#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v00 s GLU 2 N 0.00 3.36 0.22 5.55 2.12 -0.30 -4.95 118.70 124.69 1v00 s GLU 2 Ca 0.00 -0.65 0.09 0.00 0.36 0.00 0.00 54.97 54.77 1v00 s GLU 2 Cb 0.00 -3.09 -0.05 0.00 0.26 0.00 0.00 34.13 31.25 1v00 s GLU 2 CO 0.00 -0.23 -0.17 0.95 -0.54 0.00 0.00 175.26 175.27 1v00 s THR 3 N 1.49 1.95 -0.11 -1.70 -4.23 -1.26 -0.17 115.64 111.61 1v00 s THR 3 Ca 0.05 -2.21 -0.14 0.00 -1.18 0.00 0.00 61.69 58.20 1v00 s THR 3 Cb -0.15 -2.08 0.04 0.00 1.34 0.00 0.00 72.50 71.65 1v00 s THR 3 CO -0.02 -0.50 0.38 -0.51 -0.54 0.00 0.00 174.62 173.44 1v00 s ILE 4 N -2.70 0.01 -0.03 2.99 2.07 -0.88 -5.01 121.20 117.66 1v00 s ILE 4 Ca 0.23 -0.11 -0.30 0.00 -1.41 0.00 0.00 60.65 59.07 1v00 s ILE 4 Cb -0.03 -0.58 0.08 0.00 0.13 0.00 0.00 42.46 42.06 1v00 s ILE 4 CO 0.09 -0.06 0.70 -0.94 -1.91 0.00 0.00 174.94 172.82 1v00 s SER 5 N -0.19 -0.61 0.05 4.50 1.04 -1.26 -1.38 113.70 115.86 1v00 s SER 5 Ca -0.03 0.56 -0.15 0.00 0.48 0.00 0.00 55.95 56.80 1v00 s SER 5 Cb -0.03 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.64 1v00 s SER 5 CO 0.02 -0.64 0.35 0.72 0.98 0.00 0.00 173.24 174.66 1v00 s PHE 6 N -1.63 -0.16 -0.19 5.02 -0.12 -0.23 -4.99 117.98 115.67 1v00 s PHE 6 Ca -0.08 0.03 -0.07 0.00 -0.05 0.00 0.00 56.93 56.77 1v00 s PHE 6 Cb -0.00 0.15 0.09 0.00 -0.63 0.00 0.00 43.02 42.62 1v00 s PHE 6 CO 0.05 -0.55 0.41 0.45 -0.05 0.00 0.00 175.22 175.53 1v00 s SER 7 N -2.13 -0.23 -0.31 1.98 0.15 -1.26 -0.73 113.70 111.16 1v00 s SER 7 Ca -0.04 0.95 -0.02 0.00 0.70 0.00 0.00 55.95 57.55 1v00 s SER 7 Cb -0.00 1.25 0.06 0.00 -1.71 0.00 0.00 66.02 65.61 1v00 s SER 7 CO -0.04 -0.23 0.02 -0.36 1.20 0.00 0.00 173.24 173.83 1v00 s PHE 8 N 2.48 3.30 0.24 3.44 0.08 0.05 -4.94 117.98 122.64 1v00 s PHE 8 Ca -0.02 -1.95 0.26 0.00 0.12 0.00 0.00 56.93 55.34 1v00 s PHE 8 Cb -0.12 -2.22 1.17 0.00 -0.57 0.00 0.00 43.02 41.28 1v00 s PHE 8 CO -0.12 -0.82 1.93 0.66 -0.10 0.00 0.00 175.22 176.77 1v00 h SER 9 N 7.99 0.00 -5.01 1.36 4.64 -1.88 -1.81 113.55 118.84 1v00 h SER 9 Ca -0.20 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.09 1v00 h SER 9 Cb 1.06 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.02 1v00 h SER 9 CO 0.54 0.17 0.17 -1.83 -0.87 0.00 0.00 176.83 175.01 1v00 s GLU 10 N -3.85 1.21 0.14 4.77 -1.05 -1.25 -4.49 118.70 114.19 1v00 s GLU 10 Ca -0.01 -0.39 -0.29 0.00 -0.15 0.00 0.00 54.97 54.14 1v00 s GLU 10 Cb 0.11 0.56 -0.07 0.00 -0.44 0.00 0.00 34.13 34.29 1v00 s GLU 10 CO 0.61 -0.50 0.91 -0.06 0.95 0.00 0.00 175.26 177.16 1v00 s PHE 11 N -3.35 3.85 -0.35 4.83 0.08 -0.39 -4.97 117.98 117.69 1v00 s PHE 11 Ca -0.01 1.76 -0.09 0.00 0.12 0.00 0.00 56.93 58.72 1v00 s PHE 11 Cb -0.01 -2.97 0.03 0.00 -0.57 0.00 0.00 43.02 39.50 1v00 s PHE 11 CO -0.09 0.31 0.15 -1.21 -0.10 0.00 0.00 175.22 174.28 1v00 s GLU 12 N -0.40 2.81 0.38 0.44 2.02 -1.26 -4.19 118.70 118.49 1v00 s GLU 12 Ca 0.43 -1.07 -0.28 0.00 0.02 0.00 0.00 54.97 54.07 1v00 s GLU 12 Cb -0.23 -3.58 -0.11 0.00 0.10 0.00 0.00 34.13 30.31 1v00 s GLU 12 CO 0.29 -0.64 1.49 -2.14 0.02 0.00 0.00 175.26 174.28 1v00 s PRO 13 N 1.49 4.10 0.00 0.39 0.02 -1.26 -2.09 135.00 137.65 1v00 s PRO 13 Ca 0.01 2.58 0.00 0.00 0.02 0.00 0.00 61.00 63.61 1v00 s PRO 13 Cb -0.19 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 31.36 1v00 s PRO 13 CO 0.05 -0.54 0.00 0.41 -0.33 0.00 0.00 177.00 176.59 1v00 n GLY 14 N 0.48 1.85 3.60 0.52 0.00 -1.26 -4.98 105.19 105.41 1v00 n GLY 14 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1v00 n GLY 14 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1v00 s ASN 15 N -3.42 6.54 0.00 1.61 3.84 -0.89 -4.87 114.94 117.75 1v00 s ASN 15 Ca 0.00 0.67 0.07 0.00 0.21 0.00 0.00 52.86 53.81 1v00 s ASN 15 Cb 0.00 -2.55 0.36 0.00 -0.55 0.00 0.00 41.25 38.52 1v00 s ASN 15 CO 0.00 -1.29 0.99 0.59 -2.79 0.00 0.00 177.10 174.60 1v00 n ASN 16 N 8.14 0.00 0.01 -4.21 3.02 -1.26 -2.08 115.26 118.88 1v00 n ASN 16 Ca 0.14 0.04 0.09 0.00 -0.03 0.00 0.00 54.58 54.82 1v00 n ASN 16 Cb 0.48 -0.18 0.39 0.00 -0.61 0.00 0.00 39.78 39.86 1v00 n ASN 16 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1v00 n ASP 17 N -1.18 0.08 -4.26 6.41 8.00 -1.26 -4.64 116.55 119.70 1v00 n ASP 17 Ca 0.04 0.52 -0.26 0.00 0.71 0.00 0.00 54.79 55.79 1v00 n ASP 17 Cb 0.04 -0.53 -0.14 0.00 -0.02 0.00 0.00 41.12 40.47 1v00 n ASP 17 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1v00 s LEU 18 N -3.16 2.15 -0.12 0.64 1.43 -0.89 -0.45 118.68 118.28 1v00 s LEU 18 Ca 0.08 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 1v00 s LEU 18 Cb 0.11 -1.02 -0.01 0.00 0.03 0.00 0.00 46.19 45.30 1v00 s LEU 18 CO 0.33 0.19 -0.17 -0.89 0.23 0.00 0.00 176.35 176.04 1v00 s THR 19 N -0.75 2.66 -0.14 5.49 2.01 0.24 -4.86 115.64 120.28 1v00 s THR 19 Ca 0.08 -0.80 -0.09 0.00 0.31 0.00 0.00 61.69 61.19 1v00 s THR 19 Cb -0.09 -2.09 -0.05 0.00 0.01 0.00 0.00 72.50 70.29 1v00 s THR 19 CO 0.01 0.54 0.17 -0.76 -0.69 0.00 0.00 174.62 173.89 1v00 s LEU 20 N 0.41 4.32 0.12 4.42 1.43 -1.26 -1.13 118.68 126.99 1v00 s LEU 20 Ca -0.13 0.43 0.06 0.00 -1.03 0.00 0.00 54.13 53.46 1v00 s LEU 20 Cb -0.17 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 1v00 s LEU 20 CO 0.06 0.30 -0.14 -1.10 0.23 0.00 0.00 176.35 175.69 1v00 s GLN 21 N -0.42 1.02 7.00 1.70 -0.21 0.43 -4.99 119.66 124.19 1v00 s GLN 21 Ca 0.13 -1.23 0.00 0.00 0.02 0.00 0.00 55.36 54.28 1v00 s GLN 21 Cb -0.12 -0.91 0.00 0.00 1.00 0.00 0.00 33.01 32.98 1v00 s GLN 21 CO 0.03 0.17 0.00 0.41 -2.12 0.00 0.00 175.29 173.78 1v00 n GLY 22 N 0.55 3.12 0.01 3.09 0.00 -1.26 -1.51 105.19 109.19 1v00 n GLY 22 Ca -0.16 -0.26 0.14 0.00 0.00 0.00 0.00 46.02 45.75 1v00 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v00 n ALA 23 N 10.61 2.54 -1.66 4.61 0.00 0.26 -4.92 120.51 131.95 1v00 n ALA 23 Ca 0.00 -0.15 -0.47 0.00 0.00 0.00 0.00 53.44 52.82 1v00 n ALA 23 Cb 0.00 -1.42 -0.04 0.00 0.00 0.00 0.00 19.45 17.99 1v00 n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v00 n ALA 24 N -1.44 1.15 -2.51 0.00 0.00 -1.05 -4.48 120.51 112.19 1v00 n ALA 24 Ca 0.08 0.45 -0.08 0.00 0.00 0.00 0.00 53.44 53.89 1v00 n ALA 24 Cb 0.32 -2.33 -0.10 0.00 0.00 0.00 0.00 19.45 17.34 1v00 n ALA 24 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1v00 s ILE 25 N 0.88 0.19 -0.19 0.00 -4.36 -0.90 -4.66 121.20 112.14 1v00 s ILE 25 Ca 0.79 -1.39 -0.04 0.00 -0.26 0.00 0.00 60.65 59.75 1v00 s ILE 25 Cb -0.70 -0.94 -0.02 0.00 1.25 0.00 0.00 42.46 42.05 1v00 s ILE 25 CO 0.39 -0.76 -0.03 -0.63 0.24 0.00 0.00 174.94 174.15 1v00 s ILE 26 N -2.76 3.75 0.72 8.37 1.01 -1.26 -0.47 121.20 130.57 1v00 s ILE 26 Ca -0.04 -0.39 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 1v00 s ILE 26 Cb -0.01 -2.68 0.02 0.00 0.01 0.00 0.00 42.46 39.81 1v00 s ILE 26 CO -0.06 0.45 1.07 0.42 0.00 0.00 0.00 174.94 176.82 1v00 s THR 27 N 0.93 3.73 0.46 2.92 -4.23 -0.25 -4.84 115.64 114.35 1v00 s THR 27 Ca 0.00 0.56 0.31 0.00 -1.18 0.00 0.00 61.69 61.38 1v00 s THR 27 Cb -0.14 -3.37 0.33 0.00 1.34 0.00 0.00 72.50 70.66 1v00 s THR 27 CO 0.01 -0.73 2.14 -0.61 -0.54 0.00 0.00 174.62 174.89 1v00 h GLN 28 N -0.78 0.00 0.00 3.99 4.15 -1.96 0.45 115.11 120.96 1v00 h GLN 28 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.97 1v00 h GLN 28 Cb 1.23 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.92 1v00 h GLN 28 CO 0.59 0.07 0.00 -1.13 -1.93 0.00 0.00 178.83 176.43 1v00 n SER 29 N -3.56 0.00 0.00 -0.69 3.41 -1.26 -4.90 113.62 106.62 1v00 n SER 29 Ca -0.02 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 1v00 n SER 29 Cb 0.19 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 1v00 n SER 29 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v00 n GLY 30 N 1.07 0.95 3.59 5.00 0.00 0.15 -4.92 105.19 111.04 1v00 n GLY 30 Ca 0.10 -0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 1v00 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1v00 s VAL 31 N -2.00 4.37 -0.43 1.61 1.01 -1.25 -1.26 120.40 122.44 1v00 s VAL 31 Ca 0.00 -0.19 -0.24 0.00 0.00 0.00 0.00 61.98 61.55 1v00 s VAL 31 Cb 0.00 -2.93 0.02 0.00 0.00 0.00 0.00 36.38 33.48 1v00 s VAL 31 CO 0.00 0.50 0.81 -0.22 0.00 0.00 0.00 175.10 176.19 1v00 s LEU 32 N 0.14 4.18 -0.62 3.92 2.96 0.30 -1.09 118.68 128.47 1v00 