#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n6u n TYR 2 N 0.00 -0.08 -0.04 7.33 9.36 -1.26 -4.96 117.16 127.51 1n6u n TYR 2 Ca 0.00 -0.87 -0.05 0.00 3.32 0.00 0.00 57.90 60.30 1n6u n TYR 2 Cb 0.00 0.28 -0.02 0.00 -0.63 0.00 0.00 39.34 38.97 1n6u n TYR 2 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 1n6u n ASP 3 N -0.07 1.33 -4.81 2.98 8.00 -1.26 -5.01 116.55 117.71 1n6u n ASP 3 Ca -0.09 0.22 -0.36 0.00 0.71 0.00 0.00 54.79 55.26 1n6u n ASP 3 Cb 0.91 -0.57 -0.06 0.00 -0.02 0.00 0.00 41.12 41.38 1n6u n ASP 3 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1n6u s SER 4 N -5.56 7.06 1.15 -2.24 0.15 -1.26 -5.06 113.70 107.95 1n6u s SER 4 Ca -0.16 1.40 -0.17 0.00 0.70 0.00 0.00 55.95 57.71 1n6u s SER 4 Cb 0.02 -2.41 0.17 0.00 -1.71 0.00 0.00 66.02 62.10 1n6u s SER 4 CO 0.24 0.06 0.29 -2.65 1.20 0.00 0.00 173.24 172.39 1n6u n PRO 5 N 0.85 -2.12 -3.51 5.44 -0.02 -1.26 -5.04 135.00 129.35 1n6u n PRO 5 Ca -0.03 -0.60 -0.21 0.00 -2.02 0.00 0.00 63.50 60.63 1n6u n PRO 5 Cb 0.51 -1.79 -0.13 0.00 -0.02 0.00 0.00 33.50 32.07 1n6u n PRO 5 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1n6u s ASP 6 N -2.03 1.96 0.34 2.55 -1.08 -1.26 -5.13 116.67 112.01 1n6u s ASP 6 Ca 0.58 -0.56 0.04 0.00 -0.52 0.00 0.00 52.55 52.08 1n6u s ASP 6 Cb -0.14 0.17 -0.05 0.00 -1.46 0.00 0.00 42.92 41.43 1n6u s ASP 6 CO 0.63 -0.36 0.07 -0.31 0.52 0.00 0.00 175.17 175.72 1n6u s TYR 7 N 2.26 1.90 0.00 -5.34 2.02 -1.26 -5.07 117.35 111.87 1n6u s TYR 7 Ca 0.07 -1.03 0.20 0.00 -0.37 0.00 0.00 57.07 55.94 1n6u s TYR 7 Cb -0.16 -1.25 0.34 0.00 -0.40 0.00 0.00 41.96 40.49 1n6u s TYR 7 CO -0.19 -0.06 1.13 0.25 -1.57 0.00 0.00 175.55 175.10 1n6u n THR 8 N -0.73 0.00 -3.25 -0.71 -2.24 -1.26 -5.08 114.28 101.01 1n6u n THR 8 Ca -0.03 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 1n6u n THR 8 Cb 0.66 0.89 0.00 0.00 -2.10 0.00 0.00 70.33 69.78 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 0.39 0.00 -4.72 3.42 9.92 -1.26 -4.74 116.55 119.55 1n6u n ASP 9 Ca 0.04 -0.49 -0.39 0.00 -0.53 0.00 0.00 54.79 53.43 1n6u n ASP 9 Cb 1.05 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 41.48 1n6u n ASP 9 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 1n6u s GLU 10 N -0.47 4.38 0.50 -1.24 1.03 -1.26 -4.46 118.70 117.18 1n6u s GLU 10 Ca 0.00 0.67 0.33 0.00 0.03 0.00 0.00 54.97 56.00 1n6u s GLU 10 Cb 0.00 -3.43 1.79 0.00 -0.80 0.00 0.00 34.13 31.68 1n6u s GLU 10 CO 0.00 0.13 2.02 1.03 -1.33 0.00 0.00 175.26 177.11 1n6u h SER 11 N 6.65 0.00 -6.30 0.83 0.87 -1.82 -3.44 113.55 110.34 1n6u h SER 11 Ca -0.41 0.00 -0.48 0.00 -1.23 0.00 0.00 61.79 59.66 1n6u h SER 11 Cb 1.19 0.00 -0.27 0.00 -0.44 0.00 0.00 62.40 62.88 1n6u h SER 11 CO 0.75 0.00 -0.71 0.00 -0.53 0.00 0.00 176.83 176.34 1n6u s THR 13 N -2.98 5.25 -0.33 0.00 2.01 -1.05 -4.84 115.64 113.70 1n6u s THR 13 Ca 0.52 -0.01 -0.17 0.00 0.31 0.00 0.00 61.69 62.34 1n6u s THR 13 Cb -0.31 -3.71 -0.01 0.00 0.01 0.00 0.00 72.50 68.48 1n6u s THR 13 CO 0.79 0.03 0.46 -0.36 -0.69 0.00 0.00 174.62 174.84 1n6u s PHE 14 N 1.84 3.20 -0.22 4.92 0.08 -1.25 0.24 117.98 126.79 1n6u s PHE 14 Ca 0.09 0.21 -0.11 0.00 0.12 0.00 0.00 56.93 57.24 1n6u s PHE 14 Cb -0.17 -2.80 -0.05 0.00 -0.57 0.00 0.00 43.02 39.43 1n6u s PHE 14 CO 0.11 -0.45 0.18 0.21 -0.10 0.00 0.00 175.22 175.17 1n6u s LYS 15 N 2.26 4.13 -0.12 0.44 2.47 0.11 -4.81 119.74 124.21 1n6u s LYS 15 Ca 0.17 -0.20 -0.02 0.00 -1.56 0.00 0.00 55.97 54.36 1n6u s LYS 15 Cb -0.16 -3.50 -0.03 0.00 -1.46 0.00 0.00 37.83 32.69 1n6u s LYS 15 CO 0.12 0.14 -0.04 -1.50 0.16 0.00 0.00 175.35 174.22 1n6u s ILE 16 N 0.83 3.86 0.47 5.43 2.07 -1.26 0.20 121.20 132.79 1n6u s ILE 16 Ca 0.09 -0.39 0.03 0.00 -1.41 0.00 0.00 60.65 58.97 1n6u s ILE 16 Cb -0.13 -2.65 0.03 0.00 0.13 0.00 0.00 42.46 39.84 1n6u s ILE 16 CO 0.03 0.54 0.24 -1.20 -1.91 0.00 0.00 174.94 172.64 1n6u n SER 17 N 2.95 2.76 -3.32 4.50 7.64 0.12 -4.49 113.62 123.78 1n6u n SER 17 Ca -0.18 -2.74 -0.11 0.00 1.01 0.00 0.00 58.87 56.85 1n6u n SER 17 Cb 0.53 0.08 -0.06 0.00 -1.01 0.00 0.00 64.21 63.74 1n6u n SER 17 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1n6u s LEU 18 N 0.00 -0.60 -0.32 -3.43 2.96 0.36 -2.74 118.68 114.91 1n6u s LEU 18 Ca 0.18 -0.77 -0.14 0.00 -0.22 0.00 0.00 54.13 53.18 1n6u s LEU 18 Cb -0.01 0.96 -0.02 0.00 0.50 0.00 0.00 46.19 47.62 1n6u s LEU 18 CO 0.12 -0.32 0.31 -0.13 -1.32 0.00 0.00 176.35 175.01 1n6u s ARG 19 N 2.18 3.68 -1.42 1.98 0.52 0.19 -3.73 118.95 122.36 1n6u s ARG 19 Ca 0.12 -0.37 -0.01 0.00 -0.52 0.00 0.00 55.73 54.94 1n6u s ARG 19 Cb -0.13 -3.76 0.01 0.00 0.52 0.00 0.00 34.95 31.60 1n6u s ARG 19 CO -0.22 -0.41 0.46 0.09 0.02 0.00 0.00 175.30 175.24 1n6u n ASN 20 N 5.27 -0.58 -3.68 0.23 3.02 -1.26 0.82 115.26 119.08 1n6u n ASN 20 Ca -0.10 -0.99 -0.28 0.00 -0.03 0.00 0.00 54.58 53.18 1n6u n ASN 20 Cb 0.50 -3.11 0.03 0.00 -0.61 0.00 0.00 39.78 36.59 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 -4.40 -2.21 -4.54 3.10 1.16 -1.26 -4.84 117.46 104.48 1n6u n PHE 21 Ca -0.29 0.78 -0.33 0.00 -1.87 0.00 0.00 57.45 55.74 1n6u n PHE 21 Cb 0.67 -3.92 -0.14 0.00 -1.61 0.00 0.00 39.48 34.49 1n6u n PHE 21 CO 0.00 0.00 0.00 0.50 -1.87 0.00 0.00 176.76 175.39 1n6u s ARG 22 N -6.37 3.48 -0.01 3.97 3.52 0.24 -5.00 118.95 118.78 1n6u s ARG 22 Ca 0.57 -0.62 -0.20 0.00 -0.13 0.00 0.00 55.73 55.35 1n6u s ARG 22 Cb -0.28 -2.78 -0.05 0.00 -1.56 0.00 0.00 34.95 30.28 1n6u s ARG 22 CO 0.70 0.17 0.58 0.45 -0.81 0.00 0.00 175.30 176.39 1n6u s SER 23 N 0.49 6.95 -0.19 -2.12 0.15 -0.74 -0.64 113.70 117.62 1n6u s SER 23 Ca -0.07 1.14 -0.04 0.00 0.70 0.00 0.00 55.95 57.68 1n6u s SER 23 Cb -0.15 -2.35 0.09 0.00 -1.71 0.00 0.00 66.02 61.89 1n6u s SER 23 CO 0.04 0.11 0.21 -0.63 1.20 0.00 0.00 173.24 174.17 1n6u s ILE 24 N -0.22 -0.31 -0.06 6.45 1.01 -1.11 0.20 121.20 127.15 1n6u s ILE 24 Ca 0.30 -0.07 -0.03 0.00 0.00 0.00 0.00 60.65 60.85 1n6u s ILE 24 Cb -0.18 -0.64 -0.04 0.00 0.01 0.00 0.00 42.46 41.61 1n6u s ILE 24 CO 0.17 -0.17 0.10 -1.48 0.00 0.00 0.00 174.94 173.56 1n6u s LEU 25 N 2.32 4.09 0.00 2.97 0.05 0.35 0.15 118.68 128.61 1n6u s LEU 25 Ca 0.06 0.30 0.02 0.00 0.05 0.00 0.00 54.13 54.56 1n6u s LEU 25 Cb -0.15 -2.18 -0.01 0.00 -2.05 0.00 0.00 46.19 41.80 1n6u s LEU 25 CO -0.11 0.34 0.08 -1.54 -0.55 0.00 0.00 176.35 174.57 1n6u n SER 26 N 1.60 1.36 -3.99 1.48 3.41 0.53 0.09 113.62 118.09 1n6u n SER 26 Ca -0.16 -2.42 -0.08 0.00 -0.26 0.00 0.00 58.87 55.94 1n6u n SER 26 Cb 0.54 0.62 -0.10 0.00 -0.26 0.00 0.00 64.21 65.01 1n6u n SER 26 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1n6u s TRP 27 N -2.50 0.32 -0.56 7.33 -2.14 -1.26 0.06 118.94 120.19 1n6u s TRP 27 Ca 0.12 -0.70 0.04 0.00 2.66 0.00 0.00 56.10 58.22 1n6u s TRP 27 Cb 0.01 -0.23 0.15 0.00 -3.10 0.00 0.00 33.47 30.30 1n6u s TRP 27 CO 0.08 -0.33 0.37 -2.00 -2.66 0.00 0.00 176.95 172.40 1n6u s GLU 28 N -2.81 1.87 -0.41 3.25 -6.30 0.65 -4.83 118.70 110.13 1n6u s GLU 28 Ca -0.03 -2.71 -0.10 0.00 -2.50 0.00 0.00 54.97 