#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yr9 s SER 500 N 0.00 -0.09 0.04 0.00 1.04 -1.26 -4.86 113.70 108.56 1yr9 s SER 500 Ca 0.00 -0.29 -0.26 0.00 0.48 0.00 0.00 55.95 55.88 1yr9 s SER 500 Cb 0.00 0.32 -0.05 0.00 0.10 0.00 0.00 66.02 66.38 1yr9 s SER 500 CO 0.00 -0.59 0.79 -0.04 0.98 0.00 0.00 173.24 174.38 1yr9 s MET 1 N -2.72 4.52 -0.08 4.02 1.00 -0.61 -4.97 119.30 120.46 1yr9 s MET 1 Ca 0.15 1.11 0.03 0.00 0.00 0.00 0.00 55.69 56.98 1yr9 s MET 1 Cb 0.02 -3.38 0.01 0.00 0.00 0.00 0.00 34.83 31.47 1yr9 s MET 1 CO -0.01 0.24 -0.19 0.42 0.00 0.00 0.00 175.02 175.48 1yr9 s ILE 2 N 0.09 1.67 -0.15 2.53 1.01 -1.26 -0.24 121.20 124.85 1yr9 s ILE 2 Ca 0.40 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 60.26 1yr9 s ILE 2 Cb -0.21 -1.47 0.02 0.00 0.01 0.00 0.00 42.46 40.82 1yr9 s ILE 2 CO 0.24 0.47 -0.15 -0.69 0.00 0.00 0.00 174.94 174.81 1yr9 s VAL 3 N 0.46 1.67 -0.28 2.92 1.01 -0.35 -2.04 120.40 123.79 1yr9 s VAL 3 Ca -0.17 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.00 1yr9 s VAL 3 Cb -0.17 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.62 1yr9 s VAL 3 CO 0.07 0.47 0.23 -0.69 0.00 0.00 0.00 175.10 175.18 1yr9 s VAL 4 N 1.44 5.28 -0.51 2.92 1.01 -0.42 -0.48 120.40 129.64 1yr9 s VAL 4 Ca 0.05 0.23 -0.20 0.00 0.00 0.00 0.00 61.98 62.06 1yr9 s VAL 4 Cb -0.13 -3.57 0.05 0.00 0.00 0.00 0.00 36.38 32.73 1yr9 s VAL 4 CO -0.11 0.22 0.68 -0.36 0.00 0.00 0.00 175.10 175.53 1yr9 s PHE 5 N 1.82 3.00 -0.03 5.22 0.08 -0.44 -1.58 117.98 126.05 1yr9 s PHE 5 Ca 0.09 -0.44 -0.01 0.00 0.12 0.00 0.00 56.93 56.69 1yr9 s PHE 5 Cb -0.16 -3.63 -0.04 0.00 -0.57 0.00 0.00 43.02 38.62 1yr9 s PHE 5 CO 0.11 -1.09 0.05 0.54 -0.10 0.00 0.00 175.22 174.73 1yr9 s VAL 6 N 2.88 4.55 0.00 -0.44 0.11 -0.94 -3.17 120.40 123.39 1yr9 s VAL 6 Ca 0.18 -0.37 0.00 0.00 -2.93 0.00 0.00 61.98 58.86 1yr9 s VAL 6 Cb -0.18 -3.02 0.00 0.00 -1.53 0.00 0.00 36.38 31.65 1yr9 s VAL 6 CO 0.13 0.44 0.00 0.61 -3.33 0.00 0.00 175.10 172.95 1yr9 n GLY 7 N 1.53 1.68 3.53 6.54 0.00 -1.26 -0.52 105.19 116.69 1yr9 n GLY 7 Ca -0.15 0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1yr9 n GLY 7 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1yr9 n THR 8 N -0.00 0.00 -1.54 2.61 5.66 -1.26 -4.71 114.28 115.03 1yr9 n THR 8 Ca 0.00 -0.13 -0.50 0.00 -3.05 0.00 0.00 64.05 60.37 1yr9 n THR 8 Cb 0.00 -0.83 -0.05 0.00 -1.55 0.00 0.00 70.33 67.91 1yr9 n THR 8 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1yr9 n ALA 9 N -4.09 -1.55 -0.90 1.79 0.00 -1.18 -1.45 120.51 113.13 1yr9 n ALA 9 Ca 0.08 0.48 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1yr9 n ALA 9 Cb 0.53 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 18.06 1yr9 n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yr9 n GLY 10 N 1.91 0.65 0.00 0.00 0.00 -1.26 -4.85 105.19 101.65 1yr9 n GLY 10 Ca 0.16 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.26 1yr9 n GLY 10 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1yr9 n SER 11 N -0.06 0.00 -3.16 1.61 3.41 -0.53 -4.89 113.62 110.00 1yr9 n SER 11 Ca 0.00 0.06 -0.14 0.00 -0.26 0.00 0.00 58.87 58.52 1yr9 n SER 11 Cb 0.03 -0.29 0.07 0.00 -0.26 0.00 0.00 64.21 63.77 1yr9 n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1yr9 n GLY 12 N 0.08 -0.77 0.13 5.00 0.00 -1.26 -4.76 105.19 103.62 1yr9 n GLY 12 Ca 0.08 0.36 -0.22 0.00 0.00 0.00 0.00 46.02 46.24 1yr9 n GLY 12 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1yr9 n LYS 13 N -3.37 0.66 -0.19 1.61 2.85 -1.26 -3.68 118.16 114.78 1yr9 n LYS 13 Ca -0.13 0.31 -0.06 0.00 -1.05 0.00 0.00 58.31 57.37 1yr9 n LYS 13 Cb 0.63 -1.64 -0.01 0.00 -0.65 0.00 0.00 35.03 33.36 1yr9 n LYS 13 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1yr9 h THR 14 N -0.36 0.16 -0.01 0.58 2.02 -1.95 1.38 112.91 114.73 1yr9 h THR 14 Ca -0.49 0.00 0.03 0.00 0.77 0.00 0.00 66.41 66.72 1yr9 h THR 14 Cb 1.77 0.16 -0.06 0.00 -1.74 0.00 0.00 68.15 68.28 1yr9 h THR 14 CO -0.10 0.00 -0.40 0.74 0.37 0.00 0.00 175.52 176.13 1yr9 h THR 15 N -0.19 0.18 -0.74 3.16 2.02 -1.99 -0.23 112.91 115.11 1yr9 h THR 15 Ca 0.21 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.55 1yr9 h THR 15 Cb 0.55 0.18 -0.11 0.00 -1.74 0.00 0.00 68.15 67.04 1yr9 h THR 15 CO -0.66 0.00 0.18 0.25 0.37 0.00 0.00 175.52 175.66 1yr9 h LEU 16 N -0.55 0.01 -1.06 2.58 5.85 -1.09 0.87 115.31 121.92 1yr9 h LEU 16 Ca 0.05 0.15 0.12 0.00 0.84 0.00 0.00 57.88 59.05 1yr9 h LEU 16 Cb 0.63 0.20 -0.08 0.00 0.37 0.00 0.00 40.66 41.78 1yr9 h LEU 16 CO -0.31 -0.05 0.62 0.74 -0.34 0.00 0.00 178.44 179.10 1yr9 h THR 17 N 0.26 0.91 0.15 1.05 2.02 0.31 0.39 112.91 118.00 1yr9 h THR 17 Ca 0.42 -0.33 -0.22 0.00 0.77 0.00 0.00 66.41 67.06 1yr9 h THR 17 Cb 0.73 -0.12 0.02 0.00 -1.74 0.00 0.00 68.15 67.04 1yr9 h THR 17 CO -0.52 0.17 -1.01 1.23 0.37 0.00 0.00 175.52 175.76 1yr9 h GLY 18 N 0.95 0.36 2.00 2.16 0.00 0.67 -3.25 103.07 105.95 1yr9 h GLY 18 Ca 0.49 -0.91 -0.08 0.00 0.00 0.00 0.00 47.33 46.83 1yr9 h GLY 18 CO -0.25 0.80 -0.37 -2.09 0.00 0.00 0.00 176.54 174.62 1yr9 h GLU 19 N -0.31 0.00 -0.14 4.80 4.57 0.12 -2.36 114.58 121.26 1yr9 h GLU 19 Ca -0.19 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 57.88 1yr9 h GLU 19 Cb 1.72 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.31 1yr9 h GLU 19 CO 0.14 0.37 -0.33 0.35 -1.18 0.00 0.00 179.01 178.36 1yr9 h PHE 20 N 0.00 0.60 -0.44 0.92 3.57 -0.38 -3.21 116.94 118.00 1yr9 h PHE 20 Ca -0.00 -0.23 0.01 0.00 3.53 0.00 0.00 57.97 61.28 1yr9 h PHE 20 Cb 0.72 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.33 1yr9 h PHE 20 CO 0.00 0.95 0.28 0.78 -2.23 0.00 0.00 178.31 178.09 1yr9 h GLY 21 N 0.08 0.61 1.32 2.40 0.00 -1.50 -1.84 103.07 104.14 1yr9 h GLY 21 Ca -0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 47.06 1yr9 h GLY 21 CO 0.07 0.20 0.12 3.21 0.00 0.00 0.00 176.54 180.14 1yr9 h ARG 22 N 0.56 0.85 0.00 4.80 3.08 -1.54 0.45 114.38 122.58 1yr9 h ARG 22 Ca 0.17 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1yr9 h ARG 22 Cb -0.03 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 1yr9 h ARG 22 CO -0.05 0.77 -0.10 -0.92 -1.07 0.00 0.00 179.97 178.60 1yr9 h TYR 23 N 0.81 0.00 0.00 3.04 3.20 -1.52 -2.57 116.97 119.94 1yr9 h TYR 23 Ca 0.18 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.05 1yr9 h TYR 23 Cb 0.32 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.59 1yr9 h TYR 23 CO 0.02 0.10 -0.76 1.28 -1.64 0.00 0.00 178.16 177.16 1yr9 n LEU 24 N -3.72 0.67 -0.01 2.82 4.77 0.73 -3.79 117.00 118.47 1yr9 n LEU 24 Ca -0.02 -0.14 0.14 0.00 -0.03 0.00 0.00 56.01 55.96 1yr9 n LEU 24 Cb 0.20 -0.14 0.64 0.00 -2.33 0.00 0.00 43.42 41.79 1yr9 n LEU 24 CO 0.30 0.14 0.93 1.21 -1.33 0.00 0.00 177.39 178.64 1yr9 n GLU 25 N -1.61 0.24 0.03 3.23 2.13 0.12 -0.35 120.64 124.44 1yr9 n GLU 25 Ca 0.04 -0.03 -0.09 0.00 0.66 0.00 0.00 57.16 57.74 1yr9 n GLU 25 Cb 0.36 -1.50 0.06 0.00 0.27 0.00 0.00 31.44 30.63 1yr9 n GLU 25 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1yr9 h ASP 26 N 0.07 0.53 0.00 4.31 3.32 -1.65 -3.39 116.42 119.61 1yr9 h ASP 26 Ca 0.00 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1yr9 h ASP 26 Cb 0.40 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1yr9 h ASP 26 CO 0.00 1.01 -0.03 0.59 -1.72 0.00 0.00 179.24 179.08 1yr9 n ASN 27 N -3.92 0.17 -4.17 6.45 4.13 -1.18 -5.08 115.26 111.67 1yr9 n ASN 27 Ca -0.03 -0.28 -0.17 0.00 1.68 0.00 0.00 54.58 55.78 1yr9 n ASN 27 Cb 0.63 0.59 -0.12 0.00 -1.54 0.00 0.00 39.78 39.34 1yr9 n ASN 27 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1yr9 s TYR 28 N -0.62 1.17 -0.14 3.10 1.51 0.53 -5.12 117.35 117.78 1yr9 s TYR 28 Ca 0.00 -0.50 -0.27 0.00 -1.01 0.00 0.00 57.07 55.28 1yr9 s TYR 28 Cb 0.00 -0.65 -0.01 0.00 -0.11 0.00 0.00 41.96 41.18 1yr9 s TYR 28 CO 0.00 0.05 0.91 0.15 -1.11 0.00 0.00 175.55 175.55 1yr9 s LYS 29 N -2.01 4.35 -0.12 -0.62 1.02 -1.26 -3.96 119.74 117.15 1yr9 s LYS 29 Ca -0.00 1.18 0.03 0.00 0.02 0.00 0.00 55.97 57.20 1yr9 s LYS 29 Cb -0.08 -3.56 -0.00 0.00 -0.52 0.00 0.00 37.83 33.67 1yr9 s LYS 29 CO 0.02 -0.32 -0.21 0.08 -0.92 0.00 0.00 175.35 174.00 1yr9 s VAL 30 N 2.09 2.29 0.64 3.17 1.01 -1.26 0.72 120.40 129.06 1yr9 s VAL 30 Ca 0.43 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.50 1yr9 s VAL 30 Cb -0.17 -1.90 0.09 0.00 0.00 0.00 0.00 36.38 34.40 1yr9 s VAL 30 CO 0.15 0.55 0.89 0.00 0.00 0.00 0.00 175.10 176.68 1yr9 s ALA 31 N 0.45 4.02 -0.37 5.51 0.00 -0.92 -5.02 121.76 125.43 1yr9 s ALA 31 Ca -0.15 -1.75 0.05 0.00 0.00 0.00 0.00 51.96 50.11 1yr9 s ALA 31 Cb -0.17 -1.87 0.16 0.00 0.00 0.00 0.00 23.12 21.24 1yr9 s ALA 31 CO 0.06 -1.13 0.46 0.71 0.00 0.00 0.00 175.76 175.86 1yr9 s TYR 32 N -2.92 -0.85 -0.22 0.00 2.02 -1.26 -3.07 117.35 111.05 1yr9 s TYR 32 Ca 0.63 -0.34 -0.19 0.00 -0.37 0.00 0.00 57.07 56.81 1yr9 s TYR 32 Cb -0.07 -0.14 -0.03 0.00 -0.40 0.00 0.00 41.96 41.32 1yr9 s TYR 32 CO 0.41 -1.04 0.54 0.08 -1.57 0.00 0.00 175.55 173.97 1yr9 s VAL 33 N 1.70 5.08 -0.31 0.71 1.01 0.09 -1.39 120.40 127.30 1yr9 s VAL 33 Ca 0.16 0.97 -0.09 0.00 0.00 0.00 0.00 61.98 63.02 1yr9 s VAL 33 Cb -0.11 -3.85 -0.00 0.00 0.00 0.00 0.00 36.38 32.41 1yr9 s VAL 33 CO -0.08 0.13 0.14 0.21 0.00 0.00 0.00 175.10 175.50 1yr9 s ASN 34 N 1.29 5.46 0.00 3.32 3.84 0.50 0.11 114.94 129.46 1yr9 s ASN 34 Ca 0.24 -0.57 0.21 0.00 0.21 0.00 0.00 52.86 52.95 1yr9 s ASN 34 Cb -0.15 -1.98 0.54 0.00 -0.55 0.00 0.00 41.25 39.11 1yr9 s ASN 34 CO 0.09 -0.20 1.46 0.18 -2.79 0.00 0.00 177.10 175.85 1yr9 n LEU 35 N 4.96 3.27 -4.60 3.21 4.77 0.56 -2.26 117.00 126.92 1yr9 n LEU 35 Ca -0.14 -1.55 -0.40 0.00 -0.03 0.00 0.00 56.01 53.89 1yr9 n LEU 35 Cb 0.49 -0.34 -0.08 0.00 -2.33 0.00 0.00 43.42 41.16 1yr9 n LEU 35 CO 0.33 0.77 0.25 -0.62 -1.33 0.00 0.00 177.39 176.80 1yr9 s ASP 36 N -1.20 6.39 0.00 -1.43 -1.08 -1.22 -4.22 116.67 113.91 1yr9 s ASP 36 Ca 0.41 0.34 0.18 0.00 -0.52 0.00 0.00 52.55 52.95 1yr9 s ASP 36 Cb 0.22 -2.28 0.75 0.00 -1.46 0.00 0.00 42.92 40.15 1yr9 s ASP 36 CO 0.30 -0.36 1.52 0.35 0.52 0.00 0.00 175.17 177.50 1yr9 n THR 37 N 5.27 0.17 -1.63 1.71 -2.24 -1.26 -4.36 114.28 111.94 1yr9 n THR 37 Ca -0.04 -0.24 0.04 0.00 -2.27 0.00 0.00 64.05 61.54 1yr9 n THR 37 Cb 0.49 0.15 0.06 0.00 -2.10 0.00 0.00 70.33 68.93 1yr9 n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yr9 n GLY 38 N 0.98 2.34 3.75 3.38 0.00 -1.26 -1.02 105.19 113.37 1yr9 n GLY 38 Ca 0.14 -0.49 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 1yr9 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yr9 s VAL 39 N -1.21 4.28 -0.06 1.61 0.11 -1.26 -4.97 120.40 118.90 1yr9 s VAL 39 Ca 0.14 -1.08 -0.01 0.00 -2.93 0.00 0.00 61.98 58.10 1yr9 s VAL 39 Cb 0.12 -3.14 -0.01 0.00 -1.53 0.00 0.00 36.38 31.83 1yr9 s VAL 39 CO 0.01 -0.04 0.06 0.11 -3.33 0.00 0.00 175.10 171.92 1yr9 h LYS 40 N 2.76 -0.04 0.00 1.54 6.56 -1.99 -3.49 116.57 121.92 1yr9 h LYS 40 Ca -0.47 0.00 -0.42 0.00 -1.06 0.00 0.00 60.65 58.70 1yr9 h LYS 40 Cb 1.19 0.01 -0.08 0.00 -0.57 0.00 0.00 32.23 32.78 1yr9 h LYS 40 CO 0.62 -0.03 -0.32 -0.85 -2.06 0.00 0.00 179.45 176.82 1yr9 n GLU 41 N -3.83 1.08 -3.70 3.15 0.28 -1.26 -5.16 120.64 111.20 1yr9 n GLU 41 Ca -0.01 -2.42 -0.11 0.00 -0.16 0.00 0.00 57.16 54.47 1yr9 n GLU 41 Cb 0.02 0.79 -0.11 0.00 1.43 0.00 0.00 31.44 33.56 1yr9 n GLU 41 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1yr9 s LEU 42 N 0.00 -0.03 0.00 -1.84 1.43 -1.26 -5.00 118.68 111.98 1yr9 s LEU 42 Ca 0.03 0.84 0.06 0.00 -1.03 0.00 0.00 54.13 54.03 1yr9 s LEU 42 Cb 0.00 1.26 0.37 0.00 0.03 0.00 0.00 46.19 47.85 1yr9 s LEU 42 CO 0.02 -0.19 0.83 -0.81 0.23 0.00 0.00 176.35 176.43 1yr9 n PRO 43 N 4.27 0.20 -4.20 1.29 -0.04 -1.26 -4.73 135.00 130.52 1yr9 n PRO 43 Ca -0.24 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.10 1yr9 n PRO 43 Cb 0.55 -1.49 -0.10 0.00 -0.04 0.00 0.00 33.50 32.42 1yr9 n PRO 43 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1yr9 s TYR 44 N -2.00 1.09 -0.42 0.54 -0.85 -1.26 -4.96 117.35 109.49 1yr9 s TYR 44 Ca 0.09 -1.17 -0.16 0.00 -0.52 0.00 0.00 57.07 55.31 1yr9 s TYR 44 Cb 0.04 -0.61 0.02 0.00 0.38 0.00 0.00 41.96 41.80 1yr9 s TYR 44 CO 0.07 -0.41 0.38 -2.00 -1.52 0.00 0.00 175.55 172.07 1yr9 s GLU 45 N -4.01 3.04 0.29 -3.49 2.12 -1.26 -5.04 118.70 110.34 1yr9 s GLU 45 Ca 0.27 -0.88 -0.29 0.00 0.36 0.00 0.00 54.97 54.43 1yr9 s GLU 45 Cb 0.07 -3.98 -0.09 0.00 0.26 0.00 0.00 34.13 30.39 1yr9 s GLU 45 CO 0.05 -0.81 1.08 -1.25 -0.54 0.00 0.00 175.26 173.79 1yr9 s PRO 46 N 1.93 4.61 0.01 4.30 0.04 -1.26 -4.67 135.00 139.96 1yr9 s PRO 46 Ca 0.09 1.75 -0.21 0.00 0.04 0.00 0.00 61.00 62.67 1yr9 s PRO 46 Cb -0.18 -3.13 -0.18 0.00 0.04 0.00 0.00 34.50 31.05 1yr9 s PRO 46 CO 0.12 0.20 1.24 0.66 0.04 0.00 0.00 177.00 179.26 1yr9 h SER 47 N 3.71 0.36 -3.41 6.66 4.64 -1.59 -3.45 113.55 120.47 1yr9 h SER 47 Ca -0.47 -0.58 -0.66 0.00 -0.47 0.00 0.00 61.79 59.61 1yr9 h SER 47 Cb 1.21 -0.10 -0.28 0.00 -0.31 0.00 0.00 62.40 62.92 1yr9 h SER 47 CO 0.66 0.88 -0.79 -0.63 -0.87 0.00 0.00 176.83 176.08 1yr9 s ILE 48 N -3.90 2.86 -0.07 0.95 1.01 -1.14 -5.03 121.20 115.88 1yr9 s ILE 48 Ca -0.14 -0.74 0.00 0.00 0.00 0.00 0.00 60.65 59.77 1yr9 s ILE 48 Cb 0.04 -2.18 0.02 0.00 0.01 0.00 0.00 42.46 40.36 1yr9 s ILE 48 CO 0.76 0.54 -0.05 -0.62 0.00 0.00 0.00 174.94 175.57 1yr9 s ASP 49 N 0.23 1.53 0.53 3.58 -1.08 -1.26 -0.37 116.67 119.83 1yr9 s ASP 49 Ca -0.10 -0.18 0.32 0.00 -0.52 0.00 0.00 52.55 52.07 1yr9 s ASP 49 Cb -0.16 -0.59 1.28 0.00 -1.46 0.00 0.00 42.92 41.99 1yr9 s ASP 49 CO 0.06 -0.10 1.95 -0.37 0.52 0.00 0.00 175.17 177.23 1yr9 h VAL 50 N 6.18 0.11 0.18 1.11 -1.51 -1.74 -3.19 116.25 117.39 1yr9 h VAL 50 Ca -0.30 -0.63 -0.01 0.00 -1.23 0.00 0.00 66.70 64.54 1yr9 h VAL 50 Cb 1.14 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 31.87 1yr9 h VAL 50 CO 0.40 0.04 -0.09 0.03 -1.23 0.00 0.00 177.57 176.72 1yr9 h ARG 51 N 0.00 -0.23 -1.04 5.19 3.08 -1.82 -1.63 114.38 117.93 1yr9 h ARG 51 Ca -0.00 0.02 0.30 0.00 0.07 0.00 0.00 59.98 60.37 1yr9 h ARG 51 Cb 0.56 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.62 1yr9 h ARG 51 CO 0.01 -0.04 0.96 0.39 -1.07 0.00 0.00 179.97 180.22 1yr9 n GLU 52 N -5.13 0.01 -0.07 0.04 1.02 -1.21 0.23 120.64 115.53 1yr9 n GLU 52 Ca -0.09 0.77 -0.22 0.00 -0.02 0.00 0.00 57.16 57.60 1yr9 n GLU 52 Cb 0.17 -1.86 -0.12 0.00 -0.02 0.00 0.00 31.44 29.60 1yr9 n GLU 52 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1yr9 n PHE 53 N -2.99 0.84 -3.64 -0.32 7.35 -0.81 -5.04 117.46 112.84 1yr9 n PHE 53 Ca 0.23 0.24 -0.06 0.00 -0.76 0.00 0.00 57.45 57.11 1yr9 n PHE 53 Cb 1.28 -1.10 -0.07 0.00 0.35 0.00 0.00 39.48 39.94 1yr9 n PHE 53 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1yr9 s VAL 54 N -2.49 0.00 -0.10 -2.13 0.11 0.63 -5.16 120.40 111.26 1yr9 s VAL 54 Ca -0.28 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 58.79 1yr9 s VAL 54 Cb 0.08 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.91 1yr9 s VAL 54 CO 0.66 0.00 -0.15 0.42 -3.33 0.00 0.00 175.10 172.69 1yr9 s THR 55 N 1.18 2.90 0.23 5.04 -4.23 -1.26 -3.92 115.64 115.58 1yr9 s THR 55 Ca -0.07 -0.74 -0.09 0.00 -1.18 0.00 0.00 61.69 59.61 1yr9 s THR 55 Cb -0.04 -2.17 0.22 0.00 1.34 0.00 0.00 72.50 71.84 1yr9 s THR 55 CO -0.14 0.55 1.66 0.58 -0.54 0.00 0.00 174.62 176.74 1yr9 h VAL 56 N 5.05 0.48 -1.13 2.29 2.07 -1.45 0.42 116.25 123.98 1yr9 h VAL 56 Ca -0.32 -0.05 0.38 0.00 0.82 0.00 0.00 66.70 67.52 1yr9 h VAL 56 Cb 1.19 0.31 -0.14 0.00 -1.52 0.00 0.00 31.29 31.13 1yr9 h VAL 56 CO 0.53 0.03 0.68 -0.33 0.02 0.00 0.00 177.57 178.50 1yr9 h GLU 57 N 0.16 0.17 0.00 1.57 3.07 -1.94 -1.17 114.58 116.44 1yr9 h GLU 57 Ca 0.36 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 1yr9 h GLU 57 Cb 0.60 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.47 1yr9 h GLU 57 CO -0.54 0.12 0.00 -1.91 -1.40 0.00 0.00 179.01 175.27 1yr9 n GLU 58 N -4.91 0.00 0.14 2.33 4.07 0.15 -2.47 120.64 119.94 1yr9 n GLU 58 Ca 0.34 0.32 0.00 0.00 -0.06 0.00 0.00 57.16 57.76 1yr9 n GLU 58 Cb 1.21 -1.11 0.00 0.00 -0.06 0.00 0.00 31.44 31.48 1yr9 n GLU 58 CO 0.00 0.00 0.00 0.44 -0.06 0.00 0.00 177.13 177.51 1yr9 n ILE 59 N -1.45 0.00 0.00 6.31 -0.00 -0.90 0.69 119.36 124.01 1yr9 n ILE 59 Ca 0.00 0.63 -0.00 0.00 -0.00 0.00 0.00 62.75 63.38 1yr9 n ILE 59 Cb 0.00 -1.49 -0.00 0.00 -0.00 0.00 0.00 39.64 38.15 1yr9 n ILE 59 CO 0.00 0.00 0.00 0.24 -0.00 0.00 0.00 176.55 176.79 1yr9 h MET 60 N 0.00 -0.03 0.00 6.28 2.86 -1.10 -2.93 114.93 120.01 1yr9 h MET 60 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1yr9 h MET 60 Cb 1.27 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.94 1yr9 h MET 60 CO 0.00 -0.02 0.00 2.89 1.06 0.00 0.00 176.91 180.84 1yr9 n ARG 61 N -2.67 0.00 -0.02 1.72 1.85 0.22 0.33 116.66 118.09 1yr9 n ARG 61 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 56.82 1yr9 n ARG 61 Cb 0.01 -0.95 -0.03 0.00 -1.05 0.00 0.00 32.46 