#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3n s VAL 36 N 0.00 2.80 0.26 2.52 0.11 -1.26 -5.00 120.40 119.83 1u3n s VAL 36 Ca 0.00 0.75 -0.19 0.00 -2.93 0.00 0.00 61.98 59.61 1u3n s VAL 36 Cb 0.00 -3.48 0.02 0.00 -1.53 0.00 0.00 36.38 31.39 1u3n s VAL 36 CO 0.00 0.15 0.64 -1.61 -3.33 0.00 0.00 175.10 170.95 1u3n s GLU 37 N -1.19 1.68 0.18 1.54 0.41 -1.26 -5.19 118.70 114.87 1u3n s GLU 37 Ca 0.52 -1.03 -0.13 0.00 -0.41 0.00 0.00 54.97 53.92 1u3n s GLU 37 Cb -0.40 0.57 0.01 0.00 -1.78 0.00 0.00 34.13 32.53 1u3n s GLU 37 CO 0.48 -0.75 0.40 0.95 -0.49 0.00 0.00 175.26 175.85 1u3n s THR 38 N -3.94 0.05 0.21 3.63 -4.23 -1.26 -5.18 115.64 104.92 1u3n s THR 38 Ca 0.14 -1.06 -0.23 0.00 -1.18 0.00 0.00 61.69 59.36 1u3n s THR 38 Cb -0.04 -1.67 0.05 0.00 1.34 0.00 0.00 72.50 72.18 1u3n s THR 38 CO 0.06 -0.22 0.89 -0.44 -0.54 0.00 0.00 174.62 174.37 1u3n s SER 39 N -2.91 -0.16 0.00 3.99 0.01 -1.26 -4.99 113.70 108.37 1u3n s SER 39 Ca 0.12 -0.56 0.00 0.00 1.31 0.00 0.00 55.95 56.82 1u3n s SER 39 Cb 0.01 0.58 0.00 0.00 0.21 0.00 0.00 66.02 66.83 1u3n s SER 39 CO -0.02 -1.10 0.00 0.00 0.41 0.00 0.00 173.24 172.53 1u3n n ALA 40 N -0.50 0.00 -2.54 1.44 0.00 -1.26 -4.90 120.51 112.75 1u3n n ALA 40 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.97 1u3n n ALA 40 Cb 0.60 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.95 1u3n n ALA 40 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1u3n s PHE 41 N 0.00 3.24 0.00 0.00 5.36 -1.25 -4.98 117.98 120.34 1u3n s PHE 41 Ca 0.00 -0.60 0.00 0.00 -0.96 0.00 0.00 56.93 55.37 1u3n s PHE 41 Cb 0.00 -2.54 0.00 0.00 -0.34 0.00 0.00 43.02 40.14 1u3n s PHE 41 CO 0.00 -0.56 0.00 0.41 -1.46 0.00 0.00 175.22 173.61 1u3n n GLY 42 N 5.12 -0.53 0.00 13.12 0.00 -1.26 -4.76 105.19 116.88 1u3n n GLY 42 Ca -0.11 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1u3n n GLY 42 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1u3n n HIS 43 N -0.69 -2.93 -3.71 1.61 8.25 -1.26 -4.77 115.22 111.72 1u3n n HIS 43 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 1u3n n HIS 43 Cb 0.00 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 1u3n n HIS 43 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 1u3n s HIS 44 N -0.98 -0.31 -0.34 4.41 -3.43 -1.26 -4.85 115.29 108.54 1u3n s HIS 44 Ca 0.00 -0.07 -0.12 0.00 -0.80 0.00 0.00 55.06 54.07 1u3n s HIS 44 Cb 0.00 0.66 -0.01 0.00 -1.43 0.00 0.00 32.58 31.80 1u3n s HIS 44 CO 0.00 -1.11 0.21 0.08 -2.00 0.00 0.00 174.74 171.93 1u3n s VAL 45 N -3.86 4.99 -0.91 -5.38 1.01 -1.26 -3.36 120.40 111.63 1u3n s VAL 45 Ca 0.08 -0.38 -0.24 0.00 0.00 0.00 0.00 61.98 61.43 1u3n s VAL 45 Cb -0.04 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.74 1u3n s VAL 45 CO 0.00 -0.03 1.68 -1.58 0.00 0.00 0.00 175.10 175.17 1u3n s GLN 46 N 1.67 3.04 -0.76 2.72 0.74 -1.26 -4.27 119.66 121.54 1u3n s GLN 46 Ca 0.05 -0.55 -0.16 0.00 0.05 0.00 0.00 55.36 54.75 1u3n s GLN 46 Cb -0.18 -5.05 0.17 0.00 1.10 0.00 0.00 33.01 29.05 1u3n s GLN 46 CO 0.09 -2.73 0.77 -0.51 -0.55 0.00 0.00 175.29 172.36 1u3n s LEU 47 N 7.51 6.14 -0.03 3.68 1.43 -1.26 -1.46 118.68 134.69 1u3n s LEU 47 Ca 0.57 -2.22 -0.01 0.00 -1.03 0.00 0.00 54.13 51.44 1u3n s LEU 47 Cb -0.05 -2.26 0.03 0.00 0.03 0.00 0.00 46.19 43.95 1u3n s LEU 47 CO -0.01 -0.80 0.06 -0.69 0.23 0.00 0.00 176.35 175.14 1u3n s VAL 48 N 1.26 -0.08 0.39 -1.59 1.01 -1.26 -2.25 120.40 117.89 1u3n s VAL 48 Ca 0.17 0.25 0.08 0.00 0.00 0.00 0.00 61.98 62.47 1u3n s VAL 48 Cb -0.15 -0.13 0.00 0.00 0.00 0.00 0.00 36.38 36.10 1u3n s VAL 48 CO -0.04 0.10 0.52 0.20 0.00 0.00 0.00 175.10 175.88 1u3n s ASN 49 N 1.32 5.73 0.23 3.32 0.01 -1.26 -3.63 114.94 120.66 1u3n s ASN 49 Ca -0.06 -0.36 0.03 0.00 -0.71 0.00 0.00 52.86 51.75 1u3n s ASN 49 Cb -0.13 -0.85 0.25 0.00 0.41 0.00 0.00 41.25 40.93 1u3n s ASN 49 CO -0.04 -0.64 1.57 0.03 -1.51 0.00 0.00 177.10 176.51 1u3n h ARG 50 N 0.75 0.33 0.00 -0.60 2.47 -1.94 -2.32 114.38 113.07 1u3n h ARG 50 Ca -0.42 -0.21 0.00 0.00 -1.26 0.00 0.00 59.98 58.09 1u3n h ARG 50 Cb 1.27 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.61 1u3n h ARG 50 CO 0.48 0.80 -0.05 0.93 0.56 0.00 0.00 179.97 182.69 1u3n h GLU 51 N 0.25 0.00 -0.97 0.04 4.39 -1.96 -3.39 114.58 112.95 1u3n h GLU 51 Ca 0.00 0.00 0.27 0.00 0.34 0.00 0.00 59.36 59.97 1u3n h GLU 51 Cb 1.05 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 29.52 1u3n h GLU 51 CO 0.09 0.00 0.06 0.78 -1.16 0.00 0.00 179.01 178.78 1u3n h GLY 52 N -0.09 1.27 0.00 -3.84 0.00 -1.76 -3.44 103.07 95.21 1u3n h GLY 52 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1u3n h GLY 52 CO 0.00 -0.51 0.00 1.17 0.00 0.00 0.00 176.54 177.20 1u3n n LYS 53 N -5.46 0.00 0.00 4.80 4.81 -0.87 -4.83 118.16 116.60 1u3n n LYS 53 Ca 0.23 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.67 1u3n n LYS 53 Cb 0.76 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.81 1u3n n LYS 53 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1u3n n ALA 54 N 0.00 0.00 1.03 3.14 0.00 -1.26 -4.48 120.51 118.95 1u3n n ALA 54 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 1u3n n ALA 54 Cb 0.00 0.00 0.49 0.00 0.00 0.00 0.00 19.45 19.94 1u3n n ALA 54 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1u3n n VAL 55 N 0.00 0.00 0.00 0.00 0.24 -0.95 -4.84 118.33 112.78 1u3n n VAL 55 Ca 0.00 -0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1u3n n VAL 55 Cb 0.00 -0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.17 1u3n n VAL 55 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1u3n n GLY 56 N 1.48 0.77 0.00 7.63 0.00 -1.26 -4.10 105.19 109.72 1u3n n GLY 56 Ca 0.07 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1u3n n GLY 56 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1u3n n PHE 57 N 0.00 0.00 -3.35 1.61 1.16 -1.01 -4.83 117.46 111.04 1u3n n PHE 57 Ca 0.00 0.00 -0.44 0.00 -1.87 0.00 0.00 57.45 55.14 1u3n n PHE 57 Cb 0.00 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 37.80 1u3n n PHE 57 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1u3n s ILE 58 N -2.00 5.17 -0.25 1.97 1.09 -1.26 -3.06 121.20 122.86 1u3n s ILE 58 Ca 0.00 -0.99 -0.01 0.00 -1.10 0.00 0.00 60.65 58.55 1u3n s ILE 58 Cb 0.00 -4.17 0.03 0.00 -1.06 0.00 0.00 42.46 37.27 1u3n s ILE 58 CO 0.00 -0.63 -0.07 -1.61 -0.10 0.00 0.00 174.94 172.53 1u3n s GLU 59 N 1.80 2.75 -0.33 2.79 2.02 -1.20 -4.75 118.70 121.79 1u3n s GLU 59 Ca 0.06 -1.03 -0.11 0.00 0.02 0.00 0.00 54.97 53.91 1u3n s GLU 59 Cb -0.24 -2.97 -0.00 0.00 0.10 0.00 0.00 34.13 31.02 1u3n s GLU 59 CO 0.07 -0.42 0.18 0.42 0.02 0.00 0.00 175.26 175.53 1u3n s ILE 60 N 1.30 4.75 -0.95 -1.63 1.01 -1.26 -1.45 121.20 122.97 1u3n s ILE 60 Ca -0.01 -0.45 -0.03 0.00 0.00 0.00 0.00 60.65 60.16 1u3n s ILE 60 Cb -0.17 -3.47 0.24 0.00 0.01 0.00 0.00 42.46 39.07 1u3n s ILE 60 CO -0.05 -0.00 0.90 1.17 0.00 0.00 0.00 174.94 176.96 1u3n n LYS 61 N 5.01 2.93 -0.92 2.79 0.00 -1.26 -3.90 118.16 122.81 1u3n n LYS 61 Ca -0.13 -4.49 -0.31 0.00 0.00 0.00 0.00 58.31 53.39 1u3n n LYS 61 Cb 0.49 -2.44 0.02 0.00 0.00 0.00 0.00 35.03 33.09 1u3n n LYS 61 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1u3n n GLU 62 N 2.26 0.00 0.00 1.64 1.02 -1.26 -4.28 120.64 120.02 1u3n n GLU 62 Ca 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.37 1u3n n GLU 62 Cb 0.37 -0.81 0.00 0.00 -0.02 0.00 0.00 31.44 30.98 1u3n n GLU 62 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1u3n n SER 63 N 2.38 0.00 0.03 1.62 7.64 -1.26 -4.88 113.62 119.15 1u3n n SER 63 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1u3n n SER 63 Cb 0.41 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 1u3n n SER 63 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1u3n n ASP 64 N -0.92 0.44 0.04 6.43 -0.08 -1.26 -5.07 116.55 116.13 1u3n n ASP 64 Ca 0.00 0.08 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 1u3n n ASP 64 Cb 0.00 -0.12 0.00 0.00 2.34 0.00 0.00 41.12 43.34 1u3n n ASP 64 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1u3n n ASP 65 N -2.94 -0.64 -2.25 1.67 -0.08 -1.26 -5.14 116.55 105.91 1u3n n ASP 65 Ca 0.00 0.15 0.00 0.00 -1.51 0.00 0.00 54.79 53.43 1u3n n ASP 65 Cb 0.00 0.93 0.00 0.00 2.34 0.00 0.00 41.12 44.39 1u3n n ASP 65 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 1u3n n GLU 66 N -2.67 0.90 -0.83 -0.67 0.28 -1.26 -4.58 120.64 111.81 1u3n n GLU 66 Ca 0.00 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.70 1u3n n GLU 66 Cb 0.00 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 32.84 1u3n n GLU 66 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1u3n n GLY 67 N 5.00 -0.66 3.36 -1.84 0.00 0.33 -4.72 105.19 106.67 1u3n n GLY 67 Ca 0.00 0.30 -0.18 0.00 0.00 0.00 0.00 46.02 46.13 1u3n n GLY 67 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1u3n s LEU 68 N 1.01 2.24 -1.41 0.99 2.34 -1.26 -4.57 118.68 118.02 1u3n s LEU 68 Ca 0.43 -1.23 -0.10 0.00 0.06 0.00 0.00 54.13 53.29 1u3n s LEU 68 Cb -0.62 -0.35 0.07 0.00 -0.56 0.00 0.00 46.19 44.74 1u3n s LEU 68 CO 0.32 -0.49 2.29 0.47 -1.06 0.00 0.00 176.35 177.88 1u3n n ASP 69 N -0.48 6.06 -4.70 1.48 8.00 -1.26 -4.18 116.55 121.47 1u3n n ASP 69 Ca -0.05 -2.94 -0.42 0.00 0.71 0.00 0.00 54.79 52.10 1u3n n ASP 69 Cb 0.64 -1.52 -0.03 0.00 -0.02 0.00 0.00 41.12 40.19 1u3n n ASP 69 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1u3n s ILE 70 N 1.20 4.86 -1.08 0.53 -5.25 -1.26 -4.50 121.20 115.69 1u3n s ILE 70 Ca 0.50 1.91 -0.05 0.00 -0.99 0.00 0.00 60.65 62.03 1u3n s ILE 70 Cb 0.14 -4.26 0.31 0.00 2.95 0.00 0.00 42.46 41.60 1u3n s ILE 70 CO -0.05 0.09 1.44 0.00 -1.79 0.00 0.00 174.94 174.62 1u3n n HIS 71 N 4.55 2.61 -3.07 1.37 1.44 -0.53 0.99 115.22 122.58 1u3n n HIS 71 Ca 0.06 -2.74 -0.43 0.00 -2.01 0.00 0.00 57.72 52.59 1u3n n HIS 71 Cb 0.50 -1.30 0.01 0.00 0.12 0.00 0.00 29.99 29.31 1u3n n HIS 71 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 1u3n n ILE 72 N 1.47 5.19 -4.38 0.61 -6.64 -1.21 -3.22 119.36 111.17 1u3n n ILE 72 Ca 0.26 -5.84 -0.34 0.00 -1.77 0.00 0.00 62.75 55.06 1u3n n ILE 72 Cb 0.34 -2.16 -0.11 0.00 -1.44 0.00 0.00 39.64 36.26 1u3n n ILE 72 CO 0.00 0.00 0.00 -0.94 -1.77 0.00 0.00 176.55 173.84 1u3n s SER 73 N -1.27 4.91 0.00 7.28 1.04 -1.17 -4.54 113.70 119.94 1u3n s SER 73 Ca 0.31 -0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.67 1u3n s SER 73 Cb 0.02 -1.71 0.00 0.00 0.10 0.00 0.00 66.02 64.43 1u3n s SER 73 CO 0.07 0.21 0.00 0.00 0.98 0.00 0.00 173.24 174.51 1u3n n ALA 74 N 3.25 0.00 0.02 5.32 0.00 0.11 -2.40 120.51 126.82 1u3n n ALA 74 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1u3n n ALA 74 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1u3n n ALA 74 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1u3n n ASN 75 N 0.00 -0.31 -2.71 0.00 4.13 -1.24 -4.89 115.26 110.23 1u3n n ASN 75 Ca 0.00 0.08 -0.04 