#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x02 h ASP 2 N 0.00 0.00 -0.68 0.00 3.04 -2.11 -3.31 116.42 113.36 1x02 h ASP 2 Ca 0.00 0.00 -0.36 0.00 -3.24 0.00 0.00 57.03 53.43 1x02 h ASP 2 Cb 0.00 0.00 -0.21 0.00 -1.04 0.00 0.00 39.33 38.08 1x02 h ASP 2 CO 0.00 0.06 0.46 0.00 -2.04 0.00 0.00 179.24 177.72 1x02 n GLN 3 N -2.83 1.88 -3.18 4.15 1.13 -1.26 -4.46 117.38 112.81 1x02 n GLN 3 Ca 0.01 -2.07 -0.23 0.00 -1.94 0.00 0.00 57.00 52.76 1x02 n GLN 3 Cb 0.57 -1.81 -0.05 0.00 0.11 0.00 0.00 30.24 29.06 1x02 n GLN 3 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1x02 n LEU 4 N -0.59 1.65 0.00 1.08 4.77 -1.25 -4.86 117.00 117.80 1x02 n LEU 4 Ca 0.41 -5.08 -0.07 0.00 -0.03 0.00 0.00 56.01 51.24 1x02 n LEU 4 Cb 1.25 0.28 0.04 0.00 -2.33 0.00 0.00 43.42 42.66 1x02 n LEU 4 CO 0.43 2.20 0.19 0.35 -1.33 0.00 0.00 177.39 179.22 1x02 n THR 5 N 0.64 0.00 -0.43 -5.08 -2.24 -1.26 -4.57 114.28 101.33 1x02 n THR 5 Ca 0.25 -0.46 0.35 0.00 -2.27 0.00 0.00 64.05 61.93 1x02 n THR 5 Cb 0.54 -1.32 0.54 0.00 -2.10 0.00 0.00 70.33 67.99 1x02 n THR 5 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1x02 n GLU 6 N -1.61 0.00 0.38 -0.78 -0.58 -1.26 0.75 120.64 117.55 1x02 n GLU 6 Ca 0.05 0.82 -0.18 0.00 -0.42 0.00 0.00 57.16 57.43 1x02 n GLU 6 Cb 0.18 -1.93 -0.09 0.00 -0.57 0.00 0.00 31.44 29.03 1x02 n GLU 6 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 1x02 h GLU 7 N 0.00 -0.94 -0.18 3.49 4.11 -1.98 0.15 114.58 119.24 1x02 h GLU 7 Ca 0.62 0.06 -0.15 0.00 0.07 0.00 0.00 59.36 59.96 1x02 h GLU 7 Cb 2.71 0.21 0.00 0.00 0.50 0.00 0.00 28.75 32.18 1x02 h GLU 7 CO -0.01 -0.62 -0.48 1.96 0.07 0.00 0.00 179.01 179.93 1x02 h GLN 8 N -0.97 0.64 -0.50 1.06 1.08 0.05 -3.07 115.11 113.40 1x02 h GLN 8 Ca -0.09 -0.45 0.06 0.00 -1.45 0.00 0.00 58.65 56.72 1x02 h GLN 8 Cb 0.76 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 28.21 1x02 h GLN 8 CO 0.13 1.07 0.21 0.82 -0.95 0.00 0.00 178.83 180.11 1x02 h ILE 9 N 0.32 0.87 -0.45 2.54 5.03 -1.32 0.02 117.51 124.52 1x02 h ILE 9 Ca -0.01 -0.14 0.00 0.00 -0.12 0.00 0.00 64.86 64.59 1x02 h ILE 9 Cb 1.10 0.43 -0.02 0.00 -3.03 0.00 0.00 36.82 35.30 1x02 h ILE 9 CO 0.10 0.07 0.30 0.00 -0.68 0.00 0.00 178.15 177.95 1x02 h ALA 10 N 1.31 1.67 0.12 1.87 0.00 -0.72 0.35 119.26 123.87 1x02 h ALA 10 Ca 0.24 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1x02 h ALA 10 Cb 0.22 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1x02 h ALA 10 CO -0.21 0.30 -0.06 0.93 0.00 0.00 0.00 179.25 180.21 1x02 h GLU 11 N 0.62 -0.16 0.00 0.00 4.39 -1.13 -2.47 114.58 115.83 1x02 h GLU 11 Ca 0.17 0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.83 1x02 h GLU 11 Cb -0.07 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 1x02 h GLU 11 CO -0.04 0.31 -0.22 0.74 -1.16 0.00 0.00 179.01 178.65 1x02 h PHE 12 N -0.76 0.00 0.62 4.33 0.04 -0.85 -2.31 116.94 118.01 1x02 h PHE 12 Ca -0.02 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.72 1x02 h PHE 12 Cb 0.54 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.70 1x02 h PHE 12 CO 0.09 0.22 -0.30 -0.22 -0.60 0.00 0.00 178.31 177.50 1x02 h LYS 13 N 0.00 -0.80 -1.00 1.51 3.64 -0.32 -2.03 116.57 117.57 1x02 h LYS 13 Ca -0.00 0.05 0.11 0.00 -1.27 0.00 0.00 60.65 59.54 1x02 h LYS 13 Cb 0.45 0.18 -0.08 0.00 -0.41 0.00 0.00 32.23 32.37 1x02 h LYS 13 CO 0.03 -0.53 0.63 0.93 -2.27 0.00 0.00 179.45 178.24 1x02 h GLU 14 N -1.22 0.99 0.00 1.90 4.39 -1.41 0.77 114.58 120.00 1x02 h GLU 14 Ca -0.08 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.56 1x02 h GLU 14 Cb 0.64 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1x02 h GLU 14 CO 0.14 0.66 0.00 0.00 -1.16 0.00 0.00 179.01 178.64 1x02 n ALA 15 N -2.35 1.73 0.37 3.43 0.00 -0.87 -2.41 120.51 120.40 1x02 n ALA 15 Ca 0.18 0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.69 1x02 n ALA 15 Cb 0.33 -1.34 -0.06 0.00 0.00 0.00 0.00 19.45 18.38 1x02 n ALA 15 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1x02 n PHE 16 N -1.94 0.00 0.04 0.00 7.35 0.11 -4.40 117.46 118.63 1x02 n PHE 16 Ca 0.03 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.66 1x02 n PHE 16 Cb 0.22 -0.05 -0.10 0.00 0.35 0.00 0.00 39.48 39.90 1x02 n PHE 16 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 1x02 h SER 17 N 0.00 0.00 0.15 -2.13 0.02 0.68 -3.18 113.55 109.10 1x02 h SER 17 Ca 0.00 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.72 1x02 h SER 17 Cb 0.29 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.84 1x02 h SER 17 CO 0.00 0.90 -0.92 0.17 -1.14 0.00 0.00 176.83 175.83 1x02 h LEU 18 N 0.00 0.71 -0.80 5.07 -0.00 -1.74 -3.23 115.31 115.32 1x02 h LEU 18 Ca -0.10 -0.54 -0.10 0.00 -0.00 0.00 0.00 57.88 57.14 1x02 h LEU 18 Cb 1.77 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 42.20 1x02 h LEU 18 CO 0.10 1.33 -0.20 -0.26 -0.00 0.00 0.00 178.44 179.41 1x02 h PHE 19 N 0.34 0.77 -2.01 0.17 0.04 -1.77 -3.38 116.94 111.10 1x02 h PHE 19 Ca -0.09 -0.16 -0.61 0.00 2.80 0.00 0.00 57.97 59.91 1x02 h PHE 19 Cb 1.56 -0.19 -0.12 0.00 2.20 0.00 0.00 35.95 39.39 1x02 h PHE 19 