49.63 1n6u s GLU 28 Cb -0.00 -2.86 0.07 0.00 0.00 0.00 0.00 34.13 31.33 1n6u s GLU 28 CO -0.06 -1.24 0.24 -0.51 0.02 0.00 0.00 175.26 173.72 1n6u s LEU 29 N -0.58 5.03 0.84 2.70 1.43 -1.26 -1.15 118.68 125.69 1n6u s LEU 29 Ca 0.23 -1.38 -0.11 0.00 -1.03 0.00 0.00 54.13 51.84 1n6u s LEU 29 Cb -0.12 -1.99 0.10 0.00 0.03 0.00 0.00 46.19 44.20 1n6u s LEU 29 CO -0.10 -0.50 1.10 -0.54 0.23 0.00 0.00 176.35 176.54 1n6u s LYS 30 N 1.46 1.71 -0.31 1.70 1.02 -1.26 -4.83 119.74 119.23 1n6u s LYS 30 Ca 0.02 1.11 -0.00 0.00 0.02 0.00 0.00 55.97 57.12 1n6u s LYS 30 Cb -0.22 -1.84 0.10 0.00 -0.52 0.00 0.00 37.83 35.35 1n6u s LYS 30 CO 0.03 -2.01 0.09 -0.80 -0.92 0.00 0.00 175.35 171.74 1n6u s ASN 31 N -3.28 4.12 -0.03 2.83 0.02 -1.26 -4.17 114.94 113.16 1n6u s ASN 31 Ca 0.63 -1.69 -0.03 0.00 -1.02 0.00 0.00 52.86 50.75 1n6u s ASN 31 Cb -0.18 -0.98 -0.01 0.00 0.02 0.00 0.00 41.25 40.10 1n6u s ASN 31 CO 0.57 -0.40 -0.05 1.57 0.02 0.00 0.00 177.10 178.80 1n6u n HIS 32 N 4.76 0.14 -0.11 2.20 -0.00 -1.26 -4.87 115.22 116.07 1n6u n HIS 32 Ca -0.01 0.06 -0.21 0.00 0.46 0.00 0.00 57.72 58.01 1n6u n HIS 32 Cb 0.42 -0.28 -0.08 0.00 -0.12 0.00 0.00 29.99 29.94 1n6u n HIS 32 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1n6u n SER 33 N -2.84 1.92 -4.86 0.26 7.64 -1.26 -4.97 113.62 109.50 1n6u n SER 33 Ca -0.02 0.39 -0.33 0.00 1.01 0.00 0.00 58.87 59.91 1n6u n SER 33 Cb 0.08 -0.84 -0.06 0.00 -1.01 0.00 0.00 64.21 62.39 1n6u n SER 33 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1n6u s ILE 34 N -2.54 5.20 -0.37 0.44 -1.09 -1.26 -5.09 121.20 116.49 1n6u s ILE 34 Ca -0.32 -0.22 0.03 0.00 -2.23 0.00 0.00 60.65 57.91 1n6u s ILE 34 Cb 0.09 -3.40 0.11 0.00 -1.58 0.00 0.00 42.46 37.68 1n6u s ILE 34 CO 0.47 0.35 0.10 0.68 -1.23 0.00 0.00 174.94 175.31 1n6u s VAL 35 N -1.26 2.17 0.70 2.92 -7.23 -1.26 -4.63 120.40 111.81 1n6u s VAL 35 Ca 0.25 -2.44 -0.12 0.00 -1.81 0.00 0.00 61.98 57.86 1n6u s VAL 35 Cb -0.12 -2.59 0.02 0.00 0.56 0.00 0.00 36.38 34.25 1n6u s VAL 35 CO 0.16 -0.65 1.07 -2.16 -0.31 0.00 0.00 175.10 173.21 1n6u s PRO 36 N 0.73 2.77 0.08 4.82 0.04 -1.26 -4.73 135.00 137.45 1n6u s PRO 36 Ca 0.12 1.09 -0.00 0.00 0.04 0.00 0.00 61.00 62.24 1n6u s PRO 36 Cb -0.20 -1.96 -0.00 0.00 0.04 0.00 0.00 34.50 32.37 1n6u s PRO 36 CO -0.08 -1.24 -0.01 -2.37 0.04 0.00 0.00 177.00 173.34 1n6u n THR 37 N -3.06 1.06 -3.37 1.26 5.66 -1.26 -4.92 114.28 109.66 1n6u n THR 37 Ca 0.08 0.34 -0.35 0.00 -3.05 0.00 0.00 64.05 61.08 1n6u n THR 37 Cb 0.53 -1.59 -0.06 0.00 -1.55 0.00 0.00 70.33 67.66 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 -2.02 3.58 0.31 1.09 -3.43 -1.25 -4.08 115.29 109.49 1n6u s HIS 38 Ca -0.01 1.03 0.03 0.00 -0.80 0.00 0.00 55.06 55.31 1n6u s HIS 38 Cb 0.00 -2.35 -0.04 0.00 -1.43 0.00 0.00 32.58 28.76 1n6u s HIS 38 CO 0.01 0.40 0.11 0.71 -2.00 0.00 0.00 174.74 173.98 1n6u s TYR 39 N -1.52 1.69 -0.34 0.38 2.02 0.24 -3.41 117.35 116.42 1n6u s TYR 39 Ca 0.39 -1.21 -0.01 0.00 -0.37 0.00 0.00 57.07 55.87 1n6u s TYR 39 Cb -0.14 -1.01 0.12 0.00 -0.40 0.00 0.00 41.96 40.53 1n6u s TYR 39 CO 0.19 -0.32 0.18 0.99 -1.57 0.00 0.00 175.55 175.02 1n6u s THR 40 N -3.52 0.31 -0.39 -0.71 2.01 -0.14 0.20 115.64 113.40 1n6u s THR 40 Ca 0.34 -1.48 -0.28 0.00 0.31 0.00 0.00 61.69 60.58 1n6u s THR 40 Cb 0.06 -1.24 -0.01 0.00 0.01 0.00 0.00 72.50 71.32 1n6u s THR 40 CO 0.15 -0.86 1.69 -0.22 -0.69 0.00 0.00 174.62 174.70 1n6u s LEU 41 N 1.37 3.49 -0.03 4.42 1.98 0.26 -1.28 118.68 128.89 1n6u s LEU 41 Ca 0.14 1.02 0.03 0.00 -2.89 0.00 0.00 54.13 52.44 1n6u s LEU 41 Cb -0.20 -3.38 -0.03 0.00 0.66 0.00 0.00 46.19 43.24 1n6u s LEU 41 CO -0.14 -1.72 -0.10 -0.76 -1.89 0.00 0.00 176.35 171.73 1n6u s LEU 42 N 6.77 2.97 0.03 -0.68 1.43 -0.68 -2.22 118.68 126.30 1n6u s LEU 42 Ca 0.72 -0.16 -0.04 0.00 -1.03 0.00 0.00 54.13 53.63 1n6u s LEU 42 Cb -0.19 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 1n6u s LEU 42 CO 0.31 0.32 0.05 -0.72 0.23 0.00 0.00 176.35 176.54 1n6u s TYR 43 N -0.85 0.26 0.37 0.29 -0.85 -0.84 0.84 117.35 116.56 1n6u s TYR 43 Ca 0.14 -0.58 -0.08 0.00 -0.52 0.00 0.00 57.07 56.03 1n6u s TYR 43 Cb -0.11 -0.19 0.03 0.00 0.38 0.00 0.00 41.96 42.07 1n6u s TYR 43 CO 0.03 -0.32 0.63 -2.37 -1.52 0.00 0.00 175.55 172.00 1n6u n THR 44 N 0.90 0.00 -4.97 -3.49 5.66 0.50 0.58 114.28 113.45 1n6u n THR 44 Ca -0.20 -1.43 -0.32 0.00 -3.05 0.00 0.00 64.05 59.05 1n6u n THR 44 Cb 0.58 1.05 -0.15 0.00 -1.55 0.00 0.00 70.33 70.26 1n6u n THR 44 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1n6u s ILE 45 N -2.50 2.64 0.30 1.09 -4.36 -1.24 0.13 121.20 117.26 1n6u s ILE 45 Ca 0.23 -0.82 0.05 0.00 -0.26 0.00 0.00 60.65 59.85 1n6u s ILE 45 Cb -0.03 -2.06 0.38 0.00 1.25 0.00 0.00 42.46 42.00 1n6u s ILE 45 CO 0.17 0.55 1.45 1.15 0.24 0.00 0.00 174.94 178.49 1n6u n MET 46 N 3.38 -0.07 0.24 0.37 -0.00 -0.68 0.22 117.12 120.58 1n6u n MET 46 Ca -0.18 1.37 0.09 0.00 -0.00 0.00 0.00 57.70 58.97 1n6u n MET 46 Cb 0.53 -2.22 0.59 0.00 -0.00 0.00 0.00 33.22 32.12 1n6u n MET 46 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1n6u h SER 47 N 0.00 0.00 -2.04 3.17 4.64 -1.96 -3.28 113.55 114.08 1n6u h SER 47 Ca 0.60 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 61.39 1n6u h SER 47 Cb 1.31 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 63.00 1n6u h SER 47 CO -0.84 0.18 -1.07 0.29 -0.87 0.00 0.00 176.83 174.51 1n6u n LYS 48 N -3.96 1.22 0.03 4.77 5.02 0.61 -4.93 118.16 120.92 1n6u n LYS 48 Ca -0.02 -3.57 0.05 0.00 -2.02 0.00 0.00 58.31 52.75 1n6u n LYS 48 Cb 0.26 -1.64 0.21 0.00 -0.02 0.00 0.00 35.03 33.85 1n6u n LYS 48 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1n6u n PRO 49 N 0.63 0.03 0.00 1.97 -0.02 0.08 -1.37 135.00 136.31 1n6u n PRO 49 Ca 0.25 0.42 0.15 0.00 -2.02 0.00 0.00 63.50 62.30 1n6u n PRO 49 Cb 0.57 -1.58 0.67 0.00 -0.02 0.00 0.00 33.50 33.15 1n6u n PRO 49 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1n6u n GLU 50 N -1.65 1.16 -2.73 -0.52 1.02 -1.26 -4.16 120.64 112.51 1n6u n GLU 50 Ca 0.01 -0.45 -0.33 0.00 -0.02 0.00 0.00 57.16 56.38 1n6u n GLU 50 Cb 0.08 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.00 1n6u n GLU 50 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1n6u n ASP 51 N -0.53 5.72 -4.78 1.62 -0.08 -0.47 -5.05 116.55 112.98 1n6u n ASP 51 Ca 0.19 -3.70 -0.39 0.00 -1.51 0.00 0.00 54.79 49.38 1n6u n ASP 51 Cb 0.26 -0.80 -0.06 0.00 2.34 0.00 0.00 41.12 42.86 1n6u n ASP 51 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1n6u s LEU 52 N -3.83 4.56 -0.10 -2.67 1.43 -1.25 -4.43 118.68 112.39 1n6u s LEU 52 Ca 0.46 1.66 0.01 0.00 -1.03 0.00 0.00 54.13 55.23 1n6u s LEU 52 Cb 0.27 -3.39 0.02 0.00 0.03 0.00 0.00 46.19 43.11 1n6u s LEU 52 CO -0.16 0.17 -0.13 -0.75 0.23 0.00 0.00 176.35 175.72 1n6u s LYS 53 N -1.29 1.96 -0.81 1.70 2.20 0.20 -4.84 119.74 118.86 1n6u s LYS 53 Ca 0.38 -0.46 -0.26 0.00 -0.36 0.00 0.00 55.97 55.27 1n6u s LYS 53 Cb -0.22 -1.74 0.03 0.00 -1.51 0.00 0.00 37.83 34.38 1n6u s LYS 53 CO 0.26 -0.11 1.40 0.14 -0.36 0.00 0.00 175.35 176.68 1n6u s VAL 54 N 1.13 3.73 0.28 4.02 -7.23 -1.26 -1.99 120.40 119.08 1n6u s VAL 54 Ca -0.04 0.05 -0.29 0.00 -1.81 0.00 0.00 61.98 59.88 1n6u s VAL 54 Cb -0.14 -4.84 -0.14 0.00 0.56 0.00 0.00 36.38 31.82 1n6u s VAL 54 CO -0.03 -1.77 1.13 0.52 -0.31 0.00 0.00 175.10 174.65 1n6u n VAL 55 N 6.64 1.71 -1.67 1.32 0.31 -0.94 -4.77 118.33 120.92 1n6u n VAL 55 Ca 0.14 -0.43 -0.45 0.00 -0.01 0.00 0.00 64.34 63.59 1n6u n VAL 55 Cb 0.50 -1.14 -0.03 0.00 -0.91 0.00 0.00 33.84 32.25 1n6u n VAL 55 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1n6u n LYS 56 N 1.00 2.08 -0.87 5.55 5.02 -1.26 -0.33 118.16 129.34 1n6u n LYS 56 Ca 0.10 0.74 0.00 0.00 -2.02 0.00 0.00 58.31 57.13 1n6u n LYS 56 Cb 0.32 -2.44 0.00 0.00 -0.02 0.00 0.00 35.03 32.89 1n6u n LYS 56 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1n6u n ASN 57 N 2.57 -0.93 -0.34 4.39 2.85 -1.26 -4.78 115.26 117.76 1n6u n ASN 57 Ca 0.13 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.65 1n6u n ASN 57 Cb 0.31 -0.98 0.04 0.00 1.24 0.00 0.00 39.78 40.38 1n6u n ASN 57 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1n6u s ALA 59 N -0.70 3.63 0.00 0.00 0.00 -1.17 0.90 121.76 124.41 1n6u s ALA 59 Ca 0.10 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1n6u s ALA 59 Cb 0.07 -2.29 0.00 0.00 0.00 0.00 0.00 23.12 20.90 1n6u s ALA 59 CO 0.10 0.21 0.00 0.27 0.00 0.00 0.00 175.76 176.34 1n6u n ASN 60 N -1.04 0.00 -4.14 0.00 2.04 0.53 -4.73 115.26 107.92 1n6u n ASN 60 Ca -0.02 0.00 -0.26 0.00 -0.44 0.00 0.00 54.58 53.86 1n6u n ASN 60 Cb 0.54 0.00 -0.16 0.00 -2.53 0.00 0.00 39.78 37.63 1n6u n ASN 60 CO 0.00 0.00 0.00 0.28 -0.44 0.00 0.00 177.26 177.10 1n6u s THR 61 N -0.33 1.41 -1.05 5.53 -1.32 0.11 -4.71 115.64 115.28 1n6u s THR 61 Ca 0.00 -0.73 -0.02 0.00 -1.21 0.00 0.00 61.69 59.73 1n6u s THR 61 Cb 0.00 -1.20 0.27 0.00 -1.51 0.00 0.00 72.50 70.06 1n6u s THR 61 CO 0.00 0.40 2.01 0.35 -2.21 0.00 0.00 174.62 175.17 1n6u n THR 62 N 2.98 5.56 -4.24 5.08 -2.24 -1.26 0.83 114.28 120.99 1n6u n THR 62 Ca -0.17 -5.33 -0.16 0.00 -2.27 0.00 0.00 64.05 56.12 1n6u n THR 62 Cb 0.53 -1.63 -0.09 0.00 -2.10 0.00 0.00 70.33 67.04 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 -3.52 1.54 0.00 -0.78 3.00 -1.26 -4.94 118.95 112.99 1n6u s ARG 63 Ca 0.44 -1.84 0.00 0.00 0.00 0.00 0.00 55.73 54.33 1n6u s ARG 63 Cb 0.22 0.31 0.00 0.00 0.00 0.00 0.00 34.95 35.48 1n6u s ARG 63 CO -0.16 -0.55 0.00 -1.13 0.00 0.00 0.00 175.30 173.46 1n6u n SER 64 N -1.01 0.00 -4.65 0.23 3.41 -1.26 -4.60 113.62 105.73 1n6u n SER 64 Ca 0.05 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.23 1n6u n SER 64 Cb 0.64 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.54 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 -0.36 2.39 0.06 7.33 -0.71 -1.26 -4.41 117.98 121.01 1n6u s PHE 65 Ca 0.00 0.62 -0.02 0.00 -1.04 0.00 0.00 56.93 56.48 1n6u s PHE 65 Cb 0.00 -3.76 -0.04 0.00 -1.21 0.00 0.00 43.02 38.01 1n6u s PHE 65 CO 0.00 -2.71 0.24 0.00 -1.34 0.00 0.00 175.22 171.41 1n6u s ASP 67 N -2.28 5.79 -0.36 0.00 -4.77 -1.26 -0.50 116.67 113.30 1n6u s ASP 67 Ca 0.34 -0.25 -0.03 0.00 -3.30 0.00 0.00 52.55 49.31 1n6u s ASP 67 Cb -0.13 -0.99 0.19 0.00 -1.09 0.00 0.00 42.92 40.90 1n6u s ASP 67 CO 0.24 -0.63 0.92 -1.48 0.70 0.00 0.00 175.17 174.92 1n6u s LEU 68 N -4.31 -0.72 -0.16 2.11 2.34 0.54 -4.79 118.68 113.68 1n6u s LEU 68 Ca 0.50 -0.41 -0.20 0.00 0.06 0.00 0.00 54.13 54.08 1n6u s LEU 68 Cb -0.10 0.93 -0.17 0.00 -0.56 0.00 0.00 46.19 46.29 1n6u s LEU 68 CO 0.33 -0.08 0.32 0.74 -1.06 0.00 0.00 176.35 176.61 1n6u h THR 69 N 3.90 0.98 -0.38 5.48 2.02 -1.91 -1.96 112.91 121.04 1n6u h THR 69 Ca -0.01 -1.94 0.00 0.00 0.77 0.00 0.00 66.41 65.23 1n6u h THR 69 Cb 1.21 2.07 0.00 0.00 -1.74 0.00 0.00 68.15 69.69 1n6u h THR 69 CO -0.02 0.33 0.00 -0.90 0.37 0.00 0.00 175.52 175.30 1n6u n ASP 70 N -4.56 3.74 0.05 4.18 5.68 -1.26 -4.38 116.55 120.01 1n6u n ASP 70 Ca -0.18 -2.51 0.11 0.00 -0.50 0.00 0.00 54.79 51.71 1n6u n ASP 70 Cb 0.48 -0.44 -0.06 0.00 -1.14 0.00 0.00 41.12 39.96 1n6u n ASP 70 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1n6u n GLU 71 N 0.24 0.60 -2.60 0.11 -0.58 -1.26 -4.32 120.64 112.83 1n6u n GLU 71 Ca 0.19 -0.01 -0.24 0.00 -0.42 0.00 0.00 57.16 56.68 1n6u n GLU 71 Cb 0.72 -1.69 -0.00 0.00 -0.57 0.00 0.00 31.44 29.90 1n6u n GLU 71 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 1n6u n TRP 72 N -2.46 3.04 1.04 -0.32 7.02 -1.26 -4.83 117.44 119.66 1n6u n TRP 72 Ca -0.01 -3.22 0.09 0.00 -1.02 0.00 0.00 57.50 53.33 1n6u n TRP 72 Cb 0.55 -0.20 0.50 0.00 -2.42 0.00 0.00 31.31 29.74 1n6u n TRP 72 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 177.69 178.56 1n6u n ARG 73 N -0.35 0.48 -1.51 -0.99 -4.01 -1.26 -3.80 116.66 105.21 1n6u n ARG 73 Ca 0.33 0.03 -0.28 0.00 -1.04 0.00 0.00 57.85 56.88 1n6u n ARG 73 Cb 0.65 -1.50 -0.06 0.00 -3.04 0.00 0.00 32.46 28.50 1n6u n ARG 73 CO 0.00 0.00 0.00 0.43 -3.04 0.00 0.00 177.63 175.02 1n6u n SER 74 N -1.06 6.76 0.07 2.89 7.64 -1.26 -4.65 113.62 124.01 1n6u n SER 74 Ca 0.12 -3.04 0.21 0.00 1.01 0.00 0.00 58.87 57.17 1n6u n SER 74 Cb 0.08 -1.31 0.72 0.00 -1.01 0.00 0.00 64.21 62.69 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 2.19 0.33 -0.28 0.44 1.35 -1.89 0.89 112.91 115.94 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 0.73 0.59 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 1n6u h THR 75 CO 0.96 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.23 1n6u n HIS 76 N -3.65 0.63 -4.44 4.73 1.44 -1.26 -1.25 115.22 111.43 1n6u n HIS 76 Ca 0.08 -0.25 -0.21 0.00 -2.01 0.00 0.00 57.72 55.32 1n6u n HIS 76 Cb 0.69 -0.13 -0.10 0.00 0.12 0.00 0.00 29.99 30.57 1n6u n HIS 76 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1n6u s GLU 77 N -1.66 1.66 -0.78 -1.40 0.41 0.31 -4.95 118.70 112.29 1n6u s GLU 77 Ca 0.22 -1.94 -0.11 0.00 -0.41 0.00 0.00 54.97 52.74 1n6u s GLU 77 Cb 0.14 -0.74 0.21 0.00 -1.78 0.00 0.00 34.13 31.96 1n6u s GLU 77 CO 0.11 -0.25 0.69 0.00 -0.49 0.00 0.00 175.26 175.32 1n6u s ALA 78 N -3.35 3.98 -0.81 5.21 0.00 -1.25 -3.79 121.76 121.74 1n6u s ALA 78 Ca 0.34 -3.34 -0.23 0.00 0.00 0.00 0.00 51.96 48.73 1n6u s ALA 78 Cb 0.08 -3.28 -0.17 0.00 0.00 0.00 0.00 23.12 19.75 1n6u s ALA 78 CO 0.15 -2.23 2.38 0.66 0.00 0.00 0.00 175.76 176.72 1n6u n TYR 79 N 3.76 1.00 -2.11 0.00 4.02 0.12 -1.69 117.16 122.27 1n6u n TYR 79 Ca 0.13 -0.01 -0.42 0.00 -0.01 0.00 0.00 57.90 57.58 1n6u n TYR 79 Cb 0.44 -2.31 -0.03 0.00 -0.02 0.00 0.00 39.34 37.42 1n6u n TYR 79 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1n6u s VAL 80 N 12.62 3.66 0.09 -0.72 -7.23 0.35 -1.79 120.40 127.37 1n6u s VAL 80 Ca 0.99 0.90 0.08 0.00 -1.81 0.00 0.00 61.98 62.14 1n6u s VAL 80 Cb -0.24 -3.58 -0.04 0.00 0.56 0.00 0.00 36.38 33.08 1n6u s VAL 80 CO 0.16 -0.05 -0.18 -0.89 -0.31 0.00 0.00 175.10 173.83 1n6u s THR 81 N 3.45 2.84 -0.34 5.32 2.01 0.63 0.19 115.64 129.75 1n6u s THR 81 Ca 0.68 -1.39 0.01 0.00 0.31 