#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mcr s SER 2 N 0.00 5.73 0.52 3.54 0.01 -1.26 -5.06 113.70 117.17 1mcr s SER 2 Ca 0.00 0.70 -0.03 0.00 1.31 0.00 0.00 55.95 57.94 1mcr s SER 2 Cb 0.00 -1.77 0.04 0.00 0.21 0.00 0.00 66.02 64.50 1mcr s SER 2 CO 0.00 -0.95 0.09 0.00 0.41 0.00 0.00 173.24 172.80 1mcr n ALA 3 N -2.48 -0.57 -3.73 1.44 0.00 -1.26 -4.95 120.51 108.96 1mcr n ALA 3 Ca 0.04 -0.17 -0.17 0.00 0.00 0.00 0.00 53.44 53.14 1mcr n ALA 3 Cb 0.57 -0.01 -0.16 0.00 0.00 0.00 0.00 19.45 19.84 1mcr n ALA 3 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1mcr s LEU 4 N 0.00 0.93 0.18 0.00 2.96 -1.24 -4.90 118.68 116.61 1mcr s LEU 4 Ca 0.07 0.01 -0.12 0.00 -0.22 0.00 0.00 54.13 53.87 1mcr s LEU 4 Cb -0.01 -0.18 -0.07 0.00 0.50 0.00 0.00 46.19 46.43 1mcr s LEU 4 CO 0.06 -0.14 0.55 -0.89 -1.32 0.00 0.00 176.35 174.61 1mcr s THR 5 N 1.29 4.89 -0.00 3.68 2.01 0.12 -3.34 115.64 124.29 1mcr s THR 5 Ca -0.06 0.67 0.01 0.00 0.31 0.00 0.00 61.69 62.62 1mcr s THR 5 Cb -0.13 -3.68 0.00 0.00 0.01 0.00 0.00 72.50 68.70 1mcr s THR 5 CO -0.03 0.11 -0.02 -1.10 -0.69 0.00 0.00 174.62 172.89 1mcr s GLN 6 N -2.33 0.20 0.65 4.92 -0.21 -1.26 0.19 119.66 121.82 1mcr s GLN 6 Ca 0.42 -0.06 -0.17 0.00 0.02 0.00 0.00 55.36 55.56 1mcr s GLN 6 Cb -0.13 -0.22 -0.00 0.00 1.00 0.00 0.00 33.01 33.66 1mcr s GLN 6 CO 0.20 0.03 1.20 -1.25 -2.12 0.00 0.00 175.29 173.35 1mcr s PRO 7 N 0.07 2.62 0.00 2.91 0.04 -1.26 -4.66 135.00 134.72 1mcr s PRO 7 Ca -0.00 1.78 0.16 0.00 0.04 0.00 0.00 61.00 62.97 1mcr s PRO 7 Cb -0.02 -1.89 0.86 0.00 0.04 0.00 0.00 34.50 33.48 1mcr s PRO 7 CO -0.00 -1.47 1.42 -2.30 0.04 0.00 0.00 177.00 174.69 1mcr n PRO 8 N -2.10 0.33 -3.42 0.56 -0.02 -1.26 -4.24 135.00 124.85 1mcr n PRO 8 Ca 0.13 0.09 0.01 0.00 -2.02 0.00 0.00 63.50 61.71 1mcr n PRO 8 Cb 0.50 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.44 1mcr n PRO 8 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1mcr s SER 9 N -2.35 -0.78 -1.04 2.55 0.15 -1.26 -4.18 113.70 106.78 1mcr s SER 9 Ca 0.18 0.96 -0.05 0.00 0.70 0.00 0.00 55.95 57.74 1mcr s SER 9 Cb 0.11 1.84 0.28 0.00 -1.71 0.00 0.00 66.02 66.54 1mcr s SER 9 CO 0.22 -0.15 1.20 0.00 1.20 0.00 0.00 173.24 175.71 1mcr n ALA 10 N 5.18 4.55 -2.36 5.45 0.00 -0.78 -4.93 120.51 127.62 1mcr n ALA 10 Ca -0.09 -4.72 -0.42 0.00 0.00 0.00 0.00 53.44 48.21 1mcr n ALA 10 Cb 0.52 -2.21 -0.03 0.00 0.00 0.00 0.00 19.45 17.73 1mcr n ALA 10 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1mcr s SER 11 N -0.37 6.97 0.54 0.00 0.01 -1.26 -3.89 113.70 115.70 1mcr s SER 11 Ca 0.31 1.92 0.04 0.00 1.31 0.00 0.00 55.95 59.53 1mcr s SER 11 Cb -0.02 -2.56 0.03 0.00 0.21 0.00 0.00 66.02 63.68 1mcr s SER 11 CO -0.01 -0.65 0.30 -0.83 0.41 0.00 0.00 173.24 172.46 1mcr s GLY 12 N 1.68 2.58 -0.30 3.44 0.00 0.89 -4.95 107.32 110.66 1mcr s GLY 12 Ca 0.59 -0.92 0.02 0.00 0.00 0.00 0.00 44.72 44.41 1mcr s GLY 12 CO 0.23 -2.02 0.02 -0.56 0.00 0.00 0.00 173.10 170.77 1mcr s SER 13 N -4.19 4.32 0.31 1.64 0.01 -1.26 -0.72 113.70 113.82 1mcr s SER 13 Ca 0.25 -1.72 -0.13 0.00 1.31 0.00 0.00 55.95 55.66 1mcr s SER 13 Cb -0.01 -1.31 -0.10 0.00 0.21 0.00 0.00 66.02 64.80 1mcr s SER 13 CO 0.15 -0.34 -0.02 -0.11 0.41 0.00 0.00 173.24 173.33 1mcr n LEU 14 N 4.52 -2.24 0.00 2.44 7.94 0.19 -0.91 117.00 128.95 1mcr n LEU 14 Ca -0.03 0.49 0.00 0.00 -1.11 0.00 0.00 56.01 55.36 1mcr n LEU 14 Cb 0.43 -0.58 0.00 0.00 0.53 0.00 0.00 43.42 43.79 1mcr n LEU 14 CO 0.18 -3.05 0.00 0.61 -1.11 0.00 0.00 177.39 174.02 1mcr n GLY 15 N 1.64 2.02 0.00 -3.96 0.00 -0.35 -4.90 105.19 99.63 1mcr n GLY 15 Ca 0.06 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1mcr n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mcr n GLN 16 N 0.00 0.00 -3.70 1.61 10.64 -0.09 -2.44 117.38 123.40 1mcr n GLN 16 Ca 0.00 0.00 -0.08 0.00 -1.83 0.00 0.00 57.00 55.09 1mcr n GLN 16 Cb 0.00 0.00 -0.02 0.00 -0.86 0.00 0.00 30.24 29.36 1mcr n GLN 16 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 1mcr s SER 17 N -2.20 -0.34 -0.30 2.61 0.15 -1.26 -1.08 113.70 111.28 1mcr s SER 17 Ca 0.00 -0.37 -0.19 0.00 0.70 0.00 0.00 55.95 56.09 1mcr s SER 17 Cb 0.00 0.64 0.19 0.00 -1.71 0.00 0.00 66.02 65.14 1mcr s SER 17 CO 0.00 -1.14 1.26 0.54 1.20 0.00 0.00 173.24 175.10 1mcr s VAL 18 N -3.74 0.00 0.34 4.45 0.11 0.84 -4.65 120.40 117.75 1mcr s VAL 18 Ca 0.08 0.00 0.08 0.00 -2.93 0.00 0.00 61.98 59.21 1mcr s VAL 18 Cb -0.04 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.77 1mcr s VAL 18 CO -0.00 0.00 0.12 0.42 -3.33 0.00 0.00 175.10 172.31 1mcr s THR 19 N 0.72 2.96 -0.15 5.04 -4.23 -1.26 -1.03 115.64 117.69 1mcr s THR 19 Ca -0.03 -1.74 -0.10 0.00 -1.18 0.00 0.00 61.69 58.65 1mcr s THR 19 Cb -0.03 -2.95 0.05 0.00 1.34 0.00 0.00 72.50 70.90 1mcr s THR 19 CO -0.12 -0.18 0.37 -0.63 -0.54 0.00 0.00 174.62 173.51 1mcr s ILE 20 N -2.44 -0.02 0.55 2.99 1.01 0.03 -4.94 121.20 118.38 1mcr s ILE 20 Ca 0.37 0.07 0.04 0.00 0.00 0.00 0.00 60.65 61.13 1mcr s ILE 20 Cb -0.02 -0.54 0.05 0.00 0.01 0.00 0.00 42.46 41.97 1mcr s ILE 20 CO 0.22 0.03 0.76 -0.44 0.00 0.00 0.00 174.94 175.51 1mcr s SER 21 N 0.92 5.17 -0.18 3.58 0.01 -1.26 0.30 113.70 122.24 1mcr s SER 21 Ca -0.06 -0.35 -0.07 0.00 1.31 0.00 0.00 55.95 56.78 1mcr s SER 21 Cb -0.07 -0.43 0.08 0.00 0.21 0.00 0.00 66.02 65.82 1mcr s SER 21 CO -0.07 -1.21 0.39 0.00 0.41 0.00 0.00 173.24 172.75 1mcr s THR 23 N 2.35 1.73 0.00 0.00 2.01 0.13 0.42 115.64 122.27 1mcr s THR 23 Ca -0.03 -0.78 0.00 0.00 0.31 0.00 0.00 61.69 61.19 1mcr s THR 23 Cb -0.11 -1.55 0.00 0.00 0.01 0.00 0.00 72.50 70.85 1mcr s THR 23 CO -0.12 0.49 0.00 0.61 -0.69 0.00 0.00 174.62 174.91 1mcr n GLY 24 N 4.12 4.27 3.94 4.40 0.00 0.07 0.13 105.19 122.12 1mcr n GLY 24 Ca -0.19 -2.08 -0.24 0.00 0.00 0.00 0.00 46.02 43.51 1mcr n GLY 24 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1mcr s THR 25 N -1.17 4.64 0.42 2.61 -1.32 0.64 -4.79 115.64 116.67 1mcr s THR 25 Ca 0.00 -0.34 0.29 0.00 -1.21 0.00 0.00 61.69 60.42 1mcr s THR 25 Cb 0.00 -3.72 0.46 0.00 -1.51 0.00 0.00 72.50 67.74 1mcr s THR 25 CO 0.00 -0.53 1.60 0.28 -2.21 0.00 0.00 174.62 173.76 1mcr h SER 26 N 0.51 0.25 0.00 8.08 0.02 -1.95 -0.00 113.55 120.45 1mcr h SER 26 Ca -0.48 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1mcr h SER 26 Cb 1.23 0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.94 1mcr h SER 26 CO 0.60 -0.26 -0.25 0.77 -1.14 0.00 0.00 176.83 176.54 1mcr h SER 27 N 0.04 0.00 -1.57 3.07 4.64 -1.91 0.78 113.55 118.60 1mcr h SER 27 Ca 0.85 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.61 1mcr h SER 27 Cb 2.61 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 64.61 1mcr h SER 27 CO -0.51 0.54 1.31 1.51 -0.87 0.00 0.00 176.83 178.81 1mcr s ASP 28 N -5.25 6.30 0.00 4.97 1.47 -0.06 -2.73 116.67 121.36 1mcr s ASP 28 Ca -0.07 -1.02 0.00 0.00 1.18 0.00 0.00 52.55 52.63 1mcr s ASP 28 Cb 0.01 -2.57 0.00 0.00 -0.34 0.00 0.00 42.92 40.02 1mcr s ASP 28 CO 0.11 -1.69 0.00 0.52 0.68 0.00 0.00 175.17 174.79 1mcr n VAL 29 N 6.75 0.00 -0.10 2.11 0.31 -1.23 -0.26 118.33 125.91 1mcr n VAL 29 Ca 0.22 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.53 1mcr n VAL 29 