#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qjz n GLN 11 N 0.00 0.00 -2.82 1.97 7.27 -1.26 -4.73 117.38 117.82 1qjz n GLN 11 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 57.00 56.73 1qjz n GLN 11 Cb 0.00 -0.01 -0.01 0.00 2.41 0.00 0.00 30.24 32.63 1qjz n GLN 11 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1qjz n ALA 12 N -3.00 5.35 -2.70 1.69 0.00 -1.26 -4.69 120.51 115.90 1qjz n ALA 12 Ca 0.00 -4.67 -0.07 0.00 0.00 0.00 0.00 53.44 48.70 1qjz n ALA 12 Cb 0.00 -1.51 0.09 0.00 0.00 0.00 0.00 19.45 18.03 1qjz n ALA 12 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1qjz n SER 13 N -0.04 -1.85 -3.19 0.00 7.64 -1.26 -4.53 113.62 110.38 1qjz n SER 13 Ca 0.38 -2.81 -0.24 0.00 1.01 0.00 0.00 58.87 57.22 1qjz n SER 13 Cb 0.33 1.49 -0.07 0.00 -1.01 0.00 0.00 64.21 64.95 1qjz n SER 13 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1qjz n ILE 14 N 0.17 -0.66 -3.56 0.44 2.08 -1.26 -3.28 119.36 113.29 1qjz n ILE 14 Ca -0.02 -4.05 -0.40 0.00 0.56 0.00 0.00 62.75 58.85 1qjz n ILE 14 Cb 0.73 -1.86 -0.11 0.00 -0.75 0.00 0.00 39.64 37.66 1qjz n ILE 14 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1qjz s PRO 15 N -1.26 3.56 0.00 0.38 0.04 -1.26 -5.10 135.00 131.37 1qjz s PRO 15 Ca 0.35 -0.59 0.00 0.00 0.04 0.00 0.00 61.00 60.80 1qjz s PRO 15 Cb 0.18 -3.74 0.00 0.00 0.04 0.00 0.00 34.50 30.98 1qjz s PRO 15 CO -0.11 -0.39 0.00 0.00 0.04 0.00 0.00 177.00 176.55 1qjz n ALA 16 N 5.08 0.00 -1.32 8.56 0.00 -1.21 -4.23 120.51 127.40 1qjz n ALA 16 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1qjz n ALA 16 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1qjz n ALA 16 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1qjz n PRO 17 N -1.96 0.00 0.00 0.00 -0.04 -1.26 -4.87 135.00 126.88 1qjz n PRO 17 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1qjz n PRO 17 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1qjz n PRO 17 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qjz n GLY 18 N 5.00 1.27 3.53 0.55 0.00 -1.26 -5.05 105.19 109.24 1qjz n GLY 18 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1qjz n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qjz s SER 19 N -2.00 6.37 -0.49 1.61 0.01 -1.26 -4.93 113.70 113.00 1qjz s SER 19 Ca 0.00 -0.20 0.08 0.00 1.31 0.00 0.00 55.95 57.14 1qjz s SER 19 Cb 0.00 -2.35 0.35 0.00 0.21 0.00 0.00 66.02 64.24 1qjz s SER 19 CO 0.00 -0.81 0.90 -0.38 0.41 0.00 0.00 173.24 173.35 1qjz n ILE 20 N 5.94 1.96 -1.00 1.44 5.41 -1.26 -5.09 119.36 126.75 1qjz n ILE 20 Ca 0.00 -5.13 -0.29 0.00 1.00 0.00 0.00 62.75 58.33 1qjz n ILE 20 Cb 0.48 -0.96 0.18 0.00 -0.71 0.00 0.00 39.64 38.63 1qjz n ILE 20 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 1qjz s LEU 21 N -3.15 1.69 0.00 1.39 2.34 -1.26 -4.82 118.68 114.87 1qjz s LEU 21 Ca 0.45 1.42 0.01 0.00 0.06 0.00 0.00 54.13 56.07 1qjz s LEU 21 Cb 0.32 -3.62 0.01 0.00 -0.56 0.00 0.00 46.19 42.34 1qjz s LEU 21 CO -0.12 -3.24 0.08 -1.54 -1.06 0.00 0.00 176.35 170.47 1qjz n SER 22 N -4.27 0.19 -2.93 1.48 3.41 -1.26 -4.91 113.62 105.34 1qjz n SER 22 Ca 0.06 -1.14 0.01 0.00 -0.26 0.00 0.00 58.87 57.53 1qjz n SER 22 Cb 0.56 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1qjz n SER 22 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1qjz s GLN 23 N -2.34 0.45 0.01 4.33 0.74 -1.26 -3.86 119.66 117.73 1qjz s GLN 23 Ca 0.06 -0.17 -0.08 0.00 0.05 0.00 0.00 55.36 55.22 1qjz s GLN 23 Cb -0.00 0.05 -0.30 0.00 1.10 0.00 0.00 33.01 33.85 1qjz s GLN 23 CO 0.04 -0.65 0.91 -1.00 -0.55 0.00 0.00 175.29 174.04 1qjz h PRO 24 N 5.97 0.36 0.00 1.67 0.13 -2.00 -3.44 132.00 134.69 1qjz h PRO 24 Ca 0.00 -0.61 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 1qjz h PRO 24 Cb 1.21 0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.56 1qjz h PRO 24 CO -0.01 1.26 0.00 0.09 -0.23 0.00 0.00 178.00 179.11 1qjz n ASN 25 N -3.56 0.00 -3.25 1.44 3.02 -1.26 -5.02 115.26 106.63 1qjz n ASN 25 Ca -0.17 -0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.18 1qjz n ASN 25 Cb 1.06 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 40.20 1qjz n ASN 25 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1qjz s THR 26 N 0.00 -0.90 -0.21 3.41 -1.32 -1.26 -5.12 115.64 110.25 1qjz s THR 26 Ca 0.00 -0.01 -0.32 0.00 -1.21 0.00 0.00 61.69 60.15 1qjz s THR 26 Cb 0.00 -0.95 -0.09 0.00 -1.51 0.00 0.00 72.50 69.95 1qjz s THR 26 CO 0.00 -0.03 2.11 1.21 -2.21 0.00 0.00 174.62 175.70 1qjz n GLU 27 N 5.42 1.82 -4.21 7.08 0.00 -1.26 -4.77 120.64 124.72 1qjz n GLU 27 Ca -0.03 0.57 -0.14 0.00 0.00 0.00 0.00 57.16 57.56 1qjz n GLU 27 Cb 0.51 -2.84 -0.09 0.00 0.00 0.00 0.00 31.44 29.02 1qjz n GLU 27 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.13 175.99 1qjz s GLN 28 N 5.60 1.44 0.85 5.31 2.00 -1.25 -5.08 119.66 128.54 1qjz s GLN 28 Ca 1.01 -1.75 -0.16 0.00 -2.00 0.00 0.00 55.36 52.45 1qjz s GLN 28 Cb -0.59 0.31 -0.10 0.00 0.80 0.00 0.00 33.01 33.43 1qjz s GLN 28 CO 0.44 -0.51 -0.23 -1.13 -0.50 0.00 0.00 175.29 173.35 1qjz n SER 29 N -0.77 -4.07 -4.55 6.67 3.41 -1.26 -4.03 113.62 109.02 1qjz n SER 29 Ca 0.04 0.36 -0.43 0.00 -0.26 0.00 0.00 58.87 58.58 1qjz n SER 29 Cb 0.64 -0.94 -0.04 0.00 -0.26 0.00 0.00 64.21 63.61 1qjz n SER 29 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1qjz n PRO 30 N 1.00 1.48 -2.34 4.33 -0.02 -1.26 -4.43 135.00 133.75 1qjz n PRO 30 Ca 0.03 0.34 -0.39 0.00 -2.02 0.00 0.00 63.50 61.46 1qjz n PRO 30 Cb 0.53 -3.04 -0.03 0.00 -0.02 0.00 0.00 33.50 30.94 1qjz n PRO 30 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qjz s ALA 31 N 8.95 3.33 -0.18 3.55 0.00 -1.26 -4.96 121.76 131.19 1qjz s ALA 31 Ca 1.04 0.99 -0.14 0.00 0.00 0.00 0.00 51.96 53.85 1qjz s ALA 31 Cb -0.46 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.24 1qjz s ALA 31 CO 0.37 -0.38 0.31 0.42 0.00 0.00 0.00 175.76 176.48 1qjz s ILE 32 N -1.27 5.28 -0.61 0.00 1.01 -1.25 -4.79 121.20 119.57 1qjz s ILE 32 Ca 0.50 0.55 -0.26 0.00 0.00 0.00 0.00 60.65 61.44 1qjz s ILE 32 Cb -0.33 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.47 1qjz s ILE 32 CO 0.42 0.34 1.91 -0.69 0.00 0.00 0.00 