10 0.00 0.00 41.96 39.12 1gxd s TYR 495 CO -0.13 0.23 1.27 -2.00 -2.51 0.00 0.00 175.55 172.40 1gxd s GLU 496 N -1.08 4.35 0.34 -3.49 2.12 -1.26 -0.09 118.70 119.58 1gxd s GLU 496 Ca 0.13 1.81 -0.26 0.00 0.36 0.00 0.00 54.97 57.01 1gxd s GLU 496 Cb -0.11 -3.48 -0.13 0.00 0.26 0.00 0.00 34.13 30.67 1gxd s GLU 496 CO 0.03 -0.43 0.90 0.00 -0.54 0.00 0.00 175.26 175.23 1gxd n ALA 497 N 4.80 -0.50 0.18 6.30 0.00 -0.61 -4.62 120.51 126.06 1gxd n ALA 497 Ca 0.11 0.32 -0.07 0.00 0.00 0.00 0.00 53.44 53.80 1gxd n ALA 497 Cb 0.45 -1.97 -0.03 0.00 0.00 0.00 0.00 19.45 17.90 1gxd n ALA 497 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1gxd h PRO 498 N 1.63 -0.45 -0.68 0.00 0.11 -1.92 -3.37 132.00 127.31 1gxd h PRO 498 Ca -0.40 0.03 -0.36 0.00 0.11 0.00 0.00 66.00 65.38 1gxd h PRO 498 Cb 1.36 0.10 -0.41 0.00 0.11 0.00 0.00 31.00 32.16 1gxd h PRO 498 CO 0.58 -0.30 -1.03 1.04 -0.21 0.00 0.00 178.00 178.08 1gxd n GLN 499 N -3.52 2.23 -3.70 1.05 6.02 -1.26 -4.98 117.38 113.21 1gxd n GLN 499 Ca -0.06 -3.71 -0.12 0.00 -0.01 0.00 0.00 57.00 53.11 1gxd n GLN 499 Cb 0.18 -1.76 -0.12 0.00 1.02 0.00 0.00 30.24 29.56 1gxd n GLN 499 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1gxd s GLU 500 N -3.63 0.25 0.00 -1.09 2.12 -1.26 -5.04 118.70 110.06 1gxd s GLU 500 Ca 0.34 0.69 0.00 0.00 0.36 0.00 0.00 54.97 56.36 1gxd s GLU 500 Cb 0.37 -0.04 0.00 0.00 0.26 0.00 0.00 34.13 34.72 1gxd s GLU 500 CO -0.02 -0.19 0.50 0.39 -0.54 0.00 0.00 175.26 175.40 1gxd n GLU 501 N 4.56 0.35 -4.17 4.30 -0.58 -1.26 -4.03 120.64 119.82 1gxd n GLU 501 Ca -0.20 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.25 1gxd n GLU 501 Cb 0.53 -1.33 -0.08 0.00 -0.57 0.00 0.00 31.44 29.99 1gxd n GLU 501 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1gxd s LYS 502 N 0.94 2.41 -0.24 3.49 3.01 -1.26 -4.65 119.74 123.44 1gxd s LYS 502 Ca 0.00 -0.94 -0.15 0.00 -1.01 0.00 0.00 55.97 53.87 1gxd s LYS 502 Cb 0.00 -2.44 -0.04 0.00 -1.01 0.00 0.00 37.83 34.34 1gxd s LYS 502 CO 0.00 0.51 0.35 0.00 0.51 0.00 0.00 175.35 176.73 1gxd s ALA 503 N -1.38 3.57 -0.20 5.17 0.00 1.73 -1.57 121.76 129.09 1gxd s ALA 503 Ca 0.25 -0.71 -0.09 0.00 0.00 0.00 0.00 51.96 51.41 1gxd s ALA 503 Cb -0.11 -2.63 -0.04 0.00 0.00 0.00 0.00 23.12 20.34 1gxd s ALA 503 CO 0.17 -0.46 0.10 0.08 0.00 0.00 0.00 175.76 175.65 1gxd s VAL 504 N 1.64 5.00 0.38 0.00 1.01 0.87 0.22 120.40 129.52 1gxd s VAL 504 Ca 0.16 0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.26 1gxd s VAL 504 Cb -0.15 -3.28 -0.06 0.00 0.00 0.00 0.00 36.38 32.89 1gxd s VAL 504 CO 0.08 0.43 0.08 -0.36 0.00 0.00 0.00 175.10 175.33 1gxd s PHE 505 N 0.57 2.56 -0.08 5.22 0.08 0.24 0.17 117.98 126.74 1gxd s PHE 505 Ca 0.05 -0.55 -0.06 0.00 0.12 0.00 0.00 56.93 56.49 1gxd s PHE 505 Cb -0.12 -1.74 0.03 0.00 -0.57 0.00 0.00 43.02 40.62 1gxd s PHE 505 CO 0.01 0.36 0.20 -0.06 -0.10 0.00 0.00 175.22 175.63 1gxd s PHE 506 N -2.59 -0.23 -0.30 0.36 0.08 0.12 -2.74 117.98 112.68 1gxd s PHE 506 Ca 0.37 0.57 0.00 0.00 0.12 0.00 0.00 56.93 58.00 1gxd s PHE 506 Cb 0.04 0.05 0.19 0.00 -0.57 0.00 0.00 43.02 42.73 1gxd s PHE 506 CO 0.20 -0.14 0.67 0.00 -0.10 0.00 0.00 175.22 175.86 1gxd s ALA 507 N 0.47 -2.58 0.00 5.36 0.00 -1.14 -0.22 121.76 123.65 1gxd s ALA 507 Ca -0.03 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.33 1gxd s ALA 507 Cb -0.04 -2.43 0.00 0.00 0.00 0.00 0.00 23.12 20.65 1gxd s ALA 507 CO -0.02 -1.64 0.00 0.41 0.00 0.00 0.00 175.76 174.50 1gxd n GLY 508 N 5.40 2.64 1.32 0.00 0.00 -1.26 -2.93 105.19 110.36 1gxd n GLY 508 Ca 0.02 -0.28 0.12 0.00 0.00 0.00 0.00 46.02 45.88 1gxd n GLY 508 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1gxd n ASN 509 N 7.55 3.86 -4.36 1.61 4.05 -1.26 -3.80 115.26 122.91 1gxd n ASN 509 Ca 0.00 -2.00 -0.20 0.00 0.45 0.00 0.00 54.58 52.83 1gxd n ASN 509 Cb 0.00 -0.45 -0.10 0.00 1.23 0.00 0.00 39.78 40.46 1gxd n ASN 509 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1gxd s GLU 510 N -1.10 1.35 0.21 1.20 2.02 -1.15 0.30 118.70 121.53 1gxd s GLU 510 Ca 0.47 -1.57 0.09 0.00 0.02 0.00 0.00 54.97 53.99 1gxd s GLU 510 Cb 0.25 -1.23 -0.04 0.00 0.10 0.00 0.00 34.13 33.21 1gxd s GLU 510 CO 0.33 0.22 -0.10 1.52 0.02 0.00 0.00 175.26 177.25 1gxd s TYR 511 N -2.73 2.59 -0.09 1.61 1.13 -1.14 -2.87 117.35 115.86 1gxd s TYR 511 Ca 0.22 -0.24 -0.03 0.00 -1.41 0.00 0.00 57.07 55.60 1gxd s TYR 511 Cb -0.02 -1.23 0.05 0.00 -1.10 0.00 0.00 41.96 39.65 1gxd s TYR 511 CO 0.08 0.55 0.15 -1.58 -2.51 0.00 0.00 175.55 172.23 1gxd s TRP 512 N -1.89 -0.14 -0.17 -3.49 0.51 -1.11 -4.16 118.94 108.49 1gxd s TRP 512 Ca 0.26 0.53 -0.07 0.00 -2.12 0.00 0.00 56.10 54.70 1gxd s TRP 512 Cb -0.08 -0.30 -0.04 0.00 -0.81 0.00 0.00 33.47 32.24 1gxd s TRP 512 CO 0.16 -0.28 0.05 0.42 -0.51 0.00 0.00 176.95 176.79 1gxd s ILE 513 N 2.28 4.69 0.07 2.03 1.01 -1.26 0.80 121.20 130.82 1gxd s ILE 513 Ca 0.03 -0.07 0.09 0.00 0.00 0.00 0.00 60.65 60.70 1gxd s ILE 513 Cb -0.12 -3.10 -0.03 0.00 0.01 0.00 0.00 42.46 39.22 1gxd s ILE 513 CO -0.06 0.48 -0.23 -0.31 0.00 0.00 0.00 174.94 174.82 1gxd s TYR 514 N 0.26 2.03 -0.15 3.97 1.51 0.60 -4.05 117.35 121.51 1gxd s TYR 514 Ca 0.03 -0.39 -0.06 0.00 -1.01 0.00 0.00 57.07 55.63 1gxd s TYR 514 Cb -0.12 -1.17 0.07 0.00 -0.11 0.00 0.00 41.96 40.63 1gxd s TYR 514 CO 0.01 0.17 0.34 0.45 -1.11 0.00 0.00 175.55 175.41 1gxd s SER 515 N -1.52 -0.12 -1.44 2.29 0.15 -1.21 0.48 113.70 112.32 1gxd s SER 515 Ca 0.10 0.76 -0.11 0.00 0.70 0.00 0.00 55.95 57.40 1gxd s SER 515 Cb -0.10 0.85 0.08 0.00 -1.71 0.00 0.00 66.02 65.14 1gxd s SER 515 CO 0.03 -0.21 0.70 0.00 1.20 0.00 0.00 173.24 174.96 1gxd n ALA 516 N 4.92 -1.14 -2.87 5.45 0.00 -1.26 -1.03 120.51 124.58 1gxd n ALA 516 Ca -0.14 0.14 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 1gxd n ALA 516 Cb 0.51 -3.56 0.03 0.00 0.00 0.00 0.00 19.45 16.43 1gxd n ALA 516 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1gxd n SER 517 N -2.53 -5.90 -3.84 0.00 3.41 -1.26 -5.00 113.62 98.50 1gxd n SER 517 Ca 0.00 -0.23 -0.24 0.00 -0.26 0.00 0.00 58.87 58.15 1gxd n SER 517 Cb 0.54 -4.76 -0.17 0.00 -0.26 0.00 0.00 64.21 59.56 1gxd n SER 517 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1gxd s THR 518 N -3.12 0.64 0.13 6.66 -1.32 -0.20 -5.09 115.64 113.34 1gxd s THR 518 Ca 0.23 -0.06 -0.30 0.00 -1.21 0.00 0.00 61.69 60.35 1gxd s THR 518 Cb -0.10 -0.73 -0.07 0.00 -1.51 0.00 0.00 72.50 70.09 1gxd s THR 518 CO 0.29 0.30 1.11 -0.22 -2.21 0.00 0.00 174.62 173.89 1gxd s LEU 519 N 1.75 4.45 0.33 9.08 2.96 -1.26 -3.34 118.68 132.65 1gxd s LEU 519 Ca 0.03 2.03 -0.22 0.00 -0.22 0.00 0.00 54.13 55.75 1gxd s LEU 519 Cb -0.13 -3.59 -0.10 0.00 0.50 0.00 0.00 46.19 42.87 1gxd s LEU 519 CO -0.06 -0.29 0.87 -1.61 -1.32 0.00 0.00 176.35 173.94 1gxd s GLU 520 N 0.14 4.33 0.33 1.98 0.41 -1.26 -5.02 118.70 119.62 1gxd s GLU 520 Ca 0.52 1.08 -0.29 0.00 -0.41 0.00 0.00 54.97 55.87 1gxd s GLU 520 Cb -0.29 -2.59 -0.10 0.00 -1.78 0.00 0.00 34.13 29.37 1gxd s GLU 520 CO 0.33 0.20 1.32 0.50 -0.49 0.00 0.00 175.26 177.12 1gxd s ARG 521 N -2.48 4.34 0.00 1.61 3.52 -1.26 -3.17 118.95 121.51 1gxd s ARG 521 Ca 0.52 2.24 0.00 0.00 -0.13 0.00 0.00 55.73 58.37 1gxd s ARG 521 Cb -0.14 -3.07 0.00 0.00 -1.56 0.00 0.00 34.95 30.18 1gxd s ARG 521 CO 0.19 -0.22 0.00 0.41 -0.81 0.00 0.00 175.30 174.87 1gxd n GLY 522 N 0.82 3.11 3.75 8.12 0.00 -1.26 -5.02 105.19 114.72 1gxd n GLY 522 Ca 0.00 -0.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.77 1gxd n GLY 522 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gxd s TYR 523 N 0.00 3.82 0.39 1.61 1.51 -1.19 -3.87 117.35 119.62 1gxd s TYR 523 Ca 0.00 1.58 -0.13 0.00 -1.01 0.00 0.00 57.07 57.52 1gxd s TYR 523 Cb 0.00 -2.83 -0.07 0.00 -0.11 0.00 0.00 41.96 38.94 1gxd s TYR 523 CO 0.00 0.36 0.79 -1.25 -1.11 0.00 0.00 175.55 174.34 1gxd s PRO 524 N -0.49 3.88 0.04 -1.71 0.04 -1.26 -4.71 135.00 130.79 1gxd s PRO 524 Ca 0.38 0.61 -0.09 0.00 0.04 0.00 0.00 61.00 61.95 1gxd s PRO 524 Cb -0.22 -2.37 0.00 0.00 0.04 0.00 0.00 34.50 31.96 1gxd s PRO 524 CO 0.25 -0.01 0.18 0.15 0.04 0.00 0.00 177.00 177.62 1gxd s LYS 525 N -3.59 0.68 0.42 4.56 1.02 -1.25 -5.04 119.74 116.53 1gxd s LYS 525 Ca 0.53 -0.66 -0.26 0.00 0.02 0.00 0.00 55.97 55.61 1gxd s LYS 525 Cb -0.10 0.28 -0.10 0.00 -0.52 0.00 0.00 37.83 37.39 1gxd s LYS 525 CO 0.26 -0.19 1.30 -2.30 -0.92 0.00 0.00 175.35 173.50 1gxd n PRO 526 N 0.67 2.01 0.00 -1.68 -0.02 -1.26 -2.89 135.00 131.84 1gxd n PRO 526 Ca -0.19 0.72 0.08 0.00 -2.02 0.00 0.00 63.50 62.09 1gxd n PRO 526 Cb 0.59 -2.42 0.48 0.00 -0.02 0.00 0.00 33.50 32.13 1gxd n PRO 526 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1gxd n LEU 527 N 0.21 0.00 0.00 2.45 0.00 0.86 -3.41 117.00 117.11 1gxd n LEU 527 Ca 0.06 0.00 0.08 0.00 0.00 0.00 0.00 56.01 56.15 1gxd n LEU 527 Cb 0.39 0.00 0.43 0.00 0.00 0.00 0.00 43.42 44.24 1gxd n LEU 527 CO 0.59 0.00 0.73 0.35 0.00 0.00 0.00 177.39 179.07 1gxd n THR 528 N -0.89 0.44 -0.06 1.96 -2.24 -1.26 -3.21 114.28 109.02 1gxd n THR 528 Ca 0.12 0.11 -0.06 0.00 -2.27 0.00 0.00 64.05 61.96 1gxd n THR 528 Cb 0.06 -0.84 -0.09 0.00 -2.10 0.00 0.00 70.33 67.35 1gxd n THR 528 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1gxd n SER 529 N -1.24 2.08 -4.58 3.42 7.64 -1.22 -3.95 113.62 115.77 1gxd n SER 529 Ca 0.09 0.00 -0.54 0.00 1.01 0.00 0.00 58.87 59.43 