0.00 0.00 61.69 61.30 1n6u s THR 81 Cb -0.32 -2.27 0.10 0.00 0.01 0.00 0.00 72.50 70.03 1n6u s THR 81 CO 0.27 0.18 0.10 -0.69 -0.69 0.00 0.00 174.62 173.79 1n6u s VAL 82 N -1.07 1.35 -0.30 3.82 1.01 0.25 0.55 120.40 125.99 1n6u s VAL 82 Ca 0.17 -1.82 -0.21 0.00 0.00 0.00 0.00 61.98 60.12 1n6u s VAL 82 Cb -0.11 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 1n6u s VAL 82 CO 0.09 -0.68 0.67 -0.22 0.00 0.00 0.00 175.10 174.95 1n6u s LEU 83 N 1.25 4.13 -0.35 3.92 2.96 0.19 -1.69 118.68 129.09 1n6u s LEU 83 Ca 0.11 0.50 -0.03 0.00 -0.22 0.00 0.00 54.13 54.49 1n6u s LEU 83 Cb -0.19 -2.88 0.07 0.00 0.50 0.00 0.00 46.19 43.69 1n6u s LEU 83 CO -0.17 -0.50 0.10 -1.61 -1.32 0.00 0.00 176.35 172.84 1n6u s GLU 84 N 2.68 2.35 -0.12 1.98 2.02 -0.41 -1.68 118.70 125.53 1n6u s GLU 84 Ca 0.27 -1.42 -0.01 0.00 0.02 0.00 0.00 54.97 53.83 1n6u s GLU 84 Cb -0.15 -3.39 -0.02 0.00 0.10 0.00 0.00 34.13 30.66 1n6u s GLU 84 CO 0.12 -0.78 -0.07 0.20 0.02 0.00 0.00 175.26 174.74 1n6u s GLY 85 N 1.50 1.66 -0.14 -1.39 0.00 -1.02 -0.96 107.32 106.97 1n6u s GLY 85 Ca 0.00 -0.86 -0.03 0.00 0.00 0.00 0.00 44.72 43.82 1n6u s GLY 85 CO -0.01 -0.31 -0.02 -1.36 0.00 0.00 0.00 173.10 171.40 1n6u s PHE 86 N -0.04 3.07 -0.74 1.90 0.40 -1.22 -1.55 117.98 119.80 1n6u s PHE 86 Ca -0.00 -0.13 -0.27 0.00 -0.60 0.00 0.00 56.93 55.93 1n6u s PHE 86 Cb -0.14 -1.91 0.03 0.00 0.51 0.00 0.00 43.02 41.51 1n6u s PHE 86 CO 0.03 0.12 1.32 0.45 0.70 0.00 0.00 175.22 177.84 1n6u s SER 87 N -0.00 6.12 0.08 1.36 0.15 0.61 -4.29 113.70 117.72 1n6u s SER 87 Ca 0.02 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.23 1n6u s SER 87 Cb -0.13 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1n6u s SER 87 CO 0.02 -1.86 0.00 0.61 1.20 0.00 0.00 173.24 173.21 1n6u n GLY 88 N 5.45 1.83 0.00 9.45 0.00 -1.26 -2.34 105.19 118.31 1n6u n GLY 88 Ca 0.05 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1n6u n GLY 88 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1n6u n ASN 89 N 6.13 0.47 -4.65 1.61 3.02 -1.26 -4.85 115.26 115.73 1n6u n ASN 89 Ca 0.00 -0.74 -0.29 0.00 -0.03 0.00 0.00 54.58 53.52 1n6u n ASN 89 Cb 0.00 0.50 -0.08 0.00 -0.61 0.00 0.00 39.78 39.58 1n6u n ASN 89 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1n6u s THR 90 N -0.50 3.78 -0.10 3.41 2.01 -0.99 -5.09 115.64 118.16 1n6u s THR 90 Ca 0.00 -1.14 -0.30 0.00 0.31 0.00 0.00 61.69 60.56 1n6u s THR 90 Cb 0.00 -2.81 -0.01 0.00 0.01 0.00 0.00 72.50 69.69 1n6u s THR 90 CO 0.00 0.08 1.04 -0.89 -0.69 0.00 0.00 174.62 174.16 1n6u s THR 91 N -1.35 4.70 -0.02 -0.82 2.01 -1.26 0.23 115.64 119.12 1n6u s THR 91 Ca 0.25 1.98 0.11 0.00 0.31 0.00 0.00 61.69 64.33 1n6u s THR 91 Cb -0.11 -4.27 -0.16 0.00 0.01 0.00 0.00 72.50 67.96 1n6u s THR 91 CO 0.17 -0.00 0.24 -0.11 -0.69 0.00 0.00 174.62 174.22 1n6u n LEU 92 N 5.09 0.01 -3.73 4.42 7.94 -1.01 -4.75 117.00 124.97 1n6u n LEU 92 Ca 0.09 -0.01 -0.03 0.00 -1.11 0.00 0.00 56.01 54.96 1n6u n LEU 92 Cb 0.48 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.42 1n6u n LEU 92 CO 0.52 0.00 0.77 0.72 -1.11 0.00 0.00 177.39 178.30 1n6u s PHE 93 N -2.72 -0.12 -0.38 1.96 -0.71 -0.59 -4.99 117.98 110.42 1n6u s PHE 93 Ca -0.04 -0.15 -0.01 0.00 -1.04 0.00 0.00 56.93 55.68 1n6u s PHE 93 Cb 0.07 0.62 0.24 0.00 -1.21 0.00 0.00 43.02 42.75 1n6u s PHE 93 CO 0.44 -0.74 1.09 -1.13 -1.34 0.00 0.00 175.22 173.55 1n6u n SER 94 N -0.47 -1.82 -4.89 1.98 3.41 -1.26 -2.43 113.62 108.14 1n6u n SER 94 Ca -0.06 -1.92 -0.21 0.00 -0.26 0.00 0.00 58.87 56.42 1n6u n SER 94 Cb 0.61 1.01 -0.03 0.00 -0.26 0.00 0.00 64.21 65.54 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 -3.98 2.13 -0.28 0.00 0.01 -1.25 0.52 113.70 110.85 1n6u s SER 96 Ca 0.38 -1.50 -0.22 0.00 1.31 0.00 0.00 55.95 55.92 1n6u s SER 96 Cb -0.08 0.22 0.11 0.00 0.21 0.00 0.00 66.02 66.48 1n6u s SER 96 CO 0.27 -0.77 0.91 -2.28 0.41 0.00 0.00 173.24 171.78 1n6u s HIS 97 N -3.41 -0.63 -0.87 2.43 5.04 0.19 -4.94 115.29 113.09 1n6u s HIS 97 Ca 0.33 1.45 -0.24 0.00 -1.54 0.00 0.00 55.06 55.05 1n6u s HIS 97 Cb 0.06 0.37 0.05 0.00 0.04 0.00 0.00 32.58 33.11 1n6u s HIS 97 CO 0.15 -0.31 1.30 0.54 -2.34 0.00 0.00 174.74 174.08 1n6u s ASN 98 N 0.61 6.36 -0.24 9.88 2.20 -1.26 -0.27 114.94 132.23 1n6u s ASN 98 Ca -0.01 -1.12 -0.29 0.00 -0.94 0.00 0.00 52.86 50.50 1n6u s ASN 98 Cb -0.05 -2.53 -0.02 0.00 -2.00 0.00 0.00 41.25 36.65 1n6u s ASN 98 CO -0.08 -1.56 1.61 -0.36 -2.94 0.00 0.00 177.10 173.77 1n6u s PHE 99 N 4.87 2.11 -1.13 1.54 0.40 -0.74 -4.85 117.98 120.18 1n6u s PHE 99 Ca 0.38 0.56 -0.13 0.00 -0.60 0.00 0.00 56.93 57.14 1n6u s PHE 99 Cb -0.05 -4.00 0.20 0.00 0.51 0.00 0.00 43.02 39.67 1n6u s PHE 99 CO 0.01 -2.88 1.28 -0.46 0.70 0.00 0.00 175.22 173.87 1n6u s TRP 100 N 5.30 3.67 0.01 0.36 -0.00 -1.26 0.13 118.94 127.15 1n6u s TRP 100 Ca 0.71 -2.19 -0.21 0.00 -0.00 0.00 0.00 56.10 54.42 1n6u s TRP 100 Cb -0.24 -4.16 -0.12 0.00 -0.00 0.00 0.00 33.47 28.95 1n6u s TRP 100 CO 0.29 -1.27 1.06 -0.07 -0.00 0.00 0.00 176.95 176.96 1n6u h LEU 101 N 8.92 -0.64 -1.94 5.86 3.38 -1.83 1.83 115.31 130.90 1n6u h LEU 101 Ca 0.25 0.02 0.49 0.00 0.09 0.00 0.00 57.88 58.74 1n6u h LEU 101 Cb 0.90 0.17 -0.07 0.00 0.09 0.00 0.00 40.66 41.75 1n6u h LEU 101 CO 1.14 -0.36 1.25 0.00 0.09 0.00 0.00 178.44 180.56 1n6u h ALA 102 N -1.46 3.60 0.00 1.53 0.00 -1.34 0.40 119.26 122.00 1n6u h ALA 102 Ca -0.08 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1n6u h ALA 102 Cb 0.58 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1n6u h ALA 102 CO 0.13 -2.12 -1.74 -0.89 0.00 0.00 0.00 179.25 174.63 1n6u n ILE 103 N -3.95 0.16 -0.12 0.00 -0.00 -1.12 -4.78 119.36 109.55 1n6u n ILE 103 Ca 0.38 -0.39 -0.24 0.00 -0.00 0.00 0.00 62.75 62.50 1n6u n ILE 103 Cb 1.77 0.02 -0.08 0.00 -0.00 0.00 0.00 39.64 41.35 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 -2.11 1.82 -1.62 4.38 2.03 0.62 -4.61 116.55 117.06 1n6u n ASP 104 Ca -0.06 0.31 0.00 0.00 0.52 0.00 0.00 54.79 55.56 1n6u n ASP 104 Cb 0.49 -0.75 0.00 0.00 -0.72 0.00 0.00 41.12 40.14 1n6u n ASP 104 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1n6u n MET 105 N -4.20 -0.11 -3.03 -0.67 2.81 0.81 -4.81 117.12 107.92 1n6u n MET 105 Ca -0.43 0.32 -0.43 0.00 -1.81 0.00 0.00 57.70 55.34 1n6u n MET 105 Cb 0.78 -0.41 -0.05 0.00 -0.71 0.00 0.00 33.22 32.83 1n6u n MET 105 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1n6u s SER 106 N -0.42 6.27 0.14 7.83 0.01 -1.26 -4.90 113.70 121.37 1n6u s SER 106 Ca 0.00 -0.69 0.04 0.00 1.31 0.00 0.00 55.95 56.61 1n6u s SER 106 Cb 0.00 -2.35 -0.04 0.00 0.21 0.00 0.00 66.02 63.85 1n6u s SER 106 CO 0.00 -1.02 0.12 -0.36 0.41 0.00 0.00 173.24 172.39 1n6u s PHE 107 N 3.14 3.16 0.00 2.43 0.40 -1.26 0.13 117.98 125.98 1n6u s PHE 107 Ca 0.21 0.01 0.00 0.00 -0.60 0.00 0.00 56.93 56.55 1n6u s PHE 107 Cb -0.17 -1.55 0.00 0.00 0.51 0.00 0.00 43.02 41.82 1n6u s PHE 107 CO 0.15 0.52 0.00 -1.91 0.70 0.00 0.00 175.22 174.68 1n6u n GLU 108 N -0.10 0.00 -0.30 0.44 0.00 -1.24 -4.92 120.64 