Cb 0.50 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.41 1mcr n VAL 29 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1mcr n GLY 30 N 0.00 -1.44 0.11 2.92 0.00 -0.89 -3.25 105.19 102.63 1mcr n GLY 30 Ca 0.00 0.43 -0.20 0.00 0.00 0.00 0.00 46.02 46.25 1mcr n GLY 30 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1mcr h GLY 31 N 0.00 0.10 -1.78 -0.02 0.00 0.79 -3.43 103.07 98.73 1mcr h GLY 31 Ca 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.12 1mcr h GLY 31 CO -0.22 0.22 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 1mcr n TYR 32 N -4.26 0.73 -2.32 5.60 4.02 -1.20 -4.93 117.16 114.81 1mcr n TYR 32 Ca -0.26 -0.31 0.00 0.00 -0.01 0.00 0.00 57.90 57.32 1mcr n TYR 32 Cb 0.73 -0.11 0.00 0.00 -0.02 0.00 0.00 39.34 39.94 1mcr n TYR 32 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1mcr n ASN 33 N 0.57 0.00 -0.26 7.72 5.03 -1.24 -4.74 115.26 122.33 1mcr n ASN 33 Ca 0.14 0.00 0.09 0.00 0.87 0.00 0.00 54.58 55.68 1mcr n ASN 33 Cb 0.48 0.00 0.17 0.00 -1.02 0.00 0.00 39.78 39.40 1mcr n ASN 33 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1mcr n TYR 34 N -0.72 0.01 -1.56 3.10 4.01 -1.26 -4.44 117.16 116.31 1mcr n TYR 34 Ca 0.00 -1.18 -0.38 0.00 -0.16 0.00 0.00 57.90 56.19 1mcr n TYR 34 Cb 0.00 -0.19 0.05 0.00 -0.31 0.00 0.00 39.34 38.89 1mcr n TYR 34 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 1mcr n VAL 35 N -1.32 3.21 -4.05 -0.72 3.14 -1.25 -4.16 118.33 113.18 1mcr n VAL 35 Ca 0.17 -0.50 -0.10 0.00 -2.96 0.00 0.00 64.34 60.96 1mcr n VAL 35 Cb 0.66 -0.97 -0.08 0.00 -1.06 0.00 0.00 33.84 32.39 1mcr n VAL 35 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1mcr s SER 36 N -1.24 0.17 -0.06 6.55 0.01 0.63 -0.26 113.70 119.51 1mcr s SER 36 Ca 0.74 -1.03 0.02 0.00 1.31 0.00 0.00 55.95 56.99 1mcr s SER 36 Cb -0.42 0.37 0.02 0.00 0.21 0.00 0.00 66.02 66.19 1mcr s SER 36 CO 0.49 -0.81 -0.09 0.26 0.41 0.00 0.00 173.24 173.50 1mcr s TRP 37 N -4.00 1.17 -0.26 2.43 0.52 -0.15 -0.33 118.94 118.30 1mcr s TRP 37 Ca 0.20 -0.40 -0.01 0.00 0.02 0.00 0.00 56.10 55.91 1mcr s TRP 37 Cb 0.05 -0.90 0.04 0.00 -1.15 0.00 0.00 33.47 31.51 1mcr s TRP 37 CO 0.01 -0.24 -0.05 0.71 0.02 0.00 0.00 176.95 177.40 1mcr s TYR 38 N 0.74 3.14 -1.00 -1.98 2.02 0.52 -0.18 117.35 120.61 1mcr s TYR 38 Ca -0.13 -1.72 -0.23 0.00 -0.37 0.00 0.00 57.07 54.62 1mcr s TYR 38 Cb -0.15 -2.06 0.03 0.00 -0.40 0.00 0.00 41.96 39.38 1mcr s TYR 38 CO 0.02 -0.77 1.55 -1.14 -1.57 0.00 0.00 175.55 173.64 1mcr s GLN 39 N 1.28 3.40 -0.24 -0.62 0.74 0.19 -1.93 119.66 122.49 1mcr s GLN 39 Ca -0.02 -0.98 -0.29 0.00 0.05 0.00 0.00 55.36 54.12 1mcr s GLN 39 Cb -0.18 -5.31 0.01 0.00 1.10 0.00 0.00 33.01 28.63 1mcr s GLN 39 CO -0.04 -2.43 1.02 -1.14 -0.55 0.00 0.00 175.29 172.16 1mcr s GLN 40 N 5.34 4.23 -0.66 1.67 0.74 0.32 -3.91 119.66 127.39 1mcr s GLN 40 Ca 0.51 1.29 -0.22 0.00 0.05 0.00 0.00 55.36 56.99 1mcr s GLN 40 Cb -0.01 -3.65 0.08 0.00 1.10 0.00 0.00 33.01 30.53 1mcr s GLN 40 CO -0.08 -0.64 0.93 -1.01 -0.55 0.00 0.00 175.29 173.94 1mcr s HIS 41 N 3.21 2.74 -0.02 1.67 3.76 -1.26 -0.70 115.29 124.69 1mcr s HIS 41 Ca 0.43 -0.66 -0.02 0.00 -0.15 0.00 0.00 55.06 54.67 1mcr s HIS 41 Cb -0.15 -4.25 0.00 0.00 1.11 0.00 0.00 32.58 29.29 1mcr s HIS 41 CO 0.07 -1.59 0.03 0.00 -0.85 0.00 0.00 174.74 172.40 1mcr n ALA 42 N 7.44 -1.06 0.00 -1.40 0.00 -1.26 0.14 120.51 124.38 1mcr n ALA 42 Ca -0.03 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1mcr n ALA 42 Cb 0.45 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1mcr n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mcr n GLY 43 N 0.10 2.35 0.00 0.00 0.00 -1.26 -5.02 105.19 101.35 1mcr n GLY 43 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1mcr n GLY 43 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1mcr n LYS 44 N 0.00 -0.87 -2.33 1.61 4.81 0.12 -5.05 118.16 116.46 1mcr n LYS 44 Ca 0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.05 1mcr n LYS 44 Cb 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.02 1mcr n LYS 44 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1mcr s ALA 45 N -2.97 3.32 -2.61 3.14 0.00 -1.26 -4.66 121.76 116.71 1mcr s ALA 45 Ca 0.00 1.00 0.25 0.00 0.00 0.00 0.00 51.96 53.21 1mcr s ALA 45 Cb 0.00 -3.38 0.70 0.00 0.00 0.00 0.00 23.12 20.44 1mcr s ALA 45 CO 0.00 -0.41 1.55 -0.35 0.00 0.00 0.00 175.76 176.54 1mcr n PRO 46 N 0.62 1.94 0.00 0.00 -0.04 -1.26 -4.05 135.00 132.20 1mcr n PRO 46 Ca 0.01 -1.38 0.00 0.00 -0.04 0.00 0.00 63.50 62.10 1mcr n PRO 46 Cb 0.45 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 1mcr n PRO 46 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1mcr n LYS 47 N 0.65 0.00 -2.34 0.54 2.85 -1.25 -0.63 118.16 117.98 1mcr n LYS 47 Ca 0.17 0.00 -0.40 0.00 -1.05 0.00 0.00 58.31 57.03 1mcr n LYS 47 Cb 0.44 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.79 1mcr n LYS 47 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1mcr s VAL 48 N 0.00 3.20 0.00 0.58 0.11 -1.26 -1.37 120.40 121.66 1mcr s VAL 48 Ca 0.00 1.20 0.00 0.00 -2.93 0.00 0.00 61.98 60.25 1mcr s VAL 48 Cb 0.00 -3.76 0.00 0.00 -1.53 0.00 0.00 36.38 31.09 1mcr s VAL 48 CO 0.00 0.28 0.15 2.30 -3.33 0.00 0.00 175.10 174.50 1mcr n ILE 49 N 1.12 0.00 -3.30 7.04 -5.35 0.75 -4.87 119.36 114.75 1mcr n ILE 49 Ca -0.00 -0.47 -0.06 0.00 -0.27 0.00 0.00 62.75 61.94 1mcr n ILE 49 Cb 0.44 1.02 -0.06 0.00 -1.74 0.00 0.00 39.64 39.29 1mcr n ILE 49 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1mcr s ILE 50 N -0.64 -0.70 -0.12 7.28 -1.09 -1.18 -4.59 121.20 120.17 1mcr s ILE 50 Ca 0.00 -0.10 -0.11 0.00 -2.23 0.00 0.00 60.65 58.21 1mcr s ILE 50 Cb 0.00 -0.89 -0.05 0.00 -1.58 0.00 0.00 42.46 39.94 1mcr s ILE 50 CO 0.00 -0.13 0.23 -0.72 -1.23 0.00 0.00 174.94 173.09 1mcr s TYR 51 N 2.62 3.56 -0.53 3.97 1.13 -0.49 -0.98 117.35 126.62 1mcr s TYR 51 Ca 0.14 0.60 -0.12 0.00 -1.41 0.00 0.00 57.07 56.27 1mcr s TYR 51 Cb -0.14 -2.14 0.02 0.00 -1.10 0.00 0.00 41.96 38.59 1mcr s TYR 51 CO -0.20 0.52 0.63 -1.91 -2.51 0.00 0.00 175.55 172.08 1mcr n GLU 52 N 2.62 -2.03 0.00 -3.49 2.13 -0.94 -3.16 120.64 115.76 1mcr n GLU 52 Ca -0.16 1.88 0.00 0.00 0.66 0.00 0.00 57.16 59.54 1mcr n GLU 52 Cb 0.53 -5.47 0.00 0.00 0.27 0.00 0.00 31.44 26.77 1mcr n GLU 52 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1mcr n VAL 53 N -0.78 0.00 0.00 6.31 0.31 0.65 -1.79 118.33 123.03 1mcr n VAL 53 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1mcr n VAL 53 Cb 0.49 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.42 1mcr n VAL 53 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1mcr n ASN 54 N 0.00 3.08 -4.68 4.52 2.04 -1.26 -4.26 115.26 114.70 1mcr n ASN 54 Ca 0.00 0.00 -0.42 0.00 -0.44 0.00 0.00 54.58 53.72 1mcr n ASN 54 Cb 0.00 0.28 -0.03 0.00 -2.53 0.00 0.00 39.78 37.50 1mcr n ASN 54 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1mcr s LYS 55 N -1.63 4.14 -0.20 -3.83 1.02 -0.74 -4.68 119.74 113.83 1mcr s LYS 55 Ca 0.00 2.60 -0.25 0.00 0.02 0.00 0.00 55.97 58.33 1mcr s LYS 55 Cb 0.00 -3.78 -0.01 0.00 -0.52 0.00 0.00 37.83 33.52 1mcr s LYS 55 CO 0.00 -0.88 0.83 0.50 -0.92 0.00 0.00 175.35 174.88 1mcr s ARG 56 N 3.31 4.26 