#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xjz n GLN 11 N 0.00 0.00 -1.75 -0.52 0.00 -1.26 -4.56 117.38 109.29 1xjz n GLN 11 Ca 0.00 0.33 -0.42 0.00 -0.00 0.00 0.00 57.00 56.91 1xjz n GLN 11 Cb 0.00 -1.15 -0.01 0.00 0.00 0.00 0.00 30.24 29.08 1xjz n GLN 11 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1xjz n ASP 12 N -1.49 3.59 -0.29 1.69 8.00 -1.26 -4.81 116.55 121.97 1xjz n ASP 12 Ca 0.00 1.20 0.02 0.00 0.71 0.00 0.00 54.79 56.71 1xjz n ASP 12 Cb 0.00 -1.58 0.15 0.00 -0.02 0.00 0.00 41.12 39.67 1xjz n ASP 12 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1xjz h LEU 13 N 3.52 0.70 -1.01 0.64 5.85 -1.90 0.43 115.31 123.54 1xjz h LEU 13 Ca -0.48 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.32 1xjz h LEU 13 Cb 1.25 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 42.11 1xjz h LEU 13 CO 0.69 0.42 0.65 0.77 -0.34 0.00 0.00 178.44 180.63 1xjz h SER 14 N 0.82 1.07 0.07 1.25 4.64 -1.90 0.20 113.55 119.70 1xjz h SER 14 Ca 0.38 -0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.47 1xjz h SER 14 Cb 0.30 -0.23 0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1xjz h SER 14 CO -0.22 0.71 -0.87 -0.08 -0.87 0.00 0.00 176.83 175.50 1xjz h GLU 15 N 1.23 0.62 -0.43 4.77 4.81 -1.69 -2.75 114.58 121.12 1xjz h GLU 15 Ca 0.42 -0.57 -0.04 0.00 -0.13 0.00 0.00 59.36 59.03 1xjz h GLU 15 Cb 0.08 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1xjz h GLU 15 CO -0.15 1.19 0.11 0.00 -0.73 0.00 0.00 179.01 179.42 1xjz h ALA 16 N 0.63 0.57 -0.53 2.92 0.00 -0.13 -2.44 119.26 120.30 1xjz h ALA 16 Ca -0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1xjz h ALA 16 Cb 1.49 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1xjz h ALA 16 CO 0.17 0.26 0.29 -0.07 0.00 0.00 0.00 179.25 179.89 1xjz h LEU 17 N 0.57 0.66 -0.18 0.00 3.38 -0.66 -1.78 115.31 117.30 1xjz h LEU 17 Ca 0.14 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.04 1xjz h LEU 17 Cb 0.32 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1xjz h LEU 17 CO 0.00 0.56 0.03 0.50 0.09 0.00 0.00 178.44 179.62 1xjz h LYS 18 N 0.70 0.09 -0.26 1.13 3.64 -1.35 -1.66 116.57 118.86 1xjz h LYS 18 Ca 0.18 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 1xjz h LYS 18 Cb 0.05 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1xjz h LYS 18 CO -0.03 0.06 -0.01 1.49 -2.27 0.00 0.00 179.45 178.70 1xjz h GLU 19 N 0.10 0.46 0.00 1.90 4.81 -1.35 -3.01 114.58 117.49 1xjz h GLU 19 Ca 0.08 -0.15 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 1xjz h GLU 19 Cb 0.08 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 1xjz h GLU 19 CO -0.11 0.63 -0.26 0.00 -0.73 0.00 0.00 179.01 178.54 1xjz h ALA 20 N 0.81 1.50 -0.39 2.92 0.00 -1.22 -2.75 119.26 120.13 1xjz h ALA 20 Ca 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1xjz h ALA 20 Cb 0.43 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1xjz h ALA 20 CO 0.01 0.33 0.00 0.25 0.00 0.00 0.00 179.25 179.84 1xjz n THR 21 N -4.13 0.51 -0.32 0.00 -2.24 -0.63 -4.36 114.28 103.11 1xjz n THR 21 Ca -0.02 -0.66 0.05 0.00 -2.27 0.00 0.00 64.05 61.15 1xjz n THR 21 Cb 0.32 0.66 0.20 0.00 -2.10 0.00 0.00 70.33 69.41 1xjz n THR 21 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1xjz h LYS 22 N 3.61 0.81 0.50 -0.78 3.64 -1.34 -0.45 116.57 122.56 1xjz h LYS 22 Ca 0.00 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1xjz h LYS 22 Cb 0.80 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1xjz h LYS 22 CO 0.00 0.54 -0.24 1.49 -2.27 0.00 0.00 179.45 178.97 1xjz h GLU 23 N 0.84 -0.65 0.00 1.90 4.81 -1.81 -2.73 114.58 116.94 1xjz h GLU 23 Ca 0.45 0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.72 1xjz h GLU 23 Cb 0.46 0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.99 1xjz h GLU 23 CO -0.27 -0.37 -0.01 -0.39 -0.73 0.00 0.00 179.01 177.24 1xjz h VAL 24 N -1.09 0.65 -0.59 0.32 -1.51 -1.82 -0.11 116.25 112.11 1xjz h VAL 24 Ca -0.07 -0.04 -0.11 0.00 -1.23 0.00 0.00 66.70 65.26 1xjz h VAL 24 Cb 0.58 1.02 -0.02 0.00 -2.13 0.00 0.00 31.29 30.75 1xjz h VAL 24 CO 0.11 0.01 -0.05 -0.74 -1.23 0.00 0.00 177.57 175.68 1xjz h HIS 25 N 0.00 1.18 -0.56 5.19 -0.00 -1.06 0.13 115.15 120.02 1xjz h HIS 25 Ca -0.00 -0.22 -0.03 0.00 -0.00 0.00 0.00 60.37 60.11 1xjz h HIS 25 Cb 0.02 -0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 27.11 1xjz h HIS 25 CO 0.00 1.05 0.21 1.15 -0.00 0.00 0.00 177.93 180.34 1xjz h THR 26 N 0.96 1.23 -0.16 6.26 2.02 -0.72 -0.31 112.91 122.19 1xjz h THR 26 Ca 0.16 -0.72 -0.04 0.00 0.77 0.00 0.00 66.41 66.59 1xjz h THR 26 Cb 0.62 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 1xjz h THR 26 CO 0.04 0.27 -0.06 1.56 0.37 0.00 0.00 175.52 177.70 1xjz h GLN 27 N 0.76 0.24 -0.38 6.66 4.20 -0.92 -0.01 115.11 125.66 1xjz h GLN 27 Ca 0.18 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.78 1xjz h GLN 27 Cb 0.22 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1xjz h GLN 27 CO -0.01 0.32 -0.06 0.00 -0.67 0.00 0.00 178.83 178.40 1xjz h ALA 28 N 1.71 0.51 -0.19 3.87 0.00 0.32 -2.39 119.26 123.09 1xjz h ALA 28 Ca 0.05 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 1xjz h ALA 28 Cb 0.26 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1xjz h ALA 28 CO 0.01 0.34 -0.15 0.93 0.00 0.00 0.00 179.25 180.38 1xjz h GLU 29 N 0.51 0.32 -0.00 0.00 5.08 -0.21 -2.76 114.58 117.51 1xjz h GLU 29 Ca 0.10 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1xjz h GLU 29 Cb 0.56 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1xjz h GLU 29 CO 0.03 0.47 -0.07 0.09 -1.00 0.00 0.00 179.01 178.54 1xjz n ASN 30 N -4.23 0.23 -4.71 1.42 3.02 -0.10 -3.74 115.26 107.16 1xjz n ASN 30 Ca -0.00 -0.33 -0.42 0.00 -0.03 0.00 0.00 54.58 53.80 1xjz n ASN 30 Cb 0.30 -0.17 -0.03 0.00 -0.61 0.00 0.00 39.78 39.27 1xjz n ASN 30 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xjz s ALA 31 N -2.56 3.86 0.25 5.41 0.00 -0.92 -4.72 121.76 123.08 1xjz s ALA 31 Ca 0.28 1.50 -0.12 0.00 0.00 0.00 0.00 51.96 53.62 1xjz s ALA 31 Cb 0.20 -3.70 0.34 0.00 0.00 0.00 0.00 23.12 19.96 1xjz s ALA 31 CO 0.48 -1.00 1.58 1.49 0.00 0.00 0.00 175.76 178.31 1xjz h GLU 32 N 7.39 -0.01 0.18 0.00 4.81 -1.91 1.23 114.58 126.27 1xjz h GLU 32 Ca -0.44 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 58.80 1xjz h GLU 32 Cb 1.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 1xjz h GLU 32 CO 0.95 -0.01 -0.21 0.35 -0.73 0.00 0.00 179.01 179.36 1xjz h PHE 33 N -0.01 -0.56 -0.77 0.92 3.57 -1.89 0.25 116.94 118.44 1xjz h PHE 33 Ca 0.39 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.85 1xjz h PHE 33 Cb 0.62 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.55 1xjz h PHE 33 CO -0.69 -0.31 0.28 0.52 -2.23 0.00 0.00 178.31 175.88 1xjz h MET 34 N -0.44 1.17 -0.25 1.11 2.86 -1.45 -0.69 114.93 117.24 1xjz h MET 34 Ca 0.01 -0.23 0.05 0.00 -2.06 0.00 0.00 59.70 57.47 1xjz h MET 34 Cb 0.43 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.86 1xjz h MET 34 CO -0.07 0.97 -0.04 -0.09 1.06 0.00 0.00 176.91 178.73 1xjz h ARG 35 N 1.13 0.02 -0.11 1.72 2.43 0.19 0.15 114.38 119.92 1xjz h ARG 35 Ca 0.25 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 1xjz h ARG 35 Cb 0.26 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1xjz h ARG 35 CO -0.02 0.01 0.04 -0.91 -1.51 0.00 0.00 179.97 177.59 1xjz h ASN 36 N 0.02 0.15 -0.51 -3.80 -0.26 -0.16 -2.47 115.58 108.55 1xjz h ASN 36 Ca 0.12 -0.18 0.08 0.00 -0.56 0.00 0.00 56.30 55.76 1xjz h ASN 36 Cb 0.17 -0.04 -0.07 0.00 -1.06 0.00 0.00 38.32 37.33 1xjz h ASN 36 CO -0.24 0.29 0.13 0.15 -1.06 0.00 0.00 177.43 176.70 1xjz h PHE 37 