#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 3.37 0.25 -1.18 0.00 -1.26 0.15 121.76 123.09 2r8y s ALA 9 Ca 0.00 0.82 0.03 0.00 0.00 0.00 0.00 51.96 52.81 2r8y s ALA 9 Cb 0.00 -3.35 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 2r8y s ALA 9 CO 0.00 -0.22 0.03 0.95 0.00 0.00 0.00 175.76 176.52 2r8y s THR 10 N -0.22 0.97 -1.36 0.00 -4.23 -1.09 -4.88 115.64 104.83 2r8y s THR 10 Ca 0.50 -2.02 0.13 0.00 -1.18 0.00 0.00 61.69 59.11 2r8y s THR 10 Cb -0.29 -2.48 0.20 0.00 1.34 0.00 0.00 72.50 71.27 2r8y s THR 10 CO 0.35 -0.21 1.33 0.00 -0.54 0.00 0.00 174.62 175.55 2r8y n TYR 12 N -1.32 0.00 0.00 0.00 4.02 -1.26 -5.10 117.16 113.50 2r8y n TYR 12 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 2r8y n TYR 12 Cb 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.43 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 0.83 3.30 3.66 2.72 0.00 -0.25 -4.93 105.19 110.52 2r8y n GLY 13 Ca 0.05 -1.91 -0.40 0.00 0.00 0.00 0.00 46.02 43.77 2r8y n GLY 13 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2r8y n PRO 14 N -1.25 1.43 -4.37 1.61 -0.02 -1.26 -2.69 135.00 128.44 2r8y n PRO 14 Ca 0.00 0.52 -0.21 0.00 -2.02 0.00 0.00 63.50 61.79 2r8y n PRO 14 Cb 0.00 -2.27 -0.10 0.00 -0.02 0.00 0.00 33.50 31.11 2r8y n PRO 14 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2r8y s VAL 15 N -1.33 1.96 0.59 -1.45 -7.23 0.39 -4.86 120.40 108.47 2r8y s VAL 15 Ca 0.68 -2.17 -0.17 0.00 -1.81 0.00 0.00 61.98 58.51 2r8y s VAL 15 Cb -0.48 -2.05 -0.03 0.00 0.56 0.00 0.00 36.38 34.38 2r8y s VAL 15 CO 0.53 -0.45 1.11 -0.94 -0.31 0.00 0.00 175.10 175.03 2r8y s SER 16 N -3.15 5.52 0.36 4.85 1.04 -1.26 -4.28 113.70 116.77 2r8y s SER 16 Ca 0.22 2.04 0.06 0.00 0.48 0.00 0.00 55.95 58.75 2r8y s SER 16 Cb -0.03 -2.56 0.73 0.00 0.10 0.00 0.00 66.02 64.26 2r8y s SER 16 CO 0.09 -1.35 1.95 0.00 0.98 0.00 0.00 173.24 174.90 2r8y h ALA 17 N 0.65 1.70 -0.46 5.32 0.00 -1.99 -2.04 119.26 122.44 2r8y h ALA 17 Ca -0.48 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.29 2r8y h ALA 17 Cb 1.25 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2r8y h ALA 17 CO 0.56 0.17 -0.17 0.22 0.00 0.00 0.00 179.25 180.03 2r8y h ASP 18 N 0.77 0.91 -0.60 0.00 3.58 -1.99 -0.42 116.42 118.67 2r8y h ASP 18 Ca 0.33 -0.31 -0.07 0.00 0.42 0.00 0.00 57.03 57.40 2r8y h ASP 18 Cb 0.30 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 2r8y h ASP 18 CO -0.12 1.06 0.10 0.58 -2.88 0.00 0.00 179.24 177.99 2r8y h VAL 19 N 0.79 1.26 -0.57 2.25 2.07 -1.81 -1.65 116.25 118.59 2r8y h VAL 19 Ca 0.12 -0.99 -0.09 0.00 0.82 0.00 0.00 66.70 66.56 2r8y h VAL 19 Cb 0.71 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2r8y h VAL 19 CO 0.05 0.36 -0.00 -0.03 0.02 0.00 0.00 177.57 177.97 2r8y h MET 20 N 0.90 1.01 -0.75 1.57 1.85 -1.14 -1.17 114.93 117.20 2r8y h MET 20 Ca 0.18 -0.32 -0.06 0.00 -0.61 0.00 0.00 59.70 58.89 2r8y h MET 20 Cb 0.42 -0.09 -0.03 0.00 0.43 0.00 0.00 31.60 32.33 2r8y h MET 20 CO 0.01 1.01 0.23 0.00 -0.40 0.00 0.00 176.91 177.76 2r8y h ALA 21 N 0.97 0.99 -0.41 0.39 0.00 -0.98 -0.81 119.26 119.41 2r8y h ALA 21 Ca 0.16 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2r8y h ALA 21 Cb 0.55 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2r8y h ALA 21 CO 0.03 0.67 0.14 0.87 0.00 0.00 0.00 179.25 180.96 2r8y h LYS 22 N 1.12 0.64 -0.16 0.00 1.57 -1.14 -3.02 116.57 115.57 2r8y h LYS 22 Ca 0.24 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.84 2r8y h LYS 22 Cb 0.32 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2r8y h LYS 22 CO -0.01 0.62 -0.10 0.00 -0.57 0.00 0.00 179.45 179.40 2r8y h ALA 23 N 0.98 1.54 -0.28 3.86 0.00 -0.96 -2.82 119.26 121.58 2r8y h ALA 23 Ca 0.13 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2r8y h ALA 23 Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2r8y h ALA 23 CO -0.01 0.33 0.13 1.49 0.00 0.00 0.00 179.25 181.20 2r8y h GLU 24 N 0.24 0.39 -0.00 0.00 4.22 -1.01 -2.93 114.58 115.48 2r8y h GLU 24 Ca 0.05 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.45 2r8y h GLU 24 Cb 0.33 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2r8y h GLU 24 CO 0.02 0.31 -0.07 0.09 -2.18 0.00 0.00 179.01 177.18 2r8y n ASN 25 N -4.44 0.50 -4.64 1.04 4.13 -1.06 -4.77 115.26 106.03 2r8y n ASN 25 Ca 0.01 -0.78 -0.43 0.00 1.68 0.00 0.00 54.58 55.06 2r8y n ASN 25 Cb 0.11 -0.06 -0.03 0.00 -1.54 0.00 0.00 39.78 38.27 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 -2.31 4.62 -0.09 2.41 -1.09 -1.11 -4.43 121.20 119.20 2r8y s ILE 26 Ca 0.34 1.64 0.18 0.00 -2.23 0.00 0.00 60.65 60.58 2r8y s ILE 26 Cb 0.21 -4.32 -0.27 0.00 -1.58 0.00 0.00 42.46 36.49 2r8y s ILE 26 CO 0.43 -0.36 0.43 0.54 -1.23 0.00 0.00 174.94 174.75 2r8y n ARG 27 N 6.58 0.60 -4.01 2.79 5.12 0.81 -4.87 116.66 123.68 2r8y n ARG 27 Ca 0.10 -0.15 -0.18 0.00 -1.93 0.00 0.00 57.85 55.68 2r8y n ARG 27 Cb 0.47 -1.42 -0.16 0.00 -1.16 0.00 0.00 32.46 30.19 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 -4.14 1.21 -0.30 0.55 2.96 -0.92 -0.49 118.68 117.54 2r8y s LEU 28 Ca -0.06 -0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 53.75 2r8y s LEU 28 Cb 0.12 -0.31 0.04 0.00 0.50 0.00 0.00 46.19 46.54 2r8y s LEU 28 CO 0.75 -0.09 0.04 -0.22 -1.32 0.00 0.00 176.35 175.51 2r8y s LEU 29 N 1.00 3.90 -0.17 -0.68 2.96 0.11 -0.55 118.68 125.25 2r8y s LEU 29 Ca -0.10 -1.07 -0.12 0.00 -0.22 0.00 0.00 54.13 52.63 2r8y s LEU 29 Cb -0.14 -1.78 -0.05 0.00 0.50 0.00 0.00 46.19 44.72 2r8y s LEU 29 CO -0.01 -0.25 0.22 -0.63 -1.32 0.00 0.00 176.35 174.36 2r8y s ILE 30 N 1.36 5.35 -0.06 6.68 1.01 0.35 -1.00 121.20 134.89 2r8y s ILE 30 Ca -0.02 0.39 0.06 0.00 0.00 0.00 0.00 60.65 61.08 2r8y s ILE 30 Cb -0.19 -3.56 -0.01 0.00 0.01 0.00 0.00 42.46 38.72 2r8y s ILE 30 CO 0.00 0.42 -0.25 -0.76 0.00 0.00 0.00 174.94 174.36 2r8y s LEU 31 N 0.34 2.08 0.76 2.97 1.43 0.42 -1.24 118.68 125.43 2r8y s LEU 31 Ca 0.13 -0.51 -0.11 0.00 -1.03 0.00 0.00 54.13 52.61 2r8y s LEU 31 Cb -0.12 -1.38 0.05 0.00 0.03 0.00 0.00 46.19 44.77 2r8y s LEU 31 CO 0.01 0.24 1.09 -0.62 0.23 0.00 0.00 176.35 177.30 2r8y s ASP 32 N -0.15 4.80 0.00 2.29 3.68 -0.90 -2.36 116.67 124.02 2r8y s ASP 32 Ca -0.04 1.37 0.00 0.00 2.13 0.00 0.00 52.55 56.01 2r8y s ASP 32 Cb -0.14 -2.15 0.00 0.00 -1.45 0.00 0.00 42.92 39.18 2r8y s ASP 32 CO 0.04 -1.78 0.00 0.52 0.13 0.00 0.00 175.17 174.08 2r8y n VAL 33 N -3.32 0.00 -2.29 1.11 0.31 -1.26 -3.63 118.33 109.25 2r8y n VAL 33 Ca 0.07 0.40 -0.43 0.00 -0.01 0.00 0.00 64.34 64.38 2r8y n VAL 33 Cb 0.56 -1.38 -0.02 0.00 -0.91 0.00 0.00 33.84 32.09 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 -3.31 6.61 0.00 4.52 1.01 -1.26 -0.31 116.67 123.93 2r8y s ASP 34 Ca 0.00 1.48 0.00 0.00 0.71 0.00 0.00 52.55 54.74 2r8y s ASP 34 Cb 0.00 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.39 2r8y s ASP 34 CO 0.00 -1.09 0.00 0.61 0.21 0.00 0.00 175.17 174.90 2r8y n GLY 35 N 4.32 0.77 0.85 0.21 0.00 -0.99 -4.73 105.19 105.63 2r8y n GLY 35 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 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 0.44 0.22 1.61 0.31 -0.75 -4.14 118.33 114.03 2r8y n VAL 36 Ca 0.00 0.18 0.11 0.00 -0.01 0.00 0.00 64.34 64.63 2r8y n VAL 36 Cb 0.00 -1.30 0.36 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 -0.06 0.00 -9.69 7.52 3.38 -0.73 -0.44 115.31 115.29 2r8y h LEU 37 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 2r8y h LEU 37 Cb 0.06 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.68 2r8y h LEU 37 CO 0.00 0.13 -0.54 -0.94 0.09 0.00 0.00 178.44 177.18 2r8y s SER 38 N -6.10 3.45 -0.06 -0.43 1.04 -0.97 -4.09 113.70 106.52 2r8y s SER 38 Ca 0.03 -1.59 0.06 0.00 0.48 0.00 0.00 55.95 54.94 2r8y s SER 38 Cb 0.08 0.31 0.29 0.00 0.10 0.00 0.00 66.02 66.79 2r8y s SER 38 CO 0.64 -0.79 1.03 -0.90 0.98 0.00 0.00 173.24 174.20 2r8y n ASP 39 N -1.16 2.40 0.00 7.02 3.85 -1.24 -2.30 116.55 125.12 2r8y n ASP 39 Ca -0.11 -2.25 0.00 0.00 -0.71 0.00 0.00 54.79 51.72 2r8y n ASP 39 Cb 0.66 -0.46 0.00 0.00 -1.35 0.00 0.00 41.12 39.97 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 0.43 1.03 3.79 6.12 0.00 -1.26 -4.68 105.19 110.61 2r8y n GLY 40 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 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 4.32 -0.22 0.99 1.43 -1.26 -4.74 118.68 119.20 2r8y s LEU 41 Ca 0.00 1.77 0.02 0.00 -1.03 0.00 0.00 54.13 54.89 2r8y s LEU 41 Cb 0.00 -3.99 0.05 0.00 0.03 0.00 0.00 46.19 42.28 2r8y s LEU 41 CO 0.00 -0.07 -0.12 -0.63 0.23 0.00 0.00 176.35 175.76 2r8y s ILE 42 N -1.63 1.87 -0.19 -0.59 -1.09 -1.26 -4.75 121.20 113.56 2r8y s ILE 42 Ca 0.50 -1.22 -0.21 0.00 -2.23 0.00 0.00 60.65 57.49 2r8y s ILE 42 Cb -0.18 -1.93 -0.03 0.00 -1.58 0.00 0.00 42.46 38.74 2r8y s ILE 42 CO 0.23 0.14 0.62 -0.31 -1.23 0.00 0.00 174.94 174.38 2r8y s TYR 43 N 1.28 3.38 -0.02 3.97 1.51 -0.97 -4.98 117.35 121.52 2r8y s TYR 43 Ca -0.03 0.91 0.06 0.00 -1.01 0.00 0.00 57.07 57.00 2r8y s TYR 43 Cb -0.17 -2.78 -0.01 0.00 -0.11 0.00 0.00 41.96 38.88 2r8y s TYR 43 CO -0.08 -0.16 -0.18 -1.64 -1.11 0.00 0.00 175.55 172.38 2r8y s MET 44 N 1.84 1.54 0.44 -0.62 -1.94 -1.26 -0.72 119.30 118.58 2r8y s MET 44 Ca 0.28 -0.66 0.06 0.00 -1.71 0.00 0.00 55.69 53.66 2r8y s MET 44 Cb -0.16 -1.47 -0.06 0.00 2.01 0.00 0.00 34.83 35.16 2r8y s MET 44 CO 0.10 0.38 0.03 0.20 -0.01 0.00 0.00 175.02 175.72 2r8y s GLY 45 N -0.37 2.62 0.28 -0.03 0.00 -0.38 -4.99 107.32 104.45 2r8y s GLY 45 Ca 0.06 -1.80 0.25 0.00 0.00 0.00 0.00 44.72 43.23 2r8y s GLY 45 CO -0.00 -2.11 1.75 3.43 0.00 0.00 0.00 173.10 176.17 2r8y h ASN 46 N 1.62 0.00 -0.41 1.64 2.35 -2.02 -2.21 115.58 116.56 2r8y h ASN 46 Ca -0.44 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.27 2r8y h ASN 46 Cb 1.26 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.60 2r8y h ASN 46 CO 0.78 0.00 0.03 0.59 -1.65 0.00 0.00 177.43 177.18 2r8y n ASN 47 N -2.33 4.35 0.00 5.81 5.03 -1.26 -4.93 115.26 121.92 2r8y n ASN 47 Ca 0.03 -3.09 0.00 0.00 0.87 0.00 0.00 54.58 52.39 2r8y n ASN 47 Cb 0.28 -0.61 0.00 0.00 -1.02 0.00 0.00 39.78 38.43 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 -0.25 0.46 3.68 7.41 0.00 -0.83 -5.02 105.19 110.65 2r8y n GLY 48 Ca 0.26 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.70 1.70 -4.05 1.61 4.71 -1.26 -4.81 120.64 115.84 2r8y n GLU 49 Ca 0.00 0.61 -0.17 0.00 -0.01 0.00 0.00 57.16 57.59 2r8y n GLU 49 Cb 0.04 -2.32 -0.16 0.00 -1.01 0.00 0.00 31.44 27.99 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 -2.30 0.45 0.20 3.49 2.12 -1.26 -1.25 118.70 120.16 2r8y s GLU 50 Ca 0.64 -0.05 0.09 0.00 0.36 0.00 0.00 54.97 56.01 2r8y s GLU 50 Cb -0.50 -0.52 -0.05 0.00 0.26 0.00 0.00 34.13 33.33 2r8y s GLU 50 CO 0.56 -0.04 -0.18 -0.51 -0.54 0.00 0.00 175.26 174.55 2r8y s LEU 51 N 0.60 2.51 -0.04 2.70 1.43 0.10 -4.99 118.68 120.98 2r8y s LEU 51 Ca -0.07 -0.95 -0.07 0.00 -1.03 0.00 0.00 54.13 52.01 2r8y s LEU 51 Cb -0.10 -0.85 0.01 0.00 0.03 0.00 0.00 46.19 45.28 2r8y s LEU 51 CO -0.01 -0.06 0.18 -0.75 0.23 0.00 0.00 176.35 175.95 2r8y s LYS 52 N -3.22 0.34 -0.19 1.70 2.20 -1.26 -2.29 119.74 117.01 2r8y s LYS 52 Ca 0.21 0.01 -0.07 0.00 -0.36 0.00 0.00 55.97 55.77 2r8y s LYS 52 Cb -0.04 0.15 -0.04 0.00 -1.51 0.00 0.00 37.83 36.39 2r8y s LYS 52 CO 0.09 -0.07 0.05 0.00 -0.36 0.00 0.00 175.35 175.06 2r8y s ALA 53 N -0.48 3.30 0.36 3.13 0.00 -1.26 -5.10 121.76 121.70 2r8y s ALA 53 Ca -0.06 -0.83 0.08 0.00 0.00 0.00 0.00 51.96 51.15 2r8y s ALA 53 Cb -0.04 -1.90 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 2r8y s ALA 53 CO 0.01 0.06 0.19 -0.06 0.00 0.00 0.00 175.76 175.96 2r8y s PHE 54 N 0.60 2.72 -0.14 0.00 0.40 -1.26 -4.28 117.98 116.02 2r8y s PHE 54 Ca 0.02 -0.41 -0.00 0.00 -0.60 0.00 0.00 56.93 55.94 2r8y s PHE 54 Cb -0.13 -1.76 -0.01 0.00 0.51 0.00 0.00 43.02 