0.87 1.68 3.52 -1.26 -1.40 118.95 129.93 1mcr s ARG 56 Ca 0.83 0.99 -0.14 0.00 -0.13 0.00 0.00 55.73 57.29 1mcr s ARG 56 Cb -0.45 -3.60 0.02 0.00 -1.56 0.00 0.00 34.95 29.36 1mcr s ARG 56 CO 0.38 -0.40 0.53 -2.30 -0.81 0.00 0.00 175.30 172.70 1mcr n PRO 57 N 5.52 -0.07 0.03 5.12 -0.02 -1.26 -4.94 135.00 139.39 1mcr n PRO 57 Ca 0.05 0.03 0.13 0.00 -2.02 0.00 0.00 63.50 61.69 1mcr n PRO 57 Cb 0.48 -1.91 0.45 0.00 -0.02 0.00 0.00 33.50 32.50 1mcr n PRO 57 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1mcr n SER 58 N -1.24 0.37 -1.85 2.55 7.64 -1.26 -3.64 113.62 116.19 1mcr n SER 58 Ca 0.08 0.35 0.01 0.00 1.01 0.00 0.00 58.87 60.32 1mcr n SER 58 Cb 0.52 -0.37 0.33 0.00 -1.01 0.00 0.00 64.21 63.68 1mcr n SER 58 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mcr n GLY 59 N 1.43 3.15 3.10 0.23 0.00 -1.26 -4.95 105.19 106.89 1mcr n GLY 59 Ca 0.06 -0.87 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 1mcr n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mcr s VAL 60 N -2.70 0.37 0.50 1.61 1.01 -1.24 -5.06 120.40 114.89 1mcr s VAL 60 Ca 0.50 -1.75 -0.02 0.00 0.00 0.00 0.00 61.98 60.71 1mcr s VAL 60 Cb 0.39 -1.43 -0.00 0.00 0.00 0.00 0.00 36.38 35.34 1mcr s VAL 60 CO 0.14 -0.90 0.76 -2.84 0.00 0.00 0.00 175.10 172.25 1mcr s PRO 61 N -3.61 3.06 0.12 2.72 0.02 -1.26 -4.91 135.00 131.14 1mcr s PRO 61 Ca 0.06 -0.27 -0.14 0.00 0.02 0.00 0.00 61.00 60.67 1mcr s PRO 61 Cb 0.05 -2.45 -0.03 0.00 0.02 0.00 0.00 34.50 32.09 1mcr s PRO 61 CO -0.07 -0.41 1.51 0.38 -0.33 0.00 0.00 177.00 178.08 1mcr h ASP 62 N 0.19 0.80 0.00 2.53 2.03 -2.00 -2.44 116.42 117.53 1mcr h ASP 62 Ca -0.46 -0.38 0.00 0.00 -0.73 0.00 0.00 57.03 55.46 1mcr h ASP 62 Cb 1.25 -0.22 0.00 0.00 -0.83 0.00 0.00 39.33 39.53 1mcr h ASP 62 CO 0.59 1.00 0.00 0.54 -1.03 0.00 0.00 179.24 180.34 1mcr n ARG 63 N -4.30 0.27 -3.96 4.15 5.12 -1.26 -4.70 116.66 111.98 1mcr n ARG 63 Ca -0.02 0.00 -0.27 0.00 -1.93 0.00 0.00 57.85 55.63 1mcr n ARG 63 Cb 0.39 -1.32 -0.04 0.00 -1.16 0.00 0.00 32.46 30.33 1mcr n ARG 63 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1mcr s PHE 64 N -2.00 3.45 -0.04 -1.55 0.08 -0.92 -2.07 117.98 114.93 1mcr s PHE 64 Ca 0.08 0.12 -0.15 0.00 0.12 0.00 0.00 56.93 57.11 1mcr s PHE 64 Cb 0.04 -1.66 0.05 0.00 -0.57 0.00 0.00 43.02 40.87 1mcr s PHE 64 CO 0.06 0.53 0.68 -1.13 -0.10 0.00 0.00 175.22 175.26 1mcr n SER 65 N -0.35 -0.52 -3.68 1.36 3.41 -0.72 -4.92 113.62 108.20 1mcr n SER 65 Ca -0.07 -1.03 -0.14 0.00 -0.26 0.00 0.00 58.87 57.37 1mcr n SER 65 Cb 0.53 0.79 -0.08 0.00 -0.26 0.00 0.00 64.21 65.19 1mcr n SER 65 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1mcr s GLY 66 N -3.45 -0.34 -0.06 5.00 0.00 -1.25 -1.28 107.32 105.95 1mcr s GLY 66 Ca 0.16 0.97 -0.01 0.00 0.00 0.00 0.00 44.72 45.84 1mcr s GLY 66 CO -0.01 0.74 0.02 -1.35 0.00 0.00 0.00 173.10 172.49 1mcr s SER 67 N -0.68 1.33 -0.34 1.64 1.04 0.95 -4.40 113.70 113.24 1mcr s SER 67 Ca -0.08 -0.04 -0.26 0.00 0.48 0.00 0.00 55.95 56.05 1mcr s SER 67 Cb -0.03 -0.34 0.01 0.00 0.10 0.00 0.00 66.02 65.76 1mcr s SER 67 CO 0.04 -0.19 0.95 -0.75 0.98 0.00 0.00 173.24 174.27 1mcr s LYS 68 N 1.89 3.95 0.00 4.02 2.47 -1.26 -1.05 119.74 129.76 1mcr s LYS 68 Ca 0.03 0.76 0.00 0.00 -1.56 0.00 0.00 55.97 55.20 1mcr s LYS 68 Cb -0.12 -3.76 0.00 0.00 -1.46 0.00 0.00 37.83 32.48 1mcr s LYS 68 CO -0.04 -0.88 0.00 -1.13 0.16 0.00 0.00 175.35 173.46 1mcr n SER 69 N 6.69 0.00 0.07 1.43 3.41 -0.26 -5.01 113.62 119.96 1mcr n SER 69 Ca 0.08 0.41 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 1mcr n SER 69 Cb 0.48 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 1mcr n SER 69 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mcr n GLY 70 N 1.93 -1.68 0.03 5.00 0.00 -1.26 -4.95 105.19 104.26 1mcr n GLY 70 Ca 0.00 0.55 -0.04 0.00 0.00 0.00 0.00 46.02 46.54 1mcr n GLY 70 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mcr n ASN 71 N -2.88 3.64 -4.87 1.61 4.13 -1.26 -3.53 115.26 112.10 1mcr n ASN 71 Ca 0.00 -0.02 -0.30 0.00 1.68 0.00 0.00 54.58 55.93 1mcr n ASN 71 Cb 0.00 0.13 -0.02 0.00 -1.54 0.00 0.00 39.78 38.35 1mcr n ASN 71 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1mcr s THR 72 N -2.12 4.72 -0.18 3.41 2.01 -1.26 -0.76 115.64 121.47 1mcr s THR 72 Ca -0.06 0.77 -0.13 0.00 0.31 0.00 0.00 61.69 62.58 1mcr s THR 72 Cb 0.02 -3.77 0.05 0.00 0.01 0.00 0.00 72.50 68.81 1mcr s THR 72 CO 0.15 -0.72 0.45 0.00 -0.69 0.00 0.00 174.62 173.81 1mcr s ALA 73 N -2.63 -1.14 0.03 7.40 0.00 0.17 -1.10 121.76 124.48 1mcr s ALA 73 Ca 0.53 1.45 0.02 0.00 0.00 0.00 0.00 51.96 53.96 1mcr s ALA 73 Cb -0.10 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.14 1mcr s ALA 73 CO 0.37 -0.24 -0.07 -1.12 0.00 0.00 0.00 175.76 174.70 1mcr s SER 74 N 0.78 0.75 0.05 0.00 0.01 -0.22 0.35 113.70 115.43 1mcr s SER 74 Ca -0.04 -0.44 -0.13 0.00 1.31 0.00 0.00 55.95 56.65 1mcr s SER 74 Cb -0.05 0.02 -0.06 0.00 0.21 0.00 0.00 66.02 66.13 1mcr s SER 74 CO -0.06 -0.15 0.43 -0.22 0.41 0.00 0.00 173.24 173.66 1mcr s LEU 75 N -1.23 4.41 -0.23 2.44 0.20 0.15 -0.03 118.68 124.39 1mcr s LEU 75 Ca -0.08 0.93 0.01 0.00 0.69 0.00 0.00 54.13 55.69 1mcr s LEU 75 Cb -0.08 -2.84 0.05 0.00 -0.43 0.00 0.00 46.19 42.89 1mcr s LEU 75 CO 0.00 0.23 -0.08 -0.89 -0.29 0.00 0.00 176.35 175.32 1mcr s THR 76 N -1.25 1.73 -0.39 3.68 2.01 -0.40 -0.79 115.64 120.22 1mcr s THR 76 Ca 0.29 -1.27 0.01 0.00 0.31 0.00 0.00 61.69 61.03 1mcr s THR 76 Cb -0.16 -1.90 0.11 0.00 0.01 0.00 0.00 72.50 70.56 1mcr s THR 76 CO 0.16 0.00 0.14 -0.69 -0.69 0.00 0.00 174.62 173.54 1mcr s VAL 77 N 1.32 2.81 0.07 3.82 1.01 -0.20 -1.76 120.40 127.47 1mcr s VAL 77 Ca -0.05 -2.27 0.06 0.00 0.00 0.00 0.00 61.98 59.72 1mcr s VAL 77 Cb -0.18 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 1mcr s VAL 77 CO -0.07 -0.66 -0.09 -0.94 0.00 0.00 0.00 175.10 173.34 1mcr s SER 78 N 1.28 4.43 0.00 3.32 1.04 -0.88 -0.11 113.70 122.78 1mcr s SER 78 Ca 0.10 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.21 1mcr s SER 78 Cb -0.21 -0.89 0.00 0.00 0.10 0.00 0.00 66.02 65.01 1mcr s SER 78 CO -0.06 0.21 0.00 0.61 0.98 0.00 0.00 173.24 174.98 1mcr n GLY 79 N 0.98 0.97 0.00 7.32 0.00 -0.24 -4.73 105.19 109.49 1mcr n GLY 79 Ca -0.14 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1mcr n GLY 79 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1mcr n LEU 80 N 0.00 0.00 -4.77 0.99 7.94 -1.02 -4.45 117.00 115.69 1mcr n LEU 80 Ca 0.00 0.00 -0.37 0.00 -1.11 0.00 0.00 56.01 54.53 1mcr n LEU 80 Cb 0.18 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.13 1mcr n LEU 80 CO 0.00 0.00 0.84 -1.10 -1.11 0.00 0.00 177.39 176.02 1mcr s GLN 81 N 0.00 3.54 0.36 1.96 -0.21 -1.26 -1.22 119.66 122.84 1mcr s GLN 81 Ca 0.00 1.82 0.27 0.00 0.02 0.00 0.00 55.36 57.47 1mcr s GLN 81 Cb 0.00 -2.28 1.04 0.00 1.00 0.00 0.00 33.01 32.77 1mcr s GLN 81 CO 0.00 -0.74 1.80 0.00 -2.12 0.00 0.00 175.29 174.23 1mcr h ALA 82 N 1.74 1.00 -0.57 6.09 0.00 -1.93 -1.97 119.26 123.61 1mcr h ALA 82 Ca -0.50 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.50 1mcr h ALA 82 Cb 1.26 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.99 1mcr h ALA 82 CO 0.59 0.00 