#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n6u h TYR 2 N 0.00 -0.01 -2.87 7.33 5.03 -2.12 -3.49 116.97 120.85 1n6u h TYR 2 Ca 0.00 -0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.37 1n6u h TYR 2 Cb 0.00 0.00 -0.08 0.00 1.55 0.00 0.00 36.73 38.20 1n6u h TYR 2 CO 0.00 0.84 0.27 -0.51 -1.32 0.00 0.00 178.16 177.44 1n6u s ASP 3 N -6.08 -0.35 -0.03 -2.11 1.01 -1.26 -5.17 116.67 102.67 1n6u s ASP 3 Ca -0.17 -0.35 -0.01 0.00 0.71 0.00 0.00 52.55 52.73 1n6u s ASP 3 Cb -0.02 0.64 0.03 0.00 1.01 0.00 0.00 42.92 44.58 1n6u s ASP 3 CO 0.62 -1.12 0.06 -0.44 0.21 0.00 0.00 175.17 174.49 1n6u s SER 4 N -2.84 0.04 -1.27 0.27 0.01 -1.26 -5.05 113.70 103.60 1n6u s SER 4 Ca 0.08 0.10 -0.09 0.00 1.31 0.00 0.00 55.95 57.35 1n6u s SER 4 Cb -0.04 -0.01 -0.11 0.00 0.21 0.00 0.00 66.02 66.07 1n6u s SER 4 CO -0.01 -0.14 2.90 -0.81 0.41 0.00 0.00 173.24 175.59 1n6u n PRO 5 N 4.21 3.17 -3.16 12.44 -0.04 -1.26 -4.84 135.00 145.52 1n6u n PRO 5 Ca -0.27 -1.89 -0.13 0.00 -0.04 0.00 0.00 63.50 61.17 1n6u n PRO 5 Cb 0.50 -2.62 -0.03 0.00 -0.04 0.00 0.00 33.50 31.31 1n6u n PRO 5 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1n6u n ASP 6 N 3.52 1.55 -3.94 3.54 2.03 -1.26 -5.11 116.55 116.87 1n6u n ASP 6 Ca 0.67 -2.02 -0.30 0.00 0.52 0.00 0.00 54.79 53.67 1n6u n ASP 6 Cb 0.31 0.39 -0.14 0.00 -0.72 0.00 0.00 41.12 40.96 1n6u n ASP 6 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1n6u s TYR 7 N -2.13 3.25 0.07 -0.67 1.51 -1.26 -4.85 117.35 113.26 1n6u s TYR 7 Ca 0.07 -3.21 0.00 0.00 -1.01 0.00 0.00 57.07 52.92 1n6u s TYR 7 Cb 0.00 -2.80 0.00 0.00 -0.11 0.00 0.00 41.96 39.05 1n6u s TYR 7 CO 0.05 -0.71 0.00 0.25 -1.11 0.00 0.00 175.55 174.03 1n6u n THR 8 N 2.91 0.39 -1.45 -0.71 -2.24 -1.26 -4.83 114.28 107.10 1n6u n THR 8 Ca 0.07 0.13 -0.18 0.00 -2.27 0.00 0.00 64.05 61.80 1n6u n THR 8 Cb 0.33 -1.25 0.15 0.00 -2.10 0.00 0.00 70.33 67.46 1n6u n THR 8 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1n6u n ASP 9 N -3.14 4.11 -0.94 3.42 9.92 -1.26 -4.49 116.55 124.17 1n6u n ASP 9 Ca 0.00 -3.74 0.01 0.00 -0.53 0.00 0.00 54.79 50.53 1n6u n ASP 9 Cb 0.20 -0.72 0.16 0.00 -0.64 0.00 0.00 41.12 40.12 1n6u n ASP 9 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1n6u n GLU 10 N -1.04 1.71 -1.28 -1.24 4.07 -1.26 -4.76 120.64 116.83 1n6u n GLU 10 Ca 0.48 -3.30 -0.30 0.00 -0.06 0.00 0.00 57.16 53.98 1n6u n GLU 10 Cb 1.13 -1.54 0.12 0.00 -0.06 0.00 0.00 31.44 31.09 1n6u n GLU 10 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1n6u n SER 11 N -0.88 6.00 -4.50 4.31 7.64 -1.26 -4.88 113.62 120.03 1n6u n SER 11 Ca 0.21 -3.71 -0.42 0.00 1.01 0.00 0.00 58.87 55.96 1n6u n SER 11 Cb 0.78 -0.92 -0.03 0.00 -1.01 0.00 0.00 64.21 63.03 1n6u n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1n6u s THR 13 N 4.45 5.19 -0.51 0.00 2.01 -1.04 -4.87 115.64 120.88 1n6u s THR 13 Ca 0.33 -1.50 -0.17 0.00 0.31 0.00 0.00 61.69 60.66 1n6u s THR 13 Cb -0.08 -4.37 0.08 0.00 0.01 0.00 0.00 72.50 68.14 1n6u s THR 13 CO 0.03 -0.91 0.52 -0.36 -0.69 0.00 0.00 174.62 173.21 1n6u s PHE 14 N 1.65 3.15 -0.09 4.92 0.08 -1.26 0.19 117.98 126.62 1n6u s PHE 14 Ca 0.05 -0.84 -0.08 0.00 0.12 0.00 0.00 56.93 56.18 1n6u s PHE 14 Cb -0.28 -3.46 -0.04 0.00 -0.57 0.00 0.00 43.02 38.66 1n6u s PHE 14 CO 0.03 -0.96 0.19 0.21 -0.10 0.00 0.00 175.22 174.59 1n6u s LYS 15 N 2.10 3.52 -0.10 0.44 2.47 0.15 -4.86 119.74 123.46 1n6u s LYS 15 Ca 0.09 -0.04 0.03 0.00 -1.56 0.00 0.00 55.97 54.49 1n6u s LYS 15 Cb -0.23 -3.19 -0.00 0.00 -1.46 0.00 0.00 37.83 32.95 1n6u s LYS 15 CO 0.08 0.76 -0.22 -1.50 0.16 0.00 0.00 175.35 174.63 1n6u s ILE 16 N -1.05 2.25 -0.04 5.43 2.07 -1.26 0.21 121.20 128.80 1n6u s ILE 16 Ca 0.17 -0.96 0.05 0.00 -1.41 0.00 0.00 60.65 58.50 1n6u s ILE 16 Cb -0.13 -1.87 -0.00 0.00 0.13 0.00 0.00 42.46 40.59 1n6u s ILE 16 CO 0.06 0.55 -0.18 -0.44 -1.91 0.00 0.00 174.94 173.03 1n6u s SER 17 N 0.31 2.21 -0.78 4.50 0.01 0.86 -4.47 113.70 116.34 1n6u s SER 17 Ca -0.17 -0.36 -0.14 0.00 1.31 0.00 0.00 55.95 56.59 1n6u s SER 17 Cb -0.17 -0.58 0.20 0.00 0.21 0.00 0.00 66.02 65.68 1n6u s SER 17 CO 0.08 0.17 0.72 -0.22 0.41 0.00 0.00 173.24 174.40 1n6u s LEU 18 N -0.02 6.66 -0.41 2.44 2.96 0.54 -1.22 118.68 129.62 1n6u s LEU 18 Ca -0.03 -2.55 -0.26 0.00 -0.22 0.00 0.00 54.13 51.06 1n6u s LEU 18 Cb -0.11 -2.21 0.02 0.00 0.50 0.00 0.00 46.19 44.39 1n6u s LEU 18 CO 0.02 -0.61 0.97 -0.60 -1.32 0.00 0.00 176.35 174.81 1n6u s ARG 19 N 0.38 3.74 -1.12 1.98 3.52 0.13 -3.93 118.95 123.65 1n6u s ARG 19 Ca 0.16 0.48 -0.16 0.00 -0.13 0.00 0.00 55.73 56.07 1n6u s ARG 19 Cb -0.13 -3.86 -0.03 0.00 -1.56 0.00 0.00 34.95 29.38 1n6u s ARG 19 CO -0.07 -1.11 0.83 0.09 -0.81 0.00 0.00 175.30 174.23 1n6u n ASN 20 N 7.09 -5.55 -4.08 -2.12 3.02 -1.26 -1.18 115.26 111.18 1n6u n ASN 20 Ca 0.08 -0.93 -0.34 0.00 -0.03 0.00 0.00 54.58 53.36 1n6u n ASN 20 Cb 0.48 -3.89 -0.04 0.00 -0.61 0.00 0.00 39.78 35.72 1n6u n ASN 20 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 1n6u n PHE 21 N -3.93 -1.52 -5.18 3.10 -1.74 -1.25 -4.89 117.46 102.05 1n6u n PHE 21 Ca -0.09 0.63 -0.29 0.00 -0.56 0.00 0.00 57.45 57.13 1n6u n PHE 21 Cb 0.60 -2.27 -0.16 0.00 1.52 0.00 0.00 39.48 39.18 1n6u n PHE 21 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 1n6u s ARG 22 N -6.75 1.92 0.06 3.97 0.52 -0.33 -5.04 118.95 113.30 1n6u s ARG 22 Ca 0.67 -0.86 -0.20 0.00 -0.52 0.00 0.00 55.73 54.82 1n6u s ARG 22 Cb -0.38 -1.86 -0.06 0.00 0.52 0.00 0.00 34.95 33.17 1n6u s ARG 22 CO 0.82 0.51 0.58 0.45 0.02 0.00 0.00 175.30 177.68 1n6u s SER 23 N -0.58 7.05 -0.23 0.23 0.15 -0.54 -0.70 113.70 119.09 1n6u s SER 23 Ca 0.09 1.25 -0.03 0.00 0.70 0.00 0.00 55.95 57.96 1n6u s SER 23 Cb -0.09 -2.36 0.11 0.00 -1.71 0.00 0.00 66.02 61.97 1n6u s SER 23 CO -0.01 0.24 0.29 -0.63 1.20 0.00 0.00 173.24 174.33 1n6u s ILE 24 N -0.92 -0.44 -0.15 6.45 1.01 -0.36 0.20 121.20 127.00 1n6u s ILE 24 Ca 0.29 -0.12 -0.06 0.00 0.00 0.00 0.00 60.65 60.76 1n6u s ILE 24 Cb -0.19 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.48 1n6u s ILE 24 CO 0.19 -0.19 0.07 -1.48 0.00 0.00 0.00 174.94 173.53 1n6u s LEU 25 N 2.42 3.93 0.47 2.97 0.05 0.53 -0.10 118.68 128.94 1n6u s LEU 25 Ca 0.09 0.20 0.03 0.00 0.05 0.00 0.00 54.13 54.50 1n6u s LEU 25 Cb -0.15 -1.97 -0.04 0.00 -2.05 0.00 0.00 46.19 41.98 1n6u s LEU 25 CO -0.15 0.27 0.01 -0.94 -0.55 0.00 0.00 176.35 175.00 1n6u s SER 26 N -0.23 3.94 0.06 1.48 1.04 0.55 -0.42 113.70 120.11 1n6u s SER 26 Ca 0.08 -1.55 -0.03 0.00 0.48 0.00 0.00 55.95 54.93 1n6u s SER 26 Cb -0.12 0.20 -0.03 0.00 0.10 0.00 0.00 66.02 66.17 1n6u s SER 26 CO 0.01 -0.71 0.03 -1.66 0.98 0.00 0.00 173.24 171.88 1n6u s TRP 27 N -2.85 0.41 -0.41 5.02 -2.14 -1.25 0.31 118.94 118.05 1n6u s TRP 27 Ca 0.17 -0.92 0.06 0.00 2.66 0.00 0.00 56.10 58.08 1n6u s TRP 27 Cb 0.05 -0.30 0.22 0.00 -3.10 0.00 0.00 33.47 30.34 1n6u s TRP 27 CO 0.09 -0.41 0.48 0.39 -2.66 0.00 0.00 176.95 174.84 1n6u n GLU 28 N 0.15 0.52 -3.83 3.25 4.71 0.51 -4.73 120.64 121.22 1n6u n GLU 28 Ca -0.15 -3.09 -0.36 0.00 -0.01 0.00 0.00 57.16 53.56 1n6u n GLU 28 Cb 