#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j27 n LYS 3 N 0.00 1.05 -1.14 1.43 5.02 -1.26 -5.01 118.16 118.25 2j27 n LYS 3 Ca 0.00 0.40 -0.29 0.00 -2.02 0.00 0.00 58.31 56.40 2j27 n LYS 3 Cb 0.00 -2.31 0.21 0.00 -0.02 0.00 0.00 35.03 32.91 2j27 n LYS 3 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2j27 s PRO 4 N -2.92 -0.40 0.03 1.97 0.04 -1.26 -4.91 135.00 127.55 2j27 s PRO 4 Ca 0.77 0.21 -0.34 0.00 0.04 0.00 0.00 61.00 61.68 2j27 s PRO 4 Cb -0.41 -1.67 -0.13 0.00 0.04 0.00 0.00 34.50 32.34 2j27 s PRO 4 CO 0.46 -3.22 1.74 0.94 0.04 0.00 0.00 177.00 176.95 2j27 n GLN 5 N -4.47 2.18 -1.55 4.56 7.27 -1.26 -4.95 117.38 119.16 2j27 n GLN 5 Ca 0.09 0.79 -0.31 0.00 0.07 0.00 0.00 57.00 57.65 2j27 n GLN 5 Cb 0.58 -2.61 0.07 0.00 2.41 0.00 0.00 30.24 30.70 2j27 n GLN 5 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2j27 s PRO 6 N 2.61 2.52 -0.05 3.69 0.04 -1.26 -4.87 135.00 137.69 2j27 s PRO 6 Ca 0.86 0.82 0.03 0.00 0.04 0.00 0.00 61.00 62.75 2j27 s PRO 6 Cb -0.68 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 31.91 2j27 s PRO 6 CO 0.45 -1.36 -0.14 0.42 0.04 0.00 0.00 177.00 176.41 2j27 s ILE 7 N -3.09 1.18 -0.33 0.56 1.01 -0.71 -1.03 121.20 118.79 2j27 s ILE 7 Ca 0.59 -0.56 -0.01 0.00 0.00 0.00 0.00 60.65 60.68 2j27 s ILE 7 Cb -0.14 -1.04 0.08 0.00 0.01 0.00 0.00 42.46 41.36 2j27 s ILE 7 CO 0.55 0.35 0.06 0.00 0.00 0.00 0.00 174.94 175.90 2j27 s ALA 8 N 0.28 2.90 -0.25 9.38 0.00 -0.39 -1.33 121.76 132.36 2j27 s ALA 8 Ca -0.07 -2.12 -0.07 0.00 0.00 0.00 0.00 51.96 49.70 2j27 s ALA 8 Cb -0.12 -2.05 -0.02 0.00 0.00 0.00 0.00 23.12 20.93 2j27 s ALA 8 CO 0.02 -1.49 0.05 0.00 0.00 0.00 0.00 175.76 174.35 2j27 s ALA 9 N 1.15 3.09 -0.38 0.00 0.00 -0.18 -1.19 121.76 124.25 2j27 s ALA 9 Ca 0.01 -1.18 -0.22 0.00 0.00 0.00 0.00 51.96 50.57 2j27 s ALA 9 Cb -0.21 -2.03 0.01 0.00 0.00 0.00 0.00 23.12 20.90 2j27 s ALA 9 CO -0.04 -0.54 0.72 0.00 0.00 0.00 0.00 175.76 175.91 2j27 s ALA 10 N 1.58 3.41 -0.61 0.00 0.00 0.76 -0.59 121.76 126.30 2j27 s ALA 10 Ca 0.06 -0.84 -0.12 0.00 0.00 0.00 0.00 51.96 51.06 2j27 s ALA 10 Cb -0.15 -3.31 0.16 0.00 0.00 0.00 0.00 23.12 19.82 2j27 s ALA 10 CO 0.02 -1.54 0.52 1.21 0.00 0.00 0.00 175.76 175.97 2j27 s ASN 11 N 1.89 6.10 0.13 0.00 2.47 0.71 -0.32 114.94 125.93 2j27 s ASN 11 Ca 0.28 -2.19 0.16 0.00 0.42 0.00 0.00 52.86 51.52 2j27 s ASN 11 Cb -0.14 -2.11 0.71 0.00 -1.45 0.00 0.00 41.25 38.27 2j27 s ASN 11 CO 0.17 -0.68 1.49 0.79 -3.72 0.00 0.00 177.10 175.16 2j27 n TRP 12 N 4.60 0.38 -3.37 0.43 8.01 -0.76 -4.27 117.44 122.45 2j27 n TRP 12 Ca -0.02 0.16 0.00 0.00 -1.31 0.00 0.00 57.50 56.33 2j27 n TRP 12 Cb 0.42 -0.76 0.00 0.00 -2.01 0.00 0.00 31.31 28.96 2j27 n TRP 12 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 2j27 n LYS 13 N -1.86 0.00 -2.97 -0.99 5.02 -1.26 -3.24 118.16 112.86 2j27 n LYS 13 Ca 0.02 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.88 2j27 n LYS 13 Cb 0.14 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.16 2j27 n LYS 13 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j27 s ASN 15 N -1.78 0.20 0.00 0.00 0.01 -1.20 -5.14 114.94 107.03 2j27 s ASN 15 Ca 0.32 -0.57 0.00 0.00 -0.71 0.00 0.00 52.86 51.90 2j27 s ASN 15 Cb 0.06 0.23 0.00 0.00 0.41 0.00 0.00 41.25 41.95 2j27 s ASN 15 CO 0.09 -0.52 0.00 0.61 -1.51 0.00 0.00 177.10 175.77 2j27 n GLY 16 N 0.69 2.86 3.85 0.66 0.00 -1.26 -4.80 105.19 107.20 2j27 n GLY 16 Ca -0.19 -1.85 -0.21 0.00 0.00 0.00 0.00 46.02 43.77 2j27 n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2j27 s SER 17 N 0.00 5.14 0.22 1.61 1.04 -1.26 -4.97 113.70 115.48 2j27 s SER 17 Ca 0.00 -0.62 -0.07 0.00 0.48 0.00 0.00 55.95 55.74 2j27 s SER 17 Cb 0.00 -0.79 0.33 0.00 0.10 0.00 0.00 66.02 65.67 2j27 s SER 17 CO 0.00 -0.47 1.77 1.56 0.98 0.00 0.00 173.24 177.08 2j27 h GLN 18 N 1.18 0.53 -0.12 4.02 4.20 -1.99 -1.51 115.11 121.43 2j27 h GLN 18 Ca -0.43 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.19 2j27 h GLN 18 Cb 1.26 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.92 2j27 h GLN 18 CO 0.58 0.35 -0.13 0.37 -0.67 0.00 0.00 178.83 179.34 2j27 h GLN 19 N 0.55 0.31 -0.54 1.46 4.15 -1.98 -0.73 115.11 118.33 2j27 h GLN 19 Ca 0.35 -0.17 -0.07 0.00 0.77 0.00 0.00 58.65 59.53 2j27 h GLN 19 Cb 0.39 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.06 2j27 h GLN 19 CO -0.29 0.71 0.05 0.66 -1.93 0.00 0.00 178.83 178.04 2j27 h SER 20 N -0.08 0.85 -0.05 -0.69 4.64 -1.89 -1.27 113.55 115.05 2j27 h SER 20 Ca 0.02 -0.19 -0.20 0.00 -0.47 0.00 0.00 61.79 60.94 2j27 h SER 20 Cb 0.66 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2j27 h SER 20 CO 0.03 0.88 -0.70 -0.07 -0.87 0.00 0.00 176.83 176.09 2j27 h LEU 21 N 0.83 0.80 -1.39 5.97 3.38 -1.32 -2.54 115.31 121.05 2j27 h LEU 21 Ca 0.17 -0.50 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 2j27 h LEU 21 Cb 0.42 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2j27 h LEU 21 CO 0.01 1.27 0.26 -1.28 0.09 0.00 0.00 178.44 178.80 2j27 h SER 22 N 0.49 0.60 -0.33 -0.43 0.87 -0.77 -0.35 113.55 113.63 2j27 h SER 22 Ca -0.03 -0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 60.36 2j27 h SER 22 Cb 1.31 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 63.10 2j27 h SER 22 CO 0.14 0.50 -0.24 -0.33 -0.53 0.00 0.00 176.83 176.37 2j27 h GLU 23 N 0.69 0.83 -0.48 2.24 5.08 -1.09 -0.48 114.58 121.37 2j27 h GLU 23 Ca 0.18 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 2j27 h GLU 23 Cb 0.03 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2j27 h GLU 23 CO -0.03 0.98 0.26 -0.07 -1.00 0.00 0.00 179.01 179.16 2j27 h LEU 24 N 0.72 0.59 -0.84 1.33 3.38 -0.97 -2.32 115.31 117.20 2j27 h LEU 24 Ca 0.09 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.01 2j27 h LEU 24 Cb 0.77 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.32 2j27 h LEU 24 CO 0.06 0.51 0.54 0.40 0.09 0.00 0.00 178.44 180.04 2j27 h ILE 25 N 0.63 1.14 -0.88 1.22 2.04 -0.74 -0.05 117.51 120.87 2j27 h ILE 25 Ca 0.17 -0.36 0.07 0.00 1.00 0.00 0.00 64.86 65.73 2j27 h ILE 25 Cb 0.04 -0.01 -0.06 0.00 -0.74 0.00 0.00 36.82 36.05 2j27 h ILE 25 CO -0.03 0.19 0.57 0.44 0.00 0.00 0.00 178.15 179.33 2j27 h ASP 26 N 1.06 0.86 -0.14 1.72 3.32 -0.81 0.11 116.42 122.54 2j27 h ASP 26 Ca 0.33 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.36 2j27 h ASP 26 Cb -0.01 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 2j27 h ASP 26 CO -0.11 0.54 -0.04 0.25 -1.72 0.00 0.00 179.24 178.16 2j27 h LEU 27 N 0.97 0.28 -0.73 1.55 5.85 -0.75 -2.54 115.31 119.95 2j27 h LEU 27 Ca 0.38 -0.38 0.05 0.00 0.84 0.00 0.00 57.88 58.77 2j27 h LEU 27 Cb 0.24 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 2j27 h LEU 27 CO -0.15 0.60 0.44 -0.26 -0.34 0.00 0.00 178.44 178.73 2j27 h PHE 28 N -0.04 0.82 0.00 1.25 0.04 -0.52 -2.22 116.94 116.27 2j27 h PHE 28 Ca 0.03 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 2j27 h PHE 28 Cb 0.48 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 38.37 2j27 h PHE 28 CO 0.06 0.43 -0.08 -0.91 -0.60 0.00 0.00 178.31 177.20 2j27 h ASN 29 N 0.83 0.00 0.10 2.17 2.35 -0.60 -2.52 115.58 117.91 2j27 h ASN 29 Ca 0.31 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.06 2j27 h ASN 29 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 2j27 h ASN 29 CO -0.15 0.08 -0.23 -1.54 -1.65 0.00 0.00 177.43 173.93 2j27 n SER 30 N -4.29 1.57 -4.74 5.81 3.41 -0.87 -4.79 113.62 109.71 2j27 n SER 30 Ca -0.03 -1.28 -0.41 0.00 -0.26 0.00 0.00 58.87 56.90 2j27 n SER 30 Cb 0.16 0.18 -0.04 0.00 -0.26 0.00 0.00 64.21 64.25 2j27 n SER 30 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2j27 s THR 31 N -2.34 3.72 -0.30 6.66 2.01 -0.95 -5.03 115.64 119.41 2j27 s THR 31 Ca 0.26 1.55 -0.13 0.00 0.31 0.00 0.00 61.69 63.69 2j27 s THR 31 Cb 0.19 -3.99 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 2j27 s THR 31 CO 0.47 0.30 0.25 -0.55 -0.69 0.00 0.00 174.62 174.40 2j27 s SER 32 N -0.32 6.09 -0.11 3.53 0.15 -1.26 -5.07 113.70 116.71 2j27 s SER 32 Ca 0.48 -0.06 0.02 0.00 0.70 0.00 0.00 55.95 57.09 2j27 s SER 32 Cb -0.30 -2.15 0.01 0.00 -1.71 0.00 0.00 66.02 61.87 2j27 s SER 32 CO 0.37 -0.14 -0.17 -0.63 1.20 0.00 0.00 173.24 173.86 2j27 s ILE 33 N 1.84 1.63 -0.18 6.45 1.01 -1.26 -5.04 121.20 125.65 2j27 s ILE 33 Ca 0.09 -0.74 0.16 0.00 0.00 0.00 0.00 60.65 60.16 2j27 s ILE 33 Cb -0.16 -1.47 0.48 0.00 0.01 0.00 0.00 42.46 41.32 2j27 s ILE 33 CO 0.11 0.47 1.38 0.59 0.00 0.00 0.00 174.94 177.48 2j27 n ASN 34 N 4.03 3.43 -4.26 3.58 3.02 -1.26 -4.99 115.26 118.81 2j27 n ASN 34 Ca -0.20 -3.13 -0.14 0.00 -0.03 0.00 0.00 54.58 51.08 2j27 n ASN 34 Cb 0.52 -0.54 -0.10 0.00 -0.61 0.00 0.00 39.78 39.05 2j27 n ASN 34 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 2j27 s HIS 35 N -2.89 1.35 -0.40 3.10 -3.43 -1.26 -5.11 115.29 106.65 2j27 s HIS 35 Ca 0.41 -1.27 -0.28 0.00 -0.80 0.00 0.00 55.06 53.12 2j27 s HIS 35 Cb 0.34 -0.73 0.02 0.00 -1.43 0.00 0.00 32.58 30.78 2j27 s HIS 35 CO 0.07 -0.48 1.04 0.34 -2.00 0.00 0.00 174.74 173.71 2j27 s ASP 36 N -3.24 6.72 -0.16 7.38 -1.08 -1.26 -4.98 116.67 120.04 2j27 s ASP 36 Ca 0.38 0.63 -0.10 0.00 -0.52 0.00 0.00 52.55 52.94 2j27 s ASP 36 Cb 0.07 -2.51 0.05 0.00 -1.46 0.00 0.00 42.92 39.07 2j27 s ASP 36 CO 0.13 -1.02 0.40 0.54 0.52 0.00 0.00 175.17 175.74 2j27 s VAL 37 N 3.88 -0.02 -0.35 1.11 0.11 -1.26 -4.23 120.40 119.65 2j27 s VAL 37 Ca 0.43 0.08 -0.23 0.00 -2.93 0.00 0.00 61.98 59.33 2j27 s VAL 37 Cb -0.10 -0.59 0.01 0.00 -1.53 0.00 0.00 36.38 34.16 2j27 s VAL 37 CO 0.23 0.03 0.78 -1.58 -3.33 0.00 0.00 175.10 171.23 2j27 s GLN 38 N 1.16 3.81 -0.03 1.54 2.00 -0.19 -4.86 119.66 123.08 2j27 s GLN 38 Ca -0.08 0.37 -0.10 0.00 -2.00 0.00 0.00 55.36 53.55 2j27 s GLN 38 Cb -0.07 -3.79 -0.05 0.00 0.80 0.00 0.00 33.01 29.90 2j27 s GLN 38 CO -0.10 -0.79 0.29 0.00 -0.50 0.00 0.00 175.29 174.19 2j27 s VAL 40 N -1.12 0.82 -0.34 0.00 1.01 -0.33 -1.24 120.40 119.19 2j27 s VAL 40 Ca 0.22 -0.30 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 2j27 s VAL 40 Cb -0.14 -0.78 0.07 0.00 0.00 0.00 0.00 36.38 35.53 2j27 s VAL 40 CO 0.11 0.28 0.08 -0.69 0.00 0.00 0.00 175.10 174.88 2j27 s VAL 41 N 0.73 3.19 -0.55 2.92 1.01 0.07 -0.17 120.40 127.60 2j27 s VAL 41 Ca -0.12 -1.59 -0.17 0.00 0.00 0.00 0.00 61.98 60.10 2j27 s VAL 41 Cb -0.15 -2.96 0.12 0.00 0.00 0.00 0.00 36.38 33.40 2j27 s VAL 41 CO 0.02 -0.32 0.54 0.00 0.00 0.00 0.00 175.10 175.34 2j27 s ALA 42 N 1.23 3.59 0.50 5.51 0.00 0.57 -0.93 121.76 132.23 2j27 s ALA 42 Ca 0.00 -2.45 0.06 0.00 0.00 0.00 0.00 51.96 49.57 2j27 s ALA 42 Cb -0.21 -3.32 0.04 0.00 0.00 0.00 0.00 23.12 19.63 2j27 s ALA 42 CO -0.02 -2.08 0.69 -1.54 0.00 0.00 0.00 175.76 172.81 2j27 s SER 43 N 3.56 5.38 0.97 0.00 1.04 -1.12 -1.84 113.70 121.70 2j27 s SER 43 Ca 0.05 -0.37 -0.11 0.00 0.48 0.00 0.00 55.95 55.99 2j27 s SER 43 Cb -0.28 -0.52 0.18 0.00 0.10 0.00 0.00 66.02 65.49 2j27 s SER 43 CO 0.04 -1.03 1.10 0.42 0.98 0.00 0.00 173.24 174.75 2j27 s THR 44 N -2.56 2.27 0.37 2.02 -4.23 -1.26 -4.22 115.64 108.03 2j27 s THR 44 Ca 0.57 0.09 0.06 0.00 -1.18 0.00 0.00 61.69 61.23 2j27 s THR 44 Cb -0.09 -2.24 0.29 0.00 1.34 0.00 0.00 72.50 71.79 2j27 s THR 44 CO 0.36 -0.11 1.99 -0.26 -0.54 0.00 0.00 174.62 176.05 2j27 h PHE 45 N -1.98 0.71 -0.26 3.99 0.04 -1.95 -2.21 116.94 115.27 2j27 h PHE 45 Ca -0.50 0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.25 2j27 h PHE 45 Cb 1.29 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 39.19 2j27 h PHE 45 CO 0.42 0.40 -0.03 0.28 -0.60 0.00 0.00 178.31 178.78 2j27 h VAL 46 N 0.72 1.18 -0.02 -0.55 2.07 -2.03 -2.92 116.25 114.69 2j27 h VAL 46 Ca 0.27 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2j27 h VAL 46 Cb 0.17 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2j27 h VAL 46 CO -0.08 0.24 -0.03 1.41 0.02 0.00 0.00 177.57 179.13 2j27 n HIS 47 N -4.30 0.00 -0.36 1.57 8.25 -0.84 -4.25 115.22 115.28 2j27 n HIS 47 Ca 0.01 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.44 2j27 n HIS 47 Cb 0.23 -0.01 0.10 0.00 1.12 0.00 0.00 29.99 31.44 2j27 n HIS 47 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2j27 h LEU 48 N 2.54 1.14 -0.60 2.41 3.38 -1.40 -1.44 115.31 121.35 2j27 h LEU 48 Ca 0.00 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2j27 h LEU 48 Cb 0.56 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 2j27 h LEU 48 CO 0.00 0.85 0.39 0.00 0.09 0.00 0.00 178.44 179.77 2j27 h ALA 49 N 1.34 0.76 -0.40 1.53 0.00 -1.80 0.23 119.26 120.93 2j27 h ALA 49 Ca 0.35 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 2j27 h ALA 49 Cb -0.11 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 2j27 h ALA 49 CO -0.07 0.17 0.11 1.98 0.00 0.00 0.00 179.25 181.44 2j27 h MET 50 N 0.79 0.62 -0.41 0.00 1.85 -1.78 -1.91 114.93 114.09 2j27 h MET 50 Ca 0.22 -0.14 -0.13 0.00 -0.61 0.00 0.00 59.70 59.04 2j27 h MET 50 Cb -0.07 -0.09 -0.01 0.00 0.43 0.00 0.00 31.60 31.86 2j27 h MET 50 CO -0.06 0.63 -0.28 0.00 -0.40 0.00 0.00 176.91 176.81 2j27 h THR 51 N 0.49 1.27 -0.59 -0.77 1.03 -0.94 0.36 112.91 113.76 2j27 h THR 51 Ca 0.13 -1.43 0.05 0.00 -0.01 0.00 0.00 66.41 65.14 2j27 h THR 51 Cb 0.28 1.25 -0.05 0.00 -1.07 0.00 0.00 68.15 68.56 2j27 h THR 51 CO -0.00 0.48 0.31 0.50 -0.01 0.00 0.00 175.52 176.81 2j27 h LYS 52 N 0.75 0.58 -0.32 0.00 3.64 -0.88 -0.56 116.57 119.78 2j27 h LYS 52 Ca 0.09 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.30 2j27 h LYS 52 Cb 0.84 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.52 2j27 h LYS 52 CO 0.07 0.38 -0.32 1.49 -2.27 0.00 0.00 179.45 178.80 2j27 h GLU 53 N 0.60 0.78 0.01 1.90 4.57 -0.98 -3.38 114.58 118.07 2j27 h GLU 53 Ca 0.26 -0.41 -0.33 0.00 -1.18 0.00 0.00 59.36 57.70 2j27 h GLU 53 Cb 0.16 0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.71 2j27 h GLU 53 CO -0.17 1.04 -1.98 0.54 -1.18 0.00 0.00 179.01 177.26 2j27 n ARG 54 N -4.20 0.66 -2.30 1.92 5.12 0.08 -4.88 116.66 113.06 2j27 n ARG 54 Ca -0.03 0.19 -0.42 0.00 -1.93 0.00 0.00 57.85 55.65 2j27 n ARG 54 Cb 0.50 -1.69 -0.03 0.00 -1.16 0.00 0.00 32.46 30.08 2j27 n ARG 54 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2j27 s LEU 55 N -5.98 4.29 0.00 0.55 2.96 -0.24 -4.87 118.68 115.39 2j27 s LEU 55 Ca -0.09 1.98 0.00 0.00 -0.22 0.00 0.00 54.13 55.81 2j27 s LEU 55 Cb 0.07 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.21 2j27 s LEU 55 CO 0.81 -0.70 0.26 -1.54 -1.32 0.00 0.00 176.35 173.86 2j27 n SER 56 N 5.61 0.52 -4.70 3.68 3.41 -1.26 -4.92 113.62 115.96 2j27 n SER 56 Ca 0.13 -0.99 -0.42 0.00 -0.26 0.00 0.00 58.87 57.33 2j27 n SER 56 Cb 0.44 0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.37 2j27 n SER 56 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2j27 s HIS 57 N -0.01 2.92 0.58 7.33 5.04 -1.26 -4.88 115.29 125.02 2j27 s HIS 57 Ca 0.00 0.74 0.42 0.00 -1.54 0.00 0.00 55.06 54.68 2j27 s HIS 57 Cb 0.00 -3.77 2.25 0.00 0.04 0.00 0.00 32.58 31.11 2j27 s HIS 57 CO 0.00 -2.85 2.31 -1.00 -2.34 0.00 0.00 174.74 170.87 2j27 h PRO 58 N 7.45 0.00 -0.17 2.88 0.13 -1.97 -1.99 132.00 138.33 2j27 h PRO 58 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2j27 h PRO 58 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2j27 h PRO 58 CO 0.90 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.30 2j27 n LYS 59 N -3.13 1.80 -4.57 0.86 5.02 -1.26 -4.90 118.16 111.97 2j27 n LYS 59 Ca -0.02 -1.20 -0.32 0.00 -2.02 0.00 0.00 58.31 54.75 2j27 n LYS 59 Cb 0.11 -1.41 -0.11 0.00 -0.02 0.00 0.00 35.03 33.59 2j27 n LYS 59 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2j27 s PHE 60 N -1.79 2.80 0.16 2.13 0.40 -0.75 -0.60 117.98 120.32 2j27 s PHE 60 Ca 0.33 -0.10 0.06 0.00 -0.60 0.00 0.00 56.93 56.62 2j27 s PHE 60 Cb 0.18 -1.59 -0.04 0.00 0.51 0.00 0.00 43.02 42.08 2j27 s PHE 60 CO 0.27 0.32 -0.12 0.14 0.70 0.00 0.00 175.22 176.53 2j27 s VAL 61 N -0.93 1.39 0.24 -0.44 -7.23 -0.37 -4.86 120.40 108.18 2j27 s VAL 61 Ca 0.16 -2.02 -0.03 0.00 -1.81 0.00 0.00 61.98 58.27 2j27 s VAL 61 Cb -0.11 -1.83 -0.05 0.00 0.56 0.00 0.00 36.38 34.96 2j27 s VAL 61 CO 0.06 -0.62 0.47 -0.63 -0.31 0.00 0.00 175.10 174.07 2j27 s ILE 62 N -2.91 5.11 0.03 -0.62 1.01 -1.26 -0.75 121.20 121.81 2j27 s ILE 62 Ca 0.16 -0.11 -0.06 0.00 0.00 0.00 0.00 60.65 60.65 2j27 s ILE 62 Cb -0.00 -3.72 -0.01 0.00 0.01 0.00 0.00 42.46 38.74 2j27 s ILE 62 CO 0.03 -0.22 0.10 0.00 0.00 0.00 0.00 174.94 174.85 2j27 s ALA 63 N -1.95 -0.12 0.39 9.38 0.00 -0.11 -3.73 121.76 125.64 2j27 s ALA 63 Ca 0.41 -0.46 -0.02 0.00 0.00 0.00 0.00 51.96 51.90 2j27 s ALA 63 Cb -0.11 0.22 -0.03 0.00 0.00 0.00 0.00 23.12 23.19 2j27 s ALA 63 CO 0.29 -0.29 0.63 0.00 0.00 0.00 0.00 175.76 176.39 2j27 s ALA 64 N -2.30 3.59 -1.53 0.00 0.00 -0.77 -2.79 121.76 117.96 2j27 s ALA 64 Ca -0.08 -0.76 0.23 0.00 0.00 0.00 0.00 51.96 51.35 2j27 s ALA 64 Cb -0.03 -2.28 0.04 0.00 0.00 0.00 0.00 23.12 20.85 2j27 s ALA 64 CO -0.03 -0.13 1.10 1.04 0.00 0.00 0.00 175.76 177.74 2j27 n GLN 65 N -1.93 0.62 -3.62 0.00 6.02 -1.26 -0.70 117.38 116.52 2j27 n GLN 65 Ca -0.03 -0.49 -0.01 0.00 -0.01 0.00 0.00 57.00 56.46 2j27 n GLN 65 Cb 0.56 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 30.32 2j27 n GLN 65 