0.21 1.49 0.00 0.00 0.00 179.25 181.54 1mcr h GLU 83 N 0.00 0.39 -0.17 0.00 4.22 -1.93 -2.50 114.58 114.59 1mcr h GLU 83 Ca 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.42 1mcr h GLU 83 Cb 0.51 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1mcr h GLU 83 CO 0.00 0.26 0.00 -0.25 -2.18 0.00 0.00 179.01 176.84 1mcr n ASP 84 N -4.99 0.17 -4.66 1.04 8.00 -0.74 -4.38 116.55 110.99 1mcr n ASP 84 Ca 0.07 -0.89 -0.43 0.00 0.71 0.00 0.00 54.79 54.26 1mcr n ASP 84 Cb 0.24 -0.08 -0.02 0.00 -0.02 0.00 0.00 41.12 41.23 1mcr n ASP 84 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1mcr s GLU 85 N -1.62 4.24 0.14 -1.24 2.12 -0.94 -4.72 118.70 116.68 1mcr s GLU 85 Ca 0.00 1.77 -0.23 0.00 0.36 0.00 0.00 54.97 56.87 1mcr s GLU 85 Cb 0.00 -3.77 0.08 0.00 0.26 0.00 0.00 34.13 30.70 1mcr s GLU 85 CO 0.00 -0.70 1.09 0.00 -0.54 0.00 0.00 175.26 175.12 1mcr s ALA 86 N 3.40 -1.79 -0.17 6.30 0.00 -1.05 -4.87 121.76 123.57 1mcr s ALA 86 Ca 0.59 -0.26 -0.03 0.00 0.00 0.00 0.00 51.96 52.26 1mcr s ALA 86 Cb -0.25 0.79 -0.02 0.00 0.00 0.00 0.00 23.12 23.65 1mcr s ALA 86 CO 0.19 -1.08 -0.05 0.16 0.00 0.00 0.00 175.76 174.97 1mcr s ASP 87 N -3.50 4.52 -0.07 0.00 -4.77 0.12 -0.76 116.67 112.21 1mcr s ASP 87 Ca 0.24 -0.25 0.04 0.00 -3.30 0.00 0.00 52.55 49.28 1mcr s ASP 87 Cb -0.02 -1.74 -0.02 0.00 -1.09 0.00 0.00 42.92 40.05 1mcr s ASP 87 CO 0.04 0.10 -0.18 -0.31 0.70 0.00 0.00 175.17 175.52 1mcr s TYR 88 N 0.74 2.63 0.02 2.11 1.51 0.05 -0.52 117.35 123.90 1mcr s TYR 88 Ca -0.02 -0.50 0.04 0.00 -1.01 0.00 0.00 57.07 55.58 1mcr s TYR 88 Cb -0.15 -1.67 -0.03 0.00 -0.11 0.00 0.00 41.96 39.99 1mcr s TYR 88 CO 0.02 -0.07 -0.07 0.71 -1.11 0.00 0.00 175.55 175.02 1mcr s TYR 89 N -0.23 2.85 0.28 2.71 2.02 -0.81 -1.03 117.35 123.14 1mcr s TYR 89 Ca -0.00 -0.07 0.07 0.00 -0.37 0.00 0.00 57.07 56.70 1mcr s TYR 89 Cb -0.13 -1.57 -0.03 0.00 -0.40 0.00 0.00 41.96 39.82 1mcr s TYR 89 CO 0.03 0.38 0.25 0.00 -1.57 0.00 0.00 175.55 174.64 1mcr s SER 91 N -3.91 -0.57 0.00 0.00 0.15 0.55 -0.76 113.70 109.16 1mcr s SER 91 Ca 0.36 1.09 0.00 0.00 0.70 0.00 0.00 55.95 58.10 1mcr s SER 91 Cb -0.08 1.10 0.00 0.00 -1.71 0.00 0.00 66.02 65.33 1mcr s SER 91 CO 0.26 -0.19 0.00 -1.20 1.20 0.00 0.00 173.24 173.31 1mcr n SER 92 N 2.85 0.18 -3.80 5.45 7.64 0.33 -0.27 113.62 126.01 1mcr n SER 92 Ca -0.14 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.62 1mcr n SER 92 Cb 0.56 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.65 1mcr n SER 92 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1mcr s TYR 93 N 0.84 -0.22 -0.00 1.43 6.14 -1.26 -0.59 117.35 123.69 1mcr s TYR 93 Ca 0.00 0.53 0.01 0.00 0.64 0.00 0.00 57.07 58.25 1mcr s TYR 93 Cb 0.00 0.08 -0.02 0.00 0.42 0.00 0.00 41.96 42.44 1mcr s TYR 93 CO 0.00 -0.16 0.02 0.39 0.64 0.00 0.00 175.55 176.44 1mcr n GLU 94 N 2.70 0.31 0.00 4.97 1.02 -1.26 -2.51 120.64 125.87 1mcr n GLU 94 Ca -0.14 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 1mcr n GLU 94 Cb 0.58 -1.02 0.00 0.00 -0.02 0.00 0.00 31.44 30.98 1mcr n GLU 94 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1mcr n GLY 95 N 2.48 0.10 0.00 0.62 0.00 -1.26 -4.79 105.19 102.34 1mcr n GLY 95 Ca -0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1mcr n GLY 95 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mcr n SER 96 N 0.00 0.00 -1.33 1.61 7.64 -1.26 -1.61 113.62 118.67 1mcr n SER 96 Ca 0.00 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.71 1mcr n SER 96 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 1mcr n SER 96 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1mcr n ASP 97 N 0.00 -4.98 -4.85 6.43 9.92 -1.26 -5.00 116.55 116.80 1mcr n ASP 97 Ca 0.00 0.37 -0.32 0.00 -0.53 0.00 0.00 54.79 54.31 1mcr n ASP 97 Cb 0.00 -3.95 -0.05 0.00 -0.64 0.00 0.00 41.12 36.47 1mcr n ASP 97 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 1mcr s ASN 98 N -2.77 6.72 0.02 -2.24 0.02 -0.63 -5.09 114.94 110.96 1mcr s ASN 98 Ca 0.00 1.29 0.05 0.00 -1.02 0.00 0.00 52.86 53.18 1mcr s ASN 98 Cb 0.00 -2.38 -0.02 0.00 0.02 0.00 0.00 41.25 38.87 1mcr s ASN 98 CO 0.00 -0.28 -0.14 -0.36 0.02 0.00 0.00 177.10 176.34 1mcr s PHE 99 N -2.12 1.26 -0.11 2.20 0.40 -1.26 -3.98 117.98 114.37 1mcr s PHE 99 Ca 0.54 -0.30 -0.03 0.00 -0.60 0.00 0.00 56.93 56.54 1mcr s PHE 99 Cb -0.10 -0.78 0.05 0.00 0.51 0.00 0.00 43.02 42.71 1mcr s PHE 99 CO 0.21 0.01 0.15 0.54 0.70 0.00 0.00 175.22 176.83 1mcr s VAL 100 N -0.61 -0.24 0.33 -0.44 0.11 0.25 -4.96 120.40 114.84 1mcr s VAL 100 Ca 0.04 0.24 0.07 0.00 -2.93 0.00 0.00 61.98 59.39 1mcr s VAL 100 Cb -0.07 -0.37 -0.01 0.00 -1.53 0.00 0.00 36.38 34.40 1mcr s VAL 100 CO 0.00 0.05 0.42 -0.36 -3.33 0.00 0.00 175.10 171.89 1mcr s PHE 101 N 2.27 3.08 -0.24 1.54 0.40 -1.26 -0.51 117.98 123.26 1mcr s PHE 101 Ca 0.04 -0.23 0.00 0.00 -0.60 0.00 0.00 56.93 56.14 1mcr s PHE 101 Cb -0.13 -1.92 0.07 0.00 0.51 0.00 0.00 43.02 41.54 1mcr s PHE 101 CO -0.07 0.06 -0.02 0.20 0.70 0.00 0.00 175.22 176.09 1mcr s GLY 102 N -4.12 1.20 0.00 4.36 0.00 0.06 -3.65 107.32 105.18 1mcr s GLY 102 Ca 0.43 -1.34 0.00 0.00 0.00 0.00 0.00 44.72 43.82 1mcr s GLY 102 CO 0.30 1.08 0.00 2.41 0.00 0.00 0.00 173.10 176.89 1mcr n THR 103 N 4.73 0.00 0.00 0.90 -1.04 -1.24 -4.23 114.28 113.39 1mcr n THR 103 Ca -0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.91 1mcr n THR 103 Cb 0.44 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.95 1mcr n THR 103 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1mcr n GLY 104 N 0.00 3.79 2.76 3.41 0.00 -1.25 -4.93 105.19 108.97 1mcr n GLY 104 Ca 0.00 -1.63 -0.23 0.00 0.00 0.00 0.00 46.02 44.16 1mcr n GLY 104 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1mcr s THR 105 N -2.14 0.38 -0.93 2.61 -1.32 -0.20 -4.54 115.64 109.50 1mcr s THR 105 Ca 0.00 0.07 -0.22 0.00 -1.21 0.00 0.00 61.69 60.33 1mcr s THR 105 Cb 0.00 -0.57 0.08 0.00 -1.51 0.00 0.00 72.50 70.50 1mcr s THR 105 CO 0.00 0.22 1.28 -0.75 -2.21 0.00 0.00 174.62 173.16 1mcr s LYS 106 N 1.97 3.51 -0.28 7.08 2.20 -1.26 -0.77 119.74 132.20 1mcr s LYS 106 Ca 0.05 -1.22 -0.25 0.00 -0.36 0.00 0.00 55.97 54.18 1mcr s LYS 106 Cb -0.13 -4.99 0.00 0.00 -1.51 0.00 0.00 37.83 31.20 1mcr s LYS 106 CO -0.05 -2.02 0.88 0.54 -0.36 0.00 0.00 175.35 174.34 1mcr s VAL 107 N 4.20 4.75 -0.21 4.02 0.11 0.06 -1.86 120.40 131.46 1mcr s VAL 107 Ca 0.38 1.52 -0.12 0.00 -2.93 0.00 0.00 61.98 60.83 1mcr s VAL 107 Cb -0.04 -4.20 -0.05 0.00 -1.53 0.00 0.00 36.38 30.56 1mcr s VAL 107 CO -0.06 -0.22 0.24 -0.89 -3.33 0.00 0.00 175.10 170.85 1mcr s THR 108 N 3.07 5.31 -0.55 5.04 2.01 -1.25 -2.54 115.64 126.73 1mcr s THR 108 Ca 0.37 0.39 -0.08 0.00 0.31 0.00 0.00 61.69 62.68 1mcr s THR 108 Cb -0.14 -3.58 0.14 0.00 0.01 0.00 0.00 72.50 68.93 1mcr s THR 108 CO 0.10 0.34 0.41 -0.69 -0.69 0.00 0.00 174.62 174.10 1mcr s VAL 109 N 0.92 4.23 0.67 3.82 1.01 -1.26 -0.08 120.40 129.71 1mcr s VAL 109 Ca 0.12 -2.13 -0.12 0.00 0.00 0.00 0.00 61.98 59.85 1mcr s VAL 109 Cb -0.13 -3.76 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 1mcr s VAL 109 CO 0.04 -0.83 1.06 -0.76 0.00 0.00 0.00 175.10 174.62 1mcr s LEU 110 N 0.90 3.24 0.00 3.92 1.43 0.10 -4.27 