#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2okq s ASN -7 N 0.00 2.54 0.45 4.31 3.84 -1.26 -5.03 114.94 119.78 2okq s ASN -7 Ca 0.00 -0.71 0.22 0.00 0.21 0.00 0.00 52.86 52.58 2okq s ASN -7 Cb 0.00 -0.31 1.06 0.00 -0.55 0.00 0.00 41.25 41.45 2okq s ASN -7 CO 0.00 -0.35 1.92 -0.07 -2.79 0.00 0.00 177.10 175.80 2okq h LEU -6 N 8.39 0.00 -0.22 3.21 3.38 -2.05 -0.78 115.31 127.24 2okq h LEU -6 Ca -0.16 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 2okq h LEU -6 Cb 1.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 2okq h LEU -6 CO 0.31 0.24 -0.06 0.22 0.09 0.00 0.00 178.44 179.23 2okq h TYR -5 N 0.00 0.49 -0.34 1.13 3.20 -1.99 -1.50 116.97 117.96 2okq h TYR -5 Ca -0.00 -0.11 -0.02 0.00 3.14 0.00 0.00 58.73 61.74 2okq h TYR -5 Cb 0.58 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 2okq h TYR -5 CO 0.00 0.68 0.14 0.35 -1.64 0.00 0.00 178.16 177.69 2okq h PHE -4 N 0.16 0.50 -0.92 -3.82 3.57 -1.88 -2.54 116.94 112.01 2okq h PHE -4 Ca 0.05 -0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.59 2okq h PHE -4 Cb 0.52 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 39.05 2okq h PHE -4 CO 0.05 0.46 0.59 1.96 -2.23 0.00 0.00 178.31 179.15 2okq h GLN -3 N 0.40 1.00 0.00 1.11 4.20 -1.07 0.93 115.11 121.67 2okq h GLN -3 Ca 0.11 -0.06 -0.22 0.00 0.06 0.00 0.00 58.65 58.55 2okq h GLN -3 Cb 0.16 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 2okq h GLN -3 CO -0.01 0.66 -1.07 1.03 -0.67 0.00 0.00 178.83 178.77 2okq h SER -2 N 1.03 0.00 0.00 1.46 0.87 -1.23 -3.40 113.55 112.27 2okq h SER -2 Ca 0.40 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.96 2okq h SER -2 Cb 0.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 2okq h SER -2 CO -0.15 0.98 -1.12 0.59 -0.53 0.00 0.00 176.83 176.60 2okq n ASN -1 N -3.31 2.74 -0.14 6.23 3.02 -0.96 -4.77 115.26 118.07 2okq n ASN -1 Ca -0.02 -0.14 -0.08 0.00 -0.03 0.00 0.00 54.58 54.31 2okq n ASN -1 Cb 0.94 1.26 0.07 0.00 -0.61 0.00 0.00 39.78 41.44 2okq n ASN -1 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2okq h ALA 0 N 0.72 0.88 -2.55 5.41 0.00 -1.04 -3.44 119.26 119.24 2okq h ALA 0 Ca 0.00 -0.33 -0.51 0.00 0.00 0.00 0.00 54.91 54.06 2okq h ALA 0 Cb 0.29 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2okq h ALA 0 CO 0.00 0.64 0.15 -1.64 0.00 0.00 0.00 179.25 178.40 2okq s MET 1 N -4.83 4.34 0.38 0.00 -1.94 -1.26 -5.05 119.30 110.93 2okq s MET 1 Ca -0.10 0.97 0.03 0.00 -1.71 0.00 0.00 55.69 54.88 2okq s MET 1 Cb 0.13 -2.92 -0.01 0.00 2.01 0.00 0.00 34.83 34.04 2okq s MET 1 CO 0.84 0.41 0.56 0.15 -0.01 0.00 0.00 175.02 176.96 2okq s LYS 2 N -1.87 3.15 -0.10 2.03 1.02 -1.26 -4.74 119.74 117.97 2okq s LYS 2 Ca 0.43 -0.71 -0.01 0.00 0.02 0.00 0.00 55.97 55.70 2okq s LYS 2 Cb -0.18 -2.70 -0.03 0.00 -0.52 0.00 0.00 37.83 34.40 2okq s LYS 2 CO 0.22 -0.05 -0.03 -0.47 -0.92 0.00 0.00 175.35 174.11 2okq s TYR 3 N -2.34 3.07 -0.10 3.18 5.04 0.51 -1.36 117.35 125.36 2okq s TYR 3 Ca 0.45 0.04 0.02 0.00 -2.44 0.00 0.00 57.07 55.14 2okq s TYR 3 Cb -0.10 -1.80 0.01 0.00 0.35 0.00 0.00 41.96 40.42 2okq s TYR 3 CO 0.34 0.32 -0.14 0.08 -1.34 0.00 0.00 175.55 174.81 2okq s VAL 4 N -0.59 1.40 -0.27 3.14 1.01 0.34 -0.25 120.40 125.18 2okq s VAL 4 Ca 0.09 -0.60 -0.19 0.00 0.00 0.00 0.00 61.98 61.29 2okq s VAL 4 Cb -0.12 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.95 2okq s VAL 4 CO 0.02 0.42 0.55 -1.81 0.00 0.00 0.00 175.10 174.28 2okq s ASP 5 N 0.92 6.46 -0.05 3.32 1.11 -0.49 -0.30 116.67 127.64 2okq s ASP 5 Ca -0.09 0.51 -0.02 0.00 0.18 0.00 0.00 52.55 53.14 2okq s ASP 5 Cb -0.15 -2.29 -0.04 0.00 1.07 0.00 0.00 42.92 41.51 2okq s ASP 5 CO -0.00 -0.33 0.08 -0.83 1.18 0.00 0.00 175.17 175.27 2okq s GLY 6 N 1.55 2.01 -0.03 0.21 0.00 -0.01 -1.08 107.32 109.98 2okq s GLY 6 Ca 0.22 -0.80 0.01 0.00 0.00 0.00 0.00 44.72 44.16 2okq s GLY 6 CO 0.09 -0.61 -0.04 -1.36 0.00 0.00 0.00 173.10 171.18 2okq s PHE 7 N -1.08 0.55 -0.06 1.90 0.08 -0.02 -1.91 117.98 117.44 2okq s PHE 7 Ca 0.19 -0.11 0.02 0.00 0.12 