#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r8y s ALA 9 N 0.00 3.47 0.17 1.47 0.00 -1.26 0.02 121.76 125.63 2r8y s ALA 9 Ca 0.00 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 51.85 2r8y s ALA 9 Cb 0.00 -2.87 -0.05 0.00 0.00 0.00 0.00 23.12 20.20 2r8y s ALA 9 CO 0.00 -0.28 -0.05 0.95 0.00 0.00 0.00 175.76 176.39 2r8y s THR 10 N 1.25 0.97 -0.98 0.00 -4.23 -1.17 -4.96 115.64 106.52 2r8y s THR 10 Ca 0.30 -2.02 0.11 0.00 -1.18 0.00 0.00 61.69 58.90 2r8y s THR 10 Cb -0.16 -2.03 0.09 0.00 1.34 0.00 0.00 72.50 71.74 2r8y s THR 10 CO 0.12 -0.58 1.34 0.00 -0.54 0.00 0.00 174.62 174.97 2r8y n TYR 12 N -1.52 0.00 0.00 0.00 4.02 -1.26 -5.09 117.16 113.31 2r8y n TYR 12 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 2r8y n TYR 12 Cb 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.44 2r8y n TYR 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2r8y n GLY 13 N 1.27 3.00 3.75 2.72 0.00 -0.63 -4.93 105.19 110.37 2r8y n GLY 13 Ca 0.07 -1.93 -0.38 0.00 0.00 0.00 0.00 46.02 43.78 2r8y n GLY 13 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2r8y s PRO 14 N -2.14 3.10 0.17 1.61 0.02 -1.26 -3.03 135.00 133.46 2r8y s PRO 14 Ca 0.00 2.18 0.06 0.00 0.02 0.00 0.00 61.00 63.26 2r8y s PRO 14 Cb 0.00 -2.21 -0.04 0.00 0.02 0.00 0.00 34.50 32.27 2r8y s PRO 14 CO 0.00 -1.21 -0.13 0.14 -0.33 0.00 0.00 177.00 175.48 2r8y s VAL 15 N -1.33 1.44 0.70 3.83 -7.23 0.10 -4.93 120.40 112.98 2r8y s VAL 15 Ca 0.73 -2.07 -0.14 0.00 -1.81 0.00 0.00 61.98 58.69 2r8y s VAL 15 Cb -0.39 -1.88 0.02 0.00 0.56 0.00 0.00 36.38 34.69 2r8y s VAL 15 CO 0.46 -0.63 1.12 -0.94 -0.31 0.00 0.00 175.10 174.80 2r8y s SER 16 N -3.11 4.81 0.22 4.85 1.04 -1.26 -4.52 113.70 115.73 2r8y s SER 16 Ca 0.18 2.02 -0.08 0.00 0.48 0.00 0.00 55.95 58.55 2r8y s SER 16 Cb -0.00 -2.55 0.27 0.00 0.10 0.00 0.00 66.02 63.84 2r8y s SER 16 CO 0.04 -1.83 1.82 0.00 0.98 0.00 0.00 173.24 174.24 2r8y h ALA 17 N -0.29 0.98 -0.86 5.32 0.00 -1.99 -2.29 119.26 120.12 2r8y h ALA 17 Ca -0.46 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.47 2r8y h ALA 17 Cb 1.25 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2r8y h ALA 17 CO 0.53 0.10 0.56 0.22 0.00 0.00 0.00 179.25 180.66 2r8y h ASP 18 N 0.76 1.00 -0.29 0.00 3.58 -1.99 -0.64 116.42 118.84 2r8y h ASP 18 Ca 0.32 -0.03 -0.05 0.00 0.42 0.00 0.00 57.03 57.69 2r8y h ASP 18 Cb 0.20 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 2r8y h ASP 18 CO -0.19 0.73 -0.01 0.58 -2.88 0.00 0.00 179.24 177.48 2r8y h VAL 19 N 1.17 1.26 -0.84 2.25 2.07 -1.87 -1.63 116.25 118.66 2r8y h VAL 19 Ca 0.32 -0.95 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 2r8y h VAL 19 Cb -0.12 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 2r8y h VAL 19 CO -0.07 0.31 0.45 -0.03 0.02 0.00 0.00 177.57 178.25 2r8y h MET 20 N 0.31 1.18 -0.39 1.57 1.85 -1.13 0.36 114.93 118.67 2r8y h MET 20 Ca 0.08 -0.14 -0.04 0.00 -0.61 0.00 0.00 59.70 58.99 2r8y h MET 20 Cb 0.44 -0.23 -0.02 0.00 0.43 0.00 0.00 31.60 32.23 2r8y h MET 20 CO 0.02 0.87 0.09 0.00 -0.40 0.00 0.00 176.91 177.48 2r8y h ALA 21 N 1.31 0.51 -0.58 0.39 0.00 -0.98 -0.67 119.26 119.24 2r8y h ALA 21 Ca 0.30 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2r8y h ALA 21 Cb 0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2r8y h ALA 21 CO -0.05 0.20 0.37 0.87 0.00 0.00 0.00 179.25 180.64 2r8y h LYS 22 N 0.49 0.78 -0.20 0.00 1.57 -0.93 -2.88 116.57 115.40 2r8y h LYS 22 Ca 0.12 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 2r8y h LYS 22 Cb 0.32 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2r8y h LYS 22 CO 0.00 0.54 -0.13 0.00 -0.57 0.00 0.00 179.45 179.29 2r8y h ALA 23 N 1.19 1.41 0.00 3.86 0.00 -0.65 -2.72 119.26 122.35 2r8y h ALA 23 Ca 0.21 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2r8y h ALA 23 Cb -0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2r8y h ALA 23 CO -0.04 0.41 -0.04 1.49 0.00 0.00 0.00 179.25 181.07 2r8y h GLU 24 N 0.30 0.00 -0.25 0.00 4.22 -0.89 -2.92 114.58 115.04 2r8y h GLU 24 Ca 0.06 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.50 2r8y h GLU 24 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2r8y h GLU 24 CO 0.02 0.04 0.00 0.09 -2.18 0.00 0.00 179.01 176.98 2r8y n ASN 25 N -4.12 2.93 -4.67 1.04 5.03 -1.03 -4.76 115.26 109.68 2r8y n ASN 25 Ca -0.03 -1.92 -0.43 0.00 0.87 0.00 0.00 54.58 53.08 2r8y n ASN 25 Cb 0.12 -0.16 -0.02 0.00 -1.02 0.00 0.00 39.78 38.70 2r8y n ASN 25 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2r8y s ILE 26 N -1.68 4.61 -0.08 2.41 -1.09 -1.10 -4.42 121.20 119.84 2r8y s ILE 26 Ca 0.35 1.93 0.15 0.00 -2.23 0.00 0.00 60.65 60.85 2r8y s ILE 26 Cb 0.21 -4.24 -0.23 0.00 -1.58 0.00 0.00 42.46 36.62 2r8y s ILE 26 CO 0.30 -0.12 0.36 0.54 -1.23 0.00 0.00 174.94 174.79 2r8y n ARG 27 N 6.02 0.61 -3.92 2.79 5.12 0.18 -4.87 116.66 122.59 2r8y n ARG 27 Ca 0.12 -0.13 -0.16 0.00 -1.93 0.00 0.00 57.85 55.75 2r8y n ARG 27 Cb 0.46 -1.35 -0.16 0.00 -1.16 0.00 0.00 32.46 30.26 2r8y n ARG 27 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2r8y s LEU 28 N -3.94 1.36 -0.24 0.55 2.96 -0.95 -1.47 118.68 116.95 2r8y s LEU 28 Ca -0.05 -0.02 -0.05 0.00 -0.22 0.00 0.00 54.13 53.80 2r8y s LEU 28 Cb 0.10 -0.17 -0.01 0.00 0.50 0.00 0.00 46.19 46.61 2r8y s LEU 28 CO 0.63 -0.07 -0.00 -0.22 -1.32 0.00 0.00 176.35 175.36 2r8y s LEU 29 N 0.77 3.19 -0.17 -0.68 2.96 0.51 -0.38 118.68 124.88 2r8y s LEU 29 Ca -0.07 -0.46 -0.07 0.00 -0.22 0.00 0.00 54.13 53.30 2r8y s LEU 29 Cb -0.11 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 2r8y s LEU 29 CO -0.02 -0.06 0.07 -0.63 -1.32 0.00 0.00 176.35 174.39 2r8y s ILE 30 N 1.49 4.90 -0.07 6.68 1.01 0.97 -0.68 121.20 135.50 2r8y s ILE 30 Ca 0.05 0.00 0.05 0.00 0.00 0.00 0.00 60.65 60.75 2r8y s ILE 30 Cb -0.15 -3.19 -0.00 0.00 0.01 0.00 0.00 42.46 39.12 2r8y s ILE 30 CO -0.01 0.49 -0.22 -0.76 0.00 0.00 0.00 174.94 174.43 2r8y s LEU 31 N 0.11 2.02 0.79 2.97 1.43 0.27 -1.26 118.68 125.02 2r8y s LEU 31 Ca 0.06 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.56 2r8y s LEU 31 Cb -0.12 -1.28 0.07 0.00 0.03 0.00 0.00 46.19 44.88 2r8y s LEU 31 CO 0.00 0.18 1.09 -0.62 0.23 0.00 0.00 176.35 177.23 2r8y s ASP 32 N 0.11 4.46 0.00 2.29 3.68 -0.87 -2.00 116.67 124.35 2r8y s ASP 32 Ca -0.10 1.56 0.00 0.00 2.13 0.00 0.00 52.55 56.14 2r8y s ASP 32 Cb -0.15 -2.31 0.00 0.00 -1.45 0.00 0.00 42.92 39.01 2r8y s ASP 32 CO 0.05 -2.02 0.00 0.52 0.13 0.00 0.00 175.17 173.85 2r8y n VAL 33 N -3.49 0.00 -2.13 1.11 0.31 -1.26 -3.81 118.33 109.05 2r8y n VAL 33 Ca 0.08 0.34 -0.43 0.00 -0.01 0.00 0.00 64.34 64.32 2r8y n VAL 33 Cb 0.54 -1.30 -0.03 0.00 -0.91 0.00 0.00 33.84 32.15 2r8y n VAL 33 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2r8y s ASP 34 N -2.95 6.63 0.00 4.52 1.01 -1.26 -0.46 116.67 124.15 2r8y s ASP 34 Ca 0.00 1.91 0.00 0.00 0.71 0.00 0.00 52.55 55.17 2r8y s ASP 34 Cb 0.00 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.40 2r8y s ASP 34 CO 0.00 -1.00 0.00 0.61 0.21 0.00 0.00 175.17 174.99 2r8y n GLY 35 N 4.20 0.92 1.07 0.21 0.00 -0.90 -4.71 105.19 105.99 2r8y n GLY 35 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2r8y n GLY 35 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2r8y n VAL 36 N -2.00 1.03 1.07 1.61 0.31 -0.59 -4.14 118.33 115.62 2r8y n VAL 36 Ca 0.00 0.34 0.13 0.00 -0.01 0.00 0.00 64.34 64.80 2r8y n VAL 36 Cb 0.00 -1.47 0.47 0.00 -0.91 0.00 0.00 33.84 31.93 2r8y n VAL 36 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2r8y n LEU 37 N -3.36 0.28 -4.33 7.52 4.77 0.39 -1.61 117.00 120.66 2r8y n LEU 37 Ca 0.00 0.22 -0.18 0.00 -0.03 0.00 0.00 56.01 56.02 2r8y n LEU 37 Cb 0.00 -0.35 -0.09 0.00 -2.33 0.00 0.00 43.42 40.65 2r8y n LEU 37 CO 0.00 0.06 -0.21 -0.94 -1.33 0.00 0.00 177.39 174.97 2r8y s SER 38 N -2.91 1.41 -0.03 -1.43 1.04 -0.99 -4.14 113.70 106.65 2r8y s SER 38 Ca 0.15 -1.51 0.06 0.00 0.48 0.00 0.00 55.95 55.14 2r8y s SER 38 Cb 0.19 0.33 0.23 0.00 0.10 0.00 0.00 66.02 66.87 2r8y s SER 38 CO 0.59 -0.85 1.08 -0.90 0.98 0.00 0.00 173.24 174.14 2r8y n ASP 39 N -0.79 1.77 0.00 7.02 3.85 -1.24 -2.11 116.55 125.04 2r8y n ASP 39 Ca 0.01 -2.11 0.00 0.00 -0.71 0.00 0.00 54.79 51.97 2r8y n ASP 39 Cb 0.65 -0.31 0.00 0.00 -1.35 0.00 0.00 41.12 40.11 2r8y n ASP 39 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2r8y n GLY 40 N 0.63 0.75 3.82 6.12 0.00 -1.26 -4.62 105.19 110.62 2r8y n GLY 40 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 2r8y n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r8y s LEU 41 N 0.00 4.51 -0.20 0.99 1.43 -1.26 -4.75 118.68 119.39 2r8y s LEU 41 Ca 0.00 1.16 -0.00 0.00 -1.03 0.00 0.00 54.13 54.26 2r8y s LEU 41 Cb 0.00 -2.80 0.02 0.00 0.03 0.00 0.00 46.19 43.44 2r8y s LEU 41 CO 0.00 0.29 -0.14 -0.63 0.23 0.00 0.00 176.35 176.10 2r8y s ILE 42 N -1.08 2.50 -0.24 -0.59 -1.09 -1.26 -4.72 121.20 114.73 2r8y s ILE 42 Ca 0.27 -0.89 -0.14 0.00 -2.23 0.00 0.00 60.65 57.66 2r8y s ILE 42 Cb -0.19 -2.14 -0.04 0.00 -1.58 0.00 0.00 42.46 38.52 2r8y s ILE 42 CO 0.17 0.43 0.33 -0.31 -1.23 0.00 0.00 174.94 174.33 2r8y s TYR 43 N 1.33 3.31 -0.02 3.97 1.51 -0.89 -4.99 117.35 121.58 2r8y s TYR 43 Ca 0.04 0.45 0.05 0.00 -1.01 0.00 0.00 57.07 56.59 2r8y s TYR 43 Cb -0.14 -2.48 -0.01 0.00 -0.11 0.00 0.00 41.96 39.21 2r8y s TYR 43 CO -0.09 -0.08 -0.18 -1.64 -1.11 0.00 0.00 175.55 172.46 2r8y s MET 44 N 1.54 1.48 0.40 -0.62 -1.94 -1.26 -0.99 119.30 117.91 2r8y s MET 44 Ca 0.15 -0.63 0.05 0.00 -1.71 0.00 0.00 55.69 53.55 2r8y s MET 44 Cb -0.15 -1.41 -0.06 0.00 2.01 0.00 0.00 34.83 35.23 2r8y s MET 44 CO 0.08 0.36 0.03 0.20 -0.01 0.00 0.00 175.02 175.68 2r8y s GLY 45 N -0.35 2.48 0.44 -0.03 0.00 0.02 -4.97 107.32 104.92 2r8y s GLY 45 Ca 0.05 -1.81 0.24 0.00 0.00 0.00 0.00 44.72 43.21 2r8y s GLY 45 CO -0.00 -2.01 1.81 3.43 0.00 0.00 0.00 173.10 176.32 2r8y h ASN 46 N 1.80 0.00 -0.43 1.64 2.35 -2.02 -2.02 115.58 116.89 2r8y h ASN 46 Ca -0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.33 2r8y h ASN 46 Cb 1.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.63 2r8y h ASN 46 CO 0.74 0.21 0.00 0.59 -1.65 0.00 0.00 177.43 177.32 2r8y n ASN 47 N -3.33 3.71 -0.11 5.81 5.03 -1.26 -4.89 115.26 120.22 2r8y n ASN 47 Ca 0.00 -2.41 -0.01 0.00 0.87 0.00 0.00 54.58 53.03 2r8y n ASN 47 Cb 0.44 -0.53 -0.01 0.00 -1.02 0.00 0.00 39.78 38.67 2r8y n ASN 47 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2r8y n GLY 48 N 0.74 0.51 3.75 7.41 0.00 -0.76 -5.02 105.19 111.82 2r8y n GLY 48 Ca 0.18 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 2r8y n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2r8y s GLU 49 N -1.08 3.13 -0.01 1.61 8.01 -1.25 -4.78 118.70 124.33 2r8y s GLU 49 Ca 0.00 2.18 0.01 0.00 0.01 0.00 0.00 54.97 57.17 2r8y s GLU 49 Cb 0.00 -2.22 0.00 0.00 -4.31 0.00 0.00 34.13 27.60 2r8y s GLU 49 CO 0.00 -1.18 -0.04 -2.00 0.01 0.00 0.00 175.26 172.05 2r8y s GLU 50 N -2.94 0.43 0.22 1.61 2.12 -1.26 -0.80 118.70 118.08 2r8y s GLU 50 Ca 0.72 -0.13 0.09 0.00 0.36 0.00 0.00 54.97 56.02 2r8y s GLU 50 Cb -0.39 -0.45 -0.05 0.00 0.26 0.00 0.00 34.13 33.50 2r8y s GLU 50 CO 0.46 0.04 -0.17 -0.51 -0.54 0.00 0.00 175.26 174.55 2r8y s LEU 51 N 0.19 2.55 -0.04 2.70 1.43 -0.16 -5.00 118.68 120.35 2r8y s LEU 51 Ca -0.02 -1.00 -0.06 0.00 -1.03 0.00 0.00 54.13 52.02 2r8y s LEU 51 Cb -0.05 -0.82 0.01 0.00 0.03 0.00 0.00 46.19 45.36 2r8y s LEU 51 CO -0.00 -0.09 0.15 -0.75 0.23 0.00 0.00 176.35 175.89 2r8y s LYS 52 N -3.49 0.28 -0.19 1.70 2.20 -1.26 -2.09 119.74 116.88 2r8y s LYS 52 Ca 0.24 0.03 -0.10 0.00 -0.36 0.00 0.00 55.97 55.78 2r8y s LYS 52 Cb -0.03 0.12 -0.05 0.00 -1.51 0.00 0.00 37.83 36.37 2r8y s LYS 52 CO 0.09 -0.05 0.13 0.00 -0.36 0.00 0.00 175.35 175.16 2r8y s ALA 53 N -0.36 3.69 0.27 3.13 0.00 -1.26 -5.10 121.76 122.13 2r8y s ALA 53 Ca -0.04 -0.69 0.10 0.00 0.00 0.00 0.00 51.96 51.32 2r8y s ALA 53 Cb -0.03 -2.