#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3l1u s VAL 25 N 0.00 3.89 0.56 -3.33 -7.23 -0.44 -4.68 120.40 109.17 3l1u s VAL 25 Ca 0.00 -0.40 -0.17 0.00 -1.81 0.00 0.00 61.98 59.59 3l1u s VAL 25 Cb 0.00 -2.61 -0.05 0.00 0.56 0.00 0.00 36.38 34.28 3l1u s VAL 25 CO 0.00 0.59 1.06 -2.16 -0.31 0.00 0.00 175.10 174.28 3l1u s PRO 26 N -0.74 3.43 0.08 4.82 0.04 -1.26 -0.68 135.00 140.68 3l1u s PRO 26 Ca 0.11 1.28 0.01 0.00 0.04 0.00 0.00 61.00 62.45 3l1u s PRO 26 Cb -0.11 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 3l1u s PRO 26 CO 0.02 -0.73 -0.06 0.00 0.04 0.00 0.00 177.00 176.27 3l1u s ALA 27 N -2.27 0.78 -0.38 8.56 0.00 -1.26 -2.01 121.76 125.18 3l1u s ALA 27 Ca 0.65 -1.21 -0.10 0.00 0.00 0.00 0.00 51.96 51.30 3l1u s ALA 27 Cb -0.17 0.17 0.04 0.00 0.00 0.00 0.00 23.12 23.17 3l1u s ALA 27 CO 0.32 -0.24 0.20 0.42 0.00 0.00 0.00 175.76 176.46 3l1u s ILE 28 N -3.32 4.33 0.12 0.00 -1.09 0.54 -1.64 121.20 120.13 3l1u s ILE 28 Ca 0.07 -1.06 -0.30 0.00 -2.23 0.00 0.00 60.65 57.13 3l1u s ILE 28 Cb 0.03 -3.49 -0.06 0.00 -1.58 0.00 0.00 42.46 37.37 3l1u s ILE 28 CO -0.05 -0.30 0.97 -0.36 -1.23 0.00 0.00 174.94 173.97 3l1u s PHE 29 N 1.49 3.80 -0.10 3.97 0.08 0.37 -1.88 117.98 125.71 3l1u s PHE 29 Ca 0.01 1.79 0.00 0.00 0.12 0.00 0.00 56.93 58.86 3l1u s PHE 29 Cb -0.20 -3.07 0.02 0.00 -0.57 0.00 0.00 43.02 39.20 3l1u s PHE 29 CO 0.05 0.16 -0.10 -0.51 -0.10 0.00 0.00 175.22 174.72 3l1u s LEU 30 N -0.04 1.37 0.76 -0.37 1.43 0.84 -1.22 118.68 121.45 3l1u s LEU 30 Ca 0.47 -0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 53.12 3l1u s LEU 30 Cb -0.24 -0.87 0.05 0.00 0.03 0.00 0.00 46.19 45.17 3l1u s LEU 30 CO 0.30 -0.07 1.13 -0.62 0.23 0.00 0.00 176.35 177.33 3l1u s ASP 31 N 1.37 4.29 0.00 2.29 2.15 -0.38 -0.82 116.67 125.57 3l1u s ASP 31 Ca -0.01 2.07 0.00 0.00 0.43 0.00 0.00 52.55 55.04 3l1u s ASP 31 Cb -0.14 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.93 3l1u s ASP 31 CO -0.05 -2.19 0.00 -1.14 -0.17 0.00 0.00 175.17 171.62 3l1u n ARG 32 N -3.17 0.00 -1.70 4.34 0.63 -1.26 -3.98 116.66 111.52 3l1u n ARG 32 Ca 0.11 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.61 3l1u n ARG 32 Cb 0.52 -0.03 -0.03 0.00 0.45 0.00 0.00 32.46 33.37 3l1u n ARG 32 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3l1u n ASP 33 N -1.49 3.77 0.00 6.15 8.00 -1.26 0.07 116.55 131.79 3l1u n ASP 33 Ca 0.00 1.05 0.00 0.00 0.71 0.00 0.00 54.79 56.55 3l1u n ASP 33 Cb 0.00 -1.53 0.00 0.00 -0.02 0.00 0.00 41.12 39.57 3l1u n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3l1u n GLY 34 N 3.88 1.27 1.14 0.44 0.00 0.12 -4.76 105.19 107.27 3l1u n GLY 34 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3l1u n GLY 34 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3l1u n THR 35 N -2.00 0.00 -0.13 2.61 -1.04 -0.46 -2.87 114.28 110.38 3l1u n THR 35 Ca 0.00 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.75 3l1u n THR 35 Cb 0.00 -0.84 -0.10 0.00 -1.82 0.00 0.00 70.33 67.57 3l1u n THR 35 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3l1u n ILE 36 N -2.59 1.46 -4.33 12.58 5.41 0.11 -4.61 119.36 127.39 3l1u n ILE 36 Ca 0.00 -0.42 -0.25 0.00 1.00 0.00 0.00 62.75 63.08 3l1u n ILE 36 Cb 0.26 -1.74 -0.09 0.00 -0.71 0.00 0.00 39.64 37.36 3l1u n ILE 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 3l1u s ASN 37 N -7.16 4.16 0.14 4.38 4.22 -1.04 -1.26 114.94 118.37 3l1u s ASN 37 Ca -0.37 -0.69 -0.31 0.00 -2.14 0.00 0.00 52.86 49.35 3l1u s ASN 37 Cb 0.13 -0.65 -0.09 0.00 1.28 0.00 0.00 41.25 41.92 3l1u s ASN 37 CO 0.50 0.07 1.45 -0.69 -2.04 0.00 0.00 177.10 176.38 3l1u s VAL 38 N -2.01 3.06 -0.79 3.54 1.01 -0.06 0.11 120.40 125.26 3l1u s VAL 38 Ca 0.27 0.77 -0.24 0.00 0.00 0.00 0.00 61.98 62.78 3l1u s VAL 38 Cb -0.07 -3.49 0.06 0.00 0.00 0.00 0.00 36.38 32.87 3l1u s VAL 38 CO 0.16 0.06 1.19 -0.62 0.00 0.00 0.00 175.10 175.90 3l1u s ASP 39 N 1.08 6.29 0.00 3.32 -1.08 -1.26 -4.67 116.67 120.35 3l1u s ASP 39 Ca 0.66 -1.03 0.21 0.00 -0.52 0.00 0.00 52.55 51.87 3l1u s ASP 39 Cb -0.39 -2.50 0.57 0.00 -1.46 0.00 0.00 42.92 39.14 3l1u s ASP 39 CO 0.31 -1.55 1.46 1.41 0.52 0.00 0.00 175.17 177.32 3l1u n HIS 40 N 8.39 0.40 -0.37 -5.34 8.25 -1.26 -4.93 115.22 120.35 3l1u n HIS 40 Ca 0.10 -0.20 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 3l1u n HIS 40 Cb 0.48 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.59 3l1u n HIS 40 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3l1u n GLY 41 N 1.30 -3.60 3.92 -1.41 0.00 -1.26 -4.81 105.19 99.32 3l1u n GLY 41 Ca 0.17 -0.83 -0.25 0.00 0.00 0.00 0.00 46.02 45.11 3l1u n GLY 41 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3l1u n TYR 42 N -0.14 -1.72 -2.42 1.61 4.01 -1.26 -4.89 117.16 112.35 3l1u n TYR 42 Ca 0.00 0.77 -0.43 0.00 -0.16 0.00 0.00 57.90 58.08 3l1u n TYR 42 Cb 0.00 -3.84 -0.02 0.00 -0.31 0.00 0.00 39.34 35.17 3l1u n TYR 42 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3l1u s VAL 43 N -3.86 4.27 0.00 -0.72 1.01 -1.26 -4.82 120.40 115.02 3l1u s VAL 43 Ca 0.05 1.54 0.00 0.00 0.00 0.00 0.00 61.98 63.57 3l1u s VAL 43 Cb -0.03 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.36 3l1u s VAL 43 CO 0.87 -0.13 0.00 0.00 0.00 0.00 0.00 175.10 175.85 3l1u n HIS 44 N 6.51 0.00 -4.40 5.22 1.44 -1.26 -5.07 115.22 117.67 3l1u n HIS 44 Ca 0.14 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.50 3l1u n HIS 44 Cb 0.45 0.01 -0.10 0.00 0.12 0.00 0.00 29.99 30.46 3l1u n HIS 44 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3l1u s GLU 45 N 0.00 3.14 0.24 -1.40 0.41 -1.26 -4.71 118.70 115.12 3l1u s GLU 45 Ca 0.00 -0.45 -0.04 0.00 -0.41 0.00 0.00 54.97 54.07 3l1u s GLU 45 Cb 0.00 -2.81 0.44 0.00 -1.78 0.00 0.00 34.13 29.98 3l1u s GLU 45 CO 0.00 0.58 1.75 0.82 -0.49 0.00 0.00 175.26 177.92 3l1u h ILE 46 N 4.41 0.72 0.00 -1.63 2.04 -1.96 -1.15 117.51 119.94 3l1u h ILE 46 Ca -0.46 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.23 3l1u h ILE 46 Cb 1.19 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3l1u h ILE 46 CO 0.57 0.09 0.00 -0.90 0.00 0.00 0.00 178.15 177.91 3l1u n ASP 47 N -4.95 0.00 -0.39 1.72 5.75 -1.26 -1.66 116.55 115.76 3l1u n ASP 47 Ca 0.14 -0.52 0.05 0.00 -0.01 0.00 