#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2np0 s VAL 2 N 0.00 5.17 -0.17 0.52 1.01 -1.26 -5.08 120.40 120.60 2np0 s VAL 2 Ca 0.00 0.80 -0.06 0.00 0.00 0.00 0.00 61.98 62.71 2np0 s VAL 2 Cb 0.00 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 2np0 s VAL 2 CO 0.00 0.43 0.05 -0.89 0.00 0.00 0.00 175.10 174.69 2np0 s THR 3 N 0.01 4.67 -0.21 3.92 2.01 -1.26 -5.09 115.64 119.69 2np0 s THR 3 Ca 0.23 -0.08 -0.15 0.00 0.31 0.00 0.00 61.69 61.99 2np0 s THR 3 Cb -0.15 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.24 2np0 s THR 3 CO 0.09 0.49 0.38 -0.63 -0.69 0.00 0.00 174.62 174.26 2np0 s ILE 4 N 0.16 5.21 0.52 1.82 -1.09 -1.26 -4.58 121.20 121.98 2np0 s ILE 4 Ca 0.04 0.66 -0.19 0.00 -2.23 0.00 0.00 60.65 58.92 2np0 s ILE 4 Cb -0.12 -3.71 -0.07 0.00 -1.58 0.00 0.00 42.46 36.98 2np0 s ILE 4 CO 0.01 0.25 1.05 0.20 -1.23 0.00 0.00 174.94 175.23 2np0 s ASN 5 N 1.07 6.13 0.02 3.58 0.01 0.22 -5.04 114.94 120.93 2np0 s ASN 5 Ca 0.18 1.93 0.05 0.00 -0.71 0.00 0.00 52.86 54.31 2np0 s ASN 5 Cb -0.15 -2.56 -0.03 0.00 0.41 0.00 0.00 41.25 38.92 2np0 s ASN 5 CO 0.08 -0.93 -0.10 0.20 -1.51 0.00 0.00 177.10 174.84 2np0 s ASN 6 N -2.15 4.37 0.02 -1.22 0.01 -1.26 -4.90 114.94 109.81 2np0 s ASN 6 Ca 0.67 -0.24 -0.29 0.00 -0.71 0.00 0.00 52.86 52.29 2np0 s ASN 6 Cb -0.17 -0.93 0.10 0.00 0.41 0.00 0.00 41.25 40.66 2np0 s ASN 6 CO 0.25 0.27 1.11 0.72 -1.51 0.00 0.00 177.10 177.94 2np0 s PHE 7 N -0.99 -0.12 0.04 2.20 -0.12 -1.26 -5.14 117.98 112.59 2np0 s PHE 7 Ca 0.17 -0.05 0.07 0.00 -0.05 0.00 0.00 56.93 57.07 2np0 s PHE 7 Cb -0.11 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 42.82 2np0 s PHE 7 CO 0.07 -0.50 -0.19 -0.80 -0.05 0.00 0.00 175.22 173.75 2np0 s ASN 8 N -2.81 3.74 0.32 1.98 0.01 -1.26 -4.84 114.94 112.07 2np0 s ASN 8 Ca 0.12 -0.45 0.09 0.00 -0.71 0.00 0.00 52.86 51.91 2np0 s ASN 8 Cb 0.01 -0.58 0.93 0.00 0.41 0.00 0.00 41.25 42.02 2np0 s ASN 8 CO -0.02 0.25 1.63 0.22 -1.51 0.00 0.00 177.10 177.67 2np0 h TYR 9 N 4.54 0.56 -0.04 2.20 3.20 -1.89 -1.17 116.97 124.37 2np0 h TYR 9 Ca -0.48 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.44 2np0 h TYR 9 Cb 1.15 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 39.33 2np0 h TYR 9 CO 0.53 -0.26 0.00 0.09 -1.64 0.00 0.00 178.16 176.88 2np0 n ASN 10 N -5.20 0.84 -4.69 -2.11 3.02 -1.26 -4.90 115.26 100.96 2np0 n ASN 10 Ca 0.27 -1.40 -0.41 0.00 -0.03 0.00 0.00 54.58 53.01 2np0 n ASN 10 Cb 0.87 -0.02 0.01 0.00 -0.61 0.00 0.00 39.78 40.03 2np0 n ASN 10 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2np0 n ASP 11 N -0.29 2.40 -4.61 6.41 8.00 -0.44 -4.92 116.55 123.10 2np0 n ASP 11 Ca 0.19 1.10 -0.36 0.00 0.71 0.00 0.00 54.79 56.42 2np0 n ASP 11 Cb 0.23 -1.48 0.08 0.00 -0.02 0.00 0.00 41.12 39.92 2np0 n ASP 11 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 2np0 n PRO 12 N 0.04 0.61 -2.21 -0.24 -0.02 -1.26 -4.94 135.00 126.98 2np0 n PRO 12 Ca 0.07 0.26 -0.43 0.00 -2.02 0.00 0.00 63.50 61.38 2np0 n PRO 12 Cb 0.40 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2np0 n PRO 12 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2np0 s ILE 13 N -1.73 3.91 -1.43 4.25 1.01 -1.26 -4.85 121.20 121.09 2np0 s ILE 13 Ca 0.74 1.11 0.14 0.00 0.00 0.00 0.00 60.65 62.64 2np0 s ILE 13 Cb -0.36 -3.72 0.26 0.00 0.01 0.00 0.00 42.46 38.65 2np0 s ILE 13 CO 0.49 -0.09 1.14 -0.90 0.00 0.00 0.00 174.94 175.59 2np0 n ASP 14 N 6.78 2.70 -1.77 3.58 5.68 -0.83 -4.99 116.55 127.71 2np0 n ASP 14 Ca 0.15 -1.81 -0.17 0.00 -0.50 0.00 0.00 54.79 52.47 2np0 n ASP 14 Cb 0.44 -0.16 -0.06 0.00 -1.14 0.00 0.00 41.12 40.21 2np0 n ASP 14 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2np0 n ASN 15 N 0.78 -4.71 0.00 -1.12 3.02 -0.89 -4.71 115.26 107.62 2np0 n ASN 15 Ca 0.12 0.33 0.00 0.00 -0.03 0.00 0.00 54.58 54.99 2np0 n ASN 15 Cb 0.41 -4.15 0.00 0.00 -0.61 0.00 0.00 39.78 35.43 2np0 n ASN 15 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2np0 n ASN 16 N -1.25 0.00 0.04 6.41 4.05 -1.26 -4.95 115.26 118.30 2np0 n ASN 16 Ca -0.18 0.00 0.06 0.00 0.45 0.00 0.00 54.58 54.90 2np0 n ASN 16 Cb 0.59 0.00 -0.08 0.00 1.23 0.00 0.00 39.78 41.52 2np0 n ASN 16 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2np0 n ASN 17 N -2.17 0.59 -4.06 1.20 3.02 -1.26 -4.76 115.26 107.83 2np0 n ASN 17 Ca 0.00 0.25 -0.32 0.00 -0.03 0.00 0.00 54.58 54.48 2np0 n ASN 17 Cb 0.00 0.74 -0.15 0.00 -0.61 0.00 0.00 39.78 39.75 2np0 n ASN 17 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2np0 s ILE 18 N -3.17 2.06 0.31 2.41 1.01 -1.26 -0.99 121.20 121.57 2np0 s ILE 18 Ca -0.04 -1.49 0.05 0.00 0.00 0.00 0.00 60.65 59.17 2np0 s ILE 18 Cb 0.10 -2.15 -0.06 0.00 0.01 0.00 0.00 42.46 40.36 2np0 s ILE 18 CO 0.83 0.03 0.02 0.27 0.00 0.00 0.00 174.94 176.08 2np0 s ILE 19 N 1.17 1.37 -0.45 2.92 -4.36 -0.73 -1.96 121.20 119.15 2np0 s ILE 19 Ca -0.07 -2.04 -0.14 0.00 -0.26 0.00 0.00 60.65 58.14 2np0 s ILE 19 Cb -0.19 -2.68 0.07 0.00 1.25 0.00 0.00 42.46 40.91 2np0 s ILE 19 CO -0.06 -0.11 0.35 -0.04 0.24 0.00 0.00 174.94 175.32 2np0 s MET 20 N -3.83 2.91 0.13 0.37 -1.94 -1.26 -0.30 119.30 115.38 2np0 s MET 20 Ca 0.34 -1.32 -0.07 0.00 -1.71 0.00 0.00 55.69 52.93 2np0 s MET 20 Cb 0.07 -4.04 -0.06 0.00 2.01 0.00 0.00 34.83 32.81 2np0 s MET 20 CO 0.14 -0.97 0.41 1.41 -0.01 0.00 0.00 175.02 176.00 2np0 s MET 21 N 1.61 3.70 -0.54 2.03 1.75 0.21 -1.24 119.30 126.81 2np0 s MET 21 Ca 0.04 0.07 -0.07 0.00 -1.25 0.00 0.00 55.69 54.47 2np0 s MET 21 Cb -0.23 -2.88 0.14 0.00 2.84 0.00 0.00 34.83 34.70 2np0 s MET 21 CO 0.06 0.48 0.40 -2.00 -0.65 0.00 0.00 175.02 173.32 2np0 s GLU 22 N -2.37 2.56 0.59 4.11 2.12 -0.04 -0.55 118.70 125.13 2np0 s GLU 22 Ca 0.39 -2.04 -0.13 0.00 0.36 0.00 0.00 54.97 53.54 2np0 s GLU 22 Cb -0.13 -3.89 -0.05 0.00 0.26 0.00 0.00 34.13 30.33 2np0 s GLU 22 CO 0.21 -1.19 1.02 -1.25 -0.54 0.00 0.00 175.26 173.52 2np0 s PRO 23 N 0.85 3.58 0.38 4.30 0.04 -1.26 -3.83 135.00 139.06 2np0 s PRO 23 Ca 0.10 0.90 0.15 0.00 0.04 0.00 0.00 61.00 62.19 2np0 s PRO 23 Cb -0.22 -2.08 0.99 0.00 0.04 0.00 0.00 34.50 33.23 2np0 s PRO 23 CO -0.03 -0.58 1.82 -1.35 0.04 0.00 0.00 177.00 176.90 2np0 h PRO 24 N 0.12 0.49 0.00 0.56 0.11 -1.95 -0.90 132.00 130.43 2np0 h PRO 24 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2np0 h PRO 24 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2np0 h PRO 24 CO 0.60 0.32 -0.58 1.19 -0.21 0.00 0.00 178.00 179.33 2np0 n PHE 25 N -4.59 0.03 0.30 0.65 0.99 -1.26 -3.18 117.46 110.40 2np0 n PHE 25 Ca 0.21 0.01 0.18 0.00 -0.00 0.00 0.00 57.45 57.85 2np0 n PHE 25 Cb 0.69 -0.25 0.92 0.00 -1.00 0.00 0.00 39.48 39.84 2np0 n PHE 25 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2np0 h ALA 26 N 2.96 1.12 -0.65 4.37 0.00 -1.51 -3.47 119.26 122.08 2np0 h ALA 26 Ca 0.00 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 2np0 h ALA 26 Cb 0.52 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 2np0 h ALA 26 CO 0.00 0.05 -0.17 0.54 0.00 0.00 0.00 179.25 179.67 2np0 n ARG 27 N -3.30 -0.59 -0.14 0.00 5.12 -1.19 -2.14 116.66 114.43 2np0 n ARG 27 Ca -0.02 0.65 0.00 0.00 -1.93 0.00 0.00 57.85 56.55 2np0 n ARG 27 Cb 0.18 -4.53 0.00 0.00 -1.16 0.00 0.00 32.46 26.96 2np0 n ARG 27 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2np0 n GLY 28 N -1.66 0.33 3.43 -0.13 0.00 -1.26 -4.90 105.19 101.00 2np0 n GLY 28 Ca -0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.50 2np0 n GLY 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2np0 s THR 29 N -1.30 4.54 0.00 2.61 -4.23 -0.91 -4.87 115.64 111.49 2np0 s THR 29 Ca 0.00 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.74 2np0 s THR 29 Cb 0.00 -4.64 0.00 0.00 1.34 0.00 0.00 72.50 69.20 2np0 s THR 29 CO 0.00 -1.37 0.00 0.61 -0.54 0.00 0.00 174.62 173.32 2np0 n GLY 30 N 5.32 1.17 3.44 3.99 0.00 -1.26 -4.93 105.19 112.92 2np0 n GLY 30 Ca -0.01 -0.63 -0.25 0.00 0.00 0.00 0.00 46.02 45.14 2np0 n GLY 30 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2np0 s ARG 31 N 0.00 1.59 0.15 1.61 1.04 -1.26 -5.14 118.95 116.94 2np0 s ARG 31 Ca 0.00 -1.66 0.08 0.00 -1.04 0.00 0.00 55.73 53.11 2np0 s ARG 31 Cb 0.00 -1.74 -0.04 0.00 -2.04 0.00 0.00 34.95 31.13 2np0 s ARG 31 CO 0.00 0.34 -0.19 0.71 -0.04 0.00 0.00 175.30 176.12 2np0 s TYR 32 N -2.23 1.82 -0.05 5.89 1.51 -1.26 -4.68 117.35 118.34 2np0 s TYR 32 Ca 0.26 -0.46 0.02 0.00 -1.01 0.00 0.00 57.07 55.89 2np0 s TYR 32 Cb -0.06 -0.93 0.01 0.00 -0.11 0.00 0.00 41.96 40.87 2np0 s TYR 32 CO 0.12 0.30 -0.12 0.71 -1.11 0.00 0.00 175.55 175.46 2np0 s TYR 33 N -1.83 1.34 -0.06 2.71 1.51 0.29 -4.91 117.35 116.40 2np0 s TYR 33 Ca 0.13 -0.44 -0.30 0.00 -1.01 0.00 0.00 57.07 55.46 2np0 s TYR 33 Cb -0.07 -0.97 -0.06 0.00 -0.11 0.00 0.00 41.96 40.75 2np0 s TYR 33 CO 0.06 -0.22 1.77 0.21 -1.11 0.00 0.00 175.55 176.26 2np0 s LYS 34 N 0.50 4.05 0.10 -0.62 2.20 -1.26 -0.62 119.74 124.09 2np0 s LYS 34 Ca -0.11 2.22 0.09 0.00 -0.36 0.00 0.00 55.97 57.82 2np0 s LYS 34 Cb -0.14 -4.07 -0.04 0.00 -1.51 0.00 0.00 37.83 32.08 2np0 s LYS 34 CO 0.03 -1.02 -0.21 0.00 -0.36 0.00 0.00 175.35 173.79 2np0 s ALA 35 N 4.58 2.57 -0.07 3.13 0.00 0.59 -4.46 121.76 128.11 2np0 s ALA 35 Ca 0.79 -1.35 0.03 0.00 0.00 0.00 0.00 51.96 51.44 2np0 s ALA 35 Cb -0.35 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.19 2np0 s ALA 35 CO 0.33 0.57 -0.18 -0.06 0.00 0.00 0.00 175.76 176.43 2np0 s PHE 36 N -1.07 1.90 -0.70 0.00 0.40 0.48 -1.78 117.98 117.22 2np0 s PHE 36 Ca 0.16 -0.69 -0.22 0.00 -0.60 0.00 0.00 56.93 55.58 2np0 s PHE 36 Cb -0.10 -1.31 0.08 0.00 0.51 0.00 0.00 43.02 42.20 2np0 s PHE 36 CO 0.08 -0.29 0.97 0.21 0.70 0.00 0.00 175.22 176.89 2np0 s LYS 37 N 0.38 3.19 0.05 0.44 2.20 -0.16 0.61 119.74 126.45 2np0 s LYS 37 Ca -0.13 -1.03 -0.17 0.00 -0.36 0.00 0.00 55.97 54.28 2np0 s LYS 37 Cb -0.15 -4.36 -0.17 0.00 -1.51 0.00 0.00 37.83 31.63 2np0 s LYS 37 CO 0.05 -1.79 1.24 0.97 -0.36 0.00 0.00 175.35 175.46 2np0 h ILE 38 N 5.96 1.36 -4.52 5.43 2.10 -1.65 -3.41 117.51 122.78 2np0 h ILE 38 Ca -0.21 -1.82 -0.30 0.00 1.08 0.00 0.00 64.86 63.61 2np0 h ILE 38 Cb 1.06 2.15 -0.13 0.00 -1.09 0.00 0.00 36.82 38.82 2np0 h ILE 38 CO 1.17 0.55 -0.46 0.42 -1.08 0.00 0.00 178.15 178.74 2np0 s THR 39 N -3.71 0.00 0.24 2.19 -4.23 -1.22 -0.61 115.64 108.30 2np0 s THR 39 Ca -0.13 -1.88 -0.30 0.00 -1.18 0.00 0.00 61.69 58.21 2np0 s THR 39 Cb 0.06 -2.49 -0.15 0.00 1.34 0.00 0.00 72.50 71.26 2np0 s THR 39 CO 0.83 0.00 1.04 0.47 -0.54 0.00 0.00 174.62 176.42 2np0 n ASP 40 N -0.84 1.15 0.00 3.99 8.00 -1.26 -1.76 116.55 125.83 2np0 n ASP 40 Ca 0.03 1.16 0.00 0.00 0.71 0.00 0.00 54.79 56.69 2np0 n ASP 40 Cb 0.64 -1.24 0.00 0.00 -0.02 0.00 0.00 41.12 40.50 2np0 n ASP 40 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2np0 n ARG 41 N 1.16 -0.01 -5.14 -1.24 5.12 -1.26 -4.80 116.66 110.50 2np0 n ARG 41 Ca 0.12 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 55.74 2np0 n ARG 41 Cb 0.29 -4.24 -0.17 0.00 -1.16 0.00 0.00 32.46 27.18 2np0 n ARG 41 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2np0 s ILE 42 N -1.39 1.91 0.03 0.55 1.01 -0.73 -1.01 121.20 121.58 2np0 s ILE 42 Ca 0.00 -0.96 0.05 0.00 0.00 0.00 0.00 60.65 59.74 2np0 s ILE 42 Cb 0.00 -1.65 -0.02 0.00 0.01 0.00 0.00 42.46 40.80 2np0 s ILE 42 CO 0.00 0.53 -0.15 0.26 0.00 0.00 0.00 174.94 175.58 2np0 s TRP 43 N 0.18 1.32 -0.21 3.97 0.52 -0.28 -1.64 118.94 122.80 2np0 s TRP 43 Ca -0.12 -0.33 -0.02 0.00 0.02 0.00 0.00 56.10 55.64 2np0 s TRP 43 Cb -0.16 -0.80 -0.00 0.00 -1.15 0.00 0.00 33.47 31.36 2np0 s TRP 43 CO 0.06 0.03 -0.09 0.42 0.02 0.00 0.00 176.95 177.40 2np0 s ILE 44 N -0.73 3.02 -0.50 2.03 -1.09 0.20 0.09 121.20 124.22 2np0 s ILE 44 Ca 0.03 -0.61 -0.08 0.00 -2.23 0.00 0.00 60.65 57.76 2np0 s ILE 44 Cb -0.07 -2.35 0.13 0.00 -1.58 0.00 0.00 42.46 38.59 2np0 s ILE 44 CO 0.01 0.46 0.36 -0.63 -1.23 0.00 0.00 174.94 173.91 2np0 s ILE 45 N 1.38 4.09 -1.02 2.92 1.01 -0.31 -0.39 121.20 128.88 2np0 s ILE 45 Ca 0.05 -2.03 -0.19 0.00 0.00 0.00 0.00 60.65 58.48 2np0 s ILE 45 Cb -0.14 -3.69 -0.09 0.00 0.01 0.00 0.00 42.46 38.55 2np0 s ILE 45 CO -0.05 -0.79 2.03 -0.81 0.00 0.00 0.00 174.94 175.31 2np0 n PRO 46 N 4.61 1.99 -3.58 2.79 -0.04 -1.26 -3.25 135.00 136.26 2np0 n PRO 46 Ca -0.04 -2.13 -0.13 0.00 -0.04 0.00 0.00 63.50 61.16 2np0 n PRO 46 Cb 0.41 -3.07 -0.05 0.00 -0.04 0.00 0.00 33.50 30.75 2np0 n PRO 46 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2np0 s GLU 47 N 4.40 1.05 0.32 0.54 2.02 -1.26 -4.77 118.70 121.01 2np0 s GLU 47 Ca 0.54 -0.38 -0.29 0.00 0.02 0.00 0.00 54.97 54.87 2np0 s GLU 47 Cb 0.14 0.48 -0.10 0.00 0.10 0.00 0.00 34.13 34.74 2np0 s GLU 47 CO 0.05 -0.39 1.38 1.03 0.02 0.00 0.00 175.26 177.34 2np0 s ARG 48 N -2.87 4.28 -0.47 1.61 1.81 -1.26 -1.18 118.95 120.86 2np0 s ARG 48 Ca -0.03 2.32 -0.29 0.00 -1.72 0.00 0.00 55.73 56.01 2np0 s ARG 48 Cb -0.00 -3.06 0.03 0.00 -0.45 0.00 0.00 34.95 31.47 2np0 s ARG 48 CO -0.05 -0.31 1.21 -0.47 -0.68 0.00 0.00 175.30 175.00 2np0 s TYR 49 N -0.90 2.69 -1.75 -0.53 5.04 -0.62 -4.87 117.35 116.41 2np0 s TYR 49 Ca 0.52 0.68 0.19 0.00 -2.44 0.00 0.00 57.07 56.01 2np0 s TYR 49 Cb -0.42 -4.42 0.00 0.00 0.35 0.00 0.00 41.96 37.47 2np0 s TYR 49 CO 0.53 -1.48 0.96 0.25 -1.34 0.00 0.00 175.55 174.48 2np0 n THR 50 N 6.90 0.00 -2.41 4.34 -2.24 -1.26 -4.15 114.28 115.46 2np0 n THR 50 Ca 0.13 -0.31 -0.43 0.00 -2.27 0.00 0.00 64.05 61.16 2np0 n THR 50 Cb 0.49 1.23 -0.02 0.00 -2.10 0.00 0.00 70.33 69.93 2np0 n THR 50 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2np0 s PHE 51 N -2.11 2.52 0.00 4.78 0.40 -1.26 -1.45 117.98 120.85 2np0 s PHE 51 Ca 0.16 0.71 0.00 0.00 -0.60 0.00 0.00 56.93 57.20 2np0 s PHE 51 Cb 0.15 -4.28 0.00 0.00 0.51 0.00 0.00 43.02 39.40 2np0 s PHE 51 CO 0.46 -1.80 0.00 0.41 0.70 0.00 0.00 175.22 174.99 2np0 n GLY 52 N 4.92 0.62 3.57 4.36 0.00 -1.26 -4.89 105.19 112.52 2np0 n GLY 52 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 2np0 n GLY 52 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2np0 s TYR 53 N -2.31 2.76 0.08 1.61 1.51 -0.53 -1.03 117.35 119.43 2np0 s TYR 53 Ca 0.00 -0.14 -0.15 0.00 -1.01 0.00 0.00 57.07 55.78 2np0 s TYR 53 Cb 0.00 -1.48 -0.06 0.00 -0.11 0.00 0.00 41.96 40.31 2np0 s TYR 53 CO 0.00 0.40 0.48 0.15 -1.11 0.00 0.00 175.55 175.47 2np0 s LYS 54 N -1.96 3.97 0.32 -0.62 1.02 -1.26 -4.97 119.74 116.24 2np0 s LYS 54 Ca 0.20 0.46 0.10 0.00 0.02 0.00 0.00 55.97 56.75 2np0 s LYS 54 Cb -0.11 -3.09 0.92 0.00 -0.52 0.00 0.00 37.83 35.03 2np0 s LYS 54 CO 0.12 0.59 1.70 -1.35 -0.92 0.00 0.00 175.35 175.48 2np0 h PRO 55 N 4.13 0.43 -0.33 -1.68 0.11 -2.00 -1.15 132.00 131.50 2np0 h PRO 55 Ca -0.50 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 2np0 h PRO 55 Cb 1.21 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2np0 h PRO 55 CO 0.64 0.28 0.10 0.93 -0.21 0.00 0.00 178.00 179.74 2np0 h GLU 56 N 0.44 0.47 0.00 1.05 3.07 -1.97 -2.73 114.58 114.91 2np0 h GLU 56 Ca 0.66 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 59.45 2np0 h GLU 56 Cb 1.35 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 2np0 h GLU 56 CO -0.54 0.42 0.00 -0.25 -1.40 0.00 0.00 179.01 177.24 2np0 n ASP 57 N -4.37 0.00 0.00 1.42 8.00 -0.44 -1.33 116.55 119.83 2np0 n ASP 57 Ca 0.02 0.35 0.09 0.00 0.71 0.00 0.00 54.79 55.96 2np0 n ASP 57 Cb 0.16 -0.43 0.43 0.00 -0.02 0.00 0.00 41.12 41.26 2np0 n ASP 57 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2np0 n PHE 58 N -1.43 0.00 -3.93 1.24 3.01 -1.03 -4.75 117.46 110.56 2np0 n PHE 58 Ca 0.05 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.19 2np0 n PHE 58 Cb 0.17 -0.38 -0.05 0.00 -0.01 0.00 0.00 39.48 39.22 2np0 n PHE 58 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 2np0 s ASN 59 N -2.75 6.26 0.26 4.37 0.01 -0.44 -3.45 114.94 119.19 2np0 s ASN 59 Ca 0.14 0.28 -0.31 0.00 -0.71 0.00 0.00 52.86 52.26 2np0 s ASN 59 Cb 0.12 -1.92 -0.12 0.00 0.41 0.00 0.00 41.25 39.74 2np0 s ASN 59 CO 0.30 0.22 1.65 -0.75 -1.51 0.00 0.00 177.10 177.01 2np0 s LYS 60 N -2.16 4.12 0.36 -0.60 2.36 -1.26 -4.99 119.74 117.57 2np0 s LYS 60 Ca 0.30 2.60 0.06 0.00 -2.55 0.00 0.00 55.97 56.38 2np0 s LYS 60 Cb -0.13 -3.04 -0.03 0.00 -1.05 0.00 0.00 37.83 33.58 2np0 s LYS 60 CO 0.22 -0.69 0.23 -1.54 1.55 0.00 0.00 175.35 175.13 2np0 s SER 61 N 0.77 2.08 0.00 1.43 1.04 -1.26 -5.02 113.70 112.75 2np0 s SER 61 Ca 0.68 -1.75 0.09 0.00 0.48 0.00 0.00 55.95 55.46 2np0 s SER 61 Cb -0.49 0.57 0.56 0.00 0.10 0.00 0.00 66.02 66.76 2np0 s SER 61 CO 0.42 -1.03 1.06 -1.54 0.98 0.00 0.00 173.24 173.12 2np0 n SER 62 N -1.51 0.00 -4.54 7.02 3.41 -1.26 -4.80 113.62 111.94 2np0 n SER 62 Ca 0.03 -0.90 -0.27 0.00 -0.26 0.00 0.00 58.87 57.47 2np0 n SER 62 Cb 0.63 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.48 2np0 n SER 62 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2np0 s GLY 63 N -1.70 2.48 0.10 5.00 0.00 -1.26 -2.25 107.32 109.69 2np0 s GLY 63 Ca 0.14 -1.79 0.03 0.00 0.00 0.00 0.00 44.72 43.10 2np0 s GLY 63 CO 0.11 -2.00 -0.08 -0.26 0.00 0.00 0.00 173.10 170.87 2np0 s ILE 64 N -2.97 0.80 -0.14 0.90 -5.25 0.53 -4.76 121.20 110.31 2np0 s ILE 64 Ca 0.29 -1.86 -0.18 0.00 -0.99 0.00 0.00 60.65 57.92 2np0 s ILE 64 Cb 0.07 -1.60 -0.24 0.00 2.95 0.00 0.00 42.46 43.64 2np0 s ILE 64 CO 0.14 -0.78 0.44 -0.26 -1.79 0.00 0.00 174.94 172.70 2np0 h PHE 65 N 3.12 0.27 -2.80 1.37 -1.00 -1.86 -0.66 116.94 115.38 2np0 h PHE 65 Ca -0.36 -0.20 -0.52 0.00 2.81 0.00 0.00 57.97 59.70 2np0 h PHE 65 Cb 1.18 -0.01 -0.15 0.00 3.61 0.00 0.00 35.95 40.57 2np0 h PHE 65 CO 0.61 1.52 -0.76 -0.80 -1.61 0.00 0.00 178.31 177.27 2np0 s ASN 66 N -6.91 2.93 -0.11 2.17 0.01 -1.26 -4.82 114.94 106.95 2np0 s ASN 66 Ca -0.23 -0.98 0.18 0.00 -0.71 0.00 0.00 52.86 51.13 2np0 s ASN 66 Cb 0.04 -0.19 0.73 0.00 0.41 0.00 0.00 41.25 42.24 2np0 s ASN 66 CO 0.71 -0.06 1.63 0.54 -1.51 0.00 0.00 177.10 178.40 2np0 n ARG 67 N -0.26 3.73 0.00 -0.60 1.74 -1.26 -4.67 116.66 115.33 2np0 n ARG 67 Ca -0.09 -2.87 0.00 0.00 -0.77 0.00 0.00 57.85 54.13 2np0 n ARG 67 Cb 0.59 -1.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 2np0 n ARG 67 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2np0 n ASP 68 N 1.16 0.00 0.00 0.55 5.68 -1.26 -4.47 116.55 118.21 2np0 n ASP 68 Ca 0.26 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.55 2np0 n ASP 68 Cb 0.89 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.87 2np0 n ASP 68 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 2np0 n VAL 69 N -1.81 0.00 -2.69 2.12 0.24 -1.26 -4.76 118.33 110.16 2np0 n VAL 69 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.87 2np0 n VAL 69 Cb 0.00 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.35 2np0 n VAL 69 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2np0 s GLU 71 N 3.54 4.07 -0.20 0.00 2.02 0.11 -4.71 118.70 123.52 2np0 s GLU 71 Ca 0.43 -0.09 -0.10 0.00 0.02 0.00 0.00 54.97 55.24 2np0 s GLU 71 Cb -0.12 -3.57 -0.05 0.00 0.10 0.00 0.00 34.13 30.48 2np0 s GLU 71 CO 0.15 -0.06 0.12 -0.47 0.02 0.00 0.00 175.26 175.02 2np0 s TYR 72 N 1.40 3.37 -0.09 1.61 5.04 -1.26 -0.76 117.35 126.66 2np0 s TYR 72 Ca 0.12 0.27 0.02 0.00 -2.44 0.00 0.00 57.07 55.04 2np0 s TYR 72 Cb -0.15 -2.16 -0.02 0.00 0.35 0.00 0.00 41.96 39.99 2np0 s TYR 72 CO 0.07 0.24 -0.13 0.71 -1.34 0.00 0.00 175.55 175.10 2np0 s TYR 73 N 0.44 2.77 -0.28 4.97 1.51 -1.11 -1.84 117.35 123.81 2np0 s TYR 73 Ca 0.07 -0.36 0.01 0.00 -1.01 0.00 0.00 57.07 55.77 2np0 s TYR 73 Cb -0.12 -1.73 0.15 0.00 -0.11 0.00 0.00 41.96 40.15 2np0 s TYR 73 CO -0.01 0.02 0.37 0.34 -1.11 0.00 0.00 175.55 175.16 2np0 s ASP 74 N -0.24 0.67 0.00 2.29 2.15 -1.26 -4.83 116.67 115.45 2np0 s ASP 74 Ca 0.01 -0.35 0.19 0.00 0.43 0.00 0.00 52.55 52.83 2np0 s ASP 74 Cb -0.13 0.96 0.85 0.00 -0.30 0.00 0.00 42.92 44.30 2np0 s ASP 74 CO 0.03 -0.35 1.61 -0.81 -0.17 0.00 0.00 175.17 175.47 2np0 n PRO 75 N 5.35 0.08 0.00 4.34 -0.04 -1.22 -2.30 135.00 141.20 2np0 n PRO 75 Ca -0.01 0.16 0.13 0.00 -0.04 0.00 0.00 63.50 63.74 2np0 n PRO 75 Cb 0.49 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.84 2np0 n PRO 75 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2np0 n ASP 76 N -1.44 0.99 -4.70 3.54 8.00 -1.26 -4.88 116.55 116.79 2np0 n ASP 76 Ca 0.06 -0.87 -0.42 0.00 0.71 0.00 0.00 54.79 54.27 2np0 n ASP 76 Cb 0.20 0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.39 2np0 n ASP 76 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2np0 s TYR 77 N -2.50 3.00 -0.59 1.24 5.04 -0.97 -2.42 117.35 120.14 2np0 s TYR 77 Ca 0.25 0.79 -0.01 0.00 -2.44 0.00 0.00 57.07 55.65 2np0 s TYR 77 Cb 0.19 -3.75 0.00 0.00 0.35 0.00 0.00 41.96 38.76 2np0 s TYR 77 CO 0.51 -2.74 0.12 1.28 -1.34 0.00 0.00 175.55 173.39 2np0 n LEU 78 N 4.58 -1.67 -1.23 6.97 4.77 -1.26 -4.82 117.00 124.34 2np0 n LEU 78 Ca 0.13 -0.06 0.10 0.00 -0.03 0.00 0.00 56.01 56.15 2np0 n LEU 78 Cb 0.42 -1.38 0.29 0.00 -2.33 0.00 0.00 43.42 40.42 2np0 n LEU 78 CO 0.59 0.01 0.75 -0.46 -1.33 0.00 0.00 177.39 176.96 2np0 n ASN 79 N 0.38 3.87 -4.16 -1.43 0.23 -1.02 -4.81 115.26 108.33 2np0 n ASN 79 Ca -0.06 -2.08 -0.10 0.00 -0.53 0.00 0.00 54.58 51.80 2np0 n ASN 79 Cb 0.55 -0.45 -0.10 0.00 -2.08 0.00 0.00 39.78 37.70 2np0 n ASN 79 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2np0 s THR 80 N -1.16 0.37 0.31 5.53 -4.23 -1.26 -5.05 115.64 110.15 2np0 s THR 80 Ca 0.44 -1.90 -0.00 0.00 -1.18 0.00 0.00 61.69 59.04 2np0 s THR 80 Cb 0.24 -1.85 0.21 0.00 1.34 0.00 0.00 72.50 72.45 2np0 s THR 80 CO 0.28 -0.69 1.92 0.78 -0.54 0.00 0.00 174.62 176.37 2np0 h ASN 81 N 2.93 0.80 0.15 3.99 4.21 -1.99 -2.32 115.58 123.35 2np0 h ASN 81 Ca -0.35 -0.07 -0.16 0.00 1.21 0.00 0.00 56.30 56.93 2np0 h ASN 81 Cb 1.18 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 38.17 2np0 h ASN 81 CO 0.63 0.67 -0.59 -0.78 -1.29 0.00 0.00 177.43 176.07 2np0 h ASP 82 N 0.89 0.50 -0.45 5.81 3.58 -1.99 -1.15 116.42 123.62 2np0 h ASP 82 Ca 0.22 -0.28 -0.07 0.00 0.42 0.00 0.00 57.03 57.33 2np0 h ASP 82 Cb 0.07 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.96 2np0 h ASP 82 CO -0.03 0.98 0.02 0.11 -2.88 0.00 0.00 179.24 177.43 2np0 h LYS 83 N 0.34 0.79 -0.44 0.28 1.57 -1.92 -1.78 116.57 115.40 2np0 h LYS 83 Ca -0.00 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2np0 h LYS 83 Cb 1.12 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 2np0 h LYS 83 CO 0.10 0.84 0.26 0.87 -0.57 0.00 0.00 179.45 180.95 2np0 h LYS 84 N 0.64 0.58 -0.32 3.15 1.57 -1.15 -0.95 116.57 120.10 2np0 h LYS 84 Ca 0.13 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.78 2np0 h LYS 84 Cb 0.47 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2np0 h LYS 84 CO 0.02 0.41 -0.15 -0.97 -0.57 0.00 0.00 179.45 178.19 2np0 h ASN 85 N 0.60 0.68 -0.59 0.86 -1.24 -0.73 -2.07 115.58 113.08 2np0 h ASN 85 Ca 0.16 -0.41 0.04 0.00 0.71 0.00 0.00 56.30 56.80 2np0 h ASN 85 Cb -0.02 -0.19 -0.05 0.00 0.73 0.00 0.00 38.32 38.80 2np0 h ASN 85 CO -0.03 0.93 0.33 0.40 -1.29 0.00 0.00 177.43 177.78 2np0 h ILE 86 N 0.42 1.00 0.11 2.57 2.04 -0.79 -0.77 117.51 122.10 2np0 h ILE 86 Ca 0.07 -0.22 0.02 0.00 1.00 0.00 0.00 64.86 65.73 2np0 h ILE 86 Cb 0.68 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 2np0 h ILE 86 CO 0.05 0.12 -0.42 0.15 0.00 0.00 0.00 178.15 178.04 2np0 h PHE 87 N 0.64 -1.18 -0.56 1.37 3.57 -1.05 -0.02 116.94 119.71 2np0 h PHE 87 Ca 0.25 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.89 2np0 h PHE 87 Cb 0.11 0.50 -0.11 0.00 2.79 0.00 0.00 35.95 39.24 2np0 h PHE 87 CO -0.08 -0.52 -0.14 -0.07 -2.23 0.00 0.00 178.31 175.28 2np0 h LEU 88 N -0.65 -0.51 -1.07 0.59 4.07 -0.90 -0.90 115.31 115.94 2np0 h LEU 88 Ca 0.02 0.17 -0.09 0.00 0.08 0.00 0.00 57.88 58.06 2np0 h LEU 88 Cb 0.68 0.34 -0.01 0.00 1.08 0.00 0.00 40.66 42.75 2np0 h LEU 88 CO -0.25 -0.18 -0.42 1.56 -1.08 0.00 0.00 178.44 178.06 2np0 h GLN 89 N 0.00 0.00 -0.27 1.13 1.08 -0.74 -0.06 115.11 116.25 2np0 h GLN 89 Ca 0.27 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.30 2np0 h GLN 89 Cb 0.41 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 2np0 h GLN 89 CO -0.57 0.42 -0.51 1.15 -0.95 0.00 0.00 178.83 178.37 2np0 h THR 90 N 0.00 1.28 -0.45 -0.54 2.02 -0.14 -0.79 112.91 114.30 2np0 h THR 90 Ca -0.00 -1.70 -0.02 0.00 0.77 0.00 0.00 66.41 65.46 2np0 h THR 90 Cb 0.83 1.67 -0.02 0.00 -1.74 0.00 0.00 68.15 68.89 2np0 h THR 90 CO 0.05 0.55 0.19 0.24 0.37 0.00 0.00 175.52 176.93 2np0 h MET 91 N 0.59 0.67 -0.71 6.66 2.86 -0.70 0.40 114.93 124.69 2np0 h MET 91 Ca 0.01 -0.11 0.07 0.00 -2.06 0.00 0.00 59.70 57.61 2np0 h MET 91 Cb 1.11 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 32.60 2np0 h MET 91 CO 0.11 0.60 0.40 0.82 1.06 0.00 0.00 176.91 179.90 2np0 h ILE 92 N 0.59 0.96 -0.25 -1.22 2.04 -0.91 0.35 117.51 119.07 2np0 h ILE 92 Ca 0.15 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 2np0 h ILE 92 Cb 0.17 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 2np0 h ILE 92 CO -0.01 0.13 0.04 0.50 0.00 0.00 0.00 178.15 178.80 2np0 h LYS 93 N 0.72 0.42 -0.15 2.37 3.64 -0.08 -0.23 116.57 123.26 2np0 h LYS 93 Ca 0.32 -0.12 0.02 0.00 -1.27 0.00 0.00 60.65 59.60 2np0 h LYS 93 Cb 0.22 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 2np0 h LYS 93 CO -0.20 0.55 0.04 -0.07 -2.27 0.00 0.00 179.45 177.50 2np0 h LEU 94 N 0.23 0.03 -0.63 5.20 3.38 0.23 -0.33 115.31 123.41 2np0 h LEU 94 Ca 0.08 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.17 2np0 h LEU 94 Cb 0.34 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.03 2np0 h LEU 94 CO 0.01 0.04 0.24 -0.26 0.09 0.00 0.00 178.44 178.56 2np0 h PHE 95 N 0.11 0.41 -0.89 1.13 -1.00 -0.06 -0.30 116.94 116.34 2np0 h PHE 95 Ca 0.07 0.03 0.05 0.00 2.81 0.00 0.00 57.97 60.93 2np0 h PHE 95 Cb 0.05 -0.09 -0.06 0.00 3.61 0.00 0.00 35.95 39.46 2np0 h PHE 95 CO -0.12 0.10 0.57 -0.91 -1.61 0.00 0.00 178.31 176.34 2np0 h ASN 96 N 0.42 0.92 -0.30 2.17 2.35 -0.43 -1.71 115.58 118.99 2np0 h ASN 96 Ca 0.32 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.07 2np0 h ASN 96 Cb 0.41 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 2np0 h ASN 96 CO -0.32 0.61 0.15 -0.09 -1.65 0.00 0.00 177.43 176.12 2np0 h ARG 97 N 1.07 0.43 -0.91 0.81 2.43 0.09 -2.53 114.38 115.77 2np0 h ARG 97 Ca 0.37 -0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.57 2np0 h ARG 97 Cb 0.09 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.49 2np0 h ARG 97 CO -0.15 0.40 0.56 0.82 -1.51 0.00 0.00 179.97 180.09 2np0 h ILE 98 N 0.35 0.96 -0.18 1.20 2.04 -0.39 -2.01 117.51 119.48 2np0 h ILE 98 Ca 0.10 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.64 2np0 h ILE 98 Cb 0.11 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.13 2np0 h ILE 98 CO -0.01 0.17 0.00 2.29 0.00 0.00 0.00 178.15 180.60 2np0 n LYS 99 N -4.65 1.64 0.03 2.37 2.85 -0.71 -3.34 118.16 116.35 2np0 n LYS 99 Ca 0.15 -0.97 0.11 0.00 -1.05 0.00 0.00 58.31 56.55 2np0 n LYS 99 Cb 0.27 -1.35 0.46 0.00 -0.65 0.00 0.00 35.03 33.77 2np0 n LYS 99 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2np0 n SER 100 N 0.21 0.18 -4.11 -5.58 3.41 -0.76 -4.54 113.62 102.44 2np0 n SER 100 Ca 0.15 0.53 -0.16 0.00 -0.26 0.00 0.00 58.87 59.12 2np0 n SER 100 Cb 0.28 -0.57 -0.12 0.00 -0.26 0.00 0.00 64.21 63.54 2np0 n SER 100 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2np0 s LYS 101 N -3.05 0.69 0.21 4.33 1.02 -1.25 -5.07 119.74 116.62 2np0 s LYS 101 Ca 0.10 -0.81 -0.13 0.00 0.02 0.00 0.00 55.97 55.14 2np0 s LYS 101 Cb 0.14 -0.59 0.24 0.00 -0.52 0.00 0.00 37.83 37.10 2np0 s LYS 101 CO 0.42 0.13 1.63 -1.35 -0.92 0.00 0.00 175.35 175.26 2np0 h PRO 102 N 4.53 0.01 -0.60 -1.68 0.11 -1.89 -0.56 132.00 131.92 2np0 h PRO 102 Ca -0.38 -0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.83 2np0 h PRO 102 Cb 1.19 -0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.23 2np0 h PRO 102 CO 0.41 0.01 0.21 1.25 -0.21 0.00 0.00 178.00 179.67 2np0 h LEU 103 N 0.01 0.18 -0.27 2.35 5.85 -1.92 0.32 115.31 121.83 2np0 h LEU 103 Ca 0.30 0.08 -0.21 0.00 0.84 0.00 0.00 57.88 58.90 2np0 h LEU 103 Cb 0.47 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.57 2np0 h LEU 103 CO -0.62 0.11 -0.76 1.23 -0.34 0.00 0.00 178.44 178.06 2np0 h GLY 104 N 0.38 0.69 0.97 3.75 0.00 -1.40 -2.19 103.07 105.26 2np0 h GLY 104 Ca 0.30 -0.97 0.01 0.00 0.00 0.00 0.00 47.33 46.68 2np0 h GLY 104 CO -0.32 0.86 0.50 -2.09 0.00 0.00 0.00 176.54 175.50 2np0 h GLU 105 N 0.43 0.99 -0.03 4.80 4.81 -0.23 -1.89 114.58 123.45 2np0 h GLU 105 Ca -0.04 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.04 2np0 h GLU 105 Cb 1.36 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 2np0 h GLU 105 CO 0.14 0.65 -0.40 0.87 -0.73 0.00 0.00 179.01 179.55 2np0 h LYS 106 N 1.02 0.06 -0.15 1.92 1.57 -0.30 0.30 116.57 120.98 2np0 h LYS 106 Ca 0.29 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2np0 h LYS 106 Cb -0.09 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2np0 h LYS 106 CO -0.07 0.45 0.08 1.25 -0.57 0.00 0.00 179.45 180.59 2np0 h LEU 107 N 0.05 0.20 -0.68 2.94 5.85 -0.79 0.01 115.31 122.89 2np0 h LEU 107 Ca 0.00 -0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 2np0 h LEU 107 Cb 0.73 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 2np0 h LEU 107 CO 0.05 0.24 0.17 -0.07 -0.34 0.00 0.00 178.44 178.50 2np0 h LEU 108 N 0.14 1.02 -0.68 2.25 3.38 -0.68 -1.77 115.31 118.97 2np0 h LEU 108 Ca 0.05 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.72 2np0 h LEU 108 Cb 0.09 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2np0 h LEU 108 CO -0.01 0.99 0.15 -0.33 0.09 0.00 0.00 178.44 179.33 2np0 h GLU 109 N 1.01 1.09 -0.60 1.13 5.08 -0.07 0.17 114.58 122.40 2np0 h GLU 109 Ca 0.21 -0.27 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2np0 h GLU 109 Cb 0.36 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 2np0 h GLU 109 CO 0.00 0.98 0.35 0.52 -1.00 0.00 0.00 179.01 179.86 2np0 h MET 110 N 1.02 0.82 -0.27 2.33 2.86 -0.86 -1.43 114.93 119.40 2np0 h MET 110 Ca 0.21 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.75 2np0 h MET 110 Cb 0.39 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 2np0 h MET 110 CO 0.00 0.59 0.06 0.82 1.06 0.00 0.00 176.91 179.45 2np0 h ILE 111 N 0.81 1.22 -0.95 -1.22 2.04 -0.92 -1.70 117.51 116.79 2np0 h ILE 111 Ca 0.21 -0.72 0.01 0.00 1.00 0.00 0.00 64.86 65.36 2np0 h ILE 111 Cb -0.01 1.18 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 2np0 h ILE 111 CO -0.04 0.23 0.63 0.40 0.00 0.00 0.00 178.15 179.37 2np0 h ILE 112 N 0.26 1.24 -0.02 -0.67 2.04 -0.48 -3.11 117.51 116.78 2np0 h ILE 112 Ca 0.08 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.51 2np0 h ILE 112 Cb 0.30 -0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.23 2np0 h ILE 112 CO 0.00 0.23 -0.10 0.59 0.00 0.00 0.00 178.15 178.87 2np0 n ASN 113 N -4.39 2.08 -3.55 1.72 3.02 -0.56 -4.48 115.26 109.10 2np0 n ASN 113 Ca 0.11 -1.61 -0.41 0.00 -0.03 0.00 0.00 54.58 52.64 2np0 n ASN 113 Cb 0.02 0.09 0.02 0.00 -0.61 0.00 0.00 39.78 39.30 2np0 n ASN 113 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2np0 n GLY 114 N 1.30 6.00 3.72 7.41 0.00 -0.65 -4.88 105.19 118.08 2np0 n GLY 114 Ca 0.15 -2.52 -0.42 0.00 0.00 0.00 0.00 46.02 43.23 2np0 n GLY 114 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2np0 n ILE 115 N 0.06 1.62 -1.67 -0.61 -5.35 -1.26 -4.66 119.36 107.50 2np0 n ILE 115 Ca 0.49 -0.41 -0.41 0.00 -0.27 0.00 0.00 62.75 62.15 2np0 n ILE 115 Cb 0.26 -1.72 0.01 0.00 -1.74 0.00 0.00 39.64 36.45 2np0 n ILE 115 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 2np0 n PRO 116 N 1.10 1.71 -1.69 6.28 -0.02 -1.26 -4.94 135.00 136.17 2np0 n PRO 116 Ca 0.06 0.61 -0.40 0.00 -2.02 0.00 0.00 63.50 61.75 2np0 n PRO 116 Cb 0.36 -2.25 0.03 0.00 -0.02 0.00 0.00 33.50 31.62 2np0 n PRO 116 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 2np0 n TYR 117 N -0.29 1.81 -1.25 6.00 9.36 -0.31 -4.84 117.16 127.64 2np0 n TYR 117 Ca 0.08 0.47 -0.36 0.00 3.32 0.00 0.00 57.90 61.40 2np0 n TYR 117 Cb 0.39 -2.31 -0.02 0.00 -0.63 0.00 0.00 39.34 36.77 2np0 n TYR 117 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2np0 n LEU 118 N -0.34 7.49 0.00 2.98 4.77 -1.26 -4.77 117.00 125.86 2np0 n LEU 118 Ca 0.10 -3.97 0.00 0.00 -0.03 0.00 0.00 56.01 52.11 2np0 n LEU 118 Cb 0.43 -1.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 2np0 n LEU 118 CO 0.55 1.52 0.00 0.61 -1.33 0.00 0.00 177.39 178.74 2np0 n GLY 119 N 3.75 -1.42 0.00 -0.72 0.00 -1.20 -0.04 105.19 105.56 2np0 n GLY 119 Ca 0.66 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 45.46 2np0 n GLY 119 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2np0 n ASP 120 N 2.96 0.00 0.26 1.61 5.68 -1.26 -4.93 116.55 120.87 2np0 n ASP 120 Ca 0.00 -0.38 0.17 0.00 -0.50 0.00 0.00 54.79 54.08 2np0 n ASP 120 Cb 0.00 0.00 0.79 0.00 -1.14 0.00 0.00 41.12 40.77 2np0 n ASP 120 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 2np0 h ARG 121 N 0.00 0.00 0.00 0.11 0.11 -1.97 -1.38 114.38 111.24 2np0 h ARG 121 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2np0 h ARG 121 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2np0 h ARG 121 CO 0.00 0.00 -0.31 0.54 0.10 0.00 0.00 179.97 180.30 2np0 n ARG 122 N -2.86 0.24 -2.94 0.08 1.74 -1.26 -4.88 116.66 106.79 2np0 n ARG 122 Ca -0.00 0.13 -0.40 0.00 -0.77 0.00 0.00 57.85 56.80 2np0 n ARG 122 Cb 0.20 -1.71 -0.04 0.00 -1.02 0.00 0.00 32.46 29.89 2np0 n ARG 122 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2np0 s VAL 123 N -3.12 4.85 0.48 1.55 1.01 -0.52 -5.01 120.40 119.63 2np0 s VAL 123 Ca 0.09 1.68 -0.21 0.00 0.00 0.00 0.00 61.98 63.54 2np0 s VAL 123 Cb 0.14 -4.14 -0.11 0.00 0.00 0.00 0.00 36.38 32.27 2np0 s VAL 123 CO 0.65 0.29 0.65 -2.65 0.00 0.00 0.00 175.10 174.05 2np0 n PRO 124 N 3.32 0.73 0.15 2.72 -0.02 -1.26 -4.86 135.00 135.78 2np0 n PRO 124 Ca -0.00 0.27 0.05 0.00 -2.02 0.00 0.00 63.50 61.80 2np0 n PRO 124 Cb 0.51 -1.71 0.49 0.00 -0.02 0.00 0.00 33.50 32.77 2np0 n PRO 124 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2np0 h LEU 125 N 0.76 0.18 -0.72 2.45 3.38 -1.95 -2.23 115.31 117.18 2np0 h LEU 125 Ca -0.43 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2np0 h LEU 125 Cb 1.38 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.09 2np0 h LEU 125 CO 0.51 0.23 0.00 -0.62 0.09 0.00 0.00 178.44 178.65 2np0 n GLU 126 N -4.41 1.46 -4.34 1.13 4.71 -1.26 -3.50 120.64 114.44 2np0 n GLU 126 Ca -0.01 -0.71 -0.20 0.00 -0.01 0.00 0.00 57.16 56.24 2np0 n GLU 126 Cb 0.16 -1.29 -0.13 0.00 -1.01 0.00 0.00 31.44 29.18 2np0 n GLU 126 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 2np0 s GLU 127 N -1.81 0.92 -0.10 3.49 2.02 -0.84 -1.26 118.70 121.12 2np0 s GLU 127 Ca 0.25 -0.77 -0.08 0.00 0.02 0.00 0.00 54.97 54.38 2np0 s GLU 127 Cb 0.13 -0.93 -0.04 0.00 0.10 0.00 0.00 34.13 33.39 2np0 s GLU 127 CO 0.19 0.23 0.18 -0.06 0.02 0.00 0.00 175.26 175.82 2np0 s PHE 128 N -0.89 3.62 -0.10 1.61 2.99 -0.56 -4.70 117.98 119.95 2np0 s PHE 128 Ca 0.01 0.60 -0.02 0.00 0.00 0.00 0.00 56.93 57.52 2np0 s PHE 128 Cb -0.08 -1.99 0.03 0.00 0.00 0.00 0.00 43.02 40.98 2np0 s PHE 128 CO 0.01 0.72 0.01 1.21 -0.00 0.00 0.00 175.22 177.18 2np0 s ASN 129 N -1.02 1.83 0.08 1.36 2.47 0.94 -2.98 114.94 117.62 2np0 s ASN 129 Ca 0.16 -0.23 0.23 0.00 0.42 0.00 0.00 52.86 53.44 2np0 s ASN 129 Cb -0.13 -0.44 -0.05 0.00 -1.45 0.00 0.00 41.25 39.18 2np0 s ASN 129 CO 0.05 -0.22 0.92 0.35 -3.72 0.00 0.00 177.10 174.48 2np0 n THR 130 N 5.14 0.28 -1.05 -5.21 -2.24 -1.26 -3.21 114.28 106.73 2np0 n THR 130 Ca -0.07 -0.40 -0.19 0.00 -2.27 0.00 0.00 64.05 61.12 2np0 n THR 130 Cb 0.49 -0.01 -0.12 0.00 -2.10 0.00 0.00 70.33 68.59 2np0 n THR 130 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2np0 n ASN 131 N -2.26 6.08 -4.08 3.42 5.15 -1.26 -3.65 115.26 118.66 2np0 n ASN 131 Ca 0.00 -2.48 -0.15 0.00 -0.60 0.00 0.00 54.58 51.36 2np0 n ASN 131 Cb 0.50 -1.42 -0.12 0.00 -0.53 0.00 0.00 39.78 38.22 2np0 n ASN 131 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2np0 s ILE 132 N 1.43 0.69 -0.07 -1.44 -4.36 -1.26 -4.41 121.20 111.77 2np0 s ILE 132 Ca 0.66 -1.09 0.29 0.00 -0.26 0.00 0.00 60.65 60.25 2np0 s ILE 132 Cb 0.27 -0.72 0.31 0.00 1.25 0.00 0.00 42.46 43.57 2np0 s ILE 132 CO -0.02 -0.31 1.88 0.00 0.24 0.00 0.00 174.94 176.74 2np0 h ALA 133 N 4.54 1.00 -0.00 2.27 0.00 -1.80 -1.31 119.26 123.96 2np0 h ALA 133 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2np0 h ALA 133 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2np0 h ALA 133 CO 0.41 0.00 -0.03 -1.13 0.00 0.00 0.00 179.25 178.50 2np0 n SER 134 N -2.60 0.41 0.01 0.00 3.41 -1.26 -4.47 113.62 109.13 2np0 n SER 134 Ca -0.00 -0.86 0.00 0.00 -0.26 0.00 0.00 58.87 57.75 2np0 n SER 134 Cb 0.17 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 2np0 n SER 134 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2np0 n VAL 135 N -0.81 0.23 -4.49 -3.33 0.31 -0.53 -0.54 118.33 109.17 2np0 n VAL 135 Ca 0.19 0.08 -0.34 0.00 -0.01 0.00 0.00 64.34 64.25 2np0 n VAL 135 Cb 0.22 -1.41 -0.11 0.00 -0.91 0.00 0.00 33.84 31.64 2np0 n VAL 135 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2np0 s THR 136 N -2.00 3.96 0.06 2.52 2.01 -0.99 -3.91 115.64 117.29 2np0 s THR 136 Ca 0.00 -0.37 0.07 0.00 0.31 0.00 0.00 61.69 61.70 2np0 s THR 136 Cb 0.00 -2.66 -0.03 0.00 0.01 0.00 0.00 72.50 69.82 2np0 s THR 136 CO 0.00 0.58 -0.20 0.54 -0.69 0.00 0.00 174.62 174.86 2np0 s VAL 137 N -0.63 1.59 0.03 3.82 0.11 -0.21 -4.59 120.40 120.52 2np0 s VAL 137 Ca 0.10 -1.26 -0.15 0.00 -2.93 0.00 0.00 61.98 57.73 2np0 s VAL 137 Cb -0.12 -1.41 -0.06 0.00 -1.53 0.00 0.00 36.38 33.27 2np0 s VAL 137 CO 0.02 0.10 0.45 0.20 -3.33 0.00 0.00 175.10 172.53 2np0 s ASN 138 N -1.38 6.84 -0.08 3.54 0.01 -1.25 -0.03 114.94 122.59 2np0 s ASN 138 Ca 0.06 1.01 0.01 0.00 -0.71 0.00 0.00 52.86 53.23 2np0 s ASN 138 Cb -0.09 -2.27 -0.03 0.00 0.41 0.00 0.00 41.25 39.28 2np0 s ASN 138 CO 0.02 0.28 -0.10 -1.59 -1.51 0.00 0.00 177.10 174.21 2np0 s LYS 139 N -1.24 2.91 -0.43 -0.60 -2.85 0.92 -0.86 119.74 117.59 2np0 s LYS 139 Ca 0.27 -0.62 -0.24 0.00 -1.00 0.00 0.00 55.97 54.39 2np0 s LYS 139 Cb -0.17 -2.57 0.02 0.00 -2.06 0.00 0.00 37.83 33.05 2np0 s LYS 139 CO 0.15 0.51 0.81 -1.17 0.10 0.00 0.00 175.35 175.76 2np0 s LEU 140 N -0.42 4.17 0.00 2.77 2.96 -0.37 -1.05 118.68 126.74 2np0 s LEU 140 Ca 0.06 0.07 0.19 0.00 -0.22 0.00 0.00 54.13 54.23 2np0 s LEU 140 Cb -0.12 -3.02 0.07 0.00 0.50 0.00 0.00 46.19 43.61 2np0 s LEU 140 CO 0.02 -0.88 1.03 2.30 -1.32 0.00 0.00 176.35 177.50 2np0 n ILE 141 N 6.08 0.00 -0.93 6.68 -5.35 0.74 -4.45 119.36 122.14 2np0 n ILE 141 Ca 0.03 -0.39 -0.30 0.00 -0.27 0.00 0.00 62.75 61.82 2np0 n ILE 141 Cb 0.48 1.31 0.16 0.00 -1.74 0.00 0.00 39.64 39.84 2np0 n ILE 141 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2np0 s SER 142 N -1.92 3.10 0.82 7.28 1.04 -1.09 -4.96 113.70 117.97 2np0 s SER 142 Ca 0.19 1.82 -0.12 0.00 0.48 0.00 0.00 55.95 58.32 2np0 s SER 142 Cb 0.16 -2.41 0.08 0.00 0.10 0.00 0.00 66.02 63.95 2np0 s SER 142 CO 0.37 -2.93 1.12 0.20 0.98 0.00 0.00 173.24 172.98 2np0 s ASN 143 N -3.00 4.36 0.35 7.02 0.01 -1.26 -4.95 114.94 117.46 2np0 s ASN 143 Ca 0.65 1.14 -0.29 0.00 -0.71 0.00 0.00 52.86 53.65 2np0 s ASN 143 Cb -0.21 -1.81 -0.11 0.00 0.41 0.00 0.00 41.25 39.53 2np0 s ASN 143 CO 0.58 -2.04 1.46 -2.84 -1.51 0.00 0.00 177.10 172.75 2np0 s PRO 144 N -5.26 4.17 0.00 -0.60 0.02 -1.26 -2.80 135.00 129.27 2np0 s PRO 144 Ca 0.61 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.11 2np0 s PRO 144 Cb -0.14 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.38 2np0 s PRO 144 CO 0.53 -0.46 0.00 0.41 -0.33 0.00 0.00 177.00 177.15 2np0 n GLY 145 N 0.82 1.65 3.99 0.52 0.00 -1.26 -5.03 105.19 105.88 2np0 n GLY 145 Ca 0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.85 2np0 n GLY 145 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2np0 s GLU 146 N -0.37 3.03 0.29 1.61 2.02 -1.12 -5.05 118.70 119.12 2np0 s GLU 146 Ca 0.00 -1.08 -0.30 0.00 0.02 0.00 0.00 54.97 53.61 2np0 s GLU 146 Cb 0.00 -2.79 -0.12 0.00 0.10 0.00 0.00 34.13 31.32 2np0 s GLU 146 CO 0.00 -0.01 1.56 1.33 0.02 0.00 0.00 175.26 178.16 2np0 n VAL 147 N -1.67 1.11 -2.02 2.63 0.24 -1.26 -4.87 118.33 112.49 2np0 n VAL 147 Ca 0.02 -0.28 -0.42 0.00 -2.04 0.00 0.00 64.34 61.62 2np0 n VAL 147 Cb 0.58 -1.89 -0.03 0.00 -1.47 0.00 0.00 33.84 31.04 2np0 n VAL 147 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2np0 s GLU 148 N -0.64 4.25 -0.09 7.34 2.02 -1.26 -4.80 118.70 125.51 2np0 s GLU 148 Ca 0.64 2.26 0.02 0.00 0.02 0.00 0.00 54.97 57.91 2np0 s GLU 148 Cb -0.52 -3.18 0.02 0.00 0.10 0.00 0.00 34.13 30.55 2np0 s GLU 148 CO 0.50 -0.54 -0.12 1.03 0.02 0.00 0.00 175.26 176.15 2np0 s ARG 149 N 0.99 1.86 0.08 1.61 0.52 -1.26 -4.99 118.95 117.76 2np0 s ARG 149 Ca 0.67 -0.44 0.09 0.00 -0.52 0.00 0.00 55.73 55.54 2np0 s ARG 149 Cb -0.41 -1.61 -0.03 0.00 0.52 0.00 0.00 34.95 33.41 2np0 s ARG 149 CO 0.32 -0.06 -0.24 0.15 0.02 0.00 0.00 175.30 175.49 2np0 s LYS 150 N 0.98 1.75 0.13 3.54 1.02 -1.26 -0.18 119.74 125.70 2np0 s LYS 150 Ca -0.08 -1.16 0.05 0.00 0.02 0.00 0.00 55.97 54.80 2np0 s LYS 150 Cb -0.15 -2.02 -0.04 0.00 -0.52 0.00 0.00 37.83 35.10 2np0 s LYS 150 CO -0.00 0.50 -0.12 0.15 -0.92 0.00 0.00 175.35 174.95 2np0 s LYS 151 N -1.61 1.00 -0.03 1.68 -0.14 -0.21 -4.70 119.74 115.73 2np0 s LYS 151 Ca 0.14 -1.30 -0.02 0.00 -1.36 0.00 0.00 55.97 53.43 2np0 s LYS 151 Cb -0.10 -0.74 -0.04 0.00 -1.68 0.00 0.00 37.83 35.27 2np0 s LYS 151 CO 0.05 0.12 0.10 0.20 -0.76 0.00 0.00 175.35 175.06 2np0 s GLY 152 N -2.70 2.06 0.03 -3.33 0.00 -1.12 -0.05 107.32 102.21 2np0 s GLY 152 Ca 0.11 -0.81 0.08 0.00 0.00 0.00 0.00 44.72 44.10 2np0 s GLY 152 CO 0.02 -0.65 -0.22 -0.26 0.00 0.00 0.00 173.10 171.98 2np0 s ILE 153 N -1.17 1.80 0.22 0.90 -4.36 0.96 -0.67 121.20 118.88 2np0 s ILE 153 Ca 0.22 -1.20 -0.30 0.00 -0.26 0.00 0.00 60.65 59.11 2np0 s ILE 153 Cb -0.12 -1.54 -0.09 0.00 1.25 0.00 0.00 42.46 41.96 2np0 s ILE 153 CO 0.12 0.30 1.18 -0.36 0.24 0.00 0.00 174.94 176.42 2np0 s PHE 154 N -0.75 3.44 0.09 1.37 2.99 0.80 -1.05 117.98 124.88 2np0 s PHE 154 Ca 0.09 1.50 -0.03 0.00 0.00 0.00 0.00 56.93 58.49 2np0 s PHE 154 Cb -0.09 -3.41 -0.03 0.00 0.00 0.00 0.00 43.02 39.49 2np0 s PHE 154 CO 0.01 -1.07 0.06 0.00 -0.00 0.00 0.00 175.22 174.22 2np0 s ALA 155 N -0.43 0.45 -0.09 5.36 0.00 -1.25 -4.85 121.76 120.95 2np0 s ALA 155 Ca 0.50 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 51.30 2np0 s ALA 155 Cb -0.33 0.54 -0.06 0.00 0.00 0.00 0.00 23.12 23.27 2np0 s ALA 155 CO 0.39 -0.45 -0.08 0.09 0.00 0.00 0.00 175.76 175.71 2np0 n ASN 156 N -0.01 3.24 -3.82 0.00 4.13 -0.18 -4.48 115.26 114.14 2np0 n ASN 156 Ca -0.11 -0.04 -0.13 0.00 1.68 0.00 0.00 54.58 55.98 2np0 n ASN 156 Cb 0.62 -0.14 -0.13 0.00 -1.54 0.00 0.00 39.78 38.59 2np0 n ASN 156 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2np0 s LEU 157 N -5.54 1.41 -0.12 3.41 2.96 -0.91 -0.61 118.68 119.27 2np0 s LEU 157 Ca -0.12 0.24 0.02 0.00 -0.22 0.00 0.00 54.13 54.05 2np0 s LEU 157 Cb 0.03 0.39 0.02 0.00 0.50 0.00 0.00 46.19 47.12 2np0 s LEU 157 CO 0.20 -0.06 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.38 2np0 s ILE 158 N 0.27 1.58 -0.25 6.68 1.01 -0.21 -1.12 121.20 129.16 2np0 s ILE 158 Ca -0.02 -0.68 -0.07 0.00 0.00 0.00 0.00 60.65 59.88 2np0 s ILE 158 Cb -0.03 -1.44 -0.03 0.00 0.01 0.00 0.00 42.46 40.97 2np0 s ILE 158 CO -0.01 0.46 0.07 -0.63 0.00 0.00 0.00 174.94 174.83 2np0 s ILE 159 N 1.04 4.34 0.41 2.92 1.01 0.11 -1.01 121.20 130.02 2np0 s ILE 159 Ca -0.05 -0.16 0.07 0.00 0.00 0.00 0.00 60.65 60.51 2np0 s ILE 159 Cb -0.15 -3.03 0.01 0.00 0.01 0.00 0.00 42.46 39.30 2np0 s ILE 159 CO -0.03 0.34 0.56 -0.36 0.00 0.00 0.00 174.94 175.46 2np0 s PHE 160 N 1.55 2.89 1.15 3.97 0.40 0.23 -1.17 117.98 127.00 2np0 s PHE 160 Ca 0.06 -0.33 -0.19 0.00 -0.60 0.00 0.00 56.93 55.88 2np0 s PHE 160 Cb -0.15 -2.32 0.27 0.00 0.51 0.00 0.00 43.02 41.33 2np0 s PHE 160 CO 0.04 -0.36 1.16 0.20 0.70 0.00 0.00 175.22 176.96 2np0 s GLY 161 N -4.31 1.63 0.84 4.36 0.00 -0.33 -1.52 107.32 107.99 2np0 s GLY 161 Ca 0.53 -1.01 -0.11 0.00 0.00 0.00 0.00 44.72 44.12 2np0 s GLY 161 CO 0.33 -0.15 1.15 2.56 0.00 0.00 0.00 173.10 176.99 2np0 s PRO 162 N -5.52 1.51 0.00 2.90 0.04 -1.09 -3.27 135.00 129.57 2np0 s PRO 162 Ca 0.72 1.53 0.00 0.00 0.04 0.00 0.00 61.00 63.29 2np0 s PRO 162 Cb -0.08 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.67 2np0 s PRO 162 CO 0.55 -2.26 0.00 0.41 0.04 0.00 0.00 177.00 175.74 2np0 n GLY 163 N 0.00 0.13 0.36 0.56 0.00 -1.26 -1.58 105.19 103.39 2np0 n GLY 163 Ca 0.12 -1.58 0.06 0.00 0.00 0.00 0.00 46.02 44.62 2np0 n GLY 163 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2np0 h PRO 164 N 0.00 0.82 -4.21 1.61 0.11 -1.88 -3.36 132.00 125.10 2np0 h PRO 164 Ca 0.00 -0.05 -0.75 0.00 0.11 0.00 0.00 66.00 65.31 2np0 h PRO 164 Cb 0.00 -0.19 -0.23 0.00 0.11 0.00 0.00 31.00 30.69 2np0 h PRO 164 CO 0.00 0.54 -0.20 0.08 -0.21 0.00 0.00 178.00 178.21 