s LEU 32 Ca 0.02 0.04 -0.19 0.00 -0.22 0.00 0.00 54.13 53.78 1v00 s LEU 32 Cb -0.13 -3.02 0.11 0.00 0.50 0.00 0.00 46.19 43.65 1v00 s LEU 32 CO 0.02 -0.90 0.74 -1.10 -1.32 0.00 0.00 176.35 173.78 1v00 s GLN 33 N 3.34 3.10 0.24 1.98 -0.21 0.38 -0.45 119.66 128.03 1v00 s GLN 33 Ca 0.32 -1.37 -0.05 0.00 0.02 0.00 0.00 55.36 54.27 1v00 s GLN 33 Cb -0.12 -4.30 0.27 0.00 1.00 0.00 0.00 33.01 29.85 1v00 s GLN 33 CO 0.22 -1.56 1.82 -0.07 -2.12 0.00 0.00 175.29 173.58 1v00 h LEU 34 N 9.97 0.99 -9.00 2.90 3.38 -1.48 -2.41 115.31 119.66 1v00 h LEU 34 Ca -0.26 -0.14 -0.68 0.00 0.09 0.00 0.00 57.88 56.89 1v00 h LEU 34 Cb 1.08 -0.26 -0.21 0.00 0.09 0.00 0.00 40.66 41.36 1v00 h LEU 34 CO 1.09 0.88 -0.81 0.42 0.09 0.00 0.00 178.44 180.11 1v00 s THR 35 N -5.50 2.79 0.23 0.22 -4.23 -1.26 -2.88 115.64 105.00 1v00 s THR 35 Ca -0.11 -1.30 -0.32 0.00 -1.18 0.00 0.00 61.69 58.78 1v00 s THR 35 Cb 0.16 -2.21 -0.14 0.00 1.34 0.00 0.00 72.50 71.66 1v00 s THR 35 CO 0.82 0.26 1.41 1.17 -0.54 0.00 0.00 174.62 177.74 1v00 n LYS 36 N 1.30 1.99 -3.84 3.99 4.81 -1.26 -4.74 118.16 120.41 1v00 n LYS 36 Ca -0.16 0.71 -0.36 0.00 -0.87 0.00 0.00 58.31 57.63 1v00 n LYS 36 Cb 0.52 -2.37 -0.13 0.00 0.02 0.00 0.00 35.03 33.07 1v00 n LYS 36 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1v00 s ILE 37 N 0.04 3.66 1.11 3.15 -1.09 -1.26 -0.94 121.20 125.87 1v00 s ILE 37 Ca 0.70 -0.56 -0.13 0.00 -2.23 0.00 0.00 60.65 58.43 1v00 s ILE 37 Cb -0.67 -2.77 0.25 0.00 -1.58 0.00 0.00 42.46 37.70 1v00 s ILE 37 CO 0.48 0.28 1.05 0.20 -1.23 0.00 0.00 174.94 175.72 1v00 s ASN 38 N 1.49 1.57 0.40 3.58 0.02 0.38 -4.84 114.94 117.55 1v00 s ASN 38 Ca 0.04 1.31 0.11 0.00 -1.02 0.00 0.00 52.86 53.30 1v00 s ASN 38 Cb -0.16 -2.05 0.91 0.00 0.02 0.00 0.00 41.25 39.97 1v00 s ASN 38 CO -0.00 -3.81 1.96 1.56 0.02 0.00 0.00 177.10 176.83 1v00 h GLN 39 N -2.35 0.54 0.00 -0.60 4.20 -1.99 0.49 115.11 115.40 1v00 h GLN 39 Ca -0.59 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.09 1v00 h GLN 39 Cb 1.34 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.99 1v00 h GLN 39 CO 0.54 0.36 0.00 0.27 -0.67 0.00 0.00 178.83 179.33 1v00 n ASN 40 N -4.48 0.00 0.00 1.46 2.04 -1.26 -4.85 115.26 108.17 1v00 n ASN 40 Ca 0.11 -0.47 0.00 0.00 -0.44 0.00 0.00 54.58 53.78 1v00 n ASN 40 Cb 0.33 -0.10 0.00 0.00 -2.53 0.00 0.00 39.78 37.48 1v00 n ASN 40 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1v00 n GLY 41 N 0.43 0.67 3.64 4.83 0.00 0.16 -5.06 105.19 109.86 1v00 n GLY 41 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1v00 n GLY 41 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1v00 s MET 42 N -0.30 2.40 0.20 1.61 -1.94 -1.25 -4.83 119.30 115.18 1v00 s MET 42 Ca 0.00 -0.89 -0.31 0.00 -1.71 0.00 0.00 55.69 52.78 1v00 s MET 42 Cb 0.00 -2.46 -0.10 0.00 2.01 0.00 0.00 34.83 34.29 1v00 s MET 42 CO 0.00 0.54 1.48 -1.25 -0.01 0.00 0.00 175.02 175.77 1v00 s PRO 43 N -2.19 4.26 0.15 2.03 0.04 -1.26 -0.47 135.00 137.55 1v00 s PRO 43 Ca 0.23 2.29 -0.23 0.00 0.04 0.00 0.00 61.00 63.33 1v00 s PRO 43 Cb -0.11 -3.15 -0.08 0.00 0.04 0.00 0.00 34.50 31.20 1v00 s PRO 43 CO 0.16 -0.49 0.70 0.00 0.04 0.00 0.00 177.00 177.41 1v00 s ALA 44 N 0.61 3.49 0.78 8.56 0.00 -0.11 -4.71 121.76 130.37 1v00 s ALA 44 Ca 0.64 0.23 -0.10 0.00 0.00 0.00 0.00 51.96 52.74 1v00 s ALA 44 Cb -0.42 -2.83 0.09 0.00 0.00 0.00 0.00 23.12 19.96 1v00 s ALA 44 CO 0.36 0.33 1.12 1.67 0.00 0.00 0.00 175.76 179.24 1v00 s TRP 45 N -1.19 2.71 -1.45 0.00 1.48 -1.26 -4.25 118.94 114.97 1v00 s TRP 45 Ca 0.35 0.51 -0.11 0.00 -1.06 0.00 0.00 56.10 55.79 1v00 s TRP 45 Cb -0.21 -3.42 0.05 0.00 -1.16 0.00 0.00 33.47 28.72 1v00 s TRP 45 CO 0.23 -1.72 1.02 -3.47 -4.06 0.00 0.00 176.95 168.95 1v00 n ASP 46 N -3.18 -5.58 -4.29 -2.66 2.03 0.80 -4.92 116.55 98.76 1v00 n ASP 46 Ca 0.09 -0.62 -0.30 0.00 0.52 0.00 0.00 54.79 54.49 1v00 n ASP 46 Cb 0.61 -4.43 -0.16 0.00 -0.72 0.00 0.00 41.12 36.42 1v00 n ASP 46 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1v00 s SER 47 N -3.23 2.90 -0.04 1.67 0.15 -1.26 -4.98 113.70 108.92 1v00 s SER 47 Ca 0.59 -0.48 -0.01 0.00 0.70 0.00 0.00 55.95 56.75 1v00 s SER 47 Cb -0.28 -0.30 0.03 0.00 -1.71 0.00 0.00 66.02 63.76 1v00 s SER 47 CO 0.73 0.28 0.07 -0.89 1.20 0.00 0.00 173.24 174.63 1v00 s THR 48 N -0.64 -0.07 0.01 6.45 2.01 -1.26 -0.56 115.64 121.58 1v00 s THR 48 Ca 0.10 0.23 -0.10 0.00 0.31 0.00 0.00 61.69 62.22 1v00 s THR 48 Cb -0.09 -0.14 0.01 0.00 0.01 0.00 0.00 72.50 72.29 1v00 s THR 48 CO -0.00 0.09 0.21 -0.83 -0.69 0.00 0.00 174.62 173.40 1v00 s GLY 49 N 1.23 -0.02 0.17 4.40 0.00 -0.73 -0.57 107.32 111.80 1v00 s GLY 49 Ca -0.08 -0.06 -0.08 0.00 0.00 0.00 0.00 44.72 44.50 1v00 s GLY 49 CO -0.04 -0.23 0.28 0.50 0.00 0.00 0.00 173.10 173.61 1v00 s ARG 50 N -1.83 1.18 -0.00 2.90 0.52 -0.57 -0.91 118.95 120.24 1v00 s ARG 50 Ca -0.11 -1.23 -0.00 0.00 -0.52 0.00 0.00 55.73 53.87 1v00 s ARG 50 Cb -0.04 0.37 0.00 0.00 0.52 0.00 0.00 34.95 35.80 1v00 s ARG 50 CO 0.00 -0.43 0.01 -0.08 0.02 0.00 0.00 175.30 174.82 1v00 s THR 51 N -3.99 -0.00 0.02 0.02 -1.32 -0.18 -0.43 115.64 109.76 1v00 s THR 51 Ca 0.20 0.01 0.06 0.00 -1.21 0.00 0.00 61.69 60.75 1v00 s THR 51 Cb 0.03 -0.02 -0.02 0.00 -1.51 0.00 0.00 72.50 70.98 1v00 s THR 51 CO 0.02 0.00 -0.18 -0.76 -2.21 0.00 0.00 174.62 171.49 1v00 s LEU 52 N 0.06 2.12 0.20 9.08 1.43 -0.28 -1.04 118.68 130.25 1v00 s LEU 52 Ca -0.00 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.35 1v00 s LEU 52 Cb -0.01 -0.88 -0.08 0.00 0.03 0.00 0.00 46.19 45.25 1v00 s LEU 52 CO -0.00 0.15 1.21 -0.47 0.23 0.00 0.00 176.35 177.47 1v00 s TYR 53 N -0.68 3.40 -1.17 0.29 5.04 -0.50 -0.60 117.35 123.13 1v00 s TYR 53 Ca 0.06 1.42 0.20 0.00 -2.44 0.00 0.00 57.07 56.31 1v00 s TYR 53 Cb -0.08 -3.45 0.93 0.00 0.35 0.00 0.00 41.96 39.71 1v00 s TYR 53 CO 0.01 -1.26 1.65 2.41 -1.34 0.00 0.00 175.55 177.02 1v00 n THR 54 N 2.35 0.52 -4.49 4.34 -1.04 0.41 -4.60 114.28 111.77 1v00 n THR 54 Ca 0.04 0.13 -0.34 0.00 -2.04 0.00 0.00 64.05 61.84 1v00 n THR 54 Cb 0.44 -0.79 -0.12 0.00 -1.82 0.00 0.00 70.33 68.04 1v00 n THR 54 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1v00 s LYS 55 N -2.83 3.57 0.58 -2.82 1.02 -1.26 -5.07 119.74 112.93 1v00 s LYS 55 Ca 0.14 -0.55 -0.19 0.00 0.02 0.00 0.00 55.97 55.39 1v00 s LYS 55 Cb 0.13 -2.84 -0.04 0.00 -0.52 0.00 0.00 37.83 34.56 1v00 s LYS 55 CO 0.34 0.26 1.17 -1.25 -0.92 0.00 0.00 175.35 174.96 1v00 s PRO 56 N 0.29 3.11 -0.16 -1.68 0.04 -1.26 -4.81 135.00 130.53 1v00 s PRO 56 Ca -0.05 1.71 -0.03 0.00 0.04 0.00 0.00 61.00 62.67 1v00 s PRO 56 Cb -0.14 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.41 1v00 s PRO 56 CO 0.03 -1.07 -0.04 0.08 0.04 0.00 0.00 177.00 176.04 1v00 s VAL 57 N -1.71 3.81 -0.73 -0.36 1.01 0.78 -4.91 120.40 118.29 1v00 s VAL 57 Ca 0.75 -0.38 -0.25 0.00 0.00 0.00 0.00 61.98 62.10 1v00 s VAL 57 Cb -0.27 -2.67 0.05 0.00 0.00 0.00 0.00 36.38 33.49 1v00 s VAL 57 CO 0.31 0.49 1.15 -2.28 0.00 0.00 0.00 175.10 174.77 1v00 s HIS 58 N 0.44 2.49 -0.08 5.22 2.46 -1.26 -1.04 115.29 123.52 1v00 s HIS 58 Ca -0.04 -0.36 0.14 0.00 0.47 0.00 0.00 55.06 55.27 1v00 s HIS 58 Cb -0.14 -4.48 -0.11 0.00 -0.13 0.00 0.00 32.58 27.71 1v00 s HIS 58 CO 0.03 -1.87 1.03 0.97 -2.47 0.00 0.00 174.74 172.43 1v00 h ILE 59 N 6.04 0.84 -2.79 0.89 6.09 -1.32 -3.44 117.51 123.83 1v00 h ILE 59 Ca -0.24 -2.40 0.03 0.00 -1.37 0.00 0.00 64.86 60.88 1v00 h ILE 59 Cb 1.06 2.33 -0.12 0.00 0.47 0.00 0.00 36.82 40.55 1v00 h ILE 59 CO 1.24 0.48 0.29 -1.66 -3.07 0.00 0.00 178.15 175.44 1v00 s TRP 60 N -2.84 -0.44 -0.14 2.19 1.48 -1.09 -0.26 118.94 117.84 1v00 s TRP 60 Ca -0.01 0.22 0.00 0.00 -1.06 0.00 0.00 56.10 55.25 1v00 s TRP 60 Cb 0.08 0.57 0.02 0.00 -1.16 0.00 0.00 33.47 32.99 1v00 s TRP 60 CO 0.80 -0.81 -0.12 0.34 -4.06 0.00 0.00 176.95 173.09 1v00 s ASP 61 N -2.71 2.53 0.26 -2.66 -1.08 -0.48 -4.56 116.67 107.97 1v00 s ASP 61 Ca 0.04 -0.43 -0.01 0.00 -0.52 0.00 0.00 52.55 51.62 1v00 s ASP 61 Cb -0.02 -1.08 0.34 0.00 -1.46 0.00 0.00 42.92 40.71 1v00 s ASP 61 CO -0.09 -0.07 1.73 -0.03 0.52 0.00 0.00 175.17 177.23 1v00 h MET 62 N 8.08 0.71 -0.18 4.34 1.85 -1.94 0.51 114.93 128.29 1v00 h MET 62 Ca -0.36 -0.22 -0.01 0.00 -0.61 0.00 0.00 59.70 58.50 1v00 h MET 62 