#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nn6 s LYS 2 N 0.00 4.19 -0.55 2.12 2.20 -1.26 -4.97 119.74 121.47 2nn6 s LYS 2 Ca 0.00 0.75 -0.28 0.00 -0.36 0.00 0.00 55.97 56.08 2nn6 s LYS 2 Cb 0.00 -3.61 0.03 0.00 -1.51 0.00 0.00 37.83 32.74 2nn6 s LYS 2 CO 0.00 -0.38 1.16 -1.21 -0.36 0.00 0.00 175.35 174.56 2nn6 s GLU 3 N 2.36 3.55 -0.43 4.03 8.01 -1.26 -3.95 118.70 131.02 2nn6 s GLU 3 Ca 0.31 0.29 -0.28 0.00 0.01 0.00 0.00 54.97 55.30 2nn6 s GLU 3 Cb -0.16 -3.99 -0.08 0.00 -4.31 0.00 0.00 34.13 25.59 2nn6 s GLU 3 CO 0.09 -1.59 2.35 2.41 0.01 0.00 0.00 175.26 178.54 2nn6 n THR 4 N 6.68 0.09 -0.34 3.63 -1.04 -1.26 -4.91 114.28 117.12 2nn6 n THR 4 Ca 0.09 -0.57 -0.29 0.00 -2.04 0.00 0.00 64.05 61.24 2nn6 n THR 4 Cb 0.49 -2.42 0.27 0.00 -1.82 0.00 0.00 70.33 66.84 2nn6 n THR 4 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2nn6 n PRO 5 N 8.80 -3.86 -3.19 -2.82 -0.04 -1.26 -5.07 135.00 127.56 2nn6 n PRO 5 Ca 0.38 -1.13 0.01 0.00 -0.04 0.00 0.00 63.50 62.71 2nn6 n PRO 5 Cb 0.44 -1.92 -0.01 0.00 -0.04 0.00 0.00 33.50 31.97 2nn6 n PRO 5 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2nn6 s LEU 6 N -6.47 -1.45 0.78 1.53 2.96 -1.26 -5.17 118.68 109.59 2nn6 s LEU 6 Ca 0.63 -0.06 -0.08 0.00 -0.22 0.00 0.00 54.13 54.41 2nn6 s LEU 6 Cb -0.15 1.84 0.08 0.00 0.50 0.00 0.00 46.19 48.46 2nn6 s LEU 6 CO 0.57 -0.29 0.12 -0.24 -1.32 0.00 0.00 176.35 175.18 2nn6 n SER 7 N 5.27 -2.58 -0.08 3.68 2.88 -1.26 -4.89 113.62 116.65 2nn6 n SER 7 Ca 0.05 -0.21 -0.06 0.00 -1.33 0.00 0.00 58.87 57.32 2nn6 n SER 7 Cb 0.53 -0.63 -0.02 0.00 -0.75 0.00 0.00 64.21 63.34 2nn6 n SER 7 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2nn6 n ASN 8 N 0.83 1.77 -0.17 -3.46 3.02 -1.26 -3.89 115.26 112.10 2nn6 n ASN 8 Ca 0.03 0.47 -0.03 0.00 -0.03 0.00 0.00 54.58 55.02 2nn6 n ASN 8 Cb 0.20 -0.79 0.04 0.00 -0.61 0.00 0.00 39.78 38.62 2nn6 n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2nn6 h GLU 10 N -0.02 -0.11 0.67 0.00 4.57 -1.94 1.21 114.58 118.96 2nn6 h GLU 10 Ca 0.25 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.40 2nn6 h GLU 10 Cb 0.40 0.02 0.01 0.00 -0.16 0.00 0.00 28.75 29.02 2nn6 h GLU 10 CO -0.54 -0.07 -0.32 0.07 -1.18 0.00 0.00 179.01 176.96 2nn6 h ARG 11 N -0.11 -0.87 -0.49 1.92 0.11 -1.30 0.11 114.38 113.74 2nn6 h ARG 11 Ca 0.18 0.06 0.10 0.00 0.10 0.00 0.00 59.98 60.41 2nn6 h ARG 11 Cb 0.50 0.20 -0.10 0.00 1.11 0.00 0.00 29.97 31.67 2nn6 h ARG 11 CO -0.84 -0.55 -0.25 -0.09 0.10 0.00 0.00 179.97 178.34 2nn6 h ARG 12 N -1.09 -0.14 -0.14 0.08 1.12 0.80 0.55 114.38 115.57 2nn6 h ARG 12 Ca -0.09 0.01 -0.14 0.00 -1.11 0.00 0.00 59.98 58.65 2nn6 h ARG 12 Cb 0.73 0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 30.71 2nn6 h ARG 12 CO 0.15 -0.09 -0.52 0.35 -3.11 0.00 0.00 179.97 176.76 2nn6 h PHE 13 N -0.14 0.47 -1.00 2.20 3.57 0.14 0.46 116.94 122.64 2nn6 h PHE 13 Ca 0.22 -0.16 0.17 0.00 3.53 0.00 0.00 57.97 61.73 2nn6 h PHE 13 Cb 0.49 -0.09 -0.10 0.00 2.79 0.00 0.00 35.95 39.04 2nn6 h PHE 13 CO -0.52 0.82 0.62 1.25 -2.23 0.00 0.00 178.31 178.25 2nn6 h LEU 14 N 0.30 0.80 -0.03 0.59 6.46 0.14 0.59 115.31 124.17 2nn6 h LEU 14 Ca 0.01 0.08 -0.07 0.00 -0.12 0.00 0.00 57.88 57.78 2nn6 h LEU 14 Cb 1.01 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.87 2nn6 h LEU 14 CO 0.09 0.33 -0.25 -0.07 -0.62 0.00 0.00 178.44 177.92 2nn6 h LEU 15 N 0.81 0.27 -0.89 2.25 3.38 -0.49 -2.94 115.31 117.70 2nn6 h LEU 15 Ca 0.55 -0.71 0.21 0.00 0.09 0.00 0.00 57.88 58.01 2nn6 h LEU 15 Cb 0.79 -0.08 -0.16 0.00 0.09 0.00 0.00 40.66 41.30 2nn6 h LEU 15 CO -0.33 0.94 -0.08 -0.09 0.09 0.00 0.00 178.44 178.97 2nn6 h ARG 16 N -0.38 0.03 0.00 1.13 1.12 0.30 2.48 114.38 119.07 2nn6 h ARG 16 Ca -0.02 -0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.84 2nn6 h ARG 16 Cb 0.95 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 30.91 2nn6 h ARG 16 CO 0.05 0.02 0.00 0.00 -3.11 0.00 0.00 179.97 176.93 2nn6 h ALA 17 N 1.87 1.00 0.18 2.80 0.00 0.07 -1.83 119.26 123.36 2nn6 h ALA 17 Ca 0.48 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 55.07 2nn6 h ALA 17 Cb 0.85 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.66 2nn6 h ALA 17 CO -0.85 0.00 -1.53 0.82 0.00 0.00 0.00 179.25 177.69 2nn6 h ILE 18 N 0.00 1.20 -0.44 0.00 1.08 0.42 -2.19 117.51 117.58 2nn6 h ILE 18 Ca 0.00 -2.74 0.13 0.00 -0.39 0.00 0.00 64.86 61.86 2nn6 h ILE 18 Cb 0.38 2.88 -0.02 0.00 -3.07 0.00 0.00 36.82 37.00 2nn6 h ILE 18 CO 0.00 0.84 0.36 -0.33 -0.69 0.00 0.00 178.15 178.33 2nn6 h GLU 19 N 0.10 0.00 0.00 2.37 5.08 0.55 1.49 114.58 124.18 2nn6 h GLU 19 Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2nn6 h GLU 19 Cb 2.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.33 2nn6 h GLU 19 CO 0.21 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.61 2nn6 n GLU 20 N -4.13 0.32 -1.92 2.33 -0.58 -0.88 -4.86 120.64 110.92 2nn6 n GLU 20 Ca 0.08 0.03 -0.20 0.00 -0.42 0.00 0.00 57.16 56.64 2nn6 n GLU 20 Cb 0.55 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.87 2nn6 n GLU 20 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2nn6 n LYS 21 N -1.33 -1.56 -4.51 3.49 4.81 0.51 -4.93 118.16 114.64 2nn6 n LYS 21 Ca 0.12 1.10 -0.34 0.00 -0.87 0.00 0.00 58.31 58.32 2nn6 n LYS 21 Cb 0.24 -5.59 -0.12 0.00 0.02 0.00 0.00 35.03 29.58 2nn6 n LYS 21 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2nn6 s LYS 22 N -4.25 3.26 0.07 1.64 1.02 -0.85 -4.75 119.74 115.87 2nn6 s LYS 22 Ca 0.00 -0.53 -0.21 0.00 0.02 0.00 0.00 55.97 55.25 2nn6 s LYS 22 Cb 0.00 -2.76 -0.07 0.00 -0.52 0.00 0.00 37.83 34.48 2nn6 s LYS 22 CO 0.00 0.43 0.62 1.03 -0.92 0.00 0.00 175.35 176.52 2nn6 s ARG 23 N -0.17 4.31 0.06 1.68 1.81 -1.24 -4.05 118.95 121.35 2nn6 s ARG 23 Ca 0.03 0.83 -0.24 0.00 -1.72 0.00 0.00 55.73 54.63 2nn6 s ARG 23 Cb -0.13 -3.27 -0.16 0.00 -0.45 0.00 0.00 34.95 30.94 2nn6 s ARG 23 CO 0.03 0.54 1.60 -0.07 -0.68 0.00 0.00 175.30 176.72 2nn6 h LEU 24 N 4.82 0.02 -1.25 2.53 -0.00 -1.91 0.12 115.31 119.64 2nn6 h LEU 24 Ca -0.48 -0.15 0.00 0.00 -0.00 0.00 0.00 57.88 57.26 2nn6 h LEU 24 Cb 1.21 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.86 2nn6 h LEU 24 CO 0.66 0.16 0.00 -0.90 -0.00 0.00 0.00 178.44 178.36 2nn6 n ASP 25 N -5.01 0.89 -3.73 -0.43 5.75 -1.26 -4.81 116.55 107.95 2nn6 n ASP 25 Ca -0.07 -1.18 -0.27 0.00 -0.01 0.00 0.00 54.79 53.26 2nn6 n ASP 25 Cb 0.10 -0.30 0.01 0.00 -1.03 0.00 0.00 41.12 39.90 2nn6 n ASP 25 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2nn6 n GLY 26 N 0.33 -1.05 0.00 6.12 0.00 0.40 -5.01 105.19 105.99 2nn6 n GLY 26 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 46.02 46.73 2nn6 n GLY 26 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2nn6 n ARG 27 N -2.18 0.49 -4.21 1.61 1.85 -1.25 -4.98 116.66 108.00 2nn6 n ARG 27 Ca -0.28 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.34 2nn6 n ARG 27 Cb 0.69 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 32.04 2nn6 n ARG 27 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 2nn6 s GLN 28 N -0.48 2.56 0.54 2.89 0.74 -1.26 -3.67 119.66 120.98 2nn6 s GLN 28 Ca 0.00 -1.21 0.30 0.00 0.05 0.00 0.00 55.36 54.50 2nn6 s GLN 28 Cb 0.00 -2.36 1.46 0.00 1.10 0.00 0.00 33.01 33.21 2nn6 s GLN 28 CO 0.00 0.40 1.91 1.79 -0.55 0.00 0.00 175.29 178.84 2nn6 h THR 29 N 1.86 0.57 -2.14 -0.34 1.35 -1.92 -3.15 112.91 109.14 2nn6 h THR 29 Ca -0.46 0.00 -0.58 0.00 -0.55 0.00 0.00 66.41 64.82 2nn6 h THR 29 Cb 1.23 0.59 -0.41 0.00 -1.73 0.00 0.00 68.15 67.84 2nn6 h THR 29 CO 0.60 0.00 -0.79 -1.22 -0.25 0.00 0.00 175.52 173.87 2nn6 n TYR 30 N -4.24 2.36 -4.34 4.73 4.02 -1.26 -2.78 117.16 115.66 2nn6 n TYR 30 Ca 0.16 -3.95 -0.17 0.00 -0.01 0.00 0.00 57.90 53.93 2nn6 n TYR 30 Cb 0.86 -0.48 -0.10 0.00 -0.02 0.00 0.00 39.34 39.60 2nn6 n TYR 30 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2nn6 s ASP 31 N -2.28 1.37 0.29 7.72 1.11 -1.19 -5.07 116.67 118.62 2nn6 s ASP 31 Ca 0.40 -1.40 0.11 0.00 0.18 0.00 0.00 52.55 51.83 2nn6 s ASP 31 Cb 0.19 0.16 -0.05 0.00 1.07 0.00 0.00 42.92 44.29 2nn6 s ASP 31 CO -0.06 -0.73 -0.12 -0.31 1.18 0.00 0.00 175.17 175.13 2nn6 s TYR 32 N -3.69 2.42 0.70 4.23 1.51 -1.26 -4.61 117.35 116.65 2nn6 s TYR 32 Ca 0.37 -0.35 -0.11 0.00 -1.01 0.00 0.00 57.07 55.97 2nn6 s TYR 32 Cb 0.08 -1.15 0.01 0.00 -0.11 0.00 0.00 41.96 40.79 2nn6 s TYR 32 CO 0.14 0.65 1.09 1.03 -1.11 0.00 0.00 175.55 177.35 2nn6 s ARG 33 N -3.58 2.87 0.43 -0.62 0.52 -1.26 -4.91 118.95 112.39 2nn6 s ARG 33 Ca 0.31 0.45 -0.24 0.00 -0.52 0.00 0.00 55.73 55.73 2nn6 s ARG 33 Cb -0.04 -2.03 -0.08 0.00 0.52 0.00 0.00 34.95 33.32 2nn6 s ARG 33 CO 0.17 -1.02 1.13 1.21 0.02 0.00 0.00 175.30 176.81 2nn6 s ASN 34 N -4.36 6.41 -0.06 0.23 3.84 -1.26 -4.80 114.94 114.94 2nn6 s ASN 34 Ca 0.58 2.24 0.05 0.00 0.21 0.00 0.00 52.86 55.93 2nn6 s ASN 34 Cb -0.11 -2.60 -0.00 0.00 -0.55 0.00 0.00 41.25 37.99 2nn6 s ASN 34 CO 0.52 -0.75 -0.20 0.27 -2.79 0.00 0.00 177.10 174.14 2nn6 s ILE 35 N -1.55 1.71 0.30 -5.21 -5.25 -1.25 -2.37 121.20 107.58 2nn6 s ILE 35 Ca 0.61 -0.86 0.11 0.00 -0.99 0.00 0.00 60.65 59.52 2nn6 s ILE 35 Cb -0.27 -1.46 -0.05 0.00 2.95 0.00 0.00 42.46 43.62 2nn6 s ILE 35 CO 0.33 0.48 -0.17 -0.13 -1.79 0.00 0.00 174.94 173.67 2nn6 s ARG 36 N 0.06 1.73 -0.05 0.37 0.52 -0.18 -4.93 118.95 116.47 2nn6 s ARG 36 Ca -0.07 -1.82 -0.02 0.00 -0.52 0.00 0.00 55.73 53.31 2nn6 s ARG 36 Cb -0.13 -1.76 0.04 0.00 0.52 0.00 0.00 34.95 33.62 2nn6 s ARG 36 CO 0.04 0.27 0.09 0.42 0.02 0.00 0.00 175.30 176.14 2nn6 s ILE 37 N -2.54 -0.11 -0.01 1.52 1.09 -1.26 -0.20 121.20 119.69 2nn6 s ILE 37 Ca 0.31 0.28 0.06 0.00 -1.10 0.00 0.00 60.65 60.20 2nn6 s ILE 37 Cb -0.03 -0.18 -0.03 0.00 -1.06 0.00 0.00 42.46 41.16 2nn6 s ILE 37 CO 0.16 0.12 -0.19 -0.44 -0.10 0.00 0.00 174.94 174.48 2nn6 s SER 38 N 1.60 3.64 0.00 3.58 0.01 0.16 -4.97 113.70 117.71 2nn6 s SER 38 Ca -0.03 -0.36 -0.00 0.00 1.31 0.00 0.00 55.95 56.86 2nn6 s SER 38 Cb -0.12 -0.61 -0.04 0.00 0.21 0.00 0.00 66.02 65.46 2nn6 s SER 38 CO -0.04 0.31 0.09 0.72 0.41 0.00 0.00 173.24 174.73 2nn6 s PHE 39 N -0.75 3.31 0.45 2.43 -0.12 -1.26 0.25 117.98 122.30 2nn6 s PHE 39 Ca 0.12 0.21 -0.18 