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.91 2r8y s ALA 53 CO 0.01 0.21 -0.01 -0.06 0.00 0.00 0.00 175.76 175.90 2r8y s PHE 54 N 0.22 2.68 -0.19 0.00 0.40 -1.26 -4.40 117.98 115.43 2r8y s PHE 54 Ca 0.08 -0.22 -0.05 0.00 -0.60 0.00 0.00 56.93 56.14 2r8y s PHE 54 Cb -0.11 -1.19 -0.03 0.00 0.51 0.00 0.00 43.02 42.20 2r8y s PHE 54 CO -0.01 0.62 0.01 1.21 0.70 0.00 0.00 175.22 177.75 2r8y s ASN 55 N -3.67 4.97 0.50 1.36 3.04 -1.26 -5.00 114.94 114.88 2r8y s ASN 55 Ca 0.31 -0.15 0.21 0.00 0.04 0.00 0.00 52.86 53.27 2r8y s ASN 55 Cb -0.06 -1.85 1.30 0.00 -1.54 0.00 0.00 41.25 39.11 2r8y s ASN 55 CO 0.20 0.09 2.08 -0.37 -3.04 0.00 0.00 177.10 176.06 2r8y h VAL 56 N 5.27 0.86 -0.79 -5.21 -1.51 -1.93 -1.17 116.25 111.77 2r8y h VAL 56 Ca -0.35 -0.40 -0.02 0.00 -1.23 0.00 0.00 66.70 64.70 2r8y h VAL 56 Cb 1.18 1.23 -0.04 0.00 -2.13 0.00 0.00 31.29 31.53 2r8y h VAL 56 CO 0.62 0.11 0.41 -0.09 -1.23 0.00 0.00 177.57 177.39 2r8y h ARG 57 N 0.00 1.12 -0.68 5.19 2.43 -1.94 0.76 114.38 121.26 2r8y h ARG 57 Ca -0.00 -0.15 -0.08 0.00 -0.81 0.00 0.00 59.98 58.95 2r8y h ARG 57 Cb 0.22 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 2r8y h ARG 57 CO 0.01 0.84 0.13 -0.44 -1.51 0.00 0.00 179.97 179.01 2r8y h ASP 58 N 1.11 1.06 -0.34 -3.80 3.32 -1.60 -2.63 116.42 113.53 2r8y h ASP 58 Ca 0.28 -0.25 0.06 0.00 0.02 0.00 0.00 57.03 57.14 2r8y h ASP 58 Cb 0.07 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 39.28 2r8y h ASP 58 CO -0.04 1.04 -0.01 1.23 -1.72 0.00 0.00 179.24 179.74 2r8y h GLY 59 N 1.04 0.33 1.01 2.75 0.00 -0.49 -0.61 103.07 107.10 2r8y h GLY 59 Ca 0.21 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.59 2r8y h GLY 59 CO 0.01 -0.08 0.55 -1.82 0.00 0.00 0.00 176.54 175.20 2r8y h TYR 60 N 0.08 1.13 -0.55 5.60 5.03 -0.68 -1.42 116.97 126.16 2r8y h TYR 60 Ca 0.17 0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.42 2r8y h TYR 60 Cb 0.23 -0.38 -0.02 0.00 1.55 0.00 0.00 36.73 38.11 2r8y h TYR 60 CO -0.25 0.73 0.07 0.78 -1.32 0.00 0.00 178.16 178.18 2r8y h GLY 61 N 1.20 0.99 0.96 1.82 0.00 -1.06 -1.76 103.07 105.23 2r8y h GLY 61 Ca 0.32 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.93 2r8y h GLY 61 CO -0.06 0.62 0.10 -2.22 0.00 0.00 0.00 176.54 174.98 2r8y h ILE 62 N 0.81 1.24 -0.93 2.60 2.04 -0.85 -1.04 117.51 121.37 2r8y h ILE 62 Ca 0.16 -0.85 0.01 0.00 1.00 0.00 0.00 64.86 65.19 2r8y h ILE 62 Cb 0.43 0.92 -0.05 0.00 -0.74 0.00 0.00 36.82 37.38 2r8y h ILE 62 CO 0.01 0.30 0.62 0.03 0.00 0.00 0.00 178.15 179.11 2r8y h ARG 63 N 0.62 1.21 -0.17 2.37 2.47 -1.15 -0.09 114.38 119.64 2r8y h ARG 63 Ca 0.14 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.78 2r8y h ARG 63 Cb 0.35 -0.27 -0.01 0.00 -1.65 0.00 0.00 29.97 28.39 2r8y h ARG 63 CO 0.00 0.80 0.08 0.00 0.56 0.00 0.00 179.97 181.42 2r8y h ALA 65 N 0.95 0.26 -0.94 0.00 0.00 -0.69 -1.70 119.26 117.14 2r8y h ALA 65 Ca 0.06 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2r8y h ALA 65 Cb 0.12 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2r8y h ALA 65 CO -0.01 -0.21 0.61 -0.07 0.00 0.00 0.00 179.25 179.57 2r8y h LEU 66 N 0.23 1.09 -0.83 0.00 3.38 -0.92 -0.66 115.31 117.60 2r8y h LEU 66 Ca 0.07 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2r8y h LEU 66 Cb 0.06 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.54 2r8y h LEU 66 CO -0.01 0.80 0.00 0.35 0.09 0.00 0.00 178.44 179.67 2r8y n THR 67 N -4.41 0.19 -2.04 0.22 -2.24 -1.00 -3.69 114.28 101.30 2r8y n THR 67 Ca 0.11 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.52 2r8y n THR 67 Cb 0.02 0.18 0.08 0.00 -2.10 0.00 0.00 70.33 68.52 2r8y n THR 67 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2r8y n SER 68 N 0.06 3.22 -2.33 3.42 7.64 -0.65 -4.96 113.62 120.01 2r8y n SER 68 Ca 0.14 -3.43 -0.18 0.00 1.01 0.00 0.00 58.87 56.41 2r8y n SER 68 Cb 0.25 -0.41 0.01 0.00 -1.01 0.00 0.00 64.21 63.05 2r8y n SER 68 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2r8y n ASP 69 N -0.72 -5.34 -3.99 6.43 4.64 -1.19 -4.96 116.55 111.42 2r8y n ASP 69 Ca 0.29 -0.14 -0.31 0.00 -1.38 0.00 0.00 54.79 53.25 2r8y n ASP 69 Cb 0.88 -4.28 -0.15 0.00 -1.04 0.00 0.00 41.12 36.52 2r8y n ASP 69 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2r8y s ILE 70 N -2.99 1.76 0.49 5.18 1.01 -0.34 -4.82 121.20 121.48 2r8y s ILE 70 Ca 0.14 -1.34 -0.21 0.00 0.00 0.00 0.00 60.65 59.24 2r8y s ILE 70 Cb -0.06 -1.95 -0.07 0.00 0.01 0.00 0.00 42.46 40.38 2r8y s ILE 70 CO 0.17 -0.05 1.12 -1.61 0.00 0.00 0.00 174.94 174.57 2r8y s GLU 71 N 1.30 3.63 -0.12 2.79 0.41 -0.54 -2.97 118.70 123.19 2r8y s GLU 71 Ca -0.07 1.61 0.03 0.00 -0.41 0.00 0.00 54.97 56.13 2r8y s GLU 71 Cb -0.19 -2.19 0.01 0.00 -1.78 0.00 0.00 34.13 29.98 2r8y s GLU 71 CO -0.06 -0.62 -0.21 0.08 -0.49 0.00 0.00 175.26 173.97 2r8y s VAL 72 N -1.73 1.91 0.18 2.63 1.01 -1.26 -0.36 120.40 122.77 2r8y s VAL 72 Ca 0.68 -0.90 0.10 0.00 0.00 0.00 0.00 61.98 61.85 2r8y s VAL 72 Cb -0.24 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 2r8y s VAL 72 CO 0.28 0.52 -0.21 0.00 0.00 0.00 0.00 175.10 175.69 2r8y s ALA 73 N 0.74 2.26 -0.04 5.51 0.00 0.14 -4.31 121.76 126.07 2r8y s ALA 73 Ca -0.10 -1.55 0.06 0.00 0.00 0.00 0.00 51.96 50.37 2r8y s ALA 73 Cb -0.16 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 2r8y s ALA 73 CO 0.01 0.34 -0.21 0.42 0.00 0.00 0.00 175.76 176.32 2r8y s ILE 74 N -1.81 1.71 -0.16 0.00 1.01 -0.53 -0.56 121.20 120.85 2r8y s ILE 74 Ca 0.18 -0.89 -0.02 0.00 0.00 0.00 0.00 60.65 59.92 2r8y s ILE 74 Cb -0.07 -1.44 0.05 0.00 0.01 0.00 0.00 42.46 41.01 2r8y s ILE 74 CO 0.08 0.48 0.01 -0.63 0.00 0.00 0.00 174.94 174.88 2r8y s ILE 75 N -0.18 0.64 0.02 2.92 1.01 -0.85 -1.13 121.20 123.63 2r8y s ILE 75 Ca -0.00 -0.45 0.05 0.00 0.00 0.00 0.00 60.65 60.25 2r8y s ILE 75 Cb -0.11 -1.00 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 2r8y s ILE 75 CO 0.02 -0.04 -0.15 0.28 0.00 0.00 0.00 174.94 175.05 2r8y s THR 76 N 1.82 1.20 0.29 2.92 -1.32 -0.16 -4.30 115.64 116.09 2r8y s THR 76 Ca 0.00 -0.91 0.09 0.00 -1.21 0.00 0.00 61.69 59.67 2r8y s THR 76 Cb -0.16 -1.05 0.01 0.00 -1.51 0.00 0.00 72.50 69.79 2r8y s THR 76 CO -0.07 0.13 1.67 1.23 -2.21 0.00 0.00 174.62 175.37 2r8y h GLY 77 N 5.19 0.11 -1.11 6.08 0.00 -1.86 -0.73 103.07 110.76 2r8y h GLY 77 Ca -0.38 -0.12 -0.46 0.00 0.00 0.00 0.00 47.33 46.37 2r8y h