#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j03 s HIS 3 N 0.00 1.61 0.00 2.89 3.76 -1.26 -4.88 115.29 117.41 2j03 s HIS 3 Ca 0.00 -0.93 0.00 0.00 -0.15 0.00 0.00 55.06 53.98 2j03 s HIS 3 Cb 0.00 -0.94 0.00 0.00 1.11 0.00 0.00 32.58 32.75 2j03 s HIS 3 CO 0.00 -0.03 0.00 -0.11 -0.85 0.00 0.00 174.74 173.75 2j03 n LEU 4 N -0.45 0.00 -0.65 0.89 -0.00 -1.26 -4.97 117.00 110.56 2j03 n LEU 4 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.96 2j03 n LEU 4 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.06 2j03 n LEU 4 CO 0.37 0.00 0.00 0.29 -0.00 0.00 0.00 177.39 178.05 2j03 n LYS 5 N -0.70 0.00 -4.49 1.96 4.01 -1.26 -4.68 118.16 112.99 2j03 n LYS 5 Ca 0.00 0.00 -0.23 0.00 -0.51 0.00 0.00 58.31 57.57 2j03 n LYS 5 Cb 0.00 -0.96 -0.10 0.00 -0.51 0.00 0.00 35.03 33.45 2j03 n LYS 5 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 2j03 s SER 6 N -0.40 2.70 -0.88 4.39 1.04 -1.26 -5.09 113.70 114.21 2j03 s SER 6 Ca 0.00 -1.42 -0.22 0.00 0.48 0.00 0.00 55.95 54.79 2j03 s SER 6 Cb 0.00 -0.03 -0.22 0.00 0.10 0.00 0.00 66.02 65.87 2j03 s SER 6 CO 0.00 -0.64 2.42 0.61 0.98 0.00 0.00 173.24 176.62 2j03 n GLY 7 N -0.78 -0.32 0.17 7.32 0.00 -1.26 -4.79 105.19 105.53 2j03 n GLY 7 Ca -0.04 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.52 2j03 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j03 n ARG 8 N 7.65 0.00 -0.72 1.61 5.12 -1.26 -4.96 116.66 124.10 2j03 n ARG 8 Ca 0.58 0.00 -0.27 0.00 -1.93 0.00 0.00 57.85 56.23 2j03 n ARG 8 Cb 0.22 -0.09 0.02 0.00 -1.16 0.00 0.00 32.46 31.46 2j03 n ARG 8 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 2j03 n LYS 9 N -0.21 0.00 0.00 5.56 2.85 -1.26 -5.08 118.16 120.02 2j03 n LYS 9 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2j03 n LYS 9 Cb 0.00 -0.72 0.00 0.00 -0.65 0.00 0.00 35.03 33.66 2j03 n LYS 9 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2j03 n LEU 10 N 2.50 0.00 -4.85 -5.58 4.77 -1.26 -5.15 117.00 107.44 2j03 n LEU 10 Ca -0.01 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.73 2j03 n LEU 10 Cb 0.51 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 2j03 n LEU 10 CO 0.32 0.00 -0.02 0.21 -1.33 0.00 0.00 177.39 176.57 2j03 s ASN 11 N 0.00 4.75 0.79 -1.43 3.84 -1.26 -4.98 114.94 116.65 2j03 s ASN 11 Ca 0.00 -0.99 0.00 0.00 0.21 0.00 0.00 52.86 52.08 2j03 s ASN 11 Cb 0.00 -0.22 0.00 0.00 -0.55 0.00 0.00 41.25 40.48 2j03 s ASN 11 CO 0.00 -0.77 0.00 0.54 -2.79 0.00 0.00 177.10 174.08 2j03 n ARG 12 N -1.54 0.00 -3.54 0.43 1.74 -1.26 -4.58 116.66 107.91 2j03 n ARG 12 Ca 0.01 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.97 2j03 n ARG 12 Cb 0.63 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 32.03 2j03 n ARG 12 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 2j03 s HIS 13 N 0.00 -0.44 0.00 -1.55 -3.43 -1.26 -4.94 115.29 103.66 2j03 s HIS 13 Ca 0.00 0.67 0.00 0.00 -0.80 0.00 0.00 55.06 54.93 2j03 s HIS 13 Cb 0.00 0.46 0.00 0.00 -1.43 0.00 0.00 32.58 31.61 2j03 s HIS 13 CO 0.00 -0.46 0.00 -1.13 -2.00 0.00 0.00 174.74 171.15 2j03 n SER 14 N 0.56 0.00 -0.17 7.38 3.41 -1.26 -0.30 113.62 123.24 2j03 n SER 14 Ca -0.12 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.44 2j03 n SER 14 Cb 0.59 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.50 2j03 n SER 14 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2j03 n SER 15 N 0.00 -0.42 -0.01 4.04 3.41 -1.26 -0.78 113.62 118.60 2j03 n SER 15 Ca 0.00 0.86 -0.03 0.00 -0.26 0.00 0.00 58.87 59.44 2j03 n SER 15 Cb 0.00 -0.17 -0.02 0.00 -0.26 0.00 0.00 64.21 63.76 2j03 n SER 15 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 2j03 h HIS 16 N 0.00 -0.34 0.00 7.33 -0.00 -1.30 0.93 115.15 121.78 2j03 h HIS 16 Ca 0.06 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.45 2j03 h HIS 16 Cb 0.16 0.15 0.00 0.00 -0.00 0.00 0.00 27.41 27.73 2j03 h HIS 16 CO -0.55 -0.11 0.00 -2.13 -0.00 0.00 0.00 177.93 175.14 2j03 n ARG 17 N -3.17 0.00 -0.29 5.26 3.00 0.58 0.67 116.66 122.71 2j03 n ARG 17 