0.00 54.79 54.45 3l1u n ASP 47 Cb 0.38 -0.11 0.03 0.00 -1.03 0.00 0.00 41.12 40.40 3l1u n ASP 47 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3l1u n ASN 48 N -1.11 1.76 -4.58 -1.12 3.02 -0.50 -4.94 115.26 107.79 3l1u n ASN 48 Ca 0.16 -1.38 -0.42 0.00 -0.03 0.00 0.00 54.58 52.91 3l1u n ASN 48 Cb 0.13 0.11 -0.06 0.00 -0.61 0.00 0.00 39.78 39.35 3l1u n ASN 48 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3l1u s PHE 49 N -1.03 3.13 -0.24 3.10 5.36 -0.66 -4.90 117.98 122.73 3l1u s PHE 49 Ca 0.12 0.47 0.01 0.00 -0.96 0.00 0.00 56.93 56.57 3l1u s PHE 49 Cb 0.09 -3.29 0.06 0.00 -0.34 0.00 0.00 43.02 39.54 3l1u s PHE 49 CO 0.17 -0.69 -0.05 -2.00 -1.46 0.00 0.00 175.22 171.19 3l1u s GLU 50 N 2.94 1.65 0.17 10.12 2.12 -1.26 -4.99 118.70 129.44 3l1u s GLU 50 Ca 0.28 -1.03 -0.32 0.00 0.36 0.00 0.00 54.97 54.27 3l1u s GLU 50 Cb -0.14 -2.61 -0.11 0.00 0.26 0.00 0.00 34.13 31.53 3l1u s GLU 50 CO 0.16 -0.61 1.67 -0.06 -0.54 0.00 0.00 175.26 175.88 3l1u s PHE 51 N 1.37 2.84 0.43 5.30 0.08 -1.26 -0.88 117.98 125.85 3l1u s PHE 51 Ca -0.06 0.40 -0.26 0.00 0.12 0.00 0.00 56.93 57.14 3l1u s PHE 51 Cb -0.19 -4.05 -0.09 0.00 -0.57 0.00 0.00 43.02 38.12 3l1u s PHE 51 CO -0.06 -4.01 1.41 0.42 -0.10 0.00 0.00 175.22 172.87 3l1u s ILE 52 N 1.47 2.20 0.13 0.64 1.01 -0.39 -4.85 121.20 121.41 3l1u s ILE 52 Ca 0.74 0.18 -0.34 0.00 0.00 0.00 0.00 60.65 61.23 3l1u s ILE 52 Cb -0.46 -3.11 -0.14 0.00 0.01 0.00 0.00 42.46 38.76 3l1u s ILE 52 CO 0.32 0.03 1.57 0.47 0.00 0.00 0.00 174.94 177.33 3l1u n ASP 53 N -0.01 2.96 0.00 3.58 8.00 -1.26 -2.40 116.55 127.42 3l1u n ASP 53 Ca 0.04 1.08 0.00 0.00 0.71 0.00 0.00 54.79 56.62 3l1u n ASP 53 Cb 0.42 -1.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.12 3l1u n ASP 53 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3l1u n GLY 54 N 3.39 2.09 0.23 0.44 0.00 -1.26 -4.71 105.19 105.37 3l1u n GLY 54 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 3l1u n GLY 54 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3l1u h VAL 55 N 0.00 1.30 -0.32 1.61 -1.51 -1.84 -1.58 116.25 113.92 3l1u h VAL 55 Ca 0.00 -1.70 -0.03 0.00 -1.23 0.00 0.00 66.70 63.74 3l1u h VAL 55 Cb 0.00 1.65 -0.01 0.00 -2.13 0.00 0.00 31.29 30.79 3l1u h VAL 55 CO 0.00 0.54 0.10 0.40 -1.23 0.00 0.00 177.57 177.37 3l1u h ILE 56 N 0.51 1.21 -0.66 7.19 2.04 -1.90 0.28 117.51 126.18 3l1u h ILE 56 Ca 0.02 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 3l1u h ILE 56 Cb 1.04 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 3l1u h ILE 56 CO 0.10 0.23 0.30 0.44 0.00 0.00 0.00 178.15 179.22 3l1u h ASP 57 N 0.36 0.87 -0.31 1.72 3.32 -1.95 -1.65 116.42 118.78 3l1u h ASP 57 Ca 0.10 -0.14 0.04 0.00 0.02 0.00 0.00 57.03 57.05 3l1u h ASP 57 Cb 0.26 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 3l1u h ASP 57 CO -0.00 0.77 0.10 0.00 -1.72 0.00 0.00 179.24 178.38 3l1u h ALA 58 N 1.14 0.35 -0.79 3.45 0.00 -0.98 -1.10 119.26 121.32 3l1u h ALA 58 Ca 0.22 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 3l1u h ALA 58 Cb 0.14 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 3l1u h ALA 58 CO -0.03 -0.31 0.32 0.52 0.00 0.00 0.00 179.25 179.76 3l1u h MET 59 N 0.22 1.18 -0.98 0.00 2.86 -0.72 -0.18 114.93 117.31 3l1u h MET 59 Ca 0.14 -0.21 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3l1u h MET 59 Cb 0.13 -0.19 -0.05 0.00 0.06 0.00 0.00 31.60 31.54 3l1u h MET 59 CO -0.16 0.95 0.63 -0.09 1.06 0.00 0.00 176.91 179.30 3l1u h ARG 60 N 1.15 1.30 -0.25 1.72 2.43 -0.84 -1.13 114.38 118.76 3l1u h ARG 60 Ca 0.27 -0.09 -0.14 0.00 -0.81 0.00 0.00 59.98 59.20 3l1u h ARG 60 Cb 0.20 -0.29 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 3l1u h ARG 60 CO -0.02 0.88 -0.44 1.49 -1.51 0.00 0.00 179.97 180.37 3l1u h GLU 61 N 1.33 0.63 -0.41 0.20 4.57 -0.52 -2.12 114.58 118.26 3l1u h GLU 61 Ca 0.36 -0.34 -0.06 0.00 -1.18 0.00 0.00 59.36 58.14 3l1u h GLU 61 Cb -0.12 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 3l1u h GLU 61 CO -0.07 0.94 0.02 -0.07 -1.18 0.00 0.00 179.01 178.65 3l1u h LEU 62 N 0.51 0.62 -0.40 1.64 3.38 -0.44 -0.03 115.31 120.59 3l1u h LEU 62 Ca 0.04 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 3l1u h LEU 62 Cb 0.97 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 3l1u h LEU 62 CO 0.09 0.67 0.02 0.11 0.09 0.00 0.00 178.44 179.41 3l1u h LYS 63 N 0.62 0.69 -0.62 1.13 1.79 -1.05 -1.92 116.57 117.22 3l1u h LYS 63 Ca 0.13 -0.21 -0.00 0.00 -2.18 0.00 0.00 60.65 58.39 3l1u h LYS 63 Cb 0.36 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.91 3l1u h LYS 63 CO 0.01 0.77 0.38 -0.22 -1.08 0.00 0.00 179.45 179.31 3l1u h LYS 64 N 0.52 0.82 0.00 3.15 3.64 -0.77 -0.84 116.57 123.10 3l1u h LYS 64 Ca 0.11 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3l1u h LYS 64 Cb 0.45 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 3l1u h LYS 64 CO 0.02 0.57 0.00 -1.33 -2.27 0.00 0.00 179.45 176.44 3l1u n MET 65 N -4.42 0.58 -0.05 1.90 2.81 -0.08 -4.87 117.12 112.98 3l1u n MET 65 Ca 0.06 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.98 3l1u n MET 65 Cb 0.06 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.07 3l1u n MET 65 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3l1u n GLY 66 N 0.61 0.94 3.81 3.03 0.00 -0.32 -5.07 105.19 108.19 3l1u n GLY 66 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 3l1u n GLY 66 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3l1u s PHE 67 N -2.01 3.71 0.42 1.61 0.08 -0.74 -4.72 117.98 116.33 3l1u s PHE 67 Ca 0.00 1.36 -0.22 0.00 0.12 0.00 0.00 56.93 58.19 3l1u s PHE 67 Cb 0.00 -2.59 -0.10 0.00 -0.57 0.00 0.00 43.02 39.76 3l1u s PHE 67 CO 0.00 0.42 0.99 0.00 -0.10 0.00 0.00 175.22 176.53 3l1u s ALA 68 N -1.38 3.04 -0.14 5.36 0.00 -0.85 -4.32 121.76 123.47 3l1u s ALA 68 Ca 0.39 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.88 3l1u s ALA 68 Cb -0.18 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 3l1u s ALA 68 CO 0.21 -0.03 -0.16 -0.51 0.00 0.00 0.00 175.76 175.27 3l1u s LEU 69 N -2.95 2.49 -0.11 0.00 1.43 -1.26 -0.34 118.68 117.94 3l1u s LEU 69 Ca 0.60 -0.44 -0.02 0.00 -1.03 0.00 0.00 54.13 53.24 3l1u s LEU 69 Cb -0.15 -1.55 0.04 0.00 0.03 0.00 0.00 46.19 44.56 3l1u s LEU 69 