#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 -1.43 -4.01 0.00 8.00 -1.11 -4.98 116.55 113.01 2jzi n ASP 2 Ca 0.00 -0.24 -0.33 0.00 0.71 0.00 0.00 54.79 54.94 2jzi n ASP 2 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 40.98 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 -2.85 2.20 0.35 -1.24 0.74 -1.26 -5.04 119.66 112.56 2jzi s GLN 3 Ca 0.00 -2.56 0.05 0.00 0.05 0.00 0.00 55.36 52.90 2jzi s GLN 3 Cb 0.00 -3.48 -0.01 0.00 1.10 0.00 0.00 33.01 30.62 2jzi s GLN 3 CO 0.00 -1.13 0.50 -0.51 -0.55 0.00 0.00 175.29 173.60 2jzi s LEU 4 N -0.16 3.93 0.33 3.68 1.43 -1.26 -5.11 118.68 121.52 2jzi s LEU 4 Ca 0.17 -0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.22 2jzi s LEU 4 Cb -0.23 -2.84 -0.02 0.00 0.03 0.00 0.00 46.19 43.12 2jzi s LEU 4 CO -0.02 -0.46 0.50 0.42 0.23 0.00 0.00 176.35 177.02 2jzi s THR 5 N -2.24 4.76 0.19 5.49 -4.23 -1.26 -4.84 115.64 113.51 2jzi s THR 5 Ca 0.45 -0.71 -0.17 0.00 -1.18 0.00 0.00 61.69 60.07 2jzi s THR 5 Cb -0.10 -3.71 0.16 0.00 1.34 0.00 0.00 72.50 70.20 2jzi s THR 5 CO 0.32 -0.38 1.62 -0.08 -0.54 0.00 0.00 174.62 175.56 2jzi h GLU 6 N 0.83 -0.09 0.00 3.99 4.57 -1.99 1.00 114.58 122.89 2jzi h GLU 6 Ca -0.49 0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 57.66 2jzi h GLU 6 Cb 1.24 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.84 2jzi h GLU 6 CO 0.59 -0.06 -0.17 0.93 -1.18 0.00 0.00 179.01 179.12 2jzi h GLU 7 N -0.09 0.00 0.06 1.92 5.08 -1.98 0.40 114.58 119.97 2jzi h GLU 7 Ca 0.25 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2jzi h GLU 7 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2jzi h GLU 7 CO -0.61 0.17 -0.03 1.96 -1.00 0.00 0.00 179.01 179.50 2jzi h GLN 8 N 0.00 -0.08 0.00 2.33 1.08 0.10 -3.28 115.11 115.26 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 0.35 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.78 2jzi h GLN 8 CO 0.02 0.45 -0.58 -0.84 -0.95 0.00 0.00 178.83 176.93 2jzi h ILE 9 N -0.68 1.31 -0.62 2.54 3.07 0.88 -2.86 117.51 121.15 2jzi h ILE 9 Ca -0.01 -2.06 0.18 0.00 1.55 0.00 0.00 64.86 64.53 2jzi h ILE 9 Cb 0.57 2.14 -0.02 0.00 -0.27 0.00 0.00 36.82 39.23 2jzi h ILE 9 CO 0.01 0.57 0.56 0.00 -1.05 0.00 0.00 178.15 178.24 2jzi h ALA 10 N 1.42 2.44 0.00 0.16 0.00 -0.25 1.70 119.26 124.72 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 1.09 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 2jzi h ALA 10 CO 0.08 -0.88 -0.65 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 -2.86 114.58 115.24 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 1.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.67 2jzi h GLU 11 CO -0.00 0.65 -0.01 0.74 -1.00 0.00 0.00 179.01 179.38 2jzi h PHE 12 N 0.00 -0.04 -0.17 4.33 -1.00 0.23 -3.20 116.94 117.10 2jzi h PHE 12 Ca -0.01 -0.00 0.05 0.00 2.81 0.00 0.00 57.97 60.82 2jzi h PHE 12 Cb 1.26 0.01 -0.01 0.00 3.61 0.00 0.00 35.95 40.83 2jzi h PHE 12 CO 0.00 0.12 0.31 1.57 -1.61 0.00 0.00 178.31 178.70 2jzi h LYS 13 N -1.01 0.00 0.00 1.51 2.10 -1.19 1.32 116.57 119.30 2jzi h LYS 13 Ca -0.00 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.51 2jzi h LYS 13 Cb 0.18 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.49 2jzi h LYS 13 CO 0.01 0.00 -0.64 1.05 -2.00 0.00 0.00 179.45 177.86 2jzi h GLU 14 N 0.00 0.00 -0.09 0.07 4.11 -1.60 -1.95 114.58 115.12 2jzi h GLU 14 Ca 0.08 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.27 2jzi h GLU 14 Cb 0.70 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.97 2jzi h GLU 14 CO -0.00 0.64 -0.89 0.00 0.07 0.00 0.00 179.01 178.83 2jzi h ALA 15 N 1.36 0.24 0.10 1.06 0.00 0.16 0.47 119.26 122.65 2jzi h ALA 15 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2jzi h ALA 15 Cb 1.31 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2jzi h ALA 15 CO 0.08 0.69 -0.10 0.74 0.00 0.00 0.00 179.25 180.67 2jzi h PHE 16 N 0.48 -0.25 0.00 0.00 0.04 -0.98 0.38 116.94 116.62 2jzi h PHE 16 Ca -0.08 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.61 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 -0.15 -0.35 0.66 -0.60 0.00 0.00 178.31 177.96 2jzi h SER 17 N -0.22 0.00 1.38 2.17 4.64 -1.37 -2.79 113.55 117.36 2jzi h SER 17 Ca 0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.22 2jzi h SER 17 Cb 0.21 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 2jzi h SER 17 CO -0.03 0.35 -0.64 0.25 -0.87 0.00 0.00 176.83 175.89 2jzi h LEU 18 N 0.00 0.00 -0.94 5.97 6.46 0.38 -3.21 115.31 123.97 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 0.99 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.92 2jzi h LEU 18 CO 0.05 0.46 -0.15 0.33 -0.62 0.00 0.00 178.44 178.51 2jzi n PHE 19 N -3.14 0.00 -4.02 1.25 7.35 0.13 -4.41 117.46 114.61 