#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3n n VAL 36 N 0.00 1.49 -3.59 2.52 0.24 -1.26 -4.95 118.33 112.78 1u3n n VAL 36 Ca 0.00 -2.72 -0.29 0.00 -2.04 0.00 0.00 64.34 59.29 1u3n n VAL 36 Cb 0.00 0.17 -0.14 0.00 -1.47 0.00 0.00 33.84 32.40 1u3n n VAL 36 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1u3n s GLU 37 N -2.43 0.49 -0.17 7.34 2.02 -1.26 -5.09 118.70 119.61 1u3n s GLU 37 Ca 0.38 -0.97 -0.04 0.00 0.02 0.00 0.00 54.97 54.36 1u3n s GLU 37 Cb 0.38 -1.50 0.06 0.00 0.10 0.00 0.00 34.13 33.16 1u3n s GLU 37 CO -0.08 -1.06 0.07 0.95 0.02 0.00 0.00 175.26 175.16 1u3n s THR 38 N 1.61 0.09 0.00 3.63 -4.23 -1.26 -4.94 115.64 110.54 1u3n s THR 38 Ca 0.12 -0.24 0.03 0.00 -1.18 0.00 0.00 61.69 60.41 1u3n s THR 38 Cb -0.19 -0.68 0.05 0.00 1.34 0.00 0.00 72.50 73.02 1u3n s THR 38 CO -0.23 -0.23 0.84 -1.20 -0.54 0.00 0.00 174.62 173.26 1u3n n SER 39 N 5.21 -0.34 0.00 3.99 7.64 -1.26 -5.09 113.62 123.77 1u3n n SER 39 Ca -0.07 -1.64 0.00 0.00 1.01 0.00 0.00 58.87 58.17 1u3n n SER 39 Cb 0.49 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 1u3n n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u3n n ALA 40 N 0.05 0.00 -0.25 -0.43 0.00 -1.26 -4.66 120.51 113.97 1u3n n ALA 40 Ca -0.12 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.34 1u3n n ALA 40 Cb 0.68 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.12 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 -1.65 0.00 0.00 1.16 -1.26 -4.95 117.46 110.76 1u3n n PHE 41 Ca 0.00 0.15 0.00 0.00 -1.87 0.00 0.00 57.45 55.73 1u3n n PHE 41 Cb 0.00 -0.24 0.00 0.00 -1.61 0.00 0.00 39.48 37.63 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 -0.50 0.99 0.00 4.97 0.00 -1.25 -5.00 105.19 104.39 1u3n n GLY 42 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1u3n n GLY 42 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1u3n n HIS 43 N 0.00 -0.69 0.00 1.61 -0.00 -1.04 -4.81 115.22 110.29 1u3n n HIS 43 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1u3n n HIS 43 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 1u3n n HIS 43 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 1u3n n HIS 44 N -0.69 0.00 -2.72 1.57 1.44 -1.25 -4.49 115.22 109.08 1u3n n HIS 44 Ca 0.00 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.29 1u3n n HIS 44 Cb 0.00 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.08 1u3n n HIS 44 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1u3n s VAL 45 N -0.32 4.05 -0.79 0.61 1.01 -1.26 -4.79 120.40 118.92 1u3n s VAL 45 Ca 0.00 -0.03 -0.25 0.00 0.00 0.00 0.00 61.98 61.70 1u3n s VAL 45 Cb 0.00 -4.79 -0.01 0.00 0.00 0.00 0.00 36.38 31.57 1u3n s VAL 45 CO 0.00 -1.64 1.76 0.00 0.00 0.00 0.00 175.10 175.21 1u3n s GLN 46 N 4.82 2.81 -0.93 2.72 -2.07 -1.26 -4.06 119.66 121.68 1u3n s GLN 46 Ca 0.28 -0.05 -0.15 0.00 -1.82 0.00 0.00 55.36 53.61 1u3n s GLN 46 Cb -0.13 -4.73 0.18 0.00 -1.09 0.00 0.00 33.01 27.25 1u3n s GLN 46 CO 0.12 -2.81 1.00 -0.51 -1.32 0.00 0.00 175.29 171.77 1u3n s LEU 47 N 8.43 5.89 -0.14 2.60 1.02 -1.21 -3.97 118.68 131.30 1u3n s LEU 47 Ca 0.61 -2.54 0.01 0.00 0.02 0.00 0.00 54.13 52.23 1u3n s LEU 47 Cb -0.08 -2.30 -0.00 0.00 0.02 0.00 0.00 46.19 43.82 1u3n s LEU 47 CO 0.08 -0.76 -0.18 0.54 0.02 0.00 0.00 176.35 176.05 1u3n s VAL 48 N 1.17 2.45 0.23 -1.59 0.11 -1.26 -2.31 120.40 119.20 1u3n s VAL 48 Ca 0.27 -0.86 -0.09 0.00 -2.93 0.00 0.00 61.98 58.38 1u3n s VAL 48 Cb -0.07 -2.00 -0.07 0.00 -1.53 0.00 0.00 36.38 32.70 1u3n s VAL 48 CO -0.08 0.53 0.54 0.20 -3.33 0.00 0.00 175.10 172.96 1u3n s ASN 49 N 0.66 6.61 0.56 3.54 0.01 -1.25 -3.90 114.94 121.17 1u3n s ASN 49 Ca -0.09 0.89 0.32 0.00 -0.71 0.00 0.00 52.86 53.28 1u3n s ASN 49 Cb -0.16 -2.22 1.47 0.00 0.41 0.00 0.00 41.25 40.75 1u3n s ASN 49 CO 0.02 -0.07 1.81 -0.09 -1.51 0.00 0.00 177.10 177.27 1u3n h ARG 50 N 2.53 0.00 0.00 -0.60 9.65 -1.91 -2.73 114.38 121.32 1u3n h ARG 50 Ca -0.47 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.41 1u3n h ARG 50 Cb 1.17 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.75 1u3n h ARG 50 CO 0.69 0.00 -0.37 0.39 2.80 0.00 0.00 179.97 183.48 1u3n n GLU 51 N -4.00 0.00 -0.63 0.20 1.02 -1.26 -4.77 120.64 111.21 1u3n n GLU 51 Ca 0.19 0.00 0.47 0.00 -0.02 0.00 0.00 57.16 57.80 1u3n n GLU 51 Cb 1.03 -0.26 0.72 0.00 -0.02 0.00 0.00 31.44 32.92 1u3n n GLU 51 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1u3n n GLY 52 N 2.36 -0.87 2.72 0.62 0.00 -1.24 -4.68 105.19 104.10 1u3n n GLY 52 Ca 0.00 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.63 1u3n n GLY 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1u3n n LYS 53 N -3.68 0.00 0.00 1.61 4.81 -1.03 -4.79 118.16 115.08 1u3n n LYS 53 Ca 0.39 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.83 1u3n n LYS 53 Cb 1.78 0.00 0.00 0.00 0.02 0.00 0.00 35.03 36.83 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 0.93 3.14 0.00 -1.26 -3.81 120.51 119.51 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 0.34 0.00 0.00 0.00 0.00 19.45 19.79 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 -0.82 0.06 0.00 0.00 0.24 -0.98 -4.86 118.33 111.97 1u3n n VAL 55 Ca 0.00 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 1u3n n VAL 