30.44 1yr9 n ARG 61 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1yr9 n GLU 62 N 0.03 1.90 0.00 2.89 1.02 -1.01 -5.07 120.64 120.40 1yr9 n GLU 62 Ca 0.00 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1yr9 n GLU 62 Cb 0.00 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 30.33 1yr9 n GLU 62 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yr9 n GLY 63 N 3.00 -0.67 3.18 0.62 0.00 0.15 -5.11 105.19 106.36 1yr9 n GLY 63 Ca -0.07 0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.96 1yr9 n GLY 63 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1yr9 n TYR 64 N 0.00 -3.57 -2.87 1.61 4.01 -1.11 -4.90 117.16 110.32 1yr9 n TYR 64 Ca 0.00 0.14 -0.19 0.00 -0.16 0.00 0.00 57.90 57.70 1yr9 n TYR 64 Cb 0.00 -1.60 0.08 0.00 -0.31 0.00 0.00 39.34 37.50 1yr9 n TYR 64 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yr9 n GLY 65 N 2.72 1.50 0.00 2.72 0.00 -1.26 -4.35 105.19 106.51 1yr9 n GLY 65 Ca 0.03 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.90 1yr9 n GLY 65 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1yr9 n PRO 66 N -2.32 0.00 -0.13 1.61 -0.02 -1.26 0.11 135.00 132.99 1yr9 n PRO 66 Ca 0.15 0.71 0.16 0.00 -2.02 0.00 0.00 63.50 62.49 1yr9 n PRO 66 Cb 0.54 -1.16 0.54 0.00 -0.02 0.00 0.00 33.50 33.40 1yr9 n PRO 66 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1yr9 h ASN 67 N 0.00 0.32 0.48 2.55 2.35 -2.00 -1.64 115.58 117.63 1yr9 h ASN 67 Ca 0.00 0.02 -0.25 0.00 -0.55 0.00 0.00 56.30 55.52 1yr9 h ASN 67 Cb 0.00 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.33 1yr9 h ASN 67 CO 0.00 0.17 -1.08 1.23 -1.65 0.00 0.00 177.43 176.10 1yr9 h GLY 68 N 0.34 0.38 0.88 2.83 0.00 -1.72 -3.04 103.07 102.74 1yr9 h GLY 68 Ca 0.34 -0.80 -0.03 0.00 0.00 0.00 0.00 47.33 46.85 1yr9 h GLY 68 CO -0.09 0.70 -0.26 0.00 0.00 0.00 0.00 176.54 176.89 1yr9 h ALA 69 N 0.67 -0.72 -0.85 3.60 0.00 0.57 -2.56 119.26 119.97 1yr9 h ALA 69 Ca -0.11 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 54.72 1yr9 h ALA 69 Cb 1.76 0.28 -0.12 0.00 0.00 0.00 0.00 17.79 19.71 1yr9 h ALA 69 CO 0.18 -0.84 -0.53 0.82 0.00 0.00 0.00 179.25 178.88 1yr9 h ILE 70 N -0.85 0.01 -0.07 0.00 1.08 -1.46 0.63 117.51 116.85 1yr9 h ILE 70 Ca -0.07 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.41 1yr9 h ILE 70 Cb 0.61 0.01 -0.00 0.00 -3.07 0.00 0.00 36.82 34.36 1yr9 h ILE 70 CO 0.12 0.00 0.05 0.58 -0.69 0.00 0.00 178.15 178.21 1yr9 h VAL 71 N -0.09 0.97 0.02 1.67 2.07 -1.51 -2.22 116.25 117.16 1yr9 h VAL 71 Ca 0.18 -0.00 -0.26 0.00 0.82 0.00 0.00 66.70 67.45 1yr9 h VAL 71 Cb 0.49 0.97 0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1yr9 h VAL 71 CO -0.86 0.00 -1.01 -0.08 0.02 0.00 0.00 177.57 175.64 1yr9 h GLU 72 N 0.00 0.65 -0.61 1.57 4.57 -0.52 -2.61 114.58 117.64 1yr9 h GLU 72 Ca 0.03 -0.72 0.09 0.00 -1.18 0.00 0.00 59.36 57.58 1yr9 h GLU 72 Cb 0.12 0.21 -0.07 0.00 -0.16 0.00 0.00 28.75 28.85 1yr9 h GLU 72 CO -0.00 1.31 0.22 0.77 -1.18 0.00 0.00 179.01 180.13 1yr9 h SER 73 N 0.29 0.21 0.83 1.04 0.02 -0.49 0.31 113.55 115.77 1yr9 h SER 73 Ca -0.13 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1yr9 h SER 73 Cb 1.68 0.06 0.00 0.00 0.14 0.00 0.00 62.40 64.28 1yr9 h SER 73 CO 0.20 0.13 -0.23 -1.22 -1.14 0.00 0.00 176.83 174.56 1yr9 n TYR 74 N -5.00 0.10 0.04 3.45 4.01 -1.06 -1.13 117.16 117.57 1yr9 n TYR 74 Ca 0.09 0.03 -0.05 0.00 -0.16 0.00 0.00 57.90 57.81 1yr9 n TYR 74 Cb 0.28 -0.44 -0.09 0.00 -0.31 0.00 0.00 39.34 38.77 1yr9 n TYR 74 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1yr9 h ASP 75 N 0.00 0.00 1.59 7.72 3.32 -0.88 -2.96 116.42 125.21 1yr9 h ASP 75 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1yr9 h ASP 75 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 1yr9 h ASP 75 CO 0.00 0.83 -0.20 0.03 -1.72 0.00 0.00 179.24 178.19 1yr9 h ARG 76 N 0.00 0.00 0.21 3.56 3.08 -0.09 -3.33 114.38 117.81 1yr9 h ARG 76 Ca -0.12 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.59 1yr9 h ARG 76 Cb 1.74 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.81 1yr9 h ARG 76 CO 0.09 0.00 -1.56 -0.07 -1.07 0.00 0.00 179.97 177.35 1yr9 h LEU 77 N 0.00 0.69 -0.27 3.04 -0.00 -1.19 -3.24 115.31 114.34 1yr9 h LEU 77 Ca 0.00 -0.84 0.00 0.00 -0.00 0.00 0.00 57.88 57.04 1yr9 h LEU 77 Cb 0.89 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 41.33 1yr9 h LEU 77 CO 0.00 1.68 0.00 0.80 -0.00 0.00 0.00 178.44 180.92 1yr9 n MET 78 N -3.63 0.00 -0.02 1.13 1.56 -1.12 -1.16 117.12 113.88 1yr9 n MET 78 Ca -0.19 0.00 -0.03 0.00 -0.27 0.00 0.00 57.70 57.21 1yr9 n MET 78 Cb 1.08 -1.00 -0.02 0.00 2.15 0.00 0.00 33.22 35.44 1yr9 n MET 78 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 1yr9 n GLU 79 N -0.23 0.10 -0.45 2.12 1.02 -1.22 -4.42 120.64 117.55 1yr9 n GLU 79 Ca 0.00 0.03 -0.04 0.00 -0.02 0.00 0.00 57.16 57.13 1yr9 n GLU 79 Cb 0.00 -0.96 0.12 0.00 -0.02 0.00 0.00 31.44 30.58 1yr9 n GLU 79 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1yr9 n LYS 80 N -2.79 2.04 0.08 3.49 4.81 -0.31 -4.63 118.16 120.85 1yr9 n LYS 80 Ca -0.08 -1.28 -0.03 0.00 -0.87 0.00 0.00 58.31 56.05 1yr9 n LYS 80 Cb 0.57 -1.64 -0.02 0.00 0.02 0.00 0.00 35.03 33.96 1yr9 n LYS 80 CO 0.00 0.00 0.00 0.35 1.17 0.00 0.00 177.40 178.92 1yr9 h PHE 81 N 0.99 -0.20 -0.46 5.64 3.57 -1.50 0.30 116.94 125.28 1yr9 h PHE 81 Ca 0.14 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.75 1yr9 h PHE 81 Cb 1.48 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 40.27 1yr9 h PHE 81 CO 0.57 -0.13 0.32 -0.97 -2.23 0.00 0.00 178.31 175.88 1yr9 h ASN 82 N -0.31 0.09 0.00 0.41 -1.24 -1.89 0.79 115.58 113.44 1yr9 h ASN 82 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.99 1yr9 h ASN 82 Cb 0.17 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.20 1yr9 h ASN 82 CO 0.04 0.05 0.00 1.21 -1.29 0.00 0.00 177.43 177.44 1yr9 n GLU 83 N -4.43 0.00 -0.39 6.67 2.13 -1.23 -3.19 120.64 120.21 1yr9 n GLU 83 Ca 0.08 0.47 0.32 0.00 0.66 0.00 0.00 57.16 58.69 1yr9 n GLU 83 Cb 0.46 -1.40 0.63 0.00 0.27 0.00 0.00 31.44 31.40 1yr9 n GLU 83 CO 0.00 0.00 0.00 1.88 -0.41 0.00 0.00 177.13 178.60 1yr9 h TYR 84 N 0.00 0.42 0.00 4.31 0.05 0.23 -1.61 116.97 120.37 1yr9 h TYR 84 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1yr9 h TYR 84 Cb 0.00 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 37.63 1yr9 h TYR 84 CO 0.19 -0.04 0.00 -0.11 -1.05 0.00 0.00 178.16 177.14 1yr9 n LEU 85 N -4.50 0.00 -0.15 3.88 7.94 0.25 -3.05 117.00 121.37 1yr9 n LEU 85 Ca 0.30 0.31 0.14 0.00 -1.11 0.00 0.00 56.01 55.66 1yr9 n LEU 85 Cb 1.21 0.00 0.26 0.00 0.53 0.00 0.00 43.42 45.43 1yr9 n LEU 85 CO 0.29 0.00 0.48 0.59 -1.11 0.00 0.00 177.39 177.64 1yr9 n ASN 86 N -0.36 0.15 0.18 1.96 3.02 -0.82 0.35 115.26 119.74 1yr9 n ASN 86 Ca 0.00 0.76 0.18 0.00 -0.03 0.00 0.00 54.58 55.50 1yr9 n ASN 86 Cb 0.00 -0.37 0.75 0.00 -0.61 0.00 0.00 39.78 39.56 1yr9 n ASN 86 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1yr9 h LYS 87 N 0.00 0.00 0.00 3.52 1.57 -1.24 -0.19 116.57 120.23 1yr9 h LYS 87 Ca 0.38 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.97 1yr9 h LYS 87 Cb 1.01 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.28 1yr9 h LYS 87 CO -0.36 0.00 -1.86 -0.89 -0.57 0.00 0.00 179.45 175.77 1yr9 n ILE 88 N -3.39 0.96 -0.03 1.86 5.41 1.07 -4.02 119.36 121.21 1yr9 n ILE 88 Ca 0.04 -0.70 -0.14 0.00 1.00 0.00 0.00 62.75 62.96 1yr9 n ILE 88 Cb 0.55 -0.47 -0.11 0.00 -0.71 0.00 0.00 39.64 38.91 1yr9 n ILE 88 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1yr9 h LEU 89 N 0.00 0.07 0.00 1.39 3.38 -1.08 -2.59 115.31 116.48 1yr9 h LEU 89 Ca -0.24 -0.67 0.00 0.00 0.09 0.00 0.00 57.88 57.05 1yr9 h LEU 89 Cb 1.65 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.37 1yr9 h LEU 89 CO 0.03 0.74 0.01 0.54 0.09 0.00 0.00 178.44 179.85 1yr9 n ARG 90 N -4.70 0.00 -0.02 1.13 1.74 -0.44 0.43 116.66 114.79 1yr9 n ARG 90 Ca -0.09 0.12 0.06 0.00 -0.77 0.00 0.00 57.85 57.17 1yr9 n ARG 90 Cb 0.37 -1.51 -0.15 0.00 -1.02 0.00 0.00 32.46 30.15 1yr9 n ARG 90 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1yr9 n LEU 91 N -1.09 0.00 0.47 0.55 7.99 -1.07 -4.46 117.00 119.38 1yr9 n LEU 91 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 56.01 55.81 1yr9 n LEU 91 Cb 0.01 0.09 -0.09 0.00 -0.11 0.00 0.00 43.42 43.32 1yr9 n LEU 91 CO 0.00 0.09 0.53 -0.33 -1.51 0.00 0.00 177.39 176.17 1yr9 h GLU 92 N 0.00 -1.16 -1.28 3.23 4.39 0.35 -3.23 114.58 116.88 1yr9 h GLU 