#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n6u s TYR 2 N 0.00 -0.88 -0.82 7.33 2.02 -1.26 -4.97 117.35 118.78 1n6u s TYR 2 Ca 0.00 0.61 -0.02 0.00 -0.37 0.00 0.00 57.07 57.29 1n6u s TYR 2 Cb 0.00 -0.06 -0.03 0.00 -0.40 0.00 0.00 41.96 41.47 1n6u s TYR 2 CO 0.00 -0.82 0.74 -3.47 -1.57 0.00 0.00 175.55 170.43 1n6u n ASP 3 N 5.36 -7.06 -0.04 2.29 2.03 -1.26 -5.00 116.55 112.87 1n6u n ASP 3 Ca -0.02 -0.31 -0.00 0.00 0.52 0.00 0.00 54.79 54.98 1n6u n ASP 3 Cb 0.50 -5.04 -0.00 0.00 -0.72 0.00 0.00 41.12 35.86 1n6u n ASP 3 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1n6u h SER 4 N -0.14 0.00 0.00 1.67 0.02 -2.07 -3.38 113.55 109.64 1n6u h SER 4 Ca -0.23 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.19 1n6u h SER 4 Cb 1.12 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.68 1n6u h SER 4 CO 0.34 0.41 3.11 -0.81 -1.14 0.00 0.00 176.83 178.74 1n6u n PRO 5 N -4.25 2.72 -2.70 3.45 -0.04 -1.26 -4.38 135.00 128.54 1n6u n PRO 5 Ca -0.00 -1.85 -0.04 0.00 -0.04 0.00 0.00 63.50 61.56 1n6u n PRO 5 Cb 0.00 -2.68 0.04 0.00 -0.04 0.00 0.00 33.50 30.82 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 4.34 -2.16 0.01 3.54 -0.08 -1.26 -4.99 116.55 115.95 1n6u n ASP 6 Ca 0.59 -1.89 0.00 0.00 -1.51 0.00 0.00 54.79 51.98 1n6u n ASP 6 Cb 0.21 1.14 0.00 0.00 2.34 0.00 0.00 41.12 44.81 1n6u n ASP 6 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 1n6u n TYR 7 N 2.42 -2.62 -4.50 -0.67 4.01 -1.26 -5.06 117.16 109.48 1n6u n TYR 7 Ca 0.12 0.09 -0.29 0.00 -0.16 0.00 0.00 57.90 57.66 1n6u n TYR 7 Cb 0.63 0.70 -0.08 0.00 -0.31 0.00 0.00 39.34 40.28 1n6u n TYR 7 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1n6u s THR 8 N -2.00 1.72 0.00 -0.72 -4.23 -1.26 -4.93 115.64 104.22 1n6u s THR 8 Ca 0.00 -1.89 0.00 0.00 -1.18 0.00 0.00 61.69 58.62 1n6u s THR 8 Cb 0.00 -2.61 0.00 0.00 1.34 0.00 0.00 72.50 71.23 1n6u s THR 8 CO 0.00 0.00 0.00 0.47 -0.54 0.00 0.00 174.62 174.55 1n6u n ASP 9 N -1.21 -5.90 -4.38 3.99 9.92 -1.26 -4.57 116.55 113.14 1n6u n ASP 9 Ca -0.09 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.75 1n6u n ASP 9 Cb 0.66 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 41.04 1n6u n ASP 9 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1n6u s GLU 10 N 0.00 2.85 0.57 -1.24 2.02 -1.23 -3.25 118.70 118.42 1n6u s GLU 10 Ca 0.00 -1.16 0.38 0.00 0.02 0.00 0.00 54.97 54.21 1n6u s GLU 10 Cb 0.00 -3.86 1.92 0.00 0.10 0.00 0.00 34.13 32.30 1n6u s GLU 10 CO 0.00 -0.79 2.14 0.77 0.02 0.00 0.00 175.26 177.40 1n6u h SER 11 N 8.53 0.00 -5.61 -0.19 0.02 -1.68 -3.44 113.55 111.17 1n6u h SER 11 Ca -0.26 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.37 1n6u h SER 11 Cb 1.11 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.45 1n6u h SER 11 CO 0.72 0.00 -0.46 0.00 -1.14 0.00 0.00 176.83 175.95 1n6u s THR 13 N -2.38 5.28 -0.32 0.00 2.01 -1.05 -4.80 115.64 114.39 1n6u s THR 13 Ca 0.43 0.17 -0.17 0.00 0.31 0.00 0.00 61.69 62.43 1n6u s THR 13 Cb -0.25 -3.59 -0.02 0.00 0.01 0.00 0.00 72.50 68.66 1n6u s THR 13 CO 0.52 0.19 0.44 -0.36 -0.69 0.00 0.00 174.62 174.73 1n6u s PHE 14 N 1.81 3.21 -0.26 4.92 0.08 -1.25 0.21 117.98 126.69 1n6u s PHE 14 Ca 0.08 0.25 -0.11 0.00 0.12 0.00 0.00 56.93 57.27 1n6u s PHE 14 Cb -0.16 -2.75 -0.05 0.00 -0.57 0.00 0.00 43.02 39.49 1n6u s PHE 14 CO 0.11 -0.41 0.20 0.21 -0.10 0.00 0.00 175.22 175.23 1n6u s LYS 15 N 2.22 4.00 -0.15 0.44 2.47 0.91 -4.80 119.74 124.82 1n6u s LYS 15 Ca 0.16 -0.26 -0.04 0.00 -1.56 0.00 0.00 55.97 54.27 1n6u s LYS 15 Cb -0.16 -3.62 -0.03 0.00 -1.46 0.00 0.00 37.83 32.56 1n6u s LYS 15 CO 0.12 -0.11 -0.01 -1.50 0.16 0.00 0.00 175.35 174.01 1n6u s ILE 16 N 1.55 4.17 0.20 5.43 2.07 -1.26 0.20 121.20 133.56 1n6u s ILE 16 Ca 0.08 -0.26 0.02 0.00 -1.41 0.00 0.00 60.65 59.07 1n6u s ILE 16 Cb -0.15 -2.83 0.02 0.00 0.13 0.00 0.00 42.46 39.62 1n6u s ILE 16 CO 0.09 0.50 0.13 -1.20 -1.91 0.00 0.00 174.94 172.54 1n6u n SER 17 N 3.37 1.79 -3.26 4.50 7.64 0.11 -4.74 113.62 123.03 1n6u n SER 17 Ca -0.17 -1.72 -0.05 0.00 1.01 0.00 0.00 58.87 57.93 1n6u n SER 17 Cb 0.52 0.01 -0.03 0.00 -1.01 0.00 0.00 64.21 63.70 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 -1.02 -0.26 -3.43 2.96 0.94 -2.81 118.68 115.06 1n6u s LEU 18 Ca 0.10 -1.02 -0.16 0.00 -0.22 0.00 0.00 54.13 52.83 1n6u s LEU 18 Cb -0.01 1.47 -0.03 0.00 0.50 0.00 0.00 46.19 48.12 1n6u s LEU 18 CO 0.06 -0.21 0.42 -0.60 -1.32 0.00 0.00 176.35 174.70 1n6u s ARG 19 N 1.75 4.05 -1.40 1.98 3.52 -0.01 -3.63 118.95 125.21 1n6u s ARG 19 Ca 0.16 0.14 -0.01 0.00 -0.13 0.00 0.00 55.73 55.89 1n6u s ARG 19 Cb -0.08 -3.64 0.01 0.00 -1.56 0.00 0.00 34.95 29.68 1n6u s ARG 19 CO -0.07 -0.27 0.49 0.09 -0.81 0.00 0.00 175.30 174.74 1n6u n ASN 20 N 5.27 -0.64 -3.72 -2.12 5.03 -1.26 0.65 115.26 118.47 1n6u n ASN 20 Ca -0.07 -0.96 -0.28 0.00 0.87 0.00 0.00 54.58 54.13 1n6u n ASN 20 Cb 0.50 -3.27 0.01 0.00 -1.02 0.00 0.00 39.78 36.00 1n6u n ASN 20 CO 0.00 0.00 0.00 2.22 -1.83 0.00 0.00 177.26 177.65 1n6u n PHE 21 N -4.38 -1.99 -4.65 3.10 1.16 -1.26 -4.84 117.46 104.60 1n6u n PHE 21 Ca -0.29 0.70 -0.33 0.00 -1.87 0.00 0.00 57.45 55.66 1n6u n PHE 21 Cb 0.68 -3.44 -0.13 0.00 -1.61 0.00 0.00 39.48 34.98 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 -6.40 3.30 -0.04 3.97 3.52 0.21 -5.01 118.95 118.50 1n6u s ARG 22 Ca 0.56 -0.61 -0.20 0.00 -0.13 0.00 0.00 55.73 55.35 1n6u s ARG 22 Cb -0.29 -2.69 -0.05 0.00 -1.56 0.00 0.00 34.95 30.36 1n6u s ARG 22 CO 0.70 0.33 0.58 0.45 -0.81 0.00 0.00 175.30 176.54 1n6u s SER 23 N 0.07 6.90 -0.21 -2.12 0.15 -0.74 -0.83 113.70 116.93 1n6u s SER 23 Ca -0.03 1.08 -0.04 0.00 0.70 0.00 0.00 55.95 57.66 1n6u s SER 23 Cb -0.14 -2.35 0.08 0.00 -1.71 0.00 0.00 66.02 61.90 1n6u s SER 23 CO 0.04 0.05 0.16 -0.63 1.20 0.00 0.00 173.24 174.06 1n6u s ILE 24 N 0.12 -0.19 -0.09 6.45 1.01 -1.12 0.22 121.20 127.59 1n6u s ILE 24 Ca 0.31 -0.26 -0.06 0.00 0.00 0.00 0.00 60.65 60.64 1n6u s ILE 24 Cb -0.17 -0.70 -0.04 0.00 0.01 0.00 0.00 42.46 41.56 1n6u s ILE 24 CO 0.16 -0.33 0.15 -1.48 0.00 0.00 0.00 174.94 173.43 1n6u s LEU 25 N 2.22 4.38 0.00 2.97 0.05 0.44 0.04 118.68 128.78 1n6u s LEU 25 Ca 0.05 0.43 0.02 0.00 0.05 0.00 0.00 54.13 54.68 1n6u s LEU 25 Cb -0.16 -2.23 -0.01 0.00 -2.05 0.00 0.00 46.19 41.75 1n6u s LEU 25 CO -0.16 0.37 0.07 -1.54 -0.55 0.00 0.00 176.35 174.54 1n6u n SER 26 N 1.68 1.82 -4.02 1.48 3.41 0.52 0.11 113.62 118.63 1n6u n SER 26 Ca -0.17 -2.63 -0.08 0.00 -0.26 0.00 0.00 58.87 55.73 1n6u n SER 26 Cb 0.54 0.59 -0.09 0.00 -0.26 0.00 0.00 64.21 65.00 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 -2.57 0.43 -0.49 7.33 -2.14 -1.26 -0.06 118.94 120.19 1n6u s TRP 27 Ca 0.10 -0.92 0.05 0.00 2.66 0.00 0.00 56.10 57.99 1n6u s TRP 27 Cb 0.00 -0.28 0.18 0.00 -3.10 0.00 0.00 33.47 30.28 1n6u s TRP 27 CO 0.07 -0.46 0.41 0.39 -2.66 0.00 0.00 176.95 174.70 1n6u n GLU 28 N 0.02 0.72 -3.86 3.25 -0.58 0.56 -4.80 120.64 115.94 1n6u n GLU 28 Ca -0.13 -3.54 -0.35 0.00 -0.42 0.00 0.00 57.16 52.72 1n6u n GLU 28 Cb 0.62 -1.78 -0.13 0.00 -0.57 0.00 0.00 31.44 29.57 1n6u n GLU 28 CO 0.00 0.00 0.00 -0.48 -0.48 0.00 0.00 177.13 176.17 1n6u s LEU 29 N -0.54 4.46 0.72 -4.62 -0.00 -1.26 0.60 118.68 118.04 1n6u s LEU 29 Ca 0.32 -1.60 -0.07 0.00 -0.00 0.00 0.00 54.13 52.78 1n6u s LEU 29 Cb 0.04 -1.75 0.06 0.00 -0.00 0.00 0.00 46.19 44.54 1n6u s LEU 29 CO -0.18 -0.37 1.04 -0.54 -0.00 0.00 0.00 176.35 176.31 1n6u s LYS 30 N 1.20 2.15 0.03 1.48 1.02 -1.20 -4.82 119.74 119.59 1n6u s LYS 30 Ca 0.01 -0.20 0.09 0.00 0.02 0.00 0.00 55.97 55.89 1n6u s LYS 30 Cb -0.21 -2.13 -0.03 0.00 -0.52 0.00 0.00 37.83 34.94 1n6u s LYS 30 CO -0.02 -1.30 -0.25 0.54 -0.92 0.00 0.00 175.35 173.39 1n6u s ASN 31 N -4.53 3.22 -0.04 2.83 4.22 -1.24 -3.47 114.94 115.94 1n6u s ASN 31 Ca 0.60 -0.54 -0.02 0.00 -2.14 0.00 0.00 52.86 50.76 1n6u s ASN 31 Cb -0.11 -0.34 -0.02 0.00 1.28 0.00 0.00 41.25 42.06 1n6u s ASN 31 CO 0.45 0.27 -0.05 0.00 -2.04 0.00 0.00 177.10 175.73 1n6u n HIS 32 N 1.90 0.00 -0.07 1.54 1.44 -1.26 -4.51 115.22 114.25 1n6u n HIS 32 Ca -0.17 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.39 1n6u n HIS 32 Cb 0.52 -0.14 -0.05 0.00 0.12 0.00 0.00 29.99 30.44 1n6u n HIS 32 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1n6u n SER 33 N -3.21 1.03 -4.25 4.39 2.88 -1.26 -4.98 113.62 108.22 1n6u n SER 33 Ca -0.08 0.17 -0.34 0.00 -1.33 0.00 0.00 58.87 57.29 1n6u n SER 33 Cb 0.53 -0.42 -0.15 0.00 -0.75 0.00 0.00 64.21 63.43 1n6u n SER 33 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1n6u s ILE 34 N -2.26 2.94 -0.46 2.46 1.10 -1.26 -5.09 121.20 118.63 1n6u s ILE 34 Ca -0.20 -0.65 -0.21 0.00 -0.51 0.00 0.00 60.65 59.08 1n6u s ILE 34 Cb 0.08 -2.30 0.03 0.00 0.15 0.00 0.00 42.46 40.41 1n6u s ILE 34 CO 0.25 0.47 0.69 0.54 -2.11 0.00 0.00 174.94 174.77 1n6u s VAL 35 N 1.34 4.77 1.03 4.00 0.11 -1.26 -4.76 120.40 125.63 1n6u s VAL 35 Ca 0.04 0.10 -0.15 0.00 -2.93 0.00 0.00 61.98 59.04 1n6u s VAL 35 Cb -0.14 -4.26 0.20 0.00 -1.53 0.00 0.00 36.38 30.65 1n6u s VAL 35 CO -0.06 -0.68 1.17 -2.16 -3.33 0.00 0.00 175.10 170.04 1n6u s PRO 36 N 2.96 0.19 0.19 1.54 0.04 -1.26 -4.75 135.00 133.91 1n6u s PRO 36 Ca 0.23 0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.31 1n6u s PRO 36 Cb -0.14 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1n6u s PRO 36 CO 0.19 -2.79 0.00 -2.37 0.04 0.00 0.00 177.00 172.07 1n6u n THR 37 N -4.13 0.37 -3.39 1.26 5.66 -1.26 -4.87 114.28 107.92 1n6u n THR 37 Ca 0.10 0.12 -0.32 0.00 -3.05 0.00 0.00 64.05 60.90 1n6u n THR 37 Cb 0.59 -0.88 -0.05 0.00 -1.55 0.00 0.00 70.33 68.44 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 -2.00 3.45 0.26 1.09 -3.43 -1.26 -4.03 115.29 109.37 1n6u s HIS 38 Ca 0.00 0.93 0.01 0.00 -0.80 0.00 0.00 55.06 55.20 1n6u s HIS 38 Cb 0.00 -2.29 -0.05 0.00 -1.43 0.00 0.00 32.58 28.80 1n6u s HIS 38 CO 0.00 0.28 0.09 0.71 -2.00 0.00 0.00 174.74 173.82 1n6u s TYR 39 N -1.77 1.58 -0.32 0.38 2.02 0.23 -3.39 117.35 116.07 1n6u s TYR 39 Ca 0.46 -1.16 -0.02 0.00 -0.37 0.00 0.00 57.07 55.99 1n6u s TYR 39 Cb -0.12 -0.94 0.12 0.00 -0.40 0.00 0.00 41.96 40.62 1n6u s TYR 39 CO 0.21 -0.30 0.17 0.99 -1.57 0.00 0.00 175.55 175.04 1n6u s THR 40 N -3.71 0.11 -0.41 -0.71 2.01 -0.48 0.20 115.64 112.65 1n6u s THR 40 Ca 0.38 -1.24 -0.28 0.00 0.31 0.00 0.00 61.69 60.85 1n6u s THR 40 Cb 0.08 -1.10 -0.02 0.00 0.01 0.00 0.00 72.50 71.47 1n6u s THR 40 CO 0.14 -0.84 1.78 -0.22 -0.69 0.00 0.00 174.62 174.79 1n6u s LEU 41 N 1.59 3.46 -0.09 4.42 1.98 0.24 -1.94 118.68 128.35 1n6u s LEU 41 Ca 0.13 1.01 -0.01 0.00 -2.89 0.00 0.00 54.13 52.37 1n6u s LEU 41 Cb -0.19 -3.25 -0.03 0.00 0.66 0.00 0.00 46.19 43.37 1n6u s LEU 41 CO -0.19 -1.86 -0.03 -0.76 -1.89 0.00 0.00 176.35 171.61 1n6u s LEU 42 N 7.36 3.37 0.04 -0.68 1.43 -0.72 -2.31 118.68 127.16 1n6u s LEU 42 Ca 0.75 0.05 -0.00 0.00 -1.03 0.00 0.00 54.13 53.89 1n6u s LEU 42 Cb -0.19 -1.76 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 1n6u s LEU 42 CO 0.30 0.35 -0.04 -0.72 0.23 0.00 0.00 176.35 176.48 1n6u s TYR 43 N -0.72 0.45 0.34 0.29 -0.85 -0.53 0.92 117.35 117.26 1n6u s TYR 43 Ca 0.11 -0.81 -0.05 0.00 -0.52 0.00 0.00 57.07 55.80 1n6u s TYR 43 Cb -0.11 -0.32 0.01 0.00 0.38 0.00 0.00 41.96 41.92 1n6u s TYR 43 CO 0.02 -0.27 0.51 -0.08 -1.52 0.00 0.00 175.55 174.21 1n6u s THR 44 N -2.77 0.00 -0.18 -3.49 -1.32 0.29 0.95 115.64 109.12 1n6u s THR 44 Ca -0.03 -1.52 -0.05 0.00 -1.21 0.00 0.00 61.69 58.88 1n6u s THR 44 Cb -0.00 -2.65 -0.03 0.00 -1.51 0.00 0.00 72.50 68.30 1n6u s THR 44 CO -0.05 0.00 0.01 0.27 -2.21 0.00 0.00 174.62 172.64 1n6u s ILE 45 N -3.00 4.22 0.27 5.08 -4.36 -1.20 0.42 121.20 122.63 1n6u s ILE 45 Ca 0.28 -0.23 -0.04 0.00 -0.26 0.00 0.00 60.65 60.41 1n6u s ILE 45 Cb -0.01 -2.89 0.41 0.00 1.25 0.00 0.00 42.46 41.22 1n6u s ILE 45 CO 0.19 0.45 1.45 0.80 0.24 0.00 0.00 174.94 178.07 1n6u n MET 46 N 3.83 -0.08 0.19 0.37 0.00 0.58 0.19 117.12 122.19 1n6u n MET 46 Ca -0.17 1.43 0.04 0.00 -0.00 0.00 0.00 57.70 59.00 1n6u n MET 46 Cb 0.52 -2.19 0.46 0.00 0.00 0.00 0.00 33.22 32.01 1n6u n MET 46 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 1n6u h SER 47 N 0.00 0.06 -2.50 6.12 0.87 -1.95 -3.29 113.55 112.86 1n6u h SER 47 Ca 0.50 -0.01 -0.60 0.00 -1.23 0.00 0.00 61.79 60.44 1n6u h SER 47 Cb 0.88 -0.02 -0.41 0.00 -0.44 0.00 0.00 62.40 62.41 1n6u h SER 47 CO -0.92 0.26 -0.71 0.29 -0.53 0.00 0.00 176.83 175.22 1n6u n LYS 48 N -4.28 1.74 0.00 2.24 5.02 0.50 -4.92 118.16 118.45 1n6u n LYS 48 Ca -0.02 -4.22 0.07 0.00 -2.02 0.00 0.00 58.31 52.12 1n6u n LYS 48 Cb 0.27 -2.05 0.29 0.00 -0.02 0.00 0.00 35.03 33.53 1n6u n LYS 48 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1n6u n PRO 49 N 1.56 0.01 0.00 1.97 -0.04 -0.80 -2.06 135.00 135.64 1n6u n PRO 49 Ca 0.25 0.26 0.14 0.00 -0.04 0.00 0.00 63.50 64.12 1n6u n PRO 49 Cb 0.41 -1.50 0.61 0.00 -0.04 0.00 0.00 33.50 32.98 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 -1.49 1.35 -2.86 0.54 -0.58 -1.26 -4.28 120.64 112.05 1n6u n GLU 50 Ca 0.03 -0.64 -0.33 0.00 -0.42 0.00 0.00 57.16 55.80 1n6u n GLU 50 Cb 0.16 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.52 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 -0.27 5.70 -4.84 1.62 2.03 -0.87 -5.04 116.55 114.87 1n6u n ASP 51 Ca 0.19 -3.66 -0.36 0.00 0.52 0.00 0.00 54.79 51.49 1n6u n ASP 51 Cb 0.30 -0.85 -0.06 0.00 -0.72 0.00 0.00 41.12 39.79 1n6u n ASP 51 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1n6u s LEU 52 N -3.71 4.34 -0.05 -2.67 1.43 -1.25 -4.22 118.68 112.55 1n6u s LEU 52 Ca 0.43 1.15 0.01 0.00 -1.03 0.00 0.00 54.13 54.69 1n6u s LEU 52 Cb 0.22 -3.33 0.02 0.00 0.03 0.00 0.00 46.19 43.14 1n6u s LEU 52 CO -0.11 0.09 -0.03 -0.75 0.23 0.00 0.00 176.35 175.78 1n6u s LYS 53 N -1.94 0.75 -0.86 1.70 2.20 0.27 -4.86 119.74 117.00 1n6u s LYS 53 Ca 0.39 -0.06 -0.25 0.00 -0.36 0.00 0.00 55.97 55.69 1n6u s LYS 53 Cb -0.15 -0.82 0.05 0.00 -1.51 0.00 0.00 37.83 35.39 1n6u s LYS 53 CO 0.19 -0.12 1.32 0.14 -0.36 0.00 0.00 175.35 176.52 1n6u s VAL 54 N 1.06 3.90 0.28 4.02 -7.23 -1.26 -1.45 120.40 119.72 1n6u s VAL 54 Ca -0.09 -0.22 -0.29 0.00 -1.81 0.00 0.00 61.98 59.57 1n6u s VAL 54 Cb -0.14 -4.95 -0.14 0.00 0.56 0.00 0.00 36.38 31.71 1n6u s VAL 54 CO -0.01 -1.84 1.13 0.52 -0.31 0.00 0.00 175.10 174.59 1n6u n VAL 55 N 6.50 1.74 -1.71 1.32 0.31 -0.98 -4.75 118.33 120.77 1n6u n VAL 55 Ca 0.16 -0.44 -0.43 0.00 -0.01 0.00 0.00 64.34 63.62 1n6u n VAL 55 Cb 0.50 -1.16 -0.03 0.00 -0.91 0.00 0.00 33.84 32.24 1n6u n VAL 55 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 1n6u n LYS 56 N 0.96 2.50 0.00 5.55 2.85 -1.26 -0.97 118.16 127.80 1n6u n LYS 56 Ca 0.09 0.90 0.00 0.00 -1.05 0.00 0.00 58.31 58.25 1n6u n LYS 56 Cb 0.32 -2.69 0.00 0.00 -0.65 0.00 0.00 35.03 32.01 1n6u n LYS 56 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1n6u n ASN 57 N 3.17 0.00 -0.77 -5.58 2.85 -1.26 -4.73 115.26 108.94 1n6u n ASN 57 Ca 0.14 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.73 1n6u n ASN 57 Cb 0.33 0.00 0.30 0.00 1.24 0.00 0.00 39.78 41.65 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 -1.89 3.57 0.00 0.00 0.00 -1.00 0.81 121.76 123.25 1n6u s ALA 59 Ca 0.34 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1n6u s ALA 59 Cb 0.20 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.96 1n6u s ALA 59 CO 0.31 0.17 0.00 0.27 0.00 0.00 0.00 175.76 176.51 1n6u n ASN 60 N -1.08 0.00 -4.13 0.00 6.94 0.53 -4.74 115.26 112.78 1n6u n ASN 60 Ca -0.01 0.00 -0.28 0.00 -0.02 0.00 0.00 54.58 54.27 1n6u n ASN 60 Cb 0.54 0.00 -0.17 0.00 -2.36 0.00 0.00 39.78 37.79 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 -0.32 1.58 -1.10 5.53 -1.32 0.17 -4.70 115.64 115.48 1n6u s THR 61 Ca 0.00 -0.76 -0.02 0.00 -1.21 0.00 0.00 61.69 59.70 1n6u s THR 61 Cb 0.00 -1.38 0.27 0.00 -1.51 0.00 0.00 72.50 69.88 1n6u s THR 61 CO 0.00 0.45 1.98 0.35 -2.21 0.00 0.00 174.62 175.19 1n6u n THR 62 N 3.50 5.86 -4.25 5.08 -2.24 -1.26 0.74 114.28 121.72 1n6u n THR 62 Ca -0.20 -5.54 -0.17 0.00 -2.27 0.00 0.00 64.05 55.88 1n6u n THR 62 Cb 0.52 -1.68 -0.06 0.00 -2.10 0.00 0.00 70.33 67.01 1n6u n THR 62 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1n6u n ARG 63 N 0.38 0.36 0.00 -0.78 5.12 -1.26 -4.92 116.66 115.57 1n6u n ARG 63 Ca 0.51 -2.78 0.00 0.00 -1.93 0.00 0.00 57.85 53.65 1n6u n ARG 63 Cb 0.26 2.24 0.00 0.00 -1.16 0.00 0.00 32.46 33.80 1n6u n ARG 63 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1n6u n SER 64 N -1.89 0.00 -4.66 0.55 3.41 -1.26 -4.66 113.62 105.11 1n6u n SER 64 Ca 0.06 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.24 1n6u n SER 64 Cb 0.50 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.41 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 -0.33 2.39 0.00 7.33 -0.71 -1.26 -4.35 117.98 121.06 1n6u s PHE 65 Ca 0.00 0.58 -0.04 0.00 -1.04 0.00 0.00 56.93 56.43 1n6u s PHE 65 Cb 0.00 -3.72 -0.04 0.00 -1.21 0.00 0.00 43.02 38.05 1n6u s PHE 65 CO 0.00 -2.82 0.22 0.00 -1.34 0.00 0.00 175.22 171.28 1n6u s ASP 67 N -1.89 5.84 -0.36 0.00 -4.77 -1.26 -0.42 116.67 113.82 1n6u s ASP 67 Ca 0.28 -0.11 -0.03 0.00 -3.30 0.00 0.00 52.55 49.39 1n6u s ASP 67 Cb -0.13 -1.18 0.19 0.00 -1.09 0.00 0.00 42.92 40.71 1n6u s ASP 67 CO 0.18 -0.59 0.91 -1.48 0.70 0.00 0.00 175.17 174.89 1n6u s LEU 68 N -4.32 -0.73 -0.18 2.11 2.34 0.59 -4.79 118.68 113.69 1n6u s LEU 68 Ca 0.48 -0.42 -0.24 0.00 0.06 0.00 0.00 54.13 54.00 1n6u s LEU 68 Cb -0.10 0.94 -0.22 0.00 -0.56 0.00 0.00 46.19 46.25 1n6u s LEU 68 CO 0.33 -0.08 0.46 0.74 -1.06 0.00 0.00 176.35 176.75 1n6u h THR 69 N 3.90 1.28 -0.33 5.48 2.02 -1.91 -1.96 112.91 121.40 1n6u h THR 69 Ca -0.00 -2.26 0.00 0.00 0.77 0.00 0.00 66.41 64.92 1n6u h THR 69 Cb 1.21 2.73 0.00 0.00 -1.74 0.00 0.00 68.15 70.35 1n6u h THR 69 CO -0.02 0.45 0.00 -0.90 0.37 0.00 0.00 175.52 175.42 1n6u n ASP 70 N -4.49 3.02 0.09 4.18 5.68 -1.26 -4.43 116.55 119.35 1n6u n ASP 70 Ca -0.23 -2.12 0.11 0.00 -0.50 0.00 0.00 54.79 52.06 1n6u n ASP 70 Cb 0.61 -0.26 -0.01 0.00 -1.14 0.00 0.00 41.12 40.31 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 0.38 0.60 -2.55 0.11 -0.58 -1.26 -4.18 120.64 113.15 1n6u n GLU 71 Ca 0.12 0.10 -0.24 0.00 -0.42 0.00 0.00 57.16 56.72 1n6u n GLU 71 Cb 0.48 -1.80 0.00 0.00 -0.57 0.00 0.00 31.44 29.55 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 -2.63 3.02 1.33 -0.32 7.02 -1.26 -4.85 117.44 119.76 1n6u n TRP 72 Ca -0.00 -3.13 0.08 0.00 -1.02 0.00 0.00 57.50 53.42 1n6u n TRP 72 Cb 0.55 -0.16 0.46 0.00 -2.42 0.00 0.00 31.31 29.73 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 -0.38 0.67 -1.84 -0.99 1.85 -1.26 -3.80 116.66 110.91 1n6u n ARG 73 Ca 0.33 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.83 1n6u n ARG 73 Cb 0.67 -1.36 -0.00 0.00 -1.05 0.00 0.00 32.46 30.71 1n6u n ARG 73 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1n6u n SER 74 N -0.86 7.15 -0.28 2.89 7.64 -1.26 -4.71 113.62 124.18 1n6u n SER 74 Ca 0.12 -3.51 0.09 0.00 1.01 0.00 0.00 58.87 56.58 1n6u n SER 74 Cb 0.05 -1.17 0.25 0.00 -1.01 0.00 0.00 64.21 62.33 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 2.08 0.52 0.00 0.44 1.35 -1.89 1.06 112.91 116.46 1n6u h THR 75 Ca 0.51 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 66.24 1n6u h THR 75 Cb 0.35 0.11 0.00 0.00 -1.73 0.00 0.00 68.15 66.88 1n6u h THR 75 CO 1.20 0.07 0.01 1.12 -0.25 0.00 0.00 175.52 177.67 1n6u h HIS 76 N 0.37 0.00 -1.34 4.73 2.07 -1.91 0.97 115.15 120.03 1n6u h HIS 76 Ca 0.49 0.00 -0.46 0.00 -2.85 0.00 0.00 60.37 57.55 1n6u h HIS 76 Cb 0.87 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.85 1n6u h HIS 76 CO -0.19 0.00 -0.28 -1.21 -3.07 0.00 0.00 177.93 173.19 1n6u s GLU 77 N -3.74 2.65 -0.53 5.12 0.41 0.37 -4.82 118.70 118.15 1n6u s GLU 77 Ca -0.03 -1.42 -0.12 0.00 -0.41 0.00 0.00 54.97 53.00 1n6u s GLU 77 Cb 0.08 -2.60 0.13 0.00 -1.78 0.00 0.00 34.13 29.97 1n6u s GLU 77 CO 0.26 -0.34 0.44 0.00 -0.49 0.00 0.00 175.26 175.13 1n6u s ALA 78 N -2.45 3.55 -0.82 5.21 0.00 -1.26 -4.01 121.76 121.98 1n6u s ALA 78 Ca 0.53 -2.65 -0.26 0.00 0.00 0.00 0.00 51.96 49.59 1n6u s ALA 78 Cb -0.07 -3.03 -0.11 0.00 0.00 0.00 0.00 23.12 19.91 1n6u s ALA 78 CO 0.32 -1.99 2.25 0.71 0.00 0.00 0.00 175.76 177.05 1n6u s TYR 79 N 1.26 1.36 0.39 0.00 1.51 0.98 -0.31 117.35 122.55 1n6u s TYR 79 Ca 0.06 1.53 -0.26 0.00 -1.01 0.00 0.00 57.07 57.40 1n6u s TYR 79 Cb -0.26 -3.64 -0.09 0.00 -0.11 0.00 0.00 41.96 37.86 1n6u s TYR 79 CO -0.00 -1.65 1.23 0.14 -1.11 0.00 0.00 175.55 174.15 1n6u s VAL 80 N 13.17 2.93 0.02 0.71 -7.23 0.17 -1.99 120.40 128.19 1n6u s VAL 80 Ca 0.85 0.82 -0.00 0.00 -1.81 0.00 0.00 61.98 61.83 1n6u s VAL 80 Cb -0.11 -3.47 -0.02 0.00 0.56 0.00 0.00 36.38 33.34 1n6u s VAL 80 CO 0.06 0.11 -0.03 -0.89 -0.31 0.00 0.00 175.10 174.03 1n6u s THR 81 N -1.32 0.12 -0.30 5.32 2.01 -0.05 0.11 115.64 121.52 1n6u s THR 81 Ca 0.56 -0.99 -0.02 0.00 0.31 0.00 0.00 61.69 61.56 1n6u s THR 81 Cb -0.34 -0.37 0.10 0.00 0.01 0.00 0.00 72.50 71.89 1n6u s THR 81 CO 0.44 -0.54 0.10 -0.69 -0.69 0.00 0.00 174.62 173.24 1n6u s VAL 82 N -1.68 0.66 -0.50 3.82 1.01 0.26 -0.35 120.40 123.63 1n6u s VAL 82 Ca -0.14 -1.24 -0.21 0.00 0.00 0.00 0.00 61.98 60.39 1n6u s VAL 82 Cb -0.08 -1.51 0.04 0.00 0.00 0.00 0.00 36.38 34.84 1n6u s VAL 82 CO -0.02 -0.68 0.71 -0.22 0.00 0.00 0.00 175.10 174.89 1n6u s LEU 83 N 1.73 4.63 -0.33 3.92 2.96 0.16 -1.76 118.68 129.99 1n6u s LEU 83 Ca 0.09 -0.62 -0.14 0.00 -0.22 0.00 0.00 54.13 53.24 1n6u s LEU 83 Cb -0.17 -2.62 -0.02 0.00 0.50 0.00 0.00 46.19 43.88 1n6u s LEU 83 CO -0.27 -0.94 0.30 -1.61 -1.32 0.00 0.00 176.35 172.51 1n6u s GLU 84 N 3.00 3.65 -0.14 1.98 2.02 -0.82 -2.33 118.70 126.06 1n6u s GLU 84 Ca 0.21 -0.42 -0.01 0.00 0.02 0.00 0.00 54.97 54.76 1n6u s GLU 84 Cb -0.16 -3.77 -0.02 0.00 0.10 0.00 0.00 34.13 30.28 1n6u s GLU 84 CO 0.16 -0.42 -0.10 0.20 0.02 0.00 0.00 175.26 175.12 1n6u s GLY 85 N 1.72 1.61 -0.18 -1.39 0.00 -0.63 -1.38 107.32 107.07 1n6u s GLY 85 Ca 0.10 -0.86 -0.06 0.00 0.00 0.00 0.00 44.72 43.89 1n6u s GLY 85 CO 0.11 -0.17 0.03 -1.36 0.00 0.00 0.00 173.10 171.70 1n6u s PHE 86 N 0.29 3.16 -0.73 1.90 0.40 -1.22 -1.35 117.98 120.43 1n6u s PHE 86 Ca -0.07 -0.09 -0.27 0.00 -0.60 0.00 0.00 56.93 55.89 1n6u s PHE 86 Cb -0.15 -2.05 0.03 0.00 0.51 0.00 0.00 43.02 41.36 1n6u s PHE 86 CO 0.04 0.05 1.34 0.45 0.70 0.00 0.00 175.22 177.81 1n6u s SER 87 N 0.45 6.08 0.04 1.36 0.15 0.59 -4.15 113.70 118.22 1n6u s SER 87 Ca 0.01 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.27 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 0.01 -1.89 0.00 0.61 1.20 0.00 0.00 173.24 173.17 1n6u n GLY 88 N 5.43 1.98 0.00 9.45 0.00 -1.26 -2.50 105.19 118.29 1n6u n GLY 88 Ca 0.05 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 6.18 0.39 -4.65 1.61 4.13 -1.26 -4.81 115.26 116.85 1n6u n ASN 89 Ca 0.00 -0.69 -0.29 0.00 1.68 0.00 0.00 54.58 55.27 1n6u n ASN 89 Cb 0.00 0.56 -0.09 0.00 -1.54 0.00 0.00 39.78 38.72 1n6u n ASN 89 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1n6u s THR 90 N -0.56 3.76 -0.09 3.41 2.01 -1.04 -5.08 115.64 118.05 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 -2.80 -0.02 0.00 0.01 0.00 0.00 72.50 69.69 1n6u s THR 90 CO 0.00 0.08 1.09 -0.89 -0.69 0.00 0.00 174.62 174.21 1n6u s THR 91 N -1.34 4.57 -0.03 -0.82 2.01 -1.26 0.22 115.64 118.98 1n6u s THR 91 Ca 0.25 1.86 0.10 0.00 0.31 0.00 0.00 61.69 64.20 1n6u s THR 91 Cb -0.11 -4.19 -0.16 0.00 0.01 0.00 0.00 72.50 68.05 1n6u s THR 91 CO 0.17 -0.01 0.19 -0.11 -0.69 0.00 0.00 174.62 174.17 1n6u n LEU 92 N 5.18 0.00 -3.68 4.42 7.94 -0.80 -4.75 117.00 125.30 1n6u n LEU 92 Ca 0.10 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.96 1n6u n LEU 92 Cb 0.48 0.05 -0.01 0.00 0.53 0.00 0.00 43.42 44.46 1n6u n LEU 92 CO 0.53 0.05 0.79 0.72 -1.11 0.00 0.00 177.39 178.37 1n6u s PHE 93 N -2.63 -0.15 -0.29 1.96 -0.71 -0.45 -5.00 117.98 110.71 1n6u s PHE 93 Ca -0.04 -0.08 0.03 0.00 -1.04 0.00 0.00 56.93 55.80 1n6u s PHE 93 Cb 0.06 0.60 0.19 0.00 -1.21 0.00 0.00 43.02 42.66 1n6u s PHE 93 CO 0.43 -0.65 0.54 -1.12 -1.34 0.00 0.00 175.22 173.08 1n6u s SER 94 N -2.84 -1.08 0.07 1.98 0.01 -1.26 -1.61 113.70 108.96 1n6u s SER 94 Ca 0.11 0.25 0.08 0.00 1.31 0.00 0.00 55.95 57.70 1n6u s SER 94 Cb -0.00 1.83 -0.03 0.00 0.21 0.00 0.00 66.02 68.03 1n6u s SER 94 CO -0.01 -0.30 -0.23 0.00 0.41 0.00 0.00 173.24 173.11 1n6u s SER 96 N -1.46 2.67 -0.26 0.00 1.04 -1.25 0.39 113.70 114.84 1n6u s SER 96 Ca 0.09 -1.46 -0.26 0.00 0.48 0.00 0.00 55.95 54.80 1n6u s SER 96 Cb -0.09 0.06 0.13 0.00 0.10 0.00 0.00 66.02 66.22 1n6u s SER 96 CO 0.03 -0.68 1.09 -2.28 0.98 0.00 0.00 173.24 172.38 1n6u s HIS 97 N -3.21 -0.38 -0.56 5.02 5.04 0.53 -4.96 115.29 116.77 1n6u s HIS 97 Ca 0.32 0.87 -0.24 0.00 -1.54 0.00 0.00 55.06 54.46 1n6u s HIS 97 Cb 0.07 0.40 0.04 0.00 0.04 0.00 0.00 32.58 33.13 1n6u s HIS 97 CO 0.15 -0.22 0.96 -0.80 -2.34 0.00 0.00 174.74 172.49 1n6u s ASN 98 N -0.12 6.33 -0.36 9.88 -0.87 -1.26 -0.87 114.94 127.68 1n6u s ASN 98 Ca 0.03 -0.36 -0.28 0.00 -1.57 0.00 0.00 52.86 50.68 1n6u s ASN 98 Cb -0.04 -2.44 0.02 0.00 -0.02 0.00 0.00 41.25 38.76 1n6u s ASN 98 CO -0.06 -1.26 1.02 -0.36 -2.57 0.00 0.00 177.10 173.87 1n6u s PHE 99 N 4.03 3.08 -1.10 2.20 0.40 -0.84 -4.92 117.98 120.84 1n6u s PHE 99 Ca 0.31 0.98 -0.14 0.00 -0.60 0.00 0.00 56.93 57.48 1n6u s PHE 99 Cb -0.12 -3.76 0.19 0.00 0.51 0.00 0.00 43.02 39.84 1n6u s PHE 99 CO 0.19 -0.84 1.24 -0.46 0.70 0.00 0.00 175.22 176.05 1n6u s TRP 100 N 3.68 3.62 -0.00 0.36 -0.00 -1.26 -0.01 118.94 125.33 1n6u s TRP 100 Ca 0.43 -2.11 -0.23 0.00 -0.00 0.00 0.00 56.10 54.19 1n6u s TRP 100 Cb -0.11 -4.16 -0.13 0.00 -0.00 0.00 0.00 33.47 29.07 1n6u s TRP 100 CO 0.18 -1.28 0.97 -0.07 -0.00 0.00 0.00 176.95 176.76 1n6u h LEU 101 N 9.00 -0.72 -1.65 5.86 3.38 -1.77 1.74 115.31 131.16 1n6u h LEU 101 Ca 0.24 0.02 0.30 0.00 0.09 0.00 0.00 57.88 58.53 1n6u h LEU 101 Cb 0.92 0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 1n6u h LEU 101 CO 1.12 -0.32 0.95 0.00 0.09 0.00 0.00 178.44 180.28 1n6u h ALA 102 N -1.24 2.89 0.00 1.53 0.00 -0.96 0.29 119.26 121.77 1n6u h ALA 102 Ca -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1n6u h ALA 102 Cb 0.65 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1n6u h ALA 102 CO 0.14 -1.48 -1.50 -0.89 0.00 0.00 0.00 179.25 175.52 1n6u n ILE 103 N -3.67 0.00 -0.09 0.00 -0.00 -1.13 -4.81 119.36 109.66 1n6u n ILE 103 Ca 0.22 -0.28 -0.19 0.00 -0.00 0.00 0.00 62.75 62.51 1n6u n ILE 103 Cb 1.28 0.27 -0.06 0.00 -0.00 0.00 0.00 39.64 41.13 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 -1.89 1.40 -0.14 4.38 2.03 0.59 -4.94 116.55 117.99 1n6u n ASP 104 Ca -0.02 0.24 0.00 0.00 0.52 0.00 0.00 54.79 55.53 1n6u n ASP 104 Cb 0.31 -0.57 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 -3.91 0.00 -3.64 -0.67 2.81 0.71 -4.85 117.12 107.57 1n6u n MET 105 Ca -0.34 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.16 1n6u n MET 105 Cb 0.71 0.00 -0.10 0.00 -0.71 0.00 0.00 33.22 33.12 1n6u n MET 105 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1n6u s SER 106 N 0.00 5.54 -0.33 7.83 1.04 -1.26 -4.96 113.70 121.56 1n6u s SER 106 Ca 0.00 -1.75 0.01 0.00 0.48 0.00 0.00 55.95 54.69 1n6u s SER 106 Cb 0.00 -1.95 0.08 0.00 0.10 0.00 0.00 66.02 64.25 1n6u s SER 106 CO 0.00 -0.58 0.04 0.72 0.98 0.00 0.00 173.24 174.40 1n6u s PHE 107 N 1.33 3.50 -0.05 5.02 -0.71 -1.24 -0.04 117.98 125.79 1n6u s PHE 107 Ca 0.05 -2.45 0.05 0.00 -1.04 0.00 0.00 56.93 53.54 1n6u s PHE 107 Cb -0.24 -2.59 -0.07 0.00 -1.21 0.00 0.00 43.02 38.91 1n6u s PHE 107 CO -0.00 -0.90 0.03 -0.85 -1.34 0.00 0.00 175.22 172.15 