#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orr s LYS 3 N 0.00 3.70 -0.12 0.00 1.02 -1.26 -2.32 119.74 120.76 1orr s LYS 3 Ca 0.00 -0.47 0.03 0.00 0.02 0.00 0.00 55.97 55.54 1orr s LYS 3 Cb 0.00 -2.97 0.00 0.00 -0.52 0.00 0.00 37.83 34.34 1orr s LYS 3 CO 0.00 0.28 -0.22 -1.17 -0.92 0.00 0.00 175.35 173.32 1orr s LEU 4 N 0.29 2.20 -0.18 3.17 2.96 -0.02 -1.03 118.68 126.07 1orr s LEU 4 Ca -0.02 -0.54 -0.08 0.00 -0.22 0.00 0.00 54.13 53.27 1orr s LEU 4 Cb -0.14 -1.45 -0.04 0.00 0.50 0.00 0.00 46.19 45.06 1orr s LEU 4 CO 0.02 0.13 0.08 -0.22 -1.32 0.00 0.00 176.35 175.04 1orr s LEU 5 N 0.52 3.91 -0.26 -0.68 2.96 -0.16 -0.30 118.68 124.67 1orr s LEU 5 Ca -0.14 0.13 0.02 0.00 -0.22 0.00 0.00 54.13 53.93 1orr s LEU 5 Cb -0.17 -1.99 0.07 0.00 0.50 0.00 0.00 46.19 44.60 1orr s LEU 5 CO 0.05 0.19 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.57 1orr s ILE 6 N 0.29 1.95 0.28 6.68 1.01 0.03 -0.84 121.20 130.61 1orr s ILE 6 Ca 0.05 -1.60 -0.21 0.00 0.00 0.00 0.00 60.65 58.88 1orr s ILE 6 Cb -0.12 -2.17 -0.09 0.00 0.01 0.00 0.00 42.46 40.09 1orr s ILE 6 CO -0.00 -0.14 0.81 0.42 0.00 0.00 0.00 174.94 176.03 1orr s THR 7 N 1.18 4.45 -1.10 2.92 -4.23 -0.70 -1.83 115.64 116.33 1orr s THR 7 Ca -0.05 1.44 0.00 0.00 -1.18 0.00 0.00 61.69 61.91 1orr s THR 7 Cb -0.19 -3.87 0.00 0.00 1.34 0.00 0.00 72.50 69.78 1orr s THR 7 CO -0.06 0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.74 1orr n GLY 8 N 0.47 0.35 0.27 3.99 0.00 0.74 -2.13 105.19 108.88 1orr n GLY 8 Ca 0.00 -0.42 0.18 0.00 0.00 0.00 0.00 46.02 45.79 1orr n GLY 8 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1orr h GLY 9 N 0.00 0.00 -1.84 -0.02 0.00 -1.54 -1.91 103.07 97.76 1orr h GLY 9 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1orr h GLY 9 CO 0.34 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.88 1orr n GLY 11 N 1.38 -0.54 0.42 0.00 0.00 -0.72 -4.38 105.19 101.36 1orr n GLY 11 Ca 0.18 -1.76 -0.16 0.00 0.00 0.00 0.00 46.02 44.29 1orr n GLY 11 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1orr h PHE 12 N -0.77 -0.98 -0.37 1.61 3.57 -1.86 -0.50 116.94 117.64 1orr h PHE 12 Ca 0.00 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 1orr h PHE 12 Cb 0.00 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 1orr h PHE 12 CO 0.00 -0.61 0.08 -0.07 -2.23 0.00 0.00 178.31 175.48 1orr h LEU 13 N -1.18 0.57 -0.46 0.59 4.07 -1.90 -3.00 115.31 113.98 1orr h LEU 13 Ca -0.11 -0.24 0.07 0.00 0.08 0.00 0.00 57.88 57.68 1orr h LEU 13 Cb 0.81 -0.15 -0.06 0.00 1.08 0.00 0.00 40.66 42.34 1orr h LEU 13 CO 0.18 0.66 0.13 1.23 -1.08 0.00 0.00 178.44 179.56 1orr h GLY 14 N 0.45 0.58 1.94 0.83 0.00 -1.71 -0.51 103.07 104.64 1orr h GLY 14 Ca 0.11 -0.05 -0.10 0.00 0.00 0.00 0.00 47.33 47.29 1orr h GLY 14 CO 0.00 -0.03 -0.45 1.48 0.00 0.00 0.00 176.54 177.55 1orr h SER 15 N 0.28 0.07 -0.31 0.19 4.64 -0.40 0.19 113.55 118.22 1orr h SER 15 Ca 0.23 -0.03 -0.09 0.00 -0.47 0.00 0.00 61.79 61.43 1orr h SER 15 Cb 0.27 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1orr h SER 15 CO -0.27 0.52 -0.15 0.78 -0.87 0.00 0.00 176.83 176.84 1orr h ASN 16 N 0.06 0.66 -0.42 4.97 2.35 -1.29 0.10 115.58 122.01 1orr h ASN 16 Ca 0.00 -0.41 -0.13 0.00 -0.55 0.00 0.00 56.30 55.21 1orr h ASN 16 Cb 0.83 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 1orr h ASN 16 CO 0.06 0.92 -0.24 -0.07 -1.65 0.00 0.00 177.43 176.45 1orr h LEU 17 N 0.40 0.97 -0.71 1.61 3.38 -0.88 -2.83 115.31 117.26 1orr h LEU 17 Ca 0.07 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 1orr h LEU 17 Cb 0.68 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1orr h LEU 17 CO 0.05 1.16 0.34 0.00 0.09 0.00 0.00 178.44 180.07 1orr h ALA 18 N 0.91 0.91 -0.80 1.53 0.00 -0.40 -1.63 119.26 119.79 1orr h ALA 18 Ca 0.10 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1orr h ALA 18 Cb 0.81 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1orr h ALA 18 CO 0.07 0.48 0.52 0.66 0.00 0.00 0.00 179.25 180.98 1orr h SER 19 N 0.99 0.79 -0.36 0.00 4.64 -0.58 -1.04 113.55 117.99 1orr h SER 19 Ca 0.24 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.51 1orr h SER 19 Cb 0.13 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 1orr h SER 19 CO -0.03 0.52 0.04 0.15 -0.87 0.00 0.00 176.83 176.64 1orr h PHE 20 N 0.90 0.66 -0.82 4.77 3.57 -1.13 -1.06 116.94 123.83 1orr h PHE 20 Ca 0.34 -0.10 0.04 0.00 3.53 0.00 0.00 57.97 61.78 1orr h PHE 20 Cb 0.17 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 38.68 1orr h PHE 20 CO -0.00 0.69 0.52 0.00 -2.23 0.00 0.00 178.31 177.28 1orr h ALA 21 N 0.89 1.10 -0.42 2.41 0.00 -0.69 0.26 119.26 122.81 1orr h ALA 21 Ca 0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1orr h ALA 21 Cb 0.40 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1orr h ALA 21 CO 0.01 0.31 0.14 -0.07 0.00 0.00 0.00 179.25 179.64 1orr h LEU 22 N 0.99 0.60 -1.43 0.00 3.38 -0.87 -0.99 115.31 116.99 1orr h LEU 22 Ca 0.34 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1orr h LEU 22 Cb 0.06 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1orr h LEU 22 CO -0.13 0.64 -0.28 0.77 0.09 0.00 0.00 178.44 179.53 1orr h SER 23 N 0.53 0.00 -0.37 -0.43 4.64 -0.60 -2.80 113.55 114.52 1orr h SER 23 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1orr h SER 23 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1orr h SER 23 CO -0.01 0.28 0.00 0.00 -0.87 0.00 0.00 176.83 176.24 1orr n GLN 24 N -3.94 2.11 -1.23 4.77 1.13 0.03 -4.94 117.38 115.31 1orr n GLN 24 Ca -0.02 -1.70 -0.08 0.00 -1.94 0.00 0.00 57.00 53.26 1orr n GLN 24 Cb 0.35 -1.42 -0.03 0.00 0.11 0.00 0.00 30.24 29.25 1orr n GLN 24 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1orr n GLY 25 N 1.30 0.98 3.73 1.08 0.00 -0.87 -5.01 105.19 106.39 1orr n GLY 25 Ca 0.17 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 1orr n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1orr s ILE 26 N -2.21 4.49 0.17 -0.61 1.01 -0.43 -4.94 121.20 118.68 1orr s ILE 26 Ca 0.00 2.02 -0.30 0.00 0.00 0.00 0.00 60.65 62.37 1orr s ILE 26 Cb 0.00 -4.29 -0.09 0.00 0.01 0.00 0.00 42.46 38.09 1orr s ILE 26 CO 0.00 0.29 1.36 -1.81 0.00 0.00 0.00 174.94 174.78 1orr s ASP 27 N 0.14 6.83 0.06 3.58 1.01 -0.98 -4.51 116.67 122.80 1orr s ASP 27 Ca 0.48 2.41 0.09 0.00 0.71 0.00 0.00 52.55 56.24 1orr s ASP 27 Cb -0.24 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.06 1orr s ASP 27 CO 0.30 -0.60 -0.25 -0.22 0.21 0.00 0.00 175.17 174.61 1orr s LEU 28 N 0.33 2.19 -0.09 1.23 2.96 -1.26 -0.84 118.68 123.20 1orr s LEU 28 Ca 0.60 -0.60 0.02 0.00 -0.22 0.00 0.00 54.13 53.93 1orr s LEU 28 Cb -0.37 -1.20 0.01 0.00 0.50 0.00 0.00 46.19 45.13 1orr s LEU 28 CO 0.36 0.22 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.82 1orr s ILE 29 N -0.85 1.47 -0.10 6.68 1.09 0.59 -1.28 121.20 128.80 1orr s ILE 29 Ca 0.11 -0.66 0.03 0.00 -1.10 0.00 0.00 60.65 59.03 1orr s ILE 29 Cb -0.10 -1.32 -0.01 0.00 -1.06 0.00 0.00 42.46 39.97 1orr s ILE 29 CO 0.03 0.43 -0.21 -0.69 -0.10 0.00 0.00 174.94 174.40 1orr s VAL 30 N 0.70 2.34 -0.14 2.92 1.01 0.32 -0.79 120.40 126.76 1orr s VAL 30 Ca -0.13 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 60.95 1orr s VAL 30 Cb -0.16 -1.92 0.01 0.00 0.00 0.00 0.00 36.38 34.31 1orr s VAL 30 CO 0.03 0.55 -0.22 0.12 0.00 0.00 0.00 175.10 175.58 1orr s PHE 31 N 0.29 2.67 0.08 5.22 5.36 -0.76 -0.27 117.98 130.57 1orr s PHE 31 Ca -0.15 -1.33 -0.26 0.00 -0.96 0.00 0.00 56.93 54.23 1orr s PHE 31 Cb -0.17 -1.81 0.08 0.00 -0.34 0.00 0.00 43.02 40.77 1orr s PHE 31 CO 0.08 -0.60 0.67 0.34 -1.46 0.00 0.00 175.22 174.25 1orr s ASP 32 N 0.79 -0.55 0.00 6.13 -1.08 -1.04 -0.18 116.67 120.73 1orr s ASP 32 Ca -0.08 0.17 0.21 0.00 -0.52 0.00 0.00 52.55 52.34 1orr s ASP 32 Cb -0.16 0.55 0.06 0.00 -1.46 0.00 0.00 42.92 41.91 1orr s ASP 32 CO -0.01 -0.82 1.10 -0.46 0.52 0.00 0.00 175.17 175.49 1orr n ASN 33 N -0.05 2.30 -1.61 -0.34 6.94 -1.09 -1.52 115.26 119.89 1orr n ASN 33 Ca -0.16 -1.65 -0.16 0.00 -0.02 0.00 0.00 54.58 52.60 1orr n ASN 33 Cb 0.63 0.29 -0.03 0.00 -2.36 0.00 0.00 39.78 38.31 1orr n ASN 33 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1orr n LEU 34 N 0.47 -1.54 0.09 -4.53 4.77 -1.26 -4.91 117.00 110.08 1orr n LEU 34 Ca 0.10 0.11 -0.06 0.00 -0.03 0.00 0.00 56.01 56.13 1orr n LEU 34 Cb 0.48 -2.32 -0.03 0.00 -2.33 0.00 0.00 43.42 39.22 1orr n LEU 34 CO 0.21 -0.36 0.23 0.77 -1.33 0.00 0.00 177.39 176.91 1orr h SER 35 N 0.00 0.07 -3.10 -1.43 4.64 -1.98 -3.45 113.55 108.30 1orr h SER 35 Ca -0.36 -0.06 -0.54 0.00 -0.47 0.00 0.00 61.79 60.36 1orr h SER 35 Cb 1.20 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 1orr h SER 35 CO 0.45 0.93 0.67 -0.60 -0.87 0.00 0.00 176.83 177.41 1orr s ARG 36 N -3.01 4.37 0.17 4.77 6.06 -1.26 -4.96 118.95 125.10 1orr s ARG 36 Ca -0.01 1.76 -0.32 0.00 -2.50 0.00 0.00 55.73 54.67 1orr s ARG 36 Cb 0.10 -3.47 -0.11 0.00 0.06 0.00 0.00 34.95 31.53 1orr s ARG 36 CO 0.81 -0.39 1.74 0.21 -2.50 0.00 0.00 175.30 175.17 1orr s LYS 37 N 1.77 4.14 0.00 5.12 2.20 -1.26 -0.50 119.74 131.21 1orr s LYS 37 Ca 0.58 2.58 0.00 0.00 -0.36 0.00 0.00 55.97 58.77 1orr s LYS 37 Cb -0.28 -3.26 0.00 0.00 -1.51 0.00 0.00 37.83 32.78 1orr s LYS 37 CO 0.26 -0.77 0.00 0.41 -0.36 0.00 0.00 175.35 174.89 1orr n GLY 38 N 4.05 1.77 0.31 5.54 0.00 -1.26 -4.75 105.19 110.84 1orr n GLY 38 Ca 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 1orr n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orr h ALA 39 N 0.00 0.98 -0.74 4.61 0.00 -0.99 -0.19 119.26 122.92 1orr h ALA 39 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1orr h ALA 39 Cb 0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 1orr h ALA 39 CO 0.00 0.47 0.39 1.79 0.00 0.00 0.00 179.25 181.91 1orr h THR 40 N 1.05 1.22 -0.51 0.00 1.35 -1.86 0.10 112.91 114.27 1orr h THR 40 Ca 0.27 -0.58 -0.08 0.00 -0.55 0.00 0.00 66.41 65.47 1orr h THR 40 Cb 0.01 0.23 -0.02 0.00 -1.73 0.00 0.00 68.15 66.64 1orr h THR 40 CO -0.05 0.26 0.02 0.44 -0.25 0.00 0.00 175.52 175.93 1orr h ASP 41 N 1.04 0.86 -0.51 5.36 3.32 -1.76 -1.06 116.42 123.68 1orr h ASP 41 Ca 0.26 -0.30 -0.11 0.00 0.02 0.00 0.00 57.03 56.91 1orr h ASP 41 Cb 0.05 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1orr h ASP 41 CO -0.04 0.95 -0.09 0.78 -1.72 0.00 0.00 179.24 179.12 1orr h ASN 42 N 0.75 0.98 -0.61 6.45 2.35 -0.55 -0.36 115.58 124.60 1orr h ASN 42 Ca 0.15 -0.31 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 1orr h ASN 42 Cb 0.50 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.57 1orr h ASN 42 CO 0.02 1.09 0.40 0.25 -1.65 0.00 0.00 177.43 177.54 1orr h LEU 43 N 0.88 0.70 -0.62 1.61 5.85 -0.51 0.35 115.31 123.58 1orr h LEU 43 Ca 0.14 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1orr h LEU 43 Cb 0.64 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1orr h LEU 43 CO 0.04 0.52 0.30 -0.74 -0.34 0.00 0.00 178.44 178.22 1orr h HIS 44 N 0.82 0.89 -0.56 1.25 2.76 -0.91 -1.15 115.15 118.25 1orr h HIS 44 Ca 0.22 -0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 1orr h HIS 44 Cb -0.08 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 28.57 1orr h HIS 44 CO -0.03 0.67 0.22 2.35 -1.30 0.00 0.00 177.93 179.84 1orr h TRP 45 N 0.85 0.86 -0.22 5.26 7.01 -0.34 -2.64 115.95 126.74 1orr h TRP 45 Ca 0.21 -0.07 -0.10 0.00 2.11 0.00 0.00 58.89 61.05 1orr h TRP 45 Cb 0.11 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 26.90 1orr h TRP 45 CO -0.00 0.70 -0.29 -0.07 -2.79 0.00 0.00 178.44 