#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n6b n LYS 28 N 0.00 -0.65 -2.02 1.61 3.00 -1.26 -4.45 118.16 114.38 1n6b n LYS 28 Ca 0.00 0.53 -0.32 0.00 -0.00 0.00 0.00 58.31 58.52 1n6b n LYS 28 Cb 0.00 -0.76 0.01 0.00 0.00 0.00 0.00 35.03 34.27 1n6b n LYS 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1n6b s LEU 29 N -4.80 3.43 0.83 3.14 1.43 -1.25 -0.23 118.68 121.23 1n6b s LEU 29 Ca 0.00 1.66 -0.12 0.00 -1.03 0.00 0.00 54.13 54.64 1n6b s LEU 29 Cb 0.00 -4.51 0.10 0.00 0.03 0.00 0.00 46.19 41.81 1n6b s LEU 29 CO 0.00 -1.03 1.17 -2.84 0.23 0.00 0.00 176.35 173.88 1n6b s PRO 30 N -4.40 1.53 0.00 1.29 0.02 -1.26 -4.91 135.00 127.27 1n6b s PRO 30 Ca 0.60 1.62 0.00 0.00 0.02 0.00 0.00 61.00 63.24 1n6b s PRO 30 Cb -0.13 -1.78 0.00 0.00 0.02 0.00 0.00 34.50 32.61 1n6b s PRO 30 CO 0.41 -2.27 0.00 -2.30 -0.33 0.00 0.00 177.00 172.51 1n6b n PRO 31 N -3.60 1.17 0.00 5.54 -0.02 -1.26 -3.85 135.00 132.98 1n6b n PRO 31 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1n6b n PRO 31 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.99 1n6b n PRO 31 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n6b n GLY 32 N 1.11 1.59 3.48 -1.23 0.00 -1.26 0.94 105.19 109.82 1n6b n GLY 32 Ca 0.00 -1.94 -0.47 0.00 0.00 0.00 0.00 46.02 43.61 1n6b n GLY 32 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1n6b n PRO 33 N -1.86 1.08 -0.95 1.61 -0.02 -1.26 -4.70 135.00 128.90 1n6b n PRO 33 Ca 0.00 0.25 -0.38 0.00 -2.02 0.00 0.00 63.50 61.35 1n6b n PRO 33 Cb 0.00 -2.60 -0.06 0.00 -0.02 0.00 0.00 33.50 30.82 1n6b n PRO 33 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1n6b n THR 34 N 7.40 0.00 -1.53 3.45 5.66 -1.26 -4.70 114.28 123.30 1n6b n THR 34 Ca 0.42 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.99 1n6b n THR 34 Cb 0.28 -0.28 -0.05 0.00 -1.55 0.00 0.00 70.33 68.72 1n6b n THR 34 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1n6b n PRO 35 N 2.51 1.19 -2.36 1.09 -0.04 -1.26 -4.94 135.00 131.20 1n6b n PRO 35 Ca 0.19 0.22 -0.42 0.00 -0.04 0.00 0.00 63.50 63.45 1n6b n PRO 35 Cb -0.03 -2.93 -0.03 0.00 -0.04 0.00 0.00 33.50 30.47 1n6b n PRO 35 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1n6b s PHE 36 N 9.56 3.22 -0.12 0.54 2.19 -1.25 -4.92 117.98 127.20 1n6b s PHE 36 Ca 1.06 1.13 -0.39 0.00 0.33 0.00 0.00 56.93 59.06 1n6b s PHE 36 Cb -0.51 -3.50 -0.16 0.00 -1.31 0.00 0.00 43.02 37.54 1n6b s PHE 36 CO 0.37 -1.67 1.57 -2.30 1.83 0.00 0.00 175.22 175.03 1n6b n PRO 37 N 4.60 1.17 0.00 10.12 -0.02 -1.26 -2.76 135.00 146.84 1n6b n PRO 37 Ca 0.11 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1n6b n PRO 37 Cb 0.45 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1n6b n PRO 37 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1n6b n ILE 38 N 3.71 0.00 -0.77 4.25 -0.00 -1.26 -4.65 119.36 120.64 1n6b n ILE 38 Ca 0.23 0.00 -0.10 0.00 -0.00 0.00 0.00 62.75 62.88 1n6b n ILE 38 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.80 1n6b n ILE 38 CO 0.00 0.00 0.00 2.30 -0.00 0.00 0.00 176.55 178.85 1n6b n ILE 39 N 0.00 2.50 0.00 1.39 -5.35 -1.26 -3.26 119.36 113.39 1n6b n ILE 39 Ca 0.00 -1.24 0.00 0.00 -0.27 0.00 0.00 62.75 61.24 1n6b n ILE 39 Cb 0.00 -1.47 0.00 0.00 -1.74 0.00 0.00 39.64 36.43 1n6b n ILE 39 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1n6b n GLY 40 N 1.01 1.09 1.00 3.28 0.00 -1.11 -3.88 105.19 106.57 1n6b n GLY 40 Ca 0.19 0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.42 1n6b n GLY 40 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1n6b n ASN 41 N 0.86 3.90 -0.33 1.61 5.03 0.02 -3.94 115.26 122.41 1n6b n ASN 41 Ca 0.00 -2.68 0.17 0.00 0.87 0.00 0.00 54.58 52.95 1n6b n ASN 41 Cb 0.00 -0.48 0.38 0.00 -1.02 0.00 0.00 39.78 38.66 1n6b n ASN 41 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 1n6b h ILE 42 N 2.33 0.48 0.00 2.41 5.03 -1.79 0.45 117.51 126.41 1n6b h ILE 42 Ca 0.00 -0.17 0.00 0.00 -0.12 0.00 0.00 64.86 64.57 1n6b h ILE 42 Cb 1.31 -0.05 0.00 0.00 -3.03 0.00 0.00 36.82 35.04 1n6b h ILE 42 CO 0.19 0.09 0.00 -0.07 -0.68 0.00 0.00 178.15 177.68 1n6b h LEU 43 N 0.48 0.00 0.00 1.44 3.38 -1.88 -2.78 115.31 115.95 1n6b h LEU 43 Ca 0.64 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.61 1n6b h LEU 43 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1n6b h LEU 43 CO -0.52 0.00 -0.85 0.00 0.09 0.00 0.00 178.44 177.17 1n6b n GLN 44 N -2.35 0.03 -4.02 1.13 6.02 0.15 -4.94 117.38 113.39 1n6b n GLN 44 Ca 0.03 -0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.70 1n6b n GLN 44 Cb 0.29 -1.51 -0.06 0.00 1.02 0.00 0.00 30.24 29.98 1n6b n GLN 44 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1n6b s ILE 45 N -3.02 4.88 -0.47 5.09 1.01 -0.88 -5.00 121.20 122.80 1n6b s ILE 45 Ca 0.09 -0.51 -0.10 0.00 0.00 0.00 0.00 60.65 60.13 1n6b s ILE 45 Cb 0.16 -3.31 0.12 0.00 0.01 0.00 0.00 42.46 39.44 1n6b s ILE 45 CO 0.81 0.22 0.35 -0.62 0.00 0.00 0.00 174.94 175.70 1n6b s ASP 46 N -2.16 5.74 0.59 3.58 3.68 -1.26 -4.94 116.67 121.90 1n6b s ASP 46 Ca 0.28 -1.88 0.29 0.00 2.13 0.00 0.00 52.55 53.37 1n6b s ASP 46 Cb -0.12 -2.03 1.46 0.00 -1.45 0.00 0.00 42.92 40.77 1n6b s ASP 46 CO 0.20 -0.70 1.87 0.00 0.13 0.00 0.00 175.17 176.67 1n6b h ALA 47 N 8.49 2.25 0.00 3.66 0.00 -1.97 0.71 119.26 132.40 1n6b h ALA 47 Ca -0.22 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1n6b h ALA 47 Cb 1.08 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1n6b h ALA 47 CO 0.87 -0.78 -0.11 0.87 0.00 0.00 0.00 179.25 180.09 1n6b h LYS 48 N 0.00 0.00 -0.17 0.00 1.57 -1.92 -3.39 116.57 112.66 1n6b h LYS 48 Ca 0.24 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.79 1n6b h LYS 48 Cb 1.29 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.44 1n6b h LYS 48 CO -0.00 0.11 -0.52 -3.47 -0.57 0.00 0.00 179.45 175.00 1n6b n ASP 49 N -3.18 -2.79 -0.16 0.86 -0.08 0.16 -4.21 116.55 107.16 1n6b n ASP 49 Ca 0.02 -3.25 0.13 0.00 -1.51 0.00 0.00 54.79 50.18 1n6b n ASP 49 Cb 0.47 1.71 0.47 0.00 2.34 0.00 0.00 41.12 46.10 1n6b n ASP 49 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1n6b h ILE 50 N 3.08 0.85 -0.80 5.18 -0.00 -1.55 -1.33 117.51 122.95 1n6b h ILE 50 Ca -0.12 -0.17 -0.01 0.00 -0.00 0.00 0.00 64.86 64.56 1n6b h ILE 50 Cb 1.03 0.33 -0.04 0.00 -0.00 0.00 0.00 36.82 38.14 1n6b h ILE 50 CO 0.32 0.09 0.47 -1.28 -0.00 0.00 0.00 178.15 177.74 1n6b h SER 51 N 0.48 0.97 0.29 2.19 0.87 -1.95 -0.94 113.55 115.45 1n6b h SER 51 Ca 0.35 -0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.82 1n6b h SER 51 Cb 0.68 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.40 1n6b h SER 51 CO -0.11 0.75 -0.11 0.50 -0.53 0.00 0.00 176.83 177.33 1n6b h LYS 52 N 1.11 0.00 0.18 2.24 3.64 -1.61 -2.47 116.57 119.65 1n6b h LYS 52 Ca 0.29 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.34 1n6b h LYS 52 Cb -0.03 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1n6b h LYS 52 CO -0.05 0.11 -1.57 0.77 -2.27 0.00 0.00 179.45 176.43 1n6b h SER 53 N 0.00 0.59 0.16 4.20 0.02 -1.20 -2.58 113.55 114.75 1n6b h SER 53 Ca -0.00 -0.76 -0.03 0.00 -0.84 0.00 0.00 61.79 60.16 1n6b h SER 53 Cb 0.28 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 1n6b h SER 53 CO 0.01 1.62 -0.15 -0.07 -1.14 0.00 0.00 176.83 177.11 1n6b h LEU 54 N 0.10 0.00 0.10 5.07 3.38 -1.01 -0.20 115.31 122.76 1n6b h LEU 54 Ca -0.27 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.40 1n6b h LEU 54 Cb 2.08 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.86 1n6b h LEU 54 CO 0.20 0.15 -1.23 0.74 0.09 0.00 0.00 178.44 178.40 1n6b h THR 55 N 0.00 1.29 0.00 0.22 2.02 -1.52 -1.44 112.91 113.48 1n6b h THR 55 Ca -0.00 -2.45 -0.01 0.00 0.77 0.00 0.00 66.41 64.72 1n6b h THR 55 Cb 0.27 2.66 -0.00 0.00 -1.74 0.00 0.00 68.15 69.34 1n6b h THR 55 CO 0.02 0.75 -0.04 0.50 0.37 0.00 0.00 175.52 177.12 1n6b h LYS 56 N 0.29 0.00 0.00 6.66 3.64 -0.91 -1.84 116.57 124.41 1n6b h LYS 56 Ca -0.18 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 58.92 1n6b h LYS 56 Cb 1.89 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.67 1n6b h LYS 56 CO 0.23 0.04 -1.62 0.74 -2.27 0.00 0.00 179.45 176.57 1n6b h PHE 57 N 0.00 0.00 0.00 1.91 0.05 -0.89 -3.36 116.94 114.66 1n6b h PHE 57 Ca -0.00 0.00 -0.09 0.00 3.82 0.00 0.00 57.97 61.70 1n6b h PHE 57 Cb 0.24 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.18 1n6b h PHE 57 CO 0.00 0.99 -0.42 0.66 -0.18 0.00 0.00 178.31 179.35 1n6b h SER 58 N 0.00 0.00 -0.51 2.17 4.64 -0.41 -1.77 113.55 117.67 1n6b h SER 58 Ca -0.25 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.02 1n6b h SER 58 Cb 1.97 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 64.04 1n6b h SER 58 CO 0.08 0.42 0.17 -0.33 -0.87 0.00 0.00 176.83 176.30 1n6b h GLU 59 N 0.00 0.84 -0.00 4.77 5.08 -1.63 -0.68 114.58 122.96 1n6b h GLU 59 Ca -0.00 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1n6b h GLU 59 Cb 0.77 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1n6b h GLU 59 CO 0.05 0.73 -0.80 0.00 -1.00 0.00 0.00 179.01 178.00 1n6b n TYR 61 N -1.46 0.00 -1.22 0.00 4.01 -0.69 -5.02 117.16 112.78 1n6b n TYR 61 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1n6b n TYR 61 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 1n6b n TYR 61 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1n6b n GLY 62 N 0.06 -1.80 0.32 2.72 0.00 -0.26 -4.62 105.19 101.60 1n6b n GLY 62 Ca 0.00 -1.86 -0.04 0.00 0.00 0.00 0.00 46.02 44.12 1n6b n GLY 62 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n6b h PRO 63 N 0.00 0.98 -4.98 1.61 0.11 -1.81 -3.40 132.00 124.51 1n6b h PRO 63 Ca 0.00 -0.20 -0.67 0.00 0.11 0.00 0.00 66.00 65.24 1n6b h PRO 63 Cb 0.00 -0.15 -0.33 0.00 0.11 0.00 0.00 31.00 30.63 1n6b h PRO 63 CO 0.00 0.85 -0.80 0.08 -0.21 0.00 0.00 178.00 177.93 1n6b s VAL 64 N -5.32 2.51 0.12 3.15 1.01 -1.26 -0.81 120.40 119.80 1n6b s VAL 64 Ca -0.11 -1.00 -0.03 0.00 0.00 0.00 0.00 61.98 60.84 1n6b s VAL 64 Cb 0.15 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 1n6b s VAL 64 CO 0.82 0.34 0.10 0.72 0.00 0.00 0.00 175.10 177.08 1n6b s PHE 65 N 1.30 0.66 0.01 5.22 -0.12 -1.03 -4.56 117.98 119.46 1n6b s PHE 65 Ca 0.02 -1.06 0.04 0.00 -0.05 0.00 0.00 56.93 55.88 1n6b s PHE 65 Cb -0.15 -0.35 -0.03 0.00 -0.63 0.00 0.00 43.02 41.86 1n6b s PHE 65 CO -0.08 -0.55 -0.11 0.99 -0.05 0.00 0.00 175.22 175.43 1n6b s THR 66 N -4.00 3.34 0.13 -4.49 2.01 0.27 0.39 115.64 113.29 1n6b s THR 66 Ca 0.19 -0.90 0.05 0.00 0.31 0.00 0.00 61.69 61.34 1n6b s THR 66 Cb 0.06 -2.43 -0.04 0.00 0.01 0.00 0.00 72.50 70.11 1n6b s THR 66 CO -0.01 0.39 -0.11 0.68 -0.69 0.00 0.00 174.62 174.88 1n6b s VAL 67 N -0.95 1.15 -0.03 3.82 -7.23 -0.16 -4.00 120.40 113.00 1n6b s VAL 67 Ca 0.16 -1.89 0.06 0.00 -1.81 0.00 0.00 61.98 58.49 1n6b s VAL 67 Cb -0.11 -1.67 -0.01 0.00 0.56 0.00 0.00 36.38 35.15 1n6b s VAL 67 CO 0.06 -0.64 -0.20 -0.31 -0.31 0.00 0.00 175.10 173.71 1n6b s TYR 68 N -2.88 1.86 -0.07 2.82 1.51 -1.26 -1.01 117.35 118.32 1n6b s TYR 68 Ca 0.12 -0.44 0.08 0.00 -1.01 0.00 0.00 57.07 55.83 1n6b s TYR 68 Cb -0.00 -1.22 -0.12 0.00 -0.11 0.00 0.00 41.96 40.51 1n6b s TYR 68 CO 0.01 -0.10 0.08 1.28 -1.11 0.00 0.00 175.55 175.71 1n6b n LEU 69 N 2.82 0.00 0.00 -1.29 7.99 -1.24 -0.80 117.00 124.49 1n6b n LEU 69 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.84 1n6b n LEU 69 Cb 0.53 0.16 0.00 0.00 -0.11 0.00 0.00 43.42 44.00 1n6b n LEU 69 CO 0.24 0.16 0.00 0.61 -1.51 0.00 0.00 177.39 176.89 1n6b n GLY 70 N 2.32 3.62 0.00 -0.72 0.00 -1.25 -4.01 105.19 105.14 1n6b n GLY 70 Ca -0.11 -0.57 0.01 0.00 0.00 0.00 0.00 46.02 45.35 1n6b n GLY 70 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1n6b n MET 71 N 0.00 0.90 -3.48 1.61 2.81 -1.20 -4.30 117.12 113.45 1n6b n MET 71 Ca 0.00 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.48 1n6b n MET 71 Cb 0.00 -1.04 -0.10 0.00 -0.71 0.00 0.00 33.22 31.37 1n6b n MET 71 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1n6b s LYS 72 N -2.00 3.48 0.67 0.03 -0.14 -1.26 -5.08 119.74 115.44 1n6b s LYS 72 Ca 0.03 -0.59 -0.13 0.00 -1.36 0.00 0.00 55.97 53.92 1n6b s LYS 72 Cb 0.01 -3.82 0.00 0.00 -1.68 0.00 0.00 37.83 32.35 1n6b s LYS 72 CO 0.02 -0.49 1.08 -1.25 -0.76 0.00 0.00 175.35 173.95 1n6b s PRO 73 N 1.83 2.90 -0.21 -1.68 0.04 -1.26 -3.60 135.00 133.01 1n6b s PRO 73 Ca 0.08 1.18 -0.04 0.00 0.04 0.00 0.00 61.00 62.26 1n6b s PRO 73 Cb -0.17 -1.98 0.10 0.00 0.04 0.00 0.00 34.50 32.49 1n6b s PRO 73 CO 0.11 -1.14 0.25 0.99 0.04 0.00 0.00 177.00 177.25 1n6b s THR 74 N -2.67 -0.38 -0.19 1.26 2.01 -0.18 -3.97 115.64 111.51 1n6b s THR 74 Ca 0.62 -0.11 -0.26 0.00 0.31 0.00 0.00 61.69 62.25 1n6b s THR 74 Cb -0.17 -0.71 -0.01 0.00 0.01 0.00 0.00 72.50 71.63 1n6b s THR 74 CO 0.46 -0.19 0.89 0.54 -0.69 0.00 0.00 174.62 175.63 1n6b s VAL 75 N 2.37 4.82 -0.18 3.82 0.11 -0.56 -0.99 120.40 129.79 1n6b s VAL 75 Ca 0.08 1.74 -0.15 0.00 -2.93 0.00 0.00 61.98 60.71 1n6b s VAL 75 Cb -0.16 -4.18 -0.04 0.00 -1.53 0.00 0.00 36.38 30.47 1n6b s VAL 75 CO -0.13 -0.04 0.37 -0.69 -3.33 0.00 0.00 175.10 171.28 1n6b s VAL 76 N 2.51 5.23 -0.29 2.04 1.01 0.16 -1.48 120.40 129.58 1n6b s VAL 76 Ca 0.40 0.68 -0.09 0.00 0.00 0.00 0.00 61.98 62.96 1n6b s VAL 76 Cb -0.16 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1n6b s VAL 76 CO 0.10 0.29 0.14 -0.76 0.00 0.00 0.00 175.10 174.88 1n6b s LEU 77 N 1.03 3.94 -0.09 3.92 1.43 0.13 -2.46 118.68 126.59 1n6b s LEU 77 Ca 0.19 -0.37 0.04 0.00 -1.03 0.00 0.00 54.13 52.95 1n6b s LEU 77 Cb -0.14 -2.00 0.00 0.00 0.03 0.00 0.00 46.19 44.08 1n6b s LEU 77 CO 0.07 -0.14 -0.20 -2.28 0.23 0.00 0.00 176.35 174.03 1n6b s HIS 78 N 1.64 2.21 0.00 0.29 2.46 0.01 -0.96 115.29 120.93 1n6b s HIS 78 Ca 0.05 -0.87 0.00 0.00 0.47 0.00 0.00 55.06 54.71 1n6b s HIS 78 Cb -0.16 -1.50 0.00 0.00 -0.13 0.00 0.00 32.58 30.78 1n6b s HIS 78 CO 0.06 -0.37 0.00 0.41 -2.47 0.00 0.00 174.74 172.38 1n6b n GLY 79 N 3.58 1.81 0.35 1.59 0.00 -1.26 -4.51 105.19 106.75 1n6b n GLY 79 Ca -0.20 -1.69 0.04 0.00 0.00 0.00 0.00 46.02 44.17 1n6b n GLY 79 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1n6b h TYR 80 N 0.00 1.08 0.54 1.61 3.20 -1.92 -0.25 116.97 121.23 1n6b h TYR 80 Ca 0.00 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1n6b h TYR 80 Cb 0.00 -0.34 -0.00 0.00 1.54 0.00 0.00 36.73 37.92 1n6b h TYR 80 CO 0.00 0.47 -0.33 1.49 -1.64 0.00 0.00 178.16 178.15 1n6b h GLU 81 N 0.99 -0.80 -0.57 1.82 4.81 -1.99 0.15 114.58 118.99 1n6b h GLU 81 Ca 0.45 0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.64 1n6b h GLU 81 Cb 0.35 0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1n6b h GLU 81 CO -0.23 -0.53 0.00 0.00 -0.73 0.00 0.00 179.01 177.52 1n6b h ALA 82 N -0.43 0.93 -0.27 2.92 0.00 -1.75 -1.95 119.26 118.71 1n6b h ALA 82 Ca -0.06 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 1n6b h ALA 82 Cb 0.67 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1n6b h ALA 82 CO 0.07 0.64 -0.14 0.28 0.00 0.00 0.00 179.25 180.09 1n6b h VAL 83 N 0.90 1.30 -0.36 0.00 2.07 -0.98 -2.44 116.25 116.74 1n6b h VAL 83 Ca 0.16 -1.24 -0.16 0.00 0.82 0.00 0.00 66.70 66.28 1n6b h VAL 83 Cb 0.52 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 1n6b h VAL 83 CO 0.03 0.39 -0.40 0.50 0.02 0.00 0.00 177.57 178.11 1n6b h LYS 84 N 0.31 0.88 -0.29 1.57 3.64 -0.69 -1.12 116.57 120.87 1n6b h LYS 84 Ca 0.06 -0.46 0.02 0.00 -1.27 0.00 0.00 60.65 58.99 1n6b h LYS 84 Cb 0.66 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.48 1n6b h LYS 84 CO 0.04 1.11 0.15 1.49 -2.27 0.00 0.00 179.45 179.97 1n6b h GLU 85 N 0.71 0.30 0.55 1.90 4.81 -1.36 0.43 114.58 121.92 1n6b h GLU 85 Ca 0.06 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1n6b h GLU 85 Cb 0.98 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 30.30 1n6b h GLU 85 CO 0.09 0.20 -0.26 0.00 -0.73 0.00 0.00 179.01 178.31 1n6b h ALA 86 N 1.15 -0.74 -0.34 2.92 0.00 -1.40 0.13 119.26 120.98 1n6b h ALA 86 Ca 0.12 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1n6b h ALA 86 Cb 0.03 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1n6b h ALA 86 CO -0.08 -0.68 -0.11 -0.07 0.00 0.00 0.00 179.25 178.31 1n6b h LEU 87 N -1.19 0.57 0.00 0.00 3.38 -1.24 -3.18 115.31 113.65 1n6b h LEU 87 Ca -0.08 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1n6b h LEU 87 Cb 0.56 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1n6b h LEU 87 CO 0.12 0.72 0.00 0.52 0.09 0.00 0.00 178.44 179.89 1n6b n VAL 88 N -4.19 0.00 -0.25 1.22 0.31 0.15 -4.01 118.33 111.56 1n6b n VAL 88 Ca 0.01 0.49 -0.03 0.00 -0.01 0.00 0.00 64.34 64.80 1n6b n VAL 88 Cb 0.33 -1.49 0.08 0.00 -0.91 0.00 0.00 33.84 31.84 1n6b n VAL 88 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1n6b h ASP 89 N 0.00 0.72 -1.47 4.52 3.32 -1.28 -2.31 116.42 119.92 1n6b h ASP 89 Ca 0.00 -0.00 -0.70 0.00 0.02 0.00 0.00 57.03 56.35 1n6b h ASP 89 Cb 0.00 -0.16 -0.30 0.00 0.22 0.00 0.00 39.33 39.09 1n6b h ASP 89 CO 0.00 0.50 0.68 0.18 -1.72 0.00 0.00 179.24 178.88 1n6b n LEU 90 N -4.66 7.14 -0.04 1.55 4.77 0.45 -4.86 117.00 121.34 1n6b n LEU 90 Ca 0.07 -4.66 -0.05 0.00 -0.03 0.00 0.00 56.01 51.34 1n6b n LEU 90 Cb 0.08 -0.92 -0.04 0.00 -2.33 0.00 0.00 43.42 40.21 1n6b n LEU 90 CO 0.33 1.72 0.50 1.23 -1.33 0.00 0.00 177.39 179.84 1n6b h GLY 91 N 2.51 -1.52 2.00 -0.72 0.00 -1.42 -2.58 103.07 101.34 1n6b h GLY 91 Ca 0.54 0.75 0.00 0.00 0.00 0.00 0.00 47.33 48.63 1n6b h GLY 91 CO 1.39 -0.48 0.00 0.83 0.00 0.00 0.00 176.54 178.28 1n6b h GLU 92 N -0.18 0.00 0.00 4.80 5.08 -1.89 -1.77 114.58 120.63 1n6b h GLU 92 Ca 0.02 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.27 1n6b h GLU 92 Cb 0.24 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1n6b h GLU 92 CO -0.21 0.00 -0.52 0.93 -1.00 0.00 0.00 179.01 178.21 1n6b h GLU 93 N 0.00 0.00 -0.04 2.33 3.07 -1.82 -3.24 114.58 114.88 1n6b h GLU 93 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1n6b h GLU 93 Cb 0.