#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 3.24 0.32 -1.18 0.00 -1.26 -0.17 121.76 122.71 2r8y s ALA 9 Ca 0.00 0.64 0.04 0.00 0.00 0.00 0.00 51.96 52.64 2r8y s ALA 9 Cb 0.00 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 2r8y s ALA 9 CO 0.00 -0.27 0.04 0.95 0.00 0.00 0.00 175.76 176.48 2r8y s THR 10 N 0.89 1.29 -1.40 0.00 -4.23 -1.13 -4.95 115.64 106.12 2r8y s THR 10 Ca 0.53 -2.01 0.19 0.00 -1.18 0.00 0.00 61.69 59.22 2r8y s THR 10 Cb -0.24 -2.76 0.32 0.00 1.34 0.00 0.00 72.50 71.16 2r8y s THR 10 CO 0.29 -0.04 1.59 0.00 -0.54 0.00 0.00 174.62 175.92 2r8y n TYR 12 N -1.30 0.00 0.00 0.00 4.02 -1.26 -5.10 117.16 113.52 2r8y n TYR 12 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.98 2r8y n TYR 12 Cb 0.16 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.42 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 1.41 3.35 3.75 2.72 0.00 -0.83 -4.93 105.19 110.67 2r8y n GLY 13 Ca 0.02 -1.81 -0.39 0.00 0.00 0.00 0.00 46.02 43.85 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 -2.38 3.22 0.24 1.61 0.02 -1.26 -2.82 135.00 133.62 2r8y s PRO 14 Ca 0.00 2.26 0.09 0.00 0.02 0.00 0.00 61.00 63.37 2r8y s PRO 14 Cb 0.00 -2.31 -0.05 0.00 0.02 0.00 0.00 34.50 32.16 2r8y s PRO 14 CO 0.00 -1.13 -0.17 0.14 -0.33 0.00 0.00 177.00 175.51 2r8y s VAL 15 N -1.29 2.03 0.66 3.83 -7.23 0.76 -4.91 120.40 114.26 2r8y s VAL 15 Ca 0.70 -2.29 -0.14 0.00 -1.81 0.00 0.00 61.98 58.44 2r8y s VAL 15 Cb -0.41 -2.15 -0.00 0.00 0.56 0.00 0.00 36.38 34.38 2r8y s VAL 15 CO 0.49 -0.52 1.07 -0.94 -0.31 0.00 0.00 175.10 174.89 2r8y s SER 16 N -3.39 5.36 0.31 4.85 1.04 -1.26 -4.67 113.70 115.94 2r8y s SER 16 Ca 0.25 1.81 0.01 0.00 0.48 0.00 0.00 55.95 58.50 2r8y s SER 16 Cb -0.02 -2.53 0.52 0.00 0.10 0.00 0.00 66.02 64.09 2r8y s SER 16 CO 0.10 -1.46 1.88 0.00 0.98 0.00 0.00 173.24 174.74 2r8y h ALA 17 N -0.16 1.33 -0.51 5.32 0.00 -1.99 -1.19 119.26 122.06 2r8y h ALA 17 Ca -0.46 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.24 2r8y h ALA 17 Cb 1.22 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2r8y h ALA 17 CO 0.56 0.48 0.18 0.22 0.00 0.00 0.00 179.25 180.68 2r8y h ASP 18 N 0.70 0.72 -0.65 0.00 3.58 -1.99 -0.40 116.42 118.39 2r8y h ASP 18 Ca 0.16 -0.19 -0.06 0.00 0.42 0.00 0.00 57.03 57.36 2r8y h ASP 18 Cb 0.24 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 2r8y h ASP 18 CO -0.01 0.72 0.18 0.58 -2.88 0.00 0.00 179.24 177.83 2r8y h VAL 19 N 0.68 1.25 -0.63 2.25 2.07 -1.83 -1.80 116.25 118.25 2r8y h VAL 19 Ca 0.17 -0.90 -0.09 0.00 0.82 0.00 0.00 66.70 66.70 2r8y h VAL 19 Cb 0.24 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 2r8y h VAL 19 CO -0.01 0.34 0.05 -0.03 0.02 0.00 0.00 177.57 177.95 2r8y h MET 20 N 0.95 1.08 -0.24 1.57 1.85 -1.02 -0.46 114.93 118.66 2r8y h MET 20 Ca 0.21 -0.32 -0.11 0.00 -0.61 0.00 0.00 59.70 58.86 2r8y h MET 20 Cb 0.33 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 32.24 2r8y h MET 20 CO -0.00 1.02 -0.33 0.00 -0.40 0.00 0.00 176.91 177.20 2r8y h ALA 21 N 1.01 0.97 -0.39 0.39 0.00 -0.99 -1.52 119.26 118.73 2r8y h ALA 21 Ca 0.19 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 2r8y h ALA 21 Cb 0.50 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2r8y h ALA 21 CO 0.02 0.61 0.03 0.87 0.00 0.00 0.00 179.25 180.78 2r8y h LYS 22 N 0.44 0.67 0.00 0.00 1.57 -1.14 -3.08 116.57 115.02 2r8y h LYS 22 Ca 0.05 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 2r8y h LYS 22 Cb 0.79 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 2r8y h LYS 22 CO 0.06 0.74 -0.16 0.00 -0.57 0.00 0.00 179.45 179.53 2r8y h ALA 23 N 0.90 1.62 0.00 3.86 0.00 -0.81 -2.96 119.26 121.87 2r8y h ALA 23 Ca 0.12 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2r8y h ALA 23 Cb 0.42 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2r8y h ALA 23 CO 0.01 0.20 -0.28 1.49 0.00 0.00 0.00 179.25 180.67 2r8y h GLU 24 N 0.00 0.00 -0.12 0.00 4.22 -1.19 -3.08 114.58 114.41 2r8y h GLU 24 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2r8y h GLU 24 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2r8y h GLU 24 CO 0.02 0.28 0.00 0.09 -2.18 0.00 0.00 179.01 177.22 2r8y n ASN 25 N -3.93 2.40 -4.68 1.04 4.13 -1.12 -4.77 115.26 108.34 2r8y n ASN 25 Ca -0.02 -1.80 -0.43 0.00 1.68 0.00 0.00 54.58 54.02 2r8y n ASN 25 Cb 0.35 -0.07 -0.02 0.00 -1.54 0.00 0.00 39.78 38.50 2r8y n ASN 25 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2r8y s ILE 26 N -1.87 4.47 -0.04 2.41 -1.09 -1.16 -4.53 121.20 119.38 2r8y s ILE 26 Ca 0.34 1.77 0.09 0.00 -2.23 0.00 0.00 60.65 60.61 2r8y s ILE 26 Cb 0.20 -4.14 -0.13 0.00 -1.58 0.00 0.00 42.46 36.81 2r8y s ILE 26 CO 0.31 -0.04 0.21 0.54 -1.23 0.00 0.00 174.94 174.73 2r8y n ARG 27 N 5.45 0.57 -3.93 2.79 5.12 0.02 -4.84 116.66 121.82 2r8y n ARG 27 Ca 0.11 -0.08 -0.20 0.00 -1.93 0.00 0.00 57.85 55.76 2r8y n ARG 27 Cb 0.47 -1.19 -0.17 0.00 -1.16 0.00 0.00 32.46 30.41 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 -3.52 0.99 -0.28 0.55 2.96 -1.04 0.29 118.68 118.63 2r8y s LEU 28 Ca -0.03 -0.06 -0.01 0.00 -0.22 0.00 0.00 54.13 53.81 2r8y s LEU 28 Cb 0.06 -0.34 0.04 0.00 0.50 0.00 0.00 46.19 46.45 2r8y s LEU 28 CO 0.37 -0.12 -0.04 -0.22 -1.32 0.00 0.00 176.35 175.02 2r8y s LEU 29 N 1.32 3.58 -0.16 -0.68 2.96 0.20 -0.53 118.68 125.37 2r8y s LEU 29 Ca -0.05 -1.14 -0.10 0.00 -0.22 0.00 0.00 54.13 52.62 2r8y s LEU 29 Cb -0.13 -1.67 -0.05 0.00 0.50 0.00 0.00 46.19 44.84 2r8y s LEU 29 CO -0.02 -0.20 0.16 -0.63 -1.32 0.00 0.00 176.35 174.33 2r8y s ILE 30 N 1.26 5.42 -0.03 6.68 1.01 0.13 -0.60 121.20 135.07 2r8y s ILE 30 Ca -0.04 0.25 0.06 0.00 0.00 0.00 0.00 60.65 60.93 2r8y s ILE 30 Cb -0.19 -3.47 -0.01 0.00 0.01 0.00 0.00 42.46 38.80 2r8y s ILE 30 CO -0.03 0.50 -0.22 -0.76 0.00 0.00 0.00 174.94 174.43 2r8y s LEU 31 N -0.13 2.02 0.67 2.97 1.43 0.31 -1.83 118.68 124.11 2r8y s LEU 31 Ca 0.12 -0.42 -0.11 0.00 -1.03 0.00 