#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2phx s SER 3 N 0.00 1.65 -0.16 -2.24 0.01 -1.26 -1.46 113.70 110.25 2phx s SER 3 Ca 0.00 -0.45 -0.11 0.00 1.31 0.00 0.00 55.95 56.70 2phx s SER 3 Cb 0.00 -0.11 0.05 0.00 0.21 0.00 0.00 66.02 66.17 2phx s SER 3 CO 0.00 0.04 0.39 -0.22 0.41 0.00 0.00 173.24 173.86 2phx s LEU 4 N -1.11 0.25 -0.03 2.44 2.96 -0.73 -5.01 118.68 117.45 2phx s LEU 4 Ca 0.02 0.82 -0.08 0.00 -0.22 0.00 0.00 54.13 54.66 2phx s LEU 4 Cb -0.08 1.32 0.01 0.00 0.50 0.00 0.00 46.19 47.95 2phx s LEU 4 CO 0.01 -0.16 0.19 -0.55 -1.32 0.00 0.00 176.35 174.52 2phx s SER 5 N 0.75 -0.08 -0.01 3.68 0.15 -1.26 -1.12 113.70 115.80 2phx s SER 5 Ca -0.04 0.04 -0.20 0.00 0.70 0.00 0.00 55.95 56.44 2phx s SER 5 Cb -0.05 0.29 0.04 0.00 -1.71 0.00 0.00 66.02 64.59 2phx s SER 5 CO -0.05 -0.28 0.44 0.72 1.20 0.00 0.00 173.24 175.26 2phx s PHE 6 N -0.89 -0.34 -0.03 3.44 -0.12 -0.45 -5.00 117.98 114.59 2phx s PHE 6 Ca -0.10 0.51 -0.01 0.00 -0.05 0.00 0.00 56.93 57.29 2phx s PHE 6 Cb -0.05 0.21 0.03 0.00 -0.63 0.00 0.00 43.02 42.58 2phx s PHE 6 CO 0.02 -0.49 0.06 0.20 -0.05 0.00 0.00 175.22 174.95 2phx s GLY 7 N -1.41 0.07 -0.42 1.99 0.00 -1.26 -1.05 107.32 105.24 2phx s GLY 7 Ca -0.11 0.39 0.03 0.00 0.00 0.00 0.00 44.72 45.03 2phx s GLY 7 CO 0.05 0.76 0.15 -1.36 0.00 0.00 0.00 173.10 172.69 2phx s PHE 8 N 1.09 3.54 0.32 1.90 0.40 0.11 -4.95 117.98 120.38 2phx s PHE 8 Ca -0.09 -3.02 0.15 0.00 -0.60 0.00 0.00 56.93 53.36 2phx s PHE 8 Cb -0.12 -2.92 0.71 0.00 0.51 0.00 0.00 43.02 41.20 2phx s PHE 8 CO -0.04 -0.87 1.79 -1.35 0.70 0.00 0.00 175.22 175.45 2phx h PRO 9 N 7.23 0.00 -3.92 0.24 0.11 -1.90 -0.59 132.00 133.16 2phx h PRO 9 Ca -0.06 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.87 2phx h PRO 9 Cb 0.97 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.00 2phx h PRO 9 CO 0.60 0.40 -0.17 0.95 -0.21 0.00 0.00 178.00 179.56 2phx s THR 10 N -3.98 0.00 -0.59 -1.15 -4.23 -1.26 -4.55 115.64 99.88 2phx s THR 10 Ca -0.02 -1.53 0.04 0.00 -1.18 0.00 0.00 61.69 59.00 2phx s THR 10 Cb 0.13 -2.49 0.15 0.00 1.34 0.00 0.00 72.50 71.64 2phx s THR 10 CO 0.71 0.00 0.38 -0.36 -0.54 0.00 0.00 174.62 174.81 2phx s PHE 11 N -3.44 3.01 0.91 3.99 0.08 -0.13 -4.97 117.98 117.44 2phx s PHE 11 Ca 0.27 -3.07 -0.10 0.00 0.12 0.00 0.00 56.93 54.15 2phx s PHE 11 Cb -0.00 -2.45 0.14 0.00 -0.57 0.00 0.00 43.02 40.14 2phx s PHE 11 CO 0.15 -0.66 1.13 -2.14 -0.10 0.00 0.00 175.22 173.60 2phx s PRO 12 N -0.75 1.09 0.42 0.24 0.02 -1.26 -3.69 135.00 131.07 2phx s PRO 12 Ca 0.22 1.43 0.10 0.00 0.02 0.00 0.00 61.00 62.78 2phx s PRO 12 Cb -0.12 -1.74 0.90 0.00 0.02 0.00 0.00 34.50 33.56 2phx s PRO 12 CO -0.10 -2.54 2.00 0.77 -0.33 0.00 0.00 177.00 176.80 2phx h SER 13 N -1.80 0.25 -1.74 2.53 0.02 -1.96 -3.37 113.55 107.47 2phx h SER 13 Ca -0.44 -0.03 -0.72 0.00 -0.84 0.00 0.00 61.79 59.76 2phx h SER 13 Cb 1.27 -0.06 -0.14 0.00 0.14 0.00 0.00 62.40 63.60 2phx h SER 13 CO 0.44 0.29 1.61 1.51 -1.14 0.00 0.00 176.83 179.55 2phx s ASP 14 N -6.87 6.98 -0.01 3.07 -4.77 -1.26 -4.98 116.67 108.83 2phx s ASP 14 Ca -0.06 -2.77 -0.09 0.00 -3.30 0.00 0.00 52.55 46.33 2phx s ASP 14 Cb 0.16 -2.46 -0.05 0.00 -1.09 0.00 0.00 42.92 39.48 2phx s ASP 14 CO 0.72 -0.90 0.29 -1.10 0.70 0.00 0.00 175.17 174.88 2phx s GLN 15 N 2.50 3.66 0.00 2.11 -1.52 -1.26 -4.99 119.66 120.16 2phx s GLN 15 Ca 0.46 0.06 0.00 0.00 -1.95 0.00 0.00 55.36 53.93 2phx s GLN 15 Cb -0.01 -3.12 0.00 0.00 -0.22 0.00 0.00 33.01 29.66 2phx s GLN 15 CO 0.02 0.67 0.00 1.63 -0.25 0.00 0.00 175.29 177.36 2phx n LYS 16 N 1.41 2.49 -0.62 2.91 4.76 -1.26 -4.80 118.16 123.05 2phx n LYS 16 Ca -0.13 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.39 2phx n LYS 16 Cb 0.53 -0.98 0.32 0.00 -1.84 0.00 0.00 35.03 33.06 2phx n LYS 16 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2phx n ASN 17 N -1.76 4.62 -4.43 4.39 3.02 -1.26 -4.95 115.26 114.88 2phx n ASN 17 Ca 0.00 -2.87 -0.33 0.00 -0.03 0.00 0.00 54.58 51.35 2phx n ASN 17 Cb 0.30 -0.58 -0.14 0.00 -0.61 0.00 0.00 39.78 38.75 2phx n ASN 17 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2phx s LEU 18 N -2.60 2.73 -0.33 3.41 1.43 -1.26 -0.42 118.68 121.64 2phx s LEU 18 Ca 0.47 -0.25 -0.14 0.00 -1.03 0.00 0.00 54.13 53.18 2phx s LEU 18 Cb 0.36 -1.58 -0.02 0.00 0.03 0.00 0.00 46.19 44.98 2phx s LEU 18 CO 0.14 0.28 0.29 -0.63 0.23 0.00 0.00 176.35 176.65 2phx s ILE 19 N -0.31 5.24 -0.11 -0.59 1.01 -0.05 -4.92 121.20 121.46 2phx s ILE 19 Ca 0.03 0.01 -0.12 0.00 0.00 0.00 0.00 60.65 60.57 2phx s ILE 19 Cb -0.13 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.57 2phx s ILE 19 CO 0.03 0.01 0.27 -0.36 0.00 0.00 0.00 174.94 174.89 2phx s PHE 20 N 1.87 3.57 0.07 3.97 0.08 -1.26 -1.51 117.98 124.76 2phx s PHE 20 Ca 0.09 0.67 0.05 0.00 0.12 0.00 0.00 56.93 57.86 2phx s PHE 20 Cb -0.17 -2.21 -0.03 0.00 -0.57 0.00 0.00 43.02 40.05 2phx s PHE 20 CO 0.11 0.49 -0.15 -0.65 -0.10 0.00 0.00 175.22 174.92 2phx s GLN 21 N -0.36 0.89 5.95 0.44 -0.21 -0.26 -5.00 119.66 121.10 2phx s GLN 21 Ca 0.17 -0.94 0.00 0.00 0.02 0.00 0.00 55.36 54.61 2phx s GLN 21 Cb -0.14 -0.93 0.00 0.00 1.00 0.00 0.00 33.01 32.95 2phx s GLN 21 CO 0.06 0.21 0.00 0.41 -2.12 0.00 0.00 175.29 173.85 2phx n GLY 22 N 1.38 2.63 0.36 3.09 0.00 -1.26 -1.68 105.19 109.72 2phx n GLY 22 Ca -0.20 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.52 2phx n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2phx n ASP 23 N 2.09 1.11 -4.76 1.61 8.00 0.80 -4.92 116.55 120.48 2phx n ASP 23 Ca 0.00 -1.49 -0.41 0.00 0.71 0.00 0.00 54.79 53.60 2phx n ASP 23 Cb 0.00 -0.04 -0.01 0.00 -0.02 0.00 0.00 41.12 41.05 2phx n ASP 23 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2phx s ALA 24 N -1.92 3.67 0.17 2.24 0.00 -1.18 -4.48 121.76 120.27 2phx s ALA 24 Ca 0.36 1.50 -0.22 0.00 0.00 0.00 0.00 51.96 53.59 2phx s ALA 24 Cb 0.19 -3.61 0.06 0.00 0.00 0.00 0.00 23.12 19.76 2phx s ALA 24 CO 0.29 -0.92 0.60 1.14 0.00 0.00 0.00 175.76 176.87 2phx s GLN 25 N -0.89 1.33 0.07 0.00 -2.07 -0.63 -4.75 119.66 112.71 2phx s GLN 25 Ca 0.59 -0.55 -0.23 0.00 -1.82 0.00 0.00 55.36 53.35 2phx s GLN 25 Cb -0.46 0.58 -0.06 0.00 -1.09 0.00 0.00 33.01 31.98 2phx s GLN 25 CO 0.50 -0.58 0.70 0.42 -1.32 0.00 0.00 175.29 175.01 2phx s ILE 26 N -3.77 4.67 -0.20 3.63 -1.09 -1.26 0.01 121.20 123.19 2phx s ILE 26 Ca 0.02 1.50 -0.12 0.00 -2.23 0.00 0.00 60.65 59.83 2phx s ILE 26 Cb -0.01 -4.05 0.06 0.00 -1.58 0.00 0.00 42.46 36.88 2phx s ILE 26 CO -0.11 0.45 0.49 -0.54 -1.23 0.00 0.00 174.94 174.00 2phx s LYS 27 N -0.55 0.49 -1.41 2.79 1.02 -0.45 -4.91 119.74 116.71 2phx s LYS 27 Ca 0.35 0.89 -0.02 0.00 0.02 0.00 0.00 55.97 57.21 2phx s LYS 27 Cb -0.21 0.04 0.01 0.00 -0.52 0.00 0.00 37.83 37.16 2phx s LYS 27 CO 0.22 -0.15 0.51 0.09 -0.92 0.00 0.00 175.35 175.10 2phx n ASN 28 N 4.15 -0.79 -0.80 2.83 3.02 -1.26 -1.75 115.26 120.67 2phx n ASN 28 Ca -0.22 -0.97 -0.10 0.00 -0.03 0.00 0.00 54.58 53.26 2phx n ASN 28 Cb 0.56 -3.23 -0.04 0.00 -0.61 0.00 0.00 39.78 36.46 2phx n ASN 28 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2phx n ASN 29 N -2.97 -5.06 -4.15 6.41 4.13 -1.26 -4.98 115.26 107.38 2phx n ASN 29 Ca -0.27 0.26 -0.10 0.00 1.68 0.00 0.00 54.58 56.15 2phx n ASN 29 Cb 0.67 -3.47 -0.10 0.00 -1.54 0.00 0.00 39.78 35.33 2phx n ASN 29 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2phx s ALA 30 N -2.12 0.88 -0.21 5.41 0.00 -0.71 -0.95 121.76 124.06 2phx s ALA 30 Ca 0.00 -1.34 -0.17 0.00 0.00 0.00 0.00 51.96 50.45 2phx s ALA 30 Cb 0.00 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.34 2phx s ALA 30 CO 0.00 -0.29 0.47 0.08 0.00 0.00 0.00 175.76 176.02 2phx s VAL 31 N -3.73 5.14 -0.48 0.00 1.01 -0.41 -1.35 120.40 120.59 2phx s VAL 31 Ca 0.12 0.84 -0.16 0.00 0.00 0.00 0.00 61.98 62.78 2phx s VAL 31 Cb 0.06 -3.79 0.07 0.00 0.00 0.00 0.00 36.38 32.71 2phx s VAL 31 CO -0.05 0.20 0.45 -1.10 0.00 0.00 0.00 175.10 174.60 2phx s GLN 32 N 1.57 3.02 0.21 2.72 -1.52 0.10 -0.74 119.66 125.02 2phx s GLN 32 Ca 0.22 -1.21 -0.04 0.00 -1.95 0.00 0.00 55.36 52.38 2phx s GLN 32 Cb -0.15 -4.11 0.17 0.00 -0.22 0.00 0.00 33.01 28.69 2phx s GLN 32 CO 0.09 -1.06 1.60 -0.07 -0.25 0.00 0.00 175.29 175.60 2phx h LEU 33 N 8.99 0.75 -9.45 2.90 4.07 -1.64 -1.69 115.31 119.24 2phx h LEU 33 Ca -0.28 -0.30 -0.65 0.00 0.08 0.00 0.00 57.88 56.73 2phx h LEU 33 Cb 1.11 -0.21 -0.12 0.00 1.08 0.00 0.00 40.66 42.52 2phx h LEU 33 CO 0.89 1.00 -0.67 0.42 -1.08 0.00 0.00 178.44 179.00 2phx s THR 34 N -4.45 3.90 0.40 0.22 -4.23 -1.26 -3.12 115.64 107.10 2phx s THR 34 Ca -0.09 -1.07 -0.26 0.00 -1.18 0.00 0.00 61.69 59.08 2phx s THR 34 Cb 0.13 -2.86 -0.10 0.00 1.34 0.00 0.00 72.50 71.00 2phx s THR 34 CO 0.84 0.09 1.34 1.17 -0.54 0.00 0.00 174.62 177.52 2phx n LYS 35 N 0.51 2.16 -4.32 3.99 4.81 -1.26 -4.78 118.16 119.27 2phx n LYS 35 Ca -0.11 0.76 -0.17 0.00 -0.87 0.00 0.00 58.31 57.92 2phx n LYS 35 Cb 0.52 -2.47 -0.10 0.00 0.02 0.00 0.00 35.03 33.00 2phx n LYS 35 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2phx s THR 36 N -1.16 1.55 0.00 3.15 -4.23 -1.26 -3.03 115.64 110.66 2phx s THR 36 Ca 0.59 -2.16 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 2phx s THR 36 Cb -0.50 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.33 2phx s THR 36 CO 0.60 -0.62 0.00 -0.90 -0.54 0.00 0.00 174.62 173.15 2phx n ASP 37 N -0.33 0.00 -0.30 3.99 5.68 0.38 -4.88 116.55 121.08 2phx n ASP 37 Ca -0.08 -0.84 0.00 0.00 -0.50 0.00 0.00 54.79 53.37 2phx n ASP 37 Cb 0.61 0.00 0.13 0.00 -1.14 0.00 0.00 41.12 40.72 2phx n ASP 37 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2phx h SER 38 N 0.00 0.80 -0.19 -1.12 0.02 -2.02 -1.91 113.55 109.14 2phx h SER 38 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2phx h SER 38 Cb 0.00 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.39 2phx h SER 38 CO 0.00 0.52 0.00 -0.46 -1.14 0.00 0.00 176.83 175.75 2phx n ASN 39 N -4.64 1.20 0.00 3.07 6.94 -1.26 -4.90 115.26 115.67 2phx n ASN 39 Ca 0.12 -1.84 0.00 0.00 -0.02 0.00 0.00 54.58 52.83 2phx n ASN 39 Cb 0.17 -0.12 0.00 0.00 -2.36 0.00 0.00 39.78 37.47 2phx n ASN 39 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2phx n GLY 40 N 0.93 0.61 3.84 4.83 0.00 -0.72 -5.06 105.19 109.62 2phx n GLY 40 Ca 0.11 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 2phx n GLY 40 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2phx s ASN 41 N -2.38 6.85 0.58 1.61 0.02 -1.26 -4.74 114.94 115.61 2phx s ASN 41 Ca 0.00 1.17 -0.18 0.00 -1.02 0.00 0.00 52.86 52.83 2phx s ASN 41 Cb 0.00 -2.32 -0.04 0.00 0.02 0.00 0.00 41.25 38.91 2phx s ASN 41 CO 0.00 0.02 1.10 -2.16 0.02 0.00 0.00 177.10 176.08 2phx s PRO 42 N -2.21 3.26 0.23 -0.60 0.04 -1.26 -0.47 135.00 133.99 2phx s PRO 42 Ca 0.42 1.44 0.07 0.00 0.04 0.00 0.00 61.00 62.98 2phx s PRO 42 Cb -0.14 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 2phx s PRO 42 CO 0.20 -0.89 -0.10 0.14 0.04 0.00 0.00 177.00 176.38 2phx s VAL 43 N -2.08 1.65 0.70 -0.36 -7.23 -1.17 -4.82 120.40 107.09 2phx s VAL 43 Ca 0.69 -2.17 -0.11 0.00 -1.81 0.00 0.00 61.98 58.58 2phx s VAL 43 Cb -0.20 -2.20 0.01 0.00 0.56 0.00 0.00 36.38 34.54 2phx s VAL 43 CO 0.32 -0.48 1.09 0.00 -0.31 0.00 0.00 175.10 175.72 2phx s ALA 44 N -3.02 2.91 -0.87 1.32 0.00 -1.26 -4.59 121.76 116.24 2phx s ALA 44 Ca 0.25 -0.33 -0.04 0.00 0.00 0.00 0.00 51.96 51.85 2phx s ALA 44 Cb 0.01 -3.03 -0.02 0.00 0.00 0.00 0.00 23.12 20.09 2phx s ALA 44 CO 0.09 -1.11 0.75 0.43 0.00 0.00 0.00 175.76 175.91 2phx n SER 45 N -2.99 -6.90 -3.79 0.00 7.64 0.08 -4.99 113.62 102.66 2phx n SER 45 Ca 0.07 -0.43 -0.13 0.00 1.01 0.00 0.00 58.87 59.39 2phx n SER 45 Cb 0.57 -4.63 -0.10 0.00 -1.01 0.00 0.00 64.21 59.04 2phx n SER 45 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2phx s THR 46 N -3.14 0.03 0.02 0.44 -1.32 -0.41 -4.99 115.64 106.26 2phx s THR 46 Ca 0.16 -0.27 0.02 0.00 -1.21 0.00 0.00 61.69 60.39 2phx s THR 46 Cb -0.03 -0.46 -0.01 0.00 -1.51 0.00 0.00 72.50 70.48 2phx s THR 46 CO 0.78 -0.15 -0.07 -0.69 -2.21 0.00 0.00 174.62 172.28 2phx s VAL 47 N -0.58 0.52 -0.09 5.08 1.01 -1.26 -0.71 120.40 124.37 2phx s VAL 47 Ca -0.07 -0.62 -0.26 0.00 0.00 0.00 0.00 61.98 61.03 2phx s VAL 47 Cb -0.04 -0.50 0.06 0.00 0.00 0.00 0.00 36.38 35.90 2phx s VAL 47 CO 0.02 -0.09 0.60 -0.83 0.00 0.00 0.00 175.10 174.80 2phx s GLY 48 N -0.78 -0.48 0.07 4.51 0.00 -0.67 -0.14 107.32 109.84 2phx s GLY 48 Ca -0.03 1.26 -0.09 0.00 0.00 0.00 0.00 44.72 45.87 2phx s GLY 48 CO 0.00 0.96 0.19 0.50 0.00 0.00 0.00 173.10 174.75 2phx s ARG 49 N -0.83 0.80 0.04 2.90 0.52 -0.68 -1.49 118.95 120.22 2phx s ARG 49 Ca -0.09 -0.86 0.02 0.00 -0.52 0.00 0.00 55.73 54.28 2phx s ARG 49 Cb -0.02 0.33 -0.02 0.00 0.52 0.00 0.00 34.95 35.75 2phx s ARG 49 CO 0.07 -0.25 -0.07 0.96 0.02 0.00 0.00 175.30 176.03 2phx s ILE 50 N -3.49 0.48 0.02 1.52 -4.36 -0.48 -1.10 121.20 113.80 2phx s ILE 50 Ca 0.02 -1.06 0.02 0.00 -0.26 0.00 0.00 60.65 59.37 2phx s ILE 50 Cb 0.03 -0.57 -0.02 0.00 1.25 0.00 0.00 42.46 43.16 2phx s ILE 50 CO -0.09 -0.40 -0.06 -0.76 0.24 0.00 0.00 174.94 173.86 2phx s LEU 51 N -1.57 2.17 0.34 0.37 1.43 -0.57 -1.31 118.68 119.54 2phx s LEU 51 Ca -0.11 -0.38 -0.26 0.00 -1.03 0.00 0.00 54.13 52.35 2phx s LEU 51 Cb -0.10 -0.18 -0.09 0.00 0.03 0.00 0.00 46.19 45.85 2phx s LEU 51 CO 0.00 -0.11 1.05 0.12 0.23 0.00 0.00 176.35 177.64 2phx s PHE 52 N -0.93 3.46 0.19 0.29 5.36 -0.70 -0.87 117.98 124.78 2phx s PHE 52 Ca -0.06 1.70 -0.03 0.00 -0.96 0.00 0.00 56.93 57.58 2phx s PHE 52 Cb -0.07 -3.15 0.11 0.00 -0.34 0.00 0.00 43.02 39.56 2phx s PHE 52 CO 0.00 -0.45 1.50 0.66 -1.46 0.00 0.00 175.22 175.47 2phx h SER 53 N 3.13 0.61 -3.68 6.13 4.64 -1.09 -3.42 113.55 119.86 2phx h SER 53 Ca -0.47 -0.33 -0.51 0.00 -0.47 0.00 0.00 61.79 60.01 2phx h SER 53 Cb 1.21 -0.17 0.01 0.00 -0.31 0.00 0.00 62.40 63.14 2phx h SER 53 CO 0.65 1.04 0.49 0.00 -0.87 0.00 0.00 176.83 178.13 2phx s ALA 54 N -3.97 3.40 0.36 5.18 0.00 -1.26 -5.00 121.76 120.47 2phx s ALA 54 Ca -0.07 0.88 -0.25 0.00 0.00 0.00 0.00 51.96 52.51 2phx s ALA 54 Cb 0.11 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.79 2phx s ALA 54 CO 0.84 -0.20 1.01 -0.65 0.00 0.00 0.00 175.76 176.76 2phx s GLN 55 N -0.92 4.38 -0.18 0.00 -0.21 -1.26 -4.81 119.66 116.66 2phx s GLN 55 Ca 0.47 1.46 -0.09 0.00 0.02 0.00 0.00 55.36 57.22 2phx s GLN 55 Cb -0.31 -2.70 -0.05 0.00 1.00 0.00 0.00 33.01 30.95 2phx s GLN 55 CO 0.38 0.07 0.11 0.08 -2.12 0.00 0.00 175.29 173.81 2phx s VAL 56 N -1.60 5.24 -0.76 1.09 1.01 0.40 -4.91 120.40 120.87 2phx s VAL 56 Ca 0.53 0.12 -0.22 0.00 0.00 0.00 0.00 61.98 62.42 2phx s VAL 56 Cb -0.21 -3.36 0.08 0.00 0.00 0.00 0.00 36.38 32.88 2phx s VAL 56 CO 0.27 0.47 1.06 -2.28 0.00 0.00 0.00 175.10 174.62 2phx s HIS 57 N 0.14 2.75 0.10 5.22 2.46 -1.26 -1.34 115.29 123.36 2phx s HIS 57 Ca 0.08 -0.76 -0.06 0.00 0.47 0.00 0.00 55.06 54.79 2phx s HIS 57 Cb -0.11 -4.34 -0.17 0.00 -0.13 0.00 0.00 32.58 27.83 2phx s HIS 57 CO -0.01 -1.66 1.24 1.25 -2.47 0.00 0.00 174.74 173.09 2phx h LEU 58 N 11.32 0.57 -7.18 8.88 5.85 -1.06 -3.43 115.31 130.25 2phx h LEU 58 Ca -0.14 -0.50 -0.04 0.00 0.84 0.00 0.00 57.88 58.04 2phx h LEU 58 Cb 1.05 -0.18 -0.13 0.00 0.37 0.00 0.00 40.66 41.77 2phx h LEU 58 CO 1.19 1.32 0.07 -1.66 -0.34 0.00 0.00 178.44 179.02 2phx s TRP 59 N -3.09 -0.40 -0.20 1.25 1.48 -1.13 -0.11 118.94 116.75 2phx s TRP 59 Ca -0.06 0.21 -0.01 0.00 -1.06 0.00 0.00 56.10 55.18 2phx s TRP 59 Cb 0.08 0.40 0.06 0.00 -1.16 0.00 0.00 33.47 32.85 2phx s TRP 59 CO 0.88 -0.75 -0.00 -2.00 -4.06 0.00 0.00 176.95 171.02 2phx s GLU 60 N -3.46 1.03 0.23 3.25 2.12 -0.56 -4.58 118.70 116.73 2phx s GLU 60 Ca 0.00 -0.58 -0.07 0.00 0.36 0.00 0.00 54.97 54.68 2phx s GLU 60 Cb 0.00 -2.20 0.28 0.00 0.26 0.00 0.00 34.13 32.48 2phx s GLU 60 CO -0.10 -0.59 1.85 -0.22 -0.54 0.00 0.00 175.26 175.66 2phx h LYS 61 N 8.15 0.89 -0.21 4.30 3.64 -1.97 -1.16 116.57 130.21 2phx h LYS 61 Ca -0.18 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.09 2phx h LYS 61 Cb 1.10 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 2phx h LYS 61 CO 0.36 0.59 -0.12 0.66 -2.27 0.00 0.00 179.45 178.67 2phx h SER 62 N 0.92 0.32 -0.01 4.20 4.64 -1.97 -3.21 113.55 118.44 2phx h SER 62 Ca 0.34 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2phx h SER 62 Cb 0.13 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 