#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mjd n GLU -8 N 0.00 0.00 -3.60 -0.78 0.28 -1.26 -4.74 120.64 110.54 3mjd n GLU -8 Ca 0.00 0.00 -0.37 0.00 -0.16 0.00 0.00 57.16 56.63 3mjd n GLU -8 Cb 0.00 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 32.80 3mjd n GLU -8 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 3mjd s ASN -7 N 0.00 6.52 0.30 -1.84 3.84 -1.26 -5.17 114.94 117.33 3mjd s ASN -7 Ca 0.00 0.61 -0.05 0.00 0.21 0.00 0.00 52.86 53.63 3mjd s ASN -7 Cb 0.00 -2.17 -0.05 0.00 -0.55 0.00 0.00 41.25 38.47 3mjd s ASN -7 CO 0.00 0.23 0.58 -0.76 -2.79 0.00 0.00 177.10 174.35 3mjd s LEU -6 N -0.26 4.03 0.51 3.21 1.43 -1.26 -5.11 118.68 121.23 3mjd s LEU -6 Ca 0.18 0.74 0.06 0.00 -1.03 0.00 0.00 54.13 54.08 3mjd s LEU -6 Cb -0.14 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.56 3mjd s LEU -6 CO 0.06 -0.22 0.70 -0.31 0.23 0.00 0.00 176.35 176.81 3mjd s TYR -5 N -2.13 2.39 -1.32 0.29 2.02 -1.26 -4.63 117.35 112.71 3mjd s TYR -5 Ca 0.44 -0.38 -0.01 0.00 -0.37 0.00 0.00 57.07 56.76 3mjd s TYR -5 Cb -0.11 -2.48 -0.00 0.00 -0.40 0.00 0.00 41.96 38.97 3mjd s TYR -5 CO 0.31 -0.81 0.64 1.19 -1.57 0.00 0.00 175.55 175.31 3mjd n PHE -4 N -2.14 -1.86 -3.70 2.71 3.72 -1.26 -5.11 117.46 109.82 3mjd n PHE -4 Ca 0.10 0.81 -0.39 0.00 -0.05 0.00 0.00 57.45 57.93 3mjd n PHE -4 Cb 0.60 -4.23 -0.12 0.00 -0.94 0.00 0.00 39.48 34.79 3mjd n PHE -4 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3mjd s GLN -3 N -6.08 2.65 0.00 -1.08 -1.52 -1.26 -4.92 119.66 107.46 3mjd s GLN -3 Ca 0.02 -1.20 0.00 0.00 -1.95 0.00 0.00 55.36 52.23 3mjd s GLN -3 Cb -0.01 -3.55 0.00 0.00 -0.22 0.00 0.00 33.01 29.23 3mjd s GLN -3 CO 0.83 -0.71 0.00 0.00 -0.25 0.00 0.00 175.29 175.16 3mjd n ALA 0 N 4.86 0.00 -2.93 6.09 0.00 -1.26 -5.24 120.51 122.03 3mjd n ALA 0 Ca -0.12 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.11 3mjd n ALA 0 Cb 0.45 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.87 3mjd n ALA 0 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3mjd s MET 1 N 2.90 3.30 0.25 0.00 1.00 -1.26 -5.05 119.30 120.44 3mjd s MET 1 Ca 0.00 -0.83 -0.06 0.00 0.00 0.00 0.00 55.69 54.79 3mjd s MET 1 Cb 0.00 -2.80 0.25 0.00 0.00 0.00 0.00 34.83 32.28 3mjd s MET 1 CO 0.00 0.43 1.92 0.35 0.00 0.00 0.00 175.02 177.71 3mjd h PHE 2 N 1.29 1.26 -0.65 -0.03 3.57 -1.99 -2.77 116.94 117.62 3mjd h PHE 2 Ca -0.51 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.04 3mjd h PHE 2 Cb 1.23 -0.42 -0.04 0.00 2.79 0.00 0.00 35.95 39.51 3mjd h PHE 2 CO 0.48 0.80 0.40 0.82 -2.23 0.00 0.00 178.31 178.58 3mjd h ILE 3 N 1.35 1.07 -0.44 1.41 1.08 -1.96 0.23 117.51 120.25 3mjd h ILE 3 Ca 0.36 -0.27 -0.07 0.00 -0.39 0.00 0.00 64.86 64.50 3mjd h ILE 3 Cb -0.13 0.23 -0.02 0.00 -3.07 0.00 0.00 36.82 33.82 3mjd h ILE 3 CO -0.08 0.14 0.00 -0.33 -0.69 0.00 0.00 178.15 177.20 3mjd h GLU 4 N 0.78 0.71 -0.30 2.37 5.08 -1.94 0.32 114.58 121.59 3mjd h GLU 4 Ca 0.26 -0.18 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 3mjd h GLU 4 Cb 0.04 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3mjd h GLU 4 CO -0.11 0.72 -0.07 0.35 -1.00 0.00 0.00 179.01 178.90 3mjd h PHE 5 N 0.67 0.65 -0.50 4.33 3.57 -1.13 -0.58 116.94 123.95 3mjd h PHE 5 Ca 0.13 -0.14 -0.08 0.00 3.53 0.00 0.00 57.97 61.41 3mjd h PHE 5 Cb 0.41 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 3mjd h PHE 5 CO 0.02 0.77 0.00 0.00 -2.23 0.00 0.00 178.31 176.87 3mjd h ALA 6 N 0.79 0.67 -0.19 2.41 0.00 -0.20 -2.58 119.26 120.16 3mjd h ALA 6 Ca 0.08 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3mjd h ALA 6 Cb 0.56 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3mjd h ALA 6 CO 0.03 0.48 -0.00 -0.07 0.00 0.00 0.00 179.25 179.68 3mjd h LEU 7 N 0.74 0.33 -1.04 0.00 3.38 -0.34 -1.34 115.31 117.04 3mjd h LEU 7 Ca 0.14 -0.32 0.14 0.00 0.09 0.00 0.00 57.88 57.93 3mjd h LEU 7 Cb 0.51 -0.09 -0.09 0.00 0.09 0.00 0.00 40.66 41.08 3mjd h LEU 7 CO 0.02 0.57 0.62 0.50 0.09 0.00 0.00 178.44 180.25 3mjd h LYS 8 N 0.09 0.89 -0.60 1.13 3.64 -1.06 -2.52 116.57 118.13 3mjd h LYS 8 Ca 0.05 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3mjd h LYS 8 Cb 0.40 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3mjd h LYS 8 CO 0.01 0.59 0.00 0.09 -2.27 0.00 0.00 179.45 177.87 3mjd n ASN 9 N -4.64 3.50 -0.15 4.20 3.02 -0.98 -4.94 115.26 115.27 3mjd n ASN 9 Ca 0.20 -2.18 -0.02 0.00 -0.03 0.00 0.00 54.58 52.54 3mjd n ASN 9 Cb 0.42 -0.45 -0.01 0.00 -0.61 0.00 0.00 39.78 39.13 3mjd n ASN 9 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3mjd n GLN 10 N 1.01 -0.95 0.00 3.52 1.13 -0.95 -4.87 117.38 116.28 3mjd n GLN 10 Ca 0.20 0.37 -0.18 0.00 -1.94 0.00 0.00 57.00 55.44 3mjd n GLN 10 Cb 0.62 -4.15 -0.09 0.00 0.11 0.00 0.00 30.24 26.72 3mjd n GLN 10 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3mjd h VAL 11 N 0.00 1.29 -3.19 5.09 2.07 -1.51 -3.44 116.25 116.57 3mjd h VAL 11 Ca -0.04 -2.07 -0.64 0.00 0.82 0.00 0.00 66.70 64.77 3mjd h VAL 11 Cb 0.53 2.19 -0.15 0.00 -1.52 0.00 0.00 31.29 32.35 3mjd h VAL 11 CO 0.06 0.65 -0.57 -0.22 0.02 0.00 0.00 177.57 177.50 3mjd s LEU 12 N -8.31 3.81 0.00 2.57 2.96 -1.11 -1.11 118.68 117.49 3mjd s LEU 12 Ca -0.11 0.15 -0.00 0.00 -0.22 0.00 0.00 54.13 53.95 3mjd s LEU 12 Cb 0.07 -1.93 -0.00 0.00 0.50 0.00 0.00 46.19 44.83 3mjd s LEU 12 CO 0.90 0.26 0.00 -0.54 -1.32 0.00 0.00 176.35 175.66 3mjd s LYS 13 N -0.18 0.09 0.07 1.98 1.02 0.24 -4.59 119.74 118.37 3mjd s LYS 13 Ca 0.07 -0.14 0.04 0.00 0.02 0.00 0.00 55.97 55.95 3mjd s LYS 13 Cb -0.12 0.03 -0.04 0.00 -0.52 0.00 0.00 37.83 37.18 3mjd s LYS 13 CO 0.01 -0.01 0.02 -0.06 -0.92 0.00 0.00 175.35 174.39 3mjd s PHE 14 N -0.36 3.06 0.00 3.18 0.08 -1.26 -0.32 117.98 122.36 3mjd s PHE 14 Ca -0.04 0.02 0.00 0.00 0.12 0.00 0.00 56.93 57.03 3mjd s PHE 14 Cb -0.03 -1.59 0.00 0.00 -0.57 0.00 0.00 43.02 40.84 3mjd s PHE 14 CO -0.00 0.49 0.00 0.41 -0.10 0.00 0.00 175.22 176.02 3mjd n GLY 15 N 0.69 -0.08 2.55 4.36 0.00 -0.02 -4.96 105.19 107.74 3mjd n GLY 15 Ca -0.11 -0.34 -0.29 0.00 0.00 0.00 0.00 46.02 45.29 3mjd n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mjd s GLU 16 N 0.00 0.18 0.02 1.61 2.02 -1.26 -4.15 118.70 117.12 3mjd s GLU 16 Ca 0.00 -0.49 0.07 0.00 0.02 0.00 0.00 54.97 54.57 3mjd s GLU 16 Cb 0.00 -1.23 -0.03 0.00 0.10 0.00 0.00 34.13 32.97 3mjd s GLU 16 CO 0.00 -0.99 -0.19 -0.06 0.02 0.00 0.00 175.26 174.04 3mjd s PHE 17 N 2.10 2.52 -0.47 1.61 0.08 0.31 -4.96 117.98 119.17 3mjd s PHE 17 Ca 0.08 -0.28 -0.14 0.00 0.12 0.00 0.00 56.93 56.71 3mjd s PHE 17 Cb -0.16 -1.49 0.08 0.00 -0.57 0.00 0.00 43.02 40.89 3mjd s PHE 17 CO -0.34 0.19 0.38 0.99 -0.10 0.00 0.00 175.22 176.34 3mjd s THR 18 N -0.84 4.96 0.99 0.64 2.01 -1.26 -0.15 115.64 121.99 3mjd s THR 18 Ca 0.13 -1.23 -0.12 0.00 0.31 0.00 0.00 61.69 60.79 3mjd s THR 18 Cb -0.10 -4.02 0.19 0.00 0.01 0.00 0.00 72.50 68.57 3mjd s THR 18 CO 0.03 -0.61 1.08 -0.76 -0.69 0.00 0.00 174.62 173.67 3mjd s LEU 19 N 1.57 1.86 0.16 4.42 1.43 -0.18 -4.88 118.68 123.06 3mjd s LEU 19 Ca 0.04 1.59 -0.16 0.00 -1.03 0.00 0.00 54.13 54.57 3mjd s LEU 19 Cb -0.25 -3.83 0.08 0.00 0.03 0.00 0.00 46.19 42.23 3mjd s LEU 19 CO 0.05 -3.26 1.71 0.11 0.23 0.00 0.00 176.35 175.19 3mjd h LYS 20 N -1.98 0.11 -0.83 1.70 1.57 -1.98 -1.84 116.57 113.33 3mjd