#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m2p s LEU 1 N 0.00 4.53 -0.31 2.46 1.43 -1.26 -4.89 118.68 120.64 3m2p s LEU 1 Ca 0.00 1.37 -0.19 0.00 -1.03 0.00 0.00 54.13 54.29 3m2p s LEU 1 Cb 0.00 -3.04 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 3m2p s LEU 1 CO 0.00 0.22 0.54 -0.54 0.23 0.00 0.00 176.35 176.80 3m2p s LYS 2 N -0.95 3.84 -0.21 1.70 1.02 -1.26 -0.33 119.74 123.55 3m2p s LYS 2 Ca 0.32 0.11 -0.03 0.00 0.02 0.00 0.00 55.97 56.39 3m2p s LYS 2 Cb -0.20 -3.74 -0.00 0.00 -0.52 0.00 0.00 37.83 33.37 3m2p s LYS 2 CO 0.21 -0.53 -0.07 0.42 -0.92 0.00 0.00 175.35 174.46 3m2p s ILE 3 N 2.43 3.10 -0.03 2.17 1.01 0.11 -1.19 121.20 128.80 3m2p s ILE 3 Ca 0.21 -0.58 -0.22 0.00 0.00 0.00 0.00 60.65 60.05 3m2p s ILE 3 Cb -0.15 -2.40 -0.05 0.00 0.01 0.00 0.00 42.46 39.88 3m2p s ILE 3 CO 0.12 0.45 0.66 0.00 0.00 0.00 0.00 174.94 176.17 3m2p s ALA 4 N 1.44 3.40 -0.36 9.38 0.00 -0.77 -0.34 121.76 134.51 3m2p s ALA 4 Ca 0.06 0.10 0.02 0.00 0.00 0.00 0.00 51.96 52.14 3m2p s ALA 4 Cb -0.14 -2.88 0.10 0.00 0.00 0.00 0.00 23.12 20.20 3m2p s ALA 4 CO -0.05 0.01 0.09 0.08 0.00 0.00 0.00 175.76 175.89 3m2p s VAL 5 N 0.34 2.62 0.59 0.00 1.01 -0.29 -0.41 120.40 124.27 3m2p s VAL 5 Ca 0.35 -2.18 -0.19 0.00 0.00 0.00 0.00 61.98 59.95 3m2p s VAL 5 Cb -0.18 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 3m2p s VAL 5 CO 0.18 -0.58 1.24 0.42 0.00 0.00 0.00 175.10 176.36 3m2p s THR 6 N 1.00 2.49 -1.38 3.92 -4.23 -0.70 -1.88 115.64 114.86 3m2p s THR 6 Ca 0.08 0.32 -0.06 0.00 -1.18 0.00 0.00 61.69 60.85 3m2p s THR 6 Cb -0.20 -3.13 0.03 0.00 1.34 0.00 0.00 72.50 70.54 3m2p s THR 6 CO -0.06 -0.06 0.44 0.61 -0.54 0.00 0.00 174.62 175.01 3m2p n GLY 7 N 0.60 -0.50 0.26 3.99 0.00 -1.17 -2.83 105.19 105.54 3m2p n GLY 7 Ca 0.13 0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.35 3m2p n GLY 7 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3m2p h GLY 8 N -0.95 0.00 1.37 -0.02 0.00 -1.30 -1.45 103.07 100.73 3m2p h GLY 8 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3m2p h GLY 8 CO 0.52 0.00 -0.30 -1.30 0.00 0.00 0.00 176.54 175.46 3m2p n THR 9 N -4.06 0.00 -0.22 4.70 -2.24 -1.26 -3.17 114.28 108.03 3m2p n THR 9 Ca -0.03 -0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.54 3m2p n THR 9 Cb 0.16 -0.04 0.20 0.00 -2.10 0.00 0.00 70.33 68.55 3m2p n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3m2p n GLY 10 N 1.49 -3.78 0.25 3.38 0.00 -0.55 -4.67 105.19 101.31 3m2p n GLY 10 Ca 0.06 -1.29 -0.12 0.00 0.00 0.00 0.00 46.02 44.67 3m2p n GLY 10 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3m2p h PHE 11 N -3.07 -0.51 0.12 1.61 3.57 -1.91 -2.06 116.94 114.70 3m2p h PHE 11 Ca -0.27 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.23 3m2p h PHE 11 Cb 0.91 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.80 3m2p h PHE 11 CO 0.00 -0.19 -0.16 1.25 -2.23 0.00 0.00 178.31 176.97 3m2p h LEU 12 N -1.00 -0.45 -0.99 0.59 6.46 -1.93 -3.14 115.31 114.85 3m2p h LEU 12 Ca -0.06 0.05 0.24 0.00 -0.12 0.00 0.00 57.88 58.00 3m2p h LEU 12 Cb 0.54 0.17 -0.19 0.00 -0.73 0.00 0.00 40.66 40.45 3m2p h LEU 12 CO 0.09 -0.24 -0.09 0.61 -0.62 0.00 0.00 178.44 178.19 3m2p n GLY 13 N -1.29 -1.47 0.32 3.75 0.00 -1.21 -1.12 105.19 104.17 3m2p n GLY 13 Ca -0.07 1.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.89 3m2p n GLY 13 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3m2p h GLN 14 N 0.00 1.05 -0.33 1.61 4.20 -1.31 0.22 115.11 120.54 3m2p h GLN 14 Ca 0.55 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.99 3m2p h GLN 14 Cb 1.03 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.66 3m2p h GLN 14 CO -0.96 0.95 0.18 1.88 -0.67 0.00 0.00 178.83 180.21 3m2p h TYR 15 N 0.99 0.45 -0.58 2.96 0.05 -1.18 -2.99 116.97 116.67 3m2p h TYR 15 Ca 0.20 -0.01 -0.09 0.00 0.05 0.00 0.00 58.73 58.88 3m2p h TYR 15 Cb 0.40 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.98 3m2p h TYR 15 CO 0.03 0.37 -0.00 0.28 -1.05 0.00 0.00 178.16 177.78 3m2p h VAL 16 N 0.41 1.26 -0.39 -2.88 2.07 -0.84 -2.22 116.25 113.66 3m2p h VAL 16 Ca 0.12 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 3m2p h VAL 16 Cb 0.07 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 3m2p h VAL 16 CO -0.02 0.41 0.20 0.58 0.02 0.00 0.00 177.57 178.76 3m2p h VAL 17 N 0.93 1.16 -0.02 2.57 2.07 -0.61 -2.32 116.25 120.03 3m2p h VAL 17 Ca 0.17 -0.43 -0.16 0.00 0.82 0.00 0.00 66.70 67.10 3m2p h VAL 17 Cb 0.54 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3m2p h VAL 17 CO 0.03 0.17 -0.72 1.05 0.02 0.00 0.00 177.57 178.12 3m2p h GLU 18 N 0.50 0.13 -0.99 1.57 4.11 -1.46 -2.31 114.58 116.13 3m2p h GLU 18 Ca 0.14 -0.11 0.04 0.00 0.07 0.00 0.00 59.36 59.50 3m2p h GLU 18 Cb 0.08 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.30 3m2p h GLU 18 CO -0.02 0.79 0.65 0.77 0.07 0.00 0.00 179.01 181.26 3m2p h SER 19 N 0.08 1.07 0.18 3.06 0.02 -1.29 0.15 113.55 116.82 3m2p h SER 19 Ca -0.02 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 3m2p h SER 19 Cb 1.27 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.56 3m2p h SER 19 CO 0.10 0.73 -0.09 0.40 -1.14 0.00 0.00 176.83 176.83 3m2p h ILE 20 N 1.24 0.89 -0.91 3.27 2.04 -1.10 -1.82 117.51 121.11 3m2p h ILE 20 Ca 0.40 -0.35 0.04 0.00 1.00 0.00 0.00 64.86 65.95 3m2p h ILE 20 Cb 0.02 1.11 -0.06 0.00 -0.74 0.00 0.00 36.82 37.16 3m2p h ILE 20 CO -0.13 0.08 0.59 0.50 0.00 0.00 0.00 178.15 179.19 3m2p h LYS 21 N -0.41 1.09 0.00 2.37 3.64 -1.07 -0.61 116.57 121.57 3m2p h LYS 21 Ca -0.02 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 3m2p h LYS 21 Cb 0.32 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3m2p h LYS 21 CO 0.04 0.72 -0.07 -0.91 -2.27 0.00 0.00 179.45 176.96 3m2p h ASN 22 N 1.12 0.00 0.70 4.20 2.35 -0.62 -2.31 115.58 121.01 3m2p h ASN 22 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 3m2p h ASN 22 Cb 0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.42 3m2p h ASN 22 CO -0.13 0.07 -0.08 -0.67 -1.65 0.00 0.00 177.43 174.97 3m2p n ASP 23 N -3.37 0.14 0.00 5.81 2.03 -0.27 -4.89 116.55 116.01 3m2p n ASP 23 Ca -0.01 0.03 0.00 0.00 0.52 0.00 0.00 54.79 55.33 3m2p n ASP 23 Cb 0.23 -0.27 0.00 0.00 -0.72 0.00 0.00 41.12 40.36 3m2p n ASP 23 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3m2p n GLY 24 N 1.40 2.17 3.94 0.27 0.00 -0.87 -5.07 105.19 107.02 3m2p n GLY 24 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 3m2p n GLY 24 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3m2p s ASN 25 N -1.46 3.83 -0.27 1.61 0.01 -1.01 -4.78 114.94 112.86 3m2p s ASN 25 Ca 0.00 0.25 -0.04 0.00 -0.71 0.00 0.00 52.86 52.37 3m2p s ASN 25 Cb 0.00 -0.53 0.02 0.00 0.41 0.00 0.00 41.25 41.15 3m2p s ASN 25 CO 0.00 -2.26 0.00 -0.89 -1.51 0.00 0.00 177.10 172.44 3m2p s THR 26 N -3.60 3.35 0.17 1.60 2.01 0.56 -3.82 115.64 115.92 3m2p s THR 26 Ca 0.69 -0.90 -0.30 0.00 0.31 0.00 0.00 61.69 61.49 3m2p s THR 26 Cb -0.06 -2.73 -0.07 0.00 0.01 0.00 0.00 72.50 69.65 3m2p s THR 26 CO 0.49 0.13 1.05 -2.84 -0.69 0.00 0.00 174.62 172.76 3m2p s PRO 27 N 1.40 4.66 -0.30 4.92 0.02 -1.26 0.05 135.00 144.49 3m2p s PRO 27 Ca 0.01 1.63 0.01 0.00 0.02 0.00 0.00 61.00 62.67 3m2p s PRO 27 Cb -0.17 -3.30 0.09 0.00 0.02 0.00 0.00 34.50 31.14 3m2p s PRO 27 CO -0.01 0.17 0.04 0.42 -0.33 0.00 0.00 177.00 177.28 3m2p s ILE 28 N -0.35 1.58 -0.17 2.83 1.01 0.53 -4.07 121.20 122.57 3m2p s ILE 28 Ca 0.47 -1.70 -0.29 0.00 0.00 0.00 0.00 60.65 59.14 3m2p s ILE 28 Cb -0.28 -2.08 -0.02 0.00 0.01 0.00 0.00 42.46 40.09 3m2p s ILE 28 CO 0.34 -0.48 1.34 -0.63 0.00 0.00 0.00 174.94 175.50 3m2p s ILE 29 N 1.29 4.15 -0.11 2.92 1.09 -0.45 -1.13 121.20 128.95 3m2p s ILE 29 Ca 0.06 1.37 -0.16 0.00 -1.10 0.00 0.00 60.65 60.82 3m2p s ILE 29 Cb -0.18 -3.93 -0.05 0.00 -1.06 0.00 0.00 42.46 37.24 3m2p s ILE 29 CO -0.13 -0.17 0.40 -0.76 -0.10 0.00 0.00 174.94 174.18 3m2p s LEU 30 N 3.74 4.31 0.07 2.97 1.02 -0.89 -0.71 118.68 129.18 3m2p s LEU 30 Ca 0.58 0.74 -0.16 0.00 0.02 0.00 0.00 54.13 55.31 3m2p s LEU 30 Cb -0.23 -2.55 0.03 0.00 0.02 0.00 0.00 46.19 43.46 3m2p s LEU 30 CO 0.18 0.11 0.36 0.28 0.02 0.00 0.00 176.35 177.30 3m2p s THR 31 N 0.20 0.07 -0.58 5.49 -1.32 -1.12 -3.03 115.64 115.35 3m2p s THR 31 Ca 0.22 -0.61 0.26 0.00 -1.21 0.00 0.00 61.69 60.35 3m2p s THR 31 Cb -0.15 -1.03 0.29 0.00 -1.51 0.00 0.00 72.50 70.10 3m2p s THR 31 CO 0.09 -0.34 1.75 0.03 -2.21 0.00 0.00 174.62 173.94 3m2p h ARG 32 N 2.90 0.00 -1.12 7.08 3.08 -1.89 0.88 114.38 125.30 3m2p h ARG 32 Ca -0.32 0.00 0.26 0.00 0.07 0.00 0.00 59.98 59.99 3m2p h ARG 32 Cb 1.22 0.00 -0.25 0.00 0.08 0.00 0.00 29.97 31.02 3m2p h ARG 32 CO 0.46 0.00 0.93 -1.54 -1.07 0.00 0.00 179.97 178.75 3m2p s SER 33 N -4.74 -0.06 0.02 7.04 1.04 -1.26 -4.60 113.70 111.14 3m2p s SER 33 Ca 0.08 0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.56 3m2p s SER 33 Cb 0.10 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.26 3m2p s SER 33 CO 0.55 -0.07 -0.04 0.27 0.98 0.00 0.00 173.24 174.94 3m2p s ILE 34 N -1.43 0.21 -0.39 -1.02 -4.36 -1.26 -5.10 121.20 107.85 3m2p s ILE 34 Ca 0.09 -0.78 0.11 0.00 -0.26 0.00 0.00 60.65 59.81 3m2p s ILE 34 Cb -0.01 -0.31 0.40 0.00 1.25 0.00 0.00 42.46 43.79 3m2p s ILE 34 CO -0.06 -0.37 1.26 0.61 0.24 0.00 0.00 174.94 176.63 3m2p n GLY 35 N 1.85 1.36 0.97 6.27 0.00 -1.26 -5.22 105.19 109.16 3m2p n GLY 35 Ca -0.21 -0.37 0.11 0.00 0.00 0.00 0.00 46.02 45.55 3m2p n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3m2p n ASP 41 N -0.44 2.89 -4.87 1.61 8.00 -1.26 -5.37 116.55 117.11 3m2p n ASP 41 Ca 0.00 -1.91 -0.31 0.00 0.71 0.00 0.00 54.79 53.28 3m2p n ASP 41 Cb 0.83 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 3m2p n ASP 41 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3m2p s TYR 42 