#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g4n s GLN 2 N 0.00 3.26 0.45 5.31 2.00 -1.26 -2.20 119.66 127.21 2g4n s GLN 2 Ca 0.00 -0.33 -0.16 0.00 -2.00 0.00 0.00 55.36 52.87 2g4n s GLN 2 Cb 0.00 -4.13 -0.08 0.00 0.80 0.00 0.00 33.01 29.60 2g4n s GLN 2 CO 0.00 -1.79 0.90 -0.51 -0.50 0.00 0.00 175.29 173.38 2g4n s LEU 3 N 4.64 3.79 0.43 3.68 1.43 0.35 -5.02 118.68 127.99 2g4n s LEU 3 Ca 0.31 1.46 0.03 0.00 -1.03 0.00 0.00 54.13 54.90 2g4n s LEU 3 Cb -0.12 -4.35 0.00 0.00 0.03 0.00 0.00 46.19 41.76 2g4n s LEU 3 CO 0.17 -0.45 0.63 0.42 0.23 0.00 0.00 176.35 177.34 2g4n s THR 4 N -2.39 3.70 0.08 5.49 -4.23 -1.26 -4.84 115.64 112.19 2g4n s THR 4 Ca 0.57 -0.71 -0.33 0.00 -1.18 0.00 0.00 61.69 60.04 2g4n s THR 4 Cb -0.10 -3.33 -0.16 0.00 1.34 0.00 0.00 72.50 70.25 2g4n s THR 4 CO 0.26 -0.20 1.52 0.50 -0.54 0.00 0.00 174.62 176.16 2g4n h LYS 5 N 0.50 -0.89 0.00 3.99 3.64 -1.99 0.16 116.57 121.99 2g4n h LYS 5 Ca -0.45 0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 58.91 2g4n h LYS 5 Cb 1.26 0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 33.27 2g4n h LYS 5 CO 0.54 -0.59 -0.40 0.00 -2.27 0.00 0.00 179.45 176.73 2g4n h GLU 7 N 0.00 1.01 -0.66 0.00 4.81 -1.92 -0.72 114.58 117.09 2g4n h GLU 7 Ca -0.00 -0.11 0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2g4n h GLU 7 Cb 1.09 -0.20 -0.05 0.00 0.63 0.00 0.00 28.75 30.21 2g4n h GLU 7 CO 0.05 0.74 0.37 0.28 -0.73 0.00 0.00 179.01 179.73 2g4n h VAL 8 N 1.00 0.97 -0.34 0.32 2.07 -0.15 -1.61 116.25 118.51 2g4n h VAL 8 Ca 0.26 -0.24 0.07 0.00 0.82 0.00 0.00 66.70 67.61 2g4n h VAL 8 Cb 0.02 0.22 -0.06 0.00 -1.52 0.00 0.00 31.29 29.95 2g4n h VAL 8 CO -0.04 0.13 -0.08 0.15 0.02 0.00 0.00 177.57 177.74 2g4n h PHE 9 N 0.69 -0.17 -0.12 1.57 3.57 -0.57 -2.52 116.94 119.39 2g4n h PHE 9 Ca 0.30 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.81 2g4n h PHE 9 Cb 0.18 0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 2g4n h PHE 9 CO -0.08 -0.14 0.02 0.00 -2.23 0.00 0.00 178.31 175.88 2g4n h ARG 10 N 0.00 0.20 0.00 1.11 3.08 -1.08 -3.18 114.38 114.51 2g4n h ARG 10 Ca 0.16 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 60.09 2g4n h ARG 10 Cb 0.25 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 2g4n h ARG 10 CO -0.35 0.40 -0.31 0.93 -1.07 0.00 0.00 179.97 179.58 2g4n h GLU 11 N -0.04 0.00 -0.57 0.04 5.08 -1.21 -2.48 114.58 115.41 2g4n h GLU 11 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2g4n h GLU 11 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2g4n h GLU 11 CO 0.00 0.31 0.00 1.28 -1.00 0.00 0.00 179.01 179.60 2g4n n LEU 12 N -3.61 3.14 -0.34 1.33 4.77 -0.96 -4.62 117.00 116.72 2g4n n LEU 12 Ca -0.01 -1.57 0.18 0.00 -0.03 0.00 0.00 56.01 54.58 2g4n n LEU 12 Cb 0.44 -0.41 0.34 0.00 -2.33 0.00 0.00 43.42 41.47 2g4n n LEU 12 CO 0.35 0.69 0.83 1.17 -1.33 0.00 0.00 177.39 179.11 2g4n n LYS 13 N 0.98 -0.07 0.14 3.23 4.81 -0.93 0.36 118.16 126.67 2g4n n LYS 13 Ca 0.18 1.45 0.18 0.00 -0.87 0.00 0.00 58.31 59.25 2g4n n LYS 13 Cb 0.53 -2.36 0.77 0.00 0.02 0.00 0.00 35.03 34.00 2g4n n LYS 13 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2g4n h ASP 14 N 0.00 0.00 0.23 3.14 3.32 -1.86 -1.20 116.42 120.05 2g4n h ASP 14 Ca 0.64 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.69 2g4n h ASP 14 Cb 1.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.97 2g4n h ASP 14 CO -0.89 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 176.81 2g4n n LEU 15 N -3.93 0.00 -4.61 1.55 4.77 0.16 -4.80 117.00 110.14 2g4n n LEU 15 Ca 0.04 0.15 -0.43 0.00 -0.03 0.00 0.00 56.01 55.74 2g4n n LEU 15 Cb 0.43 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2g4n n LEU 15 CO 0.30 -0.03 1.49 -0.75 -1.33 0.00 0.00 177.39 177.06 2g4n s LYS 16 N -2.29 3.55 0.00 3.23 2.20 -0.45 -1.70 119.74 124.28 2g4n s LYS 16 Ca 0.30 1.61 0.00 0.00 -0.36 0.00 0.00 55.97 57.52 2g4n s LYS 16 Cb 0.17 -4.14 0.00 