#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 5.23 0.04 3.34 1.01 -1.26 -5.08 120.40 123.68 1u3n s VAL 36 Ca 0.00 0.13 0.07 0.00 0.00 0.00 0.00 61.98 62.18 1u3n s VAL 36 Cb 0.00 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 1u3n s VAL 36 CO 0.00 0.36 -0.19 -0.70 0.00 0.00 0.00 175.10 174.57 1u3n s GLU 37 N 1.00 1.29 -0.04 2.72 2.12 -1.26 -5.14 118.70 119.39 1u3n s GLU 37 Ca 0.07 -0.91 -0.29 0.00 0.36 0.00 0.00 54.97 54.20 1u3n s GLU 37 Cb -0.13 -1.39 0.09 0.00 0.26 0.00 0.00 34.13 32.96 1u3n s GLU 37 CO 0.04 0.35 0.81 -0.08 -0.54 0.00 0.00 175.26 175.84 1u3n s THR 38 N -0.82 0.00 -0.04 -1.70 -1.32 -1.26 -5.09 115.64 105.41 1u3n s THR 38 Ca 0.06 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.48 1u3n s THR 38 Cb -0.09 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.88 1u3n s THR 38 CO 0.02 0.00 -0.13 -1.20 -2.21 0.00 0.00 174.62 171.10 1u3n n SER 39 N 0.40 1.05 -1.85 8.08 7.64 -1.26 -5.13 113.62 122.55 1u3n n SER 39 Ca -0.14 0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1u3n n SER 39 Cb 0.60 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 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 -3.52 -2.14 -0.14 -0.43 0.00 -1.26 -4.77 120.51 108.25 1u3n n ALA 40 Ca -0.05 0.43 -0.08 0.00 0.00 0.00 0.00 53.44 53.73 1u3n n ALA 40 Cb 0.19 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.25 1u3n n ALA 40 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1u3n h PHE 41 N 3.61 -1.09 0.00 0.00 3.57 -1.89 -3.47 116.94 117.67 1u3n h PHE 41 Ca 0.00 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1u3n h PHE 41 Cb 0.00 0.54 0.00 0.00 2.79 0.00 0.00 35.95 39.28 1u3n h PHE 41 CO 0.00 -0.41 0.00 0.41 -2.23 0.00 0.00 178.31 176.08 1u3n n GLY 42 N -1.42 3.06 0.00 2.40 0.00 -1.26 -5.11 105.19 102.86 1u3n n GLY 42 Ca 0.01 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1u3n n GLY 42 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1u3n n HIS 43 N 0.00 -1.54 0.00 1.61 8.25 -1.26 -4.99 115.22 117.28 1u3n n HIS 43 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1u3n n HIS 43 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1u3n n HIS 43 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1u3n n HIS 44 N -2.61 0.00 -2.20 4.41 1.44 -1.26 -4.34 115.22 110.65 1u3n n HIS 44 Ca 0.00 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.28 1u3n n HIS 44 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 1u3n n HIS 44 CO 0.00 0.00 0.00 1.33 -2.81 0.00 0.00 176.34 174.86 1u3n n VAL 45 N -0.43 3.89 -1.69 0.61 0.24 -1.26 -4.84 118.33 114.85 1u3n n VAL 45 Ca 0.00 -3.80 -0.43 0.00 -2.04 0.00 0.00 64.34 58.07 1u3n n VAL 45 Cb 0.00 -2.47 -0.01 0.00 -1.47 0.00 0.00 33.84 29.89 1u3n n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1u3n n GLN 46 N 5.86 2.04 -3.36 7.34 1.13 -1.26 -4.27 117.38 124.87 1u3n n GLN 46 Ca 0.46 0.72 -0.33 0.00 -1.94 0.00 0.00 57.00 55.91 1u3n n GLN 46 Cb 0.40 -2.29 -0.05 0.00 0.11 0.00 0.00 30.24 28.41 1u3n n GLN 46 CO 0.00 0.00 0.00 1.47 -1.44 0.00 0.00 177.06 177.09 1u3n n LEU 47 N 0.76 4.55 -4.70 1.08 -0.00 -1.26 -4.27 117.00 113.17 1u3n n LEU 47 Ca 0.05 -5.33 -0.42 0.00 -0.00 0.00 0.00 56.01 50.31 1u3n n LEU 47 Cb 0.36 -0.90 -0.03 0.00 -0.00 0.00 0.00 43.42 42.85 1u3n n LEU 47 CO 0.62 1.88 0.67 -0.69 -0.00 0.00 0.00 177.39 179.87 1u3n s VAL 48 N -2.39 4.86 0.17 1.47 1.01 -1.26 -1.97 120.40 122.30 1u3n s VAL 48 Ca 0.35 1.91 -0.01 0.00 0.00 0.00 0.00 61.98 64.23 1u3n s VAL 48 Cb 0.08 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1u3n s VAL 48 CO -0.00 0.10 0.36 0.20 0.00 0.00 0.00 175.10 175.76 1u3n s ASN 49 N 1.03 6.40 0.25 3.32 -0.87 -1.25 -4.00 114.94 119.82 1u3n s ASN 49 Ca 0.47 0.41 -0.10 0.00 -1.57 0.00 0.00 52.86 52.07 1u3n s ASN 49 Cb -0.19 -2.01 0.37 0.00 -0.02 0.00 0.00 41.25 39.40 1u3n s ASN 49 CO 0.21 0.00 1.60 0.03 -2.57 0.00 0.00 177.10 176.37 1u3n h ARG 50 N 2.28 0.01 0.00 -0.60 2.47 -1.81 -2.12 114.38 114.62 1u3n h ARG 50 Ca -0.47 -0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.09 1u3n h ARG 50 Cb 1.18 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.48 1u3n h ARG 50 CO 0.70 0.01 -1.33 0.39 0.56 0.00 0.00 179.97 180.30 1u3n n GLU 51 N -5.50 0.28 -0.25 0.04 -0.58 -1.25 -4.62 120.64 108.77 1u3n n GLU 51 Ca 0.12 0.12 0.23 0.00 -0.42 0.00 0.00 57.16 57.21 1u3n n GLU 51 Cb 0.43 -0.98 0.43 0.00 -0.57 0.00 0.00 31.44 30.76 1u3n n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1u3n n GLY 52 N 2.26 -0.62 2.46 0.62 0.00 -1.25 -4.69 105.19 103.97 1u3n n GLY 52 Ca -0.20 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 -4.76 0.00 0.00 1.61 4.81 -0.80 -4.83 118.16 114.20 1u3n n LYS 53 Ca 0.28 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.72 1u3n n LYS 53 Cb 0.95 -0.05 0.00 0.00 0.02 0.00 0.00 35.03 35.94 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 -0.07 0.00 -0.12 3.14 0.00 -1.26 -3.90 120.51 118.30 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 0.12 0.00 0.00 0.00 0.00 19.45 19.57 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 -0.54 0.97 0.00 0.00 0.24 -0.83 -4.73 118.33 113.43 1u3n n VAL 55 Ca 0.00 -0.98 0.00 0.00 -2.04 0.00 0.00 64.34 61.32 1u3n n VAL 55 Cb 0.00 0.52 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 