0.00 0.00 56.93 57.15 2okq s PHE 7 Cb -0.12 -0.48 0.01 0.00 -0.57 0.00 0.00 43.02 41.87 2okq s PHE 7 CO 0.09 -0.11 -0.12 0.08 -0.10 0.00 0.00 175.22 175.06 2okq s VAL 8 N 0.56 1.08 -0.01 -0.44 1.01 -0.36 -1.04 120.40 121.20 2okq s VAL 8 Ca -0.07 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.47 2okq s VAL 8 Cb -0.10 -0.98 -0.00 0.00 0.00 0.00 0.00 36.38 35.30 2okq s VAL 8 CO -0.00 0.34 -0.05 -0.69 0.00 0.00 0.00 175.10 174.70 2okq s VAL 9 N 0.57 0.39 -0.23 2.92 1.01 -0.45 -0.50 120.40 124.11 2okq s VAL 9 Ca -0.12 -0.20 -0.19 0.00 0.00 0.00 0.00 61.98 61.47 2okq s VAL 9 Cb -0.15 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.87 2okq s VAL 9 CO 0.03 0.11 0.54 0.00 0.00 0.00 0.00 175.10 175.78 2okq s ALA 10 N -0.06 3.57 -0.06 5.51 0.00 -1.26 -0.39 121.76 129.08 2okq s ALA 10 Ca 0.01 -0.47 0.03 0.00 0.00 0.00 0.00 51.96 51.54 2okq s ALA 10 Cb -0.03 -2.88 0.00 0.00 0.00 0.00 0.00 23.12 20.22 2okq s ALA 10 CO -0.00 -0.61 -0.15 0.08 0.00 0.00 0.00 175.76 175.08 2okq s VAL 11 N 2.01 1.30 0.16 0.00 1.01 -0.24 -3.63 120.40 121.02 2okq s VAL 11 Ca 0.24 -0.61 -0.34 0.00 0.00 0.00 0.00 61.98 61.27 2okq s VAL 11 Cb -0.16 -1.15 -0.14 0.00 0.00 0.00 0.00 36.38 34.94 2okq s VAL 11 CO 0.09 0.38 1.54 -2.65 0.00 0.00 0.00 175.10 174.47 2okq n PRO 12 N 3.47 2.06 0.07 2.72 -0.02 -1.26 0.08 135.00 142.12 2okq n PRO 12 Ca -0.20 0.74 0.14 0.00 -2.02 0.00 0.00 63.50 62.16 2okq n PRO 12 Cb 0.53 -2.49 0.62 0.00 -0.02 0.00 0.00 33.50 32.13 2okq n PRO 12 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2okq h ALA 13 N 5.66 2.19 -0.00 3.55 0.00 -1.26 0.01 119.26 129.41 2okq h ALA 13 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2okq h ALA 13 Cb 1.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2okq h ALA 13 CO 0.87 -0.28 -0.00 -0.40 0.00 0.00 0.00 179.25 179.43 2okq n ASP 14 N -4.46 0.04 -1.18 0.00 5.68 -1.26 -3.50 116.55 111.88 2okq n ASP 14 Ca 0.05 -0.73 0.08 0.00 -0.50 0.00 0.00 54.79 53.69 2okq n ASP 14 Cb 0.36 -0.09 0.30 0.00 -1.14 0.00 0.00 41.12 40.55 2okq n ASP 14 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2okq n LYS 15 N -1.06 3.49 -0.08 0.11 4.76 -0.01 -4.73 118.16 120.63 2okq n LYS 15 Ca 0.21 -2.89 -0.07 0.00 -2.87 0.00 0.00 58.31 52.69 2okq n LYS 15 Cb 0.16 -1.93 -0.00 0.00 -1.84 0.00 0.00 35.03 31.42 2okq n LYS 15 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 2okq h LYS 16 N 2.52 0.18 -0.64 1.97 3.64 -1.68 0.14 116.57 122.71 2okq h LYS 16 Ca 0.00 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 2okq h LYS 16 Cb 1.54 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.30 2okq h LYS 16 CO 0.28 0.12 0.04 -0.44 -2.27 0.00 0.00 179.45 177.18 2okq h ASP 17 N 0.19 1.07 -0.57 4.20 3.32 -1.90 0.85 116.42 123.57 2okq h ASP 17 Ca 0.13 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 2okq h ASP 17 Cb 0.13 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 2okq h ASP 17 CO -0.16 1.09 0.32 0.00 -1.72 0.00 0.00 179.24 178.76 2okq h ALA 18 N 1.02 0.74 -0.14 3.45 0.00 -1.78 0.17 119.26 122.70 2okq h ALA 18 Ca 0.19 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2okq h ALA 18 Cb 0.52 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2okq h ALA 18 CO 0.02 0.25 0.01 -0.92 0.00 0.00 0.00 179.25 178.62 2okq h TYR 19 N 0.77 0.27 -0.66 0.00 3.20 -0.41 -1.60 116.97 118.54 2okq h TYR 19 Ca 0.20 -0.04 0.08 0.00 3.14 0.00 0.00 58.73 62.11 2okq h TYR 19 Cb 0.05 -0.07 -0.07 0.00 1.54 0.00 0.00 36.73 38.18 2okq h TYR 19 CO -0.01 0.45 0.32 -0.09 -1.64 0.00 0.00 178.16 177.19 2okq h ARG 20 N 0.01 0.55 -0.04 1.82 2.43 -0.66 -1.94 114.38 116.55 2okq h ARG 20 Ca 0.04 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.04 2okq h ARG 20 Cb 0.34 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2okq h ARG 20 CO 0.01 0.36 -0.60 1.05 -1.51 0.00 0.00 179.97 179.28 2okq h GLU 21 N 0.57 0.12 0.00 0.20 4.11 -0.77 -0.60 114.58 118.21 2okq h GLU 21 Ca 0.32 -0.08 -0.11 0.00 0.07 0.00 0.00 59.36 59.56 2okq h GLU 21 Cb 0.31 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2okq