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 0.73 -0.04 -0.06 0.00 0.35 0.00 0.00 39.48 40.46 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 -2.23 6.00 0.08 -2.13 2.15 -1.06 -4.88 116.67 114.59 2jzi s ASP 20 Ca 0.29 0.29 -0.28 0.00 0.43 0.00 0.00 52.55 53.28 2jzi s ASP 20 Cb 0.20 -1.83 -0.17 0.00 -0.30 0.00 0.00 42.92 40.82 2jzi s ASP 20 CO 0.42 0.32 1.68 0.11 -0.17 0.00 0.00 175.17 177.54 2jzi h LYS 21 N 4.41 -0.45 -0.00 4.34 1.79 -1.86 -2.55 116.57 122.24 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 0.62 -0.30 -0.15 -0.40 -1.08 0.00 0.00 179.45 178.14 2jzi n ASP 22 N -5.29 0.43 -3.88 0.86 5.75 -1.26 -4.94 116.55 108.21 2jzi n ASP 22 Ca -0.10 -0.40 -0.26 0.00 -0.01 0.00 0.00 54.79 54.02 2jzi n ASP 22 Cb 0.20 -0.08 0.01 0.00 -1.03 0.00 0.00 41.12 40.22 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 1.34 -0.34 1.18 6.12 0.00 -0.96 -4.85 105.19 107.67 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 3.37 0.00 1.61 5.68 -1.26 -4.84 116.55 118.17 2jzi n ASP 24 Ca -0.17 -2.42 0.00 0.00 -0.50 0.00 0.00 54.79 51.70 2jzi n ASP 24 Cb 0.62 -0.54 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 0.73 3.26 6.12 0.00 -1.26 -4.97 105.19 109.56 2jzi n GLY 25 Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.71 0.05 -0.10 2.61 -4.23 -1.26 -4.26 115.64 105.74 2jzi s THR 26 Ca 0.00 -0.44 -0.05 0.00 -1.18 0.00 0.00 61.69 60.02 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 -0.24 0.11 -0.63 -0.54 0.00 0.00 174.62 173.31 2jzi s ILE 27 N -1.31 5.18 0.83 2.99 1.01 -1.26 -4.62 121.20 124.02 2jzi s ILE 27 Ca -0.13 0.06 -0.09 0.00 0.00 0.00 0.00 60.65 60.49 2jzi s ILE 27 Cb -0.05 -3.25 0.15 0.00 0.01 0.00 0.00 42.46 39.32 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 -2.88 115.64 114.35 2jzi s THR 28 Ca 0.15 -0.27 -0.06 0.00 -1.21 0.00 0.00 61.69 60.30 2jzi s THR 28 Cb -0.12 -2.82 -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 0.00 174.62 174.67 2jzi h THR 29 N -1.05 1.29 -0.90 5.08 1.35 -1.71 -1.25 112.91 115.73 2jzi h THR 29 Ca -0.41 -1.68 0.01 0.00 -0.55 0.00 0.00 66.41 63.78 2jzi h THR 29 Cb 1.26 1.60 -0.04 0.00 -1.73 0.00 0.00 68.15 69.23 2jzi h THR 29 CO 0.43 0.54 0.59 0.07 -0.25 0.00 0.00 175.52 176.90 2jzi h LYS 30 N 0.57 1.18 0.19 4.72 5.09 -1.93 1.04 116.57 127.43 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 1.04 -0.27 0.00 0.00 0.10 0.00 0.00 32.23 33.10 2jzi h LYS 30 CO 0.10 0.78 -0.09 0.93 -2.09 0.00 0.00 179.45 179.08 2jzi h GLU 31 N 1.22 -0.24 0.38 0.07 4.39 -1.90 0.47 114.58 118.96 2jzi h GLU 31 Ca 0.33 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 0.14 -0.26 -0.07 -1.16 0.00 0.00 179.01 177.59 2jzi h LEU 32 N -0.71 -0.65 -0.49 1.33 3.38 -1.08 0.15 115.31 117.24 2jzi h LEU 32 Ca -0.03 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2jzi h LEU 32 Cb 0.50 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 2jzi h LEU 32 CO 0.04 -0.40 0.25 1.23 0.09 0.00 0.00 178.44 179.65 2jzi h GLY 33 N -0.62 0.68 1.87 0.83 0.00 0.11 -1.21 103.07 104.73 2jzi h GLY 33 Ca -0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 2jzi h GLY 33 CO 0.03 0.12 -0.04 -0.84 0.00 0.00 0.00 176.54 175.80 2jzi h THR 34 N 0.49 1.10 0.44 4.70 2.02 0.18 0.86 112.91 122.71 2jzi h THR 34 Ca 0.21 -0.42 -0.02 0.00 0.77 0.00 0.00 66.41 66.95 2jzi h THR 34 Cb 0.11 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2jzi h THR 34 CO -0.15 0.14 -0.21 0.58 0.37 0.00 0.00 175.52 176.25 2jzi h VAL 35 N 0.17 0.36 -0.14 3.16 2.07 0.15 0.36 116.25 122.38 2jzi h VAL 35 Ca 0.04 -0.55 -0.17 0.00 0.82 0.00 0.00 66.70 66.84 2jzi h VAL 35 Cb 0.18 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2jzi h VAL 35 CO 0.01 0.07 -0.61 -0.03 0.02 0.00 0.00 177.57 177.03 2jzi h MET 36 N -1.00 0.48 -0.39 1.57 -1.53 -1.15 -1.57 114.93 111.34 2jzi h MET 36 Ca -0.06 -0.33 -0.10 0.00 -3.44 0.00 0.00 59.70 55.77 2jzi h MET 36 Cb 0.57 0.05 -0.01 0.00 -0.55 0.00 0.00 31.60 31.65 2jzi h MET 36 CO 0.10 0.94 -0.16 -0.09 0.14 0.00 0.00 176.91 177.84 2jzi h ARG 37 N 0.35 0.80 0.00 0.39 2.43 0.68 -0.21 114.38 118.82 2jzi h ARG 37 Ca -0.01 -0.33 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 2jzi h ARG 37 Cb 1.15 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 2jzi h ARG 37 CO 0.11 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 0.11 -3.05 113.62 105.39 2jzi n SER 38 Ca -0.02 0.18 -0.15 0.00 -1.33 0.00 0.00 58.87 57.55 2jzi n SER 38 Cb 0.40 -0.39 -0.07 0.00 -0.75 0.00 0.00 64.21 63.40 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 -1.39 1.84 -1.14 2.46 0.00 -0.59 -4.92 117.00 113.26 2jzi n LEU 39 Ca 0.10 0.50 -0.01 0.00 0.00 0.00 0.00 56.01 56.61 2jzi n LEU 39 Cb 0.27 -0.92 0.00 0.00 0.00 0.00 0.00 43.42 42.78 2jzi n