#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tnj s VAL 17 N 0.00 5.08 -0.87 1.39 1.01 0.28 -3.87 120.40 123.42 1tnj s VAL 17 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.04 1tnj s VAL 17 Cb 0.00 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1tnj s VAL 17 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1tnj n GLY 18 N 2.90 0.39 0.00 4.51 0.00 -1.24 -1.44 105.19 110.30 1tnj n GLY 18 Ca -0.18 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1tnj n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tnj n GLY 19 N -1.31 2.53 3.23 -0.02 0.00 -1.26 -4.83 105.19 103.52 1tnj n GLY 19 Ca -0.10 -2.06 -0.13 0.00 0.00 0.00 0.00 46.02 43.73 1tnj n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1tnj s TYR 20 N 1.67 1.15 -0.03 1.61 1.13 -0.41 -4.94 117.35 117.53 1tnj s TYR 20 Ca 0.00 -0.84 -0.30 0.00 -1.41 0.00 0.00 57.07 54.52 1tnj s TYR 20 Cb 0.00 -0.62 -0.06 0.00 -1.10 0.00 0.00 41.96 40.18 1tnj s TYR 20 CO 0.00 -0.03 1.52 0.99 -2.51 0.00 0.00 175.55 175.53 1tnj s THR 21 N -3.46 3.61 0.23 -3.49 2.01 -1.26 -0.17 115.64 113.11 1tnj s THR 21 Ca 0.16 0.90 -0.08 0.00 0.31 0.00 0.00 61.69 62.98 1tnj s THR 21 Cb 0.04 -3.58 0.22 0.00 0.01 0.00 0.00 72.50 69.19 1tnj s THR 21 CO -0.00 -0.04 1.91 0.00 -0.69 0.00 0.00 174.62 175.80 1tnj n GLY 23 N -1.35 2.38 3.68 0.00 0.00 -1.26 -4.81 105.19 103.83 1tnj n GLY 23 Ca 0.10 -1.52 -0.46 0.00 0.00 0.00 0.00 46.02 44.14 1tnj n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tnj n ALA 24 N 1.74 1.35 -2.32 4.61 0.00 -1.26 -2.55 120.51 122.07 1tnj n ALA 24 Ca 0.00 0.33 -0.18 0.00 0.00 0.00 0.00 53.44 53.59 1tnj n ALA 24 Cb 0.00 -2.49 -0.02 0.00 0.00 0.00 0.00 19.45 16.95 1tnj n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1tnj n ASN 25 N 5.53 -5.28 -0.05 0.00 3.02 -1.26 -4.87 115.26 112.35 1tnj n ASN 25 Ca 0.20 0.09 0.13 0.00 -0.03 0.00 0.00 54.58 54.97 1tnj n ASN 25 Cb 0.32 -4.45 0.47 0.00 -0.61 0.00 0.00 39.78 35.51 1tnj n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1tnj n THR 26 N -3.65 0.00 -3.56 3.41 -2.24 -1.06 -4.21 114.28 102.96 1tnj n THR 26 Ca -0.21 -0.03 -0.27 0.00 -2.27 0.00 0.00 64.05 61.27 1tnj n THR 26 Cb 0.66 -0.06 -0.10 0.00 -2.10 0.00 0.00 70.33 68.74 1tnj n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1tnj n VAL 27 N -1.27 1.23 0.56 2.28 0.31 -1.26 -5.00 118.33 115.18 1tnj n VAL 27 Ca 0.09 -4.70 0.12 0.00 -0.01 0.00 0.00 64.34 59.84 1tnj n VAL 27 Cb 0.32 -2.06 0.45 0.00 -0.91 0.00 0.00 33.84 31.64 1tnj n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1tnj n PRO 28 N 1.59 0.15 0.00 5.55 -0.04 -1.26 -1.52 135.00 139.47 1tnj n PRO 28 Ca 0.25 0.27 0.13 0.00 -0.04 0.00 0.00 63.50 64.11 1tnj n PRO 28 Cb 0.41 -1.73 0.33 0.00 -0.04 0.00 0.00 33.50 32.47 1tnj n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1tnj n TYR 29 N -2.00 0.00 -2.13 0.54 0.18 -1.09 -2.23 117.16 110.44 1tnj n TYR 29 Ca 0.04 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.40 1tnj n TYR 29 Cb 0.29 -0.22 -0.03 0.00 -0.38 0.00 0.00 39.34 39.00 1tnj n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1tnj s GLN 30 N -2.82 4.25 0.22 -3.48 2.00 -0.57 -0.77 119.66 118.49 1tnj s GLN 30 Ca 0.16 2.08 0.10 0.00 -2.00 0.00 0.00 55.36 55.70 1tnj s GLN 30 Cb 0.18 -3.61 -0.04 0.00 0.80 0.00 0.00 33.01 30.34 1tnj s GLN 30 CO 0.62 -0.64 -0.11 0.14 -0.50 0.00 0.00 175.29 174.80 1tnj s VAL 31 N 2.59 2.99 -0.17 1.34 -7.23 0.14 -4.50 120.40 115.58 1tnj s VAL 31 Ca 0.67 -1.93 -0.04 0.00 -1.81 0.00 0.00 61.98 58.87 1tnj s VAL 31 Cb -0.34 -2.53 -0.03 0.00 0.56 0.00 0.00 36.38 34.05 1tnj s VAL 31 CO 0.28 -0.24 -0.03 -0.55 -0.31 0.00 0.00 175.10 174.26 1tnj s SER 32 N -3.16 4.82 -0.16 4.85 0.15 -0.19 -1.82 113.70 118.19 1tnj s SER 32 Ca 0.27 -0.14 -0.18 0.00 0.70 0.00 0.00 55.95 56.60 1tnj s SER 32 Cb -0.07 -1.80 -0.04 0.00 -1.71 0.00 0.00 66.02 62.40 1tnj s SER 32 CO 0.16 0.15 0.46 -0.76 1.20 0.00 0.00 173.24 174.44 1tnj s LEU 33 N 0.50 4.21 -0.10 3.45 1.43 0.32 -1.05 118.68 127.45 1tnj s LEU 33 Ca -0.03 0.70 0.04 0.00 -1.03 0.00 0.00 54.13 53.81 1tnj s LEU 33 Cb -0.14 -2.64 0.00 0.00 0.03 0.00 0.00 46.19 43.44 1tnj s LEU 33 CO 0.03 -0.06 -0.22 0.21 0.23 0.00 0.00 176.35 176.53 1tnj s ASN 34 N 0.85 2.91 -0.37 2.29 2.47 -0.19 -1.18 114.94 121.72 1tnj s ASN 34 Ca 0.23 -0.52 0.10 0.00 0.42 0.00 0.00 52.86 53.09 1tnj s ASN 34 Cb -0.15 -1.33 0.44 0.00 -1.45 0.00 0.00 41.25 38.76 1tnj s ASN 34 CO 0.09 0.14 1.07 -1.54 -3.72 0.00 0.00 177.10 173.14 1tnj n SER 37 N 3.56 3.50 0.00 -4.21 3.41 -1.26 -1.00 113.62 117.61 1tnj n SER 37 Ca -0.20 -3.29 0.00 0.00 -0.26 0.00 0.00 58.87 55.12 1tnj n SER 37 Cb 0.53 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 1tnj n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tnj n GLY 38 N -0.38 0.44 3.52 5.00 0.00 -1.26 -5.00 105.19 107.50 1tnj n GLY 38 Ca 0.28 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.15 1tnj n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1tnj s TYR 39 N -2.13 -0.54 0.07 1.61 1.13 -1.26 -5.14 117.35 111.09 1tnj s TYR 39 Ca 0.00 0.82 -0.30 0.00 -1.41 0.00 0.00 57.07 56.18 1tnj s TYR 39 Cb 0.00 0.45 -0.09 0.00 -1.10 0.00 0.00 41.96 41.22 1tnj s TYR 39 CO 0.00 -0.57 1.87 -1.58 -2.51 0.00 0.00 175.55 172.76 1tnj s HIS 40 N -1.68 1.76 0.00 -3.49 5.65 -1.26 -4.24 115.29 112.03 1tnj s HIS 40 Ca -0.06 -0.19 0.00 0.00 0.25 0.00 0.00 55.06 55.06 1tnj s HIS 40 Cb -0.00 -4.18 0.00 0.00 -1.18 0.00 0.00 32.58 27.21 1tnj s HIS 40 CO 0.03 -5.08 0.00 1.97 -0.65 0.00 0.00 174.74 171.01 1tnj n PHE 41 N 6.59 0.00 -3.55 3.88 -1.74 -0.32 -4.98 117.46 117.34 1tnj n PHE 41 Ca 0.19 0.00 -0.16 0.00 -0.56 0.00 0.00 57.45 56.92 1tnj n PHE 41 Cb 0.40 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.34 1tnj n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1tnj n GLY 43 N 0.67 0.15 3.83 0.00 0.00 0.61 -0.52 105.19 109.93 1tnj n GLY 43 Ca -0.19 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 43.90 1tnj n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tnj s GLY 44 N -4.64 -0.16 -0.05 -0.02 0.00 -0.75 -3.80 107.32 97.91 1tnj s GLY 44 Ca 0.52 0.13 0.02 0.00 0.00 0.00 0.00 44.72 45.39 1tnj s GLY 44 CO 0.35 2.71 -0.10 -0.56 0.00 0.00 0.00 173.10 175.50 1tnj s SER 45 N -3.39 1.43 -0.32 1.64 0.01 -0.14 -0.68 113.70 112.25 1tnj s SER 45 Ca 0.22 -0.23 -0.28 0.00 1.31 0.00 0.00 55.95 56.97 1tnj s SER 45 Cb 0.00 -0.57 0.01 0.00 0.21 0.00 0.00 66.02 65.67 1tnj s SER 45 CO 0.00 0.03 1.03 -0.22 0.41 0.00 0.00 173.24 174.49 1tnj s LEU 46 N 0.54 3.97 -0.02 2.44 2.96 0.05 -0.83 118.68 127.79 1tnj s LEU 46 Ca -0.10 0.99 0.21 0.00 -0.22 0.00 0.00 54.13 55.01 1tnj s LEU 46 Cb -0.13 -3.46 -0.28 0.00 0.50 0.00 0.00 46.19 42.81 1tnj s LEU 46 CO 0.02 -0.83 0.67 2.30 -1.32 0.00 0.00 176.35 177.18 1tnj n ILE 47 N 5.80 0.00 -3.54 6.68 -5.35 -0.53 -0.45 119.36 121.97 1tnj n ILE 47 Ca 0.11 -0.26 -0.06 0.00 -0.27 0.00 0.00 62.75 62.27 1tnj n ILE 47 Cb 0.47 0.49 0.02 0.00 -1.74 0.00 0.00 39.64 38.88 1tnj n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1tnj n ASN 48 N -1.88 -1.57 0.11 7.28 0.23 -1.17 -4.57 115.26 