#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yr7 n MET 1 N 0.00 -0.00 -4.07 -1.46 2.00 -1.21 -3.50 117.12 108.88 1yr7 n MET 1 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 57.70 57.37 1yr7 n MET 1 Cb 0.00 -0.43 -0.15 0.00 0.00 0.00 0.00 33.22 32.63 1yr7 n MET 1 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 1yr7 s ILE 2 N 0.00 2.38 -0.11 2.02 1.01 -1.26 -0.37 121.20 124.87 1yr7 s ILE 2 Ca 0.00 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1yr7 s ILE 2 Cb 0.00 -2.05 -0.01 0.00 0.01 0.00 0.00 42.46 40.41 1yr7 s ILE 2 CO 0.00 0.47 -0.16 -0.69 0.00 0.00 0.00 174.94 174.56 1yr7 s VAL 3 N 1.32 2.84 -0.20 2.92 1.01 -0.42 -0.42 120.40 127.44 1yr7 s VAL 3 Ca 0.04 -0.75 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 1yr7 s VAL 3 Cb -0.14 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.10 1yr7 s VAL 3 CO -0.10 0.54 -0.13 -0.69 0.00 0.00 0.00 175.10 174.73 1yr7 s VAL 4 N 0.12 2.62 -0.17 2.92 1.01 0.22 -0.58 120.40 126.54 1yr7 s VAL 4 Ca -0.08 -0.82 -0.17 0.00 0.00 0.00 0.00 61.98 60.92 1yr7 s VAL 4 Cb -0.15 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1yr7 s VAL 4 CO 0.05 0.44 0.44 -0.36 0.00 0.00 0.00 175.10 175.67 1yr7 s PHE 5 N 1.35 3.43 -0.02 5.22 0.08 -0.44 0.27 117.98 127.88 1yr7 s PHE 5 Ca 0.04 0.74 0.01 0.00 0.12 0.00 0.00 56.93 57.85 1yr7 s PHE 5 Cb -0.14 -2.54 0.01 0.00 -0.57 0.00 0.00 43.02 39.78 1yr7 s PHE 5 CO -0.08 0.07 -0.04 0.08 -0.10 0.00 0.00 175.22 175.14 1yr7 s VAL 6 N 1.02 0.40 0.00 -0.44 1.01 -0.33 -3.69 120.40 118.37 1yr7 s VAL 6 Ca 0.22 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.06 1yr7 s VAL 6 Cb -0.15 -0.39 0.00 0.00 0.00 0.00 0.00 36.38 35.84 1yr7 s VAL 6 CO 0.08 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.95 1yr7 n GLY 7 N 3.45 1.26 3.78 4.51 0.00 -1.26 -0.92 105.19 116.00 1yr7 n GLY 7 Ca -0.19 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.73 1yr7 n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1yr7 s THR 8 N -2.00 3.32 0.21 2.61 -1.32 -1.26 -3.83 115.64 113.37 1yr7 s THR 8 Ca 0.00 0.65 -0.32 0.00 -1.21 0.00 0.00 61.69 60.81 1yr7 s THR 8 Cb 0.00 -3.18 -0.15 0.00 -1.51 0.00 0.00 72.50 67.66 1yr7 s THR 8 CO 0.00 -0.34 1.20 0.00 -2.21 0.00 0.00 174.62 173.27 1yr7 n ALA 9 N -2.16 -0.20 0.00 11.08 0.00 -0.81 -1.25 120.51 127.17 1yr7 n ALA 9 Ca 0.10 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1yr7 n ALA 9 Cb 0.52 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.88 1yr7 n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yr7 n GLY 10 N 1.91 3.15 0.32 0.00 0.00 -1.26 -4.90 105.19 104.41 1yr7 n GLY 10 Ca 0.13 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.35 1yr7 n GLY 10 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yr7 h SER 11 N 0.00 0.00 0.00 1.61 4.64 -1.52 -3.46 113.55 114.82 1yr7 h SER 11 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yr7 h SER 11 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1yr7 h SER 11 CO 0.00 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1yr7 n GLY 12 N -1.02 1.76 0.13 -0.77 0.00 -1.26 -4.75 105.19 99.28 1yr7 n GLY 12 Ca -0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 1yr7 n GLY 12 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yr7 h LYS 13 N 0.00 -0.13 -0.29 1.61 1.57 -1.88 -1.32 116.57 116.13 1yr7 h LYS 13 Ca 0.00 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1yr7 h LYS 13 Cb 0.00 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1yr7 h LYS 13 CO 0.00 -0.09 0.17 1.15 -0.57 0.00 0.00 179.45 180.11 1yr7 h THR 14 N -0.14 1.11 -0.83 -0.16 2.02 -1.95 0.25 112.91 113.22 1yr7 h THR 14 Ca 0.05 -0.28 0.02 0.00 0.77 0.00 0.00 66.41 66.97 1yr7 h THR 14 Cb 0.20 0.78 -0.05 0.00 -1.74 0.00 0.00 68.15 67.34 1yr7 h THR 14 CO -0.11 0.11 0.54 0.74 0.37 0.00 0.00 175.52 177.17 1yr7 h THR 15 N 0.36 1.17 -0.01 3.16 2.02 -1.96 -2.22 112.91 115.43 1yr7 h THR 15 Ca 0.10 -0.37 -0.14 0.00 0.77 0.00 0.00 66.41 66.77 1yr7 h THR 15 Cb 0.03 -0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.42 1yr7 h THR 15 CO -0.02 0.20 -0.66 0.25 0.37 0.00 0.00 175.52 175.66 1yr7 h LEU 16 N 1.08 0.07 0.22 2.58 5.85 -0.97 -1.60 115.31 122.55 1yr7 h LEU 16 Ca 0.32 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 1yr7 h LEU 16 Cb -0.06 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 40.95 1yr7 h LEU 16 CO -0.09 0.71 -0.11 0.74 -0.34 0.00 0.00 178.44 179.35 1yr7 h THR 17 N 0.04 0.83 -0.01 1.05 2.02 -0.56 0.03 112.91 116.31 1yr7 h THR 17 Ca -0.01 -0.30 0.02 0.00 0.77 0.00 0.00 66.41 66.89 1yr7 h THR 17 Cb 1.17 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.57 1yr7 h THR 17 CO 0.09 0.07 -0.08 1.23 0.37 0.00 0.00 175.52 177.20 1yr7 h GLY 18 N -0.45 -0.08 0.79 2.16 0.00 -1.35 -1.52 103.07 102.62 1yr7 h GLY 18 Ca -0.03 0.10 -0.12 0.00 0.00 0.00 0.00 47.33 47.28 1yr7 h GLY 18 CO 0.05 -0.09 -0.39 -2.09 0.00 0.00 0.00 176.54 174.02 1yr7 h GLU 19 N -0.14 0.44 -0.25 4.80 4.57 -1.30 -0.97 114.58 121.73 1yr7 h GLU 19 Ca 0.04 -0.34 -0.02 0.00 -1.18 0.00 0.00 59.36 57.85 1yr7 h GLU 19 Cb 0.18 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 1yr7 h GLU 19 CO -0.09 0.97 0.08 0.35 -1.18 0.00 0.00 179.01 179.14 1yr7 h PHE 20 N 0.01 0.35 0.75 0.92 3.57 -1.06 0.25 116.94 121.73 1yr7 h PHE 20 Ca -0.02 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 1yr7 h PHE 20 Cb 1.03 -0.11 0.01 0.00 2.79 0.00 0.00 35.95 39.67 1yr7 h PHE 20 CO 0.12 0.30 -0.36 0.78 -2.23 0.00 0.00 178.31 176.92 1yr7 h GLY 21 N 0.53 -1.04 0.06 2.40 0.00 -0.95 -0.58 103.07 103.49 1yr7 h GLY 21 Ca 0.09 0.39 0.15 0.00 0.00 0.00 0.00 47.33 47.95 1yr7 h GLY 21 CO -0.01 -0.38 0.23 3.21 0.00 0.00 0.00 176.54 179.59 1yr7 h ARG 22 N -1.08 0.33 -0.53 4.80 3.08 -0.93 0.21 114.38 120.26 1yr7 h ARG 22 Ca -0.10 -0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.03 1yr7 h ARG 22 Cb 0.78 -0.07 -0.09 0.00 0.08 0.00 0.00 29.97 30.67 1yr7 h ARG 22 CO 0.17 0.22 0.01 -0.92 -1.07 0.00 0.00 179.97 178.38 1yr7 h TYR 23 N 0.34 -0.01 0.00 3.04 3.20 -0.75 -2.62 116.97 120.17 1yr7 h TYR 23 Ca 0.40 0.04 -0.11 0.00 3.14 0.00 0.00 58.73 62.20 1yr7 h TYR 23 Cb 0.64 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 1yr7 h TYR 23 CO -0.22 -0.11 -0.52 -0.07 -1.64 0.00 0.00 178.16 175.60 1yr7 h LEU 24 N 0.13 0.00 -3.23 2.82 3.38 0.74 -3.25 115.31 115.90 1yr7 h LEU 24 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1yr7 h LEU 24 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1yr7 h LEU 24 CO -0.43 0.52 0.00 -0.62 0.09 0.00 0.00 178.44 178.00 1yr7 n GLU 25 N -3.51 0.62 -0.00 1.13 1.02 0.49 -1.41 120.64 118.98 1yr7 n GLU 25 Ca -0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1yr7 n GLU 25 Cb 0.62 -1.19 -0.01 0.00 -0.02 0.00 0.00 31.44 30.85 1yr7 n GLU 25 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1yr7 n ASP 26 N 1.58 4.85 0.00 1.62 8.00 -1.23 -4.78 116.55 126.59 1yr7 n ASP 26 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1yr7 n ASP 26 Cb 0.31 0.83 0.00 0.00 -0.02 0.00 0.00 41.12 42.24 1yr7 n ASP 26 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1yr7 n ASN 27 N -1.72 0.35 -3.95 -2.24 4.13 -0.85 -5.12 115.26 105.86 1yr7 n ASN 27 Ca -0.00 -0.99 -0.09 0.00 1.68 0.00 0.00 54.58 55.17 1yr7 n ASN 27 Cb 0.22 0.00 -0.08 0.00 -1.54 0.00 0.00 39.78 38.38 1yr7 n ASN 27 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1yr7 s TYR 28 N -0.00 0.36 -0.24 3.10 1.51 -0.50 -5.13 117.35 116.45 1yr7 s TYR 28 Ca 0.00 -0.77 -0.22 0.00 -1.01 0.00 0.00 57.07 55.07 1yr7 s TYR 28 Cb 0.00 -0.14 -0.01 0.00 -0.11 0.00 0.00 41.96 41.69 1yr7 s TYR 28 CO 0.00 -0.58 0.72 0.21 -1.11 0.00 0.00 175.55 174.79 1yr7 s LYS 29 N -3.93 4.17 -0.06 -0.62 2.36 -1.26 -4.41 119.74 115.99 1yr7 s LYS 29 Ca 0.12 0.75 0.05 0.00 -2.55 0.00 0.00 55.97 54.33 1yr7 s LYS 29 Cb 0.05 -3.63 -0.00 0.00 -1.05 0.00 0.00 37.83 33.19 1yr7 s LYS 29 CO -0.06 -0.43 -0.21 0.08 1.55 0.00 0.00 175.35 176.29 1yr7 s VAL 30 N 2.54 1.75 0.07 4.02 1.01 -1.26 -0.45 120.40 128.08 1yr7 s VAL 30 Ca 0.31 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.49 1yr7 s VAL 30 Cb -0.16 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 1yr7 s VAL 30 CO 0.08 0.49 -0.19 0.00 0.00 0.00 0.00 175.10 175.49 1yr7 s ALA 31 N 0.08 2.60 -0.05 5.51 0.00 0.18 -4.97 121.76 125.11 1yr7 s ALA 31 Ca -0.07 -1.26 0.02 0.00 0.00 0.00 0.00 51.96 50.65 1yr7 s ALA 31 Cb -0.14 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 1yr7 s ALA 31 CO 