LEU 39 CO 0.24 -0.03 0.18 0.61 0.00 0.00 0.00 177.39 178.39 2jzi n GLY 40 N 1.50 -0.47 3.02 -3.96 0.00 -0.34 -5.08 105.19 99.86 2jzi n GLY 40 Ca -0.23 -0.01 -0.20 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.11 0.45 -2.72 1.61 -0.06 -0.24 -4.97 117.38 111.33 2jzi n GLN 41 Ca -0.03 -3.13 -0.08 0.00 -2.00 0.00 0.00 57.00 51.75 2jzi n GLN 41 Cb 0.44 2.28 0.10 0.00 -4.06 0.00 0.00 30.24 29.00 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 -1.71 -2.14 -3.12 1.69 0.23 -1.26 -4.39 115.26 104.56 2jzi n ASN 42 Ca 0.03 -3.26 -0.17 0.00 -0.53 0.00 0.00 54.58 50.65 2jzi n ASN 42 Cb 0.56 1.57 0.12 0.00 -2.08 0.00 0.00 39.78 39.96 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 0.02 -0.73 -4.29 -0.53 -0.04 -1.26 -5.10 135.00 123.08 2jzi n PRO 43 Ca 0.03 -1.21 -0.28 0.00 -0.04 0.00 0.00 63.50 62.00 2jzi n PRO 43 Cb 0.75 -0.79 -0.10 0.00 -0.04 0.00 0.00 33.50 33.33 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 -2.67 3.09 0.12 0.52 2.01 -1.26 -5.03 115.64 112.42 2jzi s THR 44 Ca 0.44 -1.57 -0.20 0.00 0.31 0.00 0.00 61.69 60.67 2jzi s THR 44 Cb -0.01 -2.49 -0.05 0.00 0.01 0.00 0.00 72.50 69.96 2jzi s THR 44 CO 0.31 -0.02 1.72 -0.33 -0.69 0.00 0.00 174.62 175.61 2jzi h GLU 45 N 3.26 0.04 -0.20 4.92 4.39 -1.99 -0.78 114.58 124.22 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 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.82 2jzi h GLU 45 CO 0.51 0.03 -0.24 0.00 -1.16 0.00 0.00 179.01 178.15 2jzi h ALA 46 N 1.15 1.22 0.33 3.43 0.00 -1.98 -1.51 119.26 121.90 2jzi h ALA 46 Ca 0.08 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2jzi h ALA 46 Cb 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2jzi h ALA 46 CO -0.15 0.51 -0.16 0.93 0.00 0.00 0.00 179.25 180.38 2jzi h GLU 47 N 0.33 -0.43 -0.29 0.00 4.39 -1.83 0.25 114.58 116.99 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 0.60 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.34 2jzi h GLU 47 CO 0.04 -0.15 -0.14 1.37 -1.16 0.00 0.00 179.01 178.97 2jzi h LEU 48 N -0.68 0.49 -0.50 1.33 -0.00 -1.13 -1.69 115.31 113.13 2jzi h LEU 48 Ca -0.05 -0.13 -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 0.66 0.12 1.56 -0.00 0.00 0.00 178.44 180.86 2jzi h GLN 49 N 0.46 0.80 -0.41 0.17 4.20 -1.19 0.85 115.11 119.98 2jzi h GLN 49 Ca 0.08 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 2jzi h GLN 49 Cb 0.52 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 2jzi h GLN 49 CO 0.03 0.77 0.24 0.22 -0.67 0.00 0.00 178.83 179.42 2jzi h ASP 50 N 0.69 0.51 0.67 1.46 1.82 -0.58 -2.65 116.42 118.33 2jzi h ASP 50 Ca 0.16 -0.08 -0.16 0.00 -0.39 0.00 0.00 57.03 56.56 2jzi h ASP 50 Cb 0.33 -0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.19 2jzi h ASP 50 CO 0.00 0.44 -0.74 0.24 -1.61 0.00 0.00 179.24 177.57 2jzi h MET 51 N 0.54 0.06 -0.93 0.28 2.86 -1.11 -3.24 114.93 113.39 2jzi h MET 51 Ca 0.15 -0.05 0.15 0.00 -2.06 0.00 0.00 59.70 57.88 2jzi h MET 51 Cb 0.04 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.63 2jzi h MET 51 CO -0.03 0.77 0.59 0.82 1.06 0.00 0.00 176.91 180.13 2jzi h ILE 52 N 0.03 0.83 -1.28 -1.22 1.08 0.11 -1.20 117.51 115.87 2jzi h ILE 52 Ca -0.01 -0.26 0.37 0.00 -0.39 0.00 0.00 64.86 64.57 2jzi h ILE 52 Cb 1.31 0.01 -0.05 0.00 -3.07 0.00 0.00 36.82 35.02 2jzi h ILE 52 CO 0.10 0.14 1.03 0.78 -0.69 0.00 0.00 178.15 179.51 2jzi h ASN 53 N 0.75 0.00 0.20 1.72 -0.26 -1.55 1.01 115.58 117.45 2jzi h ASN 53 Ca 0.48 0.00 -0.28 0.00 -0.56 0.00 0.00 56.30 55.93 2jzi h ASN 53 Cb 0.71 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 38.00 2jzi h ASN 53 CO -0.24 0.00 -1.19 -0.33 -1.06 0.00 0.00 177.43 174.62 2jzi h GLU 54 N 0.00 0.56 0.00 0.81 3.07 -1.46 -3.21 114.58 114.36 2jzi h GLU 54 Ca 0.61 -0.73 0.00 0.00 -0.50 0.00 0.00 59.36 58.74 2jzi h GLU 54 Cb 2.66 0.24 0.00 0.00 -0.84 0.00 0.00 28.75 30.81 2jzi h GLU 54 CO -0.01 1.32 -0.07 1.33 -1.40 0.00 0.00 179.01 180.19 2jzi n VAL 55 N -3.76 0.17 -4.04 3.13 0.24 0.31 -4.83 118.33 109.56 2jzi n VAL 55 Ca -0.12 -0.09 -0.26 0.00 -2.04 0.00 0.00 64.34 61.84 2jzi n VAL 55 Cb 0.96 -0.44 -0.04 0.00 -1.47 0.00 0.00 33.84 32.84 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 -3.45 5.82 0.07 -1.34 2.15 0.82 -4.56 116.67 116.18 2jzi s ASP 56 Ca 0.13 -0.04 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 0.57 0.05 1.03 0.00 -0.17 0.00 0.00 175.17 176.65 2jzi h ALA 57 N 2.18 0.56 -0.00 3.66 0.00 -1.84 -3.36 119.26 120.47 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 0.12 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 0.22 -3.24 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 53.49 2jzi n ASP 58 Cb 0.95 0.96 0.04 0.00 -1.14 0.00 0.00 41.12 41.94 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 