Cb 1.13 -0.07 -0.01 0.00 0.43 0.00 0.00 31.60 33.09 1v00 h MET 62 CO 0.49 0.79 0.06 1.15 -0.40 0.00 0.00 176.91 179.00 1v00 h THR 63 N 0.65 1.18 0.00 -0.77 2.02 -1.97 -3.21 112.91 110.81 1v00 h THR 63 Ca 0.12 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1v00 h THR 63 Cb 0.54 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 1v00 h THR 63 CO 0.03 0.18 -1.03 0.35 0.37 0.00 0.00 175.52 175.42 1v00 n THR 64 N -4.82 0.31 -0.98 3.16 -2.24 -1.21 -4.96 114.28 103.54 1v00 n THR 64 Ca -0.04 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1v00 n THR 64 Cb 0.14 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 1v00 n THR 64 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1v00 n GLY 65 N 1.30 0.42 3.78 3.38 0.00 0.18 -4.91 105.19 109.34 1v00 n GLY 65 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1v00 n GLY 65 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1v00 s THR 66 N -1.95 3.55 -0.02 2.61 -4.23 -1.16 -4.85 115.64 109.59 1v00 s THR 66 Ca 0.00 1.09 0.03 0.00 -1.18 0.00 0.00 61.69 61.63 1v00 s THR 66 Cb 0.00 -3.52 -0.00 0.00 1.34 0.00 0.00 72.50 70.32 1v00 s THR 66 CO 0.00 -0.08 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.19 1v00 s VAL 67 N -1.73 0.94 0.38 2.29 1.01 -1.26 -1.39 120.40 120.64 1v00 s VAL 67 Ca 0.63 -0.47 -0.20 0.00 0.00 0.00 0.00 61.98 61.94 1v00 s VAL 67 Cb -0.22 -0.81 -0.10 0.00 0.00 0.00 0.00 36.38 35.24 1v00 s VAL 67 CO 0.27 0.28 0.89 0.00 0.00 0.00 0.00 175.10 176.54 1v00 s ALA 68 N 0.01 3.14 0.04 5.51 0.00 0.64 -4.49 121.76 126.62 1v00 s ALA 68 Ca -0.01 0.33 0.01 0.00 0.00 0.00 0.00 51.96 52.30 1v00 s ALA 68 Cb -0.08 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 1v00 s ALA 68 CO 0.00 0.19 0.09 -1.12 0.00 0.00 0.00 175.76 174.92 1v00 s SER 69 N -2.11 5.63 0.20 0.00 0.01 -0.75 -4.41 113.70 112.28 1v00 s SER 69 Ca 0.58 0.07 -0.11 0.00 1.31 0.00 0.00 55.95 57.80 1v00 s SER 69 Cb -0.11 -1.57 -0.00 0.00 0.21 0.00 0.00 66.02 64.55 1v00 s SER 69 CO 0.16 0.22 0.39 0.72 0.41 0.00 0.00 173.24 175.13 1v00 s PHE 70 N -1.31 0.33 -0.08 2.43 -0.12 -0.62 -1.03 117.98 117.58 1v00 s PHE 70 Ca 0.27 -0.68 -0.12 0.00 -0.05 0.00 0.00 56.93 56.34 1v00 s PHE 70 Cb -0.12 0.09 0.03 0.00 -0.63 0.00 0.00 43.02 42.38 1v00 s PHE 70 CO 0.19 -0.85 0.30 -2.00 -0.05 0.00 0.00 175.22 172.81 1v00 s GLU 71 N -3.98 0.47 -0.01 1.99 2.12 0.35 -0.53 118.70 119.12 1v00 s GLU 71 Ca 0.19 0.20 -0.02 0.00 0.36 0.00 0.00 54.97 55.69 1v00 s GLU 71 Cb 0.01 0.22 -0.00 0.00 0.26 0.00 0.00 34.13 34.62 1v00 s GLU 71 CO 0.03 -0.09 0.05 -0.08 -0.54 0.00 0.00 175.26 174.63 1v00 s THR 72 N -0.38 0.04 0.02 -1.70 -1.32 0.04 -1.02 115.64 111.32 1v00 s THR 72 Ca -0.05 -0.35 0.01 0.00 -1.21 0.00 0.00 61.69 60.09 1v00 s THR 72 Cb -0.03 -0.20 -0.01 0.00 -1.51 0.00 0.00 72.50 70.75 1v00 s THR 72 CO 0.02 -0.19 -0.05 -0.13 -2.21 0.00 0.00 174.62 172.06 1v00 s ARG 73 N -0.59 0.36 0.11 7.08 0.52 -0.47 -0.96 118.95 125.01 1v00 s ARG 73 Ca -0.07 -0.46 -0.24 0.00 -0.52 0.00 0.00 55.73 54.44 1v00 s ARG 73 Cb -0.04 -0.17 0.07 0.00 0.52 0.00 0.00 34.95 35.32 1v00 s ARG 73 CO 0.00 0.03 0.61 -0.59 0.02 0.00 0.00 175.30 175.37 1v00 s PHE 74 N -0.86 -0.55 -0.08 -0.53 -0.71 -0.99 -0.19 117.98 114.06 1v00 s PHE 74 Ca -0.07 0.48 0.04 0.00 -1.04 0.00 0.00 56.93 56.34 1v00 s PHE 74 Cb -0.06 0.52 -0.01 0.00 -1.21 0.00 0.00 43.02 42.25 1v00 s PHE 74 CO -0.00 -0.79 -0.22 -1.12 -1.34 0.00 0.00 175.22 171.75 1v00 s SER 75 N -2.42 3.31 0.17 1.98 0.01 -1.08 -0.55 113.70 115.13 1v00 s SER 75 Ca -0.01 -0.47 -0.02 0.00 1.31 0.00 0.00 55.95 56.76 1v00 s SER 75 Cb -0.01 -1.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.05 1v00 s SER 75 CO -0.08 0.22 0.12 0.72 0.41 0.00 0.00 173.24 174.62 1v00 s PHE 76 N 0.01 0.99 -0.04 2.43 -0.12 -0.51 -0.65 117.98 120.09 1v00 s PHE 76 Ca -0.08 -1.28 -0.04 0.00 -0.05 0.00 0.00 56.93 55.48 1v00 s PHE 76 Cb -0.15 -0.49 0.01 0.00 -0.63 0.00 0.00 43.02 41.77 1v00 s PHE 76 CO 0.05 -0.61 0.11 -1.54 -0.05 0.00 0.00 175.22 173.18 1v00 s SER 77 N -3.11 -0.11 -0.12 1.98 1.04 0.21 -0.35 113.70 113.24 1v00 s SER 77 Ca 0.32 0.23 0.02 0.00 0.48 0.00 0.00 55.95 57.00 1v00 s SER 77 Cb 0.07 0.21 0.01 0.00 0.10 0.00 0.00 66.02 66.42 1v00 s SER 77 CO 0.08 -0.05 -0.17 -0.63 0.98 0.00 0.00 173.24 173.44 1v00 s ILE 78 N 0.20 1.68 -0.18 -1.02 1.01 -1.26 -2.09 121.20 119.55 1v00 s ILE 78 Ca -0.01 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.89 1v00 s ILE 78 Cb -0.02 -1.52 0.01 0.00 0.01 0.00 0.00 42.46 40.94 1v00 s ILE 78 CO -0.01 0.48 -0.17 -0.70 0.00 0.00 0.00 174.94 174.54 1v00 s GLU 79 N 0.98 3.10 -0.45 2.79 2.12 -1.25 -1.32 118.70 124.66 1v00 s GLU 79 Ca -0.06 -0.78 -0.08 0.00 0.36 0.00 0.00 54.97 54.41 1v00 s GLU 79 Cb -0.15 -2.64 0.11 0.00 0.26 0.00 0.00 34.13 31.72 1v00 s GLU 79 CO -0.03 -0.14 0.31 -0.65 -0.54 0.00 0.00 175.26 174.21 1v00 s GLN 80 N 1.18 2.44 0.49 4.30 -0.21 -1.26 -1.63 119.66 124.97 1v00 s GLN 80 Ca 0.02 -1.72 0.29 0.00 0.02 0.00 0.00 55.36 53.97 1v00 s GLN 80 Cb -0.14 -3.86 0.99 0.00 1.00 0.00 0.00 33.01 31.00 1v00 s GLN 80 CO -0.08 -1.14 1.85 -1.00 -2.12 0.00 0.00 175.29 172.80 1v00 h PRO 81 N 8.39 0.00 -6.70 2.91 0.13 -1.98 -3.46 132.00 131.29 1v00 h PRO 81 Ca -0.20 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.26 1v00 h PRO 81 Cb 1.07 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.01 1v00 h PRO 81 CO 0.82 0.06 -0.84 0.71 -0.23 0.00 0.00 178.00 178.53 1v00 s TYR 82 N -3.53 2.31 0.08 1.56 2.02 -1.26 -5.02 117.35 113.51 1v00 s TYR 82 Ca 0.03 -0.36 -0.05 0.00 -0.37 0.00 0.00 57.07 56.31 1v00 s TYR 82 Cb 0.08 -1.17 -0.25 0.00 -0.40 0.00 0.00 41.96 40.22 1v00 s TYR 82 CO 0.60 0.45 1.17 1.15 -1.57 0.00 0.00 175.55 177.35 1v00 h THR 83 N 3.39 1.47 -3.25 -0.71 2.02 -1.98 -3.45 112.91 110.40 1v00 h THR 83 Ca -0.48 -2.93 -0.14 0.00 0.77 0.00 0.00 66.41 63.64 1v00 h THR 83 Cb 1.20 2.85 -0.21 0.00 -1.74 0.00 0.00 68.15 70.24 1v00 h THR 83 CO 0.45 0.86 -0.39 0.00 0.37 0.00 0.00 175.52 176.82 1v00 s ARG 84 N -2.77 0.54 1.09 6.66 1.70 -1.26 -4.52 118.95 120.38 1v00 s ARG 84 Ca -0.05 -0.20 -0.15 0.00 -0.47 0.00 0.00 55.73 54.87 1v00 s ARG 84 Cb 0.07 0.23 0.23 0.00 -0.57 0.00 0.00 34.95 34.92 1v00 s ARG 84 CO 0.88 -0.13 1.09 -1.25 -1.08 0.00 0.00 175.30 174.81 1v00 s PRO 85 N -1.14 -0.32 0.37 3.89 0.04 -1.26 -5.03 135.00 131.55 1v00 s PRO 85 Ca -0.12 0.33 -0.28 0.00 0.04 0.00 0.00 61.00 60.97 1v00 s PRO 85 Cb -0.06 -1.67 -0.11 0.00 0.04 0.00 0.00 34.50 32.71 1v00 s PRO 85 CO 0.03 -3.19 1.50 -0.51 0.04 0.00 0.00 177.00 174.86 1v00 s LEU 86 N -6.71 4.32 0.79 -3.56 1.43 -1.26 -4.80 118.68 108.89 1v00 s LEU 86 Ca 0.67 3.04 -0.10 0.00 -1.03 0.00 0.00 54.13 56.71 1v00 s LEU 86 Cb -0.16 -3.66 0.07 0.00 0.03 0.00 0.00 46.19 42.46 1v00 s LEU 86 CO 0.58 -0.88 1.10 -2.16 0.23 0.00 0.00 176.35 175.22 1v00 s PRO 87 N -1.93 2.11 0.10 1.29 0.04 -1.26 -4.54 135.00 130.82 1v00 s PRO 87 Ca 0.54 1.20 -0.25 0.00 0.04 0.00 0.00 61.00 62.52 1v00 s PRO 87 Cb -0.47 -1.88 0.08 0.00 0.04 0.00 0.00 34.50 32.27 1v00 s PRO 87 CO 0.62 -1.75 0.77 0.00 0.04 0.00 0.00 177.00 176.67 1v00 s ALA 88 N -2.88 -1.66 0.00 8.56 0.00 -1.26 -4.33 121.76 120.19 1v00 s ALA 88 Ca 0.62 0.60 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1v00 s ALA 88 Cb -0.18 0.67 0.00 0.00 0.00 0.00 0.00 23.12 23.61 1v00 s ALA 88 CO 0.56 -0.79 0.00 -0.25 0.00 0.00 0.00 175.76 175.28 1v00 n ASP 89 N -0.34 3.46 0.00 0.00 9.92 0.44 -3.40 116.55 126.64 1v00 n ASP 89 Ca -0.11 -0.02 0.00 0.00 -0.53 0.00 0.00 54.79 54.12 1v00 n ASP 89 Cb 0.63 0.74 0.00 0.00 -0.64 0.00 0.00 41.12 41.85 1v00 n ASP 89 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1v00 n GLY 90 N 1.78 0.08 3.17 0.44 0.00 -0.97 -1.56 105.19 108.11 1v00 n GLY 90 Ca 0.00 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.12 1v00 n GLY 90 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1v00 s LEU 91 N 0.00 2.34 -0.04 0.99 0.05 -0.78 -1.39 118.68 119.86 1v00 s LEU 91 Ca 0.00 -1.06 -0.27 0.00 0.05 0.00 0.00 54.13 52.85 1v00 s LEU 91 Cb 0.00 0.03 0.06 0.00 -2.05 0.00 0.00 46.19 44.23 1v00 s LEU 91 CO 0.00 -0.54 0.60 0.54 -0.55 0.00 0.00 176.35 176.39 1v00 s VAL 92 N -3.74 0.01 -0.20 1.48 0.11 0.10 -0.84 120.40 117.33 1v00 s VAL 92 Ca 0.15 -0.11 -0.09 0.00 -2.93 0.00 0.00 61.98 