#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d3u s MET 2 N 0.00 4.55 0.43 -1.46 1.00 -1.26 -2.18 119.30 120.38 2d3u s MET 2 Ca 0.00 1.88 0.11 0.00 0.00 0.00 0.00 55.69 57.68 2d3u s MET 2 Cb 0.00 -3.19 0.98 0.00 0.00 0.00 0.00 34.83 32.61 2d3u s MET 2 CO 0.00 0.06 2.03 0.66 0.00 0.00 0.00 175.02 177.77 2d3u h SER 3 N 4.25 0.38 -5.04 3.03 4.64 -1.28 -3.40 113.55 116.14 2d3u h SER 3 Ca -0.46 -0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.74 2d3u h SER 3 Cb 1.21 -0.08 -0.18 0.00 -0.31 0.00 0.00 62.40 63.04 2d3u h SER 3 CO 0.69 0.26 -0.34 -0.31 -0.87 0.00 0.00 176.83 176.26 2d3u s TYR 4 N -5.41 -0.05 -0.08 4.77 2.02 -1.26 -0.89 117.35 116.46 2d3u s TYR 4 Ca -0.08 -0.06 0.02 0.00 -0.37 0.00 0.00 57.07 56.59 2d3u s TYR 4 Cb 0.18 0.03 0.01 0.00 -0.40 0.00 0.00 41.96 41.79 2d3u s TYR 4 CO 0.73 -0.42 -0.13 0.95 -1.57 0.00 0.00 175.55 175.11 2d3u s THR 5 N -2.12 1.26 0.14 -0.71 -4.23 -0.47 -4.84 115.64 104.66 2d3u s THR 5 Ca -0.08 -0.54 0.06 0.00 -1.18 0.00 0.00 61.69 59.95 2d3u s THR 5 Cb -0.03 -1.15 -0.04 0.00 1.34 0.00 0.00 72.50 72.63 2d3u s THR 5 CO -0.01 0.38 -0.01 0.26 -0.54 0.00 0.00 174.62 174.71 2d3u s TRP 6 N 0.72 2.90 -0.10 3.99 0.52 -1.26 -0.28 118.94 125.43 2d3u s TRP 6 Ca -0.13 -0.10 0.20 0.00 0.02 0.00 0.00 56.10 56.10 2d3u s TRP 6 Cb -0.16 -1.45 -0.28 0.00 -1.15 0.00 0.00 33.47 30.44 2d3u s TRP 6 CO 0.03 0.49 0.39 0.25 0.02 0.00 0.00 176.95 178.13 2d3u n THR 7 N 0.21 0.60 0.00 2.01 -2.24 -0.37 -4.90 114.28 109.59 2d3u n THR 7 Ca -0.10 -0.64 0.00 0.00 -2.27 0.00 0.00 64.05 61.03 2d3u n THR 7 Cb 0.54 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 2d3u n THR 7 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2d3u n GLY 8 N 1.44 1.83 3.76 3.38 0.00 -1.26 -5.07 105.19 109.26 2d3u n GLY 8 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 2d3u n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d3u s ALA 9 N -2.17 2.52 0.45 4.61 0.00 -1.26 -4.99 121.76 120.91 2d3u s ALA 9 Ca 0.00 0.91 -0.09 0.00 0.00 0.00 0.00 51.96 52.78 2d3u s ALA 9 Cb 0.00 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 2d3u s ALA 9 CO 0.00 -1.18 0.80 -0.51 0.00 0.00 0.00 175.76 174.87 2d3u s LEU 10 N -4.23 3.72 -0.36 0.00 1.43 -1.26 -4.84 118.68 113.14 2d3u s LEU 10 Ca 0.75 1.12 -0.23 0.00 -1.03 0.00 0.00 54.13 54.73 2d3u s LEU 10 Cb -0.28 -4.03 0.01 0.00 0.03 0.00 0.00 46.19 41.92 2d3u s LEU 10 CO 0.34 -0.50 0.80 -0.63 0.23 0.00 0.00 176.35 176.59 2d3u s ILE 11 N -2.55 4.72 0.18 -0.59 1.01 -1.26 -4.78 121.20 117.93 2d3u s ILE 11 Ca 0.51 0.95 0.04 0.00 0.00 0.00 0.00 60.65 62.15 2d3u s ILE 11 Cb -0.10 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 2d3u s ILE 11 CO 0.37 -0.42 0.22 0.42 0.00 0.00 0.00 174.94 175.53 2d3u s THR 12 N 3.12 4.89 0.59 2.92 -4.23 -1.26 -4.80 115.64 116.87 2d3u s THR 12 Ca 0.32 -0.96 -0.08 0.00 -1.18 0.00 0.00 61.69 59.79 2d3u s THR 12 Cb -0.13 -3.54 -0.02 0.00 1.34 0.00 0.00 72.50 70.15 2d3u s THR 12 CO 0.17 -0.15 0.95 -2.16 -0.54 0.00 0.00 174.62 172.88 2d3u s PRO 13 N -3.33 3.27 0.00 3.99 0.04 -1.26 -4.37 135.00 133.34 2d3u s PRO 13 Ca 0.33 0.36 0.25 0.00 0.04 0.00 0.00 61.00 61.98 2d3u s PRO 13 Cb -0.10 -2.19 0.42 0.00 0.04 0.00 0.00 34.50 32.67 2d3u s PRO 13 CO 0.26 -0.59 1.37 0.00 0.04 0.00 0.00 177.00 178.07 2d3u s ALA 15 N -2.31 -2.68 0.31 0.00 0.00 -1.26 -5.14 121.76 110.68 2d3u s ALA 15 Ca 0.25 0.34 -0.29 0.00 0.00 0.00 0.00 51.96 52.26 2d3u s ALA 15 Cb 0.19 0.77 -0.12 0.00 0.00 0.00 0.00 23.12 23.96 2d3u s ALA 15 CO 0.47 -1.15 1.43 0.00 0.00 0.00 0.00 175.76 176.51 2d3u n ALA 16 N -0.85 1.74 -3.03 0.00 0.00 -1.26 -4.99 120.51 112.12 2d3u n ALA 16 Ca 0.02 0.38 -0.32 0.00 0.00 0.00 0.00 53.44 53.52 2d3u n ALA 16 Cb 0.60 -2.34 -0.17 0.00 0.00 0.00 0.00 19.45 17.54 2d3u n ALA 16 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2d3u s GLU 17 N -1.13 2.89 -0.04 0.00 2.02 -1.26 -5.12 118.70 116.05 2d3u s GLU 17 Ca 0.61 -0.87 -0.16 0.00 0.02 0.00 0.00 54.97 54.57 2d3u s GLU 17 Cb -0.56 -2.28 -0.05 0.00 0.10 0.00 0.00 34.13 31.34 2d3u s GLU 17 CO 0.55 0.26 0.42 -1.21 0.02 0.00 0.00 175.26 175.30 2d3u s GLU 18 N 0.14 4.07 -0.08 1.61 2.02 -1.26 -4.97 118.70 120.23 2d3u s GLU 18 Ca -0.12 0.40 0.07 0.00 0.02 0.00 0.00 54.97 55.33 2d3u s GLU 18 Cb -0.16 -3.30 -0.10 0.00 0.10 0.00 0.00 34.13 30.67 2d3u s GLU 18 CO 0.07 0.51 0.02 -1.13 0.02 0.00 0.00 175.26 174.74 2d3u n SER 19 N 2.47 2.97 -4.84 -0.19 3.41 -1.26 -4.57 113.62 111.61 2d3u n SER 19 Ca -0.12 -0.01 -0.34 0.00 -0.26 0.00 0.00 58.87 58.14 2d3u n SER 19 Cb 0.52 0.62 -0.06 0.00 -0.26 0.00 0.00 64.21 65.03 2d3u n SER 19 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2d3u s LYS 20 N -2.20 4.01 0.05 4.33 0.00 -1.26 -0.87 119.74 123.81 2d3u s LYS 20 Ca -0.05 0.57 -0.31 0.00 0.00 0.00 0.00 55.97 56.18 2d3u s LYS 20 Cb 0.03 -2.78 -0.10 0.00 0.00 0.00 0.00 37.83 34.98 2d3u s LYS 20 CO 0.33 0.37 1.93 -0.11 0.00 0.00 0.00 175.35 177.88 2d3u n LEU 21 N 0.40 4.09 -4.77 2.77 7.94 -1.24 -4.88 117.00 121.32 2d3u n LEU 21 Ca -0.02 0.93 -0.40 0.00 -1.11 0.00 0.00 56.01 55.41 2d3u n LEU 21 Cb 0.52 -1.52 -0.03 0.00 0.53 0.00 0.00 43.42 42.92 2d3u n LEU 21 CO 0.43 0.18 0.88 -2.84 -1.11 0.00 0.00 177.39 174.93 2d3u s PRO 22 N 3.96 4.40 -0.13 1.96 0.02 -1.26 -5.02 135.00 138.93 2d3u s PRO 22 Ca 0.87 1.98 0.01 0.00 0.02 0.00 0.00 61.00 63.89 2d3u s PRO 22 Cb -0.46 -3.03 -0.01 0.00 0.02 0.00 0.00 34.50 31.02 2d3u s PRO 22 CO 0.41 -0.06 -0.17 0.42 -0.33 0.00 0.00 177.00 177.27 2d3u s ILE 23 N -1.21 2.66 0.00 2.83 -1.09 -1.26 -4.70 121.20 118.43 2d3u s ILE 23 Ca 0.49 -0.79 0.00 0.00 -2.23 0.00 0.00 60.65 58.12 2d3u s ILE 23 Cb -0.35 -2.09 0.00 0.00 -1.58 0.00 0.00 42.46 38.44 2d3u s ILE 23 CO 0.45 0.53 0.00 -0.46 -1.23 0.00 0.00 174.94 174.24 2d3u n ASN 24 N 3.67 1.30 0.12 3.58 0.23 -1.26 -5.01 115.26 117.89 2d3u n ASN 24 Ca -0.19 -0.76 0.11 0.00 -0.53 0.00 0.00 54.58 53.21 2d3u n ASN 24 Cb 0.52 0.00 0.48 0.00 -2.08 0.00 0.00 39.78 38.71 2d3u n ASN 24 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2d3u n ALA 25 N -3.00 1.61 0.03 -2.53 0.00 -1.26 -3.01 120.51 112.34 2d3u n ALA 25 Ca 0.00 0.08 0.09 0.00 0.00 0.00 0.00 53.44 53.62 2d3u n ALA 25 Cb 0.00 -1.37 -0.11 0.00 0.00 0.00 0.00 19.45 17.97 2d3u n ALA 25 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2d3u n LEU 26 N -2.19 0.33 -0.20 0.00 4.77 -1.26 -4.59 117.00 113.86 2d3u n LEU 26 Ca 0.02 0.13 -0.03 0.00 -0.03 0.00 0.00 56.01 56.11 2d3u n LEU 26 Cb 0.21 0.01 0.04 0.00 -2.33 0.00 0.00 43.42 41.35 2d3u n LEU 26 CO 0.19 -0.03 0.70 0.28 -1.33 0.00 0.00 177.39 177.20 2d3u h SER 27 N 0.00 -0.80 0.32 -1.43 0.02 -1.87 -2.15 113.55 107.64 2d3u h SER 27 Ca -0.04 0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 2d3u h SER 27 Cb 1.10 0.46 -0.00 0.00 0.14 0.00 0.00 62.40 64.10 2d3u h SER 27 CO 0.00 -0.25 -0.06 0.78 -1.14 0.00 0.00 176.83 176.16 2d3u h ASN 28 N -0.08 0.00 1.07 3.07 2.35 -1.80 -1.77 115.58 118.42 2d3u h ASN 28 Ca 0.27 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.98 2d3u h ASN 28 Cb 0.50 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.86 2d3u h ASN 28 CO -0.65 0.06 -0.20 0.77 -1.65 0.00 0.00 177.43 175.77 2d3u h SER 29 N 0.00 0.00 0.00 5.81 4.64 -1.68 -3.31 113.55 119.01 2d3u h SER 29 Ca -0.00 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.08 2d3u h SER 29 Cb 0.24 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.29 2d3u h SER 29 CO 0.01 0.20 -1.37 -0.11 -0.87 0.00 0.00 176.83 174.68 2d3u n LEU 30 N -3.31 1.87 -3.61 5.97 7.94 -0.72 -4.64 117.00 120.49 2d3u n LEU 30 Ca 0.01 0.42 -0.14 0.00 -1.11 0.00 0.00 56.01 55.19 2d3u n LEU 30 Cb 0.44 -0.94 -0.06 0.00 0.53 0.00 0.00 43.42 43.39 2d3u n LEU 30 CO 0.33 0.26 0.24 -1.48 -1.11 0.00 0.00 177.39 175.63 2d3u s LEU 31 N -7.85 0.08 -0.16 -1.96 -0.00 -0.85 -4.13 118.68 103.81 2d3u s LEU 31 Ca -0.29 0.19 0.17 0.00 -0.00 0.00 0.00 54.13 54.20 2d3u s LEU 31 Cb 0.07 1.98 -0.24 0.00 -0.00 0.00 0.00 46.19 47.99 2d3u s LEU 31 CO 0.55 -0.66 0.11 0.54 -0.00 0.00 0.00 176.35 176.90 2d3u n ARG 32 N 0.61 0.92 -1.93 1.48 1.74 -0.22 -4.02 116.66 115.24 2d3u n ARG 32 Ca -0.19 -0.03 -0.41 0.00 -0.77 0.00 0.00 57.85 56.45 2d3u n ARG 32 Cb 0.59 -1.48 -0.00 0.00 -1.02 0.00 0.00 32.46 30.55 2d3u n ARG 32 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2d3u n HIS 33 N -2.62 3.01 -0.31 -1.55 8.25 -0.78 -4.75 115.22 116.47 2d3u n HIS 33 Ca -0.27 -2.90 0.09 0.00 -0.26 0.00 0.00 57.72 54.38 2d3u n HIS 33 Cb 1.03 -2.22 0.30 0.00 1.12 0.00 0.00 29.99 30.22 2d3u n HIS 33 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2d3u h HIS 34 N 5.56 0.99 0.00 4.41 3.86 -1.84 -2.11 115.15 126.02 2d3u h HIS 34 Ca 0.57 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.81 2d3u h HIS 34 Cb 0.54 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.69 2d3u h HIS 34 CO 1.46 0.40 0.00 0.09 0.86 0.00 0.00 177.93 180.75 2d3u n ASN 35 N -4.57 0.44 0.08 2.45 4.13 -1.26 -1.80 115.26 114.72 2d3u n ASN 35 Ca 0.17 0.69 0.12 0.00 1.68 0.00 0.00 54.58 57.25 2d3u n ASN 35 Cb 0.38 -0.75 0.24 0.00 -1.54 0.00 0.00 39.78 38.10 2d3u n ASN 35 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 2d3u n MET 36 N -2.08 0.29 -3.80 3.52 2.81 -0.79 -4.85 117.12 112.22 2d3u n MET 36 Ca -0.01 0.13 -0.37 0.00 -1.81 0.00 0.00 57.70 55.64 2d3u n MET 36 Cb 0.05 -1.73 -0.06 0.00 -0.71 0.00 0.00 33.22 30.77 2d3u n MET 36 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2d3u s VAL 37 N -3.15 5.41 0.05 2.03 1.01 -0.75 -0.37 120.40 124.64 2d3u s VAL 37 Ca 0.07 0.34 -0.17 0.00 0.00 0.00 0.00 61.98 62.22 2d3u s VAL 37 Cb 0.13 -3.47 0.03 0.00 0.00 0.00 0.00 36.38 33.08 2d3u s VAL 37 CO 0.68 0.60 0.38 -0.72 0.00 0.00 0.00 175.10 176.05 2d3u s TYR 38 N -0.98 -0.21 -0.06 5.22 1.13 -0.75 -3.65 117.35 118.05 2d3u s TYR 38 Ca 0.16 0.11 0.01 0.00 -1.41 0.00 0.00 57.07 55.94 2d3u s TYR 38 Cb -0.13 0.19 -0.03 0.00 -1.10 0.00 0.00 41.96 40.89 2d3u s TYR 38 CO 0.06 -0.57 -0.06 0.00 -2.51 0.00 0.00 175.55 172.47 2d3u s ALA 39 N -2.68 3.03 0.51 9.51 0.00 -0.04 -1.19 121.76 130.89 2d3u s ALA 39 Ca -0.04 -0.89 -0.20 0.00 0.00 0.00 0.00 51.96 50.83 2d3u s ALA 39 Cb -0.00 -1.25 -0.07 0.00 0.00 0.00 0.00 23.12 21.79 2d3u s ALA 39 CO -0.04 0.58 1.06 0.95 0.00 0.00 0.00 175.76 178.31 2d3u s THR 40 N -0.84 3.68 0.20 0.00 -4.23 0.66 -4.50 115.64 110.62 2d3u s THR 40 Ca 0.13 1.02 0.01 0.00 -1.18 0.00 0.00 61.69 61.67 2d3u s THR 40 Cb -0.11 -3.41 -0.05 0.00 1.34 0.00 0.00 72.50 70.27 2d3u s THR 40 CO 0.02 -0.25 0.04 0.42 -0.54 0.00 0.00 174.62 174.31 2d3u s THR 41 N -2.00 0.60 0.60 3.99 -4.23 -1.26 -3.92 115.64 109.42 2d3u s THR 41 Ca 0.68 -1.99 0.30 0.00 -1.18 0.00 0.00 61.69 59.50 2d3u s THR 41 Cb -0.18 -2.30 0.36 0.00 1.34 0.00 0.00 72.50 71.73 2d3u s THR 41 CO 0.23 -0.30 2.07 0.77 -0.54 0.00 0.00 174.62 176.84 2d3u h SER 42 N 2.59 0.00 0.00 3.99 4.64 -1.85 -1.96 113.55 120.96 2d3u h SER 42 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2d3u h SER 42 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2d3u h SER 42 CO 0.62 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 177.12 2d3u n ARG 43 N -3.63 0.58 -0.03 4.77 5.12 -1.26 -0.95 116.66 121.26 2d3u n ARG 43 Ca 0.02 0.00 0.03 0.00 -1.93 0.00 0.00 57.85 55.97 2d3u n ARG 43 Cb 0.37 -1.41 0.04 0.00 -1.16 0.00 0.00 32.46 30.30 2d3u n ARG 43 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2d3u n SER 44 N -0.91 1.84 0.25 0.55 3.41 -0.74 -4.68 113.62 113.35 2d3u n SER 44 Ca 0.11 -1.53 0.09 0.00 -0.26 0.00 0.00 58.87 57.28 2d3u n SER 44 Cb 0.05 -0.04 0.65 0.00 -0.26 0.00 0.00 64.21 64.61 2d3u n SER 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2d3u h ALA 45 N 1.02 2.01 -0.52 7.33 0.00 -1.17 -1.74 119.26 126.20 2d3u h ALA 45 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2d3u h ALA 45 Cb 0.38 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2d3u h ALA 45 CO 0.00 -0.03 0.15 0.78 0.00 0.00 0.00 179.25 180.15 2d3u h GLY 46 N 0.00 0.83 1.05 0.00 0.00 -1.83 -0.38 103.07 102.74 2d3u h GLY 46 Ca 0.01 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 46.80 2d3u h GLY 46 CO -0.00 0.43 -0.03 1.41 0.00 0.00 0.00 176.54 178.35 2d3u h LEU 47 N 0.75 0.97 -0.56 3.11 3.38 -1.67 -2.57 115.31 118.72 2d3u h LEU 47 Ca 0.17 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 2d3u h LEU 47 Cb 0.24 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2d3u h LEU 47 CO -0.01 1.05 0.06 -0.09 0.09 0.00 0.00 178.44 179.54 2d3u h ARG 48 N 0.86 0.96 -0.68 1.13 9.65 -1.28 -2.67 114.38 122.35 2d3u h ARG 48 Ca 0.15 -0.28 0.06 0.00 -1.10 0.00 0.00 59.98 58.82 2d3u h ARG 48 Cb 0.57 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 29.01 2d3u h ARG 48 CO 0.03 0.93 0.45 1.96 2.80 0.00 0.00 179.97 186.14 2d3u h GLN 49 N 0.85 0.67 -0.33 0.20 4.20 -0.91 -0.89 115.11 118.90 2d3u h GLN 49 Ca 0.17 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 2d3u h GLN 49 Cb 0.46 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2d3u h GLN 49 CO 0.02 0.44 0.07 0.87 -0.67 0.00 0.00 178.83 179.56 2d3u h LYS 50 N 0.69 0.53 -0.52 1.46 6.56 -1.13 -2.72 116.57 121.44 2d3u h LYS 50 Ca 0.29 -0.13 -0.10 0.00 -1.06 0.00 0.00 60.65 59.64 2d3u h LYS 50 Cb 0.27 -0.07 -0.02 0.00 -0.57 0.00 0.00 32.23 31.85 2d3u h LYS 50 CO -0.09 0.60 -0.09 0.87 -2.06 0.00 0.00 179.45 178.69 2d3u h LYS 51 N 0.37 0.96 -0.01 3.15 1.57 -1.01 -3.24 116.57 118.36 2d3u h LYS 51 Ca 0.10 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 2d3u h LYS 51 Cb 0.32 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2d3u h LYS 51 CO 0.00 1.00 -0.02 1.33 -0.57 0.00 0.00 179.45 181.19 2d3u n VAL 52 N -4.16 0.00 -3.48 0.50 0.24 -0.45 -4.79 118.33 106.20 2d3u n VAL 52 Ca 0.02 -0.19 -0.43 0.00 -2.04 0.00 0.00 64.34 61.70 2d3u n VAL 52 Cb 0.38 0.29 -0.10 0.00 -1.47 0.00 0.00 33.84 32.94 2d3u n VAL 52 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2d3u s THR 53 N -2.05 5.14 0.21 3.34 2.01 -1.03 -4.69 115.64 118.57 2d3u s THR 53 Ca 0.38 -0.71 -0.22 0.00 0.31 0.00 0.00 61.69 61.46 2d3u s THR 53 Cb 0.21 -3.87 0.05 0.00 0.01 0.00 0.00 72.50 68.90 2d3u s THR 53 CO 0.36 -0.30 0.69 0.72 -0.69 0.00 0.00 174.62 175.39 2d3u s PHE 54 N 1.66 -0.35 0.21 4.92 -0.12 -1.26 -4.97 117.98 118.07 2d3u s PHE 54 Ca 0.04 0.01 -0.21 0.00 -0.05 0.00 0.00 56.93 56.73 2d3u s PHE 54 Cb -0.19 0.63 -0.08 0.00 -0.63 0.00 0.00 43.02 42.75 2d3u s PHE 54 CO 0.09 -1.02 0.73 0.34 -0.05 0.00 0.00 175.22 175.31 2d3u s ASP 55 N -2.83 7.13 0.03 1.98 2.15 -1.26 -0.83 116.67 123.03 2d3u s ASP 55 Ca 0.06 1.47 0.06 0.00 0.43 0.00 0.00 52.55 54.57 2d3u s ASP 55 Cb -0.03 -2.44 -0.03 0.00 -0.30 0.00 0.00 42.92 40.12 2d3u s ASP 55 CO -0.03 0.07 -0.16 -0.13 -0.17 0.00 0.00 175.17 174.75 2d3u s ARG 56 N -1.79 2.17 0.03 4.34 3.00 -0.93 -4.95 118.95 120.82 2d3u s ARG 56 Ca 0.41 -0.92 0.02 0.00 0.00 0.00 0.00 55.73 55.24 2d3u s ARG 56 Cb -0.18 -2.24 -0.02 0.00 0.00 0.00 0.00 34.95 32.51 2d3u s ARG 56 CO 0.22 0.56 -0.07 -0.51 0.00 0.00 0.00 175.30 175.49 2d3u s LEU 57 N -1.35 2.22 -0.01 2.53 1.02 -1.26 -4.27 118.68 117.56 2d3u s LEU 57 Ca 0.15 -0.47 0.00 0.00 0.02 0.00 0.00 54.13 53.82 2d3u s LEU 57 Cb -0.11 -0.17 0.01 0.00 0.02 0.00 0.00 46.19 45.94 2d3u s LEU 57 CO 0.05 -0.16 0.01 -1.10 0.02 0.00 0.00 176.35 175.16 2d3u s GLN 58 N -1.34 -0.01 -0.30 1.70 -0.21 -1.26 -4.03 119.66 114.21 2d3u s GLN 58 Ca -0.08 0.06 0.02 0.00 0.02 0.00 0.00 55.36 55.37 2d3u s GLN 58 Cb -0.09 -0.08 0.09 0.00 1.00 0.00 0.00 33.01 33.94 2d3u s GLN 58 CO 0.00 -0.05 0.04 0.08 -2.12 0.00 0.00 175.29 173.24 2d3u s VAL 59 N 0.32 1.61 -0.29 1.09 1.01 -0.59 -5.04 120.40 118.51 2d3u s VAL 59 Ca -0.03 -1.72 -0.13 0.00 0.00 0.00 0.00 61.98 60.10 2d3u s VAL 59 Cb -0.04 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 2d3u s VAL 59 CO -0.01 -0.48 0.29 -0.76 0.00 0.00 0.00 175.10 174.14 2d3u s LEU 60 N 1.28 4.12 0.00 3.92 1.43 -1.26 -4.48 118.68 123.68 2d3u s LEU 60 Ca 0.06 0.05 0.06 0.00 -1.03 0.00 0.00 54.13 53.27 2d3u s LEU 60 Cb -0.18 -2.27 0.06 0.00 0.03 0.00 0.00 46.19 43.82 2d3u s LEU 60 CO -0.13 -0.15 0.50 -0.90 0.23 0.00 0.00 176.35 175.89 2d3u n ASP 61 N 5.22 1.27 0.14 2.29 5.75 -1.26 -4.99 116.55 124.98 2d3u n ASP 61 Ca -0.11 -1.93 0.00 0.00 -0.01 0.00 0.00 54.79 52.74 2d3u n ASP 61 Cb 0.51 -0.27 0.27 0.00 -1.03 0.00 0.00 41.12 40.60 2d3u n ASP 61 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2d3u h ASP 62 N 0.04 0.09 -0.79 -1.12 3.32 -1.99 -2.64 116.42 113.33 2d3u h ASP 62 Ca -0.17 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 56.88 2d3u h ASP 62 Cb 0.76 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.24 2d3u h ASP 62 CO 0.24 0.52 0.50 0.45 -1.72 0.00 0.00 179.24 179.23 2d3u h HIS 63 N 0.07 0.94 0.06 4.55 3.86 -1.96 0.25 115.15 122.93 2d3u h HIS 63 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2d3u h HIS 63 Cb 0.81 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.96 2d3u h HIS 63 CO 0.01 0.53 -0.06 -0.92 0.86 0.00 0.00 177.93 178.35 2d3u h TYR 64 N 0.97 -0.15 -0.08 2.45 5.03 -1.79 -2.00 116.97 121.41 2d3u h TYR 64 Ca 0.32 0.00 -0.09 0.00 2.58 0.00 0.00 58.73 61.54 2d3u h TYR 64 Cb 0.03 0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.35 2d3u h TYR 64 CO -0.03 -0.09 -0.35 0.00 -1.32 0.00 0.00 178.16 176.37 2d3u h ARG 65 N -0.13 0.15 -0.24 1.82 3.08 -1.18 -1.71 114.38 116.17 2d3u h ARG 65 Ca 0.00 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 2d3u h ARG 65 Cb 0.13 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2d3u h ARG 65 CO -0.02 0.49 0.09 -0.44 -1.07 0.00 0.00 179.97 179.02 2d3u h ASP 66 N 0.13 0.34 -0.49 7.04 3.32 -0.26 -0.79 116.42 125.71 2d3u h ASP 66 Ca 0.02 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 2d3u h ASP 66 Cb 0.69 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 2d3u h ASP 66 CO 0.05 0.43 0.12 0.58 -1.72 0.00 0.00 179.24 178.70 2d3u h VAL 67 N 0.24 1.24 -0.77 -1.35 2.07 -1.24 -1.97 116.25 114.46 2d3u h VAL 67 Ca 0.08 -0.85 0.02 0.00 0.82 0.00 0.00 66.70 66.77 2d3u h VAL 67 Cb 0.20 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 2d3u h VAL 67 CO -0.00 0.30 0.50 0.25 0.02 0.00 0.00 177.57 178.64 2d3u h LEU 68 N 0.67 0.85 -0.88 2.57 5.85 -1.13 -0.50 115.31 122.74 2d3u h LEU 68 Ca 0.15 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 2d3u h LEU 68 Cb 0.33 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 2d3u h LEU 68 CO 0.00 0.60 0.54 0.50 -0.34 0.00 0.00 178.44 179.75 2d3u h LYS 69 N 1.00 1.18 -0.47 1.25 3.64 -0.76 -0.46 116.57 121.96 2d3u h LYS 69 Ca 0.30 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.55 2d3u h LYS 69 Cb -0.05 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.49 2d3u h LYS 69 CO -0.09 0.82 0.19 0.93 -2.27 0.00 0.00 179.45 179.03 2d3u h GLU 70 N 1.20 0.70 -0.72 1.90 5.08 -0.64 -1.71 114.58 120.38 2d3u h GLU 70 Ca 0.32 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2d3u h GLU 70 Cb -0.07 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.03 2d3u h GLU 70 CO -0.06 0.63 0.39 0.52 -1.00 0.00 0.00 179.01 179.49 2d3u h MET 71 N 0.61 1.01 -0.47 2.33 