114.51 1n6u n GLU 108 Ca -0.08 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.20 1n6u n GLU 108 Cb 0.54 0.00 0.27 0.00 0.00 0.00 0.00 31.44 32.25 1n6u n GLU 108 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 1n6u h PRO 109 N 0.00 0.17 -6.07 5.31 0.11 -1.93 -3.43 132.00 126.16 1n6u h PRO 109 Ca 0.00 -0.01 -0.52 0.00 0.11 0.00 0.00 66.00 65.58 1n6u h PRO 109 Cb 0.00 -0.04 0.25 0.00 0.11 0.00 0.00 31.00 31.32 1n6u h PRO 109 CO 0.00 0.11 -2.16 -2.30 -0.21 0.00 0.00 178.00 173.44 1n6u n PRO 110 N -5.27 -0.09 -4.02 1.05 -0.02 -1.26 -4.94 135.00 120.45 1n6u n PRO 110 Ca 0.20 -0.02 -0.23 0.00 -2.02 0.00 0.00 63.50 61.43 1n6u n PRO 110 Cb 0.66 -1.07 -0.06 0.00 -0.02 0.00 0.00 33.50 33.01 1n6u n PRO 110 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1n6u s GLU 111 N -2.15 2.36 -0.30 -0.52 1.03 -1.09 -4.99 118.70 113.05 1n6u s GLU 111 Ca 0.40 -1.62 -0.17 0.00 0.03 0.00 0.00 54.97 53.60 1n6u s GLU 111 Cb -0.05 -2.16 0.21 0.00 -0.80 0.00 0.00 34.13 31.33 1n6u s GLU 111 CO 0.74 0.00 1.29 -0.59 -1.33 0.00 0.00 175.26 175.37 1n6u s PHE 112 N -2.48 -0.06 0.35 4.83 -0.12 -1.26 0.11 117.98 119.36 1n6u s PHE 112 Ca 0.40 0.12 0.04 0.00 -0.05 0.00 0.00 56.93 57.44 1n6u s PHE 112 Cb -0.01 0.09 -0.05 0.00 -0.63 0.00 0.00 43.02 42.42 1n6u s PHE 112 CO 0.23 -0.03 0.07 -1.21 -0.05 0.00 0.00 175.22 174.24 1n6u s GLU 113 N 0.91 1.74 -0.21 1.99 2.02 0.16 -4.96 118.70 120.36 1n6u s GLU 113 Ca -0.06 -2.00 -0.04 0.00 0.02 0.00 0.00 54.97 52.89 1n6u s GLU 113 Cb -0.03 -0.85 0.10 0.00 0.10 0.00 0.00 34.13 33.46 1n6u s GLU 113 CO -0.10 -0.26 0.29 0.96 0.02 0.00 0.00 175.26 176.16 1n6u s ILE 114 N -3.25 -0.44 -0.21 -1.63 -4.36 -1.26 0.19 121.20 110.23 1n6u s ILE 114 Ca 0.32 -0.03 -0.16 0.00 -0.26 0.00 0.00 60.65 60.52 1n6u s ILE 114 Cb 0.07 -0.69 -0.04 0.00 1.25 0.00 0.00 42.46 43.05 1n6u s ILE 114 CO 0.15 -0.12 0.40 -0.69 0.24 0.00 0.00 174.94 174.91 1n6u s VAL 115 N 2.43 5.19 -0.17 8.37 1.01 0.39 -4.70 120.40 132.91 1n6u s VAL 115 Ca 0.08 0.69 -0.06 0.00 0.00 0.00 0.00 61.98 62.68 1n6u s VAL 115 Cb -0.15 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1n6u s VAL 115 CO -0.13 0.23 0.03 -0.83 0.00 0.00 0.00 175.10 174.41 1n6u s GLY 116 N 1.14 1.86 0.05 4.51 0.00 -1.26 0.19 107.32 113.81 1n6u s GLY 116 Ca 0.18 -0.76 -0.06 0.00 0.00 0.00 0.00 44.72 44.09 1n6u s GLY 116 CO 0.08 0.01 0.30 -1.36 0.00 0.00 0.00 173.10 172.13 1n6u s PHE 117 N 0.33 3.54 0.50 1.90 0.40 0.29 -4.69 117.98 120.25 1n6u s PHE 117 Ca 0.01 0.55 0.43 0.00 -0.60 0.00 0.00 56.93 57.32 1n6u s PHE 117 Cb -0.13 -1.98 1.49 0.00 0.51 0.00 0.00 43.02 42.91 1n6u s PHE 117 CO 0.01 0.56 1.37 2.41 0.70 0.00 0.00 175.22 180.26 1n6u n THR 118 N 0.73 0.00 0.00 0.64 -1.04 -1.26 -1.18 114.28 112.17 1n6u n THR 118 Ca -0.08 1.31 0.00 0.00 -2.04 0.00 0.00 64.05 63.24 1n6u n THR 118 Cb 0.52 -2.19 0.00 0.00 -1.82 0.00 0.00 70.33 66.84 1n6u n THR 118 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1n6u n ASN 119 N -3.65 4.88 -4.38 8.00 5.03 -1.26 -3.10 115.26 120.79 1n6u n ASN 119 Ca 0.38 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.54 1n6u n ASN 119 Cb 1.77 0.60 -0.06 0.00 -1.02 0.00 0.00 39.78 41.06 1n6u n ASN 119 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1n6u n HIS 120 N -1.85 0.99 -4.33 3.10 1.44 -0.33 -3.52 115.22 110.72 1n6u n HIS 120 Ca 0.00 -2.31 -0.21 0.00 -2.01 0.00 0.00 57.72 53.19 1n6u n HIS 120 Cb 0.38 -0.28 -0.13 0.00 0.12 0.00 0.00 29.99 30.08 1n6u n HIS 120 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1n6u s ILE 121 N -2.71 1.33 -0.31 0.61 1.01 0.35 0.10 121.20 121.58 1n6u s ILE 121 Ca 0.02 -1.23 0.01 0.00 0.00 0.00 0.00 60.65 59.44 1n6u s ILE 121 Cb 0.00 -1.21 0.10 0.00 0.01 0.00 0.00 42.46 41.35 1n6u s ILE 121 CO 0.01 -0.04 0.07 0.20 0.00 0.00 0.00 174.94 175.18 1n6u s ASN 122 N -1.48 4.25 -0.28 3.58 0.01 0.52 -1.01 114.94 120.53 1n6u s ASN 122 Ca 0.02 -1.76 -0.12 0.00 -0.71 0.00 0.00 52.86 50.30 1n6u s ASN 122 Cb -0.09 -1.15 -0.05 0.00 0.41 0.00 0.00 41.25 40.37 1n6u s ASN 122 CO 0.02 -0.38 0.22 -0.69 -1.51 0.00 0.00 177.10 174.76 1n6u s VAL 123 N 1.35 5.29 -0.25 1.60 1.01 0.37 0.15 120.40 129.91 1n6u s VAL 123 Ca 0.09 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.30 1n6u s VAL 123 Cb -0.18 -3.56 0.04 0.00 0.00 0.00 0.00 36.38 32.68 1n6u s VAL 123 CO -0.17 0.23 -0.09 -0.32 0.00 0.00 0.00 175.10 174.74 1n6u s MET 124 N 1.81 2.59 -0.37 2.72 1.75 0.13 0.54 119.30 128.47 1n6u s MET 124 Ca 0.08 -1.13 -0.14 0.00 -1.25 0.00 0.00 55.69 53.26 1n6u s MET 124 Cb -0.16 -2.91 -0.00 0.00 2.84 0.00 0.00 34.83 34.60 1n6u s MET 124 CO 0.11 -0.46 0.27 0.08 -0.65 0.00 0.00 175.02 174.37 1n6u s VAL 125 N 1.23 5.27 -1.18 10.11 1.01 -0.66 -0.66 120.40 135.51 1n6u s VAL 125 Ca -0.03 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.39 1n6u s VAL 125 Cb -0.18 -3.81 0.10 0.00 0.00 0.00 0.00 36.38 32.49 1n6u s VAL 125 CO -0.06 -0.14 1.55 -0.54 0.00 0.00 0.00 175.10 175.91 1n6u s LYS 126 N 1.73 3.90 0.27 2.72 -0.14 0.31 0.15 119.74 128.68 1n6u s LYS 126 Ca 0.06 -1.94 -0.12 0.00 -1.36 0.00 0.00 55.97 52.61 1n6u s LYS 126 Cb -0.18 -5.33 -0.08 0.00 -1.68 0.00 0.00 37.83 30.56 1n6u s LYS 126 CO 0.10 -2.08 0.63 -0.06 -0.76 0.00 0.00 175.35 173.18 1n6u s PHE 127 N 3.58 3.40 0.83 3.18 0.08 0.50 -2.67 117.98 126.89 1n6u s PHE 127 Ca 0.48 1.02 -0.15 0.00 0.12 0.00 0.00 56.93 58.39 1n6u s PHE 127 Cb 0.01 -2.38 -0.03 0.00 -0.57 0.00 0.00 43.02 40.05 1n6u s PHE 127 CO 0.01 0.19 0.28 -0.35 -0.10 0.00 0.00 175.22 175.24 1n6u n PRO 128 N -0.25 0.03 -2.61 0.24 -0.04 -1.26 -0.29 135.00 130.82 1n6u n PRO 128 Ca 0.02 0.05 -0.42 0.00 -0.04 0.00 0.00 63.50 63.11 1n6u n PRO 128 Cb 0.53 -1.69 -0.03 0.00 -0.04 0.00 0.00 33.50 32.27 1n6u n PRO 128 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1n6u s SER 129 N -1.59 6.23 0.01 3.54 1.04 -1.26 -1.67 113.70 120.00 1n6u s SER 129 Ca 0.58 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.62 1n6u s SER 129 Cb -0.28 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.29 1n6u s SER 129 CO 0.65 -1.69 -0.02 -0.51 0.98 0.00 0.00 173.24 172.65 1n6u s ILE 130 N 5.29 0.13 -0.62 -1.02 -1.16 -1.26 -4.96 121.20 117.60 1n6u s ILE 130 Ca 0.35 -0.41 -0.19 0.00 -0.51 0.00 0.00 60.65 59.89 1n6u s ILE 130 Cb -0.09 -0.18 0.11 0.00 0.61 0.00 0.00 42.46 42.91 1n6u s ILE 130 CO 0.17 -0.18 0.74 0.68 -2.81 0.00 0.00 174.94 173.53 1n6u s VAL 131 N -0.60 4.83 0.58 4.00 -7.23 -1.26 -4.33 120.40 116.39 1n6u s VAL 131 Ca -0.06 -1.07 0.32 0.00 -1.81 0.00 0.00 61.98 59.36 1n6u s VAL 131 Cb -0.04 -4.51 0.47 0.00 0.56 0.00 0.00 36.38 32.85 1n6u s VAL 131 CO -0.00 -1.15 1.33 -1.84 -0.31 0.00 0.00 175.10 173.12 1n6u n GLU 132 N 6.29 0.01 0.05 4.82 -0.00 -1.26 0.46 120.64 131.00 1n6u n GLU 132 Ca -0.07 1.01 0.02 0.00 -0.00 0.00 0.00 57.16 58.13 1n6u n GLU 132 Cb 0.43 -2.47 0.12 0.00 -0.00 0.00 0.00 31.44 29.52 1n6u n GLU 132 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1n6u n GLU 133 N -3.36 0.03 -1.95 3.44 -0.00 -1.26 0.55 120.64 118.09 