CO 0.08 0.84 1.05 0.34 -0.60 0.00 0.00 178.31 180.01 1x02 s ASP 20 N -6.75 6.39 0.07 2.17 2.15 -1.20 -4.58 116.67 114.91 1x02 s ASP 20 Ca -0.09 -1.28 -0.13 0.00 0.43 0.00 0.00 52.55 51.48 1x02 s ASP 20 Cb 0.13 -2.50 -0.27 0.00 -0.30 0.00 0.00 42.92 39.99 1x02 s ASP 20 CO 0.82 -1.46 1.13 0.11 -0.17 0.00 0.00 175.17 175.60 1x02 h LYS 21 N 9.57 0.60 -0.65 4.34 1.79 -1.81 -3.29 116.57 127.12 1x02 h LYS 21 Ca -0.02 -0.78 0.08 0.00 -2.18 0.00 0.00 60.65 57.76 1x02 h LYS 21 Cb 1.03 0.25 -0.06 0.00 -1.58 0.00 0.00 32.23 31.87 1x02 h LYS 21 CO 1.27 1.34 0.31 -0.44 -1.08 0.00 0.00 179.45 180.85 1x02 h ASP 22 N 0.28 0.41 -0.26 0.86 3.32 -1.90 -3.47 116.42 115.65 1x02 h ASP 22 Ca -0.17 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.93 1x02 h ASP 22 Cb 1.87 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.40 1x02 h ASP 22 CO 0.23 0.25 0.00 0.61 -1.72 0.00 0.00 179.24 178.60 1x02 n GLY 23 N -1.29 1.04 0.61 2.75 0.00 -1.24 -5.02 105.19 102.04 1x02 n GLY 23 Ca 0.09 -0.21 -0.04 0.00 0.00 0.00 0.00 46.02 45.86 1x02 n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1x02 n ASP 24 N 0.46 1.34 0.00 1.61 5.75 -1.26 -5.06 116.55 119.39 1x02 n ASP 24 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 54.79 54.81 1x02 n ASP 24 Cb 0.15 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 1x02 n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1x02 n GLY 25 N 2.89 0.53 3.11 6.12 0.00 -1.26 -5.08 105.19 111.50 1x02 n GLY 25 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 1x02 n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x02 s THR 26 N -0.55 0.21 -0.36 2.61 -4.23 -1.26 -3.09 115.64 108.97 1x02 s THR 26 Ca 0.00 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 1x02 s THR 26 Cb 0.00 -1.49 0.12 0.00 1.34 0.00 0.00 72.50 72.47 1x02 s THR 26 CO 0.00 -0.94 0.18 -0.63 -0.54 0.00 0.00 174.62 172.69 1x02 s ILE 27 N -3.91 0.73 0.49 2.99 1.01 0.14 -4.47 121.20 118.17 1x02 s ILE 27 Ca 0.07 -1.79 0.02 0.00 0.00 0.00 0.00 60.65 58.95 1x02 s ILE 27 Cb 0.07 -1.53 0.02 0.00 0.01 0.00 0.00 42.46 41.03 1x02 s ILE 27 CO -0.10 -0.84 0.70 0.28 0.00 0.00 0.00 174.94 174.97 1x02 s THR 28 N 1.11 3.22 0.38 2.92 -1.32 -1.26 -3.43 115.64 117.26 1x02 s THR 28 Ca 0.15 -0.68 0.22 0.00 -1.21 0.00 0.00 61.69 60.17 1x02 s THR 28 Cb -0.21 -3.18 0.38 0.00 -1.51 0.00 0.00 72.50 67.98 1x02 s THR 28 CO -0.11 -0.11 1.59 0.71 -2.21 0.00 0.00 174.62 174.49 1x02 h THR 29 N 0.30 0.05 -0.77 5.08 1.35 -1.95 1.63 112.91 118.60 1x02 h THR 29 Ca -0.43 -0.02 -0.02 0.00 -0.55 0.00 0.00 66.41 65.39 1x02 h THR 29 Cb 1.28 -0.00 -0.04 0.00 -1.73 0.00 0.00 68.15 67.66 1x02 h THR 29 CO 0.53 0.01 0.38 0.50 -0.25 0.00 0.00 175.52 176.69 1x02 h LYS 30 N 0.05 1.09 0.00 4.72 3.11 -1.96 0.53 116.57 124.11 1x02 h LYS 30 Ca 0.84 -0.15 -0.05 0.00 -2.81 0.00 0.00 60.65 58.48 1x02 h LYS 30 Cb 2.28 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 33.30 1x02 h LYS 30 CO -0.68 0.83 -0.38 0.93 -2.81 0.00 0.00 179.45 177.34 1x02 h GLU 31 N 1.09 0.00 -0.54 1.90 5.08 0.18 -3.19 114.58 119.10 1x02 h GLU 31 Ca 0.27 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.66 1x02 h GLU 31 Cb 0.09 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 1x02 h GLU 31 CO -0.04 0.53 0.32 1.25 -1.00 0.00 0.00 179.01 180.08 1x02 h LEU 32 N -1.00 0.50 -0.84 1.33 5.85 -0.24 -0.69 115.31 120.22 1x02 h LEU 32 Ca -0.08 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1x02 h LEU 32 Cb 0.70 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.63 1x02 h LEU 32 CO -0.05 0.35 0.00 0.61 -0.34 0.00 0.00 178.44 179.01 1x02 n GLY 33 N -1.25 -1.15 0.11 3.75 0.00 0.18 -0.76 105.19 106.08 1x02 n GLY 33 Ca 0.04 0.11 -0.00 0.00 0.00 0.00 0.00 46.02 46.17 1x02 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x02 h THR 34 N 0.00 0.95 0.01 2.61 1.03 -1.11 -3.20 112.91 113.20 1x02 h THR 34 Ca 0.00 -2.41 -0.40 0.00 -0.01 0.00 0.00 66.41 63.59 1x02 h THR 34 Cb 0.26 2.42 -0.06 0.00 -1.07 0.00 0.00 68.15 69.70 1x02 h THR 34 CO 0.00 0.54 -2.42 0.52 -0.01 0.00 0.00 175.52 174.15 1x02 n VAL 35 N -3.17 1.53 -0.28 0.00 0.31 -0.85 -4.18 118.33 111.68 1x02 n VAL 35 Ca -0.01 -0.54 0.02 0.00 -0.01 0.00 0.00 64.34 63.80 1x02 n VAL 35 Cb 0.80 -1.53 0.15 0.00 -0.91 0.00 0.00 33.84 32.36 1x02 n VAL 35 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1x02 h MET 36 N -0.16 0.76 0.00 5.55 2.86 -1.11 0.14 114.93 122.98 1x02 h MET 36 Ca -0.58 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.01 1x02 h MET 36 Cb 1.86 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 33.35 1x02 h MET 36 CO -0.13 0.50 0.00 0.07 1.06 0.00 0.00 176.91 178.42 1x02 h ARG 37 N 0.78 0.00 -0.03 1.72 -0.00 -1.77 -2.40 114.38 112.69 1x02 h ARG 37 Ca 0.38 0.00 -0.08 0.00 -0.00 0.00 0.00 59.98 60.28 1x02 h ARG 37 Cb 0.32 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.28 1x02 h ARG 37 CO -0.23 0.00 -0.37 0.77 -0.00 0.00 0.00 179.97 180.14 1x02 h SER 38 N 0.00 0.07 0.30 0.08 0.02 -0.87 -3.07 113.55 110.08 1x02 h SER 38 Ca 0.00 -0.02 -0.33 0.00 -0.84 0.00 0.00 61.79 60.59 1x02 h SER 38 Cb 0.33 -0.02 0.01 0.00 0.14 0.00 0.00 62.40 62.86 1x02 h SER 38 CO 0.00 0.43 -1.62 -0.07 -1.14 0.00 0.00 176.83 174.43 1x02 h LEU 39 N 0.06 0.58 0.00 5.07 3.38 -1.44 -3.48 115.31 119.48 1x02 h LEU 39 Ca 0.01 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 57.19 1x02 h LEU 39 Cb 0.68 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1x02 h LEU 39 CO 0.05 1.65 0.00 0.61 0.09 0.00 0.00 178.44 180.84 1x02 n GLY 40 N 1.76 0.63 0.05 0.83 0.00 -1.16 -5.09 105.19 102.22 1x02 n GLY 40 Ca -0.20 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.77 1x02 n GLY 40 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1x02 n GLN 41 N 0.00 0.32 -3.56 1.61 1.13 -1.13 -5.02 117.38 110.74 1x02 n GLN 41 Ca 0.00 0.29 -0.20 0.00 -1.94 0.00 0.00 57.00 55.14 1x02 n GLN 41 Cb 0.00 -1.24 0.05 0.00 0.11 0.00 0.00 30.24 29.16 1x02 n GLN 41 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1x02 n ASN 42 N -3.80 -2.66 -4.77 1.08 3.02 -1.26 -4.95 115.26 101.91 1x02 n ASN 42 Ca -0.07 -0.77 -0.34 0.00 -0.03 0.00 0.00 54.58 53.37 1x02 n ASN 42 Cb 0.26 -4.46 0.03 0.00 -0.61 0.00 0.00 39.78 35.00 1x02 n ASN 42 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1x02 s PRO 43 N -5.56 3.06 0.51 3.52 0.04 -1.26 -5.04 135.00 130.26 1x02 s PRO 43 Ca 0.12 1.50 -0.06 0.00 0.04 0.00 0.00 61.00 62.59 1x02 s PRO 43 Cb -0.03 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1x02 s PRO 43 CO 0.78 -1.06 0.83 0.95 0.04 0.00 0.00 177.00 178.54 1x02 s THR 44 N -2.07 4.86 0.23 1.26 -4.23 -1.26 -4.74 115.64 109.68 1x02 s THR 44 Ca 0.70 0.31 -0.18 0.00 -1.18 0.00 0.00 61.69 61.34 1x02 s THR 44 Cb -0.22 -3.86 0.23 0.00 1.34 0.00 0.00 72.50 69.99 1x02 s THR 44 CO 0.35 -0.90 1.55 -0.33 -0.54 0.00 0.00 174.62 174.75 1x02 h GLU 45 N 0.13 -0.01 -0.98 3.99 5.08 -1.99 1.06 114.58 121.87 1x02 h GLU 45 Ca -0.46 0.00 0.20 0.00 -1.00 0.00 0.00 59.36 58.09 1x02 h GLU 45 Cb 1.20 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.36 1x02 h GLU 45 CO 0.62 -0.01 0.61 0.00 -1.00 0.00 0.00 179.01 179.24 1x02 h ALA 46 N 1.36 1.87 0.31 3.43 0.00 -1.99 0.13 119.26 124.37 1x02 h ALA 46 Ca 0.34 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 1x02 h ALA 46 Cb 0.60 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1x02 h ALA 46 CO -0.97 -0.21 -0.15 0.93 0.00 0.00 0.00 179.25 178.84 1x02 h GLU 47 N 0.64 -0.41 -0.33 0.00 4.39 0.72 -2.41 114.58 117.19 1x02 h GLU 47 Ca 0.55 0.03 0.07 0.00 0.34 0.00 0.00 59.36 60.35 1x02 h GLU 47 Cb 1.01 0.09 -0.08 0.00 -0.10 0.00 0.00 28.75 29.68 1x02 h GLU 47 CO -0.31 -0.11 -0.19 -0.07 -1.16 0.00 0.00 179.01 177.17 1x02 h LEU 48 N -0.99 -0.64 -0.32 1.33 3.38 -0.45 0.94 115.31 118.56 1x02 h LEU 48 Ca -0.04 0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.12 1x02 h LEU 48 Cb 0.49 0.33 -0.05 0.00 0.09 0.00 0.00 40.66 41.52 1x02 h LEU 48 CO 0.07 -0.23 -0.01 1.56 0.09 0.00 0.00 178.44 179.92 1x02 h GLN 49 N -0.15 0.07 -0.47 1.13 1.08 -0.86 0.10 115.11 116.02 1x02 h GLN 49 Ca 0.17 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.37 1x02 h GLN 49 Cb 0.41 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.80 1x02 h GLN 49 CO -0.42 0.05 0.31 -0.44 -0.95 0.00 0.00 178.83 177.38 1x02 h ASP 50 N 0.07 0.54 -0.03 1.46 5.19 -0.80 0.76 116.42 123.61 1x02 h ASP 50 Ca 0.15 -0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.53 1x02 h ASP 50 Cb 0.21 -0.14 -0.00 0.00 0.18 0.00 0.00 39.33 39.58 1x02 h ASP 50 CO -0.27 0.40 -0.04 0.24 -3.12 0.00 0.00 179.24 176.45 1x02 h MET 51 N 0.64 0.09 0.79 3.56 2.86 0.46 -3.19 114.93 120.14 1x02 h MET 51 Ca 0.17 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.72 1x02 h MET 51 Cb -0.07 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.60 1x02 h MET 51 CO -0.04 0.58 -0.38 0.82 1.06 0.00 0.00 176.91 178.95 1x02 h ILE 52 N -0.39 0.00 -0.85 -1.22 2.04 -0.53 -3.00 117.51 113.55 1x02 h ILE 52 Ca 0.00 -0.20 0.34 0.00 1.00 0.00 0.00 64.86 66.01 1x02 h ILE 52 Cb 0.56 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.51 1x02 h ILE 52 CO 0.01 0.00 0.48 0.59 0.00 0.00 0.00 178.15 179.23 1x02 n ASN 53 N -5.39 0.26 -0.12 1.72 3.02 0.23 0.23 115.26 115.21 1x02 n ASN 53 Ca -0.13 1.28 -0.09 0.00 -0.03 0.00 0.00 54.58 55.60 1x02 n ASN 53 Cb 0.42 -0.62 -0.01 0.00 -0.61 0.00 0.00 39.78 38.95 1x02 n ASN 53 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1x02 h GLU 54 N 0.00 0.52 0.00 3.52 4.39 -1.51 -2.76 114.58 118.75 1x02 h GLU 54 Ca 0.68 -0.08 -0.06 0.00 0.34 0.00 0.00 59.36 60.24 1x02 h GLU 54 Cb 1.88 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 30.43 1x02 h GLU 54 CO -0.57 0.49 -0.26 0.28 -1.16 0.00 0.00 179.01 177.79 1x02 h VAL 55 N 0.43 0.46 -1.62 3.13 2.07 0.28 -3.45 116.25 117.55 1x02 h VAL 55 Ca 0.12 -1.61 -0.63 0.00 0.82 0.00 0.00 66.70 65.39 1x02 h VAL 55 Cb 0.15 2.20 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1x02 h VAL 55 CO -0.01 0.26 1.34 -0.67 0.02 0.00 0.00 177.57 178.50 1x02 n ASP 56 N -3.18 2.84 -0.00 0.57 2.03 0.16 -4.80 116.55 114.18 1x02 n ASP 56 Ca 0.03 0.53 -0.00 0.00 0.52 0.00 0.00 54.79 55.87 1x02 n ASP 56 Cb 0.62 -1.37 -0.00 0.00 -0.72 0.00 0.00 41.12 39.65 1x02 n ASP 56 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1x02 n ALA 57 N 9.33 1.13 -0.23 -1.67 0.00 -1.26 -4.64 120.51 123.17 1x02 n ALA 57 Ca 0.32 -0.17 0.22 0.00 0.00 0.00 0.00 53.44 53.81 1x02 n ALA 57 Cb 0.31 0.01 0.40 0.00 0.00 0.00 0.00 19.45 20.17 1x02 n ALA 57 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1x02 n ASP 58 N -2.57 0.22 0.00 0.00 8.00 -1.26 -4.73 116.55 116.20 1x02 n ASP 58 Ca -0.00 1.19 0.00 0.00 0.71 0.00 0.00 54.79 56.69 1x02 n ASP 58 Cb 0.02 -0.