0.00 1.68 0.00 0.00 54.58 56.31 1u3n n ASN 75 Cb 0.00 0.58 0.02 0.00 -1.54 0.00 0.00 39.78 38.84 1u3n n ASN 75 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1u3n n SER 76 N -2.61 -2.45 -4.61 6.41 2.88 -1.26 -4.78 113.62 107.21 1u3n n SER 76 Ca 0.00 -1.94 -0.43 0.00 -1.33 0.00 0.00 58.87 55.17 1u3n n SER 76 Cb 0.00 1.24 -0.04 0.00 -0.75 0.00 0.00 64.21 64.67 1u3n n SER 76 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 1u3n s LEU 77 N 0.89 3.99 0.00 2.46 0.05 -1.25 -4.10 118.68 120.72 1u3n s LEU 77 Ca 0.27 0.62 0.00 0.00 0.05 0.00 0.00 54.13 55.06 1u3n s LEU 77 Cb 0.07 -3.28 0.00 0.00 -2.05 0.00 0.00 46.19 40.93 1u3n s LEU 77 CO -0.08 -0.86 0.00 0.54 -0.55 0.00 0.00 176.35 175.40 1u3n n ARG 78 N 6.78 0.00 0.00 1.48 1.74 -1.26 -4.77 116.66 120.62 1u3n n ARG 78 Ca 0.07 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.15 1u3n n ARG 78 Cb 0.48 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.92 1u3n n ARG 78 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1u3n n PRO 79 N 0.00 1.01 -2.74 5.56 -0.04 -1.26 -4.85 135.00 132.67 1u3n n PRO 79 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 1u3n n PRO 79 Cb 0.00 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 33.54 1u3n n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1u3n n GLY 80 N 3.75 1.80 0.00 0.55 0.00 -1.26 -2.11 105.19 107.91 1u3n n GLY 80 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1u3n n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u3n n ALA 81 N -0.87 0.00 -2.72 4.61 0.00 -1.25 -4.11 120.51 116.17 1u3n n ALA 81 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.33 1u3n n ALA 81 Cb 0.84 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.38 1u3n n ALA 81 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1u3n n SER 82 N 0.00 -2.26 -4.13 0.00 7.64 -1.26 -4.73 113.62 108.89 1u3n n SER 82 Ca 0.00 -3.46 -0.33 0.00 1.01 0.00 0.00 58.87 56.09 1u3n n SER 82 Cb 0.00 1.76 -0.16 0.00 -1.01 0.00 0.00 64.21 64.80 1u3n n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1u3n s LEU 83 N -2.44 2.24 -0.05 -3.43 2.01 -0.80 -4.14 118.68 112.07 1u3n s LEU 83 Ca 0.22 -0.67 0.04 0.00 0.01 0.00 0.00 54.13 53.73 1u3n s LEU 83 Cb 0.31 -1.50 0.00 0.00 0.01 0.00 0.00 46.19 45.01 1u3n s LEU 83 CO -0.06 -0.01 -0.15 -0.83 1.01 0.00 0.00 176.35 176.31 1u3n s GLY 84 N 1.29 0.86 -0.18 -3.19 0.00 -1.26 -4.40 107.32 100.44 1u3n s GLY 84 Ca 0.04 -0.61 -0.16 0.00 0.00 0.00 0.00 44.72 44.00 1u3n s GLY 84 CO -0.12 -0.25 0.49 -0.11 0.00 0.00 0.00 173.10 173.11 1u3n s PHE 85 N 0.16 -0.56 -0.30 1.90 -0.71 -1.26 -4.43 117.98 112.77 1u3n s PHE 85 Ca -0.06 1.34 -0.07 0.00 -1.04 0.00 0.00 56.93 57.10 1u3n s PHE 85 Cb -0.12 0.21 0.18 0.00 -1.21 0.00 0.00 43.02 42.09 1u3n s PHE 85 CO 0.02 -0.28 0.82 -1.58 -1.34 0.00 0.00 175.22 172.86 1u3n s HIS 86 N 0.46 -1.08 -0.47 3.49 2.46 -1.26 -4.69 115.29 114.19 1u3n s HIS 86 Ca -0.02 1.20 -0.42 0.00 0.47 0.00 0.00 55.06 56.29 1u3n s HIS 86 Cb -0.04 0.40 -0.18 0.00 -0.13 0.00 0.00 32.58 32.63 1u3n s HIS 86 CO -0.02 -0.59 1.93 -0.89 -2.47 0.00 0.00 174.74 172.70 1u3n n ILE 87 N 5.43 0.00 -3.51 0.89 2.08 -1.26 -4.89 119.36 118.10 1u3n n ILE 87 Ca -0.04 0.00 -0.22 0.00 0.56 0.00 0.00 62.75 63.05 1u3n n ILE 87 Cb 0.52 -0.47 -0.00 0.00 -0.75 0.00 0.00 39.64 38.94 1u3n n ILE 87 CO 0.00 0.00 0.00 -0.47 0.56 0.00 0.00 176.55 176.64 1u3n s TYR 88 N 5.16 2.11 -0.64 1.39 5.04 -1.24 -5.02 117.35 124.14 1u3n s TYR 88 Ca 1.11 -0.64 0.05 0.00 -2.44 0.00 0.00 57.07 55.14 1u3n s TYR 88 Cb -1.42 -2.12 0.30 0.00 0.35 0.00 0.00 41.96 39.08 1u3n s TYR 88 CO 0.65 -0.47 0.92 -0.85 -1.34 0.00 0.00 175.55 174.46 1u3n n GLU 89 N -1.78 3.08 -3.14 4.97 0.28 -1.26 -4.65 120.64 118.13 1u3n n GLU 89 Ca 0.05 -4.77 -0.15 0.00 -0.16 0.00 0.00 57.16 52.13 1u3n n GLU 89 Cb 0.62 -2.27 -0.05 0.00 1.43 0.00 0.00 31.44 31.17 1u3n n GLU 89 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1u3n s LYS 90 N -3.05 0.91 -1.04 3.44 1.02 -1.26 -4.96 119.74 114.80 1u3n s LYS 90 Ca 0.44 -1.41 -0.05 0.00 0.02 0.00 0.00 55.97 54.97 1u3n s LYS 90 Cb 0.21 -0.71 0.08 0.00 -0.52 0.00 0.00 37.83 36.89 1u3n s LYS 90 CO -0.07 -1.32 2.58 0.41 -0.92 0.00 0.00 175.35 176.03 1u3n n GLY 91 N 3.21 4.83 2.16 -3.33 0.00 -1.26 -4.08 105.19 106.72 1u3n n GLY 91 Ca 0.21 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.29 1u3n n GLY 91 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1u3n n SER 92 N 1.62 -3.01 -0.74 1.61 7.64 -1.26 -4.88 113.62 114.61 1u3n n SER 92 Ca 0.59 0.79 0.00 0.00 1.01 0.00 0.00 58.87 61.26 1u3n n SER 92 Cb 0.36 2.86 0.00 0.00 -1.01 0.00 0.00 64.21 66.42 1u3n n SER 92 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u3n n VAL 94 N -0.88 -7.83 -2.41 0.00 0.31 -1.26 -4.65 118.33 101.61 1u3n n VAL 94 Ca 0.00 0.06 -0.02 0.00 -0.01 0.00 0.00 64.34 64.37 1u3n n VAL 94 Cb 0.00 -6.07 -0.02 0.00 -0.91 0.00 0.00 33.84 26.84 1u3n n VAL 94 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1u3n n ARG 95 N -1.22 -3.13 0.05 5.55 3.00 -1.26 -4.99 116.66 114.67 1u3n n ARG 95 Ca 0.02 2.53 -0.08 0.00 -0.00 0.00 0.00 57.85 60.33 1u3n n ARG 95 Cb 0.45 -4.35 -0.06 0.00 0.00 0.00 0.00 32.46 28.50 1u3n n ARG 95 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 1u3n h PRO 96 N 2.74 -0.22 0.00 -0.14 0.13 -1.94 -3.47 132.00 129.09 1u3n h PRO 96 Ca -0.19 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1u3n h PRO 96 Cb 0.42 