0.04 0.58 -0.10 0.71 0.00 0.00 0.00 175.76 176.98 1yr7 s TYR 32 N -1.00 2.82 -0.18 0.00 2.02 -1.26 -0.40 117.35 119.35 1yr7 s TYR 32 Ca 0.16 -0.07 -0.01 0.00 -0.37 0.00 0.00 57.07 56.78 1yr7 s TYR 32 Cb -0.10 -1.66 0.05 0.00 -0.40 0.00 0.00 41.96 39.85 1yr7 s TYR 32 CO 0.07 0.27 -0.02 0.08 -1.57 0.00 0.00 175.55 174.38 1yr7 s VAL 33 N -0.80 0.97 -0.35 0.71 1.01 -0.17 -1.51 120.40 120.25 1yr7 s VAL 33 Ca 0.13 -0.66 -0.17 0.00 0.00 0.00 0.00 61.98 61.27 1yr7 s VAL 33 Cb -0.11 -1.25 -0.00 0.00 0.00 0.00 0.00 36.38 35.01 1yr7 s VAL 33 CO 0.02 0.01 0.45 0.21 0.00 0.00 0.00 175.10 175.79 1yr7 s ASN 34 N 1.68 6.26 0.00 3.32 3.04 0.44 -0.11 114.94 129.56 1yr7 s ASN 34 Ca -0.01 -0.15 0.23 0.00 0.04 0.00 0.00 52.86 52.97 1yr7 s ASN 34 Cb -0.16 -2.24 0.49 0.00 -1.54 0.00 0.00 41.25 37.80 1yr7 s ASN 34 CO -0.07 -0.44 1.44 0.18 -3.04 0.00 0.00 177.10 175.17 1yr7 n LEU 35 N 5.61 3.35 -4.57 3.21 4.77 -0.02 -2.06 117.00 127.28 1yr7 n LEU 35 Ca -0.06 -1.49 -0.42 0.00 -0.03 0.00 0.00 56.01 54.01 1yr7 n LEU 35 Cb 0.49 -0.28 -0.07 0.00 -2.33 0.00 0.00 43.42 41.23 1yr7 n LEU 35 CO 0.43 0.74 0.35 -0.62 -1.33 0.00 0.00 177.39 176.97 1yr7 s ASP 36 N -1.41 6.40 0.20 -1.43 2.15 -1.26 -4.22 116.67 117.11 1yr7 s ASP 36 Ca 0.40 0.11 0.09 0.00 0.43 0.00 0.00 52.55 53.58 1yr7 s ASP 36 Cb 0.23 -2.31 0.07 0.00 -0.30 0.00 0.00 42.92 40.60 1yr7 s ASP 36 CO 0.31 -0.57 1.44 0.71 -0.17 0.00 0.00 175.17 176.90 1yr7 h THR 37 N 5.66 1.57 -0.91 1.71 1.35 -1.90 -3.33 112.91 117.06 1yr7 h THR 37 Ca -0.27 -2.78 -0.56 0.00 -0.55 0.00 0.00 66.41 62.25 1yr7 h THR 37 Cb 1.11 2.50 -0.29 0.00 -1.73 0.00 0.00 68.15 69.75 1yr7 h THR 37 CO 0.82 0.79 0.56 0.61 -0.25 0.00 0.00 175.52 178.06 1yr7 n GLY 38 N 0.82 5.31 3.73 5.82 0.00 -1.26 -3.19 105.19 116.42 1yr7 n GLY 38 Ca -0.01 -1.77 -0.32 0.00 0.00 0.00 0.00 46.02 43.92 1yr7 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yr7 s VAL 39 N -4.08 4.43 -0.13 1.61 0.11 -1.25 -4.93 120.40 116.17 1yr7 s VAL 39 Ca 0.59 -0.55 -0.06 0.00 -2.93 0.00 0.00 61.98 59.03 1yr7 s VAL 39 Cb 0.48 -3.02 -0.02 0.00 -1.53 0.00 0.00 36.38 32.29 1yr7 s VAL 39 CO 0.04 0.33 -0.12 0.50 -3.33 0.00 0.00 175.10 172.52 1yr7 h LYS 40 N 4.10 0.00 -4.42 1.54 1.63 -1.94 -3.49 116.57 113.99 1yr7 h LYS 40 Ca -0.49 0.00 -0.31 0.00 -0.85 0.00 0.00 60.65 59.00 1yr7 h LYS 40 Cb 1.18 0.00 -0.26 0.00 -0.60 0.00 0.00 32.23 32.55 1yr7 h LYS 40 CO 0.60 0.00 -0.75 -1.83 -3.45 0.00 0.00 179.45 174.02 1yr7 s GLU 41 N -2.02 0.48 -0.02 1.90 -1.05 -1.26 -5.15 118.70 111.57 1yr7 s GLU 41 Ca -0.10 -0.37 0.06 0.00 -0.15 0.00 0.00 54.97 54.40 1yr7 s GLU 41 Cb 0.01 -0.40 -0.03 0.00 -0.44 0.00 0.00 34.13 33.28 1yr7 s GLU 41 CO 0.15 0.10 -0.19 -0.51 0.95 0.00 0.00 175.26 175.76 1yr7 s LEU 42 N -0.58 2.49 0.00 1.83 1.43 -1.26 -5.00 118.68 117.60 1yr7 s LEU 42 Ca -0.01 -0.33 0.16 0.00 -1.03 0.00 0.00 54.13 52.92 1yr7 s LEU 42 Cb -0.05 -1.48 0.55 0.00 0.03 0.00 0.00 46.19 45.25 1yr7 s LEU 42 CO 0.00 0.32 1.42 -0.81 0.23 0.00 0.00 176.35 177.51 1yr7 n PRO 43 N 2.19 1.79 -4.45 1.29 -0.04 -1.26 -4.83 135.00 129.69 1yr7 n PRO 43 Ca -0.17 -1.20 -0.22 0.00 -0.04 0.00 0.00 63.50 61.87 1yr7 n PRO 43 Cb 0.52 -1.34 -0.10 0.00 -0.04 0.00 0.00 33.50 32.53 1yr7 n PRO 43 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1yr7 s TYR 44 N -1.66 1.90 -0.30 0.54 -0.85 -1.26 -4.87 117.35 110.85 1yr7 s TYR 44 Ca 0.29 -1.02 -0.07 0.00 -0.52 0.00 0.00 57.07 55.75 1yr7 s TYR 44 Cb 0.15 -1.24 0.01 0.00 0.38 0.00 0.00 41.96 41.27 1yr7 s TYR 44 CO 0.22 -0.06 0.09 -2.00 -1.52 0.00 0.00 175.55 172.28 1yr7 s GLU 45 N -3.88 3.03 0.16 -3.49 2.12 -1.26 -5.08 118.70 110.30 1yr7 s GLU 45 Ca 0.35 -0.90 -0.23 0.00 0.36 0.00 0.00 54.97 54.54 1yr7 s GLU 45 Cb 0.08 -3.41 -0.08 0.00 0.26 0.00 0.00 34.13 30.98 1yr7 s GLU 45 CO 0.15 -0.48 0.74 -1.25 -0.54 0.00 0.00 175.26 173.88 1yr7 s PRO 46 N 1.49 4.46 0.15 4.30 0.04 -1.26 -4.49 135.00 139.69 1yr7 s PRO 46 Ca 0.02 1.05 0.03 0.00 0.04 0.00 0.00 61.00 62.14 1yr7 s PRO 46 Cb -0.18 -3.19 -0.08 0.00 0.04 0.00 0.00 34.50 31.09 1yr7 s PRO 46 CO 0.03 0.55 1.33 0.77 0.04 0.00 0.00 177.00 179.72 1yr7 h SER 47 N 4.21 0.22 -3.14 6.66 0.02 -1.66 -3.44 113.55 116.41 1yr7 h SER 47 Ca -0.48 -0.19 -0.62 0.00 -0.84 0.00 0.00 61.79 59.66 1yr7 h SER 47 Cb 1.21 -0.07 -0.35 0.00 0.14 0.00 0.00 62.40 63.33 1yr7 h SER 47 CO 0.65 1.04 -0.84 -0.63 -1.14 0.00 0.00 176.83 175.91 1yr7 s ILE 48 N -3.04 1.73 -0.23 3.27 1.01 -1.17 -5.07 121.20 117.71 1yr7 s ILE 48 Ca -0.02 -0.75 -0.00 0.00 0.00 0.00 0.00 60.65 59.88 1yr7 s ILE 48 Cb 0.10 -1.59 0.06 0.00 0.01 0.00 0.00 42.46 41.04 1yr7 s ILE 48 CO 0.83 0.49 -0.03 -0.62 0.00 0.00 0.00 174.94 175.61 1yr7 s ASP 49 N 1.27 3.65 0.00 3.58 -1.08 -1.26 -0.42 116.67 122.40 1yr7 s ASP 49 Ca 0.01 -1.12 0.12 0.00 -0.52 0.00 0.00 52.55 51.05 1yr7 s ASP 49 Cb -0.14 -1.04 0.60 0.00 -1.46 0.00 0.00 42.92 40.89 1yr7 s ASP 49 CO -0.09 -0.26 1.31 1.33 0.52 0.00 0.00 175.17 177.99 1yr7 n VAL 50 N 4.76 0.75 0.47 1.11 0.24 -0.88 -2.21 118.33 122.57 1yr7 n VAL 50 Ca -0.11 0.19 0.13 0.00 -2.04 0.00 0.00 64.34 62.51 1yr7 n VAL 50 Cb 0.45 -0.98 0.46 0.00 -1.47 0.00 0.00 33.84 32.30 1yr7 n VAL 50 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1yr7 h ARG 51 N 0.00 0.00 0.00 7.34 3.08 -1.81 -2.44 114.38 120.55 1yr7 h ARG 51 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1yr7 h ARG 51 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1yr7 h ARG 51 CO 0.00 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.29 1yr7 n GLU 52 N -2.33 0.27 -0.03 0.04 -0.58 -0.94 -3.74 120.64 113.32 1yr7 n GLU 52 Ca 0.03 0.09 -0.06 0.00 -0.42 0.00 0.00 57.16 56.80 1yr7 n GLU 52 Cb 0.32 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.66 1yr7 n GLU 52 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1yr7 n PHE 53 N -1.31 0.00 -3.64 -0.32 7.35 -0.94 -5.08 117.46 113.53 1yr7 n PHE 53 Ca 0.10 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.66 1yr7 n PHE 53 Cb 0.18 -0.25 -0.06 0.00 0.35 0.00 0.00 39.48 39.71 1yr7 n PHE 53 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1yr7 s VAL 54 N -2.13 0.05 0.04 -2.13 0.11 -1.09 -5.09 120.40 110.16 1yr7 s VAL 54 Ca -0.09 -0.45 0.00 0.00 -2.93 0.00 0.00 61.98 58.51 1yr7 s VAL 54 Cb 0.03 -1.01 -0.03 0.00 -1.53 0.00 0.00 36.38 33.84 1yr7 s VAL 54 CO 0.13 -0.25 -0.04 0.42 -3.33 0.00 0.00 175.10 172.04 1yr7 s THR 55 N -2.82 0.24 0.07 5.04 -4.23 -1.26 -3.99 115.64 108.69 1yr7 s THR 55 Ca -0.03 -1.31 -0.27 0.00 -1.18 0.00 0.00 61.69 58.89 1yr7 s THR 55 Cb -0.00 -0.84 -0.13 0.00 1.34 0.00 0.00 72.50 72.88 1yr7 s THR 55 CO -0.05 -0.69 1.43 0.58 -0.54 0.00 0.00 174.62 175.35 1yr7 h VAL 56 N 3.99 0.00 -0.79 2.29 2.07 -1.82 -2.76 116.25 119.22 1yr7 h VAL 56 Ca -0.33 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.22 1yr7 h VAL 56 Cb 1.18 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 1yr7 h VAL 56 CO 0.51 0.00 0.52 1.05 0.02 0.00 0.00 177.57 179.68 1yr7 h GLU 57 N -0.70 0.96 -0.72 1.57 9.09 -1.93 0.28 114.58 123.13 1yr7 h GLU 57 Ca -0.03 -0.06 0.04 0.00 0.05 0.00 0.00 59.36 59.36 1yr7 h GLU 57 Cb 0.64 -0.22 -0.05 0.00 -1.65 0.00 0.00 28.75 27.48 1yr7 h GLU 57 CO -0.11 0.64 0.44 1.49 0.05 0.00 0.00 179.01 181.51 1yr7 h GLU 58 N 0.99 0.82 0.00 1.06 4.81 -1.97 -1.02 114.58 119.27 1yr7 h GLU 58 Ca 0.31 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.42 1yr7 h GLU 58 Cb 0.02 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 1yr7 h GLU 58 CO -0.09 0.54 -0.33 0.82 -0.73 0.00 0.00 179.01 179.23 1yr7 h ILE 59 N 0.85 0.99 0.00 2.32 2.04 -0.71 -2.86 117.51 120.14 1yr7 h ILE 59 Ca 0.30 -1.23 -0.05 0.00 1.00 0.00 0.00 64.86 64.87 1yr7 h ILE 59 Cb 0.07 1.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1yr7 h ILE 59 CO -0.13 0.32 -0.26 0.24 0.00 0.00 0.00 178.15 178.33 1yr7 h MET 60 N 0.00 0.00 -1.01 2.37 2.86 0.15 -2.25 114.93 117.05 1yr7 h MET 60 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1yr7 h MET 60 Cb 0.69 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.35 1yr7 h MET 60 CO 0.04 0.26 0.00 0.54 1.06 0.00 0.00 176.91 178.81 1yr7 n ARG 61 N -3.45 0.83 0.00 1.72 1.74 -0.83 -2.02 116.66 114.63 1yr7 n ARG 61 Ca -0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1yr7 n ARG 61 Cb 0.44 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.63 1yr7 n ARG 61 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1yr7 n GLU 62 N 0.35 0.94 0.00 5.56 1.02 -0.85 -4.98 120.64 122.68 1yr7 n GLU 62 Ca 0.00 -0.89 0.00 0.00 -0.02 0.00 0.00 57.16 56.25 1yr7 n GLU 62 Cb 0.31 -0.