Ca -0.01 0.63 0.10 0.00 -0.00 0.00 0.00 57.85 58.57 2j03 n ARG 17 Cb 0.08 -1.01 0.24 0.00 0.00 0.00 0.00 32.46 31.76 2j03 n ARG 17 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2j03 h LEU 18 N 0.00 -0.17 -1.92 6.15 7.12 -0.80 0.97 115.31 126.66 2j03 h LEU 18 Ca 0.00 0.20 -0.02 0.00 0.13 0.00 0.00 57.88 58.19 2j03 h LEU 18 Cb 0.00 0.32 -0.00 0.00 -0.53 0.00 0.00 40.66 40.44 2j03 h LEU 18 CO 0.00 -0.18 -0.11 0.00 -0.13 0.00 0.00 178.44 178.02 2j03 h ALA 19 N 1.77 1.57 0.75 1.25 0.00 0.49 -2.44 119.26 122.66 2j03 h ALA 19 Ca 0.51 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.28 2j03 h ALA 19 Cb 0.98 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.76 2j03 h ALA 19 CO -0.68 0.14 -0.36 1.25 0.00 0.00 0.00 179.25 179.59 2j03 h LEU 20 N 0.00 -0.86 -0.04 0.00 5.85 0.68 -2.01 115.31 118.93 2j03 h LEU 20 Ca -0.00 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.77 2j03 h LEU 20 Cb 0.23 0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 2j03 h LEU 20 CO 0.01 -0.49 -0.48 1.88 -0.34 0.00 0.00 178.44 179.02 2j03 h TYR 21 N -1.26 -1.43 -0.98 1.25 0.99 -1.29 0.11 116.97 114.37 2j03 h TYR 21 Ca -0.10 0.05 0.14 0.00 2.00 0.00 0.00 58.73 60.82 2j03 h TYR 21 Cb 0.77 0.63 -0.15 0.00 1.00 0.00 0.00 36.73 38.98 2j03 h TYR 21 CO 0.00 -0.51 -0.42 0.00 -0.00 0.00 0.00 178.16 177.24 2j03 h ARG 22 N -0.57 -0.01 -0.80 4.88 3.08 -1.49 0.56 114.38 120.03 2j03 h ARG 22 Ca 0.02 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.14 2j03 h ARG 22 Cb 0.63 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.62 2j03 h ARG 22 CO -0.35 -0.01 0.47 -0.91 -1.07 0.00 0.00 179.97 178.11 2j03 h ASN 23 N -0.01 0.71 -0.03 7.04 -0.26 -0.35 -0.28 115.58 122.41 2j03 h ASN 23 Ca 0.31 0.03 -0.00 0.00 -0.56 0.00 0.00 56.30 56.08 2j03 h ASN 23 Cb 0.57 -0.11 -0.00 0.00 -1.06 0.00 0.00 38.32 37.71 2j03 h ASN 23 CO -0.97 0.44 0.01 1.56 -1.06 0.00 0.00 177.43 177.41 2j03 h GLN 24 N 0.84 0.04 -0.42 0.81 4.20 0.25 -2.79 115.11 118.04 2j03 h GLN 24 Ca 0.36 -0.01 0.08 0.00 0.06 0.00 0.00 58.65 59.14 2j03 h GLN 24 Cb 0.23 -0.01 -0.09 0.00 0.30 0.00 0.00 27.48 27.91 2j03 h GLN 24 CO -0.20 0.24 -0.31 0.00 -0.67 0.00 0.00 178.83 177.89 2j03 h ALA 25 N 0.80 -0.13 -0.90 3.87 0.00 0.04 0.31 119.26 123.24 2j03 h ALA 25 Ca 0.01 0.11 0.25 0.00 0.00 0.00 0.00 54.91 55.28 2j03 h ALA 25 Cb 0.22 0.68 -0.14 0.00 0.00 0.00 0.00 17.79 18.55 2j03 h ALA 25 CO -0.00 -0.70 0.34 0.87 0.00 0.00 0.00 179.25 179.76 2j03 h LYS 26 N -0.23 0.27 0.26 0.00 1.57 -0.91 -1.77 116.57 115.77 2j03 h LYS 26 Ca 0.18 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2j03 h LYS 26 Cb 0.53 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2j03 h LYS 26 CO -0.54 0.18 -0.13 0.77 -0.57 0.00 0.00 179.45 179.16 2j03 h SER 27 N 0.28 -0.30 0.00 0.86 0.02 -0.36 -2.04 113.55 112.01 2j03 h SER 27 Ca 0.58 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 2j03 h SER 27 Cb 1.19 0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2j03 h SER 27 CO -0.61 0.20 0.23 -0.11 -1.14 0.00 0.00 176.83 175.40 2j03 n LEU 28 N -5.02 0.00 -0.06 5.07 -0.00 0.76 0.12 117.00 117.88 2j03 n LEU 28 Ca -0.07 0.26 -0.06 0.00 -0.00 0.00 0.00 56.01 56.14 2j03 n LEU 28 Cb 0.24 -0.26 -0.09 0.00 -0.00 0.00 0.00 43.42 43.31 2j03 n LEU 28 CO 0.21 -0.26 -0.87 0.18 -0.00 0.00 0.00 177.39 176.65 2j03 n LEU 29 N -1.26 0.07 -0.07 -1.96 4.32 -0.75 -2.72 117.00 114.63 2j03 n LEU 29 Ca 0.00 -0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.90 2j03 n LEU 29 Cb 0.23 0.26 0.07 0.00 -1.62 0.00 0.00 43.42 42.37 2j03 n LEU 29 CO 0.00 0.29 0.64 0.74 -1.22 0.00 0.00 177.39 177.84 2j03 h THR 30 N 0.00 1.28 0.00 -5.08 2.02 0.17 -3.34 112.91 107.96 2j03 h THR 30 Ca -0.30 -1.44 0.00 0.00 0.77 0.00 0.00 66.41 65.43 2j03 h THR 30 Cb 1.69 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 69.44 2j03 h THR 30 CO 0.02 0.47 -0.66 1.41 0.37 0.00 0.00 175.52 177.13 2j03 n HIS 31 N -4.08 0.00 0.00 3.16 8.25 0.61 -5.02 115.22 118.15 2j03 n HIS 31 