#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r8x s ALA 9 N 0.00 3.51 0.46 1.47 0.00 -1.26 -0.00 121.76 125.94 2r8x s ALA 9 Ca 0.00 -0.28 0.03 0.00 0.00 0.00 0.00 51.96 51.71 2r8x s ALA 9 Cb 0.00 -2.56 -0.03 0.00 0.00 0.00 0.00 23.12 20.53 2r8x s ALA 9 CO 0.00 0.03 0.03 0.95 0.00 0.00 0.00 175.76 176.77 2r8x s THR 10 N 0.57 1.23 -2.00 0.00 -4.23 -1.12 -4.95 115.64 105.13 2r8x s THR 10 Ca 0.23 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 59.04 2r8x s THR 10 Cb -0.14 -2.40 0.73 0.00 1.34 0.00 0.00 72.50 72.03 2r8x s THR 10 CO 0.08 0.00 2.06 0.00 -0.54 0.00 0.00 174.62 176.22 2r8x n TYR 12 N -0.77 0.00 0.00 0.00 4.02 -1.26 -5.10 117.16 114.05 2r8x n TYR 12 Ca 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.10 2r8x n TYR 12 Cb 0.20 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.52 2r8x n TYR 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2r8x n GLY 13 N 0.94 2.68 3.75 2.72 0.00 -1.18 -4.93 105.19 109.15 2r8x n GLY 13 Ca 0.05 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 2r8x n GLY 13 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2r8x s PRO 14 N -1.93 4.47 0.24 1.61 0.02 -1.26 -2.81 135.00 135.34 2r8x s PRO 14 Ca 0.00 1.95 0.10 0.00 0.02 0.00 0.00 61.00 63.08 2r8x s PRO 14 Cb 0.00 -3.20 -0.04 0.00 0.02 0.00 0.00 34.50 31.28 2r8x s PRO 14 CO 0.00 -0.09 -0.12 0.14 -0.33 0.00 0.00 177.00 176.60 2r8x s VAL 15 N -0.34 2.96 0.72 3.83 -7.23 1.00 -4.95 120.40 116.38 2r8x s VAL 15 Ca 0.52 -1.99 -0.11 0.00 -1.81 0.00 0.00 61.98 58.59 2r8x s VAL 15 Cb -0.34 -2.52 0.02 0.00 0.56 0.00 0.00 36.38 34.10 2r8x s VAL 15 CO 0.40 -0.27 1.07 -0.94 -0.31 0.00 0.00 175.10 175.05 2r8x s SER 16 N -3.25 5.18 0.47 4.85 1.04 -1.26 -4.59 113.70 116.14 2r8x s SER 16 Ca 0.28 1.53 0.24 0.00 0.48 0.00 0.00 55.95 58.47 2r8x s SER 16 Cb -0.07 -2.37 1.17 0.00 0.10 0.00 0.00 66.02 64.85 2r8x s SER 16 CO 0.16 -1.56 1.96 0.00 0.98 0.00 0.00 173.24 174.77 2r8x h ALA 17 N -0.80 1.21 -0.05 5.32 0.00 -1.99 -2.64 119.26 120.31 2r8x h ALA 17 Ca -0.45 -0.18 -0.24 0.00 0.00 0.00 0.00 54.91 54.04 2r8x h ALA 17 Cb 1.23 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 19.00 2r8x h ALA 17 CO 0.58 0.24 -0.91 0.22 0.00 0.00 0.00 179.25 179.38 2r8x h ASP 18 N 0.00 0.89 -0.49 0.00 3.58 -1.99 -2.27 116.42 116.14 2r8x h ASP 18 Ca -0.00 -0.71 -0.09 0.00 0.42 0.00 0.00 57.03 56.66 2r8x h ASP 18 Cb 0.52 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.28 2r8x h ASP 18 CO 0.03 1.47 -0.03 0.58 -2.88 0.00 0.00 179.24 178.40 2r8x h VAL 19 N 0.39 1.27 -0.58 2.25 2.07 -1.90 -2.04 116.25 117.70 2r8x h VAL 19 Ca -0.10 -1.13 -0.05 0.00 0.82 0.00 0.00 66.70 66.25 2r8x h VAL 19 Cb 1.57 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 32.32 2r8x h VAL 19 CO 0.18 0.39 0.18 -0.03 0.02 0.00 0.00 177.57 178.31 2r8x h MET 20 N 0.75 0.88 -0.55 1.57 1.85 -1.52 -1.17 114.93 116.74 2r8x h MET 20 Ca 0.14 -0.17 -0.10 0.00 -0.61 0.00 0.00 59.70 58.96 2r8x h MET 20 Cb 0.56 -0.14 -0.02 0.00 0.43 0.00 0.00 31.60 32.43 2r8x h MET 20 CO 0.03 0.76 -0.06 0.00 -0.40 0.00 0.00 176.91 177.24 2r8x h ALA 21 N 1.34 0.86 -0.41 0.39 0.00 -1.26 -2.07 119.26 118.10 2r8x h ALA 21 Ca 0.19 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2r8x h ALA 21 Cb 0.26 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2r8x h ALA 21 CO -0.01 0.66 0.16 0.87 0.00 0.00 0.00 179.25 180.93 2r8x h LYS 22 N 0.89 0.61 0.00 0.00 1.57 -0.98 -2.94 116.57 115.72 2r8x h LYS 22 Ca 0.15 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2r8x h LYS 22 Cb 0.60 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2r8x h LYS 22 CO 0.04 0.57 0.00 0.00 -0.57 0.00 0.00 179.45 179.49 2r8x h ALA 23 N 1.01 1.00 0.00 3.86 0.00 -1.10 -2.98 119.26 121.05 2r8x h ALA 23 Ca 0.14 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2r8x h ALA 23 Cb 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2r8x h ALA 23 CO -0.01 0.00 -0.39 1.49 0.00 0.00 0.00 179.25 180.34 2r8x h GLU 24 N 0.00 0.00 -0.14 0.00 4.22 -1.18 -3.22 114.58 114.25 2r8x h GLU 24 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2r8x h GLU 24 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2r8x h GLU 24 CO 0.00 0.39 0.00 0.09 -2.18 0.00 0.00 179.01 177.31 2r8x n ASN 25 N -3.73 3.06 -4.69 1.04 5.03 -1.12 -4.75 115.26 110.08 2r8x n ASN 25 Ca -0.01 -1.96 -0.42 0.00 0.87 0.00 0.00 54.58 53.06 2r8x n ASN 25 Cb 0.47 -0.08 -0.03 0.00 -1.02 0.00 0.00 39.78 39.12 2r8x n ASN 25 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2r8x s ILE 26 N -1.75 4.00 -0.02 2.41 -1.09 -1.22 -4.45 121.20 119.09 2r8x s ILE 26 Ca 0.30 1.37 0.05 0.00 -2.23 0.00 0.00 60.65 60.15 2r8x s ILE 26 Cb 0.20 -3.88 -0.08 0.00 -1.58 0.00 0.00 42.46 37.12 2r8x s ILE 26 CO 0.29 0.03 0.10 0.54 -1.23 0.00 0.00 174.94 174.66 2r8x n ARG 27 N 4.94 0.92 -4.60 2.79 5.12 0.11 -4.94 116.66 121.00 2r8x n ARG 27 Ca 0.11 -0.04 -0.25 0.00 -1.93 0.00 0.00 57.85 55.74 2r8x n ARG 27 Cb 0.45 -1.13 -0.17 0.00 -1.16 0.00 0.00 32.46 30.45 2r8x n ARG 27 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2r8x s LEU 28 N -3.64 1.66 -0.26 0.55 2.96 -0.98 -0.92 118.68 118.06 2r8x s LEU 28 Ca -0.02 -0.31 -0.05 0.00 -0.22 0.00 0.00 54.13 53.53 2r8x s LEU 28 Cb 0.03 -0.85 0.01 0.00 0.50 0.00 0.00 46.19 45.87 2r8x s LEU 28 CO 0.23 0.04 0.02 -0.22 -1.32 0.00 0.00 176.35 175.09 2r8x s LEU 29 N 0.67 3.44 -0.17 -0.68 2.96 0.03 -0.12 118.68 124.81 2r8x s LEU 29 Ca -0.14 -0.65 -0.08 0.00 -0.22 0.00 0.00 54.13 53.03 2r8x s LEU 29 Cb -0.16 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 2r8x s LEU 29 CO 0.04 -0.13 0.11 -0.63 -1.32 0.00 0.00 176.35 174.42 2r8x s ILE 30 N 1.46 5.23 -0.04 6.68 1.01 0.17 -0.17 121.20 135.53 2r8x s ILE 30 Ca 0.03 0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.84 2r8x s ILE 30 Cb -0.16 -3.35 -0.00 0.00 0.01 0.00 0.00 42.46 38.96 2r8x s ILE 30 CO -0.01 0.50 -0.17 -0.76 0.00 0.00 0.00 174.94 174.50 2r8x s LEU 31 N -0.03 1.92 0.51 2.97 1.43 0.23 -1.90 118.68 123.82 2r8x s LEU 31 Ca 0.09 -0.35 -0.17 0.00 -1.03 0.00 0.00 54.13 52.66 2r8x s