#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tgs n LYS 15 N 0.00 0.15 -1.39 -1.24 5.02 -1.26 -1.86 118.16 117.58 1tgs n LYS 15 Ca 0.00 0.30 -0.21 0.00 -2.02 0.00 0.00 58.31 56.37 1tgs n LYS 15 Cb 0.00 -1.74 0.11 0.00 -0.02 0.00 0.00 35.03 33.38 1tgs n LYS 15 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1tgs n ILE 16 N -2.00 2.93 -3.99 -0.18 -5.35 -1.26 -0.33 119.36 109.17 1tgs n ILE 16 Ca 0.04 -3.21 -0.31 0.00 -0.27 0.00 0.00 62.75 59.00 1tgs n ILE 16 Cb 0.27 -0.84 0.01 0.00 -1.74 0.00 0.00 39.64 37.33 1tgs n ILE 16 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 1tgs n VAL 17 N -0.94 -2.08 -0.68 7.28 0.31 -0.78 -0.90 118.33 120.54 1tgs n VAL 17 Ca 0.48 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.69 1tgs n VAL 17 Cb 0.95 -2.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.33 1tgs n VAL 17 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1tgs n GLY 18 N -1.63 1.36 0.00 2.92 0.00 -1.22 -1.75 105.19 104.88 1tgs n GLY 18 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1tgs n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tgs n GLY 19 N -2.00 0.85 3.08 -0.02 0.00 -0.08 -4.84 105.19 102.19 1tgs n GLY 19 Ca 0.00 -1.75 -0.13 0.00 0.00 0.00 0.00 46.02 44.14 1tgs n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1tgs s TYR 20 N 1.10 0.71 0.51 1.61 -0.85 0.04 -4.91 117.35 115.56 1tgs s TYR 20 Ca 0.00 -0.58 -0.19 0.00 -0.52 0.00 0.00 57.07 55.77 1tgs s TYR 20 Cb 0.00 -0.42 -0.08 0.00 0.38 0.00 0.00 41.96 41.84 1tgs s TYR 20 CO 0.00 -0.10 1.05 0.95 -1.52 0.00 0.00 175.55 175.93 1tgs s THR 21 N -1.83 3.76 0.11 -3.49 -4.23 -1.26 -0.05 115.64 108.65 1tgs s THR 21 Ca -0.06 1.05 -0.14 0.00 -1.18 0.00 0.00 61.69 61.37 1tgs s THR 21 Cb -0.07 -3.43 0.02 0.00 1.34 0.00 0.00 72.50 70.36 1tgs s THR 21 CO -0.01 -0.28 0.34 0.00 -0.54 0.00 0.00 174.62 174.13 1tgs s GLY 23 N -2.82 2.16 0.56 0.00 0.00 -1.26 -4.63 107.32 101.33 1tgs s GLY 23 Ca 0.03 -1.96 0.25 0.00 0.00 0.00 0.00 44.72 43.04 1tgs s GLY 23 CO -0.12 -1.81 2.20 0.00 0.00 0.00 0.00 173.10 173.38 1tgs h ALA 24 N 1.35 1.65 -0.35 3.20 0.00 -1.87 -0.32 119.26 122.92 1tgs h ALA 24 Ca -0.43 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 1tgs h ALA 24 Cb 1.26 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1tgs h ALA 24 CO 0.64 0.02 -0.07 -0.91 0.00 0.00 0.00 179.25 178.93 1tgs h ASN 25 N 0.00 0.56 -0.20 0.00 2.35 -1.85 -1.57 115.58 114.87 1tgs h ASN 25 Ca -0.00 -0.14 -0.18 0.00 -0.55 0.00 0.00 56.30 55.43 1tgs h ASN 25 Cb 0.04 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.26 1tgs h ASN 25 CO 0.00 0.68 -0.58 0.74 -1.65 0.00 0.00 177.43 176.63 1tgs h THR 26 N 0.55 1.30 -2.16 2.81 2.02 -1.37 -3.38 112.91 112.68 1tgs h THR 26 Ca 0.11 -1.79 -0.58 0.00 0.77 0.00 0.00 66.41 64.91 1tgs h THR 26 Cb 0.46 1.87 -0.41 0.00 -1.74 0.00 0.00 68.15 68.33 1tgs h THR 26 CO 0.02 0.57 -0.73 1.33 0.37 0.00 0.00 175.52 177.08 1tgs n VAL 27 N -4.08 1.76 0.72 3.16 0.24 -1.05 -4.95 118.33 114.13 1tgs n VAL 27 Ca -0.06 -5.02 0.08 0.00 -2.04 0.00 0.00 64.34 57.30 1tgs n VAL 27 Cb 0.64 -1.85 0.40 0.00 -1.47 0.00 0.00 33.84 31.56 1tgs n VAL 27 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1tgs n PRO 28 N 0.73 0.18 0.00 7.34 -0.04 -0.60 -1.98 135.00 140.62 1tgs n PRO 28 Ca 0.28 0.15 0.12 0.00 -0.04 0.00 0.00 63.50 64.01 1tgs n PRO 28 Cb 0.44 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.62 1tgs n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1tgs n TYR 29 N -1.34 0.00 -2.28 0.54 0.18 -1.18 -1.64 117.16 111.44 1tgs n TYR 29 Ca 0.07 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.43 1tgs n TYR 29 Cb 0.15 -0.20 -0.03 0.00 -0.38 0.00 0.00 39.34 38.87 1tgs n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1tgs s GLN 30 N -2.94 4.40 0.18 -3.48 2.00 -0.84 -0.36 119.66 118.63 1tgs s GLN 30 Ca 0.12 1.97 0.07 0.00 -2.00 0.00 0.00 55.36 55.52 1tgs s GLN 30 Cb 0.18 -3.24 -0.05 0.00 0.80 0.00 0.00 33.01 30.70 1tgs s GLN 30 CO 0.70 -0.26 -0.14 0.14 -0.50 0.00 0.00 175.29 175.23 1tgs s VAL 31 N 0.47 1.58 -0.14 1.34 -7.23 -0.45 -4.51 120.40 111.47 1tgs s VAL 31 Ca 0.58 -2.13 -0.05 0.00 -1.81 0.00 0.00 61.98 58.57 1tgs s VAL 31 Cb -0.34 -1.95 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 1tgs s VAL 31 CO 0.34 -0.61 0.04 -0.55 -0.31 0.00 0.00 175.10 174.01 1tgs s SER 32 N -3.19 5.48 -0.23 4.85 0.15 -0.22 -1.76 113.70 118.78 1tgs s SER 32 Ca 0.20 0.13 -0.11 0.00 0.70 0.00 0.00 55.95 56.87 1tgs s SER 32 Cb -0.00 -1.78 -0.05 0.00 -1.71 0.00 0.00 66.02 62.47 1tgs s SER 32 CO 0.05 0.28 0.19 -0.76 1.20 0.00 0.00 173.24 174.19 1tgs s LEU 33 N -0.26 4.13 -0.10 3.45 1.43 0.92 -0.89 118.68 127.36 1tgs s LEU 33 Ca 0.07 0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.36 1tgs s LEU 33 Cb -0.12 -2.15 0.01 0.00 0.03 0.00 0.00 46.19 43.96 1tgs s LEU 33 CO 0.02 0.06 -0.16 0.21 0.23 0.00 0.00 176.35 176.71 1tgs s ASN 34 N 0.99 2.39 -0.34 2.29 3.84 -0.13 -1.39 114.94 122.59 1tgs s ASN 34 Ca 0.09 -0.42 0.11 0.00 0.21 0.00 0.00 52.86 52.85 1tgs s ASN 34 Cb -0.13 -1.08 0.46 0.00 -0.55 0.00 0.00 41.25 39.94 1tgs s ASN 34 CO 0.04 0.04 1.10 -1.54 -2.79 0.00 0.00 177.10 173.95 1tgs n SER 37 N 4.03 3.56 0.00 -4.21 3.41 -1.26 -0.37 113.62 118.78 1tgs n SER 37 Ca -0.20 -3.22 0.00 0.00 -0.26 0.00 0.00 58.87 55.19 1tgs n SER 37 Cb 0.52 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 1tgs n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tgs n GLY 38 N -0.49 2.34 3.48 5.00 0.00 -1.26 -4.99 105.19 109.28 1tgs n GLY 38 Ca 0.29 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.21 1tgs n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1tgs s TYR 39 N -2.62 -0.42 -0.11 1.61 1.13 -1.26 -5.13 117.35 110.55 1tgs s TYR 39 Ca 0.00 0.24 -0.29 0.00 -1.41 0.00 0.00 57.07 55.60 1tgs s TYR 39 Cb 0.00 0.55 -0.04 0.00 -1.10 0.00 0.00 41.96 41.38 1tgs s TYR 39 CO 0.00 -0.69 1.49 -1.58 -2.51 0.00 0.00 175.55 172.26 1tgs s HIS 40 N -3.40 2.33 -0.04 -3.49 5.65 -1.26 -4.29 115.29 110.78 1tgs s HIS 40 Ca 0.04 0.54 0.05 0.00 0.25 0.00 0.00 55.06 55.93 1tgs s HIS 40 Cb -0.01 -3.75 -0.07 0.00 -1.18 0.00 0.00 32.58 27.56 1tgs s HIS 40 CO -0.10 -2.94 0.04 1.97 -0.65 0.00 0.00 174.74 173.06 1tgs n PHE 41 N 6.98 0.00 -3.89 3.88 1.16 -0.48 -4.88 117.46 120.23 1tgs n PHE 41 Ca 0.16 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.65 1tgs n PHE 41 Cb 0.44 -0.24 -0.07 0.00 -1.61 0.00 0.00 39.48 38.00 1tgs n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1tgs n GLY 43 N -0.18 1.86 3.83 0.00 0.00 0.69 -0.06 105.19 111.33 1tgs n GLY 43 Ca -0.10 -2.16 -0.04 0.00 0.00 0.00 0.00 46.02 43.72 1tgs n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tgs s GLY 44 N -3.09 0.02 0.01 -0.02 0.00 -0.72 -3.87 107.32 99.64 1tgs s GLY 44 Ca 0.25 -0.22 0.05 0.00 0.00 0.00 0.00 44.72 44.80 1tgs s GLY 44 CO 0.16 1.34 -0.14 -0.56 0.00 0.00 0.00 173.10 173.90 1tgs s SER 45 N -3.22 1.65 -0.29 1.64 0.01 -0.01 -1.34 113.70 112.14 1tgs s SER 45 Ca 0.18 -0.33 -0.22 0.00 1.31 0.00 0.00 55.95 56.88 1tgs s SER 45 Cb -0.02 -0.15 -0.00 0.00 0.21 0.00 0.00 66.02 66.05 1tgs s SER 45 CO 0.05 0.12 0.73 -0.22 0.41 0.00 0.00 173.24 174.32 1tgs s LEU 46 N -0.65 4.10 -0.01 2.44 2.96 0.51 -0.90 118.68 127.13 1tgs s LEU 46 Ca 0.04 0.64 0.15 0.00 -0.22 0.00 0.00 54.13 54.74 1tgs s LEU 46 Cb -0.06 -2.99 -0.21 0.00 0.50 0.00 0.00 46.19 43.43 1tgs s LEU 46 CO 0.00 -0.54 0.47 2.30 -1.32 0.00 0.00 176.35 177.27 1tgs n ILE 47 N 5.43 0.00 -3.56 6.68 -5.35 0.12 -0.75 119.36 121.93 1tgs n ILE 47 Ca 0.02 -0.26 -0.06 0.00 -0.27 0.00 0.00 62.75 62.18 1tgs n ILE 47 Cb 0.48 0.53 0.01 0.00 -1.74 0.00 0.00 39.64 38.93 1tgs n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1tgs n ASN 48 N -1.73 -1.40 0.16 7.28 2.04 -1.07 -4.50 115.26 116.04 1tgs n ASN 48 Ca -0.00 -2.05 0.18 0.00 -0.44 0.00 0.00 54.58 52.26 1tgs n ASN 48 Cb 0.33 2.36 0.78 0.00 -2.53 0.00 0.00 39.78 40.72 1tgs n ASN 48 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 1tgs h SER 49 N 1.28 0.00 -0.00 0.53 4.64 -1.95 -2.68 113.55 115.36 1tgs h SER 49 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1tgs h SER 49 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1tgs h SER 49 CO 0.27 0.00 -0.21 0.00 -0.87 0.00 0.00 176.83 176.02 1tgs n GLN 50 N -3.92 3.46 -4.85 4.77 6.02 -1.26 0.41 117.38 122.00 1tgs n GLN 50 Ca 0.03 -0.28 -0.26 0.00 -0.01 0.00 0.00 57.00 56.49 1tgs n GLN 50 Cb 0.40 -0.90 -0.15 0.00 1.02 0.00 0.00 30.24 30.61 1tgs n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1tgs s TRP 51 N -1.29 1.69 0.01 1.08 0.52 -1.01 -1.13 118.94 118.81 1tgs s TRP 51 Ca 0.04 -0.33 0.08 0.00 0.02 0.00 0.00 56.10 55.91 1tgs s TRP 51 Cb 0.05 -1.07 -0.02 0.00 -1.15 0.00 0.00 33.47 31.27 1tgs s TRP 51 CO 0.20 -0.01 -0.23 0.08 0.02 0.00 0.00 176.95 177.01 1tgs s VAL 52 N -0.51 1.87 -0.15 4.03 1.01 -0.16 -0.70 120.40 125.79 1tgs s VAL 52 Ca 0.07 -1.14 -0.03 0.00 0.00 0.00 0.00 61.98 60.88 1tgs s VAL 52 Cb -0.07 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 1tgs s VAL 52 CO -0.00 0.41 -0.05 0.54 0.00 0.00 0.00 175.10 176.00 1tgs s VAL 53 N -0.67 3.81 0.00 2.92 0.11 -0.07 -0.59 120.40 125.91 1tgs s VAL 53 Ca 0.09 -0.39 0.00 0.00 -2.93 0.00 0.00 61.98 58.75 1tgs s VAL 53 Cb -0.09 -2.66 0.00 0.00 -1.53 0.00 0.00 36.38 32.10 1tgs s VAL 53 CO 0.00 0.50 0.00 -0.24 -3.33 0.00 0.00 175.10 172.04 1tgs n SER 54 N 3.42 0.21 -4.84 3.54 2.88 -0.09 -0.83 113.62 117.91 1tgs n SER 54 Ca -0.17 -0.77 -0.37 0.00 -1.33 0.00 0.00 58.87 56.22 1tgs n SER 54 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1tgs n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tgs s ALA 55 N -2.00 3.66 0.37 -1.46 0.00 -1.26 -1.10 121.76 119.97 1tgs s ALA 55 Ca 0.00 -0.17 0.06 0.00 0.00 0.00 0.00 51.96 51.85 1tgs s ALA 55 Cb 0.00 -2.44 0.76 0.00 0.00 0.00 0.00 23.12 21.44 1tgs s ALA 55 CO 0.00 0.47 1.98 0.00 0.00 0.00 0.00 175.76 178.21 1tgs h ALA 56 N 4.33 1.71 0.00 0.00 0.00 -1.68 -1.48 119.26 122.14 1tgs h ALA 56 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1tgs h ALA 56 Cb 1.21 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1tgs h ALA 56 CO 0.63 0.19 0.00 -2.39 0.00 0.00 0.00 179.25 177.69 1tgs n HIS 57 N -4.47 0.00 1.77 0.00 1.44 -1.26 -1.51 115.22 111.19 1tgs n HIS 57 Ca 0.09 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.93 1tgs n HIS 57 Cb 0.20 -0.28 0.63 0.00 0.12 0.00 0.00 29.99 30.66 1tgs n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1tgs s TYR 59 N -1.96 3.00 0.16 0.00 6.14 -0.57 -4.99 117.35 119.14 1tgs s TYR 59 Ca 0.36 0.59 -0.09 0.00 0.64 0.00 0.00 57.07 58.58 1tgs s TYR 59 Cb 0.18 -3.93 -0.01 0.00 0.42 0.00 0.00 41.96 38.61 1tgs s TYR 59 CO 0.29 -3.47 0.28 0.15 0.64 0.00 0.00 175.55 173.44 1tgs s LYS 60 N 1.28 1.15 0.08 4.97 1.02 -1.26 -5.15 119.74 121.82 1tgs s LYS 60 Ca 0.70 -1.16 -0.08 0.00 0.02 0.00 0.00 55.97 55.45 1tgs s LYS 60 Cb -0.43 0.38 -0.06 0.00 -0.52 0.00 0.00 37.83 37.20 1tgs s LYS 60 CO 0.31 -0.42 0.37 -1.54 -0.92 0.00 0.00 175.35 173.15 1tgs s SER 61 N -2.96 6.58 -0.65 2.83 1.04 -1.26 -4.46 113.70 114.81 1tgs s SER 61 Ca 0.17 0.70 -0.01 0.00 0.48 0.00 0.00 55.95 57.29 1tgs s SER 61 Cb 0.03 -2.14 -0.01 0.00 0.10 0.00 0.00 66.02 64.00 1tgs s SER 61 CO -0.00 0.16 0.55 0.61 0.98 0.00 0.00 173.24 175.53 1tgs n GLY 62 N 0.75 -0.09 3.71 7.32 0.00 -1.26 -5.02 105.19 110.61 1tgs n GLY 62 Ca -0.07 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1tgs n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tgs s ILE 63 N -3.21 4.85 -0.20 -0.61 1.01 -1.26 -4.67 121.20 117.11 1tgs s ILE 63 Ca 0.08 1.97 -0.09 0.00 0.00 0.00 0.00 60.65 62.61 1tgs s ILE 63 Cb -0.01 -4.28 -0.05 0.00 0.01 0.00 0.00 42.46 38.13 1tgs s ILE 63 CO 0.41 0.19 0.11 -1.58 0.00 0.00 0.00 174.94 174.08 1tgs s GLN 64 N 0.86 4.08 -0.11 2.79 0.74 0.50 -1.37 119.66 127.15 1tgs s GLN 64 Ca 0.49 -0.28 -0.18 0.00 0.05 0.00 0.00 55.36 55.44 1tgs s GLN 64 Cb -0.21 -3.38 -0.04 0.00 1.10 0.00 0.00 33.01 30.48 1tgs s GLN 64 CO 0.27 0.22 0.47 0.08 -0.55 0.00 0.00 175.29 175.78 1tgs s VAL 65 N 0.56 5.17 -0.26 1.34 1.01 0.92 -0.96 120.40 128.19 1tgs s VAL 65 Ca 0.06 0.95 -0.02 0.00 0.00 0.00 0.00 61.98 62.97 1tgs s VAL 65 Cb -0.12 -3.81 0.03 0.00 0.00 0.00 0.00 36.38 32.48 1tgs s VAL 65 CO 0.00 0.34 -0.05 -0.13 0.00 0.00 0.00 175.10 175.27 1tgs s ARG 66 N 0.51 2.76 0.16 2.72 0.52 -0.07 -0.70 118.95 124.85 1tgs s ARG 66 Ca 0.26 -1.03 0.06 0.00 -0.52 0.00 0.00 55.73 54.50 1tgs s ARG 66 Cb -0.15 -3.03 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 1tgs s ARG 66 CO 0.10 -0.44 0.02 -0.51 0.02 0.00 0.00 175.30 174.50 1tgs s LEU 67 N 1.31 3.43 -1.53 2.53 1.02 -0.01 -1.05 118.68 124.38 1tgs s LEU 67 Ca -0.01 -0.31 0.00 0.00 0.02 0.00 0.00 54.13 53.83 1tgs s LEU 67 Cb -0.17 -2.09 0.00 0.00 0.02 0.00 0.00 46.19 43.95 1tgs s LEU 67 CO -0.04 0.10 0.00 0.61 0.02 0.00 0.00 176.35 177.04 1tgs n GLY 69 N -0.05 -0.34 3.68 -3.19 0.00 -1.25 -0.64 105.19 103.40 1tgs n GLY 69 Ca -0.10 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 1tgs n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tgs s GLU 70 N -4.87 4.33 -0.24 1.61 0.41 -1.26 -4.01 118.70 114.65 1tgs s GLU 70 Ca 0.00 1.01 -0.07 0.00 -0.41 0.00 0.00 54.97 55.50 1tgs s GLU 70 Cb 0.00 -3.55 -0.17 0.00 -1.78 0.00 0.00 34.13 28.63 1tgs s GLU 70 CO 0.00 -0.26 -0.15 -0.25 -0.49 0.00 0.00 175.26 174.10 1tgs n ASP 71 N 4.98 1.98 -4.09 -0.19 10.43 -1.26 -4.50 116.55 123.89 1tgs n ASP 71 Ca 0.04 0.13 -0.32 0.00 2.57 0.00 0.00 54.79 57.21 1tgs n ASP 71 Cb 0.49 -0.67 -0.16 0.00 1.84 0.00 0.00 41.12 42.62 1tgs n ASP 71 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 1tgs s ASN 72 N -6.97 3.18 0.11 -2.24 3.04 -1.26 -4.29 114.94 106.50 1tgs s ASN 72 Ca -0.34 -0.70 0.19 0.00 0.04 0.00 0.00 52.86 52.05 1tgs s ASN 72 Cb 0.11 -1.41 0.79 0.00 -1.54 0.00 0.00 41.25 39.19 1tgs s ASN 72 CO 0.58 -0.04 1.59 2.30 -3.04 0.00 0.00 177.10 178.50 1tgs n ILE 73 N 4.64 0.88 0.48 -5.21 -5.35 -1.26 -2.57 119.36 110.96 1tgs n ILE 73 Ca -0.19 0.21 0.11 0.00 -0.27 0.00 0.00 62.75 62.61 1tgs n ILE 73 Cb 0.49 -1.03 -0.02 0.00 -1.74 0.00 0.00 39.64 37.34 1tgs n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1tgs n ASN 74 N -1.81 0.57 -4.03 7.28 3.02 -1.26 -4.91 115.26 114.11 1tgs n ASN 74 Ca 0.03 -0.21 -0.26 0.00 -0.03 0.00 0.00 54.58 54.12 1tgs n ASN 74 Cb 0.21 0.98 -0.17 0.00 -0.61 0.00 