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2j27 s ASN 66 N -2.72 -0.10 0.12 1.08 2.47 -1.20 -4.63 114.94 109.96 2j27 s ASN 66 Ca 0.15 -0.10 -0.26 0.00 0.42 0.00 0.00 52.86 53.07 2j27 s ASN 66 Cb 0.17 0.18 0.07 0.00 -1.45 0.00 0.00 41.25 40.23 2j27 s ASN 66 CO 0.69 -0.32 0.94 0.00 -3.72 0.00 0.00 177.10 174.69 2j27 s ALA 67 N -2.49 -1.69 0.33 1.71 0.00 -1.26 -4.95 121.76 113.41 2j27 s ALA 67 Ca 0.12 0.33 0.08 0.00 0.00 0.00 0.00 51.96 52.48 2j27 s ALA 67 Cb 0.02 0.59 -0.03 0.00 0.00 0.00 0.00 23.12 23.70 2j27 s ALA 67 CO -0.04 -0.96 0.24 0.96 0.00 0.00 0.00 175.76 175.96 2j27 s ILE 68 N -3.25 3.46 0.12 0.00 -4.36 -0.21 -4.97 121.20 111.99 2j27 s ILE 68 Ca 0.11 -1.47 -0.13 0.00 -0.26 0.00 0.00 60.65 58.90 2j27 s ILE 68 Cb -0.01 -3.14 -0.07 0.00 1.25 0.00 0.00 42.46 40.49 2j27 s ILE 68 CO -0.00 -0.19 1.44 0.00 0.24 0.00 0.00 174.94 176.42 2j27 h ALA 69 N 1.36 0.49 -3.27 2.27 0.00 -1.94 -1.10 119.26 117.06 2j27 h ALA 69 Ca -0.45 -0.45 -0.38 0.00 0.00 0.00 0.00 54.91 53.64 2j27 h ALA 69 Cb 1.25 -0.10 -0.21 0.00 0.00 0.00 0.00 17.79 18.73 2j27 h ALA 69 CO 0.60 0.58 -0.77 0.15 0.00 0.00 0.00 179.25 179.81 2j27 s LYS 70 N -4.32 0.78 0.81 0.00 1.02 -1.26 -3.96 119.74 112.82 2j27 s LYS 70 Ca -0.12 -0.96 -0.11 0.00 0.02 0.00 0.00 55.97 54.81 2j27 s LYS 70 Cb 0.10 -0.71 0.08 0.00 -0.52 0.00 0.00 37.83 36.78 2j27 s LYS 70 CO 0.86 0.15 1.09 -1.12 -0.92 0.00 0.00 175.35 175.41 2j27 s SER 71 N -1.82 4.16 0.00 2.83 0.01 -1.26 -4.73 113.70 112.88 2j27 s SER 71 Ca -0.02 1.72 0.00 0.00 1.31 0.00 0.00 55.95 58.95 2j27 s SER 71 Cb -0.09 -2.41 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2j27 s SER 71 CO 0.02 -2.24 0.00 0.61 0.41 0.00 0.00 173.24 172.04 2j27 n GLY 72 N -1.18 0.47 2.85 3.44 0.00 -1.26 -5.00 105.19 104.52 2j27 n GLY 72 Ca 0.08 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 2j27 n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j27 n ALA 73 N -0.76 5.33 -3.24 4.61 0.00 -1.26 -4.69 120.51 120.51 2j27 n ALA 73 Ca 0.00 -4.12 -0.24 0.00 0.00 0.00 0.00 53.44 49.08 2j27 n ALA 73 Cb 0.00 -3.24 -0.07 0.00 0.00 0.00 0.00 19.45 16.15 2j27 n ALA 73 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2j27 n PHE 74 N 5.00 0.93 -1.67 0.00 3.72 -1.26 -5.10 117.46 119.08 2j27 n PHE 74 Ca 0.45 -3.76 -0.46 0.00 -0.05 0.00 0.00 57.45 53.63 2j27 n PHE 74 Cb 0.38 -0.42 -0.04 0.00 -0.94 0.00 0.00 39.48 38.46 2j27 n PHE 74 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2j27 n THR 75 N 1.08 0.13 0.00 4.37 -1.04 -1.26 -1.55 114.28 116.00 2j27 n THR 75 Ca 0.24 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.22 2j27 n THR 75 Cb 0.51 -1.54 0.00 0.00 -1.82 0.00 0.00 70.33 67.48 2j27 n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2j27 n GLY 76 N 3.25 3.39 3.96 3.41 0.00 -1.26 -5.05 105.19 112.88 2j27 n GLY 76 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 2j27 n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j27 s GLU 77 N -0.81 3.39 -0.07 1.61 0.41 -0.60 -5.11 118.70 117.52 2j27 s GLU 77 Ca 0.00 -0.54 0.04 0.00 -0.41 0.00 0.00 54.97 54.07 2j27 s GLU 77 Cb 0.00 -2.73 -0.02 0.00 -1.78 0.00 0.00 34.13 29.60 2j27 s GLU 77 CO 0.00 0.17 -0.19 0.08 -0.49 0.00 0.00 175.26 174.83 2j27 s VAL 78 N -2.23 2.57 0.33 2.63 1.01 -1.26 -5.00 120.40 118.44 2j27 s VAL 78 Ca 0.40 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.56 2j27 s VAL 78 Cb -0.09 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 2j27 s VAL 78 CO 0.34 0.57 0.40 -0.94 0.00 0.00 0.00 175.10 175.47 2j27 s SER 79 N -0.28 5.79 0.16 3.32 1.04 -1.26 -1.05 113.70 121.42 2j27 s SER 79 Ca 0.01 -0.26 -0.15 0.00 0.48 0.00 0.00 55.95 56.03 2j27 s SER 79 Cb -0.13 -1.21 0.06 0.00 0.10 0.00 0.00 66.02 64.84 2j27 s SER 79 CO 0.03 -0.37 1.80 -0.07 0.98 0.00 0.00 173.24 175.60 2j27 h LEU 80 N 1.03 0.40 -1.10 2.42 3.38 -1.32 -2.01 115.31 118.11 2j27 h LEU 80 Ca -0.46 0.01 0.05 0.00 0.09 0.00 0.00 57.88 57.57 2j27 h LEU 80 Cb 1.25 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.87 2j27 h LEU 80 CO 0.55 0.28 0.61 -0.65 0.09 0.00 0.00 178.44 179.33 2j27 h PRO 81 N 0.50 1.09 -0.53 1.13 0.11 -1.87 0.08 132.00 132.51 2j27 h PRO 81 Ca 0.17 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 66.16 2j27 h PRO 81 Cb 0.02 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 30.86 2j27 h PRO 81 CO -0.08 0.72 0.10 0.82 -0.21 0.00 0.00 178.00 179.35 2j27 h ILE 82 N 1.12 1.25 -0.63 4.15 2.04 -1.85 -0.52 117.51 123.07 2j27 h ILE 82 Ca 0.39 -0.93 -0.06 0.00 1.00 0.00 0.00 64.86 65.26 2j27 h ILE 82 Cb 0.11 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 2j27 h ILE 82 CO -0.14 0.34 0.15 -0.07 0.00 0.00 0.00 178.15 178.43 2j27 h LEU 83 N 0.76 0.96 -0.30 1.44 3.38 -0.90 -1.51 115.31 119.13 2j27 h LEU 83 Ca 0.16 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2j27 h LEU 83 Cb 0.39 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2j27 h LEU 83 CO 0.01 0.95 0.15 0.50 0.09 0.00 0.00 178.44 180.13 2j27 h LYS 84 N 0.93 0.43 -0.15 1.13 3.64 -0.80 -1.15 116.57 120.61 2j27 h LYS 84 Ca 0.20 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 2j27 h LYS 84 Cb 0.36 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 2j27 h LYS 84 CO 0.00 0.40 0.10 0.22 -2.27 0.00 0.00 179.45 177.90 2j27 h ASP 85 N 0.35 0.16 0.15 4.20 3.58 -0.94 -1.67 116.42 122.24 2j27 h ASP 85 Ca 0.10 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.55 2j27 h ASP 85 Cb 0.11 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.12 2j27 h ASP 85 CO -0.01 0.11 -0.04 0.33 -2.88 0.00 0.00 179.24 176.75 2j27 n PHE 86 N -4.52 0.00 -0.76 0.28 7.35 -0.55 -4.91 117.46 114.35 2j27 n PHE 86 Ca -0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.68 2j27 n PHE 86 Cb 0.09 -0.08 0.00 0.00 0.35 0.00 0.00 39.48 39.84 2j27 n PHE 86 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2j27 n GLY 87 N 1.16 0.54 3.65 7.13 0.00 -0.63 -5.04 105.19 112.00 2j27 n GLY 87 Ca 0.19 -0.74 -0.37 0.00 0.00 0.00 0.00 46.02 45.09 2j27 n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j27 s VAL 88 N -2.00 5.33 -0.20 1.61 1.01 -0.54 -4.96 120.40 120.65 2j27 s VAL 88 Ca 0.00 0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.24 2j27 s VAL 88 Cb 0.00 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.85 2j27 s VAL 88 CO 0.00 0.31 0.43 -3.20 0.00 0.00 0.00 175.10 172.64 2j27 n ASN 89 N 4.47 0.87 -4.42 3.32 4.05 -1.26 -4.10 115.26 118.18 2j27 n ASN 89 Ca -0.14 -0.94 -0.29 0.00 0.45 0.00 0.00 54.58 53.66 2j27 n ASN 89 Cb 0.52 0.27 -0.13 0.00 1.23 0.00 0.00 39.78 41.67 2j27 n ASN 89 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2j27 s TRP 90 N -0.43 2.40 -0.13 1.20 0.52 -1.24 -0.86 118.94 120.39 2j27 s TRP 90 Ca 0.02 -0.34 -0.15 0.00 0.02 0.00 0.00 56.10 55.65 2j27 s TRP 90 Cb 0.02 -1.32 0.04 0.00 -1.15 0.00 0.00 33.47 31.06 2j27 s TRP 90 CO 0.04 0.32 0.41 -1.50 0.02 0.00 0.00 176.95 176.23 2j27 s ILE 91 N -1.04 0.01 -0.15 2.03 2.07 -0.61 -1.85 121.20 121.65 2j27 s ILE 91 Ca 0.15 -0.06 -0.15 0.00 -1.41 0.00 0.00 60.65 59.17 2j27 s ILE 91 Cb -0.10 -0.59 -0.04 0.00 0.13 0.00 0.00 42.46 41.85 2j27 s ILE 91 CO 0.07 -0.03 0.36 -0.69 -1.91 0.00 0.00 174.94 172.73 2j27 s VAL 92 N -0.02 5.26 0.04 4.00 1.01 0.13 -0.65 120.40 130.16 2j27 s VAL 92 Ca -0.02 0.70 0.02 0.00 0.00 0.00 0.00 61.98 62.68 2j27 s VAL 92 Cb -0.03 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 2j27 s VAL 92 CO 0.01 0.36 -0.08 -0.76 0.00 0.00 0.00 175.10 174.63 2j27 s LEU 93 N 0.55 2.21 -0.84 3.92 1.43 -0.13 -3.27 118.68 122.55 2j27 s LEU 93 Ca 0.20 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 2j27 s LEU 93 Cb -0.14 -0.24 0.00 0.00 0.03 0.00 0.00 46.19 45.85 2j27 s LEU 93 CO 0.06 -0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.12 2j27 n GLY 94 N 1.74 0.99 3.57 -3.19 0.00 -1.26 -1.05 105.19 105.99 2j27 n GLY 94 Ca -0.21 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.72 2j27 n GLY 94 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2j27 n HIS 95 N -2.76 0.85 -0.32 1.61 -0.00 -1.26 -4.41 115.22 108.93 2j27 n HIS 95 Ca -0.08 0.62 0.23 0.00 0.46 0.00 0.00 57.72 58.95 2j27 n HIS 95 Cb 0.26 -2.18 0.53 0.00 -0.12 0.00 0.00 29.99 28.48 2j27 n HIS 95 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 2j27 h SER 96 N 1.51 0.41 0.20 0.26 0.87 -1.93 0.92 113.55 115.79 2j27 h SER 96 Ca -0.42 0.07 -0.09 0.00 -1.23 0.00 0.00 61.79 60.12 2j27 h SER 96 Cb 1.35 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 63.31 2j27 h SER 96 CO 0.57 0.08 -0.35 -0.33 -0.53 0.00 0.00 176.83 176.27 2j27 h GLU 97 N 0.36 0.22 0.08 2.24 5.08 -1.99 0.28 114.58 120.86 2j27 h GLU 97 Ca 0.58 -0.09 -0.25 0.00 -1.00 0.00 0.00 59.36 58.60 2j27 h GLU 97 Cb 1.54 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.78 2j27 h GLU 97 CO -0.27 0.55 -1.12 0.00 -1.00 0.00 0.00 179.01 177.17 2j27 h ARG 98 N 0.19 0.29 -0.76 2.33 3.08 -1.18 0.12 114.38 118.46 2j27 h ARG 98 Ca 0.02 -0.42 -0.03 0.00 0.07 0.00 0.00 59.98 59.63 2j27 h ARG 98 Cb 0.71 0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.87 2j27 h ARG 98 CO 0.05 1.16 0.37 0.00 -1.07 0.00 0.00 179.97 180.47 2j27 h ARG 99 N 0.11 1.08 0.10 0.04 3.08 -1.07 -1.44 114.38 116.29 2j27 h ARG 99 Ca -0.11 -0.15 -0.15 0.00 0.07 0.00 0.00 59.98 59.64 2j27 h ARG 99 Cb 1.81 -0.20 0.02 0.00 0.08 0.00 0.00 29.97 31.68 2j27 h ARG 99 CO 0.18 0.83 -0.67 0.00 -1.07 0.00 0.00 179.97 179.25 2j27 h ALA 100 N 1.32 -0.06 0.00 0.04 0.00 -0.86 -3.36 119.26 116.35 2j27 h ALA 100 Ca 0.26 -0.65 -0.24 0.00 0.00 0.00 0.00 54.91 54.29 2j27 h ALA 100 Cb 0.11 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2j27 h ALA 100 CO -0.03 0.31 -2.18 0.66 0.00 0.00 0.00 179.25 178.01 2j27 n TYR 101 N -4.21 0.00 -1.57 0.00 4.01 0.41 -4.65 117.16 111.16 2j27 n TYR 101 Ca -0.13 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.68 2j27 n TYR 101 Cb 0.75 -0.79 0.18 0.00 -0.31 0.00 0.00 39.34 39.17 2j27 n TYR 101 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2j27 n TYR 102 N -2.55 0.00 -1.10 -0.72 4.01 -0.56 -4.99 117.16 111.24 2j27 n TYR 102 Ca -0.22 -1.31 -0.03 0.00 -0.16 0.00 0.00 57.90 56.18 2j27 n TYR 102 Cb 0.93 -0.22 -0.01 0.00 -0.31 0.00 0.00 39.34 39.73 2j27 n TYR 102 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2j27 n GLY 103 N -1.05 0.64 3.44 2.72 0.00 -1.16 -4.91 105.19 104.87 2j27 n GLY 103 Ca 0.17 -0.45 -0.44 0.00 0.00 0.00 0.00 46.02 45.31 2j27 n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j27 s GLU 104 N -1.68 3.23 1.00 1.61 2.02 -1.08 -4.95 118.70 118.85 2j27 s GLU 104 Ca 0.00 -1.16 -0.13 0.00 0.02 0.00 0.00 54.97 53.70 2j27 s GLU 104 Cb 0.00 -4.42 0.19 0.00 0.10 0.00 0.00 34.13 30.00 2j27 s GLU 104 CO 0.00 -1.76 1.11 0.95 0.02 0.00 0.00 175.26 175.58 2j27 s THR 105 N 3.48 1.96 0.31 3.63 -4.23 -1.26 -4.26 115.64 115.27 2j27 s THR 105 Ca 0.23 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.78 2j27 s THR 105 Cb -0.15 -2.57 0.30 0.00 1.34 0.00 0.00 72.50 71.41 2j27 s THR 105 CO 0.04 0.00 1.86 0.78 -0.54 0.00 0.00 174.62 176.76 2j27 h ASN 106 N -1.88 0.83 -0.04 3.99 2.35 -1.96 -0.94 115.58 117.92 2j27 h ASN 106 Ca -0.53 0.04 -0.24 0.00 -0.55 0.00 0.00 56.30 55.02 2j27 h ASN 106 Cb 1.33 -0.13 0.02 0.00 0.05 0.00 0.00 38.32 39.59 2j27 h ASN 106 CO 0.56 0.45 -0.93 -0.33 -1.65 0.00 0.00 177.43 175.53 2j27 h GLU 107 N 0.89 0.70 -0.64 0.81 3.07 -1.93 -1.19 114.58 116.29 2j27 h GLU 107 Ca 0.47 -0.70 -0.07 0.00 -0.50 0.00 0.00 59.36 58.56 2j27 h GLU 107 Cb 0.53 0.19 -0.03 0.00 -0.84 0.00 0.00 28.75 28.60 2j27 h GLU 107 CO -0.23 1.29 0.14 0.82 -1.40 0.00 0.00 179.01 179.63 2j27 h ILE 108 N 0.39 1.26 -0.68 3.13 2.04 -1.77 -0.48 117.51 121.39 2j27 h ILE 108 Ca -0.10 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 64.78 2j27 h ILE 108 Cb 1.58 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 38.28 2j27 h ILE 108 CO 0.19 0.37 0.42 0.58 0.00 0.00 0.00 178.15 179.71 2j27 h VAL 109 N 0.97 1.19 -0.82 1.67 2.07 -1.14 -1.47 116.25 118.71 2j27 h VAL 109 Ca 0.20 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 2j27 h VAL 109 Cb 0.39 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 2j27 h VAL 109 CO 0.01 0.19 0.39 0.00 0.02 0.00 0.00 177.57 178.18 2j27 h ALA 110 N 1.23 1.06 -0.16 1.67 0.00 -0.88 -0.19 119.26 121.99 2j27 h ALA 110 Ca 0.25 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 2j27 h ALA 110 Cb -0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 2j27 h ALA 110 CO -0.05 0.62 -0.56 -0.44 0.00 0.00 0.00 179.25 178.82 2j27 h ASP 111 N 1.16 0.54 -0.29 0.00 3.32 -0.78 -1.26 116.42 119.11 2j27 h ASP 111 Ca 0.28 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 2j27 h ASP 111 Cb 0.12 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 2j27 h ASP 111 CO -0.04 0.99 0.08 0.11 -1.72 0.00 0.00 179.24 178.67 2j27 h LYS 112 N 0.37 0.45 -0.35 3.56 1.57 -0.77 -1.38 116.57 120.01 2j27 h LYS 112 Ca 0.00 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2j27 h LYS 112 Cb 1.10 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.31 2j27 h LYS 112 CO 0.10 0.52 0.15 0.28 -0.57 0.00 0.00 179.45 179.93 2j27 h VAL 113 N 0.30 0.95 -0.63 0.50 2.07 -0.93 -0.03 116.25 118.48 2j27 h VAL 113 Ca 0.09 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.45 2j27 h VAL 113 Cb 0.26 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 2j27 h VAL 113 CO -0.00 0.06 0.17 0.00 0.02 0.00 0.00 177.57 177.82 2j27 h ALA 114 N 1.20 1.12 -0.57 1.67 0.00 -1.13 -0.37 119.26 121.17 2j27 h ALA 114 Ca 0.15 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2j27 h ALA 114 Cb 0.09 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2j27 h ALA 114 CO -0.13 0.60 0.02 0.00 0.00 0.00 0.00 179.25 179.74 2j27 h ALA 115 N 1.25 0.77 -0.38 0.00 0.00 -0.83 0.12 119.26 120.19 2j27 h ALA 115 Ca 0.20 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 2j27 h ALA 115 Cb 0.30 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2j27 h ALA 115 CO -0.00 0.58 0.05 0.00 0.00 0.00 0.00 179.25 179.88 2j27 h ALA 116 N 0.98 0.50 -0.64 0.00 0.00 -0.59 -0.69 119.26 118.83 2j27 h ALA 116 Ca 0.17 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2j27 h ALA 116 Cb 0.51 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2j27 h ALA 116 CO 0.02 0.22 0.36 0.28 0.00 0.00 0.00 179.25 180.14 2j27 h VAL 117 N 0.47 1.20 -0.05 0.00 2.07 -0.88 -1.79 116.25 117.27 2j27 h VAL 117 Ca 0.11 -0.48 -0.04 0.00 0.82 0.00 0.00 66.70 67.12 2j27 h VAL 117 Cb 0.38 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2j27 h VAL 117 CO 0.01 0.21 -0.16 0.00 0.02 0.00 0.00 177.57 177.65 2j27 h ALA 118 N 1.18 1.64 -0.08 1.67 0.00 -0.65 -1.27 119.26 121.76 2j27 h ALA 118 Ca 0.23 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2j27 h ALA 118 Cb 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2j27 h ALA 118 CO -0.04 0.27 0.00 0.45 0.00 0.00 0.00 179.25 179.93 2j27 n SER 119 N -4.31 0.58 0.00 0.00 2.88 -0.29 -4.91 113.62 107.57 2j27 n SER 119 Ca -0.02 -1.67 0.00 0.00 -1.33 0.00 0.00 58.87 55.85 2j27 n SER 119 Cb 0.25 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.66 2j27 n SER 119 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2j27 n GLY 120 N 0.83 0.73 3.83 0.46 0.00 -0.48 -5.05 105.19 105.51 2j27 n GLY 120 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 2j27 n GLY 120 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2j27 s PHE 121 N -2.45 3.27 -0.03 1.61 0.40 -0.74 -5.02 117.98 115.02 2j27 s PHE 121 Ca 0.00 1.48 -0.23 0.00 -0.60 0.00 0.00 56.93 57.57 2j27 s PHE 121 Cb 0.00 -2.88 -0.04 0.00 0.51 0.00 0.00 43.02 40.61 2j27 s PHE 121 CO 0.00 -0.69 0.70 -1.64 0.70 0.00 0.00 175.22 174.29 2j27 s MET 122 N -4.13 4.43 -0.10 0.44 -1.94 -0.04 -4.50 119.30 113.45 2j27 s MET 122 Ca 0.61 0.89 0.02 0.00 -1.71 0.00 0.00 55.69 55.50 2j27 s MET 122 Cb -0.12 -3.41 0.01 0.00 2.01 0.00 0.00 34.83 33.32 2j27 s MET 122 CO 0.35 0.16 -0.18 0.08 -0.01 0.00 0.00 175.02 175.42 2j27 s VAL 123 N 0.45 1.65 -0.54 -6.03 1.01 -0.19 -1.58 120.40 115.17 2j27 s VAL 123 Ca 0.37 -0.75 -0.18 0.00 0.00 0.00 0.00 61.98 61.41 2j27 s VAL 123 Cb -0.18 -1.48 0.09 0.00 0.00 0.00 0.00 36.38 34.81 2j27 s VAL 123 CO 0.19 0.47 0.61 -0.63 0.00 0.00 0.00 175.10 175.74 2j27 s ILE 124 N 0.76 4.96 -0.23 2.22 1.01 0.17 -0.35 121.20 129.74 2j27 s ILE 124 Ca -0.11 -0.94 -0.14 0.00 0.00 0.00 0.00 60.65 59.46 2j27 s ILE 124 Cb -0.16 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 37.91 2j27 s ILE 124 CO 0.02 -0.92 0.30 0.00 0.00 0.00 0.00 174.94 174.34 2j27 s ALA 125 N 2.35 3.57 -0.11 9.38 0.00 0.65 -0.95 121.76 136.66 2j27 s ALA 125 Ca 0.10 -0.74 -0.06 0.00 0.00 0.00 0.00 51.96 51.26 2j27 s ALA 125 Cb -0.24 -2.54 -0.04 0.00 0.00 0.00 0.00 23.12 20.31 2j27 s ALA 125 CO 0.07 -0.36 0.11 0.00 0.00 0.00 0.00 175.76 175.59 2j27 s ILE 127 N -1.01 0.28 0.00 0.00 -4.36 -0.31 -4.63 121.20 111.16 2j27 s ILE 127 Ca 0.15 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.54 2j27 s ILE 127 Cb -0.12 -2.55 0.00 0.00 1.25 0.00 0.00 42.46 41.04 2j27 s ILE 127 CO 0.04 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.83 2j27 n GLY 128 N -0.43 3.89 3.84 6.27 0.00 -1.26 -0.50 105.19 116.99 2j27 n GLY 128 Ca 0.01 -1.04 -0.27 0.00 0.00 0.00 0.00 46.02 44.72 2j27 n GLY 128 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2j27 s GLU 129 N -2.65 3.06 0.80 1.61 1.03 -1.25 -4.86 118.70 116.44 2j27 s GLU 129 Ca 0.00 -0.76 -0.10 0.00 0.03 0.00 0.00 54.97 54.13 2j27 s GLU 129 Cb 0.00 -2.75 0.10 0.00 -0.80 0.00 0.00 34.13 30.68 2j27 s GLU 129 CO 0.00 0.51 1.14 0.95 -1.33 0.00 0.00 175.26 176.53 2j27 s THR 130 N -1.70 2.10 0.18 1.83 -4.23 -1.26 -2.28 115.64 110.27 2j27 s THR 130 Ca 0.32 -0.12 -0.13 0.00 -1.18 0.00 0.00 61.69 60.58 2j27 s THR 130 Cb -0.11 -2.98 0.08 0.00 1.34 0.00 0.00 72.50 70.84 2j27 s THR 130 CO 0.25 0.00 1.74 0.25 -0.54 0.00 0.00 174.62 176.32 2j27 h LEU 131 N -0.99 0.14 -0.94 4.79 5.85 -1.93 0.47 115.31 122.69 2j27 h LEU 131 Ca -0.45 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 2j27 h LEU 131 Cb 1.30 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.35 2j27 h LEU 131 CO 0.58 0.11 0.34 -0.61 -0.34 0.00 0.00 178.44 178.52 2j27 h GLN 132 N 0.32 1.10 -0.41 1.25 -0.00 -1.99 0.19 115.11 115.57 2j27 h GLN 132 Ca 0.23 -0.17 -0.06 0.00 -0.00 0.00 0.00 58.65 58.65 2j27 h GLN 132 Cb 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 27.48 27.52 2j27 h GLN 132 CO -0.24 0.86 0.01 0.93 0.00 0.00 0.00 178.83 180.39 2j27 h GLU 133 N 1.09 0.71 0.08 1.69 5.08 -1.77 -1.65 114.58 119.81 2j27 h GLU 133 Ca 0.26 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2j27 h GLU 133 Cb 0.15 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2j27 h GLU 133 CO -0.03 0.79 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.65 2j27 h ARG 134 N 0.55 -0.10 -0.02 2.33 9.65 -0.49 -0.10 114.38 126.20 2j27 h ARG 134 Ca 0.12 0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.00 2j27 h ARG 134 Cb 0.46 0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 29.07 2j27 h ARG 134 CO 0.02 0.02 -0.01 0.93 2.80 0.00 0.00 179.97 183.73 2j27 h GLU 135 N -0.21 0.02 -0.00 0.20 5.08 -0.90 -1.32 114.58 117.46 2j27 h GLU 135 Ca -0.01 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2j27 h GLU 135 Cb 0.17 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2j27 h GLU 135 CO 0.02 0.04 -0.04 0.43 -1.00 0.00 0.00 179.01 178.46 2j27 n SER 136 N -4.51 0.07 -0.03 1.42 7.64 -0.63 -4.92 113.62 112.67 2j27 n SER 136 Ca -0.03 0.07 -0.00 0.00 1.01 0.00 0.00 58.87 59.92 2j27 n SER 136 Cb 0.11 -0.32 -0.00 0.00 -1.01 0.00 0.00 64.21 62.98 2j27 n SER 136 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2j27 n GLY 137 N 1.38 0.41 1.22 0.23 0.00 -0.50 -4.96 105.19 102.97 2j27 n GLY 137 Ca 0.11 -1.07 0.08 0.00 0.00 0.00 0.00 46.02 45.14 2j27 n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j27 n ARG 138 N -2.93 3.52 -0.15 1.61 1.74 -0.07 -4.58 116.66 115.80 2j27 n ARG 138 Ca -0.00 -2.81 -0.04 0.00 -0.77 0.00 0.00 57.85 54.23 2j27 n ARG 138 Cb 0.03 -1.86 0.03 0.00 -1.02 0.00 0.00 32.46 29.64 2j27 n ARG 138 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 2j27 h THR 139 N 2.81 0.49 -0.02 0.55 2.02 -1.85 -0.82 112.91 116.10 2j27 h THR 139 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 2j27 h THR 139 Cb 1.46 0.49 -0.00 0.00 -1.74 0.00 0.00 68.15 68.35 2j27 h THR 139 CO 0.25 0.00 0.00 0.00 0.37 0.00 0.00 175.52 176.14 2j27 h ALA 140 N 1.42 0.03 -0.45 6.16 0.00 -1.95 -1.09 119.26 123.37 2j27 h ALA 140 Ca 0.23 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2j27 h ALA 140 Cb 0.37 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2j27 h ALA 140 CO -0.50 -0.36 -0.01 -0.24 0.00 0.00 0.00 179.25 178.15 2j27 h VAL 141 N -0.19 1.24 0.16 0.00 3.04 -1.84 -0.88 116.25 117.77 2j27 h VAL 141 Ca 0.01 -0.98 -0.01 0.00 -1.01 0.00 0.00 66.70 64.71 2j27 h VAL 141 Cb 0.23 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 30.41 2j27 h VAL 141 CO 0.00 0.34 -0.08 0.58 -1.01 0.00 0.00 177.57 177.41 2j27 h VAL 142 N 0.70 0.97 -0.28 1.51 2.07 -1.00 -1.50 116.25 118.73 2j27 h VAL 142 Ca 0.14 -0.64 -0.14 0.00 0.82 0.00 0.00 66.70 66.88 2j27 h VAL 142 Cb 0.44 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 2j27 h VAL 142 CO 0.02 0.15 -0.38 0.58 0.02 0.00 0.00 177.57 177.95 2j27 h VAL 143 N -0.53 1.29 -0.16 2.57 2.07 -1.11 -0.92 116.25 119.46 2j27 h VAL 143 Ca -0.02 -1.55 -0.14 0.00 0.82 0.00 0.00 66.70 65.81 2j27 h VAL 143 Cb 0.41 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 2j27 h VAL 143 CO 0.04 0.49 -0.50 -0.07 0.02 0.00 0.00 177.57 177.55 2j27 h LEU 144 N 0.53 0.46 -0.73 2.57 3.38 -1.19 -2.16 115.31 118.17 2j27 h LEU 144 Ca 0.05 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.68 2j27 h LEU 144 Cb 0.90 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2j27 h LEU 144 CO 0.08 0.88 -0.28 0.74 0.09 0.00 0.00 178.44 179.94 2j27 h THR 145 N 0.33 1.28 -0.30 0.22 2.02 -0.98 -0.48 112.91 115.00 2j27 h THR 145 Ca 0.02 -1.39 -0.01 0.00 0.77 0.00 0.00 66.41 65.79 2j27 h THR 145 Cb 0.99 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.72 2j27 h THR 145 CO 0.09 0.45 0.15 1.56 0.37 0.00 0.00 175.52 178.14 2j27 h GLN 146 N 0.57 0.42 -0.10 6.66 4.20 -0.88 -2.26 115.11 123.72 2j27 h GLN 146 Ca 0.07 -0.05 -0.17 0.00 0.06 0.00 0.00 58.65 58.56 2j27 h GLN 146 Cb 0.77 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 2j27 h GLN 146 CO 0.06 0.38 -0.66 0.97 -0.67 0.00 0.00 178.83 178.91 2j27 h ILE 147 N 0.35 1.36 -0.83 2.54 2.10 -1.32 -2.83 117.51 118.89 2j27 h ILE 147 Ca 0.10 -2.02 0.02 0.00 1.08 0.00 0.00 64.86 64.04 2j27 h ILE 147 Cb 0.09 2.01 -0.04 0.00 -1.09 0.00 0.00 36.82 37.78 2j27 h ILE 147 CO -0.02 0.61 0.55 0.00 -1.08 0.00 0.00 178.15 178.21 2j27 h ALA 148 N 0.99 1.45 -0.38 0.18 0.00 -0.97 0.11 119.26 120.63 2j27 h ALA 148 Ca -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2j27 h ALA 148 Cb 1.22 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2j27 h ALA 148 CO 0.11 0.49 0.15 0.00 0.00 0.00 0.00 179.25 180.01 2j27 h ALA 149 N 1.50 0.50 -0.26 0.00 0.00 -1.23 -1.47 119.26 118.30 2j27 h ALA 149 Ca 0.32 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2j27 h ALA 149 Cb -0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2j27 h ALA 149 CO -0.08 0.10 0.15 0.82 0.00 0.00 0.00 179.25 180.24 2j27 h ILE 150 N 0.47 1.03 -0.08 0.00 2.04 -1.14 -2.99 117.51 116.84 2j27 h ILE 150 Ca 0.13 -0.11 -0.06 0.00 1.00 0.00 0.00 64.86 65.82 2j27 h ILE 150 Cb 0.19 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2j27 h ILE 150 CO -0.01 0.06 -0.23 0.00 0.00 0.00 0.00 178.15 177.96 2j27 h ALA 151 N 1.12 1.47 -0.30 1.87 0.00 -0.55 -2.29 119.26 120.58 2j27 h ALA 151 Ca 0.10 -0.26 0.09 0.00 0.00 0.00 0.00 54.91 54.84 2j27 h ALA 151 Cb 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2j27 h ALA 151 CO -0.05 0.38 0.28 -0.22 0.00 0.00 0.00 179.25 179.64 2j27 h LYS 152 N 0.12 0.00 -0.36 0.00 1.63 -1.11 -2.16 116.57 114.68 2j27 h LYS 152 Ca 0.02 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 2j27 h LYS 152 Cb 0.49 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 2j27 h LYS 152 CO 0.03 0.00 0.00 1.63 -3.45 0.00 0.00 179.45 177.66 2j27 n LYS 153 N -3.98 2.35 -4.39 1.90 4.76 -0.86 -4.96 118.16 112.99 2j27 n LYS 153 Ca 0.04 -2.16 -0.24 0.00 -2.87 0.00 0.00 58.31 53.08 2j27 n LYS 153 Cb 0.43 -1.45 -0.09 0.00 -1.84 0.00 0.00 35.03 32.08 2j27 n LYS 153 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2j27 s LEU 154 N -1.32 2.79 0.33 -0.35 1.43 -0.81 -4.79 118.68 115.96 2j27 s LEU 154 Ca 0.34 -0.84 0.07 0.00 -1.03 0.00 0.00 54.13 52.68 2j27 s LEU 154 Cb 0.20 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 45.03 2j27 s LEU 154 CO 0.27 0.05 0.32 -0.54 0.23 0.00 0.00 176.35 176.69 2j27 s LYS 155 N -3.35 2.84 0.23 1.70 1.02 -1.26 -4.98 119.74 115.94 2j27 s LYS 155 Ca 0.28 -1.21 -0.06 0.00 0.02 0.00 0.00 55.97 55.00 2j27 s LYS 155 Cb -0.06 -2.56 0.38 0.00 -0.52 0.00 0.00 37.83 35.07 2j27 s LYS 155 CO 0.16 0.12 1.74 -0.22 -0.92 0.00 0.00 175.35 176.22 2j27 h LYS 156 N 1.19 0.44 0.00 1.68 3.64 -1.97 -0.34 116.57 121.22 2j27 h LYS 156 Ca -0.45 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 2j27 h LYS 156 Cb 1.25 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2j27 h LYS 156 CO 0.57 0.29 -0.06 0.00 -2.27 0.00 0.00 179.45 177.98 2j27 h ALA 157 N 1.49 1.11 0.00 5.00 0.00 -2.01 -2.52 119.26 122.33 2j27 h ALA 157 Ca 0.37 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2j27 h ALA 157 Cb 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2j27 h ALA 157 CO -0.36 0.08 0.00 -0.44 0.00 0.00 0.00 179.25 178.53 2j27 h ASP 158 N 0.00 0.00 0.73 0.00 3.32 -1.45 -3.13 116.42 115.89 2j27 h ASP 158 Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2j27 