CO 0.19 0.12 0.02 -0.69 0.23 0.00 0.00 176.35 176.22 3l1u s VAL 70 N 0.60 0.38 0.03 -1.59 1.01 -0.79 -0.37 120.40 119.67 3l1u s VAL 70 Ca -0.09 -0.06 -0.29 0.00 0.00 0.00 0.00 61.98 61.54 3l1u s VAL 70 Cb -0.16 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 3l1u s VAL 70 CO 0.03 0.11 0.91 -0.69 0.00 0.00 0.00 175.10 175.47 3l1u s VAL 71 N 1.95 4.76 -0.21 2.92 1.01 -0.18 -0.11 120.40 130.53 3l1u s VAL 71 Ca 0.03 1.94 -0.02 0.00 0.00 0.00 0.00 61.98 63.93 3l1u s VAL 71 Cb -0.14 -4.26 0.06 0.00 0.00 0.00 0.00 36.38 32.04 3l1u s VAL 71 CO -0.06 0.25 0.01 0.68 0.00 0.00 0.00 175.10 175.98 3l1u s VAL 72 N 0.53 0.83 -0.04 2.92 -7.23 -0.00 -0.29 120.40 117.11 3l1u s VAL 72 Ca 0.47 -0.80 0.01 0.00 -1.81 0.00 0.00 61.98 59.84 3l1u s VAL 72 Cb -0.21 -1.29 0.02 0.00 0.56 0.00 0.00 36.38 35.46 3l1u s VAL 72 CO 0.27 -0.21 -0.03 0.28 -0.31 0.00 0.00 175.10 175.09 3l1u s THR 73 N 1.71 0.45 0.10 5.32 -1.32 -0.59 -4.20 115.64 117.12 3l1u s THR 73 Ca -0.02 -0.06 -0.30 0.00 -1.21 0.00 0.00 61.69 60.10 3l1u s THR 73 Cb -0.18 -0.51 -0.06 0.00 -1.51 0.00 0.00 72.50 70.25 3l1u s THR 73 CO -0.09 0.21 1.15 0.20 -2.21 0.00 0.00 174.62 173.89 3l1u s ASN 74 N 1.04 7.16 -0.44 8.08 -0.87 -1.26 -1.66 114.94 126.99 3l1u s ASN 74 Ca -0.09 2.03 0.09 0.00 -1.57 0.00 0.00 52.86 53.31 3l1u s ASN 74 Cb -0.14 -2.59 0.29 0.00 -0.02 0.00 0.00 41.25 38.79 3l1u s ASN 74 CO -0.01 -0.37 0.67 0.00 -2.57 0.00 0.00 177.10 174.82 3l1u n GLN 75 N 3.33 1.33 0.04 -0.60 1.13 0.40 -4.89 117.38 118.12 3l1u n GLN 75 Ca 0.06 -3.66 0.09 0.00 -1.94 0.00 0.00 57.00 51.55 3l1u n GLN 75 Cb 0.47 -1.63 0.40 0.00 0.11 0.00 0.00 30.24 29.58 3l1u n GLN 75 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 3l1u n SER 76 N 0.78 0.20 0.25 1.08 3.41 -1.25 -2.37 113.62 115.71 3l1u n SER 76 Ca 0.25 0.54 0.14 0.00 -0.26 0.00 0.00 58.87 59.54 3l1u n SER 76 Cb 0.54 -0.59 0.82 0.00 -0.26 0.00 0.00 64.21 64.72 3l1u n SER 76 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3l1u h GLY 77 N 2.83 0.00 0.74 5.00 0.00 -1.91 0.54 103.07 110.27 3l1u h GLY 77 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3l1u h GLY 77 CO 0.00 0.00 -0.19 -2.22 0.00 0.00 0.00 176.54 174.13 3l1u h ILE 78 N 0.00 0.58 -0.39 2.60 2.04 -1.58 0.12 117.51 120.87 3l1u h ILE 78 Ca 0.04 -0.44 0.07 0.00 1.00 0.00 0.00 64.86 65.53 3l1u h ILE 78 Cb 0.20 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 3l1u h ILE 78 CO -0.00 0.08 0.27 0.00 0.00 0.00 0.00 178.15 178.49 3l1u h ALA 79 N -0.31 2.07 0.00 1.87 0.00 -0.81 -2.30 119.26 119.78 3l1u h ALA 79 Ca -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3l1u h ALA 79 Cb 0.53 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 3l1u h ALA 79 CO 0.09 -0.16 -0.00 -0.09 0.00 0.00 0.00 179.25 179.09 3l1u h ARG 80 N 0.23 0.00 0.00 0.00 9.65 -0.68 -0.05 114.38 123.53 3l1u h ARG 80 Ca 0.18 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 3l1u h ARG 80 Cb 0.41 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.99 3l1u h ARG 80 CO -0.03 0.00 0.00 0.41 2.80 0.00 0.00 179.97 183.15 3l1u n GLY 81 N 1.02 0.75 0.25 2.80 0.00 -0.54 -4.56 105.19 104.91 3l1u n GLY 81 Ca 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.05 3l1u n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3l1u h LYS 82 N 2.83 0.45 -2.67 1.61 1.79 -1.27 -3.46 116.57 115.86 3l1u h LYS 82 Ca 0.00 -0.12 0.03 0.00 -2.18 0.00 0.00 60.65 58.39 3l1u h LYS 82 Cb 0.00 -0.05 -0.14 0.00 -1.58 0.00 0.00 32.23 30.46 3l1u h LYS 82 CO 0.00 0.55 0.33 -0.59 -1.08 0.00 0.00 179.45 178.66 3l1u s PHE 83 N -4.78 -0.46 0.66 -1.35 -0.12 -1.18 -5.03 117.98 105.72 3l1u s PHE 83 Ca -0.07 0.31 -0.05 0.00 -0.05 0.00 0.00 56.93 57.07 3l1u s PHE 83 Cb 0.15 0.55 0.05 0.00 -0.63 0.00 0.00 43.02 43.14 3l1u s PHE 83 CO 0.76 -0.71 0.95 0.95 -0.05 0.00 0.00 175.22 177.12 3l1u s THR 84 N -3.40 2.49 0.31 -4.49 -4.23 -1.26 -3.89 115.64 101.17 3l1u s THR 84 Ca 0.02 -0.33 0.06 0.00 -1.18 0.00 0.00 61.69 60.27 3l1u s THR 84 Cb -0.01 -3.04 0.07 0.00 1.34 0.00 0.00 72.50 70.86 3l1u s THR 84 CO -0.11 -0.04 1.76 -0.08 -0.54 0.00 0.00 174.62 175.61 3l1u h GLU 85 N -0.42 0.29 -0.32 3.99 4.81 -1.98 -1.97 114.58 118.98 3l1u h GLU 85 Ca -0.44 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 3l1u h GLU 85 Cb 1.31 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.66 3l1u h GLU 85 CO 0.59 0.57 0.21 0.00 -0.73 0.00 0.00 179.01 179.65 3l1u h ALA 86 N 1.43 0.40 -0.74 2.92 0.00 -1.99 -0.42 119.26 120.85 3l1u h ALA 86 Ca 0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3l1u h ALA 86 Cb 0.68 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3l1u h ALA 86 CO 0.05 -0.12 0.33 1.96 0.00 0.00 0.00 179.25 181.47 3l1u h GLN 87 N 0.43 1.08 -0.54 0.00 4.20 -1.87 -1.36 115.11 117.05 3l1u h GLN 87 Ca 0.12 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.59 3l1u h GLN 87 Cb -0.04 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.53 3l1u h GLN 87 CO -0.02 0.85 0.03 0.35 -0.67 0.00 0.00 178.83 179.37 3l1u h PHE 88 N 1.07 0.94 -0.37 2.96 3.57 -0.83 -2.03 116.94 122.25 3l1u h PHE 88 Ca 0.25 -0.13 -0.10 0.00 3.53 0.00 0.00 57.97 61.53 3l1u h PHE 88 Cb 0.14 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 3l1u h PHE 88 CO 0.01 0.84 -0.15 0.93 -2.23 0.00 0.00 178.31 177.71 3l1u h GLU 89 N 0.83 0.75 -0.23 1.11 5.08 -0.64 -0.11 114.58 121.36 3l1u h GLU 89 Ca 0.16 -0.32 0.04 0.00 -1.00 0.00 0.00 59.36 58.25 3l1u h GLU 89 Cb 0.44 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 3l1u h GLU 89 CO 0.02 0.93 -0.03 1.15 -1.00 0.00 0.00 179.01 180.07 3l1u h THR 90 N 0.54 0.80 -0.61 1.13 2.02 -1.08 0.19 112.91 115.90 3l1u h THR 90 Ca 0.09 -0.01 -0.08 0.00 0.77 0.00 0.00 66.41 67.18 3l1u h THR 90 Cb 0.69 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 3l1u h THR 90 CO 0.05 0.01 0.08 0.25 0.37 0.00 0.00 175.52 176.27 3l1u h LEU 91 N 0.04 0.98 -0.47 2.58 5.85 -1.30 -2.14 115.31 120.86 3l1u h LEU 91 Ca 0.11 -0.27 -0.12 0.00 0.84 0.00 0.00 57.88 58.44 3l1u h LEU 91 Cb 0.16 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 3l1u h LEU 91 CO -0.21 1.01 -0.17 0.74 -0.34 0.00 0.00 178.44 179.46 3l1u h THR 92 N 0.93 1.27 -0.31 1.05 2.02 -0.57 -0.01 112.91 117.28 3l1u h THR 92 Ca 0.18 -1.32 0.02 0.00 0.77 0.00 0.00 66.41 66.07 3l1u h THR 92 Cb 0.45 1.