2phx h SER 62 CO -0.16 0.47 -0.40 -1.54 -0.87 0.00 0.00 176.83 174.33 2phx n SER 63 N -4.25 1.42 -1.40 4.97 3.41 -1.14 -4.98 113.62 111.65 2phx n SER 63 Ca -0.00 -1.21 -0.14 0.00 -0.26 0.00 0.00 58.87 57.27 2phx n SER 63 Cb 0.29 0.58 -0.02 0.00 -0.26 0.00 0.00 64.21 64.79 2phx n SER 63 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2phx n SER 64 N -0.38 -4.32 -4.93 4.04 2.88 -0.45 -5.01 113.62 105.45 2phx n SER 64 Ca 0.06 0.09 -0.27 0.00 -1.33 0.00 0.00 58.87 57.42 2phx n SER 64 Cb 0.31 -3.36 -0.03 0.00 -0.75 0.00 0.00 64.21 60.38 2phx n SER 64 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2phx s ARG 65 N -4.23 3.42 0.00 -1.46 0.52 -1.14 -4.43 118.95 111.64 2phx s ARG 65 Ca 0.00 -0.58 0.02 0.00 -0.52 0.00 0.00 55.73 54.65 2phx s ARG 65 Cb 0.00 -2.97 -0.01 0.00 0.52 0.00 0.00 34.95 32.50 2phx s ARG 65 CO 0.00 0.54 -0.06 0.08 0.02 0.00 0.00 175.30 175.88 2phx s VAL 66 N -1.69 0.45 0.37 3.52 1.01 -0.89 -1.50 120.40 121.67 2phx s VAL 66 Ca 0.34 -0.37 -0.24 0.00 0.00 0.00 0.00 61.98 61.71 2phx s VAL 66 Cb -0.11 -0.41 -0.10 0.00 0.00 0.00 0.00 36.38 35.76 2phx s VAL 66 CO 0.28 0.04 0.98 0.00 0.00 0.00 0.00 175.10 176.40 2phx s ALA 67 N -0.33 3.12 0.03 5.51 0.00 0.85 -2.00 121.76 128.95 2phx s ALA 67 Ca 0.00 0.54 -0.06 0.00 0.00 0.00 0.00 51.96 52.44 2phx s ALA 67 Cb -0.03 -3.20 -0.05 0.00 0.00 0.00 0.00 23.12 19.84 2phx s ALA 67 CO -0.00 0.05 0.29 0.54 0.00 0.00 0.00 175.76 176.64 2phx s ASN 68 N -1.76 6.50 0.09 0.00 4.22 -0.28 -4.39 114.94 119.32 2phx s ASN 68 Ca 0.56 0.57 -0.09 0.00 -2.14 0.00 0.00 52.86 51.75 2phx s ASN 68 Cb -0.17 -2.09 0.00 0.00 1.28 0.00 0.00 41.25 40.27 2phx s ASN 68 CO 0.22 0.22 0.21 0.72 -2.04 0.00 0.00 177.10 176.42 2phx s PHE 69 N -1.36 0.11 -0.04 1.54 -0.12 -0.96 -1.52 117.98 115.63 2phx s PHE 69 Ca 0.30 -0.52 -0.02 0.00 -0.05 0.00 0.00 56.93 56.64 2phx s PHE 69 Cb -0.13 -0.03 0.03 0.00 -0.63 0.00 0.00 43.02 42.25 2phx s PHE 69 CO 0.18 -0.55 0.10 -1.14 -0.05 0.00 0.00 175.22 173.76 2phx s GLN 70 N -3.76 0.06 -0.11 1.99 0.74 -0.16 -1.24 119.66 117.17 2phx s GLN 70 Ca 0.04 0.24 0.00 0.00 0.05 0.00 0.00 55.36 55.70 2phx s GLN 70 Cb 0.04 -0.13 0.02 0.00 1.10 0.00 0.00 33.01 34.05 2phx s GLN 70 CO -0.11 -0.12 -0.10 0.45 -0.55 0.00 0.00 175.29 174.87 2phx s SER 71 N 0.79 2.17 -0.07 6.67 0.15 0.10 -1.22 113.70 122.29 2phx s SER 71 Ca -0.06 -0.33 0.05 0.00 0.70 0.00 0.00 55.95 56.30 2phx s SER 71 Cb -0.08 -0.90 -0.01 0.00 -1.71 0.00 0.00 66.02 63.32 2phx s SER 71 CO -0.03 -0.07 -0.22 -1.58 1.20 0.00 0.00 173.24 172.54 2phx s GLN 72 N 1.38 2.70 0.20 5.44 0.74 0.04 -0.74 119.66 129.42 2phx s GLN 72 Ca -0.00 -0.85 -0.19 0.00 0.05 0.00 0.00 55.36 54.37 2phx s GLN 72 Cb -0.13 -2.26 0.03 0.00 1.10 0.00 0.00 33.01 31.75 2phx s GLN 72 CO -0.05 0.37 0.55 -0.59 -0.55 0.00 0.00 175.29 175.02 2phx s PHE 73 N -0.12 -0.20 0.01 1.67 -0.12 -0.47 -0.46 117.98 118.30 2phx s PHE 73 Ca -0.04 -0.13 0.03 0.00 -0.05 0.00 0.00 56.93 56.74 2phx s PHE 73 Cb -0.14 0.45 -0.01 0.00 -0.63 0.00 0.00 43.02 42.69 2phx s PHE 73 CO 0.04 -0.93 -0.08 0.45 -0.05 0.00 0.00 175.22 174.65 2phx s SER 74 N -2.85 0.94 0.15 1.98 0.15 -0.99 -0.19 113.70 112.88 2phx s SER 74 Ca 0.08 -0.27 -0.12 0.00 0.70 0.00 0.00 55.95 56.34 2phx s SER 74 Cb -0.01 -0.06 0.01 0.00 -1.71 0.00 0.00 66.02 64.24 2phx s SER 74 CO -0.04 0.01 0.32 0.72 1.20 0.00 0.00 173.24 175.46 2phx s PHE 75 N -0.54 0.15 0.04 3.44 -0.71 -0.94 -0.73 117.98 118.69 2phx s PHE 75 Ca -0.00 -0.52 0.02 0.00 -1.04 0.00 0.00 56.93 55.39 2phx s PHE 75 Cb -0.05 0.07 -0.02 0.00 -1.21 0.00 0.00 43.02 41.81 2phx s PHE 75 CO 0.00 -0.71 -0.08 -1.12 -1.34 0.00 0.00 175.22 171.97 2phx s SER 76 N -2.90 0.88 -0.03 1.98 0.01 -0.48 -0.87 113.70 112.29 2phx s SER 76 Ca 0.11 -0.55 0.06 0.00 1.31 0.00 0.00 55.95 56.88 2phx s SER 76 Cb 0.03 0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.28 2phx s SER 76 CO -0.05 -0.20 -0.22 -0.76 0.41 0.00 0.00 173.24 172.42 2phx s LEU 77 N -1.58 2.03 -0.01 2.44 1.43 -1.26 -1.39 118.68 120.33 2phx s LEU 77 Ca -0.10 -0.41 -0.01 0.00 -1.03 0.00 0.00 54.13 52.58 2phx s LEU 77 Cb -0.10 -1.15 0.00 0.00 0.03 0.00 0.00 46.19 44.97 2phx s LEU 77 CO 0.00 0.25 0.03 -0.75 0.23 0.00 0.00 176.35 176.12 2phx s LYS 78 N -0.41 0.03 -0.18 1.70 2.20 -1.21 0.19 119.74 122.07 2phx s LYS 78 Ca 0.05 0.05 -0.25 0.00 -0.36 0.00 0.00 55.97 55.46 2phx s LYS 78 Cb -0.10 -0.00 0.06 0.00 -1.51 0.00 0.00 37.83 36.29 2phx s LYS 78 CO 0.00 -0.01 0.65 0.45 -0.36 0.00 0.00 175.35 176.08 2phx s SER 79 N 0.08 -0.66 0.30 1.43 0.15 -1.26 -0.98 113.70 112.77 2phx s SER 79 Ca -0.01 1.09 0.05 0.00 0.70 0.00 0.00 55.95 57.78 2phx s SER 79 Cb -0.01 1.05 0.49 0.00 -1.71 0.00 0.00 66.02 65.84 2phx s SER 79 CO -0.00 -0.36 1.75 -0.65 1.20 0.00 0.00 173.24 175.18 2phx h PRO 80 N 4.39 0.39 -7.68 5.44 0.11 -1.97 -3.44 132.00 129.24 2phx h PRO 80 Ca -0.28 -0.14 -0.44 0.00 0.11 0.00 0.00 66.00 65.25 2phx h PRO 80 Cb 1.16 -0.03 0.17 0.00 0.11 0.00 0.00 31.00 32.41 2phx h PRO 80 CO 0.19 0.62 0.34 -0.51 -0.21 0.00 0.00 178.00 178.43 2phx s LEU 81 N -8.61 2.12 0.00 2.35 1.43 -1.26 -5.00 118.68 109.71 2phx s LEU 81 Ca -0.06 0.43 0.12 0.00 -1.03 0.00 0.00 54.13 53.59 2phx s LEU 81 Cb 0.14 -2.42 -0.06 0.00 0.03 0.00 0.00 46.19 43.87 2phx s LEU 81 CO 0.78 -3.06 0.61 -0.24 0.23 0.00 0.00 176.35 174.66 2phx n SER 82 N -4.02 0.98 -3.10 2.29 2.88 -1.26 -4.59 113.62 106.80 2phx n SER 82 Ca 0.14 -0.99 -0.26 0.00 -1.33 0.00 0.00 58.87 56.43 2phx n SER 82 Cb 0.59 0.72 -0.05 0.00 -0.75 0.00 0.00 64.21 64.72 2phx n SER 82 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2phx n ASN 83 N -0.71 3.73 -4.73 -3.46 0.23 -1.26 -5.09 115.26 103.97 2phx n ASN 83 Ca 0.04 -3.51 -0.35 0.00 -0.53 0.00 0.00 54.58 50.22 2phx n ASN 83 Cb 0.22 -0.60 0.08 0.00 -2.08 0.00 0.00 39.78 37.40 2phx n ASN 83 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 2phx s GLY 84 N -3.00 2.58 0.13 4.83 0.00 -1.26 -4.64 107.32 105.95 2phx s GLY 84 Ca 0.45 1.02 -0.07 0.00 0.00 0.00 0.00 44.72 46.12 2phx s GLY 84 CO -0.10 1.43 0.20 0.00 0.00 0.00 0.00 173.10 174.64 2phx s ALA 85 N -1.73 0.09 -0.04 3.20 0.00 -1.25 -4.39 121.76 117.65 2phx s ALA 85 Ca 0.78 -0.91 0.10 0.00 0.00 0.00 0.00 51.96 51.94 2phx s ALA 85 Cb -0.32 0.71 -0.16 0.00 0.00 0.00 0.00 23.12 23.35 2phx s ALA 85 CO 0.42 -0.56 0.19 -0.25 0.00 0.00 0.00 175.76 175.55 2phx n ASP 86 N -0.13 2.51 0.00 0.00 8.00 0.44 -2.67 116.55 124.71 2phx n ASP 86 Ca -0.10 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.40 2phx n ASP 86 Cb 0.63 1.32 0.00 0.00 -0.02 0.00 0.00 41.12 43.04 2phx n ASP 86 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2phx n GLY 87 N 2.00 2.84 3.23 0.44 0.00 -1.22 -2.71 105.19 109.77 2phx n GLY 87 Ca -0.05 -1.64 -0.22 0.00 0.00 0.00 0.00 46.02 44.11 2phx n GLY 87 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2phx s ILE 88 N -1.94 1.44 -0.01 -0.61 2.07 -0.92 -2.96 121.20 118.27 2phx s ILE 88 Ca 0.00 -1.39 -0.01 0.00 -1.41 0.00 0.00 60.65 57.84 2phx s ILE 88 Cb 0.00 -1.32 0.00 0.00 0.13 0.00 0.00 42.46 41.27 2phx s ILE 88 CO 0.00 -0.10 0.04 0.00 -1.91 0.00 0.00 174.94 172.97 2phx s ALA 89 N -1.15 -0.09 -0.03 1.50 0.00 0.46 -0.68 121.76 121.77 2phx s ALA 89 Ca 0.03 0.05 -0.19 0.00 0.00 0.00 0.00 51.96 51.85 2phx s ALA 89 Cb -0.10 -0.04 -0.05 0.00 0.00 0.00 0.00 23.12 22.93 2phx s ALA 89 CO 0.03 -0.04 0.53 0.12 0.00 0.00 0.00 175.76 176.41 2phx s PHE 90 N -0.15 3.66 0.06 0.00 5.36 -0.52 -0.96 117.98 125.43 2phx s PHE 90 Ca -0.02 1.10 -0.03 0.00 -0.96 0.00 0.00 56.93 57.02 2phx s PHE 90 Cb -0.01 -2.54 -0.03 0.00 -0.34 0.00 0.00 43.02 40.10 2phx s PHE 90 CO 0.00 0.37 0.04 -0.59 -1.46 0.00 0.00 175.22 173.58 2phx s PHE 91 N -0.20 0.39 -0.07 10.12 -0.71 -0.03 -0.66 117.98 126.82 2phx s PHE 91 Ca 0.28 -0.89 0.02 0.00 -1.04 0.00 0.00 56.93 55.31 2phx s PHE 91 Cb -0.17 -0.28 0.01 0.00 -1.21 0.00 0.00 43.02 41.37 2phx s PHE 91 CO 0.15 -0.42 -0.14 0.42 -1.34 0.00 0.00 175.22 173.89 2phx s ILE 92 N -3.77 1.27 0.29 -4.49 1.01 0.06 -1.32 121.20 114.26 2phx s ILE 92 Ca 0.05 -0.55 -0.10 0.00 0.00 0.00 0.00 60.65 60.05 2phx s ILE 92 Cb 0.06 -1.15 0.00 0.00 0.01 0.00 0.00 42.46 41.39 2phx s ILE 