55 Cb 0.00 -0.02 0.00 0.00 -1.47 0.00 0.00 33.84 32.35 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 1.47 0.18 0.00 7.63 0.00 -1.26 -4.44 105.19 108.77 1u3n n GLY 56 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.98 1.61 1.16 -1.26 -4.89 117.46 110.10 1u3n n PHE 57 Ca 0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.27 1u3n n PHE 57 Cb 0.00 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 37.73 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 2.45 -0.83 1.97 -1.09 -1.26 -4.39 121.20 116.05 1u3n s ILE 58 Ca 0.00 -2.63 -0.01 0.00 -2.23 0.00 0.00 60.65 55.79 1u3n s ILE 58 Cb 0.00 -2.77 0.20 0.00 -1.58 0.00 0.00 42.46 38.32 1u3n s ILE 58 CO 0.00 -0.67 0.69 -1.61 -1.23 0.00 0.00 174.94 172.13 1u3n s GLU 59 N 0.55 3.07 0.14 2.79 2.02 -1.24 -4.22 118.70 121.81 1u3n s GLU 59 Ca 0.13 -3.20 -0.26 0.00 0.02 0.00 0.00 54.97 51.66 1u3n s GLU 59 Cb -0.21 -3.85 -0.07 0.00 0.10 0.00 0.00 34.13 30.10 1u3n s GLU 59 CO -0.05 -1.26 0.81 0.96 0.02 0.00 0.00 175.26 175.74 1u3n s ILE 60 N -1.21 4.44 -0.34 -1.63 -0.00 -1.26 -3.85 121.20 117.35 1u3n s ILE 60 Ca 0.26 1.76 0.02 0.00 -0.00 0.00 0.00 60.65 62.69 1u3n s ILE 60 Cb -0.09 -4.17 0.10 0.00 -0.00 0.00 0.00 42.46 38.31 1u3n s ILE 60 CO -0.12 0.46 0.09 -1.59 -0.00 0.00 0.00 174.94 173.78 1u3n s LYS 61 N -0.78 1.22 -0.08 0.37 0.00 -1.26 -4.23 119.74 114.98 1u3n s LYS 61 Ca 0.38 -1.63 -0.31 0.00 0.00 0.00 0.00 55.97 54.41 1u3n s LYS 61 Cb -0.23 -2.73 -0.15 0.00 0.00 0.00 0.00 37.83 34.72 1u3n s LYS 61 CO 0.26 -0.98 0.88 0.39 0.00 0.00 0.00 175.35 175.91 1u3n n GLU 62 N 4.37 0.00 0.00 1.78 4.71 -1.26 -4.44 120.64 125.80 1u3n n GLU 62 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.17 1u3n n GLU 62 Cb 0.41 -1.12 0.00 0.00 -1.01 0.00 0.00 31.44 29.73 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 1.51 0.00 -2.69 1.62 2.88 -1.26 -5.03 113.62 110.65 1u3n n SER 63 Ca 0.17 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.67 1u3n n SER 63 Cb 0.04 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.53 1u3n n SER 63 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1u3n n ASP 64 N 0.00 -1.83 0.00 -3.46 -0.08 -1.26 -5.00 116.55 104.92 1u3n n ASP 64 Ca 0.00 -1.46 0.00 0.00 -1.51 0.00 0.00 54.79 51.82 1u3n n ASP 64 Cb 0.00 0.94 0.00 0.00 2.34 0.00 0.00 41.12 44.40 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 2.48 0.00 -3.83 1.67 -0.08 -1.26 -5.13 116.55 110.41 1u3n n ASP 65 Ca 0.11 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.27 1u3n n ASP 65 Cb 0.64 0.21 -0.09 0.00 2.34 0.00 0.00 41.12 44.22 1u3n n ASP 65 CO 0.00 0.00 0.00 -1.83 0.12 0.00 0.00 177.20 175.49 1u3n s GLU 66 N -0.54 0.54 0.00 -0.67 -1.05 -1.26 -5.07 118.70 110.66 1u3n s GLU 66 Ca 0.00 -0.31 0.00 0.00 -0.15 0.00 0.00 54.97 54.51 1u3n s GLU 66 Cb 0.00 0.23 0.00 0.00 -0.44 0.00 0.00 34.13 33.92 1u3n s GLU 66 CO 0.00 -0.14 0.00 0.41 0.95 0.00 0.00 175.26 176.48 1u3n n GLY 67 N 1.42 0.82 2.67 -3.83 0.00 -1.25 -3.49 105.19 101.53 1u3n n GLY 67 Ca -0.22 0.63 -0.23 0.00 0.00 0.00 0.00 46.02 46.20 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 0.15 -0.64 0.99 0.05 -1.26 -3.82 118.68 114.16 1u3n s LEU 68 Ca 0.00 -0.50 -0.03 0.00 0.05 0.00 0.00 54.13 53.65 1u3n s LEU 68 Cb 0.00 0.04 0.20 0.00 -2.05 0.00 0.00 46.19 44.38 1u3n s LEU 68 CO 0.00 -0.35 2.42 -0.67 -0.55 0.00 0.00 176.35 177.20 1u3n n ASP 69 N 5.29 6.97 -4.70 1.48 -0.08 -1.23 -3.55 116.55 120.74 1u3n n ASP 69 Ca -0.06 -3.50 -0.23 0.00 -1.51 0.00 0.00 54.79 49.48 1u3n n ASP 69 Cb 0.49 -1.15 0.10 0.00 2.34 0.00 0.00 41.12 42.90 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 -3.57 2.17 -0.35 5.18 -5.25 -1.26 -4.63 121.20 113.50 1u3n s ILE 70 Ca 0.56 -0.59 0.01 0.00 -0.99 0.00 0.00 60.65 59.64 1u3n s ILE 70 Cb 0.41 -2.58 0.09 0.00 2.95 0.00 0.00 42.46 43.33 1u3n s ILE 70 CO -0.31 0.00 0.07 -2.28 -1.79 0.00 0.00 174.94 170.64 1u3n s HIS 71 N -3.12 3.60 -0.08 1.37 2.46 -1.25 -4.74 115.29 113.53 1u3n s HIS 71 Ca 0.66 -2.63 -0.02 0.00 0.47 0.00 0.00 55.06 53.54 1u3n s HIS 71 Cb -0.06 -2.82 0.04 0.00 -0.13 0.00 0.00 32.58 29.61 1u3n s HIS 71 CO 0.44 -0.93 0.05 0.96 -2.47 0.00 0.00 174.74 172.78 1u3n s ILE 72 N 1.04 0.08 -0.45 0.89 -0.00 -1.26 -3.67 121.20 117.82 1u3n s ILE 72 Ca 0.06 0.19 0.07 0.00 -0.00 0.00 0.00 60.65 60.97 1u3n s ILE 72 Cb -0.20 -0.38 0.18 0.00 -0.00 0.00 0.00 42.46 42.06 1u3n s ILE 72 CO -0.06 0.11 0.62 -0.44 -0.00 0.00 0.00 174.94 175.17 1u3n s SER 73 N 2.09 -0.96 -0.32 4.36 0.01 -1.26 -3.77 113.70 113.84 1u3n s SER 73 Ca 0.04 -1.42 0.03 0.00 1.31 0.00 0.00 55.95 55.92 1u3n s SER 73 Cb -0.13 1.60 0.32 0.00 0.21 0.00 0.00 66.02 68.02 1u3n s SER 73 CO -0.05 -0.13 1.40 0.00 0.41 0.00 0.00 173.24 174.87 1u3n n ALA 74 N 3.70 -3.24 0.44 1.44 0.00 -0.75 -4.73 120.51 117.37 1u3n n ALA 74 Ca 0.15 -0.37 0.05 0.00 0.00 0.00 0.00 53.44 53.27 1u3n n ALA 74 Cb 0.54 -3.18 -0.06 0.00 0.00 0.00 0.00 19.45 16.76 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 0.61 0.61 -3.89 0.00 3.02 -1.10 -4.17 115.26 110.33 1u3n n ASN 75 Ca -0.05 -0.69 -0.26 0.00 -0.03 0.00 0.00 54.58 53.55 1u3n n ASN 75 Cb 0.76 1.03 -0.17 0.00 -0.61 0.00 0.00 39.78 40.79 1u3n n ASN 75 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1u3n