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 1yr7 n GLU 62 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yr7 n GLY 63 N -0.22 0.94 3.74 0.62 0.00 -0.86 -5.08 105.19 104.34 1yr7 n GLY 63 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1yr7 n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yr7 s TYR 64 N -2.00 3.93 0.76 1.61 2.02 -1.22 -5.06 117.35 117.39 1yr7 s TYR 64 Ca 0.00 1.88 -0.11 0.00 -0.37 0.00 0.00 57.07 58.47 1yr7 s TYR 64 Cb 0.00 -3.01 0.05 0.00 -0.40 0.00 0.00 41.96 38.60 1yr7 s TYR 64 CO 0.00 0.36 1.09 0.20 -1.57 0.00 0.00 175.55 175.63 1yr7 s GLY 65 N -0.83 1.70 0.17 0.71 0.00 -1.26 -4.63 107.32 103.18 1yr7 s GLY 65 Ca 0.43 0.28 -0.15 0.00 0.00 0.00 0.00 44.72 45.28 1yr7 s GLY 65 CO 0.32 0.62 1.73 -0.56 0.00 0.00 0.00 173.10 175.21 1yr7 h PRO 66 N -1.05 0.25 0.00 2.90 0.13 -1.98 0.15 132.00 132.40 1yr7 h PRO 66 Ca -0.44 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1yr7 h PRO 66 Cb 1.23 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1yr7 h PRO 66 CO 0.52 0.16 0.00 0.09 -0.23 0.00 0.00 178.00 178.54 1yr7 n ASN 67 N -5.07 0.42 0.03 1.44 3.02 -1.26 -1.79 115.26 112.06 1yr7 n ASN 67 Ca 0.03 0.59 -0.22 0.00 -0.03 0.00 0.00 54.58 54.96 1yr7 n ASN 67 Cb 0.18 -0.69 -0.14 0.00 -0.61 0.00 0.00 39.78 38.53 1yr7 n ASN 67 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1yr7 h GLY 68 N 2.80 0.35 1.98 7.41 0.00 -1.18 -3.26 103.07 111.17 1yr7 h GLY 68 Ca 0.00 -0.89 -0.13 0.00 0.00 0.00 0.00 47.33 46.31 1yr7 h GLY 68 CO 0.00 0.78 -0.60 0.00 0.00 0.00 0.00 176.54 176.72 1yr7 h ALA 69 N 0.12 0.99 0.74 3.60 0.00 -0.56 0.09 119.26 124.23 1yr7 h ALA 69 Ca -0.39 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 53.93 1yr7 h ALA 69 Cb 2.06 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.76 1yr7 h ALA 69 CO 0.12 0.75 -0.35 0.82 0.00 0.00 0.00 179.25 180.59 1yr7 h ILE 70 N 0.02 0.00 -0.51 0.00 1.08 -1.52 -0.43 117.51 116.14 1yr7 h ILE 70 Ca -0.01 -0.06 0.08 0.00 -0.39 0.00 0.00 64.86 64.48 1yr7 h ILE 70 Cb 1.07 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.76 1yr7 h ILE 70 CO 0.08 0.00 0.15 0.58 -0.69 0.00 0.00 178.15 178.28 1yr7 h VAL 71 N -1.05 0.78 -0.01 1.67 2.07 -1.60 0.25 116.25 118.35 1yr7 h VAL 71 Ca -0.10 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1yr7 h VAL 71 Cb 0.76 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1yr7 h VAL 71 CO 0.17 0.06 -0.01 -0.33 0.02 0.00 0.00 177.57 177.47 1yr7 h GLU 72 N 0.32 0.02 -0.08 1.57 4.39 -0.99 -2.29 114.58 117.51 1yr7 h GLU 72 Ca 0.25 -0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.86 1yr7 h GLU 72 Cb 0.31 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1yr7 h GLU 72 CO -0.29 0.03 -0.36 0.66 -1.16 0.00 0.00 179.01 177.90 1yr7 h SER 73 N 0.02 0.17 0.84 1.42 4.64 0.82 -2.25 113.55 119.21 1yr7 h SER 73 Ca 0.00 -0.06 -0.17 0.00 -0.47 0.00 0.00 61.79 61.09 1yr7 h SER 73 Cb 0.04 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.05 1yr7 h SER 73 CO 0.00 0.52 -1.25 1.88 -0.87 0.00 0.00 176.83 177.11 1yr7 h TYR 74 N 0.14 0.00 -0.74 4.77 0.05 -1.24 -2.12 116.97 117.83 1yr7 h TYR 74 Ca 0.02 0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.84 1yr7 h TYR 74 Cb 0.70 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.39 1yr7 h TYR 74 CO 0.01 0.64 0.45 -0.44 -1.05 0.00 0.00 178.16 177.77 1yr7 h ASP 75 N 0.00 0.72 0.15 3.88 3.32 -1.34 -3.04 116.42 120.11 1yr7 h ASP 75 Ca -0.14 0.01 -0.17 0.00 0.02 0.00 0.00 57.03 56.76 1yr7 h ASP 75 Cb 1.61 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 41.01 1yr7 h ASP 75 CO 0.06 0.49 -0.61 0.03 -1.72 0.00 0.00 179.24 177.48 1yr7 h ARG 76 N 0.86 0.46 0.00 3.56 3.08 -1.29 -2.95 114.38 118.10 1yr7 h ARG 76 Ca 0.31 -0.32 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1yr7 h ARG 76 Cb 0.09 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 1yr7 h ARG 76 CO -0.14 0.93 -0.02 -0.07 -1.07 0.00 0.00 179.97 179.60 1yr7 h LEU 77 N 0.34 0.00 -2.28 3.04 3.38 -1.27 -1.44 115.31 117.08 1yr7 h LEU 77 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1yr7 h LEU 77 Cb 1.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1yr7 h LEU 77 CO 0.11 0.02 -0.04 0.24 0.09 0.00 0.00 178.44 178.86 1yr7 h MET 78 N 0.00 0.00 -0.16 1.13 2.86 -1.43 0.43 114.93 117.76 1yr7 h MET 78 Ca -0.00 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.69 1yr7 h MET 78 Cb 0.06 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1yr7 h MET 78 CO 0.00 0.04 0.16 0.93 1.06 0.00 0.00 176.91 179.10 1yr7 h GLU 79 N 0.00 0.00 -0.29 1.72 5.08 -1.44 -1.38 114.58 118.27 1yr7 h GLU 79 Ca -0.00 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 1yr7 h GLU 79 Cb 0.10 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.26 1yr7 h GLU 79 CO 0.01 0.00 -0.20 1.63 -1.00 0.00 0.00 179.01 179.45 1yr7 n LYS 80 N -3.90 1.84 0.45 2.33 4.76 0.12 -4.81 118.16 118.95 1yr7 n LYS 80 Ca 0.01 -3.26 -0.19 0.00 -2.87 0.00 0.00 58.31 52.00 1yr7 n LYS 80 Cb 0.28 -1.79 -0.09 0.00 -1.84 0.00 0.00 35.03 31.59 1yr7 n LYS 80 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 1yr7 h PHE 81 N 1.05 -1.18 -0.39 2.13 3.57 -1.07 -1.26 116.94 119.80 1yr7 h PHE 81 Ca 0.18 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 1yr7 h PHE 81 Cb 1.50 0.41 -0.02 0.00 2.79 0.00 0.00 35.95 40.62 1yr7 h PHE 81 CO 0.99 -0.70 0.19 -0.97 -2.23 0.00 0.00 178.31 175.59 1yr7 h ASN 82 N -1.19 0.47 -0.02 0.41 -0.73 -1.87 -1.02 115.58 111.63 1yr7 h ASN 82 Ca -0.11 -0.03 -0.00 0.00 1.87 0.00 0.00 56.30 58.02 1yr7 h ASN 82 Cb 0.93 -0.12 -0.00 0.00 0.27 0.00 0.00 38.32 39.40 1yr7 h ASN 82 CO 0.16 0.40 0.00 -0.08 -0.37 0.00 0.00 177.43 177.54 1yr7 h GLU 83 N 0.54 0.03 -0.57 6.67 4.81 -1.87 -1.59 114.58 122.61 1yr7 h GLU 83 Ca 0.14 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1yr7 h GLU 83 Cb 0.05 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1yr7 h GLU 83 CO -0.02 0.28 0.06 1.88 -0.73 0.00 0.00 179.01 180.49 1yr7 h TYR 84 N -0.22 0.99 -0.08 0.92 0.05 -1.02 -1.52 116.97 116.09 1yr7 h TYR 84 Ca 0.01 -0.13 0.01 0.00 0.05 0.00 0.00 58.73 58.67 1yr7 h TYR 84 Cb 0.26 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 37.72 1yr7 h TYR 84 CO 0.01 0.86 -0.00 1.25 -1.05 0.00 0.00 178.16 179.23 1yr7 h LEU 85 N 0.88 -0.04 -0.46 3.88 5.85 -1.09 -1.12 115.31 123.22 1yr7 h LEU 85 Ca 0.18 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.80 1yr7 h LEU 85 Cb 0.43 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1yr7 h LEU 85 CO 0.01 -0.01 -0.15 0.78 -0.34 0.00 0.00 178.44 178.73 1yr7 h ASN 86 N 0.02 0.93 -0.59 1.25 2.35 -1.10 0.02 115.58 118.47 1yr7 h ASN 86 Ca 0.04 -0.38 0.12 0.00 -0.55 0.00 0.00 56.30 55.53 1yr7 h ASN 86 Cb 0.05 -0.25 -0.10 0.00 0.05 0.00 0.00 38.32 38.06 1yr7 h ASN 86 CO -0.07 1.10 -0.04 0.11 -1.65 0.00 0.00 177.43 176.88 1yr7 h LYS 87 N 0.75 0.08 -0.51 0.81 1.57 -1.21 0.22 116.57 118.28 1yr7 h LYS 87 Ca 0.11 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 1yr7 h LYS 87 Cb 0.71 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 1yr7 h LYS 87 CO 0.05 0.05 0.22 0.82 -0.57 0.00 0.00 179.45 180.02 1yr7 h ILE 88 N 0.08 1.21 0.00 1.86 2.04 -0.46 -1.00 117.51 121.24 1yr7 h ILE 88 Ca 0.30 -0.64 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 1yr7 h ILE 88 Cb 0.47 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.23 1yr7 h ILE 88 CO -0.53 0.24 -0.14 -0.07 0.00 0.00 0.00 178.15 177.65 1yr7 h LEU 89 N 0.68 0.00 -0.03 1.44 3.38 -0.33 -1.37 115.31 119.08 1yr7 h LEU 89 Ca 0.17 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1yr7 h LEU 89 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1yr7 h LEU 89 CO -0.02 0.14 -0.16 -0.09 0.09 0.00 0.00 178.44 178.40 1yr7 h ARG 90 N 0.00 0.17 -0.99 1.13 2.43 -0.53 -3.09 114.38 113.50 1yr7 h ARG 90 Ca -0.00 -0.13 0.20 0.00 -0.81 0.00 0.00 59.98 59.23 1yr7 h ARG 90 Cb 0.25 0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 29.73 1yr7 h ARG 90 CO 0.02 0.79 0.62 -0.07 -1.51 0.00 0.00 179.97 179.81 1yr7 h LEU 91 N -0.41 0.67 -1.61 3.80 3.38 -0.90 -1.71 115.31 118.53 1yr7 h LEU 91 Ca -0.01 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1yr7 h LEU 91 Cb 0.81 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1yr7 h LEU 91 CO 0.03 0.24 -0.18 -0.08 0.09 0.00 0.00 178.44 178.54 1yr7 h GLU 92 N 0.65 0.02 0.00 1.13 4.22 -1.20 -1.51 114.58 117.89 1yr7 h GLU 92 