#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 -1.60 -3.96 0.00 8.00 -1.18 -4.98 116.55 112.83 2jzi n ASP 2 Ca 0.00 -0.10 -0.30 0.00 0.71 0.00 0.00 54.79 55.10 2jzi n ASP 2 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 40.96 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 -2.71 1.98 0.38 -1.24 0.74 -1.26 -5.06 119.66 112.49 2jzi s GLN 3 Ca 0.00 -2.60 0.04 0.00 0.05 0.00 0.00 55.36 52.85 2jzi s GLN 3 Cb 0.00 -3.33 -0.01 0.00 1.10 0.00 0.00 33.01 30.78 2jzi s GLN 3 CO 0.00 -1.11 0.55 -0.51 -0.55 0.00 0.00 175.29 173.67 2jzi s LEU 4 N -0.25 3.85 0.32 3.68 1.43 -1.26 -5.11 118.68 121.33 2jzi s LEU 4 Ca 0.17 0.02 0.04 0.00 -1.03 0.00 0.00 54.13 53.33 2jzi s LEU 4 Cb -0.26 -2.93 -0.02 0.00 0.03 0.00 0.00 46.19 43.02 2jzi s LEU 4 CO -0.00 -0.53 0.48 0.42 0.23 0.00 0.00 176.35 176.94 2jzi s THR 5 N -2.33 4.62 0.20 5.49 -4.23 -1.26 -4.84 115.64 113.29 2jzi s THR 5 Ca 0.46 -0.83 -0.16 0.00 -1.18 0.00 0.00 61.69 59.97 2jzi s THR 5 Cb -0.10 -3.64 0.18 0.00 1.34 0.00 0.00 72.50 70.28 2jzi s THR 5 CO 0.34 -0.31 1.62 -0.08 -0.54 0.00 0.00 174.62 175.65 2jzi h GLU 6 N 0.89 -0.07 0.00 3.99 4.57 -1.99 0.98 114.58 122.95 2jzi h GLU 6 Ca -0.49 0.00 -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 0.58 -0.05 -0.17 0.93 -1.18 0.00 0.00 179.01 179.12 2jzi h GLU 7 N -0.07 0.00 0.06 1.92 5.08 -1.98 0.42 114.58 120.00 2jzi h GLU 7 Ca 0.27 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2jzi h GLU 7 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2jzi h GLU 7 CO -0.63 0.17 -0.03 1.96 -1.00 0.00 0.00 179.01 179.49 2jzi h GLN 8 N 0.00 -0.07 0.00 2.33 1.08 0.17 -3.29 115.11 115.32 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 0.48 -0.59 -0.84 -0.95 0.00 0.00 178.83 176.95 2jzi h ILE 9 N -0.69 1.33 -0.63 2.54 3.07 0.82 -2.87 117.51 121.07 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 -0.03 0.00 -0.27 0.00 0.00 36.82 39.27 2jzi h ILE 9 CO 0.01 0.58 0.57 0.00 -1.05 0.00 0.00 178.15 178.26 2jzi h ALA 10 N 1.41 2.45 0.00 0.16 0.00 -0.24 1.67 119.26 124.72 2jzi h ALA 10 Ca -0.01 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 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 -0.89 -0.65 0.93 0.00 0.00 0.00 179.25 178.71 2jzi h GLU 11 N 0.00 0.00 0.03 0.00 5.08 -1.60 -2.81 114.58 115.28 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 1.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.68 2jzi h GLU 11 CO -0.00 0.65 -0.01 0.74 -1.00 0.00 0.00 179.01 179.39 2jzi h PHE 12 N 0.00 -0.04 -0.15 4.33 -1.00 0.23 -3.21 116.94 117.11 2jzi h PHE 12 Ca -0.01 -0.00 0.04 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 0.29 1.57 -1.61 0.00 0.00 178.31 178.68 2jzi h LYS 13 N -1.01 0.00 0.00 1.51 2.10 -1.17 1.26 116.57 119.26 2jzi h LYS 13 Ca -0.00 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.52 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 -0.61 1.05 -2.00 0.00 0.00 179.45 177.90 2jzi h GLU 14 N 0.00 0.00 -0.05 0.07 4.11 -1.59 -1.85 114.58 115.27 2jzi h GLU 14 Ca 0.07 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.25 2jzi h GLU 14 Cb 0.65 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.92 2jzi h GLU 14 CO -0.00 0.61 -0.95 0.00 0.07 0.00 0.00 179.01 178.74 2jzi h ALA 15 N 1.39 0.21 0.14 1.06 0.00 0.15 0.50 119.26 122.71 2jzi h ALA 15 Ca -0.01 -0.67 -0.00 0.00 0.00 0.00 0.00 54.91 54.24 2jzi h ALA 15 Cb 1.27 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2jzi h ALA 15 CO 0.08 0.69 -0.10 0.74 0.00 0.00 0.00 179.25 180.66 2jzi h PHE 16 N 0.43 -0.27 0.00 0.00 0.04 -0.99 0.39 116.94 116.55 2jzi h PHE 16 Ca -0.10 -0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.59 2jzi h PHE 16 Cb 1.60 0.10 -0.01 0.00 2.20 0.00 0.00 35.95 39.83 2jzi h PHE 16 CO 0.09 -0.16 -0.35 1.03 -0.60 0.00 0.00 178.31 178.33 2jzi h SER 17 N -0.25 0.00 1.20 2.17 0.87 -1.36 -2.47 113.55 113.71 2jzi h SER 17 Ca -0.01 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.40 2jzi h SER 17 Cb 0.22 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.16 2jzi h SER 17 CO -0.00 0.35 -0.82 0.25 -0.53 0.00 0.00 176.83 176.07 2jzi h LEU 18 N 0.00 0.00 0.00 2.23 6.46 0.39 -3.26 115.31 121.12 2jzi h LEU 18 Ca -0.00 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.71 2jzi h LEU 18 Cb 0.99 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.91 2jzi h LEU 18 CO 0.05 0.66 -0.74 0.15 -0.62 0.00 0.00 178.44 177.94 2jzi h PHE 19 N 0.00 0.00 -3.76 1.25 3.57 -0.14 -3.39 116.94 114.46 2jzi h PHE 19 Ca -0.04 0.00 -0.49 0.00 3.53 0.00 0.00 