0.73 6.12 0.00 -1.26 -4.94 105.19 105.73 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 -2.68 3.51 0.00 1.61 6.94 -1.26 -4.81 115.26 118.57 2jzi n ASN 60 Ca -0.06 -2.84 0.00 0.00 -0.02 0.00 0.00 54.58 51.66 2jzi n ASN 60 Cb 0.58 -0.47 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 -0.46 0.59 3.46 4.83 0.00 -1.26 -4.99 105.19 107.36 2jzi n GLY 61 Ca 0.19 -0.72 -0.14 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.70 115.64 108.99 2jzi s THR 62 Ca 0.00 -1.65 0.03 0.00 -1.18 0.00 0.00 61.69 58.90 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 -0.17 -0.63 -0.54 0.00 0.00 174.62 173.28 2jzi s ILE 63 N -3.34 2.78 0.70 2.99 1.01 -1.14 -4.18 121.20 120.01 2jzi s ILE 63 Ca 0.31 -0.81 -0.06 0.00 0.00 0.00 0.00 60.65 60.10 2jzi s ILE 63 Cb 0.01 -2.09 0.15 0.00 0.01 0.00 0.00 42.46 40.54 2jzi s ILE 63 CO 0.18 0.57 0.95 0.47 0.00 0.00 0.00 174.94 177.11 2jzi n ASP 64 N 2.76 0.72 0.18 3.58 8.00 -1.26 -4.05 116.55 126.47 2jzi n ASP 64 Ca -0.17 -1.74 -0.13 0.00 0.71 0.00 0.00 54.79 53.46 2jzi n ASP 64 Cb 0.52 -0.67 -0.07 0.00 -0.02 0.00 0.00 41.12 40.88 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 -1.00 -0.45 -0.28 1.24 -1.00 -2.00 -0.91 116.94 112.54 2jzi h PHE 65 Ca -0.31 -0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.39 2jzi h PHE 65 Cb 1.01 0.15 -0.02 0.00 3.61 0.00 0.00 35.95 40.71 2jzi h PHE 65 CO 0.00 -0.11 -0.13 -1.00 -1.61 0.00 0.00 178.31 175.45 2jzi h PRO 66 N -0.89 0.49 0.21 1.51 0.13 -1.99 -1.61 132.00 129.85 2jzi h PRO 66 Ca -0.05 -0.14 -0.01 0.00 -0.87 0.00 0.00 66.00 64.93 2jzi h PRO 66 Cb 0.53 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.62 2jzi h PRO 66 CO 0.08 0.62 -0.10 0.93 -0.23 0.00 0.00 178.00 179.30 2jzi h GLU 67 N 0.45 -0.27 0.46 0.86 4.39 -1.88 0.18 114.58 118.77 2jzi h GLU 67 Ca 0.08 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.79 2jzi h GLU 67 Cb 0.50 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.20 2jzi h GLU 67 CO 0.03 -0.06 -0.37 0.35 -1.16 0.00 0.00 179.01 177.81 2jzi h PHE 68 N -0.45 -0.98 -0.39 4.33 3.04 -0.99 0.27 116.94 121.78 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 0.34 0.37 -0.04 0.00 2.56 0.00 0.00 35.95 39.18 2jzi h PHE 68 CO -0.02 -0.53 0.16 -0.07 -2.02 0.00 0.00 178.31 175.83 2jzi h LEU 69 N -0.82 0.20 -1.89 0.59 3.38 -1.32 -0.31 115.31 115.14 2jzi h LEU 69 Ca -0.05 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jzi h LEU 69 Cb 0.70 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 2jzi h LEU 69 CO -0.01 0.15 0.05 0.74 0.09 0.00 0.00 178.44 179.46 2jzi h THR 70 N 0.33 1.03 0.75 0.22 2.02 -0.43 0.82 112.91 117.65 2jzi h THR 70 Ca 0.18 -0.08 -0.04 0.00 0.77 0.00 0.00 66.41 67.24 2jzi h THR 70 Cb 0.13 0.91 0.01 0.00 -1.74 0.00 0.00 68.15 67.46 2jzi h THR 70 CO -0.16 0.03 -0.36 -0.03 0.37 0.00 0.00 175.52 175.38 2jzi h MET 71 N 0.12 -0.97 -0.03 6.66 -1.53 0.13 0.15 114.93 119.46 2jzi h MET 71 Ca 0.03 0.07 -0.15 0.00 -3.44 0.00 0.00 59.70 56.21 2jzi h MET 71 Cb 0.01 0.22 -0.01 0.00 -0.55 0.00 0.00 31.60 31.26 2jzi h MET 71 CO -0.01 -0.64 -0.65 0.52 0.14 0.00 0.00 176.91 176.27 2jzi h MET 72 N -1.09 0.14 -0.00 0.39 2.86 -1.23 -2.86 114.93 113.14 2jzi h MET 72 Ca -0.10 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 2jzi h MET 72 Cb 0.77 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.45 2jzi h MET 72 CO 0.17 0.74 0.00 0.00 1.06 0.00 0.00 176.91 178.88 2jzi n ALA 73 N -2.45 2.67 -1.32 6.32 0.00 0.28 -4.66 120.51 121.36 2jzi n ALA 73 Ca -0.02 -0.24 -0.36 0.00 0.00 0.00 0.00 53.44 52.82 2jzi n ALA 73 Cb 0.65 -1.46 0.09 0.00 0.00 0.00 0.00 19.45 18.73 2jzi n ALA 73 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2jzi n ARG 74 N -0.79 0.45 0.07 0.00 3.00 0.51 -2.76 116.66 117.14 2jzi n ARG 74 Ca 0.23 0.21 0.10 0.00 -0.00 0.00 0.00 57.85 58.38 2jzi n ARG 74 Cb 0.15 -2.16 0.41 0.00 0.00 0.00 0.00 32.46 30.86 2jzi n ARG 74 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2jzi n LYS 75 N -1.74 0.11 -0.04 -0.14 3.00 -1.26 -2.46 118.16 115.62 2jzi n LYS 75 Ca 0.12 0.36 -0.10 0.00 -0.00 0.00 0.00 58.31 58.69 2jzi n LYS 75 Cb 0.50 -1.71 -0.15 0.00 0.00 0.00 0.00 35.03 33.67 2jzi n LYS 75 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.40 177.28 2jzi n MET 76 N -1.92 0.65 -2.67 1.64 1.56 -1.26 -4.84 117.12 110.28 2jzi n MET 76 Ca 0.03 0.21 -0.43 0.00 -0.27 0.00 0.00 57.70 57.23 2jzi n MET 76 Cb 0.20 -1.71 -0.02 0.00 2.15 0.00 0.00 33.22 33.84 2jzi n MET 76 CO 0.00 0.00 0.00 0.15 -0.73 0.00 0.00 175.97 175.39 2jzi s LYS 77 N -2.56 4.02 -0.01 2.12 3.01 -1.03 -4.95 119.74 120.33 2jzi s LYS 77 Ca -0.07 0.97 -0.28 0.00 -1.01 0.00 0.00 55.97 55.57 2jzi s LYS 77 Cb 0.07 -3.75 0.09 0.00 -1.01 0.00 0.00 37.83 