#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 -1.50 -3.85 0.00 8.00 -1.26 -5.00 116.55 112.94 2jzi n ASP 2 Ca 0.00 -0.12 -0.30 0.00 0.71 0.00 0.00 54.79 55.09 2jzi n ASP 2 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 40.97 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 -2.60 1.74 0.38 -1.24 0.74 -1.26 -5.07 119.66 112.36 2jzi s GLN 3 Ca 0.00 -2.43 0.04 0.00 0.05 0.00 0.00 55.36 53.02 2jzi s GLN 3 Cb 0.00 -2.94 -0.01 0.00 1.10 0.00 0.00 33.01 31.16 2jzi s GLN 3 CO 0.00 -1.14 0.55 -0.51 -0.55 0.00 0.00 175.29 173.64 2jzi s LEU 4 N -0.11 3.84 0.32 3.68 1.43 -1.26 -5.11 118.68 121.47 2jzi s LEU 4 Ca 0.18 0.03 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 2jzi s LEU 4 Cb -0.24 -2.94 -0.02 0.00 0.03 0.00 0.00 46.19 43.03 2jzi s LEU 4 CO -0.01 -0.54 0.48 0.42 0.23 0.00 0.00 176.35 176.93 2jzi s THR 5 N -2.33 4.67 0.20 5.49 -4.23 -1.26 -4.84 115.64 113.33 2jzi s THR 5 Ca 0.46 -0.82 -0.16 0.00 -1.18 0.00 0.00 61.69 59.99 2jzi s THR 5 Cb -0.10 -3.66 0.18 0.00 1.34 0.00 0.00 72.50 70.26 2jzi s THR 5 CO 0.34 -0.32 1.62 -0.08 -0.54 0.00 0.00 174.62 175.64 2jzi h GLU 6 N 0.88 -0.07 0.00 3.99 4.81 -1.99 0.99 114.58 123.19 2jzi h GLU 6 Ca -0.49 0.00 -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 0.58 -0.05 -0.17 0.93 -0.73 0.00 0.00 179.01 179.57 2jzi h GLU 7 N -0.07 0.00 0.06 1.92 4.39 -1.98 0.42 114.58 119.31 2jzi h GLU 7 Ca 0.26 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.96 2jzi h GLU 7 Cb 0.48 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 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 0.18 -3.29 115.11 115.33 2jzi h GLN 8 Ca -0.00 0.01 -0.12 0.00 -1.45 0.00 0.00 58.65 57.08 2jzi h GLN 8 Cb 0.36 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.79 2jzi h GLN 8 CO 0.02 0.47 -0.59 -0.84 -0.95 0.00 0.00 178.83 176.94 2jzi h ILE 9 N -0.69 1.32 -0.62 2.54 3.07 0.83 -2.88 117.51 121.07 2jzi h ILE 9 Ca -0.01 -2.10 0.18 0.00 1.55 0.00 0.00 64.86 64.48 2jzi h ILE 9 Cb 0.58 2.17 -0.02 0.00 -0.27 0.00 0.00 36.82 39.27 2jzi h ILE 9 CO 0.01 0.58 0.56 0.00 -1.05 0.00 0.00 178.15 178.25 2jzi h ALA 10 N 1.41 2.43 0.00 0.16 0.00 -0.24 1.68 119.26 124.70 2jzi h ALA 10 Ca -0.01 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 2jzi h ALA 10 Cb 1.12 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2jzi h ALA 10 CO 0.08 -0.88 -0.66 0.93 0.00 0.00 0.00 179.25 178.72 2jzi h GLU 11 N 0.00 0.00 0.03 0.00 5.08 -1.60 -2.90 114.58 115.19 2jzi h GLU 11 Ca 0.29 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2jzi h GLU 11 Cb 1.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.66 2jzi h GLU 11 CO -0.00 0.66 -0.02 0.74 -1.00 0.00 0.00 179.01 179.39 2jzi h PHE 12 N 0.00 -0.04 -0.09 4.33 -1.00 0.23 -3.18 116.94 117.20 2jzi h PHE 12 Ca -0.01 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.80 2jzi h PHE 12 Cb 1.28 0.01 -0.00 0.00 3.61 0.00 0.00 35.95 40.85 2jzi h PHE 12 CO 0.00 0.10 0.25 1.57 -1.61 0.00 0.00 178.31 178.62 2jzi h LYS 13 N -1.01 0.00 0.00 1.51 2.10 -1.23 1.24 116.57 119.18 2jzi h LYS 13 Ca -0.00 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.50 2jzi h LYS 13 Cb 0.16 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.47 2jzi h LYS 13 CO 0.01 0.00 -0.69 1.05 -2.00 0.00 0.00 179.45 177.82 2jzi h GLU 14 N 0.00 0.00 -0.11 0.07 4.11 -1.60 -2.12 114.58 114.93 2jzi h GLU 14 Ca 0.04 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.24 2jzi h GLU 14 Cb 0.54 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.81 2jzi h GLU 14 CO -0.00 0.69 -0.85 0.00 0.07 0.00 0.00 179.01 178.92 2jzi h ALA 15 N 1.31 0.25 0.11 1.06 0.00 0.15 0.50 119.26 122.63 2jzi h ALA 15 Ca -0.01 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2jzi h ALA 15 Cb 1.39 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2jzi h ALA 15 CO 0.09 0.68 -0.11 0.74 0.00 0.00 0.00 179.25 180.64 2jzi h PHE 16 N 0.49 -0.29 0.00 0.00 0.04 -1.00 0.39 116.94 116.57 2jzi h PHE 16 Ca -0.08 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.63 2jzi h PHE 16 Cb 1.49 0.11 -0.01 0.00 2.20 0.00 0.00 35.95 39.75 2jzi h PHE 16 CO 0.09 -0.17 -0.31 0.66 -0.60 0.00 0.00 178.31 177.98 2jzi h SER 17 N -0.25 0.00 1.26 2.17 4.64 -1.40 -2.80 113.55 117.18 2jzi h SER 17 Ca 0.01 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 2jzi h SER 17 Cb 0.