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.60 1u3n h PRO 96 CO 0.05 0.11 0.00 -3.47 -0.23 0.00 0.00 178.00 174.46 1u3n n ASP 97 N -4.91 0.00 -2.74 1.44 -0.08 -1.26 -5.01 116.55 103.98 1u3n n ASP 97 Ca -0.06 0.00 -0.04 0.00 -1.51 0.00 0.00 54.79 53.18 1u3n n ASP 97 Cb 0.21 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.64 1u3n n ASP 97 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1u3n n PHE 98 N 0.00 -3.32 -1.52 -0.67 3.72 -1.26 -4.79 117.46 109.62 1u3n n PHE 98 Ca 0.00 1.88 -0.48 0.00 -0.05 0.00 0.00 57.45 58.81 1u3n n PHE 98 Cb 0.00 -3.19 -0.03 0.00 -0.94 0.00 0.00 39.48 35.32 1u3n n PHE 98 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1u3n n GLU 99 N 1.81 0.79 0.00 -1.08 1.02 -1.26 -4.60 120.64 117.32 1u3n n GLU 99 Ca -0.28 0.28 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1u3n n GLU 99 Cb 0.45 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 1u3n n GLU 99 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1u3n n SER 100 N 1.68 0.00 -3.86 1.62 7.64 -1.26 -5.01 113.62 114.43 1u3n n SER 100 Ca 0.14 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.62 1u3n n SER 100 Cb 0.26 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.46 1u3n n SER 100 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u3n n ALA 101 N 0.00 5.19 -3.25 -0.43 0.00 -1.26 -4.88 120.51 115.88 1u3n n ALA 101 Ca 0.00 -4.77 0.03 0.00 0.00 0.00 0.00 53.44 48.70 1u3n n ALA 101 Cb 0.00 -2.12 -0.04 0.00 0.00 0.00 0.00 19.45 17.29 1u3n n ALA 101 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1u3n s GLY 102 N -1.87 0.02 -0.20 0.00 0.00 -1.26 -4.97 107.32 99.05 1u3n s GLY 102 Ca 0.34 3.31 -0.34 0.00 0.00 0.00 0.00 44.72 48.04 1u3n s GLY 102 CO 0.05 3.42 1.20 -0.32 0.00 0.00 0.00 173.10 177.46 1u3n s GLY 103 N 2.35 -0.24 0.00 0.20 0.00 -1.26 -5.12 107.32 103.26 1u3n s GLY 103 Ca -0.01 1.81 0.00 0.00 0.00 0.00 0.00 44.72 46.52 1u3n s GLY 103 CO -0.15 0.66 0.00 -1.55 0.00 0.00 0.00 173.10 172.06 1u3n n PRO 104 N 0.08 0.50 -2.92 2.90 -0.04 -1.26 -4.93 135.00 129.33 1u3n n PRO 104 Ca -0.01 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.01 1u3n n PRO 104 Cb 0.58 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.02 1u3n n PRO 104 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1u3n s PHE 105 N -0.34 3.18 0.00 0.54 5.36 -1.26 -4.75 117.98 120.72 1u3n s PHE 105 Ca 0.00 -1.53 0.00 0.00 -0.96 0.00 0.00 56.93 54.44 1u3n s PHE 105 Cb 0.00 -4.30 0.00 0.00 -0.34 0.00 0.00 43.02 38.38 1u3n s PHE 105 CO 0.00 -1.48 0.00 -1.71 -1.46 0.00 0.00 175.22 170.57 1u3n n ASN 106 N 6.43 0.00 -2.76 6.13 2.85 -1.26 -4.91 115.26 121.74 1u3n n ASN 106 Ca 0.27 0.00 -0.21 0.00 -0.11 0.00 0.00 54.58 54.53 1u3n n ASN 106 Cb 0.48 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.43 1u3n n ASN 106 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1u3n n PRO 107 N 0.00 2.23 -3.11 1.20 -0.04 -1.26 -4.70 135.00 129.33 1u3n n PRO 107 Ca 0.00 -1.34 -0.20 0.00 -0.04 0.00 0.00 63.50 61.92 1u3n n PRO 107 Cb 0.00 -2.29 0.02 0.00 -0.04 0.00 0.00 33.50 31.19 1u3n n PRO 107 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1u3n n LEU 108 N 3.38 -2.62 0.00 1.53 4.32 -1.26 -4.89 117.00 117.46 1u3n n LEU 108 Ca 0.48 0.07 0.00 0.00 -0.02 0.00 0.00 56.01 56.53 1u3n n LEU 108 Cb 0.39 -1.42 0.00 0.00 -1.62 0.00 0.00 43.42 40.78 1u3n n LEU 108 CO 0.51 -0.53 0.00 0.59 -1.22 0.00 0.00 177.39 176.73 1u3n n ASN 109 N 0.53 0.00 0.00 -1.43 4.13 -1.26 -5.16 115.26 112.07 1u3n n ASN 109 Ca -0.05 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.21 1u3n n ASN 109 Cb 0.54 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.78 1u3n n ASN 109 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 1u3n n LYS 110 N -0.72 0.00 -0.52 3.52 2.85 -1.26 -5.15 118.16 116.89 1u3n n LYS 110 Ca 0.00 0.00 0.07 0.00 -1.05 0.00 0.00 58.31 57.33 1u3n n LYS 110 Cb 0.00 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.36 1u3n n LYS 110 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1u3n n GLU 111 N 0.00 -1.04 -3.57 -1.58 1.02 -1.26 -4.87 120.64 109.34 1u3n n GLU 111 Ca 0.00 0.68 -0.23 0.00 -0.02 0.00 0.00 57.16 57.59 1u3n n GLU 111 Cb 0.00 -1.27 0.05 0.00 -0.02 0.00 0.00 31.44 30.20 1u3n n GLU 111 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 1u3n n HIS 112 N -2.10 -2.06 0.00 -0.32 -0.00 -1.24 -4.79 115.22 104.71 1u3n n HIS 112 Ca 0.00 0.72 0.00 0.00 -0.00 0.00 0.00 57.72 58.44 1u3n n HIS 112 Cb 0.23 -4.04 0.00 0.00 -0.00 0.00 0.00 29.99 26.19 1u3n n HIS 112 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1u3n n GLY 113 N -1.51 -1.13 0.36 1.57 0.00 -1.26 -4.99 105.19 98.23 1u3n n GLY 113 Ca -0.18 0.69 0.03 0.00 0.00 0.00 0.00 46.02 46.56 1u3n n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1u3n n PHE 114 N 0.00 0.21 -1.23 1.61 3.72 -1.26 -4.90 117.46 115.61 1u3n n PHE 114 Ca 0.00 1.19 0.00 0.00 -0.05 0.00 0.00 57.45 58.59 1u3n n PHE 114 Cb 0.00 -0.97 0.00 0.00 -0.94 0.00 0.00 39.48 37.57 1u3n n PHE 114 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1u3n n ASN 115 N -5.52 -1.64 0.00 4.37 5.15 -1.26 -5.01 115.26 111.36 1u3n n ASN 115 Ca 0.13 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.11 1u3n n ASN 115 Cb 0.44 -0.82 0.00 0.00 -0.53 0.00 0.00 39.78 38.88 1u3n n ASN 115 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1u3n n ASN 116 N 0.00 0.00 -4.56 1.20 5.15 -1.26 -5.03 115.26 110.76 1u3n