#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2boa n GLU 5 N 0.00 1.39 -4.25 -0.14 4.07 0.17 -5.00 120.64 116.87 2boa n GLU 5 Ca 0.00 0.50 -0.29 0.00 -0.06 0.00 0.00 57.16 57.31 2boa n GLU 5 Cb 0.00 -2.17 -0.10 0.00 -0.06 0.00 0.00 31.44 29.11 2boa n GLU 5 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2boa s LYS 6 N 0.52 2.02 -0.31 5.31 -0.14 -1.26 -4.77 119.74 121.11 2boa s LYS 6 Ca 0.82 -1.10 0.11 0.00 -1.36 0.00 0.00 55.97 54.44 2boa s LYS 6 Cb -0.88 -2.23 0.47 0.00 -1.68 0.00 0.00 37.83 33.50 2boa s LYS 6 CO 0.45 0.49 1.14 1.19 -0.76 0.00 0.00 175.35 177.86 2boa n PHE 7 N 0.63 2.39 -1.82 3.18 3.72 -1.26 -5.07 117.46 119.23 2boa n PHE 7 Ca -0.14 -2.38 -0.42 0.00 -0.05 0.00 0.00 57.45 54.46 2boa n PHE 7 Cb 0.53 -0.28 -0.03 0.00 -0.94 0.00 0.00 39.48 38.76 2boa n PHE 7 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2boa s PHE 8 N -3.61 1.57 0.00 1.38 0.40 -1.26 -2.23 117.98 114.24 2boa s PHE 8 Ca 0.43 0.10 0.00 0.00 -0.60 0.00 0.00 56.93 56.86 2boa s PHE 8 Cb 0.39 -4.06 0.00 0.00 0.51 0.00 0.00 43.02 39.86 2boa s PHE 8 CO -0.01 -4.33 0.00 0.41 0.70 0.00 0.00 175.22 171.98 2boa n GLY 9 N 4.76 0.57 3.79 4.36 0.00 -1.26 -4.43 105.19 112.97 2boa n GLY 9 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 2boa n GLY 9 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2boa s ASP 10 N -2.30 6.42 0.02 1.61 1.11 -0.95 -4.29 116.67 118.30 2boa s ASP 10 Ca 0.00 1.97 0.03 0.00 0.18 0.00 0.00 52.55 54.74 2boa s ASP 10 Cb 0.00 -2.57 -0.02 0.00 1.07 0.00 0.00 42.92 41.41 2boa s ASP 10 CO 0.00 -0.73 -0.10 -1.10 1.18 0.00 0.00 175.17 174.42 2boa s GLN 11 N -3.03 0.74 -0.27 8.23 -0.21 0.04 -2.50 119.66 122.66 2boa s GLN 11 Ca 0.65 -0.58 -0.12 0.00 0.02 0.00 0.00 55.36 55.33 2boa s GLN 11 Cb -0.18 -0.68 -0.05 0.00 1.00 0.00 0.00 33.01 33.10 2boa s GLN 11 CO 0.22 0.17 0.26 0.08 -2.12 0.00 0.00 175.29 173.90 2boa s VAL 12 N -0.70 5.27 -0.08 1.09 1.01 -1.05 0.12 120.40 126.06 2boa s VAL 12 Ca -0.00 0.33 0.01 0.00 0.00 0.00 0.00 61.98 62.32 2boa s VAL 12 Cb -0.06 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 2boa s VAL 12 CO 0.00 0.23 -0.10 -0.76 0.00 0.00 0.00 175.10 174.48 2boa s LEU 13 N 1.74 2.96 -0.27 3.92 1.43 0.19 -1.05 118.68 127.60 2boa s LEU 13 Ca 0.10 -0.14 -0.09 0.00 -1.03 0.00 0.00 54.13 52.98 2boa s LEU 13 Cb -0.16 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 2boa s LEU 13 CO 0.10 0.31 0.11 -0.60 0.23 0.00 0.00 176.35 176.50 2boa s ARG 14 N -0.48 3.68 -0.11 1.70 3.52 -0.11 -1.37 118.95 125.78 2boa s ARG 14 Ca 0.07 -0.47 0.02 0.00 -0.13 0.00 0.00 55.73 55.21 2boa s ARG 14 Cb -0.12 -3.45 -0.01 0.00 -1.56 0.00 0.00 34.95 29.82 2boa s ARG 14 CO 0.02 -0.22 -0.19 0.42 -0.81 0.00 0.00 175.30 174.52 2boa s ILE 15 N 1.65 2.53 -0.20 4.11 1.01 0.11 -1.67 121.20 128.74 2boa s ILE 15 Ca 0.06 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.57 2boa s ILE 15 Cb -0.16 -2.02 0.00 0.00 0.01 0.00 0.00 42.46 40.29 2boa s ILE 15 CO 0.06 0.54 1.12 0.20 0.00 0.00 0.00 174.94 176.87 2boa s ASN 16 N 0.35 7.04 -0.25 3.58 -0.87 -0.60 -1.81 114.94 122.38 2boa s ASN 16 Ca -0.15 1.50 0.02 0.00 -1.57 0.00 0.00 52.86 52.66 2boa s ASN 16 Cb -0.17 -2.54 0.06 0.00 -0.02 0.00 0.00 41.25 38.58 2boa s ASN 16 CO 0.07 -0.70 -0.10 -0.69 -2.57 0.00 0.00 177.10 173.12 2boa s VAL 17 N 3.30 2.01 0.00 1.60 1.01 -1.26 -4.44 120.40 122.62 2boa s VAL 17 Ca 0.48 -1.54 0.00 0.00 0.00 0.00 0.00 61.98 60.92 2boa s VAL 17 Cb -0.18 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.04 2boa s VAL 17 CO 0.09 -0.05 0.00 0.54 0.00 0.00 0.00 175.10 175.69 2boa n ARG 18 N 4.49 0.00 0.00 2.72 1.74 -1.26 -3.70 116.66 120.64 2boa n ARG 18 Ca -0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 2boa n ARG 18 Cb 0.42 -0.16 0.00 0.00 -1.02 0.00 0.00 32.46 31.70 2boa n ARG 18 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2boa n ASN 19 N -1.82 -0.26 -0.01 0.55 0.23 -1.26 -4.60 115.26 108.09 2boa n ASN 19 Ca 0.00 -0.39 -0.17 0.00 -0.53 0.00 0.00 54.58 53.49 2boa n ASN 19 Cb 0.00 0.00 -0.09 0.00 -2.08 0.00 0.00 39.78 37.61 2boa n ASN 19 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2boa h GLY 20 N -0.13 0.63 1.02 4.83 0.00 -1.98 -3.33 103.07 104.11 2boa h GLY 20 Ca 0.00 -0.94 -0.04 0.00 0.00 0.00 0.00 47.33 46.34 2boa h GLY 20 CO 0.00 0.84 0.24 -1.80 0.00 0.00 0.00 176.54 175.82 2boa h ASP 21 N 0.18 0.94 0.11 0.19 3.58 -2.01 -3.18 116.42 116.24 2boa h ASP 21 Ca -0.06 -0.19 -0.03 0.00 0.42 0.00 0.00 57.03 57.18 2boa h ASP 21 Cb 1.28 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 42.08 2boa h ASP 21 CO 0.13 0.88 -0.13 -0.33 -2.88 0.00 0.00 179.24 176.90 2boa h GLU 22 N 0.96 0.05 0.15 0.28 5.08 -1.94 -2.13 114.58 117.02 2boa h GLU 22 Ca 0.22 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 2boa h GLU 22 Cb 0.24 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2boa h GLU 22 CO -0.01 0.18 -0.07 0.82 -1.00 0.00 0.00 179.01 178.92 2boa h ILE 23 N 0.04 0.95 0.66 3.13 2.04 -1.68 -3.22 117.51 119.44 2boa h ILE 23 Ca 0.01 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 2boa h ILE 23 Cb 0.26 1.23 0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2boa h ILE 23 CO 0.02 0.11 -0.32 0.77 0.00 0.00 0.00 178.15 178.73 2boa h SER 24 N -0.41 -0.75 0.60 1.72 4.64 -1.47 -1.98 113.55 115.89 2boa h SER 24 Ca -0.02 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2boa h SER 24 Cb 0.33 0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2boa h SER 24 CO 0.03 -0.54 0.00 0.11 -0.87 0.00 0.00 176.83 175.57 2boa h LYS 25 N -0.88 0.00 0.00 4.77 1.79 -1.58 0.41 116.57 121.08 2boa h LYS 25 Ca -0.09 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.34 2boa h LYS 25 Cb 0.68 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.32 2boa h LYS 25 CO 0.15 0.00 -0.36 1.25 -1.08 0.00 0.00 179.45 179.41 2boa h LEU 26 N 0.00 0.00 -1.13 2.94 6.46 -1.54 -3.24 115.31 118.80 2boa h LEU 26 Ca 0.00 -0.26 0.01 0.00 -0.12 0.00 0.00 57.88 57.50 2boa h LEU 26 Cb 0.30 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.18 2boa h LEU 26 CO 0.00 0.83 0.57 0.28 -0.62 0.00 0.00 178.44 179.50 2boa h SER 27 N -1.00 1.01 -0.44 1.25 0.02 -1.16 -2.51 113.55 110.72 2boa h SER 27 Ca -0.06 -0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 60.80 2boa h SER 27 Cb 0.54 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 2boa h SER 27 CO -0.03 0.73 0.00 -0.61 -1.14 0.00 0.00 176.83 175.78 2boa h GLN 28 N 1.19 0.77 -0.67 3.45 -0.00 -1.12 -3.07 115.11 115.65 2boa h GLN 28 Ca 0.32 -0.24 0.08 0.00 -0.00 0.00 0.00 58.65 58.81 2boa h GLN 28 Cb -0.13 -0.07 -0.11 0.00 0.00 0.00 0.00 27.48 27.17 2boa h GLN 28 CO -0.07 0.84 -0.50 1.25 0.00 0.00 0.00 178.83 180.35 2boa h LEU 29 N 0.61 -1.76 -4.91 -2.39 7.12 -1.47 -1.14 115.31 111.38 2boa h LEU 29 Ca 0.12 0.27 -0.60 0.00 0.13 0.00 0.00 57.88 57.81 2boa h LEU 29 Cb 0.49 0.78 -0.41 0.00 -0.53 0.00 0.00 40.66 40.98 2boa h LEU 29 CO 0.02 -0.32 -0.59 0.52 -0.13 0.00 0.00 178.44 177.94 2boa n VAL 30 N -5.37 2.81 -0.06 1.05 0.31 -1.25 -3.90 118.33 111.92 2boa n VAL 30 Ca 0.01 -5.22 -0.14 0.00 -0.01 0.00 0.00 64.34 58.98 2boa n VAL 30 Cb 0.33 -1.33 -0.05 0.00 -0.91 0.00 0.00 33.84 31.88 2boa n VAL 30 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2boa n ASN 30 N -0.37 1.02 -3.52 4.52 3.02 -0.56 -4.65 115.26 114.72 2boa n ASN 30 Ca 0.36 0.17 -0.39 0.00 -0.03 0.00 0.00 54.58 54.70 2boa n ASN 30 Cb 0.52 -0.42 -0.06 0.00 -0.61 0.00 0.00 39.78 39.22 2boa n ASN 30 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2boa n SER 30 N -3.65 2.56 -4.58 6.41 2.88 -0.54 -4.92 113.62 111.78 2boa n SER 30 Ca -0.25 -2.58 -0.57 0.00 -1.33 0.00 0.00 58.87 54.14 2boa n SER 30 Cb 0.65 -1.01 -0.07 0.00 -0.75 0.00 0.00 64.21 63.03 2boa n SER 30 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2boa n ASN 31 N 7.13 0.97 0.00 -3.46 2.85 -1.26 -4.83 115.26 116.65 2boa n ASN 31 Ca 0.47 1.14 0.00 0.00 -0.11 0.00 0.00 54.58 56.08 2boa n ASN 31 Cb 0.35 -1.04 0.00 0.00 1.24 0.00 0.00 39.78 40.33 2boa n ASN 31 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 2boa n ASN 32 N 2.46 1.08 -0.35 1.20 3.02 -1.25 -4.95 115.26 116.47 2boa n ASN 32 Ca 0.21 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.79 2boa n ASN 32 Cb 0.12 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.37 2boa n ASN 32 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2boa n LEU 33 N -2.31 2.51 -3.80 3.41 4.77 -1.26 -5.00 117.00 115.31 2boa n LEU 33 Ca 0.00 -2.00 -0.26 0.00 -0.03 0.00 0.00 56.01 53.72 2boa n LEU 33 Cb 0.24 -0.13 0.03 0.00 -2.33 0.00 0.00 43.42 41.23 2boa n LEU 33 CO 0.00 0.63 0.04 0.29 -1.33 0.00 0.00 177.39 177.01 2boa n LYS 34 N 0.06 -5.38 -2.68 3.23 5.02 -1.26 -4.66 118.16 112.48 2boa n LYS 34 Ca 0.06 0.62 -0.36 0.00 -2.02 0.00 0.00 58.31 56.61 2boa n LYS 34 Cb 0.35 -5.37 -0.05 0.00 -0.02 0.00 0.00 35.03 29.93 2boa n LYS 34 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2boa s LEU 35 N -7.01 4.17 -0.25 -0.35 1.43 -1.26 -4.61 118.68 110.80 2boa s LEU 35 Ca 0.36 1.90 0.02 0.00 -1.03 0.00 0.00 54.13 55.37 2boa s LEU 35 Cb -0.18 -4.20 0.06 0.00 0.03 0.00 0.00 46.19 41.91 2boa s LEU 35 CO 0.82 -0.32 -0.07 0.21 0.23 0.00 0.00 176.35 177.22 2boa s ASN 36 N -1.71 4.21 0.10 2.29 3.04 -0.70 -4.98 114.94 117.20 2boa s ASN 36 Ca 0.56 -1.35 -0.31 0.00 0.04 0.00 0.00 52.86 51.80 2boa s ASN 36 Cb -0.18 -1.39 -0.09 0.00 -1.54 0.00 0.00 41.25 38.05 2boa s ASN 36 CO 0.23 -0.22 1.71 -0.36 -3.04 0.00 0.00 177.10 175.42 2boa s PHE 37 N 1.22 2.39 -0.20 0.43 2.99 -1.26 -0.01 117.98 123.53 2boa s PHE 37 Ca -0.06 0.22 -0.04 0.00 0.00 0.00 0.00 56.93 57.05 2boa s PHE 37 Cb -0.19 -4.04 -0.21 0.00 0.00 0.00 0.00 43.02 38.58 2boa s PHE 37 CO -0.06 -4.19 0.05 0.91 -0.00 0.00 0.00 175.22 171.93 2boa n TRP 38 N 5.46 0.62 -3.68 0.36 7.02 0.53 -4.85 117.44 122.91 2boa n TRP 38 Ca 0.16 0.15 -0.28 0.00 -1.02 0.00 0.00 57.50 56.51 2boa n TRP 38 Cb 0.39 -1.08 -0.16 0.00 -2.42 0.00 0.00 31.31 28.04 2boa n TRP 38 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 2boa s LYS 39 N -2.53 0.47 0.96 -0.99 2.20 -0.87 -4.90 119.74 114.08 2boa s LYS 39 Ca -0.29 -0.42 -0.15 0.00 -0.36 0.00 0.00 55.97 54.75 2boa s LYS 39 Cb 0.08 -1.93 0.22 0.00 -1.51 0.00 0.00 37.83 34.69 2boa s LYS 39 CO 0.67 -0.73 1.31 -1.54 -0.36 0.00 0.00 175.35 174.70 2boa s SER 40 N 1.93 2.99 -0.00 1.43 1.04 -1.26 -0.03 113.70 119.80 2boa s SER 40 Ca 0.02 0.06 -0.37 0.00 0.48 0.00 0.00 55.95 56.14 2boa s SER 40 Cb -0.17 -0.04 -0.15 0.00 0.10 0.00 0.00 66.02 65.76 2boa s SER 40 CO -0.13 -2.79 1.54 -0.81 0.98 0.00 0.00 173.24 172.03 2boa n PRO 41 N -3.73 1.47 -0.58 4.02 -0.04 -1.26 -4.74 135.00 130.14 2boa n PRO 41 Ca 0.17 0.53 0.03 0.00 -0.04 0.00 0.00 63.50 64.19 2boa n PRO 41 Cb 0.59 -2.24 0.20 0.00 -0.04 0.00 0.00 33.50 32.02 2boa n PRO 41 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2boa n SER 46 N 3.82 2.28 0.00 3.54 7.64 -1.26 -4.70 113.62 124.94 2boa n SER 46 Ca 0.20 -3.65 0.00 0.00 1.01 0.00 0.00 58.87 56.43 2boa n SER 46 Cb 0.21 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 2boa n SER 46 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2boa n SER 47 N -1.12 0.00 0.00 6.43 7.64 -1.26 -4.85 113.62 120.47 2boa n SER 47 Ca 0.24 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2boa n SER 47 Cb 0.83 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.03 2boa n SER 47 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2boa n PHE 48 N 2.44 0.00 -1.76 1.43 3.01 -1.26 -3.19 117.46 118.12 2boa n PHE 48 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.41 2boa n PHE 48 Cb 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 39.48 39.62 2boa n PHE 48 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 2boa n ASN 49 N -1.98 2.84 -4.74 4.37 0.23 -1.24 -4.27 115.26 110.47 2boa n ASN 49 Ca 0.00 -3.83 -0.37 0.00 -0.53 0.00 0.00 54.58 49.85 2boa n ASN 49 Cb 0.00 -0.46 0.06 0.00 -2.08 0.00 0.00 39.78 37.30 2boa n ASN 49 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2boa s ARG 50 N -3.35 2.69 0.20 -3.83 1.81 -1.19 -4.50 118.95 110.78 2boa s ARG 50 Ca 0.43 1.99 -0.30 0.00 -1.72 0.00 0.00 55.73 56.13 2boa s ARG 50 Cb 0.38 -1.87 -0.08 0.00 -0.45 0.00 0.00 34.95 32.93 2boa s ARG 50 CO -0.03 -1.47 1.15 -2.14 -0.68 0.00 0.00 175.30 172.13 2boa s PRO 51 N -3.36 4.54 -0.16 3.54 0.02 -1.26 -4.36 135.00 133.96 2boa s PRO 51 Ca 0.81 1.82 -0.13 0.00 0.02 0.00 0.00 61.00 63.51 2boa s PRO 51 Cb -0.35 -3.24 -0.05 0.00 0.02 0.00 0.00 34.50 30.88 2boa s PRO 51 CO 0.38 0.00 0.28 0.08 -0.33 0.00 0.00 177.00 177.41 2boa s VAL 52 N -0.28 5.31 -0.15 3.83 1.01 -0.75 -4.85 120.40 124.53 2boa s VAL 52 Ca 0.50 0.53 -0.04 0.00 0.00 0.00 0.00 61.98 62.97 2boa s VAL 52 Cb -0.32 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 2boa s VAL 52 CO 0.37 0.40 -0.02 -1.81 0.00 0.00 0.00 175.10 174.05 2boa s ASP 53 N 0.38 4.99 -0.02 3.32 1.01 0.96 0.05 116.67 127.35 2boa s ASP 53 Ca 0.16 -0.06 0.01 0.00 0.71 0.00 0.00 52.55 53.37 2boa s ASP 53 Cb -0.13 -1.76 0.01 0.00 1.01 0.00 0.00 42.92 42.05 2boa s ASP 53 CO 0.04 0.20 -0.02 0.54 0.21 0.00 0.00 175.17 176.14 2boa s VAL 54 N 0.18 0.23 -0.15 -1.27 0.11 -0.47 -0.35 120.40 118.68 2boa s VAL 54 Ca -0.00 -0.04 -0.25 0.00 -2.93 0.00 0.00 61.98 58.75 2boa s VAL 54 Cb -0.13 -0.25 -0.02 0.00 -1.53 0.00 0.00 36.38 34.44 2boa s VAL 54 CO 0.02 0.11 0.82 -0.22 -3.33 0.00 0.00 175.10 172.50 2boa s LEU 55 N 0.43 4.20 -0.19 2.54 0.20 0.98 -0.63 118.68 126.20 2boa s LEU 55 Ca -0.04 1.19 -0.01 0.00 0.69 0.00 0.00 54.13 55.96 2boa s LEU 55 Cb -0.07 -3.22 0.01 0.00 -0.43 0.00 0.00 46.19 42.47 2boa s LEU 55 CO -0.01 -0.35 -0.13 -0.69 -0.29 0.00 0.00 176.35 174.88 2boa s VAL 56 N 1.92 2.67 0.70 1.68 1.01 0.33 -1.72 120.40 126.99 2boa s VAL 56 Ca 0.39 -0.74 -0.15 0.00 0.00 0.00 0.00 61.98 61.48 2boa s VAL 56 Cb -0.17 -2.16 0.02 0.00 0.00 0.00 0.00 36.38 34.07 2boa s VAL 56 CO 0.14 0.49 1.17 -2.84 0.00 0.00 0.00 175.10 174.06 2boa s PRO 57 N 1.27 2.39 0.23 2.72 0.02 -1.26 -0.78 135.00 139.59 2boa s PRO 57 Ca 0.03 1.61 -0.09 0.00 0.02 0.00 0.00 61.00 