#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k1s s ILE 2 N 0.00 2.65 -0.09 1.12 -1.09 -1.26 -4.30 121.20 118.24 1k1s s ILE 2 Ca 0.00 -1.06 0.00 0.00 -2.23 0.00 0.00 60.65 57.37 1k1s s ILE 2 Cb 0.00 -2.33 -0.03 0.00 -1.58 0.00 0.00 42.46 38.53 1k1s s ILE 2 CO 0.00 0.25 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.18 1k1s s VAL 3 N 1.30 3.56 -0.16 2.92 1.01 -0.35 -1.28 120.40 127.39 1k1s s VAL 3 Ca 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.47 1k1s s VAL 3 Cb -0.16 -2.47 0.01 0.00 0.00 0.00 0.00 36.38 33.76 1k1s s VAL 3 CO -0.06 0.57 -0.19 -0.63 0.00 0.00 0.00 175.10 174.79 1k1s s ILE 4 N -0.47 2.24 -0.19 2.22 1.01 0.61 -2.21 121.20 124.41 1k1s s ILE 4 Ca 0.07 -0.90 -0.06 0.00 0.00 0.00 0.00 60.65 59.76 1k1s s ILE 4 Cb -0.12 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.39 1k1s s ILE 4 CO 0.02 0.53 0.02 0.12 0.00 0.00 0.00 174.94 175.63 1k1s s PHE 5 N 1.05 3.10 -0.14 3.97 5.36 0.67 -0.60 117.98 131.38 1k1s s PHE 5 Ca -0.01 -0.26 0.02 0.00 -0.96 0.00 0.00 56.93 55.72 1k1s s PHE 5 Cb -0.14 -2.08 0.00 0.00 -0.34 0.00 0.00 43.02 40.46 1k1s s PHE 5 CO -0.06 -0.10 -0.19 0.08 -1.46 0.00 0.00 175.22 173.49 1k1s s VAL 6 N 0.76 2.34 -0.11 3.12 1.01 -0.80 -0.43 120.40 126.29 1k1s s VAL 6 Ca 0.01 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1k1s s VAL 6 Cb -0.14 -1.96 0.02 0.00 0.00 0.00 0.00 36.38 34.31 1k1s s VAL 6 CO 0.02 0.54 -0.10 -0.62 0.00 0.00 0.00 175.10 174.94 1k1s s ASP 7 N 0.76 2.25 -0.10 3.32 3.68 -0.18 -2.19 116.67 124.20 1k1s s ASP 7 Ca -0.07 -0.35 -0.29 0.00 2.13 0.00 0.00 52.55 53.97 1k1s s ASP 7 Cb -0.16 -0.92 -0.04 0.00 -1.45 0.00 0.00 42.92 40.35 1k1s s ASP 7 CO 0.00 -0.08 1.51 -0.36 0.13 0.00 0.00 175.17 176.37 1k1s s PHE 8 N 1.51 2.30 -0.03 -5.34 2.99 -0.81 -0.78 117.98 117.81 1k1s s PHE 8 Ca 0.02 0.51 -0.30 0.00 0.00 0.00 0.00 56.93 57.16 1k1s s PHE 8 Cb -0.13 -3.77 -0.07 0.00 0.00 0.00 0.00 43.02 39.04 1k1s s PHE 8 CO -0.07 -3.02 1.93 -0.51 -0.00 0.00 0.00 175.22 173.54 1k1s s ASP 9 N 2.89 6.35 -0.94 1.36 -0.00 -1.11 -3.17 116.67 122.04 1k1s s ASP 9 Ca 0.66 2.43 -0.06 0.00 -0.00 0.00 0.00 52.55 55.58 1k1s s ASP 9 Cb -0.29 -2.53 0.06 0.00 -0.00 0.00 0.00 42.92 40.16 1k1s s ASP 9 CO 0.24 -1.17 0.14 0.00 -0.00 0.00 0.00 175.17 174.38 1k1s n TYR 10 N 8.10 -0.67 0.00 4.23 0.18 -1.26 -4.53 117.16 123.21 1k1s n TYR 10 Ca 0.21 0.36 0.00 0.00 1.88 0.00 0.00 57.90 60.34 1k1s n TYR 10 Cb 0.42 -1.32 0.00 0.00 -0.38 0.00 0.00 39.34 38.06 1k1s n TYR 10 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 1k1s n PHE 11 N -2.76 0.00 -0.34 -3.48 7.35 -1.19 -1.04 117.46 116.00 1k1s n PHE 11 Ca -0.07 0.00 0.20 0.00 -0.76 0.00 0.00 57.45 56.81 1k1s n PHE 11 Cb 0.33 -0.11 0.42 0.00 0.35 0.00 0.00 39.48 40.47 1k1s n PHE 11 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 1k1s h PHE 12 N 0.00 0.95 0.05 -5.13 0.05 -1.93 0.02 116.94 110.96 1k1s h PHE 12 Ca 0.00 0.03 -0.25 0.00 3.82 0.00 0.00 57.97 61.57 1k1s h PHE 12 Cb 0.00 -0.27 0.01 0.00 2.00 0.00 0.00 35.95 37.69 1k1s h PHE 12 CO -0.21 0.02 -1.07 0.00 -0.18 0.00 0.00 178.31 176.87 1k1s h ALA 13 N 1.74 0.23 0.00 2.45 0.00 -1.41 -3.21 119.26 119.06 1k1s h ALA 13 Ca 0.66 -0.76 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1k1s h ALA 13 Cb 1.36 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1k1s h ALA 13 CO -0.48 0.83 -0.36 0.37 0.00 0.00 0.00 179.25 179.61 1k1s h GLN 14 N 0.21 0.00 -0.16 0.00 4.15 0.14 -2.85 115.11 116.59 1k1s h GLN 14 Ca -0.11 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.19 1k1s h GLN 14 Cb 1.73 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.42 1k1s h GLN 14 CO 0.19 0.36 -0.35 0.28 -1.93 0.00 0.00 178.83 177.38 1k1s h VAL 15 N 0.00 1.35 0.00 2.39 2.07 -1.24 -2.42 116.25 118.40 1k1s h VAL 15 Ca -0.00 -1.60 -0.00 0.00 0.82 0.00 0.00 66.70 65.91 1k1s h VAL 15 Cb 0.73 1.97 -0.00 0.00 -1.52 0.00 0.00 31.29 32.46 1k1s h VAL 15 CO 0.05 0.49 -0.00 -0.33 0.02 0.00 0.00 177.57 177.79 1k1s h GLU 16 N 0.16 0.00 0.00 1.57 4.39 -1.53 0.18 114.58 119.35 1k1s h GLU 16 Ca 0.00 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 1k1s h GLU 16 Cb 0.95 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.58 1k1s h GLU 16 CO 0.08 0.00 -0.63 0.93 -1.16 0.00 0.00 179.01 178.23 1k1s h GLU 17 N 0.00 0.00 0.00 2.33 5.08 -1.31 -1.08 114.58 119.59 1k1s h GLU 17 Ca -0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 1k1s h GLU 17 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1k1s h GLU 17 CO 0.00 0.63 -0.43 0.28 -1.00 0.00 0.00 179.01 178.49 1k1s h VAL 18 N 0.00 0.81 -0.01 3.13 2.07 -0.20 -2.54 116.25 119.52 1k1s h VAL 18 Ca -0.01 -1.88 0.00 0.00 0.82 0.00 0.00 66.70 65.63 1k1s h VAL 18 Cb 1.45 2.21 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 1k1s h VAL 18 CO 0.08 0.42 -0.65 0.18 0.02 0.00 0.00 177.57 177.62 1k1s n LEU 19 N -3.32 1.26 -3.09 2.57 4.77 -0.38 -4.54 117.00 114.28 1k1s n LEU 19 Ca 0.01 -0.47 -0.20 0.00 -0.03 0.00 0.00 56.01 55.32 1k1s n LEU 19 Cb 0.64 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.63 1k1s n LEU 19 CO 0.38 0.26 -0.16 0.59 -1.33 0.00 0.00 177.39 177.13 1k1s n ASN 20 N -0.91 -0.78 -0.39 -1.43 3.02 -0.42 -5.00 115.26 109.35 1k1s n ASN 20 Ca 0.07 -2.82 0.31 0.00 -0.03 0.00 0.00 54.58 52.11 1k1s n ASN 20 Cb 0.38 0.06 0.59 0.00 -0.61 0.00 0.00 39.78 40.20 1k1s n ASN 20 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1k1s h PRO 21 N 4.18 0.20 -0.76 3.52 0.11 -1.69 0.22 132.00 137.78 1k1s h PRO 21 Ca 0.03 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.23 1k1s h PRO 21 Cb 0.93 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 31.94 1k1s h PRO 21 CO 0.40 0.13 0.50 -0.56 -0.21 0.00 0.00 178.00 178.26 1k1s h GLN 22 N 0.20 0.67 0.00 1.05 -0.00 -1.95 0.22 115.11 115.31 1k1s h GLN 22 Ca 0.73 -0.04 -0.06 0.00 -0.00 0.00 0.00 58.65 59.28 1k1s h GLN 22 Cb 2.14 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.48 29.47 1k1s h GLN 22 CO -0.38 0.44 -0.30 1.88 -0.00 0.00 0.00 178.83 180.47 1k1s h TYR 23 N 0.69 0.00 -1.23 0.06 0.99 -0.87 -3.44 116.97 113.18 1k1s h TYR 23 Ca 0.35 0.00 -0.70 0.00 2.00 0.00 0.00 58.73 60.38 1k1s h TYR 23 Cb 0.44 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.17 1k1s h TYR 23 CO -0.00 0.30 1.20 1.17 -0.00 0.00 0.00 178.16 180.83 1k1s n LYS 24 N -4.12 1.09 0.00 4.88 3.00 0.06 -0.72 118.16 122.35 1k1s n LYS 24 Ca -0.02 0.35 0.00 0.00 -0.00 0.00 0.00 58.31 58.64 1k1s n LYS 24 Cb 0.35 -2.26 0.00 0.00 0.00 0.00 0.00 35.03 33.12 1k1s n LYS 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1k1s n GLY 25 N 5.64 2.41 3.89 3.14 0.00 -1.26 -5.08 105.19 113.93 1k1s n GLY 25 Ca 0.36 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 45.32 1k1s n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k1s s LYS 26 N 0.00 3.66 -0.98 1.61 0.00 0.10 -4.88 119.74 119.24 1k1s s LYS 26 Ca 0.00 0.31 -0.26 0.00 0.00 0.00 0.00 55.97 56.02 1k1s s LYS 26 Cb 0.00 -2.40 -0.15 0.00 0.00 0.00 0.00 37.83 35.28 1k1s s LYS 26 CO 0.00 -0.10 2.15 -2.14 0.00 0.00 0.00 175.35 175.27 1k1s s PRO 27 N -4.24 1.71 0.22 1.78 0.02 -1.26 -4.81 135.00 128.42 1k1s s PRO 27 Ca 0.49 -0.24 -0.24 0.00 0.02 0.00 0.00 61.00 61.02 1k1s s PRO 27 Cb -0.10 -4.97 -0.09 0.00 0.02 0.00 0.00 34.50 29.36 1k1s s PRO 27 CO 0.38 -4.63 0.81 -1.17 -0.33 0.00 0.00 177.00 172.05 1k1s s LEU 28 N 14.39 4.48 -0.22 -5.54 2.96 -1.26 -0.30 118.68 133.20 1k1s s LEU 28 Ca 0.81 1.65 -0.04 0.00 -0.22 0.00 0.00 54.13 56.33 1k1s s LEU 28 Cb -0.07 -3.54 0.09 0.00 0.50 0.00 0.00 46.19 43.16 1k1s s LEU 28 CO 0.11 0.10 0.15 -0.69 -1.32 0.00 0.00 176.35 174.71 1k1s s VAL 29 N -1.34 -0.17 -0.08 1.68 1.01 -0.31 -2.38 120.40 118.80 1k1s s VAL 29 Ca 0.41 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 1k1s s VAL 29 Cb -0.21 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 1k1s s VAL 29 CO 0.25 -0.41 1.51 -0.69 0.00 0.00 0.00 175.10 175.76 1k1s s VAL 30 N 2.19 3.80 0.40 2.92 1.01 0.14 -2.81 120.40 128.05 1k1s s VAL 30 Ca 0.06 1.00 0.05 0.00 0.00 0.00 0.00 61.98 63.09 1k1s s VAL 30 Cb -0.16 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 32.58 1k1s s VAL 30 CO -0.20 -0.08 0.56 -0.55 0.00 0.00 0.00 175.10 174.84 1k1s s SER 31 N 2.75 5.81 -0.44 3.32 0.15 -0.20 -1.13 113.70 123.96 1k1s s SER 31 Ca 0.67 -0.12 0.05 0.00 0.70 0.00 0.00 55.95 57.25 1k1s s SER 31 Cb -0.30 -1.14 0.17 0.00 -1.71 0.00 0.00 66.02 63.05 1k1s s SER 31 CO 0.25 -0.63 0.49 -0.69 1.20 0.00 0.00 173.24 173.87 1k1s s VAL 32 N -2.35 -0.32 0.43 4.45 1.01 -0.57 -2.56 120.40 120.50 1k1s s VAL 32 Ca 0.49 -1.64 0.03 0.00 0.00 0.00 0.00 61.98 60.86 1k1s s VAL 32 Cb -0.10 -0.65 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 1k1s s VAL 32 CO 0.34 -0.63 0.06 -0.72 0.00 0.00 0.00 175.10 174.15 1k1s s TYR 33 N 0.68 1.92 0.00 5.22 -0.85 -1.26 -2.71 117.35 120.35 1k1s s TYR 33 Ca 0.28 -1.06 0.00 0.00 -0.52 0.00 0.00 57.07 55.77 1k1s s TYR 33 Cb -0.02 -1.41 0.00 0.00 0.38 0.00 0.00 41.96 40.92 1k1s s TYR 33 CO -0.11 0.02 0.00 -1.13 -1.52 0.00 0.00 175.55 172.81 1k1s n SER 34 N -1.17 0.00 0.00 -0.18 3.41 -0.82 -4.98 113.62 109.87 1k1s n SER 34 Ca -0.10 -0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 1k1s n SER 34 Cb 0.66 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 1k1s n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1k1s n GLY 35 N 0.00 0.01 0.00 5.00 0.00 -1.26 -4.09 105.19 104.85 1k1s n GLY 35 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1k1s n GLY 35 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1k1s n THR 39 N 0.00 0.00 0.00 2.61 -1.04 -1.26 -5.54 114.28 109.05 1k1s n THR 39 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1k1s n THR 39 Cb 0.00 -1.10 0.00 0.00 -1.82 0.00 0.00 70.33 67.41 1k1s n THR 39 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1k1s n SER 40 N 0.00 0.00 -0.14 8.00 2.88 -1.26 -5.19 113.62 117.91 1k1s n SER 40 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1k1s n SER 40 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1k1s n SER 40 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1k1s n GLY 41 N 0.00 1.33 3.74 0.46 0.00 -1.26 -1.94 105.19 107.51 1k1s n GLY 41 Ca 0.00 -0.67 -0.04 0.00 0.00 0.00 0.00 46.02 45.31 1k1s n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k1s s ALA 42 N -1.00 -1.67 -0.16 4.61 0.00 -1.10 -3.60 121.76 118.84 1k1s s ALA 42 Ca 0.00 0.18 -0.29 0.00 0.00 0.00 0.00 51.96 51.85 1k1s s ALA 42 Cb 0.00 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 23.74 1k1s s ALA 42 CO 0.00 -1.03 0.99 0.08 0.00 0.00 0.00 175.76 175.80 1k1s s VAL 43 N -3.26 4.77 -0.22 0.00 1.01 0.15 -1.51 120.40 121.33 1k1s s VAL 43 Ca 0.12 1.97 -0.19 0.00 0.00 0.00 0.00 61.98 63.88 1k1s s VAL 43 Cb -0.01 -4.28 -0.16 0.00 0.00 0.00 0.00 36.38 31.93 1k1s s VAL 43 CO 0.02 -0.05 0.03 0.00 0.00 0.00 0.00 175.10 175.09 1k1s n ALA 44 N 5.46 0.85 -2.51 5.51 0.00 -0.28 -1.13 120.51 128.40 1k1s n ALA 44 Ca 0.09 -0.63 -0.09 0.00 0.00 0.00 0.00 53.44 52.81 1k1s n ALA 44 Cb 0.48 -0.33 -0.08 0.00 0.00 0.00 0.00 19.45 19.52 1k1s n ALA 44 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1k1s s THR 45 N -2.40 0.13 -0.28 0.00 2.01 -1.04 -4.65 115.64 109.41 1k1s s THR 45 Ca -0.30 -1.37 -0.18 0.00 0.31 0.00 0.00 61.69 60.16 1k1s s THR 45 Cb 0.08 -1.56 0.12 0.00 0.01 0.00 0.00 72.50 71.15 1k1s s THR 45 CO 0.53 -0.58 0.87 0.00 -0.69 0.00 0.00 174.62 174.75 1k1s s ALA 46 N -3.91 -2.07 1.34 7.40 0.00 -1.26 0.24 121.76 123.50 1k1s s ALA 46 Ca 0.10 2.22 -0.21 0.00 0.00 0.00 0.00 51.96 54.07 1k1s s ALA 46 Cb 0.05 -1.54 0.34 0.00 0.00 0.00 0.00 23.12 21.96 1k1s s ALA 46 CO -0.07 -0.34 0.99 0.54 0.00 0.00 0.00 175.76 176.88 1k1s s ASN 47 N 1.21 -0.36 0.22 0.00 4.22 -1.00 -4.66 114.94 114.56 1k1s s ASN 47 Ca -0.07 0.82 -0.01 0.00 -2.14 0.00 0.00 52.86 51.46 1k1s s ASN 47 Cb -0.04 -1.16 0.21 0.00 1.28 0.00 0.00 41.25 41.53 1k1s s ASN 47 CO -0.14 -4.93 1.57 1.88 -2.04 0.00 0.00 177.10 173.44 