1gxd n SER 529 Cb 0.12 0.80 -0.06 0.00 -1.01 0.00 0.00 64.21 64.05 1gxd n SER 529 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1gxd n LEU 530 N -2.43 1.35 0.00 -3.43 4.32 -1.20 -4.26 117.00 111.35 1gxd n LEU 530 Ca -0.19 1.13 0.00 0.00 -0.02 0.00 0.00 56.01 56.92 1gxd n LEU 530 Cb 0.88 -1.13 0.00 0.00 -1.62 0.00 0.00 43.42 41.55 1gxd n LEU 530 CO 0.25 -1.18 0.00 0.61 -1.22 0.00 0.00 177.39 175.85 1gxd n GLY 531 N 2.42 0.00 3.73 -0.72 0.00 -1.26 -4.48 105.19 104.87 1gxd n GLY 531 Ca 0.19 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 1gxd n GLY 531 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1gxd s LEU 532 N 0.00 3.13 0.52 0.99 2.34 -1.26 -4.59 118.68 119.80 1gxd s LEU 532 Ca 0.00 -1.02 -0.21 0.00 0.06 0.00 0.00 54.13 52.96 1gxd s LEU 532 Cb 0.00 -1.48 -0.06 0.00 -0.56 0.00 0.00 46.19 44.09 1gxd s LEU 532 CO 0.00 -0.47 1.15 -2.16 -1.06 0.00 0.00 176.35 173.81 1gxd s PRO 533 N -3.88 3.47 0.00 1.48 0.04 -1.26 -4.67 135.00 130.18 1gxd s PRO 533 Ca 0.40 1.70 -0.00 0.00 0.04 0.00 0.00 61.00 63.14 1gxd s PRO 533 Cb 0.02 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.39 1gxd s PRO 533 CO 0.22 -0.78 1.41 -2.30 0.04 0.00 0.00 177.00 175.59 1gxd n PRO 534 N -1.02 0.71 0.00 0.56 -0.02 -1.25 -3.39 135.00 130.58 1gxd n PRO 534 Ca 0.10 -0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1gxd n PRO 534 Cb 0.50 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.71 1gxd n PRO 534 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1gxd n ASP 535 N 1.82 2.51 -3.74 2.55 2.03 -1.26 -4.85 116.55 115.62 1gxd n ASP 535 Ca 0.04 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.93 1gxd n ASP 535 Cb 0.35 0.25 0.01 0.00 -0.72 0.00 0.00 41.12 41.01 1gxd n ASP 535 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1gxd n VAL 536 N -1.25 5.47 -0.16 5.18 0.24 -1.22 -4.86 118.33 121.73 1gxd n VAL 536 Ca 0.00 -5.39 -0.06 0.00 -2.04 0.00 0.00 64.34 56.85 1gxd n VAL 536 Cb 0.25 -1.92 0.03 0.00 -1.47 0.00 0.00 33.84 30.73 1gxd n VAL 536 CO 0.00 0.00 0.00 0.06 -2.14 0.00 0.00 176.83 174.75 1gxd h GLN 537 N 4.85 0.56 -5.11 7.34 3.07 -1.88 -3.41 115.11 120.52 1gxd h GLN 537 Ca 0.46 -0.03 -0.66 0.00 0.09 0.00 0.00 58.65 58.51 1gxd h GLN 537 Cb 0.44 -0.13 -0.16 0.00 0.08 0.00 0.00 27.48 27.71 1gxd h GLN 537 CO 1.35 0.37 -0.14 -0.98 0.09 0.00 0.00 178.83 179.53 1gxd s ARG 538 N -6.14 3.54 -0.67 0.06 1.70 -1.25 -4.48 118.95 111.71 1gxd s ARG 538 Ca -0.13 -0.31 -0.22 0.00 -0.47 0.00 0.00 55.73 54.61 1gxd s ARG 538 Cb 0.13 -3.83 0.08 0.00 -0.57 0.00 0.00 34.95 30.76 1gxd s ARG 538 CO 0.74 -0.64 0.94 0.08 -1.08 0.00 0.00 175.30 175.34 1gxd s VAL 539 N 2.26 4.44 0.24 4.99 1.01 -1.26 -4.88 120.40 127.19 1gxd s VAL 539 Ca 0.16 -0.57 0.31 0.00 0.00 0.00 0.00 61.98 61.88 1gxd s VAL 539 Cb -0.16 -4.66 0.31 0.00 0.00 0.00 0.00 36.38 31.87 1gxd s VAL 539 CO 0.13 -1.41 1.94 0.44 0.00 0.00 0.00 175.10 176.20 1gxd h ASP 540 N 9.44 0.00 -5.04 3.32 3.32 -1.61 -3.41 116.42 122.44 1gxd h ASP 540 Ca -0.25 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.82 1gxd h ASP 540 Cb 1.07 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.58 1gxd h ASP 540 CO 1.16 0.00 0.19 0.00 -1.72 0.00 0.00 179.24 178.87 1gxd s ALA 541 N -3.82 -0.93 -0.04 3.45 0.00 -1.20 -4.46 121.76 114.77 1gxd s ALA 541 Ca -0.03 -0.52 -0.31 0.00 0.00 0.00 0.00 51.96 51.10 1gxd s ALA 541 Cb 0.09 0.84 0.11 0.00 0.00 0.00 0.00 23.12 24.17 1gxd s ALA 541 CO 0.28 -1.00 1.15 0.00 0.00 0.00 0.00 175.76 176.20 1gxd s ALA 542 N -3.51 -2.03 0.00 0.00 0.00 -1.25 -3.00 121.76 111.97 1gxd s ALA 542 Ca 0.14 0.91 0.00 0.00 0.00 0.00 0.00 51.96 53.01 1gxd s ALA 542 Cb -0.05 0.27 0.00 0.00 0.00 0.00 0.00 23.12 23.34 1gxd s ALA 542 CO 0.09 -0.87 0.00 1.97 0.00 0.00 0.00 175.76 176.95 1gxd n PHE 543 N -0.33 0.00 -4.65 0.00 -1.74 -1.26 -4.42 117.46 105.06 1gxd n PHE 543 Ca -0.05 0.00 -0.25 0.00 -0.56 0.00 0.00 57.45 56.59 1gxd n PHE 543 Cb 0.61 0.00 -0.16 0.00 1.52 0.00 0.00 39.48 41.45 1gxd n PHE 543 CO 0.00 0.00 0.00 1.21 -0.56 0.00 0.00 176.76 177.41 1gxd s ASN 544 N 0.00 1.86 0.07 5.98 3.84 -1.25 -2.06 114.94 123.38 1gxd s ASN 544 Ca 0.00 -0.31 0.01 0.00 0.21 0.00 0.00 52.86 52.77 1gxd s ASN 544 Cb 0.00 -0.72 -0.04 0.00 -0.55 0.00 0.00 41.25 39.94 1gxd s ASN 544 CO 0.00 0.07 -0.06 -1.66 -2.79 0.00 0.00 177.10 172.66 1gxd s TRP 545 N 0.42 0.72 0.00 0.43 1.48 -1.25 -4.80 118.94 115.95 1gxd s TRP 545 Ca -0.10 -0.81 0.00 0.00 -1.06 0.00 0.00 56.10 54.13 1gxd s TRP 545 Cb -0.14 -0.44 0.00 0.00 -1.16 0.00 0.00 33.47 31.73 1gxd s TRP 545 CO 0.03 -0.18 0.00 0.45 -4.06 0.00 0.00 176.95 173.19 1gxd n SER 546 N 0.48 0.00 0.00 -2.66 2.88 -1.26 -1.68 113.62 111.38 