#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g4s s ARG 2 N 0.00 0.35 -0.16 -0.52 3.52 -1.26 -2.30 118.95 118.58 3g4s s ARG 2 Ca 0.00 0.60 -0.01 0.00 -0.13 0.00 0.00 55.73 56.19 3g4s s ARG 2 Cb 0.00 0.05 0.04 0.00 -1.56 0.00 0.00 34.95 33.48 3g4s s ARG 2 CO 0.00 -0.11 -0.03 0.14 -0.81 0.00 0.00 175.30 174.48 3g4s s VAL 3 N 0.86 0.94 -0.34 7.11 -7.23 -1.05 -5.02 120.40 115.67 3g4s s VAL 3 Ca -0.06 -0.53 -0.17 0.00 -1.81 0.00 0.00 61.98 59.41 3g4s s VAL 3 Cb -0.06 -1.16 -0.01 0.00 0.56 0.00 0.00 36.38 35.71 3g4s s VAL 3 CO -0.06 0.09 0.45 -1.61 -0.31 0.00 0.00 175.10 173.66 3g4s s GLU 4 N 1.71 3.64 -0.26 4.82 2.02 -1.26 -2.79 118.70 126.58 3g4s s GLU 4 Ca 0.01 -0.22 -0.09 0.00 0.02 0.00 0.00 54.97 54.69 3g4s s GLU 4 Cb -0.15 -3.79 -0.04 0.00 0.10 0.00 0.00 34.13 30.24 3g4s s GLU 4 CO -0.07 -0.57 0.13 -0.51 0.02 0.00 0.00 175.26 174.25 3g4s s LEU 5 N 2.24 3.78 -0.17 1.80 1.43 0.16 -4.94 118.68 122.98 3g4s s LEU 5 Ca 0.16 -0.08 -0.29 0.00 -1.03 0.00 0.00 54.13 52.89 3g4s s LEU 5 Cb -0.16 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.03 3g4s s LEU 5 CO 0.12 -0.02 1.18 -1.61 0.23 0.00 0.00 176.35 176.25 3g4s s GLU 6 N 1.56 4.26 -0.14 1.70 2.02 -1.26 -1.01 118.70 125.82 3g4s s GLU 6 Ca 0.06 1.56 -0.21 0.00 0.02 0.00 0.00 54.97 56.40 3g4s s GLU 6 Cb -0.15 -3.70 -0.03 0.00 0.10 0.00 0.00 34.13 30.35 3g4s s GLU 6 CO 0.07 -0.64 0.62 0.96 0.02 0.00 0.00 175.26 176.29 3g4s s ILE 7 N 3.21 5.07 1.22 -1.63 -4.36 -1.20 -4.99 121.20 118.52 3g4s s ILE 7 Ca 0.51 1.22 -0.16 0.00 -0.26 0.00 0.00 60.65 61.96 3g4s s ILE 7 Cb -0.20 -3.95 0.27 0.00 1.25 0.00 0.00 42.46 39.83 3g4s s ILE 7 CO 0.13 0.20 0.72 -2.65 0.24 0.00 0.00 174.94 173.59 3g4s n PRO 8 N 4.33 -2.79 0.11 0.37 -0.02 -1.26 -4.93 135.00 130.81 3g4s n PRO 8 Ca -0.03 -0.80 -0.02 0.00 -2.02 0.00 0.00 63.50 60.63 3g4s n PRO 8 Cb 0.51 -1.98 0.20 0.00 -0.02 0.00 0.00 33.50 32.21 3g4s n PRO 8 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3g4s h GLU 9 N -2.76 0.19 0.00 -0.52 4.11 -2.01 -2.98 114.58 110.60 3g4s h GLU 9 Ca -0.56 -0.10 0.00 0.00 0.07 0.00 0.00 59.36 58.77 3g4s h GLU 9 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 3g4s h GLU 9 CO 0.42 0.63 0.00 0.22 0.07 0.00 0.00 179.01 180.35 3g4s h ASP 10 N 0.15 0.00 -2.83 3.06 -0.00 -1.98 -3.46 116.42 111.36 3g4s h ASP 10 Ca 0.01 0.00 -0.64 0.00 -0.00 0.00 0.00 57.03 56.40 3g4s h ASP 10 Cb 0.90 0.00 -0.05 0.00 -0.00 0.00 0.00 39.33 40.18 3g4s h ASP 10 CO 0.07 0.00 -0.44 -0.69 -0.00 0.00 0.00 179.24 178.18 3g4s s VAL 11 N -3.21 5.38 -0.08 2.25 1.01 -1.13 -4.34 120.40 120.29 3g4s s VAL 11 Ca 0.08 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.08 3g4s s VAL 11 Cb 0.07 -3.53 0.04 0.00 0.00 0.00 0.00 36.38 32.96 3g4s s VAL 11 CO 0.64 0.39 0.07 -1.81 0.00 0.00 0.00 175.10 174.39 3g4s s ASP 12 N -1.69 1.46 -0.16 3.32 1.01 -0.56 -4.70 116.67 115.35 3g4s s ASP 12 Ca 0.25 -0.10 0.00 0.00 0.71 0.00 0.00 52.55 53.42 3g4s s ASP 12 Cb -0.13 -0.16 0.00 0.00 1.01 0.00 0.00 42.92 43.64 3g4s s ASP 12 CO 0.15 -0.28 -0.16 0.00 0.21 0.00 0.00 175.17 175.10 3g4s s ALA 13 N 2.16 2.46 0.07 5.23 0.00 -1.26 -0.25 121.76 130.18 3g4s s ALA 13 Ca 0.04 -1.09 0.05 0.00 0.00 0.00 0.00 51.96 50.96 3g4s s ALA 13 Cb -0.13 -1.22 -0.04 0.00 0.00 0.00 0.00 23.12 21.73 3g4s s ALA 13 CO -0.05 -0.11 -0.04 -2.00 0.00 0.00 0.00 175.76 173.56 3g4s s GLU 14 N 0.94 2.44 -0.03 0.00 2.12 -0.30 -4.99 118.70 118.89 3g4s s GLU 14 Ca -0.03 -0.86 0.08 0.00 0.36 0.00 0.00 54.97 54.52 3g4s s GLU 14 Cb -0.15 -2.47 -0.02 0.00 0.26 0.00 0.00 34.13 31.75 3g4s s GLU 14 CO -0.02 0.55 -0.25 -1.14 -0.54 0.00 0.00 175.26 173.85 3g4s s GLN 15 N -2.07 2.18 -0.27 4.30 0.74 -1.26 -1.92 119.66 121.36 3g4s s GLN 15 Ca 0.23 -0.91 -0.01 0.00 0.05 0.00 0.00 55.36 54.71 3g4s s GLN 15 Cb -0.11 -2.08 0.13 0.00 1.10 0.00 0.00 33.01 32.05 3g4s s GLN 15 CO 0.14 0.55 0.30 0.34 -0.55 0.00 0.00 175.29 176.08 3g4s s ASP 16 N -0.58 1.28 1.43 6.67 -1.08 -1.05 -5.06 116.67 118.28 3g4s s ASP 16 Ca 0.09 -0.47 0.00 0.00 -0.52 0.00 0.00 52.55 51.65 3g4s s ASP 16 Cb -0.10 0.64 0.00 0.00 -1.46 0.00 0.00 42.92 41.99 3g4s s ASP 16 CO -0.01 -0.36 0.00 1.41 0.52 0.00 0.00 175.17 176.73 3g4s n HIS 17 N 5.32 0.00 0.35 -5.34 8.25 -1.26 -2.28 115.22 120.27 3g4s n HIS 17 Ca -0.03 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.48 3g4s n HIS 17 Cb 0.48 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.64 3g4s n HIS 17 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3g4s n LEU 18 N 0.00 1.89 -4.76 2.41 4.77 -1.26 -4.99 117.00 115.05 3g4s n LEU 18 Ca 0.00 -1.08 -0.39 0.00 -0.03 0.00 0.00 56.01 54.51 3g4s n LEU 18 Cb 0.00 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 3g4s n LEU 18 CO 0.00 0.38 0.25 -1.81 -1.33 0.00 0.00 177.39 174.88 3g4s s ASP 19 N -0.82 6.88 -0.15 -1.43 1.01 -0.96 -2.60 116.67 118.60 3g4s s ASP 19 Ca 0.12 1.05 0.01 0.00 0.71 0.00 0.00 52.55 54.44 3g4s s ASP 19 Cb 0.08 -2.33 0.00 0.00 1.01 0.00 0.00 42.92 41.68 3g4s s ASP 19 CO 0.12 0.09 -0.18 -0.63 0.21 0.00 0.00 175.17 174.78 3g4s s ILE 20 N -0.03 2.44 -0.20 0.77 1.01 0.42 -2.53 121.20 123.08 3g4s s ILE 20 Ca 0.29 -0.85 -0.01 0.00 0.00 0.00 0.00 60.65 60.08 3g4s s ILE 20 Cb -0.17 -2.01 0.01 0.00 0.01 0.00 0.00 42.46 40.29 3g4s s ILE 20 CO 0.15 0.53 -0.13 -0.89 0.00 0.00 0.00 174.94 174.60 3g4s s THR 21 N 0.84 2.68 -0.28 2.92 2.01 -0.81 0.13 115.64 123.14 3g4s s THR 21 Ca -0.05 -0.73 -0.06 0.00 0.31 0.00 0.00 61.69 61.16 3g4s s THR 21 Cb -0.15 -2.18 0.00 0.00 0.01 0.00 0.00 72.50 70.18 3g4s s THR 21 CO -0.01 0.49 0.06 -0.69 -0.69 0.00 0.00 174.62 173.77 3g4s s VAL 22 N 1.34 3.88 0.06 3.82 1.01 0.53 -1.14 120.40 129.89 3g4s s VAL 22 Ca 0.05 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.43 3g4s s VAL 22 Cb -0.14 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3g4s s VAL 22 CO -0.08 0.16 0.04 -1.61 0.00 0.00 0.00 175.10 173.61 3g4s