h GLU 21 CO -0.25 0.68 -0.50 0.52 0.07 0.00 0.00 179.01 179.53 2okq h MET 22 N 0.09 0.00 -0.09 1.06 2.86 -1.10 -2.11 114.93 115.64 2okq h MET 22 Ca -0.01 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.48 2okq h MET 22 Cb 1.08 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.75 2okq h MET 22 CO 0.09 0.50 -0.56 0.00 1.06 0.00 0.00 176.91 178.00 2okq h ALA 23 N 1.50 0.18 -0.92 6.32 0.00 -1.13 -2.59 119.26 122.63 2okq h ALA 23 Ca -0.01 -0.53 0.13 0.00 0.00 0.00 0.00 54.91 54.51 2okq h ALA 23 Cb 1.02 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.73 2okq h ALA 23 CO 0.07 0.41 0.59 0.00 0.00 0.00 0.00 179.25 180.31 2okq h ALA 24 N 0.45 1.74 -0.19 0.00 0.00 -1.06 0.33 119.26 120.54 2okq h ALA 24 Ca -0.05 0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 2okq h ALA 24 Cb 1.21 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2okq h ALA 24 CO 0.11 0.03 -0.68 0.87 0.00 0.00 0.00 179.25 179.58 2okq h LYS 25 N 0.78 0.73 -0.07 0.00 1.57 -1.39 -3.28 116.57 114.92 2okq h LYS 25 Ca 0.46 -0.54 -0.19 0.00 -1.87 0.00 0.00 60.65 58.51 2okq h LYS 25 Cb 0.63 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 2okq h LYS 25 CO -0.22 1.16 -0.76 0.00 -0.57 0.00 0.00 179.45 179.07 2okq h ALA 26 N 0.70 0.56 -0.47 3.86 0.00 -1.01 -3.36 119.26 119.55 2okq h ALA 26 Ca -0.02 -0.62 0.09 0.00 0.00 0.00 0.00 54.91 54.36 2okq h ALA 26 Cb 1.28 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 2okq h ALA 26 CO 0.14 0.77 -0.22 0.00 0.00 0.00 0.00 179.25 179.94 2okq h ALA 27 N 0.91 0.11 -0.63 0.00 0.00 -1.01 -1.35 119.26 117.30 2okq h ALA 27 Ca -0.04 0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.12 2okq h ALA 27 Cb 1.34 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 19.63 2okq h ALA 27 CO 0.13 -0.57 0.42 -1.35 0.00 0.00 0.00 179.25 177.88 2okq h PRO 28 N -0.12 0.48 -0.11 0.00 0.11 -1.74 -1.07 132.00 129.55 2okq h PRO 28 Ca 0.22 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.22 2okq h PRO 28 Cb 0.46 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.46 2okq h PRO 28 CO -0.54 0.32 -0.26 1.25 -0.21 0.00 0.00 178.00 178.56 2okq h LEU 29 N 0.50 0.42 -0.81 2.35 5.85 -1.46 -1.10 115.31 121.05 2okq h LEU 29 Ca 0.29 -0.58 0.02 0.00 0.84 0.00 0.00 57.88 58.45 2okq h LEU 29 Cb 0.47 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 2okq h LEU 29 CO -0.09 0.92 0.53 -0.26 -0.34 0.00 0.00 178.44 179.20 2okq h PHE 30 N -0.06 1.00 -0.59 1.25 0.04 -0.94 -1.25 116.94 116.39 2okq h PHE 30 Ca -0.00 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.74 2okq h PHE 30 Cb 0.86 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 38.66 2okq h PHE 30 CO 0.11 0.60 0.16 0.87 -0.60 0.00 0.00 178.31 179.45 2okq h LYS 31 N 1.06 0.94 -0.66 1.51 1.57 -1.15 0.01 116.57 119.85 2okq h LYS 31 Ca 0.31 -0.22 0.09 0.00 -1.87 0.00 0.00 60.65 58.96 2okq h LYS 31 Cb -0.06 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.08 2okq h LYS 31 CO -0.09 0.86 0.44 1.49 -0.57 0.00 0.00 179.45 181.58 2okq h GLU 32 N 0.85 0.54 -0.01 3.15 4.81 -0.74 -1.13 114.58 122.06 2okq h GLU 32 Ca 0.19 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 2okq h GLU 32 Cb 0.33 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.59 2okq h GLU 32 CO -0.00 0.36 -0.03 1.19 -0.73 0.00 0.00 179.01 179.79 2okq n PHE 33 N -4.48 0.00 0.00 0.92 3.72 -0.51 -4.90 117.46 112.21 2okq n PHE 33 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 2okq n PHE 33 Cb 0.32 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.83 2okq n PHE 33 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2okq n GLY 34 N 1.15 1.20 3.76 1.37 0.00 -0.43 -4.31 105.19 107.93 2okq n GLY 34 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 2okq n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2okq s ALA 35 N -1.97 2.97 -0.01 4.61 0.00 -0.08 -4.58 121.76 122.70 2okq s ALA 35 Ca 0.00 1.19 0.09 0.00 0.00 0.00 0.00 51.96 53.24 2okq s ALA 35 Cb 0.00 -3.49 -0.23 0.00 0.00 0.00 0.00 23.12 19.39 2okq s ALA 