1n6u n GLU 133 Ca 0.28 0.41 0.00 0.00 -0.00 0.00 0.00 57.16 57.86 1n6u n GLU 133 Cb 1.62 -1.78 0.05 0.00 -0.00 0.00 0.00 31.44 31.33 1n6u n GLU 133 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1n6u n GLU 134 N -1.56 1.09 -2.32 3.44 0.28 0.17 -5.10 120.64 116.65 1n6u n GLU 134 Ca -0.00 -2.87 -0.40 0.00 -0.16 0.00 0.00 57.16 53.73 1n6u n GLU 134 Cb 0.19 -0.94 -0.03 0.00 1.43 0.00 0.00 31.44 32.08 1n6u n GLU 134 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 1n6u s LEU 135 N -2.03 4.48 -0.14 -1.84 2.96 0.19 -4.95 118.68 117.35 1n6u s LEU 135 Ca 0.33 2.45 0.15 0.00 -0.22 0.00 0.00 54.13 56.83 1n6u s LEU 135 Cb 0.36 -3.66 -0.21 0.00 0.50 0.00 0.00 46.19 43.18 1n6u s LEU 135 CO -0.09 -0.34 0.10 1.67 -1.32 0.00 0.00 176.35 176.37 1n6u n GLN 136 N 0.95 1.26 -4.84 1.98 -0.06 -1.26 -4.98 117.38 110.43 1n6u n GLN 136 Ca -0.00 -0.03 -0.31 0.00 -2.00 0.00 0.00 57.00 54.66 1n6u n GLN 136 Cb 0.44 -1.41 -0.14 0.00 -4.06 0.00 0.00 30.24 25.07 1n6u n GLN 136 CO 0.00 0.00 0.00 -0.59 -0.20 0.00 0.00 177.06 176.27 1n6u s PHE 137 N -2.50 2.48 -0.54 3.69 -0.71 -1.26 -4.84 117.98 114.30 1n6u s PHE 137 Ca -0.08 -0.31 0.01 0.00 -1.04 0.00 0.00 56.93 55.51 1n6u s PHE 137 Cb 0.06 -1.47 0.52 0.00 -1.21 0.00 0.00 43.02 40.92 1n6u s PHE 137 CO 0.67 0.17 1.96 -0.25 -1.34 0.00 0.00 175.22 176.43 1n6u n ASP 138 N 1.82 5.75 -4.72 1.98 8.00 -1.26 -4.97 116.55 123.15 1n6u n ASP 138 Ca -0.16 -3.62 -0.42 0.00 0.71 0.00 0.00 54.79 51.29 1n6u n ASP 138 Cb 0.52 -0.91 -0.03 0.00 -0.02 0.00 0.00 41.12 40.68 1n6u n ASP 138 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1n6u s LEU 139 N -3.39 4.38 -0.07 0.64 2.96 -1.26 -4.85 118.68 117.09 1n6u s LEU 139 Ca 0.58 2.28 0.02 0.00 -0.22 0.00 0.00 54.13 56.79 1n6u s LEU 139 Cb 0.47 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 43.55 1n6u s LEU 139 CO 0.04 -0.60 -0.13 -0.44 -1.32 0.00 0.00 176.35 173.91 1n6u s SER 140 N 0.98 4.14 0.23 3.68 0.01 -1.04 -4.89 113.70 116.81 1n6u s SER 140 Ca 0.62 -0.20 -0.15 0.00 1.31 0.00 0.00 55.95 57.54 1n6u s SER 140 Cb -0.35 -1.09 -0.08 0.00 0.21 0.00 0.00 66.02 64.71 1n6u s SER 140 CO 0.31 0.30 0.64 -0.22 0.41 0.00 0.00 173.24 174.69 1n6u s LEU 141 N -0.48 4.23 -0.14 2.44 1.98 -1.26 0.72 118.68 126.18 1n6u s LEU 141 Ca 0.06 1.18 0.02 0.00 -2.89 0.00 0.00 54.13 52.51 1n6u s LEU 141 Cb -0.12 -3.64 0.01 0.00 0.66 0.00 0.00 46.19 43.10 1n6u s LEU 141 CO 0.02 -0.03 -0.22 -0.69 -1.89 0.00 0.00 176.35 173.54 1n6u s VAL 142 N -1.69 2.10 -0.50 1.68 1.01 0.49 -4.33 120.40 119.17 1n6u s VAL 142 Ca 0.45 -0.96 -0.15 0.00 0.00 0.00 0.00 61.98 61.31 1n6u s VAL 142 Cb -0.13 -1.84 0.10 0.00 0.00 0.00 0.00 36.38 34.51 1n6u s VAL 142 CO 0.20 0.55 0.44 0.27 0.00 0.00 0.00 175.10 176.56 1n6u s ILE 143 N 0.82 5.16 -0.44 2.22 -0.00 0.53 -1.74 121.20 127.75 1n6u s ILE 143 Ca -0.07 -1.31 -0.17 0.00 -0.00 0.00 0.00 60.65 59.10 1n6u s ILE 143 Cb -0.15 -4.21 0.03 0.00 -0.00 0.00 0.00 42.46 38.13 1n6u s ILE 143 CO -0.02 -0.73 0.43 -1.61 -0.00 0.00 0.00 174.94 173.01 1n6u s GLU 144 N 1.61 3.06 -0.34 0.37 8.01 -1.05 0.15 118.70 130.50 1n6u s GLU 144 Ca 0.04 -0.89 -0.20 0.00 0.01 0.00 0.00 54.97 53.92 1n6u s GLU 144 Cb -0.27 -4.01 -0.00 0.00 -4.31 0.00 0.00 34.13 25.54 1n6u s GLU 144 CO 0.04 -0.90 0.62 -2.00 0.01 0.00 0.00 175.26 173.04 1n6u s GLU 145 N 2.05 3.73 -0.89 1.61 -6.30 0.20 -1.02 118.70 118.08 1n6u s GLU 145 Ca 0.10 0.09 -0.00 0.00 -2.50 0.00 0.00 54.97 52.66 1n6u s GLU 145 Cb -0.19 -3.79 0.28 0.00 0.00 0.00 0.00 34.13 30.43 1n6u s GLU 145 CO 0.12 -0.69 1.12 0.94 0.02 0.00 0.00 175.26 176.77 1n6u n GLN 146 N 5.98 3.51 -3.24 4.30 0.00 -0.87 0.12 117.38 127.18 1n6u n GLN 146 Ca -0.02 -4.59 -0.39 0.00 -0.00 0.00 0.00 57.00 52.00 1n6u n GLN 146 Cb 0.49 -2.40 -0.06 0.00 0.00 0.00 0.00 30.24 28.27 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 -1.81 6.95 -1.78 1.69 1.04 0.89 -1.05 113.70 119.63 1n6u s SER 147 Ca 0.34 1.14 -0.20 0.00 0.48 0.00 0.00 55.95 57.71 1n6u s SER 147 Cb 0.07 -2.35 0.19 0.00 0.10 0.00 0.00 66.02 64.03 1n6u s SER 147 CO 0.03 0.13 0.66 1.21 0.98 0.00 0.00 173.24 176.24 1n6u n GLU 148 N 2.63 -1.86 -0.59 4.02 0.00 -0.66 0.94 120.64 125.12 1n6u n GLU 148 Ca -0.08 0.25 0.00 0.00 0.00 0.00 0.00 57.16 57.33 1n6u n GLU 148 Cb 0.51 -4.84 0.00 0.00 0.00 0.00 0.00 31.44 27.11 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 -1.29 1.01 3.66 8.31 0.00 -1.26 -5.00 105.19 110.61 1n6u n GLY 149 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1n6u n GLY 149 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1n6u s ILE 150 N -3.28 4.82 -0.01 -0.61 -4.36 0.27 -5.09 121.20 112.93 1n6u s ILE 150 Ca 0.00 -0.03 -0.12 0.00 -0.26 0.00 0.00 60.65 60.24 1n6u s ILE 150 Cb 0.00 -3.15 -0.05 0.00 1.25 0.00 0.00 42.46 40.50 1n6u s ILE 150 CO 0.00 0.49 0.34 0.68 0.24 0.00 0.00 174.94 176.69 1n6u s VAL 151 N 0.14 5.15 -0.03 8.37 -7.23 -1.26 -0.08 120.40 125.46 1n6u s VAL 151 Ca 0.05 0.61 -0.04 0.00 -1.81 0.00 0.00 61.98 60.80 1n6u s VAL 151 Cb -0.12 -3.63 0.01 0.00 0.56 0.00 0.00 36.38 33.20 1n6u s VAL 151 CO 0.01 0.53 0.09 -0.54 -0.31 0.00 0.00 175.10 174.88 1n6u s LYS 152 N -1.24 0.18 -0.53 4.82 -0.14 0.32 -4.93 119.74 118.22 1n6u s LYS 152 Ca 0.24 -0.01 0.00 0.00 -1.36 0.00 0.00 55.97 54.84 1n6u s LYS 152 Cb -0.15 0.08 0.14 0.00 -1.68 0.00 0.00 37.83 36.22 1n6u s LYS 152 CO 0.12 -0.03 0.30 -1.59 -0.76 0.00 0.00 175.35 173.39 1n6u s LYS 153 N -0.29 2.17 -0.22 1.68 0.00 -1.26 0.61 119.74 122.43 1n6u s LYS 153 Ca -0.04 -2.38 -0.20 0.00 0.00 0.00 0.00 55.97 53.35 1n6u s LYS 153 Cb -0.03 -3.52 -0.02 0.00 0.00 0.00 0.00 37.83 34.26 1n6u s LYS 153 CO 0.00 -1.11 0.62 -1.01 0.00 0.00 0.00 175.35 173.85 1n6u s HIS 154 N 0.15 3.34 -0.62 1.78 3.76 0.38 -4.94 115.29 119.15 1n6u s HIS 154 Ca 0.15 0.87 0.05 0.00 -0.15 0.00 0.00 55.06 55.98 1n6u s HIS 154 Cb -0.22 -2.80 0.17 0.00 1.11 0.00 0.00 32.58 30.84 1n6u s HIS 154 CO -0.03 -0.22 0.45 -1.59 -0.85 0.00 0.00 174.74 172.50 1n6u s LYS 155 N 2.09 2.00 1.23 1.40 0.00 -1.26 0.20 119.74 125.39 1n6u s LYS 155 Ca 0.27 -2.97 -0.14 0.00 0.00 0.00 0.00 55.97 53.13 1n6u s LYS 155 Cb -0.16 -2.83 0.31 0.00 0.00 0.00 0.00 37.83 35.16 1n6u s LYS 155 CO 0.10 -1.31 0.96 -2.30 0.00 0.00 0.00 175.35 172.79 1n6u n PRO 156 N 2.24 -2.90 -2.34 1.78 -0.02 -1.26 -4.88 135.00 127.62 1n6u n PRO 156 Ca 0.23 -0.82 -0.40 0.00 -2.02 0.00 0.00 63.50 60.48 1n6u n PRO 156 Cb 0.39 -2.11 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 1n6u n PRO 156 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1n6u s GLU 157 N -4.41 2.96 0.00 -0.52 8.01 -1.26 -4.82 118.70 118.66 1n6u s GLU 157 Ca 0.68 0.08 0.23 0.00 0.01 0.00 0.00 54.97 55.98 1n6u s GLU 157 Cb -0.24 -4.29 1.03 0.00 -4.31 0.00 0.00 34.13 26.31 1n6u s GLU 157 CO 0.65 -2.40 1.71 -0.89 0.01 0.00 0.00 175.26 174.34 1n6u n ILE 158 N 6.74 0.09 -1.18 -1.63 2.08 -1.26 -4.29 119.36 119.91 1n6u n ILE 158 Ca 0.11 -0.22 -0.38 0.00 0.56 0.00 0.00 62.75 62.82 1n6u n ILE 158 Cb 0.50 0.18 -0.08 0.00 -0.75 0.00 0.00 39.64 