0.00 54.13 52.68 2r8y s LEU 31 Cb -0.12 -1.17 -0.01 0.00 0.03 0.00 0.00 46.19 44.92 2r8y s LEU 31 CO 0.01 0.24 1.05 -0.62 0.23 0.00 0.00 176.35 177.26 2r8y s ASP 32 N -0.30 5.65 0.00 2.29 3.68 -0.94 -1.80 116.67 125.25 2r8y s ASP 32 Ca 0.03 1.58 0.00 0.00 2.13 0.00 0.00 52.55 56.28 2r8y s ASP 32 Cb -0.11 -2.49 0.00 0.00 -1.45 0.00 0.00 42.92 38.87 2r8y s ASP 32 CO 0.01 -1.26 0.00 0.52 0.13 0.00 0.00 175.17 174.57 2r8y n VAL 33 N -2.94 0.00 -1.97 1.11 0.31 -1.26 -3.88 118.33 109.70 2r8y n VAL 33 Ca 0.07 0.10 -0.43 0.00 -0.01 0.00 0.00 64.34 64.07 2r8y n VAL 33 Cb 0.54 -0.91 -0.03 0.00 -0.91 0.00 0.00 33.84 32.53 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 -1.54 6.40 0.00 4.52 1.01 -1.26 0.02 116.67 125.82 2r8y s ASP 34 Ca 0.00 2.00 0.00 0.00 0.71 0.00 0.00 52.55 55.26 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 -1.18 0.00 0.61 0.21 0.00 0.00 175.17 174.81 2r8y n GLY 35 N 4.57 0.78 0.93 0.21 0.00 -1.03 -4.74 105.19 105.90 2r8y n GLY 35 Ca 0.19 0.00 -0.02 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 0.78 0.86 1.61 0.31 -0.09 -4.20 118.33 115.60 2r8y n VAL 36 Ca 0.00 0.19 0.12 0.00 -0.01 0.00 0.00 64.34 64.65 2r8y n VAL 36 Cb 0.00 -1.61 0.31 0.00 -0.91 0.00 0.00 33.84 31.63 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 -3.40 0.47 -4.39 7.52 4.77 0.10 -1.90 117.00 120.17 2r8y n LEU 37 Ca -0.04 0.20 -0.21 0.00 -0.03 0.00 0.00 56.01 55.94 2r8y n LEU 37 Cb 0.27 -0.29 -0.09 0.00 -2.33 0.00 0.00 43.42 40.99 2r8y n LEU 37 CO 0.01 0.03 -0.20 -0.94 -1.33 0.00 0.00 177.39 174.96 2r8y s SER 38 N -3.43 1.93 0.00 -1.43 1.04 -1.15 -4.11 113.70 106.55 2r8y s SER 38 Ca 0.10 -1.57 0.08 0.00 0.48 0.00 0.00 55.95 55.04 2r8y s SER 38 Cb 0.16 0.36 0.29 0.00 0.10 0.00 0.00 66.02 66.94 2r8y s SER 38 CO 0.67 -0.87 1.21 -0.90 0.98 0.00 0.00 173.24 174.33 2r8y n ASP 39 N -1.00 0.81 0.00 7.02 3.85 -1.24 -2.34 116.55 123.65 2r8y n ASP 39 Ca -0.01 -1.91 0.00 0.00 -0.71 0.00 0.00 54.79 52.16 2r8y n ASP 39 Cb 0.65 -0.09 0.00 0.00 -1.35 0.00 0.00 41.12 40.33 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 0.78 0.39 3.81 6.12 0.00 -1.26 -4.65 105.19 110.39 2r8y n GLY 40 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 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 4.35 -0.23 0.99 1.43 -1.26 -4.73 118.68 119.23 2r8y s LEU 41 Ca 0.00 1.43 0.01 0.00 -1.03 0.00 0.00 54.13 54.54 2r8y s LEU 41 Cb 0.00 -3.57 0.05 0.00 0.03 0.00 0.00 46.19 42.70 2r8y s LEU 41 CO 0.00 0.04 -0.09 -0.63 0.23 0.00 0.00 176.35 175.90 2r8y s ILE 42 N -1.50 1.77 -0.05 -0.59 -1.09 -1.26 -4.73 121.20 113.75 2r8y s ILE 42 Ca 0.43 -1.27 -0.23 0.00 -2.23 0.00 0.00 60.65 57.35 2r8y s ILE 42 Cb -0.17 -1.92 -0.04 0.00 -1.58 0.00 0.00 42.46 38.75 2r8y s ILE 42 CO 0.21 0.03 0.67 -0.31 -1.23 0.00 0.00 174.94 174.31 2r8y s TYR 43 N 1.30 3.61 0.02 3.97 1.51 -0.83 -4.98 117.35 121.95 2r8y s TYR 43 Ca -0.05 1.23 0.05 0.00 -1.01 0.00 0.00 57.07 57.29 2r8y s TYR 43 Cb -0.18 -2.75 -0.02 0.00 -0.11 0.00 0.00 41.96 38.90 2r8y s TYR 43 CO -0.07 0.16 -0.14 -1.64 -1.11 0.00 0.00 175.55 172.75 2r8y s MET 44 N 0.52 1.01 0.33 -0.62 -1.94 -1.26 -1.62 119.30 115.72 2r8y s MET 44 Ca 0.36 -0.66 0.04 0.00 -1.71 0.00 0.00 55.69 53.72 2r8y s MET 44 Cb -0.18 -1.01 -0.06 0.00 2.01 0.00 0.00 34.83 35.59 2r8y s MET 44 CO 0.18 0.26 0.05 0.20 -0.01 0.00 0.00 175.02 175.70 2r8y s GLY 45 N -0.82 2.10 0.50 -0.03 0.00 -0.63 -4.99 107.32 103.45 2r8y s GLY 45 Ca 0.03 -2.07 0.24 0.00 0.00 0.00 0.00 44.72 42.92 2r8y s GLY 45 CO 0.01 -1.83 2.05 3.43 0.00 0.00 0.00 173.10 176.75 2r8y h ASN 46 N 2.10 0.00 -0.56 1.64 2.35 -2.02 -1.50 115.58 117.59 2r8y h ASN 46 Ca -0.41 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 2r8y h ASN 46 Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 2r8y h ASN 46 CO 0.70 0.14 0.00 0.59 -1.65 0.00 0.00 177.43 177.21 2r8y n ASN 47 N -3.80 5.14 0.00 5.81 5.03 -1.26 -4.91 115.26 121.26 2r8y n ASN 47 Ca -0.02 -2.73 0.00 0.00 0.87 0.00 0.00 54.58 52.70 2r8y n ASN 47 Cb 0.24 -0.64 0.00 0.00 -1.02 0.00 0.00 39.78 38.36 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 0.53 3.74 7.41 0.00 -0.56 -5.03 105.19 112.02 2r8y n GLY 48 Ca 0.25 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.03 2.82 -0.02 1.61 8.01 -1.26 -4.81 118.70 125.03 2r8y s GLU 49 Ca 0.00 2.17 0.01 0.00 0.01 0.00 0.00 54.97 57.16 2r8y s GLU 49 Cb 0.00 -2.04 0.01 0.00 -4.31 0.00 0.00 34.13 27.78 2r8y s GLU 49 CO 0.00 -1.42 -0.04 -2.00 0.01 0.00 0.00 175.26 171.81 2r8y s GLU 50 N -3.15 0.51 0.20 1.61 2.12 -1.26 -1.60 118.70 117.13 2r8y s GLU 50 Ca 0.77 -0.11 0.10 0.00 0.36 0.00 0.00 54.97 56.09 2r8y s GLU 50 Cb -0.40 -0.54 -0.04 0.00 0.26 0.00 0.00 34.13 33.41 2r8y s GLU 50 CO 0.44 0.01 -0.20 -0.51 -0.54 0.00 0.00 175.26 174.46 2r8y s LEU 51 N 0.38 2.48 -0.01 2.70 1.43 -0.64 -4.99 118.68 120.02 2r8y s LEU 51 Ca -0.04 -0.91 -0.06 0.00 -1.03 0.00 0.00 54.13 52.09 2r8y s LEU 51 Cb -0.08 -0.99 0.00 0.00 0.03 0.00 0.00 46.19 45.16 2r8y s LEU 51 CO -0.00 0.02 0.13 -0.75 0.23 0.00 0.00 176.35 175.98 2r8y s LYS 52 N -2.97 0.37 -0.19 1.70 2.20 -1.26 -1.97 119.74 117.62 2r8y s LYS 52 Ca 0.21 -0.22 -0.05 0.00 -0.36 0.00 0.00 55.97 55.55 2r8y s LYS 52 Cb -0.06 0.16 -0.03 0.00 -1.51 0.00 0.00 37.83 36.39 2r8y s LYS 52 CO 0.09 -0.08 0.00 0.00 -0.36 0.00 0.00 175.35 175.01 2r8y s ALA 53 N -0.92 3.07 0.25 3.13 0.00 -1.26 -5.09 121.76 120.95 2r8y s ALA 53 Ca -0.10 -0.92 0.08 0.00 0.00 0.00 0.00 51.96 51.02 2r8y s ALA 53 Cb -0.06 -1.74 -0.04 0.00 0.00 0.00 0.00 23.12 21.28 2r8y s ALA 53 CO 0.01 -0.02 0.08 -0.06 0.00 0.00 0.00 175.76 175.76 2r8y s PHE 54 N 0.77 2.87 -0.18 0.00 0.40 -1.26 -4.33 117.98 116.25 2r8y s PHE 54 Ca 0.00 -0.17 -0.05 0.00 -0.60 0.00 0.00 56.93 56.11 2r8y s PHE 54 Cb -0.14 -1.29 -0.03 0.00 0.51 0.00 0.00 43.02 42.07 2r8y s PHE 54 CO 0.02 0.58 -0.00 1.21 0.70 0.00 0.00 175.22 177.72 2r8y s ASN 55 N -3.70 4.94 0.31 