2np0 s VAL 165 N -5.76 5.17 0.21 3.15 1.01 -1.26 -4.36 120.40 118.57 2np0 s VAL 165 Ca -0.10 -1.35 -0.09 0.00 0.00 0.00 0.00 61.98 60.44 2np0 s VAL 165 Cb 0.20 -4.31 0.15 0.00 0.00 0.00 0.00 36.38 32.42 2np0 s VAL 165 CO 0.78 -0.84 1.76 -0.07 0.00 0.00 0.00 175.10 176.74 2np0 h LEU 166 N 8.98 0.34 -0.24 3.92 4.07 -1.51 -2.10 115.31 128.77 2np0 h LEU 166 Ca -0.30 0.06 0.00 0.00 0.08 0.00 0.00 57.88 57.73 2np0 h LEU 166 Cb 1.10 0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.86 2np0 h LEU 166 CO 1.01 0.20 0.00 -0.46 -1.08 0.00 0.00 178.44 178.11 2np0 n ASN 167 N -4.93 0.37 -4.29 -0.43 6.94 -1.26 -4.39 115.26 107.27 2np0 n ASN 167 Ca 0.09 -1.24 -0.44 0.00 -0.02 0.00 0.00 54.58 52.97 2np0 n ASN 167 Cb 0.26 -0.01 -0.03 0.00 -2.36 0.00 0.00 39.78 37.64 2np0 n ASN 167 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 2np0 s GLU 168 N -1.98 3.65 0.50 -3.83 2.12 -0.79 -4.90 118.70 113.47 2np0 s GLU 168 Ca 0.40 -2.77 -0.20 0.00 0.36 0.00 0.00 54.97 52.76 2np0 s GLU 168 Cb 0.19 -4.35 -0.08 0.00 0.26 0.00 0.00 34.13 30.15 2np0 s GLU 168 CO 0.32 -1.26 1.04 -0.80 -0.54 0.00 0.00 175.26 174.02 2np0 s ASN 169 N 1.55 6.29 -0.26 -1.70 0.01 -1.26 -4.86 114.94 114.71 2np0 s ASN 169 Ca 0.23 1.91 -0.19 0.00 -0.71 0.00 0.00 52.86 54.10 2np0 s ASN 169 Cb -0.11 -2.56 0.07 0.00 0.41 0.00 0.00 41.25 39.07 2np0 s ASN 169 CO -0.08 -0.81 0.65 -0.70 -1.51 0.00 0.00 177.10 174.64 2np0 s GLU 170 N -3.32 0.71 -0.14 -0.60 2.12 -0.86 -5.00 118.70 111.62 2np0 s GLU 170 Ca 0.67 1.05 -0.05 0.00 0.36 0.00 0.00 54.97 56.99 2np0 s GLU 170 Cb -0.16 0.24 -0.04 0.00 0.26 0.00 0.00 34.13 34.43 2np0 s GLU 170 CO 0.22 -0.12 0.05 0.99 -0.54 0.00 0.00 175.26 175.85 2np0 s THR 171 N 1.02 4.69 -0.01 -1.70 2.01 -1.26 -1.05 115.64 119.34 2np0 s THR 171 Ca -0.05 -0.08 0.03 0.00 0.31 0.00 0.00 61.69 61.90 2np0 s THR 171 Cb -0.05 -3.06 -0.01 0.00 0.01 0.00 0.00 72.50 69.40 2np0 s THR 171 CO -0.10 0.54 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.63 2np0 s ILE 172 N -0.26 0.90 0.35 1.82 1.01 0.96 -5.00 121.20 120.99 2np0 s ILE 172 Ca 0.08 -0.48 0.08 0.00 0.00 0.00 0.00 60.65 60.33 2np0 s ILE 172 Cb -0.12 -0.76 -0.05 0.00 0.01 0.00 0.00 42.46 41.54 2np0 s ILE 172 CO 0.02 0.26 0.10 1.51 0.00 0.00 0.00 174.94 176.83 2np0 s ASP 173 N -0.19 4.47 -0.36 3.58 -4.77 -1.26 -1.77 116.67 116.36 2np0 s ASP 173 Ca 0.03 -0.89 -0.16 0.00 -3.30 0.00 0.00 52.55 48.23 2np0 s ASP 173 Cb -0.05 -0.62 -0.01 0.00 -1.09 0.00 0.00 42.92 41.15 2np0 s ASP 173 CO -0.00 -0.31 0.37 -0.63 0.70 0.00 0.00 175.17 175.30 2np0 s ILE 174 N -2.48 5.16 -0.11 2.11 1.01 -1.26 -5.02 121.20 120.60 2np0 s ILE 174 Ca 0.37 -0.03 -0.14 0.00 0.00 0.00 0.00 60.65 60.84 2np0 s ILE 174 Cb -0.01 -3.86 -0.05 0.00 0.01 0.00 0.00 42.46 38.55 2np0 s ILE 174 CO 0.21 -0.15 0.35 -0.83 0.00 0.00 0.00 174.94 174.52 2np0 s GLY 175 N 1.74 2.31 -0.06 6.18 0.00 -1.26 -4.24 107.32 112.00 2np0 s GLY 175 Ca 0.12 -0.35 0.04 0.00 0.00 0.00 0.00 44.72 44.53 2np0 s GLY 175 CO 0.12 0.38 -0.19 -0.42 0.00 0.00 0.00 173.10 172.98 2np0 s ILE 176 N 0.01 1.64 -1.76 0.90 1.01 -0.41 -0.30 121.20 122.29 2np0 s ILE 176 Ca 0.20 -0.81 -0.16 0.00 0.00 0.00 0.00 60.65 59.88 2np0 s ILE 176 Cb -0.14 -1.42 0.16 0.00 0.01 0.00 0.00 42.46 41.07 2np0 s ILE 176 CO 0.08 0.47 0.47 0.00 0.00 0.00 0.00 174.94 175.95 2np0 n GLN 177 N 3.29 -1.23 -1.00 2.79 6.02 -1.26 -1.62 117.38 124.37 2np0 n GLN 177 Ca -0.19 0.17 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 2np0 n GLN 177 Cb 0.53 -4.48 0.00 0.00 1.02 0.00 0.00 30.24 27.30 2np0 n GLN 177 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2np0 n ASN 178 N -2.62 -2.96 -4.33 1.08 2.85 -1.26 -5.00 115.26 103.02 2np0 n ASN 178 Ca -0.02 0.00 -0.18 0.00 -0.11 0.00 0.00 54.58 54.27 2np0 n ASN 178 Cb 0.53 -0.71 -0.10 0.00 1.24 0.00 0.00 39.78 40.74 2np0 n ASN 178 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 2np0 s HIS 179 N -2.08 1.65 -0.22 1.20 3.76 -0.64 -5.11 115.29 113.85 2np0 s HIS 179 Ca 0.00 -0.58 0.01 0.00 -0.15 0.00 0.00 55.06 54.34 2np0 s HIS 179 Cb 0.00 -0.79 0.05 0.00 1.11 0.00 0.00 32.58 32.96 2np0 s HIS 179 CO 0.00 0.31 -0.09 -0.06 -0.85 0.00 0.00 174.74 174.05 2np0 s PHE 180 N -2.83 2.56 0.36 1.40 0.40 -1.26 -1.29 117.98 117.31 2np0 s PHE 180 Ca 0.20 -1.77 0.09 0.00 -0.60 0.00 0.00 56.93 54.85 2np0 s PHE 180 Cb -0.01 -1.67 0.83 0.00 0.51 0.00 0.00 43.02 42.68 2np0 s PHE 180 CO 0.06 -0.78 1.86 0.00 0.70 0.00 0.00 175.22 177.06 2np0 h ALA 181 N 7.93 1.85 0.00 5.36 0.00 -1.87 -0.07 119.26 132.46 2np0 h ALA 181 Ca -0.23 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2np0 h ALA 181 Cb 1.08 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2np0 h ALA 181 CO 0.45 -0.10 0.00 -1.13 0.00 0.00 0.00 179.25 178.47 2np0 n SER 182 N -4.57 0.00 -0.64 0.00 3.41 -1.26 -1.53 113.62 109.02 2np0 n SER 182 Ca 0.18 -0.58 0.06 0.00 -0.26 0.00 0.00 58.87 58.26 2np0 n SER 182 Cb 0.49 -0.09 0.16 0.00 -0.26 0.00 0.00 64.21 64.51 2np0 n SER 182 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2np0 n ARG 183 N -1.09 2.88 -1.26 4.33 1.74 -0.05 -3.02 116.66 120.19 2np0 n ARG 183 Ca 0.17 -2.13 0.04 0.00 -0.77 0.00 0.00 57.85 55.16 2np0 n ARG 183 Cb 0.12 -1.33 0.03 0.00 -1.02 0.00 0.00 32.46 30.27 2np0 n ARG 183 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2np0 n GLU 184 N 0.35 0.10 0.00 5.56 1.02 -0.89 -4.61 120.64 122.18 2np0 n GLU 184 Ca 0.12 -1.91 0.00 0.00 -0.02 0.00 0.00 57.16 55.35 2np0 n GLU 184 Cb 0.48 -0.19 0.00 0.00 -0.02 0.00 0.00 31.44 31.70 2np0 n GLU 184 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2np0 n GLY 185 N 0.30 3.25 0.13 0.62 0.00 0.02 -4.86 105.19 104.65 2np0 n GLY 185 Ca 0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 2np0 n GLY 185 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2np0 h PHE 186 N 0.00 0.75 -0.76 1.61 -1.00 -1.76 -3.40 116.94 112.38 2np0 h PHE 186 Ca 0.00 -0.54 0.08 0.00 2.81 0.00 0.00 57.97 60.32 2np0 h PHE 186 Cb 0.00 -0.03 -0.04 0.00 3.61 0.00 0.00 35.95 39.49 2np0 h PHE 186 CO 0.00 1.46 -0.22 0.41 -1.61 0.00 0.00 178.31 178.34 2np0 n GLY 187 N 1.71 -2.29 3.82 -1.45 0.00 -0.58 -1.16 105.19 105.24 2np0 n GLY 187 Ca -0.16 -1.40 -0.06 0.00 0.00 0.00 0.00 46.02 44.40 2np0 n GLY 187 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2np0 s GLY 188 N -5.29 0.04 0.02 -0.02 0.00 -1.25 -4.26 107.32 96.57 2np0 s GLY 188 Ca 0.00 -0.35 -0.35 0.00 0.00 0.00 0.00 44.72 44.02 2np0 s GLY 188 CO 0.00 0.22 1.69 1.39 0.00 0.00 0.00 173.10 176.40 2np0 n ILE 189 N -0.52 0.26 -3.93 0.90 5.41 0.30 -4.63 119.36 117.16 2np0 n ILE 189 Ca -0.06 -0.05 -0.32 0.00 1.00 0.00 0.00 62.75 63.33 2np0 n ILE 189 Cb 0.60 -1.58 -0.04 0.00 -0.71 0.00 0.00 39.64 37.91 2np0 n ILE 189 CO 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 176.55 176.51 2np0 s MET 190 N 2.35 3.41 0.05 0.38 -1.94 0.22 -4.31 119.30 119.44 2np0 s MET 190 Ca 0.86 -0.42 0.05 0.00 -1.71 0.00 0.00 55.69 54.48 2np0 s MET 190 Cb -0.74 -3.04 -0.02 0.00 2.01 0.00 0.00 34.83 33.04 2np0 s MET 190 CO 0.46 0.63 -0.14 -0.65 -0.01 0.00 0.00 175.02 175.31 2np0 s GLN 191 N -2.33 0.93 0.01 2.03 -0.21 -0.73 -1.04 119.66 118.33 2np0 s GLN 191 Ca 0.32 -0.80 0.02 0.00 0.02 0.00 0.00 55.36 54.92 2np0 s GLN 191 Cb -0.13 -0.95 -0.01 0.00 1.00 0.00 0.00 33.01 32.92 2np0 s GLN 191 CO 0.25 0.23 -0.06 1.41 -2.12 0.00 0.00 175.29 175.00 2np0 s MET 192 N -1.25 0.48 -0.14 2.91 1.75 -0.18 -0.03 119.30 122.83 2np0 s MET 192 Ca 0.01 -0.41 0.02 0.00 -1.25 0.00 0.00 55.69 54.06 2np0 s MET 192 Cb -0.08 -0.38 0.01 0.00 2.84 0.00 0.00 34.83 37.21 2np0 s MET 192 CO 0.01 0.09 -0.20 -1.59 -0.65 0.00 0.00 175.02 172.69 2np0 s LYS 193 N -0.68 3.08 -0.01 4.11 -2.85 -0.22 0.75 119.74 123.93 2np0 s LYS 193 Ca -0.02 -0.82 -0.06 0.00 -1.00 0.00 0.00 55.97 54.06 2np0 s LYS 193 Cb -0.05 -2.49 0.00 0.00 -2.06 0.00 0.00 37.83 33.23 2np0 s LYS 193 CO 0.00 0.00 0.13 0.12 0.10 0.00 0.00 175.35 175.70 2np0 s PHE 194 N 0.80 0.02 -0.09 1.78 5.36 -0.57 -2.02 117.98 123.26 2np0 s PHE 194 Ca -0.07 -0.06 -0.03 0.00 -0.96 0.00 0.00 56.93 55.81 2np0 s PHE 194 Cb -0.16 -0.04 0.04 0.00 -0.34 0.00 0.00 43.02 42.53 2np0 s PHE 194 CO -0.01 -0.24 0.08 0.00 -1.46 0.00 0.00 175.22 173.59 2np0 h PRO 196 N 8.43 0.00 0.00 0.00 0.13 -1.96 -3.37 132.00 135.23 2np0 h PRO 196 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 2np0 h PRO 196 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2np0 h PRO 196 CO 0.19 0.68 -1.37 0.39 -0.23 0.00 0.00 178.00 177.66 2np0 n GLU 197 N -3.31 0.41 -3.29 0.86 4.71 -1.26 -4.66 120.64 114.10 2np0 n GLU 197 Ca 0.01 -0.06 -0.46 0.00 -0.01 0.00 0.00 57.16 56.64 2np0 n GLU 197 Cb 0.79 -1.58 -0.03 0.00 -1.01 0.00 0.00 31.44 29.61 2np0 n GLU 197 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 2np0 s TYR 198 N -3.30 3.48 0.15 -0.32 1.51 -1.26 -0.25 117.35 117.36 2np0 s TYR 198 Ca -0.00 -1.62 0.04 0.00 -1.01 0.00 0.00 57.07 54.48 2np0 s TYR 198 Cb 0.14 -3.85 -0.04 0.00 -0.11 0.00 0.00 41.96 38.10 2np0 s TYR 198 CO 0.85 -1.05 0.15 0.14 -1.11 0.00 0.00 175.55 174.53 2np0 s VAL 199 N 1.02 4.63 0.60 0.71 -7.23 -0.77 -4.50 120.40 114.85 2np0 s VAL 199 Ca 0.12 -0.97 -0.16 0.00 -1.81 0.00 0.00 61.98 59.17 2np0 s VAL 199 Cb -0.19 -3.34 -0.03 0.00 0.56 0.00 0.00 36.38 33.38 2np0 s VAL 199 CO -0.03 -0.07 1.07 -0.94 -0.31 0.00 0.00 175.10 174.82 2np0 s SER 200 N -3.00 5.67 0.07 4.85 1.04 -1.26 -2.21 113.70 118.86 2np0 s SER 200 Ca 0.31 1.87 0.09 0.00 0.48 0.00 0.00 55.95 58.71 2np0 s SER 200 Cb -0.11 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.44 2np0 s SER 200 CO 0.24 -1.24 -0.25 -0.69 0.98 0.00 0.00 173.24 172.28 2np0 s VAL 201 N -2.38 2.31 0.19 5.02 1.01 -1.26 -1.79 120.40 123.50 2np0 s VAL 201 Ca 0.65 -1.48 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 2np0 s VAL 201 Cb -0.17 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.24 2np0 s VAL 201 CO 0.37 0.26 0.33 0.72 0.00 0.00 0.00 175.10 176.78 2np0 s PHE 202 N -0.92 0.45 0.37 5.22 -0.12 -0.33 -2.52 117.98 120.13 2np0 s PHE 202 Ca 0.13 -0.80 0.03 0.00 -0.05 0.00 0.00 56.93 56.25 2np0 s PHE 202 Cb -0.10 -0.03 -0.04 0.00 -0.63 0.00 0.00 43.02 42.22 2np0 s PHE 202 CO 0.04 -0.79 0.10 1.21 -0.05 0.00 0.00 175.22 175.73 2np0 s ASN 203 N -3.00 2.54 -0.48 1.98 2.47 -1.26 0.98 114.94 118.17 2np0 s ASN 203 Ca 0.21 -1.55 0.07 0.00 0.42 0.00 0.00 52.86 52.01 2np0 s ASN 203 Cb 0.03 0.28 0.38 0.00 -1.45 0.00 0.00 41.25 40.48 2np0 s ASN 203 CO 0.03 -0.80 0.97 -0.46 -3.72 0.00 0.00 177.10 173.12 2np0 n ASN 204 N -1.02 3.79 0.25 -4.21 6.94 -1.26 -4.79 115.26 114.95 2np0 n ASN 204 Ca -0.04 -3.51 0.12 0.00 -0.02 0.00 0.00 54.58 51.13 2np0 n ASN 204 Cb 0.66 -0.53 0.76 0.00 -2.36 0.00 0.00 39.78 38.30 2np0 n ASN 204 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 2np0 h VAL 205 N 2.59 0.76 -0.13 3.53 2.07 -1.98 -3.14 116.25 119.96 2np0 h VAL 205 Ca 0.16 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.68 2np0 h VAL 205 Cb 0.77 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2np0 h VAL 205 CO 0.76 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.35 2np0 n GLN 206 N -4.21 2.32 -4.73 1.57 0.00 -1.26 -4.80 117.38 106.27 2np0 n GLN 206 Ca -0.02 -2.00 -0.31 0.00 0.00 0.00 0.00 57.00 54.68 2np0 n GLN 206 Cb 0.15 -1.47 -0.13 0.00 0.00 0.00 0.00 30.24 28.79 2np0 n GLN 206 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.06 175.23 2np0 s GLU 207 N -1.82 1.97 0.06 2.61 -1.05 -1.19 -5.02 118.70 114.26 2np0 s GLU 207 Ca 0.30 -1.03 -0.07 0.00 -0.15 0.00 0.00 54.97 54.02 2np0 s GLU 207 Cb 0.20 -2.12 -0.05 0.00 -0.44 0.00 0.00 34.13 31.73 2np0 s GLU 207 CO 0.30 0.53 0.33 -0.80 0.95 0.00 0.00 175.26 176.57 2np0 s ASN 208 N -1.39 6.54 -0.59 0.83 0.01 -1.26 -4.72 114.94 114.36 2np0 s ASN 208 Ca 0.14 0.63 0.00 0.00 -0.71 0.00 0.00 52.86 52.91 2np0 s ASN 208 Cb -0.10 -2.11 0.00 0.00 0.41 0.00 0.00 41.25 39.44 2np0 s ASN 208 CO 0.04 0.19 0.00 2.29 -1.51 0.00 0.00 177.10 178.11 2np0 n LYS 209 N 0.82 -2.27 0.00 -0.60 2.85 -1.26 -4.82 118.16 112.89 2np0 n LYS 209 Ca -0.08 0.33 0.00 0.00 -1.05 0.00 0.00 58.31 57.51 2np0 n LYS 209 Cb 0.52 -4.79 0.00 0.00 -0.65 0.00 0.00 35.03 30.11 2np0 n LYS 209 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2np0 n GLY 210 N -0.54 2.01 3.42 2.58 0.00 -1.26 -4.88 105.19 106.52 2np0 n GLY 210 Ca -0.08 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.96 2np0 n GLY 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2np0 s ALA 211 N -1.00 -2.56 0.50 4.61 0.00 -1.26 -4.97 121.76 117.08 2np0 s ALA 211 Ca 0.00 2.05 0.41 0.00 0.00 0.00 0.00 51.96 54.42 2np0 s ALA 211 Cb 0.00 -2.03 1.61 0.00 0.00 0.00 0.00 23.12 22.70 2np0 s ALA 211 CO 0.00 -1.03 1.58 1.03 0.00 0.00 0.00 175.76 177.34 2np0 h SER 212 N 7.73 0.11 0.00 0.00 0.87 -1.99 -3.39 113.55 116.88 2np0 h SER 212 Ca -0.17 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 2np0 h SER 212 Cb 1.12 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2np0 h SER 212 CO 0.09 -0.13 -0.00 2.30 -0.53 0.00 0.00 176.83 178.55 2np0 n ILE 213 N -4.36 0.09 -0.63 2.23 -5.35 -1.26 -5.03 119.36 105.06 2np0 n ILE 213 Ca 0.42 0.03 0.08 0.00 -0.27 0.00 0.00 62.75 63.01 2np0 n ILE 213 Cb 1.76 -0.59 0.36 0.00 -1.74 0.00 0.00 39.64 39.44 2np0 n ILE 213 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2np0 n PHE 214 N -3.46 1.69 -2.51 4.28 3.01 -1.26 -4.90 117.46 114.31 2np0 n PHE 214 Ca 0.00 -0.62 -0.31 0.00 1.01 0.00 0.00 57.45 57.53 2np0 n PHE 214 Cb 0.00 -0.36 -0.03 0.00 -0.01 0.00 0.00 39.48 39.08 2np0 n PHE 214 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2np0 s ASN 215 N -0.79 6.54 -0.66 4.37 4.22 -1.26 -3.61 114.94 123.74 2np0 s ASN 215 Ca 0.50 1.39 0.05 0.00 -2.14 0.00 0.00 52.86 52.65 2np0 s ASN 215 Cb 0.35 -2.43 0.16 0.00 1.28 0.00 0.00 41.25 40.61 2np0 s ASN 215 CO 0.19 -0.55 0.44 -0.13 -2.04 0.00 0.00 177.10 175.01 2np0 s ARG 216 N -4.11 2.36 0.00 3.55 0.52 -1.26 -5.00 118.95 115.01 2np0 s ARG 216 Ca 0.56 -3.15 0.22 0.00 -0.52 0.00 0.00 55.73 52.83 2np0 s ARG 216 Cb -0.10 -3.41 0.28 0.00 0.52 0.00 0.00 34.95 32.24 2np0 s ARG 216 CO 0.34 -1.24 1.27 0.54 0.02 0.00 0.00 175.30 176.23 2np0 n ARG 217 N 2.29 2.22 0.00 3.54 5.12 -1.24 -4.81 116.66 123.78 2np0 n ARG 217 Ca 0.16 -2.00 0.00 0.00 -1.93 0.00 0.00 57.85 54.08 2np0 n ARG 217 Cb 0.34 -1.45 0.00 0.00 -1.16 0.00 0.00 32.46 30.20 2np0 n ARG 217 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2np0 n GLY 218 N 1.30 1.73 3.10 -0.13 0.00 -1.26 -4.55 105.19 105.37 2np0 n GLY 218 Ca 0.15 -1.57 -0.18 0.00 0.00 0.00 0.00 46.02 44.42 2np0 n GLY 218 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2np0 s TYR 219 N -1.31 0.99 0.21 1.61 1.51 0.28 -0.90 117.35 119.74 2np0 s TYR 219 Ca 0.00 -0.36 0.05 0.00 -1.01 0.00 0.00 57.07 55.74 2np0 s TYR 219 Cb 0.00 -0.59 -0.03 0.00 -0.11 0.00 0.00 41.96 41.23 2np0 s TYR 219 CO 0.00 0.00 0.28 -0.59 -1.11 0.00 0.00 175.55 174.13 2np0 s PHE 220 N -0.92 3.36 0.21 2.71 -0.12 -0.34 -1.19 117.98 121.68 2np0 s PHE 220 Ca -0.01 0.00 -0.09 0.00 -0.05 0.00 0.00 56.93 56.78 2np0 s PHE 220 Cb -0.08 -1.56 -0.07 0.00 -0.63 0.00 0.00 43.02 40.69 2np0 s PHE 220 CO 0.01 0.49 0.52 -1.12 -0.05 0.00 0.00 175.22 175.06 2np0 s SER 221 N -3.62 6.61 -0.32 1.98 0.01 -0.74 -4.80 113.70 112.82 2np0 s SER 221 Ca 0.34 0.87 -0.25 0.00 1.31 0.00 0.00 55.95 58.21 2np0 s SER 221 Cb -0.09 -2.21 0.01 0.00 0.21 0.00 0.00 66.02 63.94 2np0 s SER 221 CO 0.27 -0.04 0.89 -0.62 0.41 0.00 0.00 173.24 174.16 2np0 s ASP 222 N -2.32 6.75 0.51 2.44 -1.08 -1.26 -4.85 116.67 116.85 2np0 s ASP 222 Ca 0.46 0.77 0.35 0.00 -0.52 0.00 0.00 52.55 53.60 2np0 s ASP 222 Cb -0.12 -2.46 1.80 0.00 -1.46 0.00 0.00 42.92 40.69 2np0 s ASP 222 CO 0.21 -0.72 2.05 1.55 0.52 0.00 0.00 175.17 178.78 2np0 h PRO 223 N 8.15 0.00 -0.87 4.34 0.13 -1.97 0.34 132.00 142.13 2np0 h PRO 223 Ca -0.23 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.88 2np0 h PRO 223 Cb 1.08 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.17 2np0 h PRO 223 CO 0.94 0.00 0.48 0.00 -0.23 0.00 0.00 178.00 179.19 2np0 h ALA 224 N 2.02 1.11 -0.15 -0.56 0.00 -1.92 0.22 119.26 119.98 2np0 h ALA 224 Ca 0.00 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.57 2np0 h ALA 224 Cb 0.10 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 17.55 2np0 h ALA 224 CO 0.00 0.62 -0.75 1.25 0.00 0.00 0.00 179.25 180.36 2np0 h LEU 225 N 1.21 0.86 -0.54 0.00 5.85 -0.73 -0.70 115.31 121.26 2np0 h LEU 225 Ca 0.31 -0.56 0.01 0.00 0.84 0.00 0.00 57.88 58.48 2np0 h LEU 225 Cb 0.02 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 2np0 h LEU 225 CO -0.05 1.34 0.35 0.40 -0.34 0.00 0.00 178.44 180.14 2np0 h ILE 226 N 0.50 1.11 0.05 4.05 2.04 -1.30 -0.32 117.51 123.64 2np0 h ILE 226 Ca -0.04 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 2np0 h ILE 226 Cb 1.37 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 2np0 h ILE 226 CO 0.15 0.13 -0.02 0.25 0.00 0.00 0.00 178.15 178.66 2np0 h LEU 227 N 0.71 -0.05 -1.78 1.44 5.85 -0.83 -2.64 115.31 118.00 2np0 h LEU 227 Ca 0.21 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 2np0 h LEU 227 Cb -0.05 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 2np0 h LEU 227 CO -0.06 -0.03 -0.10 0.24 -0.34 0.00 0.00 178.44 178.14 2np0 h MET 228 N -0.07 0.01 -0.49 1.25 2.86 -0.82 0.73 114.93 118.39 2np0 h MET 228 Ca -0.01 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2np0 h MET 228 Cb 0.06 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 2np0 h MET 228 CO 0.01 0.11 0.15 1.25 1.06 0.00 0.00 176.91 179.49 2np0 h HIS 229 N 0.01 0.80 -0.11 -0.22 -0.00 -0.72 -0.59 115.15 114.32 2np0 h HIS 229 Ca 0.00 -0.08 -0.13 0.00 -0.00 0.00 0.00 60.37 60.16 2np0 h HIS 229 Cb 0.19 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.36 2np0 h HIS 229 CO 0.00 0.70 -0.51 0.93 -0.00 0.00 0.00 177.93 179.04 2np0 h GLU 230 N 0.67 0.29 -0.13 5.26 4.39 -1.05 -2.86 114.58 121.14 2np0 h GLU 230 Ca 0.16 -0.17 -0.07 0.00 0.34 0.00 0.00 59.36 59.62 2np0 h GLU 230 Cb 0.28 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 2np0 h GLU 230 CO -0.00 0.73 -0.23 -0.07 -1.16 0.00 0.00 179.01 178.28 2np0 h LEU 231 N 0.23 0.22 -0.65 1.33 3.38 -0.33 -1.75 115.31 117.74 2np0 h LEU 231 Ca 0.01 -0.06 0.07 0.00 0.09 0.00 0.00 57.88 57.99 2np0 h LEU 231 Cb 0.98 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.61 2np0 h LEU 231 CO 0.08 0.46 0.33 0.40 0.09 0.00 0.00 178.44 179.80 2np0 h ILE 232 N 0.21 0.90 -0.49 1.22 2.04 -0.89 0.24 117.51 120.74 2np0 h ILE 232 Ca 0.04 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 2np0 h ILE 232 Cb 0.52 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 2np0 h ILE 232 CO 0.04 0.11 0.26 0.45 0.00 0.00 0.00 178.15 179.01 2np0 h HIS 233 N 0.60 0.69 -0.41 1.37 3.86 -1.32 -1.25 115.15 118.68 2np0 h HIS 233 Ca 0.30 -0.02 0.08 0.00 -1.16 0.00 0.00 60.37 59.57 2np0 h HIS 233 Cb 0.26 -0.22 -0.07 0.00 1.06 0.00 0.00 27.41 28.44 2np0 h HIS 233 CO -0.10 0.52 0.01 0.28 0.86 0.00 0.00 177.93 179.49 2np0 h VAL 234 N 0.65 0.69 -0.33 2.45 2.07 -0.72 -0.71 116.25 120.36 2np0 h VAL 234 Ca 0.17 -0.04 0.07 0.00 0.82 0.00 0.00 66.70 67.73 2np0 h VAL 234 Cb 0.07 0.57 -0.08 0.00 -1.52 0.00 0.00 31.29 30.32 2np0 h VAL 234 CO -0.03 0.02 -0.23 0.25 0.02 0.00 0.00 177.57 177.60 2np0 h LEU 235 N 0.12 -0.76 -0.65 2.57 5.85 0.12 0.18 115.31 122.74 2np0 h LEU 235 Ca 0.20 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 59.06 2np0 h LEU 235 Cb 0.29 0.38 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 2np0 h LEU 235 CO -0.34 -0.26 0.36 0.45 -0.34 0.00 0.00 178.44 178.31 2np0 h HIS 236 N -0.19 0.89 -0.67 1.25 3.86 -0.84 -2.40 115.15 117.04 2np0 h HIS 236 Ca 0.17 -0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.32 2np0 h HIS 236 Cb 0.45 -0.29 -0.03 0.00 1.06 0.00 0.00 27.41 28.61 2np0 h HIS 236 CO -0.43 0.64 0.28 0.78 0.86 0.00 0.00 177.93 180.06 2np0 h GLY 237 N 0.89 1.07 1.63 2.45 0.00 -0.49 -0.84 103.07 107.77 2np0 h GLY 237 Ca 0.23 -0.57 -0.08 0.00 0.00 0.00 0.00 47.33 46.91 2np0 h GLY 237 CO -0.04 0.54 -0.21 1.41 0.00 0.00 0.00 176.54 178.24 2np0 h LEU 238 N 0.95 0.44 -0.97 3.11 3.38 -0.34 -1.84 115.31 120.03 2np0 h LEU 238 Ca 0.23 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2np0 h LEU 238 Cb 0.18 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2np0 h LEU 238 CO -0.02 0.66 0.00 -1.22 0.09 0.00 0.00 178.44 177.95 2np0 n TYR 239 N -4.16 0.16 -1.66 1.13 4.02 -0.93 -4.12 117.16 111.60 2np0 n TYR 239 Ca -0.00 -0.08 -0.11 0.00 -0.01 0.00 0.00 57.90 57.70 2np0 n TYR 239 Cb 0.37 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.66 2np0 n TYR 239 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2np0 n GLY 240 N 1.11 0.76 0.67 2.72 0.00 -0.69 -4.60 105.19 105.16 2np0 n GLY 240 Ca 0.17 -0.47 0.06 0.00 0.00 0.00 0.00 46.02 45.78 2np0 n GLY 240 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2np0 n ILE 241 N -3.16 0.68 -1.05 -0.61 -5.35 -0.40 -0.80 119.36 108.67 2np0 n ILE 241 Ca -0.12 -0.84 -0.32 0.00 -0.27 0.00 0.00 62.75 61.20 2np0 n ILE 241 Cb 0.46 0.75 -0.02 0.00 -1.74 0.00 0.00 39.64 39.08 2np0 n ILE 241 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 2np0 n LYS 242 N 0.70 2.53 -3.25 6.28 4.81 -1.16 -4.93 118.16 123.14 2np0 n LYS 242 Ca 0.12 -1.82 -0.31 0.00 -0.87 0.00 0.00 58.31 55.42 2np0 n LYS 242 Cb 0.41 -2.69 -0.04 0.00 0.02 0.00 0.00 35.03 32.73 2np0 n LYS 242 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 2np0 s VAL 243 N 3.26 4.90 0.32 3.15 -7.23 -1.26 -4.45 120.40 119.09 2np0 s VAL 243 Ca 0.51 0.43 -0.23 0.00 -1.81 0.00 0.00 61.98 60.88 2np0 s VAL 243 Cb 0.13 -3.67 -0.10 0.00 0.56 0.00 0.00 36.38 33.30 2np0 s VAL 243 CO -0.03 -0.25 0.88 -1.81 -0.31 0.00 0.00 175.10 173.59 2np0 s ASP 244 N -2.74 7.16 0.00 4.85 1.01 -1.26 -4.72 116.67 120.97 2np0 s ASP 244 Ca 0.48 1.68 0.00 0.00 0.71 0.00 0.00 52.55 55.42 2np0 s ASP 244 Cb -0.11 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.30 2np0 s ASP 244 CO 0.25 -0.11 0.00 -0.67 0.21 0.00 0.00 175.17 174.85 2np0 n ASP 245 N 0.31 0.00 -4.66 0.27 -0.08 -1.26 -5.02 116.55 106.11 2np0 n ASP 245 Ca 0.02 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.88 2np0 n ASP 245 Cb 0.51 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.95 2np0 n ASP 245 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 2np0 s LEU 246 N 0.00 4.29 0.58 -2.67 2.96 -1.26 -4.90 118.68 117.67 2np0 s LEU 246 Ca 0.00 2.10 -0.02 0.00 -0.22 0.00 0.00 54.13 55.99 2np0 s LEU 246 Cb 0.00 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.18 2np0 s LEU 246 CO 0.00 -0.86 0.83 -2.16 -1.32 0.00 0.00 176.35 172.84 2np0 s PRO 247 N 3.69 2.60 -0.23 0.98 0.04 -1.26 -4.60 135.00 136.22 2np0 s PRO 247 Ca 0.68 -0.49 -0.23 0.00 0.04 0.00 0.00 61.00 60.99 2np0 s PRO 247 Cb -0.31 -2.39 -0.01 0.00 0.04 0.00 0.00 34.50 31.83 2np0 s PRO 247 CO 0.26 -0.77 0.76 0.42 0.04 0.00 0.00 177.00 177.71 2np0 s ILE 248 N -2.88 4.90 -0.10 0.56 -1.09 -0.15 -4.47 121.20 117.97 2np0 s ILE 248 Ca 0.56 1.43 0.04 0.00 -2.23 0.00 0.00 60.65 60.44 2np0 s ILE 248 Cb -0.10 -4.05 0.00 0.00 -1.58 0.00 0.00 42.46 36.72 2np0 s ILE 248 CO 0.41 -0.01 -0.22 -0.69 -1.23 0.00 0.00 174.94 173.20 2np0 s VAL 249 N 2.55 1.91 0.24 2.92 1.01 -1.26 0.05 120.40 127.82 2np0 s VAL 249 Ca 0.32 -0.93 -0.30 0.00 0.00 0.00 0.00 61.98 61.08 2np0 s VAL 249 Cb -0.16 -1.66 -0.09 0.00 0.00 0.00 0.00 36.38 34.47 2np0 s VAL 249 CO 0.09 0.53 1.22 -2.16 0.00 0.00 0.00 175.10 174.77 2np0 s PRO 250 N 0.44 4.48 0.29 2.72 0.05 -1.26 -0.20 135.00 141.51 2np0 s PRO 250 Ca -0.17 1.97 -0.30 0.00 0.05 0.00 0.00 61.00 62.55 2np0 s PRO 250 Cb -0.17 -3.18 -0.11 0.00 0.05 0.00 0.00 34.50 31.09 2np0 s PRO 250 CO 0.07 -0.07 1.52 1.21 0.05 0.00 0.00 177.00 179.78 2np0 s ASN 251 N -0.21 6.48 -0.05 6.66 3.84 0.12 -4.57 114.94 127.22 2np0 s ASN 251 Ca 0.51 2.86 0.10 0.00 0.21 0.00 0.00 52.86 56.53 2np0 s ASN 251 Cb -0.35 -2.64 0.17 0.00 -0.55 0.00 0.00 41.25 37.88 2np0 s ASN 251 CO 0.41 -0.83 1.08 -0.62 -2.79 0.00 0.00 177.10 174.36 2np0 n GLU 252 N 1.98 0.47 -0.54 0.43 1.02 -1.26 -4.53 120.64 118.21 2np0 n GLU 252 Ca 0.07 -1.74 0.08 0.00 -0.02 0.00 0.00 57.16 55.54 2np0 n GLU 252 Cb 0.39 -0.80 0.29 0.00 -0.02 0.00 0.00 31.44 31.30 2np0 n GLU 252 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2np0 n LYS 253 N -0.42 3.48 -4.09 3.49 2.85 -1.26 -4.85 118.16 117.36 2np0 n LYS 253 Ca 0.07 -2.84 -0.08 0.00 -1.05 0.00 0.00 58.31 54.41 2np0 n LYS 253 Cb 0.74 -1.88 -0.10 0.00 -0.65 0.00 0.00 35.03 33.14 2np0 n LYS 253 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2np0 s LYS 254 N -2.49 0.60 0.55 -1.58 -0.14 -1.26 -5.06 119.74 110.36 2np0 s LYS 254 Ca 0.44 -1.14 0.24 0.00 -1.36 0.00 0.00 55.97 54.16 2np0 s LYS 254 Cb 0.33 0.12 1.54 0.00 -1.68 0.00 0.00 37.83 38.15 2np0 s LYS 254 CO 0.13 -0.08 2.17 0.27 -0.76 0.00 0.00 175.35 177.08 2np0 h PHE 255 N 3.37 0.00 -0.21 3.18 -5.15 -1.99 -2.40 116.94 113.74 2np0 h PHE 255 Ca -0.34 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.43 2np0 h PHE 255 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.33 2np0 h PHE 255 CO 0.56 0.04 0.00 1.97 -2.00 0.00 0.00 178.31 178.88 2np0 n PHE 256 N -4.02 0.27 -3.42 6.09 1.16 -1.26 -4.90 117.46 111.38 2np0 n PHE 256 Ca -0.03 -0.13 -0.38 0.00 -1.87 0.00 0.00 57.45 55.04 2np0 n PHE 256 Cb 0.13 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 37.94 2np0 n PHE 256 CO 0.00 0.00 0.00 -1.64 -1.87 0.00 0.00 176.76 173.25 2np0 s MET 257 N -1.73 4.10 0.04 3.97 -1.94 -0.90 -1.65 119.30 121.18 2np0 s MET 257 Ca 0.33 0.45 -0.30 0.00 -1.71 0.00 0.00 55.69 54.46 2np0 s MET 257 Cb 0.19 -3.30 -0.05 0.00 2.01 0.00 0.00 34.83 33.68 2np0 s MET 257 CO 0.27 0.50 1.13 -1.14 -0.01 0.00 0.00 175.02 175.78 2np0 s GLN 258 N -0.48 4.47 -0.16 2.03 0.74 -0.10 -4.82 119.66 121.33 2np0 s GLN 258 Ca 0.25 1.66 -0.12 0.00 0.05 0.00 0.00 55.36 57.20 2np0 s GLN 258 Cb -0.16 -3.39 -0.05 0.00 1.10 0.00 0.00 33.01 30.51 2np0 s GLN 258 CO 0.13 -0.20 0.22 0.45 -0.55 0.00 0.00 175.29 175.33 2np0 s SER 259 N 1.06 6.36 0.19 6.67 0.15 -1.26 -4.77 113.70 122.09 2np0 s SER 259 Ca 0.57 0.42 -0.21 0.00 0.70 0.00 0.00 55.95 57.42 2np0 s SER 259 Cb -0.27 -2.14 0.05 0.00 -1.71 0.00 0.00 66.02 61.95 2np0 s SER 259 CO 0.29 0.17 0.60 0.28 1.20 0.00 0.00 173.24 175.78 2np0 s THR 260 N 0.21 0.01 0.72 6.45 -1.32 -1.26 -4.81 115.64 115.64 2np0 s THR 260 Ca 0.13 -0.35 -0.13 0.00 -1.21 0.00 0.00 61.69 60.13 2np0 s THR 260 Cb -0.12 -1.30 0.04 0.00 -1.51 0.00 0.00 72.50 69.60 2np0 s THR 260 CO 0.02 -0.03 1.12 -1.81 -2.21 0.00 0.00 174.62 171.71 2np0 s ASP 261 N -2.81 4.59 0.60 8.08 1.01 -1.26 -4.67 116.67 122.22 2np0 s ASP 261 Ca 0.04 2.03 -0.19 0.00 0.71 0.00 0.00 52.55 55.14 2np0 s ASP 261 Cb -0.02 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 2np0 s ASP 261 CO -0.07 -1.98 1.07 0.00 0.21 0.00 0.00 175.17 174.39 2np0 n ALA 262 N -2.94 0.49 -3.91 5.23 0.00 -1.26 -4.80 120.51 113.32 2np0 n ALA 262 Ca 0.11 0.02 -0.33 0.00 0.00 0.00 0.00 53.44 53.24 2np0 n ALA 262 Cb 0.52 -2.17 -0.15 0.00 0.00 0.00 0.00 19.45 17.65 2np0 n ALA 262 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2np0 s ILE 263 N -1.46 2.47 0.51 0.00 1.01 0.11 -4.94 121.20 118.90 2np0 s ILE 263 Ca 0.77 -1.51 -0.20 0.00 0.00 0.00 0.00 60.65 59.70 2np0 s ILE 263 Cb -0.41 -2.43 -0.07 0.00 0.01 0.00 0.00 42.46 39.56 2np0 s ILE 263 CO 0.46 -0.03 1.10 -1.10 0.00 0.00 0.00 174.94 175.37 2np0 s GLN 264 N 1.17 3.56 0.51 2.79 -1.52 -1.26 -0.98 119.66 123.93 2np0 s GLN 264 Ca -0.07 1.56 0.21 0.00 -1.95 0.00 0.00 55.36 55.11 2np0 s GLN 264 Cb -0.20 -2.10 1.31 0.00 -0.22 0.00 0.00 33.01 31.80 2np0 s GLN 264 CO -0.04 -0.67 2.02 0.00 -0.25 0.00 0.00 175.29 176.36 2np0 h ALA 265 N 1.46 2.32 -0.29 6.09 0.00 -1.90 -1.70 119.26 125.23 2np0 h ALA 265 Ca -0.50 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 2np0 h ALA 265 Cb 1.25 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 2np0 h ALA 265 CO 0.58 -0.44 -0.04 1.49 0.00 0.00 0.00 179.25 180.84 2np0 h GLU 266 N 0.07 0.46 -0.72 0.00 4.22 -1.91 0.14 114.58 116.84 2np0 h GLU 266 Ca 0.21 -0.10 -0.06 0.00 0.08 0.00 0.00 59.36 59.49 2np0 h GLU 266 Cb 0.74 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.90 2np0 h GLU 266 CO -0.02 0.52 0.20 0.93 -2.18 0.00 0.00 179.01 178.46 2np0 h GLU 267 N 0.44 1.13 -0.01 1.92 4.39 -1.68 -0.90 114.58 119.87 2np0 h GLU 267 Ca 0.09 -0.26 -0.19 0.00 0.34 0.00 0.00 59.36 59.35 2np0 h GLU 267 Cb 0.35 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 2np0 h GLU 267 CO 0.01 0.98 -0.84 -0.07 -1.16 0.00 0.00 179.01 177.93 2np0 h LEU 268 N 1.08 0.24 -0.54 1.33 3.38 -1.13 -2.66 115.31 117.00 2np0 h LEU 268 Ca 0.23 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 2np0 h LEU 268 Cb 0.34 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2np0 h LEU 268 CO -0.00 0.97 0.11 1.88 0.09 0.00 0.00 178.44 181.49 2np0 h TYR 269 N 0.11 0.94 -0.86 1.13 0.05 -0.75 -0.33 116.97 117.26 2np0 h TYR 269 Ca -0.04 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.63 2np0 h TYR 269 Cb 1.45 -0.26 -0.04 0.00 1.01 0.00 0.00 36.73 38.89 2np0 h TYR 269 CO 0.03 0.82 0.56 1.15 -1.05 0.00 0.00 178.16 179.67 2np0 h THR 270 N 0.78 1.23 -0.03 -2.88 2.02 -1.05 -3.03 112.91 109.96 2np0 h THR 270 Ca 0.17 -0.44 -0.06 0.00 0.77 0.00 0.00 66.41 66.86 2np0 h THR 270 Cb 0.38 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.76 2np0 h THR 270 CO 0.01 0.22 -0.21 0.15 0.37 0.00 0.00 175.52 176.06 2np0 h PHE 271 N 1.17 0.26 0.00 3.16 3.57 -1.35 -0.49 116.94 123.26 2np0 h PHE 271 Ca 0.31 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2np0 h PHE 271 Cb -0.11 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.59 2np0 h PHE 271 CO -0.01 0.86 0.00 0.41 -2.23 0.00 0.00 178.31 177.35 2np0 n GLY 272 N 0.83 -0.91 7.00 2.40 0.00 -0.14 -1.54 105.19 112.83 2np0 n GLY 272 Ca -0.09 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.61 2np0 n GLY 272 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2np0 n GLY 273 N 0.00 2.80 0.09 -0.02 0.00 -1.26 -2.43 105.19 104.38 2np0 n GLY 273 Ca 0.00 -0.24 0.12 0.00 0.00 0.00 0.00 46.02 45.90 2np0 n GLY 273 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2np0 h GLN 274 N 0.00 0.00 -0.17 1.61 3.07 -1.94 -3.38 115.11 114.30 2np0 h GLN 274 Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.60 2np0 h GLN 274 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.55 2np0 h GLN 274 CO 0.00 0.00 -0.48 -0.44 0.09 0.00 0.00 178.83 178.00 2np0 h ASP 275 N 0.00 0.48 -0.20 0.06 3.32 -1.76 -2.26 116.42 116.06 2np0 h ASP 275 Ca 0.00 -0.23 0.06 0.00 0.02 0.00 0.00 57.03 56.87 2np0 h ASP 275 Cb 0.79 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 2np0 h ASP 275 CO 0.00 0.89 0.36 -0.65 -1.72 0.00 0.00 179.24 178.12 2np0 h PRO 276 N 0.36 0.00 0.00 3.56 0.11 -1.74 -1.80 132.00 132.49 2np0 h PRO 276 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 2np0 h PRO 276 Cb 0.97 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.08 2np0 h PRO 276 CO 0.09 0.00 0.00 0.77 -0.21 0.00 0.00 178.00 178.65 2np0 h SER 277 N 0.00 0.00 1.63 -2.05 0.02 -1.64 -1.05 113.55 110.46 2np0 h SER 277 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2np0 h SER 277 Cb 0.81 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.35 2np0 h SER 277 CO -0.00 0.00 0.00 0.40 -1.14 0.00 0.00 176.83 176.09 2np0 h ILE 278 N 0.00 0.00 -3.47 3.27 2.04 -1.49 -3.28 117.51 114.58 2np0 h ILE 278 Ca 0.00 -0.78 -0.61 0.00 1.00 0.00 0.00 64.86 64.47 2np0 h ILE 278 Cb 0.36 1.77 -0.11 0.00 -0.74 0.00 0.00 36.82 38.10 2np0 h ILE 278 CO 0.00 0.00 0.34 -0.63 0.00 0.00 0.00 178.15 177.86 2np0 s ILE 279 N -3.33 4.81 0.64 -0.67 -1.09 -0.40 -4.77 121.20 116.39 2np0 s ILE 279 Ca 0.06 1.05 -0.17 0.00 -2.23 0.00 0.00 60.65 59.36 2np0 s ILE 279 Cb 0.07 -4.13 -0.01 0.00 -1.58 0.00 0.00 42.46 36.81 2np0 s ILE 279 CO 0.62 -0.27 1.16 0.42 -1.23 0.00 0.00 174.94 175.64 2np0 s THR 280 N 2.91 2.84 0.28 2.92 -4.23 -1.26 -4.73 115.64 114.37 2np0 s THR 280 Ca 0.31 0.45 0.02 0.00 -1.18 0.00 0.00 61.69 61.29 2np0 s THR 280 Cb -0.14 -3.05 0.28 0.00 1.34 0.00 0.00 72.50 70.93 2np0 s THR 280 CO 0.13 -0.18 1.71 -0.65 -0.54 0.00 0.00 174.62 175.09 2np0 h PRO 281 N 0.36 0.42 -0.62 3.99 0.11 -1.84 0.29 132.00 134.71 2np0 h PRO 281 Ca -0.48 -0.03 0.12 0.00 0.11 0.00 0.00 66.00 65.72 2np0 h PRO 281 Cb 1.27 -0.10 -0.12 0.00 0.11 0.00 0.00 31.00 32.17 2np0 h PRO 281 CO 0.54 0.28 -0.19 0.77 -0.21 0.00 0.00 178.00 179.19 2np0 h SER 282 N 0.43 -0.67 0.77 -2.05 0.02 -1.91 -1.24 113.55 108.90 2np0 h SER 282 Ca 0.53 0.20 -0.21 0.00 -0.84 0.00 0.00 61.79 61.47 2np0 h SER 282 Cb 0.97 0.42 -0.02 0.00 0.14 0.00 0.00 62.40 63.91 2np0 h SER 282 CO -0.50 -0.23 -0.99 0.74 -1.14 0.00 0.00 176.83 174.72 2np0 h THR 283 N -0.03 1.59 -0.66 -2.27 2.02 -1.48 -2.06 112.91 110.01 2np0 h THR 283 Ca 0.29 -3.01 0.09 0.00 0.77 0.00 0.00 66.41 64.55 2np0 h THR 283 Cb 0.48 2.70 -0.07 0.00 -1.74 0.00 0.00 68.15 69.52 2np0 h THR 283 CO -0.66 0.87 0.29 0.44 0.37 0.00 0.00 175.52 176.84 2np0 h ASP 284 N 0.05 0.35 0.49 4.18 3.32 -0.45 0.32 116.42 124.68 2np0 h ASP 284 Ca -0.05 0.07 -0.17 0.00 0.02 0.00 0.00 57.03 56.90 2np0 h ASP 284 Cb 1.68 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 41.24 2np0 h ASP 284 CO 0.14 0.20 -0.75 0.11 -1.72 0.00 0.00 179.24 177.23 2np0 h LYS 285 N 0.51 0.20 -0.66 3.56 1.57 -1.14 -2.01 116.57 118.60 2np0 h LYS 285 Ca 0.33 -0.18 -0.09 0.00 -1.87 0.00 0.00 60.65 58.84 2np0 h LYS 285 Cb 0.37 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 2np0 h LYS 285 CO -0.28 0.86 0.08 1.03 -0.57 0.00 0.00 179.45 180.56 2np0 h SER 286 N 0.13 1.08 -0.17 0.86 0.87 -0.62 -1.09 113.55 114.60 2np0 h SER 286 Ca -0.02 -0.27 -0.09 0.00 -1.23 0.00 0.00 61.79 60.17 2np0 h SER 286 Cb 1.32 -0.29 -0.00 0.00 -0.44 0.00 0.00 62.40 62.99 2np0 h SER 286 CO 0.11 1.08 -0.24 0.40 -0.53 0.00 0.00 176.83 177.65 2np0 h ILE 287 N 1.04 1.34 -0.44 2.23 2.04 -0.88 -2.69 117.51 120.16 2np0 h ILE 287 Ca 0.20 -1.45 0.09 0.00 1.00 0.00 0.00 64.86 64.69 2np0 h ILE 287 Cb 0.48 1.87 -0.08 0.00 -0.74 0.00 0.00 36.82 38.35 2np0 h ILE 287 CO 0.02 0.44 -0.07 0.22 0.00 0.00 0.00 178.15 178.76 2np0 h TYR 288 N 0.12 -0.15 -0.41 1.37 3.20 -1.27 -1.09 116.97 118.74 2np0 h TYR 288 Ca 0.02 0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.84 2np0 h TYR 288 Cb 0.81 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.20 2np0 h TYR 288 CO 0.09 -0.15 -0.09 -0.44 -1.64 0.00 0.00 178.16 175.92 2np0 h ASP 289 N 0.04 0.69 -0.58 -2.11 3.32 -1.20 -0.20 116.42 116.38 2np0 h ASP 289 Ca 0.21 -0.19 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 2np0 h ASP 289 Cb 0.32 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 2np0 h ASP 289 CO -0.42 0.82 0.12 0.11 -1.72 0.00 0.00 179.24 178.15 2np0 h LYS 290 N 0.65 0.95 -0.34 3.56 1.57 -1.04 -0.44 116.57 121.47 2np0 h LYS 290 Ca 0.12 -0.24 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 2np0 h LYS 290 Cb 0.54 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 2np0 h LYS 290 CO 0.03 0.89 -0.36 0.28 -0.57 0.00 0.00 179.45 179.72 2np0 h VAL 291 N 0.86 1.28 -0.20 0.50 2.07 -0.86 -1.33 116.25 118.57 2np0 h VAL 291 Ca 0.18 -1.54 0.03 0.00 0.82 0.00 0.00 66.70 66.19 2np0 h VAL 291 Cb 0.39 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 2np0 h VAL 291 CO 0.01 0.51 -0.00 0.25 0.02 0.00 0.00 177.57 178.35 2np0 h LEU 292 N 0.65 -0.08 -0.31 2.57 5.85 -0.68 -0.07 115.31 123.24 2np0 h LEU 292 Ca 0.05 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.83 2np0 h LEU 292 Cb 0.95 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 2np0 h LEU 292 CO 0.09 -0.01 0.17 1.56 -0.34 0.00 0.00 178.44 179.91 2np0 h GLN 293 N 0.06 0.35 -0.75 1.25 1.08 -0.97 -0.06 115.11 116.09 2np0 h GLN 293 Ca 0.09 -0.02 0.14 0.00 -1.45 0.00 0.00 58.65 57.41 2np0 h GLN 293 Cb 0.12 -0.08 -0.09 0.00 -0.05 0.00 0.00 27.48 27.38 2np0 h GLN 293 CO -0.16 0.23 0.30 -0.91 -0.95 0.00 0.00 178.83 177.34 2np0 h ASN 294 N 0.36 0.28 0.35 1.46 2.35 -0.83 0.37 115.58 119.92 2np0 h ASN 294 Ca 0.12 0.11 -0.08 0.00 -0.55 0.00 0.00 56.30 55.90 2np0 h ASN 294 Cb 0.01 0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 2np0 h ASN 294 CO -0.06 0.11 -0.37 -0.26 -1.65 0.00 0.00 177.43 175.20 2np0 h PHE 295 N 0.45 0.04 -0.10 1.19 -1.00 -0.25 -2.03 116.94 115.23 2np0 h PHE 295 Ca 0.41 -0.01 -0.06 0.00 2.81 0.00 0.00 57.97 61.12 2np0 h PHE 295 Cb 0.61 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 40.15 2np0 h PHE 295 CO -0.16 0.40 -0.22 0.00 -1.61 0.00 0.00 178.31 176.72 2np0 h ARG 296 N 0.03 0.17 -0.54 1.51 3.08 0.91 -0.85 114.38 118.69 2np0 h ARG 296 Ca 0.00 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 2np0 h ARG 296 Cb 0.67 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.67 2np0 h ARG 296 CO 0.05 0.39 0.14 0.78 -1.07 0.00 0.00 179.97 180.26 2np0 h GLY 297 N 0.85 0.93 1.23 0.04 0.00 -0.50 -2.57 103.07 103.05 2np0 h GLY 297 Ca 0.03 -0.58 -0.21 0.00 0.00 0.00 0.00 47.33 46.57 2np0 h GLY 297 CO 0.03 0.54 -0.73 -2.22 0.00 0.00 0.00 176.54 174.16 2np0 h ILE 298 N 0.76 1.29 -0.60 2.60 1.08 -1.02 -1.68 117.51 119.94 2np0 h ILE 298 Ca 0.17 -1.94 -0.07 0.00 -0.39 0.00 0.00 64.86 62.63 2np0 h ILE 298 Cb 0.33 1.92 -0.02 0.00 -3.07 0.00 0.00 36.82 35.97 2np0 h ILE 298 CO 0.00 0.61 0.09 1.62 -0.69 0.00 0.00 178.15 179.79 2np0 h VAL 299 N 0.54 1.26 -0.22 1.67 3.04 -1.17 -0.49 116.25 120.88 2np0 h VAL 299 Ca -0.04 -1.00 0.00 0.00 -1.01 0.00 0.00 66.70 64.66 2np0 h VAL 299 Cb 1.34 0.75 -0.01 0.00 -2.01 0.00 0.00 31.29 31.36 2np0 h VAL 299 CO 0.15 0.37 0.14 -0.78 -1.01 0.00 0.00 177.57 176.44 2np0 h ASP 300 N 0.90 0.24 -1.00 3.17 3.58 -1.45 -1.55 116.42 120.31 2np0 h ASP 300 Ca 0.18 -0.00 0.16 0.00 0.42 0.00 0.00 57.03 57.79 2np0 h ASP 300 Cb 0.43 -0.06 -0.10 0.00 1.72 0.00 0.00 39.33 41.32 2np0 h ASP 300 CO 0.01 0.18 0.61 0.03 -2.88 0.00 0.00 179.24 177.19 2np0 h ARG 301 N 0.29 0.82 -0.07 0.28 3.08 -0.84 -1.72 114.38 116.22 2np0 h ARG 301 Ca 0.08 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 59.97 2np0 h ARG 301 Cb -0.03 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.82 2np0 h ARG 301 CO -0.02 0.54 -0.47 -0.07 -1.07 0.00 0.00 179.97 178.88 2np0 h LEU 302 N 0.85 0.19 -0.61 3.04 3.38 -0.24 0.33 115.31 122.25 2np0 h LEU 302 Ca 0.54 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.42 2np0 h LEU 302 Cb 0.73 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2np0 h LEU 302 CO -0.34 0.64 0.00 0.78 0.09 0.00 0.00 178.44 179.61 2np0 h ASN 303 N 0.15 0.00 0.00 -0.43 2.35 -0.45 -3.31 115.58 113.89 2np0 h ASN 303 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2np0 h ASN 303 Cb 0.89 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.26 2np0 h ASN 303 CO 0.07 0.00 -1.47 0.29 -1.65 0.00 0.00 177.43 174.67 2np0 n LYS 304 N -2.70 0.36 -1.93 0.81 5.02 -0.69 -5.02 118.16 114.00 2np0 n LYS 304 Ca 0.03 -0.10 -0.41 0.00 -2.02 0.00 0.00 58.31 55.81 2np0 n LYS 304 Cb 0.37 -1.25 -0.02 0.00 -0.02 0.00 0.00 35.03 34.11 2np0 n LYS 304 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2np0 s VAL 305 N -2.73 2.45 0.00 -0.18 0.11 0.11 -4.34 120.40 115.82 2np0 s VAL 305 Ca -0.04 0.38 0.00 0.00 -2.93 0.00 0.00 61.98 59.39 2np0 s VAL 305 Cb 0.07 -3.24 0.00 0.00 -1.53 0.00 0.00 36.38 31.67 2np0 s VAL 305 CO 0.44 0.06 0.00 0.18 -3.33 0.00 0.00 175.10 172.45 2np0 n LEU 306 N 2.26 0.39 -3.95 2.54 4.77 -0.39 -4.97 117.00 117.66 2np0 n LEU 306 Ca 0.07 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.97 2np0 n LEU 306 Cb 0.39 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.39 2np0 n LEU 306 CO 0.62 0.07 -0.22 0.68 -1.33 0.00 0.00 177.39 177.20 2np0 s VAL 307 N -1.72 0.16 -0.26 4.08 -7.23 -1.19 -4.97 120.40 109.28 2np0 s VAL 307 Ca 0.00 -1.31 -0.03 0.00 -1.81 0.00 0.00 61.98 58.83 2np0 s VAL 307 Cb 0.00 -1.19 0.02 0.00 0.56 0.00 0.00 36.38 35.77 2np0 s VAL 307 CO 0.00 -0.72 -0.02 0.00 -0.31 0.00 0.00 175.10 174.04 2np0 h ILE 309 N 6.09 0.00 0.00 0.00 3.07 -1.95 -3.34 117.51 121.37 2np0 h ILE 309 Ca -0.32 -0.90 -0.03 0.00 1.55 0.00 0.00 64.86 65.17 2np0 h ILE 309 Cb 1.11 1.89 -0.01 0.00 -0.27 0.00 0.00 36.82 39.55 2np0 h ILE 309 CO 0.58 0.00 -1.70 -1.54 -1.05 0.00 0.00 178.15 174.44 2np0 n SER 310 N -2.99 1.65 -3.59 2.16 3.41 -1.26 -4.84 113.62 108.16 2np0 n SER 310 Ca 0.04 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.37 2np0 n SER 310 Cb 0.50 1.57 -0.16 0.00 -0.26 0.00 0.00 64.21 65.86 2np0 n SER 310 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2np0 s ASP 311 N -3.81 3.19 0.25 4.04 -1.08 -1.25 -4.74 116.67 113.28 2np0 s ASP 311 Ca -0.06 -1.09 0.23 0.00 -0.52 0.00 0.00 52.55 51.12 2np0 s ASP 311 Cb 0.09 -0.38 0.97 0.00 -1.46 0.00 0.00 42.92 42.14 2np0 s ASP 311 CO 0.60 -0.40 1.71 -0.81 0.52 0.00 0.00 175.17 176.79 2np0 n PRO 312 N 5.21 0.19 0.00 4.34 -0.04 -1.26 -2.68 135.00 140.76 2np0 n PRO 312 Ca -0.06 0.42 0.15 0.00 -0.04 0.00 0.00 63.50 63.96 2np0 n PRO 312 Cb 0.44 -1.86 0.70 0.00 -0.04 0.00 0.00 33.50 32.74 2np0 n PRO 312 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2np0 n ASN 313 N -2.22 0.11 -4.74 3.54 5.03 -1.26 -4.80 115.26 110.92 2np0 n ASN 313 Ca 0.02 -0.14 -0.41 0.00 0.87 0.00 0.00 54.58 54.92 2np0 n ASN 313 Cb 0.23 -0.26 -0.03 0.00 -1.02 0.00 0.00 39.78 38.70 2np0 n ASN 313 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2np0 s ILE 314 N -2.62 3.35 -0.34 2.41 -1.09 -1.09 -4.99 121.20 116.82 2np0 s ILE 314 Ca 0.26 1.14 -0.13 0.00 -2.23 0.00 0.00 60.65 59.68 2np0 s ILE 314 Cb 0.20 -3.72 -0.02 0.00 -1.58 0.00 0.00 42.46 37.34 2np0 s ILE 314 CO 0.48 0.18 0.26 0.21 -1.23 0.00 0.00 174.94 174.84 2np0 s ASN 315 N 0.18 6.08 0.11 3.58 3.84 -1.26 -4.89 114.94 122.57 2np0 s ASN 315 Ca 0.54 -0.37 -0.22 0.00 0.21 0.00 0.00 52.86 53.03 2np0 s ASN 315 Cb -0.35 -2.15 -0.10 0.00 -0.55 0.00 0.00 41.25 38.10 2np0 s ASN 315 CO 0.38 -0.24 1.74 0.40 -2.79 0.00 0.00 177.10 176.59 2np0 h ILE 316 N 5.49 0.97 -0.14 -5.21 1.08 -1.94 -2.52 117.51 115.25 2np0 h ILE 316 Ca -0.31 -0.02 -0.06 0.00 -0.39 0.00 0.00 64.86 64.08 2np0 h ILE 316 Cb 1.16 0.90 -0.01 0.00 -3.07 0.00 0.00 36.82 35.80 2np0 h ILE 316 CO 0.64 0.01 -0.18 0.78 -0.69 0.00 0.00 178.15 178.71 2np0 h ASN 317 N 0.06 0.21 0.15 1.72 2.35 -1.98 0.40 115.58 118.49 2np0 h ASN 317 Ca 0.04 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 2np0 h ASN 317 Cb 0.03 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.34 2np0 h ASN 317 CO -0.05 0.41 -0.07 0.40 -1.65 0.00 0.00 177.43 176.47 2np0 h ILE 318 N 0.21 0.90 -0.42 2.81 1.08 -1.90 -2.11 117.51 118.08 2np0 h ILE 318 Ca 0.04 -0.18 -0.10 0.00 -0.39 0.00 0.00 64.86 64.24 2np0 h ILE 318 Cb 0.44 1.01 -0.01 0.00 -3.07 0.00 0.00 36.82 35.19 2np0 h ILE 318 CO 0.03 0.04 -0.12 1.88 -0.69 0.00 0.00 178.15 179.29 2np0 h TYR 319 N -0.28 0.93 -0.85 1.37 -1.99 -1.05 -1.13 116.97 113.97 2np0 h TYR 319 Ca -0.02 -0.21 0.18 0.00 2.00 0.00 0.00 58.73 60.68 2np0 h TYR 319 Cb 0.22 -0.23 -0.11 0.00 2.00 0.00 0.00 36.73 38.62 2np0 h TYR 319 CO -0.04 0.95 0.39 0.87 -0.00 0.00 0.00 178.16 180.33 2np0 h LYS 320 N 0.65 0.48 -0.10 4.88 1.57 -0.95 0.35 116.57 123.45 2np0 h LYS 320 Ca 0.10 -0.03 -0.20 0.00 -1.87 0.00 0.00 60.65 58.66 2np0 h LYS 320 Cb 0.66 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.86 2np0 h LYS 320 CO 0.05 0.32 -0.76 -0.91 -0.57 0.00 0.00 179.45 177.58 2np0 h ASN 321 N 0.50 0.64 -0.50 0.86 2.35 -0.87 -1.27 115.58 117.29 2np0 h ASN 321 Ca 0.50 -0.43 -0.05 0.00 -0.55 0.00 0.00 56.30 55.77 2np0 h ASN 321 Cb 0.82 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 2np0 h ASN 321 CO -0.44 1.19 0.11 0.50 -1.65 0.00 0.00 177.43 177.14 2np0 h LYS 322 N 0.36 0.81 -0.23 0.81 1.63 -0.62 -2.22 116.57 117.11 2np0 h LYS 322 Ca -0.04 -0.20 -0.11 0.00 -0.85 0.00 0.00 60.65 59.45 2np0 h LYS 322 Cb 1.35 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 32.87 2np0 h LYS 322 CO 0.14 0.78 -0.32 0.74 -3.45 0.00 0.00 179.45 177.34 2np0 h PHE 323 N 0.69 0.56 -0.59 1.91 0.05 -0.89 0.60 116.94 119.27 2np0 h PHE 323 Ca 0.16 -0.14 0.07 0.00 3.82 0.00 0.00 57.97 61.87 2np0 h PHE 323 Cb 0.34 -0.13 -0.06 0.00 2.00 0.00 0.00 35.95 38.10 2np0 h PHE 323 CO 0.02 0.76 0.28 -0.22 -0.18 0.00 0.00 178.31 178.97 2np0 h LYS 324 N 0.42 0.51 -0.08 1.51 3.64 -1.10 -1.19 116.57 120.28 2np0 h LYS 324 Ca 0.05 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2np0 h LYS 324 Cb 0.77 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.48 2np0 h LYS 324 CO 0.06 0.33 -0.02 0.22 -2.27 0.00 0.00 179.45 177.78 2np0 h ASP 325 N 0.52 0.14 -0.36 4.20 1.82 -0.90 -0.59 116.42 121.26 2np0 h ASP 325 Ca 0.28 -0.36 0.08 0.00 -0.39 0.00 0.00 57.03 56.63 2np0 h ASP 325 Cb 0.24 -0.04 -0.08 0.00 0.68 0.00 0.00 39.33 40.13 2np0 h ASP 325 CO -0.22 0.47 -0.25 0.50 -1.61 0.00 0.00 179.24 178.14 2np0 h LYS 326 N -0.19 -0.19 -0.01 0.28 3.64 -0.58 -2.38 116.57 117.13 2np0 h LYS 326 Ca 0.02 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2np0 h LYS 326 Cb 0.41 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2np0 h LYS 326 CO 0.01 -0.13 -0.03 0.66 -2.27 0.00 0.00 179.45 177.69 2np0 n TYR 327 N -5.39 0.00 -3.49 1.91 4.02 -0.48 -4.93 117.16 108.80 2np0 n TYR 327 Ca 0.01 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.66 2np0 n TYR 327 Cb 0.31 -0.03 0.06 0.00 -0.02 0.00 0.00 39.34 39.66 2np0 n TYR 327 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2np0 n LYS 328 N -0.22 -7.07 -1.64 -0.72 4.76 -0.45 -4.85 118.16 107.98 2np0 n LYS 328 Ca 0.19 0.83 -0.31 0.00 -2.87 0.00 0.00 58.31 56.15 2np0 n LYS 328 Cb 0.30 -5.83 0.04 0.00 -1.84 0.00 0.00 35.03 27.70 2np0 n LYS 328 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2np0 s PHE 329 N -3.28 3.22 0.23 2.13 2.99 -0.36 -4.59 117.98 118.31 2np0 s PHE 329 Ca 0.53 1.38 0.08 0.00 0.00 0.00 0.00 56.93 58.92 2np0 s PHE 329 Cb -0.24 -2.85 -0.04 0.00 0.00 0.00 0.00 43.02 39.89 2np0 s PHE 329 CO 0.65 -1.13 0.03 0.14 -0.00 0.00 0.00 175.22 174.91 2np0 s VAL 330 N -3.08 3.72 -0.11 -0.44 -7.23 -0.55 -4.77 120.40 107.93 2np0 s VAL 330 Ca 0.57 -1.64 0.01 0.00 -1.81 0.00 0.00 61.98 59.12 2np0 s VAL 330 Cb -0.13 -2.95 0.02 0.00 0.56 0.00 0.00 36.38 33.88 2np0 s VAL 330 CO 0.55 -0.27 -0.14 -0.70 -0.31 0.00 0.00 175.10 174.23 2np0 s GLU 331 N -3.42 2.11 0.00 4.82 2.12 -1.26 -1.32 118.70 121.76 2np0 s GLU 331 Ca 0.30 -0.52 0.00 0.00 0.36 0.00 0.00 54.97 55.11 2np0 s GLU 331 Cb -0.08 -1.84 0.00 0.00 0.26 0.00 0.00 34.13 32.48 2np0 s GLU 331 CO 0.20 -0.09 0.00 -0.40 -0.54 0.00 0.00 175.26 174.43 2np0 n ASP 332 N 4.28 -0.08 0.23 -1.70 5.68 -0.24 -4.89 116.55 119.83 2np0 n ASP 332 Ca -0.19 -0.92 0.12 0.00 -0.50 0.00 0.00 54.79 53.30 2np0 n ASP 332 Cb 0.51 0.00 0.44 0.00 -1.14 0.00 0.00 41.12 40.93 2np0 n ASP 332 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2np0 h SER 333 N -0.08 0.00 0.36 -1.12 4.64 -2.01 -2.76 113.55 112.58 2np0 h SER 333 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2np0 h SER 333 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2np0 h SER 333 CO 0.00 0.16 -0.16 -0.62 -0.87 0.00 0.00 176.83 175.34 2np0 n GLU 334 N -3.25 0.67 -0.64 4.77 1.02 -1.26 -4.93 120.64 117.01 2np0 n GLU 334 Ca 0.01 -0.28 0.00 0.00 -0.02 0.00 0.00 57.16 56.87 2np0 n GLU 334 Cb 0.44 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 2np0 n GLU 334 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2np0 n GLY 335 N 1.31 0.64 3.72 0.62 0.00 -1.04 -5.05 105.19 105.39 2np0 n GLY 335 Ca 0.13 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 2np0 n GLY 335 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2np0 s LYS 336 N -0.80 4.46 -0.04 1.61 2.20 -1.26 -4.81 119.74 121.09 2np0 s LYS 336 Ca 0.00 0.97 -0.16 0.00 -0.36 0.00 0.00 55.97 56.41 2np0 s LYS 336 Cb 0.00 -3.44 -0.05 0.00 -1.51 0.00 0.00 37.83 32.83 2np0 s LYS 336 CO 0.00 0.08 0.45 0.71 -0.36 0.00 0.00 175.35 176.23 2np0 s TYR 337 N 0.70 3.66 0.17 4.03 4.12 -1.26 -1.08 117.35 127.68 2np0 s TYR 337 Ca 0.39 0.98 -0.00 0.00 0.02 0.00 0.00 57.07 58.46 2np0 s TYR 337 Cb -0.18 -2.41 -0.04 0.00 -1.52 0.00 0.00 41.96 37.80 2np0 s TYR 337 CO 0.20 0.46 0.07 -1.54 0.02 0.00 0.00 175.55 174.76 2np0 s SER 338 N -0.45 0.55 -0.22 2.29 1.04 -0.43 -4.86 113.70 111.61 2np0 s SER 338 Ca 0.25 -1.27 -0.24 0.00 0.48 0.00 0.00 55.95 55.17 2np0 s SER 338 Cb -0.16 0.27 -0.01 0.00 0.10 0.00 0.00 66.02 66.21 2np0 s SER 338 CO 0.13 -0.73 0.79 -0.63 0.98 0.00 0.00 173.24 173.78 2np0 s ILE 339 N -3.96 4.88 -0.23 -1.02 1.01 -1.26 -1.49 121.20 119.12 2np0 s ILE 339 Ca 0.29 1.50 -0.20 0.00 0.00 0.00 0.00 60.65 62.25 2np0 s ILE 339 Cb 0.07 -4.09 -0.02 0.00 0.01 0.00 0.00 42.46 38.43 2np0 s ILE 339 CO 0.06 -0.03 0.61 -0.62 0.00 0.00 0.00 174.94 174.96 2np0 s ASP 340 N 1.30 6.60 0.34 3.58 3.68 -1.26 -4.95 116.67 125.97 2np0 s ASP 340 Ca 0.34 0.73 0.18 0.00 2.13 0.00 0.00 52.55 55.94 2np0 s ASP 340 Cb -0.16 -2.33 0.42 0.00 -1.45 0.00 0.00 42.92 39.40 2np0 s ASP 340 CO 0.09 -0.31 1.61 1.62 0.13 0.00 0.00 175.17 178.31 2np0 h VAL 341 N 5.30 0.77 -0.00 1.11 3.04 -1.96 -1.20 116.25 123.31 2np0 h VAL 341 Ca -0.29 -1.76 -0.00 0.00 -1.01 0.00 0.00 66.70 63.63 2np0 h VAL 341 Cb 1.13 2.14 0.00 0.00 -2.01 0.00 0.00 31.29 32.55 2np0 h VAL 341 CO 0.76 0.39 -0.02 -0.33 -1.01 0.00 0.00 177.57 177.36 2np0 h GLU 342 N 0.00 0.02 -0.30 4.17 5.08 -1.99 -2.10 114.58 119.46 2np0 h GLU 342 Ca -0.00 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2np0 h GLU 342 Cb 1.11 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 2np0 h GLU 342 CO 0.05 0.69 0.04 0.66 -1.00 0.00 0.00 179.01 179.45 2np0 h SER 343 N -0.65 0.40 0.20 1.42 4.64 -1.79 -1.42 113.55 116.36 2np0 h SER 343 Ca -0.00 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 2np0 h SER 343 Cb 0.69 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 2np0 h SER 343 CO 0.00 0.43 -0.10 0.15 -0.87 0.00 0.00 176.83 176.45 2np0 h PHE 344 N 0.43 -0.25 -0.82 4.77 3.57 -1.29 -1.32 116.94 122.02 2np0 h PHE 344 Ca 0.10 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.69 2np0 h PHE 344 Cb 0.22 0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.97 2np0 h PHE 344 CO 0.01 -0.03 0.46 0.22 -2.23 0.00 0.00 178.31 176.74 2np0 h ASP 345 N -0.45 0.65 -0.04 0.41 3.58 -0.92 0.19 116.42 119.84 2np0 h ASP 345 Ca -0.03 0.05 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 2np0 h ASP 345 Cb 0.34 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.32 2np0 h ASP 345 CO 0.05 0.37 0.01 0.50 -2.88 0.00 0.00 179.24 177.28 2np0 h LYS 346 N 0.77 0.06 -0.00 0.28 3.64 -1.23 -1.96 116.57 118.13 2np0 h LYS 346 Ca 0.40 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.79 2np0 h LYS 346 Cb 0.39 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 2np0 h LYS 346 CO -0.26 0.29 -0.16 1.25 -2.27 0.00 0.00 179.45 178.30 2np0 h LEU 347 N -0.17 -0.45 -0.09 5.20 5.85 -0.74 -0.52 115.31 124.38 2np0 h LEU 347 Ca 0.01 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.84 2np0 h LEU 347 Cb 0.25 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 2np0 h LEU 347 CO 0.00 -0.22 -0.41 0.22 -0.34 0.00 0.00 178.44 177.69 2np0 h TYR 348 N -0.26 -1.18 -0.37 1.25 3.20 -0.66 0.20 116.97 119.15 2np0 h TYR 348 Ca 0.05 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.92 2np0 h TYR 348 Cb 0.32 0.53 -0.02 0.00 1.54 0.00 0.00 36.73 39.10 2np0 h TYR 348 CO -0.21 -0.48 0.05 0.87 -1.64 0.00 0.00 178.16 176.75 2np0 h LYS 349 N -0.51 0.56 -0.18 1.82 1.57 -1.23 -0.21 116.57 118.40 2np0 h LYS 349 Ca 0.07 -0.11 -0.14 0.00 -1.87 0.00 0.00 60.65 58.60 2np0 h LYS 349 Cb 0.63 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2np0 h LYS 349 CO -0.37 0.55 -0.42 0.66 -0.57 0.00 0.00 179.45 179.31 2np0 h SER 350 N 0.55 0.68 -0.07 0.86 4.64 -0.76 0.16 113.55 119.60 2np0 h SER 350 Ca 0.12 -0.57 -0.08 0.00 -0.47 0.00 0.00 61.79 60.80 2np0 h SER 350 Cb 0.28 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 2np0 h SER 350 CO 0.00 1.12 -0.19 -0.07 -0.87 0.00 0.00 176.83 176.83 2np0 h LEU 351 N 0.27 0.44 0.01 5.97 3.38 -0.28 -0.76 115.31 124.34 2np0 h LEU 351 Ca -0.00 -0.13 -0.37 0.00 0.09 0.00 0.00 57.88 57.47 2np0 h LEU 351 Cb 1.02 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.59 2np0 h LEU 351 CO 0.09 0.65 -2.35 0.23 0.09 0.00 0.00 178.44 177.15 2np0 n MET 352 N -4.17 0.67 -0.00 1.13 2.81 -0.15 -4.51 117.12 112.91 2np0 n MET 352 Ca 0.00 0.09 0.02 0.00 -1.81 0.00 0.00 57.70 56.01 2np0 n MET 352 Cb 0.36 -1.55 -0.03 0.00 -0.71 0.00 0.00 33.22 31.28 2np0 n MET 352 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2np0 n PHE 353 N -3.02 0.00 -0.01 2.03 0.99 0.48 -4.59 117.46 113.33 2np0 n PHE 353 Ca -0.37 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.08 2np0 n PHE 353 Cb 1.08 -0.00 -0.00 0.00 -1.00 0.00 0.00 39.48 39.56 2np0 n PHE 353 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 2np0 h GLY 354 N 1.17 0.00 -7.23 1.37 0.00 -0.36 -3.33 103.07 94.69 2np0 h GLY 354 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.90 2np0 h GLY 354 CO 0.00 0.00 1.07 -1.36 0.00 0.00 0.00 176.54 176.25 2np0 s PHE 355 N -1.18 2.05 0.17 5.60 0.40 -0.93 -4.80 117.98 119.29 2np0 s PHE 355 Ca -0.01 0.14 0.07 0.00 -0.60 0.00 0.00 56.93 56.53 2np0 s PHE 355 Cb 0.00 -4.30 -0.04 0.00 0.51 0.00 0.00 43.02 39.19 2np0 s PHE 355 CO 0.02 -1.90 -0.14 0.95 0.70 0.00 0.00 175.22 174.85 2np0 s THR 356 N 8.07 1.54 0.15 0.64 -4.23 -1.26 -4.80 115.64 115.75 2np0 s THR 356 Ca 0.60 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.94 2np0 s THR 356 Cb -0.05 -1.84 0.01 0.00 1.34 0.00 0.00 72.50 71.96 2np0 s THR 356 CO -0.00 -0.53 1.77 -0.08 -0.54 0.00 0.00 174.62 175.24 2np0 h GLU 357 N 2.97 0.32 -0.62 3.99 4.81 -1.02 -0.36 114.58 124.66 2np0 h GLU 357 Ca -0.39 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 58.90 2np0 h GLU 357 Cb 1.21 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 30.45 2np0 h GLU 357 CO 0.57 0.21 0.29 1.15 -0.73 0.00 0.00 179.01 180.50 2np0 h THR 358 N 0.33 0.87 -0.32 0.32 2.02 -1.53 -0.24 112.91 114.35 2np0 h THR 358 Ca 0.15 -0.18 -0.17 0.00 0.77 0.00 0.00 66.41 66.98 2np0 h THR 358 Cb 0.09 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 66.79 2np0 h THR 358 CO -0.13 0.10 -0.48 0.78 0.37 0.00 0.00 175.52 176.16 2np0 h ASN 359 N 0.52 0.95 -0.45 4.18 2.35 -1.72 -2.62 115.58 118.79 2np0 h ASN 359 Ca 0.30 -0.47 -0.06 0.00 -0.55 0.00 0.00 56.30 55.51 2np0 h ASN 359 Cb 0.28 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 2np0 h ASN 359 CO -0.24 1.26 0.06 0.40 -1.65 0.00 0.00 177.43 177.26 2np0 h ILE 360 N 0.69 1.25 -0.81 2.81 2.04 -0.46 -1.05 117.51 121.97 2np0 h ILE 360 Ca 0.03 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 64.98 2np0 h ILE 360 Cb 1.07 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 38.09 2np0 h ILE 360 CO 0.11 0.32 0.53 0.00 0.00 0.00 0.00 178.15 179.12 2np0 h ALA 361 N 0.94 1.05 -0.22 1.87 0.00 -1.06 0.35 119.26 122.19 2np0 h ALA 361 Ca 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2np0 h ALA 361 Cb 0.41 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2np0 h ALA 361 CO 0.01 0.40 0.12 1.49 0.00 0.00 0.00 179.25 181.27 2np0 h GLU 362 N 1.07 0.32 -0.33 0.00 4.22 -1.28 0.76 114.58 119.33 2np0 h GLU 362 Ca 0.31 -0.04 -0.13 0.00 0.08 0.00 0.00 59.36 59.58 2np0 h GLU 362 Cb -0.08 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2np0 h GLU 362 CO -0.08 0.30 -0.31 -0.97 -2.18 0.00 0.00 179.01 175.77 2np0 h ASN 363 N 0.25 0.73 0.16 1.04 -1.24 -0.39 -3.03 115.58 113.10 2np0 h ASN 363 Ca 0.08 -0.29 0.00 0.00 0.71 0.00 0.00 56.30 56.79 2np0 h ASN 363 Cb 0.08 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 38.93 2np0 h ASN 363 CO -0.01 0.99 -0.13 -1.22 -1.29 0.00 0.00 177.43 175.77 2np0 n TYR 364 N -4.08 0.00 -3.58 0.67 4.02 0.12 -4.95 117.16 109.36 2np0 n TYR 364 Ca -0.01 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.68 2np0 n TYR 364 Cb 0.47 -0.09 0.05 0.00 -0.02 0.00 0.00 39.34 39.76 2np0 n TYR 364 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2np0 n LYS 365 N -0.44 -5.03 -4.86 -0.72 5.02 0.05 -5.01 118.16 107.17 2np0 n LYS 365 Ca 0.16 0.70 -0.33 0.00 -2.02 0.00 0.00 58.31 56.82 2np0 n LYS 365 Cb 0.32 -5.38 -0.14 0.00 -0.02 0.00 0.00 35.03 29.82 2np0 n LYS 365 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2np0 s ILE 366 N -3.55 3.02 0.25 -0.18 1.01 -0.01 -4.96 121.20 116.79 2np0 s ILE 366 Ca 0.06 -0.71 -0.19 0.00 0.00 0.00 0.00 60.65 59.81 2np0 s ILE 366 Cb -0.01 -2.21 -0.09 0.00 0.01 0.00 0.00 42.46 40.16 2np0 s ILE 366 CO 0.78 0.56 0.74 -0.75 0.00 0.00 0.00 174.94 176.28 2np0 s LYS 367 N -0.27 4.21 0.21 2.79 2.20 -1.26 -4.44 119.74 123.18 2np0 s LYS 367 Ca 0.02 0.84 -0.08 0.00 -0.36 0.00 0.00 55.97 56.39 2np0 s LYS 367 Cb -0.13 -2.76 -0.02 0.00 -1.51 0.00 0.00 37.83 33.42 2np0 s LYS 367 CO 0.03 0.32 0.31 -0.08 -0.36 0.00 0.00 175.35 175.58 2np0 s THR 368 N -1.65 0.02 0.86 3.43 -1.32 -1.26 -4.70 115.64 111.02 2np0 s THR 368 Ca 0.46 -1.61 -0.12 0.00 -1.21 0.00 0.00 61.69 59.21 2np0 s THR 368 Cb -0.15 -2.22 0.09 0.00 -1.51 0.00 0.00 72.50 68.71 2np0 s THR 368 CO 0.20 -0.07 1.03 -2.11 -2.21 0.00 0.00 174.62 171.46 2np0 n ARG 369 N -0.30 -0.12 0.07 7.08 1.85 -1.26 -4.93 116.66 119.05 2np0 n ARG 369 Ca -0.02 0.04 0.13 0.00 -1.00 0.00 0.00 57.85 57.00 2np0 n ARG 369 Cb 0.63 -2.30 0.37 0.00 -1.05 0.00 0.00 32.46 30.12 2np0 n ARG 369 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2np0 n ALA 370 N -3.64 2.51 -3.59 2.89 0.00 -1.26 -4.90 120.51 112.52 2np0 n ALA 370 Ca 0.12 -0.11 -0.12 0.00 0.00 0.00 0.00 53.44 53.33 2np0 n ALA 370 Cb 0.51 -1.38 -0.06 0.00 0.00 0.00 0.00 19.45 18.53 2np0 n ALA 370 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2np0 s SER 371 N -4.15 -0.49 0.40 0.00 0.15 -1.26 -4.69 113.70 103.65 2np0 s SER 371 Ca 0.10 0.72 0.26 0.00 0.70 0.00 0.00 55.95 57.72 2np0 s SER 371 Cb 0.14 0.64 1.39 0.00 -1.71 0.00 0.00 66.02 66.48 2np0 s SER 371 CO 0.62 -0.33 1.59 0.22 1.20 0.00 0.00 173.24 176.54 2np0 h TYR 372 N 3.39 0.68 -0.17 3.44 3.20 -1.91 0.28 116.97 125.87 2np0 h TYR 372 Ca -0.24 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.66 2np0 h TYR 372 Cb 1.16 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.27 2np0 h TYR 372 CO 0.33 -0.35 0.00 1.19 -1.64 0.00 0.00 178.16 177.69 2np0 n PHE 373 N -4.98 0.22 -2.21 -3.82 3.01 -1.26 -4.95 117.46 103.46 2np0 n PHE 373 Ca 0.38 -0.11 -0.34 0.00 1.01 0.00 0.00 57.45 58.39 2np0 n PHE 373 Cb 1.38 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.85 2np0 n PHE 373 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2np0 s SER 374 N -1.50 5.73 0.90 4.37 0.01 0.08 -5.00 113.70 118.29 2np0 s SER 374 Ca 0.30 2.08 -0.12 0.00 1.31 0.00 0.00 55.95 59.53 2np0 s SER 374 Cb 0.16 -2.57 0.09 0.00 0.21 0.00 0.00 66.02 63.91 2np0 s SER 374 CO 0.24 -1.21 0.89 0.47 0.41 0.00 0.00 173.24 174.04 2np0 n ASP 375 N -1.48 -0.41 -4.33 2.44 9.92 -1.26 -5.01 116.55 116.42 2np0 n ASP 375 Ca 0.11 0.43 -0.25 0.00 -0.53 0.00 0.00 54.79 54.55 2np0 n ASP 375 Cb 0.51 -1.38 -0.12 0.00 -0.64 0.00 0.00 41.12 39.49 2np0 n ASP 375 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2np0 s SER 376 N -2.28 2.84 0.41 -2.24 0.01 -1.26 -4.64 113.70 106.54 2np0 s SER 376 Ca 0.65 -0.76 0.08 0.00 1.31 0.00 0.00 55.95 57.23 2np0 s SER 376 Cb -0.24 -0.17 -0.01 0.00 0.21 0.00 0.00 66.02 65.81 2np0 s SER 376 CO 0.60 0.07 0.45 -0.76 0.41 0.00 0.00 173.24 174.01 2np0 s LEU 377 N -2.18 3.51 0.63 2.44 1.43 -1.05 -5.01 118.68 118.45 2np0 s LEU 377 Ca 0.12 -0.60 -0.16 0.00 -1.03 0.00 0.00 54.13 52.45 2np0 s LEU 377 Cb -0.09 -2.31 -0.02 0.00 0.03 0.00 0.00 46.19 43.80 2np0 s LEU 377 CO 0.06 -0.69 1.11 -2.84 0.23 0.00 0.00 176.35 174.22 2np0 s PRO 378 N -4.22 2.96 0.77 1.29 0.02 -1.26 -4.09 135.00 130.47 2np0 s PRO 378 Ca 0.51 1.42 -0.12 0.00 0.02 0.00 0.00 61.00 62.82 2np0 s PRO 378 Cb -0.06 -1.97 0.06 0.00 0.02 0.00 0.00 34.50 32.55 2np0 s PRO 378 CO 0.30 -1.13 1.14 -1.25 -0.33 0.00 0.00 177.00 175.73 2np0 s PRO 379 N -3.92 2.06 0.21 5.54 0.04 -1.26 -4.38 135.00 133.29 2np0 s PRO 379 Ca 0.68 1.45 0.04 0.00 0.04 0.00 0.00 61.00 63.21 2np0 s PRO 379 Cb -0.21 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 32.43 2np0 s PRO 379 CO 0.38 -1.83 -0.05 0.14 0.04 0.00 0.00 177.00 175.68 2np0 s VAL 380 N -2.49 1.20 -0.21 -0.36 -7.23 -0.94 -4.38 120.40 105.99 2np0 s VAL 380 Ca 0.67 -2.07 -0.08 0.00 -1.81 0.00 0.00 61.98 58.70 2np0 s VAL 380 Cb -0.22 -2.19 -0.04 0.00 0.56 0.00 0.00 36.38 34.49 2np0 s VAL 380 CO 0.51 -0.46 0.08 -0.75 -0.31 0.00 0.00 175.10 174.16 2np0 s LYS 381 N -3.80 3.89 -0.39 4.82 2.20 -0.78 -1.84 119.74 123.84 2np0 s LYS 381 Ca 0.25 -0.37 -0.27 0.00 -0.36 0.00 0.00 55.97 55.21 2np0 s LYS 381 Cb 0.04 -3.28 0.02 0.00 -1.51 0.00 0.00 37.83 33.10 2np0 s LYS 381 CO 0.07 0.12 1.00 0.42 -0.36 0.00 0.00 175.35 176.59 2np0 s ILE 382 N 0.81 4.48 0.10 5.43 -1.09 0.65 -1.62 121.20 129.96 2np0 s ILE 382 Ca 0.04 1.27 -0.35 0.00 -2.23 0.00 0.00 60.65 59.38 2np0 s ILE 382 Cb -0.13 -4.42 -0.15 0.00 -1.58 0.00 0.00 42.46 36.18 2np0 s ILE 382 CO 0.02 -0.65 1.56 0.11 -1.23 0.00 0.00 174.94 174.75 2np0 h LYS 383 N 8.61 -0.75 -2.18 2.79 1.57 -1.78 -3.40 116.57 121.42 2np0 h LYS 383 Ca -0.23 0.05 -0.38 0.00 -1.87 0.00 0.00 60.65 58.23 2np0 h LYS 383 Cb 1.07 0.17 -0.34 0.00 0.08 0.00 0.00 32.23 33.21 2np0 h LYS 383 CO 1.03 -0.50 -0.68 1.21 -0.57 0.00 0.00 179.45 179.94 2np0 s ASN 384 N -4.64 1.80 0.30 0.86 2.47 -1.26 -4.97 114.94 109.50 2np0 s ASN 384 Ca -0.17 -1.14 0.24 0.00 0.42 0.00 0.00 52.86 52.21 2np0 s ASN 384 Cb 0.06 0.38 1.07 0.00 -1.45 0.00 0.00 41.25 41.31 2np0 s ASN 384 CO 0.61 -0.35 1.72 -0.07 -3.72 0.00 0.00 177.10 175.29 2np0 h LEU 385 N 7.85 0.00 -0.93 3.21 3.38 -1.94 -2.59 115.31 124.30 2np0 h LEU 385 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2np0 h LEU 385 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2np0 h LEU 385 CO 0.30 0.00 0.00 0.18 0.09 0.00 0.00 178.44 179.01 2np0 n LEU 386 N -2.30 1.42 -4.47 1.67 4.77 -1.26 -4.63 117.00 112.20 2np0 n LEU 386 Ca 0.01 -0.53 -0.43 0.00 -0.03 0.00 0.00 56.01 55.03 2np0 n LEU 386 Cb 0.18 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.13 2np0 n LEU 386 CO 0.18 0.26 -0.00 -0.62 -1.33 0.00 0.00 177.39 175.87 2np0 s ASP 387 N -1.81 6.14 0.00 -1.43 -1.08 -0.98 -4.95 116.67 112.57 2np0 s ASP 387 Ca 0.36 -0.81 0.15 0.00 -0.52 0.00 0.00 52.55 51.74 2np0 s ASP 387 Cb 0.19 -2.18 0.89 0.00 -1.46 0.00 0.00 42.92 40.36 2np0 s ASP 387 CO 0.30 -0.49 1.36 0.59 0.52 0.00 0.00 175.17 177.45 2np0 n ASN 388 N 5.32 0.00 0.23 -0.34 3.02 -1.25 -0.37 115.26 121.87 2np0 n ASN 388 Ca -0.10 -0.36 0.14 0.00 -0.03 0.00 0.00 54.58 54.23 2np0 n ASN 388 Cb 0.47 -0.06 0.33 0.00 -0.61 0.00 0.00 39.78 39.90 2np0 n ASN 388 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2np0 h GLU 389 N 0.00 0.00 0.00 3.52 4.39 -1.94 -3.40 114.58 117.14 2np0 h GLU 389 Ca 0.00 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.51 2np0 h GLU 389 Cb 0.03 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 2np0 h GLU 389 CO 0.00 0.00 -1.62 -0.89 -1.16 0.00 0.00 179.01 175.34 2np0 n ILE 390 N -3.05 0.66 -3.88 3.13 5.41 0.50 -5.04 119.36 117.09 2np0 n ILE 390 Ca 0.03 -0.15 -0.18 0.00 1.00 0.00 0.00 62.75 63.45 2np0 n ILE 390 Cb 0.46 -1.67 -0.17 0.00 -0.71 0.00 0.00 39.64 37.56 2np0 n ILE 390 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 2np0 s TYR 391 N -2.22 0.35 0.13 1.39 5.04 -0.32 -4.30 117.35 117.41 2np0 s TYR 391 Ca -0.16 0.00 0.07 0.00 -2.44 0.00 0.00 57.07 54.54 2np0 s TYR 391 Cb 0.06 -0.48 -0.04 0.00 0.35 0.00 0.00 41.96 41.85 2np0 s TYR 391 CO 0.20 -0.17 -0.17 0.95 -1.34 0.00 0.00 175.55 175.03 2np0 s THR 392 N 1.30 1.56 0.23 4.34 -4.23 -0.71 -3.96 115.64 114.17 2np0 s THR 392 Ca -0.06 -1.69 -0.09 0.00 -1.18 0.00 0.00 61.69 58.66 2np0 s THR 392 Cb -0.13 -1.59 0.26 0.00 1.34 0.00 0.00 72.50 72.38 2np0 s THR 392 CO -0.02 -0.27 1.63 0.40 -0.54 0.00 0.00 174.62 175.82 2np0 h ILE 393 N 3.66 0.36 -0.09 2.99 2.04 -1.89 0.20 117.51 124.77 2np0 h ILE 393 Ca -0.42 -0.02 -0.24 0.00 1.00 0.00 0.00 64.86 65.17 2np0 h ILE 393 Cb 1.19 0.28 0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2np0 h ILE 393 CO 0.47 0.01 -0.88 -0.33 0.00 0.00 0.00 178.15 177.42 2np0 h GLU 394 N 0.07 0.75 0.00 2.37 3.07 -1.93 -3.40 114.58 115.51 2np0 h GLU 394 Ca 0.37 -0.68 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 2np0 h GLU 394 Cb 0.62 0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 2np0 h GLU 394 CO -0.65 1.28 0.00 0.39 -1.40 0.00 0.00 179.01 178.62 2np0 n GLU 395 N -3.90 1.03 0.00 2.33 1.02 -1.13 -5.10 120.64 114.90 2np0 n GLU 395 Ca -0.09 -0.87 0.00 0.00 -0.02 0.00 0.00 57.16 56.18 2np0 n GLU 395 Cb 0.80 -0.84 0.00 0.00 -0.02 0.00 0.00 31.44 31.38 2np0 n GLU 395 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2np0 n GLY 396 N -0.21 3.44 0.16 0.62 0.00 0.04 -1.86 105.19 107.38 2np0 n GLY 396 Ca 0.00 -0.16 0.07 0.00 0.00 0.00 0.00 46.02 45.92 2np0 n GLY 396 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2np0 h PHE 397 N 0.00 0.00 -1.06 1.61 -1.00 -1.87 -1.90 116.94 112.73 2np0 h PHE 397 Ca 0.00 0.00 -0.74 0.00 2.81 0.00 0.00 57.97 60.04 2np0 h PHE 397 Cb 0.00 0.00 -0.12 0.00 3.61 0.00 0.00 35.95 39.44 2np0 h PHE 397 CO 0.00 0.28 2.35 0.09 -1.61 0.00 0.00 178.31 179.41 2np0 n ASN 398 N -3.09 5.48 -4.51 2.17 3.02 -0.77 -4.47 115.26 113.08 2np0 n ASN 398 Ca 0.01 -3.05 -0.43 0.00 -0.03 0.00 0.00 54.58 51.09 2np0 n ASN 398 Cb 0.65 -1.49 -0.06 0.00 -0.61 0.00 0.00 39.78 38.27 2np0 n ASN 398 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2np0 s ILE 399 N 0.69 4.70 0.43 2.41 1.01 -1.25 -3.91 121.20 125.28 2np0 s ILE 399 Ca 0.44 0.12 0.20 0.00 0.00 0.00 0.00 60.65 61.40 2np0 s ILE 399 Cb 0.12 -4.32 0.40 0.00 0.01 0.00 0.00 42.46 38.67 2np0 s ILE 399 CO -0.03 -0.77 1.84 0.77 0.00 0.00 0.00 174.94 176.75 2np0 h SER 400 N 9.01 0.36 0.23 3.58 4.64 -1.91 0.86 113.55 130.33 2np0 h SER 400 Ca -0.26 0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.10 2np0 h SER 400 Cb 1.09 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2np0 h SER 400 CO 0.96 0.13 -0.05 0.44 -0.87 0.00 0.00 176.83 177.44 2np0 h ASP 401 N 0.35 0.00 -0.45 4.97 3.32 -1.99 -0.82 116.42 121.81 2np0 h ASP 401 Ca 0.49 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.44 2np0 h ASP 401 Cb 1.32 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.81 2np0 h ASP 401 CO -0.18 0.05 0.07 0.29 -1.72 0.00 0.00 179.24 177.76 2np0 n LYS 402 N -3.54 3.16 -3.88 3.56 5.02 0.20 -4.96 118.16 117.72 2np0 n LYS 402 Ca -0.02 -3.01 -0.35 0.00 -2.02 0.00 0.00 58.31 52.91 2np0 n LYS 402 Cb 0.16 -1.99 0.02 0.00 -0.02 0.00 0.00 35.03 33.20 2np0 n LYS 402 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2np0 n ASP 403 N -0.41 -3.64 -0.05 4.39 8.00 -0.31 -4.92 116.55 119.61 2np0 n ASP 403 Ca 0.30 -1.11 0.01 0.00 0.71 0.00 0.00 54.79 54.70 2np0 n ASP 403 Cb 1.10 -2.74 0.02 0.00 -0.02 0.00 0.00 41.12 39.47 2np0 n ASP 403 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2np0 n MET 404 N -4.49 1.50 0.11 -1.24 2.81 -0.62 -4.80 117.12 110.39 2np0 n MET 404 Ca -0.15 -1.23 -0.24 0.00 -1.81 0.00 0.00 57.70 54.27 2np0 n MET 404 Cb 0.61 -0.84 -0.15 0.00 -0.71 0.00 0.00 33.22 32.12 2np0 n MET 404 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 2np0 h GLU 405 N 0.00 0.46 -6.71 0.03 4.81 -1.71 -2.90 114.58 108.56 2np0 h GLU 405 Ca 0.00 -0.78 -0.53 0.00 -0.13 0.00 0.00 59.36 57.93 2np0 h GLU 405 Cb 0.81 0.29 0.06 0.00 0.63 0.00 0.00 28.75 30.54 2np0 h GLU 405 CO 0.00 1.37 0.83 0.15 -0.73 0.00 0.00 179.01 180.63 2np0 s LYS 406 N -2.57 4.22 -1.35 1.92 1.02 -1.26 -3.11 119.74 118.61 2np0 s LYS 406 Ca -0.13 2.37 0.00 0.00 0.02 0.00 0.00 55.97 58.24 2np0 s LYS 406 Cb 0.04 -3.11 0.00 0.00 -0.52 0.00 0.00 37.83 34.24 2np0 s LYS 406 CO 0.89 -0.52 0.00 0.39 -0.92 0.00 0.00 175.35 175.19 2np0 n GLU 407 N 2.87 -1.89 -3.95 1.68 1.02 -1.26 -1.81 120.64 117.29 2np0 n GLU 407 Ca 0.09 0.76 -0.30 0.00 -0.02 0.00 0.00 57.16 57.69 2np0 n GLU 407 Cb 0.39 -5.31 0.02 0.00 -0.02 0.00 0.00 31.44 26.52 2np0 n GLU 407 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2np0 n TYR 408 N -3.23 -2.16 0.02 -0.32 4.02 -1.18 -4.81 117.16 109.49 2np0 n TYR 408 Ca -0.17 0.88 0.02 0.00 -0.01 0.00 0.00 57.90 58.61 2np0 n TYR 408 Cb 0.60 -3.85 0.36 0.00 -0.02 0.00 0.00 39.34 36.43 2np0 n TYR 408 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2np0 h ARG 409 N -1.97 0.49 0.00 -0.72 3.08 -1.34 -1.83 114.38 112.09 2np0 h ARG 409 Ca -0.59 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.39 2np0 h ARG 409 Cb 1.38 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.34 2np0 h ARG 409 CO 0.68 0.46 0.00 0.41 -1.07 0.00 0.00 179.97 180.45 2np0 n GLY 410 N -1.09 -0.59 0.46 0.04 0.00 -1.10 -0.69 105.19 102.21 2np0 n GLY 410 Ca 0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.11 2np0 n GLY 410 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2np0 n GLN 411 N -1.53 1.47 -2.77 1.61 6.02 -0.69 -4.67 117.38 116.82 2np0 n GLN 411 Ca 0.00 -1.06 -0.42 0.00 -0.01 0.00 0.00 57.00 55.51 2np0 n GLN 411 Cb 0.03 -1.25 -0.03 0.00 1.02 0.00 0.00 30.24 30.00 2np0 n GLN 411 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2np0 s ASN 412 N -1.51 6.99 0.51 1.08 3.84 0.13 -1.20 114.94 124.79 2np0 s ASN 412 Ca 0.15 1.24 0.22 0.00 0.21 0.00 0.00 52.86 54.67 2np0 s ASN 412 Cb 0.12 -2.49 1.32 0.00 -0.55 0.00 0.00 41.25 39.64 2np0 s ASN 412 CO 0.28 -0.58 2.02 0.11 -2.79 0.00 0.00 177.10 176.14 2np0 h LYS 413 N 7.51 0.06 0.00 0.43 1.57 -1.26 -0.54 116.57 124.35 2np0 h LYS 413 Ca -0.22 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 2np0 h LYS 413 Cb 1.08 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2np0 h LYS 413 CO 0.92 0.04 -0.43 0.00 -0.57 0.00 0.00 179.45 179.41 2np0 n ALA 414 N -2.61 2.76 -0.08 3.86 0.00 -1.26 -4.34 120.51 118.85 2np0 n ALA 414 Ca 0.08 -0.19 -0.14 0.00 0.00 0.00 0.00 53.44 53.19 2np0 n ALA 414 Cb 0.49 -1.26 -0.07 0.00 0.00 0.00 0.00 19.45 18.61 2np0 n ALA 414 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2np0 n ILE 415 N -2.11 0.94 -2.52 0.00 5.41 -0.35 -4.75 119.36 115.98 2np0 n ILE 415 Ca 0.04 -0.31 -0.41 0.00 1.00 0.00 0.00 62.75 63.07 2np0 n ILE 415 Cb 0.43 -1.32 0.02 0.00 -0.71 0.00 0.00 39.64 38.06 2np0 n ILE 415 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2np0 n ASN 416 N -3.27 7.38 0.24 4.38 5.15 -0.40 -4.73 115.26 124.01 2np0 n ASN 416 Ca -0.31 -3.71 0.09 0.00 -0.60 0.00 0.00 54.58 50.05 2np0 n ASN 416 Cb 0.78 -1.15 0.62 0.00 -0.53 0.00 0.00 39.78 39.51 2np0 n ASN 416 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 2np0 h LYS 417 N 4.00 0.00 0.00 1.20 1.57 -1.81 -2.19 116.57 119.34 2np0 h LYS 417 Ca 0.54 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.32 2np0 h LYS 417 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2np0 h LYS 417 CO 1.22 0.15 0.00 0.00 -0.57 0.00 0.00 179.45 180.25 2np0 n GLN 418 N -4.00 0.98 -0.01 3.15 0.00 -1.26 -3.35 117.38 112.89 2np0 n GLN 418 Ca -0.02 0.00 0.03 0.00 0.00 0.00 0.00 57.00 57.01 2np0 n GLN 418 Cb 0.23 -1.43 -0.12 0.00 0.00 0.00 0.00 30.24 28.92 2np0 n GLN 418 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2np0 n ALA 419 N -0.93 2.23 -2.12 2.61 0.00 -0.82 -4.91 120.51 116.56 2np0 n ALA 419 Ca 0.20 -0.68 -0.09 0.00 0.00 0.00 0.00 53.44 52.88 2np0 n ALA 419 Cb 0.09 -0.72 -0.10 0.00 0.00 0.00 0.00 19.45 18.72 2np0 n ALA 419 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2np0 s TYR 420 N -3.10 0.70 0.04 0.00 -0.85 -1.21 -2.24 117.35 110.68 2np0 s TYR 420 Ca -0.06 -1.09 0.09 0.00 -0.52 0.00 0.00 57.07 55.49 2np0 s TYR 420 Cb 0.10 -0.45 -0.03 0.00 0.38 0.00 0.00 41.96 41.97 2np0 s TYR 420 CO 0.85 -0.37 -0.25 -1.21 -1.52 0.00 0.00 175.55 173.05 2np0 s GLU 421 N -3.94 1.72 0.60 -3.49 2.02 -0.64 -4.92 118.70 110.05 2np0 s GLU 421 Ca 0.13 -1.06 -0.16 0.00 0.02 0.00 0.00 54.97 53.90 2np0 s GLU 421 Cb 0.07 -1.87 -0.03 0.00 0.10 0.00 0.00 34.13 32.40 2np0 s GLU 421 CO -0.06 0.48 1.06 -1.21 0.02 0.00 0.00 175.26 175.56 2np0 s GLU 422 N -1.18 3.26 -0.13 1.61 0.41 -1.26 -1.87 118.70 119.54 2np0 s GLU 422 Ca 0.11 1.23 -0.11 0.00 -0.41 0.00 0.00 54.97 55.79 2np0 s GLU 422 Cb -0.10 -2.02 -0.05 0.00 -1.78 0.00 0.00 34.13 30.18 2np0 s GLU 422 CO 0.02 -0.86 0.23 0.42 -0.49 0.00 0.00 175.26 174.58 2np0 s ILE 423 N -2.43 5.35 0.14 -1.63 1.01 -1.26 -4.86 121.20 117.52 2np0 s ILE 423 Ca 0.64 0.41 -0.33 0.00 0.00 0.00 0.00 60.65 61.37 2np0 s ILE 423 Cb -0.17 -3.54 -0.12 0.00 0.01 0.00 0.00 42.46 38.64 2np0 s ILE 423 CO 0.37 0.50 1.72 -0.24 0.00 0.00 0.00 174.94 177.28 2np0 n SER 424 N 2.84 3.64 0.00 3.58 2.88 -1.26 -4.83 113.62 120.47 2np0 n SER 424 Ca -0.16 1.04 0.07 0.00 -1.33 0.00 0.00 58.87 58.50 2np0 n SER 424 Cb 0.53 -1.50 0.41 0.00 -0.75 0.00 0.00 64.21 62.90 2np0 n SER 424 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2np0 n LYS 425 N 4.44 0.57 0.24 -1.46 4.76 -1.26 -1.12 118.16 124.32 2np0 n LYS 425 Ca 0.17 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.74 2np0 n LYS 425 Cb 0.33 -1.38 0.55 0.00 -1.84 0.00 0.00 35.03 32.68 2np0 n LYS 425 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 2np0 h GLU 426 N 0.00 0.00 -0.01 1.97 4.11 -2.03 -3.21 114.58 115.42 2np0 h GLU 426 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2np0 h GLU 426 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2np0 h GLU 426 CO 0.00 0.13 -0.51 0.72 0.07 0.00 0.00 179.01 179.42 2np0 n HIS 427 N -3.29 0.00 -3.71 2.06 8.25 -0.28 -4.95 115.22 113.30 2np0 n HIS 427 Ca 0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.10 2np0 n HIS 427 Cb 0.38 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.42 2np0 n HIS 427 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2np0 s LEU 428 N -2.38 4.29 -0.04 2.41 1.43 -1.21 -2.75 118.68 120.42 2np0 s LEU 428 Ca 0.13 0.41 0.05 0.00 -1.03 0.00 0.00 54.13 53.70 2np0 s LEU 428 Cb 0.15 -2.18 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 2np0 s LEU 428 CO 0.54 0.24 -0.21 0.00 0.23 0.00 0.00 176.35 177.15 2np0 s ALA 429 N -0.12 1.79 -0.00 4.21 0.00 0.06 -4.92 121.76 122.78 2np0 s ALA 429 Ca 0.13 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.24 2np0 s ALA 429 Cb -0.12 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.44 2np0 s ALA 429 CO 0.02 0.35 -0.01 0.08 0.00 0.00 0.00 175.76 176.21 2np0 s VAL 430 N -0.12 0.07 -0.08 0.00 1.01 -1.26 0.03 120.40 120.05 2np0 s VAL 430 Ca -0.02 -0.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 2np0 s VAL 430 Cb -0.12 -0.08 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 2np0 s VAL 430 CO 0.02 0.03 1.27 -0.47 0.00 0.00 0.00 175.10 175.95 2np0 s TYR 431 N 0.07 2.98 0.19 5.22 5.04 -1.26 -4.77 117.35 124.82 2np0 s TYR 431 Ca -0.00 1.04 0.11 0.00 -2.44 0.00 0.00 57.07 55.78 2np0 s TYR 431 Cb -0.01 -3.51 -0.04 0.00 0.35 0.00 0.00 41.96 38.75 2np0 s TYR 431 CO -0.00 -1.72 -0.24 0.15 -1.34 0.00 0.00 175.55 172.40 2np0 s LYS 432 N 2.73 1.50 -0.21 4.97 1.02 0.12 -1.27 119.74 128.60 2np0 s LYS 432 Ca 0.57 -1.51 -0.03 0.00 0.02 0.00 0.00 55.97 55.02 2np0 s LYS 432 Cb -0.25 -1.81 -0.01 0.00 -0.52 0.00 0.00 37.83 35.24 2np0 s LYS 432 CO 0.21 0.39 -0.06 0.42 -0.92 0.00 0.00 175.35 175.39 2np0 s ILE 433 N -1.69 3.30 -0.44 2.17 -1.09 0.95 -1.53 121.20 122.87 2np0 s ILE 433 Ca 0.20 -0.52 -0.18 0.00 -2.23 0.00 0.00 60.65 57.92 2np0 s ILE 433 Cb -0.08 -2.48 0.03 0.00 -1.58 0.00 0.00 42.46 38.35 2np0 s ILE 433 CO 0.10 0.44 0.47 -1.58 -1.23 0.00 0.00 174.94 173.14 2np0 s GLN 434 N 1.30 3.09 -0.42 2.79 0.74 -0.07 -1.15 119.66 125.95 2np0 s GLN 434 Ca 0.04 -0.82 -0.16 0.00 0.05 0.00 0.00 55.36 54.47 2np0 s GLN 434 Cb -0.14 -4.00 0.03 0.00 1.10 0.00 0.00 33.01 29.99 2np0 s GLN 434 CO -0.03 -0.94 0.34 -1.64 -0.55 0.00 0.00 175.29 172.48 2np0 s MET 435 N 2.19 3.00 -0.14 1.67 -1.94 0.22 -1.07 119.30 123.24 2np0 s MET 435 Ca 0.12 -0.99 -0.06 0.00 -1.71 0.00 0.00 55.69 53.05 2np0 s MET 435 Cb -0.18 -3.99 -0.04 0.00 2.01 0.00 0.00 34.83 32.63 2np0 s MET 435 CO 0.13 -0.80 0.09 0.00 -0.01 0.00 0.00 175.02 174.42 2np0 s LYS 437 N -0.50 4.26 0.31 0.00 1.02 -0.56 -1.10 119.74 123.17 2np0 s LYS 437 Ca 0.11 2.10 0.07 0.00 0.02 0.00 0.00 55.97 58.27 2np0 s LYS 437 Cb -0.12 -3.54 -0.06 0.00 -0.52 0.00 0.00 37.83 33.59 2np0 s LYS 437 CO 0.02 -0.61 -0.04 -1.54 -0.92 0.00 0.00 175.35 172.25 2np0 s SER 438 N 1.96 3.05 0.09 2.83 1.04 -0.53 -4.79 113.70 117.34 2np0 s SER 438 Ca 0.67 -1.24 0.04 0.00 0.48 0.00 0.00 55.95 55.90 2np0 s SER 438 Cb -0.35 -0.22 -0.03 0.00 0.10 0.00 0.00 66.02 65.51 2np0 s SER 438 CO 0.29 -0.36 -0.10 0.54 0.98 0.00 0.00 173.24 174.59 2np0 s VAL 439 N -2.93 0.90 0.00 5.02 0.11 -1.26 -3.74 120.40 118.50 2np0 s VAL 439 Ca 0.32 -1.56 0.00 0.00 -2.93 0.00 0.00 61.98 57.80 2np0 s VAL 439 Cb 0.05 -1.27 0.00 0.00 -1.53 0.00 0.00 36.38 33.63 2np0 s VAL 439 CO 0.14 -0.53 0.57 0.29 -3.33 0.00 0.00 175.10 172.25 2np0 n LYS 440 N 0.69 0.34 -2.25 1.54 5.02 -1.26 -5.03 118.16 117.21 2np0 n LYS 440 Ca -0.17 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.70 2np0 n LYS 440 Cb 0.57 -1.33 -0.03 0.00 -0.02 0.00 0.00 35.03 34.22 2np0 n LYS 440 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 2np0 s PRO 442 N 1.13 4.25 0.00 1.97 0.02 -1.26 -5.24 135.00 135.87 2np0 s PRO 442 Ca 0.00 1.91 0.00 0.00 0.02 0.00 0.00 61.00 62.93 2np0 s PRO 442 Cb 0.00 -3.72 0.00 0.00 0.02 0.00 0.00 34.50 30.80 2np0 s PRO 442 CO 0.00 -0.66 0.00 0.41 -0.33 0.00 0.00 177.00 176.42 2np0 n GLY 443 N 3.72 -0.48 3.64 0.52 0.00 -1.26 -5.00 105.19 106.34 2np0 n GLY 443 Ca 0.14 -1.49 -0.39 0.00 0.00 0.00 0.00 46.02 44.28 2np0 n GLY 443 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2np0 s ILE 444 N 0.00 5.11 -0.13 -0.61 1.01 -1.26 -5.00 121.20 120.31 2np0 s ILE 444 Ca 0.00 0.87 -0.00 0.00 0.00 0.00 0.00 60.65 61.52 2np0 s ILE 444 Cb 0.00 -3.81 0.03 0.00 0.01 0.00 0.00 42.46 38.68 2np0 s ILE 444 CO 0.00 0.15 -0.09 0.00 0.00 0.00 0.00 174.94 175.00 2np0 s ILE 446 N 1.63 5.32 -0.12 0.00 1.09 0.10 -4.87 121.20 124.36 2np0 s ILE 446 Ca 0.04 0.27 -0.28 0.00 -1.10 0.00 0.00 60.65 59.58 2np0 s ILE 446 Cb -0.13 -3.54 -0.01 0.00 -1.06 0.00 0.00 42.46 37.71 2np0 s ILE 446 CO -0.09 0.31 0.93 -1.81 -0.10 0.00 0.00 174.94 174.18 2np0 s ASP 447 N 1.16 7.13 -0.06 3.58 1.01 -1.26 -0.61 116.67 127.62 2np0 s ASP 447 Ca 0.09 1.39 0.02 0.00 0.71 0.00 0.00 52.55 54.76 2np0 s ASP 447 Cb -0.14 -2.51 0.01 0.00 1.01 0.00 0.00 42.92 41.29 2np0 s ASP 447 CO 0.06 -0.41 -0.11 -0.69 0.21 0.00 0.00 175.17 174.23 2np0 s VAL 448 N 1.97 1.01 0.32 -1.27 1.01 -0.30 -4.96 120.40 118.19 2np0 s VAL 448 Ca 0.44 -0.41 -0.29 0.00 0.00 0.00 0.00 61.98 61.72 2np0 s VAL 448 Cb -0.18 -0.94 -0.11 0.00 0.00 0.00 0.00 36.38 35.16 2np0 s VAL 448 CO 0.16 0.33 1.48 -1.81 0.00 0.00 0.00 175.10 175.26 2np0 s ASP 449 N 0.67 6.47 0.25 3.32 1.01 -1.26 -0.03 116.67 127.10 2np0 s ASP 449 Ca -0.13 2.90 -0.02 0.00 0.71 0.00 0.00 52.55 56.00 2np0 s ASP 449 Cb -0.15 -2.65 0.49 0.00 1.01 0.00 0.00 42.92 41.62 2np0 s ASP 449 CO 0.03 -0.80 1.77 -1.13 0.21 0.00 0.00 175.17 175.24 2np0 h ASN 450 N 3.94 0.52 0.93 0.27 -1.24 -1.47 -1.45 115.58 117.09 2np0 h ASN 450 Ca -0.49 0.08 0.00 0.00 0.71 0.00 0.00 56.30 56.61 2np0 h ASN 450 Cb 1.23 -0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.28 2np0 h ASN 450 CO 0.71 0.24 0.00 1.05 -1.29 0.00 0.00 177.43 178.14 2np0 h GLU 451 N 0.63 0.00 0.00 6.67 4.11 -1.81 -1.43 114.58 122.75 2np0 h GLU 451 Ca 0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.87 2np0 h GLU 451 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2np0 h GLU 451 CO -0.34 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.49 2np0 n ASP 452 N -2.51 0.27 -4.59 3.06 8.00 -0.55 -4.85 116.55 115.39 2np0 n ASP 452 Ca 0.02 0.56 -0.29 0.00 0.71 0.00 0.00 54.79 55.79 2np0 n ASP 452 Cb 0.28 -0.62 0.16 0.00 -0.02 0.00 0.00 41.12 40.92 2np0 n ASP 452 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2np0 s LEU 453 N -3.58 1.85 -0.19 0.64 1.43 -0.54 -4.99 118.68 113.30 2np0 s LEU 453 Ca 0.07 0.88 -0.27 0.00 -1.03 0.00 0.00 54.13 53.78 2np0 s LEU 453 Cb 0.10 -3.08 -0.01 0.00 0.03 0.00 0.00 46.19 43.24 2np0 s LEU 453 CO 0.34 -2.85 0.91 -0.36 0.23 0.00 0.00 176.35 174.62 2np0 s PHE 454 N -3.26 3.39 -0.24 0.29 0.40 -0.66 -4.60 117.98 113.30 2np0 s PHE 454 Ca 0.66 1.34 -0.29 0.00 -0.60 0.00 0.00 56.93 58.04 2np0 s PHE 454 Cb -0.14 -3.12 -0.00 0.00 0.51 0.00 0.00 43.02 40.28 2np0 s PHE 454 CO 0.54 -0.34 1.25 0.12 0.70 0.00 0.00 175.22 177.49 2np0 s PHE 455 N 2.56 2.84 -0.17 0.36 5.36 -1.26 -0.92 117.98 126.75 2np0 s PHE 455 Ca 0.41 1.00 -0.01 0.00 -0.96 0.00 0.00 56.93 57.37 2np0 s PHE 455 Cb -0.16 -3.66 0.04 0.00 -0.34 0.00 0.00 43.02 38.90 2np0 s PHE 455 CO 0.10 -1.54 -0.04 0.42 -1.46 0.00 0.00 175.22 172.71 2np0 s ILE 456 N 3.84 1.07 0.28 3.12 1.01 -1.26 -4.40 121.20 124.86 2np0 s ILE 456 Ca 0.54 -0.66 -0.30 0.00 0.00 0.00 0.00 60.65 60.23 2np0 s ILE 456 Cb -0.18 -1.28 -0.11 0.00 0.01 0.00 0.00 42.46 40.89 2np0 s ILE 456 CO 0.17 0.08 1.53 0.00 0.00 0.00 0.00 174.94 176.71 2np0 s ALA 457 N 1.64 3.69 0.53 9.38 0.00 -0.10 0.16 121.76 137.06 2np0 s ALA 457 Ca 0.00 1.48 -0.20 0.00 0.00 0.00 0.00 51.96 53.23 2np0 s ALA 457 Cb -0.16 -3.61 -0.06 0.00 0.00 0.00 0.00 23.12 19.30 2np0 s ALA 457 CO -0.07 -0.89 1.17 0.34 0.00 0.00 0.00 175.76 176.30 2np0 s ASP 458 N 0.39 5.71 0.41 0.00 3.68 0.72 -4.51 116.67 123.06 2np0 s ASP 458 Ca 0.61 2.29 0.13 0.00 2.13 0.00 0.00 52.55 57.71 2np0 s ASP 458 Cb -0.45 -2.59 0.85 0.00 -1.45 0.00 0.00 42.92 39.27 2np0 s ASP 458 CO 0.47 -1.23 1.91 0.50 0.13 0.00 0.00 175.17 176.95 2np0 h LYS 459 N 1.39 0.04 0.00 4.34 3.64 -1.89 0.80 116.57 124.90 2np0 h LYS 459 Ca -0.50 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2np0 h LYS 459 Cb 1.27 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 2np0 h LYS 459 CO 0.57 0.29 0.00 0.09 -2.27 0.00 0.00 179.45 178.14 2np0 n ASN 460 N -4.22 0.00 0.20 4.20 3.02 -1.26 -2.41 115.26 114.79 2np0 n ASN 460 Ca -0.02 -0.06 0.14 0.00 -0.03 0.00 0.00 54.58 54.62 2np0 n ASN 460 Cb 0.31 -0.11 0.55 0.00 -0.61 0.00 0.00 39.78 39.93 2np0 n ASN 460 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2np0 h SER 461 N 0.00 0.00 -4.02 6.41 0.02 -1.05 -3.47 113.55 111.45 2np0 h SER 461 Ca 0.00 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 60.26 2np0 h SER 461 Cb 0.02 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 62.29 2np0 h SER 461 CO 0.00 0.00 -0.82 -0.36 -1.14 0.00 0.00 176.83 174.51 2np0 s PHE 462 N -3.45 2.57 0.15 3.45 0.40 -1.01 -4.62 117.98 115.47 2np0 s PHE 462 Ca 0.03 -0.45 -0.30 0.00 -0.60 0.00 0.00 56.93 55.61 2np0 s PHE 462 Cb 0.09 -1.63 -0.07 0.00 0.51 0.00 0.00 43.02 41.92 2np0 s PHE 462 CO 0.49 -0.04 1.23 0.45 0.70 0.00 0.00 175.22 178.06 2np0 s SER 463 N -0.37 7.03 -0.46 1.36 0.15 -1.26 -4.94 113.70 115.20 2np0 s SER 463 Ca 0.03 2.21 0.04 0.00 0.70 0.00 0.00 55.95 58.92 2np0 s SER 463 Cb -0.12 -2.60 0.60 0.00 -1.71 0.00 0.00 66.02 62.19 2np0 s SER 463 CO 0.02 -0.45 1.86 -0.90 1.20 0.00 0.00 173.24 174.97 2np0 n ASP 464 N 3.07 4.30 0.26 5.45 5.75 -1.26 -4.59 116.55 129.52 2np0 n ASP 464 Ca 0.07 -3.67 0.09 0.00 -0.01 0.00 0.00 54.79 51.26 2np0 n ASP 464 Cb 0.45 -0.82 0.66 0.00 -1.03 0.00 0.00 41.12 40.37 2np0 n ASP 464 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2np0 h ASP 465 N 1.21 0.00 -0.72 -1.12 5.19 -1.96 -2.34 116.42 116.68 2np0 h ASP 465 Ca 0.57 0.00 0.21 0.00 -0.62 0.00 0.00 57.03 57.18 2np0 h ASP 465 Cb 2.29 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 41.78 2np0 h ASP 465 CO 1.08 0.06 0.76 -0.07 -3.12 0.00 0.00 179.24 177.96 2np0 h LEU 466 N 0.00 0.00 -0.01 1.55 3.38 -1.94 0.01 115.31 118.30 2np0 h LEU 466 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2np0 h LEU 466 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2np0 h LEU 466 CO 0.01 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.00 2np0 n SER 467 N -3.59 0.09 -4.78 -0.43 3.41 -0.88 -1.85 113.62 105.59 2np0 n SER 467 Ca 0.15 0.51 -0.35 0.00 -0.26 0.00 0.00 58.87 58.92 2np0 n SER 467 Cb 1.01 -0.53 -0.01 0.00 -0.26 0.00 0.00 64.21 64.42 2np0 n SER 467 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2np0 s LYS 468 N -3.01 3.46 0.79 4.33 1.02 -0.01 -3.20 119.74 123.11 2np0 s LYS 468 Ca 0.13 1.55 -0.11 0.00 0.02 0.00 0.00 55.97 57.56 2np0 s LYS 468 Cb 0.17 -2.03 0.07 0.00 -0.52 0.00 0.00 37.83 35.52 2np0 s LYS 468 CO 0.50 -0.75 1.09 -0.80 -0.92 0.00 0.00 175.35 174.47 2np0 s ASN 469 N -1.83 4.37 0.02 2.83 0.01 -1.26 -3.32 114.94 115.77 2np0 s ASN 469 Ca 0.71 1.78 0.04 0.00 -0.71 0.00 0.00 52.86 54.69 2np0 s ASN 469 Cb -0.22 -2.47 -0.02 0.00 0.41 0.00 0.00 41.25 38.95 2np0 s ASN 469 CO 0.25 -2.11 -0.13 -1.61 -1.51 0.00 0.00 177.10 171.99 2np0 s GLU 470 N -4.91 0.91 -0.40 -0.60 0.41 -0.50 -4.95 118.70 108.65 2np0 s GLU 470 Ca 0.61 -0.65 -0.05 0.00 -0.41 0.00 0.00 54.97 54.47 2np0 s GLU 470 Cb -0.17 -0.89 0.09 0.00 -1.78 0.00 0.00 34.13 31.38 2np0 s GLU 470 CO 0.56 0.23 0.21 0.50 -0.49 0.00 0.00 175.26 176.27 2np0 s ARG 471 N -0.90 2.30 -0.35 1.61 3.52 -1.26 -0.67 118.95 123.19 2np0 s ARG 471 Ca 0.02 -1.63 -0.19 0.00 -0.13 0.00 0.00 55.73 53.80 2np0 s ARG 471 Cb -0.07 -3.63 -0.00 0.00 -1.56 0.00 0.00 34.95 29.69 2np0 s ARG 471 CO 0.01 -0.99 0.54 0.42 -0.81 0.00 0.00 175.30 174.46 2np0 s ILE 472 N 1.27 4.99 0.53 4.11 -1.09 -0.36 -4.94 121.20 125.71 2np0 s ILE 472 Ca 0.04 0.38 0.02 0.00 -2.23 0.00 0.00 60.65 58.87 2np0 s ILE 472 Cb -0.23 -3.99 0.01 0.00 -1.58 0.00 0.00 42.46 36.67 2np0 s ILE 472 CO -0.01 -0.24 0.13 -1.61 -1.23 0.00 0.00 174.94 171.98 2np0 s GLU 473 N 2.45 2.22 0.49 2.79 2.02 -1.26 -0.60 118.70 126.81 2np0 s GLU 473 Ca 0.20 -2.31 0.24 0.00 0.02 0.00 0.00 54.97 53.12 2np0 s GLU 473 Cb -0.15 -1.70 1.25 0.00 0.10 0.00 0.00 34.13 33.63 2np0 s GLU 473 CO 0.14 -0.47 2.01 0.10 0.02 0.00 0.00 175.26 177.05 2np0 h TYR 474 N 1.13 0.00 -0.12 1.61 -0.00 -1.87 -3.08 116.97 114.64 2np0 h TYR 474 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.31 2np0 h TYR 474 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.05 2np0 h TYR 474 CO 1.41 0.17 0.00 0.27 -0.00 0.00 0.00 178.16 180.01 2np0 n ASN 475 N -3.74 2.62 -4.76 0.10 6.94 -1.26 -4.54 115.26 110.61 2np0 n ASN 475 Ca -0.02 -2.47 -0.41 0.00 -0.02 0.00 0.00 54.58 51.66 2np0 n ASN 475 Cb 0.28 -0.26 -0.02 0.00 -2.36 0.00 0.00 39.78 37.43 2np0 n ASN 475 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2np0 s THR 476 N -1.82 2.40 0.26 5.53 2.01 -1.16 -5.02 115.64 117.84 2np0 s THR 476 Ca 0.21 0.36 0.11 0.00 0.31 0.00 0.00 61.69 62.68 2np0 s THR 476 Cb 0.16 -3.23 -0.05 0.00 0.01 0.00 0.00 72.50 69.39 2np0 s THR 476 CO 0.06 0.07 -0.19 -1.10 -0.69 0.00 0.00 174.62 172.76 2np0 s GLN 477 N -1.01 1.60 0.00 4.92 -0.21 -1.26 -4.90 119.66 118.80 2np0 s GLN 477 Ca 0.57 -1.71 -0.00 0.00 0.02 0.00 0.00 55.36 54.24 2np0 s GLN 477 Cb -0.44 -1.65 -0.04 0.00 1.00 0.00 0.00 33.01 31.88 2np0 s GLN 477 CO 0.50 0.31 0.07 -1.54 -2.12 0.00 0.00 175.29 172.51 2np0 s SER 478 N -3.39 5.62 -0.25 5.90 1.04 -1.26 -5.03 113.70 116.33 2np0 s SER 478 Ca 0.28 0.13 0.01 0.00 0.48 0.00 0.00 55.95 56.84 2np0 s SER 478 Cb -0.05 -1.60 0.04 0.00 0.10 0.00 0.00 66.02 64.52 2np0 s SER 478 CO 0.13 0.27 -0.09 0.20 0.98 0.00 0.00 173.24 174.73 2np0 s ASN 479 N -1.75 4.30 -0.17 7.02 -0.87 -1.26 -5.08 114.94 117.13 2np0 s ASN 479 Ca 0.23 -1.12 -0.01 0.00 -1.57 0.00 0.00 52.86 50.39 2np0 s ASN 479 Cb -0.12 -1.60 0.04 0.00 -0.02 0.00 0.00 41.25 39.55 2np0 s ASN 479 CO 0.14 -0.16 -0.04 -0.31 -2.57 0.00 0.00 177.10 174.16 2np0 s TYR 480 N 1.22 1.61 -0.67 2.20 1.51 -1.26 -5.07 117.35 116.90 2np0 s TYR 480 Ca -0.04 -1.04 -0.17 0.00 -1.01 0.00 0.00 57.07 54.81 2np0 s TYR 480 Cb -0.18 -1.27 0.13 0.00 -0.11 0.00 0.00 41.96 40.53 2np0 s TYR 480 CO -0.05 -0.61 0.73 0.42 -1.11 0.00 0.00 175.55 174.93 2np0 s ILE 481 N 1.66 5.03 0.15 2.71 1.01 -1.26 -5.04 121.20 125.46 2np0 s ILE 481 Ca 0.01 -1.43 -0.30 0.00 0.00 0.00 0.00 60.65 58.92 2np0 s ILE 481 Cb -0.15 -4.49 -0.08 0.00 0.01 0.00 0.00 42.46 37.74 2np0 s ILE 481 CO -0.08 -1.11 1.28 -0.70 0.00 0.00 0.00 174.94 174.34 2np0 s GLU 482 N 2.01 4.41 -1.39 2.79 2.12 -1.26 -4.94 118.70 122.44 2np0 s GLU 482 Ca 0.14 1.96 -0.07 0.00 0.36 0.00 0.00 54.97 57.36 2np0 s GLU 482 Cb -0.20 -3.24 0.04 0.00 0.26 0.00 0.00 34.13 30.98 2np0 s GLU 482 CO 0.01 -0.25 2.62 0.09 -0.54 0.00 0.00 175.26 177.18 2np0 n ASN 483 N 3.12 8.24 -3.65 -1.70 3.02 -1.26 -4.87 115.26 118.16 2np0 n ASN 483 Ca 0.07 -2.94 -0.15 0.00 -0.03 0.00 0.00 54.58 51.53 2np0 n ASN 483 Cb 0.44 -1.43 -0.08 0.00 -0.61 0.00 0.00 39.78 38.10 2np0 n ASN 483 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2np0 s ASP 484 N 1.02 -0.44 -0.12 6.41 2.15 -1.26 -4.94 116.67 119.50 2np0 s ASP 484 Ca 0.60 0.48 -0.05 0.00 0.43 0.00 0.00 52.55 54.00 2np0 s ASP 484 Cb 0.19 0.50 0.06 0.00 -0.30 0.00 0.00 42.92 43.37 2np0 s ASP 484 CO -0.08 -0.49 0.26 0.12 -0.17 0.00 0.00 175.17 174.81 2np0 s PHE 485 N -1.07 -0.39 -0.25 -5.34 5.36 -1.25 -4.87 117.98 110.17 2np0 s PHE 485 Ca -0.11 0.90 -0.28 0.00 -0.96 0.00 0.00 56.93 56.48 2np0 s PHE 485 Cb -0.03 0.01 -0.04 0.00 -0.34 0.00 0.00 43.02 42.63 2np0 s PHE 485 CO 0.06 -0.30 1.96 -1.25 -1.46 0.00 0.00 175.22 174.24 2np0 s PRO 486 N 1.86 3.36 0.45 10.12 0.04 -1.26 -4.79 135.00 144.78 2np0 s PRO 486 Ca -0.04 1.78 0.25 0.00 0.04 0.00 0.00 61.00 63.03 2np0 s PRO 486 Cb -0.11 -4.25 0.91 0.00 0.04 0.00 0.00 34.50 31.09 2np0 s PRO 486 CO -0.09 -1.84 1.82 0.82 0.04 0.00 0.00 177.00 177.75 2np0 h ILE 487 N 6.80 0.45 0.00 0.56 1.08 -1.96 -1.85 117.51 122.59 2np0 h ILE 487 Ca -0.38 -1.08 0.00 0.00 -0.39 0.00 0.00 64.86 63.01 2np0 h ILE 487 Cb 1.20 1.78 0.00 0.00 -3.07 0.00 0.00 36.82 36.73 2np0 h ILE 487 CO 0.99 0.19 0.00 -0.55 -0.69 0.00 0.00 178.15 178.09 2np0 h ASN 488 N 0.00 0.00 0.16 1.72 -1.07 -1.99 -2.88 115.58 111.51 2np0 h ASN 488 Ca -0.00 0.00 -0.36 0.00 0.07 0.00 0.00 56.30 56.01 2np0 h ASN 488 Cb 0.76 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 36.98 2np0 h ASN 488 CO 0.03 0.00 -2.04 -0.62 0.07 0.00 0.00 177.43 174.86 2np0 n GLU 489 N -3.00 0.72 -0.35 4.14 1.02 -0.72 -2.94 120.64 119.51 2np0 n GLU 489 Ca 0.04 0.24 0.04 0.00 -0.02 0.00 0.00 57.16 57.45 2np0 n GLU 489 Cb 0.48 -1.69 0.11 0.00 -0.02 0.00 0.00 31.44 30.32 2np0 n GLU 489 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2np0 h LEU 490 N 0.05 -1.05 -1.70 -4.62 5.85 -1.57 0.45 115.31 112.72 2np0 h LEU 490 Ca -0.43 0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 2np0 h LEU 490 Cb 2.02 0.64 -0.00 0.00 0.37 0.00 0.00 40.66 43.69 2np0 h LEU 490 CO 0.06 -0.31 -0.13 0.40 -0.34 0.00 0.00 178.44 178.12 2np0 h ILE 491 N -0.00 0.45 -0.02 4.05 2.04 -1.49 -3.12 117.51 119.42 2np0 h ILE 491 Ca 0.43 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.62 2np0 h ILE 491 Cb 0.68 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 38.22 2np0 h ILE 491 CO -0.99 0.13 0.00 0.18 0.00 0.00 0.00 178.15 177.46 2np0 n LEU 492 N -3.46 1.47 -4.57 1.44 4.77 -0.73 -4.94 117.00 110.98 2np0 n LEU 492 Ca -0.01 -1.28 -0.40 0.00 -0.03 0.00 0.00 56.01 54.28 2np0 n LEU 492 Cb 0.29 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.34 2np0 n LEU 492 CO 0.30 0.35 1.59 -0.62 -1.33 0.00 0.00 177.39 177.68 2np0 s ASP 493 N -0.42 5.51 0.00 -1.43 -1.08 0.15 -4.85 116.67 114.55 2np0 s ASP 493 Ca 0.03 0.81 0.10 0.00 -0.52 0.00 0.00 52.55 52.98 2np0 s ASP 493 Cb 0.02 -2.53 0.54 0.00 -1.46 0.00 0.00 42.92 39.50 2np0 s ASP 493 CO 0.03 -2.10 1.36 0.35 0.52 0.00 0.00 175.17 175.33 2np0 n THR 494 N 7.35 0.05 0.46 1.71 -2.24 -1.26 -2.97 114.28 117.37 2np0 n THR 494 Ca 0.22 -0.06 0.07 0.00 -2.27 0.00 0.00 64.05 62.01 2np0 n THR 494 Cb 0.50 -0.08 -0.09 0.00 -2.10 0.00 0.00 70.33 68.56 2np0 n THR 494 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2np0 n ASP 495 N -0.49 0.97 -0.01 3.42 8.00 -1.26 -4.69 116.55 122.49 2np0 n ASP 495 Ca 0.08 -0.58 -0.12 0.00 0.71 0.00 0.00 54.79 54.88 2np0 n ASP 495 Cb 0.07 1.19 -0.07 0.00 -0.02 0.00 0.00 41.12 42.30 2np0 n ASP 495 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2np0 h LEU 496 N 0.00 0.12 -9.46 0.64 5.85 -1.92 -3.44 115.31 107.09 2np0 h LEU 496 Ca 0.00 -0.19 -0.58 0.00 0.84 0.00 0.00 57.88 57.95 2np0 h LEU 496 Cb 0.42 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.36 2np0 h LEU 496 CO 0.00 0.28 -0.12 -0.63 -0.34 0.00 0.00 178.44 177.63 2np0 s ILE 497 N -5.43 5.07 0.22 4.05 -1.09 -1.26 -4.99 121.20 117.77 2np0 s ILE 497 Ca -0.14 1.02 -0.31 0.00 -2.23 0.00 0.00 60.65 58.99 2np0 s ILE 497 Cb 0.05 -3.83 -0.11 0.00 -1.58 0.00 0.00 42.46 37.00 2np0 s ILE 497 CO 0.68 0.41 1.57 -0.55 -1.23 0.00 0.00 174.94 175.83 2np0 s SER 498 N 0.02 6.51 0.00 3.58 0.15 -1.26 -4.90 113.70 117.80 2np0 s SER 498 Ca 0.27 2.75 0.24 0.00 0.70 0.00 0.00 55.95 59.91 2np0 s SER 498 Cb -0.16 -2.61 0.27 0.00 -1.71 0.00 0.00 66.02 61.81 2np0 s SER 498 CO 0.13 -0.85 1.26 0.29 1.20 0.00 0.00 173.24 175.27 2np0 n LYS 499 N 3.21 0.78 -2.77 5.44 5.02 -1.26 -4.91 118.16 123.66 2np0 n LYS 499 Ca 0.11 -0.57 -0.41 0.00 -2.02 0.00 0.00 58.31 55.42 2np0 n LYS 499 Cb 0.38 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.86 2np0 n LYS 499 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2np0 s ILE 500 N -2.62 4.64 0.40 -0.18 -1.09 -1.26 -5.02 121.20 116.08 2np0 s ILE 500 Ca 0.18 1.99 -0.27 0.00 -2.23 0.00 0.00 60.65 60.33 2np0 s ILE 500 Cb 0.18 -4.29 -0.09 0.00 -1.58 0.00 0.00 42.46 36.68 2np0 s ILE 500 CO 0.61 0.28 1.40 -0.70 -1.23 0.00 0.00 174.94 175.30 2np0 s GLU 501 N 0.28 3.96 0.26 2.79 2.12 -1.26 -4.96 118.70 121.88 2np0 s GLU 501 Ca 0.47 2.38 -0.30 0.00 0.36 0.00 0.00 54.97 57.88 2np0 s GLU 501 Cb -0.22 -2.82 -0.10 0.00 0.26 0.00 0.00 34.13 31.24 2np0 s GLU 501 CO 0.28 -0.58 1.47 -0.51 -0.54 0.00 0.00 175.26 175.38 2np0 s LEU 502 N -2.36 4.38 0.84 2.70 1.43 -1.26 -5.01 118.68 119.40 2np0 s LEU 502 Ca 0.56 2.74 -0.10 0.00 -1.03 0.00 0.00 54.13 56.29 2np0 s LEU 502 Cb -0.43 -3.63 0.10 0.00 0.03 0.00 0.00 46.19 42.27 2np0 s LEU 502 CO 0.56 -0.75 1.11 -2.84 0.23 0.00 0.00 176.35 174.67 2np0 s PRO 503 N -0.49 1.63 0.29 1.29 0.02 -1.26 -4.94 135.00 131.53 2np0 s PRO 503 Ca 0.60 1.30 -0.28 0.00 0.02 0.00 0.00 61.00 62.64 2np0 s PRO 503 Cb -0.43 -1.82 -0.14 0.00 0.02 0.00 0.00 34.50 32.13 2np0 s PRO 503 CO 0.45 -2.12 0.91 0.45 -0.33 0.00 0.00 177.00 176.35 2np0 n SER 504 N -3.86 0.77 0.00 2.53 2.88 -1.26 -4.87 113.62 109.81 2np0 n SER 504 Ca 0.10 1.15 0.15 0.00 -1.33 0.00 0.00 58.87 58.94 2np0 n SER 504 Cb 0.53 -1.23 0.87 0.00 -0.75 0.00 0.00 64.21 63.62 2np0 n SER 504 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2np0 n GLU 505 N 0.73 0.76 -3.41 -1.46 0.28 -1.26 -4.87 120.64 111.40 2np0 n GLU 505 Ca 0.11 0.00 -0.38 0.00 -0.16 0.00 0.00 57.16 56.73 2np0 n GLU 505 Cb 0.32 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.63 2np0 n GLU 505 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 2np0 s ASN 506 N -2.24 6.77 0.04 -1.84 0.01 -1.26 -0.14 114.94 116.28 2np0 s ASN 506 Ca 0.40 0.92 -0.00 0.00 -0.71 0.00 0.00 52.86 53.46 2np0 s ASN 506 Cb 0.21 -2.27 0.00 0.00 0.41 0.00 0.00 41.25 39.60 2np0 s ASN 506 CO 0.40 0.19 0.05 1.07 -1.51 0.00 0.00 177.10 177.30 2np0 n THR 507 N 2.59 0.00 -2.62 1.60 5.66 0.15 -4.90 114.28 116.76 2np0 n THR 507 Ca -0.11 -0.18 -0.29 0.00 -3.05 0.00 0.00 64.05 60.42 2np0 n THR 507 Cb 0.52 0.11 -0.01 0.00 -1.55 0.00 0.00 70.33 69.40 2np0 n THR 507 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2np0 s GLU 508 N -2.08 3.65 0.53 1.09 0.41 -1.26 -2.77 118.70 118.27 2np0 s GLU 508 Ca 0.03 0.39 -0.22 0.00 -0.41 0.00 0.00 54.97 54.76 2np0 s GLU 508 Cb -0.00 -2.34 -0.05 0.00 -1.78 0.00 0.00 34.13 29.96 2np0 s GLU 508 CO 0.02 -0.19 1.32 -1.12 -0.49 0.00 0.00 175.26 174.80 2np0 s SER 509 N -3.72 5.46 -0.17 -0.19 0.01 -1.26 -3.76 113.70 110.07 2np0 s SER 509 Ca 0.50 2.67 -0.29 0.00 1.31 0.00 0.00 55.95 60.14 2np0 s SER 509 Cb -0.10 -2.63 -0.01 0.00 0.21 0.00 0.00 66.02 63.49 2np0 s SER 509 CO 0.40 -1.43 1.16 -0.22 0.41 0.00 0.00 173.24 173.56 2np0 s LEU 510 N -3.41 4.17 -0.00 2.44 2.96 -1.26 -4.88 118.68 118.70 2np0 s LEU 510 Ca 0.70 1.59 0.10 0.00 -0.22 0.00 0.00 54.13 56.30 2np0 s LEU 510 Cb -0.38 -3.54 -0.12 0.00 0.50 0.00 0.00 46.19 42.64 2np0 s LEU 510 CO 0.45 -0.68 0.35 0.35 -1.32 0.00 0.00 176.35 175.50 2np0 n THR 511 N 5.18 0.00 -3.41 3.68 -2.24 -1.26 -4.88 114.28 111.35 2np0 n THR 511 Ca 0.12 -0.26 -0.44 0.00 -2.27 0.00 0.00 64.05 61.21 2np0 n THR 511 Cb 0.46 0.75 -0.08 0.00 -2.10 0.00 0.00 70.33 69.35 2np0 n THR 511 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2np0 s ASP 512 N -2.35 6.11 0.00 3.42 -1.08 -1.26 -4.93 116.67 116.57 2np0 s ASP 512 Ca 0.01 -1.32 0.23 0.00 -0.52 0.00 0.00 52.55 50.95 2np0 s ASP 512 Cb 0.07 -2.17 0.45 0.00 -1.46 0.00 0.00 42.92 39.81 2np0 s ASP 512 CO 0.41 -0.63 1.41 0.49 0.52 0.00 0.00 175.17 177.37 2np0 n PHE 513 N 5.18 0.31 -1.67 -5.34 3.01 -1.26 -4.11 117.46 113.58 2np0 n PHE 513 Ca -0.12 -0.16 -0.52 0.00 1.01 0.00 0.00 57.45 57.66 2np0 n PHE 513 Cb 0.44 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.85 2np0 n PHE 513 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2np0 n ASN 514 N 1.23 2.59 -3.57 4.37 5.15 -1.26 -4.86 115.26 118.90 2np0 n ASN 514 Ca 0.18 1.06 -0.13 0.00 -0.60 0.00 0.00 54.58 55.09 2np0 n ASN 514 Cb 0.55 -1.25 -0.06 0.00 -0.53 0.00 0.00 39.78 38.50 2np0 n ASN 514 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2np0 s VAL 515 N 2.63 0.00 -0.19 3.44 0.11 -1.26 -4.53 120.40 120.60 2np0 s VAL 515 Ca 0.91 0.00 -0.20 0.00 -2.93 0.00 0.00 61.98 59.76 2np0 s VAL 515 Cb -0.89 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 32.93 2np0 s VAL 515 CO 0.54 0.00 0.59 -1.81 -3.33 0.00 0.00 175.10 171.10 2np0 s ASP 516 N -0.86 6.66 -0.28 3.54 1.01 0.58 -4.95 116.67 122.38 2np0 s ASP 516 Ca -0.04 0.80 -0.08 0.00 0.71 0.00 0.00 52.55 53.94 2np0 s ASP 516 Cb -0.01 -2.33 -0.02 0.00 1.01 0.00 0.00 42.92 41.57 2np0 s ASP 516 CO 0.03 -0.23 0.10 -0.69 0.21 0.00 0.00 175.17 174.59 2np0 s VAL 517 N 1.73 4.40 0.64 -1.27 1.01 -1.26 -4.46 120.40 121.19 2np0 s VAL 517 Ca 0.28 -0.31 -0.17 0.00 0.00 0.00 0.00 61.98 61.78 2np0 s VAL 517 Cb -0.16 -3.15 -0.01 0.00 0.00 0.00 0.00 36.38 33.06 2np0 s VAL 517 CO 0.10 0.21 1.16 -2.84 0.00 0.00 0.00 175.10 173.74 2np0 s PRO 518 N 1.61 2.78 -0.12 2.72 0.02 -1.26 -4.99 135.00 135.76 2np0 s PRO 518 Ca 0.05 1.64 0.01 0.00 0.02 0.00 0.00 61.00 62.73 2np0 s PRO 518 Cb -0.16 -1.93 -0.01 0.00 0.02 0.00 0.00 34.50 32.42 2np0 s PRO 518 CO 0.05 -1.31 -0.17 0.08 -0.33 0.00 0.00 177.00 175.32 2np0 s VAL 519 N -1.94 2.71 -0.07 3.83 1.01 -1.26 -4.24 120.40 120.44 2np0 s VAL 519 Ca 0.73 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.94 2np0 s VAL 519 Cb -0.26 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 2np0 s VAL 519 CO 0.37 0.54 -0.10 -0.31 0.00 0.00 0.00 175.10 175.61 2np0 s TYR 520 N 0.33 2.85 0.03 5.22 1.51 -0.20 -5.06 117.35 122.03 2np0 s TYR 520 Ca -0.13 -0.07 0.03 0.00 -1.01 0.00 0.00 57.07 55.89 2np0 s TYR 520 Cb -0.17 -1.69 -0.02 0.00 -0.11 0.00 0.00 41.96 39.97 2np0 s TYR 520 CO 0.07 0.25 -0.10 -1.83 -1.11 0.00 0.00 175.55 172.83 2np0 s GLU 521 N -0.71 0.71 0.66 -0.62 -1.05 -1.26 -4.71 118.70 111.71 2np0 s GLU 521 Ca 0.11 -0.64 -0.13 0.00 -0.15 0.00 0.00 54.97 54.16 2np0 s GLU 521 Cb -0.11 -0.64 -0.01 0.00 -0.44 0.00 0.00 34.13 32.94 2np0 s GLU 521 CO 0.01 0.15 1.07 0.15 0.95 0.00 0.00 175.26 177.59 2np0 s LYS 522 N -1.05 2.99 0.14 -4.83 1.02 -1.26 -4.77 119.74 111.97 2np0 s LYS 522 Ca -0.02 1.14 0.05 0.00 0.02 0.00 0.00 55.97 57.16 2np0 s LYS 522 Cb -0.07 -1.99 -0.04 0.00 -0.52 0.00 0.00 37.83 35.21 2np0 s LYS 522 CO 0.01 -1.07 -0.11 1.14 -0.92 0.00 0.00 175.35 174.39 2np0 s GLN 523 N -4.50 1.05 0.19 1.68 -2.07 -0.26 -4.90 119.66 110.85 2np0 s GLN 523 Ca 0.62 -1.38 -0.32 0.00 -1.82 0.00 0.00 55.36 52.46 2np0 s GLN 523 Cb -0.16 -0.70 -0.16 0.00 -1.09 0.00 0.00 33.01 30.90 2np0 s GLN 523 CO 0.46 0.10 1.06 -2.30 -1.32 0.00 0.00 175.29 173.29 2np0 n PRO 524 N 0.02 1.01 0.07 9.60 -0.02 -1.26 -0.35 135.00 144.06 2np0 n PRO 524 Ca -0.12 0.36 0.13 0.00 -2.02 0.00 0.00 63.50 61.85 2np0 n PRO 524 Cb 0.60 -1.77 0.48 0.00 -0.02 0.00 0.00 33.50 32.78 2np0 n PRO 524 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2np0 n ALA 525 N 1.09 2.15 -2.58 3.55 0.00 -0.96 -4.62 120.51 119.14 2np0 n ALA 525 Ca 0.15 -0.03 -0.29 0.00 0.00 0.00 0.00 53.44 53.27 2np0 n ALA 525 Cb 0.25 -1.44 -0.16 0.00 0.00 0.00 0.00 19.45 18.10 2np0 n ALA 525 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2np0 s ILE 526 N -3.09 1.76 -0.21 0.00 1.01 -1.26 0.10 121.20 119.51 2np0 s ILE 526 Ca 0.10 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.84 2np0 s ILE 526 Cb 0.14 -1.48 0.04 0.00 0.01 0.00 0.00 42.46 41.17 2np0 s ILE 526 CO 0.52 0.50 -0.16 -0.75 0.00 0.00 0.00 174.94 175.04 2np0 s LYS 527 N -0.32 2.64 -0.09 2.79 2.20 -0.59 -4.97 119.74 121.41 2np0 s LYS 527 Ca 0.03 -1.03 -0.22 0.00 -0.36 0.00 0.00 55.97 54.39 2np0 s LYS 527 Cb -0.10 -2.68 -0.03 0.00 -1.51 0.00 0.00 37.83 33.50 2np0 s LYS 527 CO 0.01 -0.36 0.67 0.21 -0.36 0.00 0.00 175.35 175.52 2np0 s LYS 528 N 1.22 4.39 0.07 4.03 2.20 -1.26 -0.89 119.74 129.51 2np0 s LYS 528 Ca -0.01 0.80 0.02 0.00 -0.36 0.00 0.00 55.97 56.42 2np0 s LYS 528 Cb -0.16 -3.47 -0.03 0.00 -1.51 0.00 0.00 37.83 32.66 2np0 s LYS 528 CO -0.10 0.02 -0.07 0.96 -0.36 0.00 0.00 175.35 175.80 2np0 s ILE 529 N 0.97 0.65 -0.04 5.43 -5.25 -0.23 -4.95 121.20 117.78 2np0 s ILE 529 Ca 0.35 -1.56 0.02 0.00 -0.99 0.00 0.00 60.65 58.48 2np0 s ILE 529 Cb -0.17 -1.21 -0.03 0.00 2.95 0.00 0.00 42.46 44.00 2np0 s ILE 529 CO 0.16 -0.64 -0.08 -0.36 -1.79 0.00 0.00 174.94 172.23 2np0 s PHE 530 N -2.59 2.89 -0.04 1.37 0.40 -1.26 -0.95 117.98 117.78 2np0 s PHE 530 Ca 0.02 -0.02 -0.16 0.00 -0.60 0.00 0.00 56.93 56.16 2np0 s PHE 530 Cb -0.02 -1.66 0.03 0.00 0.51 0.00 0.00 43.02 41.88 2np0 s PHE 530 CO -0.02 0.33 0.37 -0.08 0.70 0.00 0.00 175.22 176.51 2np0 s THR 531 N -0.87 0.04 -0.90 0.64 -1.32 -0.25 -4.90 115.64 108.08 2np0 s THR 531 Ca 0.14 -0.33 0.27 0.00 -1.21 0.00 0.00 61.69 60.55 2np0 s THR 531 Cb -0.11 -0.65 0.17 0.00 -1.51 0.00 0.00 72.50 70.41 2np0 s THR 531 CO 0.03 -0.18 1.71 0.47 -2.21 0.00 0.00 174.62 174.44 2np0 n ASP 532 N 1.52 0.36 -4.76 8.08 8.00 -1.25 -1.45 116.55 127.05 2np0 n ASP 532 Ca -0.20 0.30 -0.39 0.00 0.71 0.00 0.00 54.79 55.21 2np0 n ASP 532 Cb 0.56 -0.30 -0.06 0.00 -0.02 0.00 0.00 41.12 41.30 2np0 n ASP 532 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2np0 s GLU 533 N -3.04 4.74 -0.48 -1.24 0.41 -1.26 -4.88 118.70 112.95 2np0 s GLU 533 Ca 0.12 1.40 0.03 0.00 -0.41 0.00 0.00 54.97 56.11 2np0 s GLU 533 Cb 0.17 -3.13 0.14 0.00 -1.78 0.00 0.00 34.13 29.53 2np0 s GLU 533 CO 0.61 0.45 0.27 -0.80 -0.49 0.00 0.00 175.26 175.29 2np0 s ASN 534 N -1.32 3.82 0.00 -0.19 0.01 -1.26 -4.96 114.94 111.04 2np0 s ASN 534 Ca 0.43 -2.83 0.00 0.00 -0.71 0.00 0.00 52.86 49.76 2np0 s ASN 534 Cb -0.23 -1.21 0.00 0.00 0.41 0.00 0.00 41.25 40.22 2np0 s ASN 534 CO 0.29 -0.24 0.00 1.07 -1.51 0.00 0.00 177.10 176.71 2np0 n THR 535 N 3.29 0.00 -0.28 1.60 5.66 -1.26 -4.83 114.28 118.46 2np0 n THR 535 Ca 0.09 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 61.04 2np0 n THR 535 Cb 0.34 0.00 0.06 0.00 -1.55 0.00 0.00 70.33 69.19 2np0 n THR 535 CO 0.00 0.00 0.00 -0.29 -3.05 0.00 0.00 175.07 171.73 2np0 h ILE 536 N 0.00 1.24 -0.06 1.09 2.10 -1.77 -1.53 117.51 118.57 2np0 h ILE 536 Ca 0.00 -0.63 -0.14 0.00 1.08 0.00 0.00 64.86 65.18 2np0 h ILE 536 Cb 0.00 0.25 -0.01 0.00 -1.09 0.00 0.00 36.82 35.96 2np0 h ILE 536 CO 0.00 0.27 -0.59 -0.26 -1.08 0.00 0.00 178.15 176.50 2np0 h PHE 537 N 1.07 0.23 0.02 2.19 -1.00 -1.95 -1.24 116.94 116.26 2np0 h PHE 537 Ca 0.27 -0.09 -0.11 0.00 2.81 0.00 0.00 57.97 60.85 2np0 h PHE 537 Cb 0.07 -0.04 0.01 0.00 3.61 0.00 0.00 35.95 39.60 2np0 h PHE 537 CO 0.00 0.72 -0.44 1.96 -1.61 0.00 0.00 178.31 178.95 2np0 h GLN 538 N 0.14 0.26 -0.55 1.51 7.50 -1.83 -1.90 115.11 120.23 2np0 h GLN 538 Ca -0.00 -0.31 -0.02 0.00 0.50 0.00 0.00 58.65 58.82 2np0 h GLN 538 Cb 1.07 0.09 -0.03 0.00 0.05 0.00 0.00 27.48 28.67 2np0 h GLN 538 CO 0.09 1.04 0.27 1.88 -1.50 0.00 0.00 178.83 180.61 2np0 h TYR 539 N -0.39 0.76 -0.16 2.96 -1.99 -1.13 -1.21 116.97 115.81 2np0 h TYR 539 Ca -0.06 -0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.61 2np0 h TYR 539 Cb 1.21 -0.24 -0.00 0.00 2.00 0.00 0.00 36.73 39.69 2np0 h TYR 539 CO 0.18 0.55 -0.07 -0.07 -0.00 0.00 0.00 178.16 178.75 2np0 h LEU 540 N 0.77 0.33 -0.96 3.88 3.38 -1.26 -3.14 115.31 118.31 2np0 h LEU 540 Ca 0.19 -0.40 0.10 0.00 0.09 0.00 0.00 57.88 57.86 2np0 h LEU 540 Cb 0.07 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.65 2np0 h LEU 540 CO -0.03 0.66 0.60 0.22 0.09 0.00 0.00 178.44 179.98 2np0 h TYR 541 N 0.00 1.09 0.00 1.13 3.20 -0.70 -0.12 116.97 121.57 2np0 h TYR 541 Ca 0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.94 2np0 h TYR 541 Cb 0.53 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.45 2np0 h TYR 541 CO 0.06 0.48 0.00 -1.13 -1.64 0.00 0.00 178.16 175.93 2np0 n SER 542 N -4.62 0.16 -1.34 -2.11 3.41 -0.52 -1.47 113.62 107.13 2np0 n SER 542 Ca 0.17 0.56 0.11 0.00 -0.26 0.00 0.00 58.87 59.45 2np0 n SER 542 Cb 0.28 -0.59 0.32 0.00 -0.26 0.00 0.00 64.21 63.96 2np0 n SER 542 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2np0 n GLN 543 N -1.70 2.78 -3.80 4.33 6.02 -0.06 -2.01 117.38 122.93 2np0 n GLN 543 Ca 0.01 -2.56 -0.24 0.00 -0.01 0.00 0.00 57.00 54.20 2np0 n GLN 543 Cb 0.06 -1.60 -0.03 0.00 1.02 0.00 0.00 30.24 29.69 2np0 n GLN 543 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2np0 s THR 544 N -1.18 2.22 -0.16 5.09 -4.23 -0.55 -4.78 115.64 112.05 2np0 s THR 544 Ca 0.47 -1.47 -0.28 0.00 -1.18 0.00 0.00 61.69 59.23 2np0 s THR 544 Cb 0.26 -2.69 0.08 0.00 1.34 0.00 0.00 72.50 71.49 2np0 s THR 544 CO 0.31 0.00 0.77 0.72 -0.54 0.00 0.00 174.62 175.88 2np0 s PHE 545 N -2.61 -0.64 0.73 3.99 -0.12 -1.26 -4.85 117.98 113.21 2np0 s PHE 545 Ca 0.42 1.31 -0.12 0.00 -0.05 0.00 0.00 56.93 58.49 2np0 s PHE 545 Cb -0.01 0.37 0.03 0.00 -0.63 0.00 0.00 43.02 42.78 2np0 s PHE 545 CO 0.24 -0.46 1.09 -1.25 -0.05 0.00 0.00 175.22 174.80 2np0 s PRO 546 N -0.54 2.50 0.33 1.99 0.04 -1.26 -4.94 135.00 133.12 2np0 s PRO 546 Ca -0.05 1.23 0.16 0.00 0.04 0.00 0.00 61.00 62.39 2np0 s PRO 546 Cb -0.02 -1.92 0.48 0.00 0.04 0.00 0.00 34.50 33.08 2np0 s PRO 546 CO 0.04 -1.47 1.64 -0.07 0.04 0.00 0.00 177.00 177.19 2np0 h LEU 547 N -0.69 0.00 -3.37 -3.56 3.38 -2.02 -3.30 115.31 105.76 2np0 h LEU 547 Ca -0.45 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.23 2np0 h LEU 547 Cb 1.23 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.81 2np0 h LEU 547 CO 0.53 0.46 0.37 -0.90 0.09 0.00 0.00 178.44 178.99 2np0 n ASP 548 N -3.50 3.82 -3.49 -0.43 5.75 -1.26 -4.67 116.55 112.77 2np0 n ASP 548 Ca 0.00 -3.09 -0.28 0.00 -0.01 0.00 0.00 54.79 51.41 2np0 n ASP 548 Cb 0.59 -0.73 -0.11 0.00 -1.03 0.00 0.00 41.12 39.83 2np0 n ASP 548 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 2np0 s ILE 549 N -2.45 0.52 0.00 2.12 2.07 -1.24 -5.06 121.20 117.15 2np0 s ILE 549 Ca 0.43 -2.31 0.00 0.00 -1.41 0.00 0.00 60.65 57.35 2np0 s ILE 549 Cb 0.35 -1.37 0.00 0.00 0.13 0.00 0.00 42.46 41.57 2np0 s ILE 549 CO 0.09 -1.07 0.00 0.54 -1.91 0.00 0.00 174.94 172.59 2np0 n ARG 550 N 3.41 -0.91 -2.71 3.50 1.74 -1.26 -4.15 116.66 116.28 2np0 n ARG 550 Ca 0.19 0.95 -0.10 0.00 -0.77 0.00 0.00 57.85 58.12 2np0 n ARG 550 Cb 0.41 -0.71 0.05 0.00 -1.02 0.00 0.00 32.46 31.19 2np0 n ARG 550 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2np0 n ASP 551 N 2.09 -3.66 -4.79 0.55 2.03 -1.26 -4.93 116.55 106.58 2np0 n ASP 551 Ca 0.00 -0.42 -0.35 0.00 0.52 0.00 0.00 54.79 54.54 2np0 n ASP 551 Cb 0.08 -3.40 -0.04 0.00 -0.72 0.00 0.00 41.12 37.05 2np0 n ASP 551 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2np0 s ILE 552 N -3.23 3.77 0.06 5.18 -4.36 -1.26 -4.86 121.20 116.50 2np0 s ILE 552 Ca 0.16 1.24 0.04 0.00 -0.26 0.00 0.00 60.65 61.83 2np0 s ILE 552 Cb -0.02 -3.58 -0.03 0.00 1.25 0.00 0.00 42.46 40.08 2np0 s ILE 552 CO 0.46 -0.10 -0.11 -0.94 0.24 0.00 0.00 174.94 174.48 2np0 s SER 553 N -1.75 1.24 0.41 4.36 1.04 0.97 -4.85 113.70 115.11 2np0 s SER 553 Ca 0.62 -0.59 -0.17 0.00 0.48 0.00 0.00 55.95 56.28 2np0 s SER 553 Cb -0.19 -0.00 -0.09 0.00 0.10 0.00 0.00 66.02 65.83 2np0 s SER 553 CO 0.24 -0.15 0.87 -0.76 0.98 0.00 0.00 173.24 174.41 2np0 s LEU 554 N -1.69 3.92 0.05 2.42 1.43 -1.26 -0.91 118.68 122.63 2np0 s LEU 554 Ca -0.06 1.48 -0.05 0.00 -1.03 0.00 0.00 54.13 54.47 2np0 s LEU 554 Cb -0.10 -4.33 -0.01 0.00 0.03 0.00 0.00 46.19 41.78 2np0 s LEU 554 CO 0.01 -0.35 0.09 0.28 0.23 0.00 0.00 176.35 176.61 2np0 s THR 555 N -2.21 0.15 -2.86 5.49 -1.32 -0.45 -4.82 115.64 109.61 2np0 s THR 555 Ca 0.58 -1.21 0.24 0.00 -1.21 0.00 0.00 61.69 60.08 2np0 s THR 555 Cb -0.10 -1.04 0.17 0.00 -1.51 0.00 0.00 72.50 70.02 2np0 s THR 555 CO 0.19 -0.67 1.24 -1.54 -2.21 0.00 0.00 174.62 171.64 2np0 n SER 556 N 0.56 2.85 -4.36 8.08 3.41 -1.26 -0.73 113.62 122.17 2np0 n SER 556 Ca -0.18 -1.93 -0.45 0.00 -0.26 0.00 0.00 58.87 56.05 2np0 n SER 556 Cb 0.59 0.06 -0.06 0.00 -0.26 0.00 0.00 64.21 64.55 2np0 n SER 556 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2np0 s SER 557 N -2.07 6.18 0.28 4.04 0.15 -1.26 -4.90 113.70 116.13 2np0 s SER 557 Ca 0.27 -1.51 0.01 0.00 0.70 0.00 0.00 55.95 55.42 2np0 s SER 557 Cb 0.20 -2.24 0.65 0.00 -1.71 0.00 0.00 66.02 62.92 2np0 s SER 557 CO 0.34 -0.88 1.67 0.15 1.20 0.00 0.00 173.24 175.72 2np0 h PHE 558 N 8.95 0.43 -0.00 3.44 3.57 -1.96 -1.21 116.94 130.15 2np0 h PHE 558 Ca -0.29 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.25 2np0 h PHE 558 Cb 1.10 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.78 2np0 h PHE 558 CO 0.74 -0.12 0.00 -0.44 -2.23 0.00 0.00 178.31 176.26 2np0 h ASP 559 N 0.29 0.01 -1.00 0.41 3.32 -2.00 -1.74 116.42 115.71 2np0 h ASP 559 Ca 0.52 -0.29 0.17 0.00 0.02 0.00 0.00 57.03 57.45 2np0 h ASP 559 Cb 0.98 -0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.43 2np0 h ASP 559 CO -0.58 0.29 0.62 0.44 -1.72 0.00 0.00 179.24 178.29 2np0 h ASP 560 N -0.28 0.83 -0.47 6.45 3.32 -1.82 -0.91 116.42 123.55 2np0 h ASP 560 Ca 0.00 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 2np0 h ASP 560 Cb 0.29 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2np0 h ASP 560 CO 0.00 0.35 0.22 0.00 -1.72 0.00 0.00 179.24 178.09 2np0 h ALA 561 N 1.61 0.61 -0.68 3.45 0.00 -0.84 -0.24 119.26 123.16 2np0 h ALA 561 Ca 0.55 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.33 2np0 h ALA 561 Cb 0.75 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2np0 h ALA 561 CO -0.34 0.18 0.41 -0.07 0.00 0.00 0.00 179.25 179.42 2np0 h LEU 562 N 0.62 0.81 0.02 0.00 3.38 -0.40 -3.32 115.31 116.42 2np0 h LEU 562 Ca 0.16 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2np0 h LEU 562 Cb 0.13 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2np0 h LEU 562 CO -0.02 0.63 -0.01 -0.07 0.09 0.00 0.00 178.44 179.06 2np0 h LEU 563 N 0.94 -0.02 -9.45 1.67 3.38 -0.49 -3.46 115.31 107.89 2np0 h LEU 563 Ca 0.25 -0.73 -0.60 0.00 0.09 0.00 0.00 57.88 56.89 2np0 h LEU 563 Cb -0.03 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 40.64 2np0 h LEU 563 CO -0.05 0.78 -0.27 -0.36 0.09 0.00 0.00 178.44 178.64 2np0 s PHE 564 N -2.61 3.56 0.18 1.13 0.40 -0.17 -4.98 117.98 115.49 2np0 s PHE 564 Ca -0.16 0.76 0.19 0.00 -0.60 0.00 0.00 56.93 57.12 2np0 s PHE 564 Cb -0.02 -2.33 0.70 0.00 0.51 0.00 0.00 43.02 41.89 2np0 s PHE 564 CO 0.58 0.39 1.74 0.77 0.70 0.00 0.00 175.22 179.41 2np0 h SER 565 N 5.96 0.00 0.03 1.36 0.02 -1.87 -3.14 113.55 115.91 2np0 h SER 565 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2np0 h SER 565 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2np0 h SER 565 CO 0.70 0.37 -0.05 -0.46 -1.14 0.00 0.00 176.83 176.25 2np0 n ASN 566 N -3.56 1.53 -4.51 3.07 6.94 -1.26 -4.62 115.26 112.86 2np0 n ASN 566 Ca -0.00 -1.43 -0.35 0.00 -0.02 0.00 0.00 54.58 52.78 2np0 n ASN 566 Cb 0.50 0.03 -0.12 0.00 -2.36 0.00 0.00 39.78 37.83 2np0 n ASN 566 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2np0 s LYS 567 N -2.10 3.73 -0.09 -3.83 -0.14 -1.19 -0.02 119.74 116.11 2np0 s LYS 567 Ca 0.35 -0.47 0.04 0.00 -1.36 0.00 0.00 55.97 54.53 2np0 s LYS 567 Cb 0.21 -3.12 0.00 0.00 -1.68 0.00 0.00 37.83 33.23 2np0 s LYS 567 CO 0.37 0.09 -0.22 0.08 -0.76 0.00 0.00 175.35 174.91 2np0 s VAL 568 N 0.81 1.90 0.51 3.17 1.01 -0.09 -4.55 120.40 123.17 2np0 s VAL 568 Ca 0.01 -0.93 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 2np0 s VAL 568 Cb -0.14 -1.65 -0.06 0.00 0.00 0.00 0.00 36.38 34.53 2np0 s VAL 568 CO 0.02 0.52 1.21 -0.47 0.00 0.00 0.00 175.10 176.39 2np0 s TYR 569 N 0.38 2.64 -0.02 5.22 5.04 -0.85 -1.34 117.35 128.42 2np0 s TYR 569 Ca -0.18 1.50 -0.09 0.00 -2.44 0.00 0.00 57.07 55.86 2np0 s TYR 569 Cb -0.17 -3.48 0.01 0.00 0.35 0.00 0.00 41.96 38.67 2np0 s TYR 569 CO 0.08 -1.94 0.19 0.45 -1.34 0.00 0.00 175.55 173.00 2np0 s SER 570 N -1.35 -0.08 0.00 4.32 0.15 0.09 -4.65 113.70 112.18 2np0 s SER 570 Ca 0.69 -0.00 0.13 0.00 0.70 0.00 0.00 55.95 57.47 2np0 s SER 570 Cb -0.31 0.28 0.23 0.00 -1.71 0.00 0.00 66.02 64.51 2np0 s SER 570 CO 0.36 -0.33 1.11 2.22 1.20 0.00 0.00 173.24 177.80 2np0 n PHE 571 N 1.72 0.26 -1.89 3.44 1.16 -1.26 -4.51 117.46 116.39 2np0 n PHE 571 Ca -0.20 -0.23 -0.30 0.00 -1.87 0.00 0.00 57.45 54.85 2np0 n PHE 571 Cb 0.56 -0.01 0.19 0.00 -1.61 0.00 0.00 39.48 38.61 2np0 n PHE 571 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 2np0 s PHE 572 N -1.08 1.50 0.98 2.97 2.99 -1.26 -4.85 117.98 119.24 2np0 s PHE 572 Ca 0.22 0.32 -0.11 0.00 0.00 0.00 0.00 56.93 57.35 2np0 s PHE 572 Cb 0.13 -4.10 0.18 0.00 0.00 0.00 0.00 43.02 39.23 2np0 s PHE 572 CO 0.18 -2.74 1.10 -1.54 -0.00 0.00 0.00 175.22 172.22 2np0 s SER 573 N -4.85 2.45 0.00 1.36 1.04 -1.26 -4.71 113.70 107.73 2np0 s SER 573 Ca 0.74 1.90 0.00 0.00 0.48 0.00 0.00 55.95 59.07 2np0 s SER 573 Cb -0.04 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.63 2np0 s SER 573 CO 0.53 -3.35 0.26 0.23 0.98 0.00 0.00 173.24 171.90 2np0 n MET 574 N -4.38 0.00 0.00 4.02 2.81 -1.26 -2.33 117.12 115.98 2np0 n MET 574 Ca 0.08 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.97 2np0 n MET 574 Cb 0.53 -1.31 0.00 0.00 -0.71 0.00 0.00 33.22 31.73 2np0 n MET 574 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2np0 n ASP 575 N -0.74 0.00 -0.36 7.83 -0.08 -1.26 -3.31 116.55 118.63 2np0 n ASP 575 Ca 0.00 0.00 0.02 0.00 -1.51 0.00 0.00 54.79 53.30 2np0 n ASP 575 Cb 0.00 0.00 0.08 0.00 2.34 0.00 0.00 41.12 43.54 2np0 n ASP 575 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 2np0 h TYR 576 N 0.00 -0.83 -0.60 -0.67 3.20 -1.89 -3.10 116.97 113.08 2np0 h TYR 576 Ca 0.00 0.10 -0.06 0.00 3.14 0.00 0.00 58.73 61.91 2np0 h TYR 576 Cb 0.00 0.51 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 2np0 h TYR 576 CO 0.00 -0.41 0.15 0.82 -1.64 0.00 0.00 178.16 177.08 2np0 h ILE 577 N -0.01 1.25 -0.59 1.81 2.04 -1.59 0.31 117.51 120.73 2np0 h ILE 577 Ca 0.39 -0.91 -0.08 0.00 1.00 0.00 0.00 64.86 65.27 2np0 h ILE 577 Cb 0.64 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2np0 h ILE 577 CO -0.98 0.34 0.06 0.11 0.00 0.00 0.00 178.15 177.69 2np0 h LYS 578 N 0.88 0.98 -0.31 2.37 1.57 -1.67 -2.23 116.57 118.16 2np0 h LYS 578 Ca 0.19 -0.26 -0.11 0.00 -1.87 0.00 0.00 60.65 58.60 2np0 h LYS 578 Cb 0.35 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 2np0 h LYS 578 CO 0.00 0.93 -0.23 1.15 -0.57 0.00 0.00 179.45 180.73 2np0 h THR 579 N 0.92 1.30 -0.94 -0.16 2.02 -1.12 -2.62 112.91 112.31 2np0 h THR 579 Ca 0.18 -1.37 0.16 0.00 0.77 0.00 0.00 66.41 66.15 2np0 h THR 579 Cb 0.45 1.50 -0.10 0.00 -1.74 0.00 0.00 68.15 68.25 2np0 h THR 579 CO 0.02 0.44 0.54 0.00 0.37 0.00 0.00 175.52 176.88 2np0 h ALA 580 N 0.74 1.47 -0.36 6.16 0.00 -0.38 -2.05 119.26 124.84 2np0 h ALA 580 Ca 0.06 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2np0 h ALA 580 Cb 0.78 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2np0 h ALA 580 CO 0.06 -0.03 0.00 0.09 0.00 0.00 0.00 179.25 179.37 2np0 n ASN 581 N -4.79 2.30 -4.68 0.00 3.02 -0.85 -4.93 115.26 105.34 2np0 n ASN 581 Ca 0.20 -2.10 -0.40 0.00 -0.03 0.00 0.00 54.58 52.25 2np0 n ASN 581 Cb 0.48 -0.33 -0.05 0.00 -0.61 0.00 0.00 39.78 39.27 2np0 n ASN 581 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2np0 s LYS 582 N -1.59 4.27 -0.25 3.52 2.20 -0.77 -5.02 119.74 122.10 2np0 s LYS 582 Ca 0.25 0.68 -0.14 0.00 -0.36 0.00 0.00 55.97 56.40 2np0 s LYS 582 Cb 0.15 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 2np0 s LYS 582 CO 0.15 -0.15 0.32 0.08 -0.36 0.00 0.00 175.35 175.39 2np0 s VAL 583 N 1.58 5.23 0.29 4.02 1.01 -1.26 -5.06 120.40 126.21 2np0 s VAL 583 Ca 0.31 0.49 0.11 0.00 0.00 0.00 0.00 61.98 62.88 2np0 s VAL 583 Cb -0.16 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 2np0 s VAL 583 CO 0.12 0.22 -0.15 0.68 0.00 0.00 0.00 175.10 175.97 2np0 s VAL 584 N 1.69 2.61 0.97 2.92 -7.23 -1.26 -5.14 120.40 114.96 2np0 s VAL 584 Ca 0.14 -2.29 -0.12 0.00 -1.81 0.00 0.00 61.98 57.90 2np0 s VAL 584 Cb -0.15 -2.45 0.17 0.00 0.56 0.00 0.00 36.38 34.52 2np0 s VAL 584 CO 0.09 -0.36 1.09 -1.83 -0.31 0.00 0.00 175.10 173.77 2np0 s GLU 585 N -3.56 0.62 0.14 4.82 -1.05 -1.26 -4.86 118.70 113.56 2np0 s GLU 585 Ca 0.31 0.70 -0.21 0.00 -0.15 0.00 0.00 54.97 55.61 2np0 s GLU 585 Cb -0.04 -1.75 0.01 0.00 -0.44 0.00 0.00 34.13 31.91 2np0 s GLU 585 CO 0.16 -2.64 1.66 0.00 0.95 0.00 0.00 175.26 175.39 2np0 h ALA 586 N -1.84 -0.03 -0.29 -0.84 0.00 -2.01 -2.43 119.26 111.83 2np0 h ALA 586 Ca -0.53 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2np0 h ALA 586 Cb 1.31 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 2np0 h ALA 586 CO 0.55 -0.59 0.12 0.78 0.00 0.00 0.00 179.25 180.10 2np0 h GLY 587 N -0.17 0.42 -0.56 0.00 0.00 -1.93 -2.43 103.07 98.40 2np0 h GLY 587 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2np0 h GLY 587 CO -0.30 0.18 0.00 1.04 0.00 0.00 0.00 176.54 177.46 2np0 n LEU 588 N -4.42 1.45 -0.03 3.11 4.77 -0.93 -4.45 117.00 116.51 2np0 n LEU 588 Ca 0.01 -0.57 -0.15 0.00 -0.03 0.00 0.00 56.01 55.27 2np0 n LEU 588 Cb 0.13 -0.07 -0.10 0.00 -2.33 0.00 0.00 43.42 41.05 2np0 n LEU 588 CO 0.36 0.29 0.42 0.15 -1.33 0.00 0.00 177.39 177.27 2np0 h PHE 589 N 2.02 0.38 -0.72 -1.77 3.57 -1.29 -2.30 116.94 116.83 2np0 h PHE 589 Ca 0.00 -0.18 0.04 0.00 3.53 0.00 0.00 57.97 61.37 2np0 h PHE 589 Cb 0.44 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 2np0 h PHE 589 CO 0.07 0.93 0.47 0.00 -2.23 0.00 0.00 178.31 177.55 2np0 h ALA 590 N 0.37 1.63 -0.08 2.41 0.00 -1.79 0.11 119.26 121.91 2np0 h ALA 590 Ca -0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2np0 h ALA 590 Cb 0.98 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2np0 h ALA 590 CO 0.06 0.28 -0.01 0.78 0.00 0.00 0.00 179.25 180.36 2np0 h GLY 591 N 0.83 0.16 0.97 0.00 0.00 -1.83 -2.15 103.07 101.04 2np0 h GLY 591 Ca 0.29 -0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.51 2np0 h GLY 591 CO -0.09 0.11 0.48 -0.25 0.00 0.00 0.00 176.54 176.80 2np0 h TRP 592 N -0.17 0.92 -0.67 5.60 7.01 -0.78 -1.07 115.95 126.78 2np0 h TRP 592 Ca 0.02 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.09 2np0 h TRP 592 Cb 0.39 -0.31 -0.05 0.00 -2.10 0.00 0.00 29.16 27.09 2np0 h TRP 592 CO 0.05 0.56 0.39 0.28 -2.79 0.00 0.00 178.44 176.93 2np0 h VAL 593 N 0.98 1.03 0.35 2.65 2.07 -0.68 -0.11 116.25 122.54 2np0 h VAL 593 Ca 0.28 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 2np0 h VAL 593 Cb -0.08 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 29.88 2np0 h VAL 593 CO -0.07 0.14 -0.35 0.11 0.02 0.00 0.00 177.57 177.42 2np0 h LYS 594 N 0.75 -0.70 -0.37 1.57 1.57 -1.05 -1.68 116.57 116.66 2np0 h LYS 594 Ca 0.28 0.05 0.08 0.00 -1.87 0.00 0.00 60.65 59.19 2np0 h LYS 594 Cb 0.11 0.16 -0.08 0.00 0.08 0.00 0.00 32.23 32.50 2np0 h LYS 594 CO -0.14 -0.47 -0.14 1.96 -0.57 0.00 0.00 179.45 180.08 2np0 h GLN 595 N -0.73 -0.07 -0.20 3.15 1.08 -0.58 -0.89 115.11 116.88 2np0 h GLN 595 Ca -0.02 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.01 2np0 h GLN 595 Cb 0.66 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.11 2np0 h GLN 595 CO -0.06 -0.05 -0.57 0.97 -0.95 0.00 0.00 178.83 178.17 2np0 h ILE 596 N -0.07 1.30 -0.54 2.54 6.09 -1.03 0.57 117.51 126.37 2np0 h ILE 596 Ca 0.18 -1.79 0.01 0.00 -1.37 0.00 0.00 64.86 61.90 2np0 h ILE 596 Cb 0.35 1.88 -0.03 0.00 0.47 0.00 0.00 36.82 39.50 2np0 h ILE 596 CO -0.42 0.56 0.36 0.58 -3.07 0.00 0.00 178.15 176.16 2np0 h VAL 597 N 0.45 1.12 0.09 2.19 2.07 -1.15 0.44 116.25 121.45 2np0 h VAL 597 Ca -0.02 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 2np0 h VAL 597 Cb 1.19 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2np0 h VAL 597 CO 0.12 0.13 -0.04 -1.13 0.02 0.00 0.00 177.57 176.67 2np0 h ASN 598 N 0.70 -0.10 -0.98 0.57 -1.24 -0.75 -2.89 115.58 110.90 2np0 h ASN 598 Ca 0.20 -0.44 0.14 0.00 0.71 0.00 0.00 56.30 56.91 2np0 h ASN 598 Cb -0.04 0.03 -0.09 0.00 0.73 0.00 0.00 38.32 38.95 2np0 h ASN 598 CO -0.05 0.43 0.62 0.44 -1.29 0.00 0.00 177.43 177.58 2np0 h ASP 599 N -0.67 0.83 0.15 1.15 3.32 0.44 -0.87 116.42 120.78 2np0 h ASP 599 Ca -0.01 0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.11 2np0 h ASP 599 Cb 0.54 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 2np0 h ASP 599 CO 0.02 0.41 -0.24 0.15 -1.72 0.00 0.00 179.24 177.86 2np0 h PHE 600 N 0.88 -0.63 -0.68 4.55 3.57 -0.90 0.19 116.94 123.91 2np0 h PHE 600 Ca 0.50 0.01 0.04 0.00 3.53 0.00 0.00 57.97 62.05 2np0 h PHE 600 Cb 0.64 0.26 -0.05 0.00 2.79 0.00 0.00 35.95 39.59 2np0 h PHE 600 CO -0.00 -0.34 0.41 0.28 -2.23 0.00 0.00 178.31 176.43 2np0 h VAL 601 N -0.46 1.05 -0.22 1.41 2.07 -0.99 0.52 116.25 119.64 2np0 h VAL 601 Ca 0.02 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 2np0 h VAL 601 Cb 0.46 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 2np0 h VAL 601 CO -0.11 0.14 0.12 0.40 0.02 0.00 0.00 177.57 178.14 2np0 h ILE 602 N 0.79 1.10 -0.81 4.57 2.04 -0.94 -1.67 117.51 122.58 2np0 h ILE 602 Ca 0.28 -0.26 0.06 0.00 1.00 0.00 0.00 64.86 65.94 2np0 h ILE 602 Cb 0.07 0.88 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 2np0 h ILE 602 CO -0.13 0.10 0.50 -0.33 0.00 0.00 0.00 178.15 178.28 2np0 h GLU 603 N 0.25 0.89 0.00 2.37 4.39 0.45 -1.84 114.58 121.09 2np0 h GLU 603 Ca 0.08 -0.05 -0.08 0.00 0.34 0.00 0.00 59.36 59.64 2np0 h GLU 603 Cb 0.05 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.48 2np0 h GLU 603 CO -0.01 0.59 -0.38 0.00 -1.16 0.00 0.00 179.01 178.05 2np0 h ALA 604 N 1.38 0.97 -0.01 3.43 0.00 -0.61 -2.87 119.26 121.56 2np0 h ALA 604 Ca 0.35 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2np0 h ALA 604 Cb 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2np0 h ALA 604 CO -0.16 0.47 -0.05 0.09 0.00 0.00 0.00 179.25 179.59 2np0 n ASN 605 N -3.51 0.59 -4.68 0.00 3.02 -0.66 -4.48 115.26 105.55 2np0 n ASN 605 Ca -0.00 -0.92 -0.47 0.00 -0.03 0.00 0.00 54.58 53.16 2np0 n ASN 605 Cb 0.52 -0.03 -0.04 0.00 -0.61 0.00 0.00 39.78 39.61 2np0 n ASN 605 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2np0 n LYS 606 N -0.69 2.26 0.00 3.52 4.76 -1.09 -4.81 118.16 122.11 2np0 n LYS 606 Ca 0.18 0.83 0.00 0.00 -2.87 0.00 0.00 58.31 56.45 2np0 n LYS 606 Cb 0.25 -2.68 0.00 0.00 -1.84 0.00 0.00 35.03 30.76 2np0 n LYS 606 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2np0 n SER 607 N 6.36 0.07 -2.75 4.39 3.41 -1.26 -4.33 113.62 119.51 2np0 n SER 607 Ca 0.22 -1.03 -0.13 0.00 -0.26 0.00 0.00 58.87 57.67 2np0 n SER 607 Cb 0.31 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.22 2np0 n SER 607 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2np0 n ASN 608 N -0.01 1.48 -3.76 4.04 4.13 -1.25 -3.83 115.26 116.06 2np0 n ASN 608 Ca 0.00 -2.02 -0.28 0.00 1.68 0.00 0.00 54.58 53.97 2np0 n ASN 608 Cb 0.43 0.40 -0.16 0.00 -1.54 0.00 0.00 39.78 38.91 2np0 n ASN 608 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 2np0 s THR 609 N -2.15 0.61 0.44 3.41 -1.32 -1.26 -4.73 115.64 110.64 2np0 s THR 609 Ca 0.07 -0.58 0.23 0.00 -1.21 0.00 0.00 61.69 60.20 2np0 s THR 609 Cb 0.00 -1.07 0.43 0.00 -1.51 0.00 0.00 72.50 70.35 2np0 s THR 609 CO 0.05 -0.17 1.81 0.24 -2.21 0.00 0.00 174.62 174.34 2np0 h MET 610 N 8.22 0.28 -5.66 7.08 2.86 -2.01 -3.32 114.93 122.38 2np0 h MET 610 Ca -0.17 -0.02 -0.63 0.00 -2.06 0.00 0.00 59.70 56.82 2np0 h MET 610 Cb 1.12 -0.06 -0.08 0.00 0.06 0.00 0.00 31.60 32.64 2np0 h MET 610 CO 0.34 0.18 -0.39 0.34 1.06 0.00 0.00 176.91 178.44 2np0 s ASP 611 N -5.37 6.47 0.00 1.22 2.15 -1.26 -5.00 116.67 114.88 2np0 s ASP 611 Ca -0.08 0.56 0.12 0.00 0.43 0.00 0.00 52.55 53.59 2np0 s ASP 611 Cb 0.24 -2.13 -0.05 0.00 -0.30 0.00 0.00 42.92 40.68 2np0 s ASP 611 CO 0.79 0.31 0.64 0.29 -0.17 0.00 0.00 175.17 177.03 2np0 n LYS 612 N 2.40 2.37 -0.01 4.34 5.02 -1.25 -3.87 118.16 127.16 2np0 n LYS 612 Ca -0.17 -0.44 0.13 0.00 -2.02 0.00 0.00 58.31 55.81 2np0 n LYS 612 Cb 0.53 -1.11 0.33 0.00 -0.02 0.00 0.00 35.03 34.76 2np0 n LYS 612 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2np0 n ILE 613 N -0.58 0.03 0.21 -0.18 5.41 -1.26 -4.67 119.36 118.31 2np0 n ILE 613 Ca 0.04 -0.38 0.05 0.00 1.00 0.00 0.00 62.75 63.46 2np0 n ILE 613 Cb 0.23 0.93 0.44 0.00 -0.71 0.00 0.00 39.64 40.53 2np0 n ILE 613 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2np0 h ALA 614 N 4.49 1.46 -1.41 -1.39 0.00 -1.94 -3.47 119.26 117.00 2np0 h ALA 614 Ca 0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2np0 h ALA 614 Cb 0.73 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.48 2np0 h ALA 614 CO 0.00 0.35 -0.04 -0.25 0.00 0.00 0.00 179.25 179.32 2np0 n ASP 615 N -4.10 -2.18 -4.06 0.00 8.00 -1.26 -5.08 116.55 107.87 2np0 n ASP 615 Ca -0.02 -0.03 -0.29 0.00 0.71 0.00 0.00 54.79 55.17 2np0 n ASP 615 Cb 0.34 -0.73 -0.17 0.00 -0.02 0.00 0.00 41.12 40.54 2np0 n ASP 615 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2np0 s ILE 616 N -3.02 1.52 -0.01 0.53 1.01 -1.26 -5.04 121.20 114.93 2np0 s ILE 616 Ca 0.02 -0.65 -0.01 0.00 0.00 0.00 0.00 60.65 60.01 2np0 s ILE 616 Cb -0.01 -1.39 -0.01 0.00 0.01 0.00 0.00 42.46 41.06 2np0 s ILE 616 CO 0.04 0.45 0.17 0.77 0.00 0.00 0.00 174.94 176.36 2np0 h SER 617 N 7.44 -0.03 -3.12 3.58 4.64 -1.98 -3.46 113.55 120.63 2np0 h SER 617 Ca -0.31 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.40 2np0 h SER 617 Cb 1.17 0.01 -0.09 0.00 -0.31 0.00 0.00 62.40 63.18 2np0 h SER 617 CO 0.49 0.05 -0.38 -0.76 -0.87 0.00 0.00 176.83 175.36 2np0 s LEU 618 N -4.80 4.29 -0.04 5.97 1.43 -1.26 -4.94 118.68 119.33 2np0 s LEU 618 Ca -0.01 0.48 -0.18 0.00 -1.03 0.00 0.00 54.13 53.40 2np0 s LEU 618 Cb 0.00 -2.26 0.03 0.00 0.03 0.00 0.00 46.19 43.99 2np0 s LEU 618 CO 0.02 0.21 0.39 -0.51 0.23 0.00 0.00 176.35 176.69 2np0 s ILE 619 N -0.05 0.04 -0.27 -0.59 2.07 -1.25 -4.95 121.20 116.20 2np0 s ILE 619 Ca 0.15 -0.32 0.02 0.00 -1.41 0.00 0.00 60.65 59.10 2np0 s ILE 619 Cb -0.13 -0.68 0.07 0.00 0.13 0.00 0.00 42.46 41.86 2np0 s ILE 619 CO 0.04 -0.17 -0.05 -0.69 -1.91 0.00 0.00 174.94 172.16 2np0 s VAL 620 N -1.06 1.94 -0.06 4.00 1.01 -1.26 -3.86 120.40 121.11 2np0 s VAL 620 Ca -0.11 -1.66 0.30 0.00 0.00 0.00 0.00 61.98 60.51 2np0 s VAL 620 Cb -0.04 -2.20 0.37 0.00 0.00 0.00 0.00 36.38 34.52 2np0 s VAL 620 CO 0.05 -0.21 1.87 -0.65 0.00 0.00 0.00 175.10 176.15 2np0 h PRO 621 N 7.81 0.00 -0.13 2.72 0.11 -1.85 -2.99 132.00 137.66 2np0 h PRO 621 Ca -0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 2np0 h PRO 621 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2np0 h PRO 621 CO 0.46 0.01 0.00 2.48 -0.21 0.00 0.00 178.00 180.74 2np0 n TYR 622 N -3.10 0.16 -0.24 0.65 0.18 -1.26 -4.25 117.16 109.31 2np0 n TYR 622 Ca 0.02 -0.08 -0.05 0.00 1.88 0.00 0.00 57.90 59.67 2np0 n TYR 622 Cb 0.37 0.00 0.11 0.00 -0.38 0.00 0.00 39.34 39.44 2np0 n TYR 622 CO 0.00 0.00 0.00 0.82 -2.08 0.00 0.00 176.86 175.60 2np0 h ILE 623 N 1.82 1.25 0.11 -3.48 2.04 -1.92 -1.64 117.51 115.69 2np0 h ILE 623 Ca 0.00 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.03 2np0 h ILE 623 Cb 0.40 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2np0 h ILE 623 CO 0.00 0.33 -0.08 1.23 0.00 0.00 0.00 178.15 179.63 2np0 h GLY 624 N 1.10 -0.19 2.00 5.37 0.00 -1.76 -2.60 103.07 106.99 2np0 h GLY 624 Ca 0.24 0.09 -0.04 0.00 0.00 0.00 0.00 47.33 47.62 2np0 h GLY 624 CO -0.01 -0.09 -0.20 1.41 0.00 0.00 0.00 176.54 177.65 2np0 h LEU 625 N -0.20 0.00 -0.01 3.11 3.38 -1.61 0.18 115.31 120.16 2np0 h LEU 625 Ca -0.00 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.72 2np0 h LEU 625 Cb 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 2np0 h LEU 625 CO -0.00 0.20 -1.10 0.00 0.09 0.00 0.00 178.44 177.63 2np0 h ALA 626 N 1.80 0.25 0.00 1.53 0.00 -0.94 -3.40 119.26 118.49 2np0 h ALA 626 Ca -0.00 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 54.07 2np0 h ALA 626 Cb 0.43 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2np0 h ALA 626 CO 0.03 0.99 -0.90 1.28 0.00 0.00 0.00 179.25 180.65 2np0 n LEU 627 N -3.55 0.00 -1.90 0.00 4.77 -1.04 -4.48 117.00 110.79 2np0 n LEU 627 Ca -0.06 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.83 2np0 n LEU 627 Cb 0.95 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.02 2np0 n LEU 627 CO 0.51 0.00 -0.10 -3.20 -1.33 0.00 0.00 177.39 173.27 2np0 n ASN 628 N -1.36 -2.76 -4.77 -1.43 5.15 0.04 -2.75 115.26 107.38 2np0 n ASN 628 Ca 0.00 0.25 -0.38 0.00 -0.60 0.00 0.00 54.58 53.85 2np0 n ASN 628 Cb 0.02 -2.53 -0.02 0.00 -0.53 0.00 0.00 39.78 36.71 2np0 n ASN 628 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2np0 s VAL 629 N -2.13 3.19 0.00 3.44 0.11 -1.26 -4.15 120.40 119.60 2np0 s VAL 629 Ca 0.00 1.01 0.00 0.00 -2.93 0.00 0.00 61.98 60.06 2np0 s VAL 629 Cb 0.00 -3.57 0.00 0.00 -1.53 0.00 0.00 36.38 31.28 2np0 s VAL 629 CO 0.00 0.10 0.00 0.61 -3.33 0.00 0.00 175.10 172.48 2np0 n GLY 630 N 0.65 0.85 3.33 6.54 0.00 -1.24 -3.94 105.19 111.38 2np0 n GLY 630 Ca 0.04 -1.35 -0.44 0.00 0.00 0.00 0.00 46.02 44.27 2np0 n GLY 630 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2np0 n ASN 631 N 1.45 5.50 -3.76 1.61 5.15 0.30 -4.66 115.26 120.86 2np0 n ASN 631 Ca 0.00 -3.06 -0.23 0.00 -0.60 0.00 0.00 54.58 50.69 2np0 n ASN 631 Cb 0.00 -1.43 0.03 0.00 -0.53 0.00 0.00 39.78 37.85 2np0 n ASN 631 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2np0 n GLU 632 N 3.45 -4.87 0.05 1.20 -0.58 -1.26 -4.85 120.64 113.78 2np0 n GLU 632 Ca 0.29 0.60 0.09 0.00 -0.42 0.00 0.00 57.16 57.71 2np0 n GLU 632 Cb 0.39 -5.17 0.38 0.00 -0.57 0.00 0.00 31.44 26.47 2np0 n GLU 632 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2np0 n THR 633 N -4.35 0.95 1.04 2.62 -2.24 -1.25 -1.73 114.28 109.31 2np0 n THR 633 Ca -0.25 0.25 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 2np0 n THR 633 Cb 0.66 -1.07 0.32 0.00 -2.10 0.00 0.00 70.33 68.14 2np0 n THR 633 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2np0 n ALA 634 N -1.60 3.32 -3.19 6.98 0.00 -1.21 -4.12 120.51 120.69 2np0 n ALA 634 Ca 0.03 -0.32 -0.35 0.00 0.00 0.00 0.00 53.44 52.80 2np0 n ALA 634 Cb 0.19 -1.17 -0.13 0.00 0.00 0.00 0.00 19.45 18.34 2np0 n ALA 634 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2np0 s LYS 635 N -2.93 3.57 0.00 0.00 1.02 -0.71 -4.72 119.74 115.97 2np0 s LYS 635 Ca 0.13 -0.54 0.00 0.00 0.02 0.00 0.00 55.97 55.59 2np0 s LYS 635 Cb 0.18 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 34.37 2np0 s LYS 635 CO 0.65 -0.08 0.00 0.41 -0.92 0.00 0.00 175.35 175.41 2np0 n GLY 636 N 4.53 -0.84 3.63 -3.33 0.00 -1.26 -4.85 105.19 103.08 2np0 n GLY 636 Ca -0.17 -1.66 -0.43 0.00 0.00 0.00 0.00 46.02 43.76 2np0 n GLY 636 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2np0 s ASN 637 N -3.23 6.54 0.07 1.61 3.84 -1.26 -4.91 114.94 117.60 2np0 s ASN 637 Ca 0.00 1.43 -0.24 0.00 0.21 0.00 0.00 52.86 54.26 2np0 s ASN 637 Cb 0.00 -2.54 -0.16 0.00 -0.55 0.00 0.00 41.25 38.00 2np0 s ASN 637 CO 0.00 -1.15 1.66 0.15 -2.79 0.00 0.00 177.10 174.97 2np0 h PHE 638 N 9.93 -0.06 -0.67 0.43 3.57 -1.85 -0.94 116.94 127.36 2np0 h PHE 638 Ca -0.30 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.31 2np0 h PHE 638 Cb 1.12 0.02 -0.12 0.00 2.79 0.00 0.00 35.95 39.77 2np0 h PHE 638 CO 0.89 0.03 -0.38 1.49 -2.23 0.00 0.00 178.31 178.11 2np0 h GLU 639 N -0.14 -0.15 -0.77 1.11 4.81 -1.91 0.42 114.58 117.95 2np0 h GLU 639 Ca -0.01 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.29 2np0 h GLU 639 Cb 0.12 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.48 2np0 h GLU 639 CO 0.01 -0.10 0.47 -0.91 -0.73 0.00 0.00 179.01 177.75 2np0 h ASN 640 N -0.15 0.73 -0.37 1.04 2.35 -1.84 -0.46 115.58 116.89 2np0 h ASN 640 Ca 0.23 0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.96 2np0 h ASN 640 Cb 0.56 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 2np0 h ASN 640 CO -0.74 0.48 0.09 0.00 -1.65 0.00 0.00 177.43 175.61 2np0 h ALA 641 N 1.36 0.48 -0.84 -0.83 0.00 0.35 -2.64 119.26 117.15 2np0 h ALA 641 Ca 0.33 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2np0 h ALA 641 Cb 0.13 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2np0 h ALA 641 CO -0.16 0.15 0.55 0.35 0.00 0.00 0.00 179.25 180.15 2np0 h PHE 642 N 0.44 1.04 -0.97 0.00 3.57 0.08 -1.70 116.94 119.40 2np0 h PHE 642 Ca 0.12 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.69 2np0 h PHE 642 Cb 0.30 -0.35 -0.06 0.00 2.79 0.00 0.00 35.95 38.63 2np0 h PHE 642 CO 0.02 0.64 0.63 1.49 -2.23 0.00 0.00 178.31 178.86 2np0 h GLU 643 N 1.11 1.16 0.07 1.11 4.81 -0.73 0.11 114.58 122.23 2np0 h GLU 643 Ca 0.31 -0.07 -0.27 0.00 -0.13 0.00 0.00 59.36 59.20 2np0 h GLU 643 Cb -0.10 -0.26 0.02 0.00 0.63 0.00 0.00 28.75 29.04 2np0 h GLU 643 CO -0.07 0.77 -1.13 0.82 -0.73 0.00 0.00 179.01 178.66 2np0 h ILE 644 N 1.20 1.35 0.00 2.32 2.04 -1.23 -3.42 117.51 119.77 2np0 h ILE 644 Ca 0.40 -2.53 0.00 0.00 1.00 0.00 0.00 64.86 63.73 2np0 h ILE 644 Cb 0.05 2.