0.00 -0.05 0.00 0.00 56.93 57.03 2nn6 s PHE 39 Cb -0.10 -1.74 -0.10 0.00 -0.63 0.00 0.00 43.02 40.45 2nn6 s PHE 39 CO 0.01 0.56 0.94 0.20 -0.05 0.00 0.00 175.22 176.88 2nn6 s GLY 40 N -1.83 2.25 0.25 1.99 0.00 -0.10 -4.15 107.32 105.74 2nn6 s GLY 40 Ca 0.24 0.26 -0.05 0.00 0.00 0.00 0.00 44.72 45.17 2nn6 s GLY 40 CO 0.15 0.53 1.39 -1.30 0.00 0.00 0.00 173.10 173.88 2nn6 n THR 41 N -0.98 -0.37 -3.60 0.90 -2.24 0.21 -4.36 114.28 103.83 2nn6 n THR 41 Ca 0.06 2.03 -0.20 0.00 -2.27 0.00 0.00 64.05 63.67 2nn6 n THR 41 Cb 0.54 -2.83 -0.01 0.00 -2.10 0.00 0.00 70.33 65.92 2nn6 n THR 41 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2nn6 s ASP 42 N -5.19 5.84 0.12 3.42 -4.77 -1.26 -4.24 116.67 110.59 2nn6 s ASP 42 Ca -0.13 -0.24 -0.30 0.00 -3.30 0.00 0.00 52.55 48.58 2nn6 s ASP 42 Cb 0.24 -1.23 -0.06 0.00 -1.09 0.00 0.00 42.92 40.79 2nn6 s ASP 42 CO 0.70 -0.38 0.97 -0.31 0.70 0.00 0.00 175.17 176.85 2nn6 s TYR 43 N -2.19 3.80 0.00 2.11 1.51 -1.26 -3.53 117.35 117.79 2nn6 s TYR 43 Ca 0.43 1.78 0.00 0.00 -1.01 0.00 0.00 57.07 58.27 2nn6 s TYR 43 Cb -0.09 -3.07 0.00 0.00 -0.11 0.00 0.00 41.96 38.69 2nn6 s TYR 43 CO 0.30 0.14 0.00 0.41 -1.11 0.00 0.00 175.55 175.28 2nn6 n GLY 44 N 2.22 0.99 3.33 0.71 0.00 -1.24 -4.62 105.19 106.58 2nn6 n GLY 44 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2nn6 n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nn6 s ILE 47 N -3.79 0.07 0.13 0.00 1.09 0.14 -2.10 121.20 116.73 2nn6 s ILE 47 Ca 0.03 0.00 0.10 0.00 -1.10 0.00 0.00 60.65 59.68 2nn6 s ILE 47 Cb 0.00 -0.09 -0.04 0.00 -1.06 0.00 0.00 42.46 41.27 2nn6 s ILE 47 CO -0.11 0.04 -0.21 -0.69 -0.10 0.00 0.00 174.94 173.87 2nn6 s VAL 48 N 0.20 2.62 -0.29 2.92 1.01 -0.90 -0.67 120.40 125.28 2nn6 s VAL 48 Ca -0.02 -1.63 -0.03 0.00 0.00 0.00 0.00 61.98 60.31 2nn6 s VAL 48 Cb -0.03 -2.19 0.10 0.00 0.00 0.00 0.00 36.38 34.26 2nn6 s VAL 48 CO -0.01 0.08 0.11 -1.61 0.00 0.00 0.00 175.10 173.68 2nn6 s GLU 49 N -2.16 0.41 -0.02 2.72 2.02 0.72 -2.44 118.70 119.96 2nn6 s GLU 49 Ca 0.17 -0.75 0.00 0.00 0.02 0.00 0.00 54.97 54.41 2nn6 s GLU 49 Cb -0.10 -1.53 0.02 0.00 0.10 0.00 0.00 34.13 32.62 2nn6 s GLU 49 CO 0.09 -0.99 1.36 -0.11 0.02 0.00 0.00 175.26 175.62 2nn6 n LEU 50 N 5.08 3.91 -2.40 1.80 0.00 -0.53 -1.01 117.00 123.85 2nn6 n LEU 50 Ca -0.04 -1.88 -0.04 0.00 0.00 0.00 0.00 56.01 54.04 2nn6 n LEU 50 Cb 0.42 -0.72 0.01 0.00 0.00 0.00 0.00 43.42 43.13 2nn6 n LEU 50 CO 0.07 0.69 -0.06 0.61 0.00 0.00 0.00 177.39 178.70 2nn6 n GLY 51 N 0.76 -1.84 0.76 -3.96 0.00 -1.00 -4.42 105.19 95.50 2nn6 n GLY 51 Ca 0.02 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.72 2nn6 n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2nn6 n LYS 52 N -0.14 0.00 -5.20 1.61 4.76 -1.26 -4.97 118.16 112.95 2nn6 n LYS 52 Ca 0.06 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.20 2nn6 n LYS 52 Cb 0.23 -0.43 -0.16 0.00 -1.84 0.00 0.00 35.03 32.84 2nn6 n LYS 52 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2nn6 s THR 53 N -2.30 2.02 -0.02 -0.18 2.01 -1.26 -2.93 115.64 112.98 2nn6 s THR 53 Ca 0.00 -1.14 0.02 0.00 0.31 0.00 0.00 61.69 60.88 2nn6 s THR 53 Cb 0.00 -1.69 0.00 0.00 0.01 0.00 0.00 72.50 70.83 2nn6 s THR 53 CO 0.00 0.52 -0.07 -0.13 -0.69 0.00 0.00 174.62 174.25 2nn6 s ARG 54 N -0.72 0.78 0.11 4.92 0.52 -1.04 -1.46 118.95 122.07 2nn6 s ARG 54 Ca 0.10 -0.24 0.07 0.00 -0.52 0.00 0.00 55.73 55.15 2nn6 s ARG 54 Cb -0.10 -0.75 -0.04 0.00 0.52 0.00 0.00 34.95 34.59 2nn6 s ARG 54 CO -0.00 0.08 -0.18 0.08 0.02 0.00 0.00 175.30 175.30 2nn6 s VAL 55 N 0.22 1.59 -0.15 3.52 1.01 -1.02 -0.35 120.40 125.23 2nn6 s VAL 55 Ca -0.03 -1.62 0.02 0.00 0.00 0.00 0.00 61.98 60.35 2nn6 s VAL 55 Cb -0.08 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.76 2nn6 s VAL 55 CO 0.00 -0.19 -0.20 -0.22 0.00 0.00 0.00 175.10 174.49 2nn6 s LEU 56 N -2.13 2.21 -0.18 3.92 2.96 0.25 -2.13 118.68 123.59 2nn6 s LEU 56 Ca 0.08 -0.57 0.01 0.00 -0.22 0.00 0.00 54.13 53.42 2nn6 s LEU 56 Cb -0.08 -1.48 0.01 0.00 0.50 0.00 0.00 46.19 45.14 2nn6 s LEU 56 CO 0.04 0.07 -0.18 -0.83 -1.32 0.00 0.00 176.35 174.14 2nn6 s GLY 57 N 0.86 1.42 -0.03 7.98 0.00 -0.89 -1.41 107.32 115.26 2nn6 s GLY 57 Ca -0.05 -1.19 0.02 0.00 0.00 0.00 0.00 44.72 43.49 2nn6 s GLY 57 CO -0.02 0.25 -0.06 1.62 0.00 0.00 0.00 173.10 174.89 2nn6 s GLN 58 N 1.23 0.71 0.17 2.90 2.00 -0.97 -1.90 119.66 123.80 2nn6 s GLN 58 Ca 0.03 -0.17 0.10 0.00 -2.00 0.00 0.00 55.36 53.32 2nn6 s GLN 58 Cb -0.14 -0.70 -0.04 0.00 0.80 0.00 0.00 33.01 32.93 2nn6 s GLN 58 CO -0.10 0.03 -0.16 0.08 -0.50 0.00 0.00 175.29 174.64 2nn6 s VAL 59 N 0.41 2.83 0.15 1.34 1.01 -1.08 -0.05 120.40 125.02 2nn6 s VAL 59 Ca -0.05 -1.77 0.09 0.00 0.00 0.00 0.00 61.98 60.25 2nn6 s VAL 59 Cb -0.09 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 2nn6 s VAL 59 CO 0.00 -0.08 -0.21 -0.94 0.00 0.00 0.00 175.10 173.88 2nn6 s SER 60 N -2.66 2.86 -0.11 3.32 1.04 0.34 -4.95 113.70 113.54 2nn6 s SER 60 Ca 0.22 -0.82 0.02 0.00 0.48 0.00 0.00 55.95 55.86 2nn6 s SER 60 Cb -0.09 -0.18 -0.00 0.00 0.10 0.00 0.00 66.02 65.85 2nn6 s SER 60 CO 0.12 0.04 -0.20 0.00 0.98 0.00 0.00 173.24 174.18 2nn6 s GLU 62 N 0.39 0.91 -0.74 0.00 2.02 -0.73 -4.98 118.70 115.59 2nn6 s GLU 62 Ca -0.15 -0.53 0.04 0.00 0.02 0.00 0.00 54.97 54.35 2nn6 s GLU 62 Cb -0.17 0.40 0.23 0.00 0.10 0.00 0.00 34.13 34.69 2nn6 s GLU 62 CO 0.07 -0.32 0.77 1.47 0.02 0.00 0.00 175.26 177.27 2nn6 n LEU 63 N 0.32 3.92 -4.94 1.80 -0.00 -1.26 -1.21 117.00 115.63 2nn6 n LEU 63 Ca -0.18 -5.32 -0.24 0.00 -0.00 0.00 0.00 56.01 50.27 2nn6 n LEU 63 Cb 0.61 -0.81 0.02 0.00 -0.00 0.00 0.00 43.42 43.23 2nn6 n LEU 63 CO 0.20 1.88 0.35 -0.69 -0.00 0.00 0.00 177.39 179.13 2nn6 s VAL 64 N -2.12 3.88 -0.49 1.47 1.01 0.26 -4.73 120.40 119.68 2nn6 s VAL 64 Ca 0.34 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.72 2nn6 s VAL 64 Cb 0.06 -3.46 0.03 0.00 0.00 0.00 0.00 36.38 33.01 2nn6 s VAL 64 CO -0.05 -0.37 0.87 -0.55 0.00 0.00 0.00 175.10 175.00 2nn6 s SER 65 N -4.24 6.39 1.03 3.32 0.15 -1.26 0.65 113.70 119.74 2nn6 s SER 65 Ca 0.50 -0.19 -0.25 0.00 0.70 0.00 0.00 55.95 56.70 2nn6 s SER 65 Cb -0.10 -2.42 -0.12 0.00 -1.71 0.00 0.00 66.02 61.67 2nn6 s SER 65 CO 0.40 -1.07 -1.16 -0.81 1.20 0.00 0.00 173.24 171.80 2nn6 n PRO 66 N 7.08 -0.39 -1.20 5.44 -0.04 -1.25 -4.91 135.00 139.74 2nn6 n PRO 66 Ca 0.02 -0.11 -0.27 0.00 -0.04 0.00 0.00 63.50 63.11 2nn6 n PRO 66 Cb 0.48 -1.17 0.21 0.00 -0.04 0.00 0.00 33.50 32.98 2nn6 n PRO 66 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2nn6 n LYS 67 N 1.39 -2.38 0.00 0.54 4.81 -1.26 -4.97 118.16 116.29 2nn6 n LYS 67 Ca -0.01 -1.68 0.00 0.00 -0.87 0.00 0.00 58.31 55.75 2nn6 n LYS 67 Cb 0.72 -1.41 0.00 0.00 0.02 0.00 0.00 35.03 34.36 2nn6 n LYS 67 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2nn6 n LEU 68 N 0.00 0.00 0.00 3.14 4.77 -1.26 -4.16 117.00 119.49 2nn6 n LEU 68 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2nn6 n LEU 68 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2nn6 n LEU 68 CO 0.37 0.00 0.00 0.59 -1.33 0.00 0.00 177.39 177.02 2nn6 n ASN 69 N 0.00 0.00 -3.37 -1.43 3.02 -1.26 -2.26 115.26 109.96 2nn6 n ASN 69 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.24 2nn6 n ASN 69 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 2nn6 n ASN 69 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2nn6 n ARG 70 N 0.00 0.73 -0.32 3.52 1.74 -1.26 -4.70 116.66 116.37 2nn6 n ARG 70 Ca 0.00 -1.19 -0.03 0.00 -0.77 0.00 0.00 57.85 55.87 2nn6 n ARG 70 Cb 0.00 -2.49 -0.04 0.00 -1.02 0.00 0.00 32.46 28.91 2nn6 n ARG 70 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2nn6 n ALA 71 N 6.96 2.91 -0.03 7.54 0.00 -0.96 -2.72 120.51 134.21 2nn6 n ALA 71 Ca 0.37 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2nn6 n ALA 71 Cb 0.28 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 17.78 2nn6 n ALA 71 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2nn6 n THR 72 N 2.32 0.00 -3.55 0.00 -2.24 -1.26 0.27 114.28 109.81 2nn6 n THR 72 Ca 0.09 -0.23 -0.29 0.00 -2.27 0.00 0.00 64.05 61.35 2nn6 n THR 72 Cb 0.30 1.03 -0.13 0.00 -2.10 0.00 0.00 70.33 69.42 2nn6 n THR 72 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2nn6 s GLU 73 N -0.44 0.54 1.00 -0.78 1.03 -1.10 -4.58 118.70 114.35 2nn6 s GLU 73 Ca 0.00 -1.11 -0.17 0.00 0.03 0.00 0.00 54.97 53.72 2nn6 s GLU 73 Cb 0.00 -1.46 -0.14 0.00 -0.80 0.00 0.00 34.13 31.73 2nn6 s GLU 73 CO 0.00 -1.11 -0.73 0.41 -1.33 0.00 0.00 175.26 172.49 2nn6 n GLY 74 N 4.48 -4.49 3.94 -3.83 0.00 0.23 -4.83 105.19 100.68 2nn6 n GLY 74 Ca 0.04 -0.79 -0.19 0.00 0.00 0.00 0.00 46.02 45.07 2nn6 n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nn6 s ILE 75 N -2.03 3.52 0.02 -0.61 1.09 -1.23 -4.75 121.20 117.22 2nn6 s ILE 75 Ca 0.41 -1.15 -0.04 0.00 -1.10 0.00 0.00 60.65 58.78 2nn6 s ILE 75 Cb -0.18 -3.21 -0.01 0.00 -1.06 0.00 0.00 42.46 38.00 2nn6 s ILE 75 CO 0.82 -0.11 0.05 -0.22 -0.10 0.00 0.00 174.94 175.38 2nn6 s LEU 76 N -4.15 1.93 0.04 2.97 0.20 -1.26 -3.33 118.68 115.07 2nn6 s LEU 76 Ca 0.46 -0.41 0.01 0.00 0.69 0.00 0.00 54.13 54.89 2nn6 s LEU 76 Cb -0.08 0.39 -0.02 0.00 -0.43 0.00 0.00 46.19 46.05 2nn6 s LEU 76 CO 0.30 -0.36 -0.06 0.12 -0.29 0.00 0.00 176.35 176.05 2nn6 s PHE 77 N -1.64 0.55 0.02 5.38 5.36 0.14 -4.93 117.98 122.85 2nn6 s PHE 77 Ca -0.14 -0.53 0.00 0.00 -0.96 0.00 0.00 56.93 55.30 2nn6 s PHE 77 Cb -0.07 -0.34 -0.02 0.00 -0.34 0.00 0.00 43.02 42.25 2nn6 s PHE 77 CO -0.01 -0.12 -0.03 0.12 -1.46 0.00 0.00 175.22 173.72 2nn6 s PHE 78 N -1.53 0.23 0.01 10.12 5.36 -1.25 0.13 117.98 131.04 2nn6 s PHE 78 Ca -0.11 -0.43 0.00 0.00 -0.96 0.00 0.00 56.93 55.44 2nn6 s PHE 78 Cb -0.09 -0.16 -0.01 0.00 -0.34 0.00 0.00 43.02 42.42 2nn6 s PHE 78 CO -0.00 -0.15 -0.01 1.21 -1.46 0.00 0.00 175.22 174.81 2nn6 s ASN 79 N -1.18 0.11 -0.12 6.13 2.47 0.30 -4.89 114.94 117.75 2nn6 s ASN 79 Ca -0.13 -0.14 0.02 0.00 0.42 0.00 0.00 52.86 53.04 2nn6 s ASN 79 Cb -0.08 0.02 -0.00 0.00 -1.45 0.00 0.00 41.25 39.74 2nn6 s ASN 79 CO -0.01 -0.08 -0.20 -0.22 -3.72 0.00 0.00 177.10 172.87 2nn6 s LEU 80 N -0.40 2.27 0.04 3.21 2.96 -1.26 0.22 118.68 