#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 3.59 0.41 1.96 0.00 -1.26 -0.24 121.76 126.23 2r8y s ALA 9 Ca 0.00 -0.31 0.06 0.00 0.00 0.00 0.00 51.96 51.71 2r8y s ALA 9 Cb 0.00 -3.07 -0.07 0.00 0.00 0.00 0.00 23.12 19.98 2r8y s ALA 9 CO 0.00 -0.75 0.01 0.95 0.00 0.00 0.00 175.76 175.98 2r8y s THR 10 N 2.37 1.82 -1.61 0.00 -4.23 -1.13 -4.98 115.64 107.87 2r8y s THR 10 Ca 0.29 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.05 2r8y s THR 10 Cb -0.16 -2.88 0.53 0.00 1.34 0.00 0.00 72.50 71.33 2r8y s THR 10 CO 0.09 0.00 1.86 0.00 -0.54 0.00 0.00 174.62 176.03 2r8y n TYR 12 N -1.20 0.12 0.00 0.00 4.02 -1.26 -5.09 117.16 113.75 2r8y n TYR 12 Ca 0.14 -0.10 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 2r8y n TYR 12 Cb 0.16 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.48 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 0.77 2.75 3.76 2.72 0.00 -1.03 -4.92 105.19 109.24 2r8y n GLY 13 Ca 0.09 -2.09 -0.37 0.00 0.00 0.00 0.00 46.02 43.65 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 -2.22 3.36 0.23 1.61 0.02 -1.26 -2.84 135.00 133.90 2r8y s PRO 14 Ca 0.00 1.98 0.08 0.00 0.02 0.00 0.00 61.00 63.07 2r8y s PRO 14 Cb 0.00 -2.26 -0.05 0.00 0.02 0.00 0.00 34.50 32.21 2r8y s PRO 14 CO 0.00 -0.94 -0.12 0.14 -0.33 0.00 0.00 177.00 175.75 2r8y s VAL 15 N -1.45 1.76 0.72 3.83 -7.23 0.67 -4.92 120.40 113.78 2r8y s VAL 15 Ca 0.69 -2.20 -0.12 0.00 -1.81 0.00 0.00 61.98 58.54 2r8y s VAL 15 Cb -0.34 -2.17 0.02 0.00 0.56 0.00 0.00 36.38 34.46 2r8y s VAL 15 CO 0.40 -0.50 1.08 -0.94 -0.31 0.00 0.00 175.10 174.82 2r8y s SER 16 N -3.36 4.99 0.32 4.85 1.04 -1.26 -4.62 113.70 115.66 2r8y s SER 16 Ca 0.25 1.78 0.05 0.00 0.48 0.00 0.00 55.95 58.50 2r8y s SER 16 Cb 0.00 -2.52 0.55 0.00 0.10 0.00 0.00 66.02 64.15 2r8y s SER 16 CO 0.09 -1.71 1.81 0.00 0.98 0.00 0.00 173.24 174.41 2r8y h ALA 17 N -0.69 1.27 -0.13 5.32 0.00 -1.99 -1.96 119.26 121.08 2r8y h ALA 17 Ca -0.44 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.18 2r8y h ALA 17 Cb 1.22 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2r8y h ALA 17 CO 0.54 0.48 0.03 0.22 0.00 0.00 0.00 179.25 180.52 2r8y h ASP 18 N 0.39 0.19 -0.28 0.00 3.58 -1.99 -0.34 116.42 117.97 2r8y h ASP 18 Ca 0.07 -0.23 0.04 0.00 0.42 0.00 0.00 57.03 57.32 2r8y h ASP 18 Cb 0.52 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.48 2r8y h ASP 18 CO 0.03 0.37 0.08 0.58 -2.88 0.00 0.00 179.24 177.42 2r8y h VAL 19 N 0.00 0.89 -0.75 2.25 2.07 -1.90 -0.27 116.25 118.55 2r8y h VAL 19 Ca 0.04 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 67.50 2r8y h VAL 19 Cb 0.26 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 2r8y h VAL 19 CO 0.00 0.03 0.50 -0.03 0.02 0.00 0.00 177.57 178.09 2r8y h MET 20 N 0.19 0.98 -0.46 1.57 1.85 -1.29 -0.93 114.93 116.84 2r8y h MET 20 Ca 0.13 -0.06 -0.07 0.00 -0.61 0.00 0.00 59.70 59.09 2r8y h MET 20 Cb 0.12 -0.22 -0.02 0.00 0.43 0.00 0.00 31.60 31.91 2r8y h MET 20 CO -0.15 0.65 0.03 0.00 -0.40 0.00 0.00 176.91 177.03 2r8y h ALA 21 N 1.54 0.62 -0.41 0.39 0.00 -0.66 -1.86 119.26 118.87 2r8y h ALA 21 Ca 0.28 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2r8y h ALA 21 Cb -0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2r8y h ALA 21 CO -0.06 0.39 0.25 0.87 0.00 0.00 0.00 179.25 180.70 2r8y h LYS 22 N 0.65 0.56 -0.58 0.00 1.57 -0.71 -2.94 116.57 115.12 2r8y h LYS 22 Ca 0.13 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 2r8y h LYS 22 Cb 0.46 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.62 2r8y h LYS 22 CO 0.02 0.41 0.32 0.00 -0.57 0.00 0.00 179.45 179.63 2r8y h ALA 23 N 1.12 1.48 -0.50 3.86 0.00 -1.10 -2.51 119.26 121.60 2r8y h ALA 23 Ca 0.15 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.06 2r8y h ALA 23 Cb -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2r8y h ALA 23 CO -0.03 0.44 0.34 1.49 0.00 0.00 0.00 179.25 181.49 2r8y h GLU 24 N 0.81 0.26 -0.01 0.00 4.22 -1.15 -2.78 114.58 115.94 2r8y h GLU 24 Ca 0.21 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.63 2r8y h GLU 24 Cb 0.01 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2r8y h GLU 24 CO -0.04 0.17 -0.12 0.09 -2.18 0.00 0.00 179.01 176.93 2r8y n ASN 25 N -4.46 0.75 -4.66 1.04 5.03 -0.95 -4.78 115.26 107.24 2r8y n ASN 25 Ca 0.08 -0.84 -0.43 0.00 0.87 0.00 0.00 54.58 54.27 2r8y n ASN 25 Cb 0.37 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.11 2r8y n ASN 25 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2r8y s ILE 26 N -2.37 4.74 -0.30 2.41 -1.09 -1.05 -4.48 121.20 119.06 2r8y s ILE 26 Ca 0.30 1.88 0.14 0.00 -2.23 0.00 0.00 60.65 60.75 2r8y s ILE 26 Cb 0.20 -4.25 -0.19 0.00 -1.58 0.00 0.00 42.46 36.64 2r8y s ILE 26 CO 0.46 -0.13 0.43 0.54 -1.23 0.00 0.00 174.94 175.01 2r8y n ARG 27 N 6.11 1.34 -3.72 2.79 5.12 0.33 -4.88 116.66 123.75 2r8y n ARG 27 Ca 0.10 -0.07 -0.15 0.00 -1.93 0.00 0.00 57.85 55.79 2r8y n ARG 27 Cb 0.47 -1.25 -0.15 0.00 -1.16 0.00 0.00 32.46 30.36 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 -3.38 0.53 -0.32 0.55 2.96 -0.95 -1.45 118.68 116.61 2r8y s LEU 28 Ca -0.01 0.23 -0.06 0.00 -0.22 0.00 0.00 54.13 54.07 2r8y s LEU 28 Cb 0.10 0.19 0.03 0.00 0.50 0.00 0.00 46.19 47.01 2r8y s LEU 28 CO 0.58 -0.18 0.09 -0.22 -1.32 0.00 0.00 176.35 175.30 2r8y s LEU 29 N 1.55 4.15 -0.12 -0.68 2.96 0.11 -0.62 118.68 126.03 2r8y s LEU 29 Ca -0.04 -1.00 -0.06 0.00 -0.22 0.00 0.00 54.13 52.80 2r8y s LEU 29 Cb -0.12 -1.87 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 2r8y s LEU 29 CO -0.05 -0.28 0.11 -0.63 -1.32 0.00 0.00 176.35 174.18 2r8y s ILE 30 N 1.43 5.25 -0.05 6.68 1.01 0.56 -0.63 121.20 135.44 2r8y s ILE 30 Ca -0.00 0.11 0.02 0.00 0.00 0.00 0.00 60.65 60.78 2r8y s ILE 30 Cb -0.19 -3.27 0.01 0.00 0.01 0.00 0.00 42.46 39.02 2r8y s ILE 30 CO 0.03 0.61 -0.09 -0.76 0.00 0.00 0.00 174.94 174.72 2r8y s LEU 31 N -0.95 1.56 0.79 2.97 1.43 0.08 -1.33 118.68 123.23 2r8y s LEU 31 Ca 0.14 -0.23 -0.11 