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 1n6b h GLU 93 CO 0.00 0.52 0.00 1.19 -1.40 0.00 0.00 179.01 179.32 1n6b n PHE 94 N -3.54 0.03 0.42 4.33 3.01 -0.90 -1.68 117.46 119.13 1n6b n PHE 94 Ca -0.00 -0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.42 1n6b n PHE 94 Cb 0.62 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.08 1n6b n PHE 94 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1n6b n ALA 95 N 0.64 1.67 -2.58 4.37 0.00 -0.71 -4.02 120.51 119.88 1n6b n ALA 95 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.25 1n6b n ALA 95 Cb 0.30 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.73 1n6b n ALA 95 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1n6b s GLY 96 N -1.66 1.59 -0.09 0.00 0.00 -0.89 -4.87 107.32 101.40 1n6b s GLY 96 Ca 0.00 -0.74 0.01 0.00 0.00 0.00 0.00 44.72 44.00 1n6b s GLY 96 CO 0.00 -0.65 -0.12 -1.60 0.00 0.00 0.00 173.10 170.73 1n6b s ARG 97 N -3.98 2.94 0.53 2.90 6.06 -1.26 -0.67 118.95 125.46 1n6b s ARG 97 Ca 0.42 -0.66 -0.22 0.00 -2.50 0.00 0.00 55.73 52.77 1n6b s ARG 97 Cb -0.10 -2.54 -0.05 0.00 0.06 0.00 0.00 34.95 32.32 1n6b s ARG 97 CO 0.34 0.46 1.31 0.20 -2.50 0.00 0.00 175.30 175.10 1n6b s GLY 98 N -0.28 2.86 0.09 8.12 0.00 -1.20 -4.76 107.32 112.16 1n6b s GLY 98 Ca 0.03 1.23 -0.30 0.00 0.00 0.00 0.00 44.72 45.67 1n6b s GLY 98 CO 0.03 1.73 1.05 -0.56 0.00 0.00 0.00 173.10 175.34 1n6b s SER 99 N -1.07 7.33 -0.17 1.64 0.01 -1.26 -5.03 113.70 115.15 1n6b s SER 99 Ca 0.70 1.88 -0.00 0.00 1.31 0.00 0.00 55.95 59.83 1n6b s SER 99 Cb -0.37 -2.59 0.04 0.00 0.21 0.00 0.00 66.02 63.31 1n6b s SER 99 CO 0.44 -0.23 -0.05 -0.69 0.41 0.00 0.00 173.24 173.12 1n6b s VAL 100 N 0.37 1.13 0.24 3.43 1.01 -1.26 -4.68 120.40 120.63 1n6b s VAL 100 Ca 0.51 -0.65 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 1n6b s VAL 100 Cb -0.25 -1.30 0.23 0.00 0.00 0.00 0.00 36.38 35.05 1n6b s VAL 100 CO 0.31 0.13 1.69 1.55 0.00 0.00 0.00 175.10 178.78 1n6b h PRO 101 N 8.11 0.29 -0.50 2.72 0.13 -1.95 0.66 132.00 141.46 1n6b h PRO 101 Ca -0.24 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 64.81 1n6b h PRO 101 Cb 1.11 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.15 1n6b h PRO 101 CO 0.40 0.19 0.08 0.82 -0.23 0.00 0.00 178.00 179.26 1n6b h ILE 102 N 0.30 1.23 0.00 -3.56 5.03 -1.97 -2.40 117.51 116.13 1n6b h ILE 102 Ca 0.41 -0.86 -0.21 0.00 -0.12 0.00 0.00 64.86 64.09 1n6b h ILE 102 Cb 0.70 0.76 -0.03 0.00 -3.03 0.00 0.00 36.82 35.22 1n6b h ILE 102 CO -0.49 0.31 -1.04 -0.07 -0.68 0.00 0.00 178.15 176.18 1n6b h LEU 103 N 0.74 0.00 -1.64 1.44 3.38 -1.79 -2.73 115.31 114.72 1n6b h LEU 103 Ca 0.16 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 1n6b h LEU 103 Cb 0.34 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1n6b h LEU 103 CO 0.01 0.98 -0.20 -0.33 0.09 0.00 0.00 178.44 178.98 1n6b h GLU 104 N 0.00 0.00 0.08 1.13 5.08 -0.64 0.74 114.58 120.98 1n6b h GLU 104 Ca -0.03 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1n6b h GLU 104 Cb 1.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.02 1n6b h GLU 104 CO 0.12 0.20 -0.04 -0.22 -1.00 0.00 0.00 179.01 178.08 1n6b h LYS 105 N 0.00 -0.11 0.31 2.33 1.63 -1.40 -2.99 116.57 116.34 1n6b h LYS 105 Ca -0.00 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 1n6b h LYS 105 Cb 0.41 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 1n6b h LYS 105 CO 0.03 0.11 -0.15 0.28 -3.45 0.00 0.00 179.45 176.27 1n6b h VAL 106 N -1.01 0.72 0.00 2.00 2.07 -1.37 -3.27 116.25 115.39 1n6b h VAL 106 Ca -0.01 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1n6b h VAL 106 Cb 0.27 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1n6b h VAL 106 CO 0.02 0.09 0.00 -1.20 0.02 0.00 0.00 177.57 176.49 1n6b n SER 107 N -5.17 0.79 -3.37 0.57 7.64 0.26 -4.94 113.62 109.40 1n6b n SER 107 Ca -0.10 0.59 -0.23 0.00 1.01 0.00 0.00 58.87 60.14 1n6b n SER 107 Cb 0.24 -0.80 -0.01 0.00 -1.01 0.00 0.00 64.21 62.64 1n6b n SER 107 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1n6b n LYS 108 N -2.26 -3.33 -1.15 1.43 5.02 -1.13 -0.33 118.16 116.41 1n6b n LYS 108 Ca 0.05 0.47 -0.05 0.00 -2.02 0.00 0.00 58.31 56.75 1n6b n LYS 108 Cb 0.40 -5.17 -0.02 0.00 -0.02 0.00 0.00 35.03 30.22 1n6b n LYS 108 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n6b n GLY 109 N -1.16 0.73 0.00 0.72 0.00 -1.26 -5.01 105.19 99.21 1n6b n GLY 109 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1n6b n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n6b n LEU 110 N -0.60 0.00 0.00 0.99 4.77 0.55 -4.53 117.00 118.18 1n6b n LEU 110 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1n6b n LEU 110 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1n6b n LEU 110 CO 0.08 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.63 1n6b n GLY 111 N 5.00 -0.16 0.79 -0.72 0.00 -1.26 -3.97 105.19 104.87 1n6b n GLY 111 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1n6b n GLY 111 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1n6b n ILE 112 N 0.00 0.00 -0.17 -0.61 5.41 -1.26 -4.60 119.36 118.13 1n6b n ILE 112 Ca 0.00 0.00 -0.06 0.00 1.00 0.00 0.00 62.75 63.69 1n6b n ILE 112 Cb 0.00 -0.82 0.10 0.00 -0.71 0.00 0.00 39.64 38.21 1n6b n ILE 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1n6b h ALA 113 N 0.00 0.99 0.00 -1.39 0.00 -1.94 -3.34 119.26 113.59 1n6b h ALA 113 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1n6b h ALA 113 Cb 0.66 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1n6b h ALA 113 CO 0.00 0.62 -0.04 1.19 0.00 0.00 0.00 179.25 181.02 1n6b n PHE 114 N -4.21 0.00 -2.18 0.00 3.01 -1.26 -4.94 117.46 107.88 1n6b n PHE 114 Ca 0.03 -0.68 -0.26 0.00 1.01 0.00 0.00 57.45 57.55 1n6b n PHE 114 Cb 0.31 -0.10 0.07 0.00 -0.01 0.00 0.00 39.48 39.75 1n6b n PHE 114 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1n6b s SER 115 N -1.87 4.77 0.11 4.37 1.04 -1.25 -4.88 113.70 116.00 1n6b s SER 115 Ca 0.16 0.47 -0.01 0.00 0.48 0.00 0.00 55.95 57.05 1n6b s SER 115 Cb 0.14 -1.10 -0.04 0.00 0.10 0.00 0.00 66.02 65.12 1n6b s SER 115 CO 0.01 -1.63 0.04 0.20 0.98 0.00 0.00 173.24 172.85 1n6b s ASN 116 N -4.53 0.34 0.12 7.02 0.01 -1.26 -4.56 114.94 112.09 1n6b s ASN 116 Ca 0.60 -1.15 0.00 0.00 -0.71 0.00 0.00 52.86 51.61 1n6b s ASN 116 Cb -0.11 0.28 0.00 0.00 0.41 0.00 0.00 41.25 41.83 1n6b s ASN 116 CO 0.45 -0.70 0.00 0.00 -1.51 0.00 0.00 177.10 175.34 1n6b n ALA 117 N -0.05 0.00 -0.39 0.60 0.00 -1.26 -2.33 120.51 117.08 1n6b n ALA 117 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.26 1n6b n ALA 117 Cb 0.63 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.99 1n6b n ALA 117 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1n6b n LYS 118 N 14.00 -0.40 -0.28 0.00 0.00 -1.26 0.33 118.16 130.54 1n6b n LYS 118 Ca 0.00 1.40 0.02 0.00 -0.00 0.00 0.00 58.31 59.73 1n6b n LYS 118 Cb 0.00 -2.06 0.15 0.00 -0.00 0.00 0.00 35.03 33.13 1n6b n LYS 118 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1n6b h THR 119 N 0.00 0.93 -0.07 0.58 2.02 -1.91 -1.96 112.91 112.50 1n6b h THR 119 Ca 0.15 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 67.03 1n6b h THR 119 Cb 0.38 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1n6b h THR 119 CO -0.86 0.14 -0.07 -0.25 0.37 0.00 0.00 175.52 174.85 1n6b h TRP 120 N 0.79 0.20 -0.57 3.16 7.01 -0.63 -2.04 115.95 123.87 1n6b h TRP 120 Ca 0.38 -0.06 0.11 0.00 2.11 0.00 0.00 58.89 61.43 1n6b h TRP 120 Cb 0.31 -0.04 -0.09 0.00 -2.10 0.00 0.00 29.16 27.23 1n6b h TRP 120 CO -0.06 0.60 0.02 -0.22 -2.79 0.00 0.00 178.44 175.99 1n6b h LYS 121 N -0.26 0.13 -0.31 2.65 3.64 0.22 0.17 116.57 122.81 1n6b h LYS 121 Ca 0.01 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.21 1n6b h LYS 121 Cb 0.57 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1n6b h LYS 121 CO 0.02 0.09 -0.50 0.93 -2.27 0.00 0.00 179.45 177.71 1n6b h GLU 122 N 0.14 0.88 -0.16 1.90 5.08 -1.40 -2.26 114.58 118.75 1n6b h GLU 122 Ca 0.29 -0.53 -0.16 0.00 -1.00 0.00 0.00 59.36 57.96 1n6b h GLU 122 Cb 0.46 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1n6b h GLU 122 CO -0.47 1.17 -0.58 0.52 -1.00 0.00 0.00 179.01 178.66 1n6b h MET 123 N 0.69 0.51 -0.04 2.33 2.86 -0.76 -2.69 114.93 117.82 1n6b h MET 123 Ca 0.03 -0.33 -0.02 0.00 -2.06 0.00 0.00 59.70 57.32 1n6b h MET 123 Cb 1.11 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.81 1n6b h MET 123 CO 0.11 0.94 -0.04 -0.09 1.06 0.00 0.00 176.91 178.89 1n6b h ARG 124 N 0.39 0.10 -0.82 1.72 2.43 -0.71 -2.27 114.38 115.22 1n6b h ARG 124 Ca 0.00 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1n6b h ARG 124 Cb 1.12 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.63 1n6b h ARG 124 CO 0.11 0.57 0.44 0.07 -1.51 0.00 0.00 179.97 179.65 1n6b h ARG 125 N -0.37 1.15 -0.73 0.20 0.11 -1.45 0.12 114.38 113.41 1n6b h ARG 125 Ca 0.01 -0.14 -0.06 0.00 0.10 0.00 0.00 59.98 59.89 1n6b h ARG 125 Cb 0.56 -0.22 -0.03 0.00 1.11 0.00 0.00 29.97 31.38 1n6b h ARG 125 CO 0.01 0.85 0.22 0.35 0.10 0.00 0.00 179.97 181.50 1n6b h PHE 126 N 1.15 1.17 -0.19 4.08 3.04 -1.53 -1.34 116.94 123.32 1n6b h PHE 126 Ca 0.29 -0.12 -0.12 0.00 3.98 0.00 0.00 57.97 62.00 1n6b h PHE 126 Cb 0.04 -0.34 -0.01 0.00 2.56 0.00 0.00 35.95 38.20 1n6b h PHE 126 CO 0.01 0.93 -0.41 0.77 -2.02 0.00 0.00 178.31 177.59 1n6b h SER 127 N 1.09 0.48 -0.26 0.41 0.02 -0.68 -0.51 113.55 114.10 1n6b h SER 127 Ca 0.24 -0.21 -0.18 0.00 -0.84 0.00 0.00 61.79 60.80 1n6b h SER 127 Cb 0.31 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1n6b h SER 127 CO -0.01 0.83 -0.55 -0.07 -1.14 0.00 0.00 176.83 175.89 1n6b h LEU 128 N 0.37 0.93 -0.39 5.07 3.38 -0.53 -1.91 115.31 122.24 1n6b h LEU 128 Ca 0.03 -0.55 -0.06 0.00 0.09 0.00 0.00 57.88 57.39 1n6b h LEU 128 Cb 0.88 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1n6b h LEU 128 CO 0.07 1.31 0.00 0.24 0.09 0.00 0.00 178.44 180.15 1n6b h MET 129 N 0.59 0.68 0.00 1.13 2.86 -1.18 -3.22 114.93 115.79 1n6b h MET 129 Ca 0.00 -0.21 -0.15 0.00 -2.06 0.00 0.00 59.70 57.28 1n6b h MET 129 Cb 1.16 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.74 1n6b h MET 129 CO 0.12 0.77 -0.70 1.15 1.06 0.00 0.00 176.91 179.32 1n6b h THR 130 N 0.50 1.47 -0.41 2.22 2.02 -1.13 -3.29 112.91 114.30 1n6b h THR 130 Ca 0.11 -2.42 -0.11 0.00 0.77 0.00 0.00 66.41 64.76 1n6b h THR 130 Cb 0.46 2.32 -0.06 0.00 -1.74 0.00 0.00 68.15 69.13 1n6b h THR 130 CO 0.02 0.68 0.14 0.18 0.37 0.00 0.00 175.52 176.91 1n6b n LEU 131 N -3.66 4.17 -4.85 2.58 4.77 -0.72 -4.26 117.00 115.04 1n6b n LEU 131 Ca -0.01 -2.15 -0.32 0.00 -0.03 0.00 0.00 56.01 53.51 1n6b n LEU 131 Cb 0.69 -0.64 -0.02 0.00 -2.33 0.00 0.00 43.42 41.13 1n6b n LEU 131 CO 0.43 0.59 0.69 -0.13 -1.33 0.00 0.00 177.39 177.64 1n6b s ARG 132 N -1.92 3.78 0.29 3.23 0.52 -1.24 -4.83 118.95 118.78 1n6b s ARG 132 Ca 0.31 0.92 0.04 0.00 -0.52 0.00 0.00 55.73 56.48 1n6b s ARG 132 Cb 0.24 -2.11 0.70 0.00 0.52 0.00 0.00 34.95 34.30 1n6b s ARG 132 CO 0.08 -0.42 1.74 -0.97 0.02 0.00 0.00 175.30 175.75 1n6b h ASN 133 N 0.51 0.53 -0.56 0.23 -1.24 -1.94 -0.36 115.58 112.75 1n6b h ASN 133 Ca -0.46 0.12 -0.36 0.00 0.71 0.00 0.00 56.30 56.31 1n6b h ASN 133 Cb 1.19 0.05 -0.23 0.00 0.73 0.00 0.00 38.32 40.06 1n6b h ASN 133 CO 0.61 0.13 -0.16 0.49 -1.29 0.00 0.00 177.43 177.22 1n6b n PHE 134 N -4.92 1.89 1.24 0.67 3.72 -1.26 -0.90 117.46 117.90 1n6b n PHE 134 Ca 0.22 -2.01 0.13 0.00 -0.05 0.00 0.00 57.45 55.74 1n6b n PHE 134 Cb 0.59 -0.60 0.49 0.00 -0.94 0.00 0.00 39.48 39.02 1n6b n PHE 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1n6b n GLY 135 N -0.98 -1.01 2.55 1.37 0.00 -0.14 -4.29 105.19 102.69 1n6b n GLY 135 Ca 0.41 -0.29 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 1n6b n GLY 135 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1n6b n MET 136 N -1.08 1.96 0.00 1.61 2.81 -1.26 -4.79 117.12 116.38 1n6b n MET 136 Ca 0.11 -3.80 0.00 0.00 -1.81 0.00 0.00 57.70 52.20 1n6b n MET 136 Cb 0.31 -1.72 0.00 0.00 -0.71 0.00 0.00 33.22 31.10 1n6b n MET 136 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n6b n GLY 137 N -0.13 -2.08 0.18 3.03 0.00 -1.08 -4.09 105.19 101.03 1n6b n GLY 137 Ca 0.23 -2.09 -0.03 0.00 0.00 0.00 0.00 46.02 44.12 1n6b n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n6b h LYS 138 N 0.59 0.24 -6.23 1.61 1.57 -1.92 -3.39 116.57 109.04 1n6b h LYS 138 Ca 0.00 -0.14 -0.57 0.00 -1.87 0.00 0.00 60.65 58.08 1n6b h LYS 138 Cb 0.00 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.23 1n6b h LYS 138 CO 0.00 0.69 0.88 0.50 -0.57 0.00 0.00 179.45 180.95 1n6b s ARG 139 N -3.95 3.31 1.11 3.15 3.52 -1.26 -5.00 118.95 119.83 1n6b s ARG 139 Ca -0.04 -0.15 -0.17 0.00 -0.13 0.00 0.00 55.73 55.24 1n6b s ARG 139 Cb 0.13 -4.11 0.24 0.00 -1.56 0.00 0.00 34.95 29.65 1n6b s ARG 139 CO 0.78 -1.84 1.12 -1.54 -0.81 0.00 0.00 175.30 173.02 1n6b s SER 140 N 3.31 1.72 0.05 -2.12 1.04 -1.26 -4.81 113.70 111.63 1n6b s SER 140 Ca 0.35 0.77 -0.19 0.00 0.48 0.00 0.00 55.95 57.36 1n6b s SER 140 Cb -0.10 -1.13 -0.14 0.00 0.10 0.00 0.00 66.02 64.76 1n6b s SER 140 CO 0.19 -3.65 1.34 0.40 0.98 0.00 0.00 173.24 172.50 1n6b h ILE 141 N -2.25 1.34 -0.74 -1.02 2.04 -1.31 -2.13 117.51 113.44 1n6b h ILE 141 Ca -0.48 -1.39 0.13 0.00 1.00 0.00 0.00 64.86 64.12 1n6b h ILE 141 Cb 1.30 1.86 -0.09 0.00 -0.74 0.00 0.00 36.82 39.15 1n6b h ILE 141 CO 0.43 0.42 0.31 -0.08 0.00 0.00 0.00 178.15 179.23 1n6b h GLU 142 N 0.08 0.47 -0.88 2.37 4.81 -1.94 0.25 114.58 119.74 1n6b h GLU 142 Ca 0.02 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1n6b h GLU 142 Cb 0.75 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.98 1n6b h GLU 142 CO 0.05 0.31 0.58 -0.44 -0.73 0.00 0.00 179.01 178.78 1n6b h ASP 143 N 0.49 1.00 -0.04 1.04 3.32 -1.88 0.19 116.42 120.54 1n6b h ASP 143 Ca 0.39 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.33 1n6b h ASP 143 Cb 0.55 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1n6b