35 CO 0.00 -1.04 0.79 -0.07 0.00 0.00 0.00 175.76 175.44 2okq h LEU 36 N 1.90 0.06 -7.00 0.00 3.38 -0.64 -3.40 115.31 109.60 2okq h LEU 36 Ca -0.50 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.39 2okq h LEU 36 Cb 1.27 -0.02 -0.23 0.00 0.09 0.00 0.00 40.66 41.77 2okq h LEU 36 CO 0.59 1.09 0.37 -0.60 0.09 0.00 0.00 178.44 179.98 2okq s ARG 37 N -2.62 0.70 -0.08 1.13 3.52 -1.21 -4.98 118.95 115.41 2okq s ARG 37 Ca -0.05 0.48 0.02 0.00 -0.13 0.00 0.00 55.73 56.06 2okq s ARG 37 Cb 0.08 0.33 0.01 0.00 -1.56 0.00 0.00 34.95 33.82 2okq s ARG 37 CO 0.82 -0.15 -0.12 -1.50 -0.81 0.00 0.00 175.30 173.54 2okq s ILE 38 N -0.38 1.20 -0.05 4.11 2.07 -1.26 -1.16 121.20 125.73 2okq s ILE 38 Ca -0.01 -0.50 0.03 0.00 -1.41 0.00 0.00 60.65 58.76 2okq s ILE 38 Cb -0.03 -1.11 0.01 0.00 0.13 0.00 0.00 42.46 41.46 2okq s ILE 38 CO 0.00 0.38 -0.14 -0.69 -1.91 0.00 0.00 174.94 172.58 2okq s VAL 39 N 0.82 1.19 -0.08 4.00 1.01 -0.13 -5.01 120.40 122.19 2okq s VAL 39 Ca -0.11 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.34 2okq s VAL 39 Cb -0.15 -1.05 0.01 0.00 0.00 0.00 0.00 36.38 35.19 2okq s VAL 39 CO 0.02 0.36 -0.13 -1.61 0.00 0.00 0.00 175.10 173.74 2okq s GLU 40 N 0.34 1.84 -0.02 2.72 0.41 -1.26 -1.39 118.70 121.34 2okq s GLU 40 Ca -0.09 -0.44 0.06 0.00 -0.41 0.00 0.00 54.97 54.09 2okq s GLU 40 Cb -0.13 -1.56 -0.01 0.00 -1.78 0.00 0.00 34.13 30.65 2okq s GLU 40 CO 0.03 -0.01 -0.18 0.00 -0.49 0.00 0.00 175.26 174.60 2okq s TRP 42 N -0.40 3.16 -0.01 0.00 -0.11 -1.26 -0.86 118.94 119.47 2okq s TRP 42 Ca 0.06 0.07 -0.39 0.00 1.22 0.00 0.00 56.10 57.06 2okq s TRP 42 Cb -0.07 -1.89 -0.19 0.00 -1.50 0.00 0.00 33.47 29.82 2okq s TRP 42 CO -0.00 0.31 1.19 0.00 -4.62 0.00 0.00 176.95 173.83 2okq n ALA 43 N 2.71 -2.65 0.00 5.86 0.00 -0.26 -4.89 120.51 121.28 2okq n ALA 43 Ca -0.18 0.57 0.00 0.00 0.00 0.00 0.00 53.44 53.83 2okq n ALA 43 Cb 0.53 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.11 2okq n ALA 43 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2okq n SER 44 N 2.02 0.24 -3.48 0.00 2.88 -1.26 -4.97 113.62 109.06 2okq n SER 44 Ca 0.20 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.46 2okq n SER 44 Cb 0.11 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.46 2okq n SER 44 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2okq s ASP 45 N -4.91 2.37 -0.38 -3.46 2.15 -1.26 -5.08 116.67 106.10 2okq s ASP 45 Ca 0.00 -2.77 -0.01 0.00 0.43 0.00 0.00 52.55 50.20 2okq s ASP 45 Cb 0.00 -0.55 0.10 0.00 -0.30 0.00 0.00 42.92 42.17 2okq s ASP 45 CO 0.00 -0.22 0.15 -0.69 -0.17 0.00 0.00 175.17 174.24 2okq s VAL 46 N 0.35 3.07 0.50 1.11 1.01 -1.26 -5.09 120.40 120.08 2okq s VAL 46 Ca 0.26 -2.02 -0.21 0.00 0.00 0.00 0.00 61.98 60.01 2okq s VAL 46 Cb -0.09 -3.08 -0.07 0.00 0.00 0.00 0.00 36.38 33.14 2okq s VAL 46 CO -0.11 -0.59 1.12 -2.16 0.00 0.00 0.00 175.10 173.36 2okq s PRO 47 N 1.11 3.59 0.27 2.72 0.04 -1.26 -5.01 135.00 136.47 2okq s PRO 47 Ca 0.07 1.62 -0.20 0.00 0.04 0.00 0.00 61.00 62.53 2okq s PRO 47 Cb -0.22 -2.17 -0.09 0.00 0.04 0.00 0.00 34.50 32.06 2okq s PRO 47 CO -0.04 -0.65 0.77 -0.51 0.04 0.00 0.00 177.00 176.61 2okq s ASP 48 N -1.66 7.04 0.35 6.66 1.01 -1.26 -4.57 116.67 124.24 2okq s ASP 48 Ca 0.68 1.47 0.03 0.00 0.71 0.00 0.00 52.55 55.45 2okq s ASP 48 Cb -0.24 -2.44 -0.05 0.00 1.01 0.00 0.00 42.92 41.20 2okq s ASP 48 CO 0.28 -0.05 0.09 -0.83 0.21 0.00 0.00 175.17 174.87 2okq s GLY 49 N -1.79 2.23 -0.19 0.21 0.00 -1.26 -5.06 107.32 101.46 2okq s GLY 49 Ca 0.47 -1.73 0.15 0.00 0.00 0.00 0.00 44.72 43.61 2okq s GLY 49 CO 0.20 -1.80 0.04 0.58 0.00 0.00 0.00 173.10 172.12 2okq n LYS 50 N -0.74 0.93 -0.04 2.90 2.85 -1.26 -4.71 118.16 118.08 2okq n LYS 50 Ca -0.03 0.00 -0.02 0.00 -1.05 0.00 0.00 58.31 57.21 2okq n LYS 50 Cb 0.66 -1.48 -0.01 0.00 -0.65 0.00 0.00 35.03 33.56 2okq n LYS 50 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 2okq h VAL 51 N 0.00 0.00 -3.67 0.58 2.07 -2.05 -3.49 116.25 109.69 2okq h VAL 51 Ca -0.51 -0.75 -0.10 0.00 0.82 