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.97 3l1u h THR 92 CO 0.02 0.45 0.15 -0.08 0.37 0.00 0.00 175.52 176.42 3l1u h GLU 93 N 0.79 0.30 -0.58 6.66 4.81 -0.57 -0.15 114.58 125.83 3l1u h GLU 93 Ca 0.11 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.34 3l1u h GLU 93 Cb 0.74 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.01 3l1u h GLU 93 CO 0.06 0.20 0.37 2.35 -0.73 0.00 0.00 179.01 181.25 3l1u h TRP 94 N 0.31 0.69 -0.67 0.92 7.01 -1.08 -1.24 115.95 121.89 3l1u h TRP 94 Ca 0.13 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.15 3l1u h TRP 94 Cb 0.06 -0.23 -0.03 0.00 -2.10 0.00 0.00 29.16 26.86 3l1u h TRP 94 CO -0.10 0.41 0.44 1.98 -2.79 0.00 0.00 178.44 178.37 3l1u h MET 95 N 0.73 0.89 -0.30 2.65 4.05 -0.69 -1.17 114.93 121.09 3l1u h MET 95 Ca 0.23 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.59 3l1u h MET 95 Cb -0.02 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 30.57 3l1u h MET 95 CO -0.08 0.59 0.17 0.22 0.23 0.00 0.00 176.91 178.04 3l1u h ASP 96 N 0.91 0.38 -0.37 1.39 3.58 -0.52 -2.00 116.42 119.79 3l1u h ASP 96 Ca 0.25 -0.08 -0.03 0.00 0.42 0.00 0.00 57.03 57.58 3l1u h ASP 96 Cb -0.10 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 40.84 3l1u h ASP 96 CO -0.05 0.35 0.13 -0.50 -2.88 0.00 0.00 179.24 176.29 3l1u h TRP 97 N 0.37 0.59 -0.74 0.28 4.06 -1.04 -0.72 115.95 118.75 3l1u h TRP 97 Ca 0.11 -0.05 0.02 0.00 2.06 0.00 0.00 58.89 61.02 3l1u h TRP 97 Cb 0.06 -0.17 -0.04 0.00 -1.00 0.00 0.00 29.16 28.01 3l1u h TRP 97 CO -0.03 0.55 0.48 0.77 -3.56 0.00 0.00 178.44 176.64 3l1u h SER 98 N 0.45 0.81 -0.00 -3.49 0.02 -1.05 0.24 113.55 110.52 3l1u h SER 98 Ca 0.12 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3l1u h SER 98 Cb 0.23 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 3l1u h SER 98 CO -0.01 0.57 -0.00 -0.07 -1.14 0.00 0.00 176.83 176.18 3l1u h LEU 99 N 0.95 0.01 -1.27 5.07 3.38 -1.29 -2.73 115.31 119.43 3l1u h LEU 99 Ca 0.28 -0.46 0.10 0.00 0.09 0.00 0.00 57.88 57.90 3l1u h LEU 99 Cb -0.05 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 3l1u h LEU 99 CO -0.09 0.46 0.55 0.00 0.09 0.00 0.00 178.44 179.46 3l1u h ALA 100 N 0.55 1.70 0.00 1.53 0.00 -0.10 0.17 119.26 123.11 3l1u h ALA 100 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3l1u h ALA 100 Cb 0.46 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3l1u h ALA 100 CO 0.00 0.12 0.00 0.22 0.00 0.00 0.00 179.25 179.59 3l1u h ASP 101 N 0.81 0.00 -0.50 0.00 3.58 -0.46 -1.11 116.42 118.73 3l1u h ASP 101 Ca 0.39 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.84 3l1u h ASP 101 Cb 0.44 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.49 3l1u h ASP 101 CO -0.16 0.00 0.01 0.54 -2.88 0.00 0.00 179.24 176.74 3l1u n ARG 102 N -2.51 4.40 -3.72 0.28 5.12 0.20 -4.94 116.66 115.50 3l1u n ARG 102 Ca 0.03 -3.09 -0.27 0.00 -1.93 0.00 0.00 57.85 52.59 3l1u n ARG 102 Cb 0.32 -2.17 0.06 0.00 -1.16 0.00 0.00 32.46 29.51 3l1u n ARG 102 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 3l1u n ASP 103 N 0.32 -5.79 -4.08 0.55 8.00 -0.42 -4.93 116.55 110.19 3l1u n ASP 103 Ca 0.27 -0.63 -0.33 0.00 0.71 0.00 0.00 54.79 54.81 3l1u n ASP 103 Cb 1.13 -4.58 -0.15 0.00 -0.02 0.00 0.00 41.12 37.51 3l1u n ASP 103 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3l1u s VAL 104 N -3.31 2.42 -0.49 2.53 1.01 0.35 -4.77 120.40 118.13 3l1u s VAL 104 Ca 0.62 -1.77 -0.10 0.00 0.00 0.00 0.00 61.98 60.73 3l1u s VAL 104 Cb -0.29 -2.51 0.12 0.00 0.00 0.00 0.00 36.38 33.70 3l1u s VAL 104 CO 0.77 -0.21 0.38 -0.62 0.00 0.00 0.00 175.10 175.41 3l1u s ASP 105 N 1.13 5.77 0.25 3.32 2.15 -1.26 -1.57 116.67 126.45 3l1u s ASP 105 Ca -0.03 -1.96 -0.31 0.00 0.43 0.00 0.00 52.55 50.69 3l1u s ASP 105 Cb -0.20 -2.03 -0.11 0.00 -0.30 0.00 0.00 42.92 40.28 3l1u s ASP 105 CO -0.05 -0.70 1.59 -0.76 -0.17 0.00 0.00 175.17 175.08 3l1u s LEU 106 N 1.30 4.36 0.34 -1.34 1.43 -1.26 -4.76 118.68 118.75 3l1u s LEU 106 Ca 0.06 2.84 0.21 0.00 -1.03 0.00 0.00 54.13 56.21 3l1u s LEU 106 Cb -0.26 -3.62 0.19 0.00 0.03 0.00 0.00 46.19 42.53 3l1u s LEU 106 CO -0.01 -0.87 1.41 0.44 0.23 0.00 0.00 176.35 177.55 3l1u h ASP 107 N 5.53 0.00 -4.02 2.29 3.32 -1.09 -3.47 116.42 118.97 3l1u h ASP 107 Ca -0.45 0.00 0.05 0.00 0.02 0.00 0.00 57.03 56.65 3l1u h ASP 107 Cb 1.21 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.53 3l1u h ASP 107 CO 0.84 0.14 0.46 -0.83 -1.72 0.00 0.00 179.24 178.13 3l1u s GLY 108 N -4.33 -0.29 -0.14 2.75 0.00 -1.09 -5.00 107.32 99.22 3l1u s GLY 108 Ca 0.04 2.09 -0.02 0.00 0.00 0.00 0.00 44.72 46.83 3l1u s GLY 108 CO 0.72 1.24 0.02 -0.42 0.00 0.00 0.00 173.10 174.66 3l1u s ILE 109 N -0.74 0.47 0.06 0.90 1.01 -1.26 -1.02 121.20 120.63 3l1u s ILE 109 Ca -0.02 -0.29 0.09 0.00 0.00 0.00 0.00 60.65 60.43 3l1u s ILE 109 Cb -0.02 -0.84 -0.03 0.00 0.01 0.00 0.00 42.46 41.58 3l1u s ILE 109 CO 0.01 -0.01 -0.23 -0.31 0.00 0.00 0.00 174.94 174.40 3l1u s TYR 110 N 1.90 2.42 0.02 3.97 2.02 0.60 -4.98 117.35 123.31 3l1u s TYR 110 Ca 0.02 -0.34 -0.12 0.00 -0.37 0.00 0.00 57.07 56.25 3l1u s TYR 110 Cb -0.15 -1.39 0.01 0.00 -0.40 0.00 0.00 41.96 40.03 3l1u s TYR 110 CO -0.07 0.22 0.26 1.52 -1.57 0.00 0.00 175.55 175.92 3l1u s TYR 111 N -0.91 -0.07 -0.25 2.71 -0.85 -1.26 -1.53 117.35 115.18 3l1u s TYR 111 Ca 0.14 -0.01 0.01 0.00 -0.52 0.00 0.00 57.07 56.69 3l1u s TYR 111 Cb -0.10 0.05 0.04 0.00 0.38 0.00 0.00 41.96 42.33 3l1u s TYR 111 CO 0.04 -0.43 -0.09 0.00 -1.52 0.00 0.00 175.55 173.55 3l1u n PRO 113 N 4.55 1.83 -2.94 0.00 -0.04 -1.26 -0.45 135.00 136.69 3l1u n PRO 113 Ca -0.16 -1.28 -0.26 0.00 -0.04 0.00 0.00 63.50 61.77 3l1u n PRO 113 Cb 0.45 -1.30 -0.01 0.00 -0.04 0.00 0.00 33.50 32.60 3l1u n PRO 113 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3l1u s HIS 114 N -1.56 3.54 -0.28 0.54 3.76 -1.26 -2.15 115.29 117.88 3l1u s HIS 114 Ca 0.26 0.63 -0.19 0.00 -0.15 0.00 0.00 55.06 55.60 3l1u s HIS 114 Cb 0.13 -2.14 0.09 0.00 1.11 0.00 0.00 32.58 31.78 3l1u s HIS 114 CO 0.18 -0.12 0.78 -1.58 -0.85 0.00 0.00 174.74 173.15 3l1u s HIS 115 N -2.57 -0.85 0.52 1.40 2.46 -1.16 -4.50 115.29 110.59 3l1u s HIS 115 Ca 