LEU 31 Cb -0.12 -0.97 -0.08 0.00 0.03 0.00 0.00 46.19 45.05 2r8x s LEU 31 CO 0.00 0.16 0.99 -0.62 0.23 0.00 0.00 176.35 177.10 2r8x s ASP 32 N 0.01 6.61 -0.03 2.29 3.68 -1.18 -1.98 116.67 126.08 2r8x s ASP 32 Ca -0.03 1.61 -0.01 0.00 2.13 0.00 0.00 52.55 56.24 2r8x s ASP 32 Cb -0.11 -2.52 -0.00 0.00 -1.45 0.00 0.00 42.92 38.84 2r8x s ASP 32 CO 0.02 -0.60 -0.02 0.58 0.13 0.00 0.00 175.17 175.28 2r8x h VAL 33 N 1.04 0.00 -2.88 1.11 2.07 -1.93 -3.28 116.25 112.38 2r8x h VAL 33 Ca -0.47 -0.23 -0.56 0.00 0.82 0.00 0.00 66.70 66.26 2r8x h VAL 33 Cb 1.19 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 2r8x h VAL 33 CO 0.61 0.00 0.96 -1.81 0.02 0.00 0.00 177.57 177.35 2r8x s ASP 34 N -3.84 6.83 0.00 0.57 1.01 -1.26 -0.51 116.67 119.47 2r8x s ASP 34 Ca -0.02 1.71 0.00 0.00 0.71 0.00 0.00 52.55 54.95 2r8x s ASP 34 Cb 0.00 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.40 2r8x s ASP 34 CO 0.03 -0.86 0.00 0.61 0.21 0.00 0.00 175.17 175.16 2r8x n GLY 35 N 3.85 0.59 1.15 0.21 0.00 -1.06 -4.80 105.19 105.12 2r8x n GLY 35 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2r8x n GLY 35 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2r8x n VAL 36 N -2.00 0.90 0.42 1.61 0.31 -1.03 -4.13 118.33 114.40 2r8x n VAL 36 Ca 0.00 0.30 0.12 0.00 -0.01 0.00 0.00 64.34 64.75 2r8x n VAL 36 Cb 0.00 -1.45 0.20 0.00 -0.91 0.00 0.00 33.84 31.68 2r8x n VAL 36 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2r8x h LEU 37 N 0.00 0.00 -9.45 7.52 3.38 -0.85 0.13 115.31 116.04 2r8x h LEU 37 Ca 0.00 -0.07 -0.54 0.00 0.09 0.00 0.00 57.88 57.36 2r8x h LEU 37 Cb 0.16 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.78 2r8x h LEU 37 CO 0.00 0.04 -0.57 -0.94 0.09 0.00 0.00 178.44 177.06 2r8x s SER 38 N -4.94 2.91 0.00 -0.43 1.04 -0.90 -4.15 113.70 107.23 2r8x s SER 38 Ca 0.06 -1.49 0.13 0.00 0.48 0.00 0.00 55.95 55.13 2r8x s SER 38 Cb 0.11 0.10 0.64 0.00 0.10 0.00 0.00 66.02 66.96 2r8x s SER 38 CO 0.69 -0.70 1.43 -0.90 0.98 0.00 0.00 173.24 174.74 2r8x n ASP 39 N -0.96 0.51 0.00 7.02 3.85 -1.23 -2.56 116.55 123.18 2r8x n ASP 39 Ca -0.06 -1.70 0.00 0.00 -0.71 0.00 0.00 54.79 52.32 2r8x n ASP 39 Cb 0.66 -0.05 0.00 0.00 -1.35 0.00 0.00 41.12 40.39 2r8x n ASP 39 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2r8x n GLY 40 N 0.80 0.30 3.78 6.12 0.00 -1.26 -4.68 105.19 110.25 2r8x n GLY 40 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2r8x n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r8x s LEU 41 N 0.00 4.51 -0.21 0.99 1.43 -1.26 -4.76 118.68 119.38 2r8x s LEU 41 Ca 0.00 1.66 0.01 0.00 -1.03 0.00 0.00 54.13 54.77 2r8x s LEU 41 Cb 0.00 -3.50 0.03 0.00 0.03 0.00 0.00 46.19 42.75 2r8x s LEU 41 CO 0.00 0.12 -0.17 -0.63 0.23 0.00 0.00 176.35 175.91 2r8x s ILE 42 N -1.31 2.15 -0.18 -0.59 -1.09 -1.26 -4.75 121.20 114.16 2r8x s ILE 42 Ca 0.40 -1.14 -0.18 0.00 -2.23 0.00 0.00 60.65 57.50 2r8x s ILE 42 Cb -0.21 -2.02 -0.03 0.00 -1.58 0.00 0.00 42.46 38.61 2r8x s ILE 42 CO 0.25 0.36 0.50 -0.31 -1.23 0.00 0.00 174.94 174.51 2r8x s TYR 43 N 1.24 3.40 0.01 3.97 1.51 -1.00 -4.99 117.35 121.49 2r8x s TYR 43 Ca 0.01 0.78 0.05 0.00 -1.01 0.00 0.00 57.07 56.90 2r8x s TYR 43 Cb -0.15 -2.63 -0.02 0.00 -0.11 0.00 0.00 41.96 39.05 2r8x s TYR 43 CO -0.10 -0.04 -0.15 -1.64 -1.11 0.00 0.00 175.55 172.51 2r8x s MET 44 N 1.41 1.14 0.37 -0.62 -1.94 -1.26 -1.38 119.30 117.02 2r8x s MET 44 Ca 0.24 -0.65 0.08 0.00 -1.71 0.00 0.00 55.69 53.65 2r8x s MET 44 Cb -0.15 -1.14 -0.07 0.00 2.01 0.00 0.00 34.83 35.48 2r8x s MET 44 CO 0.10 0.30 -0.05 0.20 -0.01 0.00 0.00 175.02 175.56 2r8x s GLY 45 N -0.69 2.30 0.35 -0.03 0.00 -0.38 -4.96 107.32 103.90 2r8x s GLY 45 Ca 0.05 -2.17 0.08 0.00 0.00 0.00 0.00 44.72 42.68 2r8x s GLY 45 CO 0.00 -2.04 1.83 3.43 0.00 0.00 0.00 173.10 176.32 2r8x h ASN 46 N 1.94 0.22 -0.31 1.64 2.35 -2.02 -2.17 115.58 117.23 2r8x h ASN 46 Ca -0.43 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.26 2r8x h ASN 46 Cb 1.24 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.55 2r8x h ASN 46 CO 0.74 0.48 0.00 0.59 -1.65 0.00 0.00 177.43 177.60 2r8x n ASN 47 N -4.17 2.34 0.00 5.81 5.03 -1.26 -4.88 115.26 118.13 2r8x n ASN 47 Ca -0.01 -2.17 0.00 0.00 0.87 0.00 0.00 54.58 53.27 2r8x n ASN 47 Cb 0.36 -0.37 0.00 0.00 -1.02 0.00 0.00 39.78 38.75 2r8x n ASN 47 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2r8x n GLY 48 N 0.74 0.57 3.76 7.41 0.00 -0.82 -5.04 105.19 111.82 2r8x n GLY 48 Ca 0.12 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 2r8x n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2r8x s GLU 49 N -0.83 3.40 -0.04 1.61 8.01 -1.25 -4.81 118.70 124.80 2r8x s GLU 49 Ca 0.00 1.86 -0.00 0.00 0.01 0.00 0.00 54.97 56.84 2r8x s GLU 49 Cb 0.00 -2.21 0.03 0.00 -4.31 0.00 0.00 34.13 27.63 2r8x s GLU 49 CO 0.00 -0.87 0.01 -2.00 0.01 0.00 0.00 175.26 172.41 2r8x s GLU 50 N -2.96 0.23 0.17 1.61 2.12 -1.26 -1.25 118.70 117.36 2r8x s GLU 50 Ca 0.70 0.15 0.11 0.00 0.36 0.00 0.00 54.97 56.28 2r8x s GLU 50 Cb -0.31 -0.52 -0.04 0.00 0.26 0.00 0.00 34.13 33.52 2r8x s GLU 50 CO 0.36 -0.19 -0.23 -0.51 -0.54 0.00 0.00 175.26 174.15 2r8x s LEU 51 N 1.35 2.48 -0.02 2.70 1.43 -0.48 -4.97 118.68 121.17 2r8x s LEU 51 Ca -0.05 -0.78 -0.04 0.00 -1.03 0.00 0.00 54.13 52.23 2r8x s LEU 51 Cb -0.13 -1.26 0.00 0.00 0.03 0.00 0.00 46.19 44.83 2r8x s LEU 51 CO -0.03 0.14 0.08 -0.75 0.23 0.00 0.00 176.35 176.03 2r8x s LYS 52 N -2.46 0.22 -0.10 1.70 2.20 -1.26 -2.37 119.74 117.68 2r8x s LYS 52 Ca 0.19 -0.11 -0.09 0.00 -0.36 0.00 0.00 55.97 55.60 2r8x s LYS 52 Cb -0.09 0.09 -0.04 0.00 -1.51 0.00 0.00 37.83 36.28 2r8x s LYS 52 CO 0.09 -0.04 0.19 0.00 -0.36 0.00 0.00 175.35 175.23 2r8x s ALA 53 N -0.51 3.84 0.22 3.13 0.00 -1.26 -5.11 121.76 122.08 2r8x s ALA 53 Ca -0.06 -0.56 0.07 0.00 0.00 0.00 0.00 51.96 51.42 2r8x s ALA 53 Cb -0.04 -2.05 -0.05 0.00 0.00 0.00 0.00 23.12 20.98 2r8x s ALA 53 CO 0.00 0.59 -0.12 -0.06 0.00 0.00 0.00 175.76 176.17 2r8x s PHE 54 N -1.03 1.78 -0.16 0.00 0.40 -1.26 -4.27 117.98 113.43 2r8x s PHE 54 Ca 0.17 -0.60 -0.04 0.00 -0.60 0.00 0.00 56.93 55.85 2r8x s PHE 54 Cb -0.13 -0.87 -0.03 0.00 0.51 0.00 0.00 43.02 42.50 2r8x s PHE 54 CO 0.06 0.34 -0.02 1.21 0.70 0.00 0.00 175.22 177.51 2r8x s ASN 55 N -3.35 4.92 0.46 1.36 3.04 -1.26 -5.00 114.94 115.11 2r8x s ASN 55 Ca 0.24 -0.11 0.17 0.00 0.04 0.00 0.00 52.86 53.20 2r8x s ASN 55 Cb 0.00 -1.81 1.08 0.00 -1.54 0.00 0.00 41.25 38.98 2r8x s ASN 55 CO 0.08 0.16 2.01 -0.37 -3.04 0.00 0.00 177.10 175.94 2r8x h VAL 56 N 5.13 1.04 -0.48 -5.21 -1.51 -1.93 -1.11 116.25 112.17 2r8x h VAL 56 Ca -0.32 -0.60 -0.12 0.00 -1.23 0.00 0.00 66.70 64.43 2r8x h VAL 56 Cb 1.19 1.33 -0.02 0.00 -2.13 0.00 0.00 31.29 31.66 2r8x h VAL 56 CO 0.64 0.17 -0.18 -0.09 -1.23 0.00 0.00 177.57 176.88 2r8x h ARG 57 N 0.00 0.95 -0.62 5.19 2.43 -1.94 -0.35 114.38 120.04 2r8x h ARG 57 Ca -0.00 -0.38 -0.05 0.00 -0.81 0.00 0.00 59.98 58.74 2r8x h ARG 57 Cb 0.32 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.79 2r8x h ARG 57 CO 0.02 1.05 0.19 -0.44 -1.51 0.00 0.00 179.97 179.28 2r8x h ASP 58 N 0.83 0.87 -0.10 -3.80 3.32 -1.74 -2.52 116.42 113.28 2r8x h ASP 58 Ca 0.12 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.02 2r8x h ASP 58 Cb 0.74 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 2r8x h ASP 58 CO 0.06 0.82 0.06 1.23 -1.72 0.00 0.00 179.24 179.69 2r8x h GLY 59 N 1.02 0.13 0.75 2.75 0.00 -0.68 -1.61 103.07 105.44 2r8x h GLY 59 Ca 0.20 -0.05 0.05 0.00 0.00 0.00 0.00 47.33 47.53 2r8x h GLY 59 CO -0.01 0.05 0.41 -1.82 0.00 0.00 0.00 176.54 175.17 2r8x h TYR 60 N 0.13 0.75 -0.41 5.60 5.03 -0.98 -0.85 116.97 126.24 2r8x h TYR 60 Ca 0.03 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.36 2r8x h TYR 60 Cb -0.01 -0.24 -0.02 0.00 1.55 0.00 0.00 36.73 38.01 2r8x h TYR 60 CO -0.07 0.39 0.23 0.78 -1.32 0.00 0.00 178.16 178.16 2r8x h GLY 61 N 0.76 0.62 1.01 1.82 0.00 -1.27 -1.16 103.07 104.84 2r8x h GLY 61 Ca 0.30 -0.28 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 2r8x h GLY 61 CO -0.16 0.27 0.17 -2.22 0.00 0.00 0.00 176.54 174.60 2r8x h ILE 62 N 0.54 1.25 -0.34 2.60 2.04 -0.94 -1.32 117.51 121.33 2r8x h ILE 62 Ca 0.15 -0.86 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 2r8x h ILE 62 Cb 0.05 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 2r8x h ILE 62 CO -0.02 0.32 0.08 0.03 0.00 0.00 0.00 178.15 178.56 2r8x h ARG 63 N 0.85 0.49 -0.38 2.37 2.47 -1.00 -0.62 114.38 118.56 2r8x h ARG 63 Ca 0.19 -0.08 -0.11 0.00 -1.26 0.00 0.00 59.98 58.72 2r8x h ARG 63 Cb 0.31 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.54 2r8x h ARG 63 CO -0.00 0.46 -0.19 0.00 0.56 0.00 0.00 179.97 180.79 2r8x h ALA 65 N 0.80 0.10 -0.85 0.00 0.00 -0.72 -2.16 119.26 116.44 2r8x h ALA 65 Ca 0.09 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2r8x h ALA 65 Cb 0.74 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 2r8x h ALA 65 CO 0.06 -0.22 0.42 -0.07 0.00 0.00 0.00 179.25 179.44 2r8x h LEU 66 N -0.17 1.10 -0.02 0.00 3.38 -0.96 -0.22 115.31 118.41 2r8x h LEU 66 Ca 0.02 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2r8x h LEU 66 Cb 0.35 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2r8x h LEU 66 CO 0.00 0.91 -0.09 0.35 0.09 0.00 0.00 178.44 179.70 2r8x n THR 67 N -4.31 0.00 -1.92 0.22 -2.24 -1.10 -3.75 114.28 101.18 2r8x n THR 67 Ca 0.09 -0.01 -0.28 0.00 -2.27 0.00 0.00 64.05 61.58 2r8x n THR 67 Cb 0.13 -0.34 0.03 0.00 -2.10 0.00 0.00 70.33 68.05 2r8x n THR 67 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2r8x n SER 68 N -1.43 5.71 -3.69 3.42 7.64 -0.79 -4.95 113.62 119.53 2r8x n SER 68 Ca 0.08 -3.76 -0.26 0.00 1.01 0.00 0.00 58.87 55.95 2r8x n SER 68 Cb 0.32 -0.55 0.06 0.00 -1.01 0.00 0.00 64.21 63.03 2r8x n SER 68 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2r8x n ASP 69 N -0.71 -5.63 -3.78 6.43 4.64 -1.19 -4.93 116.55 111.38 2r8x n ASP 69 Ca 0.48 -0.62 -0.27 0.00 -1.38 0.00 0.00 54.79 52.99 2r8x n ASP 69 Cb 0.80 -4.66 -0.16 0.00 -1.04 0.00 0.00 41.12 36.05 2r8x n ASP 69 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2r8x s ILE 70 N -3.32 0.69 0.35 5.18 1.01 -0.16 -4.86 121.20 120.09 2r8x s ILE 70 Ca 0.58 -0.57 -0.26 0.00 0.00 0.00 0.00 60.65 60.40 2r8x s ILE 70 Cb -0.27 -1.09 -0.09 0.00 0.01 0.00 0.00 42.46 41.02 2r8x s ILE 70 CO 0.76 -0.11 1.09 -1.61 0.00 0.00 0.00 174.94 175.08 2r8x s GLU 71 N 1.79 4.32 -0.14 2.79 0.41 -0.09 -2.82 118.70 124.95 2r8x s GLU 71 Ca -0.01 1.69 0.00 0.00 -0.41 0.00 0.00 54.97 56.25 2r8x s GLU 71 Cb -0.17 -2.81 -0.01 0.00 -1.78 0.00 0.00 34.13 29.37 2r8x s GLU 71 CO -0.07 -0.05 -0.15 0.08 -0.49 0.00 0.00 175.26 174.58 2r8x s VAL 72 N -1.42 2.77 0.19 2.63 1.01 -1.26 -0.79 120.40 123.53 2r8x s VAL 72 Ca 0.53 -0.74 0.10 0.00 0.00 0.00 0.00 61.98 61.86 2r8x s VAL 72 Cb -0.28 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 2r8x s VAL 72 CO 0.35 0.52 -0.20 0.00 0.00 0.00 0.00 175.10 175.76 2r8x s ALA 73 N 0.65 2.26 -0.05 5.51 0.00 0.76 -4.37 121.76 126.52 2r8x s ALA 73 Ca -0.08 -1.58 0.02 0.00 0.00 0.00 0.00 51.96 50.32 2r8x s ALA 73 Cb -0.16 -0.24 0.02 0.00 0.00 0.00 0.00 23.12 22.74 2r8x s ALA 73 CO 0.02 0.30 -0.08 0.42 0.00 0.00 0.00 175.76 176.42 2r8x s ILE 74 N -1.99 0.81 -0.13 0.00 1.01 -0.85 -0.60 121.20 119.45 2r8x s ILE 74 Ca 0.19 -0.30 -0.00 0.00 0.00 0.00 0.00 60.65 60.54 2r8x s ILE 74 Cb -0.06 -0.77 0.03 0.00 0.01 0.00 0.00 42.46 41.67 2r8x s ILE 74 CO 0.08 0.28 -0.09 -0.63 0.00 0.00 0.00 174.94 174.58 2r8x s ILE 75 N 0.72 1.19 0.03 2.92 1.01 -0.84 -1.09 121.20 125.14 2r8x s ILE 75 Ca -0.12 -0.44 0.02 0.00 0.00 0.00 0.00 60.65 60.11 2r8x s ILE 75 Cb -0.14 -1.20 -0.02 0.00 0.01 0.00 0.00 42.46 41.10 2r8x s ILE 75 CO 0.02 0.35 -0.08 0.28 0.00 0.00 0.00 174.94 175.51 2r8x s THR 76 N 1.64 0.57 -0.30 2.92 -1.32 -0.42 -4.19 115.64 114.53 2r8x s THR 76 Ca 0.04 -0.85 0.26 0.00 -1.21 0.00 0.00 61.69 59.93 2r8x s THR 76 Cb -0.13 -0.59 0.35 0.00 -1.51 0.00 0.00 72.50 70.62 2r8x s THR 76 CO -0.09 -0.21 1.72 1.23 -2.21 0.00 0.00 174.62 175.06 2r8x h GLY 77 N 4.93 0.00 -2.49 6.08 0.00 -1.87 -0.01 103.07 109.72 2r8x h GLY 