h ASP 143 CO -0.36 0.72 -0.22 0.03 -1.72 0.00 0.00 179.24 177.69 1n6b h ARG 144 N 1.18 0.44 -0.06 3.56 3.08 0.05 -1.82 114.38 120.82 1n6b h ARG 144 Ca 0.32 -0.15 -0.06 0.00 0.07 0.00 0.00 59.98 60.16 1n6b h ARG 144 Cb -0.13 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 29.89 1n6b h ARG 144 CO -0.07 0.64 -0.18 0.82 -1.07 0.00 0.00 179.97 180.11 1n6b h ILE 145 N 0.40 1.44 -0.57 2.04 2.04 0.01 -2.36 117.51 120.50 1n6b h ILE 145 Ca 0.06 -1.56 0.06 0.00 1.00 0.00 0.00 64.86 64.41 1n6b h ILE 145 Cb 0.62 2.30 -0.05 0.00 -0.74 0.00 0.00 36.82 38.95 1n6b h ILE 145 CO 0.04 0.44 0.29 1.56 0.00 0.00 0.00 178.15 180.48 1n6b h GLN 146 N -0.28 0.53 -0.80 2.37 4.20 -0.60 0.43 115.11 120.96 1n6b h GLN 146 Ca -0.01 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.71 1n6b h GLN 146 Cb 0.80 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 28.41 1n6b h GLN 146 CO 0.04 0.35 0.51 1.49 -0.67 0.00 0.00 178.83 180.55 1n6b h GLU 147 N 0.55 0.96 -0.31 1.46 4.57 -1.34 -1.51 114.58 118.96 1n6b h GLU 147 Ca 0.26 -0.06 -0.14 0.00 -1.18 0.00 0.00 59.36 58.24 1n6b h GLU 147 Cb 0.18 -0.22 -0.00 0.00 -0.16 0.00 0.00 28.75 28.55 1n6b h GLU 147 CO -0.18 0.63 -0.37 1.49 -1.18 0.00 0.00 179.01 179.40 1n6b h GLU 148 N 0.99 0.79 -0.25 1.92 4.57 -0.64 -2.66 114.58 119.31 1n6b h GLU 148 Ca 0.32 -0.44 0.01 0.00 -1.18 0.00 0.00 59.36 58.07 1n6b h GLU 148 Cb 0.02 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 1n6b h GLU 148 CO -0.12 1.07 0.17 0.00 -1.18 0.00 0.00 179.01 178.96 1n6b h ALA 149 N 0.71 1.86 -0.22 2.92 0.00 0.13 0.90 119.26 125.55 1n6b h ALA 149 Ca 0.04 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1n6b h ALA 149 Cb 0.96 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1n6b h ALA 149 CO 0.09 0.12 -0.09 0.00 0.00 0.00 0.00 179.25 179.37 1n6b h ARG 150 N 0.31 0.45 0.00 0.00 3.08 -1.00 -2.41 114.38 114.81 1n6b h ARG 150 Ca 0.10 -0.19 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 1n6b h ARG 150 Cb 0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1n6b h ARG 150 CO -0.02 0.72 -0.18 0.00 -1.07 0.00 0.00 179.97 179.42 1n6b h LEU 152 N 0.00 0.09 -1.26 0.00 5.85 -0.65 -2.46 115.31 116.89 1n6b h LEU 152 Ca -0.00 -0.39 0.09 0.00 0.84 0.00 0.00 57.88 58.42 1n6b h LEU 152 Cb 0.41 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.36 1n6b h LEU 152 CO 0.02 0.46 0.55 0.58 -0.34 0.00 0.00 178.44 179.72 1n6b h VAL 153 N -0.27 0.97 -0.38 1.05 2.07 -1.13 -1.86 116.25 116.70 1n6b h VAL 153 Ca 0.01 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.17 1n6b h VAL 153 Cb 0.42 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1n6b h VAL 153 CO 0.01 0.15 -0.07 -0.08 0.02 0.00 0.00 177.57 177.60 1n6b h GLU 154 N 0.83 0.71 0.00 1.57 4.57 -1.40 -1.39 114.58 119.47 1n6b h GLU 154 Ca 0.39 -0.26 -0.03 0.00 -1.18 0.00 0.00 59.36 58.28 1n6b h GLU 154 Cb 0.40 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 28.94 1n6b h GLU 154 CO -0.16 0.85 -0.14 0.93 -1.18 0.00 0.00 179.01 179.31 1n6b h GLU 155 N 0.51 0.00 0.14 1.92 4.39 -0.87 -0.75 114.58 119.91 1n6b h GLU 155 Ca 0.10 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.51 1n6b h GLU 155 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1n6b h GLU 155 CO 0.03 0.14 -1.35 -0.07 -1.16 0.00 0.00 179.01 176.60 1n6b h LEU 156 N 0.00 0.46 -1.30 1.33 3.38 -1.16 -3.22 115.31 114.79 1n6b h LEU 156 Ca -0.00 -0.52 -0.07 0.00 0.09 0.00 0.00 57.88 57.38 1n6b h LEU 156 Cb 0.40 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1n6b h LEU 156 CO 0.02 1.42 -0.31 0.03 0.09 0.00 0.00 178.44 179.68 1n6b h ARG 157 N 0.08 0.00 0.00 1.13 3.08 -0.43 -2.33 114.38 115.91 1n6b h ARG 157 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1n6b h ARG 157 Cb 2.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.05 1n6b h ARG 157 CO 0.20 0.31 0.00 1.63 -1.07 0.00 0.00 179.97 181.04 1n6b n LYS 158 N -3.79 0.77 0.00 0.04 5.02 -0.37 -2.07 118.16 117.75 1n6b n LYS 158 Ca -0.01 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.41 1n6b n LYS 158 Cb 0.40 -1.45 0.46 0.00 -0.02 0.00 0.00 35.03 34.43 1n6b n LYS 158 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1n6b n THR 159 N -0.95 0.00 -2.04 -0.18 -2.24 -0.88 -4.93 114.28 103.06 1n6b n THR 159 Ca 0.16 -0.18 -0.13 0.00 -2.27 0.00 0.00 64.05 61.64 1n6b n THR 159 Cb 0.08 0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 68.69 1n6b n THR 159 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1n6b n ASN 160 N -0.31 -3.78 -0.02 3.42 3.02 -0.88 -0.98 115.26 115.74 1n6b n ASN 160 Ca 0.15 0.23 -0.00 0.00 -0.03 0.00 0.00 54.58 54.93 1n6b n ASN 160 Cb 0.34 -3.32 -0.00 0.00 -0.61 0.00 0.00 39.78 36.19 1n6b n ASN 160 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n6b n ALA 161 N -1.21 -0.00 -1.93 5.41 0.00 -1.26 -5.00 120.51 116.52 1n6b n ALA 161 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.98 1n6b n ALA 161 Cb 0.54 -0.76 -0.05 0.00 0.00 0.00 0.00 19.45 19.18 1n6b n ALA 161 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1n6b s SER 162 N -2.02 6.77 0.44 0.00 1.04 -0.15 -4.53 113.70 115.25 1n6b s SER 162 Ca 0.00 1.52 -0.24 0.00 0.48 0.00 0.00 55.95 57.70 1n6b s SER 162 Cb 0.00 -2.48 -0.09 0.00 0.10 0.00 0.00 66.02 63.55 1n6b s SER 162 CO 0.00 -0.40 1.17 -0.81 0.98 0.00 0.00 173.24 174.18 1n6b n PRO 163 N -0.93 1.66 -3.60 4.02 -0.04 -1.26 -4.64 135.00 130.20 1n6b n PRO 163 Ca 0.06 0.59 -0.10 0.00 -0.04 0.00 0.00 63.50 64.01 1n6b n PRO 163 Cb 0.54 -2.27 -0.02 0.00 -0.04 0.00 0.00 33.50 31.71 1n6b n PRO 163 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n6b s ASP 165 N -2.80 5.56 0.00 0.00 3.68 -1.26 -0.98 116.67 120.86 1n6b s ASP 165 Ca 0.05 -0.40 0.15 0.00 2.13 0.00 0.00 52.55 54.48 1n6b s ASP 165 Cb -0.03 -2.01 0.71 0.00 -1.45 0.00 0.00 42.92 40.14 1n6b s ASP 165 CO -0.05 -0.15 1.44 -0.81 0.13 0.00 0.00 175.17 175.73 1n6b n PRO 166 N 4.99 0.12 -0.25 4.34 -0.04 -1.26 -4.22 135.00 138.68 1n6b n PRO 166 Ca -0.14 0.19 -0.05 0.00 -0.04 0.00 0.00 63.50 63.46 1n6b n PRO 166 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 1n6b n PRO 166 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1n6b h THR 167 N 0.00 0.11 0.02 0.52 2.02 -1.94 -1.20 112.91 112.44 1n6b h THR 167 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1n6b h THR 167 Cb 0.19 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.71 1n6b h THR 167 CO 0.00 0.00 -0.01 0.15 0.37 0.00 0.00 175.52 176.03 1n6b h PHE 168 N -0.13 -0.02 0.00 3.16 3.57 -2.00 -2.96 116.94 118.56 1n6b h PHE 168 Ca 0.25 -0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.62 1n6b h PHE 168 Cb 0.56 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 1n6b h PHE 168 CO -0.71 0.01 -0.61 -0.84 -2.23 0.00 0.00 178.31 173.92 1n6b h ILE 169 N -0.04 1.13 0.00 1.41 3.07 -1.80 -2.79 117.51 118.48 1n6b h ILE 169 Ca -0.00 -2.38 0.00 0.00 1.55 0.00 0.00 64.86 64.03 1n6b h ILE 169 Cb 0.04 2.41 0.00 0.00 -0.27 0.00 0.00 36.82 39.00 1n6b h ILE 169 CO 0.00 0.60 0.00 0.18 -1.05 0.00 0.00 178.15 177.88 1n6b n LEU 170 N -3.36 0.00 -0.01 0.16 4.32 -0.48 -2.45 117.00 115.18 1n6b n LEU 170 Ca 0.01 0.19 0.08 0.00 -0.02 0.00 0.00 56.01 56.26 1n6b n LEU 170 Cb 0.73 -0.19 -0.11 0.00 -1.62 0.00 0.00 43.42 42.23 1n6b n LEU 170 CO 0.41 -0.02 -0.54 0.61 -1.22 0.00 0.00 177.39 176.63 1n6b n GLY 171 N 0.87 -0.64 0.17 -0.72 0.00 -1.11 -4.39 105.19 99.36 1n6b n GLY 171 Ca 0.15 -0.38 -0.22 0.00 0.00 0.00 0.00 46.02 45.57 1n6b n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n6b h ALA 173 N 0.26 -0.11 -0.15 0.00 0.00 -1.75 -1.19 119.26 116.31 1n6b h ALA 173 Ca -0.18 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 1n6b h ALA 173 Cb 1.87 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.77 1n6b h ALA 173 CO 0.23 -0.58 -0.39 -1.35 0.00 0.00 0.00 179.25 177.16 1n6b h PRO 174 N -0.15 0.33 -0.59 0.00 0.11 -1.79 -0.14 132.00 129.77 1n6b h PRO 174 Ca 0.02 -0.16 -0.10 0.00 0.11 0.00 0.00 66.00 65.87 1n6b h PRO 174 Cb 0.17 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.25 1n6b h PRO 174 CO -0.05 0.68 -0.01 0.00 -0.21 0.00 0.00 178.00 178.40 1n6b h ASN 176 N 0.96 0.93 -0.48 0.00 2.35 -0.85 -1.15 115.58 117.34 1n6b h ASN 176 Ca 0.17 -0.36 0.06 0.00 -0.55 0.00 0.00 56.30 55.61 1n6b h ASN 176 Cb 0.57 -0.26 -0.05 0.00 0.05 0.00 0.00 38.32 38.63 1n6b h ASN 176 CO 0.03 1.13 0.20 0.58 -1.65 0.00 0.00 177.43 177.72 1n6b h VAL 177 N 0.78 0.88 -0.39 2.81 2.07 -0.73 -1.09 116.25 120.58 1n6b h VAL 177 Ca 0.10 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1n6b h VAL 177 Cb 0.80 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1n6b h VAL 177 CO 0.07 0.07 0.21 0.40 0.02 0.00 0.00 177.57 178.34 1n6b h ILE 178 N 0.39 1.15 -0.22 4.57 2.04 -1.19 -1.56 117.51 122.70 1n6b h ILE 178 Ca 0.22 -0.40 0.05 0.00 1.00 0.00 0.00 64.86 65.73 1n6b h ILE 178 Cb 0.20 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 1n6b h ILE 178 CO -0.20 0.16 -0.08 0.00 0.00 0.00 0.00 178.15 178.02 1n6b h SER 180 N -0.04 0.29 0.39 0.00 4.64 -0.96 0.97 113.55 118.84 1n6b h SER 180 Ca 0.11 -0.05 -0.18 0.00 -0.47 0.00 0.00 61.79 61.20 1n6b h SER 180 Cb 0.21 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 1n6b h SER 180 CO -0.25 0.40 -0.74 0.58 -0.87 0.00 0.00 176.83 175.95 1n6b h VAL 181 N 0.30 1.42 0.00 0.95 2.07 -0.51 -2.18 116.25 118.31 1n6b h VAL 181 Ca 0.07 -2.24 -0.28 0.00 0.82 0.00 0.00 66.70 65.07 1n6b h VAL 181 Cb 0.31 2.19 -0.04 0.00 -1.52 0.00 0.00 31.29 32.23 1n6b h VAL 181 CO 0.01 0.66 -1.50 -0.38 0.02 0.00 0.00 177.57 176.38 1n6b n ILE 182 N -3.79 1.54 0.30 4.57 5.41 0.85 -1.78 119.36 126.45 1n6b n ILE 182 Ca -0.04 -0.10 0.09 0.00 1.00 0.00 0.00 62.75 63.70 1n6b n ILE 182 Cb 0.71 -2.00 0.16 0.00 -0.71 0.00 0.00 39.64 37.79 1n6b n ILE 182 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1n6b n PHE 183 N -4.37 0.34 -3.83 1.39 3.72 0.33 -2.89 117.46 112.15 1n6b n PHE 183 Ca -0.36 -0.22 -0.29 0.00 -0.05 0.00 0.00 57.45 56.53 1n6b n PHE 183 Cb 0.73 -0.00 0.03 0.00 -0.94 0.00 0.00 39.48 39.29 1n6b n PHE 183 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 1n6b n HIS 184 N 1.11 -2.31 -3.64 1.38 -0.00 -0.82 -4.93 115.22 106.01 1n6b n HIS 184 Ca 0.15 0.88 -0.07 0.00 -0.00 0.00 0.00 57.72 58.68 1n6b n HIS 184 Cb 0.50 -4.01 -0.07 0.00 -0.00 0.00 0.00 29.99 26.41 1n6b n HIS 184 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1n6b s ASN 185 N -3.24 -0.83 0.48 0.26 3.04 -1.25 -4.94 114.94 108.46 1n6b s ASN 185 Ca 0.64 1.35 0.09 0.00 0.04 0.00 0.00 52.86 54.98 1n6b s ASN 185 Cb -0.32 1.35 0.04 0.00 -1.54 0.00 0.00 41.25 40.78 1n6b s ASN 185 CO 0.79 -0.22 0.65 0.00 -3.04 0.00 0.00 177.10 175.28 1n6b s ARG 186 N 1.46 2.64 0.29 0.43 1.70 -1.26 -3.29 118.95 120.91 1n6b s ARG 186 Ca -0.09 -1.38 0.04 0.00 -0.47 0.00 0.00 55.73 53.83 1n6b s ARG 186 Cb -0.05 -2.72 -0.06 0.00 -0.57 0.00 0.00 34.95 31.56 1n6b s ARG 186 CO -0.17 -0.49 0.03 -0.06 -1.08 0.00 0.00 175.30 173.53 1n6b s PHE 187 N -2.47 1.82 0.14 5.89 0.40 -1.26 -5.04 117.98 117.46 1n6b s PHE 187 Ca 0.58 -0.94 -0.20 0.00 -0.60 0.00 0.00 56.93 55.76 1n6b s PHE 187 Cb -0.08 -1.13 -0.07 0.00 0.51 0.00 0.00 43.02 42.24 1n6b s PHE 187 CO 0.35 -0.00 0.66 0.34 0.70 0.00 0.00 175.22 177.27 1n6b s ASP 188 N -3.42 7.12 0.10 1.36 3.68 -1.26 -4.95 116.67 119.30 1n6b s ASP 188 Ca 0.34 1.38 0.11 0.00 2.13 0.00 0.00 52.55 56.51 1n6b s ASP 188 Cb 0.07 -2.40 0.50 0.00 -1.45 0.00 0.00 42.92 39.64 1n6b s ASP 188 CO 0.13 0.18 1.33 -1.22 0.13 0.00 0.00 175.17 175.72 1n6b n TYR 189 N 1.34 0.24 0.90 -5.34 0.53 -1.26 -0.63 117.16 112.94 1n6b n TYR 189 Ca -0.07 0.12 0.11 0.00 -1.02 0.00 0.00 57.90 57.04 1n6b n TYR 189 Cb 0.50 -0.68 0.07 0.00 -1.03 0.00 0.00 39.34 38.20 1n6b n TYR 189 CO 0.00 0.00 0.00 1.63 -1.02 0.00 0.00 176.86 177.47 1n6b n LYS 190 N -1.74 1.88 -1.77 -0.72 5.02 -1.26 -4.92 118.16 114.64 1n6b n LYS 190 Ca 0.01 -1.63 -0.42 0.00 -2.02 0.00 0.00 58.31 54.25 1n6b n LYS 190 Cb 0.07 -1.41 -0.03 0.00 -0.02 0.00 0.00 35.03 33.64 1n6b n LYS 190 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1n6b s ASP 191 N -1.88 6.31 0.20 4.39 2.15 0.19 -4.90 116.67 123.13 1n6b s ASP 191 Ca 0.24 2.34 -0.11 0.00 0.43 0.00 0.00 52.55 55.45 1n6b s ASP 191 Cb 0.18 -2.53 0.22 0.00 -0.30 0.00 0.00 42.92 40.48 1n6b s ASP 191 CO 0.31 -1.21 1.78 -0.08 -0.17 0.00 0.00 175.17 175.81 1n6b h GLU 192 N 11.18 0.54 -0.07 4.34 4.22 -1.92 -2.00 114.58 130.86 1n6b h GLU 192 Ca -0.44 -0.03 -0.01 0.00 0.08 0.00 0.00 59.36 58.96 1n6b h GLU 192 Cb 1.22 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 1n6b h GLU 192 CO 0.95 0.36 0.02 1.49 -2.18 0.00 0.00 179.01 179.65 1n6b h GLU 193 N 0.55 0.11 -0.68 1.92 4.57 -1.97 -2.66 114.58 116.42 1n6b h GLU 193 Ca 0.28 -0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.52 1n6b h GLU 193 Cb 0.22 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.75 1n6b h GLU 193 CO -0.20 0.31 0.45 0.35 -1.18 0.00 0.00 179.01 178.73 1n6b h PHE 194 N -0.11 0.58 -0.00 0.92 3.57 -1.87 -1.67 116.94 118.36 1n6b h PHE 194 Ca 0.02 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 1n6b h PHE 194 Cb 0.25 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.80 1n6b h PHE 194 CO 0.01 0.28 0.00 -0.07 -2.23 0.00 0.00 178.31 176.29 1n6b h LEU 195 N 0.54 0.00 -1.28 0.59 -0.00 -1.17 -0.40 115.31 113.60 1n6b h LEU 195 Ca 0.31 -0.30 0.02 0.00 -0.00 0.00 0.00 57.88 57.91 1n6b h LEU 195 Cb 0.49 -0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.11 1n6b h LEU 195 CO -0.10 0.31 0.50 0.50 -0.00 0.00 0.00 178.44 179.64 1n6b h LYS 196 N -0.30 0.93 0.04 1.13 1.63 -1.04 -0.45 116.57 118.51 1n6b h LYS 196 Ca 0.00 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1n6b h LYS 196 Cb 0.30 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1n6b h LYS 196 CO 0.00 0.61 -0.02 1.25 -3.45 0.00 0.00 179.45 177.85 1n6b h LEU 197 N 0.95 -0.04 -0.79 5.20 7.12 -1.13 0.15 115.31 126.77 1n6b h LEU 197 Ca 0.29 -0.35 0.03 0.00 0.13 0.00 0.00 57.88 57.98 1n6b h LEU 197 Cb -0.01 0.01 -0.05 0.00 -0.53 0.00 0.00 40.66 40.09 1n6b h LEU 197 CO -0.08 0.33 0.51 0.24 -0.13 0.00 0.00 178.44 179.32 1n6b h MET 198 N -0.42 0.98 -0.15 1.25 2.86 -0.79 0.30 114.93 118.96 1n6b h MET 198 Ca -0.01 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1n6b h MET 198 Cb 0.39 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 1n6b h MET 198 CO 0.01 0.65 0.06 1.49 1.06 0.00 0.00 176.91 180.18 1n6b h GLU 199 N 1.01 0.22 -0.93 1.72 4.81 -1.00 -0.18 114.58 120.23 1n6b h GLU 199 Ca 0.31 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.57 1n6b h GLU 199 Cb -0.02 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.26 1n6b h GLU 199 CO -0.10 0.29 0.59 0.77 -0.73 0.00 0.00 179.01 179.83 1n6b h SER 200 N 0.09 0.93 0.36 1.04 0.02 -0.06 0.44 113.55 116.37 1n6b h SER 200 Ca 0.05 0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 60.87 1n6b h SER 200 Cb 0.15 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1n6b h SER 200 CO -0.00 0.59 -0.61 -0.07 -1.14 0.00 0.00 176.83 175.60 1n6b h LEU 201 N 1.06 0.27 0.07 5.07 3.38 -0.69 -2.51 115.31 121.96 1n6b h LEU 201 Ca 0.40 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1n6b h LEU 201 Cb 0.18 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1n6b h LEU 201 CO -0.18 0.81 -0.03 -0.74 0.09 0.00 0.00 178.44 178.40 1n6b h HIS 202 N 0.18 -0.08 -1.00 1.13 2.76 -0.18 -3.23 115.15 114.73 1n6b h HIS 202 Ca -0.01 -0.00 0.17 0.00 -2.20 0.00 0.00 60.37 58.33 1n6b h HIS 202 Cb 1.11 0.03 -0.10 0.00 1.55 0.00 0.00 27.41 30.00 1n6b h HIS 202 CO 0.02 0.44 0.62 1.49 -1.30 0.00 0.00 177.93 179.20 1n6b h GLU 203 N -0.93 0.80 0.00 5.26 4.81 -0.24 0.29 114.58 124.57 1n6b h GLU 203 Ca -0.01 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.09 1n6b h GLU 203 Cb 0.56 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1n6b h GLU 203 CO 0.02 0.53 -0.37 -0.91 -0.73 0.00 0.00 179.01 177.54 1n6b h ASN 204 N 0.82 0.00 