118.68 124.01 1mcr s LEU 110 Ca 0.10 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.89 1mcr s LEU 110 Cb -0.23 -4.51 0.00 0.00 0.03 0.00 0.00 46.19 41.48 1mcr s LEU 110 CO -0.03 -1.39 0.00 0.61 0.23 0.00 0.00 176.35 175.77 1mcr n GLY 111 N -1.62 2.00 3.75 -3.19 0.00 -1.26 0.55 105.19 105.42 1mcr n GLY 111 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1mcr n GLY 111 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1mcr s GLN 112 N -0.78 4.85 0.76 1.61 -2.07 -1.26 -4.89 119.66 117.88 1mcr s GLN 112 Ca 0.00 1.48 -0.11 0.00 -1.82 0.00 0.00 55.36 54.91 1mcr s GLN 112 Cb 0.00 -3.28 0.05 0.00 -1.09 0.00 0.00 33.01 28.69 1mcr s GLN 112 CO 0.00 0.52 1.08 -2.14 -1.32 0.00 0.00 175.29 173.43 1mcr s PRO 113 N -1.17 2.38 0.16 9.60 0.02 -1.26 -5.02 135.00 139.71 1mcr s PRO 113 Ca 0.41 0.87 -0.30 0.00 0.02 0.00 0.00 61.00 62.00 1mcr s PRO 113 Cb -0.26 -1.93 -0.07 0.00 0.02 0.00 0.00 34.50 32.26 1mcr s PRO 113 CO 0.32 -1.47 0.97 0.15 -0.33 0.00 0.00 177.00 176.64 1mcr s LYS 114 N -5.05 4.74 0.22 5.54 3.01 -1.26 -4.78 119.74 122.16 1mcr s LYS 114 Ca 0.60 1.49 0.08 0.00 -1.01 0.00 0.00 55.97 57.13 1mcr s LYS 114 Cb -0.15 -3.33 -0.05 0.00 -1.01 0.00 0.00 37.83 33.29 1mcr s LYS 114 CO 0.55 0.30 -0.15 0.00 0.51 0.00 0.00 175.35 176.56 1mcr s ALA 115 N -0.42 2.14 0.00 5.17 0.00 0.73 -4.87 121.76 124.51 1mcr s ALA 115 Ca 0.45 -1.70 0.08 0.00 0.00 0.00 0.00 51.96 50.78 1mcr s ALA 115 Cb -0.25 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 1mcr s ALA 115 CO 0.31 0.09 -0.24 -0.80 0.00 0.00 0.00 175.76 175.12 1mcr s ASN 116 N -3.35 2.82 0.01 0.00 0.01 -1.26 -1.46 114.94 111.71 1mcr s ASN 116 Ca 0.24 -0.47 -0.30 0.00 -0.71 0.00 0.00 52.86 51.62 1mcr s ASN 116 Cb -0.01 -0.29 -0.06 0.00 0.41 0.00 0.00 41.25 41.29 1mcr s ASN 116 CO 0.08 0.27 1.52 -2.16 -1.51 0.00 0.00 177.10 175.30 1mcr s PRO 117 N -0.75 4.24 -1.24 -0.60 0.04 -1.26 -4.53 135.00 130.89 1mcr s PRO 117 Ca 0.09 2.11 -0.14 0.00 0.04 0.00 0.00 61.00 63.10 1mcr s PRO 117 Cb -0.09 -3.64 0.14 0.00 0.04 0.00 0.00 34.50 30.95 1mcr s PRO 117 CO -0.00 -0.67 1.56 2.41 0.04 0.00 0.00 177.00 180.34 1mcr n THR 118 N 4.80 4.17 -1.66 1.26 -1.04 -0.58 -4.81 114.28 116.43 1mcr n THR 118 Ca 0.15 -4.52 -0.44 0.00 -2.04 0.00 0.00 64.05 57.19 1mcr n THR 118 Cb 0.42 -2.43 -0.04 0.00 -1.82 0.00 0.00 70.33 66.46 1mcr n THR 118 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1mcr n VAL 119 N 4.96 0.70 -3.81 12.58 0.31 -1.26 -2.85 118.33 128.95 1mcr n VAL 119 Ca 0.40 -0.14 -0.30 0.00 -0.01 0.00 0.00 64.34 64.29 1mcr n VAL 119 Cb 0.43 -2.17 -0.15 0.00 -0.91 0.00 0.00 33.84 31.04 1mcr n VAL 119 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1mcr s THR 120 N 4.48 1.23 0.01 2.52 2.01 0.42 -4.98 115.64 121.33 1mcr s THR 120 Ca 0.91 -1.62 -0.24 0.00 0.31 0.00 0.00 61.69 61.04 1mcr s THR 120 Cb -0.52 -1.92 -0.05 0.00 0.01 0.00 0.00 72.50 70.02 1mcr s THR 120 CO 0.45 -0.64 0.74 -0.22 -0.69 0.00 0.00 174.62 174.26 1mcr s LEU 121 N 1.44 4.41 0.33 4.42 0.20 -1.26 -0.09 118.68 128.13 1mcr s LEU 121 Ca 0.10 1.36 0.09 0.00 0.69 0.00 0.00 54.13 56.37 1mcr s LEU 121 Cb -0.18 -3.17 -0.04 0.00 -0.43 0.00 0.00 46.19 42.37 1mcr s LEU 121 CO -0.21 -0.01 0.10 -0.36 -0.29 0.00 0.00 176.35 175.58 1mcr s PHE 122 N 0.16 2.70 0.17 5.38 0.40 -0.65 -4.96 117.98 121.17 1mcr s PHE 122 Ca 0.38 -0.35 0.11 0.00 -0.60 0.00 0.00 56.93 56.46 1mcr s PHE 122 Cb -0.20 -1.54 -0.04 0.00 0.51 0.00 0.00 43.02 41.75 1mcr s PHE 122 CO 0.21 0.41 -0.24 -1.25 0.70 0.00 0.00 175.22 175.05 1mcr s PRO 123 N -3.80 1.43 -0.07 0.24 0.04 -1.26 -4.40 135.00 127.17 1mcr s PRO 123 Ca 0.36 -1.44 -0.41 0.00 0.04 0.00 0.00 61.00 59.56 1mcr s PRO 123 Cb -0.03 -1.75 -0.20 0.00 0.04 0.00 0.00 34.50 32.56 1mcr s PRO 123 CO 0.22 0.39 1.19 -0.35 0.04 0.00 0.00 177.00 178.48 1mcr n PRO 124 N 0.49 0.14 -1.57 0.56 -0.04 -1.26 -4.95 135.00 128.37 1mcr n PRO 124 Ca -0.15 0.05 -0.34 0.00 -0.04 0.00 0.00 63.50 63.03 1mcr n PRO 124 Cb 0.55 -1.57 0.07 0.00 -0.04 0.00 0.00 33.50 32.52 1mcr n PRO 124 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1mcr s SER 125 N 0.55 4.59 0.10 3.54 1.04 -1.26 -4.90 113.70 117.36 1mcr s SER 125 Ca 0.92 2.20 -0.34 0.00 0.48 0.00 0.00 55.95 59.21 1mcr s SER 125 Cb -1.27 -2.57 -0.14 0.00 0.10 0.00 0.00 66.02 62.14 1mcr s SER 125 CO 0.60 -1.99 1.56 0.28 0.98 0.00 0.00 173.24 174.67 1mcr h SER 126 N -0.16 -1.49 0.00 7.02 0.02 -1.93 -0.39 113.55 116.62 1mcr h SER 126 Ca -0.47 0.15 -0.67 0.00 -0.84 0.00 0.00 61.79 59.96 1mcr h SER 126 Cb 1.27 0.55 0.01 0.00 0.14 0.00 0.00 62.40 64.37 1mcr h SER 126 CO 0.51 -0.56 2.75 -1.84 -1.14 0.00 0.00 176.83 176.55 1mcr n GLU 127 N -5.50 2.21 0.08 3.45 0.00 -1.26 -1.88 120.64 117.74 1mcr n GLU 127 Ca -0.09 -2.19 0.00 0.00 0.00 0.00 0.00 57.16 54.88 1mcr n GLU 127 Cb 0.42 -3.07 0.00 0.00 0.00 0.00 0.00 31.44 28.78 1mcr n GLU 127 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1mcr n GLU 128 N 6.39 0.00 0.15 3.44 2.13 -0.19 -4.82 120.64 127.73 1mcr n GLU 128 Ca 0.51 0.00 0.11 0.00 0.66 0.00 0.00 57.16 58.45 1mcr n GLU 128 Cb 0.38 0.00 0.54 0.00 0.27 0.00 0.00 31.44 32.63 1mcr n GLU 128 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1mcr n LEU 129 N -2.84 0.61 0.16 4.31 4.77 -0.98 -0.80 117.00 122.24 1mcr n LEU 129 Ca 0.00 0.72 0.04 0.00 -0.03 0.00 0.00 56.01 56.73 1mcr n LEU 129 Cb 0.00 -0.71 0.44 0.00 -2.33 0.00 0.00 43.42 40.82 1mcr n LEU 129 CO 0.00 -0.77 0.90 -0.61 -1.33 0.00 0.00 177.39 175.58 1mcr h GLN 130 N 0.00 0.14 -0.11 3.23 5.75 -1.63 -1.43 115.11 121.06 1mcr h GLN 130 Ca 0.00 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1mcr h GLN 130 Cb 0.17 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.69 1mcr h GLN 130 CO 0.00 0.29 0.00 0.00 -2.65 0.00 0.00 178.83 176.47 1mcr n ALA 131 N -2.50 2.45 -2.34 3.38 0.00 0.02 -4.96 120.51 116.56 1mcr n ALA 131 Ca -0.01 -0.76 -0.05 0.00 0.00 0.00 0.00 53.44 52.61 1mcr n ALA 131 Cb 0.25 -0.82 0.01 0.00 0.00 0.00 0.00 19.45 18.89 1mcr n ALA 131 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1mcr n ASN 132 N 1.38 -2.50 -4.48 0.00 5.15 -0.54 -5.04 115.26 109.23 1mcr n ASN 132 Ca 0.15 -0.05 -0.27 0.00 -0.60 0.00 0.00 54.58 53.81 1mcr n ASN 132 Cb 0.60 -1.56 -0.11 0.00 -0.53 0.00 0.00 39.78 38.18 1mcr n ASN 132 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1mcr s LYS 133 N -4.65 1.75 -0.39 1.20 1.02 -0.89 -4.61 119.74 113.17 1mcr s LYS 133 Ca 0.05 -1.38 0.06 0.00 0.02 0.00 0.00 55.97 54.72 1mcr s LYS 133 Cb -0.02 -2.00 0.17 0.00 -0.52 0.00 0.00 37.83 35.46 1mcr s LYS 133 CO 0.06 0.43 0.54 0.00 -0.92 0.00 0.00 175.35 175.46 1mcr s ALA 134 N -1.59 -1.69 0.29 5.17 0.00 -1.01 -2.91 121.76 120.02 1mcr s ALA 134 Ca 0.22 -0.14 -0.12 0.00 0.00 0.00 0.00 51.96 51.91 1mcr s ALA 134 Cb -0.09 -2.48 -0.08 0.00 0.00 0.00 0.00 23.12 20.47 1mcr s ALA 134 CO 0.12 -2.16 0.66 0.99 0.00 0.00 0.00 175.76 175.37 1mcr s THR 135 N 1.78 4.79 -0.14 0.00 2.01 -1.26 0.02 115.64 122.83 1mcr s THR 135 Ca 0.16 0.73 0.00 0.00 0.31 0.00 0.00 61.69 62.89 1mcr s THR 135 Cb -0.08 -3.62 0.02 0.00 0.01 0.00 0.00 72.50 68.83 1mcr s THR 135 CO -0.07 -0.16 -0.13 -0.76 -0.69 0.00 0.00 174.62 172.80 1mcr s LEU 136 N -2.98 1.59 -0.23 4.42 1.43 0.17 -4.15 118.68 118.93 1mcr s LEU 136 Ca 0.51 -0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 53.08 1mcr s LEU 136 Cb -0.11 -1.11 -0.04 0.00 0.03 0.00 0.00 46.19 44.97 1mcr s LEU 136 CO 0.20 -0.07 0.10 0.68 0.23 0.00 0.00 176.35 177.49 1mcr s VAL 137 N 1.51 4.81 -0.11 -1.59 -7.23 -1.26 -1.10 120.40 115.43 1mcr s VAL 137 Ca 0.04 -0.01 -0.20 0.00 -1.81 0.00 0.00 61.98 60.00 1mcr s VAL 137 Cb -0.13 -3.23 -0.04 0.00 0.56 0.00 0.00 36.38 33.55 1mcr s VAL 137 CO -0.10 0.37 0.55 0.00 -0.31 0.00 0.00 175.10 175.61 1mcr s LEU 139 N 0.73 4.53 -0.32 0.00 0.20 0.87 -1.43 118.68 123.26 1mcr s LEU 139 Ca 0.30 1.29 -0.01 0.00 0.69 0.00 0.00 54.13 56.39 1mcr s LEU 139 Cb -0.16 -2.92 0.11 0.00 -0.43 0.00 0.00 46.19 42.79 1mcr s LEU 139 CO 0.13 0.27 0.13 -0.63 -0.29 0.00 0.00 176.35 175.96 1mcr s ILE 140 N -1.11 0.66 0.00 6.68 1.01 -0.16 -0.44 121.20 127.84 1mcr s ILE 140 Ca 0.29 -1.40 0.00 0.00 0.00 0.00 0.00 60.65 59.54 1mcr s ILE 140 Cb -0.20 -1.50 0.00 0.00 0.01 0.00 0.00 42.46 40.77 1mcr s ILE 140 CO 0.19 -0.74 0.00 -1.54 0.00 0.00 0.00 174.94 172.86 1mcr n SER 141 N 4.73 1.53 -2.90 3.58 3.41 -1.13 -0.87 113.62 121.96 1mcr n SER 141 Ca -0.01 -0.33 -0.16 0.00 -0.26 0.00 0.00 58.87 58.11 1mcr n SER 141 Cb 0.41 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.33 1mcr n SER 141 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1mcr n ASP 142 N -0.48 -1.07 -4.96 4.04 8.00 -0.74 -1.52 116.55 119.82 1mcr n ASP 142 Ca 0.00 -0.28 -0.19 0.00 0.71 0.00 0.00 54.79 55.02 1mcr n ASP 142 Cb 0.00 -0.98 -0.01 0.00 -0.02 0.00 0.00 41.12 40.11 1mcr n ASP 142 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1mcr s PHE 143 N -2.10 3.08 -0.25 1.24 -0.71 -1.23 -4.36 117.98 113.65 1mcr s PHE 143 Ca 0.32 -0.23 -0.18 0.00 -1.04 0.00 0.00 56.93 55.80 1mcr s PHE 143 Cb -0.19 -1.94 0.07 0.00 -1.21 0.00 0.00 43.02 39.75 1mcr s PHE 143 CO 0.39 0.04 0.64 -0.47 -1.34 0.00 0.00 175.22 174.48 1mcr s TYR 144 N -2.19 -0.86 0.00 3.49 6.14 -0.53 -0.28 117.35 123.11 1mcr s TYR 144 Ca 0.44 1.88 0.00 0.00 0.64 0.00 0.00 57.07 60.03 1mcr s TYR 144 Cb -0.09 0.43 0.00 0.00 0.42 0.00 0.00 41.96 42.72 1mcr s TYR 144 CO 0.30 -0.43 0.00 -0.35 0.64 0.00 0.00 175.55 175.71 1mcr n PRO 145 N 3.61 -0.04 -1.05 4.97 -0.04 -1.26 -0.19 135.00 141.00 1mcr n PRO 145 Ca -0.18 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.08 1mcr n PRO 145 Cb 0.57 0.00 0.16 0.00 -0.04 0.00 0.00 33.50 34.19 1mcr n PRO 145 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1mcr n GLY 146 N 3.91 4.13 3.30 0.55 0.00 -1.26 -4.71 105.19 111.10 1mcr n GLY 146 Ca 0.00 -0.93 -0.44 0.00 0.00 0.00 0.00 46.02 44.65 1mcr n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mcr s ALA 147 N -2.82 4.51 0.38 4.61 0.00 -1.26 -4.80 121.76 122.36 1mcr s ALA 147 Ca 0.49 -3.72 0.08 0.00 0.00 0.00 0.00 51.96 48.81 1mcr s ALA 147 Cb 0.41 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 1mcr s ALA 147 CO 0.09 -2.21 0.17 0.54 0.00 0.00 0.00 175.76 174.36 1mcr s VAL 148 N -0.94 2.66 -0.11 0.00 0.11 -1.26 -3.97 120.40 116.88 1mcr s VAL 148 Ca 0.27 -1.68 -0.04 0.00 -2.93 0.00 0.00 61.98 57.60 1mcr s VAL 148 Cb -0.10 -2.98 0.06 0.00 -1.53 0.00 0.00 36.38 31.83 1mcr s VAL 148 CO -0.09 -0.09 0.22 -0.89 -3.33 0.00 0.00 175.10 170.93 1mcr s THR 149 N -2.51 -0.30 -0.14 5.04 2.01 -0.08 -5.00 115.64 114.66 1mcr s THR 149 Ca 0.40 0.28 0.02 0.00 0.31 0.00 0.00 61.69 62.71 1mcr s THR 149 Cb 0.00 -0.38 0.01 0.00 0.01 0.00 0.00 72.50 72.14 1mcr s THR 149 CO 0.23 0.12 -0.21 0.54 -0.69 0.00 0.00 174.62 174.60 1mcr s VAL 150 N 2.17 2.01 0.01 3.82 0.11 -1.26 0.51 120.40 127.78 1mcr s VAL 150 Ca -0.00 -0.95 0.02 0.00 -2.93 0.00 0.00 61.98 58.12 1mcr s VAL 150 Cb -0.12 -1.78 -0.01 0.00 -1.53 0.00 0.00 36.38 32.94 1mcr s VAL 150 CO -0.08 0.54 -0.08 0.00 -3.33 0.00 0.00 175.10 172.16 1mcr s ALA 151 N 0.86 0.61 -0.03 1.54 0.00 0.17 -5.02 121.76 119.89 1mcr s ALA 151 Ca -0.06 -0.47 -0.01 0.00 0.00 0.00 0.00 51.96 51.42 1mcr s ALA 151 Cb -0.15 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 1mcr s ALA 151 CO -0.03 0.10 0.04 -1.58 0.00 0.00 0.00 175.76 174.29 1mcr s TRP 152 N -0.56 3.21 0.36 0.00 0.52 -1.26 -0.69 118.94 120.51 1mcr s TRP 152 Ca -0.01 0.19 0.08 0.00 0.02 0.00 0.00 56.10 56.38 1mcr s TRP 152 Cb -0.05 -1.74 -0.05 0.00 -1.15 0.00 0.00 33.47 30.47 1mcr s TRP 152 CO 0.00 0.51 0.07 0.15 0.02 0.00 0.00 176.95 177.71 1mcr s LYS 153 N -1.41 2.17 0.00 4.98 -0.14 -0.98 -1.79 119.74 122.58 1mcr s LYS 153 Ca 0.19 -1.74 0.00 0.00 -1.36 0.00 0.00 55.97 53.06 1mcr s LYS 153 Cb -0.12 -1.98 0.00 0.00 -1.68 0.00 0.00 37.83 34.05 1mcr s LYS 153 CO 0.09 0.07 0.00 0.00 -0.76 0.00 0.00 175.35 174.75 1mcr n ALA 154 N -1.05 0.00 -3.47 5.17 0.00 -1.26 -2.48 120.51 117.42 1mcr n ALA 154 Ca -0.03 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.22 1mcr n ALA 154 Cb 0.63 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.96 1mcr n ALA 154 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1mcr s ASP 155 N -1.00 1.52 0.10 0.00 -4.77 -1.23 -0.93 116.67 110.36 1mcr s ASP 155 Ca 0.00 -0.39 0.00 0.00 -3.30 0.00 0.00 52.55 48.86 1mcr s ASP 155 Cb 0.00 0.41 0.00 0.00 -1.09 0.00 0.00 42.92 42.24 1mcr s ASP 155 CO 0.00 -0.35 0.00 0.61 0.70 0.00 0.00 175.17 176.13 1mcr n GLY 156 N 5.32 -2.38 0.00 2.12 0.00 -1.26 -4.98 105.19 104.00 1mcr n GLY 156 Ca -0.05 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1mcr n GLY 156 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mcr n SER 157 N -2.65 0.00 -2.81 1.61 7.64 -1.26 -4.62 113.62 111.53 1mcr n SER 157 Ca -0.01 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.47 1mcr n SER 157 Cb 0.12 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.24 1mcr n SER 157 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1mcr n PRO 158 N 0.16 0.00 -3.60 1.43 -0.02 -1.26 -4.44 135.00 127.27 1mcr n PRO 158 Ca 0.00 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.09 1mcr n PRO 158 Cb 0.00 -0.99 -0.07 0.00 -0.02 0.00 0.00 33.50 32.42 1mcr n PRO 158 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1mcr s VAL 159 N 3.95 4.31 0.30 -1.45 1.01 -0.74 -4.91 120.40 122.87 1mcr s VAL 159 Ca 0.79 -2.94 0.07 0.00 0.00 0.00 0.00 61.98 59.90 1mcr s VAL 159 Cb -0.99 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 31.62 1mcr s VAL 159 CO 0.44 -0.94 0.27 -0.54 0.00 0.00 0.00 175.10 174.32 1mcr s LYS 160 N -0.16 2.87 0.00 2.72 3.01 -1.26 -4.36 119.74 122.55 1mcr s LYS 160 Ca 0.18 -1.15 0.00 0.00 -1.01 0.00 0.00 55.97 53.99 1mcr s LYS 160 Cb -0.16 -2.56 0.00 0.00 -1.01 0.00 0.00 37.83 34.10 1mcr s LYS 160 CO -0.06 0.23 0.00 0.00 0.51 0.00 0.00 175.35 176.03 1mcr n ALA 161 N -1.32 -1.15 0.00 5.17 0.00 -1.26 -4.86 120.51 117.09 1mcr n ALA 161 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1mcr n ALA 161 Cb 0.59 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.85 1mcr n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mcr n GLY 162 N 1.74 2.70 3.65 0.00 0.00 -1.26 -4.87 105.19 107.16 1mcr n GLY 162 Ca 0.00 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 1mcr n GLY 162 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mcr