#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 -0.99 -0.30 3.34 0.11 -1.26 -5.13 120.40 116.17 1u3n s VAL 36 Ca 0.00 -0.01 -0.17 0.00 -2.93 0.00 0.00 61.98 58.87 1u3n s VAL 36 Cb 0.00 -1.00 0.20 0.00 -1.53 0.00 0.00 36.38 34.05 1u3n s VAL 36 CO 0.00 -0.01 1.24 -1.61 -3.33 0.00 0.00 175.10 171.39 1u3n s GLU 37 N 2.82 0.08 0.89 1.54 2.02 -1.26 -5.16 118.70 119.64 1u3n s GLU 37 Ca 0.10 0.15 -0.16 0.00 0.02 0.00 0.00 54.97 55.08 1u3n s GLU 37 Cb -0.10 0.05 -0.11 0.00 0.10 0.00 0.00 34.13 34.06 1u3n s GLU 37 CO -0.26 -0.02 -0.39 -2.37 0.02 0.00 0.00 175.26 172.24 1u3n n THR 38 N 3.65 0.15 -0.72 3.63 5.66 -1.26 -4.69 114.28 120.71 1u3n n THR 38 Ca -0.14 -0.44 0.00 0.00 -3.05 0.00 0.00 64.05 60.42 1u3n n THR 38 Cb 0.56 -0.17 0.00 0.00 -1.55 0.00 0.00 70.33 69.17 1u3n n THR 38 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1u3n n SER 39 N 2.22 -1.86 -2.90 1.09 7.64 -1.26 -5.07 113.62 113.48 1u3n n SER 39 Ca 0.02 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.83 1u3n n SER 39 Cb 0.54 -0.93 -0.01 0.00 -1.01 0.00 0.00 64.21 62.80 1u3n n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u3n s ALA 40 N 0.00 -1.57 -0.49 -0.43 0.00 -1.26 -5.06 121.76 112.96 1u3n s ALA 40 Ca 0.00 -0.69 -0.10 0.00 0.00 0.00 0.00 51.96 51.17 1u3n s ALA 40 Cb 0.00 -2.54 0.12 0.00 0.00 0.00 0.00 23.12 20.71 1u3n s ALA 40 CO 0.00 -2.20 0.37 -0.06 0.00 0.00 0.00 175.76 173.87 1u3n s PHE 41 N 0.84 3.41 0.32 0.00 0.40 -1.26 -5.01 117.98 116.68 1u3n s PHE 41 Ca 0.29 -1.83 0.00 0.00 -0.60 0.00 0.00 56.93 54.79 1u3n s PHE 41 Cb -0.00 -3.53 0.00 0.00 0.51 0.00 0.00 43.02 40.00 1u3n s PHE 41 CO -0.07 -1.00 0.00 0.41 0.70 0.00 0.00 175.22 175.26 1u3n n GLY 42 N 4.91 -1.80 2.75 4.36 0.00 -1.26 -3.93 105.19 110.22 1u3n n GLY 42 Ca -0.08 -1.05 -0.01 0.00 0.00 0.00 0.00 46.02 44.88 1u3n n GLY 42 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1u3n s HIS 43 N -2.22 -0.48 -0.66 1.61 -3.43 -0.04 -4.56 115.29 105.51 1u3n s HIS 43 Ca 0.00 -0.04 -0.08 0.00 -0.80 0.00 0.00 55.06 54.15 1u3n s HIS 43 Cb 0.00 0.09 -0.19 0.00 -1.43 0.00 0.00 32.58 31.05 1u3n s HIS 43 CO 0.00 -0.35 3.35 0.72 -2.00 0.00 0.00 174.74 176.46 1u3n n HIS 44 N 3.23 1.00 -2.83 0.38 8.25 0.51 -4.26 115.22 121.50 1u3n n HIS 44 Ca 0.09 -2.15 -0.10 0.00 -0.26 0.00 0.00 57.72 55.30 1u3n n HIS 44 Cb 0.63 -1.95 0.02 0.00 1.12 0.00 0.00 29.99 29.81 1u3n n HIS 44 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1u3n n VAL 45 N 2.90 -0.13 -2.20 1.59 0.31 -1.26 -3.77 118.33 115.77 1u3n n VAL 45 Ca 0.57 -1.82 -0.33 0.00 -0.01 0.00 0.00 64.34 62.75 1u3n n VAL 45 Cb 0.64 0.89 -0.04 0.00 -0.91 0.00 0.00 33.84 34.41 1u3n n VAL 45 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1u3n s GLN 46 N 0.45 2.85 -1.08 5.55 -0.21 -1.26 -3.96 119.66 122.00 1u3n s GLN 46 Ca 0.32 -0.32 -0.12 0.00 0.02 0.00 0.00 55.36 55.27 1u3n s GLN 46 Cb 0.19 -4.95 0.23 0.00 1.00 0.00 0.00 33.01 29.48 1u3n s GLN 46 CO -0.20 -2.91 1.13 -0.51 -2.12 0.00 0.00 175.29 170.68 1u3n s LEU 47 N 8.41 6.04 -0.20 2.90 1.43 -1.26 -4.25 118.68 131.75 1u3n s LEU 47 Ca 0.61 -3.21 -0.04 0.00 -1.03 0.00 0.00 54.13 50.46 1u3n s LEU 47 Cb -0.06 -2.27 -0.02 0.00 0.03 0.00 0.00 46.19 43.87 1u3n s LEU 47 CO 0.02 -0.49 -0.02 0.54 0.23 0.00 0.00 176.35 176.63 1u3n s VAL 48 N -0.12 3.73 0.35 -1.59 0.11 -1.26 -4.32 120.40 117.30 1u3n s VAL 48 Ca 0.31 -0.38 0.08 0.00 -2.93 0.00 0.00 61.98 59.06 1u3n s VAL 48 Cb -0.08 -2.69 -0.03 0.00 -1.53 0.00 0.00 36.38 32.06 1u3n s VAL 48 CO -0.06 0.43 0.29 0.20 -3.33 0.00 0.00 175.10 172.62 1u3n s ASN 49 N 1.12 5.19 0.00 3.54 0.01 -0.42 -3.92 114.94 120.47 1u3n s ASN 49 Ca 0.02 -0.56 0.18 0.00 -0.71 0.00 0.00 52.86 51.79 1u3n s ASN 49 Cb -0.14 -0.89 1.02 0.00 0.41 0.00 0.00 41.25 41.64 1u3n s ASN 49 CO 0.01 -0.38 1.48 0.54 -1.51 0.00 0.00 177.10 177.23 1u3n n ARG 50 N -1.37 0.47 0.00 -0.60 1.74 -1.26 -3.78 116.66 111.86 1u3n n ARG 50 Ca -0.01 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 1u3n n ARG 50 Cb 0.60 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 1u3n n ARG 50 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1u3n n GLU 51 N -1.08 0.00 0.00 5.56 1.02 -1.26 -4.69 120.64 120.19 1u3n n GLU 51 Ca 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1u3n n GLU 51 Cb 0.08 -0.86 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 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 -0.31 0.00 0.00 0.62 0.00 -1.25 -5.02 105.19 99.23 1u3n n GLY 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.25 0.00 -4.03 1.61 4.81 -1.25 -5.01 118.16 112.04 1u3n n LYS 53 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.13 1u3n n LYS 53 Cb 0.28 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 35.17 1u3n n LYS 53 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1u3n s ALA 54 N -1.00 2.28 -0.57 3.14 0.00 -1.26 -1.29 121.76 123.05 1u3n s ALA 54 Ca 0.00 -1.48 0.24 0.00 0.00 0.00 0.00 51.96 50.72 1u3n s ALA 54 Cb 0.00 -1.43 0.46 0.00 0.00 0.00 0.00 23.12 22.14 1u3n s ALA 54 CO 0.00 -1.01 1.51 -0.39 0.00 0.00 0.00 175.76 175.87 1u3n h VAL 55 N 6.56 0.00 0.00 0.00 -1.51 -1.82 -3.49 116.25 116.00 1u3n h VAL 55 Ca -0.24 -0.67 0.00 0.00 -1.23 0.00 0.00 66.70 64.56 1u3n