h ASP 158 Cb 0.34 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.89 2j27 h ASP 158 CO 0.01 0.00 -0.02 -0.50 -1.72 0.00 0.00 179.24 177.01 2j27 h TRP 159 N 0.00 0.00 0.00 4.55 4.06 -1.55 -0.76 115.95 122.25 2j27 h TRP 159 Ca 0.00 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 2j27 h TRP 159 Cb 0.59 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.75 2j27 h TRP 159 CO 0.00 0.02 -0.00 0.00 -3.56 0.00 0.00 178.44 174.89 2j27 h ALA 160 N 1.98 1.09 -0.22 1.49 0.00 -1.77 -2.05 119.26 119.79 2j27 h ALA 160 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2j27 h ALA 160 Cb 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2j27 h ALA 160 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.89 2j27 n LYS 161 N -3.22 2.28 -4.52 0.00 4.76 -0.29 -4.97 118.16 112.20 2j27 n LYS 161 Ca -0.03 -2.05 -0.32 0.00 -2.87 0.00 0.00 58.31 53.04 2j27 n LYS 161 Cb 0.09 -1.46 -0.11 0.00 -1.84 0.00 0.00 35.03 31.71 2j27 n LYS 161 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2j27 s VAL 162 N -1.61 3.51 -0.03 -0.18 1.01 -0.77 -1.02 120.40 121.32 2j27 s VAL 162 Ca 0.32 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.53 2j27 s VAL 162 Cb 0.20 -2.51 -0.00 0.00 0.00 0.00 0.00 36.38 34.07 2j27 s VAL 162 CO 0.29 0.41 -0.14 -0.69 0.00 0.00 0.00 175.10 174.97 2j27 s VAL 163 N -0.96 1.14 -0.16 2.92 1.01 0.52 -4.63 120.40 120.25 2j27 s VAL 163 Ca 0.16 -0.58 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 2j27 s VAL 163 Cb -0.11 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 2j27 s VAL 163 CO 0.06 0.33 0.08 -0.63 0.00 0.00 0.00 175.10 174.95 2j27 s ILE 164 N -0.08 4.97 -0.26 2.22 -1.09 -0.48 -0.25 121.20 126.23 2j27 s ILE 164 Ca 0.00 0.02 -0.06 0.00 -2.23 0.00 0.00 60.65 58.39 2j27 s ILE 164 Cb -0.08 -3.21 -0.00 0.00 -1.58 0.00 0.00 42.46 37.59 2j27 s ILE 164 CO 0.01 0.51 0.04 0.00 -1.23 0.00 0.00 174.94 174.27 2j27 s ALA 165 N -0.11 3.00 -0.34 9.38 0.00 -0.01 -0.25 121.76 133.43 2j27 s ALA 165 Ca 0.08 -1.32 -0.23 0.00 0.00 0.00 0.00 51.96 50.48 2j27 s ALA 165 Cb -0.12 -2.00 0.01 0.00 0.00 0.00 0.00 23.12 21.01 2j27 s ALA 165 CO 0.01 -0.71 0.78 -0.47 0.00 0.00 0.00 175.76 175.37 2j27 s TYR 166 N 1.51 3.14 -0.26 0.00 5.04 0.31 -1.16 117.35 125.92 2j27 s TYR 166 Ca 0.04 0.64 -0.09 0.00 -2.44 0.00 0.00 57.07 55.22 2j27 s TYR 166 Cb -0.16 -3.33 -0.04 0.00 0.35 0.00 0.00 41.96 38.78 2j27 s TYR 166 CO 0.01 -0.67 0.12 -1.21 -1.34 0.00 0.00 175.55 172.46 2j27 s GLU 167 N 3.04 3.79 -0.85 4.97 2.02 0.34 -1.02 118.70 130.99 2j27 s GLU 167 Ca 0.31 -0.40 -0.25 0.00 0.02 0.00 0.00 54.97 54.65 2j27 s GLU 167 Cb -0.14 -3.47 0.00 0.00 0.10 0.00 0.00 34.13 30.63 2j27 s GLU 167 CO 0.15 -0.18 1.65 0.00 0.02 0.00 0.00 175.26 176.90 2j27 s ALA 168 N 1.66 2.29 0.44 5.21 0.00 -0.48 -3.78 121.76 127.10 2j27 s ALA 168 Ca 0.07 -1.56 0.11 0.00 0.00 0.00 0.00 51.96 50.58 2j27 s ALA 168 Cb -0.15 -4.44 1.00 0.00 0.00 0.00 0.00 23.12 19.52 2j27 s ALA 168 CO 0.07 -3.98 2.05 0.28 0.00 0.00 0.00 175.76 174.18 2j27 h VAL 169 N 6.81 1.01 0.00 0.00 2.07 -1.76 0.46 116.25 124.84 2j27 h VAL 169 Ca -0.01 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2j27 h VAL 169 Cb 1.04 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 2j27 h VAL 169 CO 1.29 0.07 0.00 -2.67 0.02 0.00 0.00 177.57 176.29 2j27 n TRP 170 N -4.48 0.00 0.70 1.57 4.27 -1.26 -1.35 117.44 116.89 2j27 n TRP 170 Ca 0.04 0.00 0.08 0.00 -3.89 0.00 0.00 57.50 53.74 2j27 n TRP 170 Cb 0.18 -0.46 0.06 0.00 -1.36 0.00 0.00 31.31 29.73 2j27 n TRP 170 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2j27 n ALA 171 N -1.46 2.53 -2.40 -1.67 0.00 0.16 -4.79 120.51 112.88 2j27 n ALA 171 Ca 0.04 -0.63 -0.43 0.00 0.00 0.00 0.00 53.44 52.42 2j27 n ALA 171 Cb 0.14 -0.57 -0.02 0.00 0.00 0.00 0.00 19.45 19.00 2j27 n ALA 171 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2j27 s ILE 172 N -1.44 4.22 0.00 0.00 1.01 -0.46 -2.64 121.20 121.88 2j27 s ILE 172 Ca 0.19 1.49 0.00 0.00 0.00 0.00 0.00 60.65 62.33 2j27 s ILE 172 Cb 0.14 -3.96 0.00 0.00 0.01 0.00 0.00 42.46 38.65 2j27 s ILE 172 CO 0.23 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.67 2j27 n GLY 173 N 3.60 1.51 0.66 6.18 0.00 -1.26 -4.81 105.19 111.07 2j27 n GLY 173 Ca 0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 2j27 n GLY 173 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2j27 n THR 174 N -2.00 0.00 -0.84 2.61 -2.24 -1.22 -4.94 114.28 105.65 2j27 n THR 174 Ca 0.00 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2j27 n THR 174 Cb 0.00 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 2j27 n THR 174 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j27 n GLY 175 N 1.34 0.59 3.11 3.38 0.00 -1.26 -4.96 105.19 107.39 2j27 n GLY 175 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 2j27 n GLY 175 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2j27 s LYS 176 N -0.41 1.95 0.66 1.61 2.20 -1.26 -5.01 119.74 119.47 2j27 s LYS 176 Ca 0.00 -1.84 -0.16 0.00 -0.36 0.00 0.00 55.97 53.61 2j27 s LYS 176 Cb 0.00 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.78 2j27 s LYS 176 CO 0.00 -1.06 1.17 0.54 -0.36 0.00 0.00 175.35 175.64 2j27 s VAL 177 N 1.10 2.77 0.41 4.02 0.11 -1.26 -4.57 120.40 122.98 2j27 s VAL 177 Ca 0.09 0.40 -0.27 0.00 -2.93 0.00 0.00 61.98 59.27 2j27 s VAL 177 Cb -0.22 -2.98 -0.10 0.00 -1.53 0.00 0.00 36.38 31.55 2j27 s VAL 177 CO -0.05 -0.18 1.42 0.00 -3.33 0.00 0.00 175.10 172.96 2j27 n ALA 178 N -2.29 2.03 -1.12 1.54 0.00 -1.26 -5.00 120.51 114.41 2j27 n ALA 178 Ca 0.12 0.29 -0.31 0.00 0.00 0.00 0.00 53.44 53.55 2j27 n ALA 178 Cb 0.51 -2.38 0.12 0.00 0.00 0.00 0.00 19.45 17.70 2j27 n ALA 178 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2j27 s THR 179 N -1.16 2.91 0.26 0.00 -4.23 -1.26 -4.77 115.64 107.39 2j27 s THR 179 Ca 0.58 0.29 -0.02 0.00 -1.18 0.00 0.00 61.69 61.36 2j27 s THR 179 Cb -0.48 -2.68 0.26 0.00 1.34 0.00 0.00 72.50 70.95 2j27 s THR 179 CO 0.60 -0.38 1.68 -0.65 -0.54 0.00 0.00 174.62 175.33 2j27 h PRO 180 N -1.41 0.29 -0.53 3.99 0.11 -1.94 -1.49 132.00 131.01 2j27 h PRO 180 Ca -0.45 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.54 2j27 h PRO 180 Cb 1.25 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 2j27 h PRO 180 CO 0.50 0.19 -0.06 0.37 -0.21 0.00 0.00 178.00 178.79 2j27 h GLN 181 N 0.30 0.97 -0.37 1.05 4.15 -1.99 0.64 115.11 119.86 2j27 h GLN 181 Ca 0.46 -0.34 0.00 0.00 0.77 0.00 0.00 58.65 59.54 2j27 h GLN 181 Cb 0.82 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.42 2j27 h GLN 181 CO -0.53 1.01 0.23 1.96 -1.93 0.00 0.00 178.83 179.57 2j27 h GLN 182 N 0.84 0.50 -0.17 1.69 4.20 -1.74 0.03 115.11 120.46 2j27 h GLN 182 Ca 0.14 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 2j27 h GLN 182 Cb 0.61 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 2j27 h GLN 182 CO 0.04 0.36 0.04 0.00 -0.67 0.00 0.00 178.83 178.59 2j27 h ALA 183 N 1.11 0.22 -0.73 3.87 0.00 -1.15 -2.27 119.26 120.32 2j27 h ALA 183 Ca 0.14 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.93 2j27 h ALA 183 Cb -0.02 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2j27 h ALA 183 CO -0.03 -0.13 0.45 0.37 0.00 0.00 0.00 179.25 179.91 2j27 h GLN 184 N 0.07 0.82 -0.32 0.00 5.75 -0.72 -0.09 115.11 120.62 2j27 h GLN 184 Ca 0.05 -0.05 -0.10 0.00 -0.15 0.00 0.00 58.65 58.41 2j27 h GLN 184 Cb 0.28 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.63 2j27 h GLN 184 CO 0.00 0.54 -0.21 0.93 -2.65 0.00 0.00 178.83 177.45 2j27 h GLU 185 N 0.85 0.61 -0.19 1.69 5.08 -0.87 0.97 114.58 122.72 2j27 h GLU 185 Ca 0.31 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 2j27 h GLU 185 Cb 0.09 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2j27 h GLU 185 CO -0.14 0.77 -0.13 0.00 -1.00 0.00 0.00 179.01 178.51 2j27 h ALA 186 N 1.24 0.27 -0.87 3.43 0.00 -0.86 -1.92 119.26 120.54 2j27 h ALA 186 Ca 0.08 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2j27 h ALA 186 Cb 0.65 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2j27 h ALA 186 CO 0.05 0.13 0.49 0.45 0.00 0.00 0.00 179.25 180.37 2j27 h HIS 187 N 0.09 1.19 -0.17 0.00 3.86 -0.85 -1.49 115.15 117.79 2j27 h HIS 187 Ca 0.04 -0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.12 2j27 h HIS 187 Cb 0.64 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.72 2j27 h HIS 187 CO 0.07 0.82 -0.34 0.00 0.86 0.00 0.00 177.93 179.34 2j27 h ALA 188 N 1.26 1.10 -0.22 2.45 0.00 -0.71 -0.26 119.26 122.88 2j27 h ALA 188 Ca 0.31 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2j27 h ALA 188 