39.49 1n6u n ILE 158 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1n6u n LYS 159 N -0.08 0.99 0.00 0.38 5.02 -1.26 -2.00 118.16 121.21 1n6u n LYS 159 Ca 0.17 -1.72 0.00 0.00 -2.02 0.00 0.00 58.31 54.74 1n6u n LYS 159 Cb 0.26 -3.05 0.00 0.00 -0.02 0.00 0.00 35.03 32.22 1n6u n LYS 159 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n6u n GLY 160 N 5.03 1.12 0.65 0.72 0.00 -1.26 -4.98 105.19 106.47 1n6u n GLY 160 Ca 0.47 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.62 1n6u n GLY 160 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1n6u n ASN 161 N 0.00 2.17 -3.79 1.61 4.05 -0.84 -4.54 115.26 113.91 1n6u n ASN 161 Ca 0.00 -1.64 -0.42 0.00 0.45 0.00 0.00 54.58 52.98 1n6u n ASN 161 Cb 0.00 0.11 0.01 0.00 1.23 0.00 0.00 39.78 41.13 1n6u n ASN 161 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 177.26 174.44 1n6u n MET 162 N 0.53 5.00 -1.38 1.20 2.81 -1.26 -4.61 117.12 119.42 1n6u n MET 162 Ca 0.14 -4.62 0.02 0.00 -1.81 0.00 0.00 57.70 51.43 1n6u n MET 162 Cb 0.48 -2.48 0.09 0.00 -0.71 0.00 0.00 33.22 30.60 1n6u n MET 162 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1n6u n SER 163 N 0.54 1.68 0.00 7.83 3.41 -1.25 -4.37 113.62 121.46 1n6u n SER 163 Ca 0.38 -2.85 0.00 0.00 -0.26 0.00 0.00 58.87 56.14 1n6u n SER 163 Cb 0.29 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 1n6u n SER 163 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n6u n GLY 164 N -0.32 0.38 3.46 5.00 0.00 0.60 -4.06 105.19 110.25 1n6u n GLY 164 Ca 0.14 -0.58 -0.44 0.00 0.00 0.00 0.00 46.02 45.14 1n6u n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n6u s ASN 165 N -4.00 6.98 0.13 1.61 4.22 -1.26 0.19 114.94 122.80 1n6u s ASN 165 Ca 0.00 -2.80 -0.34 0.00 -2.14 0.00 0.00 52.86 47.58 1n6u s ASN 165 Cb 0.00 -2.39 -0.17 0.00 1.28 0.00 0.00 41.25 39.97 1n6u s ASN 165 CO 0.00 -0.80 1.02 0.33 -2.04 0.00 0.00 177.10 175.61 1n6u n PHE 166 N 5.74 0.77 -4.00 1.54 -0.00 0.40 -4.73 117.46 117.18 1n6u n PHE 166 Ca 0.33 0.84 -0.31 0.00 -0.00 0.00 0.00 57.45 58.31 1n6u n PHE 166 Cb 0.44 -2.17 -0.15 0.00 -0.00 0.00 0.00 39.48 37.60 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 -0.28 2.02 0.09 -2.13 2.01 -1.26 -1.65 115.64 114.45 1n6u s THR 167 Ca 0.77 -1.87 0.10 0.00 0.31 0.00 0.00 61.69 60.99 1n6u s THR 167 Cb -0.98 -2.34 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 1n6u s THR 167 CO 0.54 -0.34 -0.25 -0.47 -0.69 0.00 0.00 174.62 173.41 1n6u s TYR 168 N 1.10 2.18 -0.21 4.92 6.14 0.19 -5.00 117.35 126.67 1n6u s TYR 168 Ca 0.02 -0.39 -0.00 0.00 0.64 0.00 0.00 57.07 57.33 1n6u s TYR 168 Cb -0.19 -1.23 0.06 0.00 0.42 0.00 0.00 41.96 41.01 1n6u s TYR 168 CO -0.08 0.23 -0.04 0.42 0.64 0.00 0.00 175.55 176.72 1n6u s ILE 169 N -0.97 1.27 -0.58 3.14 -1.09 -1.26 0.14 121.20 121.85 1n6u s ILE 169 Ca 0.12 -0.98 -0.22 0.00 -2.23 0.00 0.00 60.65 57.34 1n6u s ILE 169 Cb -0.10 -1.55 0.06 0.00 -1.58 0.00 0.00 42.46 39.29 1n6u s ILE 169 CO 0.04 -0.07 0.85 -0.63 -1.23 0.00 0.00 174.94 173.91 1n6u s ILE 170 N 1.53 4.52 0.00 2.92 1.01 -0.18 -4.85 121.20 126.16 1n6u s ILE 170 Ca -0.04 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.40 1n6u s ILE 170 Cb -0.18 -4.52 0.00 0.00 0.01 0.00 0.00 42.46 37.77 1n6u s ILE 170 CO -0.07 -1.15 0.00 -0.90 0.00 0.00 0.00 174.94 172.82 1n6u n ASP 171 N 7.13 1.22 -2.64 3.58 5.68 -1.26 0.13 116.55 130.38 1n6u n ASP 171 Ca -0.03 -0.49 -0.16 0.00 -0.50 0.00 0.00 54.79 53.62 1n6u n ASP 171 Cb 0.46 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.49 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 -0.19 -5.35 -4.27 0.11 4.76 -1.26 -4.94 118.16 107.02 1n6u n LYS 172 Ca 0.00 0.57 -0.15 0.00 -2.87 0.00 0.00 58.31 55.86 1n6u n LYS 172 Cb 0.00 -4.83 -0.10 0.00 -1.84 0.00 0.00 35.03 28.26 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 -5.29 2.53 -0.11 -0.35 1.02 -1.23 -5.14 118.68 110.11 1n6u s LEU 173 Ca 0.33 -1.00 -0.05 0.00 0.02 0.00 0.00 54.13 53.43 1n6u s LEU 173 Cb -0.15 -0.42 -0.04 0.00 0.02 0.00 0.00 46.19 45.60 1n6u s LEU 173 CO 0.50 -0.29 0.09 -0.63 0.02 0.00 0.00 176.35 176.04 1n6u s ILE 174 N -3.20 5.09 0.67 -0.59 1.01 -1.26 -4.69 121.20 118.23 1n6u s ILE 174 Ca 0.17 0.05 -0.15 0.00 0.00 0.00 0.00 60.65 60.73 1n6u s ILE 174 Cb 0.02 -3.20 -0.13 0.00 0.01 0.00 0.00 42.46 39.16 1n6u s ILE 174 CO 0.02 0.61 -0.45 -2.65 0.00 0.00 0.00 174.94 172.47 1n6u n PRO 175 N 2.08 0.00 -2.43 2.79 -0.02 -1.18 -4.12 135.00 132.13 1n6u n PRO 175 Ca -0.19 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.24 1n6u n PRO 175 Cb 0.54 -0.83 0.02 0.00 -0.02 0.00 0.00 33.50 33.21 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 2.59 -4.83 -3.47 2.55 4.05 -1.25 -4.55 115.26 110.35 1n6u n ASN 176 Ca 0.02 -0.25 -0.28 0.00 0.45 0.00 0.00 54.58 54.51 1n6u n ASN 176 Cb 0.44 -3.22 -0.11 0.00 1.23 0.00 0.00 39.78 38.12 1n6u n ASN 176 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1n6u s THR 177 N -3.13 0.54 -0.42 -0.44 2.01 -1.26 -4.82 115.64 108.13 1n6u s THR 177 Ca 0.15 -2.48 -0.29 0.00 0.31 0.00 0.00 61.69 59.39 1n6u s THR 177 Cb -0.02 -1.39 0.01 0.00 0.01 0.00 0.00 72.50 71.11 1n6u s THR 177 CO 0.41 -1.12 1.47 0.54 -0.69 0.00 0.00 174.62 175.22 1n6u s ASN 178 N 0.27 6.25 -0.11 3.53 4.22 -1.26 -4.22 114.94 123.62 1n6u s ASN 178 Ca 0.27 0.83 -0.01 0.00 -2.14 0.00 0.00 52.86 51.81 1n6u s ASN 178 Cb -0.07 -2.54 -0.03 0.00 1.28 0.00 0.00 41.25 39.90 1n6u s ASN 178 CO -0.12 -1.51 -0.06 -0.72 -2.04 0.00 0.00 177.10 172.66 1n6u s TYR 179 N 5.72 2.98 -0.58 1.54 1.13 -1.07 -1.65 117.35 125.41 1n6u s TYR 179 Ca 0.63 -0.14 -0.19 0.00 -1.41 0.00 0.00 57.07 55.95 1n6u s TYR 179 Cb -0.14 -1.82 0.09 0.00 -1.10 0.00 0.00 41.96 38.99 1n6u s TYR 179 CO 0.32 0.16 0.71 0.00 -2.51 0.00 0.00 175.55 174.23 1n6u s VAL 181 N 2.80 4.92 0.42 0.00 1.01 0.13 -2.06 120.40 127.63 1n6u s VAL 181 Ca 0.13 0.83 -0.01 0.00 0.00 0.00 0.00 61.98 62.93 1n6u s VAL 181 Cb -0.22 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.12 1n6u s VAL 181 CO 0.08 -0.17 0.66 -0.94 0.00 0.00 0.00 175.10 174.72 1n6u s SER 182 N 1.66 6.10 -0.47 3.32 1.04 -0.19 -1.87 113.70 123.30 1n6u s SER 182 Ca 0.25 0.51 0.06 0.00 0.48 0.00 0.00 55.95 57.25 1n6u s SER 182 Cb -0.15 -1.90 0.21 0.00 0.10 0.00 0.00 66.02 64.28 1n6u s SER 182 CO 0.12 -0.52 0.49 0.52 0.98 0.00 0.00 173.24 174.83 1n6u n VAL 183 N -2.02 -0.13 -4.53 5.02 0.31 -1.25 -2.54 118.33 113.18 1n6u n VAL 183 Ca -0.01 -4.09 -0.34 0.00 -0.01 0.00 0.00 64.34 59.88 1n6u n VAL 183 Cb 0.56 -1.90 -0.11 0.00 -0.91 0.00 0.00 33.84 31.49 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 -0.98 3.01 0.61 3.52 -0.85 -0.71 -4.40 117.35 117.54 1n6u s TYR 184 Ca 0.34 0.07 -0.01 0.00 -0.52 0.00 0.00 57.07 56.95 1n6u s TYR 184 Cb 0.09 -1.73 0.05 0.00 0.38 0.00 0.00 41.96 40.76 1n6u s TYR 184 CO -0.13 0.38 0.87 -0.51 -1.52 0.00 0.00 175.55 174.63 1n6u s LEU 185 N -0.89 3.11 0.00 -3.49 1.02 -1.26 0.19 118.68 117.36 1n6u s LEU 185 Ca 0.13 0.09 -0.00 0.00 0.02 0.00 0.00 54.13 54.37 1n6u s LEU 185 Cb -0.11 -2.85 0.00 0.00 0.02 0.00 0.00 46.19 43.25 1n6u s LEU 185 CO 0.02 -1.35 0.37 -1.84 0.02 0.00 0.00 176.35 173.58 1n6u n GLU 186 N -2.56 0.54 0.00 1.70 0.28 0.22 -4.36 120.64 116.46 1n6u n GLU 186 Ca 0.09 -2.34 0.00 0.00 -0.16 0.00 0.00 57.16 54.74 1n6u n GLU 186 Cb 0.60 2.20 0.00 0.00 1.43 0.00 0.00 31.44 35.67 1n6u n GLU 186 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 1n6u n HIS 187 N -0.48 -1.09 0.00 -1.84 -0.00 -1.26 -2.49 115.22 108.06 1n6u n HIS 187 Ca 0.01 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.19 1n6u n HIS 187 Cb 0.48 0.28 0.00 0.00 -0.12 0.00 0.00 29.99 30.63 1n6u n HIS 187 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1n6u n SER 188 N -2.07 0.00 -3.52 0.26 2.88 -1.26 -5.00 113.62 104.91 1n6u n SER 188 Ca 0.00 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.44 1n6u n SER 188 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 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 0.00 -0.40 -0.33 -3.46 1.11 -1.26 -5.03 116.67 107.30 1n6u s ASP 189 Ca 0.00 0.16 0.10 0.00 0.18 0.00 0.00 52.55 52.98 1n6u s ASP 189 Cb 0.00 0.39 0.73 0.00 1.07 0.00 0.00 42.92 45.12 1n6u s ASP 189 CO 0.00 -0.58 1.80 1.21 1.18 0.00 0.00 175.17 178.79 1n6u n GLU 190 N 0.08 3.56 -0.00 8.23 4.07 -1.26 -4.04 120.64 131.27 1n6u n GLU 190 Ca -0.10 -3.09 0.03 0.00 -0.06 0.00 0.00 57.16 53.93 1n6u n GLU 190 Cb 0.61 -2.20 -0.03 0.00 -0.06 0.00 0.00 31.44 29.76 1n6u n GLU 190 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1n6u n GLN 191 N -0.27 4.79 -1.38 5.31 6.02 -1.26 -4.62 117.38 125.97 1n6u n GLN 191 Ca 0.42 -0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 57.13 1n6u n GLN 191 Cb 1.39 -0.79 0.00 0.00 1.02 0.00 0.00 30.24 31.86 1n6u n GLN 191 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1n6u n ALA 192 N -1.17 6.11 -2.93 -1.58 0.00 -1.26 -4.87 120.51 114.81 1n6u n ALA 192 Ca 0.01 -2.91 -0.44 0.00 0.00 0.00 0.00 53.44 50.10 1n6u n ALA 192 Cb 0.09 -1.87 -0.01 0.00 0.00 0.00 0.00 19.45 17.66 1n6u n ALA 192 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1n6u s VAL 193 N -3.03 4.91 -1.47 0.00 -7.23 -1.26 -4.47 120.40 107.85 1n6u s VAL 193 Ca 0.51 -2.28 -0.09 0.00 -1.81 0.00 0.00 61.98 58.31 1n6u s VAL 193 Cb 0.37 -4.88 -0.08 0.00 0.56 0.00 0.00 36.38 32.35 1n6u s VAL 193 CO -0.17 -1.60 2.79 -0.38 -0.31 0.00 0.00 175.10 175.43 1n6u n ILE 194 N 4.95 3.92 -2.09 -0.62 2.08 -1.26 -4.87 119.36 121.47 1n6u n ILE 194 Ca 0.33 -2.33 -0.39 0.00 0.56 0.00 0.00 62.75 60.92 1n6u n ILE 194 Cb 0.45 -2.51 -0.03 0.00 -0.75 0.00 0.00 39.64 36.80 1n6u n ILE 194 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1n6u s LYS 195 N 2.43 2.72 0.77 0.38 2.20 -1.26 -3.76 119.74 123.22 1n6u s LYS 195 Ca 0.63 0.58 -0.11 0.00 -0.36 0.00 0.00 55.97 56.71 1n6u s LYS 195 Cb 0.16 -4.36 0.05 0.00 -1.51 0.00 0.00 37.83 32.18 1n6u s LYS 195 CO -0.05 -2.63 1.09 -1.54 -0.36 0.00 0.00 175.35 171.85 1n6u s SER 196 N 7.60 4.71 -0.62 1.43 1.04 -1.26 -4.86 113.70 121.74 1n6u s SER 196 Ca 0.65 1.36 -0.31 0.00 0.48 0.00 0.00 55.95 58.12 1n6u s SER 196 Cb -0.13 -2.12 -0.14 0.00 0.10 0.00 0.00 66.02 63.73 1n6u s SER 196 CO 0.21 -1.84 2.43 -2.65 0.98 0.00 0.00 173.24 172.37 1n6u n PRO 197 N -3.35 0.66 -0.76 4.02 -0.02 -1.26 -4.55 135.00 129.73 1n6u n PRO 197 Ca 0.07 0.09 -0.26 0.00 -2.02 0.00 0.00 63.50 61.38 1n6u n PRO 197 Cb 0.56 -2.41 0.09 0.00 -0.02 0.00 0.00 33.50 31.72 1n6u n PRO 197 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1n6u n LEU 198 N 11.90 -2.28 -3.98 2.45 4.32 -1.26 -4.95 117.00 123.19 1n6u n LEU 198 Ca 0.49 -0.13 -0.31 0.00 -0.02 0.00 0.00 56.01 56.04 1n6u n LEU 198 Cb 0.25 -0.68 -0.15 0.00 -1.62 0.00 0.00 43.42 41.22 1n6u n LEU 198 CO 0.81 -2.74 -0.42 -0.75 -1.22 0.00 0.00 177.39 173.07 1n6u s LYS 199 N -2.72 1.77 -1.18 3.23 2.20 -0.78 -4.81 119.74 117.45 1n6u s LYS 199 Ca 0.35 -1.20 -0.09 0.00 -0.36 0.00 0.00 55.97 54.67 1n6u s LYS 199 Cb -0.01 -2.73 0.23 0.00 -1.51 0.00 0.00 37.83 33.81 1n6u s LYS 199 CO 0.48 -0.64 1.48 0.00 -0.36 0.00 0.00 175.35 176.31 1n6u s THR 201 N -0.33 5.06 0.43 0.00 -1.32 -0.53 -4.66 115.64 114.30 1n6u s THR 201 Ca 0.37 1.00 0.01 0.00 -1.21 0.00 0.00 61.69 61.86 1n6u s THR 201 Cb 0.00 -3.87 -0.01 0.00 -1.51 0.00 0.00 72.50 67.12 1n6u s THR 201 CO 0.01 0.12 0.63 -0.22 -2.21 0.00 0.00 174.62 172.95 1n6u s LEU 202 N 2.01 3.71 0.24 9.08 2.96 -1.26 -2.60 118.68 132.82 1n6u s LEU 202 Ca 0.24 0.22 0.08 0.00 -0.22 0.00 0.00 54.13 54.46 1n6u s LEU 202 Cb -0.16 -3.11 -0.04 0.00 0.50 0.00 0.00 46.19 43.39 1n6u s LEU 202 CO 0.09 -0.64 0.05 -0.76 -1.32 0.00 0.00 176.35 173.77 1n6u s LEU 203 N -4.49 3.39 -0.59 -0.68 2.01 -1.26 -4.58 118.68 112.48 1n6u s LEU 203 Ca 0.47 -0.49 -0.29 0.00 0.01 0.00 0.00 54.13 53.84 1n6u s LEU 203 Cb -0.10 -1.94 -0.12 0.00 0.01 0.00 0.00 46.19 44.05 1n6u s LEU 203 CO 0.37 0.01 2.45 -0.81 1.01 0.00 0.00 176.35 179.37 1n6u n PRO 204 N -0.81 0.82 -1.88 1.29 -0.04 -1.26 -3.92 135.00 129.20 1n6u n PRO 204 Ca -0.07 0.07 -0.41 0.00 -0.04 0.00 0.00 63.50 63.05 1n6u n PRO 204 Cb 0.58 -2.77 -0.03 0.00 -0.04 0.00 0.00 33.50 31.24 1n6u n PRO 204 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1n6u s PRO 205 N 8.05 2.93 0.50 0.54 0.04 -1.26 -3.88 135.00 141.92 1n6u s PRO 205 Ca 1.10 1.32 -0.23 0.00 0.04 0.00 0.00 61.00 63.23 1n6u s PRO 205 Cb -0.58 -4.33 -0.07 0.00 0.04 0.00 0.00 34.50 29.56 1n6u s PRO 205 CO 0.36 -2.34 1.30 0.41 0.04 0.00 0.00 177.00 176.78 1n6u n GLY 206 N 5.64 0.62 3.79 0.56 0.00 -1.26 -4.79 105.19 109.74 1n6u n GLY 206 Ca 0.26 0.08 -0.01 0.00 0.00 0.00 0.00 46.02 46.34 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 -2.61 0.91 0.16 1.61 -1.52 -1.26 -4.87 119.66 112.08 1n6u s GLN 207 Ca 0.67 -0.55 -0.09 0.00 -1.95 0.00 0.00 55.36 53.45 1n6u s GLN 207 Cb -0.45 0.28 -0.01 0.00 -0.22 0.00 0.00 33.01 32.62 1n6u s GLN 207 CO 0.53 -0.42 0.28 -1.21 -0.25 0.00 0.00 175.29 174.22 1n6u s GLU 208 N -2.53 1.14 -0.06 2.91 2.02 -1.26 -5.11 118.70 115.82 1n6u s GLU 208 Ca 0.18 -1.15 -0.07 0.00 0.02 0.00 0.00 54.97 53.94 1n6u s GLU 208 Cb 0.00 0.38 -0.02 0.00 0.10 0.00 0.00 34.13 34.58 1n6u s GLU 208 CO 0.01 -0.42 -0.14 0.43 0.02 0.00 0.00 175.26 175.16 1n6u n SER 209 N -0.21 0.99 -3.38 -0.19 7.64 -1.26 -5.05 113.62 112.17 1n6u n SER 209 Ca -0.08 0.16 -0.02 0.00 1.01 0.00 0.00 58.87 59.94 1n6u n SER 209 Cb 0.63 -0.51 -0.04 0.00 -1.01 0.00 0.00 64.21 63.27 1n6u n SER 209 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1n6u s GLU 210 N -1.96 0.49 0.50 1.43 2.02 -1.26 -5.13 118.70 114.78 1n6u s GLU 210 Ca -0.12 1.01 0.00 0.00 0.02 0.00 0.00 54.97 55.88 1n6u s GLU 210 Cb 0.02 0.36 0.00 0.00 0.10 0.00 0.00 34.13 34.61 1n6u s GLU 210 CO 0.18 -0.48 0.00 1.19 0.02 0.00 0.00 175.26 176.17 1n6u n PHE 211 N 5.41 -3.70 0.80 1.61 3.01 -1.26 -5.34 117.46 117.99 1n6u n PHE 211 Ca -0.05 1.96 0.10 0.00 1.01 0.00 0.00 57.45 60.46 1n6u n PHE 211 Cb 0.50 -3.37 0.08 0.00 -0.01 0.00 0.00 39.48 36.69 1n6u n PHE 211 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64