174.94 176.92 1qjz s VAL 33 N 0.82 3.33 -0.44 2.92 1.01 -1.26 -3.89 120.40 122.89 1qjz s VAL 33 Ca 0.16 0.17 -0.16 0.00 0.00 0.00 0.00 61.98 62.15 1qjz s VAL 33 Cb -0.14 -3.87 0.04 0.00 0.00 0.00 0.00 36.38 32.42 1qjz s VAL 33 CO 0.05 -0.84 0.37 -0.76 0.00 0.00 0.00 175.10 173.92 1qjz s LEU 34 N 9.38 5.24 0.94 3.92 1.43 -0.16 -4.82 118.68 134.62 1qjz s LEU 34 Ca 0.70 -1.01 -0.12 0.00 -1.03 0.00 0.00 54.13 52.66 1qjz s LEU 34 Cb -0.13 -2.21 0.16 0.00 0.03 0.00 0.00 46.19 44.03 1qjz s LEU 34 CO 0.20 -0.56 1.12 -2.16 0.23 0.00 0.00 176.35 175.19 1qjz s PRO 35 N 1.78 0.88 0.05 1.29 0.04 -1.26 -2.53 135.00 135.25 1qjz s PRO 35 Ca 0.06 0.35 -0.27 0.00 0.04 0.00 0.00 61.00 61.18 1qjz s PRO 35 Cb -0.21 -1.80 0.08 0.00 0.04 0.00 0.00 34.50 32.61 1qjz s PRO 35 CO 0.09 -2.39 0.68 -0.59 0.04 0.00 0.00 177.00 174.83 1qjz s PHE 36 N -3.18 -0.56 -0.17 0.56 -0.12 -0.21 -4.94 117.98 109.36 1qjz s PHE 36 Ca 0.64 0.63 -0.08 0.00 -0.05 0.00 0.00 56.93 58.07 1qjz s PHE 36 Cb -0.16 0.50 0.07 0.00 -0.63 0.00 0.00 43.02 42.79 1qjz s PHE 36 CO 0.55 -0.71 0.40 -0.65 -0.05 0.00 0.00 175.22 174.76 1qjz s GLN 37 N -2.61 0.35 -0.04 1.99 -0.21 -1.26 -2.78 119.66 115.10 1qjz s GLN 37 Ca -0.03 0.83 -0.30 0.00 0.02 0.00 0.00 55.36 55.87 1qjz s GLN 37 Cb -0.01 0.05 0.11 0.00 1.00 0.00 0.00 33.01 34.16 1qjz s GLN 37 CO -0.03 -0.19 1.07 -0.59 -2.12 0.00 0.00 175.29 173.43 1qjz s PHE 38 N 1.72 -0.19 -0.53 0.91 -0.71 -1.26 -5.03 117.98 112.90 1qjz s PHE 38 Ca -0.07 0.06 -0.04 0.00 -1.04 0.00 0.00 56.93 55.84 1qjz s PHE 38 Cb -0.09 0.55 0.14 0.00 -1.21 0.00 0.00 43.02 42.40 1qjz s PHE 38 CO -0.12 -0.43 0.34 -1.83 -1.34 0.00 0.00 175.22 171.84 1qjz s GLU 39 N -2.80 2.35 0.47 1.99 1.03 -1.26 -0.32 118.70 120.15 1qjz s GLU 39 Ca 0.09 -2.18 0.19 0.00 0.03 0.00 0.00 54.97 53.10 1qjz s GLU 39 Cb -0.00 -3.70 1.18 0.00 -0.80 0.00 0.00 34.13 30.80 1qjz s GLU 39 CO -0.05 -1.14 1.96 0.00 -1.33 0.00 0.00 175.26 174.70 1qjz h ALA 40 N 7.58 2.24 -2.36 -0.84 0.00 -1.86 -3.42 119.26 120.60 1qjz h ALA 40 Ca -0.08 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1qjz h ALA 40 Cb 1.00 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 18.55 1qjz h ALA 40 CO 0.72 -0.41 -0.07 0.99 0.00 0.00 0.00 179.25 180.48 1qjz s THR 41 N -5.26 0.01 0.43 0.00 2.01 -1.26 -5.04 115.64 106.54 1qjz s THR 41 Ca -0.07 -0.09 0.06 0.00 0.31 0.00 0.00 61.69 61.90 1qjz s THR 41 Cb 0.20 -0.77 -0.06 0.00 0.01 0.00 0.00 72.50 71.88 1qjz s THR 41 CO 0.75 -0.05 0.06 0.42 -0.69 0.00 0.00 174.62 175.11 1qjz s THR 42 N -0.33 1.91 -0.15 -0.82 -4.23 -1.25 -4.25 115.64 106.52 1qjz s THR 42 Ca -0.05 -1.91 -0.06 0.00 -1.18 0.00 0.00 61.69 58.48 1qjz s THR 42 Cb -0.03 -2.82 0.07 0.00 1.34 0.00 0.00 72.50 71.05 1qjz s THR 42 CO 0.03 0.00 0.32 -0.36 -0.54 0.00 0.00 174.62 174.08 1qjz s PHE 43 N -2.72 -0.53 0.25 3.99 2.99 -1.26 -4.89 117.98 115.81 1qjz s PHE 43 Ca 0.31 1.13 0.00 0.00 0.00 0.00 0.00 56.93 58.37 1qjz s PHE 43 Cb 0.07 0.12 0.00 0.00 0.00 0.00 0.00 43.02 43.20 1qjz s PHE 43 CO 0.17 -0.36 0.00 0.41 -0.00 0.00 0.00 175.22 175.43 1qjz n GLY 44 N 4.96 -1.82 2.40 4.36 0.00 -1.26 -1.78 105.19 112.04 1qjz n GLY 44 Ca -0.13 0.41 -0.27 0.00 0.00 0.00 0.00 46.02 46.03 1qjz n GLY 44 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qjz n THR 45 N -3.00 2.48 -3.55 2.61 -2.24 -1.26 -4.59 114.28 104.73 1qjz n THR 45 Ca 0.00 -4.72 -0.07 0.00 -2.27 0.00 0.00 64.05 56.99 1qjz n THR 45 Cb 0.00 -1.24 -0.03 0.00 -2.10 0.00 0.00 70.33 66.97 1qjz n THR 45 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qjz s ALA 46 N -3.58 -1.94 -1.04 6.98 0.00 -1.26 -4.87 121.76 116.05 1qjz s ALA 46 Ca 0.49 1.35 -0.25 0.00 0.00 0.00 0.00 51.96 53.55 1qjz s ALA 46 Cb 0.41 -0.03 -0.13 0.00 0.00 0.00 0.00 23.12 23.36 1qjz s ALA 46 CO -0.15 -0.57 2.07 -2.00 0.00 0.00 0.00 175.76 175.11 1qjz s GLU 47 N -2.46 1.92 0.06 0.00 2.12 -1.22 -4.21 118.70 114.91 1qjz s GLU 47 Ca 0.05 -0.50 -0.33 0.00 0.36 0.00 0.00 54.97 54.55 1qjz s GLU 47 Cb -0.01 -5.05 -0.12 0.00 0.26 0.00 0.00 34.13 29.21 1qjz s GLU 47 CO -0.06 -4.46 1.75 -2.37 -0.54 0.00 0.00 175.26 169.59 1qjz n THR 48 N 8.39 0.30 -2.67 -1.70 5.66 -1.26 -4.72 114.28 118.28 1qjz n THR 48 Ca 0.43 -0.05 -0.04 0.00 -3.05 0.00 0.00 64.05 61.33 1qjz n THR 48 Cb 0.46 -1.81 0.09 0.00 -1.55 0.00 0.00 70.33 67.52 1qjz n THR 48 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1qjz n ALA 49 N 5.15 -3.15 -2.41 1.79 0.00 -1.24 -1.81 120.51 118.83 1qjz n ALA 49 Ca 0.19 -0.46 -0.31 0.00 0.00 0.00 0.00 53.44 52.86 1qjz n ALA 49 Cb 0.31 -2.98 -0.14 0.00 0.00 0.00 0.00 19.45 16.65 1qjz n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qjz s ALA 50 N 0.13 2.47 -0.58 0.00 0.00 -1.20 -5.00 121.76 117.58 1qjz s ALA 50 Ca 0.24 -1.19 -0.01 0.00 0.00 0.00 0.00 51.96 51.00 1qjz s ALA 50 Cb 0.24 -0.66 0.15 0.00 0.00 0.00 0.00 23.12 22.85 1qjz s ALA 50 CO -0.13 0.56 0.37 -1.14 0.00 0.00 0.00 175.76 175.41 1qjz s GLN 51 N -1.26 2.35 0.14 0.00 2.00 -1.26 -3.11 119.66 118.52 1qjz s GLN 51 Ca 0.13 -2.49 -0.07 0.00 -2.00 0.00 0.00 55.36 50.93 1qjz s GLN 51 Cb -0.10 -3.60 -0.06 0.00 0.80 0.00 0.00 33.01 30.04 1qjz s GLN 51 CO 0.03 -1.14 0.42 0.14 -0.50 0.00 0.00 175.29 174.24 1qjz s VAL 52 N -0.02 5.10 0.06 1.34 -7.23 -1.19 -4.99 120.40 113.48 1qjz s VAL 52 Ca 0.16 0.22 0.06 0.00 -1.81 0.00 0.00 61.98 60.60 1qjz s VAL 52 Cb -0.22 -3.63 -0.04 0.00 0.56 0.00 0.00 36.38 33.06 1qjz s VAL 52 CO -0.03 0.08 -0.08 -0.55 -0.31 0.00 0.00 175.10 174.20 1qjz s SER 53 N -2.26 4.49 -0.06 4.85 0.15 -1.26 -1.54 113.70 118.07 1qjz s SER 53 Ca 0.40 -0.29 -0.02 0.00 0.70 0.00 0.00 55.95 56.75 1qjz s SER 53 Cb -0.12 -0.94 -0.02 0.00 -1.71 0.00 0.00 66.02 63.23 1qjz s SER 53 CO 0.22 0.22 2.37 -0.11 1.20 0.00 0.00 173.24 177.14 1qjz n LEU 54 N 1.03 5.54 0.00 3.45 -0.00 -0.45 -3.39 117.00 123.18 1qjz n LEU 54 Ca -0.14 -2.77 0.00 0.00 -0.00 0.00 0.00 56.01 53.10 1qjz n LEU 54 Cb 0.52 -1.18 0.00 0.00 -0.00 0.00 0.00 43.42 42.76 1qjz n LEU 54 CO 0.33 1.21 0.00 1.67 -0.00 0.00 0.00 177.39 180.60 1qjz n GLN 55 N 1.52 0.00 0.01 1.96 7.27 -1.26 -4.73 117.38 122.15 1qjz n GLN 55 Ca 0.15 0.00 0.13 