Ca 0.56 -0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.98 1yr7 h GLU 92 Cb 1.02 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 1yr7 h GLU 92 CO -0.32 0.20 -0.43 0.87 -2.18 0.00 0.00 179.01 177.15 1yr7 h LYS 93 N 0.02 0.00 -0.03 1.92 1.79 -1.25 2.31 116.57 121.33 1yr7 h LYS 93 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1yr7 h LYS 93 Cb 0.33 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.98 1yr7 h LYS 93 CO 0.02 0.04 -0.04 0.39 -1.08 0.00 0.00 179.45 178.78 1yr7 n GLU 94 N -2.95 2.19 -3.85 3.15 1.02 -0.62 -4.87 120.64 114.71 1yr7 n GLU 94 Ca 0.02 -1.78 -0.09 0.00 -0.02 0.00 0.00 57.16 55.28 1yr7 n GLU 94 Cb 0.56 -1.46 -0.07 0.00 -0.02 0.00 0.00 31.44 30.44 1yr7 n GLU 94 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1yr7 s ASN 95 N -2.04 0.09 0.15 1.62 0.01 -0.91 -4.97 114.94 108.89 1yr7 s ASN 95 Ca 0.28 -0.57 0.11 0.00 -0.71 0.00 0.00 52.86 51.97 1yr7 s ASN 95 Cb 0.20 0.33 -0.12 0.00 0.41 0.00 0.00 41.25 42.07 1yr7 s ASN 95 CO 0.33 -0.69 1.25 0.44 -1.51 0.00 0.00 177.10 176.91 1yr7 h ASP 96 N 2.92 0.00 -3.65 -1.22 3.32 -0.97 -3.19 116.42 113.63 1yr7 h ASP 96 Ca -0.33 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.35 1yr7 h ASP 96 Cb 1.20 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 40.43 1yr7 h ASP 96 CO 0.54 0.81 -0.76 -0.31 -1.72 0.00 0.00 179.24 177.80 1yr7 s TYR 97 N -2.79 0.55 -0.18 4.55 1.51 0.01 -3.33 117.35 117.67 1yr7 s TYR 97 Ca 0.01 -0.12 -0.01 0.00 -1.01 0.00 0.00 57.07 55.95 1yr7 s TYR 97 Cb 0.09 -0.47 0.00 0.00 -0.11 0.00 0.00 41.96 41.47 1yr7 s TYR 97 CO 0.80 -0.10 -0.12 0.08 -1.11 0.00 0.00 175.55 175.09 1yr7 s VAL 98 N 0.53 2.80 -0.17 0.71 1.01 0.51 0.48 120.40 126.26 1yr7 s VAL 98 Ca -0.06 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.16 1yr7 s VAL 98 Cb -0.10 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.03 1yr7 s VAL 98 CO -0.00 0.49 -0.00 -0.76 0.00 0.00 0.00 175.10 174.82 1yr7 s LEU 99 N 1.15 3.42 -0.24 3.92 1.43 0.46 -1.30 118.68 127.53 1yr7 s LEU 99 Ca 0.01 -0.07 -0.03 0.00 -1.03 0.00 0.00 54.13 53.01 1yr7 s LEU 99 Cb -0.14 -1.84 0.01 0.00 0.03 0.00 0.00 46.19 44.24 1yr7 s LEU 99 CO -0.04 0.16 -0.05 -0.63 0.23 0.00 0.00 176.35 176.02 1yr7 s ILE 100 N 0.43 3.15 -0.15 -0.59 1.01 0.26 -1.00 121.20 124.31 1yr7 s ILE 100 Ca -0.01 -0.74 -0.13 0.00 0.00 0.00 0.00 60.65 59.76 1yr7 s ILE 100 Cb -0.14 -2.51 -0.05 0.00 0.01 0.00 0.00 42.46 39.78 1yr7 s ILE 100 CO 0.02 0.31 0.27 -0.62 0.00 0.00 0.00 174.94 174.93 1yr7 s ASP 101 N 1.41 6.44 0.44 3.58 2.15 0.84 -1.33 116.67 130.19 1yr7 s ASP 101 Ca 0.03 0.51 0.08 0.00 0.43 0.00 0.00 52.55 53.60 1yr7 s ASP 101 Cb -0.15 -2.17 0.00 0.00 -0.30 0.00 0.00 42.92 40.30 1yr7 s ASP 101 CO -0.04 0.14 0.50 0.42 -0.17 0.00 0.00 175.17 176.02 1yr7 s THR 102 N 0.25 2.71 0.19 1.71 -4.23 -1.24 -0.84 115.64 114.19 1yr7 s THR 102 Ca 0.16 -1.17 -0.32 0.00 -1.18 0.00 0.00 61.69 59.18 1yr7 s THR 102 Cb -0.13 -2.89 -0.16 0.00 1.34 0.00 0.00 72.50 70.67 1yr7 s THR 102 CO 0.04 0.00 1.12 -2.65 -0.54 0.00 0.00 174.62 172.59 1yr7 n PRO 103 N -1.75 1.14 -0.24 3.99 -0.02 -1.26 -4.36 135.00 132.51 1yr7 n PRO 103 Ca 0.06 0.41 0.04 0.00 -2.02 0.00 0.00 63.50 61.99 1yr7 n PRO 103 Cb 0.61 -1.87 0.10 0.00 -0.02 0.00 0.00 33.50 32.31 1yr7 n PRO 103 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yr7 n GLY 104 N 1.90 -1.10 3.68 -1.23 0.00 -1.26 -4.08 105.19 103.10 1yr7 n GLY 104 Ca 0.14 0.71 -0.38 0.00 0.00 0.00 0.00 46.02 46.50 1yr7 n GLY 104 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yr7 s GLN 105 N -5.82 4.18 0.51 1.61 -1.52 -1.26 -1.92 119.66 115.42 1yr7 s GLN 105 Ca -0.10 0.12 0.29 0.00 -1.95 0.00 0.00 55.36 53.72 1yr7 s GLN 105 Cb 0.18 -3.52 1.21 0.00 -0.22 0.00 0.00 33.01 30.67 1yr7 s GLN 105 CO 0.52 0.03 1.94 0.00 -0.25 0.00 0.00 175.29 177.52 1yr7 h MET 106 N 7.26 0.00 0.00 2.91 -0.00 -1.71 -2.21 114.93 121.19 1yr7 h MET 106 Ca -0.37 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.28 1yr7 h MET 106 Cb 1.16 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.76 1yr7 h MET 106 CO 0.72 0.11 -0.20 1.05 -0.00 0.00 0.00 176.91 178.58 1yr7 h GLU 107 N 0.00 0.00 -0.87 -0.10 4.11 -1.92 0.22 114.58 116.02 1yr7 h GLU 107 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.41 1yr7 h GLU 107 Cb 0.58 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.79 1yr7 h GLU 107 CO 0.01 0.20 0.45 1.15 0.07 0.00 0.00 179.01 180.90 1yr7 h THR 108 N 0.00 1.26 -0.11 -1.06 2.02 -1.76 -0.25 112.91 113.01 1yr7 h THR 108 Ca -0.00 -0.67 -0.15 0.00 0.77 0.00 0.00 66.41 66.37 1yr7 h THR 108 Cb 0.56 0.11 0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1yr7 h THR 108 CO 0.03 0.30 -0.51 0.15 0.37 0.00 0.00 175.52 175.86 1yr7 h PHE 109 N 1.22 0.71 0.00 3.16 3.57 -1.11 -2.74 116.94 121.75 1yr7 h PHE 109 Ca 0.30 -0.31 -0.16 0.00 3.53 0.00 0.00 57.97 61.33 1yr7 h PHE 109 Cb 0.06 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 1yr7 h PHE 109 CO 0.01 1.09 -0.76 -0.07 -2.23 0.00 0.00 178.31 176.35 1yr7 h LEU 110 N 0.13 0.00 0.00 0.59 3.38 -0.58 -3.25 115.31 115.58 1yr7 h LEU 110 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1yr7 h LEU 110 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1yr7 h LEU 110 CO 0.11 0.74 -0.58 0.49 0.09 0.00 0.00 178.44 179.29 1yr7 n PHE 111 N -3.28 0.00 -3.76 1.13 3.72 -0.11 -4.85 117.46 110.30 1yr7 n PHE 111 Ca 0.01 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.06 1yr7 n PHE 111 Cb 0.84 -0.01 -0.05 0.00 -0.94 0.00 0.00 39.48 39.31 1yr7 n PHE 111 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1yr7 s HIS 112 N -2.11 3.57 0.37 1.38 2.46 -1.03 -5.00 115.29 114.93 1yr7 s HIS 112 Ca 0.04 0.56 0.07 0.00 0.47 0.00 0.00 55.06 56.20 1yr7 s HIS 112 Cb 0.09 -1.98 0.78 0.00 -0.13 0.00 0.00 32.58 31.33 1yr7 s HIS 112 CO 0.47 0.61 1.96 1.49 -2.47 0.00 0.00 174.74 176.81 1yr7 h GLU 113 N 3.96 0.69 0.23 2.88 4.81 -1.90 -2.75 114.58 122.50 1yr7 h GLU 113 Ca -0.50 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 58.70 1yr7 h GLU 113 Cb 1.20 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 1yr7 h GLU 113 CO 0.66 0.45 -0.48 0.35 -0.73 0.00 0.00 179.01 179.27 1yr7 h PHE 114 N 0.71 -1.35 -0.14 0.92 3.57 -1.92 0.88 116.94 119.60 1yr7 h PHE 114 Ca 0.30 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.80 1yr7 h PHE 114 Cb 0.28 0.56 -0.00 0.00 2.79 0.00 0.00 35.95 39.58 1yr7 h PHE 114 CO -0.00 -0.59 -0.04 0.78 -2.23 0.00 0.00 178.31 176.23 1yr7 h GLY 115 N -0.78 0.30 0.69 2.40 0.00 -1.73 -0.26 103.07 103.69 1yr7 h GLY 115 Ca -0.01 -0.26 0.05 0.00 0.00 0.00 0.00 47.33 47.12 1yr7 h GLY 115 CO -0.21 0.23 0.30 -2.08 0.00 0.00 0.00 176.54 174.78 1yr7 h VAL 116 N -0.04 0.95 0.02 4.60 2.07 -1.47 -0.18 116.25 122.20 1yr7 h VAL 116 Ca 0.03 -0.19 -0.21 0.00 0.82 0.00 0.00 66.70 67.15 1yr7 h VAL 116 Cb 0.48 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1yr7 h VAL 116 CO 0.02 0.10 -1.01 0.03 0.02 0.00 0.00 177.57 176.73 1yr7 h ARG 117 N 0.56 0.05 0.29 1.57 3.08 -0.72 -1.73 114.38 117.49 1yr7 h ARG 117 Ca 0.26 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.21 1yr7 h ARG 117 Cb 0.17 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1yr7 h ARG 117 CO -0.18 1.01 -0.14 1.25 -1.07 0.00 0.00 179.97 180.84 1yr7 h LEU 118 N 0.02 -0.33 -1.66 3.04 5.85 -0.77 -2.60 115.31 118.85 1yr7 h LEU 118 Ca -0.03 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.68 1yr7 h LEU 118 Cb 1.75 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.85 1yr7 h LEU 118 CO 0.14 -0.21 0.24 0.24 -0.34 0.00 0.00 178.44 178.51 1yr7 h MET 119 N -0.43 0.45 0.00 1.25 2.86 -0.92 -1.71 114.93 116.43 1yr7 h MET 119 Ca -0.04 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.50 1yr7 h MET 119 Cb 0.33 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 1yr7 h MET 119 CO 0.07 0.30 -0.35 1.49 1.06 0.00 0.00 176.91 179.48 1yr7 h GLU 120 N 0.46 0.00 -0.48 1.72 4.81 -1.15 -3.07 114.58 116.87 1yr7 h GLU 120 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1yr7 h GLU 120 Cb -0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.35 1yr7 h GLU 120 CO -0.03 0.35 0.00 0.09 -0.73 0.00 0.00 179.01 178.69 1yr7 n ASN 121 N -3.58 3.92 -4.89 1.04 4.13 -0.67 -4.93 115.26 110.28 1yr7 n ASN 121 Ca -0.00 -2.39 -0.32 0.00 1.68 0.00 0.00 54.58 53.55 1yr7 n ASN 121 Cb 0.48 -0.45 -0.05 0.00 -1.54 0.00 0.00 39.78 38.22 1yr7 n ASN 121 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1yr7 s LEU 122 N -1.71 4.29 -0.69 3.41 1.43 -1.03 -5.05 118.68 119.32 1yr7 s LEU 122 Ca 0.40 0.27 -0.26 0.00 -1.03 0.00 0.00 54.13 53.50 1yr7 s LEU 122 Cb 0.26 -2.76 -0.00 0.00 0.03 0.00 0.00 46.19 43.72 1yr7 s LEU 122 CO 0.19 0.21 1.65 -2.84 0.23 0.00 0.00 176.35 175.79 1yr7 s PRO 123 N -2.25 2.85 -1.64 1.29 0.02 -1.26 -4.46 135.00 129.55 1yr7 s PRO 123 Ca 0.31 0.19 -0.15 0.00 0.02 0.00 0.00 61.00 61.37 1yr7 s PRO 123 Cb -0.13 -4.40 0.13 0.00 0.02 0.00 0.00 34.50 30.12 1yr7 s PRO 123 CO 0.23 -2.56 0.74 0.66 -0.33 0.00 0.00 177.00 175.75 1yr7 n TYR 124 N 11.54 -1.78 -1.62 6.54 4.01 -1.26 -4.84 117.16 129.75 1yr7 n TYR 124 Ca 0.16 0.80 -0.37 0.00 -0.16 0.00 0.00 57.90 58.34 1yr7 n TYR 124 Cb 0.51 -3.17 0.08 0.00 -0.31 0.00 0.00 39.34 36.45 1yr7 n TYR 124 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1yr7 n PRO 125 N -4.42 0.94 -3.67 -0.72 -0.04 -1.26 -4.86 135.00 120.97 1yr7 n PRO 125 Ca 0.01 0.38 -0.37 0.00 -0.04 0.00 0.00 63.50 63.48 1yr7 n PRO 125 Cb 0.53 -2.48 -0.10 0.00 -0.04 0.00 0.00 33.50 31.41 1yr7 n PRO 125 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1yr7 s LEU 126 N -4.30 4.07 -0.12 1.53 2.96 0.44 -4.00 118.68 119.26 1yr7 s LEU 126 Ca 0.81 0.08 -0.14 0.00 -0.22 0.00 0.00 54.13 54.66 1yr7 s LEU 126 Cb -0.37 -2.10 -0.05 0.00 0.50 0.00 0.00 46.19 44.18 1yr7 s LEU 126 CO 0.42 0.05 0.33 -0.69 -1.32 0.00 0.00 176.35 175.15 1yr7 s VAL 127 N 1.15 5.25 -0.27 1.68 1.01 0.77 0.68 120.40 130.67 1yr7 s VAL 127 Ca 0.07 0.64 -0.04 0.00 0.00 0.00 0.00 61.98 62.65 1yr7 s VAL 127 Cb -0.14 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.60 1yr7 s VAL 127 CO 0.05 0.44 -0.00 -0.69 0.00 0.00 0.00 175.10 174.90 1yr7 s VAL 128 N 0.07 3.38 -0.33 2.92 1.01 0.14 0.38 120.40 127.96 1yr7 s VAL 128 Ca 0.19 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.21 1yr7 s VAL 128 Cb -0.14 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1yr7 s VAL 128 CO 0.07 0.17 0.23 -0.47 0.00 0.00 0.00 175.10 175.09 1yr7 s TYR 129 N 1.41 3.22 -0.01 5.22 5.04 0.11 -1.19 117.35 131.15 1yr7 s TYR 129 Ca 0.02 -0.18 0.04 0.00 -2.44 0.00 0.00 57.07 54.51 1yr7 s TYR 129 Cb -0.17 -2.45 -0.03 0.00 0.35 0.00 0.00 41.96 39.66 1yr7 s TYR 129 CO -0.01 -0.33 -0.12 0.96 -1.34 0.00 0.00 175.55 174.70 1yr7 s ILE 130 N 1.72 3.22 0.04 3.14 -4.36 -0.10 0.12 121.20 124.99 1yr7 s ILE 130 Ca 0.06 -0.82 0.06 0.00 -0.26 0.00 0.00 60.65 59.68 1yr7 s ILE 130 Cb -0.17 -2.33 -0.02 0.00 1.25 0.00 0.00 42.46 41.19 1yr7 s ILE 130 CO 0.10 0.48 -0.16 -0.44 0.24 0.00 0.00 174.94 175.16 1yr7 s SER 131 N -1.10 1.95 -0.15 4.36 0.01 0.79 -4.29 113.70 115.27 1yr7 s SER 131 Ca 0.14 -0.49 -0.29 0.00 1.31 0.00 0.00 55.95 56.61 1yr7 s SER 131 Cb -0.11 -0.14 -0.00 0.00 0.21 0.00 0.00 66.02 65.98 1yr7 s SER 131 CO 0.04 0.07 1.03 -0.62 0.41 0.00 0.00 173.24 174.17 1yr7 s ASP 132 N -1.20 7.18 0.59 2.44 -1.08 -1.26 -1.83 116.67 121.50 1yr7 s ASP 132 Ca 0.03 1.48 0.29 0.00 -0.52 0.00 0.00 52.55 53.83 1yr7 s ASP 132 Cb -0.08 -2.55 1.53 0.00 -1.46 0.00 0.00 42.92 40.36 1yr7 s ASP 132 CO 0.02 -0.54 1.96 -0.65 0.52 0.00 0.00 175.17 176.47 1yr7 h PRO 133 N 7.26 0.00 -0.51 4.34 0.11 -1.94 -0.53 132.00 140.73 1yr7 h PRO 133 Ca -0.26 0.00 0.15 0.00 0.11 0.00 0.00 66.00 65.99 1yr7 h PRO 133 Cb 1.11 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1yr7 h PRO 133 CO 0.91 0.00 0.48 1.49 -0.21 0.00 0.00 178.00 180.66 1yr7 h GLU 134 N 0.00 0.00 0.00 1.05 4.81 -1.95 0.45 114.58 118.94 1yr7 h GLU 134 Ca 0.18 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1yr7 h GLU 134 Cb 0.96 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.34 1yr7 h GLU 134 CO -0.00 0.00 0.00 0.44 -0.73 0.00 0.00 179.01 178.72 1yr7 n ILE 135 N -3.88 0.93 -3.10 2.32 -5.35 -0.21 -4.65 119.36 105.42 1yr7 n ILE 135 Ca 0.10 0.24 -0.45 0.00 -0.27 0.00 0.00 62.75 62.36 1yr7 n ILE 135 Cb 0.69 -1.04 -0.03 0.00 -1.74 0.00 0.00 39.64 37.51 1yr7 n ILE 135 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1yr7 s LEU 136 N -3.48 5.60 0.00 7.28 1.43 0.16 -4.83 118.68 124.84 1yr7 s LEU 136 Ca 0.06 -1.92 0.00 0.00 -1.03 0.00 0.00 54.13 51.24 1yr7 s LEU 136 Cb 0.10 -2.31 0.00 0.00 0.03 0.00 0.00 46.19 44.00 1yr7 s LEU 136 CO 0.31 -0.98 0.00 0.29 0.23 0.00 0.00 176.35 176.20 1yr7 n LYS 137 N 5.85 0.00 -2.94 1.70 4.76 -1.26 -5.07 118.16 121.20 1yr7 n LYS 137 Ca 0.07 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.18 1yr7 n LYS 137 Cb 0.46 -0.05 -0.06 0.00 -1.84 0.00 0.00 35.03 33.54 1yr7 n LYS 137 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 1yr7 s LYS 138 N -0.28 4.02 0.26 1.97 -2.85 -1.26 -4.97 119.74 116.63 1yr7 s LYS 138 Ca 0.00 0.78 0.11 0.00 -1.00 0.00 0.00 55.97 55.86 1yr7 s LYS 138 Cb 0.00 -2.33 0.87 0.00 -2.06 0.00 0.00 37.83 34.31 1yr7 s LYS 138 CO 0.00 0.04 1.16 -2.30 0.10 0.00 0.00 175.35 174.35 1yr7 n PRO 139 N -0.69 -0.05 0.18 1.78 -0.02 -1.26 -0.56 135.00 134.38 1yr7 n PRO 139 Ca 0.05 1.05 0.06 0.00 -2.02 0.00 0.00 63.50 62.63 1yr7 n PRO 139 Cb 0.54 -1.81 0.27 0.00 -0.02 0.00 0.00 33.50 32.48 1yr7 n PRO 139 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1yr7 h ASN 140 N 0.00 0.00 -0.69 2.55 2.35 -1.97 -2.34 115.58 115.49 1yr7 h ASN 140 Ca 0.57 0.00 0.15 0.00 -0.55 0.00 0.00 56.30 56.47 1yr7 h ASN 140 Cb 1.44 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 39.69 1yr7 h ASN 140 CO -0.61 0.37 -0.08 0.44 -1.65 0.00 0.00 177.43 175.90 1yr7 h ASP 141 N 0.00 -0.47 -0.76 5.81 3.32 -1.19 0.61 116.42 123.75 1yr7 h ASP 141 Ca -0.00 0.19 0.03 0.00 0.02 0.00 0.00 57.03 57.27 1yr7 h ASP 141 Cb 1.01 0.36 -0.05 0.00 0.22 0.00 0.00 39.33 40.88 1yr7 h ASP 141 CO 0.05 -0.19 0.48 1.88 -1.72 0.00 0.00 179.24 179.74 1yr7 h TYR 142 N 0.05 0.90 -0.30 4.55 0.05 -1.52 -0.34 116.97 120.36 1yr7 h TYR 142 Ca 0.35 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 59.07 1yr7 h TYR 142 Cb 0.57 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 38.00 1yr7 h TYR 142 CO -0.47 0.52 -0.16 0.00 -1.05 0.00 0.00 178.16 177.00 1yr7 h PHE 144 N 0.49 -0.87 -0.78 0.00 3.57 0.12 -1.25 116.94 118.22 1yr7 h PHE 144 Ca 0.08 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.67 1yr7 h PHE 144 Cb 0.57 0.29 -0.12 0.00 2.79 0.00 0.00 35.95 39.47 1yr7 h PHE 144 CO 0.02 -0.53 -0.47 0.28 -2.23 0.00 0.00 178.31 175.37 1yr7 h VAL 145 N -0.97 0.04 -0.05 1.41 2.07 -1.08 0.26 116.25 117.93 1yr7 h VAL 145 Ca -0.10 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.36 1yr7 h VAL 145 Cb 0.73 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1yr7 h VAL 145 CO 0.16 0.00 -0.29 0.03 0.02 0.00 0.00 177.57 177.49 1yr7 h ARG 146 N -0.12 0.10 0.08 1.57 3.08 -1.46 -2.28 114.38 115.35 1yr7 h ARG 146 Ca 0.21 -0.03 -0.25 0.00 0.07 0.00 0.00 59.98 59.97 1yr7 h ARG 146 Cb 0.53 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 1yr7 h ARG 146 CO -0.82 0.38 -1.18 0.74 -1.07 0.00 0.00 179.97 178.01 1yr7 h PHE 147 N 0.09 0.33 -0.76 3.04 0.04 -0.42 -3.01 116.94 116.24 1yr7 h PHE 147 Ca 0.01 -0.24 0.03 0.00 2.80 0.00 0.00 57.97 60.57 1yr7 h PHE 147 Cb 0.56 -0.01 -0.05 0.00 2.20 0.00 0.00 35.95 38.65 1yr7 h PHE 147 CO 0.00 1.19 0.49 0.35 -0.60 0.00 0.00 178.31 179.74 1yr7 h PHE 148 N 0.05 0.91 -0.83 -0.55 3.57 -0.08 -0.95 116.94 119.06 1yr7 h PHE 148 Ca -0.10 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.46 1yr7 h PHE 148 Cb 1.91 -0.30 -0.05 0.00 2.79 0.00 0.00 35.95 40.30 1yr7 h PHE 148 CO 0.04 0.53 0.53 0.00 -2.23 0.00 0.00 178.31 177.18 1yr7 h ALA 149 N 1.32 1.09 -0.64 2.41 0.00 -1.47 0.41 119.26 122.38 1yr7 h ALA 149 Ca 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1yr7 h ALA 149 Cb -0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1yr7 h ALA 149 CO -0.10 0.36 0.40 1.25 0.00 0.00 0.00 179.25 181.16 1yr7 h LEU 150 N 1.03 0.75 -0.30 0.00 6.46 -1.26 0.53 115.31 122.52 1yr7 h LEU 150 Ca 0.33 -0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 58.01 1yr7 h LEU 150 Cb 0.01 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 39.74 1yr7 h LEU 150 CO -0.11 0.56 0.04 -0.07 -0.62 0.00 0.00 178.44 178.24 1yr7 h LEU 151 N 0.86 0.49 -0.56 2.25 4.07 -0.39 0.54 115.31 122.57 1yr7 h LEU 151 Ca 0.23 -0.27 0.05 0.00 0.08 0.00 0.00 57.88 57.97 1yr7 h LEU 151 Cb -0.06 -0.13 -0.05 0.00 1.08 0.00 0.00 40.66 41.50 1yr7 h LEU 151 CO -0.05 0.64 0.29 0.40 -1.08 0.00 0.00 178.44 178.64 1yr7 h ILE 152 N 0.33 0.95 -0.20 1.22 2.04 -0.79 0.45 117.51 121.51 1yr7 h ILE 152 Ca 0.09 -0.19 0.03 0.00 1.00 0.00 0.00 64.86 65.79 1yr7 h ILE 152 