#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2et1 n ASP 2 N 0.00 -0.14 -4.62 3.42 9.92 -1.26 -4.88 116.55 118.99 2et1 n ASP 2 Ca 0.00 1.12 -0.44 0.00 -0.53 0.00 0.00 54.79 54.94 2et1 n ASP 2 Cb 0.00 -1.11 -0.01 0.00 -0.64 0.00 0.00 41.12 39.35 2et1 n ASP 2 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 2et1 n PRO 3 N 0.84 1.54 -1.62 -0.24 -0.02 -1.26 -4.97 135.00 129.26 2et1 n PRO 3 Ca 0.13 0.54 -0.33 0.00 -2.02 0.00 0.00 63.50 61.82 2et1 n PRO 3 Cb 0.30 -1.96 0.06 0.00 -0.02 0.00 0.00 33.50 31.88 2et1 n PRO 3 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2et1 s ASP 4 N -0.49 4.77 0.56 2.55 -0.00 -1.26 -4.79 116.67 118.01 2et1 s ASP 4 Ca 0.58 2.10 -0.18 0.00 -0.00 0.00 0.00 52.55 55.05 2et1 s ASP 4 Cb -0.67 -2.56 -0.05 0.00 -0.00 0.00 0.00 42.92 39.64 2et1 s ASP 4 CO 0.60 -1.86 1.06 -2.16 -0.00 0.00 0.00 175.17 172.82 2et1 s PRO 5 N -4.08 3.43 0.00 8.23 0.04 -1.21 -4.98 135.00 136.43 2et1 s PRO 5 Ca 0.69 1.32 0.07 0.00 0.04 0.00 0.00 61.00 63.11 2et1 s PRO 5 Cb -0.23 -2.04 0.18 0.00 0.04 0.00 0.00 34.50 32.45 2et1 s PRO 5 CO 0.43 -0.73 1.11 1.28 0.04 0.00 0.00 177.00 179.13 2et1 n LEU 6 N -1.64 2.48 -3.83 -3.56 4.77 -1.26 -5.03 117.00 108.93 2et1 n LEU 6 Ca 0.09 -1.87 -0.06 0.00 -0.03 0.00 0.00 56.01 54.14 2et1 n LEU 6 Cb 0.52 -0.13 0.01 0.00 -2.33 0.00 0.00 43.42 41.49 2et1 n LEU 6 CO 0.44 0.61 0.63 0.00 -1.33 0.00 0.00 177.39 177.74 2et1 s GLN 7 N -0.95 1.74 0.06 3.23 0.00 -1.26 -5.09 119.66 117.39 2et1 s GLN 7 Ca 0.14 -1.07 -0.25 0.00 -0.00 0.00 0.00 55.36 54.19 2et1 s GLN 7 Cb 0.08 0.52 -0.16 0.00 0.00 0.00 0.00 33.01 33.44 2et1 s GLN 7 CO 0.10 -0.81 1.61 -0.44 0.00 0.00 0.00 175.29 175.75 2et1 h ASP 8 N 2.00 -0.09 -4.95 12.60 3.45 -2.03 -3.46 116.42 123.93 2et1 h ASP 8 Ca -0.27 -0.10 -0.19 0.00 0.43 0.00 0.00 57.03 56.90 2et1 h ASP 8 Cb 1.24 0.02 -0.21 0.00 -0.56 0.00 0.00 39.33 39.83 2et1 h ASP 8 CO 0.34 0.04 -0.71 -0.36 -1.57 0.00 0.00 179.24 176.98 2et1 s PHE 9 N -5.72 0.35 -0.50 4.55 0.40 -1.26 -5.06 117.98 110.74 2et1 s PHE 9 Ca -0.14 -0.55 0.06 0.00 -0.60 0.00 0.00 56.93 55.70 2et1 s PHE 9 Cb 0.05 -0.24 0.22 0.00 0.51 0.00 0.00 43.02 43.55 2et1 s PHE 9 CO 0.65 -0.18 0.82 0.00 0.70 0.00 0.00 175.22 177.22 2et1 s VAL 11 N 0.78 2.81 0.28 0.00 1.01 -1.26 -4.48 120.40 119.53 2et1 s VAL 11 Ca 0.31 0.58 -0.30 0.00 0.00 0.00 0.00 61.98 62.57 2et1 s VAL 11 Cb 0.11 -3.37 -0.12 0.00 0.00 0.00 0.00 36.38 33.00 2et1 s VAL 11 CO -0.14 0.05 1.64 0.00 0.00 0.00 0.00 175.10 176.64 2et1 n ALA 12 N 3.93 2.70 -2.60 5.51 0.00 -0.65 -0.40 120.51 129.01 2et1 n ALA 12 Ca 0.13 0.38 -0.43 0.00 0.00 0.00 0.00 53.44 53.51 2et1 n ALA 12 Cb 0.40 -2.49 -0.06 0.00 0.00 0.00 0.00 19.45 17.30 2et1 n ALA 12 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2et1 s ASP 13 N 0.65 6.31 0.00 0.00 3.68 -0.07 -4.54 116.67 122.69 2et1 s ASP 13 Ca 0.66 -0.47 0.21 0.00 2.13 0.00 0.00 52.55 55.08 2et1 s ASP 13 Cb -0.49 -2.33 0.55 0.00 -1.45 0.00 0.00 42.92 39.20 2et1 s ASP 13 CO 0.45 -0.88 1.46 0.18 0.13 0.00 0.00 175.17 176.51 2et1 n LEU 14 N 6.45 3.33 -4.76 -1.34 4.77 -1.26 -4.63 117.00 119.55 2et1 n LEU 14 Ca -0.02 -1.60 -0.41 0.00 -0.03 0.00 0.00 56.01 53.95 2et1 n LEU 14 Cb 0.47 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 2et1 n LEU 14 CO 0.56 0.80 1.15 -0.67 -1.33 0.00 0.00 177.39 177.90 2et1 n ASP 15 N 1.34 3.74 0.20 -1.43 2.03 -1.26 -4.87 116.55 116.30 2et1 n ASP 15 Ca 0.21 1.20 0.17 0.00 0.52 0.00 0.00 54.79 56.89 2et1 n ASP 15 Cb 0.54 -1.60 0.82 0.00 -0.72 0.00 0.00 41.12 40.16 2et1 n ASP 15 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2et1 h GLY 16 N 3.43 0.00 -2.21 0.27 0.00 -2.03 -1.64 103.07 100.90 2et1 h GLY 16 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2et1 h GLY 16 CO 0.68 0.00 0.00 0.28 0.00 0.00 0.00 176.54 177.50 2et1 n LYS 17 N -3.85 2.49 -1.96 4.80 4.76 -1.26 -4.98 118.16 118.16 2et1 n LYS 17 Ca 0.02 -2.29 -0.35 0.00 -2.87 0.00 0.00 58.31 52.81 2et1 n LYS 17 Cb 0.33 -1.48 0.04 0.00 -1.84 0.00 0.00 35.03 32.07 2et1 n LYS 17 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2et1 s ALA 18 N -1.28 2.51 0.52 7.82 0.00 -0.62 -4.97 121.76 125.74 2et1 s ALA 18 Ca 0.38 0.95 -0.22 0.00 0.00 0.00 0.00 51.96 53.07 2et1 s ALA 18 Cb 0.21 -3.44 -0.07 0.00 0.00 0.00 0.00 23.12 19.83 2et1 s ALA 18 CO 0.29 -1.21 1.19 1.55 0.00 0.00 0.00 175.76 177.58 2et1 n VAL 19 N -1.74 3.34 -4.15 0.00 3.14 -1.26 -4.99 118.33 112.66 2et1 n VAL 19 Ca 0.13 -0.50 -0.35 0.00 -2.96 0.00 0.00 64.34 60.67 2et1 n VAL 19 Cb 0.50 -1.44 -0.10 0.00 -1.06 0.00 0.00 33.84 31.74 2et1 n VAL 19 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2et1 s SER 20 N -0.89 5.46 0.23 6.55 0.15 -1.26 -4.54 113.70 119.39 2et1 s SER 20 Ca 0.69 0.10 -0.02 0.00 0.70 0.00 0.00 55.95 57.42 2et1 s SER 20 Cb -0.46 -1.82 -0.03 0.00 -1.71 0.00 0.00 66.02 62.00 2et1 s SER 20 CO 0.52 0.25 0.23 0.68 1.20 0.00 0.00 173.24 176.11 2et1 s VAL 21 N -0.07 0.00 -0.10 4.45 -7.23 -1.26 -5.05 120.40 111.13 2et1 s VAL 21 Ca 0.05 -1.89 -0.35 0.00 -1.81 0.00 0.00 61.98 57.99 2et1 s VAL 21 Cb -0.12 -2.46 -0.12 0.00 0.56 0.00 0.00 36.38 34.23 2et1 s VAL 21 CO 0.01 0.00 1.87 -3.20 -0.31 0.00 0.00 175.10 173.47 2et1 n ASN 22 N -0.54 3.35 0.00 4.85 5.15 -1.26 -4.24 115.26 122.58 2et1 n ASN 22 Ca 0.02 0.98 0.00 0.00 -0.60 0.00 0.00 54.58 54.98 2et1 n ASN 22 Cb 0.65 -1.35 0.00 0.00 -0.53 0.00 0.00 39.78 38.55 2et1 n ASN 22 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2et1 n GLY 23 N 4.38 1.25 3.16 8.20 0.00 -1.26 -4.87 105.19 116.06 2et1 n GLY 23 Ca 0.23 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 2et1 n GLY 23 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2et1 s HIS 24 N 0.00 -0.18 0.99 1.61 3.76 -1.26 -5.08 115.29 115.13 2et1 s HIS 24 Ca 0.00 0.39 -0.12 0.00 -0.15 0.00 0.00 55.06 55.18 2et1 s HIS 24 Cb 0.00 0.06 0.19 0.00 1.11 0.00 0.00 32.58 33.94 2et1 s HIS 24 CO 0.00 -0.24 1.08 0.95 -0.85 0.00 0.00 174.74 175.68 2et1 s THR 25 N -0.61 2.29 0.11 1.30 -4.23 -1.26 -4.86 115.64 108.37 2et1 s THR 25 Ca -0.07 0.09 0.08 0.00 -1.18 0.00 0.00 61.69 60.62 2et1 s THR 25 Cb -0.04 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.44 2et1 s THR 25 CO 0.02 -0.12 -0.15 0.00 -0.54 0.00 0.00 174.62 173.82 2et1 s LYS 27 N -2.16 3.55 0.30 0.00 -0.14 0.47 -4.68 119.74 117.08 2et1 s LYS 27 Ca 0.19 2.15 -0.29 0.00 -1.36 0.00 0.00 55.97 56.66 2et1 s LYS 27 Cb -0.11 -2.47 -0.13 0.00 -1.68 0.00 0.00 37.83 33.44 2et1 s LYS 27 CO 0.11 -0.84 1.29 -2.30 -0.76 0.00 0.00 175.35 172.85 2et1 n PRO 28 N -0.51 1.98 -0.06 -1.68 -0.02 -1.26 -4.62 135.00 128.83 2et1 n PRO 28 Ca 0.07 0.70 0.16 0.00 -2.02 0.00 0.00 63.50 62.41 2et1 n PRO 28 Cb 0.45 -2.27 0.58 0.00 -0.02 0.00 0.00 33.50 32.23 2et1 n PRO 28 