h VAL 55 Cb 1.07 1.49 0.00 0.00 -2.13 0.00 0.00 31.29 31.72 1u3n h VAL 55 CO 0.47 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.42 1u3n n GLY 56 N 1.25 2.36 0.00 5.19 0.00 -1.26 -3.73 105.19 109.00 1u3n n GLY 56 Ca 0.04 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.81 1.61 1.16 -1.09 -4.64 117.46 110.68 1u3n n PHE 57 Ca 0.00 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.22 1u3n n PHE 57 Cb 0.00 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 37.74 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 4.06 -0.36 1.97 -1.09 -1.25 -3.91 121.20 118.62 1u3n s ILE 58 Ca 0.00 -0.26 0.01 0.00 -2.23 0.00 0.00 60.65 58.17 1u3n s ILE 58 Cb 0.00 -2.89 0.14 0.00 -1.58 0.00 0.00 42.46 38.14 1u3n s ILE 58 CO 0.00 0.37 0.23 -1.61 -1.23 0.00 0.00 174.94 172.69 1u3n s GLU 59 N 1.54 0.61 0.22 2.79 2.02 0.93 -4.02 118.70 122.79 1u3n s GLU 59 Ca 0.06 -1.44 -0.21 0.00 0.02 0.00 0.00 54.97 53.41 1u3n s GLU 59 Cb -0.15 -1.35 -0.08 0.00 0.10 0.00 0.00 34.13 32.65 1u3n s GLU 59 CO 0.02 -1.23 0.74 0.96 0.02 0.00 0.00 175.26 175.77 1u3n s ILE 60 N 0.94 4.53 -0.40 -1.63 -5.25 -1.24 -1.91 121.20 116.23 1u3n s ILE 60 Ca 0.20 1.36 0.09 0.00 -0.99 0.00 0.00 60.65 61.31 1u3n s ILE 60 Cb -0.20 -3.89 0.31 0.00 2.95 0.00 0.00 42.46 41.62 1u3n s ILE 60 CO -0.01 0.24 0.76 2.29 -1.79 0.00 0.00 174.94 176.43 1u3n n LYS 61 N 0.81 0.90 0.00 0.37 0.00 -1.26 -3.23 118.16 115.74 1u3n n LYS 61 Ca -0.02 -2.94 0.00 0.00 -0.00 0.00 0.00 58.31 55.35 1u3n n LYS 61 Cb 0.51 -1.45 0.00 0.00 -0.00 0.00 0.00 35.03 34.09 1u3n n LYS 61 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1u3n n GLU 62 N 0.69 0.00 -0.25 -1.58 0.28 -1.26 -4.48 120.64 114.03 1u3n n GLU 62 Ca 0.19 0.00 0.24 0.00 -0.16 0.00 0.00 57.16 57.43 1u3n n GLU 62 Cb 0.63 0.00 0.44 0.00 1.43 0.00 0.00 31.44 33.95 1u3n n GLU 62 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1u3n n SER 63 N 0.00 0.25 0.00 -1.84 2.88 -1.26 -4.66 113.62 108.98 1u3n n SER 63 Ca 0.00 1.30 0.00 0.00 -1.33 0.00 0.00 58.87 58.84 1u3n n SER 63 Cb 0.00 -0.62 0.00 0.00 -0.75 0.00 0.00 64.21 62.84 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 -4.80 0.00 -0.08 -3.46 2.03 -1.26 -3.85 116.55 105.13 1u3n n ASP 64 Ca 0.29 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.49 1u3n n ASP 64 Cb 0.98 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 41.31 1u3n n ASP 64 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 1u3n h ASP 65 N 0.00 0.00 -0.65 1.67 3.58 -1.96 -3.48 116.42 115.58 1u3n h ASP 65 Ca 0.00 -0.35 0.00 0.00 0.42 0.00 0.00 57.03 57.10 1u3n h ASP 65 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1u3n h ASP 65 CO 0.00 1.01 0.00 1.21 -2.88 0.00 0.00 179.24 178.58 1u3n n GLU 66 N -4.58 1.88 0.00 0.28 4.07 -1.25 -5.03 120.64 116.01 1u3n n GLU 66 Ca -0.15 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.95 1u3n n GLU 66 Cb 0.40 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.78 1u3n n GLU 66 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1u3n n GLY 67 N 5.00 -0.16 2.78 8.31 0.00 -1.26 -4.32 105.19 115.54 1u3n n GLY 67 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.86 -0.26 0.00 0.99 2.34 -1.26 -2.23 118.68 117.39 1u3n s LEU 68 Ca 0.00 -0.39 0.00 0.00 0.06 0.00 0.00 54.13 53.80 1u3n s LEU 68 Cb 0.00 0.57 0.00 0.00 -0.56 0.00 0.00 46.19 46.20 1u3n s LEU 68 CO 0.00 -0.35 0.89 -0.67 -1.06 0.00 0.00 176.35 175.16 1u3n n ASP 69 N 5.32 -0.75 -4.92 1.48 2.03 -1.26 -4.80 116.55 113.65 1u3n n ASP 69 Ca -0.04 -1.77 -0.23 0.00 0.52 0.00 0.00 54.79 53.27 1u3n n ASP 69 Cb 0.48 0.23 0.00 0.00 -0.72 0.00 0.00 41.12 41.11 1u3n n ASP 69 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1u3n s ILE 70 N 0.00 2.02 -0.26 5.18 -5.25 -1.26 -4.25 121.20 117.38 1u3n s ILE 70 Ca 0.00 -1.35 -0.02 0.00 -0.99 0.00 0.00 60.65 58.29 1u3n s ILE 70 Cb 0.00 -2.37 0.09 0.00 2.95 0.00 0.00 42.46 43.13 1u3n s ILE 70 CO -0.00 0.00 0.09 -1.00 -1.79 0.00 0.00 174.94 172.23 1u3n s HIS 71 N -2.67 1.09 -0.57 1.37 3.76 -0.80 -4.09 115.29 113.38 1u3n s HIS 71 Ca 0.44 -1.20 0.05 0.00 -0.15 0.00 0.00 55.06 54.20 1u3n s HIS 71 Cb -0.03 -1.26 0.35 0.00 1.11 0.00 0.00 32.58 32.75 1u3n s HIS 71 CO 0.27 -0.77 0.96 0.44 -0.85 0.00 0.00 174.74 174.79 1u3n n ILE 72 N 5.03 2.99 -4.77 0.60 -6.64 -1.26 -0.05 119.36 115.27 1u3n n ILE 72 Ca -0.05 -5.52 -0.26 0.00 -1.77 0.00 0.00 62.75 55.15 1u3n n ILE 72 Cb 0.44 -1.38 -0.16 0.00 -1.44 0.00 0.00 39.64 37.10 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 -3.47 2.08 -0.48 7.28 1.04 -1.22 -4.55 113.70 114.38 1u3n s SER 73 Ca 0.49 -0.35 0.07 0.00 0.48 0.00 0.00 55.95 56.64 1u3n s SER 73 Cb 0.29 -0.77 0.39 0.00 0.10 0.00 0.00 66.02 66.03 1u3n s SER 73 CO -0.14 0.10 1.00 0.00 0.98 0.00 0.00 173.24 175.18 1u3n n ALA 74 N 3.46 4.48 -3.39 5.32 0.00 -1.26 -2.67 120.51 126.44 1u3n n ALA 74 Ca -0.20 -4.27 -0.15 0.00 0.00 0.00 0.00 53.44 48.82 1u3n n ALA 74 Cb 0.53 -0.69 -0.05 0.00 0.00 0.00 0.00 19.45 19.24 1u3n n ALA 74 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1u3n s ASN 75 N -3.38 -0.52 0.00 0.00 0.01 -1.26 -4.64 114.94 105.15 1u3n s ASN 75 Ca 0.46 0.34 0.00 0.00 -0.71 0.00 0.00 52.86 52.94 1u3n s ASN 75 Cb 0.36 0.52 0.00 0.00 0.41 