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2j27 h ALA 188 CO -0.05 0.57 -0.05 1.25 0.00 0.00 0.00 179.25 180.97 2j27 h LEU 189 N 0.31 0.42 -0.42 0.00 5.85 -0.94 -0.97 115.31 119.56 2j27 h LEU 189 Ca 0.04 -0.36 0.02 0.00 0.84 0.00 0.00 57.88 58.42 2j27 h LEU 189 Cb 0.75 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 2j27 h LEU 189 CO 0.06 0.68 0.24 0.40 -0.34 0.00 0.00 178.44 179.48 2j27 h ILE 190 N 0.15 1.03 -0.75 4.05 2.04 -0.96 -2.11 117.51 120.96 2j27 h ILE 190 Ca 0.06 -0.17 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 2j27 h ILE 190 Cb 0.49 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 2j27 h ILE 190 CO 0.02 0.09 0.26 -0.09 0.00 0.00 0.00 178.15 178.43 2j27 h ARG 191 N 0.49 1.13 -0.49 2.37 2.43 -0.91 -1.69 114.38 117.71 2j27 h ARG 191 Ca 0.17 -0.22 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 2j27 h ARG 191 Cb 0.02 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.37 2j27 h ARG 191 CO -0.08 0.94 0.19 0.66 -1.51 0.00 0.00 179.97 180.17 2j27 h SER 192 N 1.10 0.64 -0.15 -3.80 4.64 -0.79 0.28 113.55 115.48 2j27 h SER 192 Ca 0.24 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.48 2j27 h SER 192 Cb 0.26 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 2j27 h SER 192 CO -0.01 0.59 0.04 -0.25 -0.87 0.00 0.00 176.83 176.33 2j27 h TRP 193 N 0.70 0.23 -0.78 4.77 7.01 -0.78 -1.47 115.95 125.64 2j27 h TRP 193 Ca 0.17 -0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.09 2j27 h TRP 193 Cb 0.15 -0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.11 2j27 h TRP 193 CO 0.01 0.35 0.28 0.28 -2.79 0.00 0.00 178.44 176.57 2j27 h VAL 194 N 0.05 1.26 -0.05 2.65 2.07 -0.42 0.26 116.25 122.09 2j27 h VAL 194 Ca 0.05 -0.86 0.02 0.00 0.82 0.00 0.00 66.70 66.73 2j27 h VAL 194 Cb 0.22 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2j27 h VAL 194 CO -0.00 0.35 -0.08 -1.28 0.02 0.00 0.00 177.57 176.58 2j27 h SER 195 N 1.14 -0.23 -0.29 0.57 0.87 -0.38 0.20 113.55 115.43 2j27 h SER 195 Ca 0.26 0.04 -0.11 0.00 -1.23 0.00 0.00 61.79 60.74 2j27 h SER 195 Cb 0.25 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 2j27 h SER 195 CO -0.02 -0.11 -0.26 -1.28 -0.53 0.00 0.00 176.83 174.63 2j27 h SER 196 N -0.11 0.74 0.68 6.23 0.87 -0.89 -2.61 113.55 118.46 2j27 h SER 196 Ca 0.05 -0.46 -0.26 0.00 -1.23 0.00 0.00 61.79 59.88 2j27 h SER 196 Cb 0.17 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 61.89 2j27 h SER 196 CO -0.11 1.04 -1.41 0.11 -0.53 0.00 0.00 176.83 175.93 2j27 h LYS 197 N 0.44 0.03 0.00 2.24 1.79 -0.42 -3.42 116.57 117.22 2j27 h LYS 197 Ca 0.05 -0.06 -0.11 0.00 -2.18 0.00 0.00 60.65 58.35 2j27 h LYS 197 Cb 0.83 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.48 2j27 h LYS 197 CO 0.07 0.78 -1.39 -0.89 -1.08 0.00 0.00 179.45 176.94 2j27 n ILE 198 N -3.22 0.39 0.00 1.86 2.08 0.59 -5.07 119.36 115.98 2j27 n ILE 198 Ca -0.10 -0.12 0.00 0.00 0.56 0.00 0.00 62.75 63.09 2j27 n ILE 198 Cb 1.01 -1.28 0.00 0.00 -0.75 0.00 0.00 39.64 38.62 2j27 n ILE 198 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2j27 n GLY 199 N 2.79 3.92 0.29 7.39 0.00 -0.42 -4.86 105.19 114.29 2j27 n GLY 199 Ca -0.13 -0.79 0.01 0.00 0.00 0.00 0.00 46.02 45.10 2j27 n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j27 h ALA 200 N 0.00 1.44 0.20 4.61 0.00 -1.83 -0.68 119.26 123.00 2j27 h ALA 200 Ca 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2j27 h ALA 200 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2j27 h ALA 200 CO 0.00 0.42 -0.10 0.38 0.00 0.00 0.00 179.25 179.95 2j27 h ASP 201 N 0.62 -0.23 -0.69 0.00 3.04 -1.92 -0.99 116.42 116.24 2j27 h ASP 201 Ca 0.15 -0.07 0.01 0.00 -3.24 0.00 0.00 57.03 53.87 2j27 h ASP 201 Cb 0.17 0.06 -0.03 0.00 -1.04 0.00 0.00 39.33 38.49 2j27 h ASP 201 CO -0.01 -0.07 0.46 0.58 -2.04 0.00 0.00 179.24 178.16 2j27 h VAL 202 N -0.37 1.18 -0.92 4.15 2.07 -1.85 -2.20 116.25 118.31 2j27 h VAL 202 Ca -0.03 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2j27 h VAL 202 Cb 0.29 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.17 2j27 h VAL 202 CO 0.05 0.17 0.58 0.00 0.02 0.00 0.00 177.57 178.38 2j27 h ALA 203 N 1.25 1.28 0.00 1.67 0.00 -0.94 -1.36 119.26 121.17 2j27 h ALA 203 Ca 0.25 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2j27 h ALA 203 Cb -0.11 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.30 2j27 h ALA 203 CO -0.05 0.63 -0.32 0.78 0.00 0.00 0.00 179.25 180.29 2j27 h GLY 204 N 1.27 0.00 1.00 0.00 0.00 -0.57 -3.06 103.07 101.71 2j27 h GLY 204 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 2j27 h GLY 204 CO -0.07 0.00 -0.82 1.18 0.00 0.00 0.00 176.54 176.83 2j27 n GLU 205 N -3.42 0.38 -2.19 4.80 -0.58 -0.85 -4.51 120.64 114.27 2j27 n GLU 205 Ca 0.00 0.08 -0.41 0.00 -0.42 0.00 0.00 57.16 56.41 2j27 n GLU 205 Cb 0.51 -1.71 -0.03 0.00 -0.57 0.00 0.00 31.44 29.64 2j27 n GLU 205 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2j27 s LEU 206 N -4.50 4.42 -0.14 -4.62 2.96 -0.57 -4.80 118.68 111.42 2j27 s LEU 206 Ca 0.04 2.44 -0.22 0.00 -0.22 0.00 0.00 54.13 56.17 2j27 s LEU 206 Cb 0.12 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 43.17 2j27 s LEU 206 CO 0.76 -0.54 0.66 -0.13 -1.32 0.00 0.00 176.35 175.77 2j27 s ARG 207 N -0.23 4.31 -0.23 1.98 3.00 -1.26 -4.89 118.95 121.62 2j27 s ARG 207 Ca 0.56 0.73 -0.01 0.00 0.00 0.00 0.00 55.73 57.01 2j27 s ARG 207 Cb -0.37 -3.52 0.03 0.00 0.00 0.00 0.00 34.95 31.09 2j27 s ARG 207 CO 0.39 -0.10 -0.10 0.42 0.00 0.00 0.00 175.30 175.92 2j27 s ILE 208 N 1.41 2.64 0.05 1.52 1.01 -1.26 -1.38 121.20 125.19 2j27 s ILE 208 Ca 0.32 -1.05 -0.01 0.00 0.00 0.00 0.00 60.65 59.91 2j27 s ILE 208 Cb -0.16 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 2j27 s ILE 208 CO 0.13 0.26 0.22 -0.76 0.00 0.00 0.00 174.94 174.79 2j27 s LEU 209 N 1.30 4.36 -0.11 2.97 1.43 0.65 -0.98 118.68 128.29 2j27 s LEU 209 Ca 0.00 0.32 -0.06 0.00 -1.03 0.00 0.00 54.13 53.37 2j27 s LEU 209 Cb -0.16 -2.91 -0.04 0.00 0.03 0.00 0.00 46.19 43.12 2j27 s LEU 209 CO -0.06 0.18 0.10 -0.47 0.23 0.00 0.00 176.35 176.33 2j27 s TYR 210 N -1.48 3.48 0.02 0.29 5.04 -0.46 -0.53 117.35 123.71 2j27 s TYR 210 Ca 0.34 0.44 0.03 0.00 -2.44 0.00 0.00 57.07 55.44 2j27 s TYR 210 Cb -0.13 -1.90 -0.01 0.00 0.35 0.00 0.00 41.96 40.26 2j27 s TYR 210 CO 0.25 0.66 -0.10 0.20 -1.34 0.00 0.00 175.55 175.22 2j27 s GLY 211 N -0.97 0.56 0.00 8.97 0.00 -0.19 -1.19 107.32 114.50 2j27 s GLY 211 Ca 0.14 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.28 2j27 s GLY 211 CO 0.03 -0.55 0.00 0.61 0.00 0.00 0.00 173.10 173.20 2j27 n GLY 212 N 2.34 1.27 2.33 0.20 0.00 -1.26 -1.38 105.19 108.70 2j27 n GLY 212 Ca -0.16 -0.11 -0.16 0.00 0.00 0.00 0.00 46.02 45.59 2j27 n GLY 212 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2j27 n SER 213 N 0.00 -4.81 -4.74 1.61 7.64 -1.08 -4.25 113.62 108.00 2j27 n SER 213 Ca 0.00 0.06 -0.42 0.00 1.01 0.00 0.00 58.87 59.52 2j27 n SER 213 Cb 0.00 -3.89 -0.02 0.00 -1.01 0.00 0.00 64.21 59.29 2j27 n SER 213 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2j27 s VAL 214 N -2.76 2.15 0.33 0.44 1.01 -1.26 -4.60 120.40 115.70 2j27 s VAL 214 Ca 0.00 0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.13 2j27 s VAL 214 Cb 0.00 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.29 2j27 s VAL 214 CO 0.00 0.02 0.37 -0.46 0.00 0.00 0.00 175.10 175.02 2j27 n ASN 215 N 2.95 -0.99 0.26 3.32 0.23 -1.26 -4.51 115.26 115.26 2j27 n ASN 215 Ca 0.11 -2.97 0.09 0.00 -0.53 0.00 0.00 54.58 51.28 2j27 n ASN 215 Cb 0.37 2.02 0.68 0.00 -2.08 0.00 0.00 39.78 40.77 2j27 n ASN 215 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2j27 h GLY 216 N 1.93 0.00 1.11 4.83 0.00 -1.93 -2.12 103.07 106.89 2j27 h GLY 216 Ca -0.24 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.93 2j27 h GLY 216 CO 0.34 0.00 -1.31 0.50 0.00 0.00 0.00 176.54 176.08 2j27 h LYS 217 N 0.00 0.00 -0.01 4.80 1.57 -1.95 -3.36 116.57 117.62 2j27 h LYS 217 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2j27 h LYS 217 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2j27 h LYS 217 CO 0.00 0.32 -0.51 0.27 -0.57 0.00 0.00 179.45 178.96 2j27 n ASN 218 N -2.93 1.24 -0.14 0.86 0.23 -1.05 -4.67 115.26 108.80 2j27 n ASN 218 Ca -0.08 -1.12 -0.11 0.00 -0.53 0.00 0.00 54.58 52.74 2j27 n ASN 218 Cb 0.83 0.70 -0.01 0.00 -2.08 0.00 0.00 39.78 39.22 2j27 n ASN 218 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2j27 h ALA 219 N 2.55 0.57 -0.24 -2.53 0.00 -1.54 -2.85 119.26 115.22 2j27 h ALA 219 Ca 0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2j27 h ALA 219 Cb 0.47 