N 0.01 0.22 -0.58 1.19 3.04 -0.77 0.19 116.94 120.24 1xjz h PHE 37 Ca 0.04 0.03 0.11 0.00 3.98 0.00 0.00 57.97 62.12 1xjz h PHE 37 Cb 0.18 -0.02 -0.03 0.00 2.56 0.00 0.00 35.95 38.64 1xjz h PHE 37 CO -0.01 0.03 0.39 0.37 -2.02 0.00 0.00 178.31 177.07 1xjz h GLN 38 N 0.28 0.31 -0.29 1.11 4.15 -0.51 0.35 115.11 120.51 1xjz h GLN 38 Ca 0.25 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.65 1xjz h GLN 38 Cb 0.32 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.94 1xjz h GLN 38 CO -0.30 0.21 0.00 1.63 -1.93 0.00 0.00 178.83 178.43 1xjz n LYS 39 N -4.46 1.12 -1.08 1.69 5.02 0.49 -4.80 118.16 116.15 1xjz n LYS 39 Ca 0.10 -0.15 -0.03 0.00 -2.02 0.00 0.00 58.31 56.21 1xjz n LYS 39 Cb 0.42 -1.17 -0.01 0.00 -0.02 0.00 0.00 35.03 34.25 1xjz n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xjz n GLY 40 N 0.42 0.49 3.31 0.72 0.00 0.12 -4.94 105.19 105.31 1xjz n GLY 40 Ca 0.01 -0.13 -0.46 0.00 0.00 0.00 0.00 46.02 45.45 1xjz n GLY 40 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xjz s GLN 41 N -1.55 3.01 -0.18 1.61 2.00 -0.10 -4.78 119.66 119.68 1xjz s GLN 41 Ca 0.00 -1.73 -0.26 0.00 -2.00 0.00 0.00 55.36 51.38 1xjz s GLN 41 Cb 0.00 -4.30 0.07 0.00 0.80 0.00 0.00 33.01 29.57 1xjz s GLN 41 CO 0.00 -1.33 0.66 0.54 -0.50 0.00 0.00 175.29 174.66 1xjz s VAL 42 N 1.57 0.00 0.39 1.34 0.11 -1.26 -2.66 120.40 119.89 1xjz s VAL 42 Ca 0.04 -0.02 0.08 0.00 -2.93 0.00 0.00 61.98 59.14 1xjz s VAL 42 Cb -0.29 -0.94 -0.03 0.00 -1.53 0.00 0.00 36.38 33.58 1xjz s VAL 42 CO 0.03 -0.01 0.29 0.42 -3.33 0.00 0.00 175.10 172.50 1xjz s THR 43 N -0.22 2.85 0.15 5.04 -4.23 -1.26 -4.79 115.64 113.17 1xjz s THR 43 Ca -0.04 -1.46 -0.18 0.00 -1.18 0.00 0.00 61.69 58.83 1xjz s THR 43 Cb -0.03 -3.04 0.01 0.00 1.34 0.00 0.00 72.50 70.79 1xjz s THR 43 CO 0.04 -0.07 1.71 0.03 -0.54 0.00 0.00 174.62 175.79 1xjz h ARG 44 N 1.22 0.07 -0.50 3.99 3.08 -1.95 0.47 114.38 120.76 1xjz h ARG 44 Ca -0.43 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.62 1xjz h ARG 44 Cb 1.26 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.27 1xjz h ARG 44 CO 0.60 0.05 0.30 -0.44 -1.07 0.00 0.00 179.97 179.42 1xjz h ASP 45 N 0.08 0.59 -0.15 7.04 5.19 -1.98 0.36 116.42 127.54 1xjz h ASP 45 Ca 0.14 -0.03 -0.06 0.00 -0.62 0.00 0.00 57.03 56.46 1xjz h ASP 45 Cb 0.19 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 39.55 1xjz h ASP 45 CO -0.24 0.45 -0.14 1.23 -3.12 0.00 0.00 179.24 177.42 1xjz h GLY 46 N 0.72 0.39 1.04 2.75 0.00 -1.71 -2.19 103.07 104.06 1xjz h GLY 46 Ca 0.18 -0.39 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 1xjz h GLY 46 CO -0.03 0.35 0.27 -2.75 0.00 0.00 0.00 176.54 174.37 1xjz h PHE 47 N -0.01 1.14 -0.70 5.60 3.57 -0.42 -2.16 116.94 123.96 1xjz h PHE 47 Ca 0.02 -0.10 0.05 0.00 3.53 0.00 0.00 57.97 61.48 1xjz h PHE 47 Cb 0.66 -0.34 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 1xjz h PHE 47 CO 0.08 0.88 0.41 0.87 -2.23 0.00 0.00 178.31 178.32 1xjz h LYS 48 N 1.06 0.73 -0.72 1.11 1.57 -0.22 -1.13 116.57 118.98 1xjz h LYS 48 Ca 0.24 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.93 1xjz h LYS 48 Cb 0.25 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 1xjz h LYS 48 CO -0.02 0.49 0.25 -0.07 -0.57 0.00 0.00 179.45 179.53 1xjz h LEU 49 N 0.76 1.01 -0.80 2.94 3.38 -0.92 -1.20 115.31 120.48 1xjz h LEU 49 Ca 0.31 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 1xjz h LEU 49 Cb 0.15 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1xjz h LEU 49 CO -0.17 0.92 -0.25 -0.37 0.09 0.00 0.00 178.44 178.67 1xjz h VAL 50 N 1.05 1.27 -0.43 1.22 -1.51 -0.80 -0.78 116.25 116.29 1xjz h VAL 50 Ca 0.24 -1.33 -0.14 0.00 -1.23 0.00 0.00 66.70 64.24 1xjz h VAL 50 Cb 0.26 1.30 -0.01 0.00 -2.13 0.00 0.00 31.29 30.71 1xjz h VAL 50 CO -0.01 0.43 -0.27 0.24 -1.23 0.00 0.00 177.57 176.73 1xjz h MET 51 N 0.54 0.94 -0.59 5.19 2.86 -0.81 -0.87 114.93 122.19 1xjz h MET 51 Ca 0.08 -0.44 -0.08 0.00 -2.06 0.00 0.00 59.70 57.20 1xjz h MET 51 Cb 0.72 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.34 1xjz h MET 51 CO 0.06 1.10 0.04 0.00 1.06 0.00 0.00 176.91 179.17 1xjz h ALA 52 N 0.82 0.97 0.07 6.32 0.00 -1.07 -1.48 119.26 124.88 1xjz h ALA 52 Ca 0.09 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1xjz h ALA 52 Cb 0.85 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1xjz h ALA 52 CO 0.08 0.63 -0.04 0.77 0.00 0.00 0.00 179.25 180.69 1xjz h SER 53 N 0.91 -0.09 -0.84 0.00 0.02 -0.91 -2.24 113.55 110.41 1xjz h SER 53 Ca 0.17 0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.18 1xjz h SER 53 Cb 0.47 0.03 -0.06 0.00 0.14 0.00 0.00 62.40 62.99 1xjz h SER 53 CO 0.02 -0.06 0.53 -0.07 -1.14 0.00 0.00 176.83 176.10 1xjz h LEU 54 N -0.10 0.85 0.10 5.07 3.38 -0.93 -1.03 115.31 122.66 1xjz h LEU 54 Ca -0.01 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1xjz h LEU 54 Cb 0.08 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1xjz h LEU 54 CO 0.01 0.57 -0.23 0.22 0.09 0.00 0.00 178.44 179.10 1xjz h TYR 55 N 0.99 -0.60 -0.81 1.13 3.20 -0.94 0.36 116.97 120.30 1xjz h TYR 55 Ca 0.35 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.21 1xjz h TYR 55 Cb 0.09 0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.57 1xjz h TYR 55 CO -0.03 -0.32 0.41 0.45 -1.64 0.00 0.00 178.16 177.03 1xjz h HIS 56 N -0.42 1.15 0.03 -3.82 3.86 -1.07 -0.18 115.15 114.70 1xjz h HIS 56 Ca 0.03 -0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1xjz h HIS 56 Cb 0.44 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 28.55 1xjz h HIS 56 CO -0.22 0.82 -0.02 0.82 0.86 0.00 0.00 177.93 180.20 1xjz h ILE 57 N 1.14 1.09 -0.28 2.45 2.04 -0.84 -2.53 117.51 120.58 1xjz h ILE 57 Ca 0.28 -0.38 -0.07 0.00 1.00 0.00 0.00 64.86 65.68 1xjz h ILE 57 Cb 0.09 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 1xjz h ILE 57 CO -0.04 0.10 -0.14 1.88 0.00 0.00 0.00 178.15 179.95 1xjz h TYR 58 N -0.21 0.52 -0.60 1.37 0.05 -0.14 0.03 116.97 117.99 1xjz h TYR 58 Ca -0.00 -0.08 -0.02 0.00 0.05 0.00 0.00 58.73 58.68 1xjz h TYR 58 Cb 0.19 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 1xjz h TYR 58 CO -0.02 0.61 0.32 0.28 -1.05 0.00 0.00 178.16 178.30 1xjz h VAL 59 N 0.44 1.20 -0.13 -2.88 2.07 -0.95 0.56 116.25 116.57 1xjz h VAL 59 Ca 0.08 -0.54 -0.07 0.00 0.82 0.00 0.00 66.70 66.99 1xjz h VAL 59 Cb 0.52 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1xjz h VAL 59 CO 0.03 0.23 -0.20 0.00 0.02 0.00 0.00 177.57 177.65 1xjz h ALA 60 N 1.14 0.20 -0.49 1.67 0.00 -1.17 -2.28 119.26 118.33 1xjz h ALA 60 Ca 0.21 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1xjz h ALA 60 Cb 0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1xjz h ALA 60 CO -0.03 0.13 0.31 1.25 0.00 0.00 0.00 179.25 180.91 1xjz h LEU 61 N -0.05 0.51 -0.88 0.00 5.85 -0.87 -2.27 115.31 117.61 1xjz h LEU 61 Ca 0.01 -0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 1xjz h LEU 61 Cb 0.77 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1xjz h LEU 61 CO 0.05 0.37 0.07 -0.33 -0.34 0.00 0.00 178.44 178.25 1xjz h GLU 62 N 0.62 0.90 -0.33 1.25 5.08 -0.91 -1.12 114.58 120.07 1xjz h GLU 62 Ca 0.19 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1xjz h GLU 62 Cb -0.02 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 1xjz h GLU 62 CO -0.07 0.85 0.22 0.93 -1.00 0.00 0.00 179.01 179.95 1xjz h GLU 63 N 0.85 0.44 -0.09 2.33 5.08 -1.11 -0.72 114.58 121.37 1xjz h GLU 63 Ca 0.17 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.39 1xjz h GLU 63 Cb 0.40 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1xjz h GLU 63 CO 0.01 0.29 -0.47 0.93 -1.00 