57.97 60.97 2jzi h PHE 19 Cb 1.54 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 40.26 2jzi h PHE 19 CO 0.00 0.16 0.20 0.34 -2.23 0.00 0.00 178.31 176.79 2jzi s ASP 20 N -5.80 7.05 0.02 0.41 2.15 -0.94 -4.96 116.67 114.61 2jzi s ASP 20 Ca 0.02 1.54 -0.26 0.00 0.43 0.00 0.00 52.55 54.28 2jzi s ASP 20 Cb 0.08 -2.47 -0.17 0.00 -0.30 0.00 0.00 42.92 40.06 2jzi s ASP 20 CO 0.76 -0.11 1.37 0.11 -0.17 0.00 0.00 175.17 177.12 2jzi h LYS 21 N 2.86 -0.33 -0.00 4.34 1.79 -1.86 -2.93 116.57 120.44 2jzi h LYS 21 Ca -0.48 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 2jzi h LYS 21 Cb 1.19 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.91 2jzi h LYS 21 CO 0.64 -0.04 -0.01 -0.40 -1.08 0.00 0.00 179.45 178.57 2jzi n ASP 22 N -5.12 0.01 -3.79 0.86 5.75 -1.26 -4.93 116.55 108.07 2jzi n ASP 22 Ca -0.09 0.19 -0.25 0.00 -0.01 0.00 0.00 54.79 54.63 2jzi n ASP 22 Cb 0.23 -0.39 0.03 0.00 -1.03 0.00 0.00 41.12 39.96 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 1.40 -0.35 1.24 6.12 0.00 -1.11 -4.86 105.19 107.63 2jzi n GLY 23 Ca 0.10 0.15 0.05 0.00 0.00 0.00 0.00 46.02 46.32 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 -2.98 3.56 0.00 1.61 5.75 -1.26 -4.84 116.55 118.39 2jzi n ASP 24 Ca -0.18 -2.45 0.00 0.00 -0.01 0.00 0.00 54.79 52.14 2jzi n ASP 24 Cb 0.63 -0.55 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 2jzi n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jzi n GLY 25 N 0.52 0.72 3.26 6.12 0.00 -1.26 -4.97 105.19 109.58 2jzi n GLY 25 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.77 0.06 -0.10 2.61 -4.23 -1.26 -4.17 115.64 105.79 2jzi s THR 26 Ca 0.00 -0.49 -0.05 0.00 -1.18 0.00 0.00 61.69 59.97 2jzi s THR 26 Cb 0.00 -0.70 -0.04 0.00 1.34 0.00 0.00 72.50 73.10 2jzi s THR 26 CO 0.00 -0.27 0.10 -0.63 -0.54 0.00 0.00 174.62 173.27 2jzi s ILE 27 N -1.59 5.10 0.83 2.99 1.01 -1.26 -4.59 121.20 123.69 2jzi s ILE 27 Ca -0.12 0.03 -0.09 0.00 0.00 0.00 0.00 60.65 60.48 2jzi s ILE 27 Cb -0.04 -3.21 0.15 0.00 0.01 0.00 0.00 42.46 39.37 2jzi s ILE 27 CO 0.03 0.60 1.15 0.28 0.00 0.00 0.00 174.94 176.99 2jzi s THR 28 N -1.00 2.09 0.15 2.92 -1.32 -1.26 -2.84 115.64 114.38 2jzi s THR 28 Ca 0.15 -0.27 -0.09 0.00 -1.21 0.00 0.00 61.69 60.27 2jzi s THR 28 Cb -0.12 -2.82 -0.06 0.00 -1.51 0.00 0.00 72.50 67.99 2jzi s THR 28 CO 0.04 0.00 1.47 0.71 -2.21 0.00 0.00 174.62 174.63 2jzi h THR 29 N -1.04 1.28 -0.96 5.08 1.35 -1.56 -1.35 112.91 115.71 2jzi h THR 29 Ca -0.41 -1.65 0.02 0.00 -0.55 0.00 0.00 66.41 63.82 2jzi h THR 29 Cb 1.26 1.52 -0.05 0.00 -1.73 0.00 0.00 68.15 69.16 2jzi h THR 29 CO 0.43 0.54 0.63 0.07 -0.25 0.00 0.00 175.52 176.94 2jzi h LYS 30 N 0.66 1.24 0.23 4.72 5.09 -1.93 1.14 116.57 127.73 2jzi h LYS 30 Ca 0.04 -0.07 -0.01 0.00 0.09 0.00 0.00 60.65 60.69 2jzi h LYS 30 Cb 1.05 -0.28 0.00 0.00 0.10 0.00 0.00 32.23 33.10 2jzi h LYS 30 CO 0.10 0.82 -0.11 0.93 -2.09 0.00 0.00 179.45 179.10 2jzi h GLU 31 N 1.28 -0.30 0.52 0.07 4.39 -1.90 0.49 114.58 119.12 2jzi h GLU 31 Ca 0.36 0.02 -0.02 0.00 0.34 0.00 0.00 59.36 60.06 2jzi h GLU 31 Cb -0.11 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.60 2jzi h GLU 31 CO -0.09 0.05 -0.32 -0.07 -1.16 0.00 0.00 179.01 177.42 2jzi h LEU 32 N -0.72 -0.80 -0.56 1.33 3.38 -1.05 0.15 115.31 117.04 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 0.49 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.42 2jzi h LEU 32 CO 0.05 -0.50 0.26 1.23 0.09 0.00 0.00 178.44 179.57 2jzi h GLY 33 N -0.80 0.79 1.78 0.83 0.00 0.13 -0.89 103.07 104.92 2jzi h GLY 33 Ca -0.06 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 2jzi h GLY 33 CO 0.06 0.07 -0.02 -0.84 0.00 0.00 0.00 176.54 175.81 2jzi h THR 34 N 0.50 1.14 0.50 4.70 2.02 0.21 0.84 112.91 122.81 2jzi h THR 34 Ca 0.26 -0.56 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 2jzi h THR 34 Cb 0.22 1.