#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 3.61 0.55 1.43 -0.85 -1.26 -4.95 117.35 115.88 1n6u s TYR 2 Ca 0.00 0.91 0.00 0.00 -0.52 0.00 0.00 57.07 57.46 1n6u s TYR 2 Cb 0.00 -2.25 0.00 0.00 0.38 0.00 0.00 41.96 40.09 1n6u s TYR 2 CO 0.00 0.50 0.00 -0.25 -1.52 0.00 0.00 175.55 174.28 1n6u n ASP 3 N 0.96 -8.28 -3.82 -0.18 8.00 -1.26 -5.03 116.55 106.93 1n6u n ASP 3 Ca -0.08 1.23 -0.09 0.00 0.71 0.00 0.00 54.79 56.56 1n6u n ASP 3 Cb 0.52 -4.80 -0.07 0.00 -0.02 0.00 0.00 41.12 36.76 1n6u n ASP 3 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1n6u s SER 4 N -7.25 0.07 0.24 -2.24 0.01 -1.26 -5.06 113.70 98.21 1n6u s SER 4 Ca 0.00 -0.60 -0.05 0.00 1.31 0.00 0.00 55.95 56.61 1n6u s SER 4 Cb 0.00 0.36 0.43 0.00 0.21 0.00 0.00 66.02 67.02 1n6u s SER 4 CO 0.00 -0.75 1.74 -0.65 0.41 0.00 0.00 173.24 173.99 1n6u h PRO 5 N 2.69 0.46 -6.85 12.44 0.11 -2.04 -3.41 132.00 135.40 1n6u h PRO 5 Ca -0.34 -0.03 -0.48 0.00 0.11 0.00 0.00 66.00 65.27 1n6u h PRO 5 Cb 1.21 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1n6u h PRO 5 CO 0.55 0.30 0.36 0.34 -0.21 0.00 0.00 178.00 179.34 1n6u s ASP 6 N -5.37 7.36 -0.24 -2.05 -1.08 -1.26 -4.98 116.67 109.04 1n6u s ASP 6 Ca -0.12 1.91 0.21 0.00 -0.52 0.00 0.00 52.55 54.03 1n6u s ASP 6 Cb 0.20 -2.59 0.49 0.00 -1.46 0.00 0.00 42.92 39.56 1n6u s ASP 6 CO 0.76 -0.06 1.13 -1.22 0.52 0.00 0.00 175.17 176.31 1n6u n TYR 7 N 0.78 1.33 -3.11 -5.34 4.01 -1.26 -4.96 117.16 108.61 1n6u n TYR 7 Ca 0.01 -1.98 -0.11 0.00 -0.16 0.00 0.00 57.90 55.66 1n6u n TYR 7 Cb 0.49 -0.24 -0.04 0.00 -0.31 0.00 0.00 39.34 39.24 1n6u n TYR 7 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1n6u s THR 8 N -3.55 -0.58 -0.36 -0.72 -1.32 -1.26 -5.08 115.64 102.77 1n6u s THR 8 Ca 0.31 -1.15 0.03 0.00 -1.21 0.00 0.00 61.69 59.67 1n6u s THR 8 Cb 0.34 -0.40 0.15 0.00 -1.51 0.00 0.00 72.50 71.08 1n6u s THR 8 CO -0.04 -0.39 0.37 -0.62 -2.21 0.00 0.00 174.62 171.73 1n6u s ASP 9 N 1.01 1.22 -0.22 8.08 -1.08 -1.26 -4.80 116.67 119.62 1n6u s ASP 9 Ca 0.25 -1.46 -0.03 0.00 -0.52 0.00 0.00 52.55 50.80 1n6u s ASP 9 Cb -0.04 0.56 0.01 0.00 -1.46 0.00 0.00 42.92 41.99 1n6u s ASP 9 CO -0.08 -0.28 0.05 1.21 0.52 0.00 0.00 175.17 176.60 1n6u n GLU 10 N 4.40 -3.11 -0.01 4.34 2.13 0.32 -4.87 120.64 123.85 1n6u n GLU 10 Ca 0.09 2.53 0.10 0.00 0.66 0.00 0.00 57.16 60.54 1n6u n GLU 10 Cb 0.45 -4.37 -0.14 0.00 0.27 0.00 0.00 31.44 27.65 1n6u n GLU 10 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1n6u n SER 11 N 1.11 0.61 -3.20 4.31 7.64 -0.90 -4.79 113.62 118.39 1n6u n SER 11 Ca -0.09 -0.20 -0.22 0.00 1.01 0.00 0.00 58.87 59.37 1n6u n SER 11 Cb 0.22 1.70 -0.04 0.00 -1.01 0.00 0.00 64.21 65.08 1n6u n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1n6u s THR 13 N -2.29 5.31 -0.32 0.00 2.01 -1.05 -4.83 115.64 114.48 1n6u s THR 13 Ca 0.44 0.19 -0.13 0.00 0.31 0.00 0.00 61.69 62.50 1n6u s THR 13 Cb -0.25 -3.53 -0.03 0.00 0.01 0.00 0.00 72.50 68.70 1n6u s THR 13 CO 0.53 0.27 0.26 -0.36 -0.69 0.00 0.00 174.62 174.63 1n6u s PHE 14 N 1.63 3.22 -0.09 4.92 0.08 -1.25 0.20 117.98 126.70 1n6u s PHE 14 Ca 0.07 -0.06 -0.08 0.00 0.12 0.00 0.00 56.93 56.98 1n6u s PHE 14 Cb -0.16 -2.49 -0.04 0.00 -0.57 0.00 0.00 43.02 39.76 1n6u s PHE 14 CO 0.10 -0.32 0.20 0.21 -0.10 0.00 0.00 175.22 175.31 1n6u s LYS 15 N 1.80 3.54 -0.12 0.44 2.47 0.19 -4.83 119.74 123.23 1n6u s LYS 15 Ca 0.08 -0.03 0.00 0.00 -1.56 0.00 0.00 55.97 54.46 1n6u s LYS 15 Cb -0.17 -3.19 -0.02 0.00 -1.46 0.00 0.00 37.83 33.00 1n6u s LYS 15 CO 0.11 0.75 -0.13 -1.50 0.16 0.00 0.00 175.35 174.75 1n6u s ILE 16 N -1.06 3.11 0.54 5.43 -1.16 -1.26 0.24 121.20 127.03 1n6u s ILE 16 Ca 0.18 -0.65 0.03 0.00 -0.51 0.00 0.00 60.65 59.70 1n6u s ILE 16 Cb -0.13 -2.30 0.02 0.00 0.61 0.00 0.00 42.46 40.66 1n6u s ILE 16 CO 0.07 0.53 0.21 -0.44 -2.81 0.00 0.00 174.94 172.50 1n6u s SER 17 N 0.21 4.39 -0.36 4.50 0.01 0.29 -4.43 113.70 118.31 1n6u s SER 17 Ca -0.08 -1.49 0.04 0.00 1.31 0.00 0.00 55.95 55.73 1n6u s SER 17 Cb -0.15 0.58 0.16 0.00 0.21 0.00 0.00 66.02 66.82 1n6u s SER 17 CO 0.05 -1.03 0.44 -0.22 0.41 0.00 0.00 173.24 172.89 1n6u s LEU 18 N -4.10 -0.60 -0.24 2.44 2.96 0.39 -2.66 118.68 116.86 1n6u s LEU 18 Ca 0.17 -1.05 -0.15 0.00 -0.22 0.00 0.00 54.13 52.88 1n6u s LEU 18 Cb -0.01 1.04 -0.04 0.00 0.50 0.00 0.00 46.19 47.68 1n6u s LEU 18 CO 0.11 -0.27 0.36 -0.60 -1.32 0.00 0.00 176.35 174.63 1n6u s ARG 19 N 1.85 4.08 -1.42 1.98 3.52 0.29 -3.78 118.95 125.47 1n6u s ARG 19 Ca 0.15 0.07 -0.00 0.00 -0.13 0.00 0.00 55.73 55.82 1n6u s ARG 19 Cb -0.12 -3.60 0.00 0.00 -1.56 0.00 0.00 34.95 29.67 1n6u s ARG 19 CO -0.12 -0.17 0.38 0.09 -0.81 0.00 0.00 175.30 174.67 1n6u n ASN 20 N 4.95 -0.18 -3.71 -2.12 4.13 -1.26 0.11 115.26 117.18 1n6u n ASN 20 Ca -0.09 -1.03 -0.28 0.00 1.68 0.00 0.00 54.58 54.85 1n6u n ASN 20 Cb 0.51 -2.92 0.00 0.00 -1.54 0.00 0.00 39.78 35.83 1n6u n ASN 20 CO 0.00 0.00 0.00 2.22 0.28 0.00 0.00 177.26 179.76 1n6u n PHE 21 N -4.42 -1.95 -4.90 3.10 1.16 -1.26 -4.84 117.46 104.35 1n6u n PHE 21 Ca -0.31 0.68 -0.33 0.00 -1.87 0.00 0.00 57.45 55.62 1n6u n PHE 21 Cb 0.69 -3.33 -0.14 0.00 -1.61 0.00 0.00 39.48 35.09 1n6u n PHE 21 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 1n6u s ARG 22 N -6.40 2.82 0.10 3.97 0.52 0.31 -5.01 118.95 115.27 1n6u s ARG 22 Ca 0.56 -0.72 -0.19 0.00 -0.52 0.00 0.00 55.73 54.86 1n6u s ARG 22 Cb -0.29 -2.44 -0.07 0.00 0.52 0.00 0.00 34.95 32.67 1n6u s ARG 22 CO 0.69 0.45 0.59 0.45 0.02 0.00 0.00 175.30 177.49 1n6u s SER 23 N -0.28 7.03 -0.27 0.23 0.15 -0.41 -0.54 113.70 119.60 1n6u s SER 23 Ca 0.02 1.26 -0.00 0.00 0.70 0.00 0.00 55.95 57.92 1n6u s SER 23 Cb -0.13 -2.36 0.14 0.00 -1.71 0.00 0.00 66.02 61.97 1n6u s SER 23 CO 0.03 0.22 0.36 -0.63 1.20 0.00 0.00 173.24 174.42 1n6u s ILE 24 N -1.22 -0.55 -0.13 6.45 1.01 -1.09 0.18 121.20 125.86 1n6u s ILE 24 Ca 0.32 -0.28 -0.15 0.00 0.00 0.00 0.00 60.65 60.54 1n6u s ILE 24 Cb -0.19 -0.93 -0.05 0.00 0.01 0.00 0.00 42.46 41.31 1n6u s ILE 24 CO 0.19 -0.29 0.35 -1.48 0.00 0.00 0.00 174.94 173.72 1n6u s LEU 25 N 2.48 4.28 0.54 2.97 0.05 0.11 -0.55 118.68 128.57 1n6u s LEU 25 Ca 0.10 0.65 0.02 0.00 0.05 0.00 0.00 54.13 54.95 1n6u s LEU 25 Cb -0.14 -2.48 0.02 0.00 -2.05 0.00 0.00 46.19 41.54 1n6u s LEU 25 CO -0.26 0.11 0.18 -0.94 -0.55 0.00 0.00 176.35 174.89 1n6u s SER 26 N 0.29 4.36 0.06 1.48 1.04 0.65 -0.16 113.70 121.42 1n6u s SER 26 Ca 0.20 -1.52 -0.03 0.00 0.48 0.00 0.00 55.95 55.08 1n6u s SER 26 Cb -0.14 0.61 -0.03 0.00 0.10 0.00 0.00 66.02 66.56 1n6u s SER 26 CO 0.07 -1.03 0.03 -1.66 0.98 0.00 0.00 173.24 171.63 1n6u s TRP 27 N -2.86 0.41 -0.53 5.02 -2.14 -1.26 0.56 118.94 118.15 1n6u s TRP 27 Ca 0.15 -0.93 0.05 0.00 2.66 0.00 0.00 56.10 58.03 1n6u s TRP 27 Cb -0.01 -0.30 0.17 0.00 -3.10 0.00 0.00 33.47 30.24 1n6u s TRP 27 CO 0.09 -0.42 0.41 0.39 -2.66 0.00 0.00 176.95 174.76 1n6u n GLU 28 N 0.08 0.86 -3.99 3.25 -0.58 