#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 3.39 0.22 -1.18 0.00 -1.26 0.09 121.76 123.01 2r8y s ALA 9 Ca 0.00 0.66 0.04 0.00 0.00 0.00 0.00 51.96 52.66 2r8y s ALA 9 Cb 0.00 -3.45 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 2r8y s ALA 9 CO 0.00 -0.54 -0.03 0.95 0.00 0.00 0.00 175.76 176.15 2r8y s THR 10 N 1.58 1.10 -1.57 0.00 -4.23 -1.11 -4.92 115.64 106.49 2r8y s THR 10 Ca 0.55 -2.05 0.13 0.00 -1.18 0.00 0.00 61.69 59.15 2r8y s THR 10 Cb -0.25 -2.25 0.27 0.00 1.34 0.00 0.00 72.50 71.61 2r8y s THR 10 CO 0.25 -0.41 1.32 0.00 -0.54 0.00 0.00 174.62 175.24 2r8y n TYR 12 N -1.21 0.00 0.00 0.00 4.02 -1.26 -5.11 117.16 113.60 2r8y n TYR 12 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.96 2r8y n TYR 12 Cb 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.41 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 1.02 3.07 3.76 2.72 0.00 -0.61 -4.95 105.19 110.19 2r8y n GLY 13 Ca 0.05 -1.92 -0.38 0.00 0.00 0.00 0.00 46.02 43.77 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 -2.25 3.42 0.19 1.61 0.02 -1.26 -2.75 135.00 133.98 2r8y s PRO 14 Ca 0.00 2.02 0.11 0.00 0.02 0.00 0.00 61.00 63.15 2r8y s PRO 14 Cb 0.00 -2.32 -0.04 0.00 0.02 0.00 0.00 34.50 32.15 2r8y s PRO 14 CO 0.00 -0.90 -0.22 0.14 -0.33 0.00 0.00 177.00 175.69 2r8y s VAL 15 N -1.41 2.21 0.66 3.83 -7.23 0.11 -4.91 120.40 113.65 2r8y s VAL 15 Ca 0.68 -2.01 -0.14 0.00 -1.81 0.00 0.00 61.98 58.69 2r8y s VAL 15 Cb -0.35 -2.05 -0.00 0.00 0.56 0.00 0.00 36.38 34.54 2r8y s VAL 15 CO 0.42 -0.18 1.09 -0.94 -0.31 0.00 0.00 175.10 175.17 2r8y s SER 16 N -2.70 5.26 0.24 4.85 1.04 -1.26 -4.54 113.70 116.59 2r8y s SER 16 Ca 0.20 1.88 -0.06 0.00 0.48 0.00 0.00 55.95 58.45 2r8y s SER 16 Cb -0.07 -2.54 0.33 0.00 0.10 0.00 0.00 66.02 63.84 2r8y s SER 16 CO 0.09 -1.52 1.84 0.00 0.98 0.00 0.00 173.24 174.63 2r8y h ALA 17 N -0.08 1.16 -0.81 5.32 0.00 -1.99 -1.80 119.26 121.06 2r8y h ALA 17 Ca -0.46 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2r8y h ALA 17 Cb 1.23 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 2r8y h ALA 17 CO 0.55 0.25 0.45 0.22 0.00 0.00 0.00 179.25 180.72 2r8y h ASP 18 N 0.94 1.01 -0.37 0.00 3.58 -1.99 -0.42 116.42 119.17 2r8y h ASP 18 Ca 0.37 -0.09 -0.06 0.00 0.42 0.00 0.00 57.03 57.66 2r8y h ASP 18 Cb 0.19 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 2r8y h ASP 18 CO -0.18 0.81 -0.02 0.58 -2.88 0.00 0.00 179.24 177.55 2r8y h VAL 19 N 1.13 1.26 -0.83 2.25 2.07 -1.83 -0.65 116.25 119.65 2r8y h VAL 19 Ca 0.29 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.78 2r8y h VAL 19 Cb 0.02 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 2r8y h VAL 19 CO -0.05 0.34 0.53 -0.03 0.02 0.00 0.00 177.57 178.39 2r8y h MET 20 N 0.48 1.11 -0.52 1.57 1.85 -1.05 0.62 114.93 118.99 2r8y h MET 20 Ca 0.10 -0.08 -0.07 0.00 -0.61 0.00 0.00 59.70 59.04 2r8y h MET 20 Cb 0.50 -0.24 -0.02 0.00 0.43 0.00 0.00 31.60 32.26 2r8y h MET 20 CO 0.02 0.75 0.05 0.00 -0.40 0.00 0.00 176.91 177.34 2r8y h ALA 21 N 1.29 0.70 -0.15 0.39 0.00 -0.95 0.62 119.26 121.16 2r8y h ALA 21 Ca 0.30 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2r8y h ALA 21 Cb -0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2r8y h ALA 21 CO -0.06 0.47 0.09 0.87 0.00 0.00 0.00 179.25 180.62 2r8y h LYS 22 N 0.76 0.20 -0.57 0.00 1.57 -0.69 -3.00 116.57 114.85 2r8y h LYS 22 Ca 0.15 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2r8y h LYS 22 Cb 0.46 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 2r8y h LYS 22 CO 0.02 0.16 0.36 0.00 -0.57 0.00 0.00 179.45 179.42 2r8y h ALA 23 N 1.03 1.57 -0.09 3.86 0.00 -0.61 -2.56 119.26 122.46 2r8y h ALA 23 Ca 0.05 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2r8y h ALA 23 Cb 0.01 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2r8y h ALA 23 CO -0.01 0.39 0.06 1.49 0.00 0.00 0.00 179.25 181.18 2r8y h GLU 24 N 0.78 0.00 -0.06 0.00 4.22 -0.73 -2.87 114.58 115.92 2r8y h GLU 24 Ca 0.21 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.65 2r8y h GLU 24 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2r8y h GLU 24 CO -0.04 0.00 0.00 0.09 -2.18 0.00 0.00 179.01 176.88 2r8y n ASN 25 N -4.48 1.58 -4.67 1.04 4.13 -0.96 -4.74 115.26 107.16 2r8y n ASN 25 Ca -0.01 -1.56 -0.42 0.00 1.68 0.00 0.00 54.58 54.27 2r8y n ASN 25 Cb 0.17 -0.03 -0.04 0.00 -1.54 0.00 0.00 39.78 38.35 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 -1.94 4.85 -0.15 2.41 -1.09 -1.08 -4.44 121.20 119.75 2r8y s ILE 26 Ca 0.36 1.71 0.14 0.00 -2.23 0.00 0.00 60.65 60.63 2r8y s ILE 26 Cb 0.20 -4.17 -0.20 0.00 -1.58 0.00 0.00 42.46 36.71 2r8y s ILE 26 CO 0.32 -0.01 0.36 0.54 -1.23 0.00 0.00 174.94 174.92 2r8y n ARG 27 N 5.40 0.88 -3.95 2.79 5.12 0.76 -4.87 116.66 122.78 2r8y n ARG 27 Ca 0.06 -0.10 -0.18 0.00 -1.93 0.00 0.00 57.85 55.70 2r8y n ARG 27 Cb 0.48 -1.28 -0.16 0.00 -1.16 0.00 0.00 32.46 30.34 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 -3.67 1.16 -0.27 0.55 2.96 -0.91 -0.68 118.68 117.83 2r8y s LEU 28 Ca -0.03 -0.04 -0.05 0.00 -0.22 0.00 0.00 54.13 53.79 2r8y s LEU 28 Cb 0.09 -0.26 0.01 0.00 0.50 0.00 0.00 46.19 46.53 2r8y s LEU 28 CO 0.56 -0.10 0.03 -0.22 -1.32 0.00 0.00 176.35 175.30 2r8y s LEU 29 N 1.05 3.52 -0.17 -0.68 2.96 0.15 -0.91 118.68 124.59 2r8y s LEU 29 Ca -0.09 -0.68 -0.08 0.00 -0.22 0.00 0.00 54.13 53.06 2r8y s LEU 29 Cb -0.14 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 2r8y s LEU 29 CO -0.02 -0.14 0.10 -0.63 -1.32 0.00 0.00 176.35 174.34 2r8y s ILE 30 N 1.46 5.10 -0.02 6.68 1.01 0.66 -0.94 121.20 135.16 2r8y s ILE 30 Ca 0.03 0.07 0.06 0.00 0.00 0.00 0.00 60.65 60.81 2r8y s ILE 30 Cb -0.16 -3.29 -0.02 0.00 0.01 0.00 0.00 42.46 39.00 2r8y s ILE 30 CO -0.00 0.49 -0.20 -0.76 0.00 0.00 0.00 174.94 174.47 2r8y s LEU 31 N 0.08 2.04 0.44 2.97 1.43 0.34 -1.93 118.68 124.05 2r8y s LEU 31 Ca 0.07 -0.36 -0.16 0.00 -1.03 0.00 0.00 54.13 52.65 2r8y s LEU 31 Cb -0.12 -1.03 -0.09 0.00 0.03 0.00 0.00 46.19 44.99 2r8y s LEU 31 CO -0.00 0.25 0.89 -0.62 0.23 0.00 0.00 176.35 177.10 2r8y s ASP 32 N -0.47 6.72 -0.01 2.29 3.68 -1.11 -3.10 116.67 124.67 2r8y s ASP 32 Ca 0.08 1.47 -0.01 0.00 2.13 0.00 0.00 52.55 56.22 2r8y s ASP 32 Cb -0.08 -2.46 -0.00 0.00 -1.45 0.00 0.00 42.92 38.93 2r8y s ASP 32 CO -0.01 -0.42 -0.01 0.58 0.13 0.00 0.00 175.17 175.44 2r8y h VAL 33 N 1.40 0.00 -2.56 1.11 2.07 -1.92 -3.14 116.25 113.21 2r8y h VAL 33 Ca -0.48 -0.11 -0.53 0.00 0.82 0.00 0.00 66.70 66.40 2r8y h VAL 33 Cb 1.18 0.00 0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2r8y h VAL 33 CO 0.62 0.00 1.10 -1.81 0.02 0.00 0.00 177.57 177.51 2r8y s ASP 34 N -3.54 6.54 0.00 0.57 1.01 -1.26 -1.16 116.67 118.83 2r8y s ASP 34 Ca -0.01 2.54 0.00 0.00 0.71 0.00 0.00 52.55 55.79 2r8y s ASP 34 Cb 0.00 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.38 2r8y s ASP 34 CO 0.01 -0.96 0.00 0.61 0.21 0.00 0.00 175.17 175.04 2r8y n GLY 35 N 4.22 0.62 1.02 0.21 0.00 -1.16 -4.78 105.19 105.33 2r8y n GLY 35 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.27 0.24 0.15 1.61 0.31 -0.83 -4.17 118.33 113.37 2r8y n VAL 36 Ca 0.00 0.08 0.03 0.00 -0.01 0.00 0.00 64.34 64.44 2r8y n VAL 36 Cb 0.04 -1.10 0.12 0.00 -0.91 0.00 0.00 33.84 31.99 2r8y n VAL 36 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2r8y h LEU 37 N 0.00 0.00-10.14 7.52 3.38 -1.09 -1.69 115.31 113.29 2r8y h LEU 37 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 2r8y h LEU 37 Cb 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 2r8y h LEU 37 CO 0.00 0.50 -0.39 -0.94 0.09 0.00 0.00 178.44 177.70 2r8y s SER 38 N -6.47 4.66 -0.01 -0.43 1.04 -0.51 -4.05 113.70 107.93 2r8y s SER 38 Ca 0.02 -1.06 0.03 0.00 0.48 0.00 0.00 55.95 55.42 2r8y s SER 38 Cb 0.09 -0.15 0.11 0.00 0.10 0.00 0.00 66.02 66.17 2r8y s SER 38 CO 0.73 -0.79 0.95 -0.90 0.98 0.00 0.00 173.24 174.21 2r8y n ASP 39 N -1.52 0.97 0.00 7.02 3.85 -1.26 -1.57 116.55 124.04 2r8y n ASP 39 Ca -0.01 -2.05 0.00 0.00 -0.71 0.00 0.00 54.79 52.03 2r8y n ASP 39 Cb 0.64 -0.22 0.00 0.00 -1.35 0.00 0.00 41.12 40.18 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 0.49 0.81 3.94 6.12 0.00 -1.26 -4.76 105.19 110.53 2r8y n GLY 40 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 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 4.34 -0.13 0.99 1.43 -1.26 -4.73 118.68 119.31 2r8y s LEU 41 Ca 0.00 0.18 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 2r8y s LEU 41 Cb 0.00 -2.91 0.02 0.00 0.03 0.00 0.00 46.19 43.33 2r8y s LEU 41 CO 0.00 0.06 -0.17 -0.63 0.23 0.00 0.00 176.35 175.84 2r8y s ILE 42 N -1.73 1.71 -0.19 -0.59 -1.09 -1.26 -4.74 121.20 113.31 2r8y s ILE 42 Ca 0.35 -0.75 -0.16 0.00 -2.23 0.00 0.00 60.65 57.85 2r8y s ILE 42 Cb -0.11 -1.56 -0.04 0.00 -1.58 0.00 0.00 42.46 39.17 2r8y s ILE 42 CO 0.28 0.48 0.41 -0.31 -1.23 0.00 0.00 174.94 174.57 2r8y s TYR 43 N 1.12 3.39 -0.00 3.97 1.51 -0.18 -4.98 117.35 122.18 2r8y s TYR 43 Ca -0.02 0.65 0.05 0.00 -1.01 0.00 0.00 57.07 56.74 2r8y s TYR 43 Cb -0.14 -2.52 -0.01 0.00 -0.11 0.00 0.00 41.96 39.17 2r8y s TYR 43 CO -0.05 0.02 -0.15 -1.64 -1.11 0.00 0.00 175.55 172.62 2r8y s MET 44 N 1.19 1.17 0.40 -0.62 -1.94 -1.26 -1.18 119.30 117.07 2r8y s MET 44 Ca 0.20 -0.56 0.07 0.00 -1.71 0.00 0.00 55.69 53.69 2r8y s MET 44 Cb -0.15 -1.14 -0.07 0.00 2.01 0.00 0.00 34.83 35.48 2r8y s MET 44 CO 0.08 0.31 0.01 0.20 -0.01 0.00 0.00 175.02 175.61 2r8y s GLY 45 N -0.44 2.43 0.49 -0.03 0.00 -0.57 -4.97 107.32 104.23 2r8y s GLY 45 Ca 0.05 -2.24 0.25 0.00 0.00 0.00 0.00 44.72 42.77 2r8y s GLY 45 CO -0.00 -2.06 2.01 3.43 0.00 0.00 0.00 173.10 176.48 2r8y h ASN 46 N 1.77 0.00 -0.56 1.64 2.35 -2.02 -2.35 115.58 116.41 2r8y h ASN 46 Ca -0.44 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.22 2r8y h ASN 46 Cb 1.24 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.56 2r8y h ASN 46 CO 0.78 0.16 0.12 0.59 -1.65 0.00 0.00 177.43 177.43 2r8y n ASN 47 N -3.70 4.73 -0.02 5.81 5.03 -1.26 -4.91 115.26 120.94 2r8y n ASN 47 Ca -0.02 -2.91 -0.00 0.00 0.87 0.00 0.00 54.58 52.52 2r8y n ASN 47 Cb 0.28 -0.69 -0.00 0.00 -1.02 0.00 0.00 39.78 38.35 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 0.23 0.47 3.72 7.41 0.00 -0.88 -5.02 105.19 111.13 2r8y n GLY 48 Ca 0.29 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2r8y n GLY 48 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2r8y n GLU 49 N -2.79 2.14 -3.99 1.61 4.71 -1.25 -4.81 120.64 116.26 2r8y n GLU 49 Ca -0.00 0.76 -0.19 0.00 -0.01 0.00 0.00 57.16 57.71 2r8y n GLU 49 Cb 0.03 -2.47 -0.17 0.00 -1.01 0.00 0.00 31.44 27.83 2r8y n GLU 49 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 2r8y s GLU 50 N -2.18 0.57 0.10 3.49 2.12 -1.26 -1.52 118.70 120.03 2r8y s GLU 50 Ca 0.59 0.01 0.06 0.00 0.36 0.00 0.00 54.97 55.99 2r8y s GLU 50 Cb -0.50 -0.73 -0.03 0.00 0.26 0.00 0.00 34.13 33.13 2r8y s GLU 50 CO 0.60 -0.15 -0.15 -0.51 -0.54 0.00 0.00 175.26 174.50 2r8y s LEU 51 N 1.20 2.34 0.05 2.70 1.02 -0.32 -4.97 118.68 120.69 2r8y s LEU 51 Ca -0.07 -0.72 -0.00 0.00 0.02 0.00 0.00 54.13 53.36 2r8y s LEU 51 Cb -0.14 -0.61 -0.03 0.00 0.02 0.00 0.00 46.19 45.43 2r8y s LEU 51 CO -0.02 -0.08 -0.04 -0.75 0.02 0.00 0.00 176.35 175.49 2r8y s LYS 52 N -2.19 0.56 -0.16 1.70 2.20 -1.26 -1.01 119.74 119.57 2r8y s LYS 52 Ca 0.05 -1.04 -0.02 0.00 -0.36 0.00 0.00 55.97 54.59 2r8y s LYS 52 Cb -0.08 0.09 -0.02 0.00 -1.51 0.00 0.00 37.83 36.31 2r8y s LYS 52 CO 0.03 -0.07 -0.08 0.00 -0.36 0.00 0.00 175.35 174.87 2r8y s ALA 53 N -3.05 2.80 0.29 3.13 0.00 -1.26 -5.07 121.76 118.59 2r8y s ALA 53 Ca 0.00 -0.93 0.08 0.00 0.00 0.00 0.00 51.96 51.11 2r8y s ALA 53 Cb 0.02 -1.45 -0.04 0.00 0.00 0.00 0.00 23.12 21.64 2r8y s ALA 53 CO -0.06 0.07 0.14 -0.06 0.00 0.00 0.00 175.76 175.85 2r8y s PHE 54 N 0.63 2.88 -0.15 0.00 0.40 -1.26 -4.06 117.98 116.42 2r8y s PHE 54 Ca -0.04 -0.23 -0.03 0.00 -0.60 