1gxd n SER 546 Ca -0.16 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.38 1gxd n SER 546 Cb 0.59 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 64.05 1gxd n SER 546 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1gxd h LYS 547 N 0.00 -0.00 0.00 -1.46 3.64 -1.99 -3.24 116.57 113.52 1gxd h LYS 547 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1gxd h LYS 547 Cb 0.00 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1gxd h LYS 547 CO 0.00 -0.00 -0.04 -2.95 -2.27 0.00 0.00 179.45 174.19 1gxd h ASN 548 N -0.00 0.00 -6.78 4.20 -1.07 -2.02 -3.46 115.58 106.45 1gxd h ASN 548 Ca -0.00 0.00 -0.56 0.00 0.07 0.00 0.00 56.30 55.81 1gxd h ASN 548 Cb 0.00 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 36.12 1gxd h ASN 548 CO 0.00 0.04 -0.92 0.29 0.07 0.00 0.00 177.43 176.90 1gxd n LYS 549 N -3.78 -2.19 -4.34 4.14 4.76 -0.68 -4.95 118.16 111.13 1gxd n LYS 549 Ca -0.03 0.26 -0.21 0.00 -2.87 0.00 0.00 58.31 55.46 1gxd n LYS 549 Cb 0.13 -4.12 -0.08 0.00 -1.84 0.00 0.00 35.03 29.12 1gxd n LYS 549 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1gxd s LYS 550 N -6.95 1.77 -0.12 1.97 1.02 -1.26 -4.87 119.74 111.30 1gxd s LYS 550 Ca 0.03 -2.04 -0.02 0.00 0.02 0.00 0.00 55.97 53.97 1gxd s LYS 550 Cb -0.02 0.06 -0.03 0.00 -0.52 0.00 0.00 37.83 37.33 1gxd s LYS 550 CO 0.94 -0.58 -0.06 0.99 -0.92 0.00 0.00 175.35 175.72 1gxd s THR 551 N -3.43 3.76 -0.40 2.17 2.01 -1.18 -3.78 115.64 114.79 1gxd s THR 551 Ca 0.36 -0.43 -0.08 0.00 0.31 0.00 0.00 61.69 61.86 1gxd s THR 551 Cb 0.03 -2.60 0.07 0.00 0.01 0.00 0.00 72.50 70.01 1gxd s THR 551 CO 0.23 0.54 0.22 -0.31 -0.69 0.00 0.00 174.62 174.61 1gxd s TYR 552 N -0.13 3.35 -0.42 4.92 1.51 -0.88 -0.89 117.35 124.82 1gxd s TYR 552 Ca 0.02 -1.64 -0.24 0.00 -1.01 0.00 0.00 57.07 54.20 1gxd s TYR 552 Cb -0.13 -2.85 0.02 0.00 -0.11 0.00 0.00 41.96 38.89 1gxd s TYR 552 CO 0.03 -0.84 0.86 0.42 -1.11 0.00 0.00 175.55 174.90 1gxd s ILE 553 N 1.38 4.59 0.01 2.71 1.09 -0.43 -3.81 121.20 126.74 1gxd s ILE 553 Ca 0.03 0.79 -0.06 0.00 -1.10 0.00 0.00 60.65 60.30 1gxd s ILE 553 Cb -0.22 -4.34 -0.05 0.00 -1.06 0.00 0.00 42.46 36.79 1gxd s ILE 553 CO 0.01 -0.66 0.26 -0.36 -0.10 0.00 0.00 174.94 174.09 1gxd s PHE 554 N 3.45 3.57 0.00 3.97 0.08 -1.16 0.83 117.98 128.71 1gxd s PHE 554 Ca 0.34 0.54 0.00 0.00 0.12 0.00 0.00 56.93 57.93 1gxd s PHE 554 Cb -0.12 -1.97 0.00 0.00 -0.57 0.00 0.00 43.02 40.37 1gxd s PHE 554 CO 0.22 0.61 0.79 0.00 -0.10 0.00 0.00 175.22 176.74 1gxd n ALA 555 N 1.05 1.70 0.00 5.36 0.00 -0.97 -1.78 120.51 125.87 1gxd n ALA 555 Ca -0.11 -0.74 0.00 0.00 0.00 0.00 0.00 53.44 52.59 1gxd n ALA 555 Cb 0.53 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.67 1gxd n ALA 555 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gxd n GLY 556 N 0.00 1.99 0.11 0.00 0.00 -1.26 -4.60 105.19 101.43 1gxd n GLY 556 Ca 0.00 -0.66 -0.15 0.00 0.00 0.00 0.00 46.02 45.21 1gxd n GLY 556 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1gxd h ASP 557 N 0.00 0.29 -3.71 1.61 5.19 -1.96 -3.35 116.42 114.49 1gxd h ASP 557 Ca 0.00 -0.45 -0.40 0.00 -0.62 0.00 0.00 57.03 55.56 1gxd h ASP 557 Cb 0.00 -0.09 -0.16 0.00 0.18 0.00 0.00 39.33 39.26 1gxd h ASP 557 CO 0.00 1.38 -0.74 -0.54 -3.12 0.00 0.00 179.24 176.22 1gxd s LYS 558 N -2.61 1.15 0.05 3.56 1.02 -1.26 -3.56 119.74 118.09 1gxd s LYS 558 Ca -0.09 -1.43 0.01 0.00 0.02 0.00 0.00 55.97 54.48 1gxd s LYS 558 Cb 0.07 -0.91 -0.03 0.00 -0.52 0.00 0.00 37.83 36.44 1gxd s LYS 558 CO 0.84 0.15 -0.06 -0.59 -0.92 0.00 0.00 175.35 174.77 1gxd s PHE 559 N -2.78 0.61 0.44 3.18 -0.71 -1.26 -2.29 117.98 115.17 1gxd s PHE 559 Ca 0.16 -0.71 0.06 0.00 -1.04 0.00 0.00 56.93 55.40 1gxd s PHE 559 Cb -0.01 -0.38 -0.05 0.00 -1.21 0.00 0.00 43.02 41.37 1gxd s PHE 559 CO 0.04 -0.18 0.11 -1.58 -1.34 0.00 0.00 175.22 172.27 1gxd s TRP 560 N -2.39 2.36 -0.05 3.49 0.51 0.24 -4.56 118.94 118.55 1gxd s TRP 560 Ca -0.03 -0.70 -0.01 0.00 -2.12 0.00 0.00 56.10 53.23 1gxd s TRP 560 Cb -0.03 -1.83 0.03 0.00 -0.81 0.00 0.00 33.47 30.82 1gxd s TRP 560 CO -0.03 0.23 0.03 1.03 -0.51 0.00 0.00 176.95 177.70 1gxd s ARG 561 N -3.86 0.25 0.21 4.98 0.52 -1.26 -1.31 118.95 118.48 1gxd s ARG 561 Ca 0.32 0.22 0.05 0.00 -0.52 0.00 0.00 55.73 55.80 1gxd s ARG 561 Cb 0.05 -0.69 -0.03 0.00 0.52 0.00 0.00 34.95 34.80 1gxd s ARG 561 CO 0.17 -0.29 0.26 -0.47 0.02 0.00 0.00 175.30 175.00 1gxd s TYR 562 N 1.91 3.33 -0.19 -0.53 5.04 -0.07 -3.92 117.35 122.91 1gxd s TYR 562 Ca 0.03 -0.01 -0.05 0.00 -2.44 0.00 0.00 57.07 54.61 1gxd s TYR 562 Cb -0.12 -1.55 0.07 0.00 0.35 0.00 0.00 41.96 40.71 1gxd s TYR 562 CO -0.04 0.49 0.14 0.54 -1.34 0.00 0.00 175.55 175.34 1gxd s ASN 563 N -3.60 2.08 0.31 4.32 6.03 -1.26 -3.08 114.94 119.73 1gxd s ASN 563 Ca 0.33 -0.52 0.24 0.00 -1.03 0.00 0.00 52.86 51.88 1gxd s ASN 563 Cb -0.09 -0.04 1.11 0.00 -3.03 0.00 0.00 41.25 39.19 1gxd s ASN 563 CO 0.27 -0.35 1.73 -0.33 -2.03 0.00 0.00 177.10 176.39 1gxd h GLU 564 N 8.38 0.00 -0.01 3.55 4.39 -1.93 1.07 114.58 130.04 1gxd h GLU 564 Ca -0.16 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.54 1gxd h GLU 564 Cb 1.