1n6u n GLU 108 N 4.46 2.73 -0.29 1.99 -0.00 -1.24 -4.76 120.64 123.53 1n6u n GLU 108 Ca -0.05 -0.01 0.11 0.00 -0.00 0.00 0.00 57.16 57.21 1n6u n GLU 108 Cb 0.42 -1.15 0.26 0.00 -0.00 0.00 0.00 31.44 30.98 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 0.22 -4.72 3.44 0.11 -1.92 -3.44 132.00 125.70 1n6u h PRO 109 Ca -0.14 -0.01 -0.45 0.00 0.11 0.00 0.00 66.00 65.51 1n6u h PRO 109 Cb 1.23 -0.05 0.17 0.00 0.11 0.00 0.00 31.00 32.45 1n6u h PRO 109 CO 0.01 0.15 -1.19 -2.30 -0.21 0.00 0.00 178.00 174.46 1n6u n PRO 110 N -5.21 0.00 -2.53 1.05 -0.02 -1.26 -4.96 135.00 122.07 1n6u n PRO 110 Ca 0.20 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.44 1n6u n PRO 110 Cb 0.63 -0.79 0.09 0.00 -0.02 0.00 0.00 33.50 33.42 1n6u n PRO 110 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1n6u s GLU 111 N -1.18 1.85 0.00 -0.52 0.41 -1.02 -4.92 118.70 113.32 1n6u s GLU 111 Ca 0.38 -0.93 0.00 0.00 -0.41 0.00 0.00 54.97 54.01 1n6u s GLU 111 Cb -0.27 -2.32 0.00 0.00 -1.78 0.00 0.00 34.13 29.76 1n6u s GLU 111 CO 0.59 -1.33 0.00 1.97 -0.49 0.00 0.00 175.26 176.00 1n6u n PHE 112 N -2.79 0.00 -4.21 1.61 -1.74 -1.26 0.21 117.46 109.28 1n6u n PHE 112 Ca 0.13 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.89 1n6u n PHE 112 Cb 0.60 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.50 1n6u n PHE 112 CO 0.00 0.00 0.00 -1.21 -0.56 0.00 0.00 176.76 174.99 1n6u s GLU 113 N -0.64 0.98 -0.19 3.97 2.02 0.14 -4.95 118.70 120.02 1n6u s GLU 113 Ca 0.00 -1.42 -0.04 0.00 0.02 0.00 0.00 54.97 53.53 1n6u s GLU 113 Cb 0.00 -0.36 0.10 0.00 0.10 0.00 0.00 34.13 33.96 1n6u s GLU 113 CO 0.00 -0.01 0.31 0.96 0.02 0.00 0.00 175.26 176.53 1n6u s ILE 114 N -3.53 -0.48 -0.19 -1.63 -4.36 -1.26 0.77 121.20 110.52 1n6u s ILE 114 Ca 0.16 0.05 -0.07 0.00 -0.26 0.00 0.00 60.65 60.54 1n6u s ILE 114 Cb 0.05 -0.65 -0.04 0.00 1.25 0.00 0.00 42.46 43.07 1n6u s ILE 114 CO -0.01 -0.05 0.04 -0.69 0.24 0.00 0.00 174.94 174.47 1n6u s VAL 115 N 2.46 4.51 -0.14 8.37 1.01 0.29 -4.59 120.40 132.31 1n6u s VAL 115 Ca 0.06 -0.13 -0.11 0.00 0.00 0.00 0.00 61.98 61.81 1n6u s VAL 115 Cb -0.14 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.15 1n6u s VAL 115 CO -0.12 0.44 0.21 -0.83 0.00 0.00 0.00 175.10 174.80 1n6u s GLY 116 N 0.61 2.17 0.13 4.51 0.00 -1.26 0.16 107.32 113.63 1n6u s GLY 116 Ca 0.02 -0.56 -0.06 0.00 0.00 0.00 0.00 44.72 44.12 1n6u s GLY 116 CO 0.02 0.06 0.38 -1.36 0.00 0.00 0.00 173.10 172.20 1n6u s PHE 117 N -0.19 3.49 0.51 1.90 0.40 0.20 -4.36 117.98 119.92 1n6u s PHE 117 Ca 0.14 0.61 0.46 0.00 -0.60 0.00 0.00 56.93 57.54 1n6u s PHE 117 Cb -0.12 -2.04 1.58 0.00 0.51 0.00 0.00 43.02 42.95 1n6u s PHE 117 CO 0.03 0.45 1.43 2.41 0.70 0.00 0.00 175.22 180.24 1n6u n THR 118 N 0.27 -0.01 0.00 0.64 -1.04 -1.26 -1.29 114.28 111.59 1n6u n THR 118 Ca -0.04 1.37 0.00 0.00 -2.04 0.00 0.00 64.05 63.35 1n6u n THR 118 Cb 0.52 -2.29 0.00 0.00 -1.82 0.00 0.00 70.33 66.74 1n6u n THR 118 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1n6u n ASN 119 N -3.78 4.77 -3.04 8.00 4.05 -1.26 -2.78 115.26 121.21 1n6u n ASN 119 Ca 0.41 0.00 -0.15 0.00 0.45 0.00 0.00 54.58 55.29 1n6u n ASN 119 Cb 1.84 0.77 -0.04 0.00 1.23 0.00 0.00 39.78 43.59 1n6u n ASN 119 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1n6u n HIS 120 N -1.62 0.35 -4.64 1.20 1.44 -0.41 -3.43 115.22 108.10 1n6u n HIS 120 Ca 0.00 -1.30 -0.28 0.00 -2.01 0.00 0.00 57.72 54.13 1n6u n HIS 120 Cb 0.18 -0.09 -0.17 0.00 0.12 0.00 0.00 29.99 30.04 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 -2.11 1.52 -0.49 0.61 1.01 0.33 0.58 121.20 122.65 1n6u s ILE 121 Ca 0.05 -0.68 -0.13 0.00 0.00 0.00 0.00 60.65 59.90 1n6u s ILE 121 Cb 0.00 -1.37 0.11 0.00 0.01 0.00 0.00 42.46 41.22 1n6u s ILE 121 CO 0.04 0.44 0.40 0.20 0.00 0.00 0.00 174.94 176.02 1n6u s ASN 122 N 0.77 5.93 -0.12 3.58 0.01 0.41 -0.63 114.94 124.90 1n6u s ASN 122 Ca -0.11 -1.76 -0.07 0.00 -0.71 0.00 0.00 52.86 50.21 1n6u s ASN 122 Cb -0.16 -2.10 -0.04 0.00 0.41 0.00 0.00 41.25 39.36 1n6u s ASN 122 CO 0.02 -0.74 0.14 -0.69 -1.51 0.00 0.00 177.10 174.33 1n6u s VAL 123 N 1.49 5.50 -0.17 1.60 1.01 0.34 0.11 120.40 130.28 1n6u s VAL 123 Ca 0.04 0.21 -0.05 0.00 0.00 0.00 0.00 61.98 62.19 1n6u s VAL 123 Cb -0.27 -3.41 0.06 0.00 0.00 0.00 0.00 36.38 32.76 1n6u s VAL 123 CO 0.02 0.61 0.11 -0.32 0.00 0.00 0.00 175.10 175.52 1n6u s MET 124 N -1.04 0.07 -0.35 2.72 1.75 0.23 -0.53 119.30 122.15 1n6u s MET 124 Ca 0.15 0.01 -0.13 0.00 -1.25 0.00 0.00 55.69 54.48 1n6u s MET 124 Cb -0.12 -1.61 -0.01 0.00 2.84 0.00 0.00 34.83 35.93 1n6u s MET 124 CO 0.04 -0.64 0.24 0.08 -0.65 0.00 0.00 175.02 174.09 1n6u s VAL 125 N 2.18 5.15 -1.06 10.11 1.01 -0.61 0.28 120.40 137.45 1n6u s VAL 125 Ca 0.03 -0.35 -0.19 0.00 0.00 0.00 0.00 61.98 61.47 1n6u s VAL 125 Cb -0.16 -3.69 0.11 0.00 0.00 0.00 0.00 36.38 32.65 1n6u s VAL 125 CO -0.09 -0.06 1.36 -0.54 0.00 0.00 0.00 175.10 175.77 1n6u s LYS 126 N 1.69 3.75 0.30 2.72 3.01 0.13 0.16 119.74 131.51 1n6u s LYS 126 Ca 0.05 -1.80 -0.10 0.00 -1.01 0.00 0.00 55.97 53.12 1n6u s LYS 126 Cb -0.18 -5.14 -0.07 0.00 -1.01 0.00 0.00 37.83 31.43 1n6u s LYS 126 CO 0.10 -1.95 0.64 -0.06 0.51 0.00 0.00 175.35 174.59 1n6u s PHE 127 N 3.25 3.44 0.61 3.18 0.08 0.29 -2.42 117.98 126.40 1n6u s PHE 127 Ca 0.41 0.92 -0.18 0.00 0.12 0.00 0.00 56.93 58.20 1n6u s PHE 127 Cb -0.02 -2.32 -0.05 0.00 -0.57 0.00 0.00 43.02 40.07 1n6u s PHE 127 CO -0.05 0.12 0.97 -0.35 -0.10 0.00 0.00 175.22 175.81 1n6u n PRO 128 N -0.65 0.89 -2.06 0.24 -0.04 -1.26 0.70 135.00 132.82 1n6u n PRO 128 Ca 0.01 0.35 -0.33 0.00 -0.04 0.00 0.00 63.50 63.48 1n6u n PRO 128 Cb 0.53 -2.17 -0.04 0.00 -0.04 0.00 0.00 33.50 31.78 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 -1.26 5.24 -0.07 3.54 1.04 -1.25 -2.71 113.70 118.23 1n6u s SER 129 Ca 0.76 -0.15 0.05 0.00 0.48 0.00 0.00 55.95 57.09 1n6u s SER 129 Cb -0.41 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.16 1n6u s SER 129 CO 0.47 -2.52 -0.24 -0.51 0.98 0.00 0.00 173.24 171.42 1n6u s ILE 130 N 9.42 2.00 -0.70 -1.02 -1.16 -1.25 -4.97 121.20 123.52 1n6u s ILE 130 Ca 0.68 -1.02 -0.23 0.00 -0.51 0.00 0.00 60.65 59.56 1n6u s ILE 130 Cb -0.10 -1.71 0.06 0.00 0.61 0.00 0.00 42.46 41.32 1n6u s ILE 130 CO 0.11 0.55 1.06 0.68 -2.81 0.00 0.00 174.94 174.53 1n6u s VAL 131 N 0.05 4.20 0.54 4.00 -7.23 -1.26 -4.54 120.40 116.17 1n6u s VAL 131 Ca -0.10 -0.27 0.42 0.00 -1.81 0.00 0.00 61.98 60.23 1n6u s VAL 131 Cb -0.15 -4.75 0.62 0.00 0.56 0.00 0.00 36.38 32.66 1n6u s VAL 131 CO 0.06 -1.56 1.43 -1.84 -0.31 0.00 0.00 175.10 172.87 1n6u n GLU 132 N 8.05 0.00 0.03 4.82 0.28 -1.26 0.66 120.64 133.22 1n6u n GLU 132 Ca 0.00 1.02 0.01 0.00 -0.16 0.00 0.00 57.16 58.04 1n6u n GLU 132 Cb 0.47 -2.40 0.08 0.00 1.43 0.00 0.00 31.44 31.01 1n6u n GLU 132 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1n6u n GLU 133 N -3.66 0.02 -1.08 3.44 2.13 -1.26 -1.94 120.64 118.29 1n6u n GLU 133 Ca 0.37 0.43 -0.03 0.00 0.66 0.00 0.00 57.16 58.59 1n6u n GLU 133 Cb 1.82 -1.68 -0.04 0.00 0.27 0.00 0.00 31.44 31.81 1n6u n GLU 133 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1n6u n GLU 134 N -1.52 0.00 -1.83 5.31 2.13 0.21 -5.13 120.64 119.81 1n6u n GLU 134 Ca -0.00 -1.20 -0.40 0.00 0.66 0.00 0.00 57.16 56.22 1n6u n GLU 134 Cb 0.12 0.29 0.02 0.00 0.27 0.00 0.00 31.44 32.13 1n6u n GLU 134 CO 0.00 0.00 0.00 -0.48 -0.41 0.00 0.00 177.13 176.24 1n6u s LEU 135 N 0.00 4.11 0.16 4.31 2.34 -0.82 -4.91 118.68 123.87 1n6u s LEU 135 Ca 0.09 2.88 -0.12 0.00 0.06 0.00 0.00 54.13 57.05 1n6u s LEU 135 Cb 0.11 -3.95 0.04 0.00 -0.56 0.00 0.00 46.19 41.82 1n6u s LEU 135 CO -0.05 -1.16 1.64 -0.61 -1.06 0.00 0.00 176.35 175.11 1n6u h GLN 136 N 2.32 0.88 -1.43 1.48 4.15 -1.93 -3.45 115.11 117.12 1n6u h GLN 136 Ca -0.51 -0.24 0.12 0.00 0.77 0.00 0.00 58.65 58.79 1n6u h GLN 136 Cb 1.27 -0.10 -0.28 0.00 0.21 0.00 0.00 27.48 28.57 1n6u h GLN 136 CO 0.61 0.87 0.51 0.12 -1.93 0.00 0.00 178.83 179.01 1n6u s PHE 137 N -5.17 -0.42 -0.07 3.99 5.36 -1.26 -4.84 117.98 115.57 1n6u s PHE 137 Ca -0.13 0.89 -0.10 0.00 -0.96 0.00 0.00 56.93 56.64 1n6u s PHE 137 Cb 0.12 0.33 -0.07 0.00 -0.34 0.00 0.00 43.02 43.06 1n6u s PHE 137 CO 0.81 -0.20 0.38 0.22 -1.46 0.00 0.00 175.22 174.97 1n6u h ASP 138 N 5.07 -0.20 -2.63 6.13 3.58 -1.95 -3.50 116.42 122.92 1n6u h ASP 138 Ca -0.28 -0.09 0.23 0.00 0.42 0.00 0.00 57.03 57.31 1n6u h ASP 138 Cb 1.18 0.05 -0.12 0.00 1.72 0.00 0.00 39.33 42.16 1n6u h ASP 138 CO 0.18 0.31 -0.80 0.00 -2.88 0.00 0.00 179.24 176.04 1n6u n LEU 139 N -4.92 -0.66 -4.95 2.28 -0.00 -1.26 -4.89 117.00 102.60 1n6u n LEU 139 Ca -0.04 1.54 -0.23 0.00 -0.00 0.00 0.00 56.01 57.28 1n6u n LEU 139 Cb 0.14 -2.64 -0.01 0.00 -0.00 0.00 0.00 43.42 40.91 1n6u n LEU 139 CO 0.11 -1.44 0.20 -0.44 -0.00 0.00 0.00 177.39 175.82 1n6u s SER 140 N -6.39 6.18 0.06 1.45 0.01 -0.92 -4.72 113.70 109.37 1n6u s SER 140 Ca 0.00 0.39 0.09 0.00 1.31 0.00 0.00 55.95 57.74 1n6u s SER 140 Cb 0.00 -1.89 -0.03 0.00 0.21 0.00 0.00 66.02 64.31 1n6u s SER 140 CO 0.00 -0.39 -0.26 -0.22 0.41 0.00 0.00 173.24 172.78 1n6u s LEU 141 N -4.37 2.19 -0.22 2.44 1.98 -1.26 -2.05 118.68 117.39 1n6u s LEU 141 Ca 0.42 -0.61 0.02 0.00 -2.89 0.00 0.00 54.13 51.07 1n6u s LEU 141 Cb -0.10 -1.24 0.04 0.00 0.66 0.00 0.00 46.19 45.55 1n6u s LEU 141 CO 0.36 0.23 -0.14 -0.69 -1.89 0.00 0.00 176.35 174.22 1n6u s VAL 142 N -0.85 2.20 -0.59 1.68 1.01 0.31 -3.88 120.40 120.29 1n6u s VAL 142 Ca 0.12 -1.27 -0.19 0.00 0.00 0.00 0.00 61.98 60.63 1n6u s VAL 142 Cb -0.10 -2.12 0.10 0.00 0.00 0.00 0.00 36.38 34.26 1n6u s VAL 142 CO 0.03 0.24 0.72 0.27 0.00 0.00 0.00 175.10 176.35 1n6u s ILE 143 N 1.21 4.78 -0.12 2.22 -0.00 0.48 -1.98 121.20 127.79 1n6u s ILE 143 Ca -0.02 -0.89 -0.25 0.00 -0.00 0.00 0.00 60.65 59.50 1n6u s ILE 143 Cb -0.17 -4.49 -0.02 0.00 -0.00 0.00 0.00 42.46 37.78 1n6u s ILE 143 CO -0.08 -1.12 0.78 -1.61 -0.00 0.00 0.00 174.94 172.90 1n6u s GLU 144 N 2.80 4.36 -0.25 0.37 2.02 -0.97 0.16 118.70 127.19 1n6u s GLU 144 Ca 0.13 0.96 -0.08 0.00 0.02 0.00 0.00 54.97 56.00 1n6u s GLU 144 Cb -0.23 -3.52 -0.03 0.00 0.10 0.00 0.00 34.13 30.45 1n6u s GLU 144 CO 0.07 -0.16 0.08 -2.00 0.02 0.00 0.00 175.26 173.27 1n6u s GLU 145 N 1.57 3.70 -0.64 1.61 -6.30 -0.54 -1.71 118.70 116.38 1n6u s GLU 145 Ca 0.38 -0.46 0.05 0.00 -2.50 0.00 0.00 54.97 52.44 1n6u s GLU 145 Cb -0.17 -3.35 0.31 0.00 0.00 0.00 0.00 34.13 30.92 1n6u s GLU 145 CO 0.15 -0.16 0.97 0.94 0.02 0.00 0.00 175.26 177.18 1n6u n GLN 146 N 4.85 3.23 -3.11 4.30 7.27 -0.76 0.00 117.38 133.16 1n6u n GLN 146 Ca -0.16 -4.79 -0.40 0.00 0.07 0.00 0.00 57.00 51.72 1n6u n GLN 146 Cb 0.52 -2.27 -0.06 0.00 2.41 0.00 0.00 30.24 30.84 1n6u n GLN 146 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 1n6u s SER 147 N -2.99 6.75 -1.00 1.69 1.04 0.14 -1.55 113.70 117.78 1n6u s SER 147 Ca 0.45 0.90 -0.21 0.00 0.48 0.00 0.00 55.95 57.57 1n6u s SER 147 Cb 0.23 -2.36 0.03 0.00 0.10 0.00 0.00 66.02 64.02 1n6u s SER 147 CO -0.09 -0.24 0.40 -1.84 0.98 0.00 0.00 173.24 172.46 1n6u n GLU 148 N 4.76 -0.52 0.00 4.02 0.28 -0.66 0.12 120.64 128.64 1n6u n GLU 148 Ca -0.01 -0.05 0.00 0.00 -0.16 0.00 0.00 57.16 56.94 1n6u n GLU 148 Cb 0.50 -1.91 0.00 0.00 1.43 0.00 0.00 31.44 31.46 1n6u n GLU 148 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1n6u n GLY 149 N -1.94 2.33 3.64 -1.84 0.00 -1.26 -5.01 105.19 101.11 1n6u n GLY 149 Ca -0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.37 5.06 -0.09 -0.61 1.01 0.31 -5.06 121.20 119.45 1n6u s ILE 150 Ca 0.00 0.98 0.02 0.00 0.00 0.00 0.00 60.65 61.65 1n6u s ILE 150 Cb 0.00 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 1n6u s ILE 150 CO 0.00 0.10 -0.16 0.68 0.00 0.00 0.00 174.94 175.57 1n6u s VAL 151 N 2.12 2.87 0.27 2.92 -7.23 -1.24 0.25 120.40 120.35 1n6u s VAL 151 Ca 0.24 -0.76 -0.07 0.00 -1.81 0.00 0.00 61.98 59.58 1n6u s VAL 151 Cb -0.16 -2.15 0.03 0.00 0.56 0.00 0.00 36.38 34.66 1n6u s VAL 151 CO 0.09 0.55 0.48 1.17 -0.31 0.00 0.00 175.10 177.08 1n6u n LYS 152 N 3.04 0.69 -3.94 4.82 3.00 0.10 -4.96 118.16 120.91 1n6u n LYS 152 Ca -0.18 -1.80 -0.18 0.00 -0.00 0.00 0.00 58.31 56.15 1n6u n LYS 152 Cb 0.52 1.99 -0.16 0.00 0.00 0.00 0.00 35.03 37.39 1n6u n LYS 152 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1n6u s LYS 153 N -2.29 0.38 0.14 1.64 0.00 -1.26 -1.47 119.74 116.87 1n6u s LYS 153 Ca 0.16 0.06 0.06 0.00 0.00 0.00 0.00 55.97 56.26 1n6u s LYS 153 Cb -0.02 -0.57 -0.04 0.00 0.00 0.00 0.00 37.83 37.20 1n6u s LYS 153 CO 0.12 -0.15 -0.01 -1.01 0.00 0.00 0.00 175.35 174.30 1n6u s HIS 154 N 1.11 2.88 -0.43 1.78 3.76 0.42 -4.90 115.29 119.91 1n6u s HIS 154 Ca -0.08 -0.11 0.07 0.00 -0.15 0.00 0.00 55.06 54.79 1n6u s HIS 154 Cb -0.13 -1.44 0.22 0.00 1.11 0.00 0.00 32.58 32.34 1n6u s HIS 154 CO -0.02 0.49 0.59 0.36 -0.85 0.00 0.00 174.74 175.31 1n6u n LYS 155 N 0.21 0.59 -1.60 1.40 -0.00 -1.26 0.18 118.16 117.68 1n6u n LYS 155 Ca -0.11 -2.74 -0.35 0.00 -0.00 0.00 0.00 58.31 55.12 1n6u n LYS 155 Cb 0.54 -1.40 0.08 0.00 -0.00 0.00 0.00 35.03 34.24 1n6u n LYS 155 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.40 175.26 1n6u s PRO 156 N -0.25 2.39 -0.16 -1.58 0.02 -1.25 -4.88 135.00 129.29 1n6u s PRO 156 Ca 0.33 1.76 -0.29 0.00 0.02 0.00 0.00 61.00 62.83 1n6u s PRO 156 Cb 0.13 -1.86 -0.06 0.00 0.02 0.00 0.00 34.50 32.73 1n6u s PRO 156 CO -0.15 -1.65 2.17 -1.91 -0.33 0.00 0.00 177.00 175.13 1n6u n GLU 157 N -2.41 2.17 -0.07 5.54 4.07 -1.26 -4.50 120.64 124.17 1n6u n GLU 157 Ca 0.13 0.65 0.04 0.00 -0.06 0.00 0.00 57.16 57.93 1n6u n GLU 157 Cb 0.50 -3.19 0.15 0.00 -0.06 0.00 0.00 31.44 28.85 1n6u n GLU 157 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 1n6u n ILE 158 N 7.25 0.20 -1.56 6.31 2.08 -1.26 -4.54 119.36 127.84 1n6u n ILE 158 Ca 0.28 -0.21 -0.13 0.00 0.56 0.00 0.00 