0.00 0.07 0.00 0.00 57.00 57.35 1qjz n GLN 55 Cb 0.60 -0.23 0.37 0.00 2.41 0.00 0.00 30.24 33.38 1qjz n GLN 55 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 1qjz n THR 56 N -1.76 0.07 -1.62 1.69 -2.24 -1.23 -4.54 114.28 104.64 1qjz n THR 56 Ca 0.00 -0.05 -0.49 0.00 -2.27 0.00 0.00 64.05 61.24 1qjz n THR 56 Cb 0.00 -0.08 -0.05 0.00 -2.10 0.00 0.00 70.33 68.10 1qjz n THR 56 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qjz n ALA 57 N -1.56 0.04 -0.10 6.98 0.00 -1.22 -4.83 120.51 119.83 1qjz n ALA 57 Ca 0.06 0.47 -0.06 0.00 0.00 0.00 0.00 53.44 53.92 1qjz n ALA 57 Cb 0.35 -2.18 0.01 0.00 0.00 0.00 0.00 19.45 17.64 1qjz n ALA 57 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1qjz h ASP 58 N 4.77 -0.17 -0.01 0.00 3.32 -1.94 -1.21 116.42 121.18 1qjz h ASP 58 Ca -0.46 0.08 0.03 0.00 0.02 0.00 0.00 57.03 56.71 1qjz h ASP 58 Cb 1.30 0.15 -0.05 0.00 0.22 0.00 0.00 39.33 40.95 1qjz h ASP 58 CO 0.80 -0.05 -0.36 -0.65 -1.72 0.00 0.00 179.24 177.26 1qjz h PRO 59 N 0.08 -0.49 -0.12 3.56 0.11 -1.96 0.44 132.00 133.62 1qjz h PRO 59 Ca 0.17 0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.34 1qjz h PRO 59 Cb 0.24 0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.43 1qjz h PRO 59 CO -0.30 -0.33 -0.06 0.82 -0.21 0.00 0.00 178.00 177.93 1qjz h ILE 60 N -0.51 0.81 0.00 4.15 2.04 -1.89 -0.04 117.51 122.07 1qjz h ILE 60 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.92 1qjz h ILE 60 Cb 0.60 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1qjz h ILE 60 CO -0.30 0.00 0.00 0.41 0.00 0.00 0.00 178.15 178.26 1qjz n THR 61 N -5.19 0.91 1.11 -0.27 -1.04 -0.47 -1.15 114.28 108.17 1qjz n THR 61 Ca -0.04 0.44 0.10 0.00 -2.04 0.00 0.00 64.05 62.51 1qjz n THR 61 Cb 0.12 -1.41 0.33 0.00 -1.82 0.00 0.00 70.33 67.55 1qjz n THR 61 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1qjz n LYS 62 N -2.27 1.79 0.00 -2.82 5.02 0.15 -3.30 118.16 116.72 1qjz n LYS 62 Ca 0.01 -1.19 0.00 0.00 -2.02 0.00 0.00 58.31 55.10 1qjz n LYS 62 Cb 0.15 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1qjz n LYS 62 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1qjz n LEU 63 N 0.42 0.00 -0.46 -0.35 7.94 -0.35 -4.76 117.00 119.44 1qjz n LEU 63 Ca 0.16 -0.06 0.11 0.00 -1.11 0.00 0.00 56.01 55.11 1qjz n LEU 63 Cb 0.34 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.28 1qjz n LEU 63 CO 0.12 0.00 0.28 0.35 -1.11 0.00 0.00 177.39 177.03 1qjz n THR 64 N -0.33 0.00 -0.05 1.96 -2.24 -0.30 -4.43 114.28 108.89 1qjz n THR 64 Ca 0.00 -0.25 -0.12 0.00 -2.27 0.00 0.00 64.05 61.41 1qjz n THR 64 Cb 0.00 1.24 -0.06 0.00 -2.10 0.00 0.00 70.33 69.40 1qjz n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qjz h ALA 65 N 3.76 0.20 0.00 6.98 0.00 -1.80 -2.89 119.26 125.52 1qjz h ALA 65 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1qjz h ALA 65 Cb 0.73 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1qjz h ALA 65 CO 0.00 -0.07 0.12 -2.30 0.00 0.00 0.00 179.25 177.00 1qjz n PRO 66 N -4.73 0.07 -4.08 0.00 -0.02 -1.26 -4.63 135.00 120.35 1qjz n PRO 66 Ca -0.05 0.52 -0.26 0.00 -2.02 0.00 0.00 63.50 61.68 1qjz n PRO 66 Cb 0.24 -1.84 -0.04 0.00 -0.02 0.00 0.00 33.50 31.83 1qjz n PRO 66 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1qjz n TYR 67 N -1.85 0.56 -0.08 6.00 4.01 -1.09 -0.02 117.16 124.69 1qjz n TYR 67 Ca -0.01 -2.10 -0.17 0.00 -0.16 0.00 0.00 57.90 55.46 1qjz n TYR 67 Cb 0.13 -0.31 -0.06 0.00 -0.31 0.00 0.00 39.34 38.79 1qjz n TYR 67 CO 0.00 0.00 0.00 2.89 -0.46 0.00 0.00 176.86 179.29 1qjz n ARG 68 N -1.22 0.37 -4.40 -0.72 1.85 0.70 -4.49 116.66 108.75 1qjz n ARG 68 Ca -0.14 0.15 -0.28 0.00 -1.00 0.00 0.00 57.85 56.58 1qjz n ARG 68 Cb 0.55 -1.14 -0.12 0.00 -1.05 0.00 0.00 32.46 30.69 1qjz n ARG 68 CO 0.00 0.00 0.00 -3.38 -0.01 0.00 0.00 177.63 174.24 1qjz s HIS 69 N -2.31 2.30 -0.11 2.89 -3.43 -1.22 -3.87 115.29 109.53 1qjz s HIS 69 Ca -0.24 -0.37 -0.25 0.00 -0.80 0.00 0.00 55.06 53.41 1qjz s HIS 69 Cb 0.09 -1.19 0.06 0.00 -1.43 0.00 0.00 32.58 30.10 1qjz s HIS 69 CO 0.31 0.41 0.59 0.00 -2.00 0.00 0.00 174.74 174.05 1qjz s ALA 70 N -1.35 -1.50 -0.11 -1.38 0.00 0.14 -2.22 121.76 115.34 1qjz s ALA 70 Ca 0.17 1.28 -0.02 0.00 0.00 0.00 0.00 51.96 53.40 1qjz s ALA 70 Cb -0.09 -0.34 0.04 0.00 0.00 0.00 0.00 23.12 22.73 1qjz s ALA 70 CO 0.08 -0.32 0.01 -0.65 0.00 0.00 0.00 175.76 174.87 1qjz s GLN 71 N -0.69 0.67 -0.02 0.00 1.11 -0.36 -0.02 119.66 120.35 1qjz s GLN 71 Ca -0.08 -0.06 -0.30 0.00 0.01 0.00 0.00 55.36 54.93 1qjz s GLN 71 Cb -0.02 -1.34 -0.07 0.00 -1.01 0.00 0.00 33.01 30.57 1qjz s GLN 71 CO 0.06 -0.40 1.76 -1.50 0.01 0.00 0.00 175.29 175.22 1qjz s ILE 72 N 1.93 3.40 -0.59 1.08 1.10 0.19 -2.49 121.20 125.82 1qjz s ILE 72 Ca 0.03 0.48 0.23 0.00 -0.51 0.00 0.00 60.65 60.88 1qjz s ILE 72 Cb -0.14 -3.31 -0.13 0.00 0.15 0.00 0.00 42.46 39.03 1qjz s ILE 72 CO -0.06 -0.04 0.99 0.52 -2.11 0.00 0.00 174.94 174.23 1qjz n VAL 73 N 5.50 0.16 -3.64 4.00 0.31 -1.04 -4.76 118.33 118.86 1qjz n VAL 73 Ca 0.18 -0.25 -0.07 0.00 -0.01 0.00 0.00 64.34 64.19 1qjz n VAL 73 Cb 0.42 0.23 -0.07 0.00 -0.91 0.00 0.00 33.84 33.51 1qjz n VAL 73 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1qjz s GLU 74 N -3.21 0.52 0.01 5.55 2.12 -1.08 -4.95 118.70 117.66 1qjz s GLU 74 Ca 0.03 0.73 -0.07 0.00 0.36 0.00 0.00 54.97 56.02 1qjz s GLU 74 Cb 0.14 0.19 -0.00 0.00 0.26 0.00 0.00 34.13 34.72 1qjz s GLU 74 CO 0.81 -0.08 0.12 0.00 -0.54 0.00 0.00 175.26 175.57 1qjz n LYS 76 N 1.30 0.33 -3.15 0.00 5.02 -0.75 -2.05 118.16 118.86 1qjz n LYS 76 Ca -0.22 -1.50 0.05 0.00 -2.02 0.00 0.00 58.31 54.62 1qjz n LYS 76 Cb 0.56 1.39 -0.01 0.00 -0.02 0.00 0.00 35.03 36.95 1qjz n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qjz s ALA 77 N -2.30 -2.78 0.21 7.82 0.00 -0.79 -2.82 121.76 121.10 1qjz s ALA 77 Ca 0.16 1.56 0.09 0.00 0.00 0.00 0.00 51.96 53.77 1qjz s ALA 77 Cb -0.00 -2.38 -0.04 0.00 0.00 0.00 0.00 23.12 20.69 1qjz s ALA 77 CO 0.12 -1.52 -0.05 0.96 0.00 0.00 0.00 175.76 175.27 1qjz s ILE 78 N 2.89 3.37 -0.21 0.00 -4.36 -0.56 -1.76 121.20 120.57 1qjz s ILE 78 Ca 0.13 -1.72 -0.00 0.00 -0.26 0.00 