#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j1x s ILE 2 N 0.00 4.35 -0.21 0.53 -1.09 -1.26 -5.00 121.20 118.52 1j1x s ILE 2 Ca 0.00 1.66 -0.09 0.00 -2.23 0.00 0.00 60.65 59.99 1j1x s ILE 2 Cb 0.00 -4.07 -0.05 0.00 -1.58 0.00 0.00 42.46 36.76 1j1x s ILE 2 CO 0.00 0.00 0.12 -0.69 -1.23 0.00 0.00 174.94 173.14 1j1x s VAL 3 N 2.17 5.15 -0.21 2.92 1.01 -1.26 -4.77 120.40 125.41 1j1x s VAL 3 Ca 0.54 0.10 -0.06 0.00 0.00 0.00 0.00 61.98 62.57 1j1x s VAL 3 Cb -0.24 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 1j1x s VAL 3 CO 0.21 0.41 0.02 -0.76 0.00 0.00 0.00 175.10 174.99 1j1x s LEU 4 N 0.64 3.35 -0.23 3.92 1.43 -1.26 -1.06 118.68 125.46 1j1x s LEU 4 Ca 0.06 -0.19 -0.05 0.00 -1.03 0.00 0.00 54.13 52.93 1j1x s LEU 4 Cb -0.12 -1.86 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1j1x s LEU 4 CO 0.01 0.04 -0.02 -0.89 0.23 0.00 0.00 176.35 175.73 1j1x s THR 5 N 1.14 3.55 -0.03 5.49 2.01 0.47 -3.85 115.64 124.42 1j1x s THR 5 Ca 0.03 -0.47 -0.02 0.00 0.31 0.00 0.00 61.69 61.54 1j1x s THR 5 Cb -0.14 -2.65 -0.04 0.00 0.01 0.00 0.00 72.50 69.68 1j1x s THR 5 CO 0.02 0.38 0.09 -1.10 -0.69 0.00 0.00 174.62 173.32 1j1x s GLN 6 N 1.50 3.16 -0.05 4.92 -0.21 -1.26 -0.93 119.66 126.78 1j1x s GLN 6 Ca 0.05 -0.40 -0.16 0.00 0.02 0.00 0.00 55.36 54.87 1j1x s GLN 6 Cb -0.15 -2.93 0.03 0.00 1.00 0.00 0.00 33.01 30.97 1j1x s GLN 6 CO -0.02 0.68 0.37 -1.54 -2.12 0.00 0.00 175.29 172.66 1j1x s SER 7 N -1.54 -0.30 0.87 5.90 1.04 -0.77 -4.42 113.70 114.47 1j1x s SER 7 Ca 0.21 0.34 -0.13 0.00 0.48 0.00 0.00 55.95 56.85 1j1x s SER 7 Cb -0.12 0.47 0.12 0.00 0.10 0.00 0.00 66.02 66.58 1j1x s SER 7 CO 0.11 -0.38 1.19 -2.16 0.98 0.00 0.00 173.24 172.99 1j1x s PRO 8 N -0.90 1.49 0.30 4.02 0.04 -1.26 -1.38 135.00 137.31 1j1x s PRO 8 Ca -0.10 0.06 0.08 0.00 0.04 0.00 0.00 61.00 61.08 1j1x s PRO 8 Cb -0.04 -1.90 0.47 0.00 0.04 0.00 0.00 34.50 33.07 1j1x s PRO 8 CO 0.04 -1.91 1.70 0.00 0.04 0.00 0.00 177.00 176.87 1j1x h ALA 9 N -1.29 1.12 -3.16 8.56 0.00 -1.84 -3.42 119.26 119.24 1j1x h ALA 9 Ca -0.47 -0.43 -0.18 0.00 0.00 0.00 0.00 54.91 53.83 1j1x h ALA 9 Cb 1.31 -0.09 -0.23 0.00 0.00 0.00 0.00 17.79 18.78 1j1x h ALA 9 CO 0.60 0.60 -0.62 0.99 0.00 0.00 0.00 179.25 180.82 1j1x s THR 10 N -4.05 0.06 -0.09 0.00 2.01 -1.26 -0.95 115.64 111.35 1j1x s THR 10 Ca -0.04 -0.48 -0.04 0.00 0.31 0.00 0.00 61.69 61.44 1j1x s THR 10 Cb 0.13 -0.24 0.05 0.00 0.01 0.00 0.00 72.50 72.45 1j1x s THR 10 CO 0.76 -0.27 0.20 -0.22 -0.69 0.00 0.00 174.62 174.41 1j1x s LEU 11 N -0.83 0.22 -0.14 4.42 0.20 0.23 -4.91 118.68 117.86 1j1x s LEU 11 Ca -0.09 0.43 -0.06 0.00 0.69 0.00 0.00 54.13 55.10 1j1x s LEU 11 Cb -0.06 0.50 -0.04 0.00 -0.43 0.00 0.00 46.19 46.17 1j1x s LEU 11 CO 0.00 -0.20 0.06 -0.44 -0.29 0.00 0.00 176.35 175.49 1j1x s SER 12 N 1.75 5.70 0.03 3.68 0.01 -1.26 -1.63 113.70 121.98 1j1x s SER 12 Ca -0.04 0.19 -0.09 0.00 1.31 0.00 0.00 55.95 57.32 1j1x s SER 12 Cb -0.11 -1.86 0.00 0.00 0.21 0.00 0.00 66.02 64.26 1j1x s SER 12 CO -0.07 0.28 0.17 0.54 0.41 0.00 0.00 173.24 174.57 1j1x s VAL 13 N -0.27 0.10 -0.13 3.43 0.11 -0.37 -4.75 120.40 118.51 1j1x s VAL 13 Ca 0.08 -0.86 -0.16 0.00 -2.93 0.00 0.00 61.98 58.12 1j1x s VAL 13 Cb -0.12 -0.79 -0.05 0.00 -1.53 0.00 0.00 36.38 33.89 1j1x s VAL 13 CO 0.02 -0.47 0.38 -0.89 -3.33 0.00 0.00 175.10 170.80 1j1x s THR 14 N -2.26 5.24 0.20 5.04 2.01 -1.26 -2.20 115.64 122.41 1j1x s THR 14 Ca -0.08 0.73 -0.31 0.00 0.31 0.00 0.00 61.69 62.35 1j1x s THR 