125.72 2nn6 s LEU 80 Ca -0.04 -0.51 0.08 0.00 -0.22 0.00 0.00 54.13 53.44 2nn6 s LEU 80 Cb -0.03 -1.48 -0.03 0.00 0.50 0.00 0.00 46.19 45.16 2nn6 s LEU 80 CO -0.00 0.14 -0.21 -0.70 -1.32 0.00 0.00 176.35 174.26 2nn6 s GLU 81 N 0.47 1.96 -0.18 1.98 -6.30 0.56 -4.90 118.70 112.29 2nn6 s GLU 81 Ca -0.14 -1.04 -0.04 0.00 -2.50 0.00 0.00 54.97 51.25 2nn6 s GLU 81 Cb -0.17 -2.11 -0.02 0.00 0.00 0.00 0.00 34.13 31.83 2nn6 s GLU 81 CO 0.06 0.53 -0.02 -0.51 0.02 0.00 0.00 175.26 175.33 2nn6 s LEU 82 N -1.38 3.22 0.48 2.70 1.43 -1.26 -1.38 118.68 122.48 2nn6 s LEU 82 Ca 0.14 -0.18 -0.00 0.00 -1.03 0.00 0.00 54.13 53.05 2nn6 s LEU 82 Cb -0.10 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.32 2nn6 s LEU 82 CO 0.04 0.11 0.71 -0.55 0.23 0.00 0.00 176.35 176.89 2nn6 s SER 83 N 0.73 5.75 0.00 2.29 0.15 -1.23 -4.85 113.70 116.54 2nn6 s SER 83 Ca -0.01 0.30 -0.08 0.00 0.70 0.00 0.00 55.95 56.86 2nn6 s SER 83 Cb -0.14 -1.48 -0.05 0.00 -1.71 0.00 0.00 66.02 62.64 2nn6 s SER 83 CO 0.02 -0.79 0.80 -0.61 1.20 0.00 0.00 173.24 173.86 2nn6 h GLN 84 N 0.30 -0.28 0.00 5.44 5.75 -1.84 -2.55 115.11 121.93 2nn6 h GLN 84 Ca -0.46 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.06 2nn6 h GLN 84 Cb 1.26 0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.87 2nn6 h GLN 84 CO 0.57 -0.19 0.34 0.00 -2.65 0.00 0.00 178.83 176.90 2nn6 n MET 85 N -3.09 0.01 0.00 1.69 0.00 -1.26 -1.60 117.12 112.88 2nn6 n MET 85 Ca -0.04 0.27 0.00 0.00 0.00 0.00 0.00 57.70 57.93 2nn6 n MET 85 Cb 0.12 -1.89 0.00 0.00 0.00 0.00 0.00 33.22 31.45 2nn6 n MET 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2nn6 n ALA 86 N -1.25 -0.08 -2.63 3.17 0.00 -0.96 -4.59 120.51 114.16 2nn6 n ALA 86 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.14 2nn6 n ALA 86 Cb 0.35 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.71 2nn6 n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nn6 s ALA 87 N -2.18 3.74 -0.06 0.00 0.00 -0.63 -2.98 121.76 119.64 2nn6 s ALA 87 Ca 0.00 -1.37 -0.25 0.00 0.00 0.00 0.00 51.96 50.33 2nn6 s ALA 87 Cb 0.00 -0.05 -0.21 0.00 0.00 0.00 0.00 23.12 22.87 2nn6 s ALA 87 CO 0.00 -0.11 1.01 -1.00 0.00 0.00 0.00 175.76 175.66 2nn6 h PRO 88 N 1.46 -0.05 0.00 0.00 0.13 -1.84 -2.90 132.00 128.80 2nn6 h PRO 88 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2nn6 h PRO 88 Cb 1.28 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2nn6 h PRO 88 CO 0.75 0.56 0.00 0.00 -0.23 0.00 0.00 178.00 179.08 2nn6 n ALA 89 N -2.48 1.51 -0.51 -0.56 0.00 -1.25 -3.82 120.51 113.39 2nn6 n ALA 89 Ca -0.09 -0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.26 2nn6 n ALA 89 Cb 0.32 -1.01 0.03 0.00 0.00 0.00 0.00 19.45 18.79 2nn6 n ALA 89 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2nn6 n PHE 90 N -1.01 0.91 -1.68 0.00 0.99 -1.10 -4.73 117.46 110.84 2nn6 n PHE 90 Ca 0.00 -1.44 -0.45 0.00 -0.00 0.00 0.00 57.45 55.56 2nn6 n PHE 90 Cb 0.00 -0.71 -0.04 0.00 -1.00 0.00 0.00 39.48 37.74 2nn6 n PHE 90 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 2nn6 n GLU 91 N 0.66 2.34 -1.59 -1.08 1.02 -1.25 -3.45 120.64 117.29 2nn6 n GLU 91 Ca 0.18 0.85 -0.55 0.00 -0.02 0.00 0.00 57.16 57.62 2nn6 n GLU 91 Cb 0.60 -2.66 -0.07 0.00 -0.02 0.00 0.00 31.44 29.29 2nn6 n GLU 91 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2nn6 n PRO 92 N 4.28 1.14 -0.10 3.49 -0.04 -1.26 -4.43 135.00 138.08 2nn6 n PRO 92 Ca 0.18 0.39 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 2nn6 n PRO 92 Cb 0.31 -2.23 0.00 0.00 -0.04 0.00 0.00 33.50 31.54 2nn6 n PRO 92 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2nn6 n GLY 93 N 5.22 -0.07 0.00 0.55 0.00 -1.26 -5.05 105.19 104.58 2nn6 n GLY 93 Ca 0.33 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.57 2nn6 n GLY 93 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2nn6 n ARG 94 N 0.73 0.00 0.00 1.61 0.63 -1.26 -4.98 116.66 113.39 2nn6 n ARG 94 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2nn6 n ARG 94 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2nn6 n ARG 94 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2nn6 n GLN 95 N 0.00 0.00 0.00 -0.14 1.13 -1.26 -4.20 117.38 112.91 2nn6 n GLN 95 Ca 0.00 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.12 2nn6 n GLN 95 Cb 0.00 -1.51 0.00 0.00 0.11 0.00 0.00 30.24 28.84 2nn6 n GLN 95 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2nn6 n SER 96 N -1.00 0.00 -0.09 1.08 7.64 -1.26 0.33 113.62 120.33 2nn6 n SER 96 Ca 0.00 0.00 0.17 0.00 1.01 0.00 0.00 58.87 60.05 2nn6 n SER 96 Cb 0.01 0.00 0.26 0.00 -1.01 0.00 0.00 64.21 63.46 2nn6 n SER 96 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2nn6 n ASP 97 N -3.58 0.00 -0.06 6.43 8.00 -1.26 0.47 116.55 126.55 2nn6 n ASP 97 Ca 0.00 0.52 -0.05 0.00 0.71 0.00 0.00 54.79 55.96 2nn6 n ASP 97 Cb 0.00 -0.15 -0.02 0.00 -0.02 0.00 0.00 41.12 40.93 2nn6 n ASP 97 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2nn6 n LEU 98 N -2.57 1.23 0.26 0.64 7.99 0.99 -3.63 117.00 121.92 2nn6 n LEU 98 Ca 0.14 0.26 0.16 0.00 -0.01 0.00 0.00 56.01 56.56 2nn6 n LEU 98 Cb 1.04 -0.67 0.75 0.00 -0.11 0.00 0.00 43.42 44.44 2nn6 n LEU 98 CO 0.14 -0.37 1.14 0.25 -1.51 0.00 0.00 177.39 177.03 2nn6 h LEU 99 N -0.64 0.00 0.00 2.23 5.85 0.26 3.24 115.31 126.25 2nn6 h LEU 99 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2nn6 h LEU 99 Cb 0.59 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.62 2nn6 h LEU 99 CO 0.00 0.00 0.00 0.52 -0.34 0.00 0.00 178.44 178.62 2nn6 n VAL 100 N -3.10 0.00 -0.02 1.05 0.31 1.69 -2.62 118.33 115.64 2nn6 n VAL 100 Ca 0.01 0.14 -0.15 0.00 -0.01 0.00 0.00 64.34 64.33 2nn6 n VAL 100 Cb 0.49 -0.41 -0.10 0.00 -0.91 0.00 0.00 33.84 32.92 2nn6 n VAL 100 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2nn6 h LYS 101 N 0.00 -0.53 0.27 5.55 3.11 -1.26 -0.34 116.57 123.37 2nn6 h LYS 101 Ca 0.00 0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.88 2nn6 h LYS 101 Cb 0.00 0.12 -0.02 0.00 -1.00 0.00 0.00 32.23 31.33 2nn6 h LYS 101 CO 0.00 -0.35 -0.25 -0.07 -2.81 0.00 0.00 179.45 175.96 2nn6 h LEU 102 N -0.55 -0.68 -0.10 5.20 3.38 0.57 1.73 115.31 124.86 2nn6 h LEU 102 Ca 0.03 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.11 2nn6 h LEU 102 Cb 0.65 0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.57 2nn6 h LEU 102 CO -0.44 -0.37 -0.37 -1.13 0.09 0.00 0.00 178.44 176.22 2nn6 h ASN 103 N -0.55 -1.16 0.00 -0.43 -0.73 -1.18 0.51 115.58 112.04 2nn6 h ASN 103 Ca -0.01 0.16 -0.00 0.00 1.87 0.00 0.00 56.30 58.32 2nn6 h ASN 103 Cb 0.50 0.48 0.00 0.00 0.27 0.00 0.00 38.32 39.57 2nn6 h ASN 103 CO -0.05 -0.40 -0.00 -0.09 -0.37 0.00 0.00 177.43 176.52 2nn6 h ARG 104 N -0.47 -0.01 -0.67 6.67 9.65 -0.78 0.35 114.38 129.13 2nn6 h ARG 104 Ca 0.08 0.00 0.14 0.00 -1.10 0.00 0.00 59.98 59.10 2nn6 h ARG 104 Cb 0.60 0.00 -0.11 0.00 -1.39 0.00 0.00 29.97 29.07 2nn6 h ARG 104 CO -0.36 0.13 0.03 1.25 2.80 0.00 0.00 179.97 183.82 2nn6 h LEU 105 N -0.14 -0.25 0.82 3.80 5.85 0.33 0.72 115.31 126.43 2nn6 h LEU 105 Ca -0.00 0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.84 2nn6 h LEU 105 Cb 0.14 0.28 0.01 0.00 0.37 0.00 0.00 40.66 41.46 2nn6 h LEU 105 CO 0.00 -0.12 -0.39 -0.03 -0.34 0.00 0.00 178.44 177.56 2nn6 h MET 106 N 0.14 -1.06 -0.13 1.25 4.05 0.25 -2.44 114.93 116.99 2nn6 h MET 106 Ca 0.36 0.07 0.04 0.00 -0.28 0.00 0.00 59.70 59.89 2nn6 h MET 106 Cb 0.60 0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 31.63 2nn6 h MET 106 CO -0.56 -0.71 0.50 1.49 0.23 0.00 0.00 176.91 177.87 2nn6 h GLU 107 N -1.28 0.00 0.11 0.39 4.81 0.14 -2.44 114.58 116.31 2nn6 h GLU 107 Ca -0.11 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 2nn6 h GLU 107 Cb 0.84 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.22 2nn6 h GLU 107 CO 0.18 0.00 -0.05 0.00 -0.73 0.00 0.00 179.01 178.41 2nn6 h ARG 108 N 0.00 -0.14 0.00 1.92 3.08 0.92 -3.03 114.38 117.13 2nn6 h ARG 108 Ca 0.06 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2nn6 h ARG 108 Cb 1.06 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.15 2nn6 h ARG 108 CO -0.00 -0.10 0.31 0.00 -1.07 0.00 0.00 179.97 179.12 2nn6 h LEU 110 N 0.00 -0.01 0.00 0.00 3.38 -1.60 -1.74 115.31 115.34 2nn6 h LEU 110 Ca 0.00 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.19 2nn6 h LEU 110 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2nn6 h LEU 110 CO 0.00 0.80 -0.07 0.54 0.09 0.00 0.00 178.44 179.80 2nn6 n ARG 111 N -4.71 0.19 -0.02 1.13 1.74 -0.58 -2.09 116.66 112.33 2nn6 n ARG 111 Ca -0.09 0.14 -0.13 0.00 -0.77 0.00 0.00 57.85 57.00 2nn6 n ARG 111 Cb 0.39 -1.71 -0.10 0.00 -1.02 0.00 0.00 32.46 30.01 2nn6 n ARG 111 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2nn6 h ASN 112 N 0.00 -0.02 1.05 0.55 4.21 -1.22 -3.24 115.58 116.92 2nn6 h ASN 112 Ca 0.00 -0.57 -0.08 0.00 1.21 0.00 0.00 56.30 56.86 2nn6 h ASN 112 Cb 0.67 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.87 2nn6 h ASN 112 CO 0.00 0.57 -0.37 -1.28 -1.29 0.00 0.00 177.43 175.06 2nn6 h SER 113 N -0.61 0.00 -2.26 5.81 0.87 -1.29 -3.45 113.55 112.62 2nn6 h SER 113 Ca -0.00 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.41 2nn6 h SER 113 Cb 0.59 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.50 2nn6 h SER 113 CO 0.00 0.37 -0.15 0.29 -0.53 0.00 0.00 176.83 176.82 2nn6 n LYS 114 N -3.41 -1.48 0.00 2.24 5.02 -0.89 -4.59 118.16 115.05 2nn6 n LYS 114 Ca 0.00 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 2nn6 n LYS 114 Cb 0.55 -4.65 0.00 0.00 -0.02 0.00 0.00 35.03 30.92 2nn6 n LYS 114 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nn6 s ILE 116 N -2.38 2.48 0.57 0.00 -5.25 -1.26 0.13 121.20 115.49 2nn6 s ILE 116 Ca 0.00 -0.97 -0.20 0.00 -0.99 0.00 0.00 60.65 58.49 2nn6 s ILE 116 Cb 0.00 -2.16 -0.04 0.00 2.95 0.00 0.00 42.46 43.21 2nn6 s ILE 116 CO 0.00 0.37 1.25 -0.62 -1.79 0.00 0.00 174.94 174.15 2nn6 s ASP 117 N 1.31 5.25 0.00 4.36 -1.08 -1.16 -4.95 116.67 120.39 2nn6 s ASP 117 Ca 0.02 2.49 0.00 0.00 -0.52 0.00 0.00 52.55 54.54 2nn6 s ASP 117 Cb -0.15 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.70 2nn6 s ASP 117 CO -0.08 -1.56 0.66 0.35 0.52 0.00 0.00 175.17 175.06 2nn6 