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 2jzi h THR 34 CO -0.21 0.18 -0.24 0.58 0.37 0.00 0.00 175.52 176.20 2jzi h VAL 35 N 0.28 0.34 -0.18 3.16 2.07 0.35 0.71 116.25 122.99 2jzi h VAL 35 Ca 0.06 -0.44 -0.18 0.00 0.82 0.00 0.00 66.70 66.96 2jzi h VAL 35 Cb 0.23 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2jzi h VAL 35 CO 0.01 0.05 -0.62 -0.03 0.02 0.00 0.00 177.57 177.01 2jzi h MET 36 N -1.00 0.61 -0.51 1.57 -1.53 -1.17 -1.71 114.93 111.19 2jzi h MET 36 Ca -0.07 -0.42 -0.09 0.00 -3.44 0.00 0.00 59.70 55.68 2jzi h MET 36 Cb 0.60 0.06 -0.02 0.00 -0.55 0.00 0.00 31.60 31.70 2jzi h MET 36 CO 0.11 1.04 -0.03 -0.09 0.14 0.00 0.00 176.91 178.08 2jzi h ARG 37 N 0.45 0.92 0.00 0.39 1.12 0.64 0.27 114.38 118.18 2jzi h ARG 37 Ca -0.01 -0.31 0.00 0.00 -1.11 0.00 0.00 59.98 58.55 2jzi h ARG 37 Cb 1.19 -0.08 0.00 0.00 -0.01 0.00 0.00 29.97 31.07 2jzi h ARG 37 CO 0.12 0.96 0.00 0.45 -3.11 0.00 0.00 179.97 178.39 2jzi n SER 38 N -4.27 0.00 -0.09 -3.80 2.88 0.24 -3.09 113.62 105.49 2jzi n SER 38 Ca 0.01 0.29 -0.14 0.00 -1.33 0.00 0.00 58.87 57.70 2jzi n SER 38 Cb 0.34 -0.43 -0.07 0.00 -0.75 0.00 0.00 64.21 63.31 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 -1.43 1.84 -1.00 2.46 0.00 -0.65 -4.92 117.00 113.30 2jzi n LEU 39 Ca 0.09 0.51 -0.01 0.00 0.00 0.00 0.00 56.01 56.60 2jzi n LEU 39 Cb 0.29 -0.91 0.00 0.00 0.00 0.00 0.00 43.42 42.80 2jzi n LEU 39 CO 0.24 -0.07 0.16 0.61 0.00 0.00 0.00 177.39 178.33 2jzi n GLY 40 N 1.51 -0.36 3.44 -3.96 0.00 -0.14 -5.08 105.19 100.60 2jzi n GLY 40 Ca -0.21 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.55 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 0.51 -2.72 1.61 -0.06 -0.10 -4.97 117.38 111.55 2jzi n GLN 41 Ca -0.05 -3.55 -0.08 0.00 -2.00 0.00 0.00 57.00 51.32 2jzi n GLN 41 Cb 0.42 2.25 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 -1.55 -2.14 -2.77 1.69 0.23 -1.26 -4.37 115.26 105.09 2jzi n ASN 42 Ca -0.01 -3.24 -0.12 0.00 -0.53 0.00 0.00 54.58 50.68 2jzi n ASN 42 Cb 0.63 1.57 0.08 0.00 -2.08 0.00 0.00 39.78 39.98 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 0.00 -0.48 -4.34 -0.53 -0.04 -1.26 -5.10 135.00 123.26 2jzi n PRO 43 Ca 0.03 -0.83 -0.28 0.00 -0.04 0.00 0.00 63.50 62.38 2jzi n PRO 43 Cb 0.76 -0.53 -0.11 0.00 -0.04 0.00 0.00 33.50 33.57 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 -2.11 2.76 0.12 0.52 2.01 -1.26 -5.03 115.64 112.65 2jzi s THR 44 Ca 0.30 -1.71 -0.21 0.00 0.31 0.00 0.00 61.69 60.38 2jzi s THR 44 Cb -0.01 -2.31 -0.05 0.00 0.01 0.00 0.00 72.50 70.14 2jzi s THR 44 CO 0.21 -0.02 1.71 -0.33 -0.69 0.00 0.00 174.62 175.50 2jzi h GLU 45 N 3.37 0.01 -0.11 4.92 4.39 -1.99 -0.43 114.58 124.74 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 0.48 0.00 -0.30 0.00 -1.16 0.00 0.00 179.01 178.04 2jzi h ALA 46 N 1.15 1.30 0.31 3.43 0.00 -1.98 -1.54 119.26 121.93 2jzi h ALA 46 Ca 0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2jzi h ALA 46 Cb 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2jzi h ALA 46 CO -0.16 0.48 -0.15 0.93 0.00 0.00 0.00 179.25 180.36 2jzi h GLU 47 N 0.18 -0.40 -0.28 0.00 5.08 -1.81 -0.21 114.58 117.14 2jzi h GLU 47 Ca 0.03 0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.33 2jzi h GLU 47 Cb 0.63 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 2jzi h GLU 47 CO 0.05 -0.09 -0.16 1.37 -1.00 0.00 0.00 179.01 179.18 2jzi h LEU 48 N -0.72 0.48 -0.54 1.33 -0.00 -1.07 -1.69 115.31 113.10 2jzi h LEU 48 Ca -0.04 -0.13 -0.06 0.00 -0.00 0.00 0.00 57.88 57.64 2jzi h LEU 48 Cb 0.49 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 41.00 2jzi h LEU 48 CO 0.07 0.66 0.10 1.56 -0.00 0.00 0.00 178.44 180.83 2jzi h GLN 49 N 0.45 0.89 -0.38 0.17 4.20 -1.24 0.85 115.11 120.04 2jzi h GLN 49 Ca 0.08 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.55 2jzi h GLN 49 Cb 0.54 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 2jzi h GLN 49 CO 0.03 0.86 0.21 0.22 -0.67 0.00 0.00 178.83 179.48 2jzi h ASP 50 N 0.78 0.48 0.66 1.46 1.82 -0.66 -2.70 116.42 118.25 2jzi h ASP 50 Ca 0.17 -0.09 -0.16 0.00 -0.39 0.00 0.00 57.03 56.55 2jzi h ASP 50 Cb 0.39 -0.12 -0.02 0.00 0.68 0.00 0.00 39.33 40.26 2jzi h ASP 50 CO 0.01 0.43 -0.74 0.24 -1.61 0.00 0.00 179.24 177.57 2jzi h MET 51 N 0.49 0.07 -0.87 0.28 2.86 -1.11 -3.22 114.93 113.42 2jzi h MET 51 Ca 0.13 -0.06 0.15 0.00 -2.06 0.00 0.00 59.70 57.87 2jzi h MET 51 Cb 0.06 0.02 -0.07 0.00 0.06 0.00 0.00 31.60 31.67 2jzi h MET 51 CO -0.02 0.78 0.57 0.82 1.06 0.00 0.00 176.91 180.11 2jzi h ILE 52 N 0.04 0.80 -1.32 -1.22 1.08 0.11 -1.23 117.51 115.77 2jzi h ILE 52 Ca -0.01 -0.21 0.38 0.00 -0.39 0.00 0.00 64.86 64.63 2jzi h ILE 52 Cb 1.31 0.15 -0.05 0.00 -3.07 0.00 0.00 36.82 35.15 2jzi h ILE 52 CO 0.10 0.11 1.05 -1.13 -0.69 0.00 0.00 178.15 177.59 2jzi h ASN 53 N 0.60 0.00 0.16 1.72 -0.73 -1.54 1.02 115.58 116.81 2jzi h ASN 53 Ca 0.44 0.00 -0.29 0.00 1.87 0.00 0.00 56.30 58.32 2jzi h ASN 53 Cb 0.81 0.00 0.03 0.00 0.27 0.00 0.00 38.32 39.43 2jzi h ASN 53 CO -0.19 0.00 -1.22 -0.33 -0.37 0.00 0.00 177.43 175.31 2jzi h GLU 54 N 0.00 0.60 0.00 6.67 3.07 -1.47 -3.22 114.58 120.24 2jzi h GLU 54 Ca 0.63 -0.80 0.00 0.00 -0.50 0.00 0.00 59.36 