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 2et1 h MET 29 N 2.98 0.23 -0.23 -0.52 2.86 -1.96 -0.87 114.93 117.42 2et1 h MET 29 Ca -0.45 -0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.25 2et1 h MET 29 Cb 1.29 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.89 2et1 h MET 29 CO 0.66 0.15 0.35 0.66 1.06 0.00 0.00 176.91 179.80 2et1 h SER 30 N 0.24 0.00 -0.38 1.22 4.64 -2.01 -2.21 113.55 115.05 2et1 h SER 30 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2et1 h SER 30 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2et1 h SER 30 CO -0.06 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.28 2et1 n GLU 31 N -3.48 2.38 -0.00 4.77 1.02 -0.33 -4.65 120.64 120.34 2et1 n GLU 31 Ca 0.03 -2.18 -0.10 0.00 -0.02 0.00 0.00 57.16 54.88 2et1 n GLU 31 Cb 0.47 -1.45 -0.14 0.00 -0.02 0.00 0.00 31.44 30.30 2et1 n GLU 31 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2et1 h ALA 32 N 3.85 0.66 -0.69 0.62 0.00 -1.47 -3.49 119.26 118.73 2et1 h ALA 32 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 54.91 53.53 2et1 h ALA 32 Cb 0.90 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2et1 h ALA 32 CO 0.00 1.50 0.00 0.41 0.00 0.00 0.00 179.25 181.16 2et1 n GLY 33 N 1.59 0.25 0.01 0.00 0.00 -1.26 -4.46 105.19 101.33 2et1 n GLY 33 Ca -0.17 -0.95 0.11 0.00 0.00 0.00 0.00 46.02 45.01 2et1 n GLY 33 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2et1 n ASP 34 N -2.05 0.53 -1.00 1.61 8.00 -1.26 -4.65 116.55 117.73 2et1 n ASP 34 Ca 0.00 -0.40 0.10 0.00 0.71 0.00 0.00 54.79 55.20 2et1 n ASP 34 Cb 0.00 1.29 0.19 0.00 -0.02 0.00 0.00 41.12 42.59 2et1 n ASP 34 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2et1 n ASP 35 N -1.92 3.24 0.25 -2.24 5.75 -1.26 -4.63 116.55 115.73 2et1 n ASP 35 Ca 0.00 -1.93 0.13 0.00 -0.01 0.00 0.00 54.79 52.99 2et1 n ASP 35 Cb 0.45 -0.23 0.57 0.00 -1.03 0.00 0.00 41.12 40.88 2et1 n ASP 35 CO 0.00 0.00 0.00 2.19 -0.11 0.00 0.00 177.20 179.28 2et1 h PHE 36 N 3.79 0.00 -0.05 2.11 -5.15 -1.82 -2.57 116.94 113.25 2et1 h PHE 36 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 2et1 h PHE 36 Cb 0.88 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.05 2et1 h PHE 36 CO 0.23 0.13 0.00 1.28 -2.00 0.00 0.00 178.31 177.95 2et1 n LEU 37 N -3.30 0.37 -4.23 2.10 4.77 -1.26 -4.06 117.00 111.40 2et1 n LEU 37 Ca 0.00 -0.17 -0.18 0.00 -0.03 0.00 0.00 56.01 55.64 2et1 n LEU 37 Cb 0.36 -0.03 -0.11 0.00 -2.33 0.00 0.00 43.42 41.31 2et1 n LEU 37 CO 0.31 0.08 -0.45 -0.36 -1.33 0.00 0.00 177.39 175.64 2et1 s PHE 38 N -1.94 1.37 0.05 -1.77 0.40 -0.97 -5.10 117.98 110.03 2et1 s PHE 38 Ca 0.22 -0.55 -0.13 0.00 -0.60 0.00 0.00 56.93 55.86 2et1 s PHE 38 Cb 0.11 -0.72 0.02 0.00 0.51 0.00 0.00 43.02 42.93 2et1 s PHE 38 CO 0.17 0.13 0.30 0.45 0.70 0.00 0.00 175.22 176.97 2et1 s SER 39 N -2.40 -0.11 -0.02 1.36 0.15 -1.26 -5.04 113.70 106.37 2et1 s SER 39 Ca 0.08 -0.24 0.04 0.00 0.70 0.00 0.00 55.95 56.52 2et1 s SER 39 Cb -0.05 0.36 0.07 0.00 -1.71 0.00 0.00 66.02 64.70 2et1 s SER 39 CO 0.03 -0.64 1.05 -1.54 1.20 0.00 0.00 173.24 173.33 2et1 n SER 40 N 0.46 2.16 0.29 5.45 3.41 -1.26 -4.84 113.62 119.28 2et1 n SER 40 Ca -0.18 -2.16 0.18 0.00 -0.26 0.00 0.00 58.87 56.45 2et1 n SER 40 Cb 0.60 -0.09 0.82 0.00 -0.26 0.00 0.00 64.21 65.29 2et1 n SER 40 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2et1 h LYS 41 N 0.21 0.00 -0.56 4.33 1.57 -1.98 -2.39 116.57 117.75 2et1 h LYS 41 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2et1 h LYS 41 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 2et1 h LYS 41 CO 0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 2et1 n LEU 42 N -3.03 3.22 0.21 2.94 4.77 -1.26 -4.37 117.00 119.48 2et1 n LEU 42 Ca -0.00 -1.57 0.07 0.00 -0.03 0.00 0.00 56.01 54.48 2et1 n LEU 42 Cb 0.23 -0.37 0.46 0.00 -2.33 0.00 0.00 43.42 41.41 2et1 n LEU 42 CO 0.25 0.78 0.78 0.71 -1.33 0.00 0.00 177.39 178.58 2et1 h THR 43 N 3.65 0.85 -3.78 -5.08 1.35 -1.81 -3.45 112.91 104.64 2et1 h THR 43 Ca 0.00 -1.17 -0.68 0.00 -0.55 0.00 0.00 66.41 64.02 2et1 h THR 43 Cb 0.83 1.70 -0.19 0.00 -1.73 0.00 0.00 68.15 68.76 2et1 h THR 43 CO 0.00 0.29 -0.75 -0.54 -0.25 0.00 0.00 175.52 174.26 2et1 s LYS 44 N -3.89 2.29 0.31 4.72 1.02 -1.26 -5.11 119.74 117.82 2et1 s LYS 44 Ca -0.01 -0.87 -0.29 0.00 0.02 0.00 0.00 55.97 54.82 2et1 s LYS 44 Cb 0.12 -2.34 -0.10 0.00 -0.52 0.00 0.00 37.83 34.99 2et1 s LYS 44 CO 0.66 0.56 1.27 0.00 -0.92 0.00 0.00 175.35 176.93 2et1 s ALA 45 N -0.98 3.49 0.82 5.17 0.00 -1.26 -5.03 121.76 123.96 2et1 s ALA 45 Ca 0.16 1.19 -0.12 0.00 0.00 0.00 0.00 51.96 53.19 2et1 s ALA 45 Cb -0.11 -3.45 0.08 0.00 0.00 0.00 0.00 23.12 19.64 2et1 s ALA 45 CO 0.07 -0.55 1.12 0.20 0.00 0.00 0.00 175.76 176.60 2et1 s GLY 46 N -0.49 1.61 -0.51 0.00 0.00 -1.26 -5.01 107.32 101.66 2et1 s GLY 46 Ca 0.49 -0.35 -0.26 0.00 0.00 0.00 0.00 44.72 44.59 2et1 s GLY 46 CO 0.50 0.11 1.02 0.21 0.00 0.00 0.00 173.10 174.94 2et1 s ASN 47 N -4.06 6.48 0.00 1.64 3.04 -1.26 -4.91 114.94 115.87 2et1 s ASN 47 Ca 0.61 0.09 0.20 0.00 0.04 0.00 0.00 52.86 53.80 2et1 s ASN 47 Cb -0.14 -2.49 0.90 0.00 -1.54 0.00 0.00 41.25 37.99 2et1 s ASN 47 CO 0.53 -1.21 1.62 0.35 -3.04 0.00 0.00 177.10 175.35 2et1 n THR 48 N 6.51 0.12 -1.96 -5.21 -2.24 -1.26 -4.51 114.28 105.74 2et1 n THR 48 Ca 0.07 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.22 2et1 n THR 48 Cb 0.48 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 2et1 n THR 48 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2et1 n SER 49 N -0.13 4.32 -4.34 3.42 3.41 -1.26 -4.05 113.62 114.99 2et1 n SER 49 Ca 0.15 -2.94 -0.18 0.00 -0.26 0.00 0.00 58.87 55.64 2et1 n SER 49 Cb 0.22 -1.60 -0.10 0.00 -0.26 0.00 0.00 64.21 62.48 2et1 n SER 49 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2et1 s THR 50 N 2.19 1.42 0.33 6.66 -4.23 -1.26 -5.02 115.64 115.73 2et1 s THR 50 Ca 0.44 -2.11 0.06 0.00 -1.18 0.00 0.00 61.69 58.91 2et1 s THR 50 Cb 0.12 -2.19 0.31 0.00 1.34 0.00 0.00 72.50 72.08 2et1 s THR 50 CO -0.05 -0.48 1.85 -0.65 -0.54 0.00 0.00 174.62 174.75 2et1 h PRO 51 N 2.51 0.76 0.00 3.99 0.11 -1.92 -1.30 132.00 136.16 2et1 h PRO 51 Ca -0.38 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.60 2et1 h PRO 51 Cb 1.22 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2et1 h PRO 51 CO 0.64 0.51 -0.36 -0.91 -0.21 0.00 0.00 178.00 177.67 2et1 h ASN 52 N 0.79 0.00 -0.04 -2.05 2.35 -1.90 -3.47 115.58 111.26 2et1 h ASN 52 Ca 0.47 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.20 2et1 h ASN 52 Cb 0.67 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 2et1 h ASN 52 CO -0.24 0.36 -0.02 0.61 -1.65 0.00 0.00 177.43 176.50 2et1 n GLY 53 N 0.10 0.45 3.15 2.83 0.00 -0.49 -1.36 105.19 109.88 2et1 n GLY 53 Ca -0.01 -0.98 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 2et1 n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2et1 s SER 54 N -2.92 0.32 -0.01 1.61 1.04 -1.26 -1.26 113.70 111.22 2et1 s SER 54 Ca 0.00 -1.12 0.00 0.00 0.48 0.00 0.00 55.95 55.31 2et1 s SER 54 Cb 0.00 0.29 0.02 0.00 0.10 0.00 0.00 66.02 66.43 2et1 s SER 54 CO 0.00 -0.71 0.02 0.00 0.98 0.00 0.00 173.24 173.53 2et1 s ALA 55 N -4.01 0.07 -0.24 5.32 0.00 -0.37 -4.72 121.76 117.80 2et1 s ALA 55 Ca 0.19 0.20 -0.08 0.00 0.00 0.00 0.00 51.96 52.27 2et1 s ALA 55 Cb 0.07 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.99 2et1 s ALA 55 CO -0.01 -0.07 0.09 0.08 0.00 0.00 0.00 175.76 175.85 2et1 s VAL 56 N 0.71 4.59 -0.33 0.00 1.01 -1.26 -1.48 120.40 123.64 2et1 s VAL 56 Ca -0.06 -0.08 -0.09 0.00 0.00 0.00 0.00 61.98 61.74 2et1 s VAL 56 Cb -0.09 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 33.16 2et1 s VAL 56 CO -0.02 0.34 0.15 -0.89 0.00 0.00 0.00 175.10 174.69 2et1 s THR 57 N 1.44 4.47 0.07 3.92 2.01 -0.05 -5.00 115.64 122.50 2et1 s THR 57 Ca 0.06 -0.60 -0.17 0.00 0.31 0.00 0.00 61.69 61.29 2et1 s THR 57 Cb -0.15 -3.35 -0.06 0.00 0.01 0.00 0.00 72.50 68.95 2et1 s THR 57 CO 0.05 -0.02 0.52 -1.61 -0.69 0.00 0.00 174.62 172.86 2et1 s GLU 58 N 1.57 4.06 -0.43 4.92 2.02 -1.26 -1.24 118.70 128.34 2et1 s GLU 58 Ca 0.03 0.58 0.10 0.00 0.02 0.00 0.00 54.97 55.70 2et1 s GLU 58 Cb -0.18 -3.16 0.39 0.00 0.10 0.00 0.00 34.13 31.29 2et1 s GLU 58 CO 0.06 0.62 0.94 -0.11 0.02 0.00 0.00 175.26 176.78 2et1 n LEU 59 N 1.52 2.92 0.00 1.80 7.94 0.06 -4.82 117.00 126.41 2et1 n LEU 59 Ca -0.10 -4.92 -0.19 0.00 -1.11 0.00 0.00 56.01 49.69 2et1 n LEU 59 Cb 0.51 0.02 0.12 0.00 0.53 0.00 0.00 43.42 44.60 2et1 n LEU 59 CO 0.40 2.12 0.52 -0.90 -1.11 0.00 0.00 177.39 178.42 2et1 n ASP 60 N -0.13 0.48 0.17 1.96 3.85 -1.26 -2.79 116.55 118.82 2et1 n ASP 60 Ca 0.26 -1.55 0.07 0.00 -0.71 0.00 0.00 54.79 52.86 2et1 n ASP 60 Cb 0.63 -0.60 0.57 0.00 -1.35 0.00 0.00 41.12 40.38 2et1 n ASP 60 CO 0.00 0.00 0.00 1.62 -1.01 0.00 0.00 177.20 177.81 2et1 h VAL 61 N -1.08 1.02 0.00 2.12 3.04 -1.54 0.26 116.25 120.07 2et1 h VAL 61 Ca -0.27 -0.06 -0.02 0.00 -1.01 0.00 0.00 66.70 65.34 2et1 h VAL 61 Cb 0.85 0.83 -0.00 0.00 -2.01 0.00 0.00 31.29 30.96 2et1 h VAL 61 CO 0.23 0.03 -0.10 0.00 -1.01 0.00 0.00 177.57 176.73 2et1 h ALA 62 N 1.91 1.71 0.00 3.17 0.00 -1.94 -2.98 119.26 121.13 2et1 h ALA 62 Ca 0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2et1 h ALA 62 Cb 0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2et1 h ALA 62 CO -0.01 0.12 -1.76 0.39 0.00 0.00 0.00 179.25 177.99 2et1 n GLU 63 N -4.24 0.59 -3.54 0.00 -0.58 -0.37 -4.78 120.64 107.72 2et1 n GLU 63 Ca -0.03 -0.13 -0.27 0.00 -0.42 0.00 0.00 57.16 56.31 2et1 n GLU 63 Cb 0.18 -1.38 -0.11 0.00 -0.57 0.00 0.00 31.44 29.56 2et1 n GLU 63 CO 0.00 0.00 0.00 -0.46 -0.48 0.00 0.00 177.13 176.19 2et1 s TRP 64 N -3.05 1.81 0.58 -0.32 -0.00 0.78 -4.94 118.94 113.80 2et1 s TRP 64 Ca -0.06 -2.61 0.27 0.00 -0.00 0.00 0.00 56.10 53.70 2et1 s TRP 64 Cb 0.10 -1.44 1.65 0.00 -0.00 0.00 0.00 33.47 33.78 2et1 s TRP 64 CO 0.67 -0.75 2.15 -1.35 -0.00 0.00 0.00 176.95 177.67 2et1 h PRO 65 N 5.60 0.00 0.00 5.86 0.11 -1.78 -1.72 132.00 140.07 2et1 h PRO 65 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 2et1 h PRO 65 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2et1 h PRO 65 CO 0.47 0.00 0.00 0.78 -0.21 0.00 0.00 178.00 179.04 2et1 h GLY 66 N 0.00 0.00 2.00 -0.55 0.00 -1.88 -1.57 103.07 101.07 2et1 h GLY 66 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2et1 h GLY 66 CO -0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 2et1 n THR 67 N -2.71 0.70 -1.67 4.70 -2.24 -0.65 -4.84 114.28 107.58 2et1 n THR 67 Ca -0.02 0.03 -0.46 0.00 -2.27 0.00 0.00 64.05 61.33 2et1 n THR 67 Cb 0.10 -0.89 -0.04 0.00 -2.10 0.00 0.00 70.33 67.40 2et1 n THR 67 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2et1 n ASN 68 N -2.14 2.99 0.00 3.42 5.15 -0.86 -1.35 115.26 122.48 2et1 n ASN 68 Ca 0.04 1.09 0.00 0.00 -0.60 0.00 0.00 54.58 55.11 2et1 n ASN 68 Cb 0.31 -1.42 0.00 0.00 -0.53 0.00 0.00 39.78 38.14 2et1 n ASN 68 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2et1 n THR 69 N 3.23 0.00 0.80 -0.44 -2.24 -1.26 -4.45 114.28 109.92 2et1 n THR 69 Ca 0.16 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.06 2et1 n THR 69 Cb 0.29 -0.01 0.19 0.00 -2.10 0.00 0.00 70.33 68.69 2et1 n THR 69 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2et1 n LEU 70 N 0.00 0.58 0.00 3.22 4.77 -0.46 -3.34 117.00 121.77 2et1 n LEU 70 Ca 0.00 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2et1 n LEU 70 Cb 0.00 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 2et1 n LEU 70 CO 0.00 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.73 2et1 n GLY 71 N 1.43 0.60 3.11 -0.72 0.00 -1.26 -4.98 105.19 103.38 2et1 n GLY 71 Ca 0.04 -0.41 -0.08 0.00 0.00 0.00 0.00 46.02 45.58 2et1 n GLY 71 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2et1 s VAL 72 N -2.00 0.18 0.26 1.61 -7.23 -1.26 -2.56 120.40 109.40 2et1 s VAL 72 Ca 0.00 -1.45 -0.21 0.00 -1.81 0.00 0.00 61.98 58.51 2et1 s VAL 72 Cb 0.00 -1.26 0.04 0.00 0.56 0.00 0.00 36.38 35.73 2et1 s VAL 72 CO 0.00 -0.80 0.82 -0.94 -0.31 0.00 0.00 175.10 173.87 2et1 s SER 73 N -2.63 -0.17 -0.02 4.85 1.04 -1.05 -3.77 113.70 111.95 2et1 s SER 73 Ca 0.02 -0.66 -0.07 0.00 0.48 0.00 0.00 55.95 55.73 2et1 s SER 73 Cb 0.04 0.67 0.01 0.00 0.10 0.00 0.00 66.02 66.84 2et1 s SER 73 CO -0.08 -1.27 0.14 -0.04 0.98 0.00 0.00 173.24 172.97 2et1 s MET 74 N -3.32 0.38 0.16 4.02 -1.94 -1.12 -1.20 119.30 116.28 2et1 s MET 74 Ca 0.13 -0.19 0.07 0.00 -1.71 0.00 0.00 55.69 53.99 2et1 s MET 74 Cb -0.04 0.16 -0.04 0.00 2.01 0.00 0.00 34.83 36.92 2et1 s MET 74 CO 0.06 -0.08 -0.14 -0.80 -0.01 0.00 0.00 175.02 174.05 2et1 s ASN 75 N -0.89 2.26 -0.03 3.03 0.02 -0.21 -0.76 114.94 118.36 2et1 s ASN 75 Ca -0.10 -0.91 0.02 0.00 -1.02 0.00 0.00 52.86 50.85 2et1 s ASN 75 Cb -0.05 -0.10 -0.03 0.00 0.02 0.00 0.00 41.25 41.09 2et1 s ASN 75 CO 0.01 -0.16 -0.06 -0.60 0.02 0.00 0.00 177.10 176.31 2et1 s ARG 76 N -3.14 2.67 -0.08 -0.60 3.52 -0.38 -1.24 118.95 119.71 2et1 s ARG 76 Ca 0.15 -0.63 0.01 0.00 -0.13 0.00 0.00 55.73 55.13 2et1 s ARG 76 Cb -0.03 -2.56 0.02 0.00 -1.56 0.00 0.00 34.95 30.82 2et1 s ARG 76 CO 0.04 0.63 -0.08 0.08 -0.81 0.00 0.00 175.30 175.17 2et1 s VAL 77 N -0.93 0.88 0.01 7.11 1.01 -0.47 -0.87 120.40 127.14 2et1 s VAL 77 Ca 0.15 -0.27 0.03 0.00 0.00 0.00 0.00 61.98 61.89 2et1 s VAL 77 Cb -0.11 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 2et1 s VAL 77 CO 0.05 0.32 -0.05 -1.81 0.00 0.00 0.00 175.10 173.61 2et1 s ASP 78 N 1.18 4.74 -0.08 3.32 1.01 -0.55 -1.64 