s SER 76 N -2.01 2.06 0.10 6.41 0.01 -1.25 -4.58 113.70 114.44 1u3n s SER 76 Ca 0.03 -0.27 -0.30 0.00 1.31 0.00 0.00 55.95 56.72 1u3n s SER 76 Cb 0.07 -0.78 -0.12 0.00 0.21 0.00 0.00 66.02 65.41 1u3n s SER 76 CO 0.41 -0.12 1.49 -0.07 0.41 0.00 0.00 173.24 175.35 1u3n h LEU 77 N 8.13 -1.51 0.00 2.44 4.07 -1.87 -3.19 115.31 123.38 1u3n h LEU 77 Ca -0.29 0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.85 1u3n h LEU 77 Cb 1.13 0.58 0.00 0.00 1.08 0.00 0.00 40.66 43.46 1u3n h LEU 77 CO 0.39 -0.44 0.00 -1.14 -1.08 0.00 0.00 178.44 176.17 1u3n n ARG 78 N -5.11 0.00 -1.19 1.13 0.63 -1.26 -4.76 116.66 106.10 1u3n n ARG 78 Ca -0.06 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.52 1u3n n ARG 78 Cb 0.34 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 33.23 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 2.47 -3.02 -0.14 -0.04 -1.26 -4.31 135.00 128.70 1u3n n PRO 79 Ca 0.00 -1.97 -0.21 0.00 -0.04 0.00 0.00 63.50 61.28 1u3n n PRO 79 Cb 0.00 -2.83 -0.04 0.00 -0.04 0.00 0.00 33.50 30.59 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 3.99 -0.26 3.45 0.55 0.00 -1.26 -4.82 105.19 106.84 1u3n n GLY 80 Ca 0.55 0.03 -0.30 0.00 0.00 0.00 0.00 46.02 46.31 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 -2.14 -0.26 -0.29 4.61 0.00 -1.26 -4.88 121.76 117.54 1u3n s ALA 81 Ca 0.40 -0.64 -0.03 0.00 0.00 0.00 0.00 51.96 51.69 1u3n s ALA 81 Cb -0.24 -3.02 0.03 0.00 0.00 0.00 0.00 23.12 19.90 1u3n s ALA 81 CO 0.49 -4.04 0.01 -1.12 0.00 0.00 0.00 175.76 171.10 1u3n s SER 82 N -3.18 4.83 -0.02 0.00 0.01 -1.25 -4.30 113.70 109.79 1u3n s SER 82 Ca 0.69 -1.03 0.00 0.00 1.31 0.00 0.00 55.95 56.93 1u3n s SER 82 Cb -0.16 -1.75 0.02 0.00 0.21 0.00 0.00 66.02 64.33 1u3n s SER 82 CO 0.59 -0.22 -0.00 -0.76 0.41 0.00 0.00 173.24 173.26 1u3n s LEU 83 N 1.34 1.47 -0.05 2.44 2.01 -1.26 -4.53 118.68 120.10 1u3n s LEU 83 Ca -0.02 -0.02 0.03 0.00 0.01 0.00 0.00 54.13 54.14 1u3n s LEU 83 Cb -0.18 -0.15 0.00 0.00 0.01 0.00 0.00 46.19 45.87 1u3n s LEU 83 CO -0.01 -0.06 -0.14 -0.83 1.01 0.00 0.00 176.35 176.32 1u3n s GLY 84 N 0.62 0.85 0.18 -3.19 0.00 -1.26 -4.58 107.32 99.93 1u3n s GLY 84 Ca -0.06 -0.55 0.08 0.00 0.00 0.00 0.00 44.72 44.20 1u3n s GLY 84 CO -0.01 -0.12 -0.16 -0.12 0.00 0.00 0.00 173.10 172.69 1u3n s PHE 85 N 0.35 1.75 0.00 1.90 2.19 -1.26 -4.20 117.98 118.70 1u3n s PHE 85 Ca -0.09 -0.51 0.00 0.00 0.33 0.00 0.00 56.93 56.65 1u3n s PHE 85 Cb -0.13 -0.85 0.00 0.00 -1.31 0.00 0.00 43.02 40.73 1u3n s PHE 85 CO 0.03 0.33 0.00 0.72 1.83 0.00 0.00 175.22 178.13 1u3n n HIS 86 N 0.04 0.00 -1.93 10.12 8.25 -1.26 -4.83 115.22 125.61 1u3n n HIS 86 Ca -0.11 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.93 1u3n n HIS 86 Cb 0.58 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.68 1u3n n HIS 86 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1u3n n ILE 87 N 0.00 3.29 -2.86 1.59 -5.35 -1.26 -4.34 119.36 110.43 1u3n n ILE 87 Ca 0.00 -3.09 -0.12 0.00 -0.27 0.00 0.00 62.75 59.27 1u3n n ILE 87 Cb 0.00 -2.47 0.03 0.00 -1.74 0.00 0.00 39.64 35.46 1u3n n ILE 87 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1u3n n TYR 88 N 7.48 -2.45 -3.94 4.28 4.01 -1.23 -4.86 117.16 120.44 1u3n n TYR 88 Ca 0.50 -2.31 0.01 0.00 -0.16 0.00 0.00 57.90 55.95 1u3n n TYR 88 Cb 0.42 1.06 0.00 0.00 -0.31 0.00 0.00 39.34 40.51 1u3n n TYR 88 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 1u3n n GLU 89 N 1.32 0.02 -3.86 -0.72 0.28 -1.26 -4.62 120.64 111.80 1u3n n GLU 89 Ca 0.12 -0.16 -0.36 0.00 -0.16 0.00 0.00 57.16 56.60 1u3n n GLU 89 Cb 0.62 0.29 -0.07 0.00 1.43 0.00 0.00 31.44 33.71 1u3n n GLU 89 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 1u3n s LYS 90 N -2.00 3.64 -0.31 3.44 0.00 -1.26 -4.27 119.74 118.98 1u3n s LYS 90 Ca 0.08 -0.17 -0.22 0.00 0.00 0.00 0.00 55.97 55.66 1u3n s LYS 90 Cb -0.00 -3.24 -0.00 0.00 0.00 0.00 0.00 37.83 34.59 1u3n s LYS 90 CO -0.00 0.63 0.70 0.20 0.00 0.00 0.00 175.35 176.87 1u3n s GLY 91 N -0.60 1.74 -0.27 0.59 0.00 -1.26 -4.87 107.32 102.66 1u3n s GLY 91 Ca 0.13 -0.56 -0.01 0.00 0.00 0.00 0.00 44.72 44.28 1u3n s GLY 91 CO 0.02 1.59 0.45 -0.45 0.00 0.00 0.00 173.10 174.71 1u3n s SER 92 N 1.64 -0.20 -0.29 1.64 0.15 -1.26 -4.88 113.70 110.50 1u3n s SER 92 Ca 0.28 0.21 -0.01 0.00 0.70 0.00 0.00 55.95 57.13 1u3n s SER 92 Cb -0.15 1.40 0.13 0.00 -1.71 0.00 0.00 66.02 65.69 1u3n s SER 92 CO 0.12 -0.30 0.26 0.00 1.20 0.00 0.00 173.24 174.52 1u3n s VAL 94 N 2.31 0.08 0.18 0.00 0.11 -1.26 -5.05 120.40 116.77 1u3n s VAL 94 Ca 0.09 -0.63 -0.17 0.00 -2.93 0.00 0.00 61.98 58.34 1u3n s VAL 94 Cb -0.14 -0.62 0.15 0.00 -1.53 0.00 0.00 36.38 34.24 1u3n s VAL 94 CO -0.33 -0.35 1.29 0.54 -3.33 0.00 0.00 175.10 172.92 1u3n n ARG 95 N 1.20 -0.23 0.00 1.54 3.00 -1.26 -3.25 116.66 117.66 1u3n n ARG 95 Ca -0.21 1.28 0.00 0.00 -0.01 0.00 0.00 57.85 58.90 1u3n n ARG 95 Cb 0.56 -1.89 0.00 0.00 0.00 0.00 0.00 32.46 31.13 1u3n n ARG 95 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1u3n n PRO 96 N -5.19 0.00 -0.84 5.56 -0.04 -1.26 -5.08 135.00 128.15 1u3n n PRO 96 Ca 0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 1u3n n PRO 96 Cb 0.31 -0.47 0.00 0.00 -0.04 0.00 0.00 33.50 