n THR 118 N -1.37 0.33 -0.01 1.71 -2.24 -1.26 -4.69 114.28 106.75 2nn6 n THR 118 Ca 0.12 -0.66 0.01 0.00 -2.27 0.00 0.00 64.05 61.25 2nn6 n THR 118 Cb 0.48 0.85 -0.05 0.00 -2.10 0.00 0.00 70.33 69.51 2nn6 n THR 118 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2nn6 n GLU 119 N -0.17 1.33 0.12 -0.78 1.02 -1.26 0.75 120.64 121.66 2nn6 n GLU 119 Ca 0.00 -0.04 0.02 0.00 -0.02 0.00 0.00 57.16 57.12 2nn6 n GLU 119 Cb 0.09 -1.16 0.38 0.00 -0.02 0.00 0.00 31.44 30.73 2nn6 n GLU 119 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2nn6 h SER 120 N 0.00 0.21 -0.01 1.62 4.64 -1.92 -2.00 113.55 116.09 2nn6 h SER 120 Ca -0.07 -0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.15 2nn6 h SER 120 Cb 0.75 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 2nn6 h SER 120 CO 0.00 0.39 -0.21 0.17 -0.87 0.00 0.00 176.83 176.32 2nn6 h LEU 121 N 0.20 0.20 -8.24 5.97 8.10 -1.85 -3.44 115.31 116.25 2nn6 h LEU 121 Ca 0.04 -0.75 -0.74 0.00 0.11 0.00 0.00 57.88 56.54 2nn6 h LEU 121 Cb 0.41 -0.06 -0.03 0.00 -0.44 0.00 0.00 40.66 40.54 2nn6 h LEU 121 CO 0.03 0.92 1.32 0.00 -4.11 0.00 0.00 178.44 176.59 2nn6 h VAL 123 N 6.91 0.00 -2.55 0.00 2.07 -1.80 -3.43 116.25 117.44 2nn6 h VAL 123 Ca -0.18 -0.40 -0.68 0.00 0.82 0.00 0.00 66.70 66.27 2nn6 h VAL 123 Cb 1.38 0.00 -0.37 0.00 -1.52 0.00 0.00 31.29 30.78 2nn6 h VAL 123 CO 1.06 0.00 -0.11 0.52 0.02 0.00 0.00 177.57 179.06 2nn6 n VAL 124 N -3.20 3.35 -0.77 2.57 0.31 -0.34 -5.02 118.33 115.23 2nn6 n VAL 124 Ca -0.03 -5.43 -0.26 0.00 -0.01 0.00 0.00 64.34 58.61 2nn6 n VAL 124 Cb 0.10 -2.12 -0.01 0.00 -0.91 0.00 0.00 33.84 30.90 2nn6 n VAL 124 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2nn6 n ALA 125 N 1.16 -2.15 0.00 3.52 0.00 -1.26 0.24 120.51 122.02 2nn6 n ALA 125 Ca 0.28 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.90 2nn6 n ALA 125 Cb 0.38 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.95 2nn6 n ALA 125 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nn6 n GLY 126 N 1.21 2.53 0.00 0.00 0.00 0.75 -4.70 105.19 104.98 2nn6 n GLY 126 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2nn6 n GLY 126 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2nn6 n GLU 127 N -0.02 0.00 -3.93 1.61 2.13 0.14 -4.77 120.64 115.79 2nn6 n GLU 127 Ca 0.00 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.47 2nn6 n GLU 127 Cb 0.00 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 31.57 2nn6 n GLU 127 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2nn6 s LYS 128 N 0.00 2.88 0.39 5.31 -0.14 -0.74 -3.80 119.74 123.64 2nn6 s LYS 128 Ca 0.00 -0.95 0.08 0.00 -1.36 0.00 0.00 55.97 53.73 2nn6 s LYS 128 Cb 0.00 -3.05 -0.08 0.00 -1.68 0.00 0.00 37.83 33.02 2nn6 s LYS 128 CO 0.00 -0.41 -0.02 0.54 -0.76 0.00 0.00 175.35 174.71 2nn6 s VAL 129 N 1.35 2.05 -0.00 3.17 0.11 0.21 -1.20 120.40 126.09 2nn6 s VAL 129 Ca 0.01 -2.06 -0.05 0.00 -2.93 0.00 0.00 61.98 56.94 2nn6 s VAL 129 Cb -0.17 -2.89 -0.04 0.00 -1.53 0.00 0.00 36.38 31.74 2nn6 s VAL 129 CO -0.03 -0.06 0.24 0.26 -3.33 0.00 0.00 175.10 172.17 2nn6 s TRP 130 N -2.69 3.57 -0.16 1.54 0.52 -1.26 -0.57 118.94 119.89 2nn6 s TRP 130 Ca 0.34 0.50 0.02 0.00 0.02 0.00 0.00 56.10 56.98 2nn6 s TRP 130 Cb 0.08 -1.93 0.01 0.00 -1.15 0.00 0.00 33.47 30.48 2nn6 s TRP 130 CO 0.17 0.63 -0.21 -1.14 0.02 0.00 0.00 176.95 176.42 2nn6 s GLN 131 N -1.80 2.99 -0.19 4.98 -0.44 -0.35 -3.51 119.66 121.34 2nn6 s GLN 131 Ca 0.27 -0.84 0.01 0.00 -2.50 0.00 0.00 55.36 52.30 2nn6 s GLN 131 Cb -0.13 -2.49 0.02 0.00 -1.64 0.00 0.00 33.01 28.77 2nn6 s GLN 131 CO 0.16 -0.11 -0.18 0.42 0.50 0.00 0.00 175.29 176.08 2nn6 s ILE 132 N 1.05 2.14 0.05 -2.34 1.01 -1.21 -1.77 121.20 120.13 2nn6 s ILE 132 Ca -0.01 -0.98 0.05 0.00 0.00 0.00 0.00 60.65 59.71 2nn6 s ILE 132 Cb -0.14 -1.94 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 2nn6 s ILE 132 CO -0.07 0.48 -0.08 -0.60 0.00 0.00 0.00 174.94 174.67 2nn6 s ARG 133 N 1.28 2.39 -0.02 2.79 3.52 -1.20 0.24 118.95 127.94 2nn6 s ARG 133 Ca 0.04 -0.85 0.02 0.00 -0.13 0.00 0.00 55.73 54.82 2nn6 s ARG 133 Cb -0.14 -2.42 0.00 0.00 -1.56 0.00 0.00 34.95 30.83 2nn6 s ARG 133 CO -0.12 0.56 -0.09 0.14 -0.81 0.00 0.00 175.30 174.99 2nn6 s VAL 134 N -1.09 0.74 -0.04 7.11 -7.23 0.34 0.13 120.40 120.35 2nn6 s VAL 134 Ca 0.19 -0.35 0.05 0.00 -1.81 0.00 0.00 61.98 60.06 2nn6 s VAL 134 Cb -0.11 -0.66 -0.01 0.00 0.56 0.00 0.00 36.38 36.17 2nn6 s VAL 134 CO 0.10 0.23 -0.21 -1.81 -0.31 0.00 0.00 175.10 173.11 2nn6 s ASP 135 N 0.11 2.53 -0.11 4.85 1.01 0.93 0.11 116.67 126.10 2nn6 s ASP 135 Ca -0.02 -0.41 0.02 0.00 0.71 0.00 0.00 52.55 52.85 2nn6 s ASP 135 Cb -0.07 -0.64 -0.01 0.00 1.01 0.00 0.00 42.92 43.21 2nn6 s ASP 135 CO 0.00 0.20 -0.18 -0.76 0.21 0.00 0.00 175.17 174.64 2nn6 s LEU 136 N -0.11 2.44 -0.15 1.23 1.43 0.59 -2.30 118.68 121.81 2nn6 s LEU 136 Ca -0.02 -0.42 0.01 0.00 -1.03 0.00 0.00 54.13 52.67 2nn6 s LEU 136 Cb -0.12 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.60 2nn6 s LEU 136 CO 0.02 0.17 -0.18 -1.00 0.23 0.00 0.00 176.35 175.60 2nn6 s HIS 137 N 0.30 2.45 -0.57 0.29 3.76 -0.50 0.21 115.29 121.23 2nn6 s HIS 137 Ca -0.14 -1.36 -0.24 0.00 -0.15 0.00 0.00 55.06 53.18 2nn6 s HIS 137 Cb -0.17 -1.73 0.05 0.00 1.11 0.00 0.00 32.58 31.84 2nn6 s HIS 137 CO 0.07 -0.69 0.95 -1.17 -0.85 0.00 0.00 174.74 173.05 2nn6 s LEU 138 N 1.23 4.15 0.00 0.89 1.98 -0.48 0.88 118.68 127.33 2nn6 s LEU 138 Ca 0.01 -0.49 0.00 0.00 -2.89 0.00 0.00 54.13 50.77 2nn6 s LEU 138 Cb -0.14 -2.74 0.00 0.00 0.66 0.00 0.00 46.19 43.98 2nn6 s LEU 138 CO -0.09 -1.28 0.12 0.18 -1.89 0.00 0.00 176.35 173.40 2nn6 n LEU 139 N 7.53 1.49 -4.92 -0.68 7.99 0.53 -3.47 117.00 125.47 2nn6 n LEU 139 Ca 0.01 0.12 -0.26 0.00 -0.01 0.00 0.00 56.01 55.86 2nn6 n LEU 139 Cb 0.47 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.76 2nn6 n LEU 139 CO 0.64 0.00 0.23 0.21 -1.51 0.00 0.00 177.39 176.96 2nn6 s ASN 140 N -1.33 6.35 -0.33 -1.43 3.84 -1.23 -2.56 114.94 118.26 2nn6 s ASN 140 Ca 0.00 0.65 0.01 0.00 0.21 0.00 0.00 52.86 53.73 2nn6 s ASN 140 Cb 0.00 -2.12 0.10 0.00 -0.55 0.00 0.00 41.25 38.68 2nn6 s ASN 140 CO 0.00 -0.30 0.09 -2.28 -2.79 0.00 0.00 177.10 171.82 2nn6 s HIS 141 N -2.29 2.40 -0.29 0.43 5.65 -1.16 -2.49 115.29 117.53 2nn6 s HIS 141 Ca 0.43 -2.20 -0.00 0.00 0.25 0.00 0.00 55.06 53.54 2nn6 s HIS 141 Cb -0.10 -2.13 0.09 0.00 -1.18 0.00 0.00 32.58 29.26 2nn6 s HIS 141 CO 0.35 -0.89 0.07 0.34 -0.65 0.00 0.00 174.74 173.95 2nn6 s ASP 142 N 1.30 3.99 0.48 9.88 2.15 -1.15 -4.89 116.67 128.43 2nn6 s ASP 142 Ca 0.11 -1.57 0.00 0.00 0.43 0.00 0.00 52.55 51.52 2nn6 s ASP 142 Cb -0.18 -0.96 0.00 0.00 -0.30 0.00 0.00 42.92 41.48 2nn6 s ASP 142 CO -0.18 -0.38 0.00 0.61 -0.17 0.00 0.00 175.17 175.05 2nn6 n GLY 143 N 4.78 -0.80 1.43 2.66 0.00 -1.26 -4.12 105.19 107.88 2nn6 n GLY 143 Ca -0.03 -1.13 -0.26 0.00 0.00 0.00 0.00 46.02 44.59 2nn6 n GLY 143 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2nn6 n ASN 144 N -1.24 0.36 0.00 1.61 4.05 0.49 -4.72 115.26 115.81 2nn6 n ASN 144 Ca 0.00 0.33 0.00 0.00 0.45 0.00 0.00 54.58 55.36 2nn6 n ASN 144 Cb 0.00 -0.38 0.00 0.00 1.23 0.00 0.00 39.78 40.63 2nn6 n ASN 144 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 2nn6 n ILE 145 N 2.56 0.00 -0.27 -1.44 -0.00 -1.26 -4.41 119.36 114.54 2nn6 n ILE 145 Ca 0.21 0.33 0.27 0.00 -0.00 0.00 0.00 62.75 63.56 2nn6 n ILE 145 Cb -0.02 -1.21 0.41 0.00 -0.00 0.00 0.00 39.64 38.83 2nn6 n ILE 145 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 2nn6 n ILE 146 N -1.92 0.00 -0.04 1.39 -0.00 -1.26 0.17 119.36 117.69 2nn6 n ILE 146 Ca 0.00 1.01 -0.08 0.00 -0.00 0.00 0.00 62.75 63.68 2nn6 n ILE 146 Cb 0.00 -1.78 -0.07 0.00 -0.00 0.00 0.00 39.64 37.79 2nn6 n ILE 146 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.55 176.99 2nn6 h ASP 147 N 0.00 -0.04 -0.16 4.38 3.45 -1.81 0.79 116.42 123.03 2nn6 h ASP 147 Ca 0.47 -0.49 -0.03 0.00 0.43 0.00 0.00 57.03 57.41 2nn6 h ASP 147 Cb 2.43 0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 41.20 2nn6 h ASP 147 CO -0.00 0.69 0.02 0.00 -1.57 0.00 0.00 179.24 178.37 2nn6 h ALA 148 N -0.44 1.57 -0.76 3.45 0.00 0.14 0.17 119.26 123.38 2nn6 h ALA 148 Ca -0.00 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 54.88 2nn6 h ALA 148 Cb 0.53 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.13 2nn6 h ALA 148 CO 0.01 0.32 0.39 0.00 0.00 0.00 0.00 179.25 179.96 2nn6 h ALA 149 N 1.67 1.09 -0.01 0.00 0.00 0.86 0.82 119.26 123.67 2nn6 h ALA 149 Ca 0.08 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2nn6 h ALA 149 Cb 0.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2nn6 h ALA 149 CO 0.00 -0.05 -0.08 0.66 0.00 0.00 0.00 179.25 179.78 2nn6 h SER 150 N 0.62 0.09 -0.37 0.00 4.64 0.17 -2.96 113.55 115.76 2nn6 h SER 150 Ca 0.39 -0.69 0.08 0.00 -0.47 0.00 0.00 61.79 61.09 2nn6 h SER 150 Cb 0.45 -0.03 -0.08 0.00 -0.31 0.00 0.00 62.40 62.43 2nn6 h SER 150 CO -0.30 0.77 -0.20 0.40 -0.87 0.00 0.00 176.83 176.63 2nn6 h ILE 151 N -0.58 0.42 -0.53 0.95 2.04 -0.48 0.69 117.51 120.02 2nn6 h ILE 151 Ca -0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.90 2nn6 h ILE 151 Cb 0.78 0.42 -0.06 0.00 -0.74 0.00 0.00 36.82 37.21 2nn6 h ILE 151 CO 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 178.15 177.84 2nn6 h ALA 152 N 1.08 -0.32 0.60 1.87 0.00 0.67 0.98 119.26 124.13 2nn6 h ALA 152 Ca 0.18 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2nn6 h ALA 152 Cb 0.43 1.