0.00 -1.51 0.00 0.00 37.83 32.35 2g4n s LYS 16 CO 0.33 -1.60 0.00 0.41 -0.36 0.00 0.00 175.35 174.13 2g4n n GLY 17 N 5.09 1.37 3.68 5.54 0.00 -1.11 -5.03 105.19 114.74 2g4n n GLY 17 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2g4n n GLY 17 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2g4n s TYR 18 N -2.57 2.75 -1.92 1.61 5.04 -0.69 -0.69 117.35 120.87 2g4n s TYR 18 Ca 0.00 0.74 0.00 0.00 -2.44 0.00 0.00 57.07 55.37 2g4n s TYR 18 Cb 0.00 -3.70 0.00 0.00 0.35 0.00 0.00 41.96 38.61 2g4n s TYR 18 CO 0.00 -2.63 0.00 0.41 -1.34 0.00 0.00 175.55 171.99 2g4n n GLY 19 N 3.71 1.57 2.34 8.97 0.00 -1.26 -2.55 105.19 117.97 2g4n n GLY 19 Ca 0.14 -0.13 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 2g4n n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g4n n GLY 20 N -0.74 0.36 3.41 -0.02 0.00 0.13 -5.01 105.19 103.33 2g4n n GLY 20 Ca -0.19 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.17 2g4n n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g4n s VAL 21 N -2.69 4.48 0.99 1.61 1.01 -1.06 -4.94 120.40 119.81 2g4n s VAL 21 Ca 0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.32 2g4n s VAL 21 Cb 0.00 -3.33 0.19 0.00 0.00 0.00 0.00 36.38 33.24 2g4n s VAL 21 CO 0.00 0.02 1.09 -0.94 0.00 0.00 0.00 175.10 175.27 2g4n s SER 22 N 1.58 2.43 0.08 3.32 1.04 -1.26 -2.74 113.70 118.15 2g4n s SER 22 Ca 0.04 1.79 -0.19 0.00 0.48 0.00 0.00 55.95 58.07 2g4n s SER 22 Cb -0.17 -2.39 -0.09 0.00 0.10 0.00 0.00 66.02 63.47 2g4n s SER 22 CO 0.06 -3.34 1.53 -0.07 0.98 0.00 0.00 173.24 172.39 2g4n h LEU 23 N -2.03 0.38 -1.28 2.42 4.07 -1.96 -2.25 115.31 114.66 2g4n h LEU 23 Ca -0.51 -0.29 0.21 0.00 0.08 0.00 0.00 57.88 57.37 2g4n h LEU 23 Cb 1.29 -0.10 -0.09 0.00 1.08 0.00 0.00 40.66 42.84 2g4n h LEU 23 CO 0.48 0.58 0.62 -0.65 -1.08 0.00 0.00 178.44 178.39 2g4n h PRO 24 N 0.18 0.53 -0.63 1.13 0.11 -1.95 0.14 132.00 131.51 2g4n h PRO 24 Ca 0.07 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.05 2g4n h PRO 24 Cb 0.37 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 2g4n h PRO 24 CO 0.01 0.35 0.02 0.93 -0.21 0.00 0.00 178.00 179.10 2g4n h GLU 25 N 0.55 1.09 0.00 1.05 5.08 -1.82 -2.27 114.58 118.26 2g4n h GLU 25 Ca 0.54 -0.34 -0.15 0.00 -1.00 0.00 0.00 59.36 58.41 2g4n h GLU 25 Cb 1.13 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 2g4n h GLU 25 CO -0.28 1.05 -0.71 -1.49 -1.00 0.00 0.00 179.01 176.58 2g4n h TRP 26 N 1.00 0.00 -0.22 4.33 -0.00 -0.93 0.18 115.95 120.31 2g4n h TRP 26 Ca 0.18 0.00 -0.11 0.00 -0.00 0.00 0.00 58.89 58.96 2g4n h TRP 26 Cb 0.54 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.70 2g4n h TRP 26 CO 0.04 0.71 -0.29 0.28 -0.00 0.00 0.00 178.44 179.18 2g4n h VAL 27 N 0.00 1.32 0.39 1.49 2.07 -0.63 -0.66 116.25 120.23 2g4n h VAL 27 Ca -0.01 -1.49 -0.02 0.00 0.82 0.00 0.00 66.70 66.00 2g4n h VAL 27 Cb 1.34 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 2g4n h VAL 27 CO 0.09 0.46 -0.19 0.00 0.02 0.00 0.00 177.57 177.96 2g4n h THR 29 N -0.56 1.10 -0.00 0.00 2.02 -0.64 -1.54 112.91 113.29 2g4n h THR 29 Ca -0.05 -0.23 -0.08 0.00 0.77 0.00 0.00 66.41 66.81 2g4n h THR 29 Cb 0.42 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 2g4n h THR 29 CO 0.09 0.10 -0.39 0.71 0.37 0.00 0.00 175.52 176.40 2g4n h THR 30 N 0.37 1.28 0.54 3.16 1.35 -1.19 -1.39 112.91 117.04 2g4n h THR 30 Ca 0.10 -1.34 -0.03 0.00 -0.55 0.00 0.00 66.41 64.60 2g4n h THR 30 Cb 0.01 1.72 0.01 0.00 -1.73 0.00 0.00 68.15 68.15 2g4n h THR 30 CO -0.02 0.38 -0.26 0.15 -0.25 0.00 0.00 175.52 175.52 2g4n h PHE 31 N 0.00 -0.68 0.00 4.73 3.57 -0.88 -0.01 116.94 123.68 2g4n h PHE 31 Ca -0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2g4n h PHE 31 Cb 0.69 0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.66 2g4n h PHE 31 CO 0.00 -0.38 0.00 0.72 -2.23 0.00 0.00 178.31 176.42 2g4n n HIS 32 N -5.36 0.00 -0.12 0.41 8.25 -0.71 -0.99 115.22 116.70 