113.69 1tnj n ASN 48 Ca -0.00 -2.08 0.09 0.00 -0.53 0.00 0.00 54.58 52.06 1tnj n ASN 48 Cb 0.44 2.61 0.44 0.00 -2.08 0.00 0.00 39.78 41.19 1tnj n ASN 48 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1tnj n SER 49 N -1.36 0.45 0.00 0.53 3.41 -1.26 -3.09 113.62 112.30 1tnj n SER 49 Ca -0.06 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 1tnj n SER 49 Cb 0.40 -0.74 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 1tnj n SER 49 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1tnj n GLN 50 N -2.05 0.02 -4.41 4.33 7.27 -1.26 0.21 117.38 121.48 1tnj n GLN 50 Ca 0.01 -0.34 -0.21 0.00 0.07 0.00 0.00 57.00 56.52 1tnj n GLN 50 Cb 0.11 -0.83 -0.16 0.00 2.41 0.00 0.00 30.24 31.78 1tnj n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1tnj s TRP 51 N -0.10 1.03 -0.04 3.69 0.52 -1.18 -0.48 118.94 122.38 1tnj s TRP 51 Ca 0.00 -0.29 0.06 0.00 0.02 0.00 0.00 56.10 55.90 1tnj s TRP 51 Cb 0.00 -0.76 -0.02 0.00 -1.15 0.00 0.00 33.47 31.55 1tnj s TRP 51 CO 0.00 -0.14 -0.23 0.08 0.02 0.00 0.00 176.95 176.68 1tnj s VAL 52 N 0.34 2.26 -0.04 4.03 1.01 -0.10 -1.45 120.40 126.45 1tnj s VAL 52 Ca -0.06 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 60.93 1tnj s VAL 52 Cb -0.11 -1.82 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 1tnj s VAL 52 CO 0.01 0.58 -0.08 0.54 0.00 0.00 0.00 175.10 176.14 1tnj s VAL 53 N -0.45 3.55 0.00 2.92 0.11 -0.01 -0.39 120.40 126.13 1tnj s VAL 53 Ca 0.05 -0.62 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 1tnj s VAL 53 Cb -0.12 -2.47 0.00 0.00 -1.53 0.00 0.00 36.38 32.27 1tnj s VAL 53 CO 0.01 0.54 0.00 -0.24 -3.33 0.00 0.00 175.10 172.08 1tnj n SER 54 N 2.05 0.00 -4.77 3.54 2.88 -0.01 -0.97 113.62 116.34 1tnj n SER 54 Ca -0.17 -0.82 -0.39 0.00 -1.33 0.00 0.00 58.87 56.16 1tnj n SER 54 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1tnj n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tnj s ALA 55 N -1.75 3.48 0.48 -1.46 0.00 -1.26 -1.26 121.76 119.98 1tnj s ALA 55 Ca 0.00 0.07 0.15 0.00 0.00 0.00 0.00 51.96 52.17 1tnj s ALA 55 Cb 0.00 -2.76 1.14 0.00 0.00 0.00 0.00 23.12 21.49 1tnj s ALA 55 CO 0.00 0.18 2.07 0.00 0.00 0.00 0.00 175.76 178.02 1tnj h ALA 56 N 5.49 2.00 0.00 0.00 0.00 -1.70 -0.20 119.26 124.84 1tnj h ALA 56 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1tnj h ALA 56 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1tnj h ALA 56 CO 0.69 -0.05 0.00 -2.39 0.00 0.00 0.00 179.25 177.50 1tnj n HIS 57 N -4.49 0.00 1.22 0.00 1.44 -1.26 -1.43 115.22 110.70 1tnj n HIS 57 Ca 0.03 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.87 1tnj n HIS 57 Cb 0.20 -0.50 0.56 0.00 0.12 0.00 0.00 29.99 30.38 1tnj n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1tnj n TYR 59 N -1.24 1.74 -3.59 0.00 9.36 -0.52 -4.99 117.16 117.92 1tnj n TYR 59 Ca 0.11 0.54 -0.15 0.00 3.32 0.00 0.00 57.90 61.72 1tnj n TYR 59 Cb 0.30 -2.38 -0.06 0.00 -0.63 0.00 0.00 39.34 36.57 1tnj n TYR 59 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 1tnj s LYS 60 N -0.17 0.99 0.48 2.98 2.20 -1.26 -5.15 119.74 119.81 1tnj s LYS 60 Ca 0.73 -0.13 -0.08 0.00 -0.36 0.00 0.00 55.97 56.13 1tnj s LYS 60 Cb -0.77 0.45 -0.05 0.00 -1.51 0.00 0.00 37.83 35.95 1tnj s LYS 60 CO 0.49 -0.34 0.82 -1.54 -0.36 0.00 0.00 175.35 174.43 1tnj s SER 61 N -1.72 6.36 -0.99 1.43 1.04 -1.26 -4.51 113.70 114.06 1tnj s SER 61 Ca -0.08 1.10 -0.04 0.00 0.48 0.00 0.00 55.95 57.41 1tnj s SER 61 Cb -0.01 -2.32 0.00 0.00 0.10 0.00 0.00 66.02 63.80 1tnj s SER 61 CO 0.02 -0.56 0.85 0.61 0.98 0.00 0.00 173.24 175.14 1tnj n GLY 62 N -1.96 -0.18 3.71 7.32 0.00 -1.26 -5.00 105.19 107.83 1tnj n GLY 62 Ca 0.02 0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1tnj n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tnj s ILE 63 N -3.26 5.00 -0.15 -0.61 1.01 -1.26 -4.63 121.20 117.31 1tnj s ILE 63 Ca 0.27 1.58 -0.04 0.00 0.00 0.00 0.00 60.65 62.46 1tnj s ILE 63 Cb -0.12 -4.10 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 1tnj s ILE 63 CO 0.55 0.22 -0.03 -1.58 0.00 0.00 0.00 174.94 174.10 1tnj s GLN 64 N 0.89 3.66 -0.22 2.79 0.74 -0.17 -1.27 119.66 126.08 1tnj s GLN 64 Ca 0.41 -0.51 -0.19 0.00 0.05 0.00 0.00 55.36 55.12 1tnj s GLN 64 Cb -0.18 -2.91 -0.03 0.00 1.10 0.00 0.00 33.01 30.98 1tnj s GLN 64 CO 0.20 0.26 0.53 0.08 -0.55 0.00 0.00 175.29 175.82 1tnj s VAL 65 N 0.31 5.08 -0.33 1.34 1.01 0.41 -1.02 120.40 127.21 1tnj s VAL 65 Ca -0.03 0.97 -0.06 0.00 0.00 0.00 0.00 61.98 62.86 1tnj s VAL 65 Cb -0.14 -3.85 0.04 0.00 0.00 0.00 0.00 36.38 32.43 1tnj s VAL 65 CO 0.03 0.14 0.09 -0.13 0.00 0.00 0.00 175.10 175.23 1tnj s ARG 66 N 1.86 2.63 0.22 2.72 0.52 -0.21 -0.73 118.95 125.95 1tnj s ARG 66 Ca 0.24 -1.17 0.04 0.00 -0.52 0.00 0.00 55.73 54.32 1tnj s ARG 66 Cb -0.15 -3.42 -0.03 0.00 0.52 0.00 0.00 34.95 31.86 1tnj s ARG 66 CO 0.09 -0.65 0.35 -0.51 0.02 0.00 0.00 175.30 174.61 1tnj s LEU 67 N 1.39 4.32 -1.36 2.53 1.43 -0.04 -1.03 118.68 125.92 1tnj s LEU 67 Ca -0.02 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 1tnj s LEU 67 Cb -0.19 -2.88 0.00 0.00 0.03 0.00 0.00 46.19 43.14 1tnj s LEU 67 CO 0.02 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.16 1tnj n GLY 69 N -1.24 1.05 3.78 -3.19 0.00 -1.26 -1.28 105.19 103.05 1tnj n GLY 69 Ca -0.08 -0.38 -0.39 0.00 0.00 0.00 0.00 46.02 45.16 1tnj n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tnj s GLU 70 N -3.49 4.47 0.00 1.61 0.41 -1.26 -3.73 118.70 116.71 1tnj s GLU 70 Ca 0.00 1.04 0.00 0.00 -0.41 0.00 0.00 54.97 55.60 1tnj s GLU 70 Cb 0.00 -3.27 0.00 0.00 -1.78 0.00 0.00 34.13 29.08 1tnj s GLU 70 CO 0.00 0.56 0.00 -3.47 -0.49 0.00 0.00 175.26 171.86 1tnj n ASP 71 N 1.74 0.00 -4.59 -0.19 2.03 -1.26 -4.62 116.55 109.65 1tnj n ASP 71 Ca -0.07 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.82 1tnj n ASP 71 Cb 0.49 -0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.87 1tnj n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1tnj s ASN 72 N 0.58 6.20 0.01 1.67 3.04 -1.25 -3.48 114.94 121.71 1tnj s ASN 72 Ca 0.00 0.77 0.18 0.00 0.04 0.00 0.00 52.86 53.85 1tnj s ASN 72 Cb 0.00 -2.54 0.77 0.00 -1.54 0.00 0.00 41.25 37.94 1tnj s ASN 72 CO 0.00 -1.56 1.58 2.30 -3.04 0.00 0.00 177.10 176.38 1tnj n ILE 73 N 7.10 0.77 1.02 -5.21 -5.35 -0.25 -2.44 119.36 115.00 1tnj n ILE 73 Ca 0.17 0.19 0.12 0.00 -0.27 0.00 0.00 62.75 62.95 1tnj n ILE 73 Cb 0.48 -0.89 0.07 0.00 -1.74 0.00 0.00 39.64 37.56 1tnj n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1tnj n ASN 74 N -1.53 2.44 -3.98 7.28 3.02 -1.26 -4.94 115.26 116.30 1tnj n ASN 74 Ca 0.04 -1.72 -0.22 0.00 -0.03 0.00 0.00 54.58 52.65 1tnj n ASN 74 Cb 0.21 0.24 -0.16 0.00 -0.61 0.00 0.00 39.78 39.46 1tnj n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1tnj s VAL 75 N -2.25 0.88 -0.48 2.41 1.01 -1.02 -5.09 120.40 115.85 1tnj s VAL 75 Ca 0.23 -0.34 -0.29 0.00 0.00 0.00 0.00 61.98 61.59 1tnj s VAL 75 Cb 0.19 -0.83 0.03 0.00 0.00 0.00 0.00 36.38 35.77 1tnj s VAL 75 CO 0.44 0.29 1.22 -0.69 0.00 0.00 0.00 175.10 176.36 1tnj s VAL 76 N 0.68 4.09 -0.58 2.92 1.01 -1.26 -4.64 120.40 