s VAL 163 N -2.18 4.01 -0.05 1.61 -7.23 -1.23 -3.60 120.40 111.73 1mcr s VAL 163 Ca 0.00 1.18 -0.02 0.00 -1.81 0.00 0.00 61.98 61.34 1mcr s VAL 163 Cb 0.00 -3.89 0.03 0.00 0.56 0.00 0.00 36.38 33.08 1mcr s VAL 163 CO 0.00 -0.24 0.04 -1.61 -0.31 0.00 0.00 175.10 172.98 1mcr s GLU 164 N 4.01 0.15 0.53 4.82 2.02 -0.71 -5.01 118.70 124.50 1mcr s GLU 164 Ca 0.62 0.28 0.06 0.00 0.02 0.00 0.00 54.97 55.94 1mcr s GLU 164 Cb -0.23 -0.64 0.03 0.00 0.10 0.00 0.00 34.13 33.40 1mcr s GLU 164 CO 0.22 -0.31 0.42 0.99 0.02 0.00 0.00 175.26 176.60 1mcr s THR 165 N 2.02 1.78 0.12 3.63 2.01 -1.26 -2.19 115.64 121.75 1mcr s THR 165 Ca 0.04 -1.46 0.04 0.00 0.31 0.00 0.00 61.69 60.62 1mcr s THR 165 Cb -0.12 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.11 1mcr s THR 165 CO -0.04 0.00 -0.10 -0.89 -0.69 0.00 0.00 174.62 172.91 1mcr s THR 166 N -2.74 1.01 -0.23 -0.82 2.01 -0.79 -4.97 115.64 109.11 1mcr s THR 166 Ca 0.37 -1.88 -0.04 0.00 0.31 0.00 0.00 61.69 60.45 1mcr s THR 166 Cb -0.02 -1.64 -0.00 0.00 0.01 0.00 0.00 72.50 70.85 1mcr s THR 166 CO 0.23 -0.69 -0.04 -0.54 -0.69 0.00 0.00 174.62 172.88 1mcr s LYS 167 N -3.39 3.27 -0.36 4.92 1.02 -1.26 -4.54 119.74 119.40 1mcr s LYS 167 Ca 0.12 -0.69 -0.39 0.00 0.02 0.00 0.00 55.97 55.02 1mcr s LYS 167 Cb 0.01 -3.02 -0.14 0.00 -0.52 0.00 0.00 37.83 34.16 1mcr s LYS 167 CO -0.01 -0.24 2.02 -2.30 -0.92 0.00 0.00 175.35 173.91 1mcr n PRO 168 N 4.78 0.85 -2.67 -1.68 -0.02 -1.26 -4.96 135.00 130.04 1mcr n PRO 168 Ca -0.18 0.27 -0.33 0.00 -2.02 0.00 0.00 63.50 61.24 1mcr n PRO 168 Cb 0.50 -2.13 -0.06 0.00 -0.02 0.00 0.00 33.50 31.80 1mcr n PRO 168 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1mcr s SER 169 N 5.74 6.80 0.29 2.55 0.15 -0.15 -4.71 113.70 124.37 1mcr s SER 169 Ca 1.08 1.67 -0.29 0.00 0.70 0.00 0.00 55.95 59.11 1mcr s SER 169 Cb -1.07 -2.53 -0.10 0.00 -1.71 0.00 0.00 66.02 60.61 1mcr s SER 169 CO 0.59 -0.46 1.27 -0.54 1.20 0.00 0.00 173.24 175.30 1mcr s LYS 170 N -3.46 4.42 0.00 5.44 1.02 -1.26 -0.33 119.74 125.57 1mcr s LYS 170 Ca 0.61 2.10 0.00 0.00 0.02 0.00 0.00 55.97 58.70 1mcr s LYS 170 Cb -0.10 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 34.09 1mcr s LYS 170 CO 0.19 -0.13 0.00 1.04 -0.92 0.00 0.00 175.35 175.53 1mcr n GLN 171 N 1.37 3.73 -1.13 1.68 6.02 1.00 -4.85 117.38 125.19 1mcr n GLN 171 Ca 0.01 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.86 1mcr n GLN 171 Cb 0.43 0.00 0.15 0.00 1.02 0.00 0.00 30.24 31.84 1mcr n GLN 171 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1mcr n SER 172 N 0.00 3.75 0.03 1.08 3.41 -1.26 -4.54 113.62 116.09 1mcr n SER 172 Ca 0.00 -3.77 0.00 0.00 -0.26 0.00 0.00 58.87 54.84 1mcr n SER 172 Cb 0.00 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.28 1mcr n SER 172 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1mcr n ASN 173 N -1.04 0.21 0.00 4.04 0.23 -1.26 -5.04 115.26 112.40 1mcr n ASN 173 Ca 0.43 0.09 0.00 0.00 -0.53 0.00 0.00 54.58 54.57 1mcr n ASN 173 Cb 1.07 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.75 1mcr n ASN 173 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1mcr n ASN 174 N -2.84 0.00 -3.74 0.53 5.15 -1.26 -4.55 115.26 108.56 1mcr n ASN 174 Ca 0.00 0.00 -0.10 0.00 -0.60 0.00 0.00 54.58 53.88 1mcr n ASN 174 Cb 0.00 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.19 1mcr n ASN 174 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1mcr s LYS 175 N 0.00 0.92 0.40 1.20 1.02 -1.26 -4.99 119.74 117.04 1mcr s LYS 175 Ca 0.00 -0.72 0.04 0.00 0.02 0.00 0.00 55.97 55.31 1mcr s LYS 175 Cb 0.00 0.40 -0.00 0.00 -0.52 0.00 0.00 37.83 37.71 1mcr s LYS 175 CO 0.00 -0.32 0.58 0.71 -0.92 0.00 0.00 175.35 175.39 1mcr s TYR 176 N -3.45 3.08 -0.19 3.18 2.02 0.62 -0.00 117.35 122.60 1mcr s TYR 176 Ca 0.01 -0.09 -0.05 0.00 -0.37 0.00 0.00 57.07 56.58 1mcr s TYR 176 Cb 0.02 -2.22 0.09 0.00 -0.40 0.00 0.00 41.96 39.45 1mcr s TYR 176 CO -0.09 -0.26 0.33 0.00 -1.57 0.00 0.00 175.55 173.96 1mcr s ALA 177 N -2.37 -0.82 0.07 3.71 0.00 0.55 -1.79 121.76 121.11 1mcr s ALA 177 Ca 0.49 0.99 0.06 0.00 0.00 0.00 0.00 51.96 53.50 1mcr s ALA 177 Cb -0.10 -1.31 -0.03 0.00 0.00 0.00 0.00 23.12 21.68 1mcr s ALA 177 CO 0.34 -0.91 -0.17 0.00 0.00 0.00 0.00 175.76 175.03 1mcr s ALA 178 N 2.49 1.40 0.31 0.00 0.00 -0.05 -0.97 121.76 124.93 1mcr s ALA 178 Ca 0.04 -1.04 0.11 0.00 0.00 0.00 0.00 51.96 51.07 1mcr s ALA 178 Cb -0.13 -0.17 -0.06 0.00 0.00 0.00 0.00 23.12 22.76 1mcr s ALA 178 CO -0.12 0.25 -0.13 -1.54 0.00 0.00 0.00 175.76 174.22 1mcr s SER 179 N -1.62 3.73 0.02 0.00 1.04 -1.26 -0.99 113.70 114.63 1mcr s SER 179 Ca 0.02 -1.07 -0.00 0.00 0.48 0.00 0.00 55.95 55.37 1mcr s SER 179 Cb -0.09 -0.36 -0.02 0.00 0.10 0.00 0.00 66.02 65.64 1mcr s SER 179 CO 0.03 -0.08 -0.03 -0.44 0.98 0.00 0.00 173.24 173.70 1mcr s SER 180 N -3.57 0.28 -0.15 7.02 0.01 -0.51 -1.88 113.70 114.89 1mcr s SER 180 Ca 0.31 -0.55 -0.09 0.00 1.31 0.00 0.00 55.95 56.94 1mcr s SER 180 Cb -0.02 0.11 0.05 0.00 0.21 0.00 0.00 66.02 66.37 1mcr s SER 180 CO 0.16 -0.33 0.36 -0.72 0.41 0.00 0.00 173.24 173.12 1mcr s TYR 181 N -1.71 -0.51 -0.09 2.43 1.13 -0.93 -1.41 117.35 116.26 1mcr s TYR 181 Ca -0.14 1.12 -0.01 0.00 -1.41 0.00 0.00 57.07 56.64 1mcr s TYR 181 Cb -0.08 0.20 -0.03 0.00 -1.10 0.00 0.00 41.96 40.94 1mcr s TYR 181 CO -0.02 -0.30 -0.05 -1.17 -2.51 0.00 0.00 175.55 171.50 1mcr s LEU 182 N 1.23 3.25 -0.38 -3.49 0.20 -0.26 -1.74 118.68 117.49 1mcr s LEU 182 Ca -0.08 -0.02 0.01 0.00 0.69 0.00 0.00 54.13 54.73 1mcr s LEU 182 Cb -0.08 -1.73 0.11 0.00 -0.43 0.00 0.00 46.19 44.06 1mcr s LEU 182 CO -0.10 0.32 0.12 -0.44 -0.29 0.00 0.00 176.35 175.97 1mcr s SER 183 N -0.58 4.93 0.70 3.68 0.01 -1.24 0.46 113.70 121.67 1mcr s SER 183 Ca 0.09 -2.17 -0.07 0.00 1.31 0.00 0.00 55.95 55.10 1mcr s SER 183 Cb -0.12 -1.71 0.06 0.00 0.21 0.00 0.00 66.02 64.46 1mcr s SER 183 CO 0.02 -0.43 1.02 -0.76 0.41 0.00 0.00 173.24 173.50 1mcr s LEU 184 N 0.90 2.83 -0.11 2.44 1.43 0.10 -4.92 118.68 121.36 1mcr s LEU 184 Ca 0.10 0.53 0.04 0.00 -1.03 0.00 0.00 54.13 53.78 1mcr s LEU 184 Cb -0.21 -3.19 0.00 0.00 0.03 0.00 0.00 46.19 42.83 1mcr s LEU 184 CO -0.06 -1.57 -0.23 0.42 0.23 0.00 0.00 176.35 175.14 1mcr s THR 185 N -3.26 2.02 0.27 5.49 -4.23 -1.26 -2.40 115.64 112.27 1mcr s THR 185 Ca 0.60 -0.99 -0.04 0.00 -1.18 0.00 0.00 61.69 60.07 1mcr s THR 185 Cb -0.11 -1.76 0.34 0.00 1.34 0.00 0.00 72.50 72.32 1mcr s THR 185 CO 0.45 0.55 1.61 1.55 -0.54 0.00 0.00 174.62 178.24 1mcr h PRO 186 N 6.83 0.06 -1.79 3.99 0.13 -1.87 0.59 132.00 139.93 1mcr h PRO 186 Ca -0.22 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1mcr h PRO 186 Cb 1.23 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1mcr h PRO 186 CO 0.48 0.04 0.00 -0.85 -0.23 0.00 0.00 178.00 177.44 1mcr n GLU 187 N -5.42 0.70 0.00 0.86 -0.00 -1.26 0.13 120.64 115.65 1mcr n GLU 187 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.33 1mcr n GLU 187 Cb 0.57 -1.15 0.00 0.00 -0.00 0.00 0.00 31.44 30.86 1mcr n GLU 187 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 1mcr n GLN 188 N 1.36 0.00 -0.00 3.44 7.27 0.20 -4.87 117.38 124.77 1mcr n GLN 188 Ca 0.00 0.00 