77 Ca -0.34 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.54 2r8x h GLY 77 CO 0.43 0.00 -0.19 0.50 0.00 0.00 0.00 176.54 177.28 2r8x s ARG 78 N -3.33 3.14 -0.08 4.80 0.52 -1.26 -3.84 118.95 118.90 2r8x s ARG 78 Ca 0.05 -0.64 0.00 0.00 -0.52 0.00 0.00 55.73 54.63 2r8x s ARG 78 Cb 0.06 -2.66 0.02 0.00 0.52 0.00 0.00 34.95 32.89 2r8x s ARG 78 CO 0.63 -0.10 -0.06 0.21 0.02 0.00 0.00 175.30 176.00 2r8x s LYS 79 N -4.39 1.17 -0.05 3.54 2.20 -1.26 -1.05 119.74 119.90 2r8x s LYS 79 Ca 0.46 -0.17 -0.13 0.00 -0.36 0.00 0.00 55.97 55.77 2r8x s LYS 79 Cb -0.10 -1.21 0.02 0.00 -1.51 0.00 0.00 37.83 35.04 2r8x s LYS 79 CO 0.35 -0.16 0.30 0.00 -0.36 0.00 0.00 175.35 175.48 2r8x s ALA 80 N 1.33 -0.75 0.31 3.13 0.00 -1.26 -5.01 121.76 119.52 2r8x s ALA 80 Ca -0.03 0.49 0.06 0.00 0.00 0.00 0.00 51.96 52.47 2r8x s ALA 80 Cb -0.14 -0.13 0.51 0.00 0.00 0.00 0.00 23.12 23.37 2r8x s ALA 80 CO -0.03 -0.22 1.75 -0.22 0.00 0.00 0.00 175.76 177.04 2r8x h LYS 81 N 4.51 0.30 0.00 0.00 1.63 -2.00 -3.06 116.57 117.95 2r8x h LYS 81 Ca -0.29 -0.12 -0.03 0.00 -0.85 0.00 0.00 60.65 59.37 2r8x h LYS 81 Cb 1.18 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.79 2r8x h LYS 81 CO 0.37 0.59 -0.13 1.37 -3.45 0.00 0.00 179.45 178.19 2r8x h LEU 82 N 0.26 0.00 -0.39 5.20 8.10 -1.96 -2.10 115.31 124.42 2r8x h LEU 82 Ca 0.03 0.00 -0.18 0.00 0.11 0.00 0.00 57.88 57.85 2r8x h LEU 82 Cb 0.69 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.91 2r8x h LEU 82 CO 0.05 0.13 -0.55 0.58 -4.11 0.00 0.00 178.44 174.55 2r8x h VAL 83 N 0.00 1.29 -0.85 0.15 2.07 -1.97 -1.28 116.25 115.66 2r8x h VAL 83 Ca -0.00 -1.76 -0.03 0.00 0.82 0.00 0.00 66.70 65.73 2r8x h VAL 83 Cb 0.26 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 2r8x h VAL 83 CO 0.02 0.56 0.41 -0.33 0.02 0.00 0.00 177.57 178.25 2r8x h GLU 84 N 0.57 1.22 -0.50 1.57 5.08 -1.48 -1.67 114.58 119.37 2r8x h GLU 84 Ca 0.01 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.10 2r8x h GLU 84 Cb 1.13 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 2r8x h GLU 84 CO 0.11 0.94 -0.06 -0.44 -1.00 0.00 0.00 179.01 178.56 2r8x h ASP 85 N 1.21 0.86 -0.31 1.42 3.32 -1.24 -2.35 116.42 119.34 2r8x h ASP 85 Ca 0.29 -0.25 -0.09 0.00 0.02 0.00 0.00 57.03 57.00 2r8x h ASP 85 Cb 0.12 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 2r8x h ASP 85 CO -0.04 0.96 -0.17 -0.09 -1.72 0.00 0.00 179.24 178.18 2r8x h ARG 86 N 0.80 0.65 -0.89 3.56 9.65 -0.97 -2.56 114.38 124.63 2r8x h ARG 86 Ca 0.14 -0.29 -0.02 0.00 -1.10 0.00 0.00 59.98 58.71 2r8x h ARG 86 Cb 0.56 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 29.08 2r8x h ARG 86 CO 0.03 0.88 0.49 0.00 2.80 0.00 0.00 179.97 184.18 2r8x h ALA 88 N 1.27 1.21 -0.41 0.00 0.00 -1.39 0.70 119.26 120.64 2r8x h ALA 88 Ca 0.31 -0.30 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 2r8x h ALA 88 Cb 0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2r8x h ALA 88 CO -0.05 0.51 -0.28 1.15 0.00 0.00 0.00 179.25 180.58 2r8x h THR 89 N 0.42 1.27 -0.00 0.00 2.02 -1.13 -3.07 112.91 112.42 2r8x h THR 89 Ca 0.07 -1.44 0.00 0.00 0.77 0.00 0.00 66.41 65.81 2r8x h THR 89 Cb 0.56 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 2r8x h THR 89 CO 0.04 0.48 -0.32 0.18 0.37 0.00 0.00 175.52 176.27 2r8x n LEU 90 N -4.09 0.41 -0.33 2.58 4.77 -0.76 -4.95 117.00 114.63 2r8x n LEU 90 Ca -0.01 0.11 -0.03 0.00 -0.03 0.00 0.00 56.01 56.05 2r8x n LEU 90 Cb 0.48 -0.30 -0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2r8x n LEU 90 CO 0.46 0.09 -0.04 0.61 -1.33 0.00 0.00 177.39 177.19 2r8x n GLY 91 N 1.47 0.27 3.68 -0.72 0.00 0.78 -4.76 105.19 105.90 2r8x n GLY 91 Ca 0.07 -0.78 -0.40 0.00 0.00 0.00 0.00 46.02 44.91 2r8x n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r8x s ILE 92 N -2.15 4.98 -1.07 -0.61 1.01 0.21 -4.95 121.20 118.62 2r8x s ILE 92 Ca 0.00 1.39 0.16 0.00 0.00 0.00 0.00 60.65 62.19 2r8x s ILE 92 Cb 0.00 -4.03 -0.09 0.00 0.01 0.00 0.00 42.46 38.35 2r8x s ILE 92 CO 0.00 0.12 0.74 0.35 0.00 0.00 0.00 174.94 176.15 2r8x n THR 93 N 4.49 0.00 -3.88 2.92 -2.24 -1.26 -4.38 114.28 109.94 2r8x n THR 93 Ca 0.01 -0.23 -0.34 0.00 -2.27 0.00 0.00 64.05 61.21 2r8x n THR 93 Cb 0.50 1.09 -0.13 0.00 -2.10 0.00 0.00 70.33 69.69 2r8x n THR 93 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2r8x s HIS 94 N -2.18 3.55 -0.04 4.78 3.76 -1.26 -5.08 115.29 118.82 2r8x s HIS 94 Ca 0.09 -2.44 0.01 0.00 -0.15 0.00 0.00 55.06 52.57 2r8x s HIS 94 Cb 0.12 -2.86 0.02 0.00 1.11 0.00 0.00 32.58 30.97 2r8x s HIS 94 CO 0.52 -0.93 -0.05 -1.17 -0.85 0.00 0.00 174.74 172.26 2r8x s LEU 95 N 1.10 1.37 -0.23 0.89 2.96 -1.26 -2.01 118.68 121.50 2r8x s LEU 95 Ca 0.05 -0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 53.81 2r8x s LEU 95 Cb -0.21 -0.48 0.07 0.00 0.50 0.00 0.00 46.19 46.07 2r8x s LEU 95 CO -0.04 -0.04 0.01 -0.31 -1.32 0.00 0.00 176.35 174.64 2r8x s TYR 96 N 0.87 1.80 0.13 5.38 1.51 -0.25 -5.00 117.35 121.80 2r8x s TYR 96 Ca -0.12 -1.45 0.06 0.00 -1.01 0.00 0.00 57.07 54.55 2r8x s TYR 96 Cb -0.14 -1.43 -0.04 0.00 -0.11 0.00 0.00 41.96 40.23 2r8x s TYR 96 CO 0.01 -0.73 0.03 -0.65 -1.11 0.00 0.00 175.55 173.09 2r8x s GLN 97 N 1.59 2.57 -0.90 -0.62 -0.21 -1.26 -1.30 119.66 119.53 2r8x s GLN 97 Ca -0.01 -0.94 0.00 0.00 0.02 0.00 0.00 55.36 54.43 2r8x s GLN 97 Cb -0.18 -2.50 0.00 0.00 1.00 0.00 0.00 33.01 31.33 2r8x s GLN 97 CO -0.10 0.50 0.00 0.41 -2.12 0.00 0.00 175.29 173.98 2r8x n GLY 98 N 0.14 0.65 3.41 3.09 0.00 -0.22 -4.90 105.19 107.36 2r8x n GLY 98 Ca -0.10 -0.57 -0.44 0.00 0.00 0.00 0.00 46.02 44.91 2r8x n GLY 98 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2r8x s GLN 99 N -3.45 3.06 0.21 1.61 2.00 -0.16 -4.89 119.66 118.04 2r8x s GLN 99 Ca 0.00 -1.15 0.22 0.00 -2.00 0.00 0.00 55.36 52.43 2r8x s GLN 99 Cb 0.00 -4.15 0.01 0.00 0.80 0.00 0.00 33.01 29.67 2r8x s GLN 99 CO 0.00 -1.21 1.06 0.77 -0.50 0.00 0.00 175.29 175.41 2r8x h SER 100 N 8.94 0.00 -4.11 6.67 0.02 -1.85 -3.29 113.55 119.93 2r8x h SER 100 Ca -0.28 0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 