0.00 0.00 41.25 42.53 1u3n s ASN 75 CO -0.14 -0.71 0.00 -0.24 -1.51 0.00 0.00 177.10 174.51 1u3n n SER 76 N 0.51 0.00 0.00 -1.22 2.88 -0.96 -3.74 113.62 111.09 1u3n n SER 76 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 1u3n n SER 76 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 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 0.00 0.00 0.00 2.46 4.32 -1.24 -4.56 117.00 117.98 1u3n n LEU 77 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1u3n n LEU 77 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1u3n n LEU 77 CO 0.00 0.00 0.00 0.54 -1.22 0.00 0.00 177.39 176.71 1u3n n ARG 78 N 0.00 0.00 -0.84 3.23 1.74 -1.26 -4.73 116.66 114.80 1u3n n ARG 78 Ca 0.00 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.91 1u3n n ARG 78 Cb 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.35 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 2.00 -2.09 5.56 -0.04 -1.26 -4.36 135.00 134.81 1u3n n PRO 79 Ca 0.00 -1.15 -0.13 0.00 -0.04 0.00 0.00 63.50 62.17 1u3n n PRO 79 Cb 0.00 -2.16 0.01 0.00 -0.04 0.00 0.00 33.50 31.31 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 3.04 0.07 3.55 0.55 0.00 -1.26 -4.32 105.19 106.83 1u3n n GLY 80 Ca 0.43 0.39 -0.26 0.00 0.00 0.00 0.00 46.02 46.58 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 -0.63 2.93 -0.12 4.61 0.00 -1.26 -4.66 121.76 122.63 1u3n s ALA 81 Ca 0.13 -2.16 -0.04 0.00 0.00 0.00 0.00 51.96 49.90 1u3n s ALA 81 Cb -0.01 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.18 1u3n s ALA 81 CO 0.29 -0.04 0.02 -1.12 0.00 0.00 0.00 175.76 174.91 1u3n s SER 82 N -3.62 5.35 -0.29 0.00 0.01 -1.26 0.60 113.70 114.49 1u3n s SER 82 Ca 0.33 0.12 -0.03 0.00 1.31 0.00 0.00 55.95 57.69 1u3n s SER 82 Cb 0.06 -1.67 0.10 0.00 0.21 0.00 0.00 66.02 64.72 1u3n s SER 82 CO 0.17 0.31 0.12 -0.76 0.41 0.00 0.00 173.24 173.48 1u3n s LEU 83 N -0.47 1.16 1.06 2.44 2.01 -0.95 -4.35 118.68 119.58 1u3n s LEU 83 Ca 0.09 -1.39 -0.21 0.00 0.01 0.00 0.00 54.13 52.63 1u3n s LEU 83 Cb -0.12 -0.54 -0.01 0.00 0.01 0.00 0.00 46.19 45.53 1u3n s LEU 83 CO 0.02 -0.43 -0.49 0.61 1.01 0.00 0.00 176.35 177.08 1u3n n GLY 84 N 5.10 -2.75 0.00 -3.19 0.00 -1.26 -4.67 105.19 98.43 1u3n n GLY 84 Ca -0.05 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.94 0.00 0.00 1.61 7.35 -1.25 -4.69 117.46 116.54 1u3n n PHE 85 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1u3n n PHE 85 Cb 0.65 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.48 1u3n n PHE 85 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 1u3n n HIS 86 N 0.00 0.00 -1.90 -5.13 8.25 -1.26 -4.20 115.22 110.98 1u3n n HIS 86 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.23 1u3n n HIS 86 Cb 0.00 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.03 1u3n n HIS 86 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1u3n s ILE 87 N 0.00 3.36 -0.43 1.59 -1.09 -1.25 -4.48 121.20 118.90 1u3n s ILE 87 Ca 0.00 -0.57 0.06 0.00 -2.23 0.00 0.00 60.65 57.92 1u3n s ILE 87 Cb 0.00 -4.27 0.18 0.00 -1.58 0.00 0.00 42.46 36.78 1u3n s ILE 87 CO 0.00 -0.66 0.56 -0.31 -1.23 0.00 0.00 174.94 173.30 1u3n s TYR 88 N 12.95 -1.11 -0.00 3.97 2.02 -1.26 -4.95 117.35 128.97 1u3n s TYR 88 Ca 0.74 -0.43 -0.09 0.00 -0.37 0.00 0.00 57.07 56.91 1u3n s TYR 88 Cb -0.03 0.03 0.03 0.00 -0.40 0.00 0.00 41.96 41.59 1u3n s TYR 88 CO 0.13 -1.12 0.43 0.39 -1.57 0.00 0.00 175.55 173.81 1u3n n GLU 89 N 3.89 0.07 -3.70 -0.62 1.02 -1.26 -5.00 120.64 115.04 1u3n n GLU 89 Ca 0.14 -0.28 -0.13 0.00 -0.02 0.00 0.00 57.16 56.87 1u3n n GLU 89 Cb 0.53 0.45 -0.13 0.00 -0.02 0.00 0.00 31.44 32.27 1u3n n GLU 89 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 1u3n s LYS 90 N -2.01 0.19 0.20 3.49 -2.85 -1.26 -4.99 119.74 112.52 1u3n s LYS 90 Ca 0.10 0.62 0.00 0.00 -1.00 0.00 0.00 55.97 55.69 1u3n s LYS 90 Cb -0.00 -0.09 0.00 0.00 -2.06 0.00 0.00 37.83 35.68 1u3n s LYS 90 CO -0.00 -0.20 0.00 0.41 0.10 0.00 0.00 175.35 175.66 1u3n n GLY 91 N 4.61 -3.49 4.00 0.59 0.00 -1.26 -5.03 105.19 104.61 1u3n n GLY 91 Ca -0.19 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.58 1u3n n GLY 91 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1u3n s SER 92 N -2.95 4.80 0.57 1.61 1.04 -1.26 -5.05 113.70 112.46 1u3n s SER 92 Ca 0.00 -0.43 -0.15 0.00 0.48 0.00 0.00 55.95 55.84 1u3n s SER 92 Cb 0.00 -0.13 -0.05 0.00 0.10 0.00 0.00 66.02 65.94 1u3n s SER 92 CO 0.00 -1.52 1.03 0.00 0.98 0.00 0.00 173.24 173.72 1u3n n VAL 94 N -1.96 0.00 0.00 0.00 0.31 -1.26 -5.06 118.33 110.36 1u3n n VAL 94 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 1u3n n VAL 94 Cb 0.53 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 33.20 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 -2.34 0.00 -0.02 5.55 3.00 -1.26 -4.98 116.66 116.61 1u3n n ARG 95 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.85 57.69 1u3n n ARG 95 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 32.46 32.35 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 0.00 0.29 0.00 -0.14 0.13 -1.99 -3.46 132.00 126.84 1u3n h PRO 96 Ca 0.00 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1u3n h PRO 96 Cb 0.00 0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.20 1u3n h PRO 