#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mlc s VAL 2 N 0.00 2.29 0.91 3.15 1.01 -1.26 0.09 120.40 126.59 1mlc s VAL 2 Ca 0.00 -2.86 -0.10 0.00 0.00 0.00 0.00 61.98 59.01 1mlc s VAL 2 Cb 0.00 -2.63 0.14 0.00 0.00 0.00 0.00 36.38 33.89 1mlc s VAL 2 CO 0.00 -0.74 1.15 -0.36 0.00 0.00 0.00 175.10 175.15 1mlc s PHE 3 N 0.22 1.62 0.27 5.22 0.40 -0.07 -4.94 117.98 120.69 1mlc s PHE 3 Ca 0.15 1.79 -0.18 0.00 -0.60 0.00 0.00 56.93 58.10 1mlc s PHE 3 Cb -0.23 -3.36 -0.09 0.00 0.51 0.00 0.00 43.02 39.85 1mlc s PHE 3 CO -0.04 -2.83 0.73 0.20 0.70 0.00 0.00 175.22 173.99 1mlc s GLY 4 N -2.63 2.49 0.12 4.36 0.00 -1.26 -4.81 107.32 105.59 1mlc s GLY 4 Ca 0.67 0.11 -0.23 0.00 0.00 0.00 0.00 44.72 45.27 1mlc s GLY 4 CO 0.57 0.40 1.36 -2.13 0.00 0.00 0.00 173.10 173.30 1mlc n ARG 5 N 0.23 -0.33 0.06 2.90 0.63 -1.26 0.10 116.66 118.99 1mlc n ARG 5 Ca 0.00 1.33 -0.22 0.00 -0.92 0.00 0.00 57.85 58.05 1mlc n ARG 5 Cb 0.52 -1.97 -0.15 0.00 0.45 0.00 0.00 32.46 31.31 1mlc n ARG 5 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1mlc h GLU 7 N 0.10 0.00 0.00 0.00 4.81 -1.80 -0.77 114.58 116.92 1mlc h GLU 7 Ca -0.34 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 1mlc h GLU 7 Cb 2.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.46 1mlc h GLU 7 CO 0.16 0.00 -0.01 1.25 -0.73 0.00 0.00 179.01 179.68 1mlc h LEU 8 N 0.00 0.00 -0.59 1.64 6.46 0.68 -3.31 115.31 120.19 1mlc h LEU 8 Ca 0.51 0.00 0.22 0.00 -0.12 0.00 0.00 57.88 58.49 1mlc h LEU 8 Cb 2.27 0.00 -0.08 0.00 -0.73 0.00 0.00 40.66 42.12 1mlc h LEU 8 CO -0.01 0.20 0.35 0.00 -0.62 0.00 0.00 178.44 178.37 1mlc n ALA 9 N -2.33 0.59 -0.07 1.25 0.00 -0.40 0.36 120.51 119.91 1mlc n ALA 9 Ca -0.00 0.46 -0.14 0.00 0.00 0.00 0.00 53.44 53.76 1mlc n ALA 9 Cb 0.01 -0.51 -0.06 0.00 0.00 0.00 0.00 19.45 18.89 1mlc n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mlc h ALA 10 N 0.88 0.33 0.00 0.00 0.00 -1.39 0.40 119.26 119.48 1mlc h ALA 10 Ca 0.42 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1mlc h ALA 10 Cb 1.26 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1mlc h ALA 10 CO -0.30 0.41 -0.40 0.00 0.00 0.00 0.00 179.25 178.96 1mlc h ALA 11 N 0.62 0.78 -0.01 0.00 0.00 0.62 -0.49 119.26 120.78 1mlc h ALA 11 Ca 0.01 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 1mlc h ALA 11 Cb 0.97 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1mlc h ALA 11 CO 0.08 0.49 -0.14 0.52 0.00 0.00 0.00 179.25 180.21 1mlc h MET 12 N 0.00 0.11 -0.08 0.00 2.07 -1.12 -2.76 114.93 113.15 1mlc h MET 12 Ca -0.00 -0.11 0.02 0.00 -2.07 0.00 0.00 59.70 57.54 1mlc h MET 12 Cb 1.22 0.03 -0.03 0.00 -1.87 0.00 0.00 31.60 30.96 1mlc h MET 12 CO 0.05 0.83 -0.07 1.57 1.07 0.00 0.00 176.91 180.36 1mlc h LYS 13 N -0.58 -0.09 -0.61 1.72 2.10 -0.09 -2.49 116.57 116.53 1mlc h LYS 13 Ca -0.02 0.01 0.08 0.00 -2.00 0.00 0.00 60.65 58.72 1mlc h LYS 13 Cb 0.88 0.02 -0.04 0.00 -0.90 0.00 0.00 32.23 32.19 1mlc h LYS 13 CO 0.03 -0.06 0.41 0.00 -2.00 0.00 0.00 179.45 177.83 1mlc h ARG 14 N -0.09 0.48 0.00 0.07 3.08 -1.15 0.44 114.38 117.22 1mlc h ARG 14 Ca 0.06 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1mlc h ARG 14 Cb 0.17 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1mlc h ARG 14 CO -0.13 0.32 0.00 0.72 -1.07 0.00 0.00 179.97 179.81 1mlc n HIS 15 N -4.48 0.00 -2.72 3.04 8.25 -1.00 -4.89 115.22 113.42 1mlc n HIS 15 Ca 0.09 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.46 1mlc n HIS 15 Cb 0.32 -0.13 0.05 0.00 1.12 0.00 0.00 29.99 31.35 1mlc n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1mlc n GLY 16 N 0.82 -0.04 0.03 -1.41 0.00 0.16 -4.94 105.19 99.81 1mlc n GLY 16 Ca 0.17 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.21 1mlc n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1mlc n LEU 17 N -2.65 0.69 -4.75 0.99 4.77 -0.97 -4.71 117.00 110.37 1mlc n LEU 17 Ca -0.14 -0.15 -0.41 0.00 -0.03 0.00 0.00 56.01 55.29 1mlc n LEU 17 Cb 0.59 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.46 1mlc n LEU 17 CO 0.33 0.16 0.84 -0.62 -1.33 0.00 0.00 