2.86 -0.54 -2.41 114.93 118.33 2d3u h MET 71 Ca 0.16 -0.12 -0.09 0.00 -2.06 0.00 0.00 59.70 57.59 2d3u h MET 71 Cb 0.19 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 2d3u h MET 71 CO -0.01 0.76 -0.06 0.87 1.06 0.00 0.00 176.91 179.52 2d3u h LYS 72 N 1.00 0.81 -0.53 1.72 1.57 -0.91 0.06 116.57 120.29 2d3u h LYS 72 Ca 0.25 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2d3u h LYS 72 Cb 0.04 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 2d3u h LYS 72 CO -0.04 0.85 0.35 0.00 -0.57 0.00 0.00 179.45 180.04 2d3u h ALA 73 N 1.19 0.67 -0.37 3.86 0.00 -0.95 0.23 119.26 123.89 2d3u h ALA 73 Ca 0.13 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 2d3u h ALA 73 Cb 0.54 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2d3u h ALA 73 CO 0.03 0.12 -0.39 0.87 0.00 0.00 0.00 179.25 179.87 2d3u h LYS 74 N 0.72 0.90 -0.35 0.00 1.57 -1.22 -2.95 116.57 115.24 2d3u h LYS 74 Ca 0.19 -0.47 -0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2d3u h LYS 74 Cb -0.08 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 2d3u h LYS 74 CO -0.04 1.12 0.20 0.00 -0.57 0.00 0.00 179.45 180.16 2d3u h ALA 75 N 0.81 1.69 0.00 3.86 0.00 -0.42 -1.41 119.26 123.79 2d3u h ALA 75 Ca 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2d3u h ALA 75 Cb 0.98 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2d3u h ALA 75 CO 0.09 0.27 0.00 0.43 0.00 0.00 0.00 179.25 180.04 2d3u n SER 76 N -4.45 0.39 -0.08 0.00 7.64 0.02 -1.45 113.62 115.68 2d3u n SER 76 Ca 0.02 0.65 0.13 0.00 1.01 0.00 0.00 58.87 60.68 2d3u n SER 76 Cb 0.09 -0.71 0.37 0.00 -1.01 0.00 0.00 64.21 62.95 2d3u n SER 76 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2d3u n THR 77 N -1.99 0.00 -3.13 0.44 -2.24 -0.53 -4.64 114.28 102.18 2d3u n THR 77 Ca 0.00 -0.04 -0.39 0.00 -2.27 0.00 0.00 64.05 61.35 2d3u n THR 77 Cb 0.08 0.16 -0.05 0.00 -2.10 0.00 0.00 70.33 68.41 2d3u n THR 77 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2d3u s VAL 78 N -2.80 4.88 -0.16 2.28 1.01 -0.53 -4.95 120.40 120.12 2d3u s VAL 78 Ca 0.17 1.36 0.01 0.00 0.00 0.00 0.00 61.98 63.52 2d3u s VAL 78 Cb 0.18 -3.99 0.01 0.00 0.00 0.00 0.00 36.38 32.59 2d3u s VAL 78 CO 0.60 0.39 -0.19 -0.75 0.00 0.00 0.00 175.10 175.16 2d3u s LYS 79 N -0.06 3.07 0.09 2.72 2.20 -1.26 0.11 119.74 126.61 2d3u s LYS 79 Ca 0.33 -0.81 0.10 0.00 -0.36 0.00 0.00 55.97 55.24 2d3u s LYS 79 Cb -0.19 -2.57 -0.03 0.00 -1.51 0.00 0.00 37.83 33.53 2d3u s LYS 79 CO 0.19 -0.10 -0.26 0.00 -0.36 0.00 0.00 175.35 174.82 2d3u s ALA 80 N 1.05 2.24 0.08 3.13 0.00 -0.64 -4.92 121.76 122.70 2d3u s ALA 80 Ca -0.01 -1.34 0.02 0.00 0.00 0.00 0.00 51.96 50.63 2d3u s ALA 80 Cb -0.14 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 2d3u s ALA 80 CO -0.06 0.51 0.15 -1.59 0.00 0.00 0.00 175.76 174.77 2d3u s LYS 81 N -1.66 3.13 -0.05 0.00 -2.85 -1.26 -4.47 119.74 112.59 2d3u s LYS 81 Ca 0.12 -0.60 -0.28 0.00 -1.00 0.00 0.00 55.97 54.22 2d3u s LYS 81 Cb -0.10 -2.86 -0.03 0.00 -2.06 0.00 0.00 37.83 32.78 2d3u s LYS 81 CO 0.04 0.58 0.89 -1.17 0.10 0.00 0.00 175.35 175.78 2d3u s LEU 82 N -2.53 4.32 0.34 2.77 2.96 -1.26 -4.53 118.68 120.75 2d3u s LEU 82 Ca 0.32 1.47 -0.18 0.00 -0.22 0.00 0.00 54.13 55.51 2d3u s LEU 82 Cb -0.12 -3.40 -0.10 0.00 0.50 0.00 0.00 46.19 43.07 2d3u s LEU 82 CO 0.25 -0.25 0.81 -0.76 -1.32 0.00 0.00 176.35 175.08 2d3u s LEU 83 N 1.17 4.09 0.82 -0.68 1.02 0.46 -5.03 118.68 120.53 2d3u s LEU 83 Ca 0.46 1.46 -0.12 0.00 0.02 0.00 0.00 54.13 55.96 2d3u s LEU 83 Cb -0.19 -4.15 0.08 0.00 0.02 0.00 0.00 46.19 41.95 2d3u s LEU 83 CO 0.23 -0.21 1.15 -0.94 0.02 0.00 0.00 176.35 176.60 2d3u s SER 84 N -2.11 4.43 0.09 2.29 1.04 -1.26 -4.65 113.70 113.53 2d3u s SER 84 Ca 0.55 0.90 -0.24 0.00 0.48 0.00 0.00 55.95 57.64 2d3u s SER 84 Cb -0.11 -1.47 -0.14 0.00 0.10 0.00 0.00 66.02 64.39 2d3u s SER 84 CO 0.17 -1.97 1.72 0.58 0.98 0.00 0.00 173.24 174.73 2d3u h VAL 85 N -1.10 0.89 -0.70 5.02 2.07 -1.97 -1.90 116.25 118.56 2d3u h VAL 85 Ca -0.47 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 2d3u h VAL 85 Cb 1.32 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 2d3u h VAL 85 CO 0.64 0.00 0.41 -0.33 0.02 0.00 0.00 177.57 178.32 2d3u h GLU 86 N -0.11 0.96 0.21 1.57 3.07 -1.97 0.92 114.58 119.23 2d3u h GLU 86 Ca 0.00 -0.09 -0.01 0.00 -0.50 0.00 0.00 59.36 58.76 2d3u h GLU 86 Cb 0.10 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 2d3u h GLU 86 CO -0.01 0.68 -0.10 0.93 -1.40 0.00 0.00 179.01 179.11 2d3u h GLU 87 N 0.97 -0.27 -0.84 2.33 5.08 -1.89 -2.02 114.58 117.94 2d3u h GLU 87 Ca 0.25 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.69 2d3u h GLU 87 Cb -0.02 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.23 2d3u h GLU 87 CO -0.05 -0.12 0.52 0.00 -1.00 0.00 0.00 179.01 178.37 2d3u h ALA 88 N 0.41 1.15 -0.63 3.43 0.00 -1.03 -1.54 119.26 121.06 2d3u h ALA 88 Ca -0.03 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 54.97 2d3u h ALA 88 Cb 0.28 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 2d3u h ALA 88 CO 0.05 0.26 0.24 0.00 0.00 0.00 0.00 179.25 179.80 2d3u h LYS 90 N 0.42 0.00 -0.07 0.00 1.79 -0.54 -1.19 116.57 116.98 2d3u h LYS 90 Ca 0.32 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.79 2d3u h LYS 90 Cb 0.40 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.05 2d3u h LYS 90 CO -0.32 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.33 2d3u n LEU 91 N -3.90 0.86 -4.70 2.94 4.77 -0.62 -4.87 117.00 111.48 2d3u n LEU 91 Ca 0.01 -0.35 -0.41 0.00 -0.03 0.00 0.00 56.01 55.23 2d3u n LEU 91 Cb 0.28 -0.05 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2d3u n LEU 91 CO 0.28 0.17 0.57 -0.89 -1.33 0.00 0.00 177.39 176.20 2d3u s THR 92 N -1.91 4.93 0.35 -5.08 2.01 -0.45 -1.15 115.64 114.34 2d3u s THR 92 Ca 0.32 1.74 -0.29 0.00 0.31 0.00 0.00 61.69 63.78 2d3u s THR 92 Cb 0.16 -4.18 -0.11 0.00 0.01 0.00 0.00 72.50 68.38 2d3u s THR 92 CO 0.26 0.15 1.50 -2.65 -0.69 0.00 0.00 174.62 173.19 2d3u n PRO 93 N 4.24 2.63 -0.27 4.92 -0.02 -1.26 -4.77 135.00 140.47 2d3u n PRO 93 Ca 0.03 0.93 0.25 0.00 -2.02 0.00 0.00 63.50 62.69 2d3u n PRO 93 Cb 0.50 -2.66 0.60 0.00 -0.02 0.00 0.00 33.50 31.92 2d3u n PRO 93 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2d3u h PRO 94 N 3.48 0.24 -0.43 0.52 0.11 -1.95 -1.77 132.00 132.20 2d3u h PRO 94 Ca -0.49 -0.01 -0.31 0.00 0.11 0.00 0.00 66.00 65.30 2d3u h PRO 94 Cb 1.24 -0.05 -0.23 0.00 0.11 0.00 0.00 31.00 32.07 2d3u h PRO 94 CO 0.69 0.16 -0.58 0.72 -0.21 0.00 0.00 178.00 178.77 2d3u n HIS 95 N -4.44 1.54 -1.89 0.65 8.25 -1.26 -4.28 115.22 113.78 2d3u n HIS 95 Ca 0.22 -1.91 -0.34 0.00 -0.26 0.00 0.00 57.72 55.43 2d3u n HIS 95 Cb 0.91 -0.35 0.04 0.00 1.12 0.00 0.00 29.99 31.71 2d3u n HIS 95 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2d3u s SER 96 N -3.32 5.14 0.10 0.41 0.15 -0.67 -4.90 113.70 110.61 2d3u s SER 96 Ca 0.46 2.18 -0.35 0.00 0.70 0.00 0.00 55.95 58.94 2d3u s SER 96 Cb 0.40 -2.57 -0.14 0.00 -1.71 0.00 0.00 66.02 61.99 2d3u s SER 96 CO -0.01 -1.62 1.58 0.00 1.20 0.00 0.00 173.24 174.39 2d3u n ALA 97 N -2.01 0.81 -1.53 5.45 0.00 -1.26 -4.20 120.51 117.77 2d3u n ALA 97 Ca 0.12 0.44 -0.35 0.00 0.00 0.00 0.00 53.44 53.64 2d3u n ALA 97 Cb 0.51 -2.32 0.08 0.00 0.00 0.00 0.00 19.45 17.72 2d3u n ALA 97 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2d3u s LYS 98 N 1.34 2.40 0.71 0.00 -2.85 -1.26 -4.60 119.74 115.49 2d3u s LYS 98 Ca 0.82 1.84 -0.12 0.00 -1.00 0.00 0.00 55.97 57.52 2d3u s LYS 98 Cb -0.75 -1.86 0.02 0.00 -2.06 0.00 0.00 37.83 33.19 2d3u s LYS 98 CO 0.42 -1.65 1.08 0.45 0.10 0.00 0.00 175.35 175.75 2d3u s SER 99 N -1.80 5.02 0.00 0.03 0.15 0.75 -4.71 113.70 113.14 2d3u s SER 99 Ca 0.77 1.79 0.25 0.00 0.70 0.00 0.00 55.95 59.45 2d3u s SER 99 Cb -0.31 -2.52 1.13 0.00 -1.71 0.00 0.00 66.02 62.60 2d3u s SER 99 CO 0.41 -1.69 1.77 0.29 1.20 0.00 0.00 173.24 175.22 2d3u n LYS 100 N -3.05 1.43 -0.84 5.44 5.02 -1.26 -4.02 118.16 120.88 2d3u n LYS 100 Ca 0.09 -0.64 -0.06 0.00 -2.02 0.00 0.00 58.31 55.69 2d3u n LYS 100 Cb 0.53 -1.42 0.22 0.00 -0.02 0.00 0.00 35.03 34.34 2d3u n LYS 100 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2d3u n PHE 101 N -0.19 1.61 -0.51 2.13 3.72 -1.26 -4.96 117.46 118.01 2d3u n PHE 101 Ca 0.18 -1.45 0.00 0.00 -0.05 0.00 0.00 57.45 56.13 2d3u n PHE 101 Cb 0.24 -0.57 0.00 0.00 -0.94 0.00 0.00 39.48 38.22 2d3u n PHE 101 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2d3u n GLY 102 N -0.88 0.89 3.55 1.37 0.00 -1.26 -5.06 105.19 103.81 2d3u n GLY 102 Ca 0.37 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 2d3u n GLY 102 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2d3u s TYR 103 N -2.00 -0.41 0.17 1.61 -0.85 -1.26 -4.99 117.35 109.62 2d3u s TYR 103 Ca 0.00 0.11 0.01 0.00 -0.52 0.00 0.00 57.07 56.67 2d3u s TYR 103 Cb 0.00 0.59 -0.00 0.00 0.38 0.00 0.00 41.96 42.93 2d3u s TYR 103 CO 0.00 -0.97 0.03 0.41 -1.52 0.00 0.00 175.55 173.50 2d3u n GLY 104 N -0.40 3.88 0.37 5.49 0.00 -1.26 -0.18 105.19 113.09 2d3u n GLY 104 Ca -0.13 -2.13 0.11 0.00 0.00 0.00 0.00 46.02 43.87 2d3u n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d3u h ALA 105 N 1.17 1.82 0.36 4.61 0.00 -1.83 -2.11 119.26 123.29 2d3u h ALA 105 Ca -0.14 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2d3u h ALA 105 Cb 0.46 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2d3u h ALA 105 CO 0.22 -0.02 -0.17 0.87 0.00 0.00 0.00 179.25 180.15 2d3u h LYS 106 N 0.69 -0.47 -0.98 0.00 1.79 -1.88 0.35 116.57 116.07 2d3u h LYS 106 Ca 0.40 0.03 0.19 0.00 -2.18 0.00 0.00 60.65 59.09 2d3u h LYS 106 Cb 0.60 0.11 -0.11 0.00 -1.58 0.00 0.00 32.23 31.25 2d3u h LYS 106 CO -0.17 -0.25 0.57 -0.44 -1.08 0.00 0.00 179.45 178.08 2d3u h ASP 107 N -0.59 0.72 0.02 0.86 3.32 -1.80 0.94 116.42 119.89 2d3u h ASP 107 Ca -0.05 0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2d3u h ASP 107 Cb 0.44 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.96 2d3u h ASP 107 CO 0.08 0.25 -0.01 0.58 -1.72 0.00 0.00 179.24 178.43 2d3u h VAL 108 N 0.72 1.31 -0.44 -1.35 2.07 -1.11 0.12 116.25 117.58 2d3u h VAL 108 Ca 0.56 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 2d3u h VAL 108 Cb 0.87 1.97 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 2d3u h VAL 108 CO -0.39 0.25 0.18 0.03 0.02 0.00 0.00 177.57 177.66 2d3u h ARG 109 N -0.45 0.62 -0.43 1.57 3.08 -0.10 -1.29 114.38 117.39 2d3u h ARG 109 Ca -0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2d3u h ARG 109 Cb 0.43 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2d3u h ARG 109 CO 0.00 0.51 0.00 0.09 -1.07 0.00 0.00 179.97 179.50 2d3u n ASN 110 N -4.37 1.79 -3.19 7.04 3.02 0.25 -4.79 115.26 115.01 2d3u n ASN 110 Ca 0.03 -2.09 -0.21 0.00 -0.03 0.00 0.00 54.58 52.28 2d3u n ASN 110 Cb 0.14 -0.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.03 2d3u n ASN 110 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2d3u n LEU 111 N 0.27 -1.62 -4.76 3.41 4.77 -0.49 -4.89 117.00 113.70 2d3u n LEU 111 Ca 0.09 -0.29 -0.40 0.00 -0.03 0.00 0.00 56.01 55.38 2d3u n LEU 111 Cb 0.33 -2.22 0.02 0.00 -2.33 0.00 0.00 43.42 39.22 2d3u n LEU 111 CO 0.08 0.13 1.05 -1.54 -1.33 0.00 0.00 177.39 175.78 2d3u n SER 112 N -2.24 3.24 -0.14 -1.43 3.41 0.41 -4.77 113.62 112.09 2d3u n SER 112 Ca -0.04 1.11 0.04 0.00 -0.26 0.00 0.00 58.87 59.72 2d3u n SER 112 Cb 0.56 -1.59 0.35 0.00 -0.26 0.00 0.00 64.21 63.26 2d3u n SER 112 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2d3u h SER 113 N 2.23 0.65 -0.29 4.04 4.64 -1.90 -0.58 113.55 122.35 2d3u h SER 113 Ca -0.51 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 60.80 2d3u h SER 113 Cb 1.27 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 2d3u h SER 113 CO 0.61 0.45 0.17 0.50 -0.87 0.00 0.00 176.83 177.68 2d3u h LYS 114 N 0.76 0.39 0.12 4.77 3.64 -1.94 0.25 116.57 124.55 2d3u h LYS 114 Ca 0.25 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 2d3u h LYS 114 Cb 0.07 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 2d3u h LYS 114 CO -0.07 0.32 -0.06 0.00 -2.27 0.00 0.00 179.45 177.37 2d3u h ALA 115 N 1.05 -0.16 -0.78 5.00 0.00 -1.78 -2.46 119.26 120.14 2d3u h ALA 115 Ca 0.10 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 54.93 2d3u h ALA 115 Cb 0.03 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.81 2d3u h ALA 115 CO -0.02 -0.40 0.41 0.28 0.00 0.00 0.00 179.25 179.52 2d3u h VAL 116 N -0.53 0.84 -0.47 0.00 2.07 -1.00 -0.99 116.25 116.16 2d3u h VAL 116 Ca -0.02 -0.23 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 2d3u h VAL 116 Cb 0.42 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 2d3u h VAL 116 CO 0.03 0.12 -0.11 0.78 0.02 0.00 0.00 177.57 178.41 2d3u h ASN 117 N 0.66 0.91 -0.57 0.57 2.35 -0.51 -2.08 115.58 116.91 2d3u h ASN 117 Ca 0.39 -0.36 -0.09 0.00 -0.55 0.00 0.00 56.30 55.69 2d3u h ASN 117 Cb 0.43 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 2d3u h ASN 117 CO -0.29 1.06 -0.00 -0.74 -1.65 0.00 0.00 177.43 175.81 2d3u h HIS 118 N 0.75 1.12 -0.57 1.19 2.76 -0.92 -1.86 115.15 117.63 2d3u h HIS 118 Ca 0.12 -0.19 -0.02 0.00 -2.20 0.00 0.00 60.37 58.09 2d3u h HIS 118 Cb 0.65 -0.29 -0.03 0.00 1.55 0.00 0.00 27.41 29.29 2d3u h HIS 118 CO 0.05 0.99 0.29 0.82 -1.30 0.00 0.00 177.93 178.78 2d3u h ILE 119 N 0.94 1.18 -0.27 6.26 2.04 -1.08 0.31 117.51 126.89 2d3u h ILE 119 Ca 0.17 -0.49 -0.12 0.00 1.00 0.00 0.00 64.86 65.42 2d3u h ILE 119 Cb 0.55 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 2d3u h ILE 119 CO 0.03 0.21 -0.33 0.45 0.00 0.00 0.00 178.15 178.50 2d3u h HIS 120 N 0.79 0.67 -0.20 1.37 3.86 -0.94 -1.61 115.15 119.09 2d3u h HIS 120 Ca 0.20 -0.17 -0.16 0.00 -1.16 0.00 0.00 60.37 59.07 2d3u h HIS 120 Cb 0.06 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 2d3u h HIS 120 CO 0.01 0.84 -0.55 0.66 0.86 0.00 0.00 177.93 179.75 2d3u h SER 121 N 0.49 0.67 -0.36 2.45 4.64 -0.44 -2.01 113.55 118.99 2d3u h SER 121 Ca 0.05 -0.36 -0.02 0.00 -0.47 0.00 0.00 61.79 61.00 2d3u h SER 121 Cb 0.82 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 2d3u h SER 121 CO 0.07 1.08 0.15 0.58 -0.87 0.00 0.00 176.83 177.84 2d3u h VAL 122 N 0.46 1.18 -0.75 0.95 2.07 -0.79 -1.44 116.25 117.93 2d3u h VAL 122 Ca 0.01 -0.54 0.03 0.00 0.82 0.00 0.00 66.70 67.01 2d3u h VAL 122 Cb 1.10 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 2d3u h VAL 122 CO 0.11 0.19 0.48 -0.25 0.02 0.00 0.00 177.57 178.12 2d3u h TRP 123 N 0.44 0.90 -0.40 1.57 2.91 -1.19 0.41 115.95 120.59 2d3u h TRP 123 Ca 0.12 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.15 2d3u h TRP 123 Cb 0.16 -0.30 -0.02 0.00 -0.51 0.00 0.00 29.16 28.49 2d3u h TRP 123 CO -0.01 0.53 0.19 -0.22 -1.03 0.00 0.00 178.44 177.91 2d3u h LYS 124 N 0.95 0.58 -0.97 2.65 3.64 -1.14 -1.56 116.57 120.72 2d3u h LYS 124 Ca 0.29 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.60 2d3u h LYS 124 Cb -0.02 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 31.65 2d3u h LYS 124 CO -0.10 0.51 0.63 0.22 -2.27 0.00 0.00 179.45 178.44 2d3u h ASP 125 N 0.51 1.13 -0.45 4.20 3.58 -0.53 -0.37 116.42 124.48 2d3u h ASP 125 Ca 0.14 -0.04 0.03 0.00 0.42 0.00 0.00 57.03 57.58 2d3u h ASP 125 Cb 0.12 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 40.85 2d3u h ASP 125 CO -0.02 0.83 0.24 -0.07 -2.88 0.00 0.00 179.24 177.34 2d3u h LEU 126 N 1.32 0.35 -1.23 2.28 3.38 -0.38 0.16 115.31 121.19 2d3u h LEU 126 Ca 0.35 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.27 2d3u h LEU 126 Cb -0.13 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2d3u h LEU 126 CO -0.07 0.25 -0.36 -0.07 0.09 0.00 0.00 178.44 178.28 2d3u h LEU 127 N 0.47 0.00 0.00 1.67 3.38 -0.55 -3.26 115.31 117.03 2d3u h LEU 127 Ca 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 2d3u h LEU 127 Cb 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2d3u h LEU 127 CO -0.13 0.36 -1.64 -0.62 0.09 0.00 0.00 178.44 176.51 2d3u n GLU 128 N -3.85 0.64 -3.98 1.13 1.02 -0.22 -4.87 120.64 110.50 2d3u n GLU 128 Ca -0.01 -0.08 -0.29 0.00 -0.02 0.00 0.00 57.16 56.76 2d3u n GLU 128 Cb 0.43 -1.63 -0.17 0.00 -0.02 0.00 0.00 31.44 30.05 2d3u n GLU 128 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2d3u s ASP 129 N -4.83 2.48 -0.17 1.62 -1.08 0.51 -5.01 116.67 110.18 2d3u s ASP 129 Ca -0.05 -0.41 0.15 0.00 -0.52 0.00 0.00 52.55 51.72 2d3u s ASP 129 Cb 0.12 -1.05 0.37 0.00 -1.46 0.00 0.00 42.92 40.91 2d3u s ASP 129 CO 0.87 -0.08 1.22 0.35 0.52 0.00 0.00 175.17 178.05 2d3u n THR 130 N 4.83 2.08 0.00 1.71 -2.24 -1.26 -4.55 114.28 114.84 2d3u n THR 130 Ca -0.15 -2.59 0.00 0.00 -2.27 0.00 0.00 64.05 59.03 2d3u n THR 130 Cb 0.50 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 2d3u n THR 130 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2d3u n VAL 131 N -1.23 0.00 -2.17 2.28 0.24 -1.26 -4.60 118.33 111.59 2d3u n VAL 131 Ca 0.19 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 62.06 2d3u n VAL 131 Cb 0.71 -0.26 -0.02 0.00 -1.47 0.00 0.00 33.84 32.79 2d3u n VAL 131 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2d3u s THR 132 N -1.26 3.84 0.33 3.34 2.01 -1.26 -4.74 115.64 117.90 2d3u s THR 132 Ca 0.00 1.00 -0.28 0.00 0.31 0.00 0.00 61.69 62.72 2d3u s THR 132 Cb 0.00 -3.71 -0.13 0.00 0.01 0.00 0.00 72.50 68.67 2d3u s THR 132 CO 0.00 -0.16 1.15 -2.65 -0.69 0.00 0.00 174.62 172.27 2d3u n PRO 133 N 7.11 1.75 -3.62 4.92 -0.02 -1.26 -4.66 135.00 139.21 2d3u n PRO 133 Ca 0.17 0.61 -0.37 0.00 -2.02 0.00 0.00 63.50 61.89 2d3u n PRO 133 Cb 0.44 -2.10 -0.06 0.00 -0.02 0.00 0.00 33.50 31.75 2d3u n PRO 133 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2d3u s ILE 134 N -1.09 5.25 0.48 4.25 1.01 0.49 -4.97 121.20 126.62 2d3u s ILE 134 Ca 0.57 0.56 -0.23 0.00 0.00 0.00 0.00 60.65 61.56 2d3u s ILE 134 Cb -0.62 -3.59 -0.07 0.00 0.01 0.00 0.00 42.46 38.18 2d3u s ILE 134 CO 0.61 0.53 1.23 -0.62 0.00 0.00 0.00 174.94 176.70 2d3u s ASP 135 N -0.60 5.94 0.09 3.58 2.15 -1.26 -4.36 116.67 122.20 2d3u s ASP 135 Ca 0.19 2.47 0.03 0.00 0.43 0.00 0.00 52.55 55.67 2d3u s ASP 135 Cb -0.14 -2.62 -0.04 0.00 -0.30 0.00 0.00 42.92 39.83 2d3u s ASP 135 CO 0.08 -1.09 -0.09 0.42 -0.17 0.00 0.00 175.17 174.32 2d3u s THR 136 N -1.45 0.82 -0.06 1.71 -4.23 -1.14 -4.26 115.64 107.03 2d3u s THR 136 Ca 0.65 -1.62 -0.01 0.00 -1.18 0.00 0.00 61.69 59.53 2d3u s THR 136 Cb -0.33 -1.32 -0.03 0.00 1.34 0.00 0.00 72.50 72.16 2d3u s THR 136 CO 0.40 -0.61 0.02 -0.89 -0.54 0.00 0.00 174.62 173.00 2d3u s THR 137 N -2.55 4.42 -0.14 3.99 2.01 0.71 -1.00 115.64 123.08 2d3u s THR 137 Ca 0.04 -0.30 0.02 0.00 0.31 0.00 0.00 61.69 61.76 2d3u s THR 137 Cb -0.02 -2.90 0.00 0.00 0.01 0.00 0.00 72.50 69.59 2d3u s THR 137 CO -0.01 0.53 -0.19 -0.51 -0.69 0.00 0.00 174.62 173.75 2d3u s ILE 138 N -0.97 2.35 0.16 1.82 2.07 -0.33 -1.44 121.20 124.85 2d3u s ILE 138 Ca 0.16 -0.88 0.04 0.00 -1.41 0.00 0.00 60.65 58.55 2d3u s ILE 138 Cb -0.11 -1.96 -0.05 0.00 0.13 0.00 0.00 42.46 40.47 2d3u s ILE 138 CO 0.05 0.53 -0.07 -0.04 -1.91 0.00 0.00 174.94 173.50 2d3u s MET 139 N 0.78 1.10 -0.16 3.50 -1.94 -0.40 -4.42 119.30 117.76 2d3u s MET 139 Ca -0.07 -1.49 -0.10 0.00 -1.71 0.00 0.00 55.69 52.32 2d3u s MET 139 Cb -0.16 -0.58 -0.05 0.00 2.01 0.00 0.00 34.83 36.06 2d3u s MET 139 CO -0.00 0.02 0.17 0.00 -0.01 0.00 0.00 175.02 175.20 2d3u s ALA 140 N -3.38 3.74 0.36 3.03 0.00 -1.26 -0.68 121.76 123.56 2d3u s ALA 140 Ca 0.19 -0.62 -0.26 0.00 0.00 0.00 0.00 51.96 51.27 2d3u s ALA 140 Cb 0.03 -2.15 -0.09 0.00 0.00 0.00 0.00 23.12 20.92 2d3u s ALA 140 CO 0.02 0.31 1.07 0.15 0.00 0.00 0.00 175.76 177.30 2d3u s LYS 141 N -0.11 4.31 -0.46 0.00 1.02 -0.13 -4.69 119.74 119.69 2d3u s LYS 141 Ca 0.12 1.61 -0.10 0.00 0.02 0.00 0.00 55.97 57.62 2d3u s LYS 141 Cb -0.12 -2.76 0.10 0.00 -0.52 0.00 0.00 37.83 34.54 2d3u s LYS 141 CO 0.01 -0.03 0.33 -0.80 -0.92 0.00 0.00 175.35 173.95 2d3u s ASN 142 N -1.33 5.76 0.10 2.83 0.02 -1.26 -4.39 114.94 116.67 2d3u s ASN 142 Ca 0.53 -1.71 0.08 0.00 -1.02 0.00 0.00 52.86 50.74 2d3u s ASN 142 Cb -0.25 -2.03 -0.03 0.00 0.02 0.00 0.00 41.25 38.95 2d3u s ASN 142 CO 0.32 -0.65 -0.20 -1.61 0.02 0.00 0.00 177.10 174.99 2d3u s GLU 143 N 1.43 1.07 -0.14 -0.60 2.02 -1.25 -4.84 118.70 116.39 2d3u s GLU 143 Ca 0.04 -1.13 -0.07 0.00 0.02 0.00 0.00 54.97 53.83 2d3u s GLU 143 Cb -0.25 -1.28 -0.04 0.00 0.10 0.00 0.00 34.13 32.65 2d3u s GLU 143 CO 0.01 0.29 0.10 0.08 0.02 0.00 0.00 175.26 175.77 2d3u s VAL 144 N -1.21 5.17 0.31 2.63 1.01 -1.26 -0.25 120.40 126.81 2d3u s VAL 144 Ca 0.05 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2d3u s VAL 144 Cb -0.10 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 2d3u s VAL 144 CO 0.04 0.55 0.36 -0.36 0.00 0.00 0.00 175.10 175.69 2d3u s PHE 145 N -0.46 1.26 -0.08 5.22 0.08 -0.33 -4.68 117.98 118.99 2d3u s PHE 145 Ca 0.11 -1.39 -0.01 0.00 0.12 0.00 0.00 56.93 55.76 2d3u s PHE 145 Cb -0.12 -0.35 -0.03 0.00 -0.57 0.00 0.00 43.02 41.95 2d3u s PHE 145 CO 0.02 -0.96 -0.02 0.00 -0.10 0.00 0.00 175.22 174.15 2d3u s VAL 147 N -0.84 2.79 -0.85 0.00 -7.23 0.50 -4.99 120.40 109.76 2d3u s VAL 147 Ca 0.13 0.27 -0.02 0.00 -1.81 0.00 0.00 61.98 60.54 2d3u s VAL 147 Cb -0.11 -2.58 -0.02 0.00 0.56 0.00 0.00 36.38 34.22 2d3u s VAL 147 CO 0.02 -0.32 0.78 1.67 -0.31 0.00 0.00 175.10 176.94 2d3u n GLN 148 N -3.70 -1.65 -4.30 4.82 -0.06 -1.26 -5.07 117.38 106.16 2d3u n GLN 148 Ca 0.10 1.26 -0.33 0.00 -2.00 0.00 0.00 57.00 56.04 2d3u n GLN 148 Cb 0.52 -5.75 -0.09 0.00 -4.06 0.00 0.00 30.24 20.87 2d3u n GLN 148 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 2d3u s ARG 154 N -3.54 2.78 0.00 3.69 0.52 -1.26 -5.23 118.95 115.92 2d3u s ARG 154 Ca 0.17 -0.60 -0.11 0.00 -0.52 0.00 0.00 55.73 54.66 2d3u s ARG 154 Cb -0.02 -2.67 -0.05 0.00 0.52 0.00 0.00 34.95 32.73 2d3u s ARG 154 CO 0.75 0.63 0.34 -1.59 0.02 0.00 0.00 175.30 175.45 2d3u s LYS 155 N -1.50 3.75 0.67 3.54 -2.85 -1.26 -5.07 119.74 117.02 2d3u s LYS 155 Ca 0.19 0.20 -0.13 0.00 -1.00 0.00 0.00 55.97 55.22 2d3u s LYS 155 Cb -0.11 -3.14 0.00 0.00 -2.06 0.00 0.00 37.83 32.52 2d3u s LYS 155 CO 0.09 0.67 1.08 -1.25 0.10 0.00 0.00 175.35 176.04 2d3u s PRO 156 N -1.37 2.90 0.37 1.78 0.04 -1.26 -4.86 135.00 132.60 2d3u s PRO 156 Ca 0.25 1.18 -0.28 0.00 0.04 0.00 0.00 61.00 62.20 2d3u s PRO 156 Cb -0.15 -1.98 -0.11 0.00 0.04 0.00 0.00 34.50 32.30 2d3u s PRO 156 CO 0.13 -1.14 1.45 0.00 0.04 0.00 0.00 177.00 177.48 2d3u n ALA 157 N -2.66 2.18 -1.62 8.56 0.00 -1.26 -4.92 120.51 120.78 2d3u n ALA 157 Ca 0.09 0.34 -0.31 0.00 0.00 0.00 0.00 53.44 53.56 2d3u n ALA 157 Cb 0.53 -2.39 0.04 0.00 0.00 0.00 0.00 19.45 17.63 2d3u n ALA 157 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2d3u s ARG 158 N -2.07 3.02 -0.03 0.00 0.52 -1.26 -4.69 118.95 114.43 2d3u s ARG 158 Ca 0.54 0.91 -0.02 0.00 -0.52 0.00 0.00 55.73 56.63 2d3u s ARG 158 Cb -0.49 -2.00 -0.04 0.00 0.52 0.00 0.00 34.95 32.94 2d3u s ARG 158 CO 0.64 -1.03 0.09 -0.51 0.02 0.00 0.00 175.30 174.51 2d3u s LEU 159 N -5.49 4.00 -0.10 2.53 1.02 -1.26 -0.96 118.68 118.42 2d3u s LEU 159 Ca 0.58 0.23 0.03 0.00 0.02 0.00 0.00 54.13 54.98 2d3u s LEU 159 Cb -0.13 -2.23 0.01 0.00 0.02 0.00 0.00 46.19 43.85 2d3u s LEU 159 CO 0.55 0.31 -0.20 -0.51 0.02 0.00 0.00 176.35 176.52 2d3u s ILE 160 N -1.14 1.78 -0.15 -0.59 1.10 0.14 -4.83 121.20 117.51 2d3u s ILE 160 Ca 0.21 -0.84 0.02 0.00 -0.51 0.00 0.00 60.65 59.53 2d3u s ILE 160 Cb -0.12 -1.57 0.01 0.00 0.15 0.00 0.00 42.46 40.94 2d3u s ILE 160 CO 0.11 0.50 -0.21 -0.69 -2.11 0.00 0.00 174.94 172.54 2d3u s VAL 161 N 0.61 2.07 -0.02 4.00 1.01 -1.26 -1.27 120.40 125.53 2d3u s VAL 161 Ca -0.14 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 60.79 2d3u s VAL 161 Cb -0.17 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.39 2d3u s VAL 161 CO 0.04 0.55 0.19 0.72 0.00 0.00 0.00 175.10 176.60 2d3u s PHE 162 N 0.97 -0.07 0.77 5.22 -0.71 -0.52 0.17 117.98 123.81 2d3u s PHE 162 Ca -0.03 0.12 -0.09 0.00 -1.04 0.00 0.00 56.93 55.89 2d3u s PHE 162 Cb -0.15 0.01 0.09 0.00 -1.21 0.00 0.00 43.02 41.77 2d3u s PHE 162 CO -0.06 -0.26 1.10 -1.25 -1.34 0.00 0.00 175.22 173.42 2d3u s PRO 163 N -0.99 1.84 0.81 1.99 0.04 -1.26 -0.20 135.00 137.23 2d3u s PRO 163 Ca -0.11 -0.25 -0.13 0.00 0.04 0.00 0.00 61.00 60.55 2d3u s PRO 163 Cb -0.06 -2.07 0.09 0.00 0.04 0.00 0.00 34.50 32.50 2d3u s PRO 163 CO 0.02 -1.54 1.18 0.34 0.04 0.00 0.00 177.00 177.04 2d3u s ASP 164 N -4.61 3.63 0.31 6.66 2.15 -1.26 -4.72 116.67 118.84 2d3u s ASP 164 Ca 0.63 2.29 0.07 0.00 0.43 0.00 0.00 52.55 55.97 2d3u s ASP 164 Cb -0.09 -2.58 0.76 0.00 -0.30 0.00 0.00 42.92 40.71 2d3u s ASP 164 CO 0.47 -2.63 1.79 0.25 -0.17 0.00 0.00 175.17 174.87 2d3u h LEU 165 N -1.00 0.76 -0.77 -1.34 5.85 -1.84 -0.68 115.31 116.29 2d3u h LEU 165 Ca -0.46 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.32 2d3u h LEU 165 Cb 1.28 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 2d3u h LEU 165 CO 0.46 0.28 0.35 1.23 -0.34 0.00 0.00 178.44 180.42 2d3u h GLY 166 N 0.74 1.21 1.63 3.75 0.00 -1.95 -1.13 103.07 107.31 2d3u h GLY 166 Ca 0.57 -0.62 -0.12 0.00 0.00 0.00 0.00 47.33 47.16 2d3u h GLY 166 CO -0.36 0.58 -0.42 -2.08 0.00 0.00 0.00 176.54 174.27 2d3u h VAL 167 N 1.10 1.31 -0.59 4.60 2.07 -1.51 -2.57 116.25 120.66 2d3u h VAL 167 Ca 0.26 -1.58 -0.09 0.00 0.82 0.00 0.00 66.70 66.12 2d3u h VAL 167 Cb 0.15 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 2d3u h VAL 167 CO -0.03 0.48 0.00 0.03 0.02 0.00 0.00 177.57 178.08 2d3u h ARG 168 N 0.34 1.02 -0.58 1.57 3.08 -0.54 -0.11 114.38 119.15 2d3u h ARG 168 Ca 0.03 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 59.70 2d3u h ARG 168 Cb 0.88 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.81 2d3u h ARG 168 CO 0.07 0.99 0.08 0.28 -1.07 0.00 0.00 179.97 180.32 2d3u h VAL 169 N 0.93 1.25 -0.58 2.04 2.07 -1.11 -2.52 116.25 118.33 2d3u h VAL 169 Ca 0.17 -0.99 -0.06 0.00 0.82 0.00 0.00 66.70 66.64 2d3u h VAL 169 Cb 0.54 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 2d3u h VAL 169 CO 0.03 0.36 0.12 0.00 0.02 0.00 0.00 177.57 178.10 2d3u h GLU 171 N 0.87 1.00 -0.61 0.00 5.08 -0.63 -2.12 114.58 118.18 2d3u h GLU 171 Ca 0.19 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 2d3u h GLU 171 Cb 0.34 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2d3u h GLU 171 CO 0.00 0.66 0.27 0.87 -1.00 0.00 0.00 179.01 179.81 2d3u h LYS 172 N 1.03 0.89 -0.63 2.33 1.57 -1.12 0.46 116.57 121.11 2d3u h LYS 172 Ca 0.32 -0.15 0.03 0.00 -1.87 0.00 0.00 60.65 58.98 2d3u h LYS 172 Cb -0.02 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.10 2d3u h LYS 172 CO -0.10 0.74 0.38 0.52 -0.57 0.00 0.00 179.45 180.42 2d3u h MET 173 N 0.84 0.72 0.00 3.15 2.86 -0.88 0.32 114.93 121.93 2d3u h MET 173 Ca 0.21 -0.04 -0.25 0.00 -2.06 0.00 0.00 59.70 57.56 2d3u h MET 173 Cb 0.16 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.62 2d3u h MET 173 CO -0.02 0.48 -1.32 0.00 1.06 0.00 0.00 176.91 177.11 2d3u h ALA 174 N 1.28 0.54 0.00 6.32 0.00 -1.23 0.13 119.26 126.31 2d3u h ALA 174 Ca 0.26 -1.16 0.00 0.00 0.00 0.00 0.00 54.91 54.01 2d3u h ALA 174 Cb 0.04 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2d3u h ALA 174 CO -0.11 1.40 0.00 1.28 0.00 0.00 0.00 179.25 181.82 2d3u n LEU 175 N -3.21 0.44 -0.03 0.00 4.77 0.16 -4.76 117.00 114.37 2d3u n LEU 175 Ca -0.08 -0.49 -0.09 0.00 -0.03 0.00 0.00 56.01 55.33 2d3u n LEU 175 Cb 0.99 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.05 2d3u n LEU 175 CO 0.46 0.11 0.86 0.22 -1.33 0.00 0.00 177.39 177.72 2d3u h TYR 176 N 0.00 -0.01 -0.70 -1.77 3.20 -0.99 -0.25 116.97 116.45 2d3u h TYR 176 Ca 0.00 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 2d3u h TYR 176 Cb 0.20 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 2d3u h TYR 176 CO 0.00 -0.02 0.42 0.22 -1.64 0.00 0.00 178.16 177.14 2d3u h ASP 177 N 0.06 0.85 0.09 -2.11 3.58 -1.79 -1.64 116.42 115.45 2d3u h ASP 177 Ca 0.08 -0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.46 2d3u h ASP 177 Cb 0.10 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 40.93 2d3u h ASP 177 CO -0.13 0.66 -0.04 0.58 -2.88 0.00 0.00 179.24 177.42 2d3u h VAL 178 N 0.96 0.92 0.00 2.25 2.07 -1.75 -1.47 116.25 119.24 2d3u h VAL 178 Ca 0.25 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.72 2d3u h VAL 178 Cb -0.03 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2d3u h VAL 178 CO -0.05 0.01 0.00 -0.37 0.02 0.00 0.00 177.57 177.18 2d3u h VAL 179 N -0.14 0.00 0.00 2.57 -1.51 -0.91 0.18 116.25 116.43 2d3u h VAL 179 Ca -0.01 -0.33 -0.05 0.00 -1.23 0.00 0.00 66.70 65.08 2d3u h VAL 179 Cb 0.11 1.15 -0.01 0.00 -2.13 0.00 0.00 31.29 30.41 2d3u h VAL 179 CO 0.02 0.00 -1.02 0.28 -1.23 0.00 0.00 177.57 175.62 2d3u h SER 180 N 0.00 0.00 0.00 4.19 0.02 -1.01 -3.42 113.55 113.33 2d3u h SER 180 Ca 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2d3u h SER 180 Cb 0.47 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 2d3u h SER 180 CO 0.00 0.17 -1.41 0.41 -1.14 0.00 0.00 176.83 174.86 2d3u n THR 181 N -2.78 0.41 -0.16 -2.27 -1.04 -0.58 -4.72 114.28 103.14 2d3u n THR 181 Ca -0.02 -0.15 -0.03 0.00 -2.04 0.00 0.00 64.05 61.81 2d3u n THR 181 Cb 0.63 -0.87 0.06 0.00 -1.82 0.00 0.00 70.33 68.33 2d3u n THR 181 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2d3u h LEU 182 N -0.04 0.14 -0.34 -4.42 6.46 -0.86 -3.24 115.31 113.02 2d3u h LEU 182 Ca -0.17 0.07 0.07 0.00 -0.12 0.00 0.00 57.88 57.73 2d3u h LEU 182 Cb 1.24 0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 41.16 2d3u h LEU 182 CO -0.04 0.11 -0.07 -0.65 -0.62 0.00 0.00 178.44 177.17 2d3u h PRO 183 N 0.33 0.01 -0.65 5.25 0.11 -1.82 -1.16 132.00 134.06 2d3u h PRO 183 Ca 0.24 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.31 2d3u h PRO 183 Cb 0.27 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 2d3u h PRO 183 CO -0.26 0.01 0.26 0.37 -0.21 0.00 0.00 178.00 178.17 2d3u h GLN 184 N 0.02 0.96 -0.43 1.05 -0.00 -1.87 0.18 115.11 115.02 2d3u h GLN 184 Ca 0.16 -0.16 -0.08 0.00 -0.00 0.00 0.00 58.65 58.57 2d3u h GLN 184 Cb 0.25 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 27.55 2d3u h GLN 184 CO -0.34 0.79 -0.06 0.28 0.00 0.00 0.00 178.83 179.49 2d3u h VAL 185 N 0.94 1.27 -0.09 2.39 2.07 -1.49 0.61 116.25 121.96 2d3u h VAL 185 Ca 0.22 -1.14 -0.24 0.00 0.82 0.00 0.00 66.70 66.36 2d3u h VAL 185 Cb 0.19 1.14 0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2d3u h VAL 185 CO -0.02 0.39 -0.88 0.58 0.02 0.00 0.00 177.57 177.66 2d3u h VAL 186 N 0.63 1.28 -0.01 2.57 2.07 -0.93 -3.36 116.25 118.49 2d3u h VAL 186 Ca 0.11 -2.08 0.00 0.00 0.82 0.00 0.00 66.70 65.55 2d3u h VAL 186 Cb 0.58 2.13 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 2d3u h VAL 186 CO 0.03 0.65 -0.38 0.23 0.02 0.00 0.00 177.57 178.13 2d3u n MET 187 N -3.90 1.67 0.00 1.57 2.81 0.61 -4.89 117.12 114.99 2d3u n MET 187 Ca -0.09 -0.73 0.00 0.00 -1.81 0.00 0.00 57.70 55.07 2d3u n MET 187 Cb 0.80 -1.28 0.00 0.00 -0.71 0.00 0.00 33.22 32.03 2d3u n MET 187 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2d3u n GLY 188 N 1.18 2.57 0.06 3.03 0.00 0.21 -1.70 105.19 110.55 2d3u n GLY 188 Ca 0.06 -0.23 0.05 0.00 0.00 0.00 0.00 46.02 45.91 2d3u n GLY 188 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2d3u n SER 189 N 0.98 0.24 0.12 1.61 3.41 -1.26 -1.84 113.62 116.89 2d3u n SER 189 Ca 0.00 0.60 0.13 0.00 -0.26 0.00 0.00 58.87 59.34 2d3u n SER 189 Cb 0.00 -0.64 0.38 0.00 -0.26 0.00 0.00 64.21 63.70 2d3u n SER 189 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2d3u h SER 190 N 0.00 0.00 -2.88 4.04 0.02 -1.52 -3.43 113.55 109.78 2d3u h SER 190 Ca 0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 2d3u h SER 190 Cb 0.05 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.54 2d3u h SER 190 CO 0.00 0.00 1.12 -0.47 -1.14 0.00 0.00 176.83 176.34 2d3u s TYR 191 N -3.13 2.25 0.32 3.45 5.04 -0.77 -0.57 117.35 123.95 2d3u s TYR 191 Ca 0.10 0.55 0.04 0.00 -2.44 0.00 0.00 57.07 55.32 2d3u s TYR 191 Cb 0.11 -4.34 0.55 0.00 0.35 0.00 0.00 41.96 38.63 2d3u s TYR 191 CO 0.60 -2.04 1.83 0.78 -1.34 0.00 0.00 175.55 175.37 2d3u h GLY 192 N 13.11 0.54 1.15 8.97 0.00 -1.04 -3.22 103.07 122.59 2d3u h GLY 192 Ca -0.27 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.70 2d3u h GLY 192 CO 1.15 0.33 0.00 0.69 0.00 0.00 0.00 176.54 178.71 2d3u n PHE 193 N -4.23 0.00 1.18 5.60 3.72 -1.26 -1.81 117.46 120.66 2d3u n PHE 193 Ca 0.01 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.54 2d3u n PHE 193 Cb 0.29 -0.08 0.40 0.00 -0.94 0.00 0.00 39.48 39.16 2d3u n PHE 193 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2d3u n GLN 194 N -1.08 0.49 -4.10 -1.08 10.64 -1.22 -2.76 117.38 118.28 2d3u n GLN 194 Ca 0.09 -0.25 -0.32 0.00 -1.83 0.00 0.00 57.00 54.68 2d3u n GLN 194 Cb 0.06 -1.49 -0.07 0.00 -0.86 0.00 0.00 30.24 27.87 2d3u n GLN 194 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2d3u s TYR 195 N -2.68 3.26 0.71 2.61 2.02 -0.75 -4.64 117.35 117.87 2d3u s TYR 195 Ca 0.20 0.18 -0.07 0.00 -0.37 0.00 0.00 57.07 57.01 2d3u s TYR 195 Cb 0.19 -1.71 0.06 0.00 -0.40 0.00 0.00 41.96 40.09 2d3u s TYR 195 CO 0.57 0.54 1.03 -1.54 -1.57 0.00 0.00 175.55 174.57 2d3u s SER 196 N -1.84 4.84 0.26 2.29 1.04 -1.26 -4.77 113.70 114.26 2d3u s SER 196 Ca 0.24 0.52 -0.01 0.00 0.48 0.00 0.00 55.95 57.17 2d3u s SER 196 Cb -0.12 -1.17 0.54 0.00 0.10 0.00 0.00 66.02 65.36 2d3u s SER 196 CO 0.15 -1.59 1.75 -0.65 0.98 0.00 0.00 173.24 173.88 2d3u h PRO 197 N -0.62 0.55 -0.43 4.02 0.11 -1.89 0.59 132.00 134.33 2d3u h PRO 197 Ca -0.45 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 2d3u h PRO 197 Cb 1.31 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 2d3u h PRO 197 CO 0.61 0.36 0.09 0.78 -0.21 0.00 0.00 178.00 179.63 2d3u h GLY 198 N 0.57 0.75 1.80 -0.55 0.00 -1.93 -0.91 103.07 102.80 2d3u h GLY 198 Ca 0.46 -0.49 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 2d3u h GLY 198 CO -0.39 0.45 -0.24 1.46 0.00 0.00 0.00 176.54 177.83 2d3u h GLN 199 N 0.56 0.24 -0.22 4.80 4.20 -1.68 0.12 115.11 123.13 2d3u h GLN 199 Ca 0.13 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 2d3u h GLN 199 Cb 0.35 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 2d3u h GLN 199 CO 0.01 0.47 0.02 -0.09 -0.67 0.00 0.00 178.83 178.57 2d3u h ARG 200 N 0.22 0.38 -0.53 1.46 2.43 -0.46 -0.74 114.38 117.13 2d3u h ARG 200 Ca 0.04 -0.11 0.04 0.00 -0.81 0.00 0.00 59.98 59.14 2d3u h ARG 200 Cb 0.55 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.02 2d3u h ARG 200 CO 0.04 0.54 0.29 0.28 -1.51 0.00 0.00 179.97 179.60 2d3u h VAL 201 N 0.17 0.99 -0.78 0.20 2.07 -0.74 -0.78 116.25 117.37 2d3u h VAL 201 Ca 0.07 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2d3u h VAL 201 Cb 0.35 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 2d3u h VAL 201 CO 0.01 0.10 0.50 -0.08 0.02 0.00 0.00 177.57 178.12 2d3u h GLU 202 N 0.56 1.04 -0.38 1.57 4.81 -0.72 -0.20 114.58 121.27 2d3u h GLU 202 Ca 0.23 -0.08 -0.09 0.00 -0.13 0.00 0.00 59.36 59.29 2d3u h GLU 202 Cb 0.10 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 2d3u h GLU 202 CO -0.14 0.71 -0.10 0.35 -0.73 0.00 0.00 179.01 179.10 2d3u h PHE 203 N 1.06 0.83 -0.16 0.92 3.57 -0.61 -1.35 116.94 121.20 2d3u h PHE 203 Ca 0.28 -0.18 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 2d3u h PHE 203 Cb -0.09 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 2d3u h PHE 203 CO -0.01 0.88 0.06 -0.07 -2.23 0.00 0.00 178.31 176.94 2d3u h LEU 204 N 0.54 0.23 -0.41 0.59 3.38 -0.89 -0.36 115.31 118.38 2d3u h LEU 204 Ca 0.09 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 2d3u h LEU 204 Cb 0.62 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 2d3u h LEU 204 CO 0.04 0.35 0.14 0.58 0.09 0.00 0.00 178.44 179.64 2d3u h VAL 205 N 0.10 1.21 -0.31 1.22 2.07 -1.03 0.56 116.25 120.07 2d3u h VAL 205 Ca 0.05 -0.68 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 2d3u h VAL 205 Cb 0.19 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 2d3u h VAL 205 CO -0.00 0.24 -0.09 0.78 0.02 0.00 0.00 177.57 178.52 2d3u h ASN 206 N 0.52 0.50 -0.31 0.57 2.35 -1.20 -0.25 115.58 117.77 2d3u h ASN 206 Ca 0.14 -0.12 -0.13 0.00 -0.55 0.00 0.00 56.30 55.64 2d3u h ASN 206 Cb 0.23 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 2d3u h ASN 206 CO -0.01 0.63 -0.31 0.74 -1.65 0.00 0.00 177.43 176.84 2d3u h THR 207 N 0.48 1.30 -0.21 2.81 2.02 -0.71 -1.20 112.91 117.40 2d3u h THR 207 Ca 0.09 -1.48 0.00 0.00 0.77 0.00 0.00 66.41 65.80 2d3u h THR 207 Cb 0.46 1.54 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 2d3u h THR 207 CO 0.02 0.48 0.13 -0.25 0.37 0.00 0.00 175.52 176.28 2d3u h TRP 208 N 0.51 0.27 0.00 3.16 2.91 -0.46 -2.09 115.95 120.25 2d3u h TRP 208 Ca 0.05 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.07 2d3u h TRP 208 Cb 0.88 -0.09 0.00 0.00 -0.51 0.00 0.00 29.16 29.44 2d3u h TRP 208 CO 0.07 0.19 0.00 0.87 -1.03 0.00 0.00 178.44 178.54 2d3u h LYS 209 N 0.27 0.00 -0.00 2.65 1.57 -0.98 -2.76 116.57 117.32 2d3u h LYS 209 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2d3u h LYS 209 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2d3u h LYS 209 CO -0.02 0.00 -0.04 -1.13 -0.57 0.00 0.00 179.45 177.70 2d3u n SER 210 N -2.58 0.10 -4.86 0.86 3.41 -0.46 -4.79 113.62 105.31 2d3u n SER 210 Ca 0.01 -0.11 -0.34 0.00 -0.26 0.00 0.00 58.87 58.17 2d3u n SER 210 Cb 0.23 -0.27 -0.06 0.00 -0.26 0.00 0.00 64.21 63.86 2d3u n SER 210 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2d3u s LYS 211 N -2.64 3.32 0.03 4.33 -0.14 -1.04 -5.01 119.74 118.58 2d3u s LYS 211 Ca 0.25 -0.33 -0.23 0.00 -1.36 0.00 0.00 55.97 54.30 2d3u s LYS 211 Cb 0.20 -3.04 -0.16 0.00 -1.68 0.00 0.00 37.83 33.15 2d3u s LYS 211 CO 0.48 0.69 1.45 0.87 -0.76 0.00 0.00 175.35 178.08 2d3u h LYS 212 N 4.16 0.10 -2.82 1.68 1.57 -1.87 -3.37 116.57 116.01 2d3u h LYS 212 Ca -0.50 -0.03 -0.60 0.00 -1.87 0.00 0.00 60.65 57.64 2d3u h LYS 212 Cb 1.19 -0.01 -0.40 0.00 0.08 0.00 0.00 32.23 33.10 2d3u h LYS 212 CO 0.65 0.39 -0.78 -0.80 -0.57 0.00 0.00 179.45 178.34 2d3u s ASN 213 N -5.62 3.28 0.39 0.86 