96 CO 0.00 0.97 0.00 -3.47 -0.23 0.00 0.00 178.00 175.27 1u3n n ASP 97 N -4.39 0.00 -2.78 1.44 2.03 -1.26 -4.76 116.55 106.83 1u3n n ASP 97 Ca -0.09 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.20 1u3n n ASP 97 Cb 0.55 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.94 1u3n n ASP 97 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1u3n n PHE 98 N 0.00 -3.38 -1.74 -0.67 -0.00 -1.26 -4.96 117.46 105.45 1u3n n PHE 98 Ca 0.00 1.66 -0.32 0.00 -0.00 0.00 0.00 57.45 58.79 1u3n n PHE 98 Cb 0.00 -3.43 0.04 0.00 -0.00 0.00 0.00 39.48 36.09 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 -1.21 3.06 -0.07 -4.13 0.41 -1.26 -5.00 118.70 110.50 1u3n s GLU 99 Ca -0.07 1.05 -0.03 0.00 -0.41 0.00 0.00 54.97 55.51 1u3n s GLU 99 Cb 0.00 -2.00 -0.03 0.00 -1.78 0.00 0.00 34.13 30.32 1u3n s GLU 99 CO 0.64 -1.00 -0.08 0.43 -0.49 0.00 0.00 175.26 174.75 1u3n n SER 100 N -2.73 1.18 0.00 -0.19 7.64 -1.26 -5.03 113.62 113.23 1u3n n SER 100 Ca 0.08 0.06 0.00 0.00 1.01 0.00 0.00 58.87 60.02 1u3n n SER 100 Cb 0.53 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 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 -3.17 0.00 0.00 -0.43 0.00 -1.26 -5.16 120.51 110.49 1u3n n ALA 101 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1u3n n ALA 101 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 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 -1.13 2.10 3.54 0.00 0.00 -1.26 -4.94 105.19 103.50 1u3n n GLY 102 Ca 0.00 -1.44 -0.45 0.00 0.00 0.00 0.00 46.02 44.12 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 2.34 0.78 3.73 -0.02 0.00 -1.26 -4.91 105.19 105.84 1u3n n GLY 103 Ca 0.00 0.83 -0.41 0.00 0.00 0.00 0.00 46.02 46.44 1u3n n GLY 103 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1u3n s PRO 104 N 6.45 4.51 1.10 1.61 0.04 -1.26 -5.01 135.00 142.44 1u3n s PRO 104 Ca 1.04 1.74 -0.17 0.00 0.04 0.00 0.00 61.00 63.65 1u3n s PRO 104 Cb -0.52 -3.31 0.16 0.00 0.04 0.00 0.00 34.50 30.87 1u3n s PRO 104 CO 0.40 -0.09 0.22 1.97 0.04 0.00 0.00 177.00 179.54 1u3n n PHE 105 N 3.12 -2.08 0.00 0.56 1.16 -1.26 -4.84 117.46 114.12 1u3n n PHE 105 Ca 0.06 -0.02 0.00 0.00 -1.87 0.00 0.00 57.45 55.62 1u3n n PHE 105 Cb 0.46 -1.45 0.00 0.00 -1.61 0.00 0.00 39.48 36.88 1u3n n PHE 105 CO 0.00 0.00 0.00 0.09 -1.87 0.00 0.00 176.76 174.98 1u3n n ASN 106 N -1.83 0.00 -3.23 5.98 3.02 -1.26 -4.96 115.26 112.99 1u3n n ASN 106 Ca 0.04 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.30 1u3n n ASN 106 Cb 0.49 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.64 1u3n n ASN 106 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1u3n n PRO 107 N 0.00 2.78 0.00 3.52 -0.04 -1.26 -4.74 135.00 135.26 1u3n n PRO 107 Ca 0.00 -1.77 0.00 0.00 -0.04 0.00 0.00 63.50 61.69 1u3n n PRO 107 Cb 0.00 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 30.86 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 3.93 0.00 0.00 1.53 4.32 -1.25 -4.94 117.00 120.59 1u3n n LEU 108 Ca 0.59 0.63 0.00 0.00 -0.02 0.00 0.00 56.01 57.21 1u3n n LEU 108 Cb 0.18 -0.13 0.00 0.00 -1.62 0.00 0.00 43.42 41.84 1u3n n LEU 108 CO 0.77 -0.13 0.00 -3.20 -1.22 0.00 0.00 177.39 173.61 1u3n n ASN 109 N -1.50 0.00 0.00 -1.43 2.85 -1.26 -4.97 115.26 108.94 1u3n n ASN 109 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1u3n n ASN 109 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1u3n n ASN 109 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 1u3n n LYS 110 N 0.00 0.00 -0.05 1.20 2.85 -1.26 -5.01 118.16 115.89 1u3n n LYS 110 Ca 0.00 0.00 -0.02 0.00 -1.05 0.00 0.00 58.31 57.24 1u3n n LYS 110 Cb 0.00 0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 34.37 1u3n n LYS 110 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1u3n h GLU 111 N 0.00 0.00 -6.02 -1.58 5.08 -1.96 -3.46 114.58 106.65 1u3n h GLU 111 Ca 0.00 0.00 -0.84 0.00 -1.00 0.00 0.00 59.36 57.52 1u3n h GLU 111 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1u3n h GLU 111 CO 0.00 0.00 0.86 0.72 -1.00 0.00 0.00 179.01 179.59 1u3n n HIS 112 N -3.97 1.67 -3.93 4.33 8.25 -1.26 -4.82 115.22 115.50 1u3n n HIS 112 Ca -0.03 0.98 0.01 0.00 -0.26 0.00 0.00 57.72 58.42 1u3n n HIS 112 Cb 0.12 -2.28 0.01 0.00 1.12 0.00 0.00 29.99 28.96 1u3n n HIS 112 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1u3n n GLY 113 N 4.81 0.41 3.55 -1.41 0.00 -1.25 -4.56 105.19 106.74 1u3n n GLY 113 Ca 0.36 -0.99 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 1u3n n GLY 113 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1u3n s PHE 114 N -2.49 1.57 0.00 1.61 2.19 -1.26 -3.71 117.98 115.89 1u3n s PHE 114 Ca 0.20 0.91 0.00 0.00 0.33 0.00 0.00 56.93 58.37 1u3n s PHE 114 Cb -0.01 -4.01 0.00 0.00 -1.31 0.00 0.00 43.02 37.69 1u3n s PHE 114 CO 0.00 -2.36 0.00 -1.71 1.83 0.00 0.00 175.22 172.98 1u3n n ASN 115 N 13.21 -1.64 -3.42 6.13 2.85 -1.26 -5.11 115.26 126.01 1u3n n ASN 115 Ca 0.23 0.00 -0.04 0.00 -0.11 0.00 0.00 54.58 54.66 1u3n n ASN 115 Cb 0.52 -0.82 0.01 0.00 1.24 0.00 0.00 39.78 40.73 1u3n n ASN 115 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 1u3n s ASN 116 N 0.00 -0.06 -0.04 1.20 -0.87 -1.26 -5.00 114.94 108.90 1u3n s ASN 116 Ca 0.00 -0.67 -0.24 0.00 -1.57 0.00 