1k1s h TYR 48 N -3.13 0.61 0.00 1.54 -1.99 -1.96 -1.03 116.97 111.01 1k1s h TYR 48 Ca -0.45 -0.19 0.00 0.00 2.00 0.00 0.00 58.73 60.09 1k1s h TYR 48 Cb 1.33 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 39.93 1k1s h TYR 48 CO -2.75 0.88 0.01 0.39 -0.00 0.00 0.00 178.16 176.69 1k1s n GLU 49 N -3.99 0.00 -0.00 4.88 4.71 -1.26 -0.53 120.64 124.45 1k1s n GLU 49 Ca -0.02 0.33 0.00 0.00 -0.01 0.00 0.00 57.16 57.46 1k1s n GLU 49 Cb 0.55 -1.51 -0.00 0.00 -1.01 0.00 0.00 31.44 29.47 1k1s n GLU 49 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1k1s n ALA 50 N -1.33 2.01 -0.08 0.62 0.00 -0.96 -4.16 120.51 116.61 1k1s n ALA 50 Ca 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 53.44 53.29 1k1s n ALA 50 Cb 0.01 0.03 -0.05 0.00 0.00 0.00 0.00 19.45 19.44 1k1s n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k1s h ARG 51 N 0.00 0.66 -0.89 0.00 3.08 0.52 -2.76 114.38 114.99 1k1s h ARG 51 Ca -0.00 -0.38 0.04 0.00 0.07 0.00 0.00 59.98 59.71 1k1s h ARG 51 Cb 0.17 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.20 1k1s h ARG 51 CO 0.00 0.99 0.59 -0.22 -1.07 0.00 0.00 179.97 180.26 1k1s h LYS 52 N 0.37 1.08 0.00 0.04 3.64 -1.59 -0.17 116.57 119.94 1k1s h LYS 52 Ca 0.03 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1k1s h LYS 52 Cb 0.91 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 1k1s h LYS 52 CO 0.08 0.71 0.00 1.28 -2.27 0.00 0.00 179.45 179.25 1k1s n LEU 53 N -4.45 0.00 0.00 5.20 4.77 -1.19 -4.75 117.00 116.58 1k1s n LEU 53 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1k1s n LEU 53 Cb 0.11 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1k1s n LEU 53 CO 0.35 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1k1s n GLY 54 N -0.16 0.90 3.48 -0.72 0.00 -0.09 -4.76 105.19 103.84 1k1s n GLY 54 Ca 0.03 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 1k1s n GLY 54 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k1s s VAL 55 N -2.00 4.01 0.21 1.61 1.01 -1.05 -4.99 120.40 119.21 1k1s s VAL 55 Ca 0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 1k1s s VAL 55 Cb 0.00 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1k1s s VAL 55 CO 0.00 0.45 0.16 -0.54 0.00 0.00 0.00 175.10 175.17 1k1s s LYS 56 N 0.75 1.26 0.40 2.72 1.02 -1.26 -4.04 119.74 120.59 1k1s s LYS 56 Ca -0.00 -1.64 -0.25 0.00 0.02 0.00 0.00 55.97 54.09 1k1s s LYS 56 Cb -0.14 0.29 -0.08 0.00 -0.52 0.00 0.00 37.83 37.37 1k1s s LYS 56 CO 0.02 -0.42 1.17 0.00 -0.92 0.00 0.00 175.35 175.20 1k1s s ALA 57 N -4.09 3.16 0.00 5.17 0.00 -1.26 -3.01 121.76 121.73 1k1s s ALA 57 Ca 0.38 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.31 1k1s s ALA 57 Cb 0.06 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1k1s s ALA 57 CO 0.13 -0.52 0.00 0.41 0.00 0.00 0.00 175.76 175.78 1k1s n GLY 58 N 0.63 3.28 3.68 0.00 0.00 -0.29 -4.99 105.19 107.51 1k1s n GLY 58 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1k1s n GLY 58 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1k1s s MET 59 N -0.59 4.28 0.25 1.61 0.00 -1.17 -4.72 119.30 118.96 1k1s s MET 59 Ca 0.00 1.87 -0.30 0.00 0.00 0.00 0.00 55.69 57.26 1k1s s MET 59 Cb 0.00 -3.63 -0.14 0.00 0.00 0.00 0.00 34.83 31.06 1k1s s MET 59 CO 0.00 -0.58 1.20 -2.30 0.00 0.00 0.00 175.02 173.34 1k1s n PRO 60 N 5.63 1.59 -0.27 4.11 -0.02 -1.26 -0.68 135.00 144.11 1k1s n PRO 60 Ca 0.13 0.56 0.06 0.00 -2.02 0.00 0.00 63.50 62.24 1k1s n PRO 60 Cb 0.44 -2.08 0.17 0.00 -0.02 0.00 0.00 33.50 32.02 1k1s n PRO 60 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1k1s h ILE 61 N 2.54 0.30 0.08 4.25 2.04 -1.84 -1.46 117.51 123.41 1k1s h ILE 61 Ca -0.43 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 65.42 1k1s h ILE 61 Cb 1.32 0.20 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 1k1s h ILE 61 CO 0.68 0.02 -0.36 0.16 0.00 0.00 0.00 178.15 178.64 1k1s h ILE 62 N 0.09 0.24 -0.87 -0.67 3.07 -1.89 0.37 117.51 117.86 1k1s h ILE 62 Ca 0.43 0.00 0.13 0.00 1.55 0.00 0.00 64.86 66.98 1k1s h ILE 62 Cb 0.78 0.24 -0.07 0.00 -0.27 0.00 0.00 36.82 37.50 1k1s h ILE 62 CO -0.70 0.00 0.56 0.11 -1.05 0.00 0.00 178.15 177.07 1k1s h LYS 63 N -0.57 0.67 -0.18 0.16 1.57 -1.65 0.18 116.57 116.76 1k1s h LYS 63 Ca 0.04 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 1k1s h LYS 63 Cb 0.62 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1k1s h LYS 63 CO -0.24 0.44 -0.50 0.00 -0.57 0.00 0.00 179.45 178.58 1k1s h ALA 64 N 1.60 0.30 -0.39 3.86 0.00 -0.65 -2.87 119.26 121.11 1k1s h ALA 64 Ca 0.43 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1k1s h ALA 64 Cb 0.67 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1k1s h ALA 64 CO -0.19 0.48 0.08 0.52 0.00 0.00 0.00 179.25 180.14 1k1s h MET 65 N 0.34 0.58 0.00 0.00 2.86 0.98 0.53 114.93 120.22 1k1s h MET 65 Ca -0.01 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 1k1s h MET 65 Cb 1.12 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.68 1k1s h MET 65 CO 0.11 0.55 0.00 1.04 1.06 0.00 0.00 176.91 179.67 1k1s n GLN 66 N -4.32 0.18 0.00 1.72 6.02 0.51 -2.75 117.38 118.75 1k1s n GLN 66 Ca 0.02 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 1k1s n GLN 66 Cb 0.20 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.96 1k1s n GLN 66 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 1k1s n ILE 67 N -1.38 0.00 -3.01 5.09 -5.35 -0.53 -4.85 119.36 109.33 1k1s n ILE 67 Ca 0.08 -0.36 -0.15 0.00 -0.27 0.00 0.00 62.75 62.06 1k1s n ILE 67 Cb 0.22 1.16 0.01 0.00 -1.74 0.00 0.00 39.64 39.29 1k1s n ILE 67 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1k1s n ALA 68 N -0.31 0.91 -0.35 -1.28 0.00 0.17 -4.84 120.51 114.80 1k1s n ALA 68 Ca 0.00 -2.64 -0.03 0.00 0.00 0.00 0.00 53.44 50.77 1k1s n ALA 68 Cb 0.04 -1.02 0.10 0.00 0.00 0.00 0.00 19.45 18.57 1k1s n ALA 68 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1k1s h PRO 69 N 3.10 1.26 0.00 0.00 0.11 -1.74 -1.79 132.00 132.94 1k1s h PRO 69 Ca 0.02 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1k1s h PRO 69 Cb 1.01 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1k1s h PRO 69 CO 0.36 0.86 0.00 -1.13 -0.21 0.00 0.00 178.00 177.88 1k1s n SER 70 N -4.39 0.00 -4.77 -2.05 3.41 -1.26 -4.84 113.62 99.72 1k1s n SER 70 Ca 0.11 0.22 -0.41 0.00 -0.26 0.00 0.00 58.87 58.53 1k1s n SER 70 Cb 0.03 -0.39 -0.02 0.00 -0.26 0.00 0.00 64.21 63.57 1k1s n SER 70 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k1s s ALA 71 N -2.78 3.51 -0.41 7.33 0.00 -0.67 -4.78 121.76 123.95 1k1s s ALA 71 Ca 0.17 1.29 -0.24 0.00 0.00 0.00 0.00 51.96 53.18 1k1s s ALA 71 Cb 0.16 -3.49 0.02 0.00 0.00 0.00 0.00 23.12 19.80 1k1s s ALA 71 CO 0.39 -0.68 0.86 0.42 0.00 0.00 0.00 175.76 176.74 1k1s s ILE 72 N -1.11 4.60 -0.17 0.00 1.01 0.59 -4.96 121.20 121.16 1k1s s ILE 72 Ca 0.49 0.80 -0.11 0.00 0.00 0.00 0.00 60.65 61.83 1k1s s ILE 72 Cb -0.40 -4.33 -0.05 0.00 0.01 0.00 0.00 42.46 37.69 1k1s s ILE 72 CO 0.54 -0.64 0.19 -0.31 0.00 0.00 0.00 174.94 174.72 1k1s s TYR 73 N 3.42 3.46 -0.02 3.97 1.51 -1.26 -1.16 117.35 127.27 1k1s s TYR 73 Ca 0.34 0.46 0.03 0.00 -1.01 0.00 0.00 57.07 56.89 1k1s s TYR 73 Cb -0.12 -2.19 -0.00 0.00 -0.11 0.00 0.00 41.96 39.54 1k1s s TYR 73 CO 0.21 0.34 -0.10 0.14 -1.11 0.00 0.00 175.55 175.04 1k1s s VAL 74 N 0.17 0.82 1.19 0.71 -7.23 -1.12 -4.98 120.40 109.95 1k1s s VAL 74 Ca 0.12 -0.42 -0.13 0.00 -1.81 0.00 0.00 61.98 59.74 1k1s s VAL 74 Cb -0.12 -0.70 0.30 0.00 0.56 0.00 0.00 36.38 36.42 1k1s s VAL 74 CO 0.01 0.24 1.02 -2.16 -0.31 0.00 0.00 175.10 173.90 1k1s s PRO 75 N -0.08 -1.14 -0.19 4.82 0.04 -1.26 -1.03 135.00 136.15 1k1s s PRO 75 Ca 0.01 0.79 -0.14 0.00 0.04 0.00 0.00 61.00 61.70 1k1s s PRO 75 Cb -0.06 -1.53 -0.04 0.00 0.04 0.00 0.00 34.50 32.91 1k1s s PRO 75 CO -0.00 -3.86 0.31 1.41 0.04 0.00 0.00 177.00 174.90 1k1s s MET 76 N -4.45 4.19 -0.69 4.56 1.75 -1.06 -4.56 119.30 119.05 1k1s s MET 76 Ca 0.69 0.07 0.05 0.00 -1.25 0.00 0.00 55.69 55.24 1k1s s MET 76 Cb -0.25 -3.49 0.20 0.00 2.84 0.00 0.00 34.83 34.13 1k1s s MET 76 CO 0.65 0.09 0.61 0.54 -0.65 0.00 0.00 175.02 176.26 1k1s n ARG 77 N 4.09 2.14 -0.17 4.11 1.74 -1.26 -4.95 116.66 122.35 1k1s n ARG 77 Ca -0.11 -4.57 0.11 0.00 -0.77 0.00 0.00 57.85 52.51 1k1s n ARG 77 Cb 0.52 -2.28 0.43 0.00 -1.02 0.00 0.00 32.46 30.10 1k1s n ARG 77 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1k1s h LYS 78 N 4.94 0.57 -0.41 5.56 3.64 -2.00 -2.03 116.57 126.85 1k1s h LYS 78 Ca 0.17 -0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.63 1k1s h LYS 78 Cb 0.72 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 1k1s h LYS 78 CO 0.77 0.38 0.30 -1.35 -2.27 0.00 0.00 179.45 177.28 1k1s h PRO 79 N 0.59 0.00 -0.06 1.90 0.11 -1.99 0.21 132.00 132.76 1k1s h PRO 79 Ca 0.34 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.32 1k1s h PRO 79 Cb 0.55 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.67 1k1s h PRO 79 CO -0.12 0.00 -0.50 0.82 -0.21 0.00 0.00 178.00 177.99 1k1s h ILE 80 N 0.00 1.40 -0.60 4.15 2.04 -1.80 -2.19 117.51 120.51 1k1s h ILE 80 Ca 0.20 -1.90 -0.03 0.00 1.00 0.00 0.00 64.86 64.13 1k1s h ILE 80 Cb 0.80 2.37 -0.03 0.00 -0.74 0.00 0.00 36.82 39.22 1k1s h ILE 80 CO -0.00 0.56 0.27 1.88 0.00 0.00 0.00 178.15 180.86 1k1s h TYR 81 N -0.02 0.88 -0.46 1.37 0.99 -1.26 -1.84 116.97 116.64 1k1s h TYR 81 Ca -0.05 -0.05 0.04 0.00 2.00 0.00 0.00 58.73 60.67 1k1s h TYR 81 Cb 1.17 -0.27 -0.04 0.00 1.00 0.00 0.00 36.73 38.59 1k1s h TYR 81 CO 0.13 0.69 0.23 0.93 -0.00 0.00 0.00 178.16 180.13 1k1s h GLU 82 N 0.82 0.44 0.21 4.88 5.08 -0.66 0.17 114.58 125.52 1k1s h GLU 82 Ca 0.20 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1k1s h GLU 82 Cb 0.15 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1k1s h GLU 82 CO -0.02 0.29 -0.33 0.00 -1.00 0.00 0.00 179.01 177.95 1k1s h ALA 83 N 1.25 -0.63 -0.59 3.43 0.00 -0.90 0.04 119.26 121.86 1k1s h ALA 83 Ca 0.20 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.09 1k1s h ALA 83 Cb 0.11 0.51 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 1k1s h ALA 83 CO -0.14 -0.90 0.30 0.74 0.00 0.00 0.00 179.25 179.25 1k1s h PHE 84 N -0.61 0.54 -0.17 0.00 -1.00 -1.01 -2.00 116.94 112.68 1k1s h PHE 84 Ca 0.01 0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.85 1k1s h PHE 84 Cb 0.60 -0.16 -0.04 0.00 3.61 0.00 0.00 35.95 39.97 1k1s h PHE 84 CO -0.25 0.24 -0.06 1.03 -1.61 0.00 0.00 178.31 177.66 1k1s h SER 85 N 0.56 -0.22 -0.48 2.17 0.87 -0.21 -1.36 113.55 114.87 1k1s h SER 85 Ca 0.27 0.06 0.04 0.00 -1.23 0.00 0.00 61.79 60.93 1k1s h SER 85 Cb 0.21 0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 62.26 1k1s h SER 85 CO -0.20 -0.08 0.24 0.78 -0.53 0.00 0.00 176.83 177.04 1k1s h ASN 86 N -0.03 0.35 -0.64 6.23 2.35 -0.61 0.03 115.58 123.27 1k1s h ASN 86 Ca 0.09 0.03 0.03 0.00 -0.55 0.00 0.00 56.30 55.90 1k1s h ASN 86 Cb 0.17 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.45 1k1s h ASN 86 CO -0.20 0.25 0.39 -0.09 -1.65 0.00 0.00 177.43 176.13 1k1s h ARG 87 N 0.48 0.73 -0.08 0.81 2.43 -0.94 -2.07 114.38 115.75 1k1s h ARG 87 Ca 0.21 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.19 1k1s h ARG 87 Cb 0.11 -0.16 0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1k1s h ARG 87 CO -0.15 0.48 -0.53 0.82 -1.51 0.00 0.00 179.97 179.09 1k1s h ILE 88 N 0.75 1.38 -0.90 1.20 2.04 -0.92 -2.82 117.51 118.24 1k1s h ILE 88 Ca 0.26 -1.88 0.05 0.00 1.00 0.00 0.00 64.86 64.30 1k1s h ILE 88 Cb 0.05 2.28 -0.06 0.00 -0.74 0.00 0.00 36.82 38.34 1k1s h ILE 88 CO -0.12 0.56 0.57 0.24 0.00 0.00 0.00 178.15 179.41 1k1s h MET 89 N 0.08 1.04 0.00 2.37 2.86 -0.88 0.54 114.93 120.93 1k1s h MET 89 Ca -0.04 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.46 1k1s h MET 89 Cb 1.18 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.60 1k1s h MET 89 CO 0.11 0.69 -0.34 -0.91 1.06 0.00 0.00 176.91 177.51 1k1s h ASN 90 N 1.07 0.00 0.43 1.22 -0.26 -1.45 -0.62 115.58 115.97 1k1s h ASN 90 Ca 