122.62 1tnj s VAL 76 Ca -0.12 1.09 0.15 0.00 0.00 0.00 0.00 61.98 63.09 1tnj s VAL 76 Cb -0.14 -4.54 -0.17 0.00 0.00 0.00 0.00 36.38 31.53 1tnj s VAL 76 CO 0.02 -1.02 0.57 -0.62 0.00 0.00 0.00 175.10 174.05 1tnj n GLU 77 N 8.03 1.91 0.00 2.72 1.02 -1.26 -5.03 120.64 128.03 1tnj n GLU 77 Ca 0.12 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1tnj n GLU 77 Cb 0.49 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.69 1tnj n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tnj n GLY 78 N 1.39 2.00 1.16 0.62 0.00 -1.26 -4.98 105.19 104.13 1tnj n GLY 78 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1tnj n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tnj n ASN 79 N 0.00 3.47 -4.78 1.61 3.02 -1.26 -5.00 115.26 112.31 1tnj n ASN 79 Ca 0.00 -2.00 -0.36 0.00 -0.03 0.00 0.00 54.58 52.19 1tnj n ASN 79 Cb 0.00 -0.25 -0.02 0.00 -0.61 0.00 0.00 39.78 38.90 1tnj n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1tnj s GLU 80 N -1.51 3.88 -0.13 3.52 8.01 -1.24 -4.33 118.70 126.90 1tnj s GLU 80 Ca 0.39 1.62 -0.01 0.00 0.01 0.00 0.00 54.97 56.98 1tnj s GLU 80 Cb 0.23 -2.39 0.03 0.00 -4.31 0.00 0.00 34.13 27.69 1tnj s GLU 80 CO 0.32 -0.41 -0.05 -0.65 0.01 0.00 0.00 175.26 174.47 1tnj s GLN 81 N -2.73 1.32 -0.38 1.61 -0.21 -0.40 -4.96 119.66 113.90 1tnj s GLN 81 Ca 0.63 -0.29 -0.09 0.00 0.02 0.00 0.00 55.36 55.62 1tnj s GLN 81 Cb -0.24 -1.66 0.04 0.00 1.00 0.00 0.00 33.01 32.15 1tnj s GLN 81 CO 0.30 -0.35 0.20 -0.06 -2.12 0.00 0.00 175.29 173.26 1tnj s PHE 82 N 1.73 3.27 -0.11 0.91 0.08 -1.26 -0.86 117.98 121.74 1tnj s PHE 82 Ca 0.03 -1.22 0.03 0.00 0.12 0.00 0.00 56.93 55.89 1tnj s PHE 82 Cb -0.14 -2.53 0.01 0.00 -0.57 0.00 0.00 43.02 39.79 1tnj s PHE 82 CO -0.08 -0.72 -0.20 0.42 -0.10 0.00 0.00 175.22 174.54 1tnj s ILE 83 N 1.48 1.81 0.46 0.64 1.01 0.09 -4.96 121.20 121.74 1tnj s ILE 83 Ca 0.01 -0.85 -0.22 0.00 0.00 0.00 0.00 60.65 59.59 1tnj s ILE 83 Cb -0.20 -1.60 -0.08 0.00 0.01 0.00 0.00 42.46 40.59 1tnj s ILE 83 CO 0.05 0.50 1.10 -0.55 0.00 0.00 0.00 174.94 176.04 1tnj s SER 84 N 0.68 6.29 0.20 3.58 0.15 -1.26 -0.44 113.70 122.90 1tnj s SER 84 Ca -0.12 2.12 -0.30 0.00 0.70 0.00 0.00 55.95 58.36 1tnj s SER 84 Cb -0.16 -2.58 -0.08 0.00 -1.71 0.00 0.00 66.02 61.48 1tnj s SER 84 CO 0.03 -0.82 1.09 0.00 1.20 0.00 0.00 173.24 174.73 1tnj s ALA 85 N -1.71 3.37 -0.11 5.45 0.00 -0.40 -1.02 121.76 127.34 1tnj s ALA 85 Ca 0.64 0.81 0.20 0.00 0.00 0.00 0.00 51.96 53.62 1tnj s ALA 85 Cb -0.23 -3.33 -0.28 0.00 0.00 0.00 0.00 23.12 19.27 1tnj s ALA 85 CO 0.28 -0.16 0.36 -1.13 0.00 0.00 0.00 175.76 175.10 1tnj n SER 86 N 2.08 0.09 -3.69 0.00 3.41 0.73 -4.72 113.62 111.52 1tnj n SER 86 Ca 0.02 0.04 -0.14 0.00 -0.26 0.00 0.00 58.87 58.53 1tnj n SER 86 Cb 0.46 1.42 -0.09 0.00 -0.26 0.00 0.00 64.21 65.74 1tnj n SER 86 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1tnj s LYS 87 N -3.06 0.66 -0.04 4.33 2.20 -1.21 -5.02 119.74 117.59 1tnj s LYS 87 Ca -0.08 0.61 0.05 0.00 -0.36 0.00 0.00 55.97 56.19 1tnj s LYS 87 Cb 0.10 0.32 -0.01 0.00 -1.51 0.00 0.00 37.83 36.73 1tnj s LYS 87 CO 0.87 -0.11 -0.21 -1.12 -0.36 0.00 0.00 175.35 174.42 1tnj s SER 88 N 0.01 2.61 -0.26 1.43 0.01 -1.26 -0.49 113.70 115.74 1tnj s SER 88 Ca -0.02 -0.43 0.01 0.00 1.31 0.00 0.00 55.95 56.82 1tnj s SER 88 Cb -0.03 -0.65 0.07 0.00 0.21 0.00 0.00 66.02 65.62 1tnj s SER 88 CO 0.02 0.21 -0.03 -0.63 0.41 0.00 0.00 173.24 173.22 1tnj s ILE 89 N -0.14 1.65 0.28 1.44 1.01 0.55 -4.99 121.20 121.00 1tnj s ILE 89 Ca -0.02 -1.47 -0.27 0.00 0.00 0.00 0.00 60.65 58.89 1tnj s ILE 89 Cb -0.12 -1.98 -0.09 0.00 0.01 0.00 0.00 42.46 40.28 1tnj s ILE 89 CO 0.02 -0.24 0.93 -0.69 0.00 0.00 0.00 174.94 174.96 1tnj s VAL 90 N 1.31 4.18 0.15 2.92 1.01 -1.26 -1.42 120.40 127.29 1tnj s VAL 90 Ca -0.02 1.90 -0.33 0.00 0.00 0.00 0.00 61.98 63.53 1tnj s VAL 90 Cb -0.19 -4.12 -0.16 0.00 0.00 0.00 0.00 36.38 31.90 1tnj s VAL 90 CO -0.08 0.29 1.08 1.57 0.00 0.00 0.00 175.10 177.95 1tnj n HIS 91 N 0.94 1.00 0.29 5.22 -0.00 -0.59 -4.84 115.22 117.24 1tnj n HIS 91 Ca 0.00 0.77 0.15 0.00 0.46 0.00 0.00 57.72 59.10 1tnj n HIS 91 Cb 0.49 -2.22 0.86 0.00 -0.12 0.00 0.00 29.99 29.00 1tnj n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1tnj h PRO 92 N 3.05 0.00 -0.43 1.57 0.13 -1.93 -1.85 132.00 132.54 1tnj h PRO 92 Ca -0.43 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.62 1tnj h PRO 92 Cb 1.37 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.45 1tnj h PRO 92 CO 0.68 0.06 0.06 0.43 -0.23 0.00 0.00 178.00 178.99 1tnj n SER 93 N -3.61 4.09 -4.69 1.44 7.64 -1.26 -5.01 113.62 112.22 1tnj n SER 93 Ca -0.02 -3.19 -0.42 0.00 1.01 0.00 0.00 58.87 56.25 1tnj n SER 93 Cb 0.16 -0.63 -0.03 0.00 -1.01 0.00 0.00 64.21 62.71 1tnj n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1tnj s TYR 94 N -2.94 2.22 -0.33 1.43 5.04 -0.70 -4.64 117.35 117.43 1tnj s TYR 94 Ca 0.47 0.05 -0.06 0.00 -2.44 0.00 0.00 57.07 55.10 1tnj s TYR 94 Cb 0.39 -4.14 0.04 0.00 0.35 0.00 0.00 41.96 38.60 1tnj s TYR 94 CO 0.09 -4.67 0.09 1.21 -1.34 0.00 0.00 175.55 170.93 1tnj s ASN 95 N 2.60 5.24 0.27 4.32 3.84 -0.47 -4.99 114.94 125.75 1tnj s ASN 95 Ca 0.79 -1.17 0.24 0.00 0.21 0.00 0.00 52.86 52.94 1tnj s ASN 95 Cb -0.45 -1.84 0.99 0.00 -0.55 0.00 0.00 41.25 39.39 1tnj s ASN 95 CO 0.35 -0.32 1.73 0.77 -2.79 0.00 0.00 177.10 176.85 1tnj h SER 96 N 8.18 0.00 0.16 -4.21 4.64 -1.94 0.32 113.55 120.71 1tnj h SER 96 Ca -0.23 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.87 1tnj h SER 96 Cb 1.08 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.19 1tnj h SER 96 CO 0.59 0.00 -0.95 0.78 -0.87 0.00 0.00 176.83 176.38 1tnj h ASN 97 N 0.00 0.55 0.61 4.97 2.35 -1.97 -3.36 115.58 118.74 1tnj h ASN 97 Ca 0.00 -0.94 0.00 0.00 -0.55 0.00 0.00 56.30 54.81 1tnj h ASN 97 Cb 0.41 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1tnj h ASN 97 CO 0.00 1.46 -0.93 0.35 -1.65 0.00 0.00 177.43 176.66 1tnj n THR 98 N -4.04 0.27 -1.25 2.81 -2.24 -1.16 -4.95 114.28 103.72 1tnj n THR 98 Ca -0.14 -0.29 -0.08 0.00 -2.27 0.00 0.00 64.05 61.26 1tnj n THR 98 Cb 0.88 0.04 -0.04 0.00 -2.10 0.00 0.00 70.33 69.11 1tnj n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1tnj n LEU 99 N -2.09 -0.36 -4.75 3.22 7.99 0.11 -4.99 117.00 116.13 1tnj n LEU 99 Ca 0.02 0.21 -0.41 0.00 -0.01 0.00 0.00 56.01 55.82 1tnj n LEU 99 Cb 0.45 -1.97 -0.02 0.00 -0.11 0.00 0.00 43.42 41.77 1tnj n LEU 99 CO 0.39 -0.70 1.04 0.21 -1.51 0.00 0.00 177.39 176.83 1tnj s ASN 100 N -2.52 6.75 -1.12 -1.43 2.47 -1.21 -3.13 114.94 114.74 1tnj s ASN 100 Ca 0.00 2.60 -0.04 0.00 0.42 0.00 0.00 52.86 55.84 1tnj s ASN 100 Cb 0.00 -2.63 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 1tnj s ASN 100 CO 0.00 -0.62 0.96 0.59 -3.72 0.00 0.00 177.10 174.31 1tnj n ASN 101 N 2.08 -3.95 -4.47 -4.21 3.02 -1.26 -1.37 115.26 105.09 1tnj n ASN 101 Ca 0.05 -0.51 -0.42 0.00 -0.03 0.00 0.00 54.58 53.67 1tnj n ASN 101 Cb 0.41 -4.51 -0.00 0.00 -0.61 0.00 0.00 39.78 35.06 1tnj n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1tnj n ASP 102 N -2.66 4.66 -3.74 6.41 