0.06 0.00 0.07 0.00 0.00 57.00 57.13 1mcr n GLN 188 Cb 0.35 0.00 -0.08 0.00 2.41 0.00 0.00 30.24 32.92 1mcr n GLN 188 CO 0.00 0.00 0.00 1.87 0.07 0.00 0.00 177.06 179.00 1mcr n TRP 189 N 0.00 0.00 -0.26 3.69 -0.00 0.36 -4.34 117.44 116.89 1mcr n TRP 189 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.50 57.56 1mcr n TRP 189 Cb 0.26 -0.08 0.18 0.00 -0.00 0.00 0.00 31.31 31.67 1mcr n TRP 189 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1mcr n LYS 190 N -1.49 2.88 -2.72 5.87 4.76 -0.68 -4.53 118.16 122.26 1mcr n LYS 190 Ca 0.01 -2.18 -0.25 0.00 -2.87 0.00 0.00 58.31 53.02 1mcr n LYS 190 Cb 0.24 -1.35 -0.02 0.00 -1.84 0.00 0.00 35.03 32.07 1mcr n LYS 190 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1mcr n SER 191 N 0.58 4.20 -3.62 4.39 3.41 -1.26 -4.95 113.62 116.37 1mcr n SER 191 Ca 0.14 -3.60 -0.04 0.00 -0.26 0.00 0.00 58.87 55.11 1mcr n SER 191 Cb 0.49 -0.51 -0.03 0.00 -0.26 0.00 0.00 64.21 63.89 1mcr n SER 191 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1mcr s HIS 192 N -3.43 -0.10 -0.13 7.33 3.76 -1.26 -4.95 115.29 116.50 1mcr s HIS 192 Ca 0.47 0.11 0.07 0.00 -0.15 0.00 0.00 55.06 55.56 1mcr s HIS 192 Cb 0.35 0.50 -0.13 0.00 1.11 0.00 0.00 32.58 34.41 1mcr s HIS 192 CO -0.15 -0.14 -0.03 -2.13 -0.85 0.00 0.00 174.74 171.44 1mcr n ARG 193 N 0.18 1.34 -3.88 1.40 0.63 -1.26 -4.90 116.66 110.17 1mcr n ARG 193 Ca 0.00 0.03 -0.13 0.00 -0.92 0.00 0.00 57.85 56.84 1mcr n ARG 193 Cb 0.58 -1.31 -0.01 0.00 0.45 0.00 0.00 32.46 32.17 1mcr n ARG 193 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1mcr n SER 194 N -2.66 -1.69 -3.86 6.15 3.41 -1.26 -4.23 113.62 109.48 1mcr n SER 194 Ca -0.23 -2.77 -0.11 0.00 -0.26 0.00 0.00 58.87 55.49 1mcr n SER 194 Cb 0.85 2.99 -0.11 0.00 -0.26 0.00 0.00 64.21 67.68 1mcr n SER 194 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1mcr s TYR 195 N -2.70 -0.01 0.17 7.33 2.02 0.16 -3.55 117.35 120.77 1mcr s TYR 195 Ca 0.24 0.01 0.07 0.00 -0.37 0.00 0.00 57.07 57.03 1mcr s TYR 195 Cb -0.02 -0.02 -0.04 0.00 -0.40 0.00 0.00 41.96 41.47 1mcr s TYR 195 CO 0.17 -0.22 -0.15 -1.54 -1.57 0.00 0.00 175.55 172.24 1mcr s SER 196 N -0.96 2.41 -0.22 2.29 1.04 -0.11 -0.92 113.70 117.22 1mcr s SER 196 Ca -0.10 -0.94 -0.01 0.00 0.48 0.00 0.00 55.95 55.38 1mcr s SER 196 Cb -0.06 -0.12 0.06 0.00 0.10 0.00 0.00 66.02 66.01 1mcr s SER 196 CO 0.01 -0.15 0.01 0.00 0.98 0.00 0.00 173.24 174.09 1mcr s GLN 198 N 1.66 3.71 -0.24 0.00 0.74 0.13 -0.76 119.66 124.91 1mcr s GLN 198 Ca -0.02 -0.45 -0.05 0.00 0.05 0.00 0.00 55.36 54.90 1mcr s GLN 198 Cb -0.18 -3.35 -0.01 0.00 1.10 0.00 0.00 33.01 30.57 1mcr s GLN 198 CO -0.09 -0.15 -0.01 0.08 -0.55 0.00 0.00 175.29 174.58 1mcr s VAL 199 N 1.52 3.60 -0.09 1.34 1.01 0.79 -0.65 120.40 127.92 1mcr s VAL 199 Ca 0.06 -0.48 -0.06 0.00 0.00 0.00 0.00 61.98 61.50 1mcr s VAL 199 Cb -0.15 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1mcr s VAL 199 CO 0.04 0.36 0.15 -0.89 0.00 0.00 0.00 175.10 174.76 1mcr s THR 200 N 1.50 5.46 -0.25 3.92 2.01 0.18 0.00 115.64 128.46 1mcr s THR 200 Ca 0.05 0.09 -0.12 0.00 0.31 0.00 0.00 61.69 62.02 1mcr s THR 200 Cb -0.15 -3.43 0.09 0.00 0.01 0.00 0.00 72.50 69.02 1mcr s THR 200 CO -0.01 0.53 0.60 -2.28 -0.69 0.00 0.00 174.62 172.77 1mcr s HIS 201 N -1.11 -1.01 -0.42 4.92 2.46 -0.11 -0.90 115.29 119.11 1mcr s HIS 201 Ca 0.19 1.96 -0.05 0.00 0.47 0.00 0.00 55.06 57.62 1mcr s HIS 201 Cb -0.12 0.57 0.05 0.00 -0.13 0.00 0.00 32.58 32.95 1mcr s HIS 201 CO 0.08 -0.52 0.13 0.39 -2.47 0.00 0.00 174.74 172.36 1mcr n GLU 202 N 4.67 -1.21 0.00 2.88 -0.58 -1.25 -0.51 120.64 124.63 1mcr n GLU 202 Ca -0.18 0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1mcr n GLU 202 Cb 0.55 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.75 1mcr n GLU 202 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1mcr n GLY 203 N -0.50 2.88 3.59 0.62 0.00 -1.26 -5.01 105.19 105.51 1mcr n GLY 203 Ca 0.03 -0.73 -0.49 0.00 0.00 0.00 0.00 46.02 44.83 1mcr n GLY 203 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mcr n SER 204 N 2.03 2.93 -4.81 1.61 7.64 0.33 -4.96 113.62 118.38 1mcr n SER 204 Ca 0.00 0.65 -0.23 0.00 1.01 0.00 0.00 58.87 60.30 1mcr n SER 204 Cb 0.00 -1.36 -0.05 0.00 -1.01 0.00 0.00 64.21 61.80 1mcr n SER 204 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1mcr s THR 205 N 5.90 4.44 0.02 0.44 -4.23 -1.26 -0.93 115.64 120.01 1mcr s THR 205 Ca 1.00 -1.33 0.03 0.00 -1.18 0.00 0.00 61.69 60.21 1mcr s THR 205 Cb -0.70 -3.36 -0.01 0.00 1.34 0.00 0.00 72.50 69.76 1mcr s THR 205 CO 0.49 -0.29 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.50 1mcr s VAL 206 N -2.03 0.73 -0.05 2.29 1.01 0.10 -4.99 120.40 117.46 1mcr s VAL 206 Ca 0.32 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.63 1mcr s VAL 206 Cb -0.08 -0.66 0.03 0.00 0.00 0.00 0.00 36.38 35.67 1mcr s VAL 206 CO 0.24 0.02 0.08 -0.70 0.00 0.00 0.00 175.10 174.74 1mcr s GLU 207 N -0.71 -0.03 0.26 2.72 2.12 -1.26 -0.15 118.70 121.65 1mcr s GLU 207 Ca 0.00 0.36 0.10 0.00 0.36 0.00 0.00 54.97 55.79 1mcr s GLU 207 Cb -0.06 -0.37 -0.05 0.00 0.26 0.00 0.00 34.13 33.92 1mcr s GLU 207 CO 0.00 -0.27 -0.17 0.21 -0.54 0.00 0.00 175.26 174.49 1mcr s LYS 208 N 1.80 1.56 -0.02 4.30 2.20 0.06 -4.96 119.74 124.68 1mcr s LYS 208 Ca -0.00 -1.72 0.03 0.00 -0.36 0.00 0.00 55.97 53.92 1mcr s LYS 208 Cb -0.12 -1.52 -0.00 0.00 -1.51 0.00 0.00 37.83 34.68 1mcr s LYS 208 CO -0.04 0.26 -0.10 0.99 -0.36 0.00 0.00 175.35 176.10 1mcr s THR 209 N -2.69 0.84 -0.10 3.43 2.01 -1.26 -0.49 115.64 117.38 1mcr s THR 209 Ca 0.27 -0.42 0.03 0.00 0.31 0.00 0.00 61.69 61.88 1mcr s THR 209 Cb -0.03 -0.73 -0.01 0.00 0.01 0.00 0.00 72.50 71.74 1mcr s THR 209 CO 0.12 0.25 -0.19 0.68 -0.69 0.00 0.00 174.62 174.79 1mcr s VAL 210 N -0.03 2.54 0.05 3.82 -7.23 -0.10 -4.97 120.40 114.47 1mcr s VAL 210 Ca 0.00 -0.86 0.02 0.00 -1.81 0.00 0.00 61.98 59.33 1mcr s VAL 210 Cb -0.07 -2.00 -0.04 0.00 0.56 0.00 0.00 36.38 34.83 1mcr s VAL 210 CO 0.00 0.55 0.06 0.00 -0.31 0.00 0.00 175.10 175.40 1mcr s ALA 211 N 0.11 3.50 0.65 1.32 0.00 -1.26 0.40 121.76 126.47 1mcr s ALA 211 Ca -0.09 -0.98 0.21 0.00 0.00 0.00 0.00 51.96 51.10 1mcr s ALA 211 Cb -0.15 -1.43 1.07 0.00 0.00 0.00 0.00 23.12 22.60 1mcr s ALA 211 CO 0.06 0.71 1.59 -1.35 0.00 0.00 0.00 175.76 176.77 1mcr h PRO 212 N 3.69 0.00 -4.96 0.00 0.11 -1.89 -3.38 132.00 125.57 1mcr h PRO 212 Ca -0.48 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.14 1mcr h PRO 212 Cb 1.17 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.30 1mcr h PRO 212 CO 0.63 0.00 1.63 2.41 -0.21 0.00 0.00 178.00 182.46 1mcr n THR 213 N -2.95 1.67 -4.21 -1.15 -1.04 -1.26 -4.90 114.28 100.44 1mcr n THR 213 Ca 0.03 -1.60 -0.20 0.00 -2.04 0.00 0.00 64.05 60.25 1mcr n THR 213 Cb 0.73 -2.22 -0.12 0.00 -1.82 0.00 0.00 70.33 66.89 1mcr n THR 213 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1mcr s GLU 214 N 5.89 0.90 0.08 -2.82 -6.30 -1.26 -5.02 118.70 110.17 1mcr s GLU 214 Ca 0.64 -1.00 -0.24 0.00 -2.50 0.00 0.00 54.97 51.87 1mcr s GLU 214 Cb 0.07 -0.97 -0.09 0.00 0.00 0.00 0.00 34.13 33.14 1mcr s GLU 214 CO 0.15 0.22 1.39 0.00 0.02 0.00 0.00 175.26 177.03