1.36 3.04 -1.26 -5.00 114.94 114.63 2r8y s ASN 55 Ca 0.32 -0.13 -0.01 0.00 0.04 0.00 0.00 52.86 53.08 2r8y s ASN 55 Cb -0.07 -1.83 0.50 0.00 -1.54 0.00 0.00 41.25 38.30 2r8y s ASN 55 CO 0.22 0.12 1.96 -0.37 -3.04 0.00 0.00 177.10 175.98 2r8y h VAL 56 N 5.23 1.16 -0.56 -5.21 -1.51 -1.92 -1.81 116.25 111.63 2r8y h VAL 56 Ca -0.34 -0.36 0.03 0.00 -1.23 0.00 0.00 66.70 64.79 2r8y h VAL 56 Cb 1.18 0.02 -0.03 0.00 -2.13 0.00 0.00 31.29 30.33 2r8y h VAL 56 CO 0.63 0.19 0.37 -0.09 -1.23 0.00 0.00 177.57 177.44 2r8y h ARG 57 N 1.06 0.65 -0.34 5.19 2.43 -1.94 0.11 114.38 121.55 2r8y h ARG 57 Ca 0.32 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.41 2r8y h ARG 57 Cb -0.03 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 2r8y h ARG 57 CO -0.08 0.43 0.05 -0.44 -1.51 0.00 0.00 179.97 178.41 2r8y h ASP 58 N 0.67 0.54 -0.58 -3.80 3.32 -1.71 -2.73 116.42 112.14 2r8y h ASP 58 Ca 0.22 -0.27 0.09 0.00 0.02 0.00 0.00 57.03 57.09 2r8y h ASP 58 Cb 0.04 -0.14 -0.07 0.00 0.22 0.00 0.00 39.33 39.38 2r8y h ASP 58 CO -0.06 0.67 0.21 1.23 -1.72 0.00 0.00 179.24 179.58 2r8y h GLY 59 N 0.39 0.79 0.44 2.75 0.00 -0.77 0.11 103.07 106.79 2r8y h GLY 59 Ca 0.10 -0.11 0.08 0.00 0.00 0.00 0.00 47.33 47.40 2r8y h GLY 59 CO 0.01 -0.01 0.14 -1.82 0.00 0.00 0.00 176.54 174.85 2r8y h TYR 60 N 0.39 0.23 -0.64 5.60 5.03 -0.91 -0.36 116.97 126.30 2r8y h TYR 60 Ca 0.29 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.61 2r8y h TYR 60 Cb 0.34 -0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.56 2r8y h TYR 60 CO -0.17 0.04 0.33 0.78 -1.32 0.00 0.00 178.16 177.83 2r8y h GLY 61 N 0.29 0.98 1.02 1.82 0.00 -0.97 -1.90 103.07 104.31 2r8y h GLY 61 Ca 0.24 -0.46 -0.07 0.00 0.00 0.00 0.00 47.33 47.05 2r8y h GLY 61 CO -0.28 0.44 0.10 -2.22 0.00 0.00 0.00 176.54 174.58 2r8y h ILE 62 N 0.88 1.25 -0.64 2.60 2.04 -0.46 -1.86 117.51 121.34 2r8y h ILE 62 Ca 0.22 -0.96 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 2r8y h ILE 62 Cb 0.08 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 2r8y h ILE 62 CO -0.03 0.35 0.39 0.03 0.00 0.00 0.00 178.15 178.89 2r8y h ARG 63 N 0.84 0.86 -0.49 2.37 2.47 -1.01 -1.18 114.38 118.24 2r8y h ARG 63 Ca 0.17 -0.07 0.01 0.00 -1.26 0.00 0.00 59.98 58.83 2r8y h ARG 63 Cb 0.40 -0.18 -0.03 0.00 -1.65 0.00 0.00 29.97 28.51 2r8y h ARG 63 CO 0.01 0.61 0.31 0.00 0.56 0.00 0.00 179.97 181.46 2r8y h ALA 65 N 1.20 -0.02 -0.58 0.00 0.00 -1.21 -2.28 119.26 116.36 2r8y h ALA 65 Ca 0.19 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.06 2r8y h ALA 65 Cb -0.03 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2r8y h ALA 65 CO -0.06 -0.46 0.39 -0.07 0.00 0.00 0.00 179.25 179.05 2r8y h LEU 66 N -0.13 0.64 -1.45 0.00 3.38 -1.04 -0.07 115.31 116.63 2r8y h LEU 66 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2r8y h LEU 66 Cb 0.12 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2r8y h LEU 66 CO 0.00 0.45 0.00 0.35 0.09 0.00 0.00 178.44 179.33 2r8y n THR 67 N -4.46 0.47 -2.12 0.22 -2.24 -0.60 -3.97 114.28 101.59 2r8y n THR 67 Ca 0.06 -0.51 -0.06 0.00 -2.27 0.00 0.00 64.05 61.28 2r8y n THR 67 Cb 0.08 0.33 0.08 0.00 -2.10 0.00 0.00 70.33 68.72 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 0.65 2.65 -2.13 3.42 7.64 -0.12 -4.99 113.62 120.74 2r8y n SER 68 Ca 0.15 -3.19 -0.20 0.00 1.01 0.00 0.00 58.87 56.63 2r8y n SER 68 Cb 0.35 -0.42 -0.03 0.00 -1.01 0.00 0.00 64.21 63.11 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 -0.61 -5.66 -4.30 6.43 4.64 -1.18 -4.97 116.55 110.89 2r8y n ASP 69 Ca 0.23 0.09 -0.35 0.00 -1.38 0.00 0.00 54.79 53.38 2r8y n ASP 69 Cb 0.88 -4.74 -0.14 0.00 -1.04 0.00 0.00 41.12 36.09 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 -2.95 3.34 0.51 5.18 1.01 -0.71 -4.80 121.20 122.78 2r8y s ILE 70 Ca 0.00 -0.56 -0.20 0.00 0.00 0.00 0.00 60.65 59.89 2r8y s ILE 70 Cb 0.00 -2.55 -0.08 0.00 0.01 0.00 0.00 42.46 39.84 2r8y s ILE 70 CO 0.00 0.38 1.06 -1.61 0.00 0.00 0.00 174.94 174.77 2r8y s GLU 71 N 1.46 3.68 -0.09 2.79 0.41 0.15 -3.34 118.70 123.76 2r8y s GLU 71 Ca 0.05 1.40 0.01 0.00 -0.41 0.00 0.00 54.97 56.01 2r8y s GLU 71 Cb -0.15 -2.07 0.02 0.00 -1.78 0.00 0.00 34.13 30.15 2r8y s GLU 71 CO -0.03 -0.54 -0.10 0.08 -0.49 0.00 0.00 175.26 174.18 2r8y s VAL 72 N -1.98 1.08 0.17 2.63 1.01 -1.26 0.58 120.40 122.63 2r8y s VAL 72 Ca 0.68 -0.37 0.07 0.00 0.00 0.00 0.00 61.98 62.36 2r8y s VAL 72 Cb -0.18 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 2r8y s VAL 72 CO 0.23 0.36 -0.15 0.00 0.00 0.00 0.00 175.10 175.54 2r8y s ALA 73 N 1.27 1.84 -0.05 5.51 0.00 0.24 -4.33 121.76 126.24 2r8y s ALA 73 Ca -0.03 -1.50 0.05 0.00 0.00 0.00 0.00 51.96 50.48 2r8y s ALA 73 Cb -0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 2r8y s ALA 73 CO -0.03 0.12 -0.20 0.42 0.00 0.00 0.00 175.76 176.06 2r8y s ILE 74 N -2.49 1.68 -0.15 0.00 1.01 0.40 -0.53 121.20 121.11 2r8y s ILE 74 Ca 0.16 -0.85 -0.01 0.00 0.00 0.00 0.00 60.65 59.96 2r8y s ILE 74 Cb -0.03 -1.44 0.04 0.00 0.01 0.00 0.00 42.46 41.04 2r8y s ILE 74 CO 0.05 0.48 -0.05 -0.63 0.00 0.00 0.00 174.94 174.79 2r8y s ILE 75 N 0.01 1.03 0.05 2.92 1.01 -0.74 -0.39 121.20 125.09 2r8y s ILE 75 Ca -0.05 -0.53 0.04 0.00 0.00 0.00 0.00 60.65 60.11 2r8y s ILE 75 Cb -0.13 -1.19 -0.02 0.00 0.01 0.00 0.00 42.46 41.13 2r8y s ILE 75 CO 0.03 0.16 -0.11 0.28 0.00 0.00 0.00 174.94 175.30 2r8y s THR 76 N 1.68 0.85 0.17 2.92 -1.32 -0.22 -4.28 115.64 115.44 2r8y s THR 76 Ca 0.02 -1.12 0.00 0.00 -1.21 0.00 0.00 61.69 59.38 2r8y s THR 76 Cb -0.15 -0.84 -0.12 0.00 -1.51 0.00 0.00 72.50 69.88 2r8y s THR 76 CO -0.08 -0.24 1.41 1.23 -2.21 0.00 0.00 174.62 174.74 2r8y h GLY 77 N 4.55 0.34 -0.94 6.08 0.00 -1.86 -1.23 103.07 110.00 2r8y h GLY 77 Ca -0.38 -0.52 -0.46 0.00 0.00 0.00 0.00 47.33 45.97 2r8y h GLY 77 CO 0.41 0.47 0.30 0.50 0.00 0.00 0.00 176.54 178.22 2r8y s ARG 78 N -3.45 1.99 -0.06 4.80 0.52 -1.26 -3.48 118.95 