116.67 124.64 2et1 s ASP 78 Ca -0.06 -0.13 0.01 0.00 0.71 0.00 0.00 52.55 53.09 2et1 s ASP 78 Cb -0.14 -1.13 0.02 0.00 1.01 0.00 0.00 42.92 42.68 2et1 s ASP 78 CO -0.02 0.27 -0.09 -0.36 0.21 0.00 0.00 175.17 175.18 2et1 s PHE 79 N -1.03 1.37 0.73 4.23 0.08 0.21 -1.24 117.98 122.33 2et1 s PHE 79 Ca 0.18 -0.57 -0.14 0.00 0.12 0.00 0.00 56.93 56.53 2et1 s PHE 79 Cb -0.11 -1.08 0.04 0.00 -0.57 0.00 0.00 43.02 41.30 2et1 s PHE 79 CO 0.09 -0.36 1.14 0.00 -0.10 0.00 0.00 175.22 175.99 2et1 s ALA 80 N 1.12 2.19 0.10 5.36 0.00 -0.39 -1.67 121.76 128.49 2et1 s ALA 80 Ca -0.06 0.61 -0.35 0.00 0.00 0.00 0.00 51.96 52.15 2et1 s ALA 80 Cb -0.14 -3.37 -0.14 0.00 0.00 0.00 0.00 23.12 19.46 2et1 s ALA 80 CO -0.01 -1.74 1.55 -2.30 0.00 0.00 0.00 175.76 173.26 2et1 n PRO 81 N -2.94 1.87 -0.97 0.00 -0.02 -1.26 -1.01 135.00 130.67 2et1 n PRO 81 Ca 0.11 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2et1 n PRO 81 Cb 0.52 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 2et1 n PRO 81 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2et1 n GLY 82 N 3.32 0.63 3.85 -1.23 0.00 -0.94 -5.03 105.19 105.78 2et1 n GLY 82 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 2et1 n GLY 82 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2et1 s GLY 83 N -2.00 1.86 0.03 -0.02 0.00 -0.18 -4.77 107.32 102.24 2et1 s GLY 83 Ca 0.00 0.08 0.05 0.00 0.00 0.00 0.00 44.72 44.85 2et1 s GLY 83 CO 0.00 0.37 -0.14 -1.08 0.00 0.00 0.00 173.10 172.25 2et1 s THR 84 N -2.88 1.10 -0.51 0.90 -1.32 -0.46 -0.97 115.64 111.50 2et1 s THR 84 Ca 0.58 -0.90 -0.16 0.00 -1.21 0.00 0.00 61.69 60.00 2et1 s THR 84 Cb -0.12 -0.98 0.09 0.00 -1.51 0.00 0.00 72.50 69.99 2et1 s THR 84 CO 0.44 0.08 0.49 0.21 -2.21 0.00 0.00 174.62 173.63 2et1 s ASN 85 N -0.94 6.17 0.82 8.08 2.47 -0.42 -4.11 114.94 127.01 2et1 s ASN 85 Ca 0.02 -1.41 -0.11 0.00 0.42 0.00 0.00 52.86 51.79 2et1 s ASN 85 Cb -0.07 -2.22 0.08 0.00 -1.45 0.00 0.00 41.25 37.59 2et1 s ASN 85 CO 0.01 -0.79 1.10 -2.16 -3.72 0.00 0.00 177.10 171.53 2et1 s PRO 86 N 1.88 1.87 -0.50 0.43 0.04 -1.26 -1.82 135.00 135.64 2et1 s PRO 86 Ca 0.06 1.13 -0.46 0.00 0.04 0.00 0.00 61.00 61.77 2et1 s PRO 86 Cb -0.25 -1.86 -0.20 0.00 0.04 0.00 0.00 34.50 32.24 2et1 s PRO 86 CO 0.06 -1.90 1.78 -2.30 0.04 0.00 0.00 177.00 174.68 2et1 n PRO 87 N -3.69 0.01 -4.13 0.56 -0.02 -1.25 -4.70 135.00 121.77 2et1 n PRO 87 Ca 0.09 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.46 2et1 n PRO 87 Cb 0.53 -1.50 -0.08 0.00 -0.02 0.00 0.00 33.50 32.43 2et1 n PRO 87 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2et1 s HIS 88 N 4.01 0.91 0.01 6.00 -3.43 -0.20 -1.05 115.29 121.54 2et1 s HIS 88 Ca 1.10 -1.17 0.01 0.00 -0.80 0.00 0.00 55.06 54.20 2et1 s HIS 88 Cb -1.50 -0.30 -0.01 0.00 -1.43 0.00 0.00 32.58 29.35 2et1 s HIS 88 CO 0.77 -0.78 -0.04 0.42 -2.00 0.00 0.00 174.74 173.10 2et1 s ILE 89 N -4.05 0.30 -0.36 -5.38 1.01 -0.50 -1.57 121.20 110.65 2et1 s ILE 89 Ca 0.33 -0.41 -0.09 0.00 0.00 0.00 0.00 60.65 60.49 2et1 s ILE 89 Cb 0.04 -0.30 0.04 0.00 0.01 0.00 0.00 42.46 42.25 2et1 s ILE 89 CO 0.12 -0.08 0.17 -1.00 0.00 0.00 0.00 174.94 174.15 2et1 s HIS 90 N -0.48 3.26 0.48 3.97 3.76 -1.26 -0.77 115.29 124.25 2et1 s HIS 90 Ca -0.03 -1.22 0.34 0.00 -0.15 0.00 0.00 55.06 54.00 2et1 s HIS 90 Cb -0.04 -2.41 1.80 0.00 1.11 0.00 0.00 32.58 33.04 2et1 s HIS 90 CO -0.00 -0.70 2.19 -1.00 -0.85 0.00 0.00 174.74 174.37 2et1 h PRO 91 N 8.34 0.00 0.00 8.40 0.13 -1.72 -2.61 132.00 144.53 2et1 h PRO 91 Ca -0.24 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2et1 h PRO 91 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 2et1 h PRO 91 CO 0.65 0.05 -0.26 0.54 -0.23 0.00 0.00 178.00 178.74 2et1 n ARG 92 N -3.46 0.66 -3.52 0.86 1.74 -0.90 -4.75 116.66 107.29 2et1 n ARG 92 Ca -0.02 -1.84 -0.15 0.00 -0.77 0.00 0.00 57.85 55.07 2et1 n ARG 92 Cb 0.17 -1.01 -0.05 0.00 -1.02 0.00 0.00 32.46 30.55 2et1 n ARG 92 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2et1 s ALA 93 N -1.48 -1.79 0.39 7.54 0.00 -1.25 -4.65 121.76 120.51 2et1 s ALA 93 Ca 0.17 1.27 -0.23 0.00 0.00 0.00 0.00 51.96 53.16 2et1 s ALA 93 Cb 0.15 -0.04 -0.10 0.00 0.00 0.00 0.00 23.12 23.13 2et1 s ALA 93 CO 0.01 -0.42 0.96 0.99 0.00 0.00 0.00 175.76 177.29 2et1 s THR 94 N -1.61 4.26 -0.01 0.00 2.01 -1.26 -3.87 115.64 115.15 2et1 s THR 94 Ca -0.06 1.61 0.05 0.00 0.31 0.00 0.00 61.69 63.60 2et1 s THR 94 Cb -0.00 -3.77 -0.03 0.00 0.01 0.00 0.00 72.50 68.71 2et1 s THR 94 CO 0.04 -0.11 -0.17 -0.70 -0.69 0.00 0.00 174.62 172.99 2et1 s GLU 95 N -2.68 2.30 -0.08 4.92 2.12 -0.75 -2.62 118.70 121.91 2et1 s GLU 95 Ca 0.57 -0.83 -0.00 0.00 0.36 0.00 0.00 54.97 55.07 2et1 s GLU 95 Cb -0.14 -2.27 0.02 0.00 0.26 0.00 0.00 34.13 32.00 2et1 s GLU 95 CO 0.18 0.59 -0.05 -1.50 -0.54 0.00 0.00 175.26 173.94 2et1 s ILE 96 N -0.79 0.76 0.15 -3.70 2.07 -0.22 -0.87 121.20 118.59 2et1 s ILE 96 Ca 0.13 -0.16 0.06 0.00 -1.41 0.00 0.00 60.65 59.27 2et1 s ILE 96 Cb -0.10 -0.80 -0.04 0.00 0.13 0.00 0.00 42.46 41.64 2et1 s ILE 96 CO 0.02 0.31 -0.14 -0.83 -1.91 0.00 0.00 174.94 172.39 2et1 s GLY 97 N 1.50 1.17 -0.04 1.50 0.00 -0.39 -0.74 107.32 110.33 2et1 s GLY 97 Ca -0.01 -1.41 0.02 0.00 0.00 0.00 0.00 44.72 43.32 2et1 s GLY 97 CO -0.04 -1.48 -0.08 -0.29 0.00 0.00 0.00 173.10 171.20 2et1 s MET 98 N -3.02 1.07 0.02 2.90 1.75 -0.68 -1.76 119.30 119.56 2et1 s MET 98 Ca 0.13 -0.27 -0.30 0.00 -1.25 0.00 0.00 55.69 54.01 2et1 s MET 98 Cb -0.03 -0.98 -0.03 0.00 2.84 0.00 0.00 34.83 36.63 2et1 s MET 98 CO 0.04 0.04 0.97 0.08 -0.65 0.00 0.00 175.02 175.50 2et1 s VAL 99 N 0.49 4.81 -0.19 10.11 1.01 -0.77 -1.83 120.40 134.02 2et1 s VAL 99 Ca -0.08 2.05 0.10 0.00 0.00 0.00 0.00 61.98 64.04 2et1 s VAL 99 Cb -0.12 -4.31 -0.22 0.00 0.00 0.00 0.00 36.38 31.73 2et1 s VAL 99 CO 0.01 0.19 0.09 0.23 0.00 0.00 0.00 175.10 175.62 2et1 n MET 100 N 3.70 0.68 -3.65 2.72 2.81 0.19 -0.58 117.12 122.99 2et1 n MET 100 Ca 0.05 0.11 -0.15 0.00 -1.81 0.00 0.00 57.70 55.90 2et1 n MET 100 Cb 0.51 -1.58 -0.08 0.00 -0.71 0.00 0.00 33.22 31.36 2et1 n MET 100 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 2et1 s LYS 101 N -2.52 0.82 0.70 0.03 -2.85 -1.07 -4.69 119.74 110.17 2et1 s LYS 101 Ca -0.18 0.20 0.00 0.00 -1.00 0.00 0.00 55.97 54.98 2et1 s LYS 101 Cb 0.07 0.38 0.00 0.00 -2.06 0.00 0.00 37.83 36.23 2et1 s LYS 101 CO 0.75 -0.22 0.00 0.41 0.10 0.00 0.00 175.35 176.39 2et1 n GLY 102 N 1.45 -1.81 2.82 0.59 0.00 -1.26 -1.58 105.19 105.40 2et1 n GLY 102 Ca -0.19 -1.72 -0.27 0.00 0.00 0.00 0.00 46.02 43.85 2et1 n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2et1 s GLU 103 N 0.00 1.05 -0.17 1.61 2.02 -1.26 -3.87 118.70 118.08 2et1 s GLU 103 Ca 0.00 -0.37 0.01 0.00 0.02 0.00 0.00 54.97 