41.62 2r8y s PHE 54 CO 0.02 0.25 -0.13 1.21 0.70 0.00 0.00 175.22 177.26 2r8y s ASN 55 N -3.91 3.91 0.41 1.36 2.47 -1.26 -5.01 114.94 112.91 2r8y s ASN 55 Ca 0.40 -0.38 0.07 0.00 0.42 0.00 0.00 52.86 53.37 2r8y s ASN 55 Cb -0.02 -1.60 0.85 0.00 -1.45 0.00 0.00 41.25 39.03 2r8y s ASN 55 CO 0.24 0.13 2.05 -0.37 -3.72 0.00 0.00 177.10 175.43 2r8y h VAL 56 N 5.51 1.11 -0.63 -5.21 -1.51 -1.91 -2.34 116.25 111.27 2r8y h VAL 56 Ca -0.29 -0.23 -0.03 0.00 -1.23 0.00 0.00 66.70 64.93 2r8y h VAL 56 Cb 1.20 0.54 -0.03 0.00 -2.13 0.00 0.00 31.29 30.87 2r8y h VAL 56 CO 0.56 0.11 0.30 -0.09 -1.23 0.00 0.00 177.57 177.22 2r8y h ARG 57 N 0.54 0.92 -0.81 5.19 2.43 -1.94 -0.61 114.38 120.10 2r8y h ARG 57 Ca 0.15 -0.14 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 2r8y h ARG 57 Cb -0.04 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 29.30 2r8y h ARG 57 CO -0.03 0.74 0.52 -0.44 -1.51 0.00 0.00 179.97 179.25 2r8y h ASP 58 N 0.87 0.85 -0.45 -3.80 3.32 -1.79 -2.69 116.42 112.73 2r8y h ASP 58 Ca 0.22 -0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.35 2r8y h ASP 58 Cb 0.13 -0.19 -0.07 0.00 0.22 0.00 0.00 39.33 39.42 2r8y h ASP 58 CO -0.03 0.58 0.02 1.23 -1.72 0.00 0.00 179.24 179.32 2r8y h GLY 59 N 1.00 0.47 0.94 2.75 0.00 -0.66 0.36 103.07 107.94 2r8y h GLY 59 Ca 0.33 0.04 0.02 0.00 0.00 0.00 0.00 47.33 47.71 2r8y h GLY 59 CO -0.12 -0.11 0.40 -1.82 0.00 0.00 0.00 176.54 174.89 2r8y h TYR 60 N 0.13 0.74 -0.61 5.60 5.03 -0.95 -0.42 116.97 126.49 2r8y h TYR 60 Ca 0.22 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.51 2r8y h TYR 60 Cb 0.32 -0.25 -0.03 0.00 1.55 0.00 0.00 36.73 38.33 2r8y h TYR 60 CO -0.28 0.45 0.21 0.78 -1.32 0.00 0.00 178.16 178.00 2r8y h GLY 61 N 0.79 1.01 0.96 1.82 0.00 -1.10 -0.68 103.07 105.87 2r8y h GLY 61 Ca 0.24 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 2r8y h GLY 61 CO -0.07 0.54 0.20 -2.22 0.00 0.00 0.00 176.54 174.99 2r8y h ILE 62 N 0.86 1.17 -0.34 2.60 2.04 -0.51 -1.44 117.51 121.89 2r8y h ILE 62 Ca 0.20 -0.46 0.04 0.00 1.00 0.00 0.00 64.86 65.64 2r8y h ILE 62 Cb 0.26 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 2r8y h ILE 62 CO -0.01 0.18 0.11 0.03 0.00 0.00 0.00 178.15 178.45 2r8y h ARG 63 N 0.50 0.24 -0.14 2.37 2.47 -0.88 -1.40 114.38 117.53 2r8y h ARG 63 Ca 0.14 -0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.89 2r8y h ARG 63 Cb 0.10 -0.05 -0.05 0.00 -1.65 0.00 0.00 29.97 28.32 2r8y h ARG 63 CO -0.02 0.16 -0.15 0.00 0.56 0.00 0.00 179.97 180.52 2r8y h ALA 65 N 0.89 0.61 0.00 0.00 0.00 -1.11 -1.03 119.26 118.63 2r8y h ALA 65 Ca 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2r8y h ALA 65 Cb 0.32 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2r8y h ALA 65 CO -0.25 0.13 -0.06 -0.07 0.00 0.00 0.00 179.25 178.99 2r8y h LEU 66 N 0.63 0.00 -2.43 0.00 3.38 -1.07 0.37 115.31 116.19 2r8y h LEU 66 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2r8y h LEU 66 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2r8y h LEU 66 CO -0.03 0.06 0.00 0.35 0.09 0.00 0.00 178.44 178.92 2r8y n THR 67 N -3.80 0.66 -1.58 0.22 -2.24 -0.85 -4.22 114.28 102.48 2r8y n THR 67 Ca -0.02 -0.83 0.04 0.00 -2.27 0.00 0.00 64.05 60.97 2r8y n THR 67 Cb 0.16 0.79 0.21 0.00 -2.10 0.00 0.00 70.33 69.39 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 1.02 1.83 -3.62 3.42 7.64 -0.42 -4.97 113.62 118.52 2r8y n SER 68 Ca 0.15 -3.89 -0.24 0.00 1.01 0.00 0.00 58.87 55.90 2r8y n SER 68 Cb 0.49 -0.55 0.08 0.00 -1.01 0.00 0.00 64.21 63.22 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 -1.12 -6.26 -4.01 6.43 4.64 -1.14 -4.97 116.55 110.12 2r8y n ASP 69 Ca 0.21 -0.55 -0.31 0.00 -1.38 0.00 0.00 54.79 52.76 2r8y n ASP 69 Cb 0.75 -4.97 -0.16 0.00 -1.04 0.00 0.00 41.12 35.69 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 -3.32 1.67 0.49 5.18 1.01 -0.01 -4.84 121.20 121.38 2r8y s ILE 70 Ca 0.59 -0.94 -0.21 0.00 0.00 0.00 0.00 60.65 60.09 2r8y s ILE 70 Cb -0.26 -1.69 -0.08 0.00 0.01 0.00 0.00 42.46 40.44 2r8y s ILE 70 CO 0.74 0.25 1.09 -1.61 0.00 0.00 0.00 174.94 175.41 2r8y s GLU 71 N 1.40 3.70 -0.06 2.79 0.41 0.36 -3.23 118.70 124.07 2r8y s GLU 71 Ca 0.00 1.54 0.05 0.00 -0.41 0.00 0.00 54.97 56.15 2r8y s GLU 71 Cb -0.15 -2.19 -0.00 0.00 -1.78 0.00 0.00 34.13 30.01 2r8y s GLU 71 CO -0.09 -0.54 -0.20 0.08 -0.49 0.00 0.00 175.26 174.01 2r8y s VAL 72 N -1.79 1.70 0.08 2.63 1.01 -1.26 0.06 120.40 122.84 2r8y s VAL 72 Ca 0.67 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.84 2r8y s VAL 72 Cb -0.22 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 2r8y s VAL 72 CO 0.26 0.48 -0.11 0.00 0.00 0.00 0.00 175.10 175.73 2r8y s ALA 73 N 0.10 1.09 -0.09 5.51 0.00 -0.17 -4.22 121.76 123.98 2r8y s ALA 73 Ca -0.08 -1.07 0.03 0.00 0.00 0.00 0.00 51.96 50.84 2r8y s ALA 73 Cb -0.14 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 22.97 2r8y s ALA 73 CO 0.04 0.04 -0.18 0.42 0.00 0.00 0.00 175.76 176.08 2r8y s ILE 74 N -1.88 1.64 -0.13 0.00 1.01 -0.18 -0.44 121.20 121.23 2r8y s ILE 74 Ca 0.01 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 59.89 2r8y s ILE 74 Cb -0.06 -1.46 0.03 0.00 0.01 0.00 0.00 42.46 40.98 2r8y s ILE 74 CO 0.01 0.47 -0.06 -0.63 0.00 0.00 0.00 174.94 174.73 2r8y s ILE 75 N 0.59 0.99 0.03 2.92 1.01 -1.00 -0.51 121.20 125.23 2r8y s ILE 75 Ca -0.15 -0.39 0.02 0.00 0.00 0.00 0.00 60.65 60.13 2r8y s ILE 75 Cb -0.17 -1.09 -0.02 0.00 0.01 0.00 0.00 42.46 41.19 2r8y s ILE 75 CO 0.05 0.25 -0.06 0.28 0.00 0.00 0.00 174.94 175.46 2r8y s THR 76 N 1.71 0.40 0.14 2.92 -1.32 -0.68 -4.32 115.64 114.48 2r8y s THR 76 Ca 0.03 -0.90 0.15 0.00 -1.21 0.00 0.00 61.69 59.77 2r8y s THR 76 Cb -0.14 -0.47 0.05 0.00 -1.51 0.00 0.00 72.50 70.44 2r8y s THR 76 CO -0.08 -0.34 1.62 1.23 -2.21 0.00 0.00 174.62 174.84 2r8y h GLY 77 N 4.78 0.00 -1.86 6.08 0.00 -1.89 -1.51 103.07 108.67 2r8y h GLY 77 Ca -0.33 