GLY 77 CO 0.45 0.11 0.24 0.50 0.00 0.00 0.00 176.54 177.85 2r8y s ARG 78 N -3.89 1.86 -0.04 4.80 0.52 -1.26 -3.48 118.95 117.46 2r8y s ARG 78 Ca -0.03 -0.41 -0.01 0.00 -0.52 0.00 0.00 55.73 54.76 2r8y s ARG 78 Cb 0.13 -2.14 0.03 0.00 0.52 0.00 0.00 34.95 33.49 2r8y s ARG 78 CO 0.76 -1.47 0.06 0.21 0.02 0.00 0.00 175.30 174.89 2r8y s LYS 79 N -5.34 -0.03 -0.18 3.54 2.20 -1.26 0.07 119.74 118.75 2r8y s LYS 79 Ca 0.63 0.29 -0.17 0.00 -0.36 0.00 0.00 55.97 56.37 2r8y s LYS 79 Cb -0.09 -0.31 0.05 0.00 -1.51 0.00 0.00 37.83 35.97 2r8y s LYS 79 CO 0.46 -0.22 0.48 0.00 -0.36 0.00 0.00 175.35 175.71 2r8y s ALA 80 N 1.46 -1.20 0.21 3.13 0.00 -1.26 -4.97 121.76 119.13 2r8y s ALA 80 Ca -0.05 1.38 -0.09 0.00 0.00 0.00 0.00 51.96 53.20 2r8y s ALA 80 Cb -0.12 -0.80 0.26 0.00 0.00 0.00 0.00 23.12 22.45 2r8y s ALA 80 CO -0.04 -0.23 1.78 -0.22 0.00 0.00 0.00 175.76 177.05 2r8y h LYS 81 N 5.44 0.53 -0.97 0.00 1.63 -2.00 -2.32 116.57 118.87 2r8y h LYS 81 Ca -0.28 -0.03 0.23 0.00 -0.85 0.00 0.00 60.65 59.72 2r8y h LYS 81 Cb 1.18 -0.12 -0.08 0.00 -0.60 0.00 0.00 32.23 32.61 2r8y h LYS 81 CO 0.20 0.35 0.63 1.37 -3.45 0.00 0.00 179.45 178.56 2r8y h LEU 82 N 0.55 0.46 -0.71 5.20 8.10 -1.96 0.15 115.31 127.10 2r8y h LEU 82 Ca 0.30 0.06 -0.11 0.00 0.11 0.00 0.00 57.88 58.24 2r8y h LEU 82 Cb 0.28 -0.02 -0.01 0.00 -0.44 0.00 0.00 40.66 40.47 2r8y h LEU 82 CO -0.24 0.15 -0.23 0.58 -4.11 0.00 0.00 178.44 174.59 2r8y h VAL 83 N 0.44 1.27 -0.64 0.15 2.07 -1.84 -1.14 116.25 116.56 2r8y h VAL 83 Ca 0.53 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.72 2r8y h VAL 83 Cb 1.28 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 32.25 2r8y h VAL 83 CO -0.24 0.44 0.41 -0.33 0.02 0.00 0.00 177.57 177.88 2r8y h GLU 84 N 0.65 0.85 -0.32 1.57 5.08 -0.71 -2.43 114.58 119.28 2r8y h GLU 84 Ca 0.09 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2r8y h GLU 84 Cb 0.73 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2r8y h GLU 84 CO 0.06 0.58 0.19 -0.44 -1.00 0.00 0.00 179.01 178.39 2r8y h ASP 85 N 0.87 0.39 -0.76 1.42 3.32 -1.01 -2.13 116.42 118.52 2r8y h ASP 85 Ca 0.23 -0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.27 2r8y h ASP 85 Cb -0.08 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 39.32 2r8y h ASP 85 CO -0.05 0.33 0.47 -0.09 -1.72 0.00 0.00 179.24 178.18 2r8y h ARG 86 N 0.41 0.86 -0.37 3.56 9.65 -1.09 -0.97 114.38 126.43 2r8y h ARG 86 Ca 0.11 -0.05 -0.08 0.00 -1.10 0.00 0.00 59.98 58.87 2r8y h ARG 86 Cb 0.02 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.39 2r8y h ARG 86 CO -0.02 0.57 -0.08 0.00 2.80 0.00 0.00 179.97 183.24 2r8y h ALA 88 N 1.33 0.99 -0.46 0.00 0.00 -0.75 0.36 119.26 120.72 2r8y h ALA 88 Ca 0.11 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.72 2r8y h ALA 88 Cb 0.49 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2r8y h ALA 88 CO 0.03 0.60 0.29 1.15 0.00 0.00 0.00 179.25 181.32 2r8y h THR 89 N 0.72 1.09 -0.01 0.00 2.02 -0.90 -3.08 112.91 112.76 2r8y h THR 89 Ca 0.12 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.10 2r8y h THR 89 Cb 0.58 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2r8y h THR 89 CO 0.04 0.11 -0.25 0.18 0.37 0.00 0.00 175.52 175.96 2r8y n LEU 90 N -4.79 0.94 -0.65 2.58 4.77 -0.91 -4.94 117.00 114.00 2r8y n LEU 90 Ca 0.02 -0.22 -0.08 0.00 -0.03 0.00 0.00 56.01 55.71 2r8y n LEU 90 Cb 0.04 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 40.97 2r8y n LEU 90 CO 0.34 0.18 -0.08 0.61 -1.33 0.00 0.00 177.39 177.11 2r8y n GLY 91 N 1.34 0.76 3.71 -0.72 0.00 0.70 -4.77 105.19 106.21 2r8y n GLY 91 Ca 0.12 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 2r8y n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r8y s ILE 92 N -2.31 4.53 -0.26 -0.61 1.01 0.93 -4.93 121.20 119.56 2r8y s ILE 92 Ca 0.00 1.81 0.03 0.00 0.00 0.00 0.00 60.65 62.49 2r8y s ILE 92 Cb 0.00 -4.16 0.05 0.00 0.01 0.00 0.00 42.46 38.36 2r8y s ILE 92 CO 0.00 0.12 0.86 0.35 0.00 0.00 0.00 174.94 176.27 2r8y n THR 93 N 4.01 0.58 -3.97 2.92 -2.24 -1.26 -4.38 114.28 109.94 2r8y n THR 93 Ca 0.08 -0.79 -0.31 0.00 -2.27 0.00 0.00 64.05 60.76 2r8y n THR 93 Cb 0.49 0.73 -0.15 0.00 -2.10 0.00 0.00 70.33 69.30 2r8y n THR 93 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2r8y s HIS 94 N -0.67 3.03 -0.04 4.78 3.76 -1.26 -5.09 115.29 119.79 2r8y s HIS 94 Ca 0.04 -2.37 -0.01 0.00 -0.15 0.00 0.00 55.06 52.57 2r8y s HIS 94 Cb 0.03 -2.21 0.03 0.00 1.11 0.00 0.00 32.58 31.53 2r8y s HIS 94 CO 0.03 -0.88 0.03 -1.17 -0.85 0.00 0.00 174.74 171.90 2r8y s LEU 95 N 1.17 0.61 -0.24 0.89 2.96 -1.26 -1.45 118.68 121.35 2r8y s LEU 95 Ca 0.02 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 53.97 2r8y s LEU 95 Cb -0.19 -0.21 0.06 0.00 0.50 0.00 0.00 46.19 46.35 2r8y s LEU 95 CO -0.09 -0.19 -0.08 -0.31 -1.32 0.00 0.00 176.35 174.36 2r8y s TYR 96 N 1.70 2.79 0.29 5.38 1.51 -0.29 -5.00 117.35 123.74 2r8y s TYR 96 Ca -0.01 -2.00 0.08 0.00 -1.01 0.00 0.00 57.07 54.13 2r8y s TYR 96 Cb -0.13 -1.74 -0.04 0.00 -0.11 0.00 0.00 41.96 39.94 2r8y s TYR 96 CO -0.03 -0.82 0.14 -0.65 -1.11 0.00 0.00 175.55 173.08 2r8y s GLN 97 N 1.26 2.57 -1.66 -0.62 -0.21 -1.26 -0.99 119.66 118.75 2r8y s GLN 97 Ca -0.07 -1.33 -0.02 0.00 0.02 0.00 0.00 55.36 53.96 2r8y s GLN 97 Cb -0.19 -2.33 0.00 0.00 1.00 0.00 0.00 33.01 31.49 2r8y s GLN 97 CO -0.06 0.26 0.26 0.41 -2.12 0.00 0.00 175.29 174.05 2r8y n GLY 98 N -1.12 -0.49 3.11 3.09 0.00 0.11 -4.92 105.19 104.97 2r8y n GLY 98 Ca -0.05 0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2r8y n GLY 98 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2r8y s GLN 99 N -5.31 1.94 0.00 1.61 2.00 -0.34 -4.90 119.66 114.66 2r8y s GLN 99 Ca 0.13 -1.82 0.20 0.00 -2.00 0.00 0.00 55.36 51.87 2r8y s GLN 99 Cb -0.06 -3.53 0.24 0.00 0.80 0.00 0.00 33.01 30.46 2r8y s GLN 99 CO 0.16 -1.05 1.21 0.43 -0.50 0.00 0.00 175.29 175.54 2r8y n SER 100 N 4.55 2.89 -4.10 6.67 7.64 -1.26 -3.35 113.62 126.66 2r8y n SER 100 Ca -0.02 -1.88 -0.37 0.00 1.01 0.00 0.00 58.87 57.62 2r8y n SER 100 Cb 0.41 -0.08 -0.09 0.00 -1.01 0.00 