92 Ca -0.10 0.08 -0.21 0.00 0.34 0.00 0.00 59.36 59.47 1yr9 h GLU 92 Cb 1.12 0.26 -0.11 0.00 -0.10 0.00 0.00 28.75 29.93 1yr9 h GLU 92 CO 0.01 -0.77 0.27 1.63 -1.16 0.00 0.00 179.01 178.99 1yr9 n LYS 93 N -5.29 1.52 -0.50 2.33 4.01 -1.21 -2.35 118.16 116.68 1yr9 n LYS 93 Ca -0.15 -1.13 0.00 0.00 -0.51 0.00 0.00 58.31 56.52 1yr9 n LYS 93 Cb 0.48 -1.44 0.00 0.00 -0.51 0.00 0.00 35.03 33.56 1yr9 n LYS 93 CO 0.00 0.00 0.00 -0.85 -1.11 0.00 0.00 177.40 175.44 1yr9 n GLU 94 N 0.22 0.00 -3.70 1.97 0.28 -1.23 -5.11 120.64 113.08 1yr9 n GLU 94 Ca 0.22 -0.78 -0.14 0.00 -0.16 0.00 0.00 57.16 56.30 1yr9 n GLU 94 Cb 0.76 -0.39 -0.08 0.00 1.43 0.00 0.00 31.44 33.16 1yr9 n GLU 94 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1yr9 s ASN 95 N -0.77 -0.31 -0.14 -1.84 0.01 -0.99 -4.94 114.94 105.96 1yr9 s ASN 95 Ca 0.00 0.28 -0.11 0.00 -0.71 0.00 0.00 52.86 52.31 1yr9 s ASN 95 Cb 0.00 0.40 -0.09 0.00 0.41 0.00 0.00 41.25 41.97 1yr9 s ASN 95 CO 0.00 -0.46 0.12 0.44 -1.51 0.00 0.00 177.10 175.68 1yr9 h ASP 96 N 3.78 0.00 -3.29 -1.22 3.32 0.04 -3.44 116.42 115.61 1yr9 h ASP 96 Ca -0.29 -0.26 -0.65 0.00 0.02 0.00 0.00 57.03 55.86 1yr9 h ASP 96 Cb 1.17 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.61 1yr9 h ASP 96 CO 0.39 0.82 -0.64 -0.31 -1.72 0.00 0.00 179.24 177.78 1yr9 s TYR 97 N -2.01 3.06 -0.17 4.55 1.51 -0.97 -1.57 117.35 121.75 1yr9 s TYR 97 Ca -0.12 0.01 -0.02 0.00 -1.01 0.00 0.00 57.07 55.93 1yr9 s TYR 97 Cb 0.01 -1.57 0.05 0.00 -0.11 0.00 0.00 41.96 40.34 1yr9 s TYR 97 CO 0.28 0.50 0.02 0.08 -1.11 0.00 0.00 175.55 175.32 1yr9 s VAL 98 N -1.34 0.56 -0.36 0.71 1.01 0.67 -2.16 120.40 119.50 1yr9 s VAL 98 Ca 0.27 -0.44 -0.16 0.00 0.00 0.00 0.00 61.98 61.65 1yr9 s VAL 98 Cb -0.12 -0.97 -0.00 0.00 0.00 0.00 0.00 36.38 35.29 1yr9 s VAL 98 CO 0.20 -0.09 0.41 -0.76 0.00 0.00 0.00 175.10 174.86 1yr9 s LEU 99 N 1.85 4.50 -0.19 3.92 1.43 -1.17 -1.21 118.68 127.82 1yr9 s LEU 99 Ca 0.00 -0.28 -0.11 0.00 -1.03 0.00 0.00 54.13 52.72 1yr9 s LEU 99 Cb -0.16 -2.41 -0.05 0.00 0.03 0.00 0.00 46.19 43.60 1yr9 s LEU 99 CO -0.07 -0.42 0.17 -0.63 0.23 0.00 0.00 176.35 175.62 1yr9 s ILE 100 N 2.13 5.39 -0.50 -0.59 1.01 0.37 -0.73 121.20 128.28 1yr9 s ILE 100 Ca 0.13 0.28 -0.03 0.00 0.00 0.00 0.00 60.65 61.03 1yr9 s ILE 100 Cb -0.16 -3.51 0.13 0.00 0.01 0.00 0.00 42.46 38.93 1yr9 s ILE 100 CO 0.12 0.44 0.30 -0.62 0.00 0.00 0.00 174.94 175.18 1yr9 s ASP 101 N 0.33 5.24 0.60 3.58 2.15 0.30 -1.32 116.67 127.54 1yr9 s ASP 101 Ca 0.10 -2.38 -0.16 0.00 0.43 0.00 0.00 52.55 50.54 1yr9 s ASP 101 Cb -0.12 -1.84 -0.03 0.00 -0.30 0.00 0.00 42.92 40.63 1yr9 s ASP 101 CO -0.00 -0.47 1.08 0.42 -0.17 0.00 0.00 175.17 176.02 1yr9 s THR 102 N 0.64 3.60 0.65 1.71 -4.23 -1.19 -0.32 115.64 116.49 1yr9 s THR 102 Ca 0.12 0.79 -0.17 0.00 -1.18 0.00 0.00 61.69 61.25 1yr9 s THR 102 Cb -0.22 -3.30 -0.03 0.00 1.34 0.00 0.00 72.50 70.28 1yr9 s THR 102 CO -0.04 -0.41 0.92 -0.81 -0.54 0.00 0.00 174.62 173.74 1yr9 n PRO 103 N -1.98 0.71 -0.07 3.99 -0.04 -1.26 -4.67 135.00 131.69 1yr9 n PRO 103 Ca 0.09 0.29 -0.08 0.00 -0.04 0.00 0.00 63.50 63.76 1yr9 n PRO 103 Cb 0.52 -2.14 -0.01 0.00 -0.04 0.00 0.00 33.50 31.83 1yr9 n PRO 103 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1yr9 h GLY 104 N 0.17 0.33 -7.36 0.55 0.00 -1.94 -3.15 103.07 91.66 1yr9 h GLY 104 Ca -0.48 -0.06 -0.28 0.00 0.00 0.00 0.00 47.33 46.51 1yr9 h GLY 104 CO 0.49 0.04 0.86 1.20 0.00 0.00 0.00 176.54 179.12 1yr9 s GLN 105 N -6.17 2.36 0.31 4.80 -1.52 -1.26 -3.10 119.66 115.08 1yr9 s GLN 105 Ca -0.13 -0.82 0.18 0.00 -1.95 0.00 0.00 55.36 52.64 1yr9 s GLN 105 Cb 0.10 -5.16 1.14 0.00 -0.22 0.00 0.00 33.01 28.87 1yr9 s GLN 105 CO 0.70 -3.99 1.33 -0.12 -0.25 0.00 0.00 175.29 172.96 1yr9 n MET 106 N 8.44 -0.05 0.14 2.91 1.56 -1.19 0.36 117.12 129.29 1yr9 n MET 106 Ca 0.43 1.16 0.01 0.00 -0.27 0.00 0.00 57.70 59.03 1yr9 n MET 106 Cb 0.47 -2.09 0.11 0.00 2.15 0.00 0.00 33.22 33.86 1yr9 n MET 106 CO 0.00 0.00 0.00 1.05 -0.73 0.00 0.00 175.97 176.29 1yr9 h GLU 107 N 0.00 0.00 -0.00 2.12 4.11 -1.89 -0.74 114.58 118.18 1yr9 h GLU 107 Ca 0.72 0.00 0.02 0.00 0.07 0.00 0.00 59.36 60.16 1yr9 h GLU 107 Cb 1.91 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 31.12 1yr9 h GLU 107 CO -0.64 0.58 -0.42 1.15 0.07 0.00 0.00 179.01 179.75 1yr9 h THR 108 N 0.00 0.00 0.00 -1.06 2.02 -0.47 1.61 112.91 115.01 1yr9 h THR 108 Ca -0.01 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 1yr9 h THR 108 Cb 1.27 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 1yr9 h THR 108 CO 0.07 0.00 -0.01 0.15 0.37 0.00 0.00 175.52 176.10 1yr9 h PHE 109 N -0.52 0.00 0.00 3.16 3.57 -1.40 -2.63 116.94 119.12 1yr9 h PHE 109 Ca 0.01 0.00 -0.37 0.00 3.53 0.00 0.00 57.97 61.14 1yr9 h PHE 109 Cb 0.56 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.23 1yr9 h PHE 109 CO -0.48 0.01 -2.34 -0.11 -2.23 0.00 0.00 178.31 173.16 1yr9 n LEU 110 N -3.19 0.81 0.01 0.59 -0.00 -0.32 -3.69 117.00 111.20 1yr9 n LEU 110 Ca -0.02 0.01 0.11 0.00 -0.00 0.00 0.00 56.01 56.11 1yr9 n LEU 110 Cb 0.15 0.11 -0.13 0.00 -0.00 0.00 0.00 43.42 43.55 1yr9 n LEU 110 CO 0.23 0.60 -0.52 0.49 -0.00 0.00 0.00 177.39 178.19 1yr9 n PHE 111 N -2.91 0.11 -4.55 1.96 3.72 0.54 -4.84 117.46 111.49 1yr9 n PHE 111 Ca -0.35 0.03 -0.33 0.00 -0.05 0.00 0.00 57.45 56.76 1yr9 n PHE 111 Cb 1.11 -0.47 -0.15 0.00 -0.94 0.00 0.00 39.48 39.03 1yr9 n PHE 111 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 1yr9 s HIS 112 N -3.41 2.79 0.20 1.38 3.76 -1.00 -5.01 115.29 114.01 1yr9 s HIS 112 Ca -0.04 -0.96 0.14 0.00 -0.15 0.00 0.00 55.06 54.05 1yr9 s HIS 112 Cb 0.14 -1.89 0.68 0.00 1.11 0.00 0.00 32.58 32.62 1yr9 s HIS 112 CO 0.88 -0.43 0.73 0.39 -0.85 0.00 0.00 174.74 175.47 1yr9 n GLU 113 N 3.99 -0.02 -0.27 1.40 1.02 -1.26 -0.78 120.64 124.72 1yr9 n GLU 113 Ca -0.19 0.59 0.08 0.00 -0.02 0.00 0.00 57.16 57.63 1yr9 n GLU 113 Cb 0.52 -1.15 0.23 0.00 -0.02 0.00 0.00 31.44 31.01 1yr9 n GLU 113 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1yr9 h PHE 114 N 0.00 0.46 0.06 -0.32 3.57 -1.91 0.83 116.94 119.63 1yr9 h PHE 114 Ca 0.41 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.86 1yr9 h PHE 114 Cb 1.28 -0.08 0.01 0.00 2.79 0.00 0.00 35.95 39.95 1yr9 h PHE 114 CO -0.00 -0.03 -0.38 0.78 -2.23 0.00 0.00 178.31 176.45 1yr9 h GLY 115 N 0.36 0.17 0.85 2.40 0.00 -1.09 -3.01 103.07 102.76 1yr9 h GLY 115 Ca 0.47 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 1yr9 h GLY 115 CO -0.49 0.37 -0.46 -2.08 0.00 0.00 0.00 176.54 173.87 1yr9 h VAL 116 N -0.66 0.08 0.01 4.60 2.07 -1.57 -2.57 116.25 118.22 1yr9 h VAL 116 Ca -0.06 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.48 1yr9 h VAL 116 Cb 1.27 0.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.06 1yr9 h VAL 116 CO 0.07 0.00 -0.45 0.03 0.02 0.00 0.00 177.57 177.24 1yr9 h ARG 117 N -1.15 -0.59 -1.35 1.57 3.08 -0.99 0.51 114.38 115.46 1yr9 h ARG 117 Ca -0.10 0.04 0.40 0.00 0.07 0.00 0.00 59.98 60.39 1yr9 h ARG 117 Cb 0.92 0.13 -0.09 0.00 0.08 0.00 0.00 29.97 31.01 1yr9 h ARG 117 CO 0.12 -0.39 0.92 1.25 -1.07 0.00 0.00 179.97 180.80 1yr9 h LEU 118 N -0.61 0.17 -0.45 3.04 5.85 -1.57 0.55 115.31 122.29 1yr9 h LEU 118 Ca 0.04 0.06 -0.16 0.00 0.84 0.00 0.00 57.88 58.66 1yr9 h LEU 118 Cb 0.68 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1yr9 h LEU 118 CO -0.32 -0.04 -0.45 -0.03 -0.34 0.00 0.00 178.44 177.26 1yr9 h MET 119 N 0.11 0.80 -0.27 1.25 4.05 -0.47 -2.99 114.93 117.41 1yr9 h MET 119 Ca 0.72 -0.45 -0.07 0.00 -0.28 0.00 0.00 59.70 59.63 1yr9 h MET 119 Cb 2.50 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 33.31 1yr9 h MET 119 CO -0.20 1.08 -0.14 0.93 0.23 0.00 0.00 176.91 178.81 1yr9 h GLU 120 N 0.64 0.45 -0.00 0.39 4.39 0.56 -2.88 114.58 118.13 1yr9 h GLU 120 Ca 0.04 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1yr9 h GLU 120 Cb 1.02 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 1yr9 h GLU 120 CO 0.10 0.59 -0.03 0.09 -1.16 0.00 0.00 179.01 178.60 1yr9 n ASN 121 N -4.20 0.04 -4.86 1.42 4.13 -0.85 -4.83 115.26 106.12 1yr9 n ASN 121 Ca 0.00 0.32 -0.32 0.00 1.68 0.00 0.00 54.58 56.26 1yr9 n ASN 121 Cb 0.33 -0.41 -0.05 0.00 -1.54 0.00 0.00 39.78 38.11 1yr9 n ASN 121 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1yr9 s LEU 122 N -2.92 4.10 -1.15 3.41 1.43 -1.09 -4.99 118.68 117.47 1yr9 s LEU 122 Ca 0.17 1.07 -0.19 0.00 -1.03 0.00 0.00 54.13 54.15 1yr9 s LEU 122 Cb 0.19 -3.86 