n ASN 116 Ca 0.00 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.63 1u3n n ASN 116 Cb 0.00 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.21 1u3n n ASN 116 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1u3n s PRO 117 N 0.00 3.04 -0.75 1.20 0.04 -1.26 -4.29 135.00 132.99 1u3n s PRO 117 Ca 0.00 -0.49 -0.06 0.00 0.04 0.00 0.00 61.00 60.48 1u3n s PRO 117 Cb 0.00 -4.98 0.06 0.00 0.04 0.00 0.00 34.50 29.62 1u3n s PRO 117 CO 0.00 -2.70 0.16 0.00 0.04 0.00 0.00 177.00 174.50 1u3n n MET 118 N 8.98 -0.91 -3.48 4.56 0.00 -1.26 -4.61 117.12 120.39 1u3n n MET 118 Ca 0.30 0.05 -0.17 0.00 0.00 0.00 0.00 57.70 57.88 1u3n n MET 118 Cb 0.49 -1.82 -0.04 0.00 0.00 0.00 0.00 33.22 31.86 1u3n n MET 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1u3n n GLY 119 N -1.08 3.74 0.00 3.17 0.00 -1.26 -4.91 105.19 104.85 1u3n n GLY 119 Ca -0.02 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.80 1u3n n GLY 119 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1u3n n HIS 120 N -0.65 0.00 -0.18 1.61 8.25 -1.26 -4.55 115.22 118.44 1u3n n HIS 120 Ca -0.09 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.27 1u3n n HIS 120 Cb 0.36 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.39 1u3n n HIS 120 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1u3n h HIS 121 N 0.00 -1.45 0.00 4.41 3.86 -1.95 -3.28 115.15 116.74 1u3n h HIS 121 Ca 0.00 0.08 -0.04 0.00 -1.16 0.00 0.00 60.37 59.25 1u3n h HIS 121 Cb 0.00 0.69 -0.04 0.00 1.06 0.00 0.00 27.41 29.13 1u3n h HIS 121 CO 0.00 -0.37 -0.07 0.00 0.86 0.00 0.00 177.93 178.35 1u3n n ALA 122 N -3.07 -0.60 0.00 2.45 0.00 -1.26 -4.79 120.51 113.24 1u3n n ALA 122 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1u3n n ALA 122 Cb 0.26 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.23 1u3n n ALA 122 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u3n n GLY 123 N -0.27 2.91 1.25 0.00 0.00 -1.26 -4.93 105.19 102.89 1u3n n GLY 123 Ca -0.05 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.11 1u3n n GLY 123 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1u3n n ASP 124 N 0.33 -6.83 -4.59 1.61 -0.08 -1.26 -4.57 116.55 101.16 1u3n n ASP 124 Ca 0.00 0.83 -0.42 0.00 -1.51 0.00 0.00 54.79 53.68 1u3n n ASP 124 Cb 0.00 -4.04 -0.05 0.00 2.34 0.00 0.00 41.12 39.37 1u3n n ASP 124 CO 0.00 0.00 0.00 -1.48 0.12 0.00 0.00 177.20 175.84 1u3n s LEU 125 N -6.32 4.08 -0.74 -2.67 2.34 -1.26 -4.98 118.68 109.13 1u3n s LEU 125 Ca 0.00 0.39 -0.26 0.00 0.06 0.00 0.00 54.13 54.32 1u3n s LEU 125 Cb 0.00 -3.11 0.00 0.00 -0.56 0.00 0.00 46.19 42.52 1u3n s LEU 125 CO 0.00 -0.80 1.60 -2.16 -1.06 0.00 0.00 176.35 173.92 1u3n s PRO 126 N 3.27 2.95 0.49 1.48 0.04 -1.26 -4.79 135.00 137.18 1u3n s PRO 126 Ca 0.34 -0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.36 1u3n s PRO 126 Cb -0.13 -4.49 0.00 0.00 0.04 0.00 0.00 34.50 29.93 1u3n s PRO 126 CO 0.18 -2.52 0.00 0.09 0.04 0.00 0.00 177.00 174.80 1u3n n ASN 127 N 11.13 -8.12 -1.20 6.66 4.13 -1.26 -4.60 115.26 122.00 1u3n n ASN 127 Ca 0.17 1.07 0.00 0.00 1.68 0.00 0.00 54.58 57.50 1u3n n ASN 127 Cb 0.50 -4.52 0.00 0.00 -1.54 0.00 0.00 39.78 34.22 1u3n n ASN 127 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1u3n n LEU 128 N -4.23 -1.60 -3.23 3.41 4.77 -1.26 -4.59 117.00 110.27 1u3n n LEU 128 Ca -0.05 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.67 1u3n n LEU 128 Cb 0.65 -0.80 -0.06 0.00 -2.33 0.00 0.00 43.42 40.87 1u3n n LEU 128 CO 0.03 0.00 0.04 -1.84 -1.33 0.00 0.00 177.39 174.29 1u3n n GLU 129 N -0.26 2.43 0.00 3.23 0.28 -1.26 -1.91 120.64 123.15 1u3n n GLU 129 Ca 0.00 -4.48 0.00 0.00 -0.16 0.00 0.00 57.16 52.52 1u3n n GLU 129 Cb 0.00 -2.09 0.00 0.00 1.43 0.00 0.00 31.44 30.78 1u3n n GLU 129 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 177.13 178.52 1u3n n VAL 130 N 0.53 0.00 -0.32 3.84 3.14 -1.26 -3.83 118.33 120.44 1u3n n VAL 130 Ca 0.29 0.00 0.22 0.00 -2.96 0.00 0.00 64.34 61.89 1u3n n VAL 130 Cb 0.44 0.00 0.43 0.00 -1.06 0.00 0.00 33.84 33.65 1u3n n VAL 130 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1u3n h GLY 131 N 0.00 1.80 0.59 7.55 0.00 -1.58 1.51 103.07 112.95 1u3n h GLY 131 Ca 0.00 -0.08 0.09 0.00 0.00 0.00 0.00 47.33 47.34 1u3n h GLY 131 CO 0.00 -0.57 0.53 0.00 0.00 0.00 0.00 176.54 176.50 1u3n h ALA 132 N 1.91 1.25 -1.39 3.60 0.00 -1.82 0.14 119.26 122.95 1u3n h ALA 132 Ca 0.70 0.01 0.40 0.00 0.00 0.00 0.00 54.91 56.03 1u3n h ALA 132 Cb 1.64 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 19.17 1u3n h ALA 132 CO -0.74 0.20 0.98 0.22 0.00 0.00 0.00 179.25 179.91 1u3n h ASP 133 N 0.91 0.07 0.21 0.00 3.58 0.18 2.52 116.42 123.88 1u3n h ASP 133 Ca 0.41 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.87 1u3n h ASP 133 Cb 0.31 0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.37 1u3n h ASP 133 CO -0.22 -0.01 -0.05 1.23 -2.88 0.00 0.00 179.24 177.30 1u3n h GLY 134 N 0.05 0.00 -5.03 -0.78 0.00 -0.71 -3.05 103.07 93.55 1u3n h GLY 134 Ca 0.69 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 47.42 1u3n h GLY 134 CO -0.08 0.00 2.00 0.28 0.00 0.00 0.00 176.54 178.74 1u3n n LYS 135 N -3.61 3.57 -4.72 4.80 5.02 0.85 -0.71 118.16 123.36 1u3n n LYS 135 Ca -0.02 -2.57 -0.33 0.00 -2.02 0.00 0.00 58.31 53.37 1u3n n LYS 135 Cb 0.16 -2.49 -0.16 0.00 -0.02 0.00 0.00 35.03 32.52 1u3n n LYS 135 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1u3n s VAL 136 N -0.22 2.31 0.04 -0.18 1.01 -1.16 -4.99 120.40 117.21 1u3n s VAL 136 Ca 0.61 -0.90 -0.22 0.00 0.00 0.00 0.00 61.98 61.47 1u3n s VAL 136 Cb 0.24 -1.94 0.07 0.00 0.00 0.00 0.00 36.38 34.76 1u3n s VAL 136 CO -0.10 0.54 1.02 -0.90 0.00 0.00 0.00 175.10 175.66 1u3n n ASP 137 N 3.95 -1.17 -1.13 3.32 3.85 -1.26 -3.42 116.55 120.68 1u3n n ASP 137 Ca -0.19 -1.40 0.00 0.00 -0.71 0.00 0.00 54.79 52.49 1u3n n ASP 137 Cb 0.52 1.85 0.00 0.00 -1.35 0.00 0.00 41.12 42.14 1u3n n ASP 137 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.20 176.71 1u3n n VAL 138 N -0.73 -4.03 -4.20 2.12 0.31 0.28 -4.90 118.33 107.17 1u3n n VAL 138 Ca 0.02 1.68 -0.12 0.00 -0.01 0.00 0.00 64.34 65.91 1u3n n VAL 138 Cb 0.49 -2.38 -0.10 0.00 -0.91 0.00 0.00 33.84 30.94 1u3n n VAL 138 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1u3n s ILE 139 N -2.63 0.17 -0.27 2.52 -0.00 -1.26 -4.94 121.20 114.79 1u3n s ILE 139 Ca 0.00 -1.97 -0.02 0.00 -0.00 0.00 0.00 60.65 58.66 1u3n s ILE 139 Cb 0.00 -2.34 0.09 0.00 -0.00 0.00 0.00 42.46 40.21 1u3n s ILE 139 CO 0.00 -0.19 0.09 0.00 -0.00 0.00 0.00 174.94 174.84 1u3n s MET 140 N -4.09 0.56 -0.01 0.37 0.23 -1.26 -4.39 119.30 110.72 1u3n s MET 140 Ca 0.33 -0.74 -0.00 0.00 -1.03 0.00 0.00 55.69 54.25 1u3n s MET 140 Cb 0.07 -1.83 -0.00 0.00 -1.53 0.00 0.00 34.83 31.54 1u3n s MET 140 CO 0.08 -0.89 0.01 -1.71 -2.03 0.00 0.00 175.02 170.48 1u3n n ASN 141 N 5.01 -2.04 -4.73 -1.18 5.15 -1.26 -5.03 115.26 111.17 1u3n n ASN 141 Ca -0.05 -0.01 -0.40 0.00 -0.60 0.00 0.00 54.58 53.52 1u3n n ASN 141 Cb 0.44 -0.55 -0.05 0.00 -0.53 0.00 0.00 39.78 39.09 1u3n n ASN 141 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1u3n s ALA 142 N -3.00 3.33 0.08 5.20 0.00 -1.26 -4.94 121.76 121.15 1u3n s ALA 142 Ca 0.00 0.29 -0.14 0.00 0.00 0.00 0.00 51.96 52.11 1u3n s ALA 142 Cb -0.00 -3.04 -0.21 0.00 0.00 0.00 0.00 23.12 19.87 1u3n s ALA 142 CO 0.01 -0.02 1.22 -1.00 0.00 0.00 0.00 175.76 175.96 1u3n h PRO 143 N 6.11 0.70 -0.00 0.00 0.13 -1.96 0.96 132.00 137.95 1u3n h PRO 143 Ca -0.43 -0.68 0.00 0.00 -0.87 0.00 0.00 66.00 64.02 1u3n h PRO 143 Cb 1.21 0.18 -0.14 0.00 0.13 0.00 0.00 31.00 32.37 1u3n h PRO 143 CO 0.73 1.28 0.00 -3.47 -0.23 0.00 0.00 178.00 176.31 1u3n n ASP 144 N -3.93 -1.00 -3.65 1.44 4.64 -1.26 -4.61 116.55 108.17 1u3n n ASP 144 Ca -0.10 -1.04 -0.41 0.00 -1.38 0.00 0.00 54.79 51.86 1u3n n ASP 144 Cb 0.81 0.50 0.01 0.00 -1.04 0.00 0.00 41.12 41.40 1u3n n ASP 144 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 1u3n n THR 145 N 1.96 5.84 -0.97 5.18 -2.24 -1.26 -4.33 114.28 118.46 1u3n n THR 145 Ca 0.05 -5.62 0.00 0.00 -2.27 0.00 0.00 64.05 56.20 1u3n n THR 145 Cb 0.70 -1.72 0.00 0.00 -2.10 0.00 0.00 70.33 67.20 1u3n n THR 145 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1u3n n SER 146 N 0.52 -1.67 -3.48 3.42 3.41 -1.26 -4.91 113.62 109.66 1u3n n SER 146 Ca 0.48 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.82 1u3n n SER 146 Cb 0.27 -0.58 -0.09 0.00 -0.26 0.00 0.00 64.21 63.55 1u3n n SER 146 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u3n n LEU 147 N 0.00 3.33 -4.30 1.04 -0.00 -1.26 -4.37 117.00 111.44 1u3n n LEU 147 Ca 0.00 -5.34 -0.20 0.00 -0.00 0.00 0.00 56.01 50.47 1u3n n LEU 147 Cb 0.03 -0.57 -0.08 0.00 -0.00 0.00 0.00 43.42 42.80 1u3n n LEU 147 CO 0.00 2.01 -0.11 -0.75 -0.00 0.00 0.00 177.39 178.54 1u3n s LYS 148 N -2.20 1.80 0.00 1.47 2.47 -1.26 -4.37 119.74 117.65 1u3n s LYS 148 Ca 0.37 -2.05 0.00 0.00 -1.56 0.00 0.00 55.97 52.73 1u3n s LYS 148 Cb 0.12 0.27 0.00 0.00 -1.46 0.00 0.00 37.83 36.76 1u3n s LYS 148 CO -0.04 -0.65 0.57 0.36 0.16 0.00 0.00 175.35 175.74 1u3n n LYS 149 N -0.66 0.66 0.02 4.03 0.00 -1.26 -4.60 118.16 116.35 1u3n n LYS 149 Ca 0.07 -0.69 -0.00 0.00 -0.00 0.00 0.00 58.31 57.69 1u3n n LYS 149 Cb 0.62 -0.63 -0.00 0.00 -0.00 0.00 0.00 35.03 35.02 1u3n n LYS 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1u3n n GLY 150 N -0.12 0.01 0.14 2.58 0.00 -1.26 -4.89 105.19 101.65 1u3n n GLY 150 Ca 0.00 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 1u3n n GLY 150 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1u3n h SER 151 N -0.02 0.47 -4.35 1.61 0.87 -2.01 -3.51 113.55 106.62 1u3n h SER 151 Ca 0.00 -0.91 0.00 0.00 -1.23 0.00 0.00 61.79 59.65 1u3n h SER 151 Cb 0.02 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.83 1u3n h SER 151 CO 0.00 1.78 -0.85 0.29 -0.53 0.00 0.00 176.83 177.51 1u3n n LYS 152 N -3.65 -4.85 -1.84 2.24 5.02 -1.26 -4.51 118.16 109.29 1u3n n LYS 152 Ca -0.28 3.52 -0.11 0.00 -2.02 0.00 0.00 58.31 59.42 1u3n n LYS 152 Cb 1.01 -3.93 0.01 0.00 -0.02 0.00 0.00 35.03 32.10 1u3n n LYS 152 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 1u3n n LEU 153 N 1.67 -0.66 0.02 -0.35 -0.00 -1.26 -4.77 117.00 111.65 1u3n n LEU 153 Ca 0.00 -0.08 0.12 0.00 -0.00 0.00 0.00 56.01 56.06 1u3n n LEU 153 Cb 0.00 -0.44 0.24 0.00 -0.00 0.00 0.00 43.42 43.21 1u3n n LEU 153 CO 0.00 0.02 0.43 -3.20 -0.00 0.00 0.00 177.39 174.64 1u3n n ASN 154 N 0.54 0.54 -0.02 1.45 5.15 -1.26 -3.79 115.26 117.87 1u3n n ASN 154 Ca -0.03 -0.07 0.02 0.00 -0.60 0.00 0.00 54.58 53.90 1u3n n ASN 154 Cb 0.19 0.19 -0.09 0.00 -0.53 0.00 0.00 39.78 39.55 1u3n n ASN 154 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1u3n n ILE 155 N -1.73 0.25 0.00 -1.44 0.00 -1.26 -4.96 119.36 110.22 1u3n n ILE 155 Ca 0.05 -0.33 0.00 0.00 0.00 0.00 0.00 62.75 62.46 1u3n