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 46.55 2r8y h GLY 77 CO 0.42 0.00 -0.05 0.50 0.00 0.00 0.00 176.54 177.41 2r8y s ARG 78 N -3.42 2.45 -0.05 4.80 0.52 -1.26 -3.60 118.95 118.39 2r8y s ARG 78 Ca 0.00 -0.94 -0.01 0.00 -0.52 0.00 0.00 55.73 54.27 2r8y s ARG 78 Cb 0.11 -2.51 0.03 0.00 0.52 0.00 0.00 34.95 33.09 2r8y s ARG 78 CO 0.73 -0.77 0.01 0.21 0.02 0.00 0.00 175.30 175.50 2r8y s LYS 79 N -4.75 0.38 -0.06 3.54 2.20 -1.26 -0.88 119.74 118.91 2r8y s LYS 79 Ca 0.59 0.13 -0.11 0.00 -0.36 0.00 0.00 55.97 56.22 2r8y s LYS 79 Cb -0.09 -0.68 0.02 0.00 -1.51 0.00 0.00 37.83 35.57 2r8y s LYS 79 CO 0.38 -0.22 0.26 0.00 -0.36 0.00 0.00 175.35 175.42 2r8y s ALA 80 N 1.54 -0.65 0.24 3.13 0.00 -1.26 -5.00 121.76 119.75 2r8y s ALA 80 Ca -0.02 0.51 -0.07 0.00 0.00 0.00 0.00 51.96 52.38 2r8y s ALA 80 Cb -0.13 -0.22 0.23 0.00 0.00 0.00 0.00 23.12 22.99 2r8y s ALA 80 CO -0.03 -0.18 1.91 -0.22 0.00 0.00 0.00 175.76 177.24 2r8y h LYS 81 N 4.99 1.23 -0.97 0.00 1.63 -2.00 -2.90 116.57 118.54 2r8y h LYS 81 Ca -0.28 -0.09 0.24 0.00 -0.85 0.00 0.00 60.65 59.68 2r8y h LYS 81 Cb 1.19 -0.27 -0.07 0.00 -0.60 0.00 0.00 32.23 32.47 2r8y h LYS 81 CO 0.36 0.83 0.65 1.37 -3.45 0.00 0.00 179.45 179.21 2r8y h LEU 82 N 1.27 0.33 -0.34 5.20 8.10 -1.96 0.36 115.31 128.27 2r8y h LEU 82 Ca 0.34 0.05 -0.12 0.00 0.11 0.00 0.00 57.88 58.25 2r8y h LEU 82 Cb -0.12 -0.01 -0.01 0.00 -0.44 0.00 0.00 40.66 40.08 2r8y h LEU 82 CO -0.07 0.10 -0.27 0.58 -4.11 0.00 0.00 178.44 174.67 2r8y h VAL 83 N 0.31 1.29 -0.55 0.15 2.07 -1.94 -1.19 116.25 116.39 2r8y h VAL 83 Ca 0.51 -1.43 0.05 0.00 0.82 0.00 0.00 66.70 66.65 2r8y h VAL 83 Cb 1.45 1.45 -0.05 0.00 -1.52 0.00 0.00 31.29 32.63 2r8y h VAL 83 CO -0.18 0.47 0.29 -0.33 0.02 0.00 0.00 177.57 177.83 2r8y h GLU 84 N 0.56 0.53 -0.75 1.57 5.08 -1.03 -0.77 114.58 119.77 2r8y h GLU 84 Ca 0.06 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2r8y h GLU 84 Cb 0.84 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.93 2r8y h GLU 84 CO 0.07 0.35 0.48 -0.44 -1.00 0.00 0.00 179.01 178.47 2r8y h ASP 85 N 0.55 0.79 -0.47 1.42 3.32 -1.18 -0.73 116.42 120.11 2r8y h ASP 85 Ca 0.25 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.21 2r8y h ASP 85 Cb 0.15 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 2r8y h ASP 85 CO -0.17 0.55 -0.01 -0.09 -1.72 0.00 0.00 179.24 177.79 2r8y h ARG 86 N 0.93 0.85 -0.65 3.56 9.65 -0.59 -0.53 114.38 127.61 2r8y h ARG 86 Ca 0.30 -0.28 -0.02 0.00 -1.10 0.00 0.00 59.98 58.89 2r8y h ARG 86 Cb 0.01 -0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.49 2r8y h ARG 86 CO -0.11 0.90 0.34 0.00 2.80 0.00 0.00 179.97 183.90 2r8y h ALA 88 N 1.47 -0.07 -0.97 0.00 0.00 -0.55 0.25 119.26 119.38 2r8y h ALA 88 Ca 0.23 -0.05 0.14 0.00 0.00 0.00 0.00 54.91 55.24 2r8y h ALA 88 Cb 0.05 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.78 2r8y h ALA 88 CO -0.03 -0.51 0.61 1.15 0.00 0.00 0.00 179.25 180.47 2r8y h THR 89 N -0.14 0.85 -0.00 0.00 2.02 -0.72 -2.83 112.91 112.09 2r8y h THR 89 Ca -0.01 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.88 2r8y h THR 89 Cb 0.12 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.45 2r8y h THR 89 CO 0.01 0.16 -0.73 0.18 0.37 0.00 0.00 175.52 175.51 2r8y n LEU 90 N -4.63 1.08 -0.10 2.58 4.77 -0.82 -4.97 117.00 114.92 2r8y n LEU 90 Ca 0.19 -0.42 -0.01 0.00 -0.03 0.00 0.00 56.01 55.75 2r8y n LEU 90 Cb 0.44 -0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.46 2r8y n LEU 90 CO 0.27 0.24 -0.01 0.61 -1.33 0.00 0.00 177.39 177.17 2r8y n GLY 91 N 1.47 0.37 3.71 -0.72 0.00 0.61 -4.74 105.19 105.89 2r8y n GLY 91 Ca 0.06 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.04 4.95 -0.20 -0.61 1.01 0.31 -4.95 121.20 119.67 2r8y s ILE 92 Ca 0.00 1.76 0.03 0.00 0.00 0.00 0.00 60.65 62.44 2r8y s ILE 92 Cb 0.00 -4.19 -0.01 0.00 0.01 0.00 0.00 42.46 38.27 2r8y s ILE 92 CO 0.00 0.19 0.26 0.35 0.00 0.00 0.00 174.94 175.73 2r8y n THR 93 N 3.92 0.00 -3.62 2.92 -2.24 -1.26 -4.46 114.28 109.54 2r8y n THR 93 Ca 0.03 -0.46 -0.40 0.00 -2.27 0.00 0.00 64.05 60.95 2r8y n THR 93 Cb 0.51 1.02 -0.10 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 -0.94 3.43 -0.06 4.78 3.76 -1.26 -5.06 115.29 119.93 2r8y s HIS 94 Ca 0.02 -1.88 -0.00 0.00 -0.15 0.00 0.00 55.06 53.04 2r8y s HIS 94 Cb 0.02 -3.26 0.02 0.00 1.11 0.00 0.00 32.58 30.47 2r8y s HIS 94 CO 0.09 -0.95 -0.03 -1.17 -0.85 0.00 0.00 174.74 171.83 2r8y s LEU 95 N 1.33 1.00 -0.15 0.89 2.96 -1.26 -1.01 118.68 122.44 2r8y s LEU 95 Ca 0.05 -0.13 -0.00 0.00 -0.22 0.00 0.00 54.13 53.83 2r8y s LEU 95 Cb -0.25 -0.50 0.03 0.00 0.50 0.00 0.00 46.19 45.98 2r8y s LEU 95 CO -0.01 -0.12 -0.09 -0.31 -1.32 0.00 0.00 176.35 174.50 2r8y s TYR 96 N 1.46 1.89 0.34 5.38 1.51 0.34 -4.99 117.35 123.27 2r8y s TYR 96 Ca -0.02 -1.11 0.09 0.00 -1.01 0.00 0.00 57.07 55.02 2r8y s TYR 96 Cb -0.13 -1.42 -0.06 0.00 -0.11 0.00 0.00 41.96 40.24 2r8y s TYR 96 CO -0.03 -0.62 -0.01 -0.65 -1.11 0.00 0.00 175.55 173.13 2r8y s GLN 97 N 1.57 2.03 -1.08 -0.62 -0.21 -1.26 -1.68 119.66 118.41 2r8y s GLN 97 Ca 0.03 -1.78 -0.05 0.00 0.02 0.00 0.00 55.36 53.58 2r8y s GLN 97 Cb -0.14 -1.89 0.01 0.00 1.00 0.00 0.00 33.01 31.98 2r8y s GLN 97 CO -0.09 0.14 0.93 0.41 -2.12 0.00 0.00 175.29 174.56 2r8y n GLY 98 N -0.92 -0.26 3.06 3.09 0.00 -0.06 -4.93 105.19 105.17 2r8y n GLY 98 Ca -0.04 0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 -5.81 2.35 -0.15 1.61 2.00 -0.61 -4.96 119.66 114.08 2r8y s GLN 99 Ca 0.35 -1.06 -0.10 0.00 -2.00 0.00 0.00 55.36 52.54 2r8y s GLN 99 Cb -0.15 -2.66 -0.24 0.00 0.80 0.00 0.00 33.01 30.76 2r8y s GLN 99 CO 0.60 -0.44 0.29 0.43 -0.50 0.00 0.00 175.29 175.67 2r8y n SER 100 N 4.56 2.05 -4.46 6.67 7.64 -1.26 -3.54 113.62 125.27 2r8y n SER 100 Ca -0.16 0.25 -0.44 0.00 1.01 0.00 0.00 58.87 59.54 2r8y n SER 100 Cb 0.45 -0.87 -0.03 0.00 -1.01 0.00 0.00 64.21 62.75 