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2j03 n HIS 31 Cb 0.48 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.54 2j03 n HIS 31 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2j03 n GLY 32 N 1.55 1.27 3.58 -1.41 0.00 -1.10 -4.85 105.19 104.23 2j03 n GLY 32 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 2j03 n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j03 s ARG 33 N 0.00 2.59 -0.18 1.61 0.52 -1.25 -1.00 118.95 121.24 2j03 s ARG 33 Ca 0.00 -0.67 -0.18 0.00 -0.52 0.00 0.00 55.73 54.36 2j03 s ARG 33 Cb 0.00 -2.51 0.05 0.00 0.52 0.00 0.00 34.95 33.01 2j03 s ARG 33 CO 0.00 0.62 0.50 0.42 0.02 0.00 0.00 175.30 176.86 2j03 s ILE 34 N -0.92 0.00 -0.21 1.52 -1.09 0.30 -4.86 121.20 115.95 2j03 s ILE 34 Ca 0.15 -0.02 0.01 0.00 -2.23 0.00 0.00 60.65 58.56 2j03 s ILE 34 Cb -0.11 -0.71 0.03 0.00 -1.58 0.00 0.00 42.46 40.09 2j03 s ILE 34 CO 0.05 -0.01 -0.16 -0.89 -1.23 0.00 0.00 174.94 172.69 2j03 s THR 35 N 0.14 2.16 0.00 2.92 2.01 -1.26 0.07 115.64 121.68 2j03 s THR 35 Ca -0.01 -1.14 0.00 0.00 0.31 0.00 0.00 61.69 60.85 2j03 s THR 35 Cb -0.03 -2.03 0.00 0.00 0.01 0.00 0.00 72.50 70.45 2j03 s THR 35 CO 0.01 0.35 0.00 0.35 -0.69 0.00 0.00 174.62 174.64 2j03 n THR 36 N 4.57 0.00 -2.20 -0.82 -2.24 -0.71 -4.96 114.28 107.93 2j03 n THR 36 Ca -0.19 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.28 2j03 n THR 36 Cb 0.48 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.69 2j03 n THR 36 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2j03 s THR 37 N -0.92 4.60 0.00 4.28 -4.23 -1.26 0.26 115.64 118.37 2j03 s THR 37 Ca 0.00 1.09 0.00 0.00 -1.18 0.00 0.00 61.69 61.60 2j03 s THR 37 Cb 0.00 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 70.06 2j03 s THR 37 CO 0.00 -0.86 0.78 0.52 -0.54 0.00 0.00 174.62 174.51 2j03 n VAL 38 N -2.02 0.00 -0.27 2.29 0.31 -1.08 -0.64 118.33 116.92 2j03 n VAL 38 Ca 0.06 1.28 -0.07 0.00 -0.01 0.00 0.00 64.34 65.60 2j03 n VAL 38 Cb 0.54 -1.90 -0.06 0.00 -0.91 0.00 0.00 33.84 31.51 2j03 n VAL 38 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2j03 n PRO 39 N -1.92 -0.28 -0.37 5.55 -0.02 -1.26 0.24 135.00 136.94 2j03 n PRO 39 Ca 0.00 1.27 0.30 0.00 -2.02 0.00 0.00 63.50 63.05 2j03 n PRO 39 Cb 0.00 -1.87 0.60 0.00 -0.02 0.00 0.00 33.50 32.21 2j03 n PRO 39 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2j03 h LYS 40 N 0.00 0.22 0.03 -0.52 3.64 -1.90 -1.46 116.57 116.58 2j03 h LYS 40 Ca 0.10 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2j03 h LYS 40 Cb 0.26 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2j03 h LYS 40 CO -0.60 0.15 -0.01 0.00 -2.27 0.00 0.00 179.45 176.71 2j03 h ALA 41 N 1.56 -0.04 0.00 5.00 0.00 0.54 -2.58 119.26 123.74 2j03 h ALA 41 Ca 0.66 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2j03 h ALA 41 Cb 2.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.81 2j03 h ALA 41 CO -0.27 -0.06 0.00 1.63 0.00 0.00 0.00 179.25 180.55 2j03 n LYS 42 N -4.72 0.00 -0.00 0.00 5.02 0.14 -0.34 118.16 118.26 2j03 n LYS 42 Ca -0.07 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.22 2j03 n LYS 42 Cb 0.29 -1.29 -0.00 0.00 -0.02 0.00 0.00 35.03 34.01 2j03 n LYS 42 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2j03 n GLU 43 N -0.61 0.02 0.09 1.97 4.07 -1.05 -4.57 120.64 120.55 2j03 n GLU 43 Ca 0.00 0.00 0.19 0.00 -0.06 0.00 0.00 57.16 57.30 2j03 n GLU 43 Cb 0.00 -0.92 0.75 0.00 -0.06 0.00 0.00 31.44 31.21 2j03 n GLU 43 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2j03 h LEU 44 N -0.01 0.00 0.00 4.31 7.12 -0.26 -3.15 115.31 123.33 2j03 h LEU 44 Ca -0.02 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.99 2j03 h LEU 44 Cb 1.02 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.15 2j03 h LEU 44 CO -0.00 0.00 0.00 -2.11 -0.13 0.00 0.00 178.44 176.20 2j03 n ARG 45 N -4.02 0.00 -0.21 1.25 1.85 -0.91 -1.41 116.66 113.21 2j03 n ARG 45 Ca 0.06 0.00 0.03 0.00 -1.00 0.00 0.00 57.85 56.94 2j03 n ARG 45 Cb 0.52 -0.43 0.07 0.00 -1.05 0.00 