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.55 1x02 n ASP 58 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x02 n GLY 59 N -1.20 1.01 0.49 0.44 0.00 -1.26 -5.04 105.19 99.62 1x02 n GLY 59 Ca 0.26 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.17 1x02 n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1x02 n ASN 60 N 0.00 1.38 0.00 1.61 0.23 -1.26 -5.06 115.26 112.16 1x02 n ASN 60 Ca 0.00 0.10 0.00 0.00 -0.53 0.00 0.00 54.58 54.15 1x02 n ASN 60 Cb 0.00 -0.31 0.00 0.00 -2.08 0.00 0.00 39.78 37.39 1x02 n ASN 60 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1x02 n GLY 61 N 2.41 1.77 3.75 4.83 0.00 -1.26 -5.12 105.19 111.58 1x02 n GLY 61 Ca -0.23 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.34 1x02 n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x02 s THR 62 N -0.11 4.66 -0.19 2.61 -4.23 -1.26 -4.68 115.64 112.45 1x02 s THR 62 Ca 0.00 -0.24 -0.29 0.00 -1.18 0.00 0.00 61.69 59.98 1x02 s THR 62 Cb 0.00 -3.04 -0.02 0.00 1.34 0.00 0.00 72.50 70.79 1x02 s THR 62 CO 0.00 0.51 1.34 -0.63 -0.54 0.00 0.00 174.62 175.30 1x02 s ILE 63 N -1.03 4.14 0.31 2.99 1.01 -1.22 -4.81 121.20 122.59 1x02 s ILE 63 Ca 0.17 1.35 0.02 0.00 0.00 0.00 0.00 60.65 62.19 1x02 s ILE 63 Cb -0.12 -3.96 0.06 0.00 0.01 0.00 0.00 42.46 38.45 1x02 s ILE 63 CO 0.07 -0.22 0.43 0.47 0.00 0.00 0.00 174.94 175.70 1x02 n ASP 64 N 7.03 0.79 -0.11 3.58 8.00 -1.26 0.23 116.55 134.80 1x02 n ASP 64 Ca 0.15 -1.62 -0.05 0.00 0.71 0.00 0.00 54.79 53.98 1x02 n ASP 64 Cb 0.45 -0.26 0.02 0.00 -0.02 0.00 0.00 41.12 41.31 1x02 n ASP 64 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1x02 h PHE 65 N -0.26 -0.05 -0.25 1.24 3.04 -1.94 0.24 116.94 118.96 1x02 h PHE 65 Ca -0.14 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.73 1x02 h PHE 65 Cb 0.58 0.08 -0.00 0.00 2.56 0.00 0.00 35.95 39.17 1x02 h PHE 65 CO 0.00 -0.09 -0.25 -1.00 -2.02 0.00 0.00 178.31 174.95 1x02 h PRO 66 N 0.09 0.62 -0.17 6.41 0.13 -1.94 -3.22 132.00 133.91 1x02 h PRO 66 Ca 0.19 -0.32 -0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1x02 h PRO 66 Cb 0.27 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.40 1x02 h PRO 66 CO -0.33 0.92 0.10 0.93 -0.23 0.00 0.00 178.00 179.39 1x02 h GLU 67 N 0.33 0.23 -0.75 0.86 5.08 -1.79 -2.88 114.58 115.66 1x02 h GLU 67 Ca 0.04 -0.02 0.17 0.00 -1.00 0.00 0.00 59.36 58.55 1x02 h GLU 67 Cb 0.81 -0.05 -0.13 0.00 0.50 0.00 0.00 28.75 29.88 1x02 h GLU 67 CO 0.06 0.21 -0.01 0.35 -1.00 0.00 0.00 179.01 178.63 1x02 h PHE 68 N 0.18 -0.08 -1.00 4.33 3.57 -0.57 0.15 116.94 123.53 1x02 h PHE 68 Ca 0.06 0.06 0.38 0.00 3.53 0.00 0.00 57.97 62.00 1x02 h PHE 68 Cb 0.05 0.15 -0.18 0.00 2.79 0.00 0.00 35.95 38.76 1x02 h PHE 68 CO -0.05 -0.25 0.44 -0.07 -2.23 0.00 0.00 178.31 176.16 1x02 h LEU 69 N 0.09 0.17 -0.39 0.59 3.38 -1.52 0.82 115.31 118.46 1x02 h LEU 69 Ca 0.41 0.26 0.01 0.00 0.09 0.00 0.00 57.88 58.65 1x02 h LEU 69 Cb 0.71 0.31 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 1x02 h LEU 69 CO -0.67 -0.40 0.24 0.74 0.09 0.00 0.00 178.44 178.43 1x02 h THR 70 N 0.02 1.06 0.18 0.22 2.02 -0.81 -2.92 112.91 112.68 1x02 h THR 70 Ca 0.79 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.81 1x02 h THR 70 Cb 2.01 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 68.94 1x02 h THR 70 CO -0.79 0.09 -0.14 -0.03 0.37 0.00 0.00 175.52 175.01 1x02 h MET 71 N 0.48 -0.32 -0.92 6.66 1.85 0.60 -2.58 114.93 120.70 1x02 h MET 71 Ca 0.15 0.02 0.26 0.00 -0.61 0.00 0.00 59.70 59.53 1x02 h MET 71 Cb -0.01 0.07 -0.16 0.00 0.43 0.00 0.00 31.60 31.93 1x02 h MET 71 CO -0.06 -0.21 0.19 0.52 -0.40 0.00 0.00 176.91 176.95 1x02 h MET 72 N -0.33 0.11 -0.14 0.39 2.07 -1.23 1.60 114.93 117.41 1x02 h MET 72 Ca -0.01 -0.01 0.03 0.00 -2.07 0.00 0.00 59.70 57.65 1x02 h MET 72 Cb 0.30 -0.03 -0.03 0.00 -1.87 0.00 0.00 31.60 29.97 1x02 h MET 72 CO -0.01 0.07 -0.05 0.00 1.07 0.00 0.00 176.91 177.99 1x02 h ALA 73 N 1.87 0.07 0.00 6.32 0.00 -1.29 1.38 119.26 127.61 1x02 h ALA 73 Ca 0.60 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.56 1x02 h ALA 73 Cb 1.26 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1x02 h ALA 73 CO -0.76 -0.50 -0.11 0.54 0.00 0.00 0.00 179.25 178.42 1x02 n ARG 74 N -5.19 0.11 0.00 0.00 1.74 0.81 -3.20 116.66 110.93 1x02 n ARG 74 Ca -0.04 0.08 0.10 0.00 -0.77 0.00 0.00 57.85 57.22 1x02 n ARG 74 Cb 0.12 -1.61 -0.09 0.00 -1.02 0.00 0.00 32.46 29.86 1x02 n ARG 74 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1x02 n LYS 75 N -1.79 0.15 0.30 5.56 3.00 0.51 -4.21 118.16 