0.09 0.00 0.03 0.00 0.00 46.19 42.64 1yr9 s LEU 122 CO 0.53 -0.15 1.52 -2.16 0.23 0.00 0.00 176.35 176.32 1yr9 s PRO 123 N -2.97 3.84 -1.04 1.29 0.05 -1.26 -4.45 135.00 130.46 1yr9 s PRO 123 Ca 0.50 -1.82 -0.13 0.00 0.05 0.00 0.00 61.00 59.60 1yr9 s PRO 123 Cb -0.11 -5.32 -0.02 0.00 0.05 0.00 0.00 34.50 29.10 1yr9 s PRO 123 CO 0.20 -2.09 0.80 0.66 0.05 0.00 0.00 177.00 176.62 1yr9 n TYR 124 N 7.80 -2.19 -2.41 0.56 4.01 -1.26 -4.88 117.16 118.80 1yr9 n TYR 124 Ca 0.39 0.66 -0.37 0.00 -0.16 0.00 0.00 57.90 58.42 1yr9 n TYR 124 Cb 0.47 -3.64 -0.03 0.00 -0.31 0.00 0.00 39.34 35.84 1yr9 n TYR 124 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1yr9 s PRO 125 N -5.16 3.96 -0.10 -0.72 0.04 -1.26 -4.81 135.00 126.95 1yr9 s PRO 125 Ca 0.38 1.63 -0.11 0.00 0.04 0.00 0.00 61.00 62.94 1yr9 s PRO 125 Cb -0.11 -2.46 -0.05 0.00 0.04 0.00 0.00 34.50 31.92 1yr9 s PRO 125 CO 0.82 -0.34 0.24 -1.17 0.04 0.00 0.00 177.00 176.59 1yr9 s LEU 126 N -2.86 4.36 -0.15 -3.56 2.96 -0.87 -4.23 118.68 114.34 1yr9 s LEU 126 Ca 0.61 0.59 -0.03 0.00 -0.22 0.00 0.00 54.13 55.08 1yr9 s LEU 126 Cb -0.25 -2.28 -0.02 0.00 0.50 0.00 0.00 46.19 44.14 1yr9 s LEU 126 CO 0.31 0.30 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.88 1yr9 s VAL 127 N -0.58 3.62 -0.33 1.68 1.01 -0.26 -1.30 120.40 124.25 1yr9 s VAL 127 Ca 0.17 -0.45 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 1yr9 s VAL 127 Cb -0.13 -2.57 0.04 0.00 0.00 0.00 0.00 36.38 33.71 1yr9 s VAL 127 CO 0.06 0.50 0.07 -0.69 0.00 0.00 0.00 175.10 175.04 1yr9 s VAL 128 N 0.43 3.57 -0.50 2.92 1.01 -0.62 0.12 120.40 127.33 1yr9 s VAL 128 Ca -0.06 -1.18 -0.19 0.00 0.00 0.00 0.00 61.98 60.55 1yr9 s VAL 128 Cb -0.15 -3.02 0.06 0.00 0.00 0.00 0.00 36.38 33.27 1yr9 s VAL 128 CO 0.03 -0.15 0.62 -0.47 0.00 0.00 0.00 175.10 175.14 1yr9 s TYR 129 N 1.36 3.05 -0.06 5.22 5.04 0.18 -2.22 117.35 129.93 1yr9 s TYR 129 Ca -0.03 -0.51 -0.30 0.00 -2.44 0.00 0.00 57.07 53.80 1yr9 s TYR 129 Cb -0.19 -3.51 -0.02 0.00 0.35 0.00 0.00 41.96 38.58 1yr9 s TYR 129 CO 0.02 -1.01 1.04 0.42 -1.34 0.00 0.00 175.55 174.67 1yr9 s ILE 130 N 2.62 4.70 0.10 3.14 -1.09 0.32 -0.45 121.20 130.55 1yr9 s ILE 130 Ca 0.15 1.96 0.10 0.00 -2.23 0.00 0.00 60.65 60.63 1yr9 s ILE 130 Cb -0.19 -4.26 -0.04 0.00 -1.58 0.00 0.00 42.46 36.40 1yr9 s ILE 130 CO 0.12 0.05 -0.25 -0.55 -1.23 0.00 0.00 174.94 173.08 1yr9 s SER 131 N 1.12 3.38 -0.25 3.58 0.15 0.64 -4.25 113.70 118.07 1yr9 s SER 131 Ca 0.51 -0.67 -0.22 0.00 0.70 0.00 0.00 55.95 56.27 1yr9 s SER 131 Cb -0.20 -0.30 -0.01 0.00 -1.71 0.00 0.00 66.02 63.80 1yr9 s SER 131 CO 0.22 0.20 0.72 -0.62 1.20 0.00 0.00 173.24 174.96 1yr9 s ASP 132 N -1.85 6.68 0.18 5.45 2.15 -1.26 0.33 116.67 128.36 1yr9 s ASP 132 Ca 0.14 0.83 0.15 0.00 0.43 0.00 0.00 52.55 54.10 1yr9 s ASP 132 Cb -0.10 -2.38 0.75 0.00 -0.30 0.00 0.00 42.92 40.88 1yr9 s ASP 132 CO 0.06 -0.45 1.47 -2.65 -0.17 0.00 0.00 175.17 173.43 1yr9 n PRO 133 N 5.87 0.10 0.00 4.34 -0.02 -1.26 -2.89 135.00 141.13 1yr9 n PRO 133 Ca 0.02 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1yr9 n PRO 133 Cb 0.48 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 1yr9 n PRO 133 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1yr9 n GLU 134 N -1.95 0.93 0.00 -0.52 -0.58 -1.26 -2.36 120.64 114.90 1yr9 n GLU 134 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1yr9 n GLU 134 Cb 0.09 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.50 1yr9 n GLU 134 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 1yr9 n ILE 135 N 0.05 0.00 -2.57 -3.67 -5.35 -1.14 -4.90 119.36 101.77 1yr9 n ILE 135 Ca 0.00 -0.44 -0.41 0.00 -0.27 0.00 0.00 62.75 61.63 1yr9 n ILE 135 Cb 0.24 0.97 -0.03 0.00 -1.74 0.00 0.00 39.64 39.07 1yr9 n ILE 135 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1yr9 s LEU 136 N -1.95 3.54 -0.04 7.28 1.43 -1.00 -4.61 118.68 123.33 1yr9 s LEU 136 Ca 0.00 -1.42 -0.01 0.00 -1.03 0.00 0.00 54.13 51.67 1yr9 s LEU 136 Cb 0.00 -2.56 -0.02 0.00 0.03 0.00 0.00 46.19 43.63 1yr9 s LEU 136 CO 0.00 -1.51 -0.05 2.29 0.23 0.00 0.00 176.35 177.31 1yr9 n LYS 137 N 8.83 0.10 -4.46 1.70 2.85 -1.26 -5.07 118.16 120.84 1yr9 n LYS 137 Ca 0.31 0.04 -0.24 0.00 -1.05 0.00 0.00 58.31 57.37 1yr9 n LYS 137 Cb 0.51 -0.82 -0.10 0.00 -0.65 0.00 0.00 35.03 33.97 1yr9 n LYS 137 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 1yr9 s LYS 138 N -2.08 1.65 0.16 -1.58 -2.85 -1.26 -5.07 119.74 108.70 1yr9 s LYS 138 Ca -0.06 -1.77 -0.30 0.00 -1.00 0.00 0.00 55.97 52.84 1yr9 s LYS 138 Cb 0.02 -1.67 -0.05 0.00 -2.06 0.00 0.00 37.83 34.07 1yr9 s LYS 138 CO 0.09 0.28 1.55 -1.35 0.10 0.00 0.00 175.35 176.02 1yr9 h PRO 139 N 2.27 -0.15 -0.71 1.78 0.11 -1.96 -1.97 132.00 131.37 1yr9 h PRO 139 Ca -0.40 0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.78 1yr9 h PRO 139 Cb 1.25 0.03 -0.09 0.00 0.11 0.00 0.00 31.00 32.31 1yr9 h PRO 139 CO 0.62 -0.10 -0.42 0.09 -0.21 0.00 0.00 178.00 177.98 1yr9 n ASN 140 N -5.32 -0.75 -0.18 -2.05 5.03 -1.26 -0.41 115.26 110.31 1yr9 n ASN 140 Ca 0.01 1.53 0.12 0.00 0.87 0.00 0.00 54.58 57.10 1yr9 n ASN 140 Cb 0.31 -0.29 0.22 0.00 -1.02 0.00 0.00 39.78 38.99 1yr9 n ASN 140 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1yr9 n ASP 141 N -4.61 0.03 0.07 6.41 8.00 -0.74 0.14 116.55 125.86 1yr9 n ASP 141 Ca 0.01 0.92 -0.13 0.00 0.71 0.00 0.00 54.79 56.31 1yr9 n ASP 141 Cb 0.18 -0.38 -0.08 0.00 -0.02 0.00 0.00 41.12 40.82 1yr9 n ASP 141 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 1yr9 h TYR 142 N 0.00 -0.17 -0.55 1.24 0.05 -0.79 -1.14 116.97 115.61 1yr9 h TYR 142 Ca 0.38 -0.00 0.01 0.00 0.05 0.00 0.00 58.73 59.17 1yr9 h TYR 142 Cb 0.89 0.06 -0.03 0.00 1.01 0.00 0.00 36.73 38.66 1yr9 h TYR 142 CO -0.18 0.15 0.36 0.00 -1.05 0.00 0.00 178.16 177.44 1yr9 h PHE 144 N 0.73 -1.32 -0.68 0.00 3.57 0.13 -0.11 116.94 119.28 1yr9 h PHE 144 Ca 0.20 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.73 1yr9 h PHE 144 Cb -0.07 0.59 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 1yr9 h PHE 144 CO -0.04 -0.50 0.32 0.28 -2.23 0.00 0.00 178.31 176.14 1yr9 h VAL 145 N -0.52 1.22 0.00 1.41 2.07 -1.02 -1.74 116.25 117.66 1yr9 h VAL 145 Ca 0.07 -0.62 -0.10 0.00 0.82 0.00 0.00 66.70 66.86 1yr9 h VAL 145 Cb 0.65 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1yr9 h VAL 145 CO -0.41 0.26 -0.50 0.03 0.02 0.00 0.00 177.57 176.97 1yr9 h ARG 146 N 0.96 0.00 -0.00 1.57 3.08 -0.97 -2.10 114.38 116.92 1yr9 h ARG 146 Ca 0.24 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.28 1yr9 h ARG 146 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1yr9 h ARG 146 CO -0.03 0.50 -0.00 0.35 -1.07 0.00 0.00 179.97 179.71 1yr9 h PHE 147 N 0.00 0.01 -0.92 3.04 3.57 -0.74 -2.72 116.94 119.17 1yr9 h PHE 147 Ca -0.00 -0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.63 1yr9 h PHE 147 Cb 1.11 -0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.78 1yr9 h PHE 147 CO 0.00 0.75 0.59 0.35 -2.23 0.00 0.00 178.31 177.77 1yr9 h PHE 148 N -0.75 0.90 -0.70 0.41 3.57 -1.32 0.62 116.94 119.67 1yr9 h PHE 148 Ca -0.00 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 1yr9 h PHE 148 Cb 0.76 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 39.18 1yr9 h PHE 148 CO 0.19 0.33 0.23 0.00 -2.23 0.00 0.00 178.31 176.83 1yr9 h ALA 149 N 1.59 0.92 -0.40 2.41 0.00 -1.34 0.18 119.26 122.61 1yr9 h ALA 149 Ca 0.47 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 1yr9 h ALA 149 Cb 0.69 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1yr9 h ALA 149 CO -0.23 0.58 -0.31 1.25 0.00 0.00 0.00 179.25 180.54 1yr9 h LEU 150 N 1.02 0.94 -0.45 0.00 5.85 -0.32 -1.77 115.31 120.59 1yr9 h LEU 150 Ca 0.23 -0.40 0.07 0.00 0.84 0.00 0.00 57.88 58.63 1yr9 h LEU 150 Cb 0.29 -0.26 -0.09 0.00 0.37 0.00 0.00 40.66 40.96 1yr9 h LEU 150 CO -0.01 1.17 -0.43 0.25 -0.34 0.00 0.00 178.44 179.08 1yr9 h LEU 151 N 0.76 -1.44 0.34 2.25 5.85 0.10 0.29 115.31 123.46 1yr9 h LEU 151 Ca 0.08 0.22 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 1yr9 h LEU 151 Cb 0.88 0.64 -0.03 0.00 0.37 0.00 0.00 40.66 42.52 1yr9 h LEU 151 CO 0.08 -0.36 -0.44 0.40 -0.34 0.00 0.00 178.44 177.78 1yr9 h ILE 152 N -0.30 0.13 -0.69 4.05 2.04 -0.20 0.81 117.51 123.34 1yr9 h ILE 152 Ca 0.15 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.07 1yr9 h ILE 152 Cb 0.58 0.13 -0.08 0.00 -0.74 0.00 0.00 36.82 36.71 1yr9 h ILE 152 CO -0.60 0.00 -0.41 -0.67 0.00 0.00 0.00 178.15 176.47 1yr9 