N -1.59 3.59 -0.14 1.24 2.02 -1.26 -5.02 117.35 116.20 3m2p s TYR 42 Ca 0.36 1.24 -0.29 0.00 -0.37 0.00 0.00 57.07 58.01 3m2p s TYR 42 Cb 0.21 -2.66 -0.02 0.00 -0.40 0.00 0.00 41.96 39.09 3m2p s TYR 42 CO 0.30 -0.57 1.29 -2.00 -1.57 0.00 0.00 175.55 173.00 3m2p s GLU 43 N -4.94 4.24 -0.11 -0.62 2.12 -1.26 -4.99 118.70 113.15 3m2p s GLU 43 Ca 0.54 1.72 -0.09 0.00 0.36 0.00 0.00 54.97 57.50 3m2p s GLU 43 Cb -0.11 -3.75 -0.04 0.00 0.26 0.00 0.00 34.13 30.49 3m2p s GLU 43 CO 0.49 -0.68 0.18 0.71 -0.54 0.00 0.00 175.26 175.42 3m2p s TYR 44 N 3.35 3.59 -0.18 5.30 1.51 -1.26 -1.35 117.35 128.31 3m2p s TYR 44 Ca 0.57 0.57 0.00 0.00 -1.01 0.00 0.00 57.07 57.20 3m2p s TYR 44 Cb -0.23 -2.02 0.04 0.00 -0.11 0.00 0.00 41.96 39.64 3m2p s TYR 44 CO 0.17 0.67 -0.09 1.03 -1.11 0.00 0.00 175.55 176.22 3m2p s ARG 45 N -0.85 1.80 0.19 -0.62 0.52 0.12 -4.94 118.95 115.17 3m2p s ARG 45 Ca 0.15 -0.66 -0.30 0.00 -0.52 0.00 0.00 55.73 54.41 3m2p s ARG 45 Cb -0.13 -2.18 -0.08 0.00 0.52 0.00 0.00 34.95 33.08 3m2p s ARG 45 CO 0.05 -0.40 0.97 0.08 0.02 0.00 0.00 175.30 176.01 3m2p s VAL 46 N 1.51 4.16 0.08 3.52 1.01 -1.26 -2.80 120.40 126.62 3m2p s VAL 46 Ca 0.00 2.01 -0.05 0.00 0.00 0.00 0.00 61.98 63.94 3m2p s VAL 46 Cb -0.15 -4.28 -0.02 0.00 0.00 0.00 0.00 36.38 31.93 3m2p s VAL 46 CO -0.08 0.41 0.10 -0.55 0.00 0.00 0.00 175.10 174.97 3m2p s SER 47 N -0.67 0.28 -0.01 3.32 0.15 0.30 -4.92 113.70 112.15 3m2p s SER 47 Ca 0.44 -0.85 0.09 0.00 0.70 0.00 0.00 55.95 56.33 3m2p s SER 47 Cb -0.26 0.29 0.26 0.00 -1.71 0.00 0.00 66.02 64.60 3m2p s SER 47 CO 0.32 -0.69 1.22 -0.90 1.20 0.00 0.00 173.24 174.39 3m2p n ASP 48 N -0.00 2.80 -2.46 5.45 5.68 -1.26 -3.99 116.55 122.76 3m2p n ASP 48 Ca -0.13 -2.05 -0.16 0.00 -0.50 0.00 0.00 54.79 51.95 3m2p n ASP 48 Cb 0.62 -0.21 -0.01 0.00 -1.14 0.00 0.00 41.12 40.39 3m2p n ASP 48 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 3m2p n TYR 49 N 0.29 -1.29 -3.26 2.11 4.01 -1.26 -4.98 117.16 112.79 3m2p n TYR 49 Ca 0.10 0.02 -0.29 0.00 -0.16 0.00 0.00 57.90 57.57 3m2p n TYR 49 Cb 0.42 -3.24 -0.03 0.00 -0.31 0.00 0.00 39.34 36.17 3m2p n TYR 49 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3m2p s THR 50 N -2.79 4.96 0.13 -0.72 -4.23 -1.26 -4.77 115.64 106.97 3m2p s THR 50 Ca 0.02 0.22 -0.24 0.00 -1.18 0.00 0.00 61.69 60.51 3m2p s THR 50 Cb -0.01 -3.72 -0.02 0.00 1.34 0.00 0.00 72.50 70.10 3m2p s THR 50 CO 0.02 -0.32 1.64 0.25 -0.54 0.00 0.00 174.62 175.67 3m2p h LEU 51 N 1.72 -0.67 -1.88 4.79 6.46 -1.94 -0.37 115.31 123.43 3m2p h LEU 51 Ca -0.47 0.11 -0.02 0.00 -0.12 0.00 0.00 57.88 57.37 3m2p h LEU 51 Cb 1.19 0.30 -0.00 0.00 -0.73 0.00 0.00 40.66 41.41 3m2p h LEU 51 CO 0.66 -0.27 -0.10 1.05 -0.62 0.00 0.00 178.44 179.16 3m2p h GLU 52 N -0.29 0.00 0.14 1.25 9.09 -1.95 -1.59 114.58 121.23 3m2p h GLU 52 Ca 0.10 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.24 3m2p h GLU 52 Cb 0.43 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.53 3m2p h GLU 52 CO -0.28 0.10 -1.33 0.22 0.05 0.00 0.00 179.01 177.77 3m2p h ASP 53 N 0.00 0.45 -0.69 3.06 3.58 -1.86 -3.36 116.42 117.59 3m2p h ASP 53 Ca -0.00 -0.89 -0.06 0.00 0.42 0.00 0.00 57.03 56.51 3m2p h ASP 53 Cb 0.19 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 3m2p h ASP 53 CO 0.01 1.60 0.22 -0.07 -2.88 0.00 0.00 179.24 178.12 3m2p h LEU 54 N -0.25 1.02 -0.95 2.28 3.38 -0.67 -1.23 115.31 118.89 3m2p h LEU 54 Ca -0.27 -0.19 0.27 0.00 0.09 0.00 0.00 57.88 57.78 3m2p h LEU 54 Cb 1.79 -0.27 -0.17 0.00 0.09 0.00 0.00 40.66 42.11 3m2p h LEU 54 CO 0.10 0.95 0.15 0.40 0.09 0.00 0.00 178.44 180.13 3m2p h ILE 55 N 1.05 0.11 0.05 1.22 2.04 -1.45 0.21 117.51 120.74 3m2p h ILE 55 Ca 0.23 -0.02 -0.26 0.00 1.00 0.00 0.00 64.86 65.81 3m2p h ILE 55 Cb 0.30 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 3m2p h ILE 55 CO -0.01 0.01 -1.30 0.78 0.00 0.00 0.00 178.15 177.64 3m2p h ASN 56 N 0.06 0.17 0.60 1.72 -0.26 -1.44 -3.15 115.58 113.29 3m2p h ASN 56 Ca 0.61 -0.22 0.00 0.00 -0.56 0.00 0.00 56.30 56.13 3m2p h ASN 56 Cb 1.30 -0.06 0.00 0.00 -1.06 0.00 0.00 38.32 38.51 3m2p h ASN 56 CO -0.82 1.18 0.00 0.00 -1.06 0.00 0.00 177.43 176.73 3m2p n GLN 57 N -3.35 0.05 -0.07 0.81 1.13 0.34 -2.96 117.38 113.32 3m2p n GLN 57 Ca -0.08 0.16 0.02 0.00 -1.94 0.00 0.00 57.00 55.16 3m2p n GLN 57 Cb 1.00 -1.50 0.06 0.00 0.11 0.00 0.00 30.24 29.91 3m2p n GLN 57 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3m2p n LEU 58 N -1.46 2.29 0.00 1.08 4.77 0.47 -4.79 117.00 119.36 3m2p n LEU 58 Ca 0.05 -1.90 0.07 0.00 -0.03 0.00 0.00 56.01 54.20 3m2p n LEU 58 Cb 0.21 -0.09 0.33 0.00 -2.33 0.00 0.00 43.42 41.54 3m2p n LEU 58 CO 0.17 0.57 0.70 -0.46 -1.33 0.00 0.00 177.39 177.04 3m2p n ASN 59 N -0.04 0.00 -0.59 -1.43 0.23 -1.16 -2.26 115.26 110.01 3m2p n ASN 59 Ca 0.05 0.25 0.05 0.00 -0.53 0.00 0.00 54.58 54.39 3m2p n ASN 59 Cb 0.30 -0.37 0.08 0.00 -2.08 0.00 0.00 39.78 37.72 3m2p n ASN 59 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 3m2p n ASP 60 N -1.37 1.21 -4.80 0.53 5.75 -1.26 -5.07 116.55 111.54 3m2p n ASP 60 Ca 0.05 -2.68 -0.35 0.00 -0.01 0.00 0.00 54.79 51.80 3m2p n ASP 60 Cb 0.13 -0.35 -0.07 0.00 -1.03 0.00 0.00 41.12 39.80 3m2p n ASP 60 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3m2p s VAL 61 N -1.45 4.99 -0.19 2.12 1.01 -0.96 -4.77 120.40 121.16 3m2p s VAL 61 Ca 0.23 -0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.22 3m2p s VAL 61 Cb 0.23 -3.18 -0.22 0.00 0.00 0.00 0.00 36.38 33.21 3m2p s VAL 61 CO -0.04 0.55 0.09 0.47 0.00 0.00 0.00 175.10 176.17 3m2p n ASP 62 N 1.82 1.20 -4.09 3.32 8.00 -0.33 -4.85 116.55 121.61 3m2p n ASP 62 Ca -0.18 0.04 -0.09 0.00 0.71 0.00 0.00 54.79 55.27 3m2p n ASP 62 Cb 0.54 0.03 -0.09 0.00 -0.02 0.00 0.00 41.12 41.57 3m2p n ASP 62 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3m2p s ALA 63 N -2.53 0.58 -0.05 2.24 0.00 -1.18 -4.53 121.76 116.30 3m2p s ALA 63 Ca -0.21 -1.27 0.01 0.00 0.00 0.00 0.00 51.96 50.50 3m2p s ALA 63 Cb 0.07 0.71 0.02 0.00 0.00 0.00 0.00 23.12 23.92 3m2p s ALA 63 CO 0.73 -0.49 -0.06 0.08 0.00 0.00 0.00 175.76 176.02 3m2p s VAL 64 N -4.00 0.67 -0.27 0.00 1.01 -0.79 -1.84 120.40 115.19 3m2p s VAL 64 Ca 0.18 -0.21 -0.10 0.00 0.00 0.00 0.00 61.98 61.86 3m2p s VAL 64 Cb 0.07 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 3m2p s VAL 64 CO -0.02 0.25 0.15 -0.69 0.00 0.00 0.00 175.10 174.79 3m2p s VAL 65 N 0.84 4.95 -0.71 2.92 1.01 0.45 -0.60 120.40 129.27 3m2p s VAL 65 Ca -0.12 0.03 -0.15 0.00 0.00 0.00 0.00 61.98 61.74 3m2p s VAL 65 Cb -0.15 -3.36 0.18 0.00 0.00 0.00 0.00 36.38 33.06 3m2p s VAL 65 CO 0.01 0.27 0.65 -2.28 0.00 0.00 0.00 175.10 173.75 3m2p s HIS 66 N 1.71 3.55 -0.05 5.22 2.46 0.23 -1.72 115.29 126.70 3m2p s HIS 66 Ca 0.07 -1.72 0.15 0.00 0.47 0.00 0.00 55.06 54.03 3m2p s HIS 66 Cb -0.16 -3.80 -0.23 0.00 -0.13 0.00 0.00 32.58 28.26 3m2p s HIS 66 CO 0.08 -1.00 0.28 1.28 -2.47 0.00 0.00 174.74 172.91 3m2p n LEU 67 N 4.48 0.00 -4.71 8.88 4.77 -1.14 -2.23 117.00 127.05 3m2p n LEU 67 Ca 0.02 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.58 3m2p n LEU 67 Cb 0.44 0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 3m2p n LEU 67 CO 0.42 0.08 1.36 0.00 -1.33 0.00 0.00 177.39 177.92 3m2p s ALA 68 N -2.92 3.83 0.28 -1.18 0.00 -1.13 -4.80 121.76 115.83 3m2p s ALA 68 Ca -0.06 1.46 -0.21 0.00 0.00 0.00 0.00 51.96 53.16 3m2p s ALA 68 Cb 0.09 -3.70 0.04 0.00 0.00 0.00 0.00 23.12 19.55 3m2p s ALA 68 CO 0.64 -0.99 0.78 0.00 0.00 0.00 0.00 175.76 176.20 3m2p s ALA 69 N 1.73 -1.20 0.16 0.00 0.00 -1.26 -4.92 121.76 116.27 3m2p s ALA 69 Ca 0.75 -0.34 0.09 0.00 0.00 0.00 0.00 51.96 52.47 3m2p s ALA 69 Cb -0.46 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 3m2p s ALA 69 CO 0.33 -1.03 -0.15 0.95 0.00 0.00 0.00 175.76 175.86 3m2p s THR 70 N -3.42 2.95 -0.12 0.00 -4.23 -1.26 -5.05 115.64 104.50 3m2p s THR 70 Ca 0.13 -1.68 0.21 0.00 -1.18 0.00 0.00 61.69 59.16 3m2p s THR 70 Cb -0.05 -2.42 -0.22 0.00 1.34 0.00 0.00 72.50 71.15 3m2p s THR 70 CO 0.07 -0.05 0.60 0.54 -0.54 0.00 0.00 174.62 175.24 3m2p n ARG 71 N 0.30 0.65 0.00 3.99 1.74 -1.26 -5.02 116.66 117.06 3m2p n ARG 71 Ca -0.12 -0.03 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 3m2p n ARG 71 Cb 0.55 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 3m2p n ARG 71 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3m2p n GLY 72 N 1.34 -0.94 1.35 -0.13 0.00 -1.26 -4.89 105.19 100.66 3m2p n GLY 72 Ca -0.08 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.28 3m2p n GLY 72 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3m2p n SER 73 N -0.82 0.00 0.00 1.61 2.88 -1.26 -4.96 113.62 111.08 3m2p n SER 73 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 3m2p n SER 73 Cb 0.00 0.34 0.25 0.00 -0.75 0.00 0.00 64.21 64.05 3m2p n SER 73 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3m2p n GLN 74 N -2.18 0.01 -2.22 -1.46 1.13 -1.26 -4.93 117.38 106.48 3m2p n GLN 74 Ca 0.00 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 54.95 3m2p n GLN 74 Cb 0.00 -1.51 -0.00 0.00 0.11 0.00 0.00 30.24 28.84 3m2p n GLN 74 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3m2p n GLY 75 N 1.49 -0.08 3.52 1.08 0.00 -1.26 -5.02 105.19 104.92 3m2p n GLY 75 Ca 0.05 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 3m2p n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m2p s LYS 76 N -4.56 2.34 0.29 1.61 1.02 -1.26 -5.01 119.74 114.16 3m2p s LYS 76 Ca 0.00 -0.83 0.25 0.00 0.02 0.00 0.00 55.97 55.41 3m2p s LYS 76 Cb -0.00 -2.35 1.02 0.00 -0.52 0.00 0.00 37.83 35.98 3m2p s LYS 76 CO 0.00 0.58 1.74 0.97 -0.92 0.00 0.00 175.35 177.72 3m2p h ILE 77 N 3.93 0.00 0.00 2.17 6.09 -2.02 -2.74 117.51 124.95 3m2p h ILE 77 Ca -0.48 -0.26 -0.07 0.00 -1.37 0.00 0.00 64.86 62.69 