177.39 176.77 1mlc s ASP 18 N -2.94 7.17 -1.52 -1.43 2.15 -1.26 -2.44 116.67 116.41 1mlc s ASP 18 Ca 0.12 2.25 0.00 0.00 0.43 0.00 0.00 52.55 55.35 1mlc s ASP 18 Cb 0.17 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 40.18 1mlc s ASP 18 CO 0.72 -0.26 0.00 0.59 -0.17 0.00 0.00 175.17 176.05 1mlc n ASN 19 N 1.85 -5.37 -4.63 -0.34 5.03 0.05 -4.91 115.26 106.95 1mlc n ASN 19 Ca 0.02 0.35 -0.43 0.00 0.87 0.00 0.00 54.58 55.39 1mlc n ASN 19 Cb 0.45 -4.28 -0.03 0.00 -1.02 0.00 0.00 39.78 34.90 1mlc n ASN 19 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1mlc s TYR 20 N -2.20 2.03 -1.18 3.10 6.14 -0.25 -2.02 117.35 122.98 1mlc s TYR 20 Ca 0.00 0.52 -0.04 0.00 0.64 0.00 0.00 57.07 58.19 1mlc s TYR 20 Cb 0.00 -4.00 0.03 0.00 0.42 0.00 0.00 41.96 38.41 1mlc s TYR 20 CO 0.00 -3.04 0.26 0.54 0.64 0.00 0.00 175.55 173.95 1mlc n ARG 21 N 7.75 -2.97 -1.25 4.97 1.74 -1.26 0.13 116.66 125.77 1mlc n ARG 21 Ca 0.19 0.57 0.00 0.00 -0.77 0.00 0.00 57.85 57.84 1mlc n ARG 21 Cb 0.45 -5.24 0.00 0.00 -1.02 0.00 0.00 32.46 26.65 1mlc n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1mlc n GLY 22 N -1.02 0.72 3.31 -0.13 0.00 -0.86 -5.06 105.19 102.15 1mlc n GLY 22 Ca -0.09 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 1mlc n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mlc s TYR 23 N -2.00 3.23 0.98 1.61 2.02 0.36 -4.90 117.35 118.64 1mlc s TYR 23 Ca 0.00 -1.24 -0.11 0.00 -0.37 0.00 0.00 57.07 55.35 1mlc s TYR 23 Cb 0.00 -2.30 0.18 0.00 -0.40 0.00 0.00 41.96 39.44 1mlc s TYR 23 CO 0.00 -0.68 1.09 -1.54 -1.57 0.00 0.00 175.55 172.85 1mlc s SER 24 N 1.45 2.61 0.33 2.29 1.04 -1.26 -0.77 113.70 119.39 1mlc s SER 24 Ca -0.00 1.70 0.24 0.00 0.48 0.00 0.00 55.95 58.36 1mlc s SER 24 Cb -0.19 -2.33 1.19 0.00 0.10 0.00 0.00 66.02 64.79 1mlc s SER 24 CO 0.03 -3.22 1.72 0.25 0.98 0.00 0.00 173.24 173.01 1mlc h LEU 25 N -1.95 0.00 0.17 2.42 7.12 -1.92 -1.35 115.31 119.81 1mlc h LEU 25 Ca -0.51 0.00 -0.30 0.00 0.13 0.00 0.00 57.88 57.20 1mlc h LEU 25 Cb 1.29 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 41.44 1mlc h LEU 25 CO 0.50 0.00 -1.46 1.23 -0.13 0.00 0.00 178.44 178.57 1mlc h GLY 26 N 0.73 0.42 -0.15 3.75 0.00 -1.89 -3.16 103.07 102.77 1mlc h GLY 26 Ca 0.00 -1.07 0.23 0.00 0.00 0.00 0.00 47.33 46.49 1mlc h GLY 26 CO 0.00 0.94 0.48 3.43 0.00 0.00 0.00 176.54 181.39 1mlc h ASN 27 N -0.08 0.49 0.17 0.19 -0.26 -1.49 -1.75 115.58 112.85 1mlc h ASN 27 Ca -0.29 0.14 -0.01 0.00 -0.56 0.00 0.00 56.30 55.59 1mlc h ASN 27 Cb 1.95 0.08 0.00 0.00 -1.06 0.00 0.00 38.32 39.29 1mlc h ASN 27 CO 0.16 0.05 -0.08 -0.50 -1.06 0.00 0.00 177.43 176.00 1mlc h TRP 28 N 0.49 -0.21 0.00 1.19 4.06 -1.60 -3.00 115.95 116.88 1mlc h TRP 28 Ca 0.59 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.54 1mlc h TRP 28 Cb 1.11 0.07 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 1mlc h TRP 28 CO -0.08 0.15 0.00 0.28 -3.56 0.00 0.00 178.44 175.23 1mlc h VAL 29 N -0.96 0.00 0.08 1.49 2.07 -1.48 -0.14 116.25 117.31 1mlc h VAL 29 Ca -0.02 -0.02 -0.23 0.00 0.82 0.00 0.00 66.70 67.25 1mlc h VAL 29 Cb 0.45 0.93 0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1mlc h VAL 29 CO 0.04 0.00 -0.93 0.00 0.02 0.00 0.00 177.57 176.70 1mlc h ALA 31 N 0.26 -0.60 0.00 0.00 0.00 -0.95 -2.09 119.26 115.88 1mlc h ALA 31 Ca -0.14 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1mlc h ALA 31 Cb 1.65 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.67 1mlc h ALA 31 CO 0.18 -0.73 0.11 0.00 0.00 0.00 0.00 179.25 178.81 1mlc h ALA 32 N -0.38 1.09 0.08 0.00 0.00 -1.17 0.11 119.26 118.98 1mlc h ALA 32 Ca -0.06 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1mlc h ALA 32 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1mlc h ALA 32 CO 0.10 -0.09 -0.04 -0.22 0.00 0.00 0.00 179.25 179.01 1mlc h LYS 33 N 0.00 -0.10 0.00 0.00 1.63 -1.09 -1.45 116.57 115.56 1mlc h LYS 33 Ca 0.00 0.01 -0.09 0.00 -0.85 0.00 0.00 60.65 59.72 1mlc h LYS 33 Cb 0.22 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.86 1mlc h LYS 33 CO 0.00 0.31 -0.41 