62.58 2boa s PRO 57 Cb -0.14 -1.88 0.37 0.00 0.02 0.00 0.00 34.50 32.87 2boa s PRO 57 CO -0.07 -1.61 1.65 1.03 -0.33 0.00 0.00 177.00 177.66 2boa h SER 58 N -0.17 -0.33 1.27 2.53 0.87 -1.77 -1.25 113.55 114.69 2boa h SER 58 Ca -0.47 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 2boa h SER 58 Cb 1.28 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 63.55 2boa h SER 58 CO 0.51 -0.15 0.00 -0.37 -0.53 0.00 0.00 176.83 176.29 2boa h VAL 59 N 0.10 0.00 -0.01 2.23 -1.51 -1.92 -2.98 116.25 112.17 2boa h VAL 59 Ca 0.37 -0.62 0.00 0.00 -1.23 0.00 0.00 66.70 65.22 2boa h VAL 59 Cb 0.62 1.61 0.00 0.00 -2.13 0.00 0.00 31.29 31.39 2boa h VAL 59 CO -0.61 0.00 -0.40 -1.20 -1.23 0.00 0.00 177.57 174.13 2boa n SER 60 N -3.03 1.01 0.10 4.19 7.64 -0.50 -4.59 113.62 118.43 2boa n SER 60 Ca 0.02 -0.81 -0.06 0.00 1.01 0.00 0.00 58.87 59.03 2boa n SER 60 Cb 0.36 0.26 -0.03 0.00 -1.01 0.00 0.00 64.21 63.79 2boa n SER 60 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2boa h LEU 61 N 0.96 -0.47 -0.53 -3.43 5.85 -1.33 0.16 115.31 116.52 2boa h LEU 61 Ca 0.00 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.85 2boa h LEU 61 Cb 0.53 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.65 2boa h LEU 61 CO 0.00 -0.22 0.12 -0.61 -0.34 0.00 0.00 178.44 177.39 2boa h GLN 62 N -0.34 0.25 -0.48 1.25 4.15 -1.82 -0.89 115.11 117.23 2boa h GLN 62 Ca -0.02 -0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.42 2boa h GLN 62 Cb 0.29 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 27.89 2boa h GLN 62 CO -0.02 0.17 0.26 0.00 -1.93 0.00 0.00 178.83 177.30 2boa h ALA 63 N 1.41 0.62 0.08 3.38 0.00 -1.77 -2.26 119.26 120.72 2boa h ALA 63 Ca 0.27 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 55.00 2boa h ALA 63 Cb 0.37 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.08 2boa h ALA 63 CO -0.34 -0.07 -0.79 0.35 0.00 0.00 0.00 179.25 178.40 2boa h PHE 64 N 0.52 0.64 -0.99 0.00 -0.00 -0.29 -2.85 116.94 113.96 2boa h PHE 64 Ca 0.21 -0.41 0.08 0.00 -0.00 0.00 0.00 57.97 57.85 2boa h PHE 64 Cb 0.08 -0.05 -0.07 0.00 -0.00 0.00 0.00 35.95 35.91 2boa h PHE 64 CO -0.09 1.27 0.63 0.87 -0.00 0.00 0.00 178.31 180.99 2boa h LYS 65 N -0.17 1.08 -0.69 1.11 1.57 -1.21 -0.47 116.57 117.79 2boa h LYS 65 Ca -0.12 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.58 2boa h LYS 65 Cb 1.55 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 33.58 2boa h LYS 65 CO 0.15 0.71 0.37 1.03 -0.57 0.00 0.00 179.45 181.15 2boa h SER 66 N 1.11 0.87 -0.23 0.86 0.87 -1.43 -1.24 113.55 114.37 2boa h SER 66 Ca 0.44 -0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.88 2boa h SER 66 Cb 0.24 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 2boa h SER 66 CO -0.20 0.72 0.08 0.15 -0.53 0.00 0.00 176.83 177.06 2boa h PHE 67 N 0.95 0.36 0.10 2.24 3.04 -1.15 -2.04 116.94 120.43 2boa h PHE 67 Ca 0.24 -0.03 0.02 0.00 3.98 0.00 0.00 57.97 62.18 2boa h PHE 67 Cb 0.05 -0.11 -0.05 0.00 2.56 0.00 0.00 35.95 38.41 2boa h PHE 67 CO -0.00 0.41 -0.41 -0.07 -2.02 0.00 0.00 178.31 176.21 2boa h LEU 68 N 0.21 -1.23 -0.61 0.59 4.07 -0.79 0.15 115.31 117.71 2boa h LEU 68 Ca 0.08 0.14 0.09 0.00 0.08 0.00 0.00 57.88 58.27 2boa h LEU 68 Cb 0.21 0.46 -0.07 0.00 1.08 0.00 0.00 40.66 42.34 2boa h LEU 68 CO -0.00 -0.48 0.22 0.03 -1.08 0.00 0.00 178.44 177.13 2boa h ARG 69 N -0.64 0.39 -0.36 1.13 3.08 -1.23 -0.58 114.38 116.18 2boa h ARG 69 Ca 0.03 -0.02 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 2boa h ARG 69 Cb 0.67 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 2boa h ARG 69 CO -0.25 0.26 -0.38 0.66 -1.07 0.00 0.00 179.97 179.19 2boa h SER 70 N 0.40 0.91 0.45 7.04 4.64 -0.96 -2.78 113.55 123.25 2boa h SER 70 Ca 0.31 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 2boa h SER 70 Cb 0.38 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2boa h SER 70 CO -0.31 1.18 0.00 0.00 -0.87 0.00 0.00 176.83 176.83 2boa n GLN 71 N -4.05 0.53 -1.96 4.77 1.13 0.49 -4.92 117.38 113.37 2boa n GLN 71 Ca -0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 2boa n GLN 71 Cb 0.54 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.39 2boa n GLN 71 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2boa n GLY 72 N 1.20 0.70 3.38 1.08 0.00 -0.34 -5.06 105.19 106.15 2boa n GLY 72 Ca 0.16 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 45.09 2boa n GLY 72 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2boa s LEU 73 N -0.34 3.25 0.29 0.99 1.43 -0.54 -5.03 118.68 118.74 2boa s LEU 73 Ca 0.00 -0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 52.48 2boa s LEU 73 Cb 0.00 -1.84 -0.10 0.00 0.03 0.00 0.00 46.19 44.28 2boa s LEU 73 CO 0.00 -0.04 1.14 -1.61 0.23 0.00 0.00 176.35 176.07 2boa s GLU 74 N 1.55 4.58 0.07 1.70 2.02 -1.26 -4.37 118.70 122.98 2boa s GLU 74 Ca 0.06 1.90 -0.04 0.00 0.02 0.00 0.00 54.97 56.90 2boa s GLU 74 Cb -0.15 -3.16 -0.02 0.00 0.10 0.00 0.00 34.13 30.90 2boa s GLU 74 CO 0.01 0.12 0.06 1.52 0.02 0.00 0.00 175.26 176.99 2boa s TYR 75 N -1.16 0.36 -0.00 1.61 -0.85 -1.26 -1.56 117.35 114.49 2boa s TYR 75 Ca 0.45 -0.86 0.04 0.00 -0.52 0.00 0.00 57.07 56.18 2boa s TYR 75 Cb -0.34 -0.25 -0.01 0.00 0.38 0.00 0.00 41.96 41.74 2boa s TYR 75 CO 0.44 -0.45 -0.13 0.00 -1.52 0.00 0.00 175.55 173.89 2boa s ALA 76 N -3.88 1.06 -0.22 9.51 0.00 -0.67 -4.97 121.76 122.59 2boa s ALA 76 Ca 0.06 -0.58 -0.29 0.00 0.00 0.00 0.00 51.96 51.15 2boa s ALA 76 Cb 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.92 2boa s ALA 76 CO -0.10 0.25 1.37 0.08 0.00 0.00 0.00 175.76 177.36 2boa s VAL 77 N -0.37 4.07 -0.21 0.00 1.01 -1.26 -0.93 120.40 122.70 2boa s VAL 77 Ca 0.04 1.24 0.13 0.00 0.00 0.00 0.00 61.98 63.40 2boa s VAL 77 Cb -0.05 -3.97 -0.23 0.00 0.00 0.00 0.00 36.38 32.13 2boa s VAL 77 CO -0.00 -0.30 0.01 0.35 0.00 0.00 0.00 175.10 175.16 2boa n THR 78 N 5.91 1.43 -4.02 3.92 -2.24 -0.21 -4.85 114.28 114.21 2boa n THR 78 Ca 0.15 -0.78 -0.31 0.00 -2.27 0.00 0.00 64.05 60.85 2boa n THR 78 Cb 0.45 -0.76 -0.16 0.00 -2.10 0.00 0.00 70.33 67.77 2boa n THR 78 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2boa s ILE 79 N -2.50 1.70 0.01 2.28 1.01 -1.10 -4.98 121.20 117.61 2boa s ILE 79 Ca -0.17 -0.95 -0.19 0.00 0.00 0.00 0.00 60.65 59.34 2boa s ILE 79 Cb 0.07 -1.71 -0.26 0.00 0.01 0.00 0.00 42.46 40.57 2boa s ILE 79 CO 0.77 0.26 1.06 -0.08 0.00 0.00 0.00 174.94 176.95 2boa h GLU 80 N 7.98 0.46 -2.37 2.79 4.57 -1.89 -2.78 114.58 123.33 2boa h GLU 80 Ca -0.31 -0.57 -0.34 0.00 -1.18 0.00 0.00 59.36 56.96 2boa h GLU 80 Cb 1.11 0.18 -0.35 0.00 -0.16 0.00 0.00 28.75 29.52 2boa h GLU 80 CO 0.50 1.21 -0.65 0.34 -1.18 0.00 0.00 179.01 179.24 2boa s ASP 81 N -6.98 1.75 0.32 1.04 2.15 -1.26 -4.62 116.67 109.07 2boa s ASP 81 Ca -0.12 -0.58 0.05 0.00 0.43 0.00 0.00 52.55 52.32 2boa s ASP 81 Cb 0.04 0.37 0.68 0.00 -0.30 0.00 0.00 42.92 43.71 2boa s ASP 81 CO 0.86 -0.37 1.85 0.25 -0.17 0.00 0.00 175.17 177.59 2boa h LEU 82 N 8.30 0.80 -1.40 -1.34 6.46 -1.66 -2.61 115.31 123.85 2boa h LEU 82 Ca -0.16 0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 57.60 2boa h LEU 82 Cb 1.10 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.90 2boa h LEU 82 CO 0.33 0.41 -0.08 -0.61 -0.62 0.00 0.00 178.44 177.87 2boa h GLN 83 N 0.85 0.29 -0.15 1.25 5.75 -1.85 -0.24 115.11 121.01 2boa h GLN 83 Ca 0.47 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.91 2boa h GLN 83 Cb 0.59 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.09 2boa h GLN 83 CO -0.24 0.39 0.08 0.00 -2.65 0.00 0.00 178.83 176.41 2boa h ALA 84 N 1.64 0.20 -0.37 3.38 0.00 -1.81 0.67 119.26 122.97 2boa h ALA 84 Ca 0.06 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.93 2boa h ALA 84 Cb 0.33 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 2boa h ALA 84 CO 0.02 -0.24 0.15 -0.07 0.00 0.00 0.00 179.25 179.10 2boa h LEU 85 N 0.13 0.18 -0.17 0.00 3.38 -1.43 -0.71 115.31 116.68 2boa h LEU 85 Ca 0.05 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.07 2boa h LEU 85 Cb 0.11 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2boa h LEU 85 CO -0.01 0.14 0.07 0.25 0.09 0.00 0.00 178.44 178.98 2boa h LEU 86 N 0.31 0.08 -1.04 1.67 7.12 -0.61 -1.94 115.31 120.91 2boa h LEU 86 Ca 0.17 0.01 -0.03 0.00 0.13 0.00 0.00 57.88 58.16 2boa h LEU 86 Cb 0.12 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.22 2boa h LEU 86 CO -0.15 0.07 0.29 0.44 -0.13 0.00 0.00 178.44 178.96 2boa h ASP 87 N 0.15 0.89 -0.77 1.25 3.32 0.56 -0.96 116.42 120.86 2boa h ASP 87 Ca 0.07 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.02 2boa h ASP 87 Cb 0.04 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.32 2boa h ASP 87 CO -0.07 0.78 0.51 0.78 -1.72 0.00 0.00 179.24 179.52 2boa h ASN 88 N 0.97 0.89 0.24 6.45 -0.26 -0.90 -1.75 115.58 121.22 2boa h ASN 88 Ca 0.23 -0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.93 2boa h ASN 88 Cb 0.15 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 37.19 2boa h ASN 88 CO -0.02 0.65 -0.12 -0.08 -1.06 0.00 0.00 177.43 176.80 2boa h GLU 89 N 1.05 -0.31 -0.59 0.81 4.81 -0.57 -2.02 114.58 117.76 2boa h GLU 89 Ca 0.28 0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.65 2boa h GLU 89 Cb -0.11 0.07 -0.11 0.00 0.63 0.00 0.00 28.75 29.23 2boa h GLU 89 CO -0.06 0.05 -0.17 -0.44 -0.73 0.00 0.00 179.01 177.66 2boa h ASP 90 N -0.84 -0.63 -0.37 1.04 3.45 -1.21 0.30 116.42 118.16 2boa h ASP 90 Ca -0.03 0.18 0.02 0.00 0.43 0.00 0.00 57.03 57.63 2boa h ASP 90 Cb 0.51 0.39 -0.03 0.00 -0.56 0.00 0.00 39.33 39.65 2boa h ASP 90 CO 0.05 -0.21 0.20 0.44 -1.57 0.00 0.00 179.24 178.15 2boa h ASP 91 N -0.03 0.30 -0.40 6.45 3.45 -1.32 0.57 116.42 125.45 2boa h ASP 91 Ca 0.28 0.01 -0.10 0.00 0.43 0.00 0.00 57.03 57.65 2boa h ASP 91 Cb 0.45 -0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 39.17 2boa h ASP 91 CO -0.62 0.22 -0.15 -0.33 -1.57 0.00 0.00 179.24 176.80 2boa h GLU 92 N 0.41 0.80 -0.62 3.56 5.08 -0.74 -0.56 114.58 122.51 2boa h GLU 92 Ca 0.15 -0.33 -0.07 0.00 -1.00 0.00 0.00 59.36 58.11 2boa h GLU 92 Cb 0.04 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2boa h GLU 92 CO -0.09 0.95 0.10 0.52 -1.00 0.00 0.00 179.01 179.49 2boa h MET 93 N 0.61 1.00 -0.31 2.33 2.86 -0.07 -2.08 114.93 119.28 2boa h MET 93 Ca 0.09 -0.26 -0.18 0.00 -2.06 0.00 0.00 59.70 57.30 2boa h MET 93 Cb 0.69 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.22 2boa h MET 93 CO 0.05 0.93 -0.51 0.37 1.06 0.00 0.00 176.91 178.80 2boa h GLN 94 N 0.94 0.88 0.81 1.72 4.15 0.29 -2.32 115.11 121.59 2boa h GLN 94 Ca 0.19 -0.54 -0.04 0.00 0.77 0.00 0.00 58.65 59.03 2boa h GLN 94 Cb 0.41 0.05 0.01 0.00 0.21 0.00 0.00 27.48 28.17 2boa h GLN 94 CO 0.01 1.18 -0.39 1.25 -1.93 0.00 0.00 178.83 178.95 2boa h HIS 95 N 0.69 -1.01 -0.84 3.99 2.76 -1.08 -3.00 115.15 116.65 2boa h HIS 95 Ca 0.02 -0.02 0.12 0.00 -2.20 0.00 0.00 60.37 58.29 2boa h HIS 95 Cb 1.12 0.34 -0.06 0.00 1.55 0.00 0.00 27.41 30.35 2boa h HIS 95 CO 0.07 -0.62 0.54 -0.97 -1.30 0.00 0.00 177.93 175.65 2boa h ASN 96 N -1.13 0.63 -0.69 3.26 -1.24 -1.40 -0.22 115.58 114.79 2boa h ASN 96 Ca -0.11 0.03 -0.02 0.00 0.71 0.00 0.00 56.30 56.90 2boa h ASN 96 Cb 0.84 -0.10 -0.03 0.00 0.73 0.00 0.00 38.32 39.76 2boa h ASN 96 CO 0.18 0.34 0.34 -0.08 -1.29 0.00 0.00 177.43 176.93 2boa h GLU 97 N 0.68 1.00 -0.58 6.67 4.81 -1.41 0.40 114.58 126.14 2boa h GLU 97 Ca 0.40 -0.14 -0.05 0.00 -0.13 0.00 0.00 59.36 59.44 2boa h GLU 97 Cb 0.62 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 2boa h GLU 97 CO -0.17 0.78 0.15 0.78 -0.73 0.00 0.00 179.01 179.82 2boa h GLY 98 N 0.96 0.96 1.07 1.92 0.00 -0.93 0.55 103.07 107.61 2boa h GLY 98 Ca 0.24 -0.56 -0.10 0.00 0.00 0.00 0.00 47.33 46.90 2boa h GLY 98 CO -0.03 0.53 -0.07 1.46 0.00 0.00 0.00 176.54 178.43 2boa h GLN 99 N 0.86 1.00 -0.35 4.80 4.20 -0.70 -2.88 115.11 122.05 2boa h GLN 99 Ca 0.19 -0.36 -0.16 0.00 0.06 0.00 0.00 58.65 58.39 2boa h GLN 99 Cb 0.30 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 2boa h GLN 99 CO -0.00 1.04 -0.40 0.93 -0.67 0.00 0.00 178.83 179.72 2boa h GLU 1001N 0.88 0.85 -0.66 1.46 5.08 -0.77 -0.14 114.58 121.28 2boa h GLU 1001Ca 0.14 -0.45 0.19 0.00 -1.00 0.00 0.00 59.36 58.24 2boa h GLU 1001Cb 0.63 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 2boa h GLU 1001CO 0.04 1.09 0.52 -0.09 -1.00 0.00 0.00 179.01 179.57 2boa h ARG 1002N 0.69 0.00 0.00 2.33 2.43 -0.79 0.11 114.38 119.16 2boa h ARG 1002Ca 0.05 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.86 2boa h ARG 1002Cb 0.98 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.47 2boa h ARG 1002CO 0.09 0.00 -2.27 0.45 -1.51 0.00 0.00 179.97 176.73 2boa n SER 1003N -4.16 1.97 0.13 -3.80 2.88 -1.10 -4.58 113.62 104.96 2boa n SER 1003Ca 0.13 0.09 0.13 0.00 -1.33 0.00 0.00 58.87 57.89 2boa n SER 1003Cb 0.77 -0.52 0.33 0.00 -0.75 0.00 0.00 64.21 64.04 2boa n SER 1003CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2boa h SER 1004N -0.43 0.00 0.00 -3.46 4.64 -1.02 -3.47 113.55 109.81 2boa h SER 1004Ca -0.54 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 2boa h SER 1004Cb 1.