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.41 2nn6 h ALA 152 CO -0.46 -0.55 -0.35 0.00 0.00 0.00 0.00 179.25 177.89 2nn6 h ALA 153 N -0.20 -1.19 -0.42 0.00 0.00 -0.95 0.37 119.26 116.86 2nn6 h ALA 153 Ca 0.08 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.89 2nn6 h ALA 153 Cb 0.23 0.44 -0.09 0.00 0.00 0.00 0.00 17.79 18.37 2nn6 h ALA 153 CO -0.51 -1.15 -0.38 0.82 0.00 0.00 0.00 179.25 178.04 2nn6 h ILE 154 N -0.88 0.16 -0.99 0.00 1.08 -0.45 3.15 117.51 119.57 2nn6 h ILE 154 Ca -0.08 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 64.60 2nn6 h ILE 154 Cb 0.70 0.16 -0.11 0.00 -3.07 0.00 0.00 36.82 34.50 2nn6 h ILE 154 CO 0.10 0.00 0.59 0.58 -0.69 0.00 0.00 178.15 178.72 2nn6 h VAL 155 N -0.28 0.63 0.23 1.67 2.07 0.11 -0.54 116.25 120.14 2nn6 h VAL 155 Ca 0.16 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2nn6 h VAL 155 Cb 0.56 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2nn6 h VAL 155 CO -0.57 0.12 -0.11 0.00 0.02 0.00 0.00 177.57 177.03 2nn6 h ALA 156 N 1.68 -0.31 -1.16 1.67 0.00 0.49 -3.30 119.26 118.33 2nn6 h ALA 156 Ca 0.60 -0.20 0.37 0.00 0.00 0.00 0.00 54.91 55.68 2nn6 h ALA 156 Cb 1.03 0.12 -0.13 0.00 0.00 0.00 0.00 17.79 18.81 2nn6 h ALA 156 CO -0.43 -0.37 0.72 -0.07 0.00 0.00 0.00 179.25 179.10 2nn6 h LEU 157 N -0.92 0.36 -0.60 0.00 -0.00 0.69 0.41 115.31 115.25 2nn6 h LEU 157 Ca -0.03 0.14 -0.08 0.00 -0.00 0.00 0.00 57.88 57.91 2nn6 h LEU 157 Cb 0.49 0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 41.25 2nn6 h LEU 157 CO 0.05 -0.12 -0.37 0.00 -0.00 0.00 0.00 178.44 178.00 2nn6 h HIS 159 N 0.00 0.00 -3.56 0.00 -0.00 -0.27 -3.48 115.15 107.84 2nn6 h HIS 159 Ca -0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 60.37 59.86 2nn6 h HIS 159 Cb 1.05 0.00 0.21 0.00 -0.00 0.00 0.00 27.41 28.67 2nn6 h HIS 159 CO 0.00 0.74 -0.29 0.34 -0.00 0.00 0.00 177.93 178.72 2nn6 n PHE 160 N -3.16 -0.62 -3.57 5.26 7.35 -1.13 -3.66 117.46 117.93 2nn6 n PHE 160 Ca -0.04 0.23 -0.25 0.00 -0.76 0.00 0.00 57.45 56.63 2nn6 n PHE 160 Cb 0.86 -1.82 -0.16 0.00 0.35 0.00 0.00 39.48 38.71 2nn6 n PHE 160 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2nn6 s ARG 161 N -4.06 0.12 0.05 -4.13 1.81 -1.26 -4.71 118.95 106.76 2nn6 s ARG 161 Ca 0.62 -0.14 -0.29 0.00 -1.72 0.00 0.00 55.73 54.20 2nn6 s ARG 161 Cb -0.21 -1.54 -0.05 0.00 -0.45 0.00 0.00 34.95 32.71 2nn6 s ARG 161 CO 0.64 -0.76 0.93 0.50 -0.68 0.00 0.00 175.30 175.92 2nn6 s ARG 162 N 2.17 4.60 0.69 3.54 3.52 -1.18 -4.81 118.95 127.48 2nn6 s ARG 162 Ca 0.05 1.35 -0.11 0.00 -0.13 0.00 0.00 55.73 56.89 2nn6 s ARG 162 Cb -0.16 -3.41 0.00 0.00 -1.56 0.00 0.00 34.95 29.82 2nn6 s ARG 162 CO -0.17 0.11 1.07 -1.25 -0.81 0.00 0.00 175.30 174.25 2nn6 s PRO 163 N 0.43 2.99 0.00 5.12 0.04 -1.26 -2.87 135.00 139.44 2nn6 s PRO 163 Ca 0.47 0.68 0.00 0.00 0.04 0.00 0.00 61.00 62.19 2nn6 s PRO 163 Cb -0.22 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2nn6 s PRO 163 CO 0.27 -0.99 0.00 -3.47 0.04 0.00 0.00 177.00 172.85 2nn6 n ASP 164 N -3.02 0.00 -0.00 6.66 4.64 -1.26 -4.93 116.55 118.65 2nn6 n ASP 164 Ca 0.07 0.00 -0.00 0.00 -1.38 0.00 0.00 54.79 53.47 2nn6 n ASP 164 Cb 0.55 0.00 -0.00 0.00 -1.04 0.00 0.00 41.12 40.63 2nn6 n ASP 164 CO 0.00 0.00 0.00 0.52 -0.82 0.00 0.00 177.20 176.90 2nn6 n VAL 165 N 0.00 0.14 -3.61 5.18 0.31 -1.26 -4.68 118.33 114.41 2nn6 n VAL 165 Ca 0.00 0.21 -0.06 0.00 -0.01 0.00 0.00 64.34 64.48 2nn6 n VAL 165 Cb 0.00 -1.27 -0.07 0.00 -0.91 0.00 0.00 33.84 31.59 2nn6 n VAL 165 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2nn6 s SER 166 N -4.75 -0.54 -0.19 4.52 1.04 -0.62 -5.03 113.70 108.13 2nn6 s SER 166 Ca -0.01 1.11 -0.04 0.00 0.48 0.00 0.00 55.95 57.49 2nn6 s SER 166 Cb 0.00 1.66 0.06 0.00 0.10 0.00 0.00 66.02 67.85 2nn6 s SER 166 CO 0.02 -0.23 0.08 -0.69 0.98 0.00 0.00 173.24 173.39 2nn6 s VAL 167 N 2.71 0.12 0.19 5.02 1.01 -1.26 -2.45 120.40 125.73 2nn6 s VAL 167 Ca -0.01 -0.36 0.11 0.00 0.00 0.00 0.00 61.98 61.71 2nn6 s VAL 167 Cb -0.12 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 2nn6 s VAL 167 CO -0.15 -0.31 -0.22 0.00 0.00 0.00 0.00 175.10 174.42 2nn6 s GLN 168 N 2.04 1.45 5.57 2.72 0.00 -1.17 -4.94 119.66 125.33 2nn6 s GLN 168 Ca 0.02 -1.51 0.00 0.00 -0.00 0.00 0.00 55.36 53.87 2nn6 s GLN 168 Cb -0.16 -1.67 0.00 0.00 0.00 0.00 0.00 33.01 31.17 2nn6 s GLN 168 CO -0.12 0.35 0.00 0.41 0.00 0.00 0.00 175.29 175.94 2nn6 n GLY 169 N 0.20 3.22 1.87 2.60 0.00 -1.26 -1.64 105.19 110.18 2nn6 n GLY 169 Ca -0.12 -0.10 -0.21 0.00 0.00 0.00 0.00 46.02 45.59 2nn6 n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nn6 n ASP 170 N 3.43 4.81 -4.27 1.61 9.92 -1.26 -4.99 116.55 125.79 2nn6 n ASP 170 Ca 0.00 -3.76 -0.26 0.00 -0.53 0.00 0.00 54.79 50.24 2nn6 n ASP 170 Cb 0.00 -0.69 -0.14 0.00 -0.64 0.00 0.00 41.12 39.65 2nn6 n ASP 170 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2nn6 s GLU 171 N -3.52 1.39 -0.11 -1.24 2.02 -0.65 -5.13 118.70 111.45 2nn6 s GLU 171 Ca 0.54 -1.02 0.01 0.00 0.02 0.00 0.00 54.97 54.52 2nn6 s GLU 171 Cb 0.45 -1.56 0.02 0.00 0.10 0.00 0.00 34.13 33.14 2nn6 s GLU 171 CO 0.02 0.39 -0.12 0.08 0.02 0.00 0.00 175.26 175.65 2nn6 s VAL 172 N -0.88 1.33 -0.04 2.63 1.01 -1.26 -3.02 120.40 120.17 2nn6 s VAL 172 Ca 0.08 -0.52 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 2nn6 s VAL 172 Cb -0.09 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.06 2nn6 s VAL 172 CO 0.02 0.41 0.10 0.42 0.00 0.00 0.00 175.10 176.05 2nn6 s THR 173 N 1.26 -0.03 -0.05 3.92 -4.23 -1.03 -5.03 115.64 110.46 2nn6 s THR 173 Ca -0.02 0.11 -0.03 0.00 -1.18 0.00 0.00 61.69 60.58 2nn6 s THR 173 Cb -0.14 -0.16 0.02 0.00 1.34 0.00 0.00 72.50 73.57 2nn6 s THR 173 CO -0.05 0.05 0.11 -0.76 -0.54 0.00 0.00 174.62 173.43 2nn6 s LEU 174 N 0.68 1.20 -0.09 4.79 1.43 -1.26 -1.60 118.68 123.84 2nn6 s LEU 174 Ca -0.05 0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.30 2nn6 s LEU 174 Cb -0.07 0.30 0.01 0.00 0.03 0.00 0.00 46.19 46.45 2nn6 s LEU 174 CO -0.03 -0.09 -0.19 -0.31 0.23 0.00 0.00 176.35 175.96 2nn6 s TYR 175 N 0.61 2.14 0.35 0.29 1.51 -1.26 -4.93 117.35 116.08 2nn6 s TYR 175 Ca -0.05 -0.87 0.10 0.00 -1.01 0.00 0.00 57.07 55.24 2nn6 s TYR 175 Cb -0.06 -1.47 0.84 0.00 -0.11 0.00 0.00 41.96 41.15 2nn6 s TYR 175 CO -0.03 -0.37 1.85 1.79 -1.11 0.00 0.00 175.55 177.68 2nn6 h THR 176 N 5.81 0.78 0.00 -0.71 1.35 -2.01 0.54 112.91 118.69 2nn6 h THR 176 Ca -0.24 -0.23 -0.00 0.00 -0.55 0.00 0.00 66.41 65.39 2nn6 h THR 176 Cb 1.22 0.06 -0.00 0.00 -1.73 0.00 0.00 68.15 67.69 2nn6 h THR 176 CO 0.47 0.12 -0.01 1.55 -0.25 0.00 0.00 175.52 177.40 2nn6 h PRO 177 N 0.67 0.00 0.00 4.72 0.13 -2.01 -0.13 132.00 135.37 2nn6 h PRO 177 Ca 0.48 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.51 2nn6 h PRO 177 Cb 0.83 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.94 2nn6 h PRO 177 CO -0.24 0.01 -1.59 0.39 -0.23 0.00 0.00 178.00 176.35 2nn6 n GLU 178 N -4.28 0.64 0.00 0.86 4.71 0.04 -3.70 120.64 118.91 2nn6 n GLU 178 Ca -0.03 0.04 0.06 0.00 -0.01 0.00 0.00 57.16 57.22 2nn6 n GLU 178 Cb 0.10 -1.69 0.25 0.00 -1.01 0.00 0.00 31.44 29.09 2nn6 n GLU 178 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2nn6 n GLU 179 N -2.63 0.00 0.00 3.49 1.02 0.17 -2.89 120.64 119.80 2nn6 n GLU 179 Ca -0.08 0.30 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 2nn6 n GLU 179 Cb 0.72 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.66 2nn6 n GLU 179 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2nn6 n ARG 180 N -1.50 0.03 0.04 3.49 5.12 -0.61 -3.83 116.66 119.39 2nn6 n ARG 180 Ca 0.03 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.95 2nn6 n ARG 180 Cb 0.14 -1.35 0.00 0.00 -1.16 0.00 0.00 32.46 30.09 2nn6 n ARG 180 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2nn6 n ASP 181 N -0.85 -0.01 -4.68 0.55 8.00 -1.14 -5.06 116.55 113.36 2nn6 n ASP 181 Ca 0.00 0.12 -0.42 0.00 0.71 0.00 0.00 54.79 55.20 2nn6 n ASP 181 Cb 0.00 0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 2nn6 n ASP 181 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2nn6 s PRO 182 N -1.26 4.26 0.00 -0.24 0.04 -1.25 -4.81 135.00 131.75 2nn6 s PRO 182 Ca 0.00 1.93 0.00 0.00 0.04 0.00 0.00 61.00 62.97 2nn6 s PRO 182 Cb 0.00 -3.67 0.00 0.00 0.04 0.00 0.00 34.50 30.87 2nn6 s PRO 182 CO 0.00 -0.63 0.00 1.33 0.04 0.00 0.00 177.00 177.74 2nn6 n VAL 183 N 4.91 0.00 -2.02 -0.36 0.24 -1.14 -4.01 118.33 115.95 2nn6 n VAL 183 Ca 0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.44 2nn6 n VAL 183 Cb 0.44 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.81 2nn6 n VAL 183 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2nn6 n PRO 184 N 0.00 3.87 -3.87 7.34 -0.04 -1.24 -3.21 135.00 137.85 2nn6 n PRO 184 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 2nn6 n PRO 184 Cb 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.44 2nn6 n PRO 184 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2nn6 s LEU 185 N 0.00 -0.18 -1.10 1.53 1.43 -1.26 -3.13 118.68 115.98 2nn6 s LEU 185 Ca 0.00 -0.69 -0.05 0.00 -1.03 0.00 0.00 54.13 52.37 2nn6 s LEU 185 Cb 0.00 2.64 0.30 0.00 0.03 0.00 0.00 46.19 49.16 2nn6 s LEU 185 CO 0.00 -1.35 1.49 -1.20 0.23 0.00 0.00 176.35 175.52 2nn6 n SER 186 N -0.53 6.30 -4.35 2.29 7.64 -1.26 -4.94 113.62 118.78 2nn6 n SER 186 Ca -0.04 -3.38 -0.44 0.00 1.01 0.00 0.00 58.87 56.02 2nn6 n SER 186 Cb 0.59 -1.29 0.00 0.00 -1.01 0.00 0.00 64.21 62.50 2nn6 n SER 186 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2nn6 n ILE 187 N 1.53 4.43 0.34 0.44 -0.00 -1.26 -3.01 119.36 121.83 2nn6 n ILE 187 Ca 0.27 -4.98 -0.17 0.00 -0.00 0.00 0.00 62.75 57.87 2nn6 n ILE 187 Cb 0.34 -2.48 -0.08 0.00 -0.00 0.00 0.00 39.64 37.42 2nn6 n ILE 187 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.55 177.00 2nn6 h HIS 188 N 6.76 -0.80 -3.17 1.39 3.86 0.70 -3.45 115.15 120.44 2nn6 h HIS 188 Ca 0.27 -0.02 -0.62 0.00 -1.16 0.00 0.00 60.37 58.85 2nn6 h HIS 188 Cb 0.84 0.26 -0.18 0.00 1.06 0.00 0.00 27.41 29.39 2nn6 h HIS 188 CO 1.00 -0.46 -0.81 -1.01 0.86 0.00 0.00 177.93 177.51 2nn6 s HIS 189 N -5.52 2.17 -0.28 2.45 3.76 -0.85 -5.04 115.29 111.97 2nn6 s HIS 189 Ca -0.16 -0.39 -0.00 0.00 -0.15 0.00 0.00 55.06 54.36 2nn6 s HIS 189 Cb 0.03 -1.07 0.09 0.00 1.11 0.00 0.00 32.58 32.74 2nn6 s HIS 189 CO 0.57 0.46 0.06 -1.64 -0.85 0.00 0.00 174.74 173.34 2nn6 s MET 190 N -2.74 0.93 0.07 1.40 1.00 -1.26 -4.63 119.30 114.06 2nn6 s MET 190 Ca 0.20 -1.05 0.00 0.00 0.00 0.00 0.00 55.69 54.84 2nn6 s MET 190 Cb -0.07 -2.23 -0.04 0.00 0.00 0.00 0.00 34.83 32.48 2nn6 s MET 190 CO 0.09 -0.87 0.22 -1.25 0.00 0.00 0.00 175.02 173.21 2nn6 s PRO 191 N 1.54 3.44 0.23 2.03 0.04 -1.26 -3.35 135.00 137.67 2nn6 s PRO 191 Ca 0.06 -0.46 0.04 0.00 0.04 0.00 0.00 61.00 60.68 2nn6 s PRO 191 Cb -0.18 -3.03 -0.05 0.00 0.04 0.00 0.00 34.50 31.28 