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 2jzi h SER 17 CO -0.04 0.31 -0.76 0.25 -0.87 0.00 0.00 176.83 175.72 2jzi h LEU 18 N 0.00 0.00 -0.94 5.97 6.46 0.45 -3.22 115.31 124.03 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 0.95 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.88 2jzi h LEU 18 CO 0.04 0.59 -0.12 0.33 -0.62 0.00 0.00 178.44 178.65 2jzi n PHE 19 N -3.17 0.00 -3.99 1.25 7.35 0.13 -4.42 117.46 114.61 2jzi n PHE 19 Ca -0.01 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.34 2jzi n PHE 19 Cb 0.79 -0.04 -0.06 0.00 0.35 0.00 0.00 39.48 40.51 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 -2.20 6.09 0.08 -2.13 2.15 -1.06 -4.89 116.67 114.71 2jzi s ASP 20 Ca 0.31 0.31 -0.28 0.00 0.43 0.00 0.00 52.55 53.32 2jzi s ASP 20 Cb 0.20 -1.88 -0.17 0.00 -0.30 0.00 0.00 42.92 40.77 2jzi s ASP 20 CO 0.41 0.32 1.67 0.11 -0.17 0.00 0.00 175.17 177.51 2jzi h LYS 21 N 4.37 -0.44 -0.00 4.34 1.79 -1.87 -2.57 116.57 122.19 2jzi h LYS 21 Ca -0.51 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 2jzi h LYS 21 Cb 1.20 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.95 2jzi h LYS 21 CO 0.63 -0.29 -0.14 -0.40 -1.08 0.00 0.00 179.45 178.16 2jzi n ASP 22 N -5.28 0.48 -3.89 0.86 5.75 -1.26 -4.94 116.55 108.27 2jzi n ASP 22 Ca -0.10 -0.49 -0.26 0.00 -0.01 0.00 0.00 54.79 53.92 2jzi n ASP 22 Cb 0.20 -0.06 0.01 0.00 -1.03 0.00 0.00 41.12 40.24 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 1.32 -0.34 1.19 6.12 0.00 -0.97 -4.85 105.19 107.66 2jzi n GLY 23 Ca 0.13 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 3.40 0.00 1.61 5.68 -1.26 -4.84 116.55 118.20 2jzi n ASP 24 Ca -0.18 -2.43 0.00 0.00 -0.50 0.00 0.00 54.79 51.69 2jzi n ASP 24 Cb 0.62 -0.55 0.00 0.00 -1.14 0.00 0.00 41.12 40.06 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 0.50 0.75 3.26 6.12 0.00 -1.26 -4.97 105.19 109.58 2jzi n GLY 25 Ca 0.15 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 -2.81 0.05 -0.11 2.61 -4.23 -1.26 -4.24 115.64 105.66 2jzi s THR 26 Ca 0.00 -0.41 -0.06 0.00 -1.18 0.00 0.00 61.69 60.04 2jzi s THR 26 Cb 0.00 -0.63 -0.04 0.00 1.34 0.00 0.00 72.50 73.17 2jzi s THR 26 CO 0.00 -0.22 0.13 -0.63 -0.54 0.00 0.00 174.62 173.35 2jzi s ILE 27 N -1.21 5.37 0.84 2.99 1.01 -1.26 -4.64 121.20 124.30 2jzi s ILE 27 Ca -0.12 0.13 -0.09 0.00 0.00 0.00 0.00 60.65 60.56 2jzi s ILE 27 Cb -0.05 -3.34 0.16 0.00 0.01 0.00 0.00 42.46 39.23 2jzi s ILE 27 CO 0.04 0.59 1.16 0.28 0.00 0.00 0.00 174.94 177.02 2jzi s THR 28 N -1.04 2.08 0.15 2.92 -1.32 -1.26 -2.91 115.64 114.27 2jzi s THR 28 Ca 0.16 -0.26 -0.09 0.00 -1.21 0.00 0.00 61.69 60.28 2jzi s THR 28 Cb -0.12 -2.81 -0.05 0.00 -1.51 0.00 0.00 72.50 68.00 2jzi s THR 28 CO 0.05 0.00 1.47 0.71 -2.21 0.00 0.00 174.62 174.64 2jzi h THR 29 N -1.09 1.28 -0.93 5.08 1.35 -1.62 -1.27 112.91 115.71 2jzi h THR 29 Ca -0.41 -1.64 0.02 0.00 -0.55 0.00 0.00 66.41 63.83 2jzi h THR 29 Cb 1.26 1.51 -0.05 0.00 -1.73 0.00 0.00 68.15 69.14 2jzi h THR 29 CO 0.41 0.54 0.61 0.07 -0.25 0.00 0.00 175.52 176.90 2jzi h LYS 30 N 0.67 1.19 0.20 4.72 5.09 -1.93 1.00 116.57 127.51 2jzi h LYS 30 Ca 0.04 -0.07 -0.01 0.00 0.09 0.00 0.00 60.65 60.70 2jzi h LYS 30 Cb 1.04 -0.27 0.00 0.00 0.10 0.00 0.00 32.23 33.10 2jzi h LYS 30 CO 0.10 0.79 -0.10 0.93 -2.09 0.00 0.00 179.45 179.08 2jzi h GLU 31 N 1.22 -0.26 0.28 0.07 4.39 -1.90 0.48 114.58 118.86 2jzi h GLU 31 Ca 0.36 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 60.07 2jzi h GLU 31 Cb -0.07 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2jzi h GLU 31 CO -0.10 0.12 -0.24 -0.07 -1.16 0.00 0.00 179.01 177.57 2jzi h LEU 32 N -0.75 -0.62 -0.40 1.33 3.38 -1.06 0.60 115.31 117.79 2jzi h LEU 32 Ca -0.03 0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.02 2jzi h LEU 32 Cb 0.50 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 2jzi h LEU 32 CO 0.05 -0.35 0.21 1.23 0.09 0.00 0.00 178.44 179.66 2jzi h GLY 33 N -0.53 0.54 1.99 0.83 0.00 0.98 -1.47 103.07 105.42 2jzi h GLY 33 Ca -0.02 -0.15 -0.07 0.00 0.00 0.00 0.00 47.33 47.09 2jzi h GLY 33 CO -0.02 0.12 -0.34 -0.84 0.00 0.00 0.00 176.54 175.46 2jzi h THR 34 N 0.42 1.24 0.67 4.70 2.02 0.24 0.48 112.91 122.68 2jzi h THR 34 Ca 0.16 -1.16 -0.03 0.00 0.77 0.00 0.00 66.41 66.15 2jzi h THR 34 Cb 0.05 1.62 0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2jzi h THR 34 CO -0.10 0.33 -0.32 0.58 0.37 0.00 0.00 175.52 176.38 2jzi h VAL 35 N 0.01 0.23 -0.20 3.16 2.07 0.11 0.13 116.25 121.76 2jzi h VAL 35 Ca -0.00 -0.22 -0.19 0.00 0.82 0.00 0.00 66.70 67.11 2jzi h VAL 35 Cb 0.60 0.29 0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2jzi h VAL 35 CO 0.04 0.02 -0.61 -0.03 0.02 0.00 0.00 177.57 177.02 2jzi h MET 36 N -1.07 0.77 -0.92 1.57 -1.53 -1.26 -2.18 114.93 110.31 2jzi h MET 36 Ca -0.09 -0.56 0.01 0.00 -3.44 0.00 0.00 59.70 55.62 2jzi h MET 36 Cb 0.72 0.09 -0.05 0.00 -0.55 0.00 0.00 31.60 31.82 2jzi h MET 36 CO 0.15 1.18 0.60 -0.09 0.14 0.00 0.00 176.91 178.88 2jzi h ARG 37 N 0.50 1.22 0.00 0.39 2.43 -0.09 0.16 114.38 118.99 2jzi h ARG 37 Ca -0.02 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2jzi h ARG 37 Cb 1.23 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 30.51 2jzi h ARG 37 CO 0.13 0.82 0.00 0.45 -1.51 0.00 0.00 179.97 179.86 2jzi n SER 38 N -4.38 0.36 -0.08 -3.80 2.88 0.45 -3.07 113.62 105.97 2jzi n SER 38 Ca 0.11 0.54 -0.13 0.00 -1.33 0.00 0.00 58.87 58.05 2jzi n SER 38 Cb 0.03 -0.63 -0.07 0.00 -0.75 0.00 0.00 64.21 62.78 