118.02 2r8y s ARG 78 Ca -0.04 -0.17 -0.02 0.00 -0.52 0.00 0.00 55.73 54.97 2r8y s ARG 78 Cb 0.10 -2.08 0.03 0.00 0.52 0.00 0.00 34.95 33.52 2r8y s ARG 78 CO 0.83 -1.45 0.04 0.21 0.02 0.00 0.00 175.30 174.95 2r8y s LYS 79 N -5.40 0.18 -0.09 3.54 2.20 -1.26 -0.89 119.74 118.01 2r8y s LYS 79 Ca 0.62 0.26 -0.11 0.00 -0.36 0.00 0.00 55.97 56.38 2r8y s LYS 79 Cb -0.10 -0.73 0.03 0.00 -1.51 0.00 0.00 37.83 35.52 2r8y s LYS 79 CO 0.47 -0.33 0.30 0.00 -0.36 0.00 0.00 175.35 175.42 2r8y s ALA 80 N 2.10 -0.73 0.34 3.13 0.00 -1.26 -4.98 121.76 120.35 2r8y s ALA 80 Ca 0.05 0.72 0.02 0.00 0.00 0.00 0.00 51.96 52.75 2r8y s ALA 80 Cb -0.12 -0.38 0.61 0.00 0.00 0.00 0.00 23.12 23.23 2r8y s ALA 80 CO -0.04 -0.16 1.98 -0.22 0.00 0.00 0.00 175.76 177.32 2r8y h LYS 81 N 5.32 0.81 -0.06 0.00 1.63 -2.01 -2.39 116.57 119.88 2r8y h LYS 81 Ca -0.27 -0.07 0.02 0.00 -0.85 0.00 0.00 60.65 59.48 2r8y h LYS 81 Cb 1.19 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 32.64 2r8y h LYS 81 CO 0.33 0.58 0.05 1.37 -3.45 0.00 0.00 179.45 178.33 2r8y h LEU 82 N 0.83 0.00 -0.29 5.20 8.10 -1.96 -1.57 115.31 125.62 2r8y h LEU 82 Ca 0.22 0.00 -0.19 0.00 0.11 0.00 0.00 57.88 58.01 2r8y h LEU 82 Cb -0.03 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.20 2r8y h LEU 82 CO -0.04 0.00 -0.60 0.58 -4.11 0.00 0.00 178.44 174.27 2r8y h VAL 83 N 0.00 1.28 -0.14 0.15 2.07 -1.86 -1.53 116.25 116.22 2r8y h VAL 83 Ca 0.03 -1.80 0.02 0.00 0.82 0.00 0.00 66.70 65.78 2r8y h VAL 83 Cb 0.13 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 2r8y h VAL 83 CO -0.00 0.58 0.01 -0.33 0.02 0.00 0.00 177.57 177.85 2r8y h GLU 84 N 0.62 0.05 -0.56 1.57 5.08 -1.35 -1.08 114.58 118.91 2r8y h GLU 84 Ca -0.00 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.44 2r8y h GLU 84 Cb 1.21 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.38 2r8y h GLU 84 CO 0.13 0.03 0.19 -0.44 -1.00 0.00 0.00 179.01 177.93 2r8y h ASP 85 N 0.05 0.18 -0.63 1.42 3.32 -1.22 -0.34 116.42 119.20 2r8y h ASP 85 Ca 0.06 0.07 -0.09 0.00 0.02 0.00 0.00 57.03 57.10 2r8y h ASP 85 Cb 0.07 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 2r8y h ASP 85 CO -0.10 0.12 0.06 -0.09 -1.72 0.00 0.00 179.24 177.51 2r8y h ARG 86 N 0.37 1.08 -0.70 3.56 9.65 -1.07 -0.88 114.38 126.39 2r8y h ARG 86 Ca 0.28 -0.31 -0.03 0.00 -1.10 0.00 0.00 59.98 58.82 2r8y h ARG 86 Cb 0.33 -0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 28.76 2r8y h ARG 86 CO -0.29 1.01 0.31 0.00 2.80 0.00 0.00 179.97 183.81 2r8y h ALA 88 N 1.34 -0.25 -1.00 0.00 0.00 -0.60 0.39 119.26 119.13 2r8y h ALA 88 Ca 0.24 -0.06 0.22 0.00 0.00 0.00 0.00 54.91 55.31 2r8y h ALA 88 Cb 0.14 0.10 -0.11 0.00 0.00 0.00 0.00 17.79 17.91 2r8y h ALA 88 CO -0.03 -0.63 0.61 1.15 0.00 0.00 0.00 179.25 180.35 2r8y h THR 89 N -0.27 0.62 -0.01 0.00 2.02 -0.83 -1.98 112.91 112.48 2r8y h THR 89 Ca -0.03 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2r8y h THR 89 Cb 0.21 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.53 2r8y h THR 89 CO 0.04 0.12 -0.67 0.18 0.37 0.00 0.00 175.52 175.56 2r8y n LEU 90 N -4.79 1.30 -1.28 2.58 4.77 -0.87 -4.97 117.00 113.74 2r8y n LEU 90 Ca 0.25 -0.50 -0.08 0.00 -0.03 0.00 0.00 56.01 55.64 2r8y n LEU 90 Cb 0.67 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.73 2r8y n LEU 90 CO 0.20 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 2r8y n GLY 91 N 1.45 0.23 3.69 -0.72 0.00 0.14 -4.76 105.19 105.23 2r8y n GLY 91 Ca 0.07 -0.44 -0.40 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.77 5.00 0.00 -0.61 1.01 0.11 -4.94 121.20 119.01 2r8y s ILE 92 Ca 0.11 1.44 0.00 0.00 0.00 0.00 0.00 60.65 62.20 2r8y s ILE 92 Cb -0.05 -4.04 0.00 0.00 0.01 0.00 0.00 42.46 38.38 2r8y s ILE 92 CO 0.14 0.17 0.71 0.35 0.00 0.00 0.00 174.94 176.31 2r8y n THR 93 N 4.18 0.43 -3.87 2.92 -2.24 -1.26 -4.38 114.28 110.06 2r8y n THR 93 Ca 0.00 -0.71 -0.33 0.00 -2.27 0.00 0.00 64.05 60.74 2r8y n THR 93 Cb 0.50 0.79 -0.13 0.00 -2.10 0.00 0.00 70.33 69.40 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 -0.43 3.37 -0.10 4.78 3.76 -1.26 -5.07 115.29 120.34 2r8y s HIS 94 Ca 0.00 -2.95 0.02 0.00 -0.15 0.00 0.00 55.06 51.98 2r8y s HIS 94 Cb 0.00 -2.99 0.01 0.00 1.11 0.00 0.00 32.58 30.72 2r8y s HIS 94 CO 0.00 -0.82 -0.15 -1.17 -0.85 0.00 0.00 174.74 171.75 2r8y s LEU 95 N 0.07 1.70 -0.19 0.89 2.96 -1.26 -0.46 118.68 122.39 2r8y s LEU 95 Ca 0.15 -0.41 0.01 0.00 -0.22 0.00 0.00 54.13 53.66 2r8y s LEU 95 Cb -0.23 -1.05 0.04 0.00 0.50 0.00 0.00 46.19 45.45 2r8y s LEU 95 CO -0.03 0.02 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.59 2r8y s TYR 96 N 0.95 2.48 0.40 5.38 1.51 0.48 -4.98 117.35 123.56 2r8y s TYR 96 Ca -0.08 -1.60 0.08 0.00 -1.01 0.00 0.00 57.07 54.46 2r8y s TYR 96 Cb -0.15 -1.68 -0.04 0.00 -0.11 0.00 0.00 41.96 39.98 2r8y s TYR 96 CO -0.01 -0.75 0.21 -0.65 -1.11 0.00 0.00 175.55 173.24 2r8y s GLN 97 N 1.38 2.32 -1.80 -0.62 -0.21 -1.26 -1.05 119.66 118.41 2r8y s GLN 97 Ca -0.00 -1.71 0.00 0.00 0.02 0.00 0.00 55.36 53.66 2r8y s GLN 97 Cb -0.16 -2.10 0.00 0.00 1.00 0.00 0.00 33.01 31.75 2r8y s GLN 97 CO -0.09 -0.07 0.00 0.41 -2.12 0.00 0.00 175.29 173.42 2r8y n GLY 98 N -1.27 0.12 3.16 3.09 0.00 -0.07 -4.91 105.19 105.31 2r8y n GLY 98 Ca -0.01 -0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 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 -4.68 2.28 -0.06 1.61 2.00 -0.50 -4.91 119.66 115.40 2r8y s GLN 99 Ca 0.00 -1.46 0.20 0.00 -2.00 0.00 0.00 55.36 52.10 2r8y s GLN 99 Cb 0.00 -3.34 -0.27 0.00 0.80 0.00 0.00 33.01 30.20 2r8y s GLN 99 CO 0.00 -0.78 0.41 0.43 -0.50 0.00 0.00 175.29 174.85 2r8y n SER 100 N 4.62 0.15 -4.40 6.67 7.64 -1.26 -3.33 113.62 123.71 2r8y n SER 100 Ca -0.09 0.06 -0.45 0.00 1.01 0.00 0.00 58.87 59.40 2r8y n SER 100 Cb 0.43 1.37 -0.01 0.00 -1.01 0.00 0.00 64.21 64.98 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 -5.04 6.97 0.28 6.43 