#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 -0.51 -0.26 3.34 0.11 -1.26 -5.17 120.40 116.65 1u3n s VAL 36 Ca 0.00 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 58.78 1u3n s VAL 36 Cb 0.00 -1.00 0.16 0.00 -1.53 0.00 0.00 36.38 34.01 1u3n s VAL 36 CO 0.00 0.00 1.23 -0.70 -3.33 0.00 0.00 175.10 172.30 1u3n s GLU 37 N 2.41 0.29 0.21 1.54 2.12 -1.26 -5.15 118.70 118.86 1u3n s GLU 37 Ca -0.03 0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.51 1u3n s GLU 37 Cb -0.06 0.14 0.00 0.00 0.26 0.00 0.00 34.13 34.46 1u3n s GLU 37 CO -0.17 -0.06 0.00 -2.37 -0.54 0.00 0.00 175.26 172.12 1u3n n THR 38 N 1.35 0.00 0.00 -1.70 5.66 -1.26 -4.97 114.28 113.37 1u3n n THR 38 Ca -0.09 0.09 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1u3n n THR 38 Cb 0.57 -0.36 0.00 0.00 -1.55 0.00 0.00 70.33 68.99 1u3n n THR 38 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1u3n n SER 39 N -4.33 0.00 0.00 1.09 2.88 -1.26 -5.01 113.62 106.99 1u3n n SER 39 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1u3n n SER 39 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 1u3n n SER 39 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1u3n n ALA 40 N 0.00 0.00 -0.55 -1.46 0.00 -1.26 -4.67 120.51 112.57 1u3n n ALA 40 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1u3n n ALA 40 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1u3n n ALA 40 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1u3n n PHE 41 N 0.00 0.94 -0.04 0.00 1.16 -1.26 -4.70 117.46 113.56 1u3n n PHE 41 Ca 0.00 -1.53 -0.01 0.00 -1.87 0.00 0.00 57.45 54.04 1u3n n PHE 41 Cb 0.00 -1.37 -0.01 0.00 -1.61 0.00 0.00 39.48 36.49 1u3n n PHE 41 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1u3n n GLY 42 N 3.72 -2.59 3.34 4.97 0.00 -1.26 -4.18 105.19 109.19 1u3n n GLY 42 Ca 0.33 0.56 -0.54 0.00 0.00 0.00 0.00 46.02 46.36 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 -3.12 1.22 -3.55 1.61 8.25 -1.26 -4.82 115.22 113.54 1u3n n HIS 43 Ca 0.00 0.56 -0.06 0.00 -0.26 0.00 0.00 57.72 57.96 1u3n n HIS 43 Cb 0.03 -2.38 -0.02 0.00 1.12 0.00 0.00 29.99 28.74 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 6.92 -0.24 -0.00 4.41 -0.00 -1.26 -3.58 115.29 121.54 1u3n s HIS 44 Ca 1.18 0.13 -0.00 0.00 -0.00 0.00 0.00 55.06 56.38 1u3n s HIS 44 Cb -1.25 0.53 0.00 0.00 -0.00 0.00 0.00 32.58 31.87 1u3n s HIS 44 CO 0.58 -0.40 0.01 0.08 -0.00 0.00 0.00 174.74 175.01 1u3n s VAL 45 N -2.81 -0.01 -0.46 -5.38 1.01 -1.26 -4.83 120.40 106.66 1u3n s VAL 45 Ca 0.07 0.03 -0.28 0.00 0.00 0.00 0.00 61.98 61.81 1u3n s VAL 45 Cb -0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 36.38 36.33 1u3n s VAL 45 CO -0.07 0.01 1.80 0.00 0.00 0.00 0.00 175.10 176.85 1u3n s GLN 46 N 0.15 3.02 -0.79 2.72 -2.07 -1.26 -4.20 119.66 117.23 1u3n s GLN 46 Ca -0.01 1.03 -0.24 0.00 -1.82 0.00 0.00 55.36 54.32 1u3n s GLN 46 Cb -0.02 -4.27 0.06 0.00 -1.09 0.00 0.00 33.01 27.69 1u3n s GLN 46 CO -0.00 -2.24 1.21 -0.51 -1.32 0.00 0.00 175.29 172.42 1u3n s LEU 47 N 7.81 3.80 -0.24 2.60 1.43 -1.26 -4.90 118.68 127.92 1u3n s LEU 47 Ca 0.73 -0.98 -0.08 0.00 -1.03 0.00 0.00 54.13 52.76 1u3n s LEU 47 Cb -0.17 -2.50 -0.04 0.00 0.03 0.00 0.00 46.19 43.51 1u3n s LEU 47 CO 0.28 -1.57 0.10 -0.69 0.23 0.00 0.00 176.35 174.70 1u3n s VAL 48 N 4.76 4.71 0.70 -1.59 1.01 -1.26 -1.27 120.40 127.46 1u3n s VAL 48 Ca 0.33 -0.04 -0.09 0.00 0.00 0.00 0.00 61.98 62.18 1u3n s VAL 48 Cb -0.09 -3.19 0.04 0.00 0.00 0.00 0.00 36.38 33.14 1u3n s VAL 48 CO 0.06 0.35 1.04 0.21 0.00 0.00 0.00 175.10 176.76 1u3n s ASN 49 N 1.31 5.15 0.08 3.32 3.84 -1.25 -4.34 114.94 123.04 1u3n s ASN 49 Ca 0.06 0.79 -0.25 0.00 0.21 0.00 0.00 52.86 53.67 1u3n s ASN 49 Cb -0.15 -1.55 -0.16 0.00 -0.55 0.00 0.00 41.25 38.85 1u3n s ASN 49 CO 0.05 -1.44 1.68 -0.09 -2.79 0.00 0.00 177.10 174.51 1u3n h ARG 50 N -0.59 -0.17 0.00 0.43 2.43 -1.95 -3.29 114.38 111.25 1u3n h ARG 50 Ca -0.45 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.71 1u3n h ARG 50 Cb 1.28 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.87 1u3n h ARG 50 CO 0.63 -0.08 -1.08 0.39 -1.51 0.00 0.00 179.97 178.31 1u3n n GLU 51 N -5.15 1.09 -0.36 0.20 1.02 -1.26 -4.66 120.64 111.51 1u3n n GLU 51 Ca -0.08 0.01 0.29 0.00 -0.02 0.00 0.00 57.16 57.36 1u3n n GLU 51 Cb 0.11 -1.03 0.59 0.00 -0.02 0.00 0.00 31.44 31.09 1u3n n GLU 51 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1u3n h GLY 52 N 0.15 1.01 0.00 0.62 0.00 -1.92 -3.44 103.07 99.49 1u3n h GLY 52 Ca -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1u3n h GLY 52 CO -0.00 -0.18 0.00 1.17 0.00 0.00 0.00 176.54 177.52 1u3n n LYS 53 N -4.56 0.00 0.00 4.80 3.00 -1.24 -4.88 118.16 115.28 1u3n n LYS 53 Ca 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.60 1u3n n LYS 53 Cb 1.11 -0.30 0.00 0.00 0.00 0.00 0.00 35.03 35.84 1u3n n LYS 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1u3n n ALA 54 N -0.89 0.00 -1.03 3.14 0.00 -1.26 -3.95 120.51 116.52 1u3n n ALA 54 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1u3n n ALA 54 Cb 0.00 0.00 0.30 0.00 0.00 0.00 0.00 19.45 19.75 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 -0.03 2.58 0.00 0.00 0.24 -0.40 -4.46 118.33 116.27 1u3n n VAL 55 Ca 0.00 -1.81 0.00 0.00 -2.04 0.00 0.00 64.34 60.49 1u3n n VAL 55 Cb 0.00 -0.29 0.00 0.00 -1.47 0.00 0.00 33.84 32.08 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 -0.24 0.19 3.40 7.63 0.00 -1.26 -3.72 105.19 111.19 1u3n n GLY 56 Ca 0.29 -1.