0.01 -1.26 -5.08 114.94 107.52 2d3u s ASN 213 Ca -0.15 -2.78 -0.26 0.00 -0.71 0.00 0.00 52.86 48.96 2d3u s ASN 213 Cb 0.04 -0.90 -0.09 0.00 0.41 0.00 0.00 41.25 40.71 2d3u s ASN 213 CO 0.69 -0.23 1.29 -2.16 -1.51 0.00 0.00 177.10 175.17 2d3u s PRO 214 N 0.20 4.04 -0.02 -0.60 0.04 -1.26 0.38 135.00 137.78 2d3u s PRO 214 Ca 0.21 2.12 -0.03 0.00 0.04 0.00 0.00 61.00 63.35 2d3u s PRO 214 Cb -0.17 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.58 2d3u s PRO 214 CO -0.05 -0.42 0.07 1.41 0.04 0.00 0.00 177.00 178.04 2d3u s MET 215 N -2.17 0.18 0.07 4.56 1.75 -0.72 -4.71 119.30 118.26 2d3u s MET 215 Ca 0.56 -0.09 -0.11 0.00 -1.25 0.00 0.00 55.69 54.80 2d3u s MET 215 Cb -0.37 0.08 0.01 0.00 2.84 0.00 0.00 34.83 37.38 2d3u s MET 215 CO 0.48 -0.03 0.24 0.20 -0.65 0.00 0.00 175.02 175.26 2d3u s GLY 216 N -0.41 -0.01 0.06 2.11 0.00 -0.50 -0.62 107.32 107.96 2d3u s GLY 216 Ca -0.05 -0.35 -0.17 0.00 0.00 0.00 0.00 44.72 44.15 2d3u s GLY 216 CO 0.00 -0.55 0.40 -0.11 0.00 0.00 0.00 173.10 172.83 2d3u s PHE 217 N -3.33 -0.23 0.01 1.90 -0.71 0.01 -0.47 117.98 115.17 2d3u s PHE 217 Ca 0.01 0.13 -0.01 0.00 -1.04 0.00 0.00 56.93 56.02 2d3u s PHE 217 Cb 0.02 0.21 -0.04 0.00 -1.21 0.00 0.00 43.02 42.00 2d3u s PHE 217 CO -0.08 -0.59 0.13 -1.54 -1.34 0.00 0.00 175.22 171.80 2d3u s SER 218 N -2.15 5.97 -0.24 1.98 1.04 -1.26 -0.18 113.70 118.86 2d3u s SER 218 Ca -0.04 0.21 0.01 0.00 0.48 0.00 0.00 55.95 56.61 2d3u s SER 218 Cb -0.00 -1.77 0.04 0.00 0.10 0.00 0.00 66.02 64.39 2d3u s SER 218 CO -0.04 0.24 -0.12 -0.47 0.98 0.00 0.00 173.24 173.83 2d3u s TYR 219 N -1.30 3.11 -0.46 5.02 5.04 -0.01 -4.64 117.35 124.11 2d3u s TYR 219 Ca 0.27 -2.00 -0.19 0.00 -2.44 0.00 0.00 57.07 52.71 2d3u s TYR 219 Cb -0.12 -1.96 0.04 0.00 0.35 0.00 0.00 41.96 40.26 2d3u s TYR 219 CO 0.18 -0.83 0.57 0.34 -1.34 0.00 0.00 175.55 174.47 2d3u s ASP 220 N 1.20 6.24 0.11 4.32 2.15 -1.26 -4.15 116.67 125.28 2d3u s ASP 220 Ca -0.04 -0.66 -0.28 0.00 0.43 0.00 0.00 52.55 52.00 2d3u s ASP 220 Cb -0.18 -2.28 -0.06 0.00 -0.30 0.00 0.00 42.92 40.10 2d3u s ASP 220 CO -0.07 -0.75 0.88 -0.89 -0.17 0.00 0.00 175.17 174.17 2d3u s THR 221 N 2.52 4.50 -0.22 1.71 2.01 -1.26 -0.41 115.64 124.48 2d3u s THR 221 Ca 0.16 1.90 -0.29 0.00 0.31 0.00 0.00 61.69 63.78 2d3u s THR 221 Cb -0.17 -4.24 -0.01 0.00 0.01 0.00 0.00 72.50 68.09 2d3u s THR 221 CO 0.15 0.38 1.27 -0.60 -0.69 0.00 0.00 174.62 175.12 2d3u s ARG 222 N -0.29 4.10 -1.07 4.92 3.52 -0.07 -3.85 118.95 126.22 2d3u s ARG 222 Ca 0.42 1.48 -0.19 0.00 -0.13 0.00 0.00 55.73 57.32 2d3u s ARG 222 Cb -0.23 -3.81 0.00 0.00 -1.56 0.00 0.00 34.95 29.36 2d3u s ARG 222 CO 0.28 -0.87 0.74 0.00 -0.81 0.00 0.00 175.30 174.63 2d3u h PHE 224 N -1.61 -0.27 -0.85 0.00 3.04 -1.95 -0.31 116.94 114.98 2d3u h PHE 224 Ca -0.62 0.06 0.15 0.00 3.98 0.00 0.00 57.97 61.54 2d3u h PHE 224 Cb 1.35 0.23 -0.09 0.00 2.56 0.00 0.00 35.95 39.99 2d3u h PHE 224 CO 0.31 -0.28 0.43 -0.44 -2.02 0.00 0.00 178.31 176.32 2d3u h ASP 225 N 0.03 0.52 0.70 0.41 3.32 -1.91 0.48 116.42 119.98 2d3u h ASP 225 Ca 0.35 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.46 2d3u h ASP 225 Cb 0.57 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 2d3u h ASP 225 CO -0.69 0.21 -0.19 0.28 -1.72 0.00 0.00 179.24 177.13 2d3u h SER 226 N 0.62 0.00 1.79 6.45 0.02 -1.36 -2.48 113.55 118.58 2d3u h SER 226 Ca 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.42 2d3u h SER 226 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2d3u h SER 226 CO -0.37 0.19 0.00 0.71 -1.14 0.00 0.00 176.83 176.23 2d3u h THR 227 N 0.00 0.00 -2.71 -2.27 1.35 -0.56 -3.45 112.91 105.27 2d3u h THR 227 Ca -0.00 -0.83 -0.55 0.00 -0.55 0.00 0.00 66.41 64.48 2d3u h THR 227 Cb 0.60 1.82 -0.01 0.00 -1.73 0.00 0.00 68.15 68.82 2d3u h THR 227 CO 0.03 0.00 1.02 -0.69 -0.25 0.00 0.00 175.52 175.63 2d3u s VAL 228 N -3.21 3.75 0.56 6.82 1.01 -1.04 -4.81 120.40 123.47 2d3u s VAL 228 Ca 0.07 0.93 0.03 0.00 0.00 0.00 0.00 61.98 63.02 2d3u s VAL 228 Cb 0.07 -3.60 0.05 0.00 0.00 0.00 0.00 36.38 32.90 2d3u s VAL 228 CO 0.64 -0.07 0.78 0.42 0.00 0.00 0.00 175.10 176.86 2d3u s THR 229 N 3.75 2.56 0.31 3.92 -4.23 -1.26 -3.81 115.64 116.87 2d3u s THR 229 Ca 0.68 -0.76 -0.01 0.00 -1.18 0.00 0.00 61.69 60.42 2d3u s THR 229 Cb -0.30 -2.80 0.24 0.00 1.34 0.00 0.00 72.50 70.98 2d3u s THR 229 CO 0.26 0.00 1.95 -0.08 -0.54 0.00 0.00 174.62 176.21 2d3u h GLU 230 N 0.08 0.98 -0.43 3.99 4.81 -1.88 -1.80 114.58 120.33 2d3u h GLU 230 Ca -0.39 -0.08 0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2d3u h GLU 230 Cb 1.29 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.44 2d3u h GLU 230 CO 0.47 0.69 0.28 -0.97 -0.73 0.00 0.00 179.01 178.74 2d3u h ASN 231 N 0.99 0.47 -0.67 1.04 -1.24 -1.97 -0.85 115.58 113.35 2d3u h ASN 231 Ca 0.26 -0.01 0.01 0.00 0.71 0.00 0.00 56.30 57.27 2d3u h ASN 231 Cb -0.04 -0.11 -0.03 0.00 0.73 0.00 0.00 38.32 38.87 2d3u h ASN 231 CO -0.05 0.34 0.44 0.44 -1.29 0.00 0.00 177.43 177.31 2d3u h ASP 232 N 0.56 0.78 0.29 1.15 3.32 -1.74 0.25 116.42 121.02 2d3u h ASP 232 Ca 0.16 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.06 2d3u h ASP 232 Cb -0.04 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 2d3u h ASP 232 CO -0.05 0.57 -0.52 0.40 -1.72 0.00 0.00 179.24 177.91 2d3u h ILE 233 N 0.91 1.35 -0.03 0.35 2.04 -1.08 -0.74 117.51 120.32 2d3u h ILE 233 Ca 0.25 -1.79 -0.20 0.00 1.00 0.00 0.00 64.86 64.12 2d3u h ILE 233 Cb -0.10 1.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.84 2d3u h ILE 233 CO -0.05 0.53 -0.83 0.03 0.00 0.00 0.00 178.15 177.83 2d3u h ARG 234 N 0.20 0.35 -0.66 2.37 3.08 -0.85 -2.26 114.38 116.61 2d3u h ARG 234 Ca 0.01 -0.33 -0.08 0.00 0.07 0.00 0.00 59.98 59.64 2d3u h ARG 234 Cb 0.99 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 31.10 2d3u h ARG 234 CO 0.08 1.00 0.09 0.28 -1.07 0.00 0.00 179.97 180.36 2d3u h VAL 235 N 0.22 1.26 -0.60 2.04 2.07 -0.77 -0.86 116.25 119.60 2d3u h VAL 235 Ca -0.05 -1.06 0.03 0.00 0.82 0.00 0.00 66.70 66.44 2d3u h VAL 235 Cb 1.44 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.83 2d3u h VAL 235 CO 0.14 0.40 0.37 -0.33 0.02 0.00 0.00 177.57 178.16 2d3u h GLU 236 N 1.02 0.71 -0.77 1.57 5.08 -1.01 -1.98 114.58 119.20 2d3u h GLU 236 Ca 0.20 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.47 2d3u h GLU 236 Cb 0.46 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 2d3u h GLU 236 CO 0.02 0.47 0.30 1.49 -1.00 0.00 0.00 179.01 180.28 2d3u h GLU 237 N 0.73 1.15 0.00 2.33 4.81 -0.91 -0.84 114.58 121.84 2d3u h GLU 237 Ca 0.24 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 2d3u h GLU 237 Cb 0.02 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.21 2d3u h GLU 237 CO -0.10 0.93 -0.10 0.66 -0.73 0.00 0.00 179.01 179.68 2d3u h SER 238 N 1.12 0.00 0.00 1.04 4.64 -0.61 0.69 113.55 120.44 2d3u h SER 238 Ca 0.26 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.54 2d3u h SER 238 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2d3u h SER 238 CO -0.02 0.10 -0.15 0.40 -0.87 0.00 0.00 176.83 176.29 2d3u h ILE 239 N 0.00 1.59 -0.57 0.95 2.04 -0.55 -3.14 117.51 117.82 2d3u h ILE 239 Ca -0.00 -1.92 0.08 0.00 1.00 0.00 0.00 64.86 64.02 2d3u h ILE 239 Cb 0.20 2.84 -0.07 0.00 -0.74 0.00 0.00 36.82 39.05 2d3u h ILE 239 CO 0.01 0.51 0.21 1.88 0.00 0.00 0.00 178.15 180.77 2d3u h TYR 240 N -0.63 0.37 0.00 1.37 0.05 -0.41 -0.28 116.97 117.43 2d3u h TYR 240 Ca -0.02 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2d3u h TYR 240 Cb 0.92 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.58 2d3u h TYR 240 CO 0.19 0.10 0.00 1.04 -1.05 0.00 0.00 178.16 178.44 2d3u n GLN 241 N -5.00 0.04 0.20 4.88 1.13 0.16 -1.53 117.38 117.26 2d3u n GLN 241 Ca 0.07 0.43 0.07 0.00 -1.94 0.00 0.00 57.00 55.63 2d3u n GLN 241 Cb 0.25 -1.60 0.37 0.00 0.11 0.00 0.00 30.24 29.36 2d3u n GLN 241 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2d3u s ASP 244 N -2.54 6.65 0.09 0.00 -1.08 0.30 -4.96 116.67 115.13 2d3u s ASP 244 Ca 0.69 0.66 0.04 0.00 -0.52 0.00 0.00 52.55 53.41 2d3u s ASP 244 Cb -0.24 -2.55 -0.03 0.00 -1.46 0.00 0.00 42.92 38.64 2d3u s ASP 244 CO 0.51 -1.20 -0.10 -0.76 0.52 0.00 0.00 175.17 174.13 2d3u s LEU 245 N 4.43 2.36 0.42 -1.34 1.43 -1.26 -1.62 118.68 123.11 2d3u s LEU 245 Ca 0.50 -0.75 -0.25 0.00 -1.03 0.00 0.00 54.13 52.60 2d3u s LEU 245 Cb -0.09 -0.32 -0.08 0.00 0.03 0.00 0.00 46.19 45.73 2d3u s LEU 245 CO 0.28 -0.22 1.24 0.00 0.23 0.00 0.00 176.35 177.88 2d3u s ALA 246 N -2.11 3.15 0.27 4.21 0.00 -1.26 -4.83 121.76 121.18 2d3u s ALA 246 Ca 0.02 1.10 -0.01 0.00 0.00 0.00 0.00 51.96 53.08 2d3u s ALA 246 Cb -0.05 -3.44 0.59 0.00 0.00 0.00 0.00 23.12 20.22 2d3u s ALA 246 CO 0.00 -0.74 1.68 -1.35 0.00 0.00 0.00 175.76 175.36 2d3u h PRO 247 N 2.48 0.30 -0.33 0.00 0.11 -2.00 0.23 132.00 132.79 2d3u h PRO 247 Ca -0.49 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 2d3u h PRO 247 Cb 1.25 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2d3u h PRO 247 CO 0.62 0.20 0.00 0.93 -0.21 0.00 0.00 178.00 179.54 2d3u h GLU 248 N 0.31 0.51 -0.35 1.05 5.08 -2.00 -2.18 114.58 117.01 2d3u h GLU 248 Ca 0.48 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.69 2d3u h GLU 248 Cb 0.88 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 2d3u h GLU 248 CO -0.54 0.54 0.04 0.00 -1.00 0.00 0.00 179.01 178.05 2d3u h ALA 249 N 1.52 0.47 -0.45 3.43 0.00 -1.34 -0.97 119.26 121.91 2d3u h ALA 249 Ca 0.11 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.84 2d3u h ALA 249 Cb 0.32 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2d3u h ALA 249 CO 0.01 0.19 0.22 0.00 0.00 0.00 0.00 179.25 179.67 2d3u h ARG 250 N 0.42 0.43 -0.10 0.00 3.08 -0.95 0.05 114.38 117.32 2d3u h ARG 250 Ca 0.10 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 2d3u h ARG 250 Cb 0.39 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 2d3u h ARG 250 CO 0.01 0.28 0.05 0.37 -1.07 0.00 0.00 179.97 179.61 2d3u h GLN 251 N 0.44 0.14 -0.67 0.04 5.75 -1.26 -0.82 115.11 118.74 2d3u h GLN 251 Ca 0.20 -0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.70 2d3u h GLN 251 Cb 0.11 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.60 2d3u h GLN 251 CO -0.15 0.21 0.43 0.00 -2.65 0.00 0.00 178.83 176.67 2d3u h ALA 252 N 0.93 0.86 -0.54 3.38 0.00 -0.89 0.11 119.26 123.12 2d3u h ALA 252 Ca 0.03 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2d3u h ALA 252 Cb 0.11 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2d3u h ALA 252 CO -0.00 0.23 0.19 0.82 0.00 0.00 0.00 179.25 180.48 2d3u h ILE 253 N 0.86 1.23 -0.56 0.00 2.04 -0.85 0.20 117.51 120.42 2d3u h ILE 253 Ca 0.26 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.36 2d3u h ILE 253 Cb -0.04 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 2d3u h ILE 253 CO -0.08 0.28 0.25 0.50 0.00 0.00 0.00 178.15 179.10 2d3u h LYS 254 N 0.74 0.81 -0.35 2.37 3.64 -0.70 -1.25 116.57 121.83 2d3u h LYS 254 Ca 0.18 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 2d3u h LYS 254 Cb 0.24 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 2d3u h LYS 254 CO -0.01 0.68 -0.01 1.03 -2.27 0.00 0.00 179.45 178.87 2d3u h SER 255 N 0.76 0.61 -0.70 4.20 0.87 -0.66 -1.76 113.55 116.87 2d3u h SER 255 Ca 0.19 -0.31 -0.03 0.00 -1.23 0.00 0.00 61.79 60.40 2d3u h SER 255 Cb 0.15 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.91 2d3u h SER 255 CO -0.02 0.78 0.32 -0.07 -0.53 0.00 0.00 176.83 177.30 2d3u h LEU 256 N 0.43 0.95 0.12 2.23 3.38 -0.51 0.27 115.31 122.18 2d3u h LEU 256 Ca 0.10 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2d3u h LEU 256 Cb 0.47 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2d3u h LEU 256 CO 0.02 0.82 -0.06 0.74 0.09 0.00 0.00 178.44 180.05 2d3u h THR 257 N 1.03 0.99 -0.60 0.22 2.02 -0.96 0.20 112.91 115.80 2d3u h THR 257 Ca 0.25 -0.41 -0.08 0.00 0.77 0.00 0.00 66.41 66.93 2d3u h THR 257 Cb 0.15 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 2d3u h THR 257 CO -0.03 0.10 0.07 -0.33 0.37 0.00 0.00 175.52 175.71 2d3u h GLU 258 N -0.35 1.00 0.00 6.66 4.39 -1.12 -1.53 114.58 123.63 2d3u h GLU 258 Ca -0.02 -0.28 -0.16 0.00 0.34 0.00 0.00 59.36 59.25 2d3u h GLU 258 Cb 0.29 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.80 2d3u h GLU 258 CO 0.03 0.96 -1.33 0.00 -1.16 0.00 0.00 179.01 177.50 2d3u h ARG 259 N 0.90 0.00 0.00 2.33 3.08 -0.97 -3.43 114.38 116.29 2d3u h ARG 259 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2d3u h ARG 259 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 2d3u h ARG 259 CO 0.02 0.29 -0.15 -0.11 -1.07 0.00 0.00 179.97 178.94 2d3u n LEU 260 N -2.90 0.55 -0.32 3.04 7.94 0.55 -0.38 117.00 125.48 2d3u n LEU 260 Ca -0.08 0.20 -0.01 0.00 -1.11 0.00 0.00 56.01 55.00 2d3u n LEU 260 Cb 0.82 -0.08 0.12 0.00 0.53 0.00 0.00 43.42 44.81 2d3u n LEU 260 CO 0.43 -0.63 1.22 1.88 -1.11 0.00 0.00 177.39 179.17 2d3u h TYR 261 N 0.00 1.06 0.00 1.96 0.05 -1.09 -2.71 116.97 116.24 2d3u h TYR 261 Ca 0.00 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.72 2d3u h TYR 261 Cb 0.15 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 37.53 2d3u h TYR 261 CO 0.00 0.60 -0.44 0.82 -1.05 0.00 0.00 178.16 178.09 2d3u h ILE 262 N 1.09 1.23 0.00 -2.88 2.04 -1.53 -3.42 117.51 114.05 2d3u h ILE 262 Ca 0.36 -1.54 0.00 0.00 1.00 0.00 0.00 64.86 64.68 2d3u h ILE 262 Cb 0.03 1.85 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 2d3u h ILE 262 CO -0.12 0.43 0.00 0.61 0.00 0.00 0.00 178.15 179.06 2d3u n GLY 263 N -0.15 -0.81 0.00 5.37 0.00 -1.02 -4.11 105.19 104.47 2d3u n GLY 263 Ca -0.01 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.75 2d3u n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d3u n GLY 264 N -0.83 1.80 3.77 -0.02 0.00 -0.74 -4.15 105.19 105.03 2d3u n GLY 264 Ca 0.00 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.64 2d3u n GLY 264 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d3u s PRO 265 N -2.00 3.16 -0.17 1.61 0.04 -1.26 -1.17 135.00 135.22 2d3u s PRO 265 Ca 0.00 1.63 -0.02 0.00 0.04 0.00 0.00 61.00 62.65 2d3u s PRO 265 Cb 0.00 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.55 2d3u s PRO 265 CO 0.00 -1.01 -0.10 -0.51 0.04 0.00 0.00 177.00 175.43 2d3u s LEU 266 N -4.04 2.78 -0.07 -3.56 1.43 0.26 -2.88 118.68 112.60 2d3u s LEU 266 Ca 0.73 -0.36 0.06 0.00 -1.03 0.00 0.00 54.13 53.53 2d3u s LEU 266 Cb -0.25 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.30 2d3u s LEU 266 CO 0.31 0.09 -0.24 -0.89 0.23 0.00 0.00 176.35 175.85 2d3u s THR 267 N 0.79 2.12 0.86 5.49 2.01 -0.17 0.26 115.64 127.00 2d3u s THR 267 Ca -0.04 -1.04 -0.11 0.00 0.31 0.00 0.00 61.69 60.81 2d3u s THR 267 Cb -0.15 -1.78 0.15 0.00 0.01 0.00 0.00 72.50 70.74 2d3u s THR 267 CO 0.01 0.57 1.20 0.54 -0.69 0.00 0.00 174.62 176.25 2d3u s ASN 268 N -0.09 3.75 0.23 3.53 2.20 -0.61 -1.19 114.94 122.76 2d3u s ASN 268 Ca -0.06 0.24 0.18 0.00 -0.94 0.00 0.00 52.86 52.28 2d3u s ASN 268 Cb -0.14 -0.48 0.89 0.00 -2.00 0.00 0.00 41.25 39.51 2d3u s ASN 268 CO 0.04 -2.31 1.54 -1.54 -2.94 0.00 0.00 177.10 171.89 2d3u n SER 269 N -3.42 0.45 -0.22 3.54 3.41 -1.26 -1.13 113.62 114.99 2d3u n SER 269 Ca 0.13 0.68 0.12 0.00 -0.26 0.00 0.00 58.87 59.54 2d3u n SER 269 Cb 0.60 -0.75 0.20 0.00 -0.26 0.00 0.00 64.21 64.01 2d3u n SER 269 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2d3u n LYS 270 N -2.07 0.64 -0.39 4.33 5.02 -1.26 -4.96 118.16 119.47 2d3u n LYS 270 Ca -0.00 -0.44 0.00 0.00 -2.02 0.00 0.00 58.31 55.85 2d3u n LYS 270 Cb 0.08 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 2d3u n LYS 270 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2d3u n GLY 271 N 1.41 0.79 3.87 0.72 0.00 -0.28 -5.07 105.19 106.63 2d3u n GLY 271 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 2d3u n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2d3u s GLN 272 N -0.61 3.83 -0.22 1.61 -0.21 -1.26 -4.86 119.66 117.94 2d3u s GLN 272 Ca 0.00 0.30 -0.29 0.00 0.02 0.00 0.00 55.36 55.39 2d3u s GLN 272 Cb 0.00 -2.73 0.00 0.00 1.00 0.00 0.00 33.01 31.29 2d3u s GLN 272 CO 0.00 0.37 1.14 1.21 -2.12 0.00 0.00 175.29 175.88 2d3u s ASN 273 N -2.20 7.00 0.12 5.90 3.04 -1.26 -1.57 114.94 125.97 2d3u s ASN 273 Ca 0.45 1.45 0.23 0.00 0.04 0.00 0.00 52.86 55.02 2d3u s ASN 273 Cb -0.12 -2.54 -0.02 0.00 -1.54 0.00 0.00 41.25 37.03 2d3u s ASN 273 CO 0.21 -0.75 0.96 0.00 -3.04 0.00 0.00 177.10 174.48 2d3u n GLY 275 N 1.25 0.19 2.97 0.00 0.00 -1.20 -1.24 105.19 107.17 2d3u n GLY 275 Ca -0.00 -1.34 -0.16 0.00 0.00 0.00 0.00 46.02 44.52 2d3u n GLY 275 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2d3u s TYR 276 N -3.52 0.51 -0.12 1.61 5.04 0.62 -0.57 117.35 120.92 2d3u s TYR 276 Ca 0.00 -0.10 -0.04 0.00 -2.44 0.00 0.00 57.07 54.48 2d3u s TYR 276 Cb 0.00 -0.33 -0.04 0.00 0.35 0.00 0.00 41.96 41.95 2d3u s TYR 276 CO 0.00 -0.01 0.05 0.50 -1.34 0.00 0.00 175.55 174.75 2d3u s ARG 277 N -0.16 3.32 -0.07 4.97 3.52 -0.32 -1.36 118.95 128.85 2d3u s ARG 277 Ca 0.02 -0.33 0.19 0.00 -0.13 0.00 0.00 55.73 55.48 2d3u s ARG 277 Cb -0.02 -2.98 0.39 0.00 -1.56 0.00 0.00 34.95 30.77 2d3u s ARG 277 CO -0.00 0.62 1.17 0.54 -0.81 0.00 0.00 175.30 176.82 2d3u n ARG 278 N 2.43 0.56 -2.13 5.12 1.74 -0.07 -1.80 116.66 122.52 2d3u n ARG 278 Ca -0.19 -2.36 -0.01 0.00 -0.77 0.00 0.00 57.85 54.52 2d3u n ARG 278 Cb 0.54 -0.62 -0.00 0.00 -1.02 0.00 0.00 32.46 31.35 2d3u n ARG 278 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2d3u s ARG 280 N -2.08 4.17 -0.03 0.00 6.06 -0.96 -4.61 118.95 121.50 2d3u s ARG 280 Ca 0.02 2.49 -0.27 0.00 -2.50 0.00 0.00 55.73 55.47 2d3u s ARG 280 Cb 0.00 -3.08 -0.03 0.00 0.06 0.00 0.00 34.95 31.90 2d3u s ARG 280 CO 0.01 -0.63 0.87 0.00 -2.50 0.00 0.00 175.30 173.05 2d3u s ALA 281 N 0.58 3.23 -0.50 6.12 0.00 -1.26 -4.77 121.76 125.15 2d3u s ALA 281 Ca 0.67 0.37 0.26 0.00 0.00 0.00 0.00 51.96 53.26 2d3u s ALA 281 Cb -0.46 -3.18 0.84 0.00 0.00 0.00 0.00 23.12 20.31 2d3u s ALA 281 CO 0.39 -0.18 1.76 0.66 0.00 0.00 0.00 175.76 178.38 2d3u h SER 282 N 6.79 0.00 -1.36 0.00 4.64 -1.88 -3.35 113.55 118.39 2d3u h SER 282 Ca -0.41 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.32 2d3u h SER 282 Cb 1.21 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.89 2d3u h SER 282 CO 0.75 0.00 -0.65 0.61 -0.87 0.00 0.00 176.83 176.67 2d3u n GLY 283 N 0.77 6.08 3.59 -0.77 0.00 0.13 -4.47 105.19 110.51 2d3u n GLY 283 Ca 0.04 -2.73 -0.26 0.00 0.00 0.00 0.00 46.02 43.07 2d3u n GLY 283 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2d3u s VAL 284 N -5.30 2.33 0.24 1.61 -7.23 -1.22 -4.42 120.40 106.41 2d3u s VAL 284 Ca 0.49 -2.07 -0.07 0.00 -1.81 0.00 0.00 61.98 58.52 2d3u s VAL 284 Cb 0.41 -2.77 0.23 0.00 0.56 0.00 0.00 36.38 34.80 2d3u s VAL 284 CO -0.15 -0.16 1.89 0.25 -0.31 0.00 0.00 175.10 176.63 2d3u h LEU 285 N 1.88 1.11 -0.15 1.32 5.85 -1.80 -2.53 115.31 120.99 2d3u h LEU 285 Ca -0.43 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2d3u h LEU 285 Cb 1.25 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 42.00 2d3u h LEU 285 CO 0.71 0.84 0.00 0.35 -0.34 0.00 0.00 178.44 180.00 2d3u n THR 286 N -4.38 0.05 0.06 1.05 -2.24 -1.26 -4.32 114.28 103.23 2d3u n THR 286 Ca 0.10 -0.05 -0.12 0.00 -2.27 0.00 0.00 64.05 61.71 2d3u n THR 286 Cb 0.05 -0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.15 2d3u n THR 286 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2d3u h THR 287 N 0.26 0.88 0.12 4.28 2.02 -1.73 0.15 112.91 118.89 2d3u h THR 287 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2d3u h THR 287 Cb 0.06 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 2d3u h THR 287 CO 0.00 0.00 -0.06 -1.28 0.37 0.00 0.00 175.52 174.55 2d3u h SER 288 N -0.11 -0.13 -0.59 4.18 0.87 -1.75 -0.97 113.55 115.05 2d3u h SER 288 Ca 0.01 -0.30 -0.02 0.00 -1.23 0.00 0.00 61.79 60.25 2d3u h SER 288 Cb 0.11 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.08 2d3u h SER 288 CO -0.02 0.24 0.30 0.00 -0.53 0.00 0.00 176.83 176.81 2d3u h GLY 290 N 0.80 0.67 1.01 0.00 0.00 -0.74 -1.67 103.07 103.15 2d3u h GLY 290 Ca 0.20 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 2d3u h GLY 290 CO -0.03 0.45 0.42 3.43 0.00 0.00 0.00 176.54 180.81 2d3u h ASN 291 N 0.44 0.95 0.10 0.19 2.35 -0.98 -1.20 115.58 117.43 2d3u h ASN 291 Ca 0.10 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2d3u h ASN 291 Cb 0.44 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2d3u h ASN 291 CO 0.02 0.77 -0.05 0.74 -1.65 0.00 0.00 177.43 177.26 2d3u h THR 292 N 1.05 0.96 -0.41 2.81 2.02 -1.15 0.21 112.91 118.41 2d3u h THR 292 Ca 0.27 -0.19 0.03 0.00 0.77 0.00 0.00 66.41 67.29 2d3u h THR 292 Cb 0.03 1.