2.03 -1.18 -4.35 116.55 117.71 1tnj n ASP 102 Ca -0.12 -2.89 -0.13 0.00 0.52 0.00 0.00 54.79 52.16 1tnj n ASP 102 Cb 0.60 -1.73 -0.10 0.00 -0.72 0.00 0.00 41.12 39.17 1tnj n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1tnj s ILE 103 N 4.58 -0.00 0.05 5.18 2.07 -1.26 -3.91 121.20 127.91 1tnj s ILE 103 Ca 0.54 0.01 -0.08 0.00 -1.41 0.00 0.00 60.65 59.71 1tnj s ILE 103 Cb 0.05 -0.54 -0.00 0.00 0.13 0.00 0.00 42.46 42.10 1tnj s ILE 103 CO 0.06 0.00 0.16 0.00 -1.91 0.00 0.00 174.94 173.25 1tnj s MET 104 N 0.27 0.68 -0.02 3.50 0.23 -0.39 -1.54 119.30 122.03 1tnj s MET 104 Ca -0.01 -0.74 0.02 0.00 -1.03 0.00 0.00 55.69 53.93 1tnj s MET 104 Cb -0.03 0.28 -0.03 0.00 -1.53 0.00 0.00 34.83 33.51 1tnj s MET 104 CO -0.00 -0.19 -0.05 -0.51 -2.03 0.00 0.00 175.02 172.24 1tnj s LEU 105 N -2.26 3.26 -0.12 0.18 1.43 -0.50 -0.83 118.68 119.84 1tnj s LEU 105 Ca -0.03 -0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.02 1tnj s LEU 105 Cb 0.00 -1.82 0.02 0.00 0.03 0.00 0.00 46.19 44.42 1tnj s LEU 105 CO -0.05 0.31 -0.14 -0.63 0.23 0.00 0.00 176.35 176.07 1tnj s ILE 106 N -0.95 1.46 -0.12 -0.59 1.01 0.48 -0.33 121.20 122.16 1tnj s ILE 106 Ca 0.16 -0.60 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 1tnj s ILE 106 Cb -0.11 -1.36 -0.05 0.00 0.01 0.00 0.00 42.46 40.95 1tnj s ILE 106 CO 0.06 0.44 0.32 -0.75 0.00 0.00 0.00 174.94 175.01 1tnj s LYS 107 N 1.22 4.12 0.39 2.79 2.20 0.35 -0.93 119.74 129.89 1tnj s LYS 107 Ca -0.02 0.18 -0.24 0.00 -0.36 0.00 0.00 55.97 55.53 1tnj s LYS 107 Cb -0.14 -3.36 -0.10 0.00 -1.51 0.00 0.00 37.83 32.72 1tnj s LYS 107 CO -0.05 0.37 1.00 -0.51 -0.36 0.00 0.00 175.35 175.80 1tnj s LEU 108 N 0.03 4.12 0.33 5.43 1.43 0.37 -0.19 118.68 130.20 1tnj s LEU 108 Ca 0.19 1.91 0.01 0.00 -1.03 0.00 0.00 54.13 55.21 1tnj s LEU 108 Cb -0.14 -4.25 0.58 0.00 0.03 0.00 0.00 46.19 42.41 1tnj s LEU 108 CO 0.07 -0.39 1.97 0.11 0.23 0.00 0.00 176.35 178.34 1tnj h LYS 109 N 2.46 0.84 -4.89 1.70 1.57 -1.36 -3.41 116.57 113.47 1tnj h LYS 109 Ca -0.48 -0.07 -0.29 0.00 -1.87 0.00 0.00 60.65 57.93 1tnj h LYS 109 Cb 1.20 -0.18 -0.15 0.00 0.08 0.00 0.00 32.23 33.19 1tnj h LYS 109 CO 0.62 0.60 -0.69 -1.54 -0.57 0.00 0.00 179.45 177.87 1tnj s SER 110 N -6.49 1.48 0.17 0.86 1.04 -1.26 -5.01 113.70 104.50 1tnj s SER 110 Ca -0.10 -1.07 -0.30 0.00 0.48 0.00 0.00 55.95 54.96 1tnj s SER 110 Cb 0.17 0.05 -0.08 0.00 0.10 0.00 0.00 66.02 66.27 1tnj s SER 110 CO 0.77 -0.44 1.13 0.00 0.98 0.00 0.00 173.24 175.68 1tnj s ALA 111 N -3.49 3.38 0.59 5.32 0.00 -1.26 -4.82 121.76 121.48 1tnj s ALA 111 Ca 0.18 0.85 -0.20 0.00 0.00 0.00 0.00 51.96 52.78 1tnj s ALA 111 Cb 0.04 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 1tnj s ALA 111 CO 0.01 -0.26 1.33 0.00 0.00 0.00 0.00 175.76 176.84 1tnj s ALA 112 N -0.15 2.64 -0.55 0.00 0.00 0.13 -4.98 121.76 118.86 1tnj s ALA 112 Ca 0.50 1.29 -0.23 0.00 0.00 0.00 0.00 51.96 53.52 1tnj s ALA 112 Cb -0.30 -3.56 0.05 0.00 0.00 0.00 0.00 23.12 19.30 1tnj s ALA 112 CO 0.35 -1.46 0.88 0.45 0.00 0.00 0.00 175.76 175.98 1tnj s SER 113 N -1.13 6.31 -0.04 0.00 0.15 -1.26 -4.85 113.70 112.87 1tnj s SER 113 Ca 0.76 -0.50 -0.24 0.00 0.70 0.00 0.00 55.95 56.68 1tnj s SER 113 Cb -0.39 -2.41 -0.04 0.00 -1.71 0.00 0.00 66.02 61.47 1tnj s SER 113 CO 0.44 -1.17 0.71 -0.76 1.20 0.00 0.00 173.24 173.67 1tnj s LEU 114 N 3.68 4.35 0.00 3.45 1.43 -1.26 -4.80 118.68 125.53 1tnj s LEU 114 Ca 0.27 1.24 0.00 0.00 -1.03 0.00 0.00 54.13 54.61 1tnj s LEU 114 Cb -0.14 -3.11 -0.00 0.00 0.03 0.00 0.00 46.19 42.97 1tnj s LEU 114 CO 0.17 -0.08 0.01 -0.46 0.23 0.00 0.00 176.35 176.22 1tnj n ASN 115 N 3.56 -0.03 0.03 2.29 0.23 0.10 -4.98 115.26 116.46 1tnj n ASN 115 Ca -0.02 -1.05 0.19 0.00 -0.53 0.00 0.00 54.58 53.17 1tnj n ASN 115 Cb 0.51 0.05 0.69 0.00 -2.08 0.00 0.00 39.78 38.95 1tnj n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1tnj h SER 116 N 0.05 0.00 0.00 0.53 4.64 -2.00 -2.84 113.55 113.93 1tnj h SER 116 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1tnj h SER 116 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1tnj h SER 116 CO 0.01 0.00 -1.51 0.54 -0.87 0.00 0.00 176.83 175.00 1tnj n ARG 117 N -4.38 0.54 -3.90 4.77 1.74 -1.26 -4.78 116.66 109.39 1tnj n ARG 117 Ca 0.08 -0.11 -0.29 0.00 -0.77 0.00 0.00 57.85 56.76 1tnj n ARG 117 Cb 0.54 -1.47 -0.16 0.00 -1.02 0.00 0.00 32.46 30.36 1tnj n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1tnj s VAL 118 N -3.19 1.22 -0.05 1.55 1.01 -1.07 -4.55 120.40 115.31 1tnj s VAL 118 Ca -0.01 -0.83 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 1tnj s VAL 118 Cb 0.14 -1.45 0.02 0.00 0.00 0.00 0.00 36.38 35.09 1tnj s VAL 118 CO 0.84 0.03 0.23 0.00 0.00 0.00 0.00 175.10 176.19 1tnj s ALA 119 N 1.57 -0.56 0.57 5.51 0.00 -0.94 0.01 121.76 127.91 1tnj s ALA 119 Ca -0.02 0.42 -0.15 0.00 0.00 0.00 0.00 51.96 52.21 1tnj s ALA 119 Cb -0.17 -0.19 -0.05 0.00 0.00 0.00 0.00 23.12 22.71 1tnj s ALA 119 CO -0.07 -0.16 1.02 -1.54 0.00 0.00 0.00 175.76 175.01 1tnj s SER 120 N -0.49 6.15 -0.09 0.00 1.04 -1.26 -2.67 113.70 116.39 1tnj s SER 120 Ca -0.06 1.66 -0.02 0.00 0.48 0.00 0.00 55.95 58.01 1tnj s SER 120 Cb -0.04 -2.51 -0.03 0.00 0.10 0.00 0.00 66.02 63.54 1tnj s SER 120 CO 0.01 -0.91 0.01 -0.51 0.98 0.00 0.00 173.24 172.82 1tnj s ILE 121 N -2.65 4.38 0.28 -1.02 1.10 0.41 -4.87 121.20 118.83 1tnj s ILE 121 Ca 0.60 -0.23 -0.29 0.00 -0.51 0.00 0.00 60.65 60.22 1tnj s ILE 121 Cb -0.13 -2.85 -0.09 0.00 0.15 0.00 0.00 42.46 39.54 1tnj s ILE 121 CO 0.38 0.60 1.09 -0.44 -2.11 0.00 0.00 174.94 174.46 1tnj s SER 122 N -0.90 7.28 0.57 4.50 0.01 -1.26 -4.53 113.70 119.37 1tnj s SER 122 Ca 0.13 2.26 -0.17 0.00 1.31 0.00 0.00 55.95 59.48 1tnj s SER 122 Cb -0.11 -2.63 -0.05 0.00 0.21 0.00 0.00 66.02 63.44 1tnj s SER 122 CO 0.03 -0.13 1.07 -0.76 0.41 0.00 0.00 173.24 173.85 1tnj s LEU 123 N -1.40 3.61 0.47 2.44 1.43 -1.26 -0.96 118.68 123.01 1tnj s LEU 123 Ca 0.44 1.93 -0.20 0.00 -1.03 0.00 0.00 54.13 55.28 1tnj s LEU 123 Cb -0.32 -4.55 -0.09 0.00 0.03 0.00 0.00 46.19 41.26 1tnj s LEU 123 CO 0.41 -1.14 0.99 -2.16 0.23 0.00 0.00 176.35 174.68 1tnj s PRO 124 N -3.73 3.98 0.00 1.29 0.04 -1.26 -4.79 135.00 130.53 1tnj s PRO 124 Ca 0.67 1.17 0.17 0.00 0.04 0.00 0.00 61.00 63.05 1tnj s PRO 124 Cb -0.18 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 1tnj s PRO 124 CO 0.31 -0.25 0.87 0.25 0.04 0.00 0.00 177.00 178.22 1tnj n THR 125 N -1.00 0.00 -4.03 1.26 -2.24 -1.26 -4.96 114.28 102.05 1tnj n THR 125 Ca 0.08 -0.28 -0.12 0.00 -2.27 0.00 0.00 64.05 61.46 1tnj n THR 125 Cb 0.53 1.17 -0.12 0.00 -2.10 0.00 0.00 70.33 69.82 1tnj n THR 125 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1tnj s SER 127 N -2.10 0.54 0.21 3.42 0.01 -1.26 -5.13 113.70 109.39 1tnj s SER 127 Ca 0.13 -0.44 -0.30 0.00 1.31 0.00 0.00 55.95 56.65 1tnj s SER 127 Cb 0.14 0.05 -0.08 0.00 0.21 0.00 0.00 66.02 66.33 1tnj s SER 127 CO 0.48 -0.20 1.03 0.00 0.41 0.00 0.00 173.24 174.96 1tnj s ALA 129 N -0.74 3.30 0.40 0.00 0.00 -1.26 -5.04 121.76 118.42 1tnj s ALA 129 Ca 0.45 0.86 -0.12 0.00 0.00 0.00 