3m2p h ILE 77 Cb 1.16 1.01 -0.01 0.00 0.47 0.00 0.00 36.82 39.45 3m2p h ILE 77 CO 0.51 0.00 -0.31 0.77 -3.07 0.00 0.00 178.15 176.05 3m2p h SER 78 N 0.00 0.00 0.19 2.19 4.64 -2.02 -3.03 113.55 115.52 3m2p h SER 78 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m2p h SER 78 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3m2p h SER 78 CO 0.00 0.31 0.00 -0.62 -0.87 0.00 0.00 176.83 175.65 3m2p n GLU 79 N -3.48 0.39 -0.00 4.77 1.02 -1.03 -2.91 120.64 119.40 3m2p n GLU 79 Ca -0.00 0.07 0.01 0.00 -0.02 0.00 0.00 57.16 57.22 3m2p n GLU 79 Cb 0.47 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.38 3m2p n GLU 79 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3m2p n PHE 80 N -1.16 0.00 -0.07 -0.32 3.72 -1.15 -4.67 117.46 113.81 3m2p n PHE 80 Ca 0.11 0.00 0.25 0.00 -0.05 0.00 0.00 57.45 57.76 3m2p n PHE 80 Cb 0.11 -0.05 0.72 0.00 -0.94 0.00 0.00 39.48 39.32 3m2p n PHE 80 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3m2p h HIS 81 N 0.00 0.00 -0.21 1.38 3.86 -1.58 0.34 115.15 118.94 3m2p h HIS 81 Ca 0.00 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.06 3m2p h HIS 81 Cb 0.10 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.56 3m2p h HIS 81 CO 0.00 0.00 -0.49 0.22 0.86 0.00 0.00 177.93 178.52 3m2p h ASP 82 N 0.00 0.62 0.77 2.45 3.58 -1.83 -2.35 116.42 119.66 3m2p h ASP 82 Ca 0.33 -0.31 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 3m2p h ASP 82 Cb 1.47 -0.17 0.01 0.00 1.72 0.00 0.00 39.33 42.35 3m2p h ASP 82 CO -0.00 1.00 -0.39 0.78 -2.88 0.00 0.00 179.24 177.75 3m2p h ASN 83 N 0.45 -0.93 -0.77 2.28 4.21 -0.65 0.27 115.58 120.43 3m2p h ASN 83 Ca 0.02 0.04 0.15 0.00 1.21 0.00 0.00 56.30 57.72 3m2p h ASN 83 Cb 1.02 0.25 -0.15 0.00 -1.12 0.00 0.00 38.32 38.32 3m2p h ASN 83 CO 0.09 -0.65 -0.22 -0.33 -1.29 0.00 0.00 177.43 175.04 3m2p h GLU 84 N -1.06 -0.02 -0.22 0.81 5.08 -1.38 0.44 114.58 118.23 3m2p h GLU 84 Ca -0.10 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3m2p h GLU 84 Cb 0.82 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 3m2p h GLU 84 CO 0.16 -0.01 0.07 0.82 -1.00 0.00 0.00 179.01 179.05 3m2p h ILE 85 N -0.02 0.93 -0.90 3.13 2.04 -1.37 -1.95 117.51 119.38 3m2p h ILE 85 Ca 0.36 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 66.23 3m2p h ILE 85 Cb 0.57 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 37.34 3m2p h ILE 85 CO -0.80 0.03 0.58 0.25 0.00 0.00 0.00 178.15 178.22 3m2p h LEU 86 N 0.17 0.89 0.81 1.44 6.46 0.16 -1.01 115.31 124.23 3m2p h LEU 86 Ca 0.10 0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.83 3m2p h LEU 86 Cb 0.07 -0.18 0.01 0.00 -0.73 0.00 0.00 40.66 39.83 3m2p h LEU 86 CO -0.11 0.56 -0.39 0.74 -0.62 0.00 0.00 178.44 178.63 3m2p h THR 87 N 1.00 0.00 -0.91 1.05 2.02 0.15 -1.84 112.91 114.39 3m2p h THR 87 Ca 0.39 -0.20 0.19 0.00 0.77 0.00 0.00 66.41 67.56 3m2p h THR 87 Cb 0.23 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.56 3m2p h THR 87 CO -0.15 0.00 0.59 -0.61 0.37 0.00 0.00 175.52 175.72 3m2p h GLN 88 N -1.28 0.50 0.16 6.66 4.15 -1.16 -0.84 115.11 123.29 3m2p h GLN 88 Ca -0.11 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.27 3m2p h GLN 88 Cb 0.83 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.41 3m2p h GLN 88 CO 0.18 0.33 -0.07 -0.91 -1.93 0.00 0.00 178.83 176.43 3m2p h ASN 89 N 0.52 -0.18 -0.43 -0.69 -0.26 -1.07 -0.85 115.58 112.62 3m2p h ASN 89 Ca 0.48 -0.00 0.07 0.00 -0.56 0.00 0.00 56.30 56.28 3m2p h ASN 89 Cb 1.03 0.05 -0.06 0.00 -1.06 0.00 0.00 38.32 38.28 3m2p h ASN 89 CO -0.21 -0.11 0.10 0.25 -1.06 0.00 0.00 177.43 176.40 3m2p h LEU 90 N -0.22 0.04 -0.68 1.61 5.85 -0.32 0.18 115.31 121.77 3m2p h LEU 90 Ca -0.02 0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.65 3m2p h LEU 90 Cb 0.17 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 3m2p h LEU 90 CO 0.04 0.06 -0.22 1.88 -0.34 0.00 0.00 178.44 179.85 3m2p h TYR 91 N 0.24 0.89 -0.62 1.25 0.05 -1.19 0.30 116.97 117.89 3m2p h TYR 91 Ca 0.21 -0.20 0.05 0.00 0.05 0.00 0.00 58.73 58.83 3m2p h TYR 91 Cb 0.25 -0.21 -0.05 0.00 1.01 0.00 0.00 36.73 37.73 3m2p h TYR 91 CO -0.20 0.93 0.34 -0.44 -1.05 0.00 0.00 178.16 177.75 3m2p h ASP 92 N 0.68 0.52 -0.33 3.88 3.32 -0.54 -0.39 116.42 123.56 3m2p h ASP 92 Ca 0.09 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.04 3m2p h ASP 92 Cb 0.74 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 3m2p h ASP 92 CO 0.06 0.35 -0.28 0.00 -1.72 0.00 0.00 179.24 177.64 3m2p h ALA 93 N 1.31 0.47 -0.19 3.45 0.00 -0.18 -2.08 119.26 122.05 3m2p h ALA 93 Ca 0.27 -0.40 0.03 0.00 0.00 0.00 0.00 54.91 54.81 3m2p h ALA 93 Cb 0.14 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3m2p h ALA 93 CO -0.16 0.49 -0.02 0.00 0.00 0.00 0.00 179.25 179.56 3m2p h TYR 95 N 0.04 -0.01 -0.36 0.00 3.20 -0.96 0.30 116.97 119.18 3m2p h TYR 95 Ca 0.09 0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.05 3m2p h TYR 95 Cb 0.12 0.06 -0.06 0.00 1.54 0.00 0.00 36.73 38.39 3m2p h TYR 95 CO -0.19 -0.06 -0.02 0.93 -1.64 0.00 0.00 178.16 177.18 3m2p h GLU 96 N 0.11 0.07 0.00 1.82 4.39 -1.07 -0.72 114.58 119.18 3m2p h GLU 96 Ca 0.17 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.87 3m2p h GLU 96 Cb 0.23 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 3m2p h GLU 96 CO -0.28 0.05 0.00 0.09 -1.16 0.00 0.00 179.01 177.70 3m2p n ASN 97 N -5.21 0.00 -3.34 1.42 3.02 -0.79 -4.89 115.26 105.47 3m2p n ASN 97 Ca 0.02 -1.28 -0.24 0.00 -0.03 0.00 0.00 54.58 53.05 3m2p n ASN 97 Cb 0.19 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.42 3m2p n ASN 97 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3m2p n ASN 98 N -0.84 -6.19 -4.78 6.41 5.15 -0.28 -5.02 115.26 109.72 3m2p n ASN 98 Ca 0.16 -0.43 -0.39 0.00 -0.60 0.00 0.00 54.58 53.32 3m2p n ASN 98 Cb 0.07 -4.93 -0.06 0.00 -0.53 0.00 0.00 39.78 34.33 3m2p n ASN 98 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3m2p s ILE 99 N -3.25 4.84 0.00 -1.44 1.09 0.92 -4.95 121.20 118.41 3m2p s ILE 99 Ca 0.46 1.24 0.00 0.00 -1.10 0.00 0.00 60.65 61.25 3m2p s ILE 99 Cb -0.20 -3.92 0.00 0.00 -1.06 0.00 0.00 42.46 37.27 3m2p s ILE 99 CO 0.57 0.47 0.00 -1.54 -0.10 0.00 0.00 174.94 174.34 3m2p n SER 100 N 2.36 2.12 -4.56 3.58 3.41 -1.26 -4.18 113.62 115.08 3m2p n SER 100 Ca -0.08 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.19 3m2p n SER 100 Cb 0.51 0.33 -0.04 0.00 -0.26 0.00 0.00 64.21 64.75 3m2p n SER 100 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3m2p s ASN 101 N -1.31 5.81 -0.00 4.04 3.04 -1.26 0.28 114.94 125.55 3m2p s ASN 101 Ca 0.00 -1.15 0.07 0.00 0.04 0.00 0.00 52.86 51.82 3m2p s ASN 101 Cb 0.00 -2.57 -0.02 0.00 -1.54 0.00 0.00 41.25 37.12 3m2p s ASN 101 CO 0.00 -2.15 -0.21 -0.63 -3.04 0.00 0.00 177.10 171.07 3m2p s ILE 102 N 7.62 1.67 -0.13 -5.21 1.01 -1.14 -1.88 121.20 123.15 3m2p s ILE 102 Ca 0.59 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 60.27 3m2p s ILE 102 Cb -0.03 -1.40 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 3m2p s ILE 102 CO -0.04 0.40 -0.17 -0.69 0.00 0.00 0.00 174.94 174.44 3m2p s VAL 103 N -0.57 2.62 -0.08 2.92 1.01 0.23 -1.68 120.40 124.85 3m2p s VAL 103 Ca 0.08 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.25 3m2p s VAL 103 Cb -0.08 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.20 3m2p s VAL 103 CO -0.00 0.53 -0.05 -0.47 0.00 0.00 0.00 175.10 175.11 3m2p s TYR 104 N 0.46 3.00 -0.53 5.22 5.04 -0.67 0.78 117.35 130.66 3m2p s TYR 104 Ca -0.12 0.06 -0.20 0.00 -2.44 0.00 0.00 57.07 54.36 3m2p s TYR 104 Cb -0.16 -1.74 0.06 0.00 0.35 0.00 0.00 41.96 40.46 3m2p s TYR 104 CO 0.05 0.36 0.72 0.00 -1.34 0.00 0.00 175.55 175.34 3m2p s ALA 105 N -0.79 3.32 0.00 3.97 0.00 -0.95 -1.18 121.76 126.14 3m2p s ALA 105 Ca 0.12 -1.63 0.00 0.00 0.00 0.00 0.00 51.96 50.45 3m2p s ALA 105 Cb -0.11 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.54 3m2p s ALA 105 CO 0.02 -2.14 0.00 0.45 0.00 0.00 0.00 175.76 174.09 3m2p n SER 106 N 6.55 0.01 -3.68 0.00 2.88 0.56 -4.93 113.62 115.01 3m2p n SER 106 Ca -0.04 -0.27 -0.13 0.00 -1.33 0.00 0.00 58.87 57.10 3m2p n SER 106 Cb 0.46 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.85 3m2p n SER 106 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3m2p s THR 107 N 1.72 0.06 0.44 2.46 -1.32 -1.26 -2.65 115.64 115.10 3m2p s THR 107 Ca 0.00 -0.49 0.37 0.00 -1.21 0.00 0.00 61.69 60.36 3m2p s THR 107 Cb 0.00 -0.95 0.37 0.00 -1.51 0.00 0.00 72.50 70.41 3m2p s THR 107 CO 0.00 -0.27 2.14 -0.29 -2.21 0.00 0.00 174.62 173.99 3m2p h ILE 108 N 3.04 0.00 0.00 5.08 2.10 -1.19 -2.05 117.51 124.49 3m2p h ILE 108 Ca -0.31 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.63 3m2p h ILE 108 Cb 1.20 0.83 0.00 0.00 -1.09 0.00 0.00 36.82 37.76 3m2p h ILE 108 CO 0.44 0.00 0.00 -1.20 -1.08 0.00 0.00 178.15 176.31 3m2p n SER 109 N -2.83 0.17 -0.22 2.19 7.64 -1.26 -1.43 113.62 117.87 3m2p n SER 109 Ca -0.02 -1.32 0.13 0.00 1.01 0.00 0.00 58.87 58.67 3m2p n SER 109 Cb 0.09 -0.09 0.38 0.00 -1.01 0.00 0.00 64.21 63.58 3m2p n SER 109 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3m2p n ALA 110 N -0.32 3.10 -2.54 -0.43 0.00 -0.77 -4.46 120.51 115.08 3m2p n ALA 110 Ca 0.00 -0.40 -0.26 0.00 0.00 0.00 0.00 53.44 52.78 3m2p n ALA 110 Cb 0.04 -1.14 -0.09 0.00 0.00 0.00 0.00 19.45 18.26 3m2p n ALA 110 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3m2p s TYR 111 N -2.53 2.53 0.00 0.00 2.02 -0.52 -0.10 117.35 118.75 3m2p s TYR 111 Ca 0.24 -0.57 0.00 0.00 -0.37 0.00 0.00 57.07 56.36 3m2p s TYR 111 Cb 0.19 -1.70 0.00 0.00 -0.40 0.00 0.00 41.96 40.05 3m2p s TYR 111 CO 0.53 0.41 0.00 0.45 -1.57 0.00 0.00 175.55 175.37 3m2p n SER 112 N -1.01 0.00 -4.58 2.29 2.88 -1.20 -4.62 113.62 107.38 3m2p n SER 112 Ca -0.04 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.10 