#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jzi n ASP 2 N 0.00 -0.74 -3.93 0.00 8.00 -1.26 -5.03 116.55 113.60 2jzi n ASP 2 Ca 0.00 -0.65 -0.30 0.00 0.71 0.00 0.00 54.79 54.55 2jzi n ASP 2 Cb 0.00 -0.02 -0.14 0.00 -0.02 0.00 0.00 41.12 40.94 2jzi n ASP 2 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2jzi s GLN 3 N -3.05 1.93 0.34 -1.24 0.74 -1.26 -5.05 119.66 112.07 2jzi s GLN 3 Ca 0.01 -2.59 0.06 0.00 0.05 0.00 0.00 55.36 52.89 2jzi s GLN 3 Cb -0.00 -3.23 -0.01 0.00 1.10 0.00 0.00 33.01 30.86 2jzi s GLN 3 CO 0.01 -1.12 0.48 -0.51 -0.55 0.00 0.00 175.29 173.60 2jzi s LEU 4 N -0.27 3.98 0.34 3.68 1.43 -1.26 -5.12 118.68 121.45 2jzi s LEU 4 Ca 0.17 -0.14 0.03 0.00 -1.03 0.00 0.00 54.13 53.17 2jzi s LEU 4 Cb -0.25 -2.79 -0.02 0.00 0.03 0.00 0.00 46.19 43.16 2jzi s LEU 4 CO -0.00 -0.42 0.50 0.42 0.23 0.00 0.00 176.35 177.08 2jzi s THR 5 N -2.19 4.71 0.19 5.49 -4.23 -1.26 -4.84 115.64 113.52 2jzi s THR 5 Ca 0.44 -0.73 -0.17 0.00 -1.18 0.00 0.00 61.69 60.06 2jzi s THR 5 Cb -0.10 -3.69 0.17 0.00 1.34 0.00 0.00 72.50 70.22 2jzi s THR 5 CO 0.31 -0.37 1.61 -0.08 -0.54 0.00 0.00 174.62 175.56 2jzi h GLU 6 N 0.82 -0.09 0.00 3.99 4.81 -1.99 1.01 114.58 123.13 2jzi h GLU 6 Ca -0.49 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.71 2jzi h GLU 6 Cb 1.24 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 2jzi h GLU 6 CO 0.59 -0.06 -0.17 0.93 -0.73 0.00 0.00 179.01 179.57 2jzi h GLU 7 N -0.09 0.00 0.06 1.92 4.39 -1.98 0.40 114.58 119.28 2jzi h GLU 7 Ca 0.26 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.95 2jzi h GLU 7 Cb 0.49 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 2jzi h GLU 7 CO -0.62 0.17 -0.03 1.96 -1.16 0.00 0.00 179.01 179.33 2jzi h GLN 8 N 0.00 -0.08 0.00 2.33 1.08 0.13 -3.28 115.11 115.29 2jzi h GLN 8 Ca -0.00 0.01 -0.12 0.00 -1.45 0.00 0.00 58.65 57.09 2jzi h GLN 8 Cb 0.35 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.78 2jzi h GLN 8 CO 0.02 0.46 -0.56 -0.84 -0.95 0.00 0.00 178.83 176.96 2jzi h ILE 9 N -0.69 1.28 -0.64 2.54 3.07 0.89 -2.88 117.51 121.08 2jzi h ILE 9 Ca -0.01 -2.00 0.19 0.00 1.55 0.00 0.00 64.86 64.58 2jzi h ILE 9 Cb 0.58 2.12 -0.03 0.00 -0.27 0.00 0.00 36.82 39.22 2jzi h ILE 9 CO 0.01 0.55 0.58 0.00 -1.05 0.00 0.00 178.15 178.24 2jzi h ALA 10 N 1.44 2.46 0.00 0.16 0.00 -0.26 1.72 119.26 124.78 2jzi h ALA 10 Ca -0.01 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 2jzi h ALA 10 Cb 1.07 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 2jzi h ALA 10 CO 0.07 -0.91 -0.64 0.93 0.00 0.00 0.00 179.25 178.70 2jzi h GLU 11 N 0.00 0.00 0.02 0.00 5.08 -1.61 -2.89 114.58 115.18 2jzi h GLU 11 Ca 0.30 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.66 2jzi h GLU 11 Cb 1.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.71 2jzi h GLU 11 CO -0.00 0.64 -0.01 0.74 -1.00 0.00 0.00 179.01 179.38 2jzi h PHE 12 N 0.00 -0.03 -0.13 4.33 -1.00 0.24 -3.20 116.94 117.15 2jzi h PHE 12 Ca -0.01 -0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.81 2jzi h PHE 12 Cb 1.26 0.01 -0.01 0.00 3.61 0.00 0.00 35.95 40.82 2jzi h PHE 12 CO 0.00 0.13 0.29 1.57 -1.61 0.00 0.00 178.31 178.69 2jzi h LYS 13 N -1.00 0.00 0.00 1.51 2.10 -1.23 1.31 116.57 119.26 2jzi h LYS 13 Ca -0.00 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.51 2jzi h LYS 13 Cb 0.17 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.48 2jzi h LYS 13 CO 0.01 0.00 -0.66 1.05 -2.00 0.00 0.00 179.45 177.84 2jzi h GLU 14 N 0.00 0.00 -0.09 0.07 4.11 -1.60 -1.96 114.58 115.11 2jzi h GLU 14 Ca 0.06 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.25 2jzi h GLU 14 Cb 0.65 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.91 2jzi h GLU 14 CO -0.00 0.66 -0.89 0.00 0.07 0.00 0.00 179.01 178.85 2jzi h ALA 15 N 1.34 0.24 0.10 1.06 0.00 0.16 0.48 119.26 122.64 2jzi h ALA 15 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2jzi h ALA 15 Cb 1.34 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 2jzi h ALA 15 CO 0.09 0.69 -0.10 0.74 0.00 0.00 0.00 179.25 180.66 2jzi h PHE 16 N 0.48 -0.26 0.00 0.00 0.04 -0.98 0.37 116.94 116.59 2jzi h PHE 16 Ca -0.08 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.62 2jzi h PHE 16 Cb 1.53 0.10 -0.01 0.00 2.20 0.00 0.00 35.95 39.77 2jzi h PHE 16 CO 0.09 -0.16 -0.32 0.66 -0.60 0.00 0.00 178.31 177.98 2jzi h SER 17 N -0.23 0.00 1.36 2.17 4.64 -1.37 -2.78 113.55 117.34 2jzi h SER 17 Ca 0.01 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.22 2jzi h SER 17 Cb 0.