#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mir n ASP 11 N 0.00 0.10 -0.28 4.04 8.00 -1.26 -1.64 116.55 125.51 1mir n ASP 11 Ca 0.00 1.18 0.10 0.00 0.71 0.00 0.00 54.79 56.79 1mir n ASP 11 Cb 0.00 -0.58 0.25 0.00 -0.02 0.00 0.00 41.12 40.77 1mir n ASP 11 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1mir h ASP 12 N 0.00 -0.05 0.00 -2.24 3.32 -2.06 -0.79 116.42 114.61 1mir h ASP 12 Ca 0.91 0.19 -0.00 0.00 0.02 0.00 0.00 57.03 58.15 1mir h ASP 12 Cb 3.33 0.27 0.00 0.00 0.22 0.00 0.00 39.33 43.14 1mir h ASP 12 CO -0.23 -0.14 -0.00 -0.03 -1.72 0.00 0.00 179.24 177.12 1mir h MET 13 N 0.21 -0.00 -0.89 3.56 4.05 -1.75 -1.71 114.93 118.40 1mir h MET 13 Ca 0.51 0.00 0.23 0.00 -0.28 0.00 0.00 59.70 60.16 1mir h MET 13 Cb 0.98 0.00 -0.13 0.00 -0.80 0.00 0.00 31.60 31.65 1mir h MET 13 CO -0.63 0.28 0.33 0.82 0.23 0.00 0.00 176.91 177.93 1mir h ILE 14 N -0.28 0.39 -0.12 1.77 2.04 -1.32 0.77 117.51 120.75 1mir h ILE 14 Ca -0.00 -0.10 -0.07 0.00 1.00 0.00 0.00 64.86 65.69 1mir h ILE 14 Cb 0.28 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.43 1mir h ILE 14 CO 0.00 0.05 -0.19 0.78 0.00 0.00 0.00 178.15 178.80 1mir h ASN 15 N 0.30 0.37 -0.78 1.72 2.35 -1.17 -2.36 115.58 116.02 1mir h ASN 15 Ca 0.57 -0.53 0.11 0.00 -0.55 0.00 0.00 56.30 55.89 1mir h ASN 15 Cb 1.13 -0.11 -0.08 0.00 0.05 0.00 0.00 38.32 39.31 1mir h ASN 15 CO -0.59 0.83 0.40 0.22 -1.65 0.00 0.00 177.43 176.64 1mir h TYR 16 N -0.07 0.72 0.31 1.19 3.20 -0.19 0.24 116.97 122.36 1mir h TYR 16 Ca 0.01 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 1mir h TYR 16 Cb 0.75 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.82 1mir h TYR 16 CO 0.10 0.24 -0.15 0.82 -1.64 0.00 0.00 178.16 177.53 1mir h ILE 17 N 0.65 0.70 -0.90 1.81 2.04 -0.88 -1.90 117.51 119.03 1mir h ILE 17 Ca 0.39 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 66.23 1mir h ILE 17 Cb 0.45 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 37.21 1mir h ILE 17 CO -0.29 0.01 0.60 0.78 0.00 0.00 0.00 178.15 179.24 1mir h ASN 18 N -0.43 1.03 0.40 1.72 2.35 -0.78 -1.36 115.58 118.51 1mir h ASN 18 Ca -0.04 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 1mir h ASN 18 Cb 0.33 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.44 1mir h ASN 18 CO 0.07 0.74 -0.05 0.11 -1.65 0.00 0.00 177.43 176.65 1mir h LYS 19 N 1.22 0.00 0.00 0.81 1.57 -0.32 -2.06 116.57 117.78 1mir h LYS 19 Ca 0.34 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 59.05 1mir h LYS 19 Cb -0.12 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1mir h LYS 19 CO -0.08 0.05 -0.33 1.96 -0.57 0.00 0.00 179.45 180.49 1mir h GLN 20 N 0.00 0.00 -4.67 3.15 1.08 -0.42 -3.47 115.11 110.78 1mir h GLN 20 Ca -0.00 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 57.01 1mir h GLN 20 Cb 0.27 0.00 0.13 0.00 -0.05 0.00 0.00 27.48 27.83 1mir h GLN 20 CO 0.01 0.33 -0.58 -1.71 -0.95 0.00 0.00 178.83 175.92 1mir n ASN 21 N -3.71 -4.32 -4.97 1.46 5.15 -0.78 -5.03 115.26 103.06 1mir n ASN 21 Ca -0.01 -0.48 -0.21 0.00 -0.60 0.00 0.00 54.58 53.29 1mir n ASN 21 Cb 0.43 -3.78 -0.00 0.00 -0.53 0.00 0.00 39.78 35.90 1mir n ASN 21 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1mir s THR 22 N -3.27 4.29 0.13 -0.44 2.01 -1.26 -4.98 115.64 112.13 1mir s THR 22 Ca 0.23 -0.83 0.10 0.00 0.31 0.00 0.00 61.69 61.49 1mir s THR 22 Cb -0.03 -3.52 0.10 0.00 0.01 0.00 0.00 72.50 69.06 1mir s THR 22 CO 0.52 -0.25 1.17 0.71 -0.69 0.00 0.00 174.62 176.07 1mir h THR 23 N 0.79 0.00 -2.66 -0.82 1.35 -1.93 -3.42 112.91 106.22 1mir h THR 23 Ca -0.47 0.00 -0.49 0.00 -0.55 0.00 0.00 66.41 64.90 1mir h THR 23 Cb 1.25 0.22 -0.14 0.00 -1.73 0.00 0.00 68.15 67.75 1mir h THR 23 CO 0.56 0.00 -0.65 -1.66 -0.25 0.00 0.00 175.52 173.51 1mir s TRP 24 N -3.27 1.97 -0.09 4.73 1.48 -1.23 -0.37 118.94 122.17 1mir s TRP 24 Ca -0.01 -0.77 0.04 0.00 -1.06 0.00 0.00 56.10 54.30 1mir s TRP 24 Cb 0.03 -1.19 -0.01 0.00 -1.16 0.00 0.00 33.47 31.14 1mir s TRP 24 CO 0.09 0.21 -0.23 -1.14 -4.06 0.00 0.00 176.95 171.82 1mir s GLN 25 N -3.78 2.89 0.15 3.25 0.74 0.32 -4.90 119.66 118.34 1mir s GLN 25 Ca 0.32 -0.86 0.04 0.00 0.05 0.00 0.00 55.36 54.90 1mir s GLN 25 Cb 0.06 -2.29 -0.04 0.00 1.10 0.00 0.00 33.01 31.84 1mir s GLN 25 CO 0.13 0.27 0.21 0.00 -0.55 0.00 0.00 175.29 175.35 1mir s ALA 26 N 0.12 3.78 0.20 1.58 0.00 -1.26 -1.09 121.76 125.08 1mir s ALA 26 Ca -0.11 -1.10 -0.07 0.00 0.00 0.00 0.00 51.96 50.68 1mir s ALA 26 Cb -0.16 -1.59 0.03 0.00 0.00 0.00 0.00 23.12 21.40 1mir s ALA 26 CO 0.06 0.54 0.38 0.41 0.00 0.00 0.00 175.76 177.16 1mir n GLY 27 N -0.39 1.59 3.66 0.00 0.00 0.48 -4.85 105.19 105.68 1mir n GLY 27 Ca -0.08 -1.17 -0.37 0.00 0.00 0.00 0.00 46.02 44.41 1mir n GLY 27 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1mir s ARG 28 N -2.08 4.10 -0.12 1.61 3.52 -1.26 -4.43 118.95 120.29 1mir s ARG 28 Ca 0.09 -0.13 0.16 0.00 -0.13 0.00 0.00 55.73 55.72 1mir s ARG 28 Cb -0.02 -3.54 -0.23 0.00 -1.56 0.00 0.00 34.95 29.60 1mir s ARG 28 CO 0.06 0.02 0.16 0.09 -0.81 0.00 0.00 175.30 174.83 1mir n ASN 29 N 4.38 0.95 -4.40 -2.12 3.02 -1.26 -5.00 115.26 110.82 1mir n ASN 29 Ca -0.13 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.11 1mir n ASN 29 Cb 0.52 1.20 -0.14 0.00 -0.61 0.00 0.00 39.78 40.74 1mir n ASN 29 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1mir s PHE 30 N -2.67 2.50 0.02 3.10 0.40 -1.26 -4.23 117.98 115.84 1mir s PHE 30 Ca -0.08 -0.31 0.03 0.00 -0.60 0.00 0.00 56.93 55.98 1mir s PHE 30 Cb 0.07 -1.52 -0.02 0.00 0.51 0.00 0.00 43.02 42.06 1mir s PHE 30 CO 0.69 0.12 -0.09 0.71 0.70 0.00 0.00 175.22 177.35 1mir s TYR 31 N -0.74 0.77 -1.13 0.36 2.02 -0.36 -4.91 117.35 113.35 1mir s TYR 31 Ca 0.12 -0.30 -0.23 0.00 -0.37 0.00 0.00 57.07 56.29 1mir s TYR 31 Cb -0.10 -0.47 0.01 0.00 -0.40 0.00 0.00 41.96 40.99 1mir s TYR 31 CO 0.01 -0.02 0.76 0.09 -1.57 0.00 0.00 175.55 174.82 1mir n ASN 32 N 2.18 -5.10 -4.05 2.29 3.02 -1.26 -4.74 115.26 107.60 1mir n ASN 32 Ca -0.17 -1.06 -0.22 0.00 -0.03 0.00 0.00 54.58 53.10 1mir n ASN 32 Cb 0.56 -2.91 -0.15 0.00 -0.61 0.00 0.00 39.78 36.67 1mir n ASN 32 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1mir s VAL 33 N -3.44 0.99 0.32 2.41 -7.23 -1.26 -1.22 120.40 110.97 1mir s VAL 33 Ca 0.44 -0.49 -0.20 0.00 -1.81 0.00 0.00 61.98 59.92 1mir s VAL 33 Cb -0.18 -0.85 -0.09 0.00 0.56 0.00 0.00 36.38 35.81 1mir s VAL 33 CO 0.89 0.29 0.83 -0.62 -0.31 0.00 0.00 175.10 176.18 1mir s ASP 34 N 0.02 7.01 0.25 4.85 2.15 0.43 -4.91 116.67 126.47 1mir s ASP 34 Ca -0.01 1.54 -0.05 0.00 0.43 0.00 0.00 52.55 54.46 1mir s ASP 34 Cb -0.08 -2.47 0.49 0.00 -0.30 0.00 0.00 42.92 40.55 1mir s ASP 34 CO 0.01 -0.16 1.65 0.40 -0.17 0.00 0.00 175.17 176.90 1mir h ILE 35 N 2.28 0.37 -1.22 4.11 1.08 -2.00 0.14 117.51 122.27 1mir h ILE 35 Ca -0.48 -0.05 0.36 0.00 -0.39 0.00 0.00 64.86 64.30 1mir h ILE 35 Cb 1.18 0.21 -0.10 0.00 -3.07 0.00 0.00 36.82 35.04 1mir h ILE 35 CO 0.64 0.03 0.81 0.77 -0.69 0.00 0.00 178.15 179.71 1mir h SER 36 N 0.15 0.26 0.35 1.72 4.64 -1.92 0.25 113.55 119.00 1mir h SER 36 Ca 0.44 0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.82 1mir h SER 36 Cb 0.79 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1mir h SER 36 CO -0.63 -0.03 -0.17 0.22 -0.87 0.00 0.00 176.83 175.34 1mir h TYR 37 N 0.19 -0.44 -0.94 4.77 3.20 -0.96 -0.13 116.97 122.66 1mir h TYR 37 Ca 0.69 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.67 1mir h TYR 37 Cb 2.17 0.14 -0.07 0.00 1.54 0.00 0.00 36.73 40.51 1mir h TYR 37 CO -0.00 -0.13 0.60 -0.07 -1.64 0.00 0.00 178.16 176.92 1mir h LEU 38 N -0.74 0.82 0.33 2.82 3.38 -0.57 0.12 115.31 121.48 1mir h LEU 38 Ca -0.05 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1mir h LEU 38 Cb 0.50 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1mir h LEU 38 CO 0.08 0.45 -0.16 0.11 0.09 0.00 0.00 178.44 179.01 1mir h LYS 39 N 0.88 -0.43 -0.08 1.13 1.79 -1.02 -2.70 116.57 116.16 1mir h LYS 39 Ca 0.46 0.03 0.02 0.00 -2.18 0.00 0.00 60.65 58.98 1mir h LYS 39 Cb 0.52 0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 31.26 1mir h LYS 39 CO -0.22 -0.17 0.06 0.87 -1.08 0.00 0.00 179.45 178.91 1mir h LYS 40 N -0.63 0.00 -0.72 3.15 6.56 0.05 -1.27 116.57 123.69 1mir h LYS 40 Ca -0.05 0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.49 1mir h LYS 40 Cb 0.45 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.08 1mir h LYS 40 CO 0.07 0.00 0.24 -0.07 -2.06 0.00 0.00 179.45 177.64 1mir h LEU 41 N 0.00 1.04 -6.80 2.94 3.38 -0.48 -3.06 115.31 112.34 1mir h LEU 41 Ca 0.04 -0.20 -0.71 0.00 0.09 0.00 0.00 57.88 57.09 1mir h LEU 41 Cb 0.16 -0.27 -0.09 0.00 0.09 0.00 0.00 40.66 40.56 1mir h LEU 41 CO -0.00 0.96 2.49 0.00 0.09 0.00 0.00 178.44 181.98 1mir n GLY 43 N 4.25 4.40 3.54 0.00 0.00 -1.21 -4.52 105.19 111.66 1mir n GLY 43 Ca 0.47 -2.48 -0.04 0.00 0.00 0.00 0.00 46.02 43.97 1mir n GLY 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mir s THR 44 N -1.15 -0.73 -0.30 2.61 2.01 -1.25 -1.32 115.64 115.51 1mir s THR 44 Ca 0.33 0.05 -0.19 0.00 0.31 0.00 0.00 61.69 62.19 1mir s THR 44 Cb -0.03 -0.90 -0.01 0.00 0.01 0.00 0.00 72.50 71.57 1mir s THR 44 CO -0.01 0.02 0.58 0.54 -0.69 0.00 0.00 174.62 175.06 1mir s VAL 45 N 2.58 4.98 0.82 3.82 0.11 -0.40 -3.82 120.40 128.49 1mir s VAL 45 Ca -0.06 0.77 -0.12 0.00 -2.93 0.00 0.00 61.98 59.64 1mir s VAL 45 Cb -0.11 -3.95 0.08 0.00 -1.53 0.00 0.00 36.38 30.87 1mir s VAL 45 CO -0.17 -0.10 1.15 -0.76 -3.33 0.00 0.00 175.10 171.88 1mir s LEU 46 N 2.50 2.46 -0.71 2.54 1.43 -1.26 -4.37 118.68 121.27 1mir s LEU 46 Ca 0.23 0.94 0.00 0.00 -1.03 0.00 0.00 54.13 54.27 1mir s LEU 46 Cb -0.15 -3.46 0.00 0.00 0.03 0.00 0.00 46.19 42.61 1mir s LEU 46 CO 0.11 -1.98 0.00 0.61 0.23 0.00 0.00 176.35 175.33 1mir n GLY 47 N -2.86 0.85 3.72 -3.19 0.00 -1.26 -5.01 105.19 97.44 1mir n GLY 47 Ca 0.07 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 1mir n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mir s GLY 48 N -2.57 1.68 0.12 -0.02 0.00 -1.26 -4.91 107.32 100.36 1mir s GLY 48 Ca 0.00 0.42 -0.31 0.00 0.00 0.00 0.00 44.72 44.83 1mir s GLY 48 CO 