#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i8m s LEU 2 N 0.00 4.48 -0.07 -4.62 2.96 -1.26 -5.04 118.68 115.12 1i8m s LEU 2 Ca 0.00 2.24 0.04 0.00 -0.22 0.00 0.00 54.13 56.19 1i8m s LEU 2 Cb 0.00 -3.61 -0.00 0.00 0.50 0.00 0.00 46.19 43.08 1i8m s LEU 2 CO 0.00 -0.31 -0.21 0.00 -1.32 0.00 0.00 176.35 174.52 1i8m s GLN 3 N -0.58 2.45 0.02 1.98 1.03 -1.26 -4.82 119.66 118.49 1i8m s GLN 3 Ca 0.50 -0.74 -0.01 0.00 0.04 0.00 0.00 55.36 55.15 1i8m s GLN 3 Cb -0.32 -1.96 -0.04 0.00 0.03 0.00 0.00 33.01 30.72 1i8m s GLN 3 CO 0.38 0.20 0.18 -1.64 -2.54 0.00 0.00 175.29 171.87 1i8m s MET 4 N 0.25 3.36 -0.13 9.60 1.00 -1.26 -1.17 119.30 130.96 1i8m s MET 4 Ca -0.12 -0.41 -0.01 0.00 0.00 0.00 0.00 55.69 55.15 1i8m s MET 4 Cb -0.16 -3.03 0.03 0.00 0.00 0.00 0.00 34.83 31.68 1i8m s MET 4 CO 0.06 0.64 -0.04 0.99 0.00 0.00 0.00 175.02 176.67 1i8m s THR 5 N -1.38 0.85 0.03 2.05 2.01 0.11 -4.57 115.64 114.74 1i8m s THR 5 Ca 0.30 -0.32 0.01 0.00 0.31 0.00 0.00 61.69 61.99 1i8m s THR 5 Cb -0.13 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.35 1i8m s THR 5 CO 0.22 0.22 0.08 -1.10 -0.69 0.00 0.00 174.62 173.34 1i8m s GLN 6 N 1.76 2.99 -0.09 4.92 -0.21 -1.26 0.13 119.66 127.90 1i8m s GLN 6 Ca 0.03 -0.57 -0.10 0.00 0.02 0.00 0.00 55.36 54.75 1i8m s GLN 6 Cb -0.14 -2.80 0.03 0.00 1.00 0.00 0.00 33.01 31.10 1i8m s GLN 6 CO -0.07 0.61 0.27 -1.12 -2.12 0.00 0.00 175.29 172.86 1i8m s SER 7 N -1.99 -0.27 0.76 5.90 0.01 0.14 -4.53 113.70 113.72 1i8m s SER 7 Ca 0.25 0.50 -0.06 0.00 1.31 0.00 0.00 55.95 57.96 1i8m s SER 7 Cb -0.12 0.54 0.12 0.00 0.21 0.00 0.00 66.02 66.77 1i8m s SER 7 CO 0.17 -0.12 1.06 -2.16 0.41 0.00 0.00 173.24 172.59 1i8m s PRO 8 N 0.01 1.65 0.24 12.44 0.04 -1.26 -0.08 135.00 148.03 1i8m s PRO 8 Ca -0.01 -0.71 0.03 0.00 0.04 0.00 0.00 61.00 60.34 1i8m s PRO 8 Cb -0.02 -2.19 0.28 0.00 0.04 0.00 0.00 34.50 32.60 1i8m s PRO 8 CO 0.01 -1.55 1.60 0.00 0.04 0.00 0.00 177.00 177.09 1i8m h ALA 9 N -0.75 0.90 -2.81 8.56 0.00 -1.82 -3.41 119.26 119.93 1i8m h ALA 9 Ca -0.41 -0.48 -0.14 0.00 0.00 0.00 0.00 54.91 53.88 1i8m h ALA 9 Cb 1.27 -0.09 -0.22 0.00 0.00 0.00 0.00 17.79 18.76 1i8m h ALA 9 CO 0.46 0.67 -0.42 -1.12 0.00 0.00 0.00 179.25 178.83 1i8m s SER 10 N -6.89 -0.10 -0.06 0.00 0.01 -1.26 -1.61 113.70 103.79 1i8m s SER 10 Ca -0.05 0.05 -0.10 0.00 1.31 0.00 0.00 55.95 57.16 1i8m s SER 10 Cb 0.12 0.31 0.02 0.00 0.21 0.00 0.00 66.02 66.68 1i8m s SER 10 CO 0.80 -0.31 0.24 -0.22 0.41 0.00 0.00 173.24 174.16 1i8m s LEU 11 N -0.95 1.12 -0.06 2.44 2.96 -0.59 -4.93 118.68 118.67 1i8m s LEU 11 Ca -0.10 0.27 0.04 0.00 -0.22 0.00 0.00 54.13 54.11 1i8m s LEU 11 Cb -0.05 0.89 -0.02 0.00 0.50 0.00 0.00 46.19 47.51 1i8m s LEU 11 CO 0.02 -0.22 -0.17 -0.44 -1.32 0.00 0.00 176.35 174.22 1i8m s SER 12 N -0.48 3.77 0.17 3.68 0.01 -1.26 -0.87 113.70 118.73 1i8m s SER 12 Ca -0.06 -0.29 -0.14 0.00 1.31 0.00 0.00 55.95 56.76 1i8m s SER 12 Cb -0.04 -0.91 0.02 0.00 0.21 0.00 0.00 66.02 65.30 1i8m s SER 12 CO 0.01 0.30 0.42 0.00 0.41 0.00 0.00 173.24 174.38 1i8m s ALA 13 N -0.46 -0.64 0.18 1.44 0.00 -0.51 -4.86 121.76 116.91 1i8m s ALA 13 Ca 0.05 -0.39 0.04 0.00 0.00 0.00 0.00 51.96 51.67 1i8m s ALA 13 Cb -0.12 0.81 -0.04 0.00 0.00 0.00 0.00 23.12 23.77 1i8m s ALA 13 CO 0.02 -0.72 0.21 -1.12 0.00 0.00 0.00 175.76 174.15 1i8m s SER 14 N -2.89 5.85 0.26 0.00 0.01 -1.26 -0.66 113.70 115.01 1i8m s SER 14 Ca 0.10 -0.03 -0.30 0.00 1.31 0.00 0.00 55.95 57.03 1i8m s SER 14 Cb 0.01 -1.62 -0.10 0.00 0.21 0.00 0.00 66.02 64.51 1i8m s SER 14 CO -0.04 0.04 1.49 -0.69 0.41 0.00 0.00 173.24 174.44 1i8m s VAL 15 N -1.81 2.50 0.00 3.43 1.01 -1.26 -1.57 120.40 122.69 1i8m s VAL 15 Ca 0.33 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.72 1i8m s VAL 15 Cb -0.10 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1i8m s VAL 15 CO 0.26 0.06 0.00 0.61 0.00 0.00 0.00 175.10 176.03 1i8m n GLY 16 N 2.26 1.42 3.88 4.51 0.00 0.31 -4.87 105.19 112.70 1i8m n GLY 16 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1i8m n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i8m s GLU 17 N -0.70 3.68 -0.13 1.61 2.12 -0.61 -4.22 118.70 120.45 1i8m s GLU 17 Ca 0.00 0.45 -0.01 0.00 0.36 0.00 0.00 54.97 55.77 1i8m s GLU 17 Cb 0.00 -2.32 -0.02 0.00 0.26 0.00 0.00 34.13 32.05 1i8m s GLU 17 CO 0.00 -0.19 -0.10 0.99 -0.54 0.00 0.00 175.26 175.41 1i8m s THR 18 N -2.64 3.30 0.25 -1.70 2.01 -1.26 -0.16 115.64 115.44 1i8m s THR 18 Ca 0.51 -0.57 0.01 0.00 0.31 0.00 0.00 61.69 61.95 1i8m s THR 18 Cb -0.10 -2.40 -0.05 0.00 0.01 0.00 0.00 72.50 69.95 1i8m s THR 18 CO 0.39 0.52 0.08 0.68 -0.69 0.00 0.00 174.62 175.61 1i8m s VAL 19 N 0.29 0.57 -0.06 3.82 -7.23 -1.04 -4.97 120.40 111.76 1i8m s VAL 19 Ca -0.08 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.07 1i8m s VAL 19 Cb -0.15 -2.57 0.03 0.00 0.56 0.00 0.00 36.38 34.25 1i8m s VAL 19 CO 0.05 -0.06 0.14 -0.89 -0.31 0.00 0.00 175.10 174.02 1i8m s THR 20 N -3.75 -0.04 0.24 5.32 2.01 -1.26 -1.56 115.64 116.61 1i8m s THR 20 Ca 0.36 0.16 0.11 0.00 0.31 0.00 0.00 61.69 62.63 1i8m s THR 20 Cb 0.08 -0.23 -0.05 0.00 0.01 0.00 0.00 72.50 72.31 1i8m s THR 20 CO 0.12 0.07 -0.17 0.27 -0.69 0.00 0.00 174.62 174.21 1i8m s ILE 21 N 1.03 2.65 0.23 1.82 -4.36 -0.20 -4.85 121.20 117.52 1i8m s ILE 21 Ca -0.08 -2.17 0.08 0.00 -0.26 0.00 0.00 60.65 58.22 1i8m s ILE 21 Cb -0.10 -2.35 -0.05 0.00 1.25 0.00 0.00 42.46 41.21 1i8m s ILE 21 CO -0.05 -0.29 -0.13 0.42 0.24 0.00 0.00 174.94 175.13 1i8m s THR 22 N -2.18 1.81 -0.03 8.37 -4.23 0.88 -0.52 115.64 119.75 1i8m s THR 22 Ca 0.27 -2.22 -0.02 0.00 -1.18 0.00 0.00 61.69 58.55 1i8m s THR 22 Cb -0.06 -2.17 0.02 0.00 1.34 0.00 0.00 72.50 71.62 1i8m s THR 22 CO 0.14 -0.50 0.06 0.00 -0.54 0.00 0.00 174.62 173.78 1i8m s ARG 24 N 0.42 2.12 -0.04 0.00 3.52 0.35 -0.67 118.95 124.66 1i8m s ARG 24 Ca -0.03 -0.64 -0.15 0.00 -0.13 0.00 0.00 55.73 54.78 1i8m s ARG 24 Cb -0.05 -1.73 -0.05 0.00 -1.56 0.00 0.00 34.95 31.56 1i8m s ARG 24 CO -0.01 0.18 0.40 0.00 -0.81 0.00 0.00 175.30 175.05 1i8m s ALA 25 N 0.27 3.66 0.35 6.12 0.00 0.10 0.07 121.76 132.33 1i8m s ALA 25 Ca -0.10 -0.25 0.16 0.00 0.00 0.00 0.00 51.96 51.77 1i8m s ALA 25 Cb -0.14 -2.42 0.87 0.00 0.00 0.00 0.00 23.12 21.43 1i8m s ALA 25 CO 0.04 0.37 1.87 0.66 0.00 0.00 0.00 175.76 178.70 1i8m h SER 26 N 5.24 0.00 -4.08 0.00 4.64 -1.46 -3.44 113.55 114.45 1i8m h SER 26 Ca -0.49 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.47 1i8m h SER 26 Cb 1.21 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.13 1i8m h SER 26 CO 0.65 0.31 -0.73 -1.61 -0.87 0.00 0.00 176.83 174.58 1i8m s GLU 27 N -4.14 1.00 0.30 4.77 0.41 -1.26 -5.00 118.70 114.78 1i8m s GLU 27 Ca -0.02 -1.30 -0.30 0.00 -0.41 0.00 0.00 54.97 52.93 1i8m s GLU 27 Cb 0.14 -0.70 -0.12 0.00 -1.78 0.00 0.00 34.13 31.66 1i8m s GLU 27 CO 0.69 0.11 1.51 -1.71 -0.49 0.00 0.00 175.26 175.37 1i8m n ASN 28 N 0.25 3.51 0.00 -0.19 2.85 -1.26 -4.70 115.26 115.71 1i8m n ASN 28 Ca -0.13 1.16 0.00 0.00 -0.11 0.00 0.00 54.58 55.50 1i8m n ASN 28 Cb 0.59 -1.55 0.00 0.00 1.24 0.00 0.00 39.78 40.05 1i8m n ASN 28 