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 -6.99 6.62 0.33 6.43 2.47 -1.26 -4.85 114.94 117.69 2r8y s ASN 101 Ca -0.25 -2.00 0.26 0.00 0.42 0.00 0.00 52.86 51.29 2r8y s ASN 101 Cb 0.07 -2.41 1.04 0.00 -1.45 0.00 0.00 41.25 38.49 2r8y s ASN 101 CO 0.71 -1.10 1.79 0.11 -3.72 0.00 0.00 177.10 174.89 2r8y h LYS 102 N 8.90 0.00 -0.37 0.43 1.57 -1.88 -3.06 116.57 122.16 2r8y h LYS 102 Ca 0.16 0.00 0.11 0.00 -1.87 0.00 0.00 60.65 59.05 2r8y h LYS 102 Cb 1.02 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 2r8y h LYS 102 CO 1.14 0.00 0.27 -0.07 -0.57 0.00 0.00 179.45 180.21 2r8y h LEU 103 N 0.00 0.01 -0.02 2.94 3.38 -1.95 -1.44 115.31 118.23 2r8y h LEU 103 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2r8y h LEU 103 Cb 0.47 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2r8y h LEU 103 CO 0.00 0.00 -0.05 0.40 0.09 0.00 0.00 178.44 178.89 2r8y h ILE 104 N 0.01 1.44 -0.79 1.22 2.04 -1.97 -0.75 117.51 118.71 2r8y h ILE 104 Ca 0.18 -1.37 -0.04 0.00 1.00 0.00 0.00 64.86 64.63 2r8y h ILE 104 Cb 0.70 2.31 -0.04 0.00 -0.74 0.00 0.00 36.82 39.05 2r8y h ILE 104 CO -0.00 0.37 0.35 0.00 0.00 0.00 0.00 178.15 178.87 2r8y h ALA 105 N 0.45 1.13 0.01 1.87 0.00 -1.68 -0.89 119.26 120.15 2r8y h ALA 105 Ca 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.75 2r8y h ALA 105 Cb 0.62 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2r8y h ALA 105 CO 0.01 0.64 -0.06 0.35 0.00 0.00 0.00 179.25 180.19 2r8y h PHE 106 N 1.14 -0.15 -0.58 0.00 3.04 -1.27 -0.86 116.94 118.26 2r8y h PHE 106 Ca 0.27 0.00 0.09 0.00 3.98 0.00 0.00 57.97 62.32 2r8y h PHE 106 Cb 0.16 0.07 -0.07 0.00 2.56 0.00 0.00 35.95 38.66 2r8y h PHE 106 CO 0.02 -0.10 0.18 0.77 -2.02 0.00 0.00 178.31 177.16 2r8y h SER 107 N -0.11 0.15 -0.74 0.41 0.02 -0.81 -1.59 113.55 110.87 2r8y h SER 107 Ca 0.02 0.08 0.04 0.00 -0.84 0.00 0.00 61.79 61.09 2r8y h SER 107 Cb 0.14 0.08 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 2r8y h SER 107 CO -0.06 0.10 0.46 -0.78 -1.14 0.00 0.00 176.83 175.41 2r8y h ASP 108 N 0.35 0.75 -0.50 3.07 3.58 -0.86 -1.60 116.42 121.21 2r8y h ASP 108 Ca 0.29 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.69 2r8y h ASP 108 Cb 0.37 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.25 2r8y h ASP 108 CO -0.32 0.51 0.11 -0.07 -2.88 0.00 0.00 179.24 176.59 2r8y h LEU 109 N 0.89 0.76 -1.02 2.28 3.38 -0.54 0.20 115.31 121.25 2r8y h LEU 109 Ca 0.30 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 2r8y h LEU 109 Cb 0.05 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2r8y h LEU 109 CO -0.13 0.80 0.36 -0.07 0.09 0.00 0.00 178.44 179.50 2r8y h LEU 110 N 0.68 0.95 0.31 1.67 3.38 -1.08 -1.97 115.31 119.26 2r8y h LEU 110 Ca 0.15 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2r8y h LEU 110 Cb 0.35 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2r8y h LEU 110 CO 0.00 0.80 -0.15 -0.33 0.09 0.00 0.00 178.44 178.85 2r8y h GLU 111 N 1.05 -0.41 -0.67 1.13 4.39 -1.04 -2.07 114.58 116.96 2r8y h GLU 111 Ca 0.26 0.03 0.10 0.00 0.34 0.00 0.00 59.36 60.08 2r8y h GLU 111 Cb 0.10 0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.80 2r8y h GLU 111 CO -0.03 -0.07 0.45 0.87 -1.16 0.00 0.00 179.01 179.06 2r8y h LYS 112 N -0.88 0.50 -0.02 2.33 1.57 -0.59 -3.02 116.57 116.46 2r8y h LYS 112 Ca -0.04 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2r8y h LYS 112 Cb 0.52 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2r8y h LYS 112 CO 0.07 0.33 -0.04 1.28 -0.57 0.00 0.00 179.45 180.52 2r8y n LEU 113 N -4.48 2.00 -3.57 2.94 4.77 -0.74 -5.02 117.00 112.90 2r8y n LEU 113 Ca 0.11 -0.96 -0.23 0.00 -0.03 0.00 0.00 56.01 54.90 2r8y n LEU 113 Cb 0.37 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.48 2r8y n LEU 113 CO 0.33 0.37 -0.02 0.00 -1.33 0.00 0.00 177.39 176.75 2r8y n ALA 114 N 0.61 -2.60 -3.45 -1.18 0.00 -0.81 -4.99 120.51 108.09 2r8y n ALA 114 Ca 0.07 -0.19 -0.17 0.00 0.00 0.00 0.00 53.44 53.15 2r8y n ALA 114 Cb 0.32 -2.88 -0.16 0.00 0.00 0.00 0.00 19.45 16.74 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 -3.26 0.31 0.49 0.00 2.07 -1.02 -5.07 121.20 114.71 2r8y s ILE 115 Ca 0.27 -0.04 -0.21 0.00 -1.41 0.00 0.00 60.65 59.27 2r8y s ILE 115 Cb -0.10 -0.35 -0.08 0.00 0.13 0.00 0.00 42.46 42.07 2r8y s ILE 115 CO 0.84 0.15 1.07 0.00 -1.91 0.00 0.00 174.94 175.10 2r8y s ALA 116 N 0.68 2.86 0.54 1.50 0.00 -1.26 -4.69 121.76 121.40 2r8y s ALA 116 Ca -0.08 0.70 0.21 0.00 0.00 0.00 0.00 51.96 52.80 2r8y s ALA 116 Cb -0.11 -3.29 1.46 0.00 0.00 0.00 0.00 23.12 21.18 2r8y s ALA 116 CO -0.01 -0.45 2.18 -1.00 0.00 0.00 0.00 175.76 176.49 2r8y h PRO 117 N 1.61 0.00 0.00 0.00 0.13 -1.97 -2.05 132.00 129.73 2r8y h PRO 117 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2r8y h PRO 117 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2r8y h PRO 117 CO 0.59 0.01 0.00 1.05 -0.23 0.00 0.00 178.00 179.42 2r8y h GLU 118 N 0.00 0.00 -0.61 0.86 9.09 -1.88 -0.60 114.58 121.43 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 0.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.11 2r8y h GLU 118 CO 0.00 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.15 2r8y n ASN 119 N -2.35 3.67 -4.40 3.06 3.02 -0.77 -4.15 115.26 113.34 2r8y n ASN 119 Ca 0.01 -2.29 -0.32 0.00 -0.03 0.00 0.00 54.58 51.95 2r8y n ASN 119 Cb 0.20 -0.49 -0.14 0.00 -0.61 0.00 0.00 39.78 38.74 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 -1.69 2.78 0.09 2.41 1.01 -0.63 -0.14 120.40 124.23 2r8y s VAL 120 Ca 0.39 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.61 2r8y s VAL 120 Cb 0.25 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 2r8y s VAL 120 CO 0.20 0.57 -0.02 0.00 0.00 0.00 0.00 175.10 175.86 2r8y s ALA 121 N -0.43 3.24 -0.02 5.51 0.00 0.28 -0.87 121.76 129.47 2r8y s ALA 121 Ca 0.05 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.88 2r8y s ALA 121 Cb -0.12 -1.14 0.01 0.00 0.00 