33.30 1u3n n PRO 96 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1u3n n ASP 97 N -0.35 -5.06 -0.02 3.54 -0.08 -1.20 -4.98 116.55 108.41 1u3n n ASP 97 Ca 0.00 0.65 -0.02 0.00 -1.51 0.00 0.00 54.79 53.91 1u3n n ASP 97 Cb 0.00 -2.02 -0.03 0.00 2.34 0.00 0.00 41.12 41.41 1u3n n ASP 97 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 1u3n n PHE 98 N -0.83 0.00 -2.04 -0.67 -0.00 -1.26 -5.05 117.46 107.61 1u3n n PHE 98 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.17 1u3n n PHE 98 Cb 0.00 -0.18 0.11 0.00 -0.00 0.00 0.00 39.48 39.41 1u3n n PHE 98 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.76 175.55 1u3n s GLU 99 N -2.09 1.69 -0.11 -4.13 0.41 -1.26 -5.09 118.70 108.13 1u3n s GLU 99 Ca -0.02 -0.20 -0.33 0.00 -0.41 0.00 0.00 54.97 54.01 1u3n s GLU 99 Cb 0.01 -2.01 0.14 0.00 -1.78 0.00 0.00 34.13 30.49 1u3n s GLU 99 CO 0.15 -1.68 1.40 -1.12 -0.49 0.00 0.00 175.26 173.51 1u3n s SER 100 N -4.65 -0.02 -0.11 -0.19 0.01 -1.26 -5.09 113.70 102.40 1u3n s SER 100 Ca 0.65 -0.03 -0.00 0.00 1.31 0.00 0.00 55.95 57.87 1u3n s SER 100 Cb -0.09 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.18 1u3n s SER 100 CO 0.48 -0.08 0.00 0.00 0.41 0.00 0.00 173.24 174.06 1u3n n ALA 101 N -0.43 -2.51 -2.77 1.44 0.00 -1.26 -5.02 120.51 109.96 1u3n n ALA 101 Ca -0.08 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1u3n n ALA 101 Cb 0.63 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.32 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 1.14 1.58 5.88 0.00 0.00 -1.26 -4.97 105.19 107.57 1u3n n GLY 102 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 5.00 0.54 0.00 -0.02 0.00 -1.26 -4.29 105.19 105.16 1u3n n GLY 103 Ca 0.00 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.68 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 0.24 -3.20 1.61 -0.04 -1.26 -4.88 135.00 127.47 1u3n n PRO 104 Ca 0.00 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.22 1u3n n PRO 104 Cb 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.40 1u3n n PRO 104 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1u3n n PHE 105 N -1.27 1.93 -3.87 0.54 3.01 -1.26 -4.95 117.46 111.59 1u3n n PHE 105 Ca 0.00 -3.89 -0.32 0.00 1.01 0.00 0.00 57.45 54.25 1u3n n PHE 105 Cb 0.00 -0.46 0.01 0.00 -0.01 0.00 0.00 39.48 39.02 1u3n n PHE 105 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1u3n n ASN 106 N 0.62 -4.24 -3.68 4.37 4.13 -1.26 -4.69 115.26 110.50 1u3n n ASN 106 Ca 0.27 -1.06 -0.43 0.00 1.68 0.00 0.00 54.58 55.04 1u3n n ASN 106 Cb 0.49 -1.49 -0.03 0.00 -1.54 0.00 0.00 39.78 37.21 1u3n n ASN 106 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1u3n n PRO 107 N -3.47 2.14 0.00 3.52 -0.04 -1.26 -4.82 135.00 131.06 1u3n n PRO 107 Ca -0.23 -2.20 0.00 0.00 -0.04 0.00 0.00 63.50 61.03 1u3n n PRO 107 Cb 0.61 -3.10 0.00 0.00 -0.04 0.00 0.00 33.50 30.97 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 6.86 0.00 -3.09 1.53 4.32 -1.26 -4.86 117.00 120.50 1u3n n LEU 108 Ca 0.51 0.00 -0.00 0.00 -0.02 0.00 0.00 56.01 56.50 1u3n n LEU 108 Cb 0.40 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.20 1u3n n LEU 108 CO 0.97 0.00 -0.42 0.59 -1.22 0.00 0.00 177.39 177.31 1u3n n ASN 109 N 0.00 -6.74 -3.27 -1.43 3.02 -1.26 -4.57 115.26 101.01 1u3n n ASN 109 Ca 0.00 0.65 -0.26 0.00 -0.03 0.00 0.00 54.58 54.95 1u3n n ASN 109 Cb 0.00 -2.16 -0.02 0.00 -0.61 0.00 0.00 39.78 36.98 1u3n n ASN 109 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1u3n n LYS 110 N 1.43 1.89 0.07 3.52 5.02 -1.26 -3.71 118.16 125.11 1u3n n LYS 110 Ca -0.01 -1.51 0.00 0.00 -2.02 0.00 0.00 58.31 54.77 1u3n n LYS 110 Cb 0.36 -2.54 0.00 0.00 -0.02 0.00 0.00 35.03 32.83 1u3n n LYS 110 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1u3n n GLU 111 N 4.84 0.00 -4.26 1.97 -0.58 -1.26 -5.02 120.64 116.33 1u3n n GLU 111 Ca 0.44 0.00 -0.33 0.00 -0.42 0.00 0.00 57.16 56.85 1u3n n GLU 111 Cb 0.19 -0.37 -0.08 0.00 -0.57 0.00 0.00 31.44 30.60 1u3n n GLU 111 CO 0.00 0.00 0.00 -2.39 -0.48 0.00 0.00 177.13 174.26 1u3n n HIS 112 N -3.47 -1.30 -2.72 -0.32 1.44 -1.24 -4.92 115.22 102.68 1u3n n HIS 112 Ca 0.00 0.53 0.00 0.00 -2.01 0.00 0.00 57.72 56.24 1u3n n HIS 112 Cb 0.00 -2.85 0.00 0.00 0.12 0.00 0.00 29.99 27.26 1u3n n HIS 112 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1u3n n GLY 113 N -2.48 3.85 0.06 -1.39 0.00 -1.26 -4.80 105.19 99.16 1u3n n GLY 113 Ca -0.30 -2.08 0.12 0.00 0.00 0.00 0.00 46.02 43.77 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 -0.19 0.48 0.00 1.61 -0.00 -1.26 -3.44 117.46 114.66 1u3n n PHE 114 Ca 0.00 0.14 0.00 0.00 -0.00 0.00 0.00 57.45 57.59 1u3n n PHE 114 Cb 0.00 -0.60 0.00 0.00 -0.00 0.00 0.00 39.48 38.88 1u3n n PHE 114 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 1u3n n ASN 115 N -2.10 0.00 0.04 -2.13 2.85 -1.26 -4.80 115.26 107.87 1u3n n ASN 115 Ca 0.02 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.49 1u3n n ASN 115 Cb 0.45 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.47 1u3n n ASN 115 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1u3n n ASN 116 N 0.00 -0.69 -3.25 1.20 3.02 -1.23 -5.07 115.26 109.25 1u3n n ASN 116 Ca 0.00 0.50 0.00 0.00 -0.03 0.00 0.00 54.58 55.05 1u3n n ASN 116 Cb 0.00 1.