0.44 1.83 0.25 0.00 0.47 0.00 0.00 55.06 58.05 3l1u s HIS 115 Cb -0.10 0.46 1.37 0.00 -0.13 0.00 0.00 32.58 34.19 3l1u s HIS 115 CO 0.41 -0.42 1.98 -1.35 -2.47 0.00 0.00 174.74 172.89 3l1u h PRO 116 N 6.00 0.04 -0.38 2.88 0.11 -1.83 -0.23 132.00 138.58 3l1u h PRO 116 Ca -0.29 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3l1u h PRO 116 Cb 1.20 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3l1u h PRO 116 CO 0.13 0.02 0.00 1.04 -0.21 0.00 0.00 178.00 178.98 3l1u n GLN 117 N -4.38 3.51 -1.56 1.05 6.02 -1.26 -4.25 117.38 116.52 3l1u n GLN 117 Ca 0.11 -2.87 -0.50 0.00 -0.01 0.00 0.00 57.00 53.73 3l1u n GLN 117 Cb 0.63 -1.91 -0.04 0.00 1.02 0.00 0.00 30.24 29.94 3l1u n GLN 117 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3l1u n GLY 118 N 0.01 -0.12 0.18 1.08 0.00 -0.13 -4.86 105.19 101.35 3l1u n GLY 118 Ca 0.23 0.54 0.07 0.00 0.00 0.00 0.00 46.02 46.86 3l1u n GLY 118 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3l1u h SER 119 N 3.14 0.00 -3.63 1.61 0.02 -1.29 -3.43 113.55 109.97 3l1u h SER 119 Ca -0.43 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 59.89 3l1u h SER 119 Cb 1.36 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.75 3l1u h SER 119 CO 0.68 0.28 -0.09 -0.69 -1.14 0.00 0.00 176.83 175.87 3l1u s VAL 120 N -3.15 5.07 0.13 2.27 1.01 -0.60 -4.97 120.40 120.15 3l1u s VAL 120 Ca 0.05 0.50 -0.25 0.00 0.00 0.00 0.00 61.98 62.27 3l1u s VAL 120 Cb 0.07 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 3l1u s VAL 120 CO 0.70 -0.06 1.64 -0.08 0.00 0.00 0.00 175.10 177.29 3l1u h GLU 121 N 8.30 -0.34 -0.98 2.72 4.57 -1.90 -1.22 114.58 125.73 3l1u h GLU 121 Ca -0.29 0.02 0.28 0.00 -1.18 0.00 0.00 59.36 58.20 3l1u h GLU 121 Cb 1.14 0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 29.77 3l1u h GLU 121 CO 0.73 -0.23 0.88 1.49 -1.18 0.00 0.00 179.01 180.70 3l1u h GLU 122 N -0.36 0.00 -0.00 1.92 4.81 -1.97 -1.13 114.58 117.85 3l1u h GLU 122 Ca 0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3l1u h GLU 122 Cb 0.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.84 3l1u h GLU 122 CO -0.25 0.00 -0.00 1.19 -0.73 0.00 0.00 179.01 179.22 3l1u n PHE 123 N -3.76 0.00 -2.48 0.92 3.72 -0.55 -4.95 117.46 110.36 3l1u n PHE 123 Ca 0.21 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.19 3l1u n PHE 123 Cb 1.20 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.72 3l1u n PHE 123 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 3l1u s ARG 124 N -0.25 3.50 0.00 -1.08 3.52 -0.43 -2.98 118.95 121.23 3l1u s ARG 124 Ca 0.03 0.51 0.00 0.00 -0.13 0.00 0.00 55.73 56.14 3l1u s ARG 124 Cb 0.02 -4.03 0.00 0.00 -1.56 0.00 0.00 34.95 29.38 3l1u s ARG 124 CO 0.03 -1.68 0.00 0.00 -0.81 0.00 0.00 175.30 172.84 3l1u n GLN 125 N 8.32 0.00 -1.46 5.12 10.64 -1.00 -4.94 117.38 134.07 3l1u n GLN 125 Ca 0.12 0.00 -0.32 0.00 -1.83 0.00 0.00 57.00 54.97 3l1u n GLN 125 Cb 0.49 0.00 0.07 0.00 -0.86 0.00 0.00 30.24 29.94 3l1u n GLN 125 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 3l1u s VAL 126 N -2.00 3.37 0.33 -0.39 1.01 -1.26 -2.85 120.40 118.61 3l1u s VAL 126 Ca 0.00 0.51 -0.13 0.00 0.00 0.00 0.00 61.98 62.35 3l1u s VAL 126 Cb 0.00 -3.02 0.03 0.00 0.00 0.00 0.00 36.38 33.38 3l1u s VAL 126 CO 0.00 -0.52 0.65 0.00 0.00 0.00 0.00 175.10 175.23 3l1u n ASP 128 N -1.02 0.57 -0.07 0.00 8.00 -1.26 -4.48 116.55 118.28 3l1u n ASP 128 Ca -0.04 -0.25 0.06 0.00 0.71 0.00 0.00 54.79 55.27 3l1u n ASP 128 Cb 0.60 0.34 -0.06 0.00 -0.02 0.00 0.00 41.12 41.98 3l1u n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3l1u s ARG 130 N -2.16 3.99 0.36 0.00 3.52 -1.26 -4.38 118.95 119.03 3l1u s ARG 130 Ca 0.07 1.12 -0.27 0.00 -0.13 0.00 0.00 55.73 56.52 3l1u s ARG 130 Cb 0.10 -3.80 -0.12 0.00 -1.56 0.00 0.00 34.95 29.58 3l1u s ARG 130 CO 0.51 -1.01 1.15 1.63 -0.81 0.00 0.00 175.30 176.77 3l1u n LYS 131 N 7.09 1.72 -0.01 5.12 5.02 -1.26 -0.55 118.16 135.29 3l1u n LYS 131 Ca 0.13 0.61 0.03 0.00 -2.02 0.00 0.00 58.31 57.06 3l1u n LYS 131 Cb 0.47 -2.16 0.15 0.00 -0.02 0.00 0.00 35.03 33.47 3l1u n LYS 131 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3l1u n PRO 132 N 0.40 1.04 -1.85 1.97 -0.04 -1.26 -4.96 135.00 130.31 3l1u n PRO 132 Ca 0.07 -0.06 -0.41 0.00 -0.04 0.00 0.00 63.50 63.06 3l1u n PRO 132 Cb 0.37 -1.09 -0.00 0.00 -0.04 0.00 0.00 33.50 32.73 3l1u n PRO 132 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3l1u s HIS 133 N -1.98 2.66 -2.07 0.54 3.76 0.28 -3.25 115.29 115.24 3l1u s HIS 133 Ca 0.08 1.19 0.13 0.00 -0.15 0.00 0.00 55.06 56.31 3l1u s HIS 133 Cb 0.04 -3.98 0.42 0.00 1.11 0.00 0.00 32.58 30.17 3l1u s HIS 133 CO 0.06 -2.85 1.32 -0.35 -0.85 0.00 0.00 174.74 172.08 3l1u n PRO 134 N 0.58 1.71 -0.25 8.40 -0.04 -1.26 -4.58 135.00 139.56 3l1u n PRO 134 Ca 0.01 -1.10 0.01 0.00 -0.04 0.00 0.00 63.50 62.38 3l1u n PRO 134 Cb 0.40 -1.28 0.08 0.00 -0.04 0.00 0.00 33.50 32.65 3l1u n PRO 134 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3l1u h GLY 135 N 5.24 0.48 0.97 0.55 0.00 -1.72 -0.38 103.07 108.20 3l1u h GLY 135 Ca 0.00 0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.60 3l1u h GLY 135 CO 0.00 -0.27 0.42 -0.33 0.00 0.00 0.00 176.54 176.36 3l1u h MET 136 N -0.01 0.82 -0.41 4.80 2.86 -1.79 -0.98 114.93 120.22 3l1u h MET 136 Ca 0.34 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.85 3l1u h MET 136 Cb 0.53 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 3l1u h MET 136 CO -0.75 0.55 -0.06 -0.07 1.06 0.00 0.00 176.91 177.64 3l1u h LEU 137 N 0.85 0.67 -0.66 1.22 4.07 -1.45 -1.79 115.31 118.22 3l1u h LEU 137 Ca 0.24 -0.17 -0.13 0.00 0.08 0.00 0.00 57.88 57.90 3l1u h LEU 137 Cb -0.07 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 41.48 3l1u h LEU 137 CO -0.06 0.78 -0.36 -0.07 -1.08 0.00 0.00 178.44 177.65 3l1u h LEU 138 N 0.64 0.67 -0.34 1.67 3.38 -0.81 -0.61 115.31 119.90 3l1u h LEU 138 Ca 0.12 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 3l1u h LEU 138 Cb 0.49 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3l1u h LEU 138 CO 0.03 0.97 0.01 0.28 0.09 0.00 0.00 178.44 179.82 3l1u h SER 139 N 0.53 0.59 -0.59 -0.43 0.02 -0.86 -1.65 113.55 111.16 3l1u h SER 139 Ca 0.05 -0.30 -0.03 0.00 -0.84 0.00 0.00 