#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3l s ALA 40 N 0.00 3.55 0.05 -1.58 0.00 -1.26 -4.99 121.76 117.52 3h3l s ALA 40 Ca 0.00 1.10 0.09 0.00 0.00 0.00 0.00 51.96 53.16 3h3l s ALA 40 Cb 0.00 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 3h3l s ALA 40 CO 0.00 -0.56 -0.25 -0.51 0.00 0.00 0.00 175.76 174.43 3h3l s LEU 41 N 0.39 2.25 0.00 0.00 1.43 -1.26 -1.52 118.68 119.97 3h3l s LEU 41 Ca 0.60 -0.58 -0.14 0.00 -1.03 0.00 0.00 54.13 52.97 3h3l s LEU 41 Cb -0.36 -1.32 0.20 0.00 0.03 0.00 0.00 46.19 44.74 3h3l s LEU 41 CO 0.35 0.25 0.99 -0.90 0.23 0.00 0.00 176.35 177.27 3h3l n ASP 42 N 1.65 -0.66 0.27 2.29 5.68 -0.01 -4.85 116.55 120.93 3h3l n ASP 42 Ca -0.17 -1.25 0.17 0.00 -0.50 0.00 0.00 54.79 53.04 3h3l n ASP 42 Cb 0.52 -0.81 0.67 0.00 -1.14 0.00 0.00 41.12 40.37 3h3l n ASP 42 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3h3l h SER 43 N -1.76 0.00 -0.29 -1.12 0.02 -2.01 0.19 113.55 108.58 3h3l h SER 43 Ca -0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 3h3l h SER 43 Cb 0.96 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.50 3h3l h SER 43 CO 0.23 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.39 3h3l n ASP 44 N -3.07 1.88 -0.57 3.07 8.00 -1.26 -4.92 116.55 119.68 3h3l n ASP 44 Ca 0.01 -2.08 -0.06 0.00 0.71 0.00 0.00 54.79 53.37 3h3l n ASP 44 Cb 0.31 -0.28 -0.02 0.00 -0.02 0.00 0.00 41.12 41.11 3h3l n ASP 44 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h3l n GLY 45 N 0.83 0.59 3.64 0.44 0.00 0.06 -5.02 105.19 105.73 3h3l n GLY 45 Ca 0.10 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 3h3l n GLY 45 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3l s ILE 46 N -2.26 4.92 0.28 -0.61 -1.09 -1.26 -4.82 121.20 116.36 3h3l s ILE 46 Ca 0.00 0.02 -0.30 0.00 -2.23 0.00 0.00 60.65 58.13 3h3l s ILE 46 Cb 0.00 -3.23 -0.13 0.00 -1.58 0.00 0.00 42.46 37.52 3h3l s ILE 46 CO 0.00 0.44 1.45 -2.65 -1.23 0.00 0.00 174.94 172.95 3h3l n PRO 47 N 3.67 2.29 0.07 2.79 -0.02 -1.26 -0.83 135.00 141.71 3h3l n PRO 47 Ca -0.16 0.81 0.11 0.00 -2.02 0.00 0.00 63.50 62.24 3h3l n PRO 47 Cb 0.52 -2.50 -0.01 0.00 -0.02 0.00 0.00 33.50 31.49 3h3l n PRO 47 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3h3l n THR 48 N 1.66 0.41 -1.35 3.45 -2.24 -0.57 -4.83 114.28 110.80 3h3l n THR 48 Ca 0.09 -0.46 -0.29 0.00 -2.27 0.00 0.00 64.05 61.12 3h3l n THR 48 Cb 0.34 -0.16 0.18 0.00 -2.10 0.00 0.00 70.33 68.59 3h3l n THR 48 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3h3l s GLY 49 N -4.20 1.59 0.00 3.38 0.00 -1.26 -5.02 107.32 101.81 3h3l s GLY 49 Ca -0.00 -0.66 0.00 0.00 0.00 0.00 0.00 44.72 44.05 3h3l s GLY 49 CO 0.81 0.02 0.00 0.61 0.00 0.00 0.00 173.10 174.54 3h3l n GLY 50 N -1.71 2.21 3.38 0.20 0.00 -1.26 -4.99 105.19 103.01 3h3l n GLY 50 Ca 0.09 -2.15 -0.32 0.00 0.00 0.00 0.00 46.02 43.63 3h3l n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h3l s GLU 51 N -1.87 2.48 0.19 1.61 8.01 -1.26 -5.09 118.70 122.75 3h3l s GLU 51 Ca 0.00 -0.80 -0.30 0.00 0.01 0.00 0.00 54.97 53.88 3h3l s GLU 51 Cb 0.00 -2.26 -0.08 0.00 -4.31 0.00 0.00 34.13 27.48 3h3l s GLU 51 CO 0.00 0.52 0.98 -1.58 0.01 0.00 0.00 175.26 175.19 3h3l s TRP 52 N -0.49 3.84 -0.14 1.61 0.52 -1.26 -4.43 118.94 118.59 3h3l s TRP 52 Ca 0.06 1.82 -0.00 0.00 0.02 0.00 0.00 56.10 57.99 3h3l s TRP 52 Cb -0.11 -3.07 -0.01 0.00 -1.15 0.00 0.00 33.47 29.12 3h3l s TRP 52 CO 0.01 0.15 -0.12 0.42 0.02 0.00 0.00 176.95 177.42 3h3l s ILE 53 N -0.61 3.09 0.95 2.03 -1.09 0.53 -4.94 121.20 121.15 3h3l s ILE 53 Ca 0.45 -0.65 -0.16 0.00 -2.23 0.00 0.00 60.65 58.06 3h3l s ILE 53 Cb -0.26 -2.30 0.22 0.00 -1.58 0.00 0.00 42.46 38.54 3h3l s ILE 53 CO 0.32 0.52 1.26 0.41 -1.23 0.00 0.00 174.94 176.22 3h3l n THR 54 N 3.60 0.00 -0.14 2.92 -1.04 -1.26 -1.50 114.28 116.85 3h3l n THR 54 Ca -0.18 -0.90 -0.06 0.00 -2.04 0.00 0.00 64.05 60.87 3h3l n THR 54 Cb 0.53 -1.51 -0.01 0.00 -1.82 0.00 0.00 70.33 67.51 3h3l n THR 54 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 3h3l n PHE 56 N -3.82 0.12 1.32 -1.42 7.35 -1.24 -4.98 117.46 114.79 3h3l n PHE 56 Ca 0.16 0.10 0.12 0.00 -0.76 0.00 0.00 57.45 57.07 3h3l n PHE 56 Cb 0.55 -0.19 0.67 0.00 0.35 0.00 0.00 39.48 40.87 3h3l n PHE 56 CO 0.00 0.00 0.00 -0.40 -0.76 0.00 0.00 176.76 175.60 3h3l n ASP 57 N 0.27 0.00 0.00 -2.13 5.68 -1.26 -4.74 116.55 114.37 3h3l n ASP 57 Ca 0.02 -0.34 0.00 0.00 -0.50 0.00 0.00 54.79 53.98 3h3l n ASP 57 Cb -0.00 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 39.80 3h3l n ASP 57 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h3l n GLY 58 N 0.72 1.24 0.00 6.12 0.00 -1.26 -4.81 105.19 107.20 3h3l n GLY 58 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3h3l n GLY 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h3l n LYS 59 N -2.00 0.31 -4.32 1.61 5.02 -1.26 -4.18 118.16 113.34 3h3l n LYS 59 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 3h3l n LYS 59 Cb 0.00 -0.66 -0.10 0.00 -0.02 0.00 0.00 35.03 34.26 3h3l n LYS 59 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3h3l s THR 60 N -1.32 0.39 -0.36 -0.18 -4.23 -1.26 -4.87 115.64 103.82 3h3l s THR 60 Ca 0.00 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.61 3h3l s THR 60 Cb 0.00 -2.55 0.67 0.00 1.34 0.00 0.00 72.50 71.96 3h3l s THR 60 CO 0.00 0.00 1.64 0.18 -0.54 0.00 0.00 174.62 175.90 3h3l n LEU 61 N -0.52 5.43 -4.71 4.79 4.77 -1.26 -4.48 117.00 121.01 3h3l n LEU 61 Ca 0.01 -2.80 -0.43 0.00 -0.03 0.00 0.00 56.01 52.75 3h3l n LEU 61 Cb 0.65 -0.70 -0.03 0.00 -2.33 0.00 0.00 43.42 41.02 3h3l n LEU 61 CO 0.36 0.69 1.18 0.59 -1.33 0.00 0.00 177.39 178.88 3h3l n ASN 62 N 0.12 3.41 0.00 -1.43 3.02 -1.26 -1.21 115.26 117.91 3h3l n ASN 62 Ca 0.32 1.12 0.00 0.00 -0.03 0.00 0.00 54.58 55.99 3h3l n ASN 62 Cb 1.20 -1.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 3h3l n ASN 62 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h3l n GLY 63 N 2.62 2.39 3.58 7.41 0.00 -1.26 -4.77 105.19 115.15 3h3l n GLY 63 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 3h3l n GLY 63 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h3l s TRP 64 N -2.56 2.72 0.26 1.61 0.52 -0.35 -0.33 118.94 120.82 3h3l s TRP 64 Ca 0.00 -0.17 -0.16 0.00 0.02 0.00 0.00 56.10 55.79 3h3l s TRP 64 Cb 0.00 -1.40 0.01 0.00 -1.15 0.00 0.00 33.47 30.93 3h3l s TRP 64 CO 0.00 0.45 0.58 -0.98 0.02 0.00 0.00 176.95 177.01 3h3l s ARG 65 N -2.36 1.66 0.60 4.98 1.70 -0.29 -4.74 118.95 120.50 3h3l s ARG 65 Ca 0.22 -1.16 -0.16 0.00 -0.47 0.00 0.00 55.73 54.16 3h3l s ARG 65 Cb -0.11 0.53 -0.03 0.00 -0.57 0.00 0.00 34.95 34.77 3h3l s ARG 65 CO 0.14 -0.72 1.08 0.20 -1.08 0.00 0.00 175.30 174.93 3h3l s GLY 66 N -2.98 2.25 0.11 3.88 0.00 0.09 -0.63 107.32 110.03 3h3l s GLY 66 Ca 0.18 0.53 -0.31 0.00 0.00 0.00 0.00 44.72 45.12 3h3l s GLY 66 CO 0.08 0.87 1.77 -0.47 0.00 0.00 0.00 173.10 175.35 3h3l s TYR 67 N -2.27 2.25 -1.53 1.90 5.04 0.07 -2.44 117.35 120.37 3h3l s TYR 67 Ca 0.66 0.10 -0.02 0.00 -2.44 0.00 0.00 57.07 55.37 3h3l s TYR 67 Cb -0.19 -4.11 0.00 0.00 0.35 0.00 0.00 41.96 38.02 3h3l s TYR 67 CO 0.35 -4.53 0.20 0.00 -1.34 0.00 0.00 175.55 170.23 3h3l s ARG 69 N -5.17 1.20 0.20 0.00 1.70 -1.02 -5.02 118.95 110.84 3h3l s ARG 69 Ca 0.10 -0.47 0.23 0.00 -0.47 0.00 0.00 55.73 55.12 3h3l s ARG 69 Cb -0.04 0.55 0.08 0.00 -0.57 0.00 0.00 34.95 34.97 3h3l s ARG 69 CO 0.12 -0.50 1.13 1.96 -1.08 0.00 0.00 175.30 176.93 3h3l h GLN 70 N 2.19 0.00 -6.34 3.89 1.08 -1.95 -3.32 115.11 