2g4n n HIS 32 Ca -0.12 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.10 2g4n n HIS 32 Cb 0.32 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.34 2g4n n HIS 32 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2g4n n THR 33 N -0.98 1.33 -0.02 1.59 -1.04 -0.53 -4.84 114.28 109.80 2g4n n THR 33 Ca 0.18 -0.37 0.00 0.00 -2.04 0.00 0.00 64.05 61.82 2g4n n THR 33 Cb 0.08 -1.74 0.00 0.00 -1.82 0.00 0.00 70.33 66.85 2g4n n THR 33 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2g4n n SER 34 N -3.93 0.46 -1.16 8.00 3.41 -0.04 -4.92 113.62 115.44 2g4n n SER 34 Ca -0.47 -0.73 -0.14 0.00 -0.26 0.00 0.00 58.87 57.28 2g4n n SER 34 Cb 0.85 0.51 -0.05 0.00 -0.26 0.00 0.00 64.21 65.26 2g4n n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2g4n n GLY 35 N 0.51 1.08 2.48 5.00 0.00 -0.16 -2.71 105.19 111.39 2g4n n GLY 35 Ca 0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 2g4n n GLY 35 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2g4n n TYR 36 N -2.91 0.00 -3.57 1.61 0.53 -1.23 -4.82 117.16 106.77 2g4n n TYR 36 Ca -0.14 0.00 -0.39 0.00 -1.02 0.00 0.00 57.90 56.34 2g4n n TYR 36 Cb 0.49 -2.06 -0.11 0.00 -1.03 0.00 0.00 39.34 36.63 2g4n n TYR 36 CO 0.00 0.00 0.00 0.34 -1.02 0.00 0.00 176.86 176.18 2g4n s ASP 37 N -2.57 5.97 0.32 7.72 -1.08 -1.10 -0.50 116.67 125.42 2g4n s ASP 37 Ca 0.00 -0.33 0.26 0.00 -0.52 0.00 0.00 52.55 51.96 2g4n s ASP 37 Cb 0.00 -2.11 0.91 0.00 -1.46 0.00 0.00 42.92 40.26 2g4n s ASP 37 CO 0.00 -0.18 1.77 0.71 0.52 0.00 0.00 175.17 177.99 2g4n h THR 38 N 5.48 0.00 -0.57 1.71 1.35 -1.76 -2.99 112.91 116.14 2g4n h THR 38 Ca -0.32 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.07 2g4n h THR 38 Cb 1.16 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 2g4n h THR 38 CO 0.61 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.88 2g4n n GLN 39 N -2.51 3.52 -2.25 4.72 6.02 -1.26 -3.98 117.38 121.64 2g4n n GLN 39 Ca 0.03 -2.78 -0.41 0.00 -0.01 0.00 0.00 57.00 53.84 2g4n n GLN 39 Cb 0.35 -1.80 -0.03 0.00 1.02 0.00 0.00 30.24 29.78 2g4n n GLN 39 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2g4n s ALA 40 N -1.83 3.49 -0.06 -1.58 0.00 -1.13 -4.82 121.76 115.84 2g4n s ALA 40 Ca 0.47 1.10 -0.00 0.00 0.00 0.00 0.00 51.96 53.52 2g4n s ALA 40 Cb 0.30 -3.45 0.03 0.00 0.00 0.00 0.00 23.12 20.00 2g4n s ALA 40 CO 0.22 -0.49 -0.02 0.42 0.00 0.00 0.00 175.76 175.89 2g4n s ILE 41 N -0.38 0.44 -0.14 0.00 1.01 -1.26 -0.62 121.20 120.25 2g4n s ILE 41 Ca 0.53 0.02 0.02 0.00 0.00 0.00 0.00 60.65 61.22 2g4n s ILE 41 Cb -0.36 -0.54 0.01 0.00 0.01 0.00 0.00 42.46 41.58 2g4n s ILE 41 CO 0.42 0.24 -0.21 -0.69 0.00 0.00 0.00 174.94 174.70 2g4n s VAL 42 N 1.53 2.02 0.05 2.92 1.01 -0.83 -5.00 120.40 122.10 2g4n s VAL 42 Ca -0.02 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.03 2g4n s VAL 42 Cb -0.13 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 2g4n s VAL 42 CO -0.03 0.54 -0.08 0.00 0.00 0.00 0.00 175.10 175.53 2g4n s GLN 43 N 0.88 0.58 0.00 2.72 -2.07 -1.26 -0.47 119.66 120.05 2g4n s GLN 43 Ca -0.06 -0.86 0.00 0.00 -1.82 0.00 0.00 55.36 52.63 2g4n s GLN 43 Cb -0.15 -0.28 0.00 0.00 -1.09 0.00 0.00 33.01 31.49 2g4n s GLN 43 CO -0.03 0.04 0.00 0.27 -1.32 0.00 0.00 175.29 174.25 2g4n n ASN 44 N 1.20 1.07 0.12 12.60 6.94 -0.46 -5.02 115.26 131.71 2g4n n ASN 44 Ca -0.21 0.00 0.13 0.00 -0.02 0.00 0.00 54.58 54.48 2g4n n ASN 44 Cb 0.56 0.00 0.43 0.00 -2.36 0.00 0.00 39.78 38.41 2g4n n ASN 44 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2g4n n ASN 45 N 0.00 0.80 -0.00 0.53 4.13 -1.26 -3.62 115.26 115.84 2g4n n ASN 45 Ca 0.00 0.61 0.00 0.00 1.68 0.00 0.00 54.58 56.88 2g4n n ASN 45 Cb 0.00 -0.81 -0.01 0.00 -1.54 0.00 0.00 39.78 37.42 2g4n n ASN 45 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2g4n n ASP 46 N -2.29 4.80 -3.88 6.41 5.68 -1.26 -5.08 116.55 120.93 2g4n n ASP 46 Ca 0.04 0.00 -0.11 0.00 -0.50 0.00 