59.00 1v00 s VAL 92 Cb 0.06 -0.92 -0.05 0.00 -1.53 0.00 0.00 36.38 33.94 1v00 s VAL 92 CO -0.03 -0.06 0.11 0.12 -3.33 0.00 0.00 175.10 171.91 1v00 s PHE 93 N -1.29 3.37 0.08 1.54 5.36 -0.49 -0.75 117.98 125.80 1v00 s PHE 93 Ca -0.11 0.26 0.01 0.00 -0.96 0.00 0.00 56.93 56.13 1v00 s PHE 93 Cb -0.01 -2.14 -0.04 0.00 -0.34 0.00 0.00 43.02 40.49 1v00 s PHE 93 CO 0.08 0.25 -0.06 -0.59 -1.46 0.00 0.00 175.22 173.43 1v00 s PHE 94 N 0.39 0.78 -0.04 10.12 -0.71 -0.18 -1.07 117.98 127.27 1v00 s PHE 94 Ca 0.07 -0.83 0.00 0.00 -1.04 0.00 0.00 56.93 55.13 1v00 s PHE 94 Cb -0.11 -0.47 0.03 0.00 -1.21 0.00 0.00 43.02 41.25 1v00 s PHE 94 CO -0.01 -0.16 -0.00 -1.64 -1.34 0.00 0.00 175.22 172.06 1v00 s MET 95 N -3.29 0.43 0.00 1.99 -1.94 0.11 -1.21 119.30 115.39 1v00 s MET 95 Ca 0.06 0.06 0.00 0.00 -1.71 0.00 0.00 55.69 54.10 1v00 s MET 95 Cb 0.02 -0.63 0.00 0.00 2.01 0.00 0.00 34.83 36.23 1v00 s MET 95 CO -0.04 -0.16 0.00 0.41 -0.01 0.00 0.00 175.02 175.22 1v00 n GLY 96 N 4.34 1.92 3.54 -0.03 0.00 -0.89 -1.10 105.19 112.96 1v00 n GLY 96 Ca -0.22 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 1v00 n GLY 96 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1v00 n PRO 97 N 0.00 0.90 -1.41 1.61 -0.02 -1.25 -0.97 135.00 133.87 1v00 n PRO 97 Ca 0.00 0.33 -0.30 0.00 -2.02 0.00 0.00 63.50 61.51 1v00 n PRO 97 Cb 0.00 -1.82 0.11 0.00 -0.02 0.00 0.00 33.50 31.78 1v00 n PRO 97 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1v00 s THR 98 N -1.43 2.80 -1.93 3.45 -4.23 -1.26 -3.72 115.64 109.31 1v00 s THR 98 Ca 0.65 0.26 0.00 0.00 -1.18 0.00 0.00 61.69 61.42 1v00 s THR 98 Cb -0.54 -2.90 0.00 0.00 1.34 0.00 0.00 72.50 70.40 1v00 s THR 98 CO 0.56 -0.34 0.00 0.29 -0.54 0.00 0.00 174.62 174.59 1v00 n LYS 99 N -3.65 -1.60 -2.63 3.99 4.76 -1.26 -4.96 118.16 112.81 1v00 n LYS 99 Ca 0.07 1.08 -0.33 0.00 -2.87 0.00 0.00 58.31 56.26 1v00 n LYS 99 Cb 0.56 -5.62 -0.05 0.00 -1.84 0.00 0.00 35.03 28.08 1v00 n LYS 99 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1v00 s SER 100 N -2.36 6.63 0.30 4.39 1.04 -1.24 -5.07 113.70 117.40 1v00 s SER 100 Ca 0.00 1.76 0.10 0.00 0.48 0.00 0.00 55.95 58.29 1v00 s SER 100 Cb 0.00 -2.54 -0.05 0.00 0.10 0.00 0.00 66.02 63.53 1v00 s SER 100 CO 0.00 -0.58 -0.06 -0.54 0.98 0.00 0.00 173.24 173.05 1v00 s LYS 101 N -3.36 2.01 0.35 4.02 -0.14 -1.26 -5.08 119.74 116.28 1v00 s LYS 101 Ca 0.63 -1.68 -0.27 0.00 -1.36 0.00 0.00 55.97 53.29 1v00 s LYS 101 Cb -0.12 -1.93 -0.12 0.00 -1.68 0.00 0.00 37.83 33.98 1v00 s LYS 101 CO 0.19 0.25 1.25 -0.35 -0.76 0.00 0.00 175.35 175.92 1v00 n PRO 102 N -0.84 1.99 0.00 -1.68 -0.04 -1.26 -5.00 135.00 128.17 1v00 n PRO 102 Ca -0.05 0.70 0.00 0.00 -0.04 0.00 0.00 63.50 64.11 1v00 n PRO 102 Cb 0.61 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.80 1v00 n PRO 102 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1v00 n ALA 103 N 0.22 0.00 -1.75 0.55 0.00 -0.55 -5.01 120.51 113.98 1v00 n ALA 103 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.13 1v00 n ALA 103 Cb 0.36 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.85 1v00 n ALA 103 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1v00 s GLN 104 N 2.35 3.01 0.00 0.00 -1.52 -0.93 -4.56 119.66 118.02 1v00 s GLN 104 Ca 0.00 1.96 0.00 0.00 -1.95 0.00 0.00 55.36 55.37 1v00 s GLN 104 Cb 0.00 -2.04 0.00 0.00 -0.22 0.00 0.00 33.01 30.75 1v00 s GLN 104 CO 0.00 -1.21 0.00 0.41 -0.25 0.00 0.00 175.29 174.24 1v00 n GLY 105 N 0.63 1.32 7.00 3.09 0.00 -1.26 -0.16 105.19 115.81 1v00 n GLY 105 Ca 0.13 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1v00 n GLY 105 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1v00 n TYR 106 N 0.00 0.00 0.20 1.61 0.53 -1.26 -1.71 117.16 116.53 1v00 n TYR 106 Ca 0.00 0.00 0.11 0.00 -1.02 0.00 0.00 57.90 56.99 1v00 n TYR 106 Cb 0.00 0.01 0.54 0.00 -1.03 0.00 0.00 39.34 38.86 1v00 n TYR 106 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1v00 n GLY 107 N 0.00 -0.92 0.28 2.72 0.00 -1.26 -1.38 105.19 104.62 1v00 n GLY 107 Ca 0.00 0.17 0.14 0.00 0.00 0.00 0.00 46.02 46.33 1v00 n GLY 107 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1v00 n TYR 108 N -2.22 0.00 -1.67 1.61 4.01 -0.69 -4.94 117.16 113.26 1v00 n TYR 108 Ca -0.01 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.61 1v00 n TYR 108 Cb 0.07 -0.05 -0.04 0.00 -0.31 0.00 0.00 39.34 39.01 1v00 n TYR 108 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1v00 n LEU 109 N -0.40 -0.97 -0.09 7.72 4.77 -0.48 -1.42 117.00 126.14 1v00 n LEU 109 Ca 0.18 0.27 -0.01 0.00 -0.03 0.00 0.00 56.01 56.43 1v00 n LEU 109 Cb 0.28 -1.96 -0.00 0.00 -2.33 0.00 0.00 43.42 39.41 1v00 n LEU 109 CO 0.19 -0.49 -0.01 0.61 -1.33 0.00 0.00 177.39 176.36 1v00 n GLY 110 N -0.40 0.47 0.01 -0.72 0.00 0.77 -4.27 105.19 101.06 1v00 n GLY 110 Ca -0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 46.02 45.67 1v00 n GLY 110 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1v00 n VAL 111 N -2.79 0.09 -4.09 1.61 0.31 -0.50 -1.48 118.33 111.47 1v00 n VAL 111 Ca -0.01 -0.04 -0.24 0.00 -0.01 0.00 0.00 64.34 64.03 1v00 n VAL 111 Cb 0.12 -0.68 -0.07 0.00 -0.91 0.00 0.00 33.84 32.31 1v00 n VAL 111 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1v00 s PHE 112 N -2.03 2.60 -0.16 3.52 0.40 -0.95 -4.72 117.98 116.63 1v00 s PHE 112 Ca -0.02 -0.59 0.01 0.00 -0.60 0.00 0.00 56.93 55.74 1v00 s PHE 112 Cb 0.01 -1.97 0.01 0.00 0.51 0.00 0.00 43.02 41.57 1v00 s PHE 112 CO 0.04 0.15 0.45 0.09 0.70 0.00 0.00 175.22 176.65 1v00 n ASN 113 N -1.27 0.91 -1.16 1.36 3.02 -1.26 -2.18 115.26 114.68 1v00 n ASN 113 Ca -0.01 -0.96 -0.00 0.00 -0.03 0.00 0.00 54.58 53.58 1v00 n ASN 113 Cb 0.64 0.20 0.00 0.00 -0.61 0.00 0.00 39.78 40.01 1v00 n ASN 113 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1v00 n ASN 114 N -0.14 -0.12 -1.37 6.41 0.23 -1.26 -4.92 115.26 114.09 1v00 n ASN 114 Ca 0.01 -1.07 -0.01 0.00 -0.53 0.00 0.00 54.58 52.98 1v00 n ASN 114 Cb 0.03 0.20 0.26 0.00 -2.08 0.00 0.00 39.78 38.19 1v00 n ASN 114 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1v00 n SER 115 N -0.63 3.80 -4.91 0.53 3.41 -1.26 -4.58 113.62 109.98 1v00 n SER 115 Ca -0.00 -3.32 -0.28 0.00 -0.26 0.00 0.00 58.87 55.01 1v00 n SER 115 Cb 0.04 -0.65 -0.02 0.00 -0.26 0.00 0.00 64.21 63.32 1v00 n SER 115 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1v00 s LYS 116 N -3.02 3.62 -0.92 4.33 3.01 -1.26 -4.70 119.74 120.79 1v00 s LYS 116 Ca 0.48 0.03 -0.10 0.00 -1.01 0.00 0.00 55.97 55.37 1v00 s LYS 116 Cb 0.40 -2.59 0.24 0.00 -1.01 0.00 0.00 37.83 34.87 1v00 s LYS 116 CO 0.08 0.12 0.87 -1.14 0.51 0.00 0.00 175.35 175.79 1v00 s GLN 117 N -3.85 3.72 -0.28 1.68 0.74 -1.26 -4.46 119.66 115.95 1v00 s GLN 117 Ca 0.45 -2.83 -0.12 0.00 0.05 0.00 0.00 55.36 52.91 1v00 s GLN 117 Cb -0.10 -4.38 -0.04 0.00 1.10 0.00 0.00 33.01 29.58 1v00 s GLN 117 CO 0.33 -1.26 0.24 0.34 -0.55 0.00 0.00 175.29 174.39 1v00 s ASP 118 N 1.52 6.08 0.55 6.67 -1.08 -0.96 -4.97 116.67 124.48 1v00 s ASP 118 Ca 0.23 0.03 0.25 0.00 -0.52 0.00 0.00 52.55 52.54 1v00 s ASP 118 Cb -0.11 -2.14 1.46 0.00 -1.46 0.00 0.00 42.92 40.67 1v00 s ASP 118 CO -0.08 -0.10 2.05 -0.55 0.52 0.00 0.00 175.17 177.00 1v00 h ASN 119 N 8.34 0.00 0.12 -0.34 -1.07 -1.95 -1.23 115.58 119.44 1v00 h ASN 119 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.03 1v00 h ASN 119 Cb 1.18 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.43 1v00 h ASN 119 CO 0.58 0.00 0.00 0.77 0.07 0.00 0.00 177.43 178.85 1v00 h SER 120 N 0.00 0.00 -0.08 6.14 4.64 -1.94 -1.58 113.55 120.73 1v00 h SER 120 Ca 0.16 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.40 1v00 h SER 120 Cb 0.68 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 1v00 h SER 120 CO -0.00 0.00 -0.15 1.88 -0.87 0.00 0.00 176.83 177.69 1v00 h TYR 121 N 0.00 0.46 -6.94 4.77 0.05 -1.55 -3.46 116.97 110.31 1v00 h TYR 121 Ca 0.00 -0.07 -0.59 0.00 0.05 0.00 0.00 58.73 58.12 1v00 h TYR 121 Cb 0.06 -0.12 -0.18 0.00 1.01 0.00 0.00 36.73 37.49 1v00 h TYR 121 CO 0.00 0.57 -0.94 1.04 -1.05 0.00 0.00 178.16 177.78 1v00 n GLN 122 N -4.20 -1.59 -4.55 4.88 6.02 -0.59 -4.57 117.38 112.78 1v00 n GLN 122 Ca 0.00 0.18 -0.21 0.00 -0.01 0.00 0.00 57.00 56.96 1v00 n GLN 122 Cb 0.32 -3.95 -0.15 0.00 