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.29 2jzi h SER 17 CO -0.03 0.32 -0.66 0.25 -0.87 0.00 0.00 176.83 175.84 2jzi h LEU 18 N 0.00 0.00 -1.04 5.97 6.46 0.41 -3.21 115.31 123.90 2jzi h LEU 18 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2jzi h LEU 18 Cb 0.97 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.90 2jzi h LEU 18 CO 0.04 0.49 -0.11 0.33 -0.62 0.00 0.00 178.44 178.57 2jzi n PHE 19 N -3.15 0.00 -4.06 1.25 7.35 0.13 -4.43 117.46 114.55 2jzi n PHE 19 Ca -0.00 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.35 2jzi n PHE 19 Cb 0.74 -0.03 -0.07 0.00 0.35 0.00 0.00 39.48 40.48 2jzi n PHE 19 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2jzi s ASP 20 N -2.17 5.87 0.08 -2.13 2.15 -1.06 -4.88 116.67 114.53 2jzi s ASP 20 Ca 0.31 0.25 -0.28 0.00 0.43 0.00 0.00 52.55 53.25 2jzi s ASP 20 Cb 0.20 -1.76 -0.17 0.00 -0.30 0.00 0.00 42.92 40.89 2jzi s ASP 20 CO 0.40 0.31 1.67 0.11 -0.17 0.00 0.00 175.17 177.49 2jzi h LYS 21 N 4.39 -0.45 -0.00 4.34 1.79 -1.86 -2.59 116.57 122.18 2jzi h LYS 21 Ca -0.51 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 2jzi h LYS 21 Cb 1.19 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.95 2jzi h LYS 21 CO 0.61 -0.30 -0.15 -0.40 -1.08 0.00 0.00 179.45 178.14 2jzi n ASP 22 N -5.29 0.44 -3.88 0.86 5.75 -1.26 -4.94 116.55 108.23 2jzi n ASP 22 Ca -0.10 -0.43 -0.26 0.00 -0.01 0.00 0.00 54.79 53.99 2jzi n ASP 22 Cb 0.21 -0.08 0.01 0.00 -1.03 0.00 0.00 41.12 40.23 2jzi n ASP 22 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jzi n GLY 23 N 1.33 -0.33 1.22 6.12 0.00 -0.98 -4.85 105.19 107.70 2jzi n GLY 23 Ca 0.12 0.15 0.04 0.00 0.00 0.00 0.00 46.02 46.34 2jzi n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jzi n ASP 24 N -2.94 3.49 0.00 1.61 5.68 -1.26 -4.84 116.55 118.29 2jzi n ASP 24 Ca -0.18 -2.45 0.00 0.00 -0.50 0.00 0.00 54.79 51.65 2jzi n ASP 24 Cb 0.63 -0.56 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 2jzi n ASP 24 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jzi n GLY 25 N 0.48 0.74 3.26 6.12 0.00 -1.26 -4.97 105.19 109.56 2jzi n GLY 25 Ca 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 2jzi n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jzi s THR 26 N -2.78 0.05 -0.10 2.61 -4.23 -1.26 -4.26 115.64 105.68 2jzi s THR 26 Ca 0.00 -0.45 -0.05 0.00 -1.18 0.00 0.00 61.69 60.01 2jzi s THR 26 Cb 0.00 -0.64 -0.04 0.00 1.34 0.00 0.00 72.50 73.16 2jzi s THR 26 CO 0.00 -0.25 0.10 -0.63 -0.54 0.00 0.00 174.62 173.31 2jzi s ILE 27 N -1.34 5.16 0.83 2.99 1.01 -1.26 -4.63 121.20 123.96 2jzi s ILE 27 Ca -0.13 0.05 -0.09 0.00 0.00 0.00 0.00 60.65 60.48 2jzi s ILE 27 Cb -0.05 -3.24 0.15 0.00 0.01 0.00 0.00 42.46 39.33 2jzi s ILE 27 CO 0.05 0.59 1.15 0.28 0.00 0.00 0.00 174.94 177.01 2jzi s THR 28 N -1.01 2.09 0.17 2.92 -1.32 -1.26 -2.94 115.64 114.29 2jzi s THR 28 Ca 0.15 -0.26 -0.06 0.00 -1.21 0.00 0.00 61.69 60.31 2jzi s THR 28 Cb -0.12 -2.83 -0.05 0.00 -1.51 0.00 0.00 72.50 68.00 2jzi s THR 28 CO 0.05 0.00 1.50 0.71 -2.21 0.00 0.00 174.62 174.66 2jzi h THR 29 N -1.05 1.29 -0.88 5.08 1.35 -1.73 -1.26 112.91 115.71 2jzi h THR 29 Ca -0.41 -1.67 0.01 0.00 -0.55 0.00 0.00 66.41 63.79 2jzi h THR 29 Cb 1.26 1.58 -0.04 0.00 -1.73 0.00 0.00 68.15 69.22 2jzi h THR 29 CO 0.43 0.54 0.59 0.07 -0.25 0.00 0.00 175.52 176.89 2jzi h LYS 30 N 0.58 1.16 0.21 4.72 5.09 -1.93 1.03 116.57 127.43 2jzi h LYS 30 Ca 0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 60.65 60.69 2jzi h LYS 30 Cb 1.03 -0.26 0.00 0.00 0.10 0.00 0.00 32.23 33.10 2jzi h LYS 30 CO 0.10 0.77 -0.10 0.93 -2.09 0.00 0.00 179.45 179.06 2jzi h GLU 31 N 1.20 -0.28 0.43 0.07 4.39 -1.90 0.46 114.58 118.95 2jzi h GLU 31 Ca 0.32 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 60.03 2jzi h GLU 31 Cb -0.14 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 2jzi h GLU 31 CO -0.07 0.09 -0.30 -0.07 -1.16 0.00 0.00 179.01 177.50 2jzi h LEU 32 N -0.73 -0.78 -0.53 1.33 3.38 -1.08 0.57 115.31 117.47 2jzi h LEU 32 Ca -0.03 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.05 2jzi h LEU 32 Cb 0.50 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 2jzi h LEU 32 CO 0.05 -0.46 0.25 1.23 0.09 0.00 0.00 178.44 179.59 2jzi h GLY 33 N -0.72 0.74 1.80 0.83 0.00 0.10 -1.02 103.07 104.81 2jzi h GLY 33 Ca -0.04 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 2jzi h GLY 33 CO 0.02 0.08 -0.03 -0.84 0.00 0.00 0.00 176.54 175.77 2jzi h THR 34 N 0.48 1.13 0.49 4.70 2.02 0.19 0.83 112.91 122.75 2jzi h THR 34 Ca 0.24 -0.53 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 2jzi h THR 34 Cb 0.19 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 2jzi h THR 34 CO -0.19 0.17 -0.24 0.58 0.37 0.00 0.00 175.52 176.22 2jzi h VAL 35 N 0.25 0.35 -0.18 3.16 2.07 0.35 0.62 116.25 122.88 2jzi h VAL 35 Ca 0.06 -0.46 -0.18 0.00 0.82 0.00 0.00 66.70 66.94 2jzi h VAL 35 Cb 0.23 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2jzi h VAL 35 CO 0.01 0.06 -0.61 -0.03 0.02 0.00 0.00 177.57 177.02 2jzi h MET 36 N -0.99 0.60 -0.54 1.57 -1.53 -1.17 -1.68 114.93 111.19 2jzi h MET 36 Ca -0.07 -0.41 -0.08 0.00 -3.44 0.00 0.00 59.70 55.70 2jzi h MET 36 Cb 0.60 0.06 -0.02 0.00 -0.55 0.00 0.00 31.60 31.69 2jzi h MET 36 CO 0.11 1.03 0.01 -0.09 0.14 0.00 0.00 176.91 178.11 2jzi h ARG 37 N 0.45 0.95 0.00 0.39 2.43 0.62 0.15 114.38 119.37 2jzi h ARG 37 Ca -0.00 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 2jzi h ARG 37 Cb 1.17 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 2jzi h ARG 37 CO 0.12 0.96 0.00 0.45 -1.51 0.00 0.00 179.97 179.98 2jzi n SER 38 N -4.28 0.00 -0.09 -3.80 2.88 0.21 -3.12 113.62 105.42 2jzi n SER 38 Ca 0.02 0.31 -0.15 