54.62 2et1 s GLU 103 Cb 0.00 -1.84 0.01 0.00 0.10 0.00 0.00 34.13 32.40 2et1 s GLU 103 CO 0.00 -0.47 -0.17 -0.51 0.02 0.00 0.00 175.26 174.13 2et1 s LEU 104 N 1.76 2.31 -0.16 1.80 1.43 -0.74 -1.92 118.68 123.16 2et1 s LEU 104 Ca 0.01 -0.56 -0.29 0.00 -1.03 0.00 0.00 54.13 52.26 2et1 s LEU 104 Cb -0.15 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 2et1 s LEU 104 CO -0.07 0.04 1.54 -0.22 0.23 0.00 0.00 176.35 177.87 2et1 s LEU 105 N 1.06 4.08 -0.18 1.79 2.96 0.05 -0.52 118.68 127.92 2et1 s LEU 105 Ca -0.01 1.80 -0.03 0.00 -0.22 0.00 0.00 54.13 55.68 2et1 s LEU 105 Cb -0.14 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.00 2et1 s LEU 105 CO -0.06 -1.04 -0.07 -0.69 -1.32 0.00 0.00 176.35 173.17 2et1 s VAL 106 N 4.45 3.38 -0.03 1.68 1.01 -0.50 -1.04 120.40 129.35 2et1 s VAL 106 Ca 0.68 -0.52 0.07 0.00 0.00 0.00 0.00 61.98 62.21 2et1 s VAL 106 Cb -0.26 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 2et1 s VAL 106 CO 0.26 0.47 -0.24 -0.83 0.00 0.00 0.00 175.10 174.75 2et1 s GLY 107 N 0.92 1.20 -0.05 4.51 0.00 -0.49 -2.09 107.32 111.33 2et1 s GLY 107 Ca -0.01 -1.03 0.03 0.00 0.00 0.00 0.00 44.72 43.70 2et1 s GLY 107 CO 0.01 -0.80 -0.12 -0.42 0.00 0.00 0.00 173.10 171.77 2et1 s ILE 108 N -0.46 1.08 -0.17 0.90 1.09 0.22 -1.53 121.20 122.33 2et1 s ILE 108 Ca 0.06 -0.47 -0.02 0.00 -1.10 0.00 0.00 60.65 59.11 2et1 s ILE 108 Cb -0.10 -0.98 -0.01 0.00 -1.06 0.00 0.00 42.46 40.31 2et1 s ILE 108 CO 0.00 0.34 -0.08 -0.76 -0.10 0.00 0.00 174.94 174.34 2et1 s LEU 109 N 0.49 2.89 0.82 2.97 1.43 -0.55 -1.10 118.68 125.62 2et1 s LEU 109 Ca -0.10 -0.32 -0.11 0.00 -1.03 0.00 0.00 54.13 52.57 2et1 s LEU 109 Cb -0.14 -1.69 0.08 0.00 0.03 0.00 0.00 46.19 44.47 2et1 s LEU 109 CO 0.03 0.09 1.10 -0.83 0.23 0.00 0.00 176.35 176.97 2et1 s GLY 110 N 0.80 1.67 0.63 -3.19 0.00 0.10 -4.19 107.32 103.14 2et1 s GLY 110 Ca -0.03 0.26 -0.11 0.00 0.00 0.00 0.00 44.72 44.85 2et1 s GLY 110 CO 0.01 0.65 0.76 -1.14 0.00 0.00 0.00 173.10 173.38 2et1 n SER 111 N -3.70 -0.42 -0.29 1.64 3.41 -1.26 -4.07 113.62 108.93 2et1 n SER 111 Ca 0.09 -1.18 0.01 0.00 -0.26 0.00 0.00 58.87 57.53 2et1 n SER 111 Cb 0.53 -0.61 0.14 0.00 -0.26 0.00 0.00 64.21 64.01 2et1 n SER 111 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2et1 h LEU 112 N 0.00 0.73 -0.06 1.04 5.85 -1.97 -1.03 115.31 119.86 2et1 h LEU 112 Ca -0.26 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.49 2et1 h LEU 112 Cb 0.73 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.64 2et1 h LEU 112 CO 0.18 0.45 0.00 0.47 -0.34 0.00 0.00 178.44 179.19 2et1 n ASP 113 N -4.70 0.15 -1.45 1.25 8.00 -1.26 -1.22 116.55 117.32 2et1 n ASP 113 Ca 0.12 0.52 0.07 0.00 0.71 0.00 0.00 54.79 56.21 2et1 n ASP 113 Cb 0.22 -0.56 0.30 0.00 -0.02 0.00 0.00 41.12 41.06 2et1 n ASP 113 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2et1 n SER 114 N -1.65 4.27 -1.84 -2.24 7.64 -0.60 -4.94 113.62 114.26 2et1 n SER 114 Ca 0.05 -2.51 -0.19 0.00 1.01 0.00 0.00 58.87 57.23 2et1 n SER 114 Cb 0.28 -0.57 -0.04 0.00 -1.01 0.00 0.00 64.21 62.86 2et1 n SER 114 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2et1 n GLY 115 N 0.79 0.68 4.12 0.23 0.00 -0.36 -2.74 105.19 107.90 2et1 n GLY 115 Ca 0.21 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2et1 n GLY 115 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2et1 n ASN 116 N -1.38 -2.82 -4.76 1.61 3.02 -0.49 -4.90 115.26 105.54 2et1 n ASN 116 Ca -0.21 -0.98 -0.41 0.00 -0.03 0.00 0.00 54.58 52.95 2et1 n ASN 116 Cb 0.65 -2.98 -0.03 0.00 -0.61 0.00 0.00 39.78 36.81 2et1 n ASN 116 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2et1 s LYS 117 N -6.81 4.42 -0.27 3.52 1.02 -1.11 -4.64 119.74 115.88 2et1 s LYS 117 Ca 0.56 2.11 -0.09 0.00 0.02 0.00 0.00 55.97 58.56 2et1 s LYS 117 Cb -0.30 -3.11 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 2et1 s LYS 117 CO 0.91 -0.11 0.13 -1.17 -0.92 0.00 0.00 175.35 174.19 2et1 s LEU 118 N -1.51 3.77 -0.22 3.17 2.96 -1.26 -0.72 118.68 124.86 2et1 s LEU 118 Ca 0.49 -0.20 -0.08 0.00 -0.22 0.00 0.00 54.13 54.12 2et1 s LEU 118 Cb -0.38 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 44.26 2et1 s LEU 118 CO 0.49 -0.07 0.10 -0.31 -1.32 0.00 0.00 176.35 175.23 2et1 s TYR 119 N 1.67 3.23 -0.05 5.38 1.51 -0.26 -4.97 117.35 123.85 2et1 s TYR 119 Ca 0.06 0.01 -0.09 0.00 -1.01 0.00 0.00 57.07 56.05 2et1 s TYR 119 Cb -0.16 -2.18 0.02 0.00 -0.11 0.00 0.00 41.96 39.53 2et1 s TYR 119 CO 0.07 0.00 0.21 -1.54 -1.11 0.00 0.00 175.55 173.18 2et1 s SER 120 N 0.90 -0.17 -0.08 2.29 1.04 -1.26 -0.61 113.70 115.80 2et1 s SER 120 Ca 0.05 0.25 -0.15 0.00 0.48 0.00 0.00 55.95 56.58 2et1 s SER 120 Cb -0.13 0.38 0.03 0.00 0.10 0.00 0.00 66.02 66.40 2et1 s SER 120 CO 0.03 -0.19 0.37 -0.60 0.98 0.00 0.00 173.24 173.82 2et1 s ARG 121 N -0.43 0.57 -0.18 4.02 3.52 -0.89 -4.98 118.95 120.59 2et1 s ARG 121 Ca -0.05 0.21 -0.29 0.00 -0.13 0.00 0.00 55.73 55.47 2et1 s ARG 121 Cb -0.03 0.27 -0.00 0.00 -1.56 0.00 0.00 34.95 33.62 2et1 s ARG 121 CO 0.01 -0.12 1.12 0.08 -0.81 0.00 0.00 175.30 175.58 2et1 s VAL 122 N -0.52 4.52 -0.16 7.11 1.01 -1.26 -1.41 120.40 129.68 2et1 s VAL 122 Ca -0.06 1.83 -0.03 0.00 0.00 0.00 0.00 61.98 63.72 2et1 s VAL 122 Cb -0.04 -4.18 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 2et1 s VAL 122 CO 0.03 -0.13 -0.05 -0.69 0.00 0.00 0.00 175.10 174.26 2et1 s VAL 123 N 3.07 3.68 0.52 2.92 1.01 0.32 -4.94 120.40 126.97 2et1 s VAL 123 Ca 0.49 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 62.06 2et1 s VAL 123 Cb -0.18 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.60 2et1 s VAL 123 CO 0.12 0.48 0.12 0.54 0.00 0.00 0.00 175.10 176.36 2et1 n ARG 124 N 3.77 0.75 -1.64 2.72 1.74 -1.26 -1.80 116.66 120.94 2et1 n ARG 124 Ca -0.18 -3.60 -0.50 0.00 -0.77 0.00 0.00 57.85 52.80 2et1 n ARG 124 Cb 0.52 0.80 -0.05 0.00 -1.02 0.00 0.00 32.46 32.71 2et1 n ARG 124 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2et1 n ALA 125 N -1.53 0.15 -0.10 7.54 0.00 -1.25 -1.39 120.51 123.92 2et1 n ALA 125 Ca -0.20 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2et1 n ALA 125 Cb 0.63 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.84 2et1 n ALA 125 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2et1 n GLY 126 N 3.26 1.94 3.88 0.00 0.00 0.25 -5.01 105.19 109.51 2et1 n GLY 126 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 2et1 n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2et1 s GLU 127 N -0.29 3.78 0.20 1.61 2.02 -0.49 -4.89 118.70 120.64 2et1 s GLU 127 Ca 0.00 0.38 0.07 0.00 0.02 0.00 0.00 54.97 55.44 2et1 s GLU 127 Cb 0.00 -2.47 -0.05 0.00 0.10 0.00 0.00 34.13 31.71 2et1 s GLU 127 CO 0.00 0.08 -0.14 0.95 0.02 0.00 0.00 175.26 176.17 2et1 s THR 