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 1gxd h GLU 564 CO 0.29 0.00 -0.29 1.33 -1.16 0.00 0.00 179.01 179.18 1gxd n VAL 565 N -2.32 0.00 0.00 3.13 0.24 -1.26 -4.04 118.33 114.09 1gxd n VAL 565 Ca 0.01 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1gxd n VAL 565 Cb 0.16 0.70 0.00 0.00 -1.47 0.00 0.00 33.84 33.24 1gxd n VAL 565 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1gxd n LYS 566 N -0.32 2.39 -0.10 7.34 5.02 -0.90 -5.00 118.16 126.59 1gxd n LYS 566 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1gxd n LYS 566 Cb 0.39 -0.18 0.00 0.00 -0.02 0.00 0.00 35.03 35.23 1gxd n LYS 566 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1gxd n LYS 567 N -0.34 0.00 -3.58 1.97 5.02 0.37 -4.86 118.16 116.73 1gxd n LYS 567 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 1gxd n LYS 567 Cb 0.00 -2.60 -0.06 0.00 -0.02 0.00 0.00 35.03 32.35 1gxd n LYS 567 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1gxd s LYS 568 N -0.20 3.98 -0.09 1.97 -2.85 -1.26 -4.76 119.74 116.53 1gxd s LYS 568 Ca 0.00 0.17 -0.20 0.00 -1.00 0.00 0.00 55.97 54.95 1gxd s LYS 568 Cb 0.00 -3.31 -0.04 0.00 -2.06 0.00 0.00 37.83 32.42 1gxd s LYS 568 CO 0.00 0.50 0.54 1.41 0.10 0.00 0.00 175.35 177.91 1gxd s MET 569 N -0.36 4.36 0.68 1.78 -2.45 -1.26 -4.24 119.30 117.80 1gxd s MET 569 Ca 0.19 0.58 -0.17 0.00 -1.25 0.00 0.00 55.69 55.05 1gxd s MET 569 Cb -0.14 -3.43 -0.05 0.00 1.25 0.00 0.00 34.83 32.46 1gxd s MET 569 CO 0.07 0.16 0.54 -0.25 1.05 0.00 0.00 175.02 176.60 1gxd n ASP 570 N 3.60 -1.08 -4.54 1.11 8.00 -1.25 -4.78 116.55 117.60 1gxd n ASP 570 Ca -0.06 0.64 -0.45 0.00 0.71 0.00 0.00 54.79 55.63 1gxd n ASP 570 Cb 0.51 -1.21 -0.05 0.00 -0.02 0.00 0.00 41.12 40.36 1gxd n ASP 570 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1gxd n PRO 571 N -0.56 1.53 -3.18 -0.24 -0.02 -1.26 -4.01 135.00 127.25 1gxd n PRO 571 Ca 0.11 0.39 -0.21 0.00 -2.02 0.00 0.00 63.50 61.77 1gxd n PRO 571 Cb 0.49 -2.95 0.01 0.00 -0.02 0.00 0.00 33.50 31.03 1gxd n PRO 571 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gxd n GLY 572 N 6.09 -0.57 0.00 -1.23 0.00 -1.26 -4.92 105.19 103.30 1gxd n GLY 572 Ca 0.35 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.92 1gxd n GLY 572 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1gxd n PHE 573 N -1.37 -1.03 -1.00 1.61 3.72 -1.26 -4.97 117.46 113.17 1gxd n PHE 573 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1gxd n PHE 573 Cb 0.48 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 1gxd n PHE 573 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1gxd n PRO 574 N -0.59 0.88 -0.18 -1.08 -0.04 -1.26 -5.16 135.00 127.57 1gxd n PRO 574 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1gxd n PRO 574 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1gxd n PRO 574 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1gxd n LYS 575 N -0.50 0.00 -3.76 0.54 4.76 -1.26 -5.02 118.16 112.92 1gxd n LYS 575 Ca 0.00 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.19 1gxd n LYS 575 Cb 0.00 0.00 -0.17 0.00 -1.84 0.00 0.00 35.03 33.02 1gxd n LYS 575 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1gxd s LEU 576 N 0.00 0.89 0.29 -0.35 1.43 -1.26 -4.44 118.68 115.23 1gxd s LEU 576 Ca 0.00 -0.44 0.05 0.00 -1.03 0.00 0.00 54.13 52.72 1gxd s LEU 576 Cb 0.00 -0.53 0.79 0.00 0.03 0.00 0.00 46.19 46.48 1gxd s LEU 576 CO 0.00 -0.24 1.39 -0.38 0.23 0.00 0.00 176.35 177.35 1gxd n ILE 577 N 5.09 -0.37 0.87 -0.59 5.41 -1.23 0.17 119.36 128.70 1gxd n ILE 577 Ca -0.08 1.92 0.08 0.00 1.00 0.00 0.00 62.75 65.66 1gxd n ILE 577 Cb 0.49 -2.87 0.43 0.00 -0.71 0.00 0.00 39.64 36.98 1gxd n ILE 577 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1gxd n ALA 578 N -3.03 1.98 0.13 -1.39 0.00 -1.26 -2.39 120.51 114.55 1gxd n ALA 578 Ca 0.24 -0.09 -0.01 0.00 0.00 0.00 0.00 53.44 53.58 1gxd n ALA 578 Cb 0.78 -1.25 0.08 0.00 0.00 0.00 0.00 19.45 19.07 1gxd n ALA 578 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1gxd h ASP 579 N 0.00 0.00 0.00 0.00 1.82 0.13 -3.40 116.42 114.97 1gxd h ASP 579 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1gxd h ASP 579 Cb 0.05 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.06 