175.99 1orr h LEU 46 N 0.77 0.43 -1.95 0.65 3.38 -0.02 -2.93 115.31 115.64 1orr h LEU 46 Ca 0.19 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1orr h LEU 46 Cb 0.20 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1orr h LEU 46 CO -0.02 0.71 -0.06 0.28 0.09 0.00 0.00 178.44 179.44 1orr h SER 47 N 0.37 0.00 0.96 -0.43 0.02 -0.87 0.78 113.55 114.38 1orr h SER 47 Ca 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1orr h SER 47 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1orr h SER 47 CO 0.05 0.06 -0.32 -1.54 -1.14 0.00 0.00 176.83 173.94 1orr n SER 48 N -4.36 0.54 0.05 3.07 3.41 -1.05 -3.76 113.62 111.52 1orr n SER 48 Ca -0.03 0.23 -0.02 0.00 -0.26 0.00 0.00 58.87 58.79 1orr n SER 48 Cb 0.14 -0.18 -0.08 0.00 -0.26 0.00 0.00 64.21 63.83 1orr n SER 48 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1orr h LEU 49 N 0.00 0.00 0.00 1.04 3.38 -0.78 -3.50 115.31 115.45 1orr h LEU 49 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1orr h LEU 49 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1orr h LEU 49 CO 0.00 0.71 0.00 0.61 0.09 0.00 0.00 178.44 179.85 1orr n GLY 50 N 1.39 -1.66 3.88 0.83 0.00 -1.02 -4.91 105.19 103.70 1orr n GLY 50 Ca -0.08 -1.08 -0.36 0.00 0.00 0.00 0.00 46.02 44.50 1orr n GLY 50 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1orr s ASN 51 N -1.34 6.49 0.24 1.61 0.01 -1.26 -4.50 114.94 116.19 1orr s ASN 51 Ca 0.00 0.57 -0.22 0.00 -0.71 0.00 0.00 52.86 52.50 1orr s ASN 51 Cb 0.00 -2.10 0.04 0.00 0.41 0.00 0.00 41.25 39.60 1orr s ASN 51 CO 0.00 0.34 0.82 0.72 -1.51 0.00 0.00 177.10 177.47 1orr s PHE 52 N -1.14 -0.14 -0.31 2.20 -0.12 -1.26 -4.76 117.98 112.44 1orr s PHE 52 Ca 0.21 -0.28 -0.16 0.00 -0.05 0.00 0.00 56.93 56.66 1orr s PHE 52 Cb -0.13 0.69 -0.02 0.00 -0.63 0.00 0.00 43.02 42.93 1orr s PHE 52 CO 0.10 -1.11 0.40 -1.21 -0.05 0.00 0.00 175.22 173.35 1orr s GLU 53 N -3.55 3.79 -0.19 1.99 0.41 -0.40 -5.01 118.70 115.73 1orr s GLU 53 Ca 0.12 -0.14 -0.10 0.00 -0.41 0.00 0.00 54.97 54.44 1orr s GLU 53 Cb -0.04 -3.73 -0.05 0.00 -1.78 0.00 0.00 34.13 28.53 1orr s GLU 53 CO 0.06 -0.43 0.13 0.12 -0.49 0.00 0.00 175.26 174.65 1orr s PHE 54 N 2.12 3.43 -0.22 1.61 5.36 -1.26 -0.52 117.98 128.49 1orr s PHE 54 Ca 0.15 0.35 0.00 0.00 -0.96 0.00 0.00 56.93 56.47 1orr s PHE 54 Cb -0.16 -2.14 0.05 0.00 -0.34 0.00 0.00 43.02 40.44 1orr s PHE 54 CO 0.11 0.33 -0.05 0.08 -1.46 0.00 0.00 175.22 174.23 1orr s VAL 55 N 0.24 1.41 0.16 3.12 1.01 0.63 -4.94 120.40 122.02 1orr s VAL 55 Ca 0.09 -1.06 -0.30 0.00 0.00 0.00 0.00 61.98 60.71 1orr s VAL 55 Cb -0.11 -1.65 -0.07 0.00 0.00 0.00 0.00 36.38 34.54 1orr s VAL 55 CO -0.01 -0.04 1.17 -2.28 0.00 0.00 0.00 175.10 173.94 1orr s HIS 56 N 1.46 3.47 0.02 5.22 2.46 -1.26 -2.50 115.29 124.16 1orr s HIS 56 Ca -0.04 1.44 -0.29 0.00 0.47 0.00 0.00 55.06 56.64 1orr s HIS 56 Cb -0.18 -3.39 0.10 0.00 -0.13 0.00 0.00 32.58 28.98 1orr s HIS 56 CO -0.07 -1.08 1.12 0.20 -2.47 0.00 0.00 174.74 172.44 1orr s GLY 57 N 0.27 -0.34 -0.26 1.59 0.00 -0.57 -4.88 107.32 103.12 1orr s GLY 57 Ca 0.53 0.68 -0.03 0.00 0.00 0.00 0.00 44.72 45.89 1orr s GLY 57 CO 0.35 0.17 -0.02 -0.35 0.00 0.00 0.00 173.10 173.25 1orr s ASP 58 N -2.79 4.54 0.63 1.64 -1.08 -1.26 -2.66 116.67 115.69 1orr s ASP 58 Ca 0.12 -0.74 0.34 0.00 -0.52 0.00 0.00 52.55 51.74 1orr s ASP 58 Cb 0.01 -1.74 1.90 0.00 -1.46 0.00 0.00 42.92 41.63 1orr s ASP 58 CO -0.03 -0.13 2.15 -0.29 0.52 0.00 0.00 175.17 177.39 1orr h ILE 59 N 5.99 0.22 0.00 4.11 6.09 -1.95 -0.11 117.51 131.85 1orr h ILE 59 Ca -0.34 0.00 -0.03 0.00 -1.37 0.00 0.00 64.86 63.13 1orr h ILE 59 Cb 1.12 0.85 -0.00 0.00 0.47 0.00 0.00 36.82 39.26 1orr h ILE 59 CO 0.59 0.00 -0.13 0.03 -3.07 0.00 0.00 178.15 175.57 1orr h ARG 60 N 0.00 0.00 -6.10 2.19 3.08 -1.87 -3.36 114.38 108.32 1orr h ARG 60 Ca 0.04 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.48 1orr h ARG 60 Cb 0.37 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.31 1orr h ARG 60 CO -0.00 0.13 0.55 1.21 -1.07 0.00 0.00 179.97 180.79 1orr s ASN 61 N -6.00 6.50 0.21 7.04 3.84 -0.06 -4.78 114.94 121.69 1orr s ASN 61 Ca 0.01 0.11 -0.10 0.00 0.21 0.00 0.00 52.86 53.09 1orr s ASN 61 Cb 0.10 -2.44 0.20 0.00 -0.55 0.00 0.00 41.25 38.55 1orr s ASN 61 CO 0.60 -1.03 1.85 0.50 -2.79 0.00 0.00 177.10 176.23 1orr h LYS 62 N 9.04 0.84 -0.61 0.43 3.64 -1.85 -2.07 116.57 126.00 1orr h LYS 62 Ca -0.24 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.08 1orr h LYS 62 Cb 1.08 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.68 1orr h LYS 62 CO 1.02 0.56 0.33 -0.97 -2.27 0.00 0.00 179.45 178.12 1orr h ASN 63 N 0.87 0.75 -0.38 4.20 -1.24 -1.94 -0.20 115.58 117.64 1orr h ASN 63 Ca 0.29 -0.09 0.03 0.00 0.71 0.00 0.00 56.30 57.24 1orr h ASN 63 Cb 0.03 -0.19 -0.03 0.00 0.73 0.00 0.00 38.32 38.86 1orr h ASN 63 CO -0.11 0.63 0.19 0.44 -1.29 0.00 0.00 177.43 177.28 1orr h ASP 64 N 0.82 0.27 -0.20 1.15 5.19 -1.78 -1.08 116.42 120.79 1orr h ASP 64 Ca 0.21 0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.61 1orr h ASP 64 Cb 0.04 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 39.51 1orr h ASP 64 CO -0.03 0.20 -0.01 0.58 -3.12 0.00 0.00 179.24 176.85 1orr h VAL 65 N 0.38 1.26 -0.20 -1.35 2.07 -1.02 -2.53 116.25 114.87 1orr h VAL 65 Ca 0.16 -0.91 0.02 0.00 0.82 0.00 0.00 66.70 66.79 1orr h VAL 65 Cb 0.07 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1orr h VAL 65 CO -0.11 0.28 0.06 0.74 0.02 0.00 0.00 177.57 178.55 1orr h THR 66 N 0.10 0.94 -0.37 2.57 2.02 -0.93 -1.55 112.91 115.68 1orr h THR 66 Ca 0.05 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1orr h THR 66 Cb 0.42 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 1orr h THR 66 CO 0.01 0.03 0.16 0.03 0.37 0.00 0.00 175.52 176.12 1orr h ARG 67 N 0.15 0.52 -0.14 6.66 3.08 -1.22 -1.49 114.38 121.93 1orr h ARG 67 Ca 0.09 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1orr h ARG 67 Cb 0.07 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1orr h ARG 67 CO -0.10 0.42 0.07 1.25 -1.07 0.00 0.00 179.97 180.54 1orr h LEU 68 N 0.52 0.18 -0.25 3.04 5.85 -0.96 0.77 115.31 124.47 1orr h LEU 68 Ca 0.13 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 1orr h LEU 68 Cb 0.09 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1orr h LEU 68 CO -0.01 0.25 0.02 0.40 -0.34 0.00 0.00 178.44 178.75 1orr h ILE 69 N 0.11 1.24 -0.08 4.05 1.08 -0.89 -1.79 117.51 121.23 1orr h ILE 69 Ca 0.05 -0.85 -0.11 0.00 -0.39 0.00 0.00 64.86 63.56 1orr h ILE 69 Cb 0.11 1.32 -0.01 0.00 -3.07 0.00 0.00 36.82 35.17 1orr h ILE 69 CO -0.01 0.27 -0.46 0.71 -0.69 0.00 0.00 178.15 177.97 1orr h THR 70 N 0.21 1.33 -0.06 -0.27 1.35 -1.27 0.41 112.91 114.61 1orr h THR 70 Ca 0.07 -1.63 -0.12 0.00 -0.55 0.00 0.00 66.41 64.18 1orr h THR 70 Cb 0.38 1.78 0.01 0.00 -1.73 0.00 0.00 68.15 68.58 1orr h THR 70 CO 0.01 0.48 -0.42 0.50 -0.25 0.00 0.00 175.52 175.84 1orr h LYS 71 N 0.16 0.40 0.00 4.72 3.64 -0.79 -3.36 116.57 121.34 1orr h LYS 71 Ca 0.01 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1orr h LYS 71 Cb 0.88 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.78 1orr h LYS 71 CO 0.07 0.99 -1.60 0.66 -2.27 0.00 0.00 179.45 177.30 1orr n TYR 72 N -4.34 0.19 -4.05 1.91 4.02 -0.68 -5.01 117.16 109.21 1orr n TYR 72 Ca -0.09 0.06 -0.44 0.00 -0.01 0.00 0.00 57.90 57.42 1orr n TYR 72 Cb 0.56 -0.51 0.02 0.00 -0.02 0.00 0.00 39.34 39.39 1orr n TYR 72 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 1orr n MET 73 N -2.20 -0.40 -1.39 -0.72 2.81 0.14 -4.88 117.12 110.49 1orr n MET 73 Ca -0.02 0.16 -0.33 0.00 -1.81 0.00 0.00 57.70 55.70 1orr n MET 73 Cb 0.52 -2.42 0.09 0.00 -0.71 0.00 0.00 33.22 30.71 1orr n MET 73 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1orr s PRO 74 N -7.13 2.13 -0.02 0.03 0.04 -1.26 -4.96 135.00 123.83 1orr s PRO 74 Ca 0.43 1.60 0.12 0.00 0.04 0.00 0.00 61.00 63.19 1orr s PRO 74 Cb -0.24 -1.85 -0.22 0.00 0.04 0.00 0.00 34.50 32.23 1orr s PRO 74 CO 0.97 -1.81 0.74 -0.44 0.04 0.00 0.00 177.00 176.50 1orr h ASP 75 N -0.51 0.00 -5.21 6.66 3.32 -1.42 -3.42 116.42 115.84 1orr h ASP 75 Ca -0.46 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.48 1orr h ASP 75 Cb 1.28 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.68 1orr h ASP 75 CO 0.50 0.99 -0.55 -0.94 -1.72 0.00 0.00 179.24 177.52 1orr s SER 76 N -6.15 0.33 -0.20 6.45 1.04 -0.94 -1.53 113.70 112.70 1orr s SER 76 Ca -0.04 -0.86 -0.16 0.00 0.48 0.00 0.00 55.95 55.37 1orr s SER 76 Cb 0.08 0.26 0.05 0.00 0.10 0.00 0.00 66.02 66.52 1orr s SER 76 CO 0.82 -0.66 0.51 0.00 0.98 0.00 0.00 173.24 174.90 1orr s PHE 78 N 0.55 3.14 -0.71 0.00 0.08 -0.02 -1.20 117.98 119.83 1orr s PHE 78 Ca -0.02 -0.78 -0.16 0.00 0.12 0.00 0.00 56.93 56.09 1orr s PHE 78 Cb -0.04 -2.28 0.16 0.00 -0.57 0.00 0.00 43.02 40.28 1orr s PHE 78 CO -0.03 -0.51 0.73 -1.58 -0.10 0.00 0.00 175.22 173.73 1orr s HIS 79 N 1.55 3.36 -0.49 0.36 5.65 0.05 -1.72 115.29 124.05 1orr s HIS 79 Ca 0.04 -1.48 0.11 0.00 0.25 0.00 0.00 55.06 53.98 1orr s HIS 79 Cb -0.17 -3.93 -0.13 0.00 -1.18 0.00 0.00 32.58 27.18 1orr s HIS 79 CO 0.04 -1.14 0.46 1.28 -0.65 0.00 0.00 174.74 174.72 1orr n LEU 80 N 5.22 0.48 -4.72 8.88 4.77 -0.91 -3.31 117.00 127.42 1orr n LEU 80 Ca 0.02 -0.46 -0.42 0.00 -0.03 0.00 0.00 56.01 55.12 1orr n LEU 80 Cb 0.44 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.50 1orr n LEU 80 CO 0.47 0.12 1.29 0.00 -1.33 0.00 0.00 177.39 177.94 1orr s ALA 81 N -2.11 3.83 0.10 -1.18 0.00 -1.06 -4.71 121.76 116.63 1orr s ALA 81 Ca 0.04 1.44 -0.26 0.00 0.00 0.00 0.00 51.96 53.17 1orr s ALA 81 Cb 0.08 -3.66 0.08 0.00 0.00 0.00 0.00 23.12 19.63 1orr s ALA 81 CO 0.46 -0.86 1.09 0.20 0.00 0.00 0.00 175.76 176.65 1orr s GLY 82 N 1.28 -0.23 -0.34 0.00 0.00 -1.26 -4.88 107.32 101.88 1orr s GLY 82 Ca 0.72 0.23 -0.13 0.00 0.00 0.00 0.00 44.72 45.54 1orr s GLY 82 CO 0.32 0.65 0.27 1.62 0.00 0.00 0.00 173.10 175.95 1orr s GLN 83 N -2.79 3.51 0.00 2.90 -0.44 -1.26 -4.97 119.66 116.61 1orr s GLN 83 Ca 0.15 -0.59 0.16 0.00 -2.50 0.00 0.00 55.36 52.58 1orr s GLN 83 Cb 0.00 -3.81 -0.05 0.00 -1.64 0.00 0.00 33.01 27.51 1orr s GLN 83 CO 0.01 -0.47 0.81 1.55 0.50 0.00 0.00 175.29 177.69 1orr n VAL 84 N 5.14 0.00 -3.55 1.34 3.14 -1.26 -4.94 118.33 118.20 1orr n VAL 84 Ca -0.12 -0.27 -0.37 0.00 -2.96 0.00 0.00 64.34 60.62 1orr n VAL 84 Cb 0.50 1.14 -0.08 0.00 -1.06 0.00 0.00 33.84 34.34 1orr n VAL 84 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1orr s ALA 85 N -2.09 3.60 0.22 1.55 0.00 -1.26 -4.95 121.76 118.83 1orr s ALA 85 Ca 0.11 -0.57 -0.06 0.00 0.00 0.00 0.00 51.96 51.45 1orr s ALA 85 Cb 0.13 -2.41 0.21 0.00 0.00 0.00 0.00 23.12 21.05 1orr s ALA 85 CO 0.48 -0.03 1.72 1.98 0.00 0.00 0.00 175.76 179.90 1orr h MET 86 N 6.97 0.97 -0.10 0.00 4.05 -1.93 -1.61 114.93 123.27 1orr h MET 86 Ca -0.39 -0.26 0.02 0.00 -0.28 0.00 0.00 59.70 58.79 1orr h MET 86 Cb 1.16 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.83 1orr h MET 86 CO 0.73 0.92 -0.05 1.15 0.23 0.00 0.00 176.91 179.90 1orr h THR 87 N 0.90 0.84 -0.58 -0.77 2.02 -1.92 -1.51 112.91 111.88 1orr h THR 87 Ca 0.18 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.34 1orr h THR 87 Cb 0.46 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 1orr h THR 87 CO 0.02 0.00 0.28 0.74 0.37 0.00 0.00 175.52 176.93 1orr h THR 88 N -0.04 1.19 0.00 3.16 2.02 -1.88 -0.41 112.91 116.95 1orr h THR 88 Ca 0.06 -0.54 -0.04 0.00 0.77 0.00 0.00 66.41 66.66 1orr h THR 88 Cb 0.13 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 1orr h THR 88 CO -0.13 0.22 -0.18 0.77 0.37 0.00 0.00 175.52 176.57 1orr h SER 89 N 0.81 0.00 0.78 4.18 4.64 -0.58 0.60 113.55 123.99 1orr h SER 89 Ca 0.20 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.28 1orr h SER 89 Cb 0.