59.96 2r8x h SER 100 Cb 1.10 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 63.30 2r8x h SER 100 CO 0.96 0.07 -0.31 0.21 -1.14 0.00 0.00 176.83 176.62 2r8x s ASN 101 N -5.48 5.42 0.00 3.07 2.47 -1.26 -4.96 114.94 114.20 2r8x s ASN 101 Ca -0.00 -2.84 0.17 0.00 0.42 0.00 0.00 52.86 50.60 2r8x s ASN 101 Cb 0.09 -1.90 0.84 0.00 -1.45 0.00 0.00 41.25 38.84 2r8x s ASN 101 CO 0.78 -0.39 1.48 0.29 -3.72 0.00 0.00 177.10 175.54 2r8x n LYS 102 N 3.53 0.25 0.14 0.43 5.02 -1.26 -2.46 118.16 123.80 2r8x n LYS 102 Ca 0.09 0.12 -0.01 0.00 -2.02 0.00 0.00 58.31 56.49 2r8x n LYS 102 Cb 0.39 -1.50 0.22 0.00 -0.02 0.00 0.00 35.03 34.12 2r8x n LYS 102 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2r8x h LEU 103 N 0.00 0.07 -0.09 -0.35 3.38 -1.96 -2.58 115.31 113.79 2r8x h LEU 103 Ca 0.00 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2r8x h LEU 103 Cb 0.15 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2r8x h LEU 103 CO 0.00 0.58 -0.03 0.40 0.09 0.00 0.00 178.44 179.48 2r8x h ILE 104 N 0.05 1.31 0.00 1.22 2.04 -1.93 -2.33 117.51 117.87 2r8x h ILE 104 Ca -0.00 -1.00 -0.03 0.00 1.00 0.00 0.00 64.86 64.83 2r8x h ILE 104 Cb 0.94 1.80 -0.00 0.00 -0.74 0.00 0.00 36.82 38.81 2r8x h ILE 104 CO 0.07 0.28 -0.15 0.00 0.00 0.00 0.00 178.15 178.35 2r8x h ALA 105 N 0.65 1.06 -0.02 1.87 0.00 -1.74 -2.87 119.26 118.22 2r8x h ALA 105 Ca 0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2r8x h ALA 105 Cb 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2r8x h ALA 105 CO 0.01 0.19 -0.04 0.35 0.00 0.00 0.00 179.25 179.76 2r8x h PHE 106 N 0.00 0.08 0.00 0.00 -0.00 -1.31 -2.96 116.94 112.75 2r8x h PHE 106 Ca -0.00 -0.03 -0.06 0.00 -0.00 0.00 0.00 57.97 57.88 2r8x h PHE 106 Cb 0.61 -0.01 -0.01 0.00 -0.00 0.00 0.00 35.95 36.53 2r8x h PHE 106 CO 0.00 0.64 -0.29 0.77 -0.00 0.00 0.00 178.31 179.43 2r8x h SER 107 N -0.51 0.00 0.24 0.41 0.02 -1.42 -2.64 113.55 109.65 2r8x h SER 107 Ca -0.00 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 2r8x h SER 107 Cb 0.64 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 2r8x h SER 107 CO 0.01 0.29 -0.47 -0.78 -1.14 0.00 0.00 176.83 174.74 2r8x h ASP 108 N 0.00 0.30 0.29 3.07 3.58 -1.55 -2.66 116.42 119.46 2r8x h ASP 108 Ca -0.00 -0.14 -0.21 0.00 0.42 0.00 0.00 57.03 57.10 2r8x h ASP 108 Cb 0.63 -0.08 -0.00 0.00 1.72 0.00 0.00 39.33 41.59 2r8x h ASP 108 CO 0.04 0.73 -0.84 -0.07 -2.88 0.00 0.00 179.24 176.22 2r8x h LEU 109 N 0.23 0.52 -1.18 2.28 3.38 -1.30 -2.09 115.31 117.14 2r8x h LEU 109 Ca 0.01 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.52 2r8x h LEU 109 Cb 0.92 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2r8x h LEU 109 CO 0.08 1.15 -0.39 -0.07 0.09 0.00 0.00 178.44 179.30 2r8x h LEU 110 N 0.26 0.00 0.11 1.67 3.38 -1.41 -2.33 115.31 116.98 2r8x h LEU 110 Ca -0.06 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.69 2r8x h LEU 110 Cb 1.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.20 2r8x h LEU 110 CO 0.15 0.39 -1.13 -0.33 0.09 0.00 0.00 178.44 177.60 2r8x h GLU 111 N 0.00 0.23 -0.58 1.13 5.08 -1.49 -2.43 114.58 116.51 2r8x h GLU 111 Ca -0.00 -0.39 -0.08 0.00 -1.00 0.00 0.00 59.36 57.89 2r8x h GLU 111 Cb 0.74 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 2r8x h GLU 111 CO 0.05 1.19 0.06 0.87 -1.00 0.00 0.00 179.01 180.17 2r8x h LYS 112 N -0.42 0.96 -0.02 2.33 1.57 -1.39 -3.16 116.57 116.44 2r8x h LYS 112 Ca -0.24 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2r8x h LYS 112 Cb 1.64 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.84 2r8x h LYS 112 CO 0.06 0.92 -0.39 1.28 -0.57 0.00 0.00 179.45 180.75 2r8x n LEU 113 N -4.21 2.22 -3.39 2.94 4.77 -0.88 -5.01 117.00 113.43 2r8x n LEU 113 Ca 0.04 -0.80 -0.11 0.00 -0.03 0.00 0.00 56.01 55.10 2r8x n LEU 113 Cb 0.30 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 2r8x n LEU 113 CO 0.42 0.40 0.09 0.00 -1.33 0.00 0.00 177.39 176.97 2r8x n ALA 114 N 0.23 -2.64 -2.84 -1.18 0.00 -1.10 -5.02 120.51 107.97 2r8x n ALA 114 Ca 0.10 -0.12 -0.13 0.00 0.00 0.00 0.00 53.44 53.29 2r8x n ALA 114 Cb 0.49 -1.21 -0.14 0.00 0.00 0.00 0.00 19.45 18.60 2r8x n ALA 114 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2r8x s ILE 115 N -3.00 0.21 0.45 0.00 2.07 -0.93 -5.05 121.20 114.94 2r8x s ILE 115 Ca 0.01 -0.27 -0.21 0.00 -1.41 0.00 0.00 60.65 58.77 2r8x s ILE 115 Cb -0.00 -0.22 -0.10 0.00 0.13 0.00 0.00 42.46 42.27 2r8x s ILE 115 CO 0.81 -0.04 0.99 0.00 -1.91 0.00 0.00 174.94 174.79 2r8x s ALA 116 N -0.32 2.98 0.44 1.50 0.00 -1.26 -4.74 121.76 120.37 2r8x s ALA 116 Ca -0.02 0.50 0.13 0.00 0.00 0.00 0.00 51.96 52.57 2r8x s ALA 116 Cb -0.03 -3.20 1.03 0.00 0.00 0.00 0.00 23.12 20.92 2r8x s ALA 116 CO -0.00 -0.06 2.03 -1.00 0.00 0.00 0.00 175.76 176.72 2r8x h PRO 117 N 1.85 0.37 0.00 0.00 0.13 -1.97 -2.00 132.00 130.38 2r8x h PRO 117 Ca -0.49 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2r8x h PRO 117 Cb 1.20 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2r8x h PRO 117 CO 0.60 0.24 0.00 -0.85 -0.23 0.00 0.00 178.00 177.77 2r8x n GLU 118 N -4.48 0.19 -0.58 0.86 0.00 -1.26 -1.54 120.64 113.84 2r8x n GLU 118 Ca 0.06 0.36 0.07 0.00 0.00 0.00 0.00 57.16 57.65 2r8x n GLU 118 Cb 0.25 -1.83 0.31 0.00 0.00 0.00 0.00 31.44 30.16 2r8x n GLU 118 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2r8x n ASN 119 N -2.19 4.29 -4.33 -1.84 3.02 -0.75 -3.95 115.26 109.50 2r8x n ASN 119 Ca 0.03 -2.49 -0.31 0.00 -0.03 0.00 0.00 54.58 51.78 2r8x n ASN 119 Cb 0.27 -0.57 -0.15 0.00 -0.61 0.00 0.00 39.78 38.72 2r8x n ASN 119 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2r8x s VAL 120 N -2.00 2.13 -0.03 2.41 1.01 -1.05 0.03 120.40 122.91 2r8x s VAL 120 Ca 0.43 -1.24 0.07 0.00 0.00 0.00 0.00 61.98 61.24 2r8x s VAL 120 Cb 0.29 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 2r8x s VAL 120 CO 0.18 0.47 -0.24 0.00 0.00 0.00 0.00 175.10 175.51 2r8x s ALA 121 N -0.72 2.24 -0.05 5.51 0.00 0.83 -1.88 121.76 127.71 2r8x s ALA 121 Ca 0.11 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 