14 Cb -0.03 -3.71 -0.16 0.00 0.01 0.00 0.00 72.50 68.62 1j1x s THR 14 CO -0.02 0.38 1.01 -2.65 -0.69 0.00 0.00 174.62 172.65 1j1x n PRO 15 N 3.45 0.98 0.00 4.92 -0.02 -1.26 -1.42 135.00 141.65 1j1x n PRO 15 Ca -0.10 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1j1x n PRO 15 Cb 0.52 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 1j1x n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j1x n GLY 16 N 1.75 2.11 3.90 -1.23 0.00 0.38 -4.94 105.19 107.16 1j1x n GLY 16 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 1j1x n GLY 16 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1j1x s ASN 17 N 0.06 6.32 0.19 1.61 0.01 -0.51 -4.35 114.94 118.27 1j1x s ASN 17 Ca 0.00 0.95 0.05 0.00 -0.71 0.00 0.00 52.86 53.15 1j1x s ASN 17 Cb 0.00 -2.25 -0.04 0.00 0.41 0.00 0.00 41.25 39.37 1j1x s ASN 17 CO 0.00 -0.52 0.23 -0.44 -1.51 0.00 0.00 177.10 174.86 1j1x s SER 18 N -3.88 5.91 0.11 -1.22 0.01 -1.26 -0.23 113.70 113.13 1j1x s SER 18 Ca 0.48 -0.02 -0.05 0.00 1.31 0.00 0.00 55.95 57.67 1j1x s SER 18 Cb -0.10 -1.65 -0.02 0.00 0.21 0.00 0.00 66.02 64.45 1j1x s SER 18 CO 0.41 0.02 0.12 0.68 0.41 0.00 0.00 173.24 174.89 1j1x s VAL 19 N -1.86 0.13 -0.03 3.43 -7.23 -0.89 -4.95 120.40 109.01 1j1x s VAL 19 Ca 0.33 -1.59 0.01 0.00 -1.81 0.00 0.00 61.98 58.92 1j1x s VAL 19 Cb -0.10 -1.71 0.02 0.00 0.56 0.00 0.00 36.38 35.15 1j1x s VAL 19 CO 0.26 -0.59 -0.03 -0.44 -0.31 0.00 0.00 175.10 174.00 1j1x s SER 20 N -2.96 0.65 -0.08 4.85 0.01 -1.26 -1.31 113.70 113.60 1j1x s SER 20 Ca 0.14 -0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.32 1j1x s SER 20 Cb 0.06 -0.28 -0.03 0.00 0.21 0.00 0.00 66.02 65.98 1j1x s SER 20 CO -0.04 -0.05 -0.08 -0.76 0.41 0.00 0.00 173.24 172.72 1j1x s LEU 21 N 0.72 3.10 -0.02 2.44 1.43 0.12 -4.87 118.68 121.61 1j1x s LEU 21 Ca -0.08 -0.08 -0.01 0.00 -1.03 0.00 0.00 54.13 52.93 1j1x s LEU 21 Cb -0.12 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 1j1x s LEU 21 CO -0.01 0.32 0.09 -0.55 0.23 0.00 0.00 176.35 176.43 1j1x s SER 22 N -0.56 5.77 -0.10 2.29 0.15 -0.48 -0.73 113.70 120.04 1j1x s SER 22 Ca 0.08 0.20 -0.03 0.00 0.70 0.00 0.00 55.95 56.90 1j1x s SER 22 Cb -0.12 -1.69 0.05 0.00 -1.71 0.00 0.00 66.02 62.55 1j1x s SER 22 CO 0.02 0.30 0.13 0.00 1.20 0.00 0.00 173.24 174.89 1j1x s ARG 24 N 2.24 2.99 -0.06 0.00 3.52 -0.11 -1.18 118.95 126.35 1j1x s ARG 24 Ca 0.04 -0.74 -0.08 0.00 -0.13 0.00 0.00 55.73 54.82 1j1x s ARG 24 Cb -0.13 -2.46 -0.04 0.00 -1.56 0.00 0.00 34.95 30.76 1j1x s ARG 24 CO -0.06 0.35 0.22 0.00 -0.81 0.00 0.00 175.30 174.99 1j1x s ALA 25 N -0.02 3.85 0.38 6.12 0.00 0.48 -0.39 121.76 132.17 1j1x s ALA 25 Ca -0.05 -0.56 0.32 0.00 0.00 0.00 0.00 51.96 51.68 1j1x s ALA 25 Cb -0.14 -2.06 1.62 0.00 0.00 0.00 0.00 23.12 22.54 1j1x s ALA 25 CO 0.04 0.61 2.10 0.66 0.00 0.00 0.00 175.76 179.18 1j1x h SER 26 N 4.63 0.00 -5.09 0.00 4.64 -1.43 -3.44 113.55 112.86 1j1x h SER 26 Ca -0.53 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.67 1j1x h SER 26 Cb 1.22 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.14 1j1x h SER 26 CO 0.61 0.07 -0.48 -1.58 -0.87 0.00 0.00 176.83 174.58 1j1x s GLN 27 N -4.03 0.64 0.34 4.77 0.74 -1.26 -4.99 119.66 115.86 1j1x s GLN 27 Ca -0.02 -0.76 -0.29 0.00 0.05 0.00 0.00 55.36 54.34 1j1x s GLN 27 Cb 0.12 0.25 -0.12 0.00 1.10 0.00 0.00 33.01 34.37 1j1x s GLN 27 CO 0.54 -0.17 1.50 0.45 -0.55 0.00 0.00 175.29 177.06 1j1x n SER 28 N 0.65 3.66 -0.15 6.67 2.88 -1.26 -4.74 113.62 121.32 1j1x