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2np0 h ILE 644 CO -0.14 0.76 0.00 0.00 0.00 0.00 0.00 178.15 178.77 2np0 n ALA 645 N -2.61 0.93 -0.33 1.87 0.00 -0.68 -4.87 120.51 114.83 2np0 n ALA 645 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2np0 n ALA 645 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.39 2np0 n ALA 645 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2np0 n GLY 646 N 0.44 -0.85 0.43 0.00 0.00 0.36 -3.93 105.19 101.64 2np0 n GLY 646 Ca 0.00 -1.17 0.24 0.00 0.00 0.00 0.00 46.02 45.09 2np0 n GLY 646 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2np0 h ALA 647 N -0.33 2.58 -0.63 4.61 0.00 -1.86 -0.70 119.26 122.93 2np0 h ALA 647 Ca 0.00 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.04 2np0 h ALA 647 Cb 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2np0 h ALA 647 CO 0.00 -0.83 0.43 0.77 0.00 0.00 0.00 179.25 179.62 2np0 h SER 648 N 0.14 0.22 0.58 0.00 0.02 -1.92 -2.58 113.55 110.01 2np0 h SER 648 Ca 0.42 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.38 2np0 h SER 648 Cb 1.43 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.93 2np0 h SER 648 CO -0.07 0.12 0.00 0.16 -1.14 0.00 0.00 176.83 175.90 2np0 h ILE 649 N 0.24 0.00 0.00 3.27 3.07 -1.32 -1.71 117.51 121.05 2np0 h ILE 649 Ca 0.30 -0.21 0.00 0.00 1.55 0.00 0.00 64.86 66.50 2np0 h ILE 649 Cb 0.85 0.94 0.00 0.00 -0.27 0.00 0.00 36.82 38.34 2np0 h ILE 649 CO -0.06 0.00 -0.36 0.18 -1.05 0.00 0.00 178.15 176.86 2np0 n LEU 650 N -2.41 0.59 -4.71 0.16 4.77 -0.97 -0.54 117.00 113.90 2np0 n LEU 650 Ca 0.01 0.31 -0.41 0.00 -0.03 0.00 0.00 56.01 55.89 2np0 n LEU 650 Cb 0.19 -0.27 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 2np0 n LEU 650 CO 0.19 -0.05 0.52 -0.76 -1.33 0.00 0.00 177.39 175.97 2np0 s LEU 651 N -3.90 4.31 0.38 2.23 1.43 -0.65 -3.66 118.68 118.82 2np0 s LEU 651 Ca 0.09 1.34 0.20 0.00 -1.03 0.00 0.00 54.13 54.73 2np0 s LEU 651 Cb 0.15 -3.27 0.66 0.00 0.03 0.00 0.00 46.19 43.76 2np0 s LEU 651 CO 0.66 -0.21 1.72 -0.08 0.23 0.00 0.00 176.35 178.67 2np0 h GLU 652 N 6.86 0.00 -3.36 1.70 4.57 -1.88 -3.39 114.58 119.08 2np0 h GLU 652 Ca -0.39 0.00 -0.28 0.00 -1.18 0.00 0.00 59.36 57.51 2np0 h GLU 652 Cb 1.19 0.00 -0.33 0.00 -0.16 0.00 0.00 28.75 29.45 2np0 h GLU 652 CO 0.77 0.35 -0.67 0.12 -1.18 0.00 0.00 179.01 178.40 2np0 s PHE 653 N -3.53 -0.07 -0.56 0.92 5.36 -1.26 -4.95 117.98 113.89 2np0 s PHE 653 Ca 0.01 0.33 -0.17 0.00 -0.96 0.00 0.00 56.93 56.13 2np0 s PHE 653 Cb 0.10 -0.19 0.11 0.00 -0.34 0.00 0.00 43.02 42.71 2np0 s PHE 653 CO 0.68 -0.14 0.59 0.42 -1.46 0.00 0.00 175.22 175.31 2np0 s ILE 654 N 1.27 5.02 0.68 3.12 -1.09 -1.26 -5.01 121.20 123.93 2np0 s ILE 654 Ca -0.07 -1.23 -0.15 0.00 -2.23 0.00 0.00 60.65 56.96 2np0 s ILE 654 Cb -0.12 -4.40 0.01 0.00 -1.58 0.00 0.00 42.46 36.36 2np0 s ILE 654 CO -0.05 -0.98 1.14 -2.16 -1.23 0.00 0.00 174.94 171.66 2np0 s PRO 655 N 2.13 2.62 -0.22 2.79 0.04 -1.26 -5.00 135.00 136.10 2np0 s PRO 655 Ca 0.07 1.50 -0.17 0.00 0.04 0.00 0.00 61.00 62.45 2np0 s PRO 655 Cb -0.27 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 2np0 s PRO 655 CO 0.05 -1.41 0.46 -1.21 0.04 0.00 0.00 177.00 174.93 2np0 s GLU 656 N -4.01 4.15 0.34 4.56 2.02 -1.26 -5.06 118.70 119.44 2np0 s GLU 656 Ca 0.69 0.29 -0.26 0.00 0.02 0.00 0.00 54.97 55.71 2np0 s GLU 656 Cb -0.23 -3.57 -0.10 0.00 0.10 0.00 0.00 34.13 30.33 2np0 s GLU 656 CO 0.42 -0.15 0.98 -0.51 0.02 0.00 0.00 175.26 176.03 2np0 s LEU 657 N 1.65 4.29 -0.32 1.80 1.43 -1.26 -4.85 118.68 121.42 2np0 s LEU 657 Ca 0.21 1.92 -0.21 0.00 -1.03 0.00 0.00 54.13 55.02 2np0 s LEU 657 Cb -0.15 -4.04 -0.00 0.00 0.03 0.00 0.00 46.19 42.02 2np0 s LEU 657 CO 0.09 -0.19 0.67 -0.22 0.23 0.00 0.00 176.35 176.93 2np0 s LEU 658 N -2.19 4.16 -0.38 1.79 2.96 -1.26 -5.00 118.68 118.76 2np0 s LEU 658 Ca 0.52 0.40 0.01 0.00 -0.22 0.00 0.00 54.13 54.84 2np0 s LEU 658 Cb -0.20 -2.87 0.15 0.00 0.50 0.00 0.00 46.19 43.77 2np0 s LEU 658 CO 0.26 -0.55 0.25 -0.63 -1.32 0.00 0.00 176.35 174.36 2np0 s ILE 659 N 2.73 0.40 0.59 6.68 1.01 -1.26 -4.88 121.20 126.46 2np0 s ILE 659 Ca 0.27 -2.06 -0.18 0.00 0.00 0.00 0.00 60.65 58.68 2np0 s ILE 659 Cb -0.15 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.00 2np0 s ILE 659 CO 0.13 -1.03 1.12 -2.84 0.00 0.00 0.00 174.94 172.33 2np0 s PRO 660 N 0.72 3.12 -0.18 2.79 0.02 -1.26 -4.97 135.00 135.25 2np0 s PRO 660 Ca 0.21 1.53 -0.29 0.00 0.02 0.00 0.00 61.00 62.47 2np0 s PRO 660 Cb -0.17 -1.98 -0.02 0.00 0.02 0.00 0.00 34.50 32.35 2np0 s PRO 660 CO -0.04 -1.02 1.35 0.08 -0.33 0.00 0.00 177.00 177.05 2np0 s VAL 661 N -1.99 4.11 0.25 3.83 1.01 -1.26 -4.88 120.40 121.46 2np0 s VAL 661 Ca 0.71 1.32 -0.31 0.00 0.00 0.00 0.00 61.98 63.70 2np0 s VAL 661 Cb -0.23 -3.93 -0.11 0.00 0.00 0.00 0.00 36.38 32.11 2np0 s VAL 661 CO 0.33 -0.21 1.60 -0.69 0.00 0.00 0.00 175.10 176.13 2np0 s VAL 662 N 3.90 2.22 0.78 2.92 1.01 -1.26 -3.96 120.40 126.01 2np0 s VAL 662 Ca 0.59 0.17 -0.13 0.00 0.00 0.00 0.00 61.98 62.62 2np0 s VAL 662 Cb -0.23 -3.11 0.07 0.00 0.00 0.00 0.00 36.38 33.11 2np0 s VAL 662 CO 0.19 0.02 1.15 -0.83 0.00 0.00 0.00 175.10 175.64 2np0 s GLY 663 N 0.74 1.98 0.71 4.51 0.00 -0.77 -4.93 107.32 109.56 2np0 s GLY 663 Ca 0.67 0.61 -0.11 0.00 0.00 0.00 0.00 44.72 45.89 2np0 s GLY 663 CO 0.41 1.00 1.07 0.00 0.00 0.00 0.00 173.10 175.58 2np0 s ALA 664 N -2.43 2.55 -0.13 3.20 0.00 -1.26 -4.71 121.76 118.98 2np0 s ALA 664 Ca 0.68 0.18 -0.07 0.00 0.00 0.00 0.00 51.96 52.75 2np0 s ALA 664 Cb -0.23 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 2np0 s ALA 664 CO 0.51 -1.36 0.11 -0.06 0.00 0.00 0.00 175.76 174.97 2np0 s PHE 665 N -2.94 3.49 -0.37 0.00 0.40 -1.26 -1.41 117.98 115.90 2np0 s PHE 665 Ca 0.60 0.43 -0.07 0.00 -0.60 0.00 0.00 56.93 57.28 2np0 s PHE 665 Cb -0.15 -1.96 0.05 0.00 0.51 0.00 0.00 43.02 41.47 2np0 s PHE 665 CO 0.53 0.61 0.16 -0.51 0.70 0.00 0.00 175.22 176.71 2np0 s LEU 666 N -0.75 4.62 -0.21 -0.37 1.43 0.15 -4.95 118.68 118.60 2np0 s LEU 666 Ca 0.13 -1.26 -0.24 0.00 -1.03 0.00 0.00 54.13 51.74 2np0 s LEU 666 Cb -0.12 -1.91 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 2np0 s LEU 666 CO 0.03 -0.40 0.79 -0.76 0.23 0.00 0.00 176.35 176.24 2np0 s LEU 667 N 1.41 4.12 0.64 1.79 1.43 -1.26 -1.22 118.68 125.59 2np0 s LEU 667 Ca 0.00 1.03 -0.17 0.00 -1.03 0.00 0.00 54.13 53.96 2np0 s LEU 667 Cb -0.20 -3.14 -0.01 0.00 0.03 0.00 0.00 46.19 42.87 2np0 s LEU 667 CO 0.03 -0.43 1.18 -0.70 0.23 0.00 0.00 176.35 176.66 2np0 s GLU 668 N 2.44 2.76 0.04 1.70 2.56 0.23 -4.95 118.70 123.47 2np0 s GLU 668 Ca 0.35 1.71 0.03 0.00 0.00 0.00 0.00 54.97 57.06 2np0 s GLU 668 Cb -0.16 -1.91 -0.04 0.00 2.00 0.00 0.00 34.13 34.02 2np0 s GLU 668 CO 0.10 -1.35 -0.01 -1.54 -0.56 0.00 0.00 175.26 171.90 2np0 s SER 669 N -1.90 5.01 -0.42 -1.70 1.04 -1.26 -4.95 113.70 109.51 2np0 s SER 669 Ca 0.74 -0.10 0.09 0.00 0.48 0.00 0.00 55.95 57.17 2np0 s SER 669 Cb -0.28 -1.24 0.31 0.00 0.10 0.00 0.00 66.02 64.91 2np0 s SER 669 CO 0.37 0.24 0.69 -1.22 0.98 0.00 0.00 173.24 174.29 2np0 n TYR 670 N 1.08 0.70 -1.30 5.02 4.02 -1.26 -5.08 117.16 120.33 2np0 n TYR 670 Ca -0.13 -3.78 -0.51 0.00 -0.01 0.00 0.00 57.90 53.47 2np0 n TYR 670 Cb 0.52 -0.42 -0.07 0.00 -0.02 0.00 0.00 39.34 39.36 2np0 n TYR 670 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 2np0 n ILE 671 N 0.65 0.00 -1.00 -0.72 5.41 -1.26 -1.00 119.36 121.45 2np0 n ILE 671 Ca 0.25 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.00 2np0 n ILE 671 Cb 0.57 -0.26 0.00 0.00 -0.71 0.00 0.00 39.64 39.24 2np0 n ILE 671 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2np0 n ASP 672 N 2.46 -1.70 -3.84 4.38 2.03 -1.26 -4.98 116.55 113.64 2np0 n ASP 672 Ca 0.21 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.22 2np0 n ASP 672 Cb -0.01 -0.33 -0.15 0.00 -0.72 0.00 0.00 41.12 39.91 2np0 n ASP 672 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2np0 s ASN 673 N -2.44 4.21 0.23 1.67 3.84 -0.17 -4.97 114.94 117.32 2np0 s ASN 673 Ca 0.00 -2.13 -0.08 0.00 0.21 0.00 0.00 52.86 50.87 2np0 s ASN 673 Cb 0.00 -1.21 0.25 0.00 -0.55 0.00 0.00 41.25 39.74 2np0 s ASN 673 CO 0.00 -0.36 1.88 0.50 -2.79 0.00 0.00 177.10 176.33 2np0 h LYS 674 N 7.52 1.03 -0.73 0.43 3.64 -1.83 -2.68 116.57 123.95 2np0 h LYS 674 Ca -0.08 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.23 2np0 h LYS 674 Cb 0.99 -0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 32.54 2np0 h LYS 674 CO 0.51 0.68 0.40 -0.97 -2.27 0.00 0.00 179.45 177.80 2np0 h ASN 675 N 1.06 0.90 1.52 4.20 -0.00 -1.93 -2.19 115.58 119.14 2np0 h ASN 675 Ca 0.33 -0.07 -0.03 0.00 -0.00 0.00 0.00 56.30 56.53 2np0 h ASN 675 Cb -0.00 -0.23 -0.00 0.00 -0.00 0.00 0.00 38.32 38.08 2np0 h ASN 675 CO -0.11 0.73 -0.17 0.11 -0.00 0.00 0.00 177.43 177.99 2np0 h LYS 676 N 1.02 0.00 -0.09 6.67 1.57 -1.89 -2.83 116.57 121.01 2np0 h LYS 676 Ca 0.26 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.85 2np0 h LYS 676 Cb 0.03 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.35 2np0 h LYS 676 CO -0.04 0.17 -0.70 0.82 -0.57 0.00 0.00 179.45 179.13 2np0 h ILE 677 N 0.00 1.33 -0.37 1.86 2.04 -1.08 -2.16 117.51 119.13 2np0 h ILE 677 Ca -0.00 -1.98 -0.14 0.00 1.00 0.00 0.00 64.86 63.74 2np0 h ILE 677 Cb 0.97 2.21 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 2np0 h ILE 677 CO 0.02 0.61 -0.34 0.40 0.00 0.00 0.00 178.15 178.84 2np0 h ILE 678 N 0.27 1.28 -0.33 -0.67 2.04 -1.49 -2.05 117.51 116.57 2np0 h ILE 678 Ca -0.06 -1.50 -0.07 0.00 1.00 0.00 0.00 64.86 64.23 2np0 h ILE 678 Cb 1.35 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.76 2np0 h ILE 678 CO 0.14 0.50 -0.09 0.11 0.00 0.00 0.00 178.15 178.81 2np0 h LYS 679 N 0.71 0.55 -0.20 2.37 1.57 -1.55 -0.22 116.57 119.79 2np0 h LYS 679 Ca 0.07 -0.15 -0.10 0.00 -1.87 0.00 0.00 60.65 58.60 2np0 h LYS 679 Cb 0.90 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 2np0 h LYS 679 CO 0.08 0.65 -0.30 1.15 -0.57 0.00 0.00 179.45 180.45 2np0 h THR 680 N 0.51 1.28 0.29 -0.16 2.02 -1.13 0.16 112.91 115.88 2np0 h THR 680 Ca 0.10 -1.34 -0.01 0.00 0.77 0.00 0.00 66.41 65.92 2np0 h THR 680 Cb 0.47 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 2np0 h THR 680 CO 0.03 0.42 -0.14 0.40 0.37 0.00 0.00 175.52 176.59 2np0 h ILE 681 N 0.35 0.69 -1.00 3.11 2.04 -0.84 -1.67 117.51 120.19 2np0 h ILE 681 Ca 0.05 -0.71 0.16 0.00 1.00 0.00 0.00 64.86 65.36 2np0 h ILE 681 Cb 0.71 1.03 -0.09 0.00 -0.74 0.00 0.00 36.82 37.73 2np0 h ILE 681 CO 0.05 0.13 0.62 0.44 0.00 0.00 0.00 178.15 179.40 2np0 h ASP 682 N -0.81 0.83 0.42 1.72 3.32 -0.99 0.00 116.42 120.92 2np0 h ASP 682 Ca -0.04 0.07 -0.13 0.00 0.02 0.00 0.00 57.03 56.95 2np0 h ASP 682 Cb 0.51 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 2np0 h ASP 682 CO 0.07 0.37 -0.58 0.78 -1.72 0.00 0.00 179.24 178.16 2np0 h ASN 683 N 0.85 0.18 -0.52 6.45 2.35 -0.65 -1.91 115.58 122.33 2np0 h ASN 683 Ca 0.53 -0.10 -0.10 0.00 -0.55 0.00 0.00 56.30 56.09 2np0 h ASN 683 Cb 0.72 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.02 2np0 h ASN 683 CO -0.31 0.72 -0.05 0.00 -1.65 0.00 0.00 177.43 176.13 2np0 h ALA 684 N 1.29 0.71 -0.23 -0.83 0.00 -0.03 -1.17 119.26 119.00 2np0 h ALA 684 Ca -0.00 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 2np0 h ALA 684 Cb 1.05 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2np0 h ALA 684 CO 0.08 0.58 -0.18 -0.07 0.00 0.00 0.00 179.25 179.66 2np0 h LEU 685 N 0.83 0.55 -0.34 0.00 3.38 -1.26 -1.80 115.31 116.66 2np0 h LEU 685 Ca 0.14 -0.45 0.05 0.00 0.09 0.00 0.00 57.88 57.71 2np0 h LEU 685 Cb 0.60 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 2np0 h LEU 685 CO 0.04 0.89 0.08 0.74 0.09 0.00 0.00 178.44 180.28 2np0 h THR 686 N 0.23 0.85 -0.04 0.22 2.02 -1.33 -1.84 112.91 113.02 2np0 h THR 686 Ca 0.04 -0.07 0.01 0.00 0.77 0.00 0.00 66.41 67.16 2np0 h THR 686 Cb 0.71 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.74 2np0 h THR 686 CO 0.05 0.04 0.04 0.11 0.37 0.00 0.00 175.52 176.12 2np0 h LYS 687 N 0.21 0.00 -0.32 6.66 1.79 -1.07 -2.46 116.57 121.38 2np0 h LYS 687 Ca 0.16 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.52 2np0 h LYS 687 Cb 0.16 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 2np0 h LYS 687 CO -0.19 0.00 -0.22 -0.09 -1.08 0.00 0.00 179.45 177.86 2np0 h ARG 688 N 0.00 0.72 -0.75 3.15 1.12 -0.47 -2.29 114.38 115.85 2np0 h ARG 688 Ca 0.02 -0.34 0.04 0.00 -1.11 0.00 0.00 59.98 58.59 2np0 h ARG 688 Cb 0.10 -0.01 -0.04 0.00 -0.01 0.00 0.00 29.97 30.01 2np0 h ARG 688 CO -0.00 0.96 0.50 -0.91 -3.11 0.00 0.00 179.97 177.40 2np0 h ASN 689 N 0.49 0.77 -0.49 -3.80 4.21 -1.18 -1.44 115.58 114.14 2np0 h ASN 689 Ca 0.06 -0.01 -0.04 0.00 1.21 0.00 0.00 56.30 57.53 2np0 h ASN 689 Cb 0.78 -0.17 -0.03 0.00 -1.12 0.00 0.00 38.32 37.78 2np0 h ASN 689 CO 0.06 0.52 0.17 -0.08 -1.29 0.00 0.00 177.43 176.82 2np0 h GLU 690 N 0.89 0.81 -0.12 0.81 4.81 -1.21 0.00 114.58 120.57 2np0 h GLU 690 Ca 0.31 -0.14 -0.13 0.00 -0.13 0.00 0.00 59.36 59.26 2np0 h GLU 690 Cb 0.10 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.35 2np0 h GLU 690 CO -0.09 0.70 -0.45 0.87 -0.73 0.00 0.00 179.01 179.31 2np0 h LYS 691 N 0.79 0.51 0.26 1.92 1.79 -0.81 0.12 116.57 121.15 2np0 h LYS 691 Ca 0.18 -0.39 0.01 0.00 -2.18 0.00 0.00 60.65 58.26 2np0 h LYS 691 Cb 0.23 0.07 -0.04 0.00 -1.58 0.00 0.00 32.23 30.91 2np0 h LYS 691 CO -0.01 1.02 -0.47 -1.49 -1.08 0.00 0.00 179.45 177.42 2np0 h TRP 692 N 0.12 -1.32 -0.22 -1.35 4.06 -1.15 0.11 115.95 116.20 2np0 h TRP 692 Ca -0.02 0.02 0.06 0.00 2.06 0.00 0.00 58.89 61.01 2np0 h TRP 692 Cb 1.08 0.54 -0.06 0.00 -1.00 0.00 0.00 29.16 29.72 2np0 h TRP 692 CO 0.11 -0.59 -0.18 1.03 -3.56 0.00 0.00 178.44 175.26 2np0 h SER 693 N -0.80 -0.58 -0.99 -3.49 0.87 -0.98 -0.61 113.55 106.98 2np0 h SER 693 Ca -0.01 0.12 0.08 0.00 -1.23 0.00 0.00 61.79 60.75 2np0 h SER 693 Cb 0.76 0.29 -0.07 0.00 -0.44 0.00 0.00 62.40 62.94 2np0 h SER 693 CO -0.19 -0.22 0.63 0.44 -0.53 0.00 0.00 176.83 176.97 2np0 h ASP 694 N -0.18 0.98 -0.22 6.23 5.19 -0.59 0.12 116.42 127.95 2np0 h ASP 694 Ca 0.13 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.54 2np0 h ASP 694 Cb 0.38 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.69 2np0 h ASP 694 CO -0.33 0.59 0.07 -0.03 -3.12 0.00 0.00 179.24 176.42 2np0 h MET 695 N 1.09 0.33 -0.67 3.56 4.05 -0.22 0.15 114.93 123.22 2np0 h MET 695 Ca 0.45 -0.07 0.04 0.00 -0.28 0.00 0.00 59.70 59.84 2np0 h MET 695 Cb 0.29 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 30.99 2np0 h MET 695 CO -0.20 0.42 0.40 1.88 0.23 0.00 0.00 176.91 179.65 2np0 h TYR 696 N 0.18 0.75 -0.68 1.39 0.99 -0.39 -1.27 116.97 117.94 2np0 h TYR 696 Ca 0.07 0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.86 2np0 h TYR 696 Cb 0.23 -0.24 -0.04 0.00 1.00 0.00 0.00 36.73 37.68 2np0 h TYR 696 CO 0.00 0.40 0.45 0.78 -0.00 0.00 0.00 178.16 179.80 2np0 h GLY 697 N 0.77 0.93 1.24 3.88 0.00 -0.45 0.96 103.07 110.41 2np0 h GLY 697 Ca 0.28 -0.32 -0.10 0.00 0.00 0.00 0.00 47.33 47.19 2np0 h GLY 697 CO -0.13 0.27 -0.09 -2.00 0.00 0.00 0.00 176.54 174.59 2np0 h LEU 698 N 0.81 0.89 -0.23 3.11 5.85 -0.05 -1.25 115.31 124.44 2np0 h LEU 698 Ca 0.28 -0.27 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 2np0 h LEU 698 Cb 0.09 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.87 2np0 h LEU 698 CO -0.08 1.00 -0.18 0.40 -0.34 0.00 0.00 178.44 179.24 2np0 h ILE 699 N 0.81 1.31 -0.53 4.05 1.08 -0.09 -2.71 117.51 121.43 2np0 h ILE 699 Ca 0.13 -1.32 0.01 0.00 -0.39 0.00 0.00 64.86 63.30 2np0 h ILE 699 Cb 0.61 1.66 -0.03 0.00 -3.07 0.00 0.00 36.82 35.99 2np0 h ILE 699 CO 0.04 0.41 0.35 0.58 -0.69 0.00 0.00 178.15 178.84 2np0 h VAL 700 N 0.24 1.13 -0.78 1.67 2.07 -0.81 0.29 116.25 120.05 2np0 h VAL 700 Ca 0.04 -0.25 0.09 0.00 0.82 0.00 0.00 66.70 67.41 2np0 h VAL 700 Cb 0.72 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 30.77 2np0 h VAL 700 CO 0.05 0.13 0.43 0.00 0.02 0.00 0.00 177.57 178.20 2np0 h ALA 701 N 1.20 1.10 -0.16 1.67 0.00 -1.17 -0.99 119.26 120.91 2np0 h ALA 701 Ca 0.20 0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.94 2np0 h ALA 701 Cb -0.07 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.61 2np0 h ALA 701 CO -0.05 0.06 -0.68 1.96 0.00 0.00 0.00 179.25 180.54 2np0 h GLN 702 N 0.74 0.74 -0.30 0.00 4.20 -1.03 -2.78 115.11 116.66 2np0 h GLN 702 Ca 0.38 -0.58 0.05 0.00 0.06 0.00 0.00 58.65 58.55 2np0 h GLN 702 Cb 0.34 0.12 -0.05 0.00 0.30 0.00 0.00 27.48 28.19 2np0 h GLN 702 CO -0.24 1.20 0.01 2.35 -0.67 0.00 0.00 178.83 181.47 2np0 h TRP 703 N 0.45 0.01 0.00 2.96 7.01 0.00 -0.60 115.95 125.78 2np0 h TRP 703 Ca -0.04 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 60.93 2np0 h TRP 703 Cb 1.31 0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 28.40 2np0 h TRP 703 CO 0.09 -0.04 -0.27 -0.07 -2.79 0.00 0.00 178.44 175.37 2np0 h LEU 704 N 0.11 0.00 -1.54 0.65 3.38 -1.16 -0.16 115.31 116.58 2np0 h LEU 704 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2np0 h LEU 704 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2np0 h LEU 704 CO -0.23 0.27 0.00 -1.54 0.09 0.00 0.00 178.44 177.02 2np0 n SER 705 N -3.47 2.00 0.00 -0.43 3.41 -1.05 -3.77 113.62 110.31 2np0 n SER 705 Ca -0.00 -1.50 0.00 0.00 -0.26 0.00 0.00 58.87 57.10 2np0 n SER 705 Cb 0.44 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 2np0 n SER 705 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2np0 n THR 706 N 0.62 0.00 0.02 6.66 -2.24 -0.26 -0.92 114.28 118.16 2np0 n THR 706 Ca 0.07 -0.03 -0.01 0.00 -2.27 0.00 0.00 64.05 61.80 2np0 n THR 706 Cb 0.29 0.33 -0.00 0.00 -2.10 0.00 0.00 70.33 68.84 2np0 n THR 706 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2np0 n VAL 707 N -0.56 0.86 0.32 2.28 0.31 -0.50 -4.43 118.33 116.61 2np0 n VAL 707 Ca 0.00 0.24 0.20 0.00 -0.01 0.00 0.00 64.34 64.77 2np0 n VAL 707 Cb 0.00 -1.61 1.11 0.00 -0.91 0.00 0.00 33.84 32.43 2np0 n VAL 707 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 2np0 h ASN 708 N -0.08 0.00 -0.04 4.52 -0.00 -1.27 -0.58 115.58 118.12 2np0 h ASN 708 Ca -0.02 0.00 -0.07 0.00 -0.00 0.00 0.00 56.30 56.21 2np0 h ASN 708 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.75 2np0 h ASN 708 CO -0.01 0.00 -0.24 0.71 -0.00 0.00 0.00 177.43 177.89 2np0 h THR 709 N 0.00 1.46 -0.55 -3.57 1.35 -1.80 -1.55 112.91 108.26 2np0 h THR 709 Ca 0.00 -1.72 0.06 0.00 -0.55 0.00 0.00 66.41 64.20 2np0 h THR 709 Cb 0.02 2.45 -0.05 0.00 -1.73 0.00 0.00 68.15 68.84 2np0 h THR 709 CO -0.00 0.48 0.26 1.56 -0.25 0.00 0.00 175.52 177.57 2np0 h GLN 710 N -0.31 0.48 -0.24 4.72 4.20 -1.36 -1.12 115.11 121.47 2np0 h GLN 710 Ca -0.02 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 2np0 h GLN 710 Cb 0.91 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.57 2np0 h GLN 710 CO 0.05 0.32 -0.11 0.74 -0.67 0.00 0.00 178.83 179.16 2np0 h PHE 711 N 0.49 0.42 -0.12 2.96 0.05 -1.27 -2.02 116.94 117.45 2np0 h PHE 711 Ca 0.25 -0.05 -0.00 0.00 3.82 0.00 0.00 57.97 61.99 2np0 h PHE 711 Cb 0.21 -0.12 -0.01 0.00 2.00 0.00 0.00 35.95 38.03 2np0 h PHE 711 CO -0.12 0.50 0.06 -0.92 -0.18 0.00 0.00 178.31 177.66 2np0 h TYR 712 N 0.37 0.17 -0.66 -0.55 3.20 -0.21 -1.08 116.97 118.21 2np0 h TYR 712 Ca 0.07 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.02 2np0 h TYR 712 Cb 0.43 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.60 2np0 h TYR 712 CO 0.01 0.21 0.44 1.15 -1.64 0.00 0.00 178.16 178.33 2np0 h THR 713 N 0.09 0.96 -0.33 1.81 2.02 -0.72 -0.75 112.91 115.99 2np0 h THR 713 Ca 0.04 -0.20 -0.09 0.00 0.77 0.00 0.00 66.41 66.93 2np0 h THR 713 Cb 0.09 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 2np0 h THR 713 CO -0.01 0.11 -0.15 0.40 0.37 0.00 0.00 175.52 176.24 2np0 h ILE 714 N 0.59 1.29 -0.66 3.11 2.04 -0.69 -1.18 117.51 122.02 2np0 h ILE 714 Ca 0.30 -1.26 0.11 0.00 1.00 0.00 0.00 64.86 65.01 2np0 h ILE 714 Cb 0.39 1.41 -0.08 0.00 -0.74 0.00 0.00 36.82 37.80 2np0 h ILE 714 CO -0.10 0.41 0.25 0.11 0.00 0.00 0.00 178.15 178.83 2np0 h LYS 715 N 0.45 0.42 -0.54 2.37 1.57 0.09 -1.53 116.57 119.40 2np0 h LYS 715 Ca 0.07 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.73 2np0 h LYS 715 Cb 0.68 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 2np0 h LYS 715 CO 0.05 0.28 -0.07 0.93 -0.57 0.00 0.00 179.45 180.07 2np0 h GLU 716 N 0.43 0.99 -0.20 3.15 4.39 -0.98 -1.79 114.58 120.57 2np0 h GLU 716 Ca 0.34 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2np0 h GLU 716 Cb 0.44 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 2np0 h GLU 716 CO -0.33 1.01 0.13 0.78 -1.16 0.00 0.00 179.01 179.44 2np0 h GLY 717 N 0.97 0.28 1.48 -3.84 0.00 -0.76 -1.35 103.07 99.85 2np0 h GLY 717 Ca 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2np0 h GLY 717 CO 0.04 0.10 0.33 -0.33 0.00 0.00 0.00 176.54 176.68 2np0 h MET 718 N 0.26 0.69 -0.95 4.80 2.86 -1.08 0.13 114.93 121.64 2np0 h MET 718 Ca 0.07 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2np0 h MET 718 Cb -0.02 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 31.44 2np0 h MET 718 CO -0.02 0.47 0.63 -0.92 1.06 0.00 0.00 176.91 178.13 2np0 h TYR 719 N 0.71 1.20 -0.03 -0.22 3.20 -0.40 -1.42 116.97 120.01 2np0 h TYR 719 Ca 0.19 0.03 -0.25 0.00 3.14 0.00 0.00 58.73 61.83 2np0 h TYR 719 Cb -0.06 -0.41 0.02 0.00 1.54 0.00 0.00 36.73 37.82 2np0 h TYR 719 CO 0.00 0.76 -0.97 0.87 -1.64 0.00 0.00 178.16 177.18 2np0 h LYS 720 N 1.30 0.71 -0.27 1.82 1.57 -0.22 -2.74 116.57 118.75 2np0 h LYS 720 Ca 0.35 -0.73 -0.02 0.00 -1.87 0.00 0.00 60.65 58.38 2np0 h LYS 720 Cb -0.15 0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2np0 h LYS 720 CO -0.07 1.31 0.09 0.00 -0.57 0.00 0.00 179.45 180.20 2np0 h ALA 721 N 0.43 0.35 -0.87 3.86 0.00 -0.58 0.26 119.26 122.71 2np0 h ALA 721 Ca -0.11 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.69 2np0 h ALA 721 Cb 1.62 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 19.26 2np0 h ALA 721 CO 0.19 -0.03 0.56 -0.07 0.00 0.00 0.00 179.25 179.90 2np0 h LEU 722 N 0.27 0.93 -0.81 0.00 3.38 -1.35 -1.02 115.31 116.70 2np0 h LEU 722 Ca 0.09 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 2np0 h LEU 722 Cb 0.23 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2np0 h LEU 722 CO -0.00 0.64 -0.37 0.78 0.09 0.00 0.00 178.44 179.58 2np0 h ASN 723 N 1.09 0.47 -0.53 -0.43 2.35 -1.00 -1.52 115.58 116.01 2np0 h ASN 723 Ca 0.34 -0.19 -0.08 0.00 -0.55 0.00 0.00 56.30 55.82 2np0 h ASN 723 Cb 0.00 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 2np0 h ASN 723 CO -0.12 0.80 -0.00 1.88 -1.65 0.00 0.00 177.43 178.35 2np0 h TYR 724 N 0.38 1.02 -0.62 1.19 0.05 -0.11 -0.69 116.97 118.19 2np0 h TYR 724 Ca 0.04 -0.18 -0.01 0.00 0.05 0.00 0.00 58.73 58.63 2np0 h TYR 724 Cb 0.82 -0.26 -0.03 0.00 1.01 0.00 0.00 36.73 38.27 2np0 h TYR 724 CO 0.03 0.93 0.34 1.96 -1.05 0.00 0.00 178.16 180.37 2np0 h GLN 725 N 0.80 0.85 0.54 4.88 1.08 -0.67 -0.69 115.11 121.90 2np0 h GLN 725 Ca 0.15 -0.09 -0.03 0.00 -1.45 0.00 0.00 58.65 57.24 2np0 h GLN 725 Cb 0.53 -0.17 0.01 0.00 -0.05 0.00 0.00 27.48 27.79 2np0 h GLN 725 CO 0.03 0.62 -0.26 0.00 -0.95 0.00 0.00 178.83 178.27 2np0 h ALA 726 N 1.52 -0.73 -1.04 3.87 0.00 -1.11 -2.55 119.26 119.21 2np0 h ALA 726 Ca 0.22 -0.19 0.28 0.00 0.00 0.00 0.00 54.91 55.21 2np0 h ALA 726 Cb 0.02 0.28 -0.11 0.00 0.00 0.00 0.00 17.79 17.98 2np0 h ALA 726 CO -0.04 -0.74 0.65 1.96 0.00 0.00 0.00 179.25 181.08 2np0 h GLN 727 N -1.07 0.42 -0.06 0.00 4.20 -0.99 -0.64 115.11 116.97 2np0 h GLN 727 Ca -0.07 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 2np0 h GLN 727 Cb 0.62 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 2np0 h GLN 727 CO 0.12 0.28 -0.02 0.00 -0.67 0.00 0.00 178.83 178.54 2np0 h ALA 728 N 1.68 0.09 -0.65 3.87 0.00 -1.05 -1.78 119.26 121.42 2np0 h ALA 728 Ca 0.64 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.32 2np0 h ALA 728 Cb 1.50 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.24 2np0 h ALA 728 CO -0.40 -0.18 0.33 1.25 0.00 0.00 0.00 179.25 180.25 2np0 h LEU 729 N -0.24 0.83 -0.48 0.00 5.85 -0.98 0.97 115.31 121.26 2np0 h LEU 729 Ca 0.01 -0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.67 2np0 h LEU 729 Cb 0.44 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 2np0 h LEU 729 CO 0.01 0.70 0.21 -0.33 -0.34 0.00 0.00 178.44 178.69 2np0 h GLU 730 N 0.89 0.40 -0.72 1.25 5.08 -1.10 0.21 114.58 120.58 2np0 h GLU 730 Ca 0.22 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.52 2np0 h GLU 730 Cb 0.08 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2np0 h GLU 730 CO -0.03 0.26 0.29 1.49 -1.00 0.00 0.00 179.01 180.02 2np0 h GLU 731 N 0.41 1.08 -0.43 2.33 4.57 -0.88 -0.96 114.58 120.70 2np0 h GLU 731 Ca 0.22 -0.20 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 2np0 h GLU 731 Cb 0.18 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.58 2np0 h GLU 731 CO -0.19 0.89 0.27 0.82 -1.18 0.00 0.00 179.01 179.62 2np0 h ILE 732 N 1.03 1.12 -0.02 2.32 2.04 -0.14 -0.72 117.51 123.15 2np0 h ILE 732 Ca 0.24 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 2np0 h ILE 732 Cb 0.22 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.81 2np0 h ILE 732 CO -0.02 0.12 0.01 0.40 0.00 0.00 0.00 178.15 178.65 2np0 h ILE 733 N 0.57 1.15 -0.96 -0.67 2.04 -0.45 -2.12 117.51 117.07 2np0 h ILE 733 Ca 0.15 -0.43 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 2np0 h ILE 733 Cb -0.04 1.41 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 2np0 h ILE 733 CO -0.03 0.11 0.59 0.50 0.00 0.00 0.00 178.15 179.32 2np0 h LYS 734 N -0.15 1.29 -0.26 2.37 3.64 -1.05 -1.30 116.57 121.12 2np0 h LYS 734 Ca 0.01 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 2np0 h LYS 734 Cb 0.18 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2np0 h LYS 734 CO -0.00 0.89 0.10 -0.92 -2.27 0.00 0.00 179.45 177.25 2np0 h TYR 735 N 1.32 0.39 -0.34 1.91 3.20 -1.07 -2.39 116.97 119.99 2np0 h TYR 735 Ca 0.35 -0.03 -0.15 0.00 3.14 0.00 0.00 58.73 62.03 2np0 h TYR 735 Cb -0.08 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.07 2np0 h TYR 735 CO 0.00 0.40 -0.39 0.00 -1.64 0.00 0.00 178.16 176.54 2np0 h ARG 736 N 0.26 0.81 -0.17 1.82 3.08 -0.91 -2.62 114.38 116.66 2np0 h ARG 736 Ca 0.09 -0.42 0.05 0.00 0.07 0.00 0.00 59.98 59.76 2np0 h ARG 736 Cb 0.18 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.19 2np0 h ARG 736 CO -0.01 1.06 -0.15 -0.92 -1.07 0.00 0.00 179.97 178.88 2np0 h TYR 737 N 0.66 -0.38 0.00 3.04 3.20 -1.27 -2.98 116.97 119.25 2np0 h TYR 737 Ca 0.05 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2np0 h TYR 737 Cb 0.96 0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.42 2np0 h TYR 737 CO 0.05 -0.22 0.00 0.09 -1.64 0.00 0.00 178.16 176.45 2np0 n ASN 738 N -5.30 0.00 0.25 -2.11 3.02 -0.90 -1.90 115.26 108.33 2np0 n ASN 738 Ca -0.02 0.46 0.14 0.00 -0.03 0.00 0.00 54.58 55.12 2np0 n ASN 738 Cb 0.22 -0.48 0.59 0.00 -0.61 0.00 0.00 39.78 39.49 2np0 n ASN 738 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2np0 h ILE 739 N 0.00 0.28 -4.21 2.41 2.04 -1.31 -3.46 117.51 113.26 2np0 h ILE 739 Ca 0.00 -0.78 -0.48 0.00 1.00 0.00 0.00 64.86 64.60 2np0 h ILE 739 Cb 0.34 1.61 0.03 0.00 -0.74 0.00 0.00 36.82 38.07 2np0 h ILE 739 CO 0.00 0.10 0.38 -0.31 0.00 0.00 0.00 178.15 178.32 2np0 s TYR 740 N -3.69 3.35 0.72 1.37 2.02 -0.80 -4.99 117.35 115.33 2np0 s TYR 740 Ca 0.01 1.47 -0.16 0.00 -0.37 0.00 0.00 57.07 58.01 2np0 s TYR 740 Cb 0.10 -2.84 0.01 0.00 -0.40 0.00 0.00 41.96 38.82 2np0 s TYR 740 CO 0.59 -0.58 0.99 -1.13 -1.57 0.00 0.00 175.55 173.85 2np0 n SER 741 N -1.78 0.56 -0.14 2.29 3.41 -1.26 -4.74 113.62 111.96 2np0 n SER 741 Ca 0.07 0.67 0.05 0.00 -0.26 0.00 0.00 58.87 59.40 2np0 n SER 741 Cb 0.54 -1.42 0.36 0.00 -0.26 0.00 0.00 64.21 63.43 2np0 n SER 741 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2np0 h GLU 742 N -0.23 0.72 0.05 4.33 3.07 -1.96 -0.50 114.58 120.07 2np0 h GLU 742 Ca -0.47 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 58.34 2np0 h GLU 742 Cb 1.33 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 29.08 2np0 h GLU 742 CO 0.47 0.47 -0.03 -0.22 -1.40 0.00 0.00 179.01 178.31 2np0 h LYS 743 N 0.74 -0.07 -1.03 2.33 3.64 -2.01 -3.00 116.57 117.17 2np0 h LYS 743 Ca 0.26 0.00 0.26 0.00 -1.27 0.00 0.00 60.65 59.90 2np0 h LYS 743 Cb 0.12 0.02 -0.11 0.00 -0.41 0.00 0.00 32.23 31.84 2np0 h LYS 743 CO -0.07 0.45 0.64 0.93 -2.27 0.00 0.00 179.45 179.12 2np0 h GLU 744 N -0.63 0.47 0.00 1.90 5.08 -1.80 0.22 114.58 119.82 2np0 h GLU 744 Ca -0.01 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 2np0 h GLU 744 Cb 0.55 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 2np0 h GLU 744 CO 0.01 0.31 -0.10 0.87 -1.00 0.00 0.00 179.01 179.10 2np0 h LYS 745 N 0.49 0.00 0.02 2.33 1.57 -1.04 -2.93 116.57 117.00 2np0 h LYS 745 Ca 0.62 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 59.19 2np0 h LYS 745 Cb 1.38 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.67 2np0 h LYS 745 CO -0.39 0.10 -0.97 0.66 -0.57 0.00 0.00 179.45 178.28 2np0 h SER 746 N 0.00 0.12 -0.87 0.86 4.64 -0.81 -3.23 113.55 114.26 2np0 h SER 746 Ca -0.00 -0.11 -0.56 0.00 -0.47 0.00 0.00 61.79 60.65 2np0 h SER 746 Cb 0.62 -0.04 -0.26 0.00 -0.31 0.00 0.00 62.40 62.42 2np0 h SER 746 CO 0.01 1.02 0.72 0.59 -0.87 0.00 0.00 176.83 178.30 2np0 n ASN 747 N -3.49 6.50 -3.64 4.97 3.02 -1.11 -4.76 115.26 116.75 2np0 n ASN 747 Ca -0.02 -3.56 -0.25 0.00 -0.03 0.00 0.00 54.58 50.72 2np0 n ASN 747 Cb 0.89 -0.95 -0.17 0.00 -0.61 0.00 0.00 39.78 38.94 2np0 n ASN 747 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2np0 s ILE 748 N -3.88 -0.02 -0.53 2.41 1.01 -1.21 -4.98 121.20 114.01 2np0 s ILE 748 Ca 0.55 -0.06 -0.20 0.00 0.00 0.00 0.00 60.65 60.94 2np0 s ILE 748 Cb 0.44 -0.52 0.06 0.00 0.01 0.00 0.00 42.46 42.45 2np0 s ILE 748 CO 0.02 -0.15 0.69 0.21 0.00 0.00 0.00 174.94 175.70 2np0 s ASN 749 N 2.11 6.23 -0.03 3.58 2.47 -1.26 -4.95 114.94 123.10 2np0 s ASN 749 Ca 0.02 -0.90 -0.01 0.00 0.42 0.00 0.00 52.86 52.39 2np0 s ASN 749 Cb -0.15 -2.31 0.02 0.00 -1.45 0.00 0.00 41.25 37.35 2np0 s ASN 749 CO -0.07 -0.98 0.06 -0.63 -3.72 0.00 0.00 177.10 171.76 2np0 s ILE 750 N 2.85 -0.03 -0.20 -5.21 -1.09 -1.26 -4.97 121.20 111.30 2np0 s ILE 750 Ca 0.17 0.10 0.01 0.00 -2.23 0.00 0.00 60.65 58.70 2np0 s ILE 750 Cb -0.19 -0.11 0.04 0.00 -1.58 0.00 0.00 42.46 40.62 2np0 s ILE 750 CO 0.12 0.04 -0.13 -0.62 -1.23 0.00 0.00 174.94 173.12 2np0 s ASP 751 N 0.54 3.43 0.34 3.58 -1.08 -1.26 -5.00 116.67 117.22 2np0 s ASP 751 Ca -0.04 -0.88 0.18 0.00 -0.52 0.00 0.00 52.55 51.29 2np0 s ASP 751 Cb -0.06 -1.32 0.21 0.00 -1.46 0.00 0.00 42.92 40.28 2np0 s ASP 751 CO -0.02 -0.11 1.52 -0.26 0.52 0.00 0.00 175.17 176.82 2np0 h PHE 752 N 7.94 0.00 0.06 -5.34 -1.00 -2.00 -1.71 116.94 114.90 2np0 h PHE 752 Ca -0.31 0.00 -0.25 0.00 2.81 0.00 0.00 57.97 60.22 2np0 h PHE 752 Cb 1.10 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.67 2np0 h PHE 752 CO 0.52 0.32 -1.08 -0.91 -1.61 0.00 0.00 178.31 175.54 2np0 h ASN 753 N 0.00 0.56 -0.00 2.17 4.21 -1.98 -1.98 115.58 118.55 2np0 h ASN 753 Ca -0.00 -0.50 -0.00 0.00 1.21 0.00 0.00 56.30 57.01 2np0 h ASN 753 Cb 1.22 -0.17 -0.00 0.00 -1.12 0.00 0.00 38.32 38.25 2np0 h ASN 753 CO 0.04 1.33 -0.00 -0.78 -1.29 0.00 0.00 177.43 176.73 2np0 h ASP 754 N 0.19 0.01 -0.53 5.81 -0.00 -1.98 -0.93 116.42 118.98 2np0 h ASP 754 Ca -0.11 -0.36 0.11 0.00 -0.00 0.00 0.00 57.03 56.67 2np0 h ASP 754 Cb 1.75 -0.00 -0.09 0.00 -0.00 0.00 0.00 39.33 40.99 2np0 h ASP 754 CO 0.19 0.36 -0.04 0.40 -0.00 0.00 0.00 179.24 180.15 2np0 h ILE 755 N -0.35 0.54 -0.84 2.25 2.04 -1.41 -0.44 117.51 119.30 2np0 h ILE 755 Ca 0.00 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 2np0 h ILE 755 Cb 0.36 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 2np0 h ILE 755 CO 0.00 0.01 0.51 -1.13 0.00 0.00 0.00 178.15 177.54 2np0 h ASN 756 N 0.07 1.00 0.98 1.72 -0.73 -1.20 -1.98 115.58 115.45 2np0 h ASN 756 Ca 0.27 -0.05 -0.20 0.00 1.87 0.00 0.00 56.30 58.19 2np0 h ASN 756 Cb 0.42 -0.25 -0.03 0.00 0.27 0.00 0.00 38.32 38.72 2np0 h ASN 756 CO -0.48 0.76 -1.07 0.77 -0.37 0.00 0.00 177.43 177.04 2np0 h SER 757 N 1.15 0.00 -0.08 1.15 4.64 -0.63 -1.23 113.55 118.54 2np0 h SER 757 Ca 0.30 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.62 2np0 h SER 757 Cb -0.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2np0 h SER 757 CO -0.06 0.83 0.05 0.50 -0.87 0.00 0.00 176.83 177.28 2np0 h LYS 758 N 0.00 0.11 -0.30 4.77 3.64 -0.84 -1.33 116.57 122.63 2np0 h LYS 758 Ca -0.08 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 2np0 h LYS 758 Cb 1.70 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.48 2np0 h LYS 758 CO 0.09 0.11 0.09 -0.07 -2.27 0.00 0.00 179.45 177.41 2np0 h LEU 759 N 0.08 0.43 -1.64 5.20 3.38 -1.36 -2.21 115.31 119.20 2np0 h LEU 759 Ca 0.03 -0.20 0.10 0.00 0.09 0.00 0.00 57.88 57.90 2np0 h LEU 759 Cb 0.02 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2np0 h LEU 759 CO -0.01 0.52 0.40 -1.13 0.09 0.00 0.00 178.44 178.32 2np0 h ASN 760 N 0.32 0.37 0.23 -0.43 -0.73 -1.13 -0.80 115.58 113.41 2np0 h ASN 760 Ca 0.10 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.26 2np0 h ASN 760 Cb 0.24 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 38.76 2np0 h ASN 760 CO -0.00 0.22 -0.11 -0.08 -0.37 0.00 0.00 177.43 177.09 2np0 h GLU 761 N 0.41 -0.29 -0.56 6.67 4.81 -0.77 -2.93 114.58 121.92 2np0 h GLU 761 Ca 0.28 0.02 0.16 0.00 -0.13 0.00 0.00 59.36 59.69 2np0 h GLU 761 Cb 0.55 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 2np0 h GLU 761 CO -0.08 0.03 0.43 0.78 -0.73 0.00 0.00 179.01 179.44 2np0 h GLY 762 N -0.65 0.00 1.34 1.92 0.00 -0.69 0.95 103.07 105.94 2np0 h GLY 762 Ca -0.03 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.09 2np0 h GLY 762 CO 0.05 0.00 -0.74 -2.22 0.00 0.00 0.00 176.54 173.63 2np0 h ILE 763 N 0.00 1.31 -0.22 2.60 2.04 -1.15 -1.83 117.51 120.26 2np0 h ILE 763 Ca 0.27 -2.00 -0.16 0.00 1.00 0.00 0.00 64.86 63.96 2np0 h ILE 763 Cb 1.12 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 39.18 2np0 h ILE 763 CO -0.00 0.62 -0.52 0.78 0.00 0.00 0.00 178.15 179.03 2np0 h ASN 764 N 0.45 0.70 -0.22 1.72 2.35 -0.68 0.12 115.58 120.02 2np0 h ASN 764 Ca -0.04 -0.36 0.02 0.00 -0.55 0.00 0.00 56.30 55.37 2np0 h ASN 764 Cb 1.34 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.49 2np0 h ASN 764 CO 0.14 1.09 0.07 1.56 -1.65 0.00 0.00 177.43 178.65 2np0 h GLN 765 N 0.50 0.17 -0.73 0.81 4.20 -1.24 -1.47 115.11 117.35 2np0 h GLN 765 Ca 0.02 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 2np0 h GLN 765 Cb 1.07 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.78 2np0 h GLN 765 CO 0.10 0.11 0.35 0.00 -0.67 0.00 0.00 178.83 178.73 2np0 h ALA 766 N 1.14 0.94 -0.22 3.87 0.00 -0.80 -2.82 119.26 121.38 2np0 h ALA 766 Ca 0.10 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2np0 h ALA 766 Cb 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2np0 h ALA 766 CO -0.10 0.50 -0.29 0.82 0.00 0.00 0.00 179.25 180.18 2np0 h ILE 767 N 1.02 1.27 -0.60 0.00 1.08 -0.66 0.12 117.51 119.74 2np0 h ILE 767 Ca 0.25 -1.31 0.07 0.00 -0.39 0.00 0.00 64.86 63.48 2np0 h ILE 767 Cb 0.12 1.42 -0.06 0.00 -3.07 0.00 0.00 36.82 35.23 2np0 h ILE 767 CO -0.03 0.41 0.29 0.44 -0.69 0.00 0.00 178.15 178.56 2np0 h ASP 768 N 0.37 0.38 -0.18 1.72 3.32 -1.06 0.46 116.42 121.43 2np0 h ASP 768 Ca 0.05 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 2np0 h ASP 768 Cb 0.69 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.22 2np0 h ASP 768 CO 0.05 0.25 -0.08 0.78 -1.72 0.00 0.00 179.24 178.52 2np0 h ASN 769 N 0.53 0.39 -0.75 6.45 2.35 -1.16 -2.05 115.58 121.34 2np0 h ASN 769 Ca 0.28 -0.40 0.06 0.00 -0.55 0.00 0.00 56.30 55.69 2np0 h ASN 769 Cb 0.24 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.45 2np0 h ASN 769 CO -0.22 0.71 0.44 0.40 -1.65 0.00 0.00 177.43 177.11 2np0 h ILE 770 N 0.07 0.99 -0.13 2.81 2.04 -0.56 -0.45 117.51 122.28 2np0 h ILE 770 Ca 0.04 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2np0 h ILE 770 Cb 0.56 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 2np0 h ILE 770 CO 0.03 0.15 0.08 0.78 0.00 0.00 0.00 178.15 179.18 2np0 h ASN 771 N 0.80 0.15 -0.83 1.72 2.35 0.12 -1.02 115.58 118.86 2np0 h ASN 771 Ca 0.33 -0.03 0.03 0.00 -0.55 0.00 0.00 56.30 56.09 2np0 h ASN 771 Cb 0.19 -0.04 -0.05 0.00 0.05 0.00 0.00 38.32 38.47 2np0 h ASN 771 CO -0.18 0.13 0.53 0.78 -1.65 0.00 0.00 177.43 177.05 2np0 h ASN 772 N 0.16 0.88 0.24 5.81 2.35 -0.88 0.26 115.58 124.39 2np0 h ASN 772 Ca 0.05 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2np0 h ASN 772 Cb 0.01 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.18 2np0 h ASN 772 CO -0.01 0.61 -0.11 0.15 -1.65 0.00 0.00 177.43 176.41 2np0 h PHE 773 N 1.04 -0.29 -0.47 1.19 3.57 -0.81 -1.43 116.94 119.73 2np0 h PHE 773 Ca 0.33 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 2np0 h PHE 773 Cb 0.02 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 2np0 h PHE 773 CO -0.02 0.03 0.20 0.82 -2.23 0.00 0.00 178.31 177.10 2np0 h ILE 774 N -0.63 1.20 -0.78 1.41 1.08 -1.11 0.25 117.51 118.92 2np0 h ILE 774 Ca -0.03 -0.61 0.07 0.00 -0.39 0.00 0.00 64.86 63.90 2np0 h ILE 774 Cb 0.45 0.72 -0.06 0.00 -3.07 0.00 0.00 36.82 34.86 2np0 h ILE 774 CO 0.05 0.23 0.46 0.78 -0.69 0.00 0.00 178.15 178.98 2np0 h ASN 775 N 0.62 0.69 -0.66 1.72 2.35 -0.98 0.12 115.58 119.44 2np0 h ASN 775 Ca 0.16 0.03 -0.08 0.00 -0.55 0.00 0.00 56.30 55.86 2np0 h ASN 775 Cb 0.17 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 2np0 h ASN 775 CO -0.02 0.43 0.10 1.23 -1.65 0.00 0.00 177.43 177.53 2np0 h GLY 776 N 0.82 1.19 1.01 2.83 0.00 -0.55 -1.97 103.07 106.40 2np0 h GLY 776 Ca 0.36 -0.79 -0.00 0.00 0.00 0.00 0.00 47.33 46.89 2np0 h GLY 776 CO -0.20 0.74 0.45 0.00 0.00 0.00 0.00 176.54 177.53 2np0 h SER 778 N 1.00 0.34 -0.79 0.00 0.87 -0.41 -1.16 113.55 113.40 2np0 h SER 778 Ca 0.26 -0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.62 2np0 h SER 778 Cb -0.05 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 61.79 2np0 h SER 778 CO -0.05 0.40 0.30 0.58 -0.53 0.00 0.00 176.83 177.52 2np0 h VAL 779 N 0.26 1.26 -0.49 2.23 2.07 -1.26 -2.22 116.25 118.11 2np0 h VAL 779 Ca 0.08 -0.85 0.05 0.00 0.82 0.00 0.00 66.70 66.80 2np0 h VAL 779 Cb 0.16 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.22 2np0 h VAL 779 CO -0.01 0.35 0.22 -1.28 0.02 0.00 0.00 177.57 176.87 2np0 h SER 780 N 1.16 0.30 -0.41 0.57 0.87 -0.87 0.37 113.55 115.53 2np0 h SER 780 Ca 0.26 0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.85 2np0 h SER 780 Cb 0.24 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.17 2np0 h SER 780 CO -0.02 0.21 0.24 0.22 -0.53 0.00 0.00 176.83 176.95 2np0 h TYR 781 N 0.44 0.55 -0.29 2.24 3.20 -0.65 -0.72 116.97 121.75 2np0 h TYR 781 Ca 0.22 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.15 2np0 h TYR 781 Cb 0.16 -0.18 -0.07 0.00 1.54 0.00 0.00 36.73 38.18 2np0 h TYR 781 CO -0.12 0.40 -0.21 1.25 -1.64 0.00 0.00 178.16 177.84 2np0 h LEU 782 N 0.54 -0.68 -0.13 2.82 5.85 -0.85 0.17 115.31 123.02 2np0 h LEU 782 Ca 0.15 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 2np0 h LEU 782 Cb 0.02 0.34 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 2np0 h LEU 782 CO -0.03 -0.24 -0.05 0.24 -0.34 0.00 0.00 178.44 178.02 2np0 h MET 783 N -0.19 0.00 0.00 1.25 2.86 -0.52 0.90 114.93 119.23 2np0 h MET 783 Ca 0.15 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.62 2np0 h MET 783 Cb 0.42 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 2np0 h MET 783 CO -0.40 0.05 -1.67 1.63 1.06 0.00 0.00 176.91 177.58 2np0 n LYS 784 N -3.12 1.89 0.00 1.72 5.02 -0.31 -4.39 118.16 118.97 2np0 n LYS 784 Ca 0.03 0.01 0.05 0.00 -2.02 0.00 0.00 58.31 56.38 2np0 n LYS 784 Cb 0.53 -1.25 -0.05 0.00 -0.02 0.00 0.00 35.03 34.25 2np0 n LYS 784 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2np0 n LYS 785 N -2.48 3.66 0.01 1.97 4.76 0.56 -4.71 118.16 121.92 2np0 n LYS 785 Ca -0.17 -0.08 -0.00 0.00 -2.87 0.00 0.00 58.31 55.19 2np0 n LYS 785 Cb 0.79 -0.96 -0.00 0.00 -1.84 0.00 0.00 35.03 33.02 2np0 n LYS 785 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2np0 n MET 786 N -1.10 0.01 -0.12 1.97 2.81 -1.04 -4.76 117.12 114.90 2np0 n MET 786 Ca 0.02 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.85 2np0 n MET 786 Cb 0.15 -0.16 -0.00 0.00 -0.71 0.00 0.00 33.22 32.51 2np0 n MET 786 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 2np0 h ILE 787 N -0.02 0.32 -0.72 2.02 1.08 -1.07 -1.65 117.51 117.47 2np0 h ILE 787 Ca 0.00 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.61 2np0 h ILE 787 Cb 0.02 0.32 -0.05 0.00 -3.07 0.00 0.00 36.82 34.04 2np0 h ILE 787 CO 0.00 0.00 0.48 -0.65 -0.69 0.00 0.00 178.15 177.29 2np0 h PRO 788 N -0.19 0.41 0.00 2.37 0.11 -1.82 0.11 132.00 132.98 2np0 h PRO 788 Ca 0.19 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.21 2np0 h PRO 788 Cb 0.49 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 2np0 h PRO 788 CO -0.51 0.27 -0.29 -0.07 -0.21 0.00 0.00 178.00 177.19 2np0 h LEU 789 N 0.42 0.00 -0.08 2.35 3.38 -1.59 -1.45 115.31 118.33 2np0 h LEU 789 Ca 0.35 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.14 2np0 h LEU 789 Cb 0.77 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.53 2np0 h LEU 789 CO -0.11 0.29 -0.63 0.00 0.09 0.00 0.00 178.44 178.07 2np0 h ALA 790 N 1.71 0.19 -0.34 1.53 0.00 -0.79 -3.27 119.26 118.29 2np0 h ALA 790 Ca -0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.34 2np0 h ALA 790 Cb 0.55 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2np0 h ALA 790 CO 0.04 0.47 0.19 0.28 0.00 0.00 0.00 179.25 180.22 2np0 h VAL 791 N 0.19 1.11 -0.91 0.00 2.07 -0.86 -0.76 116.25 117.08 2np0 h VAL 791 Ca -0.06 -0.27 0.06 0.00 0.82 0.00 0.00 66.70 67.26 2np0 h VAL 791 Cb 1.29 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 31.65 2np0 h VAL 791 CO 0.13 0.12 0.57 -0.08 0.02 0.00 0.00 177.57 178.33 2np0 h GLU 792 N 0.46 1.02 0.01 1.57 4.81 -1.32 -1.33 114.58 119.79 2np0 h GLU 792 Ca 0.12 -0.06 -0.25 0.00 -0.13 0.00 0.00 59.36 59.04 2np0 h GLU 792 Cb 0.01 -0.23 -0.04 0.00 0.63 0.00 0.00 28.75 29.13 2np0 h GLU 792 CO -0.02 0.67 -1.29 0.87 -0.73 0.00 0.00 179.01 178.51 2np0 h LYS 793 N 1.05 0.02 -0.02 1.92 1.79 -1.37 -2.98 116.57 116.97 2np0 h LYS 793 Ca 0.39 -0.03 -0.07 0.00 -2.18 0.00 0.00 60.65 58.76 2np0 h LYS 793 Cb 0.16 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 2np0 h LYS 793 CO -0.17 0.82 -0.32 -0.07 -1.08 0.00 0.00 179.45 178.62 2np0 h LEU 794 N 0.00 0.04 -0.01 2.94 3.38 -0.92 -1.40 115.31 119.35 2np0 h LEU 794 Ca -0.13 -0.01 -0.23 0.00 0.09 0.00 0.00 57.88 57.60 2np0 h LEU 794 Cb 1.88 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 42.63 2np0 h LEU 794 CO 0.11 0.37 -0.89 -0.07 0.09 0.00 0.00 178.44 178.05 2np0 h LEU 795 N 0.04 0.80 -0.55 1.67 3.38 -1.24 -0.17 115.31 119.24 2np0 h LEU 795 Ca 0.00 -0.74 0.11 0.00 0.09 0.00 0.00 57.88 57.34 2np0 h LEU 795 Cb 0.60 -0.24 -0.09 0.00 0.09 0.00 0.00 40.66 41.01 2np0 h LEU 795 CO 0.04 1.43 0.02 0.44 0.09 0.00 0.00 178.44 180.47 2np0 h ASP 796 N 0.25 -0.19 0.16 -0.43 3.45 -1.39 0.50 116.42 118.76 2np0 h ASP 796 Ca -0.11 0.13 -0.00 0.00 0.43 0.00 0.00 57.03 57.47 2np0 h ASP 796 Cb 1.56 0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 40.55 2np0 h ASP 796 CO 0.18 -0.07 -0.09 0.15 -1.57 0.00 0.00 179.24 177.83 2np0 h PHE 797 N 0.14 -0.24 -0.92 4.55 3.57 -1.09 -0.43 116.94 122.52 2np0 h PHE 797 Ca 0.28 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.87 2np0 h PHE 797 Cb 0.44 0.09 -0.07 0.00 2.79 0.00 0.00 35.95 39.19 2np0 h PHE 797 CO -0.32 -0.15 0.57 -0.44 -2.23 0.00 0.00 178.31 175.74 2np0 h ASP 798 N -0.24 0.85 0.31 0.41 5.19 -0.60 0.18 116.42 122.51 2np0 h ASP 798 Ca -0.02 0.03 -0.15 0.00 -0.62 0.00 0.00 57.03 56.28 2np0 h ASP 798 Cb 0.20 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.56 2np0 h ASP 798 CO 0.02 0.50 -0.60 0.78 -3.12 0.00 0.00 179.24 176.82 2np0 h ASN 799 N 0.96 0.33 -0.33 6.45 2.35 -0.49 0.50 115.58 125.35 2np0 h ASN 799 Ca 0.43 -0.19 -0.08 0.00 -0.55 0.00 0.00 56.30 55.91 2np0 h ASN 799 Cb 0.32 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 2np0 h ASN 799 CO -0.22 0.85 -0.13 0.74 -1.65 0.00 0.00 177.43 177.02 2np0 h THR 800 N 0.22 1.29 -0.36 2.81 2.02 -0.20 -2.90 112.91 115.77 2np0 h THR 800 Ca -0.01 -1.21 -0.03 0.00 0.77 0.00 0.00 66.41 65.93 2np0 h THR 800 Cb 1.11 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.88 2np0 h THR 800 CO 0.10 0.39 0.08 0.25 0.37 0.00 0.00 175.52 176.71 2np0 h LEU 801 N 0.44 0.49 0.86 2.58 5.85 -0.48 -1.65 115.31 123.40 2np0 h LEU 801 Ca 0.08 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 2np0 h LEU 801 Cb 0.64 -0.13 0.01 0.00 0.37 0.00 0.00 40.66 41.56 2np0 h LEU 801 CO 0.04 0.50 -0.42 0.50 -0.34 0.00 0.00 178.44 178.73 2np0 h LYS 802 N 0.52 -1.12 -0.78 1.25 3.64 -0.81 0.14 116.57 119.41 2np0 h LYS 802 Ca 0.12 0.08 0.18 0.00 -1.27 0.00 0.00 60.65 59.76 2np0 h LYS 802 Cb 0.22 0.25 -0.13 0.00 -0.41 0.00 0.00 32.23 32.16 2np0 h LYS 802 CO -0.00 -0.74 0.03 -0.22 -2.27 0.00 0.00 179.45 176.24 2np0 h LYS 803 N -1.19 0.11 0.28 1.90 1.63 -1.49 -0.72 116.57 117.09 2np0 h LYS 803 Ca -0.12 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.66 2np0 h LYS 803 Cb 0.89 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.50 2np0 h LYS 803 CO 0.19 0.07 -0.14 -0.97 -3.45 0.00 0.00 179.45 175.16 2np0 h ASN 804 N 0.11 -0.32 -0.33 4.20 -1.24 -0.82 -0.34 115.58 116.84 2np0 h ASN 804 Ca 0.43 -0.10 -0.05 0.00 0.71 0.00 0.00 56.30 57.29 2np0 h ASN 804 Cb 0.78 0.08 -0.02 0.00 0.73 0.00 0.00 38.32 39.89 2np0 h ASN 804 CO -0.68 -0.09 0.06 -0.07 -1.29 0.00 0.00 177.43 175.36 2np0 h LEU 805 N -0.54 0.59 -0.18 0.34 3.38 -0.52 -1.90 115.31 116.49 2np0 h LEU 805 Ca -0.04 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 2np0 h LEU 805 Cb 0.40 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2np0 h LEU 805 CO 0.06 0.62 -0.21 -0.07 0.09 0.00 0.00 178.44 178.94 2np0 h LEU 806 N 0.61 0.49 -1.27 1.67 3.38 -0.99 -0.14 115.31 119.06 2np0 h LEU 806 Ca 0.14 -0.50 0.06 0.00 0.09 0.00 0.00 57.88 57.67 2np0 h LEU 806 Cb 0.30 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 2np0 h LEU 806 CO 0.00 0.89 0.53 -1.13 0.09 0.00 0.00 178.44 178.82 2np0 h ASN 807 N 0.10 0.78 -0.24 -0.43 -0.73 -0.97 -1.83 115.58 112.27 2np0 h ASN 807 Ca 0.02 0.00 -0.10 0.00 1.87 0.00 0.00 56.30 58.10 2np0 h ASN 807 Cb 0.76 -0.17 -0.00 0.00 0.27 0.00 0.00 38.32 39.18 2np0 h ASN 807 CO 0.05 0.51 -0.23 0.22 -0.37 0.00 0.00 177.43 177.61 2np0 h TYR 808 N 0.89 0.69 -0.93 0.67 3.20 -0.99 -0.90 116.97 119.60 2np0 h TYR 808 Ca 0.34 -0.21 0.04 0.00 3.14 0.00 0.00 58.73 62.05 2np0 h TYR 808 Cb 0.20 -0.15 -0.06 0.00 1.54 0.00 0.00 36.73 38.27 2np0 h TYR 808 CO -0.00 0.90 0.60 0.82 -1.64 0.00 0.00 178.16 178.85 2np0 h ILE 809 N 0.28 1.14 -0.14 1.81 2.04 -0.84 -2.23 117.51 119.57 2np0 h ILE 809 Ca 0.04 -0.40 -0.15 0.00 1.00 0.00 0.00 64.86 65.35 2np0 h ILE 809 Cb 0.79 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2np0 h ILE 809 CO 0.06 0.21 -0.54 -0.78 0.00 0.00 0.00 178.15 177.10 2np0 h ASP 810 N 1.16 0.44 0.65 1.72 3.58 -1.12 -1.96 116.42 120.89 2np0 h ASP 810 Ca 0.38 -0.23 -0.09 0.00 0.42 0.00 0.00 57.03 57.51 2np0 h ASP 810 Cb 0.04 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 40.95 2np0 h ASP 810 CO -0.13 0.90 -0.41 -0.33 -2.88 0.00 0.00 179.24 176.39 2np0 h GLU 811 N 0.31 0.00 -0.35 0.28 5.08 -0.86 -3.21 114.58 115.82 2np0 h GLU 811 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2np0 h GLU 811 Cb 1.