0.00 -1.33 0.00 0.00 58.87 57.72 2jzi n SER 38 Cb 0.32 -0.44 -0.07 0.00 -0.75 0.00 0.00 64.21 63.28 2jzi n SER 38 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 2jzi n LEU 39 N -1.44 1.84 -1.04 2.46 0.00 -0.64 -4.93 117.00 113.27 2jzi n LEU 39 Ca 0.09 0.50 -0.01 0.00 0.00 0.00 0.00 56.01 56.60 2jzi n LEU 39 Cb 0.30 -0.92 0.00 0.00 0.00 0.00 0.00 43.42 42.80 2jzi n LEU 39 CO 0.25 -0.03 0.15 0.61 0.00 0.00 0.00 177.39 178.37 2jzi n GLY 40 N 1.50 -0.50 3.45 -3.96 0.00 -0.14 -5.08 105.19 100.45 2jzi n GLY 40 Ca -0.23 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.54 2jzi n GLY 40 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jzi s GLN 41 N 0.01 1.94 -0.44 1.61 2.00 -0.16 -4.97 119.66 119.65 2jzi s GLN 41 Ca 0.00 -2.18 0.07 0.00 -2.00 0.00 0.00 55.36 51.26 2jzi s GLN 41 Cb 0.02 -0.26 0.35 0.00 0.80 0.00 0.00 33.01 33.92 2jzi s GLN 41 CO -0.01 -0.59 1.20 0.27 -0.50 0.00 0.00 175.29 175.67 2jzi n ASN 42 N -1.54 -2.13 -2.44 6.67 6.94 -1.26 -4.39 115.26 117.10 2jzi n ASN 42 Ca -0.02 -3.23 -0.07 0.00 -0.02 0.00 0.00 54.58 51.25 2jzi n ASN 42 Cb 0.64 1.56 0.05 0.00 -2.36 0.00 0.00 39.78 39.66 2jzi n ASN 42 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 2jzi n PRO 43 N -0.00 -0.26 -4.39 -0.53 -0.04 -1.26 -5.10 135.00 123.42 2jzi n PRO 43 Ca 0.03 -0.48 -0.28 0.00 -0.04 0.00 0.00 63.50 62.73 2jzi n PRO 43 Cb 0.76 -0.30 -0.12 0.00 -0.04 0.00 0.00 33.50 33.79 2jzi n PRO 43 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2jzi s THR 44 N -1.60 2.45 0.12 0.52 2.01 -1.26 -5.04 115.64 112.84 2jzi s THR 44 Ca 0.17 -1.85 -0.21 0.00 0.31 0.00 0.00 61.69 60.11 2jzi s THR 44 Cb -0.00 -2.15 -0.06 0.00 0.01 0.00 0.00 72.50 70.30 2jzi s THR 44 CO 0.12 -0.03 1.71 -0.33 -0.69 0.00 0.00 174.62 175.40 2jzi h GLU 45 N 3.45 -0.01 -0.20 4.92 4.39 -1.99 -0.56 114.58 124.58 2jzi h GLU 45 Ca -0.48 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.14 2jzi h GLU 45 Cb 1.19 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 2jzi h GLU 45 CO 0.45 -0.01 -0.23 0.00 -1.16 0.00 0.00 179.01 178.07 2jzi h ALA 46 N 1.14 1.24 0.33 3.43 0.00 -1.98 -1.49 119.26 121.93 2jzi h ALA 46 Ca 0.07 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2jzi h ALA 46 Cb 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2jzi h ALA 46 CO -0.16 0.50 -0.16 0.93 0.00 0.00 0.00 179.25 180.36 2jzi h GLU 47 N 0.33 -0.43 -0.28 0.00 4.39 -1.83 0.00 114.58 116.76 2jzi h GLU 47 Ca 0.05 0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.71 2jzi h GLU 47 Cb 0.58 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.32 2jzi h GLU 47 CO 0.04 -0.15 -0.16 1.37 -1.16 0.00 0.00 179.01 178.95 2jzi h LEU 48 N -0.69 0.49 -0.53 1.33 -0.00 -1.09 -1.68 115.31 113.14 2jzi h LEU 48 Ca -0.05 -0.14 -0.05 0.00 -0.00 0.00 0.00 57.88 57.65 2jzi h LEU 48 Cb 0.48 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.99 2jzi h LEU 48 CO 0.08 0.67 0.13 1.56 -0.00 0.00 0.00 178.44 180.87 2jzi h GLN 49 N 0.45 0.85 -0.40 0.17 4.20 -1.20 0.85 115.11 120.03 2jzi h GLN 49 Ca 0.08 -0.21 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 2jzi h GLN 49 Cb 0.54 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 2jzi h GLN 49 CO 0.03 0.81 0.21 0.22 -0.67 0.00 0.00 178.83 179.44 2jzi h ASP 50 N 0.75 0.51 0.67 1.46 1.82 -0.63 -2.71 116.42 118.28 2jzi h ASP 50 Ca 0.17 -0.10 -0.16 0.00 -0.39 0.00 0.00 57.03 56.54 2jzi h ASP 50 Cb 0.34 -0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.20 2jzi h ASP 50 CO 0.00 0.47 -0.74 0.24 -1.61 0.00 0.00 179.24 177.60 2jzi h MET 51 N 0.52 0.05 -0.94 0.28 2.86 -1.10 -3.24 114.93 113.36 2jzi h MET 51 Ca 0.14 -0.05 0.15 0.00 -2.06 0.00 0.00 59.70 57.88 2jzi h MET 51 Cb 0.08 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.67 2jzi h MET 51 CO -0.02 0.77 0.60 0.82 1.06 0.00 0.00 176.91 180.14 2jzi h ILE 52 N 0.03 0.83 -1.29 -1.22 1.08 0.11 -1.18 117.51 115.87 2jzi h ILE 52 Ca -0.01 -0.27 0.37 0.00 -0.39 0.00 0.00 64.86 64.57 2jzi h ILE 52 Cb 1.30 -0.01 -0.05 0.00 -3.07 0.00 0.00 36.82 34.99 2jzi h ILE 52 CO 0.10 0.14 1.03 -1.13 -0.69 0.00 0.00 178.15 177.61 2jzi h ASN 53 N 0.78 0.00 0.15 1.72 -0.73 -1.56 0.99 115.58 116.93 2jzi h ASN 53 Ca 0.48 0.00 -0.29 0.00 1.87 0.00 0.00 56.30 58.37 2jzi h ASN 53 Cb 0.71 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.32 2jzi h ASN 53 CO -0.25 0.00 -1.19 -0.33 -0.37 0.00 0.00 177.43 175.29 2jzi h GLU 54 N 0.00 0.61 0.00 6.67 3.07 -1.45 -3.20 114.58 120.27 2jzi h GLU 54 Ca 0.61 -0.78 0.00 0.00 -0.50 0.00 0.00 59.36 58.70 2jzi h GLU 54 Cb 2.67 0.25 0.00 0.00 -0.84 0.00 0.00 28.75 30.83 2jzi h GLU 54 CO -0.01 1.34 -0.03 1.33 -1.40 0.00 0.00 179.01 180.24 2jzi n VAL 55 N -3.79 0.20 -4.04 3.13 0.24 0.31 -4.82 118.33 109.57 2jzi n VAL 55 Ca -0.12 -0.10 -0.26 0.00 -2.04 0.00 0.00 64.34 61.82 2jzi n VAL 55 Cb 0.96 -0.49 -0.04 0.00 -1.47 0.00 0.00 33.84 32.80 2jzi n VAL 55 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2jzi s ASP 56 N -3.53 5.82 0.07 -1.34 2.15 0.91 -4.57 116.67 116.18 2jzi s ASP 56 Ca 0.13 -0.03 0.11 0.00 0.43 0.00 0.00 52.55 53.18 2jzi s ASP 56 Cb 0.17 -1.61 -0.18 0.00 -0.30 0.00 0.00 42.92 41.00 2jzi s ASP 56 CO 0.56 0.05 1.03 0.00 -0.17 0.00 0.00 175.17 176.64 2jzi h ALA 57 N 2.19 0.57 -0.00 3.66 0.00 -1.84 -3.36 119.26 120.48 2jzi h ALA 57 Ca -0.48 -1.06 0.00 0.00 0.00 0.00 0.00 54.91 53.37 2jzi h ALA 57 Cb 1.20 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2jzi h ALA 57 CO 0.65 1.28 -0.17 -0.40 0.00 0.00 0.00 179.25 180.60 2jzi n ASP 58 N -3.18 0.21 -3.25 0.00 5.68 -1.26 -5.05 116.55 109.71 2jzi n ASP 58 Ca -0.07 -0.61 -0.12 0.00 -0.50 0.00 0.00 54.79 53.50 2jzi n ASP 58 Cb 0.95 0.97 0.04 0.00 -1.14 0.00 0.00 41.12 41.93 2jzi n ASP 58 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jzi n GLY 59 N 1.06 -1.18 0.71 6.12 0.00 -1.26 -4.94 105.19 105.70 2jzi n GLY 59 Ca 0.01 0.53 0.08 0.00 0.00 0.00 0.00 46.02 46.64 2jzi n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2jzi n ASN 60 N -2.61 3.44 0.00 1.61 6.94 -1.26 -4.81 115.26 118.57 2jzi n ASN 60 Ca -0.06 -2.80 0.00 0.00 -0.02 0.00 0.00 54.58 51.71 2jzi n ASN 60 Cb 0.58 -0.45 0.00 0.00 -2.36 0.00 0.00 39.78 37.55 2jzi n ASN 60 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2jzi n GLY 61 N -0.43 0.61 3.47 4.83 0.00 -1.26 -4.99 105.19 107.41 2jzi n GLY 61 Ca 0.18 -0.69 -0.14 0.00 0.00 0.00 0.00 46.02 45.37 2jzi n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jzi s THR 62 N -2.00 0.00 -0.07 2.61 -4.23 -1.26 -1.76 115.64 108.93 2jzi s THR 62 Ca 0.00 -1.62 0.03 0.00 -1.18 0.00 0.00 61.69 58.92 2jzi s THR 62 Cb 0.00 -2.55 -0.02 0.00 1.34 0.00 0.00 72.50 71.27 2jzi s THR 62 CO 0.00 0.00 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.29 2jzi s ILE 63 N -3.32 2.90 0.73 2.99 1.01 -1.15 -4.20 121.20 120.16 2jzi s ILE 63 Ca 0.30 -0.76 -0.06 0.00 0.00 0.00 0.00 60.65 60.13 2jzi s ILE 63 Cb 0.00 -2.15 0.16 0.00 0.01 0.00 0.00 42.46 40.48 2jzi s ILE 63 CO 0.18 0.57 0.99 0.47 0.00 0.00 0.00 174.94 177.15 2jzi n ASP 64 N 2.74 0.69 0.18 3.58 8.00 -1.26 -4.09 116.55 126.39 2jzi n ASP 64 Ca -0.17 -1.73 -0.13 0.00 0.71 0.00 0.00 54.79 53.47 2jzi n ASP 64 Cb 0.52 -0.70 -0.07 0.00 -0.02 0.00 0.00 41.12 40.85 2jzi n ASP 64 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2jzi h PHE 65 N -1.06 -0.44 -0.34 1.24 -1.00 -2.00 -0.91 116.94 112.43 2jzi h PHE 65 Ca -0.32 -0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.37 2jzi h PHE 65 Cb 1.04 0.15 -0.02 0.00 3.61 0.00 0.00 35.95 40.73 2jzi h PHE 65 CO 0.00 -0.11 -0.10 -1.00 -1.61 0.00 0.00 178.31 175.49 2jzi h PRO 66 N -0.87 0.57 0.20 1.51 0.13 -1.99 -1.59 132.00 129.97 2jzi h PRO 66 Ca -0.05 -0.16 -0.01 0.00 -0.87 0.00 0.00 66.00 64.91 2jzi h PRO 66 Cb 0.53 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.60 2jzi h PRO 66 CO 0.08 0.67 -0.10 0.93 -0.23 0.00 0.00 178.00 179.35 2jzi h GLU 67 N 0.53 -0.26 0.44 0.86 4.39 -1.88 0.04 114.58 118.71 2jzi h GLU 67 Ca 0.10 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 2jzi h GLU 67 Cb 0.49 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 2jzi h GLU 67 CO 0.03 -0.04 -0.36 0.35 -1.16 0.00 0.00 179.01 177.82 2jzi h PHE 68 N -0.44 -0.97 -0.40 4.33 3.04 -1.00 0.16 116.94 121.66 2jzi h PHE 68 Ca -0.03 0.00 0.06 0.00 3.98 0.00 0.00 57.97 61.99 2jzi h PHE 68 Cb 0.33 0.37 -0.06 0.00 2.56 0.00 0.00 35.95 39.15 2jzi h PHE 68 CO -0.01 -0.52 0.06 -0.07 -2.02 0.00 0.00 178.31 175.74 2jzi h LEU 69 N -0.80 -0.03 -1.77 0.59 3.38 -1.31 0.18 115.31 115.55 2jzi h LEU 69 Ca -0.04 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.04 2jzi h LEU 69 Cb 0.69 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 2jzi h LEU 69 CO -0.02 0.02 0.22 0.74 0.09 0.00 0.00 178.44 179.50 2jzi h THR 70 N 0.18 0.99 0.52 0.22 2.02 -0.75 0.77 112.91 116.86 2jzi h THR 70 Ca 0.19 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.25 2jzi h THR 70 Cb 0.24 0.67 0.01 0.00 -1.74 0.00 0.00 68.15 67.33 2jzi h THR 70 CO -0.27 0.05 -0.25 -0.03 0.37 0.00 0.00 175.52 175.39 2jzi h MET 71 N 0.30 -0.67 0.00 6.66 -1.53 0.20 -3.23 114.93 116.65 2jzi h MET 71 Ca 0.14 0.05 -0.04 0.00 -3.44 0.00 0.00 59.70 56.41 2jzi h MET 71 Cb 0.18 0.15 -0.01 0.00 -0.55 0.00 0.00 31.60 31.38 2jzi h MET 71 CO -0.03 -0.45 -0.17 0.52 0.14 0.00 0.00 176.91 176.92 2jzi h MET 72 N -1.03 0.00 -0.31 0.39 2.86 -0.60 -2.06 114.93 114.17 2jzi h MET 72 Ca -0.07 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 57.66 2jzi h MET 72 Cb 0.54 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 2jzi h MET 72 CO 0.12 0.17 0.40 0.00 1.06 0.00 0.00 176.91 178.66 2jzi h ALA 73 N 1.83 1.93 -0.09 6.32 0.00 0.54 0.18 119.26 129.96 2jzi h ALA 73 Ca -0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.92 2jzi h ALA 73 Cb 0.31 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2jzi h ALA 73 CO 0.02 -0.56 0.07 -0.09 0.00 0.00 0.00 179.25 178.69 2jzi h ARG 74 N 0.00 0.00 -0.03 0.00 9.65 -1.42 -0.58 114.38 122.01 2jzi h ARG 74 Ca 0.15 0.00 0.01 0.00 -1.10 0.00 0.00 59.98 59.04 2jzi h ARG 74 Cb 0.95 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.53 2jzi h ARG 74 CO -0.00 0.00 0.08 -0.22 2.80 0.00 0.00 179.97 182.63 2jzi h LYS 75 N 0.00 0.00 -0.10 0.20 1.63 -0.84 -1.28 116.57 116.18 2jzi h LYS 75 Ca 0.04 0.00 0.03 0.00 -0.85 0.00 0.00 60.65 59.87 2jzi h LYS 75 Cb 0.19 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.81 2jzi h LYS 75 CO -0.00 0.00 0.18 0.52 -3.45 0.00 0.00 179.45 176.70 2jzi h MET 76 N 0.00 0.00 0.00 1.90 2.86 -1.27 -3.22 114.93 115.20 2jzi h MET 76 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2jzi h MET 76 Cb 0.