0.61 -1.40 -0.13 0.00 -1.01 0.00 0.00 31.44 29.52 1n6u n GLU 28 CO 0.00 0.00 0.00 -0.48 0.09 0.00 0.00 177.13 176.74 1n6u s LEU 29 N -0.64 4.56 0.08 -4.62 -0.00 -1.25 -2.49 118.68 114.32 1n6u s LEU 29 Ca 0.34 -1.59 0.01 0.00 -0.00 0.00 0.00 54.13 52.89 1n6u s LEU 29 Cb 0.12 -1.79 -0.04 0.00 -0.00 0.00 0.00 46.19 44.49 1n6u s LEU 29 CO -0.15 -0.39 0.20 -0.75 -0.00 0.00 0.00 176.35 175.26 1n6u s LYS 30 N 1.22 3.35 0.15 1.48 2.36 -1.26 -5.03 119.74 122.01 1n6u s LYS 30 Ca 0.01 -0.52 0.01 0.00 -2.55 0.00 0.00 55.97 52.93 1n6u s LYS 30 Cb -0.21 -2.97 -0.01 0.00 -1.05 0.00 0.00 37.83 33.59 1n6u s LYS 30 CO -0.02 0.58 0.05 0.27 1.55 0.00 0.00 175.35 177.78 1n6u n ASN 31 N 0.13 1.11 0.00 1.43 0.23 -1.26 -4.88 115.26 112.02 1n6u n ASN 31 Ca -0.06 -1.78 0.00 0.00 -0.53 0.00 0.00 54.58 52.21 1n6u n ASN 31 Cb 0.52 0.36 0.00 0.00 -2.08 0.00 0.00 39.78 38.58 1n6u n ASN 31 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1n6u n HIS 32 N -0.33 0.00 -2.27 -2.53 8.25 -1.26 -4.44 115.22 112.64 1n6u n HIS 32 Ca -0.02 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.01 1n6u n HIS 32 Cb 0.22 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.31 1n6u n HIS 32 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1n6u s SER 33 N -2.01 6.43 -0.94 0.41 0.15 -1.26 -4.91 113.70 111.56 1n6u s SER 33 Ca 0.00 1.24 -0.24 0.00 0.70 0.00 0.00 55.95 57.65 1n6u s SER 33 Cb 0.00 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.72 1n6u s SER 33 CO 0.00 -1.28 1.94 -0.63 1.20 0.00 0.00 173.24 174.47 1n6u s ILE 34 N 5.12 3.46 -0.36 6.45 1.09 -1.26 -4.81 121.20 130.89 1n6u s ILE 34 Ca 0.64 -0.45 0.01 0.00 -1.10 0.00 0.00 60.65 59.75 1n6u s ILE 34 Cb -0.19 -4.09 0.15 0.00 -1.06 0.00 0.00 42.46 37.27 1n6u s ILE 34 CO 0.28 -0.96 0.26 0.68 -0.10 0.00 0.00 174.94 175.10 1n6u s VAL 35 N 10.19 0.09 -0.16 2.92 -7.23 -1.26 -5.13 120.40 119.83 1n6u s VAL 35 Ca 0.70 -1.75 -0.08 0.00 -1.81 0.00 0.00 61.98 59.04 1n6u s VAL 35 Cb -0.06 -1.06 -0.04 0.00 0.56 0.00 0.00 36.38 35.78 1n6u s VAL 35 CO 0.01 -0.97 0.12 -2.16 -0.31 0.00 0.00 175.10 171.79 1n6u s PRO 36 N 0.96 3.78 0.00 4.82 0.04 -1.26 -3.59 135.00 139.75 1n6u s PRO 36 Ca 0.20 -0.21 0.00 0.00 0.04 0.00 0.00 61.00 61.03 1n6u s PRO 36 Cb -0.18 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1n6u s PRO 36 CO -0.03 0.52 0.00 -2.37 0.04 0.00 0.00 177.00 175.16 1n6u n THR 37 N 2.81 0.00 -3.36 1.26 5.66 -1.25 -4.85 114.28 114.55 1n6u n THR 37 Ca -0.18 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.44 1n6u n THR 37 Cb 0.53 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.25 1n6u n THR 37 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 1n6u s HIS 38 N 2.93 3.75 0.45 1.09 -3.43 -1.25 -4.06 115.29 114.76 1n6u s HIS 38 Ca 0.00 1.15 0.05 0.00 -0.80 0.00 0.00 55.06 55.46 1n6u s HIS 38 Cb 0.00 -2.41 -0.05 0.00 -1.43 0.00 0.00 32.58 28.69 1n6u s HIS 38 CO 0.00 0.58 0.02 0.71 -2.00 0.00 0.00 174.74 174.05 1n6u s TYR 39 N -1.16 2.28 -0.33 0.38 1.51 0.50 -3.04 117.35 117.48 1n6u s TYR 39 Ca 0.29 -0.77 -0.01 0.00 -1.01 0.00 0.00 57.07 55.57 1n6u s TYR 39 Cb -0.18 -1.73 0.13 0.00 -0.11 0.00 0.00 41.96 40.07 1n6u s TYR 39 CO 0.17 0.35 0.20 0.99 -1.11 0.00 0.00 175.55 176.15 1n6u s THR 40 N -2.77 0.05 -0.46 -0.71 2.01 -0.23 0.14 115.64 113.66 1n6u s THR 40 Ca 0.25 -1.41 -0.27 0.00 0.31 0.00 0.00 61.69 60.57 1n6u s THR 40 Cb 0.07 -1.05 -0.03 0.00 0.01 0.00 0.00 72.50 71.50 1n6u s THR 40 CO 0.13 -0.90 1.90 -0.22 -0.69 0.00 0.00 174.62 174.85 1n6u s LEU 41 N 1.38 3.40 -0.12 4.42 1.98 0.38 -1.86 118.68 128.26 1n6u s LEU 41 Ca 0.15 0.89 -0.05 0.00 -2.89 0.00 0.00 54.13 52.23 1n6u s LEU 41 Cb -0.21 -2.99 -0.04 0.00 0.66 0.00 0.00 46.19 43.62 1n6u s LEU 41 CO -0.10 -2.13 0.08 -0.76 -1.89 0.00 0.00 176.35 171.56 1n6u s LEU 42 N 8.45 4.04 0.02 -0.68 1.43 -0.74 -2.61 118.68 128.58 1n6u s LEU 42 Ca 0.77 0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 54.17 1n6u s LEU 42 Cb -0.18 -1.97 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 1n6u s LEU 42 CO 0.27 0.36 -0.01 -0.72 0.23 0.00 0.00 176.35 176.48 1n6u s TYR 43 N -0.76 0.20 0.31 0.29 -0.85 -0.03 1.00 117.35 117.52 1n6u s TYR 43 Ca 0.13 -0.42 0.02 0.00 -0.52 0.00 0.00 57.07 56.28 1n6u s TYR 43 Cb -0.12 -0.15 -0.02 0.00 0.38 0.00 0.00 41.96 42.05 1n6u s TYR 43 CO 0.03 -0.17 0.32 -0.08 -1.52 0.00 0.00 175.55 174.13 1n6u s THR 44 N -1.23 0.00 -0.23 -3.49 -1.32 0.28 0.94 115.64 110.59 1n6u s THR 44 Ca -0.13 -1.86 -0.06 0.00 -1.21 0.00 0.00 61.69 58.43 1n6u s THR 44 Cb -0.08 -2.53 -0.03 0.00 -1.51 0.00 0.00 72.50 68.35 1n6u s THR 44 CO -0.01 0.00 0.04 0.27 -2.21 0.00 0.00 174.62 172.71 1n6u s ILE 45 N -3.45 4.15 0.30 5.08 -4.36 -1.21 0.60 121.20 122.30 1n6u s ILE 45 Ca 0.37 -0.23 0.06 0.00 -0.26 0.00 0.00 60.65 60.59 1n6u s ILE 45 Cb 0.02 -2.91 0.36 0.00 1.25 0.00 0.00 42.46 41.18 1n6u s ILE 45 CO 0.22 0.38 1.42 0.80 0.24 0.00 0.00 174.94 178.00 1n6u n MET 46 N 4.63 -0.07 0.24 0.37 0.00 0.27 0.27 117.12 122.83 1n6u n MET 46 Ca -0.17 1.32 0.08 0.00 -0.00 0.00 0.00 57.70 58.94 1n6u n MET 46 Cb 0.51 -2.17 0.60 0.00 0.00 0.00 0.00 33.22 32.16 1n6u n MET 46 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 175.97 176.74 1n6u h SER 47 N 0.00 0.00 -2.49 6.12 0.02 -1.95 -3.29 113.55 111.97 1n6u h SER 47 Ca 0.61 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.96 1n6u h SER 47 Cb 1.38 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 63.52 1n6u h SER 47 CO -0.81 0.15 -0.83 0.29 -1.14 0.00 0.00 176.83 174.49 1n6u n LYS 48 N -4.11 1.06 0.00 3.45 4.01 0.75 -4.94 118.16 118.38 1n6u n LYS 48 Ca -0.02 -3.76 0.07 0.00 -0.51 0.00 0.00 58.31 54.09 1n6u n LYS 48 Cb 0.23 -1.85 0.34 0.00 -0.51 0.00 0.00 35.03 33.24 1n6u n LYS 48 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 1n6u n PRO 49 N 2.08 0.15 -0.02 1.97 -0.04 -0.90 -2.09 135.00 136.14 1n6u n PRO 49 Ca 0.25 0.18 0.13 0.00 -0.04 0.00 0.00 63.50 64.03 1n6u n PRO 49 Cb 0.44 -1.50 0.48 0.00 -0.04 0.00 0.00 33.50 32.88 1n6u n PRO 49 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1n6u n GLU 50 N -1.34 1.69 -2.54 0.54 -0.58 -1.26 -4.26 120.64 112.88 1n6u n GLU 50 Ca 0.06 -1.01 -0.32 0.00 -0.42 0.00 0.00 57.16 55.47 1n6u n GLU 50 Cb 0.13 -1.46 -0.00 0.00 -0.57 0.00 0.00 31.44 29.54 1n6u n GLU 50 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1n6u n ASP 51 N 0.22 5.59 -4.81 1.62 -0.08 -0.89 -5.05 116.55 113.16 1n6u n ASP 51 Ca 0.18 -3.73 -0.35 0.00 -1.51 0.00 0.00 54.79 49.38 1n6u n ASP 51 Cb 0.35 -0.71 -0.06 0.00 2.34 0.00 0.00 41.12 43.03 1n6u n ASP 51 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 1n6u s LEU 52 N -3.75 4.21 -0.05 -2.67 0.20 -1.26 -4.33 118.68 111.04 1n6u s LEU 52 Ca 0.48 1.56 0.02 0.00 0.69 0.00 0.00 54.13 56.88 1n6u s LEU 52 Cb 0.34 -3.99 0.02 0.00 -0.43 0.00 0.00 46.19 42.13 1n6u s LEU 52 CO -0.21 -0.12 -0.08 -0.75 -0.29 0.00 0.00 176.35 174.91 1n6u s LYS 53 N -2.42 1.09 -0.76 1.98 2.20 0.27 -4.86 119.74 117.23 1n6u s LYS 53 Ca 0.51 -0.23 -0.22 0.00 -0.36 0.00 0.00 55.97 55.67 1n6u s LYS 53 Cb -0.15 -1.00 0.08 0.00 -1.51 0.00 0.00 37.83 35.26 