58.69 2jzi h GLU 54 Cb 2.71 0.26 0.00 0.00 -0.84 0.00 0.00 28.75 30.88 2jzi h GLU 54 CO -0.01 1.36 -0.09 1.33 -1.40 0.00 0.00 179.01 180.20 2jzi n VAL 55 N -3.78 0.18 -4.03 3.13 0.24 0.31 -4.83 118.33 109.55 2jzi n VAL 55 Ca -0.13 -0.09 -0.26 0.00 -2.04 0.00 0.00 64.34 61.82 2jzi n VAL 55 Cb 0.98 -0.42 -0.04 0.00 -1.47 0.00 0.00 33.84 32.89 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 -3.48 5.84 0.08 -1.34 -1.08 0.13 -4.52 116.67 112.30 2jzi s ASP 56 Ca 0.12 -0.02 0.11 0.00 -0.52 0.00 0.00 52.55 52.25 2jzi s ASP 56 Cb 0.17 -1.62 -0.17 0.00 -1.46 0.00 0.00 42.92 39.83 2jzi s ASP 56 CO 0.58 0.05 1.04 0.00 0.52 0.00 0.00 175.17 177.36 2jzi h ALA 57 N 2.23 0.57 -0.00 3.66 0.00 -1.83 -3.36 119.26 120.54 2jzi h ALA 57 Ca -0.48 -1.02 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 1.23 -0.17 -0.40 0.00 0.00 0.00 179.25 180.56 2jzi n ASP 58 N -3.17 0.20 -3.25 0.00 5.68 -1.26 -5.04 116.55 109.69 2jzi n ASP 58 Ca -0.06 -0.60 -0.14 0.00 -0.50 0.00 0.00 54.79 53.48 2jzi n ASP 58 Cb 0.94 0.98 0.06 0.00 -1.14 0.00 0.00 41.12 41.96 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 0.83 6.12 0.00 -1.26 -4.94 105.19 105.85 2jzi n GLY 59 Ca 0.01 0.57 0.08 0.00 0.00 0.00 0.00 46.02 46.68 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 -3.06 3.69 0.00 1.61 6.94 -1.26 -4.79 115.26 118.39 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 0.61 -0.48 0.00 0.00 -2.36 0.00 0.00 39.78 37.54 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 -0.34 0.61 3.43 4.83 0.00 -1.26 -4.97 105.19 107.49 2jzi n GLY 61 Ca 0.19 -0.67 -0.14 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.06 2.61 -4.23 -1.26 -1.26 115.64 109.44 2jzi s THR 62 Ca 0.00 -1.70 0.05 0.00 -1.18 0.00 0.00 61.69 58.86 2jzi s THR 62 Cb 0.00 -2.54 -0.02 0.00 1.34 0.00 0.00 72.50 71.28 2jzi s THR 62 CO 0.00 0.00 -0.21 -0.63 -0.54 0.00 0.00 174.62 173.24 2jzi s ILE 63 N -3.39 2.47 0.69 2.99 1.01 -1.13 -4.11 121.20 119.72 2jzi s ILE 63 Ca 0.32 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 60.00 2jzi s ILE 63 Cb 0.01 -1.93 0.15 0.00 0.01 0.00 0.00 42.46 40.69 2jzi s ILE 63 CO 0.19 0.57 0.94 0.47 0.00 0.00 0.00 174.94 177.11 2jzi n ASP 64 N 2.77 0.74 0.21 3.58 8.00 -1.26 -4.05 116.55 126.54 2jzi n ASP 64 Ca -0.17 -1.75 -0.13 0.00 0.71 0.00 0.00 54.79 53.45 2jzi n ASP 64 Cb 0.52 -0.66 -0.07 0.00 -0.02 0.00 0.00 41.12 40.89 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 -0.97 -0.51 -0.37 1.24 -1.00 -1.99 -0.91 116.94 112.42 2jzi h PHE 65 Ca -0.31 -0.01 -0.08 0.00 2.81 0.00 0.00 57.97 60.38 2jzi h PHE 65 Cb 1.01 0.17 -0.02 0.00 3.61 0.00 0.00 35.95 40.72 2jzi h PHE 65 CO 0.00 -0.18 -0.09 -1.00 -1.61 0.00 0.00 178.31 175.43 2jzi h PRO 66 N -0.90 0.62 0.22 1.51 0.13 -1.98 -1.58 132.00 130.02 2jzi h PRO 66 Ca -0.06 -0.18 -0.01 0.00 -0.87 0.00 0.00 66.00 64.88 2jzi h PRO 66 Cb 0.55 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.62 2jzi h PRO 66 CO 0.09 0.71 -0.11 0.93 -0.23 0.00 0.00 178.00 179.40 2jzi h GLU 67 N 0.58 -0.29 0.45 0.86 4.39 -1.88 0.27 114.58 118.97 2jzi h GLU 67 Ca 0.11 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 2jzi h GLU 67 Cb 0.50 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.20 2jzi h GLU 67 CO 0.03 -0.11 -0.36 0.35 -1.16 0.00 0.00 179.01 177.76 2jzi h PHE 68 N -0.42 -0.96 -0.39 4.33 3.04 -1.01 0.20 116.94 121.74 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 -0.03 -0.52 0.15 -0.07 -2.02 0.00 0.00 178.31 175.83 2jzi h LEU 69 N -0.80 0.19 -1.94 0.59 3.38 -1.29 -0.16 115.31 115.28 2jzi h LEU 69 Ca -0.04 0.04 0.02 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 41.44 2jzi h LEU 69 CO -0.01 0.15 0.10 0.74 0.09 0.00 0.00 178.44 179.51 2jzi h THR 70 N 0.32 0.97 0.83 0.22 2.02 -0.23 0.87 112.91 117.91 2jzi h THR 70 Ca 0.17 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.28 2jzi h THR 70 Cb 0.13 0.88 0.01 0.00 -1.74 0.00 0.00 68.15 67.43 2jzi h THR 70 CO -0.16 0.02 -0.40 -0.03 0.37 0.00 0.00 175.52 175.32 2jzi h MET 71 N 0.08 -1.07 -0.02 6.66 -1.53 0.13 0.06 114.93 119.23 2jzi h MET 71 Ca 0.06 0.07 -0.23 0.00 -3.44 0.00 0.00 59.70 56.17 2jzi h MET 71 Cb 0.15 0.24 0.01 0.00 -0.55 0.00 0.00 31.60 31.45 2jzi h MET 71 CO -0.01 -0.72 -0.92 0.52 0.14 0.00 0.00 176.91 175.93 2jzi h MET 72 N -1.13 0.51 0.00 0.39 2.86 -1.24 -3.09 114.93 113.23 2jzi h MET 72 Ca -0.11 -0.52 0.00 0.00 -2.06 0.00 0.00 59.70 57.01 2jzi h MET 72 Cb 0.85 0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.65 2jzi h MET 72 CO 0.19 1.15 0.00 0.00 1.06 0.00 0.00 176.91 