n SER 28 Ca -0.18 1.19 0.04 0.00 -1.33 0.00 0.00 58.87 58.59 1j1x n SER 28 Cb 0.59 -1.59 0.05 0.00 -0.75 0.00 0.00 64.21 62.52 1j1x n SER 28 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1j1x n ILE 29 N 1.09 0.96 0.00 2.46 -5.35 -0.23 -4.99 119.36 113.30 1j1x n ILE 29 Ca 0.05 -1.10 0.00 0.00 -0.27 0.00 0.00 62.75 61.42 1j1x n ILE 29 Cb 0.37 0.28 0.00 0.00 -1.74 0.00 0.00 39.64 38.56 1j1x n ILE 29 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1j1x n GLY 30 N -0.67 3.48 0.11 3.28 0.00 -1.25 -1.65 105.19 108.48 1j1x n GLY 30 Ca 0.06 -0.04 0.03 0.00 0.00 0.00 0.00 46.02 46.07 1j1x n GLY 30 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1j1x n ASN 31 N 9.20 2.22 -3.30 1.61 6.94 -1.26 -0.34 115.26 130.32 1j1x n ASN 31 Ca 0.00 -2.25 -0.38 0.00 -0.02 0.00 0.00 54.58 51.93 1j1x n ASN 31 Cb 0.00 -0.13 -0.03 0.00 -2.36 0.00 0.00 39.78 37.27 1j1x n ASN 31 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1j1x n ASN 32 N -0.58 8.28 -4.00 0.53 3.02 -0.66 -2.43 115.26 119.43 1j1x n ASN 32 Ca 0.05 -2.82 -0.25 0.00 -0.03 0.00 0.00 54.58 51.53 1j1x n ASN 32 Cb 0.37 -1.46 -0.17 0.00 -0.61 0.00 0.00 39.78 37.91 1j1x n ASN 32 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1j1x s LEU 33 N -0.85 1.55 0.16 3.41 1.98 -1.26 -1.87 118.68 121.81 1j1x s LEU 33 Ca 0.63 -0.30 0.11 0.00 -2.89 0.00 0.00 54.13 51.68 1j1x s LEU 33 Cb 0.19 -0.83 -0.04 0.00 0.66 0.00 0.00 46.19 46.17 1j1x s LEU 33 CO -0.08 0.00 -0.25 -1.00 -1.89 0.00 0.00 176.35 173.13 1j1x s HIS 34 N 0.89 2.32 -0.10 5.38 3.76 0.98 0.35 115.29 128.86 1j1x s HIS 34 Ca -0.10 -0.37 0.02 0.00 -0.15 0.00 0.00 55.06 54.46 1j1x s HIS 34 Cb -0.15 -1.21 -0.02 0.00 1.11 0.00 0.00 32.58 32.32 1j1x s HIS 34 CO 0.01 0.41 -0.16 -1.58 -0.85 0.00 0.00 174.74 172.57 1j1x s TRP 35 N -1.33 2.70 0.08 1.40 0.52 -0.39 -0.39 118.94 121.54 1j1x s TRP 35 Ca 0.17 -0.57 0.08 0.00 0.02 0.00 0.00 56.10 55.80 1j1x s TRP 35 Cb -0.09 -1.74 -0.03 0.00 -1.15 0.00 0.00 33.47 30.46 1j1x s TRP 35 CO 0.08 -0.13 -0.21 0.71 0.02 0.00 0.00 176.95 177.41 1j1x s TYR 36 N -0.00 1.83 -0.04 -1.98 1.51 0.10 -0.52 117.35 118.26 1j1x s TYR 36 Ca -0.05 -0.40 0.05 0.00 -1.01 0.00 0.00 57.07 55.66 1j1x s TYR 36 Cb -0.14 -1.04 -0.03 0.00 -0.11 0.00 0.00 41.96 40.64 1j1x s TYR 36 CO 0.04 0.17 -0.16 -1.14 -1.11 0.00 0.00 175.55 173.35 1j1x s GLN 37 N -1.64 2.40 -0.05 -0.62 0.74 -0.12 -0.49 119.66 119.88 1j1x s GLN 37 Ca 0.07 -0.76 -0.02 0.00 0.05 0.00 0.00 55.36 54.71 1j1x s GLN 37 Cb -0.10 -2.31 0.04 0.00 1.10 0.00 0.00 33.01 31.74 1j1x s GLN 37 CO 0.03 0.61 0.09 -1.14 -0.55 0.00 0.00 175.29 174.33 1j1x s GLN 38 N -0.79 -0.01 0.18 1.67 0.74 0.37 -0.30 119.66 121.51 1j1x s GLN 38 Ca 0.12 0.35 0.05 0.00 0.05 0.00 0.00 55.36 55.92 1j1x s GLN 38 Cb -0.10 -0.30 -0.04 0.00 1.10 0.00 0.00 33.01 33.67 1j1x s GLN 38 CO 0.01 -0.23 0.21 0.15 -0.55 0.00 0.00 175.29 174.88 1j1x s LYS 39 N 1.59 3.13 0.32 1.67 -0.14 -1.26 -0.99 119.74 124.06 1j1x s LYS 39 Ca -0.03 -0.80 -0.29 0.00 -1.36 0.00 0.00 55.97 53.49 1j1x s LYS 39 Cb -0.12 -2.76 -0.13 0.00 -1.68 0.00 0.00 37.83 33.14 1j1x s LYS 39 CO -0.04 0.48 1.29 0.43 -0.76 0.00 0.00 175.35 176.75 1j1x n SER 40 N -0.64 2.68 -0.66 2.83 7.64 -1.26 -1.12 113.62 123.09 1j1x n SER 40 Ca -0.08 1.20 -0.09 0.00 1.01 0.00 0.00 58.87 60.91 1j1x n SER 40 Cb 0.55 -1.46 -0.04 0.00 -1.01 0.00 0.00 64.21 62.25 1j1x n SER 40 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1j1x n HIS 41 N 0.60 0.00 -4.26 1.43 8.25 -1.26 -4.98 115.22 