n ASP 153 N -5.51 -0.73 0.12 1.72 -0.08 -0.71 0.45 116.55 111.81 1yr9 n ASP 153 Ca -0.10 1.25 -0.07 0.00 -1.51 0.00 0.00 54.79 54.36 1yr9 n ASP 153 Cb 0.41 -0.17 -0.04 0.00 2.34 0.00 0.00 41.12 43.66 1yr9 n ASP 153 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1yr9 h LEU 154 N 0.00 -0.57 -0.31 -2.67 5.85 0.13 0.39 115.31 118.14 1yr9 h LEU 154 Ca 0.11 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.91 1yr9 h LEU 154 Cb 0.28 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.45 1yr9 h LEU 154 CO -0.65 -0.28 -0.30 -0.09 -0.34 0.00 0.00 178.44 176.78 1yr9 h ARG 155 N -0.42 -0.14 -0.00 1.25 1.12 0.11 -2.50 114.38 113.80 1yr9 h ARG 155 Ca -0.03 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.85 1yr9 h ARG 155 Cb 0.36 0.03 0.00 0.00 -0.01 0.00 0.00 29.97 30.35 1yr9 h ARG 155 CO -0.02 -0.10 -0.03 1.28 -3.11 0.00 0.00 179.97 178.00 1yr9 n LEU 156 N -4.14 0.14 -3.35 3.80 4.77 0.17 -4.96 117.00 113.44 1yr9 n LEU 156 Ca -0.01 0.14 -0.28 0.00 -0.03 0.00 0.00 56.01 55.83 1yr9 n LEU 156 Cb 0.17 -0.19 0.03 0.00 -2.33 0.00 0.00 43.42 41.10 1yr9 n LEU 156 CO -0.02 0.03 -0.27 0.61 -1.33 0.00 0.00 177.39 176.41 1yr9 n GLY 157 N 1.22 -0.20 3.65 -0.72 0.00 0.14 -4.75 105.19 104.52 1yr9 n GLY 157 Ca 0.17 1.00 -0.02 0.00 0.00 0.00 0.00 46.02 47.17 1yr9 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yr9 s ALA 158 N -1.57 -2.34 0.04 4.61 0.00 -1.12 -4.92 121.76 116.45 1yr9 s ALA 158 Ca 0.30 1.83 -0.34 0.00 0.00 0.00 0.00 51.96 53.76 1yr9 s ALA 158 Cb -0.04 -1.81 -0.13 0.00 0.00 0.00 0.00 23.12 21.15 1yr9 s ALA 158 CO 0.74 -0.20 1.75 2.41 0.00 0.00 0.00 175.76 180.46 1yr9 n THR 159 N 2.27 0.32 -4.68 0.00 -1.04 -1.26 -4.29 114.28 105.59 1yr9 n THR 159 Ca -0.13 -0.06 -0.33 0.00 -2.04 0.00 0.00 64.05 61.49 1yr9 n THR 159 Cb 0.57 -1.76 -0.13 0.00 -1.82 0.00 0.00 70.33 67.18 1yr9 n THR 159 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1yr9 s THR 160 N 2.61 3.32 -0.24 12.58 2.01 -1.26 -1.10 115.64 133.57 1yr9 s THR 160 Ca 0.86 -0.57 -0.07 0.00 0.31 0.00 0.00 61.69 62.22 1yr9 s THR 160 Cb -0.66 -2.40 -0.03 0.00 0.01 0.00 0.00 72.50 69.42 1yr9 s THR 160 CO 0.44 0.53 0.05 -0.63 -0.69 0.00 0.00 174.62 174.32 1yr9 s ILE 161 N 0.14 4.15 0.38 1.82 1.01 0.33 -4.93 121.20 124.09 1yr9 s ILE 161 Ca -0.05 -0.23 -0.27 0.00 0.00 0.00 0.00 60.65 60.10 1yr9 s ILE 161 Cb -0.15 -2.93 -0.09 0.00 0.01 0.00 0.00 42.46 39.31 1yr9 s ILE 161 CO 0.04 0.36 1.29 -2.84 0.00 0.00 0.00 174.94 173.79 1yr9 s PRO 162 N 1.51 4.12 -0.11 2.79 0.02 -1.26 0.49 135.00 142.56 1yr9 s PRO 162 Ca 0.06 2.15 -0.09 0.00 0.02 0.00 0.00 61.00 63.13 1yr9 s PRO 162 Cb -0.15 -2.87 0.03 0.00 0.02 0.00 0.00 34.50 31.54 1yr9 s PRO 162 CO 0.02 -0.36 0.29 0.00 -0.33 0.00 0.00 177.00 176.62 1yr9 s ALA 163 N -1.23 -0.70 0.08 -1.55 0.00 0.41 -1.26 121.76 117.50 1yr9 s ALA 163 Ca 0.54 0.89 -0.09 0.00 0.00 0.00 0.00 51.96 53.30 1yr9 s ALA 163 Cb -0.38 -0.53 -0.06 0.00 0.00 0.00 0.00 23.12 22.15 1yr9 s ALA 163 CO 0.49 -0.16 0.40 -0.51 0.00 0.00 0.00 175.76 175.98 1yr9 s LEU 164 N 0.43 4.34 0.43 0.00 1.43 0.54 0.23 118.68 126.09 1yr9 s LEU 164 Ca -0.02 0.77 0.07 0.00 -1.03 0.00 0.00 54.13 53.92 1yr9 s LEU 164 Cb -0.04 -3.01 -0.02 0.00 0.03 0.00 0.00 46.19 43.15 1yr9 s LEU 164 CO -0.02 0.16 0.32 0.21 0.23 0.00 0.00 176.35 177.25 1yr9 s ASN 165 N -1.82 4.79 -1.53 2.29 3.04 0.15 -1.97 114.94 119.89 1yr9 s ASN 165 Ca 0.34 -0.93 -0.07 0.00 0.04 0.00 0.00 52.86 52.24 1yr9 s ASN 165 Cb -0.14 -0.40 0.06 0.00 -1.54 0.00 0.00 41.25 39.23 1yr9 s ASN 165 CO 0.19 -0.68 0.52 0.29 -3.04 0.00 0.00 177.10 174.38 1yr9 n LYS 166 N -1.48 -3.08 0.00 0.43 5.02 -0.54 -4.36 118.16 114.14 1yr9 n LYS 166 Ca 0.01 0.37 0.08 0.00 -2.02 0.00 0.00 58.31 56.75 1yr9 n LYS 166 Cb 0.63 -4.67 0.47 0.00 -0.02 0.00 0.00 35.03 31.44 1yr9 n LYS 166 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1yr9 n VAL 167 N -4.42 0.00 0.03 -0.18 0.24 -1.06 -3.13 118.33 109.81 1yr9 n VAL 167 Ca -0.17 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.02 1yr9 n VAL 167 Cb 0.61 -0.50 -0.08 0.00 -1.47 0.00 0.00 33.84 32.40 1yr9 n VAL 167 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 1yr9 h ASP 168 N 0.00 -0.13 0.00 -1.34 2.03 -1.87 -3.14 116.42 111.97 1yr9 h ASP 168 Ca 0.00 -0.43 0.00 0.00 -0.73 0.00 0.00 57.03 55.87 1yr9 h ASP 168 Cb 0.00 0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.53 1yr9 h ASP 168 CO 0.00 0.46 0.00 0.18 -1.03 0.00 0.00 179.24 178.85 1yr9 n LEU 169 N -4.87 0.15 -5.00 0.15 4.77 -1.18 -4.71 117.00 106.31 1yr9 n LEU 169 Ca -0.08 -0.08 -0.23 0.00 -0.03 0.00 0.00 56.01 55.59 1yr9 n LEU 169 Cb 0.28 -0.08 0.11 0.00 -2.33 0.00 0.00 43.42 41.40 1yr9 n LEU 169 CO 0.26 0.04 0.55 -0.76 -1.33 0.00 0.00 177.39 176.15 1yr9 s LEU 170 N -0.05 2.96 0.00 2.23 2.01 -1.19 -5.14 118.68 119.51 1yr9 s LEU 170 Ca 0.00 -0.45 0.00 0.00 0.01 0.00 0.00 54.13 53.69 1yr9 s LEU 170 Cb 0.00 -1.86 0.00 0.00 0.01 0.00 0.00 46.19 44.34 1yr9 s LEU 170 CO 0.00 -1.89 0.00 -0.24 1.01 0.00 0.00 176.35 175.23 1yr9 n SER 171 N -2.83 0.10 -0.00 2.29 2.88 -1.26 -5.00 113.62 109.79 1yr9 n SER 171 Ca 0.16 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.69 1yr9 n SER 171 Cb 0.61 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 64.07 1yr9 n SER 171 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1yr9 n GLU 172 N 0.00 0.03 0.18 -1.46 4.07 -1.26 -4.09 120.64 118.11 1yr9 n GLU 172 Ca 0.00 0.09 0.02 0.00 -0.06 0.00 0.00 57.16 57.21 1yr9 n GLU 172 Cb 0.00 -0.63 0.32 0.00 -0.06 0.00 0.00 31.44 31.08 1yr9 n GLU 172 CO 0.00 0.00 0.00 1.05 -0.06 0.00 0.00 177.13 178.12 1yr9 h GLU 173 N -0.05 0.00 -0.56 5.31 -0.00 -1.99 -2.55 114.58 114.74 1yr9 h GLU 173 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 59.36 59.41 1yr9 h GLU 173 Cb 0.04 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 28.74 1yr9 h GLU 173 CO 0.00 0.42 0.29 1.49 -0.00 0.00 0.00 179.01 181.21 1yr9 h GLU 174 N 0.00 0.53 -0.80 1.06 4.81 -1.98 1.36 114.58 119.56 1yr9 h GLU 174 Ca -0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1yr9 h GLU 174 Cb 0.76 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.02 1yr9 h GLU 174 CO 0.05 0.35 0.00 1.17 -0.73 0.00 0.00 179.01 179.86 1yr9 n LYS 175 N -4.86 0.79 0.00 1.92 4.81 -0.96 -1.67 118.16 118.18 1yr9 n LYS 175 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 1yr9 n LYS 175 Cb 0.16 -1.39 0.00 0.00 0.02 0.00 0.00 35.03 33.82 1yr9 n LYS 175 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1yr9 n GLU 176 N 0.12 1.97 0.03 1.64 4.07 -0.39 -4.55 120.64 123.53 1yr9 n GLU 176 Ca 0.00 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 56.98 1yr9 n GLU 176 Cb 0.20 -0.40 -0.08 0.00 -0.06 0.00 0.00 31.44 31.10 1yr9 n GLU 176 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 1yr9 h ARG 177 N 0.00 -0.03 -0.95 5.31 2.43 0.22 -0.70 114.38 120.67 1yr9 h ARG 177 Ca 0.00 0.00 0.20 0.00 -0.81 0.00 0.00 59.98 59.37 1yr9 h ARG 177 Cb 0.00 0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 29.44 1yr9 h ARG 177 CO 0.00 0.14 0.53 0.45 -1.51 0.00 0.00 179.97 179.58 1yr9 h HIS 178 N -0.20 0.91 0.00 2.20 3.86 -1.55 0.11 115.15 120.48 1yr9 h HIS 178 Ca -0.00 0.04 -0.12 0.00 -1.16 0.00 0.00 60.37 59.13 1yr9 h HIS 178 Cb 0.19 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 1yr9 h HIS 178 CO -0.02 0.12 -0.55 -0.09 0.86 0.00 0.00 177.93 178.25 1yr9 h ARG 179 N 0.62 0.00 -0.32 2.45 2.43 -1.72 -2.75 114.38 115.10 1yr9 h ARG 179 Ca 0.57 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.73 1yr9 h ARG 179 Cb 0.96 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 1yr9 h ARG 179 CO -0.43 0.55 0.16 -0.22 -1.51 0.00 0.00 179.97 178.52 1yr9 h LYS 180 N 0.00 0.45 -2.66 0.20 3.64 0.56 -2.36 116.57 116.41 1yr9 h LYS 180 Ca -0.01 -0.06 -0.67 0.00 -1.27 0.00 0.00 60.65 58.64 1yr9 h LYS 180 Cb 1.07 -0.08 -0.08 0.00 -0.41 0.00 0.00 32.23 32.73 1yr9 h LYS 180 CO 0.07 0.41 2.57 0.66 -2.27 0.00 0.00 179.45 180.89 1yr9 n TYR 181 N -4.78 2.33 0.00 1.91 4.01 -0.82 -4.10 117.16 115.71 1yr9 n TYR 181 Ca -0.01 -2.77 0.00 0.00 -0.16 0.00 0.00 57.90 54.95 1yr9 n TYR 181 Cb 0.10 -1.99 0.00 0.00 -0.31 0.00 0.00 39.34 37.13 1yr9 n TYR 181 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1yr9 n PHE 182 N 2.27 0.00 -0.30 -0.72 3.72 -0.91 -4.92 117.46 116.60 1yr9 n PHE 182 Ca 0.66 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 58.09 1yr9 n PHE 182 Cb 0.30 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 