0.00 32.46 31.57 2j03 n ARG 45 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2j03 n GLY 46 N 0.00 -1.03 0.41 2.89 0.00 -1.20 -0.72 105.19 105.55 2j03 n GLY 46 Ca 0.00 0.64 -0.14 0.00 0.00 0.00 0.00 46.02 46.52 2j03 n GLY 46 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2j03 h PHE 47 N 0.00 -1.21 -0.26 1.61 3.57 -1.49 -2.53 116.94 116.63 2j03 h PHE 47 Ca 0.27 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.86 2j03 h PHE 47 Cb 0.42 0.52 -0.05 0.00 2.79 0.00 0.00 35.95 39.63 2j03 h PHE 47 CO -0.46 -0.51 -0.07 0.28 -2.23 0.00 0.00 178.31 175.31 2j03 h VAL 48 N -0.62 0.73 -0.05 1.41 2.07 0.29 -3.04 116.25 117.05 2j03 h VAL 48 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2j03 h VAL 48 Cb 0.67 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 2j03 h VAL 48 CO -0.28 0.00 -0.03 0.44 0.02 0.00 0.00 177.57 177.72 2j03 h ASP 49 N -0.01 -0.11 -1.83 0.57 5.19 -1.09 0.57 116.42 119.70 2j03 h ASP 49 Ca 0.12 0.02 0.53 0.00 -0.62 0.00 0.00 57.03 57.08 2j03 h ASP 49 Cb 0.20 0.05 -0.07 0.00 0.18 0.00 0.00 39.33 39.68 2j03 h ASP 49 CO -0.27 -0.01 1.32 1.57 -3.12 0.00 0.00 179.24 178.73 2j03 n HIS 50 N -3.05 0.00 -0.01 4.55 -0.00 -1.01 0.29 115.22 115.99 2j03 n HIS 50 Ca 0.00 0.00 -0.17 0.00 0.46 0.00 0.00 57.72 58.01 2j03 n HIS 50 Cb 0.01 -0.46 -0.13 0.00 -0.12 0.00 0.00 29.99 29.30 2j03 n HIS 50 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 2j03 h LEU 51 N 0.00 0.24 0.75 0.27 3.38 0.05 -1.97 115.31 118.04 2j03 h LEU 51 Ca 0.87 -0.93 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 2j03 h LEU 51 Cb 3.51 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 44.18 2j03 h LEU 51 CO -0.01 1.15 -0.47 0.40 0.09 0.00 0.00 178.44 179.60 2j03 h ILE 52 N -0.63 0.00 0.00 1.22 1.08 0.65 0.44 117.51 120.27 2j03 h ILE 52 Ca -0.06 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.41 2j03 h ILE 52 Cb 1.25 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 2j03 h ILE 52 CO 0.07 0.00 0.05 1.57 -0.69 0.00 0.00 178.15 179.15 2j03 n HIS 53 N -5.43 0.52 -0.08 1.37 -0.00 0.11 -0.15 115.22 111.57 2j03 n HIS 53 Ca -0.14 0.27 -0.20 0.00 0.46 0.00 0.00 57.72 58.12 2j03 n HIS 53 Cb 0.48 -0.90 -0.12 0.00 -0.12 0.00 0.00 29.99 29.32 2j03 n HIS 53 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 2j03 h LEU 54 N 0.00 0.04 -1.31 0.27 5.85 -0.40 -3.22 115.31 116.54 2j03 h LEU 54 Ca 0.00 -0.68 0.00 0.00 0.84 0.00 0.00 57.88 58.04 2j03 h LEU 54 Cb 0.09 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.11 2j03 h LEU 54 CO 0.00 1.38 0.00 0.00 -0.34 0.00 0.00 178.44 179.48 2j03 n ALA 55 N -3.16 1.11 -0.01 1.25 0.00 0.14 -1.95 120.51 117.90 2j03 n ALA 55 Ca -0.26 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2j03 n ALA 55 Cb 0.65 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2j03 n ALA 55 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2j03 n LYS 56 N -2.23 0.00 -1.67 0.00 3.00 0.79 -4.38 118.16 113.67 2j03 n LYS 56 Ca -0.01 0.52 -0.40 0.00 -0.00 0.00 0.00 58.31 58.42 2j03 n LYS 56 Cb 0.05 -1.50 0.03 0.00 0.00 0.00 0.00 35.03 33.61 2j03 n LYS 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2j03 n ARG 57 N -2.03 1.55 0.00 1.64 1.74 -0.82 -4.88 116.66 113.86 2j03 n ARG 57 Ca 0.00 0.56 0.10 0.00 -0.77 0.00 0.00 57.85 57.74 2j03 n ARG 57 Cb 0.00 -2.31 0.02 0.00 -1.02 0.00 0.00 32.46 29.15 2j03 n ARG 57 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2j03 n GLY 58 N 0.97 0.21 3.60 -0.13 0.00 -1.26 -4.85 105.19 103.73 2j03 n GLY 58 Ca 0.09 -0.58 -0.48 0.00 0.00 0.00 0.00 46.02 45.06 2j03 n GLY 58 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2j03 n ASP 59 N 0.31 1.62 -0.30 1.61 3.85 -1.26 -4.65 116.55 117.74 2j03 n ASP 59 Ca 0.09 1.14 0.12 0.00 -0.71 0.00 0.00 54.79 55.44 2j03 n ASP 59 Cb 0.45 -1.26 0.29 0.00 -1.35 0.00 0.00 41.12 39.24 2j03 n ASP 59 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 2j03 h LEU 60 N 3.44 0.19 -0.12 -2.12 6.46 -1.98 0.25 115.31 121.43 2j03 h LEU 60 Ca -0.43 0.17 0.01 0.00 -0.12 0.00 0.00 57.88 57.51 2j03 h LEU 60 Cb 1.33 0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 41.42 2j03 h LEU 60 CO 0.70 -0.06 -0.14 -0.74 -0.62 0.00 0.00 178.44 177.59 2j03 h HIS 61 N 0.32 -0.42 -0.97 1.25 2.76 -1.99 0.66 115.15 116.76 2j03 h HIS 61 Ca 0.54 0.02 0.26 0.00 -2.20 0.00 0.00 60.37 58.99 2j03 h HIS 61 Cb 1.04 0.20 -0.13 0.00 1.55 0.00 0.00 27.41 30.07 2j03 h HIS 61 CO -0.19 -0.12 0.51 0.00 -1.30 0.00 0.00 177.93 176.84 2j03 h ALA 62 N -0.94 1.71 0.10 5.26 0.00 -1.03 0.73 119.26 125.09 2j03 h ALA 62 Ca 0.02 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2j03 h ALA 62 Cb 0.14 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2j03 h ALA 62 CO -0.16 -0.38 -0.22 -0.09 0.00 0.00 0.00 179.25 178.40 2j03 h ARG 63 N 0.44 -0.34 -1.01 0.00 2.43 0.31 -1.82 114.38 114.40 2j03 h ARG 63 Ca 0.64 0.02 0.15 0.00 -0.81 0.00 0.00 59.98 59.99 2j03 h ARG 63 Cb 1.30 0.08 -0.10 0.00 -0.42 0.00 0.00 29.97 30.83 2j03 h ARG 63 CO -0.54 -0.22 0.62 0.00 -1.51 0.00 0.00 179.97 178.32 2j03 h ARG 64 N -0.35 0.86 0.00 0.20 3.08 0.20 0.36 114.38 118.74 2j03 h ARG 64 Ca -0.01 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2j03 h ARG 64 Cb 0.33 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2j03 h ARG 64 CO -0.09 0.57 0.01 -0.11 -1.07 0.00 0.00 179.97 179.28 2j03 n LEU 65 N -4.69 0.00 -0.13 3.04 7.94 0.23 -1.90 117.00 121.50 2j03 n LEU 65 Ca 0.21 0.49 -0.20 0.00 -1.11 0.00 0.00 56.01 55.40 2j03 n LEU 65 Cb 0.46 -0.49 -0.11 0.00 0.53 0.00 0.00 43.42 43.81 2j03 n LEU 65 CO 0.24 -0.49 -1.34 0.52 -1.11 0.00 0.00 177.39 175.22 2j03 n VAL 66 N -1.49 1.44 -0.38 1.96 0.31 0.13 -4.27 118.33 116.03 2j03 n VAL 66 Ca 0.00 -0.51 0.38 0.00 -0.01 0.00 0.00 64.34 64.20 2j03 n VAL 66 Cb 0.01 -1.48 0.76 0.00 -0.91 0.00 0.00 33.84 32.21 2j03 n VAL 66 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2j03 h LEU 67 N -0.20 0.00 0.26 7.52 -0.00 -1.19 0.12 115.31 121.82 2j03 h LEU 67 Ca -0.58 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.30 2j03 h LEU 67 Cb 1.81 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 42.45 2j03 h LEU 67 CO -0.15 0.00 -0.31 0.03 -0.00 0.00 0.00 178.44 178.01 2j03 h ARG 68 N 0.00 -0.60 0.06 1.13 3.08 -1.73 -3.33 114.38 113.00 2j03 h ARG 68 Ca 0.62 0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.71 2j03 h ARG 68 Cb 2.56 0.14 0.00 0.00 0.08 0.00 0.00 29.97 32.74 2j03 h ARG 68 CO -0.01 -0.40 -0.03 -0.44 -1.07 0.00 0.00 179.97 178.03 2j03 h ASP 69 N -0.62 -0.07 0.00 7.04 3.45 -1.05 -3.45 116.42 121.72 2j03 h ASP 69 Ca -0.00 -0.23 0.00 0.00 0.43 0.00 0.00 57.03 57.23 2j03 h ASP 69 Cb 0.58 0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.37 2j03 h ASP 69 CO -0.09 0.53 0.00 0.18 -1.57 0.00 0.00 179.24 178.28 2j03 n LEU 70 N -4.80 0.00 0.00 1.55 4.77 -0.57 -4.80 117.00 113.15 2j03 n LEU 70 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2j03 n LEU 70 Cb 0.14 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2j03 n LEU 70 CO 0.11 -0.11 0.00 1.67 -1.33 0.00 0.00 177.39 177.73 2j03 n GLN 71 N 0.00 0.00 -2.87 3.23 -0.06 -1.25 -4.65 117.38 111.78 2j03 n GLN 71 Ca 0.00 0.00 -0.42 0.00 -2.00 0.00 0.00 57.00 54.58 2j03 n GLN 71 Cb 0.00 0.00 -0.04 0.00 -4.06 0.00 0.00 30.24 26.14 2j03 n GLN 71 CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 2j03 s ASP 72 N -0.72 6.91 0.29 1.69 3.68 -1.26 -4.91 116.67 122.34 2j03 s ASP 72 Ca 0.00 1.12 0.03 0.00 2.13 0.00 0.00 52.55 55.84 2j03 s ASP 72 Cb 0.00 -2.45 0.72 0.00 -1.45 0.00 0.00 42.92 39.74 2j03 s ASP 72 CO 0.00 -0.49 1.69 0.58 0.13 0.00 0.00 175.17 177.08 2j03 h VAL 73 N 5.34 0.46 0.53 1.11 2.07 -1.99 0.18 116.25 123.95 2j03 h VAL 73 Ca -0.25 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 2j03 h VAL 73 Cb 1.10 0.05 0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2j03 h VAL 73 CO 0.87 0.07 -0.25 0.50 0.02 0.00 0.00 177.57 178.77 2j03 h LYS 74 N 0.37 -0.69 -1.09 1.57 1.63 -2.01 -2.60 116.57 113.76 2j03 h LYS 74 Ca 0.56 0.05 0.32 0.00 -0.85 