179.31 2jzi n ALA 73 N -2.57 1.53 -1.45 6.32 0.00 0.30 -4.50 120.51 120.13 2jzi n ALA 73 Ca -0.07 0.07 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 2jzi n ALA 73 Cb 0.82 -1.32 0.03 0.00 0.00 0.00 0.00 19.45 18.98 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 -2.03 0.50 0.10 0.00 3.00 0.01 -3.09 116.66 115.14 2jzi n ARG 74 Ca 0.02 0.19 0.10 0.00 -0.00 0.00 0.00 57.85 58.16 2jzi n ARG 74 Cb 0.17 -1.64 0.44 0.00 0.00 0.00 0.00 32.46 31.43 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 0.13 0.13 -0.03 -0.14 3.00 -1.26 -2.24 118.16 117.75 2jzi n LYS 75 Ca 0.11 0.42 -0.04 0.00 -0.00 0.00 0.00 58.31 58.80 2jzi n LYS 75 Cb 0.47 -1.78 -0.13 0.00 0.00 0.00 0.00 35.03 33.58 2jzi n LYS 75 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.40 176.07 2jzi n MET 76 N -2.04 0.65 -2.39 1.64 2.81 -1.26 -4.70 117.12 111.84 2jzi n MET 76 Ca 0.02 0.11 -0.37 0.00 -1.81 0.00 0.00 57.70 55.65 2jzi n MET 76 Cb 0.18 -1.67 -0.03 0.00 -0.71 0.00 0.00 33.22 30.99 2jzi n MET 76 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2jzi s LYS 77 N -2.76 3.39 0.29 0.03 3.01 -0.95 -4.87 119.74 117.88 2jzi s LYS 77 Ca -0.06 -1.51 0.04 0.00 -1.01 0.00 0.00 55.97 53.43 2jzi s LYS 77 Cb 0.08 -5.39 -0.01 0.00 -1.01 0.00 0.00 37.83 31.50 2jzi s LYS 77 CO 0.83 -2.85 0.31 -0.25 0.51 0.00 0.00 175.35 173.91 2jzi n ASP 78 N 10.65 -0.83 -0.64 2.83 8.00 -1.26 -4.76 116.55 130.55 2jzi n ASP 78 Ca 0.45 -2.81 0.00 0.00 0.71 0.00 0.00 54.79 53.14 2jzi n ASP 78 Cb 0.47 1.74 0.00 0.00 -0.02 0.00 0.00 41.12 43.31 2jzi n ASP 78 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2jzi n THR 79 N -0.53 0.00 -2.75 -3.53 -1.04 -1.26 -4.98 114.28 100.19 2jzi n THR 79 Ca 0.04 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.96 2jzi n THR 79 Cb 0.52 0.00 0.04 0.00 -1.82 0.00 0.00 70.33 69.07 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 -2.54 -5.53 0.01 8.00 9.92 -1.26 -4.99 116.55 120.15 2jzi n ASP 80 Ca 0.00 -0.44 -0.05 0.00 -0.53 0.00 0.00 54.79 53.77 2jzi n ASP 80 Cb 0.00 -3.98 -0.03 0.00 -0.64 0.00 0.00 41.12 36.47 2jzi n ASP 80 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 2jzi h SER 81 N -0.61 -0.11 -0.26 -2.24 0.02 -2.02 -3.33 113.55 105.00 2jzi h SER 81 Ca -0.37 -0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 60.38 2jzi h SER 81 Cb 1.19 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.74 2jzi h SER 81 CO 0.30 0.44 0.03 -0.33 -1.14 0.00 0.00 176.83 176.14 2jzi h GLU 82 N -1.01 0.55 -0.96 3.45 5.08 -2.01 -2.42 114.58 117.25 2jzi h GLU 82 Ca -0.01 -0.11 0.27 0.00 -1.00 0.00 0.00 59.36 58.51 2jzi h GLU 82 Cb 0.26 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 2jzi h GLU 82 CO 0.02 0.55 0.69 0.93 -1.00 0.00 0.00 179.01 180.20 2jzi h GLU 83 N 0.53 0.03 0.00 2.33 4.39 -1.97 0.63 114.58 120.52 2jzi h GLU 83 Ca 0.12 -0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.65 2jzi h GLU 83 Cb 0.29 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 2jzi h GLU 83 CO 0.01 0.02 -0.77 0.93 -1.16 0.00 0.00 179.01 178.03 2jzi h GLU 84 N 0.03 0.00 0.00 2.33 5.08 -1.54 -2.21 114.58 118.28 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 0.77 -0.00 0.82 -1.00 0.00 0.00 179.01 179.58 2jzi h ILE 85 N 0.00 1.59 -0.03 3.13 2.04 0.13 -3.25 117.51 121.13 2jzi h ILE 85 Ca -0.01 -2.13 -0.03 0.00 1.00 0.00 0.00 64.86 63.69 2jzi h ILE 85 Cb 1.40 2.98 0.00 0.00 -0.74 0.00 0.00 36.82 40.46 2jzi h ILE 85 CO 0.10 0.53 -0.11 0.03 0.00 0.00 0.00 178.15 178.70 2jzi h ARG 86 N -0.97 0.13 -0.43 2.37 -0.00 -1.32 -3.05 114.38 111.12 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 0.87 0.02 -0.02 0.00 0.00 0.00 0.00 29.97 30.84 2jzi h ARG 86 CO 0.00 0.73 0.42 1.49 0.00 0.00 0.00 179.97 182.62 2jzi h GLU 87 N -0.45 0.00 0.02 0.04 4.22 -1.59 0.40 114.58 117.22 2jzi h GLU 87 Ca -0.01 0.00 -0.22 0.00 0.08 0.00 0.00 59.36 59.22 2jzi h GLU 87 Cb 0.75 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 2jzi h GLU 87 CO 0.02 0.00 -0.95 0.00 -2.18 0.00 0.00 179.01 175.91 2jzi h ALA 88 N 1.56 0.41 0.03 2.92 0.00 -1.57 -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 1.04 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.78 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 -0.04 -0.70 0.00 3.57 -0.13 0.61 116.94 120.39 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 1.60 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 40.31 2jzi h PHE 89 CO 0.04 0.40 0.48 0.07 -2.23 0.00 0.00 178.31 177.07 2jzi h ARG 90 N -0.49 0.30 0.00 1.11 0.11 -1.40 0.18 114.38 