n ILE 155 Cb 0.38 -0.08 0.00 0.00 0.00 0.00 0.00 39.64 39.94 1u3n n ILE 155 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1u3n n LEU 156 N -2.07 0.00 -4.55 9.51 7.99 -1.25 -4.99 117.00 121.63 1u3n n LEU 156 Ca -0.07 0.00 -0.31 0.00 -0.01 0.00 0.00 56.01 55.61 1u3n n LEU 156 Cb 0.49 0.00 -0.11 0.00 -0.11 0.00 0.00 43.42 43.69 1u3n n LEU 156 CO 0.24 0.00 -0.42 -0.62 -1.51 0.00 0.00 177.39 175.08 1u3n s ASP 157 N -1.00 4.34 0.64 -1.43 2.15 0.31 -4.92 116.67 116.77 1u3n s ASP 157 Ca 0.00 -0.26 0.28 0.00 0.43 0.00 0.00 52.55 53.00 1u3n s ASP 157 Cb 0.00 -0.90 1.50 0.00 -0.30 0.00 0.00 42.92 43.21 1u3n s ASP 157 CO 0.00 0.26 1.86 -0.08 -0.17 0.00 0.00 175.17 177.04 1u3n h GLU 158 N 4.41 0.00 0.00 4.34 4.81 -1.91 -3.11 114.58 123.11 1u3n h GLU 158 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1u3n h GLU 158 Cb 1.16 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1u3n h GLU 158 CO 0.52 0.00 -0.08 -0.25 -0.73 0.00 0.00 179.01 178.46 1u3n n ASP 159 N -3.15 0.19 0.00 1.04 9.92 -1.26 -5.02 116.55 118.26 1u3n n ASP 159 Ca 0.02 0.03 0.00 0.00 -0.53 0.00 0.00 54.79 54.31 1u3n n ASP 159 Cb 0.51 -0.41 0.00 0.00 -0.64 0.00 0.00 41.12 40.58 1u3n n ASP 159 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1u3n n GLY 160 N 1.96 4.00 3.06 0.44 0.00 -0.72 -4.70 105.19 109.22 1u3n n GLY 160 Ca -0.01 -0.40 -0.06 0.00 0.00 0.00 0.00 46.02 45.55 1u3n n GLY 160 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1u3n s SER 161 N 1.24 -0.28 -0.40 1.61 1.04 -1.26 -0.53 113.70 115.13 1u3n s SER 161 Ca 0.00 0.56 -0.07 0.00 0.48 0.00 0.00 55.95 56.92 1u3n s SER 161 Cb 0.00 1.45 0.08 0.00 0.10 0.00 0.00 66.02 67.65 1u3n s SER 161 CO 0.00 -0.28 0.20 0.00 0.98 0.00 0.00 173.24 174.15 1u3n s ALA 162 N 2.64 3.18 -0.90 5.32 0.00 -1.26 -4.17 121.76 126.57 1u3n s ALA 162 Ca 0.12 -2.16 -0.02 0.00 0.00 0.00 0.00 51.96 49.89 1u3n s ALA 162 Cb -0.15 -2.48 0.22 0.00 0.00 0.00 0.00 23.12 20.72 1u3n s ALA 162 CO -0.17 -1.62 0.80 -0.06 0.00 0.00 0.00 175.76 174.72 1u3n s PHE 163 N 1.34 3.92 -0.28 0.00 0.08 -1.26 -3.73 117.98 118.05 1u3n s PHE 163 Ca 0.03 -2.99 -0.24 0.00 0.12 0.00 0.00 56.93 53.85 1u3n s PHE 163 Cb -0.22 -3.29 -0.00 0.00 -0.57 0.00 0.00 43.02 38.93 1u3n s PHE 163 CO 0.00 -0.76 0.79 0.42 -0.10 0.00 0.00 175.22 175.57 1u3n s ILE 164 N -1.31 4.83 0.07 0.64 1.09 -1.26 -4.58 121.20 120.68 1u3n s ILE 164 Ca 0.27 1.33 -0.20 0.00 -1.10 0.00 0.00 60.65 60.96 1u3n s ILE 164 Cb -0.08 -4.11 -0.07 0.00 -1.06 0.00 0.00 42.46 37.14 1u3n s ILE 164 CO -0.12 -0.15 0.59 -0.63 -0.10 0.00 0.00 174.94 174.53 1u3n s ILE 165 N 2.87 4.74 -0.10 2.92 1.09 -0.97 -4.75 121.20 127.00 1u3n s ILE 165 Ca 0.33 1.27 -0.31 0.00 -1.10 0.00 0.00 60.65 60.83 1u3n s ILE 165 Cb -0.15 -3.93 0.11 0.00 -1.06 0.00 0.00 42.46 37.44 1u3n s ILE 165 CO 0.10 0.53 1.39 -1.38 -0.10 0.00 0.00 174.94 175.48 1u3n s HIS 166 N -0.94 0.00 0.00 3.97 -3.43 -1.26 -3.75 115.29 109.88 1u3n s HIS 166 Ca 0.30 -0.01 0.00 0.00 -0.80 0.00 0.00 55.06 54.55 1u3n s HIS 166 Cb -0.20 0.50 0.00 0.00 -1.43 0.00 0.00 32.58 31.46 1u3n s HIS 166 CO 0.19 -0.01 0.00 0.39 -2.00 0.00 0.00 174.74 173.31 1u3n n GLU 167 N -0.90 0.00 -3.89 -0.38 1.02 -1.25 -4.71 120.64 110.53 1u3n n GLU 167 Ca 0.04 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.08 1u3n n GLU 167 Cb 0.59 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 32.00 1u3n n GLU 167 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1u3n s GLN 168 N 0.00 1.96 1.43 3.49 -0.21 -1.25 -4.48 119.66 120.59 1u3n s GLN 168 Ca 0.00 -1.33 0.00 0.00 0.02 0.00 0.00 55.36 54.05 1u3n s GLN 168 Cb 0.00 0.57 0.00 0.00 1.00 0.00 0.00 33.01 34.58 1u3n s GLN 168 CO 0.00 -0.88 0.00 0.00 -2.12 0.00 0.00 175.29 172.29 1u3n n ALA 169 N -0.49 0.00 0.00 6.09 0.00 -1.18 -4.57 120.51 120.36 1u3n n ALA 169 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1u3n n ALA 169 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 1u3n n ALA 169 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1u3n n ASP 170 N 0.13 0.00 0.00 0.00 8.00 -1.26 -3.43 116.55 119.99 1u3n n ASP 170 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1u3n n ASP 170 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1u3n n ASP 170 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1u3n n ASP 171 N 2.86 0.00 -2.84 -2.24 2.03 -1.26 -4.35 116.55 110.74 1u3n n ASP 171 Ca 0.00 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.14 1u3n n ASP 171 Cb 0.00 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.36 1u3n n ASP 171 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1u3n n TYR 172 N 0.00 0.88 -0.06 -0.67 9.36 -1.26 -1.75 117.16 123.66 1u3n n TYR 172 Ca 0.00 -1.57 0.00 0.00 3.32 0.00 0.00 57.90 59.65 1u3n n TYR 172 Cb 0.00 -1.46 0.00 0.00 -0.63 0.00 0.00 39.34 37.25 1u3n n TYR 172 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1u3n n LEU 173 N 3.69 0.42 0.00 2.98 4.77 -1.26 -5.00 117.00 122.60 1u3n n LEU 173 Ca 0.37 -0.65 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 1u3n n LEU 173 Cb 0.26 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1u3n n LEU 173 CO 0.52 0.11 0.00 1.07 -1.33 0.00 0.00 177.39 177.76 1u3n n THR 174 N -0.45 0.00 -1.23 -5.08 5.66 -1.22 -4.75 114.28 107.20 1u3n n THR 174 Ca 0.00 0.00 0.16 0.00 -3.05 0.00 0.00 64.05 61.16 1u3n n THR 174 Cb 0.02 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 68.75 1u3n n THR 174 