2.47 -1.26 -4.89 114.94 119.91 2r8y s ASN 101 Ca -0.08 -2.86 0.25 0.00 0.42 0.00 0.00 52.86 50.59 2r8y s ASN 101 Cb 0.10 -2.31 1.00 0.00 -1.45 0.00 0.00 41.25 38.60 2r8y s ASN 101 CO 0.87 -0.66 1.74 0.11 -3.72 0.00 0.00 177.10 175.43 2r8y h LYS 102 N 7.56 0.00 0.00 0.43 1.57 -1.86 -2.32 116.57 121.96 2r8y h LYS 102 Ca 0.20 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 2r8y h LYS 102 Cb 0.94 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.25 2r8y h LYS 102 CO 1.05 0.00 -0.10 -0.07 -0.57 0.00 0.00 179.45 179.75 2r8y h LEU 103 N 0.00 0.00 0.29 2.94 3.38 -1.94 -1.47 115.31 118.51 2r8y h LEU 103 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2r8y h LEU 103 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2r8y h LEU 103 CO 0.00 0.10 -0.14 0.40 0.09 0.00 0.00 178.44 178.89 2r8y h ILE 104 N 0.00 0.74 -0.30 1.22 2.04 -1.84 -2.31 117.51 117.05 2r8y h ILE 104 Ca -0.00 -0.53 -0.07 0.00 1.00 0.00 0.00 64.86 65.26 2r8y h ILE 104 Cb 0.43 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 2r8y h ILE 104 CO 0.01 0.11 -0.12 0.00 0.00 0.00 0.00 178.15 178.15 2r8y h ALA 105 N -0.09 1.24 -0.07 1.87 0.00 -1.69 -2.63 119.26 117.89 2r8y h ALA 105 Ca -0.04 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 2r8y h ALA 105 Cb 0.48 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2r8y h ALA 105 CO 0.07 0.50 0.03 0.35 0.00 0.00 0.00 179.25 180.19 2r8y h PHE 106 N 0.47 0.10 -0.54 0.00 3.04 -1.29 -1.37 116.94 117.35 2r8y h PHE 106 Ca 0.09 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 62.06 2r8y h PHE 106 Cb 0.50 -0.03 -0.04 0.00 2.56 0.00 0.00 35.95 38.94 2r8y h PHE 106 CO 0.02 0.21 0.31 0.77 -2.02 0.00 0.00 178.31 177.60 2r8y h SER 107 N -0.04 0.48 -0.32 0.41 0.02 -1.35 -1.35 113.55 111.40 2r8y h SER 107 Ca 0.02 0.01 0.07 0.00 -0.84 0.00 0.00 61.79 61.05 2r8y h SER 107 Cb 0.16 -0.08 -0.06 0.00 0.14 0.00 0.00 62.40 62.55 2r8y h SER 107 CO -0.00 0.33 -0.09 -0.78 -1.14 0.00 0.00 176.83 175.15 2r8y h ASP 108 N 0.60 -0.32 -0.68 3.07 3.58 -1.28 -1.12 116.42 120.27 2r8y h ASP 108 Ca 0.23 0.10 -0.07 0.00 0.42 0.00 0.00 57.03 57.71 2r8y h ASP 108 Cb 0.07 0.21 -0.03 0.00 1.72 0.00 0.00 39.33 41.30 2r8y h ASP 108 CO -0.12 -0.11 0.15 -0.07 -2.88 0.00 0.00 179.24 176.21 2r8y h LEU 109 N -0.01 1.04 -0.86 2.28 3.38 -0.92 -0.62 115.31 119.61 2r8y h LEU 109 Ca 0.16 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 2r8y h LEU 109 Cb 0.25 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2r8y h LEU 109 CO -0.34 1.01 0.00 -0.07 0.09 0.00 0.00 178.44 179.13 2r8y h LEU 110 N 1.02 0.82 -0.18 1.67 3.38 -0.92 -0.64 115.31 120.46 2r8y h LEU 110 Ca 0.21 -0.21 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 2r8y h LEU 110 Cb 0.38 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.92 2r8y h LEU 110 CO 0.00 0.88 -0.82 -0.33 0.09 0.00 0.00 178.44 178.27 2r8y h GLU 111 N 0.79 0.69 -0.24 1.13 4.39 -1.07 -2.16 114.58 118.11 2r8y h GLU 111 Ca 0.15 -0.60 -0.17 0.00 0.34 0.00 0.00 59.36 59.08 2r8y h GLU 111 Cb 0.47 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 2r8y h GLU 111 CO 0.02 1.21 -0.52 0.87 -1.16 0.00 0.00 179.01 179.43 2r8y h LYS 112 N 0.45 0.77 -0.02 2.33 1.57 -1.01 -3.27 116.57 117.39 2r8y h LYS 112 Ca -0.06 -0.51 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2r8y h LYS 112 Cb 1.45 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.82 2r8y h LYS 112 CO 0.16 1.14 -0.05 1.28 -0.57 0.00 0.00 179.45 181.41 2r8y n LEU 113 N -4.09 2.02 -3.79 2.94 4.77 -0.26 -4.97 117.00 113.62 2r8y n LEU 113 Ca -0.05 -0.67 -0.25 0.00 -0.03 0.00 0.00 56.01 55.01 2r8y n LEU 113 Cb 0.61 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.70 2r8y n LEU 113 CO 0.49 0.34 -0.14 0.00 -1.33 0.00 0.00 177.39 176.75 2r8y n ALA 114 N 0.50 -2.13 -3.28 -1.18 0.00 -0.86 -4.97 120.51 108.59 2r8y n ALA 114 Ca 0.16 -0.22 -0.28 0.00 0.00 0.00 0.00 53.44 53.10 2r8y n ALA 114 Cb 0.45 -2.23 -0.17 0.00 0.00 0.00 0.00 19.45 17.50 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 -3.75 1.62 0.33 0.00 2.07 -0.91 -5.06 121.20 115.49 2r8y s ILE 115 Ca 0.10 -0.77 -0.28 0.00 -1.41 0.00 0.00 60.65 58.29 2r8y s ILE 115 Cb -0.03 -1.42 -0.09 0.00 0.13 0.00 0.00 42.46 41.04 2r8y s ILE 115 CO 0.85 0.46 1.15 0.00 -1.91 0.00 0.00 174.94 175.50 2r8y s ALA 116 N 0.44 3.34 0.48 1.50 0.00 -1.26 -4.75 121.76 121.50 2r8y s ALA 116 Ca -0.15 0.97 0.15 0.00 0.00 0.00 0.00 51.96 52.93 2r8y s ALA 116 Cb -0.16 -3.37 1.13 0.00 0.00 0.00 0.00 23.12 20.71 2r8y s ALA 116 CO 0.06 -0.35 2.06 -1.00 0.00 0.00 0.00 175.76 176.53 2r8y h PRO 117 N 3.34 0.00 0.00 0.00 0.13 -1.96 -0.70 132.00 132.81 2r8y h PRO 117 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2r8y h PRO 117 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2r8y h PRO 117 CO 0.65 0.10 0.00 1.05 -0.23 0.00 0.00 178.00 179.57 2r8y h GLU 118 N 0.00 0.00 -0.58 0.86 9.09 -1.88 -0.63 114.58 121.43 2r8y h GLU 118 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2r8y h GLU 118 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.28 2r8y h GLU 118 CO 0.01 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.16 2r8y n ASN 119 N -2.51 5.43 -4.42 3.06 3.02 -0.27 -3.97 115.26 115.60 2r8y n ASN 119 Ca 0.00 -2.83 -0.32 0.00 -0.03 0.00 0.00 54.58 51.41 2r8y n ASN 119 Cb 0.17 -0.65 -0.14 0.00 -0.61 0.00 0.00 39.78 38.54 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 -2.56 2.66 0.00 2.41 1.01 -0.66 -0.80 120.40 122.46 2r8y s VAL 120 Ca 0.53 -0.97 0.08 0.00 0.00 0.00 0.00 61.98 61.62 2r8y s VAL 120 Cb 0.39 -2.