0.00 54.79 54.22 2g4n n ASP 46 Cb 0.37 1.01 -0.11 0.00 -1.14 0.00 0.00 41.12 41.24 2g4n n ASP 46 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2g4n s SER 47 N -2.16 0.01 0.02 -1.12 1.04 -1.24 -4.91 113.70 105.35 2g4n s SER 47 Ca -0.00 -0.08 0.03 0.00 0.48 0.00 0.00 55.95 56.38 2g4n s SER 47 Cb 0.01 0.19 -0.02 0.00 0.10 0.00 0.00 66.02 66.30 2g4n s SER 47 CO 0.04 -0.21 -0.10 0.42 0.98 0.00 0.00 173.24 174.36 2g4n s THR 48 N -0.76 0.81 0.03 2.02 -4.23 -1.26 -1.35 115.64 110.90 2g4n s THR 48 Ca -0.08 -0.74 0.07 0.00 -1.18 0.00 0.00 61.69 59.75 2g4n s THR 48 Cb -0.05 -0.74 -0.02 0.00 1.34 0.00 0.00 72.50 73.02 2g4n s THR 48 CO 0.00 0.01 -0.21 -1.61 -0.54 0.00 0.00 174.62 172.27 2g4n s GLU 49 N -0.82 1.50 -0.08 3.99 2.02 0.38 -1.47 118.70 124.22 2g4n s GLU 49 Ca 0.00 -0.91 0.01 0.00 0.02 0.00 0.00 54.97 54.09 2g4n s GLU 49 Cb -0.06 -1.58 0.02 0.00 0.10 0.00 0.00 34.13 32.61 2g4n s GLU 49 CO 0.00 0.41 -0.08 0.71 0.02 0.00 0.00 175.26 176.32 2g4n s TYR 50 N -0.72 1.30 0.00 1.61 2.02 -0.40 -1.96 117.35 119.20 2g4n s TYR 50 Ca 0.08 -0.53 0.00 0.00 -0.37 0.00 0.00 57.07 56.25 2g4n s TYR 50 Cb -0.09 -1.04 0.00 0.00 -0.40 0.00 0.00 41.96 40.43 2g4n s TYR 50 CO 0.01 -0.35 0.00 0.41 -1.57 0.00 0.00 175.55 174.05 2g4n n GLY 51 N 4.36 -1.77 0.27 0.71 0.00 0.21 -1.49 105.19 107.48 2g4n n GLY 51 Ca -0.18 -1.63 -0.06 0.00 0.00 0.00 0.00 46.02 44.15 2g4n n GLY 51 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2g4n h LEU 52 N 0.00 0.79 -0.83 0.99 5.85 -1.73 -2.57 115.31 117.81 2g4n h LEU 52 Ca 0.00 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.65 2g4n h LEU 52 Cb 0.00 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.83 2g4n h LEU 52 CO 0.00 0.64 -0.04 0.49 -0.34 0.00 0.00 178.44 179.19 2g4n n PHE 53 N -4.56 0.00 -3.84 1.25 3.72 -1.26 -4.07 117.46 108.71 2g4n n PHE 53 Ca 0.05 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.10 2g4n n PHE 53 Cb 0.07 -0.02 0.03 0.00 -0.94 0.00 0.00 39.48 38.61 2g4n n PHE 53 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2g4n n GLN 54 N -0.03 -1.15 -2.62 -1.08 1.13 -0.77 -4.90 117.38 107.96 2g4n n GLN 54 Ca 0.18 0.33 -0.42 0.00 -1.94 0.00 0.00 57.00 55.15 2g4n n GLN 54 Cb 0.34 -3.70 -0.03 0.00 0.11 0.00 0.00 30.24 26.96 2g4n n GLN 54 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2g4n s ILE 55 N -3.56 4.62 0.27 5.09 1.01 -0.55 -4.33 121.20 123.75 2g4n s ILE 55 Ca 0.42 1.89 -0.00 0.00 0.00 0.00 0.00 60.65 62.96 2g4n s ILE 55 Cb -0.18 -4.21 -0.04 0.00 0.01 0.00 0.00 42.46 38.04 2g4n s ILE 55 CO 0.90 0.06 0.47 0.54 0.00 0.00 0.00 174.94 176.91 2g4n s ASN 56 N 1.14 6.35 0.00 3.58 2.20 -1.26 -1.27 114.94 125.68 2g4n s ASN 56 Ca 0.52 0.43 0.25 0.00 -0.94 0.00 0.00 52.86 53.12 2g4n s ASN 56 Cb -0.22 -2.02 0.65 0.00 -2.00 0.00 0.00 41.25 37.66 2g4n s ASN 56 CO 0.23 -0.16 1.51 -0.46 -2.94 0.00 0.00 177.10 175.29 2g4n n ASN 57 N -1.18 2.26 -0.03 3.54 6.94 -0.54 -2.32 115.26 123.92 2g4n n ASN 57 Ca -0.05 -1.76 -0.15 0.00 -0.02 0.00 0.00 54.58 52.60 2g4n n ASN 57 Cb 0.55 -0.06 -0.09 0.00 -2.36 0.00 0.00 39.78 37.82 2g4n n ASN 57 CO 0.00 0.00 0.00 0.11 -1.03 0.00 0.00 177.26 176.34 2g4n h LYS 58 N 3.33 0.32 0.00 -3.83 1.57 -1.83 -3.42 116.57 112.71 2g4n h LYS 58 Ca 0.00 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 2g4n h LYS 58 Cb 0.71 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.07 2g4n h LYS 58 CO 0.00 0.88 -0.09 0.44 -0.57 0.00 0.00 179.45 180.11 2g4n n ILE 59 N -4.46 0.00 -0.06 1.86 -5.35 -1.26 -4.01 119.36 106.08 2g4n n ILE 59 Ca -0.08 -0.11 -0.18 0.00 -0.27 0.00 0.00 62.75 62.11 2g4n n ILE 59 Cb 0.48 0.76 -0.13 0.00 -1.74 0.00 0.00 39.64 39.00 2g4n n ILE 59 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 2g4n n TRP 60 N -0.35 0.58 -3.97 4.28 7.02 -0.98 -1.06 117.44 122.96 2g4n n TRP 60 Ca 0.00 0.13 -0.10 0.00 -1.02 0.00 0.00 57.50 56.52 2g4n n TRP 60 Cb 0.00 -1.08 -0.07 0.00 -2.42 0.00 