1n6u s LYS 53 CO 0.20 -0.01 1.08 0.14 -0.36 0.00 0.00 175.35 176.40 1n6u s VAL 54 N 0.68 4.32 -0.05 4.02 -7.23 -1.26 -0.85 120.40 120.03 1n6u s VAL 54 Ca -0.11 -0.61 -0.35 0.00 -1.81 0.00 0.00 61.98 59.10 1n6u s VAL 54 Cb -0.14 -4.76 -0.13 0.00 0.56 0.00 0.00 36.38 31.91 1n6u s VAL 54 CO 0.01 -1.55 1.74 0.52 -0.31 0.00 0.00 175.10 175.51 1n6u n VAL 55 N 5.96 0.35 -0.18 1.32 0.31 -1.07 -4.70 118.33 120.31 1n6u n VAL 55 Ca 0.07 -0.06 0.25 0.00 -0.01 0.00 0.00 64.34 64.58 1n6u n VAL 55 Cb 0.47 -1.59 0.66 0.00 -0.91 0.00 0.00 33.84 32.47 1n6u n VAL 55 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1n6u h LYS 56 N 7.71 0.11 -0.17 5.55 1.63 -1.92 1.13 116.57 130.60 1n6u h LYS 56 Ca -0.47 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 1n6u h LYS 56 Cb 1.28 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.89 1n6u h LYS 56 CO 0.92 0.07 0.00 -1.71 -3.45 0.00 0.00 179.45 175.28 1n6u n ASN 57 N -4.35 2.00 -0.01 4.20 5.15 -1.26 -4.01 115.26 116.98 1n6u n ASN 57 Ca 0.18 -1.74 0.00 0.00 -0.60 0.00 0.00 54.58 52.42 1n6u n ASN 57 Cb 0.85 -0.11 0.00 0.00 -0.53 0.00 0.00 39.78 40.00 1n6u n ASN 57 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1n6u s ALA 59 N -0.09 3.69 0.00 0.00 0.00 0.31 0.14 121.76 125.81 1n6u s ALA 59 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.20 1n6u s ALA 59 Cb 0.00 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.96 1n6u s ALA 59 CO 0.00 0.15 0.00 0.27 0.00 0.00 0.00 175.76 176.18 1n6u n ASN 60 N -1.29 0.00 -4.15 0.00 6.94 0.36 -4.76 115.26 112.36 1n6u n ASN 60 Ca -0.04 0.00 -0.25 0.00 -0.02 0.00 0.00 54.58 54.28 1n6u n ASN 60 Cb 0.55 0.00 -0.15 0.00 -2.36 0.00 0.00 39.78 37.81 1n6u n ASN 60 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1n6u s THR 61 N -0.34 1.35 -1.12 5.53 -1.32 0.89 -4.74 115.64 115.88 1n6u s THR 61 Ca 0.00 -0.71 -0.03 0.00 -1.21 0.00 0.00 61.69 59.74 1n6u s THR 61 Cb 0.00 -1.13 0.26 0.00 -1.51 0.00 0.00 72.50 70.12 1n6u s THR 61 CO 0.00 0.38 1.96 0.35 -2.21 0.00 0.00 174.62 175.11 1n6u n THR 62 N 2.80 5.81 -4.15 5.08 -2.24 -1.26 0.19 114.28 120.51 1n6u n THR 62 Ca -0.16 -5.50 -0.15 0.00 -2.27 0.00 0.00 64.05 55.97 1n6u n THR 62 Cb 0.54 -1.74 -0.06 0.00 -2.10 0.00 0.00 70.33 66.97 1n6u n THR 62 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1n6u s ARG 63 N -3.28 1.75 0.01 -0.78 3.00 -1.26 -4.94 118.95 113.46 1n6u s ARG 63 Ca 0.43 -1.77 -0.01 0.00 0.00 0.00 0.00 55.73 54.37 1n6u s ARG 63 Cb 0.18 0.39 -0.00 0.00 0.00 0.00 0.00 34.95 35.52 1n6u s ARG 63 CO -0.10 -0.69 -0.02 -1.13 0.00 0.00 0.00 175.30 173.35 1n6u n SER 64 N -1.22 0.42 -4.64 0.23 3.41 -1.26 -4.52 113.62 106.03 1n6u n SER 64 Ca 0.03 0.06 -0.43 0.00 -0.26 0.00 0.00 58.87 58.27 1n6u n SER 64 Cb 0.62 -0.20 -0.02 0.00 -0.26 0.00 0.00 64.21 64.35 1n6u n SER 64 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1n6u s PHE 65 N -1.38 2.67 0.06 7.33 -0.12 -1.26 -4.22 117.98 121.05 1n6u s PHE 65 Ca -0.02 0.87 -0.03 0.00 -0.05 0.00 0.00 56.93 57.70 1n6u s PHE 65 Cb 0.00 -3.81 -0.04 0.00 -0.63 0.00 0.00 43.02 38.54 1n6u s PHE 65 CO 0.03 -1.84 0.25 0.00 -0.05 0.00 0.00 175.22 173.61 1n6u s ASP 67 N -2.28 5.64 -0.35 0.00 -4.77 -1.26 -0.35 116.67 113.30 1n6u s ASP 67 Ca 0.34 -0.35 -0.04 0.00 -3.30 0.00 0.00 52.55 49.20 1n6u s ASP 67 Cb -0.13 -1.06 0.19 0.00 -1.09 0.00 0.00 42.92 40.83 1n6u s ASP 67 CO 0.24 -0.43 0.91 -1.48 0.70 0.00 0.00 175.17 175.11 1n6u s LEU 68 N -4.11 -0.72 -0.12 2.11 2.34 0.55 -4.79 118.68 113.94 1n6u s LEU 68 Ca 0.44 -0.37 -0.18 0.00 0.06 0.00 0.00 54.13 54.08 1n6u s LEU 68 Cb -0.08 0.92 -0.26 0.00 -0.56 0.00 0.00 46.19 46.21 1n6u s LEU 68 CO 0.29 -0.08 0.54 0.71 -1.06 0.00 0.00 176.35 176.76 1n6u h THR 69 N 3.93 1.11 -0.08 5.48 1.35 -1.89 -1.45 112.91 121.36 1n6u h THR 69 Ca -0.01 -2.37 0.00 0.00 -0.55 0.00 0.00 66.41 63.48 1n6u h THR 69 Cb 1.22 2.73 0.00 0.00 -1.73 0.00 0.00 68.15 70.37 1n6u h THR 69 CO -0.02 0.64 0.00 -0.90 -0.25 0.00 0.00 175.52 174.99 1n6u n ASP 70 N -4.08 2.08 0.10 5.36 5.68 -1.26 -4.40 116.55 120.03 1n6u n ASP 70 Ca -0.24 -1.56 -0.03 0.00 -0.50 0.00 0.00 54.79 52.46 1n6u n ASP 70 Cb 0.82 -0.05 -0.02 0.00 -1.14 0.00 0.00 41.12 40.74 1n6u n ASP 70 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1n6u h GLU 71 N 1.97 0.00 -1.19 0.11 3.07 -1.94 -3.30 114.58 113.30 1n6u h GLU 71 Ca 0.00 0.00 -0.60 0.00 -0.50 0.00 0.00 59.36 58.26 1n6u h GLU 71 Cb 0.49 0.00 -0.40 0.00 -0.84 0.00 0.00 28.75 28.00 1n6u h GLU 71 CO 0.00 0.80 -0.49 0.91 -1.40 0.00 0.00 179.01 178.83 1n6u n TRP 72 N -3.41 3.09 0.26 4.33 7.02 -1.26 -4.77 117.44 122.69 1n6u n TRP 72 Ca 0.00 -2.67 0.16 0.00 -1.02 0.00 0.00 57.50 53.97 1n6u n TRP 72 Cb 0.82 -0.39 0.83 0.00 -2.42 0.00 0.00 31.31 30.15 1n6u n TRP 72 CO 0.00 0.00 0.00 0.07 -2.02 0.00 0.00 177.69 175.74 1n6u h ARG 73 N 2.40 0.00 -3.08 -0.99 0.11 -1.81 -3.23 114.38 107.77 1n6u h ARG 73 Ca 0.38 0.00 -0.36 0.00 0.10 0.00 0.00 59.98 60.10 1n6u h ARG 73 Cb 1.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.18 1n6u h ARG 73 CO 0.92 0.00 2.11 0.43 0.10 0.00 0.00 179.97 183.53 1n6u n SER 74 N -2.64 5.17 0.27 0.08 7.64 -1.26 -4.54 113.62 118.33 1n6u n SER 74 Ca -0.02 -2.31 0.17 0.00 1.01 0.00 0.00 58.87 57.71 1n6u n SER 74 Cb 0.15 -1.13 0.91 0.00 -1.01 0.00 0.00 64.21 63.14 1n6u n SER 74 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1n6u h THR 75 N 3.08 0.44 -0.29 0.44 1.35 -1.92 0.23 112.91 116.24 1n6u h THR 75 Ca 0.46 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.32 1n6u h THR 75 Cb 0.40 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 67.75 1n6u h THR 75 CO 1.21 0.00 0.00 1.57 -0.25 0.00 0.00 175.52 178.05 1n6u n HIS 76 N -3.73 0.78 -4.27 4.73 -0.00 -1.26 -2.22 115.22 109.25 1n6u n HIS 76 Ca -0.01 -0.29 -0.15 0.00 -0.00 0.00 0.00 57.72 57.26 1n6u n HIS 76 Cb 0.18 -0.18 -0.10 0.00 -0.00 0.00 0.00 29.99 29.88 1n6u n HIS 76 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1n6u s GLU 77 N -1.71 1.11 -0.83 1.57 0.41 0.82 -4.99 118.70 115.08 1n6u s GLU 77 Ca 0.24 -1.49 -0.18 0.00 -0.41 0.00 0.00 54.97 53.13 1n6u s GLU 77 Cb 0.16 -0.65 0.14 0.00 -1.78 0.00 0.00 34.13 32.00 1n6u s GLU 77 CO 0.10 0.06 0.97 0.00 -0.49 0.00 0.00 175.26 175.91 1n6u s ALA 78 N -3.32 3.49 -0.95 5.21 0.00 -1.26 -4.32 121.76 120.62 1n6u s ALA 78 Ca 0.18 -2.70 -0.25 0.00 0.00 0.00 0.00 51.96 49.19 1n6u s ALA 78 Cb 0.03 -3.84 -0.12 0.00 0.00 0.00 0.00 23.12 19.19 1n6u s ALA 78 CO 0.02 -2.72 2.13 0.71 0.00 0.00 0.00 175.76 175.89 1n6u s TYR 79 N 2.33 1.50 0.45 0.00 2.02 0.12 0.95 117.35 124.71 1n6u s TYR 79 Ca 0.25 1.36 -0.24 0.00 -0.37 0.00 0.00 57.07 58.07 1n6u s TYR 79 Cb -0.10 -3.71 -0.08 0.00 -0.40 0.00 0.00 41.96 37.68 1n6u s TYR 79 CO -0.05 -1.40 1.21 0.14 -1.57 0.00 0.00 175.55 173.88 1n6u s VAL 80 N 13.07 2.94 0.00 0.71 -7.23 0.20 -2.18 120.40 127.92 1n6u s VAL 80 Ca 0.79 0.75 -0.01 0.00 -1.81 0.00 0.00 61.98 61.70 1n6u s VAL 80 Cb -0.07 -3.40 -0.01 0.00 0.56 0.00 0.00 36.38 33.46 1n6u s VAL 80 CO 0.08 0.03 0.00 -0.89 -0.31 0.00 0.00 175.10 174.01 1n6u s THR 81 N -1.45 0.04 -0.33 5.32 2.01 0.21 0.10 115.64 