0.66 1.04 4.21 -1.57 0.14 115.58 120.89 1n6b h ASN 204 Ca 0.56 0.00 -0.23 0.00 1.21 0.00 0.00 56.30 57.84 1n6b h ASN 204 Cb 0.79 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.96 1n6b h ASN 204 CO -0.35 0.37 -1.48 1.62 -1.29 0.00 0.00 177.43 176.30 1n6b h VAL 205 N 0.00 0.78 -0.05 2.81 3.04 -1.10 -2.98 116.25 118.75 1n6b h VAL 205 Ca -0.00 -2.46 -0.21 0.00 -1.01 0.00 0.00 66.70 63.02 1n6b h VAL 205 Cb 0.81 2.30 -0.00 0.00 -2.01 0.00 0.00 31.29 32.39 1n6b h VAL 205 CO 0.05 0.44 -0.83 -0.08 -1.01 0.00 0.00 177.57 176.14 1n6b h GLU 206 N 0.00 0.43 0.01 4.17 4.81 -0.16 -0.83 114.58 123.00 1n6b h GLU 206 Ca -0.20 -0.40 -0.23 0.00 -0.13 0.00 0.00 59.36 58.39 1n6b h GLU 206 Cb 1.80 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 31.25 1n6b h GLU 206 CO 0.07 1.05 -1.18 -0.07 -0.73 0.00 0.00 179.01 178.15 1n6b h LEU 207 N 0.27 0.02 0.00 1.64 3.38 -0.87 -3.25 115.31 116.49 1n6b h LEU 207 Ca -0.05 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1n6b h LEU 207 Cb 1.44 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.18 1n6b h LEU 207 CO 0.14 1.02 -0.38 -0.11 0.09 0.00 0.00 178.44 179.20 1n6b n LEU 208 N -3.29 0.53 -4.68 1.67 -0.00 -1.13 -4.90 117.00 105.21 1n6b n LEU 208 Ca -0.04 0.26 -0.48 0.00 -0.00 0.00 0.00 56.01 55.75 1n6b n LEU 208 Cb 0.97 -0.28 -0.05 0.00 -0.00 0.00 0.00 43.42 44.06 1n6b n LEU 208 CO 0.47 -0.01 1.51 0.61 -0.00 0.00 0.00 177.39 179.97 1n6b n GLY 209 N 1.41 1.48 3.40 -3.96 0.00 -0.32 -4.95 105.19 102.24 1n6b n GLY 209 Ca 0.05 0.86 -0.16 0.00 0.00 0.00 0.00 46.02 46.77 1n6b n GLY 209 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1n6b s THR 210 N 4.21 0.02 0.14 2.61 -1.32 -1.26 -4.50 115.64 115.55 1n6b s THR 210 Ca 0.93 -0.21 -0.21 0.00 -1.21 0.00 0.00 61.69 60.99 1n6b s THR 210 Cb -0.67 -0.83 0.00 0.00 -1.51 0.00 0.00 72.50 69.49 1n6b s THR 210 CO 0.51 -0.11 1.66 -0.65 -2.21 0.00 0.00 174.62 173.82 1n6b h PRO 211 N 3.42 -0.15 -4.86 7.08 0.11 -1.71 -2.33 132.00 133.56 1n6b h PRO 211 Ca -0.28 0.01 -0.66 0.00 0.11 0.00 0.00 66.00 65.18 1n6b h PRO 211 Cb 1.16 0.03 -0.36 0.00 0.11 0.00 0.00 31.00 31.94 1n6b h PRO 211 CO 0.39 -0.10 -0.82 -1.58 -0.21 0.00 0.00 178.00 175.68 1n6b s TRP 212 N -6.15 2.96 0.59 0.65 0.52 -1.26 -4.42 118.94 111.83 1n6b s TRP 212 Ca -0.14 -1.99 0.29 0.00 0.02 0.00 0.00 56.10 54.28 1n6b s TRP 212 Cb 0.11 -1.87 1.57 0.00 -1.15 0.00 0.00 33.47 32.14 1n6b s TRP 212 CO 0.68 -0.83 2.00 -0.07 0.02 0.00 0.00 176.95 178.75 1n6b h LEU 213 N 7.86 0.00 -0.19 2.99 4.07 -1.96 0.19 115.31 128.28 1n6b h LEU 213 Ca -0.29 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.67 1n6b h LEU 213 Cb 1.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.82 1n6b h LEU 213 CO 0.52 0.00 0.00 0.00 -1.08 0.00 0.00 178.44 177.88 1n6b n GLN 214 N -3.73 0.06 -0.21 1.13 3.00 -1.26 -3.07 117.38 113.30 1n6b n GLN 214 Ca 0.05 0.29 0.01 0.00 -0.01 0.00 0.00 57.00 57.34 1n6b n GLN 214 Cb 0.48 -1.60 0.10 0.00 0.00 0.00 0.00 30.24 29.22 1n6b n GLN 214 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 1n6b h VAL 215 N 0.00 0.47 -0.67 5.09 3.04 -1.02 -0.96 116.25 122.20 1n6b h VAL 215 Ca 0.00 -0.04 0.06 0.00 -1.01 0.00 0.00 66.70 65.71 1n6b h VAL 215 Cb 0.29 0.35 -0.05 0.00 -2.01 0.00 0.00 31.29 29.87 1n6b h VAL 215 CO 0.00 0.02 0.38 1.88 -1.01 0.00 0.00 177.57 178.84 1n6b h TYR 216 N 0.11 0.69 0.00 3.17 -1.99 -1.77 -0.28 116.97 116.90 1n6b h TYR 216 Ca 0.33 0.02 0.00 0.00 2.00 0.00 0.00 58.73 61.08 1n6b h TYR 216 Cb 0.54 -0.21 0.00 0.00 2.00 0.00 0.00 36.73 39.05 1n6b h TYR 216 CO -0.38 0.33 0.00 -0.97 -0.00 0.00 0.00 178.16 177.15 1n6b h ASN 217 N 0.70 0.00 0.03 3.88 -1.24 -1.57 -3.17 115.58 114.21 1n6b h ASN 217 Ca 0.30 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.31 1n6b h ASN 217 Cb 0.18 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.23 1n6b h ASN 217 CO -0.18 0.00 -0.25 0.59 -1.29 0.00 0.00 177.43 176.30 1n6b n ASN 218 N -3.00 2.00 -3.24 1.15 3.02 -0.44 -4.59 115.26 110.16 1n6b n ASN 218 Ca 0.04 -1.51 -0.25 0.00 -0.03 0.00 0.00 54.58 52.83 1n6b n ASN 218 Cb 0.50 0.22 -0.07 0.00 -0.61 0.00 0.00 39.78 39.82 1n6b n ASN 218 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1n6b n PHE 219 N 0.22 0.16 -0.08 3.10 0.99 -0.18 -4.76 117.46 116.91 1n6b n PHE 219 Ca 0.12 -3.63 0.03 0.00 -0.00 0.00 0.00 57.45 53.98 1n6b n PHE 219 Cb 0.46 -0.34 0.37 0.00 -1.00 0.00 0.00 39.48 38.97 1n6b n PHE 219 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.76 175.41 1n6b h PRO 220 N 4.13 0.68 0.00 -1.08 0.11 -1.81 -2.66 132.00 131.37 1n6b h PRO 220 Ca 0.10 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1n6b h PRO 220 Cb 0.85 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1n6b h PRO 220 CO 0.51 0.45 0.00 0.00 -0.21 0.00 0.00 178.00 178.75 1n6b n ALA 221 N -2.46 1.18 0.18 -0.75 0.00 -1.26 -0.84 120.51 116.56 1n6b n ALA 221 Ca 0.05 0.18 0.03 0.00 0.00 0.00 0.00 53.44 53.70 1n6b n ALA 221 Cb 0.06 -1.33 0.34 0.00 0.00 0.00 0.00 19.45 18.52 1n6b n ALA 221 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1n6b h LEU 222 N 0.00 0.00 -0.79 0.00 5.85 -1.85 -1.63 115.31 116.89 1n6b h LEU 222 Ca 0.00 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.59 1n6b h LEU 222 Cb 0.08 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1n6b h LEU 222 CO 0.00 0.41 -0.55 0.25 -0.34 0.00 0.00 178.44 178.21 1n6b h LEU 223 N 0.00 0.17 0.00 2.25 6.46 -1.17 -2.24 115.31 120.78 1n6b h LEU 223 Ca -0.00 -0.09 -0.22 0.00 -0.12 0.00 0.00 57.88 57.44 1n6b h LEU 223 Cb 0.78 -0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.63 1n6b h LEU 223 CO 0.05 0.69 -1.21 0.44 -0.62 0.00 0.00 178.44 177.79 1n6b h ASP 224 N 0.12 0.00 1.37 1.25 3.32 -1.54 -3.17 116.42 117.78 1n6b h ASP 224 Ca -0.00 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1n6b h ASP 224 Cb 1.01 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1n6b h ASP 224 CO 0.08 0.93 -0.43 1.88 -1.72 0.00 0.00 179.24 179.97 1n6b h TYR 225 N 0.00 0.00 -1.74 4.55 0.05 -1.21 -3.40 116.97 115.23 1n6b h TYR 225 Ca -0.11 0.00 -0.48 0.00 0.05 0.00 0.00 58.73 58.19 1n6b h TYR 225 Cb 1.80 0.00 -0.36 0.00 1.01 0.00 0.00 36.73 39.18 1n6b h TYR 225 CO 0.00 0.43 -1.06 1.19 -1.05 0.00 0.00 178.16 177.67 1n6b n PHE 226 N -3.27 -0.50 0.23 4.88 3.72 -0.85 -4.97 117.46 116.69 1n6b n PHE 226 Ca 0.02 -3.45 0.13 0.00 -0.05 0.00 0.00 57.45 54.10 1n6b n PHE 226 Cb 0.66 -0.12 0.77 0.00 -0.94 0.00 0.00 39.48 39.85 1n6b n PHE 226 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1n6b h PRO 227 N 3.52 0.00 -0.23 -1.08 0.11 -1.76 -2.70 132.00 129.85 1n6b h PRO 227 Ca 0.06 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.08 1n6b h PRO 227 Cb 0.94 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1n6b h PRO 227 CO 0.45 0.00 -0.25 0.78 -0.21 0.00 0.00 178.00 178.77 1n6b h GLY 228 N 0.00 0.47 0.27 -0.55 0.00 -1.93 -2.89 103.07 98.43 1n6b h GLY 228 Ca 0.05 -0.37 0.05 0.00 0.00 0.00 0.00 47.33 47.05 1n6b h GLY 228 CO -0.00 0.34 -0.26 -2.22 0.00 0.00 0.00 176.54 174.40 1n6b h ILE 229 N 0.38 0.39 -0.15 2.60 2.04 -1.90 -0.48 117.51 120.40 1n6b h ILE 229 Ca 0.06 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.87 1n6b h ILE 229 Cb 0.64 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1n6b h ILE 229 CO 0.05 0.00 -0.15 0.45 0.00 0.00 0.00 178.15 178.50 1n6b h HIS 230 N -0.33 0.25 -0.56 1.37 3.86 -1.72 -1.91 115.15 116.11 1n6b h HIS 230 Ca 0.10 -0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.19 1n6b h HIS 230 Cb 0.48 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.86 1n6b h HIS 230 CO -0.35 0.38 -0.01 0.87 0.86 0.00 0.00 177.93 179.68 1n6b h LYS 231 N 0.23 1.00 -0.30 2.45 1.57 -1.09 -0.62 116.57 119.81 1n6b h LYS 231 Ca 0.05 -0.32 -0.07 0.00 -1.87 0.00 0.00 60.65 58.43 1n6b h LYS 231 Cb 0.40 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1n6b h LYS 231 CO 0.02 1.00 -0.08 1.15 -0.57 0.00 0.00 179.45 180.98 1n6b h THR 232 N 0.89 1.28 -0.35 -0.16 2.02 -0.71 -2.20 112.91 113.68 1n6b h THR 232 Ca 0.16 -1.12 0.05 0.00 0.77 0.00 0.00 66.41 66.27 1n6b h THR 232 Cb 0.56 1.39 -0.05 0.00 -1.74 0.00 0.00 68.15 68.31 1n6b h THR 232 CO 0.03 0.36 0.06 -0.07 0.37 0.00 0.00 175.52 176.27 1n6b h LEU 233 N 0.35 -0.00 -0.85 2.58 3.38 -1.12 -0.58 115.31 119.06 1n6b h LEU 233 Ca 0.08 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1n6b h LEU 233 Cb 0.56 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 1n6b h LEU 233 CO 0.03 0.03 0.35 -0.07 0.09 0.00 0.00 178.44 178.88 1n6b h LEU 234 N 0.18 1.09 0.78 1.67 3.38 -1.09 0.18 115.31 121.49 1n6b h LEU 234 Ca 0.16 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1n6b h LEU 234 Cb 0.19 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1n6b h LEU 234 CO -0.22 0.95 -0.45 0.50 0.09 0.00 0.00 178.44 179.30 1n6b h LYS 235 N 1.17 -1.10 -0.44 1.13 3.64 -0.72 0.19 116.57 120.44 1n6b h LYS 235 Ca 0.27 0.08 0.06 0.00 -1.27 0.00 0.00 60.65 59.79 1n6b h LYS 235 Cb 0.17 0.25 -0.06 0.00 -0.41 0.00 0.00 32.23 32.19 1n6b h LYS 235 CO -0.03 -0.73 0.11 -0.91 -2.27 0.00 0.00 179.45 175.62 1n6b h ASN 236 N -1.14 0.07 -0.55 4.20 2.35 -1.00 0.16 115.58 119.66 1n6b h ASN 236 Ca -0.10 0.07 0.08 0.00 -0.55 0.00 0.00 56.30 55.79 1n6b h ASN 236 Cb 0.91 0.08 -0.07 0.00 0.05 0.00 0.00 38.32 39.29 1n6b h ASN 236 CO 0.12 0.07 0.18 0.00 -1.65 0.00 0.00 177.43 176.15 1n6b h ALA 237 N 1.32 0.68 0.00 -0.83 0.00 -0.52 0.97 119.26 120.87 1n6b h ALA 237 Ca 0.21 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.10 1n6b h ALA 237 Cb 0.24 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1n6b h ALA 237 CO -0.25 -0.23 -0.49 -0.44 0.00 0.00 0.00 179.25 177.84 1n6b h ASP 238 N 0.35 0.00 -0.31 0.00 3.32 0.91 0.57 116.42 121.26 1n6b h ASP 238 Ca 0.27 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.24 1n6b h ASP 238 Cb 0.33 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 1n6b h ASP 238 CO -0.29 0.49 -0.15 0.22 -1.72 0.00 0.00 179.24 177.78 1n6b h TYR 239 N 0.00 0.74 -0.56 4.55 5.03 0.44 -1.02 116.97 126.15 1n6b h TYR 239 Ca -0.00 -0.19 0.01 0.00 2.58 0.00 0.00 58.73 61.13 1n6b h TYR 239 Cb 0.91 -0.17 -0.03 0.00 1.55 0.00 0.00 36.73 38.99 1n6b h TYR 239 CO 0.00 0.87 0.37 0.82 -1.32 0.00 0.00 178.16 178.90 1n6b h ILE 240 N 0.40 1.13 0.05 1.81 2.04 -0.56 -0.02 117.51 122.36 1n6b h ILE 240 Ca 0.07 -0.26 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 1n6b h ILE 240 Cb 0.68 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1n6b h ILE 240 CO 0.05 0.14 -0.02 0.11 0.00 0.00 0.00 178.15 178.42 1n6b h LYS 241 N 0.74 -0.06 -0.79 2.37 1.57 -0.69 -1.43 116.57 118.28 1n6b h LYS 241 Ca 0.21 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.96 1n6b h LYS 241 Cb -0.07 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.22 1n6b h LYS 241 CO -0.06 0.02 0.36 -0.97 -0.57 0.00 0.00 179.45 178.23 1n6b h ASN 242 N -0.13 1.06 -0.81 0.86 -0.73 -1.06 0.39 115.58 115.15 1n6b h ASN 242 Ca -0.01 -0.14 0.02 0.00 1.87 0.00 0.00 56.30 58.05 1n6b h ASN 242 Cb 0.11 -0.27 -0.05 0.00 0.27 0.00 0.00 38.32 38.39 1n6b h ASN 242 CO 0.01 0.91 0.53 0.15 -0.37 0.00 0.00 177.43 178.66 1n6b h PHE 243 N 1.14 0.99 -0.04 0.67 3.04 -0.78 -0.67 116.94 121.28 1n6b h PHE 243 Ca 0.27 0.03 -0.25 0.00 3.98 0.00 0.00 57.97 61.99 1n6b h PHE 243 Cb 0.15 -0.33 0.02 0.00 2.56 0.00 0.00 35.95 38.35 1n6b h PHE 243 CO 0.02 0.59 -0.97 0.82 -2.02 0.00 0.00 178.31 176.74 1n6b h ILE 244 N 1.04 1.28 -0.78 1.41 2.04 -0.59 -3.28 117.51 118.62 1n6b h ILE 244 Ca 0.32 -2.17 -0.02 0.00 1.00 0.00 0.00 64.86 63.98 1n6b h ILE 244 Cb -0.03 2.26 -0.04 0.00 -0.74 0.00 0.00 36.82 38.27 1n6b h ILE 244 CO -0.10 0.68 0.40 -0.03 0.00 0.00 0.00 178.15 179.10 1n6b h MET 245 N 0.44 1.10 -0.08 2.37 4.05 0.23 -2.61 114.93 120.43 1n6b h MET 245 Ca -0.11 -0.14 -0.00 0.00 -0.28 0.00 0.00 59.70 59.17 1n6b h MET 245 Cb 1.61 -0.21 -0.00 0.00 -0.80 0.00 0.00 31.60 32.20 1n6b h MET 245 CO 0.19 0.83 0.05 0.93 0.23 0.00 0.00 176.91 179.14 1n6b h GLU 246 N 1.10 0.11 0.00 0.39 5.08 -1.21 -2.14 114.58 117.91 1n6b h GLU 246 Ca 0.27 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.61 1n6b h GLU 246 Cb 0.07 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 1n6b h GLU 246 CO -0.04 0.11 -0.05 0.87 -1.00 0.00 0.00 179.01 178.91 1n6b h LYS 247 N 0.08 0.00 0.00 2.33 1.79 -1.58 -2.63 116.57 116.55 1n6b h LYS 247 Ca 0.03 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.34 1n6b h LYS 247 Cb 0.03 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.69 1n6b h LYS 247 CO -0.01 0.05 -0.61 0.28 -1.08 0.00 0.00 179.45 178.08 1n6b h VAL 248 N 0.00 1.43 -0.67 0.50 2.07 -1.03 -2.53 116.25 116.01 1n6b h VAL 248 Ca -0.00 -2.09 -0.02 0.00 0.82 0.00 0.00 66.70 65.41 1n6b h VAL 248 Cb 0.19 2.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.53 1n6b h VAL 248 CO 0.01 0.61 0.32 0.11 0.02 0.00 0.00 177.57 178.64 1n6b h LYS 249 N -0.10 0.96 0.00 1.57 1.57 -1.03 -1.59 116.57 117.94 1n6b h LYS 249 Ca -0.08 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1n6b h LYS 249 Cb 1.32 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1n6b h LYS 249 CO 0.12 0.74 -0.20 -0.85 -0.57 0.00 0.00 179.45 178.69 1n6b n GLU 250 N -4.34 0.02 0.09 3.15 0.28 -1.15 -3.10 120.64 115.59 1n6b n GLU 250 Ca 0.06 0.01 -0.16 0.00 -0.16 0.00 0.00 57.16 56.91 1n6b n GLU 250 Cb 0.13 -1.51 -0.14 0.00 1.43 0.00 0.00 31.44 31.35 1n6b n GLU 250 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1n6b h HIS 251 N 0.00 0.48 -0.42 -1.84 3.86 -0.86 -3.28 115.15 113.08 1n6b h HIS 251 Ca 0.00 -0.35 0.01 0.00 -1.16 0.00 0.00 60.37 58.87 1n6b h HIS 251 Cb 0.51 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 1n6b h HIS 251 CO 0.00 1.32 0.28 1.96 0.86 0.00 0.00 177.93 182.35 1n6b h GLN 252 N 0.07 0.54 -0.03 2.45 4.20 -1.27 -2.02 115.11 119.05 1n6b h GLN 252 Ca -0.18 -0.03 -0.24 0.00 0.06 0.00 0.00 58.65 58.26 1n6b h GLN 252 Cb 1.99 -0.12 0.02 0.00 0.30 0.00 0.00 27.48 29.67 1n6b h GLN 252 CO 0.19 0.36 -0.93 0.87 -0.67 0.00 0.00 178.83 178.65 1n6b h LYS 253 N 0.56 0.69 -0.48 1.46 1.57 -1.66 -3.26 116.57 115.45 1n6b h LYS 253 Ca 0.16 -0.69 0.00 0.00 -1.87 0.00 0.00 60.65 58.24 1n6b h LYS 253 Cb -0.05 0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1n6b h LYS 253 CO -0.03 1.28 0.00 1.28 -0.57 0.00 0.00 179.45 181.41 1n6b n LEU 254 N -3.93 2.39 -4.72 2.94 4.77 -1.05 -4.96 117.00 112.44 1n6b n LEU 254 Ca -0.10 -1.20 -0.42 0.00 -0.03 0.00 0.00 56.01 54.26 1n6b n LEU 254 Cb 0.83 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1n6b n LEU 254 CO 0.54 0.50 1.11 -0.22 -1.33 0.00 0.00 177.39 178.00 1n6b s LEU 255 N -1.10 4.38 -0.31 2.23 2.96 -0.79 -5.00 118.68 121.05 1n6b s LEU 255 Ca 0.26 2.49 0.00 0.00 -0.22 0.00 0.00 54.13 56.67 1n6b s LEU 255 Cb 0.15 -3.60 0.06 0.00 0.50 0.00 0.00 46.19 43.31 1n6b s LEU 255 CO 0.15 -0.70 -0.00 -0.62 -1.32 0.00 0.00 176.35 173.86 1n6b s ASP 256 N 0.88 4.80 0.60 3.68 -1.08 -1.26 -5.00 116.67 119.29 1n6b s ASP 256 Ca 0.64 -1.49 0.31 0.00 -0.52 0.00 0.00 52.55 51.50 1n6b s ASP 256 Cb -0.40 -1.67 1.85 0.00 -1.46 0.00 0.00 42.92 41.24 1n6b s ASP 256 CO 0.34 -0.29 2.21 -0.37 0.52 0.00 0.00 175.17 177.59 1n6b h VAL 257 N 6.55 0.42 0.00 1.11 -1.51 -1.98 -2.29 116.25 118.56 1n6b h VAL 257 Ca -0.18 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.29 1n6b h VAL 257 Cb 1.05 0.93 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 1n6b h VAL 257 CO 0.53 0.00 -1.37 0.59 -1.23 0.00 0.00 177.57 176.09 1n6b n ASN 258 N -3.69 0.48 -3.62 4.19 3.02 -1.26 -4.74 115.26 109.64 1n6b n ASN 258 Ca -0.02 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.25 1n6b n ASN 258 Cb 0.17 1.13 -0.12 0.00 -0.61 0.00 0.00 39.78 40.35 1n6b n ASN 258 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1n6b s ASN 259 N -4.54 3.14 -0.17 6.41 2.47 -0.86 -5.10 114.94 116.28 1n6b s ASN 259 Ca -0.02 -2.93 -0.29 0.00 0.42 0.00 0.00 52.86 50.05 1n6b s ASN 259 Cb 0.13 -0.89 -0.01 