0.00 0.00 66.70 66.16 2okq h VAL 51 Cb 2.12 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 31.72 2okq h VAL 51 CO 0.02 0.00 -0.40 0.42 0.02 0.00 0.00 177.57 177.63 2okq s THR 52 N -1.66 0.12 0.21 2.57 -4.23 -1.26 -5.12 115.64 106.27 2okq s THR 52 Ca -0.05 -1.02 -0.22 0.00 -1.18 0.00 0.00 61.69 59.22 2okq s THR 52 Cb 0.01 -1.06 0.06 0.00 1.34 0.00 0.00 72.50 72.85 2okq s THR 52 CO 0.08 -0.56 0.93 1.51 -0.54 0.00 0.00 174.62 176.04 2okq s ASP 53 N -2.35 -0.12 0.42 3.99 1.47 -1.26 -4.33 116.67 114.49 2okq s ASP 53 Ca -0.02 -0.60 0.10 0.00 1.18 0.00 0.00 52.55 53.21 2okq s ASP 53 Cb 0.01 0.57 0.90 0.00 -0.34 0.00 0.00 42.92 44.06 2okq s ASP 53 CO -0.06 -1.09 2.02 -0.26 0.68 0.00 0.00 175.17 176.45 2okq h PHE 54 N 2.00 0.32 -0.34 2.11 -1.00 -1.96 -1.35 116.94 116.72 2okq h PHE 54 Ca -0.25 -0.01 -0.13 0.00 2.81 0.00 0.00 57.97 60.38 2okq h PHE 54 Cb 1.23 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 40.69 2okq h PHE 54 CO 0.77 0.29 -0.30 0.00 -1.61 0.00 0.00 178.31 177.45 2okq h ARG 55 N 0.32 0.81 -0.11 1.51 3.08 -1.95 -3.05 114.38 115.00 2okq h ARG 55 Ca 0.08 -0.41 -0.08 0.00 0.07 0.00 0.00 59.98 59.64 2okq h ARG 55 Cb 0.13 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2okq h ARG 55 CO -0.00 1.05 -0.28 0.52 -1.07 0.00 0.00 179.97 180.19 2okq h MET 56 N 0.60 0.20 -0.63 0.04 2.86 -1.85 0.19 114.93 116.34 2okq h MET 56 Ca 0.06 -0.07 0.04 0.00 -2.06 0.00 0.00 59.70 57.67 2okq h MET 56 Cb 0.88 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.49 2okq h MET 56 CO 0.08 0.47 0.42 0.00 1.06 0.00 0.00 176.91 178.93 2okq h ALA 57 N 1.54 1.68 -0.16 6.32 0.00 -1.14 -1.56 119.26 125.94 2okq h ALA 57 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2okq h ALA 57 Cb 0.59 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2okq h ALA 57 CO 0.04 0.25 0.00 1.33 0.00 0.00 0.00 179.25 180.87 2okq n VAL 58 N -4.46 1.97 -4.15 0.00 0.24 -1.12 -4.84 118.33 105.98 2okq n VAL 58 Ca 0.08 -1.90 -0.34 0.00 -2.04 0.00 0.00 64.34 60.14 2okq n VAL 58 Cb 0.15 -0.15 -0.05 0.00 -1.47 0.00 0.00 33.84 32.32 2okq n VAL 58 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2okq n LYS 59 N -0.76 -1.30 -2.04 7.34 5.02 -0.56 -4.68 118.16 121.18 2okq n LYS 59 Ca 0.17 0.18 -0.40 0.00 -2.02 0.00 0.00 58.31 56.24 2okq n LYS 59 Cb 0.73 -3.57 -0.01 0.00 -0.02 0.00 0.00 35.03 32.16 2okq n LYS 59 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2okq s ALA 60 N -4.04 3.41 0.40 7.82 0.00 0.55 -5.01 121.76 124.90 2okq s ALA 60 Ca 0.14 1.30 0.03 0.00 0.00 0.00 0.00 51.96 53.43 2okq s ALA 60 Cb -0.07 -3.50 -0.00 0.00 0.00 0.00 0.00 23.12 19.54 2okq s ALA 60 CO 0.96 -0.78 0.59 -1.21 0.00 0.00 0.00 175.76 175.32 2okq s GLU 61 N -2.02 3.07 0.43 0.00 0.41 -1.26 -4.91 118.70 114.41 2okq s GLU 61 Ca 0.53 -0.73 0.15 0.00 -0.41 0.00 0.00 54.97 54.51 2okq s GLU 61 Cb -0.40 -2.67 1.05 0.00 -1.78 0.00 0.00 34.13 30.33 2okq s GLU 61 CO 0.53 -0.14 1.94 0.93 -0.49 0.00 0.00 175.26 178.03 2okq h GLU 62 N 0.60 0.40 -0.25 1.61 4.39 -2.03 0.05 114.58 119.35 2okq h GLU 62 Ca -0.46 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.22 2okq h GLU 62 Cb 1.26 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 2okq h GLU 62 CO 0.55 0.26 0.00 0.27 -1.16 0.00 0.00 179.01 178.93 2okq n ASN 63 N -4.47 1.42 -4.48 1.42 6.94 -1.26 -4.92 115.26 109.91 2okq n ASN 63 Ca 0.13 -1.95 -0.26 0.00 -0.02 0.00 0.00 54.58 52.47 2okq n ASN 63 Cb 0.47 -0.17 -0.10 0.00 -2.36 0.00 0.00 39.78 37.62 2okq n ASN 63 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2okq s GLU 64 N -1.66 1.74 0.34 -3.83 2.02 0.00 -0.79 118.70 116.51 2okq s GLU 64 Ca 0.20 -1.51 0.09 0.00 0.02 0.00 0.00 54.97 53.77 2okq s GLU 64 Cb 0.10 -1.93 -0.06 0.00 0.10 0.00 0.00 34.13 32.34 2okq s GLU 64 CO 0.14 0.39 -0.09 -1.21 0.02 0.00 0.00 175.26 174.51 2okq s GLU 65 N -2.95 1.79 -0.14 1.61 0.41 0.11 -4.77 118.70 114.77 2okq s GLU 65 Ca 0.24 -1.93 -0.10 0.00 -0.41 0.00 0.00 54.97 52.78 2okq s GLU 65 Cb -0.07 -1.64 -0.05 0.00 -1.78 0.00 0.00 34.13 30.59 2okq