0.74 -3.45 0.00 0.00 179.45 176.63 1mlc h PHE 34 N -0.97 0.00 0.00 1.91 0.04 -0.58 -1.82 116.94 115.52 1mlc h PHE 34 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 1mlc h PHE 34 Cb 0.46 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.61 1mlc h PHE 34 CO 0.10 0.41 0.00 0.39 -0.60 0.00 0.00 178.31 178.61 1mlc n GLU 35 N -3.22 0.00 0.00 1.51 -0.58 0.27 -4.64 120.64 113.98 1mlc n GLU 35 Ca 0.02 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.88 1mlc n GLU 35 Cb 0.69 -0.31 0.18 0.00 -0.57 0.00 0.00 31.44 31.43 1mlc n GLU 35 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1mlc n SER 36 N -0.20 0.73 -3.73 1.62 3.41 -1.22 -4.94 113.62 109.29 1mlc n SER 36 Ca 0.00 -0.53 -0.25 0.00 -0.26 0.00 0.00 58.87 57.83 1mlc n SER 36 Cb 0.00 0.39 0.05 0.00 -0.26 0.00 0.00 64.21 64.39 1mlc n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1mlc n ASN 37 N -1.33 -3.74 -0.03 4.04 5.15 -0.68 -2.58 115.26 116.09 1mlc n ASN 37 Ca 0.06 -0.72 -0.00 0.00 -0.60 0.00 0.00 54.58 53.32 1mlc n ASN 37 Cb 0.34 -4.32 -0.00 0.00 -0.53 0.00 0.00 39.78 35.27 1mlc n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1mlc n PHE 38 N -4.57 0.00 -3.21 1.20 3.72 -0.58 -4.84 117.46 109.17 1mlc n PHE 38 Ca -0.10 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 56.91 1mlc n PHE 38 Cb 0.59 -0.84 -0.06 0.00 -0.94 0.00 0.00 39.48 38.23 1mlc n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1mlc s ASN 39 N -2.04 6.72 0.00 4.37 3.84 -1.07 -0.89 114.94 125.87 1mlc s ASN 39 Ca 0.00 0.86 0.29 0.00 0.21 0.00 0.00 52.86 54.22 1mlc s ASN 39 Cb 0.00 -2.32 1.21 0.00 -0.55 0.00 0.00 41.25 39.58 1mlc s ASN 39 CO 0.00 -0.11 1.88 0.35 -2.79 0.00 0.00 177.10 176.43 1mlc n THR 40 N 4.07 0.00 -0.06 -5.21 -2.24 0.11 -2.82 114.28 108.13 1mlc n THR 40 Ca -0.04 -0.01 0.03 0.00 -2.27 0.00 0.00 64.05 61.75 1mlc n THR 40 Cb 0.51 -0.31 0.07 0.00 -2.10 0.00 0.00 70.33 68.50 1mlc n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mlc n GLN 41 N -1.33 2.60 -1.78 -0.78 6.02 -1.26 -4.31 117.38 116.54 1mlc n GLN 41 Ca 0.10 -1.69 -0.42 0.00 -0.01 0.00 0.00 57.00 54.98 1mlc n GLN 41 Cb 0.30 -1.14 -0.02 0.00 1.02 0.00 0.00 30.24 30.40 1mlc n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1mlc s ALA 42 N -0.95 3.78 0.01 -1.58 0.00 -1.23 -4.76 121.76 117.04 1mlc s ALA 42 Ca 0.12 1.56 0.01 0.00 0.00 0.00 0.00 51.96 53.64 1mlc s ALA 42 Cb 0.06 -3.65 -0.01 0.00 0.00 0.00 0.00 23.12 19.52 1mlc s ALA 42 CO 0.08 -0.96 -0.03 0.95 0.00 0.00 0.00 175.76 175.80 1mlc s THR 43 N 0.23 0.18 -0.02 0.00 -4.23 -1.26 -0.72 115.64 109.82 1mlc s THR 43 Ca 0.65 -0.58 -0.02 0.00 -1.18 0.00 0.00 61.69 60.56 1mlc s THR 43 Cb -0.48 -0.25 0.00 0.00 1.34 0.00 0.00 72.50 73.12 1mlc s THR 43 CO 0.45 -0.26 0.06 0.21 -0.54 0.00 0.00 174.62 174.54 1mlc s ASN 44 N -0.87 -0.03 0.07 3.99 2.47 -1.07 -5.02 114.94 114.47 1mlc s ASN 44 Ca -0.08 0.05 0.05 0.00 0.42 0.00 0.00 52.86 53.30 1mlc s ASN 44 Cb -0.06 0.14 -0.04 0.00 -1.45 0.00 0.00 41.25 39.84 1mlc s ASN 44 CO -0.00 -0.08 -0.05 -0.13 -3.72 0.00 0.00 177.10 173.12 1mlc s ARG 45 N -0.21 2.40 0.46 0.43 0.52 -1.26 -1.67 118.95 119.61 1mlc s ARG 45 Ca -0.03 -0.87 0.05 0.00 -0.52 0.00 0.00 55.73 54.36 1mlc s ARG 45 Cb -0.02 -2.45 0.05 0.00 0.52 0.00 0.00 34.95 33.05 1mlc s ARG 45 CO 0.00 0.55 0.43 0.09 0.02 0.00 0.00 175.30 176.38 1mlc n ASN 46 N 0.87 2.24 -2.34 0.23 5.03 -0.48 -5.02 115.26 115.79 1mlc n ASN 46 Ca -0.13 -2.47 -0.31 0.00 0.87 0.00 0.00 54.58 52.54 1mlc n ASN 46 Cb 0.52 -0.12 0.04 0.00 -1.02 0.00 0.00 39.78 39.20 1mlc n ASN 46 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1mlc n THR 47 N -1.69 3.12 -1.01 3.41 -2.24 -1.26 -4.15 114.28 110.46 1mlc n THR 47 Ca 0.03 -3.81 0.00 0.00 -2.27 0.00 0.00 64.05 58.00 1mlc n THR 47 Cb 0.51 -1.18 0.00 0.00 -2.10 0.00 0.00 70.33 67.56 1mlc n THR 47 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1mlc n ASP 48 N -0.74 0.00 0.00 3.42 5.75 -1.26 -4.99 116.55 118.73 1mlc n ASP 48 Ca 0.53 -1.