121.55 1n6u s THR 81 Ca 0.62 -0.37 0.03 0.00 0.31 0.00 0.00 61.69 62.28 1n6u s THR 81 Cb -0.32 -0.13 0.10 0.00 0.01 0.00 0.00 72.50 72.17 1n6u s THR 81 CO 0.39 -0.20 0.07 -0.69 -0.69 0.00 0.00 174.62 173.50 1n6u s VAL 82 N -0.59 1.87 -0.05 3.82 1.01 0.28 0.46 120.40 127.19 1n6u s VAL 82 Ca -0.07 -2.09 -0.25 0.00 0.00 0.00 0.00 61.98 59.58 1n6u s VAL 82 Cb -0.04 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 1n6u s VAL 82 CO -0.00 -0.63 0.78 -0.22 0.00 0.00 0.00 175.10 175.03 1n6u s LEU 83 N 1.09 4.32 -0.30 3.92 2.96 0.26 -1.79 118.68 129.14 1n6u s LEU 83 Ca 0.11 1.31 0.02 0.00 -0.22 0.00 0.00 54.13 55.34 1n6u s LEU 83 Cb -0.19 -3.21 0.09 0.00 0.50 0.00 0.00 46.19 43.38 1n6u s LEU 83 CO -0.13 -0.16 0.03 -1.61 -1.32 0.00 0.00 176.35 173.16 1n6u s GLU 84 N 0.91 1.35 0.48 1.98 2.02 -0.77 -0.96 118.70 123.71 1n6u s GLU 84 Ca 0.41 -1.44 0.07 0.00 0.02 0.00 0.00 54.97 54.03 1n6u s GLU 84 Cb -0.18 -2.73 0.03 0.00 0.10 0.00 0.00 34.13 31.35 1n6u s GLU 84 CO 0.20 -0.85 0.66 0.20 0.02 0.00 0.00 175.26 175.49 1n6u s GLY 85 N 1.21 1.88 -0.04 -1.39 0.00 -1.09 -1.07 107.32 106.82 1n6u s GLY 85 Ca 0.06 -1.69 -0.01 0.00 0.00 0.00 0.00 44.72 43.07 1n6u s GLY 85 CO -0.12 -1.43 0.07 -1.36 0.00 0.00 0.00 173.10 170.26 1n6u s PHE 86 N -2.51 -0.02 -0.50 1.90 0.08 -1.17 -2.75 117.98 113.01 1n6u s PHE 86 Ca 0.57 0.27 -0.29 0.00 0.12 0.00 0.00 56.93 57.60 1n6u s PHE 86 Cb -0.09 -0.27 0.03 0.00 -0.57 0.00 0.00 43.02 42.12 1n6u s PHE 86 CO 0.35 -0.14 1.17 0.45 -0.10 0.00 0.00 175.22 176.95 1n6u s SER 87 N 1.46 6.56 0.52 1.36 0.15 0.64 -3.76 113.70 120.65 1n6u s SER 87 Ca -0.05 0.40 0.00 0.00 0.70 0.00 0.00 55.95 57.00 1n6u s SER 87 Cb -0.12 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 1n6u s SER 87 CO -0.04 -1.33 0.00 0.61 1.20 0.00 0.00 173.24 173.68 1n6u n GLY 88 N 4.92 1.06 0.00 9.45 0.00 -1.24 -1.12 105.19 118.28 1n6u n GLY 88 Ca 0.11 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1n6u n GLY 88 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1n6u n ASN 89 N 7.27 1.06 -4.65 1.61 2.85 -1.26 -4.64 115.26 117.49 1n6u n ASN 89 Ca 0.00 -1.11 -0.29 0.00 -0.11 0.00 0.00 54.58 53.07 1n6u n ASN 89 Cb 0.00 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 40.94 1n6u n ASN 89 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1n6u s THR 90 N -0.11 3.75 -0.06 -0.44 2.01 -0.27 -5.08 115.64 115.43 1n6u s THR 90 Ca 0.00 -1.21 -0.30 0.00 0.31 0.00 0.00 61.69 60.49 1n6u s THR 90 Cb 0.00 -2.81 -0.04 0.00 0.01 0.00 0.00 72.50 69.66 1n6u s THR 90 CO 0.00 0.04 1.41 0.42 -0.69 0.00 0.00 174.62 175.80 1n6u s THR 91 N -1.43 3.87 -0.04 -0.82 -4.23 -1.26 0.24 115.64 111.96 1n6u s THR 91 Ca 0.25 1.15 0.13 0.00 -1.18 0.00 0.00 61.69 62.04 1n6u s THR 91 Cb -0.11 -3.74 -0.20 0.00 1.34 0.00 0.00 72.50 69.80 1n6u s THR 91 CO 0.17 -0.05 0.29 -0.11 -0.54 0.00 0.00 174.62 174.38 1n6u n LEU 92 N 6.15 0.03 -3.80 4.79 7.94 -1.11 -4.68 117.00 126.31 1n6u n LEU 92 Ca 0.14 -0.02 -0.04 0.00 -1.11 0.00 0.00 56.01 54.98 1n6u n LEU 92 Cb 0.44 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.38 1n6u n LEU 92 CO 0.59 0.01 0.69 0.72 -1.11 0.00 0.00 177.39 178.28 1n6u s PHE 93 N -2.85 -0.07 -0.34 1.96 -0.71 -1.19 -4.95 117.98 109.84 1n6u s PHE 93 Ca -0.04 -0.31 0.00 0.00 -1.04 0.00 0.00 56.93 55.54 1n6u s PHE 93 Cb 0.08 0.68 0.29 0.00 -1.21 0.00 0.00 43.02 42.87 1n6u s PHE 93 CO 0.53 -0.97 1.28 -1.13 -1.34 0.00 0.00 175.22 173.59 1n6u n SER 94 N -0.72 -1.35 -5.00 1.98 3.41 -1.25 -2.69 113.62 108.01 1n6u n SER 94 Ca -0.05 -1.90 -0.19 0.00 -0.26 0.00 0.00 58.87 56.47 1n6u n SER 94 Cb 0.60 0.93 0.02 0.00 -0.26 0.00 0.00 64.21 65.50 1n6u n SER 94 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n6u s SER 96 N -4.41 0.31 -0.22 0.00 1.04 -1.25 0.91 113.70 110.08 1n6u s SER 96 Ca 0.55 -1.10 -0.20 0.00 0.48 0.00 0.00 55.95 55.68 1n6u s SER 96 Cb -0.08 0.29 0.06 0.00 0.10 0.00 0.00 66.02 66.39 1n6u s SER 96 CO 0.34 -0.72 0.58 -2.28 0.98 0.00 0.00 173.24 172.13 1n6u s HIS 97 N -4.00 -0.64 -0.39 5.02 5.04 0.17 -4.95 115.29 115.54 1n6u s HIS 97 Ca 0.19 1.55 -0.25 0.00 -1.54 0.00 0.00 55.06 55.01 1n6u s HIS 97 Cb 0.07 0.22 0.02 0.00 0.04 0.00 0.00 32.58 32.93 1n6u s HIS 97 CO -0.02 -0.31 0.88 0.54 -2.34 0.00 0.00 174.74 173.50 1n6u s ASN 98 N 0.34 6.60 -0.36 9.88 2.20 -1.26 -0.62 114.94 131.72 1n6u s ASN 98 Ca -0.00 0.41 -0.21 0.00 -0.94 0.00 0.00 52.86 52.11 1n6u s ASN 98 Cb -0.04 -2.44 0.00 0.00 -2.00 0.00 0.00 41.25 36.77 1n6u s ASN 98 CO 0.00 -0.86 0.67 -0.36 -2.94 0.00 0.00 177.10 173.61 1n6u s PHE 99 N 3.42 3.14 -0.76 1.54 0.40 -0.92 -4.92 117.98 119.87 1n6u s PHE 99 Ca 0.36 0.38 -0.03 0.00 -0.60 0.00 0.00 56.93 57.04 1n6u s PHE 99 Cb -0.12 -3.20 0.24 0.00 0.51 0.00 0.00 43.02 40.45 1n6u s PHE 99 CO 0.20 -0.66 2.27 0.91 0.70 0.00 0.00 175.22 178.64 1n6u n TRP 100 N 6.13 2.49 -0.18 0.36 8.01 -1.26 0.10 117.44 133.09 1n6u n TRP 100 Ca -0.00 -2.25 -0.05 0.00 -1.31 0.00 0.00 57.50 53.89 1n6u n TRP 100 Cb 0.48 -1.29 -0.04 0.00 -2.01 0.00 0.00 31.31 28.45 1n6u n TRP 100 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 1n6u n LEU 101 N 0.09 -0.46 -0.61 -0.99 4.32 -1.26 0.22 117.00 118.31 1n6u n LEU 101 Ca 0.52 1.28 0.47 0.00 -0.02 0.00 0.00 56.01 58.27 1n6u n LEU 101 Cb 0.34 -0.35 0.75 0.00 -1.62 0.00 0.00 43.42 42.53 1n6u n LEU 101 CO 0.46 -0.88 1.35 0.00 -1.22 0.00 0.00 177.39 177.10 1n6u n ALA 102 N -3.10 1.66 0.17 -1.18 0.00 -0.94 0.12 120.51 117.23 1n6u n ALA 102 Ca 0.01 0.71 0.07 0.00 0.00 0.00 0.00 53.44 54.23 1n6u n ALA 102 Cb 0.11 -1.08 -0.11 0.00 0.00 0.00 0.00 19.45 18.38 1n6u n ALA 102 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1n6u n ILE 103 N -4.13 0.00 -0.08 0.00 -0.00 0.27 -4.77 119.36 110.66 1n6u n ILE 103 Ca 0.42 -0.30 -0.16 0.00 -0.00 0.00 0.00 62.75 62.71 1n6u n ILE 103 Cb 1.81 0.37 -0.05 0.00 -0.00 0.00 0.00 39.64 41.76 1n6u n ILE 103 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1n6u n ASP 104 N -1.85 1.26 -1.30 4.38 2.03 0.61 -4.57 116.55 117.11 1n6u n ASP 104 Ca -0.01 0.22 0.00 0.00 0.52 0.00 0.00 54.79 55.51 1n6u n ASP 104 Cb 0.35 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 40.24 1n6u n ASP 104 CO 0.00 0.00 0.00 0.80 -1.92 0.00 0.00 177.20 176.08 1n6u n MET 105 N -3.81 -0.20 -3.17 -0.67 1.56 0.24 -4.84 117.12 106.23 1n6u n MET 105 Ca -0.30 0.31 -0.40 0.00 -0.27 0.00 0.00 57.70 57.04 1n6u n MET 105 Cb 0.67 -0.31 -0.07 0.00 2.15 0.00 0.00 33.22 35.66 1n6u n MET 105 CO 0.00 0.00 0.00 -1.12 -0.73 0.00 0.00 175.97 174.12 1n6u s SER 106 N -0.23 6.57 -0.34 6.12 0.01 -1.26 -4.87 113.70 119.70 1n6u s SER 106 Ca 0.00 0.69 -0.01 0.00 1.31 0.00 0.00 55.95 57.94 1n6u s SER 106 Cb 0.00 -2.32 0.08 0.00 0.21 0.00 0.00 66.02 63.99 1n6u s SER 106 CO 0.00 -0.29 0.08 -0.36 0.41 0.00 0.00 173.24 173.08 1n6u s PHE 107 N 2.13 3.46 0.15 2.43 0.40 -1.26 0.20 117.98 125.48 1n6u s PHE 107 Ca 0.25 -2.27 0.00 0.00 -0.60 0.00 0.00 56.93 54.32 1n6u s PHE 107 Cb -0.16 -2.63 0.00 0.00 0.51 0.00 0.00 43.02 40.74 1n6u s PHE 107 CO 0.09 -0.89 0.00 0.39 0.70 0.00 0.00 175.22 175.51 1n6u n GLU 108 N 4.55 0.00 -0.32 0.44 