#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ll4 n GLY 37 N 0.00 0.22 3.86 -0.02 0.00 -1.26 -4.94 105.19 103.05 1ll4 n GLY 37 Ca 0.00 -1.83 -0.31 0.00 0.00 0.00 0.00 46.02 43.88 1ll4 n GLY 37 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ll4 s PHE 38 N 0.29 3.48 0.14 1.61 0.40 0.22 -3.80 117.98 120.33 1ll4 s PHE 38 Ca 0.00 1.28 -0.03 0.00 -0.60 0.00 0.00 56.93 57.59 1ll4 s PHE 38 Cb 0.00 -2.65 -0.05 0.00 0.51 0.00 0.00 43.02 40.83 1ll4 s PHE 38 CO 0.00 -0.31 0.35 1.03 0.70 0.00 0.00 175.22 176.99 1ll4 s ARG 39 N -4.13 3.56 -0.34 0.44 0.52 0.97 0.40 118.95 120.38 1ll4 s ARG 39 Ca 0.56 -0.21 -0.01 0.00 -0.52 0.00 0.00 55.73 55.54 1ll4 s ARG 39 Cb -0.10 -2.88 0.12 0.00 0.52 0.00 0.00 34.95 32.61 1ll4 s ARG 39 CO 0.34 0.48 0.17 0.45 0.02 0.00 0.00 175.30 176.76 1ll4 s SER 40 N -2.61 3.39 -0.18 0.23 0.15 -1.25 -1.06 113.70 112.38 1ll4 s SER 40 Ca 0.39 -1.89 -0.06 0.00 0.70 0.00 0.00 55.95 55.10 1ll4 s SER 40 Cb -0.12 -0.54 -0.03 0.00 -1.71 0.00 0.00 66.02 63.62 1ll4 s SER 40 CO 0.26 -0.36 0.01 -0.69 1.20 0.00 0.00 173.24 173.67 1ll4 s VAL 41 N 1.37 4.29 0.15 4.45 1.01 -0.02 -0.94 120.40 130.73 1ll4 s VAL 41 Ca 0.14 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.99 1ll4 s VAL 41 Cb -0.20 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 1ll4 s VAL 41 CO -0.15 0.46 -0.17 0.54 0.00 0.00 0.00 175.10 175.79 1ll4 s VAL 42 N 0.50 1.67 -0.15 2.92 0.11 -0.36 -0.15 120.40 124.94 1ll4 s VAL 42 Ca -0.00 -1.86 -0.08 0.00 -2.93 0.00 0.00 61.98 57.11 1ll4 s VAL 42 Cb -0.14 -1.76 -0.04 0.00 -1.53 0.00 0.00 36.38 32.92 1ll4 s VAL 42 CO 0.02 -0.35 0.13 -0.31 -3.33 0.00 0.00 175.10 171.25 1ll4 s TYR 43 N -2.11 3.50 -0.16 1.54 1.51 -0.81 -0.41 117.35 120.41 1ll4 s TYR 43 Ca 0.14 0.43 -0.01 0.00 -1.01 0.00 0.00 57.07 56.61 1ll4 s TYR 43 Cb -0.05 -2.02 -0.01 0.00 -0.11 0.00 0.00 41.96 39.77 1ll4 s TYR 43 CO 0.05 0.54 -0.11 0.12 -1.11 0.00 0.00 175.55 175.05 1ll4 s PHE 44 N -0.47 2.86 -0.27 2.71 2.19 0.73 -1.20 117.98 124.53 1ll4 s PHE 44 Ca 0.12 -0.78 -0.06 0.00 0.33 0.00 0.00 56.93 56.54 1ll4 s PHE 44 Cb -0.12 -1.93 0.00 0.00 -1.31 0.00 0.00 43.02 39.67 1ll4 s PHE 44 CO 0.02 -0.34 0.04 0.54 1.83 0.00 0.00 175.22 177.30 1ll4 s VAL 45 N 0.73 3.76 0.00 3.12 0.11 -1.26 -0.70 120.40 126.16 1ll4 s VAL 45 Ca -0.05 -0.62 0.00 0.00 -2.93 0.00 0.00 61.98 58.38 1ll4 s VAL 45 Cb -0.15 -2.86 0.00 0.00 -1.53 0.00 0.00 36.38 31.83 1ll4 s VAL 45 CO 0.02 0.20 0.00 -3.20 -3.33 0.00 0.00 175.10 168.79 1ll4 n ASN 46 N 4.84 0.00 0.00 3.54 2.85 0.12 -0.60 115.26 126.01 1ll4 n ASN 46 Ca -0.16 0.00 0.14 0.00 -0.11 0.00 0.00 54.58 54.45 1ll4 n ASN 46 Cb 0.49 0.00 0.77 0.00 1.24 0.00 0.00 39.78 42.28 1ll4 n ASN 46 CO 0.00 0.00 0.00 -2.67 -2.11 0.00 0.00 177.26 172.48 1ll4 n TRP 47 N -3.38 0.00 0.27 1.20 2.14 -1.26 -3.73 117.44 112.68 1ll4 n TRP 47 Ca 0.00 0.00 0.16 0.00 2.07 0.00 0.00 57.50 59.73 1ll4 n TRP 47 Cb 0.00 -0.18 0.65 0.00 -0.81 0.00 0.00 31.31 30.97 1ll4 n TRP 47 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1ll4 h ALA 48 N 3.52 1.01 0.00 -1.67 0.00 -1.12 -2.59 119.26 118.40 1ll4 h ALA 48 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ll4 h ALA 48 Cb 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ll4 h ALA 48 CO 0.00 0.03 0.00 0.44 0.00 0.00 0.00 179.25 179.72 1ll4 n ILE 49 N -3.13 0.86 0.00 0.00 -5.35 -1.09 -1.01 119.36 109.64 1ll4 n ILE 49 Ca 0.01 0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.70 1ll4 n ILE 49 Cb 0.32 -0.95 0.00 0.00 -1.74 0.00 0.00 39.64 37.27 1ll4 n ILE 49 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1ll4 n TYR 50 N -1.45 0.00 0.07 4.28 4.01 -0.98 -4.51 117.16 118.59 1ll4 n TYR 50 Ca 0.04 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.87 1ll4 n TYR 50 Cb 0.17 0.00 0.55 0.00 -0.31 0.00 0.00 39.34 39.74 1ll4 n TYR 50 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1ll4 h GLY 51 N 0.00 0.31 2.00 2.72 0.00 -1.78 -0.76 103.07 105.57 1ll4 h GLY 51 Ca 0.00 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.18 1ll4 h GLY 51 CO 0.00 0.09 -0.22 3.21 0.00 0.00 0.00 176.54 179.62 1ll4 h ARG 52 N 0.26 0.00 -0.62 4.80 3.08 -1.82 -3.47 114.38 116.61 1ll4 h ARG 52 Ca 0.14 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.94 1ll4 h ARG 52 Cb 0.21 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.17 1ll4 h ARG 52 CO -0.03 0.22 -0.22 0.41 -1.07 0.00 0.00 179.97 179.28 1ll4 n GLY 53 N 0.55 1.22 3.65 0.04 0.00 -0.29 -4.99 105.19 105.37 1ll4 n GLY 53 Ca 0.01 -0.47 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 1ll4 n GLY 53 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ll4 s HIS 54 N -2.45 3.30 0.31 1.61 5.04 -0.18 -4.93 115.29 117.99 1ll4 s HIS 54 Ca 0.00 0.27 0.09 0.00 -1.54 0.00 0.00 55.06 53.89 1ll4 s HIS 54 Cb 0.00 -2.34 -0.05 0.00 0.04 0.00 0.00 32.58 30.23 1ll4 s HIS 54 CO 0.00 0.00 0.02 -0.80 -2.34 0.00 0.00 174.74 171.62 1ll4 s ASN 55 N 1.20 4.35 0.55 9.88 -0.87 -1.26 -2.67 114.94 126.12 1ll4 s ASN 55 Ca 0.10 -0.84 0.22 0.00 -1.57 0.00 0.00 52.86 50.77 1ll4 s ASN 55 Cb -0.14 -0.65 1.48 0.00 -0.02 0.00 0.00 41.25 41.91 1ll4 s ASN 55 CO 0.06 -0.15 2.15 -0.65 -2.57 0.00 0.00 177.10 175.95 1ll4 h PRO 56 N 1.82 0.00 -0.49 -0.60 0.11 -1.94 -2.23 132.00 128.67 1ll4 h PRO 56 Ca -0.43 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.72 1ll4 h PRO 56 Cb 1.25 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 1ll4 h PRO 56 CO 0.63 0.00 0.32 1.96 -0.21 0.00 0.00 178.00 180.71 1ll4 h GLN 57 N 0.00 0.48 -1.92 1.05 7.50 -1.96 -2.83 115.11 117.43 1ll4 h GLN 57 Ca 0.04 -0.03 -0.75 0.00 0.50 0.00 0.00 58.65 58.41 1ll4 h GLN 57 Cb 0.18 -0.11 -0.29 0.00 0.05 0.00 0.00 27.48 27.31 1ll4 h GLN 57 CO -0.00 0.31 0.86 -0.40 -1.50 0.00 0.00 178.83 178.10 1ll4 n ASP 58 N -4.48 7.22 -4.46 1.46 5.68 -0.84 -4.88 116.55 116.26 1ll4 n ASP 58 Ca 0.06 -3.83 -0.33 0.00 -0.50 0.00 0.00 54.79 50.19 1ll4 n ASP 58 Cb 0.19 -1.00 -0.13 0.00 -1.14 0.00 0.00 41.12 39.04 1ll4 n ASP 58 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 1ll4 s LEU 59 N -4.01 3.06 -1.33 -2.12 2.96 -1.07 -4.87 118.68 111.30 1ll4 s LEU 59 Ca 0.52 -0.19 -0.17 0.00 -0.22 0.00 0.00 54.13 54.06 1ll4 s LEU 59 Cb 0.44 -1.72 0.06 0.00 0.50 0.00 0.00 46.19 45.47 1ll4 s LEU 59 CO -0.38 0.18 1.85 1.17 -1.32 0.00 0.00 176.35 177.85 1ll4 n LYS 60 N 3.44 3.06 0.14 1.98 3.00 -1.26 -4.77 118.16 123.75 1ll4 n LYS 60 Ca -0.18 -3.10 0.18 0.00 -0.00 0.00 0.00 58.31 55.22 1ll4 n LYS 60 Cb 0.53 -3.46 0.77 0.00 0.00 0.00 0.00 35.03 32.87 1ll4 n LYS 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ll4 h ALA 61 N 7.30 2.03 0.00 3.14 0.00 -1.94 -1.17 119.26 128.62 1ll4 h ALA 61 Ca 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1ll4 h ALA 61 Cb 0.82 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1ll4 h ALA 61 CO 1.55 -0.45 0.00 -0.40 0.00 0.00 0.00 179.25 179.94 1ll4 n ASP 62 N -3.90 0.21 0.04 0.00 5.75 -1.26 -1.99 116.55 115.40 1ll4 n ASP 62 Ca 0.05 0.54 0.13 0.00 -0.01 0.00 0.00 54.79 55.49 1ll4 n ASP 62 Cb 0.45 -0.59 0.32 0.00 -1.03 0.00 0.00 41.12 40.27 1ll4 n ASP 62 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 1ll4 n GLN 63 N -1.72 0.15 -4.47 0.11 7.27 -0.44 -4.95 117.38 113.33 1ll4 n GLN 63 Ca 0.04 0.07 -0.22 0.00 0.07 0.00 0.00 57.00 56.96 1ll4 n GLN 63 Cb 0.25 -1.62 -0.11 0.00 2.41 0.00 0.00 30.24 31.17 1ll4 n GLN 63 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1ll4 s PHE 64 N -3.08 2.04 -0.00 3.69 0.40 -0.84 -4.89 117.98 115.30 1ll4 s PHE 64 Ca 0.10 -0.81 0.02 0.00 -0.60 0.00 0.00 56.93 55.63 1ll4 s PHE 64 Cb 0.15 -1.29 -0.02 0.00 0.51 0.00 0.00 43.02 42.37 1ll4 s PHE 64 CO 0.66 0.18 0.03 0.25 0.70 0.00 0.00 175.22 177.04 1ll4 n THR 65 N -0.69 0.01 -3.64 0.64 -2.24 -0.11 -4.64 114.28 103.61 1ll4 n THR 65 Ca -0.04 -0.04 -0.17 0.00 -2.27 0.00 0.00 64.05 61.53 1ll4 n THR 65 Cb 0.65 0.32 -0.15 0.00 -2.10 0.00 0.00 70.33 69.05 1ll4 n THR 65 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1ll4 s HIS 66 N -2.10 -0.18 -0.17 4.78 3.76 -0.93 -0.60 115.29 119.86 1ll4 s HIS 66 Ca -0.01 0.53 -0.08 0.00 -0.15 0.00 0.00 55.06 55.36 1ll4 s HIS 66 Cb 0.01 -0.29 -0.04 0.00 1.11 0.00 0.00 32.58 33.37 1ll4 s HIS 66 CO 0.06 -0.33 0.09 0.42 -0.85 0.00 0.00 174.74 174.14 1ll4 s ILE 67 N 2.30 5.08 -0.16 0.60 -1.09 0.40 -1.23 121.20 127.10 1ll4 s ILE 67 Ca 0.03 0.06 0.01 0.00 -2.23 0.00 0.00 60.65 58.52 1ll4 s ILE 67 Cb -0.13 -3.27 0.00 0.00 -1.58 0.00 0.00 42.46 37.49 1ll4 s ILE 67 CO -0.07 0.50 -0.16 -0.76 -1.23 0.00 0.00 174.94 173.22 1ll4 s LEU 68 N -0.05 2.39 -0.29 2.97 1.02 0.45 -0.91 118.68 124.26 1ll4 s LEU 68 Ca 0.08 -0.51 -0.15 0.00 0.02 0.00 0.00 54.13 53.57 1ll4 s LEU 68 Cb -0.12 -1.54 -0.03 0.00 0.02 0.00 0.00 46.19 44.52 1ll4 s LEU 68 CO 0.00 0.07 0.38 -0.47 0.02 0.00 0.00 176.35 176.35 1ll4 s TYR 69 N 0.91 3.23 -0.01 0.29 5.04 0.12 -0.19 117.35 126.73 1ll4 s TYR 69 Ca -0.04 0.30 0.07 0.00 -2.44 0.00 0.00 57.07 54.96 1ll4 s TYR 69 Cb -0.15 -2.61 -0.02 0.00 0.35 0.00 0.00 41.96 39.52 1ll4 s TYR 69 CO -0.02 -0.29 -0.22 0.00 -1.34 0.00 0.00 175.55 173.67 1ll4 s ALA 70 N 2.08 2.34 0.19 3.97 0.00 0.12 0.11 121.76 130.57 1ll4 s ALA 70 Ca 0.14 -1.11 0.04 0.00 0.00 0.00 0.00 51.96 51.04 1ll4 s ALA 70 Cb -0.16 -0.67 -0.05 0.00 0.00 0.00 0.00 23.12 22.25 1ll4 s ALA 70 CO 0.11 0.54 -0.06 -0.06 0.00 0.00 0.00 175.76 176.28 1ll4 s PHE 71 N -0.70 1.43 0.01 0.00 0.08 -1.26 0.16 117.98 117.70 1ll4 s PHE 71 Ca 0.11 -0.81 0.04 0.00 0.12 0.00 0.00 56.93 56.39 1ll4 s PHE 71 Cb -0.10 -0.77 -0.03 0.00 -0.57 0.00 0.00 43.02 41.55 1ll4 s PHE 71 CO 0.00 0.06 -0.09 0.00 -0.10 0.00 0.00 175.22 175.09 1ll4 s ALA 72 N -3.33 2.91 0.42 5.36 0.00 0.64 -3.82 121.76 123.94 1ll4 s ALA 72 Ca 0.22 -1.05 0.08 0.00 0.00 0.00 0.00 51.96 51.21 1ll4 s ALA 72 Cb 0.04 -1.04 -0.00 0.00 0.00 0.00 0.00 23.12 22.11 1ll4 s ALA 72 CO 0.04 0.60 0.48 1.21 0.00 0.00 0.00 175.76 178.10 1ll4 s ASN 73 N -1.38 5.35 0.07 0.00 3.84 -0.05 -1.33 114.94 121.45 1ll4 s ASN 73 Ca 0.16 -0.59 0.07 0.00 0.21 0.00 0.00 52.86 52.71 1ll4 s ASN 73 Cb -0.11 -0.59 -0.03 0.00 -0.55 0.00 0.00 41.25 39.97 1ll4 s ASN 73 CO 0.07 -0.72 -0.18 -0.63 -2.79 0.00 0.00 177.10 172.84 1ll4 s ILE 74 N -2.42 1.45 0.25 -5.21 1.09 -1.26 -0.44 121.20 114.66 1ll4 s ILE 74 Ca 0.52 -1.32 0.07 0.00 -1.10 0.00 0.00 60.65 58.82 1ll4 s ILE 74 Cb -0.07 -1.32 -0.04 0.00 -1.06 0.00 0.00 42.46 39.98 1ll4 s ILE 74 CO 0.31 -0.03 0.21 -0.13 -0.10 0.00 0.00 174.94 175.19 1ll4 s ARG 75 N -1.58 2.97 0.49 2.79 0.52 0.19 -4.94 118.95 119.38 1ll4 s ARG 75 Ca 0.04 -1.02 0.31 0.00 -0.52 0.00 0.00 55.73 54.53 1ll4 s ARG 75 Cb -0.09 -2.60 1.40 0.00 0.52 0.00 0.00 34.95 34.18 1ll4 s ARG 75 CO 0.03 0.41 1.79 -1.35 0.02 0.00 0.00 175.30 176.19 1ll4 h PRO 76 N 1.51 0.13 0.00 3.54 0.11 -1.92 0.66 132.00 136.03 1ll4 h PRO 76 Ca -0.49 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1ll4 h PRO 76 Cb 1.24 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ll4 h PRO 76 CO 0.61 0.08 -0.03 0.66 -0.21 0.00 0.00 178.00 179.11 1ll4 h SER 77 N 0.13 0.00 0.00 -2.05 4.64 -1.95 -3.31 113.55 111.01 1ll4 h SER 77 Ca 0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.91 1ll4 h SER 77 Cb 2.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.12 1ll4 h SER 77 CO -0.12 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.48 1ll4 n GLY 78 N -1.30 0.84 3.68 -0.77 0.00 0.22 -4.11 105.19 103.75 1ll4 n GLY 78 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1ll4 n GLY 78 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ll4 s GLU 79 N -0.42 4.25 0.05 1.61 2.12 -1.21 -2.91 118.70 122.20 1ll4 s GLU 79 Ca 0.00 1.99 -0.19 0.00 0.36 0.00 0.00 54.97 57.13 1ll4 s GLU 79 Cb 0.00 -3.67 -0.06 0.00 0.26 0.00 0.00 34.13 30.66 1ll4 s GLU 79 CO 0.00 -0.65 0.56 0.08 -0.54 0.00 0.00 175.26 174.71 1ll4 s VAL 80 N 2.83 4.81 0.09 3.70 1.01 -1.26 0.54 120.40 132.11 1ll4 s VAL 80 Ca 0.65 1.19 -0.12 0.00 0.00 0.00 0.00 61.98 63.70 1ll4 s VAL 80 Cb -0.31 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.19 1ll4 s VAL 80 CO 0.26 0.52 0.28 -0.72 0.00 0.00 0.00 175.10 175.44 1ll4 s TYR 81 N -0.87 -0.02 -0.07 5.22 -0.85 0.41 -4.78 117.35 116.40 1ll4 s TYR 81 Ca 0.29 -0.31 -0.30 0.00 -0.52 0.00 0.00 57.07 56.23 1ll4 s TYR 81 Cb -0.19 0.07 -0.03 0.00 0.38 0.00 0.00 41.96 42.19 1ll4 s TYR 81 CO 0.18 -0.58 1.22 -0.51 -1.52 0.00 0.00 175.55 174.34 1ll4 s LEU 82 N -2.64 4.27 0.63 -3.49 1.43 -1.26 -0.87 118.68 116.74 1ll4 s LEU 82 Ca 0.02 1.82 0.38 0.00 -1.03 0.00 0.00 54.13 55.32 1ll4 s LEU 82 Cb 0.03 -3.56 2.14 0.00 0.03 0.00 0.00 46.19 44.83 1ll4 s LEU 82 CO -0.09 -0.62 2.30 0.28 0.23 0.00 0.00 176.35 178.45 1ll4 h SER 83 N 7.58 0.00 -1.01 2.29 0.02 -1.92 -3.39 113.55 117.12 1ll4 h SER 83 Ca -0.33 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.47 1ll4 h SER 83 Cb 1.15 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.53 1ll4 h SER 83 CO 0.89 0.01 -0.49 -0.62 -1.14 0.00 0.00 176.83 175.48 1ll4 s ASP 84 N -5.56 -1.43 0.64 3.07 -1.08 -1.26 -4.99 116.67 106.06 1ll4 s ASP 84 Ca -0.05 -1.68 0.38 0.00 -0.52 0.00 0.00 52.55 50.68 1ll4 s ASP 84 Cb 0.14 1.88 2.14 0.00 -1.46 0.00 0.00 42.92 45.62 1ll4 s ASP 84 CO 0.47 -0.06 2.29 0.71 0.52 0.00 0.00 175.17 179.10 1ll4 h THR 85 N 5.00 0.20 0.53 1.71 1.35 -1.97 0.21 112.91 119.93 1ll4 h THR 85 Ca 0.06 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.90 1ll4 h THR 85 Cb 1.11 0.96 0.01 0.00 -1.73 0.00 0.00 68.15 68.50 1ll4 h THR 85 CO 0.02 0.00 -0.25 -0.25 -0.25 0.00 0.00 175.52 174.79 