0.00 0.80 1.85 -1.55 0.00 0.00 0.00 173.10 174.20 1mir n PRO 49 N -3.89 2.83 -1.77 2.90 -0.04 -1.26 -4.96 135.00 128.82 1mir n PRO 49 Ca 0.10 1.03 -0.31 0.00 -0.04 0.00 0.00 63.50 64.28 1mir n PRO 49 Cb 0.53 -2.93 0.03 0.00 -0.04 0.00 0.00 33.50 31.08 1mir n PRO 49 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1mir s LYS 50 N 2.83 3.29 0.63 0.54 1.02 -1.26 -4.89 119.74 121.90 1mir s LYS 50 Ca 0.82 0.79 -0.06 0.00 0.02 0.00 0.00 55.97 57.54 1mir s LYS 50 Cb -0.47 -2.04 0.03 0.00 -0.52 0.00 0.00 37.83 34.82 1mir s LYS 50 CO 0.37 -0.80 0.95 -0.51 -0.92 0.00 0.00 175.35 174.44 1mir s LEU 51 N -5.33 3.08 0.34 3.17 1.43 -1.26 -5.00 118.68 115.12 1mir s LEU 51 Ca 0.56 0.65 -0.29 0.00 -1.03 0.00 0.00 54.13 54.03 1mir s LEU 51 Cb -0.12 -3.42 -0.11 0.00 0.03 0.00 0.00 46.19 42.56 1mir s LEU 51 CO 0.54 -1.25 1.54 -0.81 0.23 0.00 0.00 176.35 176.61 1mir n PRO 52 N -2.71 2.70 -2.43 1.29 -0.04 -1.26 -4.26 135.00 128.29 1mir n PRO 52 Ca 0.06 0.95 -0.38 0.00 -0.04 0.00 0.00 63.50 64.09 1mir n PRO 52 Cb 0.58 -2.71 -0.03 0.00 -0.04 0.00 0.00 33.50 31.30 1mir n PRO 52 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1mir s GLU 53 N -1.36 4.28 0.38 0.54 2.12 -1.26 -1.68 118.70 121.71 1mir s GLU 53 Ca 0.58 1.73 -0.26 0.00 0.36 0.00 0.00 54.97 57.38 1mir s GLU 53 Cb -0.48 -2.80 -0.09 0.00 0.26 0.00 0.00 34.13 31.02 1mir s GLU 53 CO 0.57 -0.09 1.18 0.50 -0.54 0.00 0.00 175.26 176.87 1mir s ARG 54 N -2.09 4.16 0.33 4.30 3.52 -0.41 -4.84 118.95 123.92 1mir s ARG 54 Ca 0.53 1.88 0.10 0.00 -0.13 0.00 0.00 55.73 58.11 1mir s ARG 54 Cb -0.28 -2.78 0.99 0.00 -1.56 0.00 0.00 34.95 31.31 1mir s ARG 54 CO 0.36 -0.24 1.59 0.28 -0.81 0.00 0.00 175.30 176.48 1mir h VAL 55 N 2.50 0.05 0.00 7.11 2.07 -1.95 -3.45 116.25 122.58 1mir h VAL 55 Ca -0.49 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1mir h VAL 55 Cb 1.23 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1mir h VAL 55 CO 0.63 0.01 0.00 0.61 0.02 0.00 0.00 177.57 178.84 1mir n GLY 56 N -1.39 0.96 0.00 2.17 0.00 -1.26 -5.06 105.19 100.60 1mir n GLY 56 Ca 0.29 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1mir n GLY 56 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1mir n PHE 57 N 1.72 0.00 -0.35 1.61 -1.74 -1.26 -4.96 117.46 112.48 1mir n PHE 57 Ca 0.00 0.00 0.24 0.00 -0.56 0.00 0.00 57.45 57.13 1mir n PHE 57 Cb 0.00 0.08 0.49 0.00 1.52 0.00 0.00 39.48 41.57 1mir n PHE 57 CO 0.00 0.00 0.00 0.66 -0.56 0.00 0.00 176.76 176.86 1mir h SER 58 N 0.00 0.49 -1.09 5.98 4.64 -1.88 -1.72 113.55 119.97 1mir h SER 58 Ca 0.00 0.14 0.32 0.00 -0.47 0.00 0.00 61.79 61.78 1mir h SER 58 Cb 0.63 0.08 -0.04 0.00 -0.31 0.00 0.00 62.40 62.76 1mir h SER 58 CO 0.00 -0.03 0.95 -0.33 -0.87 0.00 0.00 176.83 176.55 1mir h GLU 59 N 0.36 0.00 0.05 4.77 5.08 -1.93 -1.03 114.58 121.88 1mir h GLU 59 Ca 0.69 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.79 1mir h GLU 59 Cb 1.67 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.89 1mir h GLU 59 CO -0.47 0.00 -1.41 -0.44 -1.00 0.00 0.00 179.01 175.69 1mir h ASP 60 N 0.00 0.15 -2.70 1.42 3.32 -1.74 -3.47 116.42 113.41 1mir h ASP 60 Ca 0.52 -0.68 -0.53 0.00 0.02 0.00 0.00 57.03 56.35 1mir h ASP 60 Cb 2.42 -0.05 0.02 0.00 0.22 0.00 0.00 39.33 41.94 1mir h ASP 60 CO -0.01 1.58 0.99 -0.63 -1.72 0.00 0.00 179.24 179.45 1mir s ILE 61 N -2.42 3.13 -1.08 0.35 1.01 -0.39 -4.92 121.20 116.88 1mir s ILE 61 Ca -0.26 0.55 -0.20 0.00 0.00 0.00 0.00 60.65 60.75 1mir s ILE 61 Cb 0.06 -3.35 0.09 0.00 0.01 0.00 0.00 42.46 39.26 1mir s ILE 61 CO 0.66 -0.00 1.42 0.21 0.00 0.00 0.00 174.94 177.23 1mir s ASN 62 N 2.41 6.67 0.06 3.58 3.04 -1.26 -4.96 114.94 124.49 1mir s ASN 62 Ca 0.73 -2.00 -0.31 0.00 0.04 0.00 0.00 52.86 51.33 1mir s ASN 62 Cb -0.39 -2.51 -0.08 0.00 -1.54 0.00 0.00 41.25 36.74 1mir s ASN 62 CO 0.32 -1.23 1.61 -0.76 -3.04 0.00 0.00 177.10 174.00 1mir s LEU 1 N 3.82 4.36 0.96 3.21 1.43 -1.26 -5.02 118.68 126.18 1mir s LEU 1 Ca 0.44 2.44 -0.12 0.00 -1.03 0.00 0.00 54.13 55.85 1mir s LEU 1 Cb -0.01 -3.56 0.16 0.00 0.03 0.00 0.00 46.19 42.81 1mir s LEU 1 CO -0.05 -0.86 1.11 -2.16 0.23 0.00 0.00 176.35 174.62 1mir s PRO 2 N 2.55 0.77 0.18 1.29 0.04 -1.26 -4.96 135.00 133.62 1mir s PRO 2 Ca 0.72 0.46 -0.06 0.00 0.04 0.00 0.00 61.00 62.16 1mir s PRO 2 Cb -0.39 -1.78 0.09 0.00 0.04 0.00 0.00 34.50 32.46 1mir s PRO 2 CO 0.31 -2.48 1.54 1.49 0.04 0.00 0.00 177.00 177.90 1mir h GLU 3 N -1.71 0.77 -4.37 4.56 4.81 -1.98 -3.44 114.58 113.22 1mir h GLU 3 Ca -0.53 -0.39 -0.29 0.00 -0.13 0.00 0.00 59.36 58.03 1mir h GLU 3 Cb 1.33 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 30.46 1mir h GLU 3 CO 0.59 1.01 -0.74 -1.12 -0.73 0.00 0.00 179.01 178.02 1mir s SER 4 N -6.83 0.66 0.04 1.04 0.01 -1.26 -4.21 113.70 103.15 1mir s SER 4 Ca -0.09 -0.31 -0.05 0.00 1.31 0.00 0.00 55.95 56.81 1mir s SER 4 Cb 0.12 -0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.32 1mir s SER 4 CO 0.85 -0.08 0.07 0.12 0.41 0.00 0.00 173.24 174.62 1mir s PHE 5 N -0.73 0.24 -0.30 2.43 5.36 -0.83 -4.98 117.98 119.17 1mir s PHE 5 Ca -0.04 -0.57 0.04 0.00 -0.96 0.00 0.00 56.93 55.40 1mir s PHE 5 Cb -0.06 -0.17 0.18 0.00 -0.34 0.00 0.00 43.02 42.63 1mir s PHE 5 CO 0.00 -0.36 0.49 0.34 -1.46 0.00 0.00 175.22 174.24 1mir s ASP 6 N -2.17 -0.50 0.44 6.13 -1.08 -1.26 -1.98 116.67 116.24 1mir s ASP 6 Ca -0.04 -0.26 0.31 0.00 -0.52 0.00 0.00 52.55 52.04 1mir s ASP 6 Cb -0.01 1.50 1.46 0.00 -1.46 0.00 0.00 42.92 44.42 1mir s ASP 6 CO -0.05 -0.31 1.60 0.00 0.52 0.00 0.00 175.17 176.92 1mir h ALA 7 N 7.95 2.77 -0.36 3.66 0.00 -1.69 0.83 119.26 132.42 1mir h ALA 7 Ca -0.04 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.03 1mir h ALA 7 Cb 1.15 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 1mir h ALA 7 CO 0.20 -1.44 0.19 0.00 0.00 0.00 0.00 179.25 178.20 1mir h ARG 8 N 0.04 0.37 -0.23 0.00 3.08 -1.83 -0.70 114.38 115.12 1mir h ARG 8 Ca 0.86 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 60.76 1mir h ARG 8 Cb 2.71 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 32.67 1mir h ARG 8 CO -0.46 0.25 -0.36 0.93 -1.07 0.00 0.00 179.97 179.26 1mir h GLU 9 N 0.39 0.65 -0.97 0.04 5.08 -1.26 -2.87 114.58 115.63 1mir h GLU 9 Ca 0.15 -0.39 0.06 0.00 -1.00 0.00 0.00 59.36 58.18 1mir h GLU 9 Cb 0.05 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.28 1mir h GLU 9 CO -0.10 1.00 0.63 0.37 -1.00 0.00 0.00 179.01 179.91 1mir h GLN 10 N 0.35 1.11 -2.16 2.33 5.75 -1.16 -3.19 115.11 118.13 1mir h GLN 10 Ca 0.02 -0.07 -0.54 0.00 -0.15 0.00 0.00 58.65 57.91 1mir h GLN 10 Cb 0.95 -0.25 -0.41 0.00 1.07 0.00 0.00 27.48 28.84 1mir h GLN 10 CO 0.08 0.73 -0.88 0.91 -2.65 0.00 0.00 178.83 177.02 1mir n TRP 11 N -4.49 2.39 0.06 3.99 8.01 -0.30 -4.90 117.44 122.21 1mir n TRP 11 Ca 0.14 -3.92 0.20 0.00 -1.31 0.00 0.00 57.50 52.61 1mir n TRP 11 Cb 0.17 -0.46 0.73 0.00 -2.01 0.00 0.00 31.31 29.75 1mir n TRP 11 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1mir h SER 12 N 2.99 0.00 0.12 -0.99 4.64 -1.49 0.15 113.55 118.97 1mir h SER 12 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1mir h SER 12 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1mir h SER 12 CO 0.68 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.18 1mir n ASN 13 N -4.07 0.00 -4.06 4.97 6.94 -1.26 -4.11 115.26 113.66 1mir n ASN 13 Ca 0.08 -0.02 -0.35 0.00 -0.02 0.00 0.00 54.58 54.27 1mir n ASN 13 Cb 0.57 -0.19 -0.11 0.00 -2.36 0.00 0.00 39.78 37.69 1mir n ASN 13 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1mir h PRO 15 N 6.94 0.40 -0.94 0.00 0.13 -1.83 -2.70 132.00 134.01 1mir h PRO 15 Ca -0.04 -0.02 0.27 0.00 -0.87 0.00 0.00 66.00 65.34 1mir h PRO 15 Cb 0.94 -0.09 -0.14 0.00 0.13 0.00 0.00 31.00 31.84 1mir h PRO 15 CO 0.70 0.26 0.39 1.79 -0.23 0.00 0.00 178.00 180.91 1mir h THR 16 N 0.41 0.32 0.00 1.56 1.35 -1.95 -0.85 112.91 113.75 1mir h THR 16 Ca 0.41 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 66.17 1mir h THR 16 Cb 0.63 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.07 1mir h THR 16 CO -0.42 0.05 0.02 -0.38 -0.25 0.00 0.00 175.52 174.54 1mir n ILE 17 N -5.14 0.25 -0.08 6.82 5.41 -1.02 -0.18 119.36 125.42 1mir n ILE 17 Ca 0.26 0.08 0.00 0.00 1.00 0.00 0.00 62.75 64.09 1mir n ILE 17 Cb 0.81 -1.08 0.00 0.00 -0.71 0.00 0.00 39.64 38.66 1mir n ILE 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1mir n ALA 18 N -0.98 1.06 -1.76 -1.39 0.00 -0.33 -4.65 120.51 112.46 1mir n ALA 18 Ca 0.00 -0.04 -0.36 0.00 0.00 0.00 0.00 53.44 53.04 1mir n ALA 18 Cb 0.02 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.49 1mir n ALA 18 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1mir s GLN 19 N -0.43 3.06 -0.14 0.00 0.74 0.75 -5.02 119.66 118.62 1mir s GLN 19 Ca 0.00 1.81 -0.00 0.00 0.05 0.00 0.00 55.36 57.22 1mir s GLN 19 Cb 0.00 -1.97 0.03 0.00 1.10 0.00 0.00 33.01 32.17 1mir s GLN 19 CO 0.00 -1.13 -0.08 0.42 -0.55 0.00 0.00 175.29 173.95 1mir s ILE 20 N -1.60 1.14 0.77 -2.34 -1.09 -1.26 -5.03 121.20 111.79 1mir s ILE 20 Ca 0.76 -0.49 -0.04 0.00 -2.23 0.00 0.00 60.65 58.66 1mir s ILE 20 Cb -0.30 -1.21 0.15 0.00 -1.58 0.00 0.00 42.46 39.52 1mir s ILE 20 CO 0.33 0.28 1.06 -0.13 -1.23 0.00 0.00 174.94 175.25 1mir s ARG 21 N 1.64 1.44 -0.05 2.79 0.52 -1.26 -4.57 118.95 119.45 1mir s ARG 21 Ca 0.03 -1.02 -0.01 0.00 -0.52 0.00 0.00 55.73 54.22 1mir s ARG 21 Cb -0.14 -2.24 0.03 0.00 0.52 0.00 0.00 34.95 33.12 1mir s ARG 21 CO -0.08 -1.66 0.01 0.34 0.02 0.00 0.00 175.30 173.92 1mir s ASP 22 N -4.78 1.05 0.00 0.23 -1.08 -1.26 -2.77 116.67 108.06 1mir s ASP 22 Ca 0.68 -0.03 0.27 0.00 -0.52 0.00 0.00 52.55 52.95 1mir s ASP 22 Cb -0.05 -0.30 0.81 0.00 -1.46 0.00 0.00 42.92 41.92 1mir s ASP 22 CO 0.46 -0.17 1.60 0.00 0.52 0.00 0.00 175.17 177.59 1mir n GLN 23 N 4.77 0.54 0.00 4.34 10.64 -1.12 -4.96 117.38 131.60 1mir n GLN 23 Ca -0.14 -0.28 0.00 0.00 -1.83 0.00 0.00 57.00 54.75 1mir n GLN 23 Cb 0.50 -1.49 0.00 0.00 -0.86 0.00 0.00 30.24 28.39 1mir n GLN 23 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1mir n GLY 24 N 1.38 1.21 1.86 2.61 0.00 -1.26 -2.79 105.19 108.20 1mir n GLY 24 Ca 0.11 -0.61 -0.17 0.00 0.00 0.00 0.00 46.02 45.34 1mir n GLY 24 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mir n SER 25 N -1.89 5.40 -4.26 1.61 7.64 -1.26 -4.75 113.62 116.10 1mir n SER 25 Ca 0.00 -3.07 -0.31 0.00 1.01 0.00 0.00 58.87 56.50 1mir n SER 25 Cb 0.00 -0.91 -0.16 0.00 -1.01 0.00 0.00 64.21 62.13 1mir n SER 25 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1mir n GLY 27 N 2.85 3.30 1.23 0.00 0.00 0.21 -4.41 105.19 108.37 1mir n GLY 27 Ca -0.17 -1.23 0.12 0.00 0.00 0.00 0.00 46.02 44.74 1mir n GLY 27 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mir n SER 28 N 2.93 3.62 -0.30 1.61 3.41 -1.26 -2.62 113.62 121.00 1mir n SER 28 Ca 0.52 -1.99 0.16 0.00 -0.26 0.00 0.00 58.87 57.30 1mir n SER 28 Cb 0.64 -0.37 0.42 0.00 -0.26 0.00 0.00 64.21 64.63 1mir n SER 28 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1mir h SER 29 N 4.25 0.60 -0.88 4.04 4.64 -1.76 0.67 113.55 125.11 1mir h SER 29 Ca 0.00 0.07 0.18 0.00 -0.47 0.00 0.00 61.79 61.56 1mir h SER 29 Cb 0.96 -0.04 -0.07 0.00 -0.31 0.00 0.00 62.40 62.94 1mir h SER 29 CO 0.00 0.23 0.58 4.11 -0.87 0.00 0.00 176.83 180.87 1mir h TRP 30 N 0.59 0.65 0.07 4.77 5.08 -1.45 -0.02 115.95 125.64 1mir h TRP 30 Ca 0.52 0.02 -0.11 0.00 1.08 0.00 0.00 58.89 60.40 1mir h TRP 30 Cb 1.04 -0.20 0.01 0.00 -3.00 0.00 0.00 29.16 27.01 1mir h TRP 30 CO -0.00 0.20 -0.49 0.00 -1.28 0.00 0.00 178.44 176.87 1mir h ALA 31 N 1.62 -0.04 -0.32 0.11 0.00 -0.00 -3.31 119.26 117.31 1mir h ALA 31 Ca 0.45 -0.60 0.02 0.00 0.00 0.00 0.00 54.91 54.78 1mir h ALA 31 Cb 0.97 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1mir h ALA 31 CO -0.19 0.23 0.18 0.74 0.00 0.00 0.00 179.25 180.20 1mir h PHE 32 N -0.54 0.33 -0.69 0.00 -1.00 0.04 -1.87 116.94 113.20 1mir h PHE 32 Ca -0.08 0.01 0.11 0.00 2.81 0.00 0.00 57.97 60.83 1mir h PHE 32 Cb 1.34 -0.10 -0.04 0.00 3.61 0.00 0.00 35.95 40.76 1mir h PHE 32 CO 0.21 0.19 0.46 0.78 -1.61 0.00 0.00 178.31 178.35 1mir h GLY 33 N 0.36 0.72 0.05 -1.45 0.00 -1.21 -0.06 103.07 101.49 1mir h GLY 33 Ca 0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 1mir h GLY 33 CO -0.07 0.10 -0.03 0.00 0.00 0.00 0.00 176.54 176.55 1mir h ALA 34 N 1.66 -0.49 -0.50 3.60 0.00 -1.49 -2.95 119.26 119.08 1mir h ALA 34 Ca 0.33 -0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.37 1mir h ALA 34 Cb 0.63 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1mir h ALA 34 CO -0.11 -0.49 0.41 -0.39 0.00 0.00 0.00 179.25 178.67 1mir h VAL 35 N -0.13 0.59 0.05 0.00 -1.51 -1.25 -0.12 116.25 113.88 1mir h VAL 35 Ca -0.01 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.46 1mir h VAL 35 Cb 0.05 0.70 0.00 0.00 -2.13 0.00 0.00 31.29 29.92 1mir h VAL 35 CO 0.01 0.00 -0.03 -0.33 -1.23 0.00 0.00 177.57 176.00 1mir h GLU 36 N 0.00 -0.07 -0.40 5.19 5.08 -1.08 -1.11 114.58 122.18 1mir h GLU 36 Ca 0.24 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1mir h GLU 36 Cb 1.05 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 1mir h GLU 36 CO -0.00 0.21 0.23 0.00 -1.00 0.00 0.00 179.01 178.45 1mir h ALA 37 N 0.57 0.52 -0.26 3.43 0.00 -0.98 -2.52 119.26 120.03 1mir h ALA 37 Ca -0.01 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1mir h ALA 37 Cb 0.32 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1mir h ALA 37 CO 0.01 0.03 -0.03 0.52 0.00 0.00 0.00 179.25 179.78 1mir h MET 38 N 0.52 0.04 -0.40 0.00 2.86 -1.01 -1.43 114.93 115.51 1mir h MET 38 Ca 0.14 -0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.84 1mir h MET 38 Cb 0.04 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.64 1mir h MET 38 CO -0.02 0.02 0.09 0.77 1.06 0.00 0.00 176.91 178.83 1mir h SER 39 N 0.04 0.03 -0.17 1.22 0.02 -1.00 -1.31 113.55 112.39 1mir h SER 39 Ca 0.12 0.06 0.05 0.00 -0.84 0.00 0.00 61.79 61.19 1mir h SER 39 Cb 0.18 0.08 -0.06 0.00 0.14 0.00 0.00 62.40 62.74 1mir h SER 39 CO -0.24 0.05 -0.23 0.44 -1.14 0.00 0.00 176.83 175.72 1mir h ASP 40 N 0.22 -0.71 -0.45 3.07 5.19 -0.98 -2.83 116.42 119.94 1mir h ASP 40 Ca 0.19 0.12 -0.03 0.00 -0.62 0.00 0.00 57.03 56.70 1mir h ASP 40 Cb 0.22 0.33 -0.02 0.00 0.18 0.00 0.00 39.33 40.04 1mir h ASP 40 CO -0.24 -0.27 0.17 0.03 -3.12 0.00 0.00 179.24 175.80 1mir h ARG 41 N -0.27 0.68 -0.98 3.56 2.47 -0.81 -1.61 114.38 117.41 1mir h ARG 41 Ca 0.11 -0.13 0.20 0.00 -1.26 0.00 0.00 59.98 58.91 1mir h ARG 41 Cb 0.44 -0.11 -0.11 0.00 -1.65 0.00 0.00 29.97 28.54 1mir h ARG 41 CO -0.32 0.63 0.58 0.82 0.56 0.00 0.00 179.97 182.23 1mir h ILE 42 N 0.58 0.65 0.40 2.04 2.04 -1.01 0.44 117.51 122.65 1mir h ILE 42 Ca 0.15 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 1mir h ILE 42 Cb 0.21 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.20 1mir h ILE 42 CO -0.01 0.12 -0.19 0.00 0.00 0.00 0.00 178.15 178.07 1mir h ILE 44 N -0.91 0.23 0.00 0.00 2.04 -0.65 0.31 117.51 118.53 1mir h ILE 44 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1mir h ILE 44 Cb 0.42 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1mir h ILE 44 CO 0.09 0.00 0.00 1.41 0.00 0.00 0.00 178.15 179.65 1mir n HIS 45 N -5.47 0.00 -1.78 1.37 8.25 0.15 -2.04 115.22 115.70 1mir n HIS 45 Ca 0.08 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.59 1mir n HIS 45 Cb 0.37 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.55 1mir n HIS 45 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1mir n THR 46 N -0.90 0.87 -3.72 1.59 -2.24 -0.02 -4.99 114.28 104.87 1mir n THR 46 Ca 0.11 -1.35 -0.28 0.00 -2.27 0.00 0.00 64.05 60.27 1mir n THR 46 Cb 0.05 0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.55 1mir n THR 46 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1mir n ASN 47 N -0.47 -3.30 -0.62 3.42 3.02 -0.87 -0.68 115.26 115.77 1mir n ASN 47 Ca 0.09 -0.63 -0.08 0.00 -0.03 0.00 0.00 54.58 53.93 1mir n ASN 47 Cb 0.77 -2.74 -0.03 0.00 -0.61 0.00 0.00 39.78 37.18 1mir n ASN 47 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mir n GLY 48 N -1.21 0.91 0.09 7.41 0.00 -0.51 -4.88 105.19 107.00 1mir n GLY 48 Ca 0.03 -0.68 -0.03 0.00 0.00 0.00 0.00 46.02 45.34 1mir n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mir n ARG 49 N -2.70 0.63 -4.08 1.61 5.12 0.15 -4.77 116.66 112.62 1mir n ARG 49 Ca -0.08 0.19 -0.33 0.00 -1.93 0.00 0.00 57.85 55.70 1mir n ARG 49 Cb 0.28 -1.75 -0.16 0.00 -1.16 0.00 0.00 32.46 29.67 1mir n ARG 49 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1mir s VAL 50 N -2.82 2.24 -0.25 1.55 1.01 -1.26 -5.03 120.40 115.83 1mir s VAL 50 Ca -0.05 -1.06 -0.03 0.00 0.00 0.00 0.00 61.98 60.85 1mir s VAL 50 Cb 0.08 -2.04 0.08 0.00 0.00 0.00 0.00 36.38 34.51 1mir s VAL 50 CO 0.82 0.39 0.08 0.21 0.00 0.00 0.00 175.10 176.60 1mir s ASN 51 N 1.27 3.41 0.19 3.32 2.47 -1.26 -3.35 114.94 120.99 1mir s ASN 51 Ca 0.02 -1.20 0.05 0.00 0.42 0.00 0.00 52.86 52.15 1mir s ASN 51 Cb -0.15 -0.61 -0.05 0.00 -1.45 0.00 0.00 41.25 39.00 1mir s ASN 51 CO -0.10 -0.38 -0.07 0.68 -3.72 0.00 0.00 177.10 173.51 1mir s VAL 52 N 1.85 1.23 -0.36 -5.21 -7.23 -1.26 -5.09 120.40 104.33 1mir s VAL 52 Ca 0.05 -2.08 -0.09 0.00 -1.81 0.00 0.00 61.98 58.06 1mir s VAL 52 Cb -0.17 -2.10 0.04 0.00 0.56 0.00 0.00 36.38 34.71 1mir s VAL 52 CO -0.21 -0.54 0.17 -1.61 -0.31 0.00 0.00 175.10 172.60 1mir s GLU 53 N -3.77 2.70 0.30 4.82 2.02 -1.26 -4.72 118.70 118.78 1mir s GLU 53 Ca 0.23 -1.17 -0.29 0.00 0.02 0.00 0.00 54.97 53.76 1mir s GLU 53 Cb 0.03 -3.62 -0.10 0.00 0.10 0.00 0.00 34.13 30.55 1mir s GLU 53 CO 0.05 -0.71 1.32 0.08 0.02 0.00 0.00 175.26 176.02 1mir s VAL 54 N 1.47 2.80 0.00 2.63 1.01 -1.26 -0.32 120.40 126.74 1mir s VAL 54 Ca 0.00 0.77 -0.30 0.00 0.00 0.00 0.00 61.98 62.45 1mir s VAL 54 Cb -0.20 -3.49 -0.06 0.00 0.00 0.00 0.00 36.38 32.63 1mir s VAL 54 CO 0.05 0.17 1.50 -0.55 0.00 0.00 0.00 175.10 176.26 1mir s SER 55 N -0.27 6.76 0.16 3.32 0.15 0.25 -4.48 113.70 119.59 1mir s SER 55 Ca 0.51 2.21 0.06 0.00 0.70 0.00 0.00 55.95 59.43 1mir s SER 55 Cb -0.39 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.31 1mir s SER 55 CO 0.49 -0.80 1.36 0.00 1.20 0.00 0.00 173.24 175.49 1mir h ALA 56 N 8.26 0.50 0.82 5.45 0.00 -1.82 -3.29 119.26 129.18 1mir h ALA 56 Ca -0.39 -0.79 -0.04 0.00 0.00 0.00 0.00 54.91 53.70 1mir h ALA 56 Cb 1.18 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1mir h ALA 56 CO 0.92 1.04 -0.48 1.49 0.00 0.00 0.00 179.25 182.22 1mir h GLU 57 N 0.03 -1.17 -0.78 0.00 4.57 -1.86 -1.59 114.58 113.78 1mir h GLU 57 Ca -0.03 0.08 0.18 0.00 -1.18 0.00 0.00 59.36 58.41 1mir h GLU 57 Cb 1.58 0.27 -0.13 0.00 -0.16 0.00 0.00 28.75 30.31 1mir h GLU 57 CO 0.13 -0.78 0.04 0.22 -1.18 0.00 0.00 179.01 177.44 1mir h ASP 58 N -1.21 -0.29 -0.32 1.04 3.58 -1.80 -0.12 116.42 117.30 1mir h ASP 58 Ca -0.11 0.19 -0.08 0.00 0.42 0.00 0.00 57.03 57.46 1mir h ASP 58 Cb 0.96 0.33 -0.01 0.00 1.72 0.00 0.00 39.33 42.33 1mir h ASP 58 CO 0.13 -0.17 -0.10 0.25 -2.88 0.00 0.00 179.24 176.46 1mir h LEU 59 N 0.12 0.65 -1.38 2.28 5.85 -1.61 0.11 115.31 121.34 1mir h LEU 59 Ca 0.43 -0.38 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 1mir h LEU 59 Cb 0.78 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1mir h LEU 59 CO -0.66 0.88 -0.10 0.25 -0.34 0.00 0.00 178.44 178.47 1mir h LEU 60 N 0.41 0.27 0.00 2.25 5.85 -0.16 -3.09 115.31 120.84 1mir h LEU 60 Ca 0.08 -0.05 -0.33 0.00 0.84 0.00 0.00 57.88 58.42 1mir h LEU 60 Cb 0.61 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.50 1mir h LEU 60 CO 0.04 0.41 -2.24 0.35 -0.34 0.00 0.00 178.44 176.66 1mir n THR 61 N -4.28 1.24 0.42 1.05 -2.24 -0.19 -4.56 114.28 105.72 1mir n THR 61 Ca -0.00 -0.63 0.11 0.00 -2.27 0.00 0.00 64.05 61.26 1mir n THR 61 Cb 0.26 -0.88 0.01 0.00 -2.10 0.00 0.00 70.33 67.61 1mir n THR 61 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mir n GLY 64 N -1.18 0.33 0.20 0.00 0.00 -1.26 -3.65 105.19 99.63 1mir n GLY 64 Ca 0.01 -0.94 0.08 0.00 0.00 0.00 0.00 46.02 45.17 1mir n GLY 64 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1mir h ILE 65 N 0.00 0.60 -0.75 -0.61 6.09 -1.93 -3.21 117.51 117.69 1mir h ILE 65 Ca 0.00 -1.37 0.17 0.00 -1.37 0.00 0.00 64.86 62.29 1mir h ILE 65 Cb 0.00 1.93 -0.05 0.00 0.47 0.00 0.00 