2jzi n SER 38 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2jzi h LEU 39 N 0.00 0.00 -2.46 2.46 6.46 -0.32 -3.47 115.31 117.99 2jzi h LEU 39 Ca 0.00 -0.36 -0.01 0.00 -0.12 0.00 0.00 57.88 57.39 2jzi h LEU 39 Cb 0.57 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.49 2jzi h LEU 39 CO 0.00 1.10 -0.01 0.61 -0.62 0.00 0.00 178.44 179.52 2jzi n GLY 40 N 1.55 -0.73 3.23 3.75 0.00 0.36 -5.07 105.19 108.28 2jzi n GLY 40 Ca -0.18 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 2jzi n GLY 40 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2jzi n GLN 41 N -0.05 0.50 -2.72 1.61 -0.06 -0.60 -4.96 117.38 111.09 2jzi n GLN 41 Ca -0.01 -3.34 -0.08 0.00 -2.00 0.00 0.00 57.00 51.57 2jzi n GLN 41 Cb 0.44 2.23 0.10 0.00 -4.06 0.00 0.00 30.24 28.95 2jzi n GLN 41 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13 2jzi n ASN 42 N -1.62 -2.14 -3.32 1.69 0.23 -1.26 -4.37 115.26 104.48 2jzi n ASN 42 Ca 0.00 -3.25 -0.20 0.00 -0.53 0.00 0.00 54.58 50.61 2jzi n ASN 42 Cb 0.60 1.57 0.14 0.00 -2.08 0.00 0.00 39.78 40.01 2jzi n ASN 42 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 2jzi n PRO 43 N 0.01 -0.85 -4.31 -0.53 -0.04 -1.26 -5.10 135.00 122.92 2jzi n PRO 43 Ca 0.03 -1.43 -0.28 0.00 -0.04 0.00 0.00 63.50 61.78 2jzi n PRO 43 Cb 0.75 -0.92 -0.10 0.00 -0.04 0.00 0.00 33.50 33.19 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 -2.96 2.94 0.12 0.52 2.01 -1.26 -5.03 115.64 111.98 2jzi s THR 44 Ca 0.51 -1.64 -0.20 0.00 0.31 0.00 0.00 61.69 60.67 2jzi s THR 44 Cb -0.01 -2.41 -0.05 0.00 0.01 0.00 0.00 72.50 70.04 2jzi s THR 44 CO 0.36 -0.02 1.72 -0.33 -0.69 0.00 0.00 174.62 175.66 2jzi h GLU 45 N 3.30 0.04 -0.27 4.92 4.39 -1.99 -0.70 114.58 124.28 2jzi h GLU 45 Ca -0.48 -0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.14 2jzi h GLU 45 Cb 1.19 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.82 2jzi h GLU 45 CO 0.50 0.03 -0.16 0.00 -1.16 0.00 0.00 179.01 178.22 2jzi h ALA 46 N 1.16 1.24 0.33 3.43 0.00 -1.98 -1.33 119.26 122.11 2jzi h ALA 46 Ca 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2jzi h ALA 46 Cb 0.11 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2jzi h ALA 46 CO -0.15 0.50 -0.16 0.93 0.00 0.00 0.00 179.25 180.37 2jzi h GLU 47 N 0.42 -0.43 -0.58 0.00 4.39 -1.84 0.04 114.58 116.58 2jzi h GLU 47 Ca 0.08 0.03 -0.07 0.00 0.34 0.00 0.00 59.36 59.74 2jzi h GLU 47 Cb 0.52 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 2jzi h GLU 47 CO 0.03 -0.15 0.09 1.37 -1.16 0.00 0.00 179.01 179.20 2jzi h LEU 48 N -0.70 0.89 -0.68 1.33 -0.00 -1.10 -1.74 115.31 113.31 2jzi h LEU 48 Ca -0.05 -0.20 -0.02 0.00 -0.00 0.00 0.00 57.88 57.61 2jzi h LEU 48 Cb 0.48 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 40.88 2jzi h LEU 48 CO 0.08 0.90 0.33 1.56 -0.00 0.00 0.00 178.44 181.30 2jzi h GLN 49 N 0.89 0.97 -0.25 0.17 4.20 -1.20 0.83 115.11 120.72 2jzi h GLN 49 Ca 0.18 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 2jzi h GLN 49 Cb 0.39 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 2jzi h GLN 49 CO 0.01 0.77 0.15 0.22 -0.67 0.00 0.00 178.83 179.31 2jzi h ASP 50 N 0.94 0.30 0.70 1.46 1.82 -0.59 -2.78 116.42 118.27 2jzi h ASP 50 Ca 0.23 -0.06 -0.16 0.00 -0.39 0.00 0.00 57.03 56.66 2jzi h ASP 50 Cb 0.12 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 40.03 2jzi h ASP 50 CO -0.03 0.28 -0.73 0.24 -1.61 0.00 0.00 179.24 177.39 2jzi h MET 51 N 0.31 0.02 -0.96 0.28 2.86 -1.06 -3.25 114.93 113.14 2jzi h MET 51 Ca 0.09 -0.02 0.15 0.00 -2.06 0.00 0.00 59.70 57.86 2jzi h MET 51 Cb 0.03 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.61 2jzi h MET 51 CO -0.02 0.74 0.61 0.82 1.06 0.00 0.00 176.91 180.12 2jzi h ILE 52 N 0.02 0.82 -1.23 -1.22 1.08 0.98 -0.93 117.51 117.02 2jzi h ILE 52 Ca -0.01 -0.27 0.36 0.00 -0.39 0.00 0.00 64.86 64.55 2jzi h ILE 52 Cb 1.29 -0.04 -0.05 0.00 -3.07 0.00 0.00 36.82 34.95 2jzi h ILE 52 CO 0.10 0.14 1.00 0.78 -0.69 0.00 0.00 178.15 179.48 2jzi h ASN 53 N 0.79 0.00 0.27 1.72 4.21 -1.57 1.01 115.58 122.01 2jzi h ASN 53 Ca 0.50 0.00 -0.28 0.00 1.21 0.00 0.00 56.30 57.73 2jzi h ASN 53 Cb 0.72 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 37.94 2jzi h ASN 53 CO -0.27 0.00 -1.17 -0.33 -1.29 0.00 0.00 177.43 174.37 2jzi h GLU 54 N 0.00 0.51 0.00 0.81 3.07 -1.41 -3.21 114.58 114.36 2jzi h GLU 54 Ca 0.59 -0.68 0.00 0.00 -0.50 0.00 0.00 59.36 58.77 2jzi h GLU 54 Cb 2.57 0.22 0.00 0.00 -0.84 0.00 0.00 28.75 30.70 2jzi h GLU 54 CO -0.01 1.29 -0.11 1.33 -1.40 0.00 0.00 179.01 180.11 2jzi n VAL 55 N -3.73 0.20 -4.03 3.13 0.24 0.31 -4.83 118.33 109.62 2jzi n VAL 55 Ca -0.11 -0.11 -0.26 0.00 -2.04 0.00 0.00 64.34 61.83 2jzi n VAL 55 Cb 0.96 -0.40 -0.04 0.00 -1.47 0.00 0.00 33.84 32.88 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 -3.54 5.84 0.08 -1.34 2.15 0.92 -4.58 116.67 116.20 2jzi s ASP 56 Ca 0.12 -0.02 0.11 0.00 0.43 0.00 0.00 52.55 53.19 