0.00 -1.03 0.00 0.00 54.13 52.90 2r8y s LEU 31 Cb -0.12 -0.68 0.06 0.00 0.03 0.00 0.00 46.19 45.49 2r8y s LEU 31 CO 0.03 0.01 1.08 -0.62 0.23 0.00 0.00 176.35 177.09 2r8y s ASP 32 N 0.68 4.50 -0.00 2.29 3.68 -0.88 -2.15 116.67 124.78 2r8y s ASP 32 Ca -0.12 1.58 -0.00 0.00 2.13 0.00 0.00 52.55 56.14 2r8y s ASP 32 Cb -0.15 -2.33 -0.00 0.00 -1.45 0.00 0.00 42.92 38.99 2r8y s ASP 32 CO 0.02 -2.00 -0.00 0.52 0.13 0.00 0.00 175.17 173.84 2r8y n VAL 33 N -3.48 0.02 -2.31 1.11 0.31 -1.26 -3.85 118.33 108.86 2r8y n VAL 33 Ca 0.08 0.50 -0.43 0.00 -0.01 0.00 0.00 64.34 64.48 2r8y n VAL 33 Cb 0.54 -1.51 -0.02 0.00 -0.91 0.00 0.00 33.84 31.94 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 -3.85 6.71 0.00 4.52 1.01 -1.26 -0.10 116.67 123.71 2r8y s ASP 34 Ca -0.00 1.59 0.00 0.00 0.71 0.00 0.00 52.55 54.85 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 -0.98 0.00 0.61 0.21 0.00 0.00 175.17 175.02 2r8y n GLY 35 N 4.10 0.79 1.13 0.21 0.00 -0.97 -4.73 105.19 105.71 2r8y n GLY 35 Ca 0.16 0.00 0.00 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 1.06 0.65 1.61 0.31 -0.89 -4.18 118.33 114.89 2r8y n VAL 36 Ca 0.00 0.35 0.12 0.00 -0.01 0.00 0.00 64.34 64.80 2r8y n VAL 36 Cb 0.00 -1.49 0.27 0.00 -0.91 0.00 0.00 33.84 31.71 2r8y n VAL 36 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2r8y n LEU 37 N -3.47 0.67 -4.48 7.52 4.77 0.86 -2.25 117.00 120.63 2r8y n LEU 37 Ca 0.00 0.31 -0.24 0.00 -0.03 0.00 0.00 56.01 56.05 2r8y n LEU 37 Cb 0.03 -0.24 -0.09 0.00 -2.33 0.00 0.00 43.42 40.79 2r8y n LEU 37 CO 0.00 -0.07 -0.21 -0.94 -1.33 0.00 0.00 177.39 174.84 2r8y s SER 38 N -4.12 2.53 -0.06 -1.43 1.04 -0.96 -3.96 113.70 106.74 2r8y s SER 38 Ca 0.08 -1.60 0.07 0.00 0.48 0.00 0.00 55.95 54.98 2r8y s SER 38 Cb 0.14 0.38 0.31 0.00 0.10 0.00 0.00 66.02 66.95 2r8y s SER 38 CO 0.68 -0.86 1.11 -0.90 0.98 0.00 0.00 173.24 174.24 2r8y n ASP 39 N -1.13 2.42 0.00 7.02 3.85 -1.25 -2.30 116.55 125.16 2r8y n ASP 39 Ca -0.04 -2.23 0.00 0.00 -0.71 0.00 0.00 54.79 51.81 2r8y n ASP 39 Cb 0.65 -0.42 0.00 0.00 -1.35 0.00 0.00 41.12 40.00 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 0.56 0.66 3.85 6.12 0.00 -1.26 -4.68 105.19 110.44 2r8y n GLY 40 Ca 0.11 0.00 -0.38 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 4.44 -0.22 0.99 1.43 -1.26 -4.76 118.68 119.30 2r8y s LEU 41 Ca 0.00 0.80 -0.00 0.00 -1.03 0.00 0.00 54.13 53.90 2r8y s LEU 41 Cb 0.00 -2.42 0.03 0.00 0.03 0.00 0.00 46.19 43.82 2r8y s LEU 41 CO 0.00 0.35 -0.12 -0.63 0.23 0.00 0.00 176.35 176.18 2r8y s ILE 42 N -1.03 2.52 -0.24 -0.59 -1.09 -1.26 -4.70 121.20 114.81 2r8y s ILE 42 Ca 0.21 -1.04 -0.19 0.00 -2.23 0.00 0.00 60.65 57.40 2r8y s ILE 42 Cb -0.15 -2.22 -0.03 0.00 -1.58 0.00 0.00 42.46 38.48 2r8y s ILE 42 CO 0.10 0.31 0.55 -0.31 -1.23 0.00 0.00 174.94 174.36 2r8y s TYR 43 N 1.29 3.31 -0.04 3.97 1.51 -1.05 -5.00 117.35 121.34 2r8y s TYR 43 Ca 0.01 0.74 0.05 0.00 -1.01 0.00 0.00 57.07 56.86 2r8y s TYR 43 Cb -0.16 -2.74 -0.01 0.00 -0.11 0.00 0.00 41.96 38.95 2r8y s TYR 43 CO -0.07 -0.23 -0.18 -1.64 -1.11 0.00 0.00 175.55 172.31 2r8y s MET 44 N 2.13 1.84 0.37 -0.62 -1.94 -1.26 -1.54 119.30 118.28 2r8y s MET 44 Ca 0.24 -0.66 0.08 0.00 -1.71 0.00 0.00 55.69 53.64 2r8y s MET 44 Cb -0.16 -1.62 -0.07 0.00 2.01 0.00 0.00 34.83 35.00 2r8y s MET 44 CO 0.09 0.29 -0.02 0.20 -0.01 0.00 0.00 175.02 175.57 2r8y s GLY 45 N -0.07 2.30 0.53 -0.03 0.00 -0.87 -4.99 107.32 104.20 2r8y s GLY 45 Ca -0.02 -2.15 0.32 0.00 0.00 0.00 0.00 44.72 42.87 2r8y s GLY 45 CO 0.02 -2.03 2.00 3.43 0.00 0.00 0.00 173.10 176.52 2r8y h ASN 46 N 1.85 0.00 -0.42 1.64 2.35 -2.01 -1.67 115.58 117.32 2r8y h ASN 46 Ca -0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 2r8y h ASN 46 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 2r8y h ASN 46 CO 0.74 0.07 0.00 0.59 -1.65 0.00 0.00 177.43 177.18 2r8y n ASN 47 N -3.24 4.02 -0.33 5.81 5.03 -1.26 -4.91 115.26 120.38 2r8y n ASN 47 Ca -0.00 -2.54 -0.04 0.00 0.87 0.00 0.00 54.58 52.87 2r8y n ASN 47 Cb 0.30 -0.58 -0.02 0.00 -1.02 0.00 0.00 39.78 38.46 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 0.58 0.68 3.73 7.41 0.00 -0.63 -5.02 105.19 111.95 2r8y n GLY 48 Ca 0.19 -0.35 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 2r8y n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2r8y s GLU 49 N -1.79 2.37 -0.07 1.61 8.01 -1.25 -4.83 118.70 122.74 2r8y s GLU 49 Ca 0.00 1.78 -0.04 0.00 0.01 0.00 0.00 54.97 56.72 2r8y s GLU 49 Cb 0.00 -1.86 0.04 0.00 -4.31 0.00 0.00 34.13 28.00 2r8y s GLU 49 CO 0.00 -1.67 0.17 -2.00 0.01 0.00 0.00 175.26 171.77 2r8y s GLU 50 N -3.77 0.13 0.23 1.61 2.12 -1.26 -2.04 118.70 115.73 2r8y s GLU 50 Ca 0.75 0.38 0.09 0.00 0.36 0.00 0.00 54.97 56.56 2r8y s GLU 50 Cb -0.30 -0.12 -0.05 0.00 0.26 0.00 0.00 34.13 33.93 2r8y s GLU 50 CO 0.42 -0.14 -0.17 -0.51 -0.54 0.00 0.00 175.26 174.32 2r8y s LEU 51 N 1.00 2.56 -0.01 2.70 1.43 -0.59 -5.00 118.68 120.77 2r8y s LEU 51 Ca -0.08 -1.01 -0.09 0.00 -1.03 0.00 0.00 54.13 51.92 2r8y s LEU 51 Cb -0.09 -0.86 0.01 0.00 0.03 0.00 0.00 46.19 45.28 2r8y s LEU 51 CO -0.05 -0.08 0.19 -0.75 0.23 0.00 0.00 176.35 175.89 2r8y s LYS 52 N -3.52 0.49 -0.19 1.70 2.20 -1.26 -2.52 119.74 116.64 2r8y s LYS 52 Ca 0.25 -0.24 -0.06 0.00 -0.36 0.00 0.00 55.97 55.56 2r8y s LYS 52 Cb -0.03 0.21 -0.03 0.00 -1.51 0.00 0.00 37.83 36.47 2r8y s LYS 52 CO 0.10 -0.12 0.04 0.00 -0.36 0.00 0.00 175.35 175.01 2r8y s ALA 53 N -1.12 3.25 0.17 3.13 0.00 -1.26 -5.10 121.76 120.82 2r8y s ALA 53 Ca -0.12 -0.83 0.09 0.00 0.00 0.00 0.00 51.96 51.10 2r8y s ALA 53 Cb -0.06 -1.84 -0.04 0.00 0.00 0.00 0.00 23.12 21.17 2r8y s ALA 53 CO 0.02 0.08 -0.14 -0.06 0.00 0.00 0.00 175.76 175.65 2r8y s PHE 54 N 0.58 2.56 -0.20 0.00 0.40 -1.26 -4.25 117.98 115.81 2r8y s PHE 54 Ca 0.01 -0.25 -0.11 0.00 -0.60 0.00 0.00 56.93 55.99 2r8y s PHE 54 Cb -0.13 -1.28 -0.05 0.00 0.51 0.00 0.00 43.02 42.07 2r8y s PHE 54 CO 0.02 0.48 0.16 