51.02 2r8x s ALA 121 Cb -0.10 -0.62 -0.00 0.00 0.00 0.00 0.00 23.12 22.39 2r8x s ALA 121 CO 0.01 0.53 -0.18 -0.47 0.00 0.00 0.00 175.76 175.65 2r8x s TYR 122 N -0.61 1.77 -0.32 0.00 5.04 -0.85 0.43 117.35 122.81 2r8x s TYR 122 Ca 0.10 -0.52 0.00 0.00 -2.44 0.00 0.00 57.07 54.21 2r8x s TYR 122 Cb -0.10 -1.19 0.07 0.00 0.35 0.00 0.00 41.96 41.09 2r8x s TYR 122 CO -0.01 -0.18 0.02 0.08 -1.34 0.00 0.00 175.55 174.12 2r8x s VAL 123 N 0.05 2.70 0.43 3.14 1.01 -0.80 0.11 120.40 127.04 2r8x s VAL 123 Ca -0.04 -1.75 0.07 0.00 0.00 0.00 0.00 61.98 60.26 2r8x s VAL 123 Cb -0.12 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 2r8x s VAL 123 CO 0.02 -0.28 0.19 -0.83 0.00 0.00 0.00 175.10 174.20 2r8x s GLY 124 N 1.24 2.38 0.00 4.51 0.00 0.12 -3.09 107.32 112.48 2r8x s GLY 124 Ca -0.01 -1.95 0.00 0.00 0.00 0.00 0.00 44.72 42.76 2r8x s GLY 124 CO -0.04 -1.93 0.00 2.09 0.00 0.00 0.00 173.10 173.22 2r8x n ASP 125 N -1.28 1.07 -4.28 1.64 5.68 -1.26 -2.69 116.55 115.43 2r8x n ASP 125 Ca -0.02 0.00 -0.22 0.00 -0.50 0.00 0.00 54.79 54.05 2r8x n ASP 125 Cb 0.65 0.21 -0.10 0.00 -1.14 0.00 0.00 41.12 40.74 2r8x n ASP 125 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2r8x s ASP 126 N -0.46 2.29 0.54 -1.12 -1.08 -1.26 -0.32 116.67 115.26 2r8x s ASP 126 Ca 0.00 -1.50 0.30 0.00 -0.52 0.00 0.00 52.55 50.84 2r8x s ASP 126 Cb 0.00 0.20 1.55 0.00 -1.46 0.00 0.00 42.92 43.21 2r8x s ASP 126 CO 0.00 -0.76 2.09 -0.07 0.52 0.00 0.00 175.17 176.95 2r8x h LEU 127 N 2.04 0.00 -1.25 -1.34 3.38 -1.99 -2.09 115.31 114.06 2r8x h LEU 127 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2r8x h LEU 127 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2r8x h LEU 127 CO 0.62 0.09 0.00 -0.29 0.09 0.00 0.00 178.44 178.95 2r8x h ILE 128 N 0.00 0.00 0.00 1.22 6.09 -1.99 -2.56 117.51 120.27 2r8x h ILE 128 Ca -0.00 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.30 2r8x h ILE 128 Cb 0.33 0.91 0.00 0.00 0.47 0.00 0.00 36.82 38.53 2r8x h ILE 128 CO 0.01 0.00 -0.62 0.44 -3.07 0.00 0.00 178.15 174.92 2r8x h ASP 129 N 0.00 0.00 -0.40 2.19 3.32 -1.80 -3.41 116.42 116.33 2r8x h ASP 129 Ca 0.00 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 2r8x h ASP 129 Cb 0.25 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 2r8x h ASP 129 CO 0.00 0.02 0.17 -0.25 -1.72 0.00 0.00 179.24 177.46 2r8x h TRP 130 N 0.00 0.60 -0.99 4.55 -0.00 -1.60 -2.45 115.95 116.05 2r8x h TRP 130 Ca 0.00 -0.04 0.24 0.00 -0.00 0.00 0.00 58.89 59.09 2r8x h TRP 130 Cb 0.94 -0.18 -0.08 0.00 -0.00 0.00 0.00 29.16 29.84 2r8x h TRP 130 CO 0.00 0.52 0.65 -1.35 -0.00 0.00 0.00 178.44 178.26 2r8x h PRO 131 N 0.50 0.40 0.13 2.65 0.11 -1.79 0.27 132.00 134.27 2r8x h PRO 131 Ca 0.13 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 66.00 2r8x h PRO 131 Cb 0.17 -0.09 0.02 0.00 0.11 0.00 0.00 31.00 31.21 2r8x h PRO 131 CO -0.01 0.26 -0.94 0.28 -0.21 0.00 0.00 178.00 177.38 2r8x h VAL 132 N 0.41 1.44 -0.16 3.15 2.07 -1.84 -3.33 116.25 117.99 2r8x h VAL 132 Ca 0.55 -2.48 -0.01 0.00 0.82 0.00 0.00 66.70 65.58 2r8x h VAL 132 Cb 1.37 3.02 -0.01 0.00 -1.52 0.00 0.00 31.29 34.15 2r8x h VAL 132 CO -0.25 0.72 0.06 0.24 0.02 0.00 0.00 177.57 178.37 2r8x h MET 133 N -0.17 0.21 0.00 1.57 2.86 -0.67 -2.46 114.93 116.27 2r8x h MET 133 Ca -0.16 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 2r8x h MET 133 Cb 1.71 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 33.32 2r8x h MET 133 CO 0.18 0.18 -0.04 1.49 1.06 0.00 0.00 176.91 179.77 2r8x h GLU 134 N 0.21 0.00 0.00 1.72 4.81 -0.65 -3.23 114.58 117.45 2r8x h GLU 134 Ca 0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2r8x h GLU 134 Cb 0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2r8x h GLU 134 CO -0.01 0.04 -1.47 1.63 -0.73 0.00 0.00 179.01 178.48 2r8x n LYS 135 N -3.31 0.45 -1.54 1.92 5.02 -0.94 -5.03 118.16 114.73 2r8x n LYS 135 Ca -0.02 -0.10 -0.30 0.00 -2.02 0.00 0.00 58.31 55.88 2r8x n LYS 135 Cb 0.20 -1.25 0.10 0.00 -0.02 0.00 0.00 35.03 34.05 2r8x n LYS 135 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2r8x s VAL 136 N -2.74 2.93 0.21 -0.18 -7.23 -1.13 -4.57 120.40 107.69 2r8x s VAL 136 Ca -0.04 0.30 0.05 0.00 -1.81 0.00 0.00 61.98 60.48 2r8x s VAL 136 Cb 0.07 -3.04 -0.09 0.00 0.56 0.00 0.00 36.38 33.88 2r8x s VAL 136 CO 0.46 -0.39 1.48 1.23 -0.31 0.00 0.00 175.10 177.57 2r8x h GLY 137 N -1.15 0.20 -7.01 2.32 0.00 -0.54 -3.41 103.07 93.47 2r8x h GLY 137 Ca -0.47 -0.29 -0.54 0.00 0.00 0.00 0.00 47.33 46.02 2r8x h GLY 137 CO 0.59 0.26 -0.77 -2.27 0.00 0.00 0.00 176.54 174.36 2r8x s LEU 138 N -7.63 1.25 -0.04 3.11 2.96 -1.06 -4.87 118.68 112.40 2r8x s LEU 138 Ca -0.03 -1.30 -0.22 0.00 -0.22 0.00 0.00 54.13 52.36 2r8x s LEU 138 Cb 0.11 -0.57 -0.04 0.00 0.50 0.00 0.00 46.19 46.19 2r8x s LEU 138 CO 0.81 -0.40 0.66 -0.94 -1.32 0.00 0.00 176.35 175.15 2r8x s SER 139 N 1.89 6.98 -0.08 3.68 1.04 -1.26 -2.00 113.70 123.95 2r8x s SER 139 Ca 0.07 1.18 0.03 0.00 0.48 0.00 0.00 55.95 57.71 2r8x s SER 139 Cb -0.17 -2.40 0.01 0.00 0.10 0.00 0.00 66.02 63.57 2r8x s SER 139 CO -0.26 -0.04 -0.17 -0.69 0.98 0.00 0.00 173.24 173.06 2r8x s VAL 140 N 0.45 1.48 -0.07 5.02 1.01 0.12 -1.52 120.40 126.88 2r8x s VAL 140 Ca 0.35 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.67 2r8x s VAL 140 Cb -0.18 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 2r8x s VAL 140 CO 0.18 0.43 -0.10 0.00 0.00 0.00 0.00 175.10 175.61 2r8x s ALA 141 N 0.54 2.84 0.85 5.51 0.00 -0.71 -0.71 121.76 130.08 2r8x s ALA 141 Ca -0.16 -0.92 -0.11 0.00 0.00 0.00 0.00 51.96 50.76 2r8x s ALA 141 Cb -0.17 -1.14 0.10 0.00 0.00 0.00 0.00 23.12 21.92 2r8x s ALA 141 CO 0.06 0.53 1.09 0.14 0.00 0.00 0.00 175.76 177.58 2r8x s VAL 142 N -0.66 2.86 0.23 0.00 -7.23 -1.09 -1.91 120.40 112.59 2r8x s VAL 142 Ca 0.10 0.28 -0.06 0.00 -1.81 0.00 0.00 61.98 60.49 2r8x s VAL 142 Cb -0.11 -2.85 0.19 0.00 0.56 0.00 0.00 36.38 34.16 2r8x s VAL 142 CO 0.01 -0.36 1.79 0.00 -0.31 0.00 0.00 175.10 176.23 2r8x h ALA 143 N -1.36 1.05 -0.83 1.32 0.00 -1.52 -2.50 