3m2p n SER 112 Cb 0.65 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.08 3m2p n SER 112 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3m2p s ASP 113 N -0.90 5.04 0.50 -3.46 -1.08 -1.26 -4.82 116.67 110.69 3m2p s ASP 113 Ca 0.00 1.40 0.29 0.00 -0.52 0.00 0.00 52.55 53.72 3m2p s ASP 113 Cb 0.00 -2.51 1.24 0.00 -1.46 0.00 0.00 42.92 40.19 3m2p s ASP 113 CO 0.00 -2.36 1.95 -0.33 0.52 0.00 0.00 175.17 174.95 3m2p h GLU 114 N 16.81 0.00 0.00 4.34 5.08 -1.99 -2.21 114.58 136.61 3m2p h GLU 114 Ca -0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 3m2p h GLU 114 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 3m2p h GLU 114 CO 1.07 0.12 0.02 1.15 -1.00 0.00 0.00 179.01 180.36 3m2p h THR 115 N 0.00 0.00 -0.00 1.13 2.02 -2.00 -3.06 112.91 111.00 3m2p h THR 115 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3m2p h THR 115 Cb 0.56 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 3m2p h THR 115 CO 0.02 0.00 -0.12 -0.24 0.37 0.00 0.00 175.52 175.54 3m2p n SER 116 N -2.31 0.86 -4.75 4.18 2.88 -0.83 -5.00 113.62 108.65 3m2p n SER 116 Ca -0.02 -0.93 -0.41 0.00 -1.33 0.00 0.00 58.87 56.19 3m2p n SER 116 Cb 0.05 0.50 0.01 0.00 -0.75 0.00 0.00 64.21 64.02 3m2p n SER 116 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3m2p n LEU 117 N -0.40 4.62 -4.82 2.46 4.77 -1.16 -3.93 117.00 118.55 3m2p n LEU 117 Ca 0.02 1.16 -0.33 0.00 -0.03 0.00 0.00 56.01 56.84 3m2p n LEU 117 Cb 0.11 -1.58 -0.05 0.00 -2.33 0.00 0.00 43.42 39.58 3m2p n LEU 117 CO 0.07 -0.18 0.68 -2.16 -1.33 0.00 0.00 177.39 174.47 3m2p s PRO 118 N -2.22 4.02 -0.09 3.23 0.05 -1.26 -5.12 135.00 133.60 3m2p s PRO 118 Ca 0.58 1.15 -0.23 0.00 0.05 0.00 0.00 61.00 62.55 3m2p s PRO 118 Cb -0.48 -2.14 -0.03 0.00 0.05 0.00 0.00 34.50 31.89 3m2p s PRO 118 CO 0.60 -0.22 0.70 -1.58 0.05 0.00 0.00 177.00 176.56 3m2p s TRP 119 N -2.23 3.54 0.39 0.56 0.51 -1.15 -4.67 118.94 115.89 3m2p s TRP 119 Ca 0.63 1.21 0.08 0.00 -2.12 0.00 0.00 56.10 55.90 3m2p s TRP 119 Cb -0.11 -2.82 -0.04 0.00 -0.81 0.00 0.00 33.47 29.69 3m2p s TRP 119 CO 0.19 0.03 0.24 0.54 -0.51 0.00 0.00 176.95 177.44 3m2p s ASN 120 N 0.87 4.73 0.00 2.95 2.20 -1.26 -1.16 114.94 123.27 3m2p s ASN 120 Ca 0.37 -0.87 0.02 0.00 -0.94 0.00 0.00 52.86 51.44 3m2p s ASN 120 Cb -0.17 -0.60 0.14 0.00 -2.00 0.00 0.00 41.25 38.61 3m2p s ASN 120 CO 0.17 -0.50 0.46 -1.84 -2.94 0.00 0.00 177.10 172.44 3m2p n GLU 121 N -1.31 0.27 0.00 3.55 0.00 -1.26 0.02 120.64 121.91 3m2p n GLU 121 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.27 3m2p n GLU 121 Cb 0.63 -1.13 0.08 0.00 0.00 0.00 0.00 31.44 31.01 3m2p n GLU 121 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3m2p n LYS 122 N -0.63 2.05 -2.02 3.44 5.02 -1.26 -4.94 118.16 119.82 3m2p n LYS 122 Ca 0.02 -1.74 -0.42 0.00 -2.02 0.00 0.00 58.31 54.15 3m2p n LYS 122 Cb 0.01 -1.44 -0.03 0.00 -0.02 0.00 0.00 35.03 33.55 3m2p n LYS 122 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3m2p s GLU 123 N -1.97 4.24 0.01 1.97 2.56 0.10 -4.95 118.70 120.67 3m2p s GLU 123 Ca 0.25 2.24 -0.32 0.00 0.00 0.00 0.00 54.97 57.15 3m2p s GLU 123 Cb 0.19 -3.33 -0.10 0.00 2.00 0.00 0.00 34.13 32.88 3m2p s GLU 123 CO 0.32 -0.59 1.92 1.28 -0.56 0.00 0.00 175.26 177.63 3m2p n LEU 124 N 4.51 3.89 -4.75 2.70 4.77 -1.26 -4.92 117.00 121.94 3m2p n LEU 124 Ca 0.14 0.94 -0.38 0.00 -0.03 0.00 0.00 56.01 56.68 3m2p n LEU 124 Cb 0.40 -1.48 0.04 0.00 -2.33 0.00 0.00 43.42 40.06 3m2p n LEU 124 CO 0.61 0.10 0.98 -2.84 -1.33 0.00 0.00 177.39 174.91 3m2p s PRO 125 N 4.00 3.09 -0.46 3.23 0.02 -1.26 -4.87 135.00 138.75 3m2p s PRO 125 Ca 0.89 2.23 0.05 0.00 0.02 0.00 0.00 61.00 64.19 3m2p s PRO 125 Cb -0.53 -2.22 0.19 0.00 0.02 0.00 0.00 34.50 31.96 3m2p s PRO 125 CO 0.44 -1.23 0.76 -1.17 -0.33 0.00 0.00 177.00 175.48 3m2p s LEU 126 N -3.60 -1.28 0.50 -5.54 0.20 0.86 -4.98 118.68 104.84 3m2p s LEU 126 Ca 0.73 -1.25 -0.19 0.00 0.69 0.00 0.00 54.13 54.11 3m2p s LEU 126 Cb -0.40 1.67 -0.08 0.00 -0.43 0.00 0.00 46.19 46.95 3m2p s LEU 126 CO 0.47 -0.08 1.02 -2.84 -0.29 0.00 0.00 176.35 174.64 3m2p s PRO 127 N 1.20 3.79 -0.07 0.98 0.02 -1.25 -3.28 135.00 136.39 3m2p s PRO 127 Ca 0.25 1.22 0.21 0.00 0.02 0.00 0.00 61.00 62.70 3m2p s PRO 127 Cb 0.01 -2.10 -0.29 0.00 0.02 0.00 0.00 34.50 32.13 3m2p s PRO 127 CO -0.07 -0.42 0.39 -0.25 -0.33 0.00 0.00 177.00 176.32 3m2p n ASP 128 N -1.23 0.07 0.00 2.53 8.00 -1.26 -4.92 116.55 119.73 3m2p n ASP 128 Ca 0.08 0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.61 3m2p n ASP 128 Cb 0.53 1.56 0.00 0.00 -0.02 0.00 0.00 41.12 43.19 3m2p n ASP 128 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3m2p n LEU 129 N -2.45 0.00 0.00 0.64 4.77 -1.26 -5.02 117.00 113.68 3m2p n LEU 129 Ca -0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 3m2p n LEU 129 Cb 0.76 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 3m2p n LEU 129 CO 0.45 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.51 3m2p n TYR 131 N 0.00 0.00 0.40 -1.77 9.36 -1.26 -2.07 117.16 121.82 3m2p n TYR 131 Ca 0.00 0.00 -0.18 0.00 3.32 0.00 0.00 57.90 61.04 3m2p n TYR 131 Cb 0.00 0.00 -0.09 0.00 -0.63 0.00 0.00 39.34 38.62 3m2p n TYR 131 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 3m2p h GLY 132 N 0.00 -1.06 -0.73 2.98 0.00 -1.96 -1.86 103.07 100.44 3m2p h GLY 132 Ca 0.00 0.39 0.17 0.00 0.00 0.00 0.00 47.33 47.89 3m2p h GLY 132 CO 0.00 -0.38 -0.23 -2.08 0.00 0.00 0.00 176.54 173.84 3m2p h VAL 133 N -1.10 0.13 0.40 4.60 2.07 -1.71 -0.23 116.25 120.42 3m2p h VAL 133 Ca -0.10 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 3m2p h VAL 133 Cb 0.79 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 3m2p h VAL 133 CO 0.17 0.00 -0.27 -1.28 0.02 0.00 0.00 177.57 176.21 3m2p h SER 134 N -0.01 -0.69 -0.60 0.57 0.87 -1.82 -1.27 113.55 110.61 3m2p h SER 134 Ca 0.40 0.05 0.12 0.00 -1.23 0.00 0.00 61.79 61.13 3m2p h SER 134 Cb 0.63 0.21 -0.09 0.00 -0.44 0.00 0.00 62.40 62.71 3m2p h SER 134 CO -0.89 -0.42 0.08 0.11 -0.53 0.00 0.00 176.83 175.18 3m2p h LYS 135 N -0.66 0.20 -0.59 2.24 1.79 -0.47 0.32 116.57 119.40 3m2p h LYS 135 Ca -0.04 -0.01 0.10 0.00 -2.18 0.00 0.00 60.65 58.52 3m2p h LYS 135 Cb 0.55 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.12 3m2p h LYS 135 CO 0.03 0.13 0.40 1.25 -1.08 0.00 0.00 179.45 180.17 3m2p h LEU 136 N 0.20 0.34 -0.09 2.94 6.46 -0.75 -1.74 115.31 122.66 3m2p h LEU 136 Ca 0.31 0.01 -0.17 0.00 -0.12 0.00 0.00 57.88 57.92 3m2p h LEU 136 Cb 0.48 -0.06 0.01 0.00 -0.73 0.00 0.00 40.66 40.36 3m2p h LEU 136 CO -0.44 0.20 -0.59 0.00 -0.62 0.00 0.00 178.44 176.99 3m2p h ALA 137 N 1.70 0.20 0.00 1.25 0.00 0.80 -3.09 119.26 120.12 3m2p h ALA 137 Ca 0.27 -0.54 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 3m2p h ALA 137 Cb 0.58 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3m2p h ALA 137 CO -0.07 0.44 -0.23 0.00 0.00 0.00 0.00 179.25 179.39 3m2p h GLU 139 N 0.00 0.22 0.00 0.00 5.08 -1.29 -2.09 114.58 116.50 3m2p h GLU 139 Ca -0.00 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 3m2p h GLU 139 Cb 0.40 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 3m2p h GLU 139 CO 0.03 0.18 -0.52 0.45 -1.00 0.00 0.00 179.01 178.15 3m2p h HIS 140 N 0.20 0.00 -0.09 4.33 3.86 -1.39 -0.31 115.15 121.75 3m2p h HIS 140 Ca 0.06 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.30 3m2p h HIS 140 Cb 0.01 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.44 3m2p h HIS 140 CO -0.06 0.52 -0.12 0.82 0.86 0.00 0.00 177.93 179.95 3m2p h ILE 141 N 0.00 0.67 -0.49 2.45 2.04 -1.03 0.13 117.51 121.29 3m2p h ILE 141 Ca -0.01 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 3m2p h ILE 141 Cb 1.06 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 3m2p h ILE 141 CO 0.07 0.00 0.30 1.23 0.00 0.00 0.00 178.15 179.75 3m2p h GLY 142 N -0.16 0.71 0.21 5.37 0.00 -1.17 -2.13 103.07 105.89 3m2p h GLY 142 Ca 0.07 -0.29 0.09 0.00 0.00 0.00 0.00 47.33 47.21 3m2p h GLY 142 CO -0.18 0.28 -0.00 3.43 0.00 0.00 0.00 176.54 180.07 3m2p h ASN 143 N 0.66 -0.20 -0.24 0.19 -0.26 -0.64 0.14 115.58 115.22 3m2p h ASN 143 Ca 0.18 0.11 -0.01 0.00 -0.56 0.00 0.00 56.30 56.02 3m2p h ASN 143 Cb -0.02 0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 37.43 3m2p h ASN 143 CO -0.03 -0.07 0.10 0.40 -1.06 0.00 0.00 177.43 176.77 3m2p h ILE 144 N 0.11 1.17 0.00 2.81 2.04 -0.48 -1.01 117.51 122.15 3m2p h ILE 144 Ca 0.24 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 3m2p h ILE 144 Cb 0.36 1.