h LYS 20 Ca -0.53 -0.01 0.19 0.00 -1.87 0.00 0.00 60.65 58.44 3mjd h LYS 20 Cb 1.30 -0.02 -0.12 0.00 0.08 0.00 0.00 32.23 33.47 3mjd h LYS 20 CO 0.51 0.07 0.31 0.66 -0.57 0.00 0.00 179.45 180.44 3mjd h SER 21 N 0.11 0.23 0.00 0.86 4.64 -2.04 -3.45 113.55 113.90 3mjd h SER 21 Ca 0.18 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 3mjd h SER 21 Cb 0.24 0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3mjd h SER 21 CO -0.29 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.29 3mjd n GLY 22 N -1.34 0.88 3.77 -0.77 0.00 -0.69 -5.13 105.19 101.90 3mjd n GLY 22 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 3mjd n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mjd s ARG 23 N 0.00 3.57 -0.48 1.61 0.52 -1.26 -4.72 118.95 118.19 3mjd s ARG 23 Ca 0.00 1.83 -0.15 0.00 -0.52 0.00 0.00 55.73 56.89 3mjd s ARG 23 Cb 0.00 -2.31 0.08 0.00 0.52 0.00 0.00 34.95 33.24 3mjd s ARG 23 CO 0.00 -0.72 0.40 0.42 0.02 0.00 0.00 175.30 175.42 3mjd s ILE 24 N -1.54 5.10 -0.01 1.52 -1.09 -1.26 -1.01 121.20 122.91 3mjd s ILE 24 Ca 0.67 -1.19 -0.07 0.00 -2.23 0.00 0.00 60.65 57.83 3mjd s ILE 24 Cb -0.30 -4.10 -0.05 0.00 -1.58 0.00 0.00 42.46 36.44 3mjd s ILE 24 CO 0.36 -0.62 0.26 -0.55 -1.23 0.00 0.00 174.94 173.15 3mjd s SER 25 N 2.72 6.50 0.00 3.58 0.15 0.78 -4.89 113.70 122.53 3mjd s SER 25 Ca 0.04 0.57 0.30 0.00 0.70 0.00 0.00 55.95 57.56 3mjd s SER 25 Cb -0.25 -2.09 1.64 0.00 -1.71 0.00 0.00 66.02 63.60 3mjd s SER 25 CO 0.05 0.28 2.09 -0.81 1.20 0.00 0.00 173.24 176.06 3mjd n PRO 26 N 1.29 0.65 -3.83 5.44 -0.04 -1.26 -0.53 135.00 136.71 3mjd n PRO 26 Ca -0.13 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.24 3mjd n PRO 26 Cb 0.53 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.42 3mjd n PRO 26 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3mjd s TYR 27 N -2.34 0.09 -0.01 0.54 -0.85 -1.26 -0.84 117.35 112.69 3mjd s TYR 27 Ca 0.36 -0.44 0.01 0.00 -0.52 0.00 0.00 57.07 56.48 3mjd s TYR 27 Cb 0.20 -0.02 -0.00 0.00 0.38 0.00 0.00 41.96 42.52 3mjd s TYR 27 CO 0.41 -0.52 -0.04 0.12 -1.52 0.00 0.00 175.55 173.99 3mjd s PHE 28 N -3.47 0.42 -0.02 -3.49 5.36 0.56 -4.86 117.98 112.47 3mjd s PHE 28 Ca 0.02 -0.08 0.00 0.00 -0.96 0.00 0.00 56.93 55.91 3mjd s PHE 28 Cb 0.03 -0.28 0.03 0.00 -0.34 0.00 0.00 43.02 42.46 3mjd s PHE 28 CO -0.09 -0.01 0.02 0.12 -1.46 0.00 0.00 175.22 173.80 3mjd s PHE 29 N -0.05 0.11 -0.35 10.12 5.36 -1.25 -0.59 117.98 131.33 3mjd s PHE 29 Ca 0.01 0.09 0.03 0.00 -0.96 0.00 0.00 56.93 56.10 3mjd s PHE 29 Cb -0.02 -0.30 0.15 0.00 -0.34 0.00 0.00 43.02 42.51 3mjd s PHE 29 CO -0.00 -0.10 0.38 1.21 -1.46 0.00 0.00 175.22 175.24 3mjd s ASN 30 N 1.09 1.04 0.35 6.13 3.84 -0.27 -4.99 114.94 122.14 3mjd s ASN 30 Ca -0.09 -1.24 0.24 0.00 0.21 0.00 0.00 52.86 51.98 3mjd s ASN 30 Cb -0.13 0.68 1.27 0.00 -0.55 0.00 0.00 41.25 42.52 3mjd s ASN 30 CO -0.03 -0.29 1.73 0.00 -2.79 0.00 0.00 177.10 175.72 3mjd h ALA 31 N 7.43 1.00 -0.54 1.71 0.00 -1.98 -2.17 119.26 124.70 3mjd h ALA 31 Ca -0.00 0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.06 3mjd h ALA 31 Cb 1.07 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3mjd h ALA 31 CO 0.23 0.00 0.40 0.78 0.00 0.00 0.00 179.25 180.66 3mjd h GLY 32 N 0.20 0.00 2.00 0.00 0.00 -1.96 -1.59 103.07 101.72 3mjd h GLY 32 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3mjd h GLY 32 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 3mjd n LEU 33 N -4.29 0.07 -4.02 3.11 4.77 -0.82 -4.17 117.00 111.65 3mjd n LEU 33 Ca 0.10 0.51 -0.42 0.00 -0.03 0.00 0.00 56.01 56.18 3mjd n LEU 33 Cb 0.63 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 3mjd n LEU 33 CO 0.36 -0.24 2.34 0.49 -1.33 0.00 0.00 177.39 179.01 3mjd n PHE 34 N -1.57 3.63 -1.02 -1.77 3.72 -0.60 -4.76 117.46 115.09 3mjd n PHE 34 Ca 0.04 -2.71 0.00 0.00 -0.05 0.00 0.00 57.45 54.73 3mjd n PHE 34 Cb 0.20 -2.49 0.32 0.00 -0.94 0.00 0.00 39.48 36.58 3mjd n PHE 34 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 3mjd n ASN 35 N 7.45 4.85 -4.29 4.37 0.23 -1.26 -4.25 115.26 122.36 3mjd n ASN 35 Ca 0.50 -3.14 -0.18 0.00 -0.53 0.00 0.00 54.58 51.23 3mjd n ASN 35 Cb 0.42 -0.69 -0.11 0.00 -2.08 0.00 0.00 39.78 37.32 3mjd n ASN 35 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 3mjd s THR 36 N -2.92 1.51 0.26 5.53 -4.23 -1.26 -5.04 115.64 109.48 3mjd s THR 36 Ca 0.53 -1.92 -0.02 0.00 -1.18 0.00 0.00 61.69 59.10 3mjd s THR 36 Cb 0.42 -1.76 0.24 0.00 1.34 0.00 0.00 72.50 72.73 3mjd s THR 36 CO 0.13 -0.48 1.77 1.23 -0.54 0.00 0.00 174.62 176.73 3mjd h GLY 37 N 3.14 1.36 1.01 3.99 0.00 -1.99 -0.74 103.07 109.84 3mjd h GLY 37 Ca -0.39 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 46.64 3mjd h GLY 37 CO 0.55 0.00 0.35 0.00 0.00 0.00 0.00 176.54 177.44 3mjd h ALA 38 N 1.53 0.93 -0.43 3.60 0.00 -1.98 0.41 119.26 123.33 3mjd h ALA 38 Ca 0.45 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 3mjd h ALA 38 Cb 0.59 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3mjd h ALA 38 CO -0.34 0.49 -0.06 1.96 0.00 0.00 0.00 179.25 181.31 3mjd h GLN 39 N 1.01 0.80 -0.32 0.00 4.20 -1.62 -2.09 115.11 117.09 3mjd h GLN 39 Ca 0.25 -0.29 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 3mjd h GLN 39 Cb 0.11 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 3mjd h GLN 39 CO -0.03 0.90 0.03 1.25 -0.67 0.00 0.00 178.83 180.31 3mjd h LEU 40 N 0.63 0.52 -0.46 1.46 5.85 -1.02 -0.20 115.31 122.10 3mjd h LEU 40 Ca 0.12 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.59 3mjd h LEU 40 Cb 0.57 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 3mjd h LEU 40 CO 0.03 0.67 0.24 0.00 -0.34 0.00 0.00 178.44 179.04 3mjd h ALA 41 N 0.87 0.58 -0.24 1.25 0.00 -0.91 0.82 119.26 121.62 3mjd h ALA 41 Ca 0.09 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3mjd h ALA 41 Cb 0.38 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3mjd h ALA 41 CO 0.01 -0.11 0.05 1.15 0.00 0.00 0.00 179.25 180.35 3mjd h THR 42 N 0.47 1.22 -0.35 0.00 2.02 -1.24 -0.72 112.91 114.30 3mjd h THR 42 Ca 0.20 -0.71 0.06 0.00 0.77 0.00 0.00 66.41 66.73 3mjd h THR 42 Cb 0.10 1.22 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 3mjd h THR 42 CO -0.13 0.23 0.03 0.25 0.37 0.00 0.00 175.52 176.26 3mjd h LEU 43 N 0.22 -0.08 -1.53 2.58 5.85 -0.81 -1.46 115.31 120.08 3mjd h LEU 43 Ca 0.08 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.89 3mjd h LEU 43 Cb 0.29 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 3mjd h LEU 43 CO 0.00 -0.00 0.35 0.00 -0.34 0.00 0.00 178.44 178.45 3mjd h ALA 44 N 1.28 1.73 -0.41 1.25 0.00 -0.64 -1.22 119.26 121.26 3mjd h ALA 44 Ca 0.17 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 3mjd h ALA 44 Cb 0.21 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3mjd h ALA 44 CO -0.25 0.22 -0.16 0.22 0.00 0.00 0.00 179.25 179.27 3mjd h ASP 45 N 0.61 0.84 -0.64 0.00 3.58 -0.23 0.14 116.42 120.73 3mjd h ASP 45 Ca 0.21 -0.39 -0.02 0.00 0.42 0.00 0.00 57.03 57.24 3mjd h ASP 45 Cb 0.07 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 40.86 3mjd h ASP 45 CO -0.05 1.05 0.32 1.88 -2.88 0.00 0.00 179.24 179.55 3mjd h TYR 46 N 0.64 0.93 -0.17 0.28 0.05 -0.47 -0.33 116.97 117.89 3mjd h TYR 46 Ca 0.09 -0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.81 3mjd h TYR 46 Cb 