0.00 64.21 63.43 2r8y n SER 100 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2r8y s ASN 101 N -1.55 5.29 0.39 6.43 2.47 -1.26 -4.97 114.94 121.74 2r8y s ASN 101 Ca 0.27 -2.77 0.28 0.00 0.42 0.00 0.00 52.86 51.06 2r8y s ASN 101 Cb 0.18 -1.86 1.07 0.00 -1.45 0.00 0.00 41.25 39.19 2r8y s ASN 101 CO 0.26 -0.39 1.83 0.11 -3.72 0.00 0.00 177.10 175.18 2r8y h LYS 102 N 7.15 0.00 -0.44 0.43 1.57 -1.87 -2.73 116.57 120.68 2r8y h LYS 102 Ca -0.02 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 2r8y h LYS 102 Cb 0.96 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.25 2r8y h LYS 102 CO 0.72 0.00 0.22 -0.07 -0.57 0.00 0.00 179.45 179.74 2r8y h LEU 103 N 0.00 0.54 0.20 2.94 3.38 -1.94 -1.41 115.31 119.02 2r8y h LEU 103 Ca 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2r8y h LEU 103 Cb 0.52 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2r8y h LEU 103 CO 0.00 0.46 -0.10 0.40 0.09 0.00 0.00 178.44 179.30 2r8y h ILE 104 N 0.61 0.83 -0.73 1.22 2.04 -1.93 -1.46 117.51 118.09 2r8y h ILE 104 Ca 0.16 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.85 2r8y h ILE 104 Cb 0.06 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 2r8y h ILE 104 CO -0.02 0.03 0.30 0.00 0.00 0.00 0.00 178.15 178.46 2r8y h ALA 105 N 0.46 1.14 0.02 1.87 0.00 -1.68 -2.60 119.26 118.48 2r8y h ALA 105 Ca -0.03 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.71 2r8y h ALA 105 Cb 0.25 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2r8y h ALA 105 CO 0.04 0.62 -0.06 0.35 0.00 0.00 0.00 179.25 180.20 2r8y h PHE 106 N 1.06 -0.15 -0.99 0.00 -0.00 -1.11 -1.41 116.94 114.33 2r8y h PHE 106 Ca 0.25 0.00 0.02 0.00 -0.00 0.00 0.00 57.97 58.24 2r8y h PHE 106 Cb 0.19 0.07 -0.05 0.00 -0.00 0.00 0.00 35.95 36.16 2r8y h PHE 106 CO 0.02 -0.10 0.66 0.77 -0.00 0.00 0.00 178.31 179.66 2r8y h SER 107 N -0.12 1.13 -0.66 0.41 0.02 -1.17 -1.52 113.55 111.63 2r8y h SER 107 Ca 0.02 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 2r8y h SER 107 Cb 0.14 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 2r8y h SER 107 CO -0.05 0.81 0.21 -0.78 -1.14 0.00 0.00 176.83 175.88 2r8y h ASP 108 N 1.33 0.98 -0.26 3.07 3.58 -1.22 -2.74 116.42 121.16 2r8y h ASP 108 Ca 0.37 -0.17 -0.05 0.00 0.42 0.00 0.00 57.03 57.60 2r8y h ASP 108 Cb -0.12 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.67 2r8y h ASP 108 CO -0.09 0.91 -0.04 -0.07 -2.88 0.00 0.00 179.24 177.08 2r8y h LEU 109 N 1.01 0.48 -0.85 2.28 3.38 -0.59 -1.70 115.31 119.33 2r8y h LEU 109 Ca 0.22 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2r8y h LEU 109 Cb 0.29 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2r8y h LEU 109 CO -0.01 0.71 0.41 -0.07 0.09 0.00 0.00 178.44 179.58 2r8y h LEU 110 N 0.24 1.10 0.16 1.67 3.38 -1.28 -1.94 115.31 118.64 2r8y h LEU 110 Ca 0.07 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2r8y h LEU 110 Cb 0.49 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2r8y h LEU 110 CO 0.02 0.92 -0.07 -0.33 0.09 0.00 0.00 178.44 179.07 2r8y h GLU 111 N 1.20 -0.20 -0.93 1.13 5.08 -1.51 -1.04 114.58 118.32 2r8y h GLU 111 Ca 0.29 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.78 2r8y h GLU 111 Cb 0.11 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.32 2r8y h GLU 111 CO -0.04 0.21 0.56 0.87 -1.00 0.00 0.00 179.01 179.61 2r8y h LYS 112 N -0.70 0.86 -0.01 2.33 1.57 -1.28 -2.71 116.57 116.64 2r8y h LYS 112 Ca -0.02 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2r8y h LYS 112 Cb 0.50 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2r8y h LYS 112 CO 0.04 0.57 -0.54 1.28 -0.57 0.00 0.00 179.45 180.23 2r8y n LEU 113 N -4.69 1.45 -3.57 2.94 4.77 -0.73 -5.00 117.00 112.16 2r8y n LEU 113 Ca 0.17 -0.52 -0.26 0.00 -0.03 0.00 0.00 56.01 55.37 2r8y n LEU 113 Cb 0.34 -0.05 0.04 0.00 -2.33 0.00 0.00 43.42 41.42 2r8y n LEU 113 CO 0.26 0.29 -0.03 0.00 -1.33 0.00 0.00 177.39 176.58 2r8y n ALA 114 N -0.61 -2.56 -3.11 -1.18 0.00 -0.46 -5.02 120.51 107.57 2r8y n ALA 114 Ca 0.08 -0.17 -0.20 0.00 0.00 0.00 0.00 53.44 53.15 2r8y n ALA 114 Cb 0.40 -3.88 -0.16 0.00 0.00 0.00 0.00 19.45 15.81 2r8y n ALA 114 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2r8y s ILE 115 N -3.37 0.77 0.52 0.00 2.07 -0.78 -5.05 121.20 115.36 2r8y s ILE 115 Ca 0.40 -0.34 -0.21 0.00 -1.41 0.00 0.00 60.65 59.09 2r8y s ILE 115 Cb -0.13 -0.70 -0.06 0.00 0.13 0.00 0.00 42.46 41.70 2r8y s ILE 115 CO 0.84 0.25 1.16 0.00 -1.91 0.00 0.00 174.94 175.27 2r8y s ALA 116 N 0.28 2.77 0.44 1.50 0.00 -1.26 -4.72 121.76 120.77 2r8y s ALA 116 Ca -0.04 0.89 0.11 0.00 0.00 0.00 0.00 51.96 52.91 2r8y s ALA 116 Cb -0.09 -3.38 0.99 0.00 0.00 0.00 0.00 23.12 20.63 2r8y s ALA 116 CO 0.01 -0.79 2.07 -1.00 0.00 0.00 0.00 175.76 176.04 2r8y h PRO 117 N 1.44 0.38 0.00 0.00 0.13 -1.97 -2.08 132.00 129.91 2r8y h PRO 117 Ca -0.50 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2r8y h PRO 117 Cb 1.26 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2r8y h PRO 117 CO 0.58 0.25 0.00 1.05 -0.23 0.00 0.00 178.00 179.65 2r8y h GLU 118 N 0.39 0.00 -0.54 0.86 9.09 -1.87 -1.47 114.58 121.05 2r8y h GLU 118 Ca 0.14 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.55 2r8y h GLU 118 Cb 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.16 2r8y h GLU 118 CO -0.03 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.12 2r8y n ASN 119 N -2.30 5.53 -4.27 3.06 3.02 -0.78 -3.89 115.26 115.64 2r8y n ASN 119 Ca 0.01 -2.95 -0.32 0.00 -0.03 0.00 0.00 54.58 51.29 2r8y n ASN 119 Cb 0.16 -0.67 -0.16 0.00 -0.61 0.00 0.00 39.78 38.49 2r8y n ASN 119 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2r8y s VAL 120 N -2.79 2.11 0.06 2.41 1.01 -0.82 0.51 120.40 122.89 2r8y s VAL 120 Ca 0.53 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.49 2r8y s VAL 120 Cb 0.41 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 2r8y s VAL 120 CO 0.15 0.57 0.09 0.00 0.00 0.00 0.00 175.10 175.91 2r8y s ALA 121 N -0.08 3.61 -0.05 5.51 0.00 0.49 -1.85 121.76 129.41 2r8y s ALA 121 Ca -0.06 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 