0.00 0.00 179.01 178.77 1xjz h GLU 64 N 0.45 0.22 -0.20 2.33 4.39 -1.17 -1.19 114.58 119.41 1xjz h GLU 64 Ca 0.12 -0.12 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 1xjz h GLU 64 Cb -0.05 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1xjz h GLU 64 CO -0.03 0.65 -0.05 0.82 -1.16 0.00 0.00 179.01 179.24 1xjz h ILE 65 N 0.18 1.29 -0.55 3.13 2.04 -0.97 -1.91 117.51 120.71 1xjz h ILE 65 Ca 0.01 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 64.82 1xjz h ILE 65 Cb 0.90 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 38.53 1xjz h ILE 65 CO 0.07 0.32 0.34 -0.08 0.00 0.00 0.00 178.15 178.80 1xjz h GLU 66 N 0.10 0.73 -0.19 2.37 4.57 -0.96 0.49 114.58 121.68 1xjz h GLU 66 Ca 0.05 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 1xjz h GLU 66 Cb 0.51 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.92 1xjz h GLU 66 CO 0.02 0.50 -0.24 -0.09 -1.18 0.00 0.00 179.01 178.02 1xjz h ARG 67 N 0.75 0.34 -0.36 1.92 2.43 -0.88 -3.19 114.38 115.38 1xjz h ARG 67 Ca 0.20 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1xjz h ARG 67 Cb -0.05 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1xjz h ARG 67 CO -0.04 0.57 0.00 0.09 -1.51 0.00 0.00 179.97 179.08 1xjz n ASN 68 N -4.15 3.06 -0.07 -3.80 4.13 -0.51 -4.73 115.26 109.18 1xjz n ASN 68 Ca -0.01 -2.07 0.25 0.00 1.68 0.00 0.00 54.58 54.43 1xjz n ASN 68 Cb 0.37 -0.27 0.72 0.00 -1.54 0.00 0.00 39.78 39.06 1xjz n ASN 68 CO 0.00 0.00 0.00 0.07 0.28 0.00 0.00 177.26 177.61 1xjz h LYS 69 N 2.14 0.00 -0.02 3.52 2.10 -0.07 -1.18 116.57 123.05 1xjz h LYS 69 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xjz h LYS 69 Cb 0.80 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.13 1xjz h LYS 69 CO 0.02 0.00 -0.17 0.39 -2.00 0.00 0.00 179.45 177.69 1xjz n GLU 70 N -4.11 1.71 -2.84 0.07 1.02 -1.26 -3.84 120.64 111.39 1xjz n GLU 70 Ca 0.14 -1.32 -0.40 0.00 -0.02 0.00 0.00 57.16 55.56 1xjz n GLU 70 Cb 0.81 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 30.70 1xjz n GLU 70 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1xjz s SER 71 N -2.20 7.52 0.10 1.62 0.15 -0.45 -4.83 113.70 115.61 1xjz s SER 71 Ca 0.27 1.80 0.10 0.00 0.70 0.00 0.00 55.95 58.82 1xjz s SER 71 Cb 0.20 -2.56 0.49 0.00 -1.71 0.00 0.00 66.02 62.43 1xjz s SER 71 CO 0.41 0.15 1.32 -0.81 1.20 0.00 0.00 173.24 175.51 1xjz n PRO 72 N 1.72 0.05 0.05 5.44 -0.04 -1.26 0.25 135.00 141.21 1xjz n PRO 72 Ca -0.03 0.47 0.14 0.00 -0.04 0.00 0.00 63.50 64.03 1xjz n PRO 72 Cb 0.48 -1.64 0.52 0.00 -0.04 0.00 0.00 33.50 32.82 1xjz n PRO 72 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1xjz n VAL 73 N -1.74 0.27 0.00 0.52 0.24 -1.26 -4.42 118.33 111.94 1xjz n VAL 73 Ca 0.01 -0.13 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 1xjz n VAL 73 Cb 0.07 -0.53 0.00 0.00 -1.47 0.00 0.00 33.84 31.91 1xjz n VAL 73 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 1xjz n PHE 74 N -1.85 0.00 -0.29 6.34 7.35 -0.28 -4.73 117.46 124.00 1xjz n PHE 74 Ca 0.06 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.89 1xjz n PHE 74 Cb 0.38 0.00 0.27 0.00 0.35 0.00 0.00 39.48 40.48 1xjz n PHE 74 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1xjz n ALA 75 N -0.78 0.46 0.08 3.13 0.00 0.14 -0.43 120.51 123.11 1xjz n ALA 75 Ca 0.00 0.89 0.15 0.00 0.00 0.00 0.00 53.44 54.48 1xjz n ALA 75 Cb 0.05 -0.67 0.65 0.00 0.00 0.00 0.00 19.45 19.49 1xjz n ALA 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1xjz h PRO 76 N 0.00 0.05 -0.49 0.00 0.11 -1.84 -1.57 132.00 128.26 1xjz h PRO 76 Ca 0.52 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.62 1xjz h PRO 76 Cb 1.11 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1xjz h PRO 76 CO -0.77 0.03 0.01 1.33 -0.21 0.00 0.00 178.00 178.39 1xjz n VAL 77 N -4.44 2.64 -2.84 3.15 0.24 0.43 -4.82 118.33 112.69 1xjz n VAL 77 Ca 0.06 -1.56 -0.43 0.00 -2.04 0.00 0.00 64.34 60.36 1xjz n VAL 77 Cb 0.41 -0.28 -0.04 0.00 -1.47 0.00 0.00 33.84 32.46 1xjz n VAL 77 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1xjz s TYR 78 N -2.80 2.87 -0.53 6.34 5.04 -0.59 -4.93 117.35 122.74 1xjz s TYR 78 Ca 0.51 0.21 0.07 0.00 -2.44 0.00 0.00 57.07 55.41 1xjz s TYR 78 Cb 0.40 -3.99 0.24 0.00 0.35 0.00 0.00 41.96 38.95 1xjz s TYR 78 CO 0.14 -1.20 0.62 1.19 -1.34 0.00 0.00 175.55 174.96 1xjz n PHE 79 N 7.27 1.78 -0.18 4.97 3.72 -1.26 -4.99 117.46 128.77 1xjz n PHE 79 Ca 0.04 -3.88 -0.01 0.00 -0.05 0.00 0.00 57.45 53.55 1xjz n PHE 79 Cb 0.48 -0.44 0.09 0.00 -0.94 0.00 0.00 39.48 38.67 1xjz n PHE 79 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1xjz h PRO 80 N 4.26 0.23 -0.12 -1.08 0.13 -1.96 -0.83 132.00 132.63 1xjz h PRO 80 Ca 0.15 -0.01 -0.18 0.00 -0.87 0.00 0.00 66.00 65.08 1xjz h PRO 80 Cb 0.77 -0.05 0.01 0.00 0.13 0.00 0.00 31.00 31.85 1xjz h PRO 80 CO 0.65 0.15 -0.63 0.93 -0.23 0.00 0.00 178.00 178.88 1xjz h GLU 81 N 0.24 0.64 -0.06 0.86 4.39 -1.97 -2.25 114.58 116.43 1xjz h GLU 81 Ca 0.28 -0.53 -0.17 0.00 0.34 0.00 0.00 59.36 59.29 1xjz h GLU 81 Cb 0.40 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 1xjz h GLU 81 CO -0.37 1.14 -0.71 0.93 -1.16 0.00 0.00 179.01 178.84 1xjz h GLU 82 N 0.29 0.30 -0.01 2.33 3.07 -1.81 -3.38 114.58 115.37 1xjz h GLU 82 Ca -0.04 -0.24 0.00 0.00 -0.50 0.00 0.00 59.36 58.57 1xjz h GLU 82 Cb 1.27 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.23 1xjz h GLU 82 CO 0.13 0.89 -0.15 1.28 -1.40 0.00 0.00 179.01 179.76 1xjz n LEU 83 N -3.81 1.22 -4.76 1.33 4.77 -0.33 -4.62 117.00 110.80 1xjz n LEU 83 Ca -0.03 -0.80 -0.41 0.00 -0.03 0.00 0.00 56.01 54.73 1xjz n LEU 83 Cb 0.69 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.79 1xjz n LEU 83 CO 0.47 0.25 1.08 0.00 -1.33 0.00 0.00 177.39 177.85 1xjz n HIS 84 N -0.15 2.78 0.00 -1.77 1.44 -0.85 -4.89 115.22 111.78 1xjz n HIS 84 Ca 0.04 0.45 0.00 0.00 -2.01 0.00 0.00 57.72 56.20 1xjz n HIS 84 Cb 0.19 -2.49 0.00 0.00 0.12 0.00 0.00 29.99 27.81 1xjz n HIS 84 CO 0.00 0.00 0.00 -2.13 -2.81 0.00 0.00 176.34 171.40 1xjz n ARG 85 N 0.17 2.95 -0.06 -1.40 3.00 -1.26 -4.85 116.66 115.20 1xjz n ARG 85 Ca 0.03 0.00 -0.07 0.00 -0.00 0.00 0.00 57.85 57.81 1xjz n ARG 85 Cb 0.40 -0.24 -0.01 0.00 0.00 0.00 0.00 32.46 32.60 1xjz n ARG 85 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 1xjz h LYS 86 N 0.00 -0.04 -0.53 -0.14 3.64 -1.90 -1.32 116.57 116.29 1xjz h LYS 86 Ca 0.00 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1xjz h LYS 86 Cb 0.00 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.78 1xjz h LYS 86 CO 0.00 -0.02 0.25 0.00 -2.27 0.00 0.00 179.45 177.40 1xjz h ALA 87 N 1.21 0.67 -0.86 5.00 0.00 -2.00 0.14 119.26 123.42 1xjz h ALA 87 Ca 0.13 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1xjz h ALA 87 Cb 0.24 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1xjz h ALA 87 CO -0.29 -0.12 0.44 0.00 0.00 0.00 0.00 179.25 179.28 1xjz h ALA 88 N 1.31 1.15 -0.14 0.00 0.00 -1.78 -1.55 119.26 118.24 1xjz h ALA 88 Ca 0.24 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1xjz h ALA 88 Cb 0.19 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1xjz h ALA 88 CO -0.19 0.66 -0.44 -0.07 0.00 0.00 0.00 179.25 179.21 1xjz h LEU 89 N 1.22 0.36 -0.45 0.00 3.38 -0.50 -0.98 115.31 118.34 1xjz h LEU 89 Ca 0.30 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1xjz h LEU 89 Cb 0.08 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1xjz h LEU 89 CO -0.04 0.76 0.06 -0.33 0.09 0.00 0.00 178.44 178.97 1xjz h GLU 90 N 0.28 0.76 -0.38 1.13 5.08 -0.49 0.88 114.58 121.85 1xjz h GLU 90 Ca 0.02 -0.21 0.02 0.00 -1.00 0.00 0.00 59.36 58.19 1xjz h