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.72 2boa h SER 1004CO -0.22 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.33 2boa n ASN 1005N -2.48 0.00 -4.79 4.97 3.02 0.39 -4.95 115.26 111.41 2boa n ASN 1005Ca 0.05 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.23 2boa n ASN 1005Cb 0.46 -0.30 -0.06 0.00 -0.61 0.00 0.00 39.78 39.27 2boa n ASN 1005CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2boa s ASN 1006N -1.49 7.26 -0.21 6.41 0.01 -1.26 -4.99 114.94 120.68 2boa s ASN 1006Ca 0.00 1.71 -0.19 0.00 -0.71 0.00 0.00 52.86 53.67 2boa s ASN 1006Cb 0.00 -2.53 -0.03 0.00 0.41 0.00 0.00 41.25 39.10 2boa s ASN 1006CO 0.00 -0.03 0.54 0.12 -1.51 0.00 0.00 177.10 176.22 2boa s PHE 1007N -1.57 3.36 -0.55 2.20 2.19 -1.26 -4.56 117.98 117.79 2boa s PHE 1007Ca 0.48 0.78 -0.18 0.00 0.33 0.00 0.00 56.93 58.33 2boa s PHE 1007Cb -0.18 -2.70 0.09 0.00 -1.31 0.00 0.00 43.02 38.91 2boa s PHE 1007CO 0.23 -0.14 0.63 1.21 1.83 0.00 0.00 175.22 178.98 2boa s ASN 1008N 1.21 6.19 0.00 6.13 3.84 -1.26 -4.91 114.94 126.14 2boa s ASN 1008Ca 0.25 -1.27 0.09 0.00 0.21 0.00 0.00 52.86 52.13 2boa s ASN 1008Cb -0.15 -2.28 0.43 0.00 -0.55 0.00 0.00 41.25 38.70 2boa s ASN 1008CO 0.10 -0.98 1.21 -1.22 -2.79 0.00 0.00 177.10 173.42 2boa n TYR 1009N 6.09 0.00 -0.78 0.43 4.02 -1.26 -2.36 117.16 123.30 2boa n TYR 1009Ca -0.09 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.82 2boa n TYR 1009Cb 0.43 -0.36 0.34 0.00 -0.02 0.00 0.00 39.34 39.74 2boa n TYR 1009CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2boa n GLY 1010N -0.53 3.08 3.28 2.72 0.00 -1.26 -4.63 105.19 107.85 2boa n GLY 1010Ca 0.04 -0.87 -0.15 0.00 0.00 0.00 0.00 46.02 45.04 2boa n GLY 1010CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2boa s ALA 1011N -2.68 1.56 0.35 4.61 0.00 -1.00 -4.57 121.76 120.03 2boa s ALA 1011Ca 0.50 -1.71 -0.18 0.00 0.00 0.00 0.00 51.96 50.57 2boa s ALA 1011Cb 0.39 0.68 -0.10 0.00 0.00 0.00 0.00 23.12 24.10 2boa s ALA 1011CO 0.14 -0.35 0.82 0.71 0.00 0.00 0.00 175.76 177.08 2boa s TYR 1012N -3.64 3.40 0.08 0.00 2.02 -1.26 -5.00 117.35 112.95 2boa s TYR 1012Ca 0.29 1.40 0.03 0.00 -0.37 0.00 0.00 57.07 58.41 2boa s TYR 1012Cb 0.06 -2.67 -0.03 0.00 -0.40 0.00 0.00 41.96 38.92 2boa s TYR 1012CO 0.08 0.06 -0.09 -1.01 -1.57 0.00 0.00 175.55 173.02 2boa s HIS 1013N -1.98 0.90 0.62 2.71 3.76 -1.26 -4.92 115.29 115.12 2boa s HIS 1013Ca 0.55 -0.64 -0.18 0.00 -0.15 0.00 0.00 55.06 54.65 2boa s HIS 1013Cb -0.11 -0.51 -0.02 0.00 1.11 0.00 0.00 32.58 33.05 2boa s HIS 1013CO 0.17 -0.06 1.22 -1.54 -0.85 0.00 0.00 174.74 173.68 2boa s SER 1014N -2.20 4.97 0.34 1.40 1.04 -1.26 -4.82 113.70 113.18 2boa s SER 1014Ca 0.01 2.41 0.12 0.00 0.48 0.00 0.00 55.95 58.96 2boa s SER 1014Cb -0.04 -2.60 0.95 0.00 0.10 0.00 0.00 66.02 64.43 2boa s SER 1014CO -0.01 -1.74 1.74 0.25 0.98 0.00 0.00 173.24 174.46 2boa h LEU 1015N 0.66 0.61 -0.28 2.42 5.85 -1.96 0.47 115.31 123.07 2boa h LEU 1015Ca -0.50 0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.40 2boa h LEU 1015Cb 1.30 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.30 2boa h LEU 1015CO 0.54 0.10 -0.10 -0.08 -0.34 0.00 0.00 178.44 178.55 2boa h GLU 1016N 0.53 -0.05 -0.17 1.25 4.81 -2.00 -1.92 114.58 117.03 2boa h GLU 1016Ca 0.64 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.72 2boa h GLU 1016Cb 1.32 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 2boa h GLU 1016CO -0.43 -0.03 -0.54 0.00 -0.73 0.00 0.00 179.01 177.28 2boa h ALA 1017N 1.21 0.75 0.49 2.92 0.00 -1.28 -2.05 119.26 121.31 2boa h ALA 1017Ca 0.14 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2boa h ALA 1017Cb 0.26 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2boa h ALA 1017CO -0.32 0.69 -0.27 0.82 0.00 0.00 0.00 179.25 180.17 2boa h ILE 1018N 0.38 0.45 -0.58 0.00 2.04 -1.32 0.48 117.51 118.96 2boa h ILE 1018Ca 0.01 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.99 2boa h ILE 1018Cb 1.06 0.45 -0.09 0.00 -0.74 0.00 0.00 36.82 37.50 2boa h ILE 1018CO 0.10 0.00 0.05 1.88 0.00 0.00 0.00 178.15 180.18 2boa h TYR 1019N -0.71 0.06 -0.49 1.37 0.99 -1.25 0.14 116.97 117.08 2boa h TYR 1019Ca -0.06 0.04 0.03 0.00 2.00 0.00 0.00 58.73 60.74 2boa h TYR 1019Cb 0.56 0.07 -0.04 0.00 1.00 0.00 0.00 36.73 38.32 2boa h TYR 1019CO -0.07 -0.10 0.28 1.25 -0.00 0.00 0.00 178.16 179.52 2boa h HIS 1020N 0.17 0.52 -0.40 4.88 2.76 -1.27 -2.46 115.15 119.35 2boa h HIS 1020Ca 0.30 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.45 2boa h HIS 1020Cb 0.47 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.25 2boa h HIS 1020CO -0.31 0.28 0.06 1.49 -1.30 0.00 0.00 177.93 178.15 2boa h GLU 1021N 0.55 0.61 -0.51 5.26 4.57 0.11 0.22 114.58 125.40 2boa h GLU 1021Ca 0.20 -0.12 0.01 0.00 -1.18 0.00 0.00 59.36 58.27 2boa h GLU 1021Cb 0.06 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.53 2boa h GLU 1021CO -0.11 0.59 0.34 0.52 -1.18 0.00 0.00 179.01 179.16 2boa h MET 1022N 0.59 0.66 -0.00 1.92 2.86 -0.40 -0.59 114.93 119.97 2boa h MET 1022Ca 0.13 -0.04 -0.22 0.00 -2.06 0.00 0.00 59.70 57.51 2boa h MET 1022Cb 0.29 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 2boa h MET 1022CO 0.00 0.44 -0.92 0.22 1.06 0.00 0.00 176.91 177.71 2boa h ASP 1023N 0.68 0.49 0.26 1.22 -0.00 -0.90 -2.86 116.42 115.31 2boa h ASP 1023Ca 0.19 -0.39 -0.01 0.00 -0.00 0.00 0.00 57.03 56.82 2boa h ASP 1023Cb -0.06 -0.15 0.00 0.00 -0.00 0.00 0.00 39.33 39.12 2boa h ASP 1023CO -0.04 1.18 -0.13 0.78 -0.00 0.00 0.00 179.24 181.03 2boa h ASN 1024N 0.21 -0.30 -0.26 2.28 2.35 -0.34 0.11 115.58 119.64 2boa h ASN 1024Ca -0.07 -0.11 0.04 0.00 -0.55 0.00 0.00 56.30 55.61 2boa h ASN 1024Cb 1.55 0.08 -0.07 0.00 0.05 0.00 0.00 38.32 39.93 2boa h ASN 1024CO 0.16 -0.07 -0.53 0.40 -1.65 0.00 0.00 177.43 175.74 2boa h ILE 1025N -0.53 0.00 -0.64 2.81 2.04 -1.19 0.48 117.51 120.48 2boa h ILE 1025Ca -0.04 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.94 2boa h ILE 1025Cb 0.39 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.35 2boa h ILE 1025CO 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 178.15 177.92 2boa h ALA 1026N -0.23 0.11 0.00 1.87 0.00 -1.52 0.22 119.26 119.72 2boa h ALA 1026Ca 0.05 0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 2boa h ALA 1026Cb 0.61 0.72 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2boa h ALA 1026CO -0.49 -0.60 -0.20 0.00 0.00 0.00 0.00 179.25 177.96 2boa h ALA 1027N 1.22 1.33 0.01 0.00 0.00 -0.10 -2.25 119.26 119.46 2boa h ALA 1027Ca 0.27 -0.18 -0.20 0.00 0.00 0.00 0.00 54.91 54.80 2boa h ALA 1027Cb 0.54 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2boa h ALA 1027CO -0.70 0.25 -0.91 -0.44 0.00 0.00 0.00 179.25 177.44 2boa h ASP 1028N 0.00 0.08 -2.12 0.00 3.32 0.18 -3.38 116.42 114.49 2boa h ASP 1028Ca -0.00 -0.07 -0.57 0.00 0.02 0.00 0.00 57.03 56.41 2boa h ASP 1028Cb 0.45 -0.02 -0.41 0.00 0.22 0.00 0.00 39.33 39.57 2boa h ASP 1028CO 0.03 0.95 -0.84 0.49 -1.72 0.00 0.00 179.24 178.14 2boa n PHE 1029N -3.52 1.99 0.61 4.55 3.01 0.60 -4.94 117.46 119.76 2boa n PHE 1029Ca -0.01 -3.90 0.07 0.00 1.01 0.00 0.00 57.45 54.62 2boa n PHE 1029Cb 0.85 -0.46 0.34 0.00 -0.01 0.00 0.00 39.48 40.20 2boa n PHE 1029CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2boa n PRO 1030N 0.78 0.13 -0.00 -1.08 -0.04 -0.89 -1.00 135.00 132.89 2boa n PRO 1030Ca 0.27 0.19 0.07 0.00 -0.04 0.00 0.00 63.50 63.99 2boa n PRO 1030Cb 0.48 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.50 2boa n PRO 1030CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2boa n ASP 1031N -1.36 2.24 0.00 3.54 8.00 -1.26 -4.65 116.55 123.06 2boa n ASP 1031Ca 0.06 -1.62 0.00 0.00 0.71 0.00 0.00 54.79 53.94 2boa n ASP 1031Cb 0.13 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.23 2boa n ASP 1031CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2boa n LEU 1032N 0.82 0.95 -4.17 0.64 7.94 -0.17 -4.83 117.00 118.18 2boa n LEU 1032Ca 0.09 0.00 -0.23 0.00 -1.11 0.00 0.00 56.01 54.76 2boa n LEU 1032Cb 0.37 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 44.18 2boa n LEU 1032CO 0.09 0.16 -0.49 0.00 -1.11 0.00 0.00 177.39 176.04 2boa s ALA 1033N -1.59 1.36 -0.00 1.96 0.00 -0.49 -1.35 121.76 121.65 2boa s ALA 1033Ca 0.00 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.14 2boa s ALA 1033Cb 0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 23.12 22.85 2boa s ALA 1033CO 0.00 0.30 -0.05 -0.98 0.00 0.00 0.00 175.76 175.03 2boa s ARG 1034N -0.90 0.38 -0.30 0.00 1.70 -0.87 -4.54 118.95 114.42 2boa s ARG 1034Ca 0.05 -0.16 -0.25 0.00 -0.47 0.00 0.00 55.73 54.90 2boa s ARG 1034Cb -0.07 -0.37 0.00 0.00 -0.57 0.00 0.00 34.95 33.94 2boa s ARG 1034CO 0.01 0.09 0.86 0.50 -1.08 0.00 0.00 175.30 175.68 2boa s ARG 1035N -0.07 4.02 -0.08 3.89 3.52 -1.26 -0.67 118.95 128.30 2boa s ARG 1035Ca 0.01 0.75 0.02 0.00 -0.13 0.00 0.00 55.73 56.38 2boa s ARG 1035Cb -0.02 -3.72 -0.02 0.00 -1.56 0.00 0.00 34.95 29.63 2boa s ARG 1035CO -0.00 -0.71 -0.13 0.08 -0.81 0.00 0.00 175.30 173.73 2boa s VAL 1036N 3.10 3.15 -0.20 7.11 1.01 0.12 -4.92 120.40 129.76 2boa s VAL 1036Ca 0.36 -0.67 -0.20 0.00 0.00 0.00 0.00 61.98 61.47 2boa s VAL 1036Cb -0.14 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 2boa s VAL 1036CO 0.12 0.57 0.60 -0.75 0.00 0.00 0.00 175.10 175.64 2boa s LYS 1037N -0.35 4.19 -0.00 2.72 2.20 -1.26 -0.61 119.74 126.63 2boa s LYS 1037Ca 0.04 0.56 0.16 0.00 -0.36 0.00 0.00 55.97 56.37 2boa s LYS 1037Cb -0.13 -3.58 -0.19 0.00 -1.51 0.00 0.00 37.83 32.42 2boa s LYS 1037CO 0.02 -0.24 0.64 0.44 -0.36 0.00 0.00 175.35 175.86 2boa n ILE 1038N 4.71 0.00 -0.22 5.43 -5.35 -0.35 -5.00 119.36 118.58 2boa n ILE 1038Ca -0.02 -0.16 0.00 0.00 -0.27 0.00 0.00 62.75 62.30 2boa n ILE 1038Cb 0.50 0.85 0.00 0.00 -1.74 0.00 0.00 39.64 39.24 2boa n ILE 1038CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2boa n GLY 1039N 1.41 -0.50 3.05 3.28 0.00 -1.25 -4.86 105.19 106.33 2boa n GLY 1039Ca 0.02 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 45.15 2boa n GLY 1039CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2boa s HIS 1040N -3.94 0.56 0.83 1.61 3.76 -1.26 -0.59 115.29 116.25 2boa s HIS 1040Ca 0.00 -0.61 -0.11 0.00 -0.15 0.00 0.00 55.06 54.19 2boa s HIS 1040Cb 0.00 -0.35 0.13 0.00 1.11 0.00 0.00 32.58 33.47 2boa s HIS 1040CO 0.00 -0.15 1.17 -1.54 -0.85 0.00 0.00 174.74 173.37 2boa s SER 1041N -1.84 4.03 0.37 1.40 1.04 -0.26 -4.13 113.70 114.31 2boa s SER 1041Ca -0.08 0.35 0.05 0.00 0.48 0.00 0.00 55.95 56.75 2boa s SER 1041Cb -0.07 -0.69 0.73 0.00 0.10 0.00 0.00 66.02 66.09 2boa s SER 1041CO -0.02 -2.14 1.99 0.15 0.98 0.00 0.00 173.24 174.20 2boa h PHE 1042N -1.10 0.57 -0.14 5.02 3.57 -1.95 -0.65 116.94 122.27 2boa h PHE 1042Ca -0.44 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.05 2boa h PHE 1042Cb 1.28 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.84 2boa h PHE 1042CO -0.31 0.43 0.00 0.39 -2.23 0.00 0.00 178.31 176.59 2boa n GLU 1043N -4.40 1.64 -1.51 1.11 1.02 -1.26 -4.92 120.64 112.33 2boa n GLU 1043Ca 0.03 -0.97 0.00 0.00 -0.02 0.00 0.00 57.16 56.21 2boa n GLU 1043Cb 0.12 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 2boa n GLU 1043CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2boa n ASN 1044N 0.19 -1.30 -4.84 1.62 3.02 -0.25 -5.06 115.26 108.65 2boa n ASN 1044Ca 0.16 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.39 2boa n ASN 1044Cb 0.30 -0.43 -0.04 0.00 -0.61 0.00 0.00 39.78 39.00 2boa n ASN 1044CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2boa s ARG 1045N -3.12 3.98 0.49 3.52 0.52 -1.26 -4.70 118.95 118.38 2boa s ARG 1045Ca 0.00 0.91 -0.24 0.00 -0.52 0.00 0.00 55.73 55.88 2boa s ARG 1045Cb 0.00 -2.19 -0.07 0.00 0.52 0.00 0.00 34.95 33.21 2boa s ARG 1045CO 0.00 -0.17 1.35 -2.14 0.02 0.00 0.00 175.30 174.35 2boa s PRO 1046N -3.82 3.50 -0.38 3.54 0.02 -1.26 -1.10 135.00 135.49 2boa s PRO 1046Ca 0.58 2.23 -0.12 0.00 0.02 0.00 0.00 61.00 63.71 2boa s PRO 1046Cb -0.10 -2.47 0.02 0.00 0.02 0.00 0.00 34.50 31.98 2boa s PRO 1046CO 0.27 -0.90 0.22 -1.64 -0.33 0.00 0.00 177.00 174.62 2boa s MET 1047N -2.65 2.90 -0.11 5.54 -1.94 0.24 -4.76 119.30 118.52 2boa s MET 1047Ca 0.65 -1.03 -0.06 0.00 -1.71 0.00 0.00 55.69 53.54 2boa s MET 1047Cb -0.40 -3.77 -0.04 0.00 2.01 0.00 0.00 34.83 32.64 2boa s MET 1047CO 0.49 -0.68 0.11 0.71 -0.01 0.00 0.00 175.02 175.64 2boa s TYR 1048N 1.58 3.50 0.05 -0.03 4.12 -1.26 -1.21 117.35 124.10 2boa s TYR 1048Ca 0.03 0.45 0.06 0.00 0.02 0.00 0.00 57.07 57.63 2boa s TYR 1048Cb -0.19 -1.91 -0.03 0.00 -1.52 0.00 0.00 41.96 38.32 2boa s TYR 1048CO 0.07 0.67 -0.17 0.08 0.02 0.00 0.00 175.55 176.23 2boa s VAL 1049N -0.97 1.33 -0.18 0.71 1.01 0.22 -4.51 120.40 118.01 2boa s VAL 1049Ca 0.14 -1.16 -0.13 0.00 0.00 0.00 0.00 61.98 60.83 2boa s VAL 1049Cb -0.12 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 2boa s VAL 1049CO 0.04 0.02 0.28 -0.76 0.00 0.00 0.00 175.10 174.67 2boa s LEU 1050N -1.33 4.22 -0.26 3.92 1.43 -0.24 0.11 118.68 126.53 2boa s LEU 1050Ca 0.03 0.44 -0.10 0.00 -1.03 0.00 0.00 54.13 53.47 2boa s LEU 1050Cb -0.09 -2.34 -0.05 0.00 0.03 0.00 0.00 46.19 43.75 2boa s LEU 1050CO 0.02 0.08 0.16 -0.75 0.23 0.00 0.00 176.35 176.09 2boa s LYS 1051N 0.62 3.96 -0.25 1.70 2.20 0.16 -0.47 119.74 127.66 2boa s LYS 1051Ca 0.15 -0.32 -0.08 0.00 -0.36 0.00 0.00 55.97 55.36 2boa s LYS 1051Cb -0.13 -3.57 -0.03 0.00 -1.51 0.00 0.00 37.83 32.59 2boa s LYS 1051CO 0.04 -0.08 0.09 -0.06 -0.36 0.00 0.00 175.35 174.98 2boa s PHE 1052N 1.45 3.11 -0.14 4.03 0.40 0.19 -2.05 117.98 124.97 2boa s PHE 1052Ca 0.07 -0.31 -0.13 0.00 -0.60 0.00 0.00 56.93 55.96 2boa s PHE 1052Cb -0.15 -2.26 0.04 0.00 0.51 0.00 0.00 43.02 41.16 2boa s PHE 1052CO 0.08 -0.31 0.38 0.45 0.70 0.00 0.00 175.22 176.52 2boa s SER 1053N 1.59 -0.40 0.00 1.36 0.15 -0.46 -1.47 113.70 114.48 2boa s SER 1053Ca 0.06 0.76 0.18 0.00 0.70 0.00 0.00 55.95 57.65 2boa s SER 1053Cb -0.15 0.76 -0.01 0.00 -1.71 0.00 0.00 66.02 64.90 2boa s SER 1053CO 0.05 -0.13 0.90 0.35 1.20 0.00 0.00 173.24 175.60 2boa n THR 1054N 2.99 0.00 0.84 6.45 -2.24 -1.25 -4.42 114.28 116.64 2boa n THR 1054Ca -0.14 -0.31 0.09 0.00 -2.27 0.00 0.00 64.05 61.43 2boa n THR 1054Cb 0.57 1.20 0.46 0.00 -2.10 0.00 0.00 70.33 70.46 2boa n THR 1054CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2boa n GLY 1055N 1.22 -0.95 2.44 3.38 0.00 -1.26 -4.91 105.19 105.12 2boa n GLY 1055Ca 0.07 -0.08 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 2boa n GLY 1055CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2boa n LYS 1055N -1.32 -1.48 0.00 1.61 5.02 -1.26 -2.66 118.16 118.07 2boa n LYS 1055Ca 0.08 1.03 0.00 0.00 -2.02 0.00 0.00 58.31 57.40 2boa n LYS 1055Cb 0.16 -5.52 0.00 0.00 -0.02 0.00 0.00 35.03 29.65 2boa n LYS 1055CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2boa n GLY 1056N -0.86 2.99 3.76 0.72 0.00 -1.26 -5.13 105.19 105.42 2boa n GLY 1056Ca -0.22 -0.50 -0.40 0.00 0.00 0.00 0.00 46.02 44.91 2boa n GLY 