1.21 0.70 0.00 0.00 175.22 177.78 2r8y s ASN 55 N -2.63 6.23 0.52 1.36 3.04 -1.25 -4.98 114.94 117.23 2r8y s ASN 55 Ca 0.22 0.26 0.21 0.00 0.04 0.00 0.00 52.86 53.59 2r8y s ASN 55 Cb -0.09 -2.10 1.37 0.00 -1.54 0.00 0.00 41.25 38.88 2r8y s ASN 55 CO 0.13 0.16 2.12 -0.37 -3.04 0.00 0.00 177.10 176.10 2r8y h VAL 56 N 4.70 0.85 -0.43 -5.21 -1.51 -1.94 -1.98 116.25 110.74 2r8y h VAL 56 Ca -0.41 -0.24 -0.09 0.00 -1.23 0.00 0.00 66.70 64.73 2r8y h VAL 56 Cb 1.15 1.14 -0.02 0.00 -2.13 0.00 0.00 31.29 31.43 2r8y h VAL 56 CO 0.75 0.07 -0.09 -0.09 -1.23 0.00 0.00 177.57 176.98 2r8y h ARG 57 N 0.00 0.75 -0.59 5.19 2.43 -1.95 -1.35 114.38 118.85 2r8y h ARG 57 Ca -0.00 -0.23 -0.08 0.00 -0.81 0.00 0.00 59.98 58.85 2r8y h ARG 57 Cb 0.13 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 2r8y h ARG 57 CO 0.01 0.82 0.04 -0.44 -1.51 0.00 0.00 179.97 178.88 2r8y h ASP 58 N 0.68 0.97 -0.56 -3.80 3.32 -1.73 -2.78 116.42 112.53 2r8y h ASP 58 Ca 0.12 -0.25 0.04 0.00 0.02 0.00 0.00 57.03 56.96 2r8y h ASP 58 Cb 0.55 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.80 2r8y h ASP 58 CO 0.03 1.01 0.31 1.23 -1.72 0.00 0.00 179.24 180.11 2r8y h GLY 59 N 1.01 0.79 0.97 2.75 0.00 -1.13 -0.30 103.07 107.16 2r8y h GLY 59 Ca 0.18 -0.23 0.01 0.00 0.00 0.00 0.00 47.33 47.29 2r8y h GLY 59 CO 0.02 0.17 0.44 -1.82 0.00 0.00 0.00 176.54 175.35 2r8y h TYR 60 N 0.61 0.83 -0.41 5.60 5.03 -1.01 -1.87 116.97 125.75 2r8y h TYR 60 Ca 0.23 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.49 2r8y h TYR 60 Cb 0.08 -0.28 -0.01 0.00 1.55 0.00 0.00 36.73 38.07 2r8y h TYR 60 CO -0.08 0.51 -0.04 0.78 -1.32 0.00 0.00 178.16 178.01 2r8y h GLY 61 N 0.89 0.82 0.99 1.82 0.00 -1.17 -1.22 103.07 105.20 2r8y h GLY 61 Ca 0.25 -0.64 0.01 0.00 0.00 0.00 0.00 47.33 46.95 2r8y h GLY 61 CO -0.07 0.59 0.37 -2.22 0.00 0.00 0.00 176.54 175.21 2r8y h ILE 62 N 0.59 1.13 -0.85 2.60 2.04 -0.99 -0.75 117.51 121.29 2r8y h ILE 62 Ca 0.11 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2r8y h ILE 62 Cb 0.55 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 2r8y h ILE 62 CO 0.03 0.14 0.51 0.03 0.00 0.00 0.00 178.15 178.85 2r8y h ARG 63 N 0.75 1.15 -0.20 2.37 2.47 -1.21 -1.36 114.38 118.35 2r8y h ARG 63 Ca 0.21 -0.11 0.02 0.00 -1.26 0.00 0.00 59.98 58.84 2r8y h ARG 63 Cb -0.07 -0.24 -0.02 0.00 -1.65 0.00 0.00 29.97 27.99 2r8y h ARG 63 CO -0.05 0.81 0.07 0.00 0.56 0.00 0.00 179.97 181.36 2r8y h ALA 65 N 1.12 -0.58 -0.22 0.00 0.00 -0.86 -1.86 119.26 116.85 2r8y h ALA 65 Ca 0.09 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.94 2r8y h ALA 65 Cb 0.05 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2r8y h ALA 65 CO -0.09 -0.83 0.17 -0.07 0.00 0.00 0.00 179.25 178.43 2r8y h LEU 66 N -0.59 0.00 -1.79 0.00 3.38 -1.15 0.01 115.31 115.17 2r8y h LEU 66 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2r8y h LEU 66 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2r8y h LEU 66 CO 0.07 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.95 2r8y n THR 67 N -4.36 0.24 -1.61 0.22 -2.24 -0.96 -4.01 114.28 101.55 2r8y n THR 67 Ca 0.02 -0.53 0.01 0.00 -2.27 0.00 0.00 64.05 61.28 2r8y n THR 67 Cb 0.31 0.95 0.19 0.00 -2.10 0.00 0.00 70.33 69.68 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 1.05 2.16 -3.14 3.42 7.64 -0.14 -4.96 113.62 119.66 2r8y n SER 68 Ca 0.17 -3.88 -0.22 0.00 1.01 0.00 0.00 58.87 55.96 2r8y n SER 68 Cb 0.52 -0.53 0.06 0.00 -1.01 0.00 0.00 64.21 63.24 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 -1.08 -6.03 -4.00 6.43 4.64 -1.17 -4.98 116.55 110.35 2r8y n ASP 69 Ca 0.24 -0.39 -0.31 0.00 -1.38 0.00 0.00 54.79 52.95 2r8y n ASP 69 Cb 0.77 -4.74 -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 -3.23 1.69 0.46 5.18 1.01 -0.45 -4.85 121.20 121.01 2r8y s ILE 70 Ca 0.43 -1.07 -0.23 0.00 0.00 0.00 0.00 60.65 59.78 2r8y s ILE 70 Cb -0.19 -1.77 -0.07 0.00 0.01 0.00 0.00 42.46 40.44 2r8y s ILE 70 CO 0.53 0.15 1.15 -1.61 0.00 0.00 0.00 174.94 175.16 2r8y s GLU 71 N 1.37 3.76 -0.06 2.79 0.41 -0.53 -2.98 118.70 123.47 2r8y s GLU 71 Ca -0.02 1.74 0.05 0.00 -0.41 0.00 0.00 54.97 56.33 2r8y s GLU 71 Cb -0.17 -2.39 -0.01 0.00 -1.78 0.00 0.00 34.13 29.79 2r8y s GLU 71 CO -0.08 -0.54 -0.21 0.08 -0.49 0.00 0.00 175.26 174.02 2r8y s VAL 72 N -1.58 1.74 0.06 2.63 1.01 -1.26 0.06 120.40 123.07 2r8y s VAL 72 Ca 0.64 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.75 2r8y s VAL 72 Cb -0.28 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 2r8y s VAL 72 CO 0.33 0.49 -0.07 0.00 0.00 0.00 0.00 175.10 175.85 2r8y s ALA 73 N 0.01 0.72 -0.07 5.51 0.00 0.19 -4.37 121.76 123.76 2r8y s ALA 73 Ca -0.06 -0.99 0.05 0.00 0.00 0.00 0.00 51.96 50.97 2r8y s ALA 73 Cb -0.13 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 2r8y s ALA 73 CO 0.04 -0.10 -0.23 0.42 0.00 0.00 0.00 175.76 175.88 2r8y s ILE 74 N -2.24 1.93 -0.10 0.00 1.01 0.54 -0.74 121.20 121.60 2r8y s ILE 74 Ca -0.02 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 59.66 2r8y s ILE 74 Cb -0.04 -1.64 0.02 0.00 0.01 0.00 0.00 42.46 40.81 2r8y s ILE 74 CO -0.02 0.54 -0.08 -0.63 0.00 0.00 0.00 174.94 174.75 2r8y s ILE 75 N 0.01 1.01 0.00 2.92 1.01 -0.91 -0.49 121.20 124.75 2r8y s ILE 75 Ca -0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 60.65 60.24 2r8y s ILE 75 Cb -0.14 -1.00 -0.01 0.00 0.01 0.00 0.00 42.46 41.32 2r8y s ILE 75 CO 0.05 0.35 0.02 0.28 0.00 0.00 0.00 174.94 175.64 2r8y s THR 76 N 1.39 0.05 0.30 2.92 -1.32 -0.07 -4.18 115.64 114.74 2r8y s THR 76 Ca -0.01 -0.42 0.09 0.00 -1.21 0.00 0.00 61.69 60.14 2r8y s THR 76 Cb -0.13 -0.18 0.02 0.00 -1.51 0.00 0.00 72.50 70.70 2r8y s THR 76 CO -0.04 -0.23 1.68 1.23 -2.21 0.00 0.00 174.62 175.05 2r8y h GLY 77 N 5.34 0.11 -1.30 6.08 0.00 -1.87 -1.69 103.07 109.74 2r8y h GLY 77 Ca -0.28 -0.11 -0.46 0.00 0.00 0.00 0.00 47.33 46.48 2r8y h GLY 77 CO 0.45 0.10 0.19 0.50 0.00 0.00 0.00 176.54 177.78 2r8y s ARG 78 N -3.93 2.41 -0.05 