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.31 1mlc n ASP 48 Cb 0.69 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.78 1mlc n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1mlc n GLY 49 N 0.00 0.63 3.85 6.12 0.00 -1.26 -4.67 105.19 109.86 1mlc n GLY 49 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1mlc n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1mlc s SER 50 N -2.94 5.40 -0.03 1.61 1.04 -1.26 -4.36 113.70 113.16 1mlc s SER 50 Ca 0.00 -0.40 -0.01 0.00 0.48 0.00 0.00 55.95 56.02 1mlc s SER 50 Cb 0.00 -1.12 0.02 0.00 0.10 0.00 0.00 66.02 65.02 1mlc s SER 50 CO 0.00 -0.26 0.06 -0.89 0.98 0.00 0.00 173.24 173.13 1mlc s THR 51 N -2.24 -0.04 0.16 2.02 2.01 -1.26 -1.39 115.64 114.90 1mlc s THR 51 Ca 0.39 0.14 -0.21 0.00 0.31 0.00 0.00 61.69 62.32 1mlc s THR 51 Cb -0.07 -0.11 -0.08 0.00 0.01 0.00 0.00 72.50 72.26 1mlc s THR 51 CO 0.26 0.06 0.68 -1.81 -0.69 0.00 0.00 174.62 173.12 1mlc s ASP 52 N 0.74 7.12 0.05 3.53 1.01 -0.67 -1.52 116.67 126.93 1mlc s ASP 52 Ca -0.06 1.40 0.05 0.00 0.71 0.00 0.00 52.55 54.66 1mlc s ASP 52 Cb -0.08 -2.41 -0.02 0.00 1.01 0.00 0.00 42.92 41.41 1mlc s ASP 52 CO -0.03 0.15 -0.15 -0.31 0.21 0.00 0.00 175.17 175.04 1mlc s TYR 53 N -1.30 1.34 0.20 4.23 1.51 0.25 -2.61 117.35 120.96 1mlc s TYR 53 Ca 0.37 -0.38 0.00 0.00 -1.01 0.00 0.00 57.07 56.04 1mlc s TYR 53 Cb -0.19 -0.78 0.00 0.00 -0.11 0.00 0.00 41.96 40.88 1mlc s TYR 53 CO 0.22 0.06 0.00 0.41 -1.11 0.00 0.00 175.55 175.13 1mlc n GLY 54 N 1.70 -1.10 0.29 0.71 0.00 0.11 -2.36 105.19 104.54 1mlc n GLY 54 Ca -0.19 -0.64 0.27 0.00 0.00 0.00 0.00 46.02 45.46 1mlc n GLY 54 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1mlc n ILE 55 N -2.68 -0.37 0.98 -0.61 3.06 -1.13 0.73 119.36 119.34 1mlc n ILE 55 Ca 0.00 1.81 0.10 0.00 -2.50 0.00 0.00 62.75 62.17 1mlc n ILE 55 Cb 0.60 -2.92 -0.06 0.00 0.54 0.00 0.00 39.64 37.80 1mlc n ILE 55 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 1mlc n LEU 56 N -5.03 1.48 -3.41 9.51 4.77 -1.26 -3.54 117.00 119.52 1mlc n LEU 56 Ca 0.32 -0.63 -0.17 0.00 -0.03 0.00 0.00 56.01 55.51 1mlc n LEU 56 Cb 1.09 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 42.27 1mlc n LEU 56 CO 0.00 0.31 0.10 0.00 -1.33 0.00 0.00 177.39 176.47 1mlc n GLN 57 N -0.78 -6.04 -1.31 3.23 1.13 0.22 -4.95 117.38 108.89 1mlc n GLN 57 Ca 0.06 0.85 -0.33 0.00 -1.94 0.00 0.00 57.00 55.64 1mlc n GLN 57 Cb 0.39 -5.85 0.10 0.00 0.11 0.00 0.00 30.24 24.99 1mlc n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1mlc s ILE 58 N -3.37 2.41 -0.06 5.09 -1.09 -1.06 -4.44 121.20 118.68 1mlc s ILE 58 Ca 0.06 0.18 0.05 0.00 -2.23 0.00 0.00 60.65 58.71 1mlc s ILE 58 Cb -0.01 -2.64 -0.01 0.00 -1.58 0.00 0.00 42.46 38.22 1mlc s ILE 58 CO 0.73 -0.12 -0.23 0.21 -1.23 0.00 0.00 174.94 174.30 1mlc s ASN 59 N -2.28 3.29 0.32 3.58 3.84 -1.26 0.85 114.94 123.27 1mlc s ASN 59 Ca 0.71 -0.45 0.25 0.00 0.21 0.00 0.00 52.86 53.58 1mlc s ASN 59 Cb -0.26 -0.86 1.13 0.00 -0.55 0.00 0.00 41.25 40.70 1mlc s ASN 59 CO 0.48 0.26 1.74 0.77 -2.79 0.00 0.00 177.10 177.56 1mlc h SER 60 N 5.96 0.00 0.29 -4.21 4.64 -1.52 -2.82 113.55 115.90 1mlc h SER 60 Ca -0.34 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.96 1mlc h SER 60 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1mlc h SER 60 CO 0.48 0.00 -0.14 -0.09 -0.87 0.00 0.00 176.83 176.21 1mlc h ARG 61 N 0.00 -0.38 0.00 4.77 2.43 -1.85 -3.38 114.38 115.97 1mlc h ARG 61 Ca 0.00 0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.05 1mlc h ARG 61 Cb 0.25 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 1mlc h ARG 61 CO 0.00 -0.12 -0.85 -1.49 -1.51 0.00 0.00 179.97 176.00 1mlc h TRP 62 N -1.03 0.00 0.18 2.20 4.06 -1.84 -2.24 115.95 117.28 1mlc h TRP 62 Ca -0.04 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.90 1mlc h TRP 62 Cb 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.60 1mlc h TRP 62 CO 0.03 1.24 -0.09 -1.49 -3.56 0.00 0.00 178.44 174.58 1mlc h TRP 63 N -1.00 -0.23 -0.59 0.49 -0.00 -1.69 0.91 115.95 113.83 1mlc h TRP 63 Ca -0.23 -0.01 -0.66 0.00 -0.00 0.00 0.00 58.89 58.00 1mlc h TRP 63 Cb 1.15 0.07 -0.12 0.00 -0.00 0.00 0.00 29.16 30.26 1mlc h TRP 63 CO 0.13 -0.11 -0.50 0.00 -0.00 0.00 0.00 178.44 177.95 1mlc s ASN 65 N -3.90 4.01 -0.07 0.00 2.47 -0.53 -4.34 114.94 112.58 1mlc s ASN 65 Ca 0.14 -0.84 0.11 0.00 0.42 0.00 0.00 52.86 52.69 1mlc s ASN 65 Cb 0.02 -1.61 0.29 0.00 -1.45 0.00 0.00 41.25 38.51 1mlc s ASN 65 CO 0.08 -0.09 1.22 -0.90 -3.72 0.00 0.00 177.10 173.69 1mlc n ASP 66 N 4.63 2.86 0.00 -4.21 5.68 -1.26 -2.07 116.55 122.19 1mlc n ASP 66 Ca -0.17 -2.44 0.00 0.00 -0.50 0.00 0.00 54.79 51.68 1mlc n ASP 66 Cb 0.47 -0.29 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 1mlc n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1mlc n GLY 67 N -0.30 1.99 0.00 6.12 0.00 -1.26 -4.74 105.19 107.00 1mlc n GLY 67 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1mlc n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1mlc n ARG 68 N -1.91 1.53 -3.18 1.61 1.85 -1.26 -5.06 116.66 110.23 1mlc n ARG 68 Ca 0.00 -0.33 -0.37 0.00 -1.00 0.00 0.00 57.85 56.16 1mlc n ARG 68 Cb 0.00 -0.82 -0.06 0.00 -1.05 0.00 0.00 32.46 30.53 1mlc n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1mlc s THR 69 N -0.31 4.65 0.03 8.89 2.01 -1.26 -4.93 115.64 124.70 1mlc s THR 69 Ca 0.00 1.21 -0.25 0.00 0.31 0.00 0.00 61.69 62.96 1mlc s THR 69 Cb 0.00 -3.87 -0.05 0.00 0.01 0.00 0.00 72.50 68.59 1mlc s THR 69 CO 0.00 0.31 0.75 -2.16 -0.69 0.00 0.00 174.62 172.83 1mlc s PRO 70 N -1.73 4.48 -0.41 4.92 0.04 -1.26 -4.30 135.00 136.74 1mlc s PRO 70 Ca 0.38 1.03 -0.02 0.00 0.04 0.00 0.00 61.00 62.43 1mlc s PRO 70 Cb -0.17 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 30.99 1mlc s PRO 70 CO 0.21 0.25 0.35 0.41 0.04 0.00 0.00 177.00 178.26 1mlc n GLY 71 N 2.50 0.39 3.72 0.56 0.00 -1.26 -4.91 105.19 106.19 1mlc n GLY 71 Ca -0.02 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 1mlc n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1mlc s SER 72 N -3.21 7.17 -0.08 1.61 0.15 -1.25 -4.69 113.70 113.41 1mlc s SER 72 Ca 0.12 1.94 0.04 0.00 0.70 0.00 0.00 55.95 58.75 1mlc s SER 72 Cb -0.05 -2.58 -0.08 0.00 -1.71 0.00 0.00 66.02 61.60 1mlc s SER 72 CO 0.23 -0.38 -0.03 0.54 1.20 0.00 0.00 173.24 174.79 1mlc n ARG 73 N 3.68 1.44 -3.50 5.44 1.74 -0.84 -5.02 116.66 119.60 1mlc n ARG 73 Ca 0.07 0.03 -0.22 0.00 -0.77 0.00 0.00 57.85 56.96 1mlc n ARG 73 Cb 0.47 -1.19 0.06 0.00 -1.02 0.00 0.00 32.46 30.78 1mlc n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1mlc n ASN 74 N -2.54 -4.54 -0.19 0.55 5.15 0.57 -4.89 115.26 109.37 1mlc n ASN 74 Ca -0.15 -0.82 -0.09 0.00 -0.60 0.00 0.00 54.58 52.92 1mlc n ASN 74 Cb 0.71 -4.38 0.01 0.00 -0.53 0.00 0.00 39.78 35.59 1mlc n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1mlc h LEU 75 N -1.58 0.93 0.00 1.20 3.38 0.12 -1.00 115.31 118.35 1mlc h LEU 75 Ca -0.63 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.05 1mlc h LEU 75 Cb 1.34 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1mlc h LEU 75 CO 0.49 1.00 0.00 0.00 0.09 0.00 0.00 178.44 180.02 1mlc n ASN 77 N -0.60 -1.04 -3.62 0.00 5.15 -0.38 -4.96 115.26 109.81 1mlc n ASN 77 Ca 0.03 -0.20 -0.13 0.00 -0.60 0.00 0.00 54.58 53.69 1mlc n ASN 77 Cb 0.02 -0.34 -0.06 0.00 -0.53 0.00 0.00 39.78 38.87 1mlc n ASN 77 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1mlc s ILE 78 N -2.03 0.04 0.16 -1.44 -4.36 -1.26 -5.07 121.20 107.24 1mlc s ILE 78 Ca 0.01 -0.35 -0.31 0.00 -0.26 0.00 0.00 60.65 59.74 1mlc s ILE 78 Cb -0.00 -0.97 -0.09 0.00 1.25 0.00 0.00 42.46 42.65 1mlc s ILE 78 CO 0.19 -0.20 1.41 -2.84 0.24 0.00 0.00 174.94 173.75 1mlc s PRO 79 N -2.50 4.31 0.61 0.37 0.02 -1.26 -1.46 135.00 135.10 1mlc s PRO 79 Ca -0.05 2.15 0.32 0.00 0.02 0.00 0.00 61.00 63.44 1mlc s PRO 79 Cb -0.01 -3.20 1.78 0.00 0.02 0.00 0.00 34.50 33.09 1mlc s PRO 79 CO -0.02 -0.43 2.12 0.00 -0.33 0.00 0.00 177.00 178.34 1mlc h SER 81 N 0.00 0.00 1.38 0.00 4.64 -1.90 0.22 113.55 117.90 1mlc h SER 81 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1mlc h SER 81 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1mlc h SER 81 CO -0.00 