61.79 60.67 3l1u h SER 139 Cb 0.87 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 3l1u h SER 139 CO 0.08 0.74 0.24 0.00 -1.14 0.00 0.00 176.83 176.74 3l1u h ALA 140 N 0.87 0.77 -0.31 3.77 0.00 -1.26 -1.41 119.26 121.68 3l1u h ALA 140 Ca 0.10 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.89 3l1u h ALA 140 Cb 0.43 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3l1u h ALA 140 CO 0.02 0.39 0.04 -0.09 0.00 0.00 0.00 179.25 179.60 3l1u h ARG 141 N 0.82 0.14 -0.24 0.00 2.43 -0.88 -0.50 114.38 116.15 3l1u h ARG 141 Ca 0.20 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.26 3l1u h ARG 141 Cb 0.20 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 3l1u h ARG 141 CO -0.02 0.09 -0.27 -0.44 -1.51 0.00 0.00 179.97 177.83 3l1u h ASP 142 N 0.15 0.48 -0.00 -3.80 3.32 -1.12 -1.36 116.42 114.08 3l1u h ASP 142 Ca 0.15 -0.17 -0.10 0.00 0.02 0.00 0.00 57.03 56.93 3l1u h ASP 142 Cb 0.17 -0.13 0.01 0.00 0.22 0.00 0.00 39.33 39.60 3l1u h ASP 142 CO -0.21 0.74 -0.40 0.22 -1.72 0.00 0.00 179.24 177.87 3l1u h TYR 143 N 0.41 0.41 -0.26 4.55 3.20 -0.76 -3.32 116.97 121.21 3l1u h TYR 143 Ca 0.06 -0.22 0.00 0.00 3.14 0.00 0.00 58.73 61.71 3l1u h TYR 143 Cb 0.69 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.92 3l1u h TYR 143 CO 0.02 1.03 0.00 1.28 -1.64 0.00 0.00 178.16 178.85 3l1u n LEU 144 N -4.38 3.27 -3.47 2.82 4.77 -0.24 -4.98 117.00 114.79 3l1u n LEU 144 Ca -0.10 -1.32 -0.22 0.00 -0.03 0.00 0.00 56.01 54.34 3l1u n LEU 144 Cb 0.58 -0.16 0.04 0.00 -2.33 0.00 0.00 43.42 41.55 3l1u n LEU 144 CO 0.42 0.65 0.01 1.57 -1.33 0.00 0.00 177.39 178.72 3l1u n HIS 145 N 1.42 -2.24 -3.29 -1.77 -0.00 -0.57 -4.51 115.22 104.25 3l1u n HIS 145 Ca 0.17 0.70 -0.38 0.00 -0.00 0.00 0.00 57.72 58.21 3l1u n HIS 145 Cb 0.60 -3.68 -0.06 0.00 -0.00 0.00 0.00 29.99 26.85 3l1u n HIS 145 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 3l1u s ILE 146 N -3.33 4.76 -0.95 3.57 1.01 -0.85 -1.33 121.20 124.08 3l1u s ILE 146 Ca 0.36 1.18 -0.21 0.00 0.00 0.00 0.00 60.65 61.98 3l1u s ILE 146 Cb -0.10 -3.88 0.10 0.00 0.01 0.00 0.00 42.46 38.59 3l1u s ILE 146 CO 0.81 0.55 1.25 -0.62 0.00 0.00 0.00 174.94 176.93 3l1u s ASP 147 N -1.13 6.56 0.23 3.58 -1.08 0.14 -4.81 116.67 120.16 3l1u s ASP 147 Ca 0.29 -1.77 -0.06 0.00 -0.52 0.00 0.00 52.55 50.49 3l1u s ASP 147 Cb -0.19 -2.47 0.30 0.00 -1.46 0.00 0.00 42.92 39.10 3l1u s ASP 147 CO 0.19 -1.25 1.86 0.24 0.52 0.00 0.00 175.17 176.72 3l1u h MET 148 N 9.24 0.95 -0.40 4.34 2.86 -1.87 -1.41 114.93 128.64 3l1u h MET 148 Ca 0.16 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3l1u h MET 148 Cb 1.02 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.45 3l1u h MET 148 CO 1.23 0.63 0.25 0.00 1.06 0.00 0.00 176.91 180.08 3l1u h ALA 149 N 1.38 1.69 -0.34 6.32 0.00 -1.91 -0.20 119.26 126.21 3l1u h ALA 149 Ca 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3l1u h ALA 149 Cb 0.12 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3l1u h ALA 149 CO -0.15 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.37 3l1u n ALA 150 N -2.48 2.69 -2.41 0.00 0.00 -0.55 -3.41 120.51 114.36 3l1u n ALA 150 Ca 0.03 -0.75 -0.23 0.00 0.00 0.00 0.00 53.44 52.49 3l1u n ALA 150 Cb 0.07 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.46 3l1u n ALA 150 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3l1u s SER 151 N -0.80 4.79 0.13 0.00 0.01 -0.35 -4.47 113.70 113.02 3l1u s SER 151 Ca 0.26 -0.81 0.09 0.00 1.31 0.00 0.00 55.95 56.79 3l1u s SER 151 Cb 0.15 -0.64 -0.04 0.00 0.21 0.00 0.00 66.02 65.70 3l1u s SER 151 CO 0.14 -0.47 -0.21 -0.31 0.41 0.00 0.00 173.24 172.79 3l1u s TYR 152 N -2.47 1.91 -0.07 2.43 2.02 -0.65 -1.60 117.35 118.92 3l1u s TYR 152 Ca 0.42 -0.42 0.04 0.00 -0.37 0.00 0.00 57.07 56.74 3l1u s TYR 152 Cb -0.01 -1.00 -0.00 0.00 -0.40 0.00 0.00 41.96 40.54 3l1u s TYR 152 CO 0.25 0.29 -0.21 1.41 -1.57 0.00 0.00 175.55 175.72 3l1u s MET 153 N -2.28 2.38 -0.10 -0.62 -2.45 -0.45 -0.48 119.30 115.30 3l1u s MET 153 Ca 0.12 -0.75 0.03 0.00 -1.25 0.00 0.00 55.69 53.83 3l1u s MET 153 Cb -0.08 -1.93 0.01 0.00 1.25 0.00 0.00 34.83 34.07 3l1u s MET 153 CO 0.06 0.23 -0.19 0.08 1.05 0.00 0.00 175.02 176.25 3l1u s VAL 154 N 0.16 1.73 0.23 10.11 1.01 -0.36 -0.10 120.40 133.19 3l1u s VAL 154 Ca -0.10 -0.81 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 3l1u s VAL 154 Cb -0.15 -1.53 0.05 0.00 0.00 0.00 0.00 36.38 34.75 3l1u s VAL 154 CO 0.05 0.49 0.87 -0.83 0.00 0.00 0.00 175.10 175.68 3l1u s GLY 155 N 0.65 -0.06 0.00 4.51 0.00 -0.75 -1.25 107.32 110.42 3l1u s GLY 155 Ca -0.13 -0.19 0.13 0.00 0.00 0.00 0.00 44.72 44.53 3l1u s GLY 155 CO 0.03 0.22 0.98 2.09 0.00 0.00 0.00 173.10 176.42 3l1u n ASP 156 N -0.68 2.27 -4.33 1.64 5.75 -1.26 -0.90 116.55 119.03 3l1u n ASP 156 Ca -0.05 -1.63 -0.19 0.00 -0.01 0.00 0.00 54.79 52.91 3l1u n ASP 156 Cb 0.60 -0.05 -0.10 0.00 -1.03 0.00 0.00 41.12 40.53 3l1u n ASP 156 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3l1u s LYS 157 N -1.05 1.29 0.21 0.11 1.02 -1.26 -4.52 119.74 115.53 3l1u s LYS 157 Ca 0.17 -1.51 -0.09 0.00 0.02 0.00 0.00 55.97 54.56 3l1u s LYS 157 Cb 0.11 -1.15 0.28 0.00 -0.52 0.00 0.00 37.83 36.55 3l1u s LYS 157 CO 0.16 0.20 1.76 1.25 -0.92 0.00 0.00 175.35 177.81 3l1u h LEU 158 N 2.81 0.34 -1.51 3.17 5.85 -1.93 -1.88 115.31 122.16 3l1u h LEU 158 Ca -0.39 0.06 0.19 0.00 0.84 0.00 0.00 57.88 58.59 3l1u h LEU 158 Cb 1.22 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 42.19 3l1u h LEU 158 CO 0.58 0.21 0.58 1.05 -0.34 0.00 0.00 178.44 180.52 3l1u h GLU 159 N 0.50 0.40 -0.20 1.25 4.11 -1.96 0.16 114.58 118.84 3l1u h GLU 159 Ca 0.31 -0.02 -0.02 0.00 0.07 0.00 0.00 59.36 59.70 3l1u h GLU 159 Cb 0.34 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 3l1u h GLU 159 CO -0.27 0.27 0.06 -0.44 0.07 0.00 0.00 179.01 178.69 3l1u h ASP 160 N 0.42 0.30 -0.60 3.06 3.32 -1.72 -1.23 116.42 119.96 3l1u h ASP 160 Ca 0.46 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 57.20 3l1u h ASP 160 Cb 1.11 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 3l1u h ASP 160 CO -0.17 0.44 0.05 0.24 -1.72 0.00 0.00 179.24 178.08 3l1u h MET 161 N 0.14 1.03 -0.43 3.56 2.86 -0.72 -2.24 114.93 119.13 3l1u h MET 