2jzi s ASP 56 Cb 0.16 -1.62 -0.17 0.00 -0.30 0.00 0.00 42.92 41.00 2jzi s ASP 56 CO 0.59 0.05 1.05 0.00 -0.17 0.00 0.00 175.17 176.68 2jzi h ALA 57 N 2.20 0.57 -0.00 3.66 0.00 -1.84 -3.36 119.26 120.50 2jzi h ALA 57 Ca -0.48 -1.01 0.00 0.00 0.00 0.00 0.00 54.91 53.41 2jzi h ALA 57 Cb 1.20 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2jzi h ALA 57 CO 0.65 1.22 -0.18 -0.40 0.00 0.00 0.00 179.25 180.55 2jzi n ASP 58 N -3.17 0.21 -3.26 0.00 5.68 -1.26 -5.05 116.55 109.70 2jzi n ASP 58 Ca -0.06 -0.61 -0.13 0.00 -0.50 0.00 0.00 54.79 53.49 2jzi n ASP 58 Cb 0.93 0.97 0.05 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 1.07 -1.17 0.75 6.12 0.00 -1.26 -4.94 105.19 105.76 2jzi n GLY 59 Ca 0.01 0.54 0.08 0.00 0.00 0.00 0.00 46.02 46.65 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 -2.74 3.55 0.00 1.61 6.94 -1.26 -4.81 115.26 118.55 2jzi n ASN 60 Ca -0.06 -2.87 0.00 0.00 -0.02 0.00 0.00 54.58 51.63 2jzi n ASN 60 Cb 0.58 -0.48 0.00 0.00 -2.36 0.00 0.00 39.78 37.53 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 -0.48 0.56 3.44 4.83 0.00 -1.26 -4.97 105.19 107.31 2jzi n GLY 61 Ca 0.19 -0.77 -0.14 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.44 115.64 109.25 2jzi s THR 62 Ca 0.00 -1.68 0.04 0.00 -1.18 0.00 0.00 61.69 58.87 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 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.27 2jzi s ILE 63 N -3.36 2.66 0.78 2.99 1.01 -1.14 -4.19 121.20 119.94 2jzi s ILE 63 Ca 0.32 -0.85 -0.07 0.00 0.00 0.00 0.00 60.65 60.05 2jzi s ILE 63 Cb 0.01 -2.03 0.17 0.00 0.01 0.00 0.00 42.46 40.62 2jzi s ILE 63 CO 0.19 0.57 1.06 0.47 0.00 0.00 0.00 174.94 177.23 2jzi n ASP 64 N 2.77 0.71 0.18 3.58 8.00 -1.26 -4.08 116.55 126.45 2jzi n ASP 64 Ca -0.17 -1.77 -0.13 0.00 0.71 0.00 0.00 54.79 53.43 2jzi n ASP 64 Cb 0.52 -0.75 -0.07 0.00 -0.02 0.00 0.00 41.12 40.80 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 -1.11 -0.46 -0.33 1.24 -1.00 -2.00 -0.93 116.94 112.36 2jzi h PHE 65 Ca -0.35 -0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.35 2jzi h PHE 65 Cb 1.11 0.15 -0.02 0.00 3.61 0.00 0.00 35.95 40.80 2jzi h PHE 65 CO 0.00 -0.13 -0.11 -1.00 -1.61 0.00 0.00 178.31 175.47 2jzi h PRO 66 N -0.89 0.56 0.21 1.51 0.13 -1.99 -1.60 132.00 129.94 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 0.54 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.61 2jzi h PRO 66 CO 0.08 0.66 -0.10 0.93 -0.23 0.00 0.00 178.00 179.35 2jzi h GLU 67 N 0.52 -0.27 0.45 0.86 4.39 -1.88 0.21 114.58 118.85 2jzi h GLU 67 Ca 0.10 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 2jzi h GLU 67 Cb 0.50 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 2jzi h GLU 67 CO 0.03 -0.08 -0.36 0.35 -1.16 0.00 0.00 179.01 177.79 2jzi h PHE 68 N -0.41 -0.96 -0.36 4.33 3.04 -0.99 0.21 116.94 121.79 2jzi h PHE 68 Ca -0.03 -0.00 0.04 0.00 3.98 0.00 0.00 57.97 61.96 2jzi h PHE 68 Cb 0.32 0.36 -0.04 0.00 2.56 0.00 0.00 35.95 39.15 2jzi h PHE 68 CO -0.02 -0.52 0.14 -0.07 -2.02 0.00 0.00 178.31 175.81 2jzi h LEU 69 N -0.80 0.16 -1.92 0.59 3.38 -1.30 -0.09 115.31 115.32 2jzi h LEU 69 Ca -0.04 0.04 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2jzi h LEU 69 Cb 0.69 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2jzi h LEU 69 CO -0.01 0.13 0.11 0.74 0.09 0.00 0.00 178.44 179.50 2jzi h THR 70 N 0.29 0.97 0.61 0.22 2.02 -0.37 0.83 112.91 117.48 2jzi h THR 70 Ca 0.16 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 67.28 2jzi h THR 70 Cb 0.13 0.86 0.01 0.00 -1.74 0.00 0.00 68.15 67.41 2jzi h THR 70 CO -0.16 0.02 -0.29 -0.03 0.37 0.00 0.00 175.52 175.43 2jzi h MET 71 N 0.10 -0.79 -0.30 6.66 -1.53 0.12 -2.81 114.93 116.38 2jzi h MET 71 Ca 0.07 0.05 -0.14 0.00 -3.44 0.00 0.00 59.70 56.25 2jzi h MET 71 Cb 0.16 0.18 -0.01 0.00 -0.55 0.00 0.00 31.60 31.38 2jzi h MET 71 CO -0.01 -0.52 -0.37 0.52 0.14 0.00 0.00 176.91 176.66 2jzi h MET 72 N -1.05 0.71 -0.02 0.39 2.86 -1.11 -2.81 114.93 113.90 2jzi h MET 72 Ca -0.08 -0.35 0.01 0.00 -2.06 0.00 0.00 59.70 57.21 2jzi h MET 72 Cb 0.63 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.29 2jzi h MET 72 CO 0.14 0.96 0.10 0.00 1.06 0.00 0.00 176.91 179.18 2jzi h ALA 73 N 1.00 1.22 -1.13 6.32 0.00 0.61 -3.42 119.26 123.86 2jzi h ALA 73 Ca 0.05 -0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.38 2jzi h ALA 73 Cb 0.91 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2jzi h ALA 73 CO 0.08 -0.11 1.54 -2.13 0.00 0.00 0.00 179.25 178.62 2jzi n ARG 74 N -3.18 0.98 0.30 0.00 3.00 -1.06 -4.34 116.66 112.36 2jzi n ARG 74 Ca -0.02 0.19 0.20 0.00 -0.00 0.00 0.00 57.85 58.22 2jzi n ARG 74 Cb 0.17 -2.63 1.03 0.00 0.00 0.00 0.00 32.46 31.03 2jzi n ARG 74 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 2jzi h LYS 75 N 14.42 0.00 0.00 -0.14 1.63 -1.91 -1.46 116.57 129.12 2jzi h LYS 75 Ca -0.24 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.48 