2nn6 s PRO 191 CO -0.18 0.60 -0.03 -1.50 0.04 0.00 0.00 177.00 175.93 2nn6 s ILE 192 N -1.54 1.17 -0.09 0.56 -1.16 -1.24 -4.87 121.20 114.03 2nn6 s ILE 192 Ca 0.35 -2.06 -0.01 0.00 -0.51 0.00 0.00 60.65 58.42 2nn6 s ILE 192 Cb -0.13 -2.31 -0.03 0.00 0.61 0.00 0.00 42.46 40.60 2nn6 s ILE 192 CO 0.28 -0.37 -0.03 0.00 -2.81 0.00 0.00 174.94 172.02 2nn6 s VAL 194 N -0.71 0.60 0.12 0.00 1.01 -0.96 -4.60 120.40 115.85 2nn6 s VAL 194 Ca 0.11 -0.10 0.06 0.00 0.00 0.00 0.00 61.98 62.05 2nn6 s VAL 194 Cb -0.11 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 2nn6 s VAL 194 CO 0.02 0.23 -0.01 -0.44 0.00 0.00 0.00 175.10 174.90 2nn6 s SER 195 N 1.87 4.90 -0.10 3.32 0.01 -1.26 -0.68 113.70 121.77 2nn6 s SER 195 Ca 0.04 -0.26 0.01 0.00 1.31 0.00 0.00 55.95 57.05 2nn6 s SER 195 Cb -0.13 -1.11 0.02 0.00 0.21 0.00 0.00 66.02 65.01 2nn6 s SER 195 CO -0.06 0.15 -0.09 -0.36 0.41 0.00 0.00 173.24 173.28 2nn6 s PHE 196 N -1.42 1.48 0.08 2.43 0.40 0.71 -3.73 117.98 117.93 2nn6 s PHE 196 Ca 0.26 -0.67 -0.04 0.00 -0.60 0.00 0.00 56.93 55.87 2nn6 s PHE 196 Cb -0.11 -1.17 -0.05 0.00 0.51 0.00 0.00 43.02 42.20 2nn6 s PHE 196 CO 0.18 -0.43 0.30 0.00 0.70 0.00 0.00 175.22 175.98 2nn6 s ALA 197 N 1.30 3.86 0.21 5.36 0.00 0.77 -0.75 121.76 132.52 2nn6 s ALA 197 Ca -0.03 -0.63 0.10 0.00 0.00 0.00 0.00 51.96 51.41 2nn6 s ALA 197 Cb -0.14 -2.04 -0.04 0.00 0.00 0.00 0.00 23.12 20.90 2nn6 s ALA 197 CO -0.04 0.70 -0.16 -0.06 0.00 0.00 0.00 175.76 176.21 2nn6 s PHE 198 N -1.51 2.46 -0.12 0.00 0.40 0.97 -0.06 117.98 120.12 2nn6 s PHE 198 Ca 0.35 -0.29 -0.04 0.00 -0.60 0.00 0.00 56.93 56.36 2nn6 s PHE 198 Cb -0.13 -1.17 0.05 0.00 0.51 0.00 0.00 43.02 42.28 2nn6 s PHE 198 CO 0.23 0.56 0.07 -0.06 0.70 0.00 0.00 175.22 176.71 2nn6 s PHE 199 N -1.90 0.25 -0.17 0.36 0.40 -0.10 -2.26 117.98 114.56 2nn6 s PHE 199 Ca 0.25 -0.15 -0.04 0.00 -0.60 0.00 0.00 56.93 56.39 2nn6 s PHE 199 Cb -0.08 -0.65 0.02 0.00 0.51 0.00 0.00 43.02 42.82 2nn6 s PHE 199 CO 0.14 -0.39 0.09 1.04 0.70 0.00 0.00 175.22 176.79 2nn6 n GLN 200 N 5.26 -3.02 -3.91 0.44 6.02 -1.26 -2.48 117.38 118.43 2nn6 n GLN 200 Ca -0.06 2.46 -0.31 0.00 -0.01 0.00 0.00 57.00 59.08 2nn6 n GLN 200 Cb 0.49 -3.86 0.01 0.00 1.02 0.00 0.00 30.24 27.91 2nn6 n GLN 200 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2nn6 n GLN 201 N 1.43 -4.85 -2.76 -1.09 3.00 -1.26 -0.47 117.38 111.38 2nn6 n GLN 201 Ca -0.14 0.55 -0.10 0.00 -0.01 0.00 0.00 57.00 57.29 2nn6 n GLN 201 Cb 0.31 -5.40 -0.02 0.00 0.00 0.00 0.00 30.24 25.13 2nn6 n GLN 201 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2nn6 n GLY 202 N -1.58 -0.42 0.90 1.08 0.00 -1.23 -4.61 105.19 99.34 2nn6 n GLY 202 Ca 0.04 0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.11 2nn6 n GLY 202 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2nn6 n THR 203 N -2.57 0.88 -3.64 2.61 -2.24 0.38 -4.64 114.28 105.06 2nn6 n THR 203 Ca 0.03 -0.49 -0.13 0.00 -2.27 0.00 0.00 64.05 61.19 2nn6 n THR 203 Cb 0.43 -0.27 -0.07 0.00 -2.10 0.00 0.00 70.33 68.32 2nn6 n THR 203 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2nn6 s TYR 204 N -1.66 -0.82 -0.05 4.78 1.51 -1.17 -4.97 117.35 114.97 2nn6 s TYR 204 Ca 0.20 1.90 0.01 0.00 -1.01 0.00 0.00 57.07 58.18 2nn6 s TYR 204 Cb 0.14 0.33 0.02 0.00 -0.11 0.00 0.00 41.96 42.35 2nn6 s TYR 204 CO 0.08 -0.40 -0.05 -1.17 -1.11 0.00 0.00 175.55 172.90 2nn6 s LEU 205 N 0.62 1.31 0.34 -1.29 0.20 -1.26 -0.92 118.68 117.68 2nn6 s LEU 205 Ca -0.02 -0.14 0.09 0.00 0.69 0.00 0.00 54.13 54.75 2nn6 s LEU 205 Cb -0.05 -0.48 -0.05 0.00 -0.43 0.00 0.00 46.19 45.18 2nn6 s LEU 205 CO -0.03 -0.06 0.06 -0.76 -0.29 0.00 0.00 176.35 175.27 2nn6 s LEU 206 N 0.96 3.09 -0.03 -0.68 1.02 0.91 -4.88 118.68 119.06 2nn6 s LEU 206 Ca -0.10 -0.90 0.02 0.00 0.02 0.00 0.00 54.13 53.16 2nn6 s LEU 206 Cb -0.14 -1.50 0.01 0.00 0.02 0.00 0.00 46.19 44.58 2nn6 s LEU 206 CO -0.00 -0.25 -0.06 -0.69 0.02 0.00 0.00 176.35 175.37 2nn6 s VAL 207 N -2.48 0.58 -0.88 -1.59 1.01 -1.12 -0.16 120.40 115.77 2nn6 s VAL 207 Ca 0.36 -0.22 -0.05 0.00 0.00 0.00 0.00 61.98 62.07 2nn6 s VAL 207 Cb -0.01 -0.56 -0.01 0.00 0.00 0.00 0.00 36.38 35.80 2nn6 s VAL 207 CO 0.20 0.21 0.72 -0.67 0.00 0.00 0.00 175.10 175.57 2nn6 n ASP 208 N 3.56 -6.50 -4.76 3.32 2.03 -1.24 -4.63 116.55 108.32 2nn6 n ASP 208 Ca -0.21 -0.54 -0.35 0.00 0.52 0.00 0.00 54.79 54.21 2nn6 n ASP 208 Cb 0.53 -4.09 0.03 0.00 -0.72 0.00 0.00 41.12 36.87 2nn6 n ASP 208 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2nn6 s PRO 209 N -4.22 3.06 0.71 -0.67 0.04 -1.26 -4.74 135.00 127.93 2nn6 s PRO 209 Ca 0.15 1.68 -0.02 0.00 0.04 0.00 0.00 61.00 62.86 2nn6 s PRO 209 Cb -0.04 -1.96 0.11 0.00 0.04 0.00 0.00 34.50 32.65 2nn6 s PRO 209 CO 0.80 -1.10 0.98 0.54 0.04 0.00 0.00 177.00 178.27 2nn6 s ASN 210 N -1.81 4.46 0.13 6.66 4.22 -1.26 0.18 114.94 127.53 2nn6 s ASN 210 Ca 0.74 -0.18 -0.30 0.00 -2.14 0.00 0.00 52.86 50.98 2nn6 s ASN 210 Cb -0.26 -0.29 -0.06 0.00 1.28 0.00 0.00 41.25 41.91 2nn6 s ASN 210 CO 0.32 -1.78 1.57 -0.08 -2.04 0.00 0.00 177.10 175.09 2nn6 h GLU 211 N -0.51 -0.45 -0.59 3.55 4.57 -1.85 1.61 114.58 120.91 2nn6 h GLU 211 Ca -0.39 0.03 0.11 0.00 -1.18 0.00 0.00 59.36 57.93 2nn6 h GLU 211 Cb 1.27 0.10 -0.08 0.00 -0.16 0.00 0.00 28.75 29.89 2nn6 h GLU 211 CO 0.44 -0.30 0.15 -0.09 -1.18 0.00 0.00 179.01 178.03 2nn6 h ARG 212 N -0.47 0.29 0.29 1.92 9.65 -1.96 -0.02 114.38 124.08 2nn6 h ARG 212 Ca 0.08 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.93 2nn6 h ARG 212 Cb 0.63 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.15 2nn6 h ARG 212 CO -0.47 0.19 -0.14 0.93 2.80 0.00 0.00 179.97 183.28 2nn6 h GLU 213 N 0.29 -0.38 -0.84 0.20 5.08 -1.61 -2.13 114.58 115.19 2nn6 h GLU 213 Ca 0.31 0.03 0.23 0.00 -1.00 0.00 0.00 59.36 58.92 2nn6 h GLU 213 Cb 0.43 0.09 -0.16 0.00 0.50 0.00 0.00 28.75 29.61 2nn6 h GLU 213 CO -0.37 -0.18 0.00 0.39 -1.00 0.00 0.00 179.01 177.85 2nn6 n GLU 214 N -5.22 -0.07 0.01 2.33 -0.58 0.54 -0.18 120.64 117.48 2nn6 n GLU 214 Ca -0.10 1.27 -0.13 0.00 -0.42 0.00 0.00 57.16 57.78 2nn6 n GLU 214 Cb 0.21 -2.01 -0.09 0.00 -0.57 0.00 0.00 31.44 28.97 2nn6 n GLU 214 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2nn6 h ARG 215 N 0.00 -0.06 -0.24 3.49 -0.00 -0.67 -3.24 114.38 113.66 2nn6 h ARG 215 Ca 0.51 0.00 0.03 0.00 -0.50 0.00 0.00 59.98 60.02 2nn6 h ARG 215 Cb 1.03 0.01 -0.01 0.00 0.00 0.00 0.00 29.97 31.00 2nn6 h ARG 215 CO -0.80 0.38 0.17 -0.39 0.00 0.00 0.00 179.97 179.33 2nn6 h VAL 216 N -0.51 0.97 -2.58 2.04 -1.51 -0.14 -3.43 116.25 111.09 2nn6 h VAL 216 Ca -0.01 -0.06 -0.54 0.00 -1.23 0.00 0.00 66.70 64.87 2nn6 h VAL 216 Cb 0.46 0.78 0.01 0.00 -2.13 0.00 0.00 31.29 30.42 2nn6 h VAL 216 CO 0.01 0.03 1.09 0.00 -1.23 0.00 0.00 177.57 177.47 2nn6 s MET 217 N -5.20 4.17 0.02 5.19 0.23 -0.80 -4.93 119.30 117.98 2nn6 s MET 217 Ca -0.06 2.37 -0.24 0.00 -1.03 0.00 0.00 55.69 56.73 2nn6 s MET 217 Cb 0.18 -3.86 -0.18 0.00 -1.53 0.00 0.00 34.83 29.45 2nn6 s MET 217 CO 0.70 -0.83 1.43 0.38 -2.03 0.00 0.00 175.02 174.67 2nn6 h ASP 218 N 9.27 0.05 -4.38 -1.18 3.04 -1.74 -3.46 116.42 118.02 2nn6 h ASP 218 Ca -0.43 -0.33 -0.25 0.00 -3.24 0.00 0.00 57.03 52.77 2nn6 h ASP 218 Cb 1.20 -0.01 -0.24 0.00 -1.04 0.00 0.00 39.33 39.24 2nn6 h ASP 218 CO 0.94 0.37 -0.73 -0.83 -2.04 0.00 0.00 179.24 176.96 2nn6 s GLY 219 N -2.91 0.26 0.03 7.15 0.00 -1.23 -4.54 107.32 106.09 2nn6 s GLY 219 Ca -0.15 -0.42 0.05 0.00 0.00 0.00 0.00 44.72 44.20 2nn6 s GLY 219 CO 0.68 -0.44 -0.14 -2.27 0.00 0.00 0.00 173.10 170.92 2nn6 s LEU 220 N -0.84 2.16 0.11 0.66 2.96 -0.15 -0.02 118.68 123.55 2nn6 s LEU 220 Ca -0.06 -0.44 0.09 0.00 -0.22 0.00 0.00 54.13 53.50 2nn6 s LEU 220 Cb -0.06 -0.64 -0.04 0.00 0.50 0.00 0.00 46.19 45.96 2nn6 s LEU 220 CO -0.00 0.06 -0.23 -0.22 -1.32 0.00 0.00 176.35 174.64 2nn6 s LEU 221 N -1.06 2.29 0.35 -0.68 2.96 0.07 -1.04 118.68 121.58 2nn6 s LEU 221 Ca 0.02 -0.69 0.07 0.00 -0.22 0.00 0.00 54.13 53.31 2nn6 s LEU 221 Cb -0.08 -0.99 -0.07 0.00 0.50 0.00 0.00 46.19 45.55 2nn6 s LEU 221 CO 0.01 0.10 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.43 2nn6 s VAL 222 N -1.10 1.83 0.02 1.68 1.01 -0.25 0.25 120.40 123.85 2nn6 s VAL 222 Ca 0.09 -2.07 -0.18 0.00 0.00 0.00 0.00 61.98 59.82 2nn6 s VAL 222 Cb -0.10 -2.77 0.03 0.00 0.00 0.00 0.00 36.38 33.54 2nn6 s VAL 222 CO 0.05 -0.11 0.39 -0.63 0.00 0.00 0.00 175.10 174.80 2nn6 s ILE 223 N -2.86 0.06 -0.13 2.22 1.01 0.14 -2.68 121.20 118.96 2nn6 s ILE 223 Ca 0.34 -0.46 -0.01 0.00 0.00 0.00 0.00 60.65 60.52 2nn6 s ILE 223 Cb 0.07 -0.88 0.03 0.00 0.01 0.00 0.00 42.46 41.69 2nn6 s ILE 223 CO 0.16 -0.26 -0.06 0.00 0.00 0.00 0.00 174.94 174.79 2nn6 s ALA 224 N -2.14 1.31 -0.11 9.38 0.00 0.48 -2.26 121.76 128.41 2nn6 s ALA 224 Ca -0.07 -0.60 -0.01 0.00 0.00 0.00 0.00 51.96 51.27 2nn6 s ALA 224 Cb -0.02 -0.97 0.03 0.00 0.00 0.00 0.00 23.12 22.17 2nn6 s ALA 224 CO -0.00 -0.56 -0.01 -1.64 0.00 0.00 0.00 175.76 173.55 2nn6 s MET 225 N 1.72 0.90 0.32 0.00 -1.94 -1.20 0.05 119.30 119.14 2nn6 s MET 225 Ca 0.03 -0.13 -0.18 0.00 -1.71 0.00 0.00 55.69 53.71 2nn6 s MET 225 Cb -0.13 -1.41 -0.09 0.00 2.01 0.00 0.00 34.83 35.20 2nn6 s MET 225 CO -0.08 -0.37 0.79 1.21 -0.01 0.00 0.00 175.02 176.57 2nn6 s ASN 226 N 1.86 6.91 0.23 3.03 3.84 0.04 -3.66 114.94 127.20 2nn6 s ASN 226 Ca 0.04 1.44 0.21 0.00 0.21 0.00 0.00 52.86 54.75 2nn6 s ASN 226 Cb -0.13 -2.43 0.72 0.00 -0.55 0.00 0.00 41.25 38.85 2nn6 s ASN 226 CO -0.07 -0.17 0.65 1.17 -2.79 0.00 0.00 177.10 175.89 2nn6 n LYS 227 N -0.11 0.00 -0.54 0.43 4.81 -1.21 -0.93 118.16 120.61 2nn6 n LYS 227 Ca 0.03 0.45 -0.04 0.00 -0.87 0.00 0.00 58.31 57.87 2nn6 n LYS 227 Cb 0.53 -1.04 0.01 0.00 0.02 0.00 0.00 35.03 34.55 2nn6 n LYS 227 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2nn6 n HIS 228 N -2.79 0.43 -0.71 5.64 8.25 -1.26 -4.81 115.22 119.96 2nn6 n HIS 228 Ca 0.18 -1.17 -0.03 0.00 -0.26 0.00 0.00 57.72 56.44 2nn6 n HIS 228 Cb 0.84 -0.58 -0.01 0.00 1.12 0.00 0.00 29.99 31.36 2nn6 n HIS 228 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2nn6 n ARG 229 N 1.03 -1.52 -4.24 -0.41 3.00 -0.10 -4.90 116.66 109.52 2nn6 n