110.66 3h3l h GLN 70 Ca -0.33 0.00 -0.45 0.00 -1.45 0.00 0.00 58.65 56.42 3h3l h GLN 70 Cb 1.28 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.72 3h3l h GLN 70 CO 0.40 0.00 -0.33 0.16 -0.95 0.00 0.00 178.83 178.11 3h3l s ASP 71 N -5.19 6.03 -0.06 1.46 -4.77 -1.26 -4.72 116.67 108.15 3h3l s ASP 71 Ca 0.01 -0.08 -0.30 0.00 -3.30 0.00 0.00 52.55 48.88 3h3l s ASP 71 Cb 0.10 -1.39 -0.02 0.00 -1.09 0.00 0.00 42.92 40.52 3h3l s ASP 71 CO 0.77 -0.39 1.00 -0.69 0.70 0.00 0.00 175.17 176.56 3h3l s VAL 72 N -2.18 4.81 0.53 2.11 1.01 -1.26 -0.73 120.40 124.69 3h3l s VAL 72 Ca 0.43 2.05 -0.21 0.00 0.00 0.00 0.00 61.98 64.24 3h3l s VAL 72 Cb -0.09 -4.31 -0.05 0.00 0.00 0.00 0.00 36.38 31.92 3h3l s VAL 72 CO 0.31 0.07 1.25 -2.84 0.00 0.00 0.00 175.10 173.89 3h3l s PRO 73 N 1.60 3.31 0.30 2.72 0.02 -1.26 -4.90 135.00 136.79 3h3l s PRO 73 Ca 0.50 1.96 -0.30 0.00 0.02 0.00 0.00 61.00 63.18 3h3l s PRO 73 Cb -0.19 -2.22 -0.12 0.00 0.02 0.00 0.00 34.50 31.98 3h3l s PRO 73 CO 0.22 -0.97 1.41 1.28 -0.33 0.00 0.00 177.00 178.61 3h3l n LEU 74 N -0.99 3.64 0.00 -5.54 4.77 -1.26 -2.94 117.00 114.68 3h3l n LEU 74 Ca 0.10 1.17 0.00 0.00 -0.03 0.00 0.00 56.01 57.25 3h3l n LEU 74 Cb 0.47 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.07 3h3l n LEU 74 CO 0.49 -0.31 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 3h3l n GLY 75 N 1.56 1.32 3.72 -0.72 0.00 -1.26 -4.72 105.19 105.08 3h3l n GLY 75 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3h3l n GLY 75 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h3l s TRP 76 N -1.67 3.63 0.12 1.61 0.52 -1.15 -0.21 118.94 121.79 3h3l s TRP 76 Ca 0.00 1.43 -0.01 0.00 0.02 0.00 0.00 56.10 57.54 3h3l s TRP 76 Cb 0.00 -2.91 -0.04 0.00 -1.15 0.00 0.00 33.47 29.37 3h3l s TRP 76 CO 0.00 0.09 0.04 0.14 0.02 0.00 0.00 176.95 177.24 3h3l s VAL 77 N 0.70 0.14 -0.23 4.03 -7.23 -0.38 -4.98 120.40 112.45 3h3l s VAL 77 Ca 0.42 -1.90 -0.07 0.00 -1.81 0.00 0.00 61.98 58.62 3h3l s VAL 77 Cb -0.19 -1.96 -0.03 0.00 0.56 0.00 0.00 36.38 34.76 3h3l s VAL 77 CO 0.22 -0.55 0.06 -0.69 -0.31 0.00 0.00 175.10 173.83 3h3l s VAL 78 N -4.02 4.33 -0.10 1.32 1.01 -1.26 -1.28 120.40 120.41 3h3l s VAL 78 Ca 0.21 -0.17 -0.01 0.00 0.00 0.00 0.00 61.98 62.02 3h3l s VAL 78 Cb 0.08 -3.01 0.03 0.00 0.00 0.00 0.00 36.38 33.47 3h3l s VAL 78 CO -0.00 0.37 -0.06 -0.70 0.00 0.00 0.00 175.10 174.71 3h3l s GLU 79 N 1.37 1.26 -1.49 2.72 2.12 0.07 -4.84 118.70 119.91 3h3l s GLU 79 Ca 0.05 -0.16 -0.09 0.00 0.36 0.00 0.00 54.97 55.14 3h3l s GLU 79 Cb -0.15 -1.39 0.06 0.00 0.26 0.00 0.00 34.13 32.92 3h3l s GLU 79 CO 0.03 -0.26 0.75 -3.47 -0.54 0.00 0.00 175.26 171.77 3h3l n ASP 80 N 4.93 -2.68 -0.28 -1.70 4.64 -1.26 -1.37 116.55 118.83 3h3l n ASP 80 Ca -0.12 -0.89 -0.04 0.00 -1.38 0.00 0.00 54.79 52.37 3h3l n ASP 80 Cb 0.50 -3.48 -0.02 0.00 -1.04 0.00 0.00 41.12 37.08 3h3l n ASP 80 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3h3l n GLY 81 N -1.68 0.66 3.15 0.27 0.00 -1.26 -5.03 105.19 101.30 3h3l n GLY 81 Ca -0.11 -0.63 -0.19 0.00 0.00 0.00 0.00 46.02 45.10 3h3l n GLY 81 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h3l s SER 82 N -2.71 1.59 0.05 1.61 0.01 -0.47 -4.77 113.70 109.00 3h3l s SER 82 Ca 0.00 -0.54 -0.29 0.00 1.31 0.00 0.00 55.95 56.43 3h3l s SER 82 Cb 0.00 -0.07 -0.05 0.00 0.21 0.00 0.00 66.02 66.12 3h3l s SER 82 CO 0.00 -0.04 0.92 -0.63 0.41 0.00 0.00 173.24 173.90 3h3l s ILE 83 N -1.09 4.71 -0.03 1.44 1.01 -0.14 -0.75 121.20 126.36 3h3l s ILE 83 Ca -0.01 1.96 -0.16 0.00 0.00 0.00 0.00 60.65 62.44 3h3l s ILE 83 Cb -0.09 -4.27 0.03 0.00 0.01 0.00 0.00 42.46 38.14 3h3l s ILE 83 CO 0.02 0.26 0.35 0.28 0.00 0.00 0.00 174.94 175.84 3h3l s THR 84 N 0.42 0.05 -0.40 2.92 -1.32 -0.40 -0.70 115.64 116.21 3h3l s THR 84 Ca 0.47 -0.39 -0.17 0.00 -1.21 0.00 0.00 61.69 60.38 3h3l s THR 84 Cb -0.22 -0.64 0.01 0.00 -1.51 0.00 0.00 72.50 70.15 3h3l s THR 84 CO 0.27 -0.22 0.44 -0.47 -2.21 0.00 0.00 174.62 172.44 3h3l s TYR 85 N -1.18 3.17 -0.04 9.09 5.04 -1.26 -1.25 117.35 130.92 3h3l s TYR 85 Ca -0.12 -0.25 0.12 0.00 -2.44 0.00 0.00 57.07 54.37 3h3l s TYR 85 Cb -0.05 -2.89 -0.23 0.00 0.35 0.00 0.00 41.96 39.15 3h3l s TYR 85 CO 0.04 -0.65 0.67 0.87 -1.34 0.00 0.00 175.55 175.14 3h3l h LYS 86 N 8.67 0.01 0.00 4.97 1.79 -0.94 -3.41 116.57 127.66 3h3l h LYS 86 Ca -0.27 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 3h3l h LYS 86 Cb 1.12 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.77 3h3l h LYS 86 CO 0.78 0.53 0.00 0.41 -1.08 0.00 0.00 179.45 180.09 3h3l n GLY 87 N 1.57 -0.93 3.34 3.86 0.00 -1.17 -5.05 105.19 106.81 3h3l n GLY 87 Ca -0.17 -1.64 -0.25 0.00 0.00 0.00 0.00 46.02 43.96 3h3l n GLY 87 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h3l s SER 88 N -3.17 2.86 0.38 1.61 0.15 -1.26 -4.54 113.70 109.74 3h3l s SER 88 Ca 0.00 -0.76 0.15 0.00 0.70 0.00 0.00 55.95 56.04 3h3l s SER 88 Cb 0.00 -0.18 0.76 0.00 -1.71 0.00 0.00 66.02 64.89 3h3l s SER 88 CO 0.00 0.07 1.82 -2.24 1.20 0.00 0.00 173.24 174.09 3h3l h ASP 89 N 3.75 0.00 -2.64 5.45 -0.00 -2.00 -3.41 116.42 117.57 3h3l h ASP 89 Ca -0.46 0.00 -0.55 0.00 -0.00 0.00 0.00 57.03 56.01 3h3l h ASP 89 Cb 1.19 0.00 -0.04 0.00 -0.00 0.00 0.00 39.33 40.48 3h3l h ASP 89 CO 0.43 0.37 1.24 0.21 -0.00 0.00 0.00 179.24 181.49 3h3l s ASN 90 N -6.77 5.85 -0.17 4.15 3.84 -1.26 -4.86 114.94 115.72 3h3l s ASN 90 Ca -0.02 0.91 0.16 0.00 0.21 0.00 0.00 52.86 54.12 3h3l s ASN 90 Cb 0.14 -2.53 0.74 0.00 -0.55 0.00 0.00 41.25 39.05 3h3l s ASN 90 CO 0.71 -1.81 1.66 0.29 -2.79 0.00 0.00 177.10 175.16 3h3l n LYS 91 N 8.55 4.15 -2.12 0.43 5.02 -1.26 -5.01 118.16 127.92 3h3l n LYS 91 Ca 0.20 -2.99 -0.37 0.00 -2.02 0.00 0.00 58.31 53.13 3h3l n LYS 91 Cb 0.48 -2.03 0.01 0.00 -0.02 0.00 0.00 35.03 33.47 3h3l n LYS 91 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h3l s ALA 92 N -2.29 2.89 -1.21 7.82 0.00 -1.26 -4.89 121.76 122.81 3h3l s ALA 92 Ca 0.51 1.04 -0.20 0.00 0.00 0.00 0.00 51.96 53.31 3h3l s ALA 92 Cb 0.36 -3.43 0.05 0.00 0.00 0.00 0.00 23.12 20.10 3h3l s ALA 92 CO 0.20 -0.88 1.69 -0.51 0.00 0.00 0.00 175.76 176.26 3h3l s ASP 93 N -1.29 6.57 0.51 0.00 1.11 -1.26 -4.94 116.67 117.37 3h3l s ASP 93 Ca 0.67 -2.10 0.00 0.00 0.18 0.00 0.00 52.55 51.30 3h3l s ASP 93 Cb -0.31 -2.58 0.00 0.00 1.07 0.00 0.00 42.92 41.10 3h3l s ASP 93 CO 0.37 -1.45 0.00 0.41 1.18 0.00 0.00 175.17 175.69 3h3l n THR 94 N 6.67 0.00 0.00 -1.27 -1.04 -1.26 -5.09 114.28 112.29 3h3l n THR 94 Ca 0.45 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.46 3h3l n THR 94 Cb 0.47 -1.73 0.00 0.00 -1.82 0.00 0.00 70.33 67.26 3h3l n THR 94 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3h3l n GLY 95 N 5.00 -1.62 3.76 3.41 0.00 -1.26 -4.99 105.19 109.49 3h3l n GLY 95 Ca 0.00 -1.34 -0.34 0.00 0.00 0.00 0.00 46.02 44.34 3h3l n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h3l s PHE 96 N 0.00 2.50 -0.99 1.61 0.08 -1.26 -4.98 117.98 114.94 3h3l s PHE 96 Ca 0.00 1.56 0.09 0.00 0.12 0.00 0.00 56.93 58.70 3h3l s PHE 96 Cb 0.00 -3.26 0.15 0.00 -0.57 0.00 0.00 43.02 39.34 3h3l s PHE 96 CO 0.00 -1.88 0.97 0.41 -0.10 0.00 0.00 175.22 174.62 3h3l n GLY 97 N -0.19 0.91 3.77 4.36 0.00 -1.26 -4.67 105.19 108.10 3h3l n GLY 97 Ca 0.11 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 3h3l n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h3l s ASP 98 N -0.87 5.59 -0.18 1.61 1.11 -1.26 -4.41 116.67 118.26 3h3l s ASP 98 Ca 0.14 2.15 -0.04 0.00 0.18 0.00 0.00 