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.03 1mlc h ALA 82 N 1.93 1.00 -0.00 5.18 0.00 -1.57 -1.59 119.26 124.20 1mlc h ALA 82 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1mlc h ALA 82 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1mlc h ALA 82 CO 0.01 0.00 -0.07 1.28 0.00 0.00 0.00 179.25 180.47 1mlc n LEU 83 N -3.00 0.32 -0.30 0.00 4.77 0.77 -2.98 117.00 116.58 1mlc n LEU 83 Ca 0.02 0.08 0.10 0.00 -0.03 0.00 0.00 56.01 56.18 1mlc n LEU 83 Cb 0.39 -0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.24 1mlc n LEU 83 CO 0.29 0.06 0.17 0.18 -1.33 0.00 0.00 177.39 176.76 1mlc n LEU 84 N -1.03 1.60 -4.41 2.23 4.77 -0.60 -3.78 117.00 115.78 1mlc n LEU 84 Ca 0.15 -0.66 -0.30 0.00 -0.03 0.00 0.00 56.01 55.18 1mlc n LEU 84 Cb 0.25 0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.61 1mlc n LEU 84 CO 0.23 0.32 0.47 -0.55 -1.33 0.00 0.00 177.39 176.54 1mlc s SER 85 N -2.62 -0.07 0.06 -1.43 0.15 -1.16 -4.27 113.70 104.37 1mlc s SER 85 Ca 0.14 1.05 0.25 0.00 0.70 0.00 0.00 55.95 58.09 1mlc s SER 85 Cb 0.17 -1.57 0.42 0.00 -1.71 0.00 0.00 66.02 63.33 1mlc s SER 85 CO 0.67 -4.78 1.36 -1.20 1.20 0.00 0.00 173.24 170.48 1mlc n SER 86 N -5.26 0.59 -4.48 5.45 7.64 -1.26 -4.58 113.62 111.71 1mlc n SER 86 Ca 0.09 -0.04 -0.44 0.00 1.01 0.00 0.00 58.87 59.49 1mlc n SER 86 Cb 0.58 0.22 -0.01 0.00 -1.01 0.00 0.00 64.21 64.00 1mlc n SER 86 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1mlc s ASP 87 N -3.66 6.91 0.00 6.43 -1.08 -1.26 -4.89 116.67 119.11 1mlc s ASP 87 Ca 0.08 -2.62 0.00 0.00 -0.52 0.00 0.00 52.55 49.49 1mlc s ASP 87 Cb 0.15 -2.43 0.00 0.00 -1.46 0.00 0.00 42.92 39.18 1mlc s ASP 87 CO 0.71 -0.91 0.00 2.30 0.52 0.00 0.00 175.17 177.79 1mlc n ILE 88 N 5.17 0.00 0.19 4.11 -5.35 -1.26 -3.43 119.36 118.79 1mlc n ILE 88 Ca 0.35 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.69 1mlc n ILE 88 Cb 0.45 -0.30 -0.08 0.00 -1.74 0.00 0.00 39.64 37.97 1mlc n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1mlc h THR 89 N 0.00 0.62 -0.63 7.28 2.02 -1.94 0.21 112.91 120.47 1mlc h THR 89 Ca 0.00 -0.48 0.06 0.00 0.77 0.00 0.00 66.41 66.76 1mlc h THR 89 Cb 0.00 0.85 -0.08 0.00 -1.74 0.00 0.00 68.15 67.18 1mlc h THR 89 CO 0.00 0.09 -0.37 0.00 0.37 0.00 0.00 175.52 175.61 1mlc n ALA 90 N -2.47 -0.40 0.00 6.16 0.00 -1.22 0.40 120.51 122.98 1mlc n ALA 90 Ca -0.10 0.53 -0.00 0.00 0.00 0.00 0.00 53.44 53.87 1mlc n ALA 90 Cb 0.27 0.08 -0.00 0.00 0.00 0.00 0.00 19.45 19.80 1mlc n ALA 90 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1mlc h SER 91 N 0.00 -0.02 -0.85 0.00 0.02 -1.83 -0.60 113.55 110.27 1mlc h SER 91 Ca 0.10 0.00 0.22 0.00 -0.84 0.00 0.00 61.79 61.27 1mlc h SER 91 Cb 0.26 0.01 -0.13 0.00 0.14 0.00 0.00 62.40 62.67 1mlc h SER 91 CO -0.59 -0.01 0.25 0.58 -1.14 0.00 0.00 176.83 175.92 1mlc h VAL 92 N -0.01 0.38 -0.53 2.27 2.07 -0.50 0.32 116.25 120.25 1mlc h VAL 92 Ca -0.00 -0.09 -0.07 0.00 0.82 0.00 0.00 66.70 67.37 1mlc h VAL 92 Cb 0.01 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 1mlc h VAL 92 CO -0.00 0.05 0.06 -1.13 0.02 0.00 0.00 177.57 176.56 1mlc h ASN 93 N 0.25 0.81 0.01 0.57 -0.00 0.15 -3.11 115.58 114.25 1mlc h ASN 93 Ca 0.53 -0.18 -0.00 0.00 -0.00 0.00 0.00 56.30 56.65 1mlc h ASN 93 Cb 1.02 -0.21 0.00 0.00 -0.00 0.00 0.00 38.32 39.13 1mlc h ASN 93 CO -0.61 0.84 -0.00 0.00 -0.00 0.00 0.00 177.43 177.66 1mlc h ALA 95 N 0.20 2.99 -0.41 0.00 0.00 -0.40 0.03 119.26 121.66 1mlc h ALA 95 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1mlc h ALA 95 Cb 0.74 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1mlc h ALA 95 CO 0.00 -1.44 0.21 0.87 0.00 0.00 0.00 179.25 178.89 1mlc h LYS 96 N 0.10 0.56 -0.14 0.00 1.57 -1.50 -1.92 116.57 115.24 1mlc h LYS 96 Ca 0.69 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 59.22 1mlc h LYS 96 Cb 2.44 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 34.64 1mlc h LYS 96 CO -0.15 0.43 -0.67 -0.22 -0.57 0.00 0.00 179.45 178.27 1mlc h LYS 97 N 0.57 0.70 -0.62 3.15 3.64 -1.12 -3.09 116.57 119.80 1mlc h LYS 97 Ca 0.15 -0.57 