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.83 2jzi h MET 76 CO -0.00 0.00 0.00 1.63 1.06 0.00 0.00 176.91 179.60 2jzi n LYS 77 N -3.43 0.00 -3.11 1.72 4.76 -0.48 -5.03 118.16 112.58 2jzi n LYS 77 Ca -0.00 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 2jzi n LYS 77 Cb 0.27 -0.92 0.00 0.00 -1.84 0.00 0.00 35.03 32.54 2jzi n LYS 77 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2jzi n ASP 78 N -0.51 0.00 -1.37 4.39 2.03 -1.22 -5.17 116.55 114.70 2jzi n ASP 78 Ca 0.00 0.00 0.18 0.00 0.52 0.00 0.00 54.79 55.49 2jzi n ASP 78 Cb 0.00 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.36 2jzi n ASP 78 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2jzi n THR 79 N 0.03 0.00 -2.52 5.18 -1.04 -1.26 -4.88 114.28 109.79 2jzi n THR 79 Ca 0.00 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.83 2jzi n THR 79 Cb 0.00 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.07 2jzi n THR 79 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2jzi n ASP 80 N -4.06 -5.25 -0.04 8.00 9.92 -1.26 -4.92 116.55 118.94 2jzi n ASP 80 Ca 0.01 -0.09 -0.12 0.00 -0.53 0.00 0.00 54.79 54.06 2jzi n ASP 80 Cb 0.60 -4.25 -0.10 0.00 -0.64 0.00 0.00 41.12 36.73 2jzi n ASP 80 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 2jzi h SER 81 N -0.39 -0.03 1.04 -2.24 4.64 -1.99 -3.34 113.55 111.24 2jzi h SER 81 Ca -0.43 -0.71 -0.20 0.00 -0.47 0.00 0.00 61.79 59.99 2jzi h SER 81 Cb 1.31 0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 63.38 2jzi h SER 81 CO 0.49 0.77 -0.97 -0.33 -0.87 0.00 0.00 176.83 175.92 2jzi h GLU 82 N -0.91 0.00 -0.96 4.77 4.39 -2.01 -3.28 114.58 116.57 2jzi h GLU 82 Ca -0.00 0.00 0.27 0.00 0.34 0.00 0.00 59.36 59.97 2jzi h GLU 82 Cb 0.73 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.34 2jzi h GLU 82 CO 0.01 0.89 0.69 0.93 -1.16 0.00 0.00 179.01 180.36 2jzi h GLU 83 N 0.00 0.03 0.00 2.33 4.39 -1.97 0.64 114.58 120.01 2jzi h GLU 83 Ca -0.03 -0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.53 2jzi h GLU 83 Cb 1.73 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.35 2jzi h GLU 83 CO 0.12 0.02 -0.65 0.93 -1.16 0.00 0.00 179.01 178.27 2jzi h GLU 84 N 0.03 0.00 0.00 2.33 5.08 -1.68 -2.14 114.58 118.21 2jzi h GLU 84 Ca 0.46 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.82 2jzi h GLU 84 Cb 1.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.04 2jzi h GLU 84 CO -0.02 0.65 -0.00 0.82 -1.00 0.00 0.00 179.01 179.45 2jzi h ILE 85 N 0.00 1.58 0.02 3.13 2.04 0.07 -3.27 117.51 121.09 2jzi h ILE 85 Ca -0.01 -2.11 -0.00 0.00 1.00 0.00 0.00 64.86 63.75 2jzi h ILE 85 Cb 1.19 2.95 0.00 0.00 -0.74 0.00 0.00 36.82 40.22 2jzi h ILE 85 CO 0.08 0.52 -0.01 0.03 0.00 0.00 0.00 178.15 178.78 2jzi h ARG 86 N -0.96 -0.02 -0.34 2.37 -0.00 -1.41 -3.03 114.38 110.98 2jzi h ARG 86 Ca -0.00 0.00 0.10 0.00 -0.50 0.00 0.00 59.98 59.58 2jzi h ARG 86 Cb 0.86 0.01 -0.01 0.00 0.00 0.00 0.00 29.97 30.82 2jzi h ARG 86 CO 0.00 0.55 0.40 0.93 0.00 0.00 0.00 179.97 181.85 2jzi h GLU 87 N -0.62 0.00 0.08 0.04 5.08 -1.58 0.21 114.58 117.78 2jzi h GLU 87 Ca -0.00 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.09 2jzi h GLU 87 Cb 0.59 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.85 2jzi h GLU 87 CO 0.00 0.00 -1.13 0.00 -1.00 0.00 0.00 179.01 176.89 2jzi h ALA 88 N 1.52 0.17 0.08 3.43 0.00 -1.59 -2.99 119.26 119.89 2jzi h ALA 88 Ca 0.16 -0.78 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 2jzi h ALA 88 Cb 0.96 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2jzi h ALA 88 CO -0.00 0.82 -0.04 0.35 0.00 0.00 0.00 179.25 180.38 2jzi h PHE 89 N 0.20 -0.10 -0.61 0.00 3.57 -0.50 0.62 116.94 120.12 2jzi h PHE 89 Ca -0.13 -0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.50 2jzi h PHE 89 Cb 1.80 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 40.54 2jzi h PHE 89 CO 0.08 0.30 0.42 0.07 -2.23 0.00 0.00 178.31 176.95 2jzi h ARG 90 N -0.53 0.22 0.00 1.11 0.11 -1.41 0.17 114.38 114.04 2jzi h ARG 90 Ca -0.01 -0.01 -0.08 0.00 0.10 0.00 0.00 59.98 59.98 2jzi h ARG 90 Cb 0.45 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.47 2jzi h ARG 90 CO 0.02 0.14 -1.08 0.28 0.10 0.00 0.00 179.97 179.43 2jzi h VAL 91 N 0.22 0.26 -0.67 0.08 2.07 -1.38 -3.34 116.25 113.50 2jzi h VAL 91 Ca 0.29 -1.49 0.19 0.00 0.82 0.00 0.00 66.70 66.51 2jzi h VAL 91 Cb 0.84 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 32.39 2jzi h VAL 91 CO -0.06 0.15 0.48 0.15 0.02 0.00 0.00 177.57 178.31 2jzi h PHE 92 N 0.00 0.01 -3.53 1.57 3.57 0.33 -3.39 116.94 115.50 2jzi h PHE 92 Ca -0.07 0.00 -0.68 0.00 3.53 0.00 0.00 57.97 60.75 2jzi h PHE 92 Cb 1.27 -0.00 -0.18 0.00 2.79 0.00 0.00 35.95 39.83 2jzi h PHE 92 CO 