0.38 0.00 -0.16 0.00 -0.56 0.00 0.00 56.30 55.96 1k1s h ASN 90 Cb 0.11 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 1k1s h ASN 90 CO -0.15 0.34 -0.69 0.25 -1.06 0.00 0.00 177.43 176.12 1k1s h LEU 91 N 0.00 0.26 -0.17 1.61 5.85 -0.85 -3.09 115.31 118.93 1k1s h LEU 91 Ca -0.00 -0.17 -0.21 0.00 0.84 0.00 0.00 57.88 58.34 1k1s h LEU 91 Cb 0.90 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1k1s h LEU 91 CO 0.04 0.87 -0.96 -0.07 -0.34 0.00 0.00 178.44 177.99 1k1s h LEU 92 N 0.15 0.20 -1.64 2.25 3.38 -0.48 -3.31 115.31 115.87 1k1s h LEU 92 Ca -0.02 -0.18 0.09 0.00 0.09 0.00 0.00 57.88 57.86 1k1s h LEU 92 Cb 1.23 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 1k1s h LEU 92 CO 0.11 1.04 0.39 -1.13 0.09 0.00 0.00 178.44 178.94 1k1s h ASN 93 N 0.07 0.37 1.20 -0.43 -1.24 -1.04 -1.46 115.58 113.05 1k1s h ASN 93 Ca -0.05 0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.97 1k1s h ASN 93 Cb 1.63 -0.07 0.00 0.00 0.73 0.00 0.00 38.32 40.61 1k1s h ASN 93 CO 0.14 0.23 0.00 2.29 -1.29 0.00 0.00 177.43 178.80 1k1s n LYS 94 N -4.47 0.12 -0.02 6.67 2.85 -1.24 -3.46 118.16 118.61 1k1s n LYS 94 Ca 0.09 0.11 0.13 0.00 -1.05 0.00 0.00 58.31 57.59 1k1s n LYS 94 Cb 0.34 -1.65 0.29 0.00 -0.65 0.00 0.00 35.03 33.37 1k1s n LYS 94 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1k1s n HIS 95 N -1.86 0.06 -4.05 5.58 8.25 -0.55 -4.97 115.22 117.67 1k1s n HIS 95 Ca 0.06 -0.03 -0.07 0.00 -0.26 0.00 0.00 57.72 57.42 1k1s n HIS 95 Cb 0.38 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.39 1k1s n HIS 95 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1k1s s ALA 96 N -1.94 0.38 0.15 -1.41 0.00 -1.22 -4.87 121.76 112.83 1k1s s ALA 96 Ca 0.33 -1.10 -0.05 0.00 0.00 0.00 0.00 51.96 51.14 1k1s s ALA 96 Cb 0.20 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.60 1k1s s ALA 96 CO 0.31 -0.39 1.38 -0.44 0.00 0.00 0.00 175.76 176.62 1k1s h ASP 97 N 3.11 0.64 -3.81 0.00 3.32 -1.60 -3.45 116.42 114.64 1k1s h ASP 97 Ca -0.34 -0.43 -0.23 0.00 0.02 0.00 0.00 57.03 56.05 1k1s h ASP 97 Cb 1.15 -0.19 -0.28 0.00 0.22 0.00 0.00 39.33 40.23 1k1s h ASP 97 CO 0.64 1.20 -0.72 -0.54 -1.72 0.00 0.00 179.24 178.09 1k1s s LYS 98 N -3.63 0.03 -0.04 3.56 1.02 -1.22 -5.01 119.74 114.44 1k1s s LYS 98 Ca -0.07 -0.04 0.02 0.00 0.02 0.00 0.00 55.97 55.90 1k1s s LYS 98 Cb 0.10 0.00 0.01 0.00 -0.52 0.00 0.00 37.83 37.42 1k1s s LYS 98 CO 0.86 -0.00 -0.09 -1.50 -0.92 0.00 0.00 175.35 173.70 1k1s s ILE 99 N -0.10 0.82 -0.34 2.17 2.07 -1.26 -1.95 121.20 122.61 1k1s s ILE 99 Ca -0.01 -0.34 0.04 0.00 -1.41 0.00 0.00 60.65 58.93 1k1s s ILE 99 Cb -0.01 -0.76 0.10 0.00 0.13 0.00 0.00 42.46 41.93 1k1s s ILE 99 CO -0.00 0.27 0.06 -0.70 -1.91 0.00 0.00 174.94 172.66 1k1s s GLU 100 N 0.47 1.45 -0.66 3.50 2.12 -0.07 -2.46 118.70 123.05 1k1s s GLU 100 Ca -0.08 -1.85 -0.27 0.00 0.36 0.00 0.00 54.97 53.13 1k1s s GLU 100 Cb -0.12 -3.13 0.00 0.00 0.26 0.00 0.00 34.13 31.14 1k1s s GLU 100 CO 0.01 -0.95 1.58 0.08 -0.54 0.00 0.00 175.26 175.44 1k1s s VAL 101 N 0.91 3.54 0.10 3.70 1.01 -0.45 -1.55 120.40 127.65 1k1s s VAL 101 Ca 0.11 0.32 -0.15 0.00 0.00 0.00 0.00 61.98 62.27 1k1s s VAL 101 Cb -0.19 -4.39 -0.10 0.00 0.00 0.00 0.00 36.38 31.69 1k1s s VAL 101 CO -0.09 -1.34 1.38 0.00 0.00 0.00 0.00 175.10 175.06 1k1s h ALA 102 N 12.57 0.39 -2.30 5.51 0.00 -1.29 -0.46 119.26 133.68 1k1s h ALA 102 Ca -0.27 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1k1s h ALA 102 Cb 1.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1k1s h ALA 102 CO 1.24 0.49 0.00 -1.13 0.00 0.00 0.00 179.25 179.85 1k1s n SER 103 N -4.19 0.00 0.00 0.00 3.41 -0.95 -4.59 113.62 107.30 1k1s n SER 103 Ca -0.05 -0.82 0.07 0.00 -0.26 0.00 0.00 58.87 57.81 1k1s n SER 103 Cb 0.54 0.00 0.35 0.00 -0.26 0.00 0.00 64.21 64.84 1k1s n SER 103 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k1s n ILE 104 N 0.00 0.72 -2.02 -1.33 3.06 -1.26 -3.31 119.36 115.22 1k1s n ILE 104 Ca 0.00 0.18 0.00 0.00 -2.50 0.00 0.00 62.75 60.43 1k1s n ILE 104 Cb 0.00 -0.93 -0.00 0.00 0.54 0.00 0.00 39.64 39.25 1k1s n ILE 104 CO 0.00 0.00 0.00 -0.90 -2.50 0.00 0.00 176.55 173.15 1k1s n ASP 105 N -1.36 0.02 -3.86 9.51 3.85 -1.26 -4.75 116.55 118.70 1k1s n ASP 105 Ca 0.06 -1.69 -0.14 0.00 -0.71 0.00 0.00 54.79 52.31 1k1s n ASP 105 Cb 0.14 -0.13 -0.15 0.00 -1.35 0.00 0.00 41.12 39.63 1k1s n ASP 105 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1k1s s GLU 106 N 0.00 0.11 0.02 0.11 2.02 -1.21 -1.93 118.70 117.83 1k1s s GLU 106 Ca 0.02 0.01 -0.20 0.00 0.02 0.00 0.00 54.97 54.82 1k1s s GLU 106 Cb 0.02 -0.19 0.04 0.00 0.10 0.00 0.00 34.13 34.10 1k1s s GLU 106 CO -0.01 -0.03 0.44 0.00 0.02 0.00 0.00 175.26 175.68 1k1s s ALA 107 N 0.32 -1.10 -0.01 5.21 0.00 -0.93 -0.81 121.76 124.45 1k1s s ALA 107 Ca -0.03 0.47 0.07 0.00 0.00 0.00 0.00 51.96 52.48 1k1s s ALA 107 Cb -0.05 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.31 1k1s s ALA 107 CO -0.01 -0.41 -0.23 0.71 0.00 0.00 0.00 175.76 175.81 1k1s s TYR 108 N -2.09 2.10 -0.04 0.00 1.51 -0.60 -1.90 117.35 116.33 1k1s s TYR 108 Ca -0.08 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.62 1k1s s TYR 108 Cb -0.02 -1.33 0.01 0.00 -0.11 0.00 0.00 41.96 40.51 1k1s s TYR 108 CO 0.01 -0.01 -0.11 -0.51 -1.11 0.00 0.00 175.55 173.82 1k1s s LEU 109 N -0.66 1.74 -0.31 -1.29 1.02 0.23 -0.89 118.68 118.52 1k1s s LEU 109 Ca 0.09 -0.24 -0.10 0.00 0.02 0.00 0.00 54.13 53.91 1k1s s LEU 109 Cb -0.09 -0.68 -0.01 0.00 0.02 0.00 0.00 46.19 45.44 1k1s s LEU 109 CO -0.00 0.07 0.16 -0.62 0.02 0.00 0.00 176.35 175.97 1k1s s ASP 110 N 0.32 5.57 -0.13 2.29 3.68 -0.82 -0.28 116.67 127.30 1k1s s ASP 110 Ca -0.06 -0.52 0.17 0.00 2.13 0.00 0.00 52.55 54.27 1k1s s ASP 110 Cb -0.11 -2.01 0.30 0.00 -1.45 0.00 0.00 42.92 39.65 1k1s s ASP 110 CO 0.01 -0.20 1.18 1.33 0.13 0.00 0.00 175.17 177.62 1k1s n VAL 111 N 4.99 1.87 0.33 1.11 0.24 -0.40 -1.56 118.33 124.91 1k1s n VAL 111 Ca -0.14 -2.13 0.16 0.00 -2.04 0.00 0.00 64.34 60.20 1k1s n VAL 111 Cb 0.49 -0.19 0.87 0.00 -1.47 0.00 0.00 33.84 33.54 1k1s n VAL 111 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1k1s h THR 112 N 0.25 0.00 0.00 3.34 2.02 -1.92 -2.07 112.91 114.53 1k1s h THR 112 Ca 0.00 0.00 -0.36 0.00 0.77 0.00 0.00 66.41 66.82 1k1s h THR 112 Cb 1.02 0.71 -0.06 0.00 -1.74 0.00 0.00 68.15 68.07 1k1s h THR 112 CO 0.03 0.00 -2.35 0.59 0.37 0.00 0.00 175.52 174.15 1k1s n ASN 113 N -2.88 2.13 0.29 4.18 3.02 -1.26 -0.36 115.26 120.38 1k1s n ASN 113 Ca -0.02 -0.10 0.16 0.00 -0.03 0.00 0.00 54.58 54.59 1k1s n ASN 113 Cb 0.32 -0.40 0.90 0.00 -0.61 0.00 0.00 39.78 39.99 1k1s n ASN 113 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1k1s h LYS 114 N -0.06 0.00 -0.27 3.52 6.56 -1.80 -1.43 116.57 123.09 1k1s h LYS 114 Ca -0.54 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.05 1k1s h LYS 114 Cb 1.81 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.47 1k1s h LYS 114 CO -0.10 0.05 0.00 1.33 -2.06 0.00 0.00 179.45 178.67 1k1s n VAL 115 N -3.51 2.27 -2.03 0.50 0.24 -0.81 -4.96 118.33 110.02 1k1s n VAL 115 Ca -0.02 -1.85 -0.09 0.00 -2.04 0.00 0.00 64.34 60.34 1k1s n VAL 115 Cb 0.16 -0.24 -0.02 0.00 -1.47 0.00 0.00 33.84 32.28 1k1s n VAL 115 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1k1s n GLU 116 N -0.46 -2.01 -0.85 7.34 0.00 -0.54 -0.06 120.64 124.06 1k1s n GLU 116 Ca 0.21 0.45 0.00 0.00 0.00 0.00 0.00 57.16 57.82 1k1s n GLU 116 Cb 0.89 -4.87 0.00 0.00 0.00 0.00 0.00 31.44 27.46 1k1s n GLU 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1k1s n GLY 117 N -0.52 0.65 3.47 -1.84 0.00 0.51 -4.98 105.19 102.48 1k1s n GLY 117 Ca -0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 1k1s n GLY 117 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1k1s s ASN 118 N -2.21 6.25 0.58 1.61 3.84 0.91 -4.93 114.94 121.00 1k1s s ASN 118 Ca 0.00 -0.77 0.28 0.00 0.21 0.00 0.00 52.86 52.57 1k1s s ASN 118 Cb 0.00 -2.37 1.71 0.00 -0.55 0.00 0.00 41.25 40.04 1k1s s ASN 118 CO 0.00 -1.15 2.20 0.15 -2.79 0.00 0.00 177.10 175.51 1k1s h PHE 119 N 9.25 0.00 -0.00 0.43 3.57 -1.95 -1.64 116.94 126.59 1k1s h PHE 119 Ca -0.27 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.08 1k1s h PHE 119 Cb 1.08 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.80 1k1s h PHE 119 CO 0.86 0.00 -0.68 0.93 -2.23 0.00 0.00 178.31 177.20 1k1s h GLU 120 N 0.00 0.02 0.00 1.11 4.39 -1.96 -2.97 114.58 115.17 1k1s h GLU 120 Ca 0.03 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1k1s h GLU 120 Cb 0.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1k1s h GLU 120 CO -0.00 0.69 0.00 -0.91 -1.16 0.00 0.00 179.01 177.63 1k1s h ASN 121 N 0.01 0.00 0.52 1.42 -0.26 -1.65 -2.96 115.58 112.67 1k1s h ASN 121 Ca -0.01 0.00 -0.11 0.00 -0.56 0.00 0.00 56.30 55.62 1k1s h ASN 121 Cb 1.20 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 38.44 1k1s h ASN 121 CO 0.09 0.00 -0.53 1.23 -1.06 0.00 0.00 177.43 177.16 1k1s h GLY 122 N 3.89 0.02 1.57 2.83 0.00 -1.35 0.11 103.07 110.13 1k1s h GLY 122 Ca 0.00 -0.02 -0.22 0.00 0.00 0.00 0.00 47.33 47.09 1k1s h GLY 122 CO 0.00 0.02 -0.93 -2.22 0.00 0.00 0.00 176.54 173.40 1k1s h ILE 123 N 0.01 1.41 -0.37 2.60 2.04 -1.55 -0.84 117.51 120.81 1k1s h ILE 123 Ca -0.00 -2.47 -0.04 0.00 1.00 0.00 0.00 64.86 63.34 1k1s h ILE 123 Cb 0.94 2.43 -0.01 0.00 -0.74 0.00 0.00 36.82 39.43 1k1s h ILE 123 CO 0.07 0.74 0.07 -0.08 0.00 0.00 0.00 178.15 178.94 1k1s h GLU 124 N 0.21 0.61 -0.20 2.37 4.22 -1.29 -1.92 114.58 118.59 1k1s h GLU 124 Ca -0.07 -0.16 -0.03 0.00 0.08 0.00 0.00 59.36 59.18 1k1s h GLU 124 Cb 1.57 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.74 1k1s h GLU 124 CO 0.16 0.67 0.02 1.25 -2.18 0.00 0.00 179.01 178.93 1k1s h LEU 125 N 0.46 0.33 -1.88 1.64 5.85 -0.77 -1.92 115.31 119.02 1k1s h LEU 125 Ca 0.11 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1k1s h LEU 125 Cb 0.35 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1k1s h LEU 125 CO 0.01 0.53 0.00 0.00 -0.34 0.00 0.00 178.44 178.63 1k1s h ALA 126 N 0.81 1.00 0.10 1.25 0.00 -1.05 0.36 119.26 121.74 1k1s h ALA 126 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.76 1k1s h ALA 126 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1k1s h ALA 126 CO 0.01 0.00 -1.02 -0.09 0.00 0.00 0.00 179.25 178.15 1k1s h ARG 127 N 0.00 0.22 -0.31 0.00 9.65 -0.72 -2.84 114.38 120.38 1k1s h ARG 127 Ca 0.00 -0.38 -0.08 0.00 -1.10 0.00 0.00 59.98 58.42 1k1s h ARG 127 Cb 0.03 0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.74 1k1s h ARG 127 CO 0.00 1.18 -0.16 0.87 2.80 0.00 0.00 179.97 184.66 1k1s h LYS 128 N -0.46 0.56 0.26 0.20 1.57 -0.26 -1.54 116.57 116.90 1k1s h LYS 128 Ca -0.21 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.37 1k1s h LYS 128 Cb 1.60 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.86 1k1s h LYS 128 CO 0.07 0.70 -0.13 0.82 -0.57 0.00 0.00 179.45 180.34 1k1s h ILE 129 N 0.51 0.79 -0.65 1.86 2.04 -0.49 0.50 117.51 122.06 1k1s h ILE 129 Ca 0.09 -0.48 0.11 0.00 1.00 0.00 0.00 64.86 65.58 1k1s h ILE 129 Cb 0.57 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.66 1k1s h ILE 129 CO 0.04 0.10 0.44 0.50 0.00 0.00 0.00 178.15 179.22 1k1s h LYS 130 N -0.61 0.42 0.21 2.37 3.64 -1.39 -1.97 116.57 119.24 1k1s h LYS 130 Ca -0.04 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1k1s h LYS 130 Cb 0.44 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1k1s h LYS 130 CO 0.06 0.27 -0.10 0.37 -2.27 0.00 0.00 179.45 177.78 1k1s h GLN 131 N 0.43 -0.27 -0.42 1.90 5.75 -1.04 -3.14 115.11 118.31 1k1s h GLN 131 Ca 0.31 0.02 0.08 0.00 -0.15 0.00 0.00 58.65 58.90 1k1s h GLN 131 Cb 0.62 0.06 -0.07 0.00 1.07 0.00 0.00 27.48 29.16 1k1s h GLN 131 CO -0.09 0.10 0.00 1.49 -2.65 0.00 0.00 178.83 177.68 1k1s h GLU 132 N -0.91 0.11 -0.85 1.69 4.81 -0.58 -0.70 114.58 118.14 1k1s h GLU 132 Ca -0.03 -0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.30 1k1s h GLU 132 Cb 