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1orr h SER 89 CO -0.03 0.18 -1.11 0.40 -0.87 0.00 0.00 176.83 175.41 1orr h ILE 90 N 0.00 1.59 0.00 0.95 2.04 -0.13 -2.56 117.51 119.40 1orr h ILE 90 Ca -0.00 -3.17 -0.15 0.00 1.00 0.00 0.00 64.86 62.54 1orr h ILE 90 Cb 0.33 2.86 -0.02 0.00 -0.74 0.00 0.00 36.82 39.25 1orr h ILE 90 CO 0.02 0.92 -0.83 -0.78 0.00 0.00 0.00 178.15 177.48 1orr h ASP 91 N 0.05 0.00 -1.98 1.72 3.58 -0.55 -3.39 116.42 115.84 1orr h ASP 91 Ca -0.07 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 56.84 1orr h ASP 91 Cb 1.84 0.00 -0.36 0.00 1.72 0.00 0.00 39.33 42.53 1orr h ASP 91 CO 0.17 0.64 -1.01 -3.20 -2.88 0.00 0.00 179.24 172.96 1orr n ASN 92 N -3.18 -0.37 0.18 2.28 2.85 0.20 -4.98 115.26 112.25 1orr n ASN 92 Ca -0.01 -2.62 0.04 0.00 -0.11 0.00 0.00 54.58 51.88 1orr n ASN 92 Cb 0.81 -0.38 0.47 0.00 1.24 0.00 0.00 39.78 41.91 1orr n ASN 92 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1orr h PRO 93 N 4.60 0.11 -0.23 1.20 0.13 -1.65 -2.63 132.00 133.54 1orr h PRO 93 Ca 0.13 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 1orr h PRO 93 Cb 0.91 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 1orr h PRO 93 CO 0.41 0.25 0.09 0.00 -0.23 0.00 0.00 178.00 178.51 1orr h MET 95 N 0.22 1.07 -0.78 0.00 1.85 -1.91 -1.04 114.93 114.35 1orr h MET 95 Ca 0.08 -0.16 -0.03 0.00 -0.61 0.00 0.00 59.70 58.98 1orr h MET 95 Cb 0.17 -0.19 -0.04 0.00 0.43 0.00 0.00 31.60 31.98 1orr h MET 95 CO -0.01 0.84 0.39 0.22 -0.40 0.00 0.00 176.91 177.95 1orr h ASP 96 N 1.04 1.01 -0.14 1.39 1.82 -1.25 -1.15 116.42 119.14 1orr h ASP 96 Ca 0.25 -0.13 -0.02 0.00 -0.39 0.00 0.00 57.03 56.75 1orr h ASP 96 Cb 0.13 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 39.87 1orr h ASP 96 CO -0.03 0.85 0.03 0.15 -1.61 0.00 0.00 179.24 178.63 1orr h PHE 97 N 1.10 0.24 -0.28 0.28 3.57 -0.86 -0.87 116.94 120.12 1orr h PHE 97 Ca 0.27 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.75 1orr h PHE 97 Cb 0.10 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 1orr h PHE 97 CO 0.01 0.39 0.16 0.93 -2.23 0.00 0.00 178.31 177.57 1orr h GLU 98 N 0.02 0.32 0.16 1.11 5.08 -0.98 0.93 114.58 121.22 1orr h GLU 98 Ca 0.04 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1orr h GLU 98 Cb 0.28 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1orr h GLU 98 CO 0.00 0.21 -0.08 0.82 -1.00 0.00 0.00 179.01 178.97 1orr h ILE 99 N 0.33 0.94 -0.08 3.13 2.04 -1.21 0.46 117.51 123.11 1orr h ILE 99 Ca 0.11 -1.01 -0.06 0.00 1.00 0.00 0.00 64.86 64.90 1orr h ILE 99 Cb -0.00 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1orr h ILE 99 CO -0.05 0.21 -0.19 0.78 0.00 0.00 0.00 178.15 178.90 1orr h ASN 100 N -0.76 0.31 0.00 1.72 2.35 -1.15 -2.19 115.58 115.86 1orr h ASN 100 Ca -0.02 -0.58 -0.07 0.00 -0.55 0.00 0.00 56.30 55.08 1orr h ASN 100 Cb 0.52 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 1orr h ASN 100 CO 0.04 0.83 -0.51 0.58 -1.65 0.00 0.00 177.43 176.72 1orr h VAL 101 N -0.20 0.73 -0.46 2.81 2.07 -1.00 -3.19 116.25 117.02 1orr h VAL 101 Ca -0.00 -1.70 0.05 0.00 0.82 0.00 0.00 66.70 65.87 1orr h VAL 101 Cb 0.79 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 32.04 1orr h VAL 101 CO 0.04 0.25 0.20 1.23 0.02 0.00 0.00 177.57 179.30 1orr h GLY 102 N -1.00 0.62 1.07 2.17 0.00 -0.90 -0.68 103.07 104.35 1orr h GLY 102 Ca -0.11 -0.12 -0.06 0.00 0.00 0.00 0.00 47.33 47.04 1orr h GLY 102 CO -0.07 0.06 0.25 -1.33 0.00 0.00 0.00 176.54 175.45 1orr h GLY 103 N 0.39 1.25 0.96 4.60 0.00 -0.24 -0.80 103.07 109.24 1orr h GLY 103 Ca 0.21 -0.72 -0.09 0.00 0.00 0.00 0.00 47.33 46.73 1orr h GLY 103 CO -0.18 0.68 -0.10 -0.84 0.00 0.00 0.00 176.54 176.10 1orr h THR 104 N 1.12 1.28 -0.68 4.70 2.02 -1.43 -2.33 112.91 117.58 1orr h THR 104 Ca 0.25 -1.18 -0.06 0.00 0.77 0.00 0.00 66.41 66.19 1orr h THR 104 Cb 0.29 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 1orr h THR 104 CO -0.01 0.39 0.19 -0.07 0.37 0.00 0.00 175.52 176.39 1orr h LEU 105 N 0.53 1.00 -0.45 2.58 -0.00 -1.00 0.15 115.31 118.12 1orr h LEU 105 Ca 0.09 -0.19 0.05 0.00 -0.00 0.00 0.00 57.88 57.83 1orr h LEU 105 Cb 0.61 -0.26 -0.04 0.00 -0.00 0.00 0.00 40.66 40.97 1orr h LEU 105 CO 0.04 0.94 0.20 0.78 -0.00 0.00 0.00 178.44 180.40 1orr h ASN 106 N 1.02 0.27 -0.27 -0.43 2.35 -0.94 0.13 115.58 117.71 1orr h ASN 106 Ca 0.22 0.04 -0.05 0.00 -0.55 0.00 0.00 56.30 55.95 1orr h ASN 106 Cb 0.32 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1orr h ASN 106 CO -0.00 0.19 -0.03 0.25 -1.65 0.00 0.00 177.43 176.18 1orr h LEU 107 N 0.40 0.50 -0.51 1.61 5.85 -0.89 -1.88 115.31 120.39 1orr h LEU 107 Ca 0.20 -0.34 0.04 0.00 0.84 0.00 0.00 57.88 58.62 1orr h LEU 107 Cb 0.15 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1orr h LEU 107 CO -0.17 0.72 0.28 -0.07 -0.34 0.00 0.00 178.44 178.86 1orr h LEU 108 N 0.27 0.43 -0.65 2.25 3.38 -0.26 -0.04 115.31 120.68 1orr h LEU 108 Ca 0.07 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1orr h LEU 108 Cb 0.48 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1orr h LEU 108 CO 0.02 0.30 0.28 -0.33 0.09 0.00 0.00 178.44 178.79 1orr h GLU 109 N 0.55 0.95 -0.55 1.13 4.39 -0.73 0.17 114.58 120.49 1orr h GLU 109 Ca 0.22 -0.16 -0.11 0.00 0.34 0.00 0.00 59.36 59.65 1orr h GLU 109 Cb 0.08 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 1orr h GLU 109 CO -0.13 0.79 -0.07 0.00 -1.16 0.00 0.00 179.01 178.44 1orr h ALA 110 N 1.12 0.83 -0.22 3.43 0.00 -0.85 -0.76 119.26 122.81 1orr h ALA 110 Ca 0.22 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1orr h ALA 110 Cb 0.18 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1orr h ALA 110 CO -0.02 0.66 -0.25 0.28 0.00 0.00 0.00 179.25 179.92 1orr h VAL 111 N 0.90 1.32 -0.34 0.00 2.07 -0.82 -0.86 116.25 118.53 1orr h VAL 111 Ca 0.15 -1.43 0.04 0.00 0.82 0.00 0.00 66.70 66.28 1orr h VAL 111 Cb 0.62 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 32.09 1orr h VAL 111 CO 0.04 0.44 0.12 -0.09 0.02 0.00 0.00 177.57 178.11 1orr h ARG 112 N 0.25 0.27 0.06 1.57 2.43 -0.51 0.20 114.38 118.65 1orr h ARG 112 Ca 0.03 -0.02 -0.24 0.00 -0.81 0.00 0.00 59.98 58.94 1orr h ARG 112 Cb 0.81 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1orr h ARG 112 CO 0.06 0.18 -1.07 1.96 -1.51 0.00 0.00 179.97 179.58 1orr h GLN 113 N 0.27 0.30 0.00 0.20 4.20 -1.12 -3.39 115.11 115.56 1orr h GLN 113 Ca 0.15 -0.40 0.00 0.00 0.06 0.00 0.00 58.65 58.46 1orr h GLN 113 Cb 0.12 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.03 1orr h GLN 113 CO -0.15 1.13 -0.03 0.66 -0.67 0.00 0.00 178.83 179.77 1orr n TYR 114 N -3.62 0.00 -2.75 2.96 4.02 -0.33 -4.88 117.16 112.56 1orr n TYR 114 Ca -0.07 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.73 1orr n TYR 114 Cb 0.92 -0.00 0.09 0.00 -0.02 0.00 0.00 39.34 40.33 1orr n TYR 114 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1orr n ASN 115 N -1.01 -1.77 0.20 7.72 5.15 0.43 -4.95 115.26 121.02 1orr n ASN 115 Ca 0.00 -3.14 0.11 0.00 -0.60 0.00 0.00 54.58 50.95 1orr n ASN 115 Cb 0.00 1.29 0.57 0.00 -0.53 0.00 0.00 39.78 41.11 1orr n ASN 115 CO 0.00 0.00 0.00 0.77 1.40 0.00 0.00 177.26 179.43 1orr h SER 116 N 2.62 0.00 0.49 1.20 4.64 -1.02 -2.16 113.55 119.32 1orr h SER 116 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1orr h SER 116 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1orr h SER 116 CO 0.10 0.00 -0.30 0.59 -0.87 0.00 0.00 176.83 176.35 1orr n ASN 117 N -2.32 0.53 -4.66 4.97 3.02 -1.26 -4.55 115.26 110.98 1orr n ASN 117 Ca -0.01 -0.34 -0.48 0.00 -0.03 0.00 0.00 54.58 53.72 1orr n ASN 117 Cb 0.21 0.05 -0.05 0.00 -0.61 0.00 0.00 39.78 39.38 1orr n ASN 117 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1orr s ASN 119 N 1.81 7.43 -0.05 0.00 0.01 -0.58 -4.23 114.94 119.32 1orr s ASN 119 Ca 0.84 1.69 0.02 0.00 -0.71 0.00 0.00 52.86 54.71 1orr s ASN 119 Cb -0.74 -2.53 0.01 0.00 0.41 0.00 0.00 41.25 38.40 1orr s ASN 119 CO 0.44 0.14 -0.10 -0.63 -1.51 0.00 0.00 177.10 175.44 1orr s ILE 120 N -0.84 0.93 -0.17 0.60 1.01 0.06 0.16 121.20 122.95 1orr s ILE 120 Ca 0.39 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.63 1orr s ILE 120 Cb -0.23 -0.86 -0.02 0.00 0.01 0.00 0.00 42.46 41.36 1orr s ILE 120 CO 0.27 0.30 -0.08 -0.63 0.00 0.00 0.00 174.94 174.81 1orr s ILE 121 N 0.59 3.36 -0.14 2.92 1.01 -0.34 -0.99 121.20 127.61 1orr s ILE 121 Ca -0.11 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 59.98 1orr s ILE 121 Cb -0.14 -2.47 -0.03 0.00 0.01 0.00 0.00 42.46 39.84 1orr s ILE 121 CO 0.02 0.48 -0.04 -0.47 0.00 0.00 0.00 174.94 174.94 1orr s TYR 122 N 0.75 3.03 -0.78 3.97 5.04 0.10 -0.77 117.35 128.70 1orr s TYR 122 Ca -0.03 -0.20 -0.20 0.00 -2.44 0.00 0.00 57.07 54.19 1orr s TYR 122 Cb -0.15 -1.90 0.10 0.00 0.35 0.00 0.00 41.96 40.36 1orr s TYR 122 CO 0.02 0.07 1.01 -1.54 -1.34 0.00 0.00 175.55 173.77 1orr s SER 123 N 0.07 6.38 0.17 4.32 1.04 -1.21 -1.19 113.70 123.27 1orr s SER 123 Ca -0.00 -1.51 0.00 0.00 0.48 0.00 0.00 55.95 54.91 1orr s SER 123 Cb -0.13 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.59 1orr s SER 123 CO 0.03 -1.24 0.00 -0.24 0.98 0.00 0.00 173.24 172.77 1orr n SER 124 N 7.05 0.00 -3.96 7.02 2.88 0.12 -4.97 113.62 121.75 1orr n SER 124 Ca 0.08 -0.38 -0.09 0.00 -1.33 0.00 0.00 58.87 57.16 1orr n SER 124 Cb 0.47 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.85 1orr n SER 124 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1orr s THR 125 N 0.73 0.13 -0.35 2.46 -1.32 -1.26 -2.55 115.64 113.48 1orr s THR 125 Ca 0.00 -1.44 0.25 0.00 -1.21 0.00 0.00 61.69 59.29 1orr s THR 125 Cb 0.00 -1.62 0.27 0.00 -1.51 0.00 0.00 72.50 69.64 1orr s THR 125 CO 0.00 -0.57 1.76 -0.55 -2.21 0.00 0.00 174.62 173.05 1orr h ASN 126 N 2.76 0.00 0.39 8.08 -0.00 -1.36 -2.89 115.58 122.56 1orr h ASN 126 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.97 1orr h ASN 126 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.52 1orr h ASN 126 CO 0.56 0.00 0.00 0.29 -0.00 0.00 0.00 177.43 178.28 1orr n LYS 127 N -2.38 0.11 0.08 4.14 4.76 -1.26 -2.38 118.16 121.23 1orr n LYS 127 Ca 0.01 0.20 0.10 0.00 -2.87 0.00 0.00 58.31 55.75 1orr n LYS 127 Cb 0.22 -1.50 0.43 0.00 -1.84 0.00 0.00 35.03 32.33 1orr n LYS 127 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1orr n VAL 128 N -1.39 0.82 1.13 -0.18 0.24 -1.09 -2.90 118.33 114.96 1orr n VAL 128 Ca 0.05 0.18 0.12 0.00 -2.04 0.00 0.00 64.34 62.65 1orr n VAL 128 Cb 0.14 -1.02 0.36 0.00 -1.47 0.00 0.00 33.84 31.85 1orr n VAL 128 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1orr n TYR 129 N -1.94 0.17 -4.34 6.34 4.02 -1.00 -0.89 117.16 119.52 1orr n TYR 129 Ca 0.03 -0.08 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 1orr n TYR 129 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.55 1orr n TYR 129 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1orr n GLY 130 N 1.23 -0.04 0.05 2.72 0.00 0.18 -3.99 105.19 105.34 1orr n GLY 130 Ca 0.17 -0.98 0.13 0.00 0.00 0.00 0.00 46.02 45.34 1orr n GLY 130 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1orr n ASP 131 N -0.45 0.57 -2.10 1.61 5.68 -1.26 -4.80 116.55 115.79 1orr n ASP 131 Ca 0.00 0.28 -0.20 0.00 -0.50 0.00 0.00 