s GLU 23 N 1.50 2.80 0.00 2.72 2.02 0.65 -1.04 118.70 127.35 3g4s s GLU 23 Ca 0.03 -0.69 -0.00 0.00 0.02 0.00 0.00 54.97 54.33 3g4s s GLU 23 Cb -0.17 -2.68 0.00 0.00 0.10 0.00 0.00 34.13 31.38 3g4s s GLU 23 CO 0.02 0.58 0.01 0.41 0.02 0.00 0.00 175.26 176.30 3g4s n GLY 24 N 0.76 1.16 0.00 -1.39 0.00 -0.68 -1.49 105.19 103.55 3g4s n GLY 24 Ca -0.11 -0.90 0.11 0.00 0.00 0.00 0.00 46.02 45.11 3g4s n GLY 24 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3g4s n ASP 25 N -0.50 0.00 -0.00 1.61 8.00 -1.07 -2.94 116.55 121.65 3g4s n ASP 25 Ca -0.00 -0.35 0.03 0.00 0.71 0.00 0.00 54.79 55.18 3g4s n ASP 25 Cb 0.01 -0.14 -0.04 0.00 -0.02 0.00 0.00 41.12 40.92 3g4s n ASP 25 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3g4s n ASN 26 N -1.14 0.84 0.00 -2.24 5.15 -1.03 -5.04 115.26 111.80 3g4s n ASN 26 Ca 0.13 -0.55 0.00 0.00 -0.60 0.00 0.00 54.58 53.56 3g4s n ASN 26 Cb 0.12 1.06 0.00 0.00 -0.53 0.00 0.00 39.78 40.43 3g4s n ASN 26 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3g4s n GLY 27 N 1.32 -0.06 2.75 8.20 0.00 -1.15 -4.72 105.19 111.53 3g4s n GLY 27 Ca 0.01 -1.43 -0.23 0.00 0.00 0.00 0.00 46.02 44.37 3g4s n GLY 27 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g4s s SER 28 N -4.00 1.58 -0.25 1.61 1.04 -1.26 -1.68 113.70 110.74 3g4s s SER 28 Ca 0.00 -0.09 -0.04 0.00 0.48 0.00 0.00 55.95 56.30 3g4s s SER 28 Cb 0.00 -0.40 0.01 0.00 0.10 0.00 0.00 66.02 65.73 3g4s s SER 28 CO 0.00 -0.21 -0.02 -0.69 0.98 0.00 0.00 173.24 173.30 3g4s s VAL 29 N 2.00 3.33 -0.16 5.02 1.01 -0.20 -4.95 120.40 126.45 3g4s s VAL 29 Ca 0.05 -0.75 -0.08 0.00 0.00 0.00 0.00 61.98 61.20 3g4s s VAL 29 Cb -0.12 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 3g4s s VAL 29 CO -0.05 0.25 0.10 -0.89 0.00 0.00 0.00 175.10 174.51 3g4s s THR 30 N 1.42 5.18 0.04 3.92 2.01 -1.26 -0.34 115.64 126.61 3g4s s THR 30 Ca 0.03 0.10 -0.02 0.00 0.31 0.00 0.00 61.69 62.11 3g4s s THR 30 Cb -0.16 -3.30 -0.03 0.00 0.01 0.00 0.00 72.50 69.02 3g4s s THR 30 CO -0.02 0.52 0.01 -0.13 -0.69 0.00 0.00 174.62 174.31 3g4s s ARG 31 N -0.24 0.53 -0.29 4.92 0.52 0.12 -4.98 118.95 119.53 3g4s s ARG 31 Ca 0.10 -0.93 -0.01 0.00 -0.52 0.00 0.00 55.73 54.37 3g4s s ARG 31 Cb -0.12 0.19 0.05 0.00 0.52 0.00 0.00 34.95 35.59 3g4s s ARG 31 CO 0.01 -0.11 -0.03 0.50 0.02 0.00 0.00 175.30 175.70 3g4s s ARG 32 N -2.92 2.45 -0.40 3.54 3.52 -1.26 -0.44 118.95 123.44 3g4s s ARG 32 Ca -0.02 -1.24 -0.08 0.00 -0.13 0.00 0.00 55.73 54.26 3g4s s ARG 32 Cb 0.01 -3.11 0.07 0.00 -1.56 0.00 0.00 34.95 30.36 3g4s s ARG 32 CO -0.06 -0.58 0.22 -0.51 -0.81 0.00 0.00 175.30 173.55 3g4s s LEU 33 N 1.24 4.98 -0.03 -0.88 1.43 -1.07 -5.03 118.68 119.32 3g4s s LEU 33 Ca -0.05 -1.49 0.01 0.00 -1.03 0.00 0.00 54.13 51.57 3g4s s LEU 33 Cb -0.19 -1.94 0.02 0.00 0.03 0.00 0.00 46.19 44.10 3g4s s LEU 33 CO -0.02 -0.49 -0.03 0.86 0.23 0.00 0.00 176.35 176.90 3g4s s TRP 34 N 1.38 0.49 -0.15 0.29 -0.00 -1.26 -4.87 118.94 114.82 3g4s s TRP 34 Ca 0.03 -0.09 -0.30 0.00 -0.00 0.00 0.00 56.10 55.74 3g4s s TRP 34 Cb -0.22 -0.45 0.12 0.00 -0.00 0.00 0.00 33.47 32.91 3g4s s TRP 34 CO 0.01 -0.11 0.94 -0.47 -0.00 0.00 0.00 176.95 177.32 3g4s s TYR 35 N 0.67 -0.43 -0.07 5.86 5.04 -1.26 -5.13 117.35 122.03 3g4s s TYR 35 Ca -0.08 0.76 -0.37 0.00 -2.44 0.00 0.00 57.07 54.95 3g4s s TYR 35 Cb -0.11 0.44 -0.15 0.00 0.35 0.00 0.00 41.96 42.49 3g4s s TYR 35 CO -0.01 -0.38 1.64 -2.30 -1.34 0.00 0.00 175.55 173.16 3g4s n PRO 36 N 0.86 1.53 -0.83 4.97 -0.02 -1.26 -2.82 135.00 137.43 3g4s n PRO 36 Ca -0.12 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 3g4s n PRO 36 Cb 0.58 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 3g4s n PRO 36 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3g4s n ASP 37 N 4.61 -3.45 -4.77 2.55 8.00 -1.26 -4.98 116.55 117.25 3g4s n ASP 37 Ca 0.22 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.34 3g4s n ASP 37 Cb 0.21 -2.77 -0.06 0.00 -0.02 0.00 0.00 41.12 38.47 3g4s n ASP 37 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3g4s s ILE 38 N -1.22 5.14 -0.07 0.53 1.01 -1.13 -4.23 121.20 121.23 3g4s s ILE 38 Ca 0.00 0.86 0.01 0.00 0.00 0.00 0.00 60.65 61.52 3g4s s ILE 38 Cb 0.00 -3.75 0.02 0.00 0.01 0.00 0.00 42.46 38.73 3g4s s ILE 38 CO 0.00 0.43 -0.10 -1.81 0.00 0.00 0.00 174.94 173.47 3g4s s ASP 39 N -0.06 1.69 -0.12 3.58 1.01 -0.56 -4.72 116.67 117.49 3g4s s ASP 39 Ca 0.24 -0.26 -0.04 0.00 0.71 0.00 0.00 52.55 53.20 3g4s s ASP 39 Cb -0.15 -0.75 -0.04 0.00 1.01 0.00 0.00 42.92 42.99 3g4s s ASP 39 CO 0.11 -0.02 0.03 -0.69 0.21 0.00 0.00 175.17 174.81 3g4s s VAL 40 N 0.94 4.58 0.15 -1.27 1.01 -1.26 -1.96 120.40 122.59 3g4s s VAL 40 Ca -0.10 -0.14 -0.06 0.00 0.00 0.00 0.00 61.98 61.69 3g4s s VAL 40 Cb -0.15 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 3g4s s VAL 40 CO 0.00 0.57 0.20 -0.94 0.00 0.00 0.00 175.10 174.94 3g4s s SER 41 N -0.53 0.13 -0.31 3.32 1.04 -0.56 -5.00 113.70 111.80 3g4s s SER 41 Ca 0.10 -0.98 -0.01 0.00 0.48 0.00 0.00 55.95 55.55 3g4s s SER 41 Cb -0.12 0.39 0.07 0.00 0.10 0.00 0.00 66.02 66.45 3g4s s SER 41 CO 0.02 -0.83 0.02 -0.69 0.98 0.00 0.00 173.24 172.74 3g4s s VAL 42 N -3.99 2.83 -1.31 5.02 1.01 -1.26 -1.04 120.40 121.66 3g4s s VAL 42 Ca 0.19 -1.62 -0.06 0.00 0.00 0.00 0.00 61.98 60.49 3g4s s VAL 42 Cb 0.05 -2.73 0.13 0.00 0.00 0.00 0.00 36.38 33.83 3g4s s VAL 42 CO 0.00 -0.23 2.31 -0.67 0.00 0.00 0.00 175.10 176.50 3g4s n ASP 43 N 4.55 7.70 0.00 3.32 2.03 -0.24 -4.80 116.55 129.11 3g4s n ASP 43 Ca -0.10 -3.16 0.00 0.00 0.52 0.00 0.00 54.79 52.05 3g4s n ASP 43 Cb 0.43 -1.37 0.00 0.00 -0.72 0.00 0.00 41.12 39.46 3g4s n ASP 43 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3g4s n GLY 44 N 1.78 1.75 0.31 0.27 0.00 -1.26 -3.58 105.19 104.45 3g4s n GLY 44 Ca 0.59 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.56 3g4s n GLY 44 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3g4s