Cb 0.36 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 1yr7 h ILE 152 CO 0.01 0.10 -0.00 -0.78 0.00 0.00 0.00 178.15 177.47 1yr7 h ASP 153 N 0.55 -0.09 0.53 1.72 1.82 -0.41 0.23 116.42 120.78 1yr7 h ASP 153 Ca 0.25 0.05 -0.02 0.00 -0.39 0.00 0.00 57.03 56.92 1yr7 h ASP 153 Cb 0.16 0.08 -0.01 0.00 0.68 0.00 0.00 39.33 40.24 1yr7 h ASP 153 CO -0.17 -0.02 -0.40 0.25 -1.61 0.00 0.00 179.24 177.29 1yr7 h LEU 154 N 0.06 -1.05 -1.15 2.28 5.85 0.90 -0.04 115.31 122.16 1yr7 h LEU 154 Ca 0.09 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1yr7 h LEU 154 Cb 0.12 0.33 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 1yr7 h LEU 154 CO -0.16 -0.59 0.57 -0.09 -0.34 0.00 0.00 178.44 177.83 1yr7 h ARG 155 N -0.91 1.14 0.00 1.25 9.65 0.20 -3.03 114.38 122.68 1yr7 h ARG 155 Ca -0.06 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.75 1yr7 h ARG 155 Cb 0.77 -0.26 0.00 0.00 -1.39 0.00 0.00 29.97 29.09 1yr7 h ARG 155 CO 0.01 0.76 -1.28 1.28 2.80 0.00 0.00 179.97 183.54 1yr7 n LEU 156 N -4.40 0.68 -3.36 3.80 4.77 0.80 -5.00 117.00 114.30 1yr7 n LEU 156 Ca 0.10 -0.32 -0.18 0.00 -0.03 0.00 0.00 56.01 55.58 1yr7 n LEU 156 Cb 0.02 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.18 1yr7 n LEU 156 CO 0.37 0.16 0.15 0.61 -1.33 0.00 0.00 177.39 177.35 1yr7 n GLY 157 N 1.42 -0.37 3.11 -0.72 0.00 -0.03 -4.42 105.19 104.17 1yr7 n GLY 157 Ca 0.02 0.12 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 1yr7 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yr7 s ALA 158 N -3.33 -0.53 0.20 4.61 0.00 -1.22 -4.94 121.76 116.55 1yr7 s ALA 158 Ca 0.19 0.53 -0.32 0.00 0.00 0.00 0.00 51.96 52.36 1yr7 s ALA 158 Cb -0.08 -0.29 -0.13 0.00 0.00 0.00 0.00 23.12 22.61 1yr7 s ALA 158 CO 0.69 -0.12 1.55 2.41 0.00 0.00 0.00 175.76 180.29 1yr7 n THR 159 N 2.73 0.39 -4.36 0.00 -1.04 -1.26 -4.33 114.28 106.41 1yr7 n THR 159 Ca -0.14 -0.10 -0.31 0.00 -2.04 0.00 0.00 64.05 61.47 1yr7 n THR 159 Cb 0.58 -1.61 -0.16 0.00 -1.82 0.00 0.00 70.33 67.31 1yr7 n THR 159 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1yr7 s THR 160 N 0.56 1.74 -0.29 12.58 2.01 -1.26 -0.17 115.64 130.81 1yr7 s THR 160 Ca 0.74 -0.77 -0.14 0.00 0.31 0.00 0.00 61.69 61.84 1yr7 s THR 160 Cb -0.63 -1.58 -0.04 0.00 0.01 0.00 0.00 72.50 70.27 1yr7 s THR 160 CO 0.42 0.49 0.30 -0.63 -0.69 0.00 0.00 174.62 174.51 1yr7 s ILE 161 N 1.11 5.22 0.13 1.82 -1.09 0.16 -4.88 121.20 123.67 1yr7 s ILE 161 Ca -0.02 0.30 -0.31 0.00 -2.23 0.00 0.00 60.65 58.39 1yr7 s ILE 161 Cb -0.14 -3.66 -0.08 0.00 -1.58 0.00 0.00 42.46 37.00 1yr7 s ILE 161 CO -0.05 0.13 1.31 -2.16 -1.23 0.00 0.00 174.94 172.94 1yr7 s PRO 162 N 1.94 4.38 0.00 2.79 0.04 -1.26 0.04 135.00 142.92 1yr7 s PRO 162 Ca 0.11 1.99 -0.02 0.00 0.04 0.00 0.00 61.00 63.12 1yr7 s PRO 162 Cb -0.16 -3.26 -0.01 0.00 0.04 0.00 0.00 34.50 31.12 1yr7 s PRO 162 CO 0.11 -0.32 0.04 0.00 0.04 0.00 0.00 177.00 176.86 1yr7 s ALA 163 N 0.75 -0.07 0.02 8.56 0.00 0.33 -1.52 121.76 129.84 1yr7 s ALA 163 Ca 0.60 -0.20 -0.08 0.00 0.00 0.00 0.00 51.96 52.28 1yr7 s ALA 163 Cb -0.35 0.05 -0.05 0.00 0.00 0.00 0.00 23.12 22.77 1yr7 s ALA 163 CO 0.32 -0.12 0.32 -0.51 0.00 0.00 0.00 175.76 175.78 1yr7 s LEU 164 N -0.85 4.38 0.46 0.00 1.43 0.21 -0.15 118.68 124.15 1yr7 s LEU 164 Ca -0.09 0.67 0.06 0.00 -1.03 0.00 0.00 54.13 53.73 1yr7 s LEU 164 Cb -0.06 -2.72 -0.03 0.00 0.03 0.00 0.00 46.19 43.41 1yr7 s LEU 164 CO -0.00 0.25 0.15 0.21 0.23 0.00 0.00 176.35 177.18 1yr7 s ASN 165 N -1.61 4.29 -1.53 2.29 3.04 -0.76 -0.70 114.94 119.95 1yr7 s ASN 165 Ca 0.28 -1.29 0.00 0.00 0.04 0.00 0.00 52.86 51.89 1yr7 s ASN 165 Cb -0.14 -0.10 0.00 0.00 -1.54 0.00 0.00 41.25 39.47 1yr7 s ASN 165 CO 0.16 -0.69 0.00 0.29 -3.04 0.00 0.00 177.10 173.82 1yr7 n LYS 166 N -1.28 -1.87 0.16 0.43 5.02 -1.09 -4.34 118.16 115.19 1yr7 n LYS 166 Ca -0.06 0.87 0.12 0.00 -2.02 0.00 0.00 58.31 57.22 1yr7 n LYS 166 Cb 0.65 -5.51 0.56 0.00 -0.02 0.00 0.00 35.03 30.72 1yr7 n LYS 166 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1yr7 n VAL 167 N -3.76 0.95 0.29 -0.18 0.24 -1.04 -1.55 118.33 113.27 1yr7 n VAL 167 Ca -0.21 0.56 0.17 0.00 -2.04 0.00 0.00 64.34 62.82 1yr7 n VAL 167 Cb 0.66 -1.54 0.85 0.00 -1.47 0.00 0.00 33.84 32.34 1yr7 n VAL 167 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 1yr7 h ASP 168 N 0.00 0.00 1.41 -1.34 2.03 -1.89 -2.31 116.42 114.33 1yr7 h ASP 168 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1yr7 h ASP 168 Cb 0.13 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.63 1yr7 h ASP 168 CO 0.00 0.05 0.00 -0.07 -1.03 0.00 0.00 179.24 178.19 1yr7 h LEU 169 N 0.00 0.00 -9.72 0.15 3.38 -1.67 -3.46 115.31 103.99 1yr7 h LEU 169 Ca -0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 1yr7 h LEU 169 Cb 0.29 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1yr7 h LEU 169 CO 0.01 0.00 0.36 -0.76 0.09 0.00 0.00 178.44 178.14 1yr7 s LEU 170 N -4.64 4.62 0.76 1.67 1.43 -0.87 -5.05 118.68 116.59 1yr7 s LEU 170 Ca 0.10 1.94 -0.11 0.00 -1.03 0.00 0.00 54.13 55.03 1yr7 s LEU 170 Cb 0.11 -3.61 0.05 0.00 0.03 0.00 0.00 46.19 42.78 1yr7 s LEU 170 CO 0.58 0.10 1.08 -0.94 0.23 0.00 0.00 176.35 177.40 1yr7 s SER 171 N -0.95 4.66 0.40 2.29 1.04 -1.26 -4.78 113.70 115.10 1yr7 s SER 171 Ca 0.42 1.73 0.13 0.00 0.48 0.00 0.00 55.95 58.71 1yr7 s SER 171 Cb -0.26 -2.47 0.81 0.00 0.10 0.00 0.00 66.02 64.20 1yr7 s SER 171 CO 0.32 -1.92 1.88 -0.08 0.98 0.00 0.00 173.24 174.42 1yr7 h GLU 172 N -1.05 0.00 0.24 4.02 4.57 -1.97 0.34 114.58 120.74 1yr7 h GLU 172 Ca -0.44 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.74 1yr7 h GLU 172 Cb 1.23 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.79 1yr7 h GLU 172 CO 0.53 0.31 -0.42 0.93 -1.18 0.00 0.00 179.01 179.18 1yr7 h GLU 173 N 0.00 -0.68 -0.08 1.92 5.08 -1.99 -1.58 114.58 117.24 1yr7 h GLU 173 Ca -0.00 0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1yr7 h GLU 173 Cb 0.55 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 1yr7 h GLU 173 CO 0.04 -0.46 -0.04 0.93 -1.00 0.00 0.00 179.01 178.48 1yr7 h GLU 174 N -0.71 -0.04 -0.46 2.33 5.08 -1.81 0.20 114.58 119.16 1yr7 h GLU 174 Ca -0.03 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1yr7 h GLU 174 Cb 0.66 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.87 1yr7 h GLU 174 CO -0.15 -0.03 -0.27 1.63 -1.00 0.00 0.00 179.01 179.19 1yr7 n LYS 175 N -5.17 -0.20 -0.10 2.33 4.76 0.11 -1.54 118.16 118.35 1yr7 n LYS 175 Ca -0.05 1.13 -0.02 0.00 -2.87 0.00 0.00 58.31 56.50 1yr7 n LYS 175 Cb 0.10 -1.67 0.23 0.00 -1.84 0.00 0.00 35.03 31.84 1yr7 n LYS 175 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 1yr7 h GLU 176 N 0.00 0.76 -0.68 1.97 4.57 -0.94 -2.68 114.58 117.58 1yr7 h GLU 176 Ca 0.07 -0.15 0.03 0.00 -1.18 0.00 0.00 59.36 58.14 1yr7 h GLU 176 Cb 0.19 -0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 28.62 1yr7 h GLU 176 CO -0.43 0.69 0.45 -0.09 -1.18 0.00 0.00 179.01 178.44 1yr7 h ARG 177 N 0.74 0.80 0.01 1.92 2.43 0.09 -2.16 114.38 118.21 1yr7 h ARG 177 Ca 0.17 -0.05 -0.24 0.00 -0.81 0.00 0.00 59.98 59.04 1yr7 h ARG 177 Cb 0.26 -0.18 0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1yr7 h ARG 177 CO -0.00 0.53 -1.00 0.45 -1.51 0.00 0.00 179.97 178.44 1yr7 h HIS 178 N 0.82 0.79 -0.30 2.20 3.86 -0.96 -3.28 115.15 118.28 1yr7 h HIS 178 Ca 0.27 -0.43 0.02 0.00 -1.16 0.00 0.00 60.37 59.06 1yr7 h HIS 178 Cb 0.07 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.43 1yr7 h HIS 178 CO -0.00 1.26 0.17 0.00 0.86 0.00 0.00 177.93 180.22 1yr7 h ARG 179 N 0.29 0.33 -0.17 2.45 3.08 -1.14 0.18 114.38 119.41 1yr7 h ARG 179 Ca -0.10 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 59.98 1yr7 h ARG 179 Cb 1.64 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 31.55 1yr7 h ARG 179 CO 0.18 0.22 -0.28 0.87 -1.07 0.00 0.00 179.97 179.89 1yr7 h LYS 180 N 0.34 -0.32 -0.66 0.04 1.57 -1.51 4.42 116.57 120.47 1yr7 h LYS 180 Ca 0.12 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.90 1yr7 h LYS 180 Cb 0.02 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 1yr7 h LYS 180 CO -0.07 -0.21 0.31 1.88 -0.57 0.00 0.00 179.45 180.79 1yr7 h TYR 181 N -0.33 0.96 0.13 -1.35 0.05 -1.57 -1.08 116.97 113.78 1yr7 h TYR 181 Ca 0.11 -0.05 -0.23 0.00 0.05 0.00 0.00 58.73 58.61 1yr7 h TYR 181 Cb 0.50 -0.29 0.02 0.00 1.01 0.00 0.00 36.73 37.97 1yr7 h TYR 181 CO -0.39 0.72 -0.97 0.74 -1.05 0.00 0.00 178.16 177.21 1yr7 h PHE 182 N 0.91 0.72 