54.79 54.38 1orr n ASP 131 Cb 0.00 -0.26 -0.04 0.00 -1.14 0.00 0.00 41.12 39.68 1orr n ASP 131 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1orr n LEU 132 N -1.94 -1.68 0.00 -2.12 4.77 -1.26 -4.52 117.00 110.25 1orr n LEU 132 Ca 0.05 0.19 0.11 0.00 -0.03 0.00 0.00 56.01 56.33 1orr n LEU 132 Cb 0.40 -2.78 0.63 0.00 -2.33 0.00 0.00 43.42 39.33 1orr n LEU 132 CO 0.32 -0.51 0.87 -0.62 -1.33 0.00 0.00 177.39 176.13 1orr n GLU 133 N -2.73 0.52 0.22 3.23 -0.58 -1.26 -2.48 120.64 117.56 1orr n GLU 133 Ca -0.22 0.04 0.15 0.00 -0.42 0.00 0.00 57.16 56.71 1orr n GLU 133 Cb 0.66 -1.50 0.59 0.00 -0.57 0.00 0.00 31.44 30.63 1orr n GLU 133 CO 0.00 0.00 0.00 -0.56 -0.48 0.00 0.00 177.13 176.09 1orr h GLN 134 N 0.00 0.00 -7.24 3.49 -0.00 -2.00 -3.44 115.11 105.92 1orr h GLN 134 Ca 0.00 0.00 -0.46 0.00 -0.00 0.00 0.00 58.65 58.19 1orr h GLN 134 Cb 0.11 0.00 0.09 0.00 -0.00 0.00 0.00 27.48 27.68 1orr h GLN 134 CO 0.00 0.00 0.17 0.71 -0.00 0.00 0.00 178.83 179.71 1orr s TYR 135 N -3.52 1.96 -0.17 0.06 1.51 -1.03 -5.08 117.35 111.07 1orr s TYR 135 Ca 0.03 -0.02 -0.06 0.00 -1.01 0.00 0.00 57.07 56.01 1orr s TYR 135 Cb 0.09 -3.20 -0.04 0.00 -0.11 0.00 0.00 41.96 38.70 1orr s TYR 135 CO 0.50 -1.73 0.03 0.15 -1.11 0.00 0.00 175.55 173.39 1orr s LYS 136 N -5.25 3.88 0.27 -0.62 -0.14 -1.26 -5.06 119.74 111.55 1orr s LYS 136 Ca 0.66 -0.40 0.12 0.00 -1.36 0.00 0.00 55.97 54.98 1orr s LYS 136 Cb -0.07 -3.12 -0.05 0.00 -1.68 0.00 0.00 37.83 32.91 1orr s LYS 136 CO 0.45 0.26 -0.20 0.71 -0.76 0.00 0.00 175.35 175.81 1orr s TYR 137 N 0.38 2.31 0.01 3.18 1.51 -1.26 0.07 117.35 123.55 1orr s TYR 137 Ca 0.01 -0.33 0.02 0.00 -1.01 0.00 0.00 57.07 55.76 1orr s TYR 137 Cb -0.13 -1.02 -0.01 0.00 -0.11 0.00 0.00 41.96 40.69 1orr s TYR 137 CO 0.01 0.68 -0.06 1.21 -1.11 0.00 0.00 175.55 176.28 1orr s ASN 138 N -3.38 0.72 -0.22 2.29 2.47 0.20 -4.85 114.94 112.18 1orr s ASN 138 Ca 0.29 -0.25 -0.03 0.00 0.42 0.00 0.00 52.86 53.29 1orr s ASN 138 Cb -0.06 -0.04 -0.00 0.00 -1.45 0.00 0.00 41.25 39.70 1orr s ASN 138 CO 0.14 -0.02 -0.06 -0.70 -3.72 0.00 0.00 177.10 172.75 1orr s GLU 139 N -0.60 3.32 0.00 0.43 2.12 -1.26 0.57 118.70 123.28 1orr s GLU 139 Ca -0.02 -0.66 0.00 0.00 0.36 0.00 0.00 54.97 54.66 1orr s GLU 139 Cb -0.05 -2.97 0.00 0.00 0.26 0.00 0.00 34.13 31.37 1orr s GLU 139 CO 0.00 -0.21 0.00 0.25 -0.54 0.00 0.00 175.26 174.76 1orr n THR 140 N 4.78 0.00 -0.18 -1.70 -2.24 0.19 -5.00 114.28 110.12 1orr n THR 140 Ca -0.18 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.51 1orr n THR 140 Cb 0.51 -0.97 0.01 0.00 -2.10 0.00 0.00 70.33 67.77 1orr n THR 140 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1orr h GLU 141 N 0.00 0.88 -0.00 -0.78 4.81 -2.03 -3.33 114.58 114.13 1orr h GLU 141 Ca 0.00 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1orr h GLU 141 Cb 0.00 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.28 1orr h GLU 141 CO 0.00 0.86 -0.24 0.25 -0.73 0.00 0.00 179.01 179.15 1orr n THR 142 N -4.37 0.00 -3.85 0.32 -2.24 -1.26 -5.05 114.28 97.82 1orr n THR 142 Ca 0.02 -0.38 -0.07 0.00 -2.27 0.00 0.00 64.05 61.35 1orr n THR 142 Cb 0.27 1.06 -0.02 0.00 -2.10 0.00 0.00 70.33 69.54 1orr n THR 142 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1orr s ARG 143 N -1.37 1.77 -0.05 -0.78 1.70 -1.25 -4.46 118.95 114.50 1orr s ARG 143 Ca 0.05 -0.98 -0.09 0.00 -0.47 0.00 0.00 55.73 54.24 1orr s ARG 143 Cb 0.06 0.60 -0.05 0.00 -0.57 0.00 0.00 34.95 34.99 1orr s ARG 143 CO 0.24 -0.81 0.26 0.71 -1.08 0.00 0.00 175.30 174.62 1orr s TYR 144 N -3.82 3.64 0.04 5.89 1.51 -0.60 0.54 117.35 124.55 1orr s TYR 144 Ca 0.11 0.69 0.07 0.00 -1.01 0.00 0.00 57.07 56.94 1orr s TYR 144 Cb -0.06 -2.07 -0.02 0.00 -0.11 0.00 0.00 41.96 39.70 1orr s TYR 144 CO 0.07 0.68 -0.21 0.95 -1.11 0.00 0.00 175.55 175.92 1orr s THR 145 N -1.11 1.70 -0.44 -0.71 -4.23 0.19 -4.74 115.64 106.30 1orr s THR 145 Ca 0.21 -1.20 -0.16 0.00 -1.18 0.00 0.00 61.69 59.37 1orr s THR 145 Cb -0.14 -1.47 0.05 0.00 1.34 0.00 0.00 72.50 72.28 1orr s THR 145 CO 0.10 0.23 0.37 0.00 -0.54 0.00 0.00 174.62 174.78 1orr h VAL 147 N 5.70 0.93 -0.01 0.00 2.07 -0.70 -2.93 116.25 121.31 1orr h VAL 147 Ca -0.28 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1orr h VAL 147 Cb 1.11 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1orr h VAL 147 CO 0.81 0.03 -0.03 -0.90 0.02 0.00 0.00 177.57 177.51 1orr n ASP 148 N -5.05 1.12 -3.02 0.57 5.75 -1.25 -4.08 116.55 110.58 1orr n ASP 148 Ca -0.02 -1.29 -0.17 0.00 -0.01 0.00 0.00 54.79 53.30 1orr n ASP 148 Cb 0.09 0.01 -0.02 0.00 -1.03 0.00 0.00 41.12 40.17 1orr n ASP 148 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1orr n LYS 149 N -0.19 1.33 0.32 0.11 4.76 -1.16 -4.95 118.16 118.38 1orr n LYS 149 Ca 0.19 -3.55 0.20 0.00 -2.87 0.00 0.00 58.31 52.28 1orr n LYS 149 Cb 0.31 -1.68 1.09 0.00 -1.84 0.00 0.00 35.03 32.90 1orr n LYS 149 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1orr h PRO 150 N 2.98 0.00 -0.48 1.97 0.13 -1.66 -2.32 132.00 132.61 1orr h PRO 150 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1orr h PRO 150 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1orr h PRO 150 CO 0.55 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.41 1orr n ASN 151 N -3.38 4.29 0.00 1.44 3.02 -1.26 -4.92 115.26 114.45 1orr n ASN 151 Ca -0.03 -2.57 0.00 0.00 -0.03 0.00 0.00 54.58 51.96 1orr n ASN 151 Cb 0.09 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.75 1orr n ASN 151 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1orr n GLY 152 N 0.52 -3.46 3.67 7.41 0.00 -0.88 -3.89 105.19 108.57 1orr n GLY 152 Ca 0.22 -2.12 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 1orr n GLY 152 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1orr s TYR 153 N -0.75 3.12 0.08 1.61 1.51 0.18 -4.57 117.35 118.53 1orr s TYR 153 Ca 0.00 0.16 0.01 0.00 -1.01 0.00 0.00 57.07 56.23 1orr s TYR 153 Cb 0.00 -1.76 0.01 0.00 -0.11 0.00 0.00 41.96 40.10 1orr s TYR 153 CO 0.00 0.45 0.08 -0.40 -1.11 0.00 0.00 175.55 174.57 1orr n ASP 154 N 2.04 0.88 0.02 2.29 5.68 -1.26 -1.31 116.55 124.88 1orr n ASP 154 Ca -0.18 -1.24 0.07 0.00 -0.50 0.00 0.00 54.79 52.94 1orr n ASP 154 Cb 0.53 -0.03 0.30 0.00 -1.14 0.00 0.00 41.12 40.79 1orr n ASP 154 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1orr n GLU 155 N -0.87 0.03 -0.02 0.11 4.71 -1.26 -2.48 120.64 120.86 1orr n GLU 155 Ca 0.01 0.31 0.13 0.00 -0.01 0.00 0.00 57.16 57.59 1orr n GLU 155 Cb 0.09 -1.56 0.58 0.00 -1.01 0.00 0.00 31.44 29.54 1orr n GLU 155 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1orr n SER 156 N -1.62 0.93 -4.77 1.62 3.41 -1.26 -4.85 113.62 107.09 1orr n SER 156 Ca 0.03 -1.44 -0.39 0.00 -0.26 0.00 0.00 58.87 56.82 1orr n SER 156 Cb 0.15 -0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.06 1orr n SER 156 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1orr s THR 157 N -1.94 2.92 0.29 6.66 2.01 -1.03 -4.93 115.64 119.61 1orr s THR 157 Ca 0.37 0.78 -0.30 0.00 0.31 0.00 0.00 61.69 62.85 1orr s THR 157 Cb 0.19 -3.44 -0.12 0.00 0.01 0.00 0.00 72.50 69.13 1orr s THR 157 CO 0.30 0.08 1.52 1.67 -0.69 0.00 0.00 174.62 177.50 1orr n GLN 158 N 0.00 2.49 -2.93 4.92 -0.06 -1.26 -4.97 117.38 115.57 1orr n GLN 158 Ca 0.05 0.88 -0.39 0.00 -2.00 0.00 0.00 57.00 55.54 1orr n GLN 158 Cb 0.46 -2.62 -0.06 0.00 -4.06 0.00 0.00 30.24 23.95 1orr n GLN 158 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1orr s LEU 159 N -0.43 4.55 -0.36 1.69 1.43 -1.26 -4.60 118.68 119.70 1orr s LEU 159 Ca 0.64 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 55.43 1orr s LEU 159 Cb -0.54 -3.47 0.19 0.00 0.03 0.00 0.00 46.19 42.40 1orr s LEU 159 CO 0.50 0.15 0.81 -0.62 0.23 0.00 0.00 176.35 177.42 1orr s ASP 160 N -1.27 -1.02 -0.15 2.29 2.15 -0.07 -4.99 116.67 113.61 1orr s ASP 160 Ca 0.39 -0.41 -0.29 0.00 0.43 0.00 0.00 52.55 52.67 1orr s ASP 160 Cb -0.22 1.36 -0.04 0.00 -0.30 0.00 0.00 42.92 43.72 1orr s ASP 160 CO 0.26 -0.13 1.68 -0.36 -0.17 0.00 0.00 175.17 176.46 1orr s PHE 161 N 2.06 1.97 -0.10 -5.34 2.99 -1.24 -0.65 117.98 117.68 1orr s PHE 161 Ca 0.16 0.38 0.01 0.00 0.00 0.00 0.00 56.93 57.48 1orr s PHE 161 Cb -0.02 -3.96 -0.02 0.00 0.00 0.00 0.00 43.02 39.02 1orr s PHE 161 CO -0.13 -3.44 -0.13 -1.01 -0.00 0.00 0.00 175.22 170.51 1orr s HIS 162 N 4.95 2.78 0.00 0.36 3.76 -1.23 -4.62 115.29 121.29 1orr s HIS 162 Ca 0.75 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 55.25 1orr s HIS 162 Cb -0.29 -1.76 0.00 0.00 1.11 0.00 0.00 32.58 31.64 1orr s HIS 162 CO 0.30 -0.02 0.00 -1.13 -0.85 0.00 0.00 174.74 173.04 1orr n SER 163 N 2.98 0.00 0.07 1.40 3.41 -1.26 -2.72 113.62 117.49 1orr n SER 163 Ca -0.18 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.47 1orr n SER 163 Cb 0.52 0.48 0.44 0.00 -0.26 0.00 0.00 64.21 65.40 1orr n SER 163 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1orr h PRO 164 N 0.00 0.37 -0.69 4.33 0.11 -1.91 0.38 132.00 134.59 1orr h PRO 164 Ca 0.00 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.05 1orr h PRO 164 Cb 0.00 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.00 1orr h PRO 164 CO 0.00 0.32 0.35 -0.92 -0.21 0.00 0.00 178.00 177.53 1orr h TYR 165 N 0.37 0.99 -0.70 0.65 3.20 -1.86 0.19 116.97 119.81 1orr h TYR 165 Ca 0.09 -0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.87 1orr h TYR 165 Cb 0.08 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.02 1orr h TYR 165 CO 0.00 0.73 0.22 0.78 -1.64 0.00 0.00 178.16 178.25 1orr h GLY 166 N 0.96 1.17 1.32 1.82 0.00 -0.71 -1.15 103.07 106.50 1orr h GLY 166 Ca 0.24 -0.69 -0.13 0.00 0.00 0.00 0.00 47.33 46.74 1orr h GLY 166 CO -0.03 0.65 -0.33 0.00 0.00 0.00 0.00 176.54 176.82 1orr h SER 168 N 0.63 0.38 -0.51 0.00 4.64 -0.46 -1.60 113.55 116.64 1orr h SER 168 Ca 0.07 -0.66 -0.07 0.00 -0.47 0.00 0.00 61.79 60.66 1orr h SER 168 Cb 0.87 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 1orr h SER 168 CO 0.08 0.98 0.06 0.11 -0.87 0.00 0.00 176.83 177.19 1orr h LYS 169 N -0.19 0.91 -0.45 4.77 1.79 -1.27 -1.86 116.57 120.26 1orr h LYS 169 Ca -0.02 -0.23 -0.03 0.00 -2.18 0.00 0.00 60.65 58.19 1orr h LYS 169 Cb 0.98 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.49 1orr h LYS 169 CO 0.07 0.86 0.18 0.78 -1.08 0.00 0.00 179.45 180.26 1orr h GLY 170 N 1.00 0.73 0.97 3.86 0.00 -0.94 0.14 103.07 108.83 1orr h GLY 170 Ca 0.17 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1orr h GLY 170 CO 0.01 0.37 0.24 0.00 0.00 0.00 0.00 176.54 177.16 1orr h ALA 171 N 1.03 0.58 -0.86 3.60 0.00 -1.17 -0.69 119.26 121.75 1orr h ALA 171 Ca 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1orr h ALA 171 Cb 0.19 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1orr h ALA 171 CO -0.01 0.11 0.42 0.00 0.00 0.00 0.00 179.25 179.77 1orr h ALA 172 N 1.09 1.12 -0.22 0.00 0.00 -1.12 -1.68 119.26 118.45 1orr h ALA 172 Ca 0.16 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1orr h ALA 172 Cb 0.07 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1orr h ALA 172 CO -0.02 0.67 0.06 0.22 0.00 0.00 0.00 179.25 180.18 1orr h ASP 173 N 1.22 0.05 -0.62 0.00 1.82 -0.27 0.56 116.42 119.19 1orr h ASP 173 Ca 0.30 0.03 -0.09 0.00 -0.39 0.00 0.00 57.03 56.88 1orr h ASP 173 Cb 0.11 0.03 -0.02 0.00 0.68 0.00 0.00 39.33 40.12 1orr h ASP 173 CO -0.04 0.06 0.05 1.56 -1.61 0.00 0.00 179.24 179.26 1orr h GLN 174 N 0.16 1.07 -0.58 0.28 1.08 -0.91 -2.40 115.11 113.81 1orr h GLN 174 Ca 0.10 -0.31 -0.03 0.00 -1.45 0.00 0.00 