GLU 90 Cb 0.89 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.03 1xjz h GLU 90 CO 0.07 0.79 0.21 1.96 -1.00 0.00 0.00 179.01 181.05 1xjz h GLN 91 N 0.62 0.42 -0.48 2.33 1.08 -1.06 -1.68 115.11 116.35 1xjz h GLN 91 Ca 0.14 -0.03 -0.09 0.00 -1.45 0.00 0.00 58.65 57.22 1xjz h GLN 91 Cb 0.41 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.73 1xjz h GLN 91 CO 0.01 0.28 -0.06 -0.44 -0.95 0.00 0.00 178.83 177.68 1xjz h ASP 92 N 0.44 0.88 0.41 1.46 3.45 -0.82 -3.01 116.42 119.24 1xjz h ASP 92 Ca 0.15 -0.34 -0.10 0.00 0.43 0.00 0.00 57.03 57.18 1xjz h ASP 92 Cb 0.02 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 38.54 1xjz h ASP 92 CO -0.08 1.01 -0.44 -0.07 -1.57 0.00 0.00 179.24 178.09 1xjz h LEU 93 N 0.74 0.04 -1.58 1.55 -0.00 -0.71 -0.45 115.31 114.89 1xjz h LEU 93 Ca 0.13 -0.02 -0.05 0.00 -0.00 0.00 0.00 57.88 57.95 1xjz h LEU 93 Cb 0.59 -0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 41.23 1xjz h LEU 93 CO 0.04 0.48 -0.22 0.00 -0.00 0.00 0.00 178.44 178.73 1xjz h ALA 94 N 1.53 1.54 0.00 1.53 0.00 -1.19 0.27 119.26 122.94 1xjz h ALA 94 Ca -0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1xjz h ALA 94 Cb 0.79 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1xjz h ALA 94 CO 0.06 0.28 -0.05 0.35 0.00 0.00 0.00 179.25 179.89 1xjz h PHE 95 N 0.00 0.00 -0.00 0.00 3.57 -1.21 -2.01 116.94 117.28 1xjz h PHE 95 Ca -0.00 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.40 1xjz h PHE 95 Cb 0.41 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 1xjz h PHE 95 CO 0.00 0.97 -0.45 -1.49 -2.23 0.00 0.00 178.31 175.11 1xjz h TRP 96 N -1.00 0.01 -0.00 0.41 4.06 -0.93 -3.31 115.95 115.18 1xjz h TRP 96 Ca -0.01 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.93 1xjz h TRP 96 Cb 0.96 -0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.12 1xjz h TRP 96 CO 0.26 0.46 -0.00 0.66 -3.56 0.00 0.00 178.44 176.25 1xjz n TYR 97 N -4.00 0.00 0.00 0.49 4.01 0.92 -5.07 117.16 113.51 1xjz n TYR 97 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 1xjz n TYR 97 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.50 1xjz n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1xjz n GLY 98 N 0.31 -0.23 0.39 2.72 0.00 -0.75 -4.11 105.19 103.51 1xjz n GLY 98 Ca 0.00 -1.83 0.21 0.00 0.00 0.00 0.00 46.02 44.40 1xjz n GLY 98 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xjz h PRO 99 N 0.00 0.00 -0.84 1.61 0.11 -1.91 -0.74 132.00 130.23 1xjz h PRO 99 Ca 0.00 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.72 1xjz h PRO 99 Cb 0.00 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 30.88 1xjz h PRO 99 CO 0.00 0.00 0.46 0.54 -0.21 0.00 0.00 178.00 178.79 1xjz n ARG 100 N -4.06 2.62 -0.32 1.05 1.74 -1.26 -4.70 116.66 111.72 1xjz n ARG 100 Ca 0.09 -3.05 0.16 0.00 -0.77 0.00 0.00 57.85 54.27 1xjz n ARG 100 Cb 0.62 -2.14 0.34 0.00 -1.02 0.00 0.00 32.46 30.26 1xjz n ARG 100 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 1xjz h TRP 101 N 1.47 0.73 -0.04 -1.55 5.08 -1.28 -0.22 115.95 120.15 1xjz h TRP 101 Ca 0.48 0.04 0.01 0.00 1.08 0.00 0.00 58.89 60.50 1xjz h TRP 101 Cb 2.57 -0.17 -0.00 0.00 -3.00 0.00 0.00 29.16 28.55 1xjz h TRP 101 CO 1.43 -0.06 0.04 1.96 -1.28 0.00 0.00 178.44 180.53 1xjz h GLN 102 N 0.40 0.00 0.00 0.12 4.20 -1.86 -0.17 115.11 117.80 1xjz h GLN 102 Ca 0.60 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.31 1xjz h GLN 102 Cb 1.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.96 1xjz h GLN 102 CO -0.54 0.00 -0.75 0.93 -0.67 0.00 0.00 178.83 177.80 1xjz h GLU 103 N 0.00 0.00 0.00 1.46 5.08 -1.42 -3.39 114.58 116.31 1xjz h GLU 103 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1xjz h GLU 103 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1xjz h GLU 103 CO -0.00 0.00 -0.89 1.55 -1.00 0.00 0.00 179.01 178.67 1xjz n VAL 104 N -2.32 0.00 -1.80 3.13 3.14 -0.80 -5.03 118.33 114.65 1xjz n VAL 104 Ca 0.02 -0.18 -0.41 0.00 -2.96 0.00 0.00 64.34 60.81 1xjz n VAL 104 Cb 0.48 0.58 -0.00 0.00 -1.06 0.00 0.00 33.84 33.84 1xjz n VAL 104 CO 0.00 0.00 0.00 0.27 -6.46 0.00 0.00 176.83 170.64 1xjz s ILE 105 N -2.01 2.05 0.66 1.55 -4.36 -0.14 -4.97 121.20 113.98 1xjz s ILE 105 Ca -0.01 0.05 -0.13 0.00 -0.26 0.00 0.00 60.65 60.31 1xjz s ILE 105 Cb 0.03 -3.03 -0.00 0.00 1.25 0.00 0.00 42.46 40.70 1xjz s ILE 105 CO 0.17 0.01 1.06 -2.16 0.24 0.00 0.00 174.94 174.26 1xjz s PRO 106 N -1.81 3.01 -0.40 0.37 0.04 -1.26 -5.04 135.00 129.92 1xjz s PRO 106 Ca 0.55 1.08 0.03 0.00 0.04 0.00 0.00 61.00 62.70 1xjz s PRO 106 Cb -0.47 -2.00 0.16 0.00 0.04 0.00 0.00 34.50 32.24 1xjz s PRO 106 CO 0.60 -1.04 0.36 -0.47 0.04 0.00 0.00 177.00 176.49 1xjz s TYR 107 N -2.78 0.51 0.77 0.56 5.04 -1.26 -4.84 117.35 115.35 1xjz s TYR 107 Ca 0.61 -1.76 -0.12 0.00 -2.44 0.00 0.00 57.07 53.36 1xjz s TYR 107 Cb -0.15 -0.71 0.05 0.00 0.35 0.00 0.00 41.96 41.51 1xjz s TYR 107 CO 0.48 -0.90 1.11 0.95 -1.34 0.00 0.00 175.55 175.85 1xjz s THR 108 N 0.58 3.01 0.19 4.34 -4.23 -1.26 -4.83 115.64 113.45 1xjz s THR 108 Ca 0.27 0.33 -0.12 0.00 -1.18 0.00 0.00 61.69 60.99 1xjz s THR 108 Cb -0.05 -3.21 0.12 0.00 1.34 0.00 0.00 72.50 70.69 1xjz s THR 108 CO -0.11 -0.43 1.73 -0.65 -0.54 0.00 0.00 174.62 174.62 1xjz h PRO 109 N -0.94 0.30 -0.15 3.99 0.11 -2.01 0.96 132.00 134.27 1xjz h PRO 109 Ca -0.46 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 1xjz h PRO 109 Cb 1.28 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1xjz h PRO 109 CO 0.62 0.20 -0.04 0.00 -0.21 0.00 0.00 178.00 178.57 1xjz h ALA 110 N 1.39 1.66 -0.20 -0.75 0.00 -1.94 0.73 119.26 120.16 1xjz h ALA 110 Ca 0.27 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 1xjz h ALA 110 Cb 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1xjz h ALA 110 CO -0.31 0.26 -0.58 0.52 0.00 0.00 0.00 179.25 179.14 1xjz h MET 111 N 0.21 0.74 -0.59 0.00 2.86 -1.57 -2.95 114.93 113.63 1xjz h MET 111 Ca 0.05 -0.53 -0.00 0.00 -2.06 0.00 0.00 59.70 57.16 1xjz h MET 111 Cb 0.22 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.94 1xjz h MET 111 CO 0.01 1.15 0.37 1.96 1.06 0.00 0.00 176.91 181.46 1xjz h GLN 112 N 0.46 0.80 -0.88 1.72 4.20 0.06 -1.83 115.11 119.64 1xjz h GLN 112 Ca -0.02 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 1xjz h GLN 112 Cb 1.20 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 28.77 1xjz h GLN 112 CO 0.12 0.56 0.47 0.00 -0.67 0.00 0.00 178.83 179.32 1xjz h ARG 113 N 0.80 1.24 -0.08 1.46 3.08 -0.89 0.23 114.38 120.22 1xjz h ARG 113 Ca 0.21 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1xjz h ARG 113 Cb -0.04 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 29.76 1xjz h ARG 113 CO -0.04 0.91 0.01 -0.92 -1.07 0.00 0.00 179.97 178.86 1xjz h TYR 114 N 1.24 0.15 -0.74 3.04 5.03 -1.33 -2.07 116.97 122.29 1xjz h TYR 114 Ca 0.31 -0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.64 1xjz h TYR 114 Cb 0.04 -0.04 -0.05 0.00 1.55 0.00 0.00 36.73 38.23 1xjz h TYR 114 CO 0.01 0.38 0.46 0.28 -1.32 0.00 0.00 178.16 177.97 1xjz h VAL 115 N -0.11 1.07 -0.14 1.81 2.07 -1.00 -1.55 116.25 118.39 1xjz h VAL 115 Ca 0.02 -0.30 0.03 0.00 0.82 0.00 0.00 66.70 67.27 1xjz h VAL 115 Cb 0.31 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 1xjz h VAL 115 CO 0.00 0.16 -0.03 0.50 0.02 0.00 0.00 177.57 178.22 1xjz h LYS 116 N 0.88 0.00 -0.65 1.57 3.64 -0.34 -1.48 116.57 120.19 1xjz h LYS 116 Ca 0.31 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.61 1xjz h LYS 116 Cb 0.08 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 1xjz h LYS 116 CO -0.13 0.00 0.07 -0.09 -2.27 0.00 0.00 179.45 177.03 