n ASP 45 N 3.96 0.00 -4.12 1.61 5.75 -1.26 -5.04 116.55 117.45 3g4s n ASP 45 Ca 0.00 -1.51 -0.21 0.00 -0.01 0.00 0.00 54.79 53.06 3g4s n ASP 45 Cb 0.00 -0.10 -0.14 0.00 -1.03 0.00 0.00 41.12 39.84 3g4s n ASP 45 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3g4s s THR 46 N 0.00 1.10 -0.24 2.12 -4.23 -1.24 -3.21 115.64 109.95 3g4s s THR 46 Ca 0.00 -0.74 -0.12 0.00 -1.18 0.00 0.00 61.69 59.65 3g4s s THR 46 Cb 0.00 -0.95 -0.05 0.00 1.34 0.00 0.00 72.50 72.84 3g4s s THR 46 CO 0.00 0.20 0.21 -0.69 -0.54 0.00 0.00 174.62 173.80 3g4s s VAL 47 N -0.52 5.32 -0.22 2.29 1.01 -0.18 -1.08 120.40 127.01 3g4s s VAL 47 Ca 0.04 0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.28 3g4s s VAL 47 Cb -0.06 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.78 3g4s s VAL 47 CO 0.00 0.32 -0.07 -0.69 0.00 0.00 0.00 175.10 174.66 3g4s s VAL 48 N 1.16 3.07 -0.40 2.92 1.01 -0.20 -0.66 120.40 127.30 3g4s s VAL 48 Ca 0.10 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.29 3g4s s VAL 48 Cb -0.14 -2.43 0.07 0.00 0.00 0.00 0.00 36.38 33.88 3g4s s VAL 48 CO 0.06 0.37 0.21 -0.63 0.00 0.00 0.00 175.10 175.10 3g4s s ILE 49 N 1.41 3.99 -0.00 2.22 1.01 -1.12 -1.49 121.20 127.22 3g4s s ILE 49 Ca 0.04 -1.41 0.03 0.00 0.00 0.00 0.00 60.65 59.31 3g4s s ILE 49 Cb -0.15 -3.42 -0.01 0.00 0.01 0.00 0.00 42.46 38.89 3g4s s ILE 49 CO -0.05 -0.44 -0.09 -1.83 0.00 0.00 0.00 174.94 172.54 3g4s s GLU 50 N 1.38 0.67 -0.00 2.79 -1.05 -0.83 -2.52 118.70 119.15 3g4s s GLU 50 Ca 0.02 -0.35 -0.03 0.00 -0.15 0.00 0.00 54.97 54.46 3g4s s GLU 50 Cb -0.22 -0.64 -0.00 0.00 -0.44 0.00 0.00 34.13 32.83 3g4s s GLU 50 CO 0.01 0.17 0.06 0.45 0.95 0.00 0.00 175.26 176.91 3g4s s SER 51 N -0.34 0.05 0.38 0.83 0.15 -0.97 -1.50 113.70 112.29 3g4s s SER 51 Ca 0.02 -0.16 0.19 0.00 0.70 0.00 0.00 55.95 56.70 3g4s s SER 51 Cb -0.04 0.15 0.71 0.00 -1.71 0.00 0.00 66.02 65.13 3g4s s SER 51 CO -0.00 -0.21 1.75 0.44 1.20 0.00 0.00 173.24 176.42 3g4s h ASP 52 N 5.10 0.00 -3.16 5.45 3.32 -1.86 -0.07 116.42 125.20 3g4s h ASP 52 Ca -0.29 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.18 3g4s h ASP 52 Cb 1.20 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.71 3g4s h ASP 52 CO 0.43 0.37 -0.12 -1.61 -1.72 0.00 0.00 179.24 176.59 3g4s s GLU 53 N -3.67 4.03 -0.20 3.56 2.02 -1.26 -4.55 118.70 118.63 3g4s s GLU 53 Ca -0.00 0.54 0.14 0.00 0.02 0.00 0.00 54.97 55.68 3g4s s GLU 53 Cb 0.11 -3.17 0.44 0.00 0.10 0.00 0.00 34.13 31.62 3g4s s GLU 53 CO 0.69 0.63 1.33 -0.40 0.02 0.00 0.00 175.26 177.53 3g4s n ASP 54 N 1.56 2.80 -4.81 -0.19 5.75 -1.26 -4.44 116.55 115.95 3g4s n ASP 54 Ca -0.11 -3.36 -0.33 0.00 -0.01 0.00 0.00 54.79 50.98 3g4s n ASP 54 Cb 0.52 -0.54 -0.05 0.00 -1.03 0.00 0.00 41.12 40.02 3g4s n ASP 54 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3g4s s ASN 55 N -2.53 6.65 0.47 -1.12 2.20 -1.26 -4.85 114.94 114.50 3g4s s ASN 55 Ca 0.40 1.77 0.26 0.00 -0.94 0.00 0.00 52.86 54.34 3g4s s ASN 55 Cb 0.35 -2.54 1.29 0.00 -2.00 0.00 0.00 41.25 38.35 3g4s s ASN 55 CO 0.03 -0.56 1.81 0.00 -2.94 0.00 0.00 177.10 175.44 3g4s h ALA 56 N 1.64 2.58 -0.16 3.54 0.00 -1.97 -0.08 119.26 124.82 3g4s h ALA 56 Ca -0.49 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.29 3g4s h ALA 56 Cb 1.20 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3g4s h ALA 56 CO 0.60 -0.93 -0.52 0.87 0.00 0.00 0.00 179.25 179.28 3g4s h LYS 57 N 0.22 0.44 0.06 0.00 1.57 -2.00 -1.96 116.57 114.89 3g4s h LYS 57 Ca 0.54 -0.26 -0.28 0.00 -1.87 0.00 0.00 60.65 58.78 3g4s h LYS 57 Cb 1.70 0.02 0.02 0.00 0.08 0.00 0.00 32.23 34.06 3g4s h LYS 57 CO -0.15 0.85 -1.14 1.15 -0.57 0.00 0.00 179.45 179.59 3g4s h THR 58 N 0.34 1.29 0.00 -0.16 2.02 -1.43 -3.11 112.91 111.86 3g4s h THR 58 Ca 0.01 -2.36 0.00 0.00 0.77 0.00 0.00 66.41 64.83 3g4s h THR 58 Cb 1.02 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 69.96 3g4s h THR 58 CO 0.09 0.72 0.00 0.24 0.37 0.00 0.00 175.52 176.95 3g4s h MET 59 N 0.33 0.00 -0.10 6.66 2.86 -1.11 -1.50 114.93 122.07 3g4s h MET 59 Ca -0.16 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.28 3g4s h MET 59 Cb 1.80 0.00 0.01 0.00 0.06 0.00 0.00 31.60 33.47 3g4s h MET 59 CO 0.22 0.00 -0.75 0.77 1.06 0.00 0.00 176.91 178.21 3g4s h SER 60 N 0.00 0.83 0.60 1.22 0.02 -1.28 -3.08 113.55 111.85 3g4s h SER 60 Ca 0.00 -0.67 -0.28 0.00 -0.84 0.00 0.00 61.79 60.00 3g4s h SER 60 Cb 0.28 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.58 3g4s h SER 60 CO 0.00 1.37 -1.30 0.74 -1.14 0.00 0.00 176.83 176.50 3g4s h THR 61 N 0.36 1.43 -0.90 -2.27 2.02 -1.36 -2.21 112.91 109.97 3g4s h THR 61 Ca -0.07 -3.02 0.02 0.00 0.77 0.00 0.00 66.41 64.12 3g4s h THR 61 Cb 1.40 2.91 -0.05 0.00 -1.74 0.00 0.00 68.15 70.67 3g4s h THR 61 CO 0.15 0.88 0.60 0.40 0.37 0.00 0.00 175.52 177.92 3g4s h ILE 62 N 0.07 1.20 -0.34 3.11 2.04 -1.43 0.37 117.51 122.54 3g4s h ILE 62 Ca -0.15 -0.41 -0.16 0.00 1.00 0.00 0.00 64.86 65.13 3g4s h ILE 62 Cb 1.98 -0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.97 3g4s h ILE 62 CO 0.19 0.22 -0.43 1.23 0.00 0.00 0.00 178.15 179.36 3g4s h GLY 63 N 1.19 0.97 1.68 5.37 0.00 -1.53 -2.51 103.07 108.24 3g4s h GLY 63 Ca 0.34 -1.04 -0.14 0.00 0.00 0.00 0.00 47.33 46.49 3g4s h GLY 63 CO -0.09 0.94 -0.53 -0.84 0.00 0.00 0.00 176.54 176.02 3g4s h THR 64 N 0.69 1.35 -0.09 4.70 2.02 -0.65 -2.94 112.91 117.98 3g4s h THR 64 Ca 0.04 -1.80 -0.13 0.00 0.77 0.00 0.00 66.41 65.30 3g4s h THR 64 Cb 1.03 1.84 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 3g4s h THR 64 CO 0.10 0.54 -0.50 -0.26 0.37 0.00 0.00 175.52 175.77 3g4s h PHE 65 N 0.26 0.30 -0.16 3.16 0.05 -0.26 -2.06 116.94 118.24 3g4s h PHE 65 Ca 0.01 -0.10 -0.01 0.00 3.82 0.00 0.00 57.97 61.69 3g4s h PHE 65 Cb 1.02 -0.06 -0.01 0.00 2.00 0.00 0.00 35.95 38.90 3g4s h PHE 65 CO 0.03 0.70 0.06 0.37 -0.18 0.00 0.00 178.31 179.29 3g4s h GLN 66 N 