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 0.29 0.65 0.00 7.63 0.00 -1.22 -1.92 105.19 110.63 1u3n n GLY 56 Ca 0.09 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1u3n n GLY 56 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1u3n n PHE 57 N 0.00 0.00 -3.62 1.61 1.16 0.15 -4.64 117.46 112.12 1u3n n PHE 57 Ca 0.00 0.00 -0.39 0.00 -1.87 0.00 0.00 57.45 55.19 1u3n n PHE 57 Cb 0.00 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 37.79 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 4.14 -1.09 1.97 -1.09 -1.26 -3.90 121.20 117.97 1u3n s ILE 58 Ca 0.00 -2.66 -0.08 0.00 -2.23 0.00 0.00 60.65 55.68 1u3n s ILE 58 Cb 0.00 -3.67 0.28 0.00 -1.58 0.00 0.00 42.46 37.48 1u3n s ILE 58 CO 0.00 -0.88 1.11 -0.62 -1.23 0.00 0.00 174.94 173.32 1u3n n GLU 59 N 3.83 3.53 -3.03 2.79 1.02 -1.26 -4.15 120.64 123.37 1u3n n GLU 59 Ca 0.06 -4.47 -0.38 0.00 -0.02 0.00 0.00 57.16 52.35 1u3n n GLU 59 Cb 0.40 -2.53 -0.06 0.00 -0.02 0.00 0.00 31.44 29.23 1u3n n GLU 59 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1u3n s ILE 60 N -1.43 4.45 -0.64 -3.67 -0.00 -1.26 -4.00 121.20 114.65 1u3n s ILE 60 Ca 0.31 1.53 0.04 0.00 -0.00 0.00 0.00 60.65 62.53 1u3n s ILE 60 Cb -0.08 -4.02 0.34 0.00 -0.00 0.00 0.00 42.46 38.70 1u3n s ILE 60 CO -0.07 0.39 1.09 2.29 -0.00 0.00 0.00 174.94 178.64 1u3n n LYS 61 N 1.24 3.57 0.00 0.37 0.00 -1.26 -4.53 118.16 117.55 1u3n n LYS 61 Ca -0.04 -4.82 0.00 0.00 -0.00 0.00 0.00 58.31 53.44 1u3n n LYS 61 Cb 0.50 -2.27 0.00 0.00 -0.00 0.00 0.00 35.03 33.25 1u3n n LYS 61 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1u3n n GLU 62 N -0.23 0.00 -2.10 -1.58 -0.58 -1.26 -4.78 120.64 110.10 1u3n n GLU 62 Ca 0.34 0.00 -0.28 0.00 -0.42 0.00 0.00 57.16 56.80 1u3n n GLU 62 Cb 0.38 0.00 0.14 0.00 -0.57 0.00 0.00 31.44 31.39 1u3n n GLU 62 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1u3n s SER 63 N 0.00 3.77 -0.42 1.62 1.04 -1.26 -5.03 113.70 113.42 1u3n s SER 63 Ca 0.00 0.22 0.06 0.00 0.48 0.00 0.00 55.95 56.71 1u3n s SER 63 Cb 0.00 -0.47 0.21 0.00 0.10 0.00 0.00 66.02 65.85 1u3n s SER 63 CO 0.00 -2.30 0.49 0.47 0.98 0.00 0.00 173.24 172.88 1u3n n ASP 64 N -3.40 -0.74 0.00 7.02 8.00 -1.26 -4.54 116.55 121.62 1u3n n ASP 64 Ca 0.13 -2.61 0.00 0.00 0.71 0.00 0.00 54.79 53.02 1u3n n ASP 64 Cb 0.60 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 1u3n n ASP 64 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1u3n n ASP 65 N 2.24 0.00 -3.58 -2.24 9.92 -1.26 -5.13 116.55 116.50 1u3n n ASP 65 Ca 0.24 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.39 1u3n n ASP 65 Cb 0.52 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.96 1u3n n ASP 65 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1u3n s GLU 66 N 0.00 1.14 0.00 -1.24 2.12 -1.26 -5.06 118.70 114.40 1u3n s GLU 66 Ca 0.00 -0.65 0.00 0.00 0.36 0.00 0.00 54.97 54.68 1u3n s GLU 66 Cb 0.00 0.50 0.00 0.00 0.26 0.00 0.00 34.13 34.89 1u3n s GLU 66 CO 0.00 -0.46 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 1u3n n GLY 67 N -0.27 0.60 3.24 -1.50 0.00 -0.49 -4.40 105.19 102.37 1u3n n GLY 67 Ca -0.16 0.60 -0.09 0.00 0.00 0.00 0.00 46.02 46.37 1u3n n GLY 67 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u3n s LEU 68 N 0.00 1.08 0.00 0.99 1.43 -0.85 -4.35 118.68 116.99 1u3n s LEU 68 Ca 0.00 -0.53 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 1u3n s LEU 68 Cb 0.00 1.30 0.04 0.00 0.03 0.00 0.00 46.19 47.56 1u3n s LEU 68 CO 0.00 -0.76 0.97 -0.67 0.23 0.00 0.00 176.35 176.11 1u3n n ASP 69 N -0.09 -0.68 -4.50 2.29 -0.08 -1.24 -0.32 116.55 111.92 1u3n n ASP 69 Ca -0.16 -1.90 -0.26 0.00 -1.51 0.00 0.00 54.79 50.97 1u3n n ASP 69 Cb 0.63 0.20 0.13 0.00 2.34 0.00 0.00 41.12 44.42 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 0.00 2.09 -0.64 5.18 -5.25 -1.26 -4.72 121.20 116.61 1u3n s ILE 70 Ca 0.03 -0.38 0.06 0.00 -0.99 0.00 0.00 60.65 59.37 1u3n s ILE 70 Cb 0.04 -2.71 0.22 0.00 2.95 0.00 0.00 42.46 42.96 1u3n s ILE 70 CO -0.02 0.00 0.63 1.57 -1.79 0.00 0.00 174.94 175.34 1u3n n HIS 71 N -3.15 3.08 -3.25 1.37 -0.00 -1.26 -4.67 115.22 107.35 1u3n n HIS 71 Ca 0.15 -4.14 -0.42 0.00 0.46 0.00 0.00 57.72 53.77 1u3n n HIS 71 Cb 0.60 -0.54 -0.08 0.00 -0.12 0.00 0.00 29.99 29.86 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 -1.96 5.01 0.21 3.57 -0.00 -1.26 -4.12 121.20 122.63 1u3n s ILE 72 Ca 0.34 0.07 -0.19 0.00 -0.00 0.00 0.00 60.65 60.87 1u3n s ILE 72 Cb 0.08 -4.03 0.03 0.00 -0.00 0.00 0.00 42.46 38.55 1u3n s ILE 72 CO -0.08 -0.35 0.58 -0.94 -0.00 0.00 0.00 174.94 174.15 1u3n s SER 73 N 1.83 -0.32 0.00 4.36 1.04 -1.25 -4.07 113.70 115.29 1u3n s SER 73 Ca 0.17 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.19 1u3n s SER 73 Cb -0.16 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.58 1u3n s SER 73 CO 0.15 -1.10 0.00 0.00 0.98 0.00 0.00 173.24 173.26 1u3n n ALA 74 N -0.38 -2.07 0.00 5.32 0.00 -1.24 -3.71 120.51 118.43 1u3n n ALA 74 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1u3n n ALA 74 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 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 -0.25 2.79 -4.42 0.00 3.02 -0.81 0.31 115.26 115.90 1u3n n ASN 75 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 1u3n n ASN 75 Cb 0.00 0.48 -0.13 0.00 -0.61 0.00 0.00 39.78 39.52 1u3n n ASN 75 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1u3n s SER 76 N -1.38 4.70 0.17 6.41 0.15 -1.06 -4.64 113.70 118.04 1u3n s SER 76 Ca 0.00 -0.25 -0.15 0.00 0.70 0.00 0.00 55.95 56.25 1u3n s SER 76 Cb 0.00 -1.80 0.12 0.00 -1.71 0.00 0.00 66.02 62.63 1u3n s SER 76 CO 0.00 0.05 1.70 -0.07 1.20 0.00 0.00 173.24 176.12 1u3n h LEU 77 N 7.61 -0.15 0.00 3.45 3.38 -1.85 -3.14 115.31 124.62 1u3n h LEU 77 Ca -0.37 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1u3n h LEU 77 Cb 1.18 0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1u3n h LEU 77 CO 0.60 -0.04 0.00 0.54 0.09 0.00 0.00 178.44 179.64 1u3n n ARG 78 N -5.19 0.00 -2.44 1.13 1.74 -1.26 -4.66 116.66 105.98 1u3n n ARG 78 Ca 0.03 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.69 1u3n n ARG 78 Cb 0.22 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.63 1u3n n ARG 78 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1u3n s PRO 79 N 0.00 4.35 -0.25 5.56 0.04 -1.26 -2.03 135.00 141.41 1u3n s PRO 79 Ca 0.00 1.70 -0.04 0.00 0.04 0.00 0.00 61.00 62.70 1u3n s PRO 79 Cb 0.00 -3.56 -0.07 0.00 0.04 0.00 0.00 34.50 30.91 1u3n s PRO 79 CO 0.00 -0.46 0.57 0.41 0.04 0.00 0.00 177.00 177.56 1u3n n GLY 80 N 3.39 -0.12 3.73 0.56 0.00 -1.26 -4.61 105.19 106.88 1u3n n GLY 80 Ca 0.11 0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 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 0.71 3.55 -0.42 4.61 0.00 -1.26 -4.67 121.76 124.27 1u3n s ALA 81 Ca 0.33 -2.08 0.03 0.00 0.00 0.00 0.00 51.96 50.24 1u3n s ALA 81 Cb -0.24 -0.42 0.11 0.00 0.00 0.00 0.00 23.12 22.58 1u3n s ALA 81 CO 0.13 -0.13 0.16 -1.12 0.00 0.00 0.00 175.76 174.80 1u3n s SER 82 N -3.89 4.70 -0.48 0.00 0.01 -1.26 -2.25 113.70 110.53 1u3n s SER 82 Ca 0.40 -2.47 -0.10 0.00 1.31 0.00 0.00 55.95 55.09 1u3n s SER 82 Cb 0.03 -1.67 0.12 0.00 0.21 0.00 0.00 66.02 64.71 1u3n s SER 82 CO 0.22 -0.35 0.36 -0.76 0.41 0.00 0.00 173.24 173.13 1u3n s LEU 83 N 0.47 5.71 0.68 2.44 1.43 0.13 -3.03 118.68 126.51 1u3n s LEU 83 Ca 0.13 -1.84 -0.15 0.00 -1.03 0.00 0.00 54.13 51.24 1u3n s LEU 83 Cb -0.22 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 43.97 1u3n s LEU 83 CO -0.05 -0.70 1.12 -0.83 0.23 0.00 0.00 176.35 176.12 1u3n s GLY 84 N 2.74 2.14 -0.05 -3.19 0.00 -1.25 -4.14 107.32 103.57 1u3n s GLY 84 Ca 0.05 0.57 0.00 0.00 0.00 0.00 0.00 44.72 45.34 1u3n s GLY 84 CO 0.00 0.93 -0.01 -0.11 0.00 0.00 0.00 173.10 173.91 1u3n s PHE 85 N -2.33 0.56 0.00 1.90 -0.71 -1.26 -4.27 117.98 111.87 1u3n s PHE 85 Ca 0.68 -0.11 0.00 0.00 -1.04 0.00 0.00 56.93 56.45 1u3n s PHE 85 Cb -0.21 -0.62 0.00 0.00 -1.21 0.00 0.00 43.02 40.98 1u3n s PHE 85 CO 0.43 -0.21 0.00 0.72 -1.34 0.00 0.00 175.22 174.82 1u3n n HIS 86 N 4.43 0.00 -1.09 3.49 8.25 -1.26 -4.91 115.22 124.12 1u3n n HIS 86 Ca -0.20 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 56.90 1u3n n HIS 86 Cb 0.50 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.64 1u3n n HIS 86 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1u3n n ILE 87 N -0.71 0.00 -2.17 1.59 2.08 -1.26 -4.15 119.36 114.74 1u3n n ILE 87 Ca 0.00 -0.49 -0.26 0.00 0.56 0.00 0.00 62.75 62.56 1u3n n ILE 87 Cb 0.00 0.00 0.09 0.00 -0.75 0.00 0.00 39.64 38.98 1u3n n ILE 87 CO 0.00 0.00 0.00 -0.72 0.56 0.00 0.00 176.55 176.39 1u3n s TYR 88 N -1.95 2.66 -0.04 1.39 1.13 -1.24 -4.89 117.35 114.41 1u3n s TYR 88 Ca 0.47 0.40 -0.07 0.00 -1.41 0.00 0.00 57.07 56.47 1u3n s TYR 88 Cb -0.32 -3.32 -0.02 0.00 -1.10 0.00 0.00 41.96 37.19 1u3n s TYR 88 CO 0.73 -1.62 -0.13 -1.91 -2.51 0.00 0.00 175.55 170.11 1u3n n GLU 89 N -3.06 0.19 -4.03 -3.49 2.13 -1.26 -5.07 120.64 106.05 1u3n n GLU 89 Ca 0.09 0.08 -0.12 0.00 0.66 0.00 0.00 57.16 57.87 1u3n n GLU 89 Cb 0.60 -0.76 -0.12 0.00 0.27 0.00 0.00 31.44 31.43 1u3n n GLU 89 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1u3n s LYS 90 N -1.97 0.39 0.36 5.31 2.47 -1.26 -5.05 119.74 119.99 1u3n s LYS 90 Ca -0.11 -0.55 0.00 0.00 -1.56 0.00 0.00 55.97 53.76 1u3n s LYS 90 Cb 0.01 -0.16 0.00 0.00 -1.46 0.00 0.00 37.83 36.22 1u3n s LYS 90 CO 0.16 0.03 0.00 0.41 0.16 0.00 0.00 175.35 176.10 1u3n n GLY 91 N 1.90 -5.19 2.65 5.54 0.00 -1.26 -4.30 105.19 104.52 1u3n n GLY 91 Ca -0.20 -0.37 -0.37 0.00 0.00 0.00 0.00 46.02 45.08 1u3n n GLY 91 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1u3n n SER 92 N 0.85 7.29 -2.76 1.61 7.64 -1.26 -4.82 113.62 122.16 1u3n n SER 92 Ca 0.00 -3.81 -0.08 0.00 1.01 0.00 0.00 58.87 55.99 1u3n n SER 92 Cb 0.00 -0.96 0.04 0.00 -1.01 0.00 0.00 64.21 62.27 1u3n n SER 92 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u3n s VAL 94 N -3.20 1.21 -0.20 0.00 1.01 -1.26 -4.93 120.40 113.03 1u3n s VAL 94 Ca 0.23 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.71 1u3n s VAL 94 Cb -0.03 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.24 1u3n s VAL 94 CO 0.55 0.38 0.01 -1.14 0.00 0.00 0.00 175.10 174.90 1u3n n ARG 95 N 3.95 -2.32 -2.33 2.72 3.00 -1.26 -4.88 116.66 115.55 1u3n n ARG 95 Ca -0.21 2.02 -0.42 0.00 -0.00 0.00 0.00 57.85 59.24 1u3n n ARG 95 Cb 0.52 -3.91 -0.03 0.00 0.00 0.00 0.00 32.46 29.04 1u3n n ARG 95 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1u3n s PRO 96 N -1.09 3.27 0.19 -0.14 0.04 -1.26 -4.57 135.00 131.44 1u3n