0.00 51.96 53.15 1tnj s ALA 129 Cb -0.28 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.45 1tnj s ALA 129 CO 0.35 -0.21 0.78 -1.12 0.00 0.00 0.00 175.76 175.55 1tnj s SER 130 N -1.07 6.57 0.29 0.00 0.01 -1.26 -5.02 113.70 113.21 1tnj s SER 130 Ca 0.49 1.18 -0.28 0.00 1.31 0.00 0.00 55.95 58.65 1tnj s SER 130 Cb -0.29 -2.34 -0.14 0.00 0.21 0.00 0.00 66.02 63.45 1tnj s SER 130 CO 0.38 -0.38 0.95 0.00 0.41 0.00 0.00 173.24 174.60 1tnj n ALA 132 N -1.16 -0.50 0.00 1.44 0.00 -1.26 -2.13 120.51 116.89 1tnj n ALA 132 Ca 0.03 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1tnj n ALA 132 Cb 0.54 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 18.01 1tnj n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tnj n GLY 133 N 1.30 3.23 3.71 0.00 0.00 0.39 -4.96 105.19 108.87 1tnj n GLY 133 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1tnj n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tnj s THR 134 N -2.74 2.73 0.18 2.61 2.01 -0.91 -4.69 115.64 114.84 1tnj s THR 134 Ca 0.00 0.48 -0.26 0.00 0.31 0.00 0.00 61.69 62.21 1tnj s THR 134 Cb 0.00 -3.31 -0.08 0.00 0.01 0.00 0.00 72.50 69.12 1tnj s THR 134 CO 0.00 0.03 0.81 -1.58 -0.69 0.00 0.00 174.62 173.19 1tnj s GLN 135 N 1.42 4.63 0.10 4.92 0.74 -1.26 -0.71 119.66 129.51 1tnj s GLN 135 Ca 0.71 1.23 0.01 0.00 0.05 0.00 0.00 55.36 57.35 1tnj s GLN 135 Cb -0.43 -3.26 -0.04 0.00 1.10 0.00 0.00 33.01 30.38 1tnj s GLN 135 CO 0.31 0.56 -0.03 0.00 -0.55 0.00 0.00 175.29 175.59 1tnj s LEU 137 N -3.04 2.99 -0.13 0.00 2.96 -0.18 -0.89 118.68 120.39 1tnj s LEU 137 Ca 0.15 -0.33 -0.01 0.00 -0.22 0.00 0.00 54.13 53.72 1tnj s LEU 137 Cb 0.06 -1.76 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 1tnj s LEU 137 CO -0.03 0.02 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.30 1tnj s ILE 138 N 1.26 3.47 0.02 6.68 1.01 0.60 -1.63 121.20 132.61 1tnj s ILE 138 Ca 0.03 -0.52 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 1tnj s ILE 138 Cb -0.14 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.84 1tnj s ILE 138 CO -0.01 0.53 -0.01 -0.94 0.00 0.00 0.00 174.94 174.51 1tnj s SER 139 N 0.12 0.22 0.00 3.58 1.04 -1.21 -0.02 113.70 117.43 1tnj s SER 139 Ca -0.04 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 55.91 1tnj s SER 139 Cb -0.14 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.10 1tnj s SER 139 CO 0.04 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.54 1tnj n GLY 140 N 1.49 -0.05 1.28 7.32 0.00 -0.48 -4.40 105.19 110.35 1tnj n GLY 140 Ca -0.23 -0.98 0.09 0.00 0.00 0.00 0.00 46.02 44.90 1tnj n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1tnj n TRP 141 N -0.23 1.15 -1.17 1.61 8.01 -1.26 -1.69 117.44 123.85 1tnj n TRP 141 Ca 0.00 -0.61 -0.30 0.00 -1.31 0.00 0.00 57.50 55.28 1tnj n TRP 141 Cb 0.00 -0.18 0.23 0.00 -2.01 0.00 0.00 31.31 29.35 1tnj n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1tnj s GLY 142 N -1.08 1.60 0.26 6.99 0.00 -1.25 -4.30 107.32 109.54 1tnj s GLY 142 Ca 0.44 -0.97 -0.30 0.00 0.00 0.00 0.00 44.72 43.90 1tnj s GLY 142 CO 0.22 -0.10 1.21 -2.01 0.00 0.00 0.00 173.10 172.42 1tnj n ASN 143 N -4.65 2.01 -0.89 1.64 5.15 0.59 -2.76 115.26 116.35 1tnj n ASN 143 Ca 0.13 1.17 0.11 0.00 -0.60 0.00 0.00 54.58 55.39 1tnj n ASN 143 Cb 0.59 -1.35 0.10 0.00 -0.53 0.00 0.00 39.78 38.59 1tnj n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1tnj n THR 144 N 0.96 0.03 -4.91 -0.44 -2.24 -0.62 -0.72 114.28 106.35 1tnj n THR 144 Ca 0.10 -0.51 -0.33 0.00 -2.27 0.00 0.00 64.05 61.04 1tnj n THR 144 Cb 0.31 1.44 -0.14 0.00 -2.10 0.00 0.00 70.33 69.83 1tnj n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1tnj s LYS 145 N -1.82 3.01 0.40 -0.78 -0.14 -1.26 -4.45 119.74 114.69 1tnj s LYS 145 Ca 0.26 -0.73 0.28 0.00 -1.36 0.00 0.00 55.97 54.42 1tnj s LYS 145 Cb 0.19 -2.48 1.07 0.00 -1.68 0.00 0.00 37.83 34.93 1tnj s LYS 145 CO 0.28 0.35 1.83 0.66 -0.76 0.00 0.00 175.35 177.70 1tnj h SER 146 N 6.23 0.00 -3.22 2.83 4.64 -1.92 -3.41 113.55 118.69 1tnj h SER 146 Ca -0.32 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.52 1tnj h SER 146 Cb 1.19 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.89 1tnj h SER 146 CO 0.52 0.00 -0.76 -0.94 -0.87 0.00 0.00 176.83 174.78 1tnj s SER 147 N -5.09 2.46 0.00 4.97 1.04 -1.26 -4.70 113.70 111.12 1tnj s SER 147 Ca 0.04 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.87 1tnj s SER 147 Cb 0.09 -0.48 0.00 0.00 0.10 0.00 0.00 66.02 65.73 1tnj s SER 147 CO 0.51 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 175.05 1tnj n GLY 148 N 5.12 -2.24 2.90 7.32 0.00 -1.26 -5.00 105.19 112.03 1tnj n GLY 148 Ca -0.08 -1.55 -0.19 0.00 0.00 0.00 0.00 46.02 44.21 1tnj n GLY 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tnj s THR 149 N -0.39 0.48 -0.24 2.61 -4.23 -1.26 -4.47 115.64 108.14 1tnj s THR 149 Ca 0.00 -0.12 -0.04 0.00 -1.18 0.00 0.00 61.69 60.35 1tnj s THR 149 Cb 0.00 -0.49 0.13 0.00 1.34 0.00 0.00 72.50 73.48 1tnj s THR 149 CO 0.00 0.20 0.42 -0.55 -0.54 0.00 0.00 174.62 174.15 1tnj s SER 150 N 0.71 -0.10 -0.26 3.99 0.15 -1.26 -5.00 113.70 111.93 1tnj s SER 150 Ca -0.09 0.52 -0.18 0.00 0.70 0.00 0.00 55.95 56.90 1tnj s SER 150 Cb -0.12 1.32 -0.03 0.00 -1.71 0.00 0.00 66.02 65.48 1tnj s SER 150 CO -0.00 -0.28 0.51 -0.31 1.20 0.00 0.00 173.24 174.36 1tnj s TYR 151 N 2.61 3.27 0.61 3.44 1.51 -1.26 -1.58 117.35 125.94 1tnj s TYR 151 Ca 0.10 0.64 -0.17 0.00 -1.01 0.00 0.00 57.07 56.63 1tnj s TYR 151 Cb -0.14 -2.71 -0.03 0.00 -0.11 0.00 0.00 41.96 38.97 1tnj s TYR 151 CO -0.16 -0.26 1.10 -1.25 -1.11 0.00 0.00 175.55 173.87 1tnj s PRO 152 N 2.24 3.10 0.11 -1.71 0.04 -1.26 -4.98 135.00 132.54 1tnj s PRO 152 Ca 0.21 1.42 0.21 0.00 0.04 0.00 0.00 61.00 62.88 1tnj s PRO 152 Cb -0.16 -1.99 -0.11 0.00 0.04 0.00 0.00 34.50 32.29 1tnj s PRO 152 CO 0.09 -1.02 0.84 -0.25 0.04 0.00 0.00 177.00 176.71 1tnj n ASP 153 N -1.96 0.65 -4.81 6.66 8.00 -1.26 -4.88 116.55 118.95 1tnj n ASP 153 Ca 0.10 0.26 -0.27 0.00 0.71 0.00 0.00 54.79 55.60 1tnj n ASP 153 Cb 0.52 0.72 -0.05 0.00 -0.02 0.00 0.00 41.12 42.29 1tnj n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1tnj s VAL 154 N -3.27 4.58 0.20 2.53 -7.23 -1.26 -1.09 120.40 114.86 1tnj s VAL 154 Ca -0.03 -1.00 -0.31 0.00 -1.81 0.00 0.00 61.98 58.84 1tnj s VAL 154 Cb 0.10 -3.32 -0.09 0.00 0.56 0.00 0.00 36.38 33.63 1tnj s VAL 154 CO 0.82 -0.07 1.45 -0.22 -0.31 0.00 0.00 175.10 176.76 1tnj s LEU 155 N -3.02 4.38 -0.01 1.32 2.96 -1.23 -4.82 118.68 118.27 1tnj s LEU 155 Ca 0.31 2.56 0.00 0.00 -0.22 0.00 0.00 54.13 56.78 1tnj s LEU 155 Cb -0.10 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 1tnj s LEU 155 CO 0.24 -0.70 0.04 -0.54 -1.32 0.00 0.00 176.35 174.06 1tnj s LYS 156 N 0.30 2.92 0.06 1.98 -0.14 -0.68 -1.28 119.74 122.91 1tnj s LYS 156 Ca 0.63 -0.55 0.09 0.00 -1.36 0.00 0.00 55.97 54.78 1tnj s LYS 156 Cb -0.41 -2.76 -0.03 0.00 -1.68 0.00 0.00 37.83 32.95 1tnj s LYS 156 CO 0.37 0.64 -0.25 0.00 -0.76 0.00 0.00 175.35 175.35 1tnj s LEU 158 N -1.41 0.84 -0.18 0.00 2.96 0.98 -1.29 118.68 120.58 1tnj s LEU 158 Ca 0.11 0.21 -0.14 