1.02 -1.26 -4.82 120.64 120.25 1n6u n GLU 108 Ca -0.07 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.14 1n6u n GLU 108 Cb 0.42 -0.30 0.15 0.00 -0.02 0.00 0.00 31.44 31.69 1n6u n GLU 108 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1n6u n PRO 109 N -3.39 -0.08 -0.77 3.49 -0.02 -1.26 -4.68 135.00 128.29 1n6u n PRO 109 Ca 0.00 1.38 -0.24 0.00 -2.02 0.00 0.00 63.50 62.62 1n6u n PRO 109 Cb 0.00 -2.09 0.01 0.00 -0.02 0.00 0.00 33.50 31.40 1n6u n PRO 109 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1n6u n PRO 110 N -5.42 0.00 -3.39 0.52 -0.02 -1.26 -4.91 135.00 120.51 1n6u n PRO 110 Ca 0.16 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.28 1n6u n PRO 110 Cb 0.50 -0.63 -0.06 0.00 -0.02 0.00 0.00 33.50 33.29 1n6u n PRO 110 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1n6u s GLU 111 N -0.71 3.96 -0.24 -0.52 2.12 -1.02 -4.96 118.70 117.34 1n6u s GLU 111 Ca 0.35 0.46 -0.21 0.00 0.36 0.00 0.00 54.97 55.92 1n6u s GLU 111 Cb -0.29 -2.97 0.06 0.00 0.26 0.00 0.00 34.13 31.19 1n6u s GLU 111 CO 0.43 0.51 0.63 -0.59 -0.54 0.00 0.00 175.26 175.70 1n6u s PHE 112 N -1.41 -0.70 0.19 5.30 -0.12 -1.26 0.19 117.98 120.17 1n6u s PHE 112 Ca 0.36 1.70 -0.03 0.00 -0.05 0.00 0.00 56.93 58.90 1n6u s PHE 112 Cb -0.15 0.25 -0.03 0.00 -0.63 0.00 0.00 43.02 42.46 1n6u s PHE 112 CO 0.19 -0.34 0.18 -1.21 -0.05 0.00 0.00 175.22 173.99 1n6u s GLU 113 N 0.39 1.21 -0.17 1.99 2.02 0.17 -4.96 118.70 119.35 1n6u s GLU 113 Ca -0.00 -1.52 -0.08 0.00 0.02 0.00 0.00 54.97 53.39 1n6u s GLU 113 Cb -0.04 0.30 0.07 0.00 0.10 0.00 0.00 34.13 34.56 1n6u s GLU 113 CO -0.00 -0.41 0.40 0.96 0.02 0.00 0.00 175.26 176.23 1n6u s ILE 114 N -4.11 -0.29 -0.05 -1.63 -4.36 -1.26 -0.24 121.20 109.25 1n6u s ILE 114 Ca 0.33 0.14 0.04 0.00 -0.26 0.00 0.00 60.65 60.90 1n6u s ILE 114 Cb 0.06 -0.61 -0.02 0.00 1.25 0.00 0.00 42.46 43.13 1n6u s ILE 114 CO 0.09 0.06 -0.16 -0.69 0.24 0.00 0.00 174.94 174.48 1n6u s VAL 115 N 1.93 2.90 -0.10 8.37 1.01 0.27 -4.56 120.40 130.21 1n6u s VAL 115 Ca -0.06 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.17 1n6u s VAL 115 Cb -0.10 -2.13 -0.01 0.00 0.00 0.00 0.00 36.38 34.14 1n6u s VAL 115 CO -0.12 0.58 -0.18 -0.83 0.00 0.00 0.00 175.10 174.55 1n6u s GLY 116 N -0.59 1.44 0.25 4.51 0.00 -1.26 0.13 107.32 111.80 1n6u s GLY 116 Ca 0.08 -0.95 0.01 0.00 0.00 0.00 0.00 44.72 43.86 1n6u s GLY 116 CO 0.01 -0.40 0.43 -1.36 0.00 0.00 0.00 173.10 171.78 1n6u s PHE 117 N 0.09 3.48 0.35 1.90 0.40 0.26 -4.37 117.98 120.10 1n6u s PHE 117 Ca -0.08 0.27 0.17 0.00 -0.60 0.00 0.00 56.93 56.69 1n6u s PHE 117 Cb -0.15 -1.81 1.20 0.00 0.51 0.00 0.00 43.02 42.77 1n6u s PHE 117 CO 0.05 0.32 1.63 1.15 0.70 0.00 0.00 175.22 179.07 1n6u h THR 118 N 1.27 0.16 0.00 0.64 2.02 -1.90 -1.95 112.91 113.15 1n6u h THR 118 Ca -0.49 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1n6u h THR 118 Cb 1.21 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 1n6u h THR 118 CO 0.65 0.03 -0.01 -3.20 0.37 0.00 0.00 175.52 173.37 1n6u n ASN 119 N -5.15 1.96 -3.69 4.18 4.05 -1.26 -3.09 115.26 112.26 1n6u n ASN 119 Ca 0.35 -2.18 -0.07 0.00 0.45 0.00 0.00 54.58 53.12 1n6u n ASN 119 Cb 1.12 -0.09 -0.01 0.00 1.23 0.00 0.00 39.78 42.03 1n6u n ASN 119 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 177.26 172.83 1n6u s HIS 120 N -1.33 -0.11 0.07 1.20 -3.43 -0.74 -4.16 115.29 106.80 1n6u s HIS 120 Ca 0.07 -0.39 0.08 0.00 -0.80 0.00 0.00 55.06 54.01 1n6u s HIS 120 Cb 0.06 0.71 -0.04 0.00 -1.43 0.00 0.00 32.58 31.88 1n6u s HIS 120 CO 0.01 -1.29 -0.17 0.42 -2.00 0.00 0.00 174.74 171.70 1n6u s ILE 121 N -3.63 2.86 -0.34 -5.38 1.01 0.14 0.90 121.20 116.77 1n6u s ILE 121 Ca 0.12 -1.29 -0.00 0.00 0.00 0.00 0.00 60.65 59.48 1n6u s ILE 121 Cb -0.06 -2.25 0.11 0.00 0.01 0.00 0.00 42.46 40.27 1n6u s ILE 121 CO 0.08 0.25 0.13 0.20 0.00 0.00 0.00 174.94 175.59 1n6u s ASN 122 N -1.72 3.91 -0.22 3.58 -0.87 0.36 -1.45 114.94 118.53 1n6u s ASN 122 Ca 0.16 -1.85 -0.11 0.00 -1.57 0.00 0.00 52.86 49.49 1n6u s ASN 122 Cb -0.11 -0.87 -0.05 0.00 -0.02 0.00 0.00 41.25 40.20 1n6u s ASN 122 CO 0.07 -0.38 0.18 -0.69 -2.57 0.00 0.00 177.10 173.71 1n6u s VAL 123 N 1.35 5.36 -0.23 1.60 1.01 0.25 0.94 120.40 130.68 1n6u s VAL 123 Ca 0.12 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.36 1n6u s VAL 123 Cb -0.19 -3.52 0.05 0.00 0.00 0.00 0.00 36.38 32.73 1n6u s VAL 123 CO -0.19 0.37 -0.09 -0.32 0.00 0.00 0.00 175.10 174.87 1n6u s MET 124 N 0.82 1.95 -0.36 2.72 1.75 0.66 0.46 119.30 127.31 1n6u s MET 124 Ca 0.09 -1.05 -0.14 0.00 -1.25 0.00 0.00 55.69 53.35 1n6u s MET 124 Cb -0.13 -2.63 -0.01 0.00 2.84 0.00 0.00 34.83 34.91 1n6u s MET 124 CO 0.03 -0.53 0.28 0.08 -0.65 0.00 0.00 175.02 174.23 1n6u s VAL 125 N 1.31 5.25 -1.18 10.11 1.01 -0.67 -0.66 120.40 135.57 1n6u s VAL 125 Ca -0.05 -0.25 -0.18 0.00 0.00 0.00 0.00 61.98 61.50 1n6u s VAL 125 Cb -0.18 -3.79 0.10 0.00 0.00 0.00 0.00 36.38 32.51 1n6u s VAL 125 CO -0.07 -0.10 1.52 -0.54 0.00 0.00 0.00 175.10 175.92 1n6u s LYS 126 N 1.79 3.90 0.35 2.72 3.01 0.50 0.16 119.74 132.17 1n6u s LYS 126 Ca 0.07 -1.97 -0.09 0.00 -1.01 0.00 0.00 55.97 52.98 1n6u s LYS 126 Cb -0.17 -5.29 -0.06 0.00 -1.01 0.00 0.00 37.83 31.29 1n6u s LYS 126 CO 0.11 -2.05 0.68 -0.06 0.51 0.00 0.00 175.35 174.53 1n6u s PHE 127 N 3.43 3.47 1.00 3.18 0.08 0.38 -2.43 117.98 127.08 1n6u s PHE 127 Ca 0.47 0.89 -0.17 0.00 0.12 0.00 0.00 56.93 58.24 1n6u s PHE 127 Cb 0.00 -2.31 0.05 0.00 -0.57 0.00 0.00 43.02 40.19 1n6u s PHE 127 CO 0.00 0.02 -0.24 -0.35 -0.10 0.00 0.00 175.22 174.56 1n6u n PRO 128 N -1.07 -1.35 -0.10 0.24 -0.04 -1.26 0.46 135.00 131.88 1n6u n PRO 128 Ca 0.01 -0.39 0.01 0.00 -0.04 0.00 0.00 63.50 63.09 1n6u n PRO 128 Cb 0.54 -1.39 0.05 0.00 -0.04 0.00 0.00 33.50 32.65 1n6u n PRO 128 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1n6u n SER 129 N 0.06 1.41 -4.80 3.54 7.64 -1.26 0.60 113.62 120.82 1n6u n SER 129 Ca 0.02 -2.10 -0.35 0.00 1.01 0.00 0.00 58.87 57.45 1n6u n SER 129 Cb 0.50 -0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 63.19 1n6u n SER 129 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 1n6u s ILE 130 N -1.33 4.22 -0.44 0.44 -1.16 -1.26 -4.84 121.20 116.83 1n6u s ILE 130 Ca 0.07 1.62 -0.11 0.00 -0.51 0.00 0.00 60.65 61.72 1n6u s ILE 130 Cb 0.05 -3.80 0.09 0.00 0.61 0.00 0.00 42.46 39.41 1n6u s ILE 130 CO 0.02 -0.07 0.31 -0.69 -2.81 0.00 0.00 174.94 171.71 1n6u s VAL 131 N -1.86 4.48 0.65 4.00 1.01 -1.26 -2.90 120.40 124.52 1n6u s VAL 131 Ca 0.56 -1.40 0.07 0.00 0.00 0.00 0.00 61.98 61.21 1n6u s VAL 131 Cb -0.15 -3.76 0.09 0.00 0.00 0.00 0.00 36.38 32.55 1n6u s VAL 131 CO 0.20 -0.58 1.14 -0.08 0.00 0.00 0.00 175.10 175.78 1n6u h GLU 132 N 8.51 0.00 0.00 2.72 4.81 -1.78 0.62 114.58 129.46 1n6u h GLU 132 Ca -0.24 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1n6u h GLU 132 Cb 1.