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.49 2d3u h THR 292 CO -0.04 0.05 0.19 -0.07 0.37 0.00 0.00 175.52 176.02 2d3u h LEU 293 N -0.22 0.28 -0.51 2.58 3.38 -1.20 0.68 115.31 120.30 2d3u h LEU 293 Ca -0.01 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 2d3u h LEU 293 Cb 0.18 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2d3u h LEU 293 CO 0.02 0.20 -0.07 0.74 0.09 0.00 0.00 178.44 179.42 2d3u h THR 294 N 0.40 1.27 -0.42 0.22 2.02 -1.08 0.18 112.91 115.49 2d3u h THR 294 Ca 0.18 -1.20 -0.07 0.00 0.77 0.00 0.00 66.41 66.09 2d3u h THR 294 Cb 0.09 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 2d3u h THR 294 CO -0.13 0.42 0.01 0.00 0.37 0.00 0.00 175.52 176.19 2d3u h TYR 296 N 0.58 1.09 0.30 0.00 3.20 -0.71 -0.23 116.97 121.20 2d3u h TYR 296 Ca 0.12 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2d3u h TYR 296 Cb 0.47 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.44 2d3u h TYR 296 CO 0.04 0.89 -0.14 1.25 -1.64 0.00 0.00 178.16 178.55 2d3u h LEU 297 N 0.98 -0.34 -0.28 2.82 5.85 -0.44 -0.21 115.31 123.68 2d3u h LEU 297 Ca 0.21 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 2d3u h LEU 297 Cb 0.33 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2d3u h LEU 297 CO -0.00 -0.16 0.16 0.11 -0.34 0.00 0.00 178.44 178.21 2d3u h LYS 298 N -0.51 0.39 -0.49 1.25 1.57 -1.18 -2.06 116.57 115.55 2d3u h LYS 298 Ca -0.04 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 2d3u h LYS 298 Cb 0.38 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 2d3u h LYS 298 CO 0.07 0.33 0.21 0.00 -0.57 0.00 0.00 179.45 179.49 2d3u h ALA 299 N 1.04 0.63 -0.46 3.86 0.00 -1.03 0.18 119.26 123.48 2d3u h ALA 299 Ca 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2d3u h ALA 299 Cb 0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2d3u h ALA 299 CO -0.02 0.22 0.30 0.77 0.00 0.00 0.00 179.25 180.53 2d3u h SER 300 N 0.64 0.53 -0.55 0.00 0.02 -0.95 0.15 113.55 113.39 2d3u h SER 300 Ca 0.16 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.04 2d3u h SER 300 Cb 0.17 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 2d3u h SER 300 CO -0.02 0.39 0.14 0.00 -1.14 0.00 0.00 176.83 176.20 2d3u h ALA 301 N 1.17 0.72 -0.22 3.77 0.00 -1.14 -2.59 119.26 120.96 2d3u h ALA 301 Ca 0.17 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2d3u h ALA 301 Cb -0.07 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2d3u h ALA 301 CO -0.04 0.42 -0.06 0.00 0.00 0.00 0.00 179.25 179.57 2d3u h ALA 302 N 1.02 1.49 -0.64 0.00 0.00 -0.12 -1.10 119.26 119.90 2d3u h ALA 302 Ca 0.17 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2d3u h ALA 302 Cb 0.33 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2d3u h ALA 302 CO 0.00 0.37 0.14 0.00 0.00 0.00 0.00 179.25 179.76 2d3u h ARG 304 N 0.96 0.16 -0.40 0.00 3.08 -1.13 -0.60 114.38 116.46 2d3u h ARG 304 Ca 0.20 -0.08 0.07 0.00 0.07 0.00 0.00 59.98 60.24 2d3u h ARG 304 Cb 0.36 -0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.35 2d3u h ARG 304 CO 0.00 0.57 0.03 0.00 -1.07 0.00 0.00 179.97 179.51 2d3u h ALA 305 N 0.59 0.40 0.00 0.04 0.00 -1.05 -1.36 119.26 117.88 2d3u h ALA 305 Ca 0.01 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2d3u h ALA 305 Cb 0.53 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2d3u h ALA 305 CO 0.01 -0.36 0.00 0.00 0.00 0.00 0.00 179.25 178.90 2d3u n ALA 306 N -2.51 2.44 -3.33 0.00 0.00 -0.12 -4.90 120.51 112.10 2d3u n ALA 306 Ca 0.03 -0.16 -0.24 0.00 0.00 0.00 0.00 53.44 53.07 2d3u n ALA 306 Cb 0.20 -1.43 0.03 0.00 0.00 0.00 0.00 19.45 18.26 2d3u n ALA 306 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2d3u n LYS 307 N -1.07 -5.30 -1.96 0.00 5.02 -0.51 -4.88 118.16 109.45 2d3u n LYS 307 Ca 0.18 0.76 -0.41 0.00 -2.02 0.00 0.00 58.31 56.82 2d3u n LYS 307 Cb 0.12 -5.64 -0.02 0.00 -0.02 0.00 0.00 35.03 29.47 2d3u n LYS 307 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2d3u s LEU 308 N -6.86 4.38 -0.36 -0.35 1.02 -0.32 -4.94 118.68 111.24 2d3u s LEU 308 Ca 0.43 2.78 -0.26 0.00 0.02 0.00 0.00 54.13 57.10 2d3u s LEU 308 Cb -0.20 -3.64 0.01 0.00 0.02 0.00 0.00 46.19 42.38 2d3u s LEU 308 CO 0.53 -0.73 0.92 -1.10 0.02 0.00 0.00 176.35 176.00 2d3u s GLN 309 N -0.96 3.86 -1.11 1.70 -1.52 -1.26 -4.27 119.66 116.10 2d3u s GLN 309 Ca 0.57 0.60 -0.20 0.00 -1.95 0.00 0.00 55.36 54.37 2d3u s GLN 309 Cb -0.43 -3.79 -0.00 0.00 -0.22 0.00 0.00 33.01 28.56 2d3u s GLN 309 CO 0.49 -0.93 0.78 -3.47 -0.25 0.00 0.00 175.29 171.91 2d3u n ASP 310 N 6.73 -5.33 -4.67 5.90 2.03 -1.26 -0.64 116.55 119.31 2d3u n ASP 310 Ca 0.07 -1.00 -0.43 0.00 0.52 0.00 0.00 54.79 53.95 2d3u n ASP 310 Cb 0.48 -3.23 -0.02 0.00 -0.72 0.00 0.00 41.12 37.63 2d3u n ASP 310 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2d3u s THR 312 N 2.92 3.55 0.22 0.00 2.01 0.31 -4.96 115.64 119.68 2d3u s THR 312 Ca 0.49 -0.49 0.10 0.00 0.31 0.00 0.00 61.69 62.09 2d3u s THR 312 Cb -0.18 -2.52 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 2d3u s THR 312 CO 0.12 0.52 -0.10 -0.04 -0.69 0.00 0.00 174.62 174.43 2d3u s MET 313 N 0.15 2.01 -0.12 4.92 -1.94 -1.26 -0.71 119.30 122.36 2d3u s MET 313 Ca -0.04 -1.40 -0.02 0.00 -1.71 0.00 0.00 55.69 52.53 2d3u s MET 313 Cb -0.14 -2.08 0.04 0.00 2.01 0.00 0.00 34.83 34.66 2d3u s MET 313 CO 0.04 0.40 -0.00 -1.17 -0.01 0.00 0.00 175.02 174.27 2d3u s LEU 314 N -3.10 0.90 -0.09 -0.03 2.96 -0.44 -4.32 118.68 114.56 2d3u s LEU 314 Ca 0.27 -0.36 0.04 0.00 -0.22 0.00 0.00 54.13 53.86 2d3u s LEU 314 Cb -0.08 -0.57 0.00 0.00 0.50 0.00 0.00 46.19 46.05 2d3u s LEU 314 CO 0.16 -0.21 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.07 2d3u s VAL 315 N 1.88 1.82 -0.37 1.68 1.01 0.27 -1.91 120.40 124.78 2d3u s VAL 315 Ca 0.03 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.13 2d3u s VAL 315 Cb -0.14 -1.58 0.12 0.00 0.00 0.00 0.00 36.38 34.78 2d3u s VAL 315 CO -0.07 0.51 0.17 0.20 0.00 0.00 0.00 175.10 175.91 2d3u s ASN 316 N 0.40 3.73 1.94 3.32 -0.87 -0.42 -0.46 114.94 122.58 2d3u s ASN 316 Ca -0.17 -2.09 0.00 0.00 -1.57 0.00 0.00 52.86 49.03 2d3u s ASN 316 Cb -0.17 -0.86 0.00 0.00 -0.02 0.00 0.00 41.25 40.20 2d3u s ASN 316 CO 0.07 -0.34 0.00 0.61 -2.57 0.00 0.00 177.10 174.87 2d3u n GLY 317 N 4.24 3.67 0.27 0.66 0.00 -1.26 -0.71 105.19 112.06 2d3u n GLY 317 Ca 0.04 -0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.14 2d3u n GLY 317 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2d3u n ASP 318 N 6.29 0.85 -4.69 1.61 5.75 -1.26 -3.58 116.55 121.52 2d3u n ASP 318 Ca 0.00 -1.32 -0.40 0.00 -0.01 0.00 0.00 54.79 53.06 2d3u n ASP 318 Cb 0.00 -0.01 -0.05 0.00 -1.03 0.00 0.00 41.12 40.03 2d3u n ASP 318 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2d3u s ASP 319 N -1.94 6.85 -0.02 -1.12 -1.08 0.12 -4.67 116.67 114.80 2d3u s ASP 319 Ca 0.41 1.03 0.02 0.00 -0.52 0.00 0.00 52.55 53.49 2d3u s ASP 319 Cb 0.21 -2.39 0.01 0.00 -1.46 0.00 0.00 42.92 39.29 2d3u s ASP 319 CO 0.34 -0.21 -0.05 -0.22 0.52 0.00 0.00 175.17 175.54 2d3u s LEU 320 N 1.42 1.68 -0.01 -1.34 2.96 -1.26 -1.30 118.68 120.83 2d3u s LEU 320 Ca 0.34 -0.12 0.02 0.00 -0.22 0.00 0.00 54.13 54.15 2d3u s LEU 320 Cb -0.17 -0.38 -0.00 0.00 0.50 0.00 0.00 46.19 46.14 2d3u s LEU 320 CO 0.14 0.02 -0.07 0.54 -1.32 0.00 0.00 176.35 175.65 2d3u s VAL 321 N 0.36 0.57 -0.06 1.68 0.11 -0.80 -0.83 120.40 121.43 2d3u s VAL 321 Ca -0.04 -0.28 0.03 0.00 -2.93 0.00 0.00 61.98 58.75 2d3u s VAL 321 Cb -0.08 -0.50 0.01 0.00 -1.53 0.00 0.00 36.38 34.27 2d3u s VAL 321 CO -0.00 0.17 -0.14 -0.69 -3.33 0.00 0.00 175.10 171.11 2d3u s VAL 322 N 0.00 1.27 -0.13 2.04 1.01 0.75 -1.33 120.40 124.01 2d3u s VAL 322 Ca 0.00 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.43 2d3u s VAL 322 Cb -0.05 -1.13 0.01 0.00 0.00 0.00 0.00 36.38 35.21 2d3u s VAL 322 CO -0.00 0.38 -0.21 -0.63 0.00 0.00 0.00 175.10 174.63 2d3u s ILE 323 N 0.48 2.14 0.05 2.22 1.01 0.12 -0.80 121.20 126.41 2d3u s ILE 323 Ca -0.12 -0.96 0.01 0.00 0.00 0.00 0.00 60.65 59.58 2d3u s ILE 323 Cb -0.15 -1.85 -0.00 0.00 0.01 0.00 0.00 42.46 40.47 2d3u s ILE 323 CO 0.04 0.55 0.05 0.00 0.00 0.00 0.00 174.94 175.57 2d3u s GLU 325 N -2.18 4.38 0.57 0.00 0.41 0.18 -1.75 118.70 120.31 2d3u s GLU 325 Ca 0.06 0.81 -0.16 0.00 -0.41 0.00 0.00 54.97 55.26 2d3u s GLU 325 Cb 0.00 -3.48 -0.05 0.00 -1.78 0.00 0.00 34.13 28.82 2d3u s GLU 325 CO 0.04 -0.01 1.04 0.45 -0.49 0.00 0.00 175.26 176.29 2d3u s SER 326 N 0.88 6.00 -0.04 -0.19 0.15 0.16 -4.52 113.70 116.14 2d3u s SER 326 Ca 0.35 1.77 0.06 0.00 0.70 0.00 0.00 55.95 58.83 2d3u s SER 326 Cb -0.17 -2.53 0.09 0.00 -1.71 0.00 0.00 66.02 61.70 2d3u s SER 326 CO 0.15 -1.02 0.96 0.00 1.20 0.00 0.00 173.24 174.53 2d3u n ALA 327 N -1.86 1.90 0.00 5.45 0.00 -1.26 -4.88 120.51 119.85 2d3u n ALA 327 Ca 0.08 -1.43 0.00 0.00 0.00 0.00 0.00 53.44 52.09 2d3u n ALA 327 Cb 0.53 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.76 2d3u n ALA 327 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d3u n GLY 328 N -0.61 2.76 0.29 0.00 0.00 -1.26 -4.54 105.19 101.84 2d3u n GLY 328 Ca 0.05 -1.89 -0.04 0.00 0.00 0.00 0.00 46.02 44.14 2d3u n GLY 328 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2d3u h THR 329 N 0.00 1.16 0.16 2.61 1.35 -1.98 0.15 112.91 116.36 2d3u h THR 329 Ca 0.00 -0.34 -0.01 0.00 -0.55 0.00 0.00 66.41 65.51 2d3u h THR 329 Cb 0.00 0.09 0.00 0.00 -1.73 0.00 0.00 68.15 66.51 2d3u h THR 329 CO 0.00 0.18 -0.08 1.56 -0.25 0.00 0.00 175.52 176.93 2d3u h GLN 330 N 0.99 -0.21 -0.75 4.72 4.20 -2.00 -0.63 115.11 121.43 2d3u h GLN 330 Ca 0.29 0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.96 2d3u h GLN 330 Cb -0.07 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 2d3u h GLN 330 CO -0.08 -0.13 0.26 0.93 -0.67 0.00 0.00 178.83 179.14 2d3u h GLU 331 N -0.22 1.15 -0.59 1.46 3.07 -1.76 -2.14 114.58 115.55 2d3u h GLU 331 Ca -0.02 -0.23 -0.09 0.00 -0.50 0.00 0.00 59.36 58.51 2d3u h GLU 331 Cb 0.17 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 2d3u h GLU 331 CO 0.04 0.96 0.00 -0.44 -1.40 0.00 0.00 179.01 178.17 2d3u h ASP 332 N 1.10 1.01 -0.43 1.42 3.32 -0.47 0.09 116.42 122.46 2d3u h ASP 332 Ca 0.25 -0.28 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 2d3u h ASP 332 Cb 0.27 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2d3u h ASP 332 CO -0.01 1.06 0.07 0.00 -1.72 0.00 0.00 179.24 178.64 2d3u h ALA 333 N 1.04 0.57 -0.52 3.45 0.00 -0.90 -0.46 119.26 122.43 2d3u h ALA 333 Ca 0.17 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2d3u h ALA 333 Cb 0.55 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2d3u h ALA 333 CO 0.03 0.28 0.05 0.00 0.00 0.00 0.00 179.25 179.62 2d3u h ALA 334 N 0.94 0.70 -0.52 0.00 0.00 -1.25 -1.37 119.26 117.77 2d3u h ALA 334 Ca 0.13 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2d3u h ALA 334 Cb 0.37 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2d3u h ALA 334 CO 0.01 0.47 0.34 0.77 0.00 0.00 0.00 179.25 180.83 2d3u h SER 335 N 0.77 0.60 -0.79 0.00 0.02 -0.77 -1.80 113.55 111.57 2d3u h SER 335 Ca 0.16 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 2d3u h SER 335 Cb 0.45 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.80 2d3u h SER 335 CO 0.02 0.44 0.41 -0.07 -1.14 0.00 0.00 176.83 176.49 2d3u h LEU 336 N 0.70 1.02 -0.67 5.07 3.38 -0.88 0.14 115.31 124.07 2d3u h LEU 336 Ca 0.19 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 2d3u h LEU 336 Cb -0.07 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.39 2d3u h LEU 336 CO -0.04 0.83 0.16 0.03 0.09 0.00 0.00 178.44 179.52 2d3u h ARG 337 N 1.13 1.07 -0.36 1.13 3.08 -0.77 0.14 114.38 119.81 2d3u h ARG 337 Ca 0.28 -0.26 -0.16 0.00 0.07 0.00 0.00 59.98 59.91 2d3u h ARG 337 Cb 0.06 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 2d3u h ARG 337 CO -0.04 0.96 -0.41 0.28 -1.07 0.00 0.00 179.97 179.69 2d3u h VAL 338 N 1.00 1.27 -0.65 2.04 2.07 -0.93 0.36 116.25 121.41 2d3u h VAL 338 Ca 0.21 -1.59 0.04 0.00 0.82 0.00 0.00 66.70 66.18 2d3u h VAL 338 Cb 0.37 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.52 2d3u h VAL 338 CO 0.00 0.53 0.39 0.15 0.02 0.00 0.00 177.57 178.66 2d3u h PHE 339 N 0.72 0.73 -0.47 1.57 3.57 -0.36 -1.09 116.94 121.62 2d3u h PHE 339 Ca 0.05 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.48 2d3u h PHE 339 Cb 1.00 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 2d3u h PHE 339 CO 0.06 0.40 -0.08 1.15 -2.23 0.00 0.00 178.31 177.61 2d3u h THR 340 N 0.75 1.26 -0.77 4.41 2.02 -0.49 -1.62 112.91 118.47 2d3u h THR 340 Ca 0.27 -1.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.29 2d3u h THR 340 Cb 0.07 0.98 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 2d3u h THR 340 CO -0.13 0.40 0.43 -0.33 0.37 0.00 0.00 175.52 176.26 2d3u h GLU 341 N 0.76 1.08 -0.14 6.66 5.08 -0.25 -0.87 114.58 126.90 2d3u h GLU 341 Ca 0.13 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2d3u h GLU 341 Cb 0.57 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 2d3u h GLU 341 CO 0.04 0.79 -0.03 0.00 -1.00 0.00 0.00 179.01 178.81 2d3u h ALA 342 N 1.22 0.19 -0.99 3.43 0.00 -0.97 -0.73 119.26 121.40 2d3u h ALA 342 Ca 0.27 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 55.04 2d3u h ALA 342 Cb 0.03 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.70 2d3u h ALA 342 CO -0.04 -0.08 0.64 0.52 0.00 0.00 0.00 179.25 180.29 2d3u h MET 343 N -0.04 1.10 -0.20 0.00 2.86 -1.14 -0.12 114.93 117.38 2d3u h MET 343 Ca 0.04 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2d3u h MET 343 Cb 0.44 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 2d3u h MET 343 CO 0.01 0.72 0.06 1.15 1.06 0.00 0.00 176.91 179.92 2d3u h THR 344 N 1.13 1.18 -0.05 2.22 2.02 -0.95 0.19 112.91 118.65 2d3u h THR 344 Ca 0.44 -0.57 0.01 0.00 0.77 0.00 0.00 66.41 67.06 2d3u h THR 344 Cb 0.23 1.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.83 2d3u h THR 344 CO -0.19 0.18 0.04 0.03 0.37 0.00 0.00 175.52 175.95 2d3u h ARG 345 N 0.15 0.00 -0.18 6.66 3.08 -0.21 0.10 114.38 123.98 2d3u h ARG 345 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2d3u h ARG 345 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2d3u h ARG 345 CO -0.00 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.56 2d3u n TYR 346 N -4.41 0.24 -2.77 3.04 4.01 -0.14 -1.54 117.16 115.59 2d3u n TYR 346 Ca -0.02 -0.12 -0.10 0.00 -0.16 0.00 0.00 57.90 57.50 2d3u n TYR 346 Cb 0.14 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.22 2d3u n TYR 346 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2d3u n SER 347 N 0.09 -3.11 -2.85 7.72 2.88 0.36 -4.95 113.62 113.77 2d3u n SER 347 Ca 0.11 -0.40 -0.11 0.00 -1.33 0.00 0.00 58.87 57.14 2d3u n SER 347 Cb 0.22 -3.37 0.05 0.00 -0.75 0.00 0.00 64.21 60.35 2d3u n SER 347 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2d3u n ALA 348 N -2.79 1.38 -1.65 -1.46 0.00 0.58 -4.59 120.51 111.98 2d3u n ALA 348 Ca -0.13 -2.37 -0.35 0.00 0.00 0.00 0.00 53.44 50.59 2d3u n ALA 348 Cb 0.59 -1.01 0.05 0.00 0.00 0.00 0.00 19.45 19.08 2d3u n ALA 348 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2d3u s PRO 349 N -1.29 2.80 0.51 0.00 0.04 -1.26 -4.05 135.00 131.75 2d3u s PRO 349 Ca 0.28 1.76 -0.18 0.00 0.04 0.00 0.00 61.00 62.91 2d3u s PRO 349 Cb 0.37 -1.91 -0.07 0.00 0.04 0.00 0.00 34.50 32.92 2d3u s PRO 349 CO -0.05 -1.33 1.01 -1.25 0.04 0.00 0.00 177.00 175.42 2d3u s PRO 350 N -3.52 3.80 0.00 0.56 0.04 -1.26 -0.89 135.00 133.73 2d3u s PRO 350 Ca 0.76 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.93 2d3u s PRO 350 Cb -0.29 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.14 2d3u s PRO 350 CO 0.36 -0.41 0.00 0.41 0.04 0.00 0.00 177.00 177.41 2d3u n GLY 351 N -0.97 0.11 3.66 0.56 0.00 0.46 -4.35 105.19 104.66 2d3u n GLY 351 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2d3u n GLY 351 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2d3u s ASP 352 N -1.77 6.69 0.46 1.61 1.01 -1.26 -4.97 116.67 118.45 2d3u s ASP 352 Ca 0.00 0.84 -0.25 0.00 0.71 0.00 0.00 52.55 53.85 2d3u s ASP 352 Cb 0.00 -2.35 -0.08 0.00 1.01 0.00 0.00 42.92 41.50 2d3u s ASP 352 CO 0.00 -0.27 1.43 -2.16 0.21 0.00 0.00 175.17 174.38 2d3u s PRO 353 N 1.88 3.60 0.47 8.23 0.04 -1.26 -4.43 135.00 143.53 2d3u s PRO 353 Ca 0.29 2.42 -0.23 0.00 0.04 0.00 0.00 61.00 63.52 2d3u s PRO 353 Cb -0.16 -2.60 -0.07 0.00 0.04 0.00 0.00 34.50 31.71 2d3u s PRO 353 CO 0.10 -0.89 1.19 -1.25 0.04 0.00 0.00 177.00 176.20 2d3u s PRO 354 N -2.52 3.69 -0.05 0.56 0.04 -1.26 -5.01 135.00 130.45 2d3u s PRO 354 Ca 0.62 1.84 0.03 0.00 0.04 0.00 0.00 61.00 63.53 2d3u s PRO 354 Cb -0.44 -2.40 0.01 0.00 0.04 0.00 0.00 34.50 31.71 2d3u s PRO 354 CO 0.56 -0.63 -0.13 1.14 0.04 0.00 0.00 177.00 177.98 2d3u s GLN 355 N -2.71 1.58 0.41 4.56 -2.07 -1.26 -4.99 119.66 115.18 2d3u s GLN 355 Ca 0.64 -0.44 -0.25 0.00 -1.82 0.00 0.00 55.36 53.49 2d3u s GLN 355 Cb -0.30 -1.34 -0.08 0.00 -1.09 0.00 0.00 33.01 30.19 2d3u s GLN 355 CO 0.37 0.09 1.25 -1.25 -1.32 0.00 0.00 175.29 174.43 2d3u s PRO 356 N 0.43 3.94 0.04 9.60 0.04 -1.26 -4.62 135.00 143.17 2d3u s PRO 356 Ca -0.10 2.02 0.07 0.00 0.04 0.00 0.00 61.00 63.03 2d3u s PRO 356 Cb -0.13 -2.68 -0.02 0.00 0.04 0.00 0.00 34.50 31.70 2d3u s PRO 356 CO 0.03 -0.47 -0.21 -1.21 0.04 0.00 0.00 177.00 175.18 2d3u s GLU 357 N -2.32 1.42 0.00 4.56 0.41 0.38 -4.95 118.70 118.20 2d3u s GLU 357 Ca 0.58 -0.93 0.03 0.00 -0.41 0.00 0.00 54.97 54.24 2d3u