128 N -2.20 1.68 0.09 3.63 -4.23 -1.26 -1.86 115.64 111.48 2et1 s THR 128 Ca 0.50 -2.19 -0.08 0.00 -1.18 0.00 0.00 61.69 58.74 2et1 s THR 128 Cb -0.10 -2.04 -0.01 0.00 1.34 0.00 0.00 72.50 71.68 2et1 s THR 128 CO 0.28 -0.60 0.16 0.72 -0.54 0.00 0.00 174.62 174.65 2et1 s PHE 129 N -3.01 0.22 -0.03 3.99 -0.12 -0.72 -5.00 117.98 113.31 2et1 s PHE 129 Ca 0.22 -0.67 0.03 0.00 -0.05 0.00 0.00 56.93 56.46 2et1 s PHE 129 Cb -0.00 -0.11 0.00 0.00 -0.63 0.00 0.00 43.02 42.28 2et1 s PHE 129 CO 0.06 -0.53 -0.10 0.54 -0.05 0.00 0.00 175.22 175.14 2et1 s VAL 130 N -3.88 0.89 -0.31 -2.49 0.11 -1.26 -1.26 120.40 112.21 2et1 s VAL 130 Ca 0.06 -0.43 0.01 0.00 -2.93 0.00 0.00 61.98 58.69 2et1 s VAL 130 Cb 0.05 -0.78 0.07 0.00 -1.53 0.00 0.00 36.38 34.19 2et1 s VAL 130 CO -0.10 0.27 -0.01 -0.63 -3.33 0.00 0.00 175.10 171.30 2et1 s ILE 131 N 0.12 2.57 0.58 7.04 -1.09 -0.05 -5.01 121.20 125.36 2et1 s ILE 131 Ca -0.02 -1.76 -0.20 0.00 -2.23 0.00 0.00 60.65 56.44 2et1 s ILE 131 Cb -0.09 -2.61 -0.04 0.00 -1.58 0.00 0.00 42.46 38.14 2et1 s ILE 131 CO 0.01 -0.25 1.20 -2.65 -1.23 0.00 0.00 174.94 172.02 2et1 n PRO 132 N 4.47 1.29 -1.60 2.79 -0.02 -1.26 -1.81 135.00 138.86 2et1 n PRO 132 Ca -0.09 0.48 -0.53 0.00 -2.02 0.00 0.00 63.50 61.35 2et1 n PRO 132 Cb 0.42 -2.41 -0.06 0.00 -0.02 0.00 0.00 33.50 31.43 2et1 n PRO 132 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2et1 n ARG 133 N -1.16 1.03 -0.95 -0.52 1.85 -1.26 -2.62 116.66 113.02 2et1 n ARG 133 Ca 0.13 0.37 0.00 0.00 -1.00 0.00 0.00 57.85 57.35 2et1 n ARG 133 Cb 0.46 -2.00 0.00 0.00 -1.05 0.00 0.00 32.46 29.87 2et1 n ARG 133 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2et1 n GLY 134 N 2.60 0.91 3.83 2.89 0.00 -0.98 -4.96 105.19 109.47 2et1 n GLY 134 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2et1 n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2et1 s LEU 135 N 0.00 4.32 0.30 0.99 1.43 -1.08 -4.76 118.68 119.88 2et1 s LEU 135 Ca 0.00 1.29 -0.29 0.00 -1.03 0.00 0.00 54.13 54.10 2et1 s LEU 135 Cb 0.00 -3.52 -0.10 0.00 0.03 0.00 0.00 46.19 42.60 2et1 s LEU 135 CO 0.00 0.04 1.30 -0.32 0.23 0.00 0.00 176.35 177.60 2et1 s MET 136 N -2.06 4.37 0.20 1.70 -2.45 -1.26 -4.56 119.30 115.25 2et1 s MET 136 Ca 0.42 2.17 -0.19 0.00 -1.25 0.00 0.00 55.69 56.84 2et1 s MET 136 Cb -0.16 -3.10 0.04 0.00 1.25 0.00 0.00 34.83 32.86 2et1 s MET 136 CO 0.20 -0.19 0.56 -3.38 1.05 0.00 0.00 175.02 173.27 2et1 s HIS 137 N -0.85 -0.22 0.19 4.11 -3.43 -0.61 -1.47 115.29 113.00 2et1 s HIS 137 Ca 0.51 -0.11 -0.16 0.00 -0.80 0.00 0.00 55.06 54.50 2et1 s HIS 137 Cb -0.39 0.47 0.02 0.00 -1.43 0.00 0.00 32.58 31.25 2et1 s HIS 137 CO 0.49 -0.94 0.48 -0.59 -2.00 0.00 0.00 174.74 172.18 2et1 s PHE 138 N -3.85 -0.02 0.04 0.38 -0.12 -0.58 -1.04 117.98 112.78 2et1 s PHE 138 Ca 0.07 -0.33 0.03 0.00 -0.05 0.00 0.00 56.93 56.65 2et1 s PHE 138 Cb -0.02 0.31 -0.02 0.00 -0.63 0.00 0.00 43.02 42.66 2et1 s PHE 138 CO -0.04 -0.88 -0.09 -0.65 -0.05 0.00 0.00 175.22 173.51 2et1 s GLN 139 N -3.89 0.57 -0.07 1.99 1.11 -0.76 -1.39 119.66 117.22 2et1 s GLN 139 Ca 0.11 -0.69 -0.03 0.00 0.01 0.00 0.00 55.36 54.76 2et1 s GLN 139 Cb -0.00 -0.41 0.04 0.00 -1.01 0.00 0.00 33.01 31.63 2et1 s GLN 139 CO -0.02 0.09 0.14 0.12 0.01 0.00 0.00 175.29 175.62 2et1 s PHE 140 N -1.14 -0.14 -0.55 0.91 5.36 -0.21 -1.31 117.98 120.90 2et1 s PHE 140 Ca -0.06 0.50 -0.28 0.00 -0.96 0.00 0.00 56.93 56.13 2et1 s PHE 140 Cb -0.09 -0.21 0.02 0.00 -0.34 0.00 0.00 43.02 42.41 2et1 s PHE 140 CO 0.01 -0.21 1.31 1.21 -1.46 0.00 0.00 175.22 176.07 2et1 s ASN 141 N 1.77 6.31 0.00 6.13 3.84 -0.14 -0.77 114.94 132.07 2et1 s ASN 141 Ca -0.02 0.26 0.25 0.00 0.21 0.00 0.00 52.86 53.55 2et1 s ASN 141 Cb -0.12 -2.55 0.44 0.00 -0.55 0.00 0.00 41.25 38.47 2et1 s ASN 141 CO -0.05 -1.57 1.38 1.33 -2.79 0.00 0.00 177.10 175.40 2et1 n VAL 142 N 6.79 0.00 -2.28 -5.21 0.24 -0.81 -2.22 118.33 114.85 2et1 n VAL 142 Ca 0.11 -0.29 -0.26 0.00 -2.04 0.00 0.00 64.34 61.85 2et1 n VAL 142 Cb 0.49 0.97 0.14 0.00 -1.47 0.00 0.00 33.84 33.97 2et1 n VAL 142 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2et1 s GLY 143 N -2.25 1.76 0.00 7.63 0.00 -1.21 -4.99 107.32 108.25 2et1 s GLY 143 Ca 0.27 -1.42 0.24 0.00 0.00 0.00 0.00 44.72 43.80 2et1 s GLY 143 CO 0.44 -0.79 1.22 0.28 0.00 0.00 0.00 173.10 174.24 2et1 n LYS 144 N -3.22 0.78 -4.19 2.90 5.02 -1.26 -4.46 118.16 113.72 2et1 n LYS 144 Ca 0.14 -0.59 -0.24 0.00 -2.02 0.00 0.00 58.31 55.61 2et1 n LYS 144 Cb 0.60 -1.49 -0.07 0.00 -0.02 0.00 0.00 35.03 34.05 2et1 n LYS 144 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2et1 s THR 145 N -2.63 2.67 0.29 -0.18 -4.23 -1.26 -4.81 115.64 105.49 2et1 s THR 145 Ca 0.18 -1.79 -0.30 0.00 -1.18 0.00 0.00 61.69 58.60 2et1 s THR 145 Cb 0.18 -2.92 -0.11 0.00 1.34 0.00 0.00 72.50 70.98 2et1 s THR 145 CO 0.62 -0.13 1.57 -0.70 -0.54 0.00 0.00 174.62 175.44 2et1 s GLU 146 N -3.82 4.14 0.19 3.99 2.12 -1.26 -4.27 118.70 119.78 2et1 s GLU 146 Ca 0.38 2.55 0.09 0.00 0.36 0.00 0.00 54.97 58.34 2et1 s GLU 146 Cb 0.00 -3.03 -0.04 0.00 0.26 0.00 0.00 34.13 31.32 2et1 s GLU 146 CO 0.22 -0.60 -0.08 0.00 -0.54 0.00 0.00 175.26 174.25 2et1 s ALA 147 N -0.06 2.99 0.04 6.30 0.00 -0.67 -4.45 121.76 125.92 2et1 s ALA 147 Ca 0.62 -1.48 -0.15 0.00 0.00 0.00 0.00 51.96 50.95 2et1 s ALA 147 Cb -0.47 -0.76 0.02 0.00 0.00 0.00 0.00 23.12 21.91 2et1 s ALA 147 CO 0.48 0.45 0.32 1.52 0.00 0.00 0.00 175.76 178.53 2et1 s TYR 148 N -1.77 -0.14 0.07 0.00 -0.85 -0.61 -0.62 117.35 113.42 2et1 s TYR 148 Ca 0.26 0.03 0.00 0.00 -0.52 0.00 0.00 57.07 56.84 2et1 s TYR 148 Cb -0.09 0.12 -0.04 0.00 0.38 0.00 0.00 41.96 42.34 2et1 s TYR 148 CO 0.16 -0.51 -0.05 0.00 -1.52 0.00 0.00 175.55 173.63 2et1 s MET 149 N -2.49 0.67 -0.07 -3.49 0.23 -0.65 -0.64 119.30 112.86 2et1 s MET 149 Ca -0.05 -1.20 0.03 0.00 -1.03 0.00 0.00 55.69 53.44 2et1 s MET 149 Cb -0.01 0.02 0.01 0.00 -1.53 0.00 0.00 34.83 33.31 2et1 s MET 149 CO -0.03 -0.06 -0.18 0.08 -2.03 0.00 0.00 175.02 172.80 2et1 s VAL 150 N -3.51 1.54 0.04 5.16 1.01 -0.76 -1.37 120.40 122.52 2et1 s VAL 150 Ca 0.06 -0.73 0.06 0.00 0.00 0.00 0.00 61.98 61.38 2et1 s VAL 150 Cb 0.05 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 2et1 s VAL 150 CO -0.07 0.44 -0.17 0.68 0.00 0.00 0.00 175.10 175.98 2et1 s VAL 151 N 0.43 1.37 0.24 2.92 -7.23 -0.37 -1.69 120.40 116.06 2et1 s VAL 151 Ca -0.14 -1.12 0.12 0.00 -1.81 0.00 0.00 61.98 59.03 2et1 s VAL 151 Cb -0.16 -1.22 -0.05 0.00 0.56 0.00 0.00 36.38 35.51 2et1 s VAL 151 CO 0.05 0.08 -0.22 -0.44 -0.31 0.00 0.00 175.10 174.27 2et1 s SER 152 N -1.21 3.50 0.06 4.85 0.01 0.08 -1.05 113.70 119.95 2et1 s SER 152 Ca 0.04 -0.95 0.04 0.00 1.31 0.00 0.00 55.95 56.39 2et1 s SER 152 Cb -0.08 -0.28 -0.03 0.00 0.21 0.00 0.00 66.02 65.84 2et1 s SER 152 CO 0.02 0.08 -0.11 -0.36 0.41 0.00 0.00 173.24 173.27 2et1 s PHE 153 N -2.10 0.99 -0.18 2.43 0.40 -0.34 -1.05 117.98 118.12 2et1 s PHE 153 Ca 0.25 -0.46 -0.01 0.00 -0.60 0.00 0.00 56.93 56.12 2et1 s PHE 153 Cb -0.06 -0.57 0.13 0.00 0.51 0.00 0.00 43.02 43.02 2et1 s PHE 153 CO 0.12 -0.00 2.00 0.27 0.70 0.00 0.00 175.22 178.31 2et1 n ASN 154 N 1.45 5.97 -3.78 1.36 2.04 -1.08 -2.75 115.26 118.47 2et1 n ASN 154 Ca -0.21 -2.79 -0.13 0.00 -0.44 0.00 0.00 54.58 51.01 2et1 n ASN 154 Cb 0.54 -1.08 -0.09 0.00 -2.53 0.00 0.00 39.78 36.62 2et1 n ASN 154 CO 0.00 0.00 0.00 -0.55 -0.44 0.00 0.00 177.26 176.27 2et1 s SER 155 N 0.93 -0.17 0.24 0.53 0.15 -1.06 -4.37 113.70 109.96 2et1 s SER 155 Ca 0.18 0.10 0.24 0.00 0.70 0.00 0.00 55.95 57.17 2et1 s SER 155 Cb 0.14 0.33 0.95 0.00 -1.71 0.00 0.00 66.02 65.73 2et1 s SER 155 CO -0.00 -0.39 1.72 0.00 1.20 0.00 0.00 173.24 175.77 2et1 n GLN 156 N 1.53 0.20 -2.89 5.44 10.64 -1.25 -2.52 117.38 128.53 2et1 n GLN 156 Ca -0.21 0.38 -0.11 0.00 -1.83 0.00 0.00 57.00 55.23 2et1 n GLN 156 Cb 0.56 -1.85 0.00 0.00 -0.86 0.00 0.00 30.24 28.09 2et1 n GLN 156 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 2et1 n ASN 157 N -2.21 -2.39 0.23 2.61 4.05 -1.26 -1.79 115.26 114.50 2et1 n ASN 157 Ca 0.03 -2.97 0.06 0.00 0.45 0.00 0.00 54.58 52.15 2et1 n ASN 157 Cb 0.26 1.18 0.55 0.00 1.23 0.00 0.00 39.78 43.00 2et1 n ASN 157 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2et1 h PRO 158 N 4.56 0.00 0.00 1.20 0.13 -1.88 -3.46 132.00 132.56 2et1 h PRO 158 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2et1 h PRO 158 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2et1 h PRO 158 CO 0.24 0.14 0.00 0.41 -0.23 0.00 0.00 178.00 178.56 2et1 n GLY 159 N -1.12 -2.34 2.88 1.56 0.00 -1.26 -2.12 105.19 102.79 2et1 n GLY 159 Ca -0.03 -1.34 -0.26 0.00 0.00 0.00 0.00 46.02 44.39 2et1 n GLY 159 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2et1 s ILE 160 N -3.81 0.90 -0.55 -0.61 1.01 -1.26 -4.29 121.20 112.58 2et1 s ILE 160 Ca 0.00 -0.24 -0.12 0.00 0.00 0.00 0.00 60.65 60.29 2et1 s ILE 160 Cb 0.00 -0.97 0.14 0.00 0.01 0.00 0.00 42.46 41.64 2et1 s ILE 160 CO 0.00 0.32 0.46 -0.69 0.00 0.00 0.00 174.94 175.03 2et1 s VAL 161 N 1.76 4.71 -0.24 2.92 1.01 0.05 -4.98 120.40 125.63 2et1 s VAL 161 Ca 0.05 -1.86 -0.29 0.00 0.00 0.00 0.00 61.98 59.87 2et1 s VAL 161 Cb -0.13 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.22 2et1 s VAL 161 CO -0.08 -0.85 1.13 -0.36 0.00 0.00 0.00 175.10 174.94 2et1 s PHE 162 N 1.18 3.11 0.02 5.22 0.40 -1.26 -1.40 117.98 125.25 2et1 s PHE 162 Ca 0.07 1.24 -0.25 0.00 -0.60 0.00 0.00 56.93 57.39 2et1 s PHE 162 Cb -0.25 -3.47 -0.18 0.00 0.51 0.00 0.00 43.02 39.63 2et1 s PHE 162 CO -0.01 -0.98 1.41 0.28 0.70 0.00 0.00 175.22 176.62 2et1 h VAL 163 N 5.56 1.10 -0.29 -0.44 2.07 -1.40 -1.23 116.25 121.61 2et1 h VAL 163 Ca -0.22 -0.66 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 2et1 h VAL 163 Cb 1.07 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 2et1 h VAL 163 CO 0.99 0.16 0.17 -0.65 0.02 0.00 0.00 177.57 178.26 2et1 h PRO 164 N -0.41 0.40 -0.52 1.57 0.11 -1.94 -0.83 132.00 130.38 2et1 h PRO 164 Ca -0.01 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.00 2et1 h PRO 164 Cb 0.35 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.35 2et1 h PRO 164 CO 0.02 0.33 0.09 1.25 -0.21 0.00 0.00 178.00 179.48 2et1 h LEU 165 N 0.37 0.77 -0.18 2.35 5.85 -1.94 -1.69 115.31 120.84 2et1 h LEU 165 Ca 0.10 -0.15 -0.14 0.00 0.84 0.00 0.00 57.88 58.54 2et1 h LEU 165 Cb 0.03 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.86 2et1 h LEU 165 CO -0.02 0.78 -0.43 0.74 -0.34 0.00 0.00 178.44 179.17 2et1 h THR 166 N 0.78 1.33 -0.86 1.05 2.02 -1.09 0.58 112.91 116.74 2et1 h THR 166 Ca 0.17 -1.68 -0.03 0.00 0.77 0.00 0.00 66.41 65.64 2et1 h THR 166 Cb 0.34 1.94 -0.04 0.00 -1.74 0.00 0.00 68.15 68.65 2et1 h THR 166 CO 0.00 0.52 0.43 -0.07 0.37 0.00 0.00 175.52 176.77 2et1 h LEU 167 N 0.27 1.11 0.00 2.58 3.38 -0.98 -3.29 115.31 118.37 2et1 h LEU 167 Ca -0.00 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2et1 h LEU 167 Cb 1.04 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.51 2et1 h LEU 167 CO 0.09 0.92 -0.81 0.49 0.09 0.00 0.00 178.44 179.22 2et1 n PHE 168 N -4.31 0.00 -2.47 1.13 3.01 -0.65 -4.56 117.46 109.61 2et1 n PHE 168 Ca 0.09 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.58 2et1 n PHE 168 Cb 0.13 -0.08 0.04 0.00 -0.01 0.00 0.00 39.48 39.56 2et1 n PHE 168 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2et1 n GLY 169 N 1.59 1.49 3.65 1.37 0.00 0.19 -4.58 105.19 108.90 2et1 n GLY 169 Ca 0.00 -0.94 -0.29 0.00 0.00 0.00 0.00 46.02 44.80 2et1 n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2et1 s SER 170 N -2.35 2.26 -0.36 1.61 1.04 -1.15 -4.84 113.70 109.91 2et1 s SER 170 Ca 0.34 1.15 0.02 0.00 0.48 0.00 0.00 55.95 57.93 2et1 s SER 170 Cb 0.38 -1.80 0.10 0.00 0.10 0.00 0.00 66.02 64.80 2et1 s SER 170 CO -0.14 -3.35 0.10 -1.81 0.98 0.00 0.00 173.24 169.02 2et1 s ASP 171 N -3.41 4.91 0.87 7.02 1.01 -1.26 -1.71 116.67 124.10 2et1 s ASP 171 Ca 0.66 -2.14 -0.13 0.00 0.71 0.00 0.00 52.55 51.65 2et1 s ASP 171 Cb -0.19 -1.69 0.13 0.00 1.01 0.00 0.00 42.92 42.18 2et1 s ASP 171 CO 0.58 -0.43 1.24 -2.16 0.21 0.00 0.00 175.17 174.61 2et1 s PRO 172 N 0.95 1.42 0.61 8.23 0.04 -1.26 -5.11 135.00 139.88 2et1 s PRO 172 Ca 0.10 -0.12 -0.18 0.00 0.04 0.00 0.00 61.00 60.85 2et1 s PRO 172 Cb -0.20 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 2et1 s PRO 172 CO -0.07 -1.93 1.18 -2.14 0.04 0.00 0.00 177.00 174.08 2et1 s PRO 173 N -5.70 2.91 0.25 0.56 0.02 -0.70 -4.98 135.00 127.36 2et1 s PRO 173 Ca 0.67 1.72 -0.31 0.00 0.02 0.00 0.00 61.00 63.10 2et1 s PRO 173 Cb -0.08 -1.93 -0.13 0.00 0.02 0.00 0.00 34.50 32.38 2et1 s PRO 173 CO 0.51 -1.23 1.55 -0.89 -0.33 0.00 0.00 177.00 176.60 2et1 n ILE 174 N -1.79 0.74 -1.70 2.83 5.41 -1.26 -4.92 119.36 118.66 2et1 n ILE 174 Ca 0.13 -0.18 -0.42 0.00 1.00 0.00 0.00 62.75 63.27 2et1 n ILE 174 Cb 0.50 -1.75 -0.01 0.00 -0.71 0.00 0.00 39.64 37.67 2et1 n ILE 174 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2et1 n PRO 175 N 2.51 2.16 -0.19 0.38 -0.02 -1.26 -4.85 135.00 133.74 2et1 n PRO 175 Ca 0.12 0.76 -0.00 0.00 -2.02 0.00 0.00 63.50 62.35 2et1 n PRO 175 Cb 0.34 -2.35 0.09 0.00 -0.02 0.00 0.00 33.50 31.55 2et1 n PRO 175 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2et1 h THR 176 N 2.60 0.58 -0.14 3.45 2.02 -2.00 -1.70 112.91 117.73 2et1 h THR 176 Ca -0.46 -0.06 0.04 0.00 0.77 0.00 0.00 66.41 66.70 2et1 h THR 176 Cb 1.28 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2et1 h THR 176 CO 0.63 0.03 0.11 -0.65 0.37 0.00 0.00 175.52 176.01 2et1 h PRO 177 N 0.17 0.00 -0.22 6.66 0.11 -1.99 0.16 132.00 136.88 2et1 h PRO 177 Ca 0.30 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.35 2et1 h PRO 177 Cb 0.46 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 2et1 h PRO 177 CO -0.45 0.00 -0.08 0.28 -0.21 0.00 0.00 178.00 177.55 2et1 h VAL 178 N 0.00 1.29 -0.17 3.15 2.07 -1.68 -2.93 116.25 117.99 2et1 h VAL 178 Ca 0.06 -1.10 -0.12 0.00 0.82 0.00 0.00 66.70 66.36 2et1 h VAL 178 Cb 0.28 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 2et1 h VAL 178 CO -0.00 0.34 -0.40 -0.07 0.02 0.00 0.00 177.57 177.46 2et1 h LEU 179 N 0.16 0.39 -0.74 2.57 3.38 -0.90 -1.71 115.31 118.47 2et1 h LEU 179 Ca 0.05 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.77 2et1 h LEU 179 Cb 0.55 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2et1 h LEU 179 CO 0.03 0.76 0.01 0.71 0.09 0.00 0.00 178.44 180.03 2et1 h THR 180 N 0.31 1.26 -0.32 0.22 1.35 -0.79 0.63 112.91 115.57 2et1 h THR 180 Ca 0.03 -1.10 -0.10 0.00 -0.55 0.00 0.00 66.41 64.69 2et1 h THR 180 Cb 0.84 0.82 -0.01 0.00 -1.73 0.00 0.00 68.15 68.07 2et1 h THR 180 CO 0.07 0.40 -0.20 0.50 -0.25 0.00 0.00 175.52 176.04 2et1 h LYS 181 N 0.89 0.70 -0.21 4.72 1.63 -1.41 -1.86 116.57 121.03 2et1 h LYS 181 Ca 0.16 -0.32 -0.15 0.00 -0.85 0.00 0.00 60.65 59.49 2et1 h LYS 181 Cb 0.51 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.13 2et1 h LYS 181 CO 0.03 0.93 -0.50 0.00 -3.45 0.00 0.00 179.45 176.45 2et1 h ALA 182 N 0.76 0.74 0.00 5.00 0.00 -1.17 -3.30 119.26 121.29 2et1 h ALA 182 Ca 0.07 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2et1 h ALA 182 Cb 0.74 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2et1 h ALA 182 CO 0.05 0.68 -0.91 1.28 0.00 0.00 0.00 179.25 180.35 2et1 n LEU 183 N -3.98 0.80 -1.80 0.00 4.77 0.20 -4.99 117.00 112.00 2et1 n LEU 183 Ca -0.03 -0.31 -0.16 0.00 -0.03 0.00 0.00 56.01 55.49 2et1 n LEU 183 Cb 0.58 -0.07 -0.01 0.00 -2.33 0.00 0.00 43.42 41.59 2et1 n LEU 183 CO 0.46 0.19 -0.19 0.54 -1.33 0.00 0.00 177.39 177.06 2et1 n ARG 184 N -1.57 -1.32 -4.33 3.23 1.74 -0.70 -5.01 116.66 108.69 2et1 n ARG 184 Ca 0.04 0.75 -0.17 0.00 -0.77 0.00 0.00 57.85 57.70 2et1 n ARG 184 Cb 0.35 -5.12 -0.10 0.00 -1.02 0.00 0.00 32.46 26.56 2et1 n ARG 184 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2et1 s VAL 185 N -2.79 1.25 0.73 1.55 -7.23 -1.22 -5.08 120.40 107.61 2et1 s VAL 185 Ca 0.01 -2.07 -0.11 0.00 -1.81 0.00 0.00 61.98 57.99 2et1 s VAL 185 Cb -0.00 -2.21 0.03 0.00 0.56 0.00 0.00 36.38 34.76 2et1 s VAL 185 CO 0.01 -0.45 1.08 -1.83 -0.31 0.00 0.00 175.10 173.60 2et1 s GLU 186 N -3.79 2.57 0.28 4.82 -1.05 -1.26 -4.59 118.70 115.68 2et1 s GLU 186 Ca 0.25 1.10 0.02 0.00 -0.15 0.00 0.00 54.97 56.19 2et1 s GLU 186 Cb 0.04 -1.94 0.64 0.00 -0.44 0.00 0.00 34.13 32.44 2et1 s GLU 186 CO 0.07 -1.40 1.73 0.00 0.95 0.00 0.00 175.26 176.61 2et1 h ALA 187 N -0.87 1.39 -1.01 -0.84 0.00 -1.96 -1.85 119.26 114.12 2et1 h ALA 187 Ca -0.44 0.12 0.12 0.00 0.00 0.00 0.00 54.91 54.71 2et1 h ALA 187 Cb 1.22 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.99 2et1 h ALA 187 CO 0.54 -0.21 0.64 0.78 0.00 0.00 0.00 179.25 180.99 2et1 h GLY 188 N 0.53 1.64 0.86 0.00 0.00 -1.99 0.81 103.07 104.91 2et1 h GLY 188 Ca 0.52 -0.43 -0.05 0.00 0.00 0.00 0.00 47.33 47.36 2et1 h GLY 188 CO -0.44 0.17 -0.05 -2.08 0.00 0.00 0.00 176.54 174.14 2et1 h VAL 189 N 1.01 1.28 -0.34 4.60 2.07 -1.71 -1.65 116.25 121.51 2et1 h VAL 189 Ca 0.49 -1.04 0.01 0.00 0.82 0.00 0.00 66.70 66.98 2et1 h VAL 189 Cb 0.47 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 2et1 h VAL 189 CO -0.26 0.33 0.21 0.58 0.02 0.00 0.00 177.57 178.45 2et1 h VAL 190 N 0.25 1.05 -0.62 2.57 2.07 -1.24 -2.12 116.25 118.21 2et1 h VAL 190 Ca 0.07 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 2et1 h VAL 190 Cb 0.51 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 2et1 h VAL 190 CO 0.02 0.08 0.25 -0.33 0.02 0.00 0.00 177.57 177.61 2et1 h GLU 191 N 0.42 0.90 -0.29 1.57 4.39 -0.81 -0.86 114.58 119.89 2et1 h GLU 191 Ca 0.13 -0.14 0.02 0.00 0.34 0.00 0.00 59.36 59.72 2et1 h GLU 191 Cb -0.01 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 2et1 h GLU 191 CO -0.05 0.73 0.13 1.25 -1.16 0.00 0.00 179.01 179.91 2et1 h LEU 192 N 0.89 0.18 -0.41 1.33 5.85 -1.05 -1.86 115.31 120.24 2et1 h LEU 192 Ca 0.21 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 2et1 h LEU 192 Cb 0.16 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2et1 h LEU 192 CO -0.02 0.14 0.24 -0.07 -0.34 0.00 0.00 178.44 178.38 2et1 h LEU 193 N 0.28 0.50 -1.23 2.25 3.38 -0.89 -2.69 115.31 116.90 2et1 h LEU 193 Ca 0.13 -0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.09 2et1 h LEU 193 Cb 0.06 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 2et1 h LEU 193 CO -0.10 0.42 0.55 0.11 0.09 0.00 0.00 178.44 179.51 2et1 h LYS 194 N 0.53 0.90 0.00 1.13 1.57 -1.06 -2.29 116.57 117.35 2et1 h LYS 194 Ca 0.15 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 2et1 h LYS 194 Cb 0.02 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.13 2et1 h LYS 194 CO -0.03 0.60 -0.05 0.66 -0.57 0.00 0.00 179.45 180.07 2et1 h SER 195 N 0.93 0.00 1.46 0.86 4.64 -0.99 -1.84 113.55 118.62 2et1 h SER 195 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2et1 h SER 195 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2et1 h SER 195 CO -0.13 0.05 -0.15 0.11 -0.87 0.00 0.00 176.83 175.84 2et1 h LYS 196 N 0.00 0.00 -0.03 4.77 1.79 -1.40 -3.33 116.57 118.37 2et1 h LYS 196 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2et1 h LYS 196 Cb 0.16 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 2et1 h LYS 196 CO 0.01 0.00 0.00 1.19 -1.08 0.00 0.00 179.45 179.57 2et1 n PHE 197 N -2.43 0.04 0.24 -1.35 3.01 -0.73 -4.74 117.46 111.51 2et1 n PHE 197 Ca 0.05 -0.49 0.08 0.00 1.01 0.00 0.00 57.45 58.10 2et1 n PHE 197 Cb 0.46 -0.05 0.62 0.00 -0.01 0.00 0.00 39.48 40.50 2et1 n PHE 197 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2et1 h ALA 198 N 0.17 1.60 0.00 4.37 0.00 -1.58 -2.86 119.26 120.97 2et1 h ALA 198 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2et1 h ALA 198 Cb 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2et1 h ALA 198 CO 0.00 0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.82 2et1 n GLY 199 N -1.01 -1.22 0.46 0.00 0.00 -1.26 -4.92 105.19 97.24 2et1 n GLY 199 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2et1 n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2et1 n GLY 200 N 0.59 0.63 0.00 -0.02 0.00 -1.08 -5.26 105.19 100.05 2et1 n GLY 200 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2et1 n GLY 200 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18