1xjz h ARG 117 N 0.00 1.09 -0.37 1.90 9.65 -1.08 -1.04 114.38 124.53 1xjz h ARG 117 Ca 0.07 -0.31 0.07 0.00 -1.10 0.00 0.00 59.98 58.71 1xjz h ARG 117 Cb 0.10 -0.12 -0.06 0.00 -1.39 0.00 0.00 29.97 28.50 1xjz h ARG 117 CO -0.14 1.02 0.00 -0.07 2.80 0.00 0.00 179.97 183.58 1xjz h LEU 118 N 1.01 -0.14 -0.47 3.80 4.07 -0.94 0.15 115.31 122.79 1xjz h LEU 118 Ca 0.19 0.08 -0.12 0.00 0.08 0.00 0.00 57.88 58.11 1xjz h LEU 118 Cb 0.48 0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.35 1xjz h LEU 118 CO 0.02 -0.04 -0.19 0.45 -1.08 0.00 0.00 178.44 177.61 1xjz h HIS 119 N 0.10 1.10 -0.86 1.13 3.86 -1.00 -0.91 115.15 118.57 1xjz h HIS 119 Ca 0.18 -0.26 0.02 0.00 -1.16 0.00 0.00 60.37 59.15 1xjz h HIS 119 Cb 0.25 -0.26 -0.05 0.00 1.06 0.00 0.00 27.41 28.41 1xjz h HIS 119 CO -0.25 1.07 0.57 0.93 0.86 0.00 0.00 177.93 181.10 1xjz h GLU 120 N 0.81 1.11 -0.10 2.45 5.08 -0.57 0.30 114.58 123.65 1xjz h GLU 120 Ca 0.11 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1xjz h GLU 120 Cb 0.76 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1xjz h GLU 120 CO 0.06 0.73 0.01 0.28 -1.00 0.00 0.00 179.01 179.09 1xjz h VAL 121 N 1.14 1.24 -0.06 3.13 2.07 -0.51 0.10 116.25 123.36 1xjz h VAL 121 Ca 0.32 -0.74 -0.05 0.00 0.82 0.00 0.00 66.70 67.05 1xjz h VAL 121 Cb -0.09 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1xjz h VAL 121 CO -0.08 0.21 -0.21 1.23 0.02 0.00 0.00 177.57 178.74 1xjz h GLY 122 N -0.08 0.11 0.63 2.17 0.00 -0.85 0.91 103.07 105.96 1xjz h GLY 122 Ca 0.03 -0.07 -0.34 0.00 0.00 0.00 0.00 47.33 46.95 1xjz h GLY 122 CO 0.00 0.07 -1.98 0.54 0.00 0.00 0.00 176.54 175.17 1xjz n ARG 123 N -4.25 0.70 -0.00 4.80 1.74 0.07 -4.47 116.66 115.24 1xjz n ARG 123 Ca -0.02 0.24 0.00 0.00 -0.77 0.00 0.00 57.85 57.30 1xjz n ARG 123 Cb 0.30 -1.70 -0.00 0.00 -1.02 0.00 0.00 32.46 30.03 1xjz n ARG 123 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1xjz n THR 124 N -3.23 0.00 -2.71 0.55 -2.24 0.34 -4.81 114.28 102.18 1xjz n THR 124 Ca -0.28 -0.24 -0.11 0.00 -2.27 0.00 0.00 64.05 61.15 1xjz n THR 124 Cb 1.05 0.74 0.02 0.00 -2.10 0.00 0.00 70.33 70.05 1xjz n THR 124 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xjz n GLU 125 N -1.26 1.25 -0.17 -0.78 1.02 -0.27 -4.96 120.64 115.46 1xjz n GLU 125 Ca -0.00 -3.34 0.29 0.00 -0.02 0.00 0.00 57.16 54.09 1xjz n GLU 125 Cb 0.00 -1.35 0.72 0.00 -0.02 0.00 0.00 31.44 30.80 1xjz n GLU 125 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1xjz h PRO 126 N 2.98 0.00 -0.01 3.49 0.13 -1.12 0.29 132.00 137.77 1xjz h PRO 126 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1xjz h PRO 126 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 1xjz h PRO 126 CO 0.52 0.00 0.04 0.93 -0.23 0.00 0.00 178.00 179.26 1xjz h GLU 127 N 0.00 0.00 -0.02 0.86 3.07 -1.88 -1.36 114.58 115.24 1xjz h GLU 127 Ca 0.43 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.29 1xjz h GLU 127 Cb 1.89 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.80 1xjz h GLU 127 CO -0.00 0.00 -0.29 1.28 -1.40 0.00 0.00 179.01 178.60 1xjz n LEU 128 N -3.23 2.32 -0.08 1.33 4.77 0.09 -4.39 117.00 117.82 1xjz n LEU 128 Ca -0.03 -0.82 0.10 0.00 -0.03 0.00 0.00 56.01 55.24 1xjz n LEU 128 Cb 0.11 -0.01 0.48 0.00 -2.33 0.00 0.00 43.42 41.68 1xjz n LEU 128 CO 0.21 0.41 1.19 0.25 -1.33 0.00 0.00 177.39 178.12 1xjz h LEU 129 N 3.19 0.40 -1.66 2.23 5.85 -1.35 -0.89 115.31 123.09 1xjz h LEU 129 Ca 0.00 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.77 1xjz h LEU 129 Cb 0.83 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 1xjz h LEU 129 CO 0.00 0.25 0.30 1.62 -0.34 0.00 0.00 178.44 180.27 1xjz h VAL 130 N 0.45 1.00 -0.47 1.05 3.04 -1.77 -1.12 116.25 118.44 1xjz h VAL 130 Ca 0.26 -0.15 -0.05 0.00 -1.01 0.00 0.00 66.70 65.75 1xjz h VAL 130 Cb 0.44 0.53 -0.02 0.00 -2.01 0.00 0.00 31.29 30.22 1xjz h VAL 130 CO -0.07 0.08 0.06 0.00 -1.01 0.00 0.00 177.57 176.63 1xjz h ALA 131 N 1.75 1.24 0.05 3.17 0.00 -1.45 0.09 119.26 124.11 1xjz h ALA 131 Ca 0.19 -0.21 -0.23 0.00 0.00 0.00 0.00 54.91 54.66 1xjz h ALA 131 Cb 0.21 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1xjz h ALA 131 CO -0.05 0.51 -1.03 0.45 0.00 0.00 0.00 179.25 179.14 1xjz h HIS 132 N 0.69 0.39 -0.25 0.00 -0.00 -1.29 -2.47 115.15 112.23 1xjz h HIS 132 Ca 0.15 -0.25 -0.07 0.00 -0.00 0.00 0.00 60.37 60.20 1xjz h HIS 132 Cb 0.33 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.71 1xjz h HIS 132 CO 0.02 1.12 -0.11 0.00 -0.00 0.00 0.00 177.93 178.95 1xjz h ALA 133 N 0.80 0.35 -0.10 2.45 0.00 -1.06 -1.76 119.26 119.93 1xjz h ALA 133 Ca -0.08 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.55 1xjz h ALA 133 Cb 1.71 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.39 1xjz h ALA 133 CO 0.16 0.21 -0.02 -0.92 0.00 0.00 0.00 179.25 178.68 1xjz h TYR 134 N 0.25 -0.03 -0.14 0.00 3.20 -1.03 0.04 116.97 119.25 1xjz h TYR 134 Ca 0.06 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 1xjz h TYR 134 Cb 0.61 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 1xjz h TYR 134 CO 0.06 -0.03 0.08 1.15 -1.64 0.00 0.00 178.16 177.78 1xjz h THR 135 N 0.01 1.08 0.44 1.81 2.02 -1.41 -1.69 112.91 115.17 1xjz h THR 135 Ca 0.05 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1xjz h THR 135 Cb 0.07 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1xjz h THR 135 CO -0.09 0.08 -0.21 0.03 0.37 0.00 0.00 175.52 175.69 1xjz h ARG 136 N 0.14 -0.57 -0.14 6.66 2.47 -1.23 -2.61 114.38 119.09 1xjz h ARG 136 Ca 0.05 0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.80 1xjz h ARG 136 Cb 0.06 0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 1xjz h ARG 136 CO -0.01 -0.28 0.06 1.88 0.56 0.00 0.00 179.97 182.19 1xjz h TYR 137 N -1.03 0.21 -0.03 3.04 0.05 -1.07 -0.57 116.97 117.57 1xjz h TYR 137 Ca -0.06 -0.01 -0.07 0.00 0.05 0.00 0.00 58.73 58.64 1xjz h TYR 137 Cb 0.56 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.22 1xjz h TYR 137 CO 0.02 0.28 -0.29 -0.07 -1.05 0.00 0.00 178.16 177.04 1xjz h LEU 138 N 0.09 0.05 0.24 3.88 3.38 -1.46 0.27 115.31 121.77 1xjz h LEU 138 Ca 0.05 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1xjz h LEU 138 Cb 0.15 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1xjz h LEU 138 CO -0.00 0.35 -0.12 0.00 0.09 0.00 0.00 178.44 178.76 1xjz h ALA 139 N 1.66 -0.32 0.00 1.53 0.00 -1.21 -0.57 119.26 120.34 1xjz h ALA 139 Ca 0.01 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1xjz h ALA 139 Cb 0.54 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1xjz h ALA 139 CO 0.04 -0.53 -0.22 -0.44 0.00 0.00 0.00 179.25 178.09 1xjz h ASP 140 N -0.62 0.00 0.45 0.00 3.32 -0.83 -0.72 116.42 118.02 1xjz h ASP 140 Ca -0.03 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.71 1xjz h ASP 140 Cb 0.44 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.01 1xjz h ASP 140 CO 0.05 0.22 -1.41 -0.07 -1.72 0.00 0.00 179.24 176.31 1xjz h LEU 141 N 0.00 0.57 0.18 1.55 3.38 -0.43 -1.76 115.31 118.80 1xjz h LEU 141 Ca -0.00 -0.66 -0.30 0.00 0.09 0.00 0.00 57.88 57.01 1xjz h LEU 141 Cb 0.60 -0.19 0.02 0.00 0.09 0.00 0.00 40.66 41.18 1xjz h LEU 141 CO 0.03 1.52 -1.38 0.28 0.09 0.00 0.00 178.44 178.98 1xjz h SER 142 N 0.10 0.58 0.00 -0.43 0.02 -0.94 -3.37 113.55 109.51 1xjz h SER 142 Ca -0.21 -0.65 0.00 0.00 -0.84 0.00 0.00 61.79 60.09 1xjz h SER 142 Cb 2.06 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 64.41 1xjz h SER 142 CO 0.22 1.51 -0.95 0.61 -1.14 0.00 0.00 176.83 177.09 1xjz n GLY 143 N 1.63 -0.68 0.00 -3.77 0.00 -0.29 -4.76 105.19 97.31 1xjz n GLY 143 Ca -0.13 