ARG 229 Ca 0.08 0.20 -0.27 0.00 -0.00 0.00 0.00 57.85 57.87 2nn6 n ARG 229 Cb 0.54 -3.76 -0.08 0.00 0.00 0.00 0.00 32.46 29.16 2nn6 n ARG 229 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.63 175.80 2nn6 s GLU 230 N -1.49 2.26 0.94 -0.14 4.04 -1.21 -4.94 118.70 118.16 2nn6 s GLU 230 Ca 0.00 -1.18 -0.14 0.00 0.04 0.00 0.00 54.97 53.68 2nn6 s GLU 230 Cb 0.00 -2.27 0.16 0.00 0.02 0.00 0.00 34.13 32.04 2nn6 s GLU 230 CO 0.00 0.44 1.20 0.42 -1.84 0.00 0.00 175.26 175.49 2nn6 s ILE 231 N -1.73 1.95 0.00 1.83 1.09 -1.25 -0.78 121.20 122.31 2nn6 s ILE 231 Ca 0.26 0.00 0.00 0.00 -1.10 0.00 0.00 60.65 59.81 2nn6 s ILE 231 Cb -0.09 -2.85 0.00 0.00 -1.06 0.00 0.00 42.46 38.46 2nn6 s ILE 231 CO 0.17 0.00 0.00 0.00 -0.10 0.00 0.00 174.94 175.01 2nn6 s THR 233 N -1.00 0.00 0.06 0.00 -4.23 -1.24 -4.87 115.64 104.36 2nn6 s THR 233 Ca 0.00 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.43 2nn6 s THR 233 Cb 0.00 -1.00 -0.00 0.00 1.34 0.00 0.00 72.50 72.84 2nn6 s THR 233 CO 0.00 0.00 0.17 0.27 -0.54 0.00 0.00 174.62 174.52 2nn6 s ILE 234 N -2.17 0.13 -0.17 2.99 -5.25 -1.26 0.18 121.20 115.65 2nn6 s ILE 234 Ca 0.02 -1.05 -0.11 0.00 -0.99 0.00 0.00 60.65 58.52 2nn6 s ILE 234 Cb -0.01 -1.08 0.05 0.00 2.95 0.00 0.00 42.46 44.38 2nn6 s ILE 234 CO -0.04 -0.58 0.43 -1.58 -1.79 0.00 0.00 174.94 171.38 2nn6 s GLN 235 N -3.06 0.44 -0.12 0.37 -0.44 -1.09 -4.95 119.66 110.80 2nn6 s GLN 235 Ca -0.01 0.75 -0.02 0.00 -2.50 0.00 0.00 55.36 53.58 2nn6 s GLN 235 Cb 0.01 0.07 -0.03 0.00 -1.64 0.00 0.00 33.01 31.42 2nn6 s GLN 235 CO -0.07 -0.13 -0.04 0.45 0.50 0.00 0.00 175.29 176.00 2nn6 s SER 236 N 1.04 4.81 0.24 6.67 0.15 -1.26 -1.09 113.70 124.25 2nn6 s SER 236 Ca -0.07 -0.06 -0.11 0.00 0.70 0.00 0.00 55.95 56.42 2nn6 s SER 236 Cb -0.07 -1.55 -0.01 0.00 -1.71 0.00 0.00 66.02 62.69 2nn6 s SER 236 CO -0.09 0.26 0.42 -0.94 1.20 0.00 0.00 173.24 174.10 2nn6 s SER 237 N -0.19 -0.06 -0.82 5.45 1.04 -0.20 -4.88 113.70 114.03 2nn6 s SER 237 Ca 0.03 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.48 2nn6 s SER 237 Cb -0.13 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.54 2nn6 s SER 237 CO 0.02 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 173.77 2nn6 n GLY 238 N -0.36 0.96 1.40 7.32 0.00 -1.26 -0.98 105.19 112.27 2nn6 n GLY 238 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2nn6 n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nn6 n GLY 239 N -1.75 0.00 3.47 -0.02 0.00 -1.26 -3.56 105.19 102.07 2nn6 n GLY 239 Ca -0.08 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 2nn6 n GLY 239 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nn6 s ILE 240 N 0.00 0.00 -0.88 -0.61 1.09 -1.26 -4.61 121.20 114.93 2nn6 s ILE 240 Ca 0.00 -1.63 -0.16 0.00 -1.10 0.00 0.00 60.65 57.76 2nn6 s ILE 240 Cb 0.00 -2.56 0.18 0.00 -1.06 0.00 0.00 42.46 39.02 2nn6 s ILE 240 CO 0.00 0.00 0.93 -0.04 -0.10 0.00 0.00 174.94 175.73 2nn6 s MET 241 N -3.29 3.62 -0.97 2.79 -1.94 -1.26 -4.97 119.30 113.28 2nn6 s MET 241 Ca 0.31 -2.18 -0.07 0.00 -1.71 0.00 0.00 55.69 52.04 2nn6 s MET 241 Cb 0.00 -4.64 0.24 0.00 2.01 0.00 0.00 34.83 32.44 2nn6 s MET 241 CO 0.19 -1.50 0.91 -0.51 -0.01 0.00 0.00 175.02 174.10 2nn6 s LEU 242 N 1.21 6.06 -0.12 -0.03 1.43 -1.26 -4.81 118.68 121.15 2nn6 s LEU 242 Ca 0.25 -3.48 -0.34 0.00 -1.03 0.00 0.00 54.13 49.53 2nn6 s LEU 242 Cb -0.08 -2.08 -0.11 0.00 0.03 0.00 0.00 46.19 43.95 2nn6 s LEU 242 CO -0.09 -0.29 1.94 0.18 0.23 0.00 0.00 176.35 178.32 2nn6 n LEU 243 N 2.79 3.34 -0.31 1.79 4.77 -1.26 -4.59 117.00 123.53 2nn6 n LEU 243 Ca 0.21 0.86 0.29 0.00 -0.03 0.00 0.00 56.01 57.34 2nn6 n LEU 243 Cb 0.39 -1.38 0.52 0.00 -2.33 0.00 0.00 43.42 40.63 2nn6 n LEU 243 CO 0.40 -0.15 0.94 2.29 -1.33 0.00 0.00 177.39 179.54 2nn6 n LYS 244 N 7.00 -0.04 0.09 3.23 -0.00 -1.26 0.19 118.16 127.37 2nn6 n LYS 244 Ca 0.25 1.14 -0.04 0.00 -0.00 0.00 0.00 58.31 59.66 2nn6 n LYS 244 Cb 0.30 -2.10 -0.02 0.00 -0.00 0.00 0.00 35.03 33.22 2nn6 n LYS 244 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 2nn6 h ASP 245 N 0.00 -0.20 -0.89 -5.58 1.82 -2.01 -2.73 116.42 106.83 2nn6 h ASP 245 Ca 0.73 0.01 0.11 0.00 -0.39 0.00 0.00 57.03 57.48 2nn6 h ASP 245 Cb 2.05 0.05 -0.07 0.00 0.68 0.00 0.00 39.33 42.05 2nn6 h ASP 245 CO -0.58 -0.13 0.57 -0.61 -1.61 0.00 0.00 179.24 176.89 2nn6 h GLN 246 N -0.27 0.81 -0.29 0.28 -0.00 0.17 3.68 115.11 119.50 2nn6 h GLN 246 Ca -0.02 -0.05 0.08 0.00 -0.00 0.00 0.00 58.65 58.66 2nn6 h GLN 246 Cb 0.18 -0.18 -0.01 0.00 0.00 0.00 0.00 27.48 27.47 2nn6 h GLN 246 CO 0.04 0.53 0.67 -0.39 0.00 0.00 0.00 178.83 179.68 2nn6 h VAL 247 N 0.83 0.09 -0.01 2.39 -1.51 0.12 -0.65 116.25 117.52 2nn6 h VAL 247 Ca 0.42 0.00 -0.18 0.00 -1.23 0.00 0.00 66.70 65.71 2nn6 h VAL 247 Cb 0.49 0.40 -0.01 0.00 -2.13 0.00 0.00 31.29 30.04 2nn6 h VAL 247 CO -0.19 0.00 -0.82 -0.07 -1.23 0.00 0.00 177.57 175.27 2nn6 h LEU 248 N 0.00 0.20 0.18 4.19 -0.00 0.73 -3.11 115.31 117.51 2nn6 h LEU 248 Ca 0.14 -0.16 -0.01 0.00 -0.00 0.00 0.00 57.88 57.85 2nn6 h LEU 248 Cb 1.47 -0.06 0.00 0.00 -0.00 0.00 0.00 40.66 42.07 2nn6 h LEU 248 CO -0.00 0.93 -0.09 0.08 -0.00 0.00 0.00 178.44 179.36 2nn6 h ARG 249 N 0.10 -0.24 -0.59 1.13 0.11 -1.20 -2.26 114.38 111.43 2nn6 h ARG 249 Ca -0.03 0.02 0.09 0.00 0.10 0.00 0.00 59.98 60.16 2nn6 h ARG 249 Cb 1.42 0.05 -0.11 0.00 1.11 0.00 0.00 29.97 32.44 2nn6 h ARG 249 CO 0.12 0.12 -0.40 0.00 0.10 0.00 0.00 179.97 179.91 2nn6 h SER 251 N -0.20 -0.88 0.05 0.00 4.64 -1.53 2.04 113.55 117.66 2nn6 h SER 251 Ca 0.20 0.22 -0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2nn6 h SER 251 Cb 0.56 0.50 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2nn6 h SER 251 CO -0.69 -0.27 -0.04 0.50 -0.87 0.00 0.00 176.83 175.47 2nn6 h LYS 252 N -0.07 -0.08 -1.18 4.77 3.64 0.33 -2.49 116.57 121.50 2nn6 h LYS 252 Ca 0.30 0.01 0.39 0.00 -1.27 0.00 0.00 60.65 60.08 2nn6 h LYS 252 Cb 0.54 0.02 -0.14 0.00 -0.41 0.00 0.00 32.23 32.24 2nn6 h LYS 252 CO -0.72 -0.05 0.73 0.82 -2.27 0.00 0.00 179.45 177.95 2nn6 h ILE 253 N -0.08 0.17 0.16 2.00 2.04 0.44 1.46 117.51 123.69 2nn6 h ILE 253 Ca -0.01 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 2nn6 h ILE 253 Cb 0.07 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.16 2nn6 h ILE 253 CO 0.00 0.03 -0.08 0.00 0.00 0.00 0.00 178.15 178.10 2nn6 h ALA 254 N 1.72 -0.21 -0.70 1.87 0.00 0.35 -2.23 119.26 120.05 2nn6 h ALA 254 Ca 0.79 -0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.77 2nn6 h ALA 254 Cb 2.25 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 20.02 2nn6 h ALA 254 CO -0.50 -0.60 0.23 0.78 0.00 0.00 0.00 179.25 179.15 2nn6 h GLY 255 N -0.25 1.00 -0.20 0.00 0.00 0.25 0.13 103.07 104.00 2nn6 h GLY 255 Ca -0.02 -0.09 0.12 0.00 0.00 0.00 0.00 47.33 47.33 2nn6 h GLY 255 CO 0.04 -0.12 -0.17 -2.08 0.00 0.00 0.00 176.54 174.21 2nn6 h VAL 256 N 0.36 0.38 0.19 4.60 2.07 -0.90 -1.72 116.25 121.21 2nn6 h VAL 256 Ca 0.38 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.89 2nn6 h VAL 256 Cb 0.59 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 2nn6 h VAL 256 CO -0.42 0.00 -0.09 0.50 0.02 0.00 0.00 177.57 177.58 2nn6 h LYS 257 N -0.03 -0.24 -1.34 1.57 1.63 -0.44 -2.97 116.57 114.76 2nn6 h LYS 257 Ca 0.28 0.02 0.44 0.00 -0.85 0.00 0.00 60.65 60.54 2nn6 h LYS 257 Cb 0.45 0.05 -0.13 0.00 -0.60 0.00 0.00 32.23 32.01 2nn6 h LYS 257 CO -0.61 0.17 0.86 -0.24 -3.45 0.00 0.00 179.45 176.17 2nn6 h VAL 258 N -0.84 0.10 0.00 2.00 3.04 -0.52 0.69 116.25 120.72 2nn6 h VAL 258 Ca -0.03 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 2nn6 h VAL 258 Cb 0.52 0.02 0.00 0.00 -2.01 0.00 0.00 31.29 29.82 2nn6 h VAL 258 CO 0.04 0.01 0.00 0.00 -1.01 0.00 0.00 177.57 176.61 2nn6 n ALA 259 N -2.52 -0.03 -0.28 3.17 0.00 -0.68 -1.45 120.51 118.72 2nn6 n ALA 259 Ca 0.38 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.90 2nn6 n ALA 259 Cb 1.46 0.19 0.23 0.00 0.00 0.00 0.00 19.45 21.34 2nn6 n ALA 259 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2nn6 h GLU 260 N 0.00 0.47 -0.92 0.00 4.11 -0.98 -0.01 114.58 117.24 2nn6 h GLU 260 Ca 0.00 -0.03 0.18 0.00 0.07 0.00 0.00 59.36 59.59 2nn6 h GLU 260 Cb 0.00 -0.10 -0.11 0.00 0.50 0.00 0.00 28.75 29.04 2nn6 h GLU 260 CO 0.00 0.31 0.50 0.82 0.07 0.00 0.00 179.01 180.71 2nn6 h ILE 261 N 0.48 0.65 0.03 -1.06 2.04 -1.06 0.42 117.51 119.01 2nn6 h ILE 261 Ca 0.47 -0.21 0.01 0.00 1.00 0.00 0.00 64.86 66.13 2nn6 h ILE 261 Cb 0.76 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 2nn6 h ILE 261 CO -0.43 0.11 -0.10 0.74 0.00 0.00 0.00 178.15 178.47 2nn6 h THR 262 N 0.62 0.74 -0.54 -0.27 2.02 0.17 -2.68 112.91 112.98 2nn6 h THR 262 Ca 0.54 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.85 2nn6 h THR 262 Cb 0.87 0.74 -0.10 0.00 -1.74 0.00 0.00 68.15 67.92 2nn6 h THR 262 CO -0.41 0.00 -0.06 1.21 0.37 0.00 0.00 175.52 176.62 2nn6 n GLU 263 N -5.23 -0.05 0.28 6.66 4.07 0.15 0.17 120.64 126.69 2nn6 n GLU 263 Ca -0.06 0.83 -0.16 0.00 -0.06 0.00 0.00 57.16 57.71 2nn6 n GLU 263 Cb 0.15 -1.28 -0.08 0.00 -0.06 0.00 0.00 31.44 30.17 2nn6 n GLU 263 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2nn6 h LEU 264 N 0.00 -0.59 -0.49 4.31 -0.00 -1.42 1.56 115.31 118.68 2nn6 h LEU 264 Ca 0.30 -0.03 0.05 0.00 -0.00 0.00 0.00 57.88 58.20 2nn6 h LEU 264 Cb 0.54 0.15 -0.08 0.00 -0.00 0.00 0.00 40.66 41.27 2nn6 h LEU 264 CO -0.54 -0.34 -0.49 0.40 -0.00 0.00 0.00 178.44 177.47 2nn6 h ILE 265 N -0.82 0.00 0.02 1.22 2.04 0.17 0.60 117.51 120.74 2nn6 h ILE 265 Ca -0.07 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.82 2nn6 h ILE 265 Cb 0.59 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 2nn6 h ILE 265 CO 0.12 0.00 -0.28 -0.07 0.00 0.00 0.00 178.15 177.91 2nn6 h LEU 266 N -0.26 -0.84 -0.22 1.44 3.38 -1.42 3.16 115.31 120.55 2nn6 h LEU 266 Ca 0.08 0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.18 2nn6 h LEU 266 Cb 0.47 0.34 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 2nn6 h LEU 266 CO -0.59 -0.35 -0.20 0.50 0.09 0.00 0.00 178.44 177.88 2nn6 h LYS 267 N -0.44 -0.08 -0.39 1.13 3.11 0.59 0.45 116.57 120.94 2nn6 h LYS 267 Ca 0.06 0.01 -0.13 0.00 -2.81 