114.20 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 -1.10 0.28 0.10 0.00 0.00 179.97 179.46 2jzi h VAL 91 N 0.31 0.26 -0.92 0.08 2.07 -1.40 -3.36 116.25 113.30 2jzi h VAL 91 Ca 0.34 -1.50 0.18 0.00 0.82 0.00 0.00 66.70 66.54 2jzi h VAL 91 Cb 0.90 1.81 -0.08 0.00 -1.52 0.00 0.00 31.29 32.40 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 -3.40 116.94 116.93 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 39.73 2jzi h PHE 92 CO 0.00 0.23 -0.50 0.34 -2.23 0.00 0.00 178.31 176.15 2jzi s ASP 93 N -5.65 6.35 0.21 0.41 -1.08 -1.18 -4.76 116.67 110.97 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 1.61 0.11 0.52 0.00 0.00 175.17 178.43 2jzi h LYS 94 N 3.61 0.75 -0.00 4.34 1.57 -1.87 -3.28 116.57 121.69 2jzi h LYS 94 Ca -0.48 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 57.97 2jzi h LYS 94 Cb 1.18 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.47 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 -4.09 0.42 0.00 0.86 5.68 -1.26 -5.01 116.55 113.15 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 0.46 0.98 0.00 0.00 -1.14 0.00 0.00 41.12 41.42 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 -4.94 105.19 107.13 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 0.55 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 0.32 -0.77 0.00 0.00 -1.02 0.00 0.00 39.78 38.31 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 0.64 3.21 7.41 0.00 -1.26 -5.06 105.19 109.80 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 -2.11 1.55 -0.26 1.61 2.02 -1.26 -3.50 117.35 115.40 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 -4.69 121.20 115.58 2jzi s ILE 100 Ca 0.04 -1.56 -0.12 0.00 -0.26 0.00 0.00 60.65 58.76 2jzi s ILE 100 Cb -0.09 -2.18 0.17 0.00 1.25 0.00 0.00 42.46 41.61 2jzi s ILE 100 CO 0.02 -0.05 1.23 -0.55 0.24 0.00 0.00 174.94 175.83 2jzi s SER 101 N 1.16 3.56 0.43 4.36 0.15 -1.26 -4.23 113.70 117.87 2jzi s SER 101 Ca -0.08 0.17 0.14 0.00 0.70 0.00 0.00 55.95 56.87 2jzi s SER 101 Cb -0.20 -0.34 0.95 0.00 -1.71 0.00 0.00 66.02 64.71 2jzi s SER 101 CO -0.05 -2.43 1.96 0.00 1.20 0.00 0.00 173.24 173.92 2jzi h ALA 102 N -1.31 1.64 0.76 5.45 0.00 -1.89 0.43 119.26 124.35 2jzi h ALA 102 Ca -0.43 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.25 2jzi h ALA 102 Cb 1.25 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.01 2jzi h ALA 102 CO 0.41 0.27 -0.37 0.00 0.00 0.00 0.00 179.25 179.57 2jzi h ALA 103 N 1.78 -1.02 0.02 0.00 0.00 -1.98 -1.69 119.26 116.37 2jzi h ALA 103 Ca 0.00 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 2jzi h ALA 103 Cb 0.37 0.40 0.01 0.00 0.00 0.00 0.00 17.79 18.57 2jzi h ALA 103 CO 0.03 -1.05 -0.50 0.93 0.00 0.00 0.00 179.25 178.65 2jzi h GLU 104 N -1.07 0.31 -0.74 0.00 4.39 -1.91 -3.16 114.58 112.40 2jzi h GLU 104 Ca -0.10 -0.36 0.20 0.00 0.34 0.00 0.00 59.36 59.44 2jzi h GLU 104 Cb 0.79 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.51 2jzi h GLU 104 CO 0.17 1.06 0.52 1.25 -1.16 0.00 0.00 179.01 180.86 2jzi h LEU 105 N -0.28 0.10 -0.02 1.33 5.85 -0.22 -0.85 115.31 121.22 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 0.05 -0.07 -0.09 -0.34 0.00 0.00 178.44 178.09 2jzi h ARG 106 N 0.11 0.07 -0.76 1.25 2.43 -1.34 -0.46 114.38 115.69 2jzi h ARG 106 Ca 0.36 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.50 2jzi h ARG 106 Cb 1.27 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.78 2jzi h ARG 106 CO -0.04 0.70 0.48 0.45 -1.51 0.00 0.00 179.97 180.05 2jzi h HIS 107 N -0.54 0.90 -0.18 2.20 3.86 -1.22 0.81 115.15 120.99 2jzi h HIS 107 Ca -0.00 0.02 -0.22 0.00 -1.16 0.00 0.00 60.37 59.01 2jzi h HIS 107 Cb 0.71 -0.30 0.01 0.00 1.06 0.00 0.00 27.41 28.89 2jzi h HIS 107 CO 0.15 0.52 -0.74 0.28 0.86 0.00 0.00 177.93 179.00 2jzi h VAL 108 N 0.94 1.28 0.13 2.45 2.07 -1.27 -2.49 116.25 119.36 2jzi h VAL 108 Ca 0.30 -1.94 -0.01 0.00 0.82 0.00 0.00 66.70 65.88 2jzi h VAL 108 Cb 0.00 1.