1056CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2boa s VAL 1057N -0.11 3.26 -0.29 1.61 1.01 -1.09 -5.00 120.40 119.80 2boa s VAL 1057Ca 0.00 1.21 -0.29 0.00 0.00 0.00 0.00 61.98 62.90 2boa s VAL 1057Cb 0.00 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 2boa s VAL 1057CO 0.00 0.25 1.46 -0.60 0.00 0.00 0.00 175.10 176.20 2boa s ARG 1058N -1.74 3.80 0.33 2.72 3.52 -1.26 -4.80 118.95 121.52 2boa s ARG 1058Ca 0.48 1.37 0.08 0.00 -0.13 0.00 0.00 55.73 57.53 2boa s ARG 1058Cb -0.33 -3.97 -0.03 0.00 -1.56 0.00 0.00 34.95 29.06 2boa s ARG 1058CO 0.43 -1.28 0.21 1.03 -0.81 0.00 0.00 175.30 174.88 2boa s ARG 1059N 4.52 2.57 0.37 5.12 0.52 -1.26 -5.09 118.95 125.71 2boa s ARG 1059Ca 0.64 -1.39 -0.26 0.00 -0.52 0.00 0.00 55.73 54.19 2boa s ARG 1059Cb -0.20 -2.34 -0.12 0.00 0.52 0.00 0.00 34.95 32.82 2boa s ARG 1059CO 0.27 0.14 1.16 -0.35 0.02 0.00 0.00 175.30 176.53 2boa n PRO 1060N -1.24 1.73 -4.16 3.54 -0.04 -1.26 -4.64 135.00 128.93 2boa n PRO 1060Ca -0.03 0.61 -0.16 0.00 -0.04 0.00 0.00 63.50 63.88 2boa n PRO 1060Cb 0.60 -2.18 -0.12 0.00 -0.04 0.00 0.00 33.50 31.76 2boa n PRO 1060CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2boa s ALA 1061N -1.16 0.81 -0.19 0.55 0.00 -0.53 -1.34 121.76 119.90 2boa s ALA 1061Ca 0.59 -0.76 -0.03 0.00 0.00 0.00 0.00 51.96 51.77 2boa s ALA 1061Cb -0.57 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.48 2boa s ALA 1061CO 0.59 0.09 -0.06 0.08 0.00 0.00 0.00 175.76 176.46 2boa s VAL 1062N -1.09 3.38 -0.13 0.00 1.01 0.01 0.36 120.40 123.95 2boa s VAL 1062Ca -0.04 -0.51 -0.17 0.00 0.00 0.00 0.00 61.98 61.25 2boa s VAL 1062Cb -0.09 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 2boa s VAL 1062CO 0.01 0.46 0.44 0.86 0.00 0.00 0.00 175.10 176.87 2boa s TRP 1063N 1.03 3.50 -0.30 5.22 -0.11 0.10 -0.42 118.94 127.95 2boa s TRP 1063Ca 0.00 0.83 0.02 0.00 1.22 0.00 0.00 56.10 58.17 2boa s TRP 1063Cb -0.15 -2.51 0.09 0.00 -1.50 0.00 0.00 33.47 29.40 2boa s TRP 1063CO -0.00 0.18 0.02 -0.51 -4.62 0.00 0.00 176.95 172.02 2boa s LEU 1064N 0.61 3.65 0.14 5.86 1.02 0.25 -0.81 118.68 129.39 2boa s LEU 1064Ca 0.24 -1.76 0.08 0.00 0.02 0.00 0.00 54.13 52.71 2boa s LEU 1064Cb -0.15 -1.37 -0.04 0.00 0.02 0.00 0.00 46.19 44.65 2boa s LEU 1064CO 0.09 -0.33 -0.12 0.54 0.02 0.00 0.00 176.35 176.55 2boa s ASN 1065N 1.17 4.20 0.08 2.29 6.03 -1.02 0.42 114.94 128.12 2boa s ASN 1065Ca 0.05 -0.52 -0.02 0.00 -1.03 0.00 0.00 52.86 51.35 2boa s ASN 1065Cb -0.19 -0.71 -0.04 0.00 -3.03 0.00 0.00 41.25 37.29 2boa s ASN 1065CO -0.11 0.14 0.02 0.00 -2.03 0.00 0.00 177.10 175.12 2boa s ALA 1066N -1.42 0.59 -0.84 3.54 0.00 -0.04 -1.30 121.76 122.29 2boa s ALA 1066Ca 0.22 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 50.92 2boa s ALA 1066Cb -0.10 0.50 0.00 0.00 0.00 0.00 0.00 23.12 23.52 2boa s ALA 1066CO 0.13 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.88 2boa n GLY 1067N 0.02 0.90 0.23 0.00 0.00 -1.25 -0.25 105.19 104.84 2boa n GLY 1067Ca -0.11 -0.66 -0.07 0.00 0.00 0.00 0.00 46.02 45.18 2boa n GLY 1067CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2boa h ILE 1068N 0.00 1.15 -3.65 -0.61 2.10 -1.87 -2.19 117.51 112.44 2boa h ILE 1068Ca -0.17 -0.29 -0.62 0.00 1.08 0.00 0.00 64.86 64.86 2boa h ILE 1068Cb 0.59 0.36 -0.14 0.00 -1.09 0.00 0.00 36.82 36.55 2boa h ILE 1068CO 0.24 0.15 -0.27 -1.00 -1.08 0.00 0.00 178.15 176.19 2boa s HIS 1069N -6.10 3.29 0.09 2.19 3.76 -1.26 -4.46 115.29 112.79 2boa s HIS 1069Ca -0.13 0.43 -0.16 0.00 -0.15 0.00 0.00 55.06 55.05 2boa s HIS 1069Cb 0.12 -2.52 -0.08 0.00 1.11 0.00 0.00 32.58 31.21 2boa s HIS 1069CO 0.75 -0.14 1.44 0.66 -0.85 0.00 0.00 174.74 176.60 2boa h SER 1070N 7.90 0.66 0.00 1.40 4.64 -1.63 -2.75 113.55 123.77 2boa h SER 1070Ca -0.34 -0.43 0.00 0.00 -0.47 0.00 0.00 61.79 60.55 2boa h SER 1070Cb 1.16 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 2boa h SER 1070CO 0.66 0.95 0.03 -2.11 -0.87 0.00 0.00 176.83 175.49 2boa n ARG 1071N -4.37 0.09 -1.26 4.77 1.85 -0.21 -3.86 116.66 113.67 2boa n ARG 1071Ca -0.04 0.58 -0.23 0.00 -1.00 0.00 0.00 57.85 57.17 2boa n ARG 1071Cb 0.40 -1.83 -0.10 0.00 -1.05 0.00 0.00 32.46 29.88 2boa n ARG 1071CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2boa n GLU 1072N -1.99 2.60 -0.26 2.89 1.02 -1.04 -4.74 120.64 119.11 2boa n GLU 1072Ca -0.01 -1.76 0.33 0.00 -0.02 0.00 0.00 57.16 55.71 2boa n GLU 1072Cb 0.05 -2.22 0.70 0.00 -0.02 0.00 0.00 31.44 29.96 2boa n GLU 1072CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 2boa h TRP 1073N 3.45 0.00 0.00 -0.32 4.06 -1.79 0.64 115.95 121.99 2boa h TRP 1073Ca 0.40 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.30 2boa h TRP 1073Cb 1.01 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.16 2boa h TRP 1073CO 1.70 0.00 -0.21 0.97 -3.56 0.00 0.00 178.44 177.35 2boa h ILE 1074N 0.00 0.91 0.04 1.49 6.09 -1.85 -2.39 117.51 121.81 2boa h ILE 1074Ca 0.52 -0.78 -0.00 0.00 -1.37 0.00 0.00 64.86 63.23 2boa h ILE 1074Cb 2.33 1.45 0.00 0.00 0.47 0.00 0.00 36.82 41.07 2boa h ILE 1074CO -0.01 0.20 -0.02 0.77 -3.07 0.00 0.00 178.15 176.03 2boa h SER 1075N 0.00 -0.05 -0.71 2.19 4.64 -1.12 0.47 113.55 118.97 2boa h SER 1075Ca -0.00 -0.31 0.04 0.00 -0.47 0.00 0.00 61.79 61.04 2boa h SER 1075Cb 0.43 0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.49 2boa h SER 1075CO 0.03 0.29 0.44 1.56 -0.87 0.00 0.00 176.83 178.28 2boa h GLN 1076N -0.39 0.83 -0.14 4.77 7.50 -1.67 0.12 115.11 126.13 2boa h GLN 1076Ca -0.01 -0.05 -0.20 0.00 0.50 0.00 0.00 58.65 58.90 2boa h GLN 1076Cb 0.36 -0.19 0.01 0.00 0.05 0.00 0.00 27.48 27.71 2boa h GLN 1076CO 0.01 0.55 -0.69 0.00 -1.50 0.00 0.00 178.83 177.20 2boa h ALA 1077N 1.31 0.27 -0.39 3.87 0.00 -1.40 -2.49 119.26 120.44 2boa h ALA 1077Ca 0.29 -0.57 0.05 0.00 0.00 0.00 0.00 54.91 54.68 2boa h ALA 1077Cb 0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2boa h ALA 1077CO -0.12 0.58 0.14 1.15 0.00 0.00 0.00 179.25 181.00 2boa h THR 1078N 0.41 0.89 -0.76 0.00 2.02 -0.77 -2.88 112.91 111.82 2boa h THR 1078Ca -0.05 -0.10 0.07 0.00 0.77 0.00 0.00 66.41 67.10 2boa h THR 1078Cb 1.32 0.56 -0.06 0.00 -1.74 0.00 0.00 68.15 68.23 2boa h THR 1078CO 0.14 0.05 0.45 0.00 0.37 0.00 0.00 175.52 176.53 2boa h ALA 1079N 1.25 1.04 0.00 6.16 0.00 -0.54 -1.31 119.26 125.87 2boa h ALA 1079Ca 0.18 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.93 2boa h ALA 1079Cb 0.16 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2boa h ALA 1079CO -0.18 0.14 -0.79 0.97 0.00 0.00 0.00 179.25 179.39 2boa h ILE 1080N 0.81 1.35 -0.65 0.00 6.09 -1.45 -2.56 117.51 121.11 2boa h ILE 1080Ca 0.34 -2.91 -0.04 0.00 -1.37 0.00 0.00 64.86 60.89 2boa h ILE 1080Cb 0.21 2.67 -0.03 0.00 0.47 0.00 0.00 36.82 40.14 2boa h ILE 1080CO -0.19 0.77 0.25 -0.25 -3.07 0.00 0.00 178.15 175.66 2boa h TRP 1081N 0.00 0.99 -0.86 2.19 7.01 -1.29 -2.85 115.95 121.14 2boa h TRP 1081Ca -0.01 -0.08 0.04 0.00 2.11 0.00 0.00 58.89 60.96 2boa h TRP 1081Cb 1.60 -0.30 -0.05 0.00 -2.10 0.00 0.00 29.16 28.31 2boa h TRP 1081CO 0.00 0.78 0.54 1.15 -2.79 0.00 0.00 178.44 178.13 2boa h THR 1082N 0.91 1.10 -0.74 2.65 2.02 -1.08 0.34 112.91 118.12 2boa h THR 1082Ca 0.21 -0.35 0.08 0.00 0.77 0.00 0.00 66.41 67.12 2boa h THR 1082Cb 0.22 -0.02 -0.07 0.00 -1.74 0.00 0.00 68.15 66.54 2boa h THR 1082CO -0.02 0.19 0.41 0.00 0.37 0.00 0.00 175.52 176.47 2boa h ALA 1083N 1.37 1.02 -0.01 6.16 0.00 -1.31 -1.44 119.26 125.05 2boa h ALA 1083Ca 0.35 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.17 2boa h ALA 1083Cb 0.07 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2boa h ALA 1083CO -0.14 0.05 -0.59 -0.09 0.00 0.00 0.00 179.25 178.48 2boa h ARG 1084N 0.71 0.04 -0.07 0.00 9.65 -1.15 -3.23 114.38 120.33 2boa h ARG 1084Ca 0.35 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 59.18 2boa h ARG 1084Cb 0.29 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.87 2boa h ARG 1084CO -0.22 0.62 -0.01 -0.22 2.80 0.00 0.00 179.97 182.93 2boa h LYS 1085N 0.03 0.13 -0.59 0.20 1.63 -0.13 -2.57 116.57 115.27 2boa h LYS 1085Ca -0.01 -0.05 0.11 0.00 -0.85 0.00 0.00 60.65 59.86 2boa h LYS 1085Cb 1.05 -0.01 -0.09 0.00 -0.60 0.00 0.00 32.23 32.59 2boa h LYS 1085CO 0.08 0.46 0.11 0.82 -3.45 0.00 0.00 179.45 177.46 2boa h ILE 1086N -0.20 0.63 0.00 2.00 2.04 -1.35 -0.30 117.51 120.32 2boa h ILE 1086Ca 0.02 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.74 2boa h ILE 1086Cb 0.40 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 2boa h ILE 1086CO 0.01 0.04 -0.33 -0.37 0.00 0.00 0.00 178.15 177.50 2boa h VAL 1087N 0.24 0.45 0.00 1.67 -1.51 -1.59 -1.46 116.25 114.05 2boa h VAL 1087Ca 0.31 -1.64 0.00 0.00 -1.23 0.00 0.00 66.70 64.14 2boa h VAL 1087Cb 0.47 2.20 0.00 0.00 -2.13 0.00 0.00 31.29 31.83 2boa h VAL 1087CO -0.41 0.26 -0.69 -1.20 -1.23 0.00 0.00 177.57 174.29 2boa n SER 1088N -3.14 0.62 -0.00 4.19 7.64 -0.97 -4.17 113.62 117.78 2boa n SER 1088Ca 0.02 -0.08 0.06 0.00 1.01 0.00 0.00 58.87 59.89 2boa n SER 1088Cb 0.64 0.35 -0.08 0.00 -1.01 0.00 0.00 64.21 64.11 2boa n SER 1088CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2boa n ASP 1089N -1.89 1.25 -4.74 6.43 9.92 -0.16 -4.81 116.55 122.55 2boa n ASP 1089Ca 0.04 -0.44 -0.41 0.00 -0.53 0.00 0.00 54.79 53.44 2boa n ASP 1089Cb 0.41 1.26 -0.02 0.00 -0.64 0.00 0.00 41.12 42.12 2boa n ASP 1089CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 2boa s TYR 1090N -2.48 2.96 0.00 1.24 5.04 -0.56 -0.11 117.35 123.45 2boa s TYR 1090Ca 0.01 0.95 0.00 0.00 -2.44 0.00 0.00 57.07 55.59 2boa s TYR 1090Cb 0.09 -3.88 0.00 0.00 0.35 0.00 0.00 41.96 38.52 2boa s TYR 1090CO 0.52 -2.90 0.00 1.04 -1.34 0.00 0.00 175.55 172.86 2boa n GLN 1091N 2.39 0.00 -0.07 4.97 6.02 -1.26 -4.72 117.38 124.71 2boa n GLN 1091Ca 0.07 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.94 2boa n GLN 1091Cb 0.40 -2.18 -0.04 0.00 1.02 0.00 0.00 30.24 29.43 2boa n GLN 1091CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2boa n ARG 1092N -1.90 0.39 -2.86 -1.09 1.74 -0.90 -4.85 116.66 107.18 2boa n ARG 1092Ca 0.00 0.16 -0.42 0.00 -0.77 0.00 0.00 57.85 56.82 2boa n ARG 1092Cb 0.00 -1.17 -0.04 0.00 -1.02 0.00 0.00 32.46 30.23 2boa n ARG 1092CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2boa s ASP 1093N -6.28 6.76 0.51 0.55 2.15 0.84 -4.96 116.67 116.26 2boa s ASP 1093Ca -0.23 0.83 0.16 0.00 0.43 0.00 0.00 52.55 53.74 2boa s ASP 1093Cb 0.06 -2.44 1.25 0.00 -0.30 0.00 0.00 42.92 41.49 2boa s ASP 1093CO 0.32 -0.65 2.14 -0.65 -0.17 0.00 0.00 175.17 176.16 2boa h PRO 1094N 8.01 0.03 0.12 4.34 0.11 -1.89 -2.46 132.00 140.26 2boa h PRO 1094Ca -0.23 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.87 2boa h PRO 1094Cb 1.09 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2boa h PRO 1094CO 0.92 0.02 -0.06 0.00 -0.21 0.00 0.00 178.00 178.67 2boa h ALA 1095N 1.98 -0.16 0.00 -0.75 0.00 -1.93 -1.04 119.26 117.36 2boa h ALA 1095Ca 0.02 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 2boa h ALA 1095Cb 0.02 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2boa h ALA 1095CO -0.00 -0.38 -0.46 0.97 0.00 0.00 0.00 179.25 179.38 2boa h ILE 1096N -0.58 1.26 0.02 0.00 6.09 -1.89 -2.24 117.51 120.18 2boa h ILE 1096Ca -0.02 -1.61 -0.00 0.00 -1.37 0.00 0.00 64.86 61.86 2boa h ILE 1096Cb 0.46 1.88 0.00 0.00 0.47 0.00 0.00 36.82 39.63 2boa h ILE 1096CO 0.03 0.45 -0.01 0.74 -3.07 0.00 0.00 178.15 176.29 2boa h THR 1097N 0.00 1.17 0.00 2.19 2.02 -1.36 -1.03 112.91 115.89 2boa h THR 1097Ca -0.00 -0.59 -0.08 0.00 0.77 0.00 0.00 66.41 66.50 2boa h THR 1097Cb 0.85 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 68.81 2boa h THR 1097CO 0.06 0.15 -0.38 0.77 0.37 0.00 0.00 175.52 176.49 2boa h SER 1098N -0.29 0.00 -0.08 4.18 4.64 -1.19 -1.51 113.55 119.30 2boa h SER 1098Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2boa h SER 1098Cb 0.27 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2boa h SER 1098CO 0.01 0.38 0.02 0.40 -0.87 0.00 0.00 176.83 176.76 2boa h ILE 1099N 0.00 1.20 0.00 0.95 2.04 -1.28 -3.15 117.51 117.27 2boa h ILE 1099Ca -0.00 -0.61 -0.05 0.00 1.00 0.00 0.00 64.86 65.19 2boa h ILE 1099Cb 0.67 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 2boa h ILE 1099CO 0.05 0.17 -0.25 -0.07 0.00 0.00 0.00 178.15 178.05 2boa h LEU 1100N -0.10 0.00 -1.32 1.44 3.38 -0.94 0.50 115.31 118.27 2boa h LEU 1100Ca 0.02 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.09 2boa h LEU 1100Cb 0.26 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 2boa h LEU 1100CO 0.00 0.25 0.53 -0.08 0.09 0.00 0.00 178.44 179.23 2boa h GLU 1101N 0.00 0.74 0.00 1.13 4.57 -1.24 -3.27 114.58 116.51 2boa h GLU 1101Ca -0.00 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 2boa h GLU 1101Cb 0.57 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 28.99 2boa h GLU 1101CO 0.03 0.49 -1.28 1.63 -1.18 0.00 0.00 179.01 178.70 2boa n LYS 1102N -4.51 0.37 -4.24 1.92 4.76 -0.97 -4.91 118.16 110.58 2boa n LYS 1102Ca 0.13 -0.05 -0.18 0.00 -2.87 0.00 0.00 58.31 55.34 2boa n LYS 1102Cb 0.32 -1.14 -0.11 0.00 -1.84 0.00 0.00 35.03 32.25 2boa n LYS 1102CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 2boa s MET 1103N -2.40 1.02 -0.03 1.97 -1.94 0.13 -4.28 119.30 113.77 2boa s MET 1103Ca -0.02 -1.22 -0.08 0.00 -1.71 0.00 0.00 55.69 52.65 2boa s MET 1103Cb 0.04 -0.92 -0.05 0.00 2.01 0.00 0.00 34.83 35.91 2boa s MET 1103CO 0.25 0.18 0.26 -0.51 -0.01 0.00 0.00 175.02 175.19 2boa s ASP 1104N -2.40 6.53 -0.07 3.03 1.01 -0.45 -4.26 116.67 120.06 2boa s ASP 1104Ca 0.08 0.61 0.04 0.00 0.71 0.00 0.00 52.55 54.00 2boa s ASP 1104Cb -0.05 -2.11 -0.02 0.00 1.01 0.00 0.00 42.92 41.75 2boa s ASP 1104CO 0.03 0.31 -0.19 -0.63 0.21 0.00 0.00 175.17 174.90 2boa s ILE 1105N -1.19 2.60 -0.14 0.77 1.01 -0.54 -0.81 121.20 122.90 2boa s ILE 1105Ca 0.24 -0.87 -0.01 0.00 0.00 0.00 0.00 60.65 60.01 2boa s ILE 1105Cb -0.13 -2.00 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 2boa s ILE 1105CO 0.12 0.57 -0.12 -0.36 0.00 0.00 0.00 174.94 175.15 2boa s PHE 1106N -0.27 2.83 -0.15 3.97 0.08 0.44 0.56 117.98 125.43 