1.02 0.00 0.00 30.24 27.48 1v00 n GLN 122 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1v00 s THR 123 N -4.16 0.97 -0.04 5.09 2.01 -1.26 -3.89 115.64 114.36 1v00 s THR 123 Ca 0.09 -0.52 0.07 0.00 0.31 0.00 0.00 61.69 61.64 1v00 s THR 123 Cb -0.05 -0.82 -0.01 0.00 0.01 0.00 0.00 72.50 71.63 1v00 s THR 123 CO 0.97 0.28 -0.24 -0.22 -0.69 0.00 0.00 174.62 174.72 1v00 s LEU 124 N -0.23 2.04 0.07 4.42 2.96 -0.26 -0.67 118.68 127.01 1v00 s LEU 124 Ca 0.04 -0.46 -0.18 0.00 -0.22 0.00 0.00 54.13 53.30 1v00 s LEU 124 Cb -0.05 -1.27 0.04 0.00 0.50 0.00 0.00 46.19 45.40 1v00 s LEU 124 CO -0.00 0.27 0.43 0.00 -1.32 0.00 0.00 176.35 175.72 1v00 s ALA 125 N -0.36 -1.04 -0.22 5.97 0.00 0.06 -0.71 121.76 125.46 1v00 s ALA 125 Ca 0.03 0.26 0.01 0.00 0.00 0.00 0.00 51.96 52.26 1v00 s ALA 125 Cb -0.11 0.45 0.05 0.00 0.00 0.00 0.00 23.12 23.51 1v00 s ALA 125 CO 0.01 -0.52 -0.09 0.08 0.00 0.00 0.00 175.76 175.24 1v00 s VAL 126 N -2.84 1.72 0.18 0.00 1.01 -0.23 0.20 120.40 120.43 1v00 s VAL 126 Ca -0.03 -1.20 0.03 0.00 0.00 0.00 0.00 61.98 60.78 1v00 s VAL 126 Cb -0.00 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1v00 s VAL 126 CO -0.05 0.05 0.31 -1.83 0.00 0.00 0.00 175.10 173.58 1v00 s GLU 127 N 1.33 3.44 -0.47 2.72 -1.05 0.22 -1.39 118.70 123.51 1v00 s GLU 127 Ca -0.04 -0.66 0.03 0.00 -0.15 0.00 0.00 54.97 54.15 1v00 s GLU 127 Cb -0.18 -2.94 0.15 0.00 -0.44 0.00 0.00 34.13 30.72 1v00 s GLU 127 CO -0.07 0.49 0.29 -0.06 0.95 0.00 0.00 175.26 176.86 1v00 s PHE 128 N -1.83 2.00 -0.25 4.83 0.08 -0.02 -1.30 117.98 121.50 1v00 s PHE 128 Ca 0.34 -2.49 -0.20 0.00 0.12 0.00 0.00 56.93 54.70 1v00 s PHE 128 Cb -0.10 -1.80 -0.02 0.00 -0.57 0.00 0.00 43.02 40.53 1v00 s PHE 128 CO 0.29 -0.76 0.62 0.34 -0.10 0.00 0.00 175.22 175.61 1v00 s ASP 129 N 0.10 6.58 0.00 1.36 -1.08 -0.26 -1.86 116.67 121.51 1v00 s ASP 129 Ca 0.21 0.71 0.19 0.00 -0.52 0.00 0.00 52.55 53.15 1v00 s ASP 129 Cb -0.17 -2.33 -0.09 0.00 -1.46 0.00 0.00 42.92 38.86 1v00 s ASP 129 CO -0.05 -0.35 0.91 0.35 0.52 0.00 0.00 175.17 176.55 1v00 n THR 130 N 5.11 0.00 -4.66 1.71 -2.24 -0.60 -1.15 114.28 112.44 1v00 n THR 130 Ca -0.01 -0.19 -0.25 0.00 -2.27 0.00 0.00 64.05 61.33 1v00 n THR 130 Cb 0.49 1.13 -0.16 0.00 -2.10 0.00 0.00 70.33 69.69 1v00 n THR 130 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1v00 s PHE 131 N -2.47 1.54 -0.63 4.78 5.36 -1.17 -4.67 117.98 120.71 1v00 s PHE 131 Ca 0.12 -0.53 -0.24 0.00 -0.96 0.00 0.00 56.93 55.32 1v00 s PHE 131 Cb 0.15 -1.10 0.05 0.00 -0.34 0.00 0.00 43.02 41.79 1v00 s PHE 131 CO 0.62 -0.25 1.03 0.45 -1.46 0.00 0.00 175.22 175.62 1v00 s SER 132 N 0.47 6.25 0.81 6.13 0.15 -1.26 -4.99 113.70 121.26 1v00 s SER 132 Ca -0.12 -0.56 -0.09 0.00 0.70 0.00 0.00 55.95 55.88 1v00 s SER 132 Cb -0.14 -2.46 0.13 0.00 -1.71 0.00 0.00 66.02 61.83 1v00 s SER 132 CO 0.03 -1.44 1.14 0.20 1.20 0.00 0.00 173.24 174.38 1v00 s ASN 133 N 3.32 4.08 0.55 5.45 -0.87 -1.26 -4.91 114.94 121.29 1v00 s ASN 133 Ca 0.29 0.26 0.25 0.00 -1.57 0.00 0.00 52.86 52.09 1v00 s ASN 133 Cb -0.13 -0.62 1.45 0.00 -0.02 0.00 0.00 41.25 41.93 1v00 s ASN 133 CO 0.16 -2.09 2.05 -0.65 -2.57 0.00 0.00 177.10 174.00 1v00 h PRO 134 N -1.01 0.00 -0.01 -0.60 0.11 -1.98 -1.04 132.00 127.46 1v00 h PRO 134 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1v00 h PRO 134 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1v00 h PRO 134 CO 0.49 0.00 -0.07 -2.67 -0.21 0.00 0.00 178.00 175.54 1v00 n TRP 135 N -4.21 0.00 -3.36 0.65 2.14 -1.26 -4.94 117.44 106.46 1v00 n TRP 135 Ca 0.05 0.00 -0.21 0.00 2.07 0.00 0.00 57.50 59.40 1v00 n TRP 135 Cb 0.42 -0.03 -0.00 0.00 -0.81 0.00 0.00 31.31 30.89 1v00 n TRP 135 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1v00 s ASP 136 N -2.13 6.02 0.68 -0.67 1.01 -0.40 -4.79 116.67 116.40 1v00 s ASP 136 Ca 0.34 0.11 -0.11 0.00 0.71 0.00 0.00 52.55 53.60 1v00 s ASP 136 Cb 0.20 -1.55 -0.00 0.00 1.01 0.00 0.00 42.92 42.58 1v00 s ASP 136 CO 0.38 -0.45 1.05 -2.16 0.21 0.00 0.00 175.17 174.20 1v00 s PRO 137 N -4.30 3.06 0.39 8.23 0.04 -1.26 -4.81 135.00 136.34 1v00 s PRO 137 Ca 0.44 0.90 0.12 0.00 0.04 0.00 0.00 61.00 62.50 1v00 s PRO 137 Cb -0.10 -2.01 0.77 0.00 0.04 0.00 0.00 34.50 33.21 1v00 s PRO 137 CO 0.34 -1.00 1.87 -1.00 0.04 0.00 0.00 177.00 177.25 1v00 h PRO 138 N -0.64 0.07 -6.35 0.56 0.13 -1.97 -3.44 132.00 120.35 1v00 h PRO 138 Ca -0.44 -0.02 -0.55 0.00 -0.87 0.00 0.00 66.00 64.12 1v00 h PRO 138 Cb 1.21 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1v00 h PRO 138 CO 0.58 0.35 0.79 -0.65 -0.23 0.00 0.00 178.00 178.84 1v00 s GLN 139 N -4.40 4.30 0.01 0.86 1.11 -1.26 -4.81 119.66 115.48 1v00 s GLN 139 Ca -0.04 1.86 0.01 0.00 0.01 0.00 0.00 55.36 57.21 1v00 s GLN 139 Cb 0.15 -3.57 -0.01 0.00 -1.01 0.00 0.00 33.01 28.57 1v00 s GLN 139 CO 0.72 -0.53 -0.04 0.14 0.01 0.00 0.00 175.29 175.59 1v00 s VAL 140 N 2.35 0.31 0.83 1.09 -7.23 -1.26 -4.26 120.40 112.23 1v00 s VAL 140 Ca 0.61 -0.53 -0.12 0.00 -1.81 0.00 0.00 61.98 60.13 1v00 s VAL 140 Cb -0.29 -0.33 0.09 0.00 0.56 0.00 0.00 36.38 36.41 1v00 s VAL 140 CO 0.25 -0.15 1.13 -2.16 -0.31 0.00 0.00 175.10 173.86 1v00 s PRO 141 N -0.72 1.80 0.03 4.82 0.04 -1.25 -4.95 135.00 134.77 1v00 s PRO 141 Ca -0.05 0.36 -0.13 0.00 0.04 0.00 0.00 61.00 61.22 1v00 s PRO 141 Cb -0.05 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.60 1v00 s PRO 141 CO -0.00 -1.76 0.29 -3.38 0.04 0.00 0.00 177.00 172.19 1v00 s HIS 142 N -3.32 -0.10 0.13 0.56 -3.43 -0.30 -1.88 115.29 106.95 1v00 s HIS 142 Ca 0.62 -0.01 -0.09 0.00 -0.80 0.00 0.00 55.06 54.78 1v00 s HIS 142 Cb -0.13 0.08 -0.06 0.00 -1.43 0.00 0.00 32.58 31.03 1v00 s HIS 142 CO 0.52 -0.47 0.44 0.42 -2.00 0.00 0.00 174.74 173.65 1v00 s ILE 143 N -2.32 5.06 -0.06 -5.38 1.01 0.97 -1.10 121.20 119.37 1v00 s ILE 143 Ca -0.07 0.39 -0.09 0.00 0.00 0.00 0.00 60.65 60.89 1v00 s ILE 143 Cb -0.02 -3.64 0.02 0.00 0.01 0.00 0.00 42.46 38.83 1v00 s ILE 143 CO -0.02 0.16 0.23 -0.83 0.00 0.00 0.00 174.94 174.47 1v00 s GLY 144 N -2.03 -0.13 -0.31 6.18 0.00 -0.42 -0.73 107.32 109.89 1v00 s GLY 144 Ca 0.38 0.45 -0.11 0.00 0.00 0.00 0.00 44.72 45.44 1v00 s GLY 144 CO 0.20 0.33 0.19 -0.42 0.00 0.00 0.00 173.10 173.41 1v00 s ILE 145 N -0.39 5.07 -0.22 0.90 1.01 -0.73 -0.61 121.20 126.24 1v00 s ILE 145 Ca -0.05 -0.12 -0.05 0.00 0.00 0.00 0.00 60.65 60.43 1v00 s ILE 145 Cb -0.03 -3.52 -0.02 0.00 0.01 0.00 0.00 42.46 38.90 1v00 s ILE 145 CO 0.01 0.13 0.01 -1.81 0.00 0.00 0.00 174.94 173.28 1v00 s ASP 146 N 1.70 4.81 -0.35 3.58 1.01 0.13 -1.52 116.67 126.03 1v00 s ASP 146 Ca 0.06 -0.24 0.03 0.00 0.71 0.00 0.00 52.55 53.11 1v00 s ASP 146 Cb -0.17 -1.83 0.10 0.00 1.01 0.00 0.00 42.92 42.03 1v00 s ASP 146 CO 0.09 0.02 0.07 -0.69 0.21 0.00 0.00 175.17 174.88 1v00 s VAL 147 N 1.24 2.43 -1.78 -1.27 1.01 -1.26 -0.76 120.40 120.01 1v00 s VAL 147 Ca 0.04 -2.31 0.00 0.00 0.00 0.00 0.00 61.98 59.70 1v00 s VAL 147 Cb -0.15 -2.77 0.00 0.00 0.00 0.00 0.00 36.38 33.46 1v00 s VAL 147 CO 0.01 -0.61 0.00 0.59 0.00 0.00 0.00 175.10 175.09 1v00 n ASN 148 N 4.29 -5.21 -3.58 3.32 3.02 0.15 -4.92 115.26 112.34 1v00 n ASN 148 Ca 0.03 0.23 -0.10 0.00 -0.03 0.00 0.00 54.58 54.71 1v00 n ASN 148 Cb 0.42 -4.48 -0.05 0.00 -0.61 0.00 0.00 39.78 35.06 1v00 n ASN 148 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1v00 s SER 149 N -2.29 -0.35 0.23 6.41 0.15 -1.26 -2.26 113.70 114.33 1v00 s SER 149 Ca 0.00 0.39 0.25 0.00 0.70 0.00 0.00 55.95 57.29 1v00 s SER 149 Cb 0.00 0.30 0.86 0.00 -1.71 0.00 0.00 66.02 65.46 1v00 s SER 149 CO 0.00 -0.32 1.76 0.00 1.20 0.00 0.00 173.24 175.88 1v00 n ILE 150 N 0.75 0.67 -2.88 6.45 0.13 -1.26 -4.39 119.36 118.83 1v00 n ILE 150 Ca -0.10 -0.14 -0.43 0.00 -1.10 0.00 0.00 62.75 60.98 1v00 n ILE 150 Cb 0.58 -0.75 -0.04 0.00 -0.84 0.00 0.00 39.64 38.58 1v00 n ILE 150 CO 0.00 0.00 0.00 -0.60 2.80 0.00 0.00 176.55 178.75 1v00 s ARG 151 N -3.17 3.21 0.37 9.51 3.52 -1.26 -4.97 118.95 126.16 1v00 s ARG 151 Ca 0.09 -0.58 -0.28 0.00 -0.13 0.00 0.00 55.73 54.83 1v00 s ARG 151 Cb 0.11 -4.14 -0.10 0.00 -1.56 0.00 0.00 34.95 29.26 1v00 s ARG 151 CO 0.54 -1.61 1.41 -1.12 -0.81 0.00 0.00 175.30 173.71 1v00 s SER 152 N 3.21 6.42 0.21 -2.12 0.01 -1.26 -4.79 113.70 115.39 1v00 s SER 152 