0.50 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.77 1k1s h GLU 132 CO 0.05 0.07 0.48 0.82 -0.73 0.00 0.00 179.01 179.70 1k1s h ILE 133 N 0.11 0.88 -0.11 2.32 2.04 -1.49 0.13 117.51 121.38 1k1s h ILE 133 Ca 0.21 -0.27 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 1k1s h ILE 133 Cb 0.30 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1k1s h ILE 133 CO -0.35 0.14 -0.25 0.25 0.00 0.00 0.00 178.15 177.94 1k1s h LEU 134 N 0.78 0.20 0.11 1.44 5.85 -1.17 -0.48 115.31 122.04 1k1s h LEU 134 Ca 0.42 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 59.08 1k1s h LEU 134 Cb 0.43 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.41 1k1s h LEU 134 CO -0.27 0.46 -0.05 -0.33 -0.34 0.00 0.00 178.44 177.91 1k1s h GLU 135 N 0.18 -0.14 0.00 1.25 5.08 0.42 -1.54 114.58 119.83 1k1s h GLU 135 Ca 0.03 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 1k1s h GLU 135 Cb 0.55 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1k1s h GLU 135 CO 0.04 -0.09 -0.36 0.87 -1.00 0.00 0.00 179.01 178.46 1k1s h LYS 136 N -1.01 0.00 0.00 2.33 1.57 -0.92 -3.33 116.57 115.21 1k1s h LYS 136 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1k1s h LYS 136 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1k1s h LYS 136 CO 0.02 0.36 -0.15 0.39 -0.57 0.00 0.00 179.45 179.51 1k1s n GLU 137 N -3.80 6.01 -3.42 3.15 -0.58 -0.20 -5.03 120.64 116.76 1k1s n GLU 137 Ca -0.01 -0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.56 1k1s n GLU 137 Cb 0.44 -0.61 0.09 0.00 -0.57 0.00 0.00 31.44 30.79 1k1s n GLU 137 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1k1s n LYS 138 N -1.08 -6.31 -3.81 3.49 5.02 -0.58 -4.98 118.16 109.92 1k1s n LYS 138 Ca 0.00 0.85 -0.13 0.00 -2.02 0.00 0.00 58.31 57.01 1k1s n LYS 138 Cb 0.03 -5.87 -0.14 0.00 -0.02 0.00 0.00 35.03 29.03 1k1s n LYS 138 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1k1s s ILE 139 N -3.36 -0.03 0.02 -0.18 1.01 -1.24 -4.94 121.20 112.48 1k1s s ILE 139 Ca 0.03 0.09 -0.21 0.00 0.00 0.00 0.00 60.65 60.56 1k1s s ILE 139 Cb -0.00 -0.11 -0.06 0.00 0.01 0.00 0.00 42.46 42.30 1k1s s ILE 139 CO 0.73 0.04 0.63 0.42 0.00 0.00 0.00 174.94 176.76 1k1s s THR 140 N 0.53 4.84 0.03 2.92 -4.23 -1.26 -3.55 115.64 114.91 1k1s s THR 140 Ca -0.04 1.34 0.03 0.00 -1.18 0.00 0.00 61.69 61.84 1k1s s THR 140 Cb -0.06 -3.97 -0.02 0.00 1.34 0.00 0.00 72.50 69.79 1k1s s THR 140 CO -0.02 0.42 -0.11 0.68 -0.54 0.00 0.00 174.62 175.06 1k1s s VAL 141 N -0.28 0.82 -0.16 2.29 -7.23 -1.26 -2.76 120.40 111.82 1k1s s VAL 141 Ca 0.33 -0.83 -0.10 0.00 -1.81 0.00 0.00 61.98 59.57 1k1s s VAL 141 Cb -0.19 -0.77 -0.05 0.00 0.56 0.00 0.00 36.38 35.94 1k1s s VAL 141 CO 0.19 -0.05 0.17 0.28 -0.31 0.00 0.00 175.10 175.39 1k1s s THR 142 N -0.79 5.40 0.10 5.32 -1.32 0.04 -4.53 115.64 119.86 1k1s s THR 142 Ca -0.01 0.29 0.10 0.00 -1.21 0.00 0.00 61.69 60.86 1k1s s THR 142 Cb -0.07 -3.49 -0.04 0.00 -1.51 0.00 0.00 72.50 67.39 1k1s s THR 142 CO 0.01 0.49 -0.24 -0.69 -2.21 0.00 0.00 174.62 171.97 1k1s s VAL 143 N -0.06 2.39 -0.06 5.08 1.01 -1.00 -1.01 120.40 126.74 1k1s s VAL 143 Ca 0.12 -1.58 0.03 0.00 0.00 0.00 0.00 61.98 60.55 1k1s s VAL 143 Cb -0.12 -2.03 0.01 0.00 0.00 0.00 0.00 36.38 34.24 1k1s s VAL 143 CO 0.01 0.17 -0.13 -0.83 0.00 0.00 0.00 175.10 174.33 1k1s s GLY 144 N -1.84 0.80 -0.23 4.51 0.00 0.43 -0.02 107.32 110.97 1k1s s GLY 144 Ca 0.14 -0.46 0.02 0.00 0.00 0.00 0.00 44.72 44.43 1k1s s GLY 144 CO 0.06 0.03 -0.11 0.14 0.00 0.00 0.00 173.10 173.22 1k1s s VAL 145 N 0.53 1.91 0.27 1.40 1.01 0.06 -0.24 120.40 125.34 1k1s s VAL 145 Ca -0.12 -1.33 -0.13 0.00 0.00 0.00 0.00 61.98 60.40 1k1s s VAL 145 Cb -0.15 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.23 1k1s s VAL 145 CO 0.03 0.07 0.53 0.00 0.00 0.00 0.00 175.10 175.73 1k1s s ALA 146 N 1.25 -0.26 0.42 5.51 0.00 -0.94 -0.62 121.76 127.11 1k1s s ALA 146 Ca -0.05 -0.88 0.10 0.00 0.00 0.00 0.00 51.96 51.13 1k1s s ALA 146 Cb -0.18 1.03 0.94 0.00 0.00 0.00 0.00 23.12 24.90 1k1s s ALA 146 CO -0.07 -0.88 2.01 -1.35 0.00 0.00 0.00 175.76 175.47 1k1s h PRO 147 N 2.19 0.49 -4.95 0.00 0.11 -1.75 -0.93 132.00 127.16 1k1s h PRO 147 Ca -0.26 -0.03 -0.45 0.00 0.11 0.00 0.00 66.00 65.37 1k1s h PRO 147 Cb 1.25 -0.11 -0.14 0.00 0.11 0.00 0.00 31.00 32.11 1k1s h PRO 147 CO 0.35 0.32 -0.55 0.54 -0.21 0.00 0.00 178.00 178.45 1k1s s ASN 148 N -6.40 1.87 0.07 -2.05 2.20 -1.26 -4.24 114.94 105.12 1k1s s ASN 148 Ca -0.08 -1.56 -0.28 0.00 -0.94 0.00 0.00 52.86 50.00 1k1s s ASN 148 Cb 0.19 0.36 -0.17 0.00 -2.00 0.00 0.00 41.25 39.62 1k1s s ASN 148 CO 0.74 -0.86 1.61 0.11 -2.94 0.00 0.00 177.10 175.76 1k1s h LYS 149 N 2.12 -0.46 -0.85 3.55 1.57 -1.87 -1.45 116.57 119.18 1k1s h LYS 149 Ca -0.35 0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.56 1k1s h LYS 149 Cb 1.25 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.59 1k1s h LYS 149 CO 0.55 -0.27 0.49 0.82 -0.57 0.00 0.00 179.45 180.47 1k1s h ILE 150 N -0.53 0.92 -0.35 1.86 1.08 -1.94 0.14 117.51 118.68 1k1s h ILE 150 Ca -0.05 -0.28 -0.15 0.00 -0.39 0.00 0.00 64.86 63.98 1k1s h ILE 150 Cb 0.40 0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 34.16 1k1s h ILE 150 CO 0.08 0.15 -0.39 -0.07 -0.69 0.00 0.00 178.15 177.23 1k1s h LEU 151 N 0.83 0.90 -0.45 1.44 3.38 -1.93 -0.60 115.31 118.87 1k1s h LEU 151 Ca 0.41 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1k1s h LEU 151 Cb 0.37 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1k1s h LEU 151 CO -0.25 1.18 0.23 0.00 0.09 0.00 0.00 178.44 179.69 1k1s h ALA 152 N 0.86 0.58 -0.25 1.53 0.00 -0.11 -1.18 119.26 120.69 1k1s h ALA 152 Ca 0.06 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1k1s h ALA 152 Cb 0.96 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1k1s h ALA 152 CO 0.09 0.12 -0.18 -0.22 0.00 0.00 0.00 179.25 179.07 1k1s h LYS 153 N 0.59 0.55 0.13 0.00 3.64 -0.70 -2.24 116.57 118.54 1k1s h LYS 153 Ca 0.16 -0.27 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 1k1s h LYS 153 Cb 0.09 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1k1s h LYS 153 CO -0.02 0.84 -0.06 0.82 -2.27 0.00 0.00 179.45 178.76 1k1s h ILE 154 N 0.27 0.89 0.00 2.00 2.04 -1.00 -1.75 117.51 119.95 1k1s h ILE 154 Ca 0.05 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 1k1s h ILE 154 Cb 0.71 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.73 1k1s h ILE 154 CO 0.05 0.02 -0.16 -0.29 0.00 0.00 0.00 178.15 177.77 1k1s h ILE 155 N -0.22 1.00 -0.46 -0.67 6.09 -1.29 -2.16 117.51 119.80 1k1s h ILE 155 Ca -0.02 -0.56 -0.11 0.00 -1.37 0.00 0.00 64.86 62.80 1k1s h ILE 155 Cb 0.17 1.31 -0.02 0.00 0.47 0.00 0.00 36.82 38.75 1k1s h ILE 155 CO 0.03 0.15 -0.15 0.00 -3.07 0.00 0.00 178.15 175.11 1k1s h ALA 156 N 1.84 0.85 -0.14 0.18 0.00 -0.84 -2.77 119.26 118.39 1k1s h ALA 156 Ca -0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 1k1s h ALA 156 Cb 0.30 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1k1s h ALA 156 CO 0.02 0.64 -0.05 -0.44 0.00 0.00 0.00 179.25 179.43 1k1s h ASP 157 N 0.78 0.28 0.00 0.00 5.19 -0.70 -1.54 116.42 120.43 1k1s h ASP 157 Ca 0.12 -0.39 0.00 0.00 -0.62 0.00 0.00 57.03 56.14 1k1s h ASP 157 Cb 0.68 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.12 1k1s h ASP 157 CO 0.05 0.60 0.00 0.29 -3.12 0.00 0.00 179.24 177.07 1k1s n LYS 158 N -4.69 0.30 0.00 3.56 5.02 -0.99 -2.54 118.16 118.81 1k1s n LYS 158 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1k1s n LYS 158 Cb 0.27 -1.42 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 1k1s n LYS 158 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1k1s n SER 159 N -0.92 2.65 -4.88 4.39 7.64 -0.85 -5.03 113.62 116.62 1k1s n SER 159 Ca 0.06 -0.22 -0.30 0.00 1.01 0.00 0.00 58.87 59.42 1k1s n SER 159 Cb 0.03 0.97 -0.00 0.00 -1.01 0.00 0.00 64.21 64.20 1k1s n SER 159 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 1k1s s LYS 160 N -1.50 3.65 0.57 1.43 -2.85 -0.64 -2.01 119.74 118.39 1k1s s LYS 160 Ca 0.00 0.62 -0.14 0.00 -1.00 0.00 0.00 55.97 55.45 1k1s s LYS 160 Cb 0.00 -2.19 -0.06 0.00 -2.06 0.00 0.00 37.83 33.53 1k1s s LYS 160 CO 0.00 -0.39 1.01 -1.25 0.10 0.00 0.00 175.35 174.82 1k1s s PRO 161 N -4.81 3.72 0.00 1.78 0.04 -1.26 -4.83 135.00 129.64 1k1s s PRO 161 Ca 0.53 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1k1s s PRO 161 Cb -0.11 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1k1s s PRO 161 CO 0.47 -0.47 0.00 -1.71 0.04 0.00 0.00 177.00 175.33 1k1s n ASN 162 N -2.13 -3.89 -3.61 6.66 5.15 -1.26 -4.94 115.26 111.24 1k1s n ASN 162 Ca 0.07 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.74 1k1s n ASN 162 Cb 0.54 -2.97 0.25 0.00 -0.53 0.00 0.00 39.78 37.07 1k1s n ASN 162 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1k1s s GLY 163 N -1.83 1.60 -0.46 8.20 0.00 -0.85 -4.84 107.32 109.13 1k1s s GLY 163 Ca 0.00 -1.11 0.06 0.00 0.00 0.00 0.00 44.72 43.67 1k1s s GLY 163 CO 0.00 -0.17 0.62 -0.10 0.00 0.00 0.00 173.10 173.46 1k1s n LEU 164 N -4.83 -1.91 -4.76 0.66 0.00 -1.25 -2.38 117.00 102.51 1k1s n LEU 164 Ca 0.15 -3.70 -0.38 0.00 0.00 0.00 0.00 56.01 52.08 1k1s n LEU 164 Cb 0.60 0.70 0.00 0.00 0.00 0.00 0.00 43.42 44.72 1k1s n LEU 164 CO 0.42 1.95 0.89 -0.83 0.00 0.00 0.00 177.39 179.82 1k1s s GLY 165 N -0.24 2.84 -0.05 -3.96 0.00 0.97 -4.92 107.32 101.95 1k1s s GLY 165 Ca 0.32 1.09 -0.04 0.00 0.00 0.00 0.00 44.72 46.09 1k1s s GLY 165 CO -0.14 1.59 0.13 0.14 0.00 0.00 0.00 173.10 174.82 1k1s s VAL 166 N -1.42 -0.01 -0.29 1.40 1.01 -1.26 -0.76 120.40 119.06 1k1s s VAL 166 Ca 0.64 0.04 -0.04 0.00 0.00 0.00 0.00 61.98 62.62 1k1s s VAL 166 Cb -0.33 -0.19 0.10 0.00 0.00 0.00 0.00 36.38 35.95 1k1s s VAL 166 CO 0.41 0.02 0.13 -0.63 0.00 0.00 0.00 175.10 175.03 1k1s s ILE 167 N 0.30 -0.07 0.61 2.22 1.01 0.21 -4.96 121.20 120.52 1k1s s ILE 167 Ca -0.02 -0.79 -0.17 0.00 0.00 0.00 0.00 60.65 59.67 1k1s s ILE 167 Cb -0.03 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.43 1k1s s ILE 167 CO -0.01 -0.74 1.13 -0.13 0.00 0.00 0.00 174.94 175.19 1k1s s ARG 168 N 2.07 3.04 0.50 2.79 0.52 -1.26 -4.11 118.95 122.48 1k1s s ARG 168 Ca 0.09 1.53 0.32 0.00 -0.52 0.00 0.00 55.73 57.15 1k1s s ARG 168 Cb -0.16 -1.97 1.43 0.00 0.52 0.00 0.00 34.95 34.77 1k1s s ARG 168 CO -0.36 -1.09 1.77 -1.35 0.02 0.00 0.00 175.30 174.30 1k1s h PRO 169 N 0.59 0.11 0.00 3.54 0.11 -1.98 -0.69 132.00 133.68 1k1s h PRO 169 Ca -0.48 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.42 1k1s h PRO 169 Cb 1.26 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1k1s h PRO 169 CO 0.55 0.07 -1.01 1.79 -0.21 0.00 0.00 178.00 179.19 1k1s h THR 170 N 0.11 1.44 -0.47 -1.15 1.35 -2.05 -3.29 112.91 108.84 1k1s h THR 170 Ca 0.61 -3.11 0.00 0.00 -0.55 0.00 0.00 66.41 63.36 1k1s h THR 170 Cb 2.16 2.71 0.00 0.00 -1.73 0.00 0.00 68.15 71.29 1k1s h THR 170 CO -0.11 0.82 0.00 -1.84 -0.25 0.00 0.00 175.52 174.14 1k1s n GLU 171 N -3.28 2.90 0.00 4.72 0.28 -0.28 -4.63 120.64 120.35 1k1s n GLU 171 Ca -0.02 -2.04 0.00 0.00 -0.16 0.00 0.00 57.16 54.94 1k1s n GLU 171 Cb 0.92 -1.69 0.00 0.00 1.43 0.00 0.00 31.44 32.10 1k1s n GLU 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1k1s n VAL 172 N 0.78 0.00 -0.42 3.84 0.31 -1.10 -1.98 118.33 119.75 1k1s n VAL 172 Ca 0.18 0.85 0.40 0.00 -0.01 0.00 0.00 64.34 65.77 1k1s n VAL 172 Cb 0.65 -1.64 0.75 0.00 -0.91 0.00 0.00 33.84 32.70 1k1s n VAL 172 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 1k1s h GLN 173 N 0.00 0.00 0.28 5.55 5.75 -1.85 0.26 115.11 125.10 1k1s h GLN 173 Ca 0.00 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1k1s h GLN 173 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1k1s h GLN 173 CO 0.00 0.00 -0.14 0.22 -2.65 0.00 0.00 178.83 176.26 1k1s h ASP 174 N 0.00 -0.32 -0.68 -0.69 1.82 -1.85 -3.05 116.42 111.66 1k1s h ASP 174 Ca 0.67 -0.21 0.14 0.00 -0.39 0.00 0.00 57.03 57.24 1k1s h ASP 174 Cb 2.78 0.08 -0.11 0.00 0.68 0.00 0.00 39.33 