1gxd h ASP 579 CO 0.00 0.65 -0.14 0.00 -1.61 0.00 0.00 179.24 178.14 1gxd n ALA 580 N -2.32 0.35 -1.19 -0.78 0.00 -1.00 -5.02 120.51 110.54 1gxd n ALA 580 Ca 0.00 -0.31 -0.30 0.00 0.00 0.00 0.00 53.44 52.83 1gxd n ALA 580 Cb 0.72 0.01 0.14 0.00 0.00 0.00 0.00 19.45 20.32 1gxd n ALA 580 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1gxd s TRP 581 N -1.28 2.29 -0.15 0.00 0.52 -1.19 -5.05 118.94 114.09 1gxd s TRP 581 Ca -0.04 1.25 0.01 0.00 0.02 0.00 0.00 56.10 57.35 1gxd s TRP 581 Cb 0.01 -3.17 0.00 0.00 -1.15 0.00 0.00 33.47 29.16 1gxd s TRP 581 CO 0.06 -2.43 -0.18 -0.80 0.02 0.00 0.00 176.95 173.62 1gxd s ASN 582 N -3.40 3.41 -0.44 2.95 0.02 -1.26 -4.63 114.94 111.59 1gxd s ASN 582 Ca 0.64 -0.53 -0.03 0.00 -1.02 0.00 0.00 52.86 51.91 1gxd s ASN 582 Cb -0.18 -1.51 0.00 0.00 0.02 0.00 0.00 41.25 39.58 1gxd s ASN 582 CO 0.57 0.08 0.39 0.00 0.02 0.00 0.00 177.10 178.15 1gxd n ALA 583 N 4.11 -0.44 -4.03 0.60 0.00 -1.26 -5.03 120.51 114.45 1gxd n ALA 583 Ca -0.20 0.13 -0.31 0.00 0.00 0.00 0.00 53.44 53.06 1gxd n ALA 583 Cb 0.52 -2.12 -0.15 0.00 0.00 0.00 0.00 19.45 17.69 1gxd n ALA 583 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1gxd s ILE 584 N -3.11 2.10 0.99 0.00 -1.09 -1.26 -5.07 121.20 113.77 1gxd s ILE 584 Ca 0.19 -1.77 -0.16 0.00 -2.23 0.00 0.00 60.65 56.67 1gxd s ILE 584 Cb -0.08 -2.32 0.21 0.00 -1.58 0.00 0.00 42.46 38.69 1gxd s ILE 584 CO 0.24 -0.20 1.28 -2.84 -1.23 0.00 0.00 174.94 172.19 1gxd s PRO 585 N 1.09 0.41 0.21 2.79 0.02 -1.26 -4.26 135.00 134.00 1gxd s PRO 585 Ca -0.03 -0.31 -0.29 0.00 0.02 0.00 0.00 61.00 60.39 1gxd s PRO 585 Cb -0.20 -1.81 -0.08 0.00 0.02 0.00 0.00 34.50 32.43 1gxd s PRO 585 CO -0.06 -2.58 0.91 -0.51 -0.33 0.00 0.00 177.00 174.43 1gxd s ASP 586 N -4.70 7.59 -0.09 2.53 1.01 -1.26 -4.31 116.67 117.44 1gxd s ASP 586 Ca 0.73 1.88 -0.00 0.00 0.71 0.00 0.00 52.55 55.86 1gxd s ASP 586 Cb -0.05 -2.59 -0.00 0.00 1.01 0.00 0.00 42.92 41.29 1gxd s ASP 586 CO 0.53 0.15 0.08 0.59 0.21 0.00 0.00 175.17 176.73 1gxd n ASN 587 N 1.65 -2.08 -4.74 0.27 5.03 -1.26 -5.01 115.26 109.12 1gxd n ASN 587 Ca -0.02 -0.05 -0.30 0.00 0.87 0.00 0.00 54.58 55.07 1gxd n ASN 587 Cb 0.48 -0.86 0.11 0.00 -1.02 0.00 0.00 39.78 38.49 1gxd n ASN 587 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1gxd s LEU 588 N -2.53 2.68 -0.02 3.41 1.43 -1.26 -4.72 118.68 117.67 1gxd s LEU 588 Ca 0.01 1.69 0.09 0.00 -1.03 0.00 0.00 54.13 54.89 1gxd s LEU 588 Cb -0.00 -4.26 -0.14 0.00 0.03 0.00 0.00 46.19 41.82 1gxd s LEU 588 CO 0.06 -2.34 0.19 0.47 0.23 0.00 0.00 176.35 174.95 1gxd n ASP 589 N -3.71 2.83 -3.92 2.29 8.00 -0.80 -4.69 116.55 116.55 1gxd n ASP 589 Ca 0.08 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.63 1gxd n ASP 589 Cb 0.54 1.35 0.01 0.00 -0.02 0.00 0.00 41.12 42.99 1gxd n ASP 589 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gxd s ALA 590 N -2.60 -2.72 0.00 2.24 0.00 -0.99 -4.46 121.76 113.23 1gxd s ALA 590 Ca -0.04 0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1gxd s ALA 590 Cb 0.06 0.82 0.00 0.00 0.00 0.00 0.00 23.12 24.00 1gxd s ALA 590 CO 0.39 -1.16 0.00 1.55 0.00 0.00 0.00 175.76 176.54 1gxd n VAL 591 N -0.89 0.00 -3.40 0.00 3.14 -1.26 -0.76 118.33 115.16 1gxd n VAL 591 Ca 0.03 0.00 0.02 0.00 -2.96 0.00 0.00 64.34 61.43 1gxd n VAL 591 Cb 0.59 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.34 1gxd n VAL 591 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 1gxd s VAL 592 N 0.00 -0.63 -0.21 1.55 -7.23 -1.09 -4.54 120.40 108.25 1gxd s VAL 592 Ca 0.00 0.00 -0.28 0.00 -1.81 0.00 0.00 61.98 59.89 1gxd s VAL 592 Cb 0.00 -1.00 0.13 0.00 0.56 0.00 0.00 36.38 36.07 1gxd s VAL 592 CO 0.00 0.00 1.06 -0.62 -0.31 0.00 0.00 175.10 175.23 1gxd s ASP 593 N 2.64 -0.35 -0.21 4.85 -1.08 -1.26 -4.59 116.67 116.67 1gxd s ASP 593 Ca -0.01 0.49 -0.02 0.00 -0.52 0.00 0.00 52.55 52.49 1gxd s ASP 593 Cb -0.09 0.43 0.06 0.00 -1.46 0.00 0.00 42.92 41.87 1gxd s ASP 593 CO -0.17 -0.24 0.03 -1.48 0.52 0.00 0.00 175.17 173.82 1gxd s LEU 594 N -0.65 1.38 -1.50 -1.34 2.34 -1.26 -4.75 118.68 112.89 1gxd s LEU 594 Ca 0.01 -0.91 -0.00 0.00 0.06 0.00 0.00 54.13 53.29 1gxd s LEU 594 Cb -0.02 -0.67 0.00 0.00 -0.56 0.00 0.00 46.19 44.94 1gxd s LEU 594 CO -0.02 -0.31 0.02 0.00 -1.06 0.00 0.00 176.35 174.98 1gxd n GLN 595 N 5.00 -1.50 -2.89 1.48 6.02 -1.26 -4.95 117.38 119.28 1gxd n GLN 595 Ca -0.09 0.85 -0.43 0.00 -0.01 0.00 0.00 57.00 57.32 1gxd n GLN 595 Cb 0.46 -5.34 -0.04 0.00 1.02 0.00 0.00 30.24 26.34 1gxd n GLN 595 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1gxd s GLY 596 N -2.22 1.42 -0.77 1.08 0.00 -1.26 -4.14 107.32 101.43 1gxd s GLY 596 Ca 0.01 