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2np0 h GLU 811 CO 0.09 0.41 0.00 0.09 -1.00 0.00 0.00 179.01 178.60 2np0 n ASN 812 N -3.73 3.85 0.00 1.42 3.02 -0.87 -4.66 115.26 114.30 2np0 n ASN 812 Ca -0.01 -2.66 0.15 0.00 -0.03 0.00 0.00 54.58 52.03 2np0 n ASN 812 Cb 0.49 -0.47 0.60 0.00 -0.61 0.00 0.00 39.78 39.79 2np0 n ASN 812 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 2np0 h LYS 813 N 2.29 0.17 -0.54 3.52 2.10 -1.36 -1.03 116.57 121.71 2np0 h LYS 813 Ca 0.00 -0.01 0.06 0.00 -2.00 0.00 0.00 60.65 58.70 2np0 h LYS 813 Cb 1.28 -0.04 -0.05 0.00 -0.90 0.00 0.00 32.23 32.52 2np0 h LYS 813 CO 0.18 0.11 0.24 -0.07 -2.00 0.00 0.00 179.45 177.92 2np0 h LEU 814 N 0.18 0.31 -0.15 7.07 -0.00 -1.86 -2.34 115.31 118.51 2np0 h LEU 814 Ca 0.23 0.05 0.00 0.00 -0.00 0.00 0.00 57.88 58.15 2np0 h LEU 814 Cb 0.67 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.33 2np0 h LEU 814 CO -0.04 0.21 -0.10 -1.22 -0.00 0.00 0.00 178.44 177.29 2np0 n TYR 815 N -4.93 0.00 -2.27 1.13 4.02 -0.42 -3.97 117.16 110.72 2np0 n TYR 815 Ca 0.06 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.55 2np0 n TYR 815 Cb 0.18 -0.23 0.03 0.00 -0.02 0.00 0.00 39.34 39.30 2np0 n TYR 815 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2np0 n LEU 816 N -1.10 7.38 -0.33 7.72 4.77 -0.88 -4.61 117.00 129.95 2np0 n LEU 816 Ca 0.13 -5.11 0.05 0.00 -0.03 0.00 0.00 56.01 51.05 2np0 n LEU 816 Cb 0.28 -1.10 0.12 0.00 -2.33 0.00 0.00 43.42 40.39 2np0 n LEU 816 CO 0.25 1.91 0.59 -0.38 -1.33 0.00 0.00 177.39 178.43 2np0 n ILE 817 N -0.32 -0.39 -2.35 -0.08 -0.00 -1.26 -0.95 119.36 114.02 2np0 n ILE 817 Ca 0.50 2.09 0.02 0.00 -0.00 0.00 0.00 62.75 65.37 2np0 n ILE 817 Cb 0.25 -2.88 0.06 0.00 -0.00 0.00 0.00 39.64 37.08 2np0 n ILE 817 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2np0 n GLY 818 N -1.56 2.21 0.00 7.39 0.00 -1.26 -4.86 105.19 107.12 2np0 n GLY 818 Ca 0.14 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 45.10 2np0 n GLY 818 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2np0 n SER 819 N -0.05 0.28 -0.29 1.61 7.64 -0.12 -4.86 113.62 117.83 2np0 n SER 819 Ca 0.11 -0.61 0.02 0.00 1.01 0.00 0.00 58.87 59.40 2np0 n SER 819 Cb 1.00 0.46 0.16 0.00 -1.01 0.00 0.00 64.21 64.82 2np0 n SER 819 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2np0 h ALA 820 N 0.00 1.16 0.00 -0.43 0.00 -1.86 -1.33 119.26 116.80 2np0 h ALA 820 Ca 0.00 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2np0 h ALA 820 Cb 0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2np0 h ALA 820 CO 0.00 0.15 -0.30 0.93 0.00 0.00 0.00 179.25 180.03 2np0 h GLU 821 N 0.84 0.00 -0.55 0.00 3.07 -1.91 0.25 114.58 116.28 2np0 h GLU 821 Ca 0.39 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 59.17 2np0 h GLU 821 Cb 0.30 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 2np0 h GLU 821 CO -0.22 0.30 0.04 -0.92 -1.40 0.00 0.00 179.01 176.81 2np0 h TYR 822 N 0.00 1.01 -0.01 4.33 3.20 -1.69 -2.79 116.97 121.02 2np0 h TYR 822 Ca -0.00 -0.16 -0.26 0.00 3.14 0.00 0.00 58.73 61.45 2np0 h TYR 822 Cb 1.20 -0.27 0.02 0.00 1.54 0.00 0.00 36.73 39.22 2np0 h TYR 822 CO 0.00 0.91 -1.02 0.93 -1.64 0.00 0.00 178.16 177.34 2np0 h GLU 823 N 0.83 0.71 -0.80 1.82 4.39 -1.02 -0.75 114.58 119.75 2np0 h GLU 823 Ca 0.16 -0.75 0.11 0.00 0.34 0.00 0.00 59.36 59.22 2np0 h GLU 823 Cb 0.48 0.21 -0.08 0.00 -0.10 0.00 0.00 28.75 29.26 2np0 h GLU 823 CO 0.02 1.32 0.43 -0.22 -1.16 0.00 0.00 179.01 179.40 2np0 h LYS 824 N 0.39 0.68 0.00 2.33 1.63 -1.04 -0.62 116.57 119.95 2np0 h LYS 824 Ca -0.13 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.63 2np0 h LYS 824 Cb 1.67 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 33.15 2np0 h LYS 824 CO 0.20 0.45 -0.20 0.66 -3.45 0.00 0.00 179.45 177.11 2np0 h SER 825 N 0.71 0.00 0.06 4.20 4.64 -1.44 -0.64 113.55 121.07 2np0 h SER 825 Ca 0.40 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.70 2np0 h SER 825 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2np0 h SER 825 CO -0.28 0.01 -0.03 0.50 -0.87 0.00 0.00 176.83 176.17 2np0 h LYS 826 N 0.00 -0.07 0.09 4.77 3.64 -0.50 -2.63 116.57 121.87 2np0 h LYS 826 Ca 0.00 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2np0 h LYS 826 Cb 0.91 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 2np0 h LYS 826 CO 0.00 0.29 -0.04 0.28 -2.27 0.00 0.00 179.45 177.70 2np0 h VAL 827 N -0.45 1.08 -0.85 2.00 2.07 -1.12 -1.23 116.25 117.76 2np0 h VAL 827 Ca -0.01 -0.65 0.02 0.00 0.82 0.00 0.00 66.70 66.88 2np0 h VAL 827 Cb 0.40 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 2np0 h VAL 827 CO 0.01 0.16 0.56 0.78 0.02 0.00 0.00 177.57 179.10 2np0 h ASN 828 N -0.42 0.95 -0.26 0.57 2.35 -1.23 -1.39 115.58 116.15 2np0 h ASN 828 Ca -0.01 -0.02 -0.12 0.00 -0.55 0.00 0.00 56.30 55.60 2np0 h ASN 828 Cb 0.35 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.49 2np0 h ASN 828 CO 0.02 0.68 -0.29 0.50 -1.65 0.00 0.00 177.43 176.69 2np0 h LYS 829 N 1.12 0.66 -0.61 0.81 3.64 -1.45 -2.37 116.57 118.36 2np0 h LYS 829 Ca 0.32 -0.36 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 2np0 h LYS 829 Cb -0.09 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 2np0 h LYS 829 CO -0.08 0.97 0.22 -0.92 -2.27 0.00 0.00 179.45 177.37 2np0 h TYR 830 N 0.38 0.95 -0.27 1.91 3.20 -1.00 -3.09 116.97 119.05 2np0 h TYR 830 Ca 0.04 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.83 2np0 h TYR 830 Cb 0.86 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.85 2np0 h TYR 830 CO 0.08 0.77 0.00 1.28 -1.64 0.00 0.00 178.16 178.64 2np0 n LEU 831 N -4.43 2.35 0.21 2.82 4.77 -0.54 -3.91 117.00 118.27 2np0 n LEU 831 Ca 0.04 -1.01 0.10 0.00 -0.03 0.00 0.00 56.01 55.10 2np0 n LEU 831 Cb 0.18 -0.17 0.26 0.00 -2.33 0.00 0.00 43.42 41.36 2np0 n LEU 831 CO 0.39 0.51 0.75 0.50 -1.33 0.00 0.00 177.39 178.21 2np0 h LYS 832 N 3.03 0.00 -5.51 3.23 1.63 -1.33 -3.46 116.57 114.17 2np0 h LYS 832 Ca 0.00 0.00 -0.61 0.00 -0.85 0.00 0.00 60.65 59.19 2np0 h LYS 832 Cb 0.67 0.00 -0.32 0.00 -0.60 0.00 0.00 32.23 31.98 2np0 h LYS 832 CO 0.00 0.17 -0.85 0.95 -3.45 0.00 0.00 179.45 176.27 2np0 s THR 833 N -3.29 1.66 0.71 1.00 -4.23 -1.25 -4.95 115.64 105.29 2np0 s THR 833 Ca 0.04 -0.84 -0.15 0.00 -1.18 0.00 0.00 61.69 59.56 2np0 s THR 833 Cb 0.07 -1.42 0.03 0.00 1.34 0.00 0.00 72.50 72.52 2np0 s THR 833 CO 0.67 0.47 1.17 0.27 -0.54 0.00 0.00 174.62 176.65 2np0 s ILE 834 N 0.02 2.66 -0.11 2.99 -5.25 -1.26 -4.97 121.20 115.27 2np0 s ILE 834 Ca -0.05 0.31 -0.28 0.00 -0.99 0.00 0.00 60.65 59.64 2np0 s ILE 834 Cb -0.13 -2.84 -0.02 0.00 2.95 0.00 0.00 42.46 42.43 2np0 s ILE 834 CO 0.03 -0.18 0.93 -0.32 -1.79 0.00 0.00 174.94 173.61 2np0 s MET 835 N -4.02 4.40 0.52 0.37 -2.45 -1.26 -5.02 119.30 111.84 2np0 s MET 835 Ca 0.71 1.25 -0.18 0.00 -1.25 0.00 0.00 55.69 56.22 2np0 s MET 835 Cb -0.25 -3.54 -0.07 0.00 1.25 0.00 0.00 34.83 32.21 2np0 s MET 835 CO 0.44 -0.28 1.02 -1.25 1.05 0.00 0.00 175.02 176.01 2np0 s PRO 836 N 1.90 3.76 -0.28 4.11 0.04 -1.26 -4.96 135.00 138.31 2np0 s PRO 836 Ca 0.45 1.19 -0.21 0.00 0.04 0.00 0.00 61.00 62.47 2np0 s PRO 836 Cb -0.18 -2.10 -0.01 0.00 0.04 0.00 0.00 34.50 32.25 2np0 s PRO 836 CO 0.17 -0.45 0.65 0.12 0.04 0.00 0.00 177.00 177.53 2np0 s PHE 837 N -2.29 3.24 -0.25 0.56 5.36 -1.26 -5.04 117.98 118.31 2np0 s PHE 837 Ca 0.64 0.71 0.00 0.00 -0.96 0.00 0.00 56.93 57.32 2np0 s PHE 837 Cb -0.14 -2.95 0.04 0.00 -0.34 0.00 0.00 43.02 39.63 2np0 s PHE 837 CO 0.26 -0.42 -0.09 0.34 -1.46 0.00 0.00 175.22 173.85 2np0 s ASP 838 N 1.56 4.27 0.51 6.13 -1.08 -1.26 -5.02 116.67 121.78 2np0 s ASP 838 Ca 0.27 -1.09 0.23 0.00 -0.52 0.00 0.00 52.55 51.43 2np0 s ASP 838 Cb -0.15 -1.60 1.32 0.00 -1.46 0.00 0.00 42.92 41.03 2np0 s ASP 838 CO 0.10 -0.15 1.98 0.25 0.52 0.00 0.00 175.17 177.87 2np0 h LEU 839 N 7.91 0.09 -1.36 -1.34 5.85 -1.97 -2.45 115.31 122.04 2np0 h LEU 839 Ca -0.28 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.45 2np0 h LEU 839 Cb 1.08 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.10 2np0 h LEU 839 CO 0.54 0.05 0.00 0.77 -0.34 0.00 0.00 178.44 179.45 2np0 h SER 840 N 0.10 0.00 0.37 1.25 4.64 -1.96 -0.92 113.55 117.03 2np0 h SER 840 Ca 0.28 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.53 2np0 h SER 840 Cb 0.98 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.06 2np0 h SER 840 CO -0.03 0.00 -0.34 0.40 -0.87 0.00 0.00 176.83 175.99 2np0 h ILE 841 N 0.00 1.21 -0.02 0.95 2.04 -1.88 -3.29 117.51 116.52 2np0 h ILE 841 Ca 0.00 -1.19 0.00 0.00 1.00 0.00 0.00 64.86 64.67 2np0 h ILE 841 Cb 0.31 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 2np0 h ILE 841 CO 0.00 0.34 -0.06 -1.22 0.00 0.00 0.00 178.15 177.21 2np0 n TYR 842 N -4.08 0.00 -3.46 1.37 4.01 -0.36 -4.95 117.16 109.69 2np0 n TYR 842 Ca -0.02 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.60 2np0 n TYR 842 Cb 0.39 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.39 2np0 n TYR 842 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2np0 s THR 843 N -1.64 0.00 -0.09 -0.72 -1.32 -1.16 -4.52 115.64 106.18 2np0 s THR 843 Ca 0.21 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 60.82 2np0 s THR 843 Cb 0.15 -1.00 0.28 0.00 -1.51 0.00 0.00 72.50 70.42 2np0 s THR 843 CO 0.27 0.00 1.13 -0.46 -2.21 0.00 0.00 174.62 173.35 2np0 n ASN 844 N -0.06 1.38 -4.66 8.08 0.23 -1.26 -4.49 115.26 114.47 2np0 n ASN 844 Ca -0.16 -2.83 -0.42 0.00 -0.53 0.00 0.00 54.58 50.64 2np0 n ASN 844 Cb 0.63 -0.38 -0.03 0.00 -2.08 0.00 0.00 39.78 37.92 2np0 n ASN 844 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2np0 s ASP 845 N -2.35 6.42 0.44 0.53 3.68 -1.26 -4.86 116.67 119.27 2np0 s ASP 845 Ca 0.26 2.63 0.24 0.00 2.13 0.00 0.00 52.55 57.81 2np0 s ASP 845 Cb 0.25 -2.53 0.88 0.00 -1.45 0.00 0.00 42.92 40.08 2np0 s ASP 845 CO -0.04 -1.08 1.81 0.71 0.13 0.00 0.00 175.17 176.70 2np0 h THR 846 N 5.69 0.48 0.04 1.71 1.35 -1.99 -2.33 112.91 117.86 2np0 h THR 846 Ca -0.49 -1.12 -0.00 0.00 -0.55 0.00 0.00 66.41 64.25 2np0 h THR 846 Cb 1.24 1.79 0.00 0.00 -1.73 0.00 0.00 68.15 69.45 2np0 h THR 846 CO 0.94 0.20 -0.02 0.40 -0.25 0.00 0.00 175.52 176.79 2np0 h ILE 847 N 0.00 0.99 -0.16 6.82 1.08 -2.00 -1.20 117.51 123.05 2np0 h ILE 847 Ca -0.00 -0.10 -0.02 0.00 -0.39 0.00 0.00 64.86 64.35 2np0 h ILE 847 Cb 0.78 1.06 -0.01 0.00 -3.07 0.00 0.00 36.82 35.58 2np0 h ILE 847 CO 0.03 0.03 0.03 -0.07 -0.69 0.00 0.00 178.15 177.47 2np0 h LEU 848 N -0.10 0.25 -0.82 1.44 3.38 -1.93 -0.67 115.31 116.85 2np0 h LEU 848 Ca -0.01 -0.25 0.07 0.00 0.09 0.00 0.00 57.88 57.79 2np0 h LEU 848 Cb 0.09 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 2np0 h LEU 848 CO 0.01 0.43 0.49 0.40 0.09 0.00 0.00 178.44 179.86 2np0 h ILE 849 N 0.06 0.98 -0.06 1.22 2.04 -1.37 -0.89 117.51 119.48 2np0 h ILE 849 Ca 0.05 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 2np0 h ILE 849 Cb 0.29 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.41 2np0 h ILE 849 CO 0.00 0.16 0.01 -0.33 0.00 0.00 0.00 178.15 177.99 2np0 h GLU 850 N 0.86 0.09 -0.85 2.37 5.08 -0.95 0.54 114.58 121.72 2np0 h GLU 850 Ca 0.37 -0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.86 2np0 h GLU 850 Cb 0.25 -0.01 -0.15 0.00 0.50 0.00 0.00 28.75 29.34 2np0 h GLU 850 CO -0.20 0.32 -0.30 0.52 -1.00 0.00 0.00 179.01 178.34 2np0 h MET 851 N -0.15 -0.04 -0.49 2.33 2.86 -0.53 0.32 114.93 119.23 2np0 h MET 851 Ca 0.02 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.55 2np0 h MET 851 Cb 0.27 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 2np0 h MET 851 CO 0.00 -0.02 -0.12 0.35 1.06 0.00 0.00 176.91 178.18 2np0 h PHE 852 N -0.04 1.02 -0.16 -0.22 3.57 -0.76 -2.33 116.94 118.01 2np0 h PHE 852 Ca 0.35 -0.20 -0.14 0.00 3.53 0.00 0.00 57.97 61.51 2np0 h PHE 852 Cb 0.61 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 2np0 h PHE 852 CO -0.74 0.97 -0.50 -0.91 -2.23 0.00 0.00 178.31 174.91 2np0 h ASN 853 N 0.81 0.48 -0.07 0.41 2.35 0.57 -2.39 115.58 117.74 2np0 h ASN 853 Ca 0.13 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2np0 h ASN 853 Cb 0.65 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.88 2np0 h ASN 853 CO 0.05 0.90 0.05 0.11 -1.65 0.00 0.00 177.43 176.88 2np0 h LYS 854 N 0.35 0.10 -0.38 0.81 1.57 -0.18 -2.56 116.57 116.27 2np0 h LYS 854 Ca 0.02 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.87 2np0 h LYS 854 Cb 1.00 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 33.22 2np0 h LYS 854 CO 0.09 0.07 -0.10 -0.92 -0.57 0.00 0.00 179.45 178.02 2np0 h TYR 855 N 0.10 -0.21 0.00 -1.35 3.20 -1.32 -2.47 116.97 114.92 2np0 h TYR 855 Ca 0.03 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2np0 h TYR 855 Cb -0.01 0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.41 2np0 h TYR 855 CO -0.07 -0.17 0.00 0.09 -1.64 0.00 0.00 178.16 176.37 2np0 n ASN 856 N -5.30 0.51 -0.58 -2.11 3.02 -0.91 -2.14 115.26 107.75 2np0 n ASN 856 Ca 0.02 0.59 0.05 0.00 -0.03 0.00 0.00 54.58 55.21 2np0 n ASN 856 Cb 0.21 -0.71 0.13 0.00 -0.61 0.00 0.00 39.78 38.80 2np0 n ASN 856 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2np0 n SER 857 N -2.02 2.76 -4.47 6.41 3.41 -0.97 -4.80 113.62 113.94 2np0 n SER 857 Ca 0.04 -1.93 -0.43 0.00 -0.26 0.00 0.00 58.87 56.28 2np0 n SER 857 Cb 0.29 -0.19 -0.05 0.00 -0.26 0.00 0.00 64.21 64.00 2np0 n SER 857 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2np0 s GLU 858 N -0.99 3.19 0.41 4.33 2.56 -0.91 -4.96 118.70 122.34 2np0 s GLU 858 Ca 0.21 -0.68 0.20 0.00 0.00 0.00 0.00 54.97 54.70 2np0 s GLU 858 Cb 0.11 -4.13 1.14 0.00 2.00 0.00 0.00 34.13 33.24 2np0 s GLU 858 CO 0.15 -1.51 1.79 0.97 -0.56 0.00 0.00 175.26 176.09 2np0 h ILE 859 N 5.96 0.55 0.00 -3.70 6.09 -1.87 0.84 117.51 125.38 2np0 h ILE 859 Ca -0.28 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 63.09 2np0 h ILE 859 Cb 1.08 0.15 0.00 0.00 0.47 0.00 0.00 36.82 38.52 2np0 h ILE 859 CO 1.08 0.07 0.00 -0.07 -3.07 0.00 0.00 178.15 176.16 2np0 h LEU 860 N 0.36 0.00 -0.02 2.19 3.38 -1.93 0.45 115.31 119.75 2np0 h LEU 860 Ca 0.57 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.54 2np0 h LEU 860 Cb 1.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.25 2np0 h LEU 860 CO -0.25 0.00 -0.04 0.59 0.09 0.00 0.00 178.44 178.84 2np0 n ASN 861 N -2.90 0.06 -0.34 -0.43 3.02 0.29 -3.06 115.26 111.91 2np0 n ASN 861 Ca -0.01 0.15 0.10 0.00 -0.03 0.00 0.00 54.58 54.79 2np0 n ASN 861 Cb 0.16 -0.35 0.43 0.00 -0.61 0.00 0.00 39.78 39.41 2np0 n ASN 861 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2np0 n ASN 862 N -1.38 1.01 -4.67 6.41 3.02 0.15 -4.86 115.26 114.92 2np0 n ASN 862 Ca 0.10 -1.62 -0.43 0.00 -0.03 0.00 0.00 54.58 52.61 2np0 n ASN 862 Cb 0.30 -0.07 -0.02 0.00 -0.61 0.00 0.00 39.78 39.38 2np0 n ASN 862 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2np0 s ILE 863 N -1.87 4.73 -0.56 2.41 1.01 -1.17 -0.54 121.20 125.22 2np0 s ILE 863 Ca 0.30 2.02 0.10 0.00 0.00 0.00 0.00 60.65 63.07 2np0 s ILE 863 Cb 0.15 -4.31 -0.10 0.00 0.01 0.00 0.00 42.46 38.22 2np0 s ILE 863 CO 0.24 -0.09 0.47 2.30 0.00 0.00 0.00 174.94 177.86 2np0 n ILE 864 N 4.94 0.00 -3.71 2.92 -5.35 0.61 -4.86 119.36 113.91 2np0 n ILE 864 Ca 0.10 -0.27 -0.11 0.00 -0.27 0.00 0.00 62.75 62.20 2np0 n ILE 864 Cb 0.47 1.02 -0.12 0.00 -1.74 0.00 0.00 39.64 39.27 2np0 n ILE 864 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2np0 s LEU 865 N -2.39 0.11 -0.36 7.28 2.96 -0.92 -4.78 118.68 120.57 2np0 s LEU 865 Ca 0.05 0.72 0.03 0.00 -0.22 0.00 0.00 54.13 54.71 2np0 s LEU 865 Cb 0.08 1.06 0.16 0.00 0.50 0.00 0.00 46.19 47.98 2np0 s LEU 865 CO 0.41 -0.18 0.38 0.21 -1.32 0.00 0.00 176.35 175.85 2np0 s ASN 866 N 1.40 1.05 -0.13 3.68 3.84 -1.26 -0.63 114.94 122.88 2np0 s ASN 866 Ca -0.09 -1.44 -0.26 0.00 0.21 0.00 0.00 52.86 51.29 2np0 s ASN 866 Cb -0.09 0.64 -0.02 0.00 -0.55 0.00 0.00 41.25 41.22 2np0 s ASN 866 CO -0.11 -0.27 0.83 -0.76 -2.79 0.00 0.00 177.10 174.00 2np0 s LEU 867 N 1.56 4.22 0.09 3.21 1.43 -0.93 -0.32 118.68 127.94 2np0 s LEU 867 Ca 0.16 1.24 -0.02 0.00 -1.03 0.00 0.00 54.13 54.48 2np0 s LEU 867 Cb -0.15 -3.25 -0.03 0.00 0.03 0.00 0.00 46.19 42.79 2np0 s LEU 867 CO -0.07 -0.33 0.04 -0.13 0.23 0.00 0.00 176.35 176.08 2np0 s ARG 868 N 1.78 0.77 -0.20 1.70 1.81 0.01 -4.23 118.95 120.59 2np0 s ARG 868 Ca 0.40 -1.27 -0.17 0.00 -1.72 0.00 0.00 55.73 52.97 2np0 s ARG 868 Cb -0.17 0.24 -0.04 0.00 -0.45 0.00 0.00 34.95 34.53 2np0 s ARG 868 CO 0.15 -0.19 0.46 -0.47 -0.68 0.00 0.00 175.30 174.56 2np0 s TYR 869 N -3.96 3.37 -0.32 -0.53 5.04 -1.26 -0.46 117.35 119.22 2np0 s TYR 869 Ca 0.13 0.69 0.12 0.00 -2.44 0.00 0.00 57.07 55.57 2np0 s TYR 869 Cb 0.07 -2.60 0.39 0.00 0.35 0.00 0.00 41.96 40.17 2np0 s TYR 869 CO -0.05 -0.06 1.49 1.63 -1.34 0.00 0.00 175.55 177.21 2np0 n LYS 870 N 4.63 1.29 0.00 4.97 5.02 -1.26 -4.98 118.16 127.84 2np0 n LYS 870 Ca -0.07 -1.17 0.00 0.00 -2.02 0.00 0.00 58.31 55.05 2np0 n LYS 870 Cb 0.51 0.39 0.00 0.00 -0.02 0.00 0.00 35.03 35.90 2np0 n LYS 870 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2np0 n ASP 871 N -1.44 0.00 -0.04 4.39 9.92 -1.26 -5.03 116.55 123.09 2np0 n ASP 871 Ca -0.16 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.10 2np0 n ASP 871 Cb 0.86 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.34 2np0 n ASP 871 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2np0 n ASN 872 N 0.00 -0.06 0.00 -2.24 4.13 -1.26 -4.98 115.26 110.85 2np0 n ASN 872 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 2np0 n ASN 872 Cb 0.00 -0.02 0.00 0.00 -1.54 0.00 0.00 39.78 38.22 2np0 n ASN 872 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2np0 n ASN 873 N -0.04 0.00 -4.64 6.41 3.02 -1.26 -5.10 115.26 113.64 2np0 n ASN 873 Ca 0.00 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.27 2np0 n ASN 873 Cb 0.02 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.10 2np0 n ASN 873 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2np0 s LEU 874 N 0.00 3.26 0.06 3.41 1.43 -1.26 -4.12 118.68 121.46 2np0 s LEU 874 Ca 0.00 -0.36 -0.03 0.00 -1.03 0.00 0.00 54.13 52.71 2np0 s LEU 874 Cb 0.00 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 2np0 s LEU 874 CO 0.00 0.13 0.03 0.27 0.23 0.00 0.00 176.35 177.01 2np0 s ILE 875 N -1.51 0.20 -0.38 -0.59 -4.36 0.39 -4.89 121.20 110.06 2np0 s ILE 875 Ca 0.25 -1.63 -0.20 0.00 -0.26 0.00 0.00 60.65 58.82 2np0 s ILE 875 Cb -0.10 -1.46 0.01 0.00 1.25 0.00 0.00 42.46 42.16 2np0 s ILE 875 CO 0.17 -0.90 0.62 -0.62 0.24 0.00 0.00 174.94 174.46 2np0 s ASP 876 N -2.89 6.38 0.00 4.36 2.15 -1.26 -0.81 116.67 124.60 2np0 s ASP 876 Ca 0.06 -0.03 0.27 0.00 0.43 0.00 0.00 52.55 53.27 2np0 s ASP 876 Cb 0.07 -2.32 1.07 0.00 -0.30 0.00 0.00 42.92 41.44 2np0 s ASP 876 CO -0.10 -0.64 1.75 0.18 -0.17 0.00 0.00 175.17 176.18 2np0 n LEU 877 N 6.09 1.37 -0.13 -1.34 4.77 0.57 -4.49 117.00 123.83 2np0 n LEU 877 Ca -0.02 -0.48 0.02 0.00 -0.03 0.00 0.00 56.01 55.50 2np0 n LEU 877 Cb 0.48 -0.02 0.31 0.00 -2.33 0.00 0.00 43.42 41.87 2np0 n LEU 877 CO 0.50 0.24 1.20 0.77 -1.33 0.00 0.00 177.39 178.77 2np0 h SER 878 N 2.06 0.71 0.00 -1.43 4.64 -1.91 -3.47 113.55 114.16 2np0 h SER 878 Ca 0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2np0 h SER 878 Cb 0.44 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2np0 h SER 878 CO 0.00 0.52 0.00 0.61 -0.87 0.00 0.00 176.83 177.09 2np0 n GLY 879 N -1.42 0.88 0.90 -0.77 0.00 -1.26 -4.91 105.19 98.61 2np0 n GLY 879 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.20 2np0 n GLY 879 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2np0 n TYR 880 N -0.82 0.14 -3.66 1.61 4.02 -1.26 -4.86 117.16 112.33 2np0 n TYR 880 Ca 0.00 -0.07 -0.24 0.00 -0.01 0.00 0.00 57.90 57.58 2np0 n TYR 880 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.39 2np0 n TYR 880 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2np0 n GLY 881 N 1.34 -0.50 3.78 2.72 0.00 -1.26 -4.74 105.19 106.53 2np0 n GLY 881 Ca 0.16 0.22 -0.41 0.00 0.00 0.00 0.00 46.02 46.00 2np0 n GLY 881 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2np0 s ALA 882 N -3.34 3.50 0.01 4.61 0.00 -1.26 -4.91 121.76 120.37 2np0 s ALA 882 Ca 0.51 1.55 -0.30 0.00 0.00 0.00 0.00 51.96 53.72 2np0 s ALA 882 Cb -0.23 -3.61 -0.03 0.00 0.00 0.00 0.00 23.12 19.25 2np0 s ALA 882 CO 0.76 -1.09 0.97 0.21 0.00 0.00 0.00 175.76 176.60 2np0 s LYS 883 N -2.18 4.58 -0.17 0.00 2.20 -1.11 -4.57 119.74 118.48 2np0 s LYS 883 Ca 0.55 1.41 0.00 0.00 -0.36 0.00 0.00 55.97 57.57 2np0 s LYS 883 Cb -0.46 -3.45 0.04 0.00 -1.51 0.00 0.00 37.83 32.45 2np0 s LYS 883 CO 0.62 -0.01 -0.10 0.08 -0.36 0.00 0.00 175.35 175.58 2np0 s VAL 884 N 0.87 1.44 -0.31 4.02 1.01 -1.26 -0.65 120.40 125.52 2np0 s VAL 884 Ca 0.51 -0.78 -0.03 0.00 0.00 0.00 0.00 61.98 61.68 2np0 s VAL 884 Cb -0.21 -1.50 0.04 0.00 0.00 0.00 0.00 36.38 34.71 2np0 s VAL 884 CO 0.28 0.24 0.03 -1.61 0.00 0.00 0.00 175.10 174.04 2np0 s GLU 885 N 1.50 2.53 -0.25 2.72 2.02 -0.35 -4.97 118.70 121.90 2np0 s GLU 885 Ca 0.01 -1.21 -0.14 0.00 0.02 0.00 0.00 54.97 53.65 2np0 s GLU 885 Cb -0.15 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 30.78 2np0 s GLU 885 CO -0.09 -0.62 0.30 0.08 0.02 0.00 0.00 175.26 174.96 2np0 s VAL 886 N 1.31 5.24 0.51 2.63 1.01 -1.26 -0.71 120.40 129.14 2np0 s VAL 886 Ca -0.04 0.45 -0.04 0.00 0.00 0.00 0.00 61.98 62.36 2np0 s VAL 886 Cb -0.19 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 2np0 s VAL 886 CO 0.00 0.24 0.80 -0.31 0.00 0.00 0.00 175.10 175.83 2np0 s TYR 887 N 1.59 3.35 0.63 5.22 1.51 -0.46 -4.98 117.35 124.22 2np0 s TYR 887 Ca 0.13 0.59 0.37 0.00 -1.01 0.00 0.00 57.07 57.15 2np0 s TYR 887 Cb -0.15 -2.47 2.12 0.00 -0.11 0.00 0.00 41.96 41.35 2np0 s TYR 887 CO 0.08 -0.51 2.30 -0.44 -1.11 0.00 0.00 175.55 175.87 2np0 h ASP 888 N 0.12 0.00 -0.02 2.29 3.32 -1.88 -2.02 116.42 118.24 2np0 h ASP 888 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 2np0 h ASP 888 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2np0 h ASP 888 CO 0.60 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.73 2np0 n GLY 889 N -1.20 -0.63 3.62 2.75 0.00 0.16 -4.77 105.19 105.12 2np0 n GLY 889 Ca -0.03 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.34 2np0 n GLY 889 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2np0 s VAL 890 N -1.98 5.23 -0.19 1.61 1.01 -0.76 -4.36 120.40 120.96 2np0 s VAL 890 Ca 0.41 0.45 -0.24 0.00 0.00 0.00 0.00 61.98 62.60 2np0 s VAL 890 Cb 0.20 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2np0 s VAL 890 CO 0.33 0.21 0.77 -0.70 0.00 0.00 0.00 175.10 175.72 2np0 s GLU 891 N 1.78 4.25 -0.10 2.72 2.12 -1.10 -4.92 118.70 123.46 2np0 s GLU 891 Ca 0.13 0.89 0.02 0.00 0.36 0.00 0.00 54.97 56.37 2np0 s GLU 891 Cb -0.15 -3.59 -0.01 0.00 0.26 0.00 0.00 34.13 30.64 2np0 s GLU 891 CO 0.09 -0.33 -0.17 -0.51 -0.54 0.00 0.00 175.26 173.80 2np0 s LEU 892 N 2.18 2.49 0.38 2.70 1.43 -1.26 -0.83 118.68 125.77 2np0 s LEU 892 Ca 0.35 -0.38 0.06 0.00 -1.03 0.00 0.00 54.13 53.13 2np0 s LEU 892 Cb -0.16 -1.52 -0.07 0.00 0.03 0.00 0.00 46.19 44.46 2np0 s LEU 892 CO 0.11 0.21 0.02 0.54 0.23 0.00 0.00 176.35 177.46 2np0 s ASN 893 N 0.08 3.40 0.00 2.29 2.20 -0.81 -4.98 114.94 117.12 2np0 s ASN 893 Ca -0.07 -1.36 0.19 0.00 -0.94 0.00 0.00 52.86 50.67 2np0 s ASN 893 Cb -0.15 -0.30 0.96 0.00 -2.00 0.00 0.00 41.25 39.76 2np0 s ASN 893 CO 0.05 -0.48 1.64 -0.90 -2.94 0.00 0.00 177.10 174.47 2np0 n ASP 894 N -0.87 0.53 -0.94 3.54 5.68 -1.26 -1.72 116.55 121.51 2np0 n ASP 894 Ca -0.04 -1.53 0.04 0.00 -0.50 0.00 0.00 54.79 52.75 2np0 n ASP 894 Cb 0.67 -0.03 0.16 0.00 -1.14 0.00 0.00 41.12 40.77 2np0 n ASP 894 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2np0 n LYS 895 N -0.43 2.38 -1.04 0.11 5.02 -1.26 -4.90 118.16 118.05 2np0 n LYS 895 Ca 0.14 -1.28 -0.01 0.00 -2.02 0.00 0.00 58.31 55.14 2np0 n LYS 895 Cb 0.15 -1.65 -0.01 0.00 -0.02 0.00 0.00 35.03 33.50 2np0 n LYS 895 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2np0 n ASN 896 N 0.32 -5.12 -4.82 4.39 3.02 -0.70 -4.98 115.26 107.36 2np0 n ASN 896 Ca 0.11 0.03 -0.34 0.00 -0.03 0.00 0.00 54.58 54.36 2np0 n ASN 896 Cb 0.54 -2.74 -0.06 0.00 -0.61 0.00 0.00 39.78 36.90 2np0 n ASN 896 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2np0 s GLN 897 N -1.60 4.19 0.02 3.52 -0.21 -1.23 -4.30 119.66 120.05 2np0 s GLN 897 Ca 0.00 0.89 0.01 0.00 0.02 0.00 0.00 55.36 56.27 2np0 s GLN 897 Cb 0.00 -2.58 -0.02 0.00 1.00 0.00 0.00 33.01 31.41 2np0 s GLN 897 CO 0.00 0.22 -0.04 -0.59 -2.12 0.00 0.00 175.29 172.76 2np0 s PHE 898 N -1.82 0.33 -0.25 0.91 -0.12 0.42 -1.92 117.98 115.52 2np0 s PHE 898 Ca 0.51 -0.44 -0.01 0.00 -0.05 0.00 0.00 56.93 56.93 2np0 s PHE 898 Cb -0.13 -0.22 0.03 0.00 -0.63 0.00 0.00 43.02 42.07 2np0 s PHE 898 CO 0.19 -0.14 -0.06 0.21 -0.05 0.00 0.00 175.22 175.37 2np0 s LYS 899 N -1.26 2.80 -0.21 1.99 2.20 -0.01 -0.48 119.74 124.76 2np0 s LYS 899 Ca -0.12 -1.00 -0.20 0.00 -0.36 0.00 0.00 55.97 54.29 2np0 s LYS 899 Cb -0.09 -2.98 -0.03 0.00 -1.51 0.00 0.00 37.83 33.22 2np0 s LYS 899 CO -0.01 -0.41 0.58 -0.51 -0.36 0.00 0.00 175.35 174.64 2np0 s LEU 900 N 1.31 4.13 0.00 5.43 1.43 0.31 -2.70 118.68 128.60 2np0 s LEU 900 Ca -0.00 0.73 0.00 0.00 -1.03 0.00 0.00 54.13 53.83 2np0 s LEU 900 Cb -0.17 -2.80 0.00 0.00 0.03 0.00 0.00 46.19 43.26 2np0 s LEU 900 CO -0.04 -0.25 0.00 0.35 0.23 0.00 0.00 176.35 176.64 2np0 n THR 901 N 4.71 0.00 1.13 5.49 -2.24 -1.26 -1.06 114.28 121.05 2np0 n THR 901 Ca -0.03 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.83 2np0 n THR 901 Cb 0.50 -0.57 0.28 0.00 -2.10 0.00 0.00 70.33 68.44 2np0 n THR 901 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2np0 n SER 902 N -1.52 1.64 -4.85 3.42 3.41 -1.21 -4.42 113.62 110.07 2np0 n SER 902 Ca 0.00 -1.83 -0.33 0.00 -0.26 0.00 0.00 58.87 56.46 2np0 n SER 902 Cb 0.00 -0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 63.74 2np0 n SER 902 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2np0 s SER 903 N -1.31 6.75 0.33 4.04 0.01 -1.26 -4.97 113.70 117.28 2np0 s SER 903 Ca 0.27 1.16 0.06 0.00 1.31 0.00 0.00 55.95 58.76 2np0 s SER 903 Cb 0.15 -2.32 0.73 0.00 0.21 0.00 0.00 66.02 64.78 2np0 s SER 903 CO 0.21 -0.13 1.84 0.00 0.41 0.00 0.00 173.24 175.57 2np0 h ALA 904 N 2.48 1.72 -0.26 1.44 0.00 -1.98 -1.75 119.26 120.92 2np0 h ALA 904 Ca -0.48 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2np0 h ALA 904 Cb 1.17 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2np0 h ALA 904 CO 0.67 0.01 0.00 0.27 0.00 0.00 0.00 179.25 180.20 2np0 n ASN 905 N -4.61 1.79 -4.14 0.00 6.94 -1.26 -4.54 115.26 109.43 2np0 n ASN 905 Ca 0.19 -1.85 -0.43 0.00 -0.02 0.00 0.00 54.58 52.46 2np0 n ASN 905 Cb 0.46 -0.17 0.00 0.00 -2.36 0.00 0.00 39.78 37.71 2np0 n ASN 905 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 2np0 n SER 906 N 0.43 5.48 -3.80 0.53 2.88 -0.66 -0.66 113.62 117.83 2np0 n SER 906 Ca 0.14 -3.13 -0.10 0.00 -1.33 0.00 0.00 58.87 54.45 2np0 n SER 906 Cb 0.31 -1.44 -0.07 0.00 -0.75 0.00 0.00 64.21 62.26 2np0 n SER 906 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2np0 s LYS 907 N -0.24 0.83 -0.04 -1.46 -2.85 -1.26 -4.51 119.74 110.22 2np0 s LYS 907 Ca 0.37 -0.73 0.04 0.00 -1.00 0.00 0.00 55.97 54.65 2np0 s LYS 907 Cb 0.02 0.35 -0.00 0.00 -2.06 0.00 0.00 37.83 36.13 2np0 s LYS 907 CO 0.01 -0.27 -0.17 0.42 0.10 0.00 0.00 175.35 175.44 2np0 s ILE 908 N -3.22 1.44 -0.23 3.79 1.01 -0.40 -1.35 121.20 122.24 2np0 s ILE 908 Ca -0.00 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.93 2np0 s ILE 908 Cb 0.02 -1.23 0.04 0.00 0.01 0.00 0.00 42.46 41.29 2np0 s ILE 908 CO -0.08 0.41 -0.13 -0.60 0.00 0.00 0.00 174.94 174.55 2np0 s ARG 909 N -0.02 2.69 -0.19 2.79 3.52 0.11 -1.28 118.95 126.57 2np0 s ARG 909 Ca -0.03 -1.05 -0.10 0.00 -0.13 0.00 0.00 55.73 54.43 2np0 s ARG 909 Cb -0.11 -2.81 -0.05 0.00 -1.56 0.00 0.00 34.95 30.42 2np0 s ARG 909 CO 0.02 -0.39 0.13 0.08 -0.81 0.00 0.00 175.30 174.33 2np0 s VAL 910 N 1.24 5.40 -0.42 7.11 1.01 -0.10 -1.21 120.40 133.43 2np0 s VAL 910 Ca -0.01 0.19 -0.07 0.00 0.00 0.00 0.00 61.98 62.08 2np0 s VAL 910 Cb -0.16 -3.46 0.09 0.00 0.00 0.00 0.00 36.38 32.85 2np0 s VAL 910 CO -0.08 0.46 0.25 -0.89 0.00 0.00 0.00 175.10 174.84 2np0 s THR 911 N 0.23 3.89 0.74 3.92 2.01 0.18 -1.34 115.64 125.26 2np0 s THR 911 Ca 0.09 -1.66 -0.14 0.00 0.31 0.00 0.00 61.69 60.28 2np0 s THR 911 Cb -0.11 -3.49 0.04 0.00 0.01 0.00 0.00 72.50 68.95 2np0 s THR 911 CO -0.01 -0.59 1.16 -1.10 -0.69 0.00 0.00 174.62 173.38 2np0 s GLN 912 N 1.32 2.22 -0.31 4.92 -0.21 -1.26 -2.74 119.66 123.59 2np0 s GLN 912 Ca 0.04 1.55 -0.29 0.00 0.02 0.00 0.00 55.36 56.68 2np0 s GLN 912 Cb -0.24 -1.86 -0.00 0.00 1.00 0.00 0.00 33.01 31.91 2np0 s GLN 912 CO -0.00 -1.73 1.37 1.21 -2.12 0.00 0.00 175.29 174.02 2np0 s ASN 913 N -2.44 6.56 0.58 5.90 3.84 -1.26 -4.91 114.94 123.21 2np0 s ASN 913 Ca 0.70 1.20 0.36 0.00 0.21 0.00 0.00 52.86 55.32 2np0 s ASN 913 Cb -0.24 -2.54 1.64 0.00 -0.55 0.00 0.00 41.25 39.56 2np0 s ASN 913 CO 0.47 -1.18 2.08 1.56 -2.79 0.00 0.00 177.10 177.24 2np0 h GLN 914 N 9.80 0.00 -0.48 0.43 1.08 -1.93 -3.18 115.11 120.84 2np0 h GLN 914 Ca -0.28 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 2np0 h GLN 914 Cb 1.11 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 2np0 h GLN 914 CO 1.04 0.01 0.00 0.09 -0.95 0.00 0.00 178.83 179.02 2np0 n ASN 915 N -3.11 2.14 0.00 1.46 3.02 -1.26 -4.04 115.26 113.47 2np0 n ASN 915 Ca -0.00 -2.13 0.00 0.00 -0.03 0.00 0.00 54.58 52.42 2np0 n ASN 915 Cb 0.25 -0.33 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 2np0 n ASN 915 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2np0 n ILE 916 N 0.38 0.00 -3.65 2.41 -6.64 -1.20 -4.76 119.36 105.90 2np0 n ILE 916 Ca 0.11 -0.14 -0.39 0.00 -1.77 0.00 0.00 62.75 60.56 2np0 n ILE 916 Cb 0.39 0.83 -0.12 0.00 -1.44 0.00 0.00 39.64 39.31 2np0 n ILE 916 CO 0.00 0.00 0.00 -0.63 -1.77 0.00 0.00 176.55 174.15 2np0 s ILE 917 N -0.42 4.41 0.00 7.28 1.01 -1.26 -4.84 121.20 127.39 2np0 s ILE 917 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.90 2np0 s ILE 917 Cb 0.00 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 39.08 2np0 s ILE 917 CO 0.00 -0.11 0.42 2.22 0.00 0.00 0.00 174.94 177.47 2np0 n PHE 918 N 4.96 0.00 -3.23 3.97 1.16 -1.26 -4.86 117.46 118.19 2np0 n PHE 918 Ca -0.13 0.00 -0.24 0.00 -1.87 0.00 0.00 57.45 55.21 2np0 n PHE 918 Cb 0.47 0.23 -0.07 0.00 -1.61 0.00 0.00 39.48 38.50 2np0 n PHE 918 CO 0.00 0.00 0.00 -1.71 -1.87 0.00 0.00 176.76 173.18 2np0 n ASN 919 N 0.00 0.51 0.00 5.98 2.85 -1.26 -4.62 115.26 118.71 2np0 n ASN 919 Ca 0.00 -2.75 0.00 0.00 -0.11 0.00 0.00 54.58 51.72 2np0 n ASN 919 Cb 0.50 -0.64 0.00 0.00 1.24 0.00 0.00 39.78 40.88 2np0 n ASN 919 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 2np0 n SER 920 N 1.44 0.00 -0.09 1.20 3.41 -1.26 -4.25 113.62 114.08 2np0 n SER 920 Ca 0.22 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.69 2np0 n SER 920 Cb 0.51 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.39 2np0 n SER 920 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2np0 n VAL 921 N 0.00 0.96 -3.19 -3.33 0.31 -1.26 -1.56 118.33 110.25 2np0 n VAL 921 Ca 0.00 -0.32 -0.45 0.00 -0.01 0.00 0.00 64.34 63.56 2np0 n VAL 921 Cb 0.00 -1.34 -0.04 0.00 -0.91 0.00 0.00 33.84 31.55 2np0 n VAL 921 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 2np0 s PHE 922 N -2.33 3.15 0.52 3.52 0.40 -1.26 -4.74 117.98 117.24 2np0 s PHE 922 Ca -0.23 -1.17 -0.21 0.00 -0.60 0.00 0.00 56.93 54.72 2np0 s PHE 922 Cb 0.07 -3.93 -0.06 0.00 0.51 0.00 0.00 43.02 39.61 2np0 s PHE 922 CO 0.36 -1.18 1.20 -0.51 0.70 0.00 0.00 175.22 175.78 2np0 s LEU 923 N 2.12 3.85 -0.43 -0.37 1.02 -1.26 -4.93 118.68 118.68 2np0 s LEU 923 Ca 0.09 2.37 0.02 0.00 0.02 0.00 0.00 54.13 56.63 2np0 s LEU 923 Cb -0.25 -4.40 0.24 0.00 0.02 0.00 0.00 46.19 41.79 2np0 s LEU 923 CO 0.03 -1.24 0.98 -0.67 0.02 0.00 0.00 176.35 175.48 2np0 n ASP 924 N -1.00 -2.40 -3.50 2.29 2.03 -1.22 -3.31 116.55 109.45 2np0 n ASP 924 Ca 0.10 -2.50 -0.14 0.00 0.52 0.00 0.00 54.79 52.77 2np0 n ASP 924 Cb 0.49 1.37 -0.04 0.00 -0.72 0.00 0.00 41.12 42.22 2np0 n ASP 924 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 2np0 s PHE 925 N 0.62 -0.53 0.11 -0.67 -0.12 -0.91 -2.50 117.98 113.97 2np0 s PHE 925 Ca 0.29 0.59 0.05 0.00 -0.05 0.00 0.00 56.93 57.81 2np0 s PHE 925 Cb 0.16 0.44 -0.04 0.00 -0.63 0.00 0.00 43.02 42.96 2np0 s PHE 925 CO -0.15 -0.71 -0.12 -1.12 -0.05 0.00 0.00 175.22 173.07 2np0 s SER 926 N -2.07 1.72 -0.05 1.98 0.01 -0.29 -0.75 113.70 114.25 2np0 s SER 926 Ca -0.04 -0.79 0.03 0.00 1.31 0.00 0.00 55.95 56.46 2np0 s SER 926 Cb -0.01 -0.03 0.01 0.00 0.21 0.00 0.00 66.02 66.20 2np0 s SER 926 CO -0.03 -0.19 -0.12 -0.69 0.41 0.00 0.00 173.24 172.62 2np0 s VAL 927 N -2.16 1.09 0.02 3.43 1.01 0.25 -0.59 120.40 123.45 2np0 s VAL 927 Ca 0.06 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2np0 s VAL 927 Cb -0.05 -0.98 -0.01 0.00 0.00 0.00 0.00 36.38 35.34 2np0 s VAL 927 CO 0.02 0.34 -0.07 -0.94 0.00 0.00 0.00 175.10 174.44 2np0 s SER 928 N 0.44 0.81 0.10 3.32 1.04 -0.33 -0.70 113.70 118.38 2np0 s SER 928 Ca -0.10 -0.29 -0.27 0.00 0.48 0.00 0.00 55.95 55.78 2np0 s SER 928 Cb -0.13 -0.04 0.08 0.00 0.10 0.00 0.00 66.02 66.03 2np0 s SER 928 CO 0.03 -0.03 1.02 0.72 0.98 0.00 0.00 173.24 175.96 2np0 s PHE 929 N -0.62 -0.13 0.00 5.02 -0.12 -0.86 -0.58 117.98 120.69 2np0 s PHE 929 Ca -0.02 -0.11 0.01 0.00 -0.05 0.00 0.00 56.93 56.76 2np0 s PHE 929 Cb -0.05 0.61 -0.04 0.00 -0.63 0.00 0.00 43.02 42.91 2np0 s PHE 929 CO 0.00 -0.68 0.01 -1.58 -0.05 0.00 0.00 175.22 172.92 2np0 s TRP 930 N -3.09 3.10 0.04 3.49 0.52 -0.55 -0.34 118.94 122.11 2np0 s TRP 930 Ca 0.12 0.09 0.01 0.00 0.02 0.00 0.00 56.10 56.34 2np0 s TRP 930 Cb -0.00 -1.67 -0.02 0.00 -1.15 0.00 0.00 33.47 30.62 2np0 s TRP 930 CO -0.00 0.47 -0.06 -1.50 0.02 0.00 0.00 176.95 175.88 2np0 s ILE 931 N -1.11 0.41 -0.22 2.03 2.07 -0.18 -1.98 121.20 122.23 2np0 s ILE 931 Ca 0.20 -1.06 -0.02 0.00 -1.41 0.00 0.00 60.65 58.37 2np0 s ILE 931 Cb -0.12 -0.54 0.06 0.00 0.13 0.00 0.00 42.46 42.00 2np0 s ILE 931 CO 0.11 -0.44 0.02 -0.60 -1.91 0.00 0.00 174.94 172.12 2np0 s ARG 932 N -1.62 0.90 -0.18 3.50 3.52 -0.23 -1.96 118.95 122.87 2np0 s ARG 932 Ca -0.11 -0.63 -0.05 0.00 -0.13 0.00 0.00 55.73 54.81 2np0 s ARG 932 Cb -0.09 -2.22 -0.03 0.00 -1.56 0.00 0.00 34.95 31.05 2np0 s ARG 932 CO -0.00 -0.67 0.00 0.42 -0.81 0.00 0.00 175.30 174.25 2np0 s ILE 933 N 1.72 4.11 0.83 4.11 1.01 -1.26 -2.66 121.20 129.07 2np0 s ILE 933 Ca -0.01 -0.27 -0.12 0.00 0.00 0.00 0.00 60.65 60.25 2np0 s ILE 933 Cb -0.18 -2.84 0.10 0.00 0.01 0.00 0.00 42.46 39.55 2np0 s ILE 933 CO -0.09 0.45 1.16 -2.84 0.00 0.00 0.00 174.94 173.62 2np0 s PRO 934 N 0.71 1.55 0.60 2.79 0.02 -1.26 -1.17 135.00 138.23 2np0 s PRO 934 Ca 0.00 1.58 -0.19 0.00 0.02 0.00 0.00 61.00 62.41 2np0 s PRO 934 Cb -0.14 -1.78 -0.03 0.00 0.02 0.00 0.00 34.50 32.56 2np0 s PRO 934 CO 0.02 -2.24 1.21 0.21 -0.33 0.00 0.00 177.00 175.87 2np0 s LYS 935 N -4.43 2.95 0.83 5.54 2.20 0.68 -4.67 119.74 122.84 2np0 s LYS 935 Ca 0.69 1.83 -0.14 0.00 -0.36 0.00 0.00 55.97 57.99 2np0 s LYS 935 Cb -0.24 -1.92 0.04 0.00 -1.51 0.00 0.00 37.83 34.20 2np0 s LYS 935 CO 0.53 -1.23 0.80 2.48 -0.36 0.00 0.00 175.35 177.58 2np0 n TYR 936 N -1.62 -0.04 -3.27 4.03 0.18 -1.26 -4.87 117.16 110.30 2np0 n TYR 936 Ca 0.14 0.34 -0.39 0.00 1.88 0.00 0.00 57.90 59.87 2np0 n TYR 936 Cb 0.50 -1.96 -0.07 0.00 -0.38 0.00 0.00 39.34 37.43 2np0 n TYR 936 CO 0.00 0.00 0.00 0.15 -2.08 0.00 0.00 176.86 174.93 2np0 s LYS 937 N -3.66 4.18 0.39 -3.48 -0.14 -1.26 -4.81 119.74 110.96 2np0 s LYS 937 Ca 0.66 0.37 0.18 0.00 -1.36 0.00 0.00 55.97 55.83 2np0 s LYS 937 Cb -0.28 -3.56 1.09 0.00 -1.68 0.00 0.00 37.83 33.40 2np0 s LYS 937 CO 0.58 -0.14 1.77 -0.91 -0.76 0.00 0.00 175.35 175.89 2np0 h ASN 938 N 7.46 0.46 0.79 2.83 4.21 -1.94 -1.54 115.58 127.86 2np0 h ASN 938 Ca -0.34 0.09 0.00 0.00 1.21 0.00 0.00 56.30 57.26 2np0 h ASN 938 Cb 1.16 0.01 0.00 0.00 -1.12 0.00 0.00 38.32 38.37 2np0 h ASN 938 CO 0.73 0.09 -1.12 -0.90 -1.29 0.00 0.00 177.43 174.94 2np0 n ASP 939 N -4.64 0.70 -2.73 5.81 5.75 -1.26 -4.29 116.55 115.89 2np0 n ASP 939 Ca 0.25 0.22 -0.34 0.00 -0.01 0.00 0.00 54.79 54.91 2np0 n ASP 939 Cb 0.87 0.68 0.02 0.00 -1.03 0.00 0.00 41.12 41.66 2np0 n ASP 939 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2np0 n GLY 940 N 1.22 5.75 0.12 6.12 0.00 -0.58 -4.85 105.19 112.97 2np0 n GLY 940 Ca -0.00 -2.62 -0.08 0.00 0.00 0.00 0.00 46.02 43.32 2np0 n GLY 940 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2np0 h ILE 941 N 2.28 1.52 0.05 -0.61 2.10 -1.74 -2.96 117.51 118.15 2np0 h ILE 941 Ca 0.44 -2.70 -0.28 0.00 1.08 0.00 0.00 64.86 63.40 2np0 h ILE 941 Cb 0.44 2.51 0.02 0.00 -1.09 0.00 0.00 36.82 38.71 2np0 h ILE 941 CO 1.16 0.79 -1.14 1.56 -1.08 0.00 0.00 178.15 179.44 2np0 h GLN 942 N 0.09 0.67 -0.59 2.19 1.08 -1.92 -2.00 115.11 114.63 2np0 h GLN 942 Ca -0.04 -0.79 0.05 0.00 -1.45 0.00 0.00 58.65 56.41 2np0 h GLN 942 Cb 1.54 0.24 -0.05 0.00 -0.05 0.00 0.00 27.48 29.16 2np0 h GLN 942 CO 0.13 1.35 0.32 -0.91 -0.95 0.00 0.00 178.83 178.78 2np0 h ASN 943 N 0.34 0.48 0.29 1.46 4.21 -1.97 0.11 115.58 120.50 2np0 h ASN 943 Ca -0.16 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.38 2np0 h ASN 943 Cb 1.80 -0.07 -0.04 0.00 -1.12 0.00 0.00 38.32 38.89 2np0 h ASN 943 CO 0.22 0.32 -0.48 0.22 -1.29 0.00 0.00 177.43 176.43 2np0 h TYR 944 N 0.62 -1.34 -0.95 1.19 3.20 -1.46 -0.60 116.97 117.63 2np0 h TYR 944 Ca 0.26 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.17 2np0 h TYR 944 Cb 0.14 0.55 -0.05 0.00 1.54 0.00 0.00 36.73 38.91 2np0 h TYR 944 CO -0.08 -0.60 0.63 0.82 -1.64 0.00 0.00 178.16 177.28 2np0 h ILE 945 N -0.83 1.23 0.00 1.81 2.04 -1.00 -2.66 117.51 118.10 2np0 h ILE 945 Ca -0.02 -0.44 -0.09 0.00 1.00 0.00 0.00 64.86 65.32 2np0 h ILE 945 Cb 0.78 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 2np0 h ILE 945 CO -0.17 0.23 -1.82 1.41 0.00 0.00 0.00 178.15 177.81 2np0 n HIS 946 N -4.40 0.00 -3.06 1.37 8.25 0.34 -4.59 115.22 113.13 2np0 n HIS 946 Ca 0.11 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.15 2np0 n HIS 946 Cb 0.03 -0.48 -0.06 0.00 1.12 0.00 0.00 29.99 30.60 2np0 n HIS 946 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2np0 s ASN 947 N -4.14 6.40 0.04 0.41 0.01 -0.24 -5.03 114.94 112.38 2np0 s ASN 947 Ca -0.06 -0.05 -0.24 0.00 -0.71 0.00 0.00 52.86 51.81 2np0 s ASN 947 Cb 0.08 -2.35 -0.06 0.00 0.41 0.00 0.00 41.25 39.34 2np0 s ASN 947 CO 0.64 -0.75 0.71 -0.70 -1.51 0.00 0.00 177.10 175.50 2np0 s GLU 948 N 2.93 4.44 0.03 -0.60 2.12 -1.26 -4.34 118.70 122.02 2np0 s GLU 948 Ca 0.26 0.96 0.04 0.00 0.36 0.00 0.00 54.97 56.60 2np0 s GLU 948 Cb -0.14 -3.35 -0.02 0.00 0.26 0.00 0.00 34.13 30.89 2np0 s GLU 948 CO 0.18 0.33 -0.13 1.52 -0.54 0.00 0.00 175.26 176.62 2np0 s TYR 949 N -0.18 1.16 0.31 5.30 -0.85 -0.25 -4.23 117.35 118.61 2np0 s TYR 949 Ca 0.36 -0.33 -0.18 0.00 -0.52 0.00 0.00 57.07 56.39 2np0 s TYR 949 Cb -0.20 -0.70 -0.09 0.00 0.38 0.00 0.00 41.96 41.35 2np0 s TYR 949 CO 0.21 0.02 0.78 0.99 -1.52 0.00 0.00 175.55 176.03 2np0 s THR 950 N -0.78 4.57 -0.04 -3.49 2.01 0.87 -0.53 115.64 118.25 2np0 s THR 950 Ca 0.01 1.19 0.01 0.00 0.31 0.00 0.00 61.69 63.21 2np0 s THR 950 Cb -0.07 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 2np0 s THR 950 CO 0.01 -0.06 -0.03 2.30 -0.69 0.00 0.00 174.62 176.16 2np0 n ILE 951 N 0.01 0.23 -4.41 1.82 -5.35 -0.47 -1.06 119.36 110.13 2np0 n ILE 951 Ca 0.02 -0.10 -0.21 0.00 -0.27 0.00 0.00 62.75 62.19 2np0 n ILE 951 Cb 0.52 -0.70 -0.16 0.00 -1.74 0.00 0.00 39.64 37.56 2np0 n ILE 951 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2np0 s ILE 952 N -2.08 0.84 -0.05 7.28 1.01 -1.02 -0.52 121.20 126.66 2np0 s ILE 952 Ca -0.05 -0.36 -0.02 0.00 0.00 0.00 0.00 60.65 60.22 2np0 s ILE 952 Cb 0.01 -0.77 0.03 0.00 0.01 0.00 0.00 42.46 41.75 2np0 s ILE 952 CO 0.10 0.27 0.04 0.21 0.00 0.00 0.00 174.94 175.57 2np0 s ASN 953 N 0.39 1.26 -0.46 3.58 2.47 -0.14 -1.65 114.94 120.40 2np0 s ASN 953 Ca -0.07 0.03 0.03 0.00 0.42 0.00 0.00 52.86 53.28 2np0 s ASN 953 Cb -0.11 -0.23 0.13 0.00 -1.45 0.00 0.00 41.25 39.59 2np0 s ASN 953 CO 0.01 -0.23 0.21 0.00 -3.72 0.00 0.00 177.10 173.37 2np0 s MET 955 N 0.20 0.87 -0.07 0.00 -1.94 -1.26 -0.37 119.30 116.73 2np0 s MET 955 Ca 0.16 -0.33 -0.01 0.00 -1.71 0.00 0.00 55.69 53.80 2np0 s MET 955 Cb -0.24 -0.83 0.03 0.00 2.01 0.00 0.00 34.83 35.80 2np0 s MET 955 CO -0.03 0.16 -0.00 0.21 -0.01 0.00 0.00 175.02 175.36 2np0 s LYS 956 N -0.03 0.61 -1.22 2.03 2.47 0.16 -4.57 119.74 119.20 2np0 s LYS 956 Ca 0.01 0.09 -0.02 0.00 -1.56 0.00 0.00 55.97 54.49 2np0 s LYS 956 Cb -0.06 -0.95 -0.01 0.00 -1.46 0.00 0.00 37.83 35.35 2np0 s LYS 956 CO 0.00 -0.28 0.84 0.09 0.16 0.00 0.00 175.35 176.16 2np0 n ASN 957 N 5.04 -2.47 -1.55 1.43 3.02 -1.26 -2.53 115.26 116.94 2np0 n ASN 957 Ca -0.09 -0.74 -0.19 0.00 -0.03 0.00 0.00 54.58 53.52 2np0 n ASN 957 Cb 0.50 -4.56 -0.08 0.00 -0.61 0.00 0.00 39.78 35.03 2np0 n ASN 957 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2np0 n ASN 958 N -3.08 -5.12 -3.97 6.41 3.02 -1.26 -4.95 115.26 106.31 2np0 n ASN 958 Ca -0.25 0.48 -0.14 0.00 -0.03 0.00 0.00 54.58 54.63 2np0 n ASN 958 Cb 0.66 -4.54 -0.13 0.00 -0.61 0.00 0.00 39.78 35.16 2np0 n ASN 958 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2np0 s SER 959 N -2.64 0.52 0.00 6.41 0.15 -1.05 -4.68 113.70 112.42 2np0 s SER 959 Ca 0.00 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.44 2np0 s SER 959 Cb 0.00 -0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.29 2np0 s SER 959 CO 0.00 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.02 2np0 n GLY 960 N 2.55 -0.13 3.12 9.45 0.00 -0.40 -0.66 105.19 119.11 2np0 n GLY 960 Ca -0.16 -0.61 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 2np0 n GLY 960 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2np0 s TRP 961 N -2.19 0.29 -0.02 1.61 1.48 0.50 -0.67 118.94 119.93 2np0 s TRP 961 Ca 0.00 -0.69 -0.11 0.00 -1.06 0.00 0.00 56.10 54.24 2np0 s TRP 961 Cb 0.00 -0.20 0.01 0.00 -1.16 0.00 0.00 33.47 32.12 2np0 s TRP 961 CO 0.00 -0.40 0.23 -1.59 -4.06 0.00 0.00 176.95 171.13 2np0 s LYS 962 N -3.20 0.53 -0.21 3.25 -2.85 -0.53 -0.57 119.74 116.15 2np0 s LYS 962 Ca 0.00 -0.18 -0.07 0.00 -1.00 0.00 0.00 55.97 54.72 2np0 s LYS 962 Cb 0.02 0.23 -0.04 0.00 -2.06 0.00 0.00 37.83 35.99 2np0 s LYS 962 CO -0.07 -0.13 0.07 0.42 0.10 0.00 0.00 175.35 175.74 2np0 s ILE 963 N -1.09 4.60 0.28 3.79 1.01 -0.66 -1.21 121.20 127.93 2np0 s ILE 963 Ca -0.12 -0.09 0.04 0.00 0.00 0.00 0.00 60.65 60.49 2np0 s ILE 963 Cb -0.06 -3.11 -0.06 0.00 0.01 0.00 0.00 42.46 39.25 2np0 s ILE 963 CO 0.02 0.40 0.00 -0.94 0.00 0.00 0.00 174.94 174.43 2np0 s SER 964 N 0.94 2.29 -0.02 3.58 1.04 -0.02 -1.37 113.70 120.15 2np0 s SER 964 Ca 0.04 -1.27 0.04 0.00 0.48 0.00 0.00 55.95 55.23 2np0 s SER 964 Cb -0.14 -0.08 -0.01 0.00 0.10 0.00 0.00 66.02 65.90 2np0 s SER 964 CO 0.03 -0.50 -0.12 -0.63 0.98 0.00 0.00 173.24 173.00 2np0 s ILE 965 N -3.26 0.96 -0.43 -1.02 1.01 0.32 -0.49 121.20 118.28 2np0 s ILE 965 Ca 0.32 -0.50 0.02 0.00 0.00 0.00 