s GLU 65 CO 0.13 0.12 0.18 0.08 -0.49 0.00 0.00 175.26 175.29 2okq s VAL 66 N -2.66 5.41 -0.12 2.63 1.01 -1.26 -1.08 120.40 124.33 2okq s VAL 66 Ca 0.32 0.31 -0.01 0.00 0.00 0.00 0.00 61.98 62.60 2okq s VAL 66 Cb 0.03 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 2okq s VAL 66 CO 0.16 0.53 -0.06 -0.69 0.00 0.00 0.00 175.10 175.04 2okq s VAL 67 N -0.42 3.70 -0.23 2.92 1.01 0.48 -1.10 120.40 126.75 2okq s VAL 67 Ca 0.14 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.64 2okq s VAL 67 Cb -0.12 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.69 2okq s VAL 67 CO 0.03 0.54 -0.04 0.12 0.00 0.00 0.00 175.10 175.75 2okq s PHE 68 N -0.09 2.98 0.03 5.22 5.36 -0.04 -1.33 117.98 130.11 2okq s PHE 68 Ca 0.01 -1.10 -0.00 0.00 -0.96 0.00 0.00 56.93 54.88 2okq s PHE 68 Cb -0.13 -2.10 -0.03 0.00 -0.34 0.00 0.00 43.02 40.42 2okq s PHE 68 CO 0.03 -0.60 -0.03 -1.12 -1.46 0.00 0.00 175.22 172.04 2okq s SER 69 N 1.44 0.35 0.19 6.13 0.01 -0.21 -0.61 113.70 121.00 2okq s SER 69 Ca 0.04 -0.70 -0.17 0.00 1.31 0.00 0.00 55.95 56.44 2okq s SER 69 Cb -0.15 0.14 0.03 0.00 0.21 0.00 0.00 66.02 66.25 2okq s SER 69 CO -0.04 -0.42 0.49 -1.66 0.41 0.00 0.00 173.24 172.03 2okq s TRP 70 N -2.43 -0.09 -0.06 2.43 -2.14 -0.49 -0.84 118.94 115.32 2okq s TRP 70 Ca -0.07 -0.25 0.01 0.00 2.66 0.00 0.00 56.10 58.46 2okq s TRP 70 Cb -0.03 0.35 0.02 0.00 -3.10 0.00 0.00 33.47 30.71 2okq s TRP 70 CO -0.04 -0.88 -0.07 0.42 -2.66 0.00 0.00 176.95 173.71 2okq s ILE 71 N -3.87 0.79 -0.10 0.66 1.01 -0.24 -0.96 121.20 118.49 2okq s ILE 71 Ca 0.09 -0.25 -0.09 0.00 0.00 0.00 0.00 60.65 60.40 2okq s ILE 71 Cb -0.00 -0.78 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 2okq s ILE 71 CO -0.04 0.29 0.21 -1.61 0.00 0.00 0.00 174.94 173.79 2okq s GLU 72 N 0.99 3.61 0.12 2.79 2.02 -0.31 -1.39 118.70 126.52 2okq s GLU 72 Ca -0.09 -0.00 0.03 0.00 0.02 0.00 0.00 54.97 54.92 2okq s GLU 72 Cb -0.15 -3.22 -0.04 0.00 0.10 0.00 0.00 34.13 30.83 2okq s GLU 72 CO 0.00 0.72 -0.08 0.71 0.02 0.00 0.00 175.26 176.62 2okq s TYR 73 N -0.92 1.06 0.42 1.61 2.02 0.65 0.13 117.35 122.33 2okq s TYR 73 Ca 0.17 -0.82 0.12 0.00 -0.37 0.00 0.00 57.07 56.16 2okq s TYR 73 Cb -0.13 -0.57 0.90 0.00 -0.40 0.00 0.00 41.96 41.75 2okq s TYR 73 CO 0.06 -0.04 1.96 -1.35 -1.57 0.00 0.00 175.55 174.62 2okq h PRO 74 N 2.95 0.14 -2.63 -1.71 0.11 -1.84 0.15 132.00 129.17 2okq h PRO 74 Ca -0.36 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 65.82 2okq h PRO 74 Cb 1.18 -0.02 -0.10 0.00 0.11 0.00 0.00 31.00 32.17 2okq h PRO 74 CO 0.63 0.28 0.37 -1.54 -0.21 0.00 0.00 178.00 177.52 2okq s SER 75 N -6.93 -0.31 0.37 -2.05 1.04 -1.26 -4.27 113.70 100.28 2okq s SER 75 Ca -0.05 -0.29 0.06 0.00 0.48 0.00 0.00 55.95 56.15 2okq s SER 75 Cb 0.16 0.55 0.75 0.00 0.10 0.00 0.00 66.02 67.58 2okq s SER 75 CO 0.71 -0.97 1.98 0.50 0.98 0.00 0.00 173.24 176.44 2okq h LYS 76 N 2.00 0.71 -0.55 4.02 3.64 -1.93 -1.63 116.57 122.83 2okq h LYS 76 Ca -0.24 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.06 2okq h LYS 76 Cb 1.25 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 2okq h LYS 76 CO 0.28 0.47 0.19 1.49 -2.27 0.00 0.00 179.45 179.62 2okq h GLU 77 N 0.73 0.84 -0.39 1.90 4.57 -1.99 0.21 114.58 120.45 2okq h GLU 77 Ca 0.28 -0.17 -0.06 0.00 -1.18 0.00 0.00 59.36 58.23 2okq h GLU 77 Cb 0.18 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 2okq h GLU 77 CO -0.09 0.76 -0.00 0.28 -1.18 0.00 0.00 179.01 178.78 2okq h VAL 78 N 0.76 1.26 -0.49 0.32 2.07 -1.87 -1.08 116.25 117.23 2okq h VAL 78 Ca 0.18 -1.01 0.09 0.00 0.82 0.00 0.00 66.70 66.77 2okq h VAL 78 Cb 0.25 1.