0.00 0.00 60.65 60.72 2j03 h LYS 74 Cb 1.07 0.16 -0.04 0.00 -0.60 0.00 0.00 32.23 32.81 2j03 h LYS 74 CO -0.54 -0.46 0.85 1.25 -3.45 0.00 0.00 179.45 177.11 2j03 h LEU 75 N -0.83 0.00 -0.36 5.20 7.12 -1.71 0.63 115.31 125.36 2j03 h LEU 75 Ca -0.07 0.00 -0.17 0.00 0.13 0.00 0.00 57.88 57.77 2j03 h LEU 75 Cb 0.55 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.67 2j03 h LEU 75 CO 0.12 0.00 -0.47 1.62 -0.13 0.00 0.00 178.44 179.58 2j03 h VAL 76 N 0.00 1.27 0.08 1.05 3.04 -0.39 -2.50 116.25 118.80 2j03 h VAL 76 Ca 0.52 -1.65 -0.00 0.00 -1.01 0.00 0.00 66.70 64.56 2j03 h VAL 76 Cb 2.22 1.51 -0.01 0.00 -2.01 0.00 0.00 31.29 33.01 2j03 h VAL 76 CO -0.01 0.54 -0.12 0.03 -1.01 0.00 0.00 177.57 177.01 2j03 h ARG 77 N 0.70 -0.20 -1.30 4.17 3.08 0.65 1.18 114.38 122.67 2j03 h ARG 77 Ca 0.04 0.01 0.44 0.00 0.07 0.00 0.00 59.98 60.54 2j03 h ARG 77 Cb 1.07 0.04 -0.12 0.00 0.08 0.00 0.00 29.97 31.04 2j03 h ARG 77 CO 0.11 -0.13 0.85 1.17 -1.07 0.00 0.00 179.97 180.90 2j03 n LYS 78 N -3.05 -0.03 0.02 0.04 4.81 -1.10 0.06 118.16 118.91 2j03 n LYS 78 Ca -0.02 1.12 -0.01 0.00 -0.87 0.00 0.00 58.31 58.52 2j03 n LYS 78 Cb 0.10 -2.24 -0.01 0.00 0.02 0.00 0.00 35.03 32.90 2j03 n LYS 78 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 2j03 h LEU 79 N 0.00 -0.08 0.00 3.14 6.46 -0.46 1.26 115.31 125.62 2j03 h LEU 79 Ca 0.80 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.57 2j03 h LEU 79 Cb 2.65 0.02 0.00 0.00 -0.73 0.00 0.00 40.66 42.60 2j03 h LEU 79 CO -0.38 0.09 0.00 0.49 -0.62 0.00 0.00 178.44 178.02 2j03 n PHE 80 N -3.06 0.00 -1.63 1.25 3.72 0.39 -0.64 117.46 117.49 2j03 n PHE 80 Ca -0.01 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.08 2j03 n PHE 80 Cb 0.04 -0.17 -0.03 0.00 -0.94 0.00 0.00 39.48 38.37 2j03 n PHE 80 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2j03 n ASP 81 N -1.39 6.80 0.00 4.37 3.85 -0.15 -4.02 116.55 126.01 2j03 n ASP 81 Ca 0.00 -3.37 0.00 0.00 -0.71 0.00 0.00 54.79 50.71 2j03 n ASP 81 Cb 0.00 -1.20 0.00 0.00 -1.35 0.00 0.00 41.12 38.57 2j03 n ASP 81 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.20 177.40 2j03 n GLU 82 N 0.54 0.00 -0.09 0.11 2.13 -1.18 -4.82 120.64 117.33 2j03 n GLU 82 Ca 0.51 0.00 -0.23 0.00 0.66 0.00 0.00 57.16 58.10 2j03 n GLU 82 Cb 0.46 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 32.05 2j03 n GLU 82 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2j03 n ILE 83 N -1.29 1.58 -0.10 6.31 2.08 0.43 -4.41 119.36 123.97 2j03 n ILE 83 Ca 0.00 -0.21 -0.07 0.00 0.56 0.00 0.00 62.75 63.03 2j03 n ILE 83 Cb 0.00 -1.95 0.01 0.00 -0.75 0.00 0.00 39.64 36.95 2j03 n ILE 83 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2j03 h ALA 84 N -0.43 0.39 -0.87 -1.39 0.00 -1.11 -2.99 119.26 112.86 2j03 h ALA 84 Ca -0.41 0.03 0.17 0.00 0.00 0.00 0.00 54.91 54.69 2j03 h ALA 84 Cb 1.50 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 19.12 2j03 h ALA 84 CO -0.18 -0.26 -0.25 -1.35 0.00 0.00 0.00 179.25 177.22 2j03 h PRO 85 N 0.29 -0.01 0.00 0.00 0.11 -1.78 0.31 132.00 130.91 2j03 h PRO 85 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2j03 h PRO 85 Cb 0.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.21 2j03 h PRO 85 CO -0.13 -0.01 0.65 0.00 -0.21 0.00 0.00 178.00 178.30 2j03 h ARG 86 N -0.01 0.00 0.00 1.05 3.08 -1.73 -3.31 114.38 113.45 2j03 h ARG 86 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.45 2j03 h ARG 86 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.68 2j03 h ARG 86 CO -0.90 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 178.66 2j03 n TYR 87 N -1.83 0.00 0.00 3.04 4.01 0.11 -4.90 117.16 117.59 2j03 n TYR 87 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2j03 n TYR 87 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.68 2j03 n TYR 87 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2j03 n ARG 88 N 0.00 0.00 -0.15 -0.72 0.63 -1.20 -3.99 116.66 111.23 2j03 n ARG 88 Ca 0.00 0.00 0.02 0.00 -0.92 0.00 0.00 57.85 56.95 2j03 n ARG 