0.00 -0.22 0.00 0.00 54.13 54.09 1tnj s LEU 158 Cb -0.10 0.22 -0.05 0.00 0.50 0.00 0.00 46.19 46.77 1tnj s LEU 158 CO 0.03 -0.14 0.30 -0.54 -1.32 0.00 0.00 176.35 174.67 1tnj s LYS 159 N 1.14 4.22 -0.02 1.98 1.02 -1.26 -0.29 119.74 126.54 1tnj s LYS 159 Ca -0.09 0.07 -0.11 0.00 0.02 0.00 0.00 55.97 55.86 1tnj s LYS 159 Cb -0.12 -3.46 0.01 0.00 -0.52 0.00 0.00 37.83 33.74 1tnj s LYS 159 CO -0.05 0.16 0.23 0.00 -0.92 0.00 0.00 175.35 174.77 1tnj s ALA 160 N 0.70 -0.56 0.26 5.17 0.00 -0.07 -4.93 121.76 122.32 1tnj s ALA 160 Ca 0.16 0.19 -0.13 0.00 0.00 0.00 0.00 51.96 52.18 1tnj s ALA 160 Cb -0.13 0.02 -0.08 0.00 0.00 0.00 0.00 23.12 22.92 1tnj s ALA 160 CO 0.05 -0.22 0.64 -1.25 0.00 0.00 0.00 175.76 174.98 1tnj s PRO 161 N -1.13 3.93 0.09 0.00 0.04 -1.26 -0.11 135.00 136.56 1tnj s PRO 161 Ca -0.12 0.50 -0.31 0.00 0.04 0.00 0.00 61.00 61.11 1tnj s PRO 161 Cb -0.06 -2.60 -0.08 0.00 0.04 0.00 0.00 34.50 31.81 1tnj s PRO 161 CO 0.03 0.27 1.48 0.42 0.04 0.00 0.00 177.00 179.23 1tnj s ILE 162 N -1.84 3.21 0.38 0.56 1.01 0.11 -1.50 121.20 123.13 1tnj s ILE 162 Ca 0.49 0.78 -0.15 0.00 0.00 0.00 0.00 60.65 61.78 1tnj s ILE 162 Cb -0.11 -3.50 -0.08 0.00 0.01 0.00 0.00 42.46 38.77 1tnj s ILE 162 CO 0.19 0.04 0.80 -0.76 0.00 0.00 0.00 174.94 175.21 1tnj s LEU 163 N 1.69 3.93 0.50 2.97 1.43 -0.39 -0.46 118.68 128.35 1tnj s LEU 163 Ca 0.67 1.32 -0.22 0.00 -1.03 0.00 0.00 54.13 54.88 1tnj s LEU 163 Cb -0.38 -4.17 -0.07 0.00 0.03 0.00 0.00 46.19 41.60 1tnj s LEU 163 CO 0.30 -0.33 1.17 -1.54 0.23 0.00 0.00 176.35 176.18 1tnj n SER 164 N -0.82 1.88 0.16 2.29 3.41 -1.26 -4.62 113.62 114.67 1tnj n SER 164 Ca 0.04 0.98 0.06 0.00 -0.26 0.00 0.00 58.87 59.69 1tnj n SER 164 Cb 0.54 -1.47 0.54 0.00 -0.26 0.00 0.00 64.21 63.56 1tnj n SER 164 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1tnj h ASP 165 N 1.38 0.18 0.05 4.04 3.58 -1.97 -1.54 116.42 122.14 1tnj h ASP 165 Ca -0.48 -0.01 -0.18 0.00 0.42 0.00 0.00 57.03 56.78 1tnj h ASP 165 Cb 1.32 -0.04 -0.00 0.00 1.72 0.00 0.00 39.33 42.33 1tnj h ASP 165 CO 0.56 0.16 -0.65 0.77 -2.88 0.00 0.00 179.24 177.20 1tnj h SER 166 N 0.21 0.66 0.95 2.28 4.64 -1.99 0.29 113.55 120.58 1tnj h SER 166 Ca 0.05 -0.39 -0.10 0.00 -0.47 0.00 0.00 61.79 60.88 1tnj h SER 166 Cb 0.03 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 1tnj h SER 166 CO -0.01 1.13 -0.47 0.77 -0.87 0.00 0.00 176.83 177.38 1tnj h SER 167 N 0.41 0.00 -0.01 4.97 4.64 -1.82 -1.67 113.55 120.07 1tnj h SER 167 Ca -0.02 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1tnj h SER 167 Cb 1.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1tnj h SER 167 CO 0.12 0.47 0.00 0.00 -0.87 0.00 0.00 176.83 176.56 1tnj h LYS 169 N -0.27 0.16 -0.03 0.00 1.57 -0.94 -1.26 116.57 115.80 1tnj h LYS 169 Ca 0.00 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.62 1tnj h LYS 169 Cb 0.29 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1tnj h LYS 169 CO 0.00 0.34 -0.57 0.77 -0.57 0.00 0.00 179.45 179.42 1tnj h SER 170 N 0.15 0.11 0.33 0.86 0.02 -1.23 -2.27 113.55 111.53 1tnj h SER 170 Ca 0.03 -0.06 -0.20 0.00 -0.84 0.00 0.00 61.79 60.72 1tnj h SER 170 Cb 0.40 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 1tnj h SER 170 CO 0.03 0.66 -0.82 0.00 -1.14 0.00 0.00 176.83 175.55 1tnj h ALA 171 N 1.35 0.51 -2.12 3.77 0.00 -0.74 -3.39 119.26 118.65 1tnj h ALA 171 Ca -0.00 -0.66 -0.58 0.00 0.00 0.00 0.00 54.91 53.67 1tnj h ALA 171 Cb 1.02 -0.05 -0.41 0.00 0.00 0.00 0.00 17.79 18.36 1tnj h ALA 171 CO 0.08 0.80 -0.80 0.66 0.00 0.00 0.00 179.25 179.99 1tnj n TYR 172 N -3.78 2.08 -1.64 0.00 4.01 -0.52 -4.91 117.16 112.39 1tnj n TYR 172 Ca -0.05 -3.92 -0.51 0.00 -0.16 0.00 0.00 57.90 53.26 1tnj n TYR 172 Cb 0.76 -0.47 -0.06 0.00 -0.31 0.00 0.00 39.34 39.26 1tnj n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1tnj n PRO 173 N 1.00 1.50 -0.98 -0.72 -0.02 -0.86 -1.96 135.00 132.96 1tnj n PRO 173 Ca 0.27 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1tnj n PRO 173 Cb 0.46 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 1tnj n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tnj n GLY 174 N 3.30 0.31 0.00 -1.23 0.00 -1.26 -4.83 105.19 101.48 1tnj n GLY 174 Ca 0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 1tnj n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tnj n GLN 175 N -1.32 2.86 -3.06 1.61 6.02 -0.83 -4.99 117.38 117.67 1tnj n GLN 175 Ca 0.00 -0.02 -0.41 0.00 -0.01 0.00 0.00 57.00 56.56 1tnj n GLN 175 Cb 0.20 -0.90 -0.06 0.00 1.02 0.00 0.00 30.24 30.50 1tnj n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1tnj s ILE 176 N -1.85 4.92 0.55 5.09 -1.09 -1.24 -5.02 121.20 122.55 1tnj s ILE 176 Ca -0.00 1.08 0.05 0.00 -2.23 0.00 0.00 60.65 59.54 1tnj s ILE 176 Cb 0.03 -4.01 0.05 0.00 -1.58 0.00 0.00 42.46 36.95 1tnj s ILE 176 CO 0.17 -0.09 0.76 0.42 -1.23 0.00 0.00 174.94 174.96 1tnj s THR 177 N 2.66 2.56 -1.59 2.92 -4.23 -1.26 -4.98 115.64 111.71 1tnj s THR 177 Ca 0.28 -0.83 0.12 0.00 -1.18 0.00 0.00 61.69 60.08 1tnj s THR 177 Cb -0.15 -2.73 0.25 0.00 1.34 0.00 0.00 72.50 71.21 1tnj s THR 177 CO 0.10 0.00 1.27 -1.54 -0.54 0.00 0.00 174.62 173.91 1tnj n SER 178 N -2.26 0.00 -1.52 3.99 3.41 -1.26 -2.11 113.62 113.87 1tnj n SER 178 Ca 0.11 -0.03 0.10 0.00 -0.26 0.00 0.00 58.87 58.79 1tnj n SER 178 Cb 0.60 -0.21 0.35 0.00 -0.26 0.00 0.00 64.21 64.69 1tnj n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1tnj n ASN 179 N -1.21 4.48 -4.14 4.04 3.02 -1.26 -4.91 115.26 115.28 1tnj n ASN 179 Ca 0.07 -2.28 -0.19 0.00 -0.03 0.00 0.00 54.58 52.15 1tnj n ASN 179 Cb 0.08 -0.55 -0.13 0.00 -0.61 0.00 0.00 39.78 38.57 1tnj n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1tnj s MET 180 N -1.55 0.85 0.10 3.52 -1.94 -0.90 -0.75 119.30 118.65 1tnj s MET 180 Ca 0.51 -0.79 0.02 0.00 -1.71 0.00 0.00 55.69 53.72 1tnj s MET 180 Cb 0.30 -0.84 -0.04 0.00 2.01 0.00 0.00 34.83 36.26 1tnj s MET 180 CO 0.28 0.20 -0.07 -0.59 -0.01 0.00 0.00 175.02 174.83 1tnj s PHE 181 N -0.97 0.95 -0.01 -0.03 -0.12 -0.04 -4.81 117.98 112.95 1tnj s PHE 181 Ca -0.00 -0.86 -0.02 0.00 -0.05 0.00 0.00 56.93 55.99 1tnj s PHE 181 Cb -0.08 -0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 41.73 1tnj s PHE 181 CO 0.01 -0.10 0.17 0.00 -0.05 0.00 0.00 175.22 175.25 1tnj s ALA 183 N -1.31 -0.47 0.00 0.00 0.00 -0.69 -1.26 121.76 118.03 1tnj s ALA 183 Ca 0.27 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.61 1tnj s ALA 183 Cb -0.13 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.79 1tnj s ALA 183 CO 0.18 -0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.22 1tnj n GLY 184 N 2.52 0.41 2.86 0.00 0.00 -0.56 -2.91 105.19 107.50 1tnj n GLY 184 Ca -0.15 -1.53 -0.24 0.00 0.00 0.00 0.00 46.02 44.09 1tnj n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tnj s TYR 184 N -2.81 1.05 0.39 1.61 2.02 -1.26 -4.30 117.35 114.05 1tnj s TYR 184 Ca 0.00 -0.42 0.39 0.00 -0.37 0.00 0.00 57.07 56.68 1tnj s TYR 184 Cb 0.00 -0.96 1.92 0.00 -0.40 0.00 0.00 41.96 42.51 1tnj s TYR 184 CO 0.00 -0.38 2.19 -0.07 -1.57 0.00 0.00 175.55 175.72 1tnj h