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 3m2p h ILE 144 CO -0.40 0.17 -0.02 1.88 0.00 0.00 0.00 178.15 179.78 3m2p h TYR 145 N 0.24 0.00 -0.01 1.37 -1.99 -0.81 -0.14 116.97 115.62 3m2p h TYR 145 Ca 0.08 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.66 3m2p h TYR 145 Cb 0.17 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.91 3m2p h TYR 145 CO -0.01 0.02 -0.57 0.77 -0.00 0.00 0.00 178.16 178.37 3m2p h SER 146 N 0.00 0.52 0.67 3.88 0.02 0.14 0.19 113.55 118.98 3m2p h SER 146 Ca -0.00 -0.75 -0.16 0.00 -0.84 0.00 0.00 61.79 60.05 3m2p h SER 146 Cb 0.04 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 3m2p h SER 146 CO 0.00 1.20 -0.74 0.03 -1.14 0.00 0.00 176.83 176.18 3m2p h ARG 147 N -0.10 0.05 0.00 3.45 3.08 -0.98 -3.02 114.38 116.86 3m2p h ARG 147 Ca -0.07 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.93 3m2p h ARG 147 Cb 1.28 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.34 3m2p h ARG 147 CO 0.11 0.77 -1.02 1.63 -1.07 0.00 0.00 179.97 180.39 3m2p n LYS 148 N -3.69 1.80 -0.01 0.04 5.02 -0.09 -4.51 118.16 116.73 3m2p n LYS 148 Ca -0.01 -0.05 0.01 0.00 -2.02 0.00 0.00 58.31 56.23 3m2p n LYS 148 Cb 0.72 -1.11 0.01 0.00 -0.02 0.00 0.00 35.03 34.63 3m2p n LYS 148 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3m2p n LYS 149 N -1.58 2.73 -2.24 1.97 4.76 0.65 -4.97 118.16 119.49 3m2p n LYS 149 Ca -0.00 -1.52 -0.13 0.00 -2.87 0.00 0.00 58.31 53.79 3m2p n LYS 149 Cb 0.20 -1.01 -0.02 0.00 -1.84 0.00 0.00 35.03 32.37 3m2p n LYS 149 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3m2p n GLY 150 N -0.54 -0.17 3.84 0.72 0.00 -1.14 -4.93 105.19 102.97 3m2p n GLY 150 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 3m2p n GLY 150 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3m2p s LEU 151 N -5.29 3.76 -0.73 0.99 2.96 -1.03 -4.89 118.68 114.45 3m2p s LEU 151 Ca 0.00 1.56 0.04 0.00 -0.22 0.00 0.00 54.13 55.50 3m2p s LEU 151 Cb 0.00 -4.46 0.26 0.00 0.50 0.00 0.00 46.19 42.49 3m2p s LEU 151 CO 0.00 -0.49 0.88 0.00 -1.32 0.00 0.00 176.35 175.42 3m2p s ILE 153 N -2.46 5.02 -0.42 0.00 1.01 -1.25 -2.88 121.20 120.21 3m2p s ILE 153 Ca 0.37 1.07 -0.12 0.00 0.00 0.00 0.00 60.65 61.98 3m2p s ILE 153 Cb 0.11 -3.90 0.06 0.00 0.01 0.00 0.00 42.46 38.75 3m2p s ILE 153 CO -0.00 0.07 0.29 -0.54 0.00 0.00 0.00 174.94 174.76 3m2p s LYS 154 N 2.25 2.77 -0.14 2.79 1.02 -0.68 -2.42 119.74 125.33 3m2p s LYS 154 Ca 0.25 -1.34 -0.29 0.00 0.02 0.00 0.00 55.97 54.61 3m2p s LYS 154 Cb -0.16 -3.88 -0.01 0.00 -0.52 0.00 0.00 37.83 33.27 3m2p s LYS 154 CO 0.09 -0.92 1.06 -0.80 -0.92 0.00 0.00 175.35 173.87 3m2p s ASN 155 N 2.12 7.15 -0.40 2.83 0.02 0.19 -1.67 114.94 125.18 3m2p s ASN 155 Ca 0.03 1.54 -0.07 0.00 -1.02 0.00 0.00 52.86 53.34 3m2p s ASN 155 Cb -0.22 -2.55 0.08 0.00 0.02 0.00 0.00 41.25 38.58 3m2p s ASN 155 CO 0.05 -0.56 0.22 -0.76 0.02 0.00 0.00 177.10 176.07 3m2p s LEU 156 N 2.50 5.03 -1.13 0.60 1.43 -0.32 -0.67 118.68 126.12 3m2p s LEU 156 Ca 0.49 -1.58 -0.21 0.00 -1.03 0.00 0.00 54.13 51.79 3m2p s LEU 156 Cb -0.18 -1.92 0.03 0.00 0.03 0.00 0.00 46.19 44.14 3m2p s LEU 156 CO 0.15 -0.51 1.66 -0.13 0.23 0.00 0.00 176.35 177.75 3m2p s ARG 157 N 1.35 3.52 0.39 1.70 0.52 0.86 -0.32 118.95 126.97 3m2p s ARG 157 Ca 0.03 -1.37 -0.27 0.00 -0.52 0.00 0.00 55.73 53.60 3m2p s ARG 157 Cb -0.23 -5.38 -0.10 0.00 0.52 0.00 0.00 34.95 29.76 3m2p s ARG 157 CO 0.00 -2.53 1.45 -0.06 0.02 0.00 0.00 175.30 174.18 3m2p s PHE 158 N 5.85 2.60 0.52 -0.53 0.08 -1.08 -1.83 117.98 123.59 3m2p s PHE 158 Ca 0.54 1.22 -0.09 0.00 0.12 0.00 0.00 56.93 58.72 3m2p s PHE 158 Cb 0.01 -3.96 0.13 0.00 -0.57 0.00 0.00 43.02 38.63 3m2p s PHE 158 CO 0.00 -2.85 0.57 0.00 -0.10 0.00 0.00 175.22 172.83 3m2p n ALA 159 N 0.30 -1.20 -1.98 5.36 0.00 -1.02 -0.86 120.51 121.11 3m2p n ALA 159 Ca 0.02 -0.79 -0.42 0.00 0.00 0.00 0.00 53.44 52.25 3m2p n ALA 159 Cb 0.40 -0.05 -0.03 0.00 0.00 0.00 0.00 19.45 19.78 3m2p n ALA 159 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3m2p s HIS 160 N -2.14 1.90 0.18 0.00 3.76 -0.61 -4.62 115.29 113.76 3m2p s HIS 160 Ca 0.34 0.21 -0.30 0.00 -0.15 0.00 0.00 55.06 55.16 3m2p s HIS 160 Cb -0.02 -3.96 -0.07 0.00 1.11 0.00 0.00 32.58 29.64 3m2p s HIS 160 CO 0.25 -3.87 0.95 -0.51 -0.85 0.00 0.00 174.74 170.71 3m2p s LEU 161 N 4.44 4.58 0.08 0.89 1.02 -1.26 -0.16 118.68 128.27 3m2p s LEU 161 Ca 0.76 1.87 0.03 0.00 0.02 0.00 0.00 54.13 56.80 3m2p s LEU 161 Cb -0.33 -3.59 -0.03 0.00 0.02 0.00 0.00 46.19 42.26 3m2p s LEU 161 CO 0.31 0.05 -0.09 -0.72 0.02 0.00 0.00 176.35 175.92 3m2p s TYR 162 N -0.61 0.91 0.00 0.29 1.13 -1.07 -4.91 117.35 113.09 3m2p s TYR 162 Ca 0.44 -0.67 0.00 0.00 -1.41 0.00 0.00 57.07 55.43 3m2p s TYR 162 Cb -0.25 -0.52 0.00 0.00 -1.10 0.00 0.00 41.96 40.10 3m2p s TYR 162 CO 0.31 -0.06 0.00 0.41 -2.51 0.00 0.00 175.55 173.70 3m2p n GLY 163 N 0.70 3.17 3.33 5.49 0.00 -1.26 -0.87 105.19 115.75 3m2p n GLY 163 Ca -0.17 -0.74 -0.39 0.00 0.00 0.00 0.00 46.02 44.73 3m2p n GLY 163 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3m2p s PHE 164 N -2.56 3.23 0.00 1.61 5.36 -1.26 -4.80 117.98 119.56 3m2p s PHE 164 Ca 0.00 -1.14 0.00 0.00 -0.96 0.00 0.00 56.93 54.83 3m2p s PHE 164 Cb 0.00 -2.34 0.00 0.00 -0.34 0.00 0.00 43.02 40.34 3m2p s PHE 164 CO 0.00 -0.66 0.00 -1.71 -1.46 0.00 0.00 175.22 171.39 3m2p n ASN 165 N 4.90 -1.59 0.00 6.13 4.05 -1.26 -5.18 115.26 122.31 3m2p n ASN 165 Ca -0.13 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.90 3m2p n ASN 165 Cb 0.46 -0.79 0.00 0.00 1.23 0.00 0.00 39.78 40.68 3m2p n ASN 165 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 177.26 175.42 3m2p n GLU 166 N -0.23 0.00 -0.45 1.20 2.13 -1.26 -5.10 120.64 116.93 3m2p n GLU 166 Ca 0.00 0.00 0.09 0.00 0.66 0.00 0.00 57.16 57.91 3m2p n GLU 166 Cb 0.00 0.00 0.29 0.00 0.27 0.00 0.00 31.44 32.00 3m2p n GLU 166 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3m2p n ASN 169 N 0.00 4.09 0.00 4.31 5.03 -1.26 -5.18 115.26 122.26 3m2p n ASN 169 Ca 0.00 -2.31 0.00 0.00 0.87 0.00 0.00 54.58 53.14 3m2p n ASN 169 Cb 0.00 -0.48 0.00 0.00 -1.02 0.00 0.00 39.78 38.28 3m2p n ASN 169 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3m2p n TYR 170 N 0.93 0.00 0.00 3.10 4.01 -1.26 -4.69 117.16 119.25 3m2p n TYR 170 Ca 0.22 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.96 3m2p n TYR 170 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.76 3m2p n TYR 170 CO 0.00 0.00 0.00 1.51 -0.46 0.00 0.00 176.86 177.91 3m2p n ILE 172 N 0.00 0.00 -0.10 -0.72 0.13 -1.26 -1.44 119.36 115.97 3m2p n ILE 172 Ca 0.00 0.00 -0.12 0.00 -1.10 0.00 0.00 62.75 61.53 3m2p n ILE 172 Cb 0.00 0.00 -0.04 0.00 -0.84 0.00 0.00 39.64 38.76 3m2p n ILE 172 CO 0.00 0.00 0.00 0.78 2.80 0.00 0.00 176.55 180.13 3m2p h ASN 173 N 0.00 0.63 -0.23 9.51 2.35 -1.97 -2.56 115.58 123.31 3m2p h ASN 173 Ca 0.00 -0.39 0.06 0.00 -0.55 0.00 0.00 56.30 55.42 3m2p h ASN 173 Cb 0.00 -0.17 -0.07 0.00 0.05 0.00 0.00 38.32 38.13 3m2p h ASN 173 CO 0.00 0.88 -0.21 0.03 -1.65 0.00 0.00 177.43 176.49 3m2p h ARG 174 N 0.38 -0.20 -0.25 0.81 3.08 -1.52 -0.78 114.38 115.89 3m2p h ARG 174 Ca 0.07 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.19 3m2p h ARG 174 Cb 0.63 0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.67 3m2p h ARG 174 CO 0.04 -0.13 -0.12 0.74 -1.07 0.00 0.00 179.97 179.43 3m2p h PHE 175 N -0.21 -0.28 -0.12 3.04 0.04 -1.83 0.38 116.94 117.96 3m2p h PHE 175 Ca 0.13 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.97 3m2p h PHE 175 Cb 0.41 0.16 -0.07 0.00 2.20 0.00 0.00 35.95 38.66 3m2p h PHE 175 CO -0.36 -0.18 -0.48 0.74 -0.60 0.00 0.00 178.31 177.43 3m2p h PHE 176 N -0.08 -1.39 0.32 -0.55 0.04 -0.93 0.48 116.94 114.82 3m2p h PHE 176 Ca 0.13 0.05 -0.00 0.00 2.80 0.00 0.00 57.97 60.95 3m2p h PHE 176 Cb 0.29 0.63 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 3m2p h PHE 176 CO -0.30 -0.51 -0.26 0.00 -0.60 0.00 0.00 178.31 176.64 3m2p h ARG 177 N -0.55 -0.56 0.28 1.51 -0.00 -0.90 -1.48 114.38 112.69 3m2p h ARG 177 Ca 0.06 0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.58 3m2p h ARG 177 Cb 0.66 0.13 -0.02 0.00 0.00 0.00 0.00 29.97 30.73 3m2p h ARG 177 CO -0.41 -0.38 -0.31 1.96 0.00 0.00 0.00 179.97 180.83 3m2p h GLN 178 N -0.58 -0.61 -0.37 0.04 4.20 0.33 -1.48 115.11 116.63 3m2p h GLN 178 Ca -0.02 0.04 0.04 0.00 0.06 0.00 0.00 58.65 58.77 3m2p h GLN 178 Cb 0.51 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 3m2p h GLN 178 CO -0.02 -0.41 0.25 0.00 -0.67 0.00 0.00 178.83 177.99 3m2p h ALA 179 N -0.07 1.90 -0.57 3.87 0.00 -0.09 -2.00 119.26 122.30 3m2p h ALA 179 Ca -0.01 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3m2p h ALA 179 Cb 0.59 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3m2p h ALA 179 CO -0.08 0.05 0.17 0.35 0.00 0.00 0.00 179.25 179.73 3m2p h PHE 180 N 0.36 0.88 -0.28 0.00 3.57 -0.24 -1.09 116.94 120.14 3m2p h PHE 180 Ca 0.15 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.58 3m2p h PHE 180 Cb 0.17 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.65 3m2p h PHE 180 CO -0.00 0.72 0.00 0.72 -2.23 0.00 0.00 178.31 177.52 3m2p n HIS 181 N -4.29 0.39 -2.98 0.41 8.25 -0.79 -4.95 115.22 111.26 3m2p n HIS 181 Ca 0.04 -0.19 -0.07 0.00 -0.26 0.00 0.00 57.72 57.25 3m2p n HIS 181 Cb 0.21 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.31 3m2p n HIS 181 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3m2p n GLY 182 N 0.92 -1.23 3.13 -1.41 0.00 -0.41 -5.05 105.19 101.14 3m2p n GLY 182 Ca 0.09 0.95 -0.11 0.00 0.00 0.00 0.00 46.02 46.95 3m2p n GLY 182 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3m2p s GLU 183 N -2.81 0.55 -0.06 1.61 2.12 -0.95 -5.00 118.70 114.15 3m2p s GLU 183 Ca 0.16 -0.44 -0.30 0.00 0.36 0.00 0.00 54.97 54.75 3m2p s GLU 183 Cb -0.04 0.23 -0.06 0.00 0.26 0.00 0.00 34.13 34.52 3m2p s GLU 183 CO 0.77 -0.14 1.72 -1.14 -0.54 0.00 0.00 175.26 175.93 3m2p s GLN 184 N -1.65 4.10 0.27 4.30 0.74 -1.26 -4.24 119.66 121.91 3m2p s GLN 184 Ca -0.12 2.19 -0.30 0.00 0.05 0.00 0.00 55.36 57.18 3m2p s GLN 184 Cb -0.06 -4.03 -0.09 0.00 1.10 0.00 0.00 33.01 29.93 3m2p s GLN 184 CO 0.01 -0.95 1.05 -0.51 -0.55 0.00 0.00 175.29 174.33 3m2p s LEU 185 N 4.37 4.58 0.21 3.68 1.02 -0.67 -4.90 118.68 126.96 3m2p s LEU 185 Ca 0.76 2.17 0.09 0.00 0.02 0.00 0.00 54.13 57.18 3m2p s LEU 185 Cb -0.34 -3.63 -0.05 0.00 0.02 0.00 0.00 46.19 42.20 3m2p s LEU 185 CO 0.31 -0.06 -0.18 0.42 0.02 0.00 0.00 176.35 176.87 3m2p s THR 186 N -1.17 1.96 -0.07 5.49 -4.23 -1.26 0.94 115.64 117.30 3m2p s THR 186 Ca 0.44 -2.14 0.00 0.00 -1.18 0.00 0.00 61.69 58.81 3m2p s THR 186 Cb -0.30 -2.03 0.02 0.00 1.34 0.00 0.00 72.50 71.53 3m2p s THR 186 CO 0.38 -0.43 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.22 3m2p s LEU 187 N -3.09 1.16 0.22 4.79 1.43 0.11 -4.91 118.68 118.38 3m2p s LEU 187 Ca 0.22 -0.19 -0.17 0.00 -1.03 0.00 0.00 54.13 52.96 3m2p s LEU 187 Cb -0.04 -0.60 0.22 0.00 0.03 0.00 0.00 46.19 45.80 3m2p s LEU 187 CO 0.09 -0.09 1.58 -0.74 0.23 0.00 0.00 176.35 177.41 3m2p h HIS 188 N 7.68 -0.83 -4.27 0.29 -0.00 -1.95 -2.01 115.15 114.06 3m2p h HIS 188 Ca -0.30 0.08 -0.32 0.00 -0.00 0.00 0.00 60.37 59.83 3m2p h HIS 188 Cb 1.15 0.48 -0.09 0.00 -0.00 0.00 0.00 27.41 28.95 3m2p h HIS 188 CO 0.49 -0.38 -0.24 0.00 -0.00 0.00 0.00 177.93 177.79 3m2p s ALA 189 N -6.06 0.99 0.38 5.26 0.00 -1.26 -1.27 121.76 119.80 3m2p s ALA 189 Ca -0.14 -1.63 -0.21 0.00 0.00 0.00 0.00 51.96 49.98 3m2p s ALA 189 Cb 0.19 1.21 -0.10 0.00 0.00 0.00 0.00 23.12 24.42 3m2p s ALA 189 CO 0.72 -0.77 0.90 -0.80 0.00 0.00 0.00 175.76 175.81 3m2p s ASN 190 N -3.27 6.99 0.02 0.00 0.01 -1.16 -4.63 114.94 112.90 3m2p s ASN 190 Ca 0.32 1.63 -0.00 0.00 -0.71 0.00 0.00 52.86 54.11 3m2p s ASN 190 Cb 0.00 -2.51 -0.02 0.00 0.41 0.00 0.00 41.25 39.13 3m2p s ASN 190 CO 0.22 -0.26 -0.03 -0.55 -1.51 0.00 0.00 177.10 174.98 3m2p s SER 191 N -2.06 0.21 0.00 -1.22 0.15 -1.26 -1.27 113.70 108.24 3m2p s SER 191 Ca 0.57 -0.43 0.22 0.00 0.70 0.00 0.00 55.95 57.01 3m2p s SER 191 Cb -0.11 0.09 -0.10 0.00 -1.71 0.00 0.00 66.02 64.18 3m2p s SER 191 CO 0.16 -0.26 1.00 0.52 1.20 0.00 0.00 173.24 175.87 3m2p n VAL 192 N 1.81 0.00 -2.10 4.45 0.31 -1.26 -4.74 118.33 116.80 3m2p n VAL 192 Ca -0.22 -0.16 -0.40 0.00 -0.01 0.00 0.00 64.34 63.54 3m2p n VAL 192 Cb 0.56 1.15 -0.02 0.00 -0.91 0.00 0.00 33.84 34.62 3m2p n VAL 192 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3m2p s ALA 193 N -2.67 3.47 -0.13 3.52 0.00 -1.26 -4.94 121.76 119.74 3m2p s ALA 193 Ca 0.14 1.26 0.01 0.00 0.00 0.00 0.00 51.96 53.37 3m2p s ALA 193 Cb 0.17 -3.48 -0.01 0.00 0.00 0.00 0.00 23.12 19.80 3m2p s ALA 193 CO 0.68 -0.67 -0.16 0.15 0.00 0.00 0.00 175.76 175.76 3m2p s LYS 194 N -1.87 3.25 -0.04 0.00 1.02 -1.26 -4.18 119.74 116.66 3m2p s LYS 194 Ca 0.50 -0.75 0.05 0.00 0.02 0.00 0.00 55.97 55.79 3m2p s LYS 194 Cb -0.40 -2.54 -0.01 0.00 -0.52 0.00 0.00 37.83 34.36 3m2p s LYS 194 CO 0.53 0.15 -0.21 1.03 -0.92 0.00 0.00 175.35 175.93 3m2p s ARG 195 N 0.47 2.04 -0.13 1.68 0.52 0.36 -0.28 118.95 123.61 3m2p s ARG 195 Ca -0.12 -0.74 -0.21 0.00 -0.52 0.00 0.00 55.73 54.15 3m2p s ARG 195 Cb -0.16 -1.78 -0.03 0.00 0.52 0.00 0.00 34.95 33.49 3m2p s ARG 195 CO 0.05 0.33 0.60 -2.00 0.02 0.00 0.00 175.30 174.30 3m2p s GLU 196 N -0.12 4.33 -0.23 3.54 2.12 0.12 -0.68 118.70 127.78 3m2p s GLU 196 Ca -0.02 0.65 -0.01 0.00 0.36 0.00 0.00 54.97 55.95 3m2p s GLU 196 Cb -0.12 -3.49 0.03 0.00 0.26 0.00 0.00 34.13 30.81 3m2p s GLU 196 CO 0.02 -0.01 -0.09 -0.06 -0.54 0.00 0.00 175.26 174.57 3m2p s PHE 197 N 1.14 3.02 -0.26 5.30 0.40 -1.23 -1.57 117.98 124.77 3m2p s PHE 197 Ca 0.31 -1.61 -0.08 0.00 -0.60 0.00 0.00 56.93 54.95 3m2p s PHE 197 Cb -0.16 -2.02 -0.03 0.00 0.51 0.00 0.00 43.02 41.32 3m2p s PHE 197 CO 0.13 -0.75 0.10 -1.17 0.70 0.00 0.00 175.22 174.23 3m2p s LEU 198 N 1.31 3.60 0.31 -0.37 2.96 0.78 -4.67 118.68 122.59 3m2p s LEU 198 Ca 0.01 -0.23 -0.30 0.00 -0.22 0.00 0.00 54.13 53.39 3m2p s LEU 198 Cb -0.16 -1.96 -0.11 0.00 0.50 0.00 0.00 46.19 44.46 3m2p s LEU 198 CO -0.06 -0.06 1.59 -0.47 -1.32 0.00 0.00 176.35 176.03 3m2p s TYR 199 N 1.63 2.71 0.32 5.38 5.04 -1.26 -2.59 117.35 128.59 3m2p s TYR 199 Ca 0.06 0.82 0.07 0.00 -2.44 0.00 0.00 57.07 55.57 3m2p s TYR 199 Cb -0.15 -4.08 0.74 0.00 0.35 0.00 0.00 41.96 38.82 3m2p s TYR 199 CO 0.05 -3.57 1.82 0.00 -1.34 0.00 0.00 175.55 172.51 3m2p h ALA 200 N 4.60 1.73 -0.77 3.97 0.00 -1.39 -1.14 119.26 126.26 3m2p h ALA 200 Ca -0.48 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 3m2p h ALA 200 Cb 1.22 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 3m2p h ALA 200 CO 0.77 -0.03 0.40 -0.22 0.00 0.00 0.00 179.25 180.17 3m2p h LYS 201 N 0.78 1.09 0.00 0.00 3.64 -1.90 -0.36 116.57 119.81 3m2p h LYS 201 Ca 0.52 -0.14 -0.07 0.00 -1.27 0.00 0.00 60.65 59.69 3m2p h LYS 201 Cb 0.78 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 3m2p h LYS 201 CO -0.29 0.82 -0.32 -0.44 -2.27 0.00 0.00 179.45 176.95 3m2p h ASP 202 N 1.09 0.00 -0.01 4.20 3.32 -1.61 -1.94 116.42 121.46 3m2p h ASP 202 Ca 0.27 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 57.08 3m2p h ASP 202 Cb 0.07 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.63 3m2p h ASP 202 CO -0.04 0.32 -0.91 0.00 -1.72 0.00 0.00 179.24 176.89 3m2p h ALA 203 N 1.68 0.13 0.00 3.45 0.00 -0.41 -2.19 119.26 121.91 3m2p h ALA 203 Ca -0.00 -0.66 -0.04 0.00 0.00 0.00 0.00 54.91 54.21 3m2p h ALA 203 Cb 0.92 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3m2p h ALA 203 CO 0.04 0.60 -0.17 0.00 0.00 0.00 0.00 179.25 179.72 3m2p h ALA 204 N 0.39 1.65 -0.12 0.00 0.00 -1.07 -2.09 119.26 118.03 3m2p h ALA 204 Ca -0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 3m2p h ALA 204 Cb 1.58 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 3m2p h ALA 204 CO 0.18 0.21 0.00 -0.22 0.00 0.00 0.00 179.25 179.43 3m2p h LYS 205 N 0.00 0.21 -0.04 0.00 3.64 -1.17 -2.62 116.57 116.58 3m2p h LYS 205 Ca -0.00 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 3m2p h LYS 205 Cb 0.31 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 3m2p h LYS 205 CO 0.02 0.44 -0.14 0.66 -2.27 0.00 0.00 179.45 178.16 3m2p h SER 206 N -0.05 0.06 -0.26 4.20 4.64 -1.08 -1.42 113.55 119.64 3m2p h SER 206 Ca 0.03 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.34 3m2p h SER 206 Cb 0.34 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 3m2p h SER 206 CO 0.01 0.21 0.14 0.58 -0.87 0.00 0.00 176.83 176.90 3m2p h VAL 207 N 0.06 1.12 -0.33 0.95 2.07 -1.25 -1.27 116.25 117.60 3m2p h VAL 207 Ca 0.01 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.24 3m2p h VAL 207 Cb 0.29 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 3m2p h VAL 207 CO 0.02 0.12 0.11 0.40 0.02 0.00 0.00 177.57 178.24 3m2p h ILE 208 N 0.31 0.90 0.00 4.57 1.08 -0.91 -0.63 117.51 122.82 3m2p h ILE 208 Ca 0.09 -0.08 -0.10 0.00 -0.39 0.00 0.00 64.86 64.37 3m2p h ILE 208 Cb 0.07 0.63 -0.01 0.00 -3.07 0.00 0.00 36.82 34.44 3m2p h ILE 208 CO -0.01 0.04 -0.50 1.88 -0.69 0.00 0.00 178.15 178.87 3m2p h TYR 209 N 0.24 0.00 0.01 1.37 -1.99 -1.20 -2.43 116.97 112.97 3m2p h TYR 209 Ca 0.15 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.69 3m2p h TYR 209 Cb 0.13 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.84 3m2p h TYR 209 CO -0.14 0.50 -0.88 0.00 -0.00 0.00 0.00 178.16 177.63 3m2p h ALA 210 N 1.50 0.55 0.00 3.88 0.00 -1.03 -2.76 119.26 121.40 3m2p h ALA 210 Ca -0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.12 3m2p h ALA 210 Cb 0.93 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.60 3m2p h ALA 210 CO 0.06 1.05 0.00 1.28 0.00 0.00 0.00 179.25 181.64 3m2p n LEU 211 N -3.54 0.06 0.08 0.00 4.77 -0.26 -2.28 117.00 115.83 3m2p n LEU 211 Ca -0.01 0.51 -0.11 0.00 -0.03 0.00 0.00 56.01 56.37 3m2p n LEU 211 Cb 0.83 -0.50 -0.13 0.00 -2.33 0.00 0.00 43.42 41.29 3m2p n LEU 211 CO 0.46 -0.25 0.03 0.11 -1.33 0.00 0.00 177.39 176.41 3m2p h LYS 212 N 0.00 0.12 -3.29 3.23 1.57 -1.22 -3.35 116.57 113.63 3m2p h LYS 212 Ca 0.00 -0.21 -0.76 0.00 -1.87 0.00 0.00 60.65 57.81 3m2p h LYS 212 Cb 0.28 0.08 -0.15 0.00 0.08 0.00 0.00 32.23 32.52 3m2p h LYS 212 CO 0.00 1.09 2.05 1.04 -0.57 0.00 0.00 179.45 183.06 3m2p n GLN 213 N -3.43 3.86 0.32 3.15 1.13 -0.97 -4.82 117.38 116.63 3m2p n GLN 213 Ca -0.04 -3.56 0.22 0.00 -1.94 0.00 0.00 57.00 51.67 3m2p n GLN 213 Cb 0.98 -2.85 1.15 0.00 0.11 0.00 0.00 30.24 29.63 3m2p n GLN 213 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 3m2p h GLU 214 N 5.50 0.00 -0.01 -1.09 4.11 -1.77 0.16 114.58 121.47 3m2p h GLU 214 Ca 0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.88 3m2p h GLU 214 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3m2p h GLU 214 CO 1.59 0.00 -0.25 1.63 0.07 0.00 0.00 179.01 182.05 3m2p n LYS 215 N -3.03 1.63 -2.36 1.06 4.01 -1.26 -4.20 118.16 114.00 3m2p n LYS 215 Ca -0.03 -0.92 -0.40 0.00 -0.51 0.00 0.00 58.31 56.45 3m2p n LYS 215 Cb 0.09 -1.26 -0.04 0.00 -0.51 0.00 0.00 35.03 33.31 3m2p n LYS 215 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 3m2p s VAL 216 N -1.73 3.26 -0.04 -0.18 1.01 0.04 -4.95 120.40 117.81 3m2p s VAL 216 Ca 0.14 1.26 -0.01 0.00 0.00 0.00 0.00 61.98 63.37 3m2p s VAL 216 Cb 0.13 -3.80 0.03 0.00 0.00 0.00 0.00 36.38 32.74 3m2p s VAL 216 CO 0.35 0.30 0.07 -0.94 0.00 0.00 0.00 175.10 174.88 3m2p s SER 217 N -0.72 0.15 0.00 3.32 1.04 -1.26 -4.35 113.70 111.88 3m2p s SER 217 Ca 0.46 0.13 0.00 0.00 0.48 0.00 0.00 55.95 57.02 3m2p s SER 217 Cb -0.34 0.01 0.00 0.00 0.10 0.00 0.00 66.02 65.79 3m2p s SER 217 CO 0.44 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 175.12 3m2p n GLY 218 N 4.35 -0.57 2.93 7.32 0.00 -1.02 -4.98 105.19 113.23 3m2p n GLY 218 Ca -0.24 -0.70 -0.24 0.00 0.00 0.00 0.00 46.02 44.84 3m2p n GLY 218 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m2p s THR 219 N -3.17 0.85 -0.03 2.61 2.01 -1.26 -0.64 115.64 116.00 3m2p s THR 219 Ca 0.00 -0.26 0.04 0.00 0.31 0.00 0.00 61.69 61.79 3m2p s THR 219 Cb 0.00 -0.85 -0.01 0.00 0.01 0.00 0.00 72.50 71.66 3m2p s THR 219 CO 0.00 0.31 -0.16 -0.36 -0.69 0.00 0.00 174.62 173.73 3m2p s PHE 220 N 1.17 1.51 -0.00 4.92 0.40 0.15 -4.91 117.98 121.22 3m2p s PHE 220 Ca -0.06 -0.38 -0.30 0.00 -0.60 0.00 0.00 56.93 55.59 3m2p s PHE 220 Cb -0.14 -1.01 -0.04 0.00 0.51 0.00 0.00 43.02 42.34 3m2p s PHE 220 CO -0.02 -0.11 1.15 -0.80 0.70 0.00 0.00 175.22 176.14 3m2p s ASN 221 N -0.07 7.13 -0.81 1.36 0.02 -1.26 -0.10 114.94 121.20 3m2p s ASN 221 Ca -0.01 1.85 -0.01 0.00 -1.02 0.00 0.00 52.86 53.67 3m2p s ASN 221 Cb -0.09 -2.57 0.20 0.00 0.02 0.00 0.00 41.25 38.81 3m2p s ASN 221 CO 0.01 -0.48 0.67 -0.63 0.02 0.00 0.00 177.10 176.70 3m2p s ILE 222 N 1.56 4.08 0.52 0.60 -1.09 -0.76 -4.50 121.20 121.61 3m2p s ILE 222 