36.82 39.18 1mir h ILE 65 CO 0.00 0.27 0.51 -0.61 -3.07 0.00 0.00 178.15 175.26 1mir h GLN 66 N 0.00 0.29 0.02 2.19 4.15 -1.98 -2.47 115.11 117.31 1mir h GLN 66 Ca -0.00 -0.02 -0.35 0.00 0.77 0.00 0.00 58.65 59.05 1mir h GLN 66 Cb 0.91 -0.07 -0.06 0.00 0.21 0.00 0.00 27.48 28.48 1mir h GLN 66 CO 0.04 0.19 -2.16 0.00 -1.93 0.00 0.00 178.83 174.97 1mir n GLY 68 N 1.86 0.24 2.73 0.00 0.00 -0.93 0.16 105.19 109.25 1mir n GLY 68 Ca -0.31 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 44.60 1mir n GLY 68 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1mir n ASP 69 N 0.00 4.01 0.00 1.61 2.03 -0.82 -4.32 116.55 119.05 1mir n ASP 69 Ca 0.00 -3.56 0.00 0.00 0.52 0.00 0.00 54.79 51.75 1mir n ASP 69 Cb 0.00 -0.60 0.00 0.00 -0.72 0.00 0.00 41.12 39.80 1mir n ASP 69 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1mir n GLY 70 N 0.13 1.03 0.00 0.27 0.00 -1.26 0.71 105.19 106.07 1mir n GLY 70 Ca 0.30 0.26 0.04 0.00 0.00 0.00 0.00 46.02 46.63 1mir n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mir n ASN 72 N -1.51 2.31 0.00 0.00 3.02 0.22 0.64 115.26 119.95 1mir n ASN 72 Ca 0.02 -1.87 0.00 0.00 -0.03 0.00 0.00 54.58 52.70 1mir n ASN 72 Cb 0.10 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 1mir n ASN 72 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mir n GLY 73 N 1.24 2.61 0.34 7.41 0.00 -0.94 -4.89 105.19 110.98 1mir n GLY 73 Ca 0.17 -1.60 -0.02 0.00 0.00 0.00 0.00 46.02 44.57 1mir n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mir n GLY 74 N 1.23 3.74 3.33 -0.02 0.00 -1.26 -1.95 105.19 110.26 1mir n GLY 74 Ca 0.00 -1.63 -0.35 0.00 0.00 0.00 0.00 46.02 44.04 1mir n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mir s TYR 75 N -2.67 2.94 0.45 1.61 2.02 0.12 -1.27 117.35 120.56 1mir s TYR 75 Ca 0.04 -0.86 0.16 0.00 -0.37 0.00 0.00 57.07 56.04 1mir s TYR 75 Cb 0.00 -2.06 1.10 0.00 -0.40 0.00 0.00 41.96 40.60 1mir s TYR 75 CO 0.03 -0.47 1.99 -1.35 -1.57 0.00 0.00 175.55 174.17 1mir h PRO 76 N 7.85 0.32 0.49 -1.71 0.11 -1.87 -2.38 132.00 134.80 1mir h PRO 76 Ca -0.39 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.69 1mir h PRO 76 Cb 1.17 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1mir h PRO 76 CO 0.60 0.21 -0.48 0.77 -0.21 0.00 0.00 178.00 178.89 1mir h SER 77 N 0.32 -1.31 -0.93 -2.05 0.02 -1.94 -2.74 113.55 104.92 1mir h SER 77 Ca 0.26 0.11 0.15 0.00 -0.84 0.00 0.00 61.79 61.46 1mir h SER 77 Cb 0.60 0.43 -0.09 0.00 0.14 0.00 0.00 62.40 63.48 1mir h SER 77 CO -0.06 -0.64 0.54 1.23 -1.14 0.00 0.00 176.83 176.75 1mir h GLY 78 N -0.97 1.55 0.36 -3.77 0.00 -1.68 -0.79 103.07 97.77 1mir h GLY 78 Ca -0.06 -0.33 0.06 0.00 0.00 0.00 0.00 47.33 47.00 1mir h GLY 78 CO -0.06 0.03 -0.09 0.00 0.00 0.00 0.00 176.54 176.42 1mir h ALA 79 N 1.56 0.19 -0.51 3.60 0.00 -1.35 0.19 119.26 122.95 1mir h ALA 79 Ca 0.50 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.47 1mir h ALA 79 Cb 0.64 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1mir h ALA 79 CO -0.33 -0.47 0.10 -1.49 0.00 0.00 0.00 179.25 177.06 1mir h TRP 80 N -0.01 0.88 0.00 0.00 4.06 -0.95 -1.29 115.95 118.63 1mir h TRP 80 Ca 0.15 -0.11 -0.01 0.00 2.06 0.00 0.00 58.89 60.98 1mir h TRP 80 Cb 0.24 -0.24 -0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1mir h TRP 80 CO -0.30 0.79 -0.02 -0.97 -3.56 0.00 0.00 178.44 174.37 1mir h ASN 81 N 0.72 0.00 0.07 -3.49 -0.73 -0.44 -2.27 115.58 109.43 1mir h ASN 81 Ca 0.16 0.00 -0.09 0.00 1.87 0.00 0.00 56.30 58.24 1mir h ASN 81 Cb 0.37 0.00 0.01 0.00 0.27 0.00 0.00 38.32 38.97 1mir h ASN 81 CO 0.01 0.02 -0.40 0.15 -0.37 0.00 0.00 177.43 176.84 1mir h PHE 82 N 0.00 0.28 -1.12 0.67 3.04 0.21 -2.96 116.94 117.06 1mir h PHE 82 Ca -0.00 -0.20 0.31 0.00 3.98 0.00 0.00 57.97 62.06 1mir h PHE 82 Cb 0.28 -0.01 -0.08 0.00 2.56 0.00 0.00 35.95 38.69 1mir h PHE 82 CO 0.00 1.14 0.75 2.35 -2.02 0.00 0.00 178.31 180.53 1mir h TRP 83 N -0.67 0.45 0.22 0.41 7.01 -0.68 0.11 115.95 122.81 1mir h TRP 83 Ca -0.07 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 60.94 1mir h TRP 83 Cb 1.30 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 28.24 1mir h TRP 83 CO 0.23 0.01 -0.11 1.15 -2.79 0.00 0.00 178.44 176.94 1mir h THR 84 N 0.24 0.53 0.12 2.65 2.02 -1.53 -2.45 112.91 114.50 1mir h THR 84 Ca 0.62 -0.97 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 1mir h THR 84 Cb 1.86 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 69.18 1mir h THR 84 CO -0.23 0.14 -0.06 0.03 0.37 0.00 0.00 175.52 175.78 1mir h ARG 85 N -0.96 -0.15 0.00 6.66 3.08 -0.94 -3.38 114.38 118.68 1mir h ARG 85 Ca -0.03 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1mir h ARG 85 Cb 0.46 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1mir h ARG 85 CO 0.05 0.12 -0.44 1.63 -1.07 0.00 0.00 179.97 180.26 1mir n LYS 86 N -5.04 4.27 -0.87 0.04 5.02 0.21 -5.11 118.16 116.69 1mir n LYS 86 Ca -0.09 -0.01 0.11 0.00 -2.02 0.00 0.00 58.31 56.31 1mir n LYS 86 Cb 0.19 -0.83 -0.04 0.00 -0.02 0.00 0.00 35.03 34.33 1mir n LYS 86 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mir n GLY 87 N 1.32 -2.01 2.93 0.72 0.00 -0.93 -4.90 105.19 102.33 1mir n GLY 87 Ca 0.01 -1.28 -0.11 0.00 0.00 0.00 0.00 46.02 44.63 1mir n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mir s LEU 88 N -5.73 2.11 0.87 0.99 1.43 -0.85 -4.74 118.68 112.75 1mir s LEU 88 Ca 0.00 -0.23 -0.11 0.00 -1.03 0.00 0.00 54.13 52.76 1mir s LEU 88 Cb 0.00 -0.01 0.16 0.00 0.03 0.00 0.00 46.19 46.38 1mir s LEU 88 CO 0.00 -0.12 1.20 0.68 0.23 0.00 0.00 176.35 178.35 1mir s VAL 89 N -0.64 2.06 0.97 -1.59 -7.23 -1.26 -0.38 120.40 112.33 1mir s VAL 89 Ca -0.06 -0.18 -0.14 0.00 -1.81 0.00 0.00 61.98 59.79 1mir s VAL 89 Cb -0.05 -2.88 0.17 0.00 0.56 0.00 0.00 36.38 34.19 1mir s VAL 89 CO -0.00 0.00 1.17 -0.94 -0.31 0.00 0.00 175.10 175.02 1mir s SER 90 N -4.80 3.03 0.00 4.85 1.04 -1.26 -0.58 113.70 115.98 1mir s SER 90 Ca 0.70 0.76 0.00 0.00 0.48 0.00 0.00 55.95 57.89 1mir s SER 90 Cb -0.05 -1.17 0.00 0.00 0.10 0.00 0.00 66.02 64.90 1mir s SER 90 CO 0.50 -2.83 0.00 0.61 0.98 0.00 0.00 173.24 172.50 1mir n GLY 91 N -2.35 1.94 0.00 7.32 0.00 0.56 -2.00 105.19 110.66 1mir n GLY 91 Ca 0.09 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.51 1mir n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mir n GLY 92 N 0.00 -0.40 3.93 -0.02 0.00 0.97 -3.98 105.19 105.69 1mir n GLY 92 Ca 0.00 -1.64 -0.28 0.00 0.00 0.00 0.00 46.02 44.09 1mir n GLY 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mir s VAL 93 N 0.15 2.06 -0.02 1.61 1.01 -1.26 -1.93 120.40 122.01 1mir s VAL 93 Ca 0.00 -0.12 -0.35 0.00 0.00 0.00 0.00 61.98 61.51 1mir s VAL 93 Cb 0.00 -2.94 -0.14 0.00 0.00 0.00 0.00 36.38 33.30 1mir s VAL 93 CO 0.00 0.00 1.69 0.00 0.00 0.00 0.00 175.10 176.79 1mir n TYR 94 N -3.42 2.15 -1.69 5.22 9.36 -1.24 -1.15 117.16 126.39 1mir n TYR 94 Ca 0.12 0.26 -0.21 0.00 3.32 0.00 0.00 57.90 61.39 1mir n TYR 94 Cb 0.60 -2.55 -0.08 0.00 -0.63 0.00 0.00 39.34 36.68 1mir n TYR 94 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 1mir n ASN 95 N 4.87 -5.56 0.15 2.98 5.15 -1.26 -4.85 115.26 116.75 1mir n ASN 95 Ca 0.21 0.46 0.04 0.00 -0.60 0.00 0.00 54.58 54.69 1mir n ASN 95 Cb 0.25 -4.87 0.05 0.00 -0.53 0.00 0.00 39.78 34.68 1mir n ASN 95 CO 0.00 0.00 0.00 0.77 1.40 0.00 0.00 177.26 179.43 1mir h SER 96 N 0.00 0.00 -1.82 1.20 4.64 -1.49 -3.46 113.55 112.62 1mir h SER 96 Ca -0.44 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.46 1mir h SER 96 Cb 1.37 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.35 1mir h SER 96 CO 0.62 0.42 -0.45 1.41 -0.87 0.00 0.00 176.83 177.96 1mir n HIS 97 N -3.21 -0.41 -3.65 4.77 8.25 -1.26 -4.95 115.22 114.76 1mir n HIS 97 Ca 0.02 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.12 1mir n HIS 97 Cb 0.70 -3.67 -0.09 0.00 1.12 0.00 0.00 29.99 28.06 1mir n HIS 97 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1mir s ILE 98 N -2.88 5.36 0.10 1.59 1.01 -1.26 -5.00 121.20 120.12 1mir s ILE 98 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.91 1mir s ILE 98 Cb 0.00 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.95 1mir s ILE 98 CO 0.00 0.37 0.00 0.61 0.00 0.00 0.00 174.94 175.92 1mir n GLY 99 N 3.92 -2.01 0.30 6.18 0.00 -1.26 -0.02 105.19 112.31 1mir n GLY 99 Ca -0.14 -1.35 -0.07 0.00 0.00 0.00 0.00 46.02 44.45 1mir n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mir n LEU 101 N -4.37 -0.54 -4.68 0.00 4.77 -0.85 -0.78 117.00 110.55 1mir n LEU 101 Ca 0.05 -4.35 -0.33 0.00 -0.03 0.00 0.00 56.01 51.35 1mir n LEU 101 Cb 0.18 0.61 0.14 0.00 -2.33 0.00 0.00 43.42 42.02 1mir n LEU 101 CO 0.40 1.95 0.73 -2.65 -1.33 0.00 0.00 177.39 176.49 1mir n PRO 102 N 2.28 -0.03 -1.84 3.23 -0.02 -1.26 -4.30 135.00 133.06 1mir n PRO 102 Ca 0.25 0.07 -0.42 0.00 -2.02 0.00 0.00 63.50 61.39 1mir n PRO 102 Cb 0.51 -2.42 -0.02 0.00 -0.02 0.00 0.00 33.50 31.55 1mir n PRO 102 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1mir s TYR 103 N -2.29 2.85 -0.26 6.00 5.04 -0.81 -4.77 117.35 123.10 1mir s TYR 103 Ca 0.71 0.80 0.22 0.00 -2.44 0.00 0.00 57.07 56.36 1mir s TYR 103 Cb -0.27 -4.01 -0.22 0.00 0.35 0.00 0.00 41.96 37.81 1mir s TYR 103 CO 0.53 -3.41 0.69 0.25 -1.34 0.00 0.00 175.55 172.27 1mir n THR 104 N 2.45 0.12 -2.56 4.34 -2.24 -1.26 -3.67 114.28 111.46 1mir n THR 104 Ca 0.09 -0.41 -0.43 0.00 -2.27 0.00 0.00 64.05 61.03 1mir n THR 104 Cb 0.38 0.10 -0.02 0.00 -2.10 0.00 0.00 70.33 68.69 1mir n THR 104 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1mir s ILE 105 N -3.39 4.51 0.50 2.28 1.01 -1.26 -5.01 121.20 119.85 1mir s ILE 105 Ca -0.03 1.82 -0.21 0.00 0.00 0.00 0.00 60.65 62.23 1mir s ILE 105 Cb 0.14 -4.18 -0.07 0.00 0.01 0.00 0.00 42.46 38.36 1mir s ILE 105 CO 0.87 -0.15 1.15 -2.16 0.00 0.00 0.00 174.94 174.65 1mir s PRO 106 N 3.22 3.54 1.07 2.79 0.04 -1.26 -4.78 135.00 139.62 1mir s PRO 106 Ca 0.49 1.69 -0.13 0.00 0.04 0.00 0.00 61.00 63.09 1mir s PRO 106 Cb -0.18 -2.19 0.23 0.00 0.04 0.00 0.00 34.50 32.39 1mir s PRO 106 CO 0.11 -0.71 1.07 -2.14 0.04 0.00 0.00 177.00 175.36 1mir s PRO 107 N -3.01 -0.16 -0.16 0.56 0.02 -1.26 -4.34 