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.42 1u3n n GLY 56 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1u3n s PHE 57 N 0.00 -0.41 -0.11 1.61 -0.12 -1.26 -4.48 117.98 113.21 1u3n s PHE 57 Ca 0.00 0.15 -0.04 0.00 -0.05 0.00 0.00 56.93 56.99 1u3n s PHE 57 Cb 0.00 0.46 -0.03 0.00 -0.63 0.00 0.00 43.02 42.81 1u3n s PHE 57 CO 0.00 -0.81 0.02 0.42 -0.05 0.00 0.00 175.22 174.80 1u3n s ILE 58 N -3.78 4.47 -0.44 -4.49 -1.09 -1.26 -4.22 121.20 110.40 1u3n s ILE 58 Ca 0.02 -0.17 0.07 0.00 -2.23 0.00 0.00 60.65 58.34 1u3n s ILE 58 Cb -0.00 -2.92 0.24 0.00 -1.58 0.00 0.00 42.46 38.20 1u3n s ILE 58 CO -0.12 0.57 0.69 -0.62 -1.23 0.00 0.00 174.94 174.23 1u3n n GLU 59 N 2.53 0.72 -2.90 2.79 1.02 -1.26 -4.67 120.64 118.87 1u3n n GLU 59 Ca -0.18 -2.52 -0.43 0.00 -0.02 0.00 0.00 57.16 54.01 1u3n n GLU 59 Cb 0.53 -1.35 -0.05 0.00 -0.02 0.00 0.00 31.44 30.56 1u3n n GLU 59 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1u3n s ILE 60 N -0.23 4.50 -0.88 -3.67 1.01 -1.23 -3.20 121.20 117.49 1u3n s ILE 60 Ca 0.33 0.21 -0.07 0.00 0.00 0.00 0.00 60.65 61.13 1u3n s ILE 60 Cb 0.19 -4.47 0.22 0.00 0.01 0.00 0.00 42.46 38.41 1u3n s ILE 60 CO -0.17 -1.01 0.79 -1.59 0.00 0.00 0.00 174.94 172.96 1u3n s LYS 61 N 3.67 3.44 -0.08 2.79 0.00 -1.26 -4.57 119.74 123.72 1u3n s LYS 61 Ca 0.28 -2.92 -0.23 0.00 0.00 0.00 0.00 55.97 53.10 1u3n s LYS 61 Cb -0.13 -4.17 -0.11 0.00 0.00 0.00 0.00 37.83 33.42 1u3n s LYS 61 CO 0.19 -1.25 0.66 0.39 0.00 0.00 0.00 175.35 175.35 1u3n n GLU 62 N 3.04 0.00 0.00 1.78 4.71 -1.26 -4.49 120.64 124.42 1u3n n GLU 62 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.32 1u3n n GLU 62 Cb 0.40 -0.81 0.00 0.00 -1.01 0.00 0.00 31.44 30.02 1u3n n GLU 62 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1u3n n SER 63 N 1.21 0.00 -2.71 1.62 2.88 -1.07 -4.90 113.62 110.65 1u3n n SER 63 Ca 0.13 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.62 1u3n n SER 63 Cb 0.02 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 63.51 1u3n n SER 63 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1u3n n ASP 64 N 0.00 -2.36 0.00 -3.46 9.92 -1.26 -3.07 116.55 116.32 1u3n n ASP 64 Ca 0.00 -2.09 0.00 0.00 -0.53 0.00 0.00 54.79 52.17 1u3n n ASP 64 Cb 0.00 1.25 0.00 0.00 -0.64 0.00 0.00 41.12 41.73 1u3n n ASP 64 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1u3n n ASP 65 N 2.45 0.00 -3.58 -2.24 8.00 -1.26 -5.06 116.55 114.85 1u3n n ASP 65 Ca 0.12 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.50 1u3n n ASP 65 Cb 0.62 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.67 1u3n n ASP 65 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1u3n s GLU 66 N 0.00 1.06 0.27 -1.24 2.02 -1.26 -5.05 118.70 114.50 1u3n s GLU 66 Ca 0.00 -0.42 0.00 0.00 0.02 0.00 0.00 54.97 54.57 1u3n s GLU 66 Cb 0.00 0.48 0.00 0.00 0.10 0.00 0.00 34.13 34.71 1u3n s GLU 66 CO 0.00 -0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.29 1u3n n GLY 67 N 0.13 0.50 3.31 -1.39 0.00 -1.26 -4.39 105.19 102.09 1u3n n GLY 67 Ca -0.17 0.26 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 0.42 -0.32 0.99 0.05 -1.21 -2.82 118.68 115.78 1u3n s LEU 68 Ca 0.00 -0.28 0.14 0.00 0.05 0.00 0.00 54.13 54.04 1u3n s LEU 68 Cb 0.00 1.81 0.42 0.00 -2.05 0.00 0.00 46.19 46.37 1u3n s LEU 68 CO 0.00 -0.83 1.47 -0.67 -0.55 0.00 0.00 176.35 175.78 1u3n n ASP 69 N -0.13 -1.00 -4.76 1.48 -0.08 -1.26 -1.82 116.55 108.97 1u3n n ASP 69 Ca -0.16 -2.19 -0.27 0.00 -1.51 0.00 0.00 54.79 50.67 1u3n n ASP 69 Cb 0.63 0.51 0.10 0.00 2.34 0.00 0.00 41.12 44.69 1u3n n ASP 69 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1u3n s ILE 70 N -0.46 2.18 -0.73 5.18 -5.25 -1.25 -4.73 121.20 116.13 1u3n s ILE 70 Ca 0.12 -0.23 0.03 0.00 -0.99 0.00 0.00 60.65 59.58 1u3n s ILE 70 Cb 0.42 -2.95 0.29 0.00 2.95 0.00 0.00 42.46 43.17 1u3n s ILE 70 CO -0.11 0.00 1.02 1.57 -1.79 0.00 0.00 174.94 175.62 1u3n n HIS 71 N -3.11 3.45 -3.52 1.37 -0.00 -1.20 -4.51 115.22 107.71 1u3n n HIS 71 Ca 0.10 -3.71 -0.38 0.00 0.46 0.00 0.00 57.72 54.19 1u3n n HIS 71 Cb 0.60 -0.71 -0.10 0.00 -0.12 0.00 0.00 29.99 29.67 1u3n n HIS 71 CO 0.00 0.00 0.00 0.96 0.46 0.00 0.00 176.34 177.76 1u3n s ILE 72 N -3.21 5.26 -0.28 3.57 -5.25 -1.24 -4.53 121.20 115.53 1u3n s ILE 72 Ca 0.41 0.37 -0.00 0.00 -0.99 0.00 0.00 60.65 60.44 1u3n s ILE 72 Cb 0.17 -3.60 0.17 0.00 2.95 0.00 0.00 42.46 42.14 1u3n s ILE 72 CO -0.03 0.24 0.49 -0.94 -1.79 0.00 0.00 174.94 172.91 1u3n s SER 73 N 1.46 -0.53 0.93 4.36 1.04 -1.25 -4.22 113.70 115.49 1u3n s SER 73 Ca 0.11 0.31 -0.15 0.00 0.48 0.00 0.00 55.95 56.71 1u3n s SER 73 Cb -0.15 1.59 0.17 0.00 0.10 0.00 0.00 66.02 67.73 1u3n s SER 73 CO 0.09 -0.30 1.29 0.00 0.98 0.00 0.00 173.24 175.30 1u3n s ALA 74 N 2.69 2.35 -0.98 5.32 0.00 0.29 -4.54 121.76 126.89 1u3n s ALA 74 Ca 0.14 -1.11 0.25 0.00 0.00 0.00 0.00 51.96 51.25 1u3n s ALA 74 Cb -0.14 -2.79 0.56 0.00 0.00 0.00 0.00 23.12 20.75 1u3n s ALA 74 CO -0.22 -2.27 1.46 0.09 0.00 0.00 0.00 175.76 174.82 1u3n n ASN 75 N -3.66 0.46 -3.92 0.00 4.13 -1.24 -2.59 115.26 108.45 1u3n n ASN 75 Ca 0.14 -0.16 -0.35 0.00 