0.00 4.88 0.04 -0.15 -3.41 116.94 119.94 1yr7 h PHE 182 Ca 0.22 -0.49 0.00 0.00 2.80 0.00 0.00 57.97 60.51 1yr7 h PHE 182 Cb 0.13 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.24 1yr7 h PHE 182 CO 0.00 1.36 0.00 0.39 -0.60 0.00 0.00 178.31 179.46 1yr7 n GLU 183 N -4.01 0.00 -1.67 1.51 -0.58 1.45 -4.70 120.64 112.63 1yr7 n GLU 183 Ca -0.14 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.18 1yr7 n GLU 183 Cb 0.87 -0.64 -0.03 0.00 -0.57 0.00 0.00 31.44 31.07 1yr7 n GLU 183 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1yr7 s ASP 184 N -1.47 6.18 -0.06 1.62 2.15 -0.41 -4.90 116.67 119.77 1yr7 s ASP 184 Ca 0.00 2.42 -0.17 0.00 0.43 0.00 0.00 52.55 55.23 1yr7 s ASP 184 Cb 0.00 -2.52 -0.13 0.00 -0.30 0.00 0.00 42.92 39.97 1yr7 s ASP 184 CO 0.00 -1.31 0.68 -0.29 -0.17 0.00 0.00 175.17 174.09 1yr7 h ILE 185 N 6.06 0.60 0.00 4.11 6.09 -1.82 -3.25 117.51 129.31 1yr7 h ILE 185 Ca -0.47 -1.08 0.00 0.00 -1.37 0.00 0.00 64.86 61.94 1yr7 h ILE 185 Cb 1.23 1.04 0.00 0.00 0.47 0.00 0.00 36.82 39.57 1yr7 h ILE 185 CO 0.95 0.17 0.20 0.44 -3.07 0.00 0.00 178.15 176.84 1yr7 h ASP 186 N -0.95 0.00 0.04 2.19 3.45 -1.95 -1.92 116.42 117.28 1yr7 h ASP 186 Ca -0.02 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.43 1yr7 h ASP 186 Cb 0.46 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1yr7 h ASP 186 CO 0.04 0.00 -0.02 0.22 -1.57 0.00 0.00 179.24 177.91 1yr7 h TYR 187 N 0.00 -0.05 -0.45 4.55 5.03 -1.88 -2.16 116.97 122.02 1yr7 h TYR 187 Ca 0.00 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 1yr7 h TYR 187 Cb 0.40 0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.68 1yr7 h TYR 187 CO 0.00 0.59 0.29 1.25 -1.32 0.00 0.00 178.16 178.98 1yr7 h LEU 188 N -0.90 0.51 -1.17 2.82 6.46 -1.45 -2.56 115.31 119.02 1yr7 h LEU 188 Ca -0.01 -0.01 0.13 0.00 -0.12 0.00 0.00 57.88 57.87 1yr7 h LEU 188 Cb 0.67 -0.13 -0.08 0.00 -0.73 0.00 0.00 40.66 40.40 1yr7 h LEU 188 CO 0.01 0.37 0.60 0.74 -0.62 0.00 0.00 178.44 179.54 1yr7 h THR 189 N 0.60 0.89 -0.44 1.05 2.02 -1.46 0.16 112.91 115.74 1yr7 h THR 189 Ca 0.16 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 67.03 1yr7 h THR 189 Cb -0.07 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.30 1yr7 h THR 189 CO -0.04 0.15 0.17 0.00 0.37 0.00 0.00 175.52 176.18 1yr7 h ALA 190 N 1.57 0.57 0.00 6.16 0.00 -1.00 -2.13 119.26 124.43 1yr7 h ALA 190 Ca 0.46 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1yr7 h ALA 190 Cb 0.58 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1yr7 h ALA 190 CO -0.23 0.18 0.00 -0.09 0.00 0.00 0.00 179.25 179.11 1yr7 h ARG 191 N 0.57 0.00 0.00 0.00 9.65 -0.71 -1.86 114.38 122.03 1yr7 h ARG 191 Ca 0.15 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.99 1yr7 h ARG 191 Cb 0.20 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.77 1yr7 h ARG 191 CO -0.01 0.00 -0.64 -0.07 2.80 0.00 0.00 179.97 182.04 1yr7 h LEU 192 N 0.00 0.00 0.20 3.80 3.38 -0.83 -3.36 115.31 118.50 1yr7 h LEU 192 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1yr7 h LEU 192 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1yr7 h LEU 192 CO 0.00 0.12 -0.09 0.50 0.09 0.00 0.00 178.44 179.06 1yr7 h LYS 193 N 0.00 -0.26 -2.01 1.13 1.63 -0.65 -3.24 116.57 113.18 1yr7 h LYS 193 Ca -0.02 0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1yr7 h LYS 193 Cb 1.11 0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 32.80 1yr7 h LYS 193 CO 0.01 0.08 -0.00 1.47 -3.45 0.00 0.00 179.45 177.56 1yr7 n LEU 194 N -5.05 3.90 -4.01 5.20 -0.00 -1.19 -4.59 117.00 111.26 1yr7 n LEU 194 Ca -0.09 -1.77 -0.31 0.00 -0.00 0.00 0.00 56.01 53.84 1yr7 n LEU 194 Cb 0.24 -0.83 -0.15 0.00 -0.00 0.00 0.00 43.42 42.68 1yr7 n LEU 194 CO 0.31 0.75 -0.28 -0.62 -0.00 0.00 0.00 177.39 177.55 1yr7 s ASP 195 N 2.01 4.69 0.31 1.45 -1.08 -1.22 -4.96 116.67 117.86 1yr7 s ASP 195 Ca 0.01 -2.37 0.15 0.00 -0.52 0.00 0.00 52.55 49.82 1yr7 s ASP 195 Cb 0.01 -1.64 0.40 0.00 -1.46 0.00 0.00 42.92 40.23 1yr7 s ASP 195 CO 0.00 -0.35 1.61 1.55 0.52 0.00 0.00 175.17 178.50 1yr7 h PRO 196 N 7.35 0.00 -7.14 4.34 0.13 -1.91 -3.32 132.00 131.45 1yr7 h PRO 196 Ca -0.05 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.63 1yr7 h PRO 196 Cb 0.99 0.00 0.22 0.00 0.13 0.00 0.00 31.00 32.34 1yr7 h PRO 196 CO 0.57 0.52 0.01 -1.13 -0.23 0.00 0.00 178.00 177.74 1yr7 n SER 197 N -3.51 -1.50 0.25 1.44 3.41 -1.26 -4.95 113.62 107.49 1yr7 n SER 197 Ca -0.00 -0.10 -0.12 0.00 -0.26 0.00 0.00 58.87 58.40 1yr7 n SER 197 Cb 0.62 -1.28 -0.06 0.00 -0.26 0.00 0.00 64.21 63.23 1yr7 n SER 197 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1yr7 h MET 198 N -2.61 -0.69 -6.32 4.33 1.85 -2.00 -3.35 114.93 106.14 1yr7 h MET 198 Ca -0.60 0.05 -0.54 0.00 -0.61 0.00 0.00 59.70 58.00 1yr7 h MET 198 Cb 1.33 0.16 -0.03 0.00 0.43 0.00 0.00 31.60 33.48 1yr7 h MET 198 CO 0.48 -0.46 0.29 -0.65 -0.40 0.00 0.00 176.91 176.17 1yr7 s GLN 199 N -4.73 4.54 0.00 0.39 1.11 -1.26 -2.83 119.66 116.88 1yr7 s GLN 199 Ca -0.11 1.27 0.00 0.00 0.01 0.00 0.00 55.36 56.53 1yr7 s GLN 199 Cb 0.02 -3.45 0.00 0.00 -1.01 0.00 0.00 33.01 28.57 1yr7 s GLN 199 CO 0.36 0.02 0.00 0.41 0.01 0.00 0.00 175.29 176.08 1yr7 n GLY 200 N 2.87 3.36 0.10 3.09 0.00 -1.26 -4.75 105.19 108.61 1yr7 n GLY 200 Ca 0.04 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.16 1yr7 n GLY 200 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1yr7 h LEU 201 N 0.00 -0.14 -8.38 0.99 6.46 -1.67 -1.18 115.31 111.38 1yr7 h LEU 201 Ca 0.00 -0.05 -0.43 0.00 -0.12 0.00 0.00 57.88 57.28 1yr7 h LEU 201 Cb 0.00 0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 39.92 1yr7 h LEU 201 CO 0.00 -0.05 1.13 -0.04 -0.62 0.00 0.00 178.44 178.87 1yr7 s MET 202 N -5.93 2.65 0.00 1.25 -1.94 -1.13 -0.94 119.30 113.26 1yr7 s MET 202 Ca -0.14 0.22 0.00 0.00 -1.71 0.00 0.00 55.69 54.06 1yr7 s MET 202 Cb 0.05 -4.64 0.00 0.00 2.01 0.00 0.00 34.83 32.25 1yr7 s MET 202 CO 0.65 -2.92 0.00 0.00 -0.01 0.00 0.00 175.02 172.74 1yr7 n ALA 203 N 12.94 0.00 0.35 3.03 0.00 -1.25 -4.73 120.51 130.84 1yr7 n ALA 203 Ca 0.27 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.57 1yr7 n ALA 203 Cb 0.50 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.88 1yr7 n ALA 203 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1yr7 h TYR 204 N 0.00 -0.86 -0.05 0.00 5.03 0.20 -1.44 116.97 119.86 1yr7 h TYR 204 Ca 0.00 -0.02 0.01 0.00 2.58 0.00 0.00 58.73 61.30 1yr7 h TYR 204 Cb 0.00 0.28 -0.00 0.00 1.55 0.00 0.00 36.73 38.56 1yr7 h TYR 204 CO 0.00 -0.53 0.08 0.87 -1.32 0.00 0.00 178.16 177.26 1yr7 h LYS 205 N -1.21 0.00 0.00 1.82 1.57 -1.31 -0.34 116.57 117.10 1yr7 h LYS 205 Ca -0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1yr7 h LYS 205 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1yr7 h LYS 205 CO 0.16 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 177.71 1yr7 n MET 206 N -3.54 0.00 0.26 3.15 2.81 -1.16 -4.15 117.12 114.49 1yr7 n MET 206 Ca -0.02 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 55.98 1yr7 n MET 206 Cb 0.17 -0.42 0.57 0.00 -0.71 0.00 0.00 33.22 32.83 1yr7 n MET 206 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1yr7 n SER 208 N -2.50 0.00 -0.11 0.00 2.88 -0.14 -2.34 113.62 111.42 1yr7 n SER 208 Ca -0.01 0.49 -0.02 0.00 -1.33 0.00 0.00 58.87 57.99 1yr7 n SER 208 Cb 0.39 -0.49 0.21 0.00 -0.75 0.00 0.00 64.21 63.57 1yr7 n SER 208 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yr7 h MET 209 N 0.00 0.78 0.00 -1.46 -0.00 -1.70 -3.43 114.93 109.11 1yr7 h MET 209 Ca 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 59.70 59.55 1yr7 h MET 209 Cb 0.04 -0.12 0.00 0.00 -0.00 0.00 0.00 31.60 31.52 1yr7 h MET 209 CO 0.00 0.71 0.00 0.00 -0.00 0.00 0.00 176.91 177.62 1yr7 n MET 210 N -4.28 0.00 0.27 -0.10 0.00 -0.99 -2.87 117.12 109.15 1yr7 n MET 210 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 57.70 57.58 1yr7 n MET 210 Cb 0.22 0.00 -0.08 0.00 0.00 0.00 0.00 33.22 33.36 1yr7 n MET 210 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 175.97 177.76 1yr7 h THR 211 N 0.00 0.45 0.00 3.17 1.35 -1.91 -3.35 112.91 112.61 1yr7 h THR 211 Ca 0.00 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1yr7 h THR 211 Cb 0.00 0.56 0.00 0.00 -1.73 0.00 0.00 68.15 66.98 1yr7 h THR 211 CO 0.00 0.04 0.00 -0.62 -0.25 0.00 0.00 175.52 174.69 1yr7 n GLU 212 N -5.32 0.00 0.00 4.72 -0.58 -1.14 -4.07 120.64 114.25 1yr7 n GLU 212 Ca -0.11 0.24 