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.17 1u3n n ASN 116 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1u3n n PRO 117 N -2.95 1.46 0.15 3.52 -0.04 -1.26 -4.77 135.00 131.10 1u3n n PRO 117 Ca 0.00 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.52 1u3n n PRO 117 Cb 0.00 0.00 0.30 0.00 -0.04 0.00 0.00 33.50 33.76 1u3n n PRO 117 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1u3n n MET 118 N 0.00 0.08 0.00 0.54 0.00 -1.26 -4.65 117.12 111.83 1u3n n MET 118 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 57.70 58.23 1u3n n MET 118 Cb 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 33.22 31.16 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 -1.27 -2.40 3.62 3.17 0.00 -1.26 -5.17 105.19 101.87 1u3n n GLY 119 Ca -0.01 0.82 0.04 0.00 0.00 0.00 0.00 46.02 46.87 1u3n n GLY 119 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1u3n s HIS 120 N 0.00 -0.00 0.00 1.61 -3.43 -1.26 -3.49 115.29 108.71 1u3n s HIS 120 Ca 0.00 -0.01 0.00 0.00 -0.80 0.00 0.00 55.06 54.25 1u3n s HIS 120 Cb 0.00 0.51 0.00 0.00 -1.43 0.00 0.00 32.58 31.66 1u3n s HIS 120 CO 0.00 -0.04 0.00 0.72 -2.00 0.00 0.00 174.74 173.42 1u3n n HIS 121 N -0.56 0.00 0.03 0.38 8.25 -1.22 -4.10 115.22 118.00 1u3n n HIS 121 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 1u3n n HIS 121 Cb 0.63 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.74 1u3n n HIS 121 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1u3n n ALA 122 N 8.30 3.00 0.00 -1.41 0.00 -1.26 -4.32 120.51 124.82 1u3n n ALA 122 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1u3n n ALA 122 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.46 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 1.84 0.08 3.44 0.00 0.00 -1.26 -4.76 105.19 104.53 1u3n n GLY 123 Ca 0.00 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1u3n n GLY 123 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1u3n s ASP 124 N -1.22 4.75 -0.42 1.61 1.11 -1.26 -5.02 116.67 116.21 1u3n s ASP 124 Ca 0.00 -0.21 0.07 0.00 0.18 0.00 0.00 52.55 52.58 1u3n s ASP 124 Cb 0.00 -1.80 0.22 0.00 1.07 0.00 0.00 42.92 42.41 1u3n s ASP 124 CO 0.00 0.07 0.56 0.00 1.18 0.00 0.00 175.17 176.98 1u3n n LEU 125 N 4.17 -0.81 -4.81 1.23 -0.00 -1.26 -5.07 117.00 110.45 1u3n n LEU 125 Ca -0.17 -4.23 -0.30 0.00 -0.00 0.00 0.00 56.01 51.30 1u3n n LEU 125 Cb 0.52 0.66 0.08 0.00 -0.00 0.00 0.00 43.42 44.68 1u3n n LEU 125 CO 0.31 2.00 0.71 -2.16 -0.00 0.00 0.00 177.39 178.25 1u3n s PRO 126 N -0.39 2.31 -1.17 1.47 0.04 -1.26 -4.97 135.00 131.03 1u3n s PRO 126 Ca 0.34 0.72 -0.07 0.00 0.04 0.00 0.00 61.00 62.03 1u3n s PRO 126 Cb 0.13 -1.94 0.25 0.00 0.04 0.00 0.00 34.50 32.98 1u3n s PRO 126 CO -0.15 -1.48 1.63 0.09 0.04 0.00 0.00 177.00 177.13 1u3n n ASN 127 N -3.35 5.82 -3.08 6.66 4.13 -1.26 -4.71 115.26 119.46 1u3n n ASN 127 Ca 0.07 -3.27 -0.20 0.00 1.68 0.00 0.00 54.58 52.86 1u3n n ASN 127 Cb 0.56 -1.37 -0.03 0.00 -1.54 0.00 0.00 39.78 37.40 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 2.53 2.02 -3.38 3.41 4.77 -1.26 -4.96 117.00 120.12 1u3n n LEU 128 Ca 0.32 -5.16 -0.39 0.00 -0.03 0.00 0.00 56.01 50.75 1u3n n LEU 128 Cb 0.35 0.31 -0.01 0.00 -2.33 0.00 0.00 43.42 41.74 1u3n n LEU 128 CO 0.75 2.28 2.24 -1.84 -1.33 0.00 0.00 177.39 179.49 1u3n n GLU 129 N 0.09 4.43 0.00 3.23 0.28 -1.26 -4.21 120.64 123.21 1u3n n GLU 129 Ca 0.26 -3.44 0.00 0.00 -0.16 0.00 0.00 57.16 53.82 1u3n n GLU 129 Cb 0.59 -2.56 0.00 0.00 1.43 0.00 0.00 31.44 30.89 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 1.47 0.00 0.00 3.84 0.31 -1.26 -4.78 118.33 117.91 1u3n n VAL 130 Ca 0.60 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.93 1u3n n VAL 130 Cb 0.28 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.21 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 2.30 0.28 2.92 0.00 -1.26 -4.66 105.19 104.78 1u3n n GLY 131 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.06 1.57 -3.53 4.61 0.00 -1.26 -4.99 120.51 115.85 1u3n n ALA 132 Ca 0.00 -0.68 -0.22 0.00 0.00 0.00 0.00 53.44 52.54 1u3n n ALA 132 Cb 0.00 -0.24 0.08 0.00 0.00 0.00 0.00 19.45 19.28 1u3n n ALA 132 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1u3n n ASP 133 N 0.00 -6.04 -4.08 0.00 2.03 -1.26 -2.05 116.55 105.15 1u3n n ASP 133 Ca 0.00 -0.51 -0.31 0.00 0.52 0.00 0.00 54.79 54.49 1u3n n ASP 133 Cb 0.60 -4.76 -0.02 0.00 -0.72 0.00 0.00 41.12 36.22 1u3n n ASP 133 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1u3n n GLY 134 N -1.91 -0.36 3.52 0.27 0.00 -1.20 -3.91 105.19 101.59 1u3n n GLY 134 Ca 0.00 0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 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 -4.43 3.24 -3.78 1.61 5.02 -0.87 -1.81 118.16 117.15 1u3n n LYS 135 Ca -0.08 -3.42 -0.36 0.00 -2.02 0.00 0.00 58.31 52.42 1u3n n LYS 135 Cb 0.57 -3.36 -0.12 0.00 -0.02 0.00 0.00 35.03 32.11 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 3.42 3.29 -0.87 -0.18 1.01 -1.26 -5.02 120.40 120.80 1u3n s VAL 136 Ca 0.51 -2.01 -0.17 0.00 0.00 0.00 0.00 61.98 60.31 1u3n s VAL 136 Cb 0.02 -3.24 0.17 0.00 0.00 0.00 0.00 36.38 33.34 1u3n s VAL 136 CO 0.05 -0.66 0.95 1.51 0.00 0.00 0.00 175.10 176.96 