0.00 -1.45 0.00 0.00 41.25 39.03 1n6b s ASN 259 CO 0.84 -0.21 1.17 -2.84 -3.72 0.00 0.00 177.10 172.34 1n6b s PRO 260 N 0.02 4.26 0.00 0.43 0.02 -1.25 -4.52 135.00 133.97 1n6b s PRO 260 Ca 0.23 1.55 0.23 0.00 0.02 0.00 0.00 61.00 63.03 1n6b s PRO 260 Cb -0.12 -3.69 0.04 0.00 0.02 0.00 0.00 34.50 30.74 1n6b s PRO 260 CO -0.09 -0.64 1.10 0.54 -0.33 0.00 0.00 177.00 177.59 1n6b n ARG 261 N 6.30 0.63 -2.19 5.54 1.74 -1.26 -2.63 116.66 124.80 1n6b n ARG 261 Ca 0.13 -0.50 -0.04 0.00 -0.77 0.00 0.00 57.85 56.67 1n6b n ARG 261 Cb 0.46 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.42 1n6b n ARG 261 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1n6b n ASP 262 N -0.75 -0.97 0.31 0.55 3.85 -1.26 -4.74 116.55 113.54 1n6b n ASP 262 Ca 0.07 -1.67 -0.17 0.00 -0.71 0.00 0.00 54.79 52.32 1n6b n ASP 262 Cb 0.39 1.62 -0.08 0.00 -1.35 0.00 0.00 41.12 41.70 1n6b n ASP 262 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.20 176.34 1n6b h PHE 263 N 1.42 -0.78 -0.28 2.11 3.57 -1.36 -2.39 116.94 119.22 1n6b h PHE 263 Ca -0.14 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.41 1n6b h PHE 263 Cb 0.53 0.27 -0.08 0.00 2.79 0.00 0.00 35.95 39.46 1n6b h PHE 263 CO 0.00 -0.47 -0.34 0.82 -2.23 0.00 0.00 178.31 176.09 1n6b h ILE 264 N -0.78 0.24 -0.52 1.41 2.04 -1.81 -0.14 117.51 117.94 1n6b h ILE 264 Ca -0.07 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.90 1n6b h ILE 264 Cb 0.62 0.24 -0.10 0.00 -0.74 0.00 0.00 36.82 36.84 1n6b h ILE 264 CO 0.09 0.00 -0.17 0.44 0.00 0.00 0.00 178.15 178.51 1n6b h ASP 265 N -0.33 -0.60 -0.26 1.72 3.32 -1.81 0.89 116.42 119.35 1n6b h ASP 265 Ca 0.13 0.17 -0.05 0.00 0.02 0.00 0.00 57.03 57.30 1n6b h ASP 265 Cb 0.55 0.37 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 1n6b h ASP 265 CO -0.46 -0.21 0.01 0.00 -1.72 0.00 0.00 179.24 176.87 1n6b h PHE 267 N 0.54 0.28 -0.00 0.00 3.57 0.14 -1.97 116.94 119.49 1n6b h PHE 267 Ca 0.12 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1n6b h PHE 267 Cb 0.32 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.00 1n6b h PHE 267 CO 0.01 0.63 0.01 -0.07 -2.23 0.00 0.00 178.31 176.66 1n6b h LEU 268 N -0.15 0.00 0.12 0.59 3.38 0.10 -1.28 115.31 118.07 1n6b h LEU 268 Ca 0.02 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.71 1n6b h LEU 268 Cb 0.57 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 1n6b h LEU 268 CO 0.02 0.00 -1.35 0.40 0.09 0.00 0.00 178.44 177.60 1n6b h ILE 269 N 0.00 1.36 0.00 1.22 2.04 -1.07 -3.20 117.51 117.86 1n6b h ILE 269 Ca 0.00 -2.97 0.00 0.00 1.00 0.00 0.00 64.86 62.89 1n6b h ILE 269 Cb 0.02 2.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.95 1n6b h ILE 269 CO -0.00 0.86 0.00 0.50 0.00 0.00 0.00 178.15 179.51 1n6b h LYS 270 N 0.07 0.00 0.00 2.37 1.63 -0.47 -2.46 116.57 117.71 1n6b h LYS 270 Ca -0.17 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.63 1n6b h LYS 270 Cb 1.98 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.61 1n6b h LYS 270 CO 0.18 0.00 -0.22 -1.33 -3.45 0.00 0.00 179.45 174.64 1n6b n MET 271 N -2.99 0.07 0.00 1.90 2.81 -0.99 -4.40 117.12 113.52 1n6b n MET 271 Ca -0.00 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 1n6b n MET 271 Cb 0.23 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 31.17 1n6b n MET 271 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1n6b n GLU 272 N -1.67 0.00 0.00 0.03 1.02 -0.93 -4.73 120.64 114.36 1n6b n GLU 272 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 1n6b n GLU 272 Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.78 1n6b n GLU 272 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1n6b n GLN 273 N 0.00 0.00 -3.79 3.49 6.02 -1.26 -4.34 117.38 117.50 1n6b n GLN 273 Ca 0.00 0.03 -0.36 0.00 -0.01 0.00 0.00 57.00 56.66 1n6b n GLN 273 Cb 0.00 -1.52 -0.13 0.00 1.02 0.00 0.00 30.24 29.61 1n6b n GLN 273 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 1n6b s GLU 274 N -1.78 3.41 -0.86 -1.09 1.03 -1.26 -5.05 118.70 113.09 1n6b s GLU 274 Ca 0.00 -0.64 -0.25 0.00 0.03 0.00 0.00 54.97 54.11 1n6b s GLU 274 Cb 0.00 -3.27 0.02 0.00 -0.80 0.00 0.00 34.13 30.09 1n6b s GLU 274 CO 0.00 -0.27 1.49 -0.80 -1.33 0.00 0.00 175.26 174.35 1n6b s ASN 275 N 1.55 6.09 -0.20 0.83 0.01 -1.26 -4.66 114.94 117.29 1n6b s ASN 275 Ca 0.05 -0.82 -0.05 0.00 -0.71 0.00 0.00 52.86 51.34 1n6b s ASN 275 Cb -0.16 -2.56 0.07 0.00 0.41 0.00 0.00 41.25 39.01 1n6b s ASN 275 CO 0.02 -1.86 0.10 0.20 -1.51 0.00 0.00 177.10 174.04 1n6b s ASN 276 N 5.21 2.65 0.13 -1.22 0.01 -1.26 -4.99 114.94 115.47 1n6b s ASN 276 Ca 0.47 -0.79 0.23 0.00 -0.71 0.00 0.00 52.86 52.06 1n6b s ASN 276 Cb -0.05 -0.26 0.89 0.00 0.41 0.00 0.00 41.25 42.24 1n6b s ASN 276 CO 0.03 -0.37 1.70 0.00 -1.51 0.00 0.00 177.10 176.95 1n6b n LEU 277 N 5.27 0.38 0.20 0.60 -0.00 -1.26 -2.51 117.00 119.68 1n6b n LEU 277 Ca -0.07 0.57 0.07 0.00 -0.00 0.00 0.00 56.01 56.58 1n6b n LEU 277 Cb 0.47 -0.49 0.36 0.00 -0.00 0.00 0.00 43.42 43.76 1n6b n LEU 277 CO 0.08 -0.29 0.71 -0.08 -0.00 0.00 0.00 177.39 177.81 1n6b h GLU 278 N 0.00 0.00 -4.49 1.47 4.57 -2.00 -3.41 114.58 110.72 1n6b h GLU 278 Ca 0.00 0.00 -0.72 0.00 -1.18 0.00 0.00 59.36 57.46 1n6b h GLU 278 Cb 0.44 0.00 -0.22 0.00 -0.16 0.00 0.00 28.75 28.81 1n6b h GLU 278 CO 0.00 0.33 -0.43 -0.06 -1.18 0.00 0.00 179.01 177.67 1n6b s PHE 279 N -3.59 3.24 0.26 0.92 0.08 -1.04 -4.82 117.98 113.03 1n6b s PHE 279 Ca 0.00 -0.66 0.03 0.00 0.12 0.00 0.00 56.93 56.42 1n6b s PHE 279 Cb 0.11 -2.63 -0.04 0.00 -0.57 0.00 0.00 43.02 39.89 1n6b s PHE 279 CO 0.67 -0.61 0.20 0.95 -0.10 0.00 0.00 175.22 176.32 1n6b s THR 280 N 1.66 0.03 0.26 0.64 -4.23 -1.26 -4.84 115.64 107.90 1n6b s THR 280 Ca 0.05 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.52 1n6b s THR 280 Cb -0.19 -2.50 0.19 0.00 1.34 0.00 0.00 72.50 71.33 1n6b s THR 280 CO 0.09 0.00 1.85 -0.07 -0.54 0.00 0.00 174.62 175.96 1n6b h LEU 281 N 2.38 0.94 -0.42 4.79 3.38 -1.99 -1.78 115.31 122.60 1n6b h LEU 281 Ca -0.31 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.42 1n6b h LEU 281 Cb 1.24 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1n6b h LEU 281 CO 0.46 0.81 -0.23 -0.08 0.09 0.00 0.00 178.44 179.49 1n6b h GLU 282 N 1.02 0.90 -0.92 1.13 4.81 -1.99 -2.10 114.58 117.43 1n6b h GLU 282 Ca 0.24 -0.41 0.04 0.00 -0.13 0.00 0.00 59.36 59.11 1n6b h GLU 282 Cb 0.14 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 1n6b h GLU 282 CO -0.03 1.06 0.60 1.03 -0.73 0.00 0.00 179.01 180.95 1n6b h SER 283 N 0.73 0.99 0.03 1.04 0.87 -1.78 -1.79 113.55 113.63 1n6b h SER 283 Ca 0.09 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1n6b h SER 283 Cb 0.80 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 1n6b h SER 283 CO 0.07 0.67 -0.01 0.25 -0.53 0.00 0.00 176.83 177.28 1n6b h LEU 284 N 1.14 -0.03 -0.60 2.23 5.85 -1.15 -1.74 115.31 121.01 1n6b h LEU 284 Ca 0.37 -0.37 0.09 0.00 0.84 0.00 0.00 57.88 58.81 1n6b h LEU 284 Cb 0.04 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.01 1n6b h LEU 284 CO -0.12 0.36 0.24 0.58 -0.34 0.00 0.00 178.44 179.16 1n6b h VAL 285 N -0.42 0.80 -0.43 1.05 2.07 -1.10 0.12 116.25 118.34 1n6b h VAL 285 Ca -0.00 -0.15 -0.10 0.00 0.82 0.00 0.00 66.70 67.27 1n6b h VAL 285 Cb 0.40 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1n6b h VAL 285 CO 0.01 0.08 -0.13 0.40 0.02 0.00 0.00 177.57 177.95 1n6b h ILE 286 N 0.44 1.26 -0.58 4.57 2.04 -1.32 -1.07 117.51 122.84 1n6b h ILE 286 Ca 0.30 -1.20 -0.08 0.00 1.00 0.00 0.00 64.86 64.87 1n6b h ILE 286 Cb 0.35 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1n6b h ILE 286 CO -0.28 0.41 0.03 0.00 0.00 0.00 0.00 178.15 178.31 1n6b h ALA 287 N 1.14 0.78 -0.37 1.87 0.00 -0.37 -1.94 119.26 120.37 1n6b h ALA 287 Ca 0.12 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1n6b h ALA 287 Cb 0.62 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1n6b h ALA 287 CO 0.04 0.58 -0.19 0.28 0.00 0.00 0.00 179.25 179.96 1n6b h VAL 288 N 0.89 1.27 -0.57 0.00 2.07 -0.50 -1.99 116.25 117.42 1n6b h VAL 288 Ca 0.17 -1.27 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 1n6b h VAL 288 Cb 0.51 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1n6b h VAL 288 CO 0.02 0.42 0.24 0.28 0.02 0.00 0.00 177.57 178.56 1n6b h SER 289 N 0.63 0.77 -0.17 0.57 0.02 -1.04 -0.79 113.55 113.54 1n6b h SER 289 Ca 0.09 -0.16 0.03 0.00 -0.84 0.00 0.00 61.79 60.91 1n6b h SER 289 Cb 0.67 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.99 1n6b h SER 289 CO 0.05 0.72 0.01 0.44 -1.14 0.00 0.00 176.83 176.91 1n6b h ASP 290 N 0.78 -0.04 -0.23 3.07 3.45 -1.06 0.27 116.42 122.65 1n6b h ASP 290 Ca 0.19 0.03 0.03 0.00 0.43 0.00 0.00 57.03 57.71 1n6b h ASP 290 Cb 0.17 0.05 -0.03 0.00 -0.56 0.00 0.00 39.33 38.97 1n6b h ASP 290 CO -0.02 0.01 0.06 -0.07 -1.57 0.00 0.00 179.24 177.65 1n6b h LEU 291 N 0.07 0.05 0.10 1.55 3.38 -1.05 0.76 115.31 120.17 1n6b h LEU 291 Ca 0.08 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1n6b h LEU 291 Cb 0.09 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1n6b h LEU 291 CO -0.12 0.06 -0.07 -0.26 0.09 0.00 0.00 178.44 178.13 1n6b h PHE 292 N 0.16 -0.18 -0.31 1.13 -1.00 -0.81 0.26 116.94 116.18 1n6b h PHE 292 Ca 0.10 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.91 1n6b h PHE 292 Cb 0.09 0.07 -0.03 0.00 3.61 0.00 0.00 35.95 39.68 1n6b h PHE 292 CO -0.14 -0.11 0.13 0.78 -1.61 0.00 0.00 178.31 177.36 1n6b h GLY 293 N -0.18 0.39 2.00 -1.45 0.00 -0.12 -2.13 103.07 101.59 1n6b h GLY 293 Ca -0.01 -0.08 -0.11 0.00 0.00 0.00 0.00 47.33 47.13 1n6b h GLY 293 CO 0.00 0.06 -0.53 0.00 0.00 0.00 0.00 176.54 176.07 1n6b h ALA 294 N 1.18 0.78 -0.02 3.60 0.00 0.66 -3.38 119.26 122.09 1n6b h ALA 294 Ca 0.13 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1n6b h ALA 294 Cb 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1n6b h ALA 294 CO -0.12 0.66 -0.17 0.41 0.00 0.00 0.00 179.25 180.04 1n6b n GLY 295 N 0.75 0.12 0.07 0.00 0.00 0.90 -4.40 105.19 102.63 1n6b n GLY 295 Ca 0.01 -0.48 -0.05 0.00 0.00 0.00 0.00 46.02 45.50 1n6b n GLY 295 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1n6b n THR 296 N 0.42 1.36 -0.25 2.61 -1.04 -0.81 -3.84 114.28 112.72 1n6b n THR 296 Ca 0.08 0.23 -0.08 0.00 -2.04 0.00 0.00 64.05 62.25 1n6b n THR 296 Cb 0.39 -2.35 0.04 0.00 -1.82 0.00 0.00 70.33 66.58 1n6b n THR 296 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1n6b h GLU 297 N -0.96 1.10 -0.14 -2.82 4.57 -1.80 -0.02 114.58 114.50 1n6b h GLU 297 Ca 0.00 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 57.91 1n6b h GLU 297 Cb 0.51 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.95 1n6b h GLU 297 CO 0.00 0.98 0.06 1.79 -1.18 0.00 0.00 179.01 180.66 1n6b h THR 298 N 1.03 1.15 -0.21 0.32 1.35 -1.81 -0.59 112.91 114.15 1n6b h THR 298 Ca 0.21 -0.44 -0.04 0.00 -0.55 0.00 0.00 66.41 65.60 1n6b h THR 298 Cb 0.37 1.18 -0.01 0.00 -1.73 0.00 0.00 68.15 67.97 1n6b h THR 298 CO 0.00 0.14 -0.02 0.74 -0.25 0.00 0.00 175.52 176.13 1n6b h THR 299 N 0.08 1.27 0.02 6.82 2.02 -1.64 -2.11 112.91 119.37 1n6b h THR 299 Ca 0.05 -0.96 0.03 0.00 0.77 0.00 0.00 66.41 66.30 1n6b h THR 299 Cb 0.16 1.48 -0.04 0.00 -1.74 0.00 0.00 68.15 68.01 1n6b h THR 299 CO -0.00 0.29 -0.24 -1.28 0.37 0.00 0.00 175.52 174.66 1n6b h SER 300 N 0.13 -0.70 -0.86 4.18 0.87 -1.00 -0.94 113.55 115.23 1n6b h SER 300 Ca 0.06 0.09 0.03 0.00 -1.23 0.00 0.00 61.79 60.74 1n6b h SER 300 Cb 0.45 0.28 -0.05 0.00 -0.44 0.00 0.00 62.40 62.65 1n6b h SER 300 CO 0.02 -0.31 0.57 0.74 -0.53 0.00 0.00 176.83 177.31 1n6b h THR 301 N -0.39 1.16 -0.60 2.23 2.02 -1.09 -0.21 112.91 116.04 1n6b h THR 301 Ca 0.06 -0.38 -0.10 0.00 0.77 0.00 0.00 66.41 66.76 1n6b h THR 301 Cb 0.46 -0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 1n6b h THR 301 CO -0.20 0.20 -0.03 0.74 0.37 0.00 0.00 175.52 176.60 1n6b h THR 302 N 1.10 1.27 -0.11 3.16 2.02 -0.95 0.46 112.91 119.84 1n6b h THR 302 Ca 0.34 -1.18 -0.01 0.00 0.77 0.00 0.00 66.41 66.32 1n6b h THR 302 Cb -0.01 0.83 -0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1n6b h THR 302 CO -0.09 0.43 0.02 -0.07 0.37 0.00 0.00 175.52 176.17 1n6b h LEU 303 N 0.97 0.18 -0.56 2.58 3.38 -0.29 0.99 115.31 122.56 1n6b h LEU 303 Ca 0.17 -0.27 0.08 0.00 0.09 0.00 0.00 57.88 57.95 1n6b h LEU 303 Cb 0.59 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.23 1n6b h LEU 303 CO 0.04 0.40 0.22 0.03 0.09 0.00 0.00 178.44 179.22 1n6b h ARG 304 N -0.05 0.41 0.00 1.13 3.08 -0.84 0.14 114.38 118.24 1n6b h ARG 304 Ca 0.03 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 59.99 1n6b h ARG 304 Cb 0.30 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1n6b h ARG 304 CO 0.00 0.27 -0.33 -0.92 -1.07 0.00 0.00 179.97 177.92 1n6b h TYR 305 N 0.42 0.00 0.30 3.04 -0.00 -0.75 -2.31 116.97 117.67 1n6b h TYR 305 Ca 0.27 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.99 1n6b h TYR 305 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.03 1n6b h TYR 305 CO -0.15 0.33 -0.14 0.77 -0.00 0.00 0.00 178.16 178.96 1n6b h SER 306 N 0.00 -0.34 -0.57 -2.11 0.02 0.18 -0.87 113.55 109.87 1n6b h SER 306 Ca -0.00 -0.14 0.05 0.00 -0.84 0.00 0.00 61.79 60.86 1n6b h SER 306 Cb 0.60 0.09 -0.05 0.00 0.14 0.00 0.00 62.40 63.18 1n6b h SER 306 CO 0.04 -0.04 0.30 -0.07 -1.14 0.00 0.00 176.83 175.92 1n6b h LEU 307 N -0.65 0.43 -0.53 5.07 3.38 -1.14 -0.86 115.31 121.02 1n6b h LEU 307 Ca -0.04 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1n6b h LEU 307 Cb 0.46 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1n6b h LEU 307 CO 0.07 0.29 0.29 0.25 0.09 0.00 0.00 178.44 179.43 1n6b h LEU 308 N 0.57 0.45 -1.31 1.67 5.85 -1.30 -0.20 115.31 121.04 1n6b h LEU 308 Ca 0.26 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.93 1n6b h LEU 308 Cb 0.16 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1n6b h LEU 308 CO -0.17 0.31 -0.32 -0.07 -0.34 0.00 0.00 178.44 177.85 1n6b h LEU 309 N 0.57 0.00 -0.66 2.25 3.38 -0.59 -0.84 115.31 119.42 1n6b h LEU 309 Ca 0.22 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.12 1n6b h LEU 309 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1n6b h LEU 309 CO -0.13 0.32 -0.34 -0.07 0.09 0.00 0.00 178.44 178.31 1n6b h LEU 310 N 0.00 0.00 0.14 1.67 3.38 0.11 -0.41 115.31 120.20 1n6b h LEU 310 Ca -0.00 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.66 1n6b h LEU 310 Cb 0.66 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.44 1n6b h LEU 310 CO 0.04 0.34 -1.30 -0.07 0.09 0.00 0.00 178.44 177.54 1n6b h LEU 311 N 0.00 0.86 -0.84 1.67 3.38 -0.54 -3.02 115.31 116.83 1n6b h LEU 311 Ca -0.00 -0.82 -0.12 0.00 0.09 0.00 0.00 57.88 57.03 1n6b h LEU 311 Cb 1.00 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1n6b h LEU 311 CO 0.04 1.63 -0.40 0.50 0.09 0.00 0.00 178.44 180.30 1n6b h LYS 312 N 0.25 0.38 -2.81 1.13 1.63 -1.04 -3.35 116.57 112.75 1n6b h LYS 312 Ca -0.20 -0.18 -0.61 0.00 -0.85 0.00 0.00 60.65 58.81 1n6b h LYS 312 Cb 1.97 -0.00 -0.40 0.00 -0.60 0.00 0.00 32.23 33.20 1n6b h LYS 312 CO 0.25 0.72 -0.73 -1.01 -3.45 0.00 0.00 179.45 175.22 1n6b s HIS 313 N -4.20 2.59 0.40 1.91 3.76 -0.18 -4.88 115.29 114.70 1n6b s HIS 313 Ca -0.06 -2.93 0.33 0.00 -0.15 0.00 0.00 55.06 52.25 1n6b s HIS 313 Cb 0.13 -2.01 1.67 0.00 1.11 0.00 0.00 32.58 33.48 1n6b s HIS 313 CO 0.79 -0.66 2.13 -1.35 -0.85 0.00 0.00 174.74 174.80 1n6b h PRO 314 N 5.53 0.00 -0.38 8.40 0.11 -1.67 -2.47 132.00 141.51 1n6b h PRO 314 Ca 0.19 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.21 1n6b h PRO 314 Cb 0.82 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.91 1n6b h PRO 314 CO 0.58 0.06 -0.13 1.05 -0.21 0.00 0.00 178.00 179.35 1n6b h GLU 315 N 0.00 0.68 -0.38 1.05 9.09 -1.94 -1.28 114.58 121.80 1n6b h GLU 315 Ca -0.00 -0.22 -0.03 0.00 0.05 0.00 0.00 59.36 59.16 1n6b h GLU 315 Cb 0.29 -0.06 -0.02 0.00 -1.65 0.00 0.00 28.75 27.32 1n6b h GLU 315 CO 0.01 0.79 0.12 0.28 0.05 0.00 0.00 