92 CO -0.10 0.39 0.51 0.00 0.00 0.00 0.00 174.94 175.74 2phx s ALA 93 N 0.67 -0.00 0.67 9.38 0.00 -0.69 -2.19 121.76 129.60 2phx s ALA 93 Ca -0.14 -1.05 -0.17 0.00 0.00 0.00 0.00 51.96 50.59 2phx s ALA 93 Cb -0.16 1.05 0.00 0.00 0.00 0.00 0.00 23.12 24.01 2phx s ALA 93 CO 0.04 -0.85 1.29 -2.14 0.00 0.00 0.00 175.76 174.09 2phx s PRO 94 N -3.54 2.40 0.51 0.00 0.02 -1.26 -0.76 135.00 132.37 2phx s PRO 94 Ca 0.24 2.04 0.23 0.00 0.02 0.00 0.00 61.00 63.53 2phx s PRO 94 Cb -0.01 -1.83 1.32 0.00 0.02 0.00 0.00 34.50 34.00 2phx s PRO 94 CO 0.13 -1.71 1.99 -1.35 -0.33 0.00 0.00 177.00 175.73 2phx h PRO 95 N 0.32 0.08 -0.69 5.54 0.11 -1.85 -2.30 132.00 133.21 2phx h PRO 95 Ca -0.50 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2phx h PRO 95 Cb 1.33 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2phx h PRO 95 CO 0.52 0.05 0.00 -0.40 -0.21 0.00 0.00 178.00 177.96 2phx n ASP 96 N -4.40 3.30 -4.77 -2.05 3.85 -1.26 -4.86 116.55 106.36 2phx n ASP 96 Ca 0.10 -2.40 -0.40 0.00 -0.71 0.00 0.00 54.79 51.38 2phx n ASP 96 Cb 0.57 -0.53 0.01 0.00 -1.35 0.00 0.00 41.12 39.82 2phx n ASP 96 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 2phx s THR 97 N -1.86 2.13 0.15 2.12 -1.32 -0.87 -5.02 115.64 110.98 2phx s THR 97 Ca 0.30 0.12 -0.00 0.00 -1.21 0.00 0.00 61.69 60.89 2phx s THR 97 Cb 0.21 -3.07 -0.04 0.00 -1.51 0.00 0.00 72.50 68.09 2phx s THR 97 CO 0.11 0.02 0.06 0.42 -2.21 0.00 0.00 174.62 173.02 2phx s THR 98 N -1.19 0.21 0.01 5.08 -4.23 -1.26 -5.10 115.64 109.15 2phx s THR 98 Ca 0.59 -1.94 -0.30 0.00 -1.18 0.00 0.00 61.69 58.86 2phx s THR 98 Cb -0.44 -2.14 -0.07 0.00 1.34 0.00 0.00 72.50 71.19 2phx s THR 98 CO 0.57 -0.38 1.75 -0.63 -0.54 0.00 0.00 174.62 175.38 2phx s ILE 99 N -3.98 3.25 0.55 2.99 1.01 -1.26 -4.96 121.20 118.79 2phx s ILE 99 Ca 0.27 0.44 -0.19 0.00 0.00 0.00 0.00 60.65 61.17 2phx s ILE 99 Cb 0.07 -3.28 -0.06 0.00 0.01 0.00 0.00 42.46 39.20 2phx s ILE 99 CO 0.04 -0.03 1.12 -2.84 0.00 0.00 0.00 174.94 173.23 2phx s PRO 100 N 3.75 3.35 0.22 2.79 0.02 -1.26 -4.96 135.00 138.90 2phx s PRO 100 Ca 0.78 1.56 -0.31 0.00 0.02 0.00 0.00 61.00 63.05 2phx s PRO 100 Cb -0.38 -2.01 -0.10 0.00 0.02 0.00 0.00 34.50 32.03 2phx s PRO 100 CO 0.34 -0.84 1.51 -1.12 -0.33 0.00 0.00 177.00 176.55 2phx s SER 101 N -1.88 6.60 -0.92 2.53 0.01 -1.26 -2.53 113.70 116.25 2phx s SER 101 Ca 0.72 2.67 0.00 0.00 1.31 0.00 0.00 55.95 60.65 2phx s SER 101 Cb -0.23 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.39 2phx s SER 101 CO 0.28 -0.77 0.00 0.61 0.41 0.00 0.00 173.24 173.76 2phx n GLY 102 N 2.85 1.01 0.89 3.44 0.00 -1.26 -4.37 105.19 107.74 2phx n GLY 102 Ca 0.10 -0.64 0.04 0.00 0.00 0.00 0.00 46.02 45.52 2phx n GLY 102 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2phx n SER 103 N 0.59 2.49 -2.68 1.61 3.41 -1.05 -4.29 113.62 113.70 2phx n SER 103 Ca -0.09 -2.23 -0.07 0.00 -0.26 0.00 0.00 58.87 56.22 2phx n SER 103 Cb 0.30 -0.43 0.06 0.00 -0.26 0.00 0.00 64.21 63.87 2phx n SER 103 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2phx n GLY 104 N 0.58 -2.23 7.00 5.00 0.00 -1.26 0.22 105.19 114.50 2phx n GLY 104 Ca 0.11 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.63 2phx n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2phx n GLY 105 N 1.29 3.11 0.00 -0.02 0.00 -1.26 -1.85 105.19 106.46 2phx n GLY 105 Ca 0.04 -0.13 0.04 0.00 0.00 0.00 0.00 46.02 45.96 2phx n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2phx n GLY 106 N 0.00 -0.66 0.23 -0.02 0.00 -1.26 -1.45 105.19 102.03 2phx n GLY 106 Ca 0.00 -0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.13 2phx n GLY 106 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2phx n LEU 107 N -1.40 0.84 -1.36 0.99 4.77 -0.77 -4.94 117.00 115.13 2phx n LEU 107 Ca 0.03 -0.20 -0.16 0.00 -0.03 0.00 0.00 56.01 55.65 2phx n LEU 107 Cb 0.08 -0.10 -0.07 0.00 -2.33 0.00 0.00 43.42 41.00 2phx n LEU 107 CO 0.07 0.15 -0.15 0.18 -1.33 0.00 0.00 177.39 176.31 2phx n LEU 108 N -0.59 -1.08 -0.03 2.23 4.77 -0.53 -1.69 117.00 120.08 2phx n LEU 108 Ca 0.16 0.40 -0.00 0.00 -0.03 0.00 0.00 56.01 56.53 2phx n LEU 108 Cb 0.30 -2.48 -0.00 0.00 -2.33 0.00 0.00 43.42 38.91 2phx n LEU 108 CO 0.22 -0.92 -0.00 0.61 -1.33 0.00 0.00 177.39 175.97 2phx n GLY 109 N -0.21 0.45 0.04 -0.72 0.00 0.13 -3.87 105.19 101.01 2phx n GLY 109 Ca -0.16 -0.12 -0.03 0.00 0.00 0.00 0.00 46.02 45.72 2phx n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2phx n LEU 110 N -0.05 0.00 -4.22 0.99 4.77 -0.68 -4.45 117.00 113.36 2phx n LEU 110 Ca -0.00 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.79 2phx n LEU 110 Cb 0.09 0.19 -0.12 0.00 -2.33 0.00 0.00 43.42 41.26 2phx n LEU 110 CO 0.01 0.19 -0.46 -0.36 -1.33 0.00 0.00 177.39 175.44 2phx s PHE 111 N -2.34 1.36 0.15 -1.77 0.40 -1.19 -4.85 117.98 109.75 2phx s PHE 111 Ca -0.05 -0.50 -0.21 0.00 -0.60 0.00 0.00 56.93 55.57 2phx s PHE 111 Cb 0.04 -0.74 -0.08 0.00 0.51 0.00 0.00 43.02 42.75 2phx s PHE 111 CO 0.41 0.11 0.67 0.00 0.70 0.00 0.00 175.22 177.12 2phx s ALA 112 N -1.67 3.50 0.21 5.36 0.00 -1.26 -4.03 121.76 123.87 2phx s ALA 112 Ca 0.04 0.16 -0.13 0.00 0.00 0.00 0.00 51.96 52.03 2phx s ALA 112 Cb -0.08 -2.78 0.23 0.00 0.00 0.00 0.00 23.12 20.50 2phx s ALA 112 CO 0.03 0.35 1.63 -1.35 0.00 0.00 0.00 175.76 176.42 2phx h PRO 113 N 4.10 0.01 0.00 0.00 0.11 -1.76 -0.24 132.00 134.22 2phx h PRO 113 Ca -0.48 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2phx h PRO 113 Cb 1.20 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 2phx h PRO 113 CO 0.65 0.01 -0.04 0.78 -0.21 0.00 0.00 178.00 179.18 2phx h GLY 114 N 0.01 0.00 -0.20 -0.55 0.00 -1.94 -3.21 103.07 97.18 2phx h GLY 114 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 2phx h GLY 114 CO -0.62 0.00 -0.10 -1.30 0.00 0.00 0.00 176.54 174.52 2phx n THR 115 N -3.23 0.93 0.08 4.70 -2.24 -0.87 -4.83 114.28 108.81 2phx n THR 115 Ca -0.01 -1.05 0.17 0.00 -2.27 0.00 0.00 64.05 60.89 2phx n THR 115 Cb 0.23 0.34 0.69 0.00 -2.10 0.00 0.00 70.33 69.49 2phx n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2phx h ALA 116 N 0.00 2.33 -0.22 6.98 0.00 -1.06 -1.84 119.26 125.45 2phx h ALA 116 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2phx h ALA 116 Cb 0.93 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2phx h ALA 116 CO 0.00 -0.48 0.00 1.04 0.00 0.00 0.00 179.25 179.81 2phx n GLN 117 N -4.37 2.79 -3.23 0.00 6.02 -1.26 -1.06 117.38 116.28 2phx n GLN 117 Ca 0.06 -2.12 -0.45 0.00 -0.01 0.00 0.00 57.00 54.48 2phx n GLN 117 Cb 0.47 -1.34 -0.05 0.00 1.02 0.00 0.00 30.24 30.34 2phx n GLN 117 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2phx s ASN 118 N -1.33 6.19 0.49 1.08 3.84 -0.69 -4.94 114.94 119.57 2phx s ASN 118 Ca 0.22 -1.45 0.19 0.00 0.21 0.00 0.00 52.86 52.04 2phx s ASN 118 Cb 0.15 -2.25 1.25 0.00 -0.55 0.00 0.00 41.25 39.84 2phx s ASN 118 CO 0.10 -0.92 2.07 0.71 -2.79 0.00 0.00 177.10 176.26 2phx h THR 119 N 5.88 0.91 0.00 -5.21 1.35 -1.85 -1.86 112.91 112.13 2phx h THR 119 Ca -0.29 -0.43 0.00 0.00 -0.55 0.00 0.00 66.41 65.14 2phx h THR 119 Cb 1.10 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 2phx h THR 119 CO 1.02 0.12 0.00 -1.20 -0.25 0.00 0.00 175.52 175.21 2phx n SER 120 N -4.15 0.17 -0.35 5.36 7.64 -1.26 -3.30 113.62 117.73 2phx n SER 120 Ca -0.02 0.52 0.11 0.00 1.01 0.00 0.00 58.87 60.49 2phx n SER 120 Cb 0.20 -0.57 0.07 0.00 -1.01 0.00 0.00 64.21 62.90 2phx n SER 120 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2phx n ALA 121 N -1.56 3.65 -2.47 -0.43 0.00 -0.70 -4.98 120.51 114.01 2phx n ALA 121 Ca 0.06 -0.58 -0.23 0.00 0.00 0.00 0.00 53.44 52.69 2phx n ALA 121 Cb 0.31 -0.87 -0.10 0.00 0.00 0.00 0.00 19.45 18.79 2phx n ALA 121 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2phx s ASN 122 N -2.59 3.23 -0.37 0.00 0.01 -1.21 -5.10 114.94 108.93 2phx s ASN 122 Ca 0.18 -1.14 0.01 0.00 -0.71 0.00 0.00 52.86 51.20 2phx s ASN 122 Cb 0.18 -0.25 0.15 0.00 0.41 0.00 0.00 41.25 41.74 2phx s ASN 122 CO 0.61 -0.20 0.25 -1.10 -1.51 0.00 0.00 177.10 175.16 2phx s GLN 123 N -3.63 0.63 -0.17 -0.60 -0.21 -1.26 -4.85 119.66 109.57 2phx s GLN 123 Ca 0.30 -1.48 -0.28 0.00 0.02 0.00 