0.00 0.00 56.93 56.03 2r8y s PHE 54 Cb -0.15 -1.45 -0.02 0.00 0.51 0.00 0.00 43.02 41.91 2r8y s PHE 54 CO 0.03 0.46 -0.05 1.21 0.70 0.00 0.00 175.22 177.56 2r8y s ASN 55 N -3.82 4.64 0.41 1.36 2.47 -1.26 -5.02 114.94 113.73 2r8y s ASN 55 Ca 0.35 -0.17 0.08 0.00 0.42 0.00 0.00 52.86 53.53 2r8y s ASN 55 Cb -0.06 -1.75 0.88 0.00 -1.45 0.00 0.00 41.25 38.87 2r8y s ASN 55 CO 0.23 0.16 2.05 -0.37 -3.72 0.00 0.00 177.10 175.45 2r8y h VAL 56 N 5.21 1.08 -0.63 -5.21 -1.51 -1.91 -2.09 116.25 111.19 2r8y h VAL 56 Ca -0.30 -0.18 -0.02 0.00 -1.23 0.00 0.00 66.70 64.96 2r8y h VAL 56 Cb 1.19 0.49 -0.03 0.00 -2.13 0.00 0.00 31.29 30.82 2r8y h VAL 56 CO 0.61 0.10 0.31 -0.09 -1.23 0.00 0.00 177.57 177.27 2r8y h ARG 57 N 0.54 0.88 -0.55 5.19 2.43 -1.95 -1.25 114.38 119.66 2r8y h ARG 57 Ca 0.17 -0.11 -0.10 0.00 -0.81 0.00 0.00 59.98 59.13 2r8y h ARG 57 Cb 0.02 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 2r8y h ARG 57 CO -0.04 0.67 -0.06 -0.44 -1.51 0.00 0.00 179.97 178.60 2r8y h ASP 58 N 0.88 0.99 -0.57 -3.80 3.32 -1.75 -2.92 116.42 112.58 2r8y h ASP 58 Ca 0.22 -0.30 0.06 0.00 0.02 0.00 0.00 57.03 57.03 2r8y h ASP 58 Cb 0.08 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.31 2r8y h ASP 58 CO -0.03 1.08 0.27 1.23 -1.72 0.00 0.00 179.24 180.06 2r8y h GLY 59 N 0.97 0.80 0.58 2.75 0.00 -0.93 -0.79 103.07 106.45 2r8y h GLY 59 Ca 0.15 -0.17 0.06 0.00 0.00 0.00 0.00 47.33 47.37 2r8y h GLY 59 CO 0.04 0.08 0.14 -1.82 0.00 0.00 0.00 176.54 174.98 2r8y h TYR 60 N 0.51 0.25 -0.49 5.60 5.03 -0.94 -0.99 116.97 125.93 2r8y h TYR 60 Ca 0.26 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.59 2r8y h TYR 60 Cb 0.22 -0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.42 2r8y h TYR 60 CO -0.12 0.08 0.30 0.78 -1.32 0.00 0.00 178.16 177.88 2r8y h GLY 61 N 0.31 0.72 0.97 1.82 0.00 -1.25 -0.32 103.07 105.31 2r8y h GLY 61 Ca 0.21 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.21 2r8y h GLY 61 CO -0.22 0.29 0.21 -2.22 0.00 0.00 0.00 176.54 174.60 2r8y h ILE 62 N 0.66 1.21 -0.68 2.60 2.04 -0.89 0.74 117.51 123.20 2r8y h ILE 62 Ca 0.18 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 2r8y h ILE 62 Cb -0.01 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 2r8y h ILE 62 CO -0.03 0.25 0.32 0.03 0.00 0.00 0.00 178.15 178.71 2r8y h ARG 63 N 0.68 0.98 -0.27 2.37 2.47 -1.00 0.38 114.38 119.99 2r8y h ARG 63 Ca 0.17 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 2r8y h ARG 63 Cb 0.19 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.32 2r8y h ARG 63 CO -0.01 0.78 0.17 0.00 0.56 0.00 0.00 179.97 181.47 2r8y h ALA 65 N 1.08 -0.24 -0.10 0.00 0.00 -0.49 -2.39 119.26 117.11 2r8y h ALA 65 Ca 0.10 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2r8y h ALA 65 Cb -0.02 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2r8y h ALA 65 CO -0.02 -0.63 0.08 -0.07 0.00 0.00 0.00 179.25 178.61 2r8y h LEU 66 N -0.25 0.00 -2.44 0.00 3.38 -0.91 -0.95 115.31 114.13 2r8y h LEU 66 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2r8y h LEU 66 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2r8y h LEU 66 CO 0.04 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.92 2r8y n THR 67 N -4.39 0.89 -2.03 0.22 -2.24 -0.91 -4.12 114.28 101.70 2r8y n THR 67 Ca -0.00 -0.89 0.04 0.00 -2.27 0.00 0.00 64.05 60.93 2r8y n THR 67 Cb 0.19 0.44 0.12 0.00 -2.10 0.00 0.00 70.33 68.99 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 1.44 1.49 -3.33 3.42 7.64 -0.43 -4.97 113.62 118.89 2r8y n SER 68 Ca 0.22 -3.04 -0.23 0.00 1.01 0.00 0.00 58.87 56.84 2r8y n SER 68 Cb 0.56 -0.42 0.07 0.00 -1.01 0.00 0.00 64.21 63.40 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 -0.40 -6.18 -4.00 6.43 4.64 -1.20 -4.98 116.55 110.86 2r8y n ASP 69 Ca 0.14 -0.45 -0.30 0.00 -1.38 0.00 0.00 54.79 52.80 2r8y n ASP 69 Cb 0.90 -4.86 -0.16 0.00 -1.04 0.00 0.00 41.12 35.95 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 -3.27 1.55 0.56 5.18 1.01 -0.81 -4.82 121.20 120.60 2r8y s ILE 70 Ca 0.49 -0.75 -0.17 0.00 0.00 0.00 0.00 60.65 60.23 2r8y s ILE 70 Cb -0.22 -1.53 -0.05 0.00 0.01 0.00 0.00 42.46 40.67 2r8y s ILE 70 CO 0.61 0.34 1.04 -1.61 0.00 0.00 0.00 174.94 175.32 2r8y s GLU 71 N 1.47 3.50 -0.06 2.79 0.41 0.15 -3.26 118.70 123.70 2r8y s GLU 71 Ca 0.03 1.20 0.02 0.00 -0.41 0.00 0.00 54.97 55.81 2r8y s GLU 71 Cb -0.14 -2.06 0.01 0.00 -1.78 0.00 0.00 34.13 30.16 2r8y s GLU 71 CO -0.10 -0.66 -0.12 0.08 -0.49 0.00 0.00 175.26 173.97 2r8y s VAL 72 N -2.39 1.15 0.13 2.63 1.01 -1.26 0.31 120.40 121.98 2r8y s VAL 72 Ca 0.64 -0.49 0.07 0.00 0.00 0.00 0.00 61.98 62.19 2r8y s VAL 72 Cb -0.15 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 2r8y s VAL 72 CO 0.33 0.36 -0.16 0.00 0.00 0.00 0.00 175.10 175.63 2r8y s ALA 73 N 0.63 1.65 -0.03 5.51 0.00 -0.11 -4.25 121.76 125.15 2r8y s ALA 73 Ca -0.14 -1.32 0.04 0.00 0.00 0.00 0.00 51.96 50.54 2r8y s ALA 73 Cb -0.16 -0.13 -0.00 0.00 0.00 0.00 0.00 23.12 22.83 2r8y s ALA 73 CO 0.04 0.18 -0.16 0.42 0.00 0.00 0.00 175.76 176.24 2r8y s ILE 74 N -1.92 1.29 -0.15 0.00 1.01 -0.72 -0.50 121.20 120.21 2r8y s ILE 74 Ca 0.09 -0.65 0.01 0.00 0.00 0.00 0.00 60.65 60.11 2r8y s ILE 74 Cb -0.06 -1.11 0.02 0.00 0.01 0.00 0.00 42.46 41.32 2r8y s ILE 74 CO 0.04 0.38 -0.19 -0.63 0.00 0.00 0.00 174.94 174.53 2r8y s ILE 75 N -0.01 1.93 0.29 2.92 1.01 -1.18 -0.96 121.20 125.20 2r8y s ILE 75 Ca -0.02 -0.87 0.05 0.00 0.00 0.00 0.00 60.65 59.81 2r8y s ILE 75 Cb -0.10 -1.74 -0.06 0.00 0.01 0.00 0.00 42.46 40.57 2r8y s ILE 75 CO 0.01 0.52 -0.02 0.28 0.00 0.00 0.00 174.94 175.74 2r8y s THR 76 N 1.13 1.45 -1.29 2.92 -1.32 0.32 -4.52 115.64 114.32 2r8y s THR 76 Ca -0.00 -2.07 0.27 0.00 -1.21 0.00 0.00 61.69 58.67 2r8y s THR 76 Cb -0.14 -2.54 0.20 0.00 -1.51 0.00 0.00 72.50 68.51 2r8y s THR 76 CO -0.08 -0.22 1.63 0.61 -2.21 0.00 0.00 174.62 174.35 2r8y n GLY 77 N -0.60 -1.10 3.61 6.08 0.00 -1.26 -0.96 105.19 110.97 