1.68 0.00 0.00 54.58 55.89 1u3n n ASN 75 Cb 0.60 0.18 0.01 0.00 -1.54 0.00 0.00 39.78 39.03 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 -1.53 -3.26 0.00 6.41 2.88 -1.24 -3.54 113.62 113.34 1u3n n SER 76 Ca 0.06 -1.13 0.00 0.00 -1.33 0.00 0.00 58.87 56.47 1u3n n SER 76 Cb 0.34 -2.63 0.00 0.00 -0.75 0.00 0.00 64.21 61.17 1u3n n SER 76 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1u3n n LEU 77 N -4.53 0.00 0.00 2.46 4.77 -1.26 -4.36 117.00 114.07 1u3n n LEU 77 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1u3n n LEU 77 Cb 0.61 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 1u3n n LEU 77 CO 0.73 0.00 0.00 -1.14 -1.33 0.00 0.00 177.39 175.65 1u3n n ARG 78 N 0.00 0.00 -0.95 3.23 0.63 -1.26 -5.02 116.66 113.29 1u3n n ARG 78 Ca 0.00 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.66 1u3n n ARG 78 Cb 0.00 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.88 1u3n n ARG 78 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1u3n n PRO 79 N 0.00 2.63 -3.75 -0.14 -0.04 -1.26 -4.65 135.00 127.79 1u3n n PRO 79 Ca 0.00 -1.65 -0.19 0.00 -0.04 0.00 0.00 63.50 61.62 1u3n n PRO 79 Cb 0.00 -2.51 -0.00 0.00 -0.04 0.00 0.00 33.50 30.94 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 3.56 -0.28 3.92 0.55 0.00 -1.26 -4.77 105.19 106.90 1u3n n GLY 80 Ca 0.56 0.13 -0.27 0.00 0.00 0.00 0.00 46.02 46.44 1u3n n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u3n s ALA 81 N -4.20 3.70 -0.93 4.61 0.00 -1.26 -4.94 121.76 118.75 1u3n s ALA 81 Ca 0.16 -0.72 -0.22 0.00 0.00 0.00 0.00 51.96 51.18 1u3n s ALA 81 Cb -0.09 -2.16 0.07 0.00 0.00 0.00 0.00 23.12 20.93 1u3n s ALA 81 CO 0.42 0.24 1.30 -1.12 0.00 0.00 0.00 175.76 176.60 1u3n s SER 82 N -3.37 6.45 -0.91 0.00 0.01 -1.26 -4.36 113.70 110.26 1u3n s SER 82 Ca 0.41 -1.41 -0.14 0.00 1.31 0.00 0.00 55.95 56.13 1u3n s SER 82 Cb -0.11 -2.51 0.22 0.00 0.21 0.00 0.00 66.02 63.83 1u3n s SER 82 CO 0.31 -1.44 0.90 -0.76 0.41 0.00 0.00 173.24 172.66 1u3n s LEU 83 N 4.44 6.45 0.00 2.44 2.01 -1.26 -4.21 118.68 128.55 1u3n s LEU 83 Ca 0.39 -2.82 0.00 0.00 0.01 0.00 0.00 54.13 51.71 1u3n s LEU 83 Cb -0.04 -2.24 0.00 0.00 0.01 0.00 0.00 46.19 43.93 1u3n s LEU 83 CO -0.04 -0.57 0.00 0.61 1.01 0.00 0.00 176.35 177.35 1u3n n GLY 84 N 3.87 2.89 0.00 -3.19 0.00 -1.26 -4.76 105.19 102.74 1u3n n GLY 84 Ca 0.18 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.77 1u3n n GLY 84 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1u3n n PHE 85 N -1.57 0.00 -1.47 1.61 -0.00 0.08 -4.24 117.46 111.87 1u3n n PHE 85 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.45 57.54 1u3n n PHE 85 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 39.48 39.43 1u3n n PHE 85 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.76 178.34 1u3n n HIS 86 N 0.00 -3.80 0.00 -5.13 -0.00 -1.26 -4.58 115.22 100.45 1u3n n HIS 86 Ca 0.00 2.08 0.00 0.00 -0.00 0.00 0.00 57.72 59.80 1u3n n HIS 86 Cb 0.00 -3.33 0.00 0.00 -0.00 0.00 0.00 29.99 26.66 1u3n n HIS 86 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.34 177.85 1u3n n ILE 87 N -3.57 0.00 -2.26 3.57 0.13 -1.26 -3.14 119.36 112.83 1u3n n ILE 87 Ca -0.05 0.00 -0.26 0.00 -1.10 0.00 0.00 62.75 61.34 1u3n n ILE 87 Cb 0.56 -0.15 0.12 0.00 -0.84 0.00 0.00 39.64 39.33 1u3n n ILE 87 CO 0.00 0.00 0.00 -0.72 2.80 0.00 0.00 176.55 178.63 1u3n s TYR 88 N 0.00 2.05 0.12 9.51 1.13 -1.09 -4.51 117.35 124.56 1u3n s TYR 88 Ca 0.00 0.14 0.00 0.00 -1.41 0.00 0.00 57.07 55.80 1u3n s TYR 88 Cb 0.00 -3.40 0.00 0.00 -1.10 0.00 0.00 41.96 37.46 1u3n s TYR 88 CO 0.00 -1.88 0.00 -0.85 -2.51 0.00 0.00 175.55 170.31 1u3n n GLU 89 N -3.14 0.00 -3.24 -3.49 0.28 -1.26 -5.03 120.64 104.76 1u3n n GLU 89 Ca 0.13 0.00 -0.04 0.00 -0.16 0.00 0.00 57.16 57.09 1u3n n GLU 89 Cb 0.60 -0.22 -0.03 0.00 1.43 0.00 0.00 31.44 33.21 1u3n n GLU 89 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 1u3n s LYS 90 N -2.00 0.49 0.23 3.44 2.36 -1.26 -4.60 119.74 118.40 1u3n s LYS 90 Ca 0.00 0.26 0.00 0.00 -2.55 0.00 0.00 55.97 53.68 1u3n s LYS 90 Cb 0.00 -0.08 0.00 0.00 -1.05 0.00 0.00 37.83 36.70 1u3n s LYS 90 CO 0.00 -1.05 0.00 0.41 1.55 0.00 0.00 175.35 176.26 1u3n n GLY 91 N 5.32 -2.67 0.00 5.54 0.00 -1.26 -4.93 105.19 107.19 1u3n n GLY 91 Ca 0.03 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1u3n n GLY 91 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1u3n n SER 92 N -3.05 0.00 -4.37 1.61 2.88 -1.26 -5.00 113.62 104.43 1u3n n SER 92 Ca -0.03 0.00 -0.45 0.00 -1.33 0.00 0.00 58.87 57.06 1u3n n SER 92 Cb 0.27 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.72 1u3n n SER 92 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1u3n n VAL 94 N 3.91 0.00 -4.64 0.00 3.14 -1.26 -5.10 118.33 114.39 1u3n n VAL 94 Ca 0.22 -0.12 -0.28 0.00 -2.96 0.00 0.00 64.34 61.20 1u3n n VAL 94 Cb 0.44 0.56 -0.14 0.00 -1.06 0.00 0.00 33.84 33.64 1u3n n VAL 94 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1u3n s ARG 95 N -0.00 1.53 -0.05 1.45 1.81 -1.26 -5.07 118.95 117.35 1u3n s ARG 95 Ca 0.02 -1.15 -0.08 0.00 -1.72 0.00 0.00 55.73 52.81 1u3n s ARG 95 Cb 0.05 -1.79 -0.04 0.00 -0.45 0.00 0.00 34.95 32.71 1u3n s ARG 95 CO -0.02 0.45 0.37 -1.00 -0.68 0.00 0.00 175.30 174.42 1u3n h PRO 96 N 4.48 -0.27 -0.31 3.54 0.13 -2.00 -3.47 132.00 