2boa s PHE 1106Ca 0.01 -0.68 0.01 0.00 0.12 0.00 0.00 56.93 56.38 2boa s PHE 1106Cb -0.13 -1.87 0.02 0.00 -0.57 0.00 0.00 43.02 40.47 2boa s PHE 1106CO 0.03 -0.25 -0.15 -1.17 -0.10 0.00 0.00 175.22 173.58 2boa s LEU 1107N 0.47 1.75 -0.75 -0.37 2.96 0.38 0.87 118.68 124.00 2boa s LEU 1107Ca -0.09 -0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 53.24 2boa s LEU 1107Cb -0.16 -1.22 0.19 0.00 0.50 0.00 0.00 46.19 45.51 2boa s LEU 1107CO 0.04 -0.04 0.62 -0.22 -1.32 0.00 0.00 176.35 175.43 2boa s LEU 1108N 1.42 5.89 0.28 -0.68 2.96 0.17 -1.08 118.68 127.63 2boa s LEU 1108Ca 0.04 -2.91 0.00 0.00 -0.22 0.00 0.00 54.13 51.05 2boa s LEU 1108Cb -0.13 -2.01 0.54 0.00 0.50 0.00 0.00 46.19 45.09 2boa s LEU 1108CO -0.10 -0.42 1.82 -0.65 -1.32 0.00 0.00 176.35 175.67 2boa h PRO 1109N 7.20 0.87 -2.90 0.98 0.11 -1.81 -0.06 132.00 136.37 2boa h PRO 1109Ca 0.06 -0.05 -0.61 0.00 0.11 0.00 0.00 66.00 65.50 2boa h PRO 1109Cb 0.97 -0.20 -0.41 0.00 0.11 0.00 0.00 31.00 31.48 2boa h PRO 1109CO 0.75 0.58 -0.69 0.08 -0.21 0.00 0.00 178.00 178.50 2boa s VAL 1110N -5.96 2.10 0.44 3.15 1.01 -1.25 -3.82 120.40 116.07 2boa s VAL 1110Ca -0.12 -3.67 0.39 0.00 0.00 0.00 0.00 61.98 58.58 2boa s VAL 1110Cb 0.22 -2.40 0.39 0.00 0.00 0.00 0.00 36.38 34.60 2boa s VAL 1110CO 0.80 -1.05 2.20 0.00 0.00 0.00 0.00 175.10 177.05 2boa h ALA 1111N 5.62 1.00 -2.06 5.51 0.00 -0.73 -3.34 119.26 125.26 2boa h ALA 1111Ca 0.15 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.49 2boa h ALA 1111Cb 0.81 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.20 2boa h ALA 1111CO 0.61 0.00 -0.95 -1.71 0.00 0.00 0.00 179.25 177.20 2boa n ASN 1112N -2.89 1.32 0.01 0.00 5.15 -0.82 -4.80 115.26 113.23 2boa n ASN 1112Ca -0.02 -2.94 -0.01 0.00 -0.60 0.00 0.00 54.58 51.01 2boa n ASN 1112Cb 0.07 -0.65 0.29 0.00 -0.53 0.00 0.00 39.78 38.96 2boa n ASN 1112CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 2boa h PRO 1113N 4.02 0.51 -0.15 1.20 0.11 -1.87 -1.86 132.00 133.97 2boa h PRO 1113Ca 0.11 -0.12 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 2boa h PRO 1113Cb 0.81 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.85 2boa h PRO 1113CO 0.58 0.57 0.01 -0.44 -0.21 0.00 0.00 178.00 178.51 2boa h ASP 1114N 0.48 0.25 -0.85 -2.05 3.32 -1.95 -2.42 116.42 113.21 2boa h ASP 1114Ca 0.10 -0.30 -0.03 0.00 0.02 0.00 0.00 57.03 56.82 2boa h ASP 1114Cb 0.38 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.83 2boa h ASP 1114CO 0.02 0.48 0.41 1.23 -1.72 0.00 0.00 179.24 179.66 2boa h GLY 1115N 0.01 1.31 0.56 2.75 0.00 -1.75 0.55 103.07 106.49 2boa h GLY 1115Ca 0.04 -0.65 -0.02 0.00 0.00 0.00 0.00 47.33 46.70 2boa h GLY 1115CO 0.01 0.62 -0.40 -1.82 0.00 0.00 0.00 176.54 174.94 2boa h TYR 1116N 1.20 -1.08 -0.61 5.60 3.20 -1.25 1.05 116.97 125.08 2boa h TYR 1116Ca 0.29 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.28 2boa h TYR 1116Cb 0.12 0.40 -0.12 0.00 1.54 0.00 0.00 36.73 38.67 2boa h TYR 1116CO 0.01 -0.57 -0.18 0.28 -1.64 0.00 0.00 178.16 176.07 2boa h VAL 1117N -0.91 0.35 -0.65 1.81 2.07 -1.42 -0.69 116.25 116.80 2boa h VAL 1117Ca -0.07 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.56 2boa h VAL 1117Cb 0.75 0.35 -0.09 0.00 -1.52 0.00 0.00 31.29 30.78 2boa h VAL 1117CO 0.04 0.00 0.20 0.22 0.02 0.00 0.00 177.57 178.05 2boa h TYR 1118N -0.02 0.34 -0.16 1.57 3.20 -0.39 0.11 116.97 121.61 2boa h TYR 1118Ca 0.29 0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.24 2boa h TYR 1118Cb 0.47 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 2boa h TYR 1118CO -0.52 0.02 0.18 1.79 -1.64 0.00 0.00 178.16 177.99 2boa h THR 1119N 0.35 0.48 0.00 1.81 1.35 0.27 0.14 112.91 117.30 2boa h THR 1119Ca 0.35 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.21 2boa h THR 1119Cb 0.50 0.86 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 2boa h THR 1119CO -0.38 0.00 -1.15 0.00 -0.25 0.00 0.00 175.52 173.73 2boa n GLN 1120N -3.81 0.19 0.00 4.72 6.02 0.25 -3.07 117.38 121.68 2boa n GLN 1120Ca 0.01 -0.04 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 2boa n GLN 1120Cb 0.29 -1.52 0.00 0.00 1.02 0.00 0.00 30.24 30.03 2boa n GLN 1120CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2boa n THR 1121N -1.74 0.00 0.00 5.09 -2.24 -0.45 -4.97 114.28 109.96 2boa n THR 1121Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2boa n THR 1121Cb 0.40 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.85 2boa n THR 1121CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2boa n GLN 1122N -1.56 0.00 -3.42 -0.78 1.13 0.41 -4.69 117.38 108.47 2boa n GLN 1122Ca 0.00 0.00 -0.18 0.00 -1.94 0.00 0.00 57.00 54.88 2boa n GLN 1122Cb 0.09 -0.24 -0.10 0.00 0.11 0.00 0.00 30.24 30.09 2boa n GLN 1122CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2boa s ASN 1123N -4.72 1.78 0.60 1.08 3.84 -0.74 0.41 114.94 117.19 2boa s ASN 1123Ca 0.00 -0.74 0.30 0.00 0.21 0.00 0.00 52.86 52.62 2boa s ASN 1123Cb 0.00 0.44 1.72 0.00 -0.55 0.00 0.00 41.25 42.86 2boa s ASN 1123CO 0.00 -0.39 2.12 -0.09 -2.79 0.00 0.00 177.10 175.95 2boa h ARG 1124N 8.28 0.00 -0.58 0.43 9.65 -1.77 -2.59 114.38 127.80 2boa h ARG 1124Ca -0.14 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.74 2boa h ARG 1124Cb 1.08 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.66 2boa h ARG 1124CO 0.34 0.00 0.00 1.28 2.80 0.00 0.00 179.97 184.39 2boa n LEU 1125N -3.70 4.84 -4.76 3.80 4.32 -1.26 -4.54 117.00 115.70 2boa n LEU 1125Ca 0.01 -2.61 -0.40 0.00 -0.02 0.00 0.00 56.01 52.99 2boa n LEU 1125Cb 0.30 -0.59 -0.03 0.00 -1.62 0.00 0.00 43.42 41.48 2boa n LEU 1125CO 0.26 0.75 0.84 0.86 -1.22 0.00 0.00 177.39 178.88 2boa s TRP 1126N -2.14 3.37 0.00 -1.77 -0.11 -0.98 -4.83 118.94 112.48 2boa s TRP 1126Ca 0.50 1.61 0.00 0.00 1.22 0.00 0.00 56.10 59.43 2boa s TRP 1126Cb 0.34 -3.38 0.00 0.00 -1.50 0.00 0.00 33.47 28.93 2boa s TRP 1126CO 0.20 -0.97 0.00 2.89 -4.62 0.00 0.00 176.95 174.46 2boa n ARG 1127N 0.87 1.97 -1.59 5.86 1.85 -1.26 -1.04 116.66 123.32 2boa n ARG 1127Ca 0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 57.85 56.65 2boa n ARG 1127Cb 0.45 -0.93 0.13 0.00 -1.05 0.00 0.00 32.46 31.06 2boa n ARG 1127CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2boa n LYS 1128N -1.50 -0.62 -0.81 2.89 5.02 -1.26 -2.53 118.16 119.34 2boa n LYS 1128Ca 0.00 -1.65 -0.24 0.00 -2.02 0.00 0.00 58.31 54.40 2boa n LYS 1128Cb 0.19 -0.83 0.21 0.00 -0.02 0.00 0.00 35.03 34.57 2boa n LYS 1128CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2boa n THR 1129N -3.06 0.00 -1.25 -0.18 -2.24 -0.37 -4.50 114.28 102.68 2boa n THR 1129Ca 0.12 -0.37 0.06 0.00 -2.27 0.00 0.00 64.05 61.59 2boa n THR 1129Cb 0.42 -1.17 0.19 0.00 -2.10 0.00 0.00 70.33 67.67 2boa n THR 1129CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2boa n ARG 1130N -4.26 1.82 -2.30 -0.78 5.12 -1.26 -4.06 116.66 110.94 2boa n ARG 1130Ca 0.12 -2.92 -0.37 0.00 -1.93 0.00 0.00 57.85 52.75 2boa n ARG 1130Cb 0.48 -1.67 -0.01 0.00 -1.16 0.00 0.00 32.46 30.10 2boa n ARG 1130CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2boa s SER 1131N -2.69 6.30 0.07 0.55 1.04 -1.26 -4.64 113.70 113.08 2boa s SER 1131Ca 0.38 2.28 -0.08 0.00 0.48 0.00 0.00 55.95 59.01 2boa s SER 1131Cb 0.34 -2.60 -0.05 0.00 0.10 0.00 0.00 66.02 63.80 2boa s SER 1131CO 0.01 -0.83 0.36 -0.13 0.98 0.00 0.00 173.24 173.64 2boa s ARG 1132N -2.61 3.69 -0.36 4.02 3.00 -1.26 0.59 118.95 126.01 2boa s ARG 1132Ca 0.62 0.06 -0.03 0.00 0.00 0.00 0.00 55.73 56.38 2boa s ARG 1132Cb -0.28 -2.99 0.08 0.00 0.00 0.00 0.00 34.95 31.76 2boa s ARG 1132CO 0.34 0.56 0.12 -0.80 0.00 0.00 0.00 175.30 175.53 2boa s ASN 1133N -1.88 5.12 0.00 0.23 0.01 -1.25 -4.93 114.94 112.24 2boa s ASN 1133Ca 0.33 -1.70 0.00 0.00 -0.71 0.00 0.00 52.86 50.78 2boa s ASN 1133Cb -0.13 -1.79 0.00 0.00 0.41 0.00 0.00 41.25 39.74 2boa s ASN 1133CO 0.19 -0.42 0.49 -2.65 -1.51 0.00 0.00 177.10 173.20 2boa n PRO 1134N 4.61 0.00 -0.05 -0.60 -0.01 -1.26 -0.55 135.00 137.15 2boa n PRO 1134Ca -0.07 0.49 0.01 0.00 -0.01 0.00 0.00 63.50 63.93 2boa n PRO 1134Cb 0.42 -0.80 0.03 0.00 -0.01 0.00 0.00 33.50 33.14 2boa n PRO 1134CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 2boa n GLY 1135N -0.92 0.09 3.21 -1.23 0.00 -1.26 -4.86 105.19 100.21 2boa n GLY 1135Ca 0.00 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 2boa n GLY 1135CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2boa s SER 1136N -0.68 2.19 0.49 1.61 0.15 0.29 -5.00 113.70 112.75 2boa s SER 1136Ca 0.04 -0.47 0.28 0.00 0.70 0.00 0.00 55.95 56.51 2boa s SER 1136Cb 0.03 -0.18 0.88 0.00 -1.71 0.00 0.00 66.02 65.03 2boa s SER 1136CO 0.02 0.14 1.81 0.77 1.20 0.00 0.00 173.24 177.18 2boa h SER 1137N 5.04 0.00 -4.19 5.45 4.64 -1.89 -3.41 113.55 119.19 2boa h SER 1137Ca -0.40 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.42 2boa h SER 1137Cb 1.16 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.32 2boa h SER 1137CO 0.45 0.02 0.38 0.00 -0.87 0.00 0.00 176.83 176.81 2boa s ILE 1139N -2.42 1.85 0.00 0.00 -1.09 -1.26 -3.81 121.20 114.46 2boa s ILE 1139Ca 0.64 -0.99 0.00 0.00 -2.23 0.00 0.00 60.65 58.07 2boa s ILE 1139Cb -0.16 -1.55 0.00 0.00 -1.58 0.00 0.00 42.46 39.17 2boa s ILE 1139CO 0.37 0.52 0.00 0.61 -1.23 0.00 0.00 174.94 175.21 2boa n GLY 1140N 2.66 -0.82 3.35 6.18 0.00 0.20 -4.90 105.19 111.86 2boa n GLY 1140Ca -0.16 -1.57 -0.21 0.00 0.00 0.00 0.00 46.02 44.08 2boa n GLY 1140CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2boa s ALA 1141N -3.09 2.08 -0.35 4.61 0.00 -1.26 -4.85 121.76 118.90 2boa s ALA 1141Ca 0.00 -1.57 -0.29 0.00 0.00 0.00 0.00 51.96 50.10 2boa s ALA 1141Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 22.96 2boa s ALA 1141CO 0.00 0.19 1.40 0.34 0.00 0.00 0.00 175.76 177.70 2boa s ASP 1142N -2.92 6.45 0.31 0.00 -1.08 0.55 -1.24 116.67 118.74 2boa s ASP 1142Ca 0.19 1.07 0.00 0.00 -0.52 0.00 0.00 52.55 53.29 2boa s ASP 1142Cb -0.04 -2.54 0.52 0.00 -1.46 0.00 0.00 42.92 39.40 2boa s ASP 1142CO 0.07 -1.29 1.95 -0.65 0.52 0.00 0.00 175.17 175.77 2boa h PRO 1143N 10.24 1.00 -0.88 4.34 0.11 -1.86 -1.80 132.00 143.14 2boa h PRO 1143Ca -0.28 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2boa h PRO 1143Cb 1.11 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2boa h PRO 1143CO 1.06 0.66 0.00 -1.71 -0.21 0.00 0.00 178.00 177.80 2boa n ASN 1144N -4.45 1.95 0.00 -2.05 5.15 -1.26 -2.22 115.26 112.38 2boa n ASN 1144Ca 0.11 -2.19 0.00 0.00 -0.60 0.00 0.00 54.58 51.90 2boa n ASN 1144Cb 0.11 -0.52 0.00 0.00 -0.53 0.00 0.00 39.78 38.84 2boa n ASN 1144CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2boa n ARG 1145N 0.12 -0.45 0.00 1.20 3.00 -0.69 -3.46 116.66 116.38 2boa n ARG 1145Ca 0.06 -0.35 0.11 0.00 -0.01 0.00 0.00 57.85 57.66 2boa n ARG 1145Cb 0.44 -0.85 0.08 0.00 0.00 0.00 0.00 32.46 32.13 2boa n ARG 1145CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2boa n ASN 1146N -0.04 0.96 -4.80 0.55 4.05 -0.94 -4.42 115.26 110.62 2boa n ASN 1146Ca 0.00 -0.79 -0.31 0.00 0.45 0.00 0.00 54.58 53.92 2boa n ASN 1146Cb 0.06 0.58 0.06 0.00 1.23 0.00 0.00 39.78 41.71 2boa n ASN 1146CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2boa s TRP 1147N -2.88 2.95 -1.38 1.20 0.52 -0.15 0.12 118.94 119.31 2boa s TRP 1147Ca 0.12 1.47 -0.06 0.00 0.02 0.00 0.00 56.10 57.65 2boa s TRP 1147Cb 0.17 -2.94 0.08 0.00 -1.15 0.00 0.00 33.47 29.63 2boa s TRP 1147CO 0.74 -1.38 2.50 -1.71 0.02 0.00 0.00 176.95 177.12 2boa n ASN 1148N -3.11 8.21 -3.59 2.95 5.15 -1.26 -4.36 115.26 119.25 2boa n ASN 1148Ca 0.08 -3.03 -0.29 0.00 -0.60 0.00 0.00 54.58 50.75 2boa n ASN 1148Cb 0.53 -1.40 -0.15 0.00 -0.53 0.00 0.00 39.78 38.23 2boa n ASN 1148CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2boa s ALA 1149N -0.49 0.76 -1.29 5.20 0.00 -1.26 -4.82 121.76 119.86 2boa s ALA 1149Ca 0.57 -1.06 -0.16 0.00 0.00 0.00 0.00 51.96 51.32 2boa s ALA 1149Cb 0.18 -1.37 0.01 0.00 0.00 0.00 0.00 23.12 21.94 2boa s ALA 1149CO -0.09 -1.56 0.55 0.45 0.00 0.00 0.00 175.76 175.10 2boa n SER 1150N 5.18 -2.69 -4.75 0.00 2.88 -1.26 -0.98 113.62 112.00 2boa n SER 1150Ca -0.06 -1.12 -0.42 0.00 -1.33 0.00 0.00 58.87 55.94 2boa n SER 1150Cb 0.43 -2.60 -0.02 0.00 -0.75 0.00 0.00 64.21 61.27 2boa n SER 1150CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2boa s PHE 1151N -3.75 2.74 -1.26 0.66 5.36 -1.26 -2.79 117.98 117.68 2boa s PHE 1151Ca 0.28 0.71 -0.02 0.00 -0.96 0.00 0.00 56.93 56.93 2boa s PHE 1151Cb -0.12 -4.10 0.00 0.00 -0.34 0.00 0.00 43.02 38.46 2boa s PHE 1151CO 0.92 -3.76 0.32 0.00 -1.46 0.00 0.00 175.22 171.24 2boa n ALA 1152N 2.37 -0.66 -2.04 11.12 0.00 -1.26 -5.01 120.51 125.03 2boa n ALA 1152Ca 0.09 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.73 2boa n ALA 1152Cb 0.37 -2.71 0.00 0.00 0.00 0.00 0.00 19.45 17.11 2boa n ALA 1152CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2boa n GLY 1153N -1.24 1.29 3.77 0.00 0.00 -1.12 -5.02 105.19 102.86 2boa n GLY 1153Ca -0.12 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.65 2boa n GLY 1153CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2boa n LYS 1154N 0.00 2.66 -1.05 1.61 5.02 -1.26 -3.84 118.16 121.30 2boa n LYS 1154Ca 0.00 0.93 -0.02 0.00 -2.02 0.00 0.00 58.31 57.21 2boa n LYS 1154Cb 0.00 -2.66 -0.01 0.00 -0.02 0.00 0.00 35.03 32.34 2boa n LYS 1154CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2boa n GLY 1155N 0.62 0.53 3.13 0.72 0.00 -1.21 -0.23 105.19 108.75 2boa n GLY 1155Ca 0.02 -0.68 -0.11 0.00 0.00 0.00 0.00 46.02 45.24 2boa n GLY 1155CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2boa s ALA 1156N -2.03 0.81 0.02 4.61 0.00 -1.25 -4.67 121.76 119.25 2boa s ALA 1156Ca 0.00 -1.12 0.03 0.00 0.00 0.00 0.00 51.96 50.87 2boa s ALA 1156Cb 0.00 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 2boa s ALA 1156CO 0.00 -0.16 -0.06 0.45 0.00 0.00 0.00 175.76 175.99 2boa s SER 1157N -2.49 4.68 0.00 0.00 0.15 -0.91 -4.92 113.70 110.21 2boa s SER 1157Ca 0.03 -0.15 0.29 0.00 0.70 0.00 0.00 55.95 56.82 2boa s SER 1157Cb -0.00 -1.09 1.19 0.00 -1.71 0.00 0.00 66.02 64.41 