0.00 0.00 23.12 21.87 2r8y s ALA 121 CO 0.02 0.69 -0.02 -0.47 0.00 0.00 0.00 175.76 175.98 2r8y s TYR 122 N -1.30 0.37 -0.29 0.00 5.04 -0.54 -0.50 117.35 120.13 2r8y s TYR 122 Ca 0.25 -0.05 -0.03 0.00 -2.44 0.00 0.00 57.07 54.80 2r8y s TYR 122 Cb -0.12 -0.34 0.03 0.00 0.35 0.00 0.00 41.96 41.89 2r8y s TYR 122 CO 0.18 -0.07 0.01 0.08 -1.34 0.00 0.00 175.55 174.40 2r8y s VAL 123 N 0.45 3.25 0.46 3.14 1.01 -0.38 -0.11 120.40 128.22 2r8y s VAL 123 Ca -0.05 -1.11 0.03 0.00 0.00 0.00 0.00 61.98 60.85 2r8y s VAL 123 Cb -0.08 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 2r8y s VAL 123 CO -0.01 0.01 0.02 -0.83 0.00 0.00 0.00 175.10 174.29 2r8y s GLY 124 N 1.34 2.79 0.00 4.51 0.00 -0.08 -2.13 107.32 113.76 2r8y s GLY 124 Ca -0.02 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.62 2r8y s GLY 124 CO -0.01 -2.12 0.00 2.09 0.00 0.00 0.00 173.10 173.06 2r8y n ASP 125 N -1.16 0.00 -4.00 1.64 3.85 -1.26 -2.41 116.55 113.21 2r8y n ASP 125 Ca -0.13 -0.66 -0.11 0.00 -0.71 0.00 0.00 54.79 53.18 2r8y n ASP 125 Cb 0.67 0.00 -0.07 0.00 -1.35 0.00 0.00 41.12 40.36 2r8y n ASP 125 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2r8y s ASP 126 N 0.00 0.17 0.47 -1.12 -1.08 -1.26 -0.45 116.67 113.40 2r8y s ASP 126 Ca 0.00 -1.22 0.17 0.00 -0.52 0.00 0.00 52.55 50.99 2r8y s ASP 126 Cb 0.00 0.50 1.13 0.00 -1.46 0.00 0.00 42.92 43.09 2r8y s ASP 126 CO 0.00 -1.02 2.02 -0.07 0.52 0.00 0.00 175.17 176.63 2r8y h LEU 127 N 2.40 0.00 -2.70 -1.34 3.38 -1.98 -0.04 115.31 115.02 2r8y h LEU 127 Ca -0.31 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 2r8y h LEU 127 Cb 1.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 2r8y h LEU 127 CO 0.44 0.16 -0.00 -0.29 0.09 0.00 0.00 178.44 178.83 2r8y h ILE 128 N 0.00 0.29 0.00 1.22 6.09 -1.97 -2.12 117.51 121.02 2r8y h ILE 128 Ca -0.00 -0.01 0.00 0.00 -1.37 0.00 0.00 64.86 63.48 2r8y h ILE 128 Cb 0.30 1.00 0.00 0.00 0.47 0.00 0.00 36.82 38.59 2r8y h ILE 128 CO 0.02 0.00 -0.09 0.44 -3.07 0.00 0.00 178.15 175.45 2r8y h ASP 129 N 0.00 0.00 -0.71 2.19 3.32 -1.40 -3.39 116.42 116.43 2r8y h ASP 129 Ca -0.00 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 2r8y h ASP 129 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2r8y h ASP 129 CO 0.00 0.00 0.27 -0.25 -1.72 0.00 0.00 179.24 177.55 2r8y h TRP 130 N 0.00 1.09 -0.68 4.55 2.91 -1.49 -2.52 115.95 119.81 2r8y h TRP 130 Ca 0.00 -0.09 0.14 0.00 1.13 0.00 0.00 58.89 60.08 2r8y h TRP 130 Cb 0.93 -0.33 -0.10 0.00 -0.51 0.00 0.00 29.16 29.15 2r8y h TRP 130 CO 0.00 0.85 0.13 -1.35 -1.03 0.00 0.00 178.44 177.04 2r8y h PRO 131 N 1.02 0.23 -0.07 2.65 0.11 -1.78 0.18 132.00 134.35 2r8y h PRO 131 Ca 0.24 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.30 2r8y h PRO 131 Cb 0.23 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.29 2r8y h PRO 131 CO -0.02 0.15 -0.07 0.28 -0.21 0.00 0.00 178.00 178.14 2r8y h VAL 132 N 0.23 1.37 -0.92 3.15 2.07 -1.84 -3.25 116.25 117.05 2r8y h VAL 132 Ca 0.38 -1.21 0.19 0.00 0.82 0.00 0.00 66.70 66.87 2r8y h VAL 132 Cb 0.62 2.03 -0.08 0.00 -1.52 0.00 0.00 31.29 32.34 2r8y h VAL 132 CO -0.49 0.34 0.60 0.24 0.02 0.00 0.00 177.57 178.27 2r8y h MET 133 N -0.27 0.51 -0.16 1.57 2.86 -0.91 0.18 114.93 118.71 2r8y h MET 133 Ca 0.01 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2r8y h MET 133 Cb 0.57 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 2r8y h MET 133 CO 0.02 0.34 0.11 1.49 1.06 0.00 0.00 176.91 179.92 2r8y h GLU 134 N 0.53 0.21 0.00 1.72 4.81 -0.69 -3.17 114.58 117.98 2r8y h GLU 134 Ca 0.49 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 59.50 2r8y h GLU 134 Cb 1.04 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.34 2r8y h GLU 134 CO -0.22 0.14 -1.48 0.87 -0.73 0.00 0.00 179.01 177.59 2r8y h LYS 135 N 0.21 0.00 -7.52 1.92 1.57 -1.06 -3.49 116.57 108.21 2r8y h LYS 135 Ca 0.06 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 58.36 2r8y h LYS 135 Cb -0.02 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.38 2r8y h LYS 135 CO -0.01 0.38 0.40 0.14 -0.57 0.00 0.00 179.45 179.78 2r8y s VAL 136 N -2.81 2.78 0.10 0.50 -7.23 -1.11 -4.60 120.40 108.04 2r8y s VAL 136 Ca -0.03 0.22 -0.15 0.00 -1.81 0.00 0.00 61.98 60.21 2r8y s VAL 136 Cb 0.08 -3.25 -0.09 0.00 0.56 0.00 0.00 36.38 33.68 2r8y s VAL 136 CO 0.81 -0.32 1.40 1.23 -0.31 0.00 0.00 175.10 177.92 2r8y h GLY 137 N -0.81 0.76 -7.27 2.32 0.00 0.50 -3.42 103.07 95.14 2r8y h GLY 137 Ca -0.45 -0.80 -0.57 0.00 0.00 0.00 0.00 47.33 45.50 2r8y h GLY 137 CO 0.65 0.72 -0.76 -2.27 0.00 0.00 0.00 176.54 174.88 2r8y s LEU 138 N -8.93 2.06 -0.09 3.11 2.96 -0.81 -4.92 118.68 112.08 2r8y s LEU 138 Ca -0.12 -1.36 -0.18 0.00 -0.22 0.00 0.00 54.13 52.25 2r8y s LEU 138 Cb 0.08 -0.86 -0.05 0.00 0.50 0.00 0.00 46.19 45.87 2r8y s LEU 138 CO 0.83 -0.36 0.48 -0.94 -1.32 0.00 0.00 176.35 175.04 2r8y s SER 139 N 1.63 6.73 -0.08 3.68 1.04 -1.26 -1.47 113.70 123.97 2r8y s SER 139 Ca 0.05 0.87 0.04 0.00 0.48 0.00 0.00 55.95 57.38 2r8y s SER 139 Cb -0.17 -2.29 0.00 0.00 0.10 0.00 0.00 66.02 63.66 2r8y s SER 139 CO -0.17 0.07 -0.19 -0.69 0.98 0.00 0.00 173.24 173.23 2r8y s VAL 140 N 0.26 1.67 -0.12 5.02 1.01 0.84 -1.14 120.40 127.93 2r8y s VAL 140 Ca 0.26 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 2r8y s VAL 140 Cb -0.16 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 2r8y s VAL 140 CO 0.11 0.47 -0.06 0.00 0.00 0.00 0.00 175.10 175.62 2r8y s ALA 141 N 0.37 2.93 0.82 5.51 0.00 -0.58 -0.90 121.76 129.91 2r8y s ALA 141 Ca -0.14 -0.85 -0.11 0.00 0.00 0.00 0.00 51.96 50.86 2r8y s ALA 141 Cb -0.16 -1.39 0.08 0.00 0.00 0.00 0.00 23.12 21.65 2r8y s ALA 141 CO 0.06 0.34 1.10 0.14 0.00 0.00 0.00 175.76 177.40 2r8y s VAL 142 N -0.03 3.05 0.29 0.00 -7.23 -1.01 -1.60 120.40 113.87 2r8y s VAL 142 Ca -0.00 0.34 0.01 0.00 -1.81 0.00 0.00 61.98 60.52 2r8y s VAL 142 Cb -0.13 -2.77 0.33 0.00 0.56 0.00 