0.54 -4.77 120.64 116.03 1n6u n GLU 28 Ca -0.14 -3.70 -0.33 0.00 -0.42 0.00 0.00 57.16 52.57 1n6u n GLU 28 Cb 0.61 -1.90 -0.14 0.00 -0.57 0.00 0.00 31.44 29.44 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 -0.60 4.14 -0.00 -4.62 -0.00 -1.26 0.75 118.68 117.08 1n6u s LEU 29 Ca 0.30 -1.67 -0.06 0.00 -0.00 0.00 0.00 54.13 52.70 1n6u s LEU 29 Cb 0.01 -1.64 -0.05 0.00 -0.00 0.00 0.00 46.19 44.52 1n6u s LEU 29 CO -0.18 -0.30 0.25 -0.75 -0.00 0.00 0.00 176.35 175.36 1n6u s LYS 30 N 1.08 3.55 0.17 1.48 2.47 -1.26 -4.84 119.74 122.39 1n6u s LYS 30 Ca -0.00 -0.11 0.11 0.00 -1.56 0.00 0.00 55.97 54.41 1n6u s LYS 30 Cb -0.20 -3.09 -0.04 0.00 -1.46 0.00 0.00 37.83 33.04 1n6u s LYS 30 CO -0.05 0.66 -0.24 -0.80 0.16 0.00 0.00 175.35 175.08 1n6u s ASN 31 N -1.69 3.34 0.01 1.43 -0.87 -1.26 0.12 114.94 116.02 1n6u s ASN 31 Ca 0.27 -0.84 0.00 0.00 -1.57 0.00 0.00 52.86 50.72 1n6u s ASN 31 Cb -0.13 -0.24 0.00 0.00 -0.02 0.00 0.00 41.25 40.86 1n6u s ASN 31 CO 0.16 0.12 0.00 1.41 -2.57 0.00 0.00 177.10 176.22 1n6u n HIS 32 N 0.44 -0.00 0.00 2.20 8.25 -1.26 -4.92 115.22 119.92 1n6u n HIS 32 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 1n6u n HIS 32 Cb 0.55 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.66 1n6u n HIS 32 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1n6u n SER 33 N -3.07 0.00 -4.77 0.41 3.41 -1.26 -4.92 113.62 103.42 1n6u n SER 33 Ca 0.00 0.28 -0.35 0.00 -0.26 0.00 0.00 58.87 58.54 1n6u n SER 33 Cb 0.43 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 1n6u n SER 33 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1n6u s ILE 34 N -0.67 3.19 -0.70 -1.33 -1.09 -1.26 -5.00 121.20 114.34 1n6u s ILE 34 Ca 0.00 0.74 -0.06 0.00 -2.23 0.00 0.00 60.65 59.10 1n6u s ILE 34 Cb 0.00 -3.29 0.18 0.00 -1.58 0.00 0.00 42.46 37.77 1n6u s ILE 34 CO 0.00 -0.17 0.55 -0.69 -1.23 0.00 0.00 174.94 173.41 1n6u s VAL 35 N -1.79 4.32 0.56 2.92 1.01 -1.26 -4.77 120.40 121.38 1n6u s VAL 35 Ca 0.72 -2.86 -0.15 0.00 0.00 0.00 0.00 61.98 59.70 1n6u s VAL 35 Cb -0.23 -3.75 -0.06 0.00 0.00 0.00 0.00 36.38 32.34 1n6u s VAL 35 CO 0.27 -0.93 1.01 -2.16 0.00 0.00 0.00 175.10 173.29 1n6u s PRO 36 N -0.06 3.73 0.17 2.72 0.04 -1.26 -4.27 135.00 136.06 1n6u s PRO 36 Ca 0.18 0.94 0.00 0.00 0.04 0.00 0.00 61.00 62.16 1n6u s PRO 36 Cb -0.17 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1n6u s PRO 36 CO -0.05 -0.46 0.00 -2.37 0.04 0.00 0.00 177.00 174.16 1n6u n THR 37 N -1.99 0.00 -3.35 1.26 5.66 -1.26 -4.90 114.28 109.70 1n6u n THR 37 Ca 0.07 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.75 1n6u n THR 37 Cb 0.54 -0.50 -0.05 0.00 -1.55 0.00 0.00 70.33 68.77 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 3.43 0.27 1.09 -3.43 -1.26 -4.06 115.29 109.33 1n6u s HIS 38 Ca 0.00 0.87 0.02 0.00 -0.80 0.00 0.00 55.06 55.15 1n6u s HIS 38 Cb 0.00 -2.27 -0.05 0.00 -1.43 0.00 0.00 32.58 28.84 1n6u s HIS 38 CO 0.00 0.22 0.11 0.71 -2.00 0.00 0.00 174.74 173.78 1n6u s TYR 39 N -1.90 1.55 -0.27 0.38 2.02 0.32 -3.59 117.35 115.86 1n6u s TYR 39 Ca 0.48 -1.24 -0.04 0.00 -0.37 0.00 0.00 57.07 55.89 1n6u s TYR 39 Cb -0.11 -0.89 0.09 0.00 -0.40 0.00 0.00 41.96 40.66 1n6u s TYR 39 CO 0.23 -0.39 0.12 0.99 -1.57 0.00 0.00 175.55 174.93 1n6u s THR 40 N -3.71 -0.07 -0.42 -0.71 2.01 -0.31 0.21 115.64 112.64 1n6u s THR 40 Ca 0.37 -0.65 -0.29 0.00 0.31 0.00 0.00 61.69 61.43 1n6u s THR 40 Cb 0.07 -0.91 0.00 0.00 0.01 0.00 0.00 72.50 71.67 1n6u s THR 40 CO 0.15 -0.65 1.50 -0.22 -0.69 0.00 0.00 174.62 174.71 1n6u s LEU 41 N 2.11 3.54 -0.05 4.42 1.98 -0.40 -1.48 118.68 128.80 1n6u s LEU 41 Ca 0.08 0.85 0.01 0.00 -2.89 0.00 0.00 54.13 52.18 1n6u s LEU 41 Cb -0.16 -3.46 -0.03 0.00 0.66 0.00 0.00 46.19 43.20 1n6u s LEU 41 CO -0.32 -1.55 -0.07 -0.76 -1.89 0.00 0.00 176.35 171.76 1n6u s LEU 42 N 5.90 3.15 0.02 -0.68 1.43 -0.70 -2.49 118.68 125.32 1n6u s LEU 42 Ca 0.64 -0.05 -0.06 0.00 -1.03 0.00 0.00 54.13 53.63 1n6u s LEU 42 Cb -0.15 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 1n6u s LEU 42 CO 0.32 0.35 0.11 -0.72 0.23 0.00 0.00 176.35 176.63 1n6u s TYR 43 N -0.84 0.14 0.37 0.29 -0.85 -0.91 0.43 117.35 115.97 1n6u s TYR 43 Ca 0.13 -0.35 -0.05 0.00 -0.52 0.00 0.00 57.07 56.28 1n6u s TYR 43 Cb -0.11 -0.10 0.02 0.00 0.38 0.00 0.00 41.96 42.15 1n6u s TYR 43 CO 0.02 -0.33 0.58 -2.37 -1.52 0.00 0.00 175.55 171.94 1n6u n THR 44 N 1.09 0.00 -4.21 -3.49 5.66 0.30 0.28 114.28 113.91 1n6u n THR 44 Ca -0.21 -1.64 -0.34 0.00 -3.05 0.00 0.00 64.05 58.81 1n6u n THR 44 Cb 0.57 1.10 -0.12 0.00 -1.55 0.00 0.00 70.33 70.33 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 -2.65 3.98 0.29 1.09 -0.00 -1.24 0.73 121.20 123.40 1n6u s ILE 45 Ca 0.27 -0.31 0.02 0.00 -0.00 0.00 0.00 60.65 60.62 1n6u s ILE 45 Cb -0.02 -2.78 0.40 0.00 -0.00 0.00 0.00 42.46 40.06 1n6u s ILE 45 CO 0.19 0.46 1.48 0.80 -0.00 0.00 0.00 174.94 177.87 1n6u n MET 46 N 3.89 -0.08 0.23 0.37 0.00 0.15 0.22 117.12 121.91 1n6u n MET 46 Ca -0.17 1.42 0.07 0.00 -0.00 0.00 0.00 57.70 59.02 1n6u n MET 46 Cb 0.52 -2.25 0.55 0.00 0.00 0.00 0.00 33.22 32.04 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 0.00 -2.14 6.12 0.87 -1.95 -3.25 113.55 113.20 1n6u h SER 47 Ca 0.57 0.00 -0.56 0.00 -1.23 0.00 0.00 61.79 60.58 1n6u h SER 47 Cb 1.17 0.00 -0.41 0.00 -0.44 0.00 0.00 62.40 62.72 1n6u h SER 47 CO -0.89 0.20 -0.87 0.29 -0.53 0.00 0.00 176.83 175.03 1n6u n LYS 48 N -4.03 2.04 0.05 2.24 4.76 0.61 -4.91 118.16 118.93 1n6u n LYS 48 Ca -0.02 -4.14 0.04 0.00 -2.87 0.00 0.00 58.31 51.32 1n6u n LYS 48 Cb 0.28 -1.92 0.21 0.00 -1.84 0.00 0.00 35.03 31.75 1n6u n LYS 48 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1n6u n PRO 49 N 0.40 0.05 0.00 1.97 -0.02 -0.37 -1.01 135.00 136.02 1n6u n PRO 49 Ca 0.27 0.53 0.15 0.00 -2.02 0.00 0.00 63.50 62.43 1n6u n PRO 49 Cb 0.49 -1.65 0.70 0.00 -0.02 0.00 0.00 33.50 33.02 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 -1.76 1.13 -2.89 -0.52 1.02 -1.26 -4.20 120.64 112.17 1n6u n GLU 50 Ca -0.00 -0.40 -0.33 0.00 -0.02 0.00 0.00 57.16 56.41 1n6u n GLU 50 Cb 0.03 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 29.93 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 -0.58 5.53 -4.82 1.62 2.03 -0.18 -5.04 116.55 115.11 1n6u n ASP 51 Ca 0.19 -3.65 -0.37 0.00 0.52 0.00 0.00 54.79 51.48 1n6u n ASP 51 Cb 0.25 -0.82 -0.06 0.00 -0.72 0.00 0.00 41.12 39.76 1n6u n ASP 51 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1n6u s LEU 52 N -3.64 4.46 -0.08 -2.67 0.20 -1.26 -4.26 118.68 111.44 1n6u s LEU 52 Ca 0.44 1.17 -0.00 0.00 0.69 0.00 0.00 54.13 56.43 1n6u s LEU 52 Cb 0.22 -2.99 0.02 0.00 -0.43 0.00 0.00 46.19 43.02 1n6u s LEU 52 CO -0.11 0.22 -0.05 -0.75 -0.29 0.00 0.00 176.35 175.38 1n6u s LYS 53 N -1.38 1.08 -0.83 1.98 2.20 0.14 -4.87 119.74 118.06 1n6u s LYS 53 Ca 0.31 -0.12 -0.25 0.00 -0.36 0.00 0.00 55.97 55.55 1n6u s LYS 53 Cb -0.18 -1.20 0.02 0.00 -1.51 0.00 