2r8y n GLY 77 Ca -0.05 -0.30 -0.03 0.00 0.00 0.00 0.00 46.02 45.64 2r8y n GLY 77 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2r8y s ARG 78 N -2.79 0.54 0.21 1.61 3.52 -1.26 -3.16 118.95 117.63 2r8y s ARG 78 Ca 0.18 1.08 -0.31 0.00 -0.13 0.00 0.00 55.73 56.56 2r8y s ARG 78 Cb 0.19 0.34 -0.10 0.00 -1.56 0.00 0.00 34.95 33.82 2r8y s ARG 78 CO 0.59 -0.14 1.52 0.21 -0.81 0.00 0.00 175.30 176.66 2r8y s LYS 79 N 1.98 4.23 -0.16 5.12 2.20 -1.26 -4.36 119.74 127.49 2r8y s LYS 79 Ca -0.08 2.36 -0.07 0.00 -0.36 0.00 0.00 55.97 57.82 2r8y s LYS 79 Cb -0.06 -3.12 0.06 0.00 -1.51 0.00 0.00 37.83 33.20 2r8y s LYS 79 CO -0.18 -0.53 0.36 0.00 -0.36 0.00 0.00 175.35 174.64 2r8y s ALA 80 N 0.53 -0.91 0.44 3.13 0.00 -1.26 -4.99 121.76 118.71 2r8y s ALA 80 Ca 0.65 1.35 0.11 0.00 0.00 0.00 0.00 51.96 54.07 2r8y s ALA 80 Cb -0.43 -0.94 0.98 0.00 0.00 0.00 0.00 23.12 22.73 2r8y s ALA 80 CO 0.38 -0.37 2.04 -0.22 0.00 0.00 0.00 175.76 177.59 2r8y h LYS 81 N 7.44 0.24 -0.79 0.00 1.63 -1.99 -1.94 116.57 121.15 2r8y h LYS 81 Ca -0.32 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.45 2r8y h LYS 81 Cb 1.16 -0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 32.70 2r8y h LYS 81 CO 0.27 0.24 0.47 1.37 -3.45 0.00 0.00 179.45 178.35 2r8y h LEU 82 N 0.24 0.94 -0.26 5.20 8.10 -1.96 0.18 115.31 127.75 2r8y h LEU 82 Ca 0.06 -0.05 -0.11 0.00 0.11 0.00 0.00 57.88 57.89 2r8y h LEU 82 Cb 0.12 -0.24 -0.00 0.00 -0.44 0.00 0.00 40.66 40.10 2r8y h LEU 82 CO -0.00 0.72 -0.27 0.58 -4.11 0.00 0.00 178.44 175.36 2r8y h VAL 83 N 1.08 1.31 -0.28 0.15 2.07 -1.79 -0.54 116.25 118.25 2r8y h VAL 83 Ca 0.28 -1.44 0.03 0.00 0.82 0.00 0.00 66.70 66.40 2r8y h VAL 83 Cb -0.05 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 2r8y h VAL 83 CO -0.05 0.45 0.09 -0.33 0.02 0.00 0.00 177.57 177.75 2r8y h GLU 84 N 0.36 0.20 -0.82 1.57 5.08 -1.14 -0.27 114.58 119.56 2r8y h GLU 84 Ca 0.04 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 2r8y h GLU 84 Cb 0.84 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.00 2r8y h GLU 84 CO 0.07 0.13 0.54 -0.44 -1.00 0.00 0.00 179.01 178.30 2r8y h ASP 85 N 0.21 0.91 -0.36 1.42 3.32 -0.57 -0.33 116.42 121.02 2r8y h ASP 85 Ca 0.13 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 2r8y h ASP 85 Cb 0.10 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2r8y h ASP 85 CO -0.14 0.64 0.12 -0.09 -1.72 0.00 0.00 179.24 178.06 2r8y h ARG 86 N 1.07 0.55 -0.87 3.56 9.65 -0.67 -1.33 114.38 126.34 2r8y h ARG 86 Ca 0.31 -0.11 0.00 0.00 -1.10 0.00 0.00 59.98 59.08 2r8y h ARG 86 Cb -0.06 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 28.39 2r8y h ARG 86 CO -0.09 0.56 0.56 0.00 2.80 0.00 0.00 179.97 183.80 2r8y h ALA 88 N 1.31 0.75 -0.84 0.00 0.00 -0.79 0.11 119.26 119.79 2r8y h ALA 88 Ca 0.32 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.26 2r8y h ALA 88 Cb -0.10 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.45 2r8y h ALA 88 CO -0.07 0.09 0.53 1.15 0.00 0.00 0.00 179.25 180.96 2r8y h THR 89 N 0.71 1.09 -0.02 0.00 2.02 -0.80 -3.01 112.91 112.89 2r8y h THR 89 Ca 0.23 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 67.07 2r8y h THR 89 Cb 0.01 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.41 2r8y h THR 89 CO -0.09 0.18 -0.14 0.18 0.37 0.00 0.00 175.52 176.02 2r8y n LEU 90 N -4.59 2.05 -0.87 2.58 4.77 -0.89 -4.95 117.00 115.10 2r8y n LEU 90 Ca 0.11 -0.69 -0.08 0.00 -0.03 0.00 0.00 56.01 55.33 2r8y n LEU 90 Cb 0.13 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 2r8y n LEU 90 CO 0.32 0.35 -0.10 0.61 -1.33 0.00 0.00 177.39 177.25 2r8y n GLY 91 N 1.31 0.19 3.69 -0.72 0.00 0.17 -4.73 105.19 105.10 2r8y n GLY 91 Ca 0.14 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.38 4.89 -0.40 -0.61 1.01 0.01 -4.94 121.20 118.78 2r8y s ILE 92 Ca 0.00 1.75 0.04 0.00 0.00 0.00 0.00 60.65 62.43 2r8y s ILE 92 Cb 0.00 -4.18 0.02 0.00 0.01 0.00 0.00 42.46 38.30 2r8y s ILE 92 CO 0.00 0.09 0.51 0.35 0.00 0.00 0.00 174.94 175.89 2r8y n THR 93 N 4.38 0.00 -3.81 2.92 -2.24 -1.26 -4.49 114.28 109.77 2r8y n THR 93 Ca 0.04 -0.48 -0.36 0.00 -2.27 0.00 0.00 64.05 60.98 2r8y n THR 93 Cb 0.50 1.06 -0.12 0.00 -2.10 0.00 0.00 70.33 69.66 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 -0.53 3.44 -0.08 4.78 3.76 -1.26 -5.06 115.29 120.34 2r8y s HIS 94 Ca 0.04 -2.09 -0.03 0.00 -0.15 0.00 0.00 55.06 52.82 2r8y s HIS 94 Cb 0.03 -2.73 0.04 0.00 1.11 0.00 0.00 32.58 31.04 2r8y s HIS 94 CO 0.07 -0.88 0.13 -1.17 -0.85 0.00 0.00 174.74 172.03 2r8y s LEU 95 N 1.22 0.02 -0.22 0.89 2.96 -1.26 -1.75 118.68 120.53 2r8y s LEU 95 Ca 0.02 0.17 -0.05 0.00 -0.22 0.00 0.00 54.13 54.06 2r8y s LEU 95 Cb -0.21 0.11 -0.02 0.00 0.50 0.00 0.00 46.19 46.57 2r8y s LEU 95 CO -0.02 -0.26 0.00 -0.31 -1.32 0.00 0.00 176.35 174.45 2r8y s TYR 96 N 2.25 3.01 0.30 5.38 1.51 -0.13 -5.00 117.35 124.67 2r8y s TYR 96 Ca 0.04 -0.66 0.11 0.00 -1.01 0.00 0.00 57.07 55.55 2r8y s TYR 96 Cb -0.12 -2.14 -0.06 0.00 -0.11 0.00 0.00 41.96 39.53 2r8y s TYR 96 CO -0.05 -0.42 -0.16 -0.65 -1.11 0.00 0.00 175.55 173.16 2r8y s GLN 97 N 1.42 1.73 -0.86 -0.62 -0.21 -1.26 -0.53 119.66 119.33 2r8y s GLN 97 Ca 0.05 -1.83 -0.03 0.00 0.02 0.00 0.00 55.36 53.57 2r8y s GLN 97 Cb -0.15 -1.74 0.00 0.00 1.00 0.00 0.00 33.01 32.13 2r8y s GLN 97 CO 0.00 0.26 0.41 0.41 -2.12 0.00 0.00 175.29 174.25 2r8y n GLY 98 N -0.68 0.02 2.98 3.09 0.00 -1.02 -4.78 105.19 104.79 2r8y n GLY 98 Ca -0.05 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 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 -5.29 2.12 0.09 1.61 2.00 -0.14 -4.77 119.66 115.29 2r8y s GLN 99 Ca 0.20 -2.65 -0.14 0.00 -2.00 0.00 0.00 55.36 50.77 2r8y s GLN 99 Cb -0.09 -3.41 -0.16 0.00 0.80 0.00 0.00 33.01 30.16 2r8y s GLN 99 CO 0.25 -1.13 1.30 0.77 -0.50 0.00 0.00 175.29 175.97 2r8y h SER 100 N 6.54 0.86 -3.01 6.67 0.02 -1.83 -3.36 113.55 119.45 2r8y h SER 100 Ca -0.06 -0.62 -0.72 0.00 -0.84 0.00 0.00 61.79 59.55 2r8y h SER 100 Cb 0.90 -0.25 -0.21 0.00 0.14 0.00 0.00 62.40 62.97 2r8y h SER 100 CO 0.70 1.34 0.08 0.21 -1.14 0.00 0.00 176.83 178.01 2r8y s ASN 101 N -6.96 6.27 0.59 3.07 2.47 -1.26 -4.94 114.94 114.19 2r8y s ASN 101 Ca -0.11 -1.69 0.30 0.00 0.42 0.00 0.00 52.86 51.77 2r8y s ASN 101 Cb 0.08 -2.28 1.82 0.00 -1.45 0.00 0.00 41.25 39.42 2r8y s ASN 101 CO 0.88 -0.99 2.25 0.11 -3.72 0.00 0.00 177.10 175.63 2r8y h LYS 102 N 8.94 0.00 -0.97 0.43 1.57 -1.89 -2.73 116.57 121.92 2r8y h LYS 102 Ca -0.23 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.59 2r8y h LYS 102 Cb 1.08 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.33 2r8y h LYS 102 CO 1.05 0.01 0.63 -0.07 -0.57 0.00 0.00 179.45 180.50 2r8y h LEU 103 N 0.00 1.05 -0.26 2.94 3.38 -1.94 -1.48 115.31 119.00 2r8y h LEU 103 Ca -0.00 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2r8y h LEU 103 Cb 0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2r8y h LEU 103 CO 0.00 0.71 0.09 0.40 0.09 0.00 0.00 178.44 179.73 2r8y h ILE 104 N 1.22 1.19 -0.54 1.22 2.04 -1.92 0.01 117.51 120.72 2r8y h ILE 104 Ca 0.39 -0.58 -0.06 0.00 1.00 0.00 0.00 64.86 65.60 2r8y h ILE 104 Cb 0.02 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 2r8y h ILE 104 CO -0.13 0.19 0.09 0.00 0.00 0.00 0.00 178.15 178.31 2r8y h ALA 105 N 0.92 0.72 -0.32 1.87 0.00 -1.66 -2.21 119.26 118.58 2r8y h ALA 105 Ca 0.08 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.77 2r8y h ALA 105 Cb 0.21 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2r8y h ALA 105 CO -0.00 0.45 0.18 0.35 0.00 0.00 0.00 179.25 180.23 2r8y h PHE 106 N 0.78 0.34 -0.61 0.00 3.04 -1.09 0.16 116.94 119.55 2r8y h PHE 106 Ca 0.16 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.09 2r8y h PHE 106 Cb 0.40 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 38.78 2r8y h PHE 106 CO 0.03 0.20 0.25 0.77 -2.02 0.00 0.00 178.31 177.53 2r8y h SER 107 N 0.37 0.85 -0.43 0.41 0.02 -0.87 -1.49 113.55 112.42 2r8y h SER 107 Ca 0.13 -0.17 -0.10 0.00 -0.84 0.00 0.00 61.79 60.81 2r8y h SER 107 Cb 0.01 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 2r8y h SER 107 CO -0.07 0.78 -0.11 -0.78 -1.14 0.00 0.00 176.83 175.52 2r8y h ASP 108 N 0.86 0.83 0.01 3.07 3.58 -1.16 -1.78 116.42 121.83 2r8y h ASP 108 Ca 0.20 -0.36 0.03 0.00 0.42 0.00 0.00 57.03 57.32 2r8y h ASP 108 Cb 0.20 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 40.99 2r8y h ASP 108 CO -0.02 1.01 -0.19 0.25 -2.88 0.00 0.00 179.24 177.41 2r8y h LEU 109 N 0.65 -0.56 -0.86 2.28 6.46 -0.48 0.65 115.31 123.45 2r8y h LEU 109 Ca 0.11 0.08 0.01 0.00 -0.12 0.00 0.00 57.88 57.95 2r8y h LEU 109 Cb 0.64 0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 40.76 2r8y h LEU 109 CO 0.04 -0.26 0.56 -0.07 -0.62 0.00 0.00 178.44 178.10 2r8y h LEU 110 N -0.32 1.00 0.15 2.25 3.38 -1.21 -0.62 115.31 119.94 2r8y h LEU 110 Ca 0.05 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2r8y h LEU 110 Cb 0.39 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2r8y h LEU 110 CO -0.17 0.73 -0.07 -0.33 0.09 0.00 0.00 178.44 178.69 2r8y h GLU 111 N 1.17 -0.20 -0.32 1.13 4.39 -0.97 0.11 114.58 119.89 2r8y h GLU 111 Ca 0.31 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.98 2r8y h GLU 111 Cb -0.12 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 2r8y h GLU 111 CO -0.07 -0.07 0.01 0.87 -1.16 0.00 0.00 179.01 178.59 2r8y h LYS 112 N -0.27 0.49 -0.01 2.33 1.57 -0.61 -2.35 116.57 117.72 2r8y h LYS 112 Ca -0.02 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2r8y h LYS 112 Cb 0.21 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2r8y h LYS 112 CO 0.03 0.51 -0.31 1.28 -0.57 0.00 0.00 179.45 180.40 2r8y n LEU 113 N -4.30 1.50 -3.74 2.94 4.77 -0.26 -4.97 117.00 112.94 2r8y n LEU 113 Ca 0.01 -0.49 -0.23 0.00 -0.03 0.00 0.00 56.01 55.28 2r8y n LEU 113 Cb 0.23 -0.06 0.03 0.00 -2.33 0.00 0.00 43.42 41.29 2r8y n LEU 113 CO 0.38 0.28 -0.02 0.00 -1.33 0.00 0.00 177.39 176.70 2r8y n ALA 114 N -0.29 -1.84 -2.90 -1.18 0.00 0.29 -5.00 120.51 109.60 2r8y n ALA 114 Ca 0.12 -0.07 -0.32 0.00 0.00 0.00 0.00 53.44 53.17 2r8y n ALA 114 Cb 0.40 -2.60 -0.16 0.00 0.00 0.00 0.00 19.45 17.09 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 -3.57 2.39 0.39 0.00 2.07 -0.70 -5.05 121.20 116.73 2r8y s ILE 115 Ca 0.16 -0.93 -0.25 0.00 -1.41 0.00 0.00 60.65 58.23 2r8y s ILE 115 Cb -0.08 -1.92 -0.09 0.00 0.13 0.00 0.00 42.46 40.50 2r8y s ILE 115 CO 0.81 0.56 1.10 0.00 -1.91 0.00 0.00 174.94 175.50 2r8y s ALA 116 N 0.00 3.12 0.51 1.50 0.00 -1.26 -4.72 121.76 120.91 2r8y s ALA 116 Ca -0.07 0.82 0.19 0.00 0.00 0.00 0.00 51.96 52.89 2r8y s ALA 116 Cb -0.15 -3.32 1.26 0.00 0.00 0.00 0.00 23.12 20.91 2r8y s ALA 116 CO 0.05 -0.34 2.06 -1.35 0.00 0.00 0.00 175.76 176.18 2r8y h PRO 117 N 2.62 0.09 0.00 0.00 0.10 -1.96 -0.57 132.00 132.27 2r8y h PRO 117 Ca -0.48 -0.01 -0.01 0.00 0.10 0.00 0.00 66.00 65.61 2r8y h PRO 117 Cb 1.22 -0.02 -0.00 0.00 0.10 0.00 0.00 31.00 32.30 2r8y h PRO 117 CO 0.63 0.06 -0.03 1.05 0.10 0.00 0.00 178.00 179.81 2r8y h GLU 118 N 0.09 0.00 -0.62 1.05 9.09 -1.88 -0.31 114.58 122.00 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 0.45 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.55 2r8y h GLU 118 CO -0.01 0.03 0.00 0.09 0.05 0.00 0.00 179.01 179.16 2r8y n ASN 119 N -3.24 3.60 -4.47 3.06 3.02 -0.22 -3.94 115.26 113.07 2r8y n ASN 119 Ca -0.02 -2.35 -0.33 0.00 -0.03 0.00 0.00 54.58 51.85 2r8y n ASN 119 Cb 0.18 -0.50 -0.13 0.00 -0.61 0.00 0.00 39.78 38.72 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 -1.81 3.22 -0.00 2.41 1.01 -0.85 -0.17 120.40 124.20 2r8y s VAL 120 Ca 0.36 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.73 2r8y s VAL 120 Cb 0.24 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 2r8y s VAL 120 CO 0.17 0.57 -0.09 0.00 0.00 0.00 0.00 175.10 175.75 2r8y s ALA 121 N -0.45 2.93 -0.02 