0.00 60.65 60.49 2np0 s ILE 965 Cb 0.06 -0.81 0.13 0.00 0.01 0.00 0.00 42.46 41.85 2np0 s ILE 965 CO 0.12 0.28 0.23 -0.60 0.00 0.00 0.00 174.94 174.97 2np0 s ARG 966 N -0.16 1.27 6.29 2.79 3.52 -0.26 -1.09 118.95 131.31 2np0 s ARG 966 Ca 0.02 -1.97 0.00 0.00 -0.13 0.00 0.00 55.73 53.66 2np0 s ARG 966 Cb -0.06 -2.33 0.00 0.00 -1.56 0.00 0.00 34.95 31.00 2np0 s ARG 966 CO -0.00 -1.15 0.00 0.41 -0.81 0.00 0.00 175.30 173.75 2np0 n GLY 967 N 3.60 1.75 1.39 8.12 0.00 -1.00 -2.10 105.19 116.96 2np0 n GLY 967 Ca 0.08 0.23 0.06 0.00 0.00 0.00 0.00 46.02 46.39 2np0 n GLY 967 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2np0 n ASN 968 N 11.19 4.08 -4.29 1.61 6.94 -1.26 -4.87 115.26 128.67 2np0 n ASN 968 Ca 0.00 -2.50 -0.30 0.00 -0.02 0.00 0.00 54.58 51.76 2np0 n ASN 968 Cb 0.00 -0.56 -0.16 0.00 -2.36 0.00 0.00 39.78 36.70 2np0 n ASN 968 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 2np0 s ARG 969 N -2.01 2.01 -0.09 -3.83 3.52 -0.89 -1.89 118.95 115.77 2np0 s ARG 969 Ca 0.40 -0.88 0.04 0.00 -0.13 0.00 0.00 55.73 55.15 2np0 s ARG 969 Cb 0.28 -1.94 0.00 0.00 -1.56 0.00 0.00 34.95 31.73 2np0 s ARG 969 CO 0.16 0.53 -0.23 -1.50 -0.81 0.00 0.00 175.30 173.45 2np0 s ILE 970 N -0.57 1.94 -0.06 4.11 2.07 0.85 -1.10 121.20 128.43 2np0 s ILE 970 Ca 0.09 -0.96 0.03 0.00 -1.41 0.00 0.00 60.65 58.40 2np0 s ILE 970 Cb -0.10 -1.68 0.01 0.00 0.13 0.00 0.00 42.46 40.83 2np0 s ILE 970 CO -0.01 0.53 -0.13 -0.63 -1.91 0.00 0.00 174.94 172.80 2np0 s ILE 971 N 0.30 1.15 -0.19 2.00 1.01 0.35 -0.71 121.20 125.11 2np0 s ILE 971 Ca -0.16 -0.51 -0.06 0.00 0.00 0.00 0.00 60.65 59.92 2np0 s ILE 971 Cb -0.17 -1.04 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 2np0 s ILE 971 CO 0.08 0.35 0.03 0.86 0.00 0.00 0.00 174.94 176.26 2np0 s TRP 972 N 0.51 3.12 -0.03 3.97 -0.11 0.59 -0.84 118.94 126.15 2np0 s TRP 972 Ca -0.12 -0.21 0.04 0.00 1.22 0.00 0.00 56.10 57.03 2np0 s TRP 972 Cb -0.14 -2.08 -0.00 0.00 -1.50 0.00 0.00 33.47 29.74 2np0 s TRP 972 CO 0.03 -0.07 -0.15 0.99 -4.62 0.00 0.00 176.95 173.14 2np0 s THR 973 N 0.73 1.24 -0.10 5.86 2.01 -0.35 -1.06 115.64 123.97 2np0 s THR 973 Ca 0.01 -0.62 0.00 0.00 0.31 0.00 0.00 61.69 61.40 2np0 s THR 973 Cb -0.14 -1.06 -0.02 0.00 0.01 0.00 0.00 72.50 71.28 2np0 s THR 973 CO 0.02 0.36 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.46 2np0 s LEU 974 N 0.01 2.99 -0.13 4.42 1.43 0.07 -1.46 118.68 126.02 2np0 s LEU 974 Ca -0.02 -0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 52.92 2np0 s LEU 974 Cb -0.10 -1.66 0.03 0.00 0.03 0.00 0.00 46.19 44.49 2np0 s LEU 974 CO 0.01 0.27 -0.05 -0.63 0.23 0.00 0.00 176.35 176.18 2np0 s ILE 975 N -0.29 0.95 0.83 -0.59 1.01 0.16 -1.11 121.20 122.16 2np0 s ILE 975 Ca 0.03 -0.37 -0.06 0.00 0.00 0.00 0.00 60.65 60.25 2np0 s ILE 975 Cb -0.13 -1.06 0.17 0.00 0.01 0.00 0.00 42.46 41.45 2np0 s ILE 975 CO 0.03 0.25 1.14 1.51 0.00 0.00 0.00 174.94 177.86 2np0 s ASP 976 N 1.72 3.76 0.32 3.58 -4.77 -0.09 -1.28 116.67 119.91 2np0 s ASP 976 Ca 0.03 -0.20 0.24 0.00 -3.30 0.00 0.00 52.55 49.33 2np0 s ASP 976 Cb -0.14 0.00 1.13 0.00 -1.09 0.00 0.00 42.92 42.83 2np0 s ASP 976 CO -0.08 -2.27 1.74 0.16 0.70 0.00 0.00 175.17 175.42 2np0 h ILE 977 N -1.00 0.00 -0.21 2.11 3.07 -1.25 0.54 117.51 120.76 2np0 h ILE 977 Ca -0.39 -0.16 0.00 0.00 1.55 0.00 0.00 64.86 65.86 2np0 h ILE 977 Cb 1.25 0.84 0.00 0.00 -0.27 0.00 0.00 36.82 38.64 2np0 h ILE 977 CO 0.37 0.00 0.00 0.59 -1.05 0.00 0.00 178.15 178.06 2np0 n ASN 978 N -2.34 2.81 0.00 2.16 3.02 -1.26 -4.94 115.26 114.70 2np0 n ASN 978 Ca 0.01 -1.90 0.00 0.00 -0.03 0.00 0.00 54.58 52.66 2np0 n ASN 978 Cb 0.16 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 2np0 n ASN 978 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2np0 n GLY 979 N 1.36 0.78 3.75 7.41 0.00 0.18 -5.03 105.19 113.64 2np0 n GLY 979 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2np0 n GLY 979 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2np0 s LYS 980 N -0.08 4.45 0.06 1.61 2.20 -1.26 -4.71 119.74 122.02 2np0 s LYS 980 Ca 0.00 2.02 0.08 0.00 -0.36 0.00 0.00 55.97 57.72 2np0 s LYS 980 Cb 0.00 -3.16 -0.03 0.00 -1.51 0.00 0.00 37.83 33.12 2np0 s LYS 980 CO 0.00 -0.11 -0.21 0.99 -0.36 0.00 0.00 175.35 175.67 2np0 s THR 981 N -0.57 2.61 0.05 3.43 2.01 -1.26 -0.91 115.64 120.99 2np0 s THR 981 Ca 0.51 -1.33 0.00 0.00 0.31 0.00 0.00 61.69 61.18 2np0 s THR 981 Cb -0.36 -2.10 -0.03 0.00 0.01 0.00 0.00 72.50 70.01 2np0 s THR 981 CO 0.43 0.29 -0.04 -0.54 -0.69 0.00 0.00 174.62 174.06 2np0 s LYS 982 N -1.56 0.58 -0.04 4.92 -0.14 -0.26 -5.00 119.74 118.24 2np0 s LYS 982 Ca 0.14 -1.06 -0.12 0.00 -1.36 0.00 0.00 55.97 53.57 2np0 s LYS 982 Cb -0.10 0.06 0.02 0.00 -1.68 0.00 0.00 37.83 36.13 2np0 s LYS 982 CO 0.05 -0.06 0.27 -1.12 -0.76 0.00 0.00 175.35 173.73 2np0 s SER 983 N -2.48 -0.18 -0.04 2.83 0.01 -1.26 -0.75 113.70 111.84 2np0 s SER 983 Ca 0.01 0.17 -0.08 0.00 1.31 0.00 0.00 55.95 57.36 2np0 s SER 983 Cb 0.02 0.37 0.01 0.00 0.21 0.00 0.00 66.02 66.63 2np0 s SER 983 CO -0.06 -0.34 0.18 0.54 0.41 0.00 0.00 173.24 173.97 2np0 s VAL 984 N -0.94 0.04 0.13 3.43 0.11 -0.23 -4.68 120.40 118.26 2np0 s VAL 984 Ca -0.10 -0.33 -0.06 0.00 -2.93 0.00 0.00 61.98 58.56 2np0 s VAL 984 Cb -0.05 -0.37 -0.02 0.00 -1.53 0.00 0.00 36.38 34.41 2np0 s VAL 984 CO 0.03 -0.18 0.16 0.72 -3.33 0.00 0.00 175.10 172.50 2np0 s PHE 985 N -0.65 0.51 -0.05 1.54 -0.12 -1.26 -0.30 117.98 117.65 2np0 s PHE 985 Ca -0.07 -0.91 0.02 0.00 -0.05 0.00 0.00 56.93 55.91 2np0 s PHE 985 Cb -0.04 -0.22 0.02 0.00 -0.63 0.00 0.00 43.02 42.14 2np0 s PHE 985 CO 0.01 -0.59 -0.09 0.12 -0.05 0.00 0.00 175.22 174.62 2np0 s PHE 986 N -3.97 1.15 -0.14 3.49 5.36 0.11 -4.73 117.98 119.25 2np0 s PHE 986 Ca 0.16 -0.39 0.01 0.00 -0.96 0.00 0.00 56.93 55.75 2np0 s PHE 986 Cb 0.05 -0.89 0.02 0.00 -0.34 0.00 0.00 43.02 41.87 2np0 s PHE 986 CO -0.03 -0.23 -0.16 -2.00 -1.46 0.00 0.00 175.22 171.34 2np0 s GLU 987 N 0.71 2.49 0.14 10.12 2.12 -1.26 -0.11 118.70 132.91 2np0 s GLU 987 Ca -0.13 -0.64 -0.10 0.00 0.36 0.00 0.00 54.97 54.46 2np0 s GLU 987 Cb -0.15 -2.17 -0.06 0.00 0.26 0.00 0.00 34.13 32.01 2np0 s GLU 987 CO 0.02 -0.16 0.46 1.52 -0.54 0.00 0.00 175.26 176.57 2np0 s TYR 988 N 1.24 3.53 0.65 5.30 -0.85 -0.79 -5.01 117.35 121.42 2np0 s TYR 988 Ca 0.00 0.83 -0.18 0.00 -0.52 0.00 0.00 57.07 57.21 2np0 s TYR 988 Cb -0.14 -2.20 -0.01 0.00 0.38 0.00 0.00 41.96 39.99 2np0 s TYR 988 CO -0.08 0.43 1.20 -1.71 -1.52 0.00 0.00 175.55 173.87 2np0 n ASN 989 N 0.52 1.63 -0.12 -0.18 2.85 -1.26 -4.84 115.26 113.86 2np0 n ASN 989 Ca -0.05 0.80 0.03 0.00 -0.11 0.00 0.00 54.58 55.25 2np0 n ASN 989 Cb 0.52 -1.51 0.05 0.00 1.24 0.00 0.00 39.78 40.08 2np0 n ASN 989 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 2np0 n ILE 990 N -2.01 0.91 -0.45 -1.44 -5.35 -1.26 -4.70 119.36 105.06 2np0 n ILE 990 Ca 0.15 -1.03 0.05 0.00 -0.27 0.00 0.00 62.75 61.65 2np0 n ILE 990 Cb 0.48 0.35 0.11 0.00 -1.74 0.00 0.00 39.64 38.84 2np0 n ILE 990 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2np0 n ARG 991 N -0.61 2.56 -2.97 6.28 1.74 -1.25 -1.27 116.66 121.13 2np0 n ARG 991 Ca 0.05 -2.09 -0.40 0.00 -0.77 0.00 0.00 57.85 54.64 2np0 n ARG 991 Cb 0.51 -1.31 -0.05 0.00 -1.02 0.00 0.00 32.46 30.59 2np0 n ARG 991 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2np0 s GLU 992 N -1.73 4.54 0.14 5.56 0.41 -1.14 -4.54 118.70 121.94 2np0 s GLU 992 Ca 0.19 1.13 -0.27 0.00 -0.41 0.00 0.00 54.97 55.61 2np0 s GLU 992 Cb 0.15 -3.32 -0.03 0.00 -1.78 0.00 0.00 34.13 29.15 2np0 s GLU 992 CO 0.06 0.41 1.59 -0.44 -0.49 0.00 0.00 175.26 176.39 2np0 h ASP 993 N 5.05 -1.20 -3.23 -0.19 3.32 -1.91 -3.37 116.42 114.89 2np0 h ASP 993 Ca -0.45 0.17 -0.50 0.00 0.02 0.00 0.00 57.03 56.27 2np0 h ASP 993 Cb 1.21 0.50 -0.38 0.00 0.22 0.00 0.00 39.33 40.88 2np0 h ASP 993 CO 0.69 -0.39 -0.79 -0.63 -1.72 0.00 0.00 179.24 176.40 2np0 s ILE 994 N -5.93 0.78 -0.09 0.35 -1.09 -1.26 -1.52 121.20 112.44 2np0 s ILE 994 Ca -0.15 -0.21 -0.13 0.00 -2.23 0.00 0.00 60.65 57.93 2np0 s ILE 994 Cb 0.10 -0.90 -0.05 0.00 -1.58 0.00 0.00 42.46 40.03 2np0 s ILE 994 CO 0.65 0.26 0.30 -0.55 -1.23 0.00 0.00 174.94 174.37 2np0 s SER 995 N 1.80 6.57 0.00 3.58 0.15 -1.26 -4.97 113.70 119.58 2np0 s SER 995 Ca 0.04 0.68 0.30 0.00 0.70 0.00 0.00 55.95 57.67 2np0 s SER 995 Cb -0.13 -2.18 1.44 0.00 -1.71 0.00 0.00 66.02 63.43 2np0 s SER 995 CO -0.07 0.26 1.98 -0.62 1.20 0.00 0.00 173.24 175.99 2np0 n GLU 996 N 2.49 0.78 0.00 5.44 1.02 -1.26 -4.32 120.64 124.79 2np0 n GLU 996 Ca -0.15 -0.18 0.00 0.00 -0.02 0.00 0.00 57.16 56.81 2np0 n GLU 996 Cb 0.53 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 2np0 n GLU 996 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2np0 n TYR 997 N -0.95 0.00 -1.88 -0.32 4.02 -1.26 -4.80 117.16 111.97 2np0 n TYR 997 Ca 0.17 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.63 2np0 n TYR 997 Cb 0.24 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.53 2np0 n TYR 997 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2np0 s ILE 998 N -1.95 3.35 -1.31 -0.72 1.01 -1.26 -2.30 121.20 118.02 2np0 s ILE 998 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.04 2np0 s ILE 998 Cb 0.00 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 39.08 2np0 s ILE 998 CO 0.00 -0.19 0.00 -3.20 0.00 0.00 0.00 174.94 171.55 2np0 n ASN 999 N 9.61 -4.43 -4.17 3.58 5.15 -0.32 -4.86 115.26 119.82 2np0 n ASN 999 Ca 0.23 0.23 -0.26 0.00 -0.60 0.00 0.00 54.58 54.18 2np0 n ASN 999 Cb 0.45 -3.22 -0.16 0.00 -0.53 0.00 0.00 39.78 36.32 2np0 n ASN 999 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2np0 s ARG 1000N -3.51 1.69 0.06 1.20 0.52 -0.97 -4.77 118.95 113.16 2np0 s ARG 1000Ca 0.00 -0.67 -0.34 0.00 -0.52 0.00 0.00 55.73 54.21 2np0 s ARG 1000Cb 0.00 -1.55 -0.13 0.00 0.52 0.00 0.00 34.95 33.79 2np0 s ARG 1000CO 0.00 0.35 1.72 0.91 0.02 0.00 0.00 175.30 178.29 2np0 n TRP 1001N 2.83 2.32 -4.40 -0.53 7.02 -0.74 -4.66 117.44 119.27 2np0 n TRP 1001Ca -0.16 0.13 -0.20 0.00 -1.02 0.00 0.00 57.50 56.25 2np0 n TRP 1001Cb 0.53 -2.61 -0.10 0.00 -2.42 0.00 0.00 31.31 26.71 2np0 n TRP 1001CO 0.00 0.00 0.00 -0.59 -2.02 0.00 0.00 177.69 175.08 2np0 s PHE 1002N 2.27 1.81 -0.17 -5.99 -0.12 -0.83 -4.93 117.98 110.01 2np0 s PHE 1002Ca 0.84 -1.05 -0.02 0.00 -0.05 0.00 0.00 56.93 56.65 2np0 s PHE 1002Cb -0.67 -1.14 -0.01 0.00 -0.63 0.00 0.00 43.02 40.57 2np0 s PHE 1002CO 0.43 -0.13 -0.08 0.12 -0.05 0.00 0.00 175.22 175.51 2np0 s PHE 1003N -3.47 2.90 -0.07 3.49 5.36 -1.26 -1.01 117.98 123.93 2np0 s PHE 1003Ca 0.37 -0.76 0.01 0.00 -0.96 0.00 0.00 56.93 55.58 2np0 s PHE 1003Cb 0.08 -1.98 -0.03 0.00 -0.34 0.00 0.00 43.02 40.76 2np0 s PHE 1003CO 0.15 -0.36 -0.07 0.08 -1.46 0.00 0.00 175.22 173.56 2np0 s VAL 1004N 0.88 3.70 -0.03 3.12 1.01 0.54 -0.13 120.40 129.50 2np0 s VAL 1004Ca -0.02 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 2np0 s VAL 1004Cb -0.15 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.75 2np0 s VAL 1004CO 0.01 0.60 0.03 -0.89 0.00 0.00 0.00 175.10 174.85 2np0 s THR 1005N -0.77 -0.03 -0.16 3.92 2.01 -0.49 -2.02 115.64 118.09 2np0 s THR 1005Ca 0.12 0.26 -0.02 0.00 0.31 0.00 0.00 61.69 62.36 2np0 s THR 1005Cb -0.11 -0.15 -0.02 0.00 0.01 0.00 0.00 72.50 72.24 2np0 s THR 1005CO 0.01 0.13 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.37 2np0 s ILE 1006N 1.45 3.37 0.01 1.82 1.01 0.13 0.32 121.20 129.30 2np0 s ILE 1006Ca -0.04 -0.53 0.06 0.00 0.00 0.00 0.00 60.65 60.14 2np0 s ILE 1006Cb -0.13 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 2np0 s ILE 1006CO -0.03 0.49 -0.20 0.42 0.00 0.00 0.00 174.94 175.62 2np0 s THR 1007N 0.65 1.59 -0.08 2.92 -4.23 -0.83 -0.58 115.64 115.08 2np0 s THR 1007Ca -0.05 -0.96 0.03 0.00 -1.18 0.00 0.00 61.69 59.53 2np0 s THR 1007Cb -0.15 -1.34 0.01 0.00 1.34 0.00 0.00 72.50 72.36 2np0 s THR 1007CO 0.02 0.35 -0.16 0.20 -0.54 0.00 0.00 174.62 174.49 2np0 s ASN 1008N -0.71 2.24 0.00 3.99 0.01 0.07 -0.94 114.94 119.59 2np0 s ASN 1008Ca 0.07 -0.39 0.00 0.00 -0.71 0.00 0.00 52.86 51.83 2np0 s ASN 1008Cb -0.08 -1.01 0.00 0.00 0.41 0.00 0.00 41.25 40.57 2np0 s ASN 1008CO 0.00 0.08 0.00 -0.46 -1.51 0.00 0.00 177.10 175.21 2np0 n ASN 1009N 3.68 0.58 0.28 -1.22 0.23 -0.32 -2.14 115.26 116.35 2np0 n ASN 1009Ca -0.21 -0.23 0.12 0.00 -0.53 0.00 0.00 54.58 53.73 2np0 n ASN 1009Cb 0.52 0.00 0.78 0.00 -2.08 0.00 0.00 39.78 39.00 2np0 n ASN 1009CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2np0 h LEU 1010N 0.00 0.00 -0.06 -4.53 5.85 -1.91 -3.34 115.31 111.32 2np0 h LEU 1010Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2np0 h LEU 1010Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2np0 h LEU 1010CO 0.00 0.04 0.00 -0.46 -0.34 0.00 0.00 178.44 177.68 2np0 n ASN 1011N -4.00 0.06 -3.80 1.25 6.94 -1.26 -4.45 115.26 110.00 2np0 n ASN 1011Ca -0.03 -0.82 -0.14 0.00 -0.02 0.00 0.00 54.58 53.57 2np0 n ASN 1011Cb 0.13 0.01 -0.15 0.00 -2.36 0.00 0.00 39.78 37.41 2np0 n ASN 1011CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 2np0 s ASN 1012N -0.01 0.02 -0.13 0.53 0.01 -1.25 -2.25 114.94 111.86 2np0 s ASN 1012Ca 0.00 0.06 -0.07 0.00 -0.71 0.00 0.00 52.86 52.14 2np0 s ASN 1012Cb 0.00 -0.01 -0.04 0.00 0.41 0.00 0.00 41.25 41.61 2np0 s ASN 1012CO 0.00 -0.08 0.13 0.00 -1.51 0.00 0.00 177.10 175.63 2np0 s ALA 1013N 0.68 3.80 0.04 0.60 0.00 -0.27 -1.18 121.76 125.43 2np0 s ALA 1013Ca -0.06 -0.66 0.04 0.00 0.00 0.00 0.00 51.96 51.29 2np0 s ALA 1013Cb -0.08 -1.95 -0.02 0.00 0.00 0.00 0.00 23.12 21.07 2np0 s ALA 1013CO -0.02 0.57 -0.13 0.15 0.00 0.00 0.00 175.76 176.33 2np0 s LYS 1014N -0.87 0.86 -0.21 0.00 1.02 -0.12 -0.72 119.74 119.70 2np0 s LYS 1014Ca 0.14 -0.74 -0.04 0.00 0.02 0.00 0.00 55.97 55.34 2np0 s LYS 1014Cb -0.12 -0.84 -0.02 0.00 -0.52 0.00 0.00 37.83 36.33 2np0 s LYS 1014CO 0.03 0.20 -0.03 0.42 -0.92 0.00 0.00 175.35 175.06 2np0 s ILE 1015N -0.90 3.59 0.02 2.17 1.01 0.05 -1.98 121.20 125.16 2np0 s ILE 1015Ca 0.00 -0.43 -0.06 0.00 0.00 0.00 0.00 60.65 60.16 2np0 s ILE 1015Cb -0.08 -2.63 -0.05 0.00 0.01 0.00 0.00 42.46 39.72 2np0 s ILE 1015CO 0.01 0.43 0.27 -0.31 0.00 0.00 0.00 174.94 175.33 2np0 s TYR 1016N 1.24 3.57 -0.06 3.97 1.51 0.15 -0.52 117.35 127.21 2np0 s TYR 1016Ca 0.03 0.55 0.03 0.00 -1.01 0.00 0.00 57.07 56.67 2np0 s TYR 1016Cb -0.14 -1.97 0.00 0.00 -0.11 0.00 0.00 41.96 39.74 2np0 s TYR 1016CO -0.00 0.60 -0.16 0.42 -1.11 0.00 0.00 175.55 175.30 2np0 s ILE 1017N -1.33 1.43 -1.71 2.71 -1.09 0.53 -1.40 121.20 120.35 2np0 s ILE 1017Ca 0.28 -0.67 -0.13 0.00 -2.23 0.00 0.00 60.65 57.90 2np0 s ILE 1017Cb -0.13 -1.26 0.13 0.00 -1.58 0.00 0.00 42.46 39.62 2np0 s ILE 1017CO 0.17 0.42 0.44 0.59 -1.23 0.00 0.00 174.94 175.33 2np0 n ASN 1018N 3.52 -1.14 0.00 3.58 3.02 0.82 -0.80 115.26 124.27 2np0 n ASN 1018Ca -0.20 -1.19 0.00 0.00 -0.03 0.00 0.00 54.58 53.16 2np0 n ASN 1018Cb 0.52 -1.96 0.00 0.00 -0.61 0.00 0.00 39.78 37.73 2np0 n ASN 1018CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2np0 n GLY 1019N -1.67 2.44 3.76 7.41 0.00 -1.26 -5.00 105.19 110.87 2np0 n GLY 1019Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 2np0 n GLY 1019CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2np0 s LYS 1020N -0.45 3.39 -0.03 1.61 2.20 0.02 -4.46 119.74 122.03 2np0 s LYS 1020Ca 0.00 -0.28 -0.30 0.00 -0.36 0.00 0.00 55.97 55.03 2np0 s LYS 1020Cb 0.00 -3.05 -0.05 0.00 -1.51 0.00 0.00 37.83 33.21 2np0 s LYS 1020CO 0.00 0.64 1.53 -1.17 -0.36 0.00 0.00 175.35 175.99 2np0 s LEU 1021N -0.67 4.31 -0.20 5.43 2.96 -1.26 -0.34 118.68 128.91 2np0 s LEU 1021Ca 0.12 2.18 -0.02 0.00 -0.22 0.00 0.00 54.13 56.19 2np0 s LEU 1021Cb -0.12 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 42.91 2np0 s LEU 1021CO 0.02 -0.84 -0.20 -0.62 -1.32 0.00 0.00 176.35 173.40 2np0 n GLU 1022N 6.29 0.47 -3.81 1.98 -0.58 0.32 -4.92 120.64 120.39 2np0 n GLU 1022Ca 0.15 0.13 -0.09 0.00 -0.42 0.00 0.00 57.16 56.94 2np0 n GLU 1022Cb 0.43 -1.34 0.03 0.00 -0.57 0.00 0.00 31.44 29.98 2np0 n GLU 1022CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2np0 s SER 1023N -6.14 0.06 -0.29 1.62 1.04 -1.07 -5.01 113.70 103.92 2np0 s SER 1023Ca -0.27 -1.20 -0.23 0.00 0.48 0.00 0.00 55.95 54.73 2np0 s SER 1023Cb 0.08 0.86 0.14 0.00 0.10 0.00 0.00 66.02 67.20 2np0 s SER 1023CO 0.42 -1.71 1.10 0.21 0.98 0.00 0.00 173.24 174.25 2np0 s ASN 1024N -3.09 -0.38 -0.02 7.02 3.84 -1.26 -0.77 114.94 120.28 2np0 s ASN 1024Ca 0.16 0.69 -0.00 0.00 0.21 0.00 0.00 52.86 53.92 2np0 s ASN 1024Cb -0.05 0.81 0.02 0.00 -0.55 0.00 0.00 41.25 41.49 2np0 s ASN 1024CO 0.12 -0.12 0.03 -0.89 -2.79 0.00 0.00 177.10 173.46 2np0 s THR 1025N 0.46 -0.05 0.01 -5.21 2.01 0.10 -4.97 115.64 107.98 2np0 s THR 1025Ca 0.01 0.17 -0.30 0.00 0.31 0.00 0.00 61.69 61.87 2np0 s THR 1025Cb -0.05 -0.08 -0.05 0.00 0.01 0.00 0.00 72.50 72.34 2np0 s THR 1025CO -0.10 0.07 1.27 -0.62 -0.69 0.00 0.00 174.62 174.55 2np0 s ASP 1026N 0.84 6.98 -0.17 3.53 -1.08 -1.26 -1.12 116.67 124.39 2np0 s ASP 1026Ca -0.07 2.00 0.15 0.00 -0.52 0.00 0.00 52.55 54.11 2np0 s ASP 1026Cb -0.10 -2.57 0.37 0.00 -1.46 0.00 0.00 42.92 39.16 2np0 s ASP 1026CO -0.02 -0.59 1.21 2.30 0.52 0.00 0.00 175.17 178.58 2np0 n ILE 1027N 4.37 2.08 -0.16 4.11 -5.35 -0.95 -4.72 119.36 118.74 2np0 n ILE 1027Ca 0.11 -2.68 -0.03 0.00 -0.27 0.00 0.00 62.75 59.87 2np0 n ILE 1027Cb 0.45 -0.25 0.17 0.00 -1.74 0.00 0.00 39.64 38.27 2np0 n ILE 1027CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 2np0 h LYS 1028N 0.56 0.90 -0.51 6.28 1.57 -1.78 -3.29 116.57 120.30 2np0 h LYS 1028Ca 0.01 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2np0 h LYS 1028Cb 1.06 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.23 2np0 h LYS 1028CO 0.03 0.79 0.00 -3.47 -0.57 0.00 0.00 179.45 176.23 2np0 n ASP 1029N -4.28 0.96 -4.76 0.86 2.03 -1.26 -4.78 116.55 105.32 2np0 n ASP 1029Ca 0.05 -2.05 -0.26 0.00 0.52 0.00 0.00 54.79 53.05 2np0 n ASP 1029Cb 0.22 -0.28 -0.07 0.00 -0.72 0.00 0.00 41.12 40.27 2np0 n ASP 1029CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2np0 s ILE 1030N -1.55 2.07 0.00 5.18 -4.36 -1.24 -5.05 121.20 116.25 2np0 s ILE 1030Ca 0.06 -1.72 0.00 0.00 -0.26 0.00 0.00 60.65 58.72 2np0 s ILE 1030Cb 0.04 -2.79 0.00 0.00 1.25 0.00 0.00 42.46 40.95 2np0 s ILE 1030CO 0.03 0.00 0.00 0.54 0.24 0.00 0.00 174.94 175.75 2np0 n ARG 1031N -1.29 3.40 -1.62 0.37 5.12 -1.26 -5.04 116.66 116.34 2np0 n ARG 1031Ca -0.03 0.00 -0.52 0.00 -1.93 0.00 0.00 57.85 55.37 2np0 n ARG 1031Cb 0.65 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.89 2np0 n ARG 1031CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 2np0 n GLU 1032N 0.00 1.30 -4.32 5.56 2.13 -1.26 -4.80 120.64 119.24 2np0 n GLU 1032Ca 0.00 0.47 -0.34 0.00 0.66 0.00 0.00 57.16 57.95 2np0 n GLU 1032Cb 0.00 -2.14 -0.14 0.00 0.27 0.00 0.00 31.44 29.43 2np0 n GLU 1032CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2np0 s VAL 1033N 1.02 3.13 -0.56 6.31 1.01 -0.60 -0.76 120.40 129.94 2np0 s VAL 1033Ca 0.86 -0.60 -0.26 0.00 0.00 0.00 0.00 61.98 61.98 2np0 s VAL 1033Cb -0.93 -2.37 0.04 0.00 0.00 0.00 0.00 36.38 33.12 2np0 s VAL 1033CO 0.48 0.48 1.04 -0.63 0.00 0.00 0.00 175.10 176.48 2np0 s ILE 1034N 0.92 4.24 -0.21 2.22 1.01 -1.26 -4.75 121.20 123.37 2np0 s ILE 1034Ca -0.02 0.53 0.15 0.00 0.00 0.00 0.00 60.65 61.32 2np0 s ILE 1034Cb -0.15 -4.62 0.66 0.00 0.01 0.00 0.00 42.46 38.36 2np0 s ILE 1034CO -0.00 -1.21 1.57 0.00 0.00 0.00 0.00 174.94 175.30 2np0 n ALA 1035N 7.86 3.40 -0.85 9.38 0.00 -1.26 -3.57 120.51 135.47 2np0 n ALA 1035Ca 0.04 -2.16 0.08 0.00 0.00 0.00 0.00 53.44 51.40 2np0 n ALA 1035Cb 0.48 -0.89 0.21 0.00 0.00 0.00 0.00 19.45 19.25 2np0 n ALA 1035CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2np0 n ASN 1036N -0.04 3.38 -4.39 0.00 0.23 -1.26 -5.02 115.26 108.15 2np0 n ASN 1036Ca 0.24 -2.84 -0.29 0.00 -0.53 0.00 0.00 54.58 51.16 2np0 n ASN 1036Cb 1.03 -0.45 0.21 0.00 -2.08 0.00 0.00 39.78 38.49 2np0 n ASN 1036CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 2np0 s GLY 1037N -1.94 1.55 0.53 4.83 0.00 -1.26 -4.75 107.32 106.28 2np0 s GLY 1037Ca 0.36 -0.49 -0.22 0.00 0.00 0.00 0.00 44.72 44.37 2np0 s GLY 1037CO 0.08 0.24 1.22 1.18 0.00 0.00 0.00 173.10 175.82 2np0 n GLU 1038N -4.56 1.51 -3.60 2.90 1.02 -1.26 -4.52 120.64 112.13 2np0 n GLU 1038Ca 0.07 0.56 -0.37 0.00 -0.02 0.00 0.00 57.16 57.39 2np0 n GLU 1038Cb 0.57 -2.40 -0.09 0.00 -0.02 0.00 0.00 31.44 29.51 2np0 n GLU 1038CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2np0 s ILE 1039N -1.32 5.33 -0.24 -3.67 1.01 -0.45 -4.05 121.20 117.80 2np0 s ILE 1039Ca 0.70 0.32 -0.01 0.00 0.00 0.00 0.00 60.65 61.66 2np0 s ILE 1039Cb -0.45 -3.56 0.03 0.00 0.01 0.00 0.00 42.46 38.50 2np0 s ILE 1039CO 0.51 0.34 -0.09 -0.63 0.00 0.00 0.00 174.94 175.07 2np0 s ILE 1040N 1.00 2.67 -0.38 2.92 -1.09 -0.17 -0.93 121.20 125.22 2np0 s ILE 1040Ca 0.11 -1.10 -0.19 0.00 -2.23 0.00 0.00 60.65 57.23 2np0 s ILE 1040Cb -0.13 -2.36 0.01 0.00 -1.58 0.00 0.00 42.46 38.40 2np0 s ILE 1040CO 0.04 0.21 0.56 -0.36 -1.23 0.00 0.00 174.94 174.17 2np0 s PHE 1041N 1.29 3.14 -0.29 3.97 0.40 -0.41 -0.97 117.98 125.11 2np0 s PHE 1041Ca -0.01 0.08 -0.24 0.00 -0.60 0.00 0.00 56.93 56.17 2np0 s PHE 1041Cb -0.17 -3.08 0.17 0.00 0.51 0.00 0.00 43.02 40.45 2np0 s PHE 1041CO -0.06 -0.67 1.29 0.21 0.70 0.00 0.00 175.22 176.70 2np0 s LYS 1042N 2.55 0.20 -0.09 0.44 2.20 0.32 -1.27 119.74 124.09 2np0 s LYS 1042Ca 0.20 0.25 -0.30 0.00 -0.36 0.00 0.00 55.97 55.76 2np0 s LYS 1042Cb -0.15 0.09 -0.03 0.00 -1.51 0.00 0.00 37.83 36.23 2np0 s LYS 1042CO 0.15 -0.03 1.25 -0.51 -0.36 0.00 0.00 175.35 175.86 2np0 s LEU 1043N 0.23 4.25 -0.27 5.43 1.43 -1.26 -3.98 118.68 124.51 2np0 s LEU 1043Ca 0.04 1.81 -0.04 0.00 -1.03 0.00 0.00 54.13 54.91 2np0 s LEU 1043Cb -0.05 -3.55 0.09 0.00 0.03 0.00 0.00 46.19 42.72 2np0 s LEU 1043CO -0.13 -0.67 0.12 -0.62 0.23 0.00 0.00 176.35 175.28 2np0 s ASP 1044N 1.75 3.42 0.00 2.29 2.15 -0.22 -4.96 116.67 121.09 2np0 s ASP 1044Ca 0.57 -1.23 0.00 0.00 0.43 0.00 0.00 52.55 52.32 2np0 s ASP 1044Cb -0.24 -0.40 0.00 0.00 -0.30 0.00 0.00 42.92 41.98 2np0 s ASP 1044CO 0.20 -0.42 0.00 0.61 -0.17 0.00 0.00 175.17 175.39 2np0 n GLY 1045N 5.20 1.59 3.15 2.66 0.00 -1.26 -0.09 105.19 116.44 2np0 n GLY 1045Ca -0.06 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 2np0 n GLY 1045CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2np0 s ASP 1046N 2.00 5.45 0.07 1.61 2.15 -1.26 -5.04 116.67 121.66 2np0 s ASP 1046Ca 0.00 -2.26 0.01 0.00 0.43 0.00 0.00 52.55 50.73 2np0 s ASP 1046Cb 0.00 -1.91 -0.04 0.00 -0.30 0.00 0.00 42.92 40.67 2np0 s ASP 1046CO 0.00 -0.54 -0.05 0.27 -0.17 0.00 0.00 175.17 174.68 2np0 s ILE 1047N 0.83 0.47 0.71 4.11 -5.25 -1.26 -4.87 121.20 115.94 2np0 s ILE 1047Ca 0.10 -1.77 -0.15 0.00 -0.99 0.00 0.00 60.65 57.84 2np0 s ILE 1047Cb -0.22 -1.47 0.03 0.00 2.95 0.00 0.00 42.46 43.74 2np0 s ILE 1047CO -0.03 -0.87 1.16 -1.81 -1.79 0.00 0.00 174.94 171.60 2np0 s ASP 1048N -2.81 4.55 0.28 4.36 -0.00 -1.26 -4.90 116.67 116.88 2np0 s ASP 1048Ca 0.07 2.17 0.00 0.00 -0.00 0.00 0.00 52.55 54.79 2np0 s ASP 1048Cb 0.04 -2.57 0.65 0.00 -0.00 0.00 0.00 42.92 41.05 2np0 s ASP 1048CO -0.06 -2.01 1.66 -0.09 -0.00 0.00 0.00 175.17 174.66 2np0 h ARG 1049N -0.26 0.23 0.00 8.23 1.12 -2.01 -1.86 114.38 119.84 2np0 h ARG 1049Ca -0.47 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.39 2np0 h ARG 1049Cb 1.27 -0.05 0.00 0.00 -0.01 0.00 0.00 29.97 31.18 2np0 h ARG 1049CO 0.51 0.15 0.00 0.25 -3.11 0.00 0.00 179.97 177.78 2np0 n THR 1050N -5.20 1.01 -2.34 0.20 -2.24 -1.26 -4.42 114.28 100.04 2np0 n THR 1050Ca 0.20 0.44 -0.41 0.00 -2.27 0.00 0.00 64.05 62.00 2np0 n THR 1050Cb 0.62 -1.38 -0.03 0.00 -2.10 0.00 0.00 70.33 67.44 2np0 n THR 1050CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2np0 s GLN 1051N -3.35 4.46 0.23 -0.78 2.00 -0.70 -5.01 119.66 116.52 2np0 s GLN 1051Ca 0.02 1.91 -0.14 0.00 -2.00 0.00 0.00 55.36 55.15 2np0 s GLN 1051Cb 0.07 -3.24 0.00 0.00 0.80 0.00 0.00 33.01 30.65 2np0 s GLN 1051CO 0.28 -0.14 0.49 -0.59 -0.50 0.00 0.00 175.29 174.83 2np0 s PHE 1052N 0.10 0.22 -0.04 1.67 -0.12 -1.26 -3.36 117.98 115.18 2np0 s PHE 1052Ca 0.54 -0.59 -0.07 0.00 -0.05 0.00 0.00 56.93 56.76 2np0 s PHE 1052Cb -0.33 0.25 0.01 0.00 -0.63 0.00 0.00 43.02 42.32 2np0 s PHE 1052CO 0.36 -0.97 0.18 0.42 -0.05 0.00 0.00 175.22 175.16 2np0 s ILE 1053N -3.98 0.03 -0.07 -4.49 -1.09 -0.23 -4.42 121.20 106.96 2np0 s ILE 1053Ca 0.18 -0.25 0.02 0.00 -2.23 0.00 0.00 60.65 58.37 2np0 s ILE 1053Cb -0.01 -0.34 -0.03 0.00 -1.58 0.00 0.00 42.46 40.50 2np0 s ILE 1053CO 0.06 -0.14 -0.11 0.26 -1.23 0.00 0.00 174.94 173.78 2np0 s TRP 1054N -0.46 2.81 0.09 3.97 0.52 -1.09 -0.53 118.94 124.25 2np0 s TRP 1054Ca -0.06 -0.14 0.03 0.00 0.02 0.00 0.00 56.10 55.96 2np0 s TRP 1054Cb -0.04 -1.69 -0.04 0.00 -1.15 0.00 0.00 33.47 30.56 2np0 s TRP 1054CO 0.01 0.20 -0.09 -1.64 0.02 0.00 0.00 176.95 175.45 2np0 s MET 1055N -0.63 0.80 0.08 4.98 -1.94 0.37 -1.07 119.30 121.89 2np0 s MET 1055Ca 0.09 -1.16 -0.09 0.00 -1.71 0.00 0.00 55.69 52.82 2np0 s MET 1055Cb -0.11 -0.40 -0.00 0.00 2.01 0.00 0.00 34.83 36.32 2np0 s MET 1055CO 0.01 0.05 0.18 -1.59 -0.01 0.00 0.00 175.02 173.66 2np0 s LYS 1056N -2.97 0.81 -1.33 2.03 -2.85 -0.84 -0.44 119.74 114.16 2np0 s LYS 1056Ca 0.06 -0.92 -0.02 0.00 -1.00 0.00 0.00 55.97 54.09 2np0 s LYS 1056Cb -0.01 0.33 0.01 0.00 -2.06 0.00 0.00 37.83 36.10 2np0 s LYS 1056CO -0.01 -0.25 0.77 0.66 0.10 0.00 0.00 175.35 176.61 2np0 n TYR 1057N 0.07 -2.00 -2.42 1.78 0.53 -1.26 -1.48 117.16 112.36 2np0 n TYR 1057Ca -0.16 0.86 -0.42 0.00 -1.02 0.00 0.00 57.90 57.16 2np0 n TYR 1057Cb 0.62 -4.41 -0.03 0.00 -1.03 0.00 0.00 39.34 34.49 2np0 n TYR 1057CO 0.00 0.00 0.00 0.12 -1.02 0.00 0.00 176.86 175.96 2np0 s PHE 1058N -3.59 3.44 0.10 -0.72 5.36 -1.26 -4.16 117.98 117.14 2np0 s PHE 1058Ca 0.10 1.31 -0.11 0.00 -0.96 0.00 0.00 56.93 57.27 2np0 s PHE 1058Cb -0.05 -3.42 0.01 0.00 -0.34 0.00 0.00 43.02 39.22 2np0 s PHE 1058CO 0.81 -1.26 0.25 -1.54 -1.46 0.00 0.00 175.22 172.01 2np0 s SER 1059N 1.04 0.02 -0.05 6.13 1.04 0.25 -2.20 113.70 119.94 2np0 s SER 1059Ca 0.59 -0.55 0.02 0.00 0.48 0.00 0.00 55.95 56.49 2np0 s SER 1059Cb -0.29 0.37 0.01 0.00 0.10 0.00 0.00 66.02 66.21 2np0 s SER 1059CO 0.29 -0.75 -0.10 -0.63 0.98 0.00 0.00 173.24 173.03 2np0 s ILE 1060N -3.78 0.93 -0.08 -1.02 1.01 0.19 -1.19 121.20 117.26 2np0 s ILE 1060Ca 0.04 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.30 2np0 s ILE 1060Cb 0.04 -0.85 -0.03 0.00 0.01 0.00 0.00 42.46 41.63 2np0 s ILE 1060CO -0.11 0.30 -0.07 -0.36 0.00 0.00 0.00 174.94 174.70 2np0 s PHE 1061N 0.48 2.93 -0.09 3.97 0.40 0.24 -0.29 117.98 125.63 2np0 s PHE 1061Ca -0.09 -0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.18 2np0 s PHE 1061Cb -0.13 -1.75 0.11 0.00 0.51 0.00 0.00 43.02 41.77 2np0 s PHE 1061CO 0.02 0.24 1.30 0.27 0.70 0.00 0.00 175.22 177.75 2np0 n ASN 1062N 2.48 3.57 -3.88 1.36 6.94 0.30 -1.14 115.26 124.89 2np0 n ASN 1062Ca -0.18 -2.35 -0.09 0.00 -0.02 0.00 0.00 54.58 51.94 2np0 n ASN 1062Cb 0.53 -0.65 -0.05 0.00 -2.36 0.00 0.00 39.78 37.25 2np0 n ASN 1062CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2np0 s THR 1063N -0.63 0.03 -0.23 5.53 -1.32 -1.04 -4.65 115.64 113.33 2np0 s THR 1063Ca 0.10 -1.13 -0.29 0.00 -1.21 0.00 0.00 61.69 59.16 2np0 s THR 1063Cb 0.09 -1.86 0.00 0.00 -1.51 0.00 0.00 72.50 69.22 2np0 s THR 1063CO 0.02 -0.11 1.11 -0.70 -2.21 0.00 0.00 174.62 172.73 2np0 s GLU 1064N -3.94 4.21 0.30 7.08 2.12 -1.26 -2.09 118.70 125.13 2np0 s GLU 1064Ca 0.15 1.40 -0.29 0.00 0.36 0.00 0.00 54.97 56.59 2np0 s GLU 1064Cb -0.00 -3.70 -0.09 0.00 0.26 0.00 0.00 34.13 30.60 2np0 s GLU 1064CO 0.02 -0.71 1.10 -0.51 -0.54 0.00 0.00 175.26 174.63 2np0 s LEU 1065N 3.39 4.48 0.73 2.70 1.43 -1.26 -5.01 118.68 125.14 2np0 s LEU 1065Ca 0.47 2.26 -0.10 0.00 -1.03 0.00 0.00 54.13 55.73 2np0 s LEU 1065Cb -0.16 -3.72 0.05 0.00 0.03 0.00 0.00 46.19 42.39 2np0 s LEU 1065CO 0.10 -0.22 1.09 -0.94 0.23 0.00 0.00 176.35 176.60 2np0 s SER 1066N -0.97 4.94 0.16 2.29 1.04 -1.26 -4.88 113.70 115.01 2np0 s SER 1066Ca 0.47 0.78 -0.21 0.00 0.48 0.00 0.00 55.95 57.47 2np0 s SER 1066Cb -0.31 -1.44 0.05 0.00 0.10 0.00 0.00 66.02 64.42 2np0 s SER 1066CO 0.40 -1.59 1.64 -0.61 0.98 0.00 0.00 173.24 174.06 2np0 h GLN 1067N -0.74 -0.16 -0.27 4.02 -0.00 -1.96 -0.97 115.11 115.03 2np0 h GLN 1067Ca -0.45 0.01 0.07 0.00 -0.00 0.00 0.00 58.65 58.27 2np0 h GLN 1067Cb 1.30 0.04 -0.07 0.00 0.00 0.00 0.00 27.48 28.74 2np0 h GLN 1067CO 0.63 -0.11 -0.21 0.77 0.00 0.00 0.00 178.83 179.92 2np0 h SER 1068N -0.16 -0.70 -0.78 -0.69 0.02 -1.94 0.72 113.55 110.03 2np0 h SER 1068Ca 0.16 0.14 0.15 0.00 -0.84 0.00 0.00 61.79 61.39 2np0 h SER 1068Cb 0.40 0.34 -0.10 0.00 0.14 0.00 0.00 62.40 63.19 2np0 h SER 1068CO -0.39 -0.25 0.31 0.78 -1.14 0.00 0.00 176.83 176.14 2np0 h ASN 1069N -0.20 0.29 -0.07 3.07 -0.26 -1.72 0.24 115.58 116.92 2np0 h ASN 1069Ca 0.15 0.11 -0.12 0.00 -0.56 0.00 0.00 56.30 55.88 2np0 h ASN 1069Cb 0.43 0.09 0.01 0.00 -1.06 0.00 0.00 38.32 37.79 2np0 h ASN 1069CO -0.39 0.09 -0.42 0.40 -1.06 0.00 0.00 177.43 176.05 2np0 h ILE 1070N 0.44 1.41 -1.00 2.81 2.04 0.26 -1.64 117.51 121.83 2np0 h ILE 1070Ca 0.43 -1.81 0.05 0.00 1.00 0.00 0.00 64.86 64.53 2np0 h ILE 1070Cb 0.68 2.33 -0.06 0.00 -0.74 0.00 0.00 36.82 39.03 2np0 h ILE 1070CO -0.42 0.53 0.65 -0.08 0.00 0.00 0.00 178.15 178.83 2np0 h GLU 1071N -0.06 1.18 0.01 2.37 4.81 -0.66 -0.37 114.58 121.85 2np0 h GLU 1071Ca -0.03 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 59.13 2np0 h GLU 1071Cb 1.08 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 2np0 h GLU 1071CO 0.09 0.78 -0.04 0.93 -0.73 0.00 0.00 179.01 180.04 2np0 h GLU 1072N 1.21 -0.07 -0.81 1.92 5.08 -0.73 -1.67 114.58 119.51 2np0 h GLU 1072Ca 0.42 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.76 2np0 h GLU 1072Cb 0.10 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.33 2np0 h GLU 1072CO -0.15 -0.05 0.40 -0.09 -1.00 0.00 0.00 179.01 178.12 2np0 h ARG 1073N -0.07 1.15 0.14 2.33 2.43 -0.82 0.31 114.38 119.84 2np0 h ARG 1073Ca 0.01 -0.16 0.01 0.00 -0.81 0.00 0.00 59.98 59.03 2np0 h ARG 1073Cb 0.09 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 2np0 h ARG 1073CO -0.04 0.87 -0.15 -0.92 -1.51 0.00 0.00 179.97 178.23 2np0 h TYR 1074N 1.14 -0.39 -0.40 2.20 3.20 -0.95 0.36 116.97 122.12 2np0 h TYR 1074Ca 0.28 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.15 2np0 h TYR 1074Cb 0.10 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 2np0 h TYR 1074CO 0.01 -0.23 0.22 0.87 -1.64 0.00 0.00 178.16 177.39 2np0 h LYS 1075N -0.32 0.55 0.22 1.82 1.57 -0.62 -0.91 116.57 118.88 2np0 h LYS 1075Ca 0.01 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2np0 h LYS 1075Cb 0.32 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 2np0 h LYS 1075CO -0.05 0.44 -0.14 0.82 -0.57 0.00 0.00 179.45 179.95 2np0 h ILE 1076N 0.52 0.71 0.00 1.86 2.04 -0.12 -2.43 117.51 120.09 2np0 h ILE 1076Ca 0.14 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.00 2np0 h ILE 1076Cb 0.05 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2np0 h ILE 1076CO -0.02 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.13 2np0 n GLN 1077N -5.25 0.08 0.07 2.37 6.02 0.12 -2.18 117.38 118.61 2np0 n GLN 1077Ca -0.09 0.12 0.12 0.00 -0.01 0.00 0.00 57.00 57.15 2np0 n GLN 1077Cb 0.17 -1.50 0.29 0.00 1.02 0.00 0.00 30.24 30.22 2np0 n GLN 1077CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2np0 n SER 1078N -1.44 0.71 -4.77 1.08 7.64 -0.37 -4.95 113.62 111.51 2np0 n SER 1078Ca 0.07 0.30 -0.38 0.00 1.01 0.00 0.00 58.87 59.87 2np0 n SER 1078Cb 0.23 -0.25 -0.05 0.00 -1.01 0.00 0.00 64.21 63.13 2np0 n SER 1078CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2np0 s TYR 1079N -3.12 3.53 -0.15 1.43 5.04 -0.93 -4.94 117.35 118.21 2np0 s TYR 1079Ca 0.09 1.72 -0.20 0.00 -2.44 0.00 0.00 57.07 56.24 2np0 s TYR 1079Cb 0.13 -3.12 0.05 0.00 0.35 0.00 0.00 41.96 39.38 2np0 s TYR 1079CO 0.66 -0.31 0.52 -1.12 -1.34 0.00 0.00 175.55 173.96 2np0 s SER 1080N -1.32 -0.52 0.23 4.32 0.01 -1.26 -5.02 113.70 110.15 2np0 s SER 1080Ca 0.50 0.86 -0.03 0.00 1.31 0.00 0.00 55.95 58.59 2np0 s SER 1080Cb -0.25 0.88 0.25 0.00 0.21 0.00 0.00 66.02 67.11 2np0 s SER 1080CO 0.32 -0.30 1.68 -0.33 0.41 0.00 0.00 173.24 175.01 2np0 h GLU 1081N 4.67 0.75 -7.10 12.44 5.08 -1.97 -3.44 114.58 125.01 2np0 h GLU 1081Ca -0.28 -0.27 -0.49 0.00 -1.00 0.00 0.00 59.36 57.32 2np0 h GLU 1081Cb 1.17 -0.05 0.03 0.00 0.50 0.00 0.00 28.75 30.39 2np0 h GLU 1081CO 0.24 0.87 0.27 1.52 -1.00 0.00 0.00 179.01 180.91 2np0 s TYR 1082N -4.71 3.53 0.70 4.33 -0.85 -1.26 -3.52 117.35 115.56 2np0 s TYR 1082Ca -0.09 1.19 -0.08 0.00 -0.52 0.00 0.00 57.07 57.57 2np0 s TYR 1082Cb 0.14 -2.59 0.04 0.00 0.38 0.00 0.00 41.96 39.93 2np0 s TYR 1082CO 0.82 -0.38 1.03 -0.51 -1.52 0.00 0.00 175.55 175.00 2np0 s LEU 1083N -4.45 2.87 0.18 -3.49 1.43 -0.79 -4.86 118.68 109.57 2np0 s LEU 1083Ca 0.54 0.69 0.09 0.00 -1.03 0.00 0.00 54.13 54.42 2np0 s LEU 1083Cb -0.10 -3.38 -0.04 0.00 0.03 0.00 0.00 46.19 42.70 2np0 s LEU 1083CO 0.40 -1.48 -0.20 -0.54 0.23 0.00 0.00 176.35 174.76 2np0 s LYS 1084N -5.26 1.37 0.73 1.70 1.02 -1.26 -0.99 119.74 117.05 2np0 s LYS 1084Ca 0.59 -1.48 -0.08 0.00 0.02 0.00 0.00 55.97 55.02 2np0 s LYS 1084Cb -0.11 -1.48 0.16 0.00 -0.52 0.00 0.00 37.83 35.88 2np0 s LYS 1084CO 0.47 0.30 0.99 -0.40 -0.92 0.00 0.00 175.35 175.79 2np0 n ASP 1085N 0.17 0.52 -0.21 2.83 5.68 0.27 -4.60 116.55 121.22 2np0 n ASP 1085Ca -0.12 -1.63 0.03 0.00 -0.50 0.00 0.00 54.79 52.57 2np0 n ASP 1085Cb 0.57 -0.72 0.28 0.00 -1.14 0.00 0.00 41.12 40.12 2np0 n ASP 1085CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 2np0 h PHE 1086N -1.19 0.89 -0.00 2.11 3.57 -1.01 -0.99 116.94 120.32 2np0 h PHE 1086Ca -0.32 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.20 2np0 h PHE 1086Cb 1.00 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.44 2np0 h PHE 1086CO 0.00 0.52 -0.04 0.91 -2.23 0.00 0.00 178.31 177.48 2np0 n TRP 1087N -4.45 0.00 -0.09 0.41 7.02 -1.26 -4.87 117.44 114.20 2np0 n TRP 1087Ca 0.09 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.57 2np0 n TRP 1087Cb 0.11 -0.35 0.00 0.00 -2.42 0.00 0.00 31.31 28.65 2np0 n TRP 1087CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2np0 n GLY 1088N 1.37 0.51 3.85 6.99 0.00 -0.37 -1.80 105.19 115.74 2np0 n GLY 1088Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2np0 n GLY 1088CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2np0 s ASN 1089N -2.80 5.72 0.32 1.61 0.01 -1.26 -4.71 114.94 113.83 2np0 s ASN 1089Ca 0.00 1.42 -0.29 0.00 -0.71 0.00 0.00 52.86 53.27 2np0 s ASN 1089Cb 0.00 -2.35 -0.12 0.00 0.41 0.00 0.00 41.25 39.19 2np0 s ASN 1089CO 0.00 -1.20 1.46 -2.65 -1.51 0.00 0.00 177.10 173.20 2np0 n PRO 1090N -2.95 2.44 -2.62 -0.60 -0.02 -1.26 0.98 135.00 130.96 2np0 n PRO 1090Ca 0.07 0.86 -0.39 0.00 -2.02 0.00 0.00 63.50 62.02 2np0 n PRO 1090Cb 0.55 -2.56 -0.05 0.00 -0.02 0.00 0.00 33.50 31.42 2np0 n PRO 1090CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2np0 s LEU 1091N -0.96 4.46 0.05 2.45 2.96 -0.16 -4.45 118.68 123.04 2np0 s LEU 1091Ca 0.59 2.06 0.03 0.00 -0.22 0.00 0.00 54.13 56.60 2np0 s LEU 1091Cb -0.53 -3.80 -0.03 0.00 0.50 0.00 0.00 46.19 42.33 2np0 s LEU 1091CO 0.57 -0.11 -0.10 -0.04 -1.32 0.00 0.00 176.35 175.35 2np0 s MET 1092N -1.68 0.62 0.57 1.98 -1.94 -1.26 -1.45 119.30 116.15 2np0 s MET 1092Ca 0.47 -0.84 -0.09 0.00 -1.71 0.00 0.00 55.69 53.52 2np0 s MET 1092Cb -0.26 -0.44 -0.04 0.00 2.01 0.00 0.00 34.83 36.10 2np0 s MET 1092CO 0.33 0.08 0.95 0.71 -0.01 0.00 0.00 175.02 177.08 2np0 s TYR 1093N -1.45 3.61 -1.50 -0.03 1.51 0.23 -4.29 117.35 115.43 2np0 s TYR 1093Ca -0.07 1.13 -0.06 0.00 -1.01 0.00 0.00 57.07 57.06 2np0 s TYR 1093Cb -0.09 -2.58 0.02 0.00 -0.11 0.00 0.00 41.96 39.19 2np0 s TYR 1093CO 0.01 -0.55 0.76 0.09 -1.11 0.00 0.00 175.55 174.74 2np0 n ASN 1094N -2.58 -5.97 -3.81 2.29 3.02 -0.37 -4.96 115.26 102.88 2np0 n ASN 1094Ca 0.04 -0.38 -0.17 0.00 -0.03 0.00 0.00 54.58 54.04 2np0 n ASN 1094Cb 0.54 -4.79 -0.16 0.00 -0.61 0.00 0.00 39.78 34.76 2np0 n ASN 1094CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2np0 s LYS 1095N -5.92 0.30 0.18 3.52 2.20 -1.26 -5.01 119.74 113.75 2np0 s LYS 1095Ca 0.40 0.09 -0.32 0.00 -0.36 0.00 0.00 55.97 55.78 2np0 s LYS 1095Cb -0.18 -0.51 -0.11 0.00 -1.51 0.00 0.00 37.83 35.52 2np0 s LYS 1095CO 0.49 -0.15 1.66 -1.21 -0.36 0.00 0.00 175.35 175.77 2np0 s GLU 1096N 1.12 4.17 -0.02 4.03 2.02 -1.26 -4.42 118.70 124.34 2np0 s GLU 1096Ca -0.08 2.49 0.01 0.00 0.02 0.00 0.00 54.97 57.41 2np0 s GLU 1096Cb -0.13 -3.14 0.01 0.00 0.10 0.00 0.00 34.13 30.96 2np0 s GLU 1096CO -0.02 -0.69 -0.04 0.71 0.02 0.00 0.00 175.26 175.24 2np0 s TYR 1097N 1.24 0.50 0.55 1.61 4.12 0.86 -4.41 117.35 121.83 2np0 s TYR 1097Ca 0.73 -0.10 -0.12 0.00 0.02 0.00 0.00 57.07 57.60 2np0 s TYR 1097Cb -0.47 -0.39 -0.05 0.00 -1.52 0.00 0.00 41.96 39.53 2np0 s TYR 1097CO 0.32 -0.06 0.97 0.71 0.02 0.00 0.00 175.55 177.50 2np0 s TYR 1098N 0.24 3.56 -0.08 2.71 1.51 0.62 -0.13 117.35 125.78 2np0 s TYR 1098Ca -0.02 1.27 0.01 0.00 -1.01 0.00 0.00 57.07 57.32 2np0 s TYR 1098Cb -0.06 -2.67 -0.03 0.00 -0.11 0.00 0.00 41.96 39.09 2np0 s TYR 1098CO -0.00 -0.50 -0.10 -1.64 -1.11 0.00 0.00 175.55 172.20 2np0 s MET 1099N -4.69 2.84 0.01 -0.62 -1.94 -1.26 -0.79 119.30 112.84 2np0 s MET 1099Ca 0.55 -0.62 0.05 0.00 -1.71 0.00 0.00 55.69 53.96 2np0 s MET 1099Cb -0.11 -2.55 -0.02 0.00 2.01 0.00 0.00 34.83 34.17 2np0 s MET 1099CO 0.44 0.54 -0.16 0.12 -0.01 0.00 0.00 175.02 175.96 2np0 s PHE 1100N -0.50 1.41 -0.20 -0.03 5.36 0.41 -4.71 117.98 119.71 2np0 s PHE 1100Ca 0.07 -0.30 0.01 0.00 -0.96 0.00 0.00 56.93 55.75 2np0 s PHE 1100Cb -0.12 -0.88 0.03 0.00 -0.34 0.00 0.00 43.02 41.71 2np0 s PHE 1100CO 0.02 0.01 -0.17 1.21 -1.46 0.00 0.00 175.22 174.83 2np0 s ASN 1101N -0.66 3.55 0.55 6.13 3.84 -1.26 0.29 114.94 127.38 2np0 s ASN 1101Ca 0.05 -0.84 0.29 0.00 0.21 0.00 0.00 52.86 52.56 2np0 s ASN 1101Cb -0.07 -1.51 1.60 0.00 -0.55 0.00 0.00 41.25 40.72 2np0 s ASN 1101CO 0.00 -0.05 2.14 0.00 -2.79 0.00 0.00 177.10 176.40 2np0 h ALA 1102N 7.91 1.36 0.00 1.71 0.00 -1.08 -2.06 119.26 127.09 2np0 h ALA 1102Ca -0.38 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2np0 h ALA 1102Cb 1.