0.00 39.78 40.19 1tgs n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1tgs s VAL 75 N -3.24 1.21 -0.66 2.41 1.01 -1.06 -5.09 120.40 114.97 1tgs s VAL 75 Ca 0.02 -0.51 -0.26 0.00 0.00 0.00 0.00 61.98 61.23 1tgs s VAL 75 Cb 0.14 -1.11 0.04 0.00 0.00 0.00 0.00 36.38 35.45 1tgs s VAL 75 CO 0.82 0.37 1.14 -0.69 0.00 0.00 0.00 175.10 176.75 1tgs s VAL 76 N 0.75 4.03 -2.42 2.92 1.01 -1.26 -4.58 120.40 120.85 1tgs s VAL 76 Ca -0.13 0.33 0.24 0.00 0.00 0.00 0.00 61.98 62.43 1tgs s VAL 76 Cb -0.16 -4.76 0.49 0.00 0.00 0.00 0.00 36.38 31.95 1tgs s VAL 76 CO 0.03 -1.54 1.63 -0.62 0.00 0.00 0.00 175.10 174.60 1tgs n GLU 77 N 8.50 1.75 -0.84 2.72 1.02 -1.26 -4.92 120.64 127.61 1tgs n GLU 77 Ca 0.03 -1.11 0.00 0.00 -0.02 0.00 0.00 57.16 56.05 1tgs n GLU 77 Cb 0.48 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1tgs n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tgs n GLY 78 N 1.17 0.62 0.05 0.62 0.00 -1.26 -4.91 105.19 101.49 1tgs n GLY 78 Ca 0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.22 1tgs n GLY 78 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1tgs n ASN 79 N 0.00 1.64 -4.94 1.61 6.94 -1.26 -5.05 115.26 114.21 1tgs n ASN 79 Ca 0.00 -2.13 -0.24 0.00 -0.02 0.00 0.00 54.58 52.19 1tgs n ASN 79 Cb 0.00 -0.12 -0.01 0.00 -2.36 0.00 0.00 39.78 37.29 1tgs n ASN 79 CO 0.00 0.00 0.00 -1.83 -1.03 0.00 0.00 177.26 174.40 1tgs s GLU 80 N -1.25 3.44 -0.17 -3.83 1.03 -1.26 -4.75 118.70 111.91 1tgs s GLU 80 Ca 0.08 -0.27 -0.00 0.00 0.03 0.00 0.00 54.97 54.81 1tgs s GLU 80 Cb 0.07 -2.61 0.00 0.00 -0.80 0.00 0.00 34.13 30.80 1tgs s GLU 80 CO 0.01 0.04 -0.15 -0.65 -1.33 0.00 0.00 175.26 173.18 1tgs s GLN 81 N -4.41 3.19 -0.39 -4.83 -0.21 0.19 -4.97 119.66 108.22 1tgs s GLN 81 Ca 0.42 -0.75 -0.12 0.00 0.02 0.00 0.00 55.36 54.93 1tgs s GLN 81 Cb -0.10 -2.66 0.03 0.00 1.00 0.00 0.00 33.01 31.28 1tgs s GLN 81 CO 0.38 -0.06 0.25 -0.06 -2.12 0.00 0.00 175.29 173.67 1tgs s PHE 82 N 1.00 3.25 -0.09 0.91 2.99 -1.26 -0.83 117.98 123.94 1tgs s PHE 82 Ca -0.02 -0.89 0.03 0.00 0.00 0.00 0.00 56.93 56.05 1tgs s PHE 82 Cb -0.15 -2.54 0.01 0.00 0.00 0.00 0.00 43.02 40.34 1tgs s PHE 82 CO -0.03 -0.65 -0.17 0.42 -0.00 0.00 0.00 175.22 174.79 1tgs s ILE 83 N 1.59 1.58 0.49 0.64 1.01 0.13 -4.98 121.20 121.65 1tgs s ILE 83 Ca 0.03 -0.72 -0.22 0.00 0.00 0.00 0.00 60.65 59.75 1tgs s ILE 83 Cb -0.20 -1.41 -0.07 0.00 0.01 0.00 0.00 42.46 40.80 1tgs s ILE 83 CO 0.07 0.45 1.15 -0.44 0.00 0.00 0.00 174.94 176.18 1tgs s SER 84 N 0.70 6.01 0.02 3.58 0.01 -1.26 -0.06 113.70 122.70 1tgs s SER 84 Ca -0.13 2.25 -0.30 0.00 1.31 0.00 0.00 55.95 59.08 1tgs s SER 84 Cb -0.16 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.44 1tgs s SER 84 CO 0.03 -1.02 1.04 0.00 0.41 0.00 0.00 173.24 173.70 1tgs s ALA 85 N -1.64 3.23 -0.09 1.44 0.00 -0.47 -0.54 121.76 123.70 1tgs s ALA 85 Ca 0.67 0.63 -0.11 0.00 0.00 0.00 0.00 51.96 53.15 1tgs s ALA 85 Cb -0.27 -3.37 -0.28 0.00 0.00 0.00 0.00 23.12 19.20 1tgs s ALA 85 CO 0.31 -0.29 0.53 1.03 0.00 0.00 0.00 175.76 177.35 1tgs h SER 86 N 6.79 0.49 -3.62 0.00 0.87 -0.92 -3.45 113.55 113.72 1tgs h SER 86 Ca -0.41 -0.91 -0.22 0.00 -1.23 0.00 0.00 61.79 59.01 1tgs h SER 86 Cb 1.22 -0.16 -0.29 0.00 -0.44 0.00 0.00 62.40 62.73 1tgs h SER 86 CO 0.77 1.77 -0.59 -0.75 -0.53 0.00 0.00 176.83 177.50 1tgs s LYS 87 N -2.54 0.12 -0.14 2.24 2.20 -0.98 -4.99 119.74 115.64 1tgs s LYS 87 Ca -0.19 0.26 0.02 0.00 -0.36 0.00 0.00 55.97 55.69 1tgs s LYS 87 Cb 0.06 -0.05 0.01 0.00 -1.51 0.00 0.00 37.83 36.34 1tgs s LYS 87 CO 0.80 -0.09 -0.20 -1.12 -0.36 0.00 0.00 175.35 174.39 1tgs s SER 88 N 0.58 2.95 -0.34 1.43 0.01 -1.26 0.03 113.70 117.09 1tgs s SER 88 Ca -0.04 -0.57 0.01 0.00 1.31 0.00 0.00 55.95 56.66 1tgs s SER 88 Cb -0.06 -1.36 0.09 0.00 0.21 0.00 0.00 66.02 64.90 1tgs s SER 88 CO -0.03 0.04 0.06 -0.63 0.41 0.00 0.00 173.24 173.10 1tgs s ILE 89 N 0.98 2.65 0.14 1.44 1.01 0.23 -4.98 121.20 122.67 1tgs s ILE 89 Ca -0.04 -2.00 -0.25 0.00 0.00 0.00 0.00 60.65 58.36 1tgs s ILE 89 Cb -0.15 -2.78 -0.08 0.00 0.01 0.00 0.00 42.46 39.46 1tgs s ILE 89 CO -0.04 -0.46 0.76 -0.69 0.00 0.00 0.00 174.94 174.51 1tgs s VAL 90 N 1.05 4.44 0.10 2.92 1.01 -1.26 -0.53 120.40 128.13 1tgs s VAL 90 Ca 0.04 1.67 -0.35 0.00 0.00 0.00 0.00 61.98 63.34 1tgs s VAL 90 Cb -0.20 -4.12 -0.15 0.00 0.00 0.00 0.00 36.38 31.91 1tgs s VAL 90 CO -0.05 0.50 1.51 1.57 0.00 0.00 0.00 175.10 178.63 1tgs n HIS 91 N 1.77 1.99 0.23 5.22 -0.00 -0.79 -4.85 115.22 118.80 1tgs n HIS 91 Ca -0.05 0.40 0.06 0.00 0.46 0.00 0.00 57.72 58.58 1tgs n HIS 91 Cb 0.49 -2.47 0.29 0.00 -0.12 0.00 0.00 29.99 28.18 1tgs n HIS 91 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1tgs n PRO 92 N 3.35 0.06 -0.22 1.57 -0.04 -1.26 -1.36 135.00 137.11 1tgs n PRO 92 Ca 0.18 0.45 0.06 0.00 -0.04 0.00 0.00 63.50 64.15 1tgs n PRO 92 Cb 0.25 -1.66 0.16 0.00 -0.04 0.00 0.00 33.50 32.21 1tgs n PRO 92 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1tgs n SER 93 N -1.78 3.00 -4.68 3.54 7.64 -1.26 -5.00 113.62 115.07 1tgs n SER 93 Ca 0.01 -2.41 -0.45 0.00 1.01 0.00 0.00 58.87 57.03 1tgs n SER 93 Cb 0.09 -0.31 -0.04 0.00 -1.01 0.00 0.00 64.21 62.95 1tgs n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1tgs n TYR 94 N -0.16 2.45 -3.78 1.43 -0.00 -0.47 -4.73 117.16 111.90 1tgs n TYR 94 Ca 0.13 0.05 -0.37 0.00 -0.00 0.00 0.00 57.90 57.72 1tgs n TYR 94 Cb 0.56 -2.64 -0.12 0.00 -0.00 0.00 0.00 39.34 37.13 1tgs n TYR 94 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.86 178.07 1tgs s ASN 95 N 2.16 5.22 0.62 2.98 3.84 -0.81 -4.97 114.94 123.98 1tgs s ASN 95 Ca 0.82 -1.66 0.32 0.00 0.21 0.00 0.00 52.86 52.56 1tgs s ASN 95 Cb -0.60 -1.83 1.82 0.00 -0.55 0.00 0.00 41.25 40.10 1tgs s ASN 95 CO 0.40 -0.45 2.13 0.77 -2.79 0.00 0.00 177.10 177.16 1tgs h SER 96 N 8.11 0.00 0.40 -4.21 4.64 -1.92 0.10 113.55 120.67 1tgs h SER 96 Ca -0.18 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 60.86 1tgs h SER 96 Cb 1.06 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.17 1tgs h SER 96 CO 0.65 0.00 -1.26 0.78 -0.87 0.00 0.00 176.83 176.14 1tgs h ASN 97 N 0.00 0.63 0.00 4.97 4.21 -1.96 -3.36 115.58 120.07 1tgs h ASN 97 Ca 0.05 -0.63 0.00 0.00 1.21 0.00 0.00 56.30 56.93 1tgs h ASN 97 Cb 0.40 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 1tgs h ASN 97 CO -0.00 1.47 -1.04 0.35 -1.29 0.00 0.00 177.43 176.92 1tgs n THR 98 N -3.66 0.00 -1.78 2.81 -2.24 -1.12 -4.98 114.28 103.31 1tgs n THR 98 Ca -0.11 -0.05 -0.19 0.00 -2.27 0.00 0.00 64.05 61.43 1tgs n THR 98 Cb 1.01 0.93 -0.06 0.00 -2.10 0.00 0.00 70.33 70.11 1tgs n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1tgs n LEU 99 N -1.54 -1.54 -4.80 3.22 4.77 0.34 -4.99 117.00 112.47 1tgs n LEU 99 Ca 0.03 0.35 -0.36 0.00 -0.03 0.00 0.00 56.01 56.00 1tgs n LEU 99 Cb 0.34 -2.73 -0.06 0.00 -2.33 0.00 0.00 43.42 38.64 1tgs n LEU 99 CO 0.42 -0.81 0.55 0.21 -1.33 0.00 0.00 177.39 176.43 1tgs s ASN 100 N -2.62 7.19 -1.26 -1.43 3.04 -1.19 -3.59 114.94 115.08 1tgs s ASN 100 Ca 0.00 1.64 -0.01 0.00 0.04 0.00 0.00 52.86 54.53 1tgs s ASN 100 Cb 0.00 -2.50 0.00 0.00 -1.54 0.00 0.00 41.25 37.21 1tgs s ASN 100 CO 0.00 -0.04 0.90 