33.24 2jzi s LYS 77 CO 0.82 -0.92 1.28 0.34 0.51 0.00 0.00 175.35 177.38 2jzi s ASP 78 N 1.73 0.00 0.98 2.83 -1.08 -1.26 -4.66 116.67 115.20 2jzi s ASP 78 Ca 0.44 -0.21 0.00 0.00 -0.52 0.00 0.00 52.55 52.27 2jzi s ASP 78 Cb -0.12 0.15 0.00 0.00 -1.46 0.00 0.00 42.92 41.49 2jzi s ASP 78 CO 0.17 -0.30 0.00 0.41 0.52 0.00 0.00 175.17 175.97 2jzi n THR 79 N -0.90 0.00 -2.85 1.71 -1.04 -1.26 -4.97 114.28 104.96 2jzi n THR 79 Ca 0.04 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 62.00 2jzi n THR 79 Cb 0.59 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 69.12 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 -2.91 -6.42 -0.00 8.00 8.00 -1.26 -4.97 116.55 116.98 2jzi n ASP 80 Ca 0.00 -0.27 -0.17 0.00 0.71 0.00 0.00 54.79 55.06 2jzi n ASP 80 Cb 0.00 -4.51 -0.12 0.00 -0.02 0.00 0.00 41.12 36.47 2jzi n ASP 80 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 2jzi h SER 81 N -0.13 0.35 -0.14 -2.24 0.87 -2.02 -3.32 113.55 106.91 2jzi h SER 81 Ca -0.20 -0.85 -0.13 0.00 -1.23 0.00 0.00 61.79 59.38 2jzi h SER 81 Cb 1.10 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.94 2jzi h SER 81 CO 0.30 1.16 -0.34 -0.33 -0.53 0.00 0.00 176.83 177.08 2jzi h GLU 82 N -0.41 0.65 -0.96 2.24 4.39 -2.00 -2.91 114.58 115.58 2jzi h GLU 82 Ca -0.07 -0.30 0.27 0.00 0.34 0.00 0.00 59.36 59.60 2jzi h GLU 82 Cb 1.27 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.87 2jzi h GLU 82 CO 0.09 0.90 0.68 0.93 -1.16 0.00 0.00 179.01 180.45 2jzi h GLU 83 N 0.55 0.03 0.00 2.33 4.39 -1.96 0.67 114.58 120.59 2jzi h GLU 83 Ca 0.06 -0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.58 2jzi h GLU 83 Cb 0.85 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.46 2jzi h GLU 83 CO 0.07 0.02 -0.83 0.93 -1.16 0.00 0.00 179.01 178.05 2jzi h GLU 84 N 0.03 0.00 0.00 2.33 5.08 -1.61 -2.36 114.58 118.06 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 0.83 -0.00 0.82 -1.00 0.00 0.00 179.01 179.63 2jzi h ILE 85 N 0.00 1.57 -0.03 3.13 2.04 0.20 -3.25 117.51 121.17 2jzi h ILE 85 Ca -0.01 -2.11 -0.03 0.00 1.00 0.00 0.00 64.86 63.71 2jzi h ILE 85 Cb 1.50 2.93 0.00 0.00 -0.74 0.00 0.00 36.82 40.52 2jzi h ILE 85 CO 0.11 0.52 -0.11 0.03 0.00 0.00 0.00 178.15 178.70 2jzi h ARG 86 N -0.97 0.13 -0.42 2.37 -0.00 -1.23 -3.05 114.38 111.22 2jzi h ARG 86 Ca -0.00 -0.10 0.12 0.00 -0.50 0.00 0.00 59.98 59.50 2jzi h ARG 86 Cb 0.86 0.02 -0.02 0.00 0.00 0.00 0.00 29.97 30.83 2jzi h ARG 86 CO 0.00 0.73 0.42 1.49 0.00 0.00 0.00 179.97 182.61 2jzi h GLU 87 N -0.45 0.00 0.02 0.04 4.81 -1.62 0.41 114.58 117.79 2jzi h GLU 87 Ca -0.00 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.01 2jzi h GLU 87 Cb 0.74 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 2jzi h GLU 87 CO 0.02 0.00 -0.94 0.00 -0.73 0.00 0.00 179.01 177.36 2jzi h ALA 88 N 1.56 0.41 0.02 2.92 0.00 -1.58 -3.04 119.26 119.56 2jzi h ALA 88 Ca 0.20 -0.74 -0.00 0.00 0.00 0.00 0.00 54.91 54.37 2jzi h ALA 88 Cb 1.03 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2jzi h ALA 88 CO -0.00 0.90 -0.01 0.35 0.00 0.00 0.00 179.25 180.48 2jzi h PHE 89 N 0.14 -0.03 -0.70 0.00 3.57 -0.11 0.61 116.94 120.42 2jzi h PHE 89 Ca -0.07 -0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.58 2jzi h PHE 89 Cb 1.59 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 40.30 2jzi h PHE 89 CO 0.04 0.41 0.48 0.07 -2.23 0.00 0.00 178.31 177.08 2jzi h ARG 90 N -0.48 0.31 0.00 1.11 0.11 -1.40 0.18 114.38 114.21 2jzi h ARG 90 Ca -0.00 -0.02 -0.08 0.00 0.10 0.00 0.00 59.98 59.98 2jzi h ARG 90 Cb 0.45 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 31.45 2jzi h ARG 90 CO 0.01 0.20 -1.09 0.28 0.10 0.00 0.00 179.97 179.46 2jzi h VAL 91 N 0.32 0.26 -0.91 0.08 2.07 -1.40 -3.36 116.25 113.30 2jzi h VAL 91 Ca 0.34 -1.48 0.17 0.00 0.82 0.00 0.00 66.70 66.55 2jzi h VAL 91 Cb 0.89 1.80 -0.08 0.00 -1.52 0.00 0.00 31.29 32.38 2jzi h VAL 91 CO -0.09 0.15 0.59 0.15 0.02 0.00 0.00 177.57 178.39 2jzi h PHE 92 N 0.00 0.76 -2.84 1.57 3.57 0.34 -3.40 116.94 116.94 2jzi h PHE 92 Ca -0.07 0.02 -0.63 0.00 3.53 0.00 0.00 57.97 60.82 2jzi h PHE 92 Cb 1.27 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.72 2jzi h PHE 92 CO 0.00 0.23 -0.50 0.34 -2.23 0.00 0.00 178.31 176.16 2jzi s ASP 93 N -5.66 6.35 0.21 0.41 -1.08 -1.18 -4.76 116.67 110.96 2jzi s ASP 93 Ca -0.09 0.32 -0.05 0.00 -0.52 0.00 0.00 52.55 52.21 2jzi s ASP 93 Cb 0.23 -1.98 0.17 0.00 -1.46 0.00 0.00 42.92 39.87 2jzi s ASP 93 CO 0.79 0.24 1.62 0.11 0.52 0.00 0.00 175.17 178.44 2jzi h LYS 94 N 3.63 0.79 -0.00 4.34 1.57 -1.87 -3.28 116.57 121.74 2jzi h LYS 94 Ca -0.48 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 57.98 2jzi h LYS 94 Cb 1.18 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2jzi