1ll4 h TRP 86 N 0.00 -0.66 0.07 4.73 2.91 -1.95 0.20 115.95 121.25 1ll4 h TRP 86 Ca 0.01 -0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.04 1ll4 h TRP 86 Cb 0.09 0.22 -0.04 0.00 -0.51 0.00 0.00 29.16 28.91 1ll4 h TRP 86 CO 0.00 -0.41 -0.27 0.00 -1.03 0.00 0.00 178.44 176.73 1ll4 h ALA 87 N -1.64 -0.42 0.39 2.65 0.00 -1.66 -1.18 119.26 117.39 1ll4 h ALA 87 Ca -0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1ll4 h ALA 87 Cb 0.54 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1ll4 h ALA 87 CO 0.12 -0.79 -0.27 -0.44 0.00 0.00 0.00 179.25 177.86 1ll4 h ASP 88 N -0.45 -0.70 0.00 0.00 3.32 -0.68 0.12 116.42 118.03 1ll4 h ASP 88 Ca 0.04 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1ll4 h ASP 88 Cb 0.50 0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.27 1ll4 h ASP 88 CO -0.19 -0.42 -0.33 0.35 -1.72 0.00 0.00 179.24 176.93 1ll4 n THR 89 N -5.40 0.00 -0.04 0.35 -2.24 0.52 -1.24 114.28 106.23 1ll4 n THR 89 Ca -0.10 -0.13 -0.05 0.00 -2.27 0.00 0.00 64.05 61.51 1ll4 n THR 89 Cb 0.30 0.60 -0.05 0.00 -2.10 0.00 0.00 70.33 69.08 1ll4 n THR 89 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ll4 n ASP 90 N -0.75 3.28 -4.62 3.42 10.43 -0.12 -0.71 116.55 127.48 1ll4 n ASP 90 Ca 0.00 -0.02 -0.46 0.00 2.57 0.00 0.00 54.79 56.87 1ll4 n ASP 90 Cb 0.00 0.31 -0.03 0.00 1.84 0.00 0.00 41.12 43.24 1ll4 n ASP 90 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 1ll4 n LYS 91 N -2.48 1.52 -3.62 -1.24 4.81 -0.47 -4.54 118.16 112.14 1ll4 n LYS 91 Ca -0.13 0.54 -0.37 0.00 -0.87 0.00 0.00 58.31 57.47 1ll4 n LYS 91 Cb 0.70 -2.07 -0.11 0.00 0.02 0.00 0.00 35.03 33.57 1ll4 n LYS 91 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1ll4 s HIS 92 N -0.33 3.25 0.66 5.64 3.76 -1.26 -0.98 115.29 126.03 1ll4 s HIS 92 Ca 0.68 0.14 -0.06 0.00 -0.15 0.00 0.00 55.06 55.68 1ll4 s HIS 92 Cb -0.75 -2.34 0.04 0.00 1.11 0.00 0.00 32.58 30.65 1ll4 s HIS 92 CO 0.53 -0.09 0.96 0.71 -0.85 0.00 0.00 174.74 176.00 1ll4 s TYR 93 N 1.51 3.02 -0.30 1.40 1.51 -1.26 -4.95 117.35 118.27 1ll4 s TYR 93 Ca 0.07 0.47 -0.43 0.00 -1.01 0.00 0.00 57.07 56.17 1ll4 s TYR 93 Cb -0.15 -3.02 -0.18 0.00 -0.11 0.00 0.00 41.96 38.50 1ll4 s TYR 93 CO 0.09 -1.18 1.53 -2.30 -1.11 0.00 0.00 175.55 172.58 1ll4 n PRO 94 N -2.77 0.44 0.00 -1.71 -0.02 -1.26 -1.38 135.00 128.30 1ll4 n PRO 94 Ca 0.07 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1ll4 n PRO 94 Cb 0.59 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 1ll4 n PRO 94 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ll4 n GLY 95 N 3.52 0.97 3.50 -1.23 0.00 -1.26 -5.06 105.19 105.63 1ll4 n GLY 95 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 1ll4 n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ll4 s ASP 96 N -1.97 6.09 0.22 1.61 -0.00 -0.48 -5.03 116.67 117.10 1ll4 s ASP 96 Ca 0.00 -0.60 -0.31 0.00 -0.00 0.00 0.00 52.55 51.64 1ll4 s ASP 96 Cb 0.00 -2.15 -0.11 0.00 -0.00 0.00 0.00 42.92 40.66 1ll4 s ASP 96 CO 0.00 -0.32 1.63 -0.54 -0.00 0.00 0.00 175.17 175.93 1ll4 s LYS 97 N 1.72 4.16 -0.02 8.23 1.02 -1.26 -4.85 119.74 128.73 1ll4 s LYS 97 Ca 0.06 2.51 -0.26 0.00 0.02 0.00 0.00 55.97 58.30 1ll4 s LYS 97 Cb -0.18 -3.09 -0.20 0.00 -0.52 0.00 0.00 37.83 33.85 1ll4 s LYS 97 CO 0.10 -0.66 1.23 -1.49 -0.92 0.00 0.00 175.35 173.62 1ll4 h TRP 98 N 6.20 -0.04 0.00 3.18 4.06 -1.98 -3.42 115.95 123.96 1ll4 h TRP 98 Ca -0.44 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.51 1ll4 h TRP 98 Cb 1.21 0.01 0.00 0.00 -1.00 0.00 0.00 29.16 29.38 1ll4 h TRP 98 CO 0.63 0.43 0.00 -0.40 -3.56 0.00 0.00 178.44 175.54 1ll4 n ASP 99 N -4.88 0.00 -1.82 -3.49 3.85 -1.26 -5.08 116.55 103.87 1ll4 n ASP 99 Ca -0.08 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.00 1ll4 n ASP 99 Cb 0.25 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.02 1ll4 n ASP 99 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.20 177.40 1ll4 n GLU 100 N 0.00 -3.68 -1.32 0.11 2.13 -1.26 -4.97 120.64 111.66 1ll4 n GLU 100 Ca 0.00 2.64 -0.35 0.00 0.66 0.00 0.00 57.16 60.11 1ll4 n GLU 100 Cb 0.00 -3.06 0.10 0.00 0.27 0.00 0.00 31.44 28.75 1ll4 n GLU 100 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1ll4 n PRO 101 N 0.81 0.49 0.00 5.31 -0.04 -1.26 -4.91 135.00 135.40 1ll4 n PRO 101 Ca 0.00 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.69 1ll4 n PRO 101 Cb 0.00 -2.39 0.00 0.00 -0.04 0.00 0.00 33.50 31.07 1ll4 n PRO 101 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ll4 n GLY 102 N 0.81 1.98 3.53 0.55 0.00 -1.26 -4.85 105.19 105.94 1ll4 n GLY 102 Ca 0.14 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.79 1ll4 n GLY 102 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ll4 s ASN 103 N 0.00 6.35 0.14 1.61 2.47 -1.26 -4.97 114.94 119.27 1ll4 s ASN 103 Ca 0.00 -0.20 0.11 0.00 0.42 0.00 0.00 52.86 53.19 1ll4 s ASN 103 Cb 0.00 -2.32 -0.04 0.00 -1.45 0.00 0.00 41.25 37.44 1ll4 s ASN 103 CO 0.00 -0.72 -0.27 0.20 -3.72 0.00 0.00 177.10 172.59 1ll4 s ASN 104 N 1.94 3.32 -0.05 -4.21 0.01 -1.26 -0.23 114.94 114.46 1ll4 s ASN 104 Ca 0.23 -0.76 -0.03 0.00 -0.71 0.00 0.00 52.86 51.59 1ll4 s ASN 104 Cb -0.14 -0.22 -0.04 0.00 0.41 0.00 0.00 41.25 41.26 1ll4 s ASN 104 CO 0.18 0.17 0.11 0.68 -1.51 0.00 0.00 177.10 176.73 1ll4 s VAL 105 N -1.13 5.07 0.00 1.60 -7.23 -1.26 -4.98 120.40 112.48 1ll4 s VAL 105 Ca 0.15 -0.13 0.00 0.00 -1.81 0.00 0.00 61.98 60.18 1ll4 s VAL 105 Cb -0.10 -3.27 0.00 0.00 0.56 0.00 0.00 36.38 33.57 1ll4 s VAL 105 CO 0.06 0.47 0.00 -1.22 -0.31 0.00 0.00 175.10 174.10 1ll4 n TYR 106 N 1.52 0.00 -4.94 2.82 4.02 0.11 -4.63 117.16 116.05 1ll4 n TYR 106 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 1ll4 n TYR 106 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 1ll4 n TYR 106 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ll4 n GLY 107 N 2.48 0.84 0.24 2.72 0.00 -0.15 -1.45 105.19 109.87 1ll4 n GLY 107 Ca 0.00 -0.82 0.13 0.00 0.00 0.00 0.00 46.02 45.33 1ll4 n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ll4 h ILE 109 N 0.00 1.23 -0.81 0.00 5.03 -1.17 0.16 117.51 121.95 1ll4 h ILE 109 Ca -0.00 -0.75 -0.01 0.00 -0.12 0.00 0.00 64.86 63.98 1ll4 h ILE 109 Cb 0.72 1.37 -0.04 0.00 -3.03 0.00 0.00 36.82 35.84 1ll4 h ILE 109 CO 0.01 0.23 0.47 0.50 -0.68 0.00 0.00 178.15 178.68 1ll4 h LYS 110 N 0.09 1.11 -0.71 2.37 3.64 -1.12 -1.22 116.57 120.74 1ll4 h LYS 110 Ca 0.06 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1ll4 h LYS 110 Cb 0.32 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 1ll4 h LYS 110 CO 0.00 0.80 0.37 1.96 -2.27 0.00 0.00 179.45 180.31 1ll4 h GLN 111 N 1.12 0.99 -0.11 1.90 1.08 -1.17 0.90 115.11 119.81 1ll4 h GLN 111 Ca 0.29 -0.12 -0.15 0.00 -1.45 0.00 0.00 58.65 57.22 1ll4 h GLN 111 Cb -0.01 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.22 1ll4 h GLN 111 CO -0.05 0.74 -0.58 0.52 -0.95 0.00 0.00 178.83 178.51 1ll4 h MET 112 N 0.99 0.36 -0.40 1.46 2.86 -0.27 -0.49 114.93 119.44 1ll4 h MET 112 Ca 0.25 -0.24 -0.13 0.00 -2.06 0.00 0.00 59.70 57.52 1ll4 h MET 112 Cb 0.06 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1ll4 h MET 112 CO -0.04 0.84 -0.25 -0.92 1.06 0.00 0.00 176.91 177.60 1ll4 h TYR 113 N 0.27 0.96 -0.31 -0.22 3.20 -0.01 0.38 116.97 121.23 1ll4 h TYR 113 Ca -0.00 -0.23 -0.08 0.00 3.14 0.00 0.00 58.73 61.55 1ll4 h TYR 113 Cb 1.10 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.13 1ll4 h TYR 113 CO 0.03 1.00 -0.16 -0.07 -1.64 0.00 0.00 178.16 177.32 1ll4 h LEU 114 N 0.72 0.55 -0.69 2.82 3.38 -0.69 0.47 115.31 121.87 1ll4 h LEU 114 Ca 0.09 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1ll4 h LEU 114 Cb 0.79 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 1ll4 h LEU 114 CO 0.07 0.73 0.30 -0.07 0.09 0.00 0.00 178.44 179.56 1ll4 h LEU 115 N 0.51 0.92 -0.61 1.67 3.38 -0.25 -1.97 115.31 118.97 1ll4 h LEU 115 Ca 0.09 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 1ll4 h LEU 115 Cb 0.57 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1ll4 h LEU 115 CO 0.04 0.82 0.02 0.11 0.09 0.00 0.00 178.44 179.51 1ll4 h LYS 116 N 0.96 1.06 -0.56 1.13 1.57 -0.36 0.26 116.57 120.64 1ll4 h LYS 116 Ca 0.23 -0.33 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1ll4 h LYS 116 Cb 0.16 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1ll4 h LYS 116 CO -0.02 1.03 0.26 0.87 -0.57 0.00 0.00 179.45 181.01 1ll4 h LYS 117 N 0.96 0.81 -0.03 3.15 1.57 -0.77 -3.00 116.57 119.25 1ll4 h LYS 117 Ca 0.17 -0.13 -0.22 0.00 -1.87 0.00 0.00 60.65 58.61 1ll4 h LYS 117 Cb 0.54 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1ll4 h LYS 117 CO 0.03 0.67 -0.89 -0.91 -0.57 0.00 0.00 179.45 177.78 1ll4 h ASN 118 N 0.75 0.62 -3.76 0.86 2.35 -1.18 -3.39 115.58 111.82 1ll4 h ASN 118 Ca 0.19 -0.47 -0.67 0.00 -0.55 0.00 0.00 56.30 54.80 1ll4 h ASN 118 Cb 0.14 -0.19 -0.38 0.00 0.05 0.00 0.00 38.32 37.95 1ll4 h ASN 118 CO -0.02 1.25 -0.60 0.20 -1.65 0.00 0.00 177.43 176.61 1ll4 s ASN 119 N -7.09 4.94 0.14 5.81 0.01 0.91 -4.93 114.94 114.73 1ll4 s ASN 119 Ca -0.07 -2.32 0.20 0.00 -0.71 0.00 0.00 52.86 49.96 1ll4 s ASN 119 Cb 0.09 -1.73 0.82 0.00 0.41 0.00 0.00 41.25 40.84 1ll4 s ASN 119 CO 0.87 -0.42 1.61 0.54 -1.51 0.00 0.00 177.10 178.19 1ll4 n ARG 120 N 4.12 0.11 -0.20 -0.60 5.12 -1.22 -1.17 116.66 122.82 1ll4 n ARG 120 Ca 0.02 0.33 0.08 0.00 -1.93 0.00 0.00 57.85 56.36 1ll4 n ARG 120 Cb 0.40 -1.70 0.24 0.00 -1.16 0.00 0.00 32.46 30.24 1ll4 n ARG 120 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1ll4 n ASN 121 N -1.90 2.37 -4.50 0.55 5.15 -1.26 -1.30 115.26 114.38 1ll4 n ASN 121 Ca 0.03 -1.94 -0.42 0.00 -0.60 0.00 0.00 54.58 51.65 1ll4 n ASN 121 Cb 0.21 -0.26 -0.10 0.00 -0.53 0.00 0.00 39.78 39.10 1ll4 n ASN 121 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1ll4 s LEU 122 N -1.16 4.81 0.36 1.20 2.96 -0.32 -4.51 118.68 122.03 1ll4 s LEU 122 Ca 0.32 -0.65 0.01 0.00 -0.22 0.00 0.00 54.13 53.58 1ll4 s LEU 122 Cb 0.17 -2.17 -0.03 0.00 0.50 0.00 0.00 46.19 44.67 1ll4 s LEU 122 CO 0.23 -0.35 0.56 -0.54 -1.32 0.00 0.00 176.35 174.93 1ll4 s LYS 123 N 1.73 3.40 0.01 1.98 3.01 0.23 -4.68 119.74 125.42 1ll4 s LYS 123 Ca 0.06 -0.39 0.04 0.00 -1.01 0.00 0.00 55.97 54.67 1ll4 s LYS 123 Cb -0.18 -2.65 -0.01 0.00 -1.01 0.00 0.00 37.83 33.97 1ll4 s LYS 123 CO 0.10 0.08 -0.13 0.95 0.51 0.00 0.00 175.35 176.86 1ll4 s THR 124 N -2.35 1.01 0.03 2.17 -4.23 -1.26 -0.45 115.64 110.56 1ll4 s THR 124 Ca 0.41 -0.70 0.04 0.00 -1.18 0.00 0.00 61.69 60.27 1ll4 s THR 124 Cb -0.10 -0.87 -0.02 0.00 1.34 0.00 0.00 72.50 72.85 1ll4 s THR 124 CO 0.36 0.17 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.72 1ll4 s LEU 125 N -0.60 2.14 0.08 4.79 1.02 -0.09 0.18 118.68 126.20 1ll4 s LEU 125 Ca 0.03 -0.40 -0.28 0.00 0.02 0.00 0.00 54.13 53.50 1ll4 s LEU 125 Cb -0.06 -0.58 -0.05 0.00 0.02 0.00 0.00 46.19 45.52 1ll4 s LEU 125 CO 0.00 0.05 0.90 -0.22 0.02 0.00 0.00 176.35 177.10 1ll4 s LEU 126 N -0.94 4.47 -0.14 1.79 0.20 -0.54 -0.71 118.68 122.82 1ll4 s LEU 126 Ca 0.02 1.66 -0.00 0.00 0.69 0.00 0.00 54.13 56.50 1ll4 s LEU 126 Cb -0.07 -3.47 -0.01 0.00 -0.43 0.00 0.00 46.19 42.21 1ll4 s LEU 126 CO 0.01 -0.05 -0.12 -0.55 -0.29 0.00 0.00 176.35 175.34 1ll4 s SER 127 N 0.07 3.99 -0.16 3.68 0.15 0.12 -0.30 113.70 121.24 1ll4 s SER 127 Ca 0.44 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.74 1ll4 s SER 127 Cb -0.22 -1.62 0.00 0.00 -1.71 0.00 0.00 66.02 62.47 1ll4 s SER 127 CO 0.27 0.13 -0.15 -0.63 1.20 0.00 0.00 173.24 174.06 1ll4 s ILE 128 N 0.54 2.61 0.00 6.45 1.01 0.86 -0.26 121.20 132.41 1ll4 s ILE 128 Ca -0.08 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 59.79 1ll4 s ILE 128 Cb -0.16 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.21 1ll4 s ILE 128 CO 0.04 0.51 0.00 0.61 0.00 0.00 0.00 174.94 176.10 1ll4 n GLY 129 N 4.17 0.16 0.00 6.18 0.00 -0.44 -0.14 105.19 115.12 1ll4 n GLY 129 Ca -0.19 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1ll4 n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ll4 n GLY 130 N 0.00 2.40 0.12 -0.02 0.00 -0.16 -4.22 105.19 103.31 1ll4 n GLY 130 Ca 0.00 -1.98 -0.08 0.00 0.00 0.00 0.00 46.02 43.96 1ll4 n GLY 130 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1ll4 h TRP 131 N 0.00 0.03 -0.68 1.61 2.91 -1.92 -0.15 115.95 117.76 1ll4 h TRP 131 Ca 0.00 0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.10 1ll4 h TRP 131 Cb 0.00 0.02 -0.04 0.00 -0.51 0.00 0.00 29.16 28.63 1ll4 h TRP 131 CO 0.00 -0.01 0.45 1.15 -1.03 0.00 0.00 178.44 178.99 1ll4 h THR 132 N 0.11 1.00 -0.01 2.65 2.02 -1.96 -3.14 112.91 113.58 1ll4 h THR 132 Ca 0.12 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 67.07 1ll4 h THR 132 Cb 0.14 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1ll4 h THR 132 CO -0.18 0.12 -0.39 -1.22 0.37 0.00 0.00 175.52 174.23 1ll4 n TYR 133 N -4.48 0.00 0.30 3.16 0.53 -0.80 -4.60 117.16 111.27 1ll4 n TYR 133 Ca 0.10 0.00 0.19 0.00 -1.02 0.00 0.00 57.90 57.17 1ll4 n TYR 133 Cb 0.24 0.00 0.89 0.00 -1.03 0.00 0.00 39.34 39.44 1ll4 n TYR 133 CO 0.00 0.00 0.00 0.77 -1.02 0.00 0.00 176.86 176.61 1ll4 h SER 134 N 1.72 0.00 -1.09 7.72 0.02 -0.99 -1.06 113.55 119.86 1ll4 h SER 134 Ca 0.00 0.00 0.30 0.00 -0.84 0.00 0.00 61.79 61.25 1ll4 h SER 134 Cb 0.56 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.00 1ll4 h SER 134 CO 0.00 0.00 0.70 1.55 -1.14 0.00 0.00 176.83 177.94 1ll4 h PRO 135 N 0.00 0.32 -2.13 3.45 0.13 -1.81 -2.96 132.00 129.00 1ll4 h PRO 135 Ca 0.00 -0.02 -0.75 0.00 -0.87 0.00 0.00 66.00 64.36 1ll4 h PRO 135 Cb 0.27 -0.07 -0.30 0.00 0.13 0.00 0.00 31.00 31.02 1ll4 h PRO 135 CO 0.00 0.21 0.67 0.27 -0.23 0.00 0.00 178.00 178.92 1ll4 n ASN 136 N -4.66 6.79 -0.05 1.44 6.94 -0.40 -4.27 115.26 121.05 1ll4 n ASN 136 Ca 0.28 -3.73 -0.09 0.00 -0.02 0.00 0.00 54.58 51.02 1ll4 n ASN 136 Cb 0.99 -1.