179.01 180.26 1n6b h VAL 316 N 0.62 1.21 -0.50 -1.06 2.07 -1.79 -0.26 116.25 116.54 1n6b h VAL 316 Ca 0.11 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 1n6b h VAL 316 Cb 0.58 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1n6b h VAL 316 CO 0.04 0.24 0.31 0.00 0.02 0.00 0.00 177.57 178.17 1n6b h ALA 317 N 0.97 1.60 -0.07 1.67 0.00 -1.43 -1.66 119.26 120.34 1n6b h ALA 317 Ca 0.12 -0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.75 1n6b h ALA 317 Cb 0.25 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.84 1n6b h ALA 317 CO -0.00 0.35 -0.87 0.00 0.00 0.00 0.00 179.25 178.73 1n6b h ALA 318 N 1.66 0.32 0.00 0.00 0.00 -0.64 -2.35 119.26 118.24 1n6b h ALA 318 Ca 0.18 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1n6b h ALA 318 Cb -0.04 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1n6b h ALA 318 CO -0.04 0.72 -0.03 0.00 0.00 0.00 0.00 179.25 179.90 1n6b h ARG 319 N 0.41 0.00 0.09 0.00 3.08 -0.73 0.23 114.38 117.46 1n6b h ARG 319 Ca -0.08 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.78 1n6b h ARG 319 Cb 1.50 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.57 1n6b h ARG 319 CO 0.17 0.03 -0.83 0.28 -1.07 0.00 0.00 179.97 178.55 1n6b h VAL 320 N 0.00 1.44 -0.49 2.04 2.07 -1.25 -2.67 116.25 117.38 1n6b h VAL 320 Ca -0.00 -2.36 -0.02 0.00 0.82 0.00 0.00 66.70 65.14 1n6b h VAL 320 Cb 0.63 2.89 -0.02 0.00 -1.52 0.00 0.00 31.29 33.27 1n6b h VAL 320 CO 0.00 0.68 0.21 1.56 0.02 0.00 0.00 177.57 180.05 1n6b h GLN 321 N -0.15 0.69 0.48 1.57 4.20 -0.96 0.24 115.11 121.17 1n6b h GLN 321 Ca -0.13 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.47 1n6b h GLN 321 Cb 1.58 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.24 1n6b h GLN 321 CO 0.16 0.56 -0.23 1.49 -0.67 0.00 0.00 178.83 180.14 1n6b h GLU 322 N 0.69 -0.62 -0.49 1.46 4.22 -1.00 0.15 114.58 118.99 1n6b h GLU 322 Ca 0.17 0.04 0.01 0.00 0.08 0.00 0.00 59.36 59.66 1n6b h GLU 322 Cb 0.11 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1n6b h GLU 322 CO -0.02 -0.34 0.32 1.49 -2.18 0.00 0.00 179.01 178.29 1n6b h GLU 323 N -0.80 0.64 -0.26 1.92 4.81 -1.10 -1.44 114.58 118.35 1n6b h GLU 323 Ca -0.07 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.06 1n6b h GLU 323 Cb 0.56 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1n6b h GLU 323 CO 0.11 0.42 -0.08 0.82 -0.73 0.00 0.00 179.01 179.55 1n6b h ILE 324 N 0.66 1.29 -0.66 2.32 2.04 -0.19 -0.99 117.51 121.97 1n6b h ILE 324 Ca 0.18 -1.11 -0.02 0.00 1.00 0.00 0.00 64.86 64.91 1n6b h ILE 324 Cb -0.07 1.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 1n6b h ILE 324 CO -0.04 0.35 0.33 1.05 0.00 0.00 0.00 178.15 179.84 1n6b h GLU 325 N 0.25 0.94 -0.25 2.37 -0.00 -0.04 -0.22 114.58 117.63 1n6b h GLU 325 Ca 0.06 -0.13 -0.07 0.00 -0.00 0.00 0.00 59.36 59.23 1n6b h GLU 325 Cb 0.56 -0.17 -0.01 0.00 -0.00 0.00 0.00 28.75 29.13 1n6b h GLU 325 CO 0.03 0.73 -0.11 -0.09 -0.00 0.00 0.00 179.01 179.57 1n6b h ARG 326 N 0.91 0.51 0.00 1.06 2.43 -1.25 -1.35 114.38 116.69 1n6b h ARG 326 Ca 0.23 -0.22 -0.10 0.00 -0.81 0.00 0.00 59.98 59.08 1n6b h ARG 326 Cb 0.09 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1n6b h ARG 326 CO -0.03 0.77 -1.37 0.28 -1.51 0.00 0.00 179.97 178.11 1n6b n VAL 327 N -4.49 0.85 -0.01 0.20 0.31 -0.38 -4.62 118.33 110.19 1n6b n VAL 327 Ca -0.04 -0.63 -0.01 0.00 -0.01 0.00 0.00 64.34 63.65 1n6b n VAL 327 Cb 0.34 -0.49 -0.01 0.00 -0.91 0.00 0.00 33.84 32.77 1n6b n VAL 327 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1n6b n ILE 328 N -2.73 0.10 0.00 2.52 5.41 -0.17 -5.06 119.36 119.43 1n6b n ILE 328 Ca -0.07 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.64 1n6b n ILE 328 Cb 0.72 -0.71 0.00 0.00 -0.71 0.00 0.00 39.64 38.94 1n6b n ILE 328 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1n6b n GLY 329 N 3.23 -0.62 0.92 7.39 0.00 -0.51 -4.53 105.19 111.07 1n6b n GLY 329 Ca -0.03 -1.75 0.11 0.00 0.00 0.00 0.00 46.02 44.35 1n6b n GLY 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n6b n ARG 330 N -0.64 2.20 -0.08 1.61 1.74 -1.26 -4.64 116.66 115.58 1n6b n ARG 330 Ca 0.00 -1.82 -0.13 0.00 -0.77 0.00 0.00 57.85 55.13 1n6b n ARG 330 Cb 0.00 -1.46 -0.04 0.00 -1.02 0.00 0.00 32.46 29.94 1n6b n ARG 330 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1n6b n HIS 331 N 1.02 0.00 -2.56 -1.55 8.25 -1.26 -5.05 115.22 114.07 1n6b n HIS 331 Ca 0.18 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.34 1n6b n HIS 331 Cb 0.49 -0.54 -0.01 0.00 1.12 0.00 0.00 29.99 31.04 1n6b n HIS 331 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1n6b s ARG 332 N -2.65 3.69 0.28 -0.41 1.70 -1.26 -5.05 118.95 115.25 1n6b s ARG 332 Ca -0.27 0.49 -0.29 0.00 -0.47 0.00 0.00 55.73 55.19 1n6b s ARG 332 Cb 0.06 -2.30 -0.10 0.00 -0.57 0.00 0.00 34.95 32.04 1n6b s ARG 332 CO 0.37 -0.21 1.19 -1.12 -1.08 0.00 0.00 175.30 174.46 1n6b s SER 333 N -3.63 7.06 0.86 -2.89 0.01 -1.26 -4.92 113.70 108.92 1n6b s SER 333 Ca 0.51 2.42 -0.11 0.00 1.31 0.00 0.00 55.95 60.09 1n6b s SER 333 Cb -0.10 -2.63 0.11 0.00 0.21 0.00 0.00 66.02 63.60 1n6b s SER 333 CO 0.40 -0.32 1.11 -2.16 0.41 0.00 0.00 173.24 172.67 1n6b s PRO 334 N -1.35 1.52 0.11 12.44 0.04 -1.26 -5.05 135.00 141.45 1n6b s PRO 334 Ca 0.48 1.27 -0.12 0.00 0.04 0.00 0.00 61.00 62.67 1n6b s PRO 334 Cb -0.35 -1.81 0.01 0.00 0.04 0.00 0.00 34.50 32.40 1n6b s PRO 334 CO 0.44 -2.19 0.29 0.00 0.04 0.00 0.00 177.00 175.58 1n6b h MET 336 N 2.56 0.00 0.00 0.00 2.86 -1.97 -0.72 114.93 117.66 1n6b h MET 336 Ca -0.34 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.29 1n6b h MET 336 Cb 1.23 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.88 1n6b h MET 336 CO 0.51 0.00 -0.08 1.96 1.06 0.00 0.00 176.91 180.36 1n6b h GLN 337 N 0.00 0.00 -0.28 1.72 1.08 -2.02 -2.61 115.11 113.00 1n6b h GLN 337 Ca 0.19 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.33 1n6b h GLN 337 Cb 0.91 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.32 1n6b h GLN 337 CO -0.00 0.08 -0.10 -0.44 -0.95 0.00 0.00 178.83 177.42 1n6b h ASP 338 N 0.00 0.43 -0.98 1.46 3.32 -1.54 -3.20 116.42 115.91 1n6b h ASP 338 Ca -0.00 -0.10 0.14 0.00 0.02 0.00 0.00 57.03 57.09 1n6b h ASP 338 Cb 0.16 -0.12 -0.09 0.00 0.22 0.00 0.00 39.33 39.51 1n6b h ASP 338 CO 0.01 0.58 0.62 -0.09 -1.72 0.00 0.00 179.24 178.63 1n6b h ARG 339 N 0.43 0.86 -0.14 3.56 2.43 -1.61 0.25 114.38 120.16 1n6b h ARG 339 Ca 0.08 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.12 1n6b h ARG 339 Cb 0.44 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1n6b h ARG 339 CO 0.02 0.57 -0.29 0.66 -1.51 0.00 0.00 179.97 179.42 1n6b h SER 340 N 0.89 0.26 -0.39 -3.80 4.64 -1.73 -2.54 113.55 110.89 1n6b h SER 340 Ca 0.50 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1n6b h SER 340 Cb 0.61 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1n6b h SER 340 CO -0.27 0.56 0.00 0.54 -0.87 0.00 0.00 176.83 176.79 1n6b n ARG 341 N -4.12 2.43 -3.16 4.77 3.00 0.00 -4.42 116.66 115.16 1n6b n ARG 341 Ca -0.01 -1.62 -0.22 0.00 -0.01 0.00 0.00 57.85 55.99 1n6b n ARG 341 Cb 0.40 -1.55 -0.05 0.00 0.00 0.00 0.00 32.46 31.26 1n6b n ARG 341 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 1n6b n MET 342 N 0.60 1.47 -0.23 5.56 2.81 -0.75 -4.95 117.12 121.63 1n6b n MET 342 Ca 0.15 -3.74 0.21 0.00 -1.81 0.00 0.00 57.70 52.51 1n6b n MET 342 Cb 0.51 -1.74 0.54 0.00 -0.71 0.00 0.00 33.22 31.83 1n6b n MET 342 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1n6b h PRO 343 N 3.34 0.34 -0.05 0.03 0.13 -1.77 -1.97 132.00 132.05 1n6b h PRO 343 Ca 0.11 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 65.15 1n6b h PRO 343 Cb 0.83 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1n6b h PRO 343 CO 0.58 0.22 -0.21 -0.92 -0.23 0.00 0.00 178.00 177.44 1n6b h TYR 344 N 0.35 0.30 -0.67 1.56 3.20 -1.93 -1.90 116.97 117.89 1n6b h TYR 344 Ca 0.47 -0.13 -0.02 0.00 3.14 0.00 0.00 58.73 62.19 1n6b h TYR 344 Cb 1.25 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.44 1n6b h TYR 344 CO -0.00 0.85 0.35 1.15 -1.64 0.00 0.00 178.16 178.87 1n6b h THR 345 N -0.32 1.20 -0.49 1.81 2.02 -1.81 -1.27 112.91 114.05 1n6b h THR 345 Ca -0.01 -0.52 -0.12 0.00 0.77 0.00 0.00 66.41 66.52 1n6b h THR 345 Cb 0.87 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1n6b h THR 345 CO 0.04 0.23 -0.18 -0.78 0.37 0.00 0.00 175.52 175.21 1n6b h ASP 346 N 0.93 1.00 0.59 4.18 3.58 -1.41 -1.02 116.42 124.27 1n6b h ASP 346 Ca 0.23 -0.38 -0.05 0.00 0.42 0.00 0.00 57.03 57.26 1n6b h ASP 346 Cb 0.04 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.81 1n6b h ASP 346 CO -0.04 1.16 -0.22 0.00 -2.88 0.00 0.00 179.24 177.27 1n6b h ALA 347 N 0.88 1.18 -0.10 -0.78 0.00 -0.70 -1.23 119.26 118.51 1n6b h ALA 347 Ca 0.12 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 1n6b h ALA 347 Cb 0.75 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.51 1n6b h ALA 347 CO 0.06 0.27 -0.47 0.28 0.00 0.00 0.00 179.25 179.39 1n6b h VAL 348 N 0.00 1.38 -0.42 0.00 2.07 -0.56 -0.98 116.25 117.73 1n6b h VAL 348 Ca -0.00 -1.81 -0.11 0.00 0.82 0.00 0.00 66.70 65.60 1n6b h VAL 348 Cb 0.57 2.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 1n6b h VAL 348 CO 0.03 0.54 -0.17 0.40 0.02 0.00 0.00 177.57 178.39 1n6b h ILE 349 N 0.08 1.27 -0.32 4.57 2.04 -0.82 -0.82 117.51 123.50 1n6b h ILE 349 Ca -0.03 -1.27 -0.06 0.00 1.00 0.00 0.00 64.86 64.49 1n6b h ILE 349 Cb 1.12 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 1n6b h ILE 349 CO 0.10 0.43 -0.05 0.45 0.00 0.00 0.00 178.15 179.08 1n6b h HIS 350 N 0.71 0.67 0.00 1.37 3.86 -1.27 -2.40 115.15 118.09 1n6b h HIS 350 Ca 0.11 -0.14 -0.05 0.00 -1.16 0.00 0.00 60.37 59.13 1n6b h HIS 350 Cb 0.68 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 1n6b h HIS 350 CO 0.04 0.76 -0.24 1.49 0.86 0.00 0.00 177.93 180.84 1n6b h GLU 351 N 0.39 0.00 0.14 2.45 4.57 -0.88 -0.32 114.58 120.93 1n6b h GLU 351 Ca 0.08 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.26 1n6b h GLU 351 Cb 0.53 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.12 1n6b h GLU 351 CO 0.03 0.24 -0.07 0.82 -1.18 0.00 0.00 179.01 178.85 1n6b h ILE 352 N 0.00 0.93 -0.81 2.32 2.04 -0.98 -0.66 117.51 120.35 1n6b h ILE 352 Ca -0.00 -1.17 0.10 0.00 1.00 0.00 0.00 64.86 64.79 1n6b h ILE 352 Cb 0.52 1.56 -0.06 0.00 -0.74 0.00 0.00 36.82 38.11 1n6b h ILE 352 CO 0.03 0.24 0.53 1.56 0.00 0.00 0.00 178.15 180.51 1n6b h GLN 353 N -0.83 0.73 -0.01 2.37 4.20 -1.23 -0.30 115.11 120.05 1n6b h GLN 353 Ca -0.02 -0.04 -0.26 0.00 0.06 0.00 0.00 58.65 58.39 1n6b h GLN 353 Cb 0.54 -0.16 0.02 0.00 0.30 0.00 0.00 27.48 28.17 1n6b h GLN 353 CO 0.03 0.48 -1.01 -0.09 -0.67 0.00 0.00 178.83 177.58 1n6b h ARG 354 N 0.75 0.65 -0.18 1.46 2.43 -1.10 -3.16 114.38 115.23 1n6b h ARG 354 Ca 0.38 -0.69 -0.12 0.00 -0.81 0.00 0.00 59.98 58.74 1n6b h ARG 354 Cb 0.45 0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1n6b h ARG 354 CO -0.15 1.28 -0.35 0.35 -1.51 0.00 0.00 179.97 179.60 1n6b h PHE 355 N 0.37 0.70 0.00 2.20 3.04 0.15 -3.28 116.94 120.12 1n6b h PHE 355 Ca -0.11 -0.25 -0.07 0.00 3.98 0.00 0.00 57.97 61.52 1n6b h PHE 355 Cb 1.65 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 40.02 1n6b h PHE 355 CO 0.09 0.98 -0.33 -0.84 -2.02 0.00 0.00 178.31 176.20 1n6b h ILE 356 N 0.21 0.77 -6.18 1.41 3.07 -1.24 -3.48 117.51 112.07 1n6b h ILE 356 Ca 0.01 -1.42 -0.43 0.00 1.55 0.00 0.00 64.86 64.57 1n6b h ILE 356 Cb 0.94 1.90 0.06 0.00 -0.27 0.00 0.00 36.82 39.45 1n6b h ILE 356 CO 0.08 0.32 -0.90 -0.67 -1.05 0.00 0.00 178.15 175.93 1n6b n ASP 357 N -3.47 -3.52 -0.34 2.16 2.03 -1.19 -4.82 116.55 107.41 1n6b n ASP 357 Ca 0.00 -0.95 0.16 0.00 0.52 0.00 0.00 54.79 54.52 1n6b n ASP 357 Cb 0.49 -3.62 0.32 0.00 -0.72 0.00 0.00 41.12 37.59 1n6b n ASP 357 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1n6b h LEU 358 N -1.81 -0.39 -6.93 -2.67 5.85 -1.89 -2.96 115.31 104.52 1n6b h LEU 358 Ca -0.64 0.27 -0.61 0.00 0.84 0.00 0.00 57.88 57.74 1n6b h LEU 358 Cb 1.36 0.46 -0.41 0.00 0.37 0.00 0.00 40.66 42.44 1n6b h LEU 358 CO 0.52 -0.35 -0.69 -0.76 -0.34 0.00 0.00 178.44 176.82 1n6b s LEU 359 N -10.93 3.77 0.34 2.25 1.02 -1.26 -0.73 118.68 113.14 1n6b s LEU 359 Ca -0.13 -3.49 0.13 0.00 0.02 0.00 0.00 54.13 50.67 1n6b s LEU 359 Cb 0.29 -1.29 1.05 0.00 0.02 0.00 0.00 46.19 46.26 1n6b s LEU 359 CO 0.78 -0.13 1.67 -0.65 0.02 0.00 0.00 176.35 178.03 1n6b h PRO 360 N 5.66 0.32 -0.30 1.29 0.11 -1.69 -0.50 132.00 136.89 1n6b h PRO 360 Ca 0.14 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 66.14 1n6b h PRO 360 Cb 0.82 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 31.80 1n6b h PRO 360 CO 0.61 0.21 -0.03 0.25 -0.21 0.00 0.00 178.00 178.83 1n6b n THR 361 N -5.06 2.41 -4.41 -1.15 -2.24 -1.26 -0.21 114.28 102.36 1n6b n THR 361 Ca 0.31 -2.34 0.00 0.00 -2.27 0.00 0.00 64.05 59.74 1n6b n THR 361 Cb 0.95 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 1n6b n THR 361 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1n6b n ASN 362 N -0.89 -0.92 -4.59 3.42 4.05 -0.20 -4.27 115.26 111.85 1n6b n ASN 362 Ca 0.27 0.00 -0.31 0.00 0.45 0.00 0.00 54.58 55.00 1n6b n ASN 362 Cb 0.96 0.00 -0.10 0.00 1.23 0.00 0.00 39.78 41.87 1n6b n ASN 362 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1n6b s LEU 363 N 0.00 3.12 0.22 1.20 1.43 -1.26 -4.94 118.68 118.45 1n6b s LEU 363 Ca 0.00 -0.26 -0.31 0.00 -1.03 0.00 0.00 54.13 52.53 1n6b s LEU 363 Cb 0.00 -1.86 -0.11 0.00 0.03 0.00 0.00 46.19 44.26 1n6b s LEU 363 CO 0.00 0.23 1.60 -2.16 0.23 0.00 0.00 176.35 176.24 1n6b s PRO 364 N -1.84 4.17 0.24 1.29 0.04 -1.26 -4.84 135.00 132.81 1n6b s PRO 364 Ca 0.20 2.48 0.04 0.00 0.04 0.00 0.00 61.00 63.75 1n6b s PRO 364 Cb -0.11 -3.09 0.04 0.00 0.04 0.00 0.00 34.50 31.37 1n6b s PRO 364 CO 0.11 -0.62 0.30 0.72 0.04 0.00 0.00 177.00 177.55 1n6b n HIS 365 N 3.26 -2.42 -3.59 0.56 8.25 -0.58 -3.21 115.22 117.49 1n6b n HIS 365 Ca 0.12 -0.89 -0.11 0.00 -0.26 0.00 0.00 57.72 56.58 1n6b n HIS 365 Cb 0.38 -0.22 -0.06 0.00 1.12 0.00 0.00 29.99 31.21 1n6b n HIS 365 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1n6b s ALA 366 N -2.29 -1.93 0.39 -1.41 0.00 0.15 -1.53 121.76 115.14 1n6b s ALA 366 Ca 0.23 1.65 -0.24 0.00 0.00 0.00 0.00 51.96 53.60 1n6b s ALA 366 Cb -0.02 -0.85 -0.09 0.00 0.00 0.00 0.00 23.12 22.15 1n6b s ALA 366 CO 0.15 -0.29 1.02 0.14 0.00 0.00 0.00 175.76 176.77 1n6b s VAL 367 N -0.76 3.89 -2.14 0.00 -7.23 -0.92 -2.10 120.40 111.15 1n6b s VAL 367 Ca -0.01 1.42 0.23 0.00 -1.81 0.00 0.00 61.98 61.81 1n6b s VAL 367 Cb -0.02 -3.72 0.06 0.00 0.56 0.00 0.00 36.38 33.27 1n6b s VAL 367 CO 0.00 -0.02 1.18 0.35 -0.31 0.00 0.00 175.10 176.30 1n6b n THR 368 N -0.07 0.00 -3.63 5.32 -2.24 -0.68 -1.23 114.28 111.75 1n6b n THR 368 Ca 0.05 -0.27 -0.06 0.00 -2.27 0.00 0.00 64.05 61.49 1n6b n THR 368 Cb 0.50 1.17 -0.02 0.00 -2.10 0.00 0.00 70.33 69.88 1n6b n THR 368 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1n6b s ARG 369 N -2.41 1.02 0.16 -0.78 6.06 -1.26 -4.89 118.95 116.85 1n6b s ARG 369 Ca 0.21 -0.49 -0.31 0.00 -2.50 0.00 0.00 55.73 52.64 1n6b s ARG 369 Cb 0.19 0.40 -0.09 0.00 0.06 0.00 0.00 34.95 35.50 1n6b s ARG 369 CO 0.53 -0.46 1.49 -0.51 -2.50 0.00 0.00 175.30 173.85 1n6b s ASP 370 N -2.72 6.67 0.02 -2.12 1.01 -1.26 -3.71 116.67 114.56 1n6b s ASP 370 Ca 0.08 2.54 0.03 0.00 0.71 0.00 0.00 52.55 55.91 1n6b s ASP 370 Cb -0.01 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.31 1n6b s ASP 370 CO -0.04 -0.75 -0.10 0.68 0.21 0.00 0.00 175.17 175.17 1n6b s VAL 371 N 0.94 0.75 -0.79 -1.27 -7.23 0.14 -4.92 120.40 108.04 1n6b s VAL 371 Ca 0.67 -0.72 -0.13 0.00 -1.81 0.00 0.00 61.98 59.99 1n6b s VAL 371 Cb -0.41 -0.69 0.21 0.00 0.56 0.00 0.00 36.38 36.04 1n6b s VAL 371 CO 0.33 -0.01 0.72 0.00 -0.31 0.00 0.00 175.10 175.83 1n6b s ARG 372 N -0.81 3.48 -0.84 4.82 1.04 -1.26 -0.39 118.95 124.98 1n6b s ARG 372 Ca -0.00 -2.41 -0.23 0.00 -1.04 0.00 0.00 55.73 52.04 1n6b s ARG 372 Cb -0.06 -4.37 0.06 0.00 -2.04 0.00 0.00 34.95 28.55 1n6b s ARG 372 CO 0.00 -1.28 1.24 0.12 -0.04 0.00 0.00 175.30 175.34 1n6b s PHE 373 N 0.26 2.59 0.00 5.89 5.36 -1.00 -4.84 117.98 126.24 1n6b s PHE 373 Ca 0.17 -0.64 0.00 0.00 -0.96 0.00 0.00 56.93 55.49 1n6b s PHE 373 Cb -0.12 -4.52 0.00 0.00 -0.34 0.00 0.00 43.02 38.04 1n6b s PHE 373 CO -0.08 -1.84 0.00 0.54 -1.46 0.00 0.00 175.22 172.38 1n6b n ARG 374 N 8.37 0.00 -1.49 10.12 1.74 -1.26 -2.21 116.66 131.93 1n6b n ARG 374 Ca 0.15 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.98 1n6b n ARG 374 Cb 0.49 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 32.01 1n6b n ARG 374 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1n6b n ASN 375 N 9.85 5.38 -4.24 0.55 5.03 -1.26 -4.96 115.26 125.61 1n6b n ASN 375 Ca 0.00 -3.77 -0.13 0.00 0.87 0.00 0.00 54.58 51.55 1n6b n ASN 375 Cb 0.00 -0.66 -0.10 0.00 -1.02 0.00 0.00 39.78 38.00 1n6b n ASN 375 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1n6b s TYR 376 N -3.60 1.19 -0.17 3.10 1.51 -0.94 -4.88 117.35 113.56 1n6b s TYR 376 Ca 0.55 -0.81 0.01 0.00 -1.01 0.00 0.00 57.07 55.81 1n6b s TYR 376 Cb 0.45 -0.63 0.02 0.00 -0.11 0.00 0.00 41.96 41.69 1n6b s TYR 376 CO 0.02 0.02 -0.19 0.12 -1.11 0.00 0.00 175.55 174.40 1n6b s PHE 377 N -3.40 2.77 -0.26 2.71 2.19 0.68 -2.37 117.98 120.30 1n6b s PHE 377 Ca 0.16 -1.53 0.00 0.00 0.33 0.00 0.00 56.93 55.90 1n6b s PHE 377 Cb 0.03 -1.91 0.04 0.00 -1.31 0.00 0.00 43.02 39.88 1n6b s PHE 377 CO -0.00 -0.74 -0.07 0.42 1.83 0.00 0.00 175.22 176.65 1n6b s ILE 378 N 1.19 2.59 0.14 3.12 1.01 0.47 -3.92 121.20 125.81 1n6b s ILE 378 Ca 0.02 -1.34 -0.30 0.00 0.00 0.00 0.00 60.65 59.03 1n6b s ILE 378 Cb -0.14 -2.43 -0.07 0.00 0.01 0.00 0.00 42.46 39.84 1n6b s ILE 378 CO -0.10 0.05 0.95 -2.16 0.00 0.00 0.00 174.94 173.68 1n6b s PRO 379 N 1.22 4.73 -0.25 2.79 0.04 -1.26 0.28 135.00 142.55 1n6b s PRO 379 Ca -0.04 1.44 -0.34 0.00 0.04 0.00 0.00 61.00 62.10 1n6b s PRO 379 Cb -0.18 -3.35 -0.15 0.00 0.04 0.00 0.00 34.50 30.85 1n6b s PRO 379 CO -0.04 0.30 1.08 1.17 0.04 0.00 0.00 177.00 179.55 1n6b n LYS 380 N 2.43 0.00 -0.00 4.56 4.81 -1.24 -1.91 118.16 126.80 1n6b n LYS 380 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 1n6b n LYS 380 Cb 0.49 -1.14 0.00 0.00 0.02 0.00 0.00 35.03 34.40 1n6b n LYS 380 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1n6b n GLY 381 N 2.38 0.20 3.75 3.14 0.00 -0.37 -4.95 105.19 109.35 1n6b n GLY 381 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 1n6b n GLY 381 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n6b s THR 382 N -2.06 2.71 0.33 2.61 2.01 -0.80 -4.65 115.64 115.78 1n6b s THR 382 Ca 0.00 0.64 -0.29 0.00 0.31 0.00 0.00 61.69 62.35 1n6b s THR 382 Cb 0.00 -3.41 -0.10 0.00 0.01 0.00 0.00 72.50 69.00 1n6b s THR 382 CO 0.00 0.12 1.25 -1.81 -0.69 0.00 0.00 174.62 173.49 1n6b s ASP 383 N 0.06 6.86 -0.01 3.53 1.01 -1.25 -2.17 116.67 124.69 1n6b s ASP 383 Ca 0.55 2.57 0.05 0.00 0.71 0.00 0.00 52.55 56.43 1n6b s ASP 383 Cb -0.41 -2.64 -0.01 0.00 1.01 0.00 0.00 42.92 40.87 1n6b s ASP 383 CO 0.47 -0.46 -0.17 -0.63 0.21 0.00 0.00 175.17 174.58 1n6b s ILE 384 N -1.17 1.35 -0.08 0.77 -1.09 -0.58 -1.50 121.20 118.90 1n6b s ILE 384 Ca 0.49 -0.78 -0.01 0.00 -2.23 0.00 0.00 60.65 58.12 1n6b s ILE 384 Cb -0.37 -1.14 0.03 0.00 -1.58 0.00 0.00 42.46 39.40 1n6b s ILE 384 CO 0.49 0.34 -0.03 -0.63 -1.23 0.00 0.00 174.94 173.88 1n6b s ILE 385 N -0.46 0.65 -0.20 2.92 1.01 -0.55 -1.53 121.20 123.04 1n6b s ILE 385 Ca 0.06 -0.06 -0.10 0.00 0.00 0.00 0.00 60.65 60.55 1n6b s ILE 385 Cb -0.07 -0.74 -0.05 0.00 0.01 0.00 0.00 42.46 41.61 1n6b s ILE 385 CO -0.00 0.30 0.14 0.42 0.00 0.00 0.00 174.94 175.79 1n6b s THR 386 N 1.77 5.41 -0.61 2.92 -4.23 -1.26 0.20 115.64 119.83 1n6b s THR 386 Ca 0.03 0.20 -0.25 0.00 -1.18 0.00 0.00 61.69 60.50 1n6b s THR 386 Cb -0.13 -3.48 0.05 0.00 1.34 0.00 0.00 72.50 70.28 1n6b s THR 386 CO -0.06 0.44 1.03 -0.55 -0.54 0.00 0.00 174.62 174.94 1n6b s SER 387 N 0.37 6.28 0.31 3.99 0.15 -0.14 -3.75 113.70 120.92 1n6b s SER 387 Ca 0.08 -0.48 0.14 0.00 0.70 0.00 0.00 55.95 56.39 1n6b s SER 387 Cb -0.11 -2.47 0.47 0.00 -1.71 0.00 0.00 66.02 62.20 1n6b s SER 387 CO -0.02 -1.41 1.65 -0.07 1.20 0.00 0.00 173.24 174.59 1n6b h LEU 388 N 11.51 0.00 -1.49 3.45 3.38 -0.84 -3.05 115.31 128.27 1n6b h LEU 388 Ca -0.27 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.75 1n6b h LEU 388 Cb 1.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 1n6b h LEU 388 CO 1.15 0.53 0.40 0.74 0.09 0.00 0.00 178.44 181.35 1n6b h THR 389 N 0.00 1.04 -0.04 0.22 2.02 -1.78 0.15 112.91 114.52 1n6b h THR 389 Ca -0.01 -0.22 -0.08 0.00 0.77 0.00 0.00 66.41 66.87 1n6b h THR 389 Cb 1.03 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1n6b h THR 389 CO 0.07 0.12 -0.37 0.77 0.37 0.00 0.00 175.52 176.48 1n6b h SER 390 N 0.65 0.07 0.00 4.18 4.64 -1.84 -1.33 113.55 119.93 1n6b h SER 390 Ca 0.25 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1n6b h SER 390 Cb 0.18 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1n6b h SER 390 CO -0.07 0.44 -0.28 0.58 -0.87 0.00 0.00 176.83 176.63 1n6b h VAL 391 N 0.06 0.01 -0.80 0.95 2.07 -1.18 -3.12 116.25 114.23 1n6b h VAL 391 Ca 0.01 -1.01 0.19 0.00 0.82 0.00 0.00 66.70 66.71 1n6b h VAL 391 Cb 0.69 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 1n6b h VAL 391 CO 0.05 0.00 0.55 -0.07 0.02 0.00 0.00 177.57 178.12 1n6b h LEU 392 N -1.00 0.27 -3.37 2.57 3.38 -0.87 0.82 115.31 117.11 1n6b h LEU 392 Ca -0.00 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1n6b h LEU 392 Cb 0.28 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1n6b h LEU 392 CO -0.00 0.12 0.03 1.41 0.09 0.00 0.00 178.44 180.09 1n6b n HIS 393 N -4.44 1.29 -1.64 1.13 8.25 -0.50 -4.88 115.22 114.43 1n6b n HIS 393 Ca 0.16 -0.98 -0.53 0.00 -0.26 0.00 0.00 57.72 56.11 1n6b n HIS 393 Cb 0.68 -0.41 -0.06 0.00 1.12 0.00 0.00 29.99 31.32 1n6b n HIS 393 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1n6b n ASP 394 N -0.40 2.19 0.26 0.41 2.03 0.28 -4.70 116.55 116.62 1n6b n ASP 394 Ca 0.26 1.09 0.09 0.00 0.52 0.00 0.00 54.79 56.75 1n6b n ASP 394 Cb 1.01 -1.22 0.67 0.00 -0.72 0.00 0.00 41.12 40.87 1n6b n ASP 394 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1n6b h GLU 395 N 5.93 0.00 0.09 -0.67 4.81 -1.87 -2.33 114.58 120.54 1n6b h GLU 395 Ca -0.47 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.39 1n6b h GLU 395 Cb 1.32 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.67 1n6b h GLU 395 CO 0.86 0.05 -2.09 1.63 -0.73 0.00 0.00 179.01 178.72 1n6b n LYS 396 N -4.29 0.73 0.26 1.92 5.02 -1.26 -3.38 118.16 117.15 1n6b n LYS 396 Ca -0.03 0.24 0.15 0.00 -2.02 0.00 0.00 58.31 56.65 1n6b n LYS 396 Cb 0.13 -1.67 0.57 0.00 -0.02 0.00 0.00 35.03 34.05 1n6b n LYS 396 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n6b h ALA 397 N 0.03 1.01 -1.95 7.82 0.00 -1.94 -3.36 119.26 120.86 1n6b h ALA 397 Ca -0.46 -0.06 -0.49 0.00 0.00 0.00 0.00 54.91 53.90 1n6b h ALA 397 Cb 1.98 -0.01 -0.33 0.00 0.00 0.00 0.00 17.79 19.43 1n6b h ALA 397 CO 0.04 0.08 -0.89 1.19 0.00 0.00 0.00 179.25 179.67 1n6b n PHE 398 N -3.18 -1.48 -1.59 0.00 3.01 -0.88 -5.05 117.46 108.29 1n6b n PHE 398 Ca 0.01 -2.93 -0.54 0.00 1.01 0.00 0.00 57.45 55.00 1n6b n PHE 398 Cb 0.36 0.45 -0.06 0.00 -0.01 0.00 0.00 39.48 40.21 1n6b n PHE 398 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 1n6b n PRO 399 N 2.58 0.97 -2.86 -1.08 -0.02 -1.22 -1.42 135.00 131.95 1n6b n PRO 399 Ca 0.25 0.35 -0.12 0.00 -2.02 0.00 0.00 63.50 61.97 1n6b n PRO 399 Cb 0.51 -1.97 0.05 0.00 -0.02 0.00 0.00 33.50 32.07 1n6b n PRO 399 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1n6b n ASN 400 N 2.66 -5.45 0.08 2.55 3.02 -1.26 -4.92 115.26 111.95 1n6b n ASN 400 Ca 0.20 -0.54 0.08 0.00 -0.03 0.00 0.00 54.58 54.28 1n6b n ASN 400 Cb 0.17 -4.13 0.38 0.00 -0.61 0.00 0.00 39.78 35.59 1n6b n ASN 400 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1n6b n PRO 401 N -2.85 0.10 0.00 3.52 -0.04 -0.50 -2.17 135.00 133.05 1n6b n PRO 401 Ca -0.06 0.46 0.12 0.00 -0.04 0.00 0.00 63.50 63.97 1n6b n PRO 401 Cb 0.59 -1.74 0.11 0.00 -0.04 0.00 0.00 33.50 32.43 1n6b n PRO 401 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1n6b n LYS 402 N -1.93 1.78 -3.86 0.54 4.76 -1.26 -4.85 118.16 113.34 1n6b n LYS 402 Ca 0.01 -1.43 -0.36 0.00 -2.87 0.00 0.00 58.31 53.66 1n6b n LYS 402 Cb 0.12 -1.47 -0.11 0.00 -1.84 0.00 0.00 35.03 31.73 1n6b n LYS 402 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1n6b s VAL 403 N -2.20 4.79 -0.21 -0.18 1.01 -0.92 -5.06 120.40 117.62 1n6b s VAL 403 Ca 0.25 -0.02 -0.29 0.00 0.00 0.00 0.00 61.98 61.92 1n6b s VAL 403 Cb 0.19 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 1n6b s VAL 403 CO 0.41 0.39 1.30 0.12 0.00 0.00 0.00 175.10 177.32 1n6b s PHE 404 N 0.92 2.75 -0.24 5.22 5.36 -1.26 -4.98 117.98 125.74 1n6b s PHE 404 Ca 0.05 0.93 -0.04 0.00 -0.96 0.00 0.00 56.93 56.91 1n6b s PHE 404 Cb -0.14 -3.66 0.13 0.00 -0.34 0.00 0.00 43.02 39.02 1n6b s PHE 404 CO 0.03 -1.79 0.43 0.34 -1.46 0.00 0.00 175.22 172.77 1n6b s ASP 405 N 2.35 -0.18 0.66 6.13 3.68 -1.26 -5.02 116.67 123.03 1n6b s ASP 405 Ca 0.56 0.57 0.41 0.00 2.13 0.00 0.00 52.55 56.22 1n6b s ASP 405 Cb -0.20 1.38 2.23 0.00 -1.45 0.00 0.00 42.92 44.88 1n6b s ASP 405 CO 0.18 -0.27 2.28 -0.65 0.13 0.00 0.00 175.17 176.84 1n6b h PRO 406 N 8.15 0.00 0.00 4.34 0.11 -1.94 -2.38 132.00 140.27 1n6b h PRO 406 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1n6b h PRO 406 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1n6b h PRO 406 CO 0.23 0.00 0.10 0.78 -0.21 0.00 0.00 178.00 178.90 1n6b h GLY 407 N 0.00 0.00 2.00 -0.55 0.00 -1.91 -1.98 103.07 100.64 1n6b h GLY 407 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1n6b h GLY 407 CO -0.00 0.00 -0.00 0.45 0.00 0.00 0.00 176.54 176.99 1n6b h HIS 408 N 0.00 0.00 -0.47 5.60 3.86 -1.79 -2.49 115.15 119.86 1n6b h HIS 408 Ca 0.00 0.00 -0.31 0.00 -1.16 0.00 0.00 60.37 58.90 1n6b h HIS 408 Cb 0.21 0.00 -0.21 0.00 1.06 0.00 0.00 27.41 28.47 1n6b h HIS 408 CO 0.00 0.00 -0.35 1.19 0.86 0.00 0.00 177.93 179.63 1n6b n PHE 409 N -4.34 1.60 -3.79 2.45 3.72 -0.74 -4.94 117.46 111.42 1n6b n PHE 409 Ca -0.03 -1.93 -0.14 0.00 -0.05 0.00 0.00 57.45 55.30 1n6b n PHE 409 Cb 0.09 -0.47 -0.15 0.00 -0.94 0.00 0.00 39.48 38.01 1n6b n PHE 409 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1n6b s LEU 410 N -3.42 1.25 0.00 4.37 1.02 -0.94 -1.46 118.68 119.49 1n6b s LEU 410 Ca 0.47 0.07 -0.02 0.00 0.02 0.00 0.00 54.13 54.67 1n6b s LEU 410 Cb 0.41 0.02 0.04 0.00 0.02 0.00 0.00 46.19 46.67 1n6b s LEU 410 CO -0.01 -0.10 0.23 -0.90 0.02 0.00 0.00 176.35 175.59 1n6b n ASP 411 N 3.90 0.08 0.03 2.29 5.68 -0.27 -4.87 116.55 123.39 1n6b n ASP 411 Ca -0.24 -1.12 0.09 0.00 -0.50 0.00 0.00 54.79 53.02 1n6b n ASP 411 Cb 0.53 -0.17 0.39 0.00 -1.14 0.00 0.00 41.12 40.73 1n6b n ASP 411 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1n6b n GLU 412 N -1.46 0.04 -0.26 0.11 0.28 -1.26 -2.32 120.64 115.77 1n6b n GLU 412 Ca 0.03 0.24 0.10 0.00 -0.16 0.00 0.00 57.16 57.37 1n6b n GLU 412 Cb 0.11 -1.58 0.24 0.00 1.43 0.00 0.00 31.44 31.64 1n6b n GLU 412 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1n6b n SER 413 N -1.66 3.48 -0.28 -1.84 7.64 -1.26 -4.94 113.62 114.77 1n6b n SER 413 Ca 0.04 -1.97 -0.04 0.00 1.01 0.00 0.00 58.87 57.91 1n6b n SER 413 Cb 0.21 -0.35 -0.02 0.00 -1.01 0.00 0.00 64.21 63.05 1n6b n SER 413 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n6b n GLY 414 N 1.26 0.66 3.92 0.23 0.00 -0.98 -5.03 105.19 105.24 1n6b n GLY 414 Ca 0.19 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 45.05 1n6b n GLY 414 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1n6b s ASN 415 N -2.93 6.42 0.32 1.61 0.01 -1.26 -4.67 114.94 114.43 1n6b s ASN 415 Ca 0.00 0.45 -0.29 0.00 -0.71 0.00 0.00 52.86 52.31 1n6b s ASN 415 Cb 0.00 -2.03 -0.11 0.00 0.41 0.00 0.00 41.25 39.52 1n6b s ASN 415 CO 0.00 -0.00 1.52 0.12 -1.51 0.00 0.00 177.10 177.22 1n6b s PHE 416 N -1.79 2.75 -0.18 2.20 2.19 -1.26 -1.11 117.98 120.78 1n6b s PHE 416 Ca 0.39 0.99 -0.00 0.00 0.33 0.00 0.00 56.93 58.64 1n6b s PHE 416 Cb -0.11 -4.00 0.04 0.00 -1.31 0.00 0.00 43.02 37.64 1n6b s PHE 416 CO 0.28 -3.16 -0.07 0.21 1.83 0.00 0.00 175.22 174.31 1n6b s LYS 417 N -1.13 1.62 0.73 10.12 2.20 -0.54 -4.76 119.74 127.98 1n6b s LYS 417 Ca 0.58 -0.61 -0.13 0.00 -0.36 0.00 0.00 55.97 55.45 1n6b s LYS 417 Cb -0.46 -2.13 0.04 0.00 -1.51 0.00 0.00 37.83 33.77 1n6b s LYS 417 CO 0.53 -0.43 1.12 0.15 -0.36 0.00 0.00 175.35 176.36 1n6b s LYS 418 N 1.56 2.36 -0.03 4.03 1.02 -1.26 -4.53 119.74 122.89 1n6b s LYS 418 Ca 0.00 1.38 -0.02 0.00 0.02 0.00 0.00 55.97 57.36 1n6b s LYS 418 Cb -0.16 -1.90 0.02 0.00 -0.52 0.00 0.00 37.83 35.28 1n6b s LYS 418 CO -0.08 -1.59 0.08 0.45 -0.92 0.00 0.00 175.35 173.29 1n6b s SER 419 N -2.79 -0.03 0.51 2.83 0.15 -1.26 -5.00 113.70 108.10 1n6b s SER 419 Ca 0.66 0.15 0.21 0.00 0.70 0.00 0.00 55.95 57.66 1n6b s SER 419 Cb -0.21 0.07 1.32 0.00 -1.71 0.00 0.00 66.02 65.49 1n6b s SER 419 CO 0.48 -0.10 2.09 0.44 1.20 0.00 0.00 173.24 177.36 1n6b h ASP 420 N 6.85 0.00 0.37 5.45 3.45 -1.99 -2.61 116.42 127.94 1n6b h ASP 420 Ca -0.38 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.08 1n6b h ASP 420 Cb 1.16 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.93 1n6b h ASP 420 CO 0.46 0.10 0.00 -1.22 -1.57 0.00 0.00 179.24 177.01 1n6b n TYR 421 N -4.10 0.00 -2.57 4.55 4.02 -1.26 -4.62 117.16 113.17 1n6b n TYR 421 Ca -0.02 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.45 1n6b n TYR 421 Cb 0.18 -0.19 -0.03 0.00 -0.02 0.00 0.00 39.34 39.28 1n6b n TYR 421 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 1n6b s PHE 422 N -2.39 2.43 -0.29 -0.72 5.36 -0.99 -3.89 117.98 117.49 1n6b s PHE 422 Ca 0.33 -0.46 0.16 0.00 -0.96 0.00 0.00 56.93 56.00 1n6b s PHE 422 Cb 0.20 -4.64 0.48 0.00 -0.34 0.00 0.00 43.02 38.71 1n6b s PHE 422 CO 0.41 -1.99 1.11 -0.12 -1.46 0.00 0.00 175.22 173.17 1n6b n MET 423 N 9.03 2.32 0.09 10.12 1.56 -1.26 -4.86 117.12 134.12 1n6b n MET 423 Ca 0.17 -3.75 0.09 0.00 -0.27 0.00 0.00 57.70 53.95 1n6b n MET 423 Cb 0.50 -1.80 0.41 0.00 2.15 0.00 0.00 33.22 34.48 1n6b n MET 423 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1n6b n PRO 424 N -0.54 0.11 -0.26 2.12 -0.04 -1.26 -1.44 135.00 133.69 1n6b n PRO 424 Ca 0.21 0.41 0.07 0.00 -0.04 0.00 0.00 63.50 64.15 1n6b n PRO 424 Cb 0.84 -1.74 0.20 0.00 -0.04 0.00 0.00 33.50 32.76 1n6b n PRO 424 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1n6b n PHE 425 N -1.96 0.66 -4.39 0.54 3.72 -1.26 -4.85 117.46 109.92 1n6b n PHE 425 Ca 0.02 -0.54 0.00 0.00 -0.05 0.00 0.00 57.45 56.88 1n6b n PHE 425 Cb 0.16 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.64 1n6b n PHE 425 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1n6b n SER 426 N 0.65 -2.10 -3.57 4.37 2.88 -0.52 -1.68 113.62 113.64 1n6b n SER 426 Ca 0.16 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.58 1n6b n SER 426 Cb 0.53 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.95 1n6b n SER 426 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n6b s ALA 427 N -1.39 -1.15 0.00 -1.46 0.00 -1.26 -4.82 121.76 111.68 1n6b s ALA 427 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1n6b s ALA 427 Cb 0.00 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.81 1n6b s ALA 427 CO 0.00 -0.65 0.00 0.41 0.00 0.00 0.00 175.76 175.52 1n6b n GLY 428 N -0.16 -1.79 0.34 0.00 0.00 -1.26 -4.17 105.19 98.15 1n6b n GLY 428 Ca -0.17 -1.88 0.18 0.00 0.00 0.00 0.00 46.02 44.15 1n6b n GLY 428 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n6b h LYS 429 N 0.00 0.00 -0.02 1.61 6.56 -1.84 -2.32 116.57 120.55 1n6b h LYS 429 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1n6b