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2j27 h ALA 219 CO 0.00 0.40 0.13 -0.09 0.00 0.00 0.00 179.25 179.69 2j27 h ARG 220 N 0.59 0.33 -0.78 0.00 2.43 -1.83 -0.73 114.38 114.40 2j27 h ARG 220 Ca 0.11 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 2j27 h ARG 220 Cb 0.56 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.01 2j27 h ARG 220 CO 0.03 0.30 0.41 1.15 -1.51 0.00 0.00 179.97 180.35 2j27 h THR 221 N 0.27 1.23 -0.70 0.20 2.02 -1.87 -2.09 112.91 111.98 2j27 h THR 221 Ca 0.08 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.63 2j27 h THR 221 Cb 0.06 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 66.64 2j27 h THR 221 CO -0.01 0.26 0.29 -0.07 0.37 0.00 0.00 175.52 176.36 2j27 h LEU 222 N 1.09 0.96 -1.99 2.58 3.38 -1.19 -2.83 115.31 117.31 2j27 h LEU 222 Ca 0.27 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2j27 h LEU 222 Cb 0.05 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2j27 h LEU 222 CO -0.04 0.86 -0.10 0.22 0.09 0.00 0.00 178.44 179.46 2j27 h TYR 223 N 0.99 0.00 0.00 1.13 3.20 -0.48 -1.91 116.97 119.91 2j27 h TYR 223 Ca 0.23 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.10 2j27 h TYR 223 Cb 0.19 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.46 2j27 h TYR 223 CO 0.01 0.10 0.00 1.96 -1.64 0.00 0.00 178.16 178.60 2j27 h GLN 224 N 0.00 0.00 -6.94 1.82 1.08 -1.18 -3.44 115.11 106.45 2j27 h GLN 224 Ca -0.00 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.68 2j27 h GLN 224 Cb 0.27 0.00 0.06 0.00 -0.05 0.00 0.00 27.48 27.76 2j27 h GLN 224 CO 0.01 0.00 0.55 -0.65 -0.95 0.00 0.00 178.83 177.79 2j27 s GLN 225 N -3.66 4.03 0.47 1.46 -1.52 -0.72 -4.91 119.66 114.82 2j27 s GLN 225 Ca 0.00 1.97 0.17 0.00 -1.95 0.00 0.00 55.36 55.56 2j27 s GLN 225 Cb 0.09 -2.72 1.14 0.00 -0.22 0.00 0.00 33.01 31.30 2j27 s GLN 225 CO 0.42 -0.38 2.04 -0.09 -0.25 0.00 0.00 175.29 177.03 2j27 h ARG 226 N 2.68 0.00 -0.38 2.91 9.65 -1.90 -2.63 114.38 124.72 2j27 h ARG 226 Ca -0.49 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 2j27 h ARG 226 Cb 1.24 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.82 2j27 h ARG 226 CO 0.63 0.14 0.00 -0.25 2.80 0.00 0.00 179.97 183.28 2j27 n ASP 227 N -4.24 3.77 -4.66 -3.80 8.00 -1.26 -4.92 116.55 109.44 2j27 n ASP 227 Ca -0.02 -2.54 -0.37 0.00 0.71 0.00 0.00 54.79 52.57 2j27 n ASP 227 Cb 0.21 -0.44 -0.09 0.00 -0.02 0.00 0.00 41.12 40.78 2j27 n ASP 227 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2j27 s VAL 228 N -1.98 5.30 -0.18 2.53 1.01 -0.99 -4.64 120.40 121.45 2j27 s VAL 228 Ca 0.37 0.36 0.16 0.00 0.00 0.00 0.00 61.98 62.88 2j27 s VAL 228 Cb 0.26 -3.58 0.35 0.00 0.00 0.00 0.00 36.38 33.41 2j27 s VAL 228 CO 0.15 0.30 1.24 0.59 0.00 0.00 0.00 175.10 177.38 2j27 n ASN 229 N 4.42 2.92 0.00 3.32 4.13 -0.16 -4.86 115.26 125.03 2j27 n ASN 229 Ca -0.13 -2.91 0.00 0.00 1.68 0.00 0.00 54.58 53.22 2j27 n ASN 229 Cb 0.52 -0.42 0.00 0.00 -1.54 0.00 0.00 39.78 38.33 2j27 n ASN 229 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2j27 n GLY 230 N -0.91 0.81 3.07 7.41 0.00 -1.26 -1.74 105.19 112.57 2j27 n GLY 230 Ca 0.16 -2.01 -0.12 0.00 0.00 0.00 0.00 46.02 44.05 2j27 n GLY 230 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2j27 s PHE 231 N -1.97 -0.08 -0.34 1.61 0.08 -0.44 -1.35 117.98 115.48 2j27 s PHE 231 Ca 0.00 0.20 -0.09 0.00 0.12 0.00 0.00 56.93 57.16 2j27 s PHE 231 Cb 0.00 0.01 0.02 0.00 -0.57 0.00 0.00 43.02 42.49 2j27 s PHE 231 CO 0.00 -0.17 0.15 -1.17 -0.10 0.00 0.00 175.22 173.93 2j27 s LEU 232 N -0.52 4.38 -0.23 -0.37 2.96 -0.33 -1.01 118.68 123.55 2j27 s LEU 232 Ca -0.06 -0.94 -0.03 0.00 -0.22 0.00 0.00 54.13 52.88 2j27 s LEU 232 Cb -0.04 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.71 2j27 s LEU 232 CO 0.01 -0.31 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.99 2j27 s VAL 233 N 1.50 3.25 0.00 1.68 1.01 0.24 -4.21 120.40 123.87 2j27 s VAL 233 Ca 0.01 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.33 2j27 s VAL 233 Cb -0.19 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.66 2j27 s VAL 233 CO 0.05 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.10 2j27 n GLY 234 N 4.77 0.61 0.29 4.51 0.00 -1.26 -0.21 105.19 113.90 2j27 n GLY 234 Ca -0.18 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.88 2j27 n GLY 234 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2j27 h GLY 235 N 0.00 1.23 1.99 -0.02 0.00 -1.91 -0.39 103.07 103.96 2j27 h GLY 235 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2j27 h GLY 235 CO 0.00 0.04 0.00 0.00 0.00 0.00 0.00 176.54 176.58 2j27 n ALA 236 N -2.41 1.92 1.07 3.60 0.00 -1.26 -2.43 120.51 121.00 2j27 n ALA 236 Ca 0.14 -0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.65 2j27 n ALA 236 Cb 0.33 -1.32 0.64 0.00 0.00 0.00 0.00 19.45 19.09 2j27 n ALA 236 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2j27 n SER 237 N -1.49 0.01 -0.87 0.00 3.41 -0.16 -2.59 113.62 111.93 2j27 n SER 237 Ca 0.05 0.38 0.08 0.00 -0.26 0.00 0.00 58.87 59.12 2j27 n SER 237 Cb 0.23 -0.45 0.23 0.00 -0.26 0.00 0.00 64.21 63.96 2j27 n SER 237 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2j27 n LEU 238 N -1.46 2.53 -4.23 1.04 4.77 -1.02 -4.89 117.00 113.74 2j27 n LEU 238 Ca 0.08 -1.24 -0.14 0.00 -0.03 0.00 0.00 56.01 54.68 2j27 n LEU 238 Cb 0.32 -0.30 -0.10 0.00 -2.33 0.00 0.00 43.42 41.01 2j27 n LEU 238 CO 0.26 0.62 -0.41 -0.54 -1.33 0.00 0.00 177.39 175.99 2j27 s LYS 239 N -1.40 1.00 0.50 3.23 1.02 -1.07 -5.04 119.74 117.97 2j27 s LYS 239 Ca 0.32 -1.37 0.22 0.00 0.02 0.00 0.00 55.97 55.17 2j27 s LYS 239 Cb 0.17 -0.60 1.28 0.00 -0.52 0.00 0.00 37.83 38.17 2j27 s LYS 239 CO 0.23 0.08 1.98 -1.35 -0.92 0.00 0.00 175.35 175.37 2j27 h PRO 240 N 3.01 0.13 0.00 -1.68 0.11 -1.93 -1.49 132.00 130.16 2j27 h PRO 240 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2j27 h PRO 240 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2j27 h PRO 240 CO 0.60 0.08 0.00 -0.85 -0.21 0.00 0.00 178.00 177.63 2j27 n GLU 241 N -4.41 0.00 -0.19 1.05 0.28 -1.26 -1.92 120.64 114.20 2j27 n GLU 241 Ca 0.10 0.38 0.18 0.00 -0.16 0.00 0.00 57.16 57.67 2j27 n GLU 241 Cb 0.56 -1.50 0.54 0.00 1.43 0.00 0.00 31.44 32.47 2j27 n GLU 241 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 2j27 h PHE 242 N 0.00 0.43 -0.13 -1.84 3.57 -1.27 0.06 116.94 117.76 2j27 h PHE 242 Ca 0.00 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 2j27 h PHE 242 Cb 0.11 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 2j27 h PHE 242 CO 0.00 0.14 -0.17 0.28 -2.23 0.00 0.00 178.31 176.33 2j27 h VAL 243 N 0.35 1.19 -0.05 1.41 2.07 -1.63 -1.07 116.25 118.51 2j27 h VAL 243 Ca 0.41 -0.87 -0.13 0.00 0.82 0.00 0.00 66.70 66.93 2j27 h VAL 243 Cb 1.06 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 2j27 h VAL 243 CO -0.12 0.27 -0.54 0.44 0.02 0.00 0.00 177.57 177.63 2j27 h ASP 244 N 0.20 0.17 -0.46 0.57 3.32 -1.19 -1.93 116.42 117.09 2j27 h ASP 244 Ca 0.04 -0.09 -0.09 0.00 0.02 0.00 0.00 57.03 56.91 2j27 h ASP 244 Cb 0.43 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 2j27 h ASP 244 CO 0.03 0.68 -0.03 0.40 -1.72 0.00 0.00 179.24 178.60 2j27 h ILE 245 N 0.12 1.26 -0.44 0.35 2.04 -0.78 -1.50 117.51 118.55 2j27 h ILE 245 Ca -0.00 -1.10 0.01 0.00 1.00 0.00 0.00 64.86 64.76 2j27 h ILE 245 Cb 0.99 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 2j27 h ILE 245 CO 0.08 0.39 0.28 0.40 0.00 0.00 0.00 178.15 179.30 2j27 h ILE 246 N 0.82 1.10 0.00 -0.67 2.04 -0.87 -2.35 117.51 117.58 2j27 h ILE 246 Ca 0.15 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 2j27 h ILE 246 Cb 0.53 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 2j27 h ILE 246 CO 0.03 0.11 -0.15 0.50 0.00 0.00 0.00 178.15 178.64 2j27 h LYS 247 N 0.58 0.00 0.00 2.37 3.64 -0.92 -1.98 116.57 120.26 2j27 h LYS 247 Ca 0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2j27 h LYS 247 Cb -0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2j27 h LYS 247 CO -0.04 0.15 0.00 0.00 -2.27 0.00 0.00 179.45 177.28 2j27 n ALA 248 N -2.25 1.84 -1.34 5.00 0.00 -0.61 -4.02 120.51 119.14 2j27 n ALA 248 Ca -0.01 -0.06 -0.25 0.00 0.00 0.00 0.00 53.44 53.12 2j27 n ALA 248 Cb 0.29 -1.30 -0.09 0.00 0.00 0.00 0.00 19.45 18.35 2j27 n ALA 248 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2j27 n THR 249 N -1.49 3.61 -1.76 0.00 -2.24 -0.75 -4.50 114.28 107.15 2j27 n THR 249 Ca 0.05 -2.52 0.00 0.00 -2.27 0.00 0.00 64.05 59.31 2j27 n THR 249 Cb 0.21 -1.98 0.00 0.00 -2.10 0.00 0.00 70.33 66.47 2j27 n THR 249 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50