62.75 63.24 1n6u n ILE 158 Cb 0.44 0.09 -0.08 0.00 -0.75 0.00 0.00 39.64 39.34 1n6u n ILE 158 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 1n6u n LYS 159 N -0.07 0.52 -0.99 0.38 4.81 -1.26 -0.38 118.16 121.17 1n6u n LYS 159 Ca 0.07 -0.85 0.00 0.00 -0.87 0.00 0.00 58.31 56.66 1n6u n LYS 159 Cb 0.15 -3.60 0.00 0.00 0.02 0.00 0.00 35.03 31.59 1n6u n LYS 159 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1n6u n GLY 160 N 6.74 0.41 0.02 3.14 0.00 -1.26 -4.91 105.19 109.33 1n6u n GLY 160 Ca 0.48 -0.90 0.08 0.00 0.00 0.00 0.00 46.02 45.69 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 1.63 0.04 -2.20 1.61 4.05 0.48 -4.40 115.26 116.47 1n6u n ASN 161 Ca 0.00 0.01 -0.23 0.00 0.45 0.00 0.00 54.58 54.82 1n6u n ASN 161 Cb 0.00 1.82 -0.01 0.00 1.23 0.00 0.00 39.78 42.82 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 -2.34 2.14 -1.38 1.20 2.81 -1.23 -4.30 117.12 114.02 1n6u n MET 162 Ca -0.07 -2.02 0.01 0.00 -1.81 0.00 0.00 57.70 53.80 1n6u n MET 162 Cb 0.64 -1.90 0.09 0.00 -0.71 0.00 0.00 33.22 31.34 1n6u n MET 162 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1n6u n SER 163 N 0.55 1.76 0.00 7.83 2.88 -1.25 -4.45 113.62 120.94 1n6u n SER 163 Ca 0.41 -2.91 0.00 0.00 -1.33 0.00 0.00 58.87 55.04 1n6u n SER 163 Cb 0.57 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.62 1n6u n SER 163 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1n6u n GLY 164 N -0.37 0.06 3.21 0.46 0.00 0.22 -3.83 105.19 104.94 1n6u n GLY 164 Ca 0.15 -0.86 -0.41 0.00 0.00 0.00 0.00 46.02 44.90 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 4.04 -4.47 1.61 6.94 -1.26 0.10 115.26 122.23 1n6u n ASN 165 Ca 0.00 -2.84 -0.51 0.00 -0.02 0.00 0.00 54.58 51.21 1n6u n ASN 165 Cb 0.00 -1.64 -0.05 0.00 -2.36 0.00 0.00 39.78 35.73 1n6u n ASN 165 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 1n6u n PHE 166 N 8.12 0.22 -3.89 -2.53 -0.00 0.42 -4.70 117.46 115.10 1n6u n PHE 166 Ca 0.50 0.94 -0.30 0.00 -0.00 0.00 0.00 57.45 58.58 1n6u n PHE 166 Cb 0.43 -2.06 -0.15 0.00 -0.00 0.00 0.00 39.48 37.70 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 -0.57 1.75 -0.01 -2.13 2.01 -1.26 -1.58 115.64 113.85 1n6u s THR 167 Ca 0.74 -2.13 0.08 0.00 0.31 0.00 0.00 61.69 60.69 1n6u s THR 167 Cb -1.01 -2.29 -0.02 0.00 0.01 0.00 0.00 72.50 69.19 1n6u s THR 167 CO 0.56 -0.67 -0.26 -0.47 -0.69 0.00 0.00 174.62 173.09 1n6u s TYR 168 N 1.00 2.30 -0.30 4.92 5.04 0.30 -5.00 117.35 125.62 1n6u s TYR 168 Ca 0.12 -0.43 0.03 0.00 -2.44 0.00 0.00 57.07 54.34 1n6u s TYR 168 Cb -0.19 -1.47 0.08 0.00 0.35 0.00 0.00 41.96 40.72 1n6u s TYR 168 CO -0.12 -0.02 -0.03 0.42 -1.34 0.00 0.00 175.55 174.46 1n6u s ILE 169 N -0.63 2.30 -0.45 3.14 -1.09 -1.26 0.13 121.20 123.34 1n6u s ILE 169 Ca 0.10 -1.93 -0.29 0.00 -2.23 0.00 0.00 60.65 56.30 1n6u s ILE 169 Cb -0.10 -2.51 0.01 0.00 -1.58 0.00 0.00 42.46 38.29 1n6u s ILE 169 CO -0.01 -0.29 1.39 -0.63 -1.23 0.00 0.00 174.94 174.18 1n6u s ILE 170 N 1.03 3.89 0.18 2.92 1.01 0.20 -4.78 121.20 125.65 1n6u s ILE 170 Ca -0.00 0.88 0.01 0.00 0.00 0.00 0.00 60.65 61.54 1n6u s ILE 170 Cb -0.20 -4.29 0.01 0.00 0.01 0.00 0.00 42.46 37.99 1n6u s ILE 170 CO -0.06 -0.88 0.06 -0.90 0.00 0.00 0.00 174.94 173.17 1n6u n ASP 171 N 8.96 2.09 -0.99 3.58 5.75 -1.26 0.12 116.55 134.80 1n6u n ASP 171 Ca 0.15 -1.72 -0.04 0.00 -0.01 0.00 0.00 54.79 53.18 1n6u n ASP 171 Cb 0.48 0.06 0.01 0.00 -1.03 0.00 0.00 41.12 40.65 1n6u n ASP 171 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1n6u n LYS 172 N -0.66 -1.22 -4.28 0.11 4.81 -1.26 -4.96 118.16 110.70 1n6u n LYS 172 Ca -0.04 0.13 -0.15 0.00 -0.87 0.00 0.00 58.31 57.37 1n6u n LYS 172 Cb 0.22 -3.02 -0.10 0.00 0.02 0.00 0.00 35.03 32.15 1n6u n LYS 172 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1n6u s LEU 173 N -1.99 2.53 -0.10 3.14 1.02 -1.22 -5.13 118.68 116.93 1n6u s LEU 173 Ca 0.09 -1.02 -0.05 0.00 0.02 0.00 0.00 54.13 53.16 1n6u s LEU 173 Cb -0.04 -0.43 -0.04 0.00 0.02 0.00 0.00 46.19 45.70 1n6u s LEU 173 CO 0.11 -0.29 0.12 -0.63 0.02 0.00 0.00 176.35 175.68 1n6u s ILE 174 N -3.24 5.27 0.61 -0.59 1.01 -1.26 -4.64 121.20 118.36 1n6u s ILE 174 Ca 0.18 0.07 -0.13 0.00 0.00 0.00 0.00 60.65 60.77 1n6u s ILE 174 Cb 0.02 -3.30 -0.12 0.00 0.01 0.00 0.00 42.46 39.07 1n6u s ILE 174 CO 0.02 0.58 -0.41 -2.65 0.00 0.00 0.00 174.94 172.49 1n6u n PRO 175 N 1.88 0.00 -2.55 2.79 -0.02 -1.12 -4.16 135.00 131.81 1n6u n PRO 175 Ca -0.19 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.29 1n6u n PRO 175 Cb 0.54 -0.77 0.00 0.00 -0.02 0.00 0.00 33.50 33.25 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 2.38 -5.92 -3.25 2.55 5.15 -1.25 -4.52 115.26 110.41 1n6u n ASN 176 Ca 0.02 -0.05 -0.24 0.00 -0.60 0.00 0.00 54.58 53.70 1n6u n ASN 176 Cb 0.40 -3.92 -0.08 0.00 -0.53 0.00 0.00 39.78 35.66 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 -1.52 -0.87 -2.09 -0.44 -1.04 -1.26 -4.87 114.28 102.18 1n6u n THR 177 Ca -0.00 -3.66 -0.43 0.00 -2.04 0.00 0.00 64.05 57.93 1n6u n THR 177 Cb 0.50 -1.69 -0.03 0.00 -1.82 0.00 0.00 70.33 67.29 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 -0.67 5.98 -0.00 8.00 2.20 -1.26 -4.36 114.94 124.83 1n6u s ASN 178 Ca 0.34 1.12 0.03 0.00 -0.94 0.00 0.00 52.86 53.42 1n6u s ASN 178 Cb 0.12 -2.53 -0.03 0.00 -2.00 0.00 0.00 41.25 36.80 1n6u s ASN 178 CO -0.15 -1.67 -0.08 -0.72 -2.94 0.00 0.00 177.10 171.55 1n6u s TYR 179 N 6.60 2.87 -0.44 1.54 -0.85 0.12 -1.65 117.35 125.54 1n6u s TYR 179 Ca 0.74 -0.05 -0.17 0.00 -0.52 0.00 0.00 57.07 57.07 1n6u s TYR 179 Cb -0.20 -1.61 0.04 0.00 0.38 0.00 0.00 41.96 40.57 1n6u s TYR 179 CO 0.33 0.36 0.43 0.00 -1.52 0.00 0.00 175.55 175.15 1n6u s VAL 181 N 2.04 5.26 0.29 0.00 1.01 0.13 -1.83 120.40 127.29 1n6u s VAL 181 Ca 0.10 0.20 0.06 0.00 0.00 0.00 0.00 61.98 62.34 1n6u s VAL 181 Cb -0.19 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 1n6u s VAL 181 CO 0.12 0.16 0.40 -0.55 0.00 0.00 0.00 175.10 175.22 1n6u s SER 182 N 1.72 6.08 -0.53 3.32 0.15 -0.69 -1.42 113.70 122.33 1n6u s SER 182 Ca 0.09 -0.09 0.04 0.00 0.70 0.00 0.00 55.95 56.69 1n6u s SER 182 Cb -0.16 -1.51 0.16 0.00 -1.71 0.00 0.00 66.02 62.80 1n6u s SER 182 CO 0.11 -0.25 0.37 -0.69 1.20 0.00 0.00 173.24 173.98 1n6u s VAL 183 N -2.09 1.56 0.06 4.45 1.01 -1.26 -2.29 120.40 121.84 1n6u s VAL 183 Ca 0.39 -3.23 0.05 0.00 0.00 0.00 0.00 61.98 59.19 1n6u s VAL 183 Cb -0.09 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1n6u s VAL 183 CO 0.30 -1.06 -0.08 -0.72 0.00 0.00 0.00 175.10 173.54 1n6u s TYR 184 N -0.43 2.83 0.45 5.22 -0.85 -0.84 -4.28 117.35 119.45 1n6u s TYR 184 Ca 0.26 -0.10 -0.03 0.00 -0.52 0.00 0.00 57.07 56.68 1n6u s TYR 184 Cb -0.06 -1.52 -0.03 0.00 0.38 0.00 0.00 41.96 40.73 1n6u s TYR 184 CO -0.13 0.41 0.72 -0.48 -1.52 0.00 0.00 175.55 174.54 1n6u s LEU 185 N -1.89 3.69 0.04 -3.49 2.34 -1.26 0.11 118.68 118.22 1n6u s LEU 185 Ca 0.20 0.69 -0.14 0.00 0.06 0.00 0.00 54.13 54.94 1n6u s LEU 185 Cb -0.11 -3.60 0.02 0.00 -0.56 0.00 0.00 46.19 41.94 1n6u s LEU 185 CO 0.12 -0.57 0.31 -1.83 -1.06 0.00 0.00 176.35 173.32 1n6u s GLU 186 N -4.63 0.82 0.00 1.48 4.04 -0.87 -4.38 118.70 115.15 1n6u s GLU 186 Ca 0.46 -0.49 0.00 0.00 0.04 0.00 0.00 54.97 54.98 1n6u s GLU 186 Cb -0.10 0.35 0.00 0.00 0.02 0.00 0.00 34.13 34.40 1n6u s GLU 186 CO 0.42 -0.26 0.00 -2.39 -1.84 0.00 0.00 175.26 171.18 1n6u n HIS 187 N 0.58 0.00 -2.37 4.83 1.44 -1.26 -2.16 115.22 116.28 1n6u n HIS 187 Ca -0.19 0.00 -0.00 0.00 -2.01 0.00 0.00 57.72 55.52 1n6u n HIS 187 Cb 0.59 0.23 0.00 0.00 0.12 0.00 0.00 29.99 30.94 1n6u n HIS 187 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 1n6u n SER 188 N -2.28 -0.07 -3.52 4.39 7.64 -1.26 -4.97 113.62 113.56 1n6u n SER 188 Ca 0.00 -0.92 -0.15 0.00 1.01 0.00 0.00 58.87 58.81 1n6u n SER 188 Cb 0.12 0.03 -0.05 0.00 -1.01 0.00 0.00 64.21 63.30 1n6u n SER 188 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1n6u s ASP 189 N -0.05 -0.56 -0.46 6.43 -1.08 -1.26 -5.03 116.67 114.66 1n6u s ASP 189 Ca 0.00 0.51 0.03 0.00 -0.52 0.00 0.00 52.55 52.58 1n6u s ASP 189 Cb 0.02 0.48 0.61 0.00 -1.46 0.00 0.00 42.92 42.57 1n6u s ASP 189 CO -0.01 -0.58 1.91 1.21 0.52 0.00 0.00 175.17 178.22 1n6u n GLU 190 N 0.65 2.26 0.00 4.34 2.13 -1.26 -3.98 120.64 124.77 1n6u n GLU 190 Ca -0.16 -2.93 0.00 0.00 0.66 0.00 0.00 57.16 54.73 1n6u n GLU 190 Cb 0.58 -2.15 0.00 0.00 0.27 0.00 0.00 31.44 30.15 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 -1.05 4.06 -1.24 5.31 10.64 -1.26 -4.73 117.38 129.11 1n6u n GLN 191 Ca 0.58 -0.05 -0.26 0.00 -1.83 0.00 0.00 57.00 55.44 1n6u n GLN 191 Cb 1.50 -0.41 0.03 0.00 -0.86 0.00 0.00 30.24 30.49 1n6u n GLN 191 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1n6u n ALA 192 N -0.59 5.88 -2.92 2.61 0.00 -1.26 -4.89 120.51 119.34 1n6u n ALA 192 Ca 0.00 -2.69 -0.44 0.00 0.00 0.00 0.00 53.44 50.31 1n6u n ALA 192 Cb 0.01 -1.71 -0.03 0.00 0.00 0.00 0.00 19.45 17.72 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 -3.26 4.69 -1.21 0.00 -7.23 -1.26 -4.35 120.40 107.78 1n6u s VAL 193 Ca 0.48 -1.45 -0.07 0.00 -1.81 0.00 0.00 61.98 59.13 1n6u s VAL 193 Cb 0.37 -4.77 -0.02 0.00 0.56 0.00 0.00 36.38 32.52 1n6u s VAL 193 CO -0.09 -1.50 2.82 -0.38 -0.31 0.00 0.00 175.10 175.63 1n6u n ILE 194 N 5.55 4.41 -2.06 -0.62 2.08 -1.26 -4.91 119.36 122.54 1n6u n ILE 194 Ca 0.21 -3.12 -0.40 0.00 0.56 0.00 0.00 62.75 59.99 1n6u n ILE 194 Cb 0.49 -2.25 -0.03 0.00 -0.75 0.00 0.00 39.64 37.10 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 0.44 2.91 0.73 0.38 2.20 -1.26 -3.83 119.74 121.32 1n6u s LYS 195 Ca 0.63 0.85 -0.11 0.00 -0.36 0.00 0.00 55.97 56.98 1n6u s LYS 195 Cb 0.22 -4.30 0.03 0.00 -1.51 0.00 0.00 37.83 32.27 1n6u s LYS 195 CO -0.08 -2.38 1.09 -1.54 -0.36 0.00 0.00 175.35 172.08 1n6u s SER 196 N 7.11 5.12 -0.42 1.43 1.04 -1.26 -4.90 113.70 121.83 1n6u s SER 196 Ca 0.70 1.25 -0.33 0.00 0.48 0.00 0.00 55.95 58.04 1n6u s SER 196 Cb -0.15 -2.04 -0.12 0.00 0.10 0.00 0.00 66.02 63.81 1n6u s SER 196 CO 0.25 -1.56 2.27 -2.65 0.98 0.00 0.00 173.24 172.53 1n6u n PRO 197 N -3.16 1.00 -0.68 4.02 -0.02 -1.26 -4.48 135.00 130.42 1n6u n PRO 197 Ca 0.07 0.23 -0.19 0.00 -2.02 0.00 0.00 63.50 61.60 1n6u n PRO 197 Cb 0.56 -2.53 0.09 0.00 -0.02 0.00 0.00 33.50 31.61 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 10.78 -1.91 -3.88 2.45 4.77 -1.26 -4.90 117.00 123.05 1n6u n LEU 198 Ca 0.43 -0.20 -0.30 0.00 -0.03 0.00 0.00 56.01 55.91 1n6u n LEU 198 Cb 0.26 -0.68 -0.16 0.00 -2.33 0.00 0.00 43.42 40.52 1n6u n LEU 198 CO 0.77 -2.79 -0.39 -0.75 -1.33 0.00 0.00 177.39 172.89 1n6u s LYS 199 N -2.85 1.31 -1.23 3.23 2.20 -0.51 -4.79 119.74 117.10 1n6u s LYS 199 Ca 0.29 -0.97 -0.11 0.00 -0.36 0.00 0.00 55.97 54.82 1n6u s LYS 199 Cb -0.02 -2.47 0.18 0.00 -1.51 0.00 0.00 37.83 34.01 1n6u s LYS 199 CO 0.34 -0.69 1.58 0.00 -0.36 0.00 0.00 175.35 176.23 1n6u s THR 201 N 0.82 4.90 0.20 0.00 -1.32 0.07 -4.71 115.64 115.60 1n6u s THR 201 Ca 0.41 0.35 0.08 0.00 -1.21 0.00 0.00 61.69 61.31 1n6u s THR 201 Cb 0.02 -3.73 -0.05 0.00 -1.51 0.00 0.00 72.50 67.23 1n6u s THR 201 CO 0.00 -0.42 -0.15 -0.22 -2.21 0.00 0.00 174.62 171.63 1n6u s LEU 202 N -3.68 2.55 0.24 9.08 2.96 -1.26 0.14 118.68 128.70 1n6u s LEU 202 Ca 0.48 -1.01 0.07 0.00 -0.22 0.00 0.00 54.13 53.45 1n6u s LEU 202 Cb -0.10 -0.68 -0.04 0.00 0.50 0.00 0.00 46.19 45.87 1n6u s LEU 202 CO 0.30 -0.16 0.19 -1.48 -1.32 0.00 0.00 176.35 173.88 1n6u s LEU 203 N -3.26 3.82 -0.54 -0.68 2.34 -1.26 -4.09 118.68 115.00 1n6u s LEU 203 Ca 0.22 -0.22 -0.29 0.00 0.06 0.00 0.00 54.13 53.89 1n6u s LEU 203 Cb -0.01 -2.36 -0.11 0.00 -0.56 0.00 0.00 46.19 43.15 1n6u s LEU 203 CO 0.07 -0.02 2.42 -0.81 -1.06 0.00 0.00 176.35 176.94 1n6u n PRO 204 N -1.03 0.92 -1.91 1.48 -0.04 -1.26 -3.99 135.00 129.17 1n6u n PRO 204 Ca -0.08 0.10 -0.43 0.00 -0.04 0.00 0.00 63.50 63.05 1n6u n PRO 204 Cb 0.57 -2.84 -0.03 0.00 -0.04 0.00 0.00 33.50 31.16 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 7.87 3.33 0.01 0.54 0.04 -1.26 -3.82 135.00 141.71 1n6u s PRO 205 Ca 1.08 1.60 0.06 0.00 0.04 0.00 0.00 61.00 63.79 1n6u s PRO 205 Cb -0.54 -4.23 0.27 0.00 0.04 0.00 0.00 34.50 30.04 1n6u s PRO 205 CO 0.36 -1.86 1.20 0.41 0.04 0.00 0.00 177.00 177.15 1n6u n GLY 206 N 5.44 -0.70 0.02 0.56 0.00 -1.26 -4.78 105.19 104.47 1n6u n GLY 206 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1n6u n GLY 206 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1n6u n GLN 207 N -1.53 -0.06 -0.04 1.61 6.02 -1.26 -4.97 117.38 117.15 1n6u n GLN 207 Ca 0.01 0.05 -0.01 0.00 -0.01 0.00 0.00 57.00 57.04 1n6u n GLN 207 Cb 0.07 -0.05 -0.00 0.00 1.02 0.00 0.00 30.24 31.27 1n6u n GLN 207 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1n6u h GLU 208 N 0.02 0.00 0.00 -1.09 4.39 -1.96 -3.50 114.58 112.43 1n6u h GLU 208 Ca 0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 1n6u h GLU 208 Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1n6u h GLU 208 CO 0.00 0.00 -0.01 0.43 -1.16 0.00 0.00 179.01 178.27 1n6u n SER 209 N -3.89 -4.46 -3.96 1.42 7.64 -1.26 -4.80 113.62 104.32 1n6u n SER 209 Ca -0.01 0.02 -0.17 0.00 1.01 0.00 0.00 58.87 59.73 1n6u n SER 209 Cb 0.03 -0.06 -0.15 0.00 -1.01 0.00 0.00 64.21 63.02 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 -0.04 0.52 -1.35 1.43 2.02 -1.26 -4.83 118.70 115.20 1n6u s GLU 210 Ca 0.00 -0.20 -0.08 0.00 0.02 0.00 0.00 54.97 54.71 1n6u s GLU 210 Cb 0.00 -0.51 0.01 0.00 0.10 0.00 0.00 34.13 33.74 1n6u s GLU 210 CO 0.00 0.11 1.14 1.19 0.02 0.00 0.00 175.26 177.72 1n6u n PHE 211 N 3.06 -2.75 -1.61 1.61 3.01 -1.26 -5.33 117.46 114.19 1n6u n PHE 211 Ca -0.14 1.00 0.00 0.00 1.01 0.00 0.00 57.45 59.31 1n6u n PHE 211 Cb 0.57 -4.98 0.00 0.00 -0.01 0.00 0.00 39.48 35.06 1n6u n PHE 211 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64