52.55 54.98 3h3l s ASP 98 Cb 0.09 -2.58 -0.02 0.00 1.07 0.00 0.00 42.92 41.48 3h3l s ASP 98 CO 0.12 -1.31 -0.03 -0.22 1.18 0.00 0.00 175.17 174.91 3h3l s LEU 99 N -4.01 3.16 0.18 1.23 2.96 -1.26 -0.75 118.68 120.20 3h3l s LEU 99 Ca 0.72 -0.21 0.11 0.00 -0.22 0.00 0.00 54.13 54.53 3h3l s LEU 99 Cb -0.23 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 3h3l s LEU 99 CO 0.30 0.11 -0.24 0.27 -1.32 0.00 0.00 176.35 175.47 3h3l s ILE 100 N 0.73 2.28 0.13 6.68 -4.36 0.19 -4.26 121.20 122.59 3h3l s ILE 100 Ca -0.01 -1.99 -0.26 0.00 -0.26 0.00 0.00 60.65 58.13 3h3l s ILE 100 Cb -0.14 -2.08 -0.07 0.00 1.25 0.00 0.00 42.46 41.42 3h3l s ILE 100 CO 0.02 -0.12 0.80 -0.47 0.24 0.00 0.00 174.94 175.41 3h3l s TYR 101 N -1.64 3.85 -1.47 1.37 5.04 -0.44 -1.13 117.35 122.93 3h3l s TYR 101 Ca 0.19 1.61 -0.08 0.00 -2.44 0.00 0.00 57.07 56.36 3h3l s TYR 101 Cb -0.08 -2.82 0.02 0.00 0.35 0.00 0.00 41.96 39.43 3h3l s TYR 101 CO 0.09 0.41 2.65 -3.47 -1.34 0.00 0.00 175.55 173.88 3h3l n ASP 102 N 2.08 8.20 -3.64 4.32 2.03 0.55 -4.61 116.55 125.49 3h3l n ASP 102 Ca -0.04 -2.86 -0.07 0.00 0.52 0.00 0.00 54.79 52.34 3h3l n ASP 102 Cb 0.49 -1.47 -0.07 0.00 -0.72 0.00 0.00 41.12 39.35 3h3l n ASP 102 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3h3l s LYS 103 N 0.61 0.54 0.27 -0.67 2.20 -1.26 -5.05 119.74 116.37 3h3l s LYS 103 Ca 0.61 0.78 -0.18 0.00 -0.36 0.00 0.00 55.97 56.82 3h3l s LYS 103 Cb 0.18 0.19 -0.09 0.00 -1.51 0.00 0.00 37.83 36.60 3h3l s LYS 103 CO -0.08 -0.09 0.74 0.15 -0.36 0.00 0.00 175.35 175.71 3h3l s LYS 104 N 0.89 4.16 0.11 4.03 1.02 -1.26 -4.61 119.74 124.08 3h3l s LYS 104 Ca -0.04 0.81 0.04 0.00 0.02 0.00 0.00 55.97 56.80 3h3l s LYS 104 Cb -0.05 -2.69 -0.04 0.00 -0.52 0.00 0.00 37.83 34.53 3h3l s LYS 104 CO -0.11 0.29 -0.10 -0.06 -0.92 0.00 0.00 175.35 174.46 3h3l s PHE 105 N -1.71 1.12 0.10 3.18 0.08 -0.03 -4.85 117.98 115.86 3h3l s PHE 105 Ca 0.48 -0.72 0.00 0.00 0.12 0.00 0.00 56.93 56.80 3h3l s PHE 105 Cb -0.14 -0.60 0.00 0.00 -0.57 0.00 0.00 43.02 41.71 3h3l s PHE 105 CO 0.19 0.01 0.00 1.17 -0.10 0.00 0.00 175.22 176.50 3h3l n LYS 106 N 0.22 0.00 -4.16 0.44 3.00 -1.26 -0.68 118.16 115.72 3h3l n LYS 106 Ca -0.13 0.00 -0.35 0.00 -0.00 0.00 0.00 58.31 57.83 3h3l n LYS 106 Cb 0.59 -0.15 -0.13 0.00 0.00 0.00 0.00 35.03 35.35 3h3l n LYS 106 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 3h3l s ASN 107 N -5.08 4.67 0.06 3.14 0.01 -1.26 -4.72 114.94 111.77 3h3l s ASN 107 Ca 0.00 -0.23 -0.27 0.00 -0.71 0.00 0.00 52.86 51.65 3h3l s ASN 107 Cb 0.00 -1.79 0.09 0.00 0.41 0.00 0.00 41.25 39.96 3h3l s ASN 107 CO 0.00 0.08 0.91 0.72 -1.51 0.00 0.00 177.10 177.30 3h3l s PHE 108 N 0.92 -0.27 -0.23 2.20 -0.12 0.19 -0.91 117.98 119.75 3h3l s PHE 108 Ca 0.00 0.06 -0.00 0.00 -0.05 0.00 0.00 56.93 56.95 3h3l s PHE 108 Cb -0.14 0.58 0.03 0.00 -0.63 0.00 0.00 43.02 42.85 3h3l s PHE 108 CO 0.01 -0.66 -0.11 0.08 -0.05 0.00 0.00 175.22 174.50 3h3l s VAL 109 N -3.20 2.55 -0.12 -2.49 1.01 0.19 -1.41 120.40 116.94 3h3l s VAL 109 Ca 0.08 -1.09 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 3h3l s VAL 109 Cb -0.01 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 3h3l s VAL 109 CO -0.05 0.26 -0.08 0.12 0.00 0.00 0.00 175.10 175.35 3h3l s PHE 110 N 1.28 2.92 0.00 5.22 5.36 0.30 -0.79 117.98 132.27 3h3l s PHE 110 Ca 0.00 -0.31 0.05 0.00 -0.96 0.00 0.00 56.93 55.71 3h3l s PHE 110 Cb -0.16 -1.84 -0.01 0.00 -0.34 0.00 0.00 43.02 40.67 3h3l s PHE 110 CO -0.07 0.02 -0.15 -1.21 -1.46 0.00 0.00 175.22 172.35 3h3l s GLU 111 N -0.01 1.14 -0.12 10.12 2.02 0.03 -0.69 118.70 131.20 3h3l s GLU 111 Ca -0.01 -0.59 -0.19 0.00 0.02 0.00 0.00 54.97 54.20 3h3l s GLU 111 Cb -0.14 -1.12 0.05 0.00 0.10 0.00 0.00 34.13 33.02 3h3l s GLU 111 CO 0.03 0.30 0.48 -1.50 0.02 0.00 0.00 175.26 174.59 3h3l s ILE 112 N -0.47 0.02 0.01 -1.63 2.07 -0.60 -1.21 121.20 119.39 3h3l s ILE 112 Ca 0.05 -0.13 0.02 0.00 -1.41 0.00 0.00 60.65 59.19 3h3l s ILE 112 Cb -0.06 -0.73 -0.04 0.00 0.13 0.00 0.00 42.46 41.77 3h3l s ILE 112 CO -0.00 -0.07 -0.03 -1.61 -1.91 0.00 0.00 174.94 171.32 3h3l s GLU 113 N -0.41 2.66 0.02 3.50 2.02 -0.24 -0.52 118.70 125.72 3h3l s GLU 113 Ca -0.06 -0.67 -0.08 0.00 0.02 0.00 0.00 54.97 54.18 3h3l s GLU 113 Cb -0.03 -2.58 0.00 0.00 0.10 0.00 0.00 34.13 31.61 3h3l s GLU 113 CO 0.03 0.61 0.15 1.67 0.02 0.00 0.00 175.26 177.74 3h3l s TRP 114 N -1.06 0.06 -0.02 1.61 1.48 -0.34 -1.14 118.94 119.53 3h3l s TRP 114 Ca 0.19 -0.21 0.02 0.00 -1.06 0.00 0.00 56.10 55.04 3h3l s TRP 114 Cb -0.11 -0.05 0.01 0.00 -1.16 0.00 0.00 33.47 32.15 3h3l s TRP 114 CO 0.09 -0.34 -0.07 0.21 -4.06 0.00 0.00 176.95 172.79 3h3l s LYS 115 N -1.84 0.77 -0.09 3.25 2.20 -0.54 -0.40 119.74 123.08 3h3l s LYS 115 Ca -0.11 -0.22 0.03 0.00 -0.36 0.00 0.00 55.97 55.31 3h3l s LYS 115 Cb -0.05 -0.74 -0.01 0.00 -1.51 0.00 0.00 37.83 35.52 3h3l s LYS 115 CO -0.00 0.07 -0.19 -1.50 -0.36 0.00 0.00 175.35 173.36 3h3l s ILE 116 N 0.29 2.51 0.80 5.43 2.07 -1.26 -0.99 121.20 130.05 3h3l s ILE 116 Ca -0.04 -0.88 -0.11 0.00 -1.41 0.00 0.00 60.65 58.21 3h3l s ILE 116 Cb -0.08 -1.99 0.07 0.00 0.13 0.00 0.00 42.46 40.59 3h3l s ILE 116 CO 0.00 0.55 1.09 -1.81 -1.91 0.00 0.00 174.94 172.86 3h3l s ASP 117 N 0.11 4.38 0.12 4.50 1.01 0.18 -0.41 116.67 126.54 3h3l s ASP 117 Ca -0.09 1.45 -0.34 0.00 0.71 0.00 0.00 52.55 54.27 3h3l s ASP 117 Cb -0.15 -2.19 -0.14 0.00 1.01 0.00 0.00 42.92 41.45 3h3l s ASP 117 CO 0.06 -2.06 1.60 1.17 0.21 0.00 0.00 175.17 176.14 3h3l n LYS 118 N -3.51 2.05 -1.64 8.23 4.81 -1.26 -1.08 118.16 125.76 3h3l n LYS 118 Ca 0.07 0.74 -0.16 0.00 -0.87 0.00 0.00 58.31 58.09 3h3l n LYS 118 Cb 0.55 -2.51 -0.06 0.00 0.02 0.00 0.00 35.03 33.04 3h3l n LYS 118 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3h3l n ALA 119 N 3.78 -0.29 -1.63 3.14 0.00 -1.26 -5.01 120.51 119.24 3h3l n ALA 119 Ca 0.18 0.23 -0.29 0.00 0.00 0.00 0.00 53.44 53.56 3h3l n ALA 119 Cb 0.28 -1.73 0.11 0.00 0.00 0.00 0.00 19.45 18.12 3h3l n ALA 119 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h3l s GLY 120 N -2.72 1.59 -0.09 0.00 0.00 -0.24 -4.87 107.32 101.00 3h3l s GLY 120 Ca 0.00 -0.48 -0.22 0.00 0.00 0.00 0.00 44.72 44.02 3h3l s GLY 120 CO 0.00 0.03 0.52 0.54 0.00 0.00 0.00 173.10 174.18 3h3l s ASN 121 N -4.14 -0.48 0.00 1.64 2.20 -0.86 -2.43 114.94 110.88 3h3l s ASN 121 Ca 0.63 0.65 0.00 0.00 -0.94 0.00 0.00 52.86 53.20 3h3l s ASN 121 Cb -0.14 0.66 0.00 0.00 -2.00 0.00 0.00 41.25 39.78 3h3l s ASN 121 CO 0.52 -0.42 0.00 -0.24 -2.94 0.00 0.00 177.10 174.03 3h3l n SER 122 N 1.67 0.00 -3.62 3.54 2.88 -0.08 -2.53 113.62 115.48 3h3l n SER 122 Ca -0.18 -0.05 -0.05 0.00 -1.33 0.00 0.00 58.87 57.26 3h3l n SER 122 Cb 0.56 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.98 3h3l n SER 122 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3h3l s GLY 123 N -0.19 -0.02 -0.14 0.46 0.00 -1.26 -1.81 107.32 104.37 3h3l s GLY 123 Ca 0.00 2.60 0.01 0.00 0.00 0.00 0.00 44.72 47.34 3h3l s GLY 123 CO 0.00 1.12 -0.18 -0.42 0.00 0.00 0.00 173.10 173.61 3h3l s ILE 124 N -1.00 2.47 0.02 0.90 1.01 -0.28 -1.84 121.20 122.47 3h3l s ILE 124 Ca 0.05 -0.85 -0.00 0.00 0.00 0.00 0.00 60.65 59.85 3h3l s ILE 124 Cb -0.01 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 3h3l s ILE 124 CO -0.05 0.53 0.11 -0.36 0.00 0.00 0.00 174.94 175.17 3h3l s PHE 125 N 0.65 3.34 0.00 3.97 0.08 0.15 -0.39 117.98 125.78 3h3l s PHE 125 Ca -0.09 0.21 0.00 0.00 0.12 0.00 0.00 56.93 57.17 3h3l