h LYS 429 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1n6b h LYS 429 CO 0.00 0.00 -0.19 0.54 -2.06 0.00 0.00 179.45 177.74 1n6b n ARG 430 N -3.67 1.86 -1.56 3.15 5.12 -1.26 -5.02 116.66 115.27 1n6b n ARG 430 Ca 0.01 -1.54 -0.49 0.00 -1.93 0.00 0.00 57.85 53.91 1n6b n ARG 430 Cb 0.33 -1.46 -0.04 0.00 -1.16 0.00 0.00 32.46 30.13 1n6b n ARG 430 CO 0.00 0.00 0.00 -0.12 -1.93 0.00 0.00 177.63 175.58 1n6b n MET 431 N 0.78 1.01 -0.91 5.56 0.00 -0.88 -4.76 117.12 117.93 1n6b n MET 431 Ca 0.12 0.36 -0.34 0.00 -0.00 0.00 0.00 57.70 57.84 1n6b n MET 431 Cb 0.54 -1.79 -0.04 0.00 0.00 0.00 0.00 33.22 31.93 1n6b n MET 431 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1n6b n VAL 433 N 0.50 0.40 -0.80 0.00 0.31 -1.26 -3.95 118.33 113.53 1n6b n VAL 433 Ca 0.12 -0.38 0.08 0.00 -0.01 0.00 0.00 64.34 64.15 1n6b n VAL 433 Cb 0.10 -0.12 0.30 0.00 -0.91 0.00 0.00 33.84 33.21 1n6b n VAL 433 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1n6b n GLY 434 N 1.28 3.38 0.23 2.92 0.00 -1.26 -4.70 105.19 107.05 1n6b n GLY 434 Ca 0.02 -0.90 0.01 0.00 0.00 0.00 0.00 46.02 45.14 1n6b n GLY 434 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1n6b h GLU 435 N 2.82 0.17 -0.23 1.61 4.22 -1.95 0.58 114.58 121.79 1n6b h GLU 435 Ca 0.00 -0.01 -0.07 0.00 0.08 0.00 0.00 59.36 59.36 1n6b h GLU 435 Cb 1.50 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.71 1n6b h GLU 435 CO 0.27 0.11 -0.12 0.78 -2.18 0.00 0.00 179.01 177.87 1n6b h GLY 436 N 0.17 0.53 1.71 1.92 0.00 -1.91 -1.75 103.07 103.74 1n6b h GLY 436 Ca 0.31 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 47.10 1n6b h GLY 436 CO -0.46 0.44 -0.12 -2.00 0.00 0.00 0.00 176.54 174.40 1n6b h LEU 437 N 0.20 0.34 -0.07 3.11 5.85 -1.74 -0.40 115.31 122.61 1n6b h LEU 437 Ca 0.05 -0.08 -0.17 0.00 0.84 0.00 0.00 57.88 58.53 1n6b h LEU 437 Cb 0.62 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 41.57 1n6b h LEU 437 CO 0.04 0.49 -0.61 0.00 -0.34 0.00 0.00 178.44 178.02 1n6b h ALA 438 N 1.55 0.17 -0.41 1.25 0.00 0.27 -2.29 119.26 119.79 1n6b h ALA 438 Ca 0.07 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 1n6b h ALA 438 Cb 0.42 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1n6b h ALA 438 CO 0.02 0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.71 1n6b h ARG 439 N 0.13 0.65 -0.24 0.00 3.08 -1.12 -1.13 114.38 115.75 1n6b h ARG 439 Ca -0.06 -0.16 -0.13 0.00 0.07 0.00 0.00 59.98 59.71 1n6b h ARG 439 Cb 1.27 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.22 1n6b h ARG 439 CO 0.12 0.67 -0.38 0.52 -1.07 0.00 0.00 179.97 179.83 1n6b h MET 440 N 0.62 0.56 -0.55 0.04 2.86 -1.09 -1.83 114.93 115.54 1n6b h MET 440 Ca 0.13 -0.27 -0.07 0.00 -2.06 0.00 0.00 59.70 57.43 1n6b h MET 440 Cb 0.39 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 1n6b h MET 440 CO 0.01 0.85 0.09 0.93 1.06 0.00 0.00 176.91 179.86 1n6b h GLU 441 N 0.46 0.91 -0.15 1.72 5.08 -0.82 -1.42 114.58 120.36 1n6b h GLU 441 Ca 0.04 -0.24 -0.13 0.00 -1.00 0.00 0.00 59.36 58.03 1n6b h GLU 441 Cb 0.87 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1n6b h GLU 441 CO 0.07 0.88 -0.46 -0.07 -1.00 0.00 0.00 179.01 178.44 1n6b h LEU 442 N 0.80 0.39 0.23 1.33 3.38 -1.09 -1.26 115.31 119.09 1n6b h LEU 442 Ca 0.17 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1n6b h LEU 442 Cb 0.41 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1n6b h LEU 442 CO 0.01 0.79 -0.11 0.15 0.09 0.00 0.00 178.44 179.37 1n6b h PHE 443 N 0.29 -0.29 -0.46 1.13 3.04 -1.15 -2.72 116.94 116.79 1n6b h PHE 443 Ca 0.02 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 61.99 1n6b h PHE 443 Cb 0.92 0.10 -0.03 0.00 2.56 0.00 0.00 35.95 39.49 1n6b h PHE 443 CO 0.02 0.04 0.25 -0.07 -2.02 0.00 0.00 178.31 176.54 1n6b h LEU 444 N -0.97 0.39 -0.14 0.59 3.38 -1.31 -1.65 115.31 115.60 1n6b h LEU 444 Ca -0.03 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1n6b h LEU 444 Cb 0.46 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1n6b h LEU 444 CO 0.05 0.28 0.00 -0.26 0.09 0.00 0.00 178.44 178.60 1n6b h PHE 445 N 0.51 0.26 -0.19 1.13 0.04 -1.36 -1.43 116.94 115.90 1n6b h PHE 445 Ca 0.19 -0.05 -0.12 0.00 2.80 0.00 0.00 57.97 60.80 1n6b h PHE 445 Cb 0.06 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 1n6b h PHE 445 CO -0.08 0.47 -0.39 -0.07 -0.60 0.00 0.00 178.31 177.64 1n6b h LEU 446 N -0.02 0.45 -0.10 1.54 3.38 -1.42 -1.37 115.31 117.77 1n6b h LEU 446 Ca 0.04 -0.19 -0.20 0.00 0.09 0.00 0.00 57.88 57.62 1n6b h LEU 446 Cb 0.37 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.00 1n6b h LEU 446 CO 0.01 0.80 -0.70 0.71 0.09 0.00 0.00 178.44 179.35 1n6b h THR 447 N 0.36 1.32 -0.45 0.22 1.35 -1.32 -2.38 112.91 112.00 1n6b h THR 447 Ca 0.03 -1.96 -0.03 0.00 -0.55 0.00 0.00 66.41 63.91 1n6b h THR 447 Cb 0.85 2.16 -0.02 0.00 -1.73 0.00 0.00 68.15 69.40 1n6b h THR 447 CO 0.07 0.61 0.17 0.28 -0.25 0.00 0.00 175.52 176.39 1n6b h SER 448 N 0.32 0.59 -0.03 5.36 0.02 -1.20 -1.15 113.55 117.47 1n6b h SER 448 Ca -0.06 -0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.78 1n6b h SER 448 Cb 1.35 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1n6b h SER 448 CO 0.14 0.55 -0.14 0.40 -1.14 0.00 0.00 176.83 176.64 1n6b h ILE 449 N 0.65 1.49 0.00 3.27 2.04 -1.21 -2.98 117.51 120.76 1n6b h ILE 449 Ca 0.16 -1.64 0.00 0.00 1.00 0.00 0.00 64.86 64.37 1n6b h ILE 449 Cb 0.15 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 1n6b h ILE 449 CO -0.01 0.45 0.00 0.18 0.00 0.00 0.00 178.15 178.76 1n6b n LEU 450 N -4.61 0.00 -0.04 1.44 4.77 -0.90 -0.79 117.00 116.86 1n6b n LEU 450 Ca -0.09 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.68 1n6b n LEU 450 Cb 0.41 -0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.37 1n6b n LEU 450 CO 0.37 -0.00 -0.73 1.67 -1.33 0.00 0.00 177.39 177.37 1n6b n GLN 451 N -1.00 0.68 0.00 3.23 7.27 -0.45 -4.42 117.38 122.69 1n6b n GLN 451 Ca 0.16 0.38 0.11 0.00 0.07 0.00 0.00 57.00 57.72 1n6b n GLN 451 Cb 0.07 -1.72 0.01 0.00 2.41 0.00 0.00 30.24 31.01 1n6b n GLN 451 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1n6b n ASN 452 N -3.85 2.13 -4.05 1.69 3.02 -1.06 -4.87 115.26 108.27 1n6b n ASN 452 Ca -0.33 -1.57 -0.08 0.00 -0.03 0.00 0.00 54.58 52.58 1n6b n ASN 452 Cb 0.91 0.42 -0.09 0.00 -0.61 0.00 0.00 39.78 40.41 1n6b n ASN 452 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1n6b s PHE 453 N -2.40 0.52 -0.03 3.10 0.08 0.03 -1.79 117.98 117.49 1n6b s PHE 453 Ca 0.19 -1.00 0.07 0.00 0.12 0.00 0.00 56.93 56.31 1n6b s PHE 453 Cb 0.18 -0.33 -0.02 0.00 -0.57 0.00 0.00 43.02 42.28 1n6b s PHE 453 CO 0.53 -0.45 -0.24 0.21 -0.10 0.00 0.00 175.22 175.17 1n6b s LYS 454 N -3.94 2.10 -0.24 0.44 2.36 0.03 -4.49 119.74 116.01 1n6b s LYS 454 Ca 0.11 -0.87 -0.15 0.00 -2.55 0.00 0.00 55.97 52.51 1n6b s LYS 454 Cb 0.07 -1.96 -0.04 0.00 -1.05 0.00 0.00 37.83 34.85 1n6b s LYS 454 CO -0.07 0.49 0.35 -0.51 1.55 0.00 0.00 175.35 177.15 1n6b s LEU 455 N -0.47 4.09 -0.19 5.43 1.43 -1.26 -0.39 118.68 127.32 1n6b s LEU 455 Ca 0.06 0.34 -0.01 0.00 -1.03 0.00 0.00 54.13 53.49 1n6b s LEU 455 Cb -0.10 -2.41 0.00 0.00 0.03 0.00 0.00 46.19 43.71 1n6b s LEU 455 CO 0.00 -0.11 -0.12 -1.58 0.23 0.00 0.00 176.35 174.78 1n6b s GLN 456 N 1.64 3.23 -0.08 1.70 0.74 -0.24 -4.97 119.66 121.68 1n6b s GLN 456 Ca 0.15 -0.71 -0.06 0.00 0.05 0.00 0.00 55.36 54.79 1n6b s GLN 456 Cb -0.15 -2.77 -0.04 0.00 1.10 0.00 0.00 33.01 31.15 1n6b s GLN 456 CO 0.08 -0.12 0.16 -1.54 -0.55 0.00 0.00 175.29 173.33 1n6b s SER 457 N 1.18 6.40 0.34 6.67 1.04 -1.26 -0.32 113.70 127.75 1n6b s SER 457 Ca 0.02 0.45 0.10 0.00 0.48 0.00 0.00 55.95 57.00 1n6b s SER 457 Cb -0.14 -2.06 0.61 0.00 0.10 0.00 0.00 66.02 64.53 1n6b s SER 457 CO -0.05 0.36 1.78 -0.07 0.98 0.00 0.00 173.24 176.24 1n6b h LEU 458 N 4.62 0.10-10.13 2.42 4.07 -1.97 -3.44 115.31 110.99 1n6b h LEU 458 Ca -0.53 -0.04 -0.47 0.00 0.08 0.00 0.00 57.88 56.92 1n6b h LEU 458 Cb 1.22 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 42.91 1n6b h LEU 458 CO 0.61 0.48 -0.45 -0.69 -1.08 0.00 0.00 178.44 177.32 1n6b s VAL 459 N -4.18 5.01 0.37 1.22 1.01 -1.26 -5.11 120.40 117.46 1n6b s VAL 459 Ca -0.03 -1.09 -0.12 0.00 0.00 0.00 0.00 61.98 60.74 1n6b s VAL 459 Cb 0.14 -3.73 -0.07 0.00 0.00 0.00 0.00 36.38 32.72 1n6b s VAL 459 CO 0.74 -0.33 0.75 -1.61 0.00 0.00 0.00 175.10 174.66 1n6b s GLU 460 N -3.96 3.86 0.35 2.72 2.02 -1.26 -4.99 118.70 117.44 1n6b s GLU 460 Ca 0.34 0.54 0.12 0.00 0.02 0.00 0.00 54.97 55.99 1n6b s GLU 460 Cb -0.09 -2.41 0.95 0.00 0.10 0.00 0.00 34.13 32.68 1n6b s GLU 460 CO 0.28 0.04 1.75 -1.00 0.02 0.00 0.00 175.26 176.36 1n6b h PRO 461 N 1.65 0.52 0.00 0.39 0.13 -1.90 -2.01 132.00 130.78 1n6b h PRO 461 Ca -0.47 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1n6b h PRO 461 Cb 1.18 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1n6b h PRO 461 CO 0.64 0.34 0.00 -0.22 -0.23 0.00 0.00 178.00 178.54 1n6b h LYS 462 N 0.54 0.00 -0.48 0.86 1.63 -1.94 -2.88 116.57 114.30 1n6b h LYS 462 Ca 0.62 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.42 1n6b h LYS 462 Cb 1.28 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.91 1n6b h LYS 462 CO -0.39 0.00 0.00 -0.25 -3.45 0.00 0.00 179.45 175.36 1n6b n ASP 463 N -2.51 3.43 -4.66 4.20 10.43 -0.76 -4.94 116.55 121.75 1n6b n ASP 463 Ca 0.02 -2.10 -0.38 0.00 2.57 0.00 0.00 54.79 54.90 1n6b n ASP 463 Cb 0.26 -0.35 -0.08 0.00 1.84 0.00 0.00 41.12 42.79 1n6b n ASP 463 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 1n6b s LEU 464 N -1.18 4.13 -0.07 0.64 2.96 -1.09 -4.94 118.68 119.13 1n6b s LEU 464 Ca 0.34 0.42 -0.24 0.00 -0.22 0.00 0.00 54.13 54.43 1n6b s LEU 464 Cb 0.19 -2.45 -0.03 0.00 0.50 0.00 0.00 46.19 44.40 1n6b s LEU 464 CO 0.21 -0.08 0.74 -0.62 -1.32 0.00 0.00 176.35 175.27 1n6b s ASP 465 N 1.16 7.02 0.00 3.68 3.68 -1.26 -4.91 116.67 126.04 1n6b s ASP 465 Ca 0.17 1.23 0.00 0.00 2.13 0.00 0.00 52.55 56.07 1n6b s ASP 465 Cb -0.15 -2.43 0.00 0.00 -1.45 0.00 0.00 42.92 38.89 1n6b s ASP 465 CO 0.08 -0.15 0.75 2.30 0.13 0.00 0.00 175.17 178.27 1n6b n ILE 466 N 3.88 0.51 -2.12 4.11 -5.35 -1.26 -4.70 119.36 114.43 1n6b n ILE 466 Ca -0.00 -0.74 -0.42 0.00 -0.27 0.00 0.00 62.75 61.32 1n6b n ILE 466 Cb 0.51 0.76 -0.03 0.00 -1.74 0.00 0.00 39.64 39.14 1n6b n ILE 466 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1n6b s THR 467 N -0.51 3.28 0.26 7.28 2.01 -1.26 -4.81 115.64 121.89 1n6b s THR 467 Ca 0.00 0.85 -0.29 0.00 0.31 0.00 0.00 61.69 62.55 1n6b s THR 467 Cb 0.00 -3.54 -0.09 0.00 0.01 0.00 0.00 72.50 68.87 1n6b s THR 467 CO 0.00 0.04 0.96 0.00 -0.69 0.00 0.00 174.62 174.93 1n6b s ALA 468 N 1.64 3.33 -0.34 7.40 0.00 -1.26 -4.24 121.76 128.29 1n6b s ALA 468 Ca 0.66 0.65 -0.06 0.00 0.00 0.00 0.00 51.96 53.21 1n6b s ALA 468 Cb -0.37 -3.22 0.04 0.00 0.00 0.00 0.00 23.12 19.57 1n6b s ALA 468 CO 0.30 0.15 0.10 0.54 0.00 0.00 0.00 175.76 176.85 1n6b s VAL 469 N -1.23 3.72 -0.83 0.00 0.11 -0.95 -4.95 120.40 116.27 1n6b s VAL 469 Ca 0.43 -1.17 -0.25 0.00 -2.93 0.00 0.00 61.98 58.05 1n6b s VAL 469 Cb -0.26 -3.12 0.02 0.00 -1.53 0.00 0.00 36.38 31.49 1n6b s VAL 469 CO 0.32 -0.19 1.53 -0.69 -3.33 0.00 0.00 175.10 172.74 1n6b s VAL 470 N 1.39 3.69 0.00 2.04 1.01 -1.26 -2.16 120.40 125.11 1n6b s VAL 470 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1n6b s VAL 470 Cb -0.20 -4.68 0.00 0.00 0.00 0.00 0.00 36.38 31.51 1n6b s VAL 470 CO 0.02 -1.60 0.35 0.59 0.00 0.00 0.00 175.10 174.46 1n6b n ASN 471 N 10.43 0.00 0.00 3.32 5.03 -1.22 -4.84 115.26 127.98 1n6b n ASN 471 Ca 0.21 0.35 0.00 0.00 0.87 0.00 0.00 54.58 56.01 1n6b n ASN 471 Cb 0.50 -0.02 0.00 0.00 -1.02 0.00 0.00 39.78 39.24 1n6b n ASN 471 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1n6b n GLY 472 N 0.47 0.83 0.00 7.41 0.00 -1.26 -3.78 105.19 108.86 1n6b n GLY 472 Ca 0.00 -0.33 0.15 0.00 0.00 0.00 0.00 46.02 45.84 1n6b n GLY 472 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1n6b n PHE 473 N 0.00 0.00 -4.29 1.61 1.16 -0.88 -4.08 117.46 110.98 1n6b n PHE 473 Ca 0.00 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.24 1n6b n PHE 473 Cb 0.00 -0.13 -0.15 0.00 -1.61 0.00 0.00 39.48 37.60 1n6b n PHE 473 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1n6b s VAL 474 N -2.25 2.94 -0.16 1.97 1.01 -1.26 -4.22 120.40 118.42 1n6b s VAL 474 Ca 0.39 -0.66 -0.29 0.00 0.00 0.00 0.00 61.98 61.41 1n6b s VAL 474 Cb 0.21 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 1n6b s VAL 474 CO 0.41 0.49 1.37 -0.44 0.00 0.00 0.00 175.10 176.92 1n6b s SER 475 N 1.02 6.82 -0.09 3.32 0.01 0.09 -3.41 113.70 121.47 1n6b s SER 475 Ca -0.01 1.74 -0.01 0.00 1.31 0.00 0.00 55.95 58.98 1n6b s SER 475 Cb -0.15 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.52 1n6b s SER 475 CO -0.02 -0.87 -0.03 0.68 0.41 0.00 0.00 173.24 173.41 1n6b s VAL 476 N 3.83 3.99 0.52 3.43 -7.23 -0.92 -4.86 120.40 119.17 1n6b s VAL 476 Ca 0.60 -0.36 -0.19 0.00 -1.81 0.00 0.00 61.98 60.22 1n6b s VAL 476 Cb -0.24 -2.67 -0.07 0.00 0.56 0.00 0.00 36.38 33.96 1n6b s VAL 476 CO 0.20 0.58 1.05 -2.16 -0.31 0.00 0.00 175.10 174.46 1n6b s PRO 477 N -0.63 3.64 0.76 4.82 0.04 -1.26 -2.24 135.00 140.13 1n6b s PRO 477 Ca 0.10 1.36 -0.14 0.00 0.04 0.00 0.00 61.00 62.36 1n6b s PRO 477 Cb -0.12 -2.07 0.06 0.00 0.04 0.00 0.00 34.50 32.41 1n6b s PRO 477 CO 0.02 -0.57 1.21 -1.25 0.04 0.00 0.00 177.00 176.46 1n6b s PRO 478 N -3.41 1.93 0.71 0.56 0.04 -1.26 -4.94 135.00 128.63 1n6b s PRO 478 Ca 0.67 1.78 -0.15 0.00 0.04 0.00 0.00 61.00 63.34 1n6b s PRO 478 Cb -0.17 -1.81 0.03 0.00 0.04 0.00 0.00 34.50 32.59 1n6b s PRO 478 CO 0.24 -2.00 1.18 0.45 0.04 0.00 0.00 177.00 176.92 1n6b s SER 479 N -2.04 4.46 -0.12 6.66 0.15 -1.26 -5.03 113.70 116.51 1n6b s SER 479 Ca 0.74 2.27 -0.31 0.00 0.70 0.00 0.00 55.95 59.36 1n6b s SER 479 Cb -0.30 -2.58 0.13 0.00 -1.71 0.00 0.00 66.02 61.56 1n6b s SER 479 CO 0.47 -2.08 1.04 -0.72 1.20 0.00 0.00 173.24 173.15 1n6b s TYR 480 N -2.05 -0.27 0.27 3.44 -0.85 -1.26 -5.03 117.35 111.60 1n6b s TYR 480 Ca 0.73 0.29 0.09 0.00 -0.52 0.00 0.00 57.07 57.66 1n6b s TYR 480 Cb -0.27 0.50 -0.05 0.00 0.38 0.00 0.00 41.96 42.52 1n6b s TYR 480 CO 0.44 -0.36 -0.13 -0.65 -1.52 0.00 0.00 175.55 173.33 1n6b s GLN 481 N -2.18 1.58 0.25 -3.49 -0.21 -1.26 -4.45 119.66 109.90 1n6b s GLN 481 Ca 0.04 -1.76 -0.21 0.00 0.02 0.00 0.00 55.36 53.46 1n6b s GLN 481 Cb -0.01 -1.43 0.05 0.00 1.00 0.00 0.00 33.01 32.62 1n6b s GLN 481 CO -0.05 0.19 0.87 -0.48 -2.12 0.00 0.00 175.29 173.70 1n6b s LEU 482 N -3.46 -0.12 -0.04 2.90 2.34 -0.15 -4.55 118.68 115.61 1n6b s LEU 482 Ca 0.28 -0.70 0.06 0.00 0.06 0.00 0.00 54.13 53.84 1n6b s LEU 482 Cb -0.00 2.47 -0.01 0.00 -0.56 0.00 0.00 46.19 48.08 1n6b s LEU 482 CO 0.12 -1.24 -0.23 0.00 -1.06 0.00 0.00 176.35 173.95 1n6b s PHE 484 N -0.30 3.20 -0.57 0.00 0.40 -1.26 -1.08 117.98 118.37 1n6b s PHE 484 Ca 0.02 -1.26 -0.27 0.00 -0.60 0.00 0.00 56.93 54.83 1n6b s PHE 484 Cb -0.11 -3.95 0.03 0.00 0.51 0.00 0.00 43.02 39.51 1n6b s PHE 484 CO 0.01 -1.19 1.11 0.42 0.70 0.00 0.00 175.22 176.28 1n6b s ILE 485 N 1.98 4.13 0.24 0.64 -1.09 0.47 -4.28 121.20 123.29 1n6b s ILE 485 Ca 0.12 0.70 -0.31 0.00 -2.23 0.00 0.00 60.65 58.92 1n6b s ILE 485 Cb -0.22 -4.67 -0.14 0.00 -1.58 0.00 0.00 42.46 35.85 1n6b s ILE 485 CO 0.02 -1.28 1.35 -2.65 -1.23 0.00 0.00 174.94 171.15 1n6b n PRO 486 N 8.14 1.88 -4.27 2.79 -0.02 -1.26 -0.79 135.00 141.46 1n6b n PRO 486 Ca 0.06 0.67 -0.29 0.00 -2.02 0.00 0.00 63.50 61.92 1n6b n PRO 486 Cb 0.48 -2.28 -0.17 0.00 -0.02 0.00 0.00 33.50 31.52 1n6b n PRO 486 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1n6b s ILE 487 N -0.18 1.54 0.00 4.25 -4.36 -0.74 -4.85 121.20 116.86 1n6b s ILE 487 Ca 0.68 -0.64 0.00 0.00 -0.26 0.00 0.00 60.65 60.43 1n6b s ILE 487 Cb -0.68 -1.42 0.00 0.00 1.25 0.00 0.00 42.46 41.61 1n6b s ILE 487 CO 0.51 0.45 0.00 0.00 0.24 0.00 0.00 174.94 176.14