88 Cb 0.00 0.00 0.09 0.00 0.45 0.00 0.00 32.46 33.00 2j03 n ARG 88 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2j03 n ASP 89 N 1.08 1.56 -4.62 6.15 8.00 -1.26 -4.83 116.55 122.63 2j03 n ASP 89 Ca 0.00 -2.11 -0.28 0.00 0.71 0.00 0.00 54.79 53.11 2j03 n ASP 89 Cb 0.00 -0.34 -0.09 0.00 -0.02 0.00 0.00 41.12 40.67 2j03 n ASP 89 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2j03 s ARG 90 N -1.59 2.25 -0.52 -1.24 3.52 -1.26 -5.09 118.95 115.03 2j03 s ARG 90 Ca 0.12 -1.09 0.04 0.00 -0.13 0.00 0.00 55.73 54.67 2j03 s ARG 90 Cb 0.08 -2.31 0.14 0.00 -1.56 0.00 0.00 34.95 31.30 2j03 s ARG 90 CO 0.06 0.47 0.29 -1.14 -0.81 0.00 0.00 175.30 174.17 2j03 s GLN 91 N -2.63 1.81 0.68 5.12 0.74 -1.26 -5.07 119.66 119.05 2j03 s GLN 91 Ca 0.25 -2.53 0.00 0.00 0.05 0.00 0.00 55.36 53.13 2j03 s GLN 91 Cb -0.10 -2.98 0.00 0.00 1.10 0.00 0.00 33.01 31.03 2j03 s GLN 91 CO 0.16 -1.16 0.00 0.41 -0.55 0.00 0.00 175.29 174.15 2j03 n GLY 92 N 3.06 -1.94 4.25 2.59 0.00 -1.26 -4.97 105.19 106.92 2j03 n GLY 92 Ca 0.09 -1.65 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 2j03 n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j03 n GLY 93 N 0.00 -0.22 0.62 -0.02 0.00 -1.26 -4.81 105.19 99.51 2j03 n GLY 93 Ca 0.00 0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.25 2j03 n GLY 93 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2j03 n TYR 94 N -4.58 0.46 -3.61 1.61 4.02 -1.26 -4.86 117.16 108.93 2j03 n TYR 94 Ca -0.29 -0.20 -0.13 0.00 -0.01 0.00 0.00 57.90 57.27 2j03 n TYR 94 Cb 0.66 -0.07 -0.07 0.00 -0.02 0.00 0.00 39.34 39.85 2j03 n TYR 94 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 2j03 s THR 95 N -1.64 0.00 0.28 -0.72 -1.32 -1.15 -3.96 115.64 107.12 2j03 s THR 95 Ca 0.18 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.76 2j03 s THR 95 Cb 0.11 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 70.05 2j03 s THR 95 CO 0.10 0.00 -0.05 -0.13 -2.21 0.00 0.00 174.62 172.33 2j03 s ARG 96 N -0.04 2.12 -0.06 7.08 0.52 -0.05 -4.99 118.95 123.54 2j03 s ARG 96 Ca -0.01 -1.54 -0.01 0.00 -0.52 0.00 0.00 55.73 53.65 2j03 s ARG 96 Cb -0.04 -2.04 0.03 0.00 0.52 0.00 0.00 34.95 33.42 2j03 s ARG 96 CO 0.01 0.33 0.01 0.08 0.02 0.00 0.00 175.30 175.75 2j03 s VAL 97 N -2.39 0.25 -0.17 3.52 1.01 -1.25 -1.71 120.40 119.65 2j03 s VAL 97 Ca 0.31 0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.47 2j03 s VAL 97 Cb -0.05 -0.41 0.01 0.00 0.00 0.00 0.00 36.38 35.92 2j03 s VAL 97 CO 0.19 0.22 -0.18 -0.76 0.00 0.00 0.00 175.10 174.58 2j03 s LEU 98 N 1.83 2.28 0.47 3.92 1.43 0.62 -4.91 118.68 124.31 2j03 s LEU 98 Ca 0.02 -0.58 -0.24 0.00 -1.03 0.00 0.00 54.13 52.30 2j03 s LEU 98 Cb -0.12 -1.52 -0.08 0.00 0.03 0.00 0.00 46.19 44.49 2j03 s LEU 98 CO -0.04 0.03 1.25 0.29 0.23 0.00 0.00 176.35 178.11 2j03 n LYS 99 N 4.46 1.76 -4.20 1.70 4.76 -1.26 -0.77 118.16 124.61 2j03 n LYS 99 Ca -0.20 0.64 -0.26 0.00 -2.87 0.00 0.00 58.31 55.61 2j03 n LYS 99 Cb 0.51 -2.39 -0.07 0.00 -1.84 0.00 0.00 35.03 31.23 2j03 n LYS 99 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2j03 s LEU 100 N -2.05 3.36 -0.07 -0.35 2.01 -0.46 -4.84 118.68 116.28 2j03 s LEU 100 Ca 0.65 -0.39 -0.18 0.00 0.01 0.00 0.00 54.13 54.22 2j03 s LEU 100 Cb -0.48 -1.99 -0.05 0.00 0.01 0.00 0.00 46.19 43.68 2j03 s LEU 100 CO 0.55 0.07 0.48 0.00 1.01 0.00 0.00 176.35 178.46 2j03 s ALA 101 N -1.80 3.53 0.04 4.21 0.00 -1.26 -4.70 121.76 121.78 2j03 s ALA 101 Ca 0.28 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.08 2j03 s ALA 101 Cb -0.09 -2.60 0.00 0.00 0.00 0.00 0.00 23.12 20.43 2j03 s ALA 101 CO 0.19 0.15 0.00 0.39 0.00 0.00 0.00 175.76 176.49 2j03 n GLU 102 N 3.04 -0.54 -3.11 0.00 1.02 -1.26 -5.02 120.64 114.76 2j03 n GLU 102 Ca -0.09 0.46 -0.19 0.00 -0.02 0.00 0.00 57.16 57.32 2j03 n GLU 102 Cb 0.52 -0.43 0.02 0.00 -0.02 0.00 0.00 31.44 31.53 2j03 n GLU 102 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2j03 s ARG 103 N -3.66 2.61 0.20 3.49 0.52 -1.26 -4.51 118.95 116.34 