Ca 0.25 2.89 0.26 0.00 1.31 0.00 0.00 55.95 60.66 1v00 s SER 152 Cb -0.15 -2.66 0.85 0.00 0.21 0.00 0.00 66.02 64.27 1v00 s SER 152 CO 0.14 -0.80 1.77 2.30 0.41 0.00 0.00 173.24 177.06 1v00 n ILE 153 N 0.47 0.62 -3.63 1.44 -5.35 -0.57 -4.80 119.36 107.53 1v00 n ILE 153 Ca 0.01 -0.18 -0.12 0.00 -0.27 0.00 0.00 62.75 62.19 1v00 n ILE 153 Cb 0.41 -0.69 -0.07 0.00 -1.74 0.00 0.00 39.64 37.55 1v00 n ILE 153 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1v00 s LYS 154 N -3.14 0.74 0.13 6.28 2.20 -1.25 -5.03 119.74 119.68 1v00 s LYS 154 Ca 0.10 0.89 0.04 0.00 -0.36 0.00 0.00 55.97 56.64 1v00 s LYS 154 Cb 0.12 0.36 -0.04 0.00 -1.51 0.00 0.00 37.83 36.75 1v00 s LYS 154 CO 0.56 -0.09 -0.10 0.95 -0.36 0.00 0.00 175.35 176.30 1v00 s THR 155 N 0.38 1.11 -0.17 3.43 -4.23 -1.26 -1.77 115.64 113.13 1v00 s THR 155 Ca 0.01 -1.95 -0.04 0.00 -1.18 0.00 0.00 61.69 58.53 1v00 s THR 155 Cb -0.05 -1.72 0.08 0.00 1.34 0.00 0.00 72.50 72.15 1v00 s THR 155 CO -0.02 -0.69 0.20 -1.58 -0.54 0.00 0.00 174.62 171.99 1v00 s GLN 156 N -3.48 0.14 0.55 3.99 2.00 0.09 -4.95 119.66 118.00 1v00 s GLN 156 Ca 0.14 0.29 -0.20 0.00 -2.00 0.00 0.00 55.36 53.58 1v00 s GLN 156 Cb 0.01 -1.00 -0.05 0.00 0.80 0.00 0.00 33.01 32.77 1v00 s GLN 156 CO 0.00 -0.56 1.19 -2.14 -0.50 0.00 0.00 175.29 173.29 1v00 s PRO 157 N 2.30 3.24 0.01 1.67 0.02 -1.26 -0.02 135.00 140.96 1v00 s PRO 157 Ca 0.05 1.79 -0.11 0.00 0.02 0.00 0.00 61.00 62.75 1v00 s PRO 157 Cb -0.15 -2.07 0.01 0.00 0.02 0.00 0.00 34.50 32.32 1v00 s PRO 157 CO -0.10 -0.98 0.23 -0.59 -0.33 0.00 0.00 177.00 175.23 1v00 s PHE 158 N -1.61 -0.05 -0.05 6.54 -0.71 -0.79 -4.84 117.98 116.47 1v00 s PHE 158 Ca 0.73 0.01 -0.21 0.00 -1.04 0.00 0.00 56.93 56.41 1v00 s PHE 158 Cb -0.29 0.02 -0.04 0.00 -1.21 0.00 0.00 43.02 41.50 1v00 s PHE 158 CO 0.33 -0.37 0.62 -1.14 -1.34 0.00 0.00 175.22 173.32 1v00 s GLN 159 N -1.66 4.38 0.35 1.99 0.74 -1.26 -3.76 119.66 120.44 1v00 s GLN 159 Ca -0.12 0.74 -0.26 0.00 0.05 0.00 0.00 55.36 55.77 1v00 s GLN 159 Cb -0.05 -3.41 -0.10 0.00 1.10 0.00 0.00 33.01 30.56 1v00 s GLN 159 CO 0.01 0.19 0.99 -1.17 -0.55 0.00 0.00 175.29 174.77 1v00 s LEU 160 N 0.41 4.28 -0.64 3.68 2.96 -1.26 -4.98 118.68 123.13 1v00 s LEU 160 Ca 0.33 1.94 -0.01 0.00 -0.22 0.00 0.00 54.13 56.17 1v00 s LEU 160 Cb -0.17 -4.05 0.16 0.00 0.50 0.00 0.00 46.19 42.62 1v00 s LEU 160 CO 0.16 -0.23 0.44 -0.62 -1.32 0.00 0.00 176.35 174.78 1v00 s ASP 161 N -1.55 5.07 -0.46 3.68 2.15 -1.26 -5.04 116.67 119.27 1v00 s ASP 161 Ca 0.53 -3.06 -0.42 0.00 0.43 0.00 0.00 52.55 50.03 1v00 s ASP 161 Cb -0.21 -1.80 -0.18 0.00 -0.30 0.00 0.00 42.92 40.44 1v00 s ASP 161 CO 0.26 -0.30 1.76 -3.20 -0.17 0.00 0.00 175.17 173.53 1v00 n ASN 162 N 3.17 0.86 0.00 -0.34 2.85 -1.26 -0.45 115.26 120.09 1v00 n ASN 162 Ca 0.09 0.82 0.00 0.00 -0.11 0.00 0.00 54.58 55.38 1v00 n ASN 162 Cb 0.36 -0.82 0.00 0.00 1.24 0.00 0.00 39.78 40.56 1v00 n ASN 162 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1v00 n GLY 163 N 5.56 1.53 3.89 8.20 0.00 -0.43 -4.97 105.19 118.96 1v00 n GLY 163 Ca 0.41 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.15 1v00 n GLY 163 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1v00 s GLN 164 N -0.10 3.47 -0.04 1.61 -1.52 0.40 -4.80 119.66 118.68 1v00 s GLN 164 Ca 0.00 0.40 -0.25 0.00 -1.95 0.00 0.00 55.36 53.57 1v00 s GLN 164 Cb 0.00 -2.24 -0.04 0.00 -0.22 0.00 0.00 33.01 30.51 1v00 s GLN 164 CO 0.00 -0.43 0.75 0.08 -0.25 0.00 0.00 175.29 175.44 1v00 s VAL 165 N -2.96 4.96 -0.04 1.09 1.01 -1.26 -4.31 120.40 118.89 1v00 s VAL 165 Ca 0.51 1.56 0.02 0.00 0.00 0.00 0.00 61.98 64.07 1v00 s VAL 165 Cb -0.11 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 1v00 s VAL 165 CO 0.49 0.26 -0.07 0.00 0.00 0.00 0.00 175.10 175.78 1v00 s ALA 166 N 0.65 2.97 -0.17 5.51 0.00 0.52 -4.08 121.76 127.16 1v00 s ALA 166 Ca 0.40 -0.95 -0.06 0.00 0.00 0.00 0.00 51.96 51.35 1v00 s ALA 166 Cb -0.19 -1.17 -0.03 0.00 0.00 0.00 0.00 23.12 21.73 1v00 s ALA 166 CO 0.20 0.59 0.02 -0.80 0.00 0.00 0.00 175.76 175.77 1v00 s ASN 167 N -1.04 5.25 -0.03 0.00 0.01 0.88 -1.42 114.94 118.58 1v00 s ASN 167 Ca 0.14 -0.02 0.05 0.00 -0.71 0.00 0.00 52.86 52.33 1v00 s ASN 167 Cb -0.11 -1.88 -0.02 0.00 0.41 0.00 0.00 41.25 39.64 1v00 s ASN 167 CO 0.04 0.17 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.91 1v00 s VAL 168 N 0.39 2.67 -0.07 1.60 1.01 0.29 -0.74 120.40 125.56 1v00 s VAL 168 Ca -0.00 -0.90 -0.00 0.00 0.00 0.00 0.00 61.98 61.08 1v00 s VAL 168 Cb -0.13 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.26 1v00 s VAL 168 CO 0.01 0.57 -0.04 -0.69 0.00 0.00 0.00 175.10 174.96 1v00 s VAL 169 N -0.70 0.62 -0.10 2.92 1.01 -0.32 -2.35 120.40 121.48 1v00 s VAL 169 Ca 0.11 -0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.03 1v00 s VAL 169 Cb -0.10 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.60 1v00 s VAL 169 CO 0.00 0.28 -0.17 -0.63 0.00 0.00 0.00 175.10 174.58 1v00 s ILE 170 N 1.48 1.55 -0.01 2.22 1.01 -0.13 -0.03 121.20 127.29 1v00 s ILE 170 Ca -0.02 -0.70 0.01 0.00 0.00 0.00 0.00 60.65 59.95 1v00 s ILE 170 Cb -0.13 -1.40 0.01 0.00 0.01 0.00 0.00 42.46 40.95 1v00 s ILE 170 CO -0.04 0.45 -0.03 -0.75 0.00 0.00 0.00 174.94 174.57 1v00 s LYS 171 N 0.77 0.38 -0.15 2.79 2.20 0.16 -0.78 119.74 125.12 1v00 s LYS 171 Ca -0.11 -0.10 0.01 0.00 -0.36 0.00 0.00 55.97 55.42 1v00 s LYS 171 Cb -0.16 -0.41 0.02 0.00 -1.51 0.00 0.00 37.83 35.77 1v00 s LYS 171 CO 0.02 0.02 -0.18 -0.47 -0.36 0.00 0.00 175.35 174.38 1v00 s TYR 172 N 0.25 2.47 -0.34 4.03 5.04 0.32 -0.89 117.35 128.22 1v00 s TYR 172 Ca -0.02 -1.33 -0.09 0.00 -2.44 0.00 0.00 57.07 53.18 1v00 s TYR 172 Cb -0.06 -1.73 0.02 0.00 0.35 0.00 0.00 41.96 40.55 1v00 s TYR 172 CO -0.00 -0.66 0.15 -0.51 -1.34 0.00 0.00 175.55 173.18 1v00 s ASP 173 N 1.13 5.49 0.46 4.32 1.01 -0.61 -1.59 116.67 126.89 1v00 s ASP 173 Ca -0.01 -0.89 0.14 0.00 0.71 0.00 0.00 52.55 52.51 1v00 s ASP 173 Cb -0.14 -1.96 1.06 0.00 1.01 0.00 0.00 42.92 42.89 1v00 s ASP 173 CO -0.07 -0.30 2.03 0.00 0.21 0.00 0.00 175.17 177.04 1v00 h ALA 174 N 8.33 1.77 -0.40 5.23 0.00 -1.88 0.19 119.26 132.51 1v00 h ALA 174 Ca -0.27 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.40 1v00 h ALA 174 Cb 1.11 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1v00 h ALA 174 CO 0.63 0.17 -0.24 0.66 0.00 0.00 0.00 179.25 180.47 1v00 h SER 175 N 0.03 0.90 0.31 0.00 4.64 -1.94 -3.19 113.55 114.31 1v00 h SER 175 Ca 0.01 -0.42 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1v00 h SER 175 Cb 0.22 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1v00 h SER 175 CO 0.02 1.13 -0.93 -1.54 -0.87 0.00 0.00 176.83 174.64 1v00 n SER 176 N -4.19 0.67 -1.45 4.97 3.41 -1.14 -4.95 113.62 110.94 1v00 n SER 176 Ca -0.02 -0.44 -0.16 0.00 -0.26 0.00 0.00 58.87 58.00 1v00 n SER 176 Cb 0.46 0.77 -0.04 0.00 -0.26 0.00 0.00 64.21 65.14 1v00 n SER 176 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1v00 n LYS 177 N -1.73 -1.15 -3.27 4.33 5.02 0.66 -4.93 118.16 117.09 1v00 n LYS 177 Ca 0.03 0.92 -0.39 0.00 -2.02 0.00 0.00 58.31 56.86 1v00 n LYS 177 Cb 0.39 -5.17 -0.06 0.00 -0.02 0.00 0.00 35.03 30.16 1v00 n LYS 177 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1v00 s ILE 178 N -2.67 5.14 -0.22 -0.18 1.01 -1.09 -0.86 121.20 122.33 1v00 s ILE 178 Ca 0.00 0.97 -0.04 0.00 0.00 0.00 0.00 60.65 61.58 1v00 s ILE 178 Cb 0.00 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.62 1v00 s ILE 178 CO 0.00 0.24 -0.03 -0.22 0.00 0.00 0.00 174.94 174.93 1v00 s LEU 179 N 1.16 2.97 0.07 2.97 2.96 -0.41 -1.57 118.68 126.82 1v00 s LEU 179 Ca 0.25 -0.35 0.08 0.00 -0.22 0.00 0.00 54.13 53.89 1v00 s LEU 179 Cb -0.15 -1.76 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 1v00 s LEU 179 CO 0.10 -0.00 -0.23 -0.22 -1.32 0.00 0.00 176.35 174.68 1v00 s LEU 180 N 1.39 2.21 -0.01 -0.68 2.96 -0.07 -1.57 118.68 122.92 1v00 s LEU 180 Ca 0.05 -0.60 0.02 0.00 -0.22 0.00 0.00 54.13 53.38 1v00 s LEU 180 Cb -0.14 -1.05 0.00 0.00 0.50 0.00 0.00 46.19 45.50 1v00 s LEU 180 CO -0.02 0.16 -0.05 0.00 -1.32 0.00 0.00 176.35 175.12 1v00 s ALA 181 N -0.90 0.48 -0.02 5.97 0.00 0.04 -0.66 121.76 126.67 1v00 s ALA 181 Ca 0.09 -0.20 0.03 0.00 0.00 0.00 0.00 51.96 51.88 1v00 