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1i8m n ILE 29 N 1.68 0.21 0.00 -1.44 -5.35 0.60 -5.01 119.36 110.06 1i8m n ILE 29 Ca 0.08 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 1i8m n ILE 29 Cb 0.36 0.96 0.00 0.00 -1.74 0.00 0.00 39.64 39.22 1i8m n ILE 29 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1i8m n TYR 30 N -0.11 0.00 -0.72 4.28 4.02 -1.24 -2.01 117.16 121.39 1i8m n TYR 30 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.97 1i8m n TYR 30 Cb 0.42 0.00 0.24 0.00 -0.02 0.00 0.00 39.34 39.98 1i8m n TYR 30 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1i8m n SER 31 N 6.25 3.77 -3.51 7.72 7.64 -1.26 0.91 113.62 135.14 1i8m n SER 31 Ca 0.00 -2.67 -0.40 0.00 1.01 0.00 0.00 58.87 56.81 1i8m n SER 31 Cb 0.00 -0.46 -0.01 0.00 -1.01 0.00 0.00 64.21 62.73 1i8m n SER 31 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1i8m n TYR 32 N -0.02 2.72 -4.61 1.43 4.01 -0.85 -1.58 117.16 118.26 1i8m n TYR 32 Ca 0.19 -2.95 -0.30 0.00 -0.16 0.00 0.00 57.90 54.68 1i8m n TYR 32 Cb 0.77 -2.23 -0.17 0.00 -0.31 0.00 0.00 39.34 37.41 1i8m n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1i8m s LEU 33 N -0.25 1.92 0.14 7.72 2.96 -1.26 -0.63 118.68 129.27 1i8m s LEU 33 Ca 0.57 -0.51 0.07 0.00 -0.22 0.00 0.00 54.13 54.04 1i8m s LEU 33 Cb 0.16 -1.26 -0.04 0.00 0.50 0.00 0.00 46.19 45.55 1i8m s LEU 33 CO -0.07 0.06 -0.02 0.00 -1.32 0.00 0.00 176.35 175.00 1i8m s ALA 34 N 0.86 3.17 -0.04 5.97 0.00 0.16 -0.14 121.76 131.73 1i8m s ALA 34 Ca -0.08 -1.29 0.06 0.00 0.00 0.00 0.00 51.96 50.65 1i8m s ALA 34 Cb -0.15 -1.01 -0.01 0.00 0.00 0.00 0.00 23.12 21.94 1i8m s ALA 34 CO -0.01 0.56 -0.22 -1.58 0.00 0.00 0.00 175.76 174.52 1i8m s TRP 35 N -1.53 2.05 0.05 0.00 0.52 -0.46 -0.56 118.94 119.01 1i8m s TRP 35 Ca 0.26 -0.51 0.09 0.00 0.02 0.00 0.00 56.10 55.96 1i8m s TRP 35 Cb -0.10 -1.34 -0.03 0.00 -1.15 0.00 0.00 33.47 30.85 1i8m s TRP 35 CO 0.17 -0.12 -0.24 0.71 0.02 0.00 0.00 176.95 177.49 1i8m s TYR 36 N -0.28 2.10 -0.11 -1.98 1.51 0.44 -0.38 117.35 118.65 1i8m s TYR 36 Ca 0.02 -0.40 -0.01 0.00 -1.01 0.00 0.00 57.07 55.68 1i8m s TYR 36 Cb -0.11 -1.25 -0.03 0.00 -0.11 0.00 0.00 41.96 40.47 1i8m s TYR 36 CO 0.01 0.12 -0.07 -1.14 -1.11 0.00 0.00 175.55 173.36 1i8m s GLN 37 N -1.26 3.16 -0.09 -0.62 0.74 0.55 -1.23 119.66 120.91 1i8m s GLN 37 Ca 0.10 -0.57 -0.01 0.00 0.05 0.00 0.00 55.36 54.93 1i8m s GLN 37 Cb -0.09 -2.69 0.03 0.00 1.10 0.00 0.00 33.01 31.35 1i8m s GLN 37 CO 0.02 0.44 -0.04 -1.14 -0.55 0.00 0.00 175.29 174.03 1i8m s GLN 38 N -0.20 1.05 0.40 1.67 0.74 0.45 0.17 119.66 123.93 1i8m s GLN 38 Ca 0.02 -0.07 -0.13 0.00 0.05 0.00 0.00 55.36 55.24 1i8m s GLN 38 Cb -0.13 -1.26 -0.07 0.00 1.10 0.00 0.00 33.01 32.64 1i8m s GLN 38 CO 0.03 -0.28 0.80 0.15 -0.55 0.00 0.00 175.29 175.44 1i8m s LYS 39 N 1.83 3.88 0.15 1.67 -0.14 -1.26 -0.93 119.74 124.94 1i8m s LYS 39 Ca 0.05 0.62 -0.34 0.00 -1.36 0.00 0.00 55.97 54.93 1i8m s LYS 39 Cb -0.12 -2.35 -0.14 0.00 -1.68 0.00 0.00 37.83 33.53 1i8m s LYS 39 CO -0.07 -0.03 1.52 0.94 -0.76 0.00 0.00 175.35 176.96 1i8m n GLN 40 N -1.09 1.94 -1.01 1.68 -0.06 -1.26 -1.07 117.38 116.51 1i8m n GLN 40 Ca 0.03 0.70 -0.00 0.00 -2.00 0.00 0.00 57.00 55.73 1i8m n GLN 40 Cb 0.54 -2.44 -0.00 0.00 -4.06 0.00 0.00 30.24 24.28 1i8m n GLN 40 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1i8m n GLY 41 N 3.20 0.16 3.77 1.69 0.00 -1.26 -4.99 105.19 107.76 1i8m n GLY 41 Ca 0.17 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 1i8m n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i8m s LYS 42 N -1.51 2.26 0.38 1.61 -0.14 -0.23 -5.13 119.74 116.97 1i8m s LYS 42 Ca 0.00 -1.85 -0.11 0.00 -1.36 0.00 0.00 55.97 52.65 1i8m s LYS 42 Cb 0.00 -2.02 -0.07 0.00 -1.68 0.00 0.00 37.83 34.06 1i8m s LYS 42 CO 0.00 -0.18 0.75 -1.12 -0.76 0.00 0.00 175.35 174.04 1i8m s SER 43 N -3.96 6.58 0.77 2.83 0.01 -1.26 -4.58 113.70 114.08 1i8m s SER 43 Ca 0.40 1.15 -0.14 0.00 1.31 0.00 0.00 55.95 58.67 1i8m s SER 43 Cb 0.03 -2.33 0.06 0.00 0.21 0.00 0.00 66.02 63.99 1i8m s SER 43 CO 0.22 -0.34 1.18 -2.84 0.41 0.00 0.00 173.24 171.87 1i8m s PRO 44 N -3.63 1.95 -0.01 12.44 0.02 -1.26 -4.57 135.00 139.95 1i8m s PRO 44 Ca 0.52 1.65 0.04 0.00 0.02 0.00 0.00 61.00 63.23 1i8m s PRO 44 Cb -0.10 -1.82 -0.01 0.00 0.02 0.00 0.00 34.50 32.58 1i8m s PRO 44 CO 0.28 -1.95 -0.14 -0.65 -0.33 0.00 0.00 177.00 174.21 1i8m s GLN 45 N -4.15 1.13 0.08 5.54 -1.52 0.13 -4.94 119.66 115.94 1i8m s GLN 45 Ca 0.71 -0.51 -0.31 0.00 -1.95 0.00 0.00 55.36 53.31 1i8m s GLN 45 Cb -0.26 -1.10 -0.06 0.00 -0.22 0.00 0.00 33.01 31.37 1i8m s GLN 45 CO 0.48 0.30 1.22 -1.17 -0.25 0.00 0.00 175.29 175.87 1i8m s LEU 46 N -0.35 4.38 -0.12 2.90 2.96 -1.26 -0.33 118.68 126.86 1i8m s LEU 46 Ca 0.05 2.07 0.00 0.00 -0.22 0.00 0.00 54.13 56.04 1i8m s LEU 46 Cb -0.05 -3.58 -0.07 0.00 0.50 0.00 0.00 46.19 42.98 1i8m s LEU 46 CO -0.00 -0.47 -0.11 0.18 -1.32 0.00 0.00 176.35 174.62 1i8m n LEU 47 N 3.75 2.80 -3.87 -0.68 4.77 0.49 -4.74 117.00 119.53 1i8m n LEU 47 Ca 0.09 -0.04 -0.11 0.00 -0.03 0.00 0.00 56.01 55.91 1i8m n LEU 47 Cb 0.46 -0.40 -0.10 0.00 -2.33 0.00 0.00 43.42 41.05 1i8m n LEU 47 CO 0.56 0.66 -0.16 -0.69 -1.33 0.00 0.00 177.39 176.43 1i8m s VAL 48 N -2.23 0.09 0.08 4.08 1.01 -1.07 -1.03 120.40 121.32 1i8m s VAL 48 Ca -0.16 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.05 1i8m s VAL 48 Cb 0.04 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.90 1i8m s VAL 48 CO 0.26 -0.40 0.11 -0.72 0.00 0.00 0.00 175.10 174.35 1i8m s TYR 49 N -1.55 0.31 -1.55 5.22 -0.85 0.21 -1.35 117.35 117.79 1i8m s TYR 49 Ca -0.13 -0.78 -0.04 0.00 -0.52 0.00 0.00 57.07 55.59 1i8m s TYR 49 Cb -0.07 -0.19 0.01 0.00 0.38 0.00 0.00 41.96 42.09 1i8m s TYR 49 CO 0.01 -0.49 0.46 0.09 -1.52 0.00 0.00 175.55 174.11 1i8m n ASN 50 N -0.00 -5.72 0.00 -0.18 3.02 -1.18 -0.68 115.26 110.52 1i8m n ASN 50 Ca -0.14 -0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.18 1i8m n ASN 50 Cb 0.62 -4.67 0.00 0.00 -0.61 0.00 0.00 39.78 35.12 1i8m n ASN 50 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i8m n ALA 51 N -3.24 0.00 -0.55 5.41 0.00 0.80 -3.90 120.51 119.04 1i8m n ALA 51 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1i8m n ALA 51 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1i8m n ALA 51 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1i8m n LYS 52 N -0.20 0.23 -3.12 0.00 -0.00 -1.20 -2.48 118.16 111.39 1i8m n LYS 52 Ca 0.00 -0.12 -0.41 0.00 -0.00 0.00 0.00 58.31 57.78 1i8m n LYS 52 Cb 0.00 -0.54 -0.07 0.00 -0.00 0.00 0.00 35.03 34.42 1i8m n LYS 52 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1i8m s THR 53 N -0.07 4.94 0.05 0.58 2.01 0.14 -4.66 115.64 118.64 1i8m s THR 53 Ca 0.00 0.88 -0.31 0.00 0.31 0.00 0.00 61.69 62.58 1i8m s THR 53 Cb 0.00 -3.99 -0.05 0.00 0.01 0.00 0.00 72.50 68.47 1i8m s THR 53 CO 0.00 -0.12 1.17 -0.76 -0.69 0.00 0.00 174.62 174.22 1i8m s LEU 54 N 2.59 4.37 0.88 4.42 1.43 -1.26 -0.62 118.68 130.49 1i8m s LEU 54 Ca 0.25 1.97 -0.11 0.00 -1.03 0.00 0.00 54.13 55.22 1i8m s LEU 54 Cb -0.15 -3.58 0.12 0.00 0.03 0.00 