121.68 1x02 n LYS 75 Ca 0.06 -0.04 0.18 0.00 -0.00 0.00 0.00 58.31 58.52 1x02 n LYS 75 Cb 0.38 -1.51 1.01 0.00 0.00 0.00 0.00 35.03 34.91 1x02 n LYS 75 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.40 177.92 1x02 h MET 76 N 0.00 0.00 0.00 1.64 2.86 0.19 -0.24 114.93 119.38 1x02 h MET 76 Ca 0.00 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 1x02 h MET 76 Cb 0.61 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.25 1x02 h MET 76 CO 0.00 0.00 -1.36 0.36 1.06 0.00 0.00 176.91 176.97 1x02 n LYS 77 N -3.54 0.62 -0.38 1.72 -0.00 -1.26 -4.09 118.16 111.23 1x02 n LYS 77 Ca -0.02 0.16 0.34 0.00 -0.00 0.00 0.00 58.31 58.78 1x02 n LYS 77 Cb 0.11 -1.79 0.68 0.00 -0.00 0.00 0.00 35.03 34.04 1x02 n LYS 77 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.40 177.78 1x02 h ASP 78 N 0.00 0.16 0.98 -5.58 2.03 -1.24 1.09 116.42 113.86 1x02 h ASP 78 Ca -0.12 0.04 -0.17 0.00 -0.73 0.00 0.00 57.03 56.06 1x02 h ASP 78 Cb 1.39 0.02 -0.02 0.00 -0.83 0.00 0.00 39.33 39.89 1x02 h ASP 78 CO 0.03 -0.00 -0.81 0.74 -1.03 0.00 0.00 179.24 178.16 1x02 h THR 79 N 0.12 1.49 -1.01 1.15 2.02 -1.71 -3.27 112.91 111.70 1x02 h THR 79 Ca 0.65 -2.86 0.29 0.00 0.77 0.00 0.00 66.41 65.26 1x02 h THR 79 Cb 2.27 2.58 -0.04 0.00 -1.74 0.00 0.00 68.15 71.22 1x02 h THR 79 CO -0.15 0.79 1.19 -0.67 0.37 0.00 0.00 175.52 177.06 1x02 n ASP 80 N -3.44 0.00 0.32 4.18 -0.08 0.38 0.07 116.55 117.97 1x02 n ASP 80 Ca 0.00 0.74 0.08 0.00 -1.51 0.00 0.00 54.79 54.10 1x02 n ASP 80 Cb 0.82 -0.25 0.41 0.00 2.34 0.00 0.00 41.12 44.44 1x02 n ASP 80 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1x02 h SER 81 N 0.00 0.00 -0.52 1.67 0.02 -1.68 -2.85 113.55 110.19 1x02 h SER 81 Ca 0.48 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 61.51 1x02 h SER 81 Cb 2.86 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 65.32 1x02 h SER 81 CO -0.01 0.00 -0.20 1.21 -1.14 0.00 0.00 176.83 176.69 1x02 n GLU 82 N -2.63 -0.12 0.01 3.45 2.13 0.11 0.18 120.64 123.77 1x02 n GLU 82 Ca -0.01 0.81 -0.10 0.00 0.66 0.00 0.00 57.16 58.52 1x02 n GLU 82 Cb 0.65 -1.20 -0.03 0.00 0.27 0.00 0.00 31.44 31.14 1x02 n GLU 82 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1x02 h GLU 83 N 0.00 -0.28 -0.96 5.31 5.08 -1.80 -0.10 114.58 121.83 1x02 h GLU 83 Ca 0.18 0.02 0.28 0.00 -1.00 0.00 0.00 59.36 58.84 1x02 h GLU 83 Cb 0.32 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1x02 h GLU 83 CO -0.52 -0.19 1.16 0.93 -1.00 0.00 0.00 179.01 179.39 1x02 h GLU 84 N -0.29 0.00 0.04 2.33 4.39 0.16 0.67 114.58 121.87 1x02 h GLU 84 Ca 0.09 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.57 1x02 h GLU 84 Cb 0.43 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 1x02 h GLU 84 CO -0.27 0.00 -1.16 0.82 -1.16 0.00 0.00 179.01 177.23 1x02 h ILE 85 N 0.00 1.05 -0.85 3.13 2.04 -0.88 -3.39 117.51 118.62 1x02 h ILE 85 Ca 0.46 -2.27 0.09 0.00 1.00 0.00 0.00 64.86 64.14 1x02 h ILE 85 Cb 2.78 2.54 -0.11 0.00 -0.74 0.00 0.00 36.82 41.28 1x02 h ILE 85 CO -0.00 0.50 -0.46 0.54 0.00 0.00 0.00 178.15 178.72 1x02 n ARG 86 N -4.26 -0.34 -0.29 2.37 3.00 0.23 0.68 116.66 118.05 1x02 n ARG 86 Ca -0.27 1.29 0.05 0.00 -0.01 0.00 0.00 57.85 58.91 1x02 n ARG 86 Cb 0.73 -1.90 0.14 0.00 0.00 0.00 0.00 32.46 31.43 1x02 n ARG 86 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1x02 h GLU 87 N 0.00 0.02 -0.45 5.56 4.39 -1.73 0.28 114.58 122.66 1x02 h GLU 87 Ca 0.17 -0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.89 1x02 h GLU 87 Cb 0.38 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 1x02 h GLU 87 CO -0.81 0.01 0.26 0.00 -1.16 0.00 0.00 179.01 177.32 1x02 h ALA 88 N 1.83 0.57 -0.94 3.43 0.00 0.06 -1.72 119.26 122.48 1x02 h ALA 88 Ca 0.43 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.44 1x02 h ALA 88 Cb 0.70 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.30 1x02 h ALA 88 CO -0.83 -0.05 0.60 0.35 0.00 0.00 0.00 179.25 179.32 1x02 h PHE 89 N 0.53 1.03 -0.02 0.00 3.57 0.50 -2.28 116.94 120.26 1x02 h PHE 89 Ca 0.18 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 1x02 h PHE 89 Cb 0.02 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 38.43 1x02 h PHE 89 CO -0.07 0.44 -0.01 0.00 -2.23 0.00 0.00 178.31 176.44 1x02 h ARG 90 N 0.92 0.04 -0.95 1.11 3.08 -0.61 -3.05 114.38 114.92 1x02 h ARG 90 Ca 0.45 -0.02 0.17 0.00 0.07 0.00 0.00 59.98 60.66 1x02 h ARG 90 Cb 0.47 -0.00 -0.17 0.00 0.08 0.00 0.00 29.97 30.35 1x02 h ARG 90 CO -0.22 0.43 -0.29 0.28 -1.07 0.00 0.00 179.97 179.10 1x02 n VAL 91 N -4.87 -0.44 -0.18 2.04 0.31 -0.71 0.75 118.33 115.24 1x02 n VAL 91 Ca -0.08 2.19 -0.07 0.00 -0.01 0.00 0.00 64.34 66.37 1x02 n VAL 91 Cb 0.22 -2.98 0.02 0.00 -0.91 0.00 0.00 33.84 30.19 1x02 n VAL 91 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1x02 h PHE 92 N 0.00 0.71 -0.25 3.52 0.04 -1.55 -3.36 116.94 116.04 1x02 h PHE 92 Ca 0.40 -0.02 -0.09 0.00 2.80 0.00 0.00 57.97 61.06 1x02 h PHE 92 Cb 0.64 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.55 1x02 h PHE 92 CO -0.77 0.53 0.28 0.34 -0.60 0.00 0.00 178.31 178.08 1x02 s ASP 93 N -5.82 