119.26 115.43 2r8x h ALA 143 Ca -0.48 0.04 -0.49 0.00 0.00 0.00 0.00 54.91 53.98 2r8x h ALA 143 Cb 1.27 -0.09 -0.27 0.00 0.00 0.00 0.00 17.79 18.71 2r8x h ALA 143 CO 0.56 0.02 0.42 -0.40 0.00 0.00 0.00 179.25 179.85 2r8x n ASP 144 N -4.81 4.70 -4.70 0.00 5.75 -1.26 -4.99 116.55 111.24 2r8x n ASP 144 Ca 0.12 -3.72 -0.29 0.00 -0.01 0.00 0.00 54.79 50.89 2r8x n ASP 144 Cb 0.27 -0.79 0.16 0.00 -1.03 0.00 0.00 41.12 39.72 2r8x n ASP 144 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2r8x s ALA 145 N -3.47 1.25 0.16 2.12 0.00 -0.94 -4.93 121.76 115.94 2r8x s ALA 145 Ca 0.56 -0.20 -0.32 0.00 0.00 0.00 0.00 51.96 52.00 2r8x s ALA 145 Cb 0.47 -3.16 -0.11 0.00 0.00 0.00 0.00 23.12 20.32 2r8x s ALA 145 CO 0.04 -2.60 1.78 1.58 0.00 0.00 0.00 175.76 176.57 2r8x n HIS 146 N -4.03 2.67 -0.41 0.00 -0.00 0.56 -4.85 115.22 109.17 2r8x n HIS 146 Ca 0.06 -0.05 0.39 0.00 0.46 0.00 0.00 57.72 58.58 2r8x n HIS 146 Cb 0.56 -2.70 0.74 0.00 -0.12 0.00 0.00 29.99 28.47 2r8x n HIS 146 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2r8x h PRO 147 N 7.68 0.00 0.00 1.57 0.11 -1.92 0.26 132.00 139.71 2r8x h PRO 147 Ca -0.45 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.48 2r8x h PRO 147 Cb 1.21 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 2r8x h PRO 147 CO 0.95 0.00 -0.84 -0.07 -0.21 0.00 0.00 178.00 177.83 2r8x h LEU 148 N 0.00 0.00 -0.10 2.35 3.38 -1.98 -3.32 115.31 115.65 2r8x h LEU 148 Ca 0.65 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.39 2r8x h LEU 148 Cb 2.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.50 2r8x h LEU 148 CO -0.01 0.84 -1.02 0.25 0.09 0.00 0.00 178.44 178.59 2r8x h LEU 149 N 0.00 0.47 -0.32 1.67 5.85 -0.83 -3.39 115.31 118.76 2r8x h LEU 149 Ca -0.01 -0.41 0.07 0.00 0.84 0.00 0.00 57.88 58.37 2r8x h LEU 149 Cb 1.55 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 42.36 2r8x h LEU 149 CO 0.11 1.24 -0.18 0.40 -0.34 0.00 0.00 178.44 179.67 2r8x h ILE 150 N 0.17 0.47 0.00 4.05 2.04 -1.61 -2.18 117.51 120.45 2r8x h ILE 150 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.77 2r8x h ILE 150 Cb 1.68 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 2r8x h ILE 150 CO 0.17 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.51 2r8x n PRO 151 N -5.35 0.59 0.07 2.37 -0.04 -1.26 -3.00 135.00 128.37 2r8x n PRO 151 Ca 0.01 0.03 0.07 0.00 -0.04 0.00 0.00 63.50 63.57 2r8x n PRO 151 Cb 0.26 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.18 2r8x n PRO 151 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2r8x n ARG 152 N -1.09 0.62 -2.34 0.54 1.74 -0.82 -4.97 116.66 110.34 2r8x n ARG 152 Ca 0.15 0.13 -0.32 0.00 -0.77 0.00 0.00 57.85 57.04 2r8x n ARG 152 Cb 0.11 -1.79 -0.03 0.00 -1.02 0.00 0.00 32.46 29.73 2r8x n ARG 152 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2r8x s ALA 153 N -3.22 3.06 0.19 7.54 0.00 -1.16 -4.98 121.76 123.18 2r8x s ALA 153 Ca -0.02 0.16 -0.07 0.00 0.00 0.00 0.00 51.96 52.03 2r8x s ALA 153 Cb 0.10 -3.12 0.11 0.00 0.00 0.00 0.00 23.12 20.21 2r8x s ALA 153 CO 0.81 -0.29 1.61 -0.44 0.00 0.00 0.00 175.76 177.45 2r8x h ASP 154 N 0.80 0.92 -3.92 0.00 3.45 -1.62 -3.45 116.42 112.59 2r8x h ASP 154 Ca -0.47 -0.32 -0.35 0.00 0.43 0.00 0.00 57.03 56.32 2r8x h ASP 154 Cb 1.19 -0.25 -0.29 0.00 -0.56 0.00 0.00 39.33 39.42 2r8x h ASP 154 CO 0.61 1.08 -0.76 -0.47 -1.57 0.00 0.00 179.24 178.13 2r8x s TYR 155 N -4.71 0.58 -0.21 4.55 5.04 -0.68 -4.94 117.35 116.98 2r8x s TYR 155 Ca -0.10 -0.11 -0.02 0.00 -2.44 0.00 0.00 57.07 54.40 2r8x s TYR 155 Cb 0.13 -0.38 0.01 0.00 0.35 0.00 0.00 41.96 42.06 2r8x s TYR 155 CO 0.85 -0.02 -0.11 0.08 -1.34 0.00 0.00 175.55 175.01 2r8x s VAL 156 N -0.09 2.80 0.61 3.14 1.01 -1.26 -1.74 120.40 124.87 2r8x s VAL 156 Ca 0.02 -0.72 -0.17 0.00 0.00 0.00 0.00 61.98 61.11 2r8x s VAL 156 Cb -0.03 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 2r8x s VAL 156 CO -0.00 0.45 1.13 0.42 0.00 0.00 0.00 175.10 177.10 2r8x s THR 157 N 1.39 3.15 0.12 3.92 -4.23 -0.80 -4.93 115.64 114.26 2r8x s THR 157 Ca 0.05 0.61 0.06 0.00 -1.18 0.00 0.00 61.69 61.24 2r8x s THR 157 Cb -0.14 -3.16 -0.21 0.00 1.34 0.00 0.00 72.50 70.33 2r8x s THR 157 CO -0.07 -0.25 1.29 0.03 -0.54 0.00 0.00 174.62 175.07 2r8x h ARG 158 N 0.52 0.02 -5.98 3.99 -0.00 -1.92 -3.17 114.38 107.84 2r8x h ARG 158 Ca -0.48 -0.03 -0.61 0.00 -0.50 0.00 0.00 59.98 58.36 2r8x h ARG 158 Cb 1.26 0.01 -0.05 0.00 0.00 0.00 0.00 29.97 31.18 2r8x h ARG 158 CO 0.55 1.00 -0.26 0.42 0.00 0.00 0.00 179.97 181.68 2r8x s ILE 159 N -2.75 5.12 0.82 2.04 -1.09 -1.26 -4.78 121.20 119.30 2r8x s ILE 159 Ca 0.01 0.62 -0.11 0.00 -2.23 0.00 0.00 60.65 58.94 2r8x s ILE 159 Cb 0.10 -3.65 0.08 0.00 -1.58 0.00 0.00 42.46 37.42 2r8x s ILE 159 CO 0.82 0.50 1.09 0.00 -1.23 0.00 0.00 174.94 176.12 2r8x s ALA 160 N -1.16 2.00 0.33 9.38 0.00 -1.26 -3.18 121.76 127.87 2r8x s ALA 160 Ca 0.25 0.05 -0.29 0.00 0.00 0.00 0.00 51.96 51.97 2r8x s ALA 160 Cb -0.15 -3.21 -0.11 0.00 0.00 0.00 0.00 23.12 19.65 2r8x s ALA 160 CO 0.13 -1.95 1.56 0.20 0.00 0.00 0.00 175.76 175.70 2r8x s GLY 161 N -3.51 2.47 -0.87 0.00 0.00 -1.26 -2.14 107.32 102.01 2r8x s GLY 161 Ca 0.62 1.60 0.00 0.00 0.00 0.00 0.00 44.72 46.94 2r8x s GLY 161 CO 0.56 2.45 0.00 0.61 0.00 0.00 0.00 173.10 176.72 2r8x n GLY 162 N 1.38 0.93 0.00 0.20 0.00 0.45 -3.54 105.19 104.61 2r8x n GLY 162 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2r8x n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r8x n ARG 163 N -1.73 6.32 0.00 1.61 5.12 -0.91 -4.58 116.66 122.49 2r8x n ARG 163 Ca -0.08 -0.04 0.00 0.00 -1.93 0.00 0.00 57.85 55.80 2r8x n ARG 163 Cb 0.40 -0.53 0.00 0.00 -1.16 0.00 0.00 32.46 31.17 2r8x n ARG 163 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2r8x n GLY 164 N 0.91 -0.13 0.26 -0.13 0.00 -1.25 -4.90 105.19 99.95 2r8x n GLY 164 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2r8x n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r8x h ALA 165 N 0.00 0.77 -0.56 4.61 0.00 -1.75 -1.06 119.26 121.27 2r8x h ALA 165 Ca 