0.00 60.65 58.81 1qjz s ILE 78 Cb -0.12 -2.72 0.02 0.00 1.25 0.00 0.00 42.46 40.89 1qjz s ILE 78 CO -0.19 -0.21 -0.14 -0.76 0.24 0.00 0.00 174.94 173.88 1qjz s LEU 79 N -3.16 2.59 -0.56 0.37 1.43 -1.26 -1.50 118.68 116.60 1qjz s LEU 79 Ca 0.28 -0.72 -0.06 0.00 -1.03 0.00 0.00 54.13 52.59 1qjz s LEU 79 Cb -0.08 -1.57 0.14 0.00 0.03 0.00 0.00 46.19 44.72 1qjz s LEU 79 CO 0.17 -0.05 0.40 0.42 0.23 0.00 0.00 176.35 177.53 1qjz s THR 80 N 1.31 4.03 -0.10 5.49 -4.23 -1.26 -4.31 115.64 116.56 1qjz s THR 80 Ca 0.03 -2.34 -0.29 0.00 -1.18 0.00 0.00 61.69 57.90 1qjz s THR 80 Cb -0.15 -3.63 -0.06 0.00 1.34 0.00 0.00 72.50 70.00 1qjz s THR 80 CO -0.09 -0.83 1.88 -2.84 -0.54 0.00 0.00 174.62 172.21 1qjz s PRO 81 N 0.66 3.83 0.90 3.99 0.02 -1.26 -3.87 135.00 139.27 1qjz s PRO 81 Ca 0.12 2.17 -0.15 0.00 0.02 0.00 0.00 61.00 63.15 1qjz s PRO 81 Cb -0.21 -4.15 0.23 0.00 0.02 0.00 0.00 34.50 30.39 1qjz s PRO 81 CO -0.03 -1.28 0.57 0.25 -0.33 0.00 0.00 177.00 176.17 1qjz n THR 82 N 6.25 0.00 0.15 0.99 -2.24 -0.64 -4.81 114.28 113.99 1qjz n THR 82 Ca 0.21 -0.05 0.19 0.00 -2.27 0.00 0.00 64.05 62.13 1qjz n THR 82 Cb 0.43 -0.70 0.78 0.00 -2.10 0.00 0.00 70.33 68.74 1qjz n THR 82 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1qjz h ASP 83 N -2.88 0.00 0.00 3.42 3.58 -1.90 -3.41 116.42 115.23 1qjz h ASP 83 Ca -0.25 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.20 1qjz h ASP 83 Cb 0.82 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.87 1qjz h ASP 83 CO 0.15 0.00 0.00 0.18 -2.88 0.00 0.00 179.24 176.69 1qjz n LEU 84 N -3.68 0.00 0.00 2.28 7.99 -1.26 -4.37 117.00 117.96 1qjz n LEU 84 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.05 1qjz n LEU 84 Cb 0.50 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.81 1qjz n LEU 84 CO 0.26 -0.01 0.00 0.00 -1.51 0.00 0.00 177.39 176.13 1qjz n ALA 85 N -3.00 0.00 -0.05 -1.18 0.00 -1.25 -4.71 120.51 110.33 1qjz n ALA 85 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1qjz n ALA 85 Cb 0.00 -0.15 -0.06 0.00 0.00 0.00 0.00 19.45 19.24 1qjz n ALA 85 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1qjz h VAL 86 N 0.00 1.28 0.00 0.00 2.07 -1.86 -2.23 116.25 115.50 1qjz h VAL 86 Ca 0.00 -1.86 0.00 0.00 0.82 0.00 0.00 66.70 65.66 1qjz h VAL 86 Cb 0.00 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1qjz h VAL 86 CO 0.00 0.60 -1.74 -1.20 0.02 0.00 0.00 177.57 175.24 1qjz n SER 87 N -3.98 0.61 -3.36 0.57 7.64 -1.26 -4.64 113.62 109.19 1qjz n SER 87 Ca -0.06 -0.13 -0.26 0.00 1.01 0.00 0.00 58.87 59.43 1qjz n SER 87 Cb 0.69 1.76 -0.08 0.00 -1.01 0.00 0.00 64.21 65.57 1qjz n SER 87 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1qjz n ASN 88 N -2.07 1.57 -4.46 6.43 5.03 -1.24 -5.12 115.26 115.40 1qjz n ASN 88 Ca -0.03 -2.96 -0.29 0.00 0.87 0.00 0.00 54.58 52.18 1qjz n ASN 88 Cb 0.48 -0.65 0.24 0.00 -1.02 0.00 0.00 39.78 38.83 1qjz n ASN 88 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 1qjz n PRO 89 N 1.45 -2.21 -3.64 3.52 -0.04 -0.84 -3.85 135.00 129.40 1qjz n PRO 89 Ca 0.25 -0.61 -0.10 0.00 -0.04 0.00 0.00 63.50 63.00 1qjz n PRO 89 Cb 0.47 -2.12 -0.07 0.00 -0.04 0.00 0.00 33.50 31.74 1qjz n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1qjz s LEU 90 N -6.37 -0.75 -0.33 1.53 2.96 -1.26 -4.91 118.68 109.56 1qjz s LEU 90 Ca 0.67 1.32 -0.22 0.00 -0.22 0.00 0.00 54.13 55.68 1qjz s LEU 90 Cb -0.24 2.28 -0.00 0.00 0.50 0.00 0.00 46.19 48.73 1qjz s LEU 90 CO 0.65 -0.22 0.72 0.42 -1.32 0.00 0.00 176.35 176.60 1qjz s THR 91 N 0.88 4.84 -0.23 3.68 -4.23 -1.26 -3.56 115.64 115.75 1qjz s THR 91 Ca -0.04 0.93 -0.12 0.00 -1.18 0.00 0.00 61.69 61.28 1qjz s THR 91 Cb -0.05 -4.11 -0.05 0.00 1.34 0.00 0.00 72.50 69.64 1qjz s THR 91 CO -0.09 -0.27 0.23 -0.69 -0.54 0.00 0.00 174.62 173.27 1qjz s VAL 92 N 2.85 5.31 -0.15 2.29 1.01 -0.97 -3.97 120.40 126.76 1qjz s VAL 92 Ca 0.29 0.34 -0.08 0.00 0.00 0.00 0.00 61.98 62.53 1qjz s VAL 92 Cb -0.14 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1qjz s VAL 92 CO 0.14 0.31 0.13 -0.31 0.00 0.00 0.00 175.10 175.36 1qjz s TYR 93 N 1.20 3.50 0.06 5.22 1.51 0.11 -3.05 117.35 125.90 1qjz s TYR 93 Ca 0.11 0.42 0.01 0.00 -1.01 0.00 0.00 57.07 56.60 1qjz s TYR 93 Cb -0.14 -2.01 -0.03 0.00 -0.11 0.00 0.00 41.96 39.66 1qjz s TYR 93 CO 0.06 0.55 -0.05 -0.51 -1.11 0.00 0.00 175.55 174.48 1qjz s LEU 94 N -0.49 2.41 -0.30 -1.29 1.43 -1.14 -3.05 118.68 116.26 1qjz s LEU 94 Ca 0.12 -0.83 -0.25 0.00 -1.03 0.00 0.00 54.13 52.13 1qjz s LEU 94 Cb -0.12 0.00 0.18 0.00 0.03 0.00 0.00 46.19 46.29 1qjz s LEU 94 CO 0.02 -0.42 1.39 0.00 0.23 0.00 0.00 176.35 177.57 1qjz s ALA 95 N -2.91 -2.19 -0.13 4.21 0.00 -1.24 -0.64 121.76 118.86 1qjz s ALA 95 Ca 0.02 1.71 -0.06 0.00 0.00 0.00 0.00 51.96 53.62 1qjz s ALA 95 Cb 0.01 -1.73 -0.04 0.00 0.00 0.00 0.00 23.12 21.35 1qjz s ALA 95 CO -0.04 -0.12 0.11 -1.58 0.00 0.00 0.00 175.76 174.12 1qjz s TRP 96 N 0.01 3.47 -0.22 0.00 0.52 -1.26 -1.98 118.94 119.49 1qjz s TRP 96 Ca 0.07 0.41 -0.27 0.00 0.02 0.00 0.00 56.10 56.32 1qjz s TRP 96 Cb -0.05 -1.95 0.12 0.00 -1.15 0.00 0.00 33.47 30.44 1qjz s TRP 96 CO -0.14 0.59 0.99 0.54 0.02 0.00 0.00 176.95 178.95 1qjz s VAL 97 N -0.73 0.00 1.23 4.03 0.11 -0.55 -4.89 120.40 119.59 1qjz s VAL 97 Ca 0.13 0.00 -0.16 0.00 -2.93 0.00 0.00 61.98 59.02 1qjz s VAL 97 Cb -0.12 -1.00 0.27 0.00 -1.53 0.00 0.00 36.38 34.01 1qjz s VAL 97 CO 0.03 0.00 0.74 -0.81 -3.33 0.00 0.00 175.10 171.72 1qjz n PRO 98 N 1.52 -2.87 0.15 1.54 -0.04 -1.26 -1.16 135.00 132.89 1qjz n PRO 98 Ca -0.12 -0.82 0.07 0.00 -0.04 0.00 0.00 63.50 62.59 1qjz n PRO 98 Cb 0.57 -1.98 0.57 0.00 -0.04 0.00 0.00 33.50 32.62 1qjz n PRO 98 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qjz h ALA 99 N -2.80 1.93 -3.00 0.55 0.00 0.55 -3.43 119.26 113.06 1qjz h ALA 99 Ca -0.56 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1qjz h ALA 99 Cb 1.31 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1qjz h ALA 99 CO 0.41 0.06 0.00 -1.71 0.00 0.00 0.00 179.25 178.01 1qjz n ASN 100 N -4.51 -0.13 -1.47 0.00 5.15 -1.11 -4.96 115.26 108.23 1qjz n ASN 100 Ca -0.00 -0.25 0.00 0.00 -0.60 0.00 0.00 54.58 53.73 1qjz n ASN 100 Cb 0.11 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.36 1qjz n ASN 100 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1qjz n SER 101 N -0.93 -7.83 -0.67 1.20 7.64 -1.26 -4.58 113.62 107.18 1qjz n SER 101 Ca 0.00 1.05 0.00 0.00 1.01 0.00 0.00 58.87 60.93 1qjz n SER 101 Cb 0.00 -3.75 0.00 0.00 -1.01 0.00 0.00 64.21 59.45 1qjz n SER 101 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1qjz n PRO 102 N 0.33 0.61 -1.59 1.43 -0.04 -1.26 -4.79 135.00 129.69 1qjz n PRO 102 Ca 0.00 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.19 1qjz n PRO 102 Cb 0.00 -1.27 -0.05 0.00 -0.04 0.00 0.00 33.50 32.15 1qjz n PRO 102 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qjz s ALA 103 N -0.53 1.25 0.39 0.55 0.00 -1.26 -4.93 121.76 117.23 1qjz s ALA 103 Ca 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 51.96 51.57 1qjz s ALA 103 Cb 0.00 -4.45 -0.04 0.00 0.00 0.00 0.00 23.12 18.64 1qjz s ALA 103 CO 0.00 -5.07 0.64 0.95 0.00 0.00 0.00 175.76 172.27 1qjz s THR 104 N 13.19 5.03 0.42 0.00 -4.23 -1.26 -4.94 115.64 123.84 1qjz s THR 104 Ca 0.94 -0.19 0.19 0.00 -1.18 0.00 0.00 61.69 61.45 1qjz s THR 104 Cb -0.15 -3.86 0.40 0.00 1.34 0.00 0.00 72.50 70.23 1qjz s THR 104 CO 0.18 -0.65 1.82 -0.65 -0.54 0.00 0.00 174.62 174.77 1qjz h PRO 105 N 0.61 0.37 0.00 3.99 0.11 -1.92 0.36 132.00 135.52 1qjz h PRO 105 Ca -0.49 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.46 1qjz h PRO 105 Cb 1.21 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1qjz h PRO 105 CO 0.62 0.24 -0.68 1.79 -0.21 0.00 0.00 178.00 179.76 1qjz h THR 106 N 0.38 1.43 0.00 -1.15 1.35 -1.93 -2.78 112.91 110.20 1qjz h THR 106 Ca 0.53 -2.37 0.00 0.00 -0.55 0.00 0.00 66.41 64.01 1qjz h THR 106 Cb 1.38 2.30 0.00 0.00 -1.73 0.00 0.00 68.15 70.10 1qjz h THR 106 CO -0.21 0.67 0.00 0.00 -0.25 0.00 0.00 175.52 175.72 1qjz n GLN 107 N -3.64 0.72 -0.84 4.72 3.00 0.13 -4.86 117.38 116.60 1qjz n GLN 107 Ca -0.01 0.01 -0.33 0.00 -0.01 0.00 0.00 57.00 56.66 1qjz n GLN 107 Cb 0.69 -1.50 0.13 0.00 0.00 0.00 0.00 30.24 29.55 1qjz n GLN 107 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.06 178.57 1qjz n ILE 108 N -1.04 0.40 0.00 5.09 0.13 -1.04 -2.18 119.36 120.72 1qjz n ILE 108 Ca 0.18 -0.17 0.00 0.00 -1.10 0.00 0.00 62.75 61.66 1qjz n ILE 108 Cb 0.10 -0.79 0.00 0.00 -0.84 0.00 0.00 39.64 38.11 1qjz n ILE 108 CO 0.00 0.00 0.00 0.18 2.80 0.00 0.00 176.55 179.53 1qjz n LEU 109 N -2.14 0.00 0.02 9.51 4.77 -1.26 -4.52 117.00 123.38 1qjz n LEU 109 Ca 0.09 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.20 1qjz n LEU 109 Cb 0.52 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 42.12 1qjz n LEU 109 CO 0.50 0.00 0.84 0.54 -1.33 0.00 0.00 177.39 177.94 1qjz n ARG 110 N 0.00 0.05 -4.29 3.23 1.74 -0.93 -4.63 116.66 111.83 1qjz n ARG 110 Ca 0.00 0.04 -0.34 0.00 -0.77 0.00 0.00 57.85 56.78 1qjz n ARG 110 Cb 0.00 -1.55 -0.09 0.00 -1.02 0.00 0.00 32.46 29.80 1qjz n ARG 110 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1qjz s VAL 111 N -3.02 4.29 0.15 1.55 1.01 -1.21 -5.06 120.40 118.11 1qjz s VAL 111 Ca 0.13 -0.44 -0.34 0.00 0.00 0.00 0.00 61.98 61.33 1qjz s VAL 111 Cb 0.17 -2.88 -0.16 0.00 0.00 0.00 0.00 36.38 33.52 1qjz s VAL 111 CO 0.58 0.46 1.28 0.00 0.00 0.00 0.00 175.10 177.42 1qjz n TYR 112 N 1.65 1.54 -0.34 5.22 9.36 -1.26 -1.51 117.16 131.83 1qjz n TYR 112 Ca -0.16 0.60 0.00 0.00 3.32 0.00 0.00 57.90 61.67 1qjz n TYR 112 Cb 0.53 -2.34 0.00 0.00 -0.63 0.00 0.00 39.34 36.90 1qjz n TYR 112 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1qjz n GLY 113 N 2.32 0.82 3.66 2.98 0.00 -1.26 -4.59 105.19 109.12 1qjz n GLY 113 Ca 0.16 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1qjz n GLY 113 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qjz s GLY 114 N -2.11 1.54 0.30 -0.02 0.00 -0.57 -4.24 107.32 102.22 1qjz s GLY 114 Ca 0.00 0.99 0.10 0.00 0.00 0.00 0.00 44.72 45.81 1qjz s GLY 114 CO 0.00 3.06 -0.08 1.20 0.00 0.00 0.00 173.10 177.28 1qjz s GLN 115 N 3.97 1.96 -0.30 2.90 -1.52 0.18 -4.82 119.66 122.03 1qjz s GLN 115 Ca 0.75 -1.68 -0.13 0.00 -1.95 0.00 0.00 55.36 52.35 1qjz s GLN 115 Cb -0.35 -1.91 0.18 0.00 -0.22 0.00 0.00 33.01 30.71 1qjz s GLN 115 CO 0.31 0.27 1.03 -1.12 -0.25 0.00 0.00 175.29 175.53 1qjz s SER 116 N -3.62 -0.51 0.38 5.90 0.01 -1.26 -2.87 113.70 111.73 1qjz s SER 116 Ca 0.32 0.35 0.04 0.00 1.31 0.00 0.00 55.95 57.97 1qjz s SER 116 Cb -0.03 1.44 -0.04 0.00 0.21 0.00 0.00 66.02 67.60 1qjz s SER 116 CO 0.18 -0.10 0.11 -0.36 0.41 0.00 0.00 173.24 173.48 1qjz s PHE 117 N 2.89 1.81 0.50 2.43 0.40 -1.17 -5.00 117.98 119.84 1qjz s PHE 117 Ca 0.00 -1.19 0.01 0.00 -0.60 0.00 0.00 56.93 55.14 1qjz s PHE 117 Cb -0.10 -1.18 0.01 0.00 0.51 0.00 0.00 43.02 42.26 1qjz s PHE 117 CO -0.12 -0.22 0.05 0.28 0.70 0.00 0.00 175.22 175.91 1qjz n VAL 118 N -0.83 0.00 -4.23 -0.44 0.31 -1.26 -2.28 118.33 109.59 1qjz n VAL 118 Ca -0.05 -2.30 -0.16 0.00 -0.01 0.00 0.00 64.34 61.82 1qjz n VAL 118 Cb 0.65 0.40 -0.11 0.00 -0.91 0.00 0.00 33.84 33.88 1qjz n VAL 118 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1qjz s LEU 119 N 0.00 2.43 0.00 7.52 1.43 -1.23 -4.59 118.68 124.24 1qjz s LEU 119 Ca 0.04 -0.85 0.00 0.00 -1.03 0.00 0.00 54.13 52.28 1qjz s LEU 119 Cb -0.00 -0.45 0.00 0.00 0.03 0.00 0.00 46.19 45.76 1qjz s LEU 119 CO 0.02 -0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.00 1qjz n GLY 120 N 0.38 0.97 0.00 -3.19 0.00 -1.24 -4.18 105.19 97.92 1qjz n GLY 120 Ca -0.14 -1.25 0.06 0.00 0.00 0.00 0.00 46.02 44.68 1qjz n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qjz n GLY 121 N 0.00 -0.83 3.48 -0.02 0.00 -1.26 -4.47 105.19 102.09 1qjz n GLY 121 Ca 0.00 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 1qjz n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qjz s ALA 122 N -2.89 3.44 0.00 4.61 0.00 -1.26 -4.92 121.76 120.75 1qjz s ALA 122 Ca 0.07 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.50 1qjz s ALA 122 Cb 0.08 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1qjz s ALA 122 CO 0.20 -1.51 0.00 -0.89 0.00 0.00 