42.77 1k1s h ASP 174 CO -0.01 0.11 0.10 0.15 -1.61 0.00 0.00 179.24 177.99 1k1s h PHE 175 N -0.85 0.15 -0.85 0.28 3.57 0.14 -0.55 116.94 118.83 1k1s h PHE 175 Ca -0.04 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.55 1k1s h PHE 175 Cb 0.52 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 39.25 1k1s h PHE 175 CO 0.04 -0.11 0.56 -0.07 -2.23 0.00 0.00 178.31 176.50 1k1s h LEU 176 N 0.21 0.88 0.32 0.59 3.38 -1.44 -2.73 115.31 116.52 1k1s h LEU 176 Ca 0.37 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.32 1k1s h LEU 176 Cb 0.61 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1k1s h LEU 176 CO -0.51 0.60 -0.21 0.78 0.09 0.00 0.00 178.44 179.20 1k1s h ASN 177 N 1.02 -0.52 0.00 -0.43 4.21 -0.98 -2.59 115.58 116.29 1k1s h ASN 177 Ca 0.35 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.89 1k1s h ASN 177 Cb 0.09 0.15 0.00 0.00 -1.12 0.00 0.00 38.32 37.44 1k1s h ASN 177 CO -0.11 -0.31 0.00 1.21 -1.29 0.00 0.00 177.43 176.93 1k1s n GLU 178 N -3.55 0.69 -3.20 0.81 2.13 -1.14 -4.04 120.64 112.33 1k1s n GLU 178 Ca -0.06 0.00 -0.40 0.00 0.66 0.00 0.00 57.16 57.36 1k1s n GLU 178 Cb 0.21 -1.27 -0.07 0.00 0.27 0.00 0.00 31.44 30.58 1k1s n GLU 178 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1k1s s LEU 179 N 0.00 4.08 0.31 4.31 2.96 -0.97 -4.98 118.68 124.39 1k1s s LEU 179 Ca 0.00 0.62 -0.28 0.00 -0.22 0.00 0.00 54.13 54.26 1k1s s LEU 179 Cb 0.00 -2.74 -0.09 0.00 0.50 0.00 0.00 46.19 43.86 1k1s s LEU 179 CO 0.00 -0.28 1.07 -1.81 -1.32 0.00 0.00 176.35 174.00 1k1s s ASP 180 N 1.41 7.16 0.36 3.68 1.01 -1.26 0.34 116.67 129.37 1k1s s ASP 180 Ca 0.24 2.16 0.09 0.00 0.71 0.00 0.00 52.55 55.75 1k1s s ASP 180 Cb -0.16 -2.61 0.82 0.00 1.01 0.00 0.00 42.92 41.98 1k1s s ASP 180 CO 0.09 -0.21 1.87 0.40 0.21 0.00 0.00 175.17 177.53 1k1s h ILE 181 N 2.83 0.84 0.00 0.77 1.08 -1.71 -0.20 117.51 121.12 1k1s h ILE 181 Ca -0.47 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 63.76 1k1s h ILE 181 Cb 1.21 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 35.05 1k1s h ILE 181 CO 0.66 0.13 0.00 0.47 -0.69 0.00 0.00 178.15 178.71 1k1s n ASP 182 N -4.56 0.00 -0.58 1.72 9.92 -1.26 -1.94 116.55 119.85 1k1s n ASP 182 Ca 0.17 0.14 0.10 0.00 -0.53 0.00 0.00 54.79 54.67 1k1s n ASP 182 Cb 0.46 -0.31 0.03 0.00 -0.64 0.00 0.00 41.12 40.66 1k1s n ASP 182 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1k1s n GLU 183 N -1.31 1.60 -3.00 -1.24 1.02 -0.09 -4.94 120.64 112.68 1k1s n GLU 183 Ca 0.06 -1.21 -0.41 0.00 -0.02 0.00 0.00 57.16 55.58 1k1s n GLU 183 Cb 0.11 -1.38 -0.05 0.00 -0.02 0.00 0.00 31.44 30.10 1k1s n GLU 183 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1k1s s ILE 184 N -2.02 4.96 0.37 -3.67 1.01 -0.82 -4.92 121.20 116.10 1k1s s ILE 184 Ca 0.19 1.43 -0.27 0.00 0.00 0.00 0.00 60.65 62.00 1k1s s ILE 184 Cb 0.16 -4.05 -0.09 0.00 0.01 0.00 0.00 42.46 38.49 1k1s s ILE 184 CO 0.40 0.09 1.21 -2.84 0.00 0.00 0.00 174.94 173.81 1k1s s PRO 185 N 1.87 4.21 0.00 2.79 0.02 -1.26 -3.35 135.00 139.28 1k1s s PRO 185 Ca 0.34 1.97 0.00 0.00 0.02 0.00 0.00 61.00 63.34 1k1s s PRO 185 Cb -0.16 -2.86 0.00 0.00 0.02 0.00 0.00 34.50 31.49 1k1s s PRO 185 CO 0.12 -0.23 0.00 0.41 -0.33 0.00 0.00 177.00 176.97 1k1s n GLY 186 N 0.76 1.90 3.75 0.52 0.00 -1.26 -5.05 105.19 105.81 1k1s n GLY 186 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 1k1s n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k1s s ILE 187 N -2.53 5.38 0.55 -0.61 -1.09 -1.21 -5.04 121.20 116.66 1k1s s ILE 187 Ca 0.00 0.30 -0.19 0.00 -2.23 0.00 0.00 60.65 58.53 1k1s s ILE 187 Cb 0.00 -3.51 -0.05 0.00 -1.58 0.00 0.00 42.46 37.32 1k1s s ILE 187 CO 0.00 0.45 1.11 -0.83 -1.23 0.00 0.00 174.94 174.44 1k1s s GLY 188 N 0.20 2.54 0.59 6.18 0.00 -1.26 -4.89 107.32 110.69 1k1s s GLY 188 Ca 0.11 0.75 0.34 0.00 0.00 0.00 0.00 44.72 45.92 1k1s s GLY 188 CO 0.01 1.10 2.22 1.48 0.00 0.00 0.00 173.10 177.91 1k1s h SER 189 N 1.06 0.00 0.05 1.64 4.64 -1.98 -1.47 113.55 117.49 1k1s h SER 189 Ca -0.49 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.70 1k1s h SER 189 Cb 1.25 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.36 1k1s h SER 189 CO 0.57 0.03 -0.53 0.58 -0.87 0.00 0.00 176.83 176.61 1k1s h VAL 190 N 0.00 1.52 0.00 0.95 2.07 -2.00 -2.90 116.25 115.88 1k1s h VAL 190 Ca -0.00 -2.23 -0.04 0.00 0.82 0.00 0.00 66.70 65.25 1k1s h VAL 190 Cb 0.12 2.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.81 1k1s h VAL 190 CO 0.00 0.63 -0.20 0.25 0.02 0.00 0.00 177.57 178.28 1k1s h LEU 191 N -0.38 0.00 -0.12 2.57 5.85 -1.77 -2.50 115.31 118.97 1k1s h LEU 191 Ca -0.08 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.51 1k1s h LEU 191 Cb 1.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.36 1k1s h LEU 191 CO 0.10 0.20 -0.45 0.00 -0.34 0.00 0.00 178.44 177.95 1k1s h ALA 192 N 1.80 0.22 -0.12 1.25 0.00 -1.34 -1.70 119.26 119.38 1k1s h ALA 192 Ca -0.00 -0.48 0.03 0.00 0.00 0.00 0.00 54.91 54.46 1k1s h ALA 192 Cb 0.44 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1k1s h ALA 192 CO 0.03 0.36 -0.07 0.00 0.00 0.00 0.00 179.25 179.56 1k1s h ARG 193 N 0.12 -0.07 -0.94 0.00 3.08 -1.27 0.16 114.38 115.47 1k1s h ARG 193 Ca -0.02 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.07 1k1s h ARG 193 Cb 1.08 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 31.09 1k1s h ARG 193 CO 0.09 -0.04 0.61 -0.09 -1.07 0.00 0.00 179.97 179.47 1k1s h ARG 194 N -0.07 1.13 -0.53 0.04 9.65 -1.47 0.76 114.38 123.89 1k1s h ARG 194 Ca 0.07 -0.07 -0.03 0.00 -1.10 0.00 0.00 59.98 58.86 1k1s h ARG 194 Cb 0.17 -0.25 -0.02 0.00 -1.39 0.00 0.00 29.97 28.48 1k1s h ARG 194 CO -0.16 0.74 0.23 -0.07 2.80 0.00 0.00 179.97 183.51 1k1s h LEU 195 N 1.16 0.71 -1.26 3.80 3.38 -0.47 -0.85 115.31 121.78 1k1s h LEU 195 Ca 0.38 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 1k1s h LEU 195 Cb 0.04 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1k1s h LEU 195 CO -0.13 0.67 0.09 0.78 0.09 0.00 0.00 178.44 179.93 1k1s h ASN 196 N 0.71 0.55 0.40 -0.43 2.35 0.20 0.81 115.58 120.17 1k1s h ASN 196 Ca 0.18 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.77 1k1s h ASN 196 Cb 0.16 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1k1s h ASN 196 CO -0.02 0.56 -0.38 -0.33 -1.65 0.00 0.00 177.43 175.61 1k1s h GLU 197 N 0.58 0.00 -0.09 0.81 5.08 -0.19 -2.66 114.58 118.11 1k1s h GLU 197 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1k1s h GLU 197 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1k1s h GLU 197 CO -0.00 0.38 0.00 1.28 -1.00 0.00 0.00 179.01 179.67 1k1s n LEU 198 N -4.05 1.39 0.00 1.33 4.77 -0.39 -4.91 117.00 115.13 1k1s n LEU 198 Ca -0.02 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 1k1s n LEU 198 Cb 0.42 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1k1s n LEU 198 CO 0.39 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 1k1s n GLY 199 N 1.11 0.48 3.43 -0.72 0.00 -0.86 -5.04 105.19 103.59 1k1s n GLY 199 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 1k1s n GLY 199 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k1s s ILE 200 N -2.02 4.53 -0.22 -0.61 -1.09 0.14 -4.81 121.20 117.11 1k1s s ILE 200 Ca 0.00 -0.58 -0.05 0.00 -2.23 0.00 0.00 60.65 57.79 1k1s s ILE 200 Cb 0.00 -4.60 -0.12 0.00 -1.58 0.00 0.00 42.46 36.16 1k1s s ILE 200 CO 0.00 -1.30 -0.24 0.00 -1.23 0.00 0.00 174.94 172.17 1k1s n GLN 201 N 7.14 0.51 -4.21 2.79 1.13 -1.26 -3.21 117.38 120.27 1k1s n GLN 201 Ca -0.06 0.17 -0.23 0.00 -1.94 0.00 0.00 57.00 54.94 1k1s n GLN 201 Cb 0.44 -1.37 -0.06 0.00 0.11 0.00 0.00 30.24 29.36 1k1s n GLN 201 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1k1s s LYS 202 N -2.42 2.58 0.49 -1.09 -0.14 -1.26 -2.14 119.74 115.76 1k1s s LYS 202 Ca -0.30 -1.22 0.15 0.00 -1.36 0.00 0.00 55.97 53.24 1k1s s LYS 202 Cb 0.10 -2.36 1.17 0.00 -1.68 0.00 0.00 37.83 35.06 1k1s s LYS 202 CO 0.45 0.39 2.10 1.25 -0.76 0.00 0.00 175.35 178.78 1k1s h LEU 203 N 1.82 0.03 -1.34 3.17 5.85 -0.26 -1.76 115.31 122.82 1k1s h LEU 203 Ca -0.46 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.20 1k1s h LEU 203 Cb 1.24 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 1k1s h LEU 203 CO 0.60 0.07 -0.26 0.08 -0.34 0.00 0.00 178.44 178.60 1k1s h ARG 204 N 0.04 0.00 0.00 1.25 0.11 -1.76 -2.49 114.38 111.52 1k1s h ARG 204 Ca 0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.09 1k1s h ARG 204 Cb 0.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.16 1k1s h ARG 204 CO 0.00 0.26 0.00 -0.25 0.10 0.00 0.00 179.97 180.08 1k1s n ASP 205 N -3.62 0.25 0.09 0.08 8.00 -0.66 -0.43 116.55 120.26 1k1s n ASP 205 Ca -0.01 0.61 -0.06 0.00 0.71 0.00 0.00 54.79 56.04 1k1s n ASP 205 Cb 0.39 -0.65 0.05 0.00 -0.02 0.00 0.00 41.12 40.89 1k1s n ASP 205 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1k1s h ILE 206 N 0.00 1.46 -0.16 0.53 2.04 -1.60 -3.08 117.51 116.71 1k1s h ILE 206 Ca 0.00 -2.38 -0.09 0.00 1.00 0.00 0.00 64.86 63.38 1k1s h ILE 206 Cb 0.02 2.29 -0.05 0.00 -0.74 0.00 0.00 36.82 38.34 1k1s h ILE 206 CO 0.00 0.69 0.12 0.18 0.00 0.00 0.00 178.15 179.15 1k1s n LEU 207 N -3.73 4.71 -2.70 1.44 4.77 0.42 -3.51 117.00 118.40 1k1s n LEU 207 Ca -0.03 -2.29 -0.07 0.00 -0.03 0.00 0.00 56.01 53.60 1k1s n LEU 207 Cb 0.72 -0.84 0.12 0.00 -2.33 0.00 0.00 43.42 41.09 1k1s n LEU 207 CO 0.46 0.85 0.48 -0.24 -1.33 0.00 0.00 177.39 177.61 1k1s n SER 208 N 0.70 -1.71 -3.64 -1.43 2.88 -1.16 -5.12 113.62 104.14 1k1s n SER 208 Ca 0.10 -2.46 -0.05 0.00 -1.33 0.00 0.00 58.87 55.13 1k1s n SER 208 Cb 0.60 0.92 -0.07 0.00 -0.75 0.00 0.00 64.21 64.91 1k1s n SER 208 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1k1s s LYS 209 N 0.02 0.34 0.10 -1.46 2.20 -1.23 -5.04 119.74 114.66 1k1s s LYS 209 Ca 0.22 0.47 -0.36 0.00 -0.36 0.00 0.00 55.97 55.93 1k1s s LYS 209 Cb 0.41 0.13 -0.17 0.00 -1.51 0.00 0.00 37.83 36.69 1k1s s LYS 209 CO -0.09 -0.05 1.33 -1.71 -0.36 0.00 0.00 175.35 174.48 1k1s n ASN 210 N 2.63 1.67 -0.28 1.43 5.15 -1.26 -4.86 115.26 119.74 1k1s n ASN 210 Ca -0.14 1.12 -0.04 0.00 -0.60 0.00 0.00 54.58 54.91 1k1s n ASN 210 Cb 0.57 -1.20 0.07 0.00 -0.53 0.00 0.00 39.78 38.68 1k1s n ASN 210 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1k1s h TYR 211 N 4.49 0.95 -0.41 1.20 3.20 -1.98 -1.57 116.97 122.86 1k1s h TYR 211 Ca -0.47 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.35 1k1s h TYR 211 Cb 1.33 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 39.26 1k1s h TYR 211 CO 0.59 0.59 -0.03 -0.91 -1.64 0.00 0.00 178.16 176.77 1k1s h ASN 212 N 1.02 0.64 0.93 -2.11 2.35 -1.99 0.16 115.58 116.58 1k1s h ASN 212 Ca 0.28 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1k1s h ASN 212 Cb -0.10 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.10 1k1s h ASN 212 CO -0.07 0.72 0.00 -0.08 -1.65 0.00 0.00 177.43 176.36 1k1s h GLU 213 N 0.63 0.00 0.01 0.81 4.81 -1.75 -2.64 114.58 116.45 1k1s h GLU 213 Ca 0.12 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 59.03 1k1s h GLU 213 Cb 0.43 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.76 1k1s h GLU 213 CO 0.02 0.00 -1.92 -0.11 -0.73 0.00 0.00 179.01 176.27 1k1s n LEU 214 N -2.85 0.91 -0.10 1.64 0.00 -0.26 -4.31 117.00 112.03 1k1s n LEU 214 Ca 0.01 0.28 -0.12 0.00 0.00 0.00 0.00 56.01 56.18 1k1s n LEU 214 Cb 0.28 0.09 -0.00 0.00 0.00 0.00 0.00 43.42 43.78 1k1s n LEU 214 CO 0.25 0.48 0.54 -0.33 0.00 0.00 0.00 177.39 178.32 1k1s h GLU 215 N 0.01 0.87 -0.22 1.96 5.08 -0.43 -1.52 114.58 120.34 1k1s h GLU 215 Ca -0.37 -0.47 0.00 0.00 -1.00 0.00 0.00 59.36 57.52 1k1s h GLU 215 Cb 2.07 0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.34 1k1s h GLU 215 CO 0.06 1.12 0.00 0.36 -1.00 0.00 0.00 179.01 179.55 1k1s n LYS 216 N -4.04 0.49 0.00 2.33 2.85 -1.02 -0.06 118.16 118.70 1k1s n LYS 216 Ca -0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.24 1k1s n LYS 216 Cb 0.56 -1.11 0.00 0.00 -0.65 0.00 0.00 35.03 33.83 1k1s