0.00 0.00 60.65 57.78 2nn6 h LYS 267 Cb 0.52 0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.76 2nn6 h LYS 267 CO -0.23 -0.05 -0.25 0.00 -2.81 0.00 0.00 179.45 176.11 2nn6 h ALA 268 N -0.71 0.55 -1.22 5.00 0.00 0.22 -0.99 119.26 122.12 2nn6 h ALA 268 Ca 0.04 -0.39 0.35 0.00 0.00 0.00 0.00 54.91 54.90 2nn6 h ALA 268 Cb 0.18 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 17.76 2nn6 h ALA 268 CO -0.25 0.55 0.83 1.25 0.00 0.00 0.00 179.25 181.62 2nn6 h LEU 269 N 0.66 0.21 0.01 0.00 6.46 0.69 0.34 115.31 123.67 2nn6 h LEU 269 Ca 0.08 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.90 2nn6 h LEU 269 Cb 0.82 0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.78 2nn6 h LEU 269 CO 0.07 -0.00 -0.00 -0.33 -0.62 0.00 0.00 178.44 177.55 2nn6 h GLU 270 N 0.16 -0.01 -1.02 1.25 4.39 0.66 -2.95 114.58 117.07 2nn6 h GLU 270 Ca 0.65 0.00 0.27 0.00 0.34 0.00 0.00 59.36 60.62 2nn6 h GLU 270 Cb 2.16 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 30.68 2nn6 h GLU 270 CO -0.19 0.79 0.61 -0.97 -1.16 0.00 0.00 179.01 178.08 2nn6 h ASN 271 N -0.96 0.61 0.46 1.42 -1.24 0.79 -0.08 115.58 116.57 2nn6 h ASN 271 Ca -0.00 0.14 -0.02 0.00 0.71 0.00 0.00 56.30 57.13 2nn6 h ASN 271 Cb 0.80 0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.91 2nn6 h ASN 271 CO 0.00 0.05 -0.22 -0.78 -1.29 0.00 0.00 177.43 175.19 2nn6 h ASP 272 N 0.50 -0.53 -0.96 1.15 1.82 -0.69 -2.89 116.42 114.82 2nn6 h ASP 272 Ca 0.66 -0.09 0.24 0.00 -0.39 0.00 0.00 57.03 57.46 2nn6 h ASP 272 Cb 1.38 0.14 -0.13 0.00 0.68 0.00 0.00 39.33 41.40 2nn6 h ASP 272 CO -0.48 -0.18 0.51 -0.61 -1.61 0.00 0.00 179.24 176.88 2nn6 h GLN 273 N -0.91 0.47 0.18 0.28 5.75 -0.96 -1.15 115.11 118.77 2nn6 h GLN 273 Ca -0.06 -0.03 0.01 0.00 -0.15 0.00 0.00 58.65 58.42 2nn6 h GLN 273 Cb 0.58 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 29.00 2nn6 h GLN 273 CO 0.10 0.31 -0.23 0.87 -2.65 0.00 0.00 178.83 177.23 2nn6 h LYS 274 N 0.49 -0.45 -0.71 1.69 1.57 -0.94 -3.11 116.57 115.11 2nn6 h LYS 274 Ca 0.62 0.03 0.09 0.00 -1.87 0.00 0.00 60.65 59.52 2nn6 h LYS 274 Cb 1.21 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.55 2nn6 h LYS 274 CO -0.51 -0.30 0.35 0.28 -0.57 0.00 0.00 179.45 178.70 2nn6 h VAL 275 N -0.47 0.85 -0.69 0.50 2.07 -1.00 -1.49 116.25 116.02 2nn6 h VAL 275 Ca 0.01 -0.21 0.07 0.00 0.82 0.00 0.00 66.70 67.39 2nn6 h VAL 275 Cb 0.46 0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.37 2nn6 h VAL 275 CO -0.09 0.11 0.37 0.03 0.02 0.00 0.00 177.57 178.02 2nn6 h ARG 276 N 0.60 0.66 0.00 1.57 3.08 -1.47 -1.26 114.38 117.55 2nn6 h ARG 276 Ca 0.35 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.36 2nn6 h ARG 276 Cb 0.36 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2nn6 h ARG 276 CO -0.27 0.44 0.00 1.63 -1.07 0.00 0.00 179.97 180.70 2nn6 n LYS 277 N -4.80 0.17 0.00 0.04 4.76 -0.68 -4.52 118.16 113.14 2nn6 n LYS 277 Ca 0.09 0.28 0.00 0.00 -2.87 0.00 0.00 58.31 55.81 2nn6 n LYS 277 Cb 0.20 -1.76 0.00 0.00 -1.84 0.00 0.00 35.03 31.63 2nn6 n LYS 277 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2nn6 n GLU 278 N -2.08 3.77 -0.10 1.97 1.02 -0.59 -4.96 120.64 119.67 2nn6 n GLU 278 Ca 0.04 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.17 2nn6 n GLU 278 Cb 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.73 2nn6 n GLU 278 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2nn6 n GLY 279 N 5.00 -0.56 0.00 0.62 0.00 -1.25 -4.87 105.19 104.13 2nn6 n GLY 279 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.32 2nn6 n GLY 279 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nn6 n GLY 280 N -1.11 2.04 0.00 -0.02 0.00 -0.58 -5.03 105.19 100.49 2nn6 n GLY 280 Ca 0.02 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2nn6 n GLY 280 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2nn6 n LYS 281 N 2.41 0.00 0.00 1.61 4.81 -1.26 -4.99 118.16 120.73 2nn6 n LYS 281 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2nn6 n LYS 281 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2nn6 n LYS 281 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2nn6 n PHE 282 N 0.00 0.00 -1.76 5.64 3.01 -1.26 -4.96 117.46 118.13 2nn6 n PHE 282 Ca 0.00 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.51 2nn6 n PHE 282 Cb 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.46 2nn6 n PHE 282 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2nn6 n GLY 283 N 1.30 -0.76 0.05 1.37 0.00 -1.26 -4.34 105.19 101.55 2nn6 n GLY 283 Ca 0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 46.02 45.41 2nn6 n GLY 283 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2nn6 n PHE 284 N -1.81 0.71 -3.13 1.61 7.35 -1.26 0.68 117.46 121.61 2nn6 n PHE 284 Ca 0.00 0.31 0.04 0.00 -0.76 0.00 0.00 57.45 57.05 2nn6 n PHE 284 Cb 0.18 -0.65 -0.00 0.00 0.35 0.00 0.00 39.48 39.36 2nn6 n PHE 284 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2nn6 s ALA 285 N -2.80 -3.31 -0.41 3.13 0.00 -1.26 -4.07 121.76 113.04 2nn6 s ALA 285 Ca -0.11 1.16 0.24 0.00 0.00 0.00 0.00 51.96 53.26 2nn6 s ALA 285 Cb 0.02 -2.72 0.51 0.00 0.00 0.00 0.00 23.12 20.92 2nn6 s ALA 285 CO 0.16 -2.02 1.67 0.93 0.00 0.00 0.00 175.76 176.50 2nn6 h GLU 286 N 7.42 0.00 -0.20 0.00 3.07 -1.94 -3.14 114.58 119.78 2nn6 h GLU 286 Ca -0.05 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 58.84 2nn6 h GLU 286 Cb 1.19 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.07 2nn6 h GLU 286 CO 0.02 0.00 0.05 0.66 -1.40 0.00 0.00 179.01 178.33 2nn6 h SER 287 N 0.00 0.02 1.34 1.42 4.64 -2.00 0.37 113.55 119.35 2nn6 h SER 287 Ca 0.00 0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2nn6 h SER 287 Cb 0.91 0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2nn6 h SER 287 CO 0.00 0.04 -0.01 0.40 -0.87 0.00 0.00 176.83 176.39 2nn6 h ILE 288 N 0.13 0.02 0.00 0.95 2.04 -1.94 -2.50 117.51 116.21 2nn6 h ILE 288 Ca 0.09 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.26 2nn6 h ILE 288 Cb 0.08 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 2nn6 h ILE 288 CO -0.12 0.01 0.00 0.00 0.00 0.00 0.00 178.15 178.04 2nn6 n ALA 289 N -2.10 2.16 -0.03 1.87 0.00 0.91 -4.02 120.51 119.31 2nn6 n ALA 289 Ca 0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 53.44 53.39 2nn6 n ALA 289 Cb 0.38 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.35 2nn6 n ALA 289 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2nn6 n ASN 290 N -2.00 3.62 -4.61 0.00 5.15 0.89 -4.47 115.26 113.83 2nn6 n ASN 290 Ca 0.05 -0.01 -0.47 0.00 -0.60 0.00 0.00 54.58 53.56 2nn6 n ASN 290 Cb 0.36 0.46 -0.05 0.00 -0.53 0.00 0.00 39.78 40.02 2nn6 n ASN 290 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2nn6 n GLN 291 N -2.32 1.98 -0.51 1.20 6.02 -0.96 -4.84 117.38 117.95 2nn6 n GLN 291 Ca -0.10 0.66 -0.16 0.00 -0.01 0.00 0.00 57.00 57.38 2nn6 n GLN 291 Cb 0.67 -2.82 -0.00 0.00 1.02 0.00 0.00 30.24 29.11 2nn6 n GLN 291 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2nn6 n ARG 292 N 7.66 0.00 -1.05 -1.09 1.74 -1.26 -4.71 116.66 117.95 2nn6 n ARG 292 Ca 0.28 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.50 2nn6 n ARG 292 Cb 0.34 -0.40 -0.04 0.00 -1.02 0.00 0.00 32.46 31.34 2nn6 n ARG 292 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2nn6 n ILE 293 N -0.43 0.00 -0.40 0.55 5.41 -1.26 -4.79 119.36 118.43 2nn6 n ILE 293 Ca 0.04 0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.92 2nn6 n ILE 293 Cb 0.16 -0.48 0.00 0.00 -0.71 0.00 0.00 39.64 38.61 2nn6 n ILE 293 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2nn6 n THR 294 N -3.52 0.00 -3.64 1.39 -2.24 -1.26 -4.74 114.28 100.27 2nn6 n THR 294 Ca -0.01 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.67 2nn6 n THR 294 Cb 0.48 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.64 2nn6 n THR 294 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nn6 s ALA 295 N -0.40 -1.92 -0.12 6.98 0.00 -1.26 -5.09 121.76 119.95 2nn6 s ALA 295 Ca 0.00 1.97 -0.17 0.00 0.00 0.00 0.00 51.96 53.76 2nn6 s ALA 295 Cb 0.00 -1.37 0.04 0.00 0.00 0.00 0.00 23.12 21.79 2nn6 s ALA 295 CO 0.00 -0.28 0.44 0.12 0.00 0.00 0.00 175.76 176.03 2nn6 s PHE 296 N 0.41 -0.43 -0.01 0.00 5.36 -1.26 -4.89 117.98 117.15 2nn6 s PHE 296 Ca 0.01 0.96 -0.00 0.00 -0.96 0.00 0.00 56.93 56.94 2nn6 s PHE 296 Cb -0.05 0.17 0.02 0.00 -0.34 0.00 0.00 43.02 42.82 2nn6 s PHE 296 CO -0.05 -0.31 0.02 -1.59 -1.46 0.00 0.00 175.22 171.83 2nn6 s LYS 297 N -0.30 -0.02 0.08 10.12 -2.85 -1.26 -5.11 119.74 120.40 2nn6 s LYS 297 Ca -0.05 0.10 -0.26 0.00 -1.00 0.00 0.00 55.97 54.77 2nn6 s LYS 297 Cb -0.03 -0.13 0.08 0.00 -2.06 0.00 0.00 37.83 35.68 2nn6 s LYS 297 CO 0.02 -0.09 0.67 0.00 0.10 0.00 0.00 175.35 176.06 2nn6 s MET 298 N 0.56 1.15 -0.08 1.78 0.23 -1.26 -5.14 119.30 116.54 2nn6 s MET 298 Ca -0.05 -0.28 0.04 0.00 -1.03 0.00 0.00 55.69 54.38 2nn6 s MET 298 Cb -0.07 0.53 -0.01 0.00 -1.53 0.00 0.00 34.83 33.75 2nn6 s MET 298 CO -0.02 -0.47 -0.21 -2.00 -2.03 0.00 0.00 175.02 170.29 2nn6 s GLU 299 N -3.05 2.80 0.13 3.16 -6.30 -1.26 -5.13 118.70 109.06 2nn6 s GLU 299 Ca -0.01 -0.84 0.11 0.00 -2.50 0.00 0.00 54.97 51.73 2nn6 s GLU 299 Cb -0.01 -2.30 -0.04 0.00 0.00 0.00 0.00 34.13 31.78 2nn6 s GLU 299 CO -0.07 0.34 -0.25 0.15 0.02 0.00 0.00 175.26 175.44 2nn6 s LYS 300 N -0.03 1.49 0.03 4.30 -0.14 -1.26 -5.15 119.74 118.99 2nn6 s LYS 300 Ca -0.06 -1.34 -0.00 0.00 -1.36 0.00 0.00 55.97 53.20 2nn6 s LYS 300 Cb -0.15 -1.94 0.01 0.00 -1.68 0.00 0.00 37.83 34.07 2nn6 s LYS 300 CO 0.05 0.45 0.01 0.00 -0.76 0.00 0.00 175.35 175.10 2nn6 n ALA 301 N 0.81 -0.09 -0.61 5.17 0.00 -1.26 -5.30 120.51 119.23 2nn6 n ALA 301 Ca -0.17 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2nn6 n ALA 301 Cb 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2nn6 n ALA 301 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2nn6 n PRO 302 N -0.90 0.00 -0.03 0.00 -0.04 -1.26 -5.16 135.00 127.61 2nn6 n PRO 302 Ca 0.00 0.19 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 2nn6 n PRO 302 Cb 0.01 -0.99 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 2nn6 n PRO 302 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46