50.94 2r8y s ALA 121 Cb -0.14 -1.51 0.02 0.00 0.00 0.00 0.00 23.12 21.49 2r8y s ALA 121 CO 0.05 0.74 -0.03 -0.47 0.00 0.00 0.00 175.76 176.05 2r8y s TYR 122 N -1.35 0.65 -0.29 0.00 5.04 -0.42 -0.02 117.35 120.96 2r8y s TYR 122 Ca 0.28 -0.16 -0.07 0.00 -2.44 0.00 0.00 57.07 54.68 2r8y s TYR 122 Cb -0.12 -0.65 0.00 0.00 0.35 0.00 0.00 41.96 41.54 2r8y s TYR 122 CO 0.21 -0.21 0.08 0.08 -1.34 0.00 0.00 175.55 174.36 2r8y s VAL 123 N 1.19 4.06 0.39 3.14 1.01 -0.39 -0.12 120.40 129.68 2r8y s VAL 123 Ca -0.07 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 61.36 2r8y s VAL 123 Cb -0.14 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 2r8y s VAL 123 CO -0.02 0.13 0.08 -0.83 0.00 0.00 0.00 175.10 174.46 2r8y s GLY 124 N 1.53 2.46 0.00 4.51 0.00 0.18 -2.04 107.32 113.95 2r8y s GLY 124 Ca 0.03 -1.48 0.00 0.00 0.00 0.00 0.00 44.72 43.28 2r8y s GLY 124 CO 0.03 -1.89 0.00 2.09 0.00 0.00 0.00 173.10 173.33 2r8y n ASP 125 N -1.05 0.00 -3.96 1.64 3.85 -1.26 -2.16 116.55 113.61 2r8y n ASP 125 Ca -0.06 -0.60 -0.12 0.00 -0.71 0.00 0.00 54.79 53.30 2r8y n ASP 125 Cb 0.66 0.00 -0.08 0.00 -1.35 0.00 0.00 41.12 40.35 2r8y n ASP 125 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2r8y s ASP 126 N 0.00 0.29 0.50 -1.12 -1.08 -1.26 -0.24 116.67 113.76 2r8y s ASP 126 Ca 0.00 -1.29 0.26 0.00 -0.52 0.00 0.00 52.55 51.00 2r8y s ASP 126 Cb 0.00 0.49 1.34 0.00 -1.46 0.00 0.00 42.92 43.29 2r8y s ASP 126 CO 0.00 -1.00 2.02 -0.07 0.52 0.00 0.00 175.17 176.64 2r8y h LEU 127 N 2.41 0.00 -2.04 -1.34 3.38 -1.98 -1.14 115.31 114.61 2r8y h LEU 127 Ca -0.31 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 2r8y h LEU 127 Cb 1.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 2r8y h LEU 127 CO 0.45 0.15 -0.09 -0.29 0.09 0.00 0.00 178.44 178.75 2r8y h ILE 128 N 0.00 0.45 0.00 1.22 6.09 -1.98 -2.37 117.51 120.92 2r8y h ILE 128 Ca -0.00 -0.43 -0.01 0.00 -1.37 0.00 0.00 64.86 63.05 2r8y h ILE 128 Cb 0.41 1.29 -0.00 0.00 0.47 0.00 0.00 36.82 39.00 2r8y h ILE 128 CO 0.02 0.08 -0.04 0.44 -3.07 0.00 0.00 178.15 175.59 2r8y h ASP 129 N 0.00 0.00 -0.63 2.19 3.32 -1.63 -3.39 116.42 116.29 2r8y h ASP 129 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2r8y h ASP 129 Cb 0.29 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 2r8y h ASP 129 CO 0.01 0.04 0.31 -0.25 -1.72 0.00 0.00 179.24 177.62 2r8y h TRP 130 N 0.00 0.90 -0.87 4.55 2.91 -1.53 -2.21 115.95 119.70 2r8y h TRP 130 Ca -0.00 -0.04 0.21 0.00 1.13 0.00 0.00 58.89 60.19 2r8y h TRP 130 Cb 0.95 -0.28 -0.12 0.00 -0.51 0.00 0.00 29.16 29.20 2r8y h TRP 130 CO 0.00 0.68 0.35 -1.35 -1.03 0.00 0.00 178.44 177.09 2r8y h PRO 131 N 0.86 0.36 -0.02 2.65 0.11 -1.77 0.15 132.00 134.35 2r8y h PRO 131 Ca 0.22 -0.02 -0.18 0.00 0.11 0.00 0.00 66.00 66.13 2r8y h PRO 131 Cb 0.11 -0.08 0.01 0.00 0.11 0.00 0.00 31.00 31.15 2r8y h PRO 131 CO -0.03 0.24 -0.69 0.28 -0.21 0.00 0.00 178.00 177.59 2r8y h VAL 132 N 0.37 1.38 -0.88 3.15 2.07 -1.81 -3.31 116.25 117.23 2r8y h VAL 132 Ca 0.53 -2.08 0.09 0.00 0.82 0.00 0.00 66.70 66.06 2r8y h VAL 132 Cb 1.00 2.48 -0.07 0.00 -1.52 0.00 0.00 31.29 33.18 2r8y h VAL 132 CO -0.53 0.62 0.53 0.24 0.02 0.00 0.00 177.57 178.45 2r8y h MET 133 N 0.05 0.89 -0.53 1.57 2.86 -0.74 -1.40 114.93 117.63 2r8y h MET 133 Ca -0.08 -0.05 0.15 0.00 -2.06 0.00 0.00 59.70 57.66 2r8y h MET 133 Cb 1.38 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.81 2r8y h MET 133 CO 0.14 0.59 0.46 1.49 1.06 0.00 0.00 176.91 180.64 2r8y h GLU 134 N 0.91 0.00 0.00 1.72 4.81 -0.81 -2.95 114.58 118.27 2r8y h GLU 134 Ca 0.41 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.57 2r8y h GLU 134 Cb 0.31 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2r8y h GLU 134 CO -0.22 0.00 -2.05 1.63 -0.73 0.00 0.00 179.01 177.64 2r8y n LYS 135 N -4.01 0.66 -1.91 1.92 5.02 -0.54 -5.00 118.16 114.30 2r8y n LYS 135 Ca 0.10 -0.16 -0.29 0.00 -2.02 0.00 0.00 58.31 55.94 2r8y n LYS 135 Cb 0.68 -1.53 0.07 0.00 -0.02 0.00 0.00 35.03 34.23 2r8y n LYS 135 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2r8y s VAL 136 N -3.33 2.56 0.01 -0.18 -7.23 -1.11 -4.54 120.40 106.57 2r8y s VAL 136 Ca -0.08 0.16 -0.21 0.00 -1.81 0.00 0.00 61.98 60.03 2r8y s VAL 136 Cb 0.12 -3.18 -0.18 0.00 0.56 0.00 0.00 36.38 33.71 2r8y s VAL 136 CO 0.89 -0.23 1.22 1.23 -0.31 0.00 0.00 175.10 177.90 2r8y h GLY 137 N -0.89 0.34 -7.76 2.32 0.00 -0.53 -3.42 103.07 93.14 2r8y h GLY 137 Ca -0.46 -0.44 -0.66 0.00 0.00 0.00 0.00 47.33 45.78 2r8y h GLY 137 CO 0.65 0.39 -0.76 -2.27 0.00 0.00 0.00 176.54 174.55 2r8y s LEU 138 N -8.82 4.11 -0.01 3.11 2.96 -0.96 -4.93 118.68 114.14 2r8y s LEU 138 Ca -0.14 -1.80 -0.18 0.00 -0.22 0.00 0.00 54.13 51.79 2r8y s LEU 138 Cb 0.04 -1.57 -0.06 0.00 0.50 0.00 0.00 46.19 45.10 2r8y s LEU 138 CO 0.76 -0.29 0.50 -0.94 -1.32 0.00 0.00 176.35 175.06 2r8y s SER 139 N 1.01 6.88 -0.06 3.68 1.04 -1.26 -1.30 113.70 123.69 2r8y s SER 139 Ca 0.02 1.05 0.01 0.00 0.48 0.00 0.00 55.95 57.51 2r8y s SER 139 Cb -0.19 -2.31 0.02 0.00 0.10 0.00 0.00 66.02 63.64 2r8y s SER 139 CO -0.07 0.20 -0.07 -0.69 0.98 0.00 0.00 173.24 173.59 2r8y s VAL 140 N -0.53 0.76 -0.13 5.02 1.01 0.83 -1.60 120.40 125.76 2r8y s VAL 140 Ca 0.27 -0.22 -0.04 0.00 0.00 0.00 0.00 61.98 62.00 2r8y s VAL 140 Cb -0.17 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 2r8y s VAL 140 CO 0.15 0.29 0.01 0.00 0.00 0.00 0.00 175.10 175.54 2r8y s ALA 141 N 1.10 3.24 0.78 5.51 0.00 -0.31 -0.65 121.76 131.43 2r8y s ALA 141 Ca -0.08 -0.79 -0.11 0.00 0.00 0.00 0.00 51.96 50.99 2r8y s ALA 141 Cb -0.14 -1.61 0.06 0.00 0.00 0.00 0.00 23.12 21.42 2r8y s ALA 141 CO -0.01 0.39 1.09 0.14 0.00 0.00 0.00 175.76 177.37 2r8y s VAL 142 N -0.24 3.32 0.28 0.00 -7.23 -0.92 -1.44 120.40 114.18 2r8y s VAL 142 Ca 0.06 0.43 0.02 0.00 -1.81 0.00 0.00 61.98 60.68 2r8y s VAL 142 Cb -0.12 -2.92 0.27 0.00 0.56 0.00 0.00 36.38 34.17 2r8y s VAL 142 CO 0.02 -0.56 1.74 0.00 -0.31 0.00 0.00 175.10 175.99 2r8y h ALA 143 N -1.14 1.43 -0.70 1.32 0.00 -1.53 -1.53 119.26 117.11 2r8y h ALA 143 Ca -0.44 0.11 -0.40 