s PHE 125 Cb -0.16 -1.73 0.00 0.00 -0.57 0.00 0.00 43.02 40.56 3h3l s PHE 125 CO 0.02 0.57 0.14 2.48 -0.10 0.00 0.00 175.22 178.33 3h3l n TYR 126 N 0.91 0.00 -1.80 0.36 4.11 -1.24 -1.38 117.16 118.12 3h3l n TYR 126 Ca -0.11 0.00 0.04 0.00 -0.00 0.00 0.00 57.90 57.83 3h3l n TYR 126 Cb 0.52 0.00 0.07 0.00 -0.00 0.00 0.00 39.34 39.93 3h3l n TYR 126 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 3h3l n THR 127 N 0.00 0.76 -2.19 -3.48 -2.24 -1.12 -4.52 114.28 101.48 3h3l n THR 127 Ca 0.00 -1.17 -0.39 0.00 -2.27 0.00 0.00 64.05 60.22 3h3l n THR 127 Cb 0.32 0.31 -0.01 0.00 -2.10 0.00 0.00 70.33 68.85 3h3l n THR 127 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h3l s ALA 128 N -1.15 3.18 -0.10 6.98 0.00 -0.60 -4.38 121.76 125.70 3h3l s ALA 128 Ca 0.19 1.08 -0.05 0.00 0.00 0.00 0.00 51.96 53.18 3h3l s ALA 128 Cb 0.19 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 3h3l s ALA 128 CO -0.03 -0.66 0.07 -0.65 0.00 0.00 0.00 175.76 174.49 3h3l s GLN 129 N -2.28 3.23 -0.55 0.00 -1.52 -1.26 -0.23 119.66 117.05 3h3l s GLN 129 Ca 0.57 -0.26 -0.26 0.00 -1.95 0.00 0.00 55.36 53.46 3h3l s GLN 129 Cb -0.34 -3.00 0.04 0.00 -0.22 0.00 0.00 33.01 29.49 3h3l s GLN 129 CO 0.43 0.74 1.05 -1.21 -0.25 0.00 0.00 175.29 176.04 3h3l s GLU 130 N -0.94 3.43 -0.20 2.91 2.02 -1.26 -4.87 118.70 119.79 3h3l s GLU 130 Ca 0.14 0.00 0.01 0.00 0.02 0.00 0.00 54.97 55.14 3h3l s GLU 130 Cb -0.12 -4.02 0.04 0.00 0.10 0.00 0.00 34.13 30.13 3h3l s GLU 130 CO 0.03 -1.54 -0.10 0.42 0.02 0.00 0.00 175.26 174.09 3h3l s ILE 131 N 4.36 1.64 0.24 -1.63 1.01 -1.26 -5.04 121.20 120.52 3h3l s ILE 131 Ca 0.37 -1.01 -0.31 0.00 0.00 0.00 0.00 60.65 59.70 3h3l s ILE 131 Cb -0.10 -1.72 -0.11 0.00 0.01 0.00 0.00 42.46 40.54 3h3l s ILE 131 CO 0.23 0.17 1.57 -1.61 0.00 0.00 0.00 174.94 175.29 3h3l s GLU 132 N 1.40 4.18 0.00 2.79 8.01 -1.26 -2.13 118.70 131.68 3h3l s GLU 132 Ca -0.01 2.46 0.00 0.00 0.01 0.00 0.00 54.97 57.43 3h3l s GLU 132 Cb -0.16 -3.08 0.00 0.00 -4.31 0.00 0.00 34.13 26.58 3h3l s GLU 132 CO -0.08 -0.59 0.00 0.41 0.01 0.00 0.00 175.26 175.01 3h3l n GLY 133 N 2.79 1.58 3.29 -1.39 0.00 -1.26 -5.02 105.19 105.19 3h3l n GLY 133 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 3h3l n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h3l s THR 134 N -3.03 2.50 0.67 2.61 2.01 -0.91 -5.11 115.64 114.38 3h3l s THR 134 Ca 0.00 -0.87 -0.17 0.00 0.31 0.00 0.00 61.69 60.96 3h3l s THR 134 Cb 0.00 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.52 3h3l s THR 134 CO 0.00 0.55 1.27 -2.65 -0.69 0.00 0.00 174.62 173.09 3h3l n PRO 135 N 3.43 0.97 -0.18 4.92 -0.02 -1.26 -4.64 135.00 138.21 3h3l n PRO 135 Ca -0.18 0.39 0.13 0.00 -2.02 0.00 0.00 63.50 61.81 3h3l n PRO 135 Cb 0.53 -2.50 0.45 0.00 -0.02 0.00 0.00 33.50 31.96 3h3l n PRO 135 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 3h3l h ILE 136 N 0.31 0.85 0.00 4.25 2.10 -1.93 -2.14 117.51 120.96 3h3l h ILE 136 Ca -0.50 -0.18 0.00 0.00 1.08 0.00 0.00 64.86 65.26 3h3l h ILE 136 Cb 1.34 0.28 0.00 0.00 -1.09 0.00 0.00 36.82 37.34 3h3l h ILE 136 CO 0.52 0.10 0.00 0.00 -1.08 0.00 0.00 178.15 177.68 3h3l n TYR 137 N -4.50 0.00 0.31 2.19 0.18 -1.26 -2.67 117.16 111.41 3h3l n TYR 137 Ca 0.14 0.00 0.13 0.00 1.88 0.00 0.00 57.90 60.05 3h3l n TYR 137 Cb 0.45 -0.08 0.32 0.00 -0.38 0.00 0.00 39.34 39.65 3h3l n TYR 137 CO 0.00 0.00 0.00 1.88 -2.08 0.00 0.00 176.86 176.66 3h3l h TYR 138 N 0.00 0.00 0.00 -3.48 -1.99 -1.74 -3.37 116.97 106.39 3h3l h TYR 138 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3h3l h TYR 138 Cb 0.07 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.80 3h3l h TYR 138 CO 0.00 0.00 -0.11 -1.13 -0.00 0.00 0.00 178.16 176.92 3h3l n SER 139 N -2.91 1.70 -3.67 3.88 3.41 -1.09 -4.65 113.62 110.29 3h3l n SER 139 Ca 0.04 -2.65 -0.14 0.00 -0.26 0.00 0.00 58.87 55.86 3h3l n SER 139 Cb 0.46 -0.31 -0.08 0.00 -0.26 0.00 0.00 64.21 64.01 3h3l n SER 139 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3h3l s SER 140 N -2.14 -0.50 0.66 4.04 0.15 -1.25 -3.92 113.70 110.73 3h3l s SER 140 Ca 0.20 0.81 -0.17 0.00 0.70 0.00 0.00 55.95 57.49 3h3l s SER 140 Cb 0.18 0.83 -0.00 0.00 -1.71 0.00 0.00 66.02 65.31 3h3l s SER 140 CO 0.02 -0.31 1.24 -2.16 1.20 0.00 0.00 173.24 173.22 3h3l s PRO 141 N -0.31 2.55 -0.21 5.44 0.04 -1.26 -4.78 135.00 136.47 3h3l s PRO 141 Ca -0.05 1.89 -0.05 0.00 0.04 0.00 0.00 61.00 62.83 3h3l s PRO 141 Cb -0.03 -1.87 -0.02 0.00 0.04 0.00 0.00 34.50 32.62 3h3l s PRO 141 CO 0.03 -1.55 -0.01 -2.00 0.04 0.00 0.00 177.00 173.51 3h3l s GLU 142 N -3.54 3.53 -0.54 4.56 2.12 -1.26 -3.98 118.70 119.59 3h3l s GLU 142 Ca 0.78 -0.55 -0.28 0.00 0.36 0.00 0.00 54.97 55.27 3h3l s GLU 142 Cb -0.32 -3.08 0.03 0.00 0.26 0.00 0.00 34.13 31.02 3h3l s GLU 142 CO 0.39 -0.08 1.16 -0.47 -0.54 0.00 0.00 175.26 175.72 3h3l s TYR 143 N 1.24 2.70 0.31 5.30 6.14 0.47 -0.74 117.35 132.77 3h3l s TYR 143 Ca 0.03 0.52 -0.29 0.00 0.64 0.00 0.00 57.07 57.98 3h3l s TYR 143 Cb -0.15 -4.46 -0.10 0.00 0.42 0.00 0.00 41.96 37.67 3h3l s TYR 143 CO 0.01 -1.44 1.22 -1.14 0.64 0.00 0.00 175.55 174.83 3h3l s GLN 144 N 4.70 4.48 -0.11 4.97 2.00 -0.54 -1.13 119.66 134.04 3h3l s GLN 144 Ca 0.45 2.04 0.03 0.00 -2.00 0.00 0.00 55.36 55.87 3h3l s GLN 144 Cb -0.07 -3.12 0.01 0.00 0.80 0.00 0.00 33.01 30.62 3h3l s GLN 144 CO 0.28 -0.02 -0.19 -0.51 -0.50 0.00 0.00 175.29 174.35 3h3l s LEU 145 N -1.60 1.92 -0.09 3.68 1.43 -0.75 -0.30 118.68 122.97 3h3l s LEU 145 Ca 0.47 -0.49 -0.27 0.00 -1.03 0.00 0.00 54.13 52.81 3h3l s LEU 145 Cb -0.36 -1.24 0.06 0.00 0.03 0.00 0.00 46.19 44.68 3h3l s LEU 145 CO 0.47 0.08 0.62 -0.22 0.23 0.00 0.00 176.35 177.53 3h3l s LEU 146 N 0.70 -0.40 -0.76 1.79 2.96 -1.26 -0.90 118.68 120.81 3h3l s LEU 146 Ca -0.12 0.77 -0.26 0.00 -0.22 0.00 0.00 54.13 54.31 3h3l s LEU 146 Cb -0.16 2.28 0.04 0.00 0.50 0.00 0.00 46.19 48.85 3h3l s LEU 146 CO 0.02 -0.49 1.24 -0.62 -1.32 0.00 0.00 176.35 175.19 3h3l s ASP 147 N -0.83 6.20 0.45 3.68 -1.08 -1.02 -4.53 116.67 119.55 3h3l s ASP 147 Ca -0.09 -0.66 0.12 0.00 -0.52 0.00 0.00 52.55 51.40 3h3l s ASP 147 Cb -0.02 -2.54 1.03 0.00 -1.46 0.00 0.00 42.92 39.94 3h3l s ASP 147 CO 0.07 -1.73 2.06 0.78 0.52 0.00 0.00 175.17 176.87 3h3l h ASN 148 N 9.91 0.30 0.83 -0.34 2.35 -1.95 -2.72 115.58 123.97 3h3l h ASN 148 Ca -0.23 -0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.42 3h3l h ASN 148 Cb 1.05 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.33 3h3l h ASN 148 CO 1.28 0.21 -0.46 -0.33 -1.65 0.00 0.00 177.43 176.48 3h3l h GLU 149 N 0.35 0.00 -2.14 0.81 5.08 -2.00 -3.46 114.58 113.22 3h3l h GLU 149 Ca 0.14 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.96 3h3l h GLU 149 Cb 0.14 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.98 3h3l h GLU 149 CO -0.03 0.46 -0.91 0.09 -1.00 0.00 0.00 179.01 177.62 3h3l n ASN 150 N -3.57 2.58 0.00 1.42 3.02 -1.03 -5.10 115.26 112.58 3h3l n ASN 150 Ca -0.00 -3.31 0.00 0.00 -0.03 0.00 0.00 54.58 51.24 3h3l n ASN 150 Cb 0.56 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 3h3l n ASN 150 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3h3l n PRO 152 N 0.19 2.29 0.27 3.52 -0.04 -1.26 -4.66 135.00 135.31 3h3l n PRO 152 Ca 0.28 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.88 3h3l n PRO 152 Cb 0.51 -0.81 0.74 0.00 -0.04 0.00 0.00 33.50 33.90 3h3l n PRO 152 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 3h3l h ASP 153 N 0.00 0.00 -0.97 3.54 3.58 -1.97 -2.72 116.42 117.89 3h3l h ASP 153 Ca 0.00 0.00 0.24 0.00 0.42 0.00 0.00 57.03 57.69 3h3l h ASP 153 Cb 0.14 0.00 -0.12 0.00 1.72 0.00 0.00 39.33 41.07 3h3l h ASP 153 CO 0.00 0.10 0.53 0.00 -2.88 0.00 0.00 179.24 176.99 3h3l h ALA 154 N 1.90 1.67 -0.02 -0.78 0.00 -1.89 -2.38 119.26 117.75 3h3l h ALA 154 Ca -0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3h3l h ALA 154 Cb 0.39 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3h3l h ALA 154 CO 0.01 -0.29 -0.14 -2.67 0.00 0.00 0.00 179.25 176.16 3h3l n TRP 155 N -4.94 0.00 1.69 0.00 2.14 -1.09 -4.29 117.44 110.96 3h3l n TRP 155 Ca 0.25 0.00 0.13 0.00 2.07 0.00 0.00 57.50 59.96 3h3l n TRP 155 Cb 0.71 0.00 0.65 0.00 -0.81 0.00 0.00 31.31 31.86 3h3l n TRP 155 CO 0.00 0.00 0.00 -0.85 2.07 0.00 0.00 177.69 178.91 3h3l n GLU 156 N 0.65 1.36 -0.19 -2.67 -0.00 -0.90 -4.86 120.64 114.04 3h3l n GLU 156 Ca 0.10 -0.53 -0.02 0.00 -0.00 0.00 0.00 57.16 56.71 3h3l n GLU 156 Cb 0.45 -1.45 0.01 0.00 -0.00 0.00 0.00 31.44 30.45 3h3l n GLU 156 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3h3l n GLY 157 N 1.06 -0.92 3.44 -1.84 0.00 -1.23 -5.02 105.19 100.68 3h3l n GLY 157 Ca 0.20 -1.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.09 3h3l n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3l n ASP 159 N 5.09 -5.12 0.00 0.00 2.03 -1.26 -2.19 116.55 115.09 3h3l n ASP 159 Ca -0.12 -0.62 0.00 0.00 0.52 0.00 0.00 54.79 54.57 3h3l n ASP 159 Cb 0.47 -4.74 0.00 0.00 -0.72 0.00 0.00 41.12 36.14 3h3l n ASP 159 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h3l n GLY 160 N -1.80 0.73 0.00 0.27 0.00 -1.26 -4.94 105.19 98.19 3h3l n GLY 160 Ca -0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.04 3h3l n GLY 160 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3h3l n ASN 161 N 0.00 0.00 -0.08 1.61 0.23 -0.93 -2.12 115.26 113.97 3h3l n ASN 161 Ca 0.00 -0.87 0.06 0.00 -0.53 0.00 0.00 54.58 53.23 3h3l n ASN 161 Cb 0.00 0.00 0.08 0.00 -2.08 0.00 0.00 39.78 37.78 3h3l n ASN 161 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3h3l n ARG 162 N -0.83 2.11 -1.70 -3.83 1.74 -1.26 -0.60 116.66 112.29 3h3l n ARG 162 Ca 0.10 -2.11 -0.30 0.00 -0.77 0.00 0.00 57.85 54.78 3h3l n ARG 162 Cb 0.05 -1.29 0.07 0.00 -1.02 0.00 0.00 32.46 30.27 3h3l n ARG 162 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3h3l s GLN 163 N -2.02 2.41 0.14 5.56 -0.21 -0.90 -4.38 119.66 120.26 3h3l s GLN 163 Ca 0.18 0.55 -0.34 0.00 0.02 0.00 0.00 55.36 55.77 3h3l s GLN 163 Cb 0.16 -1.96 -0.14 0.00 1.00 0.00 0.00 33.01 32.06 3h3l s GLN 163 CO 0.02 -1.37 1.57 0.00 -2.12 0.00 0.00 175.29 173.39 3h3l n ALA 164 N -3.25 1.10 0.00 6.09 0.00 -1.26 -1.45 120.51 121.73 3h3l n ALA 164 Ca 0.07 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.95 3h3l n ALA 164 Cb 0.57 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.69 3h3l n ALA 164 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h3l n GLY 165 N 3.38 1.78 3.70 0.00 0.00 0.58 -4.76 105.19 109.87 3h3l n GLY 165 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 3h3l n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3l s ALA 166 N -2.42 1.76 -0.49 4.61 0.00 -0.53 -4.64 121.76 120.05 3h3l s ALA 166 Ca 0.00 0.64 -0.28 0.00 0.00 0.00 0.00 51.96 52.32 3h3l s ALA 166 Cb 0.00 -3.44 0.03 0.00 0.00 0.00 0.00 23.12 19.71 3h3l s ALA 166 CO 0.00 -2.39 1.12 0.08 0.00 0.00 0.00 175.76 174.57 3h3l s VAL 167 N -2.48 4.21 -0.05 0.00 1.01 -0.41 -1.47 120.40 121.21 3h3l s VAL 167 Ca 0.68 1.11 -0.37 0.00 0.00 0.00 0.00 61.98 63.41 3h3l s VAL 167 Cb -0.24 -4.60 -0.15 0.00 0.00 0.00 0.00 36.38 31.39 3h3l s VAL 167 CO 0.54 -1.04 1.61 0.00 0.00 0.00 0.00 175.10 176.21 3h3l n TYR 168 N 7.84 1.96 -2.37 5.22 9.36 0.08 -1.74 117.16 137.51 3h3l n TYR 168 Ca 0.11 0.43 -0.15 0.00 3.32 0.00 0.00 57.90 61.61 3h3l n TYR 168 Cb 0.49 -2.47 -0.00 0.00 -0.63 0.00 0.00 39.34 36.73 3h3l n TYR 168 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 3h3l n ASP 169 N 4.33 -4.53 -3.13 2.98 2.03 0.23 -4.81 116.55 113.64 3h3l n ASP 169 Ca 0.22 -0.05 0.00 0.00 0.52 0.00 0.00 54.79 55.48 3h3l n ASP 169 Cb 0.20 -3.63 0.00 0.00 -0.72 0.00 0.00 41.12 36.97 3h3l n ASP 169 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 3h3l n ILE 171 N -4.04 0.00 -4.63 5.18 5.41 -0.71 -4.50 119.36 116.07 3h3l n ILE 171 Ca -0.16 0.00 -0.30 0.00 1.00 0.00 0.00 62.75 63.29 3h3l n ILE 171 Cb 0.63 -0.59 -0.13 0.00 -0.71 0.00 0.00 39.64 38.84 3h3l n ILE 171 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3h3l s PRO 173 N -1.71 1.86 -0.26 0.38 0.04 -1.26 -1.29 135.00 132.75 3h3l s PRO 173 Ca 0.00 -1.10 -0.04 0.00 0.04 0.00 0.00 61.00 59.90 3h3l s PRO 173 Cb 0.00 -2.08 0.14 0.00 0.04 0.00 0.00 34.50 32.60 3h3l s PRO 173 CO 0.00 0.51 0.48 0.34 0.04 0.00 0.00 177.00 178.37 3h3l s ASP 174 N -1.59 -0.50 1.22 6.66 -1.08 -0.05 -4.51 116.67 116.81 3h3l s ASP 174 Ca 0.14 0.73 -0.20 0.00 -0.52 0.00 0.00 52.55 52.70 3h3l s ASP 174 Cb -0.10 1.61 0.29 0.00 -1.46 0.00 0.00 42.92 43.27 3h3l s ASP 174 CO 0.05 -0.27 1.11 -2.16 0.52 0.00 0.00 175.17 174.43 3h3l s PRO 175 N 2.69 -1.36 -0.56 4.34 0.04 -1.26 -4.55 135.00 134.34 3h3l s PRO 175 Ca 0.10 -0.13 0.03 0.00 0.04 0.00 0.00 61.00 61.04 3h3l s PRO 175 Cb -0.14 -1.59 0.14 0.00 0.04 0.00 0.00 34.50 32.95 3h3l s PRO 175 CO -0.17 -3.79 0.31 -1.14 0.04 0.00 0.00 177.00 172.25 3h3l s GLN 176 N -5.46 2.12 -0.10 4.56 2.00 -1.26 -4.75 119.66 116.78 3h3l s GLN 176 Ca 0.72 -2.70 0.11 0.00 -2.00 0.00 0.00 55.36 51.48 3h3l s GLN 176 Cb -0.09 -3.39 0.49 0.00 0.80 0.00 0.00 33.01 30.83 3h3l s GLN 176 CO 0.56 -1.14 1.32 -0.35 -0.50 0.00 0.00 175.29 175.18 3h3l n PRO 177 N 3.02 3.00 -1.87 1.67 -0.05 -1.26 -4.98 135.00 134.53 3h3l n PRO 177 Ca 0.07 -1.92 -0.40 0.00 -0.05 0.00 0.00 63.50 61.20 3h3l n PRO 177 Cb 0.33 -1.76 0.01 0.00 -0.05 0.00 0.00 33.50 32.02 3h3l n PRO 177 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 175.50 175.99 3h3l s VAL 178 N -1.85 2.21 0.54 0.52 0.11 -1.26 -4.79 120.40 115.89 3h3l s VAL 178 Ca 0.34 0.19 -0.09 0.00 -2.93 0.00 0.00 61.98 59.49 3h3l s VAL 178 Cb 0.23 -3.12 -0.04 0.00 -1.53 0.00 0.00 36.38 31.92 3h3l s VAL 178 CO 0.15 0.03 0.91 -0.54 -3.33 0.00 0.00 175.10 172.32 3h3l s LYS 179 N -2.32 3.62 0.79 1.54 1.02 -1.26 -5.05 119.74 118.08 3h3l s LYS 179 Ca 0.58 0.53 -0.14 0.00 0.02 0.00 0.00 55.97 56.97 3h3l s LYS 179 Cb -0.43 -2.22 0.06 0.00 -0.52 0.00 0.00 37.83 34.72 3h3l s LYS 179 CO 0.56 -0.37 1.07 -2.30 -0.92 0.00 0.00 175.35 173.39 3h3l n PRO 180 N -2.37 0.24 -1.59 -1.68 -0.02 -1.26 -4.90 135.00 123.43 3h3l n PRO 180 Ca 0.04 0.15 -0.38 0.00 -2.02 0.00 0.00 63.50 61.29 3h3l n PRO 180 Cb 0.54 -2.33 0.05 0.00 -0.02 0.00 0.00 33.50 31.74 3h3l n PRO 180 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 3h3l n TYR 181 N -3.08 0.59 -0.73 6.00 0.18 -1.26 -2.89 117.16 115.98 3h3l n TYR 181 Ca 0.13 0.45 0.00 0.00 1.88 0.00 0.00 57.90 60.36 3h3l n TYR 181 Cb 0.50 -2.11 0.00 0.00 -0.38 0.00 0.00 39.34 37.35 3h3l n TYR 181 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3h3l n GLY 182 N 1.36 0.75 3.52 -7.48 0.00 0.45 -4.96 105.19 98.84 3h3l n GLY 182 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 3h3l n GLY 182 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3h3l s ASN 183 N -2.52 4.01 -0.20 1.61 0.01 -1.14 -4.96 114.94 111.74 3h3l s ASN 183 Ca 0.00 -0.57 -0.28 0.00 -0.71 0.00 0.00 52.86 51.30 3h3l s ASN 183 Cb 0.00 -0.60 -0.00 0.00 0.41 0.00 0.00 41.25 41.06 3h3l s ASN 183 