58.65 56.96 1orr h GLN 174 Cb 0.07 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.37 1orr h GLN 174 CO -0.11 1.01 0.24 1.88 -0.95 0.00 0.00 178.83 180.90 1orr h TYR 175 N 0.99 0.87 -0.81 2.96 -1.99 -1.09 -0.42 116.97 117.48 1orr h TYR 175 Ca 0.18 -0.06 0.04 0.00 2.00 0.00 0.00 58.73 60.89 1orr h TYR 175 Cb 0.50 -0.26 -0.05 0.00 2.00 0.00 0.00 36.73 38.91 1orr h TYR 175 CO 0.04 0.70 0.52 0.52 -0.00 0.00 0.00 178.16 179.93 1orr h MET 176 N 0.79 0.96 -0.35 4.88 2.86 -0.63 -0.66 114.93 122.78 1orr h MET 176 Ca 0.19 -0.06 -0.13 0.00 -2.06 0.00 0.00 59.70 57.65 1orr h MET 176 Cb 0.19 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1orr h MET 176 CO -0.02 0.64 -0.28 -0.07 1.06 0.00 0.00 176.91 178.23 1orr h LEU 177 N 0.99 0.85 -0.88 1.22 3.38 -1.11 -3.11 115.31 116.65 1orr h LEU 177 Ca 0.33 -0.45 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 1orr h LEU 177 Cb 0.04 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1orr h LEU 177 CO -0.13 1.12 -0.37 -0.78 0.09 0.00 0.00 178.44 178.38 1orr h ASP 178 N 0.59 0.39 0.40 -0.43 3.58 -0.88 -2.62 116.42 117.46 1orr h ASP 178 Ca 0.06 -0.16 -0.04 0.00 0.42 0.00 0.00 57.03 57.31 1orr h ASP 178 Cb 0.86 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.79 1orr h ASP 178 CO 0.07 0.73 -0.21 1.88 -2.88 0.00 0.00 179.24 178.83 1orr h TYR 179 N 0.32 0.00 -0.22 0.28 -1.99 -1.09 0.27 116.97 114.54 1orr h TYR 179 Ca 0.03 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.63 1orr h TYR 179 Cb 0.79 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.52 1orr h TYR 179 CO 0.02 0.21 -0.37 0.00 -0.00 0.00 0.00 178.16 178.02 1orr h ALA 180 N 1.79 0.34 0.06 3.88 0.00 -1.41 -2.04 119.26 121.87 1orr h ALA 180 Ca -0.00 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 1orr h ALA 180 Cb 0.47 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1orr h ALA 180 CO 0.03 0.42 -0.03 0.00 0.00 0.00 0.00 179.25 179.67 1orr h ARG 181 N 0.33 -0.07 0.06 0.00 3.08 -1.17 -1.96 114.38 114.64 1orr h ARG 181 Ca 0.01 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.93 1orr h ARG 181 Cb 0.97 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1orr h ARG 181 CO 0.08 0.24 -0.67 0.82 -1.07 0.00 0.00 179.97 179.37 1orr h ILE 182 N -0.39 1.45 -0.32 2.04 5.03 -0.60 -3.39 117.51 121.33 1orr h ILE 182 Ca -0.01 -2.39 0.00 0.00 -0.12 0.00 0.00 64.86 62.35 1orr h ILE 182 Cb 0.35 3.04 0.00 0.00 -3.03 0.00 0.00 36.82 37.18 1orr h ILE 182 CO 0.01 0.61 0.00 0.49 -0.68 0.00 0.00 178.15 178.58 1orr n PHE 183 N -4.32 0.41 -1.49 1.37 3.01 -0.86 -4.98 117.46 110.59 1orr n PHE 183 Ca -0.17 -0.27 -0.14 0.00 1.01 0.00 0.00 57.45 57.88 1orr n PHE 183 Cb 0.68 -0.01 -0.05 0.00 -0.01 0.00 0.00 39.48 40.09 1orr n PHE 183 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1orr n GLY 184 N 1.09 1.25 3.77 1.37 0.00 -0.74 -4.96 105.19 106.97 1orr n GLY 184 Ca 0.15 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.47 1orr n GLY 184 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1orr s LEU 185 N -3.19 3.19 -1.19 0.99 1.43 -0.83 -4.93 118.68 114.16 1orr s LEU 185 Ca 0.00 1.90 -0.10 0.00 -1.03 0.00 0.00 54.13 54.90 1orr s LEU 185 Cb 0.00 -4.53 0.22 0.00 0.03 0.00 0.00 46.19 41.90 1orr s LEU 185 CO 0.00 -1.87 1.46 0.59 0.23 0.00 0.00 176.35 176.76 1orr n ASN 186 N -3.05 5.44 -4.67 2.29 3.02 -1.26 -4.23 115.26 112.81 1orr n ASN 186 Ca 0.10 -3.08 -0.25 0.00 -0.03 0.00 0.00 54.58 51.31 1orr n ASN 186 Cb 0.53 -1.46 -0.07 0.00 -0.61 0.00 0.00 39.78 38.16 1orr n ASN 186 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1orr s THR 187 N -0.01 3.70 -0.01 3.41 -4.23 -1.26 -0.76 115.64 116.47 1orr s THR 187 Ca 0.38 -1.54 0.01 0.00 -1.18 0.00 0.00 61.69 59.36 1orr s THR 187 Cb -0.01 -2.89 0.01 0.00 1.34 0.00 0.00 72.50 70.94 1orr s THR 187 CO -0.00 -0.19 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.17 1orr s VAL 188 N -1.89 0.29 -0.11 2.29 1.01 -0.16 0.23 120.40 122.06 1orr s VAL 188 Ca 0.29 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.19 1orr s VAL 188 Cb -0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 36.38 36.00 1orr s VAL 188 CO 0.19 0.11 -0.18 -0.69 0.00 0.00 0.00 175.10 174.53 1orr s VAL 189 N 0.26 2.65 -0.23 2.92 1.01 -0.56 -0.72 120.40 125.72 1orr s VAL 189 Ca -0.02 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.11 1orr s VAL 189 Cb -0.05 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1orr s VAL 189 CO -0.01 0.55 -0.05 -0.36 0.00 0.00 0.00 175.10 175.23 1orr s PHE 190 N 0.21 3.00 -0.62 5.22 2.99 -0.34 -0.70 117.98 127.74 1orr s PHE 190 Ca -0.11 -1.19 -0.20 0.00 0.00 0.00 0.00 56.93 55.42 1orr s PHE 190 Cb -0.16 -2.09 0.09 0.00 0.00 0.00 0.00 43.02 40.86 1orr s PHE 190 CO 0.06 -0.63 0.82 1.03 -0.00 0.00 0.00 175.22 176.50 1orr s ARG 191 N 1.42 3.07 0.13 0.44 0.52 0.76 0.14 118.95 125.42 1orr s ARG 191 Ca 0.04 -1.10 -0.13 0.00 -0.52 0.00 0.00 55.73 54.01 1orr s ARG 191 Cb -0.15 -4.25 -0.07 0.00 0.52 0.00 0.00 34.95 31.00 1orr s ARG 191 CO -0.04 -1.66 0.51 -1.01 0.02 0.00 0.00 175.30 173.13 1orr s HIS 192 N 3.29 3.61 0.54 -0.53 3.76 -1.06 -0.68 115.29 124.21 1orr s HIS 192 Ca 0.16 1.00 0.09 0.00 -0.15 0.00 0.00 55.06 56.16 1orr s HIS 192 Cb -0.21 -2.32 0.09 0.00 1.11 0.00 0.00 32.58 31.25 1orr s HIS 192 CO 0.08 0.45 0.74 0.45 -0.85 0.00 0.00 174.74 175.62 1orr n SER 193 N 0.85 1.95 -4.59 1.40 2.88 -0.57 -1.12 113.62 114.43 1orr n SER 193 Ca -0.06 -2.42 -0.51 0.00 -1.33 0.00 0.00 58.87 54.54 1orr n SER 193 Cb 0.52 -0.39 -0.06 0.00 -0.75 0.00 0.00 64.21 63.53 1orr n SER 193 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1orr n SER 194 N -2.38 1.65 -4.31 -3.46 7.64 -1.25 -4.85 113.62 106.66 1orr n SER 194 Ca 0.15 1.12 -0.25 0.00 1.01 0.00 0.00 58.87 60.90 1orr n SER 194 Cb 0.56 -1.20 -0.13 0.00 -1.01 0.00 0.00 64.21 62.42 1orr n SER 194 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1orr s MET 195 N 0.35 1.21 0.14 1.43 -1.94 -1.26 -0.15 119.30 119.09 1orr s MET 195 Ca 0.82 -1.19 -0.18 0.00 -1.71 0.00 0.00 55.69 53.43 1orr s MET 195 Cb -0.93 -1.52 0.04 0.00 2.01 0.00 0.00 34.83 34.44 1orr s MET 195 CO 0.47 0.36 0.47 1.52 -0.01 0.00 0.00 175.02 177.83 1orr s TYR 196 N -1.11 -0.30 -5.00 -0.03 -0.85 -0.67 -4.88 117.35 104.52 1orr s TYR 196 Ca 0.08 0.01 0.00 0.00 -0.52 0.00 0.00 57.07 56.64 1orr s TYR 196 Cb -0.10 0.36 0.00 0.00 0.38 0.00 0.00 41.96 42.60 1orr s TYR 196 CO 0.04 -0.76 0.00 0.41 -1.52 0.00 0.00 175.55 173.72 1orr n GLY 197 N -0.28 -1.65 3.73 5.49 0.00 -1.26 -0.81 105.19 110.41 1orr n GLY 197 Ca -0.16 -1.45 -0.36 0.00 0.00 0.00 0.00 46.02 44.05 1orr n GLY 197 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1orr s GLY 198 N 0.00 2.60 0.00 -0.02 0.00 -1.26 -2.97 107.32 105.68 1orr s GLY 198 Ca 0.00 1.04 0.00 0.00 0.00 0.00 0.00 44.72 45.76 1orr s GLY 198 CO 0.00 1.45 0.00 0.54 0.00 0.00 0.00 173.10 175.09 1orr n ARG 199 N -2.26 0.00 -3.57 2.90 5.12 -1.26 -4.90 116.66 112.68 1orr n ARG 199 Ca 0.14 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.68 1orr n ARG 199 Cb 0.49 -2.58 -0.11 0.00 -1.16 0.00 0.00 32.46 29.10 1orr n ARG 199 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1orr s GLN 200 N -0.09 3.82 -0.90 5.56 0.74 -1.16 -4.15 119.66 123.48 1orr s GLN 200 Ca 0.00 -0.41 -0.08 0.00 0.05 0.00 0.00 55.36 54.92 1orr s GLN 200 Cb 0.00 -3.70 0.23 0.00 1.10 0.00 0.00 33.01 30.64 1orr s GLN 200 CO 0.00 -0.26 0.82 -0.06 -0.55 0.00 0.00 175.29 175.25 1orr s PHE 201 N 1.75 3.89 0.73 1.67 0.40 -1.26 -4.98 117.98 120.18 1orr s PHE 201 Ca 0.07 -2.59 -0.14 0.00 -0.60 0.00 0.00 56.93 53.67 1orr s PHE 201 Cb -0.16 -3.58 0.04 0.00 0.51 0.00 0.00 43.02 39.82 1orr s PHE 201 CO 0.11 -0.89 1.16 0.00 0.70 0.00 0.00 175.22 176.30 1orr s ALA 202 N -0.69 2.19 0.19 5.36 0.00 -1.26 -4.94 121.76 122.60 1orr s ALA 202 Ca 0.24 0.69 -0.00 0.00 0.00 0.00 0.00 51.96 52.88 1orr s ALA 202 Cb -0.11 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 1orr s ALA 202 CO -0.09 -1.75 0.08 0.95 0.00 0.00 0.00 175.76 174.96 1orr s THR 203 N -2.25 0.26 0.27 0.00 -4.23 -0.27 -4.86 115.64 104.57 1orr s THR 203 Ca 0.70 -1.97 -0.02 0.00 -1.18 0.00 0.00 61.69 59.22 1orr s THR 203 Cb -0.24 -2.32 0.32 0.00 1.34 0.00 0.00 72.50 71.59 1orr s THR 203 CO 0.46 -0.22 1.62 0.22 -0.54 0.00 0.00 174.62 176.16 1orr h TYR 204 N 2.66 0.05 -0.65 3.99 3.20 -1.97 -1.71 116.97 122.54 1orr h TYR 204 Ca -0.36 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.57 1orr h TYR 204 Cb 1.23 0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.61 1orr h TYR 204 CO 0.43 -0.28 0.00 -0.40 -1.64 0.00 0.00 178.16 176.27 1orr n ASP 205 N -5.35 4.48 -3.62 -2.11 3.85 -1.26 -4.90 116.55 107.64 1orr n ASP 205 Ca 0.18 -2.34 -0.01 0.00 -0.71 0.00 0.00 54.79 51.91 1orr n ASP 205 Cb 0.60 -0.54 -0.04 0.00 -1.35 0.00 0.00 41.12 39.78 1orr n ASP 205 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.20 174.61 1orr s GLN 206 N -1.63 0.56 0.00 0.11 0.74 -0.64 -4.52 119.66 114.27 1orr s GLN 206 Ca 0.49 1.34 0.00 0.00 0.05 0.00 0.00 55.36 57.24 1orr s GLN 206 Cb 0.30 0.74 0.00 0.00 1.10 0.00 0.00 33.01 35.15 1orr s GLN 206 CO 0.26 -0.18 0.00 0.41 -0.55 0.00 0.00 175.29 175.23 1orr n GLY 207 N 5.25 0.53 0.31 2.59 0.00 -1.26 -1.11 105.19 111.50 1orr n GLY 207 Ca -0.13 -0.59 -0.05 0.00 0.00 0.00 0.00 46.02 45.26 1orr n GLY 207 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1orr h TRP 208 N 0.00 1.03 -0.11 1.61 5.08 -1.91 0.16 115.95 121.82 1orr h TRP 208 Ca 0.00 -0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.96 1orr h TRP 208 Cb 0.30 -0.34 -0.00 0.00 -3.00 0.00 0.00 29.16 26.12 1orr h TRP 208 CO 0.00 0.69 0.05 0.28 -1.28 0.00 0.00 178.44 178.18 1orr h VAL 209 N 1.08 1.14 -0.94 0.12 2.07 -1.95 -1.51 116.25 116.26 1orr h VAL 209 Ca 0.28 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1orr h VAL 209 Cb -0.05 1.22 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 1orr h VAL 209 CO -0.05 0.13 0.56 1.23 0.02 0.00 0.00 177.57 179.45 1orr h GLY 210 N 0.02 1.37 0.91 2.17 0.00 -1.87 -0.75 103.07 104.93 1orr h GLY 210 Ca 0.04 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 1orr h GLY 210 CO -0.00 0.56 0.10 -0.25 0.00 0.00 0.00 176.54 176.95 1orr h TRP 211 N 1.30 0.32 -0.13 5.60 2.91 -0.42 -1.79 115.95 123.74 1orr h TRP 211 Ca 0.34 -0.02 -0.06 0.00 1.13 0.00 0.00 58.89 60.28 1orr h TRP 211 Cb -0.04 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 28.50 1orr h TRP 211 CO 0.01 0.33 -0.17 0.74 -1.03 0.00 0.00 178.44 178.31 1orr h PHE 212 N 0.21 0.22 -0.27 2.65 -1.00 -0.97 -0.16 116.94 117.61 1orr h PHE 212 Ca 0.07 -0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.76 1orr h PHE 212 Cb 0.14 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.62 1orr h PHE 212 CO -0.02 0.38 -0.10 0.00 -1.61 0.00 0.00 178.31 176.96 1orr h GLN 214 N 0.42 0.49 -0.62 0.00 5.75 -0.44 -1.50 115.11 119.21 1orr h GLN 214 Ca 0.08 -0.30 -0.04 0.00 -0.15 0.00 0.00 58.65 58.24 1orr h GLN 214 Cb 0.43 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.98 1orr h GLN 214 CO 0.02 0.89 0.21 0.87 -2.65 0.00 0.00 178.83 178.17 1orr h LYS 215 N 0.38 0.92 -0.40 1.69 1.79 -0.32 -1.81 116.57 118.83 1orr h LYS 215 Ca 0.01 -0.17 -0.06 0.00 -2.18 0.00 0.00 60.65 58.25 1orr h LYS 215 Cb 1.04 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.53 1orr h LYS 215 CO 0.09 0.78 0.00 0.00 -1.08 0.00 0.00 179.45 179.25 1orr h ALA 216 N 1.33 0.54 -0.74 3.86 0.00 -0.95 -1.78 119.26 121.51 1orr h ALA 216 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1orr h ALA 216 Cb 0.24 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1orr h ALA 216 CO -0.01 0.31 0.47 0.28 0.00 0.00 0.00 179.25 180.30 1orr h VAL 217 N 0.53 1.20 0.02 0.00 2.07 -1.02 0.24 116.25 119.30 1orr h VAL 217 Ca 0.11 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 1orr h VAL 217 Cb 0.47 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1orr h VAL 217 CO 0.02 0.20 -0.01 -0.33 0.02 0.00 0.00 177.57 177.47 1orr h GLU 218 N 1.01 -0.03 -0.78 1.57 5.08 -1.18 -1.74 114.58 118.51 1orr h GLU 218 Ca 0.27 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.65 1orr h GLU 218 Cb -0.08 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.14 1orr h GLU 218 CO -0.05 0.02 0.51 0.82 -1.00 0.00 0.00 179.01 179.30 1orr h ILE 219 N -0.06 1.15 -0.13 3.13 2.04 -1.05 0.15 117.51 122.74 1orr h ILE 219 Ca -0.00 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 1orr h ILE 219 Cb 0.06 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.19 1orr h ILE 219 CO 0.00 0.18 0.04 0.50 0.00 0.00 0.00 178.15 178.88 1orr h LYS 220 N 1.01 0.17 -0.43 2.37 1.63 -0.58 -1.30 116.57 119.44 1orr h LYS 220 Ca 0.30 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.09 1orr h LYS 220 Cb -0.05 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.55 1orr h LYS 220 CO -0.09 0.16 0.00 0.09 -3.45 0.00 0.00 179.45 176.16 1orr n ASN 221 N -4.47 2.99 -0.72 4.20 3.02 -0.69 -4.93 115.26 114.65 1orr n ASN 221 Ca -0.01 -1.94 -0.05 0.00 -0.03 0.00 0.00 54.58 52.54 1orr n ASN 221 Cb 0.11 -0.