0.00 175.76 173.56 1qjz n ILE 123 N 5.36 0.00 -2.77 0.00 2.08 -1.26 -4.24 119.36 118.53 1qjz n ILE 123 Ca -0.08 0.00 -0.01 0.00 0.56 0.00 0.00 62.75 63.21 1qjz n ILE 123 Cb 0.47 0.00 0.02 0.00 -0.75 0.00 0.00 39.64 39.38 1qjz n ILE 123 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1qjz s SER 124 N 0.00 -0.60 0.00 4.38 1.04 -1.26 -4.74 113.70 112.52 1qjz s SER 124 Ca 0.00 -0.53 0.00 0.00 0.48 0.00 0.00 55.95 55.90 1qjz s SER 124 Cb 0.00 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.89 1qjz s SER 124 CO 0.00 -0.04 0.00 0.00 0.98 0.00 0.00 173.24 174.18 1qjz n ALA 125 N 3.18 0.00 -1.40 5.32 0.00 -1.26 -4.51 120.51 121.83 1qjz n ALA 125 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.22 1qjz n ALA 125 Cb 0.62 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.14 1qjz n ALA 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qjz s ALA 126 N -1.00 2.38 0.00 0.00 0.00 -1.26 -3.02 121.76 118.87 1qjz s ALA 126 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.37 1qjz s ALA 126 Cb 0.00 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.83 1qjz s ALA 126 CO 0.00 -1.48 0.00 1.63 0.00 0.00 0.00 175.76 175.91 1qjz n LYS 127 N -2.91 0.00 -1.20 0.00 5.02 -1.26 -4.83 118.16 112.97 1qjz n LYS 127 Ca 0.10 0.00 0.16 0.00 -2.02 0.00 0.00 58.31 56.54 1qjz n LYS 127 Cb 0.52 -2.40 -0.04 0.00 -0.02 0.00 0.00 35.03 33.09 1qjz n LYS 127 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1qjz n THR 128 N -1.75 0.00 -0.05 -0.18 -2.24 -1.17 -4.59 114.28 104.30 1qjz n THR 128 Ca 0.00 0.12 -0.14 0.00 -2.27 0.00 0.00 64.05 61.75 1qjz n THR 128 Cb 0.00 -0.52 -0.13 0.00 -2.10 0.00 0.00 70.33 67.59 1qjz n THR 128 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1qjz h ILE 129 N -1.16 1.71 -5.38 2.28 5.03 -1.88 -3.48 117.51 114.63 1qjz h ILE 129 Ca -0.00 -2.17 0.00 0.00 -0.12 0.00 0.00 64.86 62.57 1qjz h ILE 129 Cb 1.28 3.18 -0.01 0.00 -3.03 0.00 0.00 36.82 38.25 1qjz h ILE 129 CO 0.02 0.57 -1.02 1.21 -0.68 0.00 0.00 178.15 178.25 1qjz n GLU 130 N -4.62 -2.93 -3.94 2.37 2.13 -1.26 -4.99 120.64 107.41 1qjz n GLU 130 Ca -0.10 2.43 -0.32 0.00 0.66 0.00 0.00 57.16 59.84 1qjz n GLU 130 Cb 0.46 -4.50 -0.14 0.00 0.27 0.00 0.00 31.44 27.54 1qjz n GLU 130 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1qjz s VAL 131 N -1.46 2.65 0.96 6.31 1.01 -0.72 -4.97 120.40 124.18 1qjz s VAL 131 Ca -0.01 -2.78 -0.12 0.00 0.00 0.00 0.00 61.98 59.07 1qjz s VAL 131 Cb 0.00 -2.87 0.17 0.00 0.00 0.00 0.00 36.38 33.68 1qjz s VAL 131 CO 0.63 -0.72 1.09 -2.16 0.00 0.00 0.00 175.10 173.94 1qjz s PRO 132 N 0.34 0.74 -0.17 2.72 0.04 -1.26 -1.89 135.00 135.52 1qjz s PRO 132 Ca 0.14 0.95 -0.00 0.00 0.04 0.00 0.00 61.00 62.13 1qjz s PRO 132 Cb -0.22 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1qjz s PRO 132 CO -0.04 -2.64 -0.15 -1.17 0.04 0.00 0.00 177.00 173.04 1qjz s LEU 133 N -6.51 2.43 -0.24 -3.56 2.96 -0.87 -4.90 118.68 108.00 1qjz s LEU 133 Ca 0.65 -0.51 -0.29 0.00 -0.22 0.00 0.00 54.13 53.76 1qjz s LEU 133 Cb -0.20 -1.56 -0.01 0.00 0.50 0.00 0.00 46.19 44.92 1qjz s LEU 133 CO 0.59 0.05 1.29 0.21 -1.32 0.00 0.00 176.35 177.16 1qjz s ASN 134 N 1.03 6.79 0.31 3.68 3.84 -1.26 -4.68 114.94 124.66 1qjz s ASN 134 Ca -0.01 1.43 0.24 0.00 0.21 0.00 0.00 52.86 54.73 1qjz s ASN 134 Cb -0.15 -2.54 1.10 0.00 -0.55 0.00 0.00 41.25 39.12 1qjz s ASN 134 CO -0.04 -0.94 1.72 -0.07 -2.79 0.00 0.00 177.10 174.99 1qjz h LEU 135 N 10.37 0.00 -0.65 3.21 3.38 -1.98 -1.19 115.31 128.45 1qjz h LEU 135 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1qjz h LEU 135 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1qjz h LEU 135 CO 1.00 0.00 0.00 0.47 0.09 0.00 0.00 178.44 180.00 1qjz n ASP 136 N -2.31 0.95 -0.01 -0.43 9.92 -1.26 -3.25 116.55 120.17 1qjz n ASP 136 Ca 0.01 -1.95 0.00 0.00 -0.53 0.00 0.00 54.79 52.32 1qjz n ASP 136 Cb 0.16 -0.11 -0.00 0.00 -0.64 0.00 0.00 41.12 40.52 1qjz n ASP 136 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1qjz n SER 137 N -0.00 0.19 0.00 -2.24 7.64 -0.45 -5.07 113.62 113.68 1qjz n SER 137 Ca 0.07 -0.59 0.00 0.00 1.01 0.00 0.00 58.87 59.36 1qjz n SER 137 Cb 0.16 0.86 0.00 0.00 -1.01 0.00 0.00 64.21 64.22 1qjz n SER 137 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1qjz n VAL 138 N -0.87 0.00 -5.01 0.44 0.24 -1.20 -4.17 118.33 107.76 1qjz n VAL 138 Ca 0.00 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.03 1qjz n VAL 138 Cb 0.01 0.00 -0.16 0.00 -1.47 0.00 0.00 33.84 32.23 1qjz n VAL 138 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1qjz s ASN 139 N 1.17 2.46 0.12 -1.34 3.04 0.89 -4.96 114.94 116.31 1qjz s ASN 139 Ca 0.00 -0.38 -0.07 0.00 0.04 0.00 0.00 52.86 52.45 1qjz s ASN 139 Cb 0.00 -0.27 -0.13 0.00 -1.54 0.00 0.00 41.25 39.31 1qjz s ASN 139 CO 0.00 0.25 1.28 0.03 -3.04 0.00 0.00 177.10 175.62 1qjz h ARG 140 N 5.59 0.48 -5.33 0.43 3.08 -1.86 -3.39 114.38 113.38 1qjz h ARG 140 Ca -0.39 -0.52 -0.05 0.00 0.07 0.00 0.00 59.98 59.09 1qjz h ARG 140 Cb 1.14 0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.33 1qjz h ARG 140 CO 0.48 1.16 0.23 -1.33 -1.07 0.00 0.00 179.97 179.44 1qjz n MET 141 N -3.77 0.54 0.18 0.04 2.81 -1.26 -0.64 117.12 115.02 1qjz n MET 141 Ca -0.08 -0.75 0.02 0.00 -1.81 0.00 0.00 57.70 55.08 1qjz n MET 141 Cb 0.85 -3.49 0.35 0.00 -0.71 0.00 0.00 33.22 30.22 1qjz n MET 141 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1qjz h LEU 142 N 21.64 0.00 -7.00 4.03 7.12 -0.70 -3.44 115.31 136.96 1qjz h LEU 142 Ca -0.01 -0.00 0.05 0.00 0.13 0.00 0.00 57.88 58.05 1qjz h LEU 142 Cb 1.02 -0.00 -0.23 0.00 -0.53 0.00 0.00 40.66 40.92 1qjz h LEU 142 CO 1.06 0.39 0.16 -0.75 -0.13 0.00 0.00 178.44 179.16 1qjz s LYS 143 N -4.16 0.60 0.29 1.25 2.20 -1.16 -4.89 119.74 113.87 1qjz s LYS 143 Ca -0.03 1.01 -0.03 0.00 -0.36 0.00 0.00 55.97 56.56 1qjz s LYS 143 Cb 0.14 0.14 0.01 0.00 -1.51 0.00 0.00 37.83 36.61 1qjz s LYS 143 CO 0.73 -0.12 0.44 -3.47 -0.36 0.00 0.00 175.35 172.56 1qjz n ASP 144 N 3.96 -1.23 0.32 1.43 2.03 -1.25 -0.68 116.55 121.13 1qjz n ASP 144 Ca -0.19 -2.48 0.21 0.00 0.52 0.00 0.00 54.79 52.85 1qjz n ASP 144 Cb 0.58 2.23 