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.08 2okq h VAL 78 CO -0.01 0.34 0.08 -0.09 0.02 0.00 0.00 177.57 177.91 2okq h ARG 79 N 0.52 0.20 -0.49 1.57 1.12 -1.02 0.54 114.38 116.81 2okq h ARG 79 Ca 0.11 -0.01 -0.04 0.00 -1.11 0.00 0.00 59.98 58.92 2okq h ARG 79 Cb 0.48 -0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.37 2okq h ARG 79 CO 0.02 0.13 0.13 -0.44 -3.11 0.00 0.00 179.97 176.71 2okq h ASP 80 N 0.20 0.74 -0.74 -3.80 3.32 -0.43 -0.84 116.42 114.87 2okq h ASP 80 Ca 0.25 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 2okq h ASP 80 Cb 0.34 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 2okq h ASP 80 CO -0.34 0.77 0.42 0.00 -1.72 0.00 0.00 179.24 178.37 2okq h ALA 81 N 1.00 0.95 -0.32 3.45 0.00 -0.79 -0.23 119.26 123.31 2okq h ALA 81 Ca 0.16 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2okq h ALA 81 Cb 0.31 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2okq h ALA 81 CO -0.00 0.44 0.01 0.00 0.00 0.00 0.00 179.25 179.70 2okq h ALA 82 N 1.22 0.43 -0.23 0.00 0.00 -0.62 -0.28 119.26 119.78 2okq h ALA 82 Ca 0.26 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 2okq h ALA 82 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2okq h ALA 82 CO -0.05 0.17 -0.36 -0.91 0.00 0.00 0.00 179.25 178.10 2okq h ASN 83 N 0.37 0.53 -0.50 0.00 2.35 -1.01 -1.83 115.58 115.48 2okq h ASN 83 Ca 0.09 -0.22 -0.11 0.00 -0.55 0.00 0.00 56.30 55.52 2okq h ASN 83 Cb 0.42 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 2okq h ASN 83 CO 0.01 0.85 -0.09 -0.61 -1.65 0.00 0.00 177.43 175.94 2okq h GLN 84 N 0.43 0.97 -0.55 0.81 4.15 -0.80 -0.49 115.11 119.63 2okq h GLN 84 Ca 0.04 -0.34 0.02 0.00 0.77 0.00 0.00 58.65 59.14 2okq h GLN 84 Cb 0.84 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.42 2okq h GLN 84 CO 0.07 1.01 0.34 0.87 -1.93 0.00 0.00 178.83 179.19 2okq h LYS 85 N 0.87 0.67 -0.66 1.69 1.57 -0.90 -0.10 116.57 119.71 2okq h LYS 85 Ca 0.14 -0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.95 2okq h LYS 85 Cb 0.64 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.75 2okq h LYS 85 CO 0.04 0.44 0.44 0.52 -0.57 0.00 0.00 179.45 180.32 2okq h MET 86 N 0.69 0.62 0.00 3.15 2.86 -0.76 -0.91 114.93 120.58 2okq h MET 86 Ca 0.21 -0.04 -0.17 0.00 -2.06 0.00 0.00 59.70 57.65 2okq h MET 86 Cb -0.02 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.48 2okq h MET 86 CO -0.08 0.41 -0.91 0.52 1.06 0.00 0.00 176.91 177.91 2okq h MET 87 N 0.64 0.00 0.00 1.72 2.86 -0.43 -3.38 114.93 116.34 2okq h MET 87 Ca 0.29 0.00 -0.36 0.00 -2.06 0.00 0.00 59.70 57.57 2okq h MET 87 Cb 0.31 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.90 2okq h MET 87 CO -0.09 0.67 -2.28 0.43 1.06 0.00 0.00 176.91 176.70 2okq n SER 88 N -3.22 0.37 -0.01 1.22 7.64 -0.11 -4.95 113.62 114.56 2okq n SER 88 Ca -0.02 0.06 -0.02 0.00 1.01 0.00 0.00 58.87 59.90 2okq n SER 88 Cb 0.86 0.66 -0.01 0.00 -1.01 0.00 0.00 64.21 64.71 2okq n SER 88 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2okq n ASP 89 N -2.86 0.92 0.00 6.43 2.03 -0.37 -5.09 116.55 117.61 2okq n ASP 89 Ca -0.32 0.14 0.00 0.00 0.52 0.00 0.00 54.79 55.13 2okq n ASP 89 Cb 1.12 -0.40 0.00 0.00 -0.72 0.00 0.00 41.12 41.13 2okq n ASP 89 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2okq n PRO 90 N -3.38 0.00 0.00 -0.67 -0.04 -1.26 -5.10 135.00 124.55 2okq n PRO 90 Ca -0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 2okq n PRO 90 Cb 0.14 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.60 2okq n PRO 90 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2okq n ARG 91 N 0.00 0.00 0.00 0.54 3.00 -1.26 -5.20 116.66 113.74 2okq n ARG 91 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 2okq n ARG 91 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2okq n ARG 91 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2okq n PRO 100 N 0.00 0.00 -3.51 5.56 -0.04 -1.26 -5.29 135.00 130.46 2okq n PRO 100 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 2okq n PRO 100 Cb 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.44 2okq n PRO 100 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2okq s PHE 101 N -1.75 -0.46 -0.68 0.54 -0.12 -1.26 -4.36 117.98 109.88 2okq s PHE 101 Ca 0.00 0.21 -0.22 0.00 -0.05 0.00 0.00 56.93 56.86 2okq s PHE 101 Cb 0.00 0.58 0.07 0.00 -0.63 0.00 0.00 43.02 43.04 2okq s PHE 101 CO 0.00 -0.91 0.98 0.34 -0.05 0.00 0.00 175.22 175.57 