3.89 0.08 2.17 2.15 0.23 -4.41 116.67 114.95 1x02 s ASP 93 Ca -0.13 -0.91 -0.21 0.00 0.43 0.00 0.00 52.55 51.73 1x02 s ASP 93 Cb 0.12 -2.59 -0.07 0.00 -0.30 0.00 0.00 42.92 40.08 1x02 s ASP 93 CO 0.76 -4.21 1.35 0.11 -0.17 0.00 0.00 175.17 173.01 1x02 h LYS 94 N 11.44 -0.26 -0.58 4.34 1.57 -1.75 -0.96 116.57 130.37 1x02 h LYS 94 Ca 0.05 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1x02 h LYS 94 Cb 0.99 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.33 1x02 h LYS 94 CO 1.06 -0.17 0.26 0.38 -0.57 0.00 0.00 179.45 180.41 1x02 h ASP 95 N -0.26 0.75 -1.12 0.86 3.04 -1.93 -3.47 116.42 114.29 1x02 h ASP 95 Ca 0.04 -0.08 0.00 0.00 -3.24 0.00 0.00 57.03 53.75 1x02 h ASP 95 Cb 0.38 -0.19 0.00 0.00 -1.04 0.00 0.00 39.33 38.48 1x02 h ASP 95 CO -0.37 0.66 0.00 0.61 -2.04 0.00 0.00 179.24 178.10 1x02 n GLY 96 N -1.11 0.85 0.13 7.15 0.00 -0.37 -5.00 105.19 106.85 1x02 n GLY 96 Ca 0.05 -0.59 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 1x02 n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1x02 n ASN 97 N 0.88 1.97 0.00 1.61 6.94 -1.26 -5.04 115.26 120.36 1x02 n ASN 97 Ca 0.00 0.12 0.00 0.00 -0.02 0.00 0.00 54.58 54.68 1x02 n ASN 97 Cb 0.46 -0.63 0.00 0.00 -2.36 0.00 0.00 39.78 37.24 1x02 n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1x02 n GLY 98 N 1.72 1.93 3.89 4.83 0.00 -1.26 -5.14 105.19 111.16 1x02 n GLY 98 Ca -0.50 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 1x02 n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x02 s TYR 99 N 0.00 3.57 -0.42 1.61 1.51 -1.26 -3.45 117.35 118.90 1x02 s TYR 99 Ca 0.00 0.56 -0.04 0.00 -1.01 0.00 0.00 57.07 56.58 1x02 s TYR 99 Cb 0.00 -1.98 0.11 0.00 -0.11 0.00 0.00 41.96 39.98 1x02 s TYR 99 CO 0.00 0.60 0.22 0.42 -1.11 0.00 0.00 175.55 175.68 1x02 s ILE 100 N -1.34 3.41 0.83 2.71 1.01 -1.08 -4.85 121.20 121.89 1x02 s ILE 100 Ca 0.29 -2.03 -0.10 0.00 0.00 0.00 0.00 60.65 58.81 1x02 s ILE 100 Cb -0.13 -3.33 0.09 0.00 0.01 0.00 0.00 42.46 39.10 1x02 s ILE 100 CO 0.17 -0.70 1.11 -0.94 0.00 0.00 0.00 174.94 174.58 1x02 s SER 101 N 1.94 3.92 0.21 3.58 1.04 -1.26 0.34 113.70 123.46 1x02 s SER 101 Ca 0.08 1.91 -0.09 0.00 0.48 0.00 0.00 55.95 58.33 1x02 s SER 101 Cb -0.23 -2.51 0.27 0.00 0.10 0.00 0.00 66.02 63.64 1x02 s SER 101 CO -0.04 -2.43 1.78 0.00 0.98 0.00 0.00 173.24 173.54 1x02 h ALA 102 N -1.40 0.88 -0.12 5.32 0.00 -1.87 -2.25 119.26 119.82 1x02 h ALA 102 Ca -0.44 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1x02 h ALA 102 Cb 1.25 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1x02 h ALA 102 CO 0.49 -0.04 0.04 0.00 0.00 0.00 0.00 179.25 179.74 1x02 h ALA 103 N 1.38 0.15 -0.04 0.00 0.00 -1.91 0.18 119.26 119.01 1x02 h ALA 103 Ca 0.31 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1x02 h ALA 103 Cb 0.28 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1x02 h ALA 103 CO -0.23 -0.25 -0.40 0.93 0.00 0.00 0.00 179.25 179.30 1x02 h GLU 104 N 0.03 -0.45 -0.49 0.00 5.08 -1.81 -1.55 114.58 115.39 1x02 h GLU 104 Ca 0.04 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1x02 h GLU 104 Cb 0.18 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1x02 h GLU 104 CO -0.00 -0.30 0.26 1.25 -1.00 0.00 0.00 179.01 179.22 1x02 h LEU 105 N -0.47 0.62 -0.82 1.33 6.46 -1.45 -2.98 115.31 118.00 1x02 h LEU 105 Ca 0.01 -0.10 0.14 0.00 -0.12 0.00 0.00 57.88 57.82 1x02 h LEU 105 Cb 0.52 -0.16 -0.15 0.00 -0.73 0.00 0.00 40.66 40.14 1x02 h LEU 105 CO -0.29 0.54 -0.32 -0.09 -0.62 0.00 0.00 178.44 177.66 1x02 h ARG 106 N 0.65 -0.05 -0.76 1.25 2.43 -0.17 0.44 114.38 118.16 1x02 h ARG 106 Ca 0.17 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.42 1x02 h ARG 106 Cb 0.07 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.57 1x02 h ARG 106 CO -0.03 -0.03 0.44 1.25 -1.51 0.00 0.00 179.97 180.08 1x02 h HIS 107 N -0.05 0.80 0.06 2.20 2.76 -1.14 -1.75 115.15 118.02 1x02 h HIS 107 Ca 0.33 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.54 1x02 h HIS 107 Cb 0.59 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.28 1x02 h HIS 107 CO -0.74 0.37 -0.13 0.28 -1.30 0.00 0.00 177.93 176.41 1x02 h VAL 108 N 0.78 0.69 0.16 5.26 2.07 -0.15 -2.99 116.25 122.07 1x02 h VAL 108 Ca 0.35 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.88 1x02 h VAL 108 Cb 0.24 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1x02 h VAL 108 CO -0.20 0.00 -0.29 0.24 0.02 0.00 0.00 177.57 177.34 1x02 h MET 109 N -0.25 -0.51 -0.87 1.57 2.07 -0.74 -2.68 114.93 113.52 1x02 h MET 109 Ca 0.03 0.03 0.15 0.00 -2.07 0.00 0.00 59.70 57.84 1x02 h MET 109 Cb 0.28 0.12 -0.15 0.00 -1.87 0.00 0.00 31.60 29.97 1x02 h MET 109 CO -0.08 -0.34 -0.28 2.41 1.07 0.00 0.00 176.91 179.68 1x02 n THR 110 N -5.40 -0.41 -0.30 2.22 -1.04 -0.70 0.10 114.28 108.75 1x02 n THR 110 Ca -0.07 2.02 0.10 0.00 -2.04 0.00 0.00 64.05 64.05 1x02 n THR 110 Cb 0.31 -2.72 0.23 0.00 -1.82 0.00 0.00 70.33 66.32 1x02 n THR 110 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1x02 h ASN 111 N 0.00 -0.35 -0.74 8.00 2.35 -1.34 0.12 115.58 123.62 1x02 h ASN 111 Ca 0.36 0.23 