Ca 0.56 -3.69 0.08 0.00 -2.23 0.00 0.00 60.65 55.37 3m2p s ILE 222 Cb -0.25 -3.57 0.06 0.00 -1.58 0.00 0.00 42.46 37.11 3m2p s ILE 222 CO 0.25 -1.03 0.72 -0.83 -1.23 0.00 0.00 174.94 172.82 3m2p s GLY 223 N -0.06 1.82 -0.19 6.18 0.00 -1.26 -2.43 107.32 111.38 3m2p s GLY 223 Ca 0.25 -1.88 0.09 0.00 0.00 0.00 0.00 44.72 43.17 3m2p s GLY 223 CO -0.11 -1.54 -0.06 -1.14 0.00 0.00 0.00 173.10 170.26 3m2p n SER 224 N -2.13 1.55 0.00 1.64 3.41 -1.26 -4.83 113.62 111.99 3m2p n SER 224 Ca 0.12 -0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 3m2p n SER 224 Cb 0.60 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.89 3m2p n SER 224 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3m2p n GLY 225 N 2.20 -2.07 0.00 5.00 0.00 -1.26 -4.78 105.19 104.29 3m2p n GLY 225 Ca -0.32 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.37 3m2p n GLY 225 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3m2p n ASP 226 N 0.00 0.00 -4.66 1.61 2.03 -1.26 -5.03 116.55 109.24 3m2p n ASP 226 Ca 0.00 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.90 3m2p n ASP 226 Cb 0.00 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.36 3m2p n ASP 226 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3m2p s ALA 227 N -0.22 3.57 0.16 -1.67 0.00 -1.26 -3.55 121.76 118.79 3m2p s ALA 227 Ca 0.00 -0.06 0.08 0.00 0.00 0.00 0.00 51.96 51.99 3m2p s ALA 227 Cb 0.00 -3.23 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 3m2p s ALA 227 CO 0.00 -0.75 -0.09 -0.51 0.00 0.00 0.00 175.76 174.41 3m2p s LEU 228 N 2.40 2.99 0.47 0.00 1.43 0.14 -4.66 118.68 121.46 3m2p s LEU 228 Ca 0.36 -0.53 -0.07 0.00 -1.03 0.00 0.00 54.13 52.86 3m2p s LEU 228 Cb -0.16 -1.71 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 3m2p s LEU 228 CO 0.10 0.12 0.80 0.42 0.23 0.00 0.00 176.35 178.03 3m2p s THR 229 N -1.58 4.85 0.37 5.49 -4.23 -1.26 -0.49 115.64 118.80 3m2p s THR 229 Ca 0.24 0.39 0.05 0.00 -1.18 0.00 0.00 61.69 61.19 3m2p s THR 229 Cb -0.09 -3.83 0.27 0.00 1.34 0.00 0.00 72.50 70.19 3m2p s THR 229 CO 0.15 -0.78 2.01 0.78 -0.54 0.00 0.00 174.62 176.24 3m2p h ASN 230 N 0.48 0.62 -0.25 3.99 -0.26 -1.85 -0.06 115.58 118.25 3m2p h ASN 230 Ca -0.47 -0.01 0.01 0.00 -0.56 0.00 0.00 56.30 55.27 3m2p h ASN 230 Cb 1.20 -0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 38.29 3m2p h ASN 230 CO 0.62 0.44 0.14 0.22 -1.06 0.00 0.00 177.43 177.79 3m2p h TYR 231 N 0.73 0.26 0.05 1.19 5.03 -1.94 -1.50 116.97 120.79 3m2p h TYR 231 Ca 0.23 0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.56 3m2p h TYR 231 Cb 0.01 -0.08 -0.02 0.00 1.55 0.00 0.00 36.73 38.19 3m2p h TYR 231 CO -0.00 0.15 -0.12 0.93 -1.32 0.00 0.00 178.16 177.80 3m2p h GLU 232 N 0.29 -0.22 -0.16 1.82 5.08 -1.46 -2.05 114.58 117.87 3m2p h GLU 232 Ca 0.10 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.52 3m2p h GLU 232 Cb 0.00 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 3m2p h GLU 232 CO -0.05 -0.15 -0.40 0.28 -1.00 0.00 0.00 179.01 177.69 3m2p h VAL 233 N -0.23 0.17 -0.39 3.13 2.07 -0.97 -1.15 116.25 118.87 3m2p h VAL 233 Ca 0.03 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.61 3m2p h VAL 233 Cb 0.26 0.17 -0.06 0.00 -1.52 0.00 0.00 31.29 30.14 3m2p h VAL 233 CO -0.08 0.00 0.05 0.00 0.02 0.00 0.00 177.57 177.56 3m2p h ALA 234 N 0.23 0.40 -0.09 1.67 0.00 -1.18 -1.13 119.26 119.16 3m2p h ALA 234 Ca 0.09 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.12 3m2p h ALA 234 Cb 0.61 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 3m2p h ALA 234 CO -0.41 -0.35 -0.11 -0.91 0.00 0.00 0.00 179.25 177.47 3m2p h ASN 235 N 0.17 -0.35 -0.68 0.00 2.35 -1.04 0.18 115.58 116.21 3m2p h ASN 235 Ca 0.19 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 56.00 3m2p h ASN 235 Cb 0.24 0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 3m2p h ASN 235 CO -0.27 -0.15 0.39 0.74 -1.65 0.00 0.00 177.43 176.49 3m2p h THR 236 N -0.15 1.21 -0.21 2.81 2.02 -0.87 0.29 112.91 118.00 3m2p h THR 236 Ca 0.07 -0.49 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 3m2p h THR 236 Cb 0.25 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 3m2p h THR 236 CO -0.18 0.22 0.08 0.40 0.37 0.00 0.00 175.52 176.41 3m2p h ILE 237 N 0.94 1.17 -0.39 3.11 2.04 -1.01 -2.74 117.51 120.62 3m2p h ILE 237 Ca 0.24 -0.50 0.08 0.00 1.00 0.00 0.00 64.86 65.68 3m2p h ILE 237 Cb 0.01 1.11 -0.09 0.00 -0.74 0.00 0.00 36.82 37.11 3m2p h ILE 237 CO -0.04 0.16 -0.36 0.78 0.00 0.00 0.00 178.15 178.69 3m2p h ASN 238 N 0.18 -1.19 0.47 1.72 -0.26 0.01 -1.56 115.58 114.95 3m2p h ASN 238 Ca 0.07 0.20 -0.02 0.00 -0.56 0.00 0.00 56.30 55.99 3m2p h ASN 238 Cb 0.18 0.54 -0.01 0.00 -1.06 0.00 0.00 38.32 37.97 3m2p h ASN 238 CO -0.01 -0.34 -0.39 0.78 -1.06 0.00 0.00 177.43 176.42 3m2p h ASN 239 N -0.28 -1.03 -1.32 5.81 4.21 -0.95 0.86 115.58 122.88 3m2p h ASN 239 Ca 0.16 0.07 0.38 0.00 1.21 0.00 0.00 56.30 58.13 3m2p h ASN 239 Cb 0.56 0.33 -0.07 0.00 -1.12 0.00 0.00 38.32 38.02 3m2p h ASN 239 CO -0.55 -0.54 0.93 0.00 -1.29 0.00 0.00 177.43 175.99 3m2p h ALA 240 N -1.20 3.11 -0.62 -0.83 0.00 -1.39 -1.71 119.26 116.63 3m2p h ALA 240 Ca -0.06 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.64 3m2p h ALA 240 Cb 0.70 0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.48 3m2p h ALA 240 CO 0.00 -1.52 0.20 1.19 0.00 0.00 0.00 179.25 179.11 3m2p n PHE 241 N -4.24 2.03 -1.79 0.00 3.01 -0.60 -4.92 117.46 110.95 3m2p n PHE 241 Ca 0.30 -1.24 -0.15 0.00 1.01 0.00 0.00 57.45 57.36 3m2p n PHE 241 Cb 1.35 -0.61 -0.04 0.00 -0.01 0.00 0.00 39.48 40.17 3m2p n PHE 241 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3m2p n GLY 242 N -0.42 0.75 2.29 1.37 0.00 -0.64 -4.77 105.19 103.75 3m2p n GLY 242 Ca 0.38 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.10 3m2p n GLY 242 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3m2p n ASN 243 N -1.13 6.20 -4.66 1.61 5.15 0.27 -5.03 115.26 117.66 3m2p n ASN 243 Ca -0.16 -3.77 -0.47 0.00 -0.60 0.00 0.00 54.58 49.57 3m2p n ASN 243 Cb 0.55 -0.67 -0.05 0.00 -0.53 0.00 0.00 39.78 39.09 3m2p n ASN 243 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3m2p n LYS 244 N -0.74 2.02 0.00 1.20 5.02 -1.22 -2.29 118.16 122.15 3m2p n LYS 244 Ca 0.51 0.73 0.00 0.00 -2.02 0.00 0.00 58.31 57.54 3m2p n LYS 244 Cb 0.74 -2.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.25 3m2p n LYS 244 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3m2p n ASP 245 N 4.06 0.00 -3.36 4.39 8.00 -1.26 -4.89 116.55 123.48 3m2p n ASP 245 Ca 0.19 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.39 3m2p n ASP 245 Cb 0.27 -0.24 -0.04 0.00 -0.02 0.00 0.00 41.12 41.09 3m2p n ASP 245 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3m2p n ASN 246 N 0.00 2.76 -4.03 -2.24 5.15 -0.97 -4.80 115.26 111.12 3m2p n ASN 246 Ca 0.00 -2.43 -0.23 0.00 -0.60 0.00 0.00 54.58 51.31 3m2p n ASN 246 Cb 0.00 -0.93 -0.16 0.00 -0.53 0.00 0.00 39.78 38.16 3m2p n ASN 246 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3m2p s LEU 247 N 0.47 1.73 -0.08 1.20 2.96 -1.26 -1.67 118.68 122.03 3m2p s LEU 247 Ca 0.44 -0.27 0.05 0.00 -0.22 0.00 0.00 54.13 54.13 3m2p s LEU 247 Cb 0.11 -0.76 -0.01 0.00 0.50 0.00 0.00 46.19 46.03 3m2p s LEU 247 CO 0.08 0.06 -0.24 -0.22 -1.32 0.00 0.00 176.35 174.72 3m2p s LEU 248 N 0.41 2.14 -0.38 -0.68 1.98 0.27 -4.96 118.68 117.45 3m2p s LEU 248 Ca -0.09 -0.51 -0.11 0.00 -2.89 0.00 0.00 54.13 50.53 3m2p s LEU 248 Cb -0.13 -1.41 0.03 0.00 0.66 0.00 0.00 46.19 45.34 3m2p s LEU 248 CO 0.02 0.21 0.21 -0.69 -1.89 0.00 0.00 176.35 174.21 3m2p s VAL 249 N 0.06 4.63 0.24 1.68 1.01 -1.26 -0.71 120.40 126.04 3m2p s VAL 249 Ca -0.10 -0.83 -0.07 0.00 0.00 0.00 0.00 61.98 60.98 3m2p s VAL 249 Cb -0.16 -3.58 0.23 0.00 0.00 0.00 0.00 36.38 32.87 3m2p s VAL 249 CO 0.06 -0.23 1.91 0.11 0.00 0.00 0.00 175.10 176.94 3m2p h LYS 250 N 8.45 1.20 -5.27 2.72 1.57 -1.45 -3.45 116.57 120.34 3m2p h LYS 250 Ca -0.26 -0.07 -0.39 0.00 -1.87 0.00 0.00 60.65 58.06 3m2p h LYS 250 Cb 1.11 -0.27 -0.20 0.00 0.08 0.00 0.00 32.23 32.94 3m2p h LYS 250 CO 0.67 0.80 -0.77 -0.80 -0.57 0.00 0.00 179.45 178.78 3m2p s ASN 251 N -6.02 1.66 0.84 0.86 0.01 -0.40 -5.04 114.94 106.85 3m2p s ASN 251 Ca -0.13 -0.67 -0.12 0.00 -0.71 0.00 0.00 52.86 51.23 3m2p s ASN 251 Cb 0.17 -0.04 0.09 0.00 0.41 0.00 0.00 41.25 41.89 3m2p s ASN 251 CO 0.81 -0.12 1.14 -2.84 -1.51 0.00 0.00 177.10 174.58 3m2p s PRO 252 N -2.03 1.76 1.36 -0.60 0.02 -1.26 -4.37 135.00 129.89 3m2p s PRO 252 Ca 0.00 0.30 0.00 0.00 0.02 0.00 0.00 61.00 61.33 3m2p s PRO 252 Cb -0.08 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.53 3m2p s PRO 252 CO 0.02 -1.77 0.00 0.09 -0.33 0.00 0.00 177.00 175.01 3m2p n ASN 253 N -3.48 -0.53 -4.77 2.53 3.02 -1.26 -4.87 115.26 105.91 3m2p n ASN 253 Ca 0.07 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.23 3m2p n ASN 253 Cb 0.59 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.71 3m2p n ASN 253 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3m2p s ALA 254 N -1.10 3.46 0.06 5.41 0.00 -1.26 -2.99 121.76 125.34 3m2p s ALA 254 Ca 0.00 0.19 -0.26 0.00 0.00 0.00 0.00 51.96 51.89 3m2p s ALA 254 Cb 0.00 -2.86 -0.13 0.00 0.00 0.00 0.00 23.12 20.13 3m2p s ALA 254 CO 0.00 0.20 1.40 -0.97 0.00 0.00 0.00 175.76 176.40 3m2p h ASN 255 N 5.14 -0.97 0.00 0.00 -0.73 -1.44 -3.47 115.58 114.11 3m2p h ASN 255 Ca -0.46 0.07 0.00 0.00 1.87 0.00 0.00 56.30 57.78 3m2p h ASN 255 Cb 1.21 0.31 0.00 0.00 0.27 0.00 0.00 38.32 40.10 3m2p h ASN 255 CO 0.68 -0.51 0.00 -0.62 -0.37 0.00 0.00 177.43 176.61 3m2p n GLU 256 N -4.62 -0.00 -0.11 6.67 1.02 -1.26 -4.79 120.64 117.55 3m2p n GLU 256 Ca -0.09 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.15 3m2p n GLU 256 Cb 0.35 -3.14 0.32 0.00 -0.02 0.00 0.00 