0.59 -3.04 0.00 0.00 177.10 175.51 1tgs n ASN 101 N 0.57 -2.06 -3.73 -4.21 4.13 -1.26 -1.93 115.26 106.77 1tgs n ASN 101 Ca 0.00 -0.69 -0.42 0.00 1.68 0.00 0.00 54.58 55.15 1tgs n ASN 101 Cb 0.51 -4.68 -0.00 0.00 -1.54 0.00 0.00 39.78 34.06 1tgs n ASN 101 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1tgs n ASP 102 N -3.09 4.62 -3.76 6.41 2.03 -1.24 -4.25 116.55 117.27 1tgs n ASP 102 Ca -0.27 -2.90 -0.13 0.00 0.52 0.00 0.00 54.79 52.02 1tgs n ASP 102 Cb 0.66 -1.60 -0.13 0.00 -0.72 0.00 0.00 41.12 39.34 1tgs n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1tgs s ILE 103 N 2.31 -0.02 0.01 5.18 2.07 -1.26 -3.73 121.20 125.77 1tgs s ILE 103 Ca 0.47 0.08 0.01 0.00 -1.41 0.00 0.00 60.65 59.80 1tgs s ILE 103 Cb 0.13 -0.33 -0.01 0.00 0.13 0.00 0.00 42.46 42.38 1tgs s ILE 103 CO -0.06 0.03 -0.05 -0.32 -1.91 0.00 0.00 174.94 172.63 1tgs s MET 104 N 0.70 0.40 -0.11 3.50 -2.45 -0.25 -1.88 119.30 119.20 1tgs s MET 104 Ca -0.05 -0.38 -0.04 0.00 -1.25 0.00 0.00 55.69 53.97 1tgs s MET 104 Cb -0.06 -0.28 -0.04 0.00 1.25 0.00 0.00 34.83 35.70 1tgs s MET 104 CO -0.04 0.07 0.05 -0.51 1.05 0.00 0.00 175.02 175.64 1tgs s LEU 105 N -0.69 3.87 -0.16 4.11 1.43 0.31 -0.91 118.68 126.64 1tgs s LEU 105 Ca -0.04 0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.32 1tgs s LEU 105 Cb -0.05 -1.91 0.03 0.00 0.03 0.00 0.00 46.19 44.28 1tgs s LEU 105 CO -0.00 0.37 -0.14 -0.63 0.23 0.00 0.00 176.35 176.18 1tgs s ILE 106 N -0.82 1.62 -0.16 -0.59 1.01 0.24 0.77 121.20 123.27 1tgs s ILE 106 Ca 0.13 -0.72 -0.20 0.00 0.00 0.00 0.00 60.65 59.85 1tgs s ILE 106 Cb -0.12 -1.55 -0.03 0.00 0.01 0.00 0.00 42.46 40.77 1tgs s ILE 106 CO 0.03 0.41 0.58 -0.75 0.00 0.00 0.00 174.94 175.21 1tgs s LYS 107 N 1.46 4.28 0.34 2.79 2.20 0.10 -0.99 119.74 129.92 1tgs s LYS 107 Ca 0.04 0.58 -0.25 0.00 -0.36 0.00 0.00 55.97 55.97 1tgs s LYS 107 Cb -0.13 -3.52 -0.10 0.00 -1.51 0.00 0.00 37.83 32.57 1tgs s LYS 107 CO -0.10 -0.07 0.96 -0.51 -0.36 0.00 0.00 175.35 175.26 1tgs s LEU 108 N 1.34 4.28 0.32 5.43 1.43 -0.29 -0.31 118.68 130.88 1tgs s LEU 108 Ca 0.29 1.84 0.01 0.00 -1.03 0.00 0.00 54.13 55.23 1tgs s LEU 108 Cb -0.16 -4.09 0.55 0.00 0.03 0.00 0.00 46.19 42.52 1tgs s LEU 108 CO 0.11 -0.14 1.95 0.50 0.23 0.00 0.00 176.35 179.01 1tgs h LYS 109 N 2.97 0.96 -4.76 1.70 3.64 -1.11 -3.42 116.57 116.54 1tgs h LYS 109 Ca -0.47 -0.06 -0.25 0.00 -1.27 0.00 0.00 60.65 58.60 1tgs h LYS 109 Cb 1.19 -0.22 -0.15 0.00 -0.41 0.00 0.00 32.23 32.65 1tgs h LYS 109 CO 0.64 0.63 -0.70 -1.54 -2.27 0.00 0.00 179.45 176.21 1tgs s SER 110 N -6.21 1.30 0.42 4.20 1.04 -1.26 -5.00 113.70 108.19 1tgs s SER 110 Ca -0.11 -0.99 -0.25 0.00 0.48 0.00 0.00 55.95 55.07 1tgs s SER 110 Cb 0.19 0.07 -0.08 0.00 0.10 0.00 0.00 66.02 66.29 1tgs s SER 110 CO 0.79 -0.42 1.24 0.00 0.98 0.00 0.00 173.24 175.83 1tgs s ALA 111 N -3.48 3.16 0.46 5.32 0.00 -1.26 -4.82 121.76 121.14 1tgs s ALA 111 Ca 0.12 1.11 -0.22 0.00 0.00 0.00 0.00 51.96 52.98 1tgs s ALA 111 Cb 0.04 -3.44 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 1tgs s ALA 111 CO -0.03 -0.73 1.07 0.00 0.00 0.00 0.00 175.76 176.06 1tgs s ALA 112 N -1.35 2.93 -0.37 0.00 0.00 0.16 -4.99 121.76 118.15 1tgs s ALA 112 Ca 0.58 0.69 -0.18 0.00 0.00 0.00 0.00 51.96 53.06 1tgs s ALA 112 Cb -0.35 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1tgs s ALA 112 CO 0.44 -0.37 0.51 -1.54 0.00 0.00 0.00 175.76 174.80 1tgs s SER 113 N -1.77 6.29 0.13 0.00 1.04 -1.26 -4.88 113.70 113.26 1tgs s SER 113 Ca 0.65 -0.15 -0.30 0.00 0.48 0.00 0.00 55.95 56.63 1tgs s SER 113 Cb -0.20 -2.26 -0.06 0.00 0.10 0.00 0.00 66.02 63.59 1tgs s SER 113 CO 0.24 -0.51 0.96 -0.76 0.98 0.00 0.00 173.24 174.15 1tgs s LEU 114 N 2.38 4.52 0.00 2.42 1.02 -1.26 -4.84 118.68 122.92 1tgs s LEU 114 Ca 0.18 1.82 0.00 0.00 0.02 0.00 0.00 54.13 56.14 1tgs s LEU 114 Cb -0.16 -3.59 0.00 0.00 0.02 0.00 0.00 46.19 42.47 1tgs s LEU 114 CO 0.14 -0.03 0.00 -0.46 0.02 0.00 0.00 176.35 176.02 1tgs n ASN 115 N 2.57 0.00 0.20 2.29 0.23 0.02 -4.97 115.26 115.60 1tgs n ASN 115 Ca 0.02 0.00 0.08 0.00 -0.53 0.00 0.00 54.58 54.14 1tgs n ASN 115 Cb 0.49 0.00 0.32 0.00 -2.08 0.00 0.00 39.78 38.51 1tgs n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1tgs h SER 116 N 0.00 0.00 -0.01 0.53 4.64 -1.98 -2.79 113.55 113.94 1tgs h SER 116 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1tgs h SER 116 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1tgs h SER 116 CO 0.00 0.30 -0.56 0.54 -0.87 0.00 0.00 176.83 176.23 1tgs n ARG 117 N -3.35 1.27 -3.72 4.77 1.74 -1.26 -4.39 116.66 111.72 1tgs n ARG 117 Ca 0.01 -0.60 -0.30 0.00 -0.77 0.00 0.00 57.85 56.19 1tgs n ARG 117 Cb 0.52 -1.38 -0.15 0.00 -1.02 0.00 0.00 32.46 30.43 1tgs n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1tgs s VAL 118 N -2.38 0.80 0.16 1.55 1.01 -1.05 -3.94 120.40 116.54 1tgs s VAL 118 Ca 0.13 -1.29 -0.11 0.00 0.00 0.00 0.00 61.98 60.71 1tgs s VAL 118 Cb 0.15 -1.58 0.00 0.00 0.00 0.00 0.00 36.38 34.95 1tgs s VAL 118 CO 0.58 -0.63 0.32 0.00 0.00 0.00 0.00 175.10 175.37 1tgs s ALA 119 N 1.66 -0.22 0.18 5.51 0.00 -0.65 -0.80 121.76 127.44 1tgs s ALA 119 Ca 0.09 -0.71 0.04 0.00 0.00 0.00 0.00 51.96 51.38 1tgs s ALA 119 Cb -0.17 0.81 -0.03 0.00 0.00 0.00 0.00 23.12 23.72 1tgs s ALA 119 CO -0.24 -0.66 0.26 -1.54 0.00 0.00 0.00 175.76 173.58 1tgs s SER 120 N -2.93 6.08 -0.14 0.00 1.04 -1.26 -3.09 113.70 113.39 1tgs s SER 120 Ca 0.14 0.04 -0.07 0.00 0.48 0.00 0.00 55.95 56.54 1tgs s SER 120 Cb 0.03 -1.75 -0.04 0.00 0.10 0.00 0.00 66.02 64.35 1tgs s SER 120 CO -0.02 0.02 0.10 -0.51 0.98 0.00 0.00 173.24 173.80 1tgs s ILE 121 N -1.84 5.15 0.55 -1.02 1.10 0.07 -4.90 121.20 120.31 1tgs s ILE 121 Ca 0.33 0.08 -0.20 0.00 -0.51 0.00 0.00 60.65 60.36 1tgs s ILE 121 Cb -0.10 -3.27 -0.05 0.00 0.15 0.00 0.00 42.46 39.19 1tgs s ILE 121 CO 0.27 0.55 1.20 -0.44 -2.11 0.00 0.00 174.94 174.41 1tgs s SER 122 N -0.44 5.50 0.34 4.50 0.01 -1.26 -4.64 113.70 117.71 1tgs s SER 122 Ca 0.11 2.36 -0.17 0.00 1.31 0.00 0.00 55.95 59.56 1tgs s SER 122 Cb -0.12 -2.60 -0.09 0.00 0.21 0.00 0.00 66.02 63.42 1tgs s SER 122 CO 0.02 -1.38 0.79 -0.76 0.41 0.00 0.00 173.24 172.32 1tgs s LEU 123 N -3.76 4.07 0.82 2.44 1.43 -1.26 -1.19 118.68 121.23 1tgs s LEU 123 Ca 0.73 1.40 -0.11 0.00 -1.03 0.00 0.00 54.13 55.12 1tgs s LEU 123 Cb -0.29 -4.13 0.09 0.00 0.03 0.00 0.00 46.19 41.89 1tgs s LEU 123 CO 0.33 -0.21 1.13 -2.16 0.23 0.00 0.00 176.35 175.67 1tgs s PRO 124 N -2.89 1.78 -0.12 1.29 0.04 -1.26 -4.78 135.00 129.05 1tgs s PRO 124 Ca 0.55 1.40 0.09 0.00 0.04 0.00 0.00 61.00 63.08 1tgs s PRO 124 Cb -0.11 -1.83 -0.14 0.00 0.04 0.00 0.00 34.50 32.47 1tgs s PRO 124 CO 0.17 -2.04 0.02 0.25 0.04 0.00 0.00 177.00 175.44 1tgs n THR 125 N -3.65 0.82 -4.20 1.26 -2.24 -1.26 -4.95 114.28 100.06 1tgs n THR 125 Ca 0.11 -0.48 -0.12 0.00 -2.27 0.00 0.00 64.05 61.29 1tgs n THR 125 Cb 0.52 -0.74 -0.10 0.00 -2.10 0.00 0.00 70.33 67.92 1tgs n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1tgs s SER 127 N -4.61 1.23 0.49 3.42 1.04 -1.26 -5.15 113.70 108.87 1tgs s SER 127 Ca -0.08 -1.06 -0.20 0.00 0.48 0.00 0.00 55.95 55.09 1tgs s SER 127 Cb 0.04 0.09 -0.08 