0.00 0.00 0.00 0.00 54.91 54.19 2r8y h ALA 143 Cb 1.23 0.04 -0.23 0.00 0.00 0.00 0.00 17.79 18.83 2r8y h ALA 143 CO 0.52 -0.19 0.26 -0.40 0.00 0.00 0.00 179.25 179.44 2r8y n ASP 144 N -4.92 3.76 -4.64 0.00 5.75 -1.26 -5.00 116.55 110.25 2r8y n ASP 144 Ca 0.20 -3.73 -0.30 0.00 -0.01 0.00 0.00 54.79 50.96 2r8y n ASP 144 Cb 0.56 -0.74 0.18 0.00 -1.03 0.00 0.00 41.12 40.09 2r8y n ASP 144 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2r8y s ALA 145 N -3.37 0.96 0.22 2.12 0.00 -0.58 -4.92 121.76 116.19 2r8y s ALA 145 Ca 0.52 0.21 -0.32 0.00 0.00 0.00 0.00 51.96 52.38 2r8y s ALA 145 Cb 0.45 -3.32 -0.13 0.00 0.00 0.00 0.00 23.12 20.11 2r8y s ALA 145 CO 0.04 -2.93 1.51 1.58 0.00 0.00 0.00 175.76 175.96 2r8y n HIS 146 N -4.31 2.32 -0.36 0.00 -0.00 0.67 -4.82 115.22 108.71 2r8y n HIS 146 Ca 0.08 0.33 0.26 0.00 0.46 0.00 0.00 57.72 58.85 2r8y n HIS 146 Cb 0.53 -2.52 0.53 0.00 -0.12 0.00 0.00 29.99 28.41 2r8y n HIS 146 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2r8y h PRO 147 N 5.00 0.32 0.00 1.57 0.11 -1.91 0.12 132.00 137.21 2r8y h PRO 147 Ca -0.45 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2r8y h PRO 147 Cb 1.26 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2r8y h PRO 147 CO 0.82 0.21 -0.19 -0.07 -0.21 0.00 0.00 178.00 178.56 2r8y h LEU 148 N 0.32 0.00 0.07 2.35 3.38 -1.98 -3.19 115.31 116.26 2r8y h LEU 148 Ca 0.68 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.42 2r8y h LEU 148 Cb 1.77 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.54 2r8y h LEU 148 CO -0.40 0.19 -0.93 0.25 0.09 0.00 0.00 178.44 177.65 2r8y h LEU 149 N 0.00 0.70 -0.58 1.67 5.85 -1.11 -3.40 115.31 118.44 2r8y h LEU 149 Ca -0.00 -0.81 0.11 0.00 0.84 0.00 0.00 57.88 58.02 2r8y h LEU 149 Cb 0.74 -0.22 -0.11 0.00 0.37 0.00 0.00 40.66 41.44 2r8y h LEU 149 CO 0.02 1.44 -0.29 0.40 -0.34 0.00 0.00 178.44 179.67 2r8y h ILE 150 N 0.06 0.22 0.00 4.05 2.04 -1.49 -0.35 117.51 122.04 2r8y h ILE 150 Ca -0.13 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2r8y h ILE 150 Cb 1.64 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 2r8y h ILE 150 CO 0.18 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.52 2r8y n PRO 151 N -5.44 0.31 0.06 2.37 -0.04 -1.26 -2.82 135.00 128.19 2r8y n PRO 151 Ca 0.05 0.10 -0.01 0.00 -0.04 0.00 0.00 63.50 63.60 2r8y n PRO 151 Cb 0.35 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.25 2r8y n PRO 151 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2r8y h ARG 152 N 0.00 0.00 -7.07 0.54 3.08 -1.30 -3.48 114.38 106.16 2r8y h ARG 152 Ca 0.00 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.59 2r8y h ARG 152 Cb 0.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2r8y h ARG 152 CO 0.00 0.45 0.32 0.00 -1.07 0.00 0.00 179.97 179.67 2r8y s ALA 153 N -2.88 3.08 0.20 0.04 0.00 -1.13 -4.98 121.76 116.10 2r8y s ALA 153 Ca -0.00 0.28 -0.10 0.00 0.00 0.00 0.00 51.96 52.14 2r8y s ALA 153 Cb 0.08 -3.09 0.13 0.00 0.00 0.00 0.00 23.12 20.24 2r8y s ALA 153 CO 0.79 0.02 1.78 -0.44 0.00 0.00 0.00 175.76 177.91 2r8y h ASP 154 N 1.59 0.97 -3.51 0.00 3.45 -1.74 -3.44 116.42 113.75 2r8y h ASP 154 Ca -0.48 -0.15 -0.41 0.00 0.43 0.00 0.00 57.03 56.42 2r8y h ASP 154 Cb 1.18 -0.25 -0.33 0.00 -0.56 0.00 0.00 39.33 39.37 2r8y h ASP 154 CO 0.62 0.86 -0.77 -0.47 -1.57 0.00 0.00 179.24 177.90 2r8y s TYR 155 N -5.63 0.78 -0.22 4.55 5.04 -0.62 -4.95 117.35 116.29 2r8y s TYR 155 Ca -0.13 -0.22 -0.08 0.00 -2.44 0.00 0.00 57.07 54.21 2r8y s TYR 155 Cb 0.15 -0.66 -0.04 0.00 0.35 0.00 0.00 41.96 41.75 2r8y s TYR 155 CO 0.82 -0.18 0.09 0.08 -1.34 0.00 0.00 175.55 175.02 2r8y s VAL 156 N 0.77 4.74 0.61 3.14 1.01 -1.26 -1.16 120.40 128.26 2r8y s VAL 156 Ca -0.11 -0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.66 2r8y s VAL 156 Cb -0.14 -3.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 2r8y s VAL 156 CO 0.01 0.38 1.13 0.42 0.00 0.00 0.00 175.10 177.03 2r8y s THR 157 N 1.07 3.13 0.10 3.92 -4.23 -0.52 -4.92 115.64 114.18 2r8y s THR 157 Ca 0.05 0.61 -0.03 0.00 -1.18 0.00 0.00 61.69 61.15 2r8y s THR 157 Cb -0.14 -3.17 -0.25 0.00 1.34 0.00 0.00 72.50 70.28 2r8y s THR 157 CO 0.04 -0.24 1.20 0.03 -0.54 0.00 0.00 174.62 175.11 2r8y h ARG 158 N 0.58 0.26 -6.15 3.99 -0.00 -1.91 -3.16 114.38 107.98 2r8y h ARG 158 Ca -0.48 -0.39 -0.59 0.00 -0.50 0.00 0.00 59.98 58.02 2r8y h ARG 158 Cb 1.26 0.14 -0.05 0.00 0.00 0.00 0.00 29.97 31.32 2r8y h ARG 158 CO 0.55 1.16 -0.13 0.42 0.00 0.00 0.00 179.97 181.96 2r8y s ILE 159 N -2.80 4.92 0.79 2.04 -1.09 -1.26 -4.78 121.20 119.01 2r8y s ILE 159 Ca -0.04 0.91 -0.11 0.00 -2.23 0.00 0.00 60.65 59.18 2r8y s ILE 159 Cb 0.08 -3.76 0.06 0.00 -1.58 0.00 0.00 42.46 37.26 2r8y s ILE 159 CO 0.87 0.48 1.09 0.00 -1.23 0.00 0.00 174.94 176.14 2r8y s ALA 160 N -1.20 2.19 0.22 9.38 0.00 -1.26 -3.27 121.76 127.83 2r8y s ALA 160 Ca 0.29 0.08 -0.32 0.00 0.00 0.00 0.00 51.96 52.02 2r8y s ALA 160 Cb -0.17 -3.21 -0.13 0.00 0.00 0.00 0.00 23.12 19.61 2r8y s ALA 160 CO 0.17 -1.77 1.47 0.41 0.00 0.00 0.00 175.76 176.04 2r8y n GLY 161 N -1.50 0.91 3.12 0.00 0.00 -1.26 -2.05 105.19 104.41 2r8y n GLY 161 Ca 0.08 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.64 2r8y n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r8y n GLY 162 N 2.49 1.28 0.22 -0.02 0.00 -0.63 -3.64 105.19 104.90 2r8y n GLY 162 Ca 0.13 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.19 2r8y n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r8y n ARG 163 N -2.00 1.98 0.00 1.61 5.12 -0.87 -4.55 116.66 117.95 2r8y n ARG 163 Ca 0.00 -0.62 0.00 0.00 -1.93 0.00 0.00 57.85 55.30 2r8y n ARG 163 Cb 0.00 -1.07 0.00 0.00 -1.16 0.00 0.00 32.46 30.23 2r8y n ARG 163 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2r8y n GLY 164 N 0.83 0.93 0.35 -0.13 0.00 -1.24 -4.87 105.19 101.06 2r8y n GLY 164 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 2r8y n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r8y h ALA 165 N 0.00 1.11 -0.46 4.61 0.00 -1.73 -1.14 119.26 121.65 2r8y h ALA 165 Ca 0.00 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 