0.00 46.19 42.61 1i8m s LEU 54 CO 0.11 -0.45 1.11 0.00 0.23 0.00 0.00 176.35 177.36 1i8m s ALA 55 N 1.06 1.64 0.38 4.21 0.00 -0.20 -4.91 121.76 123.94 1i8m s ALA 55 Ca 0.58 0.36 -0.27 0.00 0.00 0.00 0.00 51.96 52.63 1i8m s ALA 55 Cb -0.28 -3.35 -0.11 0.00 0.00 0.00 0.00 23.12 19.38 1i8m s ALA 55 CO 0.29 -2.43 1.33 0.39 0.00 0.00 0.00 175.76 175.35 1i8m n GLU 56 N -3.98 2.19 0.00 0.00 -0.58 -1.26 -2.32 120.64 114.68 1i8m n GLU 56 Ca 0.10 0.77 0.00 0.00 -0.42 0.00 0.00 57.16 57.61 1i8m n GLU 56 Cb 0.53 -2.43 0.00 0.00 -0.57 0.00 0.00 31.44 28.96 1i8m n GLU 56 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1i8m n GLY 57 N 0.70 3.03 3.70 0.62 0.00 -1.26 -5.00 105.19 106.98 1i8m n GLY 57 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1i8m n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i8m s VAL 58 N -1.44 3.53 0.69 1.61 1.01 -0.98 -4.98 120.40 119.83 1i8m s VAL 58 Ca 0.00 0.99 -0.17 0.00 0.00 0.00 0.00 61.98 62.80 1i8m s VAL 58 Cb 0.00 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.76 1i8m s VAL 58 CO 0.00 0.02 1.27 -2.65 0.00 0.00 0.00 175.10 173.74 1i8m n PRO 59 N 4.95 0.89 0.08 2.72 -0.02 -1.26 -4.90 135.00 137.46 1i8m n PRO 59 Ca 0.13 0.37 0.10 0.00 -2.02 0.00 0.00 63.50 62.07 1i8m n PRO 59 Cb 0.43 -2.51 0.42 0.00 -0.02 0.00 0.00 33.50 31.83 1i8m n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1i8m n SER 60 N -2.21 0.42 0.09 2.55 3.41 -1.26 -2.53 113.62 114.09 1i8m n SER 60 Ca 0.15 0.60 0.09 0.00 -0.26 0.00 0.00 58.87 59.46 1i8m n SER 60 Cb 0.49 -0.69 0.41 0.00 -0.26 0.00 0.00 64.21 64.15 1i8m n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1i8m n ARG 61 N -1.96 0.12 -3.02 4.33 1.85 -1.26 -4.56 116.66 112.14 1i8m n ARG 61 Ca 0.03 0.43 -0.40 0.00 -1.00 0.00 0.00 57.85 56.91 1i8m n ARG 61 Cb 0.21 -1.75 -0.05 0.00 -1.05 0.00 0.00 32.46 29.81 1i8m n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1i8m s PHE 62 N -3.24 3.77 -0.20 2.89 0.08 -1.05 -0.23 117.98 120.00 1i8m s PHE 62 Ca 0.03 1.46 -0.04 0.00 0.12 0.00 0.00 56.93 58.51 1i8m s PHE 62 Cb 0.08 -2.77 0.10 0.00 -0.57 0.00 0.00 43.02 39.86 1i8m s PHE 62 CO 0.28 0.35 0.29 0.45 -0.10 0.00 0.00 175.22 176.49 1i8m s SER 63 N -0.35 0.70 0.13 1.36 0.15 0.17 -4.99 113.70 110.87 1i8m s SER 63 Ca 0.37 0.17 0.03 0.00 0.70 0.00 0.00 55.95 57.22 1i8m s SER 63 Cb -0.21 0.73 -0.04 0.00 -1.71 0.00 0.00 66.02 64.80 1i8m s SER 63 CO 0.23 -0.29 0.20 -0.83 1.20 0.00 0.00 173.24 173.75 1i8m s GLY 64 N 2.43 1.83 0.37 9.45 0.00 -1.26 0.74 107.32 120.88 1i8m s GLY 64 Ca 0.07 -1.05 -0.15 0.00 0.00 0.00 0.00 44.72 43.59 1i8m s GLY 64 CO -0.12 -1.05 0.74 -1.35 0.00 0.00 0.00 173.10 171.32 1i8m s SER 65 N -2.96 0.08 0.00 1.64 1.04 -0.14 -4.31 113.70 109.05 1i8m s SER 65 Ca 0.33 -1.13 0.00 0.00 0.48 0.00 0.00 55.95 55.63 1i8m s SER 65 Cb -0.11 0.82 0.00 0.00 0.10 0.00 0.00 66.02 66.82 1i8m s SER 65 CO 0.26 -1.61 0.00 0.61 0.98 0.00 0.00 173.24 173.48 1i8m n GLY 66 N -0.53 1.33 3.57 7.32 0.00 -1.26 -1.74 105.19 113.87 1i8m n GLY 66 Ca -0.07 -2.03 -0.08 0.00 0.00 0.00 0.00 46.02 43.84 1i8m n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i8m s SER 67 N 0.00 -0.29 0.00 1.61 1.04 -1.17 -4.81 113.70 110.08 1i8m s SER 67 Ca 0.00 0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.62 1i8m s SER 67 Cb 0.00 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1i8m s SER 67 CO 0.00 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.47 1i8m n GLY 68 N 0.30 1.23 0.00 7.32 0.00 0.26 -3.95 105.19 110.35 1i8m n GLY 68 Ca -0.07 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1i8m n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1i8m n THR 69 N 0.00 0.00 -4.36 2.61 -2.24 -1.26 -0.29 114.28 108.74 1i8m n THR 69 Ca 0.00 -0.08 -0.33 0.00 -2.27 0.00 0.00 64.05 61.37 1i8m n THR 69 Cb 0.00 0.78 -0.16 0.00 -2.10 0.00 0.00 70.33 68.85 1i8m n THR 69 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1i8m s GLN 70 N -0.26 3.05 0.11 -0.78 -1.52 -1.25 0.01 119.66 119.01 1i8m s GLN 70 Ca 0.00 -0.82 0.05 0.00 -1.95 0.00 0.00 55.36 52.64 1i8m s GLN 70 Cb 0.00 -2.56 -0.04 0.00 -0.22 0.00 0.00 33.01 30.20 1i8m s GLN 70 CO 0.00 -0.11 -0.11 -0.06 -0.25 0.00 0.00 175.29 174.75 1i8m s PHE 71 N 1.07 1.20 0.02 0.91 0.40 0.16 -3.04 117.98 118.70 1i8m s PHE 71 Ca -0.01 -0.63 0.00 0.00 -0.60 0.00 0.00 56.93 55.70 1i8m s PHE 71 Cb -0.14 -0.64 -0.02 0.00 0.51 0.00 0.00 43.02 42.73 1i8m s PHE 71 CO -0.07 0.06 -0.04 -1.54 0.70 0.00 0.00 175.22 174.33 1i8m s SER 72 N -2.51 0.33 -0.13 1.36 1.04 -0.71 -1.16 113.70 111.92 1i8m s SER 72 Ca 0.08 -0.47 0.01 0.00 0.48 0.00 0.00 55.95 56.05 1i8m s SER 72 Cb -0.03 0.08 0.02 0.00 0.10 0.00 0.00 66.02 66.19 1i8m s SER 72 CO 0.01 -0.26 -0.17 -0.22 0.98 0.00 0.00 173.24 173.58 1i8m s LEU 73 N -1.37 1.85 -0.05 2.42 2.96 0.32 -0.96 118.68 123.85 1i8m s LEU 73 Ca -0.14 -0.51 0.04 0.00 -0.22 0.00 0.00 54.13 53.30 1i8m s LEU 73 Cb -0.09 -1.24 -0.03 0.00 0.50 0.00 0.00 46.19 45.33 1i8m s LEU 73 CO -0.01 0.01 -0.15 -0.75 -1.32 0.00 0.00 176.35 174.14 1i8m s LYS 74 N 1.11 2.53 -0.22 1.98 2.20 0.23 -1.03 119.74 126.54 1i8m s LYS 74 Ca -0.02 -0.70 0.01 0.00 -0.36 0.00 0.00 55.97 54.90 1i8m s LYS 74 Cb -0.14 -2.38 0.05 0.00 -1.51 0.00 0.00 37.83 33.85 1i8m s LYS 74 CO -0.05 0.60 -0.10 0.42 -0.36 0.00 0.00 175.35 175.86 1i8m s ILE 75 N -0.68 1.80 -0.08 5.43 1.01 -0.60 0.43 121.20 128.52 1i8m s ILE 75 Ca 0.10 -1.22 -0.24 0.00 0.00 0.00 0.00 60.65 59.29 1i8m s ILE 75 Cb -0.11 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 1i8m s ILE 75 CO 0.01 0.09 0.75 0.20 0.00 0.00 0.00 174.94 175.98 1i8m s ASN 76 N 1.30 7.02 -0.58 3.58 0.01 0.68 -2.51 114.94 124.44 1i8m s ASN 76 Ca -0.04 1.23 -0.17 0.00 -0.71 0.00 0.00 52.86 53.17 1i8m s ASN 76 Cb -0.18 -2.43 0.02 0.00 0.41 0.00 0.00 41.25 39.08 1i8m s ASN 76 CO -0.07 -0.17 0.64 -0.24 -1.51 0.00 0.00 177.10 175.75 1i8m n SER 77 N 4.02 -6.50 -4.63 -1.22 2.88 -1.15 -4.80 113.62 102.22 1i8m n SER 77 Ca 0.00 -0.13 -0.43 0.00 -1.33 0.00 0.00 58.87 56.99 1i8m n SER 77 Cb 0.51 -3.42 -0.00 0.00 -0.75 0.00 0.00 64.21 60.54 1i8m n SER 77 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1i8m n LEU 78 N -1.07 2.63 -4.65 2.46 4.77 0.78 -4.42 117.00 117.50 1i8m n LEU 78 Ca -0.06 1.15 -0.24 0.00 -0.03 0.00 0.00 56.01 56.83 1i8m n LEU 78 Cb 0.59 -1.37 -0.08 0.00 -2.33 0.00 0.00 43.42 40.23 1i8m n LEU 78 CO 0.55 -1.12 -0.30 -1.10 -1.33 0.00 0.00 177.39 174.09 1i8m s GLN 79 N -1.80 2.21 0.28 3.23 -1.52 -1.26 0.11 119.66 120.90 1i8m s GLN 79 Ca 0.59 -1.56 0.01 0.00 -1.95 0.00 0.00 55.36 52.44 1i8m s GLN 79 Cb -0.61 -2.07 0.64 0.00 -0.22 0.00 0.00 33.01 30.74 1i8m s GLN 79 CO 0.60 0.24 1.68 -1.35 -0.25 0.00 0.00 175.29 176.21 1i8m h PRO 80 N 1.81 0.31 0.00 2.91 0.11 -1.99 -0.07 132.00 135.09 1i8m h PRO 80 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1i8m h PRO 80 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1i8m h PRO 80 CO 0.63 0.20 0.00 -0.85 -0.21 0.00 0.00 178.00 177.77 1i8m n GLU 81 N -5.12 0.19 0.09 1.05 0.00 -1.26 -3.10 120.64 112.48 1i8m n GLU 81 Ca 0.19 0.16 0.12 0.00 0.00 0.00 0.00 57.16 57.63 1i8m