0.00 0.10 0.00 0.00 66.02 66.17 1tgs s SER 127 CO 0.47 -0.48 1.05 0.00 0.98 0.00 0.00 173.24 175.25 1tgs s ALA 129 N -1.95 3.14 0.39 0.00 0.00 -1.26 -5.09 121.76 116.99 1tgs s ALA 129 Ca 0.68 0.34 0.05 0.00 0.00 0.00 0.00 51.96 53.03 1tgs s ALA 129 Cb -0.17 -3.06 -0.00 0.00 0.00 0.00 0.00 23.12 19.88 1tgs s ALA 129 CO 0.21 0.19 0.56 -1.54 0.00 0.00 0.00 175.76 175.17 1tgs s SER 130 N -2.08 5.83 0.23 0.00 1.04 -1.26 -5.04 113.70 112.42 1tgs s SER 130 Ca 0.58 -0.11 -0.31 0.00 0.48 0.00 0.00 55.95 56.59 1tgs s SER 130 Cb -0.11 -1.17 -0.11 0.00 0.10 0.00 0.00 66.02 64.73 1tgs s SER 130 CO 0.16 -0.61 1.57 0.00 0.98 0.00 0.00 173.24 175.34 1tgs s ALA 132 N -2.33 3.76 0.00 5.32 0.00 -1.26 -1.86 121.76 125.38 1tgs s ALA 132 Ca 0.48 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1tgs s ALA 132 Cb -0.10 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.40 1tgs s ALA 132 CO 0.33 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.65 1tgs n GLY 133 N 2.90 0.68 3.69 0.00 0.00 0.11 -4.98 105.19 107.60 1tgs n GLY 133 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1tgs n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tgs s THR 134 N -2.62 4.08 0.04 2.61 2.01 -0.78 -4.67 115.64 116.32 1tgs s THR 134 Ca 0.00 1.45 -0.26 0.00 0.31 0.00 0.00 61.69 63.18 1tgs s THR 134 Cb 0.00 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.53 1tgs s THR 134 CO 0.00 0.03 0.82 -1.58 -0.69 0.00 0.00 174.62 173.20 1tgs s GLN 135 N 1.94 4.54 0.37 4.92 0.74 -1.26 -0.75 119.66 130.15 1tgs s GLN 135 Ca 0.58 1.16 0.05 0.00 0.05 0.00 0.00 55.36 57.20 1tgs s GLN 135 Cb -0.27 -3.39 -0.06 0.00 1.10 0.00 0.00 33.01 30.39 1tgs s GLN 135 CO 0.25 0.20 0.05 0.00 -0.55 0.00 0.00 175.29 175.24 1tgs s LEU 137 N -3.59 2.55 -0.12 0.00 2.96 0.60 -1.12 118.68 119.96 1tgs s LEU 137 Ca 0.33 -0.51 -0.01 0.00 -0.22 0.00 0.00 54.13 53.73 1tgs s LEU 137 Cb 0.08 -1.62 -0.02 0.00 0.50 0.00 0.00 46.19 45.13 1tgs s LEU 137 CO 0.15 -0.01 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.45 1tgs s ILE 138 N 1.39 3.43 0.09 6.68 1.01 0.22 -1.22 121.20 132.79 1tgs s ILE 138 Ca 0.05 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.20 1tgs s ILE 138 Cb -0.14 -2.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.85 1tgs s ILE 138 CO -0.08 0.53 -0.09 -0.94 0.00 0.00 0.00 174.94 174.36 1tgs s SER 139 N 0.06 1.32 0.00 3.58 1.04 -1.17 -0.95 113.70 117.59 1tgs s SER 139 Ca -0.03 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.62 1tgs s SER 139 Cb -0.14 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.00 1tgs s SER 139 CO 0.04 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.60 1tgs n GLY 140 N 0.68 -2.00 1.07 7.32 0.00 -0.68 -4.34 105.19 107.23 1tgs n GLY 140 Ca -0.17 -1.17 0.12 0.00 0.00 0.00 0.00 46.02 44.80 1tgs n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1tgs n TRP 141 N -0.49 0.47 -1.72 1.61 8.01 -1.26 -1.59 117.44 122.47 1tgs n TRP 141 Ca 0.00 -0.24 -0.42 0.00 -1.31 0.00 0.00 57.50 55.53 1tgs n TRP 141 Cb 0.00 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.27 1tgs n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1tgs s GLY 142 N -1.48 1.46 0.22 6.99 0.00 -1.26 -1.39 107.32 111.86 1tgs s GLY 142 Ca 0.38 1.27 0.09 0.00 0.00 0.00 0.00 44.72 46.46 1tgs s GLY 142 CO 0.31 3.40 -0.17 -1.31 0.00 0.00 0.00 173.10 175.33 1tgs s ASN 143 N 4.25 2.94 -0.08 1.64 0.02 0.74 -4.71 114.94 119.74 1tgs s ASN 143 Ca 0.86 -0.99 0.00 0.00 -1.02 0.00 0.00 52.86 51.71 1tgs s ASN 143 Cb -0.41 -0.19 0.02 0.00 0.02 0.00 0.00 41.25 40.68 1tgs s ASN 143 CO 0.40 -0.07 -0.06 -0.89 0.02 0.00 0.00 177.10 176.49 1tgs s THR 144 N -2.62 0.82 -0.06 1.60 2.01 0.55 -0.33 115.64 117.61 1tgs s THR 144 Ca 0.24 -0.22 -0.21 0.00 0.31 0.00 0.00 61.69 61.81 1tgs s THR 144 Cb -0.03 -0.84 -0.04 0.00 0.01 0.00 0.00 72.50 71.59 1tgs s THR 144 CO 0.09 0.31 0.61 -0.54 -0.69 0.00 0.00 174.62 174.41 1tgs s LYS 145 N 1.36 4.38 0.00 4.92 -0.14 0.58 -4.19 119.74 126.65 1tgs s LYS 145 Ca -0.03 0.73 0.00 0.00 -1.36 0.00 0.00 55.97 55.32 1tgs s LYS 145 Cb -0.14 -3.41 0.00 0.00 -1.68 0.00 0.00 37.83 32.60 1tgs s LYS 145 CO -0.03 0.18 0.00 0.45 -0.76 0.00 0.00 175.35 175.19 1tgs n SER 146 N 3.42 0.00 -1.65 2.83 2.88 -1.26 -0.53 113.62 119.31 1tgs n SER 146 Ca -0.04 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.47 1tgs n SER 146 Cb 0.51 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.93 1tgs n SER 146 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1tgs n SER 147 N 0.00 5.10 -1.94 -3.46 7.64 -1.26 -4.75 113.62 114.95 1tgs n SER 147 Ca 0.00 -2.37 -0.16 0.00 1.01 0.00 0.00 58.87 57.35 1tgs n SER 147 Cb 0.00 -1.15 -0.04 0.00 -1.01 0.00 0.00 64.21 62.01 1tgs n SER 147 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tgs n GLY 148 N 1.77 0.49 3.45 0.23 0.00 0.30 -4.96 105.19 106.48 1tgs n GLY 148 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1tgs n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tgs s THR 149 N -2.55 4.88 0.19 2.61 2.01 -0.09 -4.84 115.64 117.85 1tgs s THR 149 Ca 0.00 -0.50 -0.28 0.00 0.31 0.00 0.00 61.69 61.22 1tgs s THR 149 Cb 0.00 -3.58 -0.08 0.00 0.01 0.00 0.00 72.50 68.85 1tgs s THR 149 CO 0.00 -0.08 0.86 -0.44 -0.69 0.00 0.00 174.62 174.27 1tgs s SER 150 N 1.64 7.52 0.05 3.53 0.01 -1.26 -0.31 113.70 124.88 1tgs s SER 150 Ca 0.04 1.79 -0.27 0.00 1.31 0.00 0.00 55.95 58.83 1tgs s SER 150 Cb -0.18 -2.56 0.08 0.00 0.21 0.00 0.00 66.02 63.58 1tgs s SER 150 CO 0.08 0.16 0.71 -0.72 0.41 0.00 0.00 173.24 173.88 1tgs s TYR 151 N -1.07 -0.51 0.17 2.43 1.13 0.55 -4.96 117.35 115.09 1tgs s TYR 151 Ca 0.39 0.51 -0.18 0.00 -1.41 0.00 0.00 57.07 56.37 1tgs s TYR 151 Cb -0.24 0.51 -0.08 0.00 -1.10 0.00 0.00 41.96 41.05 1tgs s TYR 151 CO 0.29 -0.69 0.65 -1.25 -2.51 0.00 0.00 175.55 172.04 1tgs s PRO 152 N -2.85 4.18 0.00 -3.49 0.04 -1.26 -0.18 135.00 131.43 1tgs s PRO 152 Ca -0.01 0.75 0.00 0.00 0.04 0.00 0.00 61.00 61.78 1tgs s PRO 152 Cb -0.01 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.56 1tgs s PRO 152 CO -0.06 0.47 0.00 -3.47 0.04 0.00 0.00 177.00 173.98 1tgs n ASP 153 N 0.94 0.00 -4.72 6.66 4.64 -0.49 -4.93 116.55 118.65 1tgs n ASP 153 Ca -0.05 0.00 -0.41 0.00 -1.38 0.00 0.00 54.79 52.96 1tgs n ASP 153 Cb 0.51 0.04 -0.04 0.00 -1.04 0.00 0.00 41.12 40.59 1tgs n ASP 153 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1tgs s VAL 154 N -0.12 4.90 -0.25 5.18 1.01 -1.26 -4.23 120.40 125.63 1tgs s VAL 154 Ca 0.00 1.71 -0.29 0.00 0.00 0.00 0.00 61.98 63.40 1tgs s VAL 154 Cb 0.00 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 1tgs s VAL 154 CO 0.00 0.25 1.80 -0.22 0.00 0.00 0.00 175.10 176.93 1tgs s LEU 155 N 0.65 3.69 0.18 3.92 2.96 -1.26 -4.51 118.68 124.30 1tgs s LEU 155 Ca 0.43 1.57 0.09 0.00 -0.22 0.00 0.00 54.13 56.01 1tgs s LEU 155 Cb -0.20 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 1tgs s LEU 155 CO 0.23 -1.54 -0.20 -1.59 -1.32 0.00 0.00 176.35 171.93 1tgs s LYS 156 N 5.33 1.37 0.10 1.98 -2.85 -0.62 -2.38 119.74 122.66 1tgs s LYS 156 Ca 0.80 -1.47 0.06 0.00 -1.00 0.00 0.00 55.97 54.36 1tgs s LYS 156 Cb -0.26 -1.49 -0.03 0.00 -2.06 0.00 0.00 37.83 33.99 1tgs s LYS 156 CO 