0.71 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 38.15 3mjd h TYR 46 CO 0.05 0.68 -0.02 1.88 -1.05 0.00 0.00 178.16 179.70 3mjd h TYR 47 N 0.94 0.35 -0.94 4.88 0.05 -0.92 -2.58 116.97 118.75 3mjd h TYR 47 Ca 0.23 -0.07 0.03 0.00 0.05 0.00 0.00 58.73 58.97 3mjd h TYR 47 Cb 0.09 -0.09 -0.05 0.00 1.01 0.00 0.00 36.73 37.69 3mjd h TYR 47 CO 0.01 0.56 0.61 0.00 -1.05 0.00 0.00 178.16 178.30 3mjd h ALA 48 N 0.74 1.23 -0.74 3.88 0.00 -0.35 -0.89 119.26 123.13 3mjd h ALA 48 Ca 0.05 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3mjd h ALA 48 Cb 0.44 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3mjd h ALA 48 CO 0.01 0.51 0.27 1.96 0.00 0.00 0.00 179.25 182.01 3mjd h GLN 49 N 1.21 1.12 -0.22 0.00 4.20 -1.05 0.25 115.11 120.61 3mjd h GLN 49 Ca 0.37 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 3mjd h GLN 49 Cb -0.04 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 3mjd h GLN 49 CO -0.11 0.93 0.05 1.25 -0.67 0.00 0.00 178.83 180.28 3mjd h LEU 50 N 1.07 0.34 -0.34 1.46 6.46 -1.02 0.23 115.31 123.51 3mjd h LEU 50 Ca 0.24 -0.24 0.03 0.00 -0.12 0.00 0.00 57.88 57.80 3mjd h LEU 50 Cb 0.25 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.05 3mjd h LEU 50 CO -0.02 0.49 0.15 0.40 -0.62 0.00 0.00 178.44 178.84 3mjd h ILE 51 N 0.18 0.95 -0.05 4.05 2.04 -0.95 0.99 117.51 124.72 3mjd h ILE 51 Ca 0.07 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 3mjd h ILE 51 Cb 0.28 0.61 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 3mjd h ILE 51 CO 0.00 0.06 0.02 0.40 0.00 0.00 0.00 178.15 178.63 3mjd h ILE 52 N 0.32 1.17 -0.62 -0.67 2.04 -0.83 -3.10 117.51 115.83 3mjd h ILE 52 Ca 0.15 -0.52 -0.06 0.00 1.00 0.00 0.00 64.86 65.42 3mjd h ILE 52 Cb 0.08 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 3mjd h ILE 52 CO -0.12 0.14 0.14 0.50 0.00 0.00 0.00 178.15 178.81 3mjd h LYS 53 N -0.11 0.99 0.00 2.37 3.64 -0.33 -2.81 116.57 120.32 3mjd h LYS 53 Ca 0.02 -0.24 -0.01 0.00 -1.27 0.00 0.00 60.65 59.14 3mjd h LYS 53 Cb 0.22 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3mjd h LYS 53 CO -0.00 0.91 -0.05 0.66 -2.27 0.00 0.00 179.45 178.70 3mjd h SER 54 N 0.91 0.00 -1.81 4.20 4.64 -0.84 -3.46 113.55 117.18 3mjd h SER 54 Ca 0.19 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 61.11 3mjd h SER 54 Cb 0.37 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.36 3mjd h SER 54 CO 0.00 0.05 -0.43 -0.67 -0.87 0.00 0.00 176.83 174.91 3mjd n ASP 55 N -3.39 -5.54 -4.75 4.97 2.03 -1.06 -4.95 116.55 103.87 3mjd n ASP 55 Ca -0.02 0.26 -0.41 0.00 0.52 0.00 0.00 54.79 55.14 3mjd n ASP 55 Cb 0.18 -4.69 -0.02 0.00 -0.72 0.00 0.00 41.12 35.88 3mjd n ASP 55 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3mjd s VAL 56 N -2.86 2.56 -0.16 5.18 0.11 -1.26 -4.98 120.40 119.01 3mjd s VAL 56 Ca 0.00 0.48 -0.14 0.00 -2.93 0.00 0.00 61.98 59.39 3mjd s VAL 56 Cb 0.00 -3.30 -0.05 0.00 -1.53 0.00 0.00 36.38 31.50 3mjd s VAL 56 CO 0.00 0.08 0.29 -0.54 -3.33 0.00 0.00 175.10 171.60 3mjd s LYS 57 N -0.44 4.23 0.22 1.54 -0.14 -1.26 -5.02 119.74 118.87 3mjd s LYS 57 Ca 0.60 0.09 -0.23 0.00 -1.36 0.00 0.00 55.97 55.07 3mjd s LYS 57 Cb -0.43 -3.42 0.04 0.00 -1.68 0.00 0.00 37.83 32.35 3mjd s LYS 57 CO 0.44 0.26 0.75 1.52 -0.76 0.00 0.00 175.35 177.57 3mjd s TYR 58 N 0.41 -0.25 -0.20 3.18 -0.85 -1.26 -4.86 117.35 113.50 3mjd s TYR 58 Ca 0.16 -0.12 0.05 0.00 -0.52 0.00 0.00 57.07 56.64 3mjd s TYR 58 Cb -0.13 0.66 -0.16 0.00 0.38 0.00 0.00 41.96 42.71 3mjd s TYR 58 CO 0.04 -1.05 -0.13 -0.25 -1.52 0.00 0.00 175.55 172.63 3mjd n ASP 59 N -0.44 1.99 -3.95 -0.18 8.00 0.93 -5.00 116.55 117.91 3mjd n ASP 59 Ca -0.07 -0.09 -0.15 0.00 0.71 0.00 0.00 54.79 55.19 3mjd n ASP 59 Cb 0.61 -0.05 -0.14 0.00 -0.02 0.00 0.00 41.12 41.51 3mjd n ASP 59 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3mjd s ILE 60 N -2.43 0.37 -0.15 0.53 1.01 -1.01 -4.36 121.20 115.16 3mjd s ILE 60 Ca -0.24 -0.19 -0.26 0.00 0.00 0.00 0.00 60.65 59.95 3mjd s ILE 60 Cb 0.07 -0.31 -0.01 0.00 0.01 0.00 0.00 42.46 42.21 3mjd s ILE 60 CO 0.54 0.11 0.87 -0.76 0.00 0.00 0.00 174.94 175.70 3mjd s LEU 61 N -0.08 4.20 -0.19 2.97 1.43 -0.52 -1.37 118.68 125.12 3mjd s LEU 61 Ca 0.01 1.27 -0.03 0.00 -1.03 0.00 0.00 54.13 54.36 3mjd s LEU 61 Cb -0.02 -3.31 -0.01 0.00 0.03 0.00 0.00 46.19 42.87 3mjd s LEU 61 CO -0.00 -0.40 -0.07 0.12 0.23 0.00 0.00 176.35 176.23 3mjd s PHE 62 N 2.03 2.92 -0.31 0.29 5.36 0.13 -0.78 117.98 127.62 3mjd s PHE 62 Ca 0.41 -0.81 -0.00 0.00 -0.96 0.00 0.00 56.93 55.57 3mjd s PHE 62 Cb -0.17 -2.01 0.07 0.00 -0.34 0.00 0.00 43.02 40.57 3mjd s PHE 62 CO 0.14 -0.40 0.02 0.20 -1.46 0.00 0.00 175.22 173.72 3mjd s GLY 63 N 1.02 1.80 0.46 13.12 0.00 -0.25 -1.39 107.32 122.07 3mjd s GLY 63 Ca -0.00 -1.99 -0.22 0.00 0.00 0.00 0.00 44.72 42.51 3mjd s GLY 63 CO -0.00 0.76 1.11 2.56 0.00 0.00 0.00 173.10 177.53 3mjd s PRO 64 N 1.16 3.81 0.38 2.90 0.04 -1.26 -3.47 135.00 138.55 3mjd s PRO 64 Ca -0.02 1.62 -0.26 0.00 0.04 0.00 0.00 61.00 62.38 3mjd s PRO 64 Cb -0.20 -2.34 -0.09 0.00 0.04 0.00 0.00 34.50 31.91 3mjd s PRO 64 CO -0.03 -0.47 1.21 0.00 0.04 0.00 0.00 177.00 177.74 3mjd s ALA 65 N -1.67 3.26 -0.19 8.56 0.00 -1.26 -1.23 121.76 129.23 3mjd s ALA 65 Ca 0.64 1.05 0.15 0.00 0.00 0.00 0.00 51.96 53.80 3mjd s ALA 65 Cb -0.24 -3.41 -0.22 0.00 0.00 0.00 0.00 23.12 19.25 3mjd s ALA 65 CO 0.30 -0.56 0.03 0.66 0.00 0.00 0.00 175.76 176.19 3mjd n TYR 66 N 0.33 0.00 0.01 0.00 4.01 -1.26 -4.81 117.16 115.44 3mjd n TYR 66 Ca 0.03 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.75 3mjd n TYR 66 Cb 0.45 -0.91 0.24 0.00 -0.31 0.00 0.00 39.34 38.82 3mjd n TYR 66 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 3mjd h LYS 67 N 0.00 0.50 0.00 -0.72 1.79 -1.97 -3.08 116.57 113.09 3mjd h LYS 67 Ca -0.50 -0.15 -0.05 0.00 -2.18 0.00 0.00 60.65 57.77 3mjd h LYS 67 Cb 2.10 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 32.69 3mjd h LYS 67 CO 0.01 0.63 -0.23 0.78 -1.08 0.00 0.00 179.45 179.57 3mjd h GLY 68 N 0.94 0.00 0.81 3.86 0.00 -1.35 -3.26 103.07 104.07 3mjd h GLY 68 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.38 3mjd h GLY 68 CO 0.03 0.00 -0.31 -2.22 0.00 0.00 0.00 176.54 174.04 3mjd h ILE 69 N 0.00 0.25 0.00 2.60 2.04 -1.52 -0.26 117.51 120.61 3mjd h ILE 69 Ca -0.00 -0.26 -0.05 0.00 1.00 0.00 0.00 64.86 65.54 3mjd h ILE 69 Cb 0.51 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 3mjd h ILE 69 CO 0.03 0.03 -0.26 1.55 0.00 0.00 0.00 178.15 179.50 3mjd h PRO 70 N -1.06 0.00 -0.01 2.37 0.13 -1.74 -1.52 132.00 130.17 3mjd h PRO 70 Ca -0.09 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.04 3mjd h PRO 70 Cb 0.70 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.83 3mjd h PRO 70 CO 0.14 0.26 0.00 -0.07 -0.23 0.00 0.00 178.00 178.10 3mjd h LEU 71 N 0.00 0.01 -0.80 1.56 3.38 -1.57 -1.16 115.31 116.73 3mjd h LEU 71 Ca -0.00 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.72 3mjd h LEU 71 Cb 0.46 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 3mjd h LEU 71 CO 0.03 0.20 0.23 0.58 0.09 0.00 0.00 178.44 179.57 3mjd h VAL 72 N -0.17 1.26 -0.32 1.22 2.07 -0.85 0.23 116.25 119.69 3mjd h VAL 72 Ca 0.00 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 3mjd h VAL 72 Cb 0.19 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3mjd