2jzi h LYS 75 Cb 1.30 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.92 2jzi h LYS 75 CO 1.11 0.00 -0.40 1.98 -3.45 0.00 0.00 179.45 178.68 2jzi h MET 76 N 0.00 0.00 -6.22 1.90 4.05 -1.94 -3.41 114.93 109.30 2jzi h MET 76 Ca 0.00 0.00 -0.58 0.00 -0.28 0.00 0.00 59.70 58.84 2jzi h MET 76 Cb 0.10 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 30.84 2jzi h MET 76 CO 0.00 0.40 0.83 0.21 0.23 0.00 0.00 176.91 178.58 2jzi s LYS 77 N -4.03 4.14 0.28 0.39 2.47 -0.55 -5.01 119.74 117.43 2jzi s LYS 77 Ca -0.02 1.18 0.05 0.00 -1.56 0.00 0.00 55.97 55.62 2jzi s LYS 77 Cb 0.14 -3.70 -0.02 0.00 -1.46 0.00 0.00 37.83 32.79 2jzi s LYS 77 CO 0.72 -0.80 0.18 -3.47 0.16 0.00 0.00 175.35 172.15 2jzi n ASP 78 N 6.65 0.05 -2.55 1.43 -0.08 -1.26 -4.97 116.55 115.82 2jzi n ASP 78 Ca 0.12 -2.69 -0.05 0.00 -1.51 0.00 0.00 54.79 50.67 2jzi n ASP 78 Cb 0.47 1.12 -0.04 0.00 2.34 0.00 0.00 41.12 45.01 2jzi n ASP 78 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2jzi n THR 79 N -0.57-13.17 0.00 5.18 -1.04 -1.26 -4.98 114.28 98.44 2jzi n THR 79 Ca 0.02 2.92 0.00 0.00 -2.04 0.00 0.00 64.05 64.96 2jzi n THR 79 Cb 0.47 -6.48 0.00 0.00 -1.82 0.00 0.00 70.33 62.50 2jzi n THR 79 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2jzi n ASP 80 N 1.76 0.00 -0.11 8.00 2.03 -1.26 -4.97 116.55 122.01 2jzi n ASP 80 Ca -0.33 0.00 0.22 0.00 0.52 0.00 0.00 54.79 55.20 2jzi n ASP 80 Cb 0.52 0.00 0.65 0.00 -0.72 0.00 0.00 41.12 41.57 2jzi n ASP 80 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2jzi h SER 81 N 0.00 0.10 0.84 1.67 0.87 -2.00 0.32 113.55 115.36 2jzi h SER 81 Ca 0.00 0.01 -0.24 0.00 -1.23 0.00 0.00 61.79 60.33 2jzi h SER 81 Cb 0.00 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 2jzi h SER 81 CO 0.00 0.05 -1.14 -0.33 -0.53 0.00 0.00 176.83 174.88 2jzi h GLU 82 N 0.10 0.09 0.07 2.24 3.07 -2.02 -3.33 114.58 114.80 2jzi h GLU 82 Ca 0.35 -0.16 -0.23 0.00 -0.50 0.00 0.00 59.36 58.81 2jzi h GLU 82 Cb 1.22 0.06 0.02 0.00 -0.84 0.00 0.00 28.75 29.21 2jzi h GLU 82 CO -0.04 1.05 -0.94 0.93 -1.40 0.00 0.00 179.01 178.60 2jzi h GLU 83 N 0.03 0.52 -0.68 2.33 4.39 -1.16 -3.26 114.58 116.74 2jzi h GLU 83 Ca -0.07 -0.65 0.20 0.00 0.34 0.00 0.00 59.36 59.17 2jzi h GLU 83 Cb 1.86 0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 30.68 2jzi h GLU 83 CO 0.15 1.27 0.51 1.05 -1.16 0.00 0.00 179.01 180.83 2jzi h GLU 84 N 0.08 0.00 0.10 2.33 -0.00 -0.62 0.71 114.58 117.17 2jzi h GLU 84 Ca -0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 59.22 2jzi h GLU 84 Cb 1.65 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.40 2jzi h GLU 84 CO 0.18 0.00 -0.05 0.82 -0.00 0.00 0.00 179.01 179.96 2jzi h ILE 85 N 0.00 1.07 0.01 -1.06 2.04 -1.66 -0.69 117.51 117.21 2jzi h ILE 85 Ca 0.32 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 2jzi h ILE 85 Cb 1.35 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 2jzi h ILE 85 CO -0.00 0.16 -0.01 0.03 0.00 0.00 0.00 178.15 178.33 2jzi h ARG 86 N -0.44 -0.02 -0.64 2.37 -0.00 -1.36 -3.08 114.38 111.21 2jzi h ARG 86 Ca -0.01 0.00 0.17 0.00 -0.50 0.00 0.00 59.98 59.64 2jzi h ARG 86 Cb 0.36 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 30.31 2jzi h ARG 86 CO 0.02 0.73 0.45 0.93 0.00 0.00 0.00 179.97 182.10 2jzi h GLU 87 N -0.81 0.06 -0.26 0.04 5.08 0.27 0.13 114.58 119.10 2jzi h GLU 87 Ca -0.00 -0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 2jzi h GLU 87 Cb 0.75 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.99 2jzi h GLU 87 CO 0.00 0.04 -0.54 0.00 -1.00 0.00 0.00 179.01 177.52 2jzi h ALA 88 N 1.68 0.55 0.39 3.43 0.00 -1.15 -2.50 119.26 121.67 2jzi h ALA 88 Ca 0.31 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2jzi h ALA 88 Cb 1.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2jzi h ALA 88 CO -0.02 0.68 -0.19 0.35 0.00 0.00 0.00 179.25 180.07 2jzi h PHE 89 N 0.59 -0.49 -0.64 0.00 3.57 -0.69 0.62 116.94 119.91 2jzi h PHE 89 Ca 0.02 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 61.68 2jzi h PHE 89 Cb 1.12 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 40.00 2jzi h PHE 89 CO 0.06 -0.16 0.45 0.07 -2.23 0.00 0.00 178.31 176.51 2jzi h ARG 90 N -0.88 0.05 0.00 1.11 0.11 -1.33 0.44 114.38 113.87 2jzi h ARG 90 Ca -0.05 -0.00 -0.08 0.00 0.10 0.00 0.00 59.98 59.94 2jzi h ARG 90 Cb 0.55 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.60 2jzi h ARG 90 CO 0.09 0.03 -1.05 0.28 0.10 0.00 0.00 179.97 179.42 2jzi h VAL 91 N 0.05 0.29 -0.61 0.08 2.07 -1.31 -3.34 116.25 113.48 2jzi h VAL 91 Ca 0.30 -1.52 0.13 0.00 0.82 0.00 0.00 66.70 66.43 2jzi h VAL 91 Cb 1.14 1.84 -0.03 0.00 -1.52 0.00 0.00 31.29 32.72 2jzi h VAL 91 CO -0.02 0.16 0.42 0.15 0.02 0.00 0.00 177.57 178.30 2jzi h PHE 92 N 0.00 0.30 -2.99 1.57 3.57 0.50 -3.41 116.94 116.48 2jzi h PHE 92 Ca -0.07 0.01 -0.63 0.00 3.53 0.00 0.00 57.97 60.81 2jzi h PHE 92 Cb 1.28 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.86 