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.47 1n6u h GLU 132 CO 0.81 0.00 0.06 0.39 -0.73 0.00 0.00 179.01 179.54 1n6u n GLU 133 N -2.65 0.02 -0.97 1.92 1.02 -1.22 0.66 120.64 119.42 1n6u n GLU 133 Ca 0.03 0.47 0.05 0.00 -0.02 0.00 0.00 57.16 57.69 1n6u n GLU 133 Cb 1.01 -1.62 0.12 0.00 -0.02 0.00 0.00 31.44 30.93 1n6u n GLU 133 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1n6u n GLU 134 N -1.55 0.87 -2.67 3.49 2.13 0.22 -5.06 120.64 118.07 1n6u n GLU 134 Ca -0.00 -2.69 -0.43 0.00 0.66 0.00 0.00 57.16 54.70 1n6u n GLU 134 Cb 0.07 -0.91 -0.02 0.00 0.27 0.00 0.00 31.44 30.85 1n6u n GLU 134 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1n6u s LEU 135 N -1.79 4.17 0.55 4.31 2.96 0.21 -4.91 118.68 124.18 1n6u s LEU 135 Ca 0.35 1.45 0.37 0.00 -0.22 0.00 0.00 54.13 56.08 1n6u s LEU 135 Cb 0.37 -3.55 1.83 0.00 0.50 0.00 0.00 46.19 45.35 1n6u s LEU 135 CO -0.11 -0.57 2.11 1.56 -1.32 0.00 0.00 176.35 178.02 1n6u h GLN 136 N 7.28 0.00 -5.49 1.98 4.20 -1.97 -3.43 115.11 117.69 1n6u h GLN 136 Ca -0.25 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 57.95 1n6u h GLN 136 Cb 1.10 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.74 1n6u h GLN 136 CO 0.92 0.00 -0.65 0.12 -0.67 0.00 0.00 178.83 178.55 1n6u s PHE 137 N -3.86 2.05 -0.82 2.96 2.19 -1.26 -4.90 117.98 114.34 1n6u s PHE 137 Ca -0.02 -0.74 -0.02 0.00 0.33 0.00 0.00 56.93 56.48 1n6u s PHE 137 Cb 0.11 -1.24 0.21 0.00 -1.31 0.00 0.00 43.02 40.78 1n6u s PHE 137 CO 0.41 0.26 0.69 0.34 1.83 0.00 0.00 175.22 178.76 1n6u s ASP 138 N -3.49 5.82 0.17 6.13 2.15 -1.26 -5.05 116.67 121.12 1n6u s ASP 138 Ca 0.32 -3.48 0.10 0.00 0.43 0.00 0.00 52.55 49.91 1n6u s ASP 138 Cb 0.05 -1.90 -0.04 0.00 -0.30 0.00 0.00 42.92 40.73 1n6u s ASP 138 CO 0.14 -0.24 -0.16 -1.48 -0.17 0.00 0.00 175.17 173.25 1n6u s LEU 139 N -0.99 2.73 0.00 -1.34 0.05 -1.26 -4.77 118.68 113.09 1n6u s LEU 139 Ca 0.25 -0.66 0.01 0.00 0.05 0.00 0.00 54.13 53.77 1n6u s LEU 139 Cb -0.10 -1.48 -0.00 0.00 -2.05 0.00 0.00 46.19 42.56 1n6u s LEU 139 CO -0.10 0.13 0.02 -1.20 -0.55 0.00 0.00 176.35 174.65 1n6u n SER 140 N 0.33 2.43 -4.24 1.48 7.64 0.81 -4.95 113.62 117.12 1n6u n SER 140 Ca -0.13 -2.33 -0.28 0.00 1.01 0.00 0.00 58.87 57.14 1n6u n SER 140 Cb 0.55 0.31 -0.15 0.00 -1.01 0.00 0.00 64.21 63.91 1n6u n SER 140 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1n6u s LEU 141 N 0.00 2.06 -0.28 -3.43 2.96 -1.26 -2.30 118.68 116.43 1n6u s LEU 141 Ca 0.03 -0.41 0.02 0.00 -0.22 0.00 0.00 54.13 53.55 1n6u s LEU 141 Cb 0.00 -1.10 0.07 0.00 0.50 0.00 0.00 46.19 45.67 1n6u s LEU 141 CO 0.02 0.25 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.59 1n6u s VAL 142 N -0.54 1.86 -0.66 1.68 1.01 0.44 -3.74 120.40 120.45 1n6u s VAL 142 Ca 0.08 -1.66 -0.24 0.00 0.00 0.00 0.00 61.98 60.16 1n6u s VAL 142 Cb -0.08 -2.17 0.06 0.00 0.00 0.00 0.00 36.38 34.18 1n6u s VAL 142 CO -0.00 -0.27 1.04 -0.63 0.00 0.00 0.00 175.10 175.24 1n6u s ILE 143 N 1.19 4.19 0.09 2.22 -1.09 0.70 -2.05 121.20 126.46 1n6u s ILE 143 Ca -0.01 -0.05 -0.26 0.00 -2.23 0.00 0.00 60.65 58.10 1n6u s ILE 143 Cb -0.19 -4.71 -0.06 0.00 -1.58 0.00 0.00 42.46 35.91 1n6u s ILE 143 CO -0.08 -1.49 0.80 -1.61 -1.23 0.00 0.00 174.94 171.33 1n6u s GLU 144 N 4.44 4.55 -0.36 2.79 2.02 -1.01 0.12 118.70 131.25 1n6u s GLU 144 Ca 0.27 1.15 -0.02 0.00 0.02 0.00 0.00 54.97 56.39 1n6u s GLU 144 Cb -0.14 -3.33 0.09 0.00 0.10 0.00 0.00 34.13 30.84 1n6u s GLU 144 CO 0.13 0.36 0.12 -2.00 0.02 0.00 0.00 175.26 173.89 1n6u s GLU 145 N -0.39 2.12 -1.04 1.61 -6.30 0.24 -1.67 118.70 113.27 1n6u s GLU 145 Ca 0.39 -1.62 -0.02 0.00 -2.50 0.00 0.00 54.97 51.22 1n6u s GLU 145 Cb -0.22 -3.41 0.31 0.00 0.00 0.00 0.00 34.13 30.81 1n6u s GLU 145 CO 0.25 -0.90 1.62 0.94 0.02 0.00 0.00 175.26 177.19 1n6u n GLN 146 N 4.58 4.87 -3.16 4.30 0.00 -0.75 0.71 117.38 127.92 1n6u n GLN 146 Ca -0.06 -4.62 -0.39 0.00 -0.00 0.00 0.00 57.00 51.94 1n6u n GLN 146 Cb 0.42 -2.48 -0.05 0.00 0.00 0.00 0.00 30.24 28.13 1n6u n GLN 146 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1n6u s SER 147 N -1.65 6.85 -0.46 1.69 1.04 0.94 -0.14 113.70 121.97 1n6u s SER 147 Ca 0.35 1.02 -0.02 0.00 0.48 0.00 0.00 55.95 57.78 1n6u s SER 147 Cb 0.12 -2.36 0.02 0.00 0.10 0.00 0.00 66.02 63.90 1n6u s SER 147 CO -0.01 -0.07 0.07 1.21 0.98 0.00 0.00 173.24 175.42 1n6u n GLU 148 N 3.78 -2.69 0.00 4.02 0.00 -0.03 0.76 120.64 126.47 1n6u n GLU 148 Ca -0.04 0.19 0.00 0.00 0.00 0.00 0.00 57.16 57.31 1n6u n GLU 148 Cb 0.51 -4.73 0.00 0.00 0.00 0.00 0.00 31.44 27.22 1n6u n GLU 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1n6u n GLY 149 N -0.65 0.41 3.57 8.31 0.00 -1.26 -5.01 105.19 110.56 1n6u n GLY 149 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1n6u n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n6u s ILE 150 N -2.00 5.29 -0.25 -0.61 1.09 0.23 -5.06 121.20 119.89 1n6u s ILE 150 Ca 0.00 0.06 -0.13 0.00 -1.10 0.00 0.00 60.65 59.47 1n6u s ILE 150 Cb 0.00 -3.60 -0.04 0.00 -1.06 0.00 0.00 42.46 37.75 1n6u s ILE 150 CO 0.00 0.15 0.30 -0.69 -0.10 0.00 0.00 174.94 174.61 1n6u s VAL 151 N 1.77 5.24 0.25 2.92 1.01 -1.24 -0.04 120.40 130.31 1n6u s VAL 151 Ca 0.07 0.45 0.05 0.00 0.00 0.00 0.00 61.98 62.55 1n6u s VAL 151 Cb -0.16 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 1n6u s VAL 151 CO 0.11 0.23 -0.04 -0.75 0.00 0.00 0.00 175.10 174.65 1n6u s LYS 152 N 1.65 1.43 -0.34 2.72 2.20 0.22 -4.90 119.74 122.72 1n6u s LYS 152 Ca 0.13 -1.72 0.01 0.00 -0.36 0.00 0.00 55.97 54.03 1n6u s LYS 152 Cb -0.15 -0.91 0.11 0.00 -1.51 0.00 0.00 37.83 35.37 1n6u s LYS 152 CO 0.09 -0.01 0.12 -1.59 -0.36 0.00 0.00 175.35 173.60 1n6u s LYS 153 N -3.78 0.98 0.09 4.03 0.00 -1.26 0.83 119.74 120.63 1n6u s LYS 153 Ca 0.28 -1.43 -0.18 0.00 0.00 0.00 0.00 55.97 54.64 1n6u s LYS 153 Cb 0.04 -2.29 -0.07 0.00 0.00 0.00 0.00 37.83 35.52 1n6u s LYS 153 CO 0.10 -1.02 0.57 -1.01 0.00 0.00 0.00 175.35 173.99 1n6u s HIS 154 N 1.21 3.76 -0.46 1.78 3.76 0.33 -4.89 115.29 120.78 1n6u s HIS 154 Ca 0.12 1.23 0.03 0.00 -0.15 0.00 0.00 55.06 56.29 1n6u s HIS 154 Cb -0.19 -2.47 0.16 0.00 1.11 0.00 0.00 32.58 31.18 1n6u s HIS 154 CO -0.17 0.54 0.32 -1.59 -0.85 0.00 0.00 174.74 173.00 1n6u s LYS 155 N -1.33 1.20 1.05 1.40 -2.85 -1.26 0.25 119.74 118.20 1n6u s LYS 155 Ca 0.31 -2.16 -0.17 0.00 -1.00 0.00 0.00 55.97 52.96 1n6u s LYS 155 Cb -0.18 -1.96 0.23 0.00 -2.06 0.00 0.00 37.83 33.86 1n6u s LYS 155 CO 0.19 -1.28 1.22 -1.25 0.10 0.00 0.00 175.35 174.32 1n6u s PRO 156 N 0.05 -0.04 0.93 1.78 0.04 -1.25 -5.01 135.00 131.51 1n6u s PRO 156 Ca 0.25 -0.19 -0.10 0.00 0.04 0.00 0.00 61.00 61.00 1n6u s PRO 156 Cb -0.09 -1.75 0.15 0.00 0.04 0.00 0.00 34.50 32.85 1n6u s PRO 156 CO -0.11 -2.90 1.14 0.39 0.04 0.00 0.00 177.00 175.56 1n6u n GLU 157 N -4.16 -0.51 0.00 4.56 1.02 -1.26 -4.59 120.64 115.70 1n6u n GLU 157 Ca 0.13 -0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1n6u n GLU 157 Cb 0.59 -2.37 0.00 0.00 -0.02 0.00 0.00 31.44 29.64 1n6u n GLU 157 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1n6u n ILE 158 N -4.28 0.00 0.20 -3.67 2.08 -1.26 -4.51 119.36 107.92 1n6u n ILE 158 Ca 0.12 0.00 0.05 0.00 0.56 0.00 0.00 62.75 63.47 1n6u n ILE 158 Cb 0.52 1.67 0.48 0.00 -0.75 0.00 0.00 39.64 41.56 1n6u n ILE 158 