0.00 37.83 34.96 1n6u s LYS 53 CO 0.18 -0.21 1.51 0.14 -0.36 0.00 0.00 175.35 176.61 1n6u s VAL 54 N 1.52 3.70 -0.20 4.02 -7.23 -1.26 -2.15 120.40 118.79 1n6u s VAL 54 Ca -0.01 -0.10 -0.41 0.00 -1.81 0.00 0.00 61.98 59.65 1n6u s VAL 54 Cb -0.13 -4.70 -0.17 0.00 0.56 0.00 0.00 36.38 31.93 1n6u s VAL 54 CO -0.04 -1.63 1.52 0.52 -0.31 0.00 0.00 175.10 175.17 1n6u n VAL 55 N 6.86 0.12 -0.16 1.32 0.31 -1.04 -4.79 118.33 120.96 1n6u n VAL 55 Ca 0.20 -0.02 -0.04 0.00 -0.01 0.00 0.00 64.34 64.47 1n6u n VAL 55 Cb 0.50 -0.80 -0.04 0.00 -0.91 0.00 0.00 33.84 32.59 1n6u n VAL 55 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1n6u n LYS 56 N 3.86 -0.17 -3.31 5.55 3.00 -1.26 -2.68 118.16 123.14 1n6u n LYS 56 Ca 0.25 0.64 -0.45 0.00 -0.00 0.00 0.00 58.31 58.75 1n6u n LYS 56 Cb 0.10 -0.94 -0.06 0.00 0.00 0.00 0.00 35.03 34.12 1n6u n LYS 56 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 1n6u s ASN 57 N -4.89 6.17 0.00 3.14 0.01 -1.26 -4.12 114.94 113.99 1n6u s ASN 57 Ca -0.05 -1.43 0.00 0.00 -0.71 0.00 0.00 52.86 50.67 1n6u s ASN 57 Cb 0.04 -2.22 0.00 0.00 0.41 0.00 0.00 41.25 39.49 1n6u s ASN 57 CO 0.23 -0.79 0.00 0.00 -1.51 0.00 0.00 177.10 175.04 1n6u s ALA 59 N 0.00 3.29 0.00 0.00 0.00 -1.23 -1.27 121.76 122.55 1n6u s ALA 59 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.69 1n6u s ALA 59 Cb 0.00 -2.78 0.00 0.00 0.00 0.00 0.00 23.12 20.34 1n6u s ALA 59 CO 0.00 -0.33 0.00 0.27 0.00 0.00 0.00 175.76 175.70 1n6u n ASN 60 N -2.07 0.00 -4.14 0.00 0.23 0.56 -4.74 115.26 105.10 1n6u n ASN 60 Ca 0.03 0.00 -0.27 0.00 -0.53 0.00 0.00 54.58 53.81 1n6u n ASN 60 Cb 0.54 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 38.08 1n6u n ASN 60 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1n6u s THR 61 N -0.29 1.50 -1.06 5.53 -1.32 0.15 -4.70 115.64 115.46 1n6u s THR 61 Ca 0.00 -0.75 -0.02 0.00 -1.21 0.00 0.00 61.69 59.71 1n6u s THR 61 Cb 0.00 -1.29 0.28 0.00 -1.51 0.00 0.00 72.50 69.98 1n6u s THR 61 CO 0.00 0.43 1.96 0.35 -2.21 0.00 0.00 174.62 175.15 1n6u n THR 62 N 3.21 5.76 -4.39 5.08 -2.24 -1.26 0.12 114.28 120.56 1n6u n THR 62 Ca -0.19 -5.53 -0.22 0.00 -2.27 0.00 0.00 64.05 55.85 1n6u n THR 62 Cb 0.53 -1.62 -0.08 0.00 -2.10 0.00 0.00 70.33 67.05 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 -3.72 1.79 0.00 -0.78 0.52 -1.26 -4.92 118.95 110.58 1n6u s ARG 63 Ca 0.43 -2.06 0.00 0.00 -0.52 0.00 0.00 55.73 53.58 1n6u s ARG 63 Cb 0.21 -0.13 0.00 0.00 0.52 0.00 0.00 34.95 35.55 1n6u s ARG 63 CO -0.15 -0.54 0.00 -1.13 0.02 0.00 0.00 175.30 173.50 1n6u n SER 64 N -1.32 0.00 -4.67 0.23 3.41 -1.26 -4.66 113.62 105.35 1n6u n SER 64 Ca 0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1n6u n SER 64 Cb 0.64 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.53 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 -0.56 2.34 -0.08 7.33 -0.12 -1.26 -4.22 117.98 121.40 1n6u s PHE 65 Ca 0.00 0.47 -0.08 0.00 -0.05 0.00 0.00 56.93 57.26 1n6u s PHE 65 Cb 0.00 -3.80 -0.04 0.00 -0.63 0.00 0.00 43.02 38.55 1n6u s PHE 65 CO 0.00 -3.20 0.21 0.00 -0.05 0.00 0.00 175.22 172.18 1n6u s ASP 67 N -1.12 6.00 -0.33 0.00 1.47 -1.26 0.08 116.67 121.51 1n6u s ASP 67 Ca 0.18 -0.12 -0.05 0.00 1.18 0.00 0.00 52.55 53.74 1n6u s ASP 67 Cb -0.13 -1.47 0.19 0.00 -0.34 0.00 0.00 42.92 41.16 1n6u s ASP 67 CO 0.07 -0.24 0.92 -1.48 0.68 0.00 0.00 175.17 175.12 1n6u s LEU 68 N -4.05 -0.71 -0.17 2.11 2.34 0.47 -4.81 118.68 113.86 1n6u s LEU 68 Ca 0.39 -0.23 -0.21 0.00 0.06 0.00 0.00 54.13 54.14 1n6u s LEU 68 Cb -0.09 1.06 -0.18 0.00 -0.56 0.00 0.00 46.19 46.42 1n6u s LEU 68 CO 0.29 -0.09 0.36 0.74 -1.06 0.00 0.00 176.35 176.59 1n6u h THR 69 N 4.19 1.06 -0.43 5.48 2.02 -1.89 -1.10 112.91 122.25 1n6u h THR 69 Ca -0.03 -2.01 0.00 0.00 0.77 0.00 0.00 66.41 65.14 1n6u h THR 69 Cb 1.21 2.22 0.00 0.00 -1.74 0.00 0.00 68.15 69.84 1n6u h THR 69 CO -0.02 0.36 0.00 -0.67 0.37 0.00 0.00 175.52 175.56 1n6u n ASP 70 N -4.55 3.98 0.06 4.18 2.03 -1.26 -4.29 116.55 116.71 1n6u n ASP 70 Ca -0.19 -2.53 0.08 0.00 0.52 0.00 0.00 54.79 52.67 1n6u n ASP 70 Cb 0.50 -0.47 -0.05 0.00 -0.72 0.00 0.00 41.12 40.38 1n6u n ASP 70 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1n6u n GLU 71 N 0.38 0.62 -3.29 -0.67 4.71 -1.26 -4.45 120.64 116.68 1n6u n GLU 71 Ca 0.20 0.11 -0.27 0.00 -0.01 0.00 0.00 57.16 57.18 1n6u n GLU 71 Cb 0.77 -1.77 -0.07 0.00 -1.01 0.00 0.00 31.44 29.36 1n6u n GLU 71 CO 0.00 0.00 0.00 0.91 0.09 0.00 0.00 177.13 178.13 1n6u n TRP 72 N -2.68 3.74 1.99 -0.32 7.02 -1.26 -4.84 117.44 121.08 1n6u n TRP 72 Ca -0.04 -4.08 0.13 0.00 -1.02 0.00 0.00 57.50 52.49 1n6u n TRP 72 Cb 0.65 -0.56 0.80 0.00 -2.42 0.00 0.00 31.31 29.78 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 0.58 0.99 -1.57 -0.99 -4.01 -1.26 -4.02 116.66 106.38 1n6u n ARG 73 Ca 0.30 0.00 -0.29 0.00 -1.04 0.00 0.00 57.85 56.82 1n6u n ARG 73 Cb 0.40 -1.42 -0.05 0.00 -3.04 0.00 0.00 32.46 28.35 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 -0.92 6.66 0.07 2.89 7.64 -1.26 -4.66 113.62 124.04 1n6u n SER 74 Ca 0.20 -3.26 0.21 0.00 1.01 0.00 0.00 58.87 57.03 1n6u n SER 74 Cb 0.09 -1.23 0.72 0.00 -1.01 0.00 0.00 64.21 62.79 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 2.04 0.33 -0.30 0.44 1.35 -1.91 0.91 112.91 115.76 1n6u h THR 75 Ca 0.43 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.29 1n6u h THR 75 Cb 0.63 0.60 0.00 0.00 -1.73 0.00 0.00 68.15 67.65 1n6u h THR 75 CO 0.96 0.00 0.00 1.57 -0.25 0.00 0.00 175.52 177.80 1n6u n HIS 76 N -3.66 0.64 -4.44 4.73 -0.00 -1.26 -2.26 115.22 108.98 1n6u n HIS 76 Ca 0.08 -0.26 -0.21 0.00 -0.00 0.00 0.00 57.72 57.33 1n6u n HIS 76 Cb 0.69 -0.12 -0.10 0.00 -0.00 0.00 0.00 29.99 30.46 1n6u n HIS 76 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1n6u s GLU 77 N -1.65 1.67 -0.48 1.57 0.41 0.31 -4.97 118.70 115.56 1n6u s GLU 77 Ca 0.23 -1.95 -0.12 0.00 -0.41 0.00 0.00 54.97 52.72 1n6u s GLU 77 Cb 0.14 -0.65 0.11 0.00 -1.78 0.00 0.00 34.13 31.96 1n6u s GLU 77 CO 0.12 -0.30 0.38 0.00 -0.49 0.00 0.00 175.26 174.97 1n6u s ALA 78 N -3.38 3.46 -0.83 5.21 0.00 -1.26 -4.09 121.76 120.86 1n6u s ALA 78 Ca 0.33 -2.40 -0.25 0.00 0.00 0.00 0.00 51.96 49.64 1n6u s ALA 78 Cb 0.07 -2.94 -0.07 0.00 0.00 0.00 0.00 23.12 20.18 1n6u s ALA 78 CO 0.15 -1.86 2.09 0.71 0.00 0.00 0.00 175.76 176.85 1n6u s TYR 79 N 1.47 1.58 0.03 0.00 2.02 0.64 0.35 117.35 123.43 1n6u s TYR 79 Ca 0.04 1.07 -0.30 0.00 -0.37 0.00 0.00 57.07 57.51 1n6u s TYR 79 Cb -0.26 -3.85 -0.07 0.00 -0.40 0.00 0.00 41.96 37.38 1n6u s TYR 79 CO 0.02 -1.76 1.51 0.14 -1.57 0.00 0.00 175.55 173.89 1n6u s VAL 80 N 11.46 3.43 0.03 0.71 -7.23 0.22 -2.17 120.40 126.85 1n6u s VAL 80 Ca 0.77 0.83 0.07 0.00 -1.81 0.00 0.00 61.98 61.84 1n6u s VAL 80 Cb -0.09 -3.53 -0.03 0.00 0.56 0.00 0.00 36.38 33.28 1n6u s VAL 80 CO 0.04 -0.01 -0.17 0.42 -0.31 0.00 0.00 175.10 175.08 1n6u s THR 81 N 2.56 2.87 -0.36 5.32 -4.23 -0.75 0.11 