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 1yr7 n GLU 212 Cb 0.31 -1.16 0.00 0.00 -0.57 0.00 0.00 31.44 30.02 1yr7 n GLU 212 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1yr7 n VAL 213 N -1.09 0.00 0.00 2.62 0.24 -1.26 -4.77 118.33 114.07 1yr7 n VAL 213 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1yr7 n VAL 213 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1yr7 n VAL 213 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1yr7 n LEU 214 N -0.35 0.00 -0.02 1.34 -0.00 -1.26 -5.06 117.00 111.66 1yr7 n LEU 214 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 56.00 1yr7 n LEU 214 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1yr7 n LEU 214 CO 0.00 0.00 0.11 -2.65 -0.00 0.00 0.00 177.39 174.85 1yr7 n PRO 215 N 0.00 -0.02 0.00 1.96 -0.02 -1.26 -4.39 135.00 131.27 1yr7 n PRO 215 Ca 0.00 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1yr7 n PRO 215 Cb 0.00 -0.37 0.00 0.00 -0.02 0.00 0.00 33.50 33.11 1yr7 n PRO 215 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1yr7 n PRO 216 N -2.66 2.93 -3.59 0.52 -0.02 -1.26 -4.72 135.00 126.21 1yr7 n PRO 216 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.24 1yr7 n PRO 216 Cb 0.01 0.00 0.08 0.00 -0.02 0.00 0.00 33.50 33.57 1yr7 n PRO 216 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1yr7 n VAL 217 N 0.00 -3.04 -1.70 -1.45 0.24 -1.26 -4.99 118.33 106.12 1yr7 n VAL 217 Ca 0.00 -0.01 -0.43 0.00 -2.04 0.00 0.00 64.34 61.86 1yr7 n VAL 217 Cb 0.00 -4.00 -0.01 0.00 -1.47 0.00 0.00 33.84 28.36 1yr7 n VAL 217 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1yr7 n ARG 218 N -4.96 2.20 -3.02 7.34 0.63 -1.26 -4.91 116.66 112.68 1yr7 n ARG 218 Ca 0.00 0.77 -0.39 0.00 -0.92 0.00 0.00 57.85 57.31 1yr7 n ARG 218 Cb 0.56 -2.39 -0.06 0.00 0.45 0.00 0.00 32.46 31.03 1yr7 n ARG 218 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1yr7 s VAL 219 N -0.93 4.57 0.10 5.15 1.01 -1.26 -4.74 120.40 124.30 1yr7 s VAL 219 Ca 0.57 1.61 -0.13 0.00 0.00 0.00 0.00 61.98 64.03 1yr7 s VAL 219 Cb -0.57 -4.10 -0.06 0.00 0.00 0.00 0.00 36.38 31.66 1yr7 s VAL 219 CO 0.60 0.46 0.47 -0.76 0.00 0.00 0.00 175.10 175.88 1yr7 s LEU 220 N -0.66 4.37 -0.35 3.92 1.43 -0.58 -4.98 118.68 121.84 1yr7 s LEU 220 Ca 0.36 0.97 -0.06 0.00 -1.03 0.00 0.00 54.13 54.36 1yr7 s LEU 220 Cb -0.21 -3.04 0.05 0.00 0.03 0.00 0.00 46.19 43.01 1yr7 s LEU 220 CO 0.24 0.17 0.12 -0.31 0.23 0.00 0.00 176.35 176.80 1yr7 s TYR 221 N -1.36 3.28 0.23 0.29 2.02 -1.26 -0.62 117.35 119.92 1yr7 s TYR 221 Ca 0.33 -1.48 0.10 0.00 -0.37 0.00 0.00 57.07 55.66 1yr7 s TYR 221 Cb -0.15 -2.38 -0.04 0.00 -0.40 0.00 0.00 41.96 38.99 1yr7 s TYR 221 CO 0.18 -0.75 -0.13 -0.51 -1.57 0.00 0.00 175.55 172.77 1yr7 s LEU 222 N 1.39 2.83 -0.14 -1.29 1.43 0.12 -3.62 118.68 119.41 1yr7 s LEU 222 Ca -0.01 -0.75 -0.06 0.00 -1.03 0.00 0.00 54.13 52.28 1yr7 s LEU 222 Cb -0.20 -1.45 0.06 0.00 0.03 0.00 0.00 46.19 44.63 1yr7 s LEU 222 CO 0.02 0.07 0.30 -0.55 0.23 0.00 0.00 176.35 176.42 1yr7 s SER 223 N -3.16 -0.03 0.47 2.29 0.15 -0.62 -2.51 113.70 110.30 1yr7 s SER 223 Ca 0.27 0.67 0.31 0.00 0.70 0.00 0.00 55.95 57.90 1yr7 s SER 223 Cb -0.07 0.71 1.21 0.00 -1.71 0.00 0.00 66.02 66.16 1yr7 s SER 223 CO 0.15 -0.21 1.90 0.00 1.20 0.00 0.00 173.24 176.28 1yr7 h ALA 224 N 7.79 1.00 0.08 5.45 0.00 -1.92 0.24 119.26 131.89 1yr7 h ALA 224 Ca -0.25 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 1yr7 h ALA 224 Cb 1.13 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.94 1yr7 h ALA 224 CO 0.23 0.00 -0.45 -0.22 0.00 0.00 0.00 179.25 178.80 1yr7 h LYS 225 N 0.00 0.17 -0.02 0.00 3.64 -1.96 -3.36 116.57 115.03 1yr7 h LYS 225 Ca 0.00 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1yr7 h LYS 225 Cb 0.52 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1yr7 h LYS 225 CO 0.00 1.14 -0.34 0.25 -2.27 0.00 0.00 179.45 178.22 1yr7 n THR 226 N -4.34 0.00 -1.60 1.00 -2.24 -1.22 -4.95 114.28 100.92 1yr7 n THR 226 Ca -0.12 -0.33 -0.19 0.00 -2.27 0.00 0.00 64.05 61.14 1yr7 n THR 226 Cb 0.67 1.28 -0.08 0.00 -2.10 0.00 0.00 70.33 70.10 1yr7 n THR 226 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1yr7 n ARG 227 N 0.20 -1.35 -1.69 -0.78 1.74 0.06 -4.95 116.66 109.89 1yr7 n ARG 227 Ca 0.09 1.17 -0.43 0.00 -0.77 0.00 0.00 57.85 57.90 1yr7 n ARG 227 Cb 0.45 -5.50 -0.02 0.00 -1.02 0.00 0.00 32.46 26.38 1yr7 n ARG 227 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1yr7 n GLU 228 N -2.46 2.12 0.00 5.56 2.13 -1.14 -2.70 120.64 124.16 1yr7 n GLU 228 Ca -0.19 0.75 0.00 0.00 0.66 0.00 0.00 57.16 58.38 1yr7 n GLU 228 Cb 0.64 -2.37 0.00 0.00 0.27 0.00 0.00 31.44 29.97 1yr7 n GLU 228 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1yr7 n GLY 229 N 1.44 3.02 0.28 8.31 0.00 -1.24 -1.58 105.19 115.42 1yr7 n GLY 229 Ca 0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.16 1yr7 n GLY 229 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1yr7 h PHE 230 N 0.00 0.50 -0.59 1.61 -1.00 -1.80 -0.43 116.94 115.23 1yr7 h PHE 230 Ca 0.00 0.04 -0.04 0.00 2.81 0.00 0.00 57.97 60.77 1yr7 h PHE 230 Cb 0.00 -0.10 -0.03 0.00 3.61 0.00 0.00 35.95 39.43 1yr7 h PHE 230 CO 0.00 0.04 0.19 0.93 -1.61 0.00 0.00 178.31 177.86 1yr7 h GLU 231 N 0.42 0.89 -0.58 1.51 3.07 -1.90 0.38 114.58 118.37 1yr7 h GLU 231 Ca 0.42 -0.17 -0.02 0.00 -0.50 0.00 0.00 59.36 59.09 1yr7 h GLU 231 Cb 0.66 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.41 1yr7 h GLU 231 CO -0.42 0.77 0.27 -0.44 -1.40 0.00 0.00 179.01 177.78 1yr7 h ASP 232 N 0.86 0.77 0.10 1.42 3.45 -1.54 -0.67 116.42 120.82 1yr7 h ASP 232 Ca 0.20 -0.14 -0.00 0.00 0.43 0.00 0.00 57.03 57.51 1yr7 h ASP 232 Cb 0.25 -0.20 0.00 0.00 -0.56 0.00 0.00 39.33 38.82 1yr7 h ASP 232 CO -0.01 0.70 -0.05 0.25 -1.57 0.00 0.00 179.24 178.56 1yr7 h LEU 233 N 0.80 -0.11 -0.80 1.55 5.85 -0.57 0.14 115.31 122.17 1yr7 h LEU 233 Ca 0.20 -0.18 0.16 0.00 0.84 0.00 0.00 57.88 58.90 1yr7 h LEU 233 Cb 0.14 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 41.10 1yr7 h LEU 233 CO -0.02 0.11 0.34 -0.08 -0.34 0.00 0.00 178.44 178.45 1yr7 h GLU 234 N -0.34 0.46 -0.01 1.25 4.81 -0.23 -0.26 114.58 120.26 1yr7 h GLU 234 Ca -0.01 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1yr7 h GLU 234 Cb 0.28 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 1yr7 h GLU 234 CO 0.02 0.30 0.00 1.15 -0.73 0.00 0.00 179.01 179.75 1yr7 h THR 235 N 0.47 1.24 -0.25 0.32 2.02 -0.76 -2.67 112.91 113.28 1yr7 h THR 235 Ca 0.45 -0.71 0.07 0.00 0.77 0.00 0.00 66.41 66.99 1yr7 h THR 235 Cb 0.71 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.80 1yr7 h THR 235 CO -0.42 0.19 0.18 -0.07 0.37 0.00 0.00 175.52 175.76 1yr7 h LEU 236 N -0.28 0.01 0.14 2.58 3.38 0.15 -1.34 115.31 119.96 1yr7 h LEU 236 Ca 0.00 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.72 1yr7 h LEU 236 Cb 0.30 -0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.08 1yr7 h LEU 236 CO 0.00 0.01 -1.09 0.00 0.09 0.00 0.00 178.44 177.45 1yr7 h ALA 237 N 1.88 -0.06 -0.42 1.53 0.00 -0.82 -1.07 119.26 120.30 1yr7 h ALA 237 Ca 0.12 -0.74 -0.12 0.00 0.00 0.00 0.00 54.91 54.16 1yr7 h ALA 237 Cb 0.45 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1yr7 h ALA 237 CO -0.00 0.55 -0.22 -0.92 0.00 0.00 0.00 179.25 178.65 1yr7 h TYR 238 N 0.01 0.98 -0.06 0.00 3.20 -1.38 -1.31 116.97 118.41 1yr7 h TYR 238 Ca -0.18 -0.23 -0.02 0.00 3.14 0.00 0.00 58.73 61.45 1yr7 h TYR 238 Cb 1.82 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 39.85 1yr7 h TYR 238 CO 0.15 0.99 -0.05 0.93 -1.64 0.00 0.00 178.16 178.54 1yr7 h GLU 239 N 0.74 0.08 0.10 1.82 5.08 -1.23 -1.47 114.58 119.71 1yr7 h GLU 239 Ca 0.10 -0.01 -0.26 0.00 -1.00 0.00 0.00 59.36 58.19 1yr7 h GLU 239 Cb 0.76 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.99 1yr7 h GLU 239 CO 0.06 0.14 -1.19 1.25 -1.00 0.00 0.00 179.01 178.27 1yr7 h HIS 240 N 0.08 0.38 0.00 4.33 2.76 -0.97 -3.07 115.15 118.66 1yr7 h HIS 240 Ca 0.02 -0.28 0.00 0.00 -2.20 0.00 0.00 60.37 57.91 1yr7 h HIS 240 Cb 0.14 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.09 1yr7 h HIS 240 CO 0.00 1.22 0.00 -0.92 -1.30 0.00 0.00 177.93 176.93 1yr7 h TYR 241 N 0.06 0.00 -0.00 5.26 3.20 -0.62 -3.51 116.97 121.35 1yr7 h TYR 241 Ca -0.11 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.76 1yr7 h TYR 241 Cb 1.93 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.20 1yr7 h TYR 241 CO 0.05 0.00 0.00 0.00 -1.64 0.00 0.00 178.16 176.57