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1xjz n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xjz n GLY 144 N 1.42 -3.39 0.44 -0.02 0.00 -0.66 -2.08 105.19 100.90 1xjz n GLY 144 Ca 0.03 0.60 0.38 0.00 0.00 0.00 0.00 46.02 47.03 1xjz n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xjz n GLN 145 N -1.48 -0.04 0.19 1.61 0.00 -1.26 -0.87 117.38 115.52 1xjz n GLN 145 Ca 0.00 1.27 -0.13 0.00 0.00 0.00 0.00 57.00 58.14 1xjz n GLN 145 Cb 0.00 -2.46 -0.08 0.00 0.00 0.00 0.00 30.24 27.70 1xjz n GLN 145 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1xjz h VAL 146 N 0.00 0.57 -0.19 -0.39 2.07 -1.73 -2.78 116.25 113.80 1xjz h VAL 146 Ca 0.87 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 67.84 1xjz h VAL 146 Cb 2.71 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 33.29 1xjz h VAL 146 CO -0.52 0.09 0.11 -0.07 0.02 0.00 0.00 177.57 177.20 1xjz h LEU 147 N -0.84 0.22 -0.79 2.57 4.07 -0.45 -1.62 115.31 118.48 1xjz h LEU 147 Ca -0.05 -0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.87 1xjz h LEU 147 Cb 0.53 -0.06 -0.04 0.00 1.08 0.00 0.00 40.66 42.18 1xjz h LEU 147 CO 0.08 0.18 0.38 0.50 -1.08 0.00 0.00 178.44 178.50 1xjz h LYS 148 N 0.26 1.14 0.47 1.13 3.64 -1.22 0.47 116.57 122.45 1xjz h LYS 148 Ca 0.07 -0.17 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 1xjz h LYS 148 Cb 0.00 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.62 1xjz h LYS 148 CO -0.01 0.88 -0.22 -0.22 -2.27 0.00 0.00 179.45 177.61 1xjz h LYS 149 N 1.12 -0.60 -0.70 1.90 1.63 -1.03 -1.95 116.57 116.93 1xjz h LYS 149 Ca 0.27 0.04 0.15 0.00 -0.85 0.00 0.00 60.65 60.26 1xjz h LYS 149 Cb 0.12 0.14 -0.11 0.00 -0.60 0.00 0.00 32.23 31.78 1xjz h LYS 149 CO -0.03 -0.30 0.13 0.82 -3.45 0.00 0.00 179.45 176.61 1xjz h ILE 150 N -0.88 0.51 0.28 2.00 5.03 -1.28 -1.77 117.51 121.40 1xjz h ILE 150 Ca -0.06 -0.08 -0.00 0.00 -0.12 0.00 0.00 64.86 64.59 1xjz h ILE 150 Cb 0.58 0.27 -0.02 0.00 -3.03 0.00 0.00 36.82 34.61 1xjz h ILE 150 CO 0.10 0.04 -0.39 0.00 -0.68 0.00 0.00 178.15 177.23 1xjz h ALA 151 N 1.59 -1.00 0.00 1.87 0.00 -0.77 0.77 119.26 121.72 1xjz h ALA 151 Ca 0.38 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1xjz h ALA 151 Cb 0.64 0.68 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1xjz h ALA 151 CO -0.51 -1.05 0.00 0.00 0.00 0.00 0.00 179.25 177.69 1xjz n GLN 152 N -4.73 0.04 -0.05 0.00 10.64 -0.75 0.48 117.38 123.02 1xjz n GLN 152 Ca -0.08 0.49 -0.15 0.00 -1.83 0.00 0.00 57.00 55.42 1xjz n GLN 152 Cb 0.34 -1.62 -0.14 0.00 -0.86 0.00 0.00 30.24 27.96 1xjz n GLN 152 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1xjz n LYS 153 N -1.70 0.69 0.01 2.61 4.76 -0.70 -3.90 118.16 119.92 1xjz n LYS 153 Ca 0.00 0.21 0.11 0.00 -2.87 0.00 0.00 58.31 55.76 1xjz n LYS 153 Cb 0.04 -1.67 -0.09 0.00 -1.84 0.00 0.00 35.03 31.48 1xjz n LYS 153 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1xjz n ALA 154 N -2.88 3.64 0.05 7.82 0.00 0.18 -4.38 120.51 124.95 1xjz n ALA 154 Ca -0.31 -0.50 0.09 0.00 0.00 0.00 0.00 53.44 52.72 1xjz n ALA 154 Cb 1.06 -0.84 -0.08 0.00 0.00 0.00 0.00 19.45 19.59 1xjz n ALA 154 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xjz n LEU 155 N -1.92 0.52 -4.19 0.00 4.77 0.18 -4.95 117.00 111.41 1xjz n LEU 155 Ca 0.01 0.21 -0.32 0.00 -0.03 0.00 0.00 56.01 55.87 1xjz n LEU 155 Cb 0.45 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.49 1xjz n LEU 155 CO 0.43 -0.05 -0.23 -0.67 -1.33 0.00 0.00 177.39 175.54 1xjz n ASP 156 N -2.56 -1.00 -4.75 -1.43 2.03 -1.25 -4.92 116.55 102.66 1xjz n ASP 156 Ca -0.04 -1.11 -0.30 0.00 0.52 0.00 0.00 54.79 53.86 1xjz n ASP 156 Cb 0.62 -2.43 0.11 0.00 -0.72 0.00 0.00 41.12 38.69 1xjz n ASP 156 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 1xjz s LEU 157 N -7.19 2.74 1.02 -2.67 0.05 -1.26 -5.04 118.68 106.33 1xjz s LEU 157 Ca 0.30 1.67 -0.16 0.00 0.05 0.00 0.00 54.13 55.99 1xjz s LEU 157 Cb -0.17 -4.27 0.21 0.00 -2.05 0.00 0.00 46.19 39.90 1xjz s LEU 157 CO 0.94 -2.21 1.20 -2.16 -0.55 0.00 0.00 176.35 173.57 1xjz s PRO 158 N -4.94 0.21 0.00 1.48 0.04 -1.26 -4.89 135.00 125.65 1xjz s PRO 158 Ca 0.62 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.58 1xjz s PRO 158 Cb -0.17 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1xjz s PRO 158 CO 0.56 -2.75 0.89 0.43 0.04 0.00 0.00 177.00 176.17 1xjz n SER 159 N -4.08 2.60 0.28 6.66 7.64 -1.26 -4.14 113.62 121.32 1xjz n SER 159 Ca 0.12 -1.93 0.19 0.00 1.01 0.00 0.00 58.87 58.26 1xjz n SER 159 Cb 0.59 -0.48 0.98 0.00 -1.01 0.00 0.00 64.21 64.29 1xjz n SER 159 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1xjz h SER 160 N 0.06 0.00 -1.90 6.43 0.87 -2.03 -3.45 113.55 113.53 1xjz h SER 160 Ca 0.00 0.00 -0.27 0.00 -1.23 0.00 0.00 61.79 60.29 1xjz h SER 160 Cb 0.89 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.84 1xjz h SER 160 CO 0.00 0.00 -0.34 0.61 -0.53 0.00 0.00 176.83 176.57 1xjz n GLY 161 N -0.90 -0.15 3.26 5.77 0.00 -1.26 -5.01 105.19 106.90 1xjz n GLY 161 Ca -0.02 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.59 1xjz n GLY 161 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xjz s GLU 162 N -4.64 0.98 0.00 1.61 2.02 -1.26 -4.95 118.70 112.46 1xjz s GLU 162 Ca 0.00 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 53.91 1xjz s GLU 162 Cb 0.00 0.35 0.00 0.00 0.10 0.00 0.00 34.13 34.58 1xjz s GLU 162 CO 0.00 -0.33 0.00 0.41 0.02 0.00 0.00 175.26 175.36 1xjz n GLY 163 N -0.13 2.50 0.12 -1.39 0.00 -1.26 -4.93 105.19 100.10 1xjz n GLY 163 Ca -0.11 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.97 1xjz n GLY 163 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xjz n LEU 164 N 0.00 1.77 -0.15 0.99 4.77 -1.26 -4.78 117.00 118.33 1xjz n LEU 164 Ca 0.00 -2.36 0.13 0.00 -0.03 0.00 0.00 56.01 53.75 1xjz n LEU 164 Cb 0.00 -0.25 0.47 0.00 -2.33 0.00 0.00 43.42 41.31 1xjz n LEU 164 CO 0.00 0.55 1.20 0.00 -1.33 0.00 0.00 177.39 177.82 1xjz h ALA 165 N 0.00 2.01 -0.67 -1.18 0.00 -1.92 -2.00 119.26 115.50 1xjz h ALA 165 Ca 0.00 -0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.05 1xjz h ALA 165 Cb 0.96 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 1xjz h ALA 165 CO 0.00 -0.18 0.46 0.35 0.00 0.00 0.00 179.25 179.87 1xjz h PHE 166 N 0.48 0.33 0.00 0.00 3.57 -1.87 -1.65 116.94 117.81 1xjz h PHE 166 Ca 0.35 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.85 1xjz h PHE 166 Cb 0.68 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.31 1xjz h PHE 166 CO -0.00 0.13 0.00 1.19 -2.23 0.00 0.00 178.31 177.40 1xjz n PHE 167 N -4.45 0.00 -4.11 0.41 3.72 -0.75 -4.67 117.46 107.62 1xjz n PHE 167 Ca 0.12 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.21 1xjz n PHE 167 Cb 0.53 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.91 1xjz n PHE 167 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1xjz s THR 168 N -2.00 1.79 -0.72 4.37 2.01 -0.62 -4.36 115.64 116.11 1xjz s THR 168 Ca 0.44 -0.77 -0.16 0.00 0.31 0.00 0.00 61.69 61.50 1xjz s THR 168 Cb 0.20 -1.64 0.16 0.00 0.01 0.00 0.00 72.50 71.23 1xjz s THR 168 CO 0.34 0.50 0.74 -0.36 -0.69 0.00 0.00 174.62 175.14 1xjz s PHE 169 N 1.36 3.39 0.61 4.92 0.40 -1.26 -4.92 117.98 122.47 1xjz s PHE 169 Ca 0.04 -1.53 0.32 0.00 -0.60 0.00 0.00 56.93 55.17 1xjz s PHE 169 Cb -0.13 -3.92 1.93 0.00 0.51 0.00 0.00 43.02 41.40 1xjz s PHE 169 CO -0.11 -1.13 2.26 -1.00 0.70 0.00 0.00 175.22 175.94 1xjz h PRO 170 N 8.48 0.00 -0.47 0.24 0.13 -1.93 -2.56 132.00 135.90 1xjz h PRO 170 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 1xjz h PRO 170 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1xjz