s PRO 96 Ca 0.00 0.58 0.00 0.00 0.04 0.00 0.00 61.00 61.62 1u3n s PRO 96 Cb -0.00 -4.14 0.00 0.00 0.04 0.00 0.00 34.50 30.40 1u3n s PRO 96 CO 0.52 -1.97 0.00 -3.47 0.04 0.00 0.00 177.00 172.12 1u3n n ASP 97 N 9.84 -0.71 -2.75 6.66 2.03 -1.26 -5.06 116.55 125.31 1u3n n ASP 97 Ca 0.14 0.33 -0.06 0.00 0.52 0.00 0.00 54.79 55.72 1u3n n ASP 97 Cb 0.49 0.81 0.04 0.00 -0.72 0.00 0.00 41.12 41.74 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 -3.03 -3.29 -1.93 -0.67 -0.00 -1.26 -5.06 117.46 102.22 1u3n n PHE 98 Ca 0.00 -1.53 -0.41 0.00 -0.00 0.00 0.00 57.45 55.52 1u3n n PHE 98 Cb 0.00 1.50 -0.02 0.00 -0.00 0.00 0.00 39.48 40.96 1u3n n PHE 98 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 1u3n n GLU 99 N 2.11 2.56 -3.22 -4.13 1.02 -1.26 -4.82 120.64 112.90 1u3n n GLU 99 Ca 0.12 -2.66 -0.44 0.00 -0.02 0.00 0.00 57.16 54.16 1u3n n GLU 99 Cb 0.61 -3.34 0.00 0.00 -0.02 0.00 0.00 31.44 28.69 1u3n n GLU 99 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1u3n n SER 100 N 8.12 5.83 0.03 1.62 2.88 -1.26 -4.47 113.62 126.37 1u3n n SER 100 Ca 0.50 -3.19 0.00 0.00 -1.33 0.00 0.00 58.87 54.85 1u3n n SER 100 Cb 0.42 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 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 2.14 0.00 -1.51 -1.46 0.00 -1.26 -5.07 120.51 113.35 1u3n n ALA 101 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.37 1u3n n ALA 101 Cb 0.37 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.67 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 -1.47 -0.34 0.00 0.00 0.00 -1.26 -4.67 105.19 97.45 1u3n n GLY 102 Ca 0.00 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.68 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 6.17 1.52 0.00 -0.02 0.00 -1.26 -4.97 105.19 106.64 1u3n n GLY 103 Ca 0.60 0.46 0.00 0.00 0.00 0.00 0.00 46.02 47.08 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 0.00 -0.02 1.61 -0.04 -1.26 -4.89 135.00 130.40 1u3n n PRO 104 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1u3n n PRO 104 Cb 0.00 -0.20 0.00 0.00 -0.04 0.00 0.00 33.50 33.26 1u3n n PRO 104 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1u3n n PHE 105 N -0.07 0.00 0.00 0.54 -0.00 -1.26 -4.83 117.46 111.84 1u3n n PHE 105 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1u3n n PHE 105 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 39.48 39.46 1u3n n PHE 105 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 1u3n n ASN 106 N 0.00 0.00 0.00 -2.13 3.02 -1.26 -4.66 115.26 110.23 1u3n n ASN 106 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1u3n n ASN 106 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 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 -1.22 0.00 0.00 3.52 -0.04 -1.26 -4.57 135.00 131.43 1u3n n PRO 107 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1u3n n PRO 107 Cb 0.00 -0.30 0.00 0.00 -0.04 0.00 0.00 33.50 33.16 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 -0.17 0.00 0.00 1.53 4.32 -1.26 -4.87 117.00 116.55 1u3n n LEU 108 Ca 0.00 0.94 0.00 0.00 -0.02 0.00 0.00 56.01 56.93 1u3n n LEU 108 Cb 0.00 -0.44 0.00 0.00 -1.62 0.00 0.00 43.42 41.36 1u3n n LEU 108 CO 0.00 -0.44 0.00 -3.20 -1.22 0.00 0.00 177.39 172.53 1u3n n ASN 109 N -2.59 0.00 0.00 -1.43 2.85 -1.26 -5.16 115.26 107.66 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 0.36 0.00 0.00 1.24 0.00 0.00 39.78 41.38 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 -2.38 0.00 -0.10 1.20 2.85 -1.26 -4.55 118.16 113.92 1u3n n LYS 110 Ca 0.00 0.00 0.01 0.00 -1.05 0.00 0.00 58.31 57.27 1u3n n LYS 110 Cb 0.00 0.00 -0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1u3n n LYS 110 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1u3n n GLU 111 N 0.00 -0.21 -2.48 -1.58 -0.58 -1.26 -4.78 120.64 109.75 1u3n n GLU 111 Ca 0.00 0.14 -0.24 0.00 -0.42 0.00 0.00 57.16 56.64 1u3n n GLU 111 Cb 0.00 -0.25 0.05 0.00 -0.57 0.00 0.00 31.44 30.66 1u3n n GLU 111 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1u3n s HIS 112 N -0.31 2.95 0.00 -0.32 5.65 -1.26 -4.13 115.29 117.87 1u3n s HIS 112 Ca 0.00 0.24 0.00 0.00 0.25 0.00 0.00 55.06 55.55 1u3n s HIS 112 Cb 0.00 -2.87 0.00 0.00 -1.18 0.00 0.00 32.58 28.53 1u3n s HIS 112 CO 0.00 -1.02 0.72 0.41 -0.65 0.00 0.00 174.74 174.20 1u3n n GLY 113 N -2.56 -2.45 0.09 1.59 0.00 -1.26 -2.96 105.19 97.64 1u3n n GLY 113 Ca 0.07 0.47 -0.03 0.00 0.00 0.00 0.00 46.02 46.53 1u3n n GLY 113 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1u3n h PHE 114 N 0.00 -0.20 0.00 1.61 3.57 -1.97 -3.48 116.94 116.47 1u3n h PHE 114 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1u3n h PHE 114 Cb 0.00 0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.81 1u3n h PHE 114 CO -0.63 -0.13 0.00 0.09 -2.23 0.00 0.00 178.31 175.41 1u3n n ASN 115 N -2.85 0.00 -3.72 0.41 4.13 -1.15 -5.14 115.26 106.94 1u3n n ASN 115 Ca -0.03 0.00 -0.30 0.00 1.68 0.00 0.00 54.58 55.93 1u3n n ASN 115 Cb 0.09 0.00 0.28 0.00 -1.54 0.00 0.00 39.78 38.61 1u3n n ASN 115 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1u3n s ASN 116 N 0.00 -0.70 0.64 6.41 -0.87 -1.26 -4.87 114.94 114.29 1u3n s ASN 116 Ca 0.00 1.06 -0.13 0.00 -1.57 0.00 0.00 52.86 52.22 1u3n s ASN 116 Cb 0.00 -1.56 -0.02 0.00 -0.02 0.00 0.00 41.25 39.65 1u3n