0.00 31.31 27.74 2g4n n TRP 60 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2g4n s LYS 62 N -3.99 3.40 0.34 0.00 2.20 -0.40 -4.39 119.74 116.90 2g4n s LYS 62 Ca 0.19 -0.32 0.01 0.00 -0.36 0.00 0.00 55.97 55.49 2g4n s LYS 62 Cb 0.02 -3.01 -0.01 0.00 -1.51 0.00 0.00 37.83 33.32 2g4n s LYS 62 CO 0.03 0.59 0.40 0.16 -0.36 0.00 0.00 175.35 176.17 2g4n s ASP 63 N -0.53 1.15 0.25 1.43 1.47 -1.25 -0.25 116.67 118.93 2g4n s ASP 63 Ca 0.10 -1.57 -0.06 0.00 1.18 0.00 0.00 52.55 52.20 2g4n s ASP 63 Cb -0.12 0.62 0.27 0.00 -0.34 0.00 0.00 42.92 43.35 2g4n s ASP 63 CO 0.02 -1.21 1.91 0.44 0.68 0.00 0.00 175.17 177.01 2g4n h ASP 64 N 2.13 1.08 -0.90 2.11 3.32 -1.98 -2.32 116.42 119.86 2g4n h ASP 64 Ca -0.27 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 2g4n h ASP 64 Cb 1.24 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 40.48 2g4n h ASP 64 CO 0.38 0.77 0.56 -0.61 -1.72 0.00 0.00 179.24 178.63 2g4n h GLN 65 N 1.27 1.21 -2.23 3.56 4.15 -1.98 -3.35 115.11 117.75 2g4n h GLN 65 Ca 0.36 -0.10 -0.58 0.00 0.77 0.00 0.00 58.65 59.11 2g4n h GLN 65 Cb -0.09 -0.26 -0.38 0.00 0.21 0.00 0.00 27.48 26.95 2g4n h GLN 65 CO -0.09 0.83 -1.02 -1.71 -1.93 0.00 0.00 178.83 174.91 2g4n n ASN 66 N -4.37 -0.28 0.27 -0.69 4.05 -1.12 -4.96 115.26 108.17 2g4n n ASN 66 Ca 0.10 -2.48 0.17 0.00 0.45 0.00 0.00 54.58 52.82 2g4n n ASN 66 Cb 0.05 -0.57 0.70 0.00 1.23 0.00 0.00 39.78 41.19 2g4n n ASN 66 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2g4n h PRO 67 N 5.06 0.00 -0.78 1.20 0.13 -1.56 -1.89 132.00 134.16 2g4n h PRO 67 Ca 0.20 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.22 2g4n h PRO 67 Cb 0.90 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.96 2g4n h PRO 67 CO 0.40 0.00 0.14 0.72 -0.23 0.00 0.00 178.00 179.03 2g4n n HIS 68 N -3.04 1.74 -1.57 1.56 8.25 -1.26 -4.89 115.22 116.00 2g4n n HIS 68 Ca 0.00 -0.81 -0.45 0.00 -0.26 0.00 0.00 57.72 56.21 2g4n n HIS 68 Cb 0.29 -0.51 -0.02 0.00 1.12 0.00 0.00 29.99 30.88 2g4n n HIS 68 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2g4n n SER 69 N 0.12 1.05 -0.43 0.41 2.88 -0.71 -4.87 113.62 112.07 2g4n n SER 69 Ca 0.27 1.17 0.37 0.00 -1.33 0.00 0.00 58.87 59.35 2g4n n SER 69 Cb 1.07 -1.26 0.70 0.00 -0.75 0.00 0.00 64.21 63.97 2g4n n SER 69 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2g4n h SER 70 N 1.87 0.13 -5.96 -3.46 4.64 -1.80 -3.47 113.55 105.51 2g4n h SER 70 Ca -0.39 0.05 -0.38 0.00 -0.47 0.00 0.00 61.79 60.60 2g4n h SER 70 Cb 1.35 0.03 0.11 0.00 -0.31 0.00 0.00 62.40 63.58 2g4n h SER 70 CO 0.60 -0.02 -0.89 -3.20 -0.87 0.00 0.00 176.83 172.45 2g4n n ASN 71 N -4.32 -4.67 0.14 4.97 5.15 -0.84 -4.88 115.26 110.81 2g4n n ASN 71 Ca 0.32 -0.88 -0.01 0.00 -0.60 0.00 0.00 54.58 53.41 2g4n n ASN 71 Cb 1.38 -4.09 0.23 0.00 -0.53 0.00 0.00 39.78 36.78 2g4n n ASN 71 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 2g4n h ILE 72 N -1.65 1.35 0.00 -1.44 2.04 -0.99 -1.63 117.51 115.20 2g4n h ILE 72 Ca -0.64 -1.71 0.00 0.00 1.00 0.00 0.00 64.86 63.52 2g4n h ILE 72 Cb 1.35 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 39.31 2g4n h ILE 72 CO 0.49 0.49 0.00 0.00 0.00 0.00 0.00 178.15 179.13 2g4n n ASN 74 N -1.40 -4.02 -3.58 0.00 4.05 -0.61 -4.96 115.26 104.73 2g4n n ASN 74 Ca 0.09 -0.67 -0.16 0.00 0.45 0.00 0.00 54.58 54.29 2g4n n ASN 74 Cb 0.24 -5.13 -0.06 0.00 1.23 0.00 0.00 39.78 36.06 2g4n n ASN 74 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 177.26 173.70 2g4n s ILE 75 N -3.38 0.00 0.23 -1.44 2.07 -1.26 -5.10 121.20 112.32 2g4n s ILE 75 Ca 0.20 0.00 -0.30 0.00 -1.41 0.00 0.00 60.65 59.14 2g4n s ILE 75 Cb -0.03 -1.00 -0.09 0.00 0.13 0.00 0.00 42.46 41.47 2g4n s ILE 75 CO 0.74 0.00 1.19 -0.55 -1.91 0.00 0.00 174.94 174.40 2g4n s SER 76 N -0.39 7.09 0.38 4.50 0.15 -1.26 -1.28 113.70 122.89 2g4n s SER 76 Ca -0.05 2.31 0.08 0.00 0.70 0.00 0.00 55.95 58.99 2g4n s SER 76 Cb -0.03 -2.62 0.74 