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.37 1ll4 n ASN 136 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 1ll4 n PHE 137 N -0.25 0.00 -0.34 -2.53 3.72 -1.12 -4.69 117.46 112.25 1ll4 n PHE 137 Ca 0.46 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.98 1ll4 n PHE 137 Cb 0.30 -0.36 0.30 0.00 -0.94 0.00 0.00 39.48 38.79 1ll4 n PHE 137 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1ll4 h LYS 138 N -0.18 0.68 0.15 -1.08 2.10 -1.79 -2.48 116.57 113.97 1ll4 h LYS 138 Ca -0.23 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.37 1ll4 h LYS 138 Cb 1.27 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 1ll4 h LYS 138 CO -0.09 0.45 -0.07 1.15 -2.00 0.00 0.00 179.45 178.88 1ll4 h THR 139 N 0.70 0.99 -0.84 0.07 2.02 -1.89 -2.26 112.91 111.70 1ll4 h THR 139 Ca 0.56 -0.75 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 1ll4 h THR 139 Cb 0.88 1.44 -0.04 0.00 -1.74 0.00 0.00 68.15 68.69 1ll4 h THR 139 CO -0.39 0.17 0.45 1.55 0.37 0.00 0.00 175.52 177.67 1ll4 h PRO 140 N -0.58 1.17 0.00 6.66 0.13 -1.64 -2.98 132.00 134.76 1ll4 h PRO 140 Ca -0.02 -0.14 -0.01 0.00 -0.87 0.00 0.00 66.00 64.96 1ll4 h PRO 140 Cb 0.44 -0.23 -0.00 0.00 0.13 0.00 0.00 31.00 31.34 1ll4 h PRO 140 CO 0.03 0.87 -0.05 0.00 -0.23 0.00 0.00 178.00 178.62 1ll4 h ALA 141 N 1.32 1.29 0.00 -0.56 0.00 -1.43 -2.20 119.26 117.69 1ll4 h ALA 141 Ca 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ll4 h ALA 141 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ll4 h ALA 141 CO -0.05 0.06 0.00 0.66 0.00 0.00 0.00 179.25 179.93 1ll4 h SER 142 N 0.00 0.00 -2.70 0.00 4.64 -1.24 -3.45 113.55 110.81 1ll4 h SER 142 Ca -0.00 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.70 1ll4 h SER 142 Cb 0.17 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.10 1ll4 h SER 142 CO 0.01 0.00 -0.79 0.42 -0.87 0.00 0.00 176.83 175.60 1ll4 s THR 143 N -3.32 2.37 0.23 2.95 -4.23 -0.84 -5.00 115.64 107.81 1ll4 s THR 143 Ca 0.06 -2.23 -0.06 0.00 -1.18 0.00 0.00 61.69 58.28 1ll4 s THR 143 Cb 0.09 -2.20 0.17 0.00 1.34 0.00 0.00 72.50 71.90 1ll4 s THR 143 CO 0.57 -0.29 1.81 -0.08 -0.54 0.00 0.00 174.62 176.09 1ll4 h GLU 144 N 2.70 1.13 -0.30 3.99 4.57 -1.88 -0.81 114.58 123.98 1ll4 h GLU 144 Ca -0.43 -0.19 -0.02 0.00 -1.18 0.00 0.00 59.36 57.54 1ll4 h GLU 144 Cb 1.24 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.62 1ll4 h GLU 144 CO 0.55 0.91 0.12 0.93 -1.18 0.00 0.00 179.01 180.34 1ll4 h GLU 145 N 1.11 0.45 -0.22 1.92 3.07 -1.94 0.74 114.58 119.71 1ll4 h GLU 145 Ca 0.26 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 1ll4 h GLU 145 Cb 0.19 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 1ll4 h GLU 145 CO -0.02 0.46 0.14 0.78 -1.40 0.00 0.00 179.01 178.97 1ll4 h GLY 146 N 0.34 0.32 0.90 -3.84 0.00 -1.58 0.19 103.07 99.39 1ll4 h GLY 146 Ca 0.10 -0.13 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 1ll4 h GLY 146 CO -0.01 0.12 -0.11 3.21 0.00 0.00 0.00 176.54 179.76 1ll4 h ARG 147 N 0.28 0.60 -0.57 4.80 3.08 -0.90 0.31 114.38 121.98 1ll4 h ARG 147 Ca 0.08 -0.24 0.08 0.00 0.07 0.00 0.00 59.98 59.97 1ll4 h ARG 147 Cb 0.00 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 29.96 1ll4 h ARG 147 CO -0.02 0.81 0.21 0.87 -1.07 0.00 0.00 179.97 180.77 1ll4 h LYS 148 N 0.35 0.38 -0.50 0.04 6.56 -0.70 0.11 116.57 122.81 1ll4 h LYS 148 Ca 0.07 -0.02 -0.10 0.00 -1.06 0.00 0.00 60.65 59.54 1ll4 h LYS 148 Cb 0.61 -0.09 -0.02 0.00 -0.57 0.00 0.00 32.23 32.16 1ll4 h LYS 148 CO 0.04 0.25 -0.08 -0.22 -2.06 0.00 0.00 179.45 177.37 1ll4 h LYS 149 N 0.39 0.90 0.32 3.15 3.64 -0.46 0.27 116.57 124.78 1ll4 h LYS 149 Ca 0.28 -0.30 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1ll4 h LYS 149 Cb 0.33 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1ll4 h LYS 149 CO -0.29 0.95 -0.15 0.35 -2.27 0.00 0.00 179.45 178.04 1ll4 h PHE 150 N 0.82 -0.40 -0.35 1.91 3.04 -0.13 -1.49 116.94 120.34 1ll4 h PHE 150 Ca 0.14 -0.01 0.06 0.00 3.98 0.00 0.00 57.97 62.14 1ll4 h PHE 150 Cb 0.60 0.13 -0.05 0.00 2.56 0.00 0.00 35.95 39.19 1ll4 h PHE 150 CO 0.04 -0.20 0.02 0.00 -2.02 0.00 0.00 178.31 176.15 1ll4 h ALA 151 N 0.17 0.34 -0.38 2.41 0.00 -0.56 -0.31 119.26 120.93 1ll4 h ALA 151 Ca -0.04 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1ll4 h ALA 151 Cb 0.37 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1ll4 h ALA 151 CO 0.07 -0.38 -0.09 -0.44 0.00 0.00 0.00 179.25 178.41 1ll4 h ASP 152 N 0.13 0.74 -0.21 0.00 3.32 -0.87 -0.55 116.42 118.98 1ll4 h ASP 152 Ca 0.17 -0.36 -0.16 0.00 0.02 0.00 0.00 57.03 56.70 1ll4 h ASP 152 Cb 0.22 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1ll4 h ASP 152 CO -0.26 0.94 -0.44 0.71 -1.72 0.00 0.00 179.24 178.47 1ll4 h THR 153 N 0.54 1.29 -0.40 0.35 1.35 -1.03 -0.50 112.91 114.50 1ll4 h THR 153 Ca 0.10 -1.62 -0.00 0.00 -0.55 0.00 0.00 66.41 64.33 1ll4 h THR 153 Cb 0.61 1.52 -0.02 0.00 -1.73 0.00 0.00 68.15 68.53 1ll4 h THR 153 CO 0.04 0.53 0.24 0.28 -0.25 0.00 0.00 175.52 176.36 1ll4 h SER 154 N 0.62 0.48 -0.52 5.36 0.02 -0.99 -0.27 113.55 118.25 1ll4 h SER 154 Ca 0.04 -0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 1ll4 h SER 154 Cb 1.00 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.40 1ll4 h SER 154 CO 0.10 0.39 0.14 0.25 -1.14 0.00 0.00 176.83 176.57 1ll4 h LEU 155 N 0.53 0.78 -0.24 5.07 5.85 -0.78 0.45 115.31 126.97 1ll4 h LEU 155 Ca 0.14 -0.23 0.06 0.00 0.84 0.00 0.00 57.88 58.70 1ll4 h LEU 155 Cb 0.00 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.76 1ll4 h LEU 155 CO -0.03 0.80 -0.16 0.50 -0.34 0.00 0.00 178.44 179.22 1ll4 h LYS 156 N 0.72 -0.14 -0.11 1.25 3.64 -0.74 0.48 116.57 121.68 1ll4 h LYS 156 Ca 0.17 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1ll4 h LYS 156 Cb 0.32 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1ll4 h LYS 156 CO -0.00 -0.09 0.07 -0.07 -2.27 0.00 0.00 179.45 177.08 1ll4 h LEU 157 N -0.15 0.13 0.34 5.20 4.07 -0.84 0.13 115.31 124.19 1ll4 h LEU 157 Ca 0.13 -0.03 -0.00 0.00 0.08 0.00 0.00 57.88 58.06 1ll4 h LEU 157 Cb 0.35 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 42.03 1ll4 h LEU 157 CO -0.33 0.12 -0.36 -0.03 -1.08 0.00 0.00 178.44 176.77 1ll4 h MET 158 N 0.12 -0.70 0.00 1.13 4.05 -0.24 -0.55 114.93 118.73 1ll4 h MET 158 Ca 0.04 0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.49 1ll4 h MET 158 Cb 0.02 0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 30.97 1ll4 h MET 158 CO -0.01 -0.47 -0.08 1.57 0.23 0.00 0.00 176.91 178.16 1ll4 h LYS 159 N -0.73 0.00 0.20 0.39 5.09 -0.86 -1.04 116.57 119.62 1ll4 h LYS 159 Ca -0.02 0.00 -0.33 0.00 0.09 0.00 0.00 60.65 60.39 1ll4 h LYS 159 Cb 0.66 0.00 0.02 0.00 0.10 0.00 0.00 32.23 33.01 1ll4 h LYS 159 CO -0.07 0.08 -1.53 -0.44 -2.09 0.00 0.00 179.45 175.40 1ll4 h ASP 160 N 0.00 0.67 0.07 7.07 3.45 -0.44 -3.36 116.42 123.88 1ll4 h ASP 160 Ca -0.00 -0.80 0.00 0.00 0.43 0.00 0.00 57.03 56.66 1ll4 h ASP 160 Cb 0.52 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 39.08 1ll4 h ASP 160 CO 0.01 1.64 -0.19 0.18 -1.57 0.00 0.00 179.24 179.32 1ll4 n LEU 161 N -3.62 1.71 -0.39 1.55 4.77 -0.24 -4.63 117.00 116.15 1ll4 n LEU 161 Ca -0.18 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 1ll4 n LEU 161 Cb 1.08 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 42.13 1ll4 n LEU 161 CO 0.56 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 1ll4 n GLY 162 N 1.31 0.95 3.90 -0.72 0.00 -0.49 -4.87 105.19 105.28 1ll4 n GLY 162 Ca 0.14 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 1ll4 n GLY 162 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ll4 s PHE 163 N -2.75 3.52 -0.98 1.61 0.08 -0.63 -4.87 117.98 113.97 1ll4 s PHE 163 Ca 0.00 0.44 0.27 0.00 0.12 0.00 0.00 56.93 57.77 1ll4 s PHE 163 Cb 0.00 -1.91 0.95 0.00 -0.57 0.00 0.00 43.02 41.49 1ll4 s PHE 163 CO 0.00 0.55 1.73 -0.25 -0.10 0.00 0.00 175.22 177.15 1ll4 n ASP 164 N 0.51 0.23 0.00 1.36 9.92 0.13 -4.70 116.55 123.99 1ll4 n ASP 164 Ca -0.06 0.24 0.00 0.00 -0.53 0.00 0.00 54.79 54.44 1ll4 n ASP 164 Cb 0.52 -0.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.75 1ll4 n ASP 164 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ll4 n GLY 165 N 1.49 -1.28 3.17 0.44 0.00 -1.12 -0.67 105.19 107.21 1ll4 n GLY 165 Ca 0.06 -0.94 -0.17 0.00 0.00 0.00 0.00 46.02 44.97 1ll4 n GLY 165 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ll4 s ILE 166 N -3.00 1.04 -0.12 -0.61 -4.36 -0.44 -1.46 121.20 112.24 1ll4 s ILE 166 Ca 0.00 -1.37 0.01 0.00 -0.26 0.00 0.00 60.65 59.03 1ll4 s ILE 166 Cb 0.00 -1.11 0.02 0.00 1.25 0.00 0.00 42.46 42.62 1ll4 s ILE 166 CO 0.00 -0.32 -0.13 -0.62 0.24 0.00 0.00 174.94 174.11 1ll4 s ASP 167 N -1.90 2.46 -0.00 4.36 3.68 0.58 -1.47 116.67 124.38 1ll4 s ASP 167 Ca -0.01 -0.42 -0.09 0.00 2.13 0.00 0.00 52.55 54.16 1ll4 s ASP 167 Cb -0.08 -1.07 -0.05 0.00 -1.45 0.00 0.00 42.92 40.27 1ll4 s ASP 167 CO 0.02 -0.04 0.31 -0.63 0.13 0.00 0.00 175.17 174.96 1ll4 s ILE 168 N 1.30 5.22 -0.51 4.11 1.09 -0.80 -0.10 121.20 131.51 1ll4 s ILE 168 Ca -0.00 0.41 0.05 0.00 -1.10 0.00 0.00 60.65 60.00 1ll4 s ILE 168 Cb -0.14 -3.59 0.18 0.00 -1.06 0.00 0.00 42.46 37.85 1ll4 s ILE 168 CO -0.06 0.45 0.41 -0.67 -0.10 0.00 0.00 174.94 174.97 1ll4 n ASP 169 N 1.39 0.80 -4.45 3.58 4.64 0.81 -1.66 116.55 121.66 1ll4 n ASP 169 Ca -0.13 -2.69 -0.44 0.00 -1.38 0.00 0.00 54.79 50.16 1ll4 n ASP 169 Cb 0.53 -0.63 -0.08 0.00 -1.04 0.00 0.00 41.12 39.90 1ll4 n ASP 169 CO 0.00 0.00 0.00 0.86 -0.82 0.00 0.00 177.20 177.24 1ll4 s TRP 170 N -0.57 3.17 -0.53 -0.67 -0.11 -1.26 -0.99 118.94 117.98 1ll4 s TRP 170 Ca 0.31 -0.59 -0.02 0.00 1.22 0.00 0.00 56.10 57.02 1ll4 s TRP 170 Cb 0.02 -3.07 0.14 0.00 -1.50 0.00 0.00 33.47 29.06 1ll4 s TRP 170 CO -0.18 -0.78 0.32 -1.21 -4.62 0.00 0.00 176.95 170.48 1ll4 s GLU 171 N 2.05 2.26 0.01 5.86 2.02 -1.26 -4.06 118.70 125.58 1ll4 s GLU 171 Ca 0.10 -2.26 -0.04 0.00 0.02 0.00 0.00 54.97 52.79 1ll4 s GLU 171 Cb -0.20 -3.62 -0.01 0.00 0.10 0.00 0.00 34.13 30.40 1ll4 s GLU 171 CO 0.11 -1.12 0.06 0.71 0.02 0.00 0.00 175.26 175.03 1ll4 s TYR 172 N 0.39 0.16 -0.48 1.61 1.51 -1.26 -4.77 117.35 114.51 1ll4 s TYR 172 Ca 0.14 -0.36 -0.35 0.00 -1.01 0.00 0.00 57.07 55.48 1ll4 s TYR 172 Cb -0.22 -0.13 -0.14 0.00 -0.11 0.00 0.00 41.96 41.37 1ll4 s TYR 172 CO -0.04 -0.26 2.28 -2.30 -1.11 0.00 0.00 175.55 174.13 1ll4 n PRO 173 N 1.41 0.74 0.00 -1.71 -0.02 -1.26 -4.82 135.00 129.34 1ll4 n PRO 173 Ca -0.23 0.17 0.14 0.00 -2.02 0.00 0.00 63.50 61.56 1ll4 n PRO 173 Cb 0.56 -2.28 0.55 0.00 -0.02 0.00 0.00 33.50 32.30 1ll4 n PRO 173 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1ll4 n GLU 174 N 8.23 0.02 -4.21 -0.52 0.28 -1.26 -4.75 120.64 118.44 1ll4 n GLU 174 Ca 0.47 -0.00 -0.18 0.00 -0.16 0.00 0.00 57.16 57.29 1ll4 n GLU 174 Cb 0.19 -1.50 -0.07 0.00 1.43 0.00 0.00 31.44 31.50 1ll4 n GLU 174 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 1ll4 s ASP 175 N -2.98 1.37 0.23 -1.84 1.47 -1.26 -5.04 116.67 108.62 1ll4 s ASP 175 Ca 0.14 -1.65 -0.08 0.00 1.18 0.00 0.00 52.55 52.14 1ll4 s ASP 175 Cb 0.19 0.59 0.22 0.00 -0.34 0.00 0.00 42.92 43.58 1ll4 s ASP 175 CO 0.56 -1.15 1.91 -0.08 0.68 0.00 0.00 175.17 177.09 1ll4 h GLU 176 N 2.14 1.19 -0.29 2.11 4.57 -1.91 -1.82 114.58 120.57 1ll4 h GLU 176 Ca -0.26 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 57.82 1ll4 h GLU 176 Cb 1.23 -0.27 -0.01 0.00 -0.16 0.00 0.00 28.75 29.54 1ll4 h GLU 176 CO 0.38 0.79 0.09 -0.22 -1.18 0.00 0.00 179.01 178.86 1ll4 h LYS 177 N 1.22 0.45 -0.32 1.92 1.63 -1.97 -1.94 116.57 117.56 1ll4 h LYS 177 Ca 0.34 -0.10 -0.04 0.00 -0.85 0.00 0.00 60.65 59.99 1ll4 h LYS 177 Cb -0.13 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.42 1ll4 h LYS 177 CO -0.08 0.51 0.01 1.96 -3.45 0.00 0.00 179.45 178.40 1ll4 h GLN 178 N 0.31 0.49 -0.15 1.90 4.20 -1.83 0.13 115.11 120.16 1ll4 h GLN 178 Ca 0.09 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1ll4 h GLN 178 Cb 0.25 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1ll4 h GLN 178 CO -0.00 0.51 0.01 0.00 -0.67 0.00 0.00 178.83 178.68 1ll4 h ALA 179 N 1.54 0.20 -0.68 3.87 0.00 -1.09 0.11 119.26 123.21 1ll4 h ALA 179 Ca 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1ll4 h ALA 179 Cb 0.30 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1ll4 h ALA 179 CO 0.01 -0.12 0.36 -0.91 0.00 0.00 0.00 179.25 178.58 1ll4 h ASN 180 N 0.01 0.85 -0.62 0.00 4.21 -0.64 -1.47 115.58 117.93 1ll4 h ASN 180 Ca 0.04 -0.07 -0.03 0.00 1.21 0.00 0.00 56.30 57.45 1ll4 h ASN 180 Cb 0.34 -0.22 -0.03 0.00 -1.12 0.00 0.00 38.32 37.29 1ll4 h ASN 180 CO 0.01 0.70 0.28 0.44 -1.29 0.00 0.00 177.43 177.57 1ll4 h ASP 181 N 0.95 0.84 -0.41 5.81 3.45 -0.46 -0.72 116.42 125.89 1ll4 h ASP 181 Ca 0.24 -0.10 -0.11 0.00 0.43 0.00 0.00 57.03 57.49 1ll4 h ASP 181 Cb 0.05 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.59 1ll4 h ASP 181 CO -0.04 0.73 -0.17 0.15 -1.57 0.00 0.00 179.24 178.35 1ll4 h PHE 182 N 0.92 1.01 -0.03 4.55 3.57 0.24 0.18 116.94 127.38 1ll4 h PHE 182 Ca 0.22 -0.22 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1ll4 h PHE 182 Cb 0.14 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.63 