0.00 36.38 34.36 2r8y s VAL 142 CO 0.03 -0.44 1.63 0.00 -0.31 0.00 0.00 175.10 176.00 2r8y h ALA 143 N -1.31 1.19 -0.61 1.32 0.00 -1.55 -1.59 119.26 116.71 2r8y h ALA 143 Ca -0.45 0.26 -0.38 0.00 0.00 0.00 0.00 54.91 54.34 2r8y h ALA 143 Cb 1.25 0.40 -0.23 0.00 0.00 0.00 0.00 17.79 19.21 2r8y h ALA 143 CO 0.51 -0.50 -0.01 -0.40 0.00 0.00 0.00 179.25 178.85 2r8y n ASP 144 N -5.31 3.97 -4.63 0.00 5.75 -1.26 -4.99 116.55 110.08 2r8y n ASP 144 Ca 0.21 -3.77 -0.29 0.00 -0.01 0.00 0.00 54.79 50.92 2r8y n ASP 144 Cb 0.68 -0.65 0.18 0.00 -1.03 0.00 0.00 41.12 40.30 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 -3.43 0.81 0.25 2.12 0.00 -0.60 -4.92 121.76 116.00 2r8y s ALA 145 Ca 0.51 -0.02 -0.31 0.00 0.00 0.00 0.00 51.96 52.13 2r8y s ALA 145 Cb 0.43 -3.24 -0.13 0.00 0.00 0.00 0.00 23.12 20.18 2r8y s ALA 145 CO 0.01 -2.95 1.39 1.58 0.00 0.00 0.00 175.76 175.79 2r8y n HIS 146 N -4.31 2.16 -0.16 0.00 -0.00 0.41 -4.82 115.22 108.50 2r8y n HIS 146 Ca 0.06 0.45 0.25 0.00 0.46 0.00 0.00 57.72 58.94 2r8y n HIS 146 Cb 0.55 -2.45 0.67 0.00 -0.12 0.00 0.00 29.99 28.64 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 3.99 0.09 0.00 1.57 0.11 -1.91 -0.97 132.00 134.88 2r8y h PRO 147 Ca -0.45 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 2r8y h PRO 147 Cb 1.28 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2r8y h PRO 147 CO 0.74 0.06 -0.23 -0.07 -0.21 0.00 0.00 178.00 178.29 2r8y h LEU 148 N 0.09 0.00 0.20 2.35 3.38 -1.98 -3.28 115.31 116.06 2r8y h LEU 148 Ca 0.41 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 58.07 2r8y h LEU 148 Cb 1.48 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.25 2r8y h LEU 148 CO -0.04 0.23 -1.42 0.25 0.09 0.00 0.00 178.44 177.55 2r8y h LEU 149 N 0.00 0.67 -0.88 1.67 5.85 -1.53 -3.40 115.31 117.68 2r8y h LEU 149 Ca -0.00 -0.92 0.18 0.00 0.84 0.00 0.00 57.88 57.97 2r8y h LEU 149 Cb 0.92 -0.22 -0.17 0.00 0.37 0.00 0.00 40.66 41.57 2r8y h LEU 149 CO 0.03 1.66 -0.22 0.40 -0.34 0.00 0.00 178.44 179.97 2r8y h ILE 150 N -0.02 0.11 0.00 4.05 2.04 -1.58 -0.00 117.51 122.11 2r8y h ILE 150 Ca -0.27 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.59 2r8y h ILE 150 Cb 2.01 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.20 2r8y h ILE 150 CO 0.20 0.00 0.00 -2.65 0.00 0.00 0.00 178.15 175.70 2r8y n PRO 151 N -5.57 0.05 0.06 2.37 -0.02 -1.26 -3.14 135.00 127.49 2r8y n PRO 151 Ca 0.13 0.20 -0.09 0.00 -2.02 0.00 0.00 63.50 61.73 2r8y n PRO 151 Cb 0.44 -1.57 -0.12 0.00 -0.02 0.00 0.00 33.50 32.23 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 0.05 -7.09 -0.52 3.08 -1.23 -3.48 114.38 105.20 2r8y h ARG 152 Ca 0.00 -0.09 -0.49 0.00 0.07 0.00 0.00 59.98 59.47 2r8y h ARG 152 Cb 0.37 0.03 0.06 0.00 0.08 0.00 0.00 29.97 30.51 2r8y h ARG 152 CO 0.00 1.01 0.41 0.00 -1.07 0.00 0.00 179.97 180.33 2r8y s ALA 153 N -2.69 2.75 0.21 0.04 0.00 -1.19 -4.97 121.76 115.91 2r8y s ALA 153 Ca -0.00 0.73 -0.07 0.00 0.00 0.00 0.00 51.96 52.62 2r8y s ALA 153 Cb 0.09 -3.32 0.17 0.00 0.00 0.00 0.00 23.12 20.06 2r8y s ALA 153 CO 0.83 -0.64 1.73 -0.44 0.00 0.00 0.00 175.76 177.24 2r8y h ASP 154 N 1.25 1.02 -3.50 0.00 3.45 -1.48 -3.44 116.42 113.72 2r8y h ASP 154 Ca -0.50 -0.22 -0.34 0.00 0.43 0.00 0.00 57.03 56.40 2r8y h ASP 154 Cb 1.25 -0.27 -0.34 0.00 -0.56 0.00 0.00 39.33 39.41 2r8y h ASP 154 CO 0.57 0.99 -0.75 -0.47 -1.57 0.00 0.00 179.24 178.02 2r8y s TYR 155 N -5.24 0.30 -0.21 4.55 5.04 -0.89 -4.93 117.35 115.97 2r8y s TYR 155 Ca -0.11 0.00 -0.08 0.00 -2.44 0.00 0.00 57.07 54.44 2r8y s TYR 155 Cb 0.15 -0.40 -0.04 0.00 0.35 0.00 0.00 41.96 42.02 2r8y s TYR 155 CO 0.84 -0.12 0.08 0.08 -1.34 0.00 0.00 175.55 175.09 2r8y s VAL 156 N 0.99 4.82 0.66 3.14 1.01 -1.26 -1.52 120.40 128.24 2r8y s VAL 156 Ca -0.10 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.72 2r8y s VAL 156 Cb -0.13 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.04 2r8y s VAL 156 CO -0.02 0.41 1.09 0.42 0.00 0.00 0.00 175.10 177.00 2r8y s THR 157 N 0.76 3.47 0.07 3.92 -4.23 -0.63 -4.91 115.64 114.10 2r8y s THR 157 Ca 0.04 0.63 -0.06 0.00 -1.18 0.00 0.00 61.69 61.13 2r8y s THR 157 Cb -0.13 -3.17 -0.29 0.00 1.34 0.00 0.00 72.50 70.26 2r8y s THR 157 CO 0.02 -0.47 1.14 0.03 -0.54 0.00 0.00 174.62 174.79 2r8y h ARG 158 N -0.13 0.32 -6.06 3.99 -0.00 -1.92 -3.14 114.38 107.44 2r8y h ARG 158 Ca -0.46 -0.52 -0.60 0.00 -0.50 0.00 0.00 59.98 57.90 2r8y h ARG 158 Cb 1.23 0.19 -0.05 0.00 0.00 0.00 0.00 29.97 31.35 2r8y h ARG 158 CO 0.55 1.24 -0.20 0.42 0.00 0.00 0.00 179.97 181.97 2r8y s ILE 159 N -2.70 5.03 0.67 2.04 -1.09 -1.26 -4.75 121.20 119.15 2r8y s ILE 159 Ca -0.05 0.74 -0.13 0.00 -2.23 0.00 0.00 60.65 58.98 2r8y s ILE 159 Cb 0.07 -3.70 0.00 0.00 -1.58 0.00 0.00 42.46 37.25 2r8y s ILE 159 CO 0.89 0.48 1.07 0.00 -1.23 0.00 0.00 174.94 176.15 2r8y s ALA 160 N -1.19 2.60 0.21 9.38 0.00 -1.26 -3.37 121.76 128.12 2r8y s ALA 160 Ca 0.27 0.26 -0.32 0.00 0.00 0.00 0.00 51.96 52.17 2r8y s ALA 160 Cb -0.16 -3.23 -0.14 0.00 0.00 0.00 0.00 23.12 19.60 2r8y s ALA 160 CO 0.15 -1.20 1.44 0.41 0.00 0.00 0.00 175.76 176.57 2r8y n GLY 161 N -1.38 0.83 2.76 0.00 0.00 -1.26 -1.45 105.19 104.69 2r8y n GLY 161 Ca 0.08 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.66 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 2.53 0.66 0.03 -0.02 0.00 -0.18 -3.72 105.19 104.50 2r8y n GLY 162 Ca 0.14 0.00 0.00 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 -2.14 -0.62 0.00 1.61 5.12 -0.53 -4.60 116.66 115.51 2r8y n ARG 163 Ca 0.00 -0.62 0.00 0.00 -1.93 0.00 0.00 57.85 55.30 2r8y n ARG 163 Cb 0.03 -1.02 0.00 0.00 -1.16 0.00 0.00 32.46 30.32 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 0.01 0.80 0.27 -0.13 0.00 -1.23 -4.84 105.19 100.08 2r8y n GLY 164 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 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 0.90 -0.33 