0.00 55.36 53.92 2phx s GLN 123 Cb 0.01 -1.28 0.09 0.00 1.00 0.00 0.00 33.01 32.82 2phx s GLN 123 CO 0.13 -1.25 0.79 0.54 -2.12 0.00 0.00 175.29 173.38 2phx s VAL 124 N 0.86 0.00 -0.08 1.09 0.11 -1.26 -4.31 120.40 116.81 2phx s VAL 124 Ca 0.21 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.29 2phx s VAL 124 Cb -0.16 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.70 2phx s VAL 124 CO -0.04 0.00 -0.16 -0.63 -3.33 0.00 0.00 175.10 170.94 2phx s ILE 125 N -0.47 1.42 0.03 7.04 1.01 -0.93 -1.24 121.20 128.06 2phx s ILE 125 Ca -0.04 -0.64 -0.03 0.00 0.00 0.00 0.00 60.65 59.94 2phx s ILE 125 Cb -0.02 -1.27 -0.02 0.00 0.01 0.00 0.00 42.46 41.16 2phx s ILE 125 CO 0.04 0.42 0.05 0.00 0.00 0.00 0.00 174.94 175.44 2phx s ALA 126 N 0.63 0.06 -0.23 9.38 0.00 -0.07 -0.76 121.76 130.78 2phx s ALA 126 Ca -0.14 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.19 2phx s ALA 126 Cb -0.16 0.22 0.04 0.00 0.00 0.00 0.00 23.12 23.21 2phx s ALA 126 CO 0.04 -0.28 -0.12 0.08 0.00 0.00 0.00 175.76 175.48 2phx s VAL 127 N -2.44 2.34 0.06 0.00 1.01 0.17 -0.27 120.40 121.26 2phx s VAL 127 Ca -0.07 -1.27 0.02 0.00 0.00 0.00 0.00 61.98 60.66 2phx s VAL 127 Cb -0.02 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 2phx s VAL 127 CO -0.04 0.19 0.10 -1.83 0.00 0.00 0.00 175.10 173.52 2phx s GLU 128 N 1.22 3.02 -0.38 2.72 -1.05 0.15 -1.44 118.70 122.93 2phx s GLU 128 Ca -0.02 -0.60 0.03 0.00 -0.15 0.00 0.00 54.97 54.23 2phx s GLU 128 Cb -0.17 -2.81 0.11 0.00 -0.44 0.00 0.00 34.13 30.82 2phx s GLU 128 CO -0.07 0.59 0.12 -0.06 0.95 0.00 0.00 175.26 176.79 2phx s PHE 129 N -1.36 3.16 -0.31 4.83 0.40 0.14 -1.10 117.98 123.75 2phx s PHE 129 Ca 0.29 -2.79 -0.09 0.00 -0.60 0.00 0.00 56.93 53.74 2phx s PHE 129 Cb -0.12 -2.62 -0.00 0.00 0.51 0.00 0.00 43.02 40.78 2phx s PHE 129 CO 0.21 -0.88 0.13 0.34 0.70 0.00 0.00 175.22 175.72 2phx s ASP 130 N 0.72 5.41 0.00 1.36 -1.08 -0.36 -2.17 116.67 120.55 2phx s ASP 130 Ca 0.13 -0.59 0.21 0.00 -0.52 0.00 0.00 52.55 51.78 2phx s ASP 130 Cb -0.21 -1.96 0.14 0.00 -1.46 0.00 0.00 42.92 39.43 2phx s ASP 130 CO -0.08 -0.20 1.14 0.35 0.52 0.00 0.00 175.17 176.90 2phx n THR 131 N 4.95 0.00 -4.23 1.71 -2.24 -1.10 -1.88 114.28 111.49 2phx n THR 131 Ca -0.14 -0.47 -0.23 0.00 -2.27 0.00 0.00 64.05 60.95 2phx n THR 131 Cb 0.49 1.41 -0.17 0.00 -2.10 0.00 0.00 70.33 69.96 2phx n THR 131 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2phx s PHE 132 N -1.84 1.08 -0.01 4.78 5.36 -1.25 -4.79 117.98 121.30 2phx s PHE 132 Ca 0.23 -0.39 0.05 0.00 -0.96 0.00 0.00 56.93 55.87 2phx s PHE 132 Cb 0.17 -0.89 0.09 0.00 -0.34 0.00 0.00 43.02 42.05 2phx s PHE 132 CO 0.30 -0.28 1.04 2.48 -1.46 0.00 0.00 175.22 177.30 2phx n TYR 133 N 4.20 0.00 -1.63 10.12 4.11 -1.26 -4.97 117.16 127.73 2phx n TYR 133 Ca -0.21 -0.15 -0.51 0.00 -0.00 0.00 0.00 57.90 57.03 2phx n TYR 133 Cb 0.51 -0.07 -0.06 0.00 -0.00 0.00 0.00 39.34 39.72 2phx n TYR 133 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2phx n ALA 134 N -0.01 -0.17 0.48 -3.48 0.00 -1.26 -4.76 120.51 111.32 2phx n ALA 134 Ca 0.02 0.47 0.09 0.00 0.00 0.00 0.00 53.44 54.02 2phx n ALA 134 Cb 0.77 -2.19 0.38 0.00 0.00 0.00 0.00 19.45 18.40 2phx n ALA 134 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2phx n GLN 135 N 3.39 0.07 0.08 0.00 1.13 -1.26 -0.68 117.38 120.10 2phx n GLN 135 Ca 0.19 0.30 -0.18 0.00 -1.94 0.00 0.00 57.00 55.38 2phx n GLN 135 Cb 0.21 -1.62 -0.10 0.00 0.11 0.00 0.00 30.24 28.84 2phx n GLN 135 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 2phx h ASP 136 N 0.00 0.67 0.00 1.08 2.03 -1.98 -3.34 116.42 114.88 2phx h ASP 136 Ca 0.00 -0.60 -0.27 0.00 -0.73 0.00 0.00 57.03 55.44 2phx h ASP 136 Cb 0.30 -0.21 -0.05 0.00 -0.83 0.00 0.00 39.33 38.54 2phx h ASP 136 CO 0.00 1.41 -2.01 -1.54 -1.03 0.00 0.00 179.24 176.08 2phx n SER 137 N -3.74 1.48 -3.52 4.15 3.41 -1.15 -4.66 113.62 109.59 2phx n SER 137 Ca -0.10 -0.01 -0.33 0.00 -0.26 0.00 0.00 58.87 58.17 2phx n SER 137 Cb 0.92 0.78 -0.03 0.00 -0.26 0.00 0.00 64.21 65.62 2phx n SER 137 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2phx n ASN 138 N -2.58 5.17 0.29 4.04 5.03 0.14 -4.88 115.26 122.48 2phx n ASN 138 Ca -0.24 -3.52 0.19 0.00 0.87 0.00 0.00 54.58 51.87 2phx n ASN 138 Cb 0.97 -0.88 0.91 0.00 -1.02 0.00 0.00 39.78 39.76 2phx n ASN 138 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 2phx h THR 139 N 3.06 0.00 0.00 3.41 1.35 -1.76 -2.49 112.91 116.49 2phx h THR 139 Ca 0.23 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2phx h THR 139 Cb 0.57 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 2phx h THR 139 CO 1.02 0.00 -0.33 -2.67 -0.25 0.00 0.00 175.52 173.29 2phx n TRP 140 N -2.99 0.49 -2.86 4.73 2.14 -1.26 -4.94 117.44 112.75 2phx n TRP 140 Ca -0.01 0.14 -0.32 0.00 2.07 0.00 0.00 57.50 59.39 2phx n TRP 140 Cb 0.18 -0.65 -0.05 0.00 -0.81 0.00 0.00 31.31 29.98 2phx n TRP 140 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2phx s ASP 141 N -3.93 6.67 0.81 -0.67 1.01 -0.94 -4.76 116.67 114.86 2phx s ASP 141 Ca 0.09 1.33 -0.11 0.00 0.71 0.00 0.00 52.55 54.57 2phx s ASP 141 Cb 0.15 -2.40 0.07 0.00 1.01 0.00 0.00 42.92 41.75 2phx s ASP 141 CO 0.65 -0.37 1.09 -2.16 0.21 0.00 0.00 175.17 174.60 2phx s PRO 142 N -3.53 2.01 -1.15 8.23 0.04 -1.26 -4.91 135.00 134.43 2phx s PRO 142 Ca 0.55 0.80 -0.06 0.00 0.04 0.00 0.00 61.00 62.33 2phx s PRO 142 Cb -0.10 -1.90 0.06 0.00 0.04 0.00 0.00 34.50 32.60 2phx s PRO 142 CO 0.25 -1.72 2.60 -1.71 0.04 0.00 0.00 177.00 176.46 2phx n ASN 143 N -3.52 7.74 -3.58 6.66 5.15 -1.26 -4.85 115.26 121.60 2phx n ASN 143 Ca 0.07 -3.04 -0.05 0.00 -0.60 0.00 0.00 54.58 50.97 2phx n ASN 143 Cb 0.55 -1.37 -0.02 0.00 -0.53 0.00 0.00 39.78 38.41 2phx n ASN 143 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 2phx s TYR 144 N -0.68 -0.17 0.57 1.20 -0.85 -1.26 -5.10 117.35 111.07 2phx s TYR 144 Ca 0.58 0.09 -0.20 0.00 -0.52 0.00 0.00 57.07 57.02 2phx s TYR 144 Cb 0.23 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 43.05 2phx s TYR 144 CO -0.11 -0.28 1.29 -2.14 -1.52 0.00 0.00 175.55 172.78 2phx s PRO 145 N -2.57 3.02 0.17 -3.49 0.02 -1.26 -4.87 135.00 126.03 2phx s PRO 145 Ca 0.09 2.05 -0.22 0.00 0.02 0.00 0.00 61.00 62.93 2phx s PRO 145 Cb -0.01 -2.09 0.06 0.00 0.02 0.00 0.00 34.50 32.48 2phx s PRO 145 CO -0.05 -1.23 0.60 -3.38 -0.33 0.00 0.00 177.00 172.61 2phx s HIS 146 N -1.42 -0.47 -0.12 6.54 -3.43 -0.79 -1.70 115.29 113.91 2phx s HIS 146 Ca 0.75 0.22 -0.04 0.00 -0.80 0.00 0.00 55.06 55.18 2phx s HIS 146 Cb -0.36 0.56 -0.04 0.00 -1.43 0.00 0.00 32.58 31.31 2phx s HIS 146 CO 0.41 -0.89 0.04 0.42 -2.00 0.00 0.00 174.74 172.72 2phx s ILE 147 N -3.78 4.67 0.03 -5.38 1.01 -0.62 -1.22 121.20 115.92 2phx s ILE 147 Ca 0.03 -0.10 -0.00 0.00 0.00 0.00 0.00 60.65 60.57 2phx s ILE 147 Cb -0.01 -3.02 -0.03 0.00 0.01 0.00 0.00 42.46 39.41 2phx s ILE 147 CO -0.10 0.57 -0.03 -0.83 0.00 0.00 0.00 174.94 174.55 2phx s GLY 148 N -0.56 0.35 -0.23 6.18 0.00 -0.26 -1.42 107.32 111.39 2phx s GLY 148 Ca 0.10 -0.86 -0.08 0.00 0.00 0.00 0.00 44.72 43.88 2phx s GLY 148 CO 0.02 -0.95 0.08 -0.42 0.00 0.00 0.00 173.10 171.83 2phx s ILE 149 N -2.53 4.62 -0.18 0.90 1.01 -0.44 -0.67 121.20 123.91 2phx s ILE 149 Ca -0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 60.65 60.48 2phx s ILE 149 Cb -0.02 -3.14 -0.02 0.00 0.01 0.00 0.00 42.46 39.30 2phx s ILE 149 CO -0.05 0.37 -0.05 -1.81 0.00 0.00 0.00 174.94 173.40 2phx s ASP 150 N 1.16 4.47 -0.33 3.58 -0.00 0.63 -1.30 116.67 124.88 2phx s ASP 150 Ca 0.05 -0.28 0.02 0.00 -0.00 0.00 0.00 52.55 52.34 2phx s ASP 150 Cb -0.14 -1.74 0.10 0.00 -0.00 0.00 0.00 42.92 41.14 2phx s ASP 150 CO 0.04 0.08 0.08 -0.69 -0.00 0.00 0.00 175.17 174.67 2phx s VAL 151 N 0.88 1.69 -1.14 -1.27 1.01 -1.26 -0.89 120.40 119.43 2phx s VAL 151 Ca -0.01 -1.98 0.00 0.00 0.00 0.00 0.00 61.98 59.99 2phx s VAL 151 Cb -0.15 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 33.97 2phx s VAL 151 CO 0.01 -0.64 0.00 0.59 0.00 0.00 0.00 175.10 175.06 2phx n ASN 152 N 4.46 -5.14 -3.54 3.32 3.02 -0.37 -4.95 115.26 112.05 2phx n ASN 152 Ca 0.02 0.27 -0.17 0.00 -0.03 0.00 0.00 54.58 54.66 2phx n