0.00 -1.71 0.00 0.00 66.02 62.41 2g4n s SER 76 CO 0.05 -0.33 1.92 0.00 1.20 0.00 0.00 173.24 176.08 2g4n h ASP 78 N 0.32 0.00 0.20 0.00 3.32 -1.93 0.99 116.42 119.33 2g4n h ASP 78 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2g4n h ASP 78 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2g4n h ASP 78 CO 0.01 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.82 2g4n n LYS 79 N -3.67 0.11 -0.63 3.56 4.76 -0.51 -2.31 118.16 119.48 2g4n n LYS 79 Ca 0.01 0.23 0.10 0.00 -2.87 0.00 0.00 58.31 55.77 2g4n n LYS 79 Cb 0.30 -1.50 0.37 0.00 -1.84 0.00 0.00 35.03 32.35 2g4n n LYS 79 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2g4n n PHE 80 N -1.33 1.52 0.20 2.13 0.99 0.34 -4.24 117.46 117.09 2g4n n PHE 80 Ca 0.04 -0.61 0.02 0.00 -0.00 0.00 0.00 57.45 56.90 2g4n n PHE 80 Cb 0.08 -0.25 -0.02 0.00 -1.00 0.00 0.00 39.48 38.29 2g4n n PHE 80 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 2g4n n LEU 81 N 1.17 0.25 0.00 4.37 4.77 -0.98 -3.81 117.00 122.79 2g4n n LEU 81 Ca 0.26 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 2g4n n LEU 81 Cb 0.91 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.00 2g4n n LEU 81 CO 0.25 0.06 0.00 -0.90 -1.33 0.00 0.00 177.39 175.47 2g4n n ASP 82 N -1.04 0.00 -0.11 -1.43 5.68 -1.26 -4.22 116.55 114.17 2g4n n ASP 82 Ca 0.01 -0.63 0.09 0.00 -0.50 0.00 0.00 54.79 53.76 2g4n n ASP 82 Cb 0.07 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 39.96 2g4n n ASP 82 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2g4n n ASP 83 N -1.90 1.14 -4.55 -1.12 8.00 -1.26 -4.82 116.55 112.05 2g4n n ASP 83 Ca 0.00 -1.07 -0.42 0.00 0.71 0.00 0.00 54.79 54.01 2g4n n ASP 83 Cb 0.00 0.88 -0.08 0.00 -0.02 0.00 0.00 41.12 41.90 2g4n n ASP 83 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2g4n s ASP 84 N -2.69 6.31 0.00 -2.24 -1.08 -1.26 -4.89 116.67 110.81 2g4n s ASP 84 Ca 0.10 -0.10 0.21 0.00 -0.52 0.00 0.00 52.55 52.24 2g4n s ASP 84 Cb 0.15 -2.27 0.73 0.00 -1.46 0.00 0.00 42.92 40.07 2g4n s ASP 84 CO 0.73 -0.51 1.54 0.18 0.52 0.00 0.00 175.17 177.63 2g4n n LEU 85 N 5.77 1.77 -0.08 -1.34 4.77 -1.26 -4.28 117.00 122.35 2g4n n LEU 85 Ca -0.05 -0.74 -0.07 0.00 -0.03 0.00 0.00 56.01 55.13 2g4n n LEU 85 Cb 0.49 -0.11 -0.00 0.00 -2.33 0.00 0.00 43.42 41.46 2g4n n LEU 85 CO 0.46 0.37 0.73 0.74 -1.33 0.00 0.00 177.39 178.36 2g4n h THR 86 N 2.35 0.47 0.01 -5.08 2.02 -1.94 -0.92 112.91 109.83 2g4n h THR 86 Ca 0.00 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.98 2g4n h THR 86 Cb 0.52 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 2g4n h THR 86 CO 0.00 0.00 -0.91 -2.24 0.37 0.00 0.00 175.52 172.74 2g4n h ASP 87 N -0.15 0.14 -0.28 4.18 3.04 -1.93 -2.34 116.42 119.09 2g4n h ASP 87 Ca 0.16 -0.13 0.07 0.00 -3.24 0.00 0.00 57.03 53.89 2g4n h ASP 87 Cb 0.40 -0.05 -0.07 0.00 -1.04 0.00 0.00 39.33 38.57 2g4n h ASP 87 CO -0.40 0.98 -0.21 0.44 -2.04 0.00 0.00 179.24 178.01 2g4n h ASP 88 N 0.05 -0.69 -0.41 4.15 5.19 -1.67 -2.19 116.42 120.86 2g4n h ASP 88 Ca -0.03 0.14 -0.09 0.00 -0.62 0.00 0.00 57.03 56.42 2g4n h ASP 88 Cb 1.58 0.34 -0.02 0.00 0.18 0.00 0.00 39.33 41.41 2g4n h ASP 88 CO 0.13 -0.25 -0.06 0.40 -3.12 0.00 0.00 179.24 176.34 2g4n h ILE 89 N -0.19 1.26 -0.44 0.35 2.04 -1.06 -1.15 117.51 118.32 2g4n h ILE 89 Ca 0.15 -1.13 0.02 0.00 1.00 0.00 0.00 64.86 64.90 2g4n h ILE 89 Cb 0.42 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 2g4n h ILE 89 CO -0.39 0.39 0.26 0.24 0.00 0.00 0.00 178.15 178.65 2g4n h MET 90 N 0.77 0.51 -0.66 2.37 2.86 -1.27 -1.45 114.93 118.07 2g4n h MET 90 Ca 0.14 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.69 2g4n h MET 90 Cb 0.55 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 2g4n h MET 90 CO 0.03 0.34 0.21 0.00 1.06 0.00 0.00 176.91 178.55 2g4n h VAL 92 N 0.96 0.73 0.06 0.00 2.07 -1.04 0.12 116.25 119.15 2g4n h VAL 92 Ca 0.21 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 