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 42.98 1gxd s GLY 596 CO 0.01 2.00 0.00 0.61 0.00 0.00 0.00 173.10 175.72 1gxd n GLY 597 N 5.28 0.69 2.01 0.20 0.00 -1.26 0.64 105.19 112.75 1gxd n GLY 597 Ca -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.92 1gxd n GLY 597 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gxd n GLY 598 N -0.08 0.23 3.38 -0.02 0.00 -1.26 -4.98 105.19 102.46 1gxd n GLY 598 Ca -0.07 -0.29 -0.19 0.00 0.00 0.00 0.00 46.02 45.47 1gxd n GLY 598 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1gxd s HIS 599 N -3.13 1.73 -0.31 1.61 3.76 0.21 -1.77 115.29 117.39 1gxd s HIS 599 Ca 0.07 -1.05 -0.01 0.00 -0.15 0.00 0.00 55.06 53.92 1gxd s HIS 599 Cb -0.03 -1.07 0.13 0.00 1.11 0.00 0.00 32.58 32.72 1gxd s HIS 599 CO 0.27 -0.15 0.25 0.45 -0.85 0.00 0.00 174.74 174.71 1gxd s SER 600 N -3.39 2.28 0.28 1.40 0.15 0.51 -4.26 113.70 110.67 1gxd s SER 600 Ca 0.36 -1.24 -0.29 0.00 0.70 0.00 0.00 55.95 55.48 1gxd s SER 600 Cb 0.08 0.16 -0.10 0.00 -1.71 0.00 0.00 66.02 64.45 1gxd s SER 600 CO 0.14 -0.37 1.24 -0.31 1.20 0.00 0.00 173.24 175.14 1gxd s TYR 601 N 1.95 3.27 -0.16 3.44 1.51 -1.26 -2.37 117.35 123.74 1gxd s TYR 601 Ca 0.12 1.46 -0.01 0.00 -1.01 0.00 0.00 57.07 57.63 1gxd s TYR 601 Cb -0.16 -3.53 -0.01 0.00 -0.11 0.00 0.00 41.96 38.15 1gxd s TYR 601 CO -0.24 -1.44 -0.12 -0.06 -1.11 0.00 0.00 175.55 172.57 1gxd s PHE 602 N -0.80 2.83 -0.11 2.71 0.40 0.42 -2.66 117.98 120.77 1gxd s PHE 602 Ca 0.50 -0.85 -0.05 0.00 -0.60 0.00 0.00 56.93 55.93 1gxd s PHE 602 Cb -0.36 -1.91 -0.04 0.00 0.51 0.00 0.00 43.02 41.22 1gxd s PHE 602 CO 0.45 -0.37 0.08 -0.06 0.70 0.00 0.00 175.22 176.03 1gxd s PHE 603 N 0.73 3.41 -0.16 0.36 0.40 0.06 0.14 117.98 122.92 1gxd s PHE 603 Ca -0.06 0.37 -0.25 0.00 -0.60 0.00 0.00 56.93 56.39 1gxd s PHE 603 Cb -0.15 -1.90 0.06 0.00 0.51 0.00 0.00 43.02 41.54 1gxd s PHE 603 CO 0.02 0.58 0.63 0.21 0.70 0.00 0.00 175.22 177.36 1gxd s LYS 604 N -0.84 0.85 1.00 0.44 2.36 -1.12 -1.90 119.74 120.53 1gxd s LYS 604 Ca 0.13 0.59 0.00 0.00 -2.55 0.00 0.00 55.97 54.15 1gxd s LYS 604 Cb -0.12 0.41 0.00 0.00 -1.05 0.00 0.00 37.83 37.07 1gxd s LYS 604 CO 0.03 -0.18 0.00 0.41 1.55 0.00 0.00 175.35 177.16 1gxd n GLY 605 N 1.99 0.35 1.07 5.54 0.00 -1.26 -1.32 105.19 111.57 1gxd n GLY 605 Ca -0.16 0.37 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 1gxd n GLY 605 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gxd n ALA 606 N 5.62 3.02 -3.11 4.61 0.00 -1.26 -4.81 120.51 124.59 1gxd n ALA 606 Ca 0.00 -1.15 -0.13 0.00 0.00 0.00 0.00 53.44 52.16 1gxd n ALA 606 Cb 0.00 -0.43 -0.12 0.00 0.00 0.00 0.00 19.45 18.90 1gxd n ALA 606 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1gxd s TYR 607 N 0.00 -0.25 0.01 0.00 2.02 -0.43 -4.06 117.35 114.64 1gxd s TYR 607 Ca 0.11 0.61 -0.01 0.00 -0.37 0.00 0.00 57.07 57.40 1gxd s TYR 607 Cb 0.12 0.08 -0.04 0.00 -0.40 0.00 0.00 41.96 41.73 1gxd s TYR 607 CO -0.05 -0.12 0.14 1.52 -1.57 0.00 0.00 175.55 175.47 1gxd s TYR 608 N 0.12 3.43 -0.13 2.71 1.13 0.28 -2.78 117.35 122.11 1gxd s TYR 608 Ca -0.00 0.27 -0.03 0.00 -1.41 0.00 0.00 57.07 55.90 1gxd s TYR 608 Cb -0.02 -1.77 -0.03 0.00 -1.10 0.00 0.00 41.96 39.04 1gxd s TYR 608 CO 0.00 0.60 -0.02 -0.51 -2.51 0.00 0.00 175.55 173.11 1gxd s LEU 609 N -1.95 3.40 -0.73 -3.49 1.02 0.37 -1.28 118.68 116.02 1gxd s LEU 609 Ca 0.27 -0.01 -0.17 0.00 0.02 0.00 0.00 54.13 54.23 1gxd s LEU 609 Cb -0.12 -1.80 0.15 0.00 0.02 0.00 0.00 46.19 44.44 1gxd s LEU 609 CO 0.18 0.25 0.77 -0.75 0.02 0.00 0.00 176.35 176.83 1gxd s LYS 610 N -0.14 3.33 0.27 1.70 2.20 -0.04 0.16 119.74 127.21 1gxd s LYS 610 Ca 0.04 -1.85 -0.22 0.00 -0.36 0.00 0.00 55.97 53.58 1gxd s LYS 610 Cb -0.13 -4.44 -0.09 0.00 -1.51 0.00 0.00 37.83 31.66 1gxd s LYS 610 CO 0.02 -1.47 0.82 -1.17 -0.36 0.00 0.00 175.35 173.20 1gxd s LEU 611 N 1.67 4.32 0.23 5.43 0.20 -1.00 -2.86 118.68 126.68 1gxd s LEU 611 Ca 0.16 1.60 -0.06 0.00 0.69 0.00 0.00 54.13 56.51 1gxd s LEU 611 Cb -0.17 -3.81 -0.06 0.00 -0.43 0.00 0.00 46.19 41.73 1gxd s LEU 611 CO -0.02 -0.03 0.51 -0.70 -0.29 0.00 0.00 176.35 175.81 1gxd s GLU 612 N -2.07 3.69 0.00 1.98 2.12 -1.07 -0.36 118.70 122.98 1gxd s GLU 612 Ca 0.47 0.07 0.00 0.00 0.36 0.00 0.00 54.97 55.87 1gxd s GLU 612 Cb -0.17 -2.70 0.00 0.00 0.26 0.00 0.00 34.13 31.52 1gxd s GLU 612 CO 0.22 0.32 0.00 0.09 -0.54 0.00 0.00 175.26 175.34 1gxd n ASN 613 N -0.40 0.00 -0.21 -1.70 5.03 -0.73 -3.44 115.26 113.82 1gxd n ASN 613 Ca -0.01 0.00 -0.05 0.00 0.87 0.00 0.00 54.58 55.39 1gxd n ASN 613 Cb 0.53 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 39.24 1gxd n ASN 613 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1gxd