n GLU 81 Cb 0.60 -1.50 0.18 0.00 0.00 0.00 0.00 31.44 30.72 1i8m n GLU 81 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1i8m h ASP 82 N 0.00 0.00 -3.94 -1.84 3.32 -1.40 -3.47 116.42 109.10 1i8m h ASP 82 Ca 0.00 -0.13 -0.48 0.00 0.02 0.00 0.00 57.03 56.43 1i8m h ASP 82 Cb 0.11 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.68 1i8m h ASP 82 CO 0.00 0.07 0.41 -0.36 -1.72 0.00 0.00 179.24 177.64 1i8m s PHE 83 N -3.19 3.33 -5.00 4.55 0.08 -1.18 -4.87 117.98 111.70 1i8m s PHE 83 Ca 0.06 1.66 0.00 0.00 0.12 0.00 0.00 56.93 58.77 1i8m s PHE 83 Cb 0.12 -3.13 0.00 0.00 -0.57 0.00 0.00 43.02 39.44 1i8m s PHE 83 CO 0.71 -0.56 0.00 0.41 -0.10 0.00 0.00 175.22 175.67 1i8m n GLY 84 N 0.46 0.47 3.92 4.36 0.00 -0.71 -4.88 105.19 108.81 1i8m n GLY 84 Ca 0.04 -1.60 -0.28 0.00 0.00 0.00 0.00 46.02 44.17 1i8m n GLY 84 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1i8m s SER 85 N -4.00 6.28 -0.06 1.61 0.01 -0.10 -0.35 113.70 117.08 1i8m s SER 85 Ca 0.00 0.19 0.02 0.00 1.31 0.00 0.00 55.95 57.47 1i8m s SER 85 Cb 0.00 -1.89 0.02 0.00 0.21 0.00 0.00 66.02 64.35 1i8m s SER 85 CO 0.00 0.10 -0.10 -0.31 0.41 0.00 0.00 173.24 173.34 1i8m s TYR 86 N -1.64 1.26 -0.05 2.43 1.51 0.33 -0.41 117.35 120.78 1i8m s TYR 86 Ca 0.34 -0.44 0.05 0.00 -1.01 0.00 0.00 57.07 56.01 1i8m s TYR 86 Cb -0.12 -0.95 -0.01 0.00 -0.11 0.00 0.00 41.96 40.77 1i8m s TYR 86 CO 0.28 -0.25 -0.21 0.71 -1.11 0.00 0.00 175.55 174.97 1i8m s TYR 87 N 0.72 2.06 0.24 2.71 1.51 -0.37 -0.58 117.35 123.64 1i8m s TYR 87 Ca -0.14 -0.58 0.03 0.00 -1.01 0.00 0.00 57.07 55.37 1i8m s TYR 87 Cb -0.15 -1.36 -0.03 0.00 -0.11 0.00 0.00 41.96 40.30 1i8m s TYR 87 CO 0.03 -0.18 0.39 0.00 -1.11 0.00 0.00 175.55 174.68 1i8m s GLN 89 N -3.86 0.69 0.29 0.00 0.74 0.27 -0.17 119.66 117.61 1i8m s GLN 89 Ca 0.36 1.18 -0.19 0.00 0.05 0.00 0.00 55.36 56.76 1i8m s GLN 89 Cb -0.10 0.13 -0.09 0.00 1.10 0.00 0.00 33.01 34.06 1i8m s GLN 89 CO 0.30 -0.15 0.77 -3.38 -0.55 0.00 0.00 175.29 172.28 1i8m s HIS 90 N 1.58 3.53 -0.45 1.67 -3.43 -1.18 0.36 115.29 117.37 1i8m s HIS 90 Ca -0.10 1.39 0.09 0.00 -0.80 0.00 0.00 55.06 55.64 1i8m s HIS 90 Cb -0.05 -2.64 0.39 0.00 -1.43 0.00 0.00 32.58 28.85 1i8m s HIS 90 CO -0.19 0.20 0.97 -2.39 -2.00 0.00 0.00 174.74 171.34 1i8m n HIS 91 N 0.21 2.66 -3.44 0.38 1.44 0.20 -4.36 115.22 112.30 1i8m n HIS 91 Ca 0.01 -3.41 -0.34 0.00 -2.01 0.00 0.00 57.72 51.96 1i8m n HIS 91 Cb 0.52 -0.31 -0.06 0.00 0.12 0.00 0.00 29.99 30.27 1i8m n HIS 91 CO 0.00 0.00 0.00 0.98 -2.81 0.00 0.00 176.34 174.51 1i8m n TYR 92 N -0.22 3.57 -0.65 -1.40 -0.00 -1.26 -4.91 117.16 112.30 1i8m n TYR 92 Ca 0.29 -3.80 0.09 0.00 -0.00 0.00 0.00 57.90 54.47 1i8m n TYR 92 Cb 0.61 -0.97 -0.03 0.00 -0.00 0.00 0.00 39.34 38.96 1i8m n TYR 92 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1i8m n GLY 93 N 1.62 -1.93 3.96 2.98 0.00 -1.26 -4.92 105.19 105.64 1i8m n GLY 93 Ca 0.25 -1.34 -0.22 0.00 0.00 0.00 0.00 46.02 44.71 1i8m n GLY 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i8m s THR 94 N -2.10 5.22 0.40 2.61 -4.23 -1.26 -4.26 115.64 112.02 1i8m s THR 94 Ca 0.00 -0.82 -0.23 0.00 -1.18 0.00 0.00 61.69 59.46 1i8m s THR 94 Cb 0.00 -3.85 -0.10 0.00 1.34 0.00 0.00 72.50 69.89 1i8m s THR 94 CO 0.00 -0.37 0.99 -2.16 -0.54 0.00 0.00 174.62 172.54 1i8m s PRO 95 N -3.99 4.26 0.36 3.99 0.04 -1.26 -5.10 135.00 133.29 1i8m s PRO 95 Ca 0.36 1.32 -0.25 0.00 0.04 0.00 0.00 61.00 62.47 1i8m s PRO 95 Cb -0.09 -2.45 -0.10 0.00 0.04 0.00 0.00 34.50 31.90 1i8m s PRO 95 CO 0.31 -0.02 0.99 -0.51 0.04 0.00 0.00 177.00 177.81 1i8m s LEU 96 N -2.74 4.25 0.02 -3.56 2.01 -1.26 -4.89 118.68 112.50 1i8m s LEU 96 Ca 0.58 1.93 0.01 0.00 0.01 0.00 0.00 54.13 56.66 1i8m s LEU 96 Cb -0.16 -4.09 -0.02 0.00 0.01 0.00 0.00 46.19 41.93 1i8m s LEU 96 CO 0.21 -0.25 -0.04 0.42 1.01 0.00 0.00 176.35 177.69 1i8m s THR 97 N -1.64 0.27 0.19 5.49 -4.23 -1.26 -5.06 115.64 109.39 1i8m s THR 97 Ca 0.54 -0.72 0.07 0.00 -1.18 0.00 0.00 61.69 60.40 1i8m s THR 97 Cb -0.20 -0.34 -0.04 0.00 1.34 0.00 0.00 72.50 73.26 1i8m s THR 97 CO 0.25 -0.29 0.06 -0.36 -0.54 0.00 0.00 174.62 173.74 1i8m s PHE 98 N -1.01 2.96 0.98 3.99 0.08 -1.26 -3.07 117.98 120.64 1i8m s PHE 98 Ca -0.09 -0.10 -0.14 0.00 0.12 0.00 0.00 56.93 56.72 1i8m s PHE 98 Cb -0.07 -1.41 0.18 0.00 -0.57 0.00 0.00 43.02 41.15 1i8m s PHE 98 CO -0.00 0.53 1.17 0.20 -0.10 0.00 0.00 175.22 177.01 1i8m s GLY 99 N -3.15 1.61 0.00 4.36 0.00 0.76 -4.50 107.32 106.40 1i8m s GLY 99 Ca 0.29 -0.73 0.29 0.00 0.00 0.00 0.00 44.72 44.58 1i8m s GLY 99 CO 0.21 -0.07 1.92 0.00 0.00 0.00 0.00 173.10 175.16 1i8m n ALA 100 N -3.96 2.55 0.00 3.20 0.00 -1.26 -4.72 120.51 116.32 1i8m n ALA 100 Ca 0.09 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1i8m n ALA 100 Cb 0.59 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1i8m n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i8m n GLY 101 N 1.40 1.33 2.98 0.00 0.00 -1.26 -5.02 105.19 104.62 1i8m n GLY 101 Ca 0.10 -1.79 -0.26 0.00 0.00 0.00 0.00 46.02 44.07 1i8m n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i8m s THR 102 N -2.91 1.13 -0.33 2.61 2.01 0.25 -4.63 115.64 113.78 1i8m s THR 102 Ca 0.00 -0.43 -0.14 0.00 0.31 0.00 0.00 61.69 61.44 1i8m s THR 102 Cb 0.00 -1.08 -0.02 0.00 0.01 0.00 0.00 72.50 71.41 1i8m s THR 102 CO 0.00 0.37 0.29 -0.75 -0.69 0.00 0.00 174.62 173.84 1i8m s LYS 103 N 1.09 3.64 -0.43 4.92 2.20 -0.64 -0.51 119.74 130.00 1i8m s LYS 103 Ca -0.06 -0.44 -0.12 0.00 -0.36 0.00 0.00 55.97 54.98 1i8m s LYS 103 Cb -0.14 -3.77 0.07 0.00 -1.51 0.00 0.00 37.83 32.47 1i8m s LYS 103 CO -0.01 -0.42 0.31 -1.17 -0.36 0.00 0.00 175.35 173.69 1i8m s LEU 104 N 1.88 5.29 0.23 5.43 2.96 0.52 -1.55 118.68 133.44 1i8m s LEU 104 Ca 0.09 -1.36 0.07 0.00 -0.22 0.00 0.00 54.13 52.71 1i8m s LEU 104 Cb -0.17 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.41 1i8m s LEU 104 CO 0.11 -0.56 0.17 -1.61 -1.32 0.00 0.00 176.35 173.14 1i8m s GLU 105 N 1.53 2.88 0.19 1.98 2.02 -0.05 -1.74 118.70 125.52 1i8m s GLU 105 Ca 0.03 -1.04 -0.30 0.00 0.02 0.00 0.00 54.97 53.69 1i8m s GLU 105 Cb -0.23 -2.55 -0.08 0.00 0.10 0.00 0.00 34.13 31.37 1i8m s GLU 105 CO 0.05 0.42 1.01 -0.51 0.02 0.00 0.00 175.26 176.24 1i8m s LEU 106 N -3.66 4.55 -0.01 1.80 1.43 -1.26 -1.42 118.68 120.12 1i8m s LEU 106 Ca 0.32 1.99 -0.13 0.00 -1.03 0.00 0.00 54.13 55.28 1i8m s LEU 106 Cb -0.08 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.48 1i8m s LEU 106 CO 0.24 -0.04 0.37 -1.59 0.23 0.00 0.00 176.35 175.56 1i8m s LYS 107 N -0.68 3.82 0.31 1.70 0.00 0.16 -4.74 119.74 120.30 1i8m s LYS 107 Ca 0.45 0.29 -0.05 0.00 0.00 0.00 0.00 55.97 56.66 1i8m s LYS 107 Cb -0.27 -3.18 -0.00 0.00 0.00 0.00 0.00 37.83 34.38 1i8m s LYS 107 CO 0.33 0.69 0.45 -0.98 0.00 0.00 0.00 175.35 175.84 1i8m s ARG 108 N -1.21 1.76 0.57 1.78 1.70 -1.26 -4.75 118.95 117.54 1i8m s ARG 108 Ca 0.24 -1.61 -0.17 0.00 -0.47 0.00 0.00 55.73 53.72 1i8m s ARG 108 Cb -0.16 0.44 -0.05 0.00 -0.57 0.00 0.00 34.95 34.62 1i8m s ARG 108 CO 0.13 -0.72 1.06 0.00 -1.08 0.00 0.00 175.30 174.68 1i8m s ALA 109 N -3.39 2.76 0.53 