0.26 0.00 -0.55 0.00 0.00 56.30 56.60 1x02 h ASN 111 Cb 0.57 0.39 -0.14 0.00 0.05 0.00 0.00 38.32 39.20 1x02 h ASN 111 CO -0.88 -0.24 0.22 0.18 -1.65 0.00 0.00 177.43 175.06 1x02 n LEU 112 N -5.38 0.10 0.00 1.61 4.77 0.28 -4.74 117.00 113.63 1x02 n LEU 112 Ca 0.18 1.24 0.00 0.00 -0.03 0.00 0.00 56.01 57.40 1x02 n LEU 112 Cb 0.61 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1x02 n LEU 112 CO 0.00 -1.33 0.00 0.61 -1.33 0.00 0.00 177.39 175.35 1x02 n GLY 113 N -1.28 3.82 3.78 -0.72 0.00 0.40 -5.13 105.19 106.07 1x02 n GLY 113 Ca 0.23 -0.56 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 1x02 n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x02 s GLU 114 N 0.00 4.26 -0.50 1.61 0.41 -1.25 -5.00 118.70 118.23 1x02 s GLU 114 Ca 0.00 1.45 -0.23 0.00 -0.41 0.00 0.00 54.97 55.79 1x02 s GLU 114 Cb 0.00 -2.58 0.04 0.00 -1.78 0.00 0.00 34.13 29.81 1x02 s GLU 114 CO 0.00 -0.04 0.81 0.15 -0.49 0.00 0.00 175.26 175.69 1x02 s LYS 115 N -2.44 3.31 0.11 1.61 1.02 -1.26 -4.39 119.74 117.70 1x02 s LYS 115 Ca 0.56 -0.34 0.07 0.00 0.02 0.00 0.00 55.97 56.28 1x02 s LYS 115 Cb -0.21 -4.02 -0.04 0.00 -0.52 0.00 0.00 37.83 33.05 1x02 s LYS 115 CO 0.26 -1.29 -0.09 -0.51 -0.92 0.00 0.00 175.35 172.81 1x02 s LEU 116 N 3.41 3.09 0.28 3.17 1.43 -1.26 -5.08 118.68 123.73 1x02 s LEU 116 Ca 0.27 -0.37 0.06 0.00 -1.03 0.00 0.00 54.13 53.06 1x02 s LEU 116 Cb -0.14 -1.87 -0.06 0.00 0.03 0.00 0.00 46.19 44.15 1x02 s LEU 116 CO 0.19 0.17 -0.05 0.42 0.23 0.00 0.00 176.35 177.31 1x02 s THR 117 N -1.26 1.60 0.52 5.49 -4.23 -1.26 -4.94 115.64 111.56 1x02 s THR 117 Ca 0.22 -2.11 0.46 0.00 -1.18 0.00 0.00 61.69 59.09 1x02 s THR 117 Cb -0.11 -2.48 0.69 0.00 1.34 0.00 0.00 72.50 71.94 1x02 s THR 117 CO 0.14 -0.27 1.52 -0.67 -0.54 0.00 0.00 174.62 174.80 1x02 n ASP 118 N -0.59 0.03 0.10 3.99 -0.08 -1.26 0.73 116.55 119.47 1x02 n ASP 118 Ca -0.05 1.03 -0.13 0.00 -1.51 0.00 0.00 54.79 54.13 1x02 n ASP 118 Cb 0.64 -0.51 -0.08 0.00 2.34 0.00 0.00 41.12 43.50 1x02 n ASP 118 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1x02 h GLU 119 N 0.00 -0.27 -0.09 -0.67 4.39 -1.98 0.10 114.58 116.06 1x02 h GLU 119 Ca 0.91 0.02 0.03 0.00 0.34 0.00 0.00 59.36 60.66 1x02 h GLU 119 Cb 3.54 0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 32.21 1x02 h GLU 119 CO -0.08 0.09 -0.14 0.93 -1.16 0.00 0.00 179.01 178.65 1x02 h GLU 120 N -0.71 -0.18 -0.61 2.33 4.39 -0.07 -2.47 114.58 117.26 1x02 h GLU 120 Ca -0.03 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 1x02 h GLU 120 Cb 0.49 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.15 1x02 h GLU 120 CO 0.05 -0.12 0.23 0.28 -1.16 0.00 0.00 179.01 178.28 1x02 h VAL 121 N -0.19 1.23 -0.86 3.13 2.07 -1.45 -2.90 116.25 117.28 1x02 h VAL 121 Ca 0.08 -0.76 0.22 0.00 0.82 0.00 0.00 66.70 67.06 1x02 h VAL 121 Cb 0.30 0.59 -0.14 0.00 -1.52 0.00 0.00 31.29 30.51 1x02 h VAL 121 CO -0.20 0.29 0.15 0.44 0.02 0.00 0.00 177.57 178.27 1x02 h ASP 122 N 0.85 -0.15 -0.24 0.57 3.32 -0.32 0.99 116.42 121.43 1x02 h ASP 122 Ca 0.20 0.21 0.01 0.00 0.02 0.00 0.00 57.03 57.47 1x02 h ASP 122 Cb 0.23 0.31 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 1x02 h ASP 122 CO -0.01 -0.19 0.16 -0.33 -1.72 0.00 0.00 179.24 177.15 1x02 h GLU 123 N 0.15 0.27 0.00 3.56 4.39 -1.28 -1.79 114.58 119.88 1x02 h GLU 123 Ca 0.52 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 60.18 1x02 h GLU 123 Cb 1.03 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 1x02 h GLU 123 CO -0.69 0.18 -0.11 1.98 -1.16 0.00 0.00 179.01 179.21 1x02 h MET 124 N 0.28 0.07 -0.72 2.33 4.05 0.86 -3.27 114.93 118.53 1x02 h MET 124 Ca 0.09 -0.08 0.14 0.00 -0.28 0.00 0.00 59.70 59.57 1x02 h MET 124 Cb 0.03 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 30.81 1x02 h MET 124 CO -0.02 0.88 0.48 0.82 0.23 0.00 0.00 176.91 179.30 1x02 h ILE 125 N -0.70 0.81 -0.02 1.77 1.08 -0.67 0.36 117.51 120.14 1x02 h ILE 125 Ca -0.02 -0.14 0.00 0.00 -0.39 0.00 0.00 64.86 64.32 1x02 h ILE 125 Cb 0.92 0.38 0.00 0.00 -3.07 0.00 0.00 36.82 35.05 1x02 h ILE 125 CO 0.02 0.07 0.00 -2.11 -0.69 0.00 0.00 178.15 175.44 1x02 n ARG 126 N -4.47 1.07 -0.02 2.37 1.85 -0.70 -0.65 116.66 116.11 1x02 n ARG 126 Ca 0.13 -0.07 -0.02 0.00 -1.00 0.00 0.00 57.85 56.88 1x02 n ARG 126 Cb 0.50 -1.28 -0.02 0.00 -1.05 0.00 0.00 32.46 30.61 1x02 n ARG 126 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1x02 n GLU 127 N -0.20 1.60 -0.07 2.89 2.13 0.13 -4.82 120.64 122.29 1x02 n GLU 127 Ca 0.01 0.01 -0.08 0.00 0.66 0.00 0.00 57.16 57.75 1x02 n GLU 127 Cb 0.15 -1.08 -0.09 0.00 0.27 0.00 0.00 31.44 30.69 1x02 n GLU 127 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1x02 n ALA 128 N -2.40 1.68 -1.53 4.31 0.00 -1.12 -4.91 120.51 116.54 1x02 n ALA 128 Ca -0.06 -0.75 -0.38 0.00 0.00 0.00 0.00 53.44 52.24 1x02 n ALA 128 Cb 0.59 0.06 -0.07 0.00 0.00 0.00 0.00 19.45 20.03 1x02 n ALA 128 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1x02 n ASP 129 N -2.70 1.66 -0.05 0.00 2.03 0.17 -4.72 116.55 112.94 1x02 n ASP 129 Ca -0.24 -0.24 -0.01 0.00 0.52 0.00 0.00 