n GLN 614 N 0.00 -0.21 -3.98 3.52 3.00 -1.26 -3.20 117.38 115.24 1gxd n GLN 614 Ca 0.00 0.74 -0.31 0.00 -0.01 0.00 0.00 57.00 57.42 1gxd n GLN 614 Cb 0.00 -1.09 -0.15 0.00 0.00 0.00 0.00 30.24 29.00 1gxd n GLN 614 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 1gxd s SER 615 N -5.24 4.57 0.00 1.08 0.01 -1.26 -5.01 113.70 107.84 1gxd s SER 615 Ca -0.06 -1.92 -0.01 0.00 1.31 0.00 0.00 55.95 55.27 1gxd s SER 615 Cb 0.06 -1.49 -0.01 0.00 0.21 0.00 0.00 66.02 64.79 1gxd s SER 615 CO 0.31 -0.35 0.72 0.00 0.41 0.00 0.00 173.24 174.33 1gxd n LEU 616 N 4.38 0.01 0.00 2.44 -0.00 -1.19 -3.83 117.00 118.81 1gxd n LEU 616 Ca -0.00 -0.86 0.00 0.00 -0.00 0.00 0.00 56.01 55.15 1gxd n LEU 616 Cb 0.42 -0.35 0.00 0.00 -0.00 0.00 0.00 43.42 43.49 1gxd n LEU 616 CO 0.20 -1.04 0.02 2.29 -0.00 0.00 0.00 177.39 178.86 1gxd n LYS 617 N 4.32 4.25 -3.14 1.47 2.85 -1.26 -4.55 118.16 122.10 1gxd n LYS 617 Ca 0.01 -0.05 -0.39 0.00 -1.05 0.00 0.00 58.31 56.83 1gxd n LYS 617 Cb 0.01 -0.42 -0.05 0.00 -0.65 0.00 0.00 35.03 33.91 1gxd n LYS 617 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1gxd s SER 618 N -0.62 7.05 -0.03 -5.58 0.15 -1.25 -4.94 113.70 108.48 1gxd s SER 618 Ca 0.00 1.25 -0.03 0.00 0.70 0.00 0.00 55.95 57.87 1gxd s SER 618 Cb 0.00 -2.40 0.01 0.00 -1.71 0.00 0.00 66.02 61.92 1gxd s SER 618 CO 0.00 0.09 0.09 0.68 1.20 0.00 0.00 173.24 175.30 1gxd s VAL 619 N -0.20 -0.00 -0.20 4.45 -7.23 -1.13 -2.59 120.40 113.49 1gxd s VAL 619 Ca 0.33 0.01 -0.04 0.00 -1.81 0.00 0.00 61.98 60.47 1gxd s VAL 619 Cb -0.19 -0.14 0.08 0.00 0.56 0.00 0.00 36.38 36.69 1gxd s VAL 619 CO 0.19 0.00 0.14 -0.75 -0.31 0.00 0.00 175.10 174.37 1gxd s LYS 620 N 0.10 0.12 -0.42 4.82 2.20 -1.19 -4.86 119.74 120.52 1gxd s LYS 620 Ca -0.00 -0.06 -0.17 0.00 -0.36 0.00 0.00 55.97 55.38 1gxd s LYS 620 Cb -0.01 -1.54 0.02 0.00 -1.51 0.00 0.00 37.83 34.78 1gxd s LYS 620 CO -0.00 -0.72 0.44 0.12 -0.36 0.00 0.00 175.35 174.83 1gxd s PHE 621 N 2.19 3.17 0.11 4.03 2.19 -1.26 -0.87 117.98 127.55 1gxd s PHE 621 Ca 0.04 -0.34 -0.07 0.00 0.33 0.00 0.00 56.93 56.90 1gxd s PHE 621 Cb -0.16 -2.90 -0.01 0.00 -1.31 0.00 0.00 43.02 38.64 1gxd s PHE 621 CO -0.14 -0.69 0.17 0.20 1.83 0.00 0.00 175.22 176.59 1gxd s GLY 622 N 1.81 0.40 -0.02 13.12 0.00 -0.41 -4.96 107.32 117.27 1gxd s GLY 622 Ca 0.13 -0.91 -0.30 0.00 0.00 0.00 0.00 44.72 43.64 1gxd s GLY 622 CO 0.14 -0.97 1.70 -0.45 0.00 0.00 0.00 173.10 173.52 1gxd s SER 623 N -2.93 6.63 0.43 1.64 0.15 -1.26 -0.56 113.70 117.79 1gxd s SER 623 Ca 0.12 2.34 0.23 0.00 0.70 0.00 0.00 55.95 59.34 1gxd s SER 623 Cb 0.05 -2.54 0.78 0.00 -1.71 0.00 0.00 66.02 62.61 1gxd s SER 623 CO -0.06 -0.94 1.77 0.16 1.20 0.00 0.00 173.24 175.37 1gxd h ILE 624 N 5.48 0.52 0.00 6.45 3.07 -1.91 0.05 117.51 131.16 1gxd h ILE 624 Ca -0.41 -1.23 0.00 0.00 1.55 0.00 0.00 64.86 64.77 1gxd h ILE 624 Cb 1.19 1.86 0.00 0.00 -0.27 0.00 0.00 36.82 39.60 1gxd h ILE 624 CO 0.95 0.23 0.00 1.17 -1.05 0.00 0.00 178.15 179.45 1gxd n LYS 625 N -3.32 0.50 0.00 0.16 4.81 -1.26 -0.52 118.16 118.52 1gxd n LYS 625 Ca 0.01 0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.49 1gxd n LYS 625 Cb 0.47 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.02 1gxd n LYS 625 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1gxd n SER 626 N -1.13 1.99 -0.04 3.14 7.64 -0.76 -4.40 113.62 120.06 1gxd n SER 626 Ca 0.13 0.00 0.02 0.00 1.01 0.00 0.00 58.87 60.03 1gxd n SER 626 Cb 0.11 0.30 -0.13 0.00 -1.01 0.00 0.00 64.21 63.48 1gxd n SER 626 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1gxd n ASP 627 N -0.85 1.09 -0.04 6.43 2.03 -0.07 -4.39 116.55 120.75 1gxd n ASP 627 Ca 0.00 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.25 1gxd n ASP 627 Cb 0.10 1.41 -0.02 0.00 -0.72 0.00 0.00 41.12 41.89 1gxd n ASP 627 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 1gxd n TRP 628 N -2.30 0.00 -2.74 -0.67 7.02 -0.96 -4.78 117.44 113.01 1gxd n TRP 628 Ca -0.13 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.01 1gxd n TRP 628 Cb 0.69 -0.31 -0.06 0.00 -2.42 0.00 0.00 31.31 29.21 1gxd n TRP 628 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1gxd s LEU 629 N -7.52 4.04 0.00 -0.99 1.43 0.32 -4.77 118.68 111.20 1gxd s LEU 629 Ca -0.18 1.80 0.00 0.00 -1.03 0.00 0.00 54.13 54.72 1gxd s LEU 629 Cb 0.02 -4.38 0.00 0.00 0.03 0.00 0.00 46.19 41.87 1gxd s LEU 629 CO 0.26 -0.37 0.00 0.61 0.23 0.00 0.00 176.35 177.08 1gxd n GLY 630 N -0.19 0.00 0.00 -3.19 0.00 -1.26 -3.53 105.19 97.03 1gxd n GLY 630 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1gxd n GLY 630 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32