n LYS 216 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 1k1s n ILE 217 N -0.16 0.00 -0.10 0.58 5.41 -1.15 -4.94 119.36 119.00 1k1s n ILE 217 Ca 0.00 0.00 -0.19 0.00 1.00 0.00 0.00 62.75 63.56 1k1s n ILE 217 Cb 0.05 -0.65 -0.09 0.00 -0.71 0.00 0.00 39.64 38.24 1k1s n ILE 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1k1s n THR 218 N -2.42 1.51 0.00 1.39 -1.04 -0.58 -5.08 114.28 108.06 1k1s n THR 218 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1k1s n THR 218 Cb 0.19 -2.10 0.00 0.00 -1.82 0.00 0.00 70.33 66.60 1k1s n THR 218 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1k1s n GLY 219 N 1.44 2.96 0.30 3.41 0.00 0.91 -4.61 105.19 109.60 1k1s n GLY 219 Ca -0.30 -1.72 0.04 0.00 0.00 0.00 0.00 46.02 44.03 1k1s n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k1s h LYS 220 N 0.00 0.02 0.00 1.61 1.57 -1.95 0.12 116.57 117.93 1k1s h LYS 220 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1k1s h LYS 220 Cb 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1k1s h LYS 220 CO 0.00 0.01 0.00 0.00 -0.57 0.00 0.00 179.45 178.89 1k1s n ALA 221 N -3.26 -0.34 0.28 3.86 0.00 -1.26 -1.92 120.51 117.86 1k1s n ALA 221 Ca 0.13 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.72 1k1s n ALA 221 Cb 0.44 0.15 0.82 0.00 0.00 0.00 0.00 19.45 20.86 1k1s n ALA 221 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1k1s h LYS 222 N 0.00 0.00 -0.05 0.00 1.57 -1.76 -2.25 116.57 114.09 1k1s h LYS 222 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1k1s h LYS 222 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1k1s h LYS 222 CO 0.00 0.08 -0.07 0.00 -0.57 0.00 0.00 179.45 178.88 1k1s h ALA 223 N 1.92 0.07 -0.88 3.86 0.00 -0.70 -0.31 119.26 123.23 1k1s h ALA 223 Ca -0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1k1s h ALA 223 Cb 0.27 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1k1s h ALA 223 CO 0.01 -0.10 0.49 -0.07 0.00 0.00 0.00 179.25 179.59 1k1s h LEU 224 N -0.36 1.09 -0.05 0.00 3.38 -1.21 0.32 115.31 118.48 1k1s h LEU 224 Ca 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1k1s h LEU 224 Cb 0.62 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 1k1s h LEU 224 CO 0.02 0.87 0.03 0.22 0.09 0.00 0.00 178.44 179.66 1k1s h TYR 225 N 1.22 0.06 -0.41 1.13 3.20 -1.35 -0.77 116.97 120.06 1k1s h TYR 225 Ca 0.31 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 62.12 1k1s h TYR 225 Cb 0.01 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1k1s h TYR 225 CO 0.01 0.07 -0.00 -0.07 -1.64 0.00 0.00 178.16 176.52 1k1s h LEU 226 N 0.04 0.70 -0.55 2.82 3.38 -0.72 -0.12 115.31 120.86 1k1s h LEU 226 Ca 0.02 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 1k1s h LEU 226 Cb 0.02 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1k1s h LEU 226 CO -0.00 0.84 0.23 0.25 0.09 0.00 0.00 178.44 179.85 1k1s h LEU 227 N 0.55 0.75 -0.21 1.67 6.46 -0.86 -1.02 115.31 122.64 1k1s h LEU 227 Ca 0.11 -0.16 -0.06 0.00 -0.12 0.00 0.00 57.88 57.66 1k1s h LEU 227 Cb 0.48 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.21 1k1s h LEU 227 CO 0.02 0.71 -0.09 0.11 -0.62 0.00 0.00 178.44 178.57 1k1s h LYS 228 N 0.75 0.43 -0.26 1.25 1.57 -1.09 -2.94 116.57 116.28 1k1s h LYS 228 Ca 0.19 -0.18 0.07 0.00 -1.87 0.00 0.00 60.65 58.86 1k1s h LYS 228 Cb 0.18 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1k1s h LYS 228 CO -0.02 0.70 0.19 1.25 -0.57 0.00 0.00 179.45 181.01 1k1s h LEU 229 N 0.13 0.00 0.00 2.94 5.85 -0.81 0.43 115.31 123.86 1k1s h LEU 229 Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1k1s h LEU 229 Cb 0.57 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1k1s h LEU 229 CO 0.03 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.13 1k1s n ALA 230 N -2.56 2.62 -0.22 1.25 0.00 -0.41 -2.91 120.51 118.28 1k1s n ALA 230 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1k1s n ALA 230 Cb 0.34 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1k1s n ALA 230 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1k1s n GLN 231 N -1.00 1.72 -1.59 0.00 6.02 0.11 -4.96 117.38 117.68 1k1s n GLN 231 Ca 0.23 -0.11 -0.10 0.00 -0.01 0.00 0.00 57.00 57.00 1k1s n GLN 231 Cb 0.11 -0.47 -0.03 0.00 1.02 0.00 0.00 30.24 30.86 1k1s n GLN 231 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1k1s n ASN 232 N -0.28 -3.93 -0.68 1.08 5.15 0.11 -4.88 115.26 111.83 1k1s n ASN 232 Ca 0.00 0.16 0.04 0.00 -0.60 0.00 0.00 54.58 54.19 1k1s n ASN 232 Cb 0.06 -2.60 0.14 0.00 -0.53 0.00 0.00 39.78 36.85 1k1s n ASN 232 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1k1s n LYS 233 N -2.46 1.92 -2.08 1.20 5.02 -0.69 -4.12 118.16 116.94 1k1s n LYS 233 Ca -0.11 -1.13 -0.37 0.00 -2.02 0.00 0.00 58.31 54.69 1k1s n LYS 233 Cb 0.42 -1.38 0.03 0.00 -0.02 0.00 0.00 35.03 34.07 1k1s n LYS 233 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1k1s n TYR 234 N 0.34 3.09 -3.33 2.13 9.36 -1.26 -4.89 117.16 122.61 1k1s n TYR 234 Ca 0.10 -2.53 -0.44 0.00 3.32 0.00 0.00 57.90 58.35 1k1s n TYR 234 Cb 0.35 -0.92 -0.00 0.00 -0.63 0.00 0.00 39.34 38.14 1k1s n TYR 234 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1k1s n SER 235 N -0.51 5.53 -4.74 2.98 7.64 -1.26 -4.76 113.62 118.50 1k1s n SER 235 Ca 0.50 -3.08 -0.41 0.00 1.01 0.00 0.00 58.87 56.90 1k1s n SER 235 Cb 0.34 -1.35 -0.05 0.00 -1.01 0.00 0.00 64.21 62.13 1k1s n SER 235 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1k1s s GLU 236 N -1.43 4.74 0.84 1.43 -1.05 -1.26 -5.03 118.70 116.94 1k1s s GLU 236 Ca 0.31 1.43 -0.11 0.00 -0.15 0.00 0.00 54.97 56.44 1k1s s GLU 236 Cb -0.09 -3.33 0.10 0.00 -0.44 0.00 0.00 34.13 30.37 1k1s s GLU 236 CO -0.07 0.35 1.14 -2.14 0.95 0.00 0.00 175.26 175.49 1k1s s PRO 237 N -0.49 1.55 -0.65 -4.83 0.02 -1.26 -4.62 135.00 124.72 1k1s s PRO 237 Ca 0.44 1.49 -0.24 0.00 0.02 0.00 0.00 61.00 62.71 1k1s s PRO 237 Cb -0.24 -1.79 0.06 0.00 0.02 0.00 0.00 34.50 32.54 1k1s s PRO 237 CO 0.30 -2.23 1.01 0.08 -0.33 0.00 0.00 177.00 175.83 1k1s s VAL 238 N -2.59 4.23 0.34 3.83 1.01 -1.26 -5.01 120.40 120.96 1k1s s VAL 238 Ca 0.67 -0.06 -0.28 0.00 0.00 0.00 0.00 61.98 62.31 1k1s s VAL 238 Cb -0.22 -4.69 -0.10 0.00 0.00 0.00 0.00 36.38 31.37 1k1s s VAL 238 CO 0.55 -1.44 1.26 -1.61 0.00 0.00 0.00 175.10 173.86 1k1s s GLU 239 N 4.33 4.31 -1.20 2.72 2.02 -1.26 -4.77 118.70 124.85 1k1s s GLU 239 Ca 0.27 2.10 -0.13 0.00 0.02 0.00 0.00 54.97 57.23 1k1s s GLU 239 Cb -0.14 -3.00 0.19 0.00 0.10 0.00 0.00 34.13 31.28 1k1s s GLU 239 CO 0.13 -0.19 1.41 -1.71 0.02 0.00 0.00 175.26 174.93 1k1s n ASN 240 N 0.68 5.28 -3.14 -0.19 2.85 -1.26 -3.56 115.26 115.92 1k1s n ASN 240 Ca 0.01 -3.00 -0.15 0.00 -0.11 0.00 0.00 54.58 51.33 1k1s n ASN 240 Cb 0.43 -1.53 -0.03 0.00 1.24 0.00 0.00 39.78 39.89 1k1s n ASN 240 CO 0.00 0.00 0.00 -1.59 -2.11 0.00 0.00 177.26 173.56 1k1s s LYS 241 N 0.97 1.98 -0.05 1.20 -2.85 -1.03 -2.01 119.74 117.96 1k1s s LYS 241 Ca 0.41 -1.76 0.02 0.00 -1.00 0.00 0.00 55.97 53.63 1k1s s LYS 241 Cb -0.03 0.46 0.01 0.00 -2.06 0.00 0.00 37.83 36.21 1k1s s LYS 241 CO -0.01 -0.83 -0.09 0.45 0.10 0.00 0.00 175.35 174.97 1k1s s SER 242 N -3.24 1.34 -0.22 0.03 0.15 -0.25 -1.35 113.70 110.17 1k1s s SER 242 Ca 0.29 -0.21 0.15 0.00 0.70 0.00 0.00 55.95 56.88 1k1s s SER 242 Cb -0.01 -0.56 0.79 0.00 -1.71 0.00 0.00 66.02 64.53 1k1s s SER 242 CO 0.20 0.02 1.71 0.29 1.20 0.00 0.00 173.24 176.66 1k1s n LYS 243 N 3.72 4.60 -3.08 5.44 5.02 -0.18 -1.55 118.16 132.13 1k1s n LYS 243 Ca -0.22 -3.11 -0.41 0.00 -2.02 0.00 0.00 58.31 52.54 1k1s n LYS 243 Cb 0.52 -2.19 -0.06 0.00 -0.02 0.00 0.00 35.03 33.28 1k1s n LYS 243 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1k1s s ILE 244 N -2.66 4.90 0.79 -0.18 1.01 -1.26 -4.76 121.20 119.04 1k1s s ILE 244 Ca 0.53 0.83 -0.13 0.00 0.00 0.00 0.00 60.65 61.88 1k1s s ILE 244 Cb 0.40 -4.05 0.07 0.00 0.01 0.00 0.00 42.46 38.89 1k1s s ILE 244 CO 0.16 -0.21 1.19 -2.84 0.00 0.00 0.00 174.94 173.24 1k1s s PRO 245 N 2.70 1.80 -0.23 2.79 0.02 -1.26 -4.78 135.00 136.04 1k1s s PRO 245 Ca 0.26 1.68 -0.13 0.00 0.02 0.00 0.00 61.00 62.83 1k1s s PRO 245 Cb -0.15 -1.80 0.07 0.00 0.02 0.00 0.00 34.50 32.64 1k1s s PRO 245 CO 0.13 -2.07 0.56 -1.01 -0.33 0.00 0.00 177.00 174.28 1k1s s HIS 246 N -2.22 -0.87 -0.20 6.54 3.76 -0.60 -5.00 115.29 116.71 1k1s s HIS 246 Ca 0.72 1.76 -0.22 0.00 -0.15 0.00 0.00 55.06 57.17 1k1s s HIS 246 Cb -0.27 0.48 0.06 0.00 1.11 0.00 0.00 32.58 33.96 1k1s s HIS 246 CO 0.50 -0.45 0.61 0.20 -0.85 0.00 0.00 174.74 174.74 1k1s s GLY 247 N 1.59 -0.46 -0.17 -2.22 0.00 -1.25 0.32 107.32 105.13 1k1s s GLY 247 Ca -0.10 1.62 -0.04 0.00 0.00 0.00 0.00 44.72 46.21 1k1s s GLY 247 CO -0.17 1.37 -0.02 -1.60 0.00 0.00 0.00 173.10 172.68 1k1s s ARG 248 N 0.07 3.65 0.15 2.90 6.06 -0.89 -4.89 118.95 126.01 1k1s s ARG 248 Ca -0.02 -0.52 0.05 0.00 -2.50 0.00 0.00 55.73 52.74 1k1s s ARG 248 Cb -0.04 -2.98 -0.04 0.00 0.06 0.00 0.00 34.95 31.96 1k1s s ARG 248 CO 0.02 0.16 0.09 0.71 -2.50 0.00 0.00 175.30 173.77 1k1s s TYR 249 N 0.60 3.08 -0.02 5.12 1.51 -1.26 -2.05 117.35 124.33 1k1s s TYR 249 Ca -0.02 -0.03 -0.04 0.00 -1.01 0.00 0.00 57.07 55.98 1k1s s TYR 249 Cb -0.14 -1.50 0.00 0.00 -0.11 0.00 0.00 41.96 40.21 1k1s s TYR 249 CO 0.02 0.52 0.08 -0.51 -1.11 0.00 0.00 175.55 174.55 1k1s s LEU 250 N -2.90 1.71 -0.15 -1.29 1.43 -0.08 -4.93 118.68 112.47 1k1s s LEU 250 Ca 0.30 0.03 -0.11 0.00 -1.03 0.00 0.00 54.13 53.31 1k1s s LEU 250 Cb -0.10 0.35 -0.05 0.00 0.03 0.00 0.00 46.19 46.42 1k1s s LEU 250 CO 0.22 -0.13 0.22 -0.89 0.23 0.00 0.00 176.35 176.00 1k1s s THR 251 N -0.40 5.35 0.66 5.49 2.01 -1.26 -0.14 115.64 127.35 1k1s s THR 251 Ca -0.05 0.40 -0.13 0.00 0.31 0.00 0.00 61.69 62.22 1k1s s THR 251 Cb -0.03 -3.54 -0.00 0.00 0.01 0.00 0.00 72.50 68.93 1k1s s THR 251 CO 0.00 0.47 1.07 -0.76 -0.69 0.00 0.00 174.62 174.71 1k1s s LEU 252 N 0.01 3.30 0.10 4.42 1.43 -0.91 -4.90 118.68 122.13 1k1s s LEU 252 Ca 0.14 1.78 0.07 0.00 -1.03 0.00 0.00 54.13 55.09 1k1s s LEU 252 Cb -0.12 -4.52 0.38 0.00 0.03 0.00 0.00 46.19 41.95 1k1s s LEU 252 CO 0.03 -1.44 1.21 -0.81 0.23 0.00 0.00 176.35 175.57 1k1s n PRO 253 N -2.64 0.04 0.00 1.29 -0.04 -1.26 -4.59 135.00 127.80 1k1s n PRO 253 Ca 0.09 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 1k1s n PRO 253 Cb 0.53 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 1k1s n PRO 253 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1k1s n TYR 254 N -1.74 0.00 -2.38 0.54 0.18 -1.26 -5.14 117.16 107.35 1k1s n TYR 254 Ca -0.00 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.35 1k1s n TYR 254 Cb 0.01 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 38.94 1k1s n TYR 254 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1k1s s ASN 255 N 0.00 7.01 0.00 9.48 6.03 -1.26 -4.97 114.94 131.24 1k1s s ASN 255 Ca 0.00 1.98 0.00 0.00 -1.03 0.00 0.00 52.86 53.81 1k1s s ASN 255 Cb 0.00 -2.57 0.00 0.00 -3.03 0.00 0.00 41.25 35.65 1k1s s ASN 255 CO 0.00 -0.56 0.00 0.35 -2.03 0.00 0.00 177.10 174.86 1k1s n THR 256 N 4.29 0.00 -1.32 0.54 -2.24 -1.10 -4.72 114.28 109.73 1k1s n THR 256 Ca 0.10 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.91 1k1s n THR 256 Cb 0.46 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.72 1k1s n THR 256 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1k1s n ARG 257 N 0.00 0.66 -2.58 -0.78 1.85 -1.26 0.59 116.66 115.15 1k1s n ARG 257 Ca 0.00 -1.32 -0.42 0.00 -1.00 0.00 0.00 57.85 55.11 1k1s n ARG 257 Cb 0.00 -0.79 -0.02 0.00 -1.05 0.00 0.00 32.46 30.59 1k1s n ARG 257 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1k1s s ASP 258 N -1.22 6.50 0.42 2.89 -1.08 -1.26 -4.89 116.67 118.03 1k1s s ASP 258 Ca 0.07 0.24 0.15 0.00 -0.52 0.00 0.00 52.55 52.49 1k1s s ASP 258 Cb 0.07 -2.55 1.03 0.00 -1.46 0.00 0.00 42.92 40.00 1k1s s ASP 258 CO 0.01 -1.42 1.91 0.58 0.52 0.00 0.00 175.17 176.77 1k1s h VAL 259 N 6.20 0.80 -0.02 1.11 2.07 -1.97 0.20 116.25 124.63 1k1s h VAL 