s GLU 357 Cb -0.35 -1.53 0.02 0.00 -1.78 0.00 0.00 34.13 30.50 2d3u s GLU 357 CO 0.44 0.39 0.58 0.66 -0.49 0.00 0.00 175.26 176.85 2d3u n TYR 358 N 1.89 0.00 -4.06 1.61 4.01 -1.26 -1.40 117.16 117.95 2d3u n TYR 358 Ca -0.17 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.24 2d3u n TYR 358 Cb 0.53 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.41 2d3u n TYR 358 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2d3u s ASP 359 N -0.28 4.02 0.32 7.72 -1.08 -1.26 -4.97 116.67 121.14 2d3u s ASP 359 Ca 0.04 -1.06 0.03 0.00 -0.52 0.00 0.00 52.55 51.04 2d3u s ASP 359 Cb 0.03 -1.55 0.63 0.00 -1.46 0.00 0.00 42.92 40.56 2d3u s ASP 359 CO 0.04 -0.12 1.89 0.25 0.52 0.00 0.00 175.17 177.75 2d3u h LEU 360 N 7.88 0.83 -2.15 -1.34 5.85 -1.95 -0.87 115.31 123.55 2d3u h LEU 360 Ca -0.30 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.44 2d3u h LEU 360 Cb 1.08 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.97 2d3u h LEU 360 CO 0.54 0.48 0.00 -0.33 -0.34 0.00 0.00 178.44 178.79 2d3u h GLU 361 N 0.91 0.00 -0.13 1.25 5.08 -1.96 -1.64 114.58 118.10 2d3u h GLU 361 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 2d3u h GLU 361 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2d3u h GLU 361 CO -0.19 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.10 2d3u n LEU 362 N -2.79 1.88 -4.64 1.33 4.77 -0.33 -4.59 117.00 112.63 2d3u n LEU 362 Ca -0.02 -0.73 -0.38 0.00 -0.03 0.00 0.00 56.01 54.86 2d3u n LEU 362 Cb 0.11 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.04 2d3u n LEU 362 CO 0.18 0.36 0.00 -0.63 -1.33 0.00 0.00 177.39 175.98 2d3u s ILE 363 N -1.85 5.23 -0.28 -0.08 1.01 -0.62 -5.05 121.20 119.56 2d3u s ILE 363 Ca 0.34 0.49 -0.07 0.00 0.00 0.00 0.00 60.65 61.42 2d3u s ILE 363 Cb 0.19 -3.65 -0.00 0.00 0.01 0.00 0.00 42.46 39.01 2d3u s ILE 363 CO 0.29 0.23 0.08 -0.89 0.00 0.00 0.00 174.94 174.66 2d3u s THR 364 N 1.59 4.11 -0.02 2.92 2.01 -1.26 -4.33 115.64 120.65 2d3u s THR 364 Ca 0.14 -0.53 0.01 0.00 0.31 0.00 0.00 61.69 61.61 2d3u s THR 364 Cb -0.15 -3.06 0.01 0.00 0.01 0.00 0.00 72.50 69.31 2d3u s THR 364 CO 0.08 0.15 -0.03 -0.94 -0.69 0.00 0.00 174.62 173.19 2d3u s SER 365 N 1.54 0.64 -1.28 3.53 1.04 -0.25 -4.72 113.70 114.20 2d3u s SER 365 Ca 0.04 -0.08 -0.06 0.00 0.48 0.00 0.00 55.95 56.32 2d3u s SER 365 Cb -0.17 -0.24 0.01 0.00 0.10 0.00 0.00 66.02 65.72 2d3u s SER 365 CO 0.03 -0.03 0.83 0.00 0.98 0.00 0.00 173.24 175.06 2d3u n SER 367 N -2.29 -5.29 -4.35 0.00 7.64 -1.26 -4.93 113.62 103.13 2d3u n SER 367 Ca -0.04 0.32 -0.18 0.00 1.01 0.00 0.00 58.87 59.98 2d3u n SER 367 Cb 0.58 -4.13 -0.10 0.00 -1.01 0.00 0.00 64.21 59.54 2d3u n SER 367 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2d3u s SER 368 N -2.38 1.92 0.04 6.43 0.01 -0.79 -4.49 113.70 114.44 2d3u s SER 368 Ca 0.00 -1.25 -0.12 0.00 1.31 0.00 0.00 55.95 55.89 2d3u s SER 368 Cb 0.00 -0.00 0.01 0.00 0.21 0.00 0.00 66.02 66.24 2d3u s SER 368 CO 0.00 -0.53 0.25 0.54 0.41 0.00 0.00 173.24 173.91 2d3u s ASN 369 N -3.34 -0.05 0.26 2.44 4.22 -0.27 -1.09 114.94 117.11 2d3u s ASN 369 Ca 0.30 -0.26 -0.29 0.00 -2.14 0.00 0.00 52.86 50.47 2d3u s ASN 369 Cb 0.06 0.32 -0.09 0.00 1.28 0.00 0.00 41.25 42.82 2d3u s ASN 369 CO 0.10 -0.58 0.94 -0.69 -2.04 0.00 0.00 177.10 174.83 2d3u s VAL 370 N -2.49 4.12 0.29 3.54 1.01 -1.26 -1.78 120.40 123.82 2d3u s VAL 370 Ca -0.05 2.01 0.01 0.00 0.00 0.00 0.00 61.98 63.94 2d3u s VAL 370 Cb -0.01 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 32.11 2d3u s VAL 370 CO -0.03 0.40 0.30 -0.55 0.00 0.00 0.00 175.10 175.21 2d3u s SER 371 N -1.30 0.90 0.04 3.32 0.15 -0.55 -4.11 113.70 112.15 2d3u s SER 371 Ca 0.43 -1.52 0.04 0.00 0.70 0.00 0.00 55.95 55.61 2d3u s SER 371 Cb -0.24 0.53 -0.02 0.00 -1.71 0.00 0.00 66.02 64.58 2d3u s SER 371 CO 0.30 -1.06 -0.12 0.54 1.20 0.00 0.00 173.24 174.10 2d3u s VAL 372 N -3.61 0.91 0.00 4.45 0.11 -1.26 -1.64 120.40 119.35 2d3u s VAL 372 Ca 0.36 -0.97 0.00 0.00 -2.93 0.00 0.00 61.98 58.45 2d3u s VAL 372 Cb 0.03 -0.85 0.00 0.00 -1.53 0.00 0.00 36.38 34.02 2d3u s VAL 372 CO 0.20 -0.09 0.00 0.00 -3.33 0.00 0.00 175.10 171.87 2d3u n ALA 373 N 1.85 0.00 -2.61 1.54 0.00 -0.24 -3.26 120.51 117.80 2d3u n ALA 373 Ca -0.19 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.04 2d3u n ALA 373 Cb 0.55 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.85 2d3u n ALA 373 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2d3u s HIS 374 N -2.69 1.16 0.11 0.00 3.76 -0.32 -0.22 115.29 117.09 2d3u s HIS 374 Ca 0.00 -0.24 -0.01 0.00 -0.15 0.00 0.00 55.06 54.66 2d3u s HIS 374 Cb 0.00 -0.73 0.02 0.00 1.11 0.00 0.00 32.58 32.98 2d3u s HIS 374 CO 0.00 -0.01 0.15 -0.40 -0.85 0.00 0.00 174.74 173.63 2d3u n ASP 375 N 2.59 0.11 -0.03 1.40 5.68 -0.73 -0.61 116.55 124.96 2d3u n ASP 375 Ca -0.15 -1.11 0.08 0.00 -0.50 0.00 0.00 54.79 53.11 2d3u n ASP 375 Cb 0.55 -0.11 0.48 0.00 -1.14 0.00 0.00 41.12 40.90 2d3u n ASP 375 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2d3u h ALA 376 N -1.15 1.88 0.00 2.12 0.00 -1.91 -1.30 119.26 118.90 2d3u h ALA 376 Ca -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2d3u h ALA 376 Cb 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2d3u h ALA 376 CO 0.04 0.04 0.00 0.43 0.00 0.00 0.00 179.25 179.76 2d3u n SER 377 N -4.48 0.54 0.00 0.00 7.64 -1.26 -4.88 113.62 111.18 2d3u n SER 377 Ca 0.06 0.57 0.00 0.00 1.01 0.00 0.00 58.87 60.51 2d3u n SER 377 Cb 0.22 -0.71 0.00 0.00 -1.01 0.00 0.00 64.21 62.72 2d3u n SER 377 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d3u n GLY 378 N 1.08 0.58 3.76 0.23 0.00 -0.49 -5.05 105.19 105.30 2d3u n GLY 378 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 2d3u n GLY 378 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2d3u s LYS 379 N -0.82 4.49 0.19 1.61 2.20 -1.26 -4.72 119.74 121.43 2d3u s LYS 379 Ca 0.00 2.03 -0.30 0.00 -0.36 0.00 0.00 55.97 57.34 2d3u s LYS 379 Cb 0.00 -3.12 -0.09 0.00 -1.51 0.00 0.00 37.83 33.11 2d3u s LYS 379 CO 0.00 -0.01 1.31 1.03 -0.36 0.00 0.00 175.35 177.32 2d3u s ARG 380 N -1.63 4.39 -0.04 4.03 0.52 -1.26 -1.77 118.95 123.18 2d3u s ARG 380 Ca 0.47 2.05 -0.00 0.00 -0.52 0.00 0.00 55.73 57.73 2d3u s ARG 380 Cb -0.36 -3.20 0.03 0.00 0.52 0.00 0.00 34.95 31.93 2d3u s ARG 380 CO 0.48 -0.26 -0.01 0.54 0.02 0.00 0.00 175.30 176.07 2d3u s VAL 381 N 0.17 0.28 0.20 3.52 0.11 0.70 -4.92 120.40 120.45 2d3u s VAL 381 Ca 0.57 0.07 -0.17 0.00 -2.93 0.00 0.00 61.98 59.52 2d3u s VAL 381 Cb -0.36 -0.39 -0.08 0.00 -1.53 0.00 0.00 36.38 34.02 2d3u s VAL 381 CO 0.38 0.19 0.66 -0.31 -3.33 0.00 0.00 175.10 172.69 2d3u s TYR 382 N 1.30 3.62 0.20 1.54 2.02 -1.26 -1.08 117.35 123.68 2d3u s TYR 382 Ca -0.06 1.25 -0.16 0.00 -0.37 0.00 0.00 57.07 57.73 2d3u s TYR 382 Cb -0.13 -2.52 0.02 0.00 -0.40 0.00 0.00 41.96 38.93 2d3u s TYR 382 CO -0.02 0.36 0.49 1.52 -1.57 0.00 0.00 175.55 176.32 2d3u s TYR 383 N -1.53 -0.01 -0.09 2.71 1.13 -0.65 -4.98 117.35 113.92 2d3u s TYR 383 Ca 0.42 -0.34 -0.14 0.00 -1.41 0.00 0.00 57.07 55.60 2d3u s TYR 383 Cb -0.16 0.32 -0.05 0.00 -1.10 0.00 0.00 41.96 40.97 2d3u s TYR 383 CO 0.20 -0.90 0.33 -1.17 -2.51 0.00 0.00 175.55 171.50 2d3u s LEU 384 N -2.90 4.35 0.00 -3.49 2.96 -1.26 -1.48 118.68 116.86 2d3u s LEU 384 Ca 0.11 0.69 0.05 0.00 -0.22 0.00 0.00 54.13 54.76 2d3u s LEU 384 Cb -0.00 -2.44 -0.02 0.00 0.50 0.00 0.00 46.19 44.23 2d3u s LEU 384 CO -0.01 0.21 0.23 1.07 -1.32 0.00 0.00 176.35 176.53 2d3u n THR 385 N 2.74 0.00 -3.61 3.68 5.66 -0.73 -4.73 114.28 117.30 2d3u n THR 385 Ca -0.13 -1.74 -0.07 0.00 -3.05 0.00 0.00 64.05 59.06 2d3u n THR 385 Cb 0.52 0.89 -0.02 0.00 -1.55 0.00 0.00 70.33 70.18 2d3u n THR 385 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2d3u s ARG 386 N -2.95 1.05 0.18 1.09 1.70 -1.26 -1.11 118.95 117.65 2d3u s ARG 386 Ca 0.29 -0.49 -0.32 0.00 -0.47 0.00 0.00 55.73 54.74 2d3u s ARG 386 Cb 0.01 0.42 -0.12 0.00 -0.57 0.00 0.00 34.95 34.69 2d3u s ARG 386 CO 0.20 -0.47 1.75 -3.47 -1.08 0.00 0.00 175.30 172.23 2d3u n ASP 387 N -0.35 3.95 0.00 -2.89 -0.08 -1.26 -4.86 116.55 111.06 2d3u n ASP 387 Ca -0.08 1.04 0.14 0.00 -1.51 0.00 0.00 54.79 54.38 2d3u n ASP 387 Cb 0.62 -1.56 0.79 0.00 2.34 0.00 0.00 41.12 43.31 2d3u n ASP 387 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2d3u n PRO 388 N 4.47 0.65 -0.03 -0.67 -0.04 -1.26 -4.38 135.00 133.74 2d3u n PRO 388 Ca 0.17 0.01 -0.11 0.00 -0.04 0.00 0.00 63.50 63.53 2d3u n PRO 388 Cb 0.35 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.26 2d3u n PRO 388 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2d3u h THR 389 N 0.00 0.19 -0.43 0.52 2.02 -1.95 0.15 112.91 113.42 2d3u h THR 389 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 2d3u h THR 389 Cb 0.14 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.73 2d3u h THR 389 CO 0.00 0.00 -0.02 0.74 0.37 0.00 0.00 175.52 176.61 2d3u h THR 390 N -0.42 1.26 -0.83 3.16 2.02 -1.94 -0.46 112.91 115.70 2d3u h THR 390 Ca 0.10 -1.06 0.08 0.00 0.77 0.00 0.00 66.41 66.30 2d3u h THR 390 Cb 0.59 1.10 -0.07 0.00 -1.74 0.00 0.00 68.15 68.03 2d3u h THR 390 CO -0.42 0.36 0.49 -0.65 0.37 0.00 0.00 175.52 175.68 2d3u h PRO 391 N 0.60 0.84 -0.08 6.66 0.11 -1.73 -0.64 132.00 137.76 2d3u h PRO 391 Ca 0.12 -0.05 -0.21 0.00 0.11 0.00 0.00 66.00 65.97 2d3u h PRO 391 Cb 0.51 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.43 2d3u h PRO 391 CO 0.03 0.56 -0.80 -0.07 -0.21 0.00 0.00 178.00 177.50 2d3u h LEU 392 N 0.87 0.66 -0.40 2.35 3.38 -0.51 -1.26 115.31 120.40 2d3u h LEU 392 Ca 0.38 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 2d3u h LEU 392 Cb 0.27 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2d3u h LEU 392 CO -0.21 1.23 0.24 0.00 0.09 0.00 0.00 178.44 179.79 2d3u h ALA 393 N 0.75 0.51 -0.19 1.53 0.00 -0.65 -1.19 119.26 120.03 2d3u h ALA 393 Ca -0.05 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2d3u h ALA 393 Cb 1.41 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2d3u h ALA 393 CO 0.15 0.01 -0.24 0.00 0.00 0.00 0.00 179.25 179.17 2d3u h ARG 394 N 0.52 0.34 -0.18 0.00 3.08 -1.09 -2.47 114.38 114.57 2d3u h ARG 394 Ca 0.14 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 59.98 2d3u h ARG 394 Cb 0.01 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2d3u h ARG 394 CO -0.03 0.56 -0.30 0.00 -1.07 0.00 0.00 179.97 179.14 2d3u h ALA 395 N 1.45 1.15 -0.54 0.04 0.00 -0.76 0.08 119.26 120.68 2d3u h ALA 395 Ca 0.05 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 2d3u h ALA 395 Cb 0.59 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2d3u h ALA 395 CO 0.04 0.54 0.01 0.00 0.00 0.00 0.00 179.25 179.85 2d3u h ALA 396 N 1.37 0.72 -0.49 0.00 0.00 -0.85 -0.86 119.26 119.15 2d3u h ALA 396 Ca 0.04 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 2d3u h ALA 396 Cb 0.69 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2d3u h ALA 396 CO 0.05 0.53 0.04 2.35 0.00 0.00 0.00 179.25 182.22 2d3u h TRP 397 N 0.81 0.90 0.00 0.00 2.91 -1.04 -2.49 115.95 117.05 2d3u h TRP 397 Ca 0.15 -0.14 0.00 0.00 1.13 0.00 0.00 58.89 60.03 2d3u h TRP 397 Cb 0.51 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 28.92 2d3u h TRP 397 CO 0.04 0.84 0.00 0.39 -1.03 0.00 0.00 178.44 178.68 2d3u n GLU 398 N -4.38 0.00 0.09 2.65 1.02 -0.02 -1.34 120.64 118.66 2d3u n GLU 398 Ca 0.01 0.17 -0.05 0.00 -0.02 0.00 0.00 57.16 57.27 2d3u n GLU 398 Cb 0.28 -1.51 -0.01 0.00 -0.02 0.00 0.00 31.44 30.19 2d3u n GLU 398 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2d3u h THR 399 N 0.00 1.60 0.00 2.62 2.02 -0.68 -3.33 112.91 115.15 2d3u h THR 399 Ca 0.00 -2.89 0.00 0.00 0.77 0.00 0.00 66.41 64.29 2d3u h THR 399 Cb 0.33 2.57 0.00 0.00 -1.74 0.00 0.00 68.15 69.31 2d3u h THR 399 CO 0.00 0.83 -0.75 0.00 0.37 0.00 0.00 175.52 175.97 2d3u n ALA 400 N -2.39 3.37 -3.35 6.16 0.00 -0.98 -4.88 120.51 118.45 2d3u n ALA 400 Ca -0.01 -0.33 -0.14 0.00 0.00 0.00 0.00 53.44 52.96 2d3u n ALA 400 Cb 0.82 -0.44 -0.15 0.00 0.00 0.00 0.00 19.45 19.68 2d3u n ALA 400 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2d3u s ARG 401 N -2.27 0.06 -0.10 0.00 1.81 -0.45 -4.96 118.95 113.04 2d3u s ARG 401 Ca 0.03 0.07 -0.27 0.00 -1.72 0.00 0.00 55.73 53.84 2d3u s ARG 401 Cb 0.09 -0.20 -0.02 0.00 -0.45 0.00 0.00 34.95 34.37 2d3u s ARG 401 CO 0.50 -0.08 0.90 -1.01 -0.68 0.00 0.00 175.30 174.92 2d3u s HIS 402 N 0.58 3.52 0.34 -0.53 3.76 -1.26 -4.23 115.29 117.46 2d3u s HIS 402 Ca -0.05 1.44 0.09 0.00 -0.15 0.00 0.00 55.06 56.40 2d3u s HIS 402 Cb -0.07 -3.06 -0.06 0.00 1.11 0.00 0.00 32.58 30.49 2d3u s HIS 402 CO -0.01 -0.14 -0.08 0.95 -0.85 0.00 0.00 174.74 174.60 2d3u s THR 403 N 1.69 2.30 0.21 1.30 -4.23 -1.26 -5.04 115.64 110.62 2d3u s THR 403 Ca 0.44 -2.17 -0.10 0.00 -1.18 0.00 0.00 61.69 58.68 2d3u s THR 403 Cb -0.18 -2.67 0.17 0.00 1.34 0.00 0.00 72.50 71.16 2d3u s THR 403 CO 0.18 -0.20 1.88 -0.65 -0.54 0.00 0.00 174.62 175.28 2d3u h PRO 404 N 1.99 1.05 -4.91 3.99 0.11 -1.96 -3.39 132.00 128.87 2d3u h PRO 404 Ca -0.42 -0.07 -0.66 0.00 0.11 0.00 0.00 66.00 64.95 2d3u h PRO 404 Cb 1.25 -0.23 -0.26 0.00 0.11 0.00 0.00 31.00 31.87 2d3u h PRO 404 CO 0.70 0.71 -0.67 0.08 -0.21 0.00 0.00 178.00 178.61 2d3u s VAL 405 N -6.08 3.76 -1.03 3.15 1.01 -1.26 -4.59 120.40 115.36 2d3u s VAL 405 Ca -0.13 -0.52 -0.18 0.00 0.00 0.00 0.00 61.98 61.14 2d3u s VAL 405 Cb 0.15 -2.82 0.12 0.00 0.00 0.00 0.00 36.38 33.84 2d3u s VAL 405 CO 0.79 0.27 1.29 0.20 0.00 0.00 0.00 175.10 177.64 2d3u s ASN 406 N 1.51 6.72 0.45 3.32 0.01 -0.44 -4.86 114.94 121.65 2d3u s ASN 406 Ca 0.04 -2.20 0.11 0.00 -0.71 0.00 0.00 52.86 50.10 2d3u s ASN 406 Cb -0.16 -2.44 1.01 0.00 0.41 0.00 0.00 41.25 40.07 2d3u s ASN 406 CO 0.00 -1.07 2.08 0.77 -1.51 0.00 0.00 177.10 177.37 2d3u h SER 407 N 8.52 0.27 -0.73 -1.22 4.64 -1.93 -2.11 113.55 120.99 2d3u h SER 407 Ca 0.22 -0.01 0.06 0.00 -0.47 0.00 0.00 61.79 61.59 2d3u h SER 407 Cb 0.98 -0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 62.96 2d3u h SER 407 CO 1.21 0.22 0.48 4.11 -0.87 0.00 0.00 176.83 181.98 2d3u h TRP 408 N 0.31 0.79 -0.03 4.77 5.08 -1.89 0.16 115.95 125.14 2d3u h TRP 408 Ca 0.08 0.02 -0.21 0.00 1.08 0.00 0.00 58.89 59.86 2d3u h TRP 408 Cb 0.01 -0.26 0.02 0.00 -3.00 0.00 0.00 29.16 25.92 2d3u h TRP 408 CO 0.00 0.42 -0.80 1.25 -1.28 0.00 0.00 178.44 178.03 2d3u h LEU 409 N 0.78 0.75 -0.94 0.11 5.85 -1.78 -1.31 115.31 118.76 2d3u h LEU 409 Ca 0.31 -0.72 -0.04 0.00 0.84 0.00 0.00 57.88 58.26 2d3u h LEU 409 Cb 0.23 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 2d3u h LEU 409 CO -0.10 1.37 0.25 1.23 -0.34 0.00 0.00 178.44 180.85 2d3u h GLY 410 N 0.20 1.10 1.50 3.75 0.00 -1.21 -1.81 103.07 106.59 2d3u h GLY 410 Ca -0.09 -0.59 -0.13 0.00 0.00 0.00 0.00 47.33 46.51 2d3u h GLY 410 CO 0.16 0.56 -0.41 3.43 0.00 0.00 0.00 176.54 180.28 2d3u h ASN 411 N 1.00 0.58 -0.51 0.19 2.35 -0.64 -0.38 115.58 118.18 2d3u h ASN 411 Ca 0.23 -0.26 -0.08 0.00 -0.55 0.00 0.00 56.30 55.63 2d3u h ASN 411 Cb 0.22 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 2d3u h ASN 411 CO -0.02 0.93 0.01 0.40 -1.65 0.00 0.00 177.43 177.11 2d3u h ILE 412 N 0.45 1.26 0.06 2.81 2.04 -0.96 0.30 117.51 123.47 2d3u h ILE 412 Ca 0.04 -1.07 -0.00 0.00 1.00 0.00 0.00 64.86 64.83 2d3u h ILE 412 Cb 0.91 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 2d3u h ILE 412 CO 0.08 0.38 -0.03 0.40 0.00 0.00 0.00 178.15 178.98 2d3u h ILE 413 N 0.87 1.20 0.00 -0.67 2.04 -1.09 -0.83 117.51 119.03 2d3u h ILE 413 Ca 0.16 -0.97 -0.11 0.00 1.00 0.00 0.00 64.86 64.95 2d3u h ILE 413 Cb 0.49 1.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.38 2d3u h ILE 413 CO 0.02 0.24 -0.51 0.24 0.00 0.00 0.00 178.15 178.14 2d3u h MET 414 N -0.52 0.00 -0.17 2.37 2.86 -1.03 -3.31 114.93 115.12 2d3u h MET 414 Ca -0.01 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.50 2d3u h MET 414 Cb 0.46 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 32.00 2d3u h MET 414 CO 0.01 0.51 -0.60 0.66 1.06 0.00 0.00 176.91 178.56 2d3u n TYR 415 N -3.49 0.61 -0.28 -0.22 4.01 0.10 -4.85 117.16 113.05 2d3u n TYR 415 Ca 0.00 -1.62 0.07 0.00 -0.16 0.00 0.00 57.90 56.19 2d3u n TYR 415 Cb 0.63 -0.27 0.22 0.00 -0.31 0.00 0.00 39.34 39.61 2d3u n TYR 415 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2d3u h ALA 416 N 1.28 1.21 0.00 -0.72 0.00 -1.24 -1.65 119.26 118.13 2d3u h ALA 416 Ca 0.07 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2d3u h ALA 416 Cb 1.16 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2d3u h ALA 416 CO 0.17 -0.20 0.00 -2.30 0.00 0.00 0.00 179.25 176.93 2d3u n PRO 417 N -4.97 0.08 -2.35 0.00 -0.02 -1.26 -4.45 135.00 122.03 2d3u n PRO 417 Ca 0.17 0.32 -0.34 0.00 -2.02 0.00 0.00 63.50 61.62 2d3u n PRO 417 Cb 0.47 -1.65 -0.01 0.00 -0.02 0.00 0.00 33.50 32.28 2d3u n PRO 417 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2d3u s THR 418 N -3.13 3.51 0.11 3.45 -4.23 -0.62 -4.88 115.64 109.85 2d3u s THR 418 Ca 0.06 0.91 -0.21 0.00 -1.18 0.00 0.00 61.69 61.27 2d3u s THR 418 Cb 0.09 -3.36 -0.09 0.00 1.34 0.00 0.00 72.50 70.48 2d3u s THR 418 CO 0.32 -0.23 1.74 0.25 -0.54 0.00 0.00 174.62 176.16 2d3u h LEU 419 N 1.26 -0.00 -0.56 4.79 5.85 -1.90 -2.44 115.31 122.31 2d3u h LEU 419 Ca -0.49 0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.12 2d3u h LEU 419 Cb 1.24 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2d3u h LEU 419 CO 0.58 0.02 -0.20 4.11 -0.34 0.00 0.00 178.44 182.61 2d3u h TRP 420 N 0.07 1.08 -0.57 1.25 5.08 -1.93 -1.10 115.95 119.83 2d3u h TRP 420 Ca 0.05 -0.25 -0.10 0.00 1.08 0.00 0.00 58.89 59.67 2d3u h TRP 420 Cb 0.05 -0.26 -0.02 0.00 -3.00 0.00 0.00 29.16 25.93 2d3u h TRP 420 CO -0.12 1.05 -0.05 0.00 -1.28 0.00 0.00 178.44 178.04 2d3u h ALA 421 N 0.94 0.77 -0.01 0.11 0.00 -1.78 -1.59 119.26 117.70 2d3u h ALA 421 Ca 0.11 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2d3u h ALA 421 Cb 0.76 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2d3u h ALA 421 CO 0.06 0.65 -0.03 0.00 0.00 0.00 0.00 179.25 179.93 2d3u h ARG 422 N 0.92 0.04 -0.25 0.00 3.08 -1.42 -0.65 114.38 116.10 2d3u h ARG 422 Ca 0.15 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 2d3u h ARG 422 Cb 0.62 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 2d3u h ARG 422 CO 0.04 0.68 0.05 1.98 -1.07 0.00 0.00 179.97 181.65 2d3u h MET 423 N -0.60 0.41 0.00 0.04 4.05 -1.26 -3.34 114.93 114.23 2d3u h MET 423 Ca -0.00 -0.10 0.00 0.00 -0.28 0.00 0.00 59.70 59.31 2d3u h MET 423 Cb 0.68 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.43 2d3u h MET 423 CO 0.01 0.52 -0.81 -0.89 0.23 0.00 0.00 176.91 175.97 2d3u n ILE 424 N -4.70 1.31 -0.04 1.77 5.41 -0.60 -4.21 119.36 118.29 2d3u n ILE 424 Ca -0.03 0.20 -0.09 0.00 1.00 0.00 0.00 62.75 63.83 2d3u n ILE 424 Cb 0.19 -2.19 -0.02 0.00 -0.71 0.00 0.00 39.64 36.90 2d3u n ILE 424 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2d3u h LEU 425 N -0.81 -0.02 -0.04 1.39 3.38 -1.44 0.19 115.31 117.96 2d3u h LEU 425 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2d3u h LEU 425 Cb 0.81 