161 Ca 0.06 -0.30 -0.11 0.00 -2.06 0.00 0.00 59.70 57.29 3l1u h MET 161 Cb 0.25 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 3l1u h MET 161 CO -0.00 0.99 -0.17 1.96 1.06 0.00 0.00 176.91 180.75 3l1u h GLN 162 N 0.93 0.87 -0.72 1.72 4.20 -0.89 -1.33 115.11 119.89 3l1u h GLN 162 Ca 0.18 -0.36 0.05 0.00 0.06 0.00 0.00 58.65 58.57 3l1u h GLN 162 Cb 0.49 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.19 3l1u h GLN 162 CO 0.02 1.01 0.43 0.00 -0.67 0.00 0.00 178.83 179.62 3l1u h ALA 163 N 0.84 0.96 -0.33 3.87 0.00 -1.12 -1.76 119.26 121.72 3l1u h ALA 163 Ca 0.10 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3l1u h ALA 163 Cb 0.72 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3l1u h ALA 163 CO 0.05 0.16 0.10 0.00 0.00 0.00 0.00 179.25 179.56 3l1u h ALA 164 N 1.34 0.43 -0.40 0.00 0.00 -1.15 -2.15 119.26 117.33 3l1u h ALA 164 Ca 0.31 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.11 3l1u h ALA 164 Cb 0.12 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 3l1u h ALA 164 CO -0.15 0.08 0.12 0.28 0.00 0.00 0.00 179.25 179.57 3l1u h VAL 165 N 0.38 0.85 -0.83 0.00 2.07 -0.84 -0.99 116.25 116.88 3l1u h VAL 165 Ca 0.11 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.50 3l1u h VAL 165 Cb 0.26 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 3l1u h VAL 165 CO -0.00 0.05 0.38 0.00 0.02 0.00 0.00 177.57 178.01 3l1u h ALA 166 N 1.28 1.08 -0.11 1.67 0.00 -1.19 -2.48 119.26 119.50 3l1u h ALA 166 Ca 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3l1u h ALA 166 Cb 0.19 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3l1u h ALA 166 CO -0.21 0.67 0.00 0.00 0.00 0.00 0.00 179.25 179.70 3l1u n ALA 167 N -2.42 2.55 -3.44 0.00 0.00 -0.82 -4.91 120.51 111.46 3l1u n ALA 167 Ca 0.08 -0.38 -0.21 0.00 0.00 0.00 0.00 53.44 52.92 3l1u n ALA 167 Cb 0.16 -1.15 0.07 0.00 0.00 0.00 0.00 19.45 18.52 3l1u n ALA 167 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3l1u n ASN 168 N -0.05 -5.87 -4.72 0.00 5.15 -0.48 -4.93 115.26 104.36 3l1u n ASN 168 Ca 0.15 -0.46 -0.42 0.00 -0.60 0.00 0.00 54.58 53.25 3l1u n ASN 168 Cb 0.24 -4.49 -0.03 0.00 -0.53 0.00 0.00 39.78 34.97 3l1u n ASN 168 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3l1u s VAL 169 N -3.27 3.82 0.15 3.44 1.01 -0.59 -3.67 120.40 121.29 3l1u s VAL 169 Ca 0.51 1.35 -0.20 0.00 0.00 0.00 0.00 61.98 63.64 3l1u s VAL 169 Cb -0.22 -3.87 0.04 0.00 0.00 0.00 0.00 36.38 32.33 3l1u s VAL 169 CO 0.63 0.13 1.66 1.23 0.00 0.00 0.00 175.10 178.74 3l1u h GLY 170 N 6.47 0.04 -6.22 4.51 0.00 -0.77 -3.42 103.07 103.68 3l1u h GLY 170 Ca -0.42 0.20 -0.52 0.00 0.00 0.00 0.00 47.33 46.59 3l1u h GLY 170 CO 0.81 -0.17 -0.81 -1.59 0.00 0.00 0.00 176.54 174.78 3l1u s THR 171 N -6.15 1.07 -0.30 4.70 2.01 -0.63 -5.01 115.64 111.33 3l1u s THR 171 Ca -0.14 -0.39 -0.08 0.00 0.31 0.00 0.00 61.69 61.39 3l1u s THR 171 Cb 0.12 -1.03 -0.00 0.00 0.01 0.00 0.00 72.50 71.60 3l1u s THR 171 CO 0.69 0.36 0.12 -0.54 -0.69 0.00 0.00 174.62 174.56 3l1u s LYS 172 N 1.13 3.25 -0.22 4.92 1.02 -1.26 -1.35 119.74 127.23 3l1u s LYS 172 Ca -0.06 -0.76 -0.04 0.00 0.02 0.00 0.00 55.97 55.12 3l1u s LYS 172 Cb -0.14 -3.48 -0.01 0.00 -0.52 0.00 0.00 37.83 33.67 3l1u s LYS 172 CO -0.02 -0.42 -0.03 0.08 -0.92 0.00 0.00 175.35 174.04 3l1u s VAL 173 N 1.57 3.53 0.02 3.17 1.01 0.86 -0.35 120.40 130.21 3l1u s VAL 173 Ca 0.04 -0.44 -0.05 0.00 0.00 0.00 0.00 61.98 61.53 3l1u s VAL 173 Cb -0.17 -2.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.56 3l1u s VAL 173 CO 0.05 0.42 0.25 -0.22 0.00 0.00 0.00 175.10 175.59 3l1u s LEU 174 N 1.39 4.36 0.24 3.92 2.96 0.07 -1.81 118.68 129.80 3l1u s LEU 174 Ca 0.05 0.47 0.09 0.00 -0.22 0.00 0.00 54.13 54.51 3l1u s LEU 174 Cb -0.14 -2.75 -0.05 0.00 0.50 0.00 0.00 46.19 43.74 3l1u s LEU 174 CO -0.02 0.23 -0.14 0.68 -1.32 0.00 0.00 176.35 175.78 3l1u s VAL 175 N -1.37 1.94 -1.81 1.68 -7.23 -0.08 -0.71 120.40 112.83 3l1u s VAL 175 Ca 0.30 -2.25 0.19 0.00 -1.81 0.00 0.00 61.98 58.40 3l1u s VAL 175 Cb -0.13 -2.20 0.47 0.00 0.56 0.00 0.00 36.38 35.08 3l1u s VAL 175 CO 0.19 -0.49 1.39 0.54 -0.31 0.00 0.00 175.10 176.42 3l1u n ARG 176 N -0.49 2.57 0.00 4.82 1.74 -0.84 -4.49 116.66 119.98 3l1u n ARG 176 Ca -0.07 -2.32 0.14 0.00 -0.77 0.00 0.00 57.85 54.84 3l1u n ARG 176 Cb 0.61 -1.46 0.65 0.00 -1.02 0.00 0.00 32.46 31.24 3l1u n ARG 176 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3l1u n THR 177 N 1.26 0.00 0.00 0.55 -2.24 -1.18 -4.75 114.28 107.92 3l1u n THR 177 Ca 0.19 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 3l1u n THR 177 Cb 0.55 -0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 3l1u n THR 177 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3l1u n GLY 178 N 1.41 1.51 3.70 3.38 0.00 -1.14 -4.80 105.19 109.26 3l1u n GLY 178 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3l1u n GLY 178 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3l1u s LYS 179 N 2.32 4.16 -0.42 1.61 1.02 -1.26 -4.88 119.74 122.28 3l1u s LYS 179 Ca 0.00 2.52 -0.40 0.00 0.02 0.00 0.00 55.97 58.11 3l1u s LYS 179 Cb 0.00 -3.36 -0.15 0.00 -0.52 0.00 0.00 37.83 33.79 3l1u s LYS 179 CO 0.00 -0.76 2.14 -2.30 -0.92 0.00 0.00 175.35 173.52 3l1u n PRO 180 N 4.86 0.54 -1.91 -1.68 -0.02 -1.26 -4.76 135.00 130.78 3l1u n PRO 180 Ca 0.16 0.15 -0.41 0.00 -2.02 0.00 0.00 63.50 61.38 3l1u n PRO 180 Cb 0.38 -1.97 -0.02 0.00 -0.02 0.00 0.00 33.50 31.87 3l1u n PRO 180 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 3l1u s ILE 181 N 6.51 2.38 0.58 4.25 -4.36 -1.26 -4.99 121.20 124.32 3l1u s ILE 181 Ca 1.14 0.33 -0.13 0.00 -0.26 0.00 0.00 60.65 61.73 3l1u s ILE 181 Cb -1.18 -3.21 -0.05 0.00 1.25 0.00 0.00 42.46 39.26 3l1u s ILE 181 CO 0.58 0.06 1.01 0.42 0.24 0.00 0.00 174.94 177.25 3l1u s THR 182 N -0.19 4.64 0.28 8.37 -4.23 -1.26 -4.94 115.64 118.30 3l1u s THR 182 Ca 0.59 1.00 0.22 0.00 -1.18 0.00 0.00 61.69 62.32 3l1u s THR 182 Cb -0.44 -3.82 0.21 0.00 1.34 0.00 0.00 72.50 69.79 3l1u s THR 182 CO 0.48 -0.99 1.89 -0.65 -0.54 0.00 0.00 174.62 174.81 3l1u h PRO 183 N 0.11 0.00 -0.08 3.99 0.11 -1.98 -1.77 132.00 132.38 3l1u h PRO 183 Ca -0.45 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 3l1u h PRO 183 