0.33 0.30 -0.15 0.00 0.10 0.00 0.00 175.35 175.94 1tgs s LEU 158 N -2.12 0.15 -0.17 0.00 2.96 -0.12 -0.78 118.68 118.60 1tgs s LEU 158 Ca 0.04 0.73 -0.14 0.00 -0.22 0.00 0.00 54.13 54.55 1tgs s LEU 158 Cb -0.07 1.09 -0.05 0.00 0.50 0.00 0.00 46.19 47.66 1tgs s LEU 158 CO 0.03 -0.18 0.28 -0.54 -1.32 0.00 0.00 176.35 174.62 1tgs s LYS 159 N 1.28 4.24 -0.02 1.98 1.02 -1.26 -0.61 119.74 126.36 1tgs s LYS 159 Ca -0.09 0.06 -0.07 0.00 0.02 0.00 0.00 55.97 55.89 1tgs s LYS 159 Cb -0.09 -3.44 0.01 0.00 -0.52 0.00 0.00 37.83 33.79 1tgs s LYS 159 CO -0.10 0.20 0.16 0.00 -0.92 0.00 0.00 175.35 174.69 1tgs s ALA 160 N 0.58 -0.40 0.54 5.17 0.00 -0.27 -4.95 121.76 122.43 1tgs s ALA 160 Ca 0.16 0.12 -0.16 0.00 0.00 0.00 0.00 51.96 52.08 1tgs s ALA 160 Cb -0.13 -0.04 -0.07 0.00 0.00 0.00 0.00 23.12 22.88 1tgs s ALA 160 CO 0.04 -0.17 1.00 -1.25 0.00 0.00 0.00 175.76 175.38 1tgs s PRO 161 N -0.85 3.79 0.04 0.00 0.04 -1.26 -0.30 135.00 136.45 1tgs s PRO 161 Ca -0.09 0.99 -0.29 0.00 0.04 0.00 0.00 61.00 61.65 1tgs s PRO 161 Cb -0.05 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 1tgs s PRO 161 CO 0.01 -0.41 0.91 0.42 0.04 0.00 0.00 177.00 177.98 1tgs s ILE 162 N -2.63 4.75 0.48 0.56 1.01 0.07 -1.81 121.20 123.63 1tgs s ILE 162 Ca 0.60 1.93 -0.04 0.00 0.00 0.00 0.00 60.65 63.14 1tgs s ILE 162 Cb -0.11 -4.26 -0.03 0.00 0.01 0.00 0.00 42.46 38.07 1tgs s ILE 162 CO 0.34 0.25 0.77 -0.76 0.00 0.00 0.00 174.94 175.54 1tgs s LEU 163 N 0.50 3.62 0.65 2.97 1.43 0.19 0.05 118.68 128.10 1tgs s LEU 163 Ca 0.47 0.81 -0.15 0.00 -1.03 0.00 0.00 54.13 54.22 1tgs s LEU 163 Cb -0.21 -3.73 -0.01 0.00 0.03 0.00 0.00 46.19 42.27 1tgs s LEU 163 CO 0.27 -0.61 1.11 -0.94 0.23 0.00 0.00 176.35 176.40 1tgs s SER 164 N -4.13 5.19 0.32 2.29 1.04 -1.26 -4.65 113.70 112.51 1tgs s SER 164 Ca 0.47 1.99 0.02 0.00 0.48 0.00 0.00 55.95 58.92 1tgs s SER 164 Cb -0.10 -2.55 0.56 0.00 0.10 0.00 0.00 66.02 64.02 1tgs s SER 164 CO 0.43 -1.57 1.89 -0.78 0.98 0.00 0.00 173.24 174.19 1tgs h ASP 165 N 0.11 0.61 -0.07 7.02 3.58 -1.97 -0.99 116.42 124.72 1tgs h ASP 165 Ca -0.47 -0.09 0.04 0.00 0.42 0.00 0.00 57.03 56.92 1tgs h ASP 165 Cb 1.24 -0.16 -0.06 0.00 1.72 0.00 0.00 39.33 42.08 1tgs h ASP 165 CO 0.54 0.61 -0.41 0.28 -2.88 0.00 0.00 179.24 177.38 1tgs h SER 166 N 0.64 -1.26 0.60 2.28 0.02 -1.99 0.14 113.55 113.99 1tgs h SER 166 Ca 0.15 0.16 -0.11 0.00 -0.84 0.00 0.00 61.79 61.15 1tgs h SER 166 Cb 0.24 0.50 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 1tgs h SER 166 CO -0.00 -0.43 -0.50 0.77 -1.14 0.00 0.00 176.83 175.52 1tgs h SER 167 N -0.52 0.00 -0.25 3.07 4.64 -1.86 -1.36 113.55 117.27 1tgs h SER 167 Ca 0.06 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.27 1tgs h SER 167 Cb 0.63 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1tgs h SER 167 CO -0.35 0.50 -0.29 0.00 -0.87 0.00 0.00 176.83 175.82 1tgs h LYS 169 N 0.35 0.00 0.10 0.00 1.57 -0.82 -0.40 116.57 117.36 1tgs h LYS 169 Ca 0.03 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.54 1tgs h LYS 169 Cb 0.86 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 1tgs h LYS 169 CO 0.07 0.00 -1.27 1.03 -0.57 0.00 0.00 179.45 178.71 1tgs h SER 170 N 0.00 0.34 -0.29 0.86 0.87 -1.03 -2.55 113.55 111.75 1tgs h SER 170 Ca 0.00 -0.38 -0.08 0.00 -1.23 0.00 0.00 61.79 60.09 1tgs h SER 170 Cb 0.56 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 1tgs h SER 170 CO 0.00 1.30 -0.14 0.00 -0.53 0.00 0.00 176.83 177.46 1tgs h ALA 171 N 0.64 0.41 -2.29 6.23 0.00 -0.85 -3.38 119.26 120.02 1tgs h ALA 171 Ca -0.14 -0.33 -0.60 0.00 0.00 0.00 0.00 54.91 53.85 1tgs h ALA 171 Cb 1.95 -0.10 -0.41 0.00 0.00 0.00 0.00 17.79 19.23 1tgs h ALA 171 CO 0.18 0.29 -0.70 0.66 0.00 0.00 0.00 179.25 179.69 1tgs n TYR 172 N -4.41 2.70 -1.86 0.00 4.02 -0.20 -4.97 117.16 112.43 1tgs n TYR 172 Ca -0.03 -4.04 -0.42 0.00 -0.01 0.00 0.00 57.90 53.40 1tgs n TYR 172 Cb 0.37 -0.50 -0.03 0.00 -0.02 0.00 0.00 39.34 39.16 1tgs n TYR 172 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 1tgs s PRO 173 N -2.00 4.18 0.00 -0.72 0.02 -0.96 -1.65 135.00 133.87 1tgs s PRO 173 Ca 0.37 2.43 0.00 0.00 0.02 0.00 0.00 61.00 63.82 1tgs s PRO 173 Cb 0.12 -3.34 0.00 0.00 0.02 0.00 0.00 34.50 31.30 1tgs s PRO 173 CO -0.06 -0.71 0.00 0.41 -0.33 0.00 0.00 177.00 176.32 1tgs n GLY 174 N 3.94 2.82 0.05 0.52 0.00 -1.26 -4.87 105.19 106.39 1tgs n GLY 174 Ca 0.15 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.23 1tgs n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tgs n GLN 175 N -2.00 0.65 -3.05 1.61 6.02 -0.66 -4.95 117.38 115.01 1tgs n GLN 175 Ca 0.00 -0.06 -0.42 0.00 -0.01 0.00 0.00 57.00 56.51 1tgs n GLN 175 Cb 0.00 -1.60 -0.06 0.00 1.02 0.00 0.00 30.24 29.60 1tgs n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1tgs s ILE 176 N -3.21 4.87 0.65 5.09 -1.09 -1.24 -5.04 121.20 121.24 1tgs s ILE 176 Ca -0.07 0.90 0.02 0.00 -2.23 0.00 0.00 60.65 59.28 1tgs s ILE 176 Cb 0.11 -4.08 0.10 0.00 -1.58 0.00 0.00 42.46 37.01 1tgs s ILE 176 CO 0.86 -0.23 0.90 0.42 -1.23 0.00 0.00 174.94 175.66 1tgs s THR 177 N 2.78 2.24 -0.83 2.92 -4.23 -1.26 -4.97 115.64 112.28 1tgs s THR 177 Ca 0.28 -0.72 0.18 0.00 -1.18 0.00 0.00 61.69 60.24 1tgs s THR 177 Cb -0.14 -2.52 0.16 0.00 1.34 0.00 0.00 72.50 71.34 1tgs s THR 177 CO 0.13 0.00 1.56 -1.54 -0.54 0.00 0.00 174.62 174.23 1tgs n SER 178 N -2.59 0.22 -1.42 3.99 3.41 -1.26 -2.20 113.62 113.78 1tgs n SER 178 Ca 0.14 0.55 0.09 0.00 -0.26 0.00 0.00 58.87 59.39 1tgs n SER 178 Cb 0.61 -0.60 0.33 0.00 -0.26 0.00 0.00 64.21 64.28 1tgs n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1tgs n ASN 179 N -1.75 4.49 -4.34 4.04 3.02 -1.26 -4.92 115.26 114.53 1tgs n ASN 179 Ca 0.03 -2.44 -0.23 0.00 -0.03 0.00 0.00 54.58 51.92 1tgs n ASN 179 Cb 0.19 -0.54 -0.11 0.00 -0.61 0.00 0.00 39.78 38.71 1tgs n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1tgs s MET 180 N -1.82 1.30 0.11 3.52 -1.94 -0.93 -0.72 119.30 118.81 1tgs s MET 180 Ca 0.48 -1.41 -0.00 0.00 -1.71 0.00 0.00 55.69 53.04 1tgs s MET 180 Cb 0.31 -1.40 -0.04 0.00 2.01 0.00 0.00 34.83 35.71 1tgs s MET 180 CO 0.23 0.29 0.01 -0.59 -0.01 0.00 0.00 175.02 174.95 1tgs s PHE 181 N -1.95 0.82 -0.03 -0.03 -0.12 -0.18 -4.77 117.98 111.73 1tgs s PHE 181 Ca 0.16 -1.13 0.00 0.00 -0.05 0.00 0.00 56.93 55.91 1tgs s PHE 181 Cb -0.06 -0.49 -0.04 0.00 -0.63 0.00 0.00 43.02 41.80 1tgs s PHE 181 CO 0.07 -0.40 0.02 0.00 -0.05 0.00 0.00 175.22 174.86 1tgs s ALA 183 N -1.06 0.32 0.00 0.00 0.00 -0.81 -0.64 121.76 119.57 1tgs s ALA 183 Ca 0.19 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.54 1tgs s ALA 183 Cb -0.12 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.09 1tgs s ALA 183 CO 0.09 -0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.18 1tgs n GLY 184 N 1.71 0.74 3.03 0.00 0.00 -0.75 -2.76 105.19 107.16 1tgs n GLY 184 Ca -0.22 -2.06 -0.28 0.00 0.00 0.00 0.00 46.02 43.46 1tgs n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tgs s TYR 184 N -1.56 1.82 0.02 1.61 1.51 -1.26 -4.42 117.35 115.08 1tgs s TYR 184 Ca 0.00 -0.85 0.32 0.00 -1.01 0.00 0.00 57.07 55.53 1tgs s TYR 184 Cb 0.00 -1.34 1.43 0.00 -0.11 0.00 0.00 41.96 41.94 