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 2d3u h LEU 425 CO 0.00 0.02 0.02 0.24 0.09 0.00 0.00 178.44 178.81 2d3u h MET 426 N 0.10 0.05 0.25 1.13 2.86 -1.27 -2.13 114.93 115.92 2d3u h MET 426 Ca 0.10 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 2d3u h MET 426 Cb 0.10 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.75 2d3u h MET 426 CO -0.14 0.05 -0.12 1.15 1.06 0.00 0.00 176.91 178.91 2d3u h THR 427 N 0.04 0.78 0.01 2.22 2.02 -1.65 -1.91 112.91 114.42 2d3u h THR 427 Ca 0.01 -0.14 0.01 0.00 0.77 0.00 0.00 66.41 67.06 2d3u h THR 427 Cb 0.01 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2d3u h THR 427 CO -0.00 0.03 -0.06 -0.74 0.37 0.00 0.00 175.52 175.12 2d3u h HIS 428 N -0.40 -0.16 0.01 3.16 6.17 -0.95 -1.73 115.15 121.24 2d3u h HIS 428 Ca -0.03 0.00 -0.20 0.00 0.71 0.00 0.00 60.37 60.85 2d3u h HIS 428 Cb 0.31 0.07 -0.01 0.00 2.52 0.00 0.00 27.41 30.30 2d3u h HIS 428 CO -0.04 -0.10 -0.92 0.74 0.71 0.00 0.00 177.93 178.32 2d3u h PHE 429 N -0.12 0.26 -0.24 5.26 0.04 -1.44 -2.40 116.94 118.30 2d3u h PHE 429 Ca 0.02 -0.15 -0.12 0.00 2.80 0.00 0.00 57.97 60.52 2d3u h PHE 429 Cb 0.15 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 2d3u h PHE 429 CO -0.13 0.99 -0.36 0.74 -0.60 0.00 0.00 178.31 178.95 2d3u h PHE 430 N 0.09 0.62 -0.39 -0.55 -1.00 -1.35 0.23 116.94 114.59 2d3u h PHE 430 Ca -0.05 -0.17 0.02 0.00 2.81 0.00 0.00 57.97 60.59 2d3u h PHE 430 Cb 1.57 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 40.96 2d3u h PHE 430 CO 0.03 0.82 0.21 1.03 -1.61 0.00 0.00 178.31 178.79 2d3u h SER 431 N 0.44 0.33 -0.25 2.17 0.87 -1.24 0.31 113.55 116.18 2d3u h SER 431 Ca 0.05 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.59 2d3u h SER 431 Cb 0.84 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.73 2d3u h SER 431 CO 0.07 0.24 0.06 0.40 -0.53 0.00 0.00 176.83 177.07 2d3u h ILE 432 N 0.43 1.22 -0.98 2.23 2.04 -0.90 -2.20 117.51 119.35 2d3u h ILE 432 Ca 0.16 -0.71 0.09 0.00 1.00 0.00 0.00 64.86 65.40 2d3u h ILE 432 Cb 0.03 1.21 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 2d3u h ILE 432 CO -0.09 0.23 0.62 -0.07 0.00 0.00 0.00 178.15 178.83 2d3u h LEU 433 N 0.23 0.94 0.43 1.44 3.38 -0.15 -1.20 115.31 120.38 2d3u h LEU 433 Ca 0.08 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2d3u h LEU 433 Cb 0.29 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2d3u h LEU 433 CO 0.00 0.55 -0.21 -0.07 0.09 0.00 0.00 178.44 178.80 2d3u h LEU 434 N 1.04 -0.49 -1.67 1.67 3.38 -0.77 0.79 115.31 119.25 2d3u h LEU 434 Ca 0.46 -0.05 0.13 0.00 0.09 0.00 0.00 57.88 58.51 2d3u h LEU 434 Cb 0.34 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 2d3u h LEU 434 CO -0.23 -0.25 0.45 0.00 0.09 0.00 0.00 178.44 178.50 2d3u h ALA 435 N -0.21 2.15 -0.05 1.53 0.00 -0.92 0.72 119.26 122.48 2d3u h ALA 435 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2d3u h ALA 435 Cb 0.51 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2d3u h ALA 435 CO 0.10 -0.32 0.00 1.04 0.00 0.00 0.00 179.25 180.07 2d3u n GLN 436 N -4.46 2.19 -3.69 0.00 1.13 -0.50 -4.98 117.38 107.07 2d3u n GLN 436 Ca 0.12 -1.73 -0.32 0.00 -1.94 0.00 0.00 57.00 53.14 2d3u n GLN 436 Cb 0.49 -1.47 0.04 0.00 0.11 0.00 0.00 30.24 29.42 2d3u n GLN 436 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2d3u n GLU 437 N 1.09 -1.18 -1.87 -1.09 1.02 0.24 -4.92 120.64 113.92 2d3u n GLU 437 Ca 0.15 0.45 -0.00 0.00 -0.02 0.00 0.00 57.16 57.75 2d3u n GLU 437 Cb 0.54 -4.08 0.06 0.00 -0.02 0.00 0.00 31.44 27.94 2d3u n GLU 437 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2d3u n GLN 438 N -4.18 1.21 0.13 3.49 6.02 -0.15 -4.83 117.38 119.07 2d3u n GLN 438 Ca -0.09 -2.93 0.01 0.00 -0.01 0.00 0.00 57.00 53.97 2d3u n GLN 438 Cb 0.59 -1.02 0.31 0.00 1.02 0.00 0.00 30.24 31.14 2d3u n GLN 438 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2d3u h LEU 439 N 1.66 0.17 0.00 1.08 4.07 -1.92 -2.96 115.31 117.41 2d3u h LEU 439 Ca -0.10 -0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.81 2d3u h LEU 439 Cb 1.52 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 43.22 2d3u h LEU 439 CO 0.19 0.48 -0.20 -0.62 -1.08 0.00 0.00 178.44 177.21 2d3u n GLU 440 N -4.12 0.03 -2.59 1.13 4.71 -1.26 -3.65 120.64 114.90 2d3u n GLU 440 Ca -0.01 0.02 -0.43 0.00 -0.01 0.00 0.00 57.16 56.73 2d3u n GLU 440 Cb 0.40 -1.53 -0.02 0.00 -1.01 0.00 0.00 31.44 29.28 2d3u n GLU 440 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 2d3u s LYS 441 N -3.01 4.29 0.30 3.49 2.20 -1.12 -4.95 119.74 120.94 2d3u s LYS 441 Ca 0.12 1.47 -0.29 0.00 -0.36 0.00 0.00 55.97 56.92 2d3u s LYS 441 Cb 0.18 -3.65 -0.10 0.00 -1.51 0.00 0.00 37.83 32.75 2d3u s LYS 441 CO 0.60 -0.58 1.15 0.00 -0.36 0.00 0.00 175.35 176.17 2d3u s ALA 442 N 2.98 3.41 0.13 3.13 0.00 -1.26 -4.44 121.76 125.70 2d3u s ALA 442 Ca 0.49 0.99 0.08 0.00 0.00 0.00 0.00 51.96 53.51 2d3u s ALA 442 Cb -0.18 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 2d3u s ALA 442 CO 0.12 -0.30 -0.19 -0.51 0.00 0.00 0.00 175.76 174.88 2d3u s LEU 443 N -1.62 2.36 0.10 0.00 1.43 0.14 -4.83 118.68 116.27 2d3u s LEU 443 Ca 0.46 -0.76 -0.15 0.00 -1.03 0.00 0.00 54.13 52.65 2d3u s LEU 443 Cb -0.34 -0.84 -0.07 0.00 0.03 0.00 0.00 46.19 44.98 2d3u s LEU 443 CO 0.44 0.01 0.53 -1.81 0.23 0.00 0.00 176.35 175.74 2d3u s ASP 444 N -2.22 6.87 0.21 2.29 1.01 -1.26 0.38 116.67 123.95 2d3u s ASP 444 Ca 0.10 1.09 -0.18 0.00 0.71 0.00 0.00 52.55 54.27 2d3u s ASP 444 Cb -0.08 -2.29 0.03 0.00 1.01 0.00 0.00 42.92 41.58 2d3u s ASP 444 CO 0.05 0.18 0.56 0.00 0.21 0.00 0.00 175.17 176.17 2d3u s GLN 446 N -3.87 2.27 -0.17 0.00 -0.21 -1.26 -1.00 119.66 115.42 2d3u s GLN 446 Ca 0.09 -0.84 -0.00 0.00 0.02 0.00 0.00 55.36 54.64 2d3u s GLN 446 Cb -0.02 -2.21 0.04 0.00 1.00 0.00 0.00 33.01 31.82 2d3u s GLN 446 CO -0.02 0.58 -0.08 0.42 -2.12 0.00 0.00 175.29 174.07 2d3u s ILE 447 N -0.72 1.31 -1.54 1.08 1.01 0.37 -4.73 121.20 117.98 2d3u s ILE 447 Ca 0.11 -0.69 -0.12 0.00 0.00 0.00 0.00 60.65 59.95 2d3u s ILE 447 Cb -0.10 -1.40 0.09 0.00 0.01 0.00 0.00 42.46 41.06 2d3u s ILE 447 CO 0.01 0.22 0.86 -1.22 0.00 0.00 0.00 174.94 174.80 2d3u n TYR 448 N 4.82 -2.07 0.00 3.97 4.01 -1.26 -1.62 117.16 125.01 2d3u n TYR 448 Ca -0.13 0.86 0.00 0.00 -0.16 0.00 0.00 57.90 58.47 2d3u n TYR 448 Cb 0.48 -3.74 0.00 0.00 -0.31 0.00 0.00 39.34 35.77 2d3u n TYR 448 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2d3u n GLY 449 N -1.63 2.58 3.79 2.72 0.00 -1.26 -1.00 105.19 110.38 2d3u n GLY 449 Ca -0.01 -0.10 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 2d3u n GLY 449 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d3u s ALA 450 N -1.25 3.12 -0.10 4.61 0.00 -0.64 -4.53 121.76 122.98 2d3u s ALA 450 Ca 0.00 0.57 -0.13 0.00 0.00 0.00 0.00 51.96 52.39 2d3u s ALA 450 Cb 0.00 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 2d3u s ALA 450 CO 0.00 0.01 0.32 0.00 0.00 0.00 0.00 175.76 176.09 2d3u s TYR 452 N -0.22 1.30 -0.27 0.00 1.51 -0.17 0.45 117.35 119.96 2d3u s TYR 452 Ca 0.19 -0.39 -0.11 0.00 -1.01 0.00 0.00 57.07 55.76 2d3u s TYR 452 Cb -0.14 -0.76 -0.05 0.00 -0.11 0.00 0.00 41.96 40.90 2d3u s TYR 452 CO 0.07 0.06 0.17 0.45 -1.11 0.00 0.00 175.55 175.19 2d3u s SER 453 N -1.39 5.95 -0.01 2.29 0.15 -1.18 -1.93 113.70 117.58 2d3u s SER 453 Ca 0.01 -0.01 0.04 0.00 0.70 0.00 0.00 55.95 56.70 2d3u s SER 453 Cb -0.09 -2.10 -0.01 0.00 -1.71 0.00 0.00 66.02 62.12 2d3u s SER 453 CO 0.02 -0.02 -0.14 -0.63 1.20 0.00 0.00 173.24 173.67 2d3u s ILE 454 N 1.60 1.06 -0.28 6.45 1.01 0.16 -2.70 121.20 128.50 2d3u s ILE 454 Ca 0.07 -0.59 -0.16 0.00 0.00 0.00 0.00 60.65 59.98 2d3u s ILE 454 Cb -0.15 -0.89 -0.03 0.00 0.01 0.00 0.00 42.46 41.40 2d3u s ILE 454 CO 0.09 0.29 0.41 -1.61 0.00 0.00 0.00 174.94 174.12 2d3u s GLU 455 N -0.34 3.93 0.50 2.79 2.02 -1.26 0.27 118.70 126.61 2d3u s GLU 455 Ca 0.05 0.01 0.30 0.00 0.02 0.00 0.00 54.97 55.35 2d3u s GLU 455 Cb -0.05 -3.69 1.40 0.00 0.10 0.00 0.00 34.13 31.89 2d3u s GLU 455 CO -0.00 -0.36 1.82 -1.35 0.02 0.00 0.00 175.26 175.39 2d3u h PRO 456 N 8.21 0.12 0.00 0.39 0.11 -1.78 0.25 132.00 139.31 2d3u h PRO 456 Ca -0.31 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2d3u h PRO 456 Cb 1.15 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2d3u h PRO 456 CO 0.67 0.08 0.00 -0.07 -0.21 0.00 0.00 178.00 178.47 2d3u h LEU 457 N 0.12 0.00 -0.79 2.35 3.38 -1.93 -2.12 115.31 116.32 2d3u h LEU 457 Ca 0.53 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.50 2d3u h LEU 457 Cb 1.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.63 2d3u h LEU 457 CO -0.09 0.00 -0.04 0.47 0.09 0.00 0.00 178.44 178.87 2d3u n ASP 458 N -3.03 1.26 -0.21 -0.43 8.00 0.89 -4.49 116.55 118.54 2d3u n ASP 458 Ca -0.00 -1.34 0.02 0.00 0.71 0.00 0.00 54.79 54.17 2d3u n ASP 458 Cb 0.23 0.01 0.12 0.00 -0.02 0.00 0.00 41.12 41.47 2d3u n ASP 458 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2d3u h LEU 459 N 1.93 -0.08 -0.56 0.64 3.38 -1.46 -1.58 115.31 117.58 2d3u h LEU 459 Ca 0.00 0.13 0.07 0.00 0.09 0.00 0.00 57.88 58.17 2d3u h LEU 459 Cb 0.45 0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 2d3u h LEU 459 CO 0.00 -0.04 0.24 -0.65 0.09 0.00 0.00 178.44 178.08 2d3u h PRO 460 N 0.22 0.43 -0.05 1.13 0.11 -1.83 0.24 132.00 132.25 2d3u h PRO 460 Ca 0.34 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.42 2d3u h PRO 460 Cb 0.54 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.55 2d3u h PRO 460 CO -0.46 0.28 0.02 1.96 -0.21 0.00 0.00 178.00 179.59 2d3u h GLN 461 N 0.44 0.07 -0.46 1.05 4.20 -1.76 0.87 115.11 119.52 2d3u h GLN 461 Ca 0.27 -0.01 0.04 0.00 0.06 0.00 0.00 58.65 59.01 2d3u h GLN 461 Cb 0.27 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.00 2d3u h GLN 461 CO -0.24 0.14 0.22 0.82 -0.67 0.00 0.00 178.83 179.10 2d3u h ILE 462 N -0.03 0.95 -0.51 2.54 2.04 -0.82 -0.01 117.51 121.67 2d3u h ILE 462 Ca 0.02 -0.15 -0.11 0.00 1.00 0.00 0.00 64.86 65.61 2d3u h ILE 462 Cb 0.09 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 2d3u h ILE 462 CO -0.00 0.08 -0.11 0.40 0.00 0.00 0.00 178.15 178.51 2d3u h ILE 463 N 0.45 1.27 -0.16 -0.67 2.04 -0.36 -1.03 117.51 119.05 2d3u h ILE 463 Ca 0.20 -1.26 -0.01 0.00 1.00 0.00 0.00 64.86 64.79 2d3u h ILE 463 Cb 0.12 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2d3u h ILE 463 CO -0.15 0.44 0.08 -0.08 0.00 0.00 0.00 178.15 178.44 2d3u h GLU 464 N 0.85 0.23 -0.77 2.37 4.81 -0.44 0.14 114.58 121.77 2d3u h GLU 464 Ca 0.13 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2d3u h GLU 464 Cb 0.68 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.98 2d3u h GLU 464 CO 0.05 0.26 0.51 0.00 -0.73 0.00 0.00 179.01 179.10 2d3u h ARG 465 N 0.14 1.01 0.07 1.92 2.47 -0.86 0.32 114.38 119.45 2d3u h ARG 465 Ca 0.06 -0.06 -0.29 0.00 -1.26 0.00 0.00 59.98 58.42 2d3u h ARG 465 Cb 0.11 -0.23 -0.02 0.00 -1.65 0.00 0.00 29.97 28.18 2d3u h ARG 465 CO -0.01 0.67 -1.53 -0.07 0.56 0.00 0.00 179.97 179.59 2d3u h LEU 466 N 1.04 0.23 0.00 3.04 3.38 -1.11 -3.41 115.31 118.49 2d3u h LEU 466 Ca 0.28 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2d3u h LEU 466 Cb -0.12 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.56 2d3u h LEU 466 CO -0.06 1.30 -1.21 1.41 0.09 0.00 0.00 178.44 179.97 2d3u n HIS 467 N -3.33 0.00 0.00 1.13 8.25 0.48 -4.52 115.22 117.22 2d3u n HIS 467 Ca -0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 2d3u n HIS 467 Cb 1.03 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 32.01 2d3u n HIS 467 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2d3u n GLY 468 N 2.07 -0.27 0.36 -1.41 0.00 0.11 -4.49 105.19 101.57 2d3u n GLY 468 Ca -0.01 -1.68 0.19 0.00 0.00 0.00 0.00 46.02 44.52 2d3u n GLY 468 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2d3u h LEU 469 N 0.00 0.00 -2.51 0.99 3.38 -1.87 -1.82 115.31 113.48 2d3u h LEU 469 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2d3u h LEU 469 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2d3u h LEU 469 CO 0.00 0.00 -0.02 0.77 0.09 0.00 0.00 178.44 179.28 2d3u h SER 470 N 0.00 0.00 -0.20 -0.43 4.64 -1.96 -1.51 113.55 114.08 2d3u h SER 470 Ca 0.13 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.51 2d3u h SER 470 Cb 0.80 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.88 2d3u h SER 470 CO -0.00 0.02 0.18 0.00 -0.87 0.00 0.00 176.83 176.16 2d3u h ALA 471 N 1.98 1.98 -0.15 5.18 0.00 -1.55 -0.57 119.26 126.13 2d3u h ALA 471 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2d3u h ALA 471 Cb 0.08 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2d3u h ALA 471 CO 0.00 -0.28 0.00 1.19 0.00 0.00 0.00 179.25 180.16 2d3u n PHE 472 N -4.10 0.18 -1.68 0.00 3.72 -0.57 -4.34 117.46 110.67 2d3u n PHE 472 Ca 0.02 -0.09 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 2d3u n PHE 472 Cb 0.31 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.85 2d3u n PHE 472 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2d3u n SER 473 N 0.71 0.00 -4.77 4.37 3.41 -0.28 -4.60 113.62 112.45 2d3u n SER 473 Ca 0.17 -1.62 -0.39 0.00 -0.26 0.00 0.00 58.87 56.77 2d3u n SER 473 Cb 0.44 -0.12 -0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2d3u n SER 473 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2d3u s LEU 474 N 0.00 4.15 0.35 1.04 1.43 -0.81 -4.00 118.68 120.84 2d3u s LEU 474 Ca 0.00 2.59 -0.15 0.00 -1.03 0.00 0.00 54.13 55.54 2d3u s LEU 474 Cb 0.00 -3.99 0.04 0.00 0.03 0.00 0.00 46.19 42.27 2d3u s LEU 474 CO 0.00 -0.92 0.73 -1.38 0.23 0.00 0.00 176.35 175.01 2d3u s HIS 475 N -1.31 0.15 -0.96 0.29 -3.43 0.22 -4.93 115.29 105.33 2d3u s HIS 475 Ca 0.59 -0.72 -0.09 0.00 -0.80 0.00 0.00 55.06 54.04 2d3u s HIS 475 Cb -0.36 0.69 -0.02 0.00 -1.43 0.00 0.00 32.58 31.46 2d3u s HIS 475 CO 0.46 -1.43 0.77 0.43 -2.00 0.00 0.00 174.74 172.97 2d3u n SER 476 N -1.15 -6.31 -4.76 7.38 7.64 -1.26 -1.18 113.62 113.98 2d3u n SER 476 Ca -0.06 -0.66 -0.29 0.00 1.01 0.00 0.00 58.87 58.87 2d3u n SER 476 Cb 0.60 -4.14 0.13 0.00 -1.01 0.00 0.00 64.21 59.79 2d3u n SER 476 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2d3u s TYR 477 N -3.24 2.51 0.61 1.43 1.51 -1.26 -4.09 117.35 114.81 2d3u s TYR 477 Ca 0.27 1.02 -0.16 0.00 -1.01 0.00 0.00 57.07 57.19 2d3u s TYR 477 Cb -0.07 -3.25 -0.03 0.00 -0.11 0.00 0.00 41.96 38.50 2d3u s TYR 477 CO 0.81 -2.29 1.09 -1.54 -1.11 0.00 0.00 175.55 172.50 2d3u s SER 478 N -3.80 5.54 0.25 2.29 1.04 -1.20 -4.85 113.70 112.96 2d3u s SER 478 Ca 0.63 1.94 -0.05 0.00 0.48 0.00 0.00 55.95 58.95 2d3u s SER 478 Cb -0.16 -2.55 0.31 0.00 0.10 0.00 0.00 66.02 63.73 2d3u s SER 478 CO 0.55 -1.34 1.90 -0.65 0.98 0.00 0.00 173.24 174.69 2d3u h PRO 479 N 0.43 1.21 -0.45 4.02 0.11 -1.95 0.26 132.00 135.62 2d3u h PRO 479 Ca -0.47 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 65.50 2d3u h PRO 479 Cb 1.24 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 2d3u h PRO 479 CO 0.56 0.80 0.05 0.78 -0.21 0.00 0.00 178.00 179.98 2d3u h GLY 480 N 1.24 0.83 0.82 -0.55 0.00 -1.99 0.52 103.07 103.94 2d3u h GLY 480 Ca 0.39 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 2d3u h GLY 480 CO -0.12 0.53 0.02 -2.09 0.00 0.00 0.00 176.54 174.88 2d3u h GLU 481 N 0.63 0.28 -0.62 4.80 4.57 -1.81 -1.59 114.58 120.85 2d3u h GLU 481 Ca 0.14 -0.08 0.02 0.00 -1.18 0.00 0.00 59.36 58.26 2d3u h GLU 481 Cb 0.42 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.94 2d3u h GLU 481 CO 0.01 0.46 0.39 0.82 -1.18 0.00 0.00 179.01 179.51 2d3u h ILE 482 N 0.07 1.09 -0.79 2.32 2.04 -0.88 -0.73 117.51 120.63 2d3u h ILE 482 Ca 0.05 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 2d3u h ILE 482 Cb 0.31 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 2d3u h ILE 482 CO 0.00 0.14 0.45 0.78 0.00 0.00 0.00 178.15 179.53 2d3u h ASN 483 N 0.77 0.97 -0.32 1.72 2.35 -0.75 -1.02 115.58 119.29 2d3u h ASN 483 Ca 0.24 -0.08 -0.05 0.00 -0.55 0.00 0.00 56.30 55.86 2d3u h ASN 483 Cb -0.01 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 2d3u h ASN 483 CO -0.09 0.77 -0.00 -0.09 -1.65 0.00 0.00 177.43 176.36 2d3u h ARG 484 N 1.09 0.57 -0.09 0.81 2.43 -0.74 -0.20 114.38 118.23 2d3u h ARG 484 Ca 0.28 -0.18 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2d3u h ARG 484 Cb -0.00 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2d3u h ARG 484 CO -0.05 0.70 0.05 0.28 -1.51 0.00 0.00 179.97 179.45 2d3u h VAL 485 N 0.37 1.08 -0.60 0.20 2.07 -0.97 -1.09 116.25 117.31 2d3u h VAL 485 Ca 0.09 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.42 2d3u h VAL 485 Cb 0.45 1.07 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 2d3u h VAL 485 CO 0.02 0.07 0.33 0.00 0.02 0.00 0.00 177.57 178.02 2d3u h ALA 486 N 0.96 0.78 -0.81 1.67 0.00 -1.12 -0.35 119.26 120.40 2d3u h ALA 486 Ca 0.03 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2d3u h ALA 486 Cb 0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2d3u h ALA 486 CO -0.01 0.02 0.43 0.77 0.00 0.00 0.00 179.25 180.46 2d3u h SER 487 N 0.64 1.02 -0.41 0.00 0.02 -0.81 -1.93 113.55 112.08 2d3u h SER 487 Ca 0.26 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 2d3u h SER 487 Cb 0.12 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 2d3u h SER 487 CO -0.15 0.84 0.16 0.00 -1.14 0.00 0.00 176.83 176.54 2d3u h LEU 489 N 0.51 0.68 -0.35 0.00 3.38 -0.80 -1.59 115.31 117.13 2d3u h LEU 489 Ca 0.13 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.83 2d3u h LEU 489 Cb 0.20 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2d3u h LEU 489 CO -0.01 0.67 -0.41 0.03 0.09 0.00 0.00 178.44 178.82 2d3u h ARG 490 N 0.71 0.90 -0.56 1.13 3.08 -1.22 0.86 114.38 119.29 2d3u h ARG 490 Ca 0.16 -0.49 -0.01 0.00 0.07 0.00 0.00 59.98 59.70 2d3u h ARG 490 Cb 0.27 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 2d3u h ARG 490 CO -0.00 1.14 0.31 -0.22 -1.07 0.00 0.00 179.97 180.13 2d3u h LYS 491 N 0.71 0.78 0.00 0.04 3.64 -0.93 -3.04 116.57 117.76 2d3u h LYS 491 Ca 0.05 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2d3u h LYS 491 Cb 1.00 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 2d3u h LYS 491 CO 0.10 0.60 -0.57 -0.07 -2.27 0.00 0.00 179.45 177.23 2d3u h LEU 492 N 0.75 0.00 -1.39 5.20 3.38 -1.31 -3.46 115.31 118.48 2d3u h LEU 492 Ca 0.20 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 2d3u h LEU 492 Cb 0.04 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.81 2d3u h LEU 492 CO -0.03 0.08 -0.10 0.61 0.09 0.00 0.00 178.44 179.10 2d3u n GLY 493 N 1.31 0.58 3.77 0.83 0.00 0.08 -1.87 105.19 109.89 2d3u n GLY 493 Ca 0.03 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.18 2d3u n GLY 493 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d3u s VAL 494 N -3.04 5.08 0.66 1.61 1.01 0.06 -1.05 120.40 124.71 2d3u s VAL 494 Ca 0.05 0.96 -0.17 0.00 0.00 0.00 0.00 61.98 62.81 2d3u s VAL 494 Cb -0.02 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 2d3u s VAL 494 CO 0.10 0.43 0.70 -2.65 0.00 0.00 0.00 175.10 173.68 2d3u n PRO 495 N 2.85 0.52 -1.41 2.72 -0.02 -1.26 -4.77 135.00 133.63 2d3u