4.80 0.52 -1.26 -3.38 118.95 118.07 2r8y s ARG 78 Ca -0.03 -0.25 -0.01 0.00 -0.52 0.00 0.00 55.73 54.93 2r8y s ARG 78 Cb 0.13 -2.23 0.03 0.00 0.52 0.00 0.00 34.95 33.40 2r8y s ARG 78 CO 0.76 -1.05 0.01 0.21 0.02 0.00 0.00 175.30 175.25 2r8y s LYS 79 N -5.13 0.33 -0.17 3.54 2.20 -1.26 -1.03 119.74 118.21 2r8y s LYS 79 Ca 0.58 0.15 -0.20 0.00 -0.36 0.00 0.00 55.97 56.14 2r8y s LYS 79 Cb -0.11 -0.65 0.05 0.00 -1.51 0.00 0.00 37.83 35.62 2r8y s LYS 79 CO 0.44 -0.23 0.54 0.00 -0.36 0.00 0.00 175.35 175.74 2r8y s ALA 80 N 1.56 -1.34 0.29 3.13 0.00 -1.26 -4.99 121.76 119.16 2r8y s ALA 80 Ca -0.02 1.40 -0.00 0.00 0.00 0.00 0.00 51.96 53.34 2r8y s ALA 80 Cb -0.13 -0.71 0.50 0.00 0.00 0.00 0.00 23.12 22.78 2r8y s ALA 80 CO -0.03 -0.27 1.91 -0.22 0.00 0.00 0.00 175.76 177.15 2r8y h LYS 81 N 4.91 1.04 -0.97 0.00 1.63 -2.00 -2.51 116.57 118.66 2r8y h LYS 81 Ca -0.28 -0.06 0.17 0.00 -0.85 0.00 0.00 60.65 59.63 2r8y h LYS 81 Cb 1.17 -0.23 -0.09 0.00 -0.60 0.00 0.00 32.23 32.48 2r8y h LYS 81 CO 0.21 0.69 0.61 1.37 -3.45 0.00 0.00 179.45 178.87 2r8y h LEU 82 N 1.07 0.74 -0.78 5.20 8.10 -1.96 -0.15 115.31 127.53 2r8y h LEU 82 Ca 0.40 0.07 -0.04 0.00 0.11 0.00 0.00 57.88 58.41 2r8y h LEU 82 Cb 0.18 -0.07 -0.03 0.00 -0.44 0.00 0.00 40.66 40.29 2r8y h LEU 82 CO -0.15 0.32 0.33 0.58 -4.11 0.00 0.00 178.44 175.41 2r8y h VAL 83 N 0.75 1.26 -0.33 0.15 2.07 -1.87 -0.09 116.25 118.19 2r8y h VAL 83 Ca 0.52 -0.78 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 2r8y h VAL 83 Cb 0.82 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 2r8y h VAL 83 CO -0.29 0.32 0.20 -0.33 0.02 0.00 0.00 177.57 177.48 2r8y h GLU 84 N 1.12 0.45 -0.69 1.57 5.08 -1.10 -1.73 114.58 119.28 2r8y h GLU 84 Ca 0.26 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.61 2r8y h GLU 84 Cb 0.19 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 2r8y h GLU 84 CO -0.02 0.35 0.42 -0.44 -1.00 0.00 0.00 179.01 178.31 2r8y h ASP 85 N 0.42 0.69 -0.61 1.42 3.32 -0.80 -1.14 116.42 119.73 2r8y h ASP 85 Ca 0.12 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 2r8y h ASP 85 Cb 0.02 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 2r8y h ASP 85 CO -0.02 0.47 0.36 -0.09 -1.72 0.00 0.00 179.24 178.24 2r8y h ARG 86 N 0.82 0.83 -0.38 3.56 9.65 -0.76 -1.63 114.38 126.46 2r8y h ARG 86 Ca 0.28 -0.08 -0.02 0.00 -1.10 0.00 0.00 59.98 59.06 2r8y h ARG 86 Cb 0.04 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.43 2r8y h ARG 86 CO -0.12 0.60 0.17 0.00 2.80 0.00 0.00 179.97 183.43 2r8y h ALA 88 N 1.02 0.75 -0.78 0.00 0.00 -1.03 0.86 119.26 120.08 2r8y h ALA 88 Ca 0.13 0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.25 2r8y h ALA 88 Cb 0.14 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.04 2r8y h ALA 88 CO -0.01 -0.30 0.45 1.15 0.00 0.00 0.00 179.25 180.53 2r8y h THR 89 N 0.27 0.94 -0.01 0.00 2.02 -0.88 -3.08 112.91 112.18 2r8y h THR 89 Ca 0.33 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.24 2r8y h THR 89 Cb 0.49 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.00 2r8y h THR 89 CO -0.41 0.14 -0.36 0.18 0.37 0.00 0.00 175.52 175.44 2r8y n LEU 90 N -4.74 1.14 -0.37 2.58 4.77 -0.69 -4.95 117.00 114.75 2r8y n LEU 90 Ca 0.12 -0.33 -0.04 0.00 -0.03 0.00 0.00 56.01 55.73 2r8y n LEU 90 Cb 0.23 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 2r8y n LEU 90 CO 0.28 0.22 -0.04 0.61 -1.33 0.00 0.00 177.39 177.13 2r8y n GLY 91 N 1.38 0.53 3.66 -0.72 0.00 0.16 -4.71 105.19 105.49 2r8y n GLY 91 Ca 0.10 -0.83 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.17 4.79 -0.98 -0.61 1.01 -0.39 -4.94 121.20 117.91 2r8y s ILE 92 Ca 0.00 1.82 0.09 0.00 0.00 0.00 0.00 60.65 62.56 2r8y s ILE 92 Cb 0.00 -4.22 0.03 0.00 0.01 0.00 0.00 42.46 38.28 2r8y s ILE 92 CO 0.00 -0.07 0.68 0.35 0.00 0.00 0.00 174.94 175.90 2r8y n THR 93 N 5.02 0.00 -3.92 2.92 -2.24 -1.26 -4.41 114.28 110.38 2r8y n THR 93 Ca 0.08 -0.45 -0.32 0.00 -2.27 0.00 0.00 64.05 61.09 2r8y n THR 93 Cb 0.48 1.15 -0.13 0.00 -2.10 0.00 0.00 70.33 69.72 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 -1.07 3.52 -0.10 4.78 3.76 -1.26 -5.07 115.29 119.84 2r8y s HIS 94 Ca 0.09 -2.93 0.00 0.00 -0.15 0.00 0.00 55.06 52.07 2r8y s HIS 94 Cb 0.08 -2.98 0.02 0.00 1.11 0.00 0.00 32.58 30.81 2r8y s HIS 94 CO 0.18 -0.88 -0.09 -1.17 -0.85 0.00 0.00 174.74 171.94 2r8y s LEU 95 N 0.45 1.33 -0.19 0.89 2.96 -1.26 -0.34 118.68 122.52 2r8y s LEU 95 Ca 0.13 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 53.75 2r8y s LEU 95 Cb -0.22 -0.84 0.03 0.00 0.50 0.00 0.00 46.19 45.66 2r8y s LEU 95 CO -0.04 -0.07 -0.16 -0.31 -1.32 0.00 0.00 176.35 174.44 2r8y s TYR 96 N 1.39 2.67 0.37 5.38 1.51 0.36 -4.99 117.35 124.04 2r8y s TYR 96 Ca -0.01 -1.65 0.08 0.00 -1.01 0.00 0.00 57.07 54.48 2r8y s TYR 96 Cb -0.13 -1.81 -0.06 0.00 -0.11 0.00 0.00 41.96 39.85 2r8y s TYR 96 CO -0.05 -0.78 0.06 -0.65 -1.11 0.00 0.00 175.55 173.02 2r8y s GLN 97 N 1.32 2.09 -1.46 -0.62 -0.21 -1.26 -0.89 119.66 118.64 2r8y s GLN 97 Ca 0.02 -1.84 -0.01 0.00 0.02 0.00 0.00 55.36 53.56 2r8y s GLN 97 Cb -0.14 -1.89 0.00 0.00 1.00 0.00 0.00 33.01 31.97 2r8y s GLN 97 CO -0.11 0.04 0.11 0.41 -2.12 0.00 0.00 175.29 173.62 2r8y n GLY 98 N -1.03 -0.35 3.28 3.09 0.00 -0.20 -4.93 105.19 105.05 2r8y n GLY 98 Ca -0.03 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 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 -5.01 2.74 0.02 1.61 2.00 -0.68 -4.92 119.66 115.43 2r8y s GLN 99 Ca 0.05 -1.64 0.13 0.00 -2.00 0.00 0.00 55.36 51.91 2r8y s GLN 99 Cb -0.02 -4.06 -0.19 0.00 0.80 0.00 0.00 33.01 29.54 2r8y s GLN 99 CO 0.07 -1.18 0.81 0.77 -0.50 0.00 0.00 175.29 175.26 2r8y h SER 100 N 8.64 0.00 -3.58 6.67 0.02 -1.86 -3.30 113.55 120.13 2r8y h SER 100 Ca -0.25 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 60.01 2r8y h SER 100 Cb 1.09 0.00 -0.35 0.00 0.14 0.00 0.00 62.40 63.28 2r8y h SER 100 CO 0.91 0.85 -0.56 0.21 -1.14 0.00 0.00 176.83 177.10 