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 3l1u h PRO 183 CO 0.62 0.25 -0.09 0.93 -0.21 0.00 0.00 178.00 179.50 3l1u h GLU 184 N 0.00 0.21 -0.46 1.05 3.07 -1.99 -0.03 114.58 116.43 3l1u h GLU 184 Ca -0.00 -0.11 0.06 0.00 -0.50 0.00 0.00 59.36 58.80 3l1u h GLU 184 Cb 0.63 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.49 3l1u h GLU 184 CO 0.03 0.64 0.17 0.00 -1.40 0.00 0.00 179.01 178.45 3l1u h ALA 185 N 0.56 0.55 -0.72 3.43 0.00 -1.89 -1.73 119.26 119.47 3l1u h ALA 185 Ca 0.01 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3l1u h ALA 185 Cb 0.61 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 3l1u h ALA 185 CO 0.02 -0.22 0.47 1.49 0.00 0.00 0.00 179.25 181.01 3l1u h GLU 186 N 0.35 0.95 -0.46 0.00 4.81 -1.28 -2.11 114.58 116.84 3l1u h GLU 186 Ca 0.21 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.43 3l1u h GLU 186 Cb 0.20 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 3l1u h GLU 186 CO -0.21 0.64 0.21 -0.91 -0.73 0.00 0.00 179.01 178.01 3l1u h ASN 187 N 0.97 0.28 1.11 1.04 2.35 -0.47 -2.86 115.58 118.00 3l1u h ASN 187 Ca 0.26 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 56.02 3l1u h ASN 187 Cb -0.09 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 3l1u h ASN 187 CO -0.05 0.20 -0.13 0.00 -1.65 0.00 0.00 177.43 175.79 3l1u h ALA 188 N 1.26 0.99 -2.09 -0.83 0.00 -0.85 -3.45 119.26 114.29 3l1u h ALA 188 Ca 0.20 -0.12 -0.45 0.00 0.00 0.00 0.00 54.91 54.55 3l1u h ALA 188 Cb 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3l1u h ALA 188 CO -0.17 0.16 0.34 0.00 0.00 0.00 0.00 179.25 179.59 3l1u s ALA 189 N -3.57 3.05 -0.15 0.00 0.00 -0.84 -4.93 121.76 115.32 3l1u s ALA 189 Ca 0.02 0.35 -0.20 0.00 0.00 0.00 0.00 51.96 52.13 3l1u s ALA 189 Cb 0.09 -3.14 -0.18 0.00 0.00 0.00 0.00 23.12 19.90 3l1u s ALA 189 CO 0.61 0.07 0.43 -0.44 0.00 0.00 0.00 175.76 176.43 3l1u h ASP 190 N 1.73 0.00 -2.96 0.00 3.32 -1.00 -3.48 116.42 114.04 3l1u h ASP 190 Ca -0.49 -0.63 -0.63 0.00 0.02 0.00 0.00 57.03 55.31 3l1u h ASP 190 Cb 1.18 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.58 3l1u h ASP 190 CO 0.61 0.98 -0.75 0.26 -1.72 0.00 0.00 179.24 178.62 3l1u s TRP 191 N -2.11 2.53 -0.15 4.55 0.51 -0.56 -5.01 118.94 118.69 3l1u s TRP 191 Ca -0.17 -0.26 0.01 0.00 -2.12 0.00 0.00 56.10 53.56 3l1u s TRP 191 Cb -0.00 -1.22 0.02 0.00 -0.81 0.00 0.00 33.47 31.45 3l1u s TRP 191 CO 0.49 0.53 -0.16 0.08 -0.51 0.00 0.00 176.95 177.38 3l1u s VAL 192 N -1.78 1.73 0.17 4.03 1.01 -1.26 -0.75 120.40 123.54 3l1u s VAL 192 Ca 0.24 -0.74 0.11 0.00 0.00 0.00 0.00 61.98 61.59 3l1u s VAL 192 Cb -0.08 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 3l1u s VAL 192 CO 0.14 0.48 -0.21 -0.76 0.00 0.00 0.00 175.10 174.75 3l1u s LEU 193 N 1.35 2.54 0.36 3.92 1.43 0.12 -4.97 118.68 123.42 3l1u s LEU 193 Ca 0.03 -0.75 0.04 0.00 -1.03 0.00 0.00 54.13 52.42 3l1u s LEU 193 Cb -0.13 -1.31 0.69 0.00 0.03 0.00 0.00 46.19 45.47 3l1u s LEU 193 CO -0.10 0.14 1.99 0.78 0.23 0.00 0.00 176.35 179.39 3l1u h ASN 194 N 3.36 0.69 -4.86 2.29 2.35 -1.95 -2.23 115.58 115.24 3l1u h ASN 194 Ca -0.48 -0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.27 3l1u h ASN 194 Cb 1.19 -0.16 -0.15 0.00 0.05 0.00 0.00 38.32 39.25 3l1u h ASN 194 CO 0.47 0.48 0.29 -0.55 -1.65 0.00 0.00 177.43 176.47 3l1u s SER 195 N -6.35 -0.53 0.56 5.81 0.15 -1.26 -2.57 113.70 109.50 3l1u s SER 195 Ca -0.10 0.19 0.26 0.00 0.70 0.00 0.00 55.95 57.00 3l1u s SER 195 Cb 0.18 0.52 1.48 0.00 -1.71 0.00 0.00 66.02 66.50 3l1u s SER 195 CO 0.77 -0.77 2.04 0.25 1.20 0.00 0.00 173.24 176.73 3l1u h LEU 196 N 2.27 0.00 -2.03 3.45 5.85 -1.89 -1.05 115.31 121.91 3l1u h LEU 196 Ca -0.29 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 3l1u h LEU 196 Cb 1.25 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 3l1u h LEU 196 CO 0.36 0.00 -0.02 0.00 -0.34 0.00 0.00 178.44 178.44 3l1u h ALA 197 N 1.75 1.89 -0.00 1.25 0.00 -1.84 -2.00 119.26 120.30 3l1u h ALA 197 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3l1u h ALA 197 Cb 0.73 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3l1u h ALA 197 CO -0.00 0.03 -0.24 -0.25 0.00 0.00 0.00 179.25 178.79 3l1u n ASP 198 N -4.40 0.25 -0.10 0.00 8.00 -0.40 -4.36 116.55 115.54 3l1u n ASP 198 Ca -0.03 0.11 -0.10 0.00 0.71 0.00 0.00 54.79 55.48 3l1u n ASP 198 Cb 0.11 -0.14 -0.02 0.00 -0.02 0.00 0.00 41.12 41.05 3l1u n ASP 198 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3l1u h LEU 199 N 0.02 0.42 -0.80 0.64 5.85 -1.43 -2.56 115.31 117.46 3l1u h LEU 199 Ca 0.00 -0.16 0.07 0.00 0.84 0.00 0.00 57.88 58.63 3l1u h LEU 199 Cb 0.49 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 3l1u h LEU 199 CO 0.00 0.47 0.47 -0.65 -0.34 0.00 0.00 178.44 178.39 3l1u h PRO 200 N 0.36 0.82 -0.66 5.25 0.11 -1.77 -0.51 132.00 135.60 3l1u h PRO 200 Ca 0.10 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.09 3l1u h PRO 200 Cb 0.17 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.07 3l1u h PRO 200 CO -0.01 0.54 0.10 1.96 -0.21 0.00 0.00 178.00 180.38 3l1u h GLN 201 N 0.84 1.09 -0.61 1.05 1.08 -1.82 -0.65 115.11 116.09 3l1u h GLN 201 Ca 0.36 -0.29 -0.04 0.00 -1.45 0.00 0.00 58.65 57.23 3l1u h GLN 201 Cb 0.23 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.50 3l1u h GLN 201 CO -0.20 1.00 0.23 0.00 -0.95 0.00 0.00 178.83 178.92 3l1u h ALA 202 N 1.08 1.26 0.04 3.87 0.00 -0.87 -1.49 119.26 123.15 3l1u h ALA 202 Ca 0.20 -0.17 -0.25 0.00 0.00 0.00 0.00 54.91 54.69 3l1u h ALA 202 Cb 0.44 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.00 3l1u h ALA 202 CO 0.01 0.54 -1.06 0.82 0.00 0.00 0.00 179.25 179.57 3l1u h ILE 203 N 0.88 1.38 -0.81 0.00 2.04 -0.89 -3.16 117.51 116.96 3l1u h ILE 203 Ca 0.21 -2.53 0.03 0.00 1.00 0.00 0.00 64.86 63.56 3l1u h ILE 203 Cb 0.19 2.55 -0.05 0.00 -0.74 0.00 0.00 36.82 38.78 3l1u h ILE 203 CO -0.02 0.76 0.52 0.11 0.00 0.00 0.00 178.15 179.52 3l1u h LYS 204 N 0.23 1.00 0.00 2.37 1.57 -0.82 -3.51 116.57 117.40 3l1u h LYS 204 Ca -0.11 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3l1u h LYS 204 Cb 1.72 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.80 3l1u h LYS 204 CO 0.19 0.66 0.00 1.63 -0.57 0.00 0.00 179.45 181.36