1.05 0.00 -0.72 0.00 0.00 41.12 44.26 1qjz n ASP 144 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1qjz h SER 145 N 1.59 0.00 -0.77 1.67 4.64 -2.02 -3.43 113.55 115.23 1qjz h SER 145 Ca -0.23 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.55 1qjz h SER 145 Cb 0.96 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.03 1qjz h SER 145 CO 0.30 0.00 -0.25 -0.69 -0.87 0.00 0.00 176.83 175.33 1qjz s VAL 146 N -4.02 1.95 -0.40 0.95 1.01 -1.26 -5.10 120.40 113.53 1qjz s VAL 146 Ca -0.03 -1.31 -0.03 0.00 0.00 0.00 0.00 61.98 60.61 1qjz s VAL 146 Cb 0.12 -2.26 0.10 0.00 0.00 0.00 0.00 36.38 34.34 1qjz s VAL 146 CO 0.46 0.00 0.19 -0.89 0.00 0.00 0.00 175.10 174.85 1qjz s THR 147 N -2.70 3.30 0.05 3.92 2.01 -1.26 -5.00 115.64 115.96 1qjz s THR 147 Ca 0.45 -1.96 -0.23 0.00 0.31 0.00 0.00 61.69 60.25 1qjz s THR 147 Cb -0.04 -3.22 -0.06 0.00 0.01 0.00 0.00 72.50 69.20 1qjz s THR 147 CO 0.28 -0.63 0.69 -0.31 -0.69 0.00 0.00 174.62 173.96 1qjz s TYR 148 N 1.16 3.76 -0.60 4.92 1.51 -1.26 -4.96 117.35 121.88 1qjz s TYR 148 Ca 0.07 1.39 0.16 0.00 -1.01 0.00 0.00 57.07 57.67 1qjz s TYR 148 Cb -0.22 -2.70 -0.19 0.00 -0.11 0.00 0.00 41.96 38.73 1qjz s TYR 148 CO -0.04 0.38 0.61 0.25 -1.11 0.00 0.00 175.55 175.64 1qjz n THR 149 N 2.45 0.00 -0.70 -0.71 -2.24 -1.26 -4.44 114.28 107.38 1qjz n THR 149 Ca -0.05 -0.18 -0.18 0.00 -2.27 0.00 0.00 64.05 61.37 1qjz n THR 149 Cb 0.50 0.82 0.07 0.00 -2.10 0.00 0.00 70.33 69.62 1qjz n THR 149 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1qjz n ASP 150 N -1.52 5.27 -4.82 3.42 5.75 -1.26 -2.76 116.55 120.63 1qjz n ASP 150 Ca 0.02 -3.11 -0.33 0.00 -0.01 0.00 0.00 54.79 51.36 1qjz n ASP 150 Cb 0.28 -0.89 -0.06 0.00 -1.03 0.00 0.00 41.12 39.42 1qjz n ASP 150 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1qjz s THR 151 N -2.48 4.42 0.80 2.12 -4.23 -1.26 -0.08 115.64 114.94 1qjz s THR 151 Ca 0.37 1.44 -0.15 0.00 -1.18 0.00 0.00 61.69 62.17 1qjz s THR 151 Cb 0.30 -3.62 0.01 0.00 1.34 0.00 0.00 72.50 70.53 1qjz s THR 151 CO 0.03 -0.38 0.69 -2.65 -0.54 0.00 0.00 174.62 171.77 1qjz n PRO 152 N -0.79 0.13 -3.52 3.99 -0.02 -1.26 0.87 135.00 134.41 1qjz n PRO 152 Ca 0.07 0.10 -0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1qjz n PRO 152 Cb 0.54 -2.01 -0.05 0.00 -0.02 0.00 0.00 33.50 31.96 1qjz n PRO 152 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1qjz s LYS 153 N -3.36 0.38 0.27 -0.52 1.02 -0.31 -1.34 119.74 115.88 1qjz s LYS 153 Ca 0.66 0.83 -0.02 0.00 0.02 0.00 0.00 55.97 57.45 1qjz s LYS 153 Cb -0.30 0.38 -0.04 0.00 -0.52 0.00 0.00 37.83 37.34 1qjz s LYS 153 CO 0.58 -0.11 0.50 -1.17 -0.92 0.00 0.00 175.35 174.23 1qjz s LEU 154 N 2.14 4.11 0.12 3.17 2.96 -0.59 -1.48 118.68 129.11 1qjz s LEU 154 Ca -0.05 0.54 0.09 0.00 -0.22 0.00 0.00 54.13 54.49 1qjz s LEU 154 Cb -0.06 -3.35 -0.04 0.00 0.50 0.00 0.00 46.19 43.24 1qjz s LEU 154 CO -0.17 -0.17 -0.22 -0.76 -1.32 0.00 0.00 176.35 173.71 1qjz s LEU 155 N -3.66 2.33 -0.06 -0.68 2.01 -0.84 -3.14 118.68 114.65 1qjz s LEU 155 Ca 0.41 -0.74 -0.11 0.00 0.01 0.00 0.00 54.13 53.70 1qjz s LEU 155 Cb -0.11 -0.97 0.02 0.00 0.01 0.00 0.00 46.19 45.15 1qjz s LEU 155 CO 0.31 0.08 0.27 0.00 1.01 0.00 0.00 176.35 178.02 1qjz s ALA 156 N -1.30 -0.67 0.01 4.21 0.00 -1.18 -3.63 121.76 119.19 1qjz s ALA 156 Ca 0.10 0.48 -0.23 0.00 0.00 0.00 0.00 51.96 52.32 1qjz s ALA 156 Cb -0.09 -0.18 0.05 0.00 0.00 0.00 0.00 23.12 22.89 1qjz s ALA 156 CO 0.05 -0.19 0.51 -0.47 0.00 0.00 0.00 175.76 175.66 1qjz s TYR 157 N -0.61 -0.42 0.00 0.00 5.04 -1.17 -3.23 117.35 116.95 1qjz s TYR 157 Ca -0.07 0.58 0.00 0.00 -2.44 0.00 0.00 57.07 55.14 1qjz s TYR 157 Cb -0.04 0.29 0.00 0.00 0.35 0.00 0.00 41.96 42.56 1qjz s TYR 157 CO 0.02 -0.57 0.00 -1.13 -1.34 0.00 0.00 175.55 172.53 1qjz n SER 158 N 0.75 0.00 0.00 4.32 3.41 -0.75 -0.71 113.62 120.64 1qjz n SER 158 Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1qjz n SER 158 Cb 0.58 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 1qjz n SER 158 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1qjz n ARG 159 N -0.44 0.00 -2.59 4.33 0.00 -1.25 -4.57 116.66 112.15 1qjz n ARG 159 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.85 57.79 1qjz n ARG 159 Cb 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 32.46 32.38 1qjz n ARG 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1qjz n ALA 160 N 0.00 -3.73 -1.00 5.13 0.00 -1.26 -3.43 120.51 116.21 1qjz n ALA 160 Ca 0.00 2.50 0.00 0.00 0.00 0.00 0.00 53.44 55.94 1qjz n ALA 160 Cb 0.00 -4.88 0.00 0.00 0.00 0.00 0.00 19.45 14.57 1qjz n ALA 160 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1qjz n PRO 161 N 1.73 0.00 -2.58 0.00 -0.04 -1.26 -4.68 135.00 128.17 1qjz n PRO 161 Ca -0.44 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.60 1qjz n PRO 161 Cb 0.67 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.14 1qjz n PRO 161 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1qjz n THR 162 N 0.00 4.63 -3.25 0.52 -1.04 -1.26 -4.79 114.28 109.09 1qjz n THR 162 Ca 0.00 -4.87 -0.25 0.00 -2.04 0.00 0.00 64.05 56.88 1qjz n THR 162 Cb 0.00 -2.29 -0.07 0.00 -1.82 0.00 0.00 70.33 66.16 1qjz n THR 162 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1qjz n ASN 163 N 3.21 2.77 -1.75 8.00 4.13 -1.26 -4.94 115.26 125.42 1qjz n ASN 163 Ca 0.35 -3.27 -0.10 0.00 1.68 0.00 0.00 54.58 53.24 1qjz n ASN 163 Cb 0.36 -0.64 0.02 0.00 -1.54 0.00 0.00 39.78 37.98 1qjz n ASN 163 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1qjz n PRO 164 N 0.71 1.50 -0.04 3.52 -0.04 -1.26 -4.25 135.00 135.14 1qjz n PRO 164 Ca 0.28 -0.95 0.01 0.00 -0.04 0.00 0.00 63.50 62.80 1qjz n PRO 164 Cb 0.46 -1.38 0.03 0.00 -0.04 0.00 0.00 33.50 32.57 1qjz n PRO 164 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1qjz n SER 165 N 0.84 0.40 0.00 3.54 7.64 -1.26 -4.93 113.62 119.85 1qjz n SER 165 Ca 0.18 -2.00 0.00 0.00 1.01 0.00 0.00 58.87 58.06 1qjz n SER 165 Cb 0.55 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 1qjz n SER 165 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1qjz n LYS 166 N -0.29 0.00 -1.56 1.43 4.81 -1.26 -4.83 118.16 116.46 1qjz n LYS 166 Ca 0.02 0.00 -0.50 0.00 -0.87 0.00 0.00 58.31 56.96 1qjz n LYS 166 Cb 0.07 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.07 1qjz n LYS 166 CO 0.00 0.00 0.00 1.51 1.17 0.00 0.00 177.40 180.08 1qjz n ILE 167 N 0.00 0.75 -1.39 3.15 3.06 -1.26 -4.33 119.36 119.33 1qjz n ILE 167 Ca 0.00 -0.19 -0.34 0.00 -2.50 0.00 0.00 62.75 59.72 1qjz n ILE 167 Cb 0.00 -0.68 0.10 0.00 0.54 0.00 0.00 39.64 39.60 1qjz n ILE 167 CO 0.00 0.00 0.00 -2.16 -2.50 0.00 0.00 176.55 171.89 1qjz s PRO 168 N -0.26 2.08 -0.00 9.51 0.04 -1.26 -4.48 135.00 140.63 1qjz s PRO 168 Ca 0.76 1.76 0.21 0.00 0.04 0.00 0.00 61.00 63.78 1qjz s PRO 168 Cb -0.92 -1.83 -0.19 0.00 0.04 0.00 0.00 34.50 31.60 1qjz s PRO 168 CO 0.52 -1.88 0.89 0.25 0.04 0.00 0.00 177.00 176.82 1qjz n THR 169 N -2.79 0.01 -2.56 1.26 -2.24 -1.15 -4.68 114.28 102.13 1qjz n THR 169 Ca 0.13 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1qjz n THR 169 Cb 0.50 0.82 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 1qjz n THR 169 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qjz n ALA 170 N -1.60 0.00 0.00 6.98 0.00 -0.74 -1.62 120.51 123.53 1qjz n ALA 170 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1qjz n ALA 170 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1qjz n ALA 170 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1qjz n SER 171 N 0.00 0.00 -3.01 0.00 7.64 -1.25 -4.64 113.62 112.36 1qjz n SER 171 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 1qjz n SER 171 Cb 0.00 0.25 0.02 0.00 -1.01 0.00 0.00 64.21 63.47 1qjz n SER 171 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1qjz n ILE 172 N -2.23 -9.05 -4.47 0.44 5.41 -1.24 -3.92 119.36 104.31 1qjz n ILE 172 Ca 0.00 0.79 -0.34 0.00 1.00 0.00 0.00 62.75 64.20 1qjz n ILE 172 Cb 0.00 -6.15 -0.11 0.00 -0.71 0.00 0.00 39.64 32.67 1qjz n ILE 172 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 1qjz s GLN 173 N -2.38 3.16 -0.42 0.38 1.11 -0.56 -3.90 119.66 117.06 1qjz s GLN 173 Ca 0.24 -0.49 -0.09 0.00 0.01 0.00 0.00 55.36 55.02 1qjz s GLN 173 Cb -0.05 -2.77 0.07 0.00 -1.01 0.00 0.00 33.01 29.25 1qjz s GLN 173 CO 0.76 0.52 0.26 0.96 0.01 0.00 0.00 175.29 177.80 1qjz s ILE 174 N -0.40 4.28 0.00 1.08 -4.36 0.56 -1.49 121.20 120.87 1qjz s ILE 174 Ca 0.07 -1.35 0.00 0.00 -0.26 0.00 0.00 60.65 59.11 1qjz s ILE 174 Cb -0.12 -3.60 0.00 0.00 1.25 0.00 0.00 42.46 39.99 1qjz s ILE 174 CO 0.02 -0.49 0.00 -1.20 0.24 0.00 0.00 174.94 173.52 1qjz n SER 175 N 4.93 0.00 0.00 4.36 7.64 -1.13 -4.00 113.62 125.43 1qjz n SER 175 Ca -0.10 -0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.73 1qjz n SER 175 Cb 0.43 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.63 1qjz n SER 175 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qjz n GLY 176 N 5.00 1.41 3.48 0.23 0.00 -1.12 -1.80 105.19 112.39 1qjz n GLY 176 Ca 0.00 -2.22 -0.24 0.00 0.00 0.00 0.00 46.02 43.56 1qjz n GLY 176 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qjz s ARG 177 N -1.29 1.68 -0.24 1.61 3.00 0.46 -1.05 118.95 123.13 1qjz s ARG 177 Ca 0.00 -1.84 -0.22 0.00 0.00 0.00 0.00 55.73 53.68 1qjz s ARG 177 Cb 0.00 -1.52 0.06 0.00 0.00 0.00 0.00 34.95 33.50 1qjz s ARG 177 CO 0.00 0.15 0.63 -1.50 0.00 0.00 0.00 175.30 174.58 1qjz s ILE 178 N -2.73 -0.00 0.01 1.52 2.07 -1.05 -2.51 121.20 118.51 1qjz s ILE 178 Ca 0.30 0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.45 1qjz s ILE 178 Cb 0.01 -0.88 -0.05 0.00 0.13 0.00 0.00 42.46 41.67 1qjz s ILE 178 CO 0.14 0.00 0.32 0.00 -1.91 0.00 0.00 174.94 173.49 1qjz s ARG 179 N 0.38 3.68 -0.03 3.50 1.04 -1.04 -0.99 118.95 125.48 1qjz s ARG 179 Ca -0.00 0.08 -0.01 0.00 -1.04 0.00 0.00 55.73 54.76 1qjz s ARG 179 Cb -0.04 -3.10 0.03 0.00 -2.04 0.00 0.00 34.95 29.79 1qjz s ARG 179 CO 0.00 0.65 0.07 -0.48 -0.04 0.00 0.00 175.30 175.50 1qjz s LEU 180 N -1.58 1.15 0.00 -1.89 0.05 -1.25 -1.23 118.68 113.93 1qjz s LEU 180 Ca 0.27 0.13 0.01 0.00 0.05 0.00 0.00 54.13 54.59 1qjz s LEU 180 Cb -0.14 0.11 -0.00 0.00 -2.05 0.00 0.00 46.19 44.11 1qjz s LEU 180 CO 0.15 -0.11 0.03 -0.24 -0.55 0.00 0.00 176.35 175.63 1qjz n SER 181 N 3.92 0.77 -2.71 1.48 2.88 -0.94 -3.94 113.62 115.08 1qjz n SER 181 Ca -0.24 -1.44 -0.04 0.00 -1.33 0.00 0.00 58.87 55.83 1qjz n SER 181 Cb 0.53 0.23 -0.03 0.00 -0.75 0.00 0.00 64.21 64.19 1qjz n SER 181 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1qjz n LYS 182 N -0.17 -3.82 -0.81 -1.46 4.01 -1.26 -3.02 118.16 111.63 1qjz n LYS 182 Ca -0.01 2.96 -0.33 0.00 -0.51 0.00 0.00 58.31 60.43 1qjz n LYS 182 Cb 0.12 -4.47 0.12 0.00 -0.51 0.00 0.00 35.03 30.29 1qjz n LYS 182 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99 1qjz n PRO 183 N 1.59 -0.28 0.00 1.97 -0.02 -1.26 -0.22 135.00 136.78 1qjz n PRO 183 Ca -0.27 -0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.17 1qjz n PRO 183 Cb 0.44 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 1qjz n PRO 183 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 1qjz n MET 184 N -1.45 -0.49 -3.37 -0.52 1.56 0.97 -4.25 117.12 109.57 1qjz n MET 184 Ca 0.06 -0.34 -0.27 0.00 -0.27 0.00 0.00 57.70 56.88 1qjz n MET 184 Cb 0.54 -0.80 0.02 0.00 2.15 0.00 0.00 33.22 35.12 1qjz n MET 184 CO 0.00 0.00 0.00 1.47 -0.73 0.00 0.00 175.97 176.71 1qjz n LEU 185 N -0.01 -1.79 0.00 -0.89 -0.00 -1.25 -4.94 117.00 108.11 1qjz n LEU 185 Ca 0.00 -0.49 0.00 0.00 -0.00 0.00 0.00 56.01 55.52 1qjz n LEU 185 Cb 0.11 -1.35 0.00 0.00 -0.00 0.00 0.00 43.42 42.19 1qjz n LEU 185 CO 0.00 0.18 0.00 -0.38 -0.00 0.00 0.00 177.39 177.19 1qjz n ILE 186 N -1.24 0.00 -0.19 1.47 2.08 -1.26 -4.85 119.36 115.37 1qjz n ILE 186 Ca -0.18 0.00 -0.02 0.00 0.56 0.00 0.00 62.75 63.12 1qjz n ILE 186 Cb 0.59 0.00 0.09 0.00 -0.75 0.00 0.00 39.64 39.56 1qjz n ILE 186 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1qjz h ALA 187 N -2.00 0.72 0.00 -1.39 0.00 -2.00 -3.53 119.26 111.05 1qjz h ALA 187 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1qjz h ALA 187 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1qjz h ALA 187 CO 0.00 -0.17 0.00 0.09 0.00 0.00 0.00 179.25 179.17