134.10 1u3n h PRO 96 Ca -0.47 0.02 0.12 0.00 -0.87 0.00 0.00 66.00 64.80 1u3n h PRO 96 Cb 1.16 0.06 -0.18 0.00 0.13 0.00 0.00 31.00 32.17 1u3n h PRO 96 CO 0.42 -0.18 -0.14 0.34 -0.23 0.00 0.00 178.00 178.21 1u3n s ASP 97 N -4.72 -0.48 -0.30 1.44 -1.08 -1.26 -5.13 116.67 105.13 1u3n s ASP 97 Ca -0.04 -0.21 -0.16 0.00 -0.52 0.00 0.00 52.55 51.62 1u3n s ASP 97 Cb 0.00 0.70 0.17 0.00 -1.46 0.00 0.00 42.92 42.33 1u3n s ASP 97 CO 0.12 -0.06 1.16 0.12 0.52 0.00 0.00 175.17 177.03 1u3n s PHE 98 N 2.07 -0.25 0.77 -5.34 2.19 -1.26 -5.18 117.98 110.98 1u3n s PHE 98 Ca 0.16 0.24 -0.06 0.00 0.33 0.00 0.00 56.93 57.60 1u3n s PHE 98 Cb 0.02 0.08 0.12 0.00 -1.31 0.00 0.00 43.02 41.93 1u3n s PHE 98 CO -0.15 -0.14 1.07 -1.21 1.83 0.00 0.00 175.22 176.63 1u3n s GLU 99 N 2.98 1.59 0.17 10.12 0.41 -1.26 -5.05 118.70 127.65 1u3n s GLU 99 Ca -0.01 -0.70 0.00 0.00 -0.41 0.00 0.00 54.97 53.85 1u3n s GLU 99 Cb -0.08 -2.17 0.00 0.00 -1.78 0.00 0.00 34.13 30.10 1u3n s GLU 99 CO -0.11 -1.60 0.00 0.45 -0.49 0.00 0.00 175.26 173.51 1u3n n SER 100 N -3.07 0.05 0.00 -0.19 2.88 -1.26 -5.11 113.62 106.92 1u3n n SER 100 Ca 0.13 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.95 1u3n n SER 100 Cb 0.60 0.17 0.00 0.00 -0.75 0.00 0.00 64.21 64.24 1u3n n SER 100 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1u3n n ALA 101 N -3.14 0.21 0.00 -1.46 0.00 -1.26 -4.99 120.51 109.87 1u3n n ALA 101 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1u3n n ALA 101 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1u3n n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u3n n GLY 102 N -1.02 0.96 0.00 0.00 0.00 -1.26 -4.90 105.19 98.97 1u3n n GLY 102 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1u3n n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u3n n GLY 103 N 0.00 0.88 1.41 -0.02 0.00 -1.26 -4.58 105.19 101.62 1u3n n GLY 103 Ca 0.00 -0.31 -0.11 0.00 0.00 0.00 0.00 46.02 45.60 1u3n n GLY 103 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1u3n n PRO 104 N 0.00 -1.15 -3.53 1.61 -0.04 -1.26 -4.91 135.00 125.72 1u3n n PRO 104 Ca 0.00 -0.73 -0.28 0.00 -0.04 0.00 0.00 63.50 62.45 1u3n n PRO 104 Cb 0.00 -0.57 -0.15 0.00 -0.04 0.00 0.00 33.50 32.74 1u3n n PRO 104 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1u3n s PHE 105 N -1.94 0.27 0.00 0.54 0.40 -1.26 -5.09 117.98 110.90 1u3n s PHE 105 Ca 0.28 -0.83 0.00 0.00 -0.60 0.00 0.00 56.93 55.78 1u3n s PHE 105 Cb -0.02 -0.87 0.00 0.00 0.51 0.00 0.00 43.02 42.64 1u3n s PHE 105 CO 0.21 -0.83 0.00 0.27 0.70 0.00 0.00 175.22 175.56 1u3n n ASN 106 N 5.25 0.00 -4.35 1.36 6.94 -1.26 -3.47 115.26 119.73 1u3n n ASN 106 Ca -0.06 0.00 -0.29 0.00 -0.02 0.00 0.00 54.58 54.21 1u3n n ASN 106 Cb 0.42 0.00 0.18 0.00 -2.36 0.00 0.00 39.78 38.02 1u3n n ASN 106 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1u3n s PRO 107 N -2.00 0.38 -0.19 -0.53 0.04 -1.26 -4.51 135.00 126.93 1u3n s PRO 107 Ca 0.00 0.01 -0.17 0.00 0.04 0.00 0.00 61.00 60.87 1u3n s PRO 107 Cb 0.00 -1.78 0.03 0.00 0.04 0.00 0.00 34.50 32.79 1u3n s PRO 107 CO 0.00 -2.66 0.29 1.28 0.04 0.00 0.00 177.00 175.95 1u3n n LEU 108 N -4.03 -2.56 -3.37 -3.56 4.32 -1.26 -4.96 117.00 101.58 1u3n n LEU 108 Ca 0.11 0.09 -0.13 0.00 -0.02 0.00 0.00 56.01 56.06 1u3n n LEU 108 Cb 0.59 -1.35 -0.08 0.00 -1.62 0.00 0.00 43.42 40.96 1u3n n LEU 108 CO 0.51 -0.59 -0.12 0.54 -1.22 0.00 0.00 177.39 176.51 1u3n s ASN 109 N -1.05 1.00 -0.00 -1.43 4.22 -1.26 -4.97 114.94 111.45 1u3n s ASN 109 Ca 0.17 -0.42 0.08 0.00 -2.14 0.00 0.00 52.86 50.55 1u3n s ASN 109 Cb -0.02 0.79 -0.10 0.00 1.28 0.00 0.00 41.25 43.21 1u3n s ASN 109 CO 0.38 -0.36 0.33 2.29 -2.04 0.00 0.00 177.10 177.70 1u3n n LYS 110 N 5.33 3.56 0.00 3.55 -0.00 -1.26 -4.75 118.16 124.59 1u3n n LYS 110 Ca -0.02 -0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.28 1u3n n LYS 110 Cb 0.48 -0.95 0.00 0.00 -0.00 0.00 0.00 35.03 34.56 1u3n n LYS 110 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1u3n n GLU 111 N -1.30 0.00 -3.33 -1.58 1.02 -1.26 -4.97 120.64 109.22 1u3n n GLU 111 Ca 0.01 0.26 -0.16 0.00 -0.02 0.00 0.00 57.16 57.25 1u3n n GLU 111 Cb 0.15 -0.91 0.08 0.00 -0.02 0.00 0.00 31.44 30.74 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 -1.28 -2.20 0.00 -0.32 -0.00 -1.26 -4.51 115.22 105.65 1u3n n HIS 112 Ca 0.00 0.89 0.00 0.00 0.46 0.00 0.00 57.72 59.07 1u3n n HIS 112 Cb 0.00 -4.73 0.00 0.00 -0.12 0.00 0.00 29.99 25.14 1u3n n HIS 112 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1u3n n GLY 113 N -1.16 1.95 2.98 1.57 0.00 -1.26 -4.80 105.19 104.47 1u3n n GLY 113 Ca -0.22 0.36 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 1u3n n GLY 113 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1u3n n PHE 114 N 2.92 -1.77 -1.42 1.61 7.35 -1.26 -2.64 117.46 122.24 1u3n n PHE 114 Ca 0.00 0.40 0.00 0.00 -0.76 0.00 0.00 57.45 57.09 1u3n n PHE 114 Cb 0.00 -3.89 0.00 0.00 0.35 0.00 0.00 39.48 35.94 1u3n n PHE 114 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1u3n n ASN 115 N -2.34 -1.67 -4.81 -2.13 5.15 -1.26 -5.10 115.26 103.10 1u3n n ASN 115 Ca -0.11 0.00 -0.23 0.00 -0.60 0.00 0.00 54.58 53.64 1u3n n ASN 115 Cb 0.61 -0.42 -0.05 0.00 -0.53 0.00 0.00 39.78 39.39 1u3n n ASN 115 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1u3n