115.64 121.16 1n6u s THR 81 Ca 0.68 -1.12 0.01 0.00 -1.18 0.00 0.00 61.69 60.08 1n6u s THR 81 Cb -0.35 -2.21 0.11 0.00 1.34 0.00 0.00 72.50 71.40 1n6u s THR 81 CO 0.29 0.36 0.14 -0.69 -0.54 0.00 0.00 174.62 174.18 1n6u s VAL 82 N -0.92 1.28 -0.43 2.29 1.01 0.17 0.31 120.40 124.11 1n6u s VAL 82 Ca 0.15 -1.98 -0.20 0.00 0.00 0.00 0.00 61.98 59.95 1n6u s VAL 82 Cb -0.11 -1.94 0.02 0.00 0.00 0.00 0.00 36.38 34.36 1n6u s VAL 82 CO 0.05 -0.75 0.62 -0.22 0.00 0.00 0.00 175.10 174.80 1n6u s LEU 83 N 1.03 4.53 -0.32 3.92 2.96 0.62 -1.72 118.68 129.70 1n6u s LEU 83 Ca 0.13 -0.36 -0.12 0.00 -0.22 0.00 0.00 54.13 53.56 1n6u s LEU 83 Cb -0.20 -2.69 -0.02 0.00 0.50 0.00 0.00 46.19 43.78 1n6u s LEU 83 CO -0.13 -0.75 0.21 -1.61 -1.32 0.00 0.00 176.35 172.75 1n6u s GLU 84 N 2.74 3.51 -0.16 1.98 2.02 -0.55 -2.50 118.70 125.75 1n6u s GLU 84 Ca 0.21 -0.62 -0.01 0.00 0.02 0.00 0.00 54.97 54.57 1n6u s GLU 84 Cb -0.14 -3.72 -0.01 0.00 0.10 0.00 0.00 34.13 30.36 1n6u s GLU 84 CO 0.18 -0.40 -0.11 0.20 0.02 0.00 0.00 175.26 175.15 1n6u s GLY 85 N 1.70 1.56 -0.21 -1.39 0.00 -0.82 -1.16 107.32 107.00 1n6u s GLY 85 Ca 0.06 -0.97 -0.10 0.00 0.00 0.00 0.00 44.72 43.71 1n6u s GLY 85 CO 0.09 -0.01 0.13 -1.36 0.00 0.00 0.00 173.10 171.96 1n6u s PHE 86 N 0.67 3.39 -0.73 1.90 0.40 -1.24 -1.52 117.98 120.85 1n6u s PHE 86 Ca -0.06 0.31 -0.27 0.00 -0.60 0.00 0.00 56.93 56.32 1n6u s PHE 86 Cb -0.15 -2.18 0.02 0.00 0.51 0.00 0.00 43.02 41.23 1n6u s PHE 86 CO 0.02 0.26 1.35 -1.12 0.70 0.00 0.00 175.22 176.43 1n6u s SER 87 N 0.47 6.06 0.04 1.36 0.01 0.67 -4.30 113.70 118.01 1n6u s SER 87 Ca 0.08 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.95 1n6u s SER 87 Cb -0.11 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.56 1n6u s SER 87 CO -0.01 -1.90 0.00 0.61 0.41 0.00 0.00 173.24 172.35 1n6u n GLY 88 N 5.45 1.98 0.00 3.44 0.00 -1.26 -2.50 105.19 112.30 1n6u n GLY 88 Ca 0.06 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1n6u n GLY 88 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1n6u n ASN 89 N 6.10 0.26 -4.65 1.61 2.85 -1.26 -4.86 115.26 115.31 1n6u n ASN 89 Ca 0.00 -0.62 -0.29 0.00 -0.11 0.00 0.00 54.58 53.56 1n6u n ASN 89 Cb 0.00 0.68 -0.08 0.00 1.24 0.00 0.00 39.78 41.62 1n6u n ASN 89 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1n6u s THR 90 N -0.68 3.78 -0.07 -0.44 2.01 -1.04 -5.07 115.64 114.13 1n6u s THR 90 Ca 0.00 -1.15 -0.30 0.00 0.31 0.00 0.00 61.69 60.55 1n6u s THR 90 Cb 0.00 -2.81 -0.03 0.00 0.01 0.00 0.00 72.50 69.67 1n6u s THR 90 CO 0.00 0.08 1.21 -0.89 -0.69 0.00 0.00 174.62 174.32 1n6u s THR 91 N -1.36 4.25 -0.03 -0.82 2.01 -1.26 0.24 115.64 118.67 1n6u s THR 91 Ca 0.25 1.57 0.13 0.00 0.31 0.00 0.00 61.69 63.95 1n6u s THR 91 Cb -0.11 -4.01 -0.20 0.00 0.01 0.00 0.00 72.50 68.19 1n6u s THR 91 CO 0.17 -0.02 0.26 -0.11 -0.69 0.00 0.00 174.62 174.24 1n6u n LEU 92 N 5.34 0.00 -3.69 4.42 7.94 -0.69 -4.72 117.00 125.60 1n6u n LEU 92 Ca 0.11 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.99 1n6u n LEU 92 Cb 0.46 0.03 -0.01 0.00 0.53 0.00 0.00 43.42 44.43 1n6u n LEU 92 CO 0.55 0.03 0.84 0.72 -1.11 0.00 0.00 177.39 178.42 1n6u s PHE 93 N -2.84 -0.11 -0.36 1.96 -0.71 -0.58 -4.98 117.98 110.36 1n6u s PHE 93 Ca -0.05 -0.11 0.04 0.00 -1.04 0.00 0.00 56.93 55.77 1n6u s PHE 93 Cb 0.08 0.60 0.19 0.00 -1.21 0.00 0.00 43.02 42.67 1n6u s PHE 93 CO 0.54 -0.61 0.71 -1.12 -1.34 0.00 0.00 175.22 173.40 1n6u s SER 94 N -2.90 -1.31 0.20 1.98 0.01 -1.26 -1.94 113.70 108.47 1n6u s SER 94 Ca 0.12 -0.39 0.09 0.00 1.31 0.00 0.00 55.95 57.09 1n6u s SER 94 Cb 0.01 1.71 -0.04 0.00 0.21 0.00 0.00 66.02 67.91 1n6u s SER 94 CO -0.01 -0.18 -0.10 0.00 0.41 0.00 0.00 173.24 173.36 1n6u s SER 96 N -2.94 3.74 -0.29 0.00 0.15 -1.24 -0.28 113.70 112.84 1n6u s SER 96 Ca 0.25 -1.29 -0.03 0.00 0.70 0.00 0.00 55.95 55.59 1n6u s SER 96 Cb -0.08 -0.36 0.17 0.00 -1.71 0.00 0.00 66.02 64.03 1n6u s SER 96 CO 0.15 -0.34 0.57 -2.28 1.20 0.00 0.00 173.24 172.54 1n6u s HIS 97 N -2.69 -1.43 -0.86 3.44 2.46 0.15 -4.93 115.29 111.43 1n6u s HIS 97 Ca 0.34 1.68 -0.25 0.00 0.47 0.00 0.00 55.06 57.30 1n6u s HIS 97 Cb 0.06 0.52 -0.08 0.00 -0.13 0.00 0.00 32.58 32.95 1n6u s HIS 97 CO 0.17 -0.81 2.12 -0.80 -2.47 0.00 0.00 174.74 172.95 1n6u s ASN 98 N 2.81 4.67 -0.23 9.88 -0.87 -1.26 -1.80 114.94 128.14 1n6u s ASN 98 Ca 0.15 -0.41 -0.29 0.00 -1.57 0.00 0.00 52.86 50.74 1n6u s ASN 98 Cb -0.14 -2.56 -0.02 0.00 -0.02 0.00 0.00 41.25 38.51 1n6u s ASN 98 CO -0.20 -3.17 1.59 -0.36 -2.57 0.00 0.00 177.10 172.39 1n6u s PHE 99 N 11.85 2.16 -1.16 2.20 0.08 -0.92 -4.89 117.98 127.29 1n6u s PHE 99 Ca 0.78 0.57 -0.10 0.00 0.12 0.00 0.00 56.93 58.31 1n6u s PHE 99 Cb -0.09 -3.98 0.23 0.00 -0.57 0.00 0.00 43.02 38.62 1n6u s PHE 99 CO 0.02 -2.82 1.35 1.87 -0.10 0.00 0.00 175.22 175.54 1n6u n TRP 100 N 8.38 4.60 0.24 0.36 -0.00 -1.26 -0.26 117.44 129.51 1n6u n TRP 100 Ca 0.18 -3.46 -0.10 0.00 -0.00 0.00 0.00 57.50 54.13 1n6u n TRP 100 Cb 0.45 -1.85 -0.05 0.00 -0.00 0.00 0.00 31.31 29.87 1n6u n TRP 100 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 1n6u h LEU 101 N 7.71 -0.53 -1.83 5.87 3.38 -1.86 1.63 115.31 129.68 1n6u h LEU 101 Ca 0.25 0.02 0.51 0.00 0.09 0.00 0.00 57.88 58.75 1n6u h LEU 101 Cb 0.82 0.14 -0.09 0.00 0.09 0.00 0.00 40.66 41.61 1n6u h LEU 101 CO 1.20 -0.29 1.19 0.00 0.09 0.00 0.00 178.44 180.63 1n6u h ALA 102 N -1.55 3.47 0.00 1.53 0.00 -1.62 0.86 119.26 121.96 1n6u h ALA 102 Ca -0.06 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 1n6u h ALA 102 Cb 0.48 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1n6u h ALA 102 CO 0.10 -2.03 -2.07 -0.89 0.00 0.00 0.00 179.25 174.37 1n6u n ILE 103 N -4.18 0.58 -0.12 0.00 5.41 -1.15 -4.75 119.36 115.16 1n6u n ILE 103 Ca 0.40 -0.60 -0.24 0.00 1.00 0.00 0.00 62.75 63.31 1n6u n ILE 103 Cb 1.76 -0.21 -0.08 0.00 -0.71 0.00 0.00 39.64 40.41 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 -2.42 1.76 -2.21 4.38 2.03 0.56 -4.13 116.55 116.52 1n6u n ASP 104 Ca -0.16 0.30 0.00 0.00 0.52 0.00 0.00 54.79 55.46 1n6u n ASP 104 Cb 0.78 -0.72 0.00 0.00 -0.72 0.00 0.00 41.12 40.46 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 -4.15 -0.30 -3.07 -0.67 2.81 0.25 -4.79 117.12 107.20 1n6u n MET 105 Ca -0.43 0.56 -0.43 0.00 -1.81 0.00 0.00 57.70 55.59 1n6u n MET 105 Cb 0.78 -0.61 -0.06 0.00 -0.71 0.00 0.00 33.22 32.62 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 -0.52 6.29 0.09 7.83 0.01 -1.26 -4.80 113.70 121.33 1n6u s SER 106 Ca 0.00 -0.58 0.04 0.00 1.31 0.00 0.00 55.95 56.72 1n6u s SER 106 Cb 0.00 -2.33 -0.04 0.00 0.21 0.00 0.00 66.02 63.86 1n6u s SER 106 CO 0.00 -0.92 0.03 -0.36 0.41 0.00 0.00 173.24 172.40 1n6u s PHE 107 N 2.98 3.06 0.01 2.43 0.40 -1.26 0.15 117.98 125.75 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 -0.16 -1.56 0.00 0.00 0.51 0.00 0.00 43.02 41.81 1n6u s PHE 107 CO 0.16 0.50 0.00 -1.91 0.70 0.00 0.00 175.22 