38.93 1yr9 n PHE 182 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1yr9 n GLU 183 N 0.00 -0.11 -2.60 -1.08 4.71 -1.05 -2.83 120.64 117.68 1yr9 n GLU 183 Ca 0.00 1.27 -0.43 0.00 -0.01 0.00 0.00 57.16 57.99 1yr9 n GLU 183 Cb 0.00 -1.89 -0.02 0.00 -1.01 0.00 0.00 31.44 28.52 1yr9 n GLU 183 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1yr9 s ASP 184 N -5.24 6.76 0.00 1.62 2.15 -1.20 -4.88 116.67 115.87 1yr9 s ASP 184 Ca -0.12 0.76 0.22 0.00 0.43 0.00 0.00 52.55 53.84 1yr9 s ASP 184 Cb 0.20 -2.55 0.01 0.00 -0.30 0.00 0.00 42.92 40.29 1yr9 s ASP 184 CO 0.62 -1.09 1.08 0.00 -0.17 0.00 0.00 175.17 175.61 1yr9 n ILE 185 N 6.41 0.00 0.03 4.11 0.13 -1.13 -4.36 119.36 124.55 1yr9 n ILE 185 Ca 0.12 -0.12 -0.22 0.00 -1.10 0.00 0.00 62.75 61.43 1yr9 n ILE 185 Cb 0.48 0.99 -0.14 0.00 -0.84 0.00 0.00 39.64 40.13 1yr9 n ILE 185 CO 0.00 0.00 0.00 -0.78 2.80 0.00 0.00 176.55 178.57 1yr9 h ASP 186 N 1.11 0.49 0.69 9.51 -0.00 -1.90 -3.33 116.42 122.99 1yr9 h ASP 186 Ca 0.00 -0.91 -0.09 0.00 -0.00 0.00 0.00 57.03 56.03 1yr9 h ASP 186 Cb 0.61 -0.16 -0.01 0.00 -0.00 0.00 0.00 39.33 39.76 1yr9 h ASP 186 CO 0.00 1.76 -0.43 0.22 -0.00 0.00 0.00 179.24 180.79 1yr9 h TYR 187 N -0.04 0.00 -0.47 0.28 5.03 -1.84 -0.83 116.97 119.10 1yr9 h TYR 187 Ca -0.36 0.00 0.01 0.00 2.58 0.00 0.00 58.73 60.97 1yr9 h TYR 187 Cb 1.97 0.00 -0.03 0.00 1.55 0.00 0.00 36.73 40.22 1yr9 h TYR 187 CO 0.10 0.43 0.30 1.25 -1.32 0.00 0.00 178.16 178.92 1yr9 h LEU 188 N 0.00 0.50 -0.70 2.82 7.12 -1.77 -1.52 115.31 121.77 1yr9 h LEU 188 Ca -0.00 -0.01 -0.13 0.00 0.13 0.00 0.00 57.88 57.86 1yr9 h LEU 188 Cb 0.89 -0.12 -0.01 0.00 -0.53 0.00 0.00 40.66 40.89 1yr9 h LEU 188 CO 0.06 0.36 -0.46 0.71 -0.13 0.00 0.00 178.44 178.97 1yr9 h THR 189 N 0.61 1.32 -0.37 1.05 1.35 -1.57 -2.58 112.91 112.72 1yr9 h THR 189 Ca 0.18 -1.67 0.05 0.00 -0.55 0.00 0.00 66.41 64.42 1yr9 h THR 189 Cb -0.04 1.69 -0.04 0.00 -1.73 0.00 0.00 68.15 68.03 1yr9 h THR 189 CO -0.06 0.51 0.11 0.00 -0.25 0.00 0.00 175.52 175.83 1yr9 h ALA 190 N 1.15 0.42 0.00 6.62 0.00 -0.62 -1.72 119.26 125.11 1yr9 h ALA 190 Ca 0.02 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1yr9 h ALA 190 Cb 0.95 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1yr9 h ALA 190 CO 0.08 -0.29 -0.28 -0.09 0.00 0.00 0.00 179.25 178.67 1yr9 h ARG 191 N 0.25 0.00 -0.28 0.00 2.43 -1.19 -3.06 114.38 112.53 1yr9 h ARG 191 Ca 0.17 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.22 1yr9 h ARG 191 Cb 0.17 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1yr9 h ARG 191 CO -0.20 0.28 -0.35 -0.07 -1.51 0.00 0.00 179.97 178.13 1yr9 h LEU 192 N 0.00 0.65 -2.47 3.80 3.38 -1.00 -2.26 115.31 117.41 1yr9 h LEU 192 Ca -0.00 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 1yr9 h LEU 192 Cb 1.01 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1yr9 h LEU 192 CO 0.04 0.94 -0.02 0.50 0.09 0.00 0.00 178.44 179.99 1yr9 h LYS 193 N 0.52 0.00 0.01 1.13 3.64 -1.22 -2.01 116.57 118.64 1yr9 h LYS 193 Ca 0.06 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.24 1yr9 h LYS 193 Cb 0.85 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.65 1yr9 h LYS 193 CO 0.07 0.02 -0.90 -0.07 -2.27 0.00 0.00 179.45 176.30 1yr9 h LEU 194 N 0.00 0.20 -8.73 5.20 4.07 -1.46 -3.43 115.31 111.17 1yr9 h LEU 194 Ca -0.00 -0.17 -0.55 0.00 0.08 0.00 0.00 57.88 57.24 1yr9 h LEU 194 Cb 0.14 -0.06 -0.04 0.00 1.08 0.00 0.00 40.66 41.78 1yr9 h LEU 194 CO 0.00 1.00 1.23 -0.62 -1.08 0.00 0.00 178.44 178.97 1yr9 s ASP 195 N -6.90 5.88 0.00 -0.43 3.68 -0.76 -4.85 116.67 113.30 1yr9 s ASP 195 Ca -0.02 0.84 0.11 0.00 2.13 0.00 0.00 52.55 55.61 1yr9 s ASP 195 Cb 0.10 -2.53 0.64 0.00 -1.45 0.00 0.00 42.92 39.68 1yr9 s ASP 195 CO 0.82 -1.80 1.36 -0.81 0.13 0.00 0.00 175.17 174.87 1yr9 n PRO 196 N 8.55 0.93 -2.98 4.34 -0.04 -1.26 -4.27 135.00 140.26 1yr9 n PRO 196 Ca 0.20 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.36 1yr9 n PRO 196 Cb 0.49 -1.18 -0.03 0.00 -0.04 0.00 0.00 33.50 32.73 1yr9 n PRO 196 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1yr9 s SER 197 N -1.41 6.50 0.21 3.54 0.15 -1.26 -4.92 113.70 116.52 1yr9 s SER 197 Ca 0.16 1.02 -0.18 0.00 0.70 0.00 0.00 55.95 57.65 1yr9 s SER 197 Cb 0.07 -2.28 0.19 0.00 -1.71 0.00 0.00 66.02 62.30 1yr9 s SER 197 CO 0.12 -0.34 1.49 0.23 1.20 0.00 0.00 173.24 175.94 1yr9 n MET 198 N -1.20 -0.25 0.06 5.44 2.81 -1.26 -0.95 117.12 121.77 1yr9 n MET 198 Ca 0.01 1.47 -0.05 0.00 -1.81 0.00 0.00 57.70 57.32 1yr9 n MET 198 Cb 0.54 -2.18 -0.03 0.00 -0.71 0.00 0.00 33.22 30.83 1yr9 n MET 198 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1yr9 h GLN 199 N 0.00 -0.26 -0.90 0.03 1.08 -1.93 -1.28 115.11 111.84 1yr9 h GLN 199 Ca 0.31 0.02 0.31 0.00 -1.45 0.00 0.00 58.65 57.84 1yr9 h GLN 199 Cb 0.55 0.06 -0.09 0.00 -0.05 0.00 0.00 27.48 27.95 1yr9 h GLN 199 CO -0.95 -0.18 0.58 0.41 -0.95 0.00 0.00 178.83 177.75 1yr9 n GLY 200 N -1.16 -0.54 0.38 3.46 0.00 -0.13 0.17 105.19 107.37 1yr9 n GLY 200 Ca -0.03 0.49 -0.18 0.00 0.00 0.00 0.00 46.02 46.30 1yr9 n GLY 200 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1yr9 h LEU 201 N 0.00 -0.78 0.00 0.99 6.46 -0.06 -0.42 115.31 121.50 1yr9 h LEU 201 Ca 0.57 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 58.34 1yr9 h LEU 201 Cb 1.84 0.20 0.00 0.00 -0.73 0.00 0.00 40.66 41.97 1yr9 h LEU 201 CO -0.29 -0.53 -0.57 0.00 -0.62 0.00 0.00 178.44 176.43 1yr9 h MET 202 N -0.97 0.00 -0.36 1.25 -0.00 0.19 0.20 114.93 115.23 1yr9 h MET 202 Ca -0.09 0.00 -0.10 0.00 -0.00 0.00 0.00 59.70 59.51 1yr9 h MET 202 Cb 0.72 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.31 1yr9 h MET 202 CO 0.16 0.00 -0.15 0.00 -0.00 0.00 0.00 176.91 176.91 1yr9 h ALA 203 N 2.05 0.51 0.32 -3.00 0.00 -0.92 0.34 119.26 118.55 1yr9 h ALA 203 Ca 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1yr9 h ALA 203 Cb 0.97 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1yr9 h ALA 203 CO 0.00 0.42 -0.15 -0.92 0.00 0.00 0.00 179.25 178.60 1yr9 h TYR 204 N 0.54 -0.40 -0.71 0.00 5.03 -1.03 -1.82 116.97 118.58 1yr9 h TYR 204 Ca 0.08 -0.01 0.10 0.00 2.58 0.00 0.00 58.73 61.49 1yr9 h TYR 204 Cb 0.69 0.13 -0.08 0.00 1.55 0.00 0.00 36.73 39.03 1yr9 h TYR 204 CO 0.06 -0.08 0.34 0.87 -1.32 0.00 0.00 178.16 178.02 1yr9 h LYS 205 N -0.72 0.54 0.11 1.82 1.57 -0.62 -2.57 116.57 116.69 1yr9 h LYS 205 Ca -0.04 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1yr9 h LYS 205 Cb 0.49 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 1yr9 h LYS 205 CO 0.07 0.36 -0.34 0.52 -0.57 0.00 0.00 179.45 179.49 1yr9 h MET 206 N 0.56 -0.49 -6.69 3.15 2.86 -0.25 -3.40 114.93 110.67 1yr9 h MET 206 Ca 0.36 0.03 -0.55 0.00 -2.06 0.00 0.00 59.70 57.48 1yr9 h MET 206 Cb 0.42 0.11 0.19 0.00 0.06 0.00 0.00 31.60 32.39 1yr9 h MET 206 CO -0.30 -0.33 -0.42 0.00 1.06 0.00 0.00 176.91 176.92 1yr9 n SER 208 N -0.53 -1.56 0.00 0.00 7.64 -1.26 -4.84 113.62 113.07 1yr9 n SER 208 Ca 0.09 0.00 0.11 0.00 1.01 0.00 0.00 58.87 60.08 1yr9 n SER 208 Cb 0.51 -0.26 0.57 0.00 -1.01 0.00 0.00 64.21 64.02 1yr9 n SER 208 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 1yr9 n MET 209 N -2.52 0.40 -0.06 1.43 0.00 -0.95 -1.38 117.12 114.04 1yr9 n MET 209 Ca 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 57.70 57.63 1yr9 n MET 209 Cb 0.00 -1.50 -0.05 0.00 0.00 0.00 0.00 33.22 31.67 1yr9 n MET 209 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 175.97 175.85 1yr9 n MET 210 N -1.22 0.28 -0.20 3.17 1.56 -1.26 -3.19 117.12 116.27 1yr9 n MET 210 Ca 0.12 0.12 -0.06 0.00 -0.27 0.00 0.00 57.70 57.61 1yr9 n MET 210 Cb 0.15 -0.98 -0.00 0.00 2.15 0.00 0.00 33.22 34.54 1yr9 n MET 210 CO 0.00 0.00 0.00 1.15 -0.73 0.00 0.00 175.97 176.39 1yr9 h THR 211 N -0.49 0.15 0.00 1.12 2.02 -1.93 -3.15 112.91 110.63 1yr9 h THR 211 Ca -0.31 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.87 1yr9 h THR 211 Cb 1.22 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1yr9 h THR 211 CO -0.19 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.08 1yr9 n GLU 212 N -5.43 0.00 -3.72 6.66 1.02 -0.48 -5.00 120.64 113.69 1yr9 n GLU 212 Ca 0.04 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.05 1yr9 n GLU 212 Cb 0.35 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.67 1yr9 n GLU 212 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1yr9 s VAL 213 N 0.00 -0.01 0.00 2.62 -7.23 -1.19 -5.04 120.40 109.56 1yr9 s VAL 213 Ca 0.00 