2boa s SER 1157CO -0.03 0.27 1.84 -0.90 1.20 0.00 0.00 173.24 175.61 2boa n ASP 1158N 1.41 0.51 -4.58 5.45 5.75 -1.26 -1.87 116.55 121.96 2boa n ASP 1158Ca -0.15 -0.59 -0.42 0.00 -0.01 0.00 0.00 54.79 53.62 2boa n ASP 1158Cb 0.52 -0.06 -0.06 0.00 -1.03 0.00 0.00 41.12 40.50 2boa n ASP 1158CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 2boa s ASN 1159N -2.48 6.50 0.53 -1.12 2.47 -1.26 -4.95 114.94 114.64 2boa s ASN 1159Ca 0.28 0.27 0.34 0.00 0.42 0.00 0.00 52.86 54.17 2boa s ASN 1159Cb 0.20 -2.37 1.50 0.00 -1.45 0.00 0.00 41.25 39.13 2boa s ASN 1159CO 0.48 -0.69 1.83 -0.65 -3.72 0.00 0.00 177.10 174.35 2boa h PRO 1160N 8.48 0.03 0.00 0.43 0.11 -1.94 0.10 132.00 139.22 2boa h PRO 1160Ca -0.25 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2boa h PRO 1160Cb 1.10 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2boa h PRO 1160CO 0.89 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.70 2boa s SER 1162N -3.25 6.37 0.30 0.00 0.15 0.02 -4.93 113.70 112.36 2boa s SER 1162Ca 0.12 2.02 0.25 0.00 0.70 0.00 0.00 55.95 59.04 2boa s SER 1162Cb 0.16 -2.57 1.00 0.00 -1.71 0.00 0.00 66.02 62.90 2boa s SER 1162CO 0.48 -0.76 1.76 -0.33 1.20 0.00 0.00 173.24 175.59 2boa h GLU 1163N 1.82 0.00 -0.09 5.44 4.39 -1.89 -3.03 114.58 121.21 2boa h GLU 1163Ca -0.49 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.18 2boa h GLU 1163Cb 1.23 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.86 2boa h GLU 1163CO 0.60 0.00 -0.17 1.33 -1.16 0.00 0.00 179.01 179.61 2boa n VAL 1164N -2.38 2.16 -1.66 3.13 0.24 -1.26 -4.53 118.33 114.03 2boa n VAL 1164Ca 0.02 -2.60 -0.47 0.00 -2.04 0.00 0.00 64.34 59.25 2boa n VAL 1164Cb 0.27 -0.26 -0.05 0.00 -1.47 0.00 0.00 33.84 32.34 2boa n VAL 1164CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2boa n TYR 1165N -1.16 2.14 0.52 6.34 9.36 -1.15 -2.15 117.16 131.07 2boa n TYR 1165Ca 0.21 0.32 0.13 0.00 3.32 0.00 0.00 57.90 61.88 2boa n TYR 1165Cb 0.76 -2.51 0.33 0.00 -0.63 0.00 0.00 39.34 37.29 2boa n TYR 1165CO 0.00 0.00 0.00 1.12 0.22 0.00 0.00 176.86 178.20 2boa h HIS 1166N 5.87 0.00 0.00 2.98 2.07 -1.65 0.16 115.15 124.57 2boa h HIS 1166Ca -0.46 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.06 2boa h HIS 1166Cb 1.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.25 2boa h HIS 1166CO 0.64 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.91 2boa n GLY 1167N 1.26 0.88 0.23 6.13 0.00 -1.26 -4.15 105.19 108.29 2boa n GLY 1167Ca 0.05 -1.96 0.12 0.00 0.00 0.00 0.00 46.02 44.23 2boa n GLY 1167CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2boa h PRO 1168N 0.00 0.00 -2.75 1.61 0.13 -1.96 -3.47 132.00 125.56 2boa h PRO 1168Ca 0.00 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.21 2boa h PRO 1168Cb 0.00 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.04 2boa h PRO 1168CO 0.00 0.13 0.32 -3.38 -0.23 0.00 0.00 178.00 174.84 2boa s HIS 1169N -3.53 -0.28 0.52 1.56 -3.43 -1.26 -5.10 115.29 103.77 2boa s HIS 1169Ca 0.02 -0.05 -0.22 0.00 -0.80 0.00 0.00 55.06 54.02 2boa s HIS 1169Cb 0.09 0.64 -0.06 0.00 -1.43 0.00 0.00 32.58 31.82 2boa s HIS 1169CO 0.62 -0.97 1.22 0.00 -2.00 0.00 0.00 174.74 173.62 2boa s ALA 1170N -3.63 2.83 -0.99 -1.38 0.00 -1.26 -2.36 121.76 114.96 2boa s ALA 1170Ca 0.08 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.09 2boa s ALA 1170Cb -0.03 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.64 2boa s ALA 1170CO -0.01 -0.96 0.00 0.09 0.00 0.00 0.00 175.76 174.88 2boa n ASN 1171N -0.91 -3.28 0.29 0.00 3.02 0.12 -4.86 115.26 109.64 2boa n ASN 1171Ca 0.10 0.25 0.18 0.00 -0.03 0.00 0.00 54.58 55.07 2boa n ASN 1171Cb 0.48 -2.91 0.84 0.00 -0.61 0.00 0.00 39.78 37.57 2boa n ASN 1171CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2boa h SER 1172N 0.00 0.00 -3.70 6.41 4.64 -1.69 -3.38 113.55 115.83 2boa h SER 1172Ca -0.24 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.45 2boa h SER 1172Cb 1.02 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.96 2boa h SER 1172CO 0.31 0.04 -0.21 -1.61 -0.87 0.00 0.00 176.83 174.48 2boa s GLU 1173N -3.90 3.94 0.59 4.77 0.41 -1.26 -4.96 118.70 118.29 2boa s GLU 1173Ca -0.01 -0.01 0.36 0.00 -0.41 0.00 0.00 54.97 54.90 2boa s GLU 1173Cb 0.11 -3.68 1.87 0.00 -1.78 0.00 0.00 34.13 30.65 2boa s GLU 1173CO 0.52 -0.34 2.20 -0.39 -0.49 0.00 0.00 175.26 176.76 2boa h VAL 1174N 5.42 0.23 -0.64 2.63 -1.51 -1.85 0.40 116.25 120.93 2boa h VAL 1174Ca -0.31 -0.26 -0.04 0.00 -1.23 0.00 0.00 66.70 64.86 2boa h VAL 1174Cb 1.16 1.20 -0.03 0.00 -2.13 0.00 0.00 31.29 31.49 2boa h VAL 1174CO 0.66 0.03 0.24 -0.33 -1.23 0.00 0.00 177.57 176.95 2boa h GLU 1175N 0.00 0.96 0.09 5.19 3.07 -1.91 0.25 114.58 122.24 2boa h GLU 1175Ca -0.00 -0.18 -0.13 0.00 -0.50 0.00 0.00 59.36 58.55 2boa h GLU 1175Cb 0.20 -0.15 0.01 0.00 -0.84 0.00 0.00 28.75 27.97 2boa h GLU 1175CO 0.00 0.82 -0.59 0.28 -1.40 0.00 0.00 179.01 178.13 2boa h VAL 1176N 0.90 1.58 -0.51 3.13 2.07 -0.64 -3.15 116.25 119.62 2boa h VAL 1176Ca 0.21 -2.47 0.09 0.00 0.82 0.00 0.00 66.70 65.35 2boa h VAL 1176Cb 0.23 3.23 -0.10 0.00 -1.52 0.00 0.00 31.29 33.13 2boa h VAL 1176CO -0.01 0.68 -0.40 0.50 0.02 0.00 0.00 177.57 178.35 2boa h LYS 1177N -0.58 -0.24 -0.86 1.57 1.63 -1.01 0.62 116.57 117.71 2boa h LYS 1177Ca -0.11 0.02 0.16 0.00 -0.85 0.00 0.00 60.65 59.87 2boa h LYS 1177Cb 1.44 0.05 -0.16 0.00 -0.60 0.00 0.00 32.23 32.96 2boa h LYS 1177CO 0.09 -0.16 -0.26 0.77 -3.45 0.00 0.00 179.45 176.45 2boa h SER 1178N -0.25 -0.95 -0.11 4.20 0.02 -1.01 0.31 113.55 115.77 2boa h SER 1178Ca 0.18 0.27 -0.05 0.00 -0.84 0.00 0.00 61.79 61.34 2boa h SER 1178Cb 0.57 0.58 -0.00 0.00 0.14 0.00 0.00 62.40 63.68 2boa h SER 1178CO -0.64 -0.29 -0.13 0.58 -1.14 0.00 0.00 176.83 175.21 2boa h VAL 1179N -0.02 1.37 -0.53 2.27 2.07 -1.22 -1.13 116.25 119.05 2boa h VAL 1179Ca 0.38 -1.32 0.10 0.00 0.82 0.00 0.00 66.70 66.68 2boa h VAL 1179Cb 0.62 2.00 -0.08 0.00 -1.52 0.00 0.00 31.29 32.31 2boa h VAL 1179CO -0.89 0.38 0.08 0.58 0.02 0.00 0.00 177.57 177.74 2boa h VAL 1180N -0.14 0.66 -0.39 2.57 2.07 -0.19 -1.52 116.25 119.31 2boa h VAL 1180Ca 0.01 -0.07 -0.13 0.00 0.82 0.00 0.00 66.70 67.33 2boa h VAL 1180Cb 0.67 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2boa h VAL 1180CO 0.03 0.04 -0.29 0.44 0.02 0.00 0.00 177.57 177.81 2boa h ASP 1181N 0.21 0.88 -0.40 0.57 3.32 -0.34 -1.93 116.42 118.73 2boa h ASP 1181Ca 0.27 -0.36 -0.04 0.00 0.02 0.00 0.00 57.03 56.93 2boa h ASP 1181Cb 0.39 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2boa h ASP 1181CO -0.37 1.11 0.11 0.15 -1.72 0.00 0.00 179.24 178.51 2boa h PHE 1182N 0.72 0.65 -0.20 4.55 3.57 -0.77 -2.37 116.94 123.09 2boa h PHE 1182Ca 0.08 -0.07 -0.09 0.00 3.53 0.00 0.00 57.97 61.42 2boa h PHE 1182Cb 0.84 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.39 2boa h PHE 1182CO 0.05 0.62 -0.21 0.82 -2.23 0.00 0.00 178.31 177.36 2boa h ILE 1183N 0.50 1.33 -0.25 1.41 2.04 -1.20 -2.20 117.51 119.13 2boa h ILE 1183Ca 0.13 -1.38 -0.09 0.00 1.00 0.00 0.00 64.86 64.52 2boa h ILE 1183Cb 0.29 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 2boa h ILE 1183CO -0.00 0.42 -0.23 1.56 0.00 0.00 0.00 178.15 179.90 2boa h GLN 1184N 0.16 0.46 0.50 2.37 4.20 -1.41 0.29 115.11 121.69 2boa h GLN 1184Ca 0.03 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 2boa h GLN 1184Cb 0.76 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.51 2boa h GLN 1184CO 0.05 0.66 -0.24 -0.22 -0.67 0.00 0.00 178.83 178.41 2boa h LYS 1185N 0.41 -0.65 -0.49 1.46 3.64 -1.33 -3.17 116.57 116.44 2boa h LYS 1185Ca 0.06 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.59 2boa h LYS 1185Cb 0.63 0.15 -0.10 0.00 -0.41 0.00 0.00 32.23 32.50 2boa h LYS 1185CO 0.04 -0.35 -0.18 1.25 -2.27 0.00 0.00 179.45 177.94 2boa h HIS 1186N -1.03 -0.42 0.00 1.91 2.76 -1.40 -3.46 115.15 113.51 2boa h HIS 1186Ca -0.07 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 2boa h HIS 1186Cb 0.60 0.26 0.00 0.00 1.55 0.00 0.00 27.41 29.82 2boa h HIS 1186CO 0.01 -0.27 0.00 0.41 -1.30 0.00 0.00 177.93 176.78 2boa n GLY 1187N -1.39 0.39 1.92 5.26 0.00 0.10 -4.82 105.19 106.65 2boa n GLY 1187Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 2boa n GLY 1187CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2boa n ASN 1188N -0.20 3.69 -4.69 1.61 5.15 -1.26 -5.04 115.26 114.52 2boa n ASN 1188Ca 0.00 -3.41 -0.42 0.00 -0.60 0.00 0.00 54.58 50.15 2boa n ASN 1188Cb 0.10 -0.39 -0.03 0.00 -0.53 0.00 0.00 39.78 38.93 2boa n ASN 1188CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2boa s PHE 1189N -3.43 3.53 -0.19 1.20 0.40 -1.26 -1.45 117.98 116.78 2boa s PHE 1189Ca 0.44 1.57 0.17 0.00 -0.60 0.00 0.00 56.93 58.51 2boa s PHE 1189Cb 0.39 -3.14 -0.24 0.00 0.51 0.00 0.00 43.02 40.53 2boa s PHE 1189CO 0.00 -0.18 0.07 1.63 0.70 0.00 0.00 175.22 177.45 2boa n LYS 1190N 4.78 0.80 -4.12 0.44 4.76 0.16 -4.55 118.16 120.44 2boa n LYS 1190Ca 0.07 -0.01 -0.13 0.00 -2.87 0.00 0.00 58.31 55.38 2boa n LYS 1190Cb 0.49 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 32.07 2boa n LYS 1190CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2boa s GLY 1191N -5.39 0.66 -0.19 0.72 0.00 -0.83 -3.34 107.32 98.94 2boa s GLY 1191Ca -0.10 -1.03 -0.05 0.00 0.00 0.00 0.00 44.72 43.55 2boa s GLY 1191CO 0.80 -1.10 0.35 -0.12 0.00 0.00 0.00 173.10 173.03 2boa s PHE 1192N -2.25 -0.66 -0.11 1.90 2.19 -0.89 0.01 117.98 118.16 2boa s PHE 1192Ca -0.00 1.06 -0.00 0.00 0.33 0.00 0.00 56.93 58.31 2boa s PHE 1192Cb -0.04 0.07 0.02 0.00 -1.31 0.00 0.00 43.02 41.76 2boa s PHE 1192CO -0.01 -0.53 -0.09 0.42 1.83 0.00 0.00 175.22 176.84 2boa s ILE 1193N 2.52 1.11 -0.19 3.12 1.01 0.00 -0.94 121.20 127.83 2boa s ILE 1193Ca 0.04 -0.35 -0.08 0.00 0.00 0.00 0.00 60.65 60.26 2boa s ILE 1193Cb -0.13 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.19 2boa s ILE 1193CO -0.13 0.38 0.09 -0.62 0.00 0.00 0.00 174.94 174.66 2boa s ASP 1194N 1.57 5.78 -0.24 3.58 2.15 0.71 -2.42 116.67 127.79 2boa s ASP 1194Ca 0.03 0.11 -0.10 0.00 0.43 0.00 0.00 52.55 53.01 2boa s ASP 1194Cb -0.13 -2.00 -0.05 0.00 -0.30 0.00 0.00 42.92 40.44 2boa s ASP 1194CO -0.07 0.16 0.15 -0.76 -0.17 0.00 0.00 175.17 174.47 2boa s LEU 1195N 0.48 3.99 0.00 -1.34 1.43 -0.42 0.44 118.68 123.26 2boa s LEU 1195Ca 0.05 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.20 2boa s LEU 1195Cb -0.12 -2.08 -0.00 0.00 0.03 0.00 0.00 46.19 44.02 2boa s LEU 1195CO 0.00 0.04 0.03 1.41 0.23 0.00 0.00 176.35 178.06 2boa n HIS 1196N 4.46 0.03 -3.55 0.29 8.25 0.16 -3.85 115.22 121.02 2boa n HIS 1196Ca -0.15 -0.51 -0.11 0.00 -0.26 0.00 0.00 57.72 56.69 2boa n HIS 1196Cb 0.52 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.60 2boa n HIS 1196CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2boa s SER 1197N -1.49 -0.46 0.47 0.41 1.04 -1.26 -1.58 113.70 110.83 2boa s SER 1197Ca 0.04 -0.18 0.05 0.00 0.48 0.00 0.00 55.95 56.33 2boa s SER 1197Cb 0.00 0.62 -0.03 0.00 0.10 0.00 0.00 66.02 66.72 2boa s SER 1197CO 0.03 -1.05 0.12 -0.72 0.98 0.00 0.00 173.24 172.60 2boa s TYR 1198N -3.80 2.13 0.00 5.02 1.13 -1.26 -4.89 117.35 115.68 2boa s TYR 1198Ca 0.04 -0.79 0.00 0.00 -1.41 0.00 0.00 57.07 54.91 2boa s TYR 1198Cb -0.02 -1.79 0.00 0.00 -1.10 0.00 0.00 41.96 39.05 2boa s TYR 1198CO -0.08 0.13 0.00 0.43 -2.51 0.00 0.00 175.55 173.52 2boa n SER 1199N -1.30 0.00 -3.09 -0.18 7.64 0.89 -4.81 113.62 112.77 2boa n SER 1199Ca -0.09 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.73 2boa n SER 1199Cb 0.66 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.89 2boa n SER 1199CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2boa n GLN 1200N 0.00 -1.68 -4.51 1.43 6.02 -0.60 -4.72 117.38 113.33 2boa n GLN 1200Ca 0.00 1.20 -0.27 0.00 -0.01 0.00 0.00 57.00 57.92 2boa n GLN 1200Cb 0.00 -5.67 -0.13 0.00 1.02 0.00 0.00 30.24 25.45 2boa n GLN 1200CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2boa s LEU 1201N -4.54 2.25 -0.25 1.08 1.43 0.35 -2.42 118.68 116.57 2boa s LEU 1201Ca 0.19 -0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 52.64 2boa s LEU 1201Cb -0.03 -1.07 0.08 0.00 0.03 0.00 0.00 46.19 45.20 2boa s LEU 1201CO 0.72 0.15 0.03 -0.22 0.23 0.00 0.00 176.35 177.27 2boa s LEU 1202N -1.64 2.08 0.34 1.79 2.96 -0.51 -0.40 118.68 123.29 2boa s LEU 1202Ca 0.10 -1.25 0.07 0.00 -0.22 0.00 0.00 54.13 52.82 2boa s LEU 1202Cb -0.10 -0.89 -0.07 0.00 0.50 0.00 0.00 46.19 45.64 2boa s LEU 1202CO 0.04 -0.33 -0.04 -0.04 -1.32 0.00 0.00 176.35 174.66 2boa s MET 1203N 1.61 1.74 0.23 1.98 -1.94 -0.34 -2.59 119.30 119.99 2boa s MET 1203Ca 0.02 -1.92 -0.09 0.00 -1.71 0.00 0.00 55.69 51.99 2boa s MET 1203Cb -0.18 -1.41 -0.02 0.00 2.01 0.00 0.00 34.83 35.23 2boa s MET 1203CO -0.13 0.03 0.35 1.52 -0.01 0.00 0.00 175.02 176.77 2boa s TYR 1204N -2.84 0.64 0.59 -0.03 1.13 -1.10 -1.23 117.35 114.51 2boa s TYR 1204Ca 0.33 -0.95 -0.20 0.00 -1.41 0.00 0.00 57.07 54.84 2boa s TYR 1204Cb 0.05 -0.08 -0.03 0.00 -1.10 0.00 0.00 41.96 40.80 2boa s TYR 1204CO 0.15 -0.86 1.25 -2.30 -2.51 0.00 0.00 175.55 171.28 2boa n PRO 1205N -0.34 1.30 -4.12 -3.49 -0.02 -1.26 -1.06 135.00 126.01 2boa n PRO 1205Ca -0.01 0.49 -0.31 0.00 -2.02 0.00 0.00 63.50 61.66 2boa n PRO 1205Cb 0.63 -2.47 -0.08 0.00 -0.02 0.00 0.00 33.50 31.57 2boa n PRO 1205CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2boa s TYR 1206N -1.37 3.08 -0.16 6.00 2.02 -1.26 -4.52 117.35 121.14 2boa s TYR 1206Ca 0.77 0.03 0.10 0.00 -0.37 0.00 0.00 57.07 57.60 2boa s TYR 1206Cb -0.41 -1.59 -0.17 0.00 -0.40 0.00 0.00 41.96 39.39 2boa s TYR 1206CO 0.45 0.49 -0.02 0.41 -1.57 0.00 0.00 175.55 175.32 2boa n GLY 1207N 0.68 -0.60 0.25 0.71 0.00 -1.26 -1.49 105.19 103.47 2boa n GLY 1207Ca -0.11 -0.21 0.14 0.00 0.00 0.00 0.00 46.02 45.84 2boa n GLY 1207CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2boa h TYR 1208N 0.00 0.00 -3.31 1.61 -0.00 -1.89 0.79 116.97 114.17 2boa h TYR 1208Ca -0.42 0.00 -0.09 0.00 -0.00 0.00 0.00 58.73 58.22 2boa h TYR 1208Cb 1.85 0.00 -0.17 0.00 -0.00 0.00 0.00 36.73 38.41 2boa h TYR 1208CO 0.01 0.05 -0.25 0.45 -0.00 0.00 0.00 178.16 178.42 2boa s SER 1209N -5.96 -0.12 0.00 0.10 0.15 -1.26 -4.50 113.70 102.10 2boa s SER 1209Ca 0.03 -0.19 0.16 0.00 0.70 0.00 0.00 55.95 56.65 2boa s SER 1209Cb 0.08 0.36 0.72 0.00 -1.71 0.00 0.00 66.02 65.46 2boa s SER 1209CO 0.61 -0.62 1.50 1.33 1.20 0.00 0.00 173.24 177.26 2boa n VAL 1210N 0.57 0.81 -1.72 4.45 0.24 -1.26 -4.68 118.33 116.73 2boa n VAL 1210Ca -0.19 0.20 -0.43 0.00 -2.04 0.00 0.00 64.34 61.89 2boa n VAL 1210Cb 0.59 -0.93 -0.02 0.00 -1.47 0.00 0.00 33.84 32.02 2boa n VAL 1210CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2boa n LYS 1211N -1.44 2.50 -2.87 7.34 2.85 -1.26 -4.94 118.16 120.33 2boa n LYS 1211Ca 0.05 0.89 -0.41 0.00 -1.05 0.00 0.00 58.31 57.79 2boa n LYS 1211Cb 0.17 -2.63 -0.04 0.00 -0.65 0.00 0.00 35.03 31.88 2boa n LYS 1211CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 2boa s LYS 1212N -0.49 4.52 0.22 -1.58 2.20 -1.26 -4.43 119.74 118.92 2boa s LYS 1212Ca 0.65 1.18 -0.30 0.00 -0.36 0.00 0.00 55.97 57.14 2boa s LYS 1212Cb -0.54 -3.43 -0.09 0.00 -1.51 0.00 0.00 37.83 32.26 2boa s LYS 1212CO 0.49 0.08 1.37 0.00 -0.36 0.00 0.00 175.35 176.93 2boa s ALA 1213N 0.63 3.58 0.45 3.13 0.00 -1.26 -4.92 121.76 123.37 2boa s ALA 1213Ca 0.44 1.20 0.29 0.00 0.00 0.00 0.00 51.96 53.89 2boa s ALA 1213Cb -0.20 -3.52 1.36 0.00 0.00 0.00 0.00 23.12 20.77 2boa s ALA 1213CO 0.24 -0.63 1.70 -1.00 0.00 0.00 0.00 175.76 176.08 2boa h PRO 1214N 5.32 0.16 -0.64 0.00 0.13 -1.96 -1.58 132.00 133.43 2boa h PRO 1214Ca -0.45 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2boa h PRO 1214Cb 1.22 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2boa h PRO 1214CO 0.78 0.11 0.00 -0.25 -0.23 0.00 0.00 178.00 178.41 2boa n ASP 1215N -4.52 4.46 -0.30 1.44 8.00 -1.26 -4.67 116.55 119.71 2boa n ASP 1215Ca 0.32 -2.53 0.10 0.00 0.71 0.00 0.00 54.79 53.39 2boa n ASP 1215Cb 1.26 -0.58 0.34 0.00 -0.02 0.00 0.00 41.12 42.11 2boa n ASP 1215CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2boa h ALA 1216N 3.84 1.74 0.05 2.24 0.00 -1.63 -2.11 119.26 123.39 2boa h ALA 1216Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2boa h ALA 1216Cb 1.46 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2boa h ALA 1216CO 0.28 0.02 -0.02 1.49 0.00 0.00 0.00 179.25 181.02 2boa h GLU 1217N 0.78 -0.06 -0.42 0.00 4.81 -1.85 -0.63 114.58 117.21 2boa h GLU 1217Ca 0.46 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.68 2boa h GLU 1217Cb 0.65 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 2boa h GLU 1217CO -0.23 0.20 0.18 1.49 -0.73 0.00 0.00 179.01 179.92 2boa h GLU 1218N -0.31 0.62 -0.07 1.92 4.81 -1.89 -2.46 114.58 117.20 2boa h GLU 1218Ca -0.01 -0.11 -0.07 0.00 -0.13 0.00 0.00 59.36 59.05 2boa h GLU 1218Cb 0.28 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 2boa h GLU 1218CO 0.01 0.56 -0.28 -0.07 -0.73 0.00 0.00 179.01 178.51 2boa h LEU 1219N 0.54 0.12 -0.44 1.64 3.38 -1.34 -1.50 115.31 117.71 2boa h LEU 1219Ca 0.14 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 2boa h LEU 1219Cb 0.17 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2boa h LEU 1219CO -0.01 0.41 -0.71 -0.78 0.09 0.00 0.00 178.44 177.43 2boa h ASP 1220N 0.12 0.00 0.04 -0.43 3.58 -1.02 -1.68 116.42 117.03 2boa h ASP 1220Ca 0.02 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 2boa h ASP 1220Cb 0.56 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.61 2boa h ASP 1220CO 0.04 0.71 -0.02 0.50 -2.88 0.00 0.00 179.24 177.59 2boa h LYS 1221N 0.00 -0.05 0.08 0.28 3.64 -0.96 -2.00 116.57 117.55 2boa h LYS 1221Ca -0.01 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2boa h LYS 1221Cb 1.34 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 33.13 2boa h LYS 1221CO 0.09 0.54 -0.27 0.28 -2.27 0.00 0.00 179.45 177.82 2boa h VAL 1222N -0.70 0.39 -0.50 2.00 2.07 -1.36 -1.46 116.25 116.69 2boa h VAL 1222Ca -0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 2boa h VAL 1222Cb 0.62 0.39 -0.07 0.00 -1.52 0.00 0.00 31.29 30.71 2boa h VAL 1222CO 0.01 0.00 0.11 0.00 0.02 0.00 0.00 177.57 177.71 2boa h ALA 1223N 0.28 0.57 -0.50 1.67 0.00 -1.40 -1.07 119.26 118.82 2boa h ALA 1223Ca 0.04 0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.11 2boa h ALA 1223Cb 0.51 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 2boa h ALA 1223CO -0.19 -0.30 0.21 -0.09 0.00 0.00 0.00 179.25 178.88 2boa h ARG 1224N 0.25 0.39 0.00 0.00 2.43 -1.07 0.61 114.38 116.99 2boa h ARG 1224Ca 0.25 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.29 2boa h ARG 1224Cb 0.33 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2boa h ARG 1224CO -0.32 0.26 -0.52 -0.07 -1.51 0.00 0.00 179.97 177.81 2boa h LEU 1225N 0.40 0.00 -0.35 3.80 4.07 -0.74 -1.74 115.31 120.75 2boa h LEU 1225Ca 0.24 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 58.02 2boa h LEU 1225Cb 0.22 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.96 2boa h LEU 1225CO -0.21 0.52 -0.52 0.00 -1.08 0.00 0.00 178.44 177.14 2boa h ALA 1226N 1.48 0.53 -0.23 1.53 0.00 -0.73 -0.05 119.26 121.79 2boa h ALA 1226Ca -0.01 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2boa h ALA 1226Cb 0.97 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2boa h ALA 1226CO 0.07 0.68 0.12 0.00 0.00 0.00 0.00 179.25 180.12 2boa h ALA 1227N 0.75 0.30 -0.53 0.00 0.00 -0.75 0.29 119.26 119.33 2boa h ALA 1227Ca 0.02 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.93 2boa h ALA 1227Cb 1.12 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 2boa h ALA 1227CO 0.11 -0.16 0.20 0.87 0.00 0.00 0.00 179.25 180.28 2boa h LYS 1228N 0.26 0.38 -0.35 0.00 1.57 -1.30 -0.25 116.57 116.88 2boa h LYS 1228Ca 0.08 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 2boa h LYS 1228Cb 0.08 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2boa h LYS 1228CO -0.01 0.25 -0.01 0.00 -0.57 0.00 0.00 179.45 179.11 2boa h ALA 1229N 1.35 0.48 -0.34 3.86 0.00 -0.80 -2.88 119.26 120.91 2boa h ALA 1229Ca 0.26 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.96 2boa h ALA 1229Cb 0.27 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2boa h ALA 1229CO -0.25 0.25 0.09 1.25 0.00 0.00 0.00 179.25 180.59 2boa h LEU 1230N 0.44 0.06 -2.42 0.00 6.46 -0.74 -2.54 115.31 116.56 2boa h LEU 1230Ca 0.10 0.05 0.02 0.00 -0.12 0.00 0.00 57.88 57.92 2boa h LEU 1230Cb 0.48 0.06 -0.00 0.00 -0.73 0.00 0.00 40.66 40.46 2boa h LEU 1230CO 0.02 0.07 0.08 0.00 -0.62 0.00 0.00 178.44 177.98 2boa h ALA 1231N 1.24 1.57 0.00 1.25 0.00 -0.91 -3.01 119.26 119.40 2boa h ALA 1231Ca 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2boa h ALA 1231Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2boa h ALA 1231CO -0.19 -0.11 0.00 0.66 0.00 0.00 0.00 179.25 179.61 2boa h SER 1232N 0.00 0.00 0.05 0.00 4.64 -1.24 0.24 113.55 117.24 2boa h SER 1232Ca 0.03 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2boa h SER 1232Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2boa h SER 1232CO -0.00 0.00 -0.02 0.58 -0.87 0.00 0.00 176.83 176.52 2boa h VAL 1233N 0.00 0.88 0.00 0.95 2.07 -1.69 -3.41 116.25 115.05 2boa h VAL 1233Ca 0.00 -1.53 0.00 0.00 0.82 0.00 0.00 66.70 65.99 2boa h VAL 1233Cb 0.50 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 2boa h VAL 1233CO 0.00 0.28 0.00 -1.20 0.02 0.00 0.00 177.57 176.67 2boa n SER 1234N -4.76 0.70 0.00 0.57 7.64 -1.25 -5.02 113.62 111.51 2boa n SER 1234Ca -0.06 -1.12 0.00 0.00 1.01 0.00 0.00 58.87 58.70 2boa n SER 1234Cb 0.25 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2boa n SER 1234CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2boa n GLY 1235N -0.06 0.52 3.72 0.23 0.00 0.85 -5.04 105.19 105.42 2boa n GLY 1235Ca 0.00 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 2boa n GLY 1235CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2boa s THR 1236N -2.00 4.45 -0.18 2.61 2.01 -1.24 -4.99 115.64 116.30 2boa s THR 1236Ca 0.00 1.90 -0.07 0.00 0.31 0.00 0.00 61.69 63.83 2boa s THR 1236Cb 0.00 -4.21 -0.04 0.00 0.01 0.00 0.00 72.50 68.26 2boa s THR 1236CO 0.00 0.22 0.04 -1.61 -0.69 0.00 0.00 174.62 172.59 2boa s GLU 1237N 0.46 3.90 -0.11 4.92 2.02 -1.26 -3.81 118.70 124.82 2boa s GLU 1237Ca 0.51 -0.38 0.00 0.00 0.02 0.00 0.00 54.97 55.12 2boa s GLU 1237Cb -0.24 -3.16 -0.02 0.00 0.10 0.00 0.00 34.13 30.81 2boa s GLU 1237CO 0.30 0.25 -0.11 0.71 0.02 0.00 0.00 175.26 176.43 2boa s TYR 1238N 0.42 2.83 0.33 1.61 1.51 -1.26 -4.88 117.35 117.91 2boa s TYR 1238Ca 0.02 -0.40 -0.27 0.00 -1.01 0.00 0.00 57.07 55.41 2boa s TYR 1238Cb -0.13 -1.80 -0.09 0.00 -0.11 0.00 0.00 41.96 39.83 2boa s TYR 1238CO 0.01 -0.03 1.02 -0.65 -1.11 0.00 0.00 175.55 174.80 2boa s GLN 1239N -0.03 4.48 -0.04 -0.62 -0.21 -1.02 -4.94 119.66 117.27 2boa s GLN 1239Ca -0.02 1.55 0.00 0.00 0.02 0.00 0.00 55.36 56.91 2boa s GLN 1239Cb -0.14 -2.87 0.02 0.00 1.00 0.00 0.00 33.01 31.02 2boa s GLN 1239CO 0.04 0.14 -0.02 0.08 -2.12 0.00 0.00 175.29 173.41 2boa s VAL 1240N -1.45 0.36 -0.72 1.09 1.01 -1.26 -1.42 120.40 118.00 2boa s VAL 1240Ca 0.50 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.49 2boa s VAL 1240Cb -0.24 -0.43 0.00 0.00 0.00 0.00 0.00 36.38 35.70 2boa s VAL 1240CO 0.31 0.20 0.00 0.61 0.00 0.00 0.00 175.10 176.22 2boa n GLY 1241N 4.27 -1.31 3.80 4.51 0.00 -1.07 -5.03 105.19 110.37 2boa n GLY 1241Ca -0.22 -0.97 -0.34 0.00 0.00 0.00 0.00 46.02 44.49 2boa n GLY 1241CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2boa s PRO 1242N -1.22 3.83 0.21 1.61 0.04 -1.26 -2.71 135.00 135.49 2boa s PRO 1242Ca 0.00 1.31 -0.09 0.00 0.04 0.00 0.00 61.00 62.26 2boa s PRO 1242Cb 0.00 -2.10 0.31 0.00 0.04 0.00 0.00 34.50 32.75 2boa s PRO 1242CO 0.00 -0.40 1.72 1.15 0.04 0.00 0.00 177.00 179.51 2boa h THR 1243N 1.51 0.68 -0.45 1.26 2.02 -1.17 -1.13 112.91 115.64 2boa h THR 1243Ca -0.49 -0.11 0.03 0.00 0.77 0.00 0.00 66.41 66.60 2boa h THR 1243Cb 1.21 0.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 2boa h THR 1243CO 0.59 0.06 0.24 0.00 0.37 0.00 0.00 175.52 176.79 2boa h THR 1245N 0.49 1.55 0.00 0.00 1.35 -1.82 -3.33 112.91 111.15 2boa h THR 1245Ca 0.19 -2.26 0.00 0.00 -0.55 0.00 0.00 66.41 63.78 2boa h THR 1245Cb 0.06 3.00 0.00 0.00 -1.73 0.00 0.00 68.15 69.47 2boa h THR 1245CO -0.11 0.63 0.00 0.41 -0.25 0.00 0.00 175.52 176.20 2boa n THR 1246N -4.32 0.00 0.00 6.82 -1.04 -0.44 -4.78 114.28 110.53 2boa n THR 1246Ca -0.11 0.94 0.00 0.00 -2.04 0.00 0.00 64.05 62.83 2boa n THR 1246Cb 0.66 -1.87 0.00 0.00 -1.82 0.00 0.00 70.33 67.30 2boa n THR 1246CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2boa n VAL 1247N -1.80 0.00 -3.61 12.58 0.31 -0.65 -4.93 118.33 120.24 2boa n VAL 1247Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 2boa n VAL 1247Cb 0.00 -0.14 -0.07 0.00 -0.91 0.00 0.00 33.84 32.72 2boa n VAL 1247CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 2boa s TYR 1248N 0.00 -0.60 -0.43 3.52 -0.85 -1.13 -4.41 117.35 113.46 2boa s TYR 1248Ca 0.00 1.35 -0.40 0.00 -0.52 0.00 0.00 57.07 57.50 2boa s TYR 1248Cb 0.00 0.35 -0.15 0.00 0.38 0.00 0.00 41.96 42.54 2boa s TYR 1248CO 0.00 -0.36 2.16 -2.30 -1.52 0.00 0.00 175.55 173.53 2boa n PRO 1249N 1.95 0.50 -3.72 -3.49 -0.02 -1.25 -4.72 135.00 124.25 2boa n PRO 1249Ca -0.14 0.14 -0.22 0.00 -2.02 0.00 0.00 63.50 61.26 2boa n PRO 1249Cb 0.56 -1.95 -0.18 0.00 -0.02 0.00 0.00 33.50 31.92 2boa n PRO 1249CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2boa s ALA 1250N 6.59 0.51 0.56 3.55 0.00 0.27 -3.33 121.76 129.91 2boa s ALA 1250Ca 1.15 -0.02 -0.08 0.00 0.00 0.00 0.00 51.96 53.01 2boa s ALA 1250Cb -1.20 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 21.17 2boa s ALA 1250CO 0.58 -0.51 0.92 -1.54 0.00 0.00 0.00 175.76 175.21 2boa s SER 1251N 2.06 6.19 -0.96 0.00 1.04 0.68 -2.96 113.70 119.76 2boa s SER 1251Ca 0.05 1.17 0.00 0.00 0.48 0.00 0.00 55.95 57.65 2boa s SER 1251Cb -0.12 -2.33 0.00 0.00 0.10 0.00 0.00 66.02 63.67 2boa s SER 1251CO -0.05 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.02 2boa n GLY 1252N -2.54 0.16 3.91 7.32 0.00 -0.16 -4.44 105.19 109.44 2boa n GLY 1252Ca 0.04 -0.45 -0.28 0.00 0.00 0.00 0.00 46.02 45.32 2boa n GLY 1252CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2boa s SER 1253N -2.58 6.42 0.13 1.61 1.04 -1.23 -0.98 113.70 118.11 2boa s SER 1253Ca 0.00 0.72 -0.18 0.00 0.48 0.00 0.00 55.95 56.97 2boa s SER 1253Cb 0.00 -2.15 -0.04 0.00 0.10 0.00 0.00 66.02 63.94 2boa s SER 1253CO 0.00 -0.24 1.78 0.77 0.98 0.00 0.00 173.24 176.52 2boa h SER 1254N 1.45 0.33 0.46 7.02 4.64 -1.91 -1.85 113.55 123.68 2boa h SER 1254Ca -0.48 -0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 60.69 2boa h SER 1254Cb 1.19 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 2boa h SER 1254CO 0.65 0.26 -0.55 0.16 -0.87 0.00 0.00 176.83 176.48 2boa h ILE 1255N 0.37 1.38 -0.37 0.95 3.07 -1.94 0.62 117.51 121.59 2boa h ILE 1255Ca 0.10 -1.87 -0.08 0.00 1.55 0.00 0.00 64.86 64.57 2boa h ILE 1255Cb -0.02 1.97 -0.01 0.00 -0.27 0.00 0.00 36.82 38.49 2boa h ILE 1255CO -0.02 0.54 -0.07 0.44 -1.05 0.00 0.00 178.15 177.99 2boa h ASP 1256N 0.08 0.71 -0.84 2.16 5.19 -1.93 -1.12 116.42 120.66 2boa h ASP 1256Ca -0.00 -0.35 0.03 0.00 -0.62 0.00 0.00 57.03 56.09 2boa h ASP 1256Cb 0.99 -0.19 -0.05 0.00 0.18 0.00 0.00 39.33 40.26 2boa h ASP 1256CO 0.08 0.90 0.54 -0.25 -3.12 0.00 0.00 179.24 177.39 2boa h TRP 1257N 0.51 1.02 0.18 4.55 7.01 -0.95 -2.29 115.95 125.96 2boa h TRP 1257Ca 0.10 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.11 2boa h TRP 1257Cb 0.58 -0.34 0.00 0.00 -2.10 0.00 0.00 29.16 27.30 2boa h TRP 1257CO 0.05 0.58 -0.08 0.00 -2.79 0.00 0.00 178.44 176.20 2boa h ALA 1258N 1.35 -0.24 -0.69 2.65 0.00 -0.67 -1.51 119.26 120.17 2boa h ALA 1258Ca 0.34 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 55.12 2boa h ALA 1258Cb 0.01 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 2boa h ALA 1258CO -0.12 -0.48 0.42 -0.92 0.00 0.00 0.00 179.25 178.15 2boa h TYR 1259N -0.55 0.77 0.00 0.00 3.20 -1.23 -1.33 116.97 117.84 2boa h TYR 1259Ca -0.02 