259 Ca -0.24 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 1k1s h VAL 259 Cb 1.06 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1k1s h VAL 259 CO 1.17 0.08 -0.03 0.11 0.02 0.00 0.00 177.57 178.92 1k1s h LYS 260 N 0.45 0.02 0.06 1.57 1.57 -2.00 0.15 116.57 118.39 1k1s h LYS 260 Ca 0.38 -0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.80 1k1s h LYS 260 Cb 0.84 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.11 1k1s h LYS 260 CO -0.13 0.06 -2.02 0.28 -0.57 0.00 0.00 179.45 177.06 1k1s n VAL 261 N -4.49 1.65 0.04 0.50 0.31 -0.11 -4.35 118.33 111.88 1k1s n VAL 261 Ca -0.03 -0.49 -0.13 0.00 -0.01 0.00 0.00 64.34 63.68 1k1s n VAL 261 Cb 0.12 -1.74 -0.09 0.00 -0.91 0.00 0.00 33.84 31.23 1k1s n VAL 261 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1k1s h ILE 262 N -0.25 1.12 -0.62 2.52 2.04 -0.99 -3.31 117.51 118.03 1k1s h ILE 262 Ca -0.47 -0.64 0.13 0.00 1.00 0.00 0.00 64.86 64.87 1k1s h ILE 262 Cb 1.83 1.54 -0.12 0.00 -0.74 0.00 0.00 36.82 39.33 1k1s h ILE 262 CO -0.06 0.16 -0.13 0.25 0.00 0.00 0.00 178.15 178.37 1k1s h LEU 263 N -0.37 -0.53 -0.99 1.44 5.85 -0.94 -0.39 115.31 119.38 1k1s h LEU 263 Ca -0.01 0.18 0.21 0.00 0.84 0.00 0.00 57.88 59.10 1k1s h LEU 263 Cb 0.33 0.37 -0.11 0.00 0.37 0.00 0.00 40.66 41.61 1k1s h LEU 263 CO 0.01 -0.19 0.58 -0.65 -0.34 0.00 0.00 178.44 177.85 1k1s h PRO 264 N 0.02 0.65 0.03 5.25 0.11 -1.76 0.66 132.00 136.96 1k1s h PRO 264 Ca 0.30 -0.04 -0.22 0.00 0.11 0.00 0.00 66.00 66.15 1k1s h PRO 264 Cb 0.47 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 1k1s h PRO 264 CO -0.63 0.43 -0.99 1.88 -0.21 0.00 0.00 178.00 178.49 1k1s h TYR 265 N 0.67 0.38 -0.36 0.65 0.05 -1.32 -2.99 116.97 114.05 1k1s h TYR 265 Ca 0.59 -0.23 -0.04 0.00 0.05 0.00 0.00 58.73 59.10 1k1s h TYR 265 Cb 1.00 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 38.68 1k1s h TYR 265 CO -0.02 1.09 0.07 1.25 -1.05 0.00 0.00 178.16 179.49 1k1s h LEU 266 N 0.12 0.49 -0.57 3.88 5.85 0.62 -0.55 115.31 125.15 1k1s h LEU 266 Ca -0.07 -0.07 -0.16 0.00 0.84 0.00 0.00 57.88 58.42 1k1s h LEU 266 Cb 1.65 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.54 1k1s h LEU 266 CO 0.16 0.51 -0.70 0.11 -0.34 0.00 0.00 178.44 178.18 1k1s h LYS 267 N 0.52 0.12 -0.16 1.25 1.57 -1.08 -2.22 116.57 116.56 1k1s h LYS 267 Ca 0.12 -0.10 -0.18 0.00 -1.87 0.00 0.00 60.65 58.63 1k1s h LYS 267 Cb 0.24 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 1k1s h LYS 267 CO -0.00 0.76 -0.62 -0.22 -0.57 0.00 0.00 179.45 178.81 1k1s h LYS 268 N 0.08 0.57 -0.43 3.15 3.64 -1.22 -1.42 116.57 120.94 1k1s h LYS 268 Ca -0.01 -0.40 -0.07 0.00 -1.27 0.00 0.00 60.65 58.91 1k1s h LYS 268 Cb 1.24 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 1k1s h LYS 268 CO 0.10 1.01 -0.01 0.00 -2.27 0.00 0.00 179.45 178.29 1k1s h ALA 269 N 0.89 1.19 -0.22 5.00 0.00 -1.02 -1.58 119.26 123.52 1k1s h ALA 269 Ca -0.01 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 1k1s h ALA 269 Cb 1.18 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1k1s h ALA 269 CO 0.12 0.53 0.00 0.82 0.00 0.00 0.00 179.25 180.72 1k1s h ILE 270 N 0.65 1.25 -0.29 0.00 2.04 -1.09 -0.59 117.51 119.49 1k1s h ILE 270 Ca 0.13 -0.88 0.01 0.00 1.00 0.00 0.00 64.86 65.12 1k1s h ILE 270 Cb 0.41 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 1k1s h ILE 270 CO 0.02 0.27 0.16 0.78 0.00 0.00 0.00 178.15 179.38 1k1s h ASN 271 N 0.16 0.27 -0.34 1.72 2.35 -1.00 -0.71 115.58 118.03 1k1s h ASN 271 Ca 0.06 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.72 1k1s h ASN 271 Cb 0.40 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 1k1s h ASN 271 CO 0.01 0.20 -0.10 -0.33 -1.65 0.00 0.00 177.43 175.56 1k1s h GLU 272 N 0.34 0.77 -0.21 0.81 5.08 -1.26 -2.00 114.58 118.11 1k1s h GLU 272 Ca 0.11 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 1k1s h GLU 272 Cb 0.00 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1k1s h GLU 272 CO -0.05 0.84 -0.14 0.00 -1.00 0.00 0.00 179.01 178.66 1k1s h ALA 273 N 1.19 1.39 0.00 3.43 0.00 -0.70 -2.61 119.26 121.96 1k1s h ALA 273 Ca 0.12 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1k1s h ALA 273 Cb 0.57 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1k1s h ALA 273 CO 0.04 0.42 -0.64 1.88 0.00 0.00 0.00 179.25 180.95 1k1s h TYR 274 N 0.32 0.00 -0.14 0.00 -1.99 -0.68 -3.25 116.97 111.23 1k1s h TYR 274 Ca 0.06 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 60.62 1k1s h TYR 274 Cb 0.44 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.16 1k1s h TYR 274 CO 0.01 0.64 -0.61 -0.91 -0.00 0.00 0.00 178.16 177.28 1k1s h ASN 275 N 0.00 0.55 -0.38 3.88 2.35 -1.00 -3.07 115.58 117.91 1k1s h ASN 275 Ca -0.01 -0.31 -0.13 0.00 -0.55 0.00 0.00 56.30 55.30 1k1s h ASN 275 Cb 1.31 -0.16 -0.08 0.00 0.05 0.00 0.00 38.32 39.45 1k1s h ASN 275 CO 0.08 1.03 0.16 2.29 -1.65 0.00 0.00 177.43 179.34 1k1s n LYS 276 N -3.91 2.17 -4.40 0.81 2.85 -1.09 -4.84 118.16 109.75 1k1s n LYS 276 Ca -0.04 -1.44 -0.20 0.00 -1.05 0.00 0.00 58.31 55.59 1k1s n LYS 276 Cb 0.64 -1.70 -0.14 0.00 -0.65 0.00 0.00 35.03 33.18 1k1s n LYS 276 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1k1s s VAL 277 N -1.68 0.94 -0.63 0.58 1.01 -1.16 -5.03 120.40 114.43 1k1s s VAL 277 Ca 0.26 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 1k1s s VAL 277 Cb 0.21 -0.83 0.41 0.00 0.00 0.00 0.00 36.38 36.17 1k1s s VAL 277 CO 0.06 0.11 2.05 0.59 0.00 0.00 0.00 175.10 177.91 1k1s n ASN 278 N 2.38 7.51 0.00 3.32 4.13 -1.26 -4.98 115.26 126.36 1k1s n ASN 278 Ca -0.16 -3.68 0.00 0.00 1.68 0.00 0.00 54.58 52.42 1k1s n ASN 278 Cb 0.56 -1.00 0.00 0.00 -1.54 0.00 0.00 39.78 37.80 1k1s n ASN 278 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1k1s n GLY 279 N -0.69 -2.74 3.68 7.41 0.00 -1.26 -4.55 105.19 107.04 1k1s n GLY 279 Ca 0.57 -1.29 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 1k1s n GLY 279 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1k1s s ILE 280 N -2.00 4.79 0.41 -0.61 -4.36 -1.24 -4.77 121.20 113.42 1k1s s ILE 280 Ca 0.00 1.96 -0.24 0.00 -0.26 0.00 0.00 60.65 62.11 1k1s s ILE 280 Cb 0.00 -4.28 -0.09 0.00 1.25 0.00 0.00 42.46 39.35 1k1s s ILE 280 CO 0.00 -0.01 1.07 -2.84 0.24 0.00 0.00 174.94 173.40 1k1s s PRO 281 N 2.15 4.08 0.00 0.37 0.02 -1.26 -1.17 135.00 139.19 1k1s s PRO 281 Ca 0.46 1.56 0.20 0.00 0.02 0.00 0.00 61.00 63.23 1k1s s PRO 281 Cb -0.18 -2.51 0.13 0.00 0.02 0.00 0.00 34.50 31.97 1k1s s PRO 281 CO 0.16 -0.23 1.10 -1.33 -0.33 0.00 0.00 177.00 176.37 1k1s n MET 282 N -0.17 1.71 -3.76 5.54 2.81 -0.85 -0.93 117.12 121.47 1k1s n MET 282 Ca 0.05 -1.55 -0.13 0.00 -1.81 0.00 0.00 57.70 54.26 1k1s n MET 282 Cb 0.49 -1.37 -0.10 0.00 -0.71 0.00 0.00 33.22 31.53 1k1s n MET 282 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1k1s s ARG 283 N -1.72 0.47 -0.04 0.03 3.52 -1.08 0.23 118.95 120.35 1k1s s ARG 283 Ca 0.22 0.30 0.02 0.00 -0.13 0.00 0.00 55.73 56.14 1k1s s ARG 283 Cb 0.16 0.22 0.01 0.00 -1.56 0.00 0.00 34.95 33.79 1k1s s ARG 283 CO 0.28 -0.08 -0.09 0.42 -0.81 0.00 0.00 175.30 175.02 1k1s s ILE 284 N -0.21 0.84 -0.10 4.11 1.01 -0.05 -2.75 121.20 124.05 1k1s s ILE 284 Ca -0.04 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.29 1k1s s ILE 284 Cb -0.03 -0.78 0.01 0.00 0.01 0.00 0.00 42.46 41.67 1k1s s ILE 284 CO 0.01 0.28 -0.15 -0.89 0.00 0.00 0.00 174.94 174.19 1k1s s THR 285 N 0.53 1.46 -0.31 2.92 2.01 -0.75 -0.67 115.64 120.83 1k1s s THR 285 Ca -0.09 -0.63 -0.16 0.00 0.31 0.00 0.00 61.69 61.12 1k1s s THR 285 Cb -0.13 -1.33 -0.02 0.00 0.01 0.00 0.00 72.50 71.03 1k1s s THR 285 CO 0.01 0.43 0.40 -0.69 -0.69 0.00 0.00 174.62 174.08 1k1s s VAL 286 N 0.89 5.14 -0.15 3.82 1.01 -0.03 -0.68 120.40 130.40 1k1s s VAL 286 Ca -0.09 0.35 -0.05 0.00 0.00 0.00 0.00 61.98 62.20 1k1s s VAL 286 Cb -0.15 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.40 1k1s s VAL 286 CO 0.00 0.00 0.01 -0.63 0.00 0.00 0.00 175.10 174.49 1k1s s ILE 287 N 2.11 4.38 -0.22 2.22 1.09 -0.84 -2.58 121.20 127.37 1k1s s ILE 287 Ca 0.15 -0.19 0.02 0.00 -1.10 0.00 0.00 60.65 59.52 1k1s s ILE 287 Cb -0.16 -2.92 0.05 0.00 -1.06 0.00 0.00 42.46 38.36 1k1s s ILE 287 CO 0.11 0.51 -0.11 0.00 -0.10 0.00 0.00 174.94 175.36 1k1s s ALA 288 N 0.02 2.21 -0.59 9.38 0.00 -0.78 -0.39 121.76 131.63 1k1s s ALA 288 Ca 0.03 -1.42 -0.23 0.00 0.00 0.00 0.00 51.96 50.34 1k1s s ALA 288 Cb -0.13 -1.40 0.05 0.00 0.00 0.00 0.00 23.12 21.65 1k1s s ALA 288 CO 0.02 -0.96 0.92 0.42 0.00 0.00 0.00 175.76 176.16 1k1s s ILE 289 N 1.29 4.40 0.25 0.00 1.01 0.16 -2.59 121.20 125.72 1k1s s ILE 289 Ca -0.04 -0.02 -0.23 0.00 0.00 0.00 0.00 60.65 60.36 1k1s s ILE 289 Cb -0.18 -4.57 -0.09 0.00 0.01 0.00 0.00 42.46 37.63 1k1s s ILE 289 CO -0.07 -1.22 0.81 -0.04 0.00 0.00 0.00 174.94 174.42 1k1s s MET 290 N 3.89 4.44 0.00 2.79 -1.94 -1.04 -0.23 119.30 127.21 1k1s s MET 290 Ca 0.26 1.09 0.00 0.00 -1.71 0.00 0.00 55.69 55.33 1k1s s MET 290 Cb -0.15 -2.93 0.00 0.00 2.01 0.00 0.00 34.83 33.76 1k1s s MET 290 CO 0.15 0.39 0.00 -0.85 -0.01 0.00 0.00 175.02 174.70 1k1s n GLU 291 N 0.85 0.00 -0.21 2.03 0.28 -0.64 0.43 120.64 123.38 1k1s n GLU 291 Ca -0.01 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 57.01 1k1s n GLU 291 Cb 0.50 0.00 0.12 0.00 1.43 0.00 0.00 31.44 33.49 1k1s n GLU 291 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1k1s n ASP 292 N -2.22 1.95 0.00 -1.84 5.75 -1.26 -4.89 116.55 114.03 1k1s n ASP 292 Ca 0.00 -2.16 0.00 0.00 -0.01 0.00 0.00 54.79 52.62 1k1s n ASP 292 Cb 0.00 -0.37 0.00 0.00 -1.03 0.00 0.00 41.12 39.72 1k1s n ASP 292 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1k1s n LEU 293 N 0.20 0.69 -4.80 -2.12 4.32 1.49 -4.98 117.00 111.80 1k1s n LEU 293 Ca 0.08 0.00 -0.34 0.00 -0.02 0.00 0.00 56.01 55.73 1k1s n LEU 293 Cb 0.39 -1.05 -0.05 0.00 -1.62 0.00 0.00 43.42 41.09 1k1s n LEU 293 CO 0.08 -0.35 0.69 1.51 -1.22 0.00 0.00 177.39 178.10 1k1s s ASP 294 N -2.30 6.64 0.33 -1.43 -4.77 -1.22 -4.70 116.67 109.22 1k1s s ASP 294 Ca 0.00 1.86 -0.21 0.00 -3.30 0.00 0.00 52.55 50.90 1k1s s ASP 294 Cb 0.00 -2.56 -0.10 0.00 -1.09 0.00 0.00 42.92 39.18 1k1s s ASP 294 CO 0.00 -0.57 0.85 -0.63 0.70 0.00 0.00 175.17 175.52 1k1s s ILE 295 N -1.99 4.44 -0.28 2.11 1.01 -1.26 -2.50 121.20 122.73 1k1s s ILE 295 Ca 0.63 1.42 0.00 0.00 0.00 0.00 0.00 60.65 62.71 1k1s s ILE 295 Cb -0.15 -3.78 0.15 0.00 0.01 0.00 0.00 42.46 38.69 1k1s s ILE 295 CO 0.19 -0.03 0.38 -0.22 0.00 0.00 0.00 174.94 175.25 1k1s s LEU 296 N -2.53 -0.63 0.33 2.97 2.96 -1.07 -4.98 118.68 115.73 1k1s s LEU 296 Ca 0.52 -0.29 0.03 0.00 -0.22 0.00 0.00 54.13 54.18 1k1s s LEU 296 Cb -0.14 0.98 -0.05 0.00 0.50 0.00 0.00 46.19 47.49 1k1s s LEU 296 CO 0.19 -0.35 0.10 -0.94 -1.32 0.00 0.00 176.35 174.03 1k1s s SER 297 N 2.51 2.07 -0.18 3.68 1.04 -1.26 -1.86 113.70 119.69 1k1s s SER 297 Ca 0.10 -1.48 -0.28 0.00 0.48 0.00 0.00 55.95 54.77 1k1s s SER 297 Cb -0.14 0.19 0.10 0.00 0.10 0.00 0.00 66.02 66.28 1k1s s SER 297 CO -0.27 -0.76 0.88 -0.75 0.98 0.00 0.00 173.24 173.33 1k1s s LYS 298 N -3.87 0.73 0.06 4.02 2.20 -1.06 -5.01 119.74 116.80 1k1s s LYS 298 Ca 0.34 0.40 0.00 0.00 -0.36 0.00 0.00 55.97 56.35 1k1s s LYS 298 Cb 0.06 0.35 -0.00 0.00 -1.51 0.00 0.00 37.83 36.73 1k1s s LYS 298 CO 0.15 -0.18 0.08 0.41 -0.36 0.00 0.00 175.35 175.45 1k1s n GLY 299 N 1.40 3.20 3.34 5.54 0.00 -1.26 -0.85 105.19 116.56 1k1s n GLY 299 Ca -0.14 -1.50 -0.13 0.00 0.00 0.00 0.00 46.02 44.25 1k1s n GLY 299 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k1s s LYS 300 N -2.17 0.54 -0.05 1.61 1.02 0.16 -4.97 119.74 115.88 1k1s s LYS 300 Ca 0.06 0.56 0.01 0.00 0.02 0.00 0.00 55.97 56.62 1k1s s LYS 300 Cb -0.00 0.26 -0.03 0.00 -0.52 0.00 0.00 37.83 37.54 1k1s s LYS 300 CO 0.04 -0.07 -0.04 0.21 -0.92 0.00 0.00 175.35 174.57 1k1s s LYS 301 N 0.11 2.78 0.15 1.68 2.20 -1.26 -0.87 119.74 124.53 1k1s s LYS 301 Ca -0.01 -0.55 0.08 0.00 -0.36 0.00 0.00 55.97 55.13 