7.88 0.00 -1.26 -4.98 121.76 123.30 1i8m s ALA 109 Ca 0.29 0.47 -0.22 0.00 0.00 0.00 0.00 51.96 52.50 1i8m s ALA 109 Cb 0.00 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.82 1i8m s ALA 109 CO 0.16 -0.71 1.25 -0.25 0.00 0.00 0.00 175.76 176.22 1i8m n ASP 110 N -1.76 2.23 -3.71 0.00 8.00 -1.26 -4.81 116.55 115.24 1i8m n ASP 110 Ca 0.09 0.97 -0.11 0.00 0.71 0.00 0.00 54.79 56.45 1i8m n ASP 110 Cb 0.53 -1.52 -0.11 0.00 -0.02 0.00 0.00 41.12 39.99 1i8m n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1i8m s ALA 111 N -1.31 -0.88 0.43 2.24 0.00 0.17 -4.90 121.76 117.51 1i8m s ALA 111 Ca 0.70 1.31 -0.23 0.00 0.00 0.00 0.00 51.96 53.75 1i8m s ALA 111 Cb -0.44 -0.80 -0.08 0.00 0.00 0.00 0.00 23.12 21.79 1i8m s ALA 111 CO 0.51 -0.23 1.08 0.00 0.00 0.00 0.00 175.76 177.11 1i8m s ALA 112 N 1.24 3.02 0.53 0.00 0.00 -1.26 -0.79 121.76 124.50 1i8m s ALA 112 Ca -0.09 0.74 -0.19 0.00 0.00 0.00 0.00 51.96 52.42 1i8m s ALA 112 Cb -0.08 -3.30 -0.06 0.00 0.00 0.00 0.00 23.12 19.68 1i8m s ALA 112 CO -0.10 -0.34 1.11 -1.25 0.00 0.00 0.00 175.76 175.17 1i8m s PRO 113 N -2.68 3.45 -0.42 0.00 0.04 -1.26 -4.57 135.00 129.55 1i8m s PRO 113 Ca 0.61 1.54 -0.18 0.00 0.04 0.00 0.00 61.00 63.01 1i8m s PRO 113 Cb -0.23 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.31 1i8m s PRO 113 CO 0.28 -0.76 0.47 0.99 0.04 0.00 0.00 177.00 178.02 1i8m s THR 114 N -1.84 5.04 -0.19 1.26 2.01 -0.33 -4.85 115.64 116.74 1i8m s THR 114 Ca 0.71 -0.24 -0.09 0.00 0.31 0.00 0.00 61.69 62.38 1i8m s THR 114 Cb -0.22 -4.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.18 1i8m s THR 114 CO 0.26 -0.44 0.12 -0.69 -0.69 0.00 0.00 174.62 173.18 1i8m s VAL 115 N 2.26 5.35 -0.03 3.82 1.01 -1.26 -0.94 120.40 130.61 1i8m s VAL 115 Ca 0.14 0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.32 1i8m s VAL 115 Cb -0.16 -3.43 -0.00 0.00 0.00 0.00 0.00 36.38 32.79 1i8m s VAL 115 CO 0.14 0.46 -0.13 -0.44 0.00 0.00 0.00 175.10 175.14 1i8m s SER 116 N 0.22 1.62 0.05 3.32 0.01 -0.25 -4.98 113.70 113.69 1i8m s SER 116 Ca 0.08 -0.26 0.08 0.00 1.31 0.00 0.00 55.95 57.17 1i8m s SER 116 Cb -0.11 -0.38 -0.03 0.00 0.21 0.00 0.00 66.02 65.71 1i8m s SER 116 CO -0.01 0.12 -0.21 -0.51 0.41 0.00 0.00 173.24 173.04 1i8m s ILE 117 N 0.02 2.57 -0.05 1.44 2.07 -1.26 -0.72 121.20 125.26 1i8m s ILE 117 Ca -0.01 -1.28 0.01 0.00 -1.41 0.00 0.00 60.65 57.95 1i8m s ILE 117 Cb -0.09 -2.06 0.02 0.00 0.13 0.00 0.00 42.46 40.46 1i8m s ILE 117 CO 0.01 0.33 -0.05 -0.36 -1.91 0.00 0.00 174.94 172.96 1i8m s PHE 118 N -0.90 0.86 0.74 3.50 0.40 0.20 -4.98 117.98 117.79 1i8m s PHE 118 Ca 0.14 -0.27 -0.11 0.00 -0.60 0.00 0.00 56.93 56.09 1i8m s PHE 118 Cb -0.10 -0.75 0.03 0.00 0.51 0.00 0.00 43.02 42.71 1i8m s PHE 118 CO 0.04 -0.23 1.09 -1.25 0.70 0.00 0.00 175.22 175.58 1i8m s PRO 119 N 1.04 2.58 0.51 0.24 0.04 -1.26 -1.39 135.00 136.76 1i8m s PRO 119 Ca -0.09 0.56 -0.21 0.00 0.04 0.00 0.00 61.00 61.30 1i8m s PRO 119 Cb -0.14 -1.98 -0.08 0.00 0.04 0.00 0.00 34.50 32.33 1i8m s PRO 119 CO -0.01 -1.25 0.86 -2.30 0.04 0.00 0.00 177.00 174.35 1i8m n PRO 120 N -3.17 0.98 -2.90 0.56 -0.02 -1.12 -4.80 135.00 124.52 1i8m n PRO 120 Ca 0.07 0.36 -0.35 0.00 -2.02 0.00 0.00 63.50 61.57 1i8m n PRO 120 Cb 0.57 -1.98 -0.07 0.00 -0.02 0.00 0.00 33.50 32.00 1i8m n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1i8m s SER 121 N -1.01 7.05 0.34 2.55 1.04 -1.26 -4.93 113.70 117.48 1i8m s SER 121 Ca 0.68 1.63 0.07 0.00 0.48 0.00 0.00 55.95 58.81 1i8m s SER 121 Cb -0.49 -2.51 0.74 0.00 0.10 0.00 0.00 66.02 63.86 1i8m s SER 121 CO 0.53 -0.20 1.87 0.77 0.98 0.00 0.00 173.24 177.20 1i8m h SER 122 N 2.54 0.72 0.02 7.02 4.64 -1.99 -1.08 113.55 125.42 1i8m h SER 122 Ca -0.48 0.04 0.03 0.00 -0.47 0.00 0.00 61.79 60.91 1i8m h SER 122 Cb 1.18 -0.11 -0.05 0.00 -0.31 0.00 0.00 62.40 63.11 1i8m h SER 122 CO 0.63 0.38 -0.42 -0.33 -0.87 0.00 0.00 176.83 176.23 1i8m h GLU 123 N 0.78 -0.56 -0.91 4.77 3.07 -1.99 -2.17 114.58 117.56 1i8m h GLU 123 Ca 0.45 0.04 0.01 0.00 -0.50 0.00 0.00 59.36 59.35 1i8m h GLU 123 Cb 0.62 0.13 -0.04 0.00 -0.84 0.00 0.00 28.75 28.61 1i8m h GLU 123 CO -0.21 -0.38 0.59 0.37 -1.40 0.00 0.00 179.01 177.98 1i8m h GLN 124 N -0.59 1.20 -0.69 2.33 4.15 -1.62 -2.01 115.11 117.88 1i8m h GLN 124 Ca 0.04 -0.08 0.11 0.00 0.77 0.00 0.00 58.65 59.49 1i8m h GLN 124 Cb 0.66 -0.27 -0.04 0.00 0.21 0.00 0.00 27.48 28.04 1i8m h GLN 124 CO -0.31 0.81 0.46 -0.07 -1.93 0.00 0.00 178.83 177.79 1i8m h LEU 125 N 1.23 0.47 -1.89 -2.39 3.38 -0.70 0.33 115.31 115.74 1i8m h LEU 125 Ca 0.33 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1i8m h LEU 125 Cb -0.12 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.54 1i8m h LEU 125 CO -0.07 0.27 0.00 0.71 0.09 0.00 0.00 178.44 179.44 1i8m h THR 126 N 0.51 0.00 -0.05 0.22 1.35 -0.75 -2.29 112.91 111.90 1i8m h THR 126 Ca 0.32 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.89 1i8m h THR 126 Cb 0.57 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 1i8m h THR 126 CO -0.11 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 173.62 1i8m n SER 127 N -2.96 2.08 0.00 5.36 3.41 0.12 -4.93 113.62 116.70 1i8m n SER 127 Ca -0.01 -1.70 0.00 0.00 -0.26 0.00 0.00 58.87 56.90 1i8m n SER 127 Cb 0.21 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1i8m n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i8m n GLY 128 N 1.24 0.47 3.73 5.00 0.00 -0.86 -5.06 105.19 109.72 1i8m n GLY 128 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 1i8m n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i8m s GLY 129 N -1.58 1.68 -0.26 -0.02 0.00 -1.20 -0.44 107.32 105.49 1i8m s GLY 129 Ca 0.00 -1.64 -0.01 0.00 0.00 0.00 0.00 44.72 43.07 1i8m s GLY 129 CO 0.00 -1.65 0.32 0.00 0.00 0.00 0.00 173.10 171.77 1i8m s ALA 130 N -2.30 -0.68 -0.15 3.20 0.00 0.11 -3.22 121.76 118.72 1i8m s ALA 130 Ca 0.34 0.14 -0.05 0.00 0.00 0.00 0.00 51.96 52.39 1i8m s ALA 130 Cb -0.06 -1.73 -0.04 0.00 0.00 0.00 0.00 23.12 21.30 1i8m s ALA 130 CO 0.22 -1.53 0.02 -1.12 0.00 0.00 0.00 175.76 173.36 1i8m s SER 131 N 2.42 5.34 -0.17 0.00 0.01 -1.26 -0.00 113.70 120.04 1i8m s SER 131 Ca 0.10 0.06 -0.03 0.00 1.31 0.00 0.00 55.95 57.39 1i8m s SER 131 Cb -0.14 -1.79 -0.02 0.00 0.21 0.00 0.00 66.02 64.27 1i8m s SER 131 CO -0.25 0.24 -0.06 -0.69 0.41 0.00 0.00 173.24 172.89 1i8m s VAL 132 N -0.02 3.53 -0.01 3.43 1.01 0.86 -2.81 120.40 126.38 1i8m s VAL 132 Ca 0.04 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.60 1i8m s VAL 132 Cb -0.13 -2.55 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 1i8m s VAL 132 CO 0.02 0.48 -0.15 -0.69 0.00 0.00 0.00 175.10 174.76 1i8m s VAL 133 N 0.68 3.01 -0.06 2.92 1.01 -0.49 -0.16 120.40 127.30 1i8m s VAL 133 Ca -0.03 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.07 1i8m s VAL 133 Cb -0.15 -2.21 0.02 0.00 0.00 0.00 0.00 36.38 34.04 1i8m s VAL 133 CO 0.02 0.49 -0.05 0.00 0.00 0.00 0.00 175.10 175.57 1i8m s PHE 135 N 1.27 3.19 -0.46 0.00 0.08 0.10 -1.12 117.98 121.03 1i8m s PHE 135 Ca -0.05 0.00 0.02 0.00 0.12 0.00 0.00 56.93 57.02 1i8m s PHE 135 Cb -0.14 -2.01 0.12 0.00 -0.57 0.00 0.00 43.02 40.43 1i8m s PHE 135 CO -0.02 0.16 0.21 -0.51 -0.10 0.00 0.00 175.22 174.96 1i8m s LEU 136 N 0.18 4.75 -0.03 -0.37 1.02 0.53 -1.09 118.68 123.67 1i8m s LEU 136 Ca 0.03 -2.57 -0.01 0.00 0.02 0.00 0.00 54.13 51.59 1i8m s LEU 136 Cb -0.13 -1.70 -0.04 0.00 0.02 0.00 0.00 46.19 44.35 1i8m s LEU 136 CO 0.01 -0.35 0.07 0.20 0.02 0.00 0.00 176.35 176.31 1i8m s ASN 137 N 0.56 5.68 -1.07 2.29 0.02 -0.12 -0.30 114.94 122.01 1i8m s ASN 137 Ca 0.14 0.19 -0.17 0.00 -1.02 0.00 0.00 52.86 51.99 1i8m s ASN 137 Cb -0.22 -1.65 -0.01 0.00 0.02 0.00 0.00 41.25 39.39 1i8m s ASN 137 CO -0.04 0.31 0.77 0.59 0.02 0.00 0.00 177.10 178.75 1i8m n ASN 138 N 1.47 -5.54 -4.67 -1.22 4.13 -0.92 -1.19 115.26 107.33 1i8m n ASN 138 Ca -0.15 -0.92 -0.26 0.00 1.68 0.00 0.00 54.58 54.92 1i8m n ASN 138 Cb 0.53 -3.38 -0.09 0.00 -1.54 0.00 0.00 39.78 35.30 1i8m n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1i8m s PHE 139 N -3.37 2.55 -0.28 3.10 -0.71 -0.10 -4.63 117.98 114.55 1i8m s PHE 139 Ca 0.38 -0.62 -0.22 0.00 -1.04 0.00 0.00 56.93 55.44 1i8m s PHE 139 Cb -0.14 -1.83 0.09 0.00 -1.21 0.00 0.00 43.02 39.94 1i8m s PHE 139 CO 0.85 0.35 0.82 -0.47 -1.34 0.00 0.00 175.22 175.43 1i8m s TYR 140 N -2.65 -0.76 1.16 3.49 5.04 0.03 -0.72 117.35 122.94 1i8m s TYR 140 Ca 0.37 1.70 -0.18 0.00 -2.44 0.00 0.00 57.07 56.52 1i8m s TYR 140 Cb 0.07 0.39 0.27 0.00 0.35 0.00 0.00 41.96 43.04 1i8m s TYR 140 CO 0.20 -0.37 1.13 -1.25 -1.34 0.00 0.00 175.55 173.92 1i8m s PRO 141 N 0.78 -0.87 0.46 4.97 0.04 -1.26 0.45 135.00 139.56 1i8m s PRO 141 Ca -0.03 -0.06 0.17 0.00 0.04 0.00 0.00 61.00 61.13 1i8m s PRO 141 Cb -0.05 -1.64 1.09 0.00 0.04 0.00 0.00 34.50 33.95 1i8m s PRO 141 CO -0.08 -3.48 2.00 -0.22 0.04 0.00 0.00 177.00 175.25 1i8m h LYS 142 N -2.42 0.00 -6.36 4.56 3.64 -1.97 -3.43 116.57 110.59 1i8m h LYS 142 Ca -0.46 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.38 1i8m h LYS 142 Cb 1.29 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.12 1i8m h LYS 142 CO 0.37 0.18 1.03 0.34 -2.27 0.00 0.00 179.45 179.10 1i8m s ASP 143 N -6.79 6.65 -0.02 4.20 2.15 -1.26 -4.99 116.67 116.62 1i8m s ASP 143 Ca -0.04 2.34 -0.25 0.00 0.43 0.00 0.00 52.55 55.04 1i8m s ASP 143 Cb 0.15 -2.55 0.05 0.00 -0.30 0.00 0.00 42.92 40.27 1i8m s ASP 143 CO 0.67 -0.89 0.54 -0.51 -0.17 0.00 0.00 175.17 174.81 1i8m s ILE 144 N 3.31 0.02 -0.15 4.11 2.07 -1.26 -4.61 121.20 124.69 1i8m s ILE 144 Ca 0.73 -0.18 0.01 0.00 -1.41 0.00 0.00 60.65 59.80 1i8m s ILE 144 Cb -0.36 -0.89 0.01 0.00 0.13 0.00 0.00 42.46 41.35 1i8m s ILE 144 CO 0.31 -0.10 -0.19 0.21 -1.91 0.00 0.00 174.94 173.26 1i8m s ASN 145 N -1.41 3.33 -0.01 4.50 2.47 -0.80 -5.00 114.94 118.03 1i8m s ASN 145 Ca -0.10 -0.56 0.05 0.00 0.42 0.00 0.00 52.86 52.67 1i8m s ASN 145 Cb -0.02 -1.50 -0.03 0.00 -1.45 0.00 0.00 41.25 38.26 1i8m s ASN 145 CO 0.06 0.07 -0.14 0.54 -3.72 0.00 0.00 177.10 173.91 1i8m s VAL 146 N 0.87 3.06 0.00 -5.21 0.11 -1.26 -0.80 120.40 117.17 1i8m s VAL 146 Ca -0.05 -0.88 0.01 0.00 -2.93 0.00 0.00 61.98 58.13 1i8m s VAL 146 Cb -0.15 -2.25 -0.00 0.00 -1.53 0.00 0.00 36.38 32.44 1i8m s VAL 146 CO -0.02 0.48 -0.04 -0.54 -3.33 0.00 0.00 175.10 171.64 1i8m s LYS 147 N -1.07 0.33 -0.13 1.54 1.02 0.14 -4.97 119.74 116.60 1i8m s LYS 147 Ca 0.13 -0.20 -0.03 0.00 0.02 0.00 0.00 55.97 55.90 1i8m s LYS 147 Cb -0.11 -0.29 -0.03 0.00 -0.52 0.00 0.00 37.83 36.88 1i8m s LYS 147 CO 0.03 0.08 -0.03 -1.58 -0.92 0.00 0.00 175.35 172.93 1i8m s TRP 148 N -0.22 3.06 -0.03 3.18 0.52 -1.26 -0.17 118.94 124.00 1i8m s TRP 148 Ca 0.00 -0.13 0.04 0.00 0.02 0.00 0.00 56.10 56.03 1i8m s TRP 148 Cb -0.02 -1.90 -0.00 0.00 -1.15 0.00 0.00 33.47 30.39 1i8m s TRP 148 CO -0.00 0.13 -0.16 0.15 0.02 0.00 0.00 176.95 177.09 1i8m s LYS 149 N -0.05 1.58 -0.18 4.98 -0.14 -0.63 -0.21 119.74 125.09 1i8m s LYS 149 Ca 0.02 -0.56 0.00 0.00 -1.36 0.00 0.00 55.97 54.07 1i8m s LYS 149 Cb -0.13 -1.41 0.02 0.00 -1.68 0.00 0.00 37.83 34.63 1i8m s LYS 149 CO 0.02 0.25 -0.18 0.42 -0.76 0.00 0.00 175.35 175.10 1i8m s ILE 150 N -0.02 2.26 -1.47 2.17 1.01 0.61 -1.07 121.20 124.69 1i8m s ILE 150 Ca -0.02 -0.88 -0.15 0.00 0.00 0.00 0.00 60.65 59.61 1i8m s ILE 150 Cb -0.10 -1.96 0.13 0.00 0.01 0.00 0.00 42.46 40.54 1i8m s ILE 150 CO 0.01 0.52 0.61 0.47 0.00 0.00 0.00 174.94 176.56 1i8m n ASP 151 N 4.61 -3.07 0.00 3.58 8.00 0.45 -1.14 116.55 128.97 1i8m n ASP 151 Ca -0.21 -0.73 0.00 0.00 0.71 0.00 0.00 54.79 54.57 1i8m n ASP 151 Cb 0.50 -2.55 0.00 0.00 -0.02 0.00 0.00 41.12 39.05 1i8m n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i8m n GLY 152 N -1.20 3.14 3.81 0.44 0.00 -1.26 -5.04 105.19 105.08 1i8m n GLY 152 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1i8m n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1i8m s SER 153 N -0.38 6.79 0.28 1.61 0.01 -0.29 -4.98 113.70 116.74 1i8m s SER 153 Ca 0.00 0.94 -0.29 0.00 1.31 0.00 0.00 55.95 57.90 1i8m s SER 153 Cb 0.00 -2.26 -0.10 0.00 0.21 0.00 0.00 66.02 63.87 1i8m s SER 153 CO 0.00 0.26 1.21 -0.70 0.41 0.00 0.00 173.24 174.42 1i8m s GLU 154 N -0.72 4.49 -0.21 12.44 2.12 -1.26 -0.28 118.70 135.28 1i8m s GLU 154 Ca 0.24 2.00 -0.04 0.00 0.36 0.00 0.00 54.97 57.53 1i8m s GLU 154 Cb -0.16 -3.15 -0.01 0.00 0.26 0.00 0.00 34.13 31.06 1i8m s GLU 154 CO 0.13 -0.02 -0.04 0.50 -0.54 0.00 0.00 175.26 175.29 1i8m s ARG 155 N -1.32 3.44 -0.17 4.30 6.06 0.71 -4.89 118.95 127.08 1i8m s ARG 155 Ca 0.48 -0.60 0.16 0.00 -2.50 0.00 0.00 55.73 53.27 1i8m s ARG 155 Cb -0.35 -3.01 -0.22 0.00 0.06 0.00 0.00 34.95 31.42 1i8m s ARG 155 CO 0.45 -0.13 0.08 1.04 -2.50 0.00 0.00 175.30 174.24 1i8m n GLN 156 N 4.60 1.07 -2.42 5.12 6.02 -1.26 -4.42 117.38 126.09 1i8m n GLN 156 Ca -0.18 -0.02 -0.34 0.00 -0.01 0.00 0.00 57.00 56.46 1i8m n GLN 156 Cb 0.51 -1.46 -0.02 0.00 1.02 0.00 0.00 30.24 30.29 1i8m n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1i8m s ASN 157 N -5.14 6.24 -1.62 1.08 -0.87 -1.26 -3.98 114.94 109.39 1i8m s ASN 157 Ca -0.09 1.87 0.00 0.00 -1.57 0.00 0.00 52.86 53.08 1i8m s ASN 157 Cb 0.06 -2.55 0.00 0.00 -0.02 0.00 0.00 41.25 38.74 1i8m s ASN 157 CO 0.73 -0.85 0.00 0.61 -2.57 0.00 0.00 177.10 175.02 1i8m n GLY 158 N -0.51 0.36 3.66 0.66 0.00 -1.26 -4.76 105.19 103.33 1i8m n GLY 158 Ca 0.09 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1i8m n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i8m s VAL 159 N -2.80 5.07 -0.17 1.61 1.01 -1.26 -0.31 120.40 123.55 1i8m s VAL 159 Ca 0.00 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1i8m s VAL 159 Cb 0.00 -3.31 0.02 0.00 0.00 0.00 0.00 36.38 33.09 1i8m s VAL 159 CO 0.00 0.43 -0.20 -0.76 0.00 0.00 0.00 175.10 174.57 1i8m s LEU 160 N 0.53 2.14 -0.03 3.92 1.43 0.06 -4.95 118.68 121.79 1i8m s LEU 160 Ca 0.06 -0.64 0.04 0.00 -1.03 0.00 0.00 54.13 52.56 1i8m s LEU 160 Cb -0.12 -1.48 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 1i8m s LEU 160 CO 0.00 0.01 -0.14 0.20 0.23 0.00 0.00 176.35 176.66 1i8m s ASN 161 N 1.20 4.03 -0.11 2.29 0.02 -1.26 -0.16 114.94 120.96 1i8m s ASN 161 Ca 0.03 -0.23 -0.07 0.00 -1.02 0.00 0.00 52.86 51.56 1i8m s