2g4n h VAL 92 Cb 0.29 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 2g4n h VAL 92 CO -0.01 0.13 -0.03 0.11 0.02 0.00 0.00 177.57 177.79 2g4n h LYS 93 N 0.69 -0.08 -0.77 1.57 1.57 -1.08 0.32 116.57 118.79 2g4n h LYS 93 Ca 0.51 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.33 2g4n h LYS 93 Cb 0.73 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 33.01 2g4n h LYS 93 CO -0.37 0.02 0.48 0.87 -0.57 0.00 0.00 179.45 179.89 2g4n h LYS 94 N -0.16 0.89 -0.02 3.15 1.57 -1.29 0.66 116.57 121.37 2g4n h LYS 94 Ca -0.01 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2g4n h LYS 94 Cb 0.13 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2g4n h LYS 94 CO 0.01 0.59 -0.02 0.82 -0.57 0.00 0.00 179.45 180.28 2g4n h ILE 95 N 0.92 0.93 -0.83 1.86 2.04 -0.25 -2.38 117.51 119.79 2g4n h ILE 95 Ca 0.32 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.26 2g4n h ILE 95 Cb 0.08 0.93 -0.06 0.00 -0.74 0.00 0.00 36.82 37.03 2g4n h ILE 95 CO -0.14 0.00 0.54 -0.07 0.00 0.00 0.00 178.15 178.49 2g4n h LEU 96 N -0.03 0.77 -1.16 1.44 3.38 -0.08 -1.44 115.31 118.20 2g4n h LEU 96 Ca 0.02 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 2g4n h LEU 96 Cb 0.06 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2g4n h LEU 96 CO -0.04 0.48 -0.41 0.44 0.09 0.00 0.00 178.44 179.00 2g4n h ASP 97 N 0.87 0.03 0.00 -0.43 3.32 -0.53 -2.78 116.42 116.90 2g4n h ASP 97 Ca 0.37 -0.01 -0.43 0.00 0.02 0.00 0.00 57.03 56.98 2g4n h ASP 97 Cb 0.31 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.78 2g4n h ASP 97 CO -0.14 0.43 -2.43 0.29 -1.72 0.00 0.00 179.24 175.67 2g4n n LYS 98 N -4.05 0.61 0.00 3.56 5.02 -0.81 -4.74 118.16 117.74 2g4n n LYS 98 Ca -0.02 0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.53 2g4n n LYS 98 Cb 0.44 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.93 2g4n n LYS 98 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2g4n n VAL 99 N -4.00 0.00 -1.82 -0.18 0.24 -0.64 -5.12 118.33 106.80 2g4n n VAL 99 Ca -0.51 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 61.51 2g4n n VAL 99 Cb 0.90 0.81 0.00 0.00 -1.47 0.00 0.00 33.84 34.09 2g4n n VAL 99 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2g4n n GLY 100 N 1.25 -2.32 0.27 7.63 0.00 -0.64 -4.49 105.19 106.89 2g4n n GLY 100 Ca 0.00 -1.60 0.13 0.00 0.00 0.00 0.00 46.02 44.54 2g4n n GLY 100 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2g4n h ILE 101 N 0.00 0.60 0.00 -0.61 6.09 -1.88 -2.89 117.51 118.82 2g4n h ILE 101 Ca 0.00 -0.46 0.00 0.00 -1.37 0.00 0.00 64.86 63.03 2g4n h ILE 101 Cb 0.00 1.29 0.00 0.00 0.47 0.00 0.00 36.82 38.58 2g4n h ILE 101 CO 0.00 0.10 0.00 0.59 -3.07 0.00 0.00 178.15 175.77 2g4n n ASN 102 N -3.72 0.00 -0.30 2.19 3.02 -1.26 -0.73 115.26 114.46 2g4n n ASN 102 Ca -0.02 -1.41 0.04 0.00 -0.03 0.00 0.00 54.58 53.16 2g4n n ASN 102 Cb 0.21 0.00 0.18 0.00 -0.61 0.00 0.00 39.78 39.56 2g4n n ASN 102 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 2g4n h TYR 103 N 0.00 0.89 -2.54 3.10 3.20 -1.75 -3.35 116.97 116.51 2g4n h TYR 103 Ca 0.00 0.03 -0.64 0.00 3.14 0.00 0.00 58.73 61.26 2g4n h TYR 103 Cb 0.00 -0.27 -0.15 0.00 1.54 0.00 0.00 36.73 37.85 2g4n h TYR 103 CO 0.00 0.35 0.64 -1.58 -1.64 0.00 0.00 178.16 175.94 2g4n s TRP 104 N -6.02 2.77 0.57 -3.82 0.51 0.09 -4.93 118.94 108.12 2g4n s TRP 104 Ca -0.12 -0.76 0.26 0.00 -2.12 0.00 0.00 56.10 53.36 2g4n s TRP 104 Cb 0.20 -4.30 1.63 0.00 -0.81 0.00 0.00 33.47 30.18 2g4n s TRP 104 CO 0.78 -1.62 2.16 -0.07 -0.51 0.00 0.00 176.95 177.70 2g4n h LEU 105 N 11.18 0.00 -1.86 2.99 4.07 -1.82 -1.37 115.31 128.50 2g4n h LEU 105 Ca -0.17 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.78 2g4n h LEU 105 Cb 1.06 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.79 2g4n h LEU 105 CO 1.17 0.00 -0.01 0.00 -1.08 0.00 0.00 178.44 178.52 2g4n h ALA 106 N 1.90 1.89 0.23 1.53 0.00 -1.91 -3.22 119.26 