1tgs s TYR 184 CO 0.00 -0.46 1.95 -0.07 -1.11 0.00 0.00 175.55 175.86 1tgs h LEU 185 N 7.49 0.00 -0.22 -1.29 3.38 -1.96 -0.81 115.31 121.90 1tgs h LEU 185 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1tgs h LEU 185 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1tgs h LEU 185 CO 0.48 0.00 -0.16 -1.84 0.09 0.00 0.00 178.44 177.00 1tgs n GLU 186 N -2.81 0.56 0.00 1.13 0.28 -1.26 -0.24 120.64 118.30 1tgs n GLU 186 Ca 0.00 -0.22 0.00 0.00 -0.16 0.00 0.00 57.16 56.78 1tgs n GLU 186 Cb 0.23 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.60 1tgs n GLU 186 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1tgs n GLY 187 N 1.34 -1.33 3.26 -1.84 0.00 -0.31 -4.37 105.19 101.94 1tgs n GLY 187 Ca 0.12 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1tgs n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tgs n GLY 188 N 0.00 2.65 2.91 -0.02 0.00 0.21 -4.86 105.19 106.08 1tgs n GLY 188 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1tgs n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tgs s LYS 188 N -0.02 1.53 0.39 1.61 1.02 -1.26 -3.42 119.74 119.60 1tgs s LYS 188 Ca 0.00 -0.27 -0.13 0.00 0.02 0.00 0.00 55.97 55.59 1tgs s LYS 188 Cb 0.00 -1.61 0.05 0.00 -0.52 0.00 0.00 37.83 35.75 1tgs s LYS 188 CO 0.00 -0.27 0.75 -3.47 -0.92 0.00 0.00 175.35 171.44 1tgs n ASP 189 N 4.94 -2.19 -4.94 2.83 4.64 -0.71 -4.46 116.55 116.65 1tgs n ASP 189 Ca -0.12 -2.64 -0.25 0.00 -1.38 0.00 0.00 54.79 50.39 1tgs n ASP 189 Cb 0.50 3.68 -0.03 0.00 -1.04 0.00 0.00 41.12 44.23 1tgs n ASP 189 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 1tgs s SER 190 N -3.09 6.35 0.33 1.67 1.04 -1.26 -4.78 113.70 113.95 1tgs s SER 190 Ca 0.18 0.29 -0.02 0.00 0.48 0.00 0.00 55.95 56.89 1tgs s SER 190 Cb -0.04 -1.96 0.01 0.00 0.10 0.00 0.00 66.02 64.12 1tgs s SER 190 CO 0.13 -0.06 0.45 0.00 0.98 0.00 0.00 173.24 174.74 1tgs n GLN 192 N -0.54 2.57 0.00 0.00 3.00 -1.26 -0.96 117.38 120.18 1tgs n GLN 192 Ca 0.01 0.93 0.00 0.00 -0.01 0.00 0.00 57.00 57.93 1tgs n GLN 192 Cb 0.55 -2.78 0.00 0.00 0.00 0.00 0.00 30.24 28.01 1tgs n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1tgs n GLY 193 N 3.99 1.56 0.06 1.08 0.00 -1.26 -4.35 105.19 106.27 1tgs n GLY 193 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1tgs n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tgs n ASP 194 N 0.00 0.68 -4.46 1.61 10.43 -0.14 -3.97 116.55 120.70 1tgs n ASP 194 Ca 0.00 0.05 -0.52 0.00 2.57 0.00 0.00 54.79 56.88 1tgs n ASP 194 Cb 0.00 0.52 -0.05 0.00 1.84 0.00 0.00 41.12 43.43 1tgs n ASP 194 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1tgs n SER 195 N -2.19 -0.53 0.00 -2.24 7.64 -1.26 -1.45 113.62 113.59 1tgs n SER 195 Ca 0.02 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1tgs n SER 195 Cb 0.47 -0.96 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 1tgs n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tgs n GLY 196 N 1.79 2.53 3.95 0.23 0.00 0.23 -0.22 105.19 113.70 1tgs n GLY 196 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 1tgs n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tgs s GLY 197 N -1.83 1.76 0.31 -0.02 0.00 -0.53 -3.55 107.32 103.46 1tgs s GLY 197 Ca 0.00 -1.36 -0.27 0.00 0.00 0.00 0.00 44.72 43.08 1tgs s GLY 197 CO 0.00 -0.71 1.01 2.56 0.00 0.00 0.00 173.10 175.96 1tgs s PRO 198 N -5.53 4.57 -0.29 2.90 0.04 -1.26 -1.48 135.00 133.95 1tgs s PRO 198 Ca 0.69 1.54 0.02 0.00 0.04 0.00 0.00 61.00 63.30 1tgs s PRO 198 Cb -0.05 -2.96 0.08 0.00 0.04 0.00 0.00 34.50 31.60 1tgs s PRO 198 CO 0.49 0.22 -0.01 0.08 0.04 0.00 0.00 177.00 177.82 1tgs s VAL 199 N -1.40 1.90 -0.19 -0.36 1.01 -0.24 -3.04 120.40 118.08 1tgs s VAL 199 Ca 0.48 -1.77 -0.03 0.00 0.00 0.00 0.00 61.98 60.67 1tgs s VAL 199 Cb -0.25 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 1tgs s VAL 199 CO 0.31 -0.33 -0.07 -0.69 0.00 0.00 0.00 175.10 174.32 1tgs s VAL 200 N 1.16 3.23 -0.20 2.92 1.01 -0.36 -0.58 120.40 127.58 1tgs s VAL 200 Ca 0.01 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.45 1tgs s VAL 200 Cb -0.19 -2.44 0.04 0.00 0.00 0.00 0.00 36.38 33.80 1tgs s VAL 200 CO -0.09 0.46 -0.11 0.00 0.00 0.00 0.00 175.10 175.36 1tgs n SER 202 N 4.67 -0.73 0.00 0.00 3.41 -1.26 -1.35 113.62 118.35 1tgs n SER 202 Ca -0.15 -0.98 0.00 0.00 -0.26 0.00 0.00 58.87 57.48 1tgs n SER 202 Cb 0.46 -3.15 0.00 0.00 -0.26 0.00 0.00 64.21 61.27 1tgs n SER 202 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tgs n GLY 203 N -1.90 0.48 3.40 5.00 0.00 -1.26 -5.03 105.19 105.88 1tgs n GLY 203 Ca -0.27 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 1tgs n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tgs s LYS 204 N -0.12 1.45 -0.66 1.61 3.01 -0.46 -4.17 119.74 120.40 1tgs s LYS 204 Ca 0.00 -1.49 -0.27 0.00 -1.01 0.00 0.00 55.97 53.20 1tgs s LYS 204 Cb 0.00 -1.72 0.02 0.00 -1.01 0.00 0.00 37.83 35.12 1tgs s LYS 204 CO 0.00 0.37 1.35 -1.17 0.51 0.00 0.00 175.35 176.41 1tgs s LEU 209 N -2.64 3.27 -0.02 3.17 2.96 -0.34 -0.62 118.68 124.46 1tgs s LEU 209 Ca 0.19 -0.13 0.18 0.00 -0.22 0.00 0.00 54.13 54.15 1tgs s LEU 209 Cb -0.08 -2.76 -0.26 0.00 0.50 0.00 0.00 46.19 43.59 1tgs s LEU 209 CO 0.09 -1.80 0.45 0.00 -1.32 0.00 0.00 176.35 173.77 1tgs n GLN 210 N 9.05 0.67 -4.12 1.98 1.13 0.25 -4.16 117.38 122.19 1tgs n GLN 210 Ca 0.07 -0.13 -0.08 0.00 -1.94 0.00 0.00 57.00 54.92 1tgs n GLN 210 Cb 0.49 -1.41 -0.10 0.00 0.11 0.00 0.00 30.24 29.34 1tgs n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1tgs s GLY 211 N -3.81 0.72 -0.07 1.08 0.00 -0.51 -2.32 107.32 102.41 1tgs s GLY 211 Ca -0.04 -1.33 0.03 0.00 0.00 0.00 0.00 44.72 43.37 1tgs s GLY 211 CO 0.74 -1.34 -0.16 -0.42 0.00 0.00 0.00 173.10 171.91 1tgs s ILE 212 N -3.98 1.45 -0.04 0.90 1.01 -0.95 -1.08 121.20 118.51 1tgs s ILE 212 Ca 0.15 -0.68 -0.32 0.00 0.00 0.00 0.00 60.65 59.80 1tgs s ILE 212 Cb 0.08 -1.28 -0.11 0.00 0.01 0.00 0.00 42.46 41.16 1tgs s ILE 212 CO -0.04 0.42 1.93 0.52 0.00 0.00 0.00 174.94 177.77 1tgs n VAL 213 N 3.59 0.66 0.00 2.92 0.31 -0.55 -1.26 118.33 124.00 1tgs n VAL 213 Ca -0.21 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1tgs n VAL 213 Cb 0.52 -2.06 0.00 0.00 -0.91 0.00 0.00 33.84 31.39 1tgs n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1tgs n SER 214 N 7.08 0.00 -2.65 4.52 2.88 -1.00 -0.60 113.62 123.85 1tgs n SER 214 Ca 0.22 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.64 1tgs n SER 214 Cb 0.34 -0.02 -0.03 0.00 -0.75 0.00 0.00 64.21 63.75 1tgs n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1tgs n TRP 215 N -2.12 -1.25 -3.60 0.66 4.27 -0.58 -4.89 117.44 109.94 1tgs n TRP 215 Ca 0.00 -1.95 0.02 0.00 -3.89 0.00 0.00 57.50 51.68 1tgs n TRP 215 Cb 0.00 0.45 -0.00 0.00 -1.36 0.00 0.00 31.31 30.39 1tgs n TRP 215 CO 0.00 0.00 0.00 0.20 -2.29 0.00 0.00 177.69 175.60 1tgs s GLY 216 N -2.79 -0.43 -0.68 -1.67 0.00 -1.26 -0.41 107.32 100.08 1tgs s GLY 216 Ca 0.24 0.82 -0.19 0.00 0.00 0.00 0.00 44.72 45.59 1tgs s GLY 216 CO 0.17 0.16 0.83 -0.45 0.00 0.00 0.00 173.10 173.81 1tgs s SER 217 N -2.94 6.30 0.68 1.64 0.15 -1.26 -4.87 113.70 113.40 1tgs s SER 217 Ca 0.14 -1.54 0.00 0.00 0.70 0.00 0.00 55.95 