115.01 1j1x n HIS 41 Ca 0.06 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.34 1j1x n HIS 41 Cb 0.35 -2.14 -0.11 0.00 1.12 0.00 0.00 29.99 29.21 1j1x n HIS 41 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1j1x s GLU 42 N -2.49 1.06 0.55 -0.41 2.02 -0.28 -5.15 118.70 114.00 1j1x s GLU 42 Ca 0.00 -1.29 -0.14 0.00 0.02 0.00 0.00 54.97 53.56 1j1x s GLU 42 Cb 0.00 -0.93 -0.06 0.00 0.10 0.00 0.00 34.13 33.24 1j1x s GLU 42 CO 0.00 0.17 0.99 -1.12 0.02 0.00 0.00 175.26 175.32 1j1x s SER 43 N -2.58 6.46 0.70 -0.19 0.01 -1.26 -4.46 113.70 112.37 1j1x s SER 43 Ca 0.11 1.48 -0.16 0.00 1.31 0.00 0.00 55.95 58.69 1j1x s SER 43 Cb -0.04 -2.48 0.02 0.00 0.21 0.00 0.00 66.02 63.73 1j1x s SER 43 CO 0.03 -0.69 1.24 -2.84 0.41 0.00 0.00 173.24 171.39 1j1x s PRO 44 N -4.50 2.26 -0.09 12.44 0.02 -1.26 -4.64 135.00 139.24 1j1x s PRO 44 Ca 0.57 1.87 0.01 0.00 0.02 0.00 0.00 61.00 63.46 1j1x s PRO 44 Cb -0.10 -1.84 0.02 0.00 0.02 0.00 0.00 34.50 32.60 1j1x s PRO 44 CO 0.40 -1.77 -0.09 0.50 -0.33 0.00 0.00 177.00 175.71 1j1x s ARG 45 N -3.72 1.56 0.01 5.54 3.52 0.58 -4.94 118.95 121.50 1j1x s ARG 45 Ca 0.77 -0.32 -0.30 0.00 -0.13 0.00 0.00 55.73 55.75 1j1x s ARG 45 Cb -0.32 -1.46 -0.05 0.00 -1.56 0.00 0.00 34.95 31.56 1j1x s ARG 45 CO 0.43 -0.12 1.33 -1.17 -0.81 0.00 0.00 175.30 174.96 1j1x s LEU 46 N 1.19 4.32 -0.19 -0.88 2.96 -1.26 -0.95 118.68 123.87 1j1x s LEU 46 Ca -0.05 2.06 -0.01 0.00 -0.22 0.00 0.00 54.13 55.91 1j1x s LEU 46 Cb -0.14 -3.56 -0.12 0.00 0.50 0.00 0.00 46.19 42.87 1j1x s LEU 46 CO -0.02 -0.66 -0.19 0.18 -1.32 0.00 0.00 176.35 174.34 1j1x n LEU 47 N 5.05 2.69 -3.83 -0.68 4.77 0.32 -4.96 117.00 120.36 1j1x n LEU 47 Ca 0.12 -0.04 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 1j1x n LEU 47 Cb 0.44 -0.66 -0.13 0.00 -2.33 0.00 0.00 43.42 40.74 1j1x n LEU 47 CO 0.57 0.75 -0.26 -0.63 -1.33 0.00 0.00 177.39 176.49 1j1x s ILE 48 N -2.38 -0.01 0.15 -0.08 -1.09 -1.18 -4.09 121.20 112.52 1j1x s ILE 48 Ca -0.26 0.03 0.11 0.00 -2.23 0.00 0.00 60.65 58.30 1j1x s ILE 48 Cb 0.07 -0.15 -0.04 0.00 -1.58 0.00 0.00 42.46 40.77 1j1x s ILE 48 CO 0.43 0.01 -0.25 -1.59 -1.23 0.00 0.00 174.94 172.31 1j1x s LYS 49 N 0.22 1.47 -1.32 2.79 -2.85 -0.74 -1.26 119.74 118.05 1j1x s LYS 49 Ca -0.01 -1.39 -0.06 0.00 -1.00 0.00 0.00 55.97 53.50 1j1x s LYS 49 Cb -0.02 -1.90 -0.00 0.00 -2.06 0.00 0.00 37.83 33.84 1j1x s LYS 49 CO -0.01 0.44 0.55 0.66 0.10 0.00 0.00 175.35 177.09 1j1x n TYR 50 N 0.69 -1.73 0.00 1.78 4.01 -1.17 -0.92 117.16 119.82 1j1x n TYR 50 Ca -0.16 0.66 0.00 0.00 -0.16 0.00 0.00 57.90 58.24 1j1x n TYR 50 Cb 0.54 -3.71 0.00 0.00 -0.31 0.00 0.00 39.34 35.86 1j1x n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1j1x n ALA 51 N -4.35 0.00 -1.04 -0.72 0.00 0.15 -3.87 120.51 110.69 1j1x n ALA 51 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1j1x n ALA 51 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1j1x n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1j1x n SER 52 N 1.07 0.00 -4.71 0.00 3.41 -1.21 -2.56 113.62 109.62 1j1x n SER 52 Ca 0.00 -1.