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1u3n n ASN 175 N -2.66 -7.23 -2.66 1.09 3.02 -1.26 -1.65 115.26 103.90 1u3n n ASN 175 Ca 0.00 0.56 -0.19 0.00 -0.03 0.00 0.00 54.58 54.92 1u3n n ASN 175 Cb 0.00 -3.85 -0.08 0.00 -0.61 0.00 0.00 39.78 35.25 1u3n n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1u3n n PRO 176 N -3.70 2.12 0.00 3.52 -0.04 -1.26 -2.77 135.00 132.87 1u3n n PRO 176 Ca 0.00 -1.25 0.00 0.00 -0.04 0.00 0.00 63.50 62.21 1u3n n PRO 176 Cb 0.64 -2.23 0.00 0.00 -0.04 0.00 0.00 33.50 31.88 1u3n n PRO 176 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1u3n n SER 177 N 3.26 0.00 -3.26 3.54 2.88 -1.23 -5.14 113.62 113.68 1u3n n SER 177 Ca 0.45 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 58.03 1u3n n SER 177 Cb 0.44 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.87 1u3n n SER 177 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1u3n s GLY 178 N 0.00 -0.36 0.01 0.46 0.00 -0.66 -4.79 107.32 101.98 1u3n s GLY 178 Ca 0.00 2.77 -0.05 0.00 0.00 0.00 0.00 44.72 47.44 1u3n s GLY 178 CO 0.00 3.50 1.08 3.43 0.00 0.00 0.00 173.10 181.11 1u3n h ASN 179 N 7.78 -0.18 0.00 1.64 2.35 -1.82 -3.29 115.58 122.06 1u3n h ASN 179 Ca -0.16 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 1u3n h ASN 179 Cb 1.15 0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.57 1u3n h ASN 179 CO 0.03 -0.11 0.00 -0.24 -1.65 0.00 0.00 177.43 175.47 1u3n n SER 180 N -2.61 0.00 0.00 5.81 2.88 -0.72 -4.72 113.62 114.26 1u3n n SER 180 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1u3n n SER 180 Cb 0.07 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 1u3n n SER 180 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1u3n n GLY 181 N 0.00 -0.57 1.38 0.46 0.00 -1.24 -3.12 105.19 102.09 1u3n n GLY 181 Ca 0.00 0.28 0.17 0.00 0.00 0.00 0.00 46.02 46.47 1u3n n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u3n n ALA 182 N 0.00 -3.60 -2.40 4.61 0.00 -1.26 -4.59 120.51 113.26 1u3n n ALA 182 Ca 0.00 0.75 -0.43 0.00 0.00 0.00 0.00 53.44 53.76 1u3n n ALA 182 Cb 0.00 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.00 1u3n n ALA 182 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1u3n s ARG 183 N -3.57 3.71 0.00 0.00 3.52 -1.26 -3.82 118.95 117.53 1u3n s ARG 183 Ca 0.00 1.00 0.00 0.00 -0.13 0.00 0.00 55.73 56.60 1u3n s ARG 183 Cb 0.00 -3.96 0.00 0.00 -1.56 0.00 0.00 34.95 29.43 1u3n s ARG 183 CO 0.00 -1.39 0.00 0.44 -0.81 0.00 0.00 175.30 173.54 1u3n n ILE 184 N 6.75 0.00 -4.16 4.11 -0.00 -1.26 -5.04 119.36 119.76 1u3n n ILE 184 Ca 0.15 0.00 -0.34 0.00 -0.00 0.00 0.00 62.75 62.56 1u3n n ILE 184 Cb 0.48 -0.23 -0.13 0.00 -0.00 0.00 0.00 39.64 39.75 1u3n n ILE 184 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1u3n s VAL 185 N -1.38 3.56 -0.18 7.28 0.11 -1.24 -4.57 120.40 123.98 1u3n s VAL 185 Ca 0.00 -0.45 -0.16 0.00 -2.93 0.00 0.00 61.98 58.44 1u3n s VAL 185 Cb 0.00 -2.59 0.05 0.00 -1.53 0.00 0.00 36.38 32.30 1u3n s VAL 185 CO 0.00 0.45 0.47 0.00 -3.33 0.00 0.00 175.10 172.69 1u3n n GLY 187 N 2.85 2.66 2.65 0.00 0.00 -0.53 -4.39 105.19 108.43 1u3n n GLY 187 Ca -0.13 -2.14 -0.27 0.00 0.00 0.00 0.00 46.02 43.47 1u3n n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u3n n ALA 188 N -3.00 3.32 -0.95 4.61 0.00 -1.21 -4.59 120.51 118.68 1u3n n ALA 188 Ca 0.00 -4.15 -0.30 0.00 0.00 0.00 0.00 53.44 48.99 1u3n n ALA 188 Cb 0.00 -0.93 0.01 0.00 0.00 0.00 0.00 19.45 18.53 1u3n n ALA 188 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1u3n n LEU 189 N 1.95 -2.76 -4.60 0.00 -0.00 -1.26 -4.19 117.00 106.14 1u3n n LEU 189 Ca 0.24 0.51 -0.43 0.00 -0.00 0.00 0.00 56.01 56.33 1u3n n LEU 189 Cb 0.40 -0.65 -0.03 0.00 -0.00 0.00 0.00 43.42 43.15 1u3n n LEU 189 CO 0.24 -3.63 0.93 -1.48 -0.00 0.00 0.00 177.39 173.44 1u3n s LEU 190 N 3.80 3.80 -0.03 1.47 0.05 -1.26 -4.84 118.68 121.67 1u3n s LEU 190 Ca 0.44 0.47 -0.04 0.00 0.05 0.00 0.00 54.13 55.04 1u3n s LEU 190 Cb -0.38 -3.43 -0.02 0.00 -2.05 0.00 0.00 46.19 40.30 1u3n s LEU 190 CO 0.50 -1.12 0.33 1.23 -0.55 0.00 0.00 176.35 176.74 1u3n h GLY 191 N 10.81 -0.17 -2.95 -3.48 0.00 -1.86 -1.92 103.07 103.50 1u3n h GLY 191 Ca -0.23 0.06 0.32 0.00 0.00 0.00 0.00 47.33 47.48 1u3n h GLY 191 CO 1.08 -0.06 -0.84 -2.01 0.00 0.00 0.00 176.54 174.71 1u3n n ASN 192 N -3.32 -7.47 -2.91 0.19 5.15 -1.26 -4.52 115.26 101.12 1u3n n ASN 192 Ca -0.02 0.95 0.02 0.00 -0.60 0.00 0.00 54.58 54.93 1u3n n ASN 192 Cb 0.06 -4.11 0.00 0.00 -0.53 0.00 0.00 39.78 35.20 1u3n n ASN 192 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1u3n s ASN 193 N -6.94 -0.64 -0.25 1.20 2.20 -1.26 -5.05 114.94 104.19 1u3n s ASN 193 Ca 0.00 -0.28 -0.02 0.00 -0.94 0.00 0.00 52.86 51.62 1u3n s ASN 193 Cb 0.00 0.89 0.00 0.00 -2.00 0.00 0.00 41.25 40.14 1u3n s ASN 193 CO 0.00 -0.08 0.08 -0.62 -2.94 0.00 0.00 177.10 173.55 1u3n n GLU 194 N 4.03 -2.49 -1.89 3.55 1.02 -1.26 -4.89 120.64 118.70 1u3n n GLU 194 Ca 0.07 2.14 -0.42 0.00 -0.02 0.00 0.00 57.16 58.93 1u3n n GLU 194 Cb 0.61 -4.37 -0.03 0.00 -0.02 0.00 0.00 31.44 27.63 1u3n n GLU 194 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1u3n s LYS 195 N -1.41 4.20 0.00 3.49 2.20 -1.26 -5.32 119.74 121.63 1u3n s LYS 195 Ca 0.04 2.42 0.00 0.00 -0.36 0.00 0.00 55.97 58.06 1u3n s LYS 195 Cb -0.01 -3.13 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 1u3n s LYS 195 CO 0.59 -0.62 0.00 1.04 -0.36 0.00 0.00 175.35 175.99