CO 0.00 0.15 0.96 0.26 -1.51 0.00 0.00 177.10 176.96 3h3l s TRP 184 N -1.35 3.38 0.11 2.20 0.52 -1.26 -4.36 118.94 118.18 3h3l s TRP 184 Ca 0.20 1.39 0.01 0.00 0.02 0.00 0.00 56.10 57.72 3h3l s TRP 184 Cb -0.10 -3.17 -0.04 0.00 -1.15 0.00 0.00 33.47 29.01 3h3l s TRP 184 CO 0.12 -0.38 0.27 -0.80 0.02 0.00 0.00 176.95 176.17 3h3l s ASN 185 N 1.20 6.36 -0.18 2.95 0.01 0.46 -4.93 114.94 120.82 3h3l s ASN 185 Ca 0.42 0.27 -0.02 0.00 -0.71 0.00 0.00 52.86 52.81 3h3l s ASN 185 Cb -0.16 -1.95 -0.01 0.00 0.41 0.00 0.00 41.25 39.54 3h3l s ASN 185 CO 0.09 0.10 -0.08 -0.54 -1.51 0.00 0.00 177.10 175.16 3h3l s LYS 186 N -2.87 3.38 -0.07 -0.60 1.02 -1.26 -1.20 119.74 118.14 3h3l s LYS 186 Ca 0.36 -0.65 0.02 0.00 0.02 0.00 0.00 55.97 55.72 3h3l s LYS 186 Cb -0.12 -2.85 -0.03 0.00 -0.52 0.00 0.00 37.83 34.31 3h3l s LYS 186 CO 0.28 -0.03 -0.11 0.99 -0.92 0.00 0.00 175.35 175.56 3h3l s THR 187 N 1.02 3.35 -0.04 2.17 2.01 0.32 0.16 115.64 124.62 3h3l s THR 187 Ca -0.00 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 61.42 3h3l s THR 187 Cb -0.15 -2.35 0.00 0.00 0.01 0.00 0.00 72.50 70.02 3h3l s THR 187 CO -0.01 0.58 -0.13 -0.60 -0.69 0.00 0.00 174.62 173.78 3h3l s ARG 188 N -0.62 1.43 -0.11 4.92 3.52 -1.05 -1.56 118.95 125.48 3h3l s ARG 188 Ca 0.09 -0.46 0.02 0.00 -0.13 0.00 0.00 55.73 55.25 3h3l s ARG 188 Cb -0.11 -1.26 0.02 0.00 -1.56 0.00 0.00 34.95 32.03 3h3l s ARG 188 CO 0.01 0.16 -0.14 0.42 -0.81 0.00 0.00 175.30 174.94 3h3l s ILE 189 N 0.18 1.44 -0.11 4.11 1.01 0.14 -0.43 121.20 127.55 3h3l s ILE 189 Ca -0.05 -0.60 0.01 0.00 0.00 0.00 0.00 60.65 60.01 3h3l s ILE 189 Cb -0.11 -1.33 -0.02 0.00 0.01 0.00 0.00 42.46 41.02 3h3l s ILE 189 CO 0.02 0.43 -0.14 -0.69 0.00 0.00 0.00 174.94 174.56 3h3l s VAL 190 N 1.04 3.04 -0.13 2.92 1.01 -0.42 -0.54 120.40 127.32 3h3l s VAL 190 Ca -0.06 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.25 3h3l s VAL 190 Cb -0.15 -2.25 0.02 0.00 0.00 0.00 0.00 36.38 34.00 3h3l s VAL 190 CO -0.02 0.54 -0.14 -0.69 0.00 0.00 0.00 175.10 174.79 3h3l s VAL 191 N 0.03 1.49 -0.20 2.92 1.01 -0.50 -0.97 120.40 124.19 3h3l s VAL 191 Ca -0.05 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 3h3l s VAL 191 Cb -0.14 -1.40 0.10 0.00 0.00 0.00 0.00 36.38 34.94 3h3l s VAL 191 CO 0.04 0.44 0.27 -0.47 0.00 0.00 0.00 175.10 175.39 3h3l s TYR 192 N 1.35 -0.46 -1.39 5.22 5.04 0.12 -0.64 117.35 126.59 3h3l s TYR 192 Ca 0.01 0.52 -0.00 0.00 -2.44 0.00 0.00 57.07 55.16 3h3l s TYR 192 Cb -0.13 -0.20 -0.00 0.00 0.35 0.00 0.00 41.96 41.98 3h3l s TYR 192 CO -0.08 -0.60 0.45 0.09 -1.34 0.00 0.00 175.55 174.08 3h3l n ASN 193 N 5.34 -0.42 0.00 4.32 3.02 -1.26 -1.49 115.26 124.77 3h3l n ASN 193 Ca -0.05 -0.98 0.00 0.00 -0.03 0.00 0.00 54.58 53.52 3h3l n ASN 193 Cb 0.50 -3.20 0.00 0.00 -0.61 0.00 0.00 39.78 36.47 3h3l n ASN 193 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h3l n GLN 194 N -4.38 0.00 -2.72 3.52 6.02 -1.26 -4.99 117.38 113.57 3h3l n GLN 194 Ca -0.31 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.27 3h3l n GLN 194 Cb 0.69 -2.69 -0.05 0.00 1.02 0.00 0.00 30.24 29.21 3h3l n GLN 194 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3h3l s ARG 195 N -0.14 4.76 -0.07 -1.09 3.52 -0.56 -0.87 118.95 124.50 3h3l s ARG 195 Ca 0.00 1.49 0.04 0.00 -0.13 0.00 0.00 55.73 57.13 3h3l s ARG 195 Cb 0.00 -3.33 -0.00 0.00 -1.56 0.00 0.00 34.95 30.06 3h3l s ARG 195 CO 0.00 0.33 -0.20 0.08 -0.81 0.00 0.00 175.30 174.70 3h3l s VAL 196 N -0.53 1.69 -0.07 7.11 1.01 0.27 -0.70 120.40 129.19 3h3l s VAL 196 Ca 0.45 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.62 3h3l s VAL 196 Cb -0.25 -1.46 0.01 0.00 0.00 0.00 0.00 36.38 34.68 3h3l s VAL 196 CO 0.31 0.48 -0.13 -0.63 0.00 0.00 0.00 175.10 175.13 3h3l s ILE 197 N 0.20 1.17 -0.17 2.22 1.01 -0.14 -1.34 121.20 124.16 3h3l s ILE 197 Ca -0.10 -0.50 -0.09 0.00 0.00 0.00 0.00 60.65 59.96 3h3l s ILE 197 Cb -0.15 -1.06 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 3h3l s ILE 197 CO 0.05 0.36 0.12 -1.00 0.00 0.00 0.00 174.94 174.47 3h3l s HIS 198 N 0.63 3.45 0.00 3.97 3.76 -0.58 -1.30 115.29 125.22 3h3l s HIS 198 Ca -0.14 0.37 0.00 0.00 -0.15 0.00 0.00 55.06 55.14 3h3l s HIS 198 Cb -0.16 -2.07 0.00 0.00 1.11 0.00 0.00 32.58 31.46 3h3l s HIS 198 CO 0.04 0.43 0.00 0.66 -0.85 0.00 0.00 174.74 175.02 3h3l n TYR 199 N 2.97 0.00 0.00 1.40 4.02 0.43 -0.96 117.16 125.02 3h3l n TYR 199 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.72 3h3l n TYR 199 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.85 3h3l n TYR 199 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3h3l n ASN 201 N -0.75 0.00 -0.38 7.72 3.02 0.12 -2.52 115.26 122.48 3h3l n ASN 201 Ca 0.00 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.50 3h3l n ASN 201 Cb 0.00 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.15 3h3l n ASN 201 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3h3l n ASP 202 N 0.00 -4.27 -4.22 6.41 8.00 -1.26 -5.01 116.55 116.20 3h3l n ASP 202 Ca 0.00 0.12 -0.31 0.00 0.71 0.00 0.00 54.79 55.31 3h3l n ASP 202 Cb 0.00 -2.20 -0.17 0.00 -0.02 0.00 0.00 41.12 38.73 3h3l n ASP 202 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3h3l s VAL 203 N -1.96 1.99 0.17 2.53 1.01 -1.26 -5.10 120.40 117.78 3h3l s VAL 203 Ca 0.00 -1.00 -0.31 0.00 0.00 0.00 0.00 61.98 60.67 3h3l s VAL 203 Cb 0.00 -1.70 -0.09 0.00 0.00 0.00 0.00 36.38 34.59 3h3l s VAL 203 CO 0.00 0.55 1.44 -0.75 0.00 0.00 0.00 175.10 176.33 3h3l s LYS 204 N 0.16 4.29 -0.00 2.72 2.20 -1.26 -4.37 119.74 123.48 3h3l s LYS 204 Ca -0.12 2.20 0.03 0.00 -0.36 0.00 0.00 55.97 57.71 3h3l s LYS 204 Cb -0.16 -3.18 -0.04 0.00 -1.51 0.00 0.00 37.83 32.94 3h3l s LYS 204 CO 0.07 -0.45 0.07 0.44 -0.36 0.00 0.00 175.35 175.11 3h3l n ILE 205 N 3.39 0.00 -3.54 5.43 -5.35 -0.13 -4.31 119.36 114.85 3h3l n ILE 205 Ca 0.10 -0.12 -0.07 0.00 -0.27 0.00 0.00 62.75 62.39 3h3l n ILE 205 Cb 0.41 0.53 -0.02 0.00 -1.74 0.00 0.00 39.64 38.82 3h3l n ILE 205 CO 0.00 0.00 0.00 -1.48 -1.76 0.00 0.00 176.55 173.31 3h3l s LEU 206 N -3.01 -0.28 -0.08 7.28 0.05 -1.21 -0.87 118.68 120.55 3h3l s LEU 206 Ca -0.01 0.01 -0.14 0.00 0.05 0.00 0.00 54.13 54.05 3h3l s LEU 206 Cb 0.02 1.79 0.03 0.00 -2.05 0.00 0.00 46.19 45.97 3h3l s LEU 206 CO 0.11 -0.47 0.34 -0.70 -0.55 0.00 0.00 176.35 175.08 3h3l s GLU 207 N -2.81 0.53 0.37 1.48 2.12 -1.26 -1.53 118.70 117.60 3h3l s GLU 207 Ca 0.06 0.20 -0.12 0.00 0.36 0.00 0.00 54.97 55.48 3h3l s GLU 207 Cb -0.01 0.25 0.04 0.00 0.26 0.00 0.00 34.13 34.67 3h3l s GLU 207 CO -0.07 -0.11 0.69 -0.59 -0.54 0.00 0.00 175.26 174.64 3h3l s PHE 208 N -0.47 0.42 -0.08 5.30 -0.71 -0.45 -5.00 117.98 116.99 3h3l s PHE 208 Ca -0.06 -0.96 -0.01 0.00 -1.04 0.00 0.00 56.93 54.86 3h3l s PHE 208 Cb -0.04 0.55 0.03 0.00 -1.21 0.00 0.00 43.02 42.36 3h3l s PHE 208 CO 0.02 -1.44 -0.02 -1.14 -1.34 0.00 0.00 175.22 171.29 3h3l s GLN 209 N -2.52 0.89 0.87 1.99 2.00 -1.26 -0.57 119.66 121.07 3h3l s GLN 209 Ca 0.20 -0.01 -0.11 0.00 -2.00 0.00 0.00 55.36 53.44 3h3l s GLN 209 Cb -0.04 -1.14 0.12 0.00 0.80 0.00 0.00 33.01 32.75 3h3l s GLN 209 CO 0.14 -0.28 1.15 -0.06 -0.50 0.00 0.00 175.29 175.74 3h3l s PHE 210 N 1.82 1.80 -0.80 1.67 0.08 -0.05 -3.98 117.98 118.52 3h3l s PHE 210 Ca 0.04 1.74 0.00 0.00 0.12 0.00 0.00 56.93 58.83 3h3l s PHE 210 Cb -0.12 -3.31 0.00 0.00 -0.57 0.00 0.00 43.02 39.01 3h3l s PHE 210 CO -0.06 -2.64 0.00 0.41 -0.10 0.00 0.00 175.22 172.83 3h3l n GLY 211 N 0.01 0.94 3.46 4.36 