2r8y s ASN 101 N -6.07 5.18 0.03 3.07 3.84 -1.26 -4.97 114.94 114.75 2r8y s ASN 101 Ca -0.03 -2.14 0.19 0.00 0.21 0.00 0.00 52.86 51.09 2r8y s ASN 101 Cb 0.08 -1.80 0.79 0.00 -0.55 0.00 0.00 41.25 39.77 2r8y s ASN 101 CO 0.82 -0.50 1.60 0.29 -2.79 0.00 0.00 177.10 176.51 2r8y n LYS 102 N 4.43 0.02 0.18 0.43 5.02 -1.26 -2.45 118.16 124.52 2r8y n LYS 102 Ca -0.00 0.21 0.03 0.00 -2.02 0.00 0.00 58.31 56.52 2r8y n LYS 102 Cb 0.41 -1.54 0.40 0.00 -0.02 0.00 0.00 35.03 34.28 2r8y n LYS 102 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2r8y h LEU 103 N 0.00 0.07 0.19 -0.35 3.38 -1.94 -0.85 115.31 115.80 2r8y h LEU 103 Ca 0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2r8y h LEU 103 Cb 0.33 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2r8y h LEU 103 CO 0.00 0.34 -0.09 0.40 0.09 0.00 0.00 178.44 179.18 2r8y h ILE 104 N 0.06 0.92 -0.48 1.22 2.04 -1.92 -0.96 117.51 118.39 2r8y h ILE 104 Ca 0.01 -0.68 -0.03 0.00 1.00 0.00 0.00 64.86 65.17 2r8y h ILE 104 Cb 0.51 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 2r8y h ILE 104 CO 0.04 0.15 0.18 0.00 0.00 0.00 0.00 178.15 178.52 2r8y h ALA 105 N 0.13 1.43 -0.04 1.87 0.00 -1.70 -1.71 119.26 119.24 2r8y h ALA 105 Ca -0.03 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2r8y h ALA 105 Cb 0.44 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2r8y h ALA 105 CO 0.04 0.43 0.02 0.35 0.00 0.00 0.00 179.25 180.10 2r8y h PHE 106 N 0.68 0.05 -0.23 0.00 -0.00 -1.03 -0.48 116.94 115.93 2r8y h PHE 106 Ca 0.16 -0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.13 2r8y h PHE 106 Cb 0.15 -0.02 -0.01 0.00 -0.00 0.00 0.00 35.95 36.07 2r8y h PHE 106 CO 0.01 0.08 0.15 0.77 -0.00 0.00 0.00 178.31 179.32 2r8y h SER 107 N 0.01 0.26 -0.78 0.41 0.02 -0.90 -1.67 113.55 110.90 2r8y h SER 107 Ca 0.01 -0.02 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 2r8y h SER 107 Cb 0.04 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.48 2r8y h SER 107 CO -0.00 0.20 0.51 -0.78 -1.14 0.00 0.00 176.83 175.62 2r8y h ASP 108 N 0.30 0.86 -0.22 3.07 3.58 -1.21 -0.14 116.42 122.66 2r8y h ASP 108 Ca 0.08 -0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.50 2r8y h ASP 108 Cb -0.02 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 40.82 2r8y h ASP 108 CO -0.02 0.60 0.08 -0.07 -2.88 0.00 0.00 179.24 176.95 2r8y h LEU 109 N 1.01 0.32 -0.75 2.28 3.38 -0.86 -0.75 115.31 119.95 2r8y h LEU 109 Ca 0.30 -0.19 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 2r8y h LEU 109 Cb -0.05 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2r8y h LEU 109 CO -0.09 0.43 -0.37 -0.07 0.09 0.00 0.00 178.44 178.42 2r8y h LEU 110 N 0.20 0.54 -0.01 1.67 3.38 -1.11 -1.66 115.31 118.32 2r8y h LEU 110 Ca 0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 2r8y h LEU 110 Cb 0.22 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2r8y h LEU 110 CO -0.00 0.87 0.01 -0.33 0.09 0.00 0.00 178.44 179.07 2r8y h GLU 111 N 0.43 0.02 -0.68 1.13 4.39 -0.94 0.72 114.58 119.65 2r8y h GLU 111 Ca 0.04 -0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.78 2r8y h GLU 111 Cb 0.85 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.45 2r8y h GLU 111 CO 0.07 0.13 0.42 0.87 -1.16 0.00 0.00 179.01 179.34 2r8y h LYS 112 N -0.10 0.78 -0.00 2.33 1.57 -1.02 -3.09 116.57 117.04 2r8y h LYS 112 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2r8y h LYS 112 Cb 0.12 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2r8y h LYS 112 CO -0.00 0.52 -0.60 1.28 -0.57 0.00 0.00 179.45 180.08 2r8y n LEU 113 N -4.70 0.81 -3.69 2.94 4.77 -0.64 -4.97 117.00 111.53 2r8y n LEU 113 Ca 0.07 -0.22 -0.29 0.00 -0.03 0.00 0.00 56.01 55.54 2r8y n LEU 113 Cb 0.10 -0.15 0.04 0.00 -2.33 0.00 0.00 43.42 41.08 2r8y n LEU 113 CO 0.32 0.18 -0.09 0.00 -1.33 0.00 0.00 177.39 176.48 2r8y n ALA 114 N -1.28 -2.43 -2.62 -1.18 0.00 0.22 -5.00 120.51 108.23 2r8y n ALA 114 Ca 0.06 -0.21 -0.29 0.00 0.00 0.00 0.00 53.44 53.00 2r8y n ALA 114 Cb 0.34 -3.70 -0.16 0.00 0.00 0.00 0.00 19.45 15.93 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 -3.54 1.82 0.37 0.00 2.07 -1.07 -5.07 121.20 115.78 2r8y s ILE 115 Ca 0.37 -0.96 -0.25 0.00 -1.41 0.00 0.00 60.65 58.40 2r8y s ILE 115 Cb -0.13 -1.53 -0.09 0.00 0.13 0.00 0.00 42.46 40.84 2r8y s ILE 115 CO 0.85 0.51 1.01 0.00 -1.91 0.00 0.00 174.94 175.40 2r8y s ALA 116 N -0.28 3.14 0.39 1.50 0.00 -1.26 -4.80 121.76 120.45 2r8y s ALA 116 Ca 0.02 0.62 0.18 0.00 0.00 0.00 0.00 51.96 52.78 2r8y s ALA 116 Cb -0.11 -3.23 1.10 0.00 0.00 0.00 0.00 23.12 20.88 2r8y s ALA 116 CO 0.01 -0.05 1.76 -1.35 0.00 0.00 0.00 175.76 176.13 2r8y h PRO 117 N 2.75 0.38 -0.37 0.00 0.11 -1.96 -0.90 132.00 132.01 2r8y h PRO 117 Ca -0.48 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.70 2r8y h PRO 117 Cb 1.20 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2r8y h PRO 117 CO 0.63 0.25 0.26 1.05 -0.21 0.00 0.00 178.00 179.98 2r8y h GLU 118 N 0.39 0.11 -0.66 1.05 9.09 -1.89 0.60 114.58 123.27 2r8y h GLU 118 Ca 0.62 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 60.02 2r8y h GLU 118 Cb 1.55 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 28.62 2r8y h GLU 118 CO -0.32 0.07 0.00 0.09 0.05 0.00 0.00 179.01 178.90 2r8y n ASN 119 N -4.45 3.51 -4.43 3.06 3.02 -0.34 -3.84 115.26 111.78 2r8y n ASN 119 Ca 0.05 -2.41 -0.33 0.00 -0.03 0.00 0.00 54.58 51.87 2r8y n ASN 119 Cb 0.37 -0.53 -0.14 0.00 -0.61 0.00 0.00 39.78 38.87 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 -1.89 2.97 0.04 2.41 1.01 -0.66 -0.52 120.40 123.76 2r8y s VAL 120 Ca 0.33 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.61 2r8y s VAL 120 Cb 0.23 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 2r8y s VAL 120 CO 0.13 0.57 -0.04 0.00 0.00 0.00 0.00 175.10 175.76 2r8y s ALA 121 N -0.38 3.13 -0.04 5.51 0.00 0.21 -0.94 121.76 129.25 2r8y s ALA 121 Ca 0.04 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.94 2r8y s