2jzi h PHE 92 CO 0.00 0.13 -0.54 0.34 -2.23 0.00 0.00 178.31 176.01 2jzi s ASP 93 N -6.16 6.04 0.19 0.41 -1.08 -1.16 -4.72 116.67 110.19 2jzi s ASP 93 Ca -0.07 0.19 -0.05 0.00 -0.52 0.00 0.00 52.55 52.10 2jzi s ASP 93 Cb 0.20 -1.79 0.11 0.00 -1.46 0.00 0.00 42.92 39.98 2jzi s ASP 93 CO 0.75 0.20 1.54 0.11 0.52 0.00 0.00 175.17 178.29 2jzi h LYS 94 N 3.42 0.72 -0.00 4.34 1.57 -1.88 -3.30 116.57 121.44 2jzi h LYS 94 Ca -0.47 -0.37 0.00 0.00 -1.87 0.00 0.00 60.65 57.94 2jzi h LYS 94 Cb 1.17 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2jzi h LYS 94 CO 0.70 0.99 -0.38 -0.40 -0.57 0.00 0.00 179.45 179.79 2jzi n ASP 95 N -4.04 0.42 -0.03 0.86 5.68 -1.26 -5.01 116.55 113.17 2jzi n ASP 95 Ca -0.02 -0.71 0.00 0.00 -0.50 0.00 0.00 54.79 53.56 2jzi n ASP 95 Cb 0.53 0.98 0.00 0.00 -1.14 0.00 0.00 41.12 41.48 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 1.18 0.60 0.10 6.12 0.00 -1.24 -4.93 105.19 107.01 2jzi n GLY 96 Ca 0.02 -0.77 0.10 0.00 0.00 0.00 0.00 46.02 45.37 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 1.72 0.48 0.00 1.61 5.03 -1.26 -4.83 115.26 118.01 2jzi n ASN 97 Ca 0.00 0.64 0.00 0.00 0.87 0.00 0.00 54.58 56.09 2jzi n ASN 97 Cb 0.44 -0.74 0.00 0.00 -1.02 0.00 0.00 39.78 38.46 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 -0.35 1.34 3.20 7.41 0.00 -1.26 -5.06 105.19 110.48 2jzi n GLY 98 Ca 0.02 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 -2.30 1.54 -0.26 1.61 2.02 -1.26 -3.48 117.35 115.22 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 -0.90 0.06 0.00 -0.40 0.00 0.00 41.96 40.72 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 -0.87 2.05 0.91 2.71 -4.36 -1.25 -4.73 121.20 115.66 2jzi s ILE 100 Ca 0.04 -1.56 -0.13 0.00 -0.26 0.00 0.00 60.65 58.74 2jzi s ILE 100 Cb -0.09 -2.19 0.18 0.00 1.25 0.00 0.00 42.46 41.62 2jzi s ILE 100 CO 0.02 -0.04 1.26 -0.44 0.24 0.00 0.00 174.94 175.97 2jzi s SER 101 N 1.16 3.38 0.47 4.36 0.01 -1.26 -4.26 113.70 117.56 2jzi s SER 101 Ca -0.08 0.17 0.19 0.00 1.31 0.00 0.00 55.95 57.53 2jzi s SER 101 Cb -0.20 -0.29 1.14 0.00 0.21 0.00 0.00 66.02 66.89 2jzi s SER 101 CO -0.05 -2.55 2.01 0.00 0.41 0.00 0.00 173.24 173.06 2jzi h ALA 102 N -1.42 1.53 0.66 1.44 0.00 -1.89 0.43 119.26 119.99 2jzi h ALA 102 Ca -0.43 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 2jzi h ALA 102 Cb 1.24 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.01 2jzi h ALA 102 CO 0.39 0.22 -0.31 0.00 0.00 0.00 0.00 179.25 179.55 2jzi h ALA 103 N 1.82 -0.88 0.03 0.00 0.00 -1.98 -2.00 119.26 116.25 2jzi h ALA 103 Ca -0.00 -0.21 -0.27 0.00 0.00 0.00 0.00 54.91 54.43 2jzi h ALA 103 Cb 0.35 0.34 0.02 0.00 0.00 0.00 0.00 17.79 18.50 2jzi h ALA 103 CO 0.02 -0.91 -1.07 0.93 0.00 0.00 0.00 179.25 178.22 2jzi h GLU 104 N -1.05 0.60 -0.56 0.00 4.39 -1.91 -3.10 114.58 112.96 2jzi h GLU 104 Ca -0.09 -0.69 0.10 0.00 0.34 0.00 0.00 59.36 59.02 2jzi h GLU 104 Cb 0.71 0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 29.54 2jzi h GLU 104 CO 0.15 1.28 0.38 1.25 -1.16 0.00 0.00 179.01 180.91 2jzi h LEU 105 N 0.32 0.32 -0.00 1.33 6.46 -0.22 0.61 115.31 124.12 2jzi h LEU 105 Ca -0.13 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.62 2jzi h LEU 105 Cb 1.73 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 41.60 2jzi h LEU 105 CO 0.20 0.19 -0.06 -0.09 -0.62 0.00 0.00 178.44 178.07 2jzi h ARG 106 N 0.36 0.05 -0.65 1.25 2.43 -1.37 -0.50 114.38 115.95 2jzi h ARG 106 Ca 0.26 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.38 2jzi h ARG 106 Cb 0.54 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.07 2jzi h ARG 106 CO -0.06 0.77 0.38 0.45 -1.51 0.00 0.00 179.97 180.00 2jzi h HIS 107 N -0.67 0.85 -0.08 2.20 3.86 -1.36 0.81 115.15 120.75 2jzi h HIS 107 Ca -0.01 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.11 2jzi h HIS 107 Cb 0.79 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.98 2jzi h HIS 107 CO 0.18 0.57 -0.31 0.28 0.86 0.00 0.00 177.93 179.51 2jzi h VAL 108 N 0.89 1.41 0.13 2.45 2.07 -0.94 -2.57 116.25 119.68 2jzi h VAL 108 Ca 0.23 -1.68 -0.01 0.00 0.82 0.00 0.00 66.70 66.06 2jzi h VAL 108 Cb -0.03 2.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 2jzi h VAL 108 CO -0.04 0.49 -0.06 0.24 0.02 0.00 0.00 177.57 178.21 2jzi h MET 109 N -0.12 -0.17 -0.76 1.57 2.07 -0.77 -3.03 114.93 113.73 2jzi h MET 109 Ca -0.02 0.01 0.09 0.00 -2.07 0.00 0.00 59.70 57.71 2jzi h MET 109 Cb 0.95 0.04 -0.07 0.00 -1.87 0.00 0.00 31.60 30.65 2jzi h MET 109 CO 0.07 0.30 0.42 1.15 1.07 0.00 0.00 176.91 179.92 2jzi h THR 110 N -0.87 0.91 -0.17 2.22 2.02 0.55 1.13 112.91 118.71 2jzi h THR 110 Ca -0.02 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.90 2jzi h THR 110 Cb 0.54 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 2jzi h THR 110 CO 0.03 0.13 0.05 -1.13 0.37 0.00 0.00 175.52 174.97 2jzi h ASN 111 N 0.73 0.21 -0.61 4.18 -0.73 -1.56 -2.70 115.58 115.09 2jzi h ASN 111 Ca 0.36 -0.02 -0.44 0.00 1.87 0.00 0.00 56.30 58.08 2jzi h ASN 111 Cb 0.32 -0.05 -0.38 0.00 0.27 0.00 0.00 38.32 38.48 2jzi h ASN 111 CO -0.24 0.21 -0.83 0.18 -0.37 0.00 0.00 177.43 176.38 2jzi n LEU 112 N -4.44 4.15 0.00 0.34 4.32 -0.17 -4.76 117.00 116.44 2jzi n LEU 112 Ca -0.00 -4.37 0.00 0.00 -0.02 0.00 0.00 56.01 51.62 2jzi n LEU 112 Cb 0.13 -0.24 0.00 0.00 -1.62 0.00 0.00 43.42 41.69 2jzi n LEU 112 CO 0.35 1.86 0.00 0.61 -1.22 0.00 0.00 177.39 178.99 2jzi n GLY 113 N -0.71 0.74 3.36 -0.72 0.00 0.37 -4.91 105.19 103.31 2jzi n GLY 113 Ca 0.35 0.45 -0.18 0.00 0.00 0.00 0.00 46.02 46.64 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 2.70 1.54 -0.68 1.61 -1.05 -1.25 -4.88 118.70 116.68 2jzi s GLU 114 Ca 0.00 -1.86 -0.27 0.00 -0.15 0.00 0.00 54.97 52.69 2jzi s GLU 114 Cb 0.00 -0.32 0.01 0.00 -0.44 0.00 0.00 34.13 33.37 2jzi s GLU 114 CO 0.00 -0.34 1.54 0.21 0.95 0.00 0.00 175.26 177.62 2jzi s LYS 115 N -3.93 2.94 -0.34 -4.83 2.20 -1.26 -3.74 119.74 110.78 2jzi s LYS 115 Ca 0.36 0.15 -0.21 0.00 -0.36 0.00 0.00 55.97 55.90 2jzi s LYS 115 Cb 0.07 -4.27 0.00 0.00 -1.51 0.00 0.00 37.83 32.12 2jzi s LYS 115 CO 0.15 -2.41 0.69 -0.48 -0.36 0.00 0.00 175.35 172.94 2jzi s LEU 116 N 7.24 4.18 1.09 5.43 2.34 -1.26 -5.03 118.68 132.67 2jzi s LEU 116 Ca 0.50 0.32 -0.16 0.00 0.06 0.00 0.00 54.13 54.84 2jzi s LEU 116 Cb -0.10 -2.88 0.24 0.00 -0.56 0.00 0.00 46.19 42.88 2jzi s LEU 116 CO 0.18 -0.60 1.14 -0.89 -1.06 0.00 0.00 176.35 175.11 2jzi s THR 117 N 2.81 1.79 0.42 5.48 2.01 -1.26 -4.35 115.64 122.54 2jzi s THR 117 Ca 0.27 0.00 0.22 0.00 0.31 0.00 0.00 61.69 62.49 2jzi s THR 117 Cb -0.14 -2.59 0.42 0.00 0.01 0.00 0.00 72.50 70.20 2jzi s THR 117 CO 0.14 0.00 1.75 -0.78 -0.69 0.00 0.00 174.62 175.05 2jzi h ASP 118 N -2.17 0.38 0.39 3.53 3.58 -1.98 0.80 116.42 120.94 2jzi h ASP 118 Ca -0.48 0.08 -0.25 0.00 0.42 0.00 0.00 57.03 56.80 2jzi h ASP 118 Cb 1.30 0.03 0.01 0.00 1.72 0.00 0.00 39.33 42.38 2jzi h ASP 118 CO 0.44 0.04 -1.07 -0.33 -2.88 0.00 0.00 179.24 175.44 2jzi h GLU 119 N 0.32 0.40 -0.14 0.28 4.39 -1.98 -0.93 114.58 116.92 2jzi h GLU 119 Ca 0.62 -0.51 -0.15 0.00 0.34 0.00 0.00 59.36 59.67 2jzi h GLU 119 Cb 1.71 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 30.51 2jzi h GLU 119 CO -0.29 1.18 -0.55 0.93 -1.16 0.00 0.00 179.01 179.12 2jzi h GLU 120 N 0.19 0.41 0.00 2.33 4.39 -0.31 0.16 114.58 121.76 2jzi h GLU 120 Ca -0.11 -0.25 -0.00 0.00 0.34 0.00 0.00 59.36 59.33 2jzi h GLU 120 Cb 1.74 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 30.41 2jzi h GLU 120 CO 0.19 0.85 -0.00 0.28 -1.16 0.00 0.00 179.01 179.16 2jzi h VAL 121 N 0.32 1.54 0.28 3.13 2.07 0.30 -2.58 116.25 121.30 2jzi h VAL 121 Ca 0.01 -1.60 -0.01 0.00 0.82 0.00 0.00 66.70 65.92 2jzi h VAL 121 Cb 1.06 2.63 0.00 0.00 -1.52 0.00 0.00 31.29 33.46 2jzi h VAL 121 CO 0.09 0.41 -0.14 0.44 0.02 0.00 0.00 177.57 178.40 2jzi h ASP 122 N -0.68 -0.34 -0.28 0.57 3.32 -1.17 -0.46 116.42 117.38 2jzi h ASP 122 Ca -0.00 0.02 0.08 0.00 0.02 0.00 0.00 57.03 57.15 2jzi h ASP 122 Cb 0.68 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 2jzi h ASP 122 CO 0.00 -0.24 0.22 1.05 -1.72 0.00 0.00 179.24 178.55 2jzi h GLU 123 N -0.39 0.00 0.02 3.56 -0.00 -0.78 -0.07 114.58 116.93 2jzi h GLU 123 Ca -0.03 0.00 -0.26 0.00 -0.00 0.00 0.00 59.36 59.06 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 0.05 0.00 -1.06 1.98 -0.00 0.00 0.00 179.01 179.98 2jzi h MET 124 N 0.00 0.61 -0.06 1.06 4.05 -0.96 -2.86 114.93 116.77 2jzi h MET 124 Ca 0.13 -0.69 -0.01 0.00 -0.28 0.00 0.00 59.70 58.86 2jzi h MET 124 Cb 0.57 0.20 -0.00 0.00 -0.80 0.00 0.00 31.60 31.57 2jzi h MET 124 CO -0.00 1.28 0.00 0.82 0.23 0.00 0.00 176.91 179.24 2jzi h ILE 125 N 0.33 1.25 -0.99 1.77 2.04 0.56 0.44 117.51 122.90 2jzi h ILE 125 Ca -0.13 -0.76 0.01 0.00 1.00 0.00 0.00 64.86 64.98 2jzi h ILE 125 Cb 1.72 1.65 -0.05 0.00 -0.74 0.00 0.00 36.82 39.39 2jzi h ILE 125 CO 0.20 0.21 0.65 0.03 0.00 0.00 0.00 178.15 179.24 2jzi h ARG 126 N -0.19 1.31 0.18 2.37 3.08 -1.21 0.26 114.38 120.18 2jzi h ARG 126 Ca 0.02 -0.08 -0.31 0.00 0.07 0.00 0.00 59.98 59.67 2jzi h ARG 126 Cb 0.33 -0.29 0.02 0.00 0.08 0.00 0.00 29.97 30.11 2jzi h ARG 126 CO 0.00 0.87 -1.41 1.05 -1.07 0.00 0.00 179.97 179.41 2jzi h GLU 127 N 1.35 0.38 -0.42 0.04 4.11 -1.48 -3.30 114.58 115.25 2jzi h GLU 127 Ca 0.36 -0.65 -0.09 0.00 0.07 0.00 0.00 59.36 59.05 2jzi h GLU 127 Cb -0.14 0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2jzi h GLU 127 CO -0.08 1.30 -0.11 0.00 0.07 0.00 0.00 179.01 180.20 2jzi h ALA 128 N 0.37 1.02 -2.88 1.06 0.00 0.12 -3.43 119.26 115.52 2jzi h ALA 128 Ca -0.21 -0.31 -0.63 0.00 0.00 0.00 0.00 54.91 53.76 2jzi h ALA 128 Cb 2.07 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 19.64 2jzi h ALA 128 CO 0.22 0.59 -0.50 0.34 0.00 0.00 0.00 179.25 179.90 2jzi s ASP 129 N -6.70 6.30 -0.05 0.00 2.15 0.89 -4.30 116.67 114.96 2jzi s ASP 129 Ca -0.09 0.29 -0.13 0.00 0.43 0.00 0.00 52.55 53.05 2jzi s ASP 129 Cb 0.14 -1.95 -0.31 0.00 -0.30 0.00 0.00 42.92 40.51 2jzi s ASP 129 CO 0.82 0.22 0.69 0.16 -0.17 0.00 0.00 175.17 176.88 2jzi h ILE 130 N 2.47 1.00 0.00 4.11 3.07 -1.84 -3.30 117.51 123.03 2jzi h ILE 130 Ca -0.47 -2.51 0.00 0.00 1.55 0.00 0.00 64.86 63.43 2jzi h ILE 130 Cb 1.17 2.80 0.00 0.00 -0.27 0.00 0.00 36.82 40.52 2jzi h ILE 130 CO 0.72 0.82 0.00 0.47 -1.05 0.00 0.00 178.15 179.11 2jzi n ASP 131 N -3.68 0.14 -3.00 2.16 9.92 -1.26 -4.83 116.55 116.01 2jzi n ASP 131 Ca -0.24 0.54 -0.12 0.00 -0.53 0.00 0.00 54.79 54.44 2jzi n ASP 131 Cb 1.04 -0.57 -0.02 0.00 -0.64 0.00 0.00 41.12 40.94 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 -0.17 -0.48 0.02 0.44 0.00 -1.24 -4.73 105.19 99.03 2jzi n GLY 132 Ca 0.03 0.02 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 -1.81 0.67 0.00 1.61 5.75 -1.26 -4.96 116.55 116.54 2jzi n ASP 133 Ca 0.01 -0.46 0.00 0.00 -0.01 0.00 0.00 54.79 54.33 2jzi n ASP 133 Cb 0.51 0.90 0.00 0.00 -1.03 0.00 0.00 41.12 41.50 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 1.42 1.26 3.15 6.12 0.00 -1.26 -5.10 105.19 110.77 2jzi n GLY 134 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.01 0.47 -0.24 1.61 -2.07 -1.26 -4.37 119.66 113.79 2jzi s GLN 135 Ca 0.00 -0.10 -0.01 0.00 -1.82 0.00 0.00 55.36 53.43 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 -0.87 0.98 0.90 3.63 1.01 -1.26 -4.66 120.40 120.12 2jzi s VAL 136 Ca -0.10 -1.02 -0.14 0.00 0.00 0.00 0.00 61.98 60.73 2jzi s VAL 136 Cb -0.05 -1.47 0.15 0.00 0.00 0.00 0.00 36.38 35.01 2jzi s VAL 136 CO 0.02 -0.29 1.26 0.21 0.00 0.00 0.00 175.10 176.30 2jzi s ASN 137 N 1.63 3.70 0.04 3.32 2.47 -1.23 -3.90 114.94 120.97 2jzi s ASN 137 Ca 0.00 0.48 -0.10 0.00 0.42 0.00 0.00 52.86 53.67 2jzi s ASN 137 Cb -0.18 -0.71 -0.03 0.00 -1.45 0.00 0.00 41.25 38.88 2jzi s ASN 137 CO -0.11 -2.39 1.16 0.22 -3.72 0.00 0.00 177.10 172.26 2jzi h TYR 138 N -1.40 -0.50 -0.42 0.43 3.20 -1.95 -1.29 116.97 115.04 2jzi h TYR 138 Ca -0.45 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.45 2jzi h TYR 138 Cb 1.27 0.24 -0.02 0.00 1.54 0.00 0.00 36.73 39.76 2jzi h TYR 138 CO -0.54 -0.15 0.28 0.93 -1.64 0.00 0.00 178.16 177.04 2jzi h GLU 139 N -0.12 0.55 -0.98 1.82 5.08 -1.97 0.36 114.58 119.32 2jzi h GLU 139 Ca 0.02 -0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.44 2jzi h GLU 139 Cb 0.18 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.23 2jzi h GLU 139 CO -0.17 0.36 0.62 1.49 -1.00 0.00 0.00 179.01 180.31 2jzi h GLU 140 N 0.57 1.04 0.07 2.33 4.81 -1.67 -0.25 114.58 121.47 2jzi h GLU 140 Ca 0.15 -0.06 -0.24 0.00 -0.13 0.00 0.00 59.36 59.08 2jzi h GLU 140 Cb -0.06 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.08 2jzi h GLU 140 CO -0.03 0.69 -1.09 0.35 -0.73 0.00 0.00 179.01 178.19 2jzi h PHE 141 N 1.07 0.37 -0.45 0.92 3.57 -0.18 -3.29 116.94 118.95 2jzi h PHE 141 Ca 0.45 -0.25 0.07 0.00 3.53 0.00 0.00 57.97 61.77 2jzi h PHE 141 Cb 0.30 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.96 2jzi h PHE 141 CO -0.01 1.15 0.12 0.28 -2.23 0.00 0.00 178.31 177.62 2jzi h VAL 142 N 0.08 0.79 -0.53 1.41 2.07 0.69 0.86 116.25 121.62 2jzi h VAL 142 Ca -0.09 -0.09 0.03 0.00 0.82 0.00 0.00 66.70 67.38 2jzi h VAL 142 Cb 1.80 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 32.04 2jzi h VAL 142 CO 0.17 0.05 0.30 1.56 0.02 0.00 0.00 177.57 179.67 2jzi h GLN 143 N 0.26 0.58 -0.04 1.57 4.20 -1.29 -1.78 115.11 118.60 2jzi h GLN 143 Ca 0.22 -0.03 -0.16 0.00 0.06 0.00 0.00 58.65 58.74 2jzi h GLN 143 Cb 0.26 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2jzi h GLN 143 CO -0.26 0.38 -0.68 1.98 -0.67 0.00 0.00 178.83 179.58 2jzi h MET 144 N 0.60 0.20 -0.65 1.46 4.05 -1.44 -2.27 114.93 116.89 2jzi h MET 144 Ca 0.22 -0.16 0.01 0.00 -0.28 0.00 0.00 59.70 59.49 2jzi h MET 144 Cb 0.07 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.86 2jzi h MET 144 CO -0.12 0.81 0.43 1.98 0.23 0.00 0.00 176.91 180.23 2jzi h MET 145 N 0.14 0.84 0.01 0.39 -1.53 0.14 -2.52 114.93 112.39 2jzi h MET 145 Ca -0.02 -0.05 -0.19 0.00 -3.44 0.00 0.00 59.70 56.00 2jzi h MET 145 Cb 1.21 -0.19 -0.02 0.00 -0.55 0.00 0.00 31.60 32.06 2jzi h MET 145 CO 0.10 0.56 -0.88 0.00 0.14 0.00 0.00 176.91 176.83 2jzi h THR 146 N 0.86 1.57 -4.15 -0.77 1.03 -1.33 -3.46 112.91 106.66 2jzi h THR 146 Ca 0.24 -2.82 -0.51 0.00 -0.01 0.00 0.00 66.41 63.31 2jzi h THR 146 Cb -0.08 2.55 0.20 0.00 -1.07 0.00 0.00 68.15 69.75 2jzi h THR 146 CO -0.06 0.81 0.17 0.00 -0.01 0.00 0.00 175.52 176.43 2jzi n ALA 147 N -2.41 -1.07 1.27 0.00 0.00 -0.86 -5.12 120.51 112.32 2jzi n ALA 147 Ca -0.02 -0.62 0.10 0.00 0.00 0.00 0.00 53.44 52.91 2jzi n ALA 147 Cb 0.82 -2.17 0.60 0.00 0.00 0.00 0.00 19.45 18.71 2jzi n ALA 147 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13