ASN 161 Cb -0.13 -0.82 0.04 0.00 0.02 0.00 0.00 41.25 40.35 1i8m s ASN 161 CO -0.11 0.33 0.28 -0.55 0.02 0.00 0.00 177.10 177.06 1i8m s SER 162 N -0.91 -0.30 -0.02 -1.22 0.15 -0.29 -4.99 113.70 106.11 1i8m s SER 162 Ca 0.12 0.58 0.02 0.00 0.70 0.00 0.00 55.95 57.38 1i8m s SER 162 Cb -0.11 0.51 -0.03 0.00 -1.71 0.00 0.00 66.02 64.68 1i8m s SER 162 CO 0.02 -0.14 -0.06 0.26 1.20 0.00 0.00 173.24 174.52 1i8m s TRP 163 N 0.85 2.92 0.54 3.44 0.51 -1.26 -0.37 118.94 125.57 1i8m s TRP 163 Ca -0.06 -0.01 -0.03 0.00 -2.12 0.00 0.00 56.10 53.89 1i8m s TRP 163 Cb -0.07 -1.65 0.01 0.00 -0.81 0.00 0.00 33.47 30.95 1i8m s TRP 163 CO -0.06 0.37 0.81 0.95 -0.51 0.00 0.00 176.95 178.51 1i8m s THR 164 N -0.95 3.72 0.70 2.01 -4.23 -0.51 -5.00 115.64 111.37 1i8m s THR 164 Ca 0.16 -0.22 -0.11 0.00 -1.18 0.00 0.00 61.69 60.33 1i8m s THR 164 Cb -0.11 -3.43 0.01 0.00 1.34 0.00 0.00 72.50 70.30 1i8m s THR 164 CO 0.06 -0.39 1.09 -1.81 -0.54 0.00 0.00 174.62 173.03 1i8m s ASP 165 N -4.28 5.53 0.19 3.99 1.01 -1.26 -4.50 116.67 117.35 1i8m s ASP 165 Ca 0.52 1.18 -0.33 0.00 0.71 0.00 0.00 52.55 54.63 1i8m s ASP 165 Cb -0.10 -2.01 -0.14 0.00 1.01 0.00 0.00 42.92 41.68 1i8m s ASP 165 CO 0.42 -1.29 1.40 1.67 0.21 0.00 0.00 175.17 177.58 1i8m n GLN 166 N -2.98 1.83 -2.16 8.23 7.27 -1.26 -4.76 117.38 123.54 1i8m n GLN 166 Ca 0.07 0.65 -0.42 0.00 0.07 0.00 0.00 57.00 57.37 1i8m n GLN 166 Cb 0.57 -2.31 -0.03 0.00 2.41 0.00 0.00 30.24 30.88 1i8m n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1i8m s ASP 167 N 0.41 6.81 0.00 1.69 2.15 0.85 -4.89 116.67 123.68 1i8m s ASP 167 Ca 0.73 2.32 0.29 0.00 0.43 0.00 0.00 52.55 56.32 1i8m s ASP 167 Cb -0.72 -2.58 1.35 0.00 -0.30 0.00 0.00 42.92 40.66 1i8m s ASP 167 CO 0.47 -0.67 1.96 -1.54 -0.17 0.00 0.00 175.17 175.22 1i8m n SER 168 N 4.16 0.00 -0.07 -0.34 3.41 -1.26 -0.92 113.62 118.60 1i8m n SER 168 Ca 0.12 0.17 -0.13 0.00 -0.26 0.00 0.00 58.87 58.76 1i8m n SER 168 Cb 0.42 -0.39 -0.14 0.00 -0.26 0.00 0.00 64.21 63.84 1i8m n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1i8m n LYS 169 N -1.39 0.68 0.00 4.33 5.02 -1.26 -4.67 118.16 120.87 1i8m n LYS 169 Ca 0.11 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 1i8m n LYS 169 Cb 0.28 -1.62 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 1i8m n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1i8m n ASP 170 N -3.05 0.83 -0.83 4.39 5.68 -1.23 -5.02 116.55 117.31 1i8m n ASP 170 Ca -0.31 -1.38 -0.11 0.00 -0.50 0.00 0.00 54.79 52.49 1i8m n ASP 170 Cb 1.08 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 41.01 1i8m n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1i8m n SER 171 N -0.19 -5.31 -4.87 -1.12 7.64 -0.09 -4.99 113.62 104.69 1i8m n SER 171 Ca 0.00 0.27 -0.21 0.00 1.01 0.00 0.00 58.87 59.94 1i8m n SER 171 Cb 0.35 -3.77 0.07 0.00 -1.01 0.00 0.00 64.21 59.85 1i8m n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1i8m s THR 172 N -2.07 2.36 0.17 0.44 -4.23 -1.26 -4.68 115.64 106.38 1i8m s THR 172 Ca 0.00 -0.75 0.09 0.00 -1.18 0.00 0.00 61.69 59.85 1i8m s THR 172 Cb 0.00 -2.61 -0.04 0.00 1.34 0.00 0.00 72.50 71.19 1i8m s THR 172 CO 0.00 0.00 -0.20 -0.31 -0.54 0.00 0.00 174.62 173.57 1i8m s TYR 173 N -2.85 1.96 0.13 3.99 2.02 0.10 -0.11 117.35 122.60 1i8m s TYR 173 Ca 0.62 -0.43 0.04 0.00 -0.37 0.00 0.00 57.07 56.93 1i8m s TYR 173 Cb -0.07 -0.99 -0.04 0.00 -0.40 0.00 0.00 41.96 40.46 1i8m s TYR 173 CO 0.40 0.37 -0.10 -1.12 -1.57 0.00 0.00 175.55 173.54 1i8m s SER 174 N -2.59 1.66 -0.03 2.29 0.01 -1.26 -0.93 113.70 112.85 1i8m s SER 174 Ca 0.16 -0.98 -0.09 0.00 1.31 0.00 0.00 55.95 56.36 1i8m s SER 174 Cb -0.07 0.00 0.01 0.00 0.21 0.00 0.00 66.02 66.18 1i8m s SER 174 CO 0.07 -0.33 0.20 -0.32 0.41 0.00 0.00 173.24 173.27 1i8m s MET 175 N -3.59 0.42 -0.07 12.44 1.75 0.59 -1.42 119.30 129.42 1i8m s MET 175 Ca 0.14 -0.07 0.04 0.00 -1.25 0.00 0.00 55.69 54.55 1i8m s MET 175 Cb 0.02 0.18 -0.00 0.00 2.84 0.00 0.00 34.83 37.87 1i8m s MET 175 CO -0.00 -0.09 -0.21 0.45 -0.65 0.00 0.00 175.02 174.52 1i8m s SER 176 N -0.75 2.70 -0.11 1.11 0.15 0.50 -0.34 113.70 116.95 1i8m s SER 176 Ca -0.08 -0.47 0.01 0.00 0.70 0.00 0.00 55.95 56.11 1i8m s SER 176 Cb -0.05 -1.00 0.02 0.00 -1.71 0.00 0.00 66.02 63.28 1i8m s SER 176 CO 0.01 0.16 -0.12 -0.55 1.20 0.00 0.00 173.24 173.94 1i8m s SER 177 N 0.19 2.31 -0.19 5.45 0.15 -0.28 -1.14 113.70 120.18 1i8m s SER 177 Ca -0.11 -0.38 -0.02 0.00 0.70 0.00 0.00 55.95 56.14 1i8m s SER 177 Cb -0.15 -0.99 -0.00 0.00 -1.71 0.00 0.00 66.02 63.16 1i8m s SER 177 CO 0.05 -0.03 -0.11 -0.89 1.20 0.00 0.00 173.24 173.46 1i8m s THR 178 N 1.24 2.90 -0.37 6.45 2.01 0.78 -1.38 115.64 127.27 1i8m s THR 178 Ca -0.02 -0.66 -0.16 0.00 0.31 0.00 0.00 61.69 61.15 1i8m s THR 178 Cb -0.14 -2.28 0.00 0.00 0.01 0.00 0.00 72.50 70.09 1i8m s THR 178 CO -0.04 0.47 0.40 -0.22 -0.69 0.00 0.00 174.62 174.54 1i8m s LEU 179 N 1.26 4.58 -0.19 4.42 2.96 0.77 -0.76 118.68 131.73 1i8m s LEU 179 Ca 0.03 -0.37 -0.07 0.00 -0.22 0.00 0.00 54.13 53.49 1i8m s LEU 179 Cb -0.14 -2.37 -0.04 0.00 0.50 0.00 0.00 46.19 44.14 1i8m s LEU 179 CO -0.05 -0.43 0.06 -0.89 -1.32 0.00 0.00 176.35 173.72 1i8m s THR 180 N 2.08 4.75 0.31 3.68 2.01 0.58 -0.10 115.64 128.95 1i8m s THR 180 Ca 0.12 -0.04 0.03 0.00 0.31 0.00 0.00 61.69 62.11 1i8m s THR 180 Cb -0.17 -3.15 -0.06 0.00 0.01 0.00 0.00 72.50 69.14 1i8m s THR 180 CO 0.12 0.45 0.07 -0.76 -0.69 0.00 0.00 174.62 173.81 1i8m s LEU 181 N 0.50 2.02 0.40 4.42 1.43 0.10 -4.66 118.68 122.89 1i8m s LEU 181 Ca 0.03 -1.40 -0.10 0.00 -1.03 0.00 0.00 54.13 51.64 1i8m s LEU 181 Cb -0.13 -0.26 -0.06 0.00 0.03 0.00 0.00 46.19 45.77 1i8m s LEU 181 CO 0.01 -0.66 0.76 0.42 0.23 0.00 0.00 176.35 177.11 1i8m s THR 182 N -3.42 4.80 0.14 5.49 -4.23 -1.26 -0.71 115.64 116.45 1i8m s THR 182 Ca 0.36 0.58 -0.18 0.00 -1.18 0.00 0.00 61.69 61.28 1i8m s THR 182 Cb 0.08 -3.73 -0.01 0.00 1.34 0.00 0.00 72.50 70.18 1i8m s THR 182 CO 0.15 -0.51 1.75 0.50 -0.54 0.00 0.00 174.62 175.97 1i8m h LYS 183 N 1.29 0.22 0.00 3.99 3.64 -0.95 -1.08 116.57 123.68 1i8m h LYS 183 Ca -0.47 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 58.85 1i8m h LYS 183 Cb 1.19 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 1i8m h LYS 183 CO 0.64 0.15 -0.23 0.38 -2.27 0.00 0.00 179.45 178.12 1i8m h ASP 184 N 0.23 0.00 0.26 4.20 3.04 -1.94 -0.35 116.42 121.86 1i8m h ASP 184 Ca 0.13 0.00 -0.18 0.00 -3.24 0.00 0.00 57.03 53.74 1i8m h ASP 184 Cb 0.10 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.39 1i8m h ASP 184 CO -0.14 0.23 -0.71 -0.08 -2.04 0.00 0.00 179.24 176.50 1i8m h GLU 185 N 0.00 0.39 -0.82 4.15 4.81 -1.84 -2.95 114.58 118.32 1i8m h GLU 185 Ca -0.00 -0.31 0.02 0.00 -0.13 0.00 0.00 59.36 58.94 1i8m h GLU 185 Cb 0.43 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.83 1i8m h GLU 185 CO 0.03 0.95 0.54 -0.92 -0.73 0.00 0.00 179.01 178.88 1i8m h TYR 186 N 0.27 1.00 0.00 0.92 3.20 0.10 -1.18 116.97 121.27 1i8m h TYR 186 Ca -0.03 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1i8m h TYR 186 Cb 1.28 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 