1ll4 h PHE 182 CO 0.01 0.99 0.01 0.28 -2.23 0.00 0.00 178.31 177.37 1ll4 h VAL 183 N 0.79 1.13 -0.49 1.41 2.07 -0.67 -1.65 116.25 118.85 1ll4 h VAL 183 Ca 0.12 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 1ll4 h VAL 183 Cb 0.71 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1ll4 h VAL 183 CO 0.05 0.11 0.17 -0.07 0.02 0.00 0.00 177.57 177.85 1ll4 h LEU 184 N -0.12 0.64 -0.54 2.57 3.38 -0.86 -0.43 115.31 119.95 1ll4 h LEU 184 Ca 0.01 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1ll4 h LEU 184 Cb 0.16 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1ll4 h LEU 184 CO -0.00 0.60 0.16 0.25 0.09 0.00 0.00 178.44 179.54 1ll4 h LEU 185 N 0.70 0.80 -0.14 1.67 5.85 -0.48 -0.04 115.31 123.66 1ll4 h LEU 185 Ca 0.17 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 1ll4 h LEU 185 Cb 0.18 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1ll4 h LEU 185 CO -0.01 0.81 0.09 -0.07 -0.34 0.00 0.00 178.44 178.91 1ll4 h LEU 186 N 0.76 0.17 -0.80 2.25 4.07 -0.61 -0.60 115.31 120.55 1ll4 h LEU 186 Ca 0.17 -0.04 0.09 0.00 0.08 0.00 0.00 57.88 58.19 1ll4 h LEU 186 Cb 0.30 -0.04 -0.07 0.00 1.08 0.00 0.00 40.66 41.92 1ll4 h LEU 186 CO -0.00 0.16 0.45 0.50 -1.08 0.00 0.00 178.44 178.47 1ll4 h LYS 187 N 0.17 0.74 0.02 1.13 3.64 -0.84 0.99 116.57 122.41 1ll4 h LYS 187 Ca 0.05 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1ll4 h LYS 187 Cb 0.02 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.64 1ll4 h LYS 187 CO -0.01 0.49 -0.17 0.00 -2.27 0.00 0.00 179.45 177.49 1ll4 h ALA 188 N 1.45 -0.21 -0.48 5.00 0.00 -0.00 -0.54 119.26 124.47 1ll4 h ALA 188 Ca 0.39 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.21 1ll4 h ALA 188 Cb 0.35 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1ll4 h ALA 188 CO -0.25 -0.66 -0.04 0.00 0.00 0.00 0.00 179.25 178.30 1ll4 h ARG 190 N 0.76 0.39 -0.90 0.00 9.65 -0.61 -1.52 114.38 122.15 1ll4 h ARG 190 Ca 0.14 -0.13 -0.01 0.00 -1.10 0.00 0.00 59.98 58.88 1ll4 h ARG 190 Cb 0.51 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.02 1ll4 h ARG 190 CO 0.03 0.60 0.52 0.93 2.80 0.00 0.00 179.97 184.85 1ll4 h GLU 191 N 0.14 1.23 0.61 0.20 5.08 -0.88 -1.93 114.58 119.04 1ll4 h GLU 191 Ca 0.06 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1ll4 h GLU 191 Cb 0.43 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1ll4 h GLU 191 CO 0.01 0.88 -0.34 0.00 -1.00 0.00 0.00 179.01 178.56 1ll4 h ALA 192 N 1.33 -0.89 -0.85 3.43 0.00 -0.44 -1.80 119.26 120.05 1ll4 h ALA 192 Ca 0.32 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1ll4 h ALA 192 Cb -0.02 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1ll4 h ALA 192 CO -0.06 -1.01 0.49 -0.07 0.00 0.00 0.00 179.25 178.61 1ll4 h LEU 193 N -0.89 1.03 -0.83 0.00 4.07 -1.22 -2.54 115.31 114.94 1ll4 h LEU 193 Ca -0.08 -0.08 -0.03 0.00 0.08 0.00 0.00 57.88 57.77 1ll4 h LEU 193 Cb 0.70 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 42.14 1ll4 h LEU 193 CO 0.11 0.81 0.40 0.44 -1.08 0.00 0.00 178.44 179.12 1ll4 h ASP 194 N 1.17 1.08 -0.89 -0.43 5.19 -1.33 -1.78 116.42 119.42 1ll4 h ASP 194 Ca 0.30 -0.13 0.02 0.00 -0.62 0.00 0.00 57.03 56.60 1ll4 h ASP 194 Cb -0.02 -0.28 -0.05 0.00 0.18 0.00 0.00 39.33 39.17 1ll4 h ASP 194 CO -0.05 0.91 0.59 0.00 -3.12 0.00 0.00 179.24 177.56 1ll4 h ALA 195 N 1.21 1.39 -0.43 3.45 0.00 -0.91 0.11 119.26 124.09 1ll4 h ALA 195 Ca 0.28 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 1ll4 h ALA 195 Cb 0.11 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1ll4 h ALA 195 CO -0.04 0.55 -0.26 -0.92 0.00 0.00 0.00 179.25 178.58 1ll4 h TYR 196 N 1.17 1.05 -0.39 0.00 5.03 -1.18 -1.64 116.97 121.01 1ll4 h TYR 196 Ca 0.34 -0.27 -0.09 0.00 2.58 0.00 0.00 58.73 61.29 1ll4 h TYR 196 Cb -0.08 -0.24 -0.02 0.00 1.55 0.00 0.00 36.73 37.94 1ll4 h TYR 196 CO -0.00 1.06 -0.12 0.77 -1.32 0.00 0.00 178.16 178.55 1ll4 h SER 197 N 0.78 0.69 -0.77 -2.11 0.02 -0.72 -2.80 113.55 108.64 1ll4 h SER 197 Ca 0.09 -0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 1ll4 h SER 197 Cb 0.82 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.14 1ll4 h SER 197 CO 0.07 0.84 0.40 0.00 -1.14 0.00 0.00 176.83 177.00 1ll4 h ALA 198 N 1.23 0.99 0.00 3.77 0.00 -0.45 0.34 119.26 125.14 1ll4 h ALA 198 Ca 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ll4 h ALA 198 Cb 0.57 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1ll4 h ALA 198 CO 0.04 0.53 0.00 1.63 0.00 0.00 0.00 179.25 181.44 1ll4 n LYS 199 N -4.41 0.14 -3.00 0.00 5.02 -0.65 -3.82 118.16 111.44 1ll4 n LYS 199 Ca 0.07 0.18 -0.16 0.00 -2.02 0.00 0.00 58.31 56.38 1ll4 n LYS 199 Cb 0.11 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.62 1ll4 n LYS 199 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1ll4 n HIS 200 N -1.24 -1.48 0.23 2.13 8.25 0.10 -5.01 115.22 118.20 1ll4 n HIS 200 Ca 0.04 -2.89 0.08 0.00 -0.26 0.00 0.00 57.72 54.69 1ll4 n HIS 200 Cb 0.06 0.47 0.57 0.00 1.12 0.00 0.00 29.99 32.20 1ll4 n HIS 200 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1ll4 h PRO 201 N 3.67 0.00 -0.03 -0.41 0.11 -1.63 0.15 132.00 133.87 1ll4 h PRO 201 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1ll4 h PRO 201 Cb 0.97 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1ll4 h PRO 201 CO 0.38 0.19 0.00 0.09 -0.21 0.00 0.00 178.00 178.46 1ll4 n ASN 202 N -3.97 0.24 0.00 -2.05 5.03 -1.26 -4.81 115.26 108.45 1ll4 n ASN 202 Ca -0.02 -1.56 0.00 0.00 0.87 0.00 0.00 54.58 53.87 1ll4 n ASN 202 Cb 0.28 -0.02 0.00 0.00 -1.02 0.00 0.00 39.78 39.02 1ll4 n ASN 202 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ll4 n GLY 203 N 0.79 3.27 3.86 7.41 0.00 0.54 -5.13 105.19 115.92 1ll4 n GLY 203 Ca 0.12 -1.95 -0.21 0.00 0.00 0.00 0.00 46.02 43.97 1ll4 n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ll4 s LYS 204 N 2.91 2.77 0.51 1.61 1.02 -1.26 -5.08 119.74 122.22 1ll4 s LYS 204 Ca 0.00 -1.25 -0.16 0.00 0.02 0.00 0.00 55.97 54.58 1ll4 s LYS 204 Cb 0.00 -2.51 -0.08 0.00 -0.52 0.00 0.00 37.83 34.72 1ll4 s LYS 204 CO 0.00 0.13 0.97 0.15 -0.92 0.00 0.00 175.35 175.68 1ll4 s LYS 205 N -3.99 3.94 0.16 1.68 -0.14 -1.26 -4.72 119.74 115.41 1ll4 s LYS 205 Ca 0.40 0.93 0.08 0.00 -1.36 0.00 0.00 55.97 56.02 1ll4 s LYS 205 Cb -0.06 -2.15 -0.04 0.00 -1.68 0.00 0.00 37.83 33.90 1ll4 s LYS 205 CO 0.27 -0.26 -0.09 -0.06 -0.76 0.00 0.00 175.35 174.45 1ll4 s PHE 206 N -2.61 2.68 0.28 3.18 0.40 -1.26 -5.03 117.98 115.62 1ll4 s PHE 206 Ca 0.58 -0.20 -0.08 0.00 -0.60 0.00 0.00 56.93 56.64 1ll4 s PHE 206 Cb -0.10 -1.34 -0.06 0.00 0.51 0.00 0.00 43.02 42.03 1ll4 s PHE 206 CO 0.31 0.48 0.58 -0.51 0.70 0.00 0.00 175.22 176.79 1ll4 s LEU 207 N -2.65 4.07 -0.16 -0.37 2.01 0.16 -4.96 118.68 116.78 1ll4 s LEU 207 Ca 0.24 0.85 -0.04 0.00 0.01 0.00 0.00 54.13 55.19 1ll4 s LEU 207 Cb -0.10 -3.66 0.07 0.00 0.01 0.00 0.00 46.19 42.52 1ll4 s LEU 207 CO 0.15 -0.18 0.21 -0.22 1.01 0.00 0.00 176.35 177.32 1ll4 s LEU 208 N -3.30 -0.11 0.37 1.79 2.96 -1.25 -1.33 118.68 117.81 1ll4 s LEU 208 Ca 0.46 0.05 0.04 0.00 -0.22 0.00 0.00 54.13 54.45 1ll4 s LEU 208 Cb -0.11 0.38 -0.04 0.00 0.50 0.00 0.00 46.19 46.93 1ll4 s LEU 208 CO 0.27 -0.29 0.11 0.42 -1.32 0.00 0.00 176.35 175.54 1ll4 s THR 209 N 2.33 0.71 0.02 3.68 -4.23 -0.54 -0.48 115.64 117.12 1ll4 s THR 209 Ca 0.05 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.52 1ll4 s THR 209 Cb -0.14 -2.48 -0.01 0.00 1.34 0.00 0.00 72.50 71.21 1ll4 s THR 209 CO -0.10 0.00 0.06 0.27 -0.54 0.00 0.00 174.62 174.32 1ll4 s ILE 210 N -3.29 0.11 -0.15 2.99 -4.36 -1.25 -1.90 121.20 113.36 1ll4 s ILE 210 Ca 0.28 -0.93 -0.21 0.00 -0.26 0.00 0.00 60.65 59.54 1ll4 s ILE 210 Cb 0.04 -0.56 -0.03 0.00 1.25 0.00 0.00 42.46 43.17 1ll4 s ILE 210 CO 0.15 -0.51 0.61 0.00 0.24 0.00 0.00 174.94 175.42 1ll4 s ALA 211 N -1.87 3.47 0.29 2.27 0.00 -0.66 -1.02 121.76 124.24 1ll4 s ALA 211 Ca -0.11 -0.15 0.10 0.00 0.00 0.00 0.00 51.96 51.79 1ll4 s ALA 211 Cb -0.06 -2.88 -0.06 0.00 0.00 0.00 0.00 23.12 20.12 1ll4 s ALA 211 CO -0.01 -0.30 -0.14 -1.54 0.00 0.00 0.00 175.76 173.76 1ll4 s SER 212 N 0.95 3.41 -0.04 0.00 1.04 0.68 -4.63 113.70 115.12 1ll4 s SER 212 Ca 0.30 -1.11 -0.30 0.00 0.48 0.00 0.00 55.95 55.32 1ll4 s SER 212 Cb -0.16 -0.28 -0.04 0.00 0.10 0.00 0.00 66.02 65.63 1ll4 s SER 212 CO 0.12 -0.12 1.37 -2.16 0.98 0.00 0.00 173.24 173.44 1ll4 s PRO 213 N -3.59 4.28 0.09 4.02 0.04 -1.26 -1.44 135.00 137.14 1ll4 s PRO 213 Ca 0.30 1.89 0.25 0.00 0.04 0.00 0.00 61.00 63.49 1ll4 s PRO 213 Cb -0.01 -3.64 0.59 0.00 0.04 0.00 0.00 34.50 31.48 1ll4 s PRO 213 CO 0.14 -0.60 1.51 0.00 0.04 0.00 0.00 177.00 178.09 1ll4 n ALA 214 N 5.71 2.86 -2.64 8.56 0.00 -1.24 -4.50 120.51 129.26 1ll4 n ALA 214 Ca 0.13 -0.21 -0.42 0.00 0.00 0.00 0.00 53.44 52.94 1ll4 n ALA 214 Cb 0.44 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.61 1ll4 n ALA 214 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ll4 s GLY 215 N -3.40 2.57 0.26 0.00 0.00 -1.26 -4.47 107.32 101.00 1ll4 s GLY 215 Ca 0.09 0.53 -0.02 0.00 0.00 0.00 0.00 44.72 45.33 1ll4 s GLY 215 CO 0.67 1.87 1.75 -2.55 0.00 0.00 0.00 173.10 174.84 1ll4 h PRO 216 N 6.98 0.55 0.00 2.90 0.11 -1.99 -1.55 132.00 139.00 1ll4 h PRO 216 Ca -0.37 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1ll4 h PRO 216 Cb 1.19 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1ll4 h PRO 216 CO 0.81 0.37 0.00 1.96 -0.21 0.00 0.00 178.00 180.92 1ll4 h GLN 217 N 0.57 0.00 0.00 1.05 4.20 -1.99 -0.87 115.11 118.07 1ll4 h GLN 217 Ca 0.45 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.87 1ll4 h GLN 217 Cb 0.66 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.39 1ll4 h GLN 217 CO -0.38 0.00 -1.97 0.09 -0.67 0.00 0.00 178.83 175.90 1ll4 n ASN 218 N -2.57 1.95 0.30 1.46 4.13 -0.65 -4.61 115.26 115.28 1ll4 n ASN 218 Ca -0.02 0.34 0.20 0.00 1.68 0.00 0.00 54.58 56.78 1ll4 n ASN 218 Cb 0.07 -0.79 0.94 0.00 -1.54 0.00 0.00 39.78 38.46 1ll4 n ASN 218 CO 0.00 0.00 0.00 0.10 0.28 0.00 0.00 177.26 177.64 1ll4 h TYR 219 N -1.00 0.00 0.00 3.10 -0.00 -1.27 -1.52 116.97 116.28 1ll4 h TYR 219 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.29 1ll4 h TYR 219 Cb 1.39 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.12 1ll4 h TYR 219 CO -0.22 0.00 0.00 0.09 -0.00 0.00 0.00 178.16 178.03 1ll4 n ASN 220 N -3.07 0.00 0.05 0.10 3.02 -0.34 -1.34 115.26 113.68 1ll4 n ASN 220 Ca -0.01 0.41 -0.00 0.00 -0.03 0.00 0.00 54.58 54.94 1ll4 n ASN 220 Cb 0.19 -0.46 -0.07 0.00 -0.61 0.00 0.00 39.78 38.83 1ll4 n ASN 220 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1ll4 h LYS 221 N 0.00 0.00 -6.86 3.52 1.57 -1.52 -3.48 116.57 109.80 1ll4 h LYS 221 Ca 0.00 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 58.30 1ll4 h LYS 221 Cb 0.30 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 1ll4 h LYS 221 CO 0.00 0.35 0.40 -0.51 -0.57 0.00 0.00 179.45 179.12 1ll4 s LEU 222 N -5.94 4.40 -1.27 2.94 1.43 -0.45 -4.84 118.68 114.96 1ll4 s LEU 222 Ca -0.02 2.02 -0.09 0.00 -1.03 0.00 0.00 54.13 55.02 1ll4 s LEU 222 Cb 0.08 -3.88 0.17 0.00 0.03 0.00 0.00 46.19 42.59 1ll4 s LEU 222 CO 0.80 -0.15 1.90 0.29 0.23 0.00 0.00 176.35 179.42 1ll4 n LYS 223 N 0.74 3.77 -0.18 1.70 4.01 -1.26 -4.84 118.16 122.10 1ll4 n LYS 223 Ca 0.01 -3.59 -0.02 0.00 -0.51 0.00 0.00 58.31 54.20 1ll4 n LYS 223 Cb 0.48 -2.87 0.05 0.00 -0.51 0.00 0.00 35.03 32.18 1ll4 n LYS 223 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1ll4 h LEU 224 N 7.48 -0.45 -0.83 -0.35 3.38 -1.92 -0.63 115.31 122.00 1ll4 h LEU 224 Ca 0.41 0.16 -0.12 0.00 0.09 0.00 0.00 57.88 58.42 1ll4 h LEU 224 Cb 0.60 0.31 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 1ll4 h LEU 224 CO 1.60 -0.16 -0.55 0.00 0.09 0.00 0.00 178.44 179.41 1ll4 h ALA 225 N 1.53 1.01 0.06 1.53 0.00 -1.88 0.10 119.26 121.61 1ll4 h ALA 225 Ca 0.26 -0.50 -0.25 0.00 0.00 0.00 0.00 54.91 54.42 1ll4 h ALA 225 Cb 0.41 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.13 1ll4 h ALA 225 CO -0.54 0.69 -1.03 1.49 0.00 0.00 0.00 179.25 179.87 1ll4 h GLU 226 N 0.00 0.59 -0.63 0.00 4.22 -1.85 -3.19 114.58 113.73 1ll4 h GLU 226 Ca -0.01 -0.72 0.03 0.00 0.08 0.00 0.00 59.36 58.75 1ll4 h GLU 226 Cb 1.03 0.22 -0.04 0.00 0.50 0.00 0.00 28.75 30.46 1ll4 h GLU 226 CO 0.07 1.30 0.38 0.52 -2.18 0.00 0.00 179.01 179.11 1ll4 h MET 227 N 0.20 0.73 -0.90 1.92 2.86 -0.84 -2.75 114.93 116.15 1ll4 h MET 227 Ca -0.15 -0.04 0.19 0.00 -2.06 0.00 0.00 59.70 57.64 1ll4 h MET 227 Cb 1.71 -0.17 -0.07 0.00 0.06 0.00 0.00 31.60 33.14 1ll4 h MET 227 CO 0.20 0.49 0.59 0.22 1.06 0.00 0.00 176.91 179.47 1ll4 h ASP 228 N 0.76 0.46 -1.11 1.22 3.58 -0.78 -1.44 116.42 119.11 1ll4 h ASP 228 Ca 0.25 0.05 0.31 0.00 0.42 0.00 0.00 57.03 58.06 1ll4 h ASP 228 Cb 0.02 -0.04 -0.06 0.00 1.72 0.00 0.00 39.33 40.97 1ll4 h ASP 228 CO -0.10 0.19 0.77 0.11 -2.88 0.00 0.00 179.24 177.33 1ll4 h LYS 229 N 0.46 0.12 0.00 0.28 1.57 -1.51 -1.26 116.57 116.23 1ll4 h LYS 229 Ca 0.47 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.25 1ll4 h LYS 229 Cb 1.09 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1ll4 h LYS 229 CO -0.20 0.08 -1.22 0.66 -0.57 0.00 0.00 179.45 178.21 1ll4 n TYR 230 N -4.34 0.27 -3.82 -1.35 4.02 -0.54 -4.98 117.16 106.42 1ll4 n TYR 230 Ca 0.25 0.08 -0.34 0.00 -0.01 0.00 0.00 57.90 57.87 1ll4 n TYR 230 Cb 1.10 -0.47 -0.05 0.00 -0.02 0.00 0.00 39.34 39.90 1ll4 n TYR 230 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1ll4 s LEU 231 N -4.12 