s ALA 181 Cb -0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 23.12 22.86 1v00 s ALA 181 CO 0.03 0.09 -0.10 0.08 0.00 0.00 0.00 175.76 175.86 1v00 s VAL 182 N 0.04 0.81 -0.08 0.00 1.01 0.96 -1.67 120.40 121.48 1v00 s VAL 182 Ca 0.00 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.60 1v00 s VAL 182 Cb -0.04 -0.70 0.01 0.00 0.00 0.00 0.00 36.38 35.64 1v00 s VAL 182 CO -0.00 0.24 -0.17 -0.22 0.00 0.00 0.00 175.10 174.95 1v00 s LEU 183 N -0.02 1.84 -0.03 3.92 0.20 -0.36 -1.18 118.68 123.05 1v00 s LEU 183 Ca 0.00 -0.40 0.03 0.00 0.69 0.00 0.00 54.13 54.45 1v00 s LEU 183 Cb -0.06 -1.06 -0.00 0.00 -0.43 0.00 0.00 46.19 44.63 1v00 s LEU 183 CO 0.00 0.09 -0.12 -0.69 -0.29 0.00 0.00 176.35 175.34 1v00 s VAL 184 N 0.47 1.03 -0.41 1.68 1.01 0.09 -0.77 120.40 123.50 1v00 s VAL 184 Ca -0.15 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 61.26 1v00 s VAL 184 Cb -0.16 -0.89 0.09 0.00 0.00 0.00 0.00 36.38 35.42 1v00 s VAL 184 CO 0.06 0.30 0.21 -0.31 0.00 0.00 0.00 175.10 175.36 1v00 s TYR 185 N 0.00 3.45 0.43 5.22 2.02 -0.53 -0.09 117.35 127.84 1v00 s TYR 185 Ca -0.01 -1.99 0.13 0.00 -0.37 0.00 0.00 57.07 54.83 1v00 s TYR 185 Cb -0.08 -3.04 1.00 0.00 -0.40 0.00 0.00 41.96 39.44 1v00 s TYR 185 CO 0.01 -0.92 1.97 -1.35 -1.57 0.00 0.00 175.55 173.69 1v00 h PRO 186 N 8.21 0.43 -0.58 -1.71 0.11 -1.88 0.72 132.00 137.31 1v00 h PRO 186 Ca -0.18 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.99 1v00 h PRO 186 Cb 1.06 -0.10 -0.07 0.00 0.11 0.00 0.00 31.00 32.01 1v00 h PRO 186 CO 0.72 0.29 0.21 0.66 -0.21 0.00 0.00 178.00 179.67 1v00 h SER 187 N 0.45 0.21 0.00 -2.05 4.64 -1.93 -3.21 113.55 111.66 1v00 h SER 187 Ca 0.29 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1v00 h SER 187 Cb 0.53 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1v00 h SER 187 CO -0.08 0.13 -1.10 -1.54 -0.87 0.00 0.00 176.83 173.37 1v00 n SER 188 N -5.00 1.62 0.00 4.97 3.41 -0.96 -5.00 113.62 112.66 1v00 n SER 188 Ca 0.08 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 1v00 n SER 188 Cb 0.26 1.30 0.00 0.00 -0.26 0.00 0.00 64.21 65.51 1v00 n SER 188 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v00 n GLY 189 N 1.61 0.94 3.78 5.00 0.00 0.25 -5.03 105.19 111.74 1v00 n GLY 189 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1v00 n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v00 s ALA 190 N -3.12 3.58 -0.05 4.61 0.00 -1.21 -4.77 121.76 120.79 1v00 s ALA 190 Ca 0.00 1.56 0.02 0.00 0.00 0.00 0.00 51.96 53.53 1v00 s ALA 190 Cb 0.00 -3.60 0.02 0.00 0.00 0.00 0.00 23.12 19.53 1v00 s ALA 190 CO 0.00 -1.03 -0.08 0.42 0.00 0.00 0.00 175.76 175.07 1v00 s ILE 191 N -1.06 0.84 0.03 0.00 1.01 -1.26 -1.46 121.20 119.30 1v00 s ILE 191 Ca 0.53 -0.31 0.06 0.00 0.00 0.00 0.00 60.65 60.93 1v00 s ILE 191 Cb -0.46 -0.80 -0.02 0.00 0.01 0.00 0.00 42.46 41.18 1v00 s ILE 191 CO 0.62 0.29 -0.17 -0.31 0.00 0.00 0.00 174.94 175.36 1v00 s TYR 192 N 0.77 1.52 0.07 3.97 2.02 0.05 -4.99 117.35 120.75 1v00 s TYR 192 Ca -0.13 -0.35 0.02 0.00 -0.37 0.00 0.00 57.07 56.25 1v00 s TYR 192 Cb -0.15 -0.92 -0.03 0.00 -0.40 0.00 0.00 41.96 40.46 1v00 s TYR 192 CO 0.02 0.05 -0.08 0.95 -1.57 0.00 0.00 175.55 174.92 1v00 s THR 193 N -0.73 0.66 -0.18 -0.71 -4.23 -1.26 -1.23 115.64 107.95 1v00 s THR 193 Ca 0.05 -1.40 -0.20 0.00 -1.18 0.00 0.00 61.69 58.95 1v00 s THR 193 Cb -0.08 -1.03 0.05 0.00 1.34 0.00 0.00 72.50 72.78 1v00 s THR 193 CO 0.01 -0.54 0.56 -0.51 -0.54 0.00 0.00 174.62 173.60 1v00 s ILE 194 N -2.15 0.00 0.03 2.99 2.07 -0.67 -4.94 121.20 118.54 1v00 s ILE 194 Ca -0.01 -0.03 -0.20 0.00 -1.41 0.00 0.00 60.65 58.99 1v00 s ILE 194 Cb -0.05 -0.79 0.04 0.00 0.13 0.00 0.00 42.46 41.79 1v00 s ILE 194 CO -0.01 -0.02 0.46 0.00 -1.91 0.00 0.00 174.94 173.47 1v00 s ALA 195 N 0.05 -1.17 0.19 1.50 0.00 -1.26 -0.78 121.76 120.30 1v00 s ALA 195 Ca -0.02 0.49 -0.23 0.00 0.00 0.00 0.00 51.96 52.20 1v00 s ALA 195 Cb -0.04 0.32 0.05 0.00 0.00 0.00 0.00 23.12 23.45 1v00 s ALA 195 CO 0.02 -0.45 0.70 -2.00 0.00 0.00 0.00 175.76 174.02 1v00 s GLU 196 N -2.29 1.43 -0.13 0.00 2.56 -0.61 -5.00 118.70 114.67 1v00 s GLU 196 Ca -0.06 -0.67 -0.24 0.00 0.00 0.00 0.00 54.97 54.00 1v00 s GLU 196 Cb -0.01 0.57 -0.03 0.00 2.00 0.00 0.00 34.13 36.66 1v00 s GLU 196 CO -0.01 -0.64 0.74 0.42 -0.56 0.00 0.00 175.26 175.21 1v00 s ILE 197 N -3.73 4.98 -0.04 -3.70 -1.09 -1.26 -1.29 121.20 115.07 1v00 s ILE 197 Ca 0.06 1.48 -0.02 0.00 -2.23 0.00 0.00 60.65 59.94 1v00 s ILE 197 Cb -0.03 -4.06 0.03 0.00 -1.58 0.00 0.00 42.46 36.82 1v00 s ILE 197 CO -0.04 0.14 0.07 -0.69 -1.23 0.00 0.00 174.94 173.19 1v00 s VAL 198 N 1.50 -0.11 -0.61 2.92 1.01 -0.04 -4.96 120.40 120.10 1v00 s VAL 198 Ca 0.37 0.37 -0.17 0.00 0.00 0.00 0.00 61.98 62.55 1v00 s VAL 198 Cb -0.17 -0.15 0.13 0.00 0.00 0.00 0.00 36.38 36.19 1v00 s VAL 198 CO 0.15 0.16 0.63 -0.62 0.00 0.00 0.00 175.10 175.41 1v00 s ASP 199 N 1.94 6.28 0.54 3.32 -1.08 -1.26 -4.63 116.67 121.78 1v00 s ASP 199 Ca 0.02 -1.79 0.24 0.00 -0.52 0.00 0.00 52.55 50.49 1v00 s ASP 199 Cb -0.12 -2.25 1.43 0.00 -1.46 0.00 0.00 42.92 40.52 1v00 s ASP 199 CO -0.03 -0.92 2.06 -0.37 0.52 0.00 0.00 175.17 176.43 1v00 h VAL 200 N 5.76 0.73 0.00 1.11 -1.51 -1.97 -0.50 116.25 119.87 1v00 h VAL 200 Ca -0.23 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.24 1v00 h VAL 200 Cb 1.09 0.83 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1v00 h VAL 200 CO 1.03 0.00 0.00 0.07 -1.23 0.00 0.00 177.57 177.44 1v00 h LYS 201 N 0.00 0.00 0.00 5.19 2.10 -1.92 0.12 116.57 122.06 1v00 h LYS 201 Ca 0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 1v00 h LYS 201 Cb 0.62 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.95 1v00 h LYS 201 CO -0.00 0.00 -0.80 1.04 -2.00 0.00 0.00 179.45 177.69 1v00 n GLN 202 N -2.35 0.18 -0.02 0.07 6.02 -0.20 -4.64 117.38 116.44 1v00 n GLN 202 Ca 0.02 0.01 -0.06 0.00 -0.01 0.00 0.00 57.00 56.96 1v00 n GLN 202 Cb 0.24 -1.57 -0.02 0.00 1.02 0.00 0.00 30.24 29.91 1v00 n GLN 202 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1v00 n VAL 203 N -1.81 1.03 -2.95 5.09 0.31 -0.72 -5.08 118.33 114.20 1v00 n VAL 203 Ca 0.03 0.14 -0.29 0.00 -0.01 0.00 0.00 64.34 64.21 1v00 n VAL 203 Cb 0.40 -1.77 -0.03 0.00 -0.91 0.00 0.00 33.84 31.53 1v00 n VAL 203 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1v00 s LEU 204 N -7.02 3.85 0.88 7.52 1.43 0.34 -4.22 118.68 121.46 1v00 s LEU 204 Ca -0.12 0.97 -0.13 0.00 -1.03 0.00 0.00 54.13 53.83 1v00 s LEU 204 Cb 0.03 -3.85 0.13 0.00 0.03 0.00 0.00 46.19 42.52 1v00 s LEU 204 CO 0.16 -0.38 1.19 -2.16 0.23 0.00 0.00 176.35 175.39 1v00 s PRO 205 N -3.95 1.36 0.29 1.29 0.04 -1.26 -4.74 135.00 128.03 1v00 s PRO 205 Ca 0.48 0.08 -0.02 0.00 0.04 0.00 0.00 61.00 61.58 1v00 s PRO 205 Cb -0.10 -1.88 0.42 0.00 0.04 0.00 0.00 34.50 32.97 1v00 s PRO 205 CO 0.34 -2.01 1.93 0.93 0.04 0.00 0.00 177.00 178.23 1v00 h GLU 206 N -1.35 1.03 -6.10 4.56 5.08 -1.96 -3.42 114.58 112.42 1v00 h GLU 206 Ca -0.47 -0.10 -0.68 0.00 -1.00 0.00 0.00 59.36 57.10 1v00 h GLU 206 Cb 1.31 -0.21 -0.25 0.00 0.50 0.00 0.00 28.75 30.10 1v00 h GLU 206 CO 0.59 0.74 -0.78 -1.58 -1.00 0.00 0.00 179.01 176.98 1v00 s TRP 207 N -5.73 2.69 0.12 4.33 0.52 -1.26 -0.92 118.94 118.69 1v00 s TRP 207 Ca -0.11 -0.32 0.01 0.00 0.02 0.00 0.00 56.10 55.71 1v00 s TRP 207 Cb 0.17 -1.67 -0.04 0.00 -1.15 0.00 0.00 33.47 30.78 1v00 s TRP 207 CO 0.80 0.06 -0.03 0.14 0.02 0.00 0.00 176.95 177.93 1v00 s VAL 208 N -0.45 0.62 -0.04 4.03 -7.23 -0.20 -4.32 120.40 112.81 1v00 s VAL 208 Ca 0.05 -1.94 -0.01 0.00 -1.81 0.00 0.00 61.98 58.27 1v00 s VAL 208 Cb -0.12 -1.84 -0.04 0.00 0.56 0.00 0.00 36.38 34.95 1v00 s VAL 208 CO 0.02 -0.73 0.04 -1.81 -0.31 0.00 0.00 175.10 172.32 1v00 s ASP 209 N -3.08 5.48 0.05 4.85 1.01 -0.14 -0.15 116.67 124.69 1v00 s ASP 209 Ca 0.16 0.14 0.07 0.00 0.71 0.00 0.00 52.55 53.63 1v00 s ASP 209 Cb 0.06 -1.55 -0.03 0.00 1.01 0.00 0.00 42.92 42.40 1v00 s ASP 209 CO -0.02 0.32 -0.16 0.68 0.21 0.00 0.00 175.17 176.19 1v00 s VAL 210 N -1.07 2.92 0.16 -1.27 -7.23 -1.26 -2.10 120.40 110.55 1v00 s VAL 210 Ca 0.19 -1.18 -0.14 0.00 -1.81 0.00 0.00 61.98 59.04 1v00 s VAL 210 Cb -0.12 -2.26 0.05 0.00 0.56 0.00 0.00 36.38 34.62 1v00 s VAL 210 CO 0.09 0.30 