0.00 52.86 50.37 1u3n s ASN 116 Cb 0.00 0.57 -0.23 0.00 -0.02 0.00 0.00 41.25 41.57 1u3n s ASN 116 CO 0.00 -1.10 1.06 1.55 -2.57 0.00 0.00 177.10 176.04 1u3n h PRO 117 N 2.00 0.17 -0.07 -0.60 0.13 -1.95 -3.31 132.00 128.36 1u3n h PRO 117 Ca -0.27 -0.16 -0.20 0.00 -0.87 0.00 0.00 66.00 64.49 1u3n h PRO 117 Cb 1.23 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1u3n h PRO 117 CO 0.33 0.88 -0.80 0.52 -0.23 0.00 0.00 178.00 178.70 1u3n h MET 118 N -0.48 0.49 0.00 0.86 2.86 -1.97 -3.50 114.93 113.19 1u3n h MET 118 Ca -0.02 -0.44 0.00 0.00 -2.06 0.00 0.00 59.70 57.18 1u3n h MET 118 Cb 0.94 0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.70 1u3n h MET 118 CO 0.04 1.07 0.00 0.41 1.06 0.00 0.00 176.91 179.49 1u3n n GLY 119 N 0.70 0.30 3.15 8.32 0.00 -1.25 -4.97 105.19 111.43 1u3n n GLY 119 Ca -0.06 -1.92 -0.32 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.57 2.60 -0.85 1.61 -3.43 -1.24 -3.74 115.29 108.66 1u3n s HIS 120 Ca 0.00 -1.33 -0.16 0.00 -0.80 0.00 0.00 55.06 52.77 1u3n s HIS 120 Cb 0.00 -1.78 0.19 0.00 -1.43 0.00 0.00 32.58 29.56 1u3n s HIS 120 CO 0.00 -0.62 0.88 -1.01 -2.00 0.00 0.00 174.74 171.99 1u3n s HIS 121 N 0.89 3.52 0.00 0.38 3.76 -1.26 -4.84 115.29 117.75 1u3n s HIS 121 Ca -0.06 -1.76 0.00 0.00 -0.15 0.00 0.00 55.06 53.10 1u3n s HIS 121 Cb -0.15 -3.98 0.00 0.00 1.11 0.00 0.00 32.58 29.56 1u3n s HIS 121 CO -0.03 -1.16 0.00 0.00 -0.85 0.00 0.00 174.74 172.69 1u3n n ALA 122 N 4.90 0.00 0.00 -1.40 0.00 -1.26 -3.29 120.51 119.47 1u3n n ALA 122 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1u3n n ALA 122 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 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 0.00 0.14 3.64 0.00 0.00 -1.26 -5.02 105.19 102.69 1u3n n GLY 123 Ca 0.00 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.97 -0.82 0.02 1.61 2.15 -1.21 -3.86 116.67 113.60 1u3n s ASP 124 Ca 0.00 1.38 -0.12 0.00 0.43 0.00 0.00 52.55 54.24 1u3n s ASP 124 Cb 0.00 1.36 0.01 0.00 -0.30 0.00 0.00 42.92 43.99 1u3n s ASP 124 CO 0.00 -0.22 0.26 -1.48 -0.17 0.00 0.00 175.17 173.56 1u3n s LEU 125 N 1.25 1.06 0.92 -1.34 2.34 -1.26 -4.92 118.68 116.73 1u3n s LEU 125 Ca -0.07 -0.17 -0.12 0.00 0.06 0.00 0.00 54.13 53.83 1u3n s LEU 125 Cb -0.05 1.16 0.14 0.00 -0.56 0.00 0.00 46.19 46.89 1u3n s LEU 125 CO -0.14 -0.54 1.14 -2.16 -1.06 0.00 0.00 176.35 173.59 1u3n s PRO 126 N -2.14 1.10 0.42 1.48 0.04 -1.26 -5.08 135.00 129.57 1u3n s PRO 126 Ca -0.08 0.28 0.06 0.00 0.04 0.00 0.00 61.00 61.30 1u3n s PRO 126 Cb -0.03 -1.84 -0.07 0.00 0.04 0.00 0.00 34.50 32.61 1u3n s PRO 126 CO -0.01 -2.22 0.01 -0.80 0.04 0.00 0.00 177.00 174.02 1u3n s ASN 127 N -4.04 3.86 0.00 6.66 0.01 -1.26 -4.95 114.94 115.22 1u3n s ASN 127 Ca 0.64 -1.42 0.00 0.00 -0.71 0.00 0.00 52.86 51.37 1u3n s ASN 127 Cb -0.15 -0.24 0.00 0.00 0.41 0.00 0.00 41.25 41.27 1u3n s ASN 127 CO 0.53 -0.52 0.00 0.18 -1.51 0.00 0.00 177.10 175.78 1u3n n LEU 128 N -1.00 -1.87 -2.88 0.60 4.77 -1.26 -4.44 117.00 110.92 1u3n n LEU 128 Ca -0.07 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.80 1u3n n LEU 128 Cb 0.67 -0.93 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 1u3n n LEU 128 CO 0.47 0.00 0.05 -1.84 -1.33 0.00 0.00 177.39 174.74 1u3n n GLU 129 N 0.07 0.62 0.00 3.23 0.28 -1.26 -2.25 120.64 121.34 1u3n n GLU 129 Ca 0.00 -2.19 0.00 0.00 -0.16 0.00 0.00 57.16 54.81 1u3n n GLU 129 Cb 0.00 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.41 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 2.20 0.00 0.00 3.84 3.14 0.20 -4.35 118.33 123.35 1u3n n VAL 130 Ca 0.16 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.54 1u3n n VAL 130 Cb 0.58 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.36 1u3n n VAL 130 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1u3n n GLY 131 N 0.00 0.53 0.00 7.55 0.00 -1.26 0.89 105.19 112.90 1u3n n GLY 131 Ca 0.00 -0.20 0.08 0.00 0.00 0.00 0.00 46.02 45.90 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 2.11 1.86 0.19 4.61 0.00 -1.26 -2.27 120.51 125.74 1u3n n ALA 132 Ca 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 53.44 53.39 1u3n n ALA 132 Cb 0.00 -1.26 0.11 0.00 0.00 0.00 0.00 19.45 18.31 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 -1.31 0.00 0.00 0.00 -0.08 0.26 -0.47 116.55 114.94 1u3n n ASP 133 Ca 0.07 0.45 0.00 0.00 -1.51 0.00 0.00 54.79 53.80 1u3n n ASP 133 Cb 0.13 -0.46 0.00 0.00 2.34 0.00 0.00 41.12 43.13 1u3n n ASP 133 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1u3n n GLY 134 N -0.95 -0.56 3.55 0.27 0.00 -0.80 -4.78 105.19 101.92 1u3n n GLY 134 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1u3n n GLY 134 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1u3n n LYS 135 N -0.10 3.21 -3.30 1.61 -0.00 0.38 -4.31 118.16 115.65 1u3n n LYS 135 Ca 0.00 -3.33 -0.46 0.00 -0.00 0.00 0.00 58.31 54.52 1u3n n LYS 135 Cb 0.06 -3.45 -0.01 0.00 -0.00 0.00 0.00 35.03 31.63 1u3n n LYS 135 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1u3n s VAL 136 N 3.92 5.66 -0.69 0.58 1.01 -1.26 -4.90 120.40 124.71 1u3n s VAL 136 Ca 0.53 -2.69 0.05 0.00 0.00 0.00 0.00 61.98 59.86 1u3n s VAL 136 Cb 0.04 -4.54 0.27 0.00 0.00 0.00 0.00 36.38 