174.67 1n6u n GLU 108 N 0.46 0.00 -0.32 0.44 0.00 -1.25 -4.84 120.64 115.14 1n6u n GLU 108 Ca -0.10 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.17 1n6u n GLU 108 Cb 0.52 0.00 0.24 0.00 0.00 0.00 0.00 31.44 32.20 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 0.05 -6.06 5.31 0.11 -1.92 -3.43 132.00 126.06 1n6u h PRO 109 Ca 0.00 -0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.59 1n6u h PRO 109 Cb 0.00 -0.01 0.25 0.00 0.11 0.00 0.00 31.00 31.35 1n6u h PRO 109 CO 0.00 0.03 -2.16 -2.30 -0.21 0.00 0.00 178.00 173.36 1n6u n PRO 110 N -5.44 -0.08 -4.06 1.05 -0.02 -1.26 -4.93 135.00 120.26 1n6u n PRO 110 Ca 0.20 -0.02 -0.28 0.00 -2.02 0.00 0.00 63.50 61.37 1n6u n PRO 110 Cb 0.65 -1.07 -0.06 0.00 -0.02 0.00 0.00 33.50 33.00 1n6u n PRO 110 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1n6u s GLU 111 N -2.13 2.92 -0.28 -0.52 2.12 -1.10 -5.00 118.70 114.71 1n6u s GLU 111 Ca 0.40 -0.78 -0.25 0.00 0.36 0.00 0.00 54.97 54.70 1n6u s GLU 111 Cb -0.05 -2.70 0.10 0.00 0.26 0.00 0.00 34.13 31.74 1n6u s GLU 111 CO 0.74 0.52 0.91 -0.59 -0.54 0.00 0.00 175.26 176.31 1n6u s PHE 112 N -1.59 -0.60 0.35 5.30 -0.12 -1.26 0.13 117.98 120.19 1n6u s PHE 112 Ca 0.30 1.46 -0.04 0.00 -0.05 0.00 0.00 56.93 58.60 1n6u s PHE 112 Cb -0.11 0.33 0.01 0.00 -0.63 0.00 0.00 43.02 42.62 1n6u s PHE 112 CO 0.23 -0.29 0.53 -1.83 -0.05 0.00 0.00 175.22 173.81 1n6u s GLU 113 N 0.32 1.98 -0.17 1.99 -1.05 -1.07 -4.95 118.70 115.74 1n6u s GLU 113 Ca 0.02 -1.72 -0.12 0.00 -0.15 0.00 0.00 54.97 53.00 1n6u s GLU 113 Cb -0.05 0.48 0.05 0.00 -0.44 0.00 0.00 34.13 34.17 1n6u s GLU 113 CO -0.04 -0.84 0.43 0.96 0.95 0.00 0.00 175.26 176.72 1n6u s ILE 114 N -2.89 -0.01 -0.21 1.83 -4.36 -1.26 -2.46 121.20 111.83 1n6u s ILE 114 Ca 0.28 0.05 -0.07 0.00 -0.26 0.00 0.00 60.65 60.65 1n6u s ILE 114 Cb -0.01 -0.63 -0.03 0.00 1.25 0.00 0.00 42.46 43.04 1n6u s ILE 114 CO 0.19 0.02 0.06 -0.69 0.24 0.00 0.00 174.94 174.76 1n6u s VAL 115 N 0.91 4.47 -0.15 8.37 1.01 0.14 -4.76 120.40 130.38 1n6u s VAL 115 Ca -0.05 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 1n6u s VAL 115 Cb -0.06 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.25 1n6u s VAL 115 CO -0.07 0.40 -0.05 -0.83 0.00 0.00 0.00 175.10 174.55 1n6u s GLY 116 N 0.97 1.69 0.22 4.51 0.00 -1.26 0.15 107.32 113.59 1n6u s GLY 116 Ca 0.03 -0.85 0.05 0.00 0.00 0.00 0.00 44.72 43.96 1n6u s GLY 116 CO 0.03 -0.06 0.25 -1.36 0.00 0.00 0.00 173.10 171.95 1n6u s PHE 117 N 0.41 3.27 0.34 1.90 0.40 0.19 -4.61 117.98 119.88 1n6u s PHE 117 Ca -0.05 -0.04 0.14 0.00 -0.60 0.00 0.00 56.93 56.38 1n6u s PHE 117 Cb -0.14 -1.51 1.07 0.00 0.51 0.00 0.00 43.02 42.95 1n6u s PHE 117 CO 0.03 0.50 1.65 1.15 0.70 0.00 0.00 175.22 179.25 1n6u h THR 118 N 1.51 0.26 0.00 0.64 2.02 -1.91 -2.19 112.91 113.24 1n6u h THR 118 Ca -0.49 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 66.59 1n6u h THR 118 Cb 1.22 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1n6u h THR 118 CO 0.62 0.05 -0.00 -3.20 0.37 0.00 0.00 175.52 173.36 1n6u n ASN 119 N -5.11 2.02 -3.62 4.18 4.05 -1.26 -2.09 115.26 113.42 1n6u n ASN 119 Ca 0.31 -2.22 -0.07 0.00 0.45 0.00 0.00 54.58 53.05 1n6u n ASN 119 Cb 0.99 -0.10 -0.01 0.00 1.23 0.00 0.00 39.78 41.89 1n6u n ASN 119 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 177.26 172.83 1n6u s HIS 120 N -1.38 -0.11 0.03 1.20 -3.43 -0.82 -3.92 115.29 106.85 1n6u s HIS 120 Ca 0.07 -0.40 0.07 0.00 -0.80 0.00 0.00 55.06 54.00 1n6u s HIS 120 Cb 0.06 0.74 -0.02 0.00 -1.43 0.00 0.00 32.58 31.93 1n6u s HIS 120 CO 0.01 -1.31 -0.20 0.42 -2.00 0.00 0.00 174.74 171.65 1n6u s ILE 121 N -3.50 1.61 -0.44 -5.38 1.01 0.13 0.56 121.20 115.18 1n6u s ILE 121 Ca 0.12 -1.09 0.03 0.00 0.00 0.00 0.00 60.65 59.71 1n6u s ILE 121 Cb -0.06 -1.38 0.12 0.00 0.01 0.00 0.00 42.46 41.15 1n6u s ILE 121 CO 0.08 0.26 0.19 0.20 0.00 0.00 0.00 174.94 175.66 1n6u s ASN 122 N -0.99 4.31 -0.38 3.58 -0.87 0.39 -1.07 114.94 119.92 1n6u s ASN 122 Ca 0.07 -2.62 -0.15 0.00 -1.57 0.00 0.00 52.86 48.59 1n6u s ASN 122 Cb -0.08 -1.49 0.00 0.00 -0.02 0.00 0.00 41.25 39.66 1n6u s ASN 122 CO 0.01 -0.29 0.30 -0.69 -2.57 0.00 0.00 177.10 173.86 1n6u s VAL 123 N 0.27 5.24 -0.19 1.60 1.01 0.40 0.24 120.40 128.97 1n6u s VAL 123 Ca 0.15 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1n6u s VAL 123 Cb -0.23 -3.86 0.02 0.00 0.00 0.00 0.00 36.38 32.31 1n6u s VAL 123 CO -0.04 -0.20 -0.16 -0.32 0.00 0.00 0.00 175.10 174.38 1n6u s MET 124 N 1.77 3.04 -0.35 2.72 0.00 -1.03 0.12 119.30 125.58 1n6u s MET 124 Ca 0.07 -0.81 -0.14 0.00 0.00 0.00 0.00 55.69 54.82 1n6u s MET 124 Cb -0.18 -2.67 -0.01 0.00 0.00 0.00 0.00 34.83 31.97 1n6u s MET 124 CO 0.11 -0.22 0.27 0.08 0.00 0.00 0.00 175.02 175.26 1n6u s VAL 125 N 1.32 5.26 -1.22 10.11 1.01 -0.40 -2.61 120.40 133.88 1n6u s VAL 125 Ca 0.05 -0.24 -0.20 0.00 0.00 0.00 0.00 61.98 61.59 1n6u s VAL 125 Cb -0.13 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 1n6u s VAL 125 CO -0.11 -0.08 1.87 0.29 0.00 0.00 0.00 175.10 177.08 1n6u n LYS 126 N 5.17 2.37 -3.30 2.72 4.01 0.34 0.21 118.16 129.68 1n6u n LYS 126 Ca -0.12 -2.77 -0.33 0.00 -0.51 0.00 0.00 58.31 54.58 1n6u n LYS 126 Cb 0.49 -3.53 -0.06 0.00 -0.51 0.00 0.00 35.03 31.43 1n6u n LYS 126 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 1n6u s PHE 127 N 7.02 3.45 1.00 2.13 0.08 0.39 -2.70 117.98 129.36 1n6u s PHE 127 Ca 0.60 1.05 -0.14 0.00 0.12 0.00 0.00 56.93 58.56 1n6u s PHE 127 Cb 0.04 -2.39 0.07 0.00 -0.57 0.00 0.00 43.02 40.16 1n6u s PHE 127 CO 0.09 0.25 0.37 -0.35 -0.10 0.00 0.00 175.22 175.47 1n6u n PRO 128 N 0.01 -0.68 -2.89 0.24 -0.04 -1.26 -0.17 135.00 130.21 1n6u n PRO 128 Ca 0.00 -0.16 -0.43 0.00 -0.04 0.00 0.00 63.50 62.87 1n6u n PRO 128 Cb 0.52 -1.85 -0.04 0.00 -0.04 0.00 0.00 33.50 32.09 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 -2.02 6.28 -0.03 3.54 1.04 -1.25 0.32 113.70 121.57 1n6u s SER 129 Ca 0.57 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 56.43 1n6u s SER 129 Cb -0.19 -2.41 -0.00 0.00 0.10 0.00 0.00 66.02 63.52 1n6u s SER 129 CO 0.67 -1.23 -0.14 -0.51 0.98 0.00 0.00 173.24 173.01 1n6u s ILE 130 N 3.77 1.17 -0.68 -1.02 -1.16 -1.25 -4.95 121.20 117.09 1n6u s ILE 130 Ca 0.26 -0.58 -0.22 0.00 -0.51 0.00 0.00 60.65 59.59 1n6u s ILE 130 Cb -0.15 -1.01 0.07 0.00 0.61 0.00 0.00 42.46 41.99 1n6u s ILE 130 CO 0.16 0.34 0.99 -0.69 -2.81 0.00 0.00 174.94 172.92 1n6u s VAL 131 N 0.02 4.32 0.54 4.00 1.01 -1.26 -4.55 120.40 124.48 1n6u s VAL 131 Ca -0.02 -0.40 0.44 0.00 0.00 0.00 0.00 61.98 62.00 1n6u s VAL 131 Cb -0.09 -4.70 0.64 0.00 0.00 0.00 0.00 36.38 32.23 1n6u s VAL 131 CO 0.01 -1.48 1.43 -1.84 0.00 0.00 0.00 175.10 173.22 1n6u n GLU 132 N 7.71 0.00 0.11 2.72 0.28 -1.26 0.50 120.64 130.70 1n6u n GLU 132 Ca -0.02 1.02 0.05 0.00 -0.16 0.00 0.00 57.16 58.05 1n6u n GLU 132 Cb 0.46 -2.39 0.27 0.00 1.43 0.00 0.00 31.44 31.21 1n6u n GLU 132 