ASN 152 Cb 0.42 -3.59 -0.06 0.00 -0.61 0.00 0.00 39.78 35.94 2phx n ASN 152 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2phx s SER 153 N -2.53 -0.64 0.16 6.41 0.15 -1.26 -3.88 113.70 112.10 2phx s SER 153 Ca 0.00 0.75 0.24 0.00 0.70 0.00 0.00 55.95 57.64 2phx s SER 153 Cb 0.00 0.61 0.91 0.00 -1.71 0.00 0.00 66.02 65.83 2phx s SER 153 CO 0.00 -0.56 1.73 0.00 1.20 0.00 0.00 173.24 175.60 2phx n ILE 154 N 1.11 0.64 -2.95 6.45 0.13 -0.22 -4.38 119.36 120.15 2phx n ILE 154 Ca -0.19 0.03 -0.43 0.00 -1.10 0.00 0.00 62.75 61.06 2phx n ILE 154 Cb 0.57 -0.84 -0.04 0.00 -0.84 0.00 0.00 39.64 38.49 2phx n ILE 154 CO 0.00 0.00 0.00 -0.60 2.80 0.00 0.00 176.55 178.75 2phx s ARG 155 N -3.14 3.13 0.33 9.51 3.52 -1.26 -4.91 118.95 126.13 2phx s ARG 155 Ca 0.08 -0.84 -0.28 0.00 -0.13 0.00 0.00 55.73 54.56 2phx s ARG 155 Cb 0.12 -4.19 -0.13 0.00 -1.56 0.00 0.00 34.95 29.19 2phx s ARG 155 CO 0.46 -1.63 1.13 0.43 -0.81 0.00 0.00 175.30 174.88 2phx n SER 156 N 7.19 1.91 0.23 -2.12 7.64 -1.26 -4.80 113.62 122.41 2phx n SER 156 Ca -0.04 1.17 0.13 0.00 1.01 0.00 0.00 58.87 61.14 2phx n SER 156 Cb 0.45 -1.38 0.34 0.00 -1.01 0.00 0.00 64.21 62.61 2phx n SER 156 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 2phx h VAL 157 N 2.16 0.10 -2.42 0.44 -1.51 -1.54 -3.45 116.25 110.02 2phx h VAL 157 Ca -0.43 -0.94 -0.08 0.00 -1.23 0.00 0.00 66.70 64.02 2phx h VAL 157 Cb 1.32 1.86 -0.23 0.00 -2.13 0.00 0.00 31.29 32.10 2phx h VAL 157 CO 0.61 0.05 -0.11 -0.75 -1.23 0.00 0.00 177.57 176.13 2phx s LYS 158 N -3.37 0.59 0.13 5.19 2.47 -1.24 -5.02 119.74 118.50 2phx s LYS 158 Ca 0.05 0.81 0.02 0.00 -1.56 0.00 0.00 55.97 55.29 2phx s LYS 158 Cb 0.07 0.22 -0.04 0.00 -1.46 0.00 0.00 37.83 36.62 2phx s LYS 158 CO 0.63 -0.10 -0.04 0.95 0.16 0.00 0.00 175.35 176.96 2phx s THR 159 N 0.67 0.69 -0.00 3.43 -4.23 -1.26 -1.33 115.64 113.61 2phx s THR 159 Ca -0.03 -1.96 0.01 0.00 -1.18 0.00 0.00 61.69 58.53 2phx s THR 159 Cb -0.05 -1.87 -0.00 0.00 1.34 0.00 0.00 72.50 71.91 2phx s THR 159 CO -0.04 -0.70 -0.05 0.54 -0.54 0.00 0.00 174.62 173.83 2phx s VAL 160 N -3.64 0.35 0.36 2.29 0.11 -0.51 -4.98 120.40 114.39 2phx s VAL 160 Ca 0.17 -0.24 -0.28 0.00 -2.93 0.00 0.00 61.98 58.70 2phx s VAL 160 Cb 0.05 -0.31 -0.11 0.00 -1.53 0.00 0.00 36.38 34.49 2phx s VAL 160 CO -0.01 0.06 1.42 -0.75 -3.33 0.00 0.00 175.10 172.49 2phx s LYS 161 N -0.20 4.21 0.09 1.54 2.20 -1.26 -1.58 119.74 124.74 2phx s LYS 161 Ca 0.01 2.43 0.02 0.00 -0.36 0.00 0.00 55.97 58.07 2phx s LYS 161 Cb -0.02 -3.01 -0.04 0.00 -1.51 0.00 0.00 37.83 33.25 2phx s LYS 161 CO -0.00 -0.40 -0.07 -0.46 -0.36 0.00 0.00 175.35 174.06 2phx s TRP 162 N -1.12 0.89 -0.15 4.03 -0.00 -0.69 -4.80 118.94 117.11 2phx s TRP 162 Ca 0.51 -0.82 -0.01 0.00 -0.00 0.00 0.00 56.10 55.78 2phx s TRP 162 Cb -0.44 -0.51 -0.01 0.00 -0.00 0.00 0.00 33.47 32.51 2phx s TRP 162 CO 0.59 -0.11 -0.11 -0.51 -0.00 0.00 0.00 176.95 176.81 2phx s ASP 163 N -2.77 4.10 0.01 5.86 1.01 -1.26 -4.40 116.67 119.22 2phx s ASP 163 Ca 0.08 -0.34 -0.24 0.00 0.71 0.00 0.00 52.55 52.76 2phx s ASP 163 Cb 0.02 -1.65 -0.05 0.00 1.01 0.00 0.00 42.92 42.25 2phx s ASP 163 CO -0.03 0.12 0.73 -0.60 0.21 0.00 0.00 175.17 175.59 2phx s ARG 164 N 0.65 4.46 -0.20 8.23 3.52 -1.26 -5.04 118.95 129.30 2phx s ARG 164 Ca -0.06 0.98 0.00 0.00 -0.13 0.00 0.00 55.73 56.53 2phx s ARG 164 Cb -0.15 -3.38 0.05 0.00 -1.56 0.00 0.00 34.95 29.91 2phx s ARG 164 CO 0.03 0.25 -0.07 1.03 -0.81 0.00 0.00 175.30 175.73 2phx s ARG 165 N 0.11 1.67 0.15 5.12 0.52 -1.26 -5.09 118.95 120.15 2phx s ARG 165 Ca 0.37 -0.80 -0.33 0.00 -0.52 0.00 0.00 55.73 54.45 2phx s ARG 165 Cb -0.20 -2.37 -0.13 0.00 0.52 0.00 0.00 34.95 32.77 2phx s ARG 165 CO 0.21 -0.50 1.66 -3.47 0.02 0.00 0.00 175.30 173.22 2phx n ASP 166 N 4.74 3.40 0.00 0.23 2.03 -1.26 -2.54 116.55 123.15 2phx n ASP 166 Ca -0.13 1.06 0.00 0.00 0.52 0.00 0.00 54.79 56.24 2phx n ASP 166 Cb 0.46 -1.46 0.00 0.00 -0.72 0.00 0.00 41.12 39.39 2phx n ASP 166 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2phx n GLY 167 N 3.69 0.54 3.76 0.27 0.00 0.13 -5.00 105.19 108.57 2phx n GLY 167 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2phx n GLY 167 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2phx s GLN 168 N -0.48 3.76 0.23 1.61 -0.21 -1.05 -4.90 119.66 118.61 2phx s GLN 168 Ca 0.00 -0.23 -0.30 0.00 0.02 0.00 0.00 55.36 54.85 2phx s GLN 168 Cb 0.00 -3.23 -0.09 0.00 1.00 0.00 0.00 33.01 30.69 2phx s GLN 168 CO 0.00 0.50 1.13 -1.12 -2.12 0.00 0.00 175.29 173.69 2phx s SER 169 N -0.26 7.20 -0.17 5.90 0.01 -1.26 -4.52 113.70 120.61 2phx s SER 169 Ca 0.10 2.22 -0.04 0.00 1.31 0.00 0.00 55.95 59.54 2phx s SER 169 Cb -0.12 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 63.47 2phx s SER 169 CO 0.01 -0.24 -0.03 -0.22 0.41 0.00 0.00 173.24 173.17 2phx s LEU 170 N -0.81 3.19 -0.18 2.44 2.96 -0.05 -4.35 118.68 121.87 2phx s LEU 170 Ca 0.48 -0.18 -0.14 0.00 -0.22 0.00 0.00 54.13 54.08 2phx s LEU 170 Cb -0.32 -1.78 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 2phx s LEU 170 CO 0.38 0.13 0.28 0.20 -1.32 0.00 0.00 176.35 176.03 2phx s ASN 171 N 0.61 6.37 -0.02 3.68 0.01 -0.32 -2.21 114.94 123.05 2phx s ASN 171 Ca -0.02 0.43 0.06 0.00 -0.71 0.00 0.00 52.86 52.62 2phx s ASN 171 Cb -0.14 -2.17 -0.01 0.00 0.41 0.00 0.00 41.25 39.33 2phx s ASN 171 CO 0.02 0.06 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.78 2phx s VAL 172 N 0.73 1.61 -0.14 1.60 1.01 0.74 -0.54 120.40 125.40 2phx s VAL 172 Ca 0.15 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.29 2phx s VAL 172 Cb -0.13 -1.34 0.02 0.00 0.00 0.00 0.00 36.38 34.92 2phx s VAL 172 CO 0.04 0.45 -0.18 -0.22 0.00 0.00 0.00 175.10 175.20 2phx s LEU 173 N -0.36 1.90 -0.13 3.92 2.96 0.11 -1.36 118.68 125.72 2phx s LEU 173 Ca 0.05 -0.53 0.02 0.00 -0.22 0.00 0.00 54.13 53.45 2phx s LEU 173 Cb -0.09 -1.28 -0.00 0.00 0.50 0.00 0.00 46.19 45.32 2phx s LEU 173 CO 0.00 0.02 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.17 2phx s VAL 174 N 1.07 2.37 0.03 1.68 1.01 0.08 -1.37 120.40 125.27 2phx s VAL 174 Ca -0.03 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.10 2phx s VAL 174 Cb -0.14 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.26 2phx s VAL 174 CO -0.05 0.54 -0.12 -0.89 0.00 0.00 0.00 175.10 174.58 2phx s THR 175 N 0.58 0.97 -0.09 3.92 2.01 0.02 -0.72 115.64 122.33 2phx s THR 175 Ca -0.11 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.06 2phx s THR 175 Cb -0.16 -0.87 0.02 0.00 0.01 0.00 0.00 72.50 71.49 2phx s THR 175 CO 0.04 0.04 -0.12 0.12 -0.69 0.00 0.00 174.62 174.01 2phx s PHE 176 N -0.72 1.60 -0.27 4.92 5.36 -0.38 -0.14 117.98 128.36 2phx s PHE 176 Ca 0.01 -0.70 -0.03 0.00 -0.96 0.00 0.00 56.93 55.25 2phx s PHE 176 Cb -0.07 -1.21 0.02 0.00 -0.34 0.00 0.00 43.02 41.43 2phx s PHE 176 CO 0.01 -0.40 -0.01 1.21 -1.46 0.00 0.00 175.22 174.57 2phx s ASN 177 N 1.06 4.66 0.54 6.13 3.84 -0.85 -2.27 114.94 128.04 2phx s ASN 177 Ca -0.07 -0.85 0.32 0.00 0.21 0.00 0.00 52.86 52.47 2phx s ASN 177 Cb -0.15 -1.74 1.45 0.00 -0.55 0.00 0.00 41.25 40.26 2phx s ASN 177 CO -0.01 -0.16 2.03 1.55 -2.79 0.00 0.00 177.10 177.71 2phx h PRO 178 N 8.09 0.00 -0.19 0.43 0.13 -1.88 0.53 132.00 139.11 2phx h PRO 178 Ca -0.31 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.78 2phx h PRO 178 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 2phx h PRO 178 CO 0.58 0.08 -0.02 1.03 -0.23 0.00 0.00 178.00 179.44 2phx h SER 179 N 0.00 0.34 0.03 1.44 0.87 -1.94 -3.28 113.55 111.00 2phx h SER 179 Ca -0.00 -0.34 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 2phx h SER 179 Cb 0.44 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.31 2phx h SER 179 CO 0.01 0.59 -1.13 0.35 -0.53 0.00 0.00 176.83 176.12 2phx n THR 180 N -4.68 0.00 -1.40 2.23 -2.24 -1.14 -4.97 114.28 102.07 2phx n THR 180 Ca -0.05 -0.08 -0.14 0.00 -2.27 0.00 0.00 64.05 61.51 2phx n THR 180 Cb 0.25 0.81 -0.06 0.00 -2.10 0.00 0.00 70.33 69.23 2phx n THR 180 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2phx n ARG 181 N -1.62 -1.15 -3.19 -0.78 1.74 0.18 -4.90 116.66 106.94 2phx n ARG 181 Ca 0.03 0.98 -0.39 0.00 -0.77 0.00 0.00 