h LYS 94 CO 0.71 0.94 -0.38 -0.40 -0.57 0.00 0.00 179.45 179.75 2jzi n ASP 95 N -4.11 0.42 0.00 0.86 5.68 -1.26 -5.01 116.55 113.14 2jzi n ASP 95 Ca -0.00 -0.71 0.00 0.00 -0.50 0.00 0.00 54.79 53.58 2jzi n ASP 95 Cb 0.44 0.98 0.00 0.00 -1.14 0.00 0.00 41.12 41.40 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 0.69 0.12 6.12 0.00 -1.24 -4.94 105.19 107.12 2jzi n GLY 96 Ca 0.02 -0.72 0.11 0.00 0.00 0.00 0.00 46.02 45.42 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 1.56 0.54 0.00 1.61 5.03 -1.26 -4.84 115.26 117.91 2jzi n ASN 97 Ca 0.00 0.66 0.00 0.00 0.87 0.00 0.00 54.58 56.11 2jzi n ASN 97 Cb 0.33 -0.77 0.00 0.00 -1.02 0.00 0.00 39.78 38.32 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 0.69 3.21 7.41 0.00 -1.26 -5.06 105.19 109.85 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 -2.13 1.55 -0.26 1.61 2.02 -1.26 -3.51 117.35 115.38 2jzi s TYR 99 Ca 0.00 -0.39 0.03 0.00 -0.37 0.00 0.00 57.07 56.34 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 0.10 -0.10 0.96 -1.57 0.00 0.00 175.55 174.94 2jzi s ILE 100 N -0.95 2.04 0.89 2.71 -4.36 -1.25 -4.69 121.20 115.59 2jzi s ILE 100 Ca 0.04 -1.56 -0.12 0.00 -0.26 0.00 0.00 60.65 58.75 2jzi s ILE 100 Cb -0.09 -2.19 0.17 0.00 1.25 0.00 0.00 42.46 41.60 2jzi s ILE 100 CO 0.02 -0.05 1.23 -0.44 0.24 0.00 0.00 174.94 175.94 2jzi s SER 101 N 1.16 3.58 0.44 4.36 0.01 -1.26 -4.23 113.70 117.75 2jzi s SER 101 Ca -0.08 0.20 0.14 0.00 1.31 0.00 0.00 55.95 57.52 2jzi s SER 101 Cb -0.20 -0.38 0.98 0.00 0.21 0.00 0.00 66.02 66.63 2jzi s SER 101 CO -0.05 -2.42 1.97 0.00 0.41 0.00 0.00 173.24 173.15 2jzi h ALA 102 N -1.31 1.65 0.74 1.44 0.00 -1.89 0.43 119.26 120.32 2jzi h ALA 102 Ca -0.43 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.26 2jzi h ALA 102 Cb 1.25 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.02 2jzi h ALA 102 CO 0.42 0.26 -0.36 0.00 0.00 0.00 0.00 179.25 179.57 2jzi h ALA 103 N 1.80 -0.99 0.02 0.00 0.00 -1.98 -1.71 119.26 116.38 2jzi h ALA 103 Ca -0.00 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 2jzi h ALA 103 Cb 0.36 0.38 0.01 0.00 0.00 0.00 0.00 17.79 18.55 2jzi h ALA 103 CO 0.03 -1.03 -0.50 0.93 0.00 0.00 0.00 179.25 178.68 2jzi h GLU 104 N -1.06 0.31 -0.74 0.00 4.39 -1.91 -3.17 114.58 112.41 2jzi h GLU 104 Ca -0.10 -0.36 0.19 0.00 0.34 0.00 0.00 59.36 59.44 2jzi h GLU 104 Cb 0.78 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.50 2jzi h GLU 104 CO 0.17 1.06 0.52 1.25 -1.16 0.00 0.00 179.01 180.85 2jzi h LEU 105 N -0.28 0.12 -0.02 1.33 5.85 -0.23 -0.63 115.31 121.46 2jzi h LEU 105 Ca -0.07 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 2jzi h LEU 105 Cb 1.25 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.27 2jzi h LEU 105 CO 0.10 0.06 -0.06 -0.09 -0.34 0.00 0.00 178.44 178.11 2jzi h ARG 106 N 0.13 0.07 -0.81 1.25 2.43 -1.34 -0.23 114.38 115.89 2jzi h ARG 106 Ca 0.36 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.49 2jzi h ARG 106 Cb 1.24 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.76 2jzi h ARG 106 CO -0.05 0.68 0.54 1.25 -1.51 0.00 0.00 179.97 180.87 2jzi h HIS 107 N -0.52 1.01 -0.18 2.20 2.76 -1.23 0.70 115.15 119.90 2jzi h HIS 107 Ca -0.00 0.02 -0.21 0.00 -2.20 0.00 0.00 60.37 57.98 2jzi h HIS 107 Cb 0.68 -0.34 0.01 0.00 1.55 0.00 0.00 27.41 29.31 2jzi h HIS 107 CO 0.14 0.63 -0.73 0.28 -1.30 0.00 0.00 177.93 176.96 2jzi h VAL 108 N 1.09 1.28 0.13 5.26 2.07 -1.22 -1.88 116.25 122.97 2jzi h VAL 108 Ca 0.30 -1.92 -0.01 0.00 0.82 0.00 0.00 66.70 65.89 2jzi h VAL 108 Cb -0.12 1.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2jzi h VAL 108 CO -0.07 0.61 -0.06 0.24 0.02 0.00 0.00 177.57 178.31 2jzi h MET 109 N 0.55 -0.17 -0.15 1.57 2.07 -0.76 -2.88 114.93 115.16 2jzi h MET 109 Ca -0.04 0.01 0.01 0.00 -2.07 0.00 0.00 59.70 57.61 2jzi h MET 109 Cb 1.36 0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 31.11 2jzi h MET 109 CO 0.15 0.30 0.06 1.15 1.07 0.00 0.00 176.91 179.64 2jzi h THR 110 N -0.87 0.98 -0.23 2.22 2.02 0.32 1.00 112.91 118.34 2jzi h THR 110 Ca -0.02 -0.05 0.07 0.00 0.77 0.00 0.00 66.41 67.18 2jzi h THR 110 Cb 0.54 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 2jzi h THR 110 CO 0.03 0.03 0.19 -1.13 0.37 0.00 0.00 175.52 175.00 2jzi h ASN 111 N 0.14 0.00 -0.48 4.18 -1.24 -1.46 -1.88 115.58 114.84 2jzi h ASN 111 Ca 0.06 0.00 -0.35 0.00 0.71 0.00 0.00 56.30 56.72 2jzi h ASN 111 Cb 0.03 0.00 -0.32 0.00 0.73 0.00 0.00 38.32 38.75 2jzi h ASN 111 CO -0.06 0.00 -0.80 0.18 -1.29 0.00 0.00 177.43 175.46 2jzi n LEU 112 N -4.25 3.64 0.00 0.34 4.77 -0.65 -4.75 117.00 116.11 2jzi n LEU 112 Ca 0.03 -4.11 0.00 0.00 -0.03 0.00 0.00 56.01 51.90 2jzi n LEU 112 Cb 0.33 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2jzi