s ASN 116 N -2.77 4.69 0.26 1.20 0.02 -1.08 -5.03 114.94 112.23 1u3n s ASN 116 Ca 0.00 -0.98 0.12 0.00 -1.02 0.00 0.00 52.86 50.99 1u3n s ASN 116 Cb 0.00 -0.40 0.27 0.00 0.02 0.00 0.00 41.25 41.14 1u3n s ASN 116 CO 0.00 -0.65 1.55 1.55 0.02 0.00 0.00 177.10 179.56 1u3n h PRO 117 N 1.19 0.00 0.08 -0.60 0.13 -1.99 -3.26 132.00 127.55 1u3n h PRO 117 Ca -0.42 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.37 1u3n h PRO 117 Cb 1.26 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 1u3n h PRO 117 CO 0.64 0.63 -1.92 -1.33 -0.23 0.00 0.00 178.00 175.79 1u3n n MET 118 N -3.57 0.72 -2.87 0.86 2.81 -1.26 -5.05 117.12 108.76 1u3n n MET 118 Ca -0.00 0.27 -0.00 0.00 -1.81 0.00 0.00 57.70 56.15 1u3n n MET 118 Cb 0.68 -1.73 -0.00 0.00 -0.71 0.00 0.00 33.22 31.46 1u3n n MET 118 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1u3n n GLY 119 N 1.86 -2.94 1.40 3.03 0.00 -1.23 -4.80 105.19 102.51 1u3n n GLY 119 Ca -0.27 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 1.03 -3.83 -2.87 1.61 8.25 -1.26 -4.89 115.22 113.26 1u3n n HIS 120 Ca -0.03 2.07 0.00 0.00 -0.26 0.00 0.00 57.72 59.50 1u3n n HIS 120 Cb 0.20 -3.26 0.00 0.00 1.12 0.00 0.00 29.99 28.05 1u3n n HIS 120 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1u3n n HIS 121 N -2.31 -0.25 -2.71 4.41 -0.00 -1.26 -4.93 115.22 108.17 1u3n n HIS 121 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.64 1u3n n HIS 121 Cb 0.38 0.00 0.11 0.00 -0.00 0.00 0.00 29.99 30.48 1u3n n HIS 121 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1u3n n ALA 122 N -3.00 1.02 0.70 -1.41 0.00 -1.26 -4.90 120.51 111.66 1u3n n ALA 122 Ca 0.00 -1.47 0.06 0.00 0.00 0.00 0.00 53.44 52.03 1u3n n ALA 122 Cb 0.00 -1.02 0.35 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.38 -0.52 3.96 0.00 0.00 -1.23 -4.67 105.19 102.34 1u3n n GLY 123 Ca -0.00 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 1u3n n GLY 123 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1u3n s ASP 124 N -2.24 6.25 -0.07 1.61 -1.08 -1.23 -4.86 116.67 115.06 1u3n s ASP 124 Ca 0.16 0.05 -0.10 0.00 -0.52 0.00 0.00 52.55 52.14 1u3n s ASP 124 Cb 0.08 -1.83 0.02 0.00 -1.46 0.00 0.00 42.92 39.74 1u3n s ASP 124 CO 0.16 -0.06 0.26 -1.48 0.52 0.00 0.00 175.17 174.58 1u3n s LEU 125 N -3.89 1.03 1.02 -1.34 0.05 -1.26 -4.87 118.68 109.42 1u3n s LEU 125 Ca 0.34 0.33 -0.16 0.00 0.05 0.00 0.00 54.13 54.69 1u3n s LEU 125 Cb -0.09 0.96 0.21 0.00 -2.05 0.00 0.00 46.19 45.22 1u3n s LEU 125 CO 0.29 -0.22 1.19 -2.16 -0.55 0.00 0.00 176.35 174.90 1u3n s PRO 126 N -0.42 0.20 -0.53 1.48 0.04 -1.26 -4.80 135.00 129.71 1u3n s PRO 126 Ca -0.05 -0.06 0.06 0.00 0.04 0.00 0.00 61.00 60.99 1u3n s PRO 126 Cb -0.04 -1.76 0.35 0.00 0.04 0.00 0.00 34.50 33.09 1u3n s PRO 126 CO 0.01 -2.76 0.92 0.09 0.04 0.00 0.00 177.00 175.31 1u3n n ASN 127 N -4.09 3.83 -3.04 6.66 3.02 -1.26 -4.85 115.26 115.53 1u3n n ASN 127 Ca 0.12 -3.56 -0.17 0.00 -0.03 0.00 0.00 54.58 50.94 1u3n n ASN 127 Cb 0.59 -0.56 -0.01 0.00 -0.61 0.00 0.00 39.78 39.19 1u3n n ASN 127 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1u3n n LEU 128 N -0.17 -0.54 -2.96 3.41 4.77 -1.26 -4.96 117.00 115.28 1u3n n LEU 128 Ca 0.30 -4.40 -0.32 0.00 -0.03 0.00 0.00 56.01 51.56 1u3n n LEU 128 Cb 0.47 0.74 -0.06 0.00 -2.33 0.00 0.00 43.42 42.24 1u3n n LEU 128 CO 0.32 2.13 2.53 -1.84 -1.33 0.00 0.00 177.39 179.20 1u3n n GLU 129 N 0.95 3.40 0.00 3.23 0.28 -1.26 -4.24 120.64 123.00 1u3n n GLU 129 Ca 0.18 -2.28 0.00 0.00 -0.16 0.00 0.00 57.16 54.90 1u3n n GLU 129 Cb 0.61 -2.50 0.00 0.00 1.43 0.00 0.00 31.44 30.98 1u3n n GLU 129 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1u3n n VAL 130 N 2.52 0.00 0.00 3.84 0.31 -1.26 -4.73 118.33 119.01 1u3n n VAL 130 Ca 0.63 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.96 1u3n n VAL 130 Cb 0.42 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.35 1u3n n VAL 130 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1u3n n GLY 131 N 0.00 2.32 0.00 2.92 0.00 -1.26 -4.43 105.19 104.74 1u3n n GLY 131 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1u3n n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u3n n ALA 132 N 0.00 1.81 -1.76 4.61 0.00 -1.26 -5.02 120.51 118.89 1u3n n ALA 132 Ca 0.00 -0.55 -0.01 0.00 0.00 0.00 0.00 53.44 52.88 1u3n n ALA 132 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 1u3n n ALA 132 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1u3n n ASP 133 N -0.13 -2.81 -2.05 0.00 8.00 -1.26 -3.55 116.55 114.74 1u3n n ASP 133 Ca 0.00 -0.06 -0.01 0.00 0.71 0.00 0.00 54.79 55.43 1u3n n ASP 133 Cb 0.15 -1.46 -0.00 0.00 -0.02 0.00 0.00 41.12 39.80 1u3n n ASP 133 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1u3n n GLY 134 N -1.28 -0.33 2.57 0.44 0.00 -1.07 -3.60 105.19 101.92 1u3n n GLY 134 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1u3n n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u3n n LYS 135 N -2.07 4.21 -4.24 1.61 5.02 -1.08 0.11 118.16 121.73 1u3n n LYS 135 Ca -0.01 -3.34 -0.23 0.00 -2.02 0.00 0.00 58.31 52.71 1u3n n LYS 135 Cb 0.36 -2.74 -0.07 0.00 -0.02 0.00 0.00 35.03 32.56 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 -0.33 3.35 -0.35 -0.18 1.01 -1.26 -4.95 120.40 117.68 1u3n s VAL 136 Ca 0.51 -1.83 0.00 0.00 0.00 0.00 