2j03 s ARG 103 Ca 0.00 -1.43 -0.32 0.00 -0.52 0.00 0.00 55.73 53.46 2j03 s ARG 103 Cb 0.00 -2.66 -0.15 0.00 0.52 0.00 0.00 34.95 32.66 2j03 s ARG 103 CO 0.00 -0.47 1.08 -2.13 0.02 0.00 0.00 175.30 173.81 2j03 n ARG 104 N -1.94 1.11 -3.03 3.54 3.00 -0.80 -4.75 116.66 113.78 2j03 n ARG 104 Ca 0.10 0.39 -0.44 0.00 -0.00 0.00 0.00 57.85 57.90 2j03 n ARG 104 Cb 0.60 -1.83 -0.04 0.00 0.00 0.00 0.00 32.46 31.20 2j03 n ARG 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2j03 s ARG 105 N -0.68 3.20 0.00 -0.14 0.52 -1.26 -1.88 118.95 118.71 2j03 s ARG 105 Ca 0.70 -1.36 0.00 0.00 -0.52 0.00 0.00 55.73 54.55 2j03 s ARG 105 Cb -0.83 -4.38 0.00 0.00 0.52 0.00 0.00 34.95 30.26 2j03 s ARG 105 CO 0.54 -1.64 0.00 0.41 0.02 0.00 0.00 175.30 174.64 2j03 n GLY 106 N 5.24 0.25 0.00 -3.53 0.00 -1.26 -4.87 105.19 101.01 2j03 n GLY 106 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 2j03 n GLY 106 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2j03 n ASP 107 N 0.00 0.00 -3.97 1.61 3.85 -1.26 -4.93 116.55 111.85 2j03 n ASP 107 Ca 0.00 0.00 -0.40 0.00 -0.71 0.00 0.00 54.79 53.68 2j03 n ASP 107 Cb 0.00 0.00 0.02 0.00 -1.35 0.00 0.00 41.12 39.79 2j03 n ASP 107 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2j03 n GLY 108 N 0.00 -0.97 3.58 6.12 0.00 -0.79 -4.91 105.19 108.22 2j03 n GLY 108 Ca 0.00 0.41 -0.40 0.00 0.00 0.00 0.00 46.02 46.03 2j03 n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j03 s ALA 109 N -3.39 3.52 0.14 4.61 0.00 -1.24 -4.73 121.76 120.66 2j03 s ALA 109 Ca 0.38 -0.94 -0.33 0.00 0.00 0.00 0.00 51.96 51.07 2j03 s ALA 109 Cb -0.20 -2.89 -0.13 0.00 0.00 0.00 0.00 23.12 19.90 2j03 s ALA 109 CO 0.94 -0.99 1.67 -0.35 0.00 0.00 0.00 175.76 177.04 2j03 n PRO 110 N 5.56 2.38 -3.49 0.00 -0.04 -1.26 -1.91 135.00 136.24 2j03 n PRO 110 Ca -0.06 0.86 -0.20 0.00 -0.04 0.00 0.00 63.50 64.06 2j03 n PRO 110 Cb 0.49 -2.67 -0.02 0.00 -0.04 0.00 0.00 33.50 31.27 2j03 n PRO 110 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2j03 s LEU 111 N 1.51 3.59 0.12 1.53 1.43 -1.26 -2.64 118.68 122.97 2j03 s LEU 111 Ca 0.80 -0.52 -0.13 0.00 -1.03 0.00 0.00 54.13 53.25 2j03 s LEU 111 Cb -0.62 -2.34 0.02 0.00 0.03 0.00 0.00 46.19 43.28 2j03 s LEU 111 CO 0.38 -0.57 0.32 0.00 0.23 0.00 0.00 176.35 176.71 2j03 s ALA 112 N -2.36 -0.56 -0.02 4.21 0.00 0.14 -1.35 121.76 121.82 2j03 s ALA 112 Ca 0.47 -0.37 0.02 0.00 0.00 0.00 0.00 51.96 52.08 2j03 s ALA 112 Cb -0.06 0.66 -0.03 0.00 0.00 0.00 0.00 23.12 23.68 2j03 s ALA 112 CO 0.29 -0.61 -0.06 -1.17 0.00 0.00 0.00 175.76 174.21 2j03 s LEU 113 N -2.85 3.19 -0.24 0.00 2.96 0.05 -1.74 118.68 120.04 2j03 s LEU 113 Ca 0.06 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 2j03 s LEU 113 Cb 0.03 -1.79 0.06 0.00 0.50 0.00 0.00 46.19 44.99 2j03 s LEU 113 CO -0.09 0.31 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.48 2j03 s VAL 114 N -0.95 1.72 0.05 1.68 1.01 0.11 -0.27 120.40 123.76 2j03 s VAL 114 Ca 0.16 -1.34 0.04 0.00 0.00 0.00 0.00 61.98 60.83 2j03 s VAL 114 Cb -0.11 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 2j03 s VAL 114 CO 0.06 -0.08 -0.02 -0.70 0.00 0.00 0.00 175.10 174.36 2j03 s GLU 115 N 1.31 2.57 0.00 2.72 2.12 -0.70 -0.54 118.70 126.18 2j03 s GLU 115 Ca -0.07 -0.78 0.00 0.00 0.36 0.00 0.00 54.97 54.48 2j03 s GLU 115 Cb -0.19 -2.54 0.00 0.00 0.26 0.00 0.00 34.13 31.65 2j03 s GLU 115 CO -0.06 0.57 0.00 1.28 -0.54 0.00 0.00 175.26 176.51 2j03 n LEU 116 N 0.95 0.00 0.00 2.70 4.77 -0.17 -0.87 117.00 124.38 2j03 n LEU 116 Ca -0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 2j03 n LEU 116 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2j03 n LEU 116 CO 0.36 0.00 0.00 0.55 -1.33 0.00 0.00 177.39 176.97 2j03 n VAL 117 N 0.00 0.00 -0.51 4.08 3.14 -1.25 -2.46 118.33 121.33 2j03 n VAL 117 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2j03 n VAL 117 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2j03 n VAL 117 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58