LEU 185 N 8.01 0.00 -2.97 -1.29 -0.00 -1.96 -2.38 115.31 114.72 1tnj h LEU 185 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.61 1tnj h LEU 185 Cb 1.14 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.80 1tnj h LEU 185 CO 0.36 0.00 0.00 -0.62 -0.00 0.00 0.00 178.44 178.18 1tnj n GLU 186 N -3.09 3.84 0.00 1.13 -0.58 -1.26 0.81 120.64 121.49 1tnj n GLU 186 Ca -0.01 -2.61 0.00 0.00 -0.42 0.00 0.00 57.16 54.11 1tnj n GLU 186 Cb 0.19 -1.97 0.00 0.00 -0.57 0.00 0.00 31.44 29.08 1tnj n GLU 186 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1tnj n GLY 187 N 0.83 -0.16 4.21 0.62 0.00 -0.90 -4.43 105.19 105.36 1tnj n GLY 187 Ca 0.23 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1tnj n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tnj n GLY 188 N 0.00 2.02 2.92 -0.02 0.00 0.85 -4.87 105.19 106.09 1tnj n GLY 188 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1tnj n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tnj s LYS 188 N 0.00 1.28 -0.07 1.61 1.02 -1.26 -3.67 119.74 118.65 1tnj s LYS 188 Ca 0.00 -0.22 -0.32 0.00 0.02 0.00 0.00 55.97 55.45 1tnj s LYS 188 Cb 0.00 -1.24 0.12 0.00 -0.52 0.00 0.00 37.83 36.19 1tnj s LYS 188 CO 0.00 -0.12 1.15 0.34 -0.92 0.00 0.00 175.35 175.80 1tnj s ASP 189 N 1.18 -0.15 0.80 2.83 -1.08 -0.52 -4.39 116.67 115.33 1tnj s ASP 189 Ca -0.06 -0.08 -0.12 0.00 -0.52 0.00 0.00 52.55 51.77 1tnj s ASP 189 Cb -0.14 0.23 0.07 0.00 -1.46 0.00 0.00 42.92 41.62 1tnj s ASP 189 CO -0.02 -0.39 1.16 -0.94 0.52 0.00 0.00 175.17 175.51 1tnj s SER 190 N -2.55 4.59 0.30 -0.34 1.04 -1.26 -0.56 113.70 114.93 1tnj s SER 190 Ca 0.10 0.79 -0.06 0.00 0.48 0.00 0.00 55.95 57.26 1tnj s SER 190 Cb 0.01 -1.31 0.02 0.00 0.10 0.00 0.00 66.02 64.84 1tnj s SER 190 CO -0.04 -1.85 0.50 0.00 0.98 0.00 0.00 173.24 172.83 1tnj n GLN 192 N -0.45 2.68 0.00 0.00 -0.06 -1.26 -1.10 117.38 117.19 1tnj n GLN 192 Ca -0.03 0.97 0.00 0.00 -2.00 0.00 0.00 57.00 55.94 1tnj n GLN 192 Cb 0.47 -2.81 0.00 0.00 -4.06 0.00 0.00 30.24 23.84 1tnj n GLN 192 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1tnj n GLY 193 N 3.91 3.10 0.11 1.69 0.00 -1.26 -0.30 105.19 112.44 1tnj n GLY 193 Ca 0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 1tnj n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1tnj h ASP 194 N 0.00 0.00 -1.01 1.61 3.32 -1.44 -3.33 116.42 115.56 1tnj h ASP 194 Ca 0.00 -0.02 -0.75 0.00 0.02 0.00 0.00 57.03 56.28 1tnj h ASP 194 Cb 0.00 0.00 0.07 0.00 0.22 0.00 0.00 39.33 39.62 1tnj h ASP 194 CO 0.00 0.01 -0.14 -1.20 -1.72 0.00 0.00 179.24 176.19 1tnj n SER 195 N -2.34 -0.42 0.00 6.45 7.64 -1.26 -1.77 113.62 121.92 1tnj n SER 195 Ca 0.05 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.08 1tnj n SER 195 Cb 0.44 -0.93 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 1tnj n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tnj n GLY 196 N 1.68 2.86 3.73 0.23 0.00 -0.24 -0.28 105.19 113.16 1tnj n GLY 196 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1tnj n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tnj s GLY 197 N -1.72 1.58 0.30 -0.02 0.00 -0.73 -3.53 107.32 103.20 1tnj s GLY 197 Ca 0.00 -0.35 -0.23 0.00 0.00 0.00 0.00 44.72 44.14 1tnj s GLY 197 CO 0.00 0.21 0.86 2.56 0.00 0.00 0.00 173.10 176.73 1tnj s PRO 198 N -5.08 4.41 -0.27 2.90 0.04 -1.26 -1.32 135.00 134.43 1tnj s PRO 198 Ca 0.64 1.12 0.03 0.00 0.04 0.00 0.00 61.00 62.83 1tnj s PRO 198 Cb -0.17 -2.75 0.07 0.00 0.04 0.00 0.00 34.50 31.69 1tnj s PRO 198 CO 0.56 0.28 -0.06 0.08 0.04 0.00 0.00 177.00 177.90 1tnj s VAL 199 N -1.66 2.00 -0.18 -0.36 1.01 -0.23 -3.36 120.40 117.62 1tnj s VAL 199 Ca 0.49 -1.67 -0.04 0.00 0.00 0.00 0.00 61.98 60.77 1tnj s VAL 199 Cb -0.17 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 1tnj s VAL 199 CO 0.21 -0.17 -0.04 -0.69 0.00 0.00 0.00 175.10 174.42 1tnj s VAL 200 N 1.15 3.70 -0.10 2.92 1.01 -0.65 -0.14 120.40 128.30 1tnj s VAL 200 Ca -0.04 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 1tnj s VAL 200 Cb -0.19 -2.65 0.03 0.00 0.00 0.00 0.00 36.38 33.57 1tnj s VAL 200 CO -0.06 0.46 -0.05 0.00 0.00 0.00 0.00 175.10 175.44 1tnj n SER 202 N 4.93 -4.37 0.00 0.00 7.64 -1.26 -1.96 113.62 118.61 1tnj n SER 202 Ca -0.12 -0.73 0.00 0.00 1.01 0.00 0.00 58.87 59.04 1tnj n SER 202 Cb 0.50 -4.24 0.00 0.00 -1.01 0.00 0.00 64.21 59.47 1tnj n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tnj n GLY 203 N -1.72 0.46 3.28 0.23 0.00 -1.26 -5.02 105.19 101.16 1tnj n GLY 203 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 1tnj n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tnj s LYS 204 N -0.40 1.67 -0.46 1.61 -0.14 -0.83 -4.22 119.74 116.97 1tnj s LYS 204 Ca 0.00 -0.95 -0.28 0.00 -1.36 0.00 0.00 55.97 53.38 1tnj s LYS 204 Cb 0.00 -1.75 -0.02 0.00 -1.68 0.00 0.00 37.83 34.38 1tnj s LYS 204 CO 0.00 0.46 1.81 -1.17 -0.76 0.00 0.00 175.35 175.69 1tnj s LEU 209 N -0.98 3.42 -0.09 3.17 2.96 -0.14 -1.08 118.68 125.94 1tnj s LEU 209 Ca 0.09 0.84 0.20 0.00 -0.22 0.00 0.00 54.13 55.04 1tnj s LEU 209 Cb -0.09 -3.06 -0.27 0.00 0.50 0.00 0.00 46.19 43.26 1tnj s LEU 209 CO 0.01 -2.01 0.36 0.00 -1.32 0.00 0.00 176.35 173.39 1tnj n GLN 210 N 8.74 0.67 -4.09 1.98 1.13 0.81 -4.11 117.38 122.51 1tnj n GLN 210 Ca 0.22 -0.07 -0.10 0.00 -1.94 0.00 0.00 57.00 55.11 1tnj n GLN 210 Cb 0.49 -1.56 -0.09 0.00 0.11 0.00 0.00 30.24 29.20 1tnj n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1tnj s GLY 211 N -4.95 0.86 -0.08 1.08 0.00 -0.58 -1.80 107.32 101.85 1tnj s GLY 211 Ca -0.08 -1.28 0.02 0.00 0.00 0.00 0.00 44.72 43.38 1tnj s GLY 211 CO 0.86 -1.15 -0.15 -0.42 0.00 0.00 0.00 173.10 172.24 1tnj s ILE 212 N -4.04 1.36 -0.09 0.90 1.01 -1.06 -1.07 121.20 118.21 1tnj s ILE 212 Ca 0.24 -0.60 -0.31 0.00 0.00 0.00 0.00 60.65 59.98 1tnj s ILE 212 Cb 0.06 -1.23 -0.09 0.00 0.01 0.00 0.00 42.46 41.21 1tnj s ILE 212 CO 0.03 0.41 2.04 0.52 0.00 0.00 0.00 174.94 177.94 1tnj n VAL 213 N 3.89 0.57 0.03 2.92 0.31 -0.43 -1.25 118.33 124.37 1tnj n VAL 213 Ca -0.21 -0.23 -0.01 0.00 -0.01 0.00 0.00 64.34 63.88 1tnj n VAL 213 Cb 0.52 -2.25 -0.00 0.00 -0.91 0.00 0.00 33.84 31.20 1tnj n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1tnj n SER 214 N 8.70 0.91 -3.37 4.52 2.88 -0.90 -1.08 113.62 125.28 1tnj n SER 214 Ca 0.25 0.12 -0.05 0.00 -1.33 0.00 0.00 58.87 57.85 1tnj n SER 214 Cb 0.38 -0.28 0.01 0.00 -0.75 0.00 0.00 64.21 63.57 1tnj n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1tnj s TRP 215 N -2.04 0.02 0.00 0.66 1.48 -0.52 -4.94 118.94 113.60 1tnj s TRP 215 Ca -0.01 -0.49 0.00 0.00 -1.06 0.00 0.00 56.10 54.54 1tnj s TRP 215 Cb 0.00 0.73 0.00 0.00 -1.16 0.00 0.00 33.47 33.04 1tnj s TRP 215 CO 0.02 -1.13 0.00 0.41 -4.06 0.00 0.00 176.95 172.19 1tnj n GLY 216 N -0.58 -0.58 3.37 3.67 0.00 -1.26 -0.35 105.19 109.45 1tnj n GLY 216 Ca -0.05 -1.03 -0.45 0.00 0.00 0.00 0.00 46.02 44.49 1tnj n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tnj s SER 217 N 0.00 6.24 0.86 1.61 0.15 -1.26 -4.93 113.70 116.37 1tnj s SER 217 Ca 0.00 -1.55 0.00 0.00 0.70 0.00 0.00 55.95 55.10 1tnj s SER 217 