0.20 0.24 0.00 1.51 4.15 -1.28 -1.53 115.11 118.40 3g4s h GLN 66 Ca 0.01 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.38 3g4s h GLN 66 Cb 0.95 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.61 3g4s h GLN 66 CO 0.08 0.33 0.00 0.77 -1.93 0.00 0.00 178.83 178.08 3g4s h SER 67 N 0.09 0.00 1.08 -0.69 0.02 -1.43 0.25 113.55 112.87 3g4s h SER 67 Ca 0.05 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.88 3g4s h SER 67 Cb 0.19 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 3g4s h SER 67 CO -0.00 0.00 -0.98 0.45 -1.14 0.00 0.00 176.83 175.16 3g4s h HIS 68 N 0.00 0.00 0.01 3.45 3.86 -0.87 -3.04 115.15 118.56 3g4s h HIS 68 Ca 0.00 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 58.97 3g4s h HIS 68 Cb 0.45 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.89 3g4s h HIS 68 CO 0.00 0.46 -1.31 0.82 0.86 0.00 0.00 177.93 178.76 3g4s h ILE 69 N 0.00 0.90 -0.79 2.45 2.04 -0.51 -3.21 117.51 118.40 3g4s h ILE 69 Ca -0.08 -2.20 0.08 0.00 1.00 0.00 0.00 64.86 63.66 3g4s h ILE 69 Cb 1.42 2.27 -0.05 0.00 -0.74 0.00 0.00 36.82 39.72 3g4s h ILE 69 CO 0.05 0.37 0.51 -0.33 0.00 0.00 0.00 178.15 178.75 3g4s h GLU 70 N -0.90 0.76 0.00 2.37 5.08 -0.69 -0.31 114.58 120.89 3g4s h GLU 70 Ca -0.35 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 3g4s h GLU 70 Cb 1.37 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3g4s h GLU 70 CO -0.18 0.50 -0.02 -0.91 -1.00 0.00 0.00 179.01 177.40 3g4s h ASN 71 N 0.78 0.00 1.39 1.42 4.21 -1.70 -2.95 115.58 118.73 3g4s h ASN 71 Ca 0.35 -0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.75 3g4s h ASN 71 Cb 0.35 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.53 3g4s h ASN 71 CO -0.13 0.00 -0.62 0.24 -1.29 0.00 0.00 177.43 175.63 3g4s h MET 72 N 0.00 0.00 -0.20 0.81 2.86 -1.08 -2.73 114.93 114.58 3g4s h MET 72 Ca 0.00 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.47 3g4s h MET 72 Cb 0.87 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.54 3g4s h MET 72 CO 0.00 0.44 -0.54 0.74 1.06 0.00 0.00 176.91 178.61 3g4s h PHE 73 N 0.00 0.93 0.00 -0.22 0.05 -1.19 -2.79 116.94 113.72 3g4s h PHE 73 Ca -0.03 -0.36 -0.07 0.00 3.82 0.00 0.00 57.97 61.33 3g4s h PHE 73 Cb 1.39 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 39.17 3g4s h PHE 73 CO 0.00 1.16 -0.35 1.25 -0.18 0.00 0.00 178.31 180.19 3g4s h HIS 74 N 0.44 0.00 -0.60 -0.55 2.76 -1.56 -2.54 115.15 113.09 3g4s h HIS 74 Ca -0.01 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.06 3g4s h HIS 74 Cb 1.16 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.10 3g4s h HIS 74 CO 0.09 0.35 0.00 0.78 -1.30 0.00 0.00 177.93 177.85 3g4s h GLY 75 N 1.47 1.14 1.16 5.26 0.00 -1.28 0.32 103.07 111.13 3g4s h GLY 75 Ca -0.00 -0.83 0.00 0.00 0.00 0.00 0.00 47.33 46.50 3g4s h GLY 75 CO 0.05 0.76 -0.45 3.33 0.00 0.00 0.00 176.54 180.23 3g4s n VAL 76 N -4.18 0.05 0.00 4.60 0.24 -1.07 -3.50 118.33 114.47 3g4s n VAL 76 Ca 0.03 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 3g4s n VAL 76 Cb 0.34 0.09 0.00 0.00 -1.47 0.00 0.00 33.84 32.81 3g4s n VAL 76 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3g4s n THR 77 N -1.59 0.00 0.07 3.34 -2.24 -0.98 -2.47 114.28 110.41 3g4s n THR 77 Ca 0.05 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.74 3g4s n THR 77 Cb 0.35 -0.54 -0.12 0.00 -2.10 0.00 0.00 70.33 67.92 3g4s n THR 77 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3g4s h GLU 78 N 0.00 0.06 0.00 -0.78 5.08 -1.71 -3.42 114.58 113.80 3g4s h GLU 78 Ca 0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3g4s h GLU 78 Cb 0.00 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.29 3g4s h GLU 78 CO 0.00 1.03 0.00 0.41 -1.00 0.00 0.00 179.01 179.45 3g4s n GLY 79 N 1.40 -0.40 3.55 -3.84 0.00 0.11 -4.98 105.19 101.02 3g4s n GLY 79 Ca -0.02 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 43.91 3g4s n GLY 79 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3g4s s TRP 80 N -1.83 3.02 -0.11 1.61 0.52 -0.02 -4.77 118.94 117.38 3g4s s TRP 80 Ca 0.00 -0.14 0.01 0.00 0.02 0.00 0.00 56.10 55.99 3g4s s TRP 80 Cb 0.00 -1.87 0.02 0.00 -1.15 0.00 0.00 33.47 30.47 3g4s s TRP 80 CO 0.00 0.14 -0.11 -1.21 0.02 0.00 0.00 176.95 175.79 3g4s s GLU 81 N -0.14 1.84 -0.13 4.98 0.41 -1.26 -1.97 118.70 122.43 3g4s s GLU 81 Ca 0.03 -0.40 0.02 0.00 -0.41 0.00 0.00 54.97 54.21 3g4s s GLU 81 Cb -0.13 -1.70 0.01 0.00 -1.78 0.00 0.00 34.13 30.53 3g4s s GLU 81 CO 0.02 -0.16 -0.21 0.71 -0.49 0.00 0.00 175.26 175.14 3g4s s TYR 82 N 1.31 2.52 -0.16 1.61 1.51 0.09 -3.88 117.35 120.34 3g4s s TYR 82 Ca -0.01 -1.24 -0.07 0.00 -1.01 0.00 0.00 57.07 54.73 3g4s s TYR 82 Cb -0.14 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 39.94 3g4s s TYR 82 CO -0.05 -0.57 0.09 0.20 -1.11 0.00 0.00 175.55 174.11 3g4s s GLY 83 N 0.81 2.00 -0.01 0.71 0.00 -0.79 -0.68 107.32 109.36 3g4s s GLY 83 Ca -0.08 -0.71 0.05 0.00 0.00 0.00 0.00 44.72 43.98 3g4s s GLY 83 CO -0.01 -0.09 -0.15 1.06 0.00 0.00 0.00 173.10 173.91 3g4s s MET 84 N -0.09 1.22 -0.16 2.90 -1.94 0.18 0.23 119.30 121.63 3g4s s MET 84 Ca 0.08 -0.53 0.01 0.00 -1.71 0.00 0.00 55.69 53.54 3g4s s MET 84 Cb -0.12 -1.17 0.03 0.00 2.01 0.00 0.00 34.83 35.58 3g4s s MET 84 CO 0.01 0.31 -0.15 -1.21 -0.01 0.00 0.00 175.02 173.97 3g4s s GLU 85 N -0.33 2.42 0.18 2.03 2.02 -1.10 0.06 118.70 123.98 3g4s s GLU 85 Ca 0.05 -0.67 -0.30 0.00 0.02 0.00 0.00 54.97 54.07 3g4s s GLU 85 Cb -0.06 -2.27 -0.08 0.00 0.10 0.00 0.00 34.13 31.82 3g4s s GLU 85 CO -0.00 -0.26 1.24 0.54 0.02 0.00 0.00 175.26 176.79 3g4s s VAL 86 N 1.42 3.50 -0.04 2.63 0.11 -0.72 -3.20 120.40 124.10 3g4s s VAL 86 Ca 0.04 1.23 0.05 0.00 -2.93 0.00 0.00 61.98 60.37 3g4s s VAL 86 Cb -0.13 -3.79 -0.01 0.00 -1.53 0.00 0.00 36.38 30.92 3g4s s VAL 86 CO -0.11 0.18 -0.19 0.12 -3.33 0.00 0.00 175.10 171.77 3g4s s PHE 87 N 0.13 1.86 -0.01 1.54 5.36 -1.10 -4.96 117.98 120.80 3g4s