n LEU 112 CO 0.33 1.68 0.00 0.61 -1.33 0.00 0.00 177.39 178.68 2jzi n GLY 113 N -0.71 0.49 3.36 -0.72 0.00 0.34 -4.90 105.19 103.05 2jzi n GLY 113 Ca 0.30 0.48 -0.18 0.00 0.00 0.00 0.00 46.02 46.62 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 2.59 1.44 -0.66 1.61 4.04 -1.24 -4.88 118.70 121.59 2jzi s GLU 114 Ca 0.00 -1.76 -0.27 0.00 0.04 0.00 0.00 54.97 52.98 2jzi s GLU 114 Cb 0.00 -0.64 -0.00 0.00 0.02 0.00 0.00 34.13 33.51 2jzi s GLU 114 CO 0.00 -0.15 1.64 0.21 -1.84 0.00 0.00 175.26 175.12 2jzi s LYS 115 N -3.90 2.84 -0.36 -4.83 2.20 -1.26 -3.74 119.74 110.69 2jzi s LYS 115 Ca 0.32 0.30 -0.21 0.00 -0.36 0.00 0.00 55.97 56.02 2jzi s LYS 115 Cb 0.07 -4.31 0.00 0.00 -1.51 0.00 0.00 37.83 32.08 2jzi s LYS 115 CO 0.12 -2.51 0.65 -0.48 -0.36 0.00 0.00 175.35 172.76 2jzi s LEU 116 N 7.83 4.25 1.10 5.43 2.34 -1.26 -5.03 118.68 133.34 2jzi s LEU 116 Ca 0.55 0.14 -0.17 0.00 0.06 0.00 0.00 54.13 54.72 2jzi s LEU 116 Cb -0.11 -2.81 0.24 0.00 -0.56 0.00 0.00 46.19 42.95 2jzi s LEU 116 CO 0.19 -0.62 1.14 -0.89 -1.06 0.00 0.00 176.35 175.11 2jzi s THR 117 N 2.75 1.78 0.41 5.48 2.01 -1.26 -4.34 115.64 122.47 2jzi s THR 117 Ca 0.25 0.00 0.21 0.00 0.31 0.00 0.00 61.69 62.46 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 0.15 0.00 1.75 0.44 -0.69 0.00 0.00 174.62 176.28 2jzi h ASP 118 N -2.19 0.39 0.45 3.53 3.32 -1.98 0.84 116.42 120.77 2jzi h ASP 118 Ca -0.48 0.09 -0.24 0.00 0.02 0.00 0.00 57.03 56.42 2jzi h ASP 118 Cb 1.30 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.88 2jzi h ASP 118 CO 0.43 0.04 -1.05 -0.33 -1.72 0.00 0.00 179.24 176.61 2jzi h GLU 119 N 0.32 0.35 -0.08 3.56 4.39 -1.98 -1.03 114.58 120.13 2jzi h GLU 119 Ca 0.62 -0.45 -0.15 0.00 0.34 0.00 0.00 59.36 59.72 2jzi h GLU 119 Cb 1.69 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 30.48 2jzi h GLU 119 CO -0.29 1.15 -0.63 0.93 -1.16 0.00 0.00 179.01 179.00 2jzi h GLU 120 N 0.17 0.28 -0.01 2.33 4.39 -0.28 0.37 114.58 121.83 2jzi h GLU 120 Ca -0.10 -0.20 -0.04 0.00 0.34 0.00 0.00 59.36 59.36 2jzi h GLU 120 Cb 1.72 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 30.41 2jzi h GLU 120 CO 0.18 0.82 -0.14 0.28 -1.16 0.00 0.00 179.01 178.99 2jzi h VAL 121 N 0.20 1.54 0.25 3.13 2.07 0.38 -2.56 116.25 121.26 2jzi h VAL 121 Ca -0.01 -1.78 -0.01 0.00 0.82 0.00 0.00 66.70 65.72 2jzi h VAL 121 Cb 1.15 2.67 -0.00 0.00 -1.52 0.00 0.00 31.29 33.59 2jzi h VAL 121 CO 0.10 0.48 -0.15 0.44 0.02 0.00 0.00 177.57 178.46 2jzi h ASP 122 N -0.55 -0.36 -0.19 0.57 5.19 -1.19 -0.18 116.42 119.70 2jzi h ASP 122 Ca -0.01 0.02 0.06 0.00 -0.62 0.00 0.00 57.03 56.47 2jzi h ASP 122 Cb 0.85 0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.46 2jzi h ASP 122 CO 0.03 -0.24 0.15 1.05 -3.12 0.00 0.00 179.24 177.11 2jzi h GLU 123 N -0.38 0.00 0.01 3.56 -0.00 -1.02 0.05 114.58 116.79 2jzi h GLU 123 Ca -0.03 0.00 -0.25 0.00 -0.00 0.00 0.00 59.36 59.08 2jzi h GLU 123 Cb 0.31 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 29.07 2jzi h GLU 123 CO 0.03 0.00 -1.01 1.98 -0.00 0.00 0.00 179.01 180.01 2jzi h MET 124 N 0.00 0.55 -0.40 1.06 4.05 -0.92 -2.78 114.93 116.48 2jzi h MET 124 Ca 0.09 -0.61 -0.14 0.00 -0.28 0.00 0.00 59.70 58.76 2jzi h MET 124 Cb 0.40 0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 31.37 2jzi h MET 124 CO -0.00 1.23 -0.30 0.82 0.23 0.00 0.00 176.91 178.89 2jzi h ILE 125 N 0.31 1.28 -0.55 1.77 2.04 0.48 0.12 117.51 122.95 2jzi h ILE 125 Ca -0.11 -1.46 -0.10 0.00 1.00 0.00 0.00 64.86 64.19 2jzi h ILE 125 Cb 1.66 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 39.05 2jzi h ILE 125 CO 0.19 0.49 -0.05 0.03 0.00 0.00 0.00 178.15 178.81 2jzi h ARG 126 N 0.73 0.99 0.15 2.37 3.08 -1.12 0.46 114.38 121.04 2jzi h ARG 126 Ca 0.08 -0.33 -0.30 0.00 0.07 0.00 0.00 59.98 59.50 2jzi h ARG 126 Cb 0.88 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.85 2jzi h ARG 126 CO 0.08 1.00 -1.38 1.05 -1.07 0.00 0.00 179.97 179.65 2jzi h GLU 127 N 0.90 0.31 -0.36 0.04 4.11 -1.48 -3.30 114.58 114.80 2jzi h GLU 127 Ca 0.15 -0.54 -0.12 0.00 0.07 0.00 0.00 59.36 58.93 2jzi h GLU 127 Cb 0.59 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2jzi h GLU 127 CO 0.04 1.23 -0.26 0.00 0.07 0.00 0.00 179.01 180.09 2jzi h ALA 128 N 0.47 0.87 -2.89 1.06 0.00 -0.71 -3.43 119.26 114.64 2jzi h ALA 128 Ca -0.19 -0.38 -0.65 0.00 0.00 0.00 0.00 54.91 53.69 2jzi h ALA 128 Cb 2.02 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 19.60 2jzi h ALA 128 CO 0.20 0.63 -0.52 0.34 0.00 0.00 0.00 179.25 179.91 2jzi s ASP 129 N -6.78 6.16 -0.03 0.00 2.15 0.15 -3.65 116.67 114.67 2jzi s ASP 129 Ca -0.09 0.29 -0.14 0.00 0.43 0.00 0.00 52.55 53.04 2jzi s ASP 129 Cb 0.13 -1.89 -0.32 0.00 -0.30 0.00 0.00 42.92 40.53 2jzi s ASP 129 CO 0.83 0.27 0.79 0.16 -0.17 0.00 0.00 175.17 177.06 2jzi h ILE 130 N 3.01 1.12 0.00 4.11 3.07 -1.84 -3.28 117.51 123.70 2jzi h ILE 130 Ca -0.49 -2.57 0.00 0.00 1.55 0.00 0.00 64.86 63.35 2jzi h ILE 130 Cb 1.19 2.90 0.00 0.00 -0.27 0.00 0.00 36.82 40.64 2jzi h ILE 130 CO 0.66 0.81 0.00 0.47 -1.05 0.00 0.00 178.15 179.05 2jzi n ASP 131 N -3.72 0.14 -3.01 2.16 9.92 -1.26 -4.83 116.55 115.95 2jzi n ASP 131 Ca -0.21 0.54 -0.12 0.00 -0.53 0.00 0.00 54.79 54.46 2jzi n ASP 131 Cb 1.05 -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 -0.16 -0.48 0.01 0.44 0.00 -1.24 -4.73 105.19 99.05 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 -1.80 0.68 0.00 1.61 5.75 -1.26 -4.96 116.55 116.56 2jzi n ASP 133 Ca 0.01 -0.47 0.00 0.00 -0.01 0.00 0.00 54.79 54.32 2jzi n ASP 133 Cb 0.50 0.82 0.00 0.00 -1.03 0.00 0.00 41.12 41.41 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 3.13 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 45.93 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 -0.01 0.46 -0.24 1.61 -2.07 -1.26 -4.41 119.66 113.74 2jzi s GLN 135 Ca 0.00 -0.18 -0.01 0.00 -1.82 0.00 0.00 55.36 53.35 2jzi s GLN 135 Cb 0.00 0.20 0.07 0.00 -1.09 0.00 0.00 33.01 32.19 2jzi s GLN 135 CO 0.00 -0.11 0.02 0.08 -1.32 0.00 0.00 175.29 173.97 2jzi s VAL 136 N -0.99 0.97 0.93 3.63 1.01 -1.26 -4.65 120.40 120.05 2jzi s VAL 136 Ca -0.11 -1.02 -0.15 0.00 0.00 0.00 0.00 61.98 60.70 2jzi s VAL 136 Cb -0.06 -1.47 0.16 0.00 0.00 0.00 0.00 36.38 35.01 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 3.42 0.04 3.32 2.47 -1.23 -3.82 114.94 120.76 2jzi s ASN 137 Ca 0.00 0.52 -0.10 0.00 0.42 0.00 0.00 52.86 53.70 2jzi s ASN 137 Cb -0.18 -0.76 -0.03 0.00 -1.45 0.00 0.00 41.25 38.83 2jzi s ASN 137 CO -0.12 -2.56 1.16 0.22 -3.72 0.00 0.00 177.10 172.08 2jzi h TYR 138 N -1.52 -0.50 0.00 0.43 3.20 -1.96 -1.73 116.97 114.89 2jzi h TYR 138 Ca -0.45 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.41 2jzi h TYR 138 Cb 1.28 0.23 -0.00 0.00 1.54 0.00 0.00 36.73 39.78 2jzi h TYR 138 CO -0.64 -0.14 -0.14 0.93 -1.64 0.00 0.00 178.16 176.52 2jzi h GLU 139 N -0.12 0.00 -0.34 1.82 5.08 -1.97 -2.39 114.58 116.66 2jzi h GLU 139 Ca 0.02 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.43 2jzi h GLU 139 Cb 0.17 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.38 2jzi h GLU 139 CO -0.17 0.14 0.05 1.49 -1.00 0.00 0.00 179.01 179.52 2jzi h GLU 140 N 0.00 0.15 0.02 2.33 4.81 -1.63 -1.04 114.58 119.22 2jzi h GLU 140 Ca -0.00 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 59.01 2jzi h GLU 140 Cb 0.37 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 2jzi h GLU 140 CO 0.02 0.10 -0.99 0.27 -0.73 0.00 0.00 179.01 177.68 2jzi h PHE 141 N 0.16 0.10 -0.72 0.92 -5.15 -1.36 -3.28 116.94 107.61 2jzi h PHE 141 Ca 0.16 -0.07 0.12 0.00 -0.20 0.00 0.00 57.97 57.98 2jzi h PHE 141 Cb 0.19 -0.01 -0.08 0.00 0.22 0.00 0.00 35.95 36.27 2jzi h PHE 141 CO -0.20 1.00 0.30 0.28 -2.00 0.00 0.00 178.31 177.70 2jzi h VAL 142 N 0.02 0.73 -0.71 0.88 2.07 -0.82 1.02 116.25 119.44 2jzi h VAL 142 Ca -0.03 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2jzi h VAL 142 Cb 1.71 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 2jzi h VAL 142 CO 0.14 0.09 0.45 1.56 0.02 0.00 0.00 177.57 179.82 2jzi h GLN 143 N 0.48 0.94 -0.12 1.57 4.20 -1.28 -2.17 115.11 118.74 2jzi h GLN 143 Ca 0.38 -0.07 -0.18 0.00 0.06 0.00 0.00 58.65 58.84 2jzi h GLN 143 Cb 0.50 -0.21 0.01 0.00 0.30 0.00 0.00 27.48 28.09 2jzi h GLN 143 CO -0.35 0.64 -0.61 1.98 -0.67 0.00 0.00 178.83 179.83 2jzi h MET 144 N 0.97 0.63 -0.74 1.46 4.05 -0.64 -1.89 114.93 118.77 2jzi h MET 144 Ca 0.26 -0.51 0.12 0.00 -0.28 0.00 0.00 59.70 59.29 2jzi h MET 144 Cb -0.08 0.11 -0.09 0.00 -0.80 0.00 0.00 31.60 30.74 2jzi h MET 144 CO -0.05 1.13 0.32 1.98 0.23 0.00 0.00 176.91 180.52 2jzi h MET 145 N 0.28 0.49 0.02 0.39 1.85 0.14 -1.10 114.93 117.00 2jzi h MET 145 Ca -0.04 -0.03 -0.21 0.00 -0.61 0.00 0.00 59.70 58.81 2jzi h MET 145 Cb 1.25 -0.11 -0.02 0.00 0.43 0.00 0.00 31.60 33.15 2jzi h MET 145 CO 0.13 0.32 -0.97 0.00 -0.40 0.00 0.00 176.91 175.99 2jzi h THR 146 N 0.50 1.61 -4.03 -0.77 1.03 -1.45 -3.46 112.91 106.35 2jzi h THR 146 Ca 0.39 -3.06 -0.55 0.00 -0.01 0.00 0.00 66.41 63.17 2jzi h THR 146 Cb 0.53 2.71 0.14 0.00 -1.07 0.00 0.00 68.15 70.46 2jzi h THR 146 CO -0.35 0.88 0.59 0.00 -0.01 0.00 0.00 175.52 176.63 2jzi n ALA 147 N -2.41 1.52 0.79 0.00 0.00 -0.42 -5.12 120.51 114.87 2jzi n ALA 147 Ca -0.02 0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.62 2jzi n ALA 147 Cb 0.89 -2.35 0.08 0.00 0.00 0.00 0.00 19.45 18.07 2jzi n ALA 147 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86