h VAL 72 CO -0.00 0.35 0.17 0.00 0.02 0.00 0.00 177.57 178.11 3mjd h ALA 73 N 1.16 0.41 -0.31 1.67 0.00 -1.16 -0.54 119.26 120.49 3mjd h ALA 73 Ca 0.24 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 3mjd h ALA 73 Cb 0.29 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3mjd h ALA 73 CO -0.01 -0.05 -0.23 0.00 0.00 0.00 0.00 179.25 178.96 3mjd h ALA 74 N 1.03 0.45 -0.33 0.00 0.00 -0.97 -2.07 119.26 117.38 3mjd h ALA 74 Ca 0.11 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3mjd h ALA 74 Cb 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3mjd h ALA 74 CO -0.02 0.42 0.18 0.82 0.00 0.00 0.00 179.25 180.65 3mjd h ILE 75 N 0.46 1.13 0.00 0.00 2.04 -0.50 -0.08 117.51 120.56 3mjd h ILE 75 Ca 0.06 -0.35 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 3mjd h ILE 75 Cb 0.78 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 3mjd h ILE 75 CO 0.06 0.13 -0.24 0.77 0.00 0.00 0.00 178.15 178.88 3mjd h SER 76 N 0.41 0.00 -0.04 1.72 4.64 -1.08 0.73 113.55 119.93 3mjd h SER 76 Ca 0.11 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.40 3mjd h SER 76 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 3mjd h SER 76 CO -0.02 0.24 -0.11 0.74 -0.87 0.00 0.00 176.83 176.81 3mjd h THR 77 N 0.00 1.46 -0.65 2.95 2.02 -1.03 -2.96 112.91 114.71 3mjd h THR 77 Ca -0.00 -1.53 -0.01 0.00 0.77 0.00 0.00 66.41 65.64 3mjd h THR 77 Cb 0.47 2.38 -0.03 0.00 -1.74 0.00 0.00 68.15 69.23 3mjd h THR 77 CO 0.03 0.42 0.38 0.58 0.37 0.00 0.00 175.52 177.30 3mjd h VAL 78 N -0.42 1.19 -0.98 3.16 2.07 -0.69 -0.59 116.25 119.99 3mjd h VAL 78 Ca -0.00 -0.44 0.08 0.00 0.82 0.00 0.00 66.70 67.15 3mjd h VAL 78 Cb 0.73 0.32 -0.07 0.00 -1.52 0.00 0.00 31.29 30.75 3mjd h VAL 78 CO 0.02 0.20 0.62 -0.07 0.02 0.00 0.00 177.57 178.37 3mjd h LEU 79 N 0.88 0.98 0.06 2.57 3.38 -0.93 0.67 115.31 122.91 3mjd h LEU 79 Ca 0.23 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 3mjd h LEU 79 Cb -0.01 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.56 3mjd h LEU 79 CO -0.04 0.60 -0.03 0.00 0.09 0.00 0.00 178.44 179.07 3mjd h ALA 80 N 1.46 -0.08 -0.13 1.53 0.00 -1.04 0.14 119.26 121.15 3mjd h ALA 80 Ca 0.44 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3mjd h ALA 80 Cb 0.23 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3mjd h ALA 80 CO -0.19 -0.17 -0.06 -0.07 0.00 0.00 0.00 179.25 178.76 3mjd h LEU 81 N -0.83 0.27 0.10 0.00 4.07 -1.05 -2.77 115.31 115.10 3mjd h LEU 81 Ca -0.01 -0.41 -0.35 0.00 0.08 0.00 0.00 57.88 57.19 3mjd h LEU 81 Cb 0.64 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.28 3mjd h LEU 81 CO 0.01 0.62 -1.96 1.17 -1.08 0.00 0.00 178.44 177.20 3mjd n LYS 82 N -4.69 0.74 -0.11 1.13 4.81 0.22 -3.83 118.16 116.43 3mjd n LYS 82 Ca -0.06 0.26 0.07 0.00 -0.87 0.00 0.00 58.31 57.71 3mjd n LYS 82 Cb 0.28 -1.72 0.12 0.00 0.02 0.00 0.00 35.03 33.73 3mjd n LYS 82 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3mjd n TYR 83 N -3.40 0.28 -3.01 5.64 4.01 -0.92 -4.99 117.16 114.77 3mjd n TYR 83 Ca -0.30 -0.25 -0.21 0.00 -0.16 0.00 0.00 57.90 56.98 3mjd n TYR 83 Cb 1.05 -0.01 0.01 0.00 -0.31 0.00 0.00 39.34 40.08 3mjd n TYR 83 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3mjd n ASN 84 N 0.76 -4.98 -4.34 7.72 5.15 -0.50 -4.93 115.26 114.15 3mjd n ASN 84 Ca 0.11 -0.24 -0.35 0.00 -0.60 0.00 0.00 54.58 53.51 3mjd n ASN 84 Cb 0.40 -4.08 -0.14 0.00 -0.53 0.00 0.00 39.78 35.43 3mjd n ASN 84 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3mjd s ILE 85 N -3.01 3.37 -0.60 -1.44 1.01 0.37 -4.95 121.20 115.96 3mjd s ILE 85 Ca 0.27 -0.50 -0.11 0.00 0.00 0.00 0.00 60.65 60.30 3mjd s ILE 85 Cb -0.13 -2.51 0.15 0.00 0.01 0.00 0.00 42.46 39.98 3mjd s ILE 85 CO 0.34 0.45 0.50 -0.62 0.00 0.00 0.00 174.94 175.60 3mjd s ASP 86 N 1.18 6.04 -0.14 3.58 2.15 -1.26 -2.11 116.67 126.10 3mjd s ASP 86 Ca 0.02 -2.19 -0.06 0.00 0.43 0.00 0.00 52.55 50.76 3mjd s ASP 86 Cb -0.14 -2.09 -0.04 0.00 -0.30 0.00 0.00 42.92 40.34 3mjd s ASP 86 CO -0.01 -0.67 0.05 -0.32 -0.17 0.00 0.00 175.17 174.05 3mjd s MET 87 N 0.95 3.61 0.53 4.34 1.75 -1.26 -5.10 119.30 124.12 3mjd s MET 87 Ca 0.09 -0.34 -0.21 0.00 -1.25 0.00 0.00 55.69 53.99 3mjd s MET 87 Cb -0.23 -3.08 -0.06 0.00 2.84 0.00 0.00 34.83 34.31 3mjd s MET 87 CO -0.02 0.47 1.18 -2.14 -0.65 0.00 0.00 175.02 173.85 3mjd s PRO 88 N -0.18 3.38 0.10 4.11 0.02 -1.26 -4.91 135.00 136.26 3mjd s PRO 88 Ca 0.07 1.76 0.01 0.00 0.02 0.00 0.00 61.00 62.86 3mjd s PRO 88 Cb -0.12 -2.14 -0.04 0.00 0.02 0.00 0.00 34.50 32.22 3mjd s PRO 88 CO 0.01 -0.86 -0.04 1.52 -0.33 0.00 0.00 177.00 177.31 3mjd s TYR 89 N -1.62 0.85 0.08 6.54 -0.85 -1.26 -1.44 117.35 119.65 3mjd s TYR 89 Ca 0.71 -1.00 -0.17 0.00 -0.52 0.00 0.00 57.07 56.09 3mjd s TYR 89 Cb -0.28 -0.51 0.04 0.00 0.38 0.00 0.00 41.96 41.59 3mjd s TYR 89 CO 0.32 -0.25 0.41 0.00 -1.52 0.00 0.00 175.55 174.52 3mjd s ALA 90 N -3.74 -0.99 0.14 9.51 0.00 0.04 -0.82 121.76 125.90 3mjd s ALA 90 Ca 0.14 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.26 3mjd s ALA 90 Cb 0.06 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.65 3mjd s ALA 90 CO -0.04 -0.55 0.00 -0.06 0.00 0.00 0.00 175.76 175.11 3mjd s PHE 91 N -3.11 1.03 0.26 0.00 0.08 -0.67 -1.10 117.98 114.48 3mjd s PHE 91 Ca -0.01 -1.05 0.01 0.00 0.12 0.00 0.00 56.93 55.99 3mjd s PHE 91 Cb 0.00 -0.60 0.01 0.00 -0.57 0.00 0.00 43.02 41.87 3mjd s PHE 91 CO -0.07 -0.28 0.07 -0.40 -0.10 0.00 0.00 175.22 174.44 3mjd n ASP 92 N -0.15 2.41 -4.44 1.36 5.75 -1.23 -1.08 116.55 119.17 3mjd n ASP 92 Ca -0.08 -2.04 -0.29 0.00 -0.01 0.00 0.00 54.79 52.37 3mjd n ASP 92 Cb 0.63 0.11 -0.12 0.00 -1.03 0.00 0.00 41.12 40.70 3mjd n ASP 92 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3mjd s ARG 93 N -2.97 1.67 0.25 0.11 0.52 -1.22 -4.30 118.95 113.01 3mjd s ARG 93 Ca 0.05 -1.22 -0.02 0.00 -0.52 0.00 0.00 55.73 54.03 3mjd s ARG 93 Cb -0.00 -2.03 0.29 0.00 0.52 0.00 0.00 34.95 33.72 3mjd s ARG 93 CO 0.03 0.48 1.69 -0.22 0.02 0.00 0.00 175.30 177.30 3mjd h LYS 94 N 3.93 0.68 0.00 3.54 1.63 -1.95 -3.46 116.57 120.94 3mjd h LYS 94 Ca -0.50 -0.25 0.00 0.00 -0.85 0.00 0.00 60.65 59.05 3mjd h LYS 94 Cb 1.17 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.75 3mjd h LYS 94 CO 0.43 0.82 0.00 -0.85 -3.45 0.00 0.00 179.45 176.41 3mjd n GLU 95 N -4.14 0.00 0.00 1.90 0.28 -1.26 -5.10 120.64 112.32 3mjd n GLU 95 Ca 0.00 0.16 0.00 0.00 -0.16 0.00 0.00 57.16 57.16 3mjd n GLU 95 Cb 0.40 -0.60 0.00 0.00 1.43 0.00 0.00 31.44 32.67 3mjd n GLU 95 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3mjd n GLY 103 N -0.33 0.00 0.15 -1.84 0.00 -1.26 -5.21 105.19 96.69 3mjd n GLY 103 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3mjd n GLY 103 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3mjd h VAL 104 N 0.00 1.29 -2.83 1.61 2.07 -1.99 -3.46 116.25 112.93 3mjd h VAL 104 Ca 0.00 -1.07 -0.63 0.00 0.82 0.00 0.00 66.70 65.82 3mjd h VAL 104 Cb 0.00 1.55 -0.16 0.00 -1.52 0.00 0.00 31.29 31.16 3mjd h VAL 104 CO 0.00 0.33 -0.77 -0.36 0.02 0.00 0.00 177.57 176.79 3mjd s PHE 105 N -4.71 2.42 0.16 1.57 0.08 -1.26 -3.40 117.98 112.83 3mjd s PHE 105 Ca -0.14 -0.31 0.04 0.00 0.12 0.00 0.00 56.93 56.65 3mjd s PHE 105 Cb 0.07 -1.15 -0.05 0.00 -0.57 0.00 0.00 43.02 41.32 3mjd s PHE 