s PHE 87 Ca 0.55 -0.51 -0.11 0.00 -0.96 0.00 0.00 56.93 55.89 3g4s s PHE 87 Cb -0.34 -1.23 0.01 0.00 -0.34 0.00 0.00 43.02 41.12 3g4s s PHE 87 CO 0.36 -0.16 0.22 1.52 -1.46 0.00 0.00 175.22 175.71 3g4s s TYR 88 N -0.07 -0.07 -0.05 10.12 -0.85 -1.26 -1.11 117.35 124.06 3g4s s TYR 88 Ca -0.02 0.07 -0.08 0.00 -0.52 0.00 0.00 57.07 56.52 3g4s s TYR 88 Cb -0.11 0.02 -0.03 0.00 0.38 0.00 0.00 41.96 42.22 3g4s s TYR 88 CO 0.02 -0.34 -0.16 -1.13 -1.52 0.00 0.00 175.55 172.43 3g4s n SER 89 N 1.39 1.31 -0.05 -0.18 3.41 -1.26 -4.94 113.62 113.30 3g4s n SER 89 Ca -0.22 0.20 -0.06 0.00 -0.26 0.00 0.00 58.87 58.53 3g4s n SER 89 Cb 0.56 -0.47 -0.05 0.00 -0.26 0.00 0.00 64.21 63.98 3g4s n SER 89 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3g4s n HIS 90 N -3.82 0.00 -3.53 7.33 -0.00 -1.26 -5.02 115.22 108.92 3g4s n HIS 90 Ca -0.11 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.23 3g4s n HIS 90 Cb 0.36 -0.40 -0.08 0.00 -0.00 0.00 0.00 29.99 29.87 3g4s n HIS 90 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 3g4s s PHE 91 N -2.20 3.36 -1.09 1.57 0.40 -1.26 -5.01 117.98 113.75 3g4s s PHE 91 Ca -0.11 0.45 -0.23 0.00 -0.60 0.00 0.00 56.93 56.44 3g4s s PHE 91 Cb 0.03 -2.39 -0.08 0.00 0.51 0.00 0.00 43.02 41.09 3g4s s PHE 91 CO 0.27 0.06 1.96 -2.14 0.70 0.00 0.00 175.22 176.07 3g4s s PRO 92 N 1.06 2.42 0.22 0.24 0.02 -1.26 -4.86 135.00 132.84 3g4s s PRO 92 Ca 0.14 -0.84 -0.30 0.00 0.02 0.00 0.00 61.00 60.02 3g4s s PRO 92 Cb -0.14 -5.17 -0.09 0.00 0.02 0.00 0.00 34.50 29.13 3g4s s PRO 92 CO 0.06 -3.90 1.22 1.41 -0.33 0.00 0.00 177.00 175.45 3g4s s MET 93 N 6.79 4.48 -0.19 5.54 1.75 -1.26 -4.89 119.30 131.51 3g4s s MET 93 Ca 0.70 1.94 0.00 0.00 -1.25 0.00 0.00 55.69 57.08 3g4s s MET 93 Cb -0.03 -3.21 0.01 0.00 2.84 0.00 0.00 34.83 34.45 3g4s s MET 93 CO 0.09 -0.09 -0.17 -0.65 -0.65 0.00 0.00 175.02 173.56 3g4s s GLN 94 N -0.55 3.06 -0.43 4.11 -0.21 -0.92 -5.01 119.66 119.71 3g4s s GLN 94 Ca 0.52 -0.79 -0.05 0.00 0.02 0.00 0.00 55.36 55.05 3g4s s GLN 94 Cb -0.34 -2.65 0.11 0.00 1.00 0.00 0.00 33.01 31.13 3g4s s GLN 94 CO 0.39 -0.21 0.26 0.08 -2.12 0.00 0.00 175.29 173.69 3g4s s VAL 95 N 1.32 3.65 -0.02 1.09 1.01 -1.26 -0.51 120.40 125.68 3g4s s VAL 95 Ca 0.05 -1.94 0.07 0.00 0.00 0.00 0.00 61.98 60.16 3g4s s VAL 95 Cb -0.13 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.77 3g4s s VAL 95 CO -0.11 -0.72 -0.22 0.20 0.00 0.00 0.00 175.10 174.25 3g4s s ASN 96 N 2.15 3.38 -0.31 3.32 -0.87 -0.25 -4.98 114.94 117.38 3g4s s ASN 96 Ca 0.07 -0.39 -0.22 0.00 -1.57 0.00 0.00 52.86 50.74 3g4s s ASN 96 Cb -0.24 -0.50 -0.00 0.00 -0.02 0.00 0.00 41.25 40.49 3g4s s ASN 96 CO -0.03 0.32 0.74 -0.69 -2.57 0.00 0.00 177.10 174.87 3g4s s VAL 97 N -0.67 4.83 -0.30 1.60 1.01 -1.26 -1.27 120.40 124.33 3g4s s VAL 97 Ca 0.11 1.03 0.03 0.00 0.00 0.00 0.00 61.98 63.16 3g4s s VAL 97 Cb -0.10 -4.11 0.08 0.00 0.00 0.00 0.00 36.38 32.25 3g4s s VAL 97 CO -0.00 -0.24 -0.02 -1.61 0.00 0.00 0.00 175.10 173.23 3g4s s GLU 98 N 2.87 1.78 5.16 2.72 2.02 -0.62 -4.96 118.70 127.66 3g4s s GLU 98 Ca 0.30 -1.63 0.00 0.00 0.02 0.00 0.00 54.97 53.66 3g4s s GLU 98 Cb -0.14 -3.04 0.00 0.00 0.10 0.00 0.00 34.13 31.05 3g4s s GLU 98 CO 0.13 -0.78 0.00 0.41 0.02 0.00 0.00 175.26 175.04 3g4s n GLY 99 N 4.35 1.75 1.82 -1.39 0.00 -1.26 -3.08 105.19 107.38 3g4s n GLY 99 Ca -0.04 -0.62 -0.16 0.00 0.00 0.00 0.00 46.02 45.20 3g4s n GLY 99 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3g4s n ASP 100 N 2.63 5.25 -3.67 1.61 8.00 -1.26 -4.83 116.55 124.28 3g4s n ASP 100 Ca 0.00 -3.02 -0.11 0.00 0.71 0.00 0.00 54.79 52.37 3g4s n ASP 100 Cb 0.00 -0.89 -0.09 0.00 -0.02 0.00 0.00 41.12 40.12 3g4s n ASP 100 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3g4s s GLU 101 N -1.92 0.61 -0.07 -1.24 -1.05 -1.18 -1.86 118.70 111.99 3g4s s GLU 101 Ca 0.33 0.93 -0.20 0.00 -0.15 0.00 0.00 54.97 55.87 3g4s s GLU 101 Cb 0.27 0.18 -0.04 0.00 -0.44 0.00 0.00 34.13 34.09 3g4s s GLU 101 CO 0.02 -0.12 0.58 0.54 0.95 0.00 0.00 175.26 177.23 3g4s s VAL 102 N 0.99 5.07 -0.00 1.83 0.11 -1.26 -1.59 120.40 125.55 3g4s s VAL 102 Ca -0.05 1.18 0.06 0.00 -2.93 0.00 0.00 61.98 60.24 3g4s s VAL 102 Cb -0.05 -3.92 -0.03 0.00 -1.53 0.00 0.00 36.38 30.85 3g4s s VAL 102 CO -0.09 0.33 -0.18 -0.69 -3.33 0.00 0.00 175.10 171.14 3g4s s VAL 103 N 0.45 2.75 -0.10 2.04 1.01 -0.40 -2.13 120.40 124.02 3g4s s VAL 103 Ca 0.31 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 61.33 3g4s s VAL 103 Cb -0.17 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.12 3g4s s VAL 103 CO 0.15 0.48 -0.23 -0.63 0.00 0.00 0.00 175.10 174.86 3g4s s ILE 104 N -0.79 2.01 0.19 2.22 1.01 0.49 -1.09 121.20 125.23 3g4s s ILE 104 Ca 0.13 -0.98 0.11 0.00 0.00 0.00 0.00 60.65 59.90 3g4s s ILE 104 Cb -0.10 -1.74 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 3g4s s ILE 104 CO 0.02 0.55 -0.23 -1.61 0.00 0.00 0.00 174.94 173.66 3g4s s GLU 105 N 0.40 1.49 -1.46 2.79 2.02 0.33 0.13 118.70 124.40 3g4s s GLU 105 Ca -0.18 -1.51 -0.08 0.00 0.02 0.00 0.00 54.97 53.22 3g4s s GLU 105 Cb -0.18 -1.79 0.06 0.00 0.10 0.00 0.00 34.13 32.32 3g4s s GLU 105 CO 0.08 0.39 0.83 -1.71 0.02 0.00 0.00 175.26 174.86 3g4s n ASN 106 N 0.28 -3.14 -4.68 -0.19 4.05 -1.24 -2.17 115.26 108.17 3g4s n ASN 106 Ca -0.13 -0.83 -0.43 0.00 0.45 0.00 0.00 54.58 53.65 3g4s n ASN 106 Cb 0.56 -3.79 -0.02 0.00 1.23 0.00 0.00 39.78 37.75 3g4s n ASN 106 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 3g4s s PHE 107 N -3.48 3.32 -0.77 1.20 5.36 -1.26 -3.56 117.98 118.78 3g4s s PHE 107 Ca 0.40 1.39 0.00 0.00 -0.96 0.00 0.00 56.93 57.76 3g4s s PHE 107 Cb -0.20 -3.31 0.00 0.00 -0.34 0.00 0.00 43.02 39.17 3g4s s PHE 107 CO 0.84 -0.78 0.00 -0.11 -1.46 0.00 0.00 175.22 173.71 3g4s n LEU 108 N 5.38 -0.09 0.00 6.12 7.94 -1.26 -1.42 117.00 133.67 3g4s n LEU 108 Ca 0.10 0.18 0.00 0.00 -1.11 0.00 0.00 56.01 