1u3n s ASP 137 N 1.80 6.67 -0.54 3.32 -4.77 -1.25 -4.38 116.67 117.53 1u3n s ASP 137 Ca 0.07 -2.31 -0.28 0.00 -3.30 0.00 0.00 52.55 46.74 1u3n s ASP 137 Cb -0.23 -2.31 0.00 0.00 -1.09 0.00 0.00 42.92 39.29 1u3n s ASP 137 CO -0.04 -0.85 1.54 0.68 0.70 0.00 0.00 175.17 177.21 1u3n s VAL 138 N 1.57 3.67 -0.00 2.11 -7.23 -1.26 -4.66 120.40 114.59 1u3n s VAL 138 Ca 0.25 0.56 0.00 0.00 -1.81 0.00 0.00 61.98 60.98 1u3n s VAL 138 Cb -0.08 -4.25 0.00 0.00 0.56 0.00 0.00 36.38 32.61 1u3n s VAL 138 CO -0.09 -1.03 0.56 -0.38 -0.31 0.00 0.00 175.10 173.85 1u3n n ILE 139 N 6.99 0.10 -3.55 -0.62 2.08 -1.23 -4.26 119.36 118.87 1u3n n ILE 139 Ca 0.15 -0.10 -0.12 0.00 0.56 0.00 0.00 62.75 63.24 1u3n n ILE 139 Cb 0.49 0.93 -0.04 0.00 -0.75 0.00 0.00 39.64 40.28 1u3n n ILE 139 CO 0.00 0.00 0.00 -0.04 0.56 0.00 0.00 176.55 177.07 1u3n s MET 140 N -0.10 1.12 -0.17 0.38 -1.94 -1.26 -4.68 119.30 112.65 1u3n s MET 140 Ca 0.00 -0.49 -0.00 0.00 -1.71 0.00 0.00 55.69 53.49 1u3n s MET 140 Cb 0.00 0.51 0.00 0.00 2.01 0.00 0.00 34.83 37.35 1u3n s MET 140 CO 0.00 -0.45 0.14 -1.71 -0.01 0.00 0.00 175.02 173.00 1u3n n ASN 141 N -0.07 -2.21 -3.68 3.03 5.15 -1.26 -5.00 115.26 111.22 1u3n n ASN 141 Ca -0.17 -0.08 -0.23 0.00 -0.60 0.00 0.00 54.58 53.50 1u3n n ASN 141 Cb 0.63 -1.12 -0.18 0.00 -0.53 0.00 0.00 39.78 38.58 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 -3.05 0.45 -0.08 5.20 0.00 -1.26 -5.03 121.76 117.99 1u3n s ALA 142 Ca 0.03 -0.08 -0.27 0.00 0.00 0.00 0.00 51.96 51.63 1u3n s ALA 142 Cb -0.01 -0.80 -0.23 0.00 0.00 0.00 0.00 23.12 22.07 1u3n s ALA 142 CO 0.10 -0.72 1.02 -1.00 0.00 0.00 0.00 175.76 175.15 1u3n h PRO 143 N 8.39 0.00 -0.46 0.00 0.13 -1.97 -3.31 132.00 134.79 1u3n h PRO 143 Ca -0.15 -0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.68 1u3n h PRO 143 Cb 1.13 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.06 1u3n h PRO 143 CO 0.23 0.75 -0.62 -0.25 -0.23 0.00 0.00 178.00 177.88 1u3n n ASP 144 N -4.73 -1.85 -2.00 1.44 10.43 -1.26 -4.85 116.55 113.74 1u3n n ASP 144 Ca -0.09 -3.40 -0.24 0.00 2.57 0.00 0.00 54.79 53.62 1u3n n ASP 144 Cb 0.37 1.32 0.05 0.00 1.84 0.00 0.00 41.12 44.70 1u3n n ASP 144 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 1u3n n THR 145 N 0.83 2.74 -2.14 -3.53 -2.24 -1.26 -4.90 114.28 103.79 1u3n n THR 145 Ca 0.11 -3.86 -0.42 0.00 -2.27 0.00 0.00 64.05 57.61 1u3n n THR 145 Cb 0.66 -1.07 -0.03 0.00 -2.10 0.00 0.00 70.33 67.79 1u3n n THR 145 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1u3n s SER 146 N -3.18 6.76 -0.22 3.42 0.01 -1.25 -4.49 113.70 114.74 1u3n s SER 146 Ca 0.53 2.09 -0.04 0.00 1.31 0.00 0.00 55.95 59.84 1u3n s SER 146 Cb 0.43 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 64.08 1u3n s SER 146 CO 0.02 -0.86 2.86 0.18 0.41 0.00 0.00 173.24 175.86 1u3n n LEU 147 N 6.74 5.91 0.00 2.44 4.77 -1.26 -2.52 117.00 133.08 1u3n n LEU 147 Ca 0.16 -3.44 -0.07 0.00 -0.03 0.00 0.00 56.01 52.63 1u3n n LEU 147 Cb 0.43 -1.26 0.05 0.00 -2.33 0.00 0.00 43.42 40.31 1u3n n LEU 147 CO 0.60 1.55 0.21 2.29 -1.33 0.00 0.00 177.39 180.72 1u3n n LYS 148 N 1.43 -0.17 -0.95 3.23 2.85 -1.26 -4.63 118.16 118.66 1u3n n LYS 148 Ca 0.38 -0.57 -0.35 0.00 -1.05 0.00 0.00 58.31 56.71 1u3n n LYS 148 Cb 0.68 -0.32 0.06 0.00 -0.65 0.00 0.00 35.03 34.80 1u3n n LYS 148 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 1u3n n LYS 149 N -1.68 -0.07 -1.50 -1.58 2.85 -1.26 -4.46 118.16 110.46 1u3n n LYS 149 Ca 0.04 -0.01 -0.13 0.00 -1.05 0.00 0.00 58.31 57.16 1u3n n LYS 149 Cb 0.15 -1.20 -0.10 0.00 -0.65 0.00 0.00 35.03 33.22 1u3n n LYS 149 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1u3n n GLY 150 N 3.03 -0.28 0.00 2.58 0.00 -1.26 -3.68 105.19 105.57 1u3n n GLY 150 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 15.36 0.00 0.07 1.61 2.88 -1.26 -5.02 113.62 127.27 1u3n n SER 151 Ca 0.44 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 1u3n n SER 151 Cb 0.40 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 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 0.00 0.00 0.27 -1.46 4.76 -1.24 -4.91 118.16 115.58 1u3n n LYS 152 Ca 0.00 0.00 0.15 0.00 -2.87 0.00 0.00 58.31 55.59 1u3n n LYS 152 Cb 0.00 0.00 0.79 0.00 -1.84 0.00 0.00 35.03 33.98 1u3n n LYS 152 CO 0.00 0.00 0.00 1.37 -1.37 0.00 0.00 177.40 177.40 1u3n h LEU 153 N 0.00 0.00 -4.46 -0.35 8.10 -1.72 -2.88 115.31 113.99 1u3n h LEU 153 Ca 0.00 0.00 -0.41 0.00 0.11 0.00 0.00 57.88 57.58 1u3n h LEU 153 Cb 0.00 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.19 1u3n h LEU 153 CO 0.00 0.00 1.55 -0.46 -4.11 0.00 0.00 178.44 175.42 1u3n n ASN 154 N -2.65 6.86 0.14 0.17 6.94 -1.25 -3.93 115.26 121.53 1u3n n ASN 154 Ca -0.02 -2.53 0.07 0.00 -0.02 0.00 0.00 54.58 52.09 1u3n n ASN 154 Cb 0.22 -1.48 0.04 0.00 -2.36 0.00 0.00 39.78 36.20 1u3n n ASN 154 CO 0.00 0.00 0.00 0.16 -1.03 0.00 0.00 177.26 176.39 1u3n h ILE 155 N 2.46 0.30 0.00 1.53 3.07 -1.64 -3.38 117.51 119.85 1u3n h ILE 155 Ca 0.51 -1.48 -0.18 0.00 1.55 0.00 0.00 64.86 65.26 1u3n h ILE 155 Cb 0.95 1.98 -0.03 0.00 -0.27 0.00 0.00 36.82 39.45 1u3n h ILE 155 CO 0.94 0.17 -1.66 0.00 -1.05 0.00 0.00 178.15 176.56 1u3n n LEU 156 N -2.98 2.80 -4.04 0.16 -0.00 -1.25 -5.04 117.00 106.65 1u3n n LEU 156 Ca 0.00 -0.04 -0.14 0.00 -0.00 0.00 0.00 56.01 55.83 1u3n n LEU 156 Cb 0.64 -0.40 -0.12 0.00 -0.00 0.00 0.00 43.42 43.54 1u3n n LEU 156 CO 0.39 0.65 -0.40 -0.62 -0.00 0.00 0.00 177.39 177.41 1u3n s ASP 157 N -5.21 0.82 0.39 1.45 -1.08 -1.02 -5.01 116.67 107.03 1u3n s ASP 157 Ca -0.16 -0.46 0.25 0.00 -0.52 0.00 0.00 52.55 51.67 1u3n s ASP 157 Cb 0.04 0.01 1.38 0.00 -1.46 0.00 0.00 42.92 42.90 1u3n s ASP 157 CO 0.26 -0.15 1.77 -0.33 0.52 0.00 0.00 175.17 177.25 1u3n h GLU 158 N 4.79 0.00 0.13 4.34 5.08 -1.96 0.11 114.58 127.08 1u3n h GLU 158 Ca -0.34 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 57.69 1u3n h GLU 158 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1u3n h GLU 158 CO 0.42 0.00 -1.66 -0.44 -1.00 0.00 0.00 179.01 176.33 1u3n h ASP 159 N 0.00 0.43 0.00 1.42 3.45 -1.94 -3.45 116.42 116.32 1u3n h ASP 159 Ca 0.00 -0.66 0.00 0.00 0.43 0.00 0.00 57.03 56.80 1u3n h ASP 159 Cb 0.06 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 38.69 1u3n h ASP 159 CO 0.00 1.56 0.00 0.61 -1.57 0.00 0.00 179.24 179.84 1u3n n GLY 160 N 1.75 -0.00 3.28 2.75 0.00 0.39 -4.76 105.19 108.60 1u3n n GLY 160 Ca -0.21 -0.11 -0.17 0.00 0.00 0.00 0.00 46.02 45.53 1u3n n GLY 160 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1u3n s SER 161 N -4.00 1.19 -0.22 1.61 0.01 -1.25 -2.42 113.70 108.61 1u3n s SER 161 Ca 0.00 -1.59 -0.14 0.00 1.31 0.00 0.00 55.95 55.53 1u3n s SER 161 Cb 0.00 0.46 0.07 0.00 0.21 0.00 0.00 66.02 66.75 1u3n s SER 161 CO 0.00 -0.95 0.55 0.00 0.41 0.00 0.00 173.24 173.25 1u3n s ALA 162 N -3.71 -1.44 -0.43 1.44 0.00 -1.26 -1.19 121.76 115.17 1u3n s ALA 162 Ca 0.39 1.90 0.06 0.00 0.00 0.00 0.00 51.96 54.31 1u3n s ALA 162 Cb 0.04 -1.13 0.21 0.00 0.00 0.00 0.00 23.12 22.25 1u3n s ALA 162 CO 0.20 -0.31 0.56 1.97 0.00 0.00 0.00 175.76 178.18 1u3n n PHE 163 N 4.03 -1.61 -2.99 0.00 -1.74 0.15 -3.56 117.46 111.75 1u3n n PHE 163 Ca -0.20 -2.83 -0.40 0.00 -0.56 0.00 0.00 57.45 53.46 1u3n n PHE 163 Cb 0.57 0.46 -0.05 0.00 1.52 0.00 0.00 39.48 41.98 1u3n n PHE 163 CO 0.00 0.00 0.00 0.42 -0.56 0.00 0.00 176.76 176.62 1u3n s ILE 164 N -0.15 4.83 -0.41 1.97 1.01 -0.77 -4.18 121.20 123.51 1u3n s ILE 164 Ca 0.33 1.60 -0.26 0.00 0.00 0.00 0.00 60.65 62.32 1u3n s ILE 164 Cb 0.11 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.50 1u3n s ILE 164 CO -0.15 0.32 0.97 -0.63 0.00 0.00 0.00 174.94 175.44 1u3n s ILE 165 N 0.25 4.49 0.35 2.92 1.09 -0.76 -4.87 121.20 124.66 1u3n s ILE 165 Ca 0.39 1.09 -0.16 0.00 -1.10 0.00 0.00 60.65 60.87 1u3n s ILE 165 Cb -0.20 -4.41 0.04 0.00 -1.06 0.00 0.00 42.46 36.83 1u3n s ILE 165 CO 0.22 -0.70 0.73 -1.38 -0.10 0.00 0.00 174.94 173.71 1u3n s HIS 166 N 3.72 0.14 0.00 3.97 -3.43 -1.26 -2.28 115.29 116.14 1u3n s HIS 166 Ca 0.40 -0.70 0.00 0.00 -0.80 0.00 0.00 55.06 53.95 1u3n s HIS 166 Cb -0.11 0.69 0.00 0.00 -1.43 0.00 0.00 32.58 31.73 1u3n s HIS 166 CO 0.23 -1.42 0.00 0.39 -2.00 0.00 0.00 174.74 171.94 1u3n n GLU 167 N -0.51 -1.24 -2.83 -0.38 1.02 -1.26 -4.77 120.64 110.68 1u3n n GLU 167 Ca -0.06 0.31 -0.21 0.00 -0.02 0.00 0.00 57.16 57.18 1u3n n GLU 167 Cb 0.60 -4.29 0.06 0.00 -0.02 0.00 0.00 31.44 27.79 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 -1.28 2.24 -0.45 3.49 -1.52 -1.26 -4.82 119.66 116.06 1u3n s GLN 168 Ca 0.00 -1.27 0.00 0.00 -1.95 0.00 0.00 55.36 52.14 1u3n s GLN 168 Cb 0.00 -2.54 0.12 0.00 -0.22 0.00 0.00 33.01 30.37 1u3n s GLN 168 CO 0.00 -0.92 0.21 0.00 -0.25 0.00 0.00 175.29 174.33 1u3n s ALA 169 N -2.78 3.18 -0.03 6.09 0.00 -1.26 -3.30 121.76 123.66 1u3n s ALA 169 Ca 0.61 -2.80 0.04 0.00 0.00 0.00 0.00 51.96 49.81 1u3n s ALA 169 Cb -0.07 -2.28 -0.03 0.00 0.00 0.00 0.00 23.12 20.74 1u3n s ALA 169 CO 0.40 -1.86 -0.14 -0.51 0.00 0.00 0.00 175.76 173.65 1u3n s ASP 170 N 0.97 4.07 -0.17 0.00 1.11 -1.15 -3.92 116.67 117.58 1u3n s ASP 170 Ca 0.12 -0.22 -0.10 0.00 0.18 0.00 0.00 52.55 52.54 1u3n s ASP 170 Cb -0.22 -0.85 0.04 0.00 1.07 0.00 0.00 42.92 42.96 1u3n s ASP 170 CO -0.04 0.33 0.20 -0.67 1.18 0.00 0.00 175.17 176.16 1u3n n ASP 171 N 2.11 -1.20 -3.51 0.27 2.03 -1.26 -3.02 116.55 111.97 1u3n n ASP 171 Ca -0.17 1.16 -0.40 0.00 0.52 0.00 0.00 54.79 55.90 1u3n n ASP 171 Cb 0.52 -4.67 -0.01 0.00 -0.72 0.00 0.00 41.12 36.24 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 1.37 2.81 0.03 -0.67 9.36 -1.26 -4.00 117.16 124.80 1u3n n TYR 172 Ca -0.33 -2.99 0.00 0.00 3.32 0.00 0.00 57.90 57.89 1u3n n TYR 172 Cb 0.51 -2.36 0.00 0.00 -0.63 0.00 0.00 39.34 36.86 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 4.04 0.24 -3.11 2.98 4.77 -1.26 -5.09 117.00 119.56 1u3n n LEU 173 Ca 0.65 0.11 -0.18 0.00 -0.03 0.00 0.00 56.01 56.56 1u3n n LEU 173 Cb 0.29 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.38 1u3n n LEU 173 CO 0.84 -0.42 -0.36 1.07 -1.33 0.00 0.00 177.39 177.20 1u3n n THR 174 N -3.07 -2.62 0.00 -5.08 5.66 -1.26 -4.63 114.28 103.28 1u3n n THR 174 Ca 0.00 0.27 0.00 0.00 -3.05 0.00 0.00 64.05 61.27 1u3n n THR 174 Cb 0.19 -2.95 0.00 0.00 -1.55 0.00 0.00 70.33 66.02 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 0.64 0.00 -0.02 1.09 3.02 -1.26 -4.98 115.26 113.75 1u3n n ASN 175 Ca -0.04 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.39 1u3n n ASN 175 Cb 0.54 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.61 1u3n n ASN 175 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1u3n h PRO 176 N 0.00 -0.05 0.00 3.52 0.13 -2.02 -3.47 132.00 130.11 1u3n h PRO 176 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1u3n h PRO 176 Cb 0.