5.51 0.00 -0.08 -1.52 121.76 128.12 2r8y s ALA 121 Ca 0.06 -1.02 0.02 0.00 0.00 0.00 0.00 51.96 51.01 2r8y s ALA 121 Cb -0.12 -1.08 0.01 0.00 0.00 0.00 0.00 23.12 21.93 2r8y s ALA 121 CO 0.02 0.60 -0.07 -0.47 0.00 0.00 0.00 175.76 175.84 2r8y s TYR 122 N -0.94 0.76 -0.19 0.00 5.04 -0.57 -0.24 117.35 121.21 2r8y s TYR 122 Ca 0.16 -0.18 0.01 0.00 -2.44 0.00 0.00 57.07 54.62 2r8y s TYR 122 Cb -0.11 -0.57 0.02 0.00 0.35 0.00 0.00 41.96 41.66 2r8y s TYR 122 CO 0.06 -0.10 -0.19 0.08 -1.34 0.00 0.00 175.55 174.06 2r8y s VAL 123 N 0.30 2.08 0.24 3.14 1.01 -0.81 -0.13 120.40 126.22 2r8y s VAL 123 Ca -0.04 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.98 2r8y s VAL 123 Cb -0.08 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.35 2r8y s VAL 123 CO 0.00 0.50 0.05 -0.83 0.00 0.00 0.00 175.10 174.82 2r8y s GLY 124 N 1.28 1.62 0.00 4.51 0.00 -0.19 -2.73 107.32 111.80 2r8y s GLY 124 Ca 0.04 -1.80 0.00 0.00 0.00 0.00 0.00 44.72 42.96 2r8y s GLY 124 CO -0.12 -1.61 0.13 2.09 0.00 0.00 0.00 173.10 173.58 2r8y n ASP 125 N -0.42 0.25 -3.75 1.64 3.85 -1.26 -2.25 116.55 114.61 2r8y n ASP 125 Ca -0.03 -0.68 -0.14 0.00 -0.71 0.00 0.00 54.79 53.24 2r8y n ASP 125 Cb 0.65 0.18 -0.08 0.00 -1.35 0.00 0.00 41.12 40.52 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 -0.18 0.67 0.40 -1.12 -1.08 -1.26 -0.26 116.67 113.84 2r8y s ASP 126 Ca 0.00 -1.44 0.13 0.00 -0.52 0.00 0.00 52.55 50.72 2r8y s ASP 126 Cb 0.00 0.52 0.83 0.00 -1.46 0.00 0.00 42.92 42.81 2r8y s ASP 126 CO 0.00 -1.04 1.90 -0.07 0.52 0.00 0.00 175.17 176.47 2r8y h LEU 127 N 2.33 0.03 -1.97 -1.34 3.38 -1.97 -1.56 115.31 114.21 2r8y h LEU 127 Ca -0.30 -0.01 0.22 0.00 0.09 0.00 0.00 57.88 57.89 2r8y h LEU 127 Cb 1.24 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 2r8y h LEU 127 CO 0.43 0.30 0.60 -0.29 0.09 0.00 0.00 178.44 179.57 2r8y h ILE 128 N 0.02 0.51 0.00 1.22 6.09 -2.01 -1.79 117.51 121.55 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 0.51 0.57 0.00 0.00 0.47 0.00 0.00 36.82 38.37 2r8y h ILE 128 CO 0.04 0.00 -0.13 0.44 -3.07 0.00 0.00 178.15 175.43 2r8y h ASP 129 N 0.00 0.00 -0.30 2.19 3.32 -1.70 -3.39 116.42 116.54 2r8y h ASP 129 Ca 0.36 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.36 2r8y h ASP 129 Cb 1.55 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.09 2r8y h ASP 129 CO -0.00 0.01 0.08 -0.25 -1.72 0.00 0.00 179.24 177.35 2r8y h TRP 130 N 0.00 0.51 -1.00 4.55 2.91 -1.43 -1.67 115.95 119.81 2r8y h TRP 130 Ca 0.00 -0.06 0.20 0.00 1.13 0.00 0.00 58.89 60.16 2r8y h TRP 130 Cb 0.87 -0.14 -0.11 0.00 -0.51 0.00 0.00 29.16 29.27 2r8y h TRP 130 CO 0.00 0.54 0.61 -1.35 -1.03 0.00 0.00 178.44 177.21 2r8y h PRO 131 N 0.32 0.69 0.04 2.65 0.11 -1.77 0.27 132.00 134.31 2r8y h PRO 131 Ca 0.09 -0.04 -0.21 0.00 0.11 0.00 0.00 66.00 65.95 2r8y h PRO 131 Cb 0.29 -0.16 0.02 0.00 0.11 0.00 0.00 31.00 31.26 2r8y h PRO 131 CO 0.00 0.46 -0.85 0.28 -0.21 0.00 0.00 178.00 177.67 2r8y h VAL 132 N 0.71 1.38 -0.89 3.15 2.07 -1.82 -3.29 116.25 117.56 2r8y h VAL 132 Ca 0.58 -2.25 0.10 0.00 0.82 0.00 0.00 66.70 65.95 2r8y h VAL 132 Cb 0.98 2.65 -0.07 0.00 -1.52 0.00 0.00 31.29 33.33 2r8y h VAL 132 CO -0.38 0.67 0.58 0.24 0.02 0.00 0.00 177.57 178.70 2r8y h MET 133 N 0.04 0.84 -0.14 1.57 2.86 -0.25 -1.08 114.93 118.77 2r8y h MET 133 Ca -0.12 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.51 2r8y h MET 133 Cb 1.56 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 33.03 2r8y h MET 133 CO 0.17 0.56 0.13 1.49 1.06 0.00 0.00 176.91 180.32 2r8y h GLU 134 N 0.87 0.00 0.00 1.72 4.81 -0.58 -2.86 114.58 118.53 2r8y h GLU 134 Ca 0.42 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.61 2r8y h GLU 134 Cb 0.44 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 2r8y h GLU 134 CO -0.18 0.00 -1.43 1.63 -0.73 0.00 0.00 179.01 178.30 2r8y n LYS 135 N -3.98 0.63 -2.35 1.92 5.02 -0.42 -4.99 118.16 113.99 2r8y n LYS 135 Ca 0.00 0.03 -0.26 0.00 -2.02 0.00 0.00 58.31 56.06 2r8y n LYS 135 Cb 0.25 -1.71 0.04 0.00 -0.02 0.00 0.00 35.03 33.59 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 3.24 0.15 -0.18 -7.23 -1.08 -4.57 120.40 107.40 2r8y s VAL 136 Ca -0.04 -0.10 -0.10 0.00 -1.81 0.00 0.00 61.98 59.93 2r8y s VAL 136 Cb 0.11 -3.31 -0.05 0.00 0.56 0.00 0.00 36.38 33.69 2r8y s VAL 136 CO 0.83 -0.32 1.47 1.23 -0.31 0.00 0.00 175.10 178.00 2r8y h GLY 137 N -0.28 0.98 -7.17 2.32 0.00 0.01 -3.41 103.07 95.52 2r8y h GLY 137 Ca -0.45 -1.03 -0.56 0.00 0.00 0.00 0.00 47.33 45.29 2r8y h GLY 137 CO 0.60 0.93 -0.76 -2.27 0.00 0.00 0.00 176.54 175.04 2r8y s LEU 138 N -8.80 1.80 -0.03 3.11 2.96 -0.84 -4.89 118.68 111.99 2r8y s LEU 138 Ca -0.11 -1.37 -0.17 0.00 -0.22 0.00 0.00 54.13 52.26 2r8y s LEU 138 Cb 0.11 -0.76 -0.05 0.00 0.50 0.00 0.00 46.19 45.99 2r8y s LEU 138 CO 0.88 -0.38 0.47 -0.94 -1.32 0.00 0.00 176.35 175.05 2r8y s SER 139 N 1.72 6.81 -0.06 3.68 1.04 -1.26 -1.50 113.70 124.12 2r8y s SER 139 Ca 0.06 0.96 0.02 0.00 0.48 0.00 0.00 55.95 57.47 2r8y s SER 139 Cb -0.17 -2.29 0.02 0.00 0.10 0.00 0.00 66.02 63.68 2r8y s SER 139 CO -0.21 0.19 -0.10 -0.69 0.98 0.00 0.00 173.24 173.41 2r8y s VAL 140 N -0.41 0.97 -0.15 5.02 1.01 0.81 -1.21 120.40 126.45 2r8y s VAL 140 Ca 0.26 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.82 2r8y s VAL 140 Cb -0.17 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 2r8y s VAL 140 CO 0.13 0.32 0.01 0.00 0.00 0.00 0.00 175.10 175.57 2r8y s ALA 141 N 0.84 3.24 0.80 5.51 0.00 -0.67 -1.02 121.76 130.46 2r8y s ALA 141 Ca -0.12 -0.78 -0.11 0.00 0.00 0.00 0.00 51.96 50.96 2r8y s ALA 141 Cb -0.15 -1.69 0.08 0.00 0.00 0.00 0.00 23.12 21.36 2r8y s ALA 141 CO 0.02 0.30 1.11 0.14 0.00 0.00 0.00 175.76 177.32 2r8y s VAL 142 N 0.04 2.98 0.33 0.00 -7.23 -0.95 -1.56 120.40 114.01 2r8y s VAL 142 Ca 0.03 0.33 0.06 0.00 -1.81 0.00 0.00 61.98 60.59 2r8y s VAL 142 Cb -0.13 -2.70 0.31 0.00 0.56 0.00 0.00 36.38 34.42 2r8y s VAL 142 CO 0.02 -0.41 1.87 0.00 -0.31 0.00 0.00 175.10 176.27 2r8y h ALA 143 N -1.26 1.71 -0.45 1.32 0.00 -1.58 -1.91 119.26 117.09 2r8y h ALA 143 Ca -0.44 0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.27 2r8y h ALA 143 Cb 1.24 -0.17 -0.13 0.00 0.00 0.00 0.00 17.79 18.74 2r8y h ALA 143 CO 0.49 0.07 0.05 -0.40 0.00 0.00 0.00 179.25 179.46 2r8y n ASP 144 N -4.56 2.89 -4.53 0.00 5.75 -1.26 -5.01 116.55 109.83 2r8y n ASP 144 Ca 0.17 -3.65 -0.30 0.00 -0.01 0.00 0.00 54.79 50.99 2r8y n ASP 144 Cb 0.39 -0.66 0.20 0.00 -1.03 0.00 0.00 41.12 40.02 2r8y n ASP 144 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2r8y n ALA 145 N -1.03 -2.14 -1.62 2.12 0.00 -0.72 -4.92 120.51 112.19 2r8y n ALA 145 Ca 0.36 -0.88 -0.48 0.00 0.00 0.00 0.00 53.44 52.44 2r8y n ALA 145 Cb 1.13 -2.