0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.20 1yr9 s VAL 213 Cb 0.00 -0.59 0.00 0.00 0.56 0.00 0.00 36.38 36.35 1yr9 s VAL 213 CO 0.00 0.01 0.00 0.18 -0.31 0.00 0.00 175.10 174.98 1yr9 n LEU 214 N 3.31 0.00 -0.55 1.32 4.77 -1.19 -4.55 117.00 120.12 1yr9 n LEU 214 Ca -0.16 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.75 1yr9 n LEU 214 Cb 0.56 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.65 1yr9 n LEU 214 CO 0.11 0.00 0.05 -2.65 -1.33 0.00 0.00 177.39 173.57 1yr9 n PRO 215 N 0.00 0.00 -0.06 3.23 -0.02 -1.26 -4.74 135.00 132.15 1yr9 n PRO 215 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.46 1yr9 n PRO 215 Cb 0.00 -0.17 -0.01 0.00 -0.02 0.00 0.00 33.50 33.30 1yr9 n PRO 215 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1yr9 n PRO 216 N 0.17 -0.06 0.00 0.52 -0.01 -1.26 -4.98 135.00 129.37 1yr9 n PRO 216 Ca 0.02 0.57 0.00 0.00 -0.01 0.00 0.00 63.50 64.09 1yr9 n PRO 216 Cb 0.02 -0.85 0.00 0.00 -0.01 0.00 0.00 33.50 32.65 1yr9 n PRO 216 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 175.50 175.77 1yr9 n VAL 217 N -3.11 -0.60 -4.19 -1.45 0.31 -1.26 -5.02 118.33 103.01 1yr9 n VAL 217 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 63.99 1yr9 n VAL 217 Cb 0.04 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 32.86 1yr9 n VAL 217 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1yr9 s ARG 218 N -5.34 3.82 -0.05 5.55 3.52 -1.26 -4.88 118.95 120.31 1yr9 s ARG 218 Ca 0.00 -0.42 -0.27 0.00 -0.13 0.00 0.00 55.73 54.91 1yr9 s ARG 218 Cb 0.00 -3.07 -0.03 0.00 -1.56 0.00 0.00 34.95 30.29 1yr9 s ARG 218 CO 0.00 0.27 0.86 0.08 -0.81 0.00 0.00 175.30 175.70 1yr9 s VAL 219 N 0.33 4.93 -0.10 7.11 1.01 -1.26 -4.47 120.40 127.95 1yr9 s VAL 219 Ca 0.00 1.77 -0.17 0.00 0.00 0.00 0.00 61.98 63.58 1yr9 s VAL 219 Cb -0.13 -4.19 -0.05 0.00 0.00 0.00 0.00 36.38 32.01 1yr9 s VAL 219 CO 0.01 0.17 0.44 -0.76 0.00 0.00 0.00 175.10 174.96 1yr9 s LEU 220 N 1.14 4.30 -0.29 3.92 1.43 -0.39 -4.97 118.68 123.82 1yr9 s LEU 220 Ca 0.45 0.79 -0.11 0.00 -1.03 0.00 0.00 54.13 54.23 1yr9 s LEU 220 Cb -0.19 -2.63 -0.04 0.00 0.03 0.00 0.00 46.19 43.36 1yr9 s LEU 220 CO 0.22 0.07 0.19 -0.31 0.23 0.00 0.00 176.35 176.74 1yr9 s TYR 221 N 0.32 3.21 0.07 0.29 2.02 -1.26 -0.34 117.35 121.66 1yr9 s TYR 221 Ca 0.24 -0.03 0.06 0.00 -0.37 0.00 0.00 57.07 56.97 1yr9 s TYR 221 Cb -0.15 -2.39 -0.03 0.00 -0.40 0.00 0.00 41.96 39.00 1yr9 s TYR 221 CO 0.10 -0.23 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.17 1yr9 s LEU 222 N 1.73 2.25 -0.27 -1.29 1.43 -0.83 -3.81 118.68 117.89 1yr9 s LEU 222 Ca 0.07 -0.59 -0.04 0.00 -1.03 0.00 0.00 54.13 52.53 1yr9 s LEU 222 Cb -0.16 -0.65 0.10 0.00 0.03 0.00 0.00 46.19 45.50 1yr9 s LEU 222 CO 0.10 -0.01 0.13 -0.55 0.23 0.00 0.00 176.35 176.26 1yr9 s SER 223 N -1.61 3.27 0.16 2.29 0.15 -1.15 -1.47 113.70 115.34 1yr9 s SER 223 Ca 0.01 -1.16 -0.30 0.00 0.70 0.00 0.00 55.95 55.21 1yr9 s SER 223 Cb -0.09 -0.30 -0.04 0.00 -1.71 0.00 0.00 66.02 63.88 1yr9 s SER 223 CO 0.02 -0.42 1.54 0.00 1.20 0.00 0.00 173.24 175.59 1yr9 h ALA 224 N 8.41 -0.50 0.03 5.45 0.00 -1.92 -1.23 119.26 129.49 1yr9 h ALA 224 Ca -0.19 0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1yr9 h ALA 224 Cb 1.03 1.28 -0.04 0.00 0.00 0.00 0.00 17.79 20.07 1yr9 h ALA 224 CO 0.41 -0.94 -0.36 -0.22 0.00 0.00 0.00 179.25 178.14 1yr9 h LYS 225 N -0.07 -0.46 -1.03 0.00 3.64 -1.96 -3.26 116.57 113.43 1yr9 h LYS 225 Ca 0.17 0.03 -0.47 0.00 -1.27 0.00 0.00 60.65 59.11 1yr9 h LYS 225 Cb 0.46 0.10 -0.26 0.00 -0.41 0.00 0.00 32.23 32.13 1yr9 h LYS 225 CO -0.88 -0.30 0.60 0.25 -2.27 0.00 0.00 179.45 176.84 1yr9 n THR 226 N -4.50 2.98 -3.39 1.00 -2.24 -0.90 -4.92 114.28 102.30 1yr9 n THR 226 Ca -0.05 -1.81 -0.21 0.00 -2.27 0.00 0.00 64.05 59.71 1yr9 n THR 226 Cb 0.27 -0.68 -0.04 0.00 -2.10 0.00 0.00 70.33 67.79 1yr9 n THR 226 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1yr9 n ARG 227 N -0.83 -1.79 -2.25 -0.78 3.00 -0.51 -4.88 116.66 108.62 1yr9 n ARG 227 Ca 0.51 0.07 -0.42 0.00 -0.01 0.00 0.00 57.85 58.00 1yr9 n ARG 227 Cb 1.34 -4.34 -0.03 0.00 0.00 0.00 0.00 32.46 29.42 1yr9 n ARG 227 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1yr9 s GLU 228 N -5.81 4.33 0.00 5.56 0.41 -1.19 -3.30 118.70 118.70 1yr9 s GLU 228 Ca 0.40 1.96 0.00 0.00 -0.41 0.00 0.00 54.97 56.92 1yr9 s GLU 228 Cb -0.23 -3.40 0.00 0.00 -1.78 0.00 0.00 34.13 28.71 1yr9 s GLU 228 CO 0.49 -0.46 0.00 0.41 -0.49 0.00 0.00 175.26 175.22 1yr9 n GLY 229 N 3.50 0.14 0.23 -1.39 0.00 -1.25 -2.94 105.19 103.48 1yr9 n GLY 229 Ca 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 1yr9 n GLY 229 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1yr9 h PHE 230 N 0.00 0.58 -0.33 1.61 -1.00 -1.85 -2.64 116.94 113.31 1yr9 h PHE 230 Ca 0.00 0.02 0.06 0.00 2.81 0.00 0.00 57.97 60.86 1yr9 h PHE 230 Cb 0.68 -0.18 -0.05 0.00 3.61 0.00 0.00 35.95 40.01 1yr9 h PHE 230 CO 0.43 0.29 0.02 0.93 -1.61 0.00 0.00 178.31 178.37 1yr9 h GLU 231 N 0.60 0.11 -0.67 1.51 3.07 -1.89 -2.63 114.58 114.69 1yr9 h GLU 231 Ca 0.25 -0.01 0.04 0.00 -0.50 0.00 0.00 59.36 59.14 1yr9 h GLU 231 Cb 0.13 -0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 27.96 1yr9 h GLU 231 CO -0.15 0.08 0.40 -0.44 -1.40 0.00 0.00 179.01 177.49 1yr9 h ASP 232 N 0.12 0.64 -0.73 1.42 3.45 -1.88 -1.53 116.42 117.91 1yr9 h ASP 232 Ca 0.16 0.01 0.12 0.00 0.43 0.00 0.00 57.03 57.75 1yr9 h ASP 232 Cb 0.21 -0.13 -0.13 0.00 -0.56 0.00 0.00 39.33 38.72 1yr9 h ASP 232 CO -0.25 0.44 -0.36 0.25 -1.57 0.00 0.00 179.24 177.74 1yr9 h LEU 233 N 0.77 -1.29 -0.55 1.55 5.85 -1.20 -0.87 115.31 119.57 1yr9 h LEU 233 Ca 0.28 0.26 0.08 0.00 0.84 0.00 0.00 57.88 59.33 1yr9 h LEU 233 Cb 0.07 0.65 -0.10 0.00 0.37 0.00 0.00 40.66 41.65 1yr9 h LEU 233 CO -0.13 -0.30 -0.46 -0.33 -0.34 0.00 0.00 178.44 176.89 1yr9 h GLU 234 N -0.11 -0.25 0.00 1.25 5.08 -1.23 0.50 114.58 119.82 1yr9 h GLU 234 Ca 0.26 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1yr9 h GLU 234 Cb 0.57 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1yr9 h GLU 234 CO -0.78 -0.16 0.00 0.25 -1.00 0.00 0.00 179.01 177.31 1yr9 n THR 235 N -5.40 0.00 -0.19 1.13 -2.24 -0.41 0.13 114.28 107.30 1yr9 n THR 235 Ca 0.01 1.24 -0.02 0.00 -2.27 0.00 0.00 64.05 63.01 1yr9 n THR 235 Cb 0.35 -2.01 0.00 0.00 -2.10 0.00 0.00 70.33 66.57 1yr9 n THR 235 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1yr9 n LEU 236 N -1.57 -0.37 -0.11 3.22 4.32 -0.74 0.12 117.00 121.87 1yr9 n LEU 236 Ca 0.00 0.84 -0.14 0.00 -0.02 0.00 0.00 56.01 56.69 1yr9 n LEU 236 Cb 0.00 -0.17 -0.09 0.00 -1.62 0.00 0.00 43.42 41.54 1yr9 n LEU 236 CO 0.00 -0.74 0.51 0.00 -1.22 0.00 0.00 177.39 175.94 1yr9 h ALA 237 N 0.54 -0.77 0.27 -1.18 0.00 0.85 0.40 119.26 119.36 1yr9 h ALA 237 Ca 0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1yr9 h ALA 237 Cb 0.26 1.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1yr9 h ALA 237 CO -0.47 -1.04 -0.15 -0.92 0.00 0.00 0.00 179.25 176.66 1yr9 h TYR 238 N -0.44 -0.40 -0.53 0.00 3.20 0.50 0.10 116.97 119.41 1yr9 h TYR 238 Ca 0.07 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.02 1yr9 h TYR 238 Cb 0.62 0.14 -0.03 0.00 1.54 0.00 0.00 36.73 39.00 1yr9 h TYR 238 CO -0.68 -0.24 0.36 0.93 -1.64 0.00 0.00 178.16 176.88 1yr9 h GLU 239 N -0.40 0.35 0.03 1.82 5.08 0.10 0.78 114.58 122.35 1yr9 h GLU 239 Ca -0.03 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 1yr9 h GLU 239 Cb 0.33 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.51 1yr9 h GLU 239 CO 0.03 0.23 -0.34 1.25 -1.00 0.00 0.00 179.01 179.19 1yr9 h HIS 240 N 0.36 0.28 -0.91 4.33 2.76 -0.11 -2.24 115.15 119.63 1yr9 h HIS 240 Ca 0.24 -0.17 0.14 0.00 -2.20 0.00 0.00 60.37 58.38 1yr9 h HIS 240 Cb 0.48 -0.02 -0.07 0.00 1.55 0.00 0.00 27.41 29.34 1yr9 h HIS 240 CO -0.00 1.05 0.58 -0.92 -1.30 0.00 0.00 177.93 177.34 1yr9 h TYR 241 N -0.57 0.85 0.02 5.26 5.03 0.11 -1.62 116.97 126.04 1yr9 h TYR 241 Ca -0.05 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.28 1yr9 h TYR 241 Cb 1.17 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 39.18 1yr9 h TYR 241 CO 0.21 0.31 -0.01 0.00 -1.32 0.00 0.00 178.16 177.35 1yr9 n THR 243 N -2.09 -0.23 -0.57 0.00 -1.04 -0.84 -5.09 114.28 104.42 1yr9 n THR 243 Ca -0.00 1.19 0.00 0.00 -2.04 0.00 0.00 64.05 63.20 1yr9 n THR 243 Cb 0.01 -1.73 0.00 0.00 -1.82 0.00 0.00 70.33 66.79 1yr9 n THR 243 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43