0.66 0.61 -0.31 0.00 0.00 175.10 176.45 1v00 n GLY 211 N 1.41 0.93 3.19 2.32 0.00 -0.35 -1.40 105.19 111.29 1v00 n GLY 211 Ca -0.16 -1.10 -0.23 0.00 0.00 0.00 0.00 46.02 44.54 1v00 n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1v00 s LEU 212 N 0.00 2.16 -0.00 0.99 1.43 -0.21 -1.02 118.68 122.04 1v00 s LEU 212 Ca 0.14 -0.48 -0.04 0.00 -1.03 0.00 0.00 54.13 52.73 1v00 s LEU 212 Cb -0.02 -0.79 -0.00 0.00 0.03 0.00 0.00 46.19 45.41 1v00 s LEU 212 CO 0.05 0.10 0.08 -0.55 0.23 0.00 0.00 176.35 176.25 1v00 s SER 213 N -1.12 0.06 0.04 2.29 0.15 0.08 -1.01 113.70 114.19 1v00 s SER 213 Ca 0.05 -0.21 -0.01 0.00 0.70 0.00 0.00 55.95 56.48 1v00 s SER 213 Cb -0.08 0.17 -0.03 0.00 -1.71 0.00 0.00 66.02 64.37 1v00 s SER 213 CO 0.01 -0.27 -0.02 -0.83 1.20 0.00 0.00 173.24 173.33 1v00 s GLY 214 N -1.08 0.36 -0.13 9.45 0.00 -0.09 0.00 107.32 115.84 1v00 s GLY 214 Ca -0.12 -0.94 -0.18 0.00 0.00 0.00 0.00 44.72 43.49 1v00 s GLY 214 CO 0.00 -1.04 0.46 0.00 0.00 0.00 0.00 173.10 172.52 1v00 s ALA 215 N -2.96 -1.15 0.44 3.20 0.00 -0.49 -1.78 121.76 119.03 1v00 s ALA 215 Ca -0.02 1.11 0.07 0.00 0.00 0.00 0.00 51.96 53.12 1v00 s ALA 215 Cb 0.01 -0.51 -0.01 0.00 0.00 0.00 0.00 23.12 22.61 1v00 s ALA 215 CO -0.06 -0.25 0.35 0.95 0.00 0.00 0.00 175.76 176.75 1v00 s THR 216 N -0.25 2.37 1.15 0.00 -4.23 0.27 0.17 115.64 115.12 1v00 s THR 216 Ca -0.04 -1.44 -0.13 0.00 -1.18 0.00 0.00 61.69 58.90 1v00 s THR 216 Cb -0.03 -2.81 0.28 0.00 1.34 0.00 0.00 72.50 71.27 1v00 s THR 216 CO 0.02 0.00 1.04 -0.83 -0.54 0.00 0.00 174.62 174.31 1v00 s GLY 217 N -4.12 1.55 0.00 3.99 0.00 0.96 -4.00 107.32 105.69 1v00 s GLY 217 Ca 0.44 -0.11 0.28 0.00 0.00 0.00 0.00 44.72 45.33 1v00 s GLY 217 CO 0.26 0.60 1.75 0.00 0.00 0.00 0.00 173.10 175.70 1v00 n ALA 218 N -4.87 2.87 -2.35 3.20 0.00 -1.26 -0.14 120.51 117.96 1v00 n ALA 218 Ca 0.03 -0.32 -0.16 0.00 0.00 0.00 0.00 53.44 53.00 1v00 n ALA 218 Cb 0.54 -1.26 -0.10 0.00 0.00 0.00 0.00 19.45 18.63 1v00 n ALA 218 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1v00 s GLN 219 N -2.47 1.05 0.00 0.00 -2.07 -1.26 -4.94 119.66 109.97 1v00 s GLN 219 Ca 0.27 -1.37 -0.38 0.00 -1.82 0.00 0.00 55.36 52.07 1v00 s GLN 219 Cb 0.20 -0.73 -0.17 0.00 -1.09 0.00 0.00 33.01 31.22 1v00 s GLN 219 CO 0.49 0.11 1.36 -2.13 -1.32 0.00 0.00 175.29 173.80 1v00 n ARG 220 N 0.08 0.93 -1.08 9.60 0.63 -1.26 -1.55 116.66 124.00 1v00 n ARG 220 Ca -0.12 0.34 -0.03 0.00 -0.92 0.00 0.00 57.85 57.12 1v00 n ARG 220 Cb 0.59 -1.96 -0.01 0.00 0.45 0.00 0.00 32.46 31.53 1v00 n ARG 220 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1v00 n ASP 221 N 2.79 -5.33 -4.35 6.15 8.00 -1.26 -4.76 116.55 117.79 1v00 n ASP 221 Ca 0.20 0.07 -0.43 0.00 0.71 0.00 0.00 54.79 55.34 1v00 n ASP 221 Cb 0.16 -3.08 0.00 0.00 -0.02 0.00 0.00 41.12 38.18 1v00 n ASP 221 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1v00 n ALA 222 N 1.05 4.15 -3.11 2.24 0.00 -0.59 -4.54 120.51 119.71 1v00 n ALA 222 Ca -0.03 -4.18 -0.10 0.00 0.00 0.00 0.00 53.44 49.13 1v00 n ALA 222 Cb 0.42 -3.15 -0.05 0.00 0.00 0.00 0.00 19.45 16.67 1v00 n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v00 s ALA 223 N 1.87 0.01 0.15 0.00 0.00 -1.26 -0.03 121.76 122.50 1v00 s ALA 223 Ca 0.44 -1.05 -0.25 0.00 0.00 0.00 0.00 51.96 51.11 1v00 s ALA 223 Cb 0.01 1.08 0.06 0.00 0.00 0.00 0.00 23.12 24.27 1v00 s ALA 223 CO 0.01 -0.84 0.86 -1.83 0.00 0.00 0.00 175.76 173.96 1v00 s GLU 224 N -3.72 1.24 0.58 0.00 -1.05 -1.22 -4.40 118.70 110.14 1v00 s GLU 224 Ca 0.25 -0.63 -0.10 0.00 -0.15 0.00 0.00 54.97 54.34 1v00 s GLU 224 Cb -0.01 0.46 -0.04 0.00 -0.44 0.00 0.00 34.13 34.11 1v00 s GLU 224 CO 0.12 -0.56 0.97 0.95 0.95 0.00 0.00 175.26 177.68 1v00 s THR 225 N -3.43 4.75 -0.40 1.83 -4.23 -0.65 -4.83 115.64 108.68 1v00 s THR 225 Ca 0.09 0.73 0.08 0.00 -1.18 0.00 0.00 61.69 61.41 1v00 s THR 225 Cb -0.02 -3.86 0.25 0.00 1.34 0.00 0.00 72.50 70.21 1v00 s THR 225 CO -0.01 -1.06 0.58 1.41 -0.54 0.00 0.00 174.62 175.00 1v00 n HIS 226 N -2.58 -0.80 -3.61 3.99 -0.00 -1.26 -3.89 115.22 107.07 1v00 n HIS 226 Ca 0.05 -3.30 -0.38 0.00 -0.00 0.00 0.00 57.72 54.09 1v00 n HIS 226 Cb 0.54 -0.07 -0.06 0.00 -0.00 0.00 0.00 29.99 30.40 1v00 n HIS 226 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1v00 s ASP 227 N -1.27 6.67 -0.07 0.41 1.01 -0.89 -1.36 116.67 121.17 1v00 s ASP 227 Ca 0.35 0.79 0.05 0.00 0.71 0.00 0.00 52.55 54.45 1v00 s ASP 227 Cb 0.18 -2.19 -0.00 0.00 1.01 0.00 0.00 42.92 41.91 1v00 s ASP 227 CO -0.13 0.33 -0.22 -0.69 0.21 0.00 0.00 175.17 174.67 1v00 s VAL 228 N -0.96 1.85 -0.19 -1.27 1.01 0.40 -0.62 120.40 120.62 1v00 s VAL 228 Ca 0.21 -0.93 0.17 0.00 0.00 0.00 0.00 61.98 61.43 1v00 s VAL 228 Cb -0.15 -1.58 -0.24 0.00 0.00 0.00 0.00 36.38 34.41 1v00 s VAL 228 CO 0.10 0.52 0.07 -1.22 0.00 0.00 0.00 175.10 174.57 1v00 n TYR 229 N 3.22 0.00 -3.66 5.22 4.01 0.17 -0.53 117.16 125.59 1v00 n TYR 229 Ca -0.18 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.45 1v00 n TYR 229 Cb 0.52 -0.95 -0.04 0.00 -0.31 0.00 0.00 39.34 38.56 1v00 n TYR 229 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1v00 s SER 230 N -5.38 -0.26 -0.29 7.72 1.04 -1.24 -3.80 113.70 111.49 1v00 s SER 230 Ca -0.10 -0.36 -0.15 0.00 0.48 0.00 0.00 55.95 55.83 1v00 s SER 230 Cb 0.06 0.51 0.11 0.00 0.10 0.00 0.00 66.02 66.80 1v00 s SER 230 CO 0.79 -0.92 0.79 0.86 0.98 0.00 0.00 173.24 175.74 1v00 s TRP 231 N -3.82 -0.93 0.12 5.02 -0.00 -0.68 -2.63 118.94 116.01 1v00 s TRP 231 Ca 0.05 1.80 0.05 0.00 -0.00 0.00 0.00 56.10 58.00 1v00 s TRP 231 Cb 0.01 0.56 -0.04 0.00 -0.00 0.00 0.00 33.47 34.00 1v00 s TRP 231 CO -0.09 -0.46 -0.13 -1.54 -0.00 0.00 0.00 176.95 174.73 1v00 s SER 232 N 1.81 1.87 -0.14 5.86 1.04 0.73 -0.77 113.70 124.10 1v00 s SER 232 Ca -0.09 -0.82 -0.18 0.00 0.48 0.00 0.00 55.95 55.34 1v00 s SER 232 Cb -0.06 -0.05 0.05 0.00 0.10 0.00 0.00 66.02 66.06 1v00 s SER 232 CO -0.18 -0.18 0.48 0.12 0.98 0.00 0.00 173.24 174.46 1v00 s PHE 233 N -2.26 -0.49 -0.11 5.02 2.19 0.09 -1.37 117.98 121.04 1v00 s PHE 233 Ca 0.08 1.12 -0.09 0.00 0.33 0.00 0.00 56.93 58.37 1v00 s PHE 233 Cb -0.04 0.20 0.04 0.00 -1.31 0.00 0.00 43.02 41.90 1v00 s PHE 233 CO 0.02 -0.32 0.29 -1.58 1.83 0.00 0.00 175.22 175.46 1v00 s HIS 234 N -0.18 -0.35 0.02 10.12 2.46 -0.19 -1.07 115.29 126.09 1v00 s HIS 234 Ca -0.04 0.83 0.01 0.00 0.47 0.00 0.00 55.06 56.34 1v00 s HIS 234 Cb -0.03 0.11 -0.01 0.00 -0.13 0.00 0.00 32.58 32.51 1v00 s HIS 234 CO 0.02 -0.20 -0.04 0.00 -2.47 0.00 0.00 174.74 172.06 1v00 s ALA 235 N 0.59 0.28 -0.06 1.58 0.00 -0.48 -0.49 121.76 123.18 1v00 s ALA 235 Ca -0.04 -0.43 -0.02 0.00 0.00 0.00 0.00 51.96 51.48 1v00 s ALA 235 Cb -0.05 0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.13 1v00 s ALA 235 CO -0.03 -0.03 0.02 0.45 0.00 0.00 0.00 175.76 176.17 1v00 s SER 236 N -0.87 1.45 -0.38 0.00 0.15 -0.20 -2.08 113.70 111.75 1v00 s SER 236 Ca -0.07 -0.03 -0.12 0.00 0.70 0.00 0.00 55.95 56.43 1v00 s SER 236 Cb -0.06 -0.34 0.03 0.00 -1.71 0.00 0.00 66.02 63.94 1v00 s SER 236 CO -0.00 -0.21 0.23 -0.22 1.20 0.00 0.00 173.24 174.23 1v00 s LEU 237 N 2.04 4.82 0.63 3.45 2.96 0.77 -1.81 118.68 131.53 1v00 s LEU 237 Ca 0.05 -1.00 -0.17 0.00 -0.22 0.00 0.00 54.13 52.79 1v00 s LEU 237 Cb -0.12 -2.05 -0.02 0.00 0.50 0.00 0.00 46.19 44.50 1v00 s LEU 237 CO -0.05 -0.41 1.16 -2.16 -1.32 0.00 0.00 176.35 173.58 1v00 s PRO 238 N 1.58 2.86 0.30 0.98 0.04 -1.26 -1.15 135.00 138.34 1v00 s PRO 238 Ca 0.03 1.63 -0.11 0.00 0.04 0.00 0.00 61.00 62.58 1v00 s PRO 238 Cb -0.19 -1.94 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1v00 s PRO 238 CO 0.07 -1.25 0.65 -1.83 0.04 0.00 0.00 177.00 174.68 1v00 s GLU 239 N -3.66 3.85 0.00 4.56 -1.05 -1.26 -4.46 118.70 116.68 1v00 s GLU 239 Ca 0.73 0.41 0.00 0.00 -0.15 0.00 0.00 54.97 55.96 1v00 s GLU 239 Cb -0.26 -2.53 0.00 0.00 -0.44 0.00 0.00 34.13 30.90 1v00 s GLU 239 CO 0.36 0.19 0.00 2.41 0.95 0.00 0.00 175.26 179.18 1v00 n THR 240 N -0.48 0.00 0.00 1.83 -1.04 -1.26 -4.91 114.28 108.42 1v00 n THR 240 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1v00 n THR 240 Cb 0.53 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.04 1v00 n THR 240 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02