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 2r8y n ALA 145 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2r8y n HIS 146 N -4.51 1.76 -0.15 0.00 -0.00 0.64 -4.84 115.22 108.11 2r8y n HIS 146 Ca 0.07 0.53 0.21 0.00 0.46 0.00 0.00 57.72 58.99 2r8y n HIS 146 Cb 0.54 -2.39 0.61 0.00 -0.12 0.00 0.00 29.99 28.63 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 4.32 0.19 0.00 1.57 0.11 -1.91 -0.81 132.00 135.48 2r8y h PRO 147 Ca -0.45 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 2r8y h PRO 147 Cb 1.31 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2r8y h PRO 147 CO 0.77 0.13 -0.27 -0.07 -0.21 0.00 0.00 178.00 178.34 2r8y h LEU 148 N 0.20 0.00 0.11 2.35 3.38 -1.98 -3.24 115.31 116.13 2r8y h LEU 148 Ca 0.39 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 58.09 2r8y h LEU 148 Cb 1.23 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.00 2r8y h LEU 148 CO -0.08 0.27 -1.13 0.25 0.09 0.00 0.00 178.44 177.84 2r8y h LEU 149 N 0.00 0.80 -0.73 1.67 5.85 -1.50 -3.40 115.31 118.00 2r8y h LEU 149 Ca -0.00 -0.83 0.14 0.00 0.84 0.00 0.00 57.88 58.02 2r8y h LEU 149 Cb 0.83 -0.25 -0.14 0.00 0.37 0.00 0.00 40.66 41.47 2r8y h LEU 149 CO 0.04 1.55 -0.26 0.40 -0.34 0.00 0.00 178.44 179.83 2r8y h ILE 150 N 0.16 0.19 0.00 4.05 2.04 -1.54 -0.71 117.51 121.70 2r8y h ILE 150 Ca -0.17 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.69 2r8y h ILE 150 Cb 1.83 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 2r8y h ILE 150 CO 0.22 0.00 0.00 -2.65 0.00 0.00 0.00 178.15 175.72 2r8y n PRO 151 N -5.48 0.13 0.09 2.37 -0.02 -1.26 -3.01 135.00 127.83 2r8y n PRO 151 Ca 0.09 0.38 0.02 0.00 -2.02 0.00 0.00 63.50 61.97 2r8y n PRO 151 Cb 0.38 -1.76 -0.02 0.00 -0.02 0.00 0.00 33.50 32.08 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 -7.08 -0.52 3.08 -1.36 -3.48 114.38 105.02 2r8y h ARG 152 Ca 0.00 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.60 2r8y h ARG 152 Cb 0.31 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 2r8y h ARG 152 CO 0.00 0.36 0.36 0.00 -1.07 0.00 0.00 179.97 179.62 2r8y s ALA 153 N -2.98 3.00 0.18 0.04 0.00 -1.16 -4.97 121.76 115.86 2r8y s ALA 153 Ca 0.01 0.41 -0.12 0.00 0.00 0.00 0.00 51.96 52.26 2r8y s ALA 153 Cb 0.08 -3.17 0.08 0.00 0.00 0.00 0.00 23.12 20.11 2r8y s ALA 153 CO 0.77 -0.04 1.75 -0.44 0.00 0.00 0.00 175.76 177.81 2r8y h ASP 154 N 1.66 0.81 -3.86 0.00 3.45 -1.51 -3.43 116.42 113.54 2r8y h ASP 154 Ca -0.49 -0.14 -0.44 0.00 0.43 0.00 0.00 57.03 56.39 2r8y h ASP 154 Cb 1.19 -0.21 -0.31 0.00 -0.56 0.00 0.00 39.33 39.45 2r8y h ASP 154 CO 0.61 0.73 -0.79 -0.47 -1.57 0.00 0.00 179.24 177.74 2r8y s TYR 155 N -5.66 1.04 -0.23 4.55 5.04 -0.65 -4.95 117.35 116.49 2r8y s TYR 155 Ca -0.13 -0.26 -0.06 0.00 -2.44 0.00 0.00 57.07 54.18 2r8y s TYR 155 Cb 0.13 -0.72 -0.02 0.00 0.35 0.00 0.00 41.96 41.69 2r8y s TYR 155 CO 0.79 -0.10 0.03 0.08 -1.34 0.00 0.00 175.55 175.01 2r8y s VAL 156 N 0.12 4.05 0.70 3.14 1.01 -1.26 -1.67 120.40 126.49 2r8y s VAL 156 Ca -0.02 -0.27 -0.15 0.00 0.00 0.00 0.00 61.98 61.54 2r8y s VAL 156 Cb -0.08 -2.86 0.02 0.00 0.00 0.00 0.00 36.38 33.46 2r8y s VAL 156 CO 0.01 0.38 1.17 0.42 0.00 0.00 0.00 175.10 177.07 2r8y s THR 157 N 1.38 2.69 0.11 3.92 -4.23 -0.60 -4.91 115.64 114.00 2r8y s THR 157 Ca 0.05 0.33 -0.03 0.00 -1.18 0.00 0.00 61.69 60.86 2r8y s THR 157 Cb -0.15 -2.87 -0.22 0.00 1.34 0.00 0.00 72.50 70.60 2r8y s THR 157 CO 0.02 -0.19 1.25 0.03 -0.54 0.00 0.00 174.62 175.19 2r8y h ARG 158 N -0.15 0.31 -6.05 3.99 -0.00 -1.92 -3.24 114.38 107.32 2r8y h ARG 158 Ca -0.47 -0.41 -0.60 0.00 -0.50 0.00 0.00 59.98 58.00 2r8y h ARG 158 Cb 1.27 0.13 -0.05 0.00 0.00 0.00 0.00 29.97 31.33 2r8y h ARG 158 CO 0.51 1.13 -0.31 0.42 0.00 0.00 0.00 179.97 181.73 2r8y s ILE 159 N -3.00 5.18 0.65 2.04 -1.09 -1.26 -4.78 121.20 118.93 2r8y s ILE 159 Ca -0.04 0.28 -0.11 0.00 -2.23 0.00 0.00 60.65 58.54 2r8y s ILE 159 Cb 0.08 -3.62 -0.02 0.00 -1.58 0.00 0.00 42.46 37.32 2r8y s ILE 159 CO 0.87 0.27 1.04 0.00 -1.23 0.00 0.00 174.94 175.89 2r8y s ALA 160 N -1.41 2.94 0.26 9.38 0.00 -1.26 -3.31 121.76 128.35 2r8y s ALA 160 Ca 0.33 -0.01 -0.31 0.00 0.00 0.00 0.00 51.96 51.97 2r8y s ALA 160 Cb -0.13 -3.12 -0.13 0.00 0.00 0.00 0.00 23.12 19.73 2r8y s ALA 160 CO 0.19 -0.88 1.36 0.41 0.00 0.00 0.00 175.76 176.83 2r8y n GLY 161 N -2.41 0.66 3.17 0.00 0.00 -1.26 -1.78 105.19 103.58 2r8y n GLY 161 Ca 0.07 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 1.86 1.39 0.26 -0.02 0.00 -0.61 -4.13 105.19 103.93 2r8y n GLY 162 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.16 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 0.44 0.00 1.61 5.12 -0.74 -4.46 116.66 116.63 2r8y n ARG 163 Ca 0.00 -0.84 0.00 0.00 -1.93 0.00 0.00 57.85 55.08 2r8y n ARG 163 Cb 0.00 -1.11 0.00 0.00 -1.16 0.00 0.00 32.46 30.19 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 0.47 1.46 0.29 -0.13 0.00 -1.23 -4.83 105.19 101.22 2r8y n GLY 164 Ca 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.03 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 0.97 -0.35 4.61 0.00 -1.72 -1.10 