0.00 -1.26 -4.90 105.19 107.79 3h3l n GLY 211 Ca 0.12 -0.70 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 3h3l n GLY 211 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h3l s THR 212 N -2.29 2.44 0.50 2.61 -4.23 -1.26 -5.03 115.64 108.39 3h3l s THR 212 Ca 0.00 -2.38 0.16 0.00 -1.18 0.00 0.00 61.69 58.29 3h3l s THR 212 Cb 0.00 -2.28 0.25 0.00 1.34 0.00 0.00 72.50 71.81 3h3l s THR 212 CO 0.00 -0.39 2.12 1.55 -0.54 0.00 0.00 174.62 177.36 3h3l h PRO 213 N 2.35 0.00 -0.24 3.99 0.13 -1.95 -1.54 132.00 134.75 3h3l h PRO 213 Ca -0.40 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.72 3h3l h PRO 213 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 3h3l h PRO 213 CO 0.59 0.04 0.12 0.28 -0.23 0.00 0.00 178.00 178.81 3h3l h VAL 214 N 0.00 1.13 -0.45 1.56 2.07 -1.96 0.20 116.25 118.80 3h3l h VAL 214 Ca -0.00 -0.37 0.06 0.00 0.82 0.00 0.00 66.70 67.22 3h3l h VAL 214 Cb 0.07 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 3h3l h VAL 214 CO 0.01 0.13 0.14 -0.25 0.02 0.00 0.00 177.57 177.61 3h3l h TRP 215 N 0.27 0.24 -0.59 1.57 2.91 -1.56 -0.70 115.95 118.09 3h3l h TRP 215 Ca 0.08 0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.15 3h3l h TRP 215 Cb 0.10 -0.04 -0.03 0.00 -0.51 0.00 0.00 29.16 28.67 3h3l h TRP 215 CO -0.03 0.07 0.37 -0.09 -1.03 0.00 0.00 178.44 177.74 3h3l h ARG 216 N 0.30 0.73 -0.72 2.65 2.43 -0.98 -0.40 114.38 118.37 3h3l h ARG 216 Ca 0.22 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.36 3h3l h ARG 216 Cb 0.24 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 3h3l h ARG 216 CO -0.24 0.48 0.47 0.00 -1.51 0.00 0.00 179.97 179.18 3h3l h ALA 217 N 1.24 0.93 -0.32 2.80 0.00 -0.47 0.12 119.26 123.56 3h3l h ALA 217 Ca 0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3h3l h ALA 217 Cb -0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3h3l h ALA 217 CO -0.08 0.31 0.11 -0.07 0.00 0.00 0.00 179.25 179.52 3h3l h LEU 218 N 0.96 0.46 -0.65 0.00 3.38 -0.52 -2.64 115.31 116.29 3h3l h LEU 218 Ca 0.27 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3h3l h LEU 218 Cb -0.07 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 3h3l h LEU 218 CO -0.07 0.53 0.38 0.58 0.09 0.00 0.00 178.44 179.95 3h3l h VAL 219 N 0.37 1.20 -0.38 1.22 2.07 -0.85 -2.92 116.25 116.96 3h3l h VAL 219 Ca 0.10 -0.46 0.11 0.00 0.82 0.00 0.00 66.70 67.28 3h3l h VAL 219 Cb 0.23 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3h3l h VAL 219 CO -0.00 0.21 0.29 0.44 0.02 0.00 0.00 177.57 178.52 3h3l h ASP 220 N 0.88 0.00 -0.26 0.57 3.32 -0.42 -1.50 116.42 119.01 3h3l h ASP 220 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 3h3l h ASP 220 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3h3l h ASP 220 CO -0.04 0.00 0.00 1.41 -1.72 0.00 0.00 179.24 178.89 3h3l n HIS 221 N -4.27 0.33 -2.99 4.55 8.25 -1.05 -4.67 115.22 115.37 3h3l n HIS 221 Ca 0.06 -0.16 -0.19 0.00 -0.26 0.00 0.00 57.72 57.17 3h3l n HIS 221 Cb 0.47 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.63 3h3l n HIS 221 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3h3l s SER 222 N -1.65 5.30 0.42 0.41 1.04 -0.56 -4.98 113.70 113.68 3h3l s SER 222 Ca 0.35 -0.62 0.29 0.00 0.48 0.00 0.00 55.95 56.45 3h3l s SER 222 Cb 0.22 -0.14 1.49 0.00 0.10 0.00 0.00 66.02 67.68 3h3l s SER 222 CO 0.31 -1.12 1.89 0.07 0.98 0.00 0.00 173.24 175.36 3h3l h LYS 223 N 0.33 0.00 -0.01 4.02 2.10 -1.83 -2.41 116.57 118.77 3h3l h LYS 223 Ca -0.35 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.30 3h3l h LYS 223 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 3h3l h LYS 223 CO 0.43 0.00 -0.03 1.19 -2.00 0.00 0.00 179.45 179.04 3h3l n PHE 224 N -2.54 0.00 -2.61 0.07 3.72 -1.26 -0.12 117.46 114.71 3h3l n PHE 224 Ca -0.01 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.01 3h3l n PHE 224 Cb 0.10 -0.04 -0.05 0.00 -0.94 0.00 0.00 39.48 38.55 3h3l n PHE 224 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3h3l s SER 225 N -2.11 7.15 0.61 4.37 0.15 -0.91 -2.68 113.70 120.28 3h3l s SER 225 Ca 0.39 2.04 0.37 0.00 0.70 0.00 0.00 55.95 59.45 3h3l s SER 225 Cb 0.21 -2.60 1.97 0.00 -1.71 0.00 0.00 66.02 63.90 3h3l s SER 225 CO 0.38 -0.21 2.24 0.07 1.20 0.00 0.00 173.24 176.92 3h3l h LYS 226 N 3.22 0.00 -0.01 5.44 2.10 -1.90 -2.69 116.57 122.74 3h3l h LYS 226 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 3h3l h LYS 226 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 3h3l h LYS 226 CO 0.65 0.02 -0.06 1.19 -2.00 0.00 0.00 179.45 179.25 3h3l n PHE 227 N -3.36 0.00 -2.30 0.07 3.72 -1.26 -4.99 117.46 109.33 3h3l n PHE 227 Ca -0.02 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.97 3h3l n PHE 227 Cb 0.14 -0.05 -0.03 0.00 -0.94 0.00 0.00 39.48 38.60 3h3l n PHE 227 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3h3l s SER 228 N -2.16 7.01 -0.17 4.37 0.15 -1.01 -4.96 113.70 116.94 3h3l s SER 228 Ca 0.36 2.46 0.17 0.00 0.70 0.00 0.00 55.95 59.64 3h3l s SER 228 Cb 0.21 -2.64 0.45 0.00 -1.71 0.00 0.00 66.02 62.33 3h3l s SER 228 CO 0.39 -0.34 1.33 0.35 1.20 0.00 0.00 173.24 176.17 3h3l n THR 229 N 0.97 2.16 -1.93 6.45 -2.24 -1.26 -4.97 114.28 113.45 3h3l n THR 229 Ca -0.00 -2.06 -0.37 0.00 -2.27 0.00 0.00 64.05 59.34 3h3l n THR 229 Cb 0.43 -0.25 0.03 0.00 -2.10 0.00 0.00 70.33 68.44 3h3l n THR 229 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3h3l s SER 230 N -2.30 5.37 0.36 3.42 0.15 -1.26 -4.93 113.70 114.52 3h3l s SER 230 Ca 0.39 2.58 0.27 0.00 0.70 0.00 0.00 55.95 59.88 3h3l s SER 230 Cb 0.32 -2.62 0.93 0.00 -1.71 0.00 0.00 66.02 62.95 3h3l s SER 230 CO 0.06 -1.48 1.78 1.55 1.20 0.00 0.00 173.24 176.36 3h3l h PRO 231 N 1.37 0.00 -0.89 5.44 0.13 -2.01 -2.54 132.00 133.51 3h3l h PRO 231 Ca -0.50 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.30 3h3l h PRO 231 Cb 1.29 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.23 3h3l h PRO 231 CO 0.57 0.00 0.41 -0.85 -0.23 0.00 0.00 178.00 177.90 3h3l n GLU 232 N -2.64 2.82 -1.75 0.86 0.28 -1.26 -5.03 120.64 113.92 3h3l n GLU 232 Ca 0.03 -2.71 -0.41 0.00 -0.16 0.00 0.00 57.16 53.91 3h3l n GLU 232 Cb 0.35 -2.09 0.01 0.00 1.43 0.00 0.00 31.44 31.14 3h3l n GLU 232 CO 0.00 0.00 0.00 0.36 -0.16 0.00 0.00 177.13 177.33 3h3l n LYS 233 N -0.50 2.35 -3.30 3.44 2.85 -0.96 -4.94 118.16 117.10 3h3l n LYS 233 Ca 0.45 0.83 -0.25 0.00 -1.05 0.00 0.00 58.31 58.28 3h3l n LYS 233 Cb 1.41 -2.56 -0.08 0.00 -0.65 0.00 0.00 35.03 33.15 3h3l n LYS 233 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3h3l h PRO 235 N 4.31 0.00 0.00 0.00 0.13 -1.71 -1.67 132.00 133.06 3h3l h PRO 235 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3h3l h PRO 235 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 3h3l h PRO 235 CO 0.55 0.04 0.00 0.39 -0.23 0.00 0.00 178.00 178.75 3h3l n GLU 236 N -3.38 0.00 0.01 0.86 1.02 -1.26 -2.33 120.64 115.55 3h3l n GLU 236 Ca -0.02 0.27 0.14 0.00 -0.02 0.00 0.00 57.16 57.53 3h3l n GLU 236 Cb 0.17 -1.50 0.60 0.00 -0.02 0.00 0.00 31.44 30.69 3h3l n GLU 236 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h3l n ALA 237 N -1.50 2.36 0.15 0.62 0.00 -0.63 -4.62 120.51 116.89 3h3l n ALA 237 Ca 0.03 -0.10 -0.14 0.00 0.00 0.00 0.00 53.44 53.23 3h3l n ALA 237 Cb 0.16 -1.46 -0.07 0.00 0.00 0.00 0.00 19.45 18.08 3h3l n ALA 237 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 3h3l h TYR 238 N 0.00 -0.95 -0.35 0.00 3.20 -1.24 -2.84 116.97 114.79 3h3l h TYR 238 Ca 0.00 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.79 