2okq s ASP 102 N -2.78 6.21 0.59 1.98 -1.08 -1.24 -4.93 116.67 115.42 2okq s ASP 102 Ca 0.03 -1.08 0.31 0.00 -0.52 0.00 0.00 52.55 51.29 2okq s ASP 102 Cb -0.02 -2.42 1.85 0.00 -1.46 0.00 0.00 42.92 40.87 2okq s ASP 102 CO -0.09 -1.41 2.25 1.23 0.52 0.00 0.00 175.17 177.66 2okq h GLY 103 N 11.29 0.00 1.37 2.66 0.00 -1.96 -2.59 103.07 113.84 2okq h GLY 103 Ca -0.25 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 46.78 2okq h GLY 103 CO 1.18 0.00 -1.43 1.70 0.00 0.00 0.00 176.54 177.99 2okq h LYS 104 N 0.00 0.31 0.00 4.80 3.64 -2.01 -3.31 116.57 120.00 2okq h LYS 104 Ca -0.00 -0.53 -0.06 0.00 -1.27 0.00 0.00 60.65 58.79 2okq h LYS 104 Cb 0.04 0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 2okq h LYS 104 CO 0.00 1.22 -0.28 0.00 -2.27 0.00 0.00 179.45 178.12 2okq h ARG 105 N 0.08 0.00 -6.47 1.90 3.08 -1.80 -3.44 114.38 107.73 2okq h ARG 105 Ca -0.21 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.24 2okq h ARG 105 Cb 2.03 0.00 0.12 0.00 0.08 0.00 0.00 29.97 32.20 2okq h ARG 105 CO 0.20 0.28 0.01 -0.12 -1.07 0.00 0.00 179.97 179.26 2okq n MET 106 N -3.28 1.14 -4.49 0.04 1.56 -1.04 -4.56 117.12 106.49 2okq n MET 106 Ca 0.01 0.40 -0.32 0.00 -0.27 0.00 0.00 57.70 57.53 2okq n MET 106 Cb 0.54 -1.79 -0.11 0.00 2.15 0.00 0.00 33.22 34.01 2okq n MET 106 CO 0.00 0.00 0.00 0.96 -0.73 0.00 0.00 175.97 176.20 2okq s ILE 107 N -1.19 3.42 -0.03 1.12 -4.36 0.34 -4.98 121.20 115.52 2okq s ILE 107 Ca 0.61 -0.92 -0.14 0.00 -0.26 0.00 0.00 60.65 59.95 2okq s ILE 107 Cb -0.65 -2.49 0.02 0.00 1.25 0.00 0.00 42.46 40.59 2okq s ILE 107 CO 0.59 0.35 0.30 -0.47 0.24 0.00 0.00 174.94 175.95 2okq s TYR 108 N -1.00 -0.20 -0.11 1.37 5.04 -1.26 -1.22 117.35 119.97 2okq s TYR 108 Ca 0.17 0.35 -0.32 0.00 -2.44 0.00 0.00 57.07 54.83 2okq s TYR 108 Cb -0.11 0.09 0.12 0.00 0.35 0.00 0.00 41.96 42.42 2okq s TYR 108 CO 0.08 -0.35 1.05 0.20 -1.34 0.00 0.00 175.55 175.19 2okq s GLY 109 N -1.07 -0.35 -0.08 8.97 0.00 -0.80 -5.00 107.32 108.98 2okq s GLY 109 Ca -0.11 1.47 -0.10 0.00 0.00 0.00 0.00 44.72 45.97 2okq s GLY 109 CO 0.03 0.54 0.25 -0.32 0.00 0.00 0.00 173.10 173.61 2okq s GLY 110 N -2.11 2.28 0.02 0.20 0.00 -1.26 -0.83 107.32 105.62 2okq s GLY 110 Ca 0.06 -0.47 0.01 0.00 0.00 0.00 0.00 44.72 44.32 2okq s GLY 110 CO -0.06 -0.11 -0.06 -1.36 0.00 0.00 0.00 173.10 171.52 2okq s PHE 111 N -0.89 0.48 -0.18 1.90 0.08 0.59 -5.00 117.98 114.97 2okq s PHE 111 Ca 0.18 -0.35 -0.13 0.00 0.12 0.00 0.00 56.93 56.75 2okq s PHE 111 Cb -0.14 -0.30 -0.05 0.00 -0.57 0.00 0.00 43.02 41.97 2okq s PHE 111 CO 0.07 -0.08 0.26 -1.21 -0.10 0.00 0.00 175.22 174.17 2okq s GLU 112 N -1.04 4.22 0.24 0.44 0.41 -1.26 -0.50 118.70 121.21 2okq s GLU 112 Ca -0.07 0.02 -0.30 0.00 -0.41 0.00 0.00 54.97 54.21 2okq s GLU 112 Cb -0.07 -3.45 -0.10 0.00 -1.78 0.00 0.00 34.13 28.74 2okq s GLU 112 CO -0.00 0.20 1.35 -1.54 -0.49 0.00 0.00 175.26 174.78 2okq s SER 113 N 0.56 6.80 -0.00 -0.19 1.04 -0.46 -4.88 113.70 116.56 2okq s SER 113 Ca 0.14 2.55 0.03 0.00 0.48 0.00 0.00 55.95 59.15 2okq s SER 113 Cb -0.13 -2.62 -0.05 0.00 0.10 0.00 0.00 66.02 63.32 2okq s SER 113 CO 0.03 -0.58 0.08 2.30 0.98 0.00 0.00 173.24 176.05 2okq n ILE 114 N 2.14 0.00 -4.34 -1.02 -5.35 -1.26 -4.70 119.36 104.83 2okq n ILE 114 Ca 0.05 -0.08 -0.20 0.00 -0.27 0.00 0.00 62.75 62.24 2okq n ILE 114 Cb 0.42 0.43 -0.16 0.00 -1.74 0.00 0.00 39.64 38.59 2okq n ILE 114 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2okq s ILE 115 N -2.23 0.74 -0.34 7.28 -1.09 -1.26 -5.11 121.20 119.19 2okq s ILE 115 Ca -0.01 -0.30 0.04 0.00 -2.23 0.00 0.00 60.65 58.14 2okq s ILE 115 Cb 0.02 -0.68 0.16 0.00 -1.58 0.00 0.00 42.46 40.38 2okq s ILE 115 CO 0.14 0.25 0.45 -0.62 -1.23 0.00 0.00 174.94 173.93 2okq s ASP 116 N 0.43 0.20 0.00 3.58 -1.08 -1.26 -5.08 116.67 113.45 2okq s ASP 116 Ca -0.07 -0.83 0.00 0.00 -0.52 0.00 0.00 52.55 51.14 2okq s ASP 116 Cb -0.11 1.13 0.00 0.00 -1.46 0.00 0.00 42.92 42.48 2okq s ASP 116 CO 0.01 -0.29 0.32 -0.62 0.52 0.00 0.00 175.17 175.11