119.26 121.67 2r8y h ALA 165 Ca 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2r8y h ALA 165 Cb 0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2r8y h ALA 165 CO 0.00 0.25 -0.13 0.28 0.00 0.00 0.00 179.25 179.64 2r8y h VAL 166 N 0.90 1.28 -0.63 0.00 2.07 -1.88 -2.35 116.25 115.64 2r8y h VAL 166 Ca 0.30 -1.23 0.08 0.00 0.82 0.00 0.00 66.70 66.67 2r8y h VAL 166 Cb 0.03 1.34 -0.07 0.00 -1.52 0.00 0.00 31.29 31.08 2r8y h VAL 166 CO -0.12 0.40 0.28 -0.09 0.02 0.00 0.00 177.57 178.07 2r8y h ARG 167 N 0.50 0.49 -0.58 1.57 9.65 -1.77 -0.51 114.38 123.73 2r8y h ARG 167 Ca 0.08 -0.03 0.07 0.00 -1.10 0.00 0.00 59.98 59.00 2r8y h ARG 167 Cb 0.66 -0.11 -0.06 0.00 -1.39 0.00 0.00 29.97 29.07 2r8y h ARG 167 CO 0.04 0.32 0.26 1.49 2.80 0.00 0.00 179.97 184.89 2r8y h GLU 168 N 0.50 0.47 -0.38 0.20 4.81 -0.95 0.15 114.58 119.39 2r8y h GLU 168 Ca 0.31 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.49 2r8y h GLU 168 Cb 0.33 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 2r8y h GLU 168 CO -0.27 0.31 0.14 0.28 -0.73 0.00 0.00 179.01 178.75 2r8y h VAL 169 N 0.49 1.20 -0.46 0.32 2.07 -1.03 -0.68 116.25 118.14 2r8y h VAL 169 Ca 0.27 -0.62 0.02 0.00 0.82 0.00 0.00 66.70 67.20 2r8y h VAL 169 Cb 0.25 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 2r8y h VAL 169 CO -0.23 0.22 0.28 0.00 0.02 0.00 0.00 177.57 177.86 2r8y h ASP 171 N 0.56 1.05 0.14 0.00 3.45 -0.62 -1.24 116.42 119.77 2r8y h ASP 171 Ca 0.18 -0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.63 2r8y h ASP 171 Cb 0.00 -0.24 0.00 0.00 -0.56 0.00 0.00 39.33 38.54 2r8y h ASP 171 CO -0.08 0.72 -0.07 0.25 -1.57 0.00 0.00 179.24 178.49 2r8y h LEU 172 N 1.22 -0.16 -0.22 1.55 5.85 -0.38 0.86 115.31 124.03 2r8y h LEU 172 Ca 0.39 -0.15 0.05 0.00 0.84 0.00 0.00 57.88 59.01 2r8y h LEU 172 Cb 0.01 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 2r8y h LEU 172 CO -0.12 0.05 -0.08 -0.07 -0.34 0.00 0.00 178.44 177.87 2r8y h LEU 173 N -0.38 -0.29 -0.16 2.25 3.38 -1.08 0.17 115.31 119.20 2r8y h LEU 173 Ca -0.02 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2r8y h LEU 173 Cb 0.30 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2r8y h LEU 173 CO 0.03 -0.11 0.07 -0.07 0.09 0.00 0.00 178.44 178.45 2r8y h LEU 174 N -0.05 0.22 -0.55 1.67 3.38 -1.19 -1.32 115.31 117.47 2r8y h LEU 174 Ca 0.11 -0.16 0.10 0.00 0.09 0.00 0.00 57.88 58.03 2r8y h LEU 174 Cb 0.22 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 2r8y h LEU 174 CO -0.25 0.32 0.11 0.25 0.09 0.00 0.00 178.44 178.95 2r8y h LEU 175 N 0.11 -0.02 -1.55 1.67 5.85 -0.62 0.15 115.31 120.89 2r8y h LEU 175 Ca 0.05 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 2r8y h LEU 175 Cb 0.16 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 2r8y h LEU 175 CO -0.00 0.01 -0.24 0.00 -0.34 0.00 0.00 178.44 177.87 2r8y h ALA 176 N 1.44 1.44 -0.70 1.25 0.00 -0.28 -2.62 119.26 119.79 2r8y h ALA 176 Ca 0.28 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2r8y h ALA 176 Cb 0.41 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2r8y h ALA 176 CO -0.38 0.30 0.00 1.04 0.00 0.00 0.00 179.25 180.21 2r8y n GLN 177 N -4.02 2.68 -2.13 0.00 6.02 -0.53 -4.54 117.38 114.86 2r8y n GLN 177 Ca -0.02 -2.60 -0.13 0.00 -0.01 0.00 0.00 57.00 54.24 2r8y n GLN 177 Cb 0.31 -1.56 -0.01 0.00 1.02 0.00 0.00 30.24 29.99 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 1.65 0.06 0.29 1.08 0.00 -0.70 -4.91 105.19 102.65 2r8y n GLY 178 Ca 0.24 -0.33 0.04 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.34 0.52 -0.06 1.61 5.02 0.43 -4.80 118.16 118.55 2r8y n LYS 179 Ca -0.16 -0.88 -0.12 0.00 -2.02 0.00 0.00 58.31 55.13 2r8y n LYS 179 Cb 0.59 -1.12 -0.07 0.00 -0.02 0.00 0.00 35.03 34.42 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 1.41 0.34 -0.59 -0.35 5.85 -1.84 -2.52 115.31 117.61 2r8y h LEU 180 Ca 0.00 -0.41 0.12 0.00 0.84 0.00 0.00 57.88 58.42 2r8y h LEU 180 Cb 0.32 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.16 2r8y h LEU 180 CO 0.00 0.68 0.08 0.44 -0.34 0.00 0.00 178.44 179.29 2r8y h ASP 181 N -0.00 -0.10 0.01 1.25 3.32 -1.91 -2.93 116.42 116.06 2r8y h ASP 181 Ca 0.03 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2r8y h ASP 181 Cb 0.55 0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.29 2r8y h ASP 181 CO 0.02 -0.04 -0.19 -0.62 -1.72 0.00 0.00 179.24 176.69 2r8y n GLU 182 N -5.18 1.66 -1.76 3.56 -0.58 -1.22 -4.97 120.64 112.14 2r8y n GLU 182 Ca 0.08 -1.28 -0.41 0.00 -0.42 0.00 0.00 57.16 55.13 2r8y n GLU 182 Cb 0.33 -1.47 0.01 0.00 -0.57 0.00 0.00 31.44 29.73 2r8y n GLU 182 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2r8y n ALA 183 N 0.45 2.17 -2.86 0.62 0.00 -0.95 -5.01 120.51 114.93 2r8y n ALA 183 Ca 0.13 0.31 -0.28 0.00 0.00 0.00 0.00 53.44 53.60 2r8y n ALA 183 Cb 0.49 -2.40 -0.16 0.00 0.00 0.00 0.00 19.45 17.38 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 -2.22 2.07 0.28 0.00 -0.14 -1.26 -5.05 119.74 113.42 2r8y s LYS 184 Ca 0.56 -0.71 -0.01 0.00 -1.36 0.00 0.00 55.97 54.45 2r8y s LYS 184 Cb -0.47 -1.77 0.01 0.00 -1.68 0.00 0.00 37.83 33.91 2r8y s LYS 184 CO 0.61 0.29 0.38 0.41 -0.76 0.00 0.00 175.35 176.29 2r8y n GLY 185 N 3.09 2.35 3.12 -3.33 0.00 -1.26 -3.58 105.19 105.58 2r8y n GLY 185 Ca -0.18 -1.58 -0.26 0.00 0.00 0.00 0.00 46.02 44.00 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 -2.66 1.70 -1.26 1.61 1.11 -1.26 -4.99 119.66 113.91 2r8y s GLN 186 Ca 0.24 -0.58 -0.11 0.00 0.01 0.00 0.00 55.36 54.92 2r8y s GLN 186 Cb -0.01 -1.49 0.16 0.00 -1.01 0.00 0.00 33.01 30.67 2r8y s GLN 186 CO 0.17 0.23 1.71 0.45 0.01 0.00 0.00 175.29 177.86 2r8y n SER 187 N 3.16 5.11 0.00 5.90 2.88 -1.26 -2.38 113.62 127.04 2r8y n SER 187 Ca -0.18 -3.05 0.00 0.00 -1.33 0.00 0.00 58.87 54.31 2r8y n SER 187 Cb 0.53 -1.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.47 2r8y n SER 187 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11