105 CO 0.75 0.56 -0.08 0.14 -0.10 0.00 0.00 175.22 176.50 3mjd s VAL 106 N -1.93 1.10 0.00 -0.44 -7.23 -0.24 -5.00 120.40 106.67 3mjd s VAL 106 Ca 0.25 -2.05 0.00 0.00 -1.81 0.00 0.00 61.98 58.37 3mjd s VAL 106 Cb -0.07 -1.94 0.00 0.00 0.56 0.00 0.00 36.38 34.93 3mjd s VAL 106 CO 0.13 -0.67 0.00 0.61 -0.31 0.00 0.00 175.10 174.86 3mjd n GLY 107 N -0.23 -0.60 3.77 2.32 0.00 -1.26 -1.67 105.19 107.52 3mjd n GLY 107 Ca -0.09 -1.58 -0.40 0.00 0.00 0.00 0.00 46.02 43.95 3mjd n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mjd s ALA 108 N -1.59 3.25 -0.07 4.61 0.00 -0.00 -4.92 121.76 123.03 3mjd s ALA 108 Ca 0.00 1.41 -0.30 0.00 0.00 0.00 0.00 51.96 53.08 3mjd s ALA 108 Cb 0.00 -3.57 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 3mjd s ALA 108 CO 0.00 -1.11 1.61 0.34 0.00 0.00 0.00 175.76 176.60 3mjd s ASP 109 N -0.56 6.69 0.00 0.00 -1.08 -1.26 -4.72 116.67 115.74 3mjd s ASP 109 Ca 0.60 2.17 0.26 0.00 -0.52 0.00 0.00 52.55 55.06 3mjd s ASP 109 Cb -0.42 -2.53 0.64 0.00 -1.46 0.00 0.00 42.92 39.15 3mjd s ASP 109 CO 0.55 -0.91 1.51 0.23 0.52 0.00 0.00 175.17 177.06 3mjd n MET 110 N 7.08 1.59 -1.68 4.34 2.81 -1.26 -4.90 117.12 125.11 3mjd n MET 110 Ca 0.17 -1.10 -0.45 0.00 -1.81 0.00 0.00 57.70 54.50 3mjd n MET 110 Cb 0.43 -1.48 -0.04 0.00 -0.71 0.00 0.00 33.22 31.42 3mjd n MET 110 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 3mjd n THR 111 N 0.26 0.07 -2.05 2.03 -1.04 -1.26 -1.21 114.28 111.08 3mjd n THR 111 Ca 0.15 -0.01 -0.21 0.00 -2.04 0.00 0.00 64.05 61.94 3mjd n THR 111 Cb 0.43 -1.67 -0.04 0.00 -1.82 0.00 0.00 70.33 67.22 3mjd n THR 111 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3mjd n ASN 112 N 3.89 -5.68 -4.68 8.00 3.02 -0.90 -4.96 115.26 113.94 3mjd n ASN 112 Ca 0.17 0.22 -0.24 0.00 -0.03 0.00 0.00 54.58 54.70 3mjd n ASN 112 Cb 0.30 -4.85 -0.08 0.00 -0.61 0.00 0.00 39.78 34.54 3mjd n ASN 112 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3mjd s LYS 113 N -4.48 2.18 -0.17 3.52 -0.14 -0.35 -4.97 119.74 115.33 3mjd s LYS 113 Ca 0.00 -1.72 -0.08 0.00 -1.36 0.00 0.00 55.97 52.81 3mjd s LYS 113 Cb 0.00 -2.00 -0.04 0.00 -1.68 0.00 0.00 37.83 34.11 3mjd s LYS 113 CO 0.00 0.08 0.11 0.15 -0.76 0.00 0.00 175.35 174.92 3mjd s LYS 114 N -3.79 3.90 0.11 1.68 1.02 -1.26 -0.66 119.74 120.74 3mjd s LYS 114 Ca 0.37 -0.25 0.08 0.00 0.02 0.00 0.00 55.97 56.19 3mjd s LYS 114 Cb 0.00 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 34.00 3mjd s LYS 114 CO 0.21 0.42 -0.21 0.14 -0.92 0.00 0.00 175.35 174.99 3mjd s VAL 115 N -0.02 1.72 -0.26 3.17 -7.23 0.99 -0.05 120.40 118.72 3mjd s VAL 115 Ca 0.08 -1.57 -0.08 0.00 -1.81 0.00 0.00 61.98 58.60 3mjd s VAL 115 Cb -0.12 -1.58 -0.03 0.00 0.56 0.00 0.00 36.38 35.22 3mjd s VAL 115 CO 0.00 -0.08 0.10 -0.22 -0.31 0.00 0.00 175.10 174.59 3mjd s LEU 116 N -1.96 3.62 -0.21 1.32 2.96 -0.47 0.13 118.68 124.07 3mjd s LEU 116 Ca 0.07 -0.25 -0.24 0.00 -0.22 0.00 0.00 54.13 53.50 3mjd s LEU 116 Cb -0.10 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.62 3mjd s LEU 116 CO 0.04 -0.07 0.77 -0.22 -1.32 0.00 0.00 176.35 175.56 3mjd s LEU 117 N 1.63 4.13 -0.18 -0.68 0.20 -0.12 -0.69 118.68 122.97 3mjd s LEU 117 Ca 0.06 1.01 -0.03 0.00 0.69 0.00 0.00 54.13 55.86 3mjd s LEU 117 Cb -0.16 -3.11 -0.02 0.00 -0.43 0.00 0.00 46.19 42.48 3mjd s LEU 117 CO 0.05 -0.40 -0.05 -0.63 -0.29 0.00 0.00 176.35 175.03 3mjd s ILE 118 N 2.34 3.59 0.22 6.68 -1.09 -0.49 -0.94 121.20 131.52 3mjd s ILE 118 Ca 0.34 -0.45 -0.00 0.00 -2.23 0.00 0.00 60.65 58.31 3mjd s ILE 118 Cb -0.16 -2.59 0.00 0.00 -1.58 0.00 0.00 42.46 38.13 3mjd s ILE 118 CO 0.10 0.46 0.29 -0.67 -1.23 0.00 0.00 174.94 173.89 3mjd n ASP 119 N 4.06 -0.80 -0.04 3.58 -0.08 -0.76 -4.18 116.55 118.33 3mjd n ASP 119 Ca -0.18 -2.25 -0.02 0.00 -1.51 0.00 0.00 54.79 50.83 3mjd n ASP 119 Cb 0.52 1.54 -0.01 0.00 2.34 0.00 0.00 41.12 45.51 3mjd n ASP 119 CO 0.00 0.00 0.00 -0.78 0.12 0.00 0.00 177.20 176.54 3mjd h ASP 120 N 1.28 0.00 -5.38 1.67 3.58 -1.86 -3.31 116.42 112.39 3mjd h ASP 120 Ca -0.17 0.00 -0.24 0.00 0.42 0.00 0.00 57.03 57.04 3mjd h ASP 120 Cb 0.77 0.00 -0.15 0.00 1.72 0.00 0.00 39.33 41.67 3mjd h ASP 120 CO 0.23 0.44 -0.63 0.68 -2.88 0.00 0.00 179.24 177.09 3mjd s VAL 121 N -1.69 0.11 -0.29 2.25 -7.23 -1.26 -0.75 120.40 111.55 3mjd s VAL 121 Ca -0.07 -1.98 -0.04 0.00 -1.81 0.00 0.00 61.98 58.08 3mjd s VAL 121 Cb 0.01 -2.41 0.10 0.00 0.56 0.00 0.00 36.38 34.64 3mjd s VAL 121 CO 0.10 -0.12 0.13 -0.32 -0.31 0.00 0.00 175.10 174.58 3mjd s MET 122 N -4.11 0.21 -0.02 4.82 1.75 -1.26 -4.99 119.30 115.69 3mjd s MET 122 Ca 0.35 -0.53 0.21 0.00 -1.25 0.00 0.00 55.69 54.46 3mjd s MET 122 Cb 0.07 -1.22 -0.29 0.00 2.84 0.00 0.00 34.83 36.24 3mjd s MET 122 CO 0.10 -1.01 0.60 0.25 -0.65 0.00 0.00 175.02 174.31 3mjd n THR 123 N 5.24 0.00 -4.10 10.11 -2.24 -1.26 -4.52 114.28 117.50 3mjd n THR 123 Ca -0.06 -0.32 -0.10 0.00 -2.27 0.00 0.00 64.05 61.30 3mjd n THR 123 Cb 0.42 0.35 -0.09 0.00 -2.10 0.00 0.00 70.33 68.92 3mjd n THR 123 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mjd s ALA 124 N -3.27 0.63 -0.89 6.98 0.00 -1.26 -4.66 121.76 119.28 3mjd s ALA 124 Ca -0.02 -1.33 0.27 0.00 0.00 0.00 0.00 51.96 50.88 3mjd s ALA 124 Cb 0.14 0.98 0.88 0.00 0.00 0.00 0.00 23.12 25.13 3mjd s ALA 124 CO 0.86 -0.57 1.72 0.41 0.00 0.00 0.00 175.76 178.17 3mjd n GLY 125 N -0.18 -1.50 0.31 0.00 0.00 -1.26 -4.40 105.19 98.16 3mjd n GLY 125 Ca -0.04 -0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 3mjd n GLY 125 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3mjd h THR 126 N 0.00 0.34 -0.37 2.61 2.02 -2.00 -2.12 112.91 113.40 3mjd h THR 126 Ca 0.00 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.10 3mjd h THR 126 Cb 0.59 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.33 3mjd h THR 126 CO 0.00 0.00 -0.09 0.00 0.37 0.00 0.00 175.52 175.80 3mjd h ALA 127 N 0.51 1.15 -0.41 6.16 0.00 -2.01 -2.17 119.26 122.49 3mjd h ALA 127 Ca 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3mjd h ALA 127 Cb 0.51 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3mjd h ALA 127 CO -0.33 0.54 0.23 0.35 0.00 0.00 0.00 179.25 180.04 3mjd h PHE 128 N 0.59 0.56 -0.24 0.00 3.57 -1.76 -2.52 116.94 117.14 3mjd h PHE 128 Ca 0.11 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.57 3mjd h PHE 128 Cb 0.50 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 3mjd h PHE 128 CO 0.02 0.42 0.03 1.88 -2.23 0.00 0.00 178.31 178.43 3mjd h TYR 129 N 0.54 0.35 -0.19 0.41 -1.99 -1.02 0.95 116.97 116.02 3mjd h TYR 129 Ca 0.15 -0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.87 3mjd h TYR 129 Cb 0.04 -0.11 -0.01 0.00 2.00 0.00 0.00 36.73 38.65 3mjd h TYR 129 CO -0.03 0.34 0.10 0.93 -0.00 0.00 0.00 178.16 179.51 3mjd h GLU 130 N 0.35 0.21 -0.10 4.88 5.08 -1.00 0.19 114.58 124.19 3mjd h GLU 130 Ca 0.08 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 3mjd h GLU 130 Cb 0.19 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 3mjd h GLU 130 CO 0.00 0.14 -0.01 0.77 -1.00 0.00 0.00 179.01 178.91 3mjd h SER 131 N 0.22 0.17 -0.34 1.42 0.02 -1.09 -2.56 113.55 111.39 3mjd h SER 131 Ca 0.07 -0.33 0.07 0.00 -0.84 0.00 0.00 61.79 60.77 3mjd h SER 131 Cb 0.00 -0.05 -0.07 0.00 0.14 0.00 0.00 62.40 62.42 3mjd h SER 131 CO -0.04 0.46 -0.14 0.22 -1.14 0.00 0.00 176.83 176.19 3mjd h TYR 132 N -0.11 -0.33 -0.87 3.45 3.20 -0.64 0.02 116.97 121.69 3mjd h TYR 132 Ca 0.03 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 3mjd h TYR 132 Cb 0.37 0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.80 3mjd h TYR 132 CO 0.04 -0.21 0.53 -0.91 -1.64 0.00 0.00 178.16 175.96 3mjd h ASN 133 N -0.08 1.04 -0.37 -2.11 2.35 -0.63 0.50 115.58 116.28 3mjd h ASN 133 Ca 0.17 -0.06 -0.13 0.00 -0.55 0.00 0.00 56.30 55.73 3mjd h ASN 133 Cb 0.34 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 3mjd h ASN 133 CO -0.39 0.79 -0.26 0.11 -1.65 0.00 0.00 177.43 176.03 3mjd h LYS 134 N 1.19 0.83 -0.05 0.81 1.57 -1.13 -3.23 116.57 116.56 3mjd h LYS 134 Ca 0.31 -0.40 -0.16 0.00 -1.87 0.00 0.00 60.65 58.54 3mjd h LYS 134 Cb -0.06 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3mjd h LYS 134 CO -0.06 1.03 -0.67 -0.07 -0.57 0.00 0.00 179.45 179.11 3mjd h LEU 135 N 0.62 0.26 -1.37 2.94 3.38 -0.76 -3.16 115.31 117.21 3mjd h LEU 135 Ca 0.07 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 3mjd h LEU 135 Cb 0.83 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 3mjd h LEU 135 CO 0.07 0.85 0.10 0.50 0.09 0.00 0.00 178.44 180.05 3mjd h LYS 136 N 0.16 0.52 -0.45 1.13 3.64 -0.92 -1.12 116.57 119.53 3mjd h LYS 136 Ca -0.01 -0.08 0.05 0.00 -1.27 0.00 0.00 60.65 59.33 3mjd h LYS 136 Cb 1.20 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 3mjd h LYS 136 CO 0.10 0.47 0.30 0.82 -2.27 0.00 0.00 179.45 178.87 3mjd h ILE 137 N 0.51 1.00 -0.52 2.00 2.04 -1.56 -1.53 117.51 119.44 3mjd h ILE 137 Ca 0.12 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.83 3mjd h ILE 137 Cb 0.18 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 3mjd h ILE 137 CO -0.01 0.08 0.00 2.30 0.00 0.00 0.00 178.15 180.52 3mjd n ILE 138 N -4.48 2.12 -3.85 -0.67 -5.35 -0.85 -4.97 119.36 101.31 3mjd n ILE 138 Ca 0.05 -1.38 -0.27 0.00 -0.27 0.00 0.00 62.75 60.88 3mjd n ILE 138 Cb 0.20 -0.03 0.03 0.00 -1.74 0.00 0.00 39.64 38.10 3mjd n ILE 138 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 3mjd n ASN 139 N 0.60 -3.43 -4.58 7.28 5.15 -0.58 -2.92 115.26 116.78 3mjd n ASN 139 Ca 0.24 -0.81 -0.37 0.00 -0.60 0.00 0.00 54.58 53.05 3mjd n ASN 139 Cb 0.94 -3.89 -0.11 0.00 -0.53 0.00 0.00 39.78 36.19 3mjd n ASN 139 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3mjd s ALA 140 N -3.45 3.44 -0.14 5.20 0.00 -0.48 -2.12 121.76 124.21 3mjd s ALA 140 Ca 0.42 -1.01 -0.13 0.00 0.00 0.00 0.00 51.96 51.24 3mjd s ALA 140 Cb -0.21 -2.28 -0.05 0.00 0.00 0.00 0.00 23.12 20.58 3mjd s ALA 140 CO 0.83 -0.37 0.28 0.15 0.00 0.00 0.00 175.76 176.65 3mjd s LYS 141 N 1.40 4.11 -0.33 0.00 1.02 0.17 -4.13 119.74 121.97 3mjd s LYS 141 Ca 0.06 0.08 -0.29 0.00 0.02 0.00 0.00 55.97 55.85 3mjd s LYS 141 Cb -0.15 -3.37 0.02 0.00 -0.52 0.00 0.00 37.83 33.81 3mjd s LYS 141 CO 0.06 0.37 1.07 0.42 -0.92 0.00 0.00 175.35 176.35 3mjd s ILE 142 N 0.08 4.50 -0.60 2.17 1.01 -1.26 -0.01 121.20 127.09 3mjd s ILE 142 Ca 0.17 1.69 0.24 0.00 0.00 0.00 0.00 60.65 62.75 3mjd s ILE 142 Cb -0.13 -4.42 0.02 0.00 0.01 0.00 0.00 42.46 37.93 3mjd s ILE 142 CO 0.05 -0.51 1.24 0.00 0.00 0.00 0.00 174.94 175.72 3mjd h ALA 143 N 8.16 0.52 0.00 9.38 0.00 -0.65 -3.47 119.26 133.21 3mjd h ALA 143 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3mjd h ALA 143 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3mjd h ALA 143 CO 1.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.70 3mjd n GLY 144 N 1.33 0.30 3.03 0.00 0.00 -1.25 -4.28 105.19 104.32 3mjd n GLY 144 Ca 0.03 -0.93 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 3mjd n GLY 144 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mjd s VAL 145 N -2.00 0.86 -0.10 1.61 1.01 -0.44 -0.94 120.40 120.40 3mjd s VAL 145 Ca 0.00 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.57 3mjd s VAL 145 Cb 0.00 -0.74 0.02 0.00 0.00 0.00 0.00 36.38 35.65 3mjd s VAL 145 CO 0.00 0.26 -0.14 -0.69 0.00 0.00 0.00 175.10 174.53 3mjd s VAL 146 N -0.00 1.39 0.35 2.92 1.01 -0.11 -0.12 120.40 125.83 3mjd s VAL 146 Ca -0.00 -0.58 0.07 0.00 0.00 0.00 0.00 61.98 61.47 3mjd s VAL 146 Cb -0.07 -1.28 -0.07 0.00 0.00 0.00 0.00 36.38 34.96 3mjd s VAL 146 CO 0.00 0.42 -0.03 -0.76 0.00 0.00 0.00 175.10 174.73 3mjd s LEU 147 N 1.01 2.66 0.07 3.92 1.43 0.74 -1.83 118.68 126.68 3mjd s LEU 147 Ca -0.07 -1.29 -0.14 0.00 -1.03 0.00 0.00 54.13 51.60 3mjd s LEU 147 Cb -0.15 -0.81 -0.21 0.00 0.03 0.00 0.00 46.19 45.05 3mjd s LEU 147 CO -0.01 -0.38 1.21 0.77 0.23 0.00 0.00 176.35 178.17 3mjd h SER 148 N 1.99 0.87 -4.02 2.29 4.64 -1.03 0.05 113.55 118.35 3mjd h SER 148 Ca -0.42 -0.71 -0.17 0.00 -0.47 0.00 0.00 61.79 60.02 3mjd h SER 148 Cb 1.24 -0.27 -0.25 0.00 -0.31 0.00 0.00 62.40 62.82 3mjd h SER 148 CO 0.74 1.46 -0.46 -0.51 -0.87 0.00 0.00 176.83 177.19 3mjd s ILE 149 N -3.43 0.01 -0.35 0.95 2.07 -1.24 -1.60 121.20 117.62 3mjd s ILE 149 Ca -0.10 -0.11 -0.02 0.00 -1.41 0.00 0.00 60.65 59.00 3mjd s ILE 149 Cb 0.07 -0.34 0.07 0.00 0.13 0.00 0.00 42.46 42.40 3mjd s ILE 149 CO 0.90 -0.06 0.09 -0.62 -1.91 0.00 0.00 174.94 173.34 3mjd s ASP 150 N -0.15 5.07 0.00 4.50 -1.08 -0.67 -4.61 116.67 119.72 3mjd s ASP 150 Ca -0.03 -1.58 0.19 0.00 -0.52 0.00 0.00 52.55 50.62 3mjd s ASP 150 Cb -0.02 -1.77 0.86 0.00 -1.46 0.00 0.00 42.92 40.53 3mjd s ASP 150 CO 0.01 -0.38 1.62 0.54 0.52 0.00 0.00 175.17 177.48 3mjd n ARG 151 N 4.62 0.06 -3.95 4.34 1.74 -1.26 -1.78 116.66 120.42 3mjd n ARG 151 Ca -0.08 0.15 -0.26 0.00 -0.77 0.00 0.00 57.85 56.89 3mjd n ARG 151 Cb 0.43 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.35 3mjd n ARG 151 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3mjd n GLN 152 N -1.46 -3.38 -4.20 5.56 6.02 -1.26 -4.47 117.38 114.19 3mjd n GLN 152 Ca 0.06 0.41 -0.19 0.00 -0.01 0.00 0.00 57.00 57.27 3mjd n GLN 152 Cb 0.21 -4.59 -0.12 0.00 1.02 0.00 0.00 30.24 26.76 3mjd n GLN 152 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 3mjd s GLU 153 N -6.55 0.87 0.26 -1.09 2.12 -1.26 -0.81 118.70 112.24 3mjd s GLU 153 Ca 0.04 -0.97 -0.31 0.00 0.36 0.00 0.00 54.97 54.10 3mjd s GLU 153 Cb -0.02 -0.91 -0.12 0.00 0.26 0.00 0.00 34.13 33.33 3mjd s GLU 153 CO 0.89 0.21 1.59 1.63 -0.54 0.00 0.00 175.26 179.04 3mjd n LYS 154 N 1.31 2.60 -1.09 4.30 5.02 0.87 -3.61 118.16 127.55 3mjd n LYS 154 Ca -0.21 0.93 -0.29 0.00 -2.02 0.00 0.00 58.31 56.72 3mjd n LYS 154 Cb 0.54 -2.70 0.16 0.00 -0.02 0.00 0.00 35.03 33.01 3mjd n LYS 154 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3mjd s ALA 155 N 0.25 1.20 0.16 7.82 0.00 -0.64 -4.85 121.76 125.69 3mjd s ALA 155 Ca 0.67 -0.09 -0.32 0.00 0.00 0.00 0.00 51.96 52.23 3mjd s ALA 155 Cb -0.53 -3.20 -0.10 0.00 0.00 0.00 0.00 23.12 19.30 3mjd s ALA 155 CO 0.45 -2.64 1.55 0.15 0.00 0.00 0.00 175.76 175.27 3mjd s LYS 156 N -4.87 4.23 -1.45 0.00 -0.14 -1.26 -2.34 119.74 113.90 3mjd s LYS 156 Ca 0.65 2.33 -0.08 0.00 -1.36 0.00 0.00 55.97 57.50 3mjd s LYS 156 Cb -0.19 -3.17 0.05 0.00 -1.68 0.00 0.00 37.83 32.84 3mjd s LYS 156 CO 0.58 -0.59 0.81 -0.25 -0.76 0.00 0.00 175.35 175.14 3mjd n ASP 157 N 3.98 -2.94 -4.00 2.83 8.00 -1.26 -4.98 116.55 118.18 3mjd n ASP 157 Ca 0.14 -0.84 -0.10 0.00 0.71 0.00 0.00 54.79 54.70 3mjd n ASP 157 Cb 0.39 -3.76 -0.08 0.00 -0.02 0.00 