ALA 121 Cb -0.12 -1.15 0.03 0.00 0.00 0.00 0.00 23.12 21.87 2r8y s ALA 121 CO 0.02 0.65 -0.01 -0.47 0.00 0.00 0.00 175.76 175.95 2r8y s TYR 122 N -1.13 0.47 -0.29 0.00 5.04 -0.48 -0.32 117.35 120.63 2r8y s TYR 122 Ca 0.20 -0.07 -0.06 0.00 -2.44 0.00 0.00 57.07 54.71 2r8y s TYR 122 Cb -0.11 -0.54 0.02 0.00 0.35 0.00 0.00 41.96 41.68 2r8y s TYR 122 CO 0.12 -0.18 0.06 0.08 -1.34 0.00 0.00 175.55 174.29 2r8y s VAL 123 N 1.19 3.74 0.43 3.14 1.01 -0.44 -0.22 120.40 129.25 2r8y s VAL 123 Ca -0.07 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.12 2r8y s VAL 123 Cb -0.13 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 2r8y s VAL 123 CO -0.02 0.06 0.06 -0.83 0.00 0.00 0.00 175.10 174.37 2r8y s GLY 124 N 1.45 2.63 0.00 4.51 0.00 -0.23 -2.08 107.32 113.60 2r8y s GLY 124 Ca 0.01 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.48 2r8y s GLY 124 CO 0.01 -1.98 0.00 2.09 0.00 0.00 0.00 173.10 173.22 2r8y n ASP 125 N -1.13 0.00 -3.98 1.64 3.85 -1.26 -2.32 116.55 113.34 2r8y n ASP 125 Ca -0.09 0.00 -0.14 0.00 -0.71 0.00 0.00 54.79 53.85 2r8y n ASP 125 Cb 0.66 0.00 -0.10 0.00 -1.35 0.00 0.00 41.12 40.34 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 0.58 0.48 -1.12 -1.08 -1.26 -0.28 116.67 114.00 2r8y s ASP 126 Ca 0.00 -1.49 0.21 0.00 -0.52 0.00 0.00 52.55 50.75 2r8y s ASP 126 Cb 0.00 0.42 1.22 0.00 -1.46 0.00 0.00 42.92 43.10 2r8y s ASP 126 CO 0.00 -0.90 2.02 -0.07 0.52 0.00 0.00 175.17 176.75 2r8y h LEU 127 N 2.49 0.00 -1.82 -1.34 3.38 -1.99 -1.22 115.31 114.81 2r8y h LEU 127 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2r8y h LEU 127 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2r8y h LEU 127 CO 0.49 0.16 0.00 -0.29 0.09 0.00 0.00 178.44 178.89 2r8y h ILE 128 N 0.00 0.00 0.00 1.22 6.09 -1.99 -1.39 117.51 121.44 2r8y h ILE 128 Ca -0.00 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 63.34 2r8y h ILE 128 Cb 0.35 0.96 0.00 0.00 0.47 0.00 0.00 36.82 38.60 2r8y h ILE 128 CO 0.02 0.00 -0.64 0.44 -3.07 0.00 0.00 178.15 174.90 2r8y h ASP 129 N 0.00 0.00 -0.62 2.19 3.32 -1.64 -3.40 116.42 116.26 2r8y h ASP 129 Ca 0.00 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 56.86 2r8y h ASP 129 Cb 0.18 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 2r8y h ASP 129 CO 0.00 0.07 0.18 -0.25 -1.72 0.00 0.00 179.24 177.52 2r8y h TRP 130 N 0.00 1.02 -0.76 4.55 2.91 -1.35 -2.02 115.95 120.29 2r8y h TRP 130 Ca 0.00 -0.11 0.17 0.00 1.13 0.00 0.00 58.89 60.08 2r8y h TRP 130 Cb 0.82 -0.29 -0.11 0.00 -0.51 0.00 0.00 29.16 29.07 2r8y h TRP 130 CO 0.00 0.84 0.21 -1.35 -1.03 0.00 0.00 178.44 177.11 2r8y h PRO 131 N 0.90 0.29 -0.14 2.65 0.11 -1.78 0.18 132.00 134.20 2r8y h PRO 131 Ca 0.20 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.14 2r8y h PRO 131 Cb 0.31 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 31.36 2r8y h PRO 131 CO -0.00 0.19 -0.50 0.28 -0.21 0.00 0.00 178.00 177.76 2r8y h VAL 132 N 0.29 1.34 -0.78 3.15 2.07 -1.83 -3.26 116.25 117.24 2r8y h VAL 132 Ca 0.44 -1.78 0.04 0.00 0.82 0.00 0.00 66.70 66.22 2r8y h VAL 132 Cb 0.75 2.07 -0.05 0.00 -1.52 0.00 0.00 31.29 32.55 2r8y h VAL 132 CO -0.51 0.54 0.51 0.24 0.02 0.00 0.00 177.57 178.37 2r8y h MET 133 N 0.22 0.90 -0.66 1.57 2.86 -0.58 -1.61 114.93 117.62 2r8y h MET 133 Ca -0.02 -0.05 0.12 0.00 -2.06 0.00 0.00 59.70 57.68 2r8y h MET 133 Cb 1.13 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 32.54 2r8y h MET 133 CO 0.10 0.59 0.44 1.49 1.06 0.00 0.00 176.91 180.60 2r8y h GLU 134 N 0.93 0.40 0.00 1.72 4.81 -0.73 -3.01 114.58 118.70 2r8y h GLU 134 Ca 0.31 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 2r8y h GLU 134 Cb 0.09 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2r8y h GLU 134 CO -0.10 0.26 -1.03 1.63 -0.73 0.00 0.00 179.01 179.05 2r8y n LYS 135 N -4.47 0.50 -2.36 1.92 5.02 -0.62 -4.99 118.16 113.17 2r8y n LYS 135 Ca 0.12 0.07 -0.27 0.00 -2.02 0.00 0.00 58.31 56.20 2r8y n LYS 135 Cb 0.44 -1.74 0.03 0.00 -0.02 0.00 0.00 35.03 33.74 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 -3.32 3.84 0.17 -0.18 -7.23 -1.14 -4.59 120.40 107.95 2r8y s VAL 136 Ca 0.01 0.10 -0.10 0.00 -1.81 0.00 0.00 61.98 60.18 2r8y s VAL 136 Cb 0.11 -3.52 0.04 0.00 0.56 0.00 0.00 36.38 33.57 2r8y s VAL 136 CO 0.79 -0.56 1.60 1.23 -0.31 0.00 0.00 175.10 177.85 2r8y h GLY 137 N -0.17 1.11 -7.22 2.32 0.00 0.95 -3.41 103.07 96.67 2r8y h GLY 137 Ca -0.45 -0.88 -0.58 0.00 0.00 0.00 0.00 47.33 45.41 2r8y h GLY 137 CO 0.61 0.81 -0.76 -2.27 0.00 0.00 0.00 176.54 174.93 2r8y s LEU 138 N -9.25 2.16 0.05 3.11 2.96 -0.56 -4.91 118.68 112.24 2r8y s LEU 138 Ca -0.12 -1.50 -0.22 0.00 -0.22 0.00 0.00 54.13 52.08 2r8y s LEU 138 Cb 0.13 -0.86 -0.06 0.00 0.50 0.00 0.00 46.19 45.89 2r8y s LEU 138 CO 0.86 -0.39 0.65 -0.94 -1.32 0.00 0.00 176.35 175.22 2r8y s SER 139 N 1.62 7.11 -0.05 3.68 1.04 -1.26 -1.38 113.70 124.46 2r8y s SER 139 Ca 0.07 1.32 0.02 0.00 0.48 0.00 0.00 55.95 57.85 2r8y s SER 139 Cb -0.17 -2.41 0.01 0.00 0.10 0.00 0.00 66.02 63.55 2r8y s SER 139 CO -0.21 0.14 -0.11 -0.69 0.98 0.00 0.00 173.24 173.36 2r8y s VAL 140 N -0.53 0.99 -0.09 5.02 1.01 0.70 -2.02 120.40 125.48 2r8y s VAL 140 Ca 0.33 -0.41 -0.00 0.00 0.00 0.00 0.00 61.98 61.89 2r8y s VAL 140 Cb -0.20 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.24 2r8y s VAL 140 CO 0.20 0.32 -0.06 0.00 0.00 0.00 0.00 175.10 175.57 2r8y s ALA 141 N 0.60 3.02 0.68 5.51 0.00 -0.57 -1.07 121.76 129.93 2r8y s ALA 141 Ca -0.12 -0.86 -0.14 0.00 0.00 0.00 0.00 51.96 50.84 2r8y s ALA 141 Cb -0.14 -1.32 0.01 0.00 0.00 0.00 0.00 23.12 21.66 2r8y s ALA 141 CO 0.03 0.50 1.11 0.14 0.00 0.00 0.00 175.76 177.53 2r8y s VAL 142 N -0.57 3.27 0.29 0.00 -7.23 -0.98 -1.51 120.40 113.67 2r8y s VAL 142 Ca 0.09 0.55 0.03 0.00 -1.81 0.00 0.00 61.98 60.84 2r8y s VAL 142 Cb -0.12 -3.07 0.32 0.00 0.56 0.00 0.00 36.38 34.08 2r8y s VAL 142 CO 0.02 -0.40 1.64 0.00 -0.31 0.00 0.00 175.10 176.04 2r8y h ALA 