54.79 54.83 1x02 n ASP 129 Cb 0.85 -1.36 -0.00 0.00 -0.72 0.00 0.00 41.12 39.89 1x02 n ASP 129 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1x02 h ILE 130 N 7.77 0.00 -0.69 5.18 1.08 -1.86 -3.36 117.51 125.62 1x02 h ILE 130 Ca -0.18 -1.00 0.14 0.00 -0.39 0.00 0.00 64.86 63.43 1x02 h ILE 130 Cb 1.29 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.93 1x02 h ILE 130 CO 1.23 0.00 0.14 -2.24 -0.69 0.00 0.00 178.15 176.59 1x02 h ASP 131 N -1.00 -0.03 -0.25 1.72 3.04 -1.91 -3.46 116.42 114.53 1x02 h ASP 131 Ca 0.00 0.14 0.00 0.00 -3.24 0.00 0.00 57.03 53.93 1x02 h ASP 131 Cb 0.07 0.20 0.00 0.00 -1.04 0.00 0.00 39.33 38.55 1x02 h ASP 131 CO 0.00 -0.04 0.00 0.61 -2.04 0.00 0.00 179.24 177.77 1x02 n GLY 132 N -1.35 0.78 0.04 7.15 0.00 -1.26 -5.02 105.19 105.53 1x02 n GLY 132 Ca 0.12 -0.10 0.04 0.00 0.00 0.00 0.00 46.02 46.08 1x02 n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1x02 n ASP 133 N 0.08 2.03 -0.71 1.61 5.68 -1.26 -4.97 116.55 119.00 1x02 n ASP 133 Ca 0.00 -2.38 -0.07 0.00 -0.50 0.00 0.00 54.79 51.85 1x02 n ASP 133 Cb 0.09 -0.17 -0.01 0.00 -1.14 0.00 0.00 41.12 39.89 1x02 n ASP 133 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x02 n GLY 134 N -0.83 0.23 3.25 6.12 0.00 -1.26 -5.01 105.19 107.69 1x02 n GLY 134 Ca 0.06 -0.63 -0.14 0.00 0.00 0.00 0.00 46.02 45.31 1x02 n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x02 s GLN 135 N -4.04 1.07 -0.43 1.61 -0.21 -1.26 -2.40 119.66 114.00 1x02 s GLN 135 Ca 0.00 -1.47 0.02 0.00 0.02 0.00 0.00 55.36 53.93 1x02 s GLN 135 Cb 0.00 -0.55 0.15 0.00 1.00 0.00 0.00 33.01 33.61 1x02 s GLN 135 CO 0.00 0.03 0.28 0.08 -2.12 0.00 0.00 175.29 173.56 1x02 s VAL 136 N -3.39 0.84 1.07 1.09 1.01 0.15 -4.35 120.40 116.83 1x02 s VAL 136 Ca 0.18 -2.47 -0.18 0.00 0.00 0.00 0.00 61.98 59.51 1x02 s VAL 136 Cb 0.03 -1.59 0.27 0.00 0.00 0.00 0.00 36.38 35.09 1x02 s VAL 136 CO 0.01 -1.03 0.91 -0.46 0.00 0.00 0.00 175.10 174.53 1x02 n ASN 137 N 3.36 -2.16 0.00 3.32 6.94 -1.26 -2.63 115.26 122.84 1x02 n ASN 137 Ca 0.17 -1.03 -0.10 0.00 -0.02 0.00 0.00 54.58 53.59 1x02 n ASN 137 Cb 0.39 -0.86 -0.03 0.00 -2.36 0.00 0.00 39.78 36.92 1x02 n ASN 137 CO 0.00 0.00 0.00 0.22 -1.03 0.00 0.00 177.26 176.45 1x02 h TYR 138 N -2.65 -0.67 0.51 -2.53 3.20 -1.94 0.15 116.97 113.04 1x02 h TYR 138 Ca -0.35 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.54 1x02 h TYR 138 Cb 1.08 0.31 -0.02 0.00 1.54 0.00 0.00 36.73 39.64 1x02 h TYR 138 CO 0.00 -0.33 -0.45 1.49 -1.64 0.00 0.00 178.16 177.23 1x02 h GLU 139 N -0.32 -0.92 -0.61 1.82 4.81 -1.92 0.33 114.58 117.77 1x02 h GLU 139 Ca 0.10 0.06 0.18 0.00 -0.13 0.00 0.00 59.36 59.57 1x02 h GLU 139 Cb 0.47 0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 1x02 h GLU 139 CO -0.31 -0.61 0.47 0.93 -0.73 0.00 0.00 179.01 178.76 1x02 h GLU 140 N -0.95 0.00 0.12 1.92 5.08 -1.79 -0.25 114.58 118.70 1x02 h GLU 140 Ca -0.06 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.08 1x02 h GLU 140 Cb 0.82 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.09 1x02 h GLU 140 CO -0.03 0.00 -0.93 0.35 -1.00 0.00 0.00 179.01 177.40 1x02 h PHE 141 N 0.00 0.71 -0.35 4.33 3.57 0.32 -3.26 116.94 122.26 1x02 h PHE 141 Ca 0.29 -0.47 0.02 0.00 3.53 0.00 0.00 57.97 61.34 1x02 h PHE 141 Cb 1.23 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.90 1x02 h PHE 141 CO 0.00 1.34 0.19 0.28 -2.23 0.00 0.00 178.31 177.89 1x02 h VAL 142 N -0.11 1.01 -0.34 1.41 2.07 0.13 -2.79 116.25 117.63 1x02 h VAL 142 Ca -0.15 -0.13 0.08 0.00 0.82 0.00 0.00 66.70 67.31 1x02 h VAL 142 Cb 1.68 0.59 -0.08 0.00 -1.52 0.00 0.00 31.29 31.96 1x02 h VAL 142 CO 0.18 0.07 -0.20 1.56 0.02 0.00 0.00 177.57 179.20 1x02 h GLN 143 N 0.39 -0.14 -0.37 1.57 1.08 -1.41 -1.78 115.11 114.46 1x02 h GLN 143 Ca 0.14 0.01 0.08 0.00 -1.45 0.00 0.00 58.65 57.43 1x02 h GLN 143 Cb 0.03 0.03 -0.08 0.00 -0.05 0.00 0.00 27.48 27.41 1x02 h GLN 143 CO -0.08 -0.10 -0.20 1.98 -0.95 0.00 0.00 178.83 179.49 1x02 h MET 144 N -0.15 -0.14 -0.86 1.46 4.05 -1.54 -0.02 114.93 117.73 1x02 h MET 144 Ca 0.17 0.01 0.15 0.00 -0.28 0.00 0.00 59.70 59.75 1x02 h MET 144 Cb 0.41 0.03 -0.09 0.00 -0.80 0.00 0.00 31.60 31.15 1x02 h MET 144 CO -0.43 -0.09 0.45 0.52 0.23 0.00 0.00 176.91 177.59 1x02 h MET 145 N -0.14 0.62 -0.99 0.39 2.86 -1.12 -0.68 114.93 115.87 1x02 h MET 145 Ca 0.18 -0.04 -0.66 0.00 -2.06 0.00 0.00 59.70 57.12 1x02 h MET 145 Cb 0.42 -0.14 -0.31 0.00 0.06 0.00 0.00 31.60 31.63 1x02 h MET 145 CO -0.45 0.41 0.62 0.25 1.06 0.00 0.00 176.91 178.79 1x02 n THR 146 N -4.86 3.47 -3.19 2.22 -2.24 -0.23 -4.87 114.28 104.57 1x02 n THR 146 Ca 0.17 -3.16 -0.45 0.00 -2.27 0.00 0.00 64.05 58.34 1x02 n THR 146 Cb 0.44 -1.16 -0.01 0.00 -2.10 0.00 0.00 70.33 67.50 1x02 n THR 146 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x02 s ALA 147 N -3.80 4.23 -2.00 6.98 0.00 -0.19 -4.95 121.76 122.04 1x02 s ALA 147 Ca 0.63 -3.47 0.09 0.00 0.00 0.00 0.00 51.96 49.21 1x02 s ALA 147 Cb 0.49 -3.75 0.56 0.00 0.00 0.00 0.00 23.12 20.42 1x02 s ALA 147 CO -0.01 -2.46 1.00 1.63 0.00 0.00 0.00 175.76 175.92