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2jzi h VAL 108 CO -0.11 0.62 -0.06 0.24 0.02 0.00 0.00 177.57 178.28 2jzi h MET 109 N 0.56 -0.16 -0.31 1.57 2.07 -0.74 -2.92 114.93 115.00 2jzi h MET 109 Ca -0.04 0.01 0.05 0.00 -2.07 0.00 0.00 59.70 57.65 2jzi h MET 109 Cb 1.36 0.04 -0.05 0.00 -1.87 0.00 0.00 31.60 31.08 2jzi h MET 109 CO 0.15 0.30 0.02 1.15 1.07 0.00 0.00 176.91 179.61 2jzi h THR 110 N -0.87 0.80 -0.11 2.22 2.02 0.54 1.03 112.91 118.54 2jzi h THR 110 Ca -0.02 -0.04 0.03 0.00 0.77 0.00 0.00 66.41 67.15 2jzi h THR 110 Cb 0.54 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2jzi h THR 110 CO 0.03 0.02 0.08 0.78 0.37 0.00 0.00 175.52 176.80 2jzi h ASN 111 N 0.12 0.00 -0.48 4.18 -0.26 -1.56 -2.26 115.58 115.32 2jzi h ASN 111 Ca 0.15 0.00 -0.35 0.00 -0.56 0.00 0.00 56.30 55.54 2jzi h ASN 111 Cb 0.18 0.00 -0.29 0.00 -1.06 0.00 0.00 38.32 37.15 2jzi h ASN 111 CO -0.23 0.00 -0.75 0.18 -1.06 0.00 0.00 177.43 175.58 2jzi n LEU 112 N -4.46 3.92 0.00 1.61 4.32 -0.36 -4.71 117.00 117.31 2jzi n LEU 112 Ca -0.00 -4.30 0.00 0.00 -0.02 0.00 0.00 56.01 51.69 2jzi n LEU 112 Cb 0.20 -0.34 0.00 0.00 -1.62 0.00 0.00 43.42 41.66 2jzi n LEU 112 CO 0.34 1.78 0.00 0.61 -1.22 0.00 0.00 177.39 178.90 2jzi n GLY 113 N -0.79 0.34 3.28 -0.72 0.00 0.34 -4.90 105.19 102.74 2jzi n GLY 113 Ca 0.33 0.49 -0.15 0.00 0.00 0.00 0.00 46.02 46.68 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 2.32 1.36 -0.71 1.61 -1.05 -1.25 -4.90 118.70 116.08 2jzi s GLU 114 Ca 0.00 -1.73 -0.26 0.00 -0.15 0.00 0.00 54.97 52.82 2jzi s GLU 114 Cb 0.00 -0.09 -0.00 0.00 -0.44 0.00 0.00 34.13 33.60 2jzi s GLU 114 CO 0.00 -0.34 1.68 0.21 0.95 0.00 0.00 175.26 177.76 2jzi s LYS 115 N -4.05 2.84 -0.38 -4.83 2.20 -1.26 -3.82 119.74 110.44 2jzi s LYS 115 Ca 0.38 0.14 -0.22 0.00 -0.36 0.00 0.00 55.97 55.91 2jzi s LYS 115 Cb 0.07 -4.48 0.01 0.00 -1.51 0.00 0.00 37.83 31.92 2jzi s LYS 115 CO 0.13 -2.61 0.71 -0.48 -0.36 0.00 0.00 175.35 172.74 2jzi s LEU 116 N 7.98 4.23 1.10 5.43 2.34 -1.26 -5.02 118.68 133.48 2jzi s LEU 116 Ca 0.57 0.15 -0.17 0.00 0.06 0.00 0.00 54.13 54.74 2jzi s LEU 116 Cb -0.10 -2.89 0.24 0.00 -0.56 0.00 0.00 46.19 42.88 2jzi s LEU 116 CO 0.14 -0.70 1.14 -0.89 -1.06 0.00 0.00 176.35 174.98 2jzi s THR 117 N 2.93 1.78 0.41 5.48 2.01 -1.26 -4.33 115.64 122.66 2jzi s THR 117 Ca 0.27 0.00 0.21 0.00 0.31 0.00 0.00 61.69 62.49 2jzi s THR 117 Cb -0.14 -2.59 0.41 0.00 0.01 0.00 0.00 72.50 70.20 2jzi s THR 117 CO 0.17 0.00 1.76 0.44 -0.69 0.00 0.00 174.62 176.29 2jzi h ASP 118 N -2.21 0.39 0.48 3.53 5.19 -1.98 0.85 116.42 122.67 2jzi h ASP 118 Ca -0.47 0.08 -0.24 0.00 -0.62 0.00 0.00 57.03 55.78 2jzi h ASP 118 Cb 1.30 0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.83 2jzi h ASP 118 CO 0.42 0.05 -1.04 -0.33 -3.12 0.00 0.00 179.24 175.22 2jzi h GLU 119 N 0.32 0.32 -0.06 3.56 5.08 -1.98 -1.00 114.58 120.82 2jzi h GLU 119 Ca 0.62 -0.41 -0.16 0.00 -1.00 0.00 0.00 59.36 58.40 2jzi h GLU 119 Cb 1.69 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 31.06 2jzi h GLU 119 CO -0.29 1.12 -0.67 0.93 -1.00 0.00 0.00 179.01 179.10 2jzi h GLU 120 N 0.15 0.28 -0.01 2.33 4.39 -0.25 0.20 114.58 121.66 2jzi h GLU 120 Ca -0.09 -0.21 -0.03 0.00 0.34 0.00 0.00 59.36 59.36 2jzi h GLU 120 Cb 1.71 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.40 2jzi h GLU 120 CO 0.17 0.84 -0.12 0.28 -1.16 0.00 0.00 179.01 179.02 2jzi h VAL 121 N 0.19 1.54 0.26 3.13 2.07 0.39 -2.62 116.25 121.21 2jzi h VAL 121 Ca -0.02 -1.76 -0.01 0.00 0.82 0.00 0.00 66.70 65.73 2jzi h VAL 121 Cb 1.21 2.66 -0.00 0.00 -1.52 0.00 0.00 31.29 33.64 2jzi h VAL 121 CO 0.11 0.47 -0.15 0.44 0.02 0.00 0.00 177.57 178.46 2jzi h ASP 122 N -0.56 -0.36 -0.24 0.57 5.19 -1.20 -0.22 116.42 119.60 2jzi h ASP 122 Ca -0.01 0.02 0.07 0.00 -0.62 0.00 0.00 57.03 56.49 2jzi h ASP 122 Cb 0.84 0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.44 2jzi h ASP 122 CO 0.03 -0.24 0.19 1.05 -3.12 0.00 0.00 179.24 177.14 2jzi h GLU 123 N -0.39 0.00 0.01 3.56 -0.00 -1.06 0.23 114.58 116.93 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 29.08 2jzi h GLU 123 CO 0.04 0.00 -1.02 1.98 -0.00 0.00 0.00 179.01 180.01 2jzi h MET 124 N 0.00 0.57 -0.30 1.06 4.05 -0.96 -2.89 114.93 116.45 2jzi h MET 124 Ca 0.11 -0.63 -0.08 0.00 -0.28 0.00 0.00 59.70 58.82 2jzi h MET 124 Cb 0.49 0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 31.47 2jzi h MET 124 CO -0.00 1.24 -0.14 0.82 0.23 0.00 0.00 176.91 179.06 2jzi h ILE 125 N 0.31 1.29 -0.79 1.77 2.04 0.67 0.17 117.51 122.97 2jzi h ILE 125 Ca -0.11 -1.23 -0.03 0.00 1.00 0.00 0.00 64.86 64.49 2jzi h ILE 125 Cb 1.67 1.45 -0.04 0.00 -0.74 0.00 0.00 36.82 39.16 2jzi h ILE 125 CO 0.19 0.39 0.38 0.03 0.00 0.00 0.00 178.15 179.15 2jzi h ARG 126 N 0.39 1.14 0.16 2.37 3.08 -1.11 0.17 114.38 120.58 2jzi h ARG 126 Ca 0.07 -0.17 -0.30 0.00 0.07 0.00 0.00 59.98 59.66 2jzi h ARG 126 Cb 0.65 -0.21 0.01 0.00 0.08 0.00 0.00 29.97 30.51 2jzi h ARG 126 CO 0.04 0.88 -1.35 1.05 -1.07 0.00 0.00 179.97 179.52 2jzi h GLU 127 N 1.12 0.34 -0.27 0.04 4.11 -1.50 -3.29 114.58 115.14 2jzi h GLU 127 Ca 0.27 -0.58 -0.10 0.00 0.07 0.00 0.00 59.36 59.02 2jzi h GLU 127 Cb 0.11 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2jzi h GLU 127 CO -0.04 1.27 -0.26 0.00 0.07 0.00 0.00 179.01 180.05 2jzi h ALA 128 N 0.46 1.05 -3.10 1.06 0.00 -0.52 -3.43 119.26 114.77 2jzi h ALA 128 Ca -0.18 -0.36 -0.65 0.00 0.00 0.00 0.00 54.91 53.72 2jzi h ALA 128 Cb 2.03 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 19.60 2jzi h ALA 128 CO 0.22 0.57 -0.58 0.34 0.00 0.00 0.00 179.25 179.81 2jzi s ASP 129 N -6.80 5.68 -0.03 0.00 2.15 0.59 -3.60 116.67 114.66 2jzi s ASP 129 Ca -0.07 0.14 -0.14 0.00 0.43 0.00 0.00 52.55 52.91 2jzi s ASP 129 Cb 0.14 -1.63 -0.32 0.00 -0.30 0.00 0.00 42.92 40.80 2jzi s ASP 129 CO 0.80 0.27 0.80 0.16 -0.17 0.00 0.00 175.17 177.02 2jzi h ILE 130 N 3.19 1.12 0.00 4.11 3.07 -1.84 -3.28 117.51 123.89 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 1.18 2.90 0.00 0.00 -0.27 0.00 0.00 36.82 40.63 2jzi h ILE 130 CO 0.62 0.81 0.00 0.47 -1.05 0.00 0.00 178.15 179.01 2jzi n ASP 131 N -3.73 0.15 -3.03 2.16 9.92 -1.26 -4.83 116.55 115.94 2jzi n ASP 131 Ca -0.21 0.54 -0.13 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 40.93 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 -0.17 -0.48 0.01 0.44 0.00 -1.24 -4.73 105.19 99.04 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 0.69 0.00 1.61 5.75 -1.26 -4.96 116.55 116.56 2jzi n ASP 133 Ca 0.01 -0.48 0.00 0.00 -0.01 0.00 0.00 54.79 54.31 2jzi n ASP 133 Cb 0.50 0.83 0.00 0.00 -1.03 0.00 0.00 41.12 41.42 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 -0.02 0.46 -0.24 1.61 -2.07 -1.26 -4.40 119.66 113.74 2jzi s GLN 135 Ca 0.00 -0.17 -0.01 0.00 -1.82 0.00 0.00 55.36 53.36 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 -0.98 0.98 0.93 3.63 1.01 -1.26 -4.65 120.40 120.06 2jzi s VAL 136 Ca -0.11 -1.03 -0.15 0.00 0.00 0.00 0.00 61.98 60.70 2jzi s VAL 136 Cb -0.06 -1.48 0.17 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 1.62 3.39 0.04 3.32 2.47 -1.23 -3.82 114.94 120.73 2jzi s ASN 137 Ca 0.01 0.51 -0.09 0.00 0.42 0.00 0.00 52.86 53.70 2jzi s ASN 137 Cb -0.18 -0.75 -0.03 0.00 -1.45 0.00 0.00 41.25 38.84 2jzi s ASN 137 CO -0.12 -2.58 1.16 0.22 -3.72 0.00 0.00 177.10 172.05 2jzi h TYR 138 N -1.53 -0.49 0.00 0.43 3.20 -1.96 -1.73 116.97 114.88 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 39.77 2jzi h TYR 138 CO -0.66 -0.14 -0.14 0.93 -1.64 0.00 0.00 178.16 176.50 2jzi h GLU 139 N -0.12 0.00 -0.34 1.82 5.08 -1.97 -2.37 114.58 116.69 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 29.37 2jzi h GLU 139 CO -0.17 0.14 0.04 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 0.15 0.11 -0.72 0.92 -5.15 -1.36 -3.28 116.94 107.60 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 1.01 0.31 0.28 -2.00 0.00 0.00 178.31 177.71 2jzi h VAL 142 N 0.02 0.74 -0.86 0.88 2.07 -0.81 1.05 116.25 119.33 2jzi h VAL 142 Ca -0.03 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.33 2jzi h VAL 142 Cb 1.71 0.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 2jzi h VAL 142 CO 0.14 0.09 0.57 1.56 0.02 0.00 0.00 177.57 179.95 2jzi h GLN 143 N 0.50 1.12 -0.14 1.57 4.20 -1.28 -2.06 115.11 119.02 2jzi h GLN 143 Ca 0.38 -0.07 -0.20 0.00 0.06 0.00 0.00 58.65 58.82 2jzi h GLN 143 Cb 0.51 -0.25 0.01 0.00 0.30 0.00 0.00 27.48 28.05 2jzi h GLN 143 CO -0.34 0.74 -0.70 1.98 -0.67 0.00 0.00 178.83 179.83 2jzi h MET 144 N 1.15 0.72 -0.76 1.46 4.05 -0.74 -1.95 114.93 118.86 2jzi h MET 144 Ca 0.32 -0.59 0.12 0.00 -0.28 0.00 0.00 59.70 59.27 2jzi h MET 144 Cb -0.10 0.12 -0.08 0.00 -0.80 0.00 0.00 31.60 30.74 2jzi h MET 144 CO -0.08 1.20 0.37 1.98 0.23 0.00 0.00 176.91 180.62 2jzi h MET 145 N 0.42 0.57 0.03 0.39 1.85 0.15 -1.29 114.93 117.05 2jzi h MET 145 Ca -0.05 -0.03 -0.21 0.00 -0.61 0.00 0.00 59.70 58.79 2jzi h MET 145 Cb 1.34 -0.13 -0.02 0.00 0.43 0.00 0.00 31.60 33.22 2jzi h MET 145 CO 0.15 0.38 -1.00 0.00 -0.40 0.00 0.00 176.91 176.03 2jzi h THR 146 N 0.58 1.62 -4.22 -0.77 1.03 -1.42 -3.46 112.91 106.27 2jzi h THR 146 Ca 0.39 -3.14 -0.52 0.00 -0.01 0.00 0.00 66.41 63.13 2jzi h THR 146 Cb 0.49 2.76 0.20 0.00 -1.07 0.00 0.00 68.15 70.53 2jzi h THR 146 CO -0.32 0.90 0.22 0.00 -0.01 0.00 0.00 175.52 176.31 2jzi n ALA 147 N -2.41 -0.69 -1.25 0.00 0.00 -0.49 -5.12 120.51 110.55 2jzi n ALA 147 Ca -0.02 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.91 2jzi n ALA 147 Cb 0.91 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 18.16 2jzi n ALA 147 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86