n PRO 495 Ca -0.10 0.22 -0.29 0.00 -2.02 0.00 0.00 63.50 61.31 2d3u n PRO 495 Cb 0.52 -1.94 0.18 0.00 -0.02 0.00 0.00 33.50 32.24 2d3u n PRO 495 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2d3u s PRO 496 N -2.68 0.27 0.23 0.52 0.04 -1.26 -4.83 135.00 127.28 2d3u s PRO 496 Ca 0.70 0.11 -0.08 0.00 0.04 0.00 0.00 61.00 61.77 2d3u s PRO 496 Cb -0.39 -1.75 0.37 0.00 0.04 0.00 0.00 34.50 32.77 2d3u s PRO 496 CO 0.53 -2.75 1.68 1.25 0.04 0.00 0.00 177.00 177.75 2d3u h LEU 497 N -1.89 -0.10 -1.36 -3.56 5.85 -1.99 -2.18 115.31 110.08 2d3u h LEU 497 Ca -0.49 0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.43 2d3u h LEU 497 Cb 1.31 0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.51 2d3u h LEU 497 CO 0.50 -0.06 0.47 0.08 -0.34 0.00 0.00 178.44 179.09 2d3u h ARG 498 N 0.21 0.78 0.09 1.25 0.11 -1.98 0.44 114.38 115.28 2d3u h ARG 498 Ca 0.36 -0.05 -0.00 0.00 0.10 0.00 0.00 59.98 60.39 2d3u h ARG 498 Cb 0.60 -0.18 0.00 0.00 1.11 0.00 0.00 29.97 31.50 2d3u h ARG 498 CO -0.50 0.51 -0.04 0.28 0.10 0.00 0.00 179.97 180.32 2d3u h VAL 499 N 0.80 1.06 -0.83 0.08 2.07 -1.76 -0.51 116.25 117.17 2d3u h VAL 499 Ca 0.30 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 2d3u h VAL 499 Cb 0.16 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 2d3u h VAL 499 CO -0.09 0.14 0.46 -0.50 0.02 0.00 0.00 177.57 177.59 2d3u h TRP 500 N -0.37 1.12 -0.51 1.57 4.06 -1.08 -1.19 115.95 119.55 2d3u h TRP 500 Ca -0.01 -0.02 -0.05 0.00 2.06 0.00 0.00 58.89 60.86 2d3u h TRP 500 Cb 0.31 -0.36 -0.02 0.00 -1.00 0.00 0.00 29.16 28.09 2d3u h TRP 500 CO 0.01 0.77 0.11 -0.09 -3.56 0.00 0.00 178.44 175.68 2d3u h ARG 501 N 1.15 0.84 0.18 0.49 2.43 -0.07 0.80 114.38 120.20 2d3u h ARG 501 Ca 0.29 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2d3u h ARG 501 Cb 0.02 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 2d3u h ARG 501 CO -0.05 0.81 -0.17 1.25 -1.51 0.00 0.00 179.97 180.30 2d3u h HIS 502 N 0.72 -0.45 -0.40 2.20 2.76 -0.50 -0.79 115.15 118.69 2d3u h HIS 502 Ca 0.16 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.30 2d3u h HIS 502 Cb 0.36 0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.48 2d3u h HIS 502 CO 0.02 -0.26 0.13 0.00 -1.30 0.00 0.00 177.93 176.53 2d3u h ARG 503 N -0.38 0.57 -0.48 5.26 3.08 -1.11 -2.37 114.38 118.95 2d3u h ARG 503 Ca -0.00 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 59.85 2d3u h ARG 503 Cb 0.36 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2d3u h ARG 503 CO -0.04 0.50 -0.18 0.00 -1.07 0.00 0.00 179.97 179.18 2d3u h ALA 504 N 1.58 0.77 -0.59 0.04 0.00 -0.37 0.12 119.26 120.81 2d3u h ALA 504 Ca 0.14 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 2d3u h ALA 504 Cb 0.16 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2d3u h ALA 504 CO -0.01 0.66 0.23 0.00 0.00 0.00 0.00 179.25 180.13 2d3u h ARG 505 N 0.83 0.89 -0.19 0.00 3.08 -0.69 0.37 114.38 118.67 2d3u h ARG 505 Ca 0.12 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 2d3u h ARG 505 Cb 0.73 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 2d3u h ARG 505 CO 0.06 0.77 0.05 1.03 -1.07 0.00 0.00 179.97 180.80 2d3u h SER 506 N 0.82 0.28 -0.57 7.04 0.87 -1.23 -1.10 113.55 119.67 2d3u h SER 506 Ca 0.20 -0.23 0.02 0.00 -1.23 0.00 0.00 61.79 60.54 2d3u h SER 506 Cb 0.22 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 2d3u h SER 506 CO -0.01 0.44 0.36 0.58 -0.53 0.00 0.00 176.83 177.66 2d3u h VAL 507 N 0.12 1.10 0.04 2.23 2.07 -0.51 -1.16 116.25 120.14 2d3u h VAL 507 Ca 0.06 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2d3u h VAL 507 Cb 0.27 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 2d3u h VAL 507 CO 0.00 0.13 -0.05 -0.09 0.02 0.00 0.00 177.57 177.58 2d3u h ARG 508 N 0.72 -0.10 -0.68 1.57 2.43 -0.09 -1.01 114.38 117.22 2d3u h ARG 508 Ca 0.22 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.45 2d3u h ARG 508 Cb -0.02 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.49 2d3u h ARG 508 CO -0.08 -0.07 0.39 0.00 -1.51 0.00 0.00 179.97 178.70 2d3u h ALA 509 N 0.85 0.91 -0.23 2.80 0.00 -0.95 0.01 119.26 122.65 2d3u h ALA 509 Ca 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2d3u h ALA 509 Cb 0.10 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2d3u h ALA 509 CO -0.02 0.08 0.13 0.00 0.00 0.00 0.00 179.25 179.45 2d3u h ARG 510 N 0.72 0.31 -0.79 0.00 -0.00 -1.00 -1.67 114.38 111.95 2d3u h ARG 510 Ca 0.30 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.98 59.73 2d3u h ARG 510 Cb 0.16 -0.06 -0.04 0.00 0.00 0.00 0.00 29.97 30.03 2d3u h ARG 510 CO -0.17 0.25 0.40 -0.07 0.00 0.00 0.00 179.97 180.39 2d3u h LEU 511 N 0.27 1.01 -0.54 3.04 3.38 -0.55 -2.64 115.31 119.28 2d3u h LEU 511 Ca 0.08 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2d3u h LEU 511 Cb 0.03 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 2d3u h LEU 511 CO -0.01 0.84 0.35 -0.07 0.09 0.00 0.00 178.44 179.64 2d3u h LEU 512 N 1.10 0.63 -2.25 1.67 3.38 -0.78 -1.71 115.31 117.35 2d3u h LEU 512 Ca 0.27 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.24 2d3u h LEU 512 Cb 0.08 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2d3u h LEU 512 CO -0.04 0.47 0.06 0.28 0.09 0.00 0.00 178.44 179.30 2d3u h SER 513 N 0.73 0.00 1.34 -0.43 0.02 -0.96 -0.93 113.55 113.33 2d3u h SER 513 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 2d3u h SER 513 Cb -0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.47 2d3u h SER 513 CO -0.04 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.65 2d3u n GLN 514 N -4.09 0.24 0.00 3.45 6.02 -0.66 -5.03 117.38 117.31 2d3u n GLN 514 Ca -0.01 0.23 0.00 0.00 -0.01 0.00 0.00 57.00 57.21 2d3u n GLN 514 Cb 0.16 -1.80 0.00 0.00 1.02 0.00 0.00 30.24 29.62 2d3u n GLN 514 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2d3u n GLY 515 N 1.13 -1.06 7.00 1.08 0.00 -0.35 -4.81 105.19 108.18 2d3u n GLY 515 Ca 0.05 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2d3u n GLY 515 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d3u n GLY 516 N 0.00 1.83 0.35 -0.02 0.00 -1.26 -1.74 105.19 104.35 2d3u n GLY 516 Ca 0.00 -0.42 0.01 0.00 0.00 0.00 0.00 46.02 45.61 2d3u n GLY 516 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2d3u h ARG 517 N 0.00 0.96 -0.62 1.61 -0.00 -1.91 -1.64 114.38 112.78 2d3u h ARG 517 Ca 0.00 -0.06 0.01 0.00 -0.50 0.00 0.00 59.98 59.43 2d3u h ARG 517 Cb 0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 29.97 29.72 2d3u h ARG 517 CO 0.00 0.64 0.41 0.00 0.00 0.00 0.00 179.97 181.02 2d3u h ALA 518 N 1.54 1.57 -0.54 0.04 0.00 -1.76 0.13 119.26 120.25 2d3u h ALA 518 Ca 0.27 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 2d3u h ALA 518 Cb -0.10 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2d3u h ALA 518 CO -0.06 0.39 -0.02 0.00 0.00 0.00 0.00 179.25 179.56 2d3u h ALA 519 N 1.62 0.73 -0.32 0.00 0.00 -0.45 -1.04 119.26 119.80 2d3u h ALA 519 Ca 0.23 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2d3u h ALA 519 Cb -0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2d3u h ALA 519 CO -0.05 0.57 0.20 1.15 0.00 0.00 0.00 179.25 181.11 2d3u h THR 520 N 0.84 1.11 -0.54 0.00 2.02 -0.71 -0.39 112.91 115.23 2d3u h THR 520 Ca 0.15 -0.25 0.08 0.00 0.77 0.00 0.00 66.41 67.16 2d3u h THR 520 Cb 0.56 0.69 -0.06 0.00 -1.74 0.00 0.00 68.15 67.60 2d3u h THR 520 CO 0.03 0.11 0.19 0.00 0.37 0.00 0.00 175.52 176.22 2d3u h GLY 522 N 0.36 0.56 0.99 0.00 0.00 -0.73 -1.20 103.07 103.06 2d3u h GLY 522 Ca 0.27 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2d3u h GLY 522 CO -0.28 0.31 0.03 1.70 0.00 0.00 0.00 176.54 178.30 2d3u h LYS 523 N 0.38 0.05 0.00 4.80 3.64 -0.52 -3.06 116.57 121.87 2d3u h LYS 523 Ca 0.11 -0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.35 2d3u h LYS 523 Cb 0.25 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 2d3u h LYS 523 CO -0.00 0.04 -0.77 1.88 -2.27 0.00 0.00 179.45 178.33 2d3u h TYR 524 N 0.05 0.00 -0.18 1.91 -1.99 -1.11 -3.25 116.97 112.40 2d3u h TYR 524 Ca 0.01 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.74 2d3u h TYR 524 Cb 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 2d3u h TYR 524 CO -0.07 1.22 0.07 -0.07 -0.00 0.00 0.00 178.16 179.32 2d3u h LEU 525 N -1.00 0.22 -3.05 3.88 3.38 -1.38 -3.20 115.31 114.17 2d3u h LEU 525 Ca -0.21 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 2d3u h LEU 525 Cb 1.14 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 2d3u h LEU 525 CO -0.13 0.20 -0.02 0.49 0.09 0.00 0.00 178.44 179.07 2d3u n PHE 526 N -4.46 0.17 0.28 1.13 3.72 -1.16 -4.66 117.46 112.49 2d3u n PHE 526 Ca -0.00 -1.01 0.13 0.00 -0.05 0.00 0.00 57.45 56.52 2d3u n PHE 526 Cb 0.11 -0.19 0.83 0.00 -0.94 0.00 0.00 39.48 39.29 2d3u n PHE 526 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 2d3u h ASN 527 N 0.36 0.00 0.54 4.37 -0.00 -1.58 -0.87 115.58 118.41 2d3u h ASN 527 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.30 2d3u h ASN 527 Cb 1.08 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.40 2d3u h ASN 527 CO 0.04 0.04 -0.01 4.11 -0.00 0.00 0.00 177.43 181.61 2d3u h TRP 528 N 0.00 0.00 0.00 0.67 5.08 -1.83 -3.05 115.95 116.82 2d3u h TRP 528 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2d3u h TRP 528 Cb 0.10 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.26 2d3u h TRP 528 CO 0.00 0.01 -0.57 0.00 -1.28 0.00 0.00 178.44 176.60 2d3u h ALA 529 N 1.99 0.71 -2.27 0.11 0.00 -1.52 -3.47 119.26 114.81 2d3u h ALA 529 Ca -0.00 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 2d3u h ALA 529 Cb 0.28 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.09 2d3u h ALA 529 CO 0.00 0.00 -0.07 0.14 0.00 0.00 0.00 179.25 179.32 2d3u s VAL 530 N -3.29 5.02 -0.10 0.00 -7.23 -1.15 -4.86 120.40 108.79 2d3u s VAL 530 Ca 0.03 -0.17 -0.25 0.00 -1.81 0.00 0.00 61.98 59.78 2d3u s VAL 530 Cb 0.08 -3.86 -0.21 0.00 0.56 0.00 0.00 36.38 32.95 2d3u s VAL 530 CO 0.74 -0.66 0.82 0.11 -0.31 0.00 0.00 175.10 175.80 2d3u h LYS 531 N 0.61 -0.03 -4.53 4.82 1.57 -1.92 -3.40 116.57 113.70 2d3u h LYS 531 Ca -0.49 0.00 -0.73 0.00 -1.87 0.00 0.00 60.65 57.57 2d3u h LYS 531 Cb 1.21 0.01 -0.21 0.00 0.08 0.00 0.00 32.23 33.32 2d3u h LYS 531 CO 0.62 0.70 0.41 0.99 -0.57 0.00 0.00 179.45 181.60 2d3u s THR 532 N -2.74 5.06 0.57 -0.16 2.01 -1.26 -5.03 115.64 114.10 2d3u s THR 532 Ca -0.16 -1.76 -0.20 0.00 0.31 0.00 0.00 61.69 59.88 2d3u s THR 532 Cb -0.01 -4.60 -0.05 0.00 0.01 0.00 0.00 72.50 67.85 2d3u s THR 532 CO 0.60 -1.25 1.20 0.29 -0.69 0.00 0.00 174.62 174.76 2d3u n LYS 533 N 5.59 1.30 -2.29 4.92 4.76 -1.26 -5.02 118.16 126.17 2d3u n LYS 533 Ca 0.13 0.49 -0.26 0.00 -2.87 0.00 0.00 58.31 55.80 2d3u n LYS 533 Cb 0.47 -2.40 0.11 0.00 -1.84 0.00 0.00 35.03 31.38 2d3u n LYS 533 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2d3u s LEU 534 N -2.94 2.87 0.14 -0.35 1.02 -1.26 -5.01 118.68 113.15 2d3u s LEU 534 Ca 0.74 0.09 -0.26 0.00 0.02 0.00 0.00 54.13 54.72 2d3u s LEU 534 Cb -0.42 -2.47 -0.01 0.00 0.02 0.00 0.00 46.19 43.31 2d3u s LEU 534 CO 0.47 -1.99 1.60 0.07 0.02 0.00 0.00 176.35 176.53 2d3u h LYS 535 N -0.83 -0.37 -5.67 1.70 2.10 -1.97 -3.47 116.57 108.05 2d3u h LYS 535 Ca -0.41 0.03 -0.17 0.00 -2.00 0.00 0.00 60.65 58.09 2d3u h LYS 535 Cb 1.27 0.08 0.06 0.00 -0.90 0.00 0.00 32.23 32.75 2d3u h LYS 535 CO 0.47 -0.25 -0.45 1.28 -2.00 0.00 0.00 179.45 178.50 2d3u n LEU 536 N -5.41 -5.42 -4.98 7.07 4.32 -1.26 -5.04 117.00 106.28 2d3u n LEU 536 Ca -0.03 -0.45 -0.19 0.00 -0.02 0.00 0.00 56.01 55.33 2d3u n LEU 536 Cb 0.33 -2.96 0.01 0.00 -1.62 0.00 0.00 43.42 39.18 2d3u n LEU 536 CO 0.13 -0.46 0.15 0.42 -1.22 0.00 0.00 177.39 176.41 2d3u s THR 537 N -3.15 2.68 1.08 -5.08 -4.23 -1.26 -5.08 115.64 100.60 2d3u s THR 537 Ca 0.16 -1.11 -0.15 0.00 -1.18 0.00 0.00 61.69 59.42 2d3u s THR 537 Cb -0.04 -2.78 0.21 0.00 1.34 0.00 0.00 72.50 71.23 2d3u s THR 537 CO 0.78 0.00 0.44 -2.65 -0.54 0.00 0.00 174.62 172.65 2d3u n PRO 538 N -1.85 -2.71 -4.01 3.99 -0.02 -1.26 -5.04 135.00 124.10 2d3u n PRO 538 Ca 0.08 -0.80 -0.17 0.00 -2.02 0.00 0.00 63.50 60.59 2d3u n PRO 538 Cb 0.60 -1.54 -0.16 0.00 -0.02 0.00 0.00 33.50 32.39 2d3u n PRO 538 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2d3u s ILE 539 N -2.08 0.26 0.00 4.25 1.01 -1.26 -5.13 121.20 118.26 2d3u s ILE 539 Ca 0.40 -0.02 0.00 0.00 0.00 0.00 0.00 60.65 61.04 2d3u s ILE 539 Cb -0.07 -0.30 0.00 0.00 0.01 0.00 0.00 42.46 42.10 2d3u s ILE 539 CO 0.36 0.13 0.00 -2.65 0.00 0.00 0.00 174.94 172.78 2d3u n PRO 540 N 3.76 0.00 0.22 2.79 -0.02 -1.26 -3.65 135.00 136.84 2d3u n PRO 540 Ca -0.22 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.27 2d3u n PRO 540 Cb 0.53 -0.27 0.02 0.00 -0.02 0.00 0.00 33.50 33.76 2d3u n PRO 540 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2d3u n ALA 541 N -3.00 0.04 -0.29 3.55 0.00 -1.26 -2.00 120.51 117.55 2d3u n ALA 541 Ca 0.00 0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.54 2d3u n ALA 541 Cb 0.00 -0.02 0.24 0.00 0.00 0.00 0.00 19.45 19.67 2d3u n ALA 541 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d3u h ALA 542 N 0.02 1.28 0.00 0.00 0.00 -1.92 -1.12 119.26 117.53 2d3u h ALA 542 Ca 0.02 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2d3u h ALA 542 Cb 1.48 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.33 2d3u h ALA 542 CO -0.00 -0.19 0.00 -1.13 0.00 0.00 0.00 179.25 177.93 2d3u n SER 543 N -4.95 0.00 -0.33 0.00 3.41 -0.85 -2.79 113.62 108.12 2d3u n SER 543 Ca 0.18 0.19 0.12 0.00 -0.26 0.00 0.00 58.87 59.10 2d3u n SER 543 Cb 0.49 -0.34 0.23 0.00 -0.26 0.00 0.00 64.21 64.33 2d3u n SER 543 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2d3u n GLN 544 N -1.34 0.95 -2.39 4.33 10.64 -0.42 -4.91 117.38 124.23 2d3u n GLN 544 Ca 0.06 -0.67 -0.41 0.00 -1.83 0.00 0.00 57.00 54.15 2d3u n GLN 544 Cb 0.13 -1.49 -0.03 0.00 -0.86 0.00 0.00 30.24 27.99 2d3u n GLN 544 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2d3u s LEU 545 N -2.51 4.46 -1.02 2.61 1.43 -1.12 -4.96 118.68 117.57 2d3u s LEU 545 Ca 0.22 2.23 -0.15 0.00 -1.03 0.00 0.00 54.13 55.39 2d3u s LEU 545 Cb 0.19 -3.61 0.17 0.00 0.03 0.00 0.00 46.19 42.97 2d3u s LEU 545 CO 0.55 -0.35 1.16 -0.62 0.23 0.00 0.00 176.35 177.32 2d3u s ASP 546 N 0.05 6.87 -0.07 2.29 -1.08 -1.26 -4.82 116.67 118.65 2d3u s ASP 546 Ca 0.52 -2.62 0.09 0.00 -0.52 0.00 0.00 52.55 50.02 2d3u s ASP 546 Cb -0.32 -2.35 0.40 0.00 -1.46 0.00 0.00 42.92 39.19 2d3u s ASP 546 CO 0.37 -0.80 1.21 0.18 0.52 0.00 0.00 175.17 176.65 2d3u n LEU 547 N 5.42 2.92 -4.62 -1.34 4.32 -1.26 -4.89 117.00 117.55 2d3u n LEU 547 Ca 0.26 -1.48 -0.43 0.00 -0.02 0.00 0.00 56.01 54.35 2d3u n LEU 547 Cb 0.46 -0.46 -0.02 0.00 -1.62 0.00 0.00 43.42 41.77 2d3u n LEU 547 CO 0.51 0.48 1.14 -0.94 -1.22 0.00 0.00 177.39 177.36 2d3u s SER 548 N -0.64 6.62 0.00 -1.43 1.04 -1.26 -2.64 113.70 115.38 2d3u s SER 548 Ca 0.28 1.11 0.00 0.00 0.48 0.00 0.00 55.95 57.82 2d3u s SER 548 Cb 0.18 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.76 2d3u s SER 548 CO 0.12 -1.14 0.00 0.61 0.98 0.00 0.00 173.24 173.81 2d3u n GLY 549 N 4.45 0.92 0.12 7.32 0.00 -1.26 -5.00 105.19 111.74 2d3u n GLY 549 Ca 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.02 2d3u n GLY 549 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2d3u h TRP 550 N 0.00 0.37 -2.26 1.61 4.06 -1.87 -3.38 115.95 114.49 2d3u h TRP 550 Ca 0.00 -0.17 -0.60 0.00 2.06 0.00 0.00 58.89 60.19 2d3u h TRP 550 Cb 0.00 -0.06 -0.42 0.00 -1.00 0.00 0.00 29.16 27.69 2d3u h TRP 550 CO 0.00 0.90 -0.65 1.19 -3.56 0.00 0.00 178.44 176.31 2d3u n PHE 551 N -4.48 3.11 -0.01 0.49 3.72 -1.26 -4.78 117.46 114.25 2d3u n PHE 551 Ca -0.09 -4.10 -0.01 0.00 -0.05 0.00 0.00 57.45 53.21 2d3u n PHE 551 Cb 0.48 -0.53 -0.01 0.00 -0.94 0.00 0.00 39.48 38.48 2d3u n PHE 551 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2d3u n VAL 552 N 1.04 0.08 -3.86 -4.37 0.31 -1.11 -4.23 118.33 106.19 2d3u n VAL 552 Ca 0.28 -0.03 -0.09 0.00 -0.01 0.00 0.00 64.34 64.49 2d3u n VAL 552 Cb 0.42 -0.98 -0.05 0.00 -0.91 0.00 0.00 33.84 32.31 2d3u n VAL 552 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2d3u s ALA 553 N -2.03 -0.52 0.12 3.52 0.00 -1.22 -4.10 121.76 117.53 2d3u s ALA 553 Ca -0.02 -0.55 -0.07 0.00 0.00 0.00 0.00 51.96 51.32 2d3u s ALA 553 Cb 0.01 0.89 -0.06 0.00 0.00 0.00 0.00 23.12 23.96 2d3u s ALA 553 CO 0.03 -0.77 0.39 0.20 0.00 0.00 0.00 175.76 175.62 2d3u s GLY 554 N -2.93 2.28 0.00 0.00 0.00 -1.26 -4.92 107.32 100.48 2d3u s GLY 554 Ca 0.14 -0.47 0.00 0.00 0.00 0.00 0.00 44.72 44.39 2d3u s GLY 554 CO 0.00 -0.33 0.92 -1.72 0.00 0.00 0.00 173.10 171.97 2d3u n TYR 555 N 0.41 0.00 -1.58 1.90 4.01 -0.17 -4.61 117.16 117.12 2d3u n TYR 555 Ca -0.05 0.00 -0.52 0.00 -0.16 0.00 0.00 57.90 57.17 2d3u n TYR 555 Cb 0.52 -0.02 -0.06 0.00 -0.31 0.00 0.00 39.34 39.47 2d3u n TYR 555 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2d3u n SER 556 N 0.00 1.53 0.00 7.72 2.88 -1.24 0.20 113.62 124.71 2d3u n SER 556 Ca 0.00 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.66 2d3u n SER 556 Cb 0.67 -1.18 0.00 0.00 -0.75 0.00 0.00 64.21 62.95 2d3u n SER 556 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d3u n GLY 557 N 2.43 0.53 0.00 0.46 0.00 -1.26 -4.25 105.19 103.09 2d3u n GLY 557 Ca 0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.35 2d3u n GLY 557 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d3u n GLY 558 N -2.00 -1.15 3.55 -0.02 0.00 0.53 -3.38 105.19 102.71 2d3u n GLY 558 Ca 0.00 -0.16 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 2d3u n GLY 558 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2d3u n ASP 559 N -1.18 -2.21 -4.47 1.61 2.03 -1.26 -4.54 116.55 106.53 2d3u n ASP 559 Ca 0.17 -0.68 -0.33 0.00 0.52 0.00 0.00 54.79 54.47 2d3u n ASP 559 Cb 0.19 -4.73 -0.13 0.00 -0.72 0.00 0.00 41.12 35.73 2d3u n ASP 559 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2d3u s ILE 560 N -3.45 3.30 0.03 5.18 -1.09 -1.26 -4.33 121.20 119.57 2d3u s ILE 560 Ca 0.07 -0.61 0.04 0.00 -2.23 0.00 0.00 60.65 57.92 2d3u s ILE 560 Cb -0.03 -2.35 -0.02 0.00 -1.58 0.00 0.00 42.46 38.48 2d3u s ILE 560 CO 0.76 0.56 -0.11 -0.47 -1.23 0.00 0.00 174.94 174.45 2d3u s TYR 561 N -0.28 0.96 -0.13 3.97 5.04 -0.30 -0.97 117.35 125.64 2d3u s TYR 561 Ca 0.03 -0.33 -0.06 0.00 -2.44 0.00 0.00 57.07 54.27 2d3u s TYR 561 Cb -0.13 -0.58 0.06 0.00 0.35 0.00 0.00 41.96 41.66 2d3u s TYR 561 CO 0.03 -0.00 0.28 -1.01 -1.34 0.00 0.00 175.55 173.51 2d3u s HIS 562 N -0.80 -0.42 -0.25 4.97 3.76 0.17 -4.62 115.29 118.11 2d3u s HIS 562 Ca -0.01 0.95 -0.18 0.00 -0.15 0.00 0.00 55.06 55.67 2d3u s HIS 562 Cb -0.07 0.07 -0.03 0.00 1.11 0.00 0.00 32.58 33.66 2d3u s HIS 562 CO 0.01 -0.30 0.54 -1.12 -0.85 0.00 0.00 174.74 173.02 2d3u s SER 563 N 1.69 6.48 0.00 1.40 0.01 -1.26 -3.11 113.70 118.90 2d3u s SER 563 Ca -0.06 0.58 0.00 0.00 1.31 0.00 0.00 55.95 57.78 2d3u s SER 563 Cb -0.11 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.83 2d3u s SER 563 CO -0.09 -0.28 0.36 -0.11 0.41 0.00 0.00 173.24 173.52