s ASN 116 CO 0.00 -5.17 1.05 -2.16 -2.57 0.00 0.00 177.10 168.25 1u3n s PRO 117 N -4.86 3.15 -0.42 -0.60 0.04 -1.26 -3.48 135.00 127.58 1u3n s PRO 117 Ca 0.68 1.05 -0.05 0.00 0.04 0.00 0.00 61.00 62.72 1u3n s PRO 117 Cb -0.17 -2.02 0.05 0.00 0.04 0.00 0.00 34.50 32.41 1u3n s PRO 117 CO 0.60 -0.93 0.13 -1.33 0.04 0.00 0.00 177.00 175.51 1u3n n MET 118 N -2.60 -2.09 -1.01 4.56 2.81 -1.26 -4.37 117.12 113.16 1u3n n MET 118 Ca 0.08 0.03 0.12 0.00 -1.81 0.00 0.00 57.70 56.12 1u3n n MET 118 Cb 0.53 -3.66 -0.04 0.00 -0.71 0.00 0.00 33.22 29.35 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 -0.55 -1.40 0.00 3.03 0.00 -1.23 -4.74 105.19 100.30 1u3n n GLY 119 Ca 0.03 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1u3n n GLY 119 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1u3n n HIS 120 N -3.14 0.00 0.01 1.61 -0.00 -1.26 -4.70 115.22 107.74 1u3n n HIS 120 Ca -0.01 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.17 1u3n n HIS 120 Cb 0.61 -0.35 0.00 0.00 -0.12 0.00 0.00 29.99 30.14 1u3n n HIS 120 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1u3n n HIS 121 N -1.54 -1.47 0.00 1.57 -0.00 -1.26 -5.01 115.22 107.52 1u3n n HIS 121 Ca 0.00 0.07 0.00 0.00 0.46 0.00 0.00 57.72 58.25 1u3n n HIS 121 Cb 0.00 0.44 0.00 0.00 -0.12 0.00 0.00 29.99 30.31 1u3n n HIS 121 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1u3n n ALA 122 N -2.55 0.00 -2.20 1.57 0.00 -1.26 -5.00 120.51 111.07 1u3n n ALA 122 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1u3n n ALA 122 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.74 0.11 0.00 0.00 -1.26 -4.65 105.19 100.13 1u3n n GLY 123 Ca 0.00 -0.34 0.01 0.00 0.00 0.00 0.00 46.02 45.69 1u3n n GLY 123 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1u3n n ASP 124 N 0.20 -0.67 -4.45 1.61 4.64 -1.26 -4.76 116.55 111.86 1u3n n ASP 124 Ca 0.01 0.06 -0.43 0.00 -1.38 0.00 0.00 54.79 53.04 1u3n n ASP 124 Cb 0.87 -0.35 -0.09 0.00 -1.04 0.00 0.00 41.12 40.51 1u3n n ASP 124 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 1u3n s LEU 125 N -3.68 5.14 0.97 -2.67 1.43 -1.26 -5.07 118.68 113.54 1u3n s LEU 125 Ca 0.00 -0.93 -0.14 0.00 -1.03 0.00 0.00 54.13 52.03 1u3n s LEU 125 Cb 0.00 -2.26 0.17 0.00 0.03 0.00 0.00 46.19 44.14 1u3n s LEU 125 CO 0.00 -0.57 1.17 -2.16 0.23 0.00 0.00 176.35 175.02 1u3n s PRO 126 N 1.89 0.64 0.71 1.29 0.04 -1.26 -5.06 135.00 133.24 1u3n s PRO 126 Ca 0.08 0.10 -0.07 0.00 0.04 0.00 0.00 61.00 61.14 1u3n s PRO 126 Cb -0.20 -1.80 0.06 0.00 0.04 0.00 0.00 34.50 32.61 1u3n s PRO 126 CO 0.11 -2.50 1.02 -0.80 0.04 0.00 0.00 177.00 174.87 1u3n s ASN 127 N -4.17 4.81 -0.53 6.66 0.01 -1.26 -4.59 114.94 115.86 1u3n s ASN 127 Ca 0.67 0.48 -0.02 0.00 -0.71 0.00 0.00 52.86 53.27 1u3n s ASN 127 Cb -0.12 -1.12 -0.03 0.00 0.41 0.00 0.00 41.25 40.39 1u3n s ASN 127 CO 0.54 -1.61 0.48 0.18 -1.51 0.00 0.00 177.10 175.18 1u3n n LEU 128 N -2.94 -4.27 -2.93 0.60 4.77 -1.26 -4.35 117.00 106.61 1u3n n LEU 128 Ca 0.08 -0.28 -0.13 0.00 -0.03 0.00 0.00 56.01 55.65 1u3n n LEU 128 Cb 0.60 -2.12 0.03 0.00 -2.33 0.00 0.00 43.42 39.60 1u3n n LEU 128 CO 0.52 -0.17 0.04 -1.84 -1.33 0.00 0.00 177.39 174.62 1u3n n GLU 129 N -2.13 1.02 -3.61 3.23 0.28 -1.25 0.18 120.64 118.37 1u3n n GLU 129 Ca -0.03 -2.72 -0.00 0.00 -0.16 0.00 0.00 57.16 54.25 1u3n n GLU 129 Cb 0.55 -1.29 -0.01 0.00 1.43 0.00 0.00 31.44 32.11 1u3n n GLU 129 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1u3n s VAL 130 N -1.32 0.00 0.00 3.84 0.11 -0.96 -4.21 120.40 117.87 1u3n s VAL 130 Ca 0.31 -0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.27 1u3n s VAL 130 Cb 0.34 -1.55 0.00 0.00 -1.53 0.00 0.00 36.38 33.64 1u3n s VAL 130 CO -0.06 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.32 1u3n n GLY 131 N -0.30 -2.64 1.99 6.54 0.00 -0.86 -4.40 105.19 105.52 1u3n n GLY 131 Ca -0.04 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.18 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 -3.00 0.00 -2.53 4.61 0.00 -1.26 -3.68 120.51 114.65 1u3n n ALA 132 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 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 -3.47 0.00 0.00 0.00 177.50 174.03 1u3n n ASP 133 N 0.00 -2.39 -1.07 0.00 4.64 -1.25 -4.65 116.55 111.83 1u3n n ASP 133 Ca 0.00 -0.06 0.00 0.00 -1.38 0.00 0.00 54.79 53.35 1u3n n ASP 133 Cb 0.00 -1.08 0.00 0.00 -1.04 0.00 0.00 41.12 39.00 1u3n n ASP 133 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1u3n n GLY 134 N -0.76 -2.06 2.34 0.27 0.00 -1.18 -3.72 105.19 100.08 1u3n n GLY 134 Ca -0.01 -0.43 -0.38 0.00 0.00 0.00 0.00 46.02 45.20 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 3.83 -4.44 1.61 2.85 -1.26 -4.26 118.16 116.59 1u3n n LYS 135 Ca 0.00 -2.45 -0.24 0.00 -1.05 0.00 0.00 58.31 54.57 1u3n n LYS 135 Cb 0.00 -2.72 -0.10 0.00 -0.65 0.00 0.00 35.03 31.57 1u3n n LYS 135 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1u3n s VAL 136 N 1.27 2.61 0.00 0.58 0.11 -1.26 -4.84 120.40 118.88 1u3n s VAL 136 Ca 0.66 -2.31 0.00 0.00 -2.93 0.00 0.00 61.98 57.40 1u3n s VAL 136 Cb 0.19 -2.36 0.00 0.00 -1.53 0.00 0.00 36.38 32.67 1u3n s VAL 136 CO -0.07 -0.37 0.00 -0.67 -3.33 0.00 0.00 175.10 170.66 1u3n n ASP 137 N -0.59 0.00 -3.72 3.54 2.03 -1.26 -4.79 116.55 111.77 1u3n n ASP 