0.10 0.00 -1.27 0.00 0.00 60.65 59.06 1mlc h LYS 97 Cb 0.04 0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 31.90 1mlc h LYS 97 CO -0.02 1.18 0.22 0.82 -2.27 0.00 0.00 179.45 179.38 1mlc h ILE 98 N 0.40 0.74 0.35 2.00 2.04 -1.18 -3.21 117.51 118.64 1mlc h ILE 98 Ca -0.04 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 1mlc h ILE 98 Cb 1.30 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 1mlc h ILE 98 CO 0.14 0.07 -0.17 -0.37 0.00 0.00 0.00 178.15 177.82 1mlc h VAL 99 N 0.39 0.00 0.00 1.67 -1.51 -1.42 -2.92 116.25 112.45 1mlc h VAL 99 Ca 0.32 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.69 1mlc h VAL 99 Cb 0.42 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 29.58 1mlc h VAL 99 CO -0.33 0.00 0.00 -1.20 -1.23 0.00 0.00 177.57 174.81 1mlc n SER 100 N -3.56 0.00 -0.95 4.19 7.64 -1.17 -2.56 113.62 117.22 1mlc n SER 100 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1mlc n SER 100 Cb 0.19 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 1mlc n SER 100 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1mlc n ASP 101 N -2.92 1.33 -4.16 6.43 9.92 -1.10 -4.84 116.55 121.21 1mlc n ASP 101 Ca 0.00 -0.96 -0.31 0.00 -0.53 0.00 0.00 54.79 52.99 1mlc n ASP 101 Cb 0.00 -0.24 -0.07 0.00 -0.64 0.00 0.00 41.12 40.17 1mlc n ASP 101 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1mlc n GLY 102 N 0.71 -0.22 0.00 0.44 0.00 -1.06 -4.53 105.19 100.53 1mlc n GLY 102 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1mlc n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mlc n ASN 103 N -2.51 0.52 0.00 1.61 4.13 -1.26 -5.12 115.26 112.63 1mlc n ASN 103 Ca -0.27 -0.01 0.00 0.00 1.68 0.00 0.00 54.58 55.98 1mlc n ASN 103 Cb 0.62 0.13 0.00 0.00 -1.54 0.00 0.00 39.78 38.99 1mlc n ASN 103 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mlc n GLY 104 N 0.29 0.39 0.00 7.41 0.00 -1.25 -3.03 105.19 108.99 1mlc n GLY 104 Ca 0.00 -0.88 0.07 0.00 0.00 0.00 0.00 46.02 45.21 1mlc n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1mlc n MET 105 N 2.48 0.47 0.24 1.61 2.81 -1.26 -3.20 117.12 120.26 1mlc n MET 105 Ca 0.00 0.00 0.07 0.00 -1.81 0.00 0.00 57.70 55.96 1mlc n MET 105 Cb 0.00 -1.44 0.58 0.00 -0.71 0.00 0.00 33.22 31.64 1mlc n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1mlc h ASN 106 N 0.00 0.00 -1.13 7.83 -0.26 -1.96 -1.36 115.58 118.70 1mlc h ASN 106 Ca 0.00 0.00 0.33 0.00 -0.56 0.00 0.00 56.30 56.07 1mlc h ASN 106 Cb 0.00 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.21 1mlc h ASN 106 CO 0.00 0.14 0.84 0.00 -1.06 0.00 0.00 177.43 177.35 1mlc h ALA 107 N 1.86 3.05 -1.00 -0.83 0.00 -1.80 -3.25 119.26 117.29 1mlc h ALA 107 Ca -0.00 -0.04 -0.76 0.00 0.00 0.00 0.00 54.91 54.11 1mlc h ALA 107 Cb 0.26 0.08 -0.16 0.00 0.00 0.00 0.00 17.79 17.98 1mlc h ALA 107 CO 0.02 -1.42 1.94 0.91 0.00 0.00 0.00 179.25 180.70 1mlc n TRP 108 N -4.11 3.12 -0.01 0.00 8.01 -0.51 -4.91 117.44 119.03 1mlc n TRP 108 Ca 0.24 -2.84 -0.00 0.00 -1.31 0.00 0.00 57.50 53.59 1mlc n TRP 108 Cb 1.21 -1.96 -0.00 0.00 -2.01 0.00 0.00 31.31 28.55 1mlc n TRP 108 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.69 176.96 1mlc n VAL 109 N 3.41 -0.02 0.27 -0.99 0.31 -1.23 0.49 118.33 120.57 1mlc n VAL 109 Ca 0.39 0.08 0.16 0.00 -0.01 0.00 0.00 64.34 64.95 1mlc n VAL 109 Cb 0.37 -0.09 0.79 0.00 -0.91 0.00 0.00 33.84 34.00 1mlc n VAL 109 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1mlc h ALA 110 N 0.02 1.00 0.07 3.52 0.00 -1.91 -0.55 119.26 121.41 1mlc h ALA 110 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1mlc h ALA 110 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1mlc h ALA 110 CO -0.03 0.00 -0.03 2.35 0.00 0.00 0.00 179.25 181.54 1mlc h TRP 111 N 0.00 -0.09 0.00 0.00 7.01 1.10 -2.76 115.95 121.21 1mlc h TRP 111 Ca 0.00 -0.00 -0.22 0.00 2.11 0.00 0.00 58.89 60.77 1mlc h TRP 111 Cb 0.11 0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.19 1mlc h TRP 111 CO 0.00 -0.05 1.26 -2.13 -2.79 0.00 0.00 178.44 174.72 1mlc n ARG 112 N -3.25 1.49 0.00 2.65 0.00 -0.26 0.13 