143 N -0.21 1.32 -0.73 1.32 0.00 -1.54 -1.44 119.26 117.97 2r8y h ALA 143 Ca -0.46 0.24 -0.41 0.00 0.00 0.00 0.00 54.91 54.27 2r8y h ALA 143 Cb 1.24 0.34 -0.24 0.00 0.00 0.00 0.00 17.79 19.14 2r8y h ALA 143 CO 0.54 -0.50 0.31 -0.40 0.00 0.00 0.00 179.25 179.19 2r8y n ASP 144 N -5.25 3.86 -4.63 0.00 5.75 -1.26 -4.99 116.55 110.03 2r8y n ASP 144 Ca 0.22 -3.72 -0.30 0.00 -0.01 0.00 0.00 54.79 50.99 2r8y n ASP 144 Cb 0.72 -0.75 0.18 0.00 -1.03 0.00 0.00 41.12 40.25 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 -3.38 0.93 0.14 2.12 0.00 -0.54 -4.91 121.76 116.12 2r8y s ALA 145 Ca 0.53 0.22 -0.34 0.00 0.00 0.00 0.00 51.96 52.36 2r8y s ALA 145 Cb 0.45 -3.32 -0.15 0.00 0.00 0.00 0.00 23.12 20.10 2r8y s ALA 145 CO 0.04 -2.95 1.41 1.58 0.00 0.00 0.00 175.76 175.85 2r8y n HIS 146 N -4.33 1.85 -0.40 0.00 -0.00 0.62 -4.82 115.22 108.14 2r8y n HIS 146 Ca 0.08 0.48 0.34 0.00 0.46 0.00 0.00 57.72 59.08 2r8y n HIS 146 Cb 0.53 -2.42 0.66 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 4.87 0.14 0.00 1.57 0.11 -1.91 -0.20 132.00 136.59 2r8y h PRO 147 Ca -0.46 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.50 2r8y h PRO 147 Cb 1.30 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 2r8y h PRO 147 CO 0.81 0.09 -0.66 -0.07 -0.21 0.00 0.00 178.00 177.95 2r8y h LEU 148 N 0.14 0.00 -0.32 2.35 3.38 -1.98 -3.26 115.31 115.63 2r8y h LEU 148 Ca 0.68 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.45 2r8y h LEU 148 Cb 2.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.03 2r8y h LEU 148 CO -0.20 0.66 -0.75 0.25 0.09 0.00 0.00 178.44 178.49 2r8y h LEU 149 N 0.00 0.63 -0.52 1.67 5.85 -1.39 -3.39 115.31 118.16 2r8y h LEU 149 Ca -0.01 -0.42 0.10 0.00 0.84 0.00 0.00 57.88 58.40 2r8y h LEU 149 Cb 1.45 -0.19 -0.11 0.00 0.37 0.00 0.00 40.66 42.18 2r8y h LEU 149 CO 0.09 1.18 -0.26 0.40 -0.34 0.00 0.00 178.44 179.51 2r8y h ILE 150 N 0.36 0.28 0.00 4.05 2.04 -1.55 -0.75 117.51 121.93 2r8y h ILE 150 Ca -0.04 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.82 2r8y h ILE 150 Cb 1.35 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 2r8y h ILE 150 CO 0.14 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.48 2r8y n PRO 151 N -5.42 0.08 0.08 2.37 -0.04 -1.26 -3.16 135.00 127.64 2r8y n PRO 151 Ca 0.04 0.16 -0.05 0.00 -0.04 0.00 0.00 63.50 63.61 2r8y n PRO 151 Cb 0.33 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.22 2r8y n PRO 151 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2r8y h ARG 152 N 0.00 0.00 -7.12 0.54 3.08 -1.35 -3.47 114.38 106.06 2r8y h ARG 152 Ca 0.00 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.59 2r8y h ARG 152 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2r8y h ARG 152 CO 0.00 0.89 0.36 0.00 -1.07 0.00 0.00 179.97 180.15 2r8y s ALA 153 N -2.80 3.00 0.21 0.04 0.00 -1.19 -4.99 121.76 116.04 2r8y s ALA 153 Ca 0.01 0.35 -0.10 0.00 0.00 0.00 0.00 51.96 52.23 2r8y s ALA 153 Cb 0.10 -3.16 0.15 0.00 0.00 0.00 0.00 23.12 20.21 2r8y s ALA 153 CO 0.80 -0.12 1.86 -0.44 0.00 0.00 0.00 175.76 177.86 2r8y h ASP 154 N 1.42 0.88 -3.71 0.00 3.45 -1.76 -3.44 116.42 113.27 2r8y h ASP 154 Ca -0.48 -0.05 -0.40 0.00 0.43 0.00 0.00 57.03 56.53 2r8y h ASP 154 Cb 1.19 -0.22 -0.31 0.00 -0.56 0.00 0.00 39.33 39.42 2r8y h ASP 154 CO 0.61 0.67 -0.78 -0.47 -1.57 0.00 0.00 179.24 177.70 2r8y s TYR 155 N -6.05 0.78 -0.19 4.55 5.04 -0.86 -4.94 117.35 115.69 2r8y s TYR 155 Ca -0.13 -0.19 -0.05 0.00 -2.44 0.00 0.00 57.07 54.26 2r8y s TYR 155 Cb 0.15 -0.60 -0.02 0.00 0.35 0.00 0.00 41.96 41.84 2r8y s TYR 155 CO 0.79 -0.11 -0.01 0.08 -1.34 0.00 0.00 175.55 174.95 2r8y s VAL 156 N 0.38 3.88 0.61 3.14 1.01 -1.26 -1.50 120.40 126.65 2r8y s VAL 156 Ca -0.05 -0.34 -0.16 0.00 0.00 0.00 0.00 61.98 61.43 2r8y s VAL 156 Cb -0.09 -2.75 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 2r8y s VAL 156 CO 0.00 0.44 1.08 0.42 0.00 0.00 0.00 175.10 177.04 2r8y s THR 157 N 0.94 3.55 0.09 3.92 -4.23 -0.57 -4.91 115.64 114.43 2r8y s THR 157 Ca 0.01 0.76 0.06 0.00 -1.18 0.00 0.00 61.69 61.34 2r8y s THR 157 Cb -0.14 -3.28 -0.22 0.00 1.34 0.00 0.00 72.50 70.20 2r8y s THR 157 CO 0.02 -0.41 1.16 0.03 -0.54 0.00 0.00 174.62 174.88 2r8y h ARG 158 N 0.42 0.04 -5.89 3.99 -0.00 -1.92 -3.09 114.38 107.94 2r8y h ARG 158 Ca -0.47 -0.07 -0.61 0.00 -0.50 0.00 0.00 59.98 58.33 2r8y h ARG 158 Cb 1.23 0.02 -0.06 0.00 0.00 0.00 0.00 29.97 31.17 2r8y h ARG 158 CO 0.56 0.95 -0.24 0.42 0.00 0.00 0.00 179.97 181.66 2r8y s ILE 159 N -2.68 5.13 0.74 2.04 -1.09 -1.26 -4.79 121.20 119.28 2r8y s ILE 159 Ca -0.01 0.74 -0.12 0.00 -2.23 0.00 0.00 60.65 59.03 2r8y s ILE 159 Cb 0.09 -3.67 0.04 0.00 -1.58 0.00 0.00 42.46 37.34 2r8y s ILE 159 CO 0.83 0.55 1.10 0.00 -1.23 0.00 0.00 174.94 176.18 2r8y s ALA 160 N -0.78 2.31 0.16 9.38 0.00 -1.26 -3.37 121.76 128.20 2r8y s ALA 160 Ca 0.22 0.37 -0.34 0.00 0.00 0.00 0.00 51.96 52.21 2r8y s ALA 160 Cb -0.16 -3.29 -0.14 0.00 0.00 0.00 0.00 23.12 19.53 2r8y s ALA 160 CO 0.11 -1.63 1.55 0.41 0.00 0.00 0.00 175.76 176.20 2r8y n GLY 161 N -0.96 1.06 2.04 0.00 0.00 -1.26 -1.95 105.19 104.12 2r8y n GLY 161 Ca 0.10 0.65 0.00 0.00 0.00 0.00 0.00 46.02 46.77 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 3.30 1.41 0.18 -0.02 0.00 -0.95 -3.84 105.19 105.26 2r8y n GLY 162 Ca 0.17 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.21 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 0.52 0.00 1.61 5.12 -0.82 -4.43 116.66 116.65 2r8y n ARG 163 Ca 0.00 -1.01 0.00 0.00 -1.93 0.00 0.00 57.85 54.91 2r8y n ARG 163 Cb 0.00 -1.08 0.00 0.00 -1.16 0.00 0.00 32.46 30.22 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 0.12 1.73 0.31 -0.13 0.00 -1.23 -4.83 105.19 101.15 2r8y n GLY 164 Ca 0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.00 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 0.98 -0.30 4.61 0.00 -1.69 -1.13 119.26 121.74 2r8y h ALA 165 Ca 0.00 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2r8y