137 Ca -0.06 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 55.00 1u3n n ASP 137 Cb 0.60 0.00 -0.17 0.00 -0.72 0.00 0.00 41.12 40.83 1u3n n ASP 137 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1u3n s VAL 138 N 0.00 0.33 0.00 5.18 -7.23 -1.26 -5.08 120.40 112.34 1u3n s VAL 138 Ca 0.00 -0.24 0.00 0.00 -1.81 0.00 0.00 61.98 59.93 1u3n s VAL 138 Cb 0.00 -0.76 0.00 0.00 0.56 0.00 0.00 36.38 36.18 1u3n s VAL 138 CO 0.00 -0.08 0.00 -0.38 -0.31 0.00 0.00 175.10 174.33 1u3n n ILE 139 N 5.13 0.00 -0.13 -0.62 2.08 -1.26 -4.37 119.36 120.20 1u3n n ILE 139 Ca -0.08 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.23 1u3n n ILE 139 Cb 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.37 1u3n n ILE 139 CO 0.00 0.00 0.00 1.15 0.56 0.00 0.00 176.55 178.26 1u3n n MET 140 N 0.00 3.18 -2.21 0.38 0.00 0.56 -2.00 117.12 117.03 1u3n n MET 140 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 57.70 57.56 1u3n n MET 140 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 33.22 33.21 1u3n n MET 140 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 1u3n n ASN 141 N 0.00 -4.41 -4.04 3.17 4.05 -1.26 -4.62 115.26 108.15 1u3n n ASN 141 Ca 0.00 0.01 -0.20 0.00 0.45 0.00 0.00 54.58 54.84 1u3n n ASN 141 Cb 0.00 -3.54 -0.15 0.00 1.23 0.00 0.00 39.78 37.32 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 -2.70 0.87 0.05 5.20 0.00 -1.26 -5.03 121.76 118.88 1u3n s ALA 142 Ca 0.00 -0.43 -0.16 0.00 0.00 0.00 0.00 51.96 51.36 1u3n s ALA 142 Cb 0.00 -0.24 -0.21 0.00 0.00 0.00 0.00 23.12 22.67 1u3n s ALA 142 CO 0.00 0.20 1.19 -1.00 0.00 0.00 0.00 175.76 176.15 1u3n h PRO 143 N 5.96 0.59 0.00 0.00 0.13 -1.94 -1.29 132.00 135.45 1u3n h PRO 143 Ca -0.32 -0.58 0.00 0.00 -0.87 0.00 0.00 66.00 64.23 1u3n h PRO 143 Cb 1.17 0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1u3n h PRO 143 CO 0.49 1.19 0.00 -3.47 -0.23 0.00 0.00 178.00 175.99 1u3n n ASP 144 N -4.06 0.00 -2.95 1.44 -0.08 -1.26 -4.33 116.55 105.31 1u3n n ASP 144 Ca -0.10 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.87 1u3n n ASP 144 Cb 0.74 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 44.19 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 0.00 3.58 -2.60 5.18 -2.24 -1.26 -4.68 114.28 112.26 1u3n n THR 145 Ca 0.00 -5.30 0.00 0.00 -2.27 0.00 0.00 64.05 56.48 1u3n n THR 145 Cb 0.00 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 66.86 1u3n n THR 145 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1u3n n SER 146 N -0.32 0.00 -3.37 3.42 3.41 -1.26 -4.92 113.62 110.58 1u3n n SER 146 Ca 0.40 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.91 1u3n n SER 146 Cb 0.41 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.35 1u3n n SER 146 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1u3n n LEU 147 N 0.00 -0.14 0.00 1.04 4.77 -1.26 -4.51 117.00 116.89 1u3n n LEU 147 Ca 0.00 -0.34 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 1u3n n LEU 147 Cb 0.00 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 1u3n n LEU 147 CO 0.00 0.17 0.00 1.17 -1.33 0.00 0.00 177.39 177.40 1u3n n LYS 148 N -1.97 2.30 0.00 3.23 3.00 -1.26 -4.34 118.16 119.12 1u3n n LYS 148 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.25 1u3n n LYS 148 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.20 1u3n n LYS 148 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1u3n n LYS 149 N 0.00 0.00 0.00 1.64 2.85 -1.26 -4.74 118.16 116.65 1u3n n LYS 149 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1u3n n LYS 149 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 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 -0.42 -1.25 0.28 2.58 0.00 -1.26 -3.40 105.19 101.73 1u3n n GLY 150 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1u3n n GLY 150 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1u3n h SER 151 N 0.00 0.09 -4.50 1.61 0.87 -2.00 -3.47 113.55 106.14 1u3n h SER 151 Ca 0.00 0.15 0.01 0.00 -1.23 0.00 0.00 61.79 60.71 1u3n h SER 151 Cb 0.00 0.18 -0.09 0.00 -0.44 0.00 0.00 62.40 62.05 1u3n h SER 151 CO 0.00 -0.02 -1.13 1.17 -0.53 0.00 0.00 176.83 176.31 1u3n n LYS 152 N -5.13 -3.33 -1.41 2.24 4.81 -1.22 -4.40 118.16 109.72 1u3n n LYS 152 Ca 0.16 2.65 -0.06 0.00 -0.87 0.00 0.00 58.31 60.18 1u3n n LYS 152 Cb 0.49 -4.10 0.01 0.00 0.02 0.00 0.00 35.03 31.45 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 1.15 -0.58 -1.12 3.14 -0.00 -1.26 -4.79 117.00 113.55 1u3n n LEU 153 Ca -0.27 -0.01 0.04 0.00 -0.00 0.00 0.00 56.01 55.77 1u3n n LEU 153 Cb 0.42 -0.33 0.26 0.00 -0.00 0.00 0.00 43.42 43.76 1u3n n LEU 153 CO 0.31 -0.07 0.76 -3.20 -0.00 0.00 0.00 177.39 175.18 1u3n n ASN 154 N 0.93 3.73 -0.04 1.45 2.85 -1.26 -4.36 115.26 118.57 1u3n n ASN 154 Ca -0.01 -3.21 -0.04 0.00 -0.11 0.00 0.00 54.58 51.20 1u3n n ASN 154 Cb 0.14 -0.60 -0.05 0.00 1.24 0.00 0.00 39.78 40.51 1u3n n ASN 154 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1u3n n ILE 155 N -0.59 0.46 -0.60 -1.44 0.00 -1.26 -5.03 119.36 110.89 1u3n n ILE 155 Ca 0.27 -0.25 0.00 0.00 0.00 0.00 0.00 62.75 62.77 1u3n n ILE 155 Cb 1.00 -0.82 0.00 0.00 0.00 0.00 0.00 39.64 39.82 1u3n n ILE 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1u3n n LEU 156 N -2.40 0.00 -4.83 9.51 -0.00 -1.26 -5.05 117.00 112.96 1u3n n LEU 