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 1n6u h LYS 159 N 0.00 0.07 0.00 0.38 1.57 -1.93 -3.25 116.57 113.41 1n6u h LYS 159 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1n6u h LYS 159 Cb 0.42 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1n6u h LYS 159 CO 0.00 0.22 -0.46 0.41 -0.57 0.00 0.00 179.45 179.05 1n6u n GLY 160 N -1.02 0.35 0.03 3.86 0.00 -1.26 -3.36 105.19 103.78 1n6u n GLY 160 Ca -0.02 -0.02 0.04 0.00 0.00 0.00 0.00 46.02 46.02 1n6u n GLY 160 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1n6u n ASN 161 N -0.02 1.17 -2.09 1.61 4.13 -1.23 -4.46 115.26 114.36 1n6u n ASN 161 Ca 0.00 0.00 -0.23 0.00 1.68 0.00 0.00 54.58 56.03 1n6u n ASN 161 Cb 0.69 1.50 0.04 0.00 -1.54 0.00 0.00 39.78 40.46 1n6u n ASN 161 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1n6u n MET 162 N -2.23 2.11 -1.31 3.52 2.81 -1.24 -3.79 117.12 116.99 1n6u n MET 162 Ca -0.10 -2.12 0.02 0.00 -1.81 0.00 0.00 57.70 53.69 1n6u n MET 162 Cb 0.61 -1.85 0.10 0.00 -0.71 0.00 0.00 33.22 31.36 1n6u n MET 162 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1n6u n SER 163 N 0.08 1.67 0.00 7.83 7.64 -1.14 -4.18 113.62 125.51 1n6u n SER 163 Ca 0.41 -2.91 0.00 0.00 1.01 0.00 0.00 58.87 57.38 1n6u n SER 163 Cb 0.58 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 1n6u n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n6u n GLY 164 N -0.35 0.26 3.16 0.23 0.00 0.20 -4.10 105.19 104.59 1n6u n GLY 164 Ca 0.15 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 1n6u n GLY 164 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1n6u n ASN 165 N 0.00 4.94 -4.43 1.61 0.23 -1.26 0.14 115.26 116.49 1n6u n ASN 165 Ca 0.00 -3.00 -0.51 0.00 -0.53 0.00 0.00 54.58 50.54 1n6u n ASN 165 Cb 0.00 -1.58 -0.04 0.00 -2.08 0.00 0.00 39.78 36.08 1n6u n ASN 165 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 1n6u n PHE 166 N 5.48 -0.16 -3.97 -2.53 -0.00 0.42 -4.70 117.46 112.01 1n6u n PHE 166 Ca 0.42 0.98 -0.29 0.00 -0.00 0.00 0.00 57.45 58.56 1n6u n PHE 166 Cb 0.40 -2.00 -0.16 0.00 -0.00 0.00 0.00 39.48 37.72 1n6u n PHE 166 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 1n6u s THR 167 N -0.74 1.40 0.05 -2.13 2.01 -1.26 -1.68 115.64 113.29 1n6u s THR 167 Ca 0.71 -0.66 0.03 0.00 0.31 0.00 0.00 61.69 62.08 1n6u s THR 167 Cb -1.01 -1.42 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 1n6u s THR 167 CO 0.56 0.31 -0.10 -0.47 -0.69 0.00 0.00 174.62 174.22 1n6u s TYR 168 N 1.54 0.91 -0.19 4.92 6.14 0.17 -5.00 117.35 125.83 1n6u s TYR 168 Ca 0.03 -0.43 -0.01 0.00 0.64 0.00 0.00 57.07 57.29 1n6u s TYR 168 Cb -0.14 -0.53 0.05 0.00 0.42 0.00 0.00 41.96 41.76 1n6u s TYR 168 CO -0.09 -0.02 -0.01 0.42 0.64 0.00 0.00 175.55 176.50 1n6u s ILE 169 N -1.15 0.90 -0.69 3.14 -1.09 -1.26 0.85 121.20 121.89 1n6u s ILE 169 Ca -0.05 -0.70 -0.20 0.00 -2.23 0.00 0.00 60.65 57.47 1n6u s ILE 169 Cb -0.09 -1.25 0.10 0.00 -1.58 0.00 0.00 42.46 39.63 1n6u s ILE 169 CO 0.01 -0.08 0.91 -0.63 -1.23 0.00 0.00 174.94 173.91 1n6u s ILE 170 N 1.70 4.59 0.26 2.92 1.01 -0.53 -4.85 121.20 126.30 1n6u s ILE 170 Ca -0.02 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.84 1n6u s ILE 170 Cb -0.17 -4.64 0.04 0.00 0.01 0.00 0.00 42.46 37.71 1n6u s ILE 170 CO -0.07 -1.35 0.35 -0.90 0.00 0.00 0.00 174.94 172.97 1n6u n ASP 171 N 6.97 0.95 -1.63 3.58 5.68 -1.26 0.26 116.55 131.11 1n6u n ASP 171 Ca -0.00 -1.68 -0.07 0.00 -0.50 0.00 0.00 54.79 52.54 1n6u n ASP 171 Cb 0.45 -0.19 0.03 0.00 -1.14 0.00 0.00 41.12 40.27 1n6u n ASP 171 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1n6u n LYS 172 N -1.55 -2.38 -4.27 0.11 4.76 -1.26 -4.93 118.16 108.63 1n6u n LYS 172 Ca 0.07 0.27 -0.15 0.00 -2.87 0.00 0.00 58.31 55.63 1n6u n LYS 172 Cb 0.27 -3.59 -0.10 0.00 -1.84 0.00 0.00 35.03 29.77 1n6u n LYS 172 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1n6u s LEU 173 N -3.20 2.52 -0.07 -0.35 1.02 -1.26 -5.13 118.68 112.22 1n6u s LEU 173 Ca 0.10 -1.02 0.01 0.00 0.02 0.00 0.00 54.13 53.25 1n6u s LEU 173 Cb -0.05 -0.41 -0.03 0.00 0.02 0.00 0.00 46.19 45.72 1n6u s LEU 173 CO 0.23 -0.30 -0.10 -0.51 0.02 0.00 0.00 176.35 175.69 1n6u s ILE 174 N -3.26 3.46 0.21 -0.59 1.10 -1.26 -4.67 121.20 116.19 1n6u s ILE 174 Ca 0.18 -0.56 -0.10 0.00 -0.51 0.00 0.00 60.65 59.66 1n6u s ILE 174 Cb 0.02 -2.41 -0.07 0.00 0.15 0.00 0.00 42.46 40.15 1n6u s ILE 174 CO 0.02 0.58 0.01 -2.65 -2.11 0.00 0.00 174.94 170.79 1n6u n PRO 175 N 2.43 0.00 -2.10 3.50 -0.02 -1.18 -4.02 135.00 133.62 1n6u n PRO 175 Ca -0.18 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.25 1n6u n PRO 175 Cb 0.53 -0.48 0.02 0.00 -0.02 0.00 0.00 33.50 33.55 1n6u n PRO 175 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1n6u n ASN 176 N 1.16 -3.40 -3.55 2.55 5.15 -1.24 -4.84 115.26 111.10 1n6u n ASN 176 Ca 0.05 -0.23 -0.27 0.00 -0.60 0.00 0.00 54.58 53.53 1n6u n ASN 176 Cb 0.20 -2.03 -0.10 0.00 -0.53 0.00 0.00 39.78 37.33 1n6u n ASN 176 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 1n6u n THR 177 N -2.06 0.60 -2.26 -0.44 -1.04 -1.26 -4.79 114.28 103.04 1n6u n THR 177 Ca -0.03 -4.39 -0.43 0.00 -2.04 0.00 0.00 64.05 57.16 1n6u n THR 177 Cb 0.54 -1.98 -0.02 0.00 -1.82 0.00 0.00 70.33 67.05 1n6u n THR 177 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1n6u s ASN 178 N -1.20 6.19 -0.12 8.00 2.20 -1.26 -4.29 114.94 124.47 1n6u s ASN 178 Ca 0.32 0.89 -0.00 0.00 -0.94 0.00 0.00 52.86 53.12 1n6u s ASN 178 Cb 0.05 -2.54 -0.02 0.00 -2.00 0.00 0.00 41.25 36.75 1n6u s ASN 178 CO -0.14 -1.54 -0.10 -0.72 -2.94 0.00 0.00 177.10 171.66 1n6u s TYR 179 N 5.92 2.87 -0.63 1.54 -0.85 -1.06 -0.85 117.35 124.28 1n6u s TYR 179 Ca 0.65 -0.40 -0.20 0.00 -0.52 0.00 0.00 57.07 56.60 1n6u s TYR 179 Cb -0.15 -1.82 0.09 0.00 0.38 0.00 0.00 41.96 40.45 1n6u s TYR 179 CO 0.32 -0.04 0.83 0.00 -1.52 0.00 0.00 175.55 175.14 1n6u s VAL 181 N 3.29 5.14 0.38 0.00 1.01 0.27 -1.82 120.40 128.68 1n6u s VAL 181 Ca 0.17 1.01 0.06 0.00 0.00 0.00 0.00 61.98 63.21 1n6u s VAL 181 Cb -0.21 -3.85 -0.00 0.00 0.00 0.00 0.00 36.38 32.32 1n6u s VAL 181 CO 0.08 0.27 0.53 -0.55 0.00 0.00 0.00 175.10 175.42 1n6u s SER 182 N 0.82 5.83 -0.47 3.32 0.15 -0.67 -2.64 113.70 120.04 1n6u s SER 182 Ca 0.27 -0.20 0.08 0.00 0.70 0.00 0.00 55.95 56.80 1n6u s SER 182 Cb -0.15 -1.08 0.31 0.00 -1.71 0.00 0.00 66.02 63.39 1n6u s SER 182 CO 0.11 -0.59 0.74 0.52 1.20 0.00 0.00 173.24 175.22 1n6u n VAL 183 N -1.78 0.90 -3.80 4.45 0.31 -1.26 -2.42 118.33 114.74 1n6u n VAL 183 Ca 0.03 -4.80 -0.37 0.00 -0.01 0.00 0.00 64.34 59.19 1n6u n VAL 183 Cb 0.58 -1.21 -0.06 0.00 -0.91 0.00 0.00 33.84 32.24 1n6u n VAL 183 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1n6u s TYR 184 N -2.41 3.62 0.38 3.52 -0.85 -0.87 -4.58 117.35 116.16 1n6u s TYR 184 Ca 0.41 0.61 -0.06 0.00 -0.52 0.00 0.00 57.07 57.51 1n6u s TYR 184 Cb 0.26 -2.01 -0.05 0.00 0.38 0.00 0.00 41.96 40.54 1n6u s TYR 184 CO -0.09 0.71 0.68 -0.48 -1.52 0.00 0.00 175.55 174.84 1n6u s LEU 185 N -1.15 3.88 0.35 -3.49 2.34 -1.26 0.17 118.68 119.53 1n6u s LEU 185 Ca 0.18 0.88 -0.05 0.00 0.06 0.00 0.00 54.13 55.20 1n6u