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.19 1j1x n SER 52 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1j1x n SER 52 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1j1x s GLN 53 N 0.00 4.50 0.65 4.33 -0.21 -0.10 -4.60 119.66 124.23 1j1x s GLN 53 Ca 0.00 1.53 -0.16 0.00 0.02 0.00 0.00 55.36 56.76 1j1x s GLN 53 Cb 0.00 -3.44 -0.01 0.00 1.00 0.00 0.00 33.01 30.56 1j1x s GLN 53 CO 0.00 -0.16 1.12 -1.12 -2.12 0.00 0.00 175.29 173.01 1j1x s SER 54 N 1.06 5.14 -0.11 5.90 0.01 -1.26 -1.79 113.70 122.65 1j1x s SER 54 Ca 0.54 2.04 0.03 0.00 1.31 0.00 0.00 55.95 59.87 1j1x s SER 54 Cb -0.23 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.44 1j1x s SER 54 CO 0.27 -1.61 -0.23 -0.63 0.41 0.00 0.00 173.24 171.45 1j1x s ILE 55 N -2.25 2.08 0.25 1.44 -1.09 -1.26 -4.81 121.20 115.55 1j1x s ILE 55 Ca 0.68 -1.00 -0.31 0.00 -2.23 0.00 0.00 60.65 57.79 1j1x s ILE 55 Cb -0.21 -1.80 -0.12 0.00 -1.58 0.00 0.00 42.46 38.75 1j1x s ILE 55 CO 0.40 0.56 1.65 -0.24 -1.23 0.00 0.00 174.94 176.07 1j1x n SER 56 N 3.67 3.84 0.00 3.58 2.88 -1.26 -2.33 113.62 123.99 1j1x n SER 56 Ca -0.19 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.45 1j1x n SER 56 Cb 0.53 -1.57 0.00 0.00 -0.75 0.00 0.00 64.21 62.42 1j1x n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1j1x n GLY 57 N 3.04 0.75 3.88 0.46 0.00 -1.26 -5.06 105.19 106.99 1j1x n GLY 57 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1j1x n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j1x s ILE 58 N -2.46 5.42 0.40 -0.61 -1.09 -0.99 -5.06 121.20 116.82 1j1x s ILE 58 Ca 0.00 0.03 -0.26 0.00 -2.23 0.00 0.00 60.65 58.18 1j1x s ILE 58 Cb 0.00 -3.44 -0.10 0.00 -1.58 0.00 0.00 42.46 37.34 1j1x s ILE 58 CO 0.00 0.49 1.32 -2.65 -1.23 0.00 0.00 174.94 172.87 1j1x n PRO 59 N 1.53 2.11 0.31 2.79 -0.02 -1.26 -4.87 135.00 135.59 1j1x n PRO 59 Ca -0.16 0.75 0.21 0.00 -2.02 0.00 0.00 63.50 62.27 1j1x n PRO 59 Cb 0.54 -2.44 1.01 0.00 -0.02 0.00 0.00 33.50 32.58 1j1x n PRO 59 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1j1x h SER 60 N 2.32 0.00 0.41 2.55 0.02 -1.97 -2.77 113.55 114.10 1j1x h SER 60 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 1j1x h SER 60 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1j1x h SER 60 CO 0.61 0.00 0.00 -2.11 -1.14 0.00 0.00 176.83 174.19 1j1x n ARG 61 N -3.08 0.10 -3.28 3.45 1.85 -1.26 -4.58 116.66 109.86 1j1x n ARG 61 Ca -0.02 0.44 -0.38 0.00 -1.00 0.00 0.00 57.85 56.89 1j1x n ARG 61 Cb 0.16 -1.74 -0.06 0.00 -1.05 0.00 0.00 32.46 29.78 1j1x n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1j1x s PHE 62 N -3.24 3.53 0.01 2.89 0.08 -1.05 -1.11 117.98 119.09 1j1x s PHE 62 Ca 0.03 0.94 -0.07 0.00 0.12 0.00 0.00 56.93 57.95 1j1x s PHE 62 Cb 0.07 -2.58 0.00 0.00 -0.57 0.00 0.00 43.02 39.94 1j1x s PHE 62 CO 0.26 0.17 0.14 -1.54 -0.10 0.00 0.00 175.22 174.15 1j1x s SER 63 N 0.61 0.04 0.15 1.36 1.04 -0.53 -5.00 113.70 111.37 1j1x s SER 63 Ca 0.28 -0.26 0.10 0.00 0.48 0.00 0.00 55.95 56.54 1j1x s SER 63 Cb -0.16 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 66.14 1j1x s SER 63 CO 0.11 -0.41 -0.22 -0.83 0.98 0.00 0.00 173.24 172.87 1j1x s GLY 64 N -1.57 1.46 0.07 7.32 0.00 -1.26 -0.41 107.32 112.94 1j1x s GLY 64 Ca -0.12 -1.45 -0.10 0.00 0.00 0.00 0.00 44.72 43.05 1j1x s GLY 64 CO 0.00 -1.46 0.22 -0.45 0.00 0.00 0.00 173.10 171.41 1j1x s SER 65 N -2.31 0.04 0.00 1.64 0.15 -0.21 -4.25 113.70 108.76 1j1x s SER 65 Ca 0.14 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.29 1j1x s SER 65 Cb -0.08 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 1j1x s SER 65 CO 0.07 -0.69 0.00 0.61 1.20 0.00 0.00 173.24 174.43 1j1x n GLY 66 N 0.18 2.63 3.52 9.45 0.00 -1.26 -1.06 105.19 118.65 1j1x n GLY 66 Ca -0.16 -2.11 -0.08 0.00 0.00 0.00 0.00 46.02 43.67 1j1x n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1j1x s SER 67 N 0.00 -0.33 0.33 