119.68 2g4n h ALA 106 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2g4n h ALA 106 Cb 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2g4n h ALA 106 CO -0.00 0.09 -0.25 1.25 0.00 0.00 0.00 179.25 180.34 2g4n h HIS 107 N 0.07 -0.65 -0.39 0.00 6.17 -1.56 0.20 115.15 119.00 2g4n h HIS 107 Ca 0.02 0.00 -0.03 0.00 0.71 0.00 0.00 60.37 61.07 2g4n h HIS 107 Cb 0.07 0.26 -0.02 0.00 2.52 0.00 0.00 27.41 30.24 2g4n h HIS 107 CO 0.00 -0.36 0.11 -0.22 0.71 0.00 0.00 177.93 178.17 2g4n h LYS 108 N -0.52 0.62 0.06 5.26 3.64 -1.75 -0.12 116.57 123.75 2g4n h LYS 108 Ca -0.00 -0.14 -0.23 0.00 -1.27 0.00 0.00 60.65 59.00 2g4n h LYS 108 Cb 0.48 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2g4n h LYS 108 CO -0.06 0.64 -1.07 0.00 -2.27 0.00 0.00 179.45 176.68 2g4n h ALA 109 N 0.96 0.29 0.00 5.00 0.00 -1.53 -3.38 119.26 120.58 2g4n h ALA 109 Ca 0.12 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2g4n h ALA 109 Cb 0.28 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2g4n h ALA 109 CO -0.00 1.04 -0.60 1.28 0.00 0.00 0.00 179.25 180.97 2g4n n LEU 110 N -3.51 0.00 -0.93 0.00 7.99 0.69 -4.82 117.00 116.41 2g4n n LEU 110 Ca -0.05 -0.18 0.05 0.00 -0.01 0.00 0.00 56.01 55.82 2g4n n LEU 110 Cb 0.94 0.00 0.10 0.00 -0.11 0.00 0.00 43.42 44.35 2g4n n LEU 110 CO 0.50 0.00 0.24 0.00 -1.51 0.00 0.00 177.39 176.62 2g4n n SER 112 N -0.33 0.89 -3.84 0.00 7.64 -1.09 -4.86 113.62 112.04 2g4n n SER 112 Ca 0.11 -1.09 -0.12 0.00 1.01 0.00 0.00 58.87 58.78 2g4n n SER 112 Cb 0.89 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.95 2g4n n SER 112 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2g4n s GLU 113 N -0.09 0.07 0.00 1.43 8.01 -1.26 -5.08 118.70 121.78 2g4n s GLU 113 Ca 0.00 0.11 0.00 0.00 0.01 0.00 0.00 54.97 55.09 2g4n s GLU 113 Cb 0.00 0.01 0.00 0.00 -4.31 0.00 0.00 34.13 29.83 2g4n s GLU 113 CO 0.00 -0.02 0.00 0.36 0.01 0.00 0.00 175.26 175.61 2g4n n LYS 114 N 3.15 0.00 0.00 1.61 -0.00 -1.26 -4.97 118.16 116.69 2g4n n LYS 114 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.17 2g4n n LYS 114 Cb 0.59 -0.18 0.00 0.00 -0.00 0.00 0.00 35.03 35.44 2g4n n LYS 114 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2g4n n LEU 115 N -0.11 0.08 0.00 -5.58 4.32 -1.26 -4.86 117.00 109.59 2g4n n LEU 115 Ca 0.00 -0.08 0.07 0.00 -0.02 0.00 0.00 56.01 55.98 2g4n n LEU 115 Cb 0.00 0.00 0.34 0.00 -1.62 0.00 0.00 43.42 42.14 2g4n n LEU 115 CO 0.00 0.02 0.70 -0.90 -1.22 0.00 0.00 177.39 175.99 2g4n n ASP 116 N -0.02 0.00 -0.53 -1.43 3.85 -1.26 -1.24 116.55 115.93 2g4n n ASP 116 Ca 0.00 0.19 0.14 0.00 -0.71 0.00 0.00 54.79 54.41 2g4n n ASP 116 Cb 0.41 -0.34 0.43 0.00 -1.35 0.00 0.00 41.12 40.27 2g4n n ASP 116 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2g4n n GLN 117 N -1.34 1.66 -0.52 0.11 10.64 -1.26 -4.16 117.38 122.51 2g4n n GLN 117 Ca 0.06 -1.06 0.04 0.00 -1.83 0.00 0.00 57.00 54.22 2g4n n GLN 117 Cb 0.13 -1.48 0.20 0.00 -0.86 0.00 0.00 30.24 28.22 2g4n n GLN 117 CO 0.00 0.00 0.00 0.91 -1.83 0.00 0.00 177.06 176.14 2g4n n TRP 118 N 0.25 0.41 -3.67 2.61 7.02 -0.37 -5.02 117.44 118.68 2g4n n TRP 118 Ca 0.17 -1.34 -0.37 0.00 -1.02 0.00 0.00 57.50 54.94 2g4n n TRP 118 Cb 0.39 -0.30 -0.06 0.00 -2.42 0.00 0.00 31.31 28.92 2g4n n TRP 118 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2g4n s LEU 119 N -3.11 4.40 -0.52 -0.99 1.43 -1.26 -4.37 118.68 114.26 2g4n s LEU 119 Ca 0.39 0.67 0.04 0.00 -1.03 0.00 0.00 54.13 54.20 2g4n s LEU 119 Cb 0.36 -2.33 0.40 0.00 0.03 0.00 0.00 46.19 44.65 2g4n s LEU 119 CO -0.01 0.32 1.22 0.00 0.23 0.00 0.00 176.35 178.11 2g4n n GLU 121 N -0.46 -0.64 -0.44 0.00 -0.58 -1.26 -5.12 120.64 112.13 2g4n n GLU 121 Ca 0.40 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.14 2g4n n GLU 121 Cb 0.57 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.44 2g4n n GLU 121 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28