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.14 1u3n h PRO 176 CO 0.00 0.59 0.00 0.43 -0.23 0.00 0.00 178.00 178.79 1u3n n SER 177 N -4.78 0.00 0.00 1.44 7.64 -1.26 -5.15 113.62 111.51 1u3n n SER 177 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.80 1u3n n SER 177 Cb 0.33 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 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 0.00 -0.49 0.00 0.23 0.00 -1.26 -4.90 105.19 98.77 1u3n n GLY 178 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1u3n n GLY 178 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1u3n n ASN 179 N 0.00 0.00 -3.14 1.61 0.23 -1.22 -4.81 115.26 107.93 1u3n n ASN 179 Ca 0.00 0.00 -0.21 0.00 -0.53 0.00 0.00 54.58 53.84 1u3n n ASN 179 Cb 0.00 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.66 1u3n n ASN 179 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1u3n n SER 180 N 0.00 1.67 0.00 0.53 3.41 -1.17 -2.93 113.62 115.14 1u3n n SER 180 Ca 0.00 -3.15 0.00 0.00 -0.26 0.00 0.00 58.87 55.46 1u3n n SER 180 Cb 0.00 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.34 1u3n n SER 180 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u3n n GLY 181 N 0.27 -2.00 1.49 5.00 0.00 -1.21 -4.78 105.19 103.96 1u3n n GLY 181 Ca 0.26 0.95 0.11 0.00 0.00 0.00 0.00 46.02 47.34 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 -3.08 -2.45 4.61 0.00 -1.26 -4.92 120.51 113.41 1u3n n ALA 182 Ca 0.00 0.75 -0.03 0.00 0.00 0.00 0.00 53.44 54.16 1u3n n ALA 182 Cb 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 19.45 17.93 1u3n n ALA 182 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1u3n n ARG 183 N -3.69 -1.28 0.00 0.00 1.74 -1.26 -4.86 116.66 107.31 1u3n n ARG 183 Ca -0.06 1.40 0.00 0.00 -0.77 0.00 0.00 57.85 58.42 1u3n n ARG 183 Cb 0.59 -4.29 0.00 0.00 -1.02 0.00 0.00 32.46 27.74 1u3n n ARG 183 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1u3n n ILE 184 N -0.85 0.00 -4.03 0.55 -0.00 -1.26 -4.91 119.36 108.85 1u3n n ILE 184 Ca 0.05 0.00 -0.31 0.00 -0.00 0.00 0.00 62.75 62.49 1u3n n ILE 184 Cb 0.39 0.00 -0.06 0.00 -0.00 0.00 0.00 39.64 39.97 1u3n n ILE 184 CO 0.00 0.00 0.00 -0.69 -0.00 0.00 0.00 176.55 175.86 1u3n s VAL 185 N 0.89 4.64 0.52 7.28 1.01 -0.97 -4.15 120.40 129.62 1u3n s VAL 185 Ca 0.00 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.29 1u3n s VAL 185 Cb 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.14 1u3n s VAL 185 CO 0.00 0.13 0.13 0.00 0.00 0.00 0.00 175.10 175.36 1u3n n GLY 187 N -1.42 1.94 3.84 0.00 0.00 -1.26 -3.32 105.19 104.97 1u3n n GLY 187 Ca -0.13 0.38 -0.05 0.00 0.00 0.00 0.00 46.02 46.21 1u3n n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u3n s ALA 188 N 0.00 -1.34 -0.36 4.61 0.00 -1.26 -0.67 121.76 122.74 1u3n s ALA 188 Ca 0.00 -0.38 -0.13 0.00 0.00 0.00 0.00 51.96 51.45 1u3n s ALA 188 Cb 0.00 0.72 0.02 0.00 0.00 0.00 0.00 23.12 23.86 1u3n s ALA 188 CO 0.00 -1.04 0.49 1.28 0.00 0.00 0.00 175.76 176.49 1u3n n LEU 189 N -0.60 -7.01 -4.14 0.00 4.77 -0.34 -4.38 117.00 105.30 1u3n n LEU 189 Ca -0.05 0.47 -0.36 0.00 -0.03 0.00 0.00 56.01 56.05 1u3n n LEU 189 Cb 0.60 -3.02 0.09 0.00 -2.33 0.00 0.00 43.42 38.76 1u3n n LEU 189 CO 0.21 -2.01 -1.23 0.18 -1.33 0.00 0.00 177.39 173.22 1u3n n LEU 190 N -0.31 -2.94 -4.57 2.23 4.77 -1.26 -3.94 117.00 110.98 1u3n n LEU 190 Ca 0.10 0.03 -0.28 0.00 -0.03 0.00 0.00 56.01 55.83 1u3n n LEU 190 Cb 0.38 -0.78 -0.06 0.00 -2.33 0.00 0.00 43.42 40.63 1u3n n LEU 190 CO 0.40 -3.44 1.47 -0.83 -1.33 0.00 0.00 177.39 173.67 1u3n s GLY 191 N -1.40 0.20 0.53 -0.72 0.00 -1.26 -4.24 107.32 100.42 1u3n s GLY 191 Ca 0.46 -2.02 0.06 0.00 0.00 0.00 0.00 44.72 43.22 1u3n s GLY 191 CO 0.69 3.52 0.39 0.54 0.00 0.00 0.00 173.10 178.25 1u3n s ASN 192 N 6.81 4.64 -0.30 1.64 2.20 -1.26 -3.89 114.94 124.79 1u3n s ASN 192 Ca 0.68 -1.22 -0.15 0.00 -0.94 0.00 0.00 52.86 51.24 1u3n s ASN 192 Cb -0.02 0.34 0.18 0.00 -2.00 0.00 0.00 41.25 39.75 1u3n s ASN 192 CO 0.10 -1.06 1.14 0.21 -2.94 0.00 0.00 177.10 174.55 1u3n s ASN 193 N -4.26 -0.17 -0.21 3.54 3.84 -1.26 -2.50 114.94 113.91 1u3n s ASN 193 Ca 0.35 0.03 -0.11 0.00 0.21 0.00 0.00 52.86 53.33 1u3n s ASN 193 Cb -0.02 1.11 0.07 0.00 -0.55 0.00 0.00 41.25 41.86 1u3n s ASN 193 CO 0.21 -0.03 0.51 -0.70 -2.79 0.00 0.00 177.10 174.31 1u3n s GLU 194 N 2.98 0.50 0.00 0.43 2.56 -1.26 -4.56 118.70 119.36 1u3n s GLU 194 Ca 0.27 0.98 0.00 0.00 0.00 0.00 0.00 54.97 56.22 1u3n s GLU 194 Cb -0.01 0.09 0.00 0.00 2.00 0.00 0.00 34.13 36.21 1u3n s GLU 194 CO -0.21 -0.16 0.00 0.36 -0.56 0.00 0.00 175.26 174.69 1u3n n LYS 195 N 4.42 -0.39 0.00 4.30 0.00 -1.26 -5.00 118.16 120.23 1u3n n LYS 195 Ca -0.21 0.00 0.15 0.00 -0.00 0.00 0.00 58.31 58.25 1u3n n LYS 195 Cb 0.56 0.00 0.69 0.00 -0.00 0.00 0.00 35.03 36.27 1u3n n LYS 195 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44