156 Ca -0.12 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.56 1u3n n LEU 156 Cb 0.70 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 44.05 1u3n n LEU 156 CO 0.12 0.00 0.50 -0.62 -0.00 0.00 0.00 177.39 177.39 1u3n s ASP 157 N -1.00 6.88 0.26 1.45 2.15 -1.24 -4.87 116.67 120.30 1u3n s ASP 157 Ca 0.00 1.44 0.17 0.00 0.43 0.00 0.00 52.55 54.59 1u3n s ASP 157 Cb 0.00 -2.44 0.90 0.00 -0.30 0.00 0.00 42.92 41.08 1u3n s ASP 157 CO 0.00 -0.22 0.99 1.21 -0.17 0.00 0.00 175.17 176.98 1u3n n GLU 158 N -0.28 -0.03 -0.09 4.34 4.07 -1.26 0.18 120.64 127.57 1u3n n GLU 158 Ca 0.04 0.83 -0.18 0.00 -0.06 0.00 0.00 57.16 57.79 1u3n n GLU 158 Cb 0.53 -1.56 -0.11 0.00 -0.06 0.00 0.00 31.44 30.24 1u3n n GLU 158 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 1u3n h ASP 159 N 0.00 0.00 0.00 4.31 3.45 -1.95 -3.47 116.42 118.77 1u3n h ASP 159 Ca 0.54 -0.60 0.00 0.00 0.43 0.00 0.00 57.03 57.40 1u3n h ASP 159 Cb 1.60 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.37 1u3n h ASP 159 CO -0.39 1.29 0.00 0.61 -1.57 0.00 0.00 179.24 179.18 1u3n n GLY 160 N 1.50 1.61 0.00 2.75 0.00 0.49 -4.76 105.19 106.78 1u3n n GLY 160 Ca -0.24 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.27 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 -3.30 1.61 3.41 -1.26 -3.63 113.62 110.45 1u3n n SER 161 Ca 0.00 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.42 1u3n n SER 161 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 1u3n n SER 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u3n s ALA 162 N -1.91 1.69 0.71 7.33 0.00 -1.23 -4.63 121.76 123.73 1u3n s ALA 162 Ca 0.00 -1.99 -0.10 0.00 0.00 0.00 0.00 51.96 49.87 1u3n s ALA 162 Cb 0.00 1.42 0.04 0.00 0.00 0.00 0.00 23.12 24.58 1u3n s ALA 162 CO 0.00 -0.69 1.07 -0.59 0.00 0.00 0.00 175.76 175.55 1u3n s PHE 163 N -3.33 3.13 0.06 0.00 -0.12 -1.24 -3.59 117.98 112.89 1u3n s PHE 163 Ca 0.39 0.77 0.09 0.00 -0.05 0.00 0.00 56.93 58.13 1u3n s PHE 163 Cb 0.02 -3.15 -0.03 0.00 -0.63 0.00 0.00 43.02 39.23 1u3n s PHE 163 CO 0.27 -1.32 -0.25 0.96 -0.05 0.00 0.00 175.22 174.84 1u3n s ILE 164 N -3.33 2.00 -0.60 -4.49 -4.36 -1.26 -1.65 121.20 107.51 1u3n s ILE 164 Ca 0.59 -1.40 -0.16 0.00 -0.26 0.00 0.00 60.65 59.41 1u3n s ILE 164 Cb -0.11 -1.73 0.14 0.00 1.25 0.00 0.00 42.46 42.01 1u3n s ILE 164 CO 0.48 0.25 0.60 -0.63 0.24 0.00 0.00 174.94 175.88 1u3n s ILE 165 N -0.87 5.17 0.48 8.37 1.09 0.30 -3.87 121.20 131.88 1u3n s ILE 165 Ca 0.11 -1.52 0.04 0.00 -1.10 0.00 0.00 60.65 58.18 1u3n s ILE 165 Cb -0.10 -4.40 -0.02 0.00 -1.06 0.00 0.00 42.46 36.88 1u3n s ILE 165 CO 0.03 -0.96 0.14 -1.38 -0.10 0.00 0.00 174.94 172.66 1u3n s HIS 166 N 1.67 2.06 -0.38 3.97 -3.43 -1.26 -3.22 115.29 114.71 1u3n s HIS 166 Ca 0.08 -0.81 0.00 0.00 -0.80 0.00 0.00 55.06 53.53 1u3n s HIS 166 Cb -0.25 -1.78 0.00 0.00 -1.43 0.00 0.00 32.58 29.11 1u3n s HIS 166 CO 0.02 0.09 0.00 0.39 -2.00 0.00 0.00 174.74 173.23 1u3n n GLU 167 N -1.33 -2.19 -2.14 -0.38 -0.58 -1.26 -4.39 120.64 108.37 1u3n n GLU 167 Ca -0.09 0.21 -0.27 0.00 -0.42 0.00 0.00 57.16 56.58 1u3n n GLU 167 Cb 0.66 -4.59 0.14 0.00 -0.57 0.00 0.00 31.44 27.08 1u3n n GLU 167 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 1u3n s GLN 168 N -4.11 1.27 0.40 3.49 1.03 -1.17 -4.40 119.66 116.17 1u3n s GLN 168 Ca 0.00 -0.53 0.08 0.00 0.04 0.00 0.00 55.36 54.95 1u3n s GLN 168 Cb 0.00 -2.03 -0.04 0.00 0.03 0.00 0.00 33.01 30.97 1u3n s GLN 168 CO 0.00 -1.91 0.25 0.00 -2.54 0.00 0.00 175.29 171.09 1u3n s ALA 169 N -3.57 3.74 1.00 2.60 0.00 -1.26 -4.61 121.76 119.67 1u3n s ALA 169 Ca 0.69 -1.97 0.00 0.00 0.00 0.00 0.00 51.96 50.68 1u3n s ALA 169 Cb -0.06 -0.69 0.00 0.00 0.00 0.00 0.00 23.12 22.37 1u3n s ALA 169 CO 0.49 -0.15 0.00 -3.47 0.00 0.00 0.00 175.76 172.63 1u3n n ASP 170 N -1.33 0.00 -3.99 0.00 4.64 -1.26 -4.85 116.55 109.76 1u3n n ASP 170 Ca 0.00 0.00 -0.37 0.00 -1.38 0.00 0.00 54.79 53.04 1u3n n ASP 170 Cb 0.63 0.00 -0.04 0.00 -1.04 0.00 0.00 41.12 40.67 1u3n n ASP 170 CO 0.00 0.00 0.00 -0.90 -0.82 0.00 0.00 177.20 175.48 1u3n n ASP 171 N 0.00 4.79 -3.79 1.67 5.68 -1.26 -4.74 116.55 118.90 1u3n n ASP 171 Ca 0.00 -3.25 -0.24 0.00 -0.50 0.00 0.00 54.79 50.80 1u3n n ASP 171 Cb 0.00 -1.07 0.02 0.00 -1.14 0.00 0.00 41.12 38.93 1u3n n ASP 171 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1u3n n TYR 172 N 1.84 -1.97 0.00 2.11 4.19 -1.26 -4.80 117.16 117.27 1u3n n TYR 172 Ca 0.24 0.84 0.00 0.00 3.31 0.00 0.00 57.90 62.30 1u3n n TYR 172 Cb 0.37 -4.19 0.00 0.00 0.49 0.00 0.00 39.34 36.01 1u3n n TYR 172 CO 0.00 0.00 0.00 -0.11 0.91 0.00 0.00 176.86 177.66 1u3n n LEU 173 N -4.39 0.00 -3.02 2.98 7.94 -1.26 -5.12 117.00 114.12 1u3n n LEU 173 Ca -0.21 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 54.68 1u3n n LEU 173 Cb 0.64 0.11 -0.01 0.00 0.53 0.00 0.00 43.42 44.70 1u3n n LEU 173 CO 0.71 -0.28 -0.16 1.07 -1.11 0.00 0.00 177.39 177.62 1u3n n THR 174 N -1.84 -2.93 0.00 1.96 5.66 -1.26 -4.87 114.28 111.00 1u3n n THR 174 Ca 0.00 0.47 0.00 0.00 -3.05 0.00 0.00 64.05 61.47 1u3n n THR 174 Cb 0.00 -3.19 0.00 0.00 -1.55 0.00 0.00 70.33 65.59 1u3n n THR 174 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1u3n n ASN 175 N 2.23 0.00 -2.49 1.09 4.13 -1.26 -4.99 115.26 113.97 1u3n n ASN 175 Ca -0.06 