4.37 0.04 7.72 1.43 -0.48 -4.77 118.68 122.87 1ll4 s LEU 231 Ca 0.01 0.47 -0.19 0.00 -1.03 0.00 0.00 54.13 53.39 1ll4 s LEU 231 Cb 0.14 -2.64 -0.15 0.00 0.03 0.00 0.00 46.19 43.57 1ll4 s LEU 231 CO 0.83 0.26 1.31 0.44 0.23 0.00 0.00 176.35 179.41 1ll4 h ASP 232 N 3.93 0.48 -5.26 2.29 5.19 -1.09 -3.49 116.42 118.47 1ll4 h ASP 232 Ca -0.50 -0.54 0.12 0.00 -0.62 0.00 0.00 57.03 55.49 1ll4 h ASP 232 Cb 1.19 -0.14 -0.04 0.00 0.18 0.00 0.00 39.33 40.53 1ll4 h ASP 232 CO 0.67 0.93 0.46 0.72 -3.12 0.00 0.00 179.24 178.89 1ll4 s PHE 233 N -4.08 0.01 -0.06 4.55 -0.12 -1.26 -4.90 117.98 112.11 1ll4 s PHE 233 Ca -0.14 -0.45 0.05 0.00 -0.05 0.00 0.00 56.93 56.34 1ll4 s PHE 233 Cb 0.05 0.72 -0.01 0.00 -0.63 0.00 0.00 43.02 43.16 1ll4 s PHE 233 CO 0.78 -1.08 -0.23 -1.58 -0.05 0.00 0.00 175.22 173.06 1ll4 s TRP 234 N -2.64 2.29 -0.58 3.49 0.52 0.90 -3.74 118.94 119.18 1ll4 s TRP 234 Ca 0.17 -0.74 -0.07 0.00 0.02 0.00 0.00 56.10 55.48 1ll4 s TRP 234 Cb -0.03 -1.52 0.15 0.00 -1.15 0.00 0.00 33.47 30.92 1ll4 s TRP 234 CO 0.06 -0.25 0.43 -0.80 0.02 0.00 0.00 176.95 176.41 1ll4 s ASN 235 N 0.00 5.63 -0.18 2.95 0.01 -0.19 -0.08 114.94 123.08 1ll4 s ASN 235 Ca -0.07 -2.42 -0.29 0.00 -0.71 0.00 0.00 52.86 49.36 1ll4 s ASN 235 Cb -0.14 -1.96 -0.02 0.00 0.41 0.00 0.00 41.25 39.54 1ll4 s ASN 235 CO 0.04 -0.53 1.39 -0.22 -1.51 0.00 0.00 177.10 176.28 1ll4 s LEU 236 N 0.58 4.11 -1.27 0.60 2.96 -0.50 -0.23 118.68 124.94 1ll4 s LEU 236 Ca 0.12 1.69 -0.17 0.00 -0.22 0.00 0.00 54.13 55.56 1ll4 s LEU 236 Cb -0.21 -3.54 0.10 0.00 0.50 0.00 0.00 46.19 43.05 1ll4 s LEU 236 CO -0.04 -0.92 1.64 -0.04 -1.32 0.00 0.00 176.35 175.68 1ll4 s MET 237 N 3.88 4.01 -1.40 1.98 -1.94 -0.52 -0.21 119.30 125.10 1ll4 s MET 237 Ca 0.61 -2.16 -0.07 0.00 -1.71 0.00 0.00 55.69 52.35 1ll4 s MET 237 Cb -0.23 -5.39 0.07 0.00 2.01 0.00 0.00 34.83 31.28 1ll4 s MET 237 CO 0.21 -2.11 2.47 0.00 -0.01 0.00 0.00 175.02 175.58 1ll4 n ALA 238 N 7.57 6.79 -3.86 3.03 0.00 -1.25 -3.69 120.51 129.10 1ll4 n ALA 238 Ca 0.45 -3.96 -0.05 0.00 0.00 0.00 0.00 53.44 49.88 1ll4 n ALA 238 Cb 0.45 -2.99 0.02 0.00 0.00 0.00 0.00 19.45 16.93 1ll4 n ALA 238 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1ll4 s TYR 239 N 0.08 0.08 -1.47 0.00 -0.85 -1.26 -4.55 117.35 109.38 1ll4 s TYR 239 Ca 0.56 -0.58 -0.07 0.00 -0.52 0.00 0.00 57.07 56.47 1ll4 s TYR 239 Cb 0.17 0.75 0.01 0.00 0.38 0.00 0.00 41.96 43.27 1ll4 s TYR 239 CO -0.07 -1.14 0.88 -0.25 -1.52 0.00 0.00 175.55 173.44 1ll4 n ASP 240 N -1.28 -6.24 0.09 -0.18 10.43 -0.32 -4.91 116.55 114.15 1ll4 n ASP 240 Ca -0.05 -0.41 -0.04 0.00 2.57 0.00 0.00 54.79 56.86 1ll4 n ASP 240 Cb 0.60 -4.97 -0.06 0.00 1.84 0.00 0.00 41.12 38.52 1ll4 n ASP 240 CO 0.00 0.00 0.00 -0.26 -1.07 0.00 0.00 177.20 175.87 1ll4 h PHE 241 N -2.00 0.00 -3.96 1.24 0.04 -1.01 -3.45 116.94 107.79 1ll4 h PHE 241 Ca -0.55 0.00 -0.27 0.00 2.80 0.00 0.00 57.97 59.95 1ll4 h PHE 241 Cb 1.37 0.00 -0.21 0.00 2.20 0.00 0.00 35.95 39.31 1ll4 h PHE 241 CO 0.52 0.83 -0.73 -1.54 -0.60 0.00 0.00 178.31 176.78 1ll4 s SER 242 N -6.63 0.82 0.00 2.17 1.04 -1.25 -4.72 113.70 105.13 1ll4 s SER 242 Ca 0.02 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 55.89 1ll4 s SER 242 Cb 0.09 0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.26 1ll4 s SER 242 CO 0.79 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 175.40 1ll4 n GLY 243 N 1.43 -0.99 0.53 7.32 0.00 -1.26 -4.69 105.19 107.52 1ll4 n GLY 243 Ca -0.23 -0.84 0.39 0.00 0.00 0.00 0.00 46.02 45.34 1ll4 n GLY 243 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ll4 h SER 244 N 0.00 0.17 0.45 1.61 4.64 -1.94 0.20 113.55 118.68 1ll4 h SER 244 Ca 0.00 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1ll4 h SER 244 Cb 0.00 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1ll4 h SER 244 CO 0.00 -0.08 0.00 -2.67 -0.87 0.00 0.00 176.83 173.21 1ll4 n TRP 245 N -4.42 0.63 -2.96 4.77 2.14 -1.26 -4.88 117.44 111.45 1ll4 n TRP 245 Ca 0.35 0.27 -0.19 0.00 2.07 0.00 0.00 57.50 60.01 1ll4 n TRP 245 Cb 1.47 -0.94 0.04 0.00 -0.81 0.00 0.00 31.31 31.06 1ll4 n TRP 245 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1ll4 s ASP 246 N -3.94 5.31 -0.02 -0.67 -0.00 0.06 -5.05 116.67 112.36 1ll4 s ASP 246 Ca 0.02 -0.55 0.17 0.00 -0.00 0.00 0.00 52.55 52.20 1ll4 s ASP 246 Cb 0.08 -0.25 -0.26 0.00 -0.00 0.00 0.00 42.92 42.49 1ll4 s ASP 246 CO 0.29 -1.10 0.45 0.29 -0.00 0.00 0.00 175.17 175.10 1ll4 n LYS 247 N -2.12 0.69 -4.69 8.23 5.02 -1.26 -4.96 118.16 119.07 1ll4 n LYS 247 Ca 0.12 -0.13 -0.27 0.00 -2.02 0.00 0.00 58.31 56.01 1ll4 n LYS 247 Cb 0.60 -1.39 -0.14 0.00 -0.02 0.00 0.00 35.03 34.08 1ll4 n LYS 247 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ll4 s VAL 248 N -3.10 1.80 0.20 -0.18 1.01 -1.26 -3.38 120.40 115.49 1ll4 s VAL 248 Ca -0.04 -1.28 -0.30 0.00 0.00 0.00 0.00 61.98 60.36 1ll4 s VAL 248 Cb 0.11 -1.56 -0.09 0.00 0.00 0.00 0.00 36.38 34.84 1ll4 s VAL 248 CO 0.72 0.23 1.30 -0.94 0.00 0.00 0.00 175.10 176.42 1ll4 s SER 249 N -1.25 6.90 0.36 3.32 1.04 0.26 -4.90 113.70 119.44 1ll4 s SER 249 Ca 0.09 2.40 0.05 0.00 0.48 0.00 0.00 55.95 58.97 1ll4 s SER 249 Cb -0.09 -2.61 -0.02 0.00 0.10 0.00 0.00 66.02 63.40 1ll4 s SER 249 CO 0.02 -0.52 0.19 0.61 0.98 0.00 0.00 173.24 174.52 1ll4 n GLY 250 N 2.33 3.15 3.73 7.32 0.00 -1.26 -0.21 105.19 120.25 1ll4 n GLY 250 Ca 0.06 -2.01 -0.40 0.00 0.00 0.00 0.00 46.02 43.67 1ll4 n GLY 250 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ll4 s HIS 251 N -3.12 3.65 -1.05 1.61 3.76 0.20 -4.80 115.29 115.54 1ll4 s HIS 251 Ca 0.27 1.37 0.23 0.00 -0.15 0.00 0.00 55.06 56.78 1ll4 s HIS 251 Cb 0.01 -2.83 0.13 0.00 1.11 0.00 0.00 32.58 31.00 1ll4 s HIS 251 CO 0.19 0.16 1.15 0.00 -0.85 0.00 0.00 174.74 175.39 1ll4 n MET 252 N 3.38 0.06 -1.83 1.40 3.85 -1.26 -3.83 117.12 118.90 1ll4 n MET 252 Ca -0.01 -0.04 -0.02 0.00 -1.00 0.00 0.00 57.70 56.62 1ll4 n MET 252 Cb 0.51 -1.50 0.02 0.00 -1.05 0.00 0.00 33.22 31.20 1ll4 n MET 252 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1ll4 n SER 253 N -1.43 -0.32 -4.77 3.17 3.41 -1.26 -0.44 113.62 111.97 1ll4 n SER 253 Ca 0.05 -2.06 -0.36 0.00 -0.26 0.00 0.00 58.87 56.24 1ll4 n SER 253 Cb 0.34 0.16 -0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1ll4 n SER 253 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ll4 s ASN 254 N -1.67 5.92 -0.09 4.04 4.22 -1.26 -4.81 114.94 121.28 1ll4 s ASN 254 Ca 0.14 2.22 -0.26 0.00 -2.14 0.00 0.00 52.86 52.81 1ll4 s ASN 254 Cb 0.25 -2.59 -0.23 0.00 1.28 0.00 0.00 41.25 39.97 1ll4 s ASN 254 CO -0.08 -1.09 0.92 0.58 -2.04 0.00 0.00 177.10 175.40 1ll4 h VAL 255 N 1.47 1.53 -3.96 3.54 2.07 -1.14 0.19 116.25 119.95 1ll4 h VAL 255 Ca -0.50 -1.81 -0.69 0.00 0.82 0.00 0.00 66.70 64.53 1ll4 h VAL 255 Cb 1.26 2.73 -0.22 0.00 -1.52 0.00 0.00 31.29 33.53 1ll4 h VAL 255 CO 0.58 0.46 -0.86 -0.36 0.02 0.00 0.00 177.57 177.41 1ll4 s PHE 256 N -2.98 2.37 0.30 1.57 0.40 -0.28 -1.79 117.98 117.57 1ll4 s PHE 256 Ca -0.17 -0.36 -0.30 0.00 -0.60 0.00 0.00 56.93 55.51 1ll4 s PHE 256 Cb -0.01 -1.31 -0.11 0.00 0.51 0.00 0.00 43.02 42.09 1ll4 s PHE 256 CO 0.65 0.30 1.58 -2.14 0.70 0.00 0.00 175.22 176.31 1ll4 s PRO 257 N -1.86 4.12 -0.33 0.24 0.02 -1.26 -4.78 135.00 131.16 1ll4 s PRO 257 Ca 0.14 2.57 -0.29 0.00 0.02 0.00 0.00 61.00 63.44 1ll4 s PRO 257 Cb -0.10 -3.02 0.01 0.00 0.02 0.00 0.00 34.50 31.41 1ll4 s PRO 257 CO 0.06 -0.62 1.21 0.45 -0.33 0.00 0.00 177.00 177.77 1ll4 s SER 258 N 0.43 6.75 0.16 2.53 0.15 -1.26 -4.89 113.70 117.58 1ll4 s SER 258 Ca 0.62 1.05 0.06 0.00 0.70 0.00 0.00 55.95 58.38 1ll4 s SER 258 Cb -0.48 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.26 1ll4 s SER 258 CO 0.49 -1.04 1.37 0.71 1.20 0.00 0.00 173.24 175.97 1ll4 h THR 259 N 5.93 1.58 -0.23 6.45 1.35 -1.97 -2.96 112.91 123.05 1ll4 h THR 259 Ca -0.24 -2.87 -0.18 0.00 -0.55 0.00 0.00 66.41 62.57 1ll4 h THR 259 Cb 1.08 2.58 0.00 0.00 -1.73 0.00 0.00 68.15 70.09 1ll4 h THR 259 CO 1.05 0.83 -0.55 0.71 -0.25 0.00 0.00 175.52 177.31 1ll4 h THR 260 N 0.04 1.29 -2.09 6.82 1.35 -2.03 -3.37 112.91 114.92 1ll4 h THR 260 Ca -0.03 -1.75 -0.57 0.00 -0.55 0.00 0.00 66.41 63.52 1ll4 h THR 260 Cb 1.56 1.78 -0.40 0.00 -1.73 0.00 0.00 68.15 69.35 1ll4 h THR 260 CO 0.13 0.56 -0.91 1.17 -0.25 0.00 0.00 175.52 176.21 1ll4 n LYS 261 N -4.07 1.55 -0.33 4.72 4.81 -1.24 -4.96 118.16 118.65 1ll4 n LYS 261 Ca -0.06 -3.86 0.20 0.00 -0.87 0.00 0.00 58.31 53.73 1ll4 n LYS 261 Cb 0.62 -1.70 0.42 0.00 0.02 0.00 0.00 35.03 34.40 1ll4 n LYS 261 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1ll4 h PRO 262 N 3.86 0.34 0.00 1.64 0.11 -1.70 0.16 132.00 136.41 1ll4 h PRO 262 Ca 0.12 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.21 1ll4 h PRO 262 Cb 0.79 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.82 1ll4 h PRO 262 CO 0.62 0.22 -0.02 1.05 -0.21 0.00 0.00 178.00 179.67 1ll4 h GLU 263 N 0.35 0.00 0.00 1.05 9.09 -1.93 -1.06 114.58 122.08 1ll4 h GLU 263 Ca 0.68 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.09 1ll4 h GLU 263 Cb 1.48 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.58 1ll4 h GLU 263 CO -0.59 0.02 -0.04 -1.13 0.05 0.00 0.00 179.01 177.31 1ll4 n SER 264 N -3.42 0.59 -3.41 3.06 3.41 0.55 -4.42 113.62 109.98 1ll4 n SER 264 Ca -0.03 0.52 -0.26 0.00 -0.26 0.00 0.00 58.87 58.84 1ll4 n SER 264 Cb 0.11 -0.65 -0.09 0.00 -0.26 0.00 0.00 64.21 63.33 1ll4 n SER 264 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1ll4 n THR 265 N -2.04 0.15 0.10 6.66 -2.24 -0.40 -0.62 114.28 115.89 1ll4 n THR 265 Ca 0.06 -4.23 0.17 0.00 -2.27 0.00 0.00 64.05 57.78 1ll4 n THR 265 Cb 0.41 -1.94 0.72 0.00 -2.10 0.00 0.00 70.33 67.42 1ll4 n THR 265 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1ll4 h PRO 266 N 4.72 0.00 0.00 -0.78 0.13 -1.77 -3.44 132.00 130.86 1ll4 h PRO 266 Ca 0.17 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.96 1ll4 h PRO 266 Cb 0.82 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.87 1ll4 h PRO 266 CO 0.55 0.00 -0.29 1.19 -0.23 0.00 0.00 178.00 179.22 1ll4 n PHE 267 N -4.24 -0.12 -3.64 1.56 3.01 -1.26 -5.11 117.46 107.67 1ll4 n PHE 267 Ca 0.05 -1.69 -0.08 0.00 1.01 0.00 0.00 57.45 56.74 1ll4 n PHE 267 Cb 0.44 0.06 -0.07 0.00 -0.01 0.00 0.00 39.48 39.90 1ll4 n PHE 267 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1ll4 s SER 268 N -2.54 -0.36 0.17 4.37 1.04 -1.26 -4.70 113.70 110.42 1ll4 s SER 268 Ca 0.17 0.69 -0.19 0.00 0.48 0.00 0.00 55.95 57.10 1ll4 s SER 268 Cb 0.01 0.69 0.11 0.00 0.10 0.00 0.00 66.02 66.92 1ll4 s SER 268 CO 0.12 -0.13 1.63 0.28 0.98 0.00 0.00 173.24 176.12 1ll4 h SER 269 N 3.89 -0.68 -0.88 7.02 0.02 -0.72 -2.95 113.55 119.25 1ll4 h SER 269 Ca -0.27 0.16 0.17 0.00 -0.84 0.00 0.00 61.79 61.01 1ll4 h SER 269 Cb 1.18 0.37 -0.10 0.00 0.14 0.00 0.00 62.40 63.99 1ll4 h SER 269 CO 0.13 -0.23 0.44 -0.78 -1.14 0.00 0.00 176.83 175.25 1ll4 h ASP 270 N -0.12 0.49 -0.07 3.07 1.82 -1.62 0.17 116.42 120.16 1ll4 h ASP 270 Ca 0.20 0.11 0.01 0.00 -0.39 0.00 0.00 57.03 56.96 1ll4 h ASP 270 Cb 0.43 0.04 -0.01 0.00 0.68 0.00 0.00 39.33 40.48 1ll4 h ASP 270 CO -0.49 0.16 0.03 0.50 -1.61 0.00 0.00 179.24 177.82 1ll4 h LYS 271 N 0.57 0.06 0.16 0.28 1.63 -1.77 -2.28 116.57 115.22 1ll4 h LYS 271 Ca 0.51 -0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 60.30 1ll4 h LYS 271 Cb 0.81 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.42 1ll4 h LYS 271 CO -0.42 0.04 -0.10 0.00 -3.45 0.00 0.00 179.45 175.53 1ll4 h ALA 272 N 1.04 -0.24 0.49 5.00 0.00 -0.72 -1.60 119.26 123.23 1ll4 h ALA 272 Ca 0.03 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1ll4 h ALA 272 Cb 0.01 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ll4 h ALA 272 CO -0.03 -0.64 -0.26 0.28 0.00 0.00 0.00 179.25 178.61 1ll4 h VAL 273 N -0.25 0.47 0.00 0.00 2.07 -1.26 0.46 116.25 117.74 1ll4 h VAL 273 Ca -0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 1ll4 h VAL 273 Cb 0.21 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1ll4 h VAL 273 CO 0.02 0.00 -0.08 0.07 0.02 0.00 0.00 177.57 177.59 1ll4 h LYS 274 N -0.69 0.00 -0.09 1.57 2.10 -1.43 -0.87 116.57 117.16 1ll4 h LYS 274 Ca -0.06 0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 58.39 1ll4 h LYS 274 Cb 0.54 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.87 1ll4 h LYS 274 CO 0.09 0.08 -0.76 -0.44 -2.00 0.00 0.00 179.45 176.43 1ll4 h ASP 275 N 0.00 0.59 -0.55 7.07 5.19 -0.65 0.40 116.42 128.47 1ll4 h ASP 275 Ca -0.00 -0.40 -0.07 0.00 -0.62 0.00 0.00 57.03 55.94 1ll4 h ASP 275 Cb 0.37 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 39.69 1ll4 h ASP 275 CO 0.01 1.15 0.07 1.88 -3.12 0.00 0.00 179.24 179.24 1ll4 h TYR 276 N 0.33 0.97 -0.22 4.55 -1.99 -0.14 -0.72 116.97 119.76 1ll4 h TYR 276 Ca -0.04 -0.14 -0.05 0.00 2.00 0.00 0.00 58.73 60.50 1ll4 h TYR 276 Cb 1.35 -0.26 -0.01 0.00 2.00 0.00 0.00 36.73 39.81 1ll4 h TYR 276 CO 0.06 0.87 -0.05 0.82 -0.00 0.00 0.00 178.16 179.85 1ll4 h ILE 277 N 0.80 1.29 -0.29 -2.88 2.04 -1.10 0.11 117.51 117.47 1ll4 h ILE 277 Ca 0.16 -1.05 -0.00 0.00 1.00 0.00 0.00 64.86 64.98 1ll4 h ILE 277 Cb 0.43 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 1ll4 h ILE 277 CO 0.01 0.32 0.17 0.11 0.00 0.00 0.00 178.15 178.77 1ll4 h LYS 278 N 0.15 0.39 0.00 2.37 1.57 -0.84 -1.03 116.57 119.18 1ll4 h LYS 278 Ca 0.06 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1ll4 h LYS 278 Cb 0.51 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 1ll4 h