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 1orr n ASN 221 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1orr n GLY 222 N 1.41 0.23 3.62 7.41 0.00 -0.49 -5.01 105.19 112.36 1orr n GLY 222 Ca 0.19 -0.63 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 1orr n GLY 222 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1orr s ILE 223 N -2.41 5.15 -0.66 -0.61 1.09 0.45 -5.01 121.20 119.21 1orr s ILE 223 Ca 0.03 0.67 -0.20 0.00 -1.10 0.00 0.00 60.65 60.05 1orr s ILE 223 Cb -0.01 -3.74 0.10 0.00 -1.06 0.00 0.00 42.46 37.76 1orr s ILE 223 CO 0.03 0.15 0.82 0.21 -0.10 0.00 0.00 174.94 176.05 1orr s ASN 224 N 1.54 6.25 -0.39 3.58 2.47 -1.26 -4.23 114.94 122.90 1orr s ASN 224 Ca 0.17 -1.45 0.11 0.00 0.42 0.00 0.00 52.86 52.11 1orr s ASN 224 Cb -0.16 -2.34 0.35 0.00 -1.45 0.00 0.00 41.25 37.66 1orr s ASN 224 CO 0.09 -1.16 0.85 0.29 -3.72 0.00 0.00 177.10 173.44 1orr n LYS 225 N 6.58 1.00 -1.53 0.43 5.02 -1.26 -5.13 118.16 123.27 1orr n LYS 225 Ca -0.04 -3.01 -0.54 0.00 -2.02 0.00 0.00 58.31 52.70 1orr n LYS 225 Cb 0.44 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.90 1orr n LYS 225 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1orr n PRO 226 N 0.26 0.54 -4.20 1.97 -0.02 -1.26 -4.97 135.00 127.31 1orr n PRO 226 Ca 0.19 0.19 -0.26 0.00 -2.02 0.00 0.00 63.50 61.61 1orr n PRO 226 Cb 0.68 -1.69 -0.07 0.00 -0.02 0.00 0.00 33.50 32.40 1orr n PRO 226 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1orr s PHE 227 N 0.03 2.48 0.31 6.00 -0.12 -1.26 -5.04 117.98 120.38 1orr s PHE 227 Ca 0.84 -0.64 0.06 0.00 -0.05 0.00 0.00 56.93 57.14 1orr s PHE 227 Cb -1.08 -1.92 -0.06 0.00 -0.63 0.00 0.00 43.02 39.33 1orr s PHE 227 CO 0.53 0.17 -0.02 0.95 -0.05 0.00 0.00 175.22 176.80 1orr s THR 228 N -2.64 1.56 0.05 -4.49 -4.23 -1.26 -1.16 115.64 103.47 1orr s THR 228 Ca 0.38 -2.08 0.04 0.00 -1.18 0.00 0.00 61.69 58.85 1orr s THR 228 Cb 0.04 -2.61 -0.02 0.00 1.34 0.00 0.00 72.50 71.24 1orr s THR 228 CO 0.21 -0.18 -0.11 0.27 -0.54 0.00 0.00 174.62 174.26 1orr s ILE 229 N -3.05 0.86 -0.38 2.99 -4.36 -0.78 -4.90 121.20 111.59 1orr s ILE 229 Ca 0.32 -1.05 -0.18 0.00 -0.26 0.00 0.00 60.65 59.48 1orr s ILE 229 Cb 0.06 -0.84 0.01 0.00 1.25 0.00 0.00 42.46 42.93 1orr s ILE 229 CO 0.14 -0.18 0.49 -0.44 0.24 0.00 0.00 174.94 175.18 1orr s SER 230 N -1.38 6.27 0.00 4.36 0.01 -1.26 0.34 113.70 122.03 1orr s SER 230 Ca -0.03 -0.26 0.00 0.00 1.31 0.00 0.00 55.95 56.97 1orr s SER 230 Cb -0.09 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.89 1orr s SER 230 CO 0.01 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 173.74 1orr n GLY 231 N 4.93 -1.80 0.34 3.44 0.00 -0.03 -4.43 105.19 107.65 1orr n GLY 231 Ca -0.06 -1.95 0.14 0.00 0.00 0.00 0.00 46.02 44.15 1orr n GLY 231 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1orr n ASN 232 N 0.05 1.18 0.00 1.61 0.23 -1.26 -4.44 115.26 112.63 1orr n ASN 232 Ca 0.00 -1.17 0.00 0.00 -0.53 0.00 0.00 54.58 52.88 1orr n ASN 232 Cb 0.00 0.05 0.00 0.00 -2.08 0.00 0.00 39.78 37.75 1orr n ASN 232 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1orr n GLY 233 N 1.24 0.88 0.00 4.83 0.00 -1.26 -4.90 105.19 105.98 1orr n GLY 233 Ca 0.16 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.32 1orr n GLY 233 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1orr n LYS 234 N -2.18 0.00 -1.78 1.61 5.02 -1.26 -1.29 118.16 118.28 1orr n LYS 234 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.88 1orr n LYS 234 Cb 0.00 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 33.51 1orr n LYS 234 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1orr n GLN 235 N -1.51 2.68 -4.52 1.97 0.00 -1.26 -1.56 117.38 113.18 1orr n GLN 235 Ca 0.07 0.94 -0.29 0.00 0.00 0.00 0.00 57.00 57.71 1orr n GLN 235 Cb 0.34 -2.67 -0.13 0.00 0.00 0.00 0.00 30.24 27.77 1orr n GLN 235 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1orr s VAL 236 N -1.09 2.35 -0.04 -0.39 1.01 0.44 -2.94 120.40 119.73 1orr s VAL 236 Ca 0.53 -1.59 -0.05 0.00 0.00 0.00 0.00 61.98 60.87 1orr s VAL 236 Cb -0.48 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 33.90 1orr s VAL 236 CO 0.64 0.18 0.14 -0.13 0.00 0.00 0.00 175.10 175.92 1orr s ARG 237 N -1.83 0.25 0.30 2.72 1.81 -0.75 -0.91 118.95 120.54 1orr s ARG 237 Ca 0.14 0.03 -0.22 0.00 -1.72 0.00 0.00 55.73 53.96 1orr s ARG 237 Cb -0.10 0.11 -0.09 0.00 -0.45 0.00 0.00 34.95 34.42 1orr s ARG 237 CO 0.06 -0.04 0.86 0.16 -0.68 0.00 0.00 175.30 175.65 1orr s ASP 238 N -0.33 7.15 -0.05 0.23 -4.77 -0.92 -1.06 116.67 116.93 1orr s ASP 238 Ca -0.04 1.63 0.05 0.00 -3.30 0.00 0.00 52.55 50.89 1orr s ASP 238 Cb -0.03 -2.50 -0.02 0.00 -1.09 0.00 0.00 42.92 39.27 1orr s ASP 238 CO 0.00 -0.08 -0.18 0.68 0.70 0.00 0.00 175.17 176.29 1orr s VAL 239 N -1.68 2.72 -0.15 2.11 -7.23 -0.52 -3.79 120.40 111.86 1orr s VAL 239 Ca 0.50 -0.85 0.01 0.00 -1.81 0.00 0.00 61.98 59.83 1orr s VAL 239 Cb -0.16 -2.04 0.01 0.00 0.56 0.00 0.00 36.38 34.75 1orr s VAL 239 CO 0.21 0.58 -0.19 -0.22 -0.31 0.00 0.00 175.10 175.17 1orr s LEU 240 N -0.56 2.25 0.44 1.32 2.96 0.79 -3.87 118.68 122.00 1orr s LEU 240 Ca 0.08 -0.56 -0.23 0.00 -0.22 0.00 0.00 54.13 53.19 1orr s LEU 240 Cb -0.11 -1.49 -0.08 0.00 0.50 0.00 0.00 46.19 45.01 1orr s LEU 240 CO 0.01 0.07 1.12 -2.28 -1.32 0.00 0.00 176.35 173.95 1orr s HIS 241 N 0.89 3.02 0.36 5.38 5.65 -1.26 -1.67 115.29 127.65 1orr s HIS 241 Ca -0.05 1.57 0.11 0.00 0.25 0.00 0.00 55.06 56.95 1orr s HIS 241 Cb -0.15 -3.29 0.90 0.00 -1.18 0.00 0.00 32.58 28.86 1orr s HIS 241 CO -0.03 -1.18 1.81 0.00 -0.65 0.00 0.00 174.74 174.69 1orr h ALA 242 N 2.21 1.93 -0.79 1.58 0.00 -1.36 -1.45 119.26 121.38 1orr h ALA 242 Ca -0.49 0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.55 1orr h ALA 242 Cb 1.23 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.92 1orr h ALA 242 CO 0.61 -0.27 0.52 0.93 0.00 0.00 0.00 179.25 181.04 1orr h GLU 243 N 0.60 0.76 0.00 0.00 5.08 -1.92 -0.78 114.58 118.32 1orr h GLU 243 Ca 0.54 -0.05 -0.18 0.00 -1.00 0.00 0.00 59.36 58.67 1orr h GLU 243 Cb 1.05 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1orr h GLU 243 CO -0.29 0.50 -0.84 -0.44 -1.00 0.00 0.00 179.01 176.94 1orr h ASP 244 N 0.78 0.12 -0.39 1.42 3.32 -1.66 -2.88 116.42 117.13 1orr h ASP 244 Ca 0.35 -0.10 -0.10 0.00 0.02 0.00 0.00 57.03 57.21 1orr h ASP 244 Cb 0.35 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1orr h ASP 244 CO -0.13 0.90 -0.11 -0.03 -1.72 0.00 0.00 179.24 178.15 1orr h MET 245 N 0.05 0.84 -0.19 3.56 4.05 -0.81 -2.10 114.93 120.34 1orr h MET 245 Ca -0.02 -0.29 -0.01 0.00 -0.28 0.00 0.00 59.70 59.09 1orr h MET 245 Cb 1.46 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 32.19 1orr h MET 245 CO 0.12 0.92 0.06 0.82 0.23 0.00 0.00 176.91 179.06 1orr h ILE 246 N 0.76 1.18 -0.43 1.77 2.04 -1.12 -2.03 117.51 119.67 1orr h ILE 246 Ca 0.12 -0.57 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 1orr h ILE 246 Cb 0.62 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 1orr h ILE 246 CO 0.04 0.18 0.16 0.77 0.00 0.00 0.00 178.15 179.30 1orr h SER 247 N 0.14 0.56 0.09 1.72 4.64 -1.39 -2.55 113.55 116.76 1orr h SER 247 Ca 0.06 -0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1orr h SER 247 Cb 0.22 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1orr h SER 247 CO -0.00 0.53 -0.04 0.25 -0.87 0.00 0.00 176.83 176.69 1orr h LEU 248 N 0.62 -0.10 0.03 5.97 5.85 -1.10 0.12 115.31 126.69 1orr h LEU 248 Ca 0.15 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1orr h LEU 248 Cb 0.15 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1orr h LEU 248 CO -0.01 0.09 -0.08 1.88 -0.34 0.00 0.00 178.44 179.97 1orr h TYR 249 N -0.29 -0.21 -0.37 1.25 -1.99 -1.23 0.22 116.97 114.35 1orr h TYR 249 Ca -0.01 0.01 -0.13 0.00 2.00 0.00 0.00 58.73 60.59 1orr h TYR 249 Cb 0.24 0.09 -0.01 0.00 2.00 0.00 0.00 36.73 39.05 1orr h TYR 249 CO -0.02 -0.13 -0.30 0.74 -0.00 0.00 0.00 178.16 178.46 1orr h PHE 250 N -0.16 0.93 -0.48 4.88 -1.00 -1.50 -0.83 116.94 118.78 1orr h PHE 250 Ca 0.02 -0.24 -0.08 0.00 2.81 0.00 0.00 57.97 60.49 1orr h PHE 250 Cb 0.19 -0.21 -0.02 0.00 3.61 0.00 0.00 35.95 39.52 1orr h PHE 250 CO -0.14 1.00 -0.01 1.15 -1.61 0.00 0.00 178.31 178.70 1orr h THR 251 N 0.68 1.26 -0.33 -1.55 2.02 -0.54 -1.86 112.91 112.59 1orr h THR 251 Ca 0.08 -1.07 0.01 0.00 0.77 0.00 0.00 66.41 66.19 1orr h THR 251 Cb 0.83 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 1orr h THR 251 CO 0.07 0.37 0.21 0.00 0.37 0.00 0.00 175.52 176.55 1orr h ALA 252 N 0.92 0.42 -0.41 6.16 0.00 -0.44 -2.62 119.26 123.30 1orr h ALA 252 Ca 0.13 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1orr h ALA 252 Cb 0.52 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 1orr h ALA 252 CO 0.03 -0.13 0.03 1.25 0.00 0.00 0.00 179.25 180.42 1orr h LEU 253 N 0.43 -0.11 -2.87 0.00 5.85 -1.01 0.20 115.31 117.81 1orr h LEU 253 Ca 0.12 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1orr h LEU 253 Cb -0.03 0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1orr h LEU 253 CO -0.04 -0.02 0.03 0.00 -0.34 0.00 0.00 178.44 178.07 1orr h ALA 254 N 1.34 1.03 -0.03 1.25 0.00 -0.97 -2.11 119.26 119.77 1orr h ALA 254 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1orr h ALA 254 Cb 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1orr h ALA 254 CO -0.31 -0.03 -0.10 0.09 0.00 0.00 0.00 179.25 178.90 1orr n ASN 255 N -3.04 2.34 -0.26 0.00 3.02 -0.07 -4.83 115.26 112.43 1orr n ASN 255 Ca -0.03 -3.27 0.17 0.00 -0.03 0.00 0.00 54.58 51.42 1orr n ASN 255 Cb 0.10 -0.46 0.46 0.00 -0.61 0.00 0.00 39.78 39.26 1orr n ASN 255 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1orr h VAL 256 N 0.36 0.72 -0.23 2.41 3.04 -0.49 -0.11 116.25 121.95 1orr h VAL 256 Ca 0.01 -0.18 0.02 0.00 -1.01 0.00 0.00 66.70 65.54 1orr h VAL 256 Cb 1.05 0.16 -0.01 0.00 -2.01 0.00 0.00 31.29 30.48 1orr h VAL 256 CO 0.03 0.09 0.15 0.77 -1.01 0.00 0.00 177.57 177.61 1orr h SER 257 N 0.51 0.19 0.88 3.17 4.64 -1.88 0.21 113.55 121.27 1orr h SER 257 Ca 0.48 -0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.67 1orr h SER 257 Cb 1.03 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 63.05 1orr h SER 257 CO -0.21 0.14 -1.20 0.50 -0.87 0.00 0.00 176.83 175.19 1orr h LYS 258 N 0.23 0.00 -0.01 4.77 3.64 -1.42 -3.38 116.57 120.40 1orr h LYS 258 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1orr h LYS 258 Cb 0.