0.00 0.00 -0.67 0.34 -2.23 0.00 0.00 178.31 175.76 2jzi s ASP 93 N -6.00 4.86 0.25 0.41 -1.08 -1.19 -4.74 116.67 109.17 2jzi s ASP 93 Ca -0.05 0.03 -0.04 0.00 -0.52 0.00 0.00 52.55 51.97 2jzi s ASP 93 Cb 0.20 -1.31 0.30 0.00 -1.46 0.00 0.00 42.92 40.65 2jzi s ASP 93 CO 0.75 0.36 1.82 0.11 0.52 0.00 0.00 175.17 178.73 2jzi h LYS 94 N 5.29 1.04 -0.00 4.34 6.56 -1.89 -3.14 116.57 128.77 2jzi h LYS 94 Ca -0.49 -0.18 0.00 0.00 -1.06 0.00 0.00 60.65 58.93 2jzi h LYS 94 Cb 1.18 -0.17 0.00 0.00 -0.57 0.00 0.00 32.23 32.67 2jzi h LYS 94 CO 0.53 0.85 -0.59 -0.40 -2.06 0.00 0.00 179.45 177.79 2jzi n ASP 95 N -4.29 0.66 -0.05 0.86 5.68 -1.26 -5.00 116.55 113.15 2jzi n ASP 95 Ca 0.06 -0.83 0.00 0.00 -0.50 0.00 0.00 54.79 53.52 2jzi n ASP 95 Cb 0.18 0.96 0.00 0.00 -1.14 0.00 0.00 41.12 41.13 2jzi n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jzi n GLY 96 N 1.29 0.44 0.11 6.12 0.00 -1.19 -4.92 105.19 107.04 2jzi n GLY 96 Ca 0.03 -0.86 0.10 0.00 0.00 0.00 0.00 46.02 45.29 2jzi n GLY 96 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jzi n ASN 97 N 1.93 0.52 0.00 1.61 5.03 -1.26 -4.84 115.26 118.26 2jzi n ASN 97 Ca 0.00 0.65 0.00 0.00 0.87 0.00 0.00 54.58 56.10 2jzi n ASN 97 Cb 0.50 -0.76 0.00 0.00 -1.02 0.00 0.00 39.78 38.50 2jzi n ASN 97 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2jzi n GLY 98 N -0.33 0.79 3.20 7.41 0.00 -1.26 -5.05 105.19 109.96 2jzi n GLY 98 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 2jzi n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jzi s TYR 99 N -2.21 1.52 -0.25 1.61 2.02 -1.26 -3.38 117.35 115.41 2jzi s TYR 99 Ca 0.00 -0.37 0.03 0.00 -0.37 0.00 0.00 57.07 56.35 2jzi s TYR 99 Cb 0.00 -0.89 0.06 0.00 -0.40 0.00 0.00 41.96 40.73 2jzi s TYR 99 CO 0.00 0.08 -0.10 0.96 -1.57 0.00 0.00 175.55 174.92 2jzi s ILE 100 N -0.89 2.04 0.91 2.71 -4.36 -1.25 -4.74 121.20 115.62 2jzi s ILE 100 Ca 0.04 -1.55 -0.12 0.00 -0.26 0.00 0.00 60.65 58.76 2jzi s ILE 100 Cb -0.09 -2.18 0.19 0.00 1.25 0.00 0.00 42.46 41.63 2jzi s ILE 100 CO 0.02 -0.04 1.24 -0.55 0.24 0.00 0.00 174.94 175.85 2jzi s SER 101 N 1.16 3.39 0.48 4.36 0.15 -1.26 -4.27 113.70 117.70 2jzi s SER 101 Ca -0.08 0.09 0.19 0.00 0.70 0.00 0.00 55.95 56.85 2jzi s SER 101 Cb -0.20 -0.20 1.19 0.00 -1.71 0.00 0.00 66.02 65.10 2jzi s SER 101 CO -0.05 -2.54 2.03 0.00 1.20 0.00 0.00 173.24 173.88 2jzi h ALA 102 N -1.38 1.56 0.56 5.45 0.00 -1.89 0.40 119.26 123.96 2jzi h ALA 102 Ca -0.42 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 2jzi h ALA 102 Cb 1.24 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.01 2jzi h ALA 102 CO 0.38 0.19 -0.27 0.00 0.00 0.00 0.00 179.25 179.55 2jzi h ALA 103 N 1.84 -0.75 0.02 0.00 0.00 -1.98 -1.79 119.26 116.61 2jzi h ALA 103 Ca -0.00 -0.20 -0.21 0.00 0.00 0.00 0.00 54.91 54.51 2jzi h ALA 103 Cb 0.31 0.29 0.02 0.00 0.00 0.00 0.00 17.79 18.41 2jzi h ALA 103 CO 0.02 -0.82 -0.82 0.93 0.00 0.00 0.00 179.25 178.56 2jzi h GLU 104 N -0.94 0.52 -0.58 0.00 4.39 -1.90 -3.07 114.58 113.00 2jzi h GLU 104 Ca -0.08 -0.59 0.09 0.00 0.34 0.00 0.00 59.36 59.13 2jzi h GLU 104 Cb 0.64 0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 29.42 2jzi h GLU 104 CO 0.13 1.21 0.39 1.25 -1.16 0.00 0.00 179.01 180.83 2jzi h LEU 105 N 0.08 0.37 -0.01 1.33 5.85 -0.29 0.11 115.31 122.74 2jzi h LEU 105 Ca -0.11 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 2jzi h LEU 105 Cb 1.52 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.48 2jzi h LEU 105 CO 0.16 0.22 -0.03 -0.09 -0.34 0.00 0.00 178.44 178.36 2jzi h ARG 106 N 0.41 0.05 -0.75 1.25 2.43 -1.35 0.19 114.38 116.60 2jzi h ARG 106 Ca 0.27 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.38 2jzi h ARG 106 Cb 0.51 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.03 2jzi h ARG 106 CO -0.07 0.62 0.38 1.25 -1.51 0.00 0.00 179.97 180.64 2jzi h HIS 107 N -0.52 1.05 -0.11 2.20 2.76 -1.32 0.78 115.15 119.99 2jzi h HIS 107 Ca -0.00 -0.03 -0.13 0.00 -2.20 0.00 0.00 60.37 58.00 2jzi h HIS 107 Cb 0.62 -0.33 0.01 0.00 1.55 0.00 0.00 27.41 29.26 2jzi h HIS 107 CO 0.13 0.75 -0.45 0.28 -1.30 0.00 0.00 177.93 177.34 2jzi h VAL 108 N 1.06 1.37 0.12 5.26 2.07 -0.82 -2.46 116.25 122.86 2jzi h VAL 108 Ca 0.26 -1.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 2jzi h VAL 108 Cb 0.08 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 2jzi h VAL 108 CO -0.04 0.53 -0.06 0.24 0.02 0.00 0.00 177.57 178.26 2jzi h MET 109 N 0.09 -0.16 -0.47 1.57 2.07 -0.39 -2.99 114.93 114.65 2jzi h MET 109 Ca -0.02 0.01 0.06 0.00 -2.07 0.00 0.00 59.70 57.68 2jzi h MET 109 Cb 1.08 0.04 -0.06 0.00 -1.87 0.00 0.00 31.60 30.80 2jzi h MET 109 CO 0.09 0.31 0.16 1.15 1.07 0.00 0.00 176.91 179.70 2jzi h THR 110 N -0.87 0.83 -0.01 2.22 2.02 0.49 1.09 112.91 118.68 2jzi h THR 110 Ca -0.02 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.05 2jzi h THR 110 Cb 0.55 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2jzi h THR 110 CO 0.03 0.06 0.01 0.78 0.37 0.00 0.00 175.52 176.77 2jzi h ASN 111 N 0.33 0.00 -0.58 4.18 4.21 -1.55 -2.43 115.58 119.74 2jzi h ASN 111 Ca 0.23 0.00 -0.42 0.00 1.21 0.00 0.00 56.30 57.32 2jzi h ASN 111 Cb 0.24 0.00 -0.36 0.00 -1.12 0.00 0.00 38.32 37.08 2jzi h ASN 111 CO -0.24 0.00 -0.81 0.18 -1.29 0.00 0.00 177.43 175.27 2jzi n LEU 112 N -4.50 4.07 0.00 1.61 4.77 -0.25 -4.72 117.00 117.98 2jzi n LEU 112 Ca -0.03 -4.33 0.00 0.00 -0.03 0.00 0.00 56.01 51.62 2jzi n LEU 112 Cb 0.10 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 2jzi n LEU 112 CO 0.34 1.83 0.00 0.61 -1.33 0.00 0.00 177.39 178.83 2jzi n GLY 113 N -0.73 0.29 3.29 -0.72 0.00 0.36 -4.90 105.19 102.78 2jzi n GLY 113 Ca 0.35 0.50 -0.15 0.00 0.00 0.00 0.00 46.02 46.71 2jzi n GLY 113 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2jzi s GLU 114 N 2.40 1.34 -0.67 1.61 -1.05 -1.25 -4.89 118.70 116.18 2jzi s GLU 114 Ca 0.00 -1.71 -0.27 0.00 -0.15 0.00 0.00 54.97 52.84 2jzi s GLU 114 Cb 0.00 -0.19 -0.00 0.00 -0.44 0.00 0.00 34.13 33.50 2jzi s GLU 114 CO 0.00 -0.28 1.63 0.21 0.95 0.00 0.00 175.26 177.77 2jzi s LYS 115 N -4.03 2.85 -0.35 -4.83 2.20 -1.26 -3.76 119.74 110.56 2jzi s LYS 115 Ca 0.36 0.25 -0.21 0.00 -0.36 0.00 0.00 55.97 56.01 2jzi s LYS 115 Cb 0.07 -4.33 0.00 0.00 -1.51 0.00 0.00 37.83 32.07 2jzi s LYS 115 CO 0.12 -2.51 0.66 -0.48 -0.36 0.00 0.00 175.35 172.78 2jzi s LEU 116 N 7.77 4.21 1.09 5.43 2.34 -1.26 -5.03 118.68 133.23 2jzi s LEU 116 Ca 0.55 0.26 -0.17 0.00 0.06 0.00 0.00 54.13 54.83 2jzi s LEU 116 Cb -0.11 -2.84 0.24 0.00 -0.56 0.00 0.00 46.19 42.92 2jzi s LEU 116 CO 0.18 -0.59 1.14 -0.89 -1.06 0.00 0.00 176.35 175.12 2jzi s THR 117 N 2.76 1.79 0.41 5.48 2.01 -1.26 -4.35 115.64 122.48 2jzi s THR 117 Ca 0.26 0.00 0.21 0.00 0.31 0.00 0.00 61.69 62.47 2jzi s THR 117 Cb -0.14 -2.59 0.41 0.00 0.01 0.00 0.00 72.50 70.19 2jzi s THR 117 CO 0.14 0.00 1.75 0.44 -0.69 0.00 0.00 174.62 176.27 2jzi h ASP 118 N -2.19 0.39 0.41 3.53 5.19 -1.98 0.83 116.42 122.60 2jzi h ASP 118 Ca -0.48 0.08 -0.25 0.00 -0.62 0.00 0.00 57.03 55.77 2jzi h ASP 118 Cb 1.30 0.03 0.01 0.00 0.18 0.00 0.00 39.33 40.84 2jzi h ASP 118 CO 0.43 0.04 -1.07 -0.08 -3.12 0.00 0.00 179.24 175.44 2jzi h GLU 119 N 0.32 0.38 -0.09 3.56 4.57 -1.98 -0.95 114.58 120.40 2jzi h GLU 119 Ca 0.62 -0.49 -0.15 0.00 -1.18 0.00 0.00 59.36 58.17 2jzi h GLU 119 Cb 1.70 0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 30.43 2jzi h GLU 119 CO -0.29 1.17 -0.59 0.93 -1.18 0.00 0.00 179.01 179.05 2jzi h GLU 120 N 0.18 0.29 -0.01 1.92 4.39 -0.32 0.83 114.58 121.86 2jzi h GLU 120 Ca -0.11 -0.19 -0.02 0.00 0.34 0.00 0.00 59.36 59.38 2jzi h GLU 120 Cb 1.74 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 30.42 2jzi h GLU 120 CO 0.18 0.79 -0.08 0.28 -1.16 0.00 0.00 179.01 179.02 2jzi h VAL 121 N 0.22 1.57 0.25 3.13 2.07 0.36 -2.64 116.25 121.20 2jzi h VAL 121 Ca -0.00 -1.78 -0.01 0.00 0.82 0.00 0.00 66.70 65.73 2jzi h VAL 121 Cb 1.09 2.73 -0.00 0.00 -1.52 0.00 0.00 31.29 33.59 2jzi h VAL 121 CO 0.09 0.47 -0.14 0.44 0.02 0.00 0.00 177.57 178.46 2jzi h ASP 122 N -0.64 -0.35 -0.23 0.57 3.32 -1.17 -0.38 116.42 117.54 2jzi h ASP 122 Ca -0.01 0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.13 2jzi h ASP 122 Cb 0.82 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 2jzi h ASP 122 CO 0.02 -0.23 0.18 1.05 -1.72 0.00 0.00 179.24 178.54 2jzi h GLU 123 N -0.37 0.00 0.02 3.56 -0.00 -0.94 -0.31 114.58 116.54 2jzi h GLU 123 Ca -0.03 0.00 -0.27 0.00 -0.00 0.00 0.00 59.36 59.07 2jzi h GLU 123 Cb 0.30 0.00 0.02 0.00 -0.00 0.00 0.00 28.75 29.07 2jzi h GLU 123 CO 0.03 0.00 -1.06 1.98 -0.00 0.00 0.00 179.01 179.96 2jzi h MET 124 N 0.00 0.66 -0.53 1.06 4.05 -0.97 -2.83 114.93 116.36 2jzi h MET 124 Ca 0.11 -0.73 -0.09 0.00 -0.28 0.00 0.00 59.70 58.71 2jzi h MET 124 Cb 0.48 0.21 -0.02 0.00 -0.80 0.00 0.00 31.60 31.47 2jzi h MET 124 CO -0.00 1.31 -0.04 0.82 0.23 0.00 0.00 176.91 179.23 2jzi h ILE 125 N 0.36 1.27 -0.62 1.77 2.04 0.36 0.75 117.51 123.42 2jzi h ILE 125 Ca -0.13 -1.16 -0.05 0.00 1.00 0.00 0.00 64.86 64.52 2jzi h ILE 125 Cb 1.72 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 38.72 2jzi h ILE 125 CO 0.21 0.41 0.18 0.03 0.00 0.00 0.00 178.15 178.97 2jzi h ARG 126 N 0.82 0.98 0.07 2.37 3.08 -1.18 0.13 114.38 120.66 2jzi h ARG 126 Ca 0.14 -0.22 -0.27 0.00 0.07 0.00 0.00 59.98 59.71 2jzi h ARG 126 Cb 0.58 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 2jzi h ARG 126 CO 0.03 0.87 -1.33 1.05 -1.07 0.00 0.00 179.97 179.53 2jzi h GLU 127 N 0.90 0.15 -0.25 0.04 4.11 -1.41 -3.30 114.58 114.82 2jzi h GLU 127 Ca 0.20 -0.25 -0.11 0.00 0.07 0.00 0.00 59.36 59.26 2jzi h GLU 127 Cb 0.31 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2jzi h GLU 127 CO -0.00 1.03 -0.32 0.00 0.07 0.00 0.00 179.01 179.78 2jzi h ALA 128 N 0.73 0.97 -3.22 1.06 0.00 0.64 -3.44 119.26 116.00 2jzi h ALA 128 Ca -0.15 -0.39 -0.66 0.00 0.00 0.00 0.00 54.91 53.71 2jzi h ALA 128 Cb 1.93 -0.12 -0.11 0.00 0.00 0.00 0.00 17.79 19.49 2jzi h ALA 128 CO 0.15 0.61 -0.61 0.34 0.00 0.00 0.00 179.25 179.74 2jzi s ASP 129 N -6.83 5.41 -0.02 0.00 2.15 0.45 -4.10 116.67 113.74 2jzi s ASP 129 Ca -0.07 0.05 -0.15 0.00 0.43 0.00 0.00 52.55 52.81 2jzi s ASP 129 Cb 0.13 -1.47 -0.33 0.00 -0.30 0.00 0.00 42.92 40.95 2jzi s ASP 129 CO 0.81 0.25 0.81 0.16 -0.17 0.00 0.00 175.17 177.03 2jzi h ILE 130 N 3.22 1.15 0.00 4.11 3.07 -1.84 -3.27 117.51 123.94 2jzi h ILE 130 Ca -0.49 -2.58 0.00 0.00 1.55 0.00 0.00 64.86 63.35 2jzi h ILE 130 Cb 1.18 2.92 0.00 0.00 -0.27 0.00 0.00 36.82 40.65 2jzi h ILE 130 CO 0.61 0.81 0.00 0.47 -1.05 0.00 0.00 178.15 178.98 2jzi n ASP 131 N -3.74 0.15 -3.11 2.16 9.92 -1.26 -4.83 116.55 115.84 2jzi n ASP 131 Ca -0.20 0.54 -0.14 0.00 -0.53 0.00 0.00 54.79 54.45 2jzi n ASP 131 Cb 1.04 -0.57 -0.02 0.00 -0.64 0.00 0.00 41.12 40.93 2jzi n ASP 131 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jzi n GLY 132 N -0.15 -0.47 0.01 0.44 0.00 -1.24 -4.73 105.19 99.06 2jzi n GLY 132 Ca 0.03 0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.18 2jzi n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jzi n ASP 133 N -1.84 0.69 0.00 1.61 5.75 -1.26 -4.97 116.55 116.53 2jzi n ASP 133 Ca 0.02 -0.52 0.00 0.00 -0.01 0.00 0.00 54.79 54.28 2jzi n ASP 133 Cb 0.50 0.93 0.00 0.00 -1.03 0.00 0.00 41.12 41.52 2jzi n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jzi n GLY 134 N 1.43 1.26 3.14 6.12 0.00 -1.26 -5.10 105.19 110.78 2jzi n GLY 134 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 2jzi n GLY 134 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2jzi s GLN 135 N -0.02 0.48 -0.24 1.61 -2.07 -1.26 -4.42 119.66 113.74 2jzi s GLN 135 Ca 0.00 -0.15 -0.01 0.00 -1.82 0.00 0.00 55.36 53.38 2jzi s GLN 135 Cb 0.00 0.21 0.07 0.00 -1.09 0.00 0.00 33.01 32.20 2jzi s GLN 135 CO 0.00 -0.11 0.02 0.08 -1.32 0.00 0.00 175.29 173.96 2jzi s VAL 136 N -0.95 0.97 0.89 3.63 1.01 -1.26 -4.66 120.40 120.02 2jzi s VAL 136 Ca -0.10 -1.03 -0.14 0.00 0.00 0.00 0.00 61.98 60.71 2jzi s VAL 136 Cb -0.05 -1.48 0.15 0.00 0.00 0.00 0.00 36.38 35.00 2jzi s VAL 136 CO 0.02 -0.30 1.25 0.21 0.00 0.00 0.00 175.10 176.27 2jzi s ASN 137 N 1.63 3.76 0.04 3.32 2.47 -1.22 -3.82 114.94 121.11 2jzi s ASN 137 Ca 0.00 0.46 -0.09 0.00 0.42 0.00 0.00 52.86 53.65 2jzi s ASN 137 Cb -0.18 -0.70 -0.03 0.00 -1.45 0.00 0.00 41.25 38.89 2jzi s ASN 137 CO -0.12 -2.34 1.16 0.22 -3.72 0.00 0.00 177.10 172.30 2jzi h TYR 138 N -1.34 -0.49 0.00 0.43 3.20 -1.95 -1.22 116.97 115.60 2jzi h TYR 138 Ca -0.45 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.44 2jzi h TYR 138 Cb 1.28 0.23 -0.00 0.00 1.54 0.00 0.00 36.73 39.77 2jzi h TYR 138 CO -0.50 -0.14 -0.04 0.93 -1.64 0.00 0.00 178.16 176.77 2jzi h GLU 139 N -0.12 0.00 -0.68 1.82 5.08 -1.97 -1.44 114.58 117.27 2jzi h GLU 139 Ca 0.02 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.45 2jzi h GLU 139 Cb 0.17 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.36 2jzi h GLU 139 CO -0.17 0.04 0.36 1.49 -1.00 0.00 0.00 179.01 179.73 2jzi h GLU 140 N 0.00 0.63 0.03 2.33 4.81 -1.57 -0.94 114.58 119.87 2jzi h GLU 140 Ca -0.00 -0.04 -0.22 0.00 -0.13 0.00 0.00 59.36 58.97 2jzi h GLU 140 Cb 0.06 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 2jzi h GLU 140 CO 0.00 0.42 -1.02 0.27 -0.73 0.00 0.00 179.01 177.95 2jzi h PHE 141 N 0.65 0.19 -0.42 0.92 -5.15 -0.80 -3.30 116.94 109.04 2jzi h PHE 141 Ca 0.32 -0.13 0.07 0.00 -0.20 0.00 0.00 57.97 58.03 2jzi h PHE 141 Cb 0.26 -0.01 -0.06 0.00 0.22 0.00 0.00 35.95 36.35 2jzi h PHE 141 CO -0.09 1.05 0.05 0.28 -2.00 0.00 0.00 178.31 177.59 2jzi h VAL 142 N 0.04 0.73 -0.56 0.88 2.07 -0.19 1.05 116.25 120.29 2jzi h VAL 142 Ca -0.05 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.45 2jzi h VAL 142 Cb 1.73 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 2jzi h VAL 142 CO 0.15 0.03 0.32 1.56 0.02 0.00 0.00 177.57 179.64 2jzi h GLN 143 N 0.16 0.60 -0.05 1.57 1.08 -1.31 -1.75 115.11 115.42 2jzi h GLN 143 Ca 0.21 -0.04 -0.16 0.00 -1.45 0.00 0.00 58.65 57.21 2jzi h GLN 143 Cb 0.28 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.56 2jzi h GLN 143 CO -0.30 0.40 -0.68 1.98 -0.95 0.00 0.00 178.83 179.27 2jzi h MET 144 N 0.62 0.24 -0.70 1.46 4.05 -1.42 -2.25 114.93 116.93 2jzi h MET 144 Ca 0.23 -0.19 0.01 0.00 -0.28 0.00 0.00 59.70 59.47 2jzi h MET 144 Cb 0.08 0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 30.88 2jzi h MET 144 CO -0.13 0.83 0.46 1.98 0.23 0.00 0.00 176.91 180.29 2jzi h MET 145 N 0.17 0.92 0.01 0.39 1.85 0.18 -2.51 114.93 115.93 2jzi h MET 145 Ca -0.02 -0.06 -0.19 0.00 -0.61 0.00 0.00 59.70 58.82 2jzi h MET 145 Cb 1.23 -0.21 -0.02 0.00 0.43 0.00 0.00 31.60 33.03 2jzi h MET 145 CO 0.11 0.61 -0.91 0.00 -0.40 0.00 0.00 176.91 176.31 2jzi h THR 146 N 0.95 1.60 -4.05 -0.77 1.03 -1.33 -3.46 112.91 106.88 2jzi h THR 146 Ca 0.26 -2.96 -0.56 0.00 -0.01 0.00 0.00 66.41 63.14 2jzi h THR 146 Cb -0.10 2.63 0.16 0.00 -1.07 0.00 0.00 68.15 69.77 2jzi h THR 146 CO -0.06 0.85 0.50 0.00 -0.01 0.00 0.00 175.52 176.81 2jzi n ALA 147 N -2.40 1.17 -1.23 0.00 0.00 -0.85 -5.12 120.51 112.07 2jzi n ALA 147 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2jzi n ALA 147 Cb 0.85 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2jzi n ALA 147 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86