1k1s s LYS 301 Cb -0.03 -2.64 -0.04 0.00 -1.51 0.00 0.00 37.83 33.61 1k1s s LYS 301 CO 0.01 0.66 -0.18 -0.06 -0.36 0.00 0.00 175.35 175.42 1k1s s PHE 302 N -0.91 1.73 -0.01 4.03 0.40 0.62 -4.95 117.98 118.89 1k1s s PHE 302 Ca 0.15 -0.48 -0.13 0.00 -0.60 0.00 0.00 56.93 55.87 1k1s s PHE 302 Cb -0.11 -0.88 -0.07 0.00 0.51 0.00 0.00 43.02 42.46 1k1s s PHE 302 CO 0.04 0.27 0.74 1.57 0.70 0.00 0.00 175.22 178.55 1k1s h LYS 303 N 3.45 -0.46 -7.51 0.44 -0.00 -1.98 -3.44 116.57 107.07 1k1s h LYS 303 Ca -0.42 0.03 -0.43 0.00 -0.00 0.00 0.00 60.65 59.82 1k1s h LYS 303 Cb 1.20 0.10 0.17 0.00 -0.00 0.00 0.00 32.23 33.70 1k1s h LYS 303 CO 0.49 -0.30 0.24 -1.01 -0.00 0.00 0.00 179.45 178.86 1k1s s HIS 304 N -3.28 1.26 0.66 0.07 3.76 -1.26 -4.97 115.29 111.52 1k1s s HIS 304 Ca -0.07 0.56 -0.13 0.00 -0.15 0.00 0.00 55.06 55.27 1k1s s HIS 304 Cb 0.01 -3.58 -0.00 0.00 1.11 0.00 0.00 32.58 30.11 1k1s s HIS 304 CO 0.21 -3.24 1.07 0.20 -0.85 0.00 0.00 174.74 172.13 1k1s s GLY 305 N -4.11 1.91 -0.44 -2.22 0.00 -1.26 -4.71 107.32 96.49 1k1s s GLY 305 Ca 0.70 0.29 -0.12 0.00 0.00 0.00 0.00 44.72 45.59 1k1s s GLY 305 CO 0.55 0.61 0.31 -0.42 0.00 0.00 0.00 173.10 174.16 1k1s s ILE 306 N -2.70 4.72 0.82 0.90 1.01 -0.11 -4.98 121.20 120.85 1k1s s ILE 306 Ca 0.62 -1.19 -0.13 0.00 0.00 0.00 0.00 60.65 59.95 1k1s s ILE 306 Cb -0.16 -3.82 0.09 0.00 0.01 0.00 0.00 42.46 38.58 1k1s s ILE 306 CO 0.46 -0.51 1.20 -0.44 0.00 0.00 0.00 174.94 175.65 1k1s s SER 307 N 2.26 3.54 0.36 3.58 0.01 -1.26 -4.48 113.70 117.70 1k1s s SER 307 Ca 0.03 2.34 0.03 0.00 1.31 0.00 0.00 55.95 59.67 1k1s s SER 307 Cb -0.23 -2.59 0.67 0.00 0.21 0.00 0.00 66.02 64.08 1k1s s SER 307 CO 0.05 -2.70 1.99 -0.29 0.41 0.00 0.00 173.24 172.69 1k1s h ILE 308 N -1.01 1.16 -0.02 1.44 6.09 -1.98 0.12 117.51 123.31 1k1s h ILE 308 Ca -0.46 -0.39 -0.11 0.00 -1.37 0.00 0.00 64.86 62.53 1k1s h ILE 308 Cb 1.29 0.44 -0.01 0.00 0.47 0.00 0.00 36.82 39.01 1k1s h ILE 308 CO 0.46 0.17 -0.51 -2.24 -3.07 0.00 0.00 178.15 172.96 1k1s h ASP 309 N 0.73 0.05 0.60 2.19 2.03 -2.01 -2.47 116.42 117.54 1k1s h ASP 309 Ca 0.19 -0.03 -0.22 0.00 -0.73 0.00 0.00 57.03 56.25 1k1s h ASP 309 Cb 0.01 -0.01 -0.01 0.00 -0.83 0.00 0.00 39.33 38.48 1k1s h ASP 309 CO -0.03 0.56 -0.97 0.78 -1.03 0.00 0.00 179.24 178.55 1k1s h ASN 310 N 0.04 0.30 -0.68 4.15 2.35 -1.64 -3.23 115.58 116.87 1k1s h ASN 310 Ca -0.00 -0.26 0.05 0.00 -0.55 0.00 0.00 56.30 55.53 1k1s h ASN 310 Cb 0.92 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 39.15 1k1s h ASN 310 CO 0.07 1.10 0.40 0.00 -1.65 0.00 0.00 177.43 177.35 1k1s h ALA 311 N 0.87 0.91 -0.45 -0.83 0.00 -0.36 0.76 119.26 120.16 1k1s h ALA 311 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1k1s h ALA 311 Cb 1.63 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 1k1s h ALA 311 CO 0.15 0.11 0.29 1.88 0.00 0.00 0.00 179.25 181.68 1k1s h TYR 312 N 0.75 0.58 0.63 0.00 0.99 -1.47 0.14 116.97 118.59 1k1s h TYR 312 Ca 0.30 0.01 -0.03 0.00 2.00 0.00 0.00 58.73 61.00 1k1s h TYR 312 Cb 0.13 -0.19 0.01 0.00 1.00 0.00 0.00 36.73 37.67 1k1s h TYR 312 CO -0.06 0.38 -0.30 -0.22 -0.00 0.00 0.00 178.16 177.95 1k1s h LYS 313 N 0.61 -0.82 -0.55 4.88 3.11 -1.43 -1.80 116.57 120.56 1k1s h LYS 313 Ca 0.16 0.06 0.07 0.00 -2.81 0.00 0.00 60.65 58.13 1k1s h LYS 313 Cb -0.05 0.19 -0.06 0.00 -1.00 0.00 0.00 32.23 31.31 1k1s h LYS 313 CO -0.03 -0.50 0.23 0.28 -2.81 0.00 0.00 179.45 176.62 1k1s h VAL 314 N -1.10 0.86 -0.52 2.00 2.07 -0.86 -2.35 116.25 116.35 1k1s h VAL 314 Ca -0.09 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.31 1k1s h VAL 314 Cb 0.69 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 1k1s h VAL 314 CO 0.14 0.08 0.30 0.00 0.02 0.00 0.00 177.57 178.12 1k1s h ALA 315 N 1.35 0.66 -0.72 1.67 0.00 -0.73 -1.41 119.26 120.07 1k1s h ALA 315 Ca 0.26 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.19 1k1s h ALA 315 Cb 0.26 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1k1s h ALA 315 CO -0.24 0.00 0.46 1.49 0.00 0.00 0.00 179.25 180.97 1k1s h GLU 316 N 0.60 0.89 -0.63 0.00 4.81 -0.82 0.29 114.58 119.72 1k1s h GLU 316 Ca 0.21 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.30 1k1s h GLU 316 Cb 0.04 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 1k1s h GLU 316 CO -0.10 0.59 0.05 -0.44 -0.73 0.00 0.00 179.01 178.37 1k1s h ASP 317 N 0.91 1.04 -0.63 1.04 3.32 -1.08 -0.38 116.42 120.65 1k1s h ASP 317 Ca 0.28 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 1k1s h ASP 317 Cb -0.01 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.23 1k1s h ASP 317 CO -0.10 1.07 0.22 -0.07 -1.72 0.00 0.00 179.24 178.64 1k1s h LEU 318 N 0.99 0.92 -0.48 1.55 3.38 -0.66 -1.32 115.31 119.69 1k1s h LEU 318 Ca 0.19 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1k1s h LEU 318 Cb 0.50 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1k1s h LEU 318 CO 0.02 0.85 0.01 0.25 0.09 0.00 0.00 178.44 179.66 1k1s h LEU 319 N 0.96 0.82 0.59 1.67 7.12 -0.52 -2.40 115.31 123.56 1k1s h LEU 319 Ca 0.22 -0.30 -0.02 0.00 0.13 0.00 0.00 57.88 57.91 1k1s h LEU 319 Cb 0.25 -0.22 -0.02 0.00 -0.53 0.00 0.00 40.66 40.14 1k1s h LEU 319 CO -0.01 0.92 -0.49 0.03 -0.13 0.00 0.00 178.44 178.76 1k1s h ARG 320 N 0.69 -1.02 -0.51 1.25 2.47 -0.61 -2.63 114.38 114.04 1k1s h ARG 320 Ca 0.14 0.07 0.10 0.00 -1.26 0.00 0.00 59.98 59.02 1k1s h ARG 320 Cb 0.49 0.23 -0.10 0.00 -1.65 0.00 0.00 29.97 28.94 1k1s h ARG 320 CO 0.02 -0.68 -0.27 0.93 0.56 0.00 0.00 179.97 180.54 1k1s h GLU 321 N -1.06 -0.14 -0.87 0.04 5.08 -1.21 0.14 114.58 116.56 1k1s h GLU 321 Ca -0.07 0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.48 1k1s h GLU 321 Cb 0.89 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.11 1k1s h GLU 321 CO -0.01 -0.10 0.58 -0.07 -1.00 0.00 0.00 179.01 178.42 1k1s h LEU 322 N -0.15 0.43 -0.31 1.33 3.38 -1.32 0.39 115.31 119.05 1k1s h LEU 322 Ca 0.22 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.16 1k1s h LEU 322 Cb 0.51 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1k1s h LEU 322 CO -0.60 0.18 -0.33 -0.07 0.09 0.00 0.00 178.44 177.72 1k1s h LEU 323 N 0.43 0.00 -2.08 1.67 3.38 -0.41 -1.95 115.31 116.36 1k1s h LEU 323 Ca 0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.42 1k1s h LEU 323 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1k1s h LEU 323 CO -0.17 0.33 0.00 0.52 0.09 0.00 0.00 178.44 179.21 1k1s n VAL 324 N -3.25 1.00 0.00 1.22 0.31 0.12 -3.72 118.33 114.02 1k1s n VAL 324 Ca 0.02 -0.74 0.00 0.00 -0.01 0.00 0.00 64.34 63.61 1k1s n VAL 324 Cb 0.61 0.13 0.00 0.00 -0.91 0.00 0.00 33.84 33.68 1k1s n VAL 324 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1k1s n ARG 325 N 0.80 1.57 -3.87 5.55 0.63 -0.40 -5.02 116.66 115.92 1k1s n ARG 325 Ca 0.17 0.00 -0.20 0.00 -0.92 0.00 0.00 57.85 56.90 1k1s n ARG 325 Cb 0.55 -0.86 -0.17 0.00 0.45 0.00 0.00 32.46 32.43 1k1s n ARG 325 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1k1s s ASP 326 N -1.50 1.11 0.52 6.15 -1.08 -0.76 -5.08 116.67 116.03 1k1s s ASP 326 Ca 0.00 -0.05 0.06 0.00 -0.52 0.00 0.00 52.55 52.04 1k1s s ASP 326 Cb 0.00 -0.34 0.03 0.00 -1.46 0.00 0.00 42.92 41.14 1k1s s ASP 326 CO 0.00 -0.15 0.41 -0.54 0.52 0.00 0.00 175.17 175.41 1k1s s LYS 327 N 1.56 2.30 -0.52 4.34 -0.14 -1.26 -4.66 119.74 121.35 1k1s s LYS 327 Ca -0.02 -1.92 -0.03 0.00 -1.36 0.00 0.00 55.97 52.65 1k1s s LYS 327 Cb -0.13 -2.16 0.00 0.00 -1.68 0.00 0.00 37.83 33.86 1k1s s LYS 327 CO -0.03 -0.54 0.40 -2.13 -0.76 0.00 0.00 175.35 172.29 1k1s n ARG 328 N -1.73 -1.05 -2.71 1.68 3.00 -1.26 -4.90 116.66 109.69 1k1s n ARG 328 Ca 0.00 0.54 0.02 0.00 -0.00 0.00 0.00 57.85 58.41 1k1s n ARG 328 Cb 0.64 -1.44 0.01 0.00 0.00 0.00 0.00 32.46 31.66 1k1s n ARG 328 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1k1s s ARG 329 N -3.72 0.07 0.46 -0.14 0.52 -1.26 -5.13 118.95 109.76 1k1s s ARG 329 Ca 0.03 -0.02 -0.23 0.00 -0.52 0.00 0.00 55.73 54.98 1k1s s ARG 329 Cb -0.00 0.01 -0.07 0.00 0.52 0.00 0.00 34.95 35.40 1k1s s ARG 329 CO 0.59 -0.11 1.22 -0.80 0.02 0.00 0.00 175.30 176.22 1k1s s ASN 330 N 2.02 6.07 -0.09 0.23 0.01 -1.26 -4.85 114.94 117.06 1k1s s ASN 330 Ca 0.15 2.43 -0.28 0.00 -0.71 0.00 0.00 52.86 54.45 1k1s s ASN 330 Cb 0.04 -2.61 -0.02 0.00 0.41 0.00 0.00 41.25 39.07 1k1s s ASN 330 CO -0.16 -1.00 0.92 -0.69 -1.51 0.00 0.00 177.10 174.66 1k1s s VAL 331 N -1.45 4.86 -0.21 1.60 1.01 0.20 -1.62 120.40 124.80 1k1s s VAL 331 Ca 0.63 1.86 -0.22 0.00 0.00 0.00 0.00 61.98 64.26 1k1s s VAL 331 Cb -0.32 -4.23 -0.19 0.00 0.00 0.00 0.00 36.38 31.63 1k1s s VAL 331 CO 0.39 0.08 0.22 -0.09 0.00 0.00 0.00 175.10 175.70 1k1s h ARG 332 N 7.04 0.00 -5.68 2.72 2.43 -0.89 -2.92 114.38 117.07 1k1s h ARG 332 Ca -0.34 -0.00 -0.47 0.00 -0.81 0.00 0.00 59.98 58.36 1k1s h ARG 332 Cb 1.17 0.00 -0.18 0.00 -0.42 0.00 0.00 29.97 30.54 1k1s h ARG 332 CO 0.81 1.00 -0.77 1.03 -1.51 0.00 0.00 179.97 180.54 1k1s s ARG 333 N -2.36 1.17 -0.10 0.20 0.52 0.24 -2.15 118.95 116.47 1k1s s ARG 333 Ca -0.29 -1.35 -0.05 0.00 -0.52 0.00 0.00 55.73 53.53 1k1s s ARG 333 Cb 0.06 -1.13 0.05 0.00 0.52 0.00 0.00 34.95 34.45 1k1s s ARG 333 CO 0.59 0.22 0.22 -1.50 0.02 0.00 0.00 175.30 174.86 1k1s s ILE 334 N -2.16 -0.07 0.11 1.52 2.07 0.80 0.37 121.20 123.85 1k1s s ILE 334 Ca 0.13 0.17 0.02 0.00 -1.41 0.00 0.00 60.65 59.56 1k1s s ILE 334 Cb -0.05 -0.35 -0.01 0.00 0.13 0.00 0.00 42.46 42.19 1k1s s ILE 334 CO 0.05 0.07 0.06 0.61 -1.91 0.00 0.00 174.94 173.82 1k1s n GLY 335 N 4.31 3.77 2.92 1.50 0.00 0.48 -0.90 105.19 117.28 1k1s n GLY 335 Ca -0.24 -1.85 -0.12 0.00 0.00 0.00 0.00 46.02 43.81 1k1s n GLY 335 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k1s s VAL 336 N -2.20 0.09 -0.22 1.61 1.01 -0.87 -1.99 120.40 117.83 1k1s s VAL 336 Ca 0.09 -0.32 -0.00 0.00 0.00 0.00 0.00 61.98 61.75 1k1s s VAL 336 Cb 0.00 -0.13 0.06 0.00 0.00 0.00 0.00 36.38 36.31 1k1s s VAL 336 CO 0.06 -0.14 -0.02 -0.75 0.00 0.00 0.00 175.10 174.24 1k1s s LYS 337 N -0.48 1.32 -0.05 2.72 2.20 0.14 -2.08 119.74 123.51 1k1s s LYS 337 Ca -0.05 -0.83 -0.13 0.00 -0.36 0.00 0.00 55.97 54.60 1k1s s LYS 337 Cb -0.03 -2.45 -0.05 0.00 -1.51 0.00 0.00 37.83 33.79 1k1s s LYS 337 CO -0.00 -0.62 0.34 -0.51 -0.36 0.00 0.00 175.35 174.20 1k1s s LEU 338 N 1.53 4.42 0.12 5.43 1.43 0.15 -1.81 118.68 129.96 1k1s s LEU 338 Ca -0.04 0.79 -0.07 0.00 -1.03 0.00 0.00 54.13 53.79 1k1s s LEU 338 Cb -0.18 -2.45 -0.02 0.00 0.03 0.00 0.00 46.19 43.57 1k1s s LEU 338 CO -0.07 0.30 0.18 -1.81 0.23 0.00 0.00 176.35 175.19 1k1s s ASP 339 N -0.82 0.16 -0.79 2.29 1.01 -1.11 -1.55 116.67 115.86 1k1s s ASP 339 Ca 0.21 -0.89 -0.03 0.00 0.71 0.00 0.00 52.55 52.56 1k1s s ASP 339 Cb -0.15 0.36 -0.03 0.00 1.01 0.00 0.00 42.92 44.11 1k1s s ASP 339 CO 0.10 -0.79 0.68 0.59 0.21 0.00 0.00 175.17 175.96 1k1s n ASN 340 N -0.11 -4.04 -4.66 0.27 3.02 -1.22 -2.30 115.26 106.22 1k1s n ASN 340 Ca -0.10 -0.48 -0.43 0.00 -0.03 0.00 0.00 54.58 53.54 1k1s n ASN 340 Cb 0.63 -3.84 -0.02 0.00 -0.61 0.00 0.00 39.78 35.93 1k1s n ASN 340 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1k1s s ILE 341 N -3.27 4.50 -0.71 2.41 1.09 -0.60 -2.00 121.20 122.62 1k1s s ILE 341 Ca 0.20 1.81 -0.27 0.00 -1.10 0.00 0.00 60.65 61.29 1k1s s ILE 341 Cb -0.03 -4.17 0.02 0.00 -1.06 0.00 0.00 42.46 37.23 1k1s s ILE 341 CO 0.53 -0.16 1.40 -0.63 -0.10 0.00 0.00 174.94 175.97 1k1s s ILE 342 N 3.32 3.65 0.63 2.92 1.01 -0.32 -1.09 121.20 131.31 1k1s s ILE 342 Ca 0.49 0.38 -0.05 0.00 0.00 0.00 0.00 60.65 61.46 1k1s s ILE 342 Cb -0.18 -4.72 0.03 0.00 0.01 0.00 0.00 42.46 37.60 1k1s s ILE 342 CO 0.10 -1.66 0.93 0.27 0.00 0.00 0.00 174.94 174.58 1k1s s ILE 343 N 6.40 3.04 0.00 2.92 -4.36 -0.85 -3.63 121.20 124.72 1k1s s ILE 343 Ca 0.42 -0.18 0.00 0.00 -0.26 0.00 0.00 60.65 60.62 1k1s s ILE 343 Cb -0.09 -3.24 0.00 0.00 1.25 0.00 0.00 42.46 40.38 1k1s s ILE 343 CO 0.16 -0.24 0.00 -3.20 0.24 0.00 0.00 174.94 171.90