LYS 278 CO 0.02 0.27 -0.11 0.00 -0.57 0.00 0.00 179.45 179.06 1ll4 h ALA 279 N 1.80 1.08 0.00 3.86 0.00 -0.19 -3.47 119.26 122.33 1ll4 h ALA 279 Ca 0.11 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ll4 h ALA 279 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1ll4 h ALA 279 CO -0.02 0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.78 1ll4 n GLY 280 N -0.19 1.55 3.73 0.00 0.00 0.17 -4.29 105.19 106.15 1ll4 n GLY 280 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1ll4 n GLY 280 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ll4 s VAL 281 N -2.00 4.95 -0.01 1.61 1.01 -0.08 -4.82 120.40 121.06 1ll4 s VAL 281 Ca 0.00 1.49 -0.35 0.00 0.00 0.00 0.00 61.98 63.11 1ll4 s VAL 281 Cb 0.00 -4.06 -0.14 0.00 0.00 0.00 0.00 36.38 32.19 1ll4 s VAL 281 CO 0.00 0.29 1.67 -2.65 0.00 0.00 0.00 175.10 174.42 1ll4 n PRO 282 N 3.43 1.84 -0.32 2.72 -0.02 -1.26 -4.10 135.00 137.29 1ll4 n PRO 282 Ca -0.02 0.67 0.07 0.00 -2.02 0.00 0.00 63.50 62.20 1ll4 n PRO 282 Cb 0.51 -2.43 0.27 0.00 -0.02 0.00 0.00 33.50 31.83 1ll4 n PRO 282 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ll4 h ALA 283 N 7.06 1.59 0.00 3.55 0.00 -1.93 -0.13 119.26 129.41 1ll4 h ALA 283 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1ll4 h ALA 283 Cb 1.28 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ll4 h ALA 283 CO 0.90 0.20 0.00 0.27 0.00 0.00 0.00 179.25 180.62 1ll4 n ASN 284 N -4.56 0.42 -0.51 0.00 6.94 -1.06 -0.59 115.26 115.89 1ll4 n ASN 284 Ca 0.17 0.65 0.12 0.00 -0.02 0.00 0.00 54.58 55.50 1ll4 n ASN 284 Cb 0.33 -0.72 0.19 0.00 -2.36 0.00 0.00 39.78 37.22 1ll4 n ASN 284 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1ll4 n LYS 285 N -2.02 1.37 -3.27 -3.83 5.02 -0.06 -2.70 118.16 112.67 1ll4 n LYS 285 Ca 0.00 -1.02 -0.42 0.00 -2.02 0.00 0.00 58.31 54.85 1ll4 n LYS 285 Cb 0.10 -1.48 -0.08 0.00 -0.02 0.00 0.00 35.03 33.55 1ll4 n LYS 285 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ll4 s ILE 286 N -2.33 5.03 -0.26 -0.18 1.01 0.24 -0.07 121.20 124.64 1ll4 s ILE 286 Ca 0.25 0.04 -0.12 0.00 0.00 0.00 0.00 60.65 60.81 1ll4 s ILE 286 Cb 0.19 -4.00 -0.05 0.00 0.01 0.00 0.00 42.46 38.61 1ll4 s ILE 286 CO 0.48 -0.32 0.25 -0.69 0.00 0.00 0.00 174.94 174.66 1ll4 s VAL 287 N 2.32 5.28 -0.40 2.92 1.01 0.88 -0.47 120.40 131.94 1ll4 s VAL 287 Ca 0.16 0.32 -0.29 0.00 0.00 0.00 0.00 61.98 62.17 1ll4 s VAL 287 Cb -0.16 -3.58 0.02 0.00 0.00 0.00 0.00 36.38 32.65 1ll4 s VAL 287 CO 0.14 0.25 1.24 -0.22 0.00 0.00 0.00 175.10 176.51 1ll4 s LEU 288 N 1.65 3.72 0.21 3.92 1.98 0.11 -1.41 118.68 128.85 1ll4 s LEU 288 Ca 0.10 0.81 -0.30 0.00 -2.89 0.00 0.00 54.13 51.85 1ll4 s LEU 288 Cb -0.15 -3.54 -0.09 0.00 0.66 0.00 0.00 46.19 43.07 1ll4 s LEU 288 CO 0.09 -1.21 1.30 -0.83 -1.89 0.00 0.00 176.35 173.81 1ll4 s GLY 289 N 2.81 2.50 -0.01 7.98 0.00 0.70 -1.04 107.32 120.26 1ll4 s GLY 289 Ca 0.53 1.11 0.03 0.00 0.00 0.00 0.00 44.72 46.39 1ll4 s GLY 289 CO 0.28 2.05 -0.10 1.06 0.00 0.00 0.00 173.10 176.38 1ll4 s MET 290 N -0.23 0.89 0.35 2.90 -1.94 0.15 -3.86 119.30 117.57 1ll4 s MET 290 Ca 0.56 -0.35 -0.25 0.00 -1.71 0.00 0.00 55.69 53.94 1ll4 s MET 290 Cb -0.36 -0.85 -0.10 0.00 2.01 0.00 0.00 34.83 35.53 1ll4 s MET 290 CO 0.39 0.19 0.98 -1.25 -0.01 0.00 0.00 175.02 175.31 1ll4 s PRO 291 N -0.10 4.44 -0.21 2.03 0.04 -1.26 -2.43 135.00 137.50 1ll4 s PRO 291 Ca 0.02 1.37 0.15 0.00 0.04 0.00 0.00 61.00 62.57 1ll4 s PRO 291 Cb -0.06 -2.68 0.55 0.00 0.04 0.00 0.00 34.50 32.36 1ll4 s PRO 291 CO -0.00 0.13 1.47 1.28 0.04 0.00 0.00 177.00 179.92 1ll4 n LEU 292 N 0.28 4.16 -4.37 -3.56 4.77 0.02 -4.82 117.00 113.48 1ll4 n LEU 292 Ca 0.03 -3.18 -0.19 0.00 -0.03 0.00 0.00 56.01 52.64 1ll4 n LEU 292 Cb 0.50 -0.58 -0.10 0.00 -2.33 0.00 0.00 43.42 40.91 1ll4 n LEU 292 CO 0.44 0.79 -0.23 -0.72 -1.33 0.00 0.00 177.39 176.34 1ll4 s TYR 293 N -2.92 1.65 0.02 -1.77 1.13 -1.26 -1.27 117.35 112.92 1ll4 s TYR 293 Ca 0.44 -1.23 0.01 0.00 -1.41 0.00 0.00 57.07 54.88 1ll4 s TYR 293 Cb 0.36 -0.97 -0.01 0.00 -1.10 0.00 0.00 41.96 40.24 1ll4 s TYR 293 CO 0.08 -0.35 -0.05 0.20 -2.51 0.00 0.00 175.55 172.91 1ll4 s GLY 294 N -3.40 0.31 -0.21 5.49 0.00 0.12 -4.73 107.32 104.90 1ll4 s GLY 294 Ca 0.35 -0.43 -0.11 0.00 0.00 0.00 0.00 44.72 44.53 1ll4 s GLY 294 CO 0.15 -0.44 0.16 0.50 0.00 0.00 0.00 173.10 173.47 1ll4 s ARG 295 N -0.78 4.15 0.32 2.90 0.52 -0.09 -0.80 118.95 125.17 1ll4 s ARG 295 Ca -0.05 -0.20 -0.02 0.00 -0.52 0.00 0.00 55.73 54.94 1ll4 s ARG 295 Cb -0.06 -3.47 -0.04 0.00 0.52 0.00 0.00 34.95 31.90 1ll4 s ARG 295 CO -0.00 0.19 0.55 0.00 0.02 0.00 0.00 175.30 176.07 1ll4 s ALA 296 N 0.66 3.66 -0.01 2.13 0.00 -0.32 0.04 121.76 127.93 1ll4 s ALA 296 Ca 0.09 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.30 1ll4 s ALA 296 Cb -0.12 -2.20 0.02 0.00 0.00 0.00 0.00 23.12 20.81 1ll4 s ALA 296 CO 0.01 0.09 0.01 -0.06 0.00 0.00 0.00 175.76 175.82 1ll4 s PHE 297 N -2.22 0.09 0.18 0.00 0.40 0.18 -4.68 117.98 111.94 1ll4 s PHE 297 Ca 0.42 0.05 0.06 0.00 -0.60 0.00 0.00 56.93 56.86 1ll4 s PHE 297 Cb -0.10 -0.18 -0.04 0.00 0.51 0.00 0.00 43.02 43.21 1ll4 s PHE 297 CO 0.34 -0.06 0.08 0.00 0.70 0.00 0.00 175.22 176.28 1ll4 s ALA 298 N 0.60 3.39 -1.05 5.36 0.00 0.42 -1.26 121.76 129.23 1ll4 s ALA 298 Ca -0.05 -1.32 -0.12 0.00 0.00 0.00 0.00 51.96 50.47 1ll4 s ALA 298 Cb -0.08 -1.17 -0.03 0.00 0.00 0.00 0.00 23.12 21.84 1ll4 s ALA 298 CO -0.02 0.46 0.82 0.43 0.00 0.00 0.00 175.76 177.46 1ll4 n SER 299 N -0.34 -6.09 -4.27 0.00 7.64 -0.63 -0.26 113.62 109.67 1ll4 n SER 299 Ca -0.09 -0.80 -0.19 0.00 1.01 0.00 0.00 58.87 58.81 1ll4 n SER 299 Cb 0.55 -4.20 -0.11 0.00 -1.01 0.00 0.00 64.21 59.45 1ll4 n SER 299 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1ll4 s THR 300 N -3.36 1.46 -0.14 0.44 -4.23 0.67 -3.89 115.64 106.59 1ll4 s THR 300 Ca 0.40 -1.79 -0.09 0.00 -1.18 0.00 0.00 61.69 59.03 1ll4 s THR 300 Cb -0.10 -1.63 -0.25 0.00 1.34 0.00 0.00 72.50 71.86 1ll4 s THR 300 CO 0.81 -0.40 0.32 0.47 -0.54 0.00 0.00 174.62 175.27 1ll4 n ASP 301 N 0.43 2.08 0.00 3.99 10.43 -1.26 -4.51 116.55 127.71 1ll4 n ASP 301 Ca -0.15 0.24 0.00 0.00 2.57 0.00 0.00 54.79 57.45 1ll4 n ASP 301 Cb 0.57 -0.87 0.00 0.00 1.84 0.00 0.00 41.12 42.66 1ll4 n ASP 301 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1ll4 n GLY 302 N 1.90 -0.94 3.72 0.44 0.00 -1.26 -5.00 105.19 104.05 1ll4 n GLY 302 Ca -0.33 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.45 1ll4 n GLY 302 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1ll4 n ILE 303 N 2.09 1.60 -0.75 -0.61 0.13 -1.26 -1.09 119.36 119.47 1ll4 n ILE 303 Ca 0.00 -0.40 0.00 0.00 -1.10 0.00 0.00 62.75 61.25 1ll4 n ILE 303 Cb 0.00 -1.74 0.00 0.00 -0.84 0.00 0.00 39.64 37.06 1ll4 n ILE 303 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1ll4 n GLY 304 N 1.24 1.45 3.97 4.50 0.00 0.71 -4.95 105.19 112.11 1ll4 n GLY 304 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 1ll4 n GLY 304 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ll4 s THR 305 N -3.73 3.11 0.58 2.61 -4.23 -0.25 -4.68 115.64 109.05 1ll4 s THR 305 Ca 0.00 -1.10 -0.17 0.00 -1.18 0.00 0.00 61.69 59.24 1ll4 s THR 305 Cb 0.00 -3.07 -0.04 0.00 1.34 0.00 0.00 72.50 70.73 1ll4 s THR 305 CO 0.00 -0.03 1.08 -0.94 -0.54 0.00 0.00 174.62 174.19 1ll4 s SER 306 N -4.25 5.71 0.13 3.99 1.04 -1.26 -0.57 113.70 118.48 1ll4 s SER 306 Ca 0.51 1.96 -0.00 0.00 0.48 0.00 0.00 55.95 58.90 1ll4 s SER 306 Cb -0.08 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.44 1ll4 s SER 306 CO 0.31 -1.22 0.02 0.72 0.98 0.00 0.00 173.24 174.06 1ll4 s PHE 307 N -2.19 0.90 -0.11 5.02 -0.12 -1.22 -4.14 117.98 116.13 1ll4 s PHE 307 Ca 0.67 -1.13 -0.03 0.00 -0.05 0.00 0.00 56.93 56.39 1ll4 s PHE 307 Cb -0.19 -0.53 0.05 0.00 -0.63 0.00 0.00 43.02 41.73 1ll4 s PHE 307 CO 0.33 -0.39 0.11 1.21 -0.05 0.00 0.00 175.22 176.43 1ll4 s ASN 308 N -3.06 1.43 0.00 1.98 2.47 0.65 -4.92 114.94 113.48 1ll4 s ASN 308 Ca 0.20 -0.10 0.00 0.00 0.42 0.00 0.00 52.86 53.39 1ll4 s ASN 308 Cb 0.07 -0.02 0.00 0.00 -1.45 0.00 0.00 41.25 39.85 1ll4 s ASN 308 CO -0.00 -0.29 0.00 0.61 -3.72 0.00 0.00 177.10 173.70 1ll4 n GLY 309 N 5.30 -0.82 0.00 1.21 0.00 -1.26 -4.13 105.19 105.49 1ll4 n GLY 309 Ca -0.05 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1ll4 n GLY 309 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ll4 n VAL 310 N -0.67 0.00 -4.14 1.61 0.24 -1.26 -0.44 118.33 113.66 1ll4 n VAL 310 Ca 0.00 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 1ll4 n VAL 310 Cb 0.00 1.30 0.00 0.00 -1.47 0.00 0.00 33.84 33.67 1ll4 n VAL 310 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ll4 n GLY 311 N 0.20 -0.85 0.00 7.63 0.00 -1.26 -3.95 105.19 106.95 1ll4 n GLY 311 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.84 1ll4 n GLY 311 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ll4 n GLY 312 N 0.00 1.01 3.99 -0.02 0.00 -1.26 -3.15 105.19 105.76 1ll4 n GLY 312 Ca 0.00 -1.53 0.05 0.00 0.00 0.00 0.00 46.02 44.54 1ll4 n GLY 312 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ll4 s GLY 313 N 0.00 -0.25 0.13 -0.02 0.00 -1.15 0.12 107.32 106.15 1ll4 s GLY 313 Ca 0.00 0.25 0.03 0.00 0.00 0.00 0.00 44.72 45.01 1ll4 s GLY 313 CO 0.00 6.32 1.28 1.76 0.00 0.00 0.00 173.10 182.46 1ll4 h SER 314 N 2.00 0.16 0.00 1.64 0.02 -1.23 -3.42 113.55 112.71 1ll4 h SER 314 Ca -0.21 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1ll4 h SER 314 Cb 1.17 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1ll4 h SER 314 CO 0.29 1.07 -0.13 0.79 -1.14 0.00 0.00 176.83 177.71 1ll4 n TRP 315 N -3.48 0.00 -4.32 3.45 7.02 -1.26 -5.01 117.44 113.84 1ll4 n TRP 315 Ca -0.03 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 56.28 1ll4 n TRP 315 Cb 0.92 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.71 1ll4 n TRP 315 CO 0.00 0.00 0.00 -1.83 -2.02 0.00 0.00 177.69 173.84 1ll4 s GLU 316 N -1.13 1.46 0.33 -0.99 -1.05 -1.26 -5.12 118.70 110.94 1ll4 s GLU 316 Ca 0.00 -1.81 -0.23 0.00 -0.15 0.00 0.00 54.97 52.78 1ll4 s GLU 316 Cb 0.00 -0.16 -0.10 0.00 -0.44 0.00 0.00 34.13 33.43 1ll4 s GLU 316 CO 0.00 -0.36 0.91 -0.80 0.95 0.00 0.00 175.26 175.95 1ll4 s ASN 317 N -3.32 7.18 0.00 0.83 0.02 -1.26 -2.94 114.94 115.44 1ll4 s ASN 317 Ca 0.37 1.72 0.00 0.00 -1.02 0.00 0.00 52.86 53.93 1ll4 s ASN 317 Cb 0.07 -2.54 0.00 0.00 0.02 0.00 0.00 41.25 38.80 1ll4 s ASN 317 CO 0.15 -0.13 0.00 0.61 0.02 0.00 0.00 177.10 177.75 1ll4 n GLY 318 N 0.25 0.37 2.89 0.66 0.00 0.33 -4.88 105.19 104.81 1ll4 n GLY 318 Ca 0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 1ll4 n GLY 318 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ll4 s VAL 319 N -1.90 0.77 -0.03 1.61 1.01 -1.23 -1.17 120.40 119.46 1ll4 s VAL 319 Ca 0.00 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 61.86 1ll4 s VAL 319 Cb 0.00 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 1ll4 s VAL 319 CO 0.00 0.30 -0.23 0.26 0.00 0.00 0.00 175.10 175.43 1ll4 s TRP 320 N 1.37 2.14 0.26 5.22 0.52 0.02 -0.66 118.94 127.81 1ll4 s TRP 320 Ca -0.03 -0.45 -0.30 0.00 0.02 0.00 0.00 56.10 55.34 1ll4 s TRP 320 Cb -0.14 -1.39 -0.09 0.00 -1.15 0.00 0.00 33.47 30.71 1ll4 s TRP 320 CO -0.03 -0.07 1.24 -0.51 0.02 0.00 0.00 176.95 177.60 1ll4 s ASP 321 N -0.46 6.98 0.35 2.95 1.01 -1.26 0.15 116.67 126.39 1ll4 s ASP 321 Ca 0.06 2.43 0.10 0.00 0.71 0.00 0.00 52.55 55.85 1ll4 s ASP 321 Cb -0.10 -2.63 0.84 0.00 1.01 0.00 0.00 42.92 42.05 1ll4 s ASP 321 CO -0.00 -0.41 1.82 0.22 0.21 0.00 0.00 175.17 177.01 1ll4 h TYR 322 N 4.38 0.88 0.00 4.23 3.20 -1.00 0.13 116.97 128.79 1ll4 h TYR 322 Ca -0.46 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.43 1ll4 h TYR 322 Cb 1.22 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.22 1ll4 h TYR 322 CO 0.59 0.24 0.00 0.36 -1.64 0.00 0.00 178.16 177.71 1ll4 n LYS 323 N -4.64 0.26 0.00 1.82 2.85 0.05 -0.43 118.16 118.08 1ll4 n LYS 323 Ca 0.21 0.11 0.12 0.00 -1.05 0.00 0.00 58.31 57.70 1ll4 n LYS 323 Cb 0.58 -1.50 0.11 0.00 -0.65 0.00 0.00 35.03 33.58 1ll4 n LYS 323 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1ll4 n ASP 324 N -1.19 1.69 -4.87 -5.58 8.00 0.03 -4.91 116.55 109.72 1ll4 n ASP 324 Ca 0.07 -1.31 -0.34 0.00 0.71 0.00 0.00 54.79 53.93 1ll4 n ASP 324 Cb 0.09 0.38 -0.05 0.00 -0.02 0.00 0.00 41.12 41.51 1ll4 n ASP 324 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1ll4 s MET 325 N -2.50 3.76 0.02 -1.24 -1.94 0.43 -3.76 119.30 114.08 1ll4 s MET 325 Ca 0.20 0.17 -0.14 0.00 -1.71 0.00 0.00 55.69 54.21 1ll4 s MET 325 Cb 0.18 -2.92 -0.06 0.00 2.01 0.00 0.00 34.83 34.04 1ll4 s MET 325 CO 0.56 0.51 0.41 -1.25 -0.01 0.00 0.00 175.02 175.24 1ll4 s PRO 326 N -2.16 3.89 0.33 2.03 0.04 -1.26 -5.01 135.00 132.86 1ll4 s PRO 326 Ca 0.37 0.37 -0.28 0.00 0.04 0.00 0.00 61.00 61.50 1ll4 s PRO 326 Cb -0.13 -3.16 -0.09 0.00 0.04 0.00 0.00 34.50 31.15 1ll4 s PRO 326 CO 0.20 0.66 1.17 -0.65 0.04 0.00 0.00 177.00 178.41 1ll4 s GLN 327 N -1.28 4.41 0.08 4.56 -0.21 -1.25 -4.95 119.66 121.01 1ll4 s GLN 327 Ca 0.26 1.91 -0.36 0.00 0.02 0.00 0.00 55.36 57.19 1ll4 s GLN 327 Cb -0.16 -3.01 -0.16 0.00 1.00 0.00 0.00 33.01 30.68 1ll4 s GLN 327 CO 0.15 -0.03 1.40 1.04 -2.12 0.00 0.00 175.29 175.73 1ll4 n GLN 328 N 0.77 1.32 -0.79 2.91 6.02 -1.26 -1.74 117.38 124.61 1ll4 n GLN 328 Ca 0.01 0.48 0.00 0.00 -0.01 0.00 0.00 57.00 57.47 1ll4 n GLN 328 Cb 0.45 -2.14 0.00 0.00 1.02 0.00 0.00 30.24 29.56 1ll4 n GLN 328 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ll4 