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1orr h LYS 258 CO -0.02 0.24 -0.34 0.44 -2.27 0.00 0.00 179.45 177.50 1orr n ILE 259 N -2.88 0.00 -1.55 2.00 -5.35 -0.95 -5.02 119.36 105.61 1orr n ILE 259 Ca -0.06 -0.33 -0.43 0.00 -0.27 0.00 0.00 62.75 61.66 1orr n ILE 259 Cb 0.76 1.19 -0.00 0.00 -1.74 0.00 0.00 39.64 39.84 1orr n ILE 259 CO 0.00 0.00 0.00 -2.11 -1.76 0.00 0.00 176.55 172.68 1orr n ARG 260 N -0.14 1.05 -0.94 6.28 1.85 0.02 -2.37 116.66 122.42 1orr n ARG 260 Ca 0.07 0.37 0.00 0.00 -1.00 0.00 0.00 57.85 57.29 1orr n ARG 260 Cb 0.34 -1.74 0.00 0.00 -1.05 0.00 0.00 32.46 30.01 1orr n ARG 260 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1orr n GLY 261 N 1.41 0.69 3.53 2.89 0.00 0.13 -4.96 105.19 108.89 1orr n GLY 261 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 1orr n GLY 261 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1orr s ASN 262 N -2.36 4.02 0.02 1.61 0.01 -1.00 -4.91 114.94 112.34 1orr s ASN 262 Ca 0.00 -0.64 0.02 0.00 -0.71 0.00 0.00 52.86 51.52 1orr s ASN 262 Cb 0.00 -0.59 -0.04 0.00 0.41 0.00 0.00 41.25 41.03 1orr s ASN 262 CO 0.00 0.12 0.03 0.00 -1.51 0.00 0.00 177.10 175.74 1orr s ALA 263 N -1.64 3.40 -0.02 0.60 0.00 -1.26 -1.49 121.76 121.35 1orr s ALA 263 Ca 0.23 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.24 1orr s ALA 263 Cb -0.09 -1.40 0.02 0.00 0.00 0.00 0.00 23.12 21.65 1orr s ALA 263 CO 0.13 0.68 -0.01 -0.06 0.00 0.00 0.00 175.76 176.50 1orr s PHE 264 N -1.18 0.34 0.05 0.00 0.40 0.12 -4.95 117.98 112.76 1orr s PHE 264 Ca 0.22 -0.03 -0.30 0.00 -0.60 0.00 0.00 56.93 56.22 1orr s PHE 264 Cb -0.12 -0.35 -0.05 0.00 0.51 0.00 0.00 43.02 43.01 1orr s PHE 264 CO 0.14 -0.09 1.07 -0.80 0.70 0.00 0.00 175.22 176.24 1orr s ASN 265 N 0.63 7.27 -0.06 1.36 -0.87 -1.26 -0.17 114.94 121.83 1orr s ASN 265 Ca -0.06 1.85 0.04 0.00 -1.57 0.00 0.00 52.86 53.11 1orr s ASN 265 Cb -0.10 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.56 1orr s ASN 265 CO -0.01 -0.31 -0.18 -0.63 -2.57 0.00 0.00 177.10 173.40 1orr s ILE 266 N 0.79 1.53 0.13 0.60 -1.09 0.14 -4.58 121.20 118.73 1orr s ILE 266 Ca 0.54 -0.74 -0.25 0.00 -2.23 0.00 0.00 60.65 57.97 1orr s ILE 266 Cb -0.25 -1.34 0.08 0.00 -1.58 0.00 0.00 42.46 39.37 1orr s ILE 266 CO 0.29 0.44 1.08 -0.83 -1.23 0.00 0.00 174.94 174.70 1orr s GLY 267 N 0.29 -0.07 0.00 6.18 0.00 -1.26 -1.51 107.32 110.95 1orr s GLY 267 Ca -0.11 -0.04 0.21 0.00 0.00 0.00 0.00 44.72 44.78 1orr s GLY 267 CO 0.04 1.89 1.68 0.61 0.00 0.00 0.00 173.10 177.33 1orr n GLY 268 N -0.64 -1.21 0.00 0.20 0.00 -1.25 -4.85 105.19 97.45 1orr n GLY 268 Ca -0.04 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1orr n GLY 268 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1orr n THR 269 N -1.48 0.00 -0.32 2.61 -2.24 -1.26 -4.01 114.28 107.58 1orr n THR 269 Ca 0.06 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 61.99 1orr n THR 269 Cb 0.24 0.00 0.35 0.00 -2.10 0.00 0.00 70.33 68.82 1orr n THR 269 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1orr h ILE 270 N 0.00 0.49 0.00 2.28 6.09 -1.81 -0.04 117.51 124.51 1orr h ILE 270 Ca 0.00 -0.16 -0.00 0.00 -1.37 0.00 0.00 64.86 63.33 1orr h ILE 270 Cb 0.00 -0.02 -0.00 0.00 0.47 0.00 0.00 36.82 37.27 1orr h ILE 270 CO 0.00 0.09 -0.02 1.62 -3.07 0.00 0.00 178.15 176.77 1orr h VAL 271 N 0.47 0.31 -0.47 2.19 3.04 -1.98 -1.69 116.25 118.12 1orr h VAL 271 Ca 0.60 -0.11 -0.23 0.00 -1.01 0.00 0.00 66.70 65.95 1orr h VAL 271 Cb 1.16 1.08 -0.14 0.00 -2.01 0.00 0.00 31.29 31.39 1orr h VAL 271 CO -0.51 0.02 0.06 0.59 -1.01 0.00 0.00 177.57 176.72 1orr n ASN 272 N -3.49 2.83 -4.88 3.17 3.02 -0.04 -4.79 115.26 111.07 1orr n ASN 272 Ca -0.03 -3.70 -0.31 0.00 -0.03 0.00 0.00 54.58 50.52 1orr n ASN 272 Cb 0.11 -0.67 -0.05 0.00 -0.61 0.00 0.00 39.78 38.57 1orr n ASN 272 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1orr s SER 273 N -2.25 6.56 -0.06 6.41 1.04 -0.64 -1.43 113.70 123.33 1orr s SER 273 Ca 0.47 0.86 -0.10 0.00 0.48 0.00 0.00 55.95 57.67 1orr s SER 273 Cb 0.42 -2.20 0.02 0.00 0.10 0.00 0.00 66.02 64.35 1orr s SER 273 CO 0.02 -0.13 0.24 -0.76 0.98 0.00 0.00 173.24 173.60 1orr s LEU 274 N -3.10 1.11 0.55 2.42 1.43 -0.23 -4.95 118.68 115.92 1orr s LEU 274 Ca 0.46 0.28 -0.00 0.00 -1.03 0.00 0.00 54.13 53.85 1orr s LEU 274 Cb -0.11 0.90 0.03 0.00 0.03 0.00 0.00 46.19 47.03 1orr s LEU 274 CO 0.25 -0.21 0.78 -0.94 0.23 0.00 0.00 176.35 176.46 1orr s SER 275 N -0.44 5.36 0.20 2.29 1.04 -1.26 -1.80 113.70 119.10 1orr s SER 275 Ca -0.05 0.13 -0.08 0.00 0.48 0.00 0.00 55.95 56.42 1orr s SER 275 Cb -0.04 -1.07 0.14 0.00 0.10 0.00 0.00 66.02 65.15 1orr s SER 275 CO 0.01 -1.09 1.75 -0.07 0.98 0.00 0.00 173.24 174.82 1orr h LEU 276 N 0.06 1.08 -1.02 2.42 3.38 -1.07 -0.66 115.31 119.49 1orr h LEU 276 Ca -0.43 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.36 1orr h LEU 276 Cb 1.29 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.70 1orr h LEU 276 CO 0.54 0.99 0.66 -0.07 0.09 0.00 0.00 178.44 180.65 1orr h LEU 277 N 1.11 1.12 -0.83 1.67 3.38 -1.63 0.49 115.31 120.62 1orr h LEU 277 Ca 0.25 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 58.08 1orr h LEU 277 Cb 0.28 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1orr h LEU 277 CO -0.01 0.79 -0.33 -0.33 0.09 0.00 0.00 178.44 178.65 1orr h GLU 278 N 1.31 0.48 -0.34 1.13 5.08 -1.65 -2.54 114.58 118.07 1orr h GLU 278 Ca 0.38 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1orr h GLU 278 Cb -0.09 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1orr h GLU 278 CO -0.10 0.76 0.13 1.25 -1.00 0.00 0.00 179.01 180.05 1orr h LEU 279 N 0.41 0.47 -0.80 1.33 5.85 -0.08 -2.01 115.31 120.48 1orr h LEU 279 Ca 0.05 -0.17 0.11 0.00 0.84 0.00 0.00 57.88 58.71 1orr h LEU 279 Cb 0.79 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.61 1orr h LEU 279 CO 0.06 0.51 0.42 -0.26 -0.34 0.00 0.00 178.44 178.84 1orr h PHE 280 N 0.40 0.75 -0.66 1.25 0.04 -0.73 -0.90 116.94 117.10 1orr h PHE 280 Ca 0.11 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.90 1orr h PHE 280 Cb 0.19 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 1orr h PHE 280 CO -0.00 0.25 0.35 -0.22 -0.60 0.00 0.00 178.31 178.09 1orr h LYS 281 N 0.67 0.92 -0.63 1.51 1.63 -1.12 0.34 116.57 119.89 1orr h LYS 281 Ca 0.41 -0.12 0.03 0.00 -0.85 0.00 0.00 60.65 60.12 1orr h LYS 281 Cb 0.47 -0.18 -0.04 0.00 -0.60 0.00 0.00 32.23 31.88 1orr h LYS 281 CO -0.30 0.71 0.39 -0.07 -3.45 0.00 0.00 179.45 176.73 1orr h LEU 282 N 0.90 0.63 -0.32 5.20 3.38 -0.61 0.18 115.31 124.67 1orr h LEU 282 Ca 0.23 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.08 1orr h LEU 282 Cb 0.06 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1orr h LEU 282 CO -0.03 0.43 -0.28 -0.07 0.09 0.00 0.00 178.44 178.58 1orr h LEU 283 N 0.76 0.80 -1.14 1.67 3.38 -0.48 -1.75 115.31 118.54 1orr h LEU 283 Ca 0.26 -0.46 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1orr h LEU 283 Cb 0.04 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1orr h LEU 283 CO -0.11 1.09 0.34 -0.33 0.09 0.00 0.00 178.44 179.52 1orr h GLU 284 N 0.52 0.94 -0.24 1.13 5.08 -0.04 0.66 114.58 122.64 1orr h GLU 284 Ca 0.06 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 1orr h GLU 284 Cb 0.85 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1orr h GLU 284 CO 0.07 0.72 -0.16 -0.44 -1.00 0.00 0.00 179.01 178.20 1orr h ASP 285 N 0.94 0.55 0.67 1.42 3.32 -0.85 -0.51 116.42 121.96 1orr h ASP 285 Ca 0.24 -0.43 -0.09 0.00 0.02 0.00 0.00 57.03 56.76 1orr h ASP 285 Cb 0.07 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1orr h ASP 285 CO -0.03 0.87 -0.44 0.22 -1.72 0.00 0.00 179.24 178.14 1orr h TYR 286 N 0.24 0.00 -0.00 4.55 3.20 -1.00 -3.30 116.97 120.66 1orr h TYR 286 Ca 0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1orr h TYR 286 Cb 0.68 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.95 1orr h TYR 286 CO 0.07 0.44 -0.48 0.00 -1.64 0.00 0.00 178.16 176.55 1orr n ASN 288 N -0.86 -2.75 -3.68 0.00 3.02 -0.22 -5.01 115.26 105.76 1orr n ASN 288 Ca 0.04 -0.55 -0.23 0.00 -0.03 0.00 0.00 54.58 53.80 1orr n ASN 288 Cb 0.23 -4.68 -0.08 0.00 -0.61 0.00 0.00 39.78 34.64 1orr n ASN 288 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1orr s ILE 289 N -3.32 0.26 -0.15 2.41 -4.36 -1.11 -5.07 121.20 109.86 1orr s ILE 289 Ca 0.10 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.51 1orr s ILE 289 Cb -0.04 -2.38 0.01 0.00 1.25 0.00 0.00 42.46 41.30 1orr s ILE 289 CO 0.66 0.00 -0.20 -1.81 0.24 0.00 0.00 174.94 173.83 1orr s ASP 290 N -3.52 3.24 -0.60 4.36 1.01 -1.26 -4.49 116.67 115.40 1orr s ASP 290 Ca 0.31 -0.58 -0.18 0.00 0.71 0.00 0.00 52.55 52.81 1orr s ASP 290 Cb 0.02 -1.48 0.12 0.00 1.01 0.00 0.00 42.92 42.59 1orr s ASP 290 CO 0.22 0.07 0.68 -0.04 0.21 0.00 0.00 175.17 176.30 1orr s MET 291 N 0.87 3.08 0.02 8.23 -1.94 -1.26 -5.02 119.30 123.28 1orr s MET 291 Ca -0.05 -1.49 -0.12 0.00 -1.71 0.00 0.00 55.69 52.32 1orr s MET 291 Cb -0.15 -4.31 -0.06 0.00 2.01 0.00 0.00 34.83 32.33 1orr s MET 291 CO -0.03 -1.49 0.39 1.03 -0.01 0.00 0.00 175.02 174.91 1orr s ARG 292 N 2.30 3.82 0.29 2.03 0.52 -1.26 -5.07 118.95 121.59 1orr s ARG 292 Ca 0.11 0.29 -0.14 0.00 -0.52 0.00 0.00 55.73 55.46 1orr s ARG 292 Cb -0.24 -3.13 0.01 0.00 0.52 0.00 0.00 34.95 32.11 1orr s ARG 292 CO 0.04 0.65 0.59 -0.59 0.02 0.00 0.00 175.30 176.01 1orr s PHE 293 N -1.20 0.28 0.02 -0.53 -0.12 -1.26 -4.39 117.98 110.78 1orr s PHE 293 Ca 0.27 -0.70 0.08 0.00 -0.05 0.00 0.00 56.93 56.53 1orr s PHE 293 Cb -0.15 0.39 -0.02 0.00 -0.63 0.00 0.00 43.02 42.60 1orr s PHE 293 CO 0.15 -1.17 -0.24 0.99 -0.05 0.00 0.00 175.22 174.90 1orr s THR 294 N -3.58 1.89 -0.05 -4.49 2.01 -0.31 -5.00 115.64 106.12 1orr s THR 294 Ca 0.20 -1.19 -0.22 0.00 0.31 0.00 0.00 61.69 60.78 1orr s THR 294 Cb -0.03 -1.61 -0.04 0.00 0.01 0.00 0.00 72.50 70.83 1orr s THR 294 CO 0.10 0.38 0.66 0.20 -0.69 0.00 0.00 174.62 175.27 1orr s ASN 295 N -0.97 6.96 0.40 3.53 -0.87 -1.26 -1.86 114.94 120.87 1orr s ASN 295 Ca 0.10 1.16 0.08 0.00 -1.57 0.00 0.00 52.86 52.62 1orr s ASN 295 Cb -0.09 -2.39 -0.02 0.00 -0.02 0.00 0.00 41.25 38.72 1orr s ASN 295 CO 0.01 -0.05 0.34 -0.76 -2.57 0.00 0.00 177.10 174.06 1orr s LEU 296 N 0.53 3.41 0.78 0.60 1.43 0.15 -4.93 118.68 120.66 1orr s LEU 296 Ca 0.35 -0.71 -0.13 0.00 -1.03 0.00 0.00 54.13 52.60 1orr s LEU 296 Cb -0.18 -2.04 0.07 0.00 0.03 0.00 0.00 46.19 44.07 1orr s LEU 296 CO 0.17 -0.57 1.19 -2.84 0.23 0.00 0.00 176.35 174.54 1orr s PRO 297 N -4.07 1.85 0.70 1.29 0.02 -1.26 -0.85 135.00 132.68 1orr s PRO 297 Ca 0.46 1.68 -0.14 0.00 0.02 0.00 0.00 61.00 63.02 1orr s PRO 297 Cb -0.03 -1.81 0.02 0.00 0.02 0.00 0.00 34.50 32.70 1orr s PRO 297 CO 0.27 -2.04 1.13 0.54 -0.33 0.00 0.00 177.00 176.57 1orr s VAL 298 N -2.19 2.97 0.43 3.83 0.11 -1.26 -3.60 120.40 120.69 1orr s VAL 298 Ca 0.72 0.44 -0.25 0.00 -2.93 0.00 0.00 61.98 59.96 1orr s VAL 298 Cb -0.27 -2.94 -0.08 0.00 -1.53 0.00 0.00 36.38 31.56 1orr s VAL 298 CO 0.49 -0.29 