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1n6u n GLU 133 N -3.69 0.07 -1.55 3.44 -0.58 -1.26 -1.82 120.64 115.25 1n6u n GLU 133 Ca 0.38 0.50 -0.03 0.00 -0.42 0.00 0.00 57.16 57.60 1n6u n GLU 133 Cb 1.83 -1.92 -0.00 0.00 -0.57 0.00 0.00 31.44 30.78 1n6u n GLU 133 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 1n6u n GLU 134 N -1.84 0.36 -1.87 3.49 0.28 0.18 -5.13 120.64 116.11 1n6u n GLU 134 Ca -0.01 -1.50 -0.37 0.00 -0.16 0.00 0.00 57.16 55.12 1n6u n GLU 134 Cb 0.22 0.19 0.04 0.00 1.43 0.00 0.00 31.44 33.31 1n6u n GLU 134 CO 0.00 0.00 0.00 -0.48 -0.16 0.00 0.00 177.13 176.49 1n6u s LEU 135 N -0.98 3.77 0.17 -1.84 2.34 -0.75 -4.92 118.68 116.47 1n6u s LEU 135 Ca 0.12 2.61 -0.09 0.00 0.06 0.00 0.00 54.13 56.83 1n6u s LEU 135 Cb 0.20 -4.41 0.05 0.00 -0.56 0.00 0.00 46.19 41.47 1n6u s LEU 135 CO -0.07 -1.60 1.57 1.56 -1.06 0.00 0.00 176.35 176.76 1n6u h GLN 136 N 1.21 0.97 -1.47 1.48 1.08 -1.93 -3.45 115.11 112.99 1n6u h GLN 136 Ca -0.51 -0.40 0.10 0.00 -1.45 0.00 0.00 58.65 56.39 1n6u h GLN 136 Cb 1.30 -0.04 -0.28 0.00 -0.05 0.00 0.00 27.48 28.41 1n6u h GLN 136 CO 0.56 1.07 0.54 0.12 -0.95 0.00 0.00 178.83 180.17 1n6u s PHE 137 N -4.69 -0.39 -0.15 2.96 5.36 -1.26 -4.91 117.98 114.91 1n6u s PHE 137 Ca -0.11 0.92 0.00 0.00 -0.96 0.00 0.00 56.93 56.79 1n6u s PHE 137 Cb 0.13 0.38 0.15 0.00 -0.34 0.00 0.00 43.02 43.34 1n6u s PHE 137 CO 0.86 -0.19 1.59 -0.40 -1.46 0.00 0.00 175.22 175.62 1n6u n ASP 138 N 2.23 4.44 -4.14 6.13 5.68 -1.26 -4.97 116.55 124.66 1n6u n ASP 138 Ca -0.13 -2.59 -0.35 0.00 -0.50 0.00 0.00 54.79 51.23 1n6u n ASP 138 Cb 0.56 -0.81 0.08 0.00 -1.14 0.00 0.00 41.12 39.80 1n6u n ASP 138 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1n6u n LEU 139 N 0.41 -3.52 -4.40 -2.12 -0.00 -1.26 -4.50 117.00 101.61 1n6u n LEU 139 Ca 0.16 0.14 -0.32 0.00 -0.00 0.00 0.00 56.01 55.99 1n6u n LEU 139 Cb 0.69 -0.84 -0.14 0.00 -0.00 0.00 0.00 43.42 43.13 1n6u n LEU 139 CO 0.19 -4.36 -0.48 -0.44 -0.00 0.00 0.00 177.39 172.29 1n6u s SER 140 N -1.36 3.77 0.29 1.45 0.01 -1.09 -4.75 113.70 112.02 1n6u s SER 140 Ca 0.45 -0.31 -0.10 0.00 1.31 0.00 0.00 55.95 57.30 1n6u s SER 140 Cb -0.12 -1.00 -0.07 0.00 0.21 0.00 0.00 66.02 65.03 1n6u s SER 140 CO 0.74 0.28 0.63 -0.22 0.41 0.00 0.00 173.24 175.07 1n6u s LEU 141 N -0.34 4.08 -0.14 2.44 1.98 -1.26 0.74 118.68 126.17 1n6u s LEU 141 Ca 0.03 1.01 0.02 0.00 -2.89 0.00 0.00 54.13 52.29 1n6u s LEU 141 Cb -0.12 -3.80 0.01 0.00 0.66 0.00 0.00 46.19 42.93 1n6u s LEU 141 CO 0.02 -0.17 -0.19 -0.69 -1.89 0.00 0.00 176.35 173.43 1n6u s VAL 142 N -1.98 1.85 -0.52 1.68 1.01 0.69 -4.31 120.40 118.83 1n6u s VAL 142 Ca 0.49 -0.85 -0.17 0.00 0.00 0.00 0.00 61.98 61.46 1n6u s VAL 142 Cb -0.11 -1.67 0.10 0.00 0.00 0.00 0.00 36.38 34.71 1n6u s VAL 142 CO 0.23 0.51 0.50 0.27 0.00 0.00 0.00 175.10 176.61 1n6u s ILE 143 N 1.00 5.13 -0.51 2.22 -0.00 0.53 -1.51 121.20 128.05 1n6u s ILE 143 Ca -0.04 -1.19 -0.18 0.00 -0.00 0.00 0.00 60.65 59.24 1n6u s ILE 143 Cb -0.15 -4.28 0.07 0.00 -0.00 0.00 0.00 42.46 38.10 1n6u s ILE 143 CO -0.04 -0.80 0.58 -1.61 -0.00 0.00 0.00 174.94 173.07 1n6u s GLU 144 N 1.86 3.07 -0.38 0.37 8.01 -1.02 0.14 118.70 130.75 1n6u s GLU 144 Ca 0.06 -1.08 -0.22 0.00 0.01 0.00 0.00 54.97 53.74 1n6u s GLU 144 Cb -0.26 -4.13 0.01 0.00 -4.31 0.00 0.00 34.13 25.43 1n6u s GLU 144 CO 0.06 -1.22 0.70 -2.00 0.01 0.00 0.00 175.26 172.81 1n6u s GLU 145 N 2.37 3.61 -0.91 1.61 2.12 0.32 0.12 118.70 127.94 1n6u s GLU 145 Ca 0.12 0.05 -0.01 0.00 0.36 0.00 0.00 54.97 55.48 1n6u s GLU 145 Cb -0.21 -3.85 0.26 0.00 0.26 0.00 0.00 34.13 30.58 1n6u s GLU 145 CO 0.10 -0.86 0.99 0.94 -0.54 0.00 0.00 175.26 175.89 1n6u n GLN 146 N 6.29 3.19 -3.20 4.30 0.00 -0.87 0.12 117.38 127.21 1n6u n GLN 146 Ca 0.00 -4.54 -0.39 0.00 -0.00 0.00 0.00 57.00 52.07 1n6u n GLN 146 Cb 0.48 -2.42 -0.05 0.00 0.00 0.00 0.00 30.24 28.25 1n6u n GLN 146 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 1n6u s SER 147 N -1.02 6.83 -1.63 1.69 0.01 0.49 -0.87 113.70 119.20 1n6u s SER 147 Ca 0.32 0.99 -0.11 0.00 1.31 0.00 0.00 55.95 58.46 1n6u s SER 147 Cb 0.01 -2.34 0.11 0.00 0.21 0.00 0.00 66.02 64.00 1n6u s SER 147 CO -0.03 -0.04 0.27 -1.84 0.41 0.00 0.00 173.24 172.01 1n6u n GLU 148 N 3.64 -0.84 0.00 12.44 0.28 0.12 0.75 120.64 137.03 1n6u n GLU 148 Ca -0.05 0.11 0.00 0.00 -0.16 0.00 0.00 57.16 57.06 1n6u n GLU 148 Cb 0.51 -3.93 0.00 0.00 1.43 0.00 0.00 31.44 29.46 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 -1.82 1.50 3.66 -1.84 0.00 -1.26 -4.99 105.19 100.43 1n6u n GLY 149 Ca -0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.36 5.21 0.01 -0.61 -4.36 0.23 -5.06 121.20 114.26 1n6u s ILE 150 Ca 0.00 0.61 -0.19 0.00 -0.26 0.00 0.00 60.65 60.81 1n6u s ILE 150 Cb 0.00 -3.69 -0.06 0.00 1.25 0.00 0.00 42.46 39.96 1n6u s ILE 150 CO 0.00 0.24 0.55 0.68 0.24 0.00 0.00 174.94 176.65 1n6u s VAL 151 N 1.43 4.90 -0.00 8.37 -7.23 -1.26 -0.38 120.40 126.23 1n6u s VAL 151 Ca 0.17 1.15 0.00 0.00 -1.81 0.00 0.00 61.98 61.49 1n6u s VAL 151 Cb -0.15 -3.88 0.00 0.00 0.56 0.00 0.00 36.38 32.92 1n6u s VAL 151 CO 0.08 0.48 -0.01 -0.75 -0.31 0.00 0.00 175.10 174.59 1n6u s LYS 152 N -0.53 0.07 -0.56 4.82 2.20 0.33 -4.93 119.74 121.14 1n6u s LYS 152 Ca 0.29 -0.01 0.01 0.00 -0.36 0.00 0.00 55.97 55.90 1n6u s LYS 152 Cb -0.18 -0.10 0.14 0.00 -1.51 0.00 0.00 37.83 36.18 1n6u s LYS 152 CO 0.16 -0.00 0.33 -1.59 -0.36 0.00 0.00 175.35 173.89 1n6u s LYS 153 N 0.10 2.21 -0.18 4.03 0.00 -1.26 0.12 119.74 124.76 1n6u s LYS 153 Ca -0.01 -2.58 -0.21 0.00 0.00 0.00 0.00 55.97 53.18 1n6u s LYS 153 Cb -0.02 -3.48 -0.03 0.00 0.00 0.00 0.00 37.83 34.30 1n6u s LYS 153 CO -0.00 -1.13 0.62 -1.01 0.00 0.00 0.00 175.35 173.82 1n6u s HIS 154 N -0.19 3.40 -0.65 1.78 3.76 0.37 -4.93 115.29 118.83 1n6u s HIS 154 Ca 0.17 0.94 0.05 0.00 -0.15 0.00 0.00 55.06 56.07 1n6u s HIS 154 Cb -0.23 -2.78 0.17 0.00 1.11 0.00 0.00 32.58 30.85 1n6u s HIS 154 CO -0.02 -0.12 0.47 0.36 -0.85 0.00 0.00 174.74 174.58 1n6u n LYS 155 N 4.83 1.50 -0.50 1.40 2.85 -1.26 0.20 118.16 127.19 1n6u n LYS 155 Ca -0.02 -4.22 -0.29 0.00 -1.05 0.00 0.00 58.31 52.73 1n6u n LYS 155 Cb 0.50 -2.16 0.24 0.00 -0.65 0.00 0.00 35.03 32.97 1n6u n LYS 155 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1n6u n PRO 156 N 2.12 -2.55 -2.40 -1.58 -0.02 -1.26 -4.88 135.00 124.43 1n6u n PRO 156 Ca 0.22 -0.72 -0.40 0.00 -2.02 0.00 0.00 63.50 60.58 1n6u n PRO 156 Cb 0.38 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 1n6u n PRO 156 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1n6u s GLU 157 N -4.15 3.03 0.00 -0.52 2.56 -1.26 -4.83 118.70 113.53 1n6u s GLU 157 Ca 0.65 -0.02 0.18 0.00 0.00 0.00 0.00 54.97 55.78 1n6u s GLU 157 Cb -0.21 -4.28 0.64 0.00 2.00 0.00 0.00 34.13 32.28 1n6u s GLU 157 CO 0.65 -2.33 1.47 -0.89 -0.56 0.00 0.00 175.26 173.60 1n6u n ILE 158 N 6.64 0.28 -1.53 -3.70 2.08 -1.26 -4.58 119.36 