32.14 1u3n s VAL 136 CO 0.07 -1.12 0.87 -0.90 0.00 0.00 0.00 175.10 174.01 1u3n n ASP 137 N 3.82 4.19 -3.62 3.32 5.75 -1.26 -3.43 116.55 125.31 1u3n n ASP 137 Ca 0.18 -3.47 -0.15 0.00 -0.01 0.00 0.00 54.79 51.34 1u3n n ASP 137 Cb 0.45 -0.73 -0.07 0.00 -1.03 0.00 0.00 41.12 39.74 1u3n n ASP 137 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 1u3n s VAL 138 N -2.75 0.00 0.27 2.12 -7.23 -1.26 -4.51 120.40 107.04 1u3n s VAL 138 Ca 0.40 -0.02 0.10 0.00 -1.81 0.00 0.00 61.98 60.64 1u3n s VAL 138 Cb 0.15 -0.92 -0.04 0.00 0.56 0.00 0.00 36.38 36.13 1u3n s VAL 138 CO -0.01 -0.01 -0.02 -0.63 -0.31 0.00 0.00 175.10 174.11 1u3n s ILE 139 N -0.15 3.31 -0.22 -0.62 -1.09 -1.26 -4.94 121.20 116.22 1u3n s ILE 139 Ca -0.04 -1.96 -0.11 0.00 -2.23 0.00 0.00 60.65 56.31 1u3n s ILE 139 Cb -0.03 -2.79 0.08 0.00 -1.58 0.00 0.00 42.46 38.14 1u3n s ILE 139 CO 0.04 -0.37 0.53 -0.04 -1.23 0.00 0.00 174.94 173.87 1u3n s MET 140 N -3.66 0.51 0.00 2.79 -1.94 -1.26 -4.68 119.30 111.05 1u3n s MET 140 Ca 0.31 1.05 0.00 0.00 -1.71 0.00 0.00 55.69 55.34 1u3n s MET 140 Cb -0.06 0.18 0.00 0.00 2.01 0.00 0.00 34.83 36.96 1u3n s MET 140 CO 0.19 -0.17 0.00 -1.71 -0.01 0.00 0.00 175.02 173.32 1u3n n ASN 141 N 4.58 -1.90 -3.64 3.03 5.15 -1.26 -5.09 115.26 116.12 1u3n n ASN 141 Ca -0.19 0.00 -0.16 0.00 -0.60 0.00 0.00 54.58 53.64 1u3n n ASN 141 Cb 0.55 -0.95 -0.07 0.00 -0.53 0.00 0.00 39.78 38.77 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 -2.32 -1.29 0.10 5.20 0.00 -1.26 -4.95 121.76 117.24 1u3n s ALA 142 Ca 0.00 0.89 -0.10 0.00 0.00 0.00 0.00 51.96 52.75 1u3n s ALA 142 Cb 0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 23.12 22.92 1u3n s ALA 142 CO 0.00 -0.31 1.27 -1.00 0.00 0.00 0.00 175.76 175.72 1u3n h PRO 143 N 3.59 0.64 0.00 0.00 0.13 -1.91 -3.36 132.00 131.08 1u3n h PRO 143 Ca -0.28 -0.63 -0.13 0.00 -0.87 0.00 0.00 66.00 64.09 1u3n h PRO 143 Cb 1.16 0.16 -0.12 0.00 0.13 0.00 0.00 31.00 32.33 1u3n h PRO 143 CO 0.38 1.23 -0.10 -3.47 -0.23 0.00 0.00 178.00 175.81 1u3n n ASP 144 N -3.85 -1.59 -4.22 1.44 -0.08 -1.26 -4.36 116.55 102.63 1u3n n ASP 144 Ca -0.09 -2.27 -0.37 0.00 -1.51 0.00 0.00 54.79 50.55 1u3n n ASP 144 Cb 0.82 1.21 -0.05 0.00 2.34 0.00 0.00 41.12 45.44 1u3n n ASP 144 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1u3n n THR 145 N 0.89 -1.60 -0.06 5.18 -2.24 -0.95 -4.75 114.28 110.76 1u3n n THR 145 Ca -0.00 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1u3n n THR 145 Cb 0.72 -1.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.50 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 -2.56 0.14 -3.08 3.42 7.64 -1.26 -4.74 113.62 113.17 1u3n n SER 146 Ca -0.24 -0.48 0.00 0.00 1.01 0.00 0.00 58.87 59.16 1u3n n SER 146 Cb 0.64 0.57 0.00 0.00 -1.01 0.00 0.00 64.21 64.41 1u3n n SER 146 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1u3n n LEU 147 N -0.57 0.00 -4.68 -3.43 7.99 -1.26 -4.01 117.00 111.04 1u3n n LEU 147 Ca 0.00 0.00 -0.46 0.00 -0.01 0.00 0.00 56.01 55.54 1u3n n LEU 147 Cb 0.01 0.00 -0.04 0.00 -0.11 0.00 0.00 43.42 43.28 1u3n n LEU 147 CO 0.00 0.00 1.37 2.29 -1.51 0.00 0.00 177.39 179.54 1u3n n LYS 148 N -0.75 2.33 0.00 3.23 2.85 -1.26 -4.67 118.16 119.89 1u3n n LYS 148 Ca 0.00 0.85 0.00 0.00 -1.05 0.00 0.00 58.31 58.11 1u3n n LYS 148 Cb 0.00 -2.68 0.00 0.00 -0.65 0.00 0.00 35.03 31.70 1u3n n LYS 148 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1u3n n LYS 149 N 5.13 0.00 0.13 -1.58 4.76 -1.26 -5.08 118.16 120.26 1u3n n LYS 149 Ca 0.19 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.63 1u3n n LYS 149 Cb 0.31 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.50 1u3n n LYS 149 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1u3n n GLY 150 N 2.69 -0.30 0.00 0.72 0.00 -1.26 -5.03 105.19 102.00 1u3n n GLY 150 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1u3n n GLY 150 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1u3n n SER 151 N -3.38 0.00 0.00 1.61 7.64 -1.26 -5.01 113.62 113.22 1u3n n SER 151 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1u3n n SER 151 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1u3n n SER 151 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1u3n n LYS 152 N 0.00 0.00 -0.03 1.43 4.81 -1.26 -5.03 118.16 118.08 1u3n n LYS 152 Ca 0.00 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.39 1u3n n LYS 152 Cb 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.02 1u3n n LYS 152 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 1u3n n LEU 153 N -0.48 2.33 0.00 3.14 -0.00 -1.26 -4.20 117.00 116.53 1u3n n LEU 153 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1u3n n LEU 153 Cb 0.00 -0.20 0.00 0.00 -0.00 0.00 0.00 43.42 43.22 1u3n n LEU 153 CO 0.00 0.48 0.00 -3.20 -0.00 0.00 0.00 177.39 174.67 1u3n n ASN 154 N -2.83 -2.81 -0.02 1.45 5.15 -1.26 -4.31 115.26 110.63 1u3n n ASN 154 Ca -0.11 0.00 -0.07 0.00 -0.60 0.00 0.00 54.58 53.80 1u3n n ASN 154 Cb 0.60 -1.56 -0.02 0.00 -0.53 0.00 0.00 39.78 38.27 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 -2.36 0.74 -3.20 -1.44 0.13 -1.26 -4.74 119.36 107.22 1u3n n ILE 155 Ca 0.00 0.04 -0.24 0.00 -1.10 0.00 0.00 62.75 61.44 1u3n n ILE 155 Cb 0.14 -1.68 -0.06 0.00 -0.84 0.00 0.00 39.64 37.21 1u3n n ILE 155 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1u3n n LEU 156 N -3.50 2.29 -4.56 9.51 -0.00 -1.26 -4.72 117.00 114.75 1u3n n LEU 156 Ca -0.12 -5.19 -0.32 0.00 -0.00 0.00 0.00 56.01 50.38 1u3n n LEU 156 Cb 0.46 0.02 -0.11 0.00 -0.00 0.00 0.00 43.42 43.79 1u3n n LEU 156 CO 0.03 2.17 -0.41 -0.62 -0.00 0.00 0.00 177.39 178.56 1u3n s ASP 157 N -2.31 4.42 0.16 1.45 3.68 -1.26 -4.86 116.67 117.95 1u3n s ASP 157 Ca 0.40 -0.22 -0.29 0.00 2.13 0.00 0.00 52.55 54.58 1u3n s ASP 157 Cb 0.23 -0.96 -0.05 0.00 -1.45 0.00 0.00 42.92 40.69 1u3n s ASP 157 CO -0.08 0.27 1.47 1.21 0.13 0.00 0.00 175.17 178.17 1u3n n GLU 158 N 1.51 -0.41 -2.35 4.34 2.13 -1.26 -1.65 120.64 122.95 1u3n n GLU 158 Ca -0.15 1.44 -0.23 0.00 0.66 0.00 0.00 57.16 58.88 1u3n n GLU 158 Cb 0.52 -2.12 0.01 0.00 0.27 0.00 0.00 31.44 30.12 1u3n n GLU 158 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1u3n n ASP 159 N -5.21 4.40 -0.00 4.31 2.03 -1.26 -3.95 116.55 116.87 1u3n n ASP 159 Ca 0.02 -3.58 0.00 0.00 0.52 0.00 0.00 54.79 51.76 1u3n n ASP 159 Cb 0.26 -0.42 -0.00 0.00 -0.72 0.00 0.00 41.12 40.23 1u3n n ASP 159 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1u3n n GLY 160 N -0.53 0.54 3.87 0.27 0.00 -0.66 -4.76 105.19 103.91 1u3n n GLY 160 Ca 0.37 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.88 6.58 -0.21 1.61 0.01 -1.22 -4.62 113.70 114.96 1u3n s SER 161 Ca 0.00 0.69 -0.18 0.00 1.31 0.00 0.00 55.95 57.77 1u3n s SER 161 Cb 0.00 -2.14 0.06 0.00 0.21 0.00 0.00 66.02 64.15 1u3n s SER 161 CO 0.02 0.29 0.56 0.00 0.41 0.00 0.00 173.24 174.52 1u3n s ALA 162 N -1.20 -1.40 -0.46 1.44 0.00 -1.26 -3.00 121.76 115.88 1u3n s ALA 162 Ca 0.25 1.64 0.06 0.00 0.00 0.00 0.00 51.96 53.91 1u3n s ALA 162 Cb -0.14 -0.96 0.18 0.00 0.00 0.00 0.00 23.12 22.20 1u3n s ALA 162 CO 0.13 -0.27 0.60 -0.06 0.00 0.00 0.00 175.76 176.16 1u3n s PHE 163 N 0.47 -1.13 -0.29 0.00 0.08 0.42 -3.74 117.98 113.78 1u3n s PHE 163 Ca -0.01 -0.61 -0.26 0.00 0.12 0.00 0.00 56.93 56.17 1u3n s PHE 163 Cb -0.04 0.06 0.01 0.00 -0.57 0.00 0.00 43.02 42.48 1u3n s PHE 163 CO -0.02 -1.15 0.90 0.42 -0.10 0.00 0.00 175.22 175.27 1u3n s ILE 164 N 1.11 4.71 -0.21 0.64 -1.09 -1.26 -1.13 121.20 123.96 1u3n s ILE 164 Ca 0.25 1.49 -0.00 0.00 -2.23 0.00 0.00 60.65 60.15 1u3n s ILE 164 Cb -0.03 -4.24 0.05 0.00 -1.58 0.00 0.00 42.46 36.67 1u3n s ILE 164 CO -0.07 -0.28 -0.05 -0.63 -1.23 0.00 0.00 174.94 172.68 1u3n s ILE 165 N 3.16 1.29 0.00 2.92 1.09 -0.93 -3.85 121.20 124.88 1u3n s ILE 165 Ca 0.38 -0.95 0.00 0.00 -1.10 0.00 0.00 60.65 58.97 1u3n s ILE 165 Cb -0.14 -1.55 0.00 0.00 -1.06 0.00 0.00 42.46 39.71 1u3n s ILE 165 CO 0.12 -0.03 0.00 0.00 -0.10 0.00 0.00 174.94 174.93 1u3n n HIS 166 N 4.78 0.00 -0.74 3.97 1.44 -1.26 -1.68 115.22 121.72 1u3n n HIS 166 Ca -0.12 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.59 1u3n n HIS 166 Cb 0.46 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.57 1u3n n HIS 166 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1u3n n GLU 167 N -0.06 0.00 -3.97 -1.40 1.02 -1.26 -4.74 120.64 110.23 1u3n n GLU 167 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.05 1u3n n GLU 167 Cb 0.00 -2.62 -0.08 0.00 -0.02 0.00 0.00 31.44 28.72 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 -0.12 0.93 0.00 3.49 -0.21 -0.99 -4.59 119.66 118.17 1u3n s GLN 168 Ca 0.00 -1.14 0.00 0.00 0.02 0.00 0.00 55.36 54.24 1u3n s GLN 168 Cb 0.00 0.32 0.00 0.00 1.00 0.00 0.00 33.01 34.33 1u3n s GLN 168 CO 0.00 -0.30 0.00 0.00 -2.12 0.00 0.00 175.29 172.87 1u3n n ALA 169 N -0.10 0.00 0.00 6.09 0.00 -1.25 -4.06 120.51 121.20 1u3n n ALA 169 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1u3n n ALA 169 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 1u3n n ALA 169 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1u3n n ASP 170 N 0.00 0.00 -2.17 0.00 4.64 -1.26 -4.66 116.55 113.11 1u3n n ASP 170 Ca 0.00 0.00 -0.09 0.00 -1.38 0.00 0.00 54.79 53.32 1u3n n ASP 170 Cb 0.00 0.00 -0.02 0.00 -1.04 0.00 0.00 41.12 40.06 1u3n n ASP 170 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 1u3n n ASP 171 N 0.00 -0.76 -3.10 1.67 10.43 -1.26 -4.36 116.55 119.17 1u3n n ASP 171 Ca 0.00 -2.11 -0.35 0.00 2.57 0.00 0.00 54.79 54.90 1u3n n ASP 171 Cb 0.00 1.43 -0.03 0.00 1.84 0.00 0.00 41.12 44.36 1u3n n ASP 171 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1u3n n TYR 172 N -0.34 2.16 0.00 1.24 9.36 -1.26 -4.25 117.16 124.07 1u3n n TYR 172 Ca 0.01 -2.52 0.00 0.00 3.32 0.00 0.00 57.90 58.71 1u3n n TYR 172 Cb 0.34 -1.74 0.00 0.00 -0.63 0.00 0.00 39.34 37.31 1u3n n TYR 172 CO 0.00 0.00 0.00 1.47 0.22 0.00 0.00 176.86 178.55 1u3n n LEU 173 N 1.66 0.00 -2.74 2.98 -0.00 -1.26 -5.08 117.00 112.57 1u3n n LEU 173 Ca 0.59 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 56.38 1u3n n LEU 173 Cb 0.37 0.13 0.02 0.00 -0.00 0.00 0.00 43.42 43.94 1u3n n LEU 173 CO 0.57 -0.33 -0.17 1.07 -0.00 0.00 0.00 177.39 178.53 1u3n n THR 174 N -1.99 -2.21 0.00 1.47 5.66 -1.26 -4.38 114.28 111.56 1u3n n THR 174 Ca 0.00 0.03 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 1u3n n THR 174 Cb 0.00 -2.01 0.00 0.00 -1.55 0.00 0.00 70.33 