1.28 -0.60 -3.33 0.00 0.00 175.10 172.65 1orr s ARG 299 N -4.15 3.84 0.05 1.54 3.52 -1.26 -4.86 118.95 117.63 1orr s ARG 299 Ca 0.68 2.08 -0.10 0.00 -0.13 0.00 0.00 55.73 58.26 1orr s ARG 299 Cb -0.22 -2.64 -0.03 0.00 -1.56 0.00 0.00 34.95 30.50 1orr s ARG 299 CO 0.44 -0.57 1.18 1.49 -0.81 0.00 0.00 175.30 177.03 1orr h GLU 300 N 2.43 -0.04 -4.83 5.12 4.81 -2.02 -3.34 114.58 116.71 1orr h GLU 300 Ca -0.50 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 58.07 1orr h GLU 300 Cb 1.25 0.01 -0.24 0.00 0.63 0.00 0.00 28.75 30.40 1orr h GLU 300 CO 0.62 -0.03 -0.60 0.45 -0.73 0.00 0.00 179.01 178.72 1orr s SER 301 N -3.70 5.28 0.13 1.04 0.15 -1.26 -5.07 113.70 110.26 1orr s SER 301 Ca -0.04 -0.53 -0.16 0.00 0.70 0.00 0.00 55.95 55.92 1orr s SER 301 Cb 0.03 -1.94 0.04 0.00 -1.71 0.00 0.00 66.02 62.44 1orr s SER 301 CO 0.20 -0.16 0.41 -0.62 1.20 0.00 0.00 173.24 174.27 1orr s ASP 302 N 1.57 -0.25 -0.13 5.45 2.15 -1.26 -5.08 116.67 119.12 1orr s ASP 302 Ca 0.04 -0.31 0.01 0.00 0.43 0.00 0.00 52.55 52.72 1orr s ASP 302 Cb -0.17 0.48 -0.00 0.00 -0.30 0.00 0.00 42.92 42.93 1orr s ASP 302 CO 0.04 -0.86 -0.17 -1.10 -0.17 0.00 0.00 175.17 172.91 1orr s GLN 303 N -3.80 3.21 0.31 4.34 -0.21 -1.26 -4.67 119.66 117.59 1orr s GLN 303 Ca 0.03 -0.77 0.03 0.00 0.02 0.00 0.00 55.36 54.67 1orr s GLN 303 Cb 0.02 -2.53 0.53 0.00 1.00 0.00 0.00 33.01 32.02 1orr s GLN 303 CO -0.12 0.12 1.83 0.00 -2.12 0.00 0.00 175.29 175.00 1orr h ARG 304 N 6.97 0.55 -3.32 2.91 3.08 -1.91 -3.43 114.38 119.23 1orr h ARG 304 Ca -0.27 -0.14 -0.18 0.00 0.07 0.00 0.00 59.98 59.46 1orr h ARG 304 Cb 1.21 -0.07 -0.26 0.00 0.08 0.00 0.00 29.97 30.93 1orr h ARG 304 CO 0.54 0.62 -0.51 0.08 -1.07 0.00 0.00 179.97 179.62 1orr s VAL 305 N -4.88 0.00 -0.17 2.04 1.01 -1.26 -0.42 120.40 116.72 1orr s VAL 305 Ca -0.08 -0.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 1orr s VAL 305 Cb 0.15 -0.25 0.07 0.00 0.00 0.00 0.00 36.38 36.35 1orr s VAL 305 CO 0.78 -0.01 0.14 0.12 0.00 0.00 0.00 175.10 176.13 1orr s PHE 306 N 0.06 -0.01 -0.03 5.22 5.36 -0.09 -4.96 117.98 123.54 1orr s PHE 306 Ca -0.00 -0.02 0.02 0.00 -0.96 0.00 0.00 56.93 55.96 1orr s PHE 306 Cb -0.01 -0.53 0.01 0.00 -0.34 0.00 0.00 43.02 42.14 1orr s PHE 306 CO 0.00 -0.51 -0.08 0.08 -1.46 0.00 0.00 175.22 173.26 1orr s VAL 307 N 2.22 0.71 -0.00 3.12 1.01 -1.26 -2.15 120.40 124.04 1orr s VAL 307 Ca 0.04 -0.29 -0.20 0.00 0.00 0.00 0.00 61.98 61.53 1orr s VAL 307 Cb -0.15 -0.66 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 1orr s VAL 307 CO -0.09 0.24 0.58 0.00 0.00 0.00 0.00 175.10 175.82 1orr s ALA 308 N 0.42 3.50 -0.38 5.51 0.00 -1.26 -0.65 121.76 128.90 1orr s ALA 308 Ca -0.06 0.01 -0.17 0.00 0.00 0.00 0.00 51.96 51.74 1orr s ALA 308 Cb -0.10 -2.72 0.01 0.00 0.00 0.00 0.00 23.12 20.30 1orr s ALA 308 CO 0.01 0.19 0.44 0.34 0.00 0.00 0.00 175.76 176.73 1orr s ASP 309 N -0.28 6.22 -0.23 0.00 -1.08 -0.43 -4.30 116.67 116.56 1orr s ASP 309 Ca 0.30 -0.38 0.13 0.00 -0.52 0.00 0.00 52.55 52.08 1orr s ASP 309 Cb -0.18 -2.23 0.76 0.00 -1.46 0.00 0.00 42.92 39.81 1orr s ASP 309 CO 0.17 -0.49 1.67 2.30 0.52 0.00 0.00 175.17 179.34 1orr n ILE 310 N 5.39 2.59 -0.27 4.11 -5.35 -1.26 -4.53 119.36 120.05 1orr n ILE 310 Ca -0.07 -1.32 0.06 0.00 -0.27 0.00 0.00 62.75 61.15 1orr n ILE 310 Cb 0.48 -0.30 0.20 0.00 -1.74 0.00 0.00 39.64 38.28 1orr n ILE 310 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1orr h LYS 311 N 3.64 0.44 0.03 6.28 3.64 -1.92 -1.55 116.57 127.13 1orr h LYS 311 Ca 0.02 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1orr h LYS 311 Cb 1.91 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 33.60 1orr h LYS 311 CO 0.48 0.29 -0.19 -0.22 -2.27 0.00 0.00 179.45 177.54 1orr h LYS 312 N 0.45 -0.32 -0.47 1.90 3.64 -1.94 0.96 116.57 120.78 1orr h LYS 312 Ca 0.43 0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.70 1orr h LYS 312 Cb 0.67 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 1orr h LYS 312 CO -0.42 -0.21 -0.23 0.97 -2.27 0.00 0.00 179.45 177.29 1orr h ILE 313 N -0.33 1.27 -0.57 2.00 6.09 -1.79 -1.47 117.51 122.71 1orr h ILE 313 Ca 0.05 -1.40 -0.08 0.00 -1.37 0.00 0.00 64.86 62.06 1orr h ILE 313 Cb 0.39 1.16 -0.02 0.00 0.47 0.00 0.00 36.82 38.81 1orr h ILE 313 CO -0.16 0.48 0.05 0.00 -3.07 0.00 0.00 178.15 175.45 1orr h THR 314 N 0.84 1.25 -0.14 2.19 1.03 -1.16 -1.01 112.91 115.91 1orr h THR 314 Ca 0.10 -1.03 -0.08 0.00 -0.01 0.00 0.00 66.41 65.39 1orr h THR 314 Cb 0.82 0.76 -0.01 0.00 -1.07 0.00 0.00 68.15 68.64 1orr h THR 314 CO 0.07 0.37 -0.27 -1.13 -0.01 0.00 0.00 175.52 174.55 1orr h ASN 315 N 0.89 0.26 0.26 0.00 -0.73 -0.63 0.23 115.58 115.87 1orr h ASN 315 Ca 0.17 -0.08 -0.32 0.00 1.87 0.00 0.00 56.30 57.94 1orr h ASN 315 Cb 0.45 -0.07 0.03 0.00 0.27 0.00 0.00 38.32 39.01 1orr h ASN 315 CO 0.02 0.54 -1.40 0.00 -0.37 0.00 0.00 177.43 176.22 1orr h ALA 316 N 1.49 -0.09 0.00 1.57 0.00 -0.45 -3.40 119.26 118.37 1orr h ALA 316 Ca 0.04 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 54.11 1orr h ALA 316 Cb 0.61 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1orr h ALA 316 CO 0.04 0.72 0.00 0.44 0.00 0.00 0.00 179.25 180.45 1orr n ILE 317 N -3.72 0.00 -3.68 0.00 -5.35 -0.46 -5.03 119.36 101.12 1orr n ILE 317 Ca -0.15 -0.28 -0.23 0.00 -0.27 0.00 0.00 62.75 61.82 1orr n ILE 317 Cb 1.07 1.33 0.03 0.00 -1.74 0.00 0.00 39.64 40.33 1orr n ILE 317 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1orr n ASP 318 N -0.14 -2.49 -4.69 7.28 8.00 0.82 -4.99 116.55 120.33 1orr n ASP 318 Ca 0.00 -0.87 -0.33 0.00 0.71 0.00 0.00 54.79 54.30 1orr n ASP 318 Cb 0.08 -3.93 -0.09 0.00 -0.02 0.00 0.00 41.12 37.17 1orr n ASP 318 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1orr s TRP 319 N -3.63 3.11 0.01 1.24 -0.00 -1.26 -5.02 118.94 113.39 1orr s TRP 319 Ca 0.15 0.11 -0.18 0.00 -0.00 0.00 0.00 56.10 56.17 1orr s TRP 319 Cb -0.04 -1.69 0.03 0.00 -0.00 0.00 0.00 33.47 31.77 1orr s TRP 319 CO 0.82 0.47 0.40 -1.54 -0.00 0.00 0.00 176.95 177.11 1orr s SER 320 N -1.51 -0.29 0.17 5.86 1.04 -1.26 -4.15 113.70 113.56 1orr s SER 320 Ca 0.19 0.12 -0.30 0.00 0.48 0.00 0.00 55.95 56.44 1orr s SER 320 Cb -0.12 0.39 -0.08 0.00 0.10 0.00 0.00 66.02 66.32 1orr s SER 320 CO 0.10 -0.57 1.14 -2.84 0.98 0.00 0.00 173.24 172.05 1orr s PRO 321 N -1.84 4.54 -0.07 4.02 0.02 -1.26 -4.93 135.00 135.48 1orr s PRO 321 Ca -0.09 1.77 0.16 0.00 0.02 0.00 0.00 61.00 62.86 1orr s PRO 321 Cb -0.02 -3.27 -0.24 0.00 0.02 0.00 0.00 34.50 30.99 1orr s PRO 321 CO 0.02 -0.01 0.25 1.63 -0.33 0.00 0.00 177.00 178.56 1orr n LYS 322 N 2.56 0.86 -3.29 5.54 4.76 -1.26 -4.94 118.16 122.39 1orr n LYS 322 Ca 0.04 -0.10 -0.39 0.00 -2.87 0.00 0.00 58.31 54.98 1orr n LYS 322 Cb 0.46 -1.40 -0.08 0.00 -1.84 0.00 0.00 35.03 32.16 1orr n LYS 322 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1orr s VAL 323 N -2.87 5.11 0.72 -0.18 1.01 -1.26 -5.05 120.40 117.88 1orr s VAL 323 Ca -0.07 0.79 -0.13 0.00 0.00 0.00 0.00 61.98 62.58 1orr s VAL 323 Cb 0.08 -3.79 0.03 0.00 0.00 0.00 0.00 36.38 32.71 1orr s VAL 323 CO 0.68 0.13 1.11 -0.94 0.00 0.00 0.00 175.10 176.08 1orr s SER 324 N 1.47 4.71 0.21 3.32 1.04 -1.26 -4.70 113.70 118.49 1orr s SER 324 Ca 0.20 1.96 -0.10 0.00 0.48 0.00 0.00 55.95 58.49 1orr s SER 324 Cb -0.16 -2.54 0.15 0.00 0.10 0.00 0.00 66.02 63.58 1orr s SER 324 CO 0.09 -1.90 1.85 0.00 0.98 0.00 0.00 173.24 174.26 1orr h ALA 325 N -0.55 0.97 0.06 5.32 0.00 -1.86 0.26 119.26 123.45 1orr h ALA 325 Ca -0.45 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.37 1orr h ALA 325 Cb 1.24 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1orr h ALA 325 CO 0.52 0.44 -0.03 -0.22 0.00 0.00 0.00 179.25 179.96 1orr h LYS 326 N 1.04 -0.08 -0.71 0.00 3.64 -1.95 -0.05 116.57 118.46 1orr h LYS 326 Ca 0.27 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.61 1orr h LYS 326 Cb -0.04 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 1orr h LYS 326 CO -0.05 0.10 0.27 -0.44 -2.27 0.00 0.00 179.45 177.05 1orr h ASP 327 N -0.24 1.00 -0.25 4.20 3.32 -1.88 -2.19 116.42 120.37 1orr h ASP 327 Ca -0.01 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 56.83 1orr h ASP 327 Cb 0.21 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1orr h ASP 327 CO 0.01 0.91 0.04 1.23 -1.72 0.00 0.00 179.24 179.71 1orr h GLY 328 N 1.03 0.45 1.18 2.75 0.00 -0.39 -1.75 103.07 106.34 1orr h GLY 328 Ca 0.23 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.25 1orr h GLY 328 CO -0.02 0.28 0.41 -2.08 0.00 0.00 0.00 176.54 175.14 1orr h VAL 329 N 0.22 1.23 -0.40 4.60 2.07 -0.94 0.16 116.25 123.19 1orr h VAL 329 Ca 0.08 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 1orr h VAL 329 Cb 0.33 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1orr h VAL 329 CO 0.01 0.26 0.19 1.56 0.02 0.00 0.00 177.57 179.61 1orr h GLN 330 N 1.07 0.57 -0.60 1.57 4.20 -1.25 0.11 115.11 120.78 1orr h GLN 330 Ca 0.27 -0.08 0.01 0.00 0.06 0.00 0.00 58.65 58.91 1orr h GLN 330 Cb 0.04 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 1orr h GLN 330 CO -0.04 0.49 0.39 0.87 -0.67 0.00 0.00 178.83 179.87 1orr h LYS 331 N 0.50 0.77 -0.56 1.46 1.57 -0.72 -1.88 116.57 117.71 1orr h LYS 331 Ca 0.14 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 1orr h LYS 331 Cb 0.11 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 1orr h LYS 331 CO -0.02 0.51 0.26 1.98 -0.57 0.00 0.00 179.45 181.61 1orr h MET 332 N 0.79 0.81 -0.53 3.15 4.05 -0.26 -0.10 114.93 122.84 1orr h MET 332 Ca 0.22 -0.13 0.00 0.00 -0.28 0.00 0.00 59.70 59.52 1orr h MET 332 Cb -0.07 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 30.56 1orr h MET 332 CO -0.06 0.68 0.34 -0.92 0.23 0.00 0.00 176.91 177.18 1orr h TYR 333 N 0.76 0.68 -0.50 1.39 3.20 -0.48 0.52 116.97 122.54 1orr h TYR 333 Ca 0.19 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.11 1orr h TYR 333 Cb 0.14 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.14 1orr h TYR 333 CO 0.00 0.45 0.27 -0.44 -1.64 0.00 0.00 178.16 176.80 1orr h ASP 334 N 0.72 0.41 -0.01 -2.11 3.32 -0.82 0.29 116.42 118.22 1orr h ASP 334 Ca 0.19 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 1orr h ASP 334 Cb -0.06 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 1orr h ASP 334 CO -0.04 0.28 0.01 -0.25 -1.72 0.00 0.00 179.24 177.52 1orr h TRP 335 N 0.53 0.02 -0.62 4.55 7.01 -0.70 -1.94 115.95 124.80 1orr h TRP 335 Ca 0.21 -0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.30 1orr h TRP 335 Cb 0.09 -0.01 -0.07 0.00 -2.10 0.00 0.00 29.16 27.08 1orr h TRP 335 CO -0.09 0.14 0.26 1.15 -2.79 0.00 0.00 178.44 177.11 1orr h THR 336 N -0.11 0.82 0.00 2.65 2.02 -0.33 0.79 112.91 118.76 1orr h THR 336 Ca 0.00 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1orr h THR 336 Cb 0.13 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1orr h THR 336 CO -0.00 0.09 0.00 0.77 0.37 0.00 0.00 175.52 176.75 1orr h SER 337 N 0.47 0.00 1.17 4.18 4.64 -0.20 -2.68 113.55 121.13 1orr h SER 337 Ca 0.30 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.55 1orr h SER 337 Cb 0.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1orr h SER 337 CO -0.27 0.00 -0.35 0.77 -0.87 0.00 0.00 176.83 176.11 1orr h SER 338 N 0.00 0.00 0.00 4.97 4.64 -0.04 -3.51 113.55 119.62 1orr h SER 338 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1orr h SER 338 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1orr h SER 338 CO 0.00 0.35 0.00 -0.38 -0.87 0.00 0.00 176.83 175.93