135.00 126.66 1mir s PRO 107 Ca 0.69 0.55 -0.04 0.00 0.02 0.00 0.00 61.00 62.22 1mir s PRO 107 Cb -0.26 -1.67 0.07 0.00 0.02 0.00 0.00 34.50 32.66 1mir s PRO 107 CO 0.31 -3.14 0.17 0.00 -0.33 0.00 0.00 177.00 174.01 1mir n GLU 109 N 5.31 1.37 0.00 0.00 1.02 -1.26 -4.64 120.64 122.44 1mir n GLU 109 Ca -0.06 -1.21 0.05 0.00 -0.02 0.00 0.00 57.16 55.92 1mir n GLU 109 Cb 0.50 -2.37 0.26 0.00 -0.02 0.00 0.00 31.44 29.81 1mir n GLU 109 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 1mir n HIS 110 N 4.91 0.00 0.75 -0.32 1.44 -1.26 -2.08 115.22 118.66 1mir n HIS 110 Ca 0.33 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 56.13 1mir n HIS 110 Cb 0.13 -0.13 -0.12 0.00 0.12 0.00 0.00 29.99 29.99 1mir n HIS 110 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14 1mir n HIS 111 N -1.13 0.00 -1.92 -1.40 1.44 -1.26 -1.23 115.22 109.72 1mir n HIS 111 Ca 0.06 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.77 1mir n HIS 111 Cb 0.05 -0.08 0.00 0.00 0.12 0.00 0.00 29.99 30.08 1mir n HIS 111 CO 0.00 0.00 0.00 1.33 -2.81 0.00 0.00 176.34 174.86 1mir n VAL 112 N -1.59 0.00 -3.39 0.61 0.24 -0.88 -4.90 118.33 108.41 1mir n VAL 112 Ca 0.02 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.34 1mir n VAL 112 Cb 0.34 -1.11 -0.03 0.00 -1.47 0.00 0.00 33.84 31.57 1mir n VAL 112 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1mir s ASN 113 N -1.00 -0.93 0.00 -1.34 3.84 -1.26 -4.60 114.94 109.65 1mir s ASN 113 Ca 0.00 1.00 0.00 0.00 0.21 0.00 0.00 52.86 54.07 1mir s ASN 113 Cb 0.00 1.94 0.00 0.00 -0.55 0.00 0.00 41.25 42.64 1mir s ASN 113 CO 0.00 -0.18 0.00 0.61 -2.79 0.00 0.00 177.10 174.74 1mir n GLY 114 N 5.30 -2.16 3.57 1.21 0.00 -1.26 -5.08 105.19 106.77 1mir n GLY 114 Ca -0.08 0.72 -0.39 0.00 0.00 0.00 0.00 46.02 46.27 1mir n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mir s ALA 115 N -1.00 2.09 0.38 4.61 0.00 -1.26 -4.86 121.76 121.72 1mir s ALA 115 Ca 0.00 0.26 0.17 0.00 0.00 0.00 0.00 51.96 52.39 1mir s ALA 115 Cb 0.00 -4.24 1.06 0.00 0.00 0.00 0.00 23.12 19.94 1mir s ALA 115 CO 0.00 -3.79 1.77 0.00 0.00 0.00 0.00 175.76 173.74 1mir h ARG 116 N 17.53 0.42 -5.10 0.00 2.47 -2.00 -3.42 114.38 124.28 1mir h ARG 116 Ca -0.31 -0.03 -0.41 0.00 -1.26 0.00 0.00 59.98 57.98 1mir h ARG 116 Cb 1.25 -0.09 -0.08 0.00 -1.65 0.00 0.00 29.97 29.39 1mir h ARG 116 CO 1.09 0.28 1.70 -0.35 0.56 0.00 0.00 179.97 183.25 1mir n PRO 117 N -4.66 0.16 -1.76 0.04 -0.04 -1.26 -4.79 135.00 122.69 1mir n PRO 117 Ca 0.25 -0.07 -0.41 0.00 -0.04 0.00 0.00 63.50 63.23 1mir n PRO 117 Cb 0.84 -1.74 -0.01 0.00 -0.04 0.00 0.00 33.50 32.56 1mir n PRO 117 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1mir n PRO 118 N 7.63 2.67 -1.76 0.54 -0.04 -1.26 -4.92 135.00 137.85 1mir n PRO 118 Ca 0.62 0.94 -0.41 0.00 -0.04 0.00 0.00 63.50 64.61 1mir n PRO 118 Cb 0.16 -2.69 -0.01 0.00 -0.04 0.00 0.00 33.50 30.92 1mir n PRO 118 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mir s THR 120 N -0.78 -0.26 -0.76 0.00 -1.32 -1.26 -0.43 115.64 110.83 1mir s THR 120 Ca 0.57 0.30 -0.26 0.00 -1.21 0.00 0.00 61.69 61.09 1mir s THR 120 Cb -0.49 -0.34 -0.14 0.00 -1.51 0.00 0.00 72.50 70.03 1mir s THR 120 CO 0.59 0.12 2.42 0.61 -2.21 0.00 0.00 174.62 176.15 1mir n GLY 121 N 5.12 -0.12 0.00 6.08 0.00 -1.24 -4.77 105.19 110.26 1mir n GLY 121 Ca -0.09 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1mir n GLY 121 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1mir n GLU 122 N 8.78 1.39 -0.15 1.61 -0.58 -1.25 -4.70 120.64 125.75 1mir n GLU 122 Ca 0.46 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 57.22 1mir n GLU 122 Cb 0.44 0.00 -0.01 0.00 -0.57 0.00 0.00 31.44 31.30 1mir n GLU 122 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1mir n GLY 123 N 1.74 -2.49 3.34 0.62 0.00 -1.26 -4.70 105.19 102.44 1mir n GLY 123 Ca 0.00 -1.42 -0.19 0.00 0.00 0.00 0.00 46.02 44.41 1mir n GLY 123 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1mir s ASP 124 N -4.61 2.55 -0.06 1.61 1.11 -1.26 -5.04 116.67 110.96 1mir s ASP 124 Ca 0.00 -0.98 -0.30 0.00 0.18 0.00 0.00 52.55 51.46 1mir s ASP 124 Cb 0.00 -0.13 -0.06 0.00 1.07 0.00 0.00 42.92 43.79 1mir s ASP 124 CO 0.00 -0.14 1.79 -0.89 1.18 0.00 0.00 175.17 177.11 1mir s THR 125 N -2.75 3.38 0.91 -1.27 2.01 -1.26 -4.95 115.64 111.71 1mir s THR 125 Ca 0.20 0.45 -0.10 0.00 0.31 0.00 0.00 61.69 62.54 1mir s THR 125 Cb -0.02 -3.32 0.14 0.00 0.01 0.00 0.00 72.50 69.31 1mir s THR 125 CO 0.06 -0.07 1.12 -0.81 -0.69 0.00 0.00 174.62 174.23 1mir n PRO 126 N 7.47 -0.39 -2.35 4.92 -0.04 -1.26 -4.96 135.00 138.39 1mir n PRO 126 Ca 0.19 -0.05 -0.40 0.00 -0.04 0.00 0.00 63.50 63.20 1mir n PRO 126 Cb 0.43 -2.36 -0.04 0.00 -0.04 0.00 0.00 33.50 31.49 1mir n PRO 126 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1mir s LYS 127 N -4.53 4.54 -1.02 0.54 2.20 -1.26 -4.72 119.74 115.49 1mir s LYS 127 Ca 0.67 1.94 -0.24 0.00 -0.36 0.00 0.00 55.97 57.98 1mir s LYS 127 Cb -0.24 -3.16 -0.10 0.00 -1.51 0.00 0.00 37.83 32.83 1mir s LYS 127 CO 0.58 0.06 2.03 0.00 -0.36 0.00 0.00 175.35 177.66 1mir s ASN 129 N 7.93 6.69 -1.12 0.00 2.47 -1.26 -4.91 114.94 124.74 1mir s ASN 129 Ca 0.74 -2.07 -0.25 0.00 0.42 0.00 0.00 52.86 51.69 1mir s ASN 129 Cb -0.05 -2.47 -0.18 0.00 -1.45 0.00 0.00 41.25 37.09 1mir s ASN 129 CO 0.08 -1.16 2.04 0.29 -3.72 0.00 0.00 177.10 174.64 1mir n LYS 130 N 7.34 0.68 -3.45 0.43 5.02 -1.26 -4.70 118.16 122.22 1mir n LYS 130 Ca 0.32 -2.00 0.01 0.00 -2.02 0.00 0.00 58.31 54.62 1mir n LYS 130 Cb 0.48 -3.86 -0.04 0.00 -0.02 0.00 0.00 35.03 31.59 1mir n LYS 130 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1mir s MET 131 N 7.74 0.32 0.50 1.97 1.75 -1.26 -4.94 119.30 125.39 1mir s MET 131 Ca 0.77 0.78 -0.23 0.00 -1.25 0.00 0.00 55.69 55.76 1mir s MET 131 Cb -0.03 0.44 -0.06 0.00 2.84 0.00 0.00 34.83 38.01 1mir s MET 131 CO 0.17 -0.11 1.32 0.00 -0.65 0.00 0.00 175.02 175.76 1mir n GLU 133 N -0.70 2.08 -1.67 0.00 2.13 0.04 -4.83 120.64 117.70 1mir n GLU 133 Ca 0.08 0.75 -0.52 0.00 0.66 0.00 0.00 57.16 58.13 1mir n GLU 133 Cb 0.45 -2.46 -0.06 0.00 0.27 0.00 0.00 31.44 29.64 1mir n GLU 133 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1mir n ALA 134 N 2.71 0.09 0.00 4.31 0.00 -1.26 -1.57 120.51 124.78 1mir n ALA 134 Ca 0.14 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.99 1mir n ALA 134 Cb 0.30 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.48 1mir n ALA 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mir n GLY 135 N 3.73 1.57 3.66 0.00 0.00 -1.26 -5.07 105.19 107.81 1mir n GLY 135 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1mir n GLY 135 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1mir s TYR 136 N -1.57 3.36 -0.56 1.61 5.04 -0.61 -4.95 117.35 119.67 1mir s TYR 136 Ca 0.00 1.33 -0.07 0.00 -2.44 0.00 0.00 57.07 55.89 1mir s TYR 136 Cb 0.00 -3.14 -0.21 0.00 0.35 0.00 0.00 41.96 38.96 1mir s TYR 136 CO 0.00 -0.38 3.39 -1.13 -1.34 0.00 0.00 175.55 176.09 1mir n SER 137 N 5.87 6.44 -3.65 4.32 3.41 -1.26 -4.81 113.62 123.94 1mir n SER 137 Ca 0.08 -2.51 0.02 0.00 -0.26 0.00 0.00 58.87 56.20 1mir n SER 137 Cb 0.47 -1.46 -0.06 0.00 -0.26 0.00 0.00 64.21 62.90 1mir n SER 137 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1mir s THR 138 N 1.42 0.00 0.18 6.66 -1.32 -1.26 -5.15 115.64 116.17 1mir s THR 138 Ca 0.68 0.00 -0.33 0.00 -1.21 0.00 0.00 61.69 60.83 1mir s THR 138 Cb 0.27 -1.00 -0.14 0.00 -1.51 0.00 0.00 72.50 70.12 1mir s THR 138 CO -0.02 0.00 1.47 -1.54 -2.21 0.00 0.00 174.62 172.31 1mir n SER 139 N 2.78 2.70 -0.29 8.08 3.41 -1.26 -4.82 113.62 124.22 1mir n SER 139 Ca -0.16 1.11 -0.04 0.00 -0.26 0.00 0.00 58.87 59.52 1mir n SER 139 Cb 0.56 -1.39 0.01 0.00 -0.26 0.00 0.00 64.21 63.14 1mir n SER 139 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1mir h TYR 140 N 5.02 -1.10 -0.95 7.33 5.03 -1.95 0.78 116.97 131.13 1mir h TYR 140 Ca -0.45 0.09 0.18 0.00 2.58 0.00 0.00 58.73 61.13 1mir h TYR 140 Cb 1.28 0.60 -0.08 0.00 1.55 0.00 0.00 36.73 40.07 1mir h TYR 140 CO 0.60 -0.40 0.60 -0.22 -1.32 0.00 0.00 178.16 177.42 1mir h LYS 141 N -0.10 0.62 -0.62 1.82 3.64 -1.93 0.21 116.57 120.20 1mir h LYS 141 Ca 0.27 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1mir h LYS 141 Cb 0.57 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1mir h LYS 141 CO -0.83 0.41 0.00 0.39 -2.27 0.00 0.00 179.45 177.15 1mir n GLU 142 N -4.62 2.51 -0.00 1.90 1.02 0.26 -3.69 120.64 118.03 1mir n GLU 142 Ca 0.21 -1.48 0.02 0.00 -0.02 0.00 0.00 57.16 55.89 1mir n GLU 142 Cb 0.59 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 30.33 1mir n GLU 142 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1mir n ASP 143 N 0.42 2.96 -4.65 1.62 2.03 0.70 -4.84 116.55 114.80 1mir n ASP 143 Ca 0.13 -0.16 -0.53 0.00 0.52 0.00 0.00 54.79 54.74 1mir n ASP 143 Cb 0.56 1.15 -0.06 0.00 -0.72 0.00 0.00 41.12 42.04 1mir n ASP 143 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1mir n LYS 144 N -1.50 1.28 -3.92 -0.67 4.76 -1.11 -4.33 118.16 112.67 1mir n LYS 144 Ca -0.00 0.47 -0.36 0.00 -2.87 0.00 0.00 58.31 55.55 1mir n LYS 144 Cb 0.10 -2.14 -0.12 0.00 -1.84 0.00 0.00 35.03 31.03 1mir n LYS 144 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 1mir s HIS 145 N 1.85 3.12 0.38 2.13 3.76 0.49 -4.85 115.29 122.18 1mir s HIS 145 Ca 0.90 -0.26 0.08 0.00 -0.15 0.00 0.00 55.06 55.62 1mir s HIS 145 Cb -0.96 -2.15 -0.03 0.00 1.11 0.00 0.00 32.58 30.55 1mir s HIS 145 CO 0.53 -0.17 0.31 0.71 -0.85 0.00 0.00 174.74 175.28 1mir s TYR 146 N 1.09 2.76 0.08 1.40 2.02 -1.26 -2.01 117.35 121.43 1mir s TYR 146 Ca 0.04 -0.43 0.07 0.00 -0.37 0.00 0.00 57.07 56.38 1mir s TYR 146 Cb -0.14 -1.99 -0.03 0.00 -0.40 0.00 0.00 41.96 39.40 1mir s TYR 146 CO 0.03 0.04 -0.18 0.20 -1.57 0.00 0.00 175.55 174.06 1mir s GLY 147 N -4.04 1.09 0.05 0.71 0.00 -1.21 -1.77 107.32 102.15 1mir s GLY 147 Ca 0.44 -1.13 -0.23 0.00 0.00 0.00 0.00 44.72 43.80 1mir s GLY 147 CO 0.27 -1.13 1.51 -0.97 0.00 0.00 0.00 173.10 172.78 1mir h TYR 148 N 4.26 0.12 -1.65 1.90 0.05 -1.08 -3.40 116.97 117.16 1mir h TYR 148 Ca -0.44 -0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.38 1mir h TYR 148 Cb 1.18 -0.03 -0.22 0.00 1.01 0.00 0.00 36.73 38.67 1mir h TYR 148 CO 0.60 0.33 0.47 0.95 -1.05 0.00 0.00 178.16 179.46 1mir s THR 149 N -5.19 0.00 0.09 -2.88 -4.23 -1.26 -5.00 115.64 97.17 1mir s THR 149 Ca -0.14 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.43 1mir s THR 149 Cb 0.05 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.85 1mir s THR 149 CO 0.69 0.00 -0.07 -0.94 -0.54 0.00 0.00 174.62 173.76 1mir s SER 150 N -1.08 4.59 0.19 3.99 1.04 -1.26 -2.90 113.70 118.26 1mir s SER 150 Ca -0.03 -0.30 -0.10 0.00 0.48 0.00 0.00 55.95 55.99 1mir s SER 150 Cb -0.00 -0.96 -0.01 0.00 0.10 0.00 0.00 66.02 65.15 1mir s SER 150 CO 0.03 0.19 0.33 -0.72 0.98 0.00 0.00 173.24 174.05 1mir s TYR 151 N -1.21 0.39 0.33 5.02 -0.85 0.31 -4.76 117.35 116.58 1mir s TYR 151 Ca 0.22 -0.75 -0.06 0.00 -0.52 0.00 0.00 57.07 55.96 1mir s TYR 151 Cb -0.11 -0.00 -0.05 0.00 0.38 0.00 0.00 41.96 42.17 1mir s TYR 151 CO 0.14 -0.79 0.62 -1.12 -1.52 0.00 0.00 175.55 172.89 1mir s SER 152 N -2.98 6.46 -0.12 -0.18 0.01 -0.68 -1.85 113.70 114.36 1mir s SER 152 Ca 0.19 0.83 0.03 0.00 1.31 0.00 0.00 55.95 58.31 1mir s SER 152 Cb 0.02 -2.19 0.01 0.00 0.21 0.00 0.00 66.02 64.06 1mir s SER 152 CO 0.02 -0.27 -0.22 -0.69 0.41 0.00 0.00 173.24 172.49 1mir s VAL 153 N -2.19 2.00 1.02 3.43 1.01 -0.28 -1.29 120.40 124.09 1mir s VAL 153 Ca 0.46 -0.96 -0.16 0.00 0.00 0.00 0.00 61.98 61.32 1mir s VAL 153 Cb -0.11 -1.75 0.02 0.00 0.00 0.00 0.00 36.38 34.55 1mir s VAL 153 CO 0.31 0.54 -0.02 -1.54 0.00 0.00 0.00 175.10 174.39 1mir n SER 154 N 3.83 -2.73 -1.57 3.32 3.41 -1.26 -4.30 113.62 114.31 1mir n SER 154 Ca -0.20 0.14 -0.09 0.00 -0.26 0.00 0.00 58.87 58.46 1mir n SER 154 Cb 0.52 -1.02 0.04 0.00 -0.26 0.00 0.00 64.21 63.49 1mir n SER 154 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1mir n ASP 155 N -0.50 4.74 -4.55 4.04 5.75 -1.26 -4.58 116.55 120.19 1mir n ASP 155 Ca 0.03 -2.67 -0.41 0.00 -0.01 0.00 0.00 54.79 51.73 1mir n ASP 155 Cb 0.58 -0.86 -0.08 0.00 -1.03 0.00 0.00 41.12 39.73 1mir n ASP 155 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1mir s SER 156 N 0.59 6.26 0.28 -1.12 0.15 -1.26 -4.95 113.70 113.65 1mir s SER 156 Ca 0.19 -0.15 -0.04 0.00 0.70 0.00 0.00 55.95 56.65 1mir s SER 156 Cb 0.15 -2.24 0.56 0.00 -1.71 0.00 0.00 66.02 62.78 1mir s SER 156 CO 0.01 -0.44 1.59 -0.08 1.20 0.00 0.00 173.24 175.53 1mir h GLU 157 N 8.48 0.04 -0.29 5.44 4.81 -1.90 0.26 114.58 131.42 1mir h GLU 157 Ca -0.28 -0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 58.82 1mir h GLU 157 Cb 1.13 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1mir h GLU 157 CO 0.75 0.02 -0.33 -0.22 -0.73 0.00 0.00 179.01 178.50 1mir h LYS 158 N 0.04 0.62 -0.31 1.92 3.64 -1.97 -2.36 116.57 118.15 1mir h LYS 158 Ca 0.50 -0.28 -0.05 0.00 -1.27 0.00 0.00 60.65 59.55 1mir h LYS 158 Cb 0.91 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1mir h LYS 158 CO -0.85 0.87 0.01 0.93 -2.27 0.00 0.00 179.45 178.14 1mir h GLU 159 N 0.53 0.53 -0.97 1.90 4.39 -0.90 -1.29 114.58 118.77 1mir h GLU 159 Ca 0.06 -0.16 0.02 0.00 0.34 0.00 0.00 59.36 59.61 1mir h GLU 159 Cb 0.82 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 29.37 1mir h GLU 159 CO 0.07 0.66 0.64 0.82 -1.16 0.00 0.00 179.01 180.05 1mir h ILE 160 N 0.33 1.23 -0.49 3.13 2.04 -1.17 -1.09 117.51 121.50 1mir h ILE 160 Ca 0.09 -0.45 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 1mir h ILE 160 Cb 0.42 -0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 1mir h ILE 160 CO 0.01 0.24 0.30 0.24 0.00 0.00 0.00 178.15 178.94 1mir h MET 161 N 1.30 0.66 -0.33 2.37 2.86 -1.15 -1.52 114.93 119.13 1mir h MET 161 Ca 0.36 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.93 1mir h MET 161 Cb -0.12 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.38 1mir h MET 161 CO -0.09 0.47 0.15 0.00 1.06 0.00 0.00 176.91 178.50 1mir h ALA 162 N 1.15 0.42 -0.66 6.32 0.00 -0.63 -1.59 119.26 124.27 1mir h ALA 162 Ca 0.18 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.03 1mir h ALA 162 Cb -0.02 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 1mir h ALA 162 CO -0.03 0.00 0.37 1.49 0.00 0.00 0.00 179.25 181.07 1mir h GLU 163 N 0.39 0.66 -0.16 0.00 4.57 -0.86 0.12 114.58 119.31 1mir h GLU 163 Ca 0.11 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.21 1mir h GLU 163 Cb 0.14 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.58 1mir h GLU 163 CO -0.01 0.44 -0.08 0.82 -1.18 0.00 0.00 179.01 179.00 1mir h ILE 164 N 0.68 1.31 -0.71 2.32 2.04 -1.17 0.13 117.51 122.11 1mir h ILE 164 Ca 0.29 -1.12 -0.04 0.00 1.00 0.00 0.00 64.86 64.99 1mir h ILE 164 Cb 0.17 1.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 1mir h ILE 164 CO -0.18 0.33 0.29 0.22 0.00 0.00 0.00 178.15 178.81 1mir h TYR 165 N -0.00 1.06 0.00 1.37 5.03 -0.92 0.57 116.97 124.08 1mir h TYR 165 Ca 0.03 -0.07 -0.22 0.00 2.58 0.00 0.00 58.73 61.06 1mir h TYR 165 Cb 0.55 -0.32 -0.03 0.00 1.55 0.00 0.00 36.73 38.47 1mir h TYR 165 CO 0.07 0.81 -1.22 -0.22 -1.32 0.00 0.00 178.16 176.28 1mir h LYS 166 N 1.03 0.00 0.00 1.82 1.63 -0.78 -3.42 116.57 116.85 1mir h LYS 166 Ca 0.24 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.04 1mir h LYS 166 Cb 0.19 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.82 1mir h LYS 166 CO -0.02 0.95 -1.51 0.09 -3.45 0.00 0.00 179.45 175.51 1mir n ASN 167 N -4.44 0.57 0.00 4.20 3.02 0.42 -5.08 115.26 113.95 1mir n ASN 167 Ca -0.31 -0.42 0.00 0.00 -0.03 0.00 0.00 54.58 53.82 1mir n ASN 167 Cb 0.66 1.53 0.00 0.00 -0.61 0.00 0.00 39.78 41.36 1mir n ASN 167 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mir n GLY 168 N 1.39 0.91 3.60 7.41 0.00 0.19 -4.85 105.19 113.84 1mir n GLY 168 Ca -0.00 -2.31 -0.39 0.00 0.00 0.00 0.00 46.02 43.32 1mir n GLY 168 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1mir n PRO 169 N -0.92 0.97 -4.21 1.61 -0.02 -1.26 -3.86 135.00 127.30 1mir n PRO 169 Ca 0.00 0.37 -0.14 0.00 -2.02 0.00 0.00 63.50 61.71 1mir n PRO 169 Cb 0.00 -2.08 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 1mir n PRO 169 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1mir s VAL 170 N -1.48 1.05 0.30 -1.45 -7.23 -0.66 -4.84 120.40 106.09 1mir s VAL 170 Ca 0.72 -1.87 -0.12 0.00 -1.81 0.00 0.00 61.98 58.89 1mir s VAL 170 Cb -0.45 -1.63 -0.08 0.00 0.56 0.00 0.00 36.38 34.78 1mir s VAL 170 CO 0.51 -0.67 0.67 -0.70 -0.31 0.00 0.00 175.10 174.59 1mir s GLU 171 N -3.33 3.90 -0.02 4.82 2.12 -0.63 -0.34 118.70 125.22 1mir s GLU 171 Ca 0.12 0.49 -0.29 0.00 0.36 0.00 0.00 54.97 55.64 1mir s GLU 171 Cb 0.00 -2.51 0.08 0.00 0.26 0.00 0.00 34.13 31.96 1mir s GLU 171 CO -0.00 0.20 0.72 0.20 -0.54 0.00 0.00 175.26 175.84 1mir s GLY 172 N -2.41 -0.54 0.26 -1.50 0.00 0.04 -1.32 107.32 101.86 1mir s GLY 172 Ca 0.51 1.25 0.09 0.00 0.00 0.00 0.00 44.72 46.57 1mir s GLY 172 CO 0.20 0.79 -0.14 0.00 0.00 0.00 0.00 173.10 173.95 1mir s ALA 173 N -1.77 2.45 0.27 3.20 0.00 -1.25 0.75 121.76 125.40 1mir s ALA 173 Ca -0.06 -1.83 -0.14 0.00 0.00 0.00 0.00 51.96 49.93 1mir s ALA 173 Cb -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.03 1mir s ALA 173 CO 0.03 0.12 0.54 -0.59 0.00 0.00 0.00 175.76 175.86 1mir s PHE 174 N -2.78 0.31 0.03 0.00 -0.71 0.15 -4.13 117.98 110.85 1mir s PHE 174 Ca 0.28 -0.70 -0.25 0.00 -1.04 0.00 0.00 56.93 55.21 1mir s PHE 174 Cb -0.01 0.30 -0.05 0.00 -1.21 0.00 0.00 43.02 42.05 1mir s PHE 174 CO 0.12 -1.09 0.78 0.99 -1.34 0.00 0.00 175.22 174.68 1mir s THR 175 N -3.81 4.78 -0.17 -4.49 2.01 -0.50 -0.50 115.64 112.96 1mir s THR 175 Ca 0.21 1.65 -0.08 0.00 0.31 0.00 0.00 61.69 63.77 1mir s THR 175 Cb -0.02 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.32 1mir s THR 175 CO 0.10 0.33 0.11 -0.69 -0.69 0.00 0.00 174.62 173.78 1mir s VAL 176 N 0.14 5.21 0.09 3.82 1.01 0.64 -4.92 120.40 126.38 1mir s VAL 176 Ca 0.40 0.11 0.09 0.00 0.00 0.00 0.00 61.98 62.57 1mir s VAL 176 Cb -0.20 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 1mir s VAL 176 CO 0.23 0.50 -0.20 -0.36 0.00 0.00 0.00 175.10 175.27 1mir s PHE 177 N -0.08 2.49 0.09 5.22 0.08 -1.26 0.02 117.98 124.55 1mir s PHE 177 Ca 0.09 -0.29 -0.18 0.00 0.12 0.00 0.00 56.93 56.67 1mir s PHE 177 Cb -0.12 -1.38 -0.04 0.00 -0.57 0.00 0.00 43.02 40.92 1mir s PHE 177 CO 0.00 0.31 0.98 0.43 -0.10 0.00 0.00 175.22 176.84 1mir n SER 178 N 1.16 -0.62 0.04 1.36 7.64 -0.05 -0.36 113.62 122.79 1mir n SER 178 Ca -0.16 1.12 0.21 0.00 1.01 0.00 0.00 58.87 61.05 1mir n SER 178 Cb 0.52 -0.17 0.73 0.00 -1.01 0.00 0.00 64.21 64.29 1mir n SER 178 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 1mir h ASP 179 N 0.00 0.00 -0.95 6.43 2.03 -1.85 0.48 116.42 122.55 1mir h ASP 179 Ca 0.09 0.00 0.07 0.00 -0.73 0.00 0.00 57.03 56.46 1mir h ASP 179 Cb 0.24 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.68 1mir h ASP 179 CO -0.55 0.00 0.62 0.15 -1.03 0.00 0.00 179.24 178.43 1mir h PHE 180 N 0.00 1.12 -0.39 4.15 3.57 -1.00 0.08 116.94 124.47 1mir h PHE 180 Ca 0.23 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.87 1mir h PHE 180 Cb 1.16 -0.37 -0.02 0.00 2.79 0.00 0.00 35.95 39.51 1mir h PHE 180 CO 0.00 0.57 0.49 -0.07 -2.23 0.00 0.00 178.31 177.07 1mir h LEU 181 N 1.09 0.00 -2.42 0.59 3.38 -1.00 0.71 115.31 117.65 1mir h LEU 181 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 1mir h LEU 181 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1mir h LEU 181 CO -0.16 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.72 1mir n THR 182 N -3.54 0.80 -1.63 0.22 -2.24 0.01 -4.36 114.28 103.53 1mir n THR 182 Ca 0.07 -0.86 -0.47 0.00 -2.27 0.00 0.00 64.05 60.52 1mir n THR 182 Cb 0.65 0.58 -0.04 0.00 -2.10 0.00 0.00 70.33 69.42 1mir n THR 182 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mir n TYR 183 N 1.46 1.81 0.00 4.78 9.36 0.24 -0.39 117.16 134.42 1mir n TYR 183 Ca 0.22 0.52 0.00 0.00 3.32 0.00 0.00 57.90 61.96 1mir n TYR 183 Cb 0.58 -2.39 0.00 0.00 -0.63 0.00 0.00 39.34 36.89 1mir n TYR 183 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1mir n LYS 184 N 2.19 0.20 -3.91 2.98 4.76 -0.25 -3.98 118.16 120.14 1mir n LYS 184 Ca 0.14 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.56 1mir n LYS 184 Cb 0.27 -0.91 0.02 0.00 -1.84 0.00 0.00 35.03 32.57 1mir n LYS 184 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1mir s SER 185 N -3.75 0.01 0.00 4.39 1.04 -0.92 -3.60 113.70 110.87 1mir s SER 185 Ca 0.00 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.78 1mir s SER 185 Cb 0.00 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.59 1mir s SER 185 CO 0.00 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 173.90 1mir n GLY 186 N -0.74 -1.75 3.24 7.32 0.00 -1.26 -0.52 105.19 111.47 1mir n GLY 186 Ca -0.02 -1.53 -0.40 0.00 0.00 0.00 0.00 46.02 44.07 1mir n GLY 186 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mir s VAL 187 N 0.00 4.09 -0.04 1.61 1.01 0.50 -4.07 120.40 123.49 1mir s VAL 187 Ca 0.00 -1.57 -0.34 0.00 0.00 0.00 0.00 61.98 60.07 1mir s VAL 187 Cb 0.00 -3.58 -0.12 0.00 0.00 0.00 0.00 36.38 32.69 1mir s VAL 187 CO 0.00 -0.58 1.85 0.00 0.00 0.00 0.00 175.10 176.37 1mir n TYR 188 N 4.87 2.35 -3.54 5.22 9.36 0.43 -3.49 117.16 132.36 1mir n TYR 188 Ca -0.09 -0.02 -0.29 0.00 3.32 0.00 0.00 57.90 60.83 1mir n TYR 188 Cb 0.42 -2.67 -0.14 0.00 -0.63 0.00 0.00 39.34 36.32 1mir n TYR 188 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 1mir s LYS 189 N 3.70 0.40 -0.22 2.98 2.20 -1.26 -1.90 119.74 125.65 1mir s LYS 189 Ca 0.90 -0.90 -0.19 0.00 -0.36 0.00 0.00 55.97 55.43 1mir s LYS 189 Cb -0.66 -1.33 -0.08 0.00 -1.51 0.00 0.00 37.83 34.25 1mir s LYS 189 CO 0.49 -1.08 0.88 1.58 -0.36 0.00 0.00 175.35 176.85 1mir n HIS 190 N 4.76 0.56 -0.07 4.03 -0.00 -1.26 -4.84 115.22 118.40 1mir n HIS 190 Ca 0.01 0.37 -0.08 0.00 -0.00 0.00 0.00 57.72 58.02 1mir n HIS 190 Cb 0.40 -0.99 -0.09 0.00 -0.00 0.00 0.00 29.99 29.31 1mir n HIS 190 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 1mir n GLU 191 N 2.93 1.50 -3.83 1.57 4.07 -1.26 -5.10 120.64 120.52 1mir n GLU 191 Ca 0.22 0.02 -0.06 0.00 -0.06 0.00 0.00 57.16 57.28 1mir n GLU 191 Cb -0.02 -1.32 0.01 0.00 -0.06 0.00 0.00 31.44 30.05 1mir n GLU 191 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1mir s ALA 192 N -2.31 -1.25 0.00 4.31 0.00 -1.26 -5.07 121.76 116.18 1mir s ALA 192 Ca -0.11 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.45 1mir s ALA 192 Cb 0.04 0.72 0.00 0.00 0.00 0.00 0.00 23.12 23.88 1mir s ALA 192 CO 0.47 -1.03 0.00 0.41 0.00 0.00 0.00 175.76 175.61 1mir n GLY 193 N -0.57 0.22 2.64 0.00 0.00 -1.26 -3.44 105.19 102.78 1mir n GLY 193 Ca -0.06 -1.73 -0.17 0.00 0.00 0.00 0.00 46.02 44.07 1mir n GLY 193 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1mir n ASP 194 N -0.85 0.74 -4.70 1.61 -0.08 -1.26 -4.62 116.55 107.39 1mir n ASP 194 Ca 0.00 -1.68 -0.41 0.00 -1.51 0.00 0.00 54.79 51.19 1mir n ASP 194 Cb 0.00 -0.49 -0.04 0.00 2.34 0.00 0.00 41.12 42.93 1mir n ASP 194 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1mir s VAL 195 N -2.23 4.91 -0.10 5.18 1.01 -1.26 -0.87 120.40 127.04 1mir s VAL 195 Ca 0.46 1.79 -0.06 0.00 0.00 0.00 0.00 61.98 64.17 1mir s VAL 195 Cb -0.02 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 1mir s VAL 195 CO 0.31 0.14 -0.12 0.24 0.00 0.00 0.00 175.10 175.68 1mir h MET 196 N 6.92 0.00 0.00 2.72 2.86 -0.73 -3.47 114.93 123.23 1mir h MET 196 Ca -0.37 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 1mir h MET 196 Cb 1.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.85 1mir h MET 196 CO 0.78 0.00 0.00 0.41 1.06 0.00 0.00 176.91 179.16 1mir n GLY 197 N 1.66 -1.49 3.90 8.32 0.00 -1.21 -5.00 105.19 111.37 1mir n GLY 197 Ca -0.05 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.66 1mir n GLY 197 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mir s GLY 198 N 0.00 1.62 -0.28 -0.02 0.00 -1.25 -0.26 107.32 107.12 1mir s GLY 198 Ca 0.00 -0.61 -0.16 0.00 0.00 0.00 0.00 44.72 43.94 1mir s GLY 198 CO 0.00 -0.19 0.79 -1.58 0.00 0.00 0.00 173.10 172.12 1mir s HIS 199 N -3.41 -0.89 0.28 1.90 5.04 0.34 -3.74 115.29 114.81 1mir s HIS 199 Ca 0.60 1.79 0.02 0.00 -1.54 0.00 0.00 55.06 55.92 1mir s HIS 199 Cb -0.11 0.53 -0.03 0.00 0.04 0.00 0.00 32.58 33.01 1mir s HIS 199 CO 0.49 -0.44 0.45 0.00 -2.34 0.00 0.00 174.74 172.90 1mir s ALA 200 N 1.51 3.80 0.36 1.58 0.00 -1.26 0.31 121.76 128.07 1mir s ALA 200 Ca -0.09 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 50.75 1mir s ALA 200 Cb -0.05 -1.96 0.05 0.00 0.00 0.00 0.00 23.12 21.16 1mir s ALA 200 CO -0.18 0.16 0.68 0.44 0.00 0.00 0.00 175.76 176.86 1mir n ILE 201 N -1.43 0.00 -3.97 0.00 -6.64 0.23 -4.77 119.36 102.77 1mir n ILE 201 Ca -0.06 -1.04 -0.34 0.00 -1.77 0.00 0.00 62.75 59.53 1mir n ILE 201 Cb 0.56 0.93 -0.14 0.00 -1.44 0.00 0.00 39.64 39.55 1mir n ILE 201 CO 0.00 0.00 0.00 -0.60 -1.77 0.00 0.00 176.55 174.18 1mir s ARG 202 N -2.20 2.71 -0.09 6.28 3.52 -1.17 -0.78 118.95 127.22 1mir s ARG 202 Ca 0.17 -1.06 -0.23 0.00 -0.13 0.00 0.00 55.73 54.48 1mir s ARG 202 Cb -0.04 -2.98 -0.03 0.00 -1.56 0.00 0.00 34.95 30.33 1mir s ARG 202 CO 0.12 -0.44 0.67 0.42 -0.81 0.00 0.00 175.30 175.26 1mir s ILE 203 N 1.28 5.05 -0.03 4.11 1.01 0.54 -1.49 121.20 131.68 1mir s ILE 203 Ca -0.02 1.36 0.16 0.00 0.00 0.00 0.00 60.65 62.16 1mir s ILE 203 Cb -0.17 -4.01 0.29 0.00 0.01 0.00 0.00 42.46 38.58 1mir s ILE 203 CO -0.04 0.23 1.12 0.00 0.00 0.00 0.00 174.94 176.25 1mir n LEU 204 N 3.99 0.98 0.00 2.97 -0.00 -0.67 -1.65 117.00 122.63 1mir n LEU 204 Ca -0.02 -1.98 0.00 0.00 -0.00 0.00 0.00 56.01 54.01 1mir n LEU 204 Cb 0.51 -0.09 0.00 0.00 -0.00 0.00 0.00 43.42 43.84 1mir n LEU 204 CO 0.46 0.54 0.00 0.61 -0.00 0.00 0.00 177.39 179.00 1mir n GLY 205 N 0.03 -0.29 2.61 1.47 0.00 -1.22 -1.57 105.19 106.21 1mir n GLY 205 Ca 0.06 -1.25 -0.09 0.00 0.00 0.00 0.00 46.02 44.74 1mir n GLY 205 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1mir n TRP 206 N -0.92 -1.50 -3.24 1.61 2.14 -0.84 -0.46 117.44 114.23 1mir n TRP 206 Ca 0.00 -1.61 0.00 0.00 2.07 0.00 0.00 57.50 57.96 1mir n TRP 206 Cb 0.00 0.51 0.00 0.00 -0.81 0.00 0.00 31.31 31.01 1mir n TRP 206 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1mir n GLY 207 N -0.42 -1.49 2.92 -1.67 0.00 -0.83 -1.96 105.19 101.74 1mir n GLY 207 Ca -0.02 -1.13 -0.22 0.00 0.00 0.00 0.00 46.02 44.65 1mir n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mir s ILE 208 N -2.87 0.70 -0.10 -0.61 1.01 -1.26 -1.29 121.20 116.78 1mir s ILE 208 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 60.65 60.44 1mir s ILE 208 Cb 0.00 -0.71 0.03 0.00 0.01 0.00 0.00 42.46 41.79 1mir s ILE 208 CO 0.00 0.27 -0.04 -0.70 0.00 0.00 0.00 174.94 174.47 1mir s GLU 209 N 0.97 1.07 -1.42 2.79 2.12 -0.13 -4.78 118.70 119.33 1mir s GLU 209 Ca -0.10 -0.10 -0.08 0.00 0.36 0.00 0.00 54.97 55.05 1mir s GLU 209 Cb -0.14 -1.34 0.01 0.00 0.26 0.00 0.00 34.13 32.92 1mir s GLU 209 CO 0.00 -0.30 1.04 -1.71 -0.54 0.00 0.00 175.26 173.75 1mir n ASN 210 N 5.04 -6.33 0.00 -1.70 5.15 -1.26 -1.83 115.26 114.33 1mir n ASN 210 Ca -0.10 -0.48 0.00 0.00 -0.60 0.00 0.00 54.58 53.40 1mir n ASN 210 Cb 0.50 -5.01 0.00 0.00 -0.53 0.00 0.00 39.78 34.74 1mir n ASN 210 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1mir n GLY 211 N -1.89 2.25 3.69 8.20 0.00 -1.26 -4.98 105.19 111.20 1mir n GLY 211 Ca -0.02 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1mir n GLY 211 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mir s VAL 212 N -0.57 4.35 0.39 1.61 1.01 -0.76 -5.01 120.40 121.42 1mir s VAL 212 Ca 0.00 1.67 -0.24 0.00 0.00 0.00 0.00 61.98 63.41 1mir s VAL 212 Cb 0.00 -4.07 -0.09 0.00 0.00 0.00 0.00 36.38 32.21 1mir s VAL 212 CO 0.00 0.03 1.04 -2.16 0.00 0.00 0.00 175.10 174.01 1mir s PRO 213 N 1.90 4.20 0.02 2.72 0.04 -1.26 -0.96 135.00 141.66 1mir s PRO 213 Ca 0.55 1.48 -0.12 0.00 0.04 0.00 0.00 61.00 62.95 1mir s PRO 213 Cb -0.24 -2.55 0.02 0.00 0.04 0.00 0.00 34.50 31.76 1mir s PRO 213 CO 0.23 -0.10 0.26 1.52 0.04 0.00 0.00 177.00 178.95 1mir s TYR 214 N -1.67 -0.08 -0.09 0.56 -0.85 -0.41 -0.57 117.35 114.23 1mir s TYR 214 Ca 0.57 0.01 -0.12 0.00 -0.52 0.00 0.00 57.07 57.01 1mir s TYR 214 Cb -0.21 0.05 -0.05 0.00 0.38 0.00 0.00 41.96 42.13 1mir s TYR 214 CO 0.27 -0.42 0.28 -1.58 -1.52 0.00 0.00 175.55 172.57 1mir s TRP 215 N -2.00 3.59 -0.39 -3.49 0.52 0.39 -1.97 118.94 115.59 1mir s TRP 215 Ca -0.09 0.70 -0.22 0.00 0.02 0.00 0.00 56.10 56.51 1mir s TRP 215 Cb -0.03 -2.19 0.01 0.00 -1.15 0.00 0.00 33.47 30.11 1mir s TRP 215 CO -0.00 0.53 0.74 -1.17 0.02 0.00 0.00 176.95 177.07 1mir s LEU 216 N -0.53 4.22 0.01 2.99 2.96 0.40 -2.16 118.68 126.57 1mir s LEU 216 Ca 0.18 0.14 0.07 0.00 -0.22 0.00 0.00 54.13 54.30 1mir s LEU 216 Cb -0.14 -2.93 -0.03 0.00 0.50 0.00 0.00 46.19 43.59 1mir s LEU 216 CO 0.07 -0.75 -0.20 -0.69 -1.32 0.00 0.00 176.35 173.46 1mir s VAL 217 N 3.03 2.63 -0.24 1.68 1.01 0.07 -1.67 120.40 126.92 1mir s VAL 217 Ca 0.29 -1.11 -0.06 0.00 0.00 0.00 0.00 61.98 61.09 1mir s VAL 217 Cb -0.13 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1mir s VAL 217 CO 0.18 0.43 0.04 0.00 0.00 0.00 0.00 175.10 175.75 1mir s ALA 218 N -0.82 3.10 0.28 5.51 0.00 -0.55 -0.41 121.76 128.87 1mir s ALA 218 Ca 0.13 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 50.99 1mir s ALA 218 Cb -0.10 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 21.00 1mir s ALA 218 CO 0.03 -0.40 0.47 1.21 0.00 0.00 0.00 175.76 177.06 1mir s ASN 219 N 1.46 6.34 -0.59 0.00 3.84 -0.53 -3.07 114.94 122.39 1mir s ASN 219 Ca 0.05 0.38 0.02 0.00 0.21 0.00 0.00 52.86 53.53 1mir s ASN 219 Cb -0.15 -2.00 0.40 0.00 -0.55 0.00 0.00 41.25 38.95 1mir s ASN 219 CO 0.02 -0.17 1.53 -1.54 -2.79 0.00 0.00 177.10 174.15 1mir n SER 220 N -1.33 6.01 -1.89 -4.21 3.41 -1.26 -4.64 113.62 109.71 1mir n SER 220 Ca -0.05 -3.77 -0.22 0.00 -0.26 0.00 0.00 58.87 54.56 1mir n SER 220 Cb 0.55 -0.71 0.08 0.00 -0.26 0.00 0.00 64.21 63.88 1mir n SER 220 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1mir n TRP 221 N -0.57 2.47 -0.34 7.33 8.01 -1.25 -2.78 117.44 130.31 1mir n TRP 221 Ca 0.47 -2.29 0.00 0.00 -1.31 0.00 0.00 57.50 54.37 1mir n TRP 221 Cb 0.54 -0.70 0.00 