0.00 41.12 37.65 3mjd n ASP 157 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3mjd s SER 158 N -3.79 0.09 0.18 -2.24 0.15 -0.99 -5.07 113.70 102.03 3mjd s SER 158 Ca 0.37 -0.94 0.21 0.00 0.70 0.00 0.00 55.95 56.29 3mjd s SER 158 Cb -0.19 0.41 -0.02 0.00 -1.71 0.00 0.00 66.02 64.51 3mjd s SER 158 CO 0.84 -0.86 1.02 -0.78 1.20 0.00 0.00 173.24 174.66 3mjd h ASP 159 N 2.61 0.00 -4.49 5.45 -0.00 -1.94 -3.40 116.42 114.64 3mjd h ASP 159 Ca -0.32 0.00 -0.36 0.00 -0.00 0.00 0.00 57.03 56.35 3mjd h ASP 159 Cb 1.22 0.00 -0.14 0.00 -0.00 0.00 0.00 39.33 40.41 3mjd h ASP 159 CO 0.50 0.13 -0.61 0.27 -0.00 0.00 0.00 179.24 179.53 3mjd s ILE 160 N -3.26 0.55 0.65 2.25 -4.36 -1.26 -4.84 121.20 110.92 3mjd s ILE 160 Ca -0.01 -2.00 -0.16 0.00 -0.26 0.00 0.00 60.65 58.23 3mjd s ILE 160 Cb 0.09 -2.63 -0.01 0.00 1.25 0.00 0.00 42.46 41.17 3mjd s ILE 160 CO 0.79 0.00 1.13 -0.94 0.24 0.00 0.00 174.94 176.16 3mjd s SER 161 N -3.32 5.10 0.26 4.36 1.04 -1.24 -1.62 113.70 118.28 3mjd s SER 161 Ca 0.38 2.07 -0.03 0.00 0.48 0.00 0.00 55.95 58.85 3mjd s SER 161 Cb 0.08 -2.56 0.32 0.00 0.10 0.00 0.00 66.02 63.96 3mjd s SER 161 CO 0.14 -1.64 1.82 0.00 0.98 0.00 0.00 173.24 174.54 3mjd h ALA 162 N 0.19 1.17 -0.58 5.32 0.00 -1.84 -1.73 119.26 121.78 3mjd h ALA 162 Ca -0.47 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.19 3mjd h ALA 162 Cb 1.26 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 3mjd h ALA 162 CO 0.54 0.58 0.17 1.79 0.00 0.00 0.00 179.25 182.33 3mjd h THR 163 N 0.94 1.24 -0.36 0.00 1.35 -1.91 -1.44 112.91 112.73 3mjd h THR 163 Ca 0.21 -0.85 -0.10 0.00 -0.55 0.00 0.00 66.41 65.13 3mjd h THR 163 Cb 0.25 0.69 -0.01 0.00 -1.73 0.00 0.00 68.15 67.35 3mjd h THR 163 CO -0.01 0.32 -0.15 0.50 -0.25 0.00 0.00 175.52 175.92 3mjd h LYS 164 N 0.83 0.73 -0.71 4.72 3.64 -1.89 -1.26 116.57 122.62 3mjd h LYS 164 Ca 0.19 -0.31 0.02 0.00 -1.27 0.00 0.00 60.65 59.27 3mjd h LYS 164 Cb 0.31 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 3mjd h LYS 164 CO -0.00 0.92 0.46 -0.22 -2.27 0.00 0.00 179.45 178.34 3mjd h LYS 165 N 0.52 0.89 -0.29 1.90 3.64 -1.17 -0.39 116.57 121.67 3mjd h LYS 165 Ca 0.08 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 3mjd h LYS 165 Cb 0.69 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 3mjd h LYS 165 CO 0.05 0.59 -0.04 0.82 -2.27 0.00 0.00 179.45 178.60 3mjd h ILE 166 N 0.92 1.27 -0.76 2.00 1.08 -1.16 0.75 117.51 121.62 3mjd h ILE 166 Ca 0.27 -1.04 0.03 0.00 -0.39 0.00 0.00 64.86 63.74 3mjd h ILE 166 Cb -0.05 1.36 -0.05 0.00 -3.07 0.00 0.00 36.82 35.02 3mjd h ILE 166 CO -0.08 0.33 0.47 -1.28 -0.69 0.00 0.00 178.15 176.90 3mjd h SER 167 N 0.32 0.78 0.05 1.72 0.87 -0.93 -1.07 113.55 115.27 3mjd h SER 167 Ca 0.08 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.64 3mjd h SER 167 Cb 0.51 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 3mjd h SER 167 CO 0.02 0.53 -0.02 1.56 -0.53 0.00 0.00 176.83 178.39 3mjd h GLN 168 N 0.92 -0.07 -0.70 2.24 4.20 -0.97 -0.46 115.11 120.27 3mjd h GLN 168 Ca 0.31 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.00 3mjd h GLN 168 Cb 0.04 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 3mjd h GLN 168 CO -0.12 0.51 0.35 -0.44 -0.67 0.00 0.00 178.83 178.46 3mjd h ASP 169 N -0.71 0.88 -0.01 1.46 3.32 -0.76 -3.02 116.42 117.58 3mjd h ASP 169 Ca -0.01 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.96 3mjd h ASP 169 Cb 0.61 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.93 3mjd h ASP 169 CO 0.01 0.74 -0.76 0.49 -1.72 0.00 0.00 179.24 178.00 3mjd n PHE 170 N -4.35 0.00 -3.47 4.55 3.72 -0.42 -5.01 117.46 112.50 3mjd n PHE 170 Ca 0.07 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.27 3mjd n PHE 170 Cb 0.12 -0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.74 3mjd n PHE 170 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3mjd n ASN 171 N -0.81 -4.38 -4.16 4.37 4.13 -0.22 -5.02 115.26 109.16 3mjd n ASN 171 Ca 0.06 -0.55 -0.14 0.00 1.68 0.00 0.00 54.58 55.64 3mjd n ASN 171 Cb 0.40 -4.86 -0.11 0.00 -1.54 0.00 0.00 39.78 33.66 3mjd n ASN 171 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 3mjd s ILE 172 N -3.32 0.88 0.27 2.41 -4.36 -0.95 -5.04 121.20 111.08 3mjd s ILE 172 Ca 0.32 -1.61 -0.30 0.00 -0.26 0.00 0.00 60.65 58.80 3mjd s ILE 172 Cb -0.14 -1.31 -0.09 0.00 1.25 0.00 0.00 42.46 42.16 3mjd s ILE 172 CO 0.70 -0.57 1.08 -2.16 0.24 0.00 0.00 174.94 174.23 3mjd s PRO 173 N -2.76 4.66 -0.35 0.37 0.04 -1.26 -4.38 135.00 131.33 3mjd s PRO 173 Ca 0.04 1.77 0.03 0.00 0.04 0.00 0.00 61.00 62.88 3mjd s PRO 173 Cb -0.03 -3.20 0.10 0.00 0.04 0.00 0.00 34.50 31.41 3mjd s PRO 173 CO -0.00 0.24 0.06 0.08 0.04 0.00 0.00 177.00 177.42 3mjd s VAL 174 N -1.14 2.42 0.18 -0.36 1.01 -1.26 -1.33 120.40 119.92 3mjd s VAL 174 Ca 0.44 -2.27 0.02 0.00 0.00 0.00 0.00 61.98 60.18 3mjd s VAL 174 Cb -0.31 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 3mjd s VAL 174 CO 0.40 -0.58 0.32 -0.76 0.00 0.00 0.00 175.10 174.48 3mjd s LEU 175 N 0.94 4.31 -0.07 3.92 1.02 0.83 -4.99 118.68 124.65 3mjd s LEU 175 Ca 0.10 0.20 -0.09 0.00 0.02 0.00 0.00 54.13 54.36 3mjd s LEU 175 Cb -0.20 -2.95 0.02 0.00 0.02 0.00 0.00 46.19 43.08 3mjd s LEU 175 CO -0.07 0.00 0.23 0.00 0.02 0.00 0.00 176.35 176.53 3mjd s ALA 176 N -1.83 -0.56 0.34 4.21 0.00 -1.26 -0.19 121.76 122.47 3mjd s ALA 176 Ca 0.35 0.51 0.01 0.00 0.00 0.00 0.00 51.96 52.84 3mjd s ALA 176 Cb -0.11 -0.27 0.59 0.00 0.00 0.00 0.00 23.12 23.33 3mjd s ALA 176 CO 0.29 -0.14 2.00 0.28 0.00 0.00 0.00 175.76 178.19 3mjd h VAL 177 N 4.62 1.17 -4.46 0.00 2.07 -0.81 -3.44 116.25 115.39 3mjd h VAL 177 Ca -0.27 -0.32 -0.21 0.00 0.82 0.00 0.00 66.70 66.72 3mjd h VAL 177 Cb 1.19 0.16 -0.14 0.00 -1.52 0.00 0.00 31.29 30.98 3mjd h VAL 177 CO 0.37 0.17 -0.56 0.28 0.02 0.00 0.00 177.57 177.85 3mjd s THR 178 N -5.78 0.01 0.23 2.57 -1.32 -0.63 -5.02 115.64 105.69 3mjd s THR 178 Ca -0.10 -1.92 -0.17 0.00 -1.21 0.00 0.00 61.69 58.28 3mjd s THR 178 Cb 0.18 -2.42 0.02 0.00 -1.51 0.00 0.00 72.50 68.76 3mjd s THR 178 CO 0.77 -0.04 0.56 0.54 -2.21 0.00 0.00 174.62 174.24 3mjd s ASN 179 N -3.13 -0.23 0.31 8.08 2.20 -1.26 -1.67 114.94 119.24 3mjd s ASN 179 Ca 0.36 -0.60 0.06 0.00 -0.94 0.00 0.00 52.86 51.74 3mjd s ASN 179 Cb 0.06 0.62 0.75 0.00 -2.00 0.00 0.00 41.25 40.68 3mjd s ASN 179 CO 0.11 -1.14 1.79 0.15 -2.94 0.00 0.00 177.10 175.06 3mjd h PHE 180 N 2.16 1.04 -0.39 1.54 3.57 -1.57 -1.47 116.94 121.83 3mjd h PHE 180 Ca -0.26 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.27 3mjd h PHE 180 Cb 1.26 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.66 3mjd h PHE 180 CO 0.38 0.25 0.23 1.49 -2.23 0.00 0.00 178.31 178.42 3mjd h GLU 181 N 0.76 0.53 -0.41 1.11 4.57 -1.91 0.14 114.58 119.37 3mjd h GLU 181 Ca 0.57 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.61 3mjd h GLU 181 Cb 0.89 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.35 3mjd h GLU 181 CO -0.36 0.41 -0.05 0.77 -1.18 0.00 0.00 179.01 178.60 3mjd h SER 182 N 0.50 0.76 -0.86 1.04 0.02 -1.72 -1.45 113.55 111.85 3mjd h SER 182 Ca 0.14 -0.34 -0.03 0.00 -0.84 0.00 0.00 61.79 60.72 3mjd h SER 182 Cb 0.02 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.31 3mjd h SER 182 CO -0.02 0.92 0.42 0.40 -1.14 0.00 0.00 176.83 177.40 