55.18 3g4s n LEU 108 Cb 0.47 -2.20 0.00 0.00 0.53 0.00 0.00 43.42 42.22 3g4s n LEU 108 CO 0.53 -0.82 0.00 0.61 -1.11 0.00 0.00 177.39 176.61 3g4s n GLY 109 N 0.31 0.92 3.78 -3.96 0.00 -1.23 -5.03 105.19 99.98 3g4s n GLY 109 Ca -0.07 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 3g4s n GLY 109 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g4s s GLU 110 N -0.41 4.50 0.21 1.61 2.02 -0.51 -4.97 118.70 121.15 3g4s s GLU 110 Ca 0.00 1.10 0.07 0.00 0.02 0.00 0.00 54.97 56.17 3g4s s GLU 110 Cb 0.00 -3.17 0.13 0.00 0.10 0.00 0.00 34.13 31.18 3g4s s GLU 110 CO 0.00 0.53 1.47 0.87 0.02 0.00 0.00 175.26 178.15 3g4s h LYS 111 N 4.11 0.07 -5.97 1.61 1.57 -1.98 -3.30 116.57 112.69 3g4s h LYS 111 Ca -0.47 -0.07 -0.57 0.00 -1.87 0.00 0.00 60.65 57.67 3g4s h LYS 111 Cb 1.20 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.47 3g4s h LYS 111 CO 0.66 0.80 0.13 0.00 -0.57 0.00 0.00 179.45 180.47 3g4s s ALA 112 N -3.32 3.39 0.28 3.86 0.00 -1.26 -4.88 121.76 119.83 3g4s s ALA 112 Ca -0.01 0.06 -0.29 0.00 0.00 0.00 0.00 51.96 51.72 3g4s s ALA 112 Cb 0.11 -2.99 -0.09 0.00 0.00 0.00 0.00 23.12 20.15 3g4s s ALA 112 CO 0.80 -0.23 1.05 -2.14 0.00 0.00 0.00 175.76 175.24 3g4s s PRO 113 N 1.12 4.66 -0.40 0.00 0.02 -1.26 -4.65 135.00 134.48 3g4s s PRO 113 Ca 0.36 1.70 -0.16 0.00 0.02 0.00 0.00 61.00 62.91 3g4s s PRO 113 Cb -0.17 -3.16 0.01 0.00 0.02 0.00 0.00 34.50 31.20 3g4s s PRO 113 CO 0.16 0.27 0.39 1.03 -0.33 0.00 0.00 177.00 178.52 3g4s s ARG 114 N -1.47 3.16 -0.08 5.54 0.52 0.12 -4.95 118.95 121.79 3g4s s ARG 114 Ca 0.45 -0.76 0.04 0.00 -0.52 0.00 0.00 55.73 54.94 3g4s s ARG 114 Cb -0.29 -3.94 -0.01 0.00 0.52 0.00 0.00 34.95 31.23 3g4s s ARG 114 CO 0.37 -0.77 -0.22 -0.98 0.02 0.00 0.00 175.30 173.73 3g4s s ARG 115 N 2.00 2.81 0.00 3.54 1.70 -1.26 -0.38 118.95 127.36 3g4s s ARG 115 Ca 0.10 -0.85 0.00 0.00 -0.47 0.00 0.00 55.73 54.51 3g4s s ARG 115 Cb -0.17 -2.28 0.00 0.00 -0.57 0.00 0.00 34.95 31.92 3g4s s ARG 115 CO 0.12 0.32 0.00 -2.37 -1.08 0.00 0.00 175.30 172.29 3g4s n THR 116 N 3.15 0.00 -3.79 4.99 5.66 -0.90 -5.03 114.28 118.35 3g4s n THR 116 Ca -0.18 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.69 3g4s n THR 116 Cb 0.52 -0.53 -0.11 0.00 -1.55 0.00 0.00 70.33 68.66 3g4s n THR 116 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3g4s s THR 117 N 1.86 0.00 -0.22 1.09 2.01 -1.26 -4.27 115.64 114.85 3g4s s THR 117 Ca 0.00 -0.04 -0.28 0.00 0.31 0.00 0.00 61.69 61.68 3g4s s THR 117 Cb 0.00 -0.38 0.01 0.00 0.01 0.00 0.00 72.50 72.14 3g4s s THR 117 CO 0.00 -0.02 1.00 -0.63 -0.69 0.00 0.00 174.62 174.28 3g4s s ILE 118 N 0.04 4.72 -0.42 1.82 1.01 -0.78 -4.88 121.20 122.71 3g4s s ILE 118 Ca -0.01 1.95 -0.29 0.00 0.00 0.00 0.00 60.65 62.30 3g4s s ILE 118 Cb -0.02 -4.28 0.02 0.00 0.01 0.00 0.00 42.46 38.20 3g4s s ILE 118 CO 0.01 -0.14 1.11 -1.00 0.00 0.00 0.00 174.94 174.91 3g4s s HIS 119 N 3.02 2.95 0.00 3.97 3.76 -1.26 -4.89 115.29 122.84 3g4s s HIS 119 Ca 0.43 0.90 0.00 0.00 -0.15 0.00 0.00 55.06 56.24 3g4s s HIS 119 Cb -0.15 -4.14 0.00 0.00 1.11 0.00 0.00 32.58 29.39 3g4s s HIS 119 CO 0.07 -1.07 0.00 0.41 -0.85 0.00 0.00 174.74 173.30 3g4s n GLY 120 N 4.47 1.60 0.12 -2.22 0.00 -1.26 -3.92 105.19 103.97 3g4s n GLY 120 Ca 0.12 -0.53 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 3g4s n GLY 120 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g4s h ASP 121 N 3.11 0.49 -0.10 1.61 3.32 -1.98 -3.49 116.42 119.38 3g4s h ASP 121 Ca 0.00 -0.50 -0.07 0.00 0.02 0.00 0.00 57.03 56.48 3g4s h ASP 121 Cb 0.00 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 39.40 3g4s h ASP 121 CO 0.00 1.37 -0.00 0.41 -1.72 0.00 0.00 179.24 179.30 3g4s n THR 122 N -3.59 0.03 -3.62 0.35 -1.04 -1.25 -4.96 114.28 100.20 3g4s n THR 122 Ca -0.09 -0.01 -0.39 0.00 -2.04 0.00 0.00 64.05 61.53 3g4s n THR 122 Cb 1.00 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 69.39 3g4s n THR 122 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 3g4s s ASP 123 N -0.01 5.72 -0.35 8.00 1.01 0.11 -4.94 116.67 126.21 3g4s s ASP 123 Ca 0.08 -0.39 -0.06 0.00 0.71 0.00 0.00 52.55 52.90 3g4s s ASP 123 Cb -0.12 -2.05 0.05 0.00 1.01 0.00 0.00 42.92 41.82 3g4s s ASP 123 CO 0.05 -0.17 0.12 -0.69 0.21 0.00 0.00 175.17 174.70 3g4s s VAL 124 N 1.67 3.66 -0.06 -1.27 1.01 -1.26 -0.89 120.40 123.25 3g4s s VAL 124 Ca 0.06 -1.31 0.05 0.00 0.00 0.00 0.00 61.98 60.78 3g4s s VAL 124 Cb -0.17 -3.15 -0.00 0.00 0.00 0.00 0.00 36.38 33.06 3g4s s VAL 124 CO 0.08 -0.27 -0.22 -1.61 0.00 0.00 0.00 175.10 173.09 3g4s s GLU 125 N 1.35 2.39 -0.16 2.72 2.02 -1.13 -4.99 118.70 120.90 3g4s s GLU 125 Ca -0.01 -0.78 -0.08 0.00 0.02 0.00 0.00 54.97 54.12 3g4s s GLU 125 Cb -0.20 -1.97 -0.04 0.00 0.10 0.00 0.00 34.13 32.02 3g4s s GLU 125 CO 0.01 0.27 0.13 -1.50 0.02 0.00 0.00 175.26 174.19 3g4s s ILE 126 N 0.08 5.39 -0.57 -1.63 2.07 -1.26 -1.78 121.20 123.49 3g4s s ILE 126 Ca -0.08 0.17 0.07 0.00 -1.41 0.00 0.00 60.65 59.40 3g4s s ILE 126 Cb -0.14 -3.40 0.26 0.00 0.13 0.00 0.00 42.46 39.30 3g4s s ILE 126 CO 0.05 0.53 0.70 -0.67 -1.91 0.00 0.00 174.94 173.63 3g4s n ASP 127 N 2.79 2.86 0.00 4.50 4.64 -0.67 -5.01 116.55 125.66 3g4s n ASP 127 Ca -0.18 -3.26 0.00 0.00 -1.38 0.00 0.00 54.79 49.97 3g4s n ASP 127 Cb 0.53 -0.66 0.00 0.00 -1.04 0.00 0.00 41.12 39.96 3g4s n ASP 127 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3g4s n GLY 128 N 0.92 1.90 0.03 0.27 0.00 -1.26 -2.96 105.19 104.09 3g4s n GLY 128 Ca 0.28 0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.42 3g4s n GLY 128 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3g4s n GLU 129 N 0.00 0.30 -3.92 1.61 -0.58 -1.26 -4.95 120.64 111.85 3g4s n GLU 129 Ca 0.00 -0.02 -0.21 0.00 -0.42 0.00 0.00 57.16 56.51 3g4s n GLU 129 Cb 0.00 -1.58 -0.03 0.00 -0.57 0.00 0.00 31.44 29.26 3g4s n GLU 129 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 3g4s