117.30 1n6u n ILE 158 Ca 0.09 -0.38 -0.13 0.00 0.56 0.00 0.00 62.75 62.88 1n6u n ILE 158 Cb 0.50 0.34 -0.10 0.00 -0.75 0.00 0.00 39.64 39.63 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 0.39 0.30 -0.91 0.38 5.02 -1.26 -0.37 118.16 121.71 1n6u n LYS 159 Ca 0.15 -1.05 0.00 0.00 -2.02 0.00 0.00 58.31 55.39 1n6u n LYS 159 Cb 0.32 -3.41 0.00 0.00 -0.02 0.00 0.00 35.03 31.92 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 6.31 0.48 0.67 0.72 0.00 -1.26 -4.94 105.19 107.17 1n6u n GLY 160 Ca 0.43 -0.93 0.12 0.00 0.00 0.00 0.00 46.02 45.64 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 1.71 2.31 -3.58 1.61 4.05 0.50 -4.51 115.26 117.35 1n6u n ASN 161 Ca 0.00 -1.67 -0.41 0.00 0.45 0.00 0.00 54.58 52.95 1n6u n ASN 161 Cb 0.02 0.20 0.02 0.00 1.23 0.00 0.00 39.78 41.26 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 5.24 -1.43 1.20 2.81 -1.26 -4.61 117.12 119.60 1n6u n MET 162 Ca 0.12 -4.58 0.01 0.00 -1.81 0.00 0.00 57.70 51.44 1n6u n MET 162 Cb 0.50 -2.45 0.09 0.00 -0.71 0.00 0.00 33.22 30.65 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 -0.10 1.81 0.00 7.83 3.41 -1.21 -4.40 113.62 120.97 1n6u n SER 163 Ca 0.47 -2.89 0.00 0.00 -0.26 0.00 0.00 58.87 56.20 1n6u n SER 163 Cb 0.26 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 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 -0.37 -0.18 3.56 5.00 0.00 0.15 -3.78 105.19 109.57 1n6u n GLY 164 Ca 0.15 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 1n6u n GLY 164 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1n6u s ASN 165 N -4.00 6.73 0.29 1.61 -0.87 -1.25 0.15 114.94 117.60 1n6u s ASN 165 Ca 0.00 -2.13 -0.25 0.00 -1.57 0.00 0.00 52.86 48.90 1n6u s ASN 165 Cb 0.00 -2.56 -0.16 0.00 -0.02 0.00 0.00 41.25 38.51 1n6u s ASN 165 CO 0.00 -1.25 0.36 0.33 -2.57 0.00 0.00 177.10 173.97 1n6u n PHE 166 N 8.29 -1.09 -3.83 2.20 -0.00 0.56 -4.65 117.46 118.94 1n6u n PHE 166 Ca 0.42 0.82 -0.29 0.00 -0.00 0.00 0.00 57.45 58.40 1n6u n PHE 166 Cb 0.48 -1.89 -0.16 0.00 -0.00 0.00 0.00 39.48 37.90 1n6u n PHE 166 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1n6u s THR 167 N -1.27 1.05 0.05 -2.13 -4.23 -1.26 -1.27 115.64 106.58 1n6u s THR 167 Ca 0.62 -0.98 0.07 0.00 -1.18 0.00 0.00 61.69 60.22 1n6u s THR 167 Cb -0.81 -1.48 -0.03 0.00 1.34 0.00 0.00 72.50 71.53 1n6u s THR 167 CO 0.59 -0.22 -0.20 -0.47 -0.54 0.00 0.00 174.62 173.78 1n6u s TYR 168 N 1.60 1.74 -0.23 3.99 6.14 0.32 -4.99 117.35 125.93 1n6u s TYR 168 Ca -0.02 -0.38 0.00 0.00 0.64 0.00 0.00 57.07 57.32 1n6u s TYR 168 Cb -0.18 -1.03 0.06 0.00 0.42 0.00 0.00 41.96 41.23 1n6u s TYR 168 CO -0.09 0.09 -0.04 0.42 0.64 0.00 0.00 175.55 176.58 1n6u s ILE 169 N -0.84 1.39 -0.81 3.14 -1.09 -1.26 0.15 121.20 121.87 1n6u s ILE 169 Ca 0.07 -1.13 -0.22 0.00 -2.23 0.00 0.00 60.65 57.14 1n6u s ILE 169 Cb -0.09 -1.69 0.08 0.00 -1.58 0.00 0.00 42.46 39.19 1n6u s ILE 169 CO 0.02 -0.12 1.13 -0.63 -1.23 0.00 0.00 174.94 174.12 1n6u s ILE 170 N 1.46 4.31 0.23 2.92 1.01 -0.23 -4.84 121.20 126.06 1n6u s ILE 170 Ca -0.05 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.91 1n6u s ILE 170 Cb -0.19 -4.81 0.04 0.00 0.01 0.00 0.00 42.46 37.52 1n6u s ILE 170 CO -0.06 -1.60 0.32 -0.90 0.00 0.00 0.00 174.94 172.69 1n6u n ASP 171 N 7.73 0.82 -2.09 3.58 5.68 -1.26 0.18 116.55 131.20 1n6u n ASP 171 Ca 0.12 -1.60 -0.11 0.00 -0.50 0.00 0.00 54.79 52.70 1n6u n ASP 171 Cb 0.48 -0.17 0.04 0.00 -1.14 0.00 0.00 41.12 40.33 1n6u n ASP 171 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1n6u n LYS 172 N -1.51 -3.71 -4.56 0.11 4.81 -1.26 -4.93 118.16 107.12 1n6u n LYS 172 Ca 0.07 0.41 -0.21 0.00 -0.87 0.00 0.00 58.31 57.71 1n6u n LYS 172 Cb 0.24 -4.17 -0.15 0.00 0.02 0.00 0.00 35.03 30.97 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 -4.13 2.03 0.08 3.14 1.02 -1.25 -5.10 118.68 114.46 1n6u s LEU 173 Ca 0.19 -0.23 -0.18 0.00 0.02 0.00 0.00 54.13 53.92 1n6u s LEU 173 Cb -0.08 -0.64 -0.07 0.00 0.02 0.00 0.00 46.19 45.42 1n6u s LEU 173 CO 0.36 0.15 0.55 -0.63 0.02 0.00 0.00 176.35 176.80 1n6u s ILE 174 N -0.31 4.79 0.63 -0.59 1.01 -1.26 -4.35 121.20 121.11 1n6u s ILE 174 Ca 0.05 1.11 -0.13 0.00 0.00 0.00 0.00 60.65 61.68 1n6u s ILE 174 Cb -0.05 -3.85 -0.11 0.00 0.01 0.00 0.00 42.46 38.46 1n6u s ILE 174 CO -0.00 0.51 -0.44 -2.65 0.00 0.00 0.00 174.94 172.36 1n6u n PRO 175 N 1.59 0.00 -2.50 2.79 -0.02 -0.89 -4.06 135.00 131.91 1n6u n PRO 175 Ca -0.10 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.29 1n6u n PRO 175 Cb 0.51 -0.76 0.04 0.00 -0.02 0.00 0.00 33.50 33.27 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 2.41 -4.68 -3.61 2.55 5.15 -1.24 -4.56 115.26 111.28 1n6u n ASN 176 Ca 0.01 -0.40 -0.28 0.00 -0.60 0.00 0.00 54.58 53.31 1n6u n ASN 176 Cb 0.40 -3.21 -0.11 0.00 -0.53 0.00 0.00 39.78 36.33 1n6u n ASN 176 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1n6u s THR 177 N -3.22 1.29 -0.45 -0.44 2.01 -1.26 -4.85 115.64 108.73 1n6u s THR 177 Ca 0.26 -3.05 -0.29 0.00 0.31 0.00 0.00 61.69 58.93 1n6u s THR 177 Cb -0.03 -1.88 0.02 0.00 0.01 0.00 0.00 72.50 70.61 1n6u s THR 177 CO 0.43 -1.08 1.33 0.54 -0.69 0.00 0.00 174.62 175.15 1n6u s ASN 178 N -0.26 6.40 -0.09 3.53 2.20 -1.26 -3.93 114.94 121.53 1n6u s ASN 178 Ca 0.26 0.66 0.02 0.00 -0.94 0.00 0.00 52.86 52.86 1n6u s ASN 178 Cb -0.06 -2.54 -0.02 0.00 -2.00 0.00 0.00 41.25 36.63 1n6u s ASN 178 CO -0.13 -1.41 -0.14 -0.72 -2.94 0.00 0.00 177.10 171.75 1n6u s TYR 179 N 5.22 2.74 -0.57 1.54 1.13 -1.06 0.13 117.35 126.48 1n6u s TYR 179 Ca 0.56 -0.44 -0.18 0.00 -1.41 0.00 0.00 57.07 55.61 1n6u s TYR 179 Cb -0.11 -1.74 0.11 0.00 -1.10 0.00 0.00 41.96 39.12 1n6u s TYR 179 CO 0.32 -0.04 0.63 0.00 -2.51 0.00 0.00 175.55 173.95 1n6u s VAL 181 N 2.32 5.09 0.37 0.00 1.01 -0.74 -2.04 120.40 126.42 1n6u s VAL 181 Ca 0.09 1.23 0.03 0.00 0.00 0.00 0.00 61.98 63.33 1n6u s VAL 181 Cb -0.26 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.16 1n6u s VAL 181 CO 0.05 0.25 0.55 -0.44 0.00 0.00 0.00 175.10 175.51 1n6u s SER 182 N 0.80 5.97 -0.40 3.32 0.01 0.12 -2.70 113.70 120.82 1n6u s SER 182 Ca 0.32 0.08 0.08 0.00 1.31 0.00 0.00 55.95 57.73 1n6u s SER 182 Cb -0.16 -1.47 0.24 0.00 0.21 0.00 0.00 66.02 64.84 1n6u s SER 182 CO 0.14 -0.50 0.53 0.52 0.41 0.00 0.00 173.24 174.33 1n6u n VAL 183 N -1.81 -0.70 -4.51 3.43 0.31 -1.24 -2.43 118.33 111.38 1n6u n VAL 183 Ca -0.01 -3.82 -0.32 0.00 -0.01 0.00 0.00 64.34 60.18 1n6u n VAL 183 Cb 0.58 -1.75 -0.11 0.00 -0.91 0.00 0.00 33.84 31.65 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 2.87 0.58 3.52 -0.85 -0.57 -4.41 117.35 117.50 1n6u s TYR 184 Ca 0.35 -0.05 -0.03 0.00 -0.52 0.00 0.00 57.07 56.82 1n6u s TYR 184 Cb 0.16 -1.61 0.02 0.00 0.38 0.00 0.00 41.96 40.91 1n6u s TYR 184 CO -0.12 0.35 0.85 -0.51 -1.52 0.00 0.00 175.55 174.59 1n6u s LEU 185 N -1.31 3.24 0.13 -3.49 1.02 -1.26 0.25 118.68 117.26 1n6u s LEU 185 Ca 0.16 0.38 -0.09 