h PRO 170 CO 0.94 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.80 1xjz n ASN 171 N -3.69 2.49 -4.07 1.44 5.03 -1.26 -4.68 115.26 110.52 1xjz n ASN 171 Ca -0.03 -2.00 -0.32 0.00 0.87 0.00 0.00 54.58 53.10 1xjz n ASN 171 Cb 0.10 -0.31 -0.15 0.00 -1.02 0.00 0.00 39.78 38.41 1xjz n ASN 171 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1xjz s ILE 172 N -1.38 2.40 0.32 2.41 1.01 -0.97 -4.69 121.20 120.30 1xjz s ILE 172 Ca 0.31 -1.87 0.04 0.00 0.00 0.00 0.00 60.65 59.13 1xjz s ILE 172 Cb 0.16 -2.55 0.12 0.00 0.01 0.00 0.00 42.46 40.21 1xjz s ILE 172 CO 0.21 -0.28 1.81 0.00 0.00 0.00 0.00 174.94 176.69 1xjz h ALA 173 N 7.77 1.26 -3.16 9.38 0.00 -1.85 -3.42 119.26 129.25 1xjz h ALA 173 Ca -0.14 -0.26 -0.38 0.00 0.00 0.00 0.00 54.91 54.13 1xjz h ALA 173 Cb 1.04 -0.13 -0.39 0.00 0.00 0.00 0.00 17.79 18.30 1xjz h ALA 173 CO 0.51 0.48 -0.72 0.45 0.00 0.00 0.00 179.25 179.97 1xjz s SER 174 N -6.77 1.42 0.19 0.00 0.15 -1.26 -5.03 113.70 102.40 1xjz s SER 174 Ca -0.07 -0.09 -0.10 0.00 0.70 0.00 0.00 55.95 56.39 1xjz s SER 174 Cb 0.15 -0.07 0.12 0.00 -1.71 0.00 0.00 66.02 64.51 1xjz s SER 174 CO 0.77 -0.28 1.78 0.00 1.20 0.00 0.00 173.24 176.71 1xjz h ALA 175 N 8.41 0.90 -0.01 5.45 0.00 -1.97 0.73 119.26 132.77 1xjz h ALA 175 Ca -0.13 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1xjz h ALA 175 Cb 1.13 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1xjz h ALA 175 CO 0.19 0.47 0.01 1.15 0.00 0.00 0.00 179.25 181.07 1xjz h THR 176 N 0.97 1.02 -0.64 0.00 2.02 -1.97 -1.44 112.91 112.87 1xjz h THR 176 Ca 0.24 -0.04 -0.07 0.00 0.77 0.00 0.00 66.41 67.30 1xjz h THR 176 Cb 0.13 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 1xjz h THR 176 CO -0.03 0.01 0.12 0.11 0.37 0.00 0.00 175.52 176.10 1xjz h LYS 177 N -0.00 1.03 -0.55 6.66 1.57 -1.93 -2.68 116.57 120.67 1xjz h LYS 177 Ca 0.00 -0.26 -0.08 0.00 -1.87 0.00 0.00 60.65 58.45 1xjz h LYS 177 Cb 0.01 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 1xjz h LYS 177 CO -0.00 0.94 0.04 0.35 -0.57 0.00 0.00 179.45 180.21 1xjz h PHE 178 N 0.97 0.97 -0.37 -1.35 3.57 -0.62 -2.32 116.94 117.81 1xjz h PHE 178 Ca 0.20 -0.14 -0.06 0.00 3.53 0.00 0.00 57.97 61.50 1xjz h PHE 178 Cb 0.40 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 1xjz h PHE 178 CO 0.03 0.86 -0.03 0.87 -2.23 0.00 0.00 178.31 177.81 1xjz h LYS 179 N 0.85 0.59 -0.64 1.11 1.57 -1.08 0.23 116.57 119.20 1xjz h LYS 179 Ca 0.17 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 1xjz h LYS 179 Cb 0.45 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 1xjz h LYS 179 CO 0.02 0.63 0.17 0.37 -0.57 0.00 0.00 179.45 180.07 1xjz h GLN 180 N 0.56 1.02 -0.39 3.15 4.15 -1.13 0.83 115.11 123.30 1xjz h GLN 180 Ca 0.11 -0.24 -0.11 0.00 0.77 0.00 0.00 58.65 59.18 1xjz h GLN 180 Cb 0.40 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 1xjz h GLN 180 CO 0.02 0.92 -0.18 1.25 -1.93 0.00 0.00 178.83 178.90 1xjz h LEU 181 N 0.94 0.83 -0.67 -2.39 5.85 -0.87 -2.16 115.31 116.85 1xjz h LEU 181 Ca 0.20 -0.40 -0.06 0.00 0.84 0.00 0.00 57.88 58.46 1xjz h LEU 181 Cb 0.35 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1xjz h LEU 181 CO 0.00 1.05 0.17 0.22 -0.34 0.00 0.00 178.44 179.54 1xjz h TYR 182 N 0.61 1.12 -0.71 1.25 5.03 -0.23 -0.59 116.97 123.45 1xjz h TYR 182 Ca 0.09 -0.13 -0.07 0.00 2.58 0.00 0.00 58.73 61.20 1xjz h TYR 182 Cb 0.73 -0.32 -0.03 0.00 1.55 0.00 0.00 36.73 38.67 1xjz h TYR 182 CO 0.06 0.92 0.18 0.00 -1.32 0.00 0.00 178.16 178.00 1xjz h ARG 183 N 0.99 1.12 -0.59 1.82 3.08 -0.78 -0.65 114.38 119.37 1xjz h ARG 183 Ca 0.21 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 1xjz h ARG 183 Cb 0.36 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1xjz h ARG 183 CO 0.00 0.98 0.16 1.03 -1.07 0.00 0.00 179.97 181.07 1xjz h SER 184 N 1.07 0.89 -0.66 7.04 0.87 -1.03 0.89 113.55 122.62 1xjz h SER 184 Ca 0.22 -0.22 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 1xjz h SER 184 Cb 0.35 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 62.05 1xjz h SER 184 CO -0.00 0.88 0.10 0.03 -0.53 0.00 0.00 176.83 177.31 1xjz h ARG 185 N 0.85 1.10 -0.54 2.24 2.47 -0.79 -1.13 114.38 118.59 1xjz h ARG 185 Ca 0.19 -0.30 -0.02 0.00 -1.26 0.00 0.00 59.98 58.59 1xjz h ARG 185 Cb 0.32 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.49 1xjz h ARG 185 CO -0.00 1.01 0.26 0.52 0.56 0.00 0.00 179.97 182.32 1xjz h MET 186 N 1.02 0.77 0.00 0.04 2.86 -0.78 -2.06 114.93 116.77 1xjz h MET 186 Ca 0.20 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1xjz h MET 186 Cb 0.45 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.97 1xjz h MET 186 CO 0.01 0.63 0.00 0.09 1.06 0.00 0.00 176.91 178.70 1xjz n ASN 187 N -4.58 0.03 0.02 1.22 3.02 0.28 -2.00 115.26 113.25 1xjz n ASN 187 Ca 0.03 0.51 0.12 0.00 -0.03 0.00 0.00 54.58 55.20 1xjz n ASN 187 Cb 0.11 -0.51 0.24 0.00 -0.61 0.00 0.00 39.78 39.01 1xjz n ASN 187 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1xjz n SER 188 N -1.53 0.54 -4.75 6.41 3.41 -0.46 -4.88 113.62 112.36 1xjz n SER 188 Ca 0.04 -0.06 -0.41 0.00 -0.26 0.00 0.00 58.87 58.18 1xjz n SER 188 Cb 0.22 0.18 -0.02 0.00 -0.26 0.00 0.00 64.21 64.33 1xjz n SER 188 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1xjz s LEU 189 N -3.46 4.39 -0.24 1.04 1.43 -0.85 -4.98 118.68 116.01 1xjz s LEU 189 Ca 0.09 2.67 -0.17 0.00 -1.03 0.00 0.00 54.13 55.69 1xjz s LEU 189 Cb 0.16 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.72 1xjz s LEU 189 CO 0.70 -0.67 0.48 -0.70 0.23 0.00 0.00 176.35 176.40 1xjz s GLU 190 N -0.71 4.10 -0.11 1.70 2.56 -1.26 -5.05 118.70 119.93 1xjz s GLU 190 Ca 0.57 0.29 -0.15 0.00 0.00 0.00 0.00 54.97 55.68 1xjz s GLU 190 Cb -0.41 -3.62 0.04 0.00 2.00 0.00 0.00 34.13 32.13 1xjz s GLU 190 CO 0.46 -0.27 0.39 0.00 -0.56 0.00 0.00 175.26 175.28 1xjz s MET 191 N 2.04 0.56 0.89 4.30 0.23 -1.26 -4.96 119.30 121.10 1xjz s MET 191 Ca 0.21 0.33 -0.11 0.00 -1.03 0.00 0.00 55.69 55.09 1xjz s MET 191 Cb -0.15 0.26 0.13 0.00 -1.53 0.00 0.00 34.83 33.53 1xjz s MET 191 CO 0.09 -0.11 1.09 0.95 -2.03 0.00 0.00 175.02 175.02 1xjz s THR 192 N -0.29 2.68 0.31 3.16 -4.23 -1.26 -4.72 115.64 111.28 1xjz s THR 192 Ca -0.04 0.22 0.03 0.00 -1.18 0.00 0.00 61.69 60.71 1xjz s THR 192 Cb -0.03 -2.71 0.29 0.00 1.34 0.00 0.00 72.50 71.39 1xjz s THR 192 CO 0.02 -0.29 1.88 -0.65 -0.54 0.00 0.00 174.62 175.04 1xjz h PRO 193 N -1.53 0.92 -0.09 3.99 0.11 -2.01 0.37 132.00 133.75 1xjz h PRO 193 Ca -0.49 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.55 1xjz h PRO 193 Cb 1.28 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1xjz h PRO 193 CO 0.54 0.61 0.02 0.00 -0.21 0.00 0.00 178.00 178.96 1xjz h ALA 194 N 1.54 0.12 -0.54 -0.75 0.00 -1.99 -0.75 119.26 116.88 1xjz h ALA 194 Ca 0.44 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1xjz h ALA 194 Cb 0.41 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1xjz h ALA 194 CO -0.20 -0.24 0.22 0.28 0.00 0.00 0.00 179.25 179.32 1xjz h VAL 195 N -0.07 1.22 -0.63 0.00 2.07 -1.82 -0.72 116.25 116.29 1xjz h VAL 195 Ca 0.03 -0.67 0.12 0.00 0.82 0.00 0.00 66.70 67.00 1xjz h VAL 195 Cb 0.27 0.64 -0.09 0.00 -1.52 0.00 0.00 31.29 30.59 1xjz h VAL 195 CO 0.00 0.26 0.16 -0.09 0.02 0.00 0.00 177.57 177.92 1xjz h ARG 196 N 0.74 0.28 -0.56 1.57 9.65 -0.79 0.96 114.38 126.24 1xjz h ARG 196 Ca 0.18 -0.02 -0.11 0.00 -1.10 0.00 0.00 59.98 58.93 1xjz h ARG 196 Cb 0.19 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.69 1xjz h ARG 196 CO -0.02 0.19 -0.09 1.96 2.80 0.00 0.00 179.97 184.81 1xjz h GLN 197 N 0.29 1.05 0.00 0.20 4.20 -0.55 -2.38 115.11 117.93 1xjz h GLN 197 Ca 0.33 -0.38 -0.08 0.00 0.06 0.00 0.00 58.65 58.58 1xjz h GLN 197 Cb 0.50 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 1xjz h GLN 197 CO -0.40 1.08 -0.40 0.00 -0.67 0.00 0.00 178.83 178.43 1xjz h ARG 198 N 0.94 0.00 -0.39 1.46 3.08 -0.16 -1.15 114.38 118.16 1xjz h ARG 198 Ca 0.15 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.09 1xjz h ARG 198 Cb 0.66 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 1xjz h ARG 198 CO 0.05 0.40 -0.18 0.28 -1.07 0.00 0.00 179.97 179.44 1xjz h VAL 199 N 0.00 1.28 -0.14 2.04 2.07 -0.58 0.16 116.25 121.08 1xjz h VAL 199 Ca -0.00 -1.31 -0.00 0.00 0.82 0.00 0.00 66.70 66.20 1xjz h VAL 199 Cb 0.77 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 1xjz h VAL 199 CO 0.05 0.44 0.07 0.40 0.02 0.00 0.00 177.57 178.55 1xjz h ILE 200 N 0.61 1.11 -0.18 4.57 2.04 -1.13 -1.56 117.51 122.97 1xjz h ILE 200 Ca 0.09 -0.30 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 1xjz h ILE 200 Cb 0.73 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1xjz h ILE 200 CO 0.06 0.10 -0.09 -0.33 0.00 0.00 0.00 178.15 177.88 1xjz h GLU 201 N 0.12 0.28 0.00 2.37 4.39 -1.07 -2.04 114.58 118.63 1xjz h GLU 201 Ca 0.05 -0.06 -0.10 0.00 0.34 0.00 0.00 59.36 59.59 1xjz h GLU 201 Cb 0.09 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 1xjz h GLU 201 CO -0.01 0.39 -0.48 1.49 -1.16 0.00 0.00 179.01 179.24 1xjz h GLU 202 N 0.27 0.00 -0.60 2.33 4.57 -0.28 -2.16 114.58 118.71 1xjz h GLU 202 Ca 0.06 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.16 1xjz h GLU 202 Cb 0.34 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.90 1xjz h GLU 202 CO 0.02 0.48 0.07 0.00 -1.18 0.00 0.00 179.01 178.40 1xjz h ALA 203 N 1.52 0.80 -0.76 2.92 0.00 -0.56 0.18 119.26 123.37 1xjz h ALA 203 Ca -0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1xjz h ALA 203 Cb 0.95 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1xjz h ALA 203 CO 0.06 0.58 0.27 0.87 0.00 0.00 0.00 179.25 181.03 1xjz h LYS 204 N 0.92 1.15 -0.63 0.00 1.57 -1.23 -1.55 116.57 116.80 1xjz h LYS 204 Ca 0.18 -0.22 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1xjz h LYS 204 Cb 0.46 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 1xjz h LYS 204 CO 0.02 0.95 0.29 1.15 -0.57 0.00 0.00 179.45 181.28 1xjz h THR 205 N 1.11 1.22 -0.36 -0.16 2.02 -0.83 -0.21 112.91 115.70 1xjz h THR 205 Ca 0.25 -0.65 0.03 0.00 0.77 0.00 0.00 66.41 66.80 1xjz h THR 205 Cb 0.26 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 1xjz h THR 205 CO -0.02 0.26 0.18 0.00 0.37 0.00 0.00 175.52 176.32 1xjz h ALA 206 N 1.12 0.45 -0.32 6.16 0.00 -0.41 0.62 119.26 126.88 1xjz h ALA 206 Ca 0.21 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1xjz h ALA 206 Cb 0.15 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1xjz h ALA 206 CO -0.02 -0.19 0.21 0.74 0.00 0.00 0.00 179.25 179.99 1xjz h PHE 207 N 0.37 0.41 -0.95 0.00 -1.00 -0.94 -2.22 116.94 112.61 1xjz h PHE 207 Ca 0.15 0.01 0.07 0.00 2.81 0.00 0.00 57.97 61.01 1xjz h PHE 207 Cb 0.06 -0.14 -0.06 0.00 3.61 0.00 0.00 35.95 39.42 1xjz h PHE 207 CO -0.10 0.27 0.61 -0.07 -1.61 0.00 0.00 178.31 177.41 1xjz h LEU 208 N 0.44 0.95 -1.04 1.54 3.38 -0.43 0.12 115.31 120.28 1xjz h LEU 208 Ca 0.12 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 1xjz h LEU 208 Cb -0.04 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1xjz h LEU 208 CO -0.03 0.60 0.04 -0.07 0.09 0.00 0.00 178.44 179.08 1xjz h LEU 209 N 1.08 0.69 -0.39 1.67 3.38 -0.44 0.15 115.31 121.46 1xjz h LEU 209 Ca 0.41 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 58.11 1xjz h LEU 209 Cb 0.21 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1xjz h LEU 209 CO -0.16 0.73 -0.28 0.78 0.09 0.00 0.00 178.44 179.60 1xjz h ASN 210 N 0.69 0.91 -0.50 -0.43 2.35 -0.59 -1.49 115.58 116.52 1xjz h ASN 210 Ca 0.14 -0.44 -0.03 0.00 -0.55 0.00 0.00 56.30 55.43 1xjz h ASN 210 Cb 0.37 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 1xjz h ASN 210 CO 0.01 1.15 0.19 0.40 -1.65 0.00 0.00 177.43 177.54 1xjz h ILE 211 N 0.68 1.22 -0.41 2.81 2.04 -0.25 -0.84 117.51 122.75 1xjz h ILE 211 Ca 0.07 -0.69 -0.04 0.00 1.00 0.00 0.00 64.86 65.21 1xjz h ILE 211 Cb 0.86 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 1xjz h ILE 211 CO 0.07 0.26 0.09 -0.61 0.00 0.00 0.00 178.15 177.96 1xjz h GLN 212 N 0.67 0.60 -0.31 2.37 4.15 -0.63 -1.21 115.11 120.75 1xjz h GLN 212 Ca 0.17 -0.11 -0.06 0.00 0.77 0.00 0.00 58.65 59.43 1xjz h GLN 212 Cb 0.21 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.79 1xjz h GLN 212 CO -0.01 0.56 -0.02 1.25 -1.93 0.00 0.00 178.83 178.68 1xjz h LEU 213 N 0.59 0.56 -0.11 -2.39 5.85 -0.75 -2.18 115.31 116.88 1xjz h LEU 213 Ca 0.14 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.55 1xjz h LEU 213 Cb 0.24 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1xjz h LEU 213 CO -0.00 0.75 -0.03 -0.26 -0.34 0.00 0.00 178.44 178.56 1xjz h PHE 214 N 0.35 -0.07 -0.87 1.25 0.04 -0.66 0.40 116.94 117.38 1xjz h PHE 214 Ca 0.09 0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.95 1xjz h PHE 214 Cb 0.48 0.05 -0.06 0.00 2.20 0.00 0.00 35.95 38.61 1xjz h PHE 214 CO 0.04 -0.05 0.57 0.93 -0.60 0.00 0.00 178.31 179.19 1xjz h GLU 215 N -0.01 0.87 -0.06 1.51 5.08 -1.19 0.67 114.58 121.44 1xjz h GLU 215 Ca 0.05 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1xjz h GLU 215 Cb 0.09 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.14 1xjz h GLU 215 CO -0.12 0.57 -0.10 1.49 -1.00 0.00 0.00 179.01 179.86 1xjz h GLU 216 N 0.90 0.17 -0.26 2.33 4.81 -0.70 -2.75 114.58 119.07 1xjz h GLU 216 Ca 0.40 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.51 1xjz h GLU 216 Cb 0.35 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1xjz h GLU 216 CO -0.16 0.67 0.09 -0.07 -0.73 0.00 0.00 179.01 178.81 1xjz h LEU 217 N -0.31 0.33 -0.56 1.64 3.38 -0.50 -1.60 115.31 117.68 1xjz h LEU 217 Ca 0.00 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 1xjz h LEU 217 Cb 0.66 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1xjz h LEU 217 CO 0.02 0.32 -0.21 -0.61 0.09 0.00 0.00 178.44 178.05 1xjz h GLN 218 N 0.37 0.94 -0.01 1.13 5.75 -0.84 -1.89 115.11 120.55 1xjz h GLN 218 Ca 0.09 -0.39 -0.17 0.00 -0.15 0.00 0.00 58.65 58.03 1xjz h GLN 218 Cb 0.10 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 1xjz h GLN 218 CO -0.01 1.05 -0.77 1.49 -2.65 0.00 0.00 178.83 177.95 1xjz h GLU 219 N 0.81 0.14 -0.16 1.69 4.81 -1.12 -2.32 114.58 118.43 1xjz h GLU 219 Ca 0.11 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1xjz h GLU 219 Cb 0.77 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 1xjz h GLU 219 CO 0.06 0.84 -0.00 -0.07 -0.73 0.00 0.00 179.01 179.11 1xjz h LEU 220 N 0.09 0.27 -1.47 1.64 3.38 -1.20 -3.00 115.31 115.03 1xjz h LEU 220 Ca -0.02 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 1xjz h LEU 220 Cb 1.34 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1xjz h LEU 220 CO 0.11 0.52 0.06 -0.07 0.09 0.00 0.00 178.44 179.16 1xjz h LEU 221 N 0.02 0.38 -7.80 1.67 3.38 -1.32 -3.33 115.31 108.29 1xjz h LEU 221 Ca 0.04 -0.04 -0.72 0.00 0.09 0.00 0.00 57.88 57.24 1xjz h LEU 221 Cb 0.38 -0.10 -0.18 0.00 0.09 0.00 0.00 40.66 40.86 1xjz h LEU 221 CO 0.01 0.39 1.12 0.42 0.09 0.00 0.00 178.44 180.47 1xjz s THR 222 N -5.10 4.98 0.00 0.22 -4.23 -0.88 -5.11 115.64 105.52 1xjz s THR 222 Ca -0.07 -2.30 0.00 0.00 -1.18 0.00 0.00 61.69 58.13 1xjz s THR 222 Cb 0.16 -4.85 0.00 0.00 1.34 0.00 0.00 72.50 69.16 1xjz s THR 222 CO 0.74 -1.56 0.00 1.41 -0.54 0.00 0.00 174.62 174.67