s GLU 130 N -3.21 3.19 -0.12 3.49 2.02 -1.15 -1.76 118.70 121.15 3g4s s GLU 130 Ca 0.03 -0.93 -0.09 0.00 0.02 0.00 0.00 54.97 54.00 3g4s s GLU 130 Cb 0.14 -2.76 0.04 0.00 0.10 0.00 0.00 34.13 31.66 3g4s s GLU 130 CO 0.82 0.33 0.31 -0.51 0.02 0.00 0.00 175.26 176.23 3g4s s LEU 131 N -3.98 0.51 -0.19 1.80 1.43 0.11 -1.67 118.68 116.69 3g4s s LEU 131 Ca 0.36 0.65 -0.01 0.00 -1.03 0.00 0.00 54.13 54.11 3g4s s LEU 131 Cb -0.08 1.03 0.05 0.00 0.03 0.00 0.00 46.19 47.22 3g4s s LEU 131 CO 0.28 -0.14 -0.03 0.28 0.23 0.00 0.00 176.35 176.97 3g4s s THR 132 N 0.72 1.10 -0.16 5.49 -1.32 -0.74 0.49 115.64 121.23 3g4s s THR 132 Ca -0.05 -0.80 -0.23 0.00 -1.21 0.00 0.00 61.69 59.40 3g4s s THR 132 Cb -0.06 -1.38 -0.02 0.00 -1.51 0.00 0.00 72.50 69.52 3g4s s THR 132 CO -0.05 -0.03 0.72 -0.69 -2.21 0.00 0.00 174.62 172.36 3g4s s VAL 133 N 1.61 4.98 0.02 5.08 1.01 0.15 -2.85 120.40 130.39 3g4s s VAL 133 Ca -0.02 1.41 -0.01 0.00 0.00 0.00 0.00 61.98 63.35 3g4s s VAL 133 Cb -0.17 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.16 3g4s s VAL 133 CO -0.07 0.11 0.00 -0.94 0.00 0.00 0.00 175.10 174.21 3g4s s SER 134 N 1.09 0.19 0.00 3.32 1.04 -0.07 -0.73 113.70 118.54 3g4s s SER 134 Ca 0.34 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.34 3g4s s SER 134 Cb -0.16 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.08 3g4s s SER 134 CO 0.13 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 174.65 3g4s n GLY 135 N 1.59 0.32 0.12 7.32 0.00 -0.83 0.06 105.19 113.76 3g4s n GLY 135 Ca -0.24 -1.04 -0.18 0.00 0.00 0.00 0.00 46.02 44.57 3g4s n GLY 135 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3g4s h PRO 136 N 0.00 0.31 -5.46 1.61 0.13 -1.85 0.00 132.00 126.74 3g4s h PRO 136 Ca 0.00 -0.52 -0.63 0.00 -0.87 0.00 0.00 66.00 63.98 3g4s h PRO 136 Cb 0.00 0.19 -0.14 0.00 0.13 0.00 0.00 31.00 31.18 3g4s h PRO 136 CO 0.00 1.20 0.53 0.34 -0.23 0.00 0.00 178.00 179.84 3g4s s ASP 137 N -7.13 6.19 0.55 1.44 2.15 -1.26 -4.27 116.67 114.33 3g4s s ASP 137 Ca -0.08 -0.94 0.25 0.00 0.43 0.00 0.00 52.55 52.20 3g4s s ASP 137 Cb 0.06 -2.42 1.45 0.00 -0.30 0.00 0.00 42.92 41.71 3g4s s ASP 137 CO 0.87 -1.41 2.05 -0.29 -0.17 0.00 0.00 175.17 176.23 3g4s h ILE 138 N 5.97 0.70 -0.69 4.11 2.10 -1.88 -0.17 117.51 127.66 3g4s h ILE 138 Ca -0.29 0.00 -0.06 0.00 1.08 0.00 0.00 64.86 65.60 3g4s h ILE 138 Cb 1.07 0.81 -0.03 0.00 -1.09 0.00 0.00 36.82 37.58 3g4s h ILE 138 CO 1.17 0.00 0.21 -0.33 -1.08 0.00 0.00 178.15 178.12 3g4s h GLU 139 N 0.00 1.08 0.24 2.19 4.39 -1.99 0.81 114.58 121.30 3g4s h GLU 139 Ca 0.15 -0.24 -0.33 0.00 0.34 0.00 0.00 59.36 59.29 3g4s h GLU 139 Cb 0.67 -0.15 0.04 0.00 -0.10 0.00 0.00 28.75 29.21 3g4s h GLU 139 CO -0.00 0.93 -1.47 0.00 -1.16 0.00 0.00 179.01 177.31 3g4s h ALA 140 N 1.09 -0.13 0.12 3.43 0.00 -1.39 -3.20 119.26 119.19 3g4s h ALA 140 Ca 0.22 -0.88 -0.01 0.00 0.00 0.00 0.00 54.91 54.24 3g4s h ALA 140 Cb 0.31 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3g4s h ALA 140 CO -0.01 0.70 -0.06 0.28 0.00 0.00 0.00 179.25 180.17 3g4s h VAL 141 N 0.11 1.03 -0.06 0.00 2.07 -1.10 0.77 116.25 119.07 3g4s h VAL 141 Ca -0.26 -0.63 -0.00 0.00 0.82 0.00 0.00 66.70 66.62 3g4s h VAL 141 Cb 2.13 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 33.32 3g4s h VAL 141 CO 0.26 0.15 0.04 1.23 0.02 0.00 0.00 177.57 179.27 3g4s h GLY 142 N -0.46 0.09 1.36 2.17 0.00 -1.00 0.72 103.07 105.94 3g4s h GLY 142 Ca -0.02 -0.03 -0.32 0.00 0.00 0.00 0.00 47.33 46.96 3g4s h GLY 142 CO 0.03 0.03 -1.43 1.46 0.00 0.00 0.00 176.54 176.63 3g4s h GLN 143 N 0.08 0.46 0.00 4.80 1.08 -1.52 -1.92 115.11 118.09 3g4s h GLN 143 Ca 0.02 -0.78 -0.11 0.00 -1.45 0.00 0.00 58.65 56.33 3g4s h GLN 143 Cb -0.00 0.29 -0.02 0.00 -0.05 0.00 0.00 27.48 27.71 3g4s h GLN 143 CO -0.00 1.37 -0.52 1.15 -0.95 0.00 0.00 178.83 179.88 3g4s h THR 144 N 0.12 1.29 -0.14 -0.54 2.02 -0.18 0.14 112.91 115.64 3g4s h THR 144 Ca -0.23 -1.82 -0.19 0.00 0.77 0.00 0.00 66.41 64.95 3g4s h THR 144 Cb 2.11 2.00 0.01 0.00 -1.74 0.00 0.00 68.15 70.53 3g4s h THR 144 CO 0.25 0.51 -0.64 0.00 0.37 0.00 0.00 175.52 176.01 3g4s h ALA 145 N 1.48 0.27 0.11 6.16 0.00 -0.93 -3.03 119.26 123.32 3g4s h ALA 145 Ca -0.01 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 3g4s h ALA 145 Cb 0.96 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3g4s h ALA 145 CO 0.07 0.55 -0.05 0.00 0.00 0.00 0.00 179.25 179.81 3g4s h ALA 146 N 0.52 -0.15 -1.09 0.00 0.00 -1.08 -2.99 119.26 114.47 3g4s h ALA 146 Ca -0.04 -0.16 0.30 0.00 0.00 0.00 0.00 54.91 55.01 3g4s h ALA 146 Cb 1.28 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 19.05 3g4s h ALA 146 CO 0.13 -0.43 0.74 -0.44 0.00 0.00 0.00 179.25 179.25 3g4s h ASP 147 N -0.44 0.26 0.03 0.00 5.19 -0.77 0.10 116.42 120.78 3g4s h ASP 147 Ca -0.01 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.45 3g4s h ASP 147 Cb 0.36 0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.88 3g4s h ASP 147 CO 0.02 0.04 -0.01 0.40 -3.12 0.00 0.00 179.24 176.57 3g4s h ILE 148 N 0.22 1.40 -0.35 0.35 2.04 -1.40 -2.01 117.51 117.77 3g4s h ILE 148 Ca 0.58 -1.