4.61 0.00 -1.69 -0.48 119.26 122.27 2r8y h ALA 165 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2r8y h ALA 165 Cb 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2r8y h ALA 165 CO 0.00 0.20 0.08 0.28 0.00 0.00 0.00 179.25 179.81 2r8y h VAL 166 N 0.85 1.22 -0.68 0.00 2.07 -1.89 -1.81 116.25 116.01 2r8y h VAL 166 Ca 0.28 -0.76 0.12 0.00 0.82 0.00 0.00 66.70 67.16 2r8y h VAL 166 Cb 0.02 1.08 -0.08 0.00 -1.52 0.00 0.00 31.29 30.79 2r8y h VAL 166 CO -0.11 0.26 0.26 -0.09 0.02 0.00 0.00 177.57 177.91 2r8y h ARG 167 N 0.38 0.41 -0.68 1.57 9.65 -1.75 -0.81 114.38 123.15 2r8y h ARG 167 Ca 0.10 -0.02 0.03 0.00 -1.10 0.00 0.00 59.98 58.99 2r8y h ARG 167 Cb 0.31 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 28.75 2r8y h ARG 167 CO 0.00 0.27 0.43 1.49 2.80 0.00 0.00 179.97 184.96 2r8y h GLU 168 N 0.42 0.82 -0.36 0.20 4.81 -0.68 0.97 114.58 120.77 2r8y h GLU 168 Ca 0.36 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.50 2r8y h GLU 168 Cb 0.50 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2r8y h GLU 168 CO -0.36 0.54 0.07 0.28 -0.73 0.00 0.00 179.01 178.81 2r8y h VAL 169 N 0.84 1.23 -0.37 0.32 2.07 -0.63 -0.95 116.25 118.77 2r8y h VAL 169 Ca 0.27 -0.80 0.03 0.00 0.82 0.00 0.00 66.70 67.02 2r8y h VAL 169 Cb 0.01 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 2r8y h VAL 169 CO -0.10 0.27 0.19 0.00 0.02 0.00 0.00 177.57 177.95 2r8y h ASP 171 N 0.39 1.00 -0.19 0.00 3.45 -0.67 -1.16 116.42 119.24 2r8y h ASP 171 Ca 0.16 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.62 2r8y h ASP 171 Cb 0.06 -0.21 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 2r8y h ASP 171 CO -0.11 0.65 0.09 0.25 -1.57 0.00 0.00 179.24 178.55 2r8y h LEU 172 N 1.15 0.24 -0.49 1.55 5.85 -0.46 -1.11 115.31 122.04 2r8y h LEU 172 Ca 0.41 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.99 2r8y h LEU 172 Cb 0.13 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 2r8y h LEU 172 CO -0.16 0.29 0.21 -0.07 -0.34 0.00 0.00 178.44 178.37 2r8y h LEU 173 N 0.17 0.66 -0.17 2.25 3.38 -0.67 -0.45 115.31 120.48 2r8y h LEU 173 Ca 0.06 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2r8y h LEU 173 Cb 0.11 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2r8y h LEU 173 CO -0.01 0.64 0.03 -0.07 0.09 0.00 0.00 178.44 179.11 2r8y h LEU 174 N 0.65 0.28 -0.20 1.67 3.38 -1.21 -1.34 115.31 118.53 2r8y h LEU 174 Ca 0.16 -0.26 0.05 0.00 0.09 0.00 0.00 57.88 57.93 2r8y h LEU 174 Cb 0.17 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 2r8y h LEU 174 CO -0.02 0.47 -0.18 0.25 0.09 0.00 0.00 178.44 179.06 2r8y h LEU 175 N 0.08 -0.57 -1.16 1.67 5.85 -1.09 0.36 115.31 120.44 2r8y h LEU 175 Ca 0.05 0.11 0.12 0.00 0.84 0.00 0.00 57.88 59.00 2r8y h LEU 175 Cb 0.31 0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.55 2r8y h LEU 175 CO 0.00 -0.22 0.59 0.00 -0.34 0.00 0.00 178.44 178.48 2r8y h ALA 176 N 0.91 1.65 -0.53 1.25 0.00 -0.92 -1.50 119.26 120.12 2r8y h ALA 176 Ca 0.12 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2r8y h ALA 176 Cb 0.37 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2r8y h ALA 176 CO -0.32 0.13 0.00 1.04 0.00 0.00 0.00 179.25 180.10 2r8y n GLN 177 N -4.56 2.26 -2.00 0.00 6.02 -0.52 -4.64 117.38 113.94 2r8y n GLN 177 Ca 0.17 -1.96 -0.16 0.00 -0.01 0.00 0.00 57.00 55.04 2r8y n GLN 177 Cb 0.36 -1.43 -0.03 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 1.37 0.41 0.68 1.08 0.00 -0.38 -4.90 105.19 103.46 2r8y n GLY 178 Ca 0.18 -0.22 0.07 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.55 1.77 -0.04 1.61 5.02 0.11 -4.74 118.16 119.34 2r8y n LYS 179 Ca -0.18 -1.72 -0.14 0.00 -2.02 0.00 0.00 58.31 54.25 2r8y n LYS 179 Cb 0.60 -1.31 -0.08 0.00 -0.02 0.00 0.00 35.03 34.23 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 2.74 0.38 -0.63 -0.35 5.85 -1.84 -1.72 115.31 119.74 2r8y h LEU 180 Ca 0.00 -0.58 -0.01 0.00 0.84 0.00 0.00 57.88 58.13 2r8y h LEU 180 Cb 0.68 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 2r8y h LEU 180 CO 0.00 0.88 0.35 0.44 -0.34 0.00 0.00 178.44 179.77 2r8y h ASP 181 N -0.11 0.78 0.84 1.25 5.19 -1.91 -3.05 116.42 119.40 2r8y h ASP 181 Ca -0.00 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 2r8y h ASP 181 Cb 0.83 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 40.14 2r8y h ASP 181 CO 0.05 0.64 -0.35 -0.62 -3.12 0.00 0.00 179.24 175.84 2r8y n GLU 182 N -4.56 0.11 -1.68 3.56 -0.58 -1.23 -4.95 120.64 111.31 2r8y n GLU 182 Ca 0.05 0.05 -0.44 0.00 -0.42 0.00 0.00 57.16 56.40 2r8y n GLU 182 Cb 0.08 -1.59 -0.02 0.00 -0.57 0.00 0.00 31.44 29.34 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 -1.62 1.21 -2.92 0.62 0.00 -0.65 -5.02 120.51 112.13 2r8y n ALA 183 Ca 0.05 0.39 -0.24 0.00 0.00 0.00 0.00 53.44 53.64 2r8y n ALA 183 Cb 0.38 -2.27 -0.16 0.00 0.00 0.00 0.00 19.45 17.40 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 -0.97 1.52 0.21 0.00 -0.14 -1.26 -5.05 119.74 114.05 2r8y s LYS 184 Ca 0.63 -0.52 -0.04 0.00 -1.36 0.00 0.00 55.97 54.68 2r8y s LYS 184 Cb -0.61 -1.35 0.02 0.00 -1.68 0.00 0.00 37.83 34.20 2r8y s LYS 184 CO 0.54 0.21 0.36 0.41 -0.76 0.00 0.00 175.35 176.11 2r8y n GLY 185 N 3.17 2.04 3.19 -3.33 0.00 -1.26 -3.71 105.19 105.28 2r8y n GLY 185 Ca -0.18 -1.35 -0.28 0.00 0.00 0.00 0.00 46.02 44.21 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 -2.28 1.95 -1.38 1.61 1.11 -1.26 -4.98 119.66 114.43 2r8y s GLN 186 Ca 0.13 -0.72 -0.14 0.00 0.01 0.00 0.00 55.36 54.65 2r8y s GLN 186 Cb -0.02 -1.72 0.08 0.00 -1.01 0.00 0.00 33.01 30.34 2r8y s GLN 186 CO 0.10 0.33 2.02 0.45 0.01 0.00 0.00 175.29 178.20 2r8y n SER 187 N 2.94 4.39 0.00 5.90 2.88 -1.26 -2.75 113.62 125.71 2r8y n SER 187 Ca -0.17 -2.92 0.00 0.00 -1.33 0.00 0.00 58.87 54.45 2r8y n SER 187 Cb 0.53 -1.63 0.00 0.00 -0.75 0.00 0.00 64.21 62.35 2r8y n SER 187 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11