Cb 0.00 -2.30 0.00 0.00 -1.71 0.00 0.00 66.02 62.01 1tnj s SER 217 CO 0.00 -1.08 0.00 0.61 1.20 0.00 0.00 173.24 173.97 1tnj n GLY 219 N 5.22 0.68 2.99 9.45 0.00 -1.26 -4.74 105.19 117.53 1tnj n GLY 219 Ca -0.06 -0.83 -0.17 0.00 0.00 0.00 0.00 46.02 44.96 1tnj n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tnj n ALA 221 N 2.87 -0.36 -1.95 0.00 0.00 -1.26 -4.64 120.51 115.17 1tnj n ALA 221 Ca -0.13 0.21 -0.35 0.00 0.00 0.00 0.00 53.44 53.17 1tnj n ALA 221 Cb 0.57 -1.60 -0.06 0.00 0.00 0.00 0.00 19.45 18.36 1tnj n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1tnj s GLN 221 N -3.74 4.30 0.10 0.00 -1.52 -1.26 -0.11 119.66 117.44 1tnj s GLN 221 Ca 0.00 1.02 -0.33 0.00 -1.95 0.00 0.00 55.36 54.11 1tnj s GLN 221 Cb 0.00 -2.63 -0.12 0.00 -0.22 0.00 0.00 33.01 30.04 1tnj s GLN 221 CO 0.00 0.23 1.77 1.17 -0.25 0.00 0.00 175.29 178.20 1tnj n LYS 222 N 0.19 2.51 -1.86 2.91 4.81 -1.26 -1.93 118.16 123.52 1tnj n LYS 222 Ca 0.02 0.91 -0.20 0.00 -0.87 0.00 0.00 58.31 58.17 1tnj n LYS 222 Cb 0.52 -2.76 -0.06 0.00 0.02 0.00 0.00 35.03 32.75 1tnj n LYS 222 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1tnj n ASN 223 N 5.07 -5.41 -3.25 3.14 5.03 0.24 -4.92 115.26 115.16 1tnj n ASN 223 Ca 0.18 0.33 -0.25 0.00 0.87 0.00 0.00 54.58 55.71 1tnj n ASN 223 Cb 0.33 -4.70 -0.06 0.00 -1.02 0.00 0.00 39.78 34.33 1tnj n ASN 223 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1tnj n LYS 224 N -2.55 1.84 -1.06 3.52 4.76 -0.81 -4.70 118.16 119.16 1tnj n LYS 224 Ca -0.21 -4.06 -0.31 0.00 -2.87 0.00 0.00 58.31 50.86 1tnj n LYS 224 Cb 0.66 -1.84 0.13 0.00 -1.84 0.00 0.00 35.03 32.14 1tnj n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1tnj s PRO 225 N -2.18 1.63 0.48 1.97 0.04 -1.26 -4.34 135.00 131.34 1tnj s PRO 225 Ca 0.40 1.21 -0.24 0.00 0.04 0.00 0.00 61.00 62.40 1tnj s PRO 225 Cb 0.20 -1.82 -0.07 0.00 0.04 0.00 0.00 34.50 32.84 1tnj s PRO 225 CO -0.07 -2.09 1.42 0.41 0.04 0.00 0.00 177.00 176.70 1tnj n GLY 226 N -0.72 0.96 3.42 0.56 0.00 -1.14 -4.64 105.19 103.62 1tnj n GLY 226 Ca 0.09 0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 1tnj n GLY 226 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tnj s VAL 227 N -1.22 3.20 0.00 1.61 1.01 0.52 -1.71 120.40 123.81 1tnj s VAL 227 Ca 0.64 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 62.06 1tnj s VAL 227 Cb -0.44 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 1tnj s VAL 227 CO 0.55 0.54 -0.20 -0.31 0.00 0.00 0.00 175.10 175.68 1tnj s TYR 228 N 0.04 1.77 0.09 5.22 2.02 0.49 -1.44 117.35 125.55 1tnj s TYR 228 Ca -0.04 -0.34 -0.31 0.00 -0.37 0.00 0.00 57.07 56.01 1tnj s TYR 228 Cb -0.14 -1.12 -0.08 0.00 -0.40 0.00 0.00 41.96 40.22 1tnj s TYR 228 CO 0.04 0.00 1.51 0.99 -1.57 0.00 0.00 175.55 176.53 1tnj s THR 229 N -0.55 3.15 -0.90 -0.71 2.01 -0.38 -0.86 115.64 117.39 1tnj s THR 229 Ca 0.07 0.72 -0.24 0.00 0.31 0.00 0.00 61.69 62.55 1tnj s THR 229 Cb -0.08 -3.46 0.05 0.00 0.01 0.00 0.00 72.50 69.02 1tnj s THR 229 CO -0.00 0.03 1.35 -0.75 -0.69 0.00 0.00 174.62 174.55 1tnj s LYS 230 N 1.85 3.43 0.45 4.92 2.20 0.07 -2.58 119.74 130.07 1tnj s LYS 230 Ca 0.69 -0.84 0.12 0.00 -0.36 0.00 0.00 55.97 55.58 1tnj s LYS 230 Cb -0.38 -4.86 1.03 0.00 -1.51 0.00 0.00 37.83 32.11 1tnj s LYS 230 CO 0.30 -2.14 2.06 0.28 -0.36 0.00 0.00 175.35 175.49 1tnj h VAL 231 N 6.43 1.01 0.00 4.02 2.07 -1.66 -2.23 116.25 125.88 1tnj h VAL 231 Ca 0.00 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 1tnj h VAL 231 Cb 1.03 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1tnj h VAL 231 CO 1.34 0.07 -0.01 0.00 0.02 0.00 0.00 177.57 178.98 1tnj h ASN 233 N 0.00 0.00 -0.12 0.00 2.35 -1.79 -3.30 115.58 112.72 1tnj h ASN 233 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1tnj h ASN 233 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1tnj h ASN 233 CO 0.00 0.00 0.00 -1.22 -1.65 0.00 0.00 177.43 174.56 1tnj n TYR 234 N -2.52 0.14 -0.18 1.19 4.01 0.36 -4.73 117.16 115.43 1tnj n TYR 234 Ca 0.03 -0.13 -0.06 0.00 -0.16 0.00 0.00 57.90 57.59 1tnj n TYR 234 Cb 0.32 -0.01 0.04 0.00 -0.31 0.00 0.00 39.34 39.38 1tnj n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1tnj h VAL 235 N 2.58 1.08 0.00 -0.72 2.07 -1.64 -0.21 116.25 119.40 1tnj h VAL 235 Ca 0.00 -0.23 -0.14 0.00 0.82 0.00 0.00 66.70 67.16 1tnj h VAL 235 Cb 0.61 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1tnj h VAL 235 CO 0.00 0.12 -0.65 0.77 0.02 0.00 0.00 177.57 177.83 1tnj h SER 236 N 0.67 0.00 -0.66 0.57 4.64 -1.88 -1.67 113.55 115.21 1tnj h SER 236 Ca 0.21 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.48 1tnj h SER 236 Cb -0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1tnj h SER 236 CO -0.08 0.65 0.22 -0.25 -0.87 0.00 0.00 176.83 176.50 1tnj h TRP 237 N 0.00 1.05 0.12 4.77 7.01 -1.73 -1.15 115.95 126.02 1tnj h TRP 237 Ca -0.01 -0.10 0.00 0.00 2.11 0.00 0.00 58.89 60.90 1tnj h TRP 237 Cb 1.27 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 28.01 1tnj h TRP 237 CO 0.00 0.84 -0.11 0.82 -2.79 0.00 0.00 178.44 177.20 1tnj h ILE 238 N 0.95 0.76 -0.48 2.65 2.04 -0.91 -1.45 117.51 121.07 1tnj h ILE 238 Ca 0.22 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.06 1tnj h ILE 238 Cb 0.27 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1tnj h ILE 238 CO -0.01 0.00 0.23 0.11 0.00 0.00 0.00 178.15 178.48 1tnj h LYS 239 N -0.25 0.69 -0.18 2.37 1.57 -1.22 0.02 116.57 119.58 1tnj h LYS 239 Ca -0.00 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.70 1tnj h LYS 239 Cb 0.23 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 1tnj h LYS 239 CO -0.02 0.59 0.01 1.96 -0.57 0.00 0.00 179.45 181.42 1tnj h GLN 240 N 0.63 0.07 -0.35 3.15 4.20 -1.19 -1.33 115.11 120.29 1tnj h GLN 240 Ca 0.16 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 1tnj h GLN 240 Cb 0.13 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 1tnj h GLN 240 CO -0.02 0.05 0.13 1.15 -0.67 0.00 0.00 178.83 179.47 1tnj h THR 241 N 0.08 1.19 0.00 -0.54 2.02 -1.07 -2.48 112.91 112.11 1tnj h THR 241 Ca 0.08 -0.60 -0.07 0.00 0.77 0.00 0.00 66.41 66.59 1tnj h THR 241 Cb 0.09 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1tnj h THR 241 CO -0.13 0.21 -0.34 0.16 0.37 0.00 0.00 175.52 175.79 1tnj h ILE 242 N 0.42 0.81 0.00 3.11 3.07 -0.87 -2.69 117.51 121.37 1tnj h ILE 242 Ca 0.12 -1.44 -0.03 0.00 1.55 0.00 0.00 64.86 65.06 1tnj h ILE 242 Cb 0.20 1.90 -0.00 0.00 -0.27 0.00 0.00 36.82 38.65 1tnj h ILE 242 CO -0.01 0.34 -0.13 0.00 -1.05 0.00 0.00 178.15 177.30 1tnj h ALA 243 N 1.66 1.25 -0.01 0.16 0.00 -0.96 -3.18 119.26 118.17 1tnj h ALA 243 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1tnj h ALA 243 Cb 0.87 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1tnj h ALA 243 CO 0.04 0.16 -0.01 0.43 0.00 0.00 0.00 179.25 179.87 1tnj n SER 244 N -3.60 1.99 0.00 0.00 7.64 -0.96 -5.10 113.62 113.59 1tnj n SER 244 Ca -0.02 -1.49 0.00 0.00 1.01 0.00 0.00 58.87 58.37 1tnj n SER 244 Cb 0.26 0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 1tnj n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62