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.00 3g4s h ILE 148 Cb 1.83 2.34 -0.02 0.00 -0.74 0.00 0.00 36.82 40.23 3g4s h ILE 148 CO -0.18 0.36 0.18 -0.08 0.00 0.00 0.00 178.15 178.43 3g4s h GLU 149 N -0.67 0.49 0.00 2.37 4.81 -0.83 -2.52 114.58 118.22 3g4s h GLU 149 Ca -0.00 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3g4s h GLU 149 Cb 0.62 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.90 3g4s h GLU 149 CO 0.01 0.42 0.00 1.96 -0.73 0.00 0.00 179.01 180.66 3g4s h GLN 150 N 0.43 0.00 0.00 1.92 1.08 -0.97 -2.22 115.11 115.36 3g4s h GLN 150 Ca 0.12 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.32 3g4s h GLN 150 Cb 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 3g4s h GLN 150 CO -0.02 0.00 0.00 1.25 -0.95 0.00 0.00 178.83 179.11 3g4s h LEU 151 N 0.00 0.00 -3.67 1.46 5.85 -0.89 -2.66 115.31 115.39 3g4s h LEU 151 Ca 0.00 0.00 -0.24 0.00 0.84 0.00 0.00 57.88 58.48 3g4s h LEU 151 Cb 0.23 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.12 3g4s h LEU 151 CO 0.00 0.00 0.25 0.35 -0.34 0.00 0.00 178.44 178.70 3g4s n THR 152 N -2.97 2.85 -2.19 1.05 -2.24 -0.83 -4.98 114.28 104.97 3g4s n THR 152 Ca 0.01 -1.89 -0.42 0.00 -2.27 0.00 0.00 64.05 59.48 3g4s n THR 152 Cb 0.30 -0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.14 3g4s n THR 152 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3g4s s ARG 153 N -3.07 4.31 -0.22 -0.78 3.52 -1.01 -4.91 118.95 116.79 3g4s s ARG 153 Ca 0.52 2.03 0.01 0.00 -0.13 0.00 0.00 55.73 58.16 3g4s s ARG 153 Cb 0.43 -3.38 0.06 0.00 -1.56 0.00 0.00 34.95 30.50 3g4s s ARG 153 CO 0.10 -0.49 -0.06 -1.50 -0.81 0.00 0.00 175.30 172.55 3g4s s ILE 154 N 1.60 1.47 -0.05 4.11 2.07 -1.26 -4.98 121.20 124.17 3g4s s ILE 154 Ca 0.64 -1.13 0.16 0.00 -1.41 0.00 0.00 60.65 58.92 3g4s s ILE 154 Cb -0.35 -1.72 -0.25 0.00 0.13 0.00 0.00 42.46 40.28 3g4s s ILE 154 CO 0.29 -0.06 0.30 0.59 -1.91 0.00 0.00 174.94 174.16 3g4s n ASN 155 N 4.70 1.18 0.18 4.50 3.02 -1.26 -4.57 115.26 123.02 3g4s n ASN 155 Ca -0.12 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.45 3g4s n ASN 155 Cb 0.45 1.59 0.35 0.00 -0.61 0.00 0.00 39.78 41.56 3g4s n ASN 155 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 3g4s h ASP 156 N 0.00 0.00 -3.94 6.41 2.03 -2.04 -3.47 116.42 115.41 3g4s h ASP 156 Ca -0.08 0.00 -0.51 0.00 -0.73 0.00 0.00 57.03 55.71 3g4s h ASP 156 Cb 1.00 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 39.37 3g4s h ASP 156 CO 0.00 0.39 -0.52 -0.54 -1.03 0.00 0.00 179.24 177.54 3g4s s LYS 157 N -4.13 1.82 -0.17 4.15 1.02 -1.26 -5.12 119.74 116.06 3g4s s LYS 157 Ca -0.03 -2.09 -0.29 0.00 0.02 0.00 0.00 55.97 53.58 3g4s s LYS 157 Cb 0.14 -0.35 -0.02 0.00 -0.52 0.00 0.00 37.83 37.08 3g4s s LYS 157 CO 0.72 -0.49 1.33 0.34 -0.92 0.00 0.00 175.35 176.33 3g4s s ASP 158 N -3.52 6.87 0.24 2.83 2.15 -1.26 -4.92 116.67 119.06 3g4s s ASP 158 Ca 0.29 1.71 0.23 0.00 0.43 0.00 0.00 52.55 55.22 3g4s s ASP 158 Cb 0.03 -2.54 0.95 0.00 -0.30 0.00 0.00 42.92 41.07 3g4s s ASP 158 CO 0.17 -0.83 1.70 0.52 -0.17 0.00 0.00 175.17 176.57 3g4s n VAL 159 N 5.50 0.83 0.52 1.11 0.31 -1.26 -1.50 118.33 123.83 3g4s n VAL 159 Ca 0.15 0.21 0.13 0.00 -0.01 0.00 0.00 64.34 64.81 3g4s n VAL 159 Cb 0.45 -1.13 0.34 0.00 -0.91 0.00 0.00 33.84 32.59 3g4s n VAL 159 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 3g4s h ARG 160 N 0.00 0.00 0.00 5.55 3.08 -2.00 -3.28 114.38 117.73 3g4s h ARG 160 Ca 0.00 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.76 3g4s h ARG 160 Cb 0.37 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.38 3g4s h ARG 160 CO 0.00 0.00 -2.00 0.28 -1.07 0.00 0.00 179.97 177.18 3g4s n VAL 161 N -2.47 0.99 -3.14 2.04 0.31 -1.00 -4.78 118.33 110.28 3g4s n VAL 161 Ca 0.05 -0.30 -0.44 0.00 -0.01 0.00 0.00 64.34 63.63 3g4s n VAL 161 Cb 0.46 -1.49 -0.00 0.00 -0.91 0.00 0.00 33.84 31.89 3g4s n VAL 161 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3g4s s PHE 162 N -2.34 3.90 -1.68 3.52 0.40 -0.56 -4.82 117.98 116.40 3g4s s PHE 162 Ca -0.25 -2.43 0.16 0.00 -0.60 0.00 0.00 56.93 53.82 3g4s s PHE 162 Cb 0.08 -4.08 0.53 0.00 0.51 0.00 0.00 43.02 40.07 3g4s s PHE 162 CO 0.35 -1.17 1.43 1.04 0.70 0.00 0.00 175.22 177.57 3g4s n GLN 163 N 4.15 2.66 -1.97 0.44 6.02 -1.24 -4.51 117.38 122.93 3g4s n GLN 163 Ca 0.30 -2.12 -0.38 0.00 -0.01 0.00 0.00 57.00 54.79 3g4s n GLN 163 Cb 0.41 -1.57 0.02 0.00 1.02 0.00 0.00 30.24 30.11 3g4s n GLN 163 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3g4s s ASP 164 N -0.92 5.63 0.00 1.08 1.11 -1.26 -4.84 116.67 117.48 3g4s s ASP 164 Ca 0.39 2.59 0.00 0.00 0.18 0.00 0.00 52.55 55.71 3g4s s ASP 164 Cb 0.22 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.59 3g4s s ASP 164 CO 0.23 -1.31 0.00 0.61 1.18 0.00 0.00 175.17 175.88 3g4s n GLY 165 N 0.62 3.91 3.74 0.21 0.00 -0.27 -4.99 105.19 108.41 3g4s n GLY 165 Ca 0.09 -1.70 -0.40 0.00 0.00 0.00 0.00 46.02 44.00 3g4s n GLY 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g4s s VAL 166 N -2.43 4.43 0.32 1.61 1.01 -1.26 -2.72 120.40 121.36 3g4s s VAL 166 Ca 0.00 1.97 0.08 0.00 0.00 0.00 0.00 61.98 64.02 3g4s s VAL 166 Cb 0.00 -4.27 -0.06 0.00 0.00 0.00 0.00 36.38 32.05 3g4s s VAL 166 CO 0.00 0.39 -0.06 -0.31 0.00 0.00 0.00 175.10 175.11 3g4s s TYR 167 N -0.40 2.17 -0.07 5.22 1.51 -1.20 -4.29 117.35 120.30 3g4s s TYR 167 Ca 0.43 -0.63 -0.20 0.00 -1.01 0.00 0.00 57.07 55.66 3g4s s TYR 167 Cb -0.23 -1.27 -0.04 0.00 -0.11 0.00 0.00 41.96 40.31 3g4s s TYR 167 CO 0.29 0.40 0.57 0.42 -1.11 0.00 0.00 175.55 176.12 3g4s s ILE 168 N -2.84 5.06 -0.16 2.71 -1.09 -1.26 -2.71 121.20 120.91 3g4s s ILE 168 Ca 0.31 1.17 -0.08 0.00 -2.23 0.00 0.00 60.65 59.82 3g4s s ILE 168 Cb 0.04 -3.91 -0.07 0.00 -1.58 0.00 0.00 42.46 36.94 3g4s s ILE 168 CO 0.14 0.34 -0.21 0.41 -1.23 0.00 0.00 174.94 174.39 3g4s n THR 169 N 3.37 0.89 -4.00 2.92 -1.04 0.14 -4.94 114.28 111.62 3g4s n THR 169 Ca -0.06 -0.23 -0.35 0.00 -2.04 0.00 0.00 64.05 61.38 3g4s n THR 169 Cb 0.51 -1.72 -0.14 0.00 -1.82 0.00 0.00 70.33 67.17 3g4s n THR 169 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3g4s s ARG 170 N -2.30 3.40 -0.19 -2.82 0.52 -0.89 -4.95 118.95 111.72 3g4s s ARG 170 Ca -0.23 -0.62 -0.04 0.00 -0.52 0.00 0.00 55.73 54.33 3g4s s ARG 170 Cb 0.09 -2.98 -0.02 0.00 0.52 0.00 0.00 34.95 32.56 3g4s s ARG 170 CO 0.29 -0.14 -0.04 0.15 0.02 0.00 0.00 175.30 175.57 3g4s s LYS 171 N 1.33 3.50 0.00 3.54 1.02 -1.26 -1.89 119.74 125.99 3g4s s LYS 171 Ca 0.04 -0.59 0.25 0.00 0.02 0.00 0.00 55.97 55.69 3g4s s LYS 171 Cb -0.14 -2.95 1.49 0.00 -0.52 0.00 0.00 37.83 35.70 3g4s s LYS 171 CO -0.02 0.01 1.85 -0.35 -0.92 0.00 0.00 175.35 175.92