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 2r8x h ALA 165 Cb 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2r8x h ALA 165 CO 0.00 0.36 0.09 0.28 0.00 0.00 0.00 179.25 179.98 2r8x h VAL 166 N 0.81 1.26 -0.68 0.00 2.07 -1.89 -2.36 116.25 115.46 2r8x h VAL 166 Ca 0.20 -0.98 0.02 0.00 0.82 0.00 0.00 66.70 66.77 2r8x h VAL 166 Cb 0.16 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 30.69 2r8x h VAL 166 CO -0.02 0.35 0.43 -0.09 0.02 0.00 0.00 177.57 178.26 2r8x h ARG 167 N 0.82 0.82 -0.49 1.57 9.65 -1.76 -0.20 114.38 124.80 2r8x h ARG 167 Ca 0.17 -0.05 0.04 0.00 -1.10 0.00 0.00 59.98 59.04 2r8x h ARG 167 Cb 0.42 -0.19 -0.04 0.00 -1.39 0.00 0.00 29.97 28.77 2r8x h ARG 167 CO 0.01 0.54 0.24 1.49 2.80 0.00 0.00 179.97 185.06 2r8x h GLU 168 N 0.85 0.47 -0.19 0.20 4.81 -0.97 0.89 114.58 120.64 2r8x h GLU 168 Ca 0.27 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.43 2r8x h GLU 168 Cb -0.01 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 2r8x h GLU 168 CO -0.09 0.31 -0.02 0.28 -0.73 0.00 0.00 179.01 178.75 2r8x h VAL 169 N 0.48 1.27 -0.63 0.32 2.07 -1.09 -0.89 116.25 117.78 2r8x h VAL 169 Ca 0.22 -0.94 0.11 0.00 0.82 0.00 0.00 66.70 66.91 2r8x h VAL 169 Cb 0.13 1.52 -0.08 0.00 -1.52 0.00 0.00 31.29 31.33 2r8x h VAL 169 CO -0.15 0.28 0.18 0.00 0.02 0.00 0.00 177.57 177.90 2r8x h ASP 171 N 0.32 0.77 -0.50 0.00 3.45 -0.65 -1.56 116.42 118.24 2r8x h ASP 171 Ca 0.33 -0.13 -0.09 0.00 0.43 0.00 0.00 57.03 57.58 2r8x h ASP 171 Cb 0.48 -0.20 -0.02 0.00 -0.56 0.00 0.00 39.33 39.03 2r8x h ASP 171 CO -0.38 0.74 -0.02 0.25 -1.57 0.00 0.00 179.24 178.26 2r8x h LEU 172 N 0.80 0.89 -0.51 1.55 5.85 0.07 -0.39 115.31 123.57 2r8x h LEU 172 Ca 0.18 -0.32 -0.14 0.00 0.84 0.00 0.00 57.88 58.44 2r8x h LEU 172 Cb 0.26 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2r8x h LEU 172 CO -0.01 0.99 -0.31 -0.07 -0.34 0.00 0.00 178.44 178.70 2r8x h LEU 173 N 0.76 0.91 -0.51 2.25 3.38 -1.00 -2.18 115.31 118.92 2r8x h LEU 173 Ca 0.14 -0.38 -0.14 0.00 0.09 0.00 0.00 57.88 57.59 2r8x h LEU 173 Cb 0.55 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2r8x h LEU 173 CO 0.03 1.15 -0.31 -0.07 0.09 0.00 0.00 178.44 179.33 2r8x h LEU 174 N 0.73 0.92 -0.60 1.67 3.38 -1.18 -2.34 115.31 117.90 2r8x h LEU 174 Ca 0.08 -0.38 -0.11 0.00 0.09 0.00 0.00 57.88 57.55 2r8x h LEU 174 Cb 0.88 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 2r8x h LEU 174 CO 0.08 1.15 -0.08 0.25 0.09 0.00 0.00 178.44 179.93 2r8x h LEU 175 N 0.74 1.02 -0.94 1.67 5.85 -1.06 0.27 115.31 122.87 2r8x h LEU 175 Ca 0.08 -0.32 -0.09 0.00 0.84 0.00 0.00 57.88 58.39 2r8x h LEU 175 Cb 0.87 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 2r8x h LEU 175 CO 0.08 1.11 -0.15 0.00 -0.34 0.00 0.00 178.44 179.15 2r8x h ALA 176 N 0.98 1.11 -0.06 1.25 0.00 -1.31 -2.95 119.26 118.28 2r8x h ALA 176 Ca 0.15 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2r8x h ALA 176 Cb 0.64 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2r8x h ALA 176 CO 0.04 0.55 0.00 1.04 0.00 0.00 0.00 179.25 180.89 2r8x n GLN 177 N -4.17 1.89 -2.38 0.00 6.02 -0.89 -4.71 117.38 113.15 2r8x n GLN 177 Ca 0.01 -1.30 -0.11 0.00 -0.01 0.00 0.00 57.00 55.59 2r8x n GLN 177 Cb 0.36 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.16 2r8x n GLN 177 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2r8x n GLY 178 N 1.23 0.00 0.04 1.08 0.00 -0.87 -4.93 105.19 101.74 2r8x n GLY 178 Ca 0.17 -0.40 0.04 0.00 0.00 0.00 0.00 46.02 45.83 2r8x n GLY 178 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2r8x n LYS 179 N -2.15 3.75 -0.16 1.61 5.02 0.88 -4.76 118.16 122.35 2r8x n LYS 179 Ca -0.09 -0.11 -0.03 0.00 -2.02 0.00 0.00 58.31 56.05 2r8x n LYS 179 Cb 0.58 -0.94 0.06 0.00 -0.02 0.00 0.00 35.03 34.71 2r8x n LYS 179 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2r8x h LEU 180 N 0.19 0.21 -0.37 -0.35 5.85 -1.70 -0.46 115.31 118.68 2r8x h LEU 180 Ca 0.00 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.69 2r8x h LEU 180 Cb 0.23 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2r8x h LEU 180 CO 0.00 0.15 -0.10 0.44 -0.34 0.00 0.00 178.44 178.58 2r8x h ASP 181 N 0.37 0.72 1.85 1.25 3.32 -1.89 -3.21 116.42 118.84 2r8x h ASP 181 Ca 0.24 -0.37 -0.00 0.00 0.02 0.00 0.00 57.03 56.91 2r8x h ASP 181 Cb 0.24 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 2r8x h ASP 181 CO -0.23 0.93 -0.00 1.05 -1.72 0.00 0.00 179.24 179.26 2r8x h GLU 182 N 0.51 0.00 -6.73 3.56 4.11 -1.81 -3.46 114.58 110.77 2r8x h GLU 182 Ca 0.09 0.00 -0.52 0.00 0.07 0.00 0.00 59.36 59.00 2r8x h GLU 182 Cb 0.62 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.91 2r8x h GLU 182 CO 0.04 0.00 0.69 0.00 0.07 0.00 0.00 179.01 179.82 2r8x s ALA 183 N -3.28 3.56 0.11 1.06 0.00 -0.21 -5.04 121.76 117.97 2r8x s ALA 183 Ca 0.06 1.21 0.10 0.00 0.00 0.00 0.00 51.96 53.33 2r8x s ALA 183 Cb 0.06 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 2r8x s ALA 183 CO 0.65 -0.63 -0.24 0.15 0.00 0.00 0.00 175.76 175.69 2r8x s LYS 184 N -0.38 1.31 0.24 0.00 -0.14 -1.26 -5.01 119.74 114.48 2r8x s LYS 184 Ca 0.57 -1.24 -0.03 0.00 -1.36 0.00 0.00 55.97 53.91 2r8x s LYS 184 Cb -0.39 -1.68 0.01 0.00 -1.68 0.00 0.00 37.83 34.09 2r8x s LYS 184 CO 0.42 0.40 0.36 0.41 -0.76 0.00 0.00 175.35 176.17 2r8x n GLY 185 N 1.07 2.27 3.11 -3.33 0.00 -1.26 -4.12 105.19 102.92 2r8x n GLY 185 Ca -0.19 -1.48 -0.26 0.00 0.00 0.00 0.00 46.02 44.09 2r8x n GLY 185 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2r8x s GLN 186 N -2.46 1.93 -1.19 1.61 1.11 -1.26 -5.03 119.66 114.37 2r8x s GLN 186 Ca 0.18 -0.57 -0.19 0.00 0.01 0.00 0.00 55.36 54.78 2r8x s GLN 186 Cb -0.01 -1.60 -0.03 0.00 -1.01 0.00 0.00 33.01 30.36 2r8x s GLN 186 CO 0.13 0.15 1.94 0.45 0.01 0.00 0.00 175.29 177.98 2r8x n SER 187 N 3.44 3.69 0.00 5.90 2.88 -1.26 -3.17 113.62 125.10 2r8x n SER 187 Ca -0.20 -2.79 0.00 0.00 -1.33 0.00 0.00 58.87 54.55 2r8x n SER 187 Cb 0.53 -1.59 0.00 0.00 -0.75 0.00 0.00 64.21 62.40 2r8x n SER 187 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11