66.77 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 -0.18 0.00 0.02 1.09 3.02 -1.26 -4.90 115.26 113.05 1u3n n ASN 175 Ca -0.09 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.27 1u3n n ASN 175 Cb 0.42 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.51 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 0.69 0.00 3.52 0.13 -2.00 -3.43 132.00 130.91 1u3n h PRO 176 Ca 0.00 -0.67 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1u3n h PRO 176 Cb 0.00 0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.30 1u3n h PRO 176 CO 0.00 1.27 -0.21 0.45 -0.23 0.00 0.00 178.00 179.28 1u3n n SER 177 N -3.87 0.10 -3.06 1.44 2.88 -1.26 -5.11 113.62 104.74 1u3n n SER 177 Ca -0.09 0.15 -0.00 0.00 -1.33 0.00 0.00 58.87 57.60 1u3n n SER 177 Cb 0.83 0.07 -0.00 0.00 -0.75 0.00 0.00 64.21 64.35 1u3n n SER 177 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1u3n n GLY 178 N 2.07 -1.09 0.07 0.46 0.00 -1.26 -4.88 105.19 100.56 1u3n n GLY 178 Ca 0.00 0.16 -0.02 0.00 0.00 0.00 0.00 46.02 46.16 1u3n n GLY 178 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1u3n h ASN 179 N 3.65 -0.22 0.00 1.61 -0.00 -1.96 -3.46 115.58 115.21 1u3n h ASN 179 Ca -0.02 0.02 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 1u3n h ASN 179 Cb 0.70 0.08 0.00 0.00 -0.00 0.00 0.00 38.32 39.10 1u3n h ASN 179 CO 0.02 -0.08 0.00 -0.24 -0.00 0.00 0.00 177.43 177.13 1u3n n SER 180 N -2.84 0.00 0.00 1.15 2.88 -1.26 -4.82 113.62 108.72 1u3n n SER 180 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1u3n n SER 180 Cb 0.06 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 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 -0.22 1.66 0.46 0.00 -1.26 -2.34 105.19 103.49 1u3n n GLY 181 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.29 -1.99 -1.50 4.61 0.00 -1.26 -4.25 120.51 115.83 1u3n n ALA 182 Ca 0.00 0.49 -0.27 0.00 0.00 0.00 0.00 53.44 53.66 1u3n n ALA 182 Cb 0.00 -1.49 -0.19 0.00 0.00 0.00 0.00 19.45 17.77 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 -2.02 0.06 0.01 0.00 1.74 -1.26 -4.19 116.66 111.00 1u3n n ARG 183 Ca 0.00 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1u3n n ARG 183 Cb 0.32 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 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 6.33 0.17 -3.08 0.55 -0.00 -1.26 -5.06 119.36 117.02 1u3n n ILE 184 Ca 0.65 0.06 -0.39 0.00 -0.00 0.00 0.00 62.75 63.07 1u3n n ILE 184 Cb 0.14 -0.89 -0.06 0.00 -0.00 0.00 0.00 39.64 38.83 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 -1.18 4.65 -0.21 1.39 1.01 -0.68 -4.81 120.40 120.57 1u3n s VAL 185 Ca 0.00 1.51 -0.20 0.00 0.00 0.00 0.00 61.98 63.29 1u3n s VAL 185 Cb 0.00 -4.05 0.06 0.00 0.00 0.00 0.00 36.38 32.39 1u3n s VAL 185 CO 0.00 0.46 0.58 0.00 0.00 0.00 0.00 175.10 176.14 1u3n s GLY 187 N 0.23 -0.19 -0.03 0.00 0.00 -0.29 -4.18 107.32 102.86 1u3n s GLY 187 Ca -0.01 0.66 -0.29 0.00 0.00 0.00 0.00 44.72 45.08 1u3n s GLY 187 CO 0.01 0.51 1.30 0.00 0.00 0.00 0.00 173.10 174.92 1u3n s ALA 188 N -0.38 -2.46 -0.14 3.20 0.00 -1.25 0.16 121.76 120.89 1u3n s ALA 188 Ca -0.05 0.20 -0.05 0.00 0.00 0.00 0.00 51.96 52.06 1u3n s ALA 188 Cb -0.03 0.78 0.01 0.00 0.00 0.00 0.00 23.12 23.87 1u3n s ALA 188 CO 0.02 -1.13 0.18 1.28 0.00 0.00 0.00 175.76 176.11 1u3n n LEU 189 N -0.82 -3.99 0.00 0.00 7.99 -1.16 -4.36 117.00 114.65 1u3n n LEU 189 Ca 0.01 0.21 0.00 0.00 -0.01 0.00 0.00 56.01 56.22 1u3n n LEU 189 Cb 0.60 -1.80 0.00 0.00 -0.11 0.00 0.00 43.42 42.10 1u3n n LEU 189 CO 0.14 -0.82 0.00 0.18 -1.51 0.00 0.00 177.39 175.39 1u3n n LEU 190 N -0.37 0.00 0.00 2.23 4.32 -1.04 -4.52 117.00 117.63 1u3n n LEU 190 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.03 1u3n n LEU 190 Cb 0.14 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.94 1u3n n LEU 190 CO 0.16 0.00 -0.11 0.61 -1.22 0.00 0.00 177.39 176.83 1u3n n GLY 191 N 0.00 0.00 3.77 -0.72 0.00 -1.26 -4.41 105.19 102.57 1u3n n GLY 191 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1u3n n GLY 191 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1u3n s ASN 192 N -4.97 6.54 -0.92 1.61 3.84 -1.20 0.19 114.94 120.04 1u3n s ASN 192 Ca 0.00 2.88 -0.24 0.00 0.21 0.00 0.00 52.86 55.71 1u3n s ASN 192 Cb 0.00 -2.66 0.04 0.00 -0.55 0.00 0.00 41.25 38.08 1u3n s ASN 192 CO 0.00 -0.71 1.43 0.21 -2.79 0.00 0.00 177.10 175.24 1u3n s ASN 193 N -0.30 6.30 -0.69 -4.21 3.84 -1.25 -4.36 114.94 114.26 1u3n s ASN 193 Ca 0.51 -1.07 -0.05 0.00 0.21 0.00 0.00 52.86 52.46 1u3n s ASN 193 Cb -0.43 -2.57 0.01 0.00 -0.55 0.00 0.00 41.25 37.71 1u3n s ASN 193 CO 0.58 -1.69 0.55 1.21 -2.79 0.00 0.00 177.10 174.96 1u3n n GLU 194 N 9.04 -1.45 0.00 0.43 2.13 -1.26 -4.49 120.64 125.05 1u3n n GLU 194 Ca 0.24 0.76 0.00 0.00 0.66 0.00 0.00 57.16 58.82 1u3n n GLU 194 Cb 0.50 -1.96 0.00 0.00 0.27 0.00 0.00 31.44 30.26 1u3n n GLU 194 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1u3n n LYS 195 N -2.09 0.00 0.00 5.31 4.81 -1.26 -5.18 118.16 119.75 1u3n n LYS 195 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.18 1u3n n LYS 195 Cb 0.63 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.68 1u3n n LYS 195 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51