39.21 1i8m h TYR 186 CO 0.04 0.60 0.00 0.39 -1.64 0.00 0.00 178.16 177.55 1i8m n GLU 187 N -4.43 0.22 0.00 1.82 -0.58 -0.27 -2.99 120.64 114.40 1i8m n GLU 187 Ca 0.10 0.10 0.13 0.00 -0.42 0.00 0.00 57.16 57.07 1i8m n GLU 187 Cb 0.08 -1.50 0.36 0.00 -0.57 0.00 0.00 31.44 29.81 1i8m n GLU 187 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1i8m n ARG 188 N -1.35 0.95 -4.27 3.49 1.74 -0.45 -4.92 116.66 111.85 1i8m n ARG 188 Ca 0.09 -0.58 -0.15 0.00 -0.77 0.00 0.00 57.85 56.43 1i8m n ARG 188 Cb 0.19 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 30.04 1i8m n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1i8m s HIS 189 N -2.45 1.37 -0.08 -1.55 3.76 -1.16 -5.08 115.29 110.09 1i8m s HIS 189 Ca 0.25 -0.75 -0.01 0.00 -0.15 0.00 0.00 55.06 54.40 1i8m s HIS 189 Cb 0.19 -0.70 -0.05 0.00 1.11 0.00 0.00 32.58 33.14 1i8m s HIS 189 CO 0.50 0.11 -0.08 0.27 -0.85 0.00 0.00 174.74 174.69 1i8m n ASN 190 N -0.25 2.45 -4.65 1.40 6.94 -1.26 -4.72 115.26 115.17 1i8m n ASN 190 Ca -0.09 0.01 -0.37 0.00 -0.02 0.00 0.00 54.58 54.11 1i8m n ASN 190 Cb 0.61 -0.17 -0.10 0.00 -2.36 0.00 0.00 39.78 37.77 1i8m n ASN 190 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1i8m s SER 191 N -5.11 6.09 -0.12 0.53 0.15 -1.26 -0.01 113.70 113.97 1i8m s SER 191 Ca -0.11 0.10 0.03 0.00 0.70 0.00 0.00 55.95 56.67 1i8m s SER 191 Cb 0.03 -2.10 0.01 0.00 -1.71 0.00 0.00 66.02 62.25 1i8m s SER 191 CO 0.17 0.06 -0.20 -0.31 1.20 0.00 0.00 173.24 174.16 1i8m s TYR 192 N 1.08 2.41 -0.05 3.44 2.02 -0.76 -0.41 117.35 125.09 1i8m s TYR 192 Ca 0.07 -1.14 0.03 0.00 -0.37 0.00 0.00 57.07 55.67 1i8m s TYR 192 Cb -0.14 -1.66 0.00 0.00 -0.40 0.00 0.00 41.96 39.77 1i8m s TYR 192 CO 0.05 -0.52 -0.13 0.99 -1.57 0.00 0.00 175.55 174.36 1i8m s THR 193 N 0.74 1.17 -0.27 -0.71 2.01 -0.23 -2.09 115.64 116.26 1i8m s THR 193 Ca -0.10 -0.55 -0.11 0.00 0.31 0.00 0.00 61.69 61.25 1i8m s THR 193 Cb -0.16 -1.04 -0.05 0.00 0.01 0.00 0.00 72.50 71.27 1i8m s THR 193 CO 0.01 0.35 0.17 0.00 -0.69 0.00 0.00 174.62 174.46 1i8m s GLU 195 N 1.54 2.51 -0.10 0.00 2.12 0.75 -1.62 118.70 123.91 1i8m s GLU 195 Ca 0.07 -0.65 0.02 0.00 0.36 0.00 0.00 54.97 54.76 1i8m s GLU 195 Cb -0.15 -2.18 -0.02 0.00 0.26 0.00 0.00 34.13 32.04 1i8m s GLU 195 CO 0.09 -0.15 -0.14 0.00 -0.54 0.00 0.00 175.26 174.52 1i8m s ALA 196 N 1.20 2.60 -0.20 6.30 0.00 0.38 0.27 121.76 132.32 1i8m s ALA 196 Ca -0.00 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 1i8m s ALA 196 Cb -0.14 -1.09 0.01 0.00 0.00 0.00 0.00 23.12 21.91 1i8m s ALA 196 CO -0.07 0.37 -0.13 0.99 0.00 0.00 0.00 175.76 176.91 1i8m s THR 197 N -0.05 2.58 0.11 0.00 2.01 0.02 0.79 115.64 121.11 1i8m s THR 197 Ca -0.03 -0.82 0.04 0.00 0.31 0.00 0.00 61.69 61.19 1i8m s THR 197 Cb -0.14 -2.16 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 1i8m s THR 197 CO 0.04 0.45 -0.11 -2.28 -0.69 0.00 0.00 174.62 172.02 1i8m s HIS 198 N 1.35 1.19 0.35 4.92 2.46 -1.26 -1.90 115.29 122.40 1i8m s HIS 198 Ca 0.04 -0.65 0.13 0.00 0.47 0.00 0.00 55.06 55.05 1i8m s HIS 198 Cb -0.14 -0.63 0.95 0.00 -0.13 0.00 0.00 32.58 32.63 1i8m s HIS 198 CO -0.09 0.05 1.77 -0.22 -2.47 0.00 0.00 174.74 173.78 1i8m h LYS 199 N 3.38 0.52 0.00 2.88 3.64 -1.94 -2.00 116.57 123.05 1i8m h LYS 199 Ca -0.38 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 1i8m h LYS 199 Cb 1.19 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1i8m h LYS 199 CO 0.55 0.34 0.00 0.25 -2.27 0.00 0.00 179.45 178.32 1i8m n THR 200 N -4.73 0.71 -3.54 1.00 -2.24 -1.26 -4.74 114.28 99.48 1i8m n THR 200 Ca 0.25 0.18 -0.14 0.00 -2.27 0.00 0.00 64.05 62.07 1i8m n THR 200 Cb 0.76 -1.12 -0.05 0.00 -2.10 0.00 0.00 70.33 67.81 1i8m n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1i8m s SER 201 N -2.39 -0.50 0.10 3.42 0.15 -0.75 -4.97 113.70 108.75 1i8m s SER 201 Ca 0.04 0.47 0.12 0.00 0.70 0.00 0.00 55.95 57.28 1i8m s SER 201 Cb 0.02 0.43 -0.15 0.00 -1.71 0.00 0.00 66.02 64.61 1i8m s SER 201 CO 0.05 -0.52 1.07 0.71 1.20 0.00 0.00 173.24 175.74 1i8m h THR 202 N 2.66 1.12 -3.35 6.45 1.35 -1.85 -3.40 112.91 115.88 1i8m h THR 202 Ca -0.23 -2.77 -0.60 0.00 -0.55 0.00 0.00 66.41 62.26 1i8m h THR 202 Cb 1.17 2.52 -0.09 0.00 -1.73 0.00 0.00 68.15 70.02 1i8m h THR 202 CO 0.35 0.64 0.49 -0.44 -0.25 0.00 0.00 175.52 176.30 1i8m s SER 203 N -6.34 6.77 0.61 5.36 0.01 -1.26 -5.02 113.70 113.83 1i8m s SER 203 Ca -0.01 0.87 -0.19 0.00 1.31 0.00 0.00 55.95 57.94 1i8m s SER 203 Cb 0.09 -2.44 -0.03 0.00 0.21 0.00 0.00 66.02 63.85 1i8m s SER 203 CO 0.81 -0.61 1.28 -2.84 0.41 0.00 0.00 173.24 172.29 1i8m s PRO 204 N 3.00 2.80 0.10 12.44 0.02 -1.26 -4.89 135.00 147.20 1i8m s PRO 204 Ca 0.35 2.02 -0.26 0.00 0.02 0.00 0.00 61.00 63.13 1i8m s PRO 204 Cb -0.14 -1.95 -0.06 0.00 0.02 0.00 0.00 34.50 32.36 1i8m s PRO 204 CO 0.11 -1.39 0.80 0.42 -0.33 0.00 0.00 177.00 176.60 1i8m s ILE 205 N -1.44 4.57 -0.03 2.83 -1.09 0.24 -4.87 121.20 121.41 1i8m s ILE 205 Ca 0.79 1.72 0.03 0.00 -2.23 0.00 0.00 60.65 60.95 1i8m s ILE 205 Cb -0.36 -4.15 0.00 0.00 -1.58 0.00 0.00 42.46 36.37 1i8m s ILE 205 CO 0.39 0.41 -0.10 0.54 -1.23 0.00 0.00 174.94 174.95 1i8m s VAL 206 N -0.42 0.84 -0.04 2.92 0.11 -1.26 -0.47 120.40 122.08 1i8m s VAL 206 Ca 0.39 -0.39 0.04 0.00 -2.93 0.00 0.00 61.98 59.09 1i8m s VAL 206 Cb -0.22 -0.74 -0.00 0.00 -1.53 0.00 0.00 36.38 33.89 1i8m s VAL 206 CO 0.25 0.26 -0.15 -0.54 -3.33 0.00 0.00 175.10 171.59 1i8m s LYS 207 N 0.18 1.62 0.25 1.54 -0.14 -0.64 -5.01 119.74 117.55 1i8m s LYS 207 Ca -0.03 -0.55 0.02 0.00 -1.36 0.00 0.00 55.97 54.05 1i8m s LYS 207 Cb -0.09 -1.42 -0.04 0.00 -1.68 0.00 0.00 37.83 34.60 1i8m s LYS 207 CO 0.01 0.21 0.16 -1.12 -0.76 0.00 0.00 175.35 173.85 1i8m s SER 208 N 0.08 0.83 -0.06 2.83 0.01 -1.26 -0.44 113.70 115.69 1i8m s SER 208 Ca -0.04 -1.50 -0.29 0.00 1.31 0.00 0.00 55.95 55.43 1i8m s SER 208 Cb -0.11 0.40 0.10 0.00 0.21 0.00 0.00 66.02 66.62 1i8m s SER 208 CO 0.02 -0.89 0.85 0.72 0.41 0.00 0.00 173.24 174.35 1i8m s PHE 209 N -3.87 -0.46 -0.09 2.43 -0.12 -0.89 -5.00 117.98 109.98 1i8m s PHE 209 Ca 0.39 0.64 0.02 0.00 -0.05 0.00 0.00 56.93 57.93 1i8m s PHE 209 Cb 0.06 0.47 -0.02 0.00 -0.63 0.00 0.00 43.02 42.90 1i8m s PHE 209 CO 0.16 -0.51 -0.15 -0.80 -0.05 0.00 0.00 175.22 173.87 1i8m s ASN 210 N -1.61 3.91 0.16 1.98 0.02 -1.26 -1.83 114.94 116.30 1i8m s ASN 210 Ca -0.02 -0.30 -0.16 0.00 -1.02 0.00 0.00 52.86 51.36 1i8m s ASN 210 Cb -0.01 -1.24 0.07 0.00 0.02 0.00 0.00 41.25 40.10 1i8m s ASN 210 CO 0.00 0.24 1.75 -0.09 0.02 0.00 0.00 177.10 179.02 1i8m h ARG 211 N 6.11 0.26 -5.19 -0.60 2.43 -0.72 -3.22 114.38 113.46 1i8m h ARG 211 Ca -0.34 -0.02 -0.71 0.00 -0.81 0.00 0.00 59.98 58.11 1i8m h ARG 211 Cb 1.19 -0.06 -0.14 0.00 -0.42 0.00 0.00 29.97 30.53 1i8m h ARG 211 CO 0.52 0.17 1.53 -0.80 -1.51 0.00 0.00 179.97 179.89 1i8m s ASN 212 N -5.35 6.91 0.00 -3.80 -0.87 -1.26 -5.13 114.94 105.44 1i8m s ASN 212 Ca -0.13 -2.61 0.00 0.00 -1.57 0.00 0.00 52.86 48.55 1i8m s ASN 212 Cb 0.12 -2.46 0.00 0.00 -0.02 0.00 0.00 41.25 38.89 1i8m s ASN 212 CO 0.71 -0.96 0.00 -1.84 -2.57 0.00 0.00 177.10 172.44