n GLY 329 N 2.77 0.64 3.57 1.08 0.00 -1.26 -5.04 105.19 106.95 1ll4 n GLY 329 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1ll4 n GLY 329 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ll4 s ALA 330 N -2.20 2.95 -0.12 4.61 0.00 -0.71 -4.45 121.76 121.83 1ll4 s ALA 330 Ca 0.00 -1.01 -0.05 0.00 0.00 0.00 0.00 51.96 50.90 1ll4 s ALA 330 Cb 0.00 -1.10 -0.04 0.00 0.00 0.00 0.00 23.12 21.98 1ll4 s ALA 330 CO 0.00 0.60 0.08 1.14 0.00 0.00 0.00 175.76 177.58 1ll4 s GLN 331 N -1.26 3.40 -0.18 0.00 -2.07 0.45 -4.80 119.66 115.21 1ll4 s GLN 331 Ca 0.16 -0.26 -0.16 0.00 -1.82 0.00 0.00 55.36 53.27 1ll4 s GLN 331 Cb -0.11 -3.07 -0.04 0.00 -1.09 0.00 0.00 33.01 28.70 1ll4 s GLN 331 CO 0.06 0.65 0.41 0.08 -1.32 0.00 0.00 175.29 175.16 1ll4 s VAL 332 N -0.69 5.21 -0.14 3.63 1.01 -1.26 -1.56 120.40 126.60 1ll4 s VAL 332 Ca 0.12 0.75 -0.04 0.00 0.00 0.00 0.00 61.98 62.81 1ll4 s VAL 332 Cb -0.12 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 1ll4 s VAL 332 CO 0.02 0.29 0.01 -0.89 0.00 0.00 0.00 175.10 174.53 1ll4 s THR 333 N 1.04 4.31 -0.21 3.92 2.01 0.04 -4.97 115.64 121.77 1ll4 s THR 333 Ca 0.20 -0.22 0.01 0.00 0.31 0.00 0.00 61.69 61.99 1ll4 s THR 333 Cb -0.15 -2.88 0.03 0.00 0.01 0.00 0.00 72.50 69.52 1ll4 s THR 333 CO 0.08 0.53 -0.16 -1.61 -0.69 0.00 0.00 174.62 172.76 1ll4 s GLU 334 N -0.10 2.79 -0.80 4.92 2.02 -1.26 -1.46 118.70 124.81 1ll4 s GLU 334 Ca 0.04 -0.97 -0.06 0.00 0.02 0.00 0.00 54.97 54.00 1ll4 s GLU 334 Cb -0.13 -2.70 0.21 0.00 0.10 0.00 0.00 34.13 31.61 1ll4 s GLU 334 CO 0.02 -0.32 0.69 -0.51 0.02 0.00 0.00 175.26 175.16 1ll4 s LEU 335 N 1.25 5.87 0.28 1.80 1.02 0.89 -4.93 118.68 124.85 1ll4 s LEU 335 Ca 0.01 -3.11 -0.00 0.00 0.02 0.00 0.00 54.13 51.05 1ll4 s LEU 335 Cb -0.15 -2.01 0.50 0.00 0.02 0.00 0.00 46.19 44.55 1ll4 s LEU 335 CO -0.10 -0.37 1.85 -0.33 0.02 0.00 0.00 176.35 177.42 1ll4 h GLU 336 N 6.95 1.01 0.00 1.70 5.08 -1.96 -1.54 114.58 125.82 1ll4 h GLU 336 Ca 0.08 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1ll4 h GLU 336 Cb 0.93 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 1ll4 h GLU 336 CO 0.79 0.67 -0.08 0.38 -1.00 0.00 0.00 179.01 179.76 1ll4 h ASP 337 N 1.04 0.00 -0.12 1.42 -0.00 -1.95 -1.52 116.42 115.29 1ll4 h ASP 337 Ca 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.50 1ll4 h ASP 337 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.72 1ll4 h ASP 337 CO -0.24 0.08 0.00 2.30 -0.00 0.00 0.00 179.24 181.38 1ll4 n ILE 338 N -4.19 0.26 -3.43 4.15 -5.35 -1.10 -4.78 119.36 104.92 1ll4 n ILE 338 Ca -0.03 -0.63 -0.29 0.00 -0.27 0.00 0.00 62.75 61.53 1ll4 n ILE 338 Cb 0.16 1.08 0.03 0.00 -1.74 0.00 0.00 39.64 39.17 1ll4 n ILE 338 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ll4 n ALA 339 N 0.73 -2.52 -3.23 -1.28 0.00 -0.57 -1.12 120.51 112.52 1ll4 n ALA 339 Ca 0.09 0.34 -0.13 0.00 0.00 0.00 0.00 53.44 53.75 1ll4 n ALA 339 Cb 0.36 -2.17 -0.10 0.00 0.00 0.00 0.00 19.45 17.55 1ll4 n ALA 339 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ll4 s ALA 340 N -2.03 -0.80 0.21 0.00 0.00 -0.82 -3.15 121.76 115.17 1ll4 s ALA 340 Ca 0.27 0.68 -0.05 0.00 0.00 0.00 0.00 51.96 52.86 1ll4 s ALA 340 Cb -0.04 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.77 1ll4 s ALA 340 CO 0.86 -0.20 0.25 -1.54 0.00 0.00 0.00 175.76 175.13 1ll4 s SER 341 N -0.44 0.07 0.04 0.00 1.04 -1.25 -0.08 113.70 113.09 1ll4 s SER 341 Ca -0.06 -1.20 -0.27 0.00 0.48 0.00 0.00 55.95 54.90 1ll4 s SER 341 Cb -0.04 0.45 0.08 0.00 0.10 0.00 0.00 66.02 66.61 1ll4 s SER 341 CO 0.02 -0.93 0.71 -0.72 0.98 0.00 0.00 173.24 173.30 1ll4 s TYR 342 N -4.10 -0.52 0.12 5.02 1.13 -0.54 -3.02 117.35 115.45 1ll4 s TYR 342 Ca 0.32 0.53 0.03 0.00 -1.41 0.00 0.00 57.07 56.54 1ll4 s TYR 342 Cb 0.04 0.51 -0.04 0.00 -1.10 0.00 0.00 41.96 41.37 1ll4 s TYR 342 CO 0.10 -0.68 0.19 -1.54 -2.51 0.00 0.00 175.55 171.11 1ll4 s SER 343 N -2.15 5.99 -0.11 -0.18 1.04 -0.16 -0.78 113.70 117.34 1ll4 s SER 343 Ca -0.01 0.09 -0.06 0.00 0.48 0.00 0.00 55.95 56.44 1ll4 s SER 343 Cb -0.01 -1.73 0.04 0.00 0.10 0.00 0.00 66.02 64.43 1ll4 s SER 343 CO -0.05 0.11 0.26 -0.47 0.98 0.00 0.00 173.24 174.07 1ll4 s TYR 344 N -1.62 -0.34 -0.37 5.02 5.04 -0.60 -0.90 117.35 123.58 1ll4 s TYR 344 Ca 0.33 0.79 -0.10 0.00 -2.44 0.00 0.00 57.07 55.66 1ll4 s TYR 344 Cb -0.12 0.07 0.04 0.00 0.35 0.00 0.00 41.96 42.31 1ll4 s TYR 344 CO 0.26 -0.22 0.19 0.34 -1.34 0.00 0.00 175.55 174.78 1ll4 s ASP 345 N 1.01 5.62 0.27 4.32 3.68 -0.14 -0.41 116.67 131.02 1ll4 s ASP 345 Ca -0.07 -1.12 -0.02 0.00 2.13 0.00 0.00 52.55 53.46 1ll4 s ASP 345 Cb -0.08 -1.98 0.41 0.00 -1.45 0.00 0.00 42.92 39.82 1ll4 s ASP 345 CO -0.07 -0.40 1.89 0.50 0.13 0.00 0.00 175.17 177.22 1ll4 h LYS 346 N 8.38 1.15 0.21 4.34 1.63 -1.88 0.47 116.57 130.87 1ll4 h LYS 346 Ca -0.24 -0.07 -0.01 0.00 -0.85 0.00 0.00 60.65 59.48 1ll4 h LYS 346 Cb 1.09 -0.26 0.00 0.00 -0.60 0.00 0.00 32.23 32.47 1ll4 h LYS 346 CO 0.67 0.76 -0.10 -0.91 -3.45 0.00 0.00 179.45 176.42 1ll4 h ASN 347 N 1.18 -0.23 0.00 4.20 -0.26 -1.94 -3.27 115.58 115.25 1ll4 h ASN 347 Ca 0.42 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 56.17 1ll4 h ASN 347 Cb 0.14 0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.46 1ll4 h ASN 347 CO -0.16 0.01 0.00 0.29 -1.06 0.00 0.00 177.43 176.51 1ll4 n LYS 348 N -3.75 0.51 -3.98 0.81 5.02 -1.20 -4.86 118.16 110.72 1ll4 n LYS 348 Ca -0.03 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.95 1ll4 n LYS 348 Cb 0.11 -1.44 0.01 0.00 -0.02 0.00 0.00 35.03 33.69 1ll4 n LYS 348 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1ll4 n ARG 349 N -0.94 -4.67 -4.95 1.97 1.74 0.16 -4.50 116.66 105.47 1ll4 n ARG 349 Ca 0.11 0.53 -0.32 0.00 -0.77 0.00 0.00 57.85 57.39 1ll4 n ARG 349 Cb 0.05 -5.27 -0.17 0.00 -1.02 0.00 0.00 32.46 26.05 1ll4 n ARG 349 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1ll4 s TYR 350 N -3.39 2.62 -0.13 -1.55 5.04 -1.02 -0.24 117.35 118.67 1ll4 s TYR 350 Ca 0.56 -1.19 -0.02 0.00 -2.44 0.00 0.00 57.07 53.99 1ll4 s TYR 350 Cb -0.29 -1.76 -0.02 0.00 0.35 0.00 0.00 41.96 40.24 1ll4 s TYR 350 CO 0.86 -0.51 -0.08 -1.17 -1.34 0.00 0.00 175.55 173.30 1ll4 s LEU 351 N 0.57 2.99 -0.21 6.97 1.98 -0.39 -0.97 118.68 129.62 1ll4 s LEU 351 Ca -0.13 -0.21 0.00 0.00 -2.89 0.00 0.00 54.13 50.90 1ll4 s LEU 351 Cb -0.17 -1.69 0.05 0.00 0.66 0.00 0.00 46.19 45.04 1ll4 s LEU 351 CO 0.04 0.19 -0.05 -0.63 -1.89 0.00 0.00 176.35 174.01 1ll4 s ILE 352 N 0.24 1.33 -0.22 6.68 1.01 -0.08 0.52 121.20 130.68 1ll4 s ILE 352 Ca -0.06 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 59.32 1ll4 s ILE 352 Cb -0.15 -1.58 0.00 0.00 0.01 0.00 0.00 42.46 40.75 1ll4 s ILE 352 CO 0.04 -0.03 1.11 -0.55 0.00 0.00 0.00 174.94 175.52 1ll4 s SER 353 N 1.50 7.04 0.19 3.58 0.15 0.11 -0.99 113.70 125.27 1ll4 s SER 353 Ca -0.03 1.45 -0.23 0.00 0.70 0.00 0.00 55.95 57.85 1ll4 s SER 353 Cb -0.17 -2.54 0.06 0.00 -1.71 0.00 0.00 66.02 61.65 1ll4 s SER 353 CO -0.07 -0.71 0.66 -0.72 1.20 0.00 0.00 173.24 173.59 1ll4 s TYR 354 N 3.33 -0.42 0.09 3.44 -0.85 -1.17 -0.91 117.35 120.86 1ll4 s TYR 354 Ca 0.47 0.14 -0.19 0.00 -0.52 0.00 0.00 57.07 56.98 1ll4 s TYR 354 Cb -0.17 0.60 -0.07 0.00 0.38 0.00 0.00 41.96 42.71 1ll4 s TYR 354 CO 0.09 -0.95 0.57 -0.51 -1.52 0.00 0.00 175.55 173.24 1ll4 s ASP 355 N -2.79 7.03 0.47 -0.18 -0.00 -1.26 -3.90 116.67 116.04 1ll4 s ASP 355 Ca 0.04 1.24 0.08 0.00 -0.00 0.00 0.00 52.55 53.91 1ll4 s ASP 355 Cb -0.02 -2.35 0.03 0.00 -0.00 0.00 0.00 42.92 40.58 1ll4 s ASP 355 CO -0.07 0.24 0.59 0.42 -0.00 0.00 0.00 175.17 176.36 1ll4 s THR 356 N -1.17 2.60 0.34 -1.27 -4.23 -1.26 -4.93 115.64 105.72 1ll4 s THR 356 Ca 0.31 -1.09 0.02 0.00 -1.18 0.00 0.00 61.69 59.75 1ll4 s THR 356 Cb -0.19 -2.69 0.27 0.00 1.34 0.00 0.00 72.50 71.23 1ll4 s THR 356 CO 0.19 0.00 1.99 -0.37 -0.54 0.00 0.00 174.62 175.89 1ll4 h VAL 357 N 0.57 1.15 -0.80 2.29 -1.51 -1.95 0.13 116.25 116.13 1ll4 h VAL 357 Ca -0.37 -0.31 -0.03 0.00 -1.23 0.00 0.00 66.70 64.76 1ll4 h VAL 357 Cb 1.28 0.16 -0.04 0.00 -2.13 0.00 0.00 31.29 30.57 1ll4 h VAL 357 CO 0.47 0.16 0.40 0.50 -1.23 0.00 0.00 177.57 177.87 1ll4 h LYS 358 N 0.90 1.15 -0.13 5.19 3.64 -1.99 0.16 116.57 125.49 1ll4 h LYS 358 Ca 0.27 -0.16 -0.22 0.00 -1.27 0.00 0.00 60.65 59.26 1ll4 h LYS 358 Cb -0.04 -0.21 0.01 0.00 -0.41 0.00 0.00 32.23 31.58 1ll4 h LYS 358 CO -0.07 0.88 -0.79 0.82 -2.27 0.00 0.00 179.45 178.02 1ll4 h ILE 359 N 1.13 1.29 -0.67 2.00 1.08 -1.52 -1.84 117.51 118.98 1ll4 h ILE 359 Ca 0.28 -2.02 0.00 0.00 -0.39 0.00 0.00 64.86 62.73 1ll4 h ILE 359 Cb 0.10 2.03 -0.03 0.00 -3.07 0.00 0.00 36.82 35.84 1ll4 h ILE 359 CO -0.04 0.64 0.43 0.00 -0.69 0.00 0.00 178.15 178.49 1ll4 h ALA 360 N 0.61 1.50 -0.57 1.87 0.00 -0.37 -0.07 119.26 122.21 1ll4 h ALA 360 Ca -0.06 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1ll4 h ALA 360 Cb 1.42 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1ll4 h ALA 360 CO 0.16 0.46 0.20 0.78 0.00 0.00 0.00 179.25 180.85 1ll4 h GLY 361 N 0.93 0.94 1.97 0.00 0.00 -0.63 0.19 103.07 106.46 1ll4 h GLY 361 Ca 0.24 -0.53 -0.07 0.00 0.00 0.00 0.00 47.33 46.97 1ll4 h GLY 361 CO -0.05 0.50 -0.32 0.50 0.00 0.00 0.00 176.54 177.17 1ll4 h LYS 362 N 0.79 0.04 -0.11 4.80 1.79 -0.38 -0.68 116.57 122.83 1ll4 h LYS 362 Ca 0.19 -0.01 -0.08 0.00 -2.18 0.00 0.00 60.65 58.57 1ll4 h LYS 362 Cb 0.24 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 1ll4 h LYS 362 CO -0.01 0.36 -0.24 0.87 -1.08 0.00 0.00 179.45 179.35 1ll4 h LYS 363 N 0.04 0.35 -0.53 3.15 1.57 -0.21 -2.09 116.57 118.84 1ll4 h LYS 363 Ca 0.00 -0.23 0.10 0.00 -1.87 0.00 0.00 60.65 58.65 1ll4 h LYS 363 Cb 0.59 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.85 1ll4 h LYS 363 CO 0.04 0.84 0.09 0.00 -0.57 0.00 0.00 179.45 179.85 1ll4 h ALA 364 N 0.51 0.59 -0.73 3.86 0.00 -0.39 -0.27 119.26 122.82 1ll4 h ALA 364 Ca 0.00 0.12 0.15 0.00 0.00 0.00 0.00 54.91 55.18 1ll4 h ALA 364 Cb 0.83 0.17 -0.10 0.00 0.00 0.00 0.00 17.79 18.69 1ll4 h ALA 364 CO 0.05 -0.32 0.23 0.93 0.00 0.00 0.00 179.25 180.14 1ll4 h GLU 365 N 0.22 0.32 -0.43 0.00 5.08 -1.05 0.10 114.58 118.82 1ll4 h GLU 365 Ca 0.27 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.49 1ll4 h GLU 365 Cb 0.38 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1ll4 h GLU 365 CO -0.37 0.21 -0.19 -0.92 -1.00 0.00 0.00 179.01 176.75 1ll4 h TYR 366 N 0.33 1.03 0.19 4.33 3.20 -0.36 0.30 116.97 125.99 1ll4 h TYR 366 Ca 0.41 -0.25 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 1ll4 h TYR 366 Cb 0.67 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.70 1ll4 h TYR 366 CO -0.22 1.04 -0.12 0.82 -1.64 0.00 0.00 178.16 178.04 1ll4 h ILE 367 N 0.73 0.75 0.81 1.81 2.04 0.00 -0.38 117.51 123.27 1ll4 h ILE 367 Ca 0.10 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.92 1ll4 h ILE 367 Cb 0.76 0.75 0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1ll4 h ILE 367 CO 0.06 0.00 -0.39 0.71 0.00 0.00 0.00 178.15 178.53 1ll4 h THR 368 N -0.30 0.11 -0.93 -0.27 1.35 -1.07 -0.76 112.91 111.04 1ll4 h THR 368 Ca -0.02 -0.14 0.26 0.00 -0.55 0.00 0.00 66.41 65.97 1ll4 h THR 368 Cb 0.25 0.12 -0.14 0.00 -1.73 0.00 0.00 68.15 66.65 1ll4 h THR 368 CO 0.02 0.01 0.38 0.11 -0.25 0.00 0.00 175.52 175.79 1ll4 h LYS 369 N -1.21 0.28 -0.17 4.72 6.56 -0.92 0.11 116.57 125.95 1ll4 h LYS 369 Ca -0.11 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.46 1ll4 h LYS 369 Cb 0.85 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.44 1ll4 h LYS 369 CO 0.18 0.18 0.00 0.09 -2.06 0.00 0.00 179.45 177.85 1ll4 n ASN 370 N -5.13 2.44 -3.55 0.86 3.02 -0.16 -4.95 115.26 107.79 1ll4 n ASN 370 Ca 0.25 -1.81 -0.20 0.00 -0.03 0.00 0.00 54.58 52.79 1ll4 n ASN 370 Cb 0.79 -0.10 0.07 0.00 -0.61 0.00 0.00 39.78 39.93 1ll4 n ASN 370 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ll4 n GLY 371 N 1.30 -0.39 3.93 7.41 0.00 0.39 -4.86 105.19 112.97 1ll4 n GLY 371 Ca 0.17 0.14 -0.26 0.00 0.00 0.00 0.00 46.02 46.07 1ll4 n GLY 371 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ll4 s MET 372 N -5.75 2.39 0.00 1.61 -1.94 -0.39 -2.57 119.30 112.64 1ll4 s MET 372 Ca 0.15 -0.19 0.14 0.00 -1.71 0.00 0.00 55.69 54.09 1ll4 s MET 372 Cb -0.07 -2.19 0.63 0.00 2.01 0.00 0.00 34.83 35.20 1ll4 s MET 372 CO 0.75 -1.10 1.46 0.41 -0.01 0.00 0.00 175.02 176.53 1ll4 n GLY 373 N -2.84 -0.98 0.00 -0.03 0.00 0.38 -4.67 105.19 97.05 1ll4 n GLY 373 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ll4 n GLY 373 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ll4 n GLY 374 N -0.01 0.68 3.42 -0.02 0.00 -1.26 -0.02 105.19 107.98 1ll4 n GLY 374 Ca 0.04 -2.11 -0.30 0.00 0.00 0.00 0.00 46.02 43.65 1ll4 n GLY 374 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ll4 s GLY 375 N 0.00 1.56 0.00 -0.02 0.00 -0.22 -0.71 107.32 107.93 1ll4 s GLY 375 Ca 0.00 -1.33 0.06 0.00 0.00 0.00 0.00 44.72 43.45 1ll4 s GLY 375 CO 0.00 -1.26 -0.18 -0.29 0.00 0.00 0.00 173.10 171.37 1ll4 s MET 376 N -1.73 1.37 -0.04 2.90 0.00 -0.21 -0.84 119.30 120.74 1ll4 s MET 376 Ca 0.15 -0.70 0.03 0.00 0.00 0.00 0.00 55.69 55.17 1ll4 s MET 376 Cb -0.10 -1.36 0.00 0.00 0.00 0.00 0.00 34.83 33.37 1ll4 s MET 376 CO 0.06 0.36 -0.14 -1.58 0.00 0.00 0.00 175.02 173.73 1ll4 s TRP 377 N -0.53 1.45 -0.26 4.11 0.51 0.79 0.34 118.94 125.35 1ll4 s TRP 377 Ca 0.06 -0.44 0.00 0.00 -2.12 0.00 0.00 56.10 53.61 1ll4 s TRP 377 Cb -0.07 -1.01 0.04 0.00 -0.81 0.00 0.00 33.47 31.62 1ll4 s TRP 377 CO -0.00 -0.18 -0.08 -0.46 -0.51 0.00 0.00 176.95 175.72 1ll4 s TRP 378 N 0.25 3.14 0.05 -1.98 -0.11 -1.02 -1.93 118.94 117.33 1ll4 s TRP 378 Ca -0.07 -1.87 -0.05 0.00 1.22 0.00 0.00 56.10 55.33 1ll4 s TRP 378 Cb -0.12 -2.01 -0.02 0.00 -1.50 0.00 0.00 33.47 29.82 1ll4 s TRP 378 CO 0.02 -0.80 0.08 -1.83 -4.62 0.00 0.00 176.95 169.80 1ll4 s GLU 379 N 1.24 0.63 0.62 5.86 4.04 -1.26 -0.80 118.70 129.02 1ll4 s GLU 379 Ca -0.03 -0.91 0.06 0.00 0.04 0.00 0.00 54.97 54.13 1ll4 s GLU 379 Cb -0.18 0.24 0.31 0.00 0.02 0.00 0.00 34.13 34.52 1ll4 s GLU 379 CO -0.05 -0.16 1.14 0.66 -1.84 0.00 0.00 175.26 175.02 1ll4 h SER 380 N 3.40 0.00 0.72 0.83 4.64 -1.38 -2.96 113.55 118.80 1ll4 h SER 380 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1ll4 h SER 380 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1ll4 h SER 380 CO 0.55 0.00 -0.98 -1.54 -0.87 0.00 0.00 176.83 173.99 1ll4 n SER 381 N -2.48 0.68 -0.51 4.97 3.41 -1.26 -4.20 113.62 114.23 1ll4 n SER 381 Ca -0.00 0.08 0.14 0.00 -0.26 0.00 0.00 58.87 58.83 1ll4 n SER 381 Cb 0.84 0.59 0.50 0.00 -0.26 0.00 0.00 64.21 65.88 1ll4 n SER 381 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ll4 n SER 382 N -2.28 1.58 -4.86 4.04 3.41 -1.12 -4.89 113.62 109.50 1ll4 n SER 382 Ca 0.01 -1.54 -0.31 0.00 -0.26 0.00 0.00 58.87 56.77 1ll4 n SER 382 Cb 0.49 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.39 1ll4 n SER 382 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ll4 s ASP 383 N -1.97 6.62 0.83 4.04 2.15 -1.26 -0.77 116.67 126.32 1ll4 s ASP 383 Ca 0.37 1.20 -0.10 0.00 0.43 0.00 0.00 52.55 54.46 1ll4 s ASP 383 Cb 0.21 -2.35 0.14 0.00 -0.30 0.00 0.00 42.92 40.62 1ll4 s ASP 383 CO 0.33 -0.33 1.16 -0.54 -0.17 0.00 0.00 175.17 175.62 1ll4 s LYS 384 N -3.51 1.34 0.52 4.34 1.02 -1.26 -4.71 119.74 117.48 1ll4 s LYS 384 Ca 0.53 -0.54 0.02 0.00 0.02 0.00 0.00 55.97 56.00 1ll4 s LYS 384 Cb -0.10 -2.05 0.02 0.00 -0.52 0.00 0.00 37.83 35.18 1ll4 s LYS 384 CO 0.26 -1.85 0.20 0.25 -0.92 0.00 0.00 175.35 173.29 1ll4 n THR 385 N -3.30 0.00 -4.94 2.17 -2.24 -1.26 -4.03 114.28 100.67 1ll4 n THR 385 Ca 0.13 -2.27 0.00 0.00 -2.27 0.00 0.00 64.05 59.64 1ll4 n THR 385 Cb 0.60 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1ll4 n THR 385 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ll4 n GLY 386 N -1.28 2.51 0.25 3.38 0.00 -1.26 -1.88 105.19 106.92 1ll4 n GLY 386 Ca -0.12 -0.44 0.17 0.00 0.00 0.00 0.00 46.02 45.64 1ll4 n GLY 386 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ll4 h ASN 387 N 9.76 0.00 -0.46 1.61 4.21 -2.03 -1.35 115.58 127.32 1ll4 h ASN 387 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1ll4 h ASN 387 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 1ll4 h ASN 387 CO 0.00 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 175.52 1ll4 n GLU 388 N -2.78 2.29 -2.20 0.81 1.02 -0.79 -4.90 120.64 114.09 1ll4 n GLU 388 Ca -0.01 -1.98 -0.43 0.00 -0.02 0.00 0.00 57.16 54.72 1ll4 n GLU 388 Cb 0.16 -1.46 -0.02 0.00 -0.02 0.00 0.00 31.44 30.10 1ll4 n GLU 388 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ll4 s SER 389 N -1.22 6.77 0.27 1.62 0.15 -0.51 -4.46 113.70 116.32 1ll4 s SER 389 Ca 0.38 1.95 -0.04 0.00 0.70 0.00 0.00 55.95 58.94 1ll4 s SER 389 Cb 0.20 -2.54 0.36 0.00 -1.71 0.00 0.00 66.02 62.34 1ll4 s SER 389 CO 0.28 -0.87 1.93 -0.07 1.20 0.00 0.00 173.24 175.70 1ll4 h LEU 390 N 10.10 1.06 -0.16 3.45 3.38 -1.91 -0.41 115.31 130.82 1ll4 h LEU 390 Ca -0.33 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 1ll4 h LEU 390 Cb 1.14 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 1ll4 h LEU 390 CO 0.96 0.75 -0.04 0.58 0.09 0.00 0.00 178.44 180.79 1ll4 h VAL 391 N 1.24 1.28 -0.50 1.22 2.07 -1.90 -1.38 116.25 118.28 1ll4 h VAL 391 Ca 0.37 -0.98 0.10 0.00 0.82 0.00 0.00 66.70 67.00 1ll4 h VAL 391 Cb -0.06 1.60 -0.10 0.00 -1.52 0.00 0.00 31.29 31.21 1ll4 h VAL 391 CO -0.10 0.29 -0.23 1.23 0.02 0.00 0.00 177.57 178.79 1ll4 h GLY 392 N 0.02 0.12 0.30 2.17 0.00 -1.81 0.49 103.07 104.36 1ll4 h GLY 392 Ca 0.04 0.29 0.10 0.00 0.00 0.00 0.00 47.33 47.77 1ll4 h GLY 392 CO 0.02 -0.22 0.19 -0.84 0.00 0.00 0.00 176.54 175.69 1ll4 h THR 393 N -0.11 0.72 -0.21 4.70 2.02 -0.85 -1.57 112.91 117.61 1ll4 h THR 393 Ca 0.23 -0.12 -0.16 0.00 0.77 0.00 0.00 66.41 67.13 1ll4 h THR 393 Cb 0.48 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1ll4 h THR 393 CO -0.57 0.06 -0.54 0.58 0.37 0.00 0.00 175.52 175.42 1ll4 h VAL 394 N 0.35 1.31 -0.30 3.16 2.07 0.10 -1.97 116.25 120.98 1ll4 h VAL 394 Ca 0.31 -1.78 -0.05 0.00 0.82 0.00 0.00 66.70 66.00 1ll4 h VAL 394 Cb 0.42 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1ll4 h VAL 394 CO -0.35 0.56 -0.02 0.58 0.02 0.00 0.00 177.57 178.36 1ll4 h VAL 395 N 0.47 1.27 -0.59 2.57 2.07 -0.31 -0.72 116.25 121.01 1ll4 h VAL 395 Ca 0.01 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.57 1ll4 h VAL 395 Cb 1.09 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 1ll4 h VAL 395 CO 0.11 0.32 0.35 0.78 0.02 0.00 0.00 177.57 179.14 1ll4 h ASN 396 N 0.32 0.55 0.71 0.57 4.21 -1.31 0.17 115.58 120.80 1ll4 h ASN 396 Ca 0.08 0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.60 1ll4 h ASN 396 Cb 0.47 -0.10 0.00 0.00 -1.12 0.00 0.00 38.32 37.57 1ll4 h ASN 396 CO 0.02 0.38 0.00 0.61 -1.29 0.00 0.00 177.43 177.15 1ll4 n GLY 397 N -1.26 -1.27 0.00 2.83 0.00 -0.74 -0.86 105.19 103.89 1ll4 n GLY 397 Ca 0.06 0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.30 1ll4 n GLY 397 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ll4 n LEU 398 N -2.26 0.15 0.00 0.99 4.32 -0.25 -4.69 117.00 115.26 1ll4 n LEU 398 Ca 0.02 0.34 0.00 0.00 -0.02 0.00 0.00 56.01 56.35 1ll4 n LEU 398 Cb 0.22 -0.42 0.00 0.00 -1.62 0.00 0.00 43.42 41.61 1ll4 n LEU 398 CO 0.20 0.04 0.00 0.61 -1.22 0.00 0.00 177.39 177.01 1ll4 n GLY 399 N 1.49 1.30 1.42 -0.72 0.00 -0.04 -4.72 105.19 103.92 1ll4 n GLY 399 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1ll4 n GLY 399 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ll4 n GLY 400 N -1.18 -2.37 0.26 -0.02 0.00 0.44 -4.23 105.19 98.09 1ll4 n GLY 400 Ca 0.00 -1.57 0.10 0.00 0.00 0.00 0.00 46.02 44.55 1ll4 n GLY 400 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1ll4 h THR 401 N 0.00 0.80 -0.02 2.61 1.35 -1.93 -1.04 112.91 114.69 1ll4 h THR 401 Ca 0.00 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 1ll4 h THR 401 Cb 0.00 1.24 -0.00 0.00 -1.73 0.00 0.00 68.15 67.66 1ll4 h THR 401 CO 0.00 0.11 0.05 1.23 -0.25 0.00 0.00 175.52 176.66 1ll4 h GLY 402 N 0.48 0.00 -1.94 5.82 0.00 -1.96 0.14 103.07 105.61 1ll4 h GLY 402 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ll4 h GLY 402 CO 0.01 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.83 1ll4 n LYS 403 N -3.30 2.33 -2.87 4.80 4.01 -0.39 -4.94 118.16 117.79 1ll4 n LYS 403 Ca -0.02 -1.99 -0.33 0.00 -0.51 0.00 0.00 58.31 55.46 1ll4 n LYS 403 Cb 0.13 -1.49 -0.07 0.00 -0.51 0.00 0.00 35.03 33.10 1ll4 n LYS 403 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1ll4 s LEU 404 N -1.62 3.95 0.12 -0.35 1.43 0.48 -0.61 118.68 122.08 1ll4 s LEU 404 Ca 0.36 1.61 -0.31 0.00 -1.03 0.00 0.00 54.13 54.76 1ll4 s LEU 404 Cb 0.21 -4.45 -0.10 0.00 0.03 0.00 0.00 46.19 41.88 1ll4 s LEU 404 CO 0.31 -0.34 1.87 -0.70 0.23 0.00 0.00 176.35 177.72 1ll4 s GLU 405 N -3.17 4.13 -0.53 1.70 -6.30 0.16 -4.49 118.70 110.21 1ll4 s GLU 405 Ca 0.60 2.62 -0.18 0.00 -2.50 0.00 0.00 54.97 55.52 1ll4 s GLU 405 Cb -0.09 -3.68 0.08 0.00 0.00 0.00 0.00 34.13 30.44 1ll4 s GLU 405 CO 0.14 -0.87 0.58 -0.65 0.02 0.00 0.00 175.26 174.48 1ll4 s GLN 406 N 3.01 3.05 -0.13 4.30 -1.52 -1.26 -4.93 119.66 122.18 1ll4 s GLN 406 Ca 0.83 -1.23 -0.03 0.00 -1.95 0.00 0.00 55.36 52.98 1ll4 s GLN 406 Cb -0.46 -4.18 0.04 0.00 -0.22 0.00 0.00 33.01 28.19 1ll4 s GLN 406 CO 0.37 -1.29 0.04 0.50 -0.25 0.00 0.00 175.29 174.67 1ll4 s ARG 407 N 2.29 0.41 0.25 2.91 3.52 -1.26 -5.04 118.95 122.04 1ll4 s ARG 407 Ca 0.10 -0.06 -0.30 0.00 -0.13 0.00 0.00 55.73 55.34 1ll4 s ARG 407 Cb -0.23 -1.45 -0.09 0.00 -1.56 0.00 0.00 34.95 31.62 1ll4 s ARG 407 CO 0.08 -0.49 1.02 -2.00 -0.81 0.00 0.00 175.30 173.10 1ll4 s GLU 408 N 2.00 4.75 1.07 5.12 2.12 -1.26 -4.56 118.70 127.93 1ll4 s GLU 408 Ca 0.03 1.64 -0.18 0.00 0.36 0.00 0.00 54.97 56.82 1ll4 s GLU 408 Cb -0.15 -3.24 0.25 0.00 0.26 0.00 0.00 34.13 31.25 1ll4 s GLU 408 CO -0.07 0.36 1.27 0.54 -0.54 0.00 0.00 175.26 176.83 1ll4 s ASN 409 N -0.99 2.13 -0.23 -1.70 2.20 -0.42 -5.02 114.94 110.91 1ll4 s ASN 409 Ca 0.43 0.28 -0.05 0.00 -0.94 0.00 0.00 52.86 52.58 1ll4 s ASN 409 Cb -0.29 -0.31 -0.02 0.00 -2.00 0.00 0.00 41.25 38.64 1ll4 s ASN 409 CO 0.36 -3.35 0.00 -0.70 -2.94 0.00 0.00 177.10 170.48 1ll4 s GLU 410 N -5.80 3.49 -0.00 3.55 2.56 -1.26 -4.94 118.70 116.30 1ll4 s GLU 410 Ca 0.75 -0.56 0.19 0.00 0.00 0.00 0.00 54.97 55.35 1ll4 s GLU 410 Cb -0.04 -3.13 -0.23 0.00 2.00 0.00 0.00 34.13 32.73 1ll4 s GLU 410 CO 0.54 -0.18 0.76 1.28 -0.56 0.00 0.00 175.26 177.10 1ll4 n LEU 411 N 4.80 0.76 -4.52 2.70 4.77 -1.26 -4.90 117.00 119.34 1ll4 n LEU 411 Ca -0.17 -0.41 -0.41 0.00 -0.03 0.00 0.00 56.01 54.99 1ll4 n LEU 411 Cb 0.51 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 1ll4 n LEU 411 CO 0.30 0.19 -0.08 -0.55 -1.33 0.00 0.00 177.39 175.92 1ll4 s SER 412 N -3.10 6.09 -0.69 -1.43 0.15 -1.26 -4.76 113.70 108.70 1ll4 s SER 412 Ca 0.05 -0.46 0.05 0.00 0.70 0.00 0.00 55.95 56.28 1ll4 s SER 412 Cb 0.14 -2.15 0.17 0.00 -1.71 0.00 0.00 66.02 62.47 1ll4 s SER 412 CO 0.81 -0.30 0.49 -0.31 1.20 0.00 0.00 173.24 175.13 1ll4 s TYR 413 N 1.78 3.42 0.41 3.44 1.51 -1.26 -4.96 117.35 121.68 1ll4 s TYR 413 Ca 0.07 -3.28 0.11 0.00 -1.01 0.00 0.00 57.07 52.97 1ll4 s TYR 413 Cb -0.17 -2.59 0.85 0.00 -0.11 0.00 0.00 41.96 39.94 1ll4 s TYR 413 CO 0.11 -0.56 1.94 -1.35 -1.11 0.00 0.00 175.55 174.57 1ll4 h PRO 414 N 5.40 0.15 -0.54 -1.71 0.11 -1.89 -2.44 132.00 131.09 1ll4 h PRO 414 Ca 0.15 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1ll4 h PRO 414 Cb 0.76 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1ll4 h PRO 414 CO 0.70 0.31 0.00 0.39 -0.21 0.00 0.00 178.00 179.19 1ll4 n GLU 415 N -4.29 2.30 -2.07 1.05 1.02 -1.26 -4.95 120.64 112.44 1ll4 n GLU 415 Ca -0.01 -1.91 -0.41 0.00 -0.02 0.00 0.00 57.16 54.81 1ll4 n GLU 415 Cb 0.26 -1.44 -0.02 0.00 -0.02 0.00 0.00 31.44 30.22 1ll4 n GLU 415 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ll4 s SER 416 N -0.97 6.71 0.00 1.62 0.15 -0.92 -4.85 113.70 115.44 1ll4 s SER 416 Ca 0.35 2.73 0.30 0.00 0.70 0.00 0.00 55.95 60.03 1ll4 s SER 416 Cb 0.19 -2.65 1.67 0.00 -1.71 0.00 0.00 66.02 63.51 1ll4 s SER 416 CO 0.23 -0.58 2.09 0.55 1.20 0.00 0.00 173.24 176.73 1ll4 n VAL 417 N 0.84 0.02 -4.86 4.45 3.14 -1.26 -4.73 118.33 115.94 1ll4 n VAL 417 Ca 0.00 0.01 -0.33 0.00 -2.96 0.00 0.00 64.34 61.06 1ll4 n VAL 417 Cb 0.41 -0.52 -0.14 0.00 -1.06 0.00 0.00 33.84 32.53 1ll4 n VAL 417 CO 0.00 0.00 0.00 -0.31 -6.46 0.00 0.00 176.83 170.06 1ll4 s TYR 418 N -2.27 2.75 -0.10 1.45 1.51 -1.26 -4.83 117.35 114.60 1ll4 s TYR 418 Ca 0.37 -0.54 -0.27 0.00 -1.01 0.00 0.00 57.07 55.62 1ll4 s TYR 418 Cb 0.20 -1.77 -0.25 0.00 -0.11 0.00 0.00 41.96 40.03 1ll4 s TYR 418 CO 0.40 -0.12 0.90 -0.44 -1.11 0.00 0.00 175.55 175.18 1ll4 h ASP 419 N 6.32 0.09 -0.82 2.29 3.45 -0.89 -0.14 116.42 126.72 1ll4 h ASP 419 Ca -0.31 -0.88 0.10 0.00 0.43 0.00 0.00 57.03 56.37 1ll4 h ASP 419 Cb 1.20 -0.03 -0.08 0.00 -0.56 0.00 0.00 39.33 39.86 1ll4 h ASP 419 CO 0.53 0.97 0.46 -0.55 -1.57 0.00 0.00 179.24 179.08 1ll4 h ASN 420 N -0.77 0.64 -0.22 6.45 -1.07 -1.91 0.12 115.58 118.81 1ll4 h ASN 420 Ca -0.02 0.05 -0.11 0.00 0.07 0.00 0.00 56.30 56.29 1ll4 h ASN 420 Cb 1.00 -0.06 -0.00 0.00 -2.07 0.00 0.00 38.32 37.18 1ll4 h ASN 420 CO 0.02 0.35 -0.29 0.25 0.07 0.00 0.00 177.43 177.83 1ll4 h LEU 421 N 0.75 0.64 -1.83 6.14 6.46 -1.89 0.22 115.31 125.81 1ll4 h LEU 421 Ca 0.40 -0.51 0.08 0.00 -0.12 0.00 0.00 57.88 57.74 1ll4 h LEU 421 Cb 0.40 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.13 1ll4 h LEU 421 CO -0.26 1.02 0.29 0.50 -0.62 0.00 0.00 178.44 179.37 1ll4 h LYS 422 N 0.28 0.20 -0.66 1.25 1.63 -0.30 0.92 116.57 119.88 1ll4 h LYS 422 Ca 0.03 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.76 1ll4 h LYS 422 Cb 0.87 -0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 32.42 1ll4 h LYS 422 CO 0.07 0.13 0.07 0.09 -3.45 0.00 0.00 179.45 176.36 1ll4 n ASN 423 N -4.46 5.15 -2.18 4.20 5.03 0.35 -4.68 115.26 118.66 1ll4 n ASN 423 Ca 0.06 -2.92 -0.19 0.00 0.87 0.00 0.00 54.58 52.41 1ll4 n ASN 423 Cb 0.35 -0.69 -0.00 0.00 -1.02 0.00 0.00 39.78 38.42 1ll4 n ASN 423 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ll4 n GLY 424 N 0.39 -0.39 3.40 7.41 0.00 0.32 -4.12 105.19 112.19 1ll4 n GLY 424 Ca 0.29 -0.09 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 1ll4 n GLY 424 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ll4 n MET 425 N -2.89 -1.50 0.00 1.61 0.00 0.75 -5.02 117.12 110.08 1ll4 n MET 425 Ca -0.21 1.28 0.00 0.00 0.00 0.00 0.00 57.70 58.77 1ll4 n MET 425 Cb 0.66 -1.87 0.00 0.00 0.00 0.00 0.00 33.22 32.01 1ll4 n MET 425 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1ll4 n PRO 426 N 0.24 1.20 0.00 0.03 -0.02 -1.26 -5.09 135.00 130.10 1ll4 n PRO 426 Ca -0.06 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.50 1ll4 n PRO 426 Cb 0.62 0.00 0.06 0.00 -0.02 0.00 0.00 33.50 34.16 1ll4 n PRO 426 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91