0.00 -0.16 0.00 1.68 0.00 0.00 54.58 56.05 1u3n n ASN 175 Cb 0.15 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.30 1u3n n ASN 175 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1u3n n PRO 176 N 0.00 1.93 -3.11 3.52 -0.04 -1.26 -4.59 135.00 131.45 1u3n n PRO 176 Ca 0.00 -1.09 -0.16 0.00 -0.04 0.00 0.00 63.50 62.21 1u3n n PRO 176 Cb 0.00 -2.11 -0.03 0.00 -0.04 0.00 0.00 33.50 31.32 1u3n n PRO 176 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1u3n n SER 177 N 3.05 -1.22 0.08 3.54 3.41 -1.26 -4.73 113.62 116.50 1u3n n SER 177 Ca 0.41 -0.18 -0.15 0.00 -0.26 0.00 0.00 58.87 58.69 1u3n n SER 177 Cb 0.52 -1.13 -0.07 0.00 -0.26 0.00 0.00 64.21 63.26 1u3n n SER 177 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1u3n h GLY 178 N -0.32 0.47 -5.64 5.00 0.00 -1.96 -3.46 103.07 97.16 1u3n h GLY 178 Ca -0.22 -0.90 0.20 0.00 0.00 0.00 0.00 47.33 46.41 1u3n h GLY 178 CO 0.33 0.79 0.28 -1.31 0.00 0.00 0.00 176.54 176.63 1u3n s ASN 179 N -7.14 -0.46 -0.06 0.19 0.01 -1.26 -3.79 114.94 102.42 1u3n s ASN 179 Ca -0.06 0.60 0.02 0.00 -0.71 0.00 0.00 52.86 52.71 1u3n s ASN 179 Cb 0.08 1.51 0.08 0.00 0.41 0.00 0.00 41.25 43.33 1u3n s ASN 179 CO 0.88 -0.09 0.62 -1.54 -1.51 0.00 0.00 177.10 175.47 1u3n n SER 180 N 4.92 -0.37 -3.38 -1.22 3.41 -1.26 -4.29 113.62 111.43 1u3n n SER 180 Ca -0.08 -1.08 0.02 0.00 -0.26 0.00 0.00 58.87 57.46 1u3n n SER 180 Cb 0.53 0.16 -0.04 0.00 -0.26 0.00 0.00 64.21 64.61 1u3n n SER 180 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1u3n s GLY 181 N -0.31 -0.32 0.78 5.00 0.00 -1.26 -5.10 107.32 106.11 1u3n s GLY 181 Ca 0.02 2.86 -0.16 0.00 0.00 0.00 0.00 44.72 47.43 1u3n s GLY 181 CO -0.02 3.30 -0.53 0.00 0.00 0.00 0.00 173.10 175.84 1u3n n ALA 182 N 5.12 -4.50 -1.28 3.20 0.00 -1.26 -4.24 120.51 117.55 1u3n n ALA 182 Ca -0.09 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1u3n n ALA 182 Cb 0.52 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.80 1u3n n ALA 182 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1u3n n ARG 183 N 2.03 0.00 0.00 0.00 0.00 -1.26 -4.87 116.66 112.55 1u3n n ARG 183 Ca 0.02 0.02 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 1u3n n ARG 183 Cb 0.50 -1.28 0.00 0.00 0.00 0.00 0.00 32.46 31.68 1u3n n ARG 183 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 1u3n n ILE 184 N -1.27 0.00 -3.77 5.15 -0.00 -1.26 -5.05 119.36 113.16 1u3n n ILE 184 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 62.75 62.57 1u3n n ILE 184 Cb 0.43 -0.22 -0.17 0.00 -0.00 0.00 0.00 39.64 39.68 1u3n n ILE 184 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1u3n s VAL 185 N -1.43 0.01 0.01 7.28 0.11 -1.20 -3.97 120.40 121.22 1u3n s VAL 185 Ca 0.00 0.25 -0.12 0.00 -2.93 0.00 0.00 61.98 59.18 1u3n s VAL 185 Cb 0.00 -0.18 0.01 0.00 -1.53 0.00 0.00 36.38 34.68 1u3n s VAL 185 CO 0.00 0.15 0.25 0.00 -3.33 0.00 0.00 175.10 172.16 1u3n s GLY 187 N -1.68 1.05 -0.10 0.00 0.00 -0.66 -4.61 107.32 101.33 1u3n s GLY 187 Ca -0.10 -1.27 -0.32 0.00 0.00 0.00 0.00 44.72 43.03 1u3n s GLY 187 CO 0.00 -1.33 1.40 0.00 0.00 0.00 0.00 173.10 173.18 1u3n s ALA 188 N -2.11 -2.72 -0.32 3.20 0.00 -1.26 -3.50 121.76 115.05 1u3n s ALA 188 Ca 0.08 0.44 -0.11 0.00 0.00 0.00 0.00 51.96 52.37 1u3n s ALA 188 Cb -0.05 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.80 1u3n s ALA 188 CO 0.03 -1.14 0.39 1.28 0.00 0.00 0.00 175.76 176.32 1u3n n LEU 189 N -0.83 -6.63 -3.91 0.00 7.99 -1.26 -4.24 117.00 108.12 1u3n n LEU 189 Ca 0.01 0.52 -0.36 0.00 -0.01 0.00 0.00 56.01 56.18 1u3n n LEU 189 Cb 0.60 -2.86 0.01 0.00 -0.11 0.00 0.00 43.42 41.06 1u3n n LEU 189 CO 0.12 -1.94 -0.71 0.18 -1.51 0.00 0.00 177.39 173.53 1u3n n LEU 190 N -0.21 -3.79 -4.18 2.23 7.99 -1.26 -4.43 117.00 113.35 1u3n n LEU 190 Ca 0.08 0.53 -0.44 0.00 -0.01 0.00 0.00 56.01 56.17 1u3n n LEU 190 Cb 0.30 -0.77 0.00 0.00 -0.11 0.00 0.00 43.42 42.84 1u3n n LEU 190 CO 0.37 -4.66 0.97 0.61 -1.51 0.00 0.00 177.39 173.17 1u3n n GLY 191 N 2.49 4.66 0.00 -0.72 0.00 -1.26 -4.68 105.19 105.67 1u3n n GLY 191 Ca 0.06 -2.61 0.00 0.00 0.00 0.00 0.00 46.02 43.46 1u3n n GLY 191 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1u3n n ASN 192 N 2.10 0.00 -0.40 1.61 2.85 -1.26 -4.28 115.26 115.87 1u3n n ASN 192 Ca 0.25 0.00 0.02 0.00 -0.11 0.00 0.00 54.58 54.74 1u3n n ASN 192 Cb 0.36 0.00 -0.00 0.00 1.24 0.00 0.00 39.78 41.38 1u3n n ASN 192 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1u3n n ASN 193 N 0.00 -2.42 -2.48 1.20 2.85 -1.26 -4.87 115.26 108.28 1u3n n ASN 193 Ca 0.00 0.14 -0.03 0.00 -0.11 0.00 0.00 54.58 54.58 1u3n n ASN 193 Cb 0.00 -0.48 -0.00 0.00 1.24 0.00 0.00 39.78 40.54 1u3n n ASN 193 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 1u3n n GLU 194 N -1.01 0.23 -3.70 1.20 2.13 -1.26 -4.97 120.64 113.26 1u3n n GLU 194 Ca 0.00 -0.65 -0.14 0.00 0.66 0.00 0.00 57.16 57.03 1u3n n GLU 194 Cb 0.06 0.01 -0.08 0.00 0.27 0.00 0.00 31.44 31.70 1u3n n GLU 194 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1u3n s LYS 195 N 0.04 0.75 0.00 5.31 2.36 -1.26 -5.13 119.74 121.81 1u3n s LYS 195 Ca 0.04 -0.06 0.00 0.00 -2.55 0.00 0.00 55.97 53.40 1u3n s LYS 195 Cb 0.08 0.34 0.00 0.00 -1.05 0.00 0.00 37.83 37.20 1u3n s LYS 195 CO -0.02 -0.21 0.18 0.94 1.55 0.00 0.00 175.35 177.78