1.61 1.04 -1.10 -4.86 113.70 110.38 1j1x s SER 67 Ca 0.00 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.42 1j1x s SER 67 Cb 0.00 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.48 1j1x s SER 67 CO 0.00 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1j1x n GLY 68 N -0.23 1.66 0.00 7.32 0.00 0.53 -3.22 105.19 111.25 1j1x n GLY 68 Ca -0.08 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1j1x n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1j1x n THR 69 N 0.00 0.00 -3.95 2.61 -2.24 -1.26 -1.06 114.28 108.37 1j1x n THR 69 Ca 0.00 -0.37 -0.35 0.00 -2.27 0.00 0.00 64.05 61.06 1j1x n THR 69 Cb 0.00 0.90 -0.14 0.00 -2.10 0.00 0.00 70.33 68.98 1j1x n THR 69 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1j1x s ASP 70 N -1.09 4.22 0.11 3.42 3.68 -1.20 -0.39 116.67 125.42 1j1x s ASP 70 Ca 0.00 -0.70 0.05 0.00 2.13 0.00 0.00 52.55 54.03 1j1x s ASP 70 Cb 0.00 -1.68 -0.04 0.00 -1.45 0.00 0.00 42.92 39.76 1j1x s ASP 70 CO 0.00 -0.09 -0.13 -0.36 0.13 0.00 0.00 175.17 174.72 1j1x s PHE 71 N 1.37 1.29 0.01 -5.34 0.40 -0.33 -2.70 117.98 112.69 1j1x s PHE 71 Ca 0.02 -0.56 -0.00 0.00 -0.60 0.00 0.00 56.93 55.80 1j1x s PHE 71 Cb -0.16 -0.69 -0.01 0.00 0.51 0.00 0.00 43.02 42.68 1j1x s PHE 71 CO -0.05 0.10 -0.01 0.99 0.70 0.00 0.00 175.22 176.95 1j1x s THR 72 N -2.02 0.03 -0.15 0.64 2.01 -0.22 -1.22 115.64 114.70 1j1x s THR 72 Ca 0.06 -0.25 -0.00 0.00 0.31 0.00 0.00 61.69 61.81 1j1x s THR 72 Cb -0.05 -0.08 -0.01 0.00 0.01 0.00 0.00 72.50 72.37 1j1x s THR 72 CO 0.02 -0.14 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.46 1j1x s LEU 73 N -0.40 2.59 0.02 4.42 2.96 0.10 -1.05 118.68 127.32 1j1x s LEU 73 Ca -0.04 -0.41 0.07 0.00 -0.22 0.00 0.00 54.13 53.52 1j1x s LEU 73 Cb -0.03 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 45.04 1j1x s LEU 73 CO -0.00 0.11 -0.19 -0.44 -1.32 0.00 0.00 176.35 174.50 1j1x s SER 74 N 0.70 3.69 -0.21 3.68 0.01 0.45 0.13 113.70 122.15 1j1x s SER 74 Ca -0.06 -0.41 0.01 0.00 1.31 0.00 0.00 55.95 56.79 1j1x s SER 74 Cb -0.15 -0.59 0.05 0.00 0.21 0.00 0.00 66.02 65.54 1j1x s SER 74 CO 0.02 0.28 -0.09 -0.63 0.41 0.00 0.00 173.24 173.22 1j1x s ILE 75 N -0.85 1.66 -0.51 1.44 1.01 -0.43 -1.46 121.20 122.07 1j1x s ILE 75 Ca 0.13 -1.09 -0.23 0.00 0.00 0.00 0.00 60.65 59.46 1j1x s ILE 75 Cb -0.10 -1.78 0.04 0.00 0.01 0.00 0.00 42.46 40.63 1j1x s ILE 75 CO 0.04 0.11 0.85 0.21 0.00 0.00 0.00 174.94 176.14 1j1x s ASN 76 N 1.37 6.35 -0.20 3.58 3.04 -0.27 -2.09 114.94 126.73 1j1x s ASN 76 Ca -0.03 -0.33 -0.07 0.00 0.04 0.00 0.00 52.86 52.47 1j1x s ASN 76 Cb -0.17 -2.40 0.01 0.00 -1.54 0.00 0.00 41.25 37.15 1j1x s ASN 76 CO -0.08 -1.08 0.28 -0.24 -3.04 0.00 0.00 177.10 172.94 1j1x n SER 77 N 7.04 -4.84 -4.72 -4.21 2.88 -1.25 -4.78 113.62 103.75 1j1x n SER 77 Ca 0.01 0.27 -0.42 0.00 -1.33 0.00 0.00 58.87 57.40 1j1x n SER 77 Cb 0.47 -3.10 -0.01 0.00 -0.75 0.00 0.00 64.21 60.83 1j1x n SER 77 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1j1x n VAL 78 N -0.39 1.95 -4.33 2.46 0.31 0.67 -4.62 118.33 114.39 1j1x n VAL 78 Ca 0.06 -0.49 -0.24 0.00 -0.01 0.00 0.00 64.34 63.66 1j1x n VAL 78 Cb 0.21 -1.68 -0.08 0.00 -0.91 0.00 0.00 33.84 31.38 1j1x n VAL 78 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1j1x s GLU 79 N -1.87 2.10 0.42 5.55 0.41 -1.26 -0.47 118.70 123.57 1j1x s GLU 79 Ca 0.55 -1.60 0.12 0.00 -0.41 0.00 0.00 54.97 53.63 1j1x s GLU 79 Cb -0.55 -2.01 0.95 0.00 -1.78 0.00 0.00 34.13 30.75 1j1x s GLU 79 CO 0.62 