116.66 117.42 1mlc n ARG 112 Ca -0.01 -0.95 0.00 0.00 -0.00 0.00 0.00 57.85 56.89 1mlc n ARG 112 Cb 0.04 -2.09 0.00 0.00 0.00 0.00 0.00 32.46 30.41 1mlc n ARG 112 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1mlc n ASN 113 N 3.49 0.00 0.00 6.15 5.15 -0.92 -4.69 115.26 124.44 1mlc n ASN 113 Ca 0.32 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.30 1mlc n ASN 113 Cb 0.30 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.55 1mlc n ASN 113 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1mlc n ARG 114 N 0.00 2.39 -2.71 1.20 5.12 0.49 -4.95 116.66 118.19 1mlc n ARG 114 Ca 0.00 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.87 1mlc n ARG 114 Cb 0.00 -0.20 0.07 0.00 -1.16 0.00 0.00 32.46 31.18 1mlc n ARG 114 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1mlc s LYS 116 N -1.88 3.67 0.20 0.00 2.20 -1.20 -4.60 119.74 118.13 1mlc s LYS 116 Ca 0.23 0.40 0.00 0.00 -0.36 0.00 0.00 55.97 56.23 1mlc s LYS 116 Cb 0.41 -3.89 0.00 0.00 -1.51 0.00 0.00 37.83 32.84 1mlc s LYS 116 CO -0.04 -1.21 0.00 0.41 -0.36 0.00 0.00 175.35 174.15 1mlc n GLY 117 N 4.76 1.54 5.53 5.54 0.00 -1.26 -4.83 105.19 116.46 1mlc n GLY 117 Ca 0.08 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.44 1mlc n GLY 117 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mlc n THR 118 N 0.00 0.00 -2.64 2.61 -2.24 -1.26 -3.51 114.28 107.23 1mlc n THR 118 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 1mlc n THR 118 Cb 0.00 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.33 1mlc n THR 118 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1mlc n ASP 119 N 3.08 -1.26 -0.40 3.42 -0.08 -1.26 -4.98 116.55 115.07 1mlc n ASP 119 Ca 0.00 -2.01 0.35 0.00 -1.51 0.00 0.00 54.79 51.62 1mlc n ASP 119 Cb 0.00 0.62 0.54 0.00 2.34 0.00 0.00 41.12 44.63 1mlc n ASP 119 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 1mlc n VAL 120 N -1.12 0.00 0.33 5.18 0.24 -1.23 0.37 118.33 122.10 1mlc n VAL 120 Ca -0.13 1.18 0.18 0.00 -2.04 0.00 0.00 64.34 63.53 1mlc n VAL 120 Cb 0.80 -2.04 0.97 0.00 -1.47 0.00 0.00 33.84 32.10 1mlc n VAL 120 CO 0.00 0.00 0.00 0.06 -2.14 0.00 0.00 176.83 174.75 1mlc h GLN 121 N 0.00 0.00 -0.91 7.34 3.07 -1.90 -1.64 115.11 121.08 1mlc h GLN 121 Ca 0.62 0.00 0.23 0.00 0.09 0.00 0.00 58.65 59.59 1mlc h GLN 121 Cb 2.90 0.00 -0.16 0.00 0.08 0.00 0.00 27.48 30.30 1mlc h GLN 121 CO -0.01 0.00 0.01 0.00 0.09 0.00 0.00 178.83 178.93 1mlc h ALA 122 N 1.61 1.02 0.00 0.06 0.00 0.64 -0.17 119.26 122.41 1mlc h ALA 122 Ca 0.01 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1mlc h ALA 122 Cb 0.42 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1mlc h ALA 122 CO -0.00 -0.50 0.00 -1.49 0.00 0.00 0.00 179.25 177.26 1mlc h TRP 123 N 0.05 0.00 -0.01 0.00 4.06 -1.53 0.23 115.95 118.76 1mlc h TRP 123 Ca 0.53 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.48 1mlc h TRP 123 Cb 1.02 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.18 1mlc h TRP 123 CO -0.48 0.00 -0.74 0.44 -3.56 0.00 0.00 178.44 174.10 1mlc n ILE 124 N -2.67 0.00 -1.54 1.49 -5.35 -0.19 -4.66 119.36 106.44 1mlc n ILE 124 Ca 0.02 -0.13 -0.57 0.00 -0.27 0.00 0.00 62.75 61.80 1mlc n ILE 124 Cb 0.33 1.11 -0.07 0.00 -1.74 0.00 0.00 39.64 39.26 1mlc n ILE 124 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1mlc n ARG 125 N -0.86 0.38 -0.57 6.28 5.12 0.07 0.27 116.66 127.35 1mlc n ARG 125 Ca 0.06 0.14 0.00 0.00 -1.93 0.00 0.00 57.85 56.12 1mlc n ARG 125 Cb 0.37 -1.69 0.00 0.00 -1.16 0.00 0.00 32.46 29.99 1mlc n ARG 125 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1mlc n GLY 126 N 1.96 0.13 3.56 -0.13 0.00 -1.26 -4.87 105.19 104.57 1mlc n GLY 126 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 1mlc n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mlc s ARG 128 N 6.06 2.83 0.00 0.00 0.52 -1.26 -4.99 118.95 122.10 1mlc s ARG 128 Ca 0.54 -0.53 0.10 0.00 -0.52 0.00 0.00 55.73 55.32 1mlc s ARG 128 Cb -0.06 -5.15 0.08 0.00 0.52 0.00 0.00 34.95 30.35 1mlc s ARG 128 CO 0.03 -3.08 0.83 1.28 0.02 0.00 0.00 175.30 174.38