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 2boa h TYR 1259Cb 0.41 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.43 2boa h TYR 1259CO 0.02 0.42 -0.14 -0.44 -1.64 0.00 0.00 178.16 176.38 2boa h ASP 1260N 0.80 0.00 -0.81 -2.11 3.45 -1.38 -2.79 116.42 113.58 2boa h ASP 1260Ca 0.29 0.00 -0.37 0.00 0.43 0.00 0.00 57.03 57.37 2boa h ASP 1260Cb 0.07 0.00 -0.22 0.00 -0.56 0.00 0.00 39.33 38.62 2boa h ASP 1260CO -0.13 0.14 0.47 0.59 -1.57 0.00 0.00 179.24 178.74 2boa n ASN 1261N -3.71 3.95 0.00 6.45 3.02 -0.57 -4.91 115.26 119.49 2boa n ASN 1261Ca -0.02 -3.30 0.00 0.00 -0.03 0.00 0.00 54.58 51.23 2boa n ASN 1261Cb 0.26 -0.77 0.00 0.00 -0.61 0.00 0.00 39.78 38.65 2boa n ASN 1261CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2boa n GLY 1262N -0.67 0.49 3.27 7.41 0.00 -1.05 -5.01 105.19 109.63 2boa n GLY 1262Ca 0.47 -0.49 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 2boa n GLY 1262CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2boa s ILE 1263N -2.00 4.92 0.15 -0.61 1.01 -0.59 -4.91 121.20 119.17 2boa s ILE 1263Ca 0.00 -1.98 -0.17 0.00 0.00 0.00 0.00 60.65 58.50 2boa s ILE 1263Cb 0.00 -4.14 0.01 0.00 0.01 0.00 0.00 42.46 38.34 2boa s ILE 1263CO 0.00 -0.89 1.73 0.50 0.00 0.00 0.00 174.94 176.28 2boa h LYS 1264N 8.30 0.18 -3.27 2.79 3.64 -1.85 -3.24 116.57 123.13 2boa h LYS 1264Ca -0.14 -0.01 -0.76 0.00 -1.27 0.00 0.00 60.65 58.47 2boa h LYS 1264Cb 1.06 -0.04 -0.17 0.00 -0.41 0.00 0.00 32.23 32.67 2boa h LYS 1264CO 0.88 0.12 1.89 1.19 -2.27 0.00 0.00 179.45 181.27 2boa n PHE 1265N -5.08 2.77 -3.43 1.91 3.72 -1.21 -4.89 117.46 111.25 2boa n PHE 1265Ca 0.00 -2.75 -0.38 0.00 -0.05 0.00 0.00 57.45 54.27 2boa n PHE 1265Cb 0.13 -1.82 -0.08 0.00 -0.94 0.00 0.00 39.48 36.78 2boa n PHE 1265CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2boa s ALA 1266N -0.37 3.57 -0.00 4.37 0.00 -1.25 -2.10 121.76 125.97 2boa s ALA 1266Ca 0.40 -0.58 -0.02 0.00 0.00 0.00 0.00 51.96 51.77 2boa s ALA 1266Cb 0.10 -2.58 -0.00 0.00 0.00 0.00 0.00 23.12 20.64 2boa s ALA 1266CO 0.00 -0.28 0.03 -0.06 0.00 0.00 0.00 175.76 175.46 2boa s PHE 1267N 1.25 0.07 -0.09 0.00 0.40 -0.11 -4.39 117.98 115.11 2boa s PHE 1267Ca 0.17 -0.14 0.01 0.00 -0.60 0.00 0.00 56.93 56.38 2boa s PHE 1267Cb -0.14 -0.06 -0.02 0.00 0.51 0.00 0.00 43.02 43.30 2boa s PHE 1267CO 0.07 -0.11 -0.10 0.99 0.70 0.00 0.00 175.22 176.77 2boa s THR 1268N -0.66 3.37 -0.25 0.64 2.01 -0.37 -0.21 115.64 120.17 2boa s THR 1268Ca -0.07 -0.58 -0.03 0.00 0.31 0.00 0.00 61.69 61.31 2boa s THR 1268Cb -0.05 -2.38 0.02 0.00 0.01 0.00 0.00 72.50 70.10 2boa s THR 1268CO -0.00 0.56 -0.04 -0.36 -0.69 0.00 0.00 174.62 174.10 2boa s PHE 1269N -0.34 3.07 -0.43 4.92 0.40 0.17 -1.20 117.98 124.57 2boa s PHE 1269Ca 0.04 -1.39 -0.20 0.00 -0.60 0.00 0.00 56.93 54.79 2boa s PHE 1269Cb -0.13 -2.10 0.02 0.00 0.51 0.00 0.00 43.02 41.33 2boa s PHE 1269CO 0.02 -0.68 0.59 -1.21 0.70 0.00 0.00 175.22 174.64 2boa s GLU 1270N 1.37 3.26 0.00 0.44 0.41 0.47 0.38 118.70 125.03 2boa s GLU 1270Ca 0.01 -0.44 0.00 0.00 -0.41 0.00 0.00 54.97 54.13 2boa s GLU 1270Cb -0.16 -3.94 0.00 0.00 -1.78 0.00 0.00 34.13 28.24 2boa s GLU 1270CO -0.03 -0.95 0.00 1.28 -0.49 0.00 0.00 175.26 175.07 2boa n LEU 1271N 6.07 0.00 -4.62 1.80 4.77 -0.61 -0.49 117.00 123.91 2boa n LEU 1271Ca -0.03 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.57 2boa n LEU 1271Cb 0.48 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.61 2boa n LEU 1271CO 0.51 -0.46 0.58 0.54 -1.33 0.00 0.00 177.39 177.23 2boa n ARG 1272N -0.92 1.02 0.00 3.23 1.74 -1.26 -1.38 116.66 119.09 2boa n ARG 1272Ca 0.00 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.47 2boa n ARG 1272Cb 0.00 -2.18 0.00 0.00 -1.02 0.00 0.00 32.46 29.26 2boa n ARG 1272CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2boa n ASP 1273N -0.62 0.00 -0.32 0.55 5.68 -1.26 -4.63 116.55 115.95 2boa n ASP 1273Ca 0.13 0.00 0.08 0.00 -0.50 0.00 0.00 54.79 54.50 2boa n ASP 1273Cb 0.46 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.43 2boa n ASP 1273CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2boa n THR 1274N 0.00 0.00 0.00 2.12 -2.24 -1.26 -0.08 114.28 112.82 2boa n THR 1274Ca 0.00 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2boa n THR 1274Cb 0.00 1.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.39 2boa n THR 1274CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2boa n GLY 1275N 1.17 -0.10 0.30 3.38 0.00 -1.26 -4.86 105.19 103.83 2boa n GLY 1275Ca 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.03 2boa n GLY 1275CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2boa h THR 1276N 0.00 1.21 0.00 2.61 2.02 -1.93 -3.34 112.91 113.48 2boa h THR 1276Ca 0.00 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 66.75 2boa h THR 1276Cb 0.00 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.54 2boa h THR 1276CO 0.00 0.21 -0.83 -1.22 0.37 0.00 0.00 175.52 174.05 2boa n TYR 1277N -4.52 0.00 0.00 3.16 4.01 -1.26 -4.85 117.16 113.70 2boa n TYR 1277Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 2boa n TYR 1277Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 2boa n TYR 1277CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2boa n GLY 1278N 2.11 3.46 0.24 2.72 0.00 -1.26 -2.07 105.19 110.40 2boa n GLY 1278Ca 0.00 -0.11 0.08 0.00 0.00 0.00 0.00 46.02 45.98 2boa n GLY 1278CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2boa h PHE 1279N 0.00 0.00 -0.97 1.61 0.04 -1.91 -3.27 116.94 112.45 2boa h PHE 1279Ca 0.00 0.00 -0.66 0.00 2.80 0.00 0.00 57.97 60.11 2boa h PHE 1279Cb 0.00 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 38.03 2boa h PHE 1279CO 0.00 0.11 2.04 1.28 -0.60 0.00 0.00 178.31 181.15 2boa n LEU 1280N -4.27 7.70 -4.68 1.54 7.99 -0.88 -4.49 117.00 119.90 2boa n LEU 1280Ca -0.03 -4.60 -0.42 0.00 -0.01 0.00 0.00 56.01 50.95 2boa n LEU 1280Cb 0.19 -1.36 -0.03 0.00 -0.11 0.00 0.00 43.42 42.12 2boa n LEU 1280CO 0.34 1.98 1.19 -0.22 -1.51 0.00 0.00 177.39 179.18 2boa s LEU 1281N -1.81 4.32 0.22 2.23 2.96 -1.23 -4.82 118.68 120.55 2boa s LEU 1281Ca 0.57 2.17 -0.31 0.00 -0.22 0.00 0.00 54.13 56.34 2boa s LEU 1281Cb 0.23 -3.56 -0.15 0.00 0.50 0.00 0.00 46.19 43.22 2boa s LEU 1281CO -0.11 -0.78 1.17 -2.65 -1.32 0.00 0.00 176.35 172.66 2boa n PRO 1282N 5.74 1.42 -0.32 0.98 -0.02 -1.26 -4.86 135.00 136.68 2boa n PRO 1282Ca 0.14 0.50 0.18 0.00 -2.02 0.00 0.00 63.50 62.31 2boa n PRO 1282Cb 0.43 -2.00 0.37 0.00 -0.02 0.00 0.00 33.50 32.28 2boa n PRO 1282CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2boa h ALA 1283N 3.13 1.51 0.00 3.55 0.00 -1.92 -1.93 119.26 123.60 2boa h ALA 1283Ca -0.43 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2boa h ALA 1283Cb 1.33 0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.48 2boa h ALA 1283CO 0.68 -0.59 0.00 0.27 0.00 0.00 0.00 179.25 179.61 2boa n ASN 1284N -5.27 0.00 -0.17 0.00 0.23 -1.26 -0.30 115.26 108.50 2boa n ASN 1284Ca 0.26 0.29 0.12 0.00 -0.53 0.00 0.00 54.58 54.73 2boa n ASN 1284Cb 0.85 -0.39 0.29 0.00 -2.08 0.00 0.00 39.78 38.45 2boa n ASN 1284CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2boa n GLN 1285N -1.39 0.55 0.03 -3.83 6.02 -0.73 -4.57 117.38 113.47 2boa n GLN 1285Ca 0.04 -0.34 -0.12 0.00 -0.01 0.00 0.00 57.00 56.58 2boa n GLN 1285Cb 0.12 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 29.81 2boa n GLN 1285CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2boa h ILE 1286N 0.83 1.02 -0.44 5.09 2.04 -0.80 -0.62 117.51 124.63 2boa h ILE 1286Ca 0.00 -0.06 -0.05 0.00 1.00 0.00 0.00 64.86 65.75 2boa h ILE 1286Cb 0.52 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 2boa h ILE 1286CO 0.00 0.02 0.08 0.40 0.00 0.00 0.00 178.15 178.65 2boa h ILE 1287N -0.02 1.24 -0.59 -0.67 2.04 -1.81 0.22 117.51 117.93 2boa h ILE 1287Ca 0.00 -0.87 -0.08 0.00 1.00 0.00 0.00 64.86 64.91 2boa h ILE 1287Cb 0.03 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2boa h ILE 1287CO -0.00 0.30 0.05 -0.65 0.00 0.00 0.00 178.15 177.85 2boa h PRO 1288N 0.58 1.01 -0.44 2.37 0.11 -1.79 0.25 132.00 134.09 2boa h PRO 1288Ca 0.13 -0.30 0.04 0.00 0.11 0.00 0.00 66.00 65.98 2boa h PRO 1288Cb 0.36 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.33 2boa h PRO 1288CO 0.01 0.98 0.22 1.15 -0.21 0.00 0.00 178.00 180.14 2boa h THR 1289N 0.91 0.97 -0.06 -1.15 2.02 -1.01 -1.76 112.91 112.82 2boa h THR 1289Ca 0.17 -0.15 0.02 0.00 0.77 0.00 0.00 66.41 67.22 2boa h THR 1289Cb 0.49 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2boa h THR 1289CO 0.02 0.08 -0.04 0.00 0.37 0.00 0.00 175.52 175.95 2boa h ALA 1290N 1.23 0.01 -0.40 6.16 0.00 -0.10 -0.80 119.26 125.36 2boa h ALA 1290Ca 0.19 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 2boa h ALA 1290Cb 0.10 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2boa h ALA 1290CO -0.13 -0.52 -0.03 0.93 0.00 0.00 0.00 179.25 179.50 2boa h GLU 1291N -0.05 0.72 -0.34 0.00 5.08 -0.39 0.13 114.58 119.73 2boa h GLU 1291Ca 0.04 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.12 2boa h GLU 1291Cb 0.11 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2boa h GLU 1291CO -0.09 0.82 0.06 1.05 -1.00 0.00 0.00 179.01 179.85 2boa h GLU 1292N 0.54 0.56 -0.79 2.33 4.11 -1.33 -2.96 114.58 117.04 2boa h GLU 1292Ca 0.11 -0.15 0.09 0.00 0.07 0.00 0.00 59.36 59.48 2boa h GLU 1292Cb 0.52 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.63 2boa h GLU 1292CO 0.03 0.63 0.45 1.15 0.07 0.00 0.00 179.01 181.33 2boa h THR 1293N 0.40 0.91 -0.81 -1.06 2.02 -0.88 -2.83 112.91 110.67 2boa h THR 1293Ca 0.10 -0.26 0.11 0.00 0.77 0.00 0.00 66.41 67.13 2boa h THR 1293Cb 0.34 0.09 -0.08 0.00 -1.74 0.00 0.00 68.15 66.76 2boa h THR 1293CO 0.01 0.14 0.44 -0.25 0.37 0.00 0.00 175.52 176.22 2boa h TRP 1294N 0.76 0.78 -0.74 3.16 -0.00 -0.57 0.22 115.95 119.55 2boa h TRP 1294Ca 0.38 0.03 -0.02 0.00 -0.00 0.00 0.00 58.89 59.28 2boa h TRP 1294Cb 0.34 -0.23 -0.03 0.00 -0.00 0.00 0.00 29.16 29.23 2boa h TRP 1294CO -0.07 0.28 0.39 -0.07 -0.00 0.00 0.00 178.44 178.97 2boa h LEU 1295N 0.71 0.95 -0.34 0.65 3.38 -1.48 -0.57 115.31 118.61 2boa h LEU 1295Ca 0.41 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 2boa h LEU 1295Cb 0.44 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2boa h LEU 1295CO -0.28 0.79 0.17 1.23 0.09 0.00 0.00 178.44 180.44 2boa h GLY 1296N 1.03 0.51 0.94 0.83 0.00 -0.88 -2.56 103.07 102.95 2boa h GLY 1296Ca 0.26 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.34 2boa h GLY 1296CO -0.04 0.23 -0.09 1.41 0.00 0.00 0.00 176.54 178.06 2boa h LEU 1297N 0.41 -0.22 -1.56 3.11 3.38 -0.50 -2.44 115.31 117.50 2boa h LEU 1297Ca 0.12 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.16 2boa h LEU 1297Cb 0.09 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2boa h LEU 1297CO -0.02 -0.14 0.38 0.11 0.09 0.00 0.00 178.44 178.86 2boa h LYS 1298N -0.22 0.52 -0.19 1.13 1.57 -1.12 -0.33 116.57 117.94 2boa h LYS 1298Ca -0.01 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 2boa h LYS 1298Cb 0.19 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 2boa h LYS 1298CO 0.01 0.35 -0.15 1.15 -0.57 0.00 0.00 179.45 180.23 2boa h THR 1299N 0.54 1.33 -0.71 -0.16 2.02 -1.11 0.29 112.91 115.11 2boa h THR 1299Ca 0.25 -1.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.14 2boa h THR 1299Cb 0.29 1.74 -0.03 0.00 -1.74 0.00 0.00 68.15 68.41 2boa h THR 1299CO -0.07 0.38 0.37 0.40 0.37 0.00 0.00 175.52 176.97 2boa h ILE 1300N 0.10 1.22 0.00 3.11 2.04 -1.01 -2.34 117.51 120.64 2boa h ILE 1300Ca 0.04 -0.58 -0.11 0.00 1.00 0.00 0.00 64.86 65.20 2boa h ILE 1300Cb 0.67 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2boa h ILE 1300CO 0.04 0.25 -0.52 0.24 0.00 0.00 0.00 178.15 178.16 2boa h MET 1301N 0.98 0.00 -0.21 2.37 2.86 -0.85 -2.05 114.93 118.03 2boa h MET 1301Ca 0.25 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.78 2boa h MET 1301Cb 0.07 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.73 2boa h MET 1301CO -0.04 0.52 -0.30 0.93 1.06 0.00 0.00 176.91 179.09 2boa h GLU 1302N 0.00 0.57 -0.84 1.72 5.08 -0.24 -1.06 114.58 119.81 2boa h GLU 1302Ca -0.01 -0.34 0.10 0.00 -1.00 0.00 0.00 59.36 58.12 2boa h GLU 1302Cb 0.94 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 30.14 2boa h GLU 1302CO 0.07 0.94 0.48 1.25 -1.00 0.00 0.00 179.01 180.74 2boa h HIS 1303N 0.24 0.86 -0.70 4.33 2.76 -1.20 -1.77 115.15 119.67 2boa h HIS 1303Ca 0.02 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.16 2boa h HIS 1303Cb 0.88 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 29.55 2boa h HIS 1303CO 0.09 0.33 0.21 0.28 -1.30 0.00 0.00 177.93 177.54 2boa h VAL 1304N 0.78 1.26 -0.81 5.26 2.07 -1.18 0.16 116.25 123.79 2boa h VAL 1304Ca 0.41 -0.91 0.01 0.00 0.82 0.00 0.00 66.70 67.03 2boa h VAL 1304Cb 0.41 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 2boa h VAL 1304CO -0.26 0.35 0.54 -0.09 0.02 0.00 0.00 177.57 178.12 2boa h ARG 1305N 1.04 1.07 0.00 1.57 2.43 -0.49 -2.93 114.38 117.07 2boa h ARG 1305Ca 0.22 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2boa h ARG 1305Cb 0.32 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2boa h ARG 1305CO -0.00 0.71 -0.49 -0.25 -1.51 0.00 0.00 179.97 178.43 2boa n ASP 1306N -4.51 0.68 -2.37 -3.80 8.00 -0.73 -4.28 116.55 109.53 2boa n ASP 1306Ca 0.08 0.18 -0.22 0.00 0.71 0.00 0.00 54.79 55.54 2boa n ASP 1306Cb 0.02 -0.02 0.01 0.00 -0.02 0.00 0.00 41.12 41.11 2boa n ASP 1306CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2boa n ASN 1307N -2.07 4.22 -4.80 -2.24 3.02 0.52 -5.08 115.26 108.84 2boa n ASN 1307Ca 0.04 -3.50 -0.33 0.00 -0.03 0.00 0.00 54.58 50.76 2boa n ASN 1307Cb 0.43 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2boa n ASN 1307CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2boa s LEU 1308N -3.54 3.56 0.00 3.41 1.43 -1.19 -4.88 118.68 117.48 2boa s LEU 1308Ca 0.45 1.84 0.00 0.00 -1.03 0.00 0.00 54.13 55.40 2boa s LEU 1308Cb 0.40 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 42.09 2boa s LEU 1308CO -0.08 -1.11 0.28 0.00 0.23 0.00 0.00 176.35 175.68