0.28 1.98 1.15 -0.49 0.00 0.00 175.26 178.80 1j1x h THR 80 N 1.93 0.93 0.00 3.63 2.02 -1.99 -0.44 112.91 118.99 1j1x h THR 80 Ca -0.43 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1j1x h THR 80 Cb 1.25 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1j1x h THR 80 CO 0.62 0.09 0.00 -1.84 0.37 0.00 0.00 175.52 174.76 1j1x n GLU 81 N -4.48 0.10 0.00 6.66 0.28 -1.26 -2.78 120.64 119.16 1j1x n GLU 81 Ca 0.10 0.21 0.12 0.00 -0.16 0.00 0.00 57.16 57.43 1j1x n GLU 81 Cb 0.32 -1.50 0.26 0.00 1.43 0.00 0.00 31.44 31.96 1j1x n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1j1x n ASP 82 N -1.39 0.57 -4.71 -1.84 8.00 -0.18 -4.89 116.55 112.10 1j1x n ASP 82 Ca 0.05 -0.34 -0.42 0.00 0.71 0.00 0.00 54.79 54.79 1j1x n ASP 82 Cb 0.14 0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.45 1j1x n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1j1x s PHE 83 N -2.94 3.29 -4.56 1.24 0.08 -1.12 -4.85 117.98 109.12 1j1x s PHE 83 Ca 0.13 1.05 0.00 0.00 0.12 0.00 0.00 56.93 58.22 1j1x s PHE 83 Cb 0.18 -3.61 0.00 0.00 -0.57 0.00 0.00 43.02 39.02 1j1x s PHE 83 CO 0.68 -2.07 0.00 0.41 -0.10 0.00 0.00 175.22 174.14 1j1x n GLY 84 N 3.42 -0.56 3.90 4.36 0.00 -0.62 -4.92 105.19 110.78 1j1x n GLY 84 Ca 0.11 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.73 1j1x n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1j1x s MET 85 N -1.83 3.52 -0.07 1.61 -1.94 -0.16 -0.91 119.30 119.52 1j1x s MET 85 Ca 0.00 -0.25 0.02 0.00 -1.71 0.00 0.00 55.69 53.75 1j1x s MET 85 Cb 0.00 -2.99 0.01 0.00 2.01 0.00 0.00 34.83 33.87 1j1x s MET 85 CO 0.00 0.57 -0.12 0.71 -0.01 0.00 0.00 175.02 176.18 1j1x s TYR 86 N -1.51 1.48 0.01 -0.03 1.51 -0.29 -0.48 117.35 118.04 1j1x s TYR 86 Ca 0.35 -0.58 0.06 0.00 -1.01 0.00 0.00 57.07 55.89 1j1x s TYR 86 Cb -0.13 -1.11 -0.02 0.00 -0.11 0.00 0.00 41.96 40.60 1j1x s TYR 86 CO 0.24 -0.32 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.12 1j1x s PHE 87 N 0.84 1.60 0.15 2.71 0.08 0.35 -1.09 117.98 122.62 1j1x s PHE 87 Ca -0.11 -0.33 0.04 0.00 0.12 0.00 0.00 56.93 56.65 1j1x s PHE 87 Cb -0.15 -1.00 -0.04 0.00 -0.57 0.00 0.00 43.02 41.26 1j1x s PHE 87 CO 0.02 0.02 0.14 0.00 -0.10 0.00 0.00 175.22 175.30 1j1x s GLN 89 N -3.02 0.23 0.04 0.00 0.74 0.48 -0.84 119.66 117.30 1j1x s GLN 89 Ca 0.31 0.34 0.02 0.00 0.05 0.00 0.00 55.36 56.08 1j1x s GLN 89 Cb -0.10 0.06 -0.04 0.00 1.10 0.00 0.00 33.01 34.03 1j1x s GLN 89 CO 0.24 -0.06 0.03 1.14 -0.55 0.00 0.00 175.29 176.09 1j1x s GLN 90 N 0.37 2.79 -0.04 1.67 1.03 -0.63 -0.01 119.66 124.84 1j1x s GLN 90 Ca -0.02 -0.67 0.06 0.00 0.04 0.00 0.00 55.36 54.77 1j1x s GLN 90 Cb -0.04 -2.68 0.09 0.00 0.03 0.00 0.00 33.01 30.41 1j1x s GLN 90 CO -0.02 0.59 0.95 -1.13 -2.54 0.00 0.00 175.29 173.14 1j1x n SER 91 N 0.93 1.36 0.11 12.60 3.41 -0.78 -3.41 113.62 127.83 1j1x n SER 91 Ca -0.12 -2.14 -0.04 0.00 -0.26 0.00 0.00 58.87 56.32 1j1x n SER 91 Cb 0.52 -0.17 0.10 0.00 -0.26 0.00 0.00 64.21 64.40 1j1x n SER 91 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1j1x h ASN 92 N 0.00 0.09 -4.73 4.04 -1.24 -1.84 -3.46 115.58 108.44 1j1x h ASN 92 Ca 0.00 -0.06 -0.29 0.00 0.71 0.00 0.00 56.30 56.66 1j1x h ASN 92 Cb 0.91 -0.03 -0.21 0.00 0.73 0.00 0.00 38.32 39.73 1j1x h ASN 92 CO 0.00 0.76 -0.74 0.00 -1.29 0.00 0.00 177.43 176.17 1j1x s ALA 93 N -3.46 0.65 -0.12 1.57 0.00 -1.26 -5.13 121.76 114.00 1j1x s ALA 93 Ca -0.02 -0.81 -0.11 0.00 0.00 0.00 0.00 51.96 51.02 1j1x s ALA 93 Cb 0.12 0.04 -0.05 0.00 0.00 0.00 