3h3l h TYR 238 Cb 0.51 0.39 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 3h3l h TYR 238 CO 0.00 -0.47 -0.18 -0.44 -1.64 0.00 0.00 178.16 175.43 3h3l h ASP 239 N -0.63 0.65 0.00 -2.11 3.32 -1.85 -1.44 116.42 114.37 3h3l h ASP 239 Ca 0.01 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.85 3h3l h ASP 239 Cb 0.62 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.00 3h3l h ASP 239 CO -0.15 0.84 0.00 0.18 -1.72 0.00 0.00 179.24 178.39 3h3l n LEU 240 N -4.14 0.09 0.00 1.55 4.77 -1.07 -2.54 117.00 115.66 3h3l n LEU 240 Ca 0.00 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 3h3l n LEU 240 Cb 0.39 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 3h3l n LEU 240 CO 0.43 0.02 0.00 0.18 -1.33 0.00 0.00 177.39 176.68 3h3l n LEU 242 N 0.72 0.00 -0.79 2.23 4.77 -0.54 -2.77 117.00 120.62 3h3l n LEU 242 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 3h3l n LEU 242 Cb 0.02 0.00 0.30 0.00 -2.33 0.00 0.00 43.42 41.40 3h3l n LEU 242 CO 0.00 0.00 0.73 0.00 -1.33 0.00 0.00 177.39 176.79 3h3l n GLN 243 N 0.00 2.03 -1.62 3.23 1.13 -1.05 -4.60 117.38 116.49 3h3l n GLN 243 Ca 0.00 -1.56 -0.46 0.00 -1.94 0.00 0.00 57.00 53.05 3h3l n GLN 243 Cb 0.00 -1.43 -0.02 0.00 0.11 0.00 0.00 30.24 28.90 3h3l n GLN 243 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3h3l n GLY 245 N 1.64 0.91 0.24 0.00 0.00 -1.26 -4.54 105.19 102.18 3h3l n GLY 245 Ca 0.11 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.27 3h3l n GLY 245 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h3l n LYS 246 N -2.16 1.15 -3.83 1.61 5.02 -0.96 -4.82 118.16 114.17 3h3l n LYS 246 Ca 0.00 -0.48 -0.09 0.00 -2.02 0.00 0.00 58.31 55.72 3h3l n LYS 246 Cb 0.00 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.48 3h3l n LYS 246 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 3h3l s GLN 247 N -2.18 1.47 0.82 1.97 0.00 -1.26 -5.16 119.66 115.33 3h3l s GLN 247 Ca 0.36 -0.99 -0.12 0.00 -0.00 0.00 0.00 55.36 54.62 3h3l s GLN 247 Cb 0.21 0.52 0.09 0.00 0.00 0.00 0.00 33.01 33.83 3h3l s GLN 247 CO 0.40 -0.63 1.15 -2.14 0.00 0.00 0.00 175.29 174.08 3h3l s PRO 248 N -3.92 1.65 0.30 9.60 0.02 -1.26 -4.90 135.00 136.49 3h3l s PRO 248 Ca 0.13 1.54 -0.12 0.00 0.02 0.00 0.00 61.00 62.57 3h3l s PRO 248 Cb -0.02 -1.80 0.01 0.00 0.02 0.00 0.00 34.50 32.72 3h3l s PRO 248 CO 0.02 -2.16 0.57 0.20 -0.33 0.00 0.00 177.00 175.30 3h3l s GLY 249 N -2.60 0.64 0.16 0.52 0.00 0.15 -4.87 107.32 101.31 3h3l s GLY 249 Ca 0.68 -0.92 -0.03 0.00 0.00 0.00 0.00 44.72 44.45 3h3l s GLY 249 CO 0.53 -0.58 0.37 -0.19 0.00 0.00 0.00 173.10 173.23 3h3l s TYR 250 N -3.44 3.48 -0.14 1.90 2.02 0.68 -0.85 117.35 121.00 3h3l s TYR 250 Ca 0.21 0.46 -0.06 0.00 -0.37 0.00 0.00 57.07 57.31 3h3l s TYR 250 Cb -0.02 -1.93 -0.04 0.00 -0.40 0.00 0.00 41.96 39.57 3h3l s TYR 250 CO 0.12 0.43 0.08 0.42 -1.57 0.00 0.00 175.55 175.02 3h3l s ILE 251 N -1.72 4.95 0.00 2.71 1.01 -1.26 -1.55 121.20 125.34 3h3l s ILE 251 Ca 0.40 0.01 0.00 0.00 0.00 0.00 0.00 60.65 61.06 3h3l s ILE 251 Cb -0.12 -3.17 0.00 0.00 0.01 0.00 0.00 42.46 39.18 3h3l s ILE 251 CO 0.26 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.36 3h3l n GLY 252 N 2.68 2.94 3.36 6.18 0.00 -0.48 -1.32 105.19 118.55 3h3l n GLY 252 Ca -0.18 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 3h3l n GLY 252 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3h3l s GLN 254 N 3.30 2.96 0.84 1.61 0.74 -0.77 -0.68 119.66 127.66 3h3l s GLN 254 Ca 0.00 -0.75 -0.12 0.00 0.05 0.00 0.00 55.36 54.54 3h3l s GLN 254 Cb 0.00 -2.44 0.10 0.00 1.10 0.00 0.00 33.01 31.77 3h3l s GLN 254 CO 0.00 0.35 1.11 0.16 -0.55 0.00 0.00 175.29 176.36 3h3l s ASP 255 N -0.03 4.12 -1.41 6.67 -4.77 -1.26 -3.60 116.67 116.39 3h3l s ASP 255 Ca -0.05 1.17 -0.02 0.00 -3.30 0.00 0.00 52.55 50.35 3h3l s ASP 255 Cb -0.14 -1.84 0.01 0.00 -1.09 0.00 0.00 42.92 39.86 3h3l s ASP 255 CO 0.04 -2.19 0.20 1.41 0.70 0.00 0.00 175.17 175.33 3h3l n HIS 256 N -3.55 -1.46 -2.76 2.11 8.25 -1.26 -4.91 115.22 111.63 3h3l n HIS 256 Ca 0.07 0.18 -0.43 0.00 -0.26 0.00 0.00 57.72 57.27 3h3l n HIS 256 Cb 0.57 -3.51 0.00 0.00 1.12 0.00 0.00 29.99 28.18 3h3l n HIS 256 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h3l n GLY 257 N -1.07 4.49 3.74 -1.41 0.00 -1.24 -4.88 105.19 104.83 3h3l n GLY 257 Ca -0.15 -2.28 -0.41 0.00 0.00 0.00 0.00 46.02 43.18 3h3l n GLY 257 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h3l s TYR 258 N -0.36 3.37 0.00 1.61 2.02 -1.05 -3.52 117.35 119.42 3h3l s TYR 258 Ca 0.37 1.40 0.00 0.00 -0.37 0.00 0.00 57.07 58.47 3h3l s TYR 258 Cb 0.03 -3.48 0.00 0.00 -0.40 0.00 0.00 41.96 38.12 3h3l s TYR 258 CO 0.02 -1.35 0.00 0.41 -1.57 0.00 0.00 175.55 173.06 3h3l n GLY 259 N 2.04 0.49 3.28 0.71 0.00 -1.26 -2.02 105.19 108.42 3h3l n GLY 259 Ca 0.04 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.27 3h3l n GLY 259 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h3l s VAL 260 N -2.00 2.57 -0.01 1.61 1.01 -1.23 0.48 120.40 122.84 3h3l s VAL 260 Ca 0.00 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.21 3h3l s VAL 260 Cb 0.00 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 3h3l s VAL 260 CO 0.00 0.53 -0.17 0.00 0.00 0.00 0.00 175.10 175.46 3h3l s PHE 262 N -0.81 2.01 0.28 0.00 0.08 0.13 -1.46 117.98 118.21 3h3l s PHE 262 Ca 0.13 -0.50 -0.06 0.00 0.12 0.00 0.00 56.93 56.61 3h3l s PHE 262 Cb -0.10 -1.32 -0.01 0.00 -0.57 0.00 0.00 43.02 41.02 3h3l s PHE 262 CO 0.03 -0.12 0.42 -0.98 -0.10 0.00 0.00 175.22 174.46 3h3l s ARG 263 N -0.25 1.65 -1.13 0.44 1.70 -0.29 -0.97 118.95 120.11 3h3l s ARG 263 Ca 0.01 -1.54 -0.21 0.00 -0.47 0.00 0.00 55.73 53.53 3h3l s ARG 263 Cb -0.11 0.43 -0.01 0.00 -0.57 0.00 0.00 34.95 34.69 3h3l s ARG 263 CO 0.01 -0.67 0.80 0.09 -1.08 0.00 0.00 175.30 174.46 3h3l n ASN 264 N -0.81 -5.39 -4.50 -2.89 3.02 -1.26 -1.08 115.26 102.34 3h3l n ASN 264 Ca 0.00 -1.01 -0.38 0.00 -0.03 0.00 0.00 54.58 53.16 3h3l n ASN 264 Cb 0.62 -3.42 -0.12 0.00 -0.61 0.00 0.00 39.78 36.26 3h3l n ASN 264 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h3l s ILE 265 N -3.46 4.78 0.12 2.41 1.01 -1.26 -3.85 121.20 120.95 3h3l s ILE 265 Ca 0.48 -0.10 -0.13 0.00 0.00 0.00 0.00 60.65 60.90 3h3l s ILE 265 Cb -0.17 -3.30 0.02 0.00 0.01 0.00 0.00 42.46 39.02 3h3l s ILE 265 CO 0.86 0.24 0.32 0.00 0.00 0.00 0.00 174.94 176.36 3h3l s ARG 266 N 1.67 1.01 -0.04 2.79 1.70 -0.35 -3.60 118.95 122.14 3h3l s ARG 266 Ca 0.06 -0.85 -0.07 0.00 -0.47 0.00 0.00 55.73 54.41 3h3l s ARG 266 Cb -0.16 0.42 0.01 0.00 -0.57 0.00 0.00 34.95 34.65 3h3l s ARG 266 CO 0.07 -0.37 0.16 -1.50 -1.08 0.00 0.00 175.30 172.58 3h3l s ILE 267 N -3.84 0.04 -0.20 4.99 2.07 -0.56 -0.79 121.20 122.90 3h3l s ILE 267 Ca 0.05 -0.29 0.01 0.00 -1.41 0.00 0.00 60.65 59.01 3h3l s ILE 267 Cb 0.03 -0.33 0.03 0.00 0.13 0.00 0.00 42.46 42.32 3h3l s ILE 267 CO -0.10 -0.16 -0.17 -0.75 -1.91 0.00 0.00 174.94 171.85 3h3l s LYS 268 N -0.54 2.69 0.25 3.50 2.20 0.03 -0.35 119.74 127.53 3h3l s LYS 268 Ca -0.06 -0.95 -0.30 0.00 -0.36 0.00 0.00 55.97 54.30 3h3l s LYS 268 Cb -0.04 -2.62 -0.09 0.00 -1.51 0.00 0.00 37.83 33.57 3h3l s LYS 268 CO 0.01 -0.32 1.03 -1.21 -0.36 0.00 0.00 175.35 174.49 3h3l s GLU 269 N 1.26 4.74 0.00 4.03 2.02 -1.26 -0.63 118.70 128.85 3h3l s GLU 269 Ca 0.01 1.65 0.12 0.00 0.02 0.00 0.00 54.97 56.78 3h3l s GLU 269 Cb -0.15 -3.24 0.10 0.00 0.10 0.00 0.00 34.13 30.94 3h3l s GLU 269 CO -0.10 0.34 0.89 1.28 0.02 0.00 0.00 175.26 177.69