3mjd h ILE 183 N 0.59 1.26 -0.19 3.27 2.04 -1.20 -2.22 117.51 121.06 3mjd h ILE 183 Ca 0.11 -0.73 -0.11 0.00 1.00 0.00 0.00 64.86 65.13 3mjd h ILE 183 Cb 0.56 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 3mjd h ILE 183 CO 0.03 0.31 -0.38 0.15 0.00 0.00 0.00 178.15 178.27 3mjd h PHE 184 N 1.23 0.48 -0.02 1.37 3.57 -0.50 -1.24 116.94 121.83 3mjd h PHE 184 Ca 0.30 -0.13 -0.08 0.00 3.53 0.00 0.00 57.97 61.59 3mjd h PHE 184 Cb 0.11 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 3mjd h PHE 184 CO 0.01 0.73 -0.35 0.93 -2.23 0.00 0.00 178.31 177.40 3mjd h GLU 185 N 0.35 0.03 -0.07 1.11 4.39 -0.96 -1.48 114.58 117.95 3mjd h GLU 185 Ca 0.04 -0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.64 3mjd h GLU 185 Cb 0.82 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 3mjd h GLU 185 CO 0.07 0.39 -0.29 -0.92 -1.16 0.00 0.00 179.01 177.09 3mjd h TYR 186 N 0.03 0.43 -0.60 4.33 3.20 -0.89 -3.24 116.97 120.22 3mjd h TYR 186 Ca 0.00 -0.18 -0.02 0.00 3.14 0.00 0.00 58.73 61.67 3mjd h TYR 186 Cb 0.64 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.81 3mjd h TYR 186 CO 0.00 0.91 0.31 0.28 -1.64 0.00 0.00 178.16 178.02 3mjd h VAL 187 N -0.18 1.19 -0.10 1.81 2.07 -1.02 -2.72 116.25 117.30 3mjd h VAL 187 Ca -0.02 -0.50 0.04 0.00 0.82 0.00 0.00 66.70 67.05 3mjd h VAL 187 Cb 0.94 0.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.05 3mjd h VAL 187 CO 0.06 0.21 -0.26 0.11 0.02 0.00 0.00 177.57 177.71 3mjd h LYS 188 N 0.84 -0.34 -0.71 1.57 1.57 -1.32 -2.17 116.57 116.01 3mjd h LYS 188 Ca 0.21 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3mjd h LYS 188 Cb 0.05 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.44 3mjd h LYS 188 CO -0.03 -0.22 0.00 0.39 -0.57 0.00 0.00 179.45 179.01 3mjd n GLU 189 N -5.38 2.74 0.00 3.15 1.02 -1.06 -4.40 120.64 116.72 3mjd n GLU 189 Ca -0.03 -1.53 0.00 0.00 -0.02 0.00 0.00 57.16 55.58 3mjd n GLU 189 Cb 0.29 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 29.94 3mjd n GLU 189 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3mjd n ASN 190 N 0.37 0.00 -4.31 1.62 3.02 -1.05 -5.08 115.26 109.82 3mjd n ASN 190 Ca 0.14 -0.09 -0.23 0.00 -0.03 0.00 0.00 54.58 54.37 3mjd n ASN 190 Cb 0.65 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.72 3mjd n ASN 190 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3mjd s LEU 191 N 0.00 2.04 0.49 3.41 1.43 -0.84 -5.04 118.68 120.18 3mjd s LEU 191 Ca 0.00 -1.50 -0.23 0.00 -1.03 0.00 0.00 54.13 51.37 3mjd s LEU 191 Cb 0.00 -0.23 -0.07 0.00 0.03 0.00 0.00 46.19 45.92 3mjd s LEU 191 CO 0.00 -0.75 1.33 -0.67 0.23 0.00 0.00 176.35 176.49 3mjd n ASP 192 N -0.90 2.71 -0.35 2.29 2.03 -1.26 -4.85 116.55 116.22 3mjd n ASP 192 Ca -0.04 1.04 0.09 0.00 0.52 0.00 0.00 54.79 56.41 3mjd n ASP 192 Cb 0.66 -1.55 0.28 0.00 -0.72 0.00 0.00 41.12 39.78 3mjd n ASP 192 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 3mjd h GLU 193 N 1.77 0.87 -0.98 -0.67 4.57 -1.99 -1.04 114.58 117.12 3mjd h GLU 193 Ca -0.50 -0.05 0.02 0.00 -1.18 0.00 0.00 59.36 57.65 3mjd h GLU 193 Cb 1.30 -0.20 -0.05 0.00 -0.16 0.00 0.00 28.75 29.64 3mjd h GLU 193 CO 0.58 0.58 0.65 1.15 -1.18 0.00 0.00 179.01 180.79 3mjd h THR 194 N 0.90 1.23 -0.16 0.32 2.02 -2.00 -2.64 112.91 112.58 3mjd h THR 194 Ca 0.52 -0.45 -0.04 0.00 0.77 0.00 0.00 66.41 67.21 3mjd h THR 194 Cb 0.63 -0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 66.85 3mjd h THR 194 CO -0.29 0.24 -0.06 -0.03 0.37 0.00 0.00 175.52 175.74 3mjd h MET 195 N 1.30 0.33 -0.68 6.66 1.85 -1.57 -2.13 114.93 120.70 3mjd h MET 195 Ca 0.37 -0.14 0.02 0.00 -0.61 0.00 0.00 59.70 59.34 3mjd h MET 195 Cb -0.11 -0.01 -0.04 0.00 0.43 0.00 0.00 31.60 31.87 3mjd h MET 195 CO -0.09 0.63 0.45 0.82 -0.40 0.00 0.00 176.91 178.32 3mjd h ILE 196 N 0.02 1.12 -0.05 1.77 2.04 -1.32 0.97 117.51 122.06 3mjd h ILE 196 Ca 0.04 -0.29 -0.16 0.00 1.00 0.00 0.00 64.86 65.45 3mjd h ILE 196 Cb 0.53 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3mjd h ILE 196 CO 0.02 0.15 -0.68 0.44 0.00 0.00 0.00 178.15 178.09 3mjd h ASP 197 N 0.85 0.29 -0.72 1.72 3.32 -1.44 0.19 116.42 120.62 3mjd h ASP 197 Ca 0.26 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 3mjd h ASP 197 Cb 0.00 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 3mjd h ASP 197 CO -0.07 0.88 0.23 0.11 -1.72 0.00 0.00 179.24 178.67 3mjd h LYS 198 N 0.17 1.12 0.40 3.56 1.57 -0.50 -1.77 116.57 121.11 3mjd h LYS 198 Ca -0.02 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.51 3mjd h LYS 198 Cb 1.21 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.36 3mjd h LYS 198 CO 0.11 0.95 -0.19 0.74 -0.57 0.00 0.00 179.45 180.48 3mjd h PHE 199 N 1.06 -0.50 -0.52 -1.35 -1.00 -0.59 -1.47 116.94 112.58 3mjd h PHE 199 Ca 0.23 -0.01 0.10 0.00 2.81 0.00 0.00 57.97 61.11 3mjd h PHE 199 Cb 0.30 0.17 -0.10 0.00 3.61 0.00 0.00 35.95 39.92 3mjd h PHE 199 CO 0.02 -0.18 -0.19 0.87 -1.61 0.00 0.00 178.31 177.23 3mjd h LYS 200 N -0.86 -0.06 0.00 1.51 1.57 -0.59 0.50 116.57 118.63 3mjd h LYS 200 Ca -0.06 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 3mjd h LYS 200 Cb 0.55 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 3mjd h LYS 200 CO 0.09 -0.04 -0.52 -0.56 -0.57 0.00 0.00 179.45 177.85 3mjd h GLN 201 N -0.07 0.00 -0.32 3.15 3.07 -1.40 -1.47 115.11 118.08 3mjd h GLN 201 Ca 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.98 3mjd h GLN 201 Cb 0.44 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.99 3mjd h GLN 201 CO -0.57 0.52 0.17 -0.92 0.09 0.00 0.00 178.83 178.13 3mjd h TYR 202 N 0.00 0.44 -0.03 0.06 3.20 0.14 0.25 116.97 121.04 3mjd h TYR 202 Ca -0.01 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 3mjd h TYR 202 Cb 0.97 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 39.10 3mjd h TYR 202 CO 0.00 0.36 0.02 -0.09 -1.64 0.00 0.00 178.16 176.81 3mjd h ARG 203 N 0.40 0.04 -0.87 1.82 2.43 -0.83 0.52 114.38 117.88 3mjd h ARG 203 Ca 0.11 -0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.35 3mjd h ARG 203 Cb 0.07 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.54 3mjd h ARG 203 CO -0.02 0.09 0.54 1.96 -1.51 0.00 0.00 179.97 181.03 3mjd h GLN 204 N -0.03 0.94 0.00 0.20 1.08 -1.04 0.68 115.11 116.95 3mjd h GLN 204 Ca 0.01 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.12 3mjd h GLN 204 Cb 0.06 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.29 3mjd h GLN 204 CO -0.00 0.62 -0.12 -0.22 -0.95 0.00 0.00 178.83 178.16 3mjd h LYS 205 N 0.96 0.08 -0.00 1.46 1.63 -0.29 -3.42 116.57 117.00 3mjd h LYS 205 Ca 0.39 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 60.10 3mjd h LYS 205 Cb 0.21 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 3mjd h LYS 205 CO -0.19 0.88 -0.00 0.66 -3.45 0.00 0.00 179.45 177.35 3mjd n TYR 206 N -4.60 0.00 -1.70 1.91 4.01 0.18 -5.03 117.16 111.93 3mjd n TYR 206 Ca -0.10 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.25 3mjd n TYR 206 Cb 0.46 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.52 3mjd n TYR 206 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3mjd n GLY 207 N 1.00 0.48 0.74 2.72 0.00 0.24 -0.09 105.19 110.27 3mjd n GLY 207 Ca 0.00 0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.19 3mjd n GLY 207 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06