0.00 23.12 23.23 1j1x s ALA 93 CO 0.79 -0.01 0.24 -0.46 0.00 0.00 0.00 175.76 176.31 1j1x s TRP 94 N -1.47 3.55 0.44 0.00 -0.11 -1.26 -3.30 118.94 116.80 1j1x s TRP 94 Ca -0.08 0.61 -0.22 0.00 1.22 0.00 0.00 56.10 57.63 1j1x s TRP 94 Cb -0.09 -2.17 -0.09 0.00 -1.50 0.00 0.00 33.47 29.62 1j1x s TRP 94 CO 0.00 0.50 1.02 -1.25 -4.62 0.00 0.00 176.95 172.60 1j1x s PRO 95 N -0.36 4.02 0.43 5.86 0.04 -1.26 -5.02 135.00 138.71 1j1x s PRO 95 Ca 0.16 1.35 -0.25 0.00 0.04 0.00 0.00 61.00 62.30 1j1x s PRO 95 Cb -0.13 -2.26 -0.08 0.00 0.04 0.00 0.00 34.50 32.07 1j1x s PRO 95 CO 0.05 -0.24 1.28 0.71 0.04 0.00 0.00 177.00 178.83 1j1x s TYR 96 N -1.92 2.77 0.09 0.56 2.02 -1.21 -4.75 117.35 114.91 1j1x s TYR 96 Ca 0.63 1.44 0.03 0.00 -0.37 0.00 0.00 57.07 58.80 1j1x s TYR 96 Cb -0.16 -3.62 -0.03 0.00 -0.40 0.00 0.00 41.96 37.74 1j1x s TYR 96 CO 0.21 -2.05 -0.10 0.95 -1.57 0.00 0.00 175.55 172.99 1j1x s THR 97 N -1.33 0.88 0.17 -0.71 -4.23 -1.22 -4.99 115.64 104.20 1j1x s THR 97 Ca 0.60 -1.59 0.08 0.00 -1.18 0.00 0.00 61.69 59.61 1j1x s THR 97 Cb -0.36 -1.29 -0.04 0.00 1.34 0.00 0.00 72.50 72.15 1j1x s THR 97 CO 0.45 -0.55 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.53 1j1x s PHE 98 N -2.38 2.67 0.82 3.99 0.08 -1.26 -1.60 117.98 120.30 1j1x s PHE 98 Ca 0.04 -0.20 -0.12 0.00 0.12 0.00 0.00 56.93 56.77 1j1x s PHE 98 Cb -0.03 -1.32 0.09 0.00 -0.57 0.00 0.00 43.02 41.18 1j1x s PHE 98 CO -0.00 0.50 1.18 0.20 -0.10 0.00 0.00 175.22 177.00 1j1x s GLY 99 N -2.74 1.59 0.00 4.36 0.00 -0.02 -4.52 107.32 106.00 1j1x s GLY 99 Ca 0.25 -0.66 0.17 0.00 0.00 0.00 0.00 44.72 44.48 1j1x s GLY 99 CO 0.15 -0.16 1.54 0.61 0.00 0.00 0.00 173.10 175.25 1j1x n GLY 100 N -3.27 -1.08 0.00 0.20 0.00 -1.25 -4.72 105.19 95.07 1j1x n GLY 100 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1j1x n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j1x n GLY 101 N 0.25 -0.20 3.01 -0.02 0.00 -1.26 -5.03 105.19 101.94 1j1x n GLY 101 Ca 0.04 -1.54 -0.26 0.00 0.00 0.00 0.00 46.02 44.26 1j1x n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j1x s THR 102 N -2.96 1.25 -0.24 2.61 2.01 -0.25 -4.70 115.64 113.37 1j1x s THR 102 Ca 0.00 -0.51 -0.17 0.00 0.31 0.00 0.00 61.69 61.32 1j1x s THR 102 Cb 0.00 -1.17 -0.03 0.00 0.01 0.00 0.00 72.50 71.31 1j1x s THR 102 CO 0.00 0.39 0.49 -0.75 -0.69 0.00 0.00 174.62 174.06 1j1x s LYS 103 N 0.98 4.11 -0.25 4.92 2.20 -0.13 -1.14 119.74 130.43 1j1x s LYS 103 Ca -0.08 0.30 -0.07 0.00 -0.36 0.00 0.00 55.97 55.76 1j1x s LYS 103 Cb -0.15 -3.61 -0.03 0.00 -1.51 0.00 0.00 37.83 32.53 1j1x s LYS 103 CO -0.00 -0.25 0.07 -1.17 -0.36 0.00 0.00 175.35 173.64 1j1x s LEU 104 N 1.98 3.48 0.12 5.43 2.96 -0.09 -0.60 118.68 131.95 1j1x s LEU 104 Ca 0.21 -0.18 -0.00 0.00 -0.22 0.00 0.00 54.13 53.94 1j1x s LEU 104 Cb -0.15 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 1j1x s LEU 104 CO 0.09 -0.02 0.02 -1.83 -1.32 0.00 0.00 176.35 173.29 1j1x s GLU 105 N 1.54 0.87 0.26 1.98 -1.05 -0.65 -1.59 118.70 120.07 1j1x s GLU 105 Ca 0.06 -1.39 -0.29 0.00 -0.15 0.00 0.00 54.97 53.19 1j1x s GLU 105 Cb -0.15 0.11 -0.09 0.00 -0.44 0.00 0.00 34.13 33.55 1j1x s GLU 105 CO 0.04 -0.18 1.21 -1.50 0.95 0.00 0.00 175.26 175.77 1j1x s ILE 106 N -3.91 3.25 -2.51 1.83 2.07 -1.26 -1.24 121.20 119.42 1j1x s ILE 106 Ca 0.19 1.18 0.28 0.00 -1.41 0.00 0.00 60.65 60.89 1j1x s ILE 106 Cb 0.07 -3.75 0.54 0.00 0.13 0.00 0.00 42.46 39.45 1j1x s ILE 106 CO -0.01 0.25 1.73 1.17 -1.91 0.00 0.00 174.94 176.17