31.44 28.95 3m2p n GLU 256 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3m2p n GLY 257 N -2.00 0.65 3.10 0.62 0.00 -1.26 -4.91 105.19 101.39 3m2p n GLY 257 Ca 0.00 -0.50 -0.24 0.00 0.00 0.00 0.00 46.02 45.28 3m2p n GLY 257 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m2p s ILE 258 N -1.71 1.22 0.25 -0.61 1.01 -1.26 -5.14 121.20 114.95 3m2p s ILE 258 Ca 0.33 -0.61 0.11 0.00 0.00 0.00 0.00 60.65 60.48 3m2p s ILE 258 Cb 0.18 -1.05 -0.05 0.00 0.01 0.00 0.00 42.46 41.56 3m2p s ILE 258 CO 0.27 0.36 -0.12 -1.00 0.00 0.00 0.00 174.94 174.44 3m2p s HIS 259 N 0.02 2.48 0.24 3.97 3.76 -1.26 -4.82 115.29 119.68 3m2p s HIS 259 Ca -0.02 -0.28 -0.30 0.00 -0.15 0.00 0.00 55.06 54.31 3m2p s HIS 259 Cb -0.10 -1.13 -0.09 0.00 1.11 0.00 0.00 32.58 32.38 3m2p s HIS 259 CO 0.01 0.63 1.05 -1.12 -0.85 0.00 0.00 174.74 174.46 3m2p s SER 260 N -3.34 7.39 -0.19 1.40 0.01 -1.26 -4.64 113.70 113.06 3m2p s SER 260 Ca 0.28 2.11 -0.04 0.00 1.31 0.00 0.00 55.95 59.62 3m2p s SER 260 Cb -0.06 -2.61 0.09 0.00 0.21 0.00 0.00 66.02 63.64 3m2p s SER 260 CO 0.16 -0.07 0.30 -0.94 0.41 0.00 0.00 173.24 173.10 3m2p s SER 261 N -0.74 0.52 0.00 2.44 1.04 0.62 -4.87 113.70 112.71 3m2p s SER 261 Ca 0.45 0.33 0.00 0.00 0.48 0.00 0.00 55.95 57.21 3m2p s SER 261 Cb -0.29 0.80 0.00 0.00 0.10 0.00 0.00 66.02 66.63 3m2p s SER 261 CO 0.36 -0.28 0.00 0.00 0.98 0.00 0.00 173.24 174.31 3m2p n TYR 262 N 5.35 -0.34 -4.01 5.02 4.11 -1.26 0.16 117.16 126.19 3m2p n TYR 262 Ca -0.06 0.00 -0.34 0.00 -0.00 0.00 0.00 57.90 57.51 3m2p n TYR 262 Cb 0.50 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.69 3m2p n TYR 262 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 3m2p s ASP 264 N 0.38 3.91 -0.27 9.48 -1.08 -0.31 -2.92 116.67 125.85 3m2p s ASP 264 Ca 0.00 -0.74 0.12 0.00 -0.52 0.00 0.00 52.55 51.41 3m2p s ASP 264 Cb 0.00 -1.61 0.60 0.00 -1.46 0.00 0.00 42.92 40.45 3m2p s ASP 264 CO 0.00 -0.07 1.58 -1.20 0.52 0.00 0.00 175.17 176.01 3m2p n SER 265 N 4.66 3.74 -0.13 -0.34 7.64 -1.26 -4.63 113.62 123.30 3m2p n SER 265 Ca -0.18 -3.34 -0.05 0.00 1.01 0.00 0.00 58.87 56.30 3m2p n SER 265 Cb 0.48 -0.65 -0.04 0.00 -1.01 0.00 0.00 64.21 62.99 3m2p n SER 265 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3m2p h SER 266 N 1.77 -0.89 -0.83 6.43 0.02 -1.98 -2.33 113.55 115.73 3m2p h SER 266 Ca 0.19 0.13 0.19 0.00 -0.84 0.00 0.00 61.79 61.45 3m2p h SER 266 Cb 1.87 0.38 -0.15 0.00 0.14 0.00 0.00 62.40 64.64 3m2p h SER 266 CO 0.48 -0.14 -0.06 0.50 -1.14 0.00 0.00 176.83 176.48 3m2p h LYS 267 N -0.08 0.05 -0.48 3.45 3.64 -1.92 1.15 116.57 122.38 3m2p h LYS 267 Ca 0.05 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3m2p h LYS 267 Cb 0.22 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 3m2p h LYS 267 CO -0.34 0.03 0.31 0.00 -2.27 0.00 0.00 179.45 177.18 3m2p h ALA 268 N 1.81 1.64 -0.42 5.00 0.00 -1.70 -2.01 119.26 123.58 3m2p h ALA 268 Ca 0.45 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.18 3m2p h ALA 268 Cb 0.80 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3m2p h ALA 268 CO -0.79 0.33 -0.27 -0.22 0.00 0.00 0.00 179.25 178.30 3m2p h LYS 269 N 0.65 0.93 0.00 0.00 3.64 0.19 -1.90 116.57 120.08 3m2p h LYS 269 Ca 0.17 -0.43 -0.14 0.00 -1.27 0.00 0.00 60.65 58.98 3m2p h LYS 269 Cb -0.06 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 3m2p h LYS 269 CO -0.04 1.09 -0.76 1.49 -2.27 0.00 0.00 179.45 178.96 3m2p h GLU 270 N 0.76 0.00 -0.07 1.90 4.81 -1.24 -2.90 114.58 117.84 3m2p h GLU 270 Ca 0.09 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.17 3m2p h GLU 270 Cb 0.85 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.23 3m2p h GLU 270 CO 0.07 0.99 -0.53 -0.07 -0.73 0.00 0.00 179.01 178.74 3m2p h LEU 271 N -1.00 0.59 -1.10 1.64 -0.00 -1.52 -3.26 115.31 110.66 3m2p h LEU 271 Ca -0.21 -0.68 0.00 0.00 -0.00 0.00 0.00 57.88 56.99 3m2p h LEU 271 Cb 1.18 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 41.66 3m2p h LEU 271 CO -0.13 1.18 0.00 0.18 -0.00 0.00 0.00 178.44 179.67 3m2p n LEU 272 N -4.23 1.69 -4.24 1.67 4.32 -0.76 -4.93 117.00 110.52 3m2p n LEU 272 Ca -0.09 -0.61 -0.32 0.00 -0.02 0.00 0.00 56.01 54.97 3m2p n LEU 272 Cb 0.62 -0.04 -0.07 0.00 -1.62 0.00 0.00 43.42 42.32 3m2p n LEU 272 CO 0.46 0.31 -0.30 0.47 -1.22 0.00 0.00 177.39 177.11 3m2p n ASP 273 N 0.32 -0.39 -4.48 -1.43 8.00 -1.10 -4.81 116.55 112.67 3m2p n ASP 273 Ca 0.18 -1.16 -0.33 0.00 0.71 0.00 0.00 54.79 54.18 3m2p n ASP 273 Cb 0.37 -2.16 -0.13 0.00 -0.02 0.00 0.00 41.12 39.19 3m2p n ASP 273 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3m2p s PHE 274 N -3.95 2.90 0.04 1.24 5.36 -0.93 -4.99 117.98 117.64 3m2p s PHE 274 Ca 0.23 -0.31 -0.10 0.00 -0.96 0.00 0.00 56.93 55.80 3m2p s PHE 274 Cb -0.13 -1.82 0.00 0.00 -0.34 0.00 0.00 43.02 40.74 3m2p s PHE 274 CO 0.96 0.03 0.20 -1.54 -1.46 0.00 0.00 175.22 173.41 3m2p s SER 275 N -0.07 0.03 0.28 6.13 1.04 -1.26 -3.90 113.70 115.94 3m2p s SER 275 Ca -0.00 -0.35 -0.29 0.00 0.48 0.00 0.00 55.95 55.78 3m2p s SER 275 Cb -0.13 0.29 -0.09 0.00 0.10 0.00 0.00 66.02 66.18 3m2p s SER 275 CO 0.03 -0.55 1.07 0.42 0.98 0.00 0.00 173.24 175.19 3m2p s THR 276 N -2.51 3.59 0.11 2.02 -4.23 -1.26 -4.96 115.64 108.40 3m2p s THR 276 Ca -0.05 1.59 -0.14 0.00 -1.18 0.00 0.00 61.69 61.90 3m2p s THR 276 Cb -0.01 -4.01 -0.08 0.00 1.34 0.00 0.00 72.50 69.75 3m2p s THR 276 CO -0.04 0.37 1.43 0.44 -0.54 0.00 0.00 174.62 176.29 3m2p h ASP 277 N 3.83 0.80 -1.90 3.99 3.32 -1.96 -3.47 116.42 121.03 3m2p h ASP 277 Ca -0.46 -0.47 -0.49 0.00 0.02 0.00 0.00 57.03 55.63 3m2p h ASP 277 Cb 1.21 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.50 3m2p h ASP 277 CO 0.67 1.10 -0.45 -0.31 -1.72 0.00 0.00 179.24 178.53 3m2p s TYR 278 N -4.38 2.98 0.29 4.55 1.51 -1.26 -5.07 117.35 115.96 3m2p s TYR 278 Ca -0.12 -0.25 0.05 0.00 -1.01 0.00 0.00 57.07 55.73 3m2p s TYR 278 Cb 0.09 -1.75 -0.06 0.00 -0.11 0.00 0.00 41.96 40.13 3m2p s TYR 278 CO 0.84 0.22 -0.00 0.54 -1.11 0.00 0.00 175.55 176.04 3m2p s ASN 279 N -3.99 2.40 0.25 2.29 2.20 -1.26 -4.96 114.94 111.87 3m2p s ASN 279 Ca 0.40 -1.27 -0.04 0.00 -0.94 0.00 0.00 52.86 51.01 3m2p s ASN 279 Cb -0.07 -0.10 0.49 0.00 -2.00 0.00 0.00 41.25 39.58 3m2p s ASN 279 CO 0.27 -0.48 1.68 0.15 -2.94 0.00 0.00 177.10 175.78 3m2p h PHE 280 N 2.26 0.29 -0.31 1.54 3.04 -1.93 -0.27 116.94 121.56 3m2p h PHE 280 Ca -0.40 0.04 -0.15 0.00 3.98 0.00 0.00 57.97 61.45 3m2p h PHE 280 Cb 1.23 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.72 3m2p h PHE 280 CO 0.62 -0.09 -0.40 0.00 -2.02 0.00 0.00 178.31 176.42 3m2p h ALA 281 N 1.63 0.71 -0.46 2.41 0.00 -1.97 -1.98 119.26 119.61 3m2p h ALA 281 Ca 0.43 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 3m2p h ALA 281 Cb 0.75 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3m2p h ALA 281 CO -0.53 0.66 -0.15 1.15 0.00 0.00 0.00 179.25 180.39 3m2p h THR 282 N 0.61 1.27 -0.42 0.00 2.02 -1.65 -1.43 112.91 113.32 3m2p h THR 282 Ca 0.05 -1.29 -0.03 0.00 0.77 0.00 0.00 66.41 65.91 3m2p h THR 282 Cb 0.95 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 68.48 3m2p h THR 282 CO 0.09 0.44 0.13 0.00 0.37 0.00 0.00 175.52 176.54 3m2p h ALA 283 N 0.87 0.55 -0.00 6.16 0.00 -0.96 -2.89 119.26 122.98 3m2p h ALA 283 Ca 0.11 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.64 3m2p h ALA 283 Cb 0.71 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3m2p h ALA 283 CO 0.05 0.20 -0.89 0.28 0.00 0.00 0.00 179.25 178.90 3m2p h VAL 284 N 0.53 1.45 -1.00 0.00 2.07 -1.37 -0.55 116.25 117.38 3m2p h VAL 284 Ca 0.13 -2.50 0.22 0.00 0.82 0.00 0.00 66.70 65.37 3m2p h VAL 284 Cb 0.27 2.41 -0.10 0.00 -1.52 0.00 0.00 31.29 32.35 3m2p h VAL 284 CO -0.00 0.74 0.62 -0.33 0.02 0.00 0.00 177.57 178.62 3m2p h GLU 285 N 0.17 0.57 0.12 1.57 5.08 -1.18 0.13 114.58 121.03 3m2p h GLU 285 Ca -0.06 -0.03 -0.22 0.00 -1.00 0.00 0.00 59.36 58.05 3m2p h GLU 285 Cb 1.51 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 30.64 3m2p h GLU 285 CO 0.14 0.38 -1.08 1.49 -1.00 0.00 0.00 179.01 178.94 3m2p h GLU 286 N 0.59 0.25 -0.51 2.33 4.81 -1.26 -2.72 114.58 118.07 3m2p h GLU 286 Ca 0.58 -0.44 0.05 0.00 -0.13 0.00 0.00 59.36 59.43 3m2p h GLU 286 Cb 1.15 0.16 -0.05 0.00 0.63 0.00 0.00 28.75 30.64 3m2p h GLU 286 CO -0.34 1.21 0.23 0.82 -0.73 0.00 0.00 179.01 180.20 3m2p h ILE 287 N -0.38 0.91 0.22 2.32 2.04 -0.77 -2.07 117.51 119.77 3m2p h ILE 287 Ca -0.22 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.50 3m2p h ILE 287 Cb 1.67 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 3m2p h ILE 287 CO 0.09 0.08 -0.42 -0.74 0.00 0.00 0.00 178.15 177.16 3m2p h HIS 288 N 0.45 -1.18 0.00 1.37 2.76 -0.84 -1.97 115.15 115.74 3m2p h HIS 288 Ca 0.23 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.42 3m2p h HIS 288 Cb 0.18 0.49 0.00 0.00 1.55 0.00 0.00 27.41 29.63 3m2p h HIS 288 CO -0.12 -0.54 0.00 -0.11 -1.30 0.00 0.00 177.93 175.86 3m2p n LEU 289 N -5.48 0.05 -3.04 0.26 -0.00 -0.81 -3.87 117.00 104.11 3m2p n LEU 289 Ca -0.08 -0.02 -0.20 0.00 -0.00 0.00 0.00 56.01 55.71 3m2p n LEU 289 Cb 0.39 -0.02 -0.02 0.00 -0.00 0.00 0.00 43.42 43.76 3m2p n LEU 289 CO 0.22 0.01 -0.10 -0.11 -0.00 0.00 0.00 177.39 177.41 3m2p n LEU 290 N -0.18 2.01 -4.04 -1.96 7.94 -0.74 -5.03 117.00 115.00 3m2p n LEU 290 Ca 0.00 -5.05 -0.38 0.00 -1.11 0.00 0.00 56.01 49.47 3m2p n LEU 290 Cb 0.01 0.31 -0.00 0.00 0.53 0.00 0.00 43.42 44.26 3m2p n LEU 290 CO 0.00 2.23 -0.20 0.54 -1.11 0.00 0.00 177.39 178.85 3m2p n ARG 292 N 0.07 -0.45 0.00 1.96 1.74 -1.25 -5.09 116.66 113.64 3m2p n ARG 292 Ca 0.25 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 3m2p n ARG 292 Cb 0.61 -2.16 0.00 0.00 -1.02 0.00 0.00 32.46 29.89 3m2p n ARG 292 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52