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 2r8y s VAL 120 CO 0.18 0.52 -0.26 0.00 0.00 0.00 0.00 175.10 175.54 2r8y s ALA 121 N -0.74 2.17 -0.04 5.51 0.00 0.31 -1.23 121.76 127.73 2r8y s ALA 121 Ca 0.12 -1.16 0.02 0.00 0.00 0.00 0.00 51.96 50.94 2r8y s ALA 121 Cb -0.10 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.51 2r8y s ALA 121 CO 0.01 0.52 -0.09 -0.47 0.00 0.00 0.00 175.76 175.74 2r8y s TYR 122 N -0.67 1.05 -0.24 0.00 5.04 -0.35 0.19 117.35 122.37 2r8y s TYR 122 Ca 0.10 -0.32 -0.00 0.00 -2.44 0.00 0.00 57.07 54.41 2r8y s TYR 122 Cb -0.10 -0.80 0.03 0.00 0.35 0.00 0.00 41.96 41.44 2r8y s TYR 122 CO 0.00 -0.18 -0.09 0.08 -1.34 0.00 0.00 175.55 174.02 2r8y s VAL 123 N 0.56 2.63 0.38 3.14 1.01 -0.76 -0.30 120.40 127.06 2r8y s VAL 123 Ca -0.10 -1.15 0.04 0.00 0.00 0.00 0.00 61.98 60.77 2r8y s VAL 123 Cb -0.13 -2.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.85 2r8y s VAL 123 CO 0.01 0.18 0.07 -0.83 0.00 0.00 0.00 175.10 174.54 2r8y s GLY 124 N 1.27 2.40 0.00 4.51 0.00 -0.28 -2.22 107.32 113.00 2r8y s GLY 124 Ca -0.01 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.09 2r8y s GLY 124 CO -0.06 -1.89 0.04 2.09 0.00 0.00 0.00 173.10 173.28 2r8y n ASP 125 N -0.97 0.09 -3.93 1.64 3.85 -1.26 -2.38 116.55 113.58 2r8y n ASP 125 Ca -0.06 -0.54 -0.12 0.00 -0.71 0.00 0.00 54.79 53.37 2r8y n ASP 125 Cb 0.66 0.09 -0.07 0.00 -1.35 0.00 0.00 41.12 40.45 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 -0.09 0.26 0.45 -1.12 -1.08 -1.26 0.13 116.67 113.96 2r8y s ASP 126 Ca 0.00 -1.25 0.15 0.00 -0.52 0.00 0.00 52.55 50.93 2r8y s ASP 126 Cb 0.00 0.51 1.03 0.00 -1.46 0.00 0.00 42.92 43.00 2r8y s ASP 126 CO 0.00 -1.03 1.99 -0.07 0.52 0.00 0.00 175.17 176.58 2r8y h LEU 127 N 2.38 0.00 -2.22 -1.34 3.38 -1.98 -1.38 115.31 114.15 2r8y h LEU 127 Ca -0.30 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.72 2r8y h LEU 127 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 2r8y h LEU 127 CO 0.43 0.18 0.19 -0.29 0.09 0.00 0.00 178.44 179.04 2r8y h ILE 128 N 0.00 0.52 0.00 1.22 6.09 -1.97 -1.95 117.51 121.43 2r8y h ILE 128 Ca -0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2r8y h ILE 128 Cb 0.33 0.85 0.00 0.00 0.47 0.00 0.00 36.82 38.48 2r8y h ILE 128 CO 0.02 0.00 -0.08 0.44 -3.07 0.00 0.00 178.15 175.47 2r8y h ASP 129 N 0.00 0.00 -0.70 2.19 3.32 -1.64 -3.39 116.42 116.20 2r8y h ASP 129 Ca 0.09 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.08 2r8y h ASP 129 Cb 0.46 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 2r8y h ASP 129 CO -0.00 0.00 0.25 -0.25 -1.72 0.00 0.00 179.24 177.52 2r8y h TRP 130 N 0.00 1.10 -0.95 4.55 2.91 -1.47 -1.29 115.95 120.80 2r8y h TRP 130 Ca 0.00 -0.10 0.12 0.00 1.13 0.00 0.00 58.89 60.04 2r8y h TRP 130 Cb 0.93 -0.32 -0.08 0.00 -0.51 0.00 0.00 29.16 29.19 2r8y h TRP 130 CO 0.00 0.86 0.61 -1.35 -1.03 0.00 0.00 178.44 177.53 2r8y h PRO 131 N 1.01 0.88 -0.10 2.65 0.11 -1.77 0.41 132.00 135.19 2r8y h PRO 131 Ca 0.23 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 66.14 2r8y h PRO 131 Cb 0.26 -0.20 0.01 0.00 0.11 0.00 0.00 31.00 31.17 2r8y h PRO 131 CO -0.01 0.58 -0.50 0.28 -0.21 0.00 0.00 178.00 178.15 2r8y h VAL 132 N 0.91 1.37 -0.17 3.15 2.07 -1.80 -3.24 116.25 118.54 2r8y h VAL 132 Ca 0.46 -1.83 0.02 0.00 0.82 0.00 0.00 66.70 66.17 2r8y h VAL 132 Cb 0.50 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 2r8y h VAL 132 CO -0.23 0.55 0.12 0.24 0.02 0.00 0.00 177.57 178.27 2r8y h MET 133 N 0.09 0.14 0.00 1.57 2.86 -0.37 -2.46 114.93 116.76 2r8y h MET 133 Ca -0.03 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 2r8y h MET 133 Cb 1.14 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.77 2r8y h MET 133 CO 0.10 0.09 -0.18 1.49 1.06 0.00 0.00 176.91 179.47 2r8y h GLU 134 N 0.14 0.00 0.00 1.72 4.81 -0.25 -3.23 114.58 117.77 2r8y h GLU 134 Ca 0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2r8y h GLU 134 Cb 0.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.50 2r8y h GLU 134 CO -0.01 0.18 -1.63 1.63 -0.73 0.00 0.00 179.01 178.45 2r8y n LYS 135 N -3.72 0.42 -2.12 1.92 5.02 -0.93 -5.01 118.16 113.74 2r8y n LYS 135 Ca -0.02 -0.13 -0.28 0.00 -2.02 0.00 0.00 58.31 55.86 2r8y n LYS 135 Cb 0.29 -1.51 0.04 0.00 -0.02 0.00 0.00 35.03 33.83 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 3.49 0.18 -0.18 -7.23 -1.20 -4.53 120.40 107.61 2r8y s VAL 136 Ca -0.02 0.24 -0.05 0.00 -1.81 0.00 0.00 61.98 60.33 2r8y s VAL 136 Cb 0.15 -3.44 -0.03 0.00 0.56 0.00 0.00 36.38 33.62 2r8y s VAL 136 CO 0.90 -0.52 1.53 1.23 -0.31 0.00 0.00 175.10 177.92 2r8y h GLY 137 N -0.45 0.77 -7.28 2.32 0.00 0.29 -3.41 103.07 95.31 2r8y h GLY 137 Ca -0.45 -0.80 -0.56 0.00 0.00 0.00 0.00 47.33 45.51 2r8y h GLY 137 CO 0.62 0.73 -0.76 -2.27 0.00 0.00 0.00 176.54 174.86 2r8y s LEU 138 N -8.62 1.89 -0.01 3.11 2.96 -0.92 -4.90 118.68 112.19 2r8y s LEU 138 Ca -0.09 -1.25 -0.17 0.00 -0.22 0.00 0.00 54.13 52.40 2r8y s LEU 138 Cb 0.12 -0.82 -0.06 0.00 0.50 0.00 0.00 46.19 45.94 2r8y s LEU 138 CO 0.85 -0.34 0.48 -0.94 -1.32 0.00 0.00 176.35 175.08 2r8y s SER 139 N 1.67 6.85 -0.05 3.68 1.04 -1.26 -1.21 113.70 124.42 2r8y s SER 139 Ca 0.03 1.01 0.02 0.00 0.48 0.00 0.00 55.95 57.49 2r8y s SER 139 Cb -0.17 -2.29 0.01 0.00 0.10 0.00 0.00 66.02 63.67 2r8y s SER 139 CO -0.15 0.22 -0.09 -0.69 0.98 0.00 0.00 173.24 173.50 2r8y s VAL 140 N -0.60 0.87 -0.06 5.02 1.01 0.58 -1.40 120.40 125.83 2r8y s VAL 140 Ca 0.26 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.92 2r8y s VAL 140 Cb -0.17 -0.82 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 2r8y s VAL 140 CO 0.14 0.29 -0.09 0.00 0.00 0.00 0.00 175.10 175.45 2r8y s ALA 141 N 0.68 2.91 0.68 5.51 0.00 -0.49 -1.13 121.76 129.92 2r8y s ALA 141 Ca -0.12 -0.93 -0.14 0.00 0.00 0.00 0.00 51.96 50.78 2r8y s ALA 141 Cb -0.14 -1.16 0.01 0.00 0.00 0.00 0.00 23.12 21.83 2r8y s ALA 141 CO 0.02 0.57 1.09 0.14 0.00 0.00 0.00 175.76 177.59 2r8y s VAL 142 N -0.81 3.43 0.30 0.00 -7.23 -1.00 -1.46 120.40 113.63 2r8y s VAL 142 Ca 0.13 0.60 0.04 0.00 -1.81 0.00 0.00 61.98 60.93 2r8y s VAL 142 Cb -0.11 -3.13 0.34 0.00 0.56 0.00 0.00 36.38 34.04 2r8y s VAL 142 CO 0.02 -0.48 1.62 0.00 -0.31 0.00 0.00 175.10 175.95 2r8y h ALA 143 N -0.26 1.34 -0.55 1.32 0.00 -1.56 -1.63 119.26 117.92 2r8y h ALA 143 Ca -0.46 0.26 -0.26 0.00 0.00 0.00 0.00 54.91 54.45 2r8y h ALA 143 Cb 1.23 0.39 -0.16 0.00 0.00 0.00 0.00 17.79 19.26 2r8y h ALA 143 CO 0.54 -0.54 0.16 -0.40 0.00 0.00 0.00 179.25 179.01 2r8y n ASP 144 N -5.29 3.14 -4.58 0.00 5.75 -1.26 -5.00 116.55 109.31 2r8y n ASP 144 Ca 0.23 -3.62 -0.29 0.00 -0.01 0.00 0.00 54.79 51.10 2r8y n ASP 144 Cb 0.76 -0.69 0.21 0.00 -1.03 0.00 0.00 41.12 40.37 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 -3.21 0.36 0.20 2.12 0.00 -0.61 -4.91 121.76 115.72 2r8y s ALA 145 Ca 0.49 0.05 -0.32 0.00 0.00 0.00 0.00 51.96 52.17 2r8y s ALA 145 Cb 0.42 -3.28 -0.14 0.00 0.00 0.00 0.00 23.12 20.12 2r8y s ALA 145 CO 0.05 -3.32 1.41 1.58 0.00 0.00 0.00 175.76 175.48 2r8y n HIS 146 N -4.57 2.03 -0.36 0.00 -0.00 0.12 -4.81 115.22 107.63 2r8y n HIS 146 Ca 0.06 0.44 0.32 0.00 0.46 0.00 0.00 57.72 59.00 2r8y n HIS 146 Cb 0.54 -2.45 0.66 0.00 -0.12 0.00 0.00 29.99 28.62 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 4.57 0.14 0.00 1.57 0.11 -1.91 0.11 132.00 136.60 2r8y h PRO 147 Ca -0.45 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 2r8y h PRO 147 Cb 1.28 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 2r8y h PRO 147 CO 0.78 0.10 -0.53 -0.07 -0.21 0.00 0.00 178.00 178.07 2r8y h LEU 148 N 0.15 0.00 -0.11 2.35 3.38 -1.98 -3.26 115.31 115.84 2r8y h LEU 148 Ca 0.64 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.37 2r8y h LEU 148 Cb 2.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.91 2r8y h LEU 148 CO -0.17 0.53 -0.89 0.25 0.09 0.00 0.00 178.44 178.26 2r8y h LEU 149 N 0.00 0.88 -0.57 1.67 5.85 -1.12 -3.39 115.31 118.63 2r8y h LEU 149 Ca -0.01 -0.63 0.10 0.00 0.84 0.00 0.00 57.88 58.18 2r8y h LEU 149 Cb 1.16 -0.26 -0.11 0.00 0.37 0.00 0.00 40.66 41.82 2r8y h LEU 149 CO 0.07 1.43 -0.32 0.40 -0.34 0.00 0.00 178.44 179.68 2r8y h ILE 150 N 0.45 0.19 0.00 4.05 2.04 -1.55 -1.52 117.51 121.17 2r8y h ILE 150 Ca -0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2r8y h ILE 150 Cb 1.53 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.79 2r8y h ILE 150 CO 0.18 0.00 0.00 -2.65 0.00 0.00 0.00 178.15 175.68 2r8y n PRO 151 N -5.43 0.02 0.10 2.37 -0.02 -1.26 -2.94 135.00 127.84 2r8y n PRO 151 Ca 0.04 0.22 0.01 0.00 -2.02 0.00 0.00 63.50 61.75 2r8y n PRO 151 Cb 0.35 -1.54 -0.03 0.00 -0.02 0.00 0.00 33.50 32.27 2r8y n PRO 151 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r8y h ARG 152 N 0.00 0.00 -7.13 -0.52 3.08 -1.51 -3.47 114.38 104.84 2r8y h ARG 152 Ca 0.00 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.58 2r8y h ARG 152 Cb 0.31 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.38 2r8y h ARG 152 CO 0.00 0.49 0.37 0.00 -1.07 0.00 0.00 179.97 179.76 2r8y s ALA 153 N -2.92 2.96 0.22 0.04 0.00 -1.15 -4.97 121.76 115.94 2r8y s ALA 153 Ca 0.01 0.38 -0.06 0.00 0.00 0.00 0.00 51.96 52.30 2r8y s ALA 153 Cb 0.08 -3.18 0.19 0.00 0.00 0.00 0.00 23.12 20.21 2r8y s ALA 153 CO 0.78 -0.24 1.71 -0.44 0.00 0.00 0.00 175.76 177.57 2r8y h ASP 154 N 1.28 0.95 -3.75 0.00 3.45 -1.58 -3.44 116.42 113.33 2r8y h ASP 154 Ca -0.48 -0.23 -0.32 0.00 0.43 0.00 0.00 57.03 56.43 2r8y h ASP 154 Cb 1.20 -0.25 -0.30 0.00 -0.56 0.00 0.00 39.33 39.41 2r8y h ASP 154 CO 0.60 0.97 -0.75 -0.47 -1.57 0.00 0.00 179.24 178.03 2r8y s TYR 155 N -5.11 0.37 -0.20 4.55 5.04 -0.80 -4.93 117.35 116.28 2r8y s TYR 155 Ca -0.11 -0.06 -0.03 0.00 -2.44 0.00 0.00 57.07 54.43 2r8y s TYR 155 Cb 0.14 -0.30 -0.01 0.00 0.35 0.00 0.00 41.96 42.15 2r8y s TYR 155 CO 0.84 -0.05 -0.08 0.08 -1.34 0.00 0.00 175.55 175.00 2r8y s VAL 156 N 0.23 3.19 0.59 3.14 1.01 -1.26 -1.39 120.40 125.91 2r8y s VAL 156 Ca -0.02 -0.57 -0.18 0.00 0.00 0.00 0.00 61.98 61.21 2r8y s VAL 156 Cb -0.05 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 2r8y s VAL 156 CO -0.00 0.46 1.16 0.42 0.00 0.00 0.00 175.10 177.13 2r8y s THR 157 N 1.19 2.92 0.17 3.92 -4.23 -0.54 -4.88 115.64 114.19 2r8y s THR 157 Ca 0.02 0.55 -0.03 0.00 -1.18 0.00 0.00 61.69 61.05 2r8y s THR 157 Cb -0.14 -3.18 -0.11 0.00 1.34 0.00 0.00 72.50 70.41 2r8y s THR 157 CO -0.02 -0.15 1.42 0.03 -0.54 0.00 0.00 174.62 175.36 2r8y h ARG 158 N 0.84 0.45 -6.06 3.99 -0.00 -1.92 -3.09 114.38 108.60 2r8y h ARG 158 Ca -0.50 -0.37 -0.60 0.00 -0.50 0.00 0.00 59.98 58.02 2r8y h ARG 158 Cb 1.28 0.07 -0.05 0.00 0.00 0.00 0.00 29.97 31.27 2r8y h ARG 158 CO 0.55 1.00 -0.21 0.42 0.00 0.00 0.00 179.97 181.73 2r8y s ILE 159 N -3.65 5.04 0.65 2.04 -1.09 -1.26 -4.77 121.20 118.17 2r8y s ILE 159 Ca -0.06 0.70 -0.16 0.00 -2.23 0.00 0.00 60.65 58.91 2r8y s ILE 159 Cb 0.10 -3.69 -0.00 0.00 -1.58 0.00 0.00 42.46 37.29 2r8y s ILE 159 CO 0.85 0.46 1.12 0.00 -1.23 0.00 0.00 174.94 176.14 2r8y s ALA 160 N -1.21 2.46 0.13 9.38 0.00 -1.26 -3.43 121.76 127.82 2r8y s ALA 160 Ca 0.28 0.62 -0.35 0.00 0.00 0.00 0.00 51.96 52.50 2r8y s ALA 160 Cb -0.16 -3.34 -0.15 0.00 0.00 0.00 0.00 23.12 19.47 2r8y s ALA 160 CO 0.15 -1.28 1.45 0.41 0.00 0.00 0.00 175.76 176.49 2r8y n GLY 161 N -0.33 0.78 2.44 0.00 0.00 -1.26 -1.46 105.19 105.36 2r8y n GLY 161 Ca 0.11 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.80 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 2.93 1.86 0.62 -0.02 0.00 -0.80 -3.59 105.19 106.18 2r8y n GLY 162 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 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 1.60 0.00 1.61 5.12 -0.54 -4.53 116.66 117.92 2r8y n ARG 163 Ca 0.00 -1.62 0.00 0.00 -1.93 0.00 0.00 57.85 54.30 2r8y n ARG 163 Cb 0.00 -1.28 0.00 0.00 -1.16 0.00 0.00 32.46 30.02 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 0.73 1.82 0.25 -0.13 0.00 -1.24 -4.86 105.19 101.75 2r8y n GLY 164 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 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 0.71 -0.48 4.61 0.00 -1.73 -1.58 119.26 120.77 2r8y h ALA 165 Ca 