s LEU 185 Cb -0.13 -3.75 0.01 0.00 -0.56 0.00 0.00 46.19 41.76 1n6u s LEU 185 CO 0.08 -0.36 0.55 -1.83 -1.06 0.00 0.00 176.35 173.72 1n6u s GLU 186 N -3.98 1.99 0.00 1.48 1.03 -0.97 -4.37 118.70 113.88 1n6u s GLU 186 Ca 0.47 -1.69 0.00 0.00 0.03 0.00 0.00 54.97 53.78 1n6u s GLU 186 Cb -0.10 0.49 0.00 0.00 -0.80 0.00 0.00 34.13 33.71 1n6u s GLU 186 CO 0.34 -0.85 0.00 -2.39 -1.33 0.00 0.00 175.26 171.03 1n6u n HIS 187 N -0.56 -0.94 -2.51 4.83 1.44 -1.26 -0.14 115.22 116.08 1n6u n HIS 187 Ca -0.01 0.00 -0.00 0.00 -2.01 0.00 0.00 57.72 55.70 1n6u n HIS 187 Cb 0.61 0.30 0.00 0.00 0.12 0.00 0.00 29.99 31.03 1n6u n HIS 187 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1n6u n SER 188 N -2.10 -0.11 -3.53 4.39 2.88 -1.26 -5.00 113.62 108.88 1n6u n SER 188 Ca 0.00 -1.08 -0.15 0.00 -1.33 0.00 0.00 58.87 56.31 1n6u n SER 188 Cb 0.00 0.08 -0.05 0.00 -0.75 0.00 0.00 64.21 63.49 1n6u n SER 188 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1n6u s ASP 189 N -0.05 -0.54 -0.24 -3.46 1.11 -1.26 -5.03 116.67 107.19 1n6u s ASP 189 Ca 0.00 0.35 0.14 0.00 0.18 0.00 0.00 52.55 53.22 1n6u s ASP 189 Cb 0.02 0.52 0.76 0.00 1.07 0.00 0.00 42.92 45.29 1n6u s ASP 189 CO -0.01 -0.72 1.70 1.21 1.18 0.00 0.00 175.17 178.54 1n6u n GLU 190 N 0.48 4.32 -0.00 8.23 2.13 -1.26 -4.12 120.64 130.41 1n6u n GLU 190 Ca -0.18 -3.10 0.05 0.00 0.66 0.00 0.00 57.16 54.58 1n6u n GLU 190 Cb 0.60 -2.18 -0.07 0.00 0.27 0.00 0.00 31.44 30.05 1n6u n GLU 190 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1n6u n GLN 191 N 0.26 1.49 -1.45 5.31 -0.00 -1.26 -4.57 117.38 117.15 1n6u n GLN 191 Ca 0.29 -0.06 -0.28 0.00 -0.00 0.00 0.00 57.00 56.95 1n6u n GLN 191 Cb 1.18 -1.16 -0.02 0.00 -0.00 0.00 0.00 30.24 30.23 1n6u n GLN 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1n6u n ALA 192 N -1.65 6.27 -2.82 2.61 0.00 -1.26 -4.85 120.51 118.82 1n6u n ALA 192 Ca -0.01 -3.01 -0.44 0.00 0.00 0.00 0.00 53.44 49.99 1n6u n ALA 192 Cb 0.24 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 17.69 1n6u n ALA 192 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1n6u n VAL 193 N 0.52 4.27 -1.19 0.00 0.24 -1.26 -4.48 118.33 116.43 1n6u n VAL 193 Ca 0.48 -4.65 -0.35 0.00 -2.04 0.00 0.00 64.34 57.78 1n6u n VAL 193 Cb 0.52 -2.44 -0.02 0.00 -1.47 0.00 0.00 33.84 30.42 1n6u n VAL 193 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1n6u n ILE 194 N 4.39 3.40 -2.49 1.34 -0.00 -1.26 -4.86 119.36 119.88 1n6u n ILE 194 Ca 0.38 -2.22 -0.40 0.00 -0.00 0.00 0.00 62.75 60.51 1n6u n ILE 194 Cb 0.41 -2.44 -0.03 0.00 -0.00 0.00 0.00 39.64 37.58 1n6u n ILE 194 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 1n6u s LYS 195 N 2.96 3.24 1.13 0.38 2.20 -1.26 -3.35 119.74 125.05 1n6u s LYS 195 Ca 0.56 -0.46 -0.13 0.00 -0.36 0.00 0.00 55.97 55.58 1n6u s LYS 195 Cb 0.15 -4.63 0.27 0.00 -1.51 0.00 0.00 37.83 32.10 1n6u s LYS 195 CO -0.04 -2.28 1.04 -1.54 -0.36 0.00 0.00 175.35 172.17 1n6u s SER 196 N 4.72 1.25 -0.49 1.43 1.04 -1.26 -4.77 113.70 115.62 1n6u s SER 196 Ca 0.43 1.51 -0.34 0.00 0.48 0.00 0.00 55.95 58.03 1n6u s SER 196 Cb -0.06 -2.26 -0.13 0.00 0.10 0.00 0.00 66.02 63.67 1n6u s SER 196 CO 0.06 -4.03 2.30 -2.65 0.98 0.00 0.00 173.24 169.91 1n6u n PRO 197 N -4.80 0.78 -1.70 4.02 -0.02 -1.26 -4.69 135.00 127.33 1n6u n PRO 197 Ca 0.04 0.17 -0.58 0.00 -2.02 0.00 0.00 63.50 61.10 1n6u n PRO 197 Cb 0.54 -2.35 -0.07 0.00 -0.02 0.00 0.00 33.50 31.60 1n6u n PRO 197 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1n6u n LEU 198 N 10.63 2.11 -4.61 2.45 7.94 -1.26 -4.93 117.00 129.33 1n6u n LEU 198 Ca 0.46 1.09 -0.39 0.00 -1.11 0.00 0.00 56.01 56.06 1n6u n LEU 198 Cb 0.22 -1.11 -0.09 0.00 0.53 0.00 0.00 43.42 42.97 1n6u n LEU 198 CO 0.79 -0.58 0.11 -0.75 -1.11 0.00 0.00 177.39 175.85 1n6u s LYS 199 N 3.03 4.03 -0.65 1.96 2.20 -1.08 -4.81 119.74 124.42 1n6u s LYS 199 Ca 0.97 0.12 -0.12 0.00 -0.36 0.00 0.00 55.97 56.58 1n6u s LYS 199 Cb -1.11 -3.66 0.17 0.00 -1.51 0.00 0.00 37.83 31.72 1n6u s LYS 199 CO 0.65 -0.30 0.56 0.00 -0.36 0.00 0.00 175.35 175.90 1n6u s THR 201 N 0.76 5.32 0.54 0.00 -1.32 -0.34 -4.73 115.64 115.87 1n6u s THR 201 Ca 0.11 0.25 0.02 0.00 -1.21 0.00 0.00 61.69 60.87 1n6u s THR 201 Cb -0.20 -3.54 0.03 0.00 -1.51 0.00 0.00 72.50 67.28 1n6u s THR 201 CO -0.03 0.30 0.75 -0.22 -2.21 0.00 0.00 174.62 173.20 1n6u s LEU 202 N 1.33 3.32 0.27 9.08 2.96 -1.26 -2.55 118.68 131.83 1n6u s LEU 202 Ca 0.09 -0.11 0.11 0.00 -0.22 0.00 0.00 54.13 54.00 1n6u s LEU 202 Cb -0.14 -2.78 -0.05 0.00 0.50 0.00 0.00 46.19 43.71 1n6u s LEU 202 CO 0.07 -1.11 -0.20 -1.48 -1.32 0.00 0.00 176.35 172.31 1n6u s LEU 203 N -4.71 2.58 -0.33 -0.68 2.34 -1.26 -4.04 118.68 112.58 1n6u s LEU 203 Ca 0.57 -1.02 -0.32 0.00 0.06 0.00 0.00 54.13 53.42 1n6u s LEU 203 Cb -0.10 -1.06 -0.09 0.00 -0.56 0.00 0.00 46.19 44.38 1n6u s LEU 203 CO 0.38 0.02 2.23 -0.81 -1.06 0.00 0.00 176.35 177.11 1n6u n PRO 204 N -0.54 1.34 0.00 1.48 -0.04 -1.26 -3.93 135.00 132.05 1n6u n PRO 204 Ca -0.06 0.34 0.08 0.00 -0.04 0.00 0.00 63.50 63.82 1n6u n PRO 204 Cb 0.60 -2.77 0.46 0.00 -0.04 0.00 0.00 33.50 31.75 1n6u n PRO 204 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1n6u n PRO 205 N 8.46 0.56 -3.04 0.54 -0.04 -1.26 -3.59 135.00 136.63 1n6u n PRO 205 Ca 0.38 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.82 1n6u n PRO 205 Cb 0.32 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 1n6u n PRO 205 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1n6u n GLY 206 N 0.12 -1.25 3.51 0.55 0.00 -1.26 -4.33 105.19 102.52 1n6u n GLY 206 Ca 0.12 0.61 -0.42 0.00 0.00 0.00 0.00 46.02 46.33 1n6u n GLY 206 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n6u s GLN 207 N -2.97 3.20 -0.28 1.61 -0.21 -1.26 -4.92 119.66 114.82 1n6u s GLN 207 Ca 0.04 -0.61 0.02 0.00 0.02 0.00 0.00 55.36 54.83 1n6u s GLN 207 Cb -0.01 -4.31 0.17 0.00 1.00 0.00 0.00 33.01 29.86 1n6u s GLN 207 CO 0.76 -2.00 0.47 -2.00 -2.12 0.00 0.00 175.29 170.40 1n6u s GLU 208 N 4.86 0.45 0.31 2.91 2.12 -1.26 -5.10 118.70 123.00 1n6u s GLU 208 Ca 0.30 0.42 0.00 0.00 0.36 0.00 0.00 54.97 56.05 1n6u s GLU 208 Cb -0.11 -0.10 0.00 0.00 0.26 0.00 0.00 34.13 34.18 1n6u s GLU 208 CO 0.10 -0.90 0.00 0.45 -0.54 0.00 0.00 175.26 174.37 1n6u n SER 209 N 5.38 -8.48 -1.05 -1.70 2.88 -1.26 -4.89 113.62 104.50 1n6u n SER 209 Ca 0.01 1.18 -0.02 0.00 -1.33 0.00 0.00 58.87 58.70 1n6u n SER 209 Cb 0.51 -4.33 0.20 0.00 -0.75 0.00 0.00 64.21 59.84 1n6u n SER 209 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1n6u n GLU 210 N 0.56 1.79 -3.61 -1.46 1.02 -1.26 -5.02 120.64 112.66 1n6u n GLU 210 Ca 0.00 -3.24 -0.01 0.00 -0.02 0.00 0.00 57.16 53.89 1n6u n GLU 210 Cb 0.00 -1.78 -0.01 0.00 -0.02 0.00 0.00 31.44 29.63 1n6u n GLU 210 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1n6u s PHE 211 N -3.26 -0.08 0.00 -0.32 5.36 -1.26 -5.33 117.98 113.09 1n6u s PHE 211 Ca 0.43 -0.00 0.00 0.00 -0.96 0.00 0.00 56.93 56.40 1n6u s PHE 211 Cb 0.40 0.53 0.00 0.00 -0.34 0.00 0.00 43.02 43.61 1n6u s PHE 211 CO -0.02 -0.25 0.00 -1.13 -1.46 0.00 0.00 175.22 172.36