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2np0 h ALA 1102CO 0.59 0.09 -0.58 0.78 0.00 0.00 0.00 179.25 180.14 2np0 h GLY 1103N 0.54 0.00 -6.36 0.00 0.00 -1.65 -3.40 103.07 92.20 2np0 h GLY 1103Ca -0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 2np0 h GLY 1103CO 0.01 0.00 -0.96 0.70 0.00 0.00 0.00 176.54 176.29 2np0 n ASN 1104N -2.65 -0.03 -0.22 0.19 4.13 -0.79 -4.85 115.26 111.04 2np0 n ASN 1104Ca 0.02 -2.51 -0.01 0.00 1.68 0.00 0.00 54.58 53.76 2np0 n ASN 1104Cb 0.51 -0.58 0.10 0.00 -1.54 0.00 0.00 39.78 38.27 2np0 n ASN 1104CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 2np0 h LYS 1105N 5.33 0.57 -0.91 3.52 1.57 -1.73 -1.69 116.57 123.23 2np0 h LYS 1105Ca 0.23 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.84 2np0 h LYS 1105Cb 0.89 -0.13 -0.08 0.00 0.08 0.00 0.00 32.23 32.99 2np0 h LYS 1105CO 0.42 0.38 0.17 0.09 -0.57 0.00 0.00 179.45 179.94 2np0 n ASN 1106N -4.86 3.32 -4.29 0.86 3.02 -1.26 -4.73 115.26 107.31 2np0 n ASN 1106Ca 0.08 -2.62 -0.29 0.00 -0.03 0.00 0.00 54.58 51.73 2np0 n ASN 1106Cb 0.21 -0.63 -0.15 0.00 -0.61 0.00 0.00 39.78 38.60 2np0 n ASN 1106CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2np0 s SER 1107N -0.22 2.84 0.04 6.41 0.01 -0.63 -1.16 113.70 120.98 2np0 s SER 1107Ca 0.27 -0.52 -0.03 0.00 1.31 0.00 0.00 55.95 56.98 2np0 s SER 1107Cb 0.21 -0.27 -0.02 0.00 0.21 0.00 0.00 66.02 66.15 2np0 s SER 1107CO 0.06 0.24 0.02 -0.72 0.41 0.00 0.00 173.24 173.26 2np0 s TYR 1108N -0.72 0.32 -0.00 2.43 -0.85 -0.59 -4.55 117.35 113.38 2np0 s TYR 1108Ca 0.10 -0.70 -0.21 0.00 -0.52 0.00 0.00 57.07 55.73 2np0 s TYR 1108Cb -0.09 -0.24 -0.05 0.00 0.38 0.00 0.00 41.96 41.96 2np0 s TYR 1108CO 0.01 -0.33 0.63 0.42 -1.52 0.00 0.00 175.55 174.76 2np0 s ILE 1109N -2.79 4.90 -0.03 -3.49 1.01 -1.26 -0.43 121.20 119.11 2np0 s ILE 1109Ca -0.03 1.32 0.01 0.00 0.00 0.00 0.00 60.65 61.94 2np0 s ILE 1109Cb -0.00 -3.97 0.01 0.00 0.01 0.00 0.00 42.46 38.52 2np0 s ILE 1109CO -0.06 0.39 -0.05 -0.75 0.00 0.00 0.00 174.94 174.48 2np0 s LYS 1110N -0.06 0.72 -0.02 2.79 2.36 0.34 -2.44 119.74 123.43 2np0 s LYS 1110Ca 0.33 -0.14 -0.32 0.00 -2.55 0.00 0.00 55.97 53.28 2np0 s LYS 1110Cb -0.18 -0.73 -0.10 0.00 -1.05 0.00 0.00 37.83 35.77 2np0 s LYS 1110CO 0.18 -0.01 1.93 -0.11 1.55 0.00 0.00 175.35 178.89 2np0 n LEU 1111N 3.68 3.83 -4.72 5.43 7.94 -1.26 -0.68 117.00 131.21 2np0 n LEU 1111Ca -0.22 0.94 -0.38 0.00 -1.11 0.00 0.00 56.01 55.24 2np0 n LEU 1111Cb 0.53 -1.45 0.05 0.00 0.53 0.00 0.00 43.42 43.08 2np0 n LEU 1111CO 0.24 0.08 0.90 1.17 -1.11 0.00 0.00 177.39 178.67 2np0 n LYS 1112N 7.07 1.42 0.00 1.96 4.81 -0.09 -4.86 118.16 128.46 2np0 n LYS 1112Ca 0.21 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 2np0 n LYS 1112Cb 0.35 -2.50 0.00 0.00 0.02 0.00 0.00 35.03 32.90 2np0 n LYS 1112CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2np0 n LYS 1113N -1.25 0.00 0.14 1.64 3.00 -1.26 -3.09 118.16 117.33 2np0 n LYS 1113Ca 0.12 0.30 0.08 0.00 -0.00 0.00 0.00 58.31 58.81 2np0 n LYS 1113Cb 0.46 -1.15 0.42 0.00 0.00 0.00 0.00 35.03 34.76 2np0 n LYS 1113CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2np0 n ASP 1114N -1.39 0.40 -4.34 3.14 5.75 -1.26 -4.85 116.55 114.00 2np0 n ASP 1114Ca 0.00 0.64 -0.18 0.00 -0.01 0.00 0.00 54.79 55.25 2np0 n ASP 1114Cb 0.00 -0.67 -0.10 0.00 -1.03 0.00 0.00 41.12 39.32 2np0 n ASP 1114CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2np0 s SER 1115N -3.65 2.10 -0.75 -1.12 0.01 -1.18 -5.07 113.70 104.04 2np0 s SER 1115Ca -0.02 -1.16 -0.01 0.00 1.31 0.00 0.00 55.95 56.07 2np0 s SER 1115Cb 0.04 -0.05 0.38 0.00 0.21 0.00 0.00 66.02 66.61 2np0 s SER 1115CO 0.14 -0.42 1.91 -0.81 0.41 0.00 0.00 173.24 174.47 2np0 n PRO 1116N -0.42 2.84 -4.16 12.44 -0.04 -1.26 -4.27 135.00 140.13 2np0 n PRO 1116Ca -0.06 -3.60 -0.10 0.00 -0.04 0.00 0.00 63.50 59.70 2np0 n PRO 1116Cb 0.63 -2.27 -0.10 0.00 -0.04 0.00 0.00 33.50 31.72 2np0 n PRO 1116CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2np0 s VAL 1117N -5.06 0.45 -0.37 0.52 -7.23 -1.26 -1.57 120.40 105.88 2np0 s VAL 1117Ca 0.54 -1.91 -0.15 0.00 -1.81 0.00 0.00 61.98 58.65 2np0 s VAL 1117Cb 0.45 -1.82 -0.00 0.00 0.56 0.00 0.00 36.38 35.56 2np0 s VAL 1117CO -0.30 -0.72 0.34 -0.83 -0.31 0.00 0.00 175.10 173.28 2np0 s GLY 1118N -3.05 1.93 0.31 2.32 0.00 -1.26 -0.92 107.32 106.66 2np0 s GLY 1118Ca 0.16 -1.40 -0.09 0.00 0.00 0.00 0.00 44.72 43.38 2np0 s GLY 1118CO -0.03 0.97 0.64 -1.83 0.00 0.00 0.00 173.10 172.85 2np0 s GLU 1119N 1.92 3.77 -0.17 2.90 -1.05 0.14 -0.75 118.70 125.46 2np0 s GLU 1119Ca 0.09 0.30 -0.10 0.00 -0.15 0.00 0.00 54.97 55.11 2np0 s GLU 1119Cb -0.17 -2.55 -0.05 0.00 -0.44 0.00 0.00 34.13 30.92 2np0 s GLU 1119CO 0.12 0.17 0.17 0.42 0.95 0.00 0.00 175.26 177.09 2np0 s ILE 1120N -2.07 5.40 0.47 1.83 -1.09 -0.99 -0.51 121.20 124.25 2np0 s ILE 1120Ca 0.48 0.29 0.02 0.00 -2.23 0.00 0.00 60.65 59.22 2np0 s ILE 1120Cb -0.11 -3.50 -0.03 0.00 -1.58 0.00 0.00 42.46 37.25 2np0 s ILE 1120CO 0.26 0.48 0.03 -0.76 -1.23 0.00 0.00 174.94 173.71 2np0 s LEU 1121N 0.02 2.31 -0.23 2.97 1.43 0.43 -4.81 118.68 120.81 2np0 s LEU 1121Ca 0.12 -1.61 -0.05 0.00 -1.03 0.00 0.00 54.13 51.55 2np0 s LEU 1121Cb -0.12 -0.63 -0.02 0.00 0.03 0.00 0.00 46.19 45.46 2np0 s LEU 1121CO 0.01 -0.81 0.01 -0.89 0.23 0.00 0.00 176.35 174.90 2np0 s THR 1122N -2.93 3.82 0.16 5.49 2.01 -1.26 -1.54 115.64 121.39 2np0 s THR 1122Ca 0.14 -0.34 -0.33 0.00 0.31 0.00 0.00 61.69 61.47 2np0 s THR 1122Cb 0.03 -2.76 -0.16 0.00 0.01 0.00 0.00 72.50 69.63 2np0 s THR 1122CO 0.08 0.39 1.17 0.54 -0.69 0.00 0.00 174.62 176.10 2np0 n ARG 1123N 4.79 1.13 -1.92 4.92 1.74 -0.31 -4.93 116.66 122.08 2np0 n ARG 1123Ca -0.17 0.40 -0.38 0.00 -0.77 0.00 0.00 57.85 56.93 2np0 n ARG 1123Cb 0.51 -1.90 0.03 0.00 -1.02 0.00 0.00 32.46 30.07 2np0 n ARG 1123CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2np0 s SER 1124N 0.02 5.55 0.51 0.55 1.04 -1.26 -4.81 113.70 115.30 2np0 s SER 1124Ca 0.74 2.64 -0.06 0.00 0.48 0.00 0.00 55.95 59.75 2np0 s SER 1124Cb -0.87 -2.63 -0.03 0.00 0.10 0.00 0.00 66.02 62.59 2np0 s SER 1124CO 0.52 -1.37 0.84 -0.54 0.98 0.00 0.00 173.24 173.67 2np0 s LYS 1125N -2.83 3.50 -0.29 4.02 1.02 -1.26 -1.01 119.74 122.88 2np0 s LYS 1125Ca 0.69 0.27 -0.42 0.00 0.02 0.00 0.00 55.97 56.53 2np0 s LYS 1125Cb -0.37 -2.32 -0.17 0.00 -0.52 0.00 0.00 37.83 34.45 2np0 s LYS 1125CO 0.44 -0.31 1.62 0.98 -0.92 0.00 0.00 175.35 177.16 2np0 n TYR 1126N -2.37 1.83 -3.76 3.18 9.36 -0.07 -4.82 117.16 120.50 2np0 n TYR 1126Ca 0.02 0.76 -0.30 0.00 3.32 0.00 0.00 57.90 61.70 2np0 n TYR 1126Cb 0.55 -2.36 -0.10 0.00 -0.63 0.00 0.00 39.34 36.81 2np0 n TYR 1126CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2np0 n ASN 1127N 4.45 3.48 -3.45 2.98 4.13 -1.26 -4.90 115.26 120.68 2np0 n ASN 1127Ca 0.27 -3.24 -0.04 0.00 1.68 0.00 0.00 54.58 53.25 2np0 n ASN 1127Cb 0.07 -0.82 0.01 0.00 -1.54 0.00 0.00 39.78 37.50 2np0 n ASN 1127CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2np0 s GLN 1128N -1.63 1.40 0.52 3.52 -0.21 -1.26 -5.06 119.66 116.94 2np0 s GLN 1128Ca 0.28 -0.86 0.28 0.00 0.02 0.00 0.00 55.36 55.08 2np0 s GLN 1128Cb -0.02 0.42 1.45 0.00 1.00 0.00 0.00 33.01 35.86 2np0 s GLN 1128CO -0.13 -0.65 2.06 -2.95 -2.12 0.00 0.00 175.29 171.50 2np0 h ASN 1129N 2.00 0.00 -3.27 5.90 -1.07 -1.99 -3.46 115.58 113.70 2np0 h ASN 1129Ca -0.27 0.00 -0.53 0.00 0.07 0.00 0.00 56.30 55.58 2np0 h ASN 1129Cb 1.23 0.00 0.02 0.00 -2.07 0.00 0.00 38.32 37.50 2np0 h ASN 1129CO 0.33 0.11 0.65 -0.55 0.07 0.00 0.00 177.43 178.04 2np0 s SER 1130N -6.09 6.92 0.00 6.14 0.15 -1.26 -4.92 113.70 114.65 2np0 s SER 1130Ca -0.02 2.31 0.24 0.00 0.70 0.00 0.00 55.95 59.17 2np0 s SER 1130Cb 0.13 -2.60 0.21 0.00 -1.71 0.00 0.00 66.02 62.05 2np0 s SER 1130CO 0.58 -0.54 1.22 2.29 1.20 0.00 0.00 173.24 177.99 2np0 n LYS 1131N 3.15 0.85 0.05 5.44 2.85 -1.26 -4.09 118.16 125.15 2np0 n LYS 1131Ca 0.08 -0.65 -0.04 0.00 -1.05 0.00 0.00 58.31 56.65 2np0 n LYS 1131Cb 0.43 -1.49 -0.09 0.00 -0.65 0.00 0.00 35.03 33.24 2np0 n LYS 1131CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 177.40 179.23 2np0 h TYR 1132N 1.58 0.00 -3.73 5.58 -1.99 -1.97 -3.48 116.97 112.96 2np0 h TYR 1132Ca 0.00 0.00 -0.38 0.00 2.00 0.00 0.00 58.73 60.35 2np0 h TYR 1132Cb 0.63 0.00 -0.19 0.00 2.00 0.00 0.00 36.73 39.17 2np0 h TYR 1132CO 0.00 0.81 -0.76 0.96 -0.00 0.00 0.00 178.16 179.17 2np0 s ILE 1133N -2.78 1.14 -0.09 -2.88 -4.36 -1.26 -4.58 121.20 106.39 2np0 s ILE 1133Ca -0.00 -1.56 -0.30 0.00 -0.26 0.00 0.00 60.65 58.53 2np0 s ILE 1133Cb 0.09 -1.33 0.07 0.00 1.25 0.00 0.00 42.46 42.53 2np0 s ILE 1133CO 0.80 -0.40 0.68 0.21 0.24 0.00 0.00 174.94 176.47 2np0 s ASN 1134N -2.23 -0.67 0.32 4.36 3.84 -0.40 -4.85 114.94 115.31 2np0 s ASN 1134Ca 0.04 0.86 -0.19 0.00 0.21 0.00 0.00 52.86 53.78 2np0 s ASN 1134Cb -0.06 0.72 0.03 0.00 -0.55 0.00 0.00 41.25 41.40 2np0 s ASN 1134CO 0.02 -0.53 0.75 -0.72 -2.79 0.00 0.00 177.10 173.82 2np0 s TYR 1135N -0.88 -0.06 0.00 0.43 -0.85 -1.26 -2.91 117.35 111.84 2np0 s TYR 1135Ca -0.09 -0.49 0.03 0.00 -0.52 0.00 0.00 57.07 56.00 2np0 s TYR 1135Cb -0.01 0.76 -0.03 0.00 0.38 0.00 0.00 41.96 43.06 2np0 s TYR 1135CO 0.08 -1.38 -0.05 1.03 -1.52 0.00 0.00 175.55 173.71 2np0 s ARG 1136N -3.25 2.60 0.40 -3.49 1.81 -0.58 -0.89 118.95 115.56 2np0 s ARG 1136Ca 0.13 -0.70 -0.26 0.00 -1.72 0.00 0.00 55.73 53.18 2np0 s ARG 1136Cb -0.06 -2.54 -0.09 0.00 -0.45 0.00 0.00 34.95 31.82 2np0 s ARG 1136CO 0.09 0.61 1.31 -0.51 -0.68 0.00 0.00 175.30 176.11 2np0 s ASP 1137N -1.47 6.32 -0.12 0.23 1.01 -0.18 -4.92 116.67 117.54 2np0 s ASP 1137Ca 0.18 2.67 0.08 0.00 0.71 0.00 0.00 52.55 56.18 2np0 s ASP 1137Cb -0.11 -2.64 -0.13 0.00 1.01 0.00 0.00 42.92 41.05 2np0 s ASP 1137CO 0.08 -0.84 -0.00 0.18 0.21 0.00 0.00 175.17 174.79 2np0 n LEU 1138N 0.16 0.79 -3.40 1.23 4.77 -1.26 -4.72 117.00 114.57 2np0 n LEU 1138Ca 0.03 -0.02 -0.40 0.00 -0.03 0.00 0.00 56.01 55.60 2np0 n LEU 1138Cb 0.43 0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 2np0 n LEU 1138CO 0.56 0.40 3.06 -1.22 -1.33 0.00 0.00 177.39 178.87 2np0 n TYR 1139N -2.55 2.55 -4.16 -1.77 4.01 -1.26 -4.85 117.16 109.14 2np0 n TYR 1139Ca -0.20 -3.01 -0.11 0.00 -0.16 0.00 0.00 57.90 54.42 2np0 n TYR 1139Cb 0.84 -2.31 -0.09 0.00 -0.31 0.00 0.00 39.34 37.47 2np0 n TYR 1139CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 2np0 s ILE 1140N 1.31 0.01 0.01 -0.72 -4.36 -1.26 -5.10 121.20 111.08 2np0 s ILE 1140Ca 0.63 -1.88 0.00 0.00 -0.26 0.00 0.00 60.65 59.14 2np0 s ILE 1140Cb 0.18 -2.40 0.00 0.00 1.25 0.00 0.00 42.46 41.49 2np0 s ILE 1140CO -0.07 -0.05 0.00 0.61 0.24 0.00 0.00 174.94 175.67 2np0 n GLY 1141N -0.27 -1.99 3.81 6.27 0.00 -1.26 -4.61 105.19 107.15 2np0 n GLY 1141Ca 0.01 -1.39 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 2np0 n GLY 1141CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2np0 s GLU 1142N -0.13 3.28 -0.58 1.61 0.41 -1.02 -4.98 118.70 117.29 2np0 s GLU 1142Ca 0.00 1.08 -0.20 0.00 -0.41 0.00 0.00 54.97 55.45 2np0 s GLU 1142Cb 0.00 -2.03 0.08 0.00 -1.78 0.00 0.00 34.13 30.40 2np0 s GLU 1142CO 0.00 -0.83 0.74 0.15 -0.49 0.00 0.00 175.26 174.82 2np0 s LYS 1143N -4.41 3.09 0.51 1.61 1.02 -1.26 -4.48 119.74 115.82 2np0 s LYS 1143Ca 0.61 -1.08 -0.05 0.00 0.02 0.00 0.00 55.97 55.48 2np0 s LYS 1143Cb -0.15 -4.21 -0.02 0.00 -0.52 0.00 0.00 37.83 32.94 2np0 s LYS 1143CO 0.42 -1.50 0.81 -0.06 -0.92 0.00 0.00 175.35 174.10 2np0 s PHE 1144N 2.95 3.42 -0.14 3.18 0.40 0.82 -1.80 117.98 126.81 2np0 s PHE 1144Ca 0.15 0.68 -0.13 0.00 -0.60 0.00 0.00 56.93 57.03 2np0 s PHE 1144Cb -0.21 -2.44 0.04 0.00 0.51 0.00 0.00 43.02 40.92 2np0 s PHE 1144CO 0.09 -0.46 0.38 -1.50 0.70 0.00 0.00 175.22 174.43 2np0 s ILE 1145N -2.79 -0.00 -0.24 0.64 2.07 0.35 -0.10 121.20 121.12 2np0 s ILE 1145Ca 0.49 0.01 -0.13 0.00 -1.41 0.00 0.00 60.65 59.62 2np0 s ILE 1145Cb -0.10 -0.54 -0.04 0.00 0.13 0.00 0.00 42.46 41.91 2np0 s ILE 1145CO 0.44 0.00 0.28 -0.63 -1.91 0.00 0.00 174.94 173.12 2np0 s ILE 1146N 0.33 5.27 0.10 2.00 1.01 -1.26 -1.43 121.20 127.21 2np0 s ILE 1146Ca -0.01 0.41 0.07 0.00 0.00 0.00 0.00 60.65 61.12 2np0 s ILE 1146Cb -0.03 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 2np0 s ILE 1146CO -0.01 0.26 -0.09 -0.13 0.00 0.00 0.00 174.94 174.97 2np0 s ARG 1147N 1.46 2.18 -0.04 2.79 1.81 -0.65 -1.24 118.95 125.26 2np0 s ARG 1147Ca 0.12 -1.00 -0.30 0.00 -1.72 0.00 0.00 55.73 52.83 2np0 s ARG 1147Cb -0.15 -2.33 -0.04 0.00 -0.45 0.00 0.00 34.95 31.98 2np0 s ARG 1147CO 0.08 0.51 1.22 1.03 -0.68 0.00 0.00 175.30 177.46 2np0 s ARG 1148N -2.19 4.36 0.29 3.54 0.52 -1.26 -0.90 118.95 123.30 2np0 s ARG 1148Ca 0.22 1.71 0.04 0.00 -0.52 0.00 0.00 55.73 57.17 2np0 s ARG 1148Cb -0.11 -3.54 0.66 0.00 0.52 0.00 0.00 34.95 32.48 2np0 s ARG 1148CO 0.14 -0.44 1.80 -0.22 0.02 0.00 0.00 175.30 176.61 2np0 h LYS 1149N 7.42 0.85 0.00 3.54 3.11 -1.78 -3.41 116.57 126.30 2np0 h LYS 1149Ca -0.35 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.44 2np0 h LYS 1149Cb 1.17 -0.19 0.00 0.00 -1.00 0.00 0.00 32.23 32.21 2np0 h LYS 1149CO 0.87 0.56 0.00 0.43 -2.81 0.00 0.00 179.45 178.50 2np0 n SER 1150N -4.70 0.57 -3.84 4.20 7.64 -1.26 -5.02 113.62 111.22 2np0 n SER 1150Ca 0.21 0.20 -0.38 0.00 1.01 0.00 0.00 58.87 59.92 2np0 n SER 1150Cb 0.47 -0.08 0.03 0.00 -1.01 0.00 0.00 64.21 63.62 2np0 n SER 1150CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2np0 n ASN 1151N -3.30 -4.84 -3.64 6.43 5.15 -1.26 -5.06 115.26 108.75 2np0 n ASN 1151Ca 0.00 -1.13 -0.04 0.00 -0.60 0.00 0.00 54.58 52.81 2np0 n ASN 1151Cb 0.00 -2.72 -0.07 0.00 -0.53 0.00 0.00 39.78 36.47 2np0 n ASN 1151CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2np0 s SER 1152N -3.50 -0.65 0.05 1.20 1.04 -1.26 -4.14 113.70 106.44 2np0 s SER 1152Ca 0.48 1.05 -0.16 0.00 0.48 0.00 0.00 55.95 57.80 2np0 s SER 1152Cb -0.21 1.26 -0.07 0.00 0.10 0.00 0.00 66.02 67.10 2np0 s SER 1152CO 0.91 -0.17 1.25 0.06 0.98 0.00 0.00 173.24 176.27 2np0 h GLN 1153N 6.28 -0.36 0.00 4.02 -0.00 -2.06 -3.52 115.11 119.47 2np0 h GLN 1153Ca -0.29 0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.39 2np0 h GLN 1153Cb 1.20 0.08 0.00 0.00 -0.00 0.00 0.00 27.48 28.77 2np0 h GLN 1153CO 0.18 -0.24 0.00 -1.13 -0.00 0.00 0.00 178.83 177.64 2np0 n SER 1154N -3.81 0.00 -0.40 0.06 3.41 -1.26 -5.11 113.62 106.51 2np0 n SER 1154Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 2np0 n SER 1154Cb 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 2np0 n SER 1154CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2np0 n ILE 1155N 1.15 -0.54 0.00 -1.33 3.06 -1.26 -4.97 119.36 115.47 2np0 n ILE 1155Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 2np0 n ILE 1155Cb 0.00 -1.08 0.00 0.00 0.54 0.00 0.00 39.64 39.10 2np0 n ILE 1155CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 2np0 n ASN 1156N -0.08 0.00 -3.69 9.51 2.85 -1.26 -4.80 115.26 117.78 2np0 n ASN 1156Ca 0.00 0.00 -0.09 0.00 -0.11 0.00 0.00 54.58 54.38 2np0 n ASN 1156Cb 0.00 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 40.99 2np0 n ASN 1156CO 0.00 0.00 0.00 1.51 -2.11 0.00 0.00 177.26 176.66 2np0 s ASP 1157N -2.28 -0.34 -0.26 1.20 3.84 -1.26 -5.08 116.67 112.49 2np0 s ASP 1157Ca 0.00 -0.40 0.11 0.00 -0.00 0.00 0.00 52.55 52.26 2np0 s ASP 1157Cb 0.00 0.63 0.72 0.00 -1.38 0.00 0.00 42.92 42.89 2np0 s ASP 1157CO 0.00 -1.12 1.69 0.47 -0.00 0.00 0.00 175.17 176.21 2np0 n ASP 1158N -0.39 4.95 -4.79 2.11 8.00 -1.26 -4.92 116.55 120.25 2np0 n ASP 1158Ca -0.10 -2.99 -0.38 0.00 0.71 0.00 0.00 54.79 52.02 2np0 n ASP 1158Cb 0.62 -0.70 -0.06 0.00 -0.02 0.00 0.00 41.12 40.96 2np0 n ASP 1158CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2np0 s ILE 1159N -2.70 4.90 0.03 0.53 1.01 -1.26 -0.60 121.20 123.11 2np0 s ILE 1159Ca 0.50 1.10 -0.23 0.00 0.00 0.00 0.00 60.65 62.02 2np0 s ILE 1159Cb 0.39 -3.85 -0.06 0.00 0.01 0.00 0.00 42.46 38.96 2np0 s ILE 1159CO 0.13 0.50 0.71 -0.69 0.00 0.00 0.00 174.94 175.60 2np0 s VAL 1160N -0.68 4.77 0.18 2.92 1.01 -0.53 -4.86 120.40 123.22 2np0 s VAL 1160Ca 0.28 1.51 0.10 0.00 0.00 0.00 0.00 61.98 63.86 2np0 s VAL 1160Cb -0.18 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 2np0 s VAL 1160CO 0.16 0.39 -0.21 -0.13 0.00 0.00 0.00 175.10 175.31 2np0 s ARG 1161N -0.15 1.39 0.42 2.72 0.52 -1.26 -1.89 118.95 120.71 2np0 s ARG 1161Ca 0.36 -1.46 -0.23 0.00 -0.52 0.00 0.00 55.73 53.89 2np0 s ARG 1161Cb -0.20 -1.59 -0.12 0.00 0.52 0.00 0.00 34.95 33.56 2np0 s ARG 1161CO 0.21 0.34 0.69 1.63 0.02 0.00 0.00 175.30 178.19 2np0 n LYS 1162N 0.32 0.79 -0.85 3.54 5.02 -1.23 -1.67 118.16 124.08 2np0 n LYS 1162Ca -0.13 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 2np0 n LYS 1162Cb 0.56 -1.67 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 2np0 n LYS 1162CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2np0 n GLU 1163N 0.41 -0.07 -1.77 1.97 -0.58 0.98 -4.99 120.64 116.60 2np0 n GLU 1163Ca 0.11 0.02 -0.35 0.00 -0.42 0.00 0.00 57.16 56.52 2np0 n GLU 1163Cb 0.39 -3.23 0.06 0.00 -0.57 0.00 0.00 31.44 28.09 2np0 n GLU 1163CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2np0 s ASP 1164N -2.59 4.82 -0.23 1.62 1.11 -0.67 -4.71 116.67 116.00 2np0 s ASP 1164Ca 0.00 2.33 -0.09 0.00 0.18 0.00 0.00 52.55 54.97 2np0 s ASP 1164Cb 0.00 -2.59 -0.04 0.00 1.07 0.00 0.00 42.92 41.36 2np0 s ASP 1164CO 0.00 -1.84 0.12 -0.31 1.18 0.00 0.00 175.17 174.32 2np0 s TYR 1165N -1.83 3.24 0.21 4.23 1.51 -1.26 -1.68 117.35 121.76 2np0 s TYR 1165Ca 0.75 0.05 0.04 0.00 -1.01 0.00 0.00 57.07 56.90 2np0 s TYR 1165Cb -0.29 -2.24 -0.05 0.00 -0.11 0.00 0.00 41.96 39.28 2np0 s TYR 1165CO 0.39 -0.03 -0.05 0.96 -1.11 0.00 0.00 175.55 175.71 2np0 s ILE 1166N 1.12 1.18 -0.12 2.71 -4.36 0.14 -2.54 121.20 119.34 2np0 s ILE 1166Ca 0.06 -2.06 -0.03 0.00 -0.26 0.00 0.00 60.65 58.35 2np0 s ILE 1166Cb -0.14 -2.19 -0.03 0.00 1.25 0.00 0.00 42.46 41.35 2np0 s ILE 1166CO 0.04 -0.46 0.01 -0.31 0.24 0.00 0.00 174.94 174.46 2np0 s TYR 1167N -3.32 3.16 -0.43 1.37 4.12 -0.08 -1.66 117.35 120.50 2np0 s TYR 1167Ca 0.25 0.07 -0.15 0.00 0.02 0.00 0.00 57.07 57.25 2np0 s TYR 1167Cb 0.04 -1.89 0.04 0.00 -1.52 0.00 0.00 41.96 38.63 2np0 s TYR 1167CO 0.07 0.30 0.35 -1.17 0.02 0.00 0.00 175.55 175.12 2np0 s LEU 1168N -0.37 5.28 0.46 -1.29 2.96 -1.26 -1.64 118.68 122.82 2np0 s LEU 1168Ca 0.07 -1.04 0.06 0.00 -0.22 0.00 0.00 54.13 53.00 2np0 s LEU 1168Cb -0.12 -2.18 -0.02 0.00 0.50 0.00 0.00 46.19 44.37 2np0 s LEU 1168CO 0.02 -0.53 0.24 -1.81 -1.32 0.00 0.00 176.35 172.94 2np0 s ASP 1169N 2.03 4.49 0.15 3.68 1.11 -0.51 -1.28 116.67 126.33 2np0 s ASP 1169Ca 0.05 -1.18 -0.24 0.00 0.18 0.00 0.00 52.55 51.36 2np0 s ASP 1169Cb -0.21 -0.09 0.07 0.00 1.07 0.00 0.00 42.92 43.76 2np0 s ASP 1169CO 0.09 -0.76 0.71 0.72 1.18 0.00 0.00 175.17 177.11 2np0 s PHE 1170N -2.68 -0.41 -0.06 4.23 -0.71 -0.33 -0.50 117.98 117.52 2np0 s PHE 1170Ca 0.35 0.16 -0.14 0.00 -1.04 0.00 0.00 56.93 56.26 2np0 s PHE 1170Cb 0.01 0.59 -0.05 0.00 -1.21 0.00 0.00 43.02 42.36 2np0 s PHE 1170CO 0.20 -0.85 0.37 -0.06 -1.34 0.00 0.00 175.22 173.54 2np0 s PHE 1171N -3.61 3.63 -0.18 3.49 0.08 -0.74 0.95 117.98 121.59 2np0 s PHE 1171Ca 0.04 0.86 -0.09 0.00 0.12 0.00 0.00 56.93 57.86 2np0 s PHE 1171Cb -0.02 -2.31 0.07 0.00 -0.57 0.00 0.00 43.02 40.18 2np0 s PHE 1171CO -0.08 0.49 0.42 1.21 -0.10 0.00 0.00 175.22 177.16 2np0 s ASN 1172N -0.47 -0.45 -1.49 1.36 2.47 -0.42 -4.62 114.94 111.32 2np0 s ASN 1172Ca 0.22 0.93 -0.04 0.00 0.42 0.00 0.00 52.86 54.39 2np0 s ASN 1172Cb -0.15 0.93 0.02 0.00 -1.45 0.00 0.00 41.25 40.60 2np0 s ASN 1172CO 0.10 -0.21 0.36 0.18 -3.72 0.00 0.00 177.10 173.82 2np0 n LEU 1173N 4.57 -2.10 -2.37 3.21 4.77 -1.26 -0.80 117.00 123.02 2np0 n LEU 1173Ca -0.19 -0.17 -0.15 0.00 -0.03 0.00 0.00 56.01 55.46 2np0 n LEU 1173Cb 0.54 -2.70 0.04 0.00 -2.33 0.00 0.00 43.42 38.97 2np0 n LEU 1173CO 0.06 0.07 0.12 0.59 -1.33 0.00 0.00 177.39 176.89 2np0 n ASN 1174N -2.27 -4.75 -4.04 -1.43 3.02 -1.26 -5.04 115.26 99.49 2np0 n ASN 1174Ca -0.13 -0.30 -0.10 0.00 -0.03 0.00 0.00 54.58 54.01 2np0 n ASN 1174Cb 0.62 -3.40 -0.07 0.00 -0.61 0.00 0.00 39.78 36.32 2np0 n ASN 1174CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2np0 s GLN 1175N -5.70 1.44 -0.22 3.52 -0.21 0.02 -5.14 119.66 113.37 2np0 s GLN 1175Ca 0.33 -1.40 -0.05 0.00 0.02 0.00 0.00 55.36 54.26 2np0 s GLN 1175Cb -0.15 0.40 -0.02 0.00 1.00 0.00 0.00 33.01 34.25 2np0 s GLN 1175CO 0.41 -0.56 -0.01 -2.00 -2.12 0.00 0.00 175.29 171.01 2np0 s GLU 1176N -4.04 3.50 0.55 2.91 2.12 -1.26 -1.30 118.70 121.18 2np0 s GLU 1176Ca 0.28 -0.57 0.05 0.00 0.36 0.00 0.00 54.97 55.09 2np0 s GLU 1176Cb 0.02 -3.09 0.05 0.00 0.26 0.00 0.00 34.13 31.37 2np0 s GLU 1176CO 0.10 -0.13 0.40 0.91 -0.54 0.00 0.00 175.26 176.00 2np0 n TRP 1177N 4.65 -0.54 -3.79 5.30 7.02 0.27 -4.03 117.44 126.32 2np0 n TRP 1177Ca -0.17 -2.33 -0.13 0.00 -1.02 0.00 0.00 57.50 53.85 2np0 n TRP 1177Cb 0.51 -0.44 -0.10 0.00 -2.42 0.00 0.00 31.31 28.86 2np0 n TRP 1177CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 2np0 s ARG 1178N -4.24 0.54 -0.31 -0.99 3.52 -0.15 -1.19 118.95 116.14 2np0 s ARG 1178Ca 0.30 -0.07 -0.15 0.00 -0.13 0.00 0.00 55.73 55.68 2np0 s ARG 1178Cb -0.02 0.24 -0.02 0.00 -1.56 0.00 0.00 34.95 33.59 2np0 s ARG 1178CO 0.19 -0.13 0.38 0.08 -0.81 0.00 0.00 175.30 175.01 2np0 s VAL 1179N -0.93 5.16 0.40 7.11 1.01 -0.41 -1.90 120.40 130.84 2np0 s VAL 1179Ca -0.10 0.30 0.07 0.00 0.00 0.00 0.00 61.98 62.26 2np0 s VAL 1179Cb -0.05 -3.78 -0.07 0.00 0.00 0.00 0.00 36.38 32.48 2np0 s VAL 1179CO 0.03 0.00 0.06 -0.31 0.00 0.00 0.00 175.10 174.88 2np0 s TYR 1180N 2.08 2.55 0.01 5.22 2.02 0.11 -4.68 117.35 124.65 2np0 s TYR 1180Ca 0.14 -0.61 0.06 0.00 -0.37 0.00 0.00 57.07 56.29 2np0 s TYR 1180Cb -0.16 -1.79 -0.02 0.00 -0.40 0.00 0.00 41.96 39.60 2np0 s TYR 1180CO 0.11 0.37 -0.19 -0.08 -1.57 0.00 0.00 175.55 174.20 2np0 s THR 1181N -2.65 1.47 0.34 -0.71 -1.32 -0.95 -1.81 115.64 110.03 2np0 s THR 1181Ca 0.37 -0.94 -0.29 0.00 -1.21 0.00 0.00 61.69 59.63 2np0 s THR 1181Cb 0.06 -1.26 -0.11 0.00 -1.51 0.00 0.00 72.50 69.68 2np0 s THR 1181CO 0.20 0.30 1.48 0.00 -2.21 0.00 0.00 174.62 174.39 2np0 n TYR 1182N 2.30 2.82 0.10 9.09 9.36 -1.26 -2.03 117.16 137.55 2np0 n TYR 1182Ca -0.16 0.41 -0.01 0.00 3.32 0.00 0.00 57.90 61.46 2np0 n TYR 1182Cb 0.54 -2.53 0.27 0.00 -0.63 0.00 0.00 39.34 36.99 2np0 n TYR 1182CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 2np0 h LYS 1183N 3.43 0.23 0.00 2.98 1.57 -1.74 -3.36 116.57 119.67 2np0 h LYS 1183Ca -0.49 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.18 2np0 h LYS 1183Cb 1.24 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.50 2np0 h LYS 1183CO 0.68 0.54 -0.40 0.66 -0.57 0.00 0.00 179.45 180.37 2np0 n TYR 1184N -4.09 0.00 -1.72 -1.35 4.01 -1.26 -5.02 117.16 107.72 2np0 n TYR 1184Ca -0.01 -1.14 -0.42 0.00 -0.16 0.00 0.00 57.90 56.17 2np0 n TYR 1184Cb 0.42 -0.19 -0.01 0.00 -0.31 0.00 0.00 39.34 39.25 2np0 n TYR 1184CO 0.00 0.00 0.00 1.97 -0.46 0.00 0.00 176.86 178.37 2np0 n PHE 1185N -0.98 2.57 0.49 -0.72 -1.74 -1.26 -4.91 117.46 110.91 2np0 n PHE 1185Ca 0.15 0.43 0.05 0.00 -0.56 0.00 0.00 57.45 57.53 2np0 n PHE 1185Cb 0.72 -2.50 -0.01 0.00 1.52 0.00 0.00 39.48 39.22 2np0 n PHE 1185CO 0.00 0.00 0.00 1.17 -0.56 0.00 0.00 176.76 177.37 2np0 n LYS 1186N 1.22 2.22 -2.92 3.97 3.00 -1.26 -4.94 118.16 119.46 2np0 n LYS 1186Ca 0.06 -0.55 -0.20 0.00 -0.00 0.00 0.00 58.31 57.61 2np0 n LYS 1186Cb 0.36 -1.10 0.07 0.00 0.00 0.00 0.00 35.03 34.36 2np0 n LYS 1186CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2np0 s LYS 1187N -1.51 2.16 0.40 1.64 -0.14 -1.26 -5.03 119.74 116.00 2np0 s LYS 1187Ca 0.08 -1.49 0.22 0.00 -1.36 0.00 0.00 55.97 53.43 2np0 s LYS 1187Cb 0.09 -2.57 0.28 0.00 -1.68 0.00 0.00 37.83 33.94 2np0 s LYS 1187CO 0.30 -0.99 1.54 0.93 -0.76 0.00 0.00 175.35 176.37 2np0 h GLU 1188N 0.01 0.00 -4.93 1.68 3.07 -1.96 -3.45 114.58 109.00 2np0 h GLU 1188Ca -0.32 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 58.23 2np0 h GLU 1188Cb 1.28 0.00 -0.17 0.00 -0.84 0.00 0.00 28.75 29.02 2np0 h GLU 1188CO 0.41 0.07 -0.72 -1.21 -1.40 0.00 0.00 179.01 176.15 2np0 s GLU 1189N -3.18 0.88 0.00 2.33 8.01 -1.26 -0.79 118.70 124.68 2np0 s GLU 1189Ca 0.06 -1.23 -0.26 0.00 0.01 0.00 0.00 54.97 53.55 2np0 s GLU 1189Cb 0.06 -0.50 0.06 0.00 -4.31 0.00 0.00 34.13 29.44 2np0 s GLU 1189CO 0.69 0.07 0.59 -2.00 0.01 0.00 0.00 175.26 174.61 2np0 s GLU 1190N -3.09 1.03 0.37 1.61 2.56 -0.24 -4.94 118.70 116.00 2np0 s GLU 1190Ca 0.08 -0.00 -0.28 0.00 0.00 0.00 0.00 54.97 54.77 2np0 s GLU 1190Cb -0.01 0.48 -0.11 0.00 2.00 0.00 0.00 34.13 36.49 2np0 s GLU 1190CO -0.01 -0.35 1.47 0.15 -0.56 0.00 0.00 175.26 175.96 2np0 s LYS 1191N -1.81 4.14 0.60 4.30 1.02 -1.26 -0.92 119.74 125.80 2np0 s LYS 1191Ca -0.08 2.53 -0.13 0.00 0.02 0.00 0.00 55.97 58.31 2np0 s LYS 1191Cb -0.01 -2.98 -0.04 0.00 -0.52 0.00 0.00 37.83 34.28 2np0 s LYS 1191CO 0.04 -0.49 1.02 -0.51 -0.92 0.00 0.00 175.35 174.49 2np0 s LEU 1192N -2.04 3.35 -0.21 3.17 1.43 -0.53 -4.72 118.68 119.14 2np0 s LEU 1192Ca 0.52 1.52 -0.05 0.00 -1.03 0.00 0.00 54.13 55.10 2np0 s LEU 1192Cb -0.46 -4.49 -0.02 0.00 0.03 0.00 0.00 46.19 41.25 2np0 s LEU 1192CO 0.62 -0.89 -0.01 0.12 0.23 0.00 0.00 176.35 176.42 2np0 s PHE 1193N -2.94 3.02 -0.23 0.29 5.36 -0.75 -4.34 117.98 118.38 2np0 s PHE 1193Ca 0.57 -0.59 0.01 0.00 -0.96 0.00 0.00 56.93 55.97 2np0 s PHE 1193Cb -0.11 -2.10 0.04 0.00 -0.34 0.00 0.00 43.02 40.50 2np0 s PHE 1193CO 0.46 -0.34 -0.12 -0.51 -1.46 0.00 0.00 175.22 173.25 2np0 s LEU 1194N 1.19 2.98 0.23 6.12 1.02 -0.61 0.07 118.68 129.67 2np0 s LEU 1194Ca 0.03 -1.03 -0.19 0.00 0.02 0.00 0.00 54.13 52.96 2np0 s LEU 1194Cb -0.15 -1.56 0.03 0.00 0.02 0.00 0.00 46.19 44.53 2np0 s LEU 1194CO 0.01 -0.12 0.60 0.00 0.02 0.00 0.00 176.35 176.86 2np0 s ALA 1195N 1.22 -1.05 1.13 4.21 0.00 -0.80 -4.48 121.76 122.00 2np0 s ALA 1195Ca -0.02 -0.23 -0.14 0.00 0.00 0.00 0.00 51.96 51.57 2np0 s ALA 1195Cb -0.17 0.88 0.26 0.00 0.00 0.00 0.00 23.12 24.09 2np0 s ALA 1195CO -0.07 -0.89 1.05 -1.25 0.00 0.00 0.00 175.76 174.59 2np0 s PRO 1196N -3.89 -0.66 0.04 0.00 0.04 -1.26 -0.97 135.00 128.30 2np0 s PRO 1196Ca 0.10 0.59 -0.31 0.00 0.04 0.00 0.00 61.00 61.43 2np0 s PRO 1196Cb -0.03 -1.60 -0.07 0.00 0.04 0.00 0.00 34.50 32.84 2np0 s PRO 1196CO 0.01 -3.49 1.46 0.42 0.04 0.00 0.00 177.00 175.44 2np0 s ILE 1197N -2.67 3.45 -0.10 0.56 1.01 -1.26 -4.67 121.20 117.52 2np0 s ILE 1197Ca 0.68 0.91 -0.30 0.00 0.00 0.00 0.00 60.65 61.93 2np0 s ILE 1197Cb -0.21 -3.58 0.09 0.00 0.01 0.00 0.00 42.46 38.77 2np0 s ILE 1197CO 0.61 0.02 0.81 -0.55 0.00 0.00 0.00 174.94 175.82 2np0 s SER 1198N 1.81 -0.55 -1.07 3.58 0.15 -1.26 -5.07 113.70 111.28 2np0 s SER 1198Ca 0.66 0.62 -0.05 0.00 0.70 0.00 0.00 55.95 57.88 2np0 s SER 1198Cb -0.35 0.47 0.30 0.00 -1.71 0.00 0.00 66.02 64.73 2np0 s SER 1198CO 0.29 -0.49 1.33 -0.90 1.20 0.00 0.00 173.24 174.66 2np0 n ASP 1199N 0.90 6.01 -4.66 5.45 5.75 -1.26 -5.01 116.55 123.72 2np0 n ASP 1199Ca -0.15 -3.30 -0.39 0.00 -0.01 0.00 0.00 54.79 50.94 2np0 n ASP 1199Cb 0.57 -1.27 -0.07 0.00 -1.03 0.00 0.00 41.12 39.32 2np0 n ASP 1199CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2np0 s SER 1200N -0.87 6.54 0.00 -1.12 0.15 -1.26 -4.98 113.70 112.16 2np0 s SER 1200Ca 0.31 0.65 0.00 0.00 0.70 0.00 0.00 55.95 57.61 2np0 s SER 1200Cb 0.01 -2.28 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 2np0 s SER 1200CO 0.04 -0.17 0.55 -0.90 1.20 0.00 0.00 173.24 173.96 2np0 n ASP 1201N 4.75 1.61 -0.12 5.45 5.75 -1.26 -2.36 116.55 130.37 2np0 n ASP 1201Ca -0.05 -1.19 0.01 0.00 -0.01 0.00 0.00 54.79 53.55 2np0 n ASP 1201Cb 0.50 -0.30 0.02 0.00 -1.03 0.00 0.00 41.12 40.32 2np0 n ASP 1201CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2np0 n GLU 1202N 0.63 0.61 -3.79 0.11 1.02 -1.26 -5.02 120.64 112.95 2np0 n GLU 1202Ca 0.00 -0.99 -0.13 0.00 -0.02 0.00 0.00 57.16 56.01 2np0 n GLU 1202Cb 0.28 -1.05 -0.14 0.00 -0.02 0.00 0.00 31.44 30.50 2np0 n GLU 1202CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2np0 s PHE 1203N -0.49 -0.10 0.20 -0.32 0.08 -1.00 -1.94 117.98 114.42 2np0 s PHE 1203Ca 0.04 0.32 -0.30 0.00 0.12 0.00 0.00 56.93 57.11 2np0 s PHE 1203Cb 0.02 -0.07 -0.08 0.00 -0.57 0.00 0.00 43.02 42.32 2np0 s PHE 1203CO 0.03 -0.11 1.10 0.71 -0.10 0.00 0.00 175.22 176.86 2np0 s TYR 1204N 0.74 3.59 -0.03 0.36 2.02 -0.86 -4.79 117.35 118.37 2np0 s TYR 1204Ca -0.06 1.61 0.05 0.00 -0.37 0.00 0.00 57.07 58.30 2np0 s TYR 1204Cb -0.08 -3.28 -0.07 0.00 -0.40 0.00 0.00 41.96 38.13 2np0 s TYR 1204CO -0.03 -0.62 0.11 0.27 -1.57 0.00 0.00 175.55 173.71 2np0 n ASN 1205N 2.14 3.46 -4.67 2.29 6.94 -1.26 -2.23 115.26 121.92 2np0 n ASN 1205Ca 0.02 -0.08 -0.42 0.00 -0.02 0.00 0.00 54.58 54.08 2np0 n ASN 1205Cb 0.46 1.18 -0.03 0.00 -2.36 0.00 0.00 39.78 39.04 2np0 n ASN 1205CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2np0 s THR 1206N -2.21 3.63 -0.13 5.53 2.01 -1.26 -4.69 115.64 118.52 2np0 s THR 1206Ca -0.01 0.87 0.01 0.00 0.31 0.00 0.00 61.69 62.87 2np0 s THR 1206Cb 0.03 -3.56 -0.00 0.00 0.01 0.00 0.00 72.50 68.98 2np0 s THR 1206CO 0.19 -0.05 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.26 2np0 s ILE 1207N 3.43 2.54 -0.10 1.82 1.01 -0.66 -2.20 121.20 127.03 2np0 s ILE 1207Ca 0.69 -0.83 -0.13 0.00 0.00 0.00 0.00 60.65 60.38 2np0 s ILE 1207Cb -0.32 -2.04 -0.05 0.00 0.01 0.00 0.00 42.46 40.06 2np0 s ILE 1207CO 0.27 0.53 0.30 -1.58 0.00 0.00 0.00 174.94 174.46 2np0 s GLN 1208N 0.60 3.97 -0.20 2.79 0.74 0.16 0.29 119.66 127.99 2np0 s GLN 1208Ca -0.10 0.15 -0.11 0.00 0.05 0.00 0.00 55.36 55.35 2np0 s GLN 1208Cb -0.16 -3.31 -0.05 0.00 1.10 0.00 0.00 33.01 30.59 2np0 s GLN 1208CO 0.03 0.50 0.18 -1.50 -0.55 0.00 0.00 175.29 173.96 2np0 s ILE 1209N -0.36 5.37 0.25 -2.34 2.07 -0.68 -0.81 121.20 124.70 2np0 s ILE 1209Ca 0.19 0.28 0.11 0.00 -1.41 0.00 0.00 60.65 59.81 2np0 s ILE 1209Cb -0.14 -3.52 -0.05 0.00 0.13 0.00 0.00 42.46 38.88 2np0 s ILE 1209CO 0.07 0.40 -0.18 -0.54 -1.91 0.00 0.00 174.94 172.78 2np0 s LYS 1210N 0.57 1.55 -0.36 3.50 -0.14 0.65 -0.02 119.74 125.50 2np0 s LYS 1210Ca 0.10 -1.68 0.00 0.00 -1.36 0.00 0.00 55.97 53.03 2np0 s LYS 1210Cb -0.12 -1.56 0.14 0.00 -1.68 0.00 0.00 37.83 34.61 2np0 s LYS 1210CO 0.01 0.29 0.21 -2.00 -0.76 0.00 0.00 175.35 173.10 2np0 s GLU 1211N -3.46 0.65 0.18 1.68 2.12 -1.26 -0.08 118.70 118.53 2np0 s GLU 1211Ca 0.26 -1.41 0.26 0.00 0.36 0.00 0.00 54.97 54.45 2np0 s GLU 1211Cb -0.04 -1.45 0.83 0.00 0.26 0.00 0.00 34.13 33.73 2np0 s GLU 1211CO 0.12 -1.20 1.77 0.66 -0.54 0.00 0.00 175.26 176.07 2np0 n TYR 1212N 4.00 0.82 -2.86 5.30 4.01 -1.26 -4.75 117.16 122.41 2np0 n TYR 1212Ca 0.11 0.24 -0.41 0.00 -0.16 0.00 0.00 57.90 57.68 2np0 n TYR 1212Cb 0.37 -0.88 -0.04 0.00 -0.31 0.00 0.00 39.34 38.48 2np0 n TYR 1212CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2np0 s ASP 1213N -4.36 7.16 0.08 7.72 -1.08 -1.26 -4.95 116.67 119.99 2np0 s ASP 1213Ca 0.11 1.40 0.24 0.00 -0.52 0.00 0.00 52.55 53.78 2np0 s ASP 1213Cb 0.13 -2.49 0.26 0.00 -1.46 0.00 0.00 42.92 39.36 2np0 s ASP 1213CO 0.60 -0.24 1.23 -0.62 0.52 0.00 0.00 175.17 176.66 2np0 n GLU 1214N 4.12 0.26 -3.07 4.34 1.02 -1.26 -4.86 120.64 121.19 2np0 n GLU 1214Ca 0.03 0.05 -0.29 0.00 -0.02 0.00 0.00 57.16 56.93 2np0 n GLU 1214Cb 0.51 -1.63 -0.03 0.00 -0.02 0.00 0.00 31.44 30.26 2np0 n GLU 1214CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2np0 s GLN 1215N -3.16 3.68 0.23 3.49 -1.52 -1.26 -5.01 119.66 116.11 2np0 s GLN 1215Ca 0.06 0.21 -0.30 0.00 -1.95 0.00 0.00 55.36 53.37 2np0 s GLN 1215Cb 0.14 -2.51 -0.15 0.00 -0.22 0.00 0.00 33.01 30.27 2np0 s GLN 1215CO 0.75 0.07 1.09 -2.30 -0.25 0.00 0.00 175.29 174.65 2np0 n PRO 1216N -1.23 1.28 -3.57 2.91 -0.02 -1.26 -4.98 135.00 128.13 2np0 n PRO 1216Ca 0.00 0.45 -0.07 0.00 -2.02 0.00 0.00 63.50 61.86 2np0 n PRO 1216Cb 0.54 -1.89 -0.02 0.00 -0.02 0.00 0.00 33.50 32.11 2np0 n PRO 1216CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2np0 s THR 1217N -0.59 0.00 -0.51 3.45 -1.32 -1.26 -5.03 115.64 110.37 2np0 s THR 1217Ca 0.66 -0.20 0.05 0.00 -1.21 0.00 0.00 61.69 60.98 2np0 s THR 1217Cb -0.77 -1.29 0.08 0.00 -1.51 0.00 0.00 72.50 69.01 2np0 s THR 1217CO 0.56 0.00 0.85 -1.22 -2.21 0.00 0.00 174.62 172.60 2np0 n TYR 1218N -0.32 0.09 -3.02 9.09 4.01 -1.26 -4.91 117.16 120.84 2np0 n TYR 1218Ca -0.09 -0.22 -0.33 0.00 -0.16 0.00 0.00 57.90 57.10 2np0 n TYR 1218Cb 0.62 -0.02 -0.06 0.00 -0.31 0.00 0.00 39.34 39.57 2np0 n TYR 1218CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2np0 s SER 1219N -0.67 6.89 0.18 7.72 0.01 -1.26 -4.70 113.70 121.88 2np0 s SER 1219Ca 0.08 1.45 -0.01 0.00 1.31 0.00 0.00 55.95 58.78 2np0 s SER 1219Cb 0.05 -2.44 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 2np0 s SER 1219CO 0.06 -0.22 0.10 0.00 0.41 0.00 0.00 173.24 173.60 2np0 s GLN 1221N -4.11 1.68 -0.22 0.00 1.11 0.89 -1.13 119.66 117.87 2np0 s GLN 1221Ca 0.34 -1.84 -0.01 0.00 0.01 0.00 0.00 55.36 53.85 2np0 s GLN 1221Cb 0.07 -1.49 0.06 0.00 -1.01 0.00 0.00 33.01 30.65 2np0 s GLN 1221CO 0.08 0.13 0.01 -0.51 0.01 0.00 0.00 175.29 175.01 2np0 s LEU 1222N -3.52 1.85 -0.18 2.90 1.43 -1.26 -0.25 118.68 119.65 2np0 s LEU 1222Ca 0.31 -1.06 -0.06 0.00 -1.03 0.00 0.00 54.13 52.28 2np0 s LEU 1222Cb 0.02 -0.85 -0.04 0.00 0.03 0.00 0.00 46.19 45.35 2np0 s LEU 1222CO 0.14 -0.29 0.04 -0.22 0.23 0.00 0.00 176.35 176.25 2np0 s LEU 1223N 1.65 3.66 -0.09 1.79 2.96 0.01 -1.19 118.68 127.48 2np0 s LEU 1223Ca -0.02 0.02 -0.19 0.00 -0.22 0.00 0.00 54.13 53.73 2np0 s LEU 1223Cb -0.18 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 2np0 s LEU 1223CO -0.09 0.17 0.50 -0.36 -1.32 0.00 0.00 176.35 175.25 2np0 s PHE 1224N 0.41 3.56 0.24 5.38 0.40 -0.33 0.37 117.98 128.01 2np0 s PHE 1224Ca 0.01 0.97 0.11 0.00 -0.60 0.00 0.00 56.93 57.43 2np0 s PHE 1224Cb -0.13 -2.55 -0.05 0.00 0.51 0.00 0.00 43.02 40.80 2np0 s PHE 1224CO 0.01 0.24 -0.18 0.15 0.70 0.00 0.00 175.22 176.14 2np0 s LYS 1225N 0.34 1.75 0.08 0.44 -0.14 -0.93 -1.58 119.74 119.69 2np0 s LYS 1225Ca 0.27 -1.60 -0.31 0.00 -1.36 0.00 0.00 55.97 52.97 2np0 s LYS 1225Cb -0.16 -1.88 -0.17 0.00 -1.68 0.00 0.00 37.83 33.94 2np0 s LYS 1225CO 0.12 0.37 1.64 0.87 -0.76 0.00 0.00 175.35 177.58 2np0 h LYS 1226N 2.57 -0.73 0.00 1.68 1.57 -1.89 -3.41 116.57 116.36 2np0 h LYS 1226Ca -0.43 0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.37 2np0 h LYS 1226Cb 1.24 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.71 2np0 h LYS 1226CO 0.56 -0.49 0.07 -0.40 -0.57 0.00 0.00 179.45 178.62 2np0 n ASP 1227N -5.43 -0.81 0.30 0.86 3.85 -1.26 -4.86 116.55 109.19 2np0 n ASP 1227Ca -0.12 -1.64 0.17 0.00 -0.71 0.00 0.00 54.79 52.49 2np0 n ASP 1227Cb 0.33 1.37 0.91 0.00 -1.35 0.00 0.00 41.12 42.37 2np0 n ASP 1227CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 2np0 h GLU 1228N 0.00 0.00 0.20 0.11 5.08 -1.98 -3.19 114.58 114.80 2np0 h GLU 1228Ca -0.12 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.91 2np0 h GLU 1228Cb 0.47 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.74 2np0 h GLU 1228CO 0.16 0.04 -1.50 0.93 -1.00 0.00 0.00 179.01 177.64 2np0 h GLU 1229N 0.00 0.42 -6.68 2.33 4.39 -2.01 -3.48 114.58 109.56 2np0 h GLU 1229Ca -0.00 -0.72 -0.48 0.00 0.34 0.00 0.00 59.36 58.50 2np0 h GLU 1229Cb 0.22 0.27 0.02 0.00 -0.10 0.00 0.00 28.75 29.16 2np0 h GLU 1229CO 0.01 1.33 -0.09 -1.54 -1.16 0.00 0.00 179.01 177.56 2np0 s SER 1230N -7.36 6.19 0.00 1.42 1.04 -1.21 -4.98 113.70 108.80 2np0 s SER 1230Ca -0.09 0.56 0.24 0.00 0.48 0.00 0.00 55.95 57.13 2np0 s SER 1230Cb 0.05 -2.00 0.18 0.00 0.10 0.00 0.00 66.02 64.36 2np0 s SER 1230CO 0.90 -0.46 1.24 0.35 0.98 0.00 0.00 173.24 176.26 2np0 n THR 1231N -1.98 0.00 -2.67 2.02 -2.24 -1.26 -4.81 114.28 103.34 2np0 n THR 1231Ca -0.02 -0.45 -0.42 0.00 -2.27 0.00 0.00 64.05 60.89 2np0 n THR 1231Cb 0.56 1.43 -0.03 0.00 -2.10 0.00 0.00 70.33 70.19 2np0 n THR 1231CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2np0 s ASP 1232N -2.09 7.35 -0.14 3.42 -0.00 -1.26 -5.02 116.67 118.93 2np0 s ASP 1232Ca 0.27 1.75 -0.03 0.00 -0.00 0.00 0.00 52.55 54.53 2np0 s ASP 1232Cb 0.20 -2.58 -0.03 0.00 -0.00 0.00 0.00 42.92 40.51 2np0 s ASP 1232CO 0.35 -0.25 -0.03 -1.61 -0.00 0.00 0.00 175.17 173.63 2np0 s GLU 1233N 0.78 3.55 -0.23 8.23 2.02 -1.26 -3.82 118.70 127.97 2np0 s GLU 1233Ca 0.52 -0.50 -0.14 0.00 0.02 0.00 0.00 54.97 54.87 2np0 s GLU 1233Cb -0.23 -2.89 -0.17 0.00 0.10 0.00 0.00 34.13 30.94 2np0 s GLU 1233CO 0.29 0.33 -0.05 -0.89 0.02 0.00 0.00 175.26 174.95 2np0 n ILE 1234N 3.28 1.56 0.00 -1.63 2.08 -0.61 -5.03 119.36 119.00 2np0 n ILE 1234Ca -0.17 -0.31 0.00 0.00 0.56 0.00 0.00 62.75 62.82 2np0 n ILE 1234Cb 0.53 -1.87 0.00 0.00 -0.75 0.00 0.00 39.64 37.55 2np0 n ILE 1234CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2np0 n GLY 1235N 1.52 0.80 3.45 7.39 0.00 -1.24 -4.71 105.19 112.40 2np0 n GLY 1235Ca -0.43 -0.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 2np0 n GLY 1235CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2np0 s LEU 1236N 0.00 2.62 0.18 0.99 1.43 -0.60 -1.19 118.68 122.11 2np0 s LEU 1236Ca 0.00 -0.26 -0.30 0.00 -1.03 0.00 0.00 54.13 52.54 2np0 s LEU 1236Cb 0.00 -1.52 -0.09 0.00 0.03 0.00 0.00 46.19 44.62 2np0 s LEU 1236CO 0.00 0.33 1.33 -0.63 0.23 0.00 0.00 176.35 177.62 2np0 s ILE 1237N -0.73 3.22 0.00 -0.59 1.01 -0.33 -1.47 121.20 122.31 2np0 s ILE 1237Ca 0.12 0.97 0.00 0.00 0.00 0.00 0.00 60.65 61.73 2np0 s ILE 1237Cb -0.10 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.75 2np0 s ILE 1237CO 0.01 0.13 0.00 0.61 0.00 0.00 0.00 174.94 175.68 2np0 n GLY 1238N 2.67 3.52 3.12 6.18 0.00 -0.30 -4.31 105.19 116.07 2np0 n GLY 1238Ca 0.08 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.14 2np0 n GLY 1238CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2np0 s ILE 1239N -1.54 1.57 0.10 -0.61 1.01 -1.24 -0.89 121.20 119.60 2np0 s ILE 1239Ca 0.00 -0.74 0.03 0.00 0.00 0.00 0.00 60.65 59.94 2np0 s ILE 1239Cb 0.00 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 2np0 s ILE 1239CO 0.00 0.45 -0.09 -2.28 0.00 0.00 0.00 174.94 173.02 2np0 s HIS 1240N 0.45 1.02 0.26 3.97 2.46 -0.71 -4.95 115.29 117.80 2np0 s HIS 1240Ca -0.15 -0.74 -0.17 0.00 0.47 0.00 0.00 55.06 54.47 2np0 s HIS 1240Cb -0.16 -0.56 -0.08 0.00 -0.13 0.00 0.00 32.58 31.64 2np0 s HIS 1240CO 0.06 -0.03 0.72 -0.98 -2.47 0.00 0.00 174.74 172.03 2np0 s ARG 1241N -3.18 4.12 0.05 2.88 1.70 -1.26 0.06 118.95 123.32 2np0 s ARG 1241Ca 0.08 0.75 0.02 0.00 -0.47 0.00 0.00 55.73 56.12 2np0 s ARG 1241Cb -0.00 -2.68 -0.03 0.00 -0.57 0.00 0.00 34.95 31.67 2np0 s ARG 1241CO -0.01 0.29 -0.08 -0.06 -1.08 0.00 0.00 175.30 174.36 2np0 s PHE 1242N -1.73 0.75 -0.12 5.89 0.40 0.33 -4.88 117.98 118.63 2np0 s PHE 1242Ca 0.48 -0.54 -0.30 0.00 -0.60 0.00 0.00 56.93 55.97 2np0 s PHE 1242Cb -0.14 -0.44 -0.01 0.00 0.51 0.00 0.00 43.02 42.93 2np0 s PHE 1242CO 0.19 -0.08 1.10 -0.47 0.70 0.00 0.00 175.22 176.67 2np0 s TYR 1243N -1.63 3.30 -0.29 0.36 5.04 -1.26 -0.96 117.35 121.91 2np0 s TYR 1243Ca -0.07 1.39 -0.14 0.00 -2.44 0.00 0.00 57.07 55.81 2np0 s TYR 1243Cb -0.08 -3.31 -0.03 0.00 0.35 0.00 0.00 41.96 38.88 2np0 s TYR 1243CO 0.00 -0.78 0.34 -1.21 -1.34 0.00 0.00 175.55 172.56 2np0 s GLU 1244N 2.46 3.89 0.80 4.97 0.41 -0.15 -4.97 118.70 126.11 2np0 s GLU 1244Ca 0.51 -0.13 -0.12 0.00 -0.41 0.00 0.00 54.97 54.82 2np0 s GLU 1244Cb -0.20 -3.70 0.08 0.00 -1.78 0.00 0.00 34.13 28.53 2np0 s GLU 1244CO 0.17 -0.33 1.14 -1.12 -0.49 0.00 0.00 175.26 174.63 2np0 s SER 1245N 1.69 3.89 0.01 -0.19 0.01 -1.26 -3.64 113.70 114.20 2np0 s SER 1245Ca 0.13 2.11 0.00 0.00 1.31 0.00 0.00 55.95 59.50 2np0 s SER 1245Cb -0.16 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.51 2np0 s SER 1245CO 0.11 -2.45 0.00 0.61 0.41 0.00 0.00 173.24 171.91 2np0 n GLY 1246N -0.21 -0.22 0.01 3.44 0.00 -1.26 -4.75 105.19 102.20 2np0 n GLY 1246Ca 0.11 0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.30 2np0 n GLY 1246CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2np0 n ILE 1247N -2.15 0.04 0.00 -0.61 -5.35 -1.26 -4.84 119.36 105.19 2np0 n ILE 1247Ca 0.00 -0.19 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 2np0 n ILE 1247Cb 0.00 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 2np0 n ILE 1247CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 2np0 n VAL 1248N -1.80 0.00 -4.47 7.28 0.24 -1.26 -5.03 118.33 113.28 2np0 n VAL 1248Ca 0.01 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.07 2np0 n VAL 1248Cb 0.42 -0.05 -0.10 0.00 -1.47 0.00 0.00 33.84 32.64 2np0 n VAL 1248CO 0.00 0.00 0.00 0.72 -2.14 0.00 0.00 176.83 175.41 2np0 s PHE 1249N 0.00 2.37 0.11 6.34 -0.71 -1.26 -5.17 117.98 119.67 2np0 s PHE 1249Ca 0.00 -0.39 0.09 0.00 -1.04 0.00 0.00 56.93 55.59 2np0 s PHE 1249Cb 0.00 -1.17 -0.04 0.00 -1.21 0.00 0.00 43.02 40.60 2np0 s PHE 1249CO 0.00 0.65 -0.17 -1.21 -1.34 0.00 0.00 175.22 173.15 2np0 s GLU 1250N -3.57 1.84 -0.02 1.99 2.02 -1.26 -4.12 118.70 115.58 2np0 s GLU 1250Ca 0.31 -1.15 -0.30 0.00 0.02 0.00 0.00 54.97 53.85 2np0 s GLU 1250Cb -0.02 -2.14 0.11 0.00 0.10 0.00 0.00 34.13 32.18 2np0 s GLU 1250CO 0.16 0.49 1.19 -1.83 0.02 0.00 0.00 175.26 175.28 2np0 s GLU 1251N -2.13 0.55 0.15 1.61 -1.05 -1.24 -5.06 118.70 111.54 2np0 s GLU 1251Ca 0.18 -0.28 0.04 0.00 -0.15 0.00 0.00 54.97 54.76 2np0 s GLU 1251Cb -0.11 0.20 -0.04 0.00 -0.44 0.00 0.00 34.13 33.75 2np0 s GLU 1251CO 0.10 -0.25 0.19 0.71 0.95 0.00 0.00 175.26 176.97 2np0 s TYR 1252N -2.63 3.29 -0.16 4.83 1.51 -1.26 -0.97 117.35 121.96 2np0 s TYR 1252Ca 0.12 0.05 -0.12 0.00 -1.01 0.00 0.00 57.07 56.11 2np0 s TYR 1252Cb 0.02 -1.58 0.05 0.00 -0.11 0.00 0.00 41.96 40.34 2np0 s TYR 1252CO -0.03 0.52 0.40 0.21 -1.11 0.00 0.00 175.55 175.54 2np0 s LYS 1253N -3.11 0.44 0.26 -0.62 2.20 -0.14 -4.89 119.74 113.88 2np0 s LYS 1253Ca 0.32 0.64 -0.29 0.00 -0.36 0.00 0.00 55.97 56.29 2np0 s LYS 1253Cb -0.11 0.13 -0.09 0.00 -1.51 0.00 0.00 37.83 36.25 2np0 s LYS 1253CO 0.25 -0.10 0.97 -0.51 -0.36 0.00 0.00 175.35 175.61 2np0 s ASP 1254N 0.66 7.51 0.03 1.43 1.01 -1.26 -0.51 116.67 125.54 2np0 s ASP 1254Ca -0.04 1.99 0.02 0.00 0.71 0.00 0.00 52.55 55.24 2np0 s ASP 1254Cb -0.05 -2.61 -0.02 0.00 1.01 0.00 0.00 42.92 41.25 2np0 s ASP 1254CO -0.04 0.05 -0.07 -0.31 0.21 0.00 0.00 175.17 175.01 2np0 s TYR 1255N -1.26 0.60 -0.02 4.23 1.51 0.11 -2.34 117.35 120.18 2np0 s TYR 1255Ca 0.43 -0.44 -0.33 0.00 -1.01 0.00 0.00 57.07 55.73 2np0 s TYR 1255Cb -0.26 -0.37 -0.11 0.00 -0.11 0.00 0.00 41.96 41.12 2np0 s TYR 1255CO 0.32 -0.08 1.90 0.34 -1.11 0.00 0.00 175.55 176.92 2np0 n PHE 1256N 1.71 2.41 -4.20 2.71 7.35 0.07 -1.74 117.46 125.77 2np0 n PHE 1256Ca -0.21 -0.13 -0.14 0.00 -0.76 0.00 0.00 57.45 56.21 2np0 n PHE 1256Cb 0.55 -2.71 -0.09 0.00 0.35 0.00 0.00 39.48 37.58 2np0 n PHE 1256CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2np0 s ILE 1258N -3.86 3.64 -0.02 0.00 2.07 -0.10 -1.15 121.20 121.78 2np0 s ILE 1258Ca 0.38 -1.00 -0.01 0.00 -1.41 0.00 0.00 60.65 58.61 2np0 s ILE 1258Cb 0.05 -2.66 0.01 0.00 0.13 0.00 0.00 42.46 39.98 2np0 s ILE 1258CO 0.17 0.23 0.05 -0.55 -1.91 0.00 0.00 174.94 172.93 2np0 s SER 1259N -1.91 -0.04 0.09 4.50 0.15 -0.54 -1.08 113.70 114.87 2np0 s SER 1259Ca 0.21 0.09 0.01 0.00 0.70 0.00 0.00 55.95 56.96 2np0 s SER 1259Cb -0.11 0.08 -0.25 0.00 -1.71 0.00 0.00 66.02 64.02 2np0 s SER 1259CO 0.12 -0.03 1.18 0.11 1.20 0.00 0.00 173.24 175.82 2np0 h LYS 1260N 6.25 0.14 -0.82 5.44 1.57 -1.25 -1.58 116.57 126.31 2np0 h LYS 1260Ca -0.27 -0.24 0.14 0.00 -1.87 0.00 0.00 60.65 58.41 2np0 h LYS 1260Cb 1.20 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 33.54 2np0 h LYS 1260CO 0.48 1.10 0.54 -1.49 -0.57 0.00 0.00 179.45 179.51 2np0 h TRP 1261N 0.04 0.66 -0.76 -1.35 4.06 -1.96 -2.31 115.95 114.32 2np0 h TRP 1261Ca -0.09 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.86 2np0 h TRP 1261Cb 1.88 -0.21 -0.04 0.00 -1.00 0.00 0.00 29.16 29.80 2np0 h TRP 1261CO 0.03 0.25 0.39 1.88 -3.56 0.00 0.00 178.44 177.43 2np0 h TYR 1262N 0.56 1.08 -0.16 0.49 0.05 -1.94 -1.92 116.97 115.14 2np0 h TYR 1262Ca 0.41 -0.04 0.05 0.00 0.05 0.00 0.00 58.73 59.19 2np0 h TYR 1262Cb 0.77 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 2np0 h TYR 1262CO -0.00 0.78 0.27 -0.07 -1.05 0.00 0.00 178.16 178.09 2np0 h LEU 1263N 1.07 0.00 0.00 3.88 3.38 -1.65 0.55 115.31 122.55 2np0 h LEU 1263Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2np0 h LEU 1263Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2np0 h LEU 1263CO -0.04 0.00 -0.07 0.29 0.09 0.00 0.00 178.44 178.71 2np0 n LYS 1264N -3.45 0.10 -0.04 1.13 4.76 -0.72 -3.99 118.16 115.94 2np0 n LYS 1264Ca 0.01 0.07 -0.01 0.00 -2.87 0.00 0.00 58.31 55.52 2np0 n LYS 1264Cb 0.38 -1.61 -0.11 0.00 -1.84 0.00 0.00 35.03 31.85 2np0 n LYS 1264CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2np0 n GLU 1265N -1.78 1.33 -0.12 1.97 -0.58 0.15 -4.69 120.64 116.92 2np0 n GLU 1265Ca 0.06 -0.05 0.14 0.00 -0.42 0.00 0.00 57.16 56.89 2np0 n GLU 1265Cb 0.37 -1.33 0.51 0.00 -0.57 0.00 0.00 31.44 30.43 2np0 n GLU 1265CO 0.00 0.00 0.00 -0.39 -0.48 0.00 0.00 177.13 176.26 2np0 h VAL 1266N 0.00 0.84 -0.00 2.62 -1.51 -1.60 0.07 116.25 116.66 2np0 h VAL 1266Ca -0.22 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 65.12 2np0 h VAL 1266Cb 1.36 0.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.94 2np0 h VAL 1266CO 0.01 0.07 -0.11 0.29 -1.23 0.00 0.00 177.57 176.60 2np0 n LYS 1267N -4.47 0.55 -1.46 5.19 4.76 -1.26 -4.88 118.16 116.59 2np0 n LYS 1267Ca 0.12 -0.16 -0.34 0.00 -2.87 0.00 0.00 58.31 55.06 2np0 n LYS 1267Cb 0.46 -1.50 0.09 0.00 -1.84 0.00 0.00 35.03 32.25 2np0 n LYS 1267CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2np0 s ARG 1268N -2.56 2.19 -0.03 1.97 6.06 0.01 -5.02 118.95 121.57 2np0 s ARG 1268Ca 0.26 1.71 0.01 0.00 -2.50 0.00 0.00 55.73 55.21 2np0 s ARG 1268Cb 0.20 -1.85 0.02 0.00 0.06 0.00 0.00 34.95 33.39 2np0 s ARG 1268CO 0.49 -1.78 -0.01 0.15 -2.50 0.00 0.00 175.30 171.65 2np0 s LYS 1269N -3.95 0.35 0.57 5.12 3.01 -1.26 -3.58 119.74 119.99 2np0 s LYS 1269Ca 0.73 0.04 -0.18 0.00 -1.01 0.00 0.00 55.97 55.55 2np0 s LYS 1269Cb -0.28 -0.50 -0.05 0.00 -1.01 0.00 0.00 37.83 36.00 2np0 s LYS 1269CO 0.45 -0.11 1.11 -1.25 0.51 0.00 0.00 175.35 176.06 2np0 s PRO 1270N 0.93 3.27 0.21 -1.68 0.04 -1.26 -5.09 135.00 131.42 2np0 s PRO 1270Ca -0.10 1.52 -0.31 0.00 0.04 0.00 0.00 61.00 62.16 2np0 s PRO 1270Cb -0.13 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 32.31 2np0 s PRO 1270CO -0.01 -0.90 1.51 -0.47 0.04 0.00 0.00 177.00 177.17 2np0 s TYR 1271N -1.94 3.02 -0.38 0.56 5.04 -1.24 -4.91 117.35 117.50 2np0 s TYR 1271Ca 0.71 0.83 -0.29 0.00 -2.44 0.00 0.00 57.07 55.87 2np0 s TYR 1271Cb -0.22 -3.89 0.01 0.00 0.35 0.00 0.00 41.96 38.21 2np0 s TYR 1271CO 0.30 -3.08 1.42 1.21 -1.34 0.00 0.00 175.55 174.07 2np0 s ASN 1272N 0.74 6.36 0.48 4.32 3.84 -1.26 -4.86 114.94 124.55 2np0 s ASN 1272Ca 0.65 0.94 0.30 0.00 0.21 0.00 0.00 52.86 54.95 2np0 s ASN 1272Cb -0.43 -2.54 1.12 0.00 -0.55 0.00 0.00 41.25 38.85 2np0 s ASN 1272CO 0.38 -1.39 1.88 -0.07 -2.79 0.00 0.00 177.10 175.11 2np0 h LEU 1273N 12.06 0.00 -0.75 3.21 3.38 -1.99 -2.94 115.31 128.28 2np0 h LEU 1273Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2np0 h LEU 1273Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2np0 h LEU 1273CO 1.07 0.00 -0.12 0.29 0.09 0.00 0.00 178.44 179.77 2np0 n LYS 1274N -2.93 1.27 -1.75 1.13 4.76 -1.26 -4.55 118.16 114.83 2np0 n LYS 1274Ca 0.02 -0.75 -0.40 0.00 -2.87 0.00 0.00 58.31 54.31 2np0 n LYS 1274Cb 0.34 -1.48 0.02 0.00 -1.84 0.00 0.00 35.03 32.06 2np0 n LYS 1274CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2np0 n LEU 1275N -0.21 5.01 0.00 -0.35 4.77 -1.11 -3.48 117.00 121.62 2np0 n LEU 1275Ca 0.16 1.09 0.06 0.00 -0.03 0.00 0.00 56.01 57.29 2np0 n LEU 1275Cb 0.36 -1.58 0.31 0.00 -2.33 0.00 0.00 43.42 40.18 2np0 n LEU 1275CO 0.21 -0.32 0.63 0.61 -1.33 0.00 0.00 177.39 177.19 2np0 n GLY 1276N 0.65 -0.63 0.78 -0.72 0.00 -1.26 -1.88 105.19 102.13 2np0 n GLY 1276Ca 0.06 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2np0 n GLY 1276CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2np0 s ASN 1278N -1.73 6.40 0.14 0.00 0.01 -0.79 -4.38 114.94 114.59 2np0 s ASN 1278Ca 0.34 -0.14 0.06 0.00 -0.71 0.00 0.00 52.86 52.41 2np0 s ASN 1278Cb 0.20 -2.45 -0.04 0.00 0.41 0.00 0.00 41.25 39.37 2np0 s ASN 1278CO 0.30 -1.19 0.04 0.26 -1.51 0.00 0.00 177.10 175.00 2np0 s TRP 1279N 3.97 2.98 0.02 2.20 0.52 -0.29 -0.53 118.94 127.82 2np0 s TRP 1279Ca 0.34 -0.06 0.02 0.00 0.02 0.00 0.00 56.10 56.41 2np0 s TRP 1279Cb -0.11 -1.47 -0.01 0.00 -1.15 0.00 0.00 33.47 30.72 2np0 s TRP 1279CO 0.22 0.51 -0.06 -0.65 0.02 0.00 0.00 176.95 176.99 2np0 s GLN 1280N -2.76 0.42 -0.19 4.98 -0.21 0.15 -1.26 119.66 120.78 2np0 s GLN 1280Ca 0.28 -0.44 -0.06 0.00 0.02 0.00 0.00 55.36 55.16 2np0 s GLN 1280Cb -0.10 -0.28 -0.03 0.00 1.00 0.00 0.00 33.01 33.59 2np0 s GLN 1280CO 0.20 0.06 0.03 -0.06 -2.12 0.00 0.00 175.29 173.40 2np0 s PHE 1281N -0.74 3.13 -0.33 0.91 0.40 -1.26 -0.45 117.98 119.64 2np0 s PHE 1281Ca -0.05 -0.18 -0.02 0.00 -0.60 0.00 0.00 56.93 56.08 2np0 s PHE 1281Cb -0.06 -2.07 0.06 0.00 0.51 0.00 0.00 43.02 41.47 2np0 s PHE 1281CO -0.00 -0.03 0.06 0.42 0.70 0.00 0.00 175.22 176.37 2np0 s ILE 1282N 0.63 3.10 0.40 0.64 1.01 0.03 -0.39 121.20 126.62 2np0 s ILE 1282Ca 0.01 -1.55 -0.10 0.00 0.00 0.00 0.00 60.65 59.01 2np0 s ILE 1282Cb -0.14 -2.88 -0.06 0.00 0.01 0.00 0.00 42.46 39.39 2np0 s ILE 1282CO 0.02 -0.26 0.77 -2.16 0.00 0.00 0.00 174.94 173.30 2np0 s PRO 1283N 1.23 3.77 0.32 2.79 0.04 -1.26 -0.27 135.00 141.61 2np0 s PRO 1283Ca -0.01 0.45 -0.29 0.00 0.04 0.00 0.00 61.00 61.19 2np0 s PRO 1283Cb -0.20 -2.40 -0.12 0.00 0.04 0.00 0.00 34.50 31.82 2np0 s PRO 1283CO -0.02 -0.04 1.40 1.63 0.04 0.00 0.00 177.00 180.02 2np0 n LYS 1284N -1.32 2.29 -3.89 4.56 5.02 -1.26 -4.99 118.16 118.58 2np0 n LYS 1284Ca 0.02 0.81 -0.11 0.00 -2.02 0.00 0.00 58.31 57.01 2np0 n LYS 1284Cb 0.54 -2.46 -0.13 0.00 -0.02 0.00 0.00 35.03 32.96 2np0 n LYS 1284CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2np0 s ASP 1285N -0.02 0.03 0.55 4.39 -1.08 -1.26 -5.04 116.67 114.24 2np0 s ASP 1285Ca 0.59 -0.08 0.35 0.00 -0.52 0.00 0.00 52.55 52.89 2np0 s ASP 1285Cb -0.56 0.09 1.49 0.00 -1.46 0.00 0.00 42.92 42.49 2np0 s ASP 1285CO 0.58 -0.11 2.02 1.05 0.52 0.00 0.00 175.17 179.23 2np0 h GLU 1286N 5.62 0.00 -0.02 4.34 4.11 -2.02 -2.31 114.58 124.30 2np0 h GLU 1286Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.16 2np0 h GLU 1286Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2np0 h GLU 1286CO 0.46 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.95 2np0 n GLY 1287N -0.13 -0.77 2.72 1.06 0.00 -1.26 -4.68 105.19 102.12 2np0 n GLY 1287Ca 0.00 -0.19 -0.20 0.00 0.00 0.00 0.00 46.02 45.63 2np0 n GLY 1287CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2np0 s TRP 1288N -1.97 -0.01 -0.05 1.61 -0.11 -0.87 -0.23 118.94 117.30 2np0 s TRP 1288Ca 0.34 0.28 0.03 0.00 1.22 0.00 0.00 56.10 57.96 2np0 s TRP 1288Cb 0.16 -0.44 0.00 0.00 -1.50 0.00 0.00 33.47 31.70 2np0 s TRP 1288CO 0.26 -0.29 -0.14 0.95 -4.62 0.00 0.00 176.95 173.11 2np0 s THR 1289N 2.21 1.24 0.00 5.86 -4.23 -1.26 -4.53 115.64 114.94 2np0 s THR 1289Ca 0.04 -0.58 0.00 0.00 -1.18 0.00 0.00 61.69 59.97 2np0 s THR 1289Cb -0.13 -1.10 0.00 0.00 1.34 0.00 0.00 72.50 72.61 2np0 s THR 1289CO -0.05 0.37 0.15 -1.84 -0.54 0.00 0.00 174.62 172.71