0.00 61.98 60.67 1u3n s VAL 136 Cb 0.16 -2.91 0.14 0.00 0.00 0.00 0.00 36.38 33.77 1u3n s VAL 136 CO -0.06 -0.31 0.21 1.51 0.00 0.00 0.00 175.10 176.44 1u3n s ASP 137 N -3.73 2.99 -0.30 3.32 1.47 -1.26 -3.83 116.67 115.32 1u3n s ASP 137 Ca 0.33 -2.20 -0.29 0.00 1.18 0.00 0.00 52.55 51.57 1u3n s ASP 137 Cb -0.05 -0.42 0.02 0.00 -0.34 0.00 0.00 42.92 42.13 1u3n s ASP 137 CO 0.21 -0.31 1.07 0.68 0.68 0.00 0.00 175.17 177.50 1u3n s VAL 138 N 1.04 4.54 0.00 2.11 -7.23 -1.26 -4.95 120.40 114.66 1u3n s VAL 138 Ca 0.18 1.79 0.00 0.00 -1.81 0.00 0.00 61.98 62.14 1u3n s VAL 138 Cb -0.23 -4.39 0.00 0.00 0.56 0.00 0.00 36.38 32.32 1u3n s VAL 138 CO 0.01 -0.42 0.00 -0.38 -0.31 0.00 0.00 175.10 174.00 1u3n n ILE 139 N 5.77 0.00 -2.63 -0.62 2.08 -1.26 -3.90 119.36 118.79 1u3n n ILE 139 Ca 0.12 0.00 -0.42 0.00 0.56 0.00 0.00 62.75 63.01 1u3n n ILE 139 Cb 0.47 0.00 -0.03 0.00 -0.75 0.00 0.00 39.64 39.33 1u3n n ILE 139 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1u3n s MET 140 N 2.66 3.26 0.00 0.38 0.23 -0.76 -3.35 119.30 121.73 1u3n s MET 140 Ca 0.00 -0.23 0.00 0.00 -1.03 0.00 0.00 55.69 54.43 1u3n s MET 140 Cb 0.00 -4.14 0.00 0.00 -1.53 0.00 0.00 34.83 29.16 1u3n s MET 140 CO 0.00 -1.93 0.00 -1.71 -2.03 0.00 0.00 175.02 169.35 1u3n n ASN 141 N 8.72 0.00 -4.66 -1.18 4.05 -1.26 -5.02 115.26 115.91 1u3n n ASN 141 Ca 0.03 0.00 -0.25 0.00 0.45 0.00 0.00 54.58 54.81 1u3n n ASN 141 Cb 0.48 0.00 -0.08 0.00 1.23 0.00 0.00 39.78 41.41 1u3n n ASN 141 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1u3n s ALA 142 N 0.00 3.31 -0.06 5.20 0.00 -1.26 -5.08 121.76 123.87 1u3n s ALA 142 Ca 0.00 -2.04 -0.09 0.00 0.00 0.00 0.00 51.96 49.83 1u3n s ALA 142 Cb 0.00 -0.32 -0.05 0.00 0.00 0.00 0.00 23.12 22.75 1u3n s ALA 142 CO 0.00 -0.02 0.39 -1.00 0.00 0.00 0.00 175.76 175.13 1u3n h PRO 143 N 1.69 -0.32 -0.17 0.00 0.13 -1.99 -3.45 132.00 127.90 1u3n h PRO 143 Ca -0.43 0.02 -0.25 0.00 -0.87 0.00 0.00 66.00 64.47 1u3n h PRO 143 Cb 1.25 0.07 -0.16 0.00 0.13 0.00 0.00 31.00 32.29 1u3n h PRO 143 CO 0.69 -0.21 -0.54 -0.40 -0.23 0.00 0.00 178.00 177.31 1u3n n ASP 144 N -4.90 -2.63 -2.48 1.44 5.68 -1.26 -5.00 116.55 107.40 1u3n n ASP 144 Ca -0.04 -3.27 -0.28 0.00 -0.50 0.00 0.00 54.79 50.69 1u3n n ASP 144 Cb 0.13 1.64 0.01 0.00 -1.14 0.00 0.00 41.12 41.76 1u3n n ASP 144 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1u3n n THR 145 N 1.58 2.51 -1.53 2.12 -2.24 -1.26 -4.97 114.28 110.48 1u3n n THR 145 Ca 0.10 -4.80 -0.15 0.00 -2.27 0.00 0.00 64.05 56.93 1u3n n THR 145 Cb 0.62 -1.25 -0.12 0.00 -2.10 0.00 0.00 70.33 67.48 1u3n n THR 145 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1u3n n SER 146 N -0.51 1.29 -2.11 3.42 7.64 -1.13 -4.13 113.62 118.09 1u3n n SER 146 Ca 0.41 -2.49 -0.26 0.00 1.01 0.00 0.00 58.87 57.55 1u3n n SER 146 Cb 0.65 -1.68 0.07 0.00 -1.01 0.00 0.00 64.21 62.24 1u3n n SER 146 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u3n n LEU 147 N 19.58 7.03 0.00 -3.43 -0.00 -1.13 -3.44 117.00 135.60 1u3n n LEU 147 Ca 0.41 -3.77 0.00 0.00 -0.00 0.00 0.00 56.01 52.65 1u3n n LEU 147 Cb 0.47 -0.99 0.00 0.00 -0.00 0.00 0.00 43.42 42.90 1u3n n LEU 147 CO 0.62 1.32 0.00 2.29 -0.00 0.00 0.00 177.39 181.62 1u3n n LYS 148 N -0.38 3.40 -4.02 1.47 0.00 -1.16 -2.58 118.16 114.88 1u3n n LYS 148 Ca 0.48 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 58.52 1u3n n LYS 148 Cb 0.70 0.00 -0.05 0.00 -0.00 0.00 0.00 35.03 35.68 1u3n n LYS 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1u3n s LYS 149 N 0.00 3.10 0.00 -1.58 0.00 -1.18 -3.05 119.74 117.04 1u3n s LYS 149 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 55.97 55.24 1u3n s LYS 149 Cb 0.00 -2.78 0.00 0.00 0.00 0.00 0.00 37.83 35.05 1u3n s LYS 149 CO 0.00 0.52 0.00 0.41 0.00 0.00 0.00 175.35 176.28 1u3n n GLY 150 N -0.26 2.36 0.12 0.59 0.00 -1.26 -4.46 105.19 102.28 1u3n n GLY 150 Ca -0.08 -0.51 0.07 0.00 0.00 0.00 0.00 46.02 45.50 1u3n n GLY 150 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1u3n n SER 151 N 1.96 0.98 0.00 1.61 2.88 -1.26 -5.00 113.62 114.79 1u3n n SER 151 Ca 0.00 -0.99 0.00 0.00 -1.33 0.00 0.00 58.87 56.55 1u3n n SER 151 Cb 0.00 0.81 0.00 0.00 -0.75 0.00 0.00 64.21 64.27 1u3n n SER 151 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1u3n n LYS 152 N -0.90 0.00 -0.00 -1.46 5.02 -1.17 0.41 118.16 120.06 1u3n n LYS 152 Ca 0.04 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.37 1u3n n LYS 152 Cb 0.25 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.20 1u3n n LYS 152 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1u3n n LEU 153 N 0.00 0.04 0.00 -0.35 4.77 -1.26 -3.00 117.00 117.19 1u3n n LEU 153 Ca 0.00 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1u3n n LEU 153 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1u3n n LEU 153 CO 0.00 0.01 0.00 -3.20 -1.33 0.00 0.00 177.39 172.87 1u3n n ASN 154 N -1.70 -1.21 -2.66 -1.43 5.15 0.16 -3.79 115.26 109.79 1u3n n ASN 154 Ca -0.01 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 53.89 1u3n n ASN 154 Cb 0.19 -1.68 0.03 0.00 -0.53 0.00 0.00 39.78 37.79 1u3n n ASN 154 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1u3n n ILE 155 N -2.10 1.37 -2.75 -1.44 -5.35 -1.26 -4.95 119.36 102.87 1u3n n ILE 155 Ca 0.00 -3.28 -0.43 0.00 -0.27 0.00 0.00 62.75 58.78 1u3n n ILE 155 Cb 0.07 0.59 -0.04 0.00 -1.74 0.00 0.00 39.64 38.52 1u3n n ILE 155 CO 0.00 0.00 0.00 -1.48 -1.76 0.00 0.00 176.55 173.31 1u3n s LEU 156 N -3.48 3.88 0.84 7.28 2.34 -1.26 -4.59 118.68 123.70 1u3n s LEU 156 Ca 0.31 -0.29 -0.10 0.00 0.06 0.00 0.00 54.13 54.11 1u3n s LEU 156 Cb 0.39 -2.87 0.14 0.00 -0.56 0.00 0.00 46.19 43.30 1u3n s LEU 156 CO -0.01 -1.36 1.17 -0.62 -1.06 0.00 0.00 176.35 174.47 1u3n s ASP 157 N 3.00 3.89 0.16 1.48 -1.08 -0.20 -4.91 116.67 119.01 1u3n s ASP 157 Ca 0.33 0.23 -0.23 0.00 -0.52 0.00 0.00 52.55 52.37 1u3n s ASP 157 Cb -0.11 -0.52 0.03 0.00 -1.46 0.00 0.00 42.92 40.86 1u3n s ASP 157 CO 0.20 -2.22 1.34 -0.62 0.52 0.00 0.00 175.17 174.39 1u3n n GLU 158 N -3.34 -0.32 -0.08 4.34 1.02 -1.26 -2.39 120.64 118.60 1u3n n GLU 158 Ca 0.13 1.32 -0.11 0.00 -0.02 0.00 0.00 57.16 58.48 1u3n n GLU 158 Cb 0.60 -1.95 -0.07 0.00 -0.02 0.00 0.00 31.44 30.00 1u3n n GLU 158 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1u3n h ASP 159 N 0.00 0.00 0.00 1.62 5.19 -1.92 -3.49 116.42 117.83 1u3n h ASP 159 Ca 0.19 -0.37 0.00 0.00 -0.62 0.00 0.00 57.03 56.23 1u3n h ASP 159 Cb 0.41 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.92 1u3n h ASP 159 CO -0.83 0.98 0.00 0.61 -3.12 0.00 0.00 179.24 176.88 1u3n n GLY 160 N 1.59 -0.28 0.00 2.75 0.00 -1.01 -4.26 105.19 103.99 1u3n n GLY 160 Ca -0.14 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.30 1u3n n GLY 160 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u3n n SER 161 N 0.00 0.00 -2.83 1.61 3.41 -1.25 -1.03 113.62 113.52 1u3n n SER 161 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 1u3n n SER 161 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1u3n n SER 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u3n n ALA 162 N -0.14 -1.34 -2.64 7.33 0.00 -1.26 -4.49 120.51 117.97 1u3n n ALA 162 Ca 0.00 -1.36 -0.43 0.00 0.00 0.00 0.00 53.44 51.65 1u3n n ALA 162 Cb 0.00 1.09 -0.03 0.00 0.00 0.00 0.00 19.45 20.51 1u3n n ALA 162 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1u3n s PHE 163 N -2.46 3.24 0.09 0.00 0.08 -1.26 -2.69 117.98 114.99 1u3n s PHE 163 Ca 0.20 1.18 -0.25 0.00 0.12 0.00 0.00 56.93 58.17 1u3n s PHE 163 Cb -0.04 -3.36 -0.06 0.00 -0.57 0.00 0.00 43.02 38.99 1u3n s PHE 163 CO 0.14 -0.58 0.78 0.42 -0.10 0.00 0.00 175.22 175.89 1u3n s ILE 164 N 3.23 4.58 -0.18 0.64 1.09 -1.19 -4.21 121.20 125.17 1u3n s ILE 164 Ca 0.40 1.68 0.01 0.00 -1.10 0.00 0.00 60.65 61.65 1u3n s ILE 164 Cb -0.14 -4.14 0.02 0.00 -1.06 0.00 0.00 42.46 37.15 1u3n s ILE 164 CO 0.11 0.42 -0.17 -0.63 -0.10 0.00 0.00 174.94 174.56 1u3n s ILE 165 N -0.46 1.92 0.17 2.92 1.09 -0.69 -0.74 121.20 125.41 1u3n s ILE 165 Ca 0.38 -0.92 -0.23 0.00 -1.10 0.00 0.00 60.65 58.78 1u3n s ILE 165 Cb -0.22 -1.78 0.07 0.00 -1.06 0.00 0.00 42.46 39.47 1u3n s ILE 165 CO 0.25 0.46 1.02 -1.38 -0.10 0.00 0.00 174.94 175.18 1u3n s HIS 166 N 1.33 0.02 -1.67 3.97 -3.43 -1.26 -2.49 115.29 111.76 1u3n s HIS 166 Ca 0.04 -0.39 0.00 0.00 -0.80 0.00 0.00 55.06 53.91 1u3n s HIS 166 Cb -0.14 0.68 0.00 0.00 -1.43 0.00 0.00 32.58 31.70 1u3n s HIS 166 CO -0.12 -0.89 0.00 0.39 -2.00 0.00 0.00 174.74 172.12 1u3n n GLU 167 N -0.63 -1.30 -2.01 -0.38 1.02 -1.24 -4.74 120.64 111.36 1u3n n GLU 167 Ca -0.04 0.98 -0.29 0.00 -0.02 0.00 0.00 57.16 57.79 1u3n n GLU 167 Cb 0.60 -5.33 0.16 0.00 -0.02 0.00 0.00 31.44 26.85 1u3n n GLU 167 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 1u3n s GLN 168 N -4.18 0.93 0.28 3.49 -2.07 -1.24 -4.88 119.66 111.99 1u3n s GLN 168 Ca 0.00 -0.43 0.04 0.00 -1.82 0.00 0.00 55.36 53.15 1u3n s GLN 168 Cb 0.00 -1.92 -0.01 0.00 -1.09 0.00 0.00 33.01 29.99 1u3n s GLN 168 CO 0.00 -2.20 0.14 0.00 -1.32 0.00 0.00 175.29 171.91 1u3n n ALA 169 N -3.60 0.46 -1.17 2.60 0.00 -1.25 -4.24 120.51 113.32 1u3n n ALA 169 Ca 0.14 -1.50 0.00 0.00 0.00 0.00 0.00 53.44 52.08 1u3n n ALA 169 Cb 0.60 1.07 0.00 0.00 0.00 0.00 0.00 19.45 21.12 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 -1.78 -6.19 -2.49 0.00 9.92 -1.26 -4.63 116.55 110.13 1u3n n ASP 170 Ca -0.01 0.78 0.01 0.00 -0.53 0.00 0.00 54.79 55.03 1u3n n ASP 170 Cb 0.45 -2.72 0.01 0.00 -0.64 0.00 0.00 41.12 38.22 1u3n n ASP 170 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1u3n n ASP 171 N 0.38 -0.74 0.18 -2.24 10.43 -1.26 -4.75 116.55 118.55 1u3n n ASP 171 Ca 0.00 -1.23 -0.15 0.00 2.57 0.00 0.00 54.79 55.98 1u3n n ASP 171 Cb 0.00 1.16 -0.07 0.00 1.84 0.00 0.00 41.12 44.05 1u3n n ASP 171 CO 0.00 0.00 0.00 1.88 -1.07 0.00 0.00 177.20 178.01 1u3n h TYR 172 N 1.55 -0.92 0.03 1.24 -1.99 -1.95 -3.32 116.97 111.60 1u3n h TYR 172 Ca -0.13 0.01 -0.34 0.00 2.00 0.00 0.00 58.73 60.27 1u3n h TYR 172 Cb 0.65 0.37 -0.04 0.00 2.00 0.00 0.00 36.73 39.71 1u3n h TYR 172 CO 0.00 -0.47 -1.91 1.28 -0.00 0.00 0.00 178.16 177.07 1u3n n LEU 173 N -5.44 2.19 -4.43 3.88 4.77 -1.26 -4.95 117.00 111.76 1u3n n LEU 173 Ca -0.09 0.29 -0.40 0.00 -0.03 0.00 0.00 56.01 55.78 1u3n n LEU 173 Cb 0.35 -0.96 -0.08 0.00 -2.33 0.00 0.00 43.42 40.40 1u3n n LEU 173 CO 0.26 0.56 -0.20 1.07 -1.33 0.00 0.00 177.39 177.75 1u3n n THR 174 N -4.04 -0.15 0.04 -5.08 5.66 -1.25 -4.80 114.28 104.66 1u3n n THR 174 Ca -0.40 -0.08 -0.13 0.00 -3.05 0.00 0.00 64.05 60.40 1u3n n THR 174 Cb 0.85 -0.56 -0.09 0.00 -1.55 0.00 0.00 70.33 68.98 1u3n n THR 174 CO 0.00 0.00 0.00 -1.13 -3.05 0.00 0.00 175.07 170.89 1u3n h ASN 175 N -0.98 -0.11 0.00 1.09 -1.24 -1.93 -3.37 115.58 109.04 1u3n h ASN 175 Ca -0.59 -0.38 0.00 0.00 0.71 0.00 0.00 56.30 56.04 1u3n h ASN 175 Cb 1.35 0.03 0.00 0.00 0.73 0.00 0.00 38.32 40.43 1u3n h ASN 175 CO 0.84 0.34 0.00 -0.81 -1.29 0.00 0.00 177.43 176.51 1u3n n PRO 176 N -4.94 0.00 -2.72 6.67 -0.04 -1.26 -4.85 135.00 127.86 1u3n n PRO 176 Ca -0.09 0.06 -0.04 0.00 -0.04 0.00 0.00 63.50 63.39 1u3n n PRO 176 Cb 0.25 -0.68 0.09 0.00 -0.04 0.00 0.00 33.50 33.11 1u3n n PRO 176 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1u3n n SER 177 N -0.68 -0.21 -0.99 3.54 7.64 -1.26 -4.95 113.62 116.71 1u3n n SER 177 Ca 0.00 -2.33 -0.05 0.00 1.01 0.00 0.00 58.87 57.49 1u3n n SER 177 Cb 0.00 0.22 0.01 0.00 -1.01 0.00 0.00 64.21 63.43 1u3n n SER 177 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1u3n n GLY 178 N -0.77 0.44 3.76 0.23 0.00 -1.26 -3.80 105.19 103.80 1u3n n GLY 178 Ca -0.02 -0.54 -0.24 0.00 0.00 0.00 0.00 46.02 45.22 1u3n n GLY 178 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1u3n n ASN 179 N 0.66 -4.96 -2.68 1.61 4.13 -1.26 -4.48 115.26 108.28 1u3n n ASN 179 Ca -0.02 -0.93 -0.04 0.00 1.68 0.00 0.00 54.58 55.27 1u3n n ASN 179 Cb 0.53 -1.81 0.06 0.00 -1.54 0.00 0.00 39.78 37.02 1u3n n ASN 179 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1u3n n SER 180 N -2.58 -1.51 -1.18 6.41 2.88 -1.26 -4.83 113.62 111.56 1u3n n SER 180 Ca -0.31 -1.61 -0.01 0.00 -1.33 0.00 0.00 58.87 55.61 1u3n n SER 180 Cb 0.69 0.82 0.23 0.00 -0.75 0.00 0.00 64.21 65.19 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 1.95 4.49 3.83 0.46 0.00 -1.26 -3.63 105.19 111.02 1u3n n GLY 181 Ca 0.06 -1.14 0.03 0.00 0.00 0.00 0.00 46.02 44.98 1u3n n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u3n s ALA 182 N -3.08 -2.55 0.07 4.61 0.00 -1.26 -4.96 121.76 114.58 1u3n s ALA 182 Ca 0.45 0.43 -0.32 0.00 0.00 0.00 0.00 51.96 52.52 1u3n s ALA 182 Cb 0.39 0.65 -0.11 0.00 0.00 0.00 0.00 23.12 24.05 1u3n s ALA 182 CO 0.05 -1.12 1.82 0.54 0.00 0.00 0.00 175.76 177.04 1u3n n ARG 183 N -0.76 2.52 0.00 0.00 1.74 -1.26 -3.63 116.66 115.27 1u3n n ARG 183 Ca -0.01 0.92 0.00 0.00 -0.77 0.00 0.00 57.85 57.99 1u3n n ARG 183 Cb 0.61 -2.78 0.00 0.00 -1.02 0.00 0.00 32.46 29.26 1u3n n ARG 183 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1u3n n ILE 184 N 4.66 0.00 -3.87 0.55 -0.00 -1.26 -5.03 119.36 114.41 1u3n n ILE 184 Ca 0.19 0.01 -0.37 0.00 -0.00 0.00 0.00 62.75 62.58 1u3n n ILE 184 Cb 0.34 -0.87 -0.06 0.00 -0.00 0.00 0.00 39.64 39.05 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 -0.72 5.51 0.02 1.39 0.11 -1.04 -5.03 120.40 120.64 1u3n s VAL 185 Ca 0.00 0.21 -0.26 0.00 -2.93 0.00 0.00 61.98 59.00 1u3n s VAL 185 Cb 0.00 -3.40 0.06 0.00 -1.53 0.00 0.00 36.38 31.51 1u3n s VAL 185 CO 0.00 0.62 0.60 0.00 -3.33 0.00 0.00 175.10 172.99 1u3n n GLY 187 N 0.55 -0.20 3.25 0.00 0.00 -1.26 -4.95 105.19 102.59 1u3n n GLY 187 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.90 -1.33 -2.76 4.61 0.00 -1.26 -4.71 120.51 113.17 1u3n n ALA 188 Ca 0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 53.44 53.21 1u3n n ALA 188 Cb 0.00 -0.37 0.08 0.00 0.00 0.00 0.00 19.45 19.17 1u3n n ALA 188 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1u3n n LEU 189 N -2.02 -2.10 0.00 0.00 4.77 -1.26 -3.92 117.00 112.47 1u3n n LEU 189 Ca -0.07 -3.77 0.00 0.00 -0.03 0.00 0.00 56.01 52.13 1u3n n LEU 189 Cb 0.18 0.86 0.00 0.00 -2.33 0.00 0.00 43.42 42.13 1u3n n LEU 189 CO 0.23 2.08 0.00 0.18 -1.33 0.00 0.00 177.39 178.54 1u3n n LEU 190 N 0.28 0.00 0.00 2.23 4.77 -1.26 -4.86 117.00 118.16 1u3n n LEU 190 Ca 0.07 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.86 1u3n n LEU 190 Cb 0.71 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.95 1u3n n LEU 190 CO 0.04 0.00 0.35 0.61 -1.33 0.00 0.00 177.39 177.06 1u3n n GLY 191 N 5.00 -2.80 1.96 -0.72 0.00 -1.26 -4.82 105.19 102.55 1u3n n GLY 191 Ca 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1u3n n GLY 191 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1u3n n ASN 192 N -4.20 -0.14 -4.50 1.61 4.13 -1.26 -4.56 115.26 106.34 1u3n n ASN 192 Ca 0.09 0.49 -0.51 0.00 1.68 0.00 0.00 54.58 56.34 1u3n n ASN 192 Cb 0.36 0.40 -0.07 0.00 -1.54 0.00 0.00 39.78 38.93 1u3n n ASN 192 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 1u3n n ASN 193 N -3.50 2.35 0.00 6.41 0.23 -1.26 -4.42 115.26 115.08 1u3n n ASN 193 Ca 0.00 0.52 0.00 0.00 -0.53 0.00 0.00 54.58 54.57 1u3n n ASN 193 Cb 0.00 -1.28 0.00 0.00 -2.08 0.00 0.00 39.78 36.42 1u3n n ASN 193 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 1u3n n GLU 194 N 7.81 0.00 0.00 -3.83 0.00 -1.26 -5.17 120.64 118.19 1u3n n GLU 194 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.53 1u3n n GLU 194 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.68 1u3n n GLU 194 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1u3n n LYS 195 N -2.07 0.00 0.00 5.31 4.81 -1.26 -5.19 118.16 119.76 1u3n n LYS 195 Ca 0.00 0.00 0.08 0.00 -0.87 0.00 0.00 58.31 57.52 1u3n n LYS 195 Cb 0.00 0.00 0.49 0.00 0.02 0.00 0.00 35.03 35.54 1u3n n LYS 195 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51