57.85 57.69 2phx n ARG 181 Cb 0.37 -5.14 -0.06 0.00 -1.02 0.00 0.00 32.46 26.61 2phx n ARG 181 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2phx s ASN 182 N -2.73 6.69 -0.34 0.55 0.01 -1.15 -0.54 114.94 117.41 2phx s ASN 182 Ca 0.00 0.83 -0.12 0.00 -0.71 0.00 0.00 52.86 52.85 2phx s ASN 182 Cb 0.00 -2.33 -0.01 0.00 0.41 0.00 0.00 41.25 39.32 2phx s ASN 182 CO 0.00 -0.17 0.23 -0.22 -1.51 0.00 0.00 177.10 175.43 2phx s LEU 183 N 1.42 4.51 -0.05 0.60 0.20 0.23 -2.01 118.68 123.58 2phx s LEU 183 Ca 0.28 -0.50 0.02 0.00 0.69 0.00 0.00 54.13 54.61 2phx s LEU 183 Cb -0.16 -2.11 -0.03 0.00 -0.43 0.00 0.00 46.19 43.46 2phx s LEU 183 CO 0.11 -0.25 -0.09 -1.81 -0.29 0.00 0.00 176.35 174.02 2phx s ASP 184 N 1.69 4.47 -0.09 3.68 1.01 0.81 -1.54 116.67 126.70 2phx s ASP 184 Ca 0.06 -0.09 0.02 0.00 0.71 0.00 0.00 52.55 53.25 2phx s ASP 184 Cb -0.18 -1.07 0.01 0.00 1.01 0.00 0.00 42.92 42.70 2phx s ASP 184 CO 0.10 0.35 -0.13 -0.69 0.21 0.00 0.00 175.17 175.00 2phx s VAL 185 N -0.81 1.31 -0.10 -1.27 1.01 0.44 -0.80 120.40 120.18 2phx s VAL 185 Ca 0.13 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.57 2phx s VAL 185 Cb -0.11 -1.21 0.02 0.00 0.00 0.00 0.00 36.38 35.08 2phx s VAL 185 CO 0.02 0.40 -0.10 -0.69 0.00 0.00 0.00 175.10 174.73 2phx s VAL 186 N 0.93 1.09 -0.04 2.92 1.01 -0.47 -1.67 120.40 124.17 2phx s VAL 186 Ca -0.09 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.57 2phx s VAL 186 Cb -0.15 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.16 2phx s VAL 186 CO 0.00 0.37 -0.19 0.00 0.00 0.00 0.00 175.10 175.28 2phx s ALA 187 N 1.32 1.62 0.00 5.51 0.00 -0.01 -0.71 121.76 129.49 2phx s ALA 187 Ca -0.02 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.17 2phx s ALA 187 Cb -0.14 -0.49 -0.01 0.00 0.00 0.00 0.00 23.12 22.49 2phx s ALA 187 CO -0.04 0.33 -0.02 0.99 0.00 0.00 0.00 175.76 177.02 2phx s THR 188 N -0.15 0.15 0.50 0.00 2.01 0.29 -0.62 115.64 117.83 2phx s THR 188 Ca -0.00 -0.25 0.00 0.00 0.31 0.00 0.00 61.69 61.75 2phx s THR 188 Cb -0.10 -0.17 0.01 0.00 0.01 0.00 0.00 72.50 72.25 2phx s THR 188 CO 0.01 -0.06 0.73 -0.31 -0.69 0.00 0.00 174.62 174.30 2phx s TYR 189 N -0.32 3.08 0.58 4.92 1.51 -0.29 -1.17 117.35 125.65 2phx s TYR 189 Ca -0.02 0.16 0.33 0.00 -1.01 0.00 0.00 57.07 56.53 2phx s TYR 189 Cb -0.03 -2.51 1.92 0.00 -0.11 0.00 0.00 41.96 41.23 2phx s TYR 189 CO -0.00 -0.59 2.26 0.66 -1.11 0.00 0.00 175.55 176.76 2phx h SER 190 N 0.23 0.00 -0.03 2.29 4.64 -1.90 -1.19 113.55 117.59 2phx h SER 190 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2phx h SER 190 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2phx h SER 190 CO 0.55 0.02 0.00 -0.90 -0.87 0.00 0.00 176.83 175.63 2phx n ASP 191 N -3.62 0.38 0.00 4.97 5.68 -1.26 -4.88 116.55 117.82 2phx n ASP 191 Ca -0.03 -1.44 0.00 0.00 -0.50 0.00 0.00 54.79 52.82 2phx n ASP 191 Cb 0.10 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.06 2phx n ASP 191 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2phx n GLY 192 N 0.89 0.68 3.70 6.12 0.00 -0.45 -5.04 105.19 111.10 2phx n GLY 192 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2phx n GLY 192 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2phx s THR 193 N -2.47 2.95 0.04 2.61 2.01 -1.25 -4.81 115.64 114.73 2phx s THR 193 Ca 0.00 0.56 0.07 0.00 0.31 0.00 0.00 61.69 62.64 2phx s THR 193 Cb 0.00 -3.36 -0.03 0.00 0.01 0.00 0.00 72.50 69.12 2phx s THR 193 CO 0.00 0.02 -0.21 -0.60 -0.69 0.00 0.00 174.62 173.14 2phx s ARG 194 N 1.86 1.44 -0.01 4.92 3.52 -1.26 -1.14 118.95 128.28 2phx s ARG 194 Ca 0.71 -0.95 0.03 0.00 -0.13 0.00 0.00 55.73 55.39 2phx s ARG 194 Cb -0.40 -1.55 -0.01 0.00 -1.56 0.00 0.00 34.95 31.42 2phx s ARG 194 CO 0.31 0.40 -0.10 0.71 -0.81 0.00 0.00 175.30 175.81 2phx s TYR 195 N -0.79 0.90 0.00 5.12 1.51 0.21 -4.98 117.35 119.32 2phx s TYR 195 Ca 0.08 -0.17 0.01 0.00 -1.01 0.00 0.00 57.07 55.98 2phx s TYR 195 Cb -0.09 -0.58 -0.01 0.00 -0.11 0.00 0.00 41.96 41.18 2phx s TYR 195 CO 0.02 -0.02 -0.03 -1.21 -1.11 0.00 0.00 175.55 173.20 2phx s GLU 196 N -0.24 0.26 -0.11 -0.62 2.02 -1.26 -0.83 118.70 117.92 2phx s GLU 196 Ca 0.04 -0.21 -0.13 0.00 0.02 0.00 0.00 54.97 54.69 2phx s GLU 196 Cb -0.04 -0.20 0.03 0.00 0.10 0.00 0.00 34.13 34.02 2phx s GLU 196 CO -0.00 0.05 0.35 0.14 0.02 0.00 0.00 175.26 175.82 2phx s VAL 197 N -0.31 0.01 0.05 2.63 -7.23 -0.67 -4.88 120.40 110.00 2phx s VAL 197 Ca -0.01 -0.10 -0.05 0.00 -1.81 0.00 0.00 61.98 60.00 2phx s VAL 197 Cb -0.03 -0.53 -0.02 0.00 0.56 0.00 0.00 36.38 36.36 2phx s VAL 197 CO -0.00 -0.06 0.08 -0.55 -0.31 0.00 0.00 175.10 174.27 2phx s SER 198 N -0.15 0.23 -0.12 4.85 0.15 -1.26 -0.42 113.70 116.98 2phx s SER 198 Ca -0.03 -0.64 -0.21 0.00 0.70 0.00 0.00 55.95 55.77 2phx s SER 198 Cb -0.03 0.24 0.05 0.00 -1.71 0.00 0.00 66.02 64.56 2phx s SER 198 CO 0.01 -0.55 0.52 -0.47 1.20 0.00 0.00 173.24 173.95 2phx s TYR 199 N -3.01 -0.51 -0.19 3.44 6.14 -0.59 -4.98 117.35 117.65 2phx s TYR 199 Ca -0.02 1.07 -0.18 0.00 0.64 0.00 0.00 57.07 58.58 2phx s TYR 199 Cb 0.01 0.23 -0.03 0.00 0.42 0.00 0.00 41.96 42.59 2phx s TYR 199 CO -0.06 -0.40 0.51 -2.00 0.64 0.00 0.00 175.55 174.24 2phx s GLU 200 N -0.50 4.22 -0.06 4.97 2.12 -1.26 -0.60 118.70 127.58 2phx s GLU 200 Ca -0.06 0.42 -0.03 0.00 0.36 0.00 0.00 54.97 55.65 2phx s GLU 200 Cb -0.03 -3.54 0.03 0.00 0.26 0.00 0.00 34.13 30.85 2phx s GLU 200 CO 0.04 -0.09 0.14 0.08 -0.54 0.00 0.00 175.26 174.89 2phx s VAL 201 N 1.46 -0.03 -0.61 3.70 1.01 0.29 -4.98 120.40 121.24 2phx s VAL 201 Ca 0.24 0.12 -0.20 0.00 0.00 0.00 0.00 61.98 62.14 2phx s VAL 201 Cb -0.15 -0.23 0.08 0.00 0.00 0.00 0.00 36.38 36.09 2phx s VAL 201 CO 0.10 0.05 0.80 -0.62 0.00 0.00 0.00 175.10 175.42 2phx s ASP 202 N 0.82 6.19 0.60 3.32 -1.08 -1.26 -4.73 116.67 120.52 2phx s ASP 202 Ca -0.06 -1.18 0.32 0.00 -0.52 0.00 0.00 52.55 51.11 2phx s ASP 202 Cb -0.08 -2.35 1.91 0.00 -1.46 0.00 0.00 42.92 40.94 2phx s ASP 202 CO -0.04 -1.21 2.26 0.58 0.52 0.00 0.00 175.17 177.28 2phx h VAL 203 N 5.94 0.43 0.00 1.11 2.07 -1.97 -2.15 116.25 121.68 2phx h VAL 203 Ca -0.29 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 2phx h VAL 203 Cb 1.08 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2phx h VAL 203 CO 1.12 0.01 -0.08 0.03 0.02 0.00 0.00 177.57 178.67 2phx h ARG 204 N 0.00 0.00 -0.04 1.57 3.08 -1.90 -1.46 114.38 115.62 2phx h ARG 204 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2phx h ARG 204 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 2phx h ARG 204 CO 0.00 0.08 0.00 -1.13 -1.07 0.00 0.00 179.97 177.85 2phx n SER 205 N -3.69 2.15 -0.03 7.04 3.41 -0.81 -4.44 113.62 117.25 2phx n SER 205 Ca -0.02 -1.72 -0.05 0.00 -0.26 0.00 0.00 58.87 56.82 2phx n SER 205 Cb 0.19 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 2phx n SER 205 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2phx n VAL 206 N 0.68 0.38 -4.47 -3.33 0.31 -0.87 -5.08 118.33 105.94 2phx n VAL 206 Ca 0.17 -0.14 -0.24 0.00 -0.01 0.00 0.00 64.34 64.12 2phx n VAL 206 Cb 0.46 -0.76 -0.10 0.00 -0.91 0.00 0.00 33.84 32.53 2phx n VAL 206 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2phx s LEU 207 N -5.41 2.61 0.94 7.52 1.43 -0.61 -4.62 118.68 120.54 2phx s LEU 207 Ca -0.09 -1.04 -0.13 0.00 -1.03 0.00 0.00 54.13 51.84 2phx s LEU 207 Cb 0.02 -1.10 0.16 0.00 0.03 0.00 0.00 46.19 45.30 2phx s LEU 207 CO 0.15 0.02 1.14 -2.16 0.23 0.00 0.00 176.35 175.72 2phx s PRO 208 N -3.52 0.88 0.33 1.29 0.04 -1.26 -4.68 135.00 128.08 2phx s PRO 208 Ca 0.30 0.28 0.01 0.00 0.04 0.00 0.00 61.00 61.63 2phx s PRO 208 Cb -0.04 -1.81 0.56 0.00 0.04 0.00 0.00 34.50 33.25 2phx s PRO 208 CO 0.15 -2.37 1.97 0.93 0.04 0.00 0.00 177.00 177.72 2phx h GLU 209 N -1.63 0.86 -5.84 4.56 5.08 -1.96 -3.42 114.58 112.25 2phx h GLU 209 Ca -0.51 -0.07 -0.67 0.00 -1.00 0.00 0.00 59.36 57.10 2phx h GLU 209 Cb 1.33 -0.18 -0.24 0.00 0.50 0.00 0.00 28.75 30.15 2phx h GLU 209 CO 0.59 0.61 -0.75 -1.58 -1.00 0.00 0.00 179.01 176.88 2phx s TRP 210 N -5.65 2.79 0.24 4.33 0.52 -1.26 -0.45 118.94 119.46 2phx s TRP 210 Ca -0.10 -0.34 0.01 0.00 0.02 0.00 0.00 56.10 55.70 2phx s TRP 210 Cb 0.17 -1.74 -0.04 0.00 -1.15 0.00 0.00 33.47 30.71 2phx s TRP 210 CO 0.77 0.03 0.17 0.14 0.02 0.00 0.00 176.95 178.09 2phx s VAL 211 N -0.24 0.02 0.16 4.03 -7.23 -0.45 -4.30 120.40 112.37 2phx s VAL 211 Ca 0.02 -2.00 0.11 0.00 -1.81 0.00 0.00 61.98 58.30 2phx s VAL 211 Cb -0.13 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 2phx s VAL 211 CO 0.03 0.00 -0.25 -0.13 -0.31 0.00 0.00 175.10 174.44 2phx s ARG 212 N -3.95 1.43 0.13 4.82 0.52 0.07 -0.45 118.95 121.52 2phx s ARG 212 Ca 0.39 -1.42 0.11 0.00 -0.52 0.00 0.00 55.73 54.29 2phx s ARG 212 Cb 0.06 -1.82 -0.04 0.00 0.52 0.00 0.00 34.95 33.66 2phx s ARG 212 CO 0.17 0.41 -0.26 0.14 0.02 0.00 0.00 175.30 175.78 2phx s VAL 213 N -1.38 2.22 0.00 3.52 -7.23 -1.26 -1.71 120.40 114.56 2phx s VAL 213 Ca 0.17 -1.76 0.00 0.00 -1.81 0.00 0.00 61.98 58.57 2phx s VAL 213 Cb -0.09 -1.97 0.00 0.00 0.56 0.00 0.00 36.38 34.88 2phx s VAL 213 CO 0.08 0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.54 2phx n GLY 214 N 0.88 1.06 3.08 2.32 0.00 -0.43 -1.72 105.19 110.37 2phx n GLY 214 Ca -0.18 -0.55 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 2phx n GLY 214 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2phx s PHE 215 N -1.91 0.67 0.02 1.61 0.40 -0.43 -0.85 117.98 117.48 2phx s PHE 215 Ca 0.00 -0.62 -0.01 0.00 -0.60 0.00 0.00 56.93 55.70 2phx s PHE 215 Cb 0.00 -0.40 -0.02 0.00 0.51 0.00 0.00 43.02 43.11 2phx s PHE 215 CO 0.00 -0.12 -0.01 0.45 0.70 0.00 0.00 175.22 176.24 2phx s SER 216 N -1.94 0.20 0.08 1.36 0.15 -0.13 -1.39 113.70 112.03 2phx s SER 216 Ca -0.05 -0.42 -0.18 0.00 0.70 0.00 0.00 55.95 55.99 2phx s SER 216 Cb -0.06 0.11 0.04 0.00 -1.71 0.00 0.00 66.02 64.40 2phx s SER 216 CO -0.01 -0.28 0.44 0.00 1.20 0.00 0.00 173.24 174.58 2phx s ALA 217 N -1.33 -1.06 0.10 5.45 0.00 -0.55 -0.41 121.76 123.96 2phx s ALA 217 Ca -0.15 0.24 -0.18 0.00 0.00 0.00 0.00 51.96 51.88 2phx s ALA 217 Cb -0.09 0.49 0.04 0.00 0.00 0.00 0.00 23.12 23.57 2phx s ALA 217 CO -0.01 -0.54 0.44 0.00 0.00 0.00 0.00 175.76 175.65 2phx s ALA 218 N -2.98 -1.07 -0.03 0.00 0.00 -1.15 -1.67 121.76 114.85 2phx s ALA 218 Ca -0.02 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.11 2phx s ALA 218 Cb 0.00 0.60 0.03 0.00 0.00 0.00 0.00 23.12 23.75 2phx s ALA 218 CO -0.06 -0.60 -0.01 -1.12 0.00 0.00 0.00 175.76 173.97 2phx s SER 219 N -2.52 0.59 0.00 0.00 0.01 0.12 -0.42 113.70 111.48 2phx s SER 219 Ca -0.00 -0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.21 2phx s SER 219 Cb 0.01 -0.27 0.00 0.00 0.21 0.00 0.00 66.02 65.96 2phx s SER 219 CO -0.09 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.08 2phx n GLY 220 N 4.17 0.48 0.14 3.44 0.00 -1.26 -1.29 105.19 110.87 2phx n GLY 220 Ca -0.25 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.74 2phx n GLY 220 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2phx h GLU 221 N 0.00 0.09 -6.10 1.61 5.08 -1.97 0.26 114.58 113.55 2phx h GLU 221 Ca 0.00 -0.07 -0.55 0.00 -1.00 0.00 0.00 59.36 57.74 2phx h GLU 221 Cb 0.00 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 2phx h GLU 221 CO 0.00 0.71 -0.41 -0.65 -1.00 0.00 0.00 179.01 177.66 2phx s GLN 222 N -3.60 3.48 0.18 2.33 -1.52 -1.26 -4.83 119.66 114.44 2phx s GLN 222 Ca -0.02 -0.45 -0.12 0.00 -1.95 0.00 0.00 55.36 52.82 2phx s GLN 222 Cb 0.12 -2.92 0.00 0.00 -0.22 0.00 0.00 33.01 29.99 2phx s GLN 222 CO 0.78 0.48 0.36 1.52 -0.25 0.00 0.00 175.29 178.19 2phx s TYR 223 N -1.75 0.25 -0.09 0.91 1.13 -1.25 -4.25 117.35 112.29 2phx s TYR 223 Ca 0.36 -0.61 -0.31 0.00 -1.41 0.00 0.00 57.07 55.10 2phx s TYR 223 Cb -0.11 0.08 0.12 0.00 -1.10 0.00 0.00 41.96 40.95 2phx s TYR 223 CO 0.28 -0.79 1.03 1.14 -2.51 0.00 0.00 175.55 174.70 2phx s GLN 224 N -3.94 0.60 0.51 -3.49 -2.07 -1.09 -3.76 119.66 106.41 2phx s GLN 224 Ca 0.15 -0.20 -0.18 0.00 -1.82 0.00 0.00 55.36 53.31 2phx s GLN 224 Cb 0.02 0.28 -0.08 0.00 -1.09 0.00 0.00 33.01 32.13 2phx s GLN 224 CO -0.00 -0.26 0.99 0.95 -1.32 0.00 0.00 175.29 175.65 2phx s THR 225 N -2.73 4.33 -0.43 3.63 -4.23 -0.15 -4.86 115.64 111.20 2phx s THR 225 Ca 0.06 1.21 0.02 0.00 -1.18 0.00 0.00 61.69 61.81 2phx s THR 225 Cb -0.01 -3.62 0.13 0.00 1.34 0.00 0.00 72.50 70.34 2phx s THR 225 CO -0.07 -0.54 0.22 -1.00 -0.54 0.00 0.00 174.62 172.68 2phx s HIS 226 N -2.45 2.25 -0.36 3.99 0.09 -1.26 -3.28 115.29 114.27 2phx s HIS 226 Ca 0.61 -2.51 -0.14 0.00 -0.00 0.00 0.00 55.06 53.02 2phx s HIS 226 Cb -0.11 -2.08 -0.01 0.00 -0.00 0.00 0.00 32.58 30.38 2phx s HIS 226 CO 0.27 -0.79 0.32 0.99 -0.00 0.00 0.00 174.74 175.52 2phx s THR 227 N 0.41 5.22 -0.28 1.30 2.01 -0.49 -1.91 115.64 121.90 2phx s THR 227 Ca 0.16 -0.19 -0.19 0.00 0.31 0.00 0.00 61.69 61.78 2phx s THR 227 Cb -0.24 -3.82 -0.02 0.00 0.01 0.00 0.00 72.50 68.44 2phx s THR 227 CO -0.03 -0.12 0.58 -0.22 -0.69 0.00 0.00 174.62 174.13 2phx s LEU 228 N 1.87 4.10 -0.14 4.42 2.96 0.08 -1.38 118.68 130.60 2phx s LEU 228 Ca 0.09 0.50 0.15 0.00 -0.22 0.00 0.00 54.13 54.64 2phx s LEU 228 Cb -0.17 -2.75 -0.24 0.00 0.50 0.00 0.00 46.19 43.53 2phx s LEU 228 CO 0.11 -0.38 0.29 -0.62 -1.32 0.00 0.00 176.35 174.43 2phx n GLU 229 N 5.70 0.67 -3.49 1.98 1.02 0.09 -1.29 120.64 125.31 2phx n GLU 229 Ca -0.02 0.12 -0.14 0.00 -0.02 0.00 0.00 57.16 57.10 2phx n GLU 229 Cb 0.49 -1.63 -0.04 0.00 -0.02 0.00 0.00 31.44 30.25 2phx n GLU 229 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2phx s SER 230 N -5.78 -0.54 -0.28 1.62 0.15 -1.21 -4.26 113.70 103.39 2phx s SER 230 Ca -0.09 0.19 -0.16 0.00 0.70 0.00 0.00 55.95 56.59 2phx s SER 230 Cb 0.07 0.55 0.11 0.00 -1.71 0.00 0.00 66.02 65.04 2phx s SER 230 CO 0.82 -0.82 0.80 0.86 1.20 0.00 0.00 173.24 176.10 2phx s TRP 231 N -2.87 -0.88 0.03 3.44 -0.00 -0.23 -2.36 118.94 116.08 2phx s TRP 231 Ca -0.03 1.75 0.05 0.00 -0.00 0.00 0.00 56.10 57.87 2phx s TRP 231 Cb -0.01 0.53 -0.02 0.00 -0.00 0.00 0.00 33.47 33.97 2phx s TRP 231 CO -0.05 -0.44 -0.14 -1.12 -0.00 0.00 0.00 176.95 175.21 2phx s SER 232 N 1.57 1.60 -0.05 5.86 0.01 0.39 0.03 113.70 123.11 2phx s SER 232 Ca -0.09 -0.43 -0.06 0.00 1.31 0.00 0.00 55.95 56.67 2phx s SER 232 Cb -0.05 -0.11 0.01 0.00 0.21 0.00 0.00 66.02 66.09 2phx s SER 232 CO -0.18 0.04 0.16 0.12 0.41 0.00 0.00 173.24 173.79 2phx s PHE 233 N -0.80 -0.14 -0.07 2.43 2.19 -0.21 -0.78 117.98 120.60 2phx s PHE 233 Ca 0.01 0.32 -0.06 0.00 0.33 0.00 0.00 56.93 57.54 2phx s PHE 233 Cb -0.08 0.04 0.02 0.00 -1.31 0.00 0.00 43.02 41.70 2phx s PHE 233 CO 0.01 -0.13 0.18 0.95 1.83 0.00 0.00 175.22 178.06 2phx s THR 234 N -0.23 -0.01 -0.00 0.12 -4.23 -0.36 -1.34 115.64 109.60 2phx s THR 234 Ca -0.03 0.04 -0.02 0.00 -1.18 0.00 0.00 61.69 60.50 2phx s THR 234 Cb -0.03 -0.26 -0.00 0.00 1.34 0.00 0.00 72.50 73.55 2phx s THR 234 CO 0.01 0.02 0.03 -0.94 -0.54 0.00 0.00 174.62 173.19 2phx s SER 235 N 0.36 0.05 -0.07 3.99 1.04 -0.27 -0.99 113.70 117.81 2phx s SER 235 Ca -0.02 -0.13 -0.03 0.00 0.48 0.00 0.00 55.95 56.25 2phx s SER 235 Cb -0.04 0.10 0.04 0.00 0.10 0.00 0.00 66.02 66.23 2phx s SER 235 CO -0.02 -0.14 0.14 -0.89 0.98 0.00 0.00 173.24 173.32 2phx s THR 236 N -0.58 -0.10 0.02 2.02 2.01 -0.57 -1.77 115.64 116.67 2phx s THR 236 Ca -0.06 0.23 -0.30 0.00 0.31 0.00 0.00 61.69 61.86 2phx s THR 236 Cb -0.04 -0.24 -0.05 0.00 0.01 0.00 0.00 72.50 72.17 2phx s THR 236 CO -0.00 0.09 1.24 -0.76 -0.69 0.00 0.00 174.62 174.50 2phx s LEU 237 N 1.44 4.34 0.08 4.42 1.43 -0.53 -1.12 118.68 128.74 2phx s LEU 237 Ca -0.06 1.99 0.06 0.00 -1.03 0.00 0.00 54.13 55.09 2phx s LEU 237 Cb -0.12 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.50 2phx s LEU 237 CO -0.06 -0.55 -0.17 -0.76 0.23 0.00 0.00 176.35 175.04 2phx s LEU 238 N 1.59 2.27 0.07 1.79 1.43 -0.85 -4.94 118.68 120.04 2phx s LEU 238 Ca 0.59 -0.62 -0.26 0.00 -1.03 0.00 0.00 54.13 52.81 2phx s LEU 238 Cb -0.29 -0.70 -0.06 0.00 0.03 0.00 0.00 46.19 45.18 2phx s LEU 238 CO 0.27 0.00 0.81 -0.31 0.23 0.00 0.00 176.35 177.35 2phx s TYR 239 N -1.16 3.77 0.00 0.29 2.02 -1.26 -2.09 117.35 118.92 2phx s TYR 239 Ca 0.02 1.56 0.00 0.00 -0.37 0.00 0.00 57.07 58.28 2phx s TYR 239 Cb -0.10 -2.87 0.00 0.00 -0.40 0.00 0.00 41.96 38.60 2phx s TYR 239 CO 0.03 0.29 0.00 2.41 -1.57 0.00 0.00 175.55 176.71