0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2r8y h ALA 165 Cb 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2r8y h ALA 165 CO 0.00 0.31 0.03 0.28 0.00 0.00 0.00 179.25 179.87 2r8y h VAL 166 N 0.74 1.26 -0.49 0.00 2.07 -1.90 -1.71 116.25 116.22 2r8y h VAL 166 Ca 0.18 -1.02 0.09 0.00 0.82 0.00 0.00 66.70 66.78 2r8y h VAL 166 Cb 0.19 0.97 -0.08 0.00 -1.52 0.00 0.00 31.29 30.85 2r8y h VAL 166 CO -0.02 0.36 0.02 -0.09 0.02 0.00 0.00 177.57 177.86 2r8y h ARG 167 N 0.69 0.14 -0.61 1.57 9.65 -1.79 0.16 114.38 124.18 2r8y h ARG 167 Ca 0.14 -0.01 0.07 0.00 -1.10 0.00 0.00 59.98 59.08 2r8y h ARG 167 Cb 0.47 -0.03 -0.06 0.00 -1.39 0.00 0.00 29.97 28.96 2r8y h ARG 167 CO 0.02 0.09 0.30 1.49 2.80 0.00 0.00 179.97 184.67 2r8y h GLU 168 N 0.14 0.54 -0.57 0.20 4.81 -0.86 0.54 114.58 119.38 2r8y h GLU 168 Ca 0.25 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.36 2r8y h GLU 168 Cb 0.37 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 2r8y h GLU 168 CO -0.39 0.36 0.01 0.28 -0.73 0.00 0.00 179.01 178.54 2r8y h VAL 169 N 0.56 1.26 -0.13 0.32 2.07 -0.67 -0.36 116.25 119.31 2r8y h VAL 169 Ca 0.29 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 66.69 2r8y h VAL 169 Cb 0.24 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2r8y h VAL 169 CO -0.21 0.40 0.08 0.00 0.02 0.00 0.00 177.57 177.86 2r8y h ASP 171 N 0.16 0.86 -0.25 0.00 3.45 0.16 -1.81 116.42 118.99 2r8y h ASP 171 Ca 0.05 0.03 -0.03 0.00 0.43 0.00 0.00 57.03 57.50 2r8y h ASP 171 Cb -0.01 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 38.60 2r8y h ASP 171 CO -0.01 0.50 0.02 0.25 -1.57 0.00 0.00 179.24 178.43 2r8y h LEU 172 N 0.94 0.42 -0.53 1.55 5.85 -0.51 -0.95 115.31 122.07 2r8y h LEU 172 Ca 0.44 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 2r8y h LEU 172 Cb 0.41 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2r8y h LEU 172 CO -0.20 0.59 0.12 -0.07 -0.34 0.00 0.00 178.44 178.54 2r8y h LEU 173 N 0.22 0.82 -0.33 2.25 3.38 -0.86 -1.96 115.31 118.83 2r8y h LEU 173 Ca 0.07 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 2r8y h LEU 173 Cb 0.37 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2r8y h LEU 173 CO 0.01 0.85 -0.05 -0.07 0.09 0.00 0.00 178.44 179.27 2r8y h LEU 174 N 0.75 0.62 -0.36 1.67 3.38 -1.32 -1.86 115.31 118.20 2r8y h LEU 174 Ca 0.17 -0.34 0.03 0.00 0.09 0.00 0.00 57.88 57.82 2r8y h LEU 174 Cb 0.36 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 2r8y h LEU 174 CO 0.00 0.82 0.17 0.25 0.09 0.00 0.00 178.44 179.77 2r8y h LEU 175 N 0.41 0.25 -1.53 1.67 5.85 -1.11 0.64 115.31 121.49 2r8y h LEU 175 Ca 0.09 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 2r8y h LEU 175 Cb 0.53 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 2r8y h LEU 175 CO 0.03 0.19 -0.24 0.00 -0.34 0.00 0.00 178.44 178.07 2r8y h ALA 176 N 1.19 1.53 -0.46 1.25 0.00 -1.29 -2.19 119.26 119.29 2r8y h ALA 176 Ca 0.15 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2r8y h ALA 176 Cb 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2r8y h ALA 176 CO -0.11 0.30 0.00 1.04 0.00 0.00 0.00 179.25 180.48 2r8y n GLN 177 N -4.15 2.38 -3.28 0.00 6.02 -0.70 -4.63 117.38 113.02 2r8y n GLN 177 Ca -0.02 -2.11 -0.15 0.00 -0.01 0.00 0.00 57.00 54.71 2r8y n GLN 177 Cb 0.30 -1.49 0.08 0.00 1.02 0.00 0.00 30.24 30.16 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 1.45 -0.27 0.00 1.08 0.00 0.03 -4.95 105.19 102.53 2r8y n GLY 178 Ca 0.20 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 -3.81 0.10 -0.06 1.61 5.02 0.20 -4.84 118.16 116.38 2r8y n LYS 179 Ca -0.25 -0.31 -0.12 0.00 -2.02 0.00 0.00 58.31 55.61 2r8y n LYS 179 Cb 0.65 -0.56 -0.06 0.00 -0.02 0.00 0.00 35.03 35.04 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 0.00 0.31 -0.96 -0.35 5.85 -1.86 0.73 115.31 119.03 2r8y h LEU 180 Ca 0.00 -0.31 -0.08 0.00 0.84 0.00 0.00 57.88 58.32 2r8y h LEU 180 Cb 0.67 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2r8y h LEU 180 CO 0.00 0.54 -0.15 0.44 -0.34 0.00 0.00 178.44 178.93 2r8y h ASP 181 N 0.06 0.57 0.13 1.25 5.19 -1.92 -3.12 116.42 118.59 2r8y h ASP 181 Ca 0.05 -0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.30 2r8y h ASP 181 Cb 0.39 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.74 2r8y h ASP 181 CO 0.01 0.74 -0.11 -0.33 -3.12 0.00 0.00 179.24 176.43 2r8y h GLU 182 N 0.53 -0.25 -6.52 3.56 3.07 -1.82 -3.47 114.58 109.68 2r8y h GLU 182 Ca 0.09 0.02 -0.60 0.00 -0.50 0.00 0.00 59.36 58.37 2r8y h GLU 182 Cb 0.57 0.06 0.08 0.00 -0.84 0.00 0.00 28.75 28.61 2r8y h GLU 182 CO 0.04 -0.17 0.55 0.00 -1.40 0.00 0.00 179.01 178.03 2r8y n ALA 183 N -2.29 0.67 -3.10 3.43 0.00 0.23 -5.02 120.51 114.43 2r8y n ALA 183 Ca -0.08 0.43 -0.33 0.00 0.00 0.00 0.00 53.44 53.46 2r8y n ALA 183 Cb 0.15 -2.22 -0.15 0.00 0.00 0.00 0.00 19.45 17.23 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 -0.27 3.34 0.31 0.00 -0.14 -1.26 -5.05 119.74 116.68 2r8y s LYS 184 Ca 0.71 -0.71 0.05 0.00 -1.36 0.00 0.00 55.97 54.65 2r8y s LYS 184 Cb -0.70 -2.59 -0.03 0.00 -1.68 0.00 0.00 37.83 32.83 2r8y s LYS 184 CO 0.49 0.21 0.28 0.20 -0.76 0.00 0.00 175.35 175.78 2r8y s GLY 185 N 0.35 2.08 -0.13 -3.33 0.00 -1.26 -4.02 107.32 101.00 2r8y s GLY 185 Ca -0.12 -1.94 0.02 0.00 0.00 0.00 0.00 44.72 42.68 2r8y s GLY 185 CO 0.06 -1.39 -0.20 1.20 0.00 0.00 0.00 173.10 172.77 2r8y s GLN 186 N -3.50 3.10 -1.32 2.90 1.11 -1.26 -5.00 119.66 115.68 2r8y s GLN 186 Ca 0.39 -0.82 -0.17 0.00 0.01 0.00 0.00 55.36 54.77 2r8y s GLN 186 Cb 0.03 -2.46 0.03 0.00 -1.01 0.00 0.00 33.01 29.59 2r8y s GLN 186 CO 0.24 0.05 2.00 0.45 0.01 0.00 0.00 175.29 178.04 2r8y n SER 187 N 3.90 4.13 0.00 5.90 2.88 -1.26 -2.92 113.62 126.25 2r8y n SER 187 Ca -0.19 -2.85 0.00 0.00 -1.33 0.00 0.00 58.87 54.50 2r8y n SER 187 Cb 0.52 -1.66 0.00 0.00 -0.75 0.00 0.00 64.21 62.32 2r8y n SER 187 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11