0.00 0.02 0.00 0.00 54.13 54.60 1n6u s LEU 185 Cb -0.11 -3.19 -0.00 0.00 0.02 0.00 0.00 46.19 42.91 1n6u s LEU 185 CO 0.06 -1.13 0.25 -1.83 0.02 0.00 0.00 176.35 173.73 1n6u s GLU 186 N -4.90 1.02 -0.42 1.70 -1.05 0.23 -4.42 118.70 110.86 1n6u s GLU 186 Ca 0.55 -1.05 0.09 0.00 -0.15 0.00 0.00 54.97 54.40 1n6u s GLU 186 Cb -0.10 0.37 0.35 0.00 -0.44 0.00 0.00 34.13 34.30 1n6u s GLU 186 CO 0.42 -0.36 1.06 0.72 0.95 0.00 0.00 175.26 178.04 1n6u n HIS 187 N -0.15 -1.83 -2.43 4.83 8.25 -1.26 -2.65 115.22 119.97 1n6u n HIS 187 Ca -0.11 -2.54 -0.10 0.00 -0.26 0.00 0.00 57.72 54.71 1n6u n HIS 187 Cb 0.63 1.02 0.01 0.00 1.12 0.00 0.00 29.99 32.76 1n6u n HIS 187 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1n6u n SER 188 N 0.16 -3.55 -3.69 0.41 2.88 -1.26 -4.97 113.62 103.60 1n6u n SER 188 Ca 0.09 -0.08 -0.14 0.00 -1.33 0.00 0.00 58.87 57.41 1n6u n SER 188 Cb 0.72 -2.60 -0.08 0.00 -0.75 0.00 0.00 64.21 61.49 1n6u n SER 188 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1n6u s ASP 189 N -2.73 -0.41 -0.24 -3.46 1.01 -1.26 -5.04 116.67 104.54 1n6u s ASP 189 Ca 0.08 0.58 0.14 0.00 0.71 0.00 0.00 52.55 54.06 1n6u s ASP 189 Cb -0.04 0.64 0.69 0.00 1.01 0.00 0.00 42.92 45.22 1n6u s ASP 189 CO 0.10 -0.36 1.64 1.21 0.21 0.00 0.00 175.17 177.97 1n6u n GLU 190 N 1.88 3.79 -0.00 8.23 4.07 -1.26 -4.22 120.64 133.13 1n6u n GLU 190 Ca -0.17 -3.05 0.05 0.00 -0.06 0.00 0.00 57.16 53.93 1n6u n GLU 190 Cb 0.56 -2.09 -0.07 0.00 -0.06 0.00 0.00 31.44 29.78 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 -0.05 1.44 -1.53 5.31 6.02 -1.26 -4.60 117.38 122.72 1n6u n GLN 191 Ca 0.29 -0.06 -0.28 0.00 -0.01 0.00 0.00 57.00 56.93 1n6u n GLN 191 Cb 1.13 -1.15 -0.04 0.00 1.02 0.00 0.00 30.24 31.20 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 -1.65 6.41 -2.84 -1.58 0.00 -1.26 -4.86 120.51 114.74 1n6u n ALA 192 Ca -0.01 -3.15 -0.44 0.00 0.00 0.00 0.00 53.44 49.84 1n6u n ALA 192 Cb 0.23 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.59 1n6u n ALA 192 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1n6u n VAL 193 N 0.63 4.27 -1.23 0.00 0.24 -1.26 -4.46 118.33 116.52 1n6u n VAL 193 Ca 0.49 -4.67 -0.36 0.00 -2.04 0.00 0.00 64.34 57.76 1n6u n VAL 193 Cb 0.51 -2.44 -0.02 0.00 -1.47 0.00 0.00 33.84 30.41 1n6u n VAL 193 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1n6u n ILE 194 N 4.37 3.05 -2.05 1.34 2.08 -1.26 -4.85 119.36 122.04 1n6u n ILE 194 Ca 0.37 -2.17 -0.30 0.00 0.56 0.00 0.00 62.75 61.21 1n6u n ILE 194 Cb 0.41 -2.42 -0.05 0.00 -0.75 0.00 0.00 39.64 36.84 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 3.38 2.59 1.31 0.38 2.20 -1.26 -3.85 119.74 124.49 1n6u s LYS 195 Ca 0.53 -0.08 -0.21 0.00 -0.36 0.00 0.00 55.97 55.85 1n6u s LYS 195 Cb 0.14 -4.90 0.33 0.00 -1.51 0.00 0.00 37.83 31.89 1n6u s LYS 195 CO -0.02 -3.20 1.02 -1.12 -0.36 0.00 0.00 175.35 171.66 1n6u s SER 196 N 8.00 -0.10 1.06 1.43 0.01 -1.26 -4.96 113.70 117.88 1n6u s SER 196 Ca 0.69 0.75 -0.14 0.00 1.31 0.00 0.00 55.95 58.56 1n6u s SER 196 Cb -0.08 -1.05 0.22 0.00 0.21 0.00 0.00 66.02 65.31 1n6u s SER 196 CO 0.04 -4.76 0.49 -2.65 0.41 0.00 0.00 173.24 166.77 1n6u n PRO 197 N -5.21 -2.02 -4.64 12.44 -0.02 -1.26 -4.62 135.00 129.67 1n6u n PRO 197 Ca 0.13 -0.83 -0.25 0.00 -2.02 0.00 0.00 63.50 60.53 1n6u n PRO 197 Cb 0.60 -1.47 -0.14 0.00 -0.02 0.00 0.00 33.50 32.46 1n6u n PRO 197 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1n6u s LEU 198 N 0.00 2.14 -0.51 2.45 1.02 -1.26 -4.55 118.68 117.97 1n6u s LEU 198 Ca 0.38 -0.47 -0.20 0.00 0.02 0.00 0.00 54.13 53.86 1n6u s LEU 198 Cb -0.07 -0.91 0.05 0.00 0.02 0.00 0.00 46.19 45.29 1n6u s LEU 198 CO 0.32 0.15 0.66 -0.54 0.02 0.00 0.00 176.35 176.96 1n6u s LYS 199 N -1.02 3.16 -1.22 1.70 -0.14 -1.10 -4.79 119.74 116.33 1n6u s LYS 199 Ca 0.06 -0.78 -0.10 0.00 -1.36 0.00 0.00 55.97 53.79 1n6u s LYS 199 Cb -0.08 -4.08 0.19 0.00 -1.68 0.00 0.00 37.83 32.18 1n6u s LYS 199 CO 0.01 -1.24 1.62 0.00 -0.76 0.00 0.00 175.35 174.99 1n6u s THR 201 N 0.36 5.05 0.49 0.00 -1.32 -0.60 -4.68 115.64 114.94 1n6u s THR 201 Ca 0.39 0.95 -0.01 0.00 -1.21 0.00 0.00 61.69 61.82 1n6u s THR 201 Cb 0.03 -3.86 0.00 0.00 -1.51 0.00 0.00 72.50 67.17 1n6u s THR 201 CO 0.01 0.08 0.73 -0.22 -2.21 0.00 0.00 174.62 173.01 1n6u s LEU 202 N 2.30 3.52 0.23 9.08 2.96 -1.26 -2.57 118.68 132.94 1n6u s LEU 202 Ca 0.23 0.37 0.07 0.00 -0.22 0.00 0.00 54.13 54.58 1n6u s LEU 202 Cb -0.16 -3.23 -0.04 0.00 0.50 0.00 0.00 46.19 43.26 1n6u s LEU 202 CO 0.09 -0.82 0.11 -0.76 -1.32 0.00 0.00 176.35 173.65 1n6u s LEU 203 N -4.67 3.60 -0.52 -0.68 1.43 -1.25 -4.51 118.68 112.08 1n6u s LEU 203 Ca 0.50 -0.34 -0.29 0.00 -1.03 0.00 0.00 54.13 52.97 1n6u s LEU 203 Cb -0.10 -2.16 -0.10 0.00 0.03 0.00 0.00 46.19 43.86 1n6u s LEU 203 CO 0.40 0.01 2.41 -0.81 0.23 0.00 0.00 176.35 178.58 1n6u n PRO 204 N -0.82 0.99 -1.97 1.29 -0.04 -1.26 -3.68 135.00 129.51 1n6u n PRO 204 Ca -0.08 0.11 -0.41 0.00 -0.04 0.00 0.00 63.50 63.09 1n6u n PRO 204 Cb 0.57 -2.94 -0.03 0.00 -0.04 0.00 0.00 33.50 31.07 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 7.84 2.95 -0.43 0.54 0.04 -1.26 -3.61 135.00 141.07 1n6u s PRO 205 Ca 1.07 1.12 -0.29 0.00 0.04 0.00 0.00 61.00 62.94 1n6u s PRO 205 Cb -0.49 -4.31 -0.09 0.00 0.04 0.00 0.00 34.50 29.66 1n6u s PRO 205 CO 0.35 -2.33 2.34 0.41 0.04 0.00 0.00 177.00 177.81 1n6u n GLY 206 N 5.58 0.43 2.07 0.56 0.00 -1.26 -4.52 105.19 108.05 1n6u n GLY 206 Ca 0.23 0.80 0.00 0.00 0.00 0.00 0.00 46.02 47.05 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 8.72 0.00 0.11 1.61 6.02 -1.26 -4.71 117.38 127.87 1n6u n GLN 207 Ca 0.39 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 57.34 1n6u n GLN 207 Cb 0.40 0.00 0.14 0.00 1.02 0.00 0.00 30.24 31.80 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 0.00 0.13 -4.20 -1.09 4.39 -2.02 -3.37 114.58 108.43 1n6u h GLU 208 Ca 0.00 -0.10 -0.75 0.00 0.34 0.00 0.00 59.36 58.86 1n6u h GLU 208 Cb 0.00 0.02 -0.24 0.00 -0.10 0.00 0.00 28.75 28.42 1n6u h GLU 208 CO 0.00 0.71 -0.29 -1.12 -1.16 0.00 0.00 179.01 177.16 1n6u s SER 209 N -6.88 6.09 -0.19 1.42 0.01 -1.26 -4.79 113.70 108.11 1n6u s SER 209 Ca -0.03 -1.63 -0.12 0.00 1.31 0.00 0.00 55.95 55.48 1n6u s SER 209 Cb 0.12 -2.17 0.05 0.00 0.21 0.00 0.00 66.02 64.23 1n6u s SER 209 CO 0.78 -0.75 0.24 1.21 0.41 0.00 0.00 173.24 175.13 1n6u n GLU 210 N 5.18 -4.56 -2.48 12.44 4.07 -1.26 -4.88 120.64 129.16 1n6u n GLU 210 Ca -0.13 3.43 -0.43 0.00 -0.06 0.00 0.00 57.16 59.98 1n6u n GLU 210 Cb 0.41 -5.06 -0.02 0.00 -0.06 0.00 0.00 31.44 26.71 1n6u n GLU 210 CO 0.00 0.00 0.00 0.12 -0.06 0.00 0.00 177.13 177.19 1n6u s PHE 211 N -0.69 2.90 0.00 4.31 2.19 -1.26 -4.52 117.98 120.91 1n6u s PHE 211 Ca -0.28 1.05 0.00 0.00 0.33 0.00 0.00 56.93 58.03 1n6u s PHE 211 Cb 0.02 -3.62 0.00 0.00 -1.31 0.00 0.00 43.02 38.11 1n6u s PHE 211 CO 0.79 -1.43 0.39 0.45 1.83 0.00 0.00 175.22 177.26