55.25 1tgs s SER 217 Cb 0.05 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 1tgs s SER 217 CO -0.05 -1.13 0.00 0.61 1.20 0.00 0.00 173.24 173.87 1tgs n GLY 219 N 5.22 0.35 2.98 9.45 0.00 -1.26 -4.70 105.19 117.24 1tgs n GLY 219 Ca -0.01 -0.89 -0.17 0.00 0.00 0.00 0.00 46.02 44.95 1tgs n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tgs n ALA 221 N 2.95 -0.65 -2.05 0.00 0.00 -1.26 -4.92 120.51 114.58 1tgs n ALA 221 Ca -0.14 0.13 -0.34 0.00 0.00 0.00 0.00 53.44 53.09 1tgs n ALA 221 Cb 0.57 -1.54 -0.06 0.00 0.00 0.00 0.00 19.45 18.42 1tgs n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1tgs s GLN 221 N -4.66 4.17 0.31 0.00 -0.21 -1.26 -0.62 119.66 117.40 1tgs s GLN 221 Ca 0.00 0.86 -0.29 0.00 0.02 0.00 0.00 55.36 55.94 1tgs s GLN 221 Cb 0.00 -2.59 -0.11 0.00 1.00 0.00 0.00 33.01 31.32 1tgs s GLN 221 CO 0.00 0.23 1.48 -1.59 -2.12 0.00 0.00 175.29 173.28 1tgs s LYS 222 N -2.58 4.19 0.00 2.91 -2.85 -1.26 -2.73 119.74 117.42 1tgs s LYS 222 Ca 0.51 2.45 0.00 0.00 -1.00 0.00 0.00 55.97 57.93 1tgs s LYS 222 Cb -0.13 -3.03 0.00 0.00 -2.06 0.00 0.00 37.83 32.61 1tgs s LYS 222 CO 0.19 -0.48 0.00 0.09 0.10 0.00 0.00 175.35 175.25 1tgs n ASN 223 N 1.45 -3.26 -3.73 0.03 3.02 0.66 -4.91 115.26 108.53 1tgs n ASN 223 Ca 0.04 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.32 1tgs n ASN 223 Cb 0.39 -2.40 -0.11 0.00 -0.61 0.00 0.00 39.78 37.06 1tgs n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1tgs n LYS 224 N -0.77 1.82 -1.29 3.52 4.76 -1.10 -4.73 118.16 120.36 1tgs n LYS 224 Ca 0.00 -4.39 -0.32 0.00 -2.87 0.00 0.00 58.31 50.73 1tgs n LYS 224 Cb 0.23 -2.20 0.10 0.00 -1.84 0.00 0.00 35.03 31.32 1tgs n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1tgs s PRO 225 N -1.57 2.08 0.61 1.97 0.04 -1.26 -4.33 135.00 132.55 1tgs s PRO 225 Ca 0.29 1.44 -0.18 0.00 0.04 0.00 0.00 61.00 62.59 1tgs s PRO 225 Cb 0.01 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.67 1tgs s PRO 225 CO -0.14 -1.81 1.19 0.20 0.04 0.00 0.00 177.00 176.48 1tgs s GLY 226 N -2.73 2.64 -0.12 0.56 0.00 -1.11 -4.69 107.32 101.86 1tgs s GLY 226 Ca 0.67 0.94 0.02 0.00 0.00 0.00 0.00 44.72 46.35 1tgs s GLY 226 CO 0.51 1.33 -0.19 0.14 0.00 0.00 0.00 173.10 174.88 1tgs s VAL 227 N -1.71 2.48 0.02 1.40 1.01 0.45 -1.92 120.40 122.13 1tgs s VAL 227 Ca 0.76 -0.86 0.07 0.00 0.00 0.00 0.00 61.98 61.95 1tgs s VAL 227 Cb -0.29 -2.00 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 1tgs s VAL 227 CO 0.34 0.54 -0.22 -0.31 0.00 0.00 0.00 175.10 175.46 1tgs s TYR 228 N 0.48 1.91 0.13 5.22 2.02 0.12 -1.52 117.35 125.71 1tgs s TYR 228 Ca -0.13 -0.37 -0.31 0.00 -0.37 0.00 0.00 57.07 55.89 1tgs s TYR 228 Cb -0.17 -1.18 -0.08 0.00 -0.40 0.00 0.00 41.96 40.13 1tgs s TYR 228 CO 0.05 0.04 1.40 0.99 -1.57 0.00 0.00 175.55 176.46 1tgs s THR 229 N -0.66 3.20 -1.01 -0.71 2.01 -0.39 -1.01 115.64 117.08 1tgs s THR 229 Ca 0.08 0.88 -0.22 0.00 0.31 0.00 0.00 61.69 62.74 1tgs s THR 229 Cb -0.09 -3.56 0.06 0.00 0.01 0.00 0.00 72.50 68.92 1tgs s THR 229 CO 0.01 0.08 1.40 -0.75 -0.69 0.00 0.00 174.62 174.67 1tgs s LYS 230 N 0.92 3.59 0.55 4.92 2.20 0.11 -2.24 119.74 129.78 1tgs s LYS 230 Ca 0.64 -1.22 0.25 0.00 -0.36 0.00 0.00 55.97 55.29 1tgs s LYS 230 Cb -0.38 -5.30 1.47 0.00 -1.51 0.00 0.00 37.83 32.12 1tgs s LYS 230 CO 0.32 -2.15 2.05 0.28 -0.36 0.00 0.00 175.35 175.49 1tgs h VAL 231 N 6.66 0.67 0.00 4.02 2.07 -1.76 -2.39 116.25 125.51 1tgs h VAL 231 Ca 0.19 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.71 1tgs h VAL 231 Cb 1.01 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1tgs h VAL 231 CO 1.38 0.00 -0.02 0.00 0.02 0.00 0.00 177.57 178.96 1tgs n ASN 233 N -3.20 0.59 -0.03 0.00 3.02 -0.90 -3.82 115.26 110.92 1tgs n ASN 233 Ca -0.02 0.60 0.01 0.00 -0.03 0.00 0.00 54.58 55.14 1tgs n ASN 233 Cb 0.16 -0.74 0.00 0.00 -0.61 0.00 0.00 39.78 38.59 1tgs n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1tgs n TYR 234 N -2.11 0.00 -0.25 3.10 4.01 -0.23 -4.81 117.16 116.87 1tgs n TYR 234 Ca 0.04 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.79 1tgs n TYR 234 Cb 0.30 0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.47 1tgs n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1tgs h VAL 235 N 0.17 0.88 -0.60 -0.72 2.07 -1.63 -0.13 116.25 116.29 1tgs h VAL 235 Ca 0.00 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.25 1tgs h VAL 235 Cb 0.04 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 29.95 1tgs h VAL 235 CO 0.00 0.12 0.22 0.28 0.02 0.00 0.00 177.57 178.21 1tgs h SER 236 N 0.66 0.84 -0.62 0.57 0.02 -1.88 0.11 113.55 113.25 1tgs h SER 236 Ca 0.35 -0.19 0.04 0.00 -0.84 0.00 0.00 61.79 61.16 1tgs h SER 236 Cb 0.34 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 1tgs h SER 236 CO -0.25 0.80 0.36 -0.25 -1.14 0.00 0.00 176.83 176.36 1tgs h TRP 237 N 0.84 0.68 0.06 3.45 7.01 -1.74 -1.24 115.95 125.01 1tgs h TRP 237 Ca 0.20 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.22 1tgs h TRP 237 Cb 0.24 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 27.08 1tgs h TRP 237 CO 0.01 0.37 -0.03 0.82 -2.79 0.00 0.00 178.44 176.82 1tgs h ILE 238 N 0.70 1.11 -0.62 2.65 2.04 -0.66 0.85 117.51 123.58 1tgs h ILE 238 Ca 0.26 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 1tgs h ILE 238 Cb 0.07 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1tgs h ILE 238 CO -0.13 0.15 0.28 0.11 0.00 0.00 0.00 178.15 178.57 1tgs h LYS 239 N -0.36 0.91 -0.11 2.37 1.57 -0.85 -0.26 116.57 119.83 1tgs h LYS 239 Ca -0.01 -0.14 -0.12 0.00 -1.87 0.00 0.00 60.65 58.51 1tgs h LYS 239 Cb 0.32 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1tgs h LYS 239 CO 0.01 0.74 -0.46 0.37 -0.57 0.00 0.00 179.45 179.54 1tgs h GLN 240 N 0.86 0.27 -0.30 3.15 5.75 -1.21 -2.18 115.11 121.46 1tgs h GLN 240 Ca 0.21 -0.14 -0.15 0.00 -0.15 0.00 0.00 58.65 58.42 1tgs h GLN 240 Cb 0.14 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.70 1tgs h GLN 240 CO -0.02 0.68 -0.41 1.15 -2.65 0.00 0.00 178.83 177.58 1tgs h THR 241 N 0.22 1.29 -0.70 2.39 2.02 -0.25 -1.80 112.91 116.08 1tgs h THR 241 Ca 0.01 -1.59 -0.05 0.00 0.77 0.00 0.00 66.41 65.55 1tgs h THR 241 Cb 0.90 1.59 -0.03 0.00 -1.74 0.00 0.00 68.15 68.87 1tgs h THR 241 CO 0.07 0.52 0.26 0.40 0.37 0.00 0.00 175.52 177.14 1tgs h ILE 242 N 0.58 1.25 0.00 3.11 2.04 -1.08 -2.52 117.51 120.89 1tgs h ILE 242 Ca 0.03 -0.82 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 1tgs h ILE 242 Cb 1.01 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 37.54 1tgs h ILE 242 CO 0.10 0.32 -0.12 0.00 0.00 0.00 0.00 178.15 178.45 1tgs h ALA 243 N 1.12 0.98 -0.37 1.87 0.00 -1.10 -3.06 119.26 118.69 1tgs h ALA 243 Ca 0.23 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 1tgs h ALA 243 Cb 0.25 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1tgs h ALA 243 CO -0.01 0.15 0.03 -1.13 0.00 0.00 0.00 179.25 178.29 1tgs n SER 244 N -3.21 3.76 0.00 0.00 3.41 -0.70 -5.08 113.62 111.80 1tgs n SER 244 Ca 0.01 -3.23 0.00 0.00 -0.26 0.00 0.00 58.87 55.39 1tgs n SER 244 Cb 0.44 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 1tgs n SER 244 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47