2r8y h ALA 165 Cb 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2r8y h ALA 165 CO 0.00 0.66 -0.13 0.28 0.00 0.00 0.00 179.25 180.06 2r8y h VAL 166 N 1.22 1.27 -0.74 0.00 2.07 -1.89 -2.11 116.25 116.07 2r8y h VAL 166 Ca 0.30 -1.26 0.05 0.00 0.82 0.00 0.00 66.70 66.61 2r8y h VAL 166 Cb 0.09 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 2r8y h VAL 166 CO -0.04 0.43 0.44 -0.09 0.02 0.00 0.00 177.57 178.33 2r8y h ARG 167 N 0.74 0.80 -0.44 1.57 9.65 -1.75 0.05 114.38 125.00 2r8y h ARG 167 Ca 0.11 -0.05 0.05 0.00 -1.10 0.00 0.00 59.98 59.00 2r8y h ARG 167 Cb 0.68 -0.18 -0.05 0.00 -1.39 0.00 0.00 29.97 29.04 2r8y h ARG 167 CO 0.05 0.53 0.18 1.49 2.80 0.00 0.00 179.97 185.01 2r8y h GLU 168 N 0.82 0.35 -0.47 0.20 4.81 -0.95 0.16 114.58 119.50 2r8y h GLU 168 Ca 0.32 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.47 2r8y h GLU 168 Cb 0.15 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 2r8y h GLU 168 CO -0.16 0.23 0.06 0.28 -0.73 0.00 0.00 179.01 178.69 2r8y h VAL 169 N 0.36 1.25 -0.23 0.32 2.07 -0.87 -1.73 116.25 117.42 2r8y h VAL 169 Ca 0.20 -0.94 0.03 0.00 0.82 0.00 0.00 66.70 66.81 2r8y h VAL 169 Cb 0.17 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 2r8y h VAL 169 CO -0.18 0.33 0.04 0.00 0.02 0.00 0.00 177.57 177.78 2r8y h ASP 171 N 0.13 0.46 -0.19 0.00 3.45 -0.54 -1.68 116.42 118.05 2r8y h ASP 171 Ca 0.11 0.10 -0.03 0.00 0.43 0.00 0.00 57.03 57.63 2r8y h ASP 171 Cb 0.11 0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 38.90 2r8y h ASP 171 CO -0.14 0.19 0.01 0.25 -1.57 0.00 0.00 179.24 177.97 2r8y h LEU 172 N 0.57 0.32 0.18 1.55 5.85 -0.63 0.19 115.31 123.34 2r8y h LEU 172 Ca 0.45 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 2r8y h LEU 172 Cb 0.65 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.60 2r8y h LEU 172 CO -0.37 0.54 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.11 2r8y h LEU 173 N 0.09 -0.21 -0.40 2.25 3.38 -1.14 0.10 115.31 119.39 2r8y h LEU 173 Ca 0.05 -0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.03 2r8y h LEU 173 Cb 0.37 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.12 2r8y h LEU 173 CO 0.01 -0.08 0.05 -0.07 0.09 0.00 0.00 178.44 178.44 2r8y h LEU 174 N -0.32 -0.05 -0.04 1.67 3.38 -1.31 -0.89 115.31 117.75 2r8y h LEU 174 Ca -0.02 0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.05 2r8y h LEU 174 Cb 0.25 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2r8y h LEU 174 CO 0.04 0.01 -0.11 0.25 0.09 0.00 0.00 178.44 178.72 2r8y h LEU 175 N 0.17 -0.34 -2.14 1.67 5.85 -0.45 0.34 115.31 120.41 2r8y h LEU 175 Ca 0.20 0.06 0.05 0.00 0.84 0.00 0.00 57.88 59.03 2r8y h LEU 175 Cb 0.26 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2r8y h LEU 175 CO -0.28 -0.16 0.16 0.00 -0.34 0.00 0.00 178.44 177.82 2r8y h ALA 176 N 0.83 1.98 -0.53 1.25 0.00 -0.28 -2.00 119.26 120.52 2r8y h ALA 176 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2r8y h ALA 176 Cb 0.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2r8y h ALA 176 CO -0.14 -0.26 0.00 1.04 0.00 0.00 0.00 179.25 179.89 2r8y n GLN 177 N -4.15 2.61 -3.49 0.00 6.02 -0.38 -4.53 117.38 113.46 2r8y n GLN 177 Ca 0.02 -2.38 -0.21 0.00 -0.01 0.00 0.00 57.00 54.41 2r8y n GLN 177 Cb 0.29 -1.48 0.07 0.00 1.02 0.00 0.00 30.24 30.15 2r8y n GLN 177 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2r8y n GLY 178 N 1.34 -0.42 0.03 1.08 0.00 -0.75 -4.91 105.19 101.56 2r8y n GLY 178 Ca 0.20 0.17 0.01 0.00 0.00 0.00 0.00 46.02 46.40 2r8y n GLY 178 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2r8y n LYS 179 N -4.57 2.89 -0.07 1.61 5.02 0.11 -4.79 118.16 118.36 2r8y n LYS 179 Ca -0.02 -0.29 -0.09 0.00 -2.02 0.00 0.00 58.31 55.88 2r8y n LYS 179 Cb 0.57 -0.79 0.06 0.00 -0.02 0.00 0.00 35.03 34.84 2r8y n LYS 179 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2r8y h LEU 180 N 0.14 0.79 -0.27 -0.35 5.85 -1.83 -0.03 115.31 119.62 2r8y h LEU 180 Ca 0.00 -0.34 -0.12 0.00 0.84 0.00 0.00 57.88 58.26 2r8y h LEU 180 Cb 0.05 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.85 2r8y h LEU 180 CO 0.00 1.07 -0.29 0.44 -0.34 0.00 0.00 178.44 179.31 2r8y h ASP 181 N 0.63 0.73 0.92 1.25 3.32 -1.91 -3.28 116.42 118.07 2r8y h ASP 181 Ca 0.06 -0.48 -0.19 0.00 0.02 0.00 0.00 57.03 56.44 2r8y h ASP 181 Cb 0.89 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.21 2r8y h ASP 181 CO 0.08 1.06 -0.91 1.05 -1.72 0.00 0.00 179.24 178.80 2r8y h GLU 182 N 0.41 0.00 -6.45 3.56 4.11 -1.86 -3.47 114.58 110.88 2r8y h GLU 182 Ca 0.04 0.00 -0.62 0.00 0.07 0.00 0.00 59.36 58.85 2r8y h GLU 182 Cb 0.86 0.00 0.07 0.00 0.50 0.00 0.00 28.75 30.18 2r8y h GLU 182 CO 0.07 0.91 0.55 0.00 0.07 0.00 0.00 179.01 180.61 2r8y n ALA 183 N -2.36 0.33 -2.47 1.06 0.00 -0.03 -5.01 120.51 112.02 2r8y n ALA 183 Ca -0.00 0.45 -0.26 0.00 0.00 0.00 0.00 53.44 53.63 2r8y n ALA 183 Cb 0.87 -2.20 -0.13 0.00 0.00 0.00 0.00 19.45 17.98 2r8y n ALA 183 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2r8y s LYS 184 N 0.12 1.35 0.32 0.00 -0.14 -1.26 -5.02 119.74 115.09 2r8y s LYS 184 Ca 0.75 -1.10 -0.15 0.00 -1.36 0.00 0.00 55.97 54.10 2r8y s LYS 184 Cb -0.76 -1.58 0.06 0.00 -1.68 0.00 0.00 37.83 33.86 2r8y s LYS 184 CO 0.47 0.39 0.80 0.41 -0.76 0.00 0.00 175.35 176.65 2r8y n GLY 185 N 1.42 0.94 3.34 -3.33 0.00 -1.26 -3.68 105.19 102.62 2r8y n GLY 185 Ca -0.18 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.30 2r8y n GLY 185 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2r8y s GLN 186 N -2.07 2.90 -1.25 1.61 1.11 -1.26 -4.99 119.66 115.71 2r8y s GLN 186 Ca 0.16 -0.78 -0.17 0.00 0.01 0.00 0.00 55.36 54.58 2r8y s GLN 186 Cb -0.04 -2.39 0.10 0.00 -1.01 0.00 0.00 33.01 29.68 2r8y s GLN 186 CO 0.09 0.34 1.61 0.45 0.01 0.00 0.00 175.29 177.80 2r8y s SER 187 N -0.03 6.89 0.00 5.90 0.15 -1.26 -2.73 113.70 122.62 2r8y s SER 187 Ca -0.05 -2.56 0.00 0.00 0.70 0.00 0.00 55.95 54.03 2r8y s SER 187 Cb -0.14 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.65 2r8y s SER 187 CO 0.05 -1.05 0.18 2.30 1.20 0.00 0.00 173.24 175.91