h ALA 165 Cb 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2r8y h ALA 165 CO 0.00 0.45 -0.07 0.28 0.00 0.00 0.00 179.25 179.91 2r8y h VAL 166 N 1.05 1.28 -0.89 0.00 2.07 -1.89 -2.43 116.25 115.45 2r8y h VAL 166 Ca 0.28 -1.10 0.11 0.00 0.82 0.00 0.00 66.70 66.80 2r8y h VAL 166 Cb -0.03 1.39 -0.08 0.00 -1.52 0.00 0.00 31.29 31.05 2r8y h VAL 166 CO -0.05 0.35 0.52 -0.09 0.02 0.00 0.00 177.57 178.32 2r8y h ARG 167 N 0.34 0.82 -0.46 1.57 9.65 -1.78 0.16 114.38 124.67 2r8y h ARG 167 Ca 0.08 -0.05 0.05 0.00 -1.10 0.00 0.00 59.98 58.96 2r8y h ARG 167 Cb 0.55 -0.18 -0.05 0.00 -1.39 0.00 0.00 29.97 28.90 2r8y h ARG 167 CO 0.03 0.54 0.20 1.49 2.80 0.00 0.00 179.97 185.03 2r8y h GLU 168 N 0.84 0.39 -0.23 0.20 4.81 -0.94 0.12 114.58 119.77 2r8y h GLU 168 Ca 0.44 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.59 2r8y h GLU 168 Cb 0.43 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2r8y h GLU 168 CO -0.26 0.26 -0.07 0.28 -0.73 0.00 0.00 179.01 178.48 2r8y h VAL 169 N 0.40 1.29 -0.26 0.32 2.07 -0.88 -0.99 116.25 118.21 2r8y h VAL 169 Ca 0.21 -1.09 0.06 0.00 0.82 0.00 0.00 66.70 66.70 2r8y h VAL 169 Cb 0.16 1.54 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 2r8y h VAL 169 CO -0.18 0.33 -0.09 0.00 0.02 0.00 0.00 177.57 177.65 2r8y h ASP 171 N -0.04 0.60 0.04 0.00 3.45 -0.58 -1.51 116.42 118.38 2r8y h ASP 171 Ca 0.13 0.07 -0.00 0.00 0.43 0.00 0.00 57.03 57.66 2r8y h ASP 171 Cb 0.24 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 38.97 2r8y h ASP 171 CO -0.29 0.31 -0.02 0.25 -1.57 0.00 0.00 179.24 177.92 2r8y h LEU 172 N 0.71 -0.04 -0.28 1.55 5.85 -0.58 -0.13 115.31 122.38 2r8y h LEU 172 Ca 0.42 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 59.05 2r8y h LEU 172 Cb 0.48 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 2r8y h LEU 172 CO -0.29 0.08 0.12 -0.07 -0.34 0.00 0.00 178.44 177.94 2r8y h LEU 173 N -0.17 0.17 -0.51 2.25 3.38 -0.89 0.89 115.31 120.43 2r8y h LEU 173 Ca -0.01 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2r8y h LEU 173 Cb 0.15 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2r8y h LEU 173 CO 0.01 0.13 0.26 -0.07 0.09 0.00 0.00 178.44 178.86 2r8y h LEU 174 N 0.27 0.66 -0.43 1.67 3.38 -1.24 -1.03 115.31 118.58 2r8y h LEU 174 Ca 0.12 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2r8y h LEU 174 Cb 0.06 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2r8y h LEU 174 CO -0.10 0.59 0.26 0.25 0.09 0.00 0.00 178.44 179.54 2r8y h LEU 175 N 0.68 0.51 -1.63 1.67 5.85 -0.71 0.53 115.31 122.22 2r8y h LEU 175 Ca 0.18 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 2r8y h LEU 175 Cb 0.10 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 2r8y h LEU 175 CO -0.02 0.41 -0.07 0.00 -0.34 0.00 0.00 178.44 178.41 2r8y h ALA 176 N 1.12 1.70 -0.63 1.25 0.00 -0.51 -2.40 119.26 119.79 2r8y h ALA 176 Ca 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2r8y h ALA 176 Cb -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2r8y h ALA 176 CO -0.03 0.23 0.00 1.04 0.00 0.00 0.00 179.25 180.49 2r8y n GLN 177 N -4.37 2.53 -2.31 0.00 6.02 -0.42 -4.56 117.38 114.28 2r8y n GLN 177 Ca -0.01 -2.38 -0.14 0.00 -0.01 0.00 0.00 57.00 54.46 2r8y n GLN 177 Cb 0.20 -1.52 -0.00 0.00 1.02 0.00 0.00 30.24 29.94 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 1.55 -0.22 0.11 1.08 0.00 -0.74 -4.92 105.19 102.06 2r8y n GLY 178 Ca 0.22 -0.27 0.03 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.42 2.70 -0.11 1.61 5.02 0.18 -4.77 118.16 120.36 2r8y n LYS 179 Ca -0.16 -0.40 -0.10 0.00 -2.02 0.00 0.00 58.31 55.62 2r8y n LYS 179 Cb 0.63 -0.92 -0.02 0.00 -0.02 0.00 0.00 35.03 34.70 2r8y n LYS 179 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2r8y h LEU 180 N 0.53 0.54 -2.01 -0.35 5.85 -1.80 -1.47 115.31 116.60 2r8y h LEU 180 Ca 0.00 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.45 2r8y h LEU 180 Cb 0.18 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 2r8y h LEU 180 CO 0.00 0.67 -0.01 0.44 -0.34 0.00 0.00 178.44 179.21 2r8y h ASP 181 N 0.39 0.00 -0.07 1.25 3.32 -1.90 -2.98 116.42 116.42 2r8y h ASP 181 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2r8y h ASP 181 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 2r8y h ASP 181 CO 0.01 0.01 0.00 -0.62 -1.72 0.00 0.00 179.24 176.92 2r8y n GLU 182 N -4.49 0.86 -2.15 3.56 -0.58 -1.14 -5.03 120.64 111.67 2r8y n GLU 182 Ca -0.03 -1.26 -0.40 0.00 -0.42 0.00 0.00 57.16 55.05 2r8y n GLU 182 Cb 0.10 -1.20 -0.02 0.00 -0.57 0.00 0.00 31.44 29.75 2r8y n GLU 182 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2r8y s ALA 183 N -0.85 3.37 -0.08 0.62 0.00 -0.57 -5.03 121.76 119.22 2r8y s ALA 183 Ca 0.13 1.19 0.02 0.00 0.00 0.00 0.00 51.96 53.30 2r8y s ALA 183 Cb 0.09 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 19.76 2r8y s ALA 183 CO 0.13 -0.64 -0.14 0.15 0.00 0.00 0.00 175.76 175.25 2r8y s LYS 184 N -1.97 1.99 0.19 0.00 -0.14 -1.26 -5.05 119.74 113.50 2r8y s LYS 184 Ca 0.52 -0.50 0.04 0.00 -1.36 0.00 0.00 55.97 54.67 2r8y s LYS 184 Cb -0.37 -1.65 -0.01 0.00 -1.68 0.00 0.00 37.83 34.12 2r8y s LYS 184 CO 0.49 0.01 0.14 0.41 -0.76 0.00 0.00 175.35 175.64 2r8y n GLY 185 N 3.93 3.45 2.98 -3.33 0.00 -1.26 -3.89 105.19 107.07 2r8y n GLY 185 Ca -0.21 -1.83 -0.22 0.00 0.00 0.00 0.00 46.02 43.76 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 -2.77 1.27 -0.87 1.61 1.11 -1.26 -4.99 119.66 113.77 2r8y s GLN 186 Ca 0.20 -0.30 -0.24 0.00 0.01 0.00 0.00 55.36 55.03 2r8y s GLN 186 Cb 0.01 -1.12 0.06 0.00 -1.01 0.00 0.00 33.01 30.94 2r8y s GLN 186 CO 0.14 0.02 1.30 0.45 0.01 0.00 0.00 175.29 177.21 2r8y s SER 187 N 0.60 6.36 0.00 5.90 0.15 -1.26 -2.62 113.70 122.83 2r8y s SER 187 Ca -0.11 -1.13 0.00 0.00 0.70 0.00 0.00 55.95 55.41 2r8y s SER 187 Cb -0.14 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.65 2r8y s SER 187 CO 0.02 -1.56 0.00 2.30 1.20 0.00 0.00 173.24 175.20