0.00 -2.01 0.00 0.00 31.31 29.14 1mir n TRP 221 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.69 174.97 1mir n ASN 222 N -0.88 -2.47 0.09 -0.99 2.85 -1.11 -4.29 115.26 108.46 1mir n ASN 222 Ca 0.47 0.29 0.03 0.00 -0.11 0.00 0.00 54.58 55.26 1mir n ASN 222 Cb 0.91 -0.24 0.18 0.00 1.24 0.00 0.00 39.78 41.86 1mir n ASN 222 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1mir n ALA 223 N -1.11 0.54 1.13 5.20 0.00 -1.26 -1.53 120.51 123.47 1mir n ALA 223 Ca 0.00 0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.62 1mir n ALA 223 Cb 0.02 -0.62 0.19 0.00 0.00 0.00 0.00 19.45 19.03 1mir n ALA 223 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1mir n ASP 224 N -1.69 1.73 -4.79 0.00 8.00 -1.26 -3.09 116.55 115.45 1mir n ASP 224 Ca -0.00 -1.34 -0.39 0.00 0.71 0.00 0.00 54.79 53.76 1mir n ASP 224 Cb 0.31 0.27 -0.06 0.00 -0.02 0.00 0.00 41.12 41.62 1mir n ASP 224 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1mir s TRP 225 N -2.40 3.85 0.00 1.24 -0.00 -0.58 -4.81 118.94 116.24 1mir s TRP 225 Ca 0.23 1.53 0.00 0.00 -0.00 0.00 0.00 56.10 57.86 1mir s TRP 225 Cb 0.19 -2.69 0.00 0.00 -0.00 0.00 0.00 33.47 30.97 1mir s TRP 225 CO 0.51 0.50 0.00 0.41 -0.00 0.00 0.00 176.95 178.37 1mir n GLY 226 N 1.47 2.38 3.54 5.86 0.00 -1.26 -0.52 105.19 116.66 1mir n GLY 226 Ca -0.06 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 1mir n GLY 226 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mir s ASP 227 N -4.00 6.83 -1.79 1.61 -1.08 -0.76 -4.35 116.67 113.13 1mir s ASP 227 Ca 0.00 -2.39 0.00 0.00 -0.52 0.00 0.00 52.55 49.64 1mir s ASP 227 Cb 0.00 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.94 1mir s ASP 227 CO 0.00 -1.11 0.00 0.59 0.52 0.00 0.00 175.17 175.17 1mir n ASN 228 N 7.62 -4.50 0.00 -0.34 4.13 -1.24 -0.90 115.26 120.02 1mir n ASN 228 Ca 0.41 0.41 0.00 0.00 1.68 0.00 0.00 54.58 57.08 1mir n ASN 228 Cb 0.46 -4.05 0.00 0.00 -1.54 0.00 0.00 39.78 34.65 1mir n ASN 228 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mir n GLY 229 N -0.34 1.97 4.01 7.41 0.00 0.32 -4.65 105.19 113.91 1mir n GLY 229 Ca -0.17 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.67 1mir n GLY 229 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mir s PHE 230 N -1.96 2.65 0.05 1.61 0.40 -0.08 -1.46 117.98 119.19 1mir s PHE 230 Ca 0.00 -0.41 -0.27 0.00 -0.60 0.00 0.00 56.93 55.65 1mir s PHE 230 Cb 0.00 -2.39 0.08 0.00 0.51 0.00 0.00 43.02 41.22 1mir s PHE 230 CO 0.00 -0.54 0.71 -0.59 0.70 0.00 0.00 175.22 175.49 1mir s PHE 231 N -2.42 -0.52 -0.03 0.36 -0.12 0.45 -1.82 117.98 113.89 1mir s PHE 231 Ca 0.56 0.53 0.03 0.00 -0.05 0.00 0.00 56.93 58.00 1mir s PHE 231 Cb -0.10 0.51 -0.03 0.00 -0.63 0.00 0.00 43.02 42.77 1mir s PHE 231 CO 0.34 -0.69 -0.10 0.15 -0.05 0.00 0.00 175.22 174.87 1mir s LYS 232 N -2.78 2.56 0.14 1.99 1.02 -1.26 -0.75 119.74 120.66 1mir s LYS 232 Ca -0.01 -0.69 0.07 0.00 0.02 0.00 0.00 55.97 55.36 1mir s LYS 232 Cb -0.01 -2.47 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 1mir s LYS 232 CO -0.05 0.62 -0.16 -1.50 -0.92 0.00 0.00 175.35 173.34 1mir s ILE 233 N -0.87 1.58 0.03 2.17 2.07 -0.92 -0.43 121.20 124.82 1mir s ILE 233 Ca 0.14 -1.81 -0.35 0.00 -1.41 0.00 0.00 60.65 57.22 1mir s ILE 233 Cb -0.11 -1.69 -0.14 0.00 0.13 0.00 0.00 42.46 40.66 1mir s ILE 233 CO 0.04 -0.36 1.66 -0.11 -1.91 0.00 0.00 174.94 174.26 1mir n LEU 234 N 0.42 2.94 -4.88 8.50 0.00 -0.80 -0.46 117.00 122.73 1mir n LEU 234 Ca -0.14 1.05 -0.34 0.00 0.00 0.00 0.00 56.01 56.58 1mir n LEU 234 Cb 0.57 -1.35 -0.05 0.00 0.00 0.00 0.00 43.42 42.59 1mir n LEU 234 CO 0.28 -0.33 -0.18 -0.60 0.00 0.00 0.00 177.39 176.56 1mir s ARG 235 N 2.14 3.37 0.00 1.96 3.52 0.26 -4.51 118.95 125.69 1mir s ARG 235 Ca 0.86 -0.32 0.00 0.00 -0.13 0.00 0.00 55.73 56.14 1mir s ARG 235 Cb -0.76 -3.07 0.00 0.00 -1.56 0.00 0.00 34.95 29.56 1mir s ARG 235 CO 0.46 0.69 0.00 0.41 -0.81 0.00 0.00 175.30 176.05 1mir n GLY 236 N 1.17 2.09 1.90 8.12 0.00 -1.26 -4.65 105.19 112.55 1mir n GLY 236 Ca -0.13 -0.67 -0.07 0.00 0.00 0.00 0.00 46.02 45.15 1mir n GLY 236 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1mir n GLU 237 N 0.00 1.41 -3.76 1.61 0.28 -1.26 -4.79 120.64 114.12 1mir n GLU 237 Ca 0.00 -0.56 -0.21 0.00 -0.16 0.00 0.00 57.16 56.24 1mir n GLU 237 Cb 0.00 -1.63 -0.01 0.00 1.43 0.00 0.00 31.44 31.24 1mir n GLU 237 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1mir n ASN 238 N 2.22 -1.32 -4.71 -1.84 5.15 -1.26 -4.82 115.26 108.69 1mir n ASN 238 Ca 0.24 -0.63 -0.42 0.00 -0.60 0.00 0.00 54.58 53.17 1mir n ASN 238 Cb 0.66 -0.76 -0.03 0.00 -0.53 0.00 0.00 39.78 39.12 1mir n ASN 238 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 1mir s HIS 239 N -4.13 3.27 -0.62 1.20 5.65 -1.26 -2.89 115.29 116.51 1mir s HIS 239 Ca 0.18 1.03 0.00 0.00 0.25 0.00 0.00 55.06 56.52 1mir s HIS 239 Cb -0.10 -3.62 0.00 0.00 -1.18 0.00 0.00 32.58 27.69 1mir s HIS 239 CO 0.47 -2.12 0.00 0.00 -0.65 0.00 0.00 174.74 172.45 1mir n GLY 241 N 0.32 0.45 0.39 0.00 0.00 -1.14 -1.42 105.19 103.80 1mir n GLY 241 Ca -0.06 -0.52 0.20 0.00 0.00 0.00 0.00 46.02 45.64 1mir n GLY 241 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1mir h ILE 242 N 0.00 0.35 -0.03 -0.61 6.09 -1.18 0.11 117.51 122.24 1mir h ILE 242 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1mir h ILE 242 Cb 0.00 0.63 0.00 0.00 0.47 0.00 0.00 36.82 37.92 1mir h ILE 242 CO 0.00 0.00 -0.01 -0.62 -3.07 0.00 0.00 178.15 174.45 1mir n GLU 243 N -3.67 1.98 -0.01 2.19 1.02 -1.26 -4.62 120.64 116.27 1mir n GLU 243 Ca 0.07 -1.77 -0.17 0.00 -0.02 0.00 0.00 57.16 55.27 1mir n GLU 243 Cb 0.63 -1.41 -0.10 0.00 -0.02 0.00 0.00 31.44 30.53 1mir n GLU 243 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1mir h SER 244 N 4.19 0.51 -2.29 1.62 0.02 -1.07 -3.37 113.55 113.16 1mir h SER 244 Ca 0.00 -0.73 -0.63 0.00 -0.84 0.00 0.00 61.79 59.59 1mir h SER 244 Cb 0.89 -0.15 -0.40 0.00 0.14 0.00 0.00 62.40 62.88 1mir h SER 244 CO 0.00 1.17 -0.38 -0.62 -1.14 0.00 0.00 176.83 175.86 1mir n GLU 245 N -4.26 3.24 -2.89 3.45 1.02 -1.26 -4.81 120.64 115.13 1mir n GLU 245 Ca -0.10 -4.76 -0.42 0.00 -0.02 0.00 0.00 57.16 51.87 1mir n GLU 245 Cb 0.63 -2.29 -0.04 0.00 -0.02 0.00 0.00 31.44 29.72 1mir n GLU 245 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1mir s ILE 246 N -3.56 4.84 0.17 -3.67 -1.09 -1.26 -3.90 121.20 112.72 1mir s ILE 246 Ca 0.43 1.58 0.10 0.00 -2.23 0.00 0.00 60.65 60.54 1mir s ILE 246 Cb 0.20 -4.12 -0.04 0.00 -1.58 0.00 0.00 42.46 36.92 1mir s ILE 246 CO -0.07 -0.06 -0.19 -0.69 -1.23 0.00 0.00 174.94 172.70 1mir s VAL 247 N 2.76 2.67 0.20 2.92 1.01 -0.44 -1.13 120.40 128.40 1mir s VAL 247 Ca 0.35 -1.81 -0.23 0.00 0.00 0.00 0.00 61.98 60.29 1mir s VAL 247 Cb -0.15 -2.28 0.07 0.00 0.00 0.00 0.00 36.38 34.01 1mir s VAL 247 CO 0.08 -0.06 0.96 0.00 0.00 0.00 0.00 175.10 176.08 1mir s ALA 248 N -1.54 -1.50 0.19 5.51 0.00 -0.77 -1.60 121.76 122.04 1mir s ALA 248 Ca 0.21 -0.17 -0.24 0.00 0.00 0.00 0.00 51.96 51.76 1mir s ALA 248 Cb -0.09 0.70 0.05 0.00 0.00 0.00 0.00 23.12 23.78 1mir s ALA 248 CO 0.11 -1.05 0.91 0.20 0.00 0.00 0.00 175.76 175.94 1mir s GLY 249 N -3.13 -0.17 -0.18 0.00 0.00 -1.26 -0.53 107.32 102.04 1mir s GLY 249 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.88 1mir s GLY 249 CO 0.05 0.06 -0.17 -0.42 0.00 0.00 0.00 173.10 172.62 1mir s ILE 250 N -3.36 2.30 0.18 0.90 -1.09 -1.14 -5.03 121.20 113.96 1mir s ILE 250 Ca 0.12 -0.86 -0.32 0.00 -2.23 0.00 0.00 60.65 57.37 1mir s ILE 250 Cb -0.02 -1.98 -0.10 0.00 -1.58 0.00 0.00 42.46 38.77 1mir s ILE 250 CO 0.04 0.52 1.59 -2.16 -1.23 0.00 0.00 174.94 173.70 1mir s PRO 251 N 1.27 4.20 -0.51 2.79 0.04 -1.26 -0.55 135.00 140.97 1mir s PRO 251 Ca 0.04 2.42 -0.27 0.00 0.04 0.00 0.00 61.00 63.22 1mir s PRO 251 Cb -0.13 -3.13 -0.02 0.00 0.04 0.00 0.00 34.50 31.25 1mir s PRO 251 CO -0.10 -0.63 1.89 0.50 0.04 0.00 0.00 177.00 178.70 1mir s ARG 252 N 1.03 2.79 0.34 4.56 3.52 -0.73 -4.63 118.95 125.83 1mir s ARG 252 Ca 0.70 0.94 0.09 0.00 -0.13 0.00 0.00 55.73 57.34 1mir s ARG 252 Cb -0.45 -4.35 0.60 0.00 -1.56 0.00 0.00 34.95 29.19 1mir s ARG 252 CO 0.32 -2.52 1.78 1.15 -0.81 0.00 0.00 175.30 175.22 1mir h THR 253 N 6.94 1.28 -0.65 4.11 2.02 -1.90 -3.37 112.91 121.34 1mir h THR 253 Ca -0.28 -1.34 0.06 0.00 0.77 0.00 0.00 66.41 65.62 1mir h THR 253 Cb 1.17 1.63 -0.08 0.00 -1.74 0.00 0.00 68.15 69.14 1mir h THR 253 CO 1.16 0.39 -0.38 1.67 0.37 0.00 0.00 175.52 178.73 1mir n GLN 254 N -4.08 -0.28 0.00 6.66 7.27 -1.26 -1.74 117.38 123.95 1mir n GLN 254 Ca -0.01 1.10 0.00 0.00 0.07 0.00 0.00 57.00 58.15 1mir n GLN 254 Cb 0.42 -1.62 0.00 0.00 2.41 0.00 0.00 30.24 31.46 1mir n GLN 254 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1mir n GLN 255 N -4.62 0.00 -0.02 3.69 10.64 -1.26 -2.20 117.38 123.61 1mir n GLN 255 Ca 0.01 0.29 -0.03 0.00 -1.83 0.00 0.00 57.00 55.44 1mir n GLN 255 Cb 0.17 -1.55 -0.13 0.00 -0.86 0.00 0.00 30.24 27.87 1mir n GLN 255 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1mir n TYR 256 N -1.27 0.56 -0.03 2.61 4.01 -0.71 -4.61 117.16 117.72 1mir n TYR 256 Ca 0.00 0.19 -0.07 0.00 -0.16 0.00 0.00 57.90 57.87 1mir n TYR 256 Cb 0.05 -1.01 -0.05 0.00 -0.31 0.00 0.00 39.34 38.03 1mir n TYR 256 CO 0.00 0.00 0.00 -1.49 -0.46 0.00 0.00 176.86 174.91 1mir h TRP 257 N 0.00 -0.76 0.00 -0.72 4.06 -1.58 0.43 115.95 117.38 1mir h TRP 257 Ca -0.29 0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.70 1mir h TRP 257 Cb 1.80 0.35 0.00 0.00 -1.00 0.00 0.00 29.16 30.31 1mir h TRP 257 CO 0.00 -0.24 0.12 0.78 -3.56 0.00 0.00 178.44 175.54 1mir h GLY 258 N -0.22 0.00 0.00 1.49 0.00 -1.83 -2.40 103.07 100.11 1mir h GLY 258 Ca 0.02 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.20 1mir h GLY 258 CO -0.24 0.00 -2.02 0.54 0.00 0.00 0.00 176.54 174.83 1mir n ARG 259 N -2.63 0.87 0.00 4.80 1.74 -0.57 -5.25 116.66 115.62 1mir n ARG 259 Ca -0.02 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 1mir n ARG 259 Cb 0.17 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1mir n ARG 259 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30