#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ue1 s GLY 3 N 0.00 1.16 0.99 0.00 0.00 -1.26 -5.15 107.32 103.07 1ue1 s GLY 3 Ca 0.00 -1.30 -0.16 0.00 0.00 0.00 0.00 44.72 43.27 1ue1 s GLY 3 CO 0.00 -1.34 1.23 0.99 0.00 0.00 0.00 173.10 173.99 1ue1 s ASP 4 N -2.30 2.86 -0.18 1.64 1.11 -1.26 -5.03 116.67 113.51 1ue1 s ASP 4 Ca 0.09 0.51 -0.17 0.00 0.18 0.00 0.00 52.55 53.16 1ue1 s ASP 4 Cb -0.07 -0.73 -0.04 0.00 1.07 0.00 0.00 42.92 43.15 1ue1 s ASP 4 CO 0.04 -2.91 0.46 -0.89 1.18 0.00 0.00 175.17 173.05 1ue1 s THR 5 N -3.57 5.16 0.18 -1.27 2.01 -1.26 -5.02 115.64 111.87 1ue1 s THR 5 Ca 0.70 0.84 0.09 0.00 0.31 0.00 0.00 61.69 63.63 1ue1 s THR 5 Cb -0.08 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 1ue1 s THR 5 CO 0.53 0.24 -0.09 0.42 -0.69 0.00 0.00 174.62 175.03 1ue1 s THR 6 N 1.28 3.20 -0.00 -0.82 -4.23 -1.26 -1.20 115.64 112.62 1ue1 s THR 6 Ca 0.22 -1.63 -0.11 0.00 -1.18 0.00 0.00 61.69 58.99 1ue1 s THR 6 Cb -0.15 -2.58 0.01 0.00 1.34 0.00 0.00 72.50 71.12 1ue1 s THR 6 CO 0.09 -0.10 0.23 0.27 -0.54 0.00 0.00 174.62 174.58 1ue1 s ILE 7 N -1.67 0.07 -0.28 2.99 -4.36 -0.40 -4.96 121.20 112.60 1ue1 s ILE 7 Ca 0.25 -0.60 -0.00 0.00 -0.26 0.00 0.00 60.65 60.03 1ue1 s ILE 7 Cb -0.09 -0.58 0.05 0.00 1.25 0.00 0.00 42.46 43.10 1ue1 s ILE 7 CO 0.15 -0.33 -0.04 -0.89 0.24 0.00 0.00 174.94 174.07 1ue1 s THR 8 N -1.49 2.70 -0.10 8.37 2.01 -1.25 -1.14 115.64 124.74 1ue1 s THR 8 Ca -0.13 -1.43 0.04 0.00 0.31 0.00 0.00 61.69 60.48 1ue1 s THR 8 Cb -0.06 -2.54 0.00 0.00 0.01 0.00 0.00 72.50 69.91 1ue1 s THR 8 CO 0.02 -0.05 -0.24 -0.51 -0.69 0.00 0.00 174.62 173.16 1ue1 s ILE 9 N 1.21 2.04 -0.06 1.82 2.07 -0.27 -4.95 121.20 123.06 1ue1 s ILE 9 Ca -0.06 -1.01 -0.01 0.00 -1.41 0.00 0.00 60.65 58.16 1ue1 s ILE 9 Cb -0.19 -1.77 -0.03 0.00 0.13 0.00 0.00 42.46 40.59 1ue1 s ILE 9 CO -0.03 0.56 0.00 -0.69 -1.91 0.00 0.00 174.94 172.87 1ue1 s VAL 10 N 0.35 4.28 -1.06 4.00 1.01 -1.26 -1.70 120.40 126.01 1ue1 s VAL 10 Ca -0.19 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.44 1ue1 s VAL 10 Cb -0.18 -2.83 0.00 0.00 0.00 0.00 0.00 36.38 33.37 1ue1 s VAL 10 CO 0.09 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.33 1ue1 n GLY 11 N 1.89 -1.04 3.55 4.51 0.00 -1.05 -4.30 105.19 108.75 1ue1 n GLY 11 Ca -0.17 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 1ue1 n GLY 11 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ue1 s ASN 12 N -4.00 4.26 -0.19 1.61 -0.87 -0.61 -0.51 114.94 114.63 1ue1 s ASN 12 Ca 0.00 -0.44 -0.29 0.00 -1.57 0.00 0.00 52.86 50.55 1ue1 s ASN 12 Cb 0.00 -0.75 -0.01 0.00 -0.02 0.00 0.00 41.25 40.47 1ue1 s ASN 12 CO 0.00 0.17 1.22 -0.76 -2.57 0.00 0.00 177.10 175.17 1ue1 s LEU 13 N -2.24 4.15 0.46 0.60 1.43 -0.66 0.29 118.68 122.71 1ue1 s LEU 13 Ca 0.21 1.60 0.17 0.00 -1.03 0.00 0.00 54.13 55.08 1ue1 s LEU 13 Cb -0.11 -3.54 1.13 0.00 0.03 0.00 0.00 46.19 43.70 1ue1 s LEU 13 CO 0.13 -0.76 1.98 0.71 0.23 0.00 0.00 176.35 178.63 1ue1 h THR 14 N 5.52 0.85 -2.80 5.49 1.35 -1.73 0.12 112.91 121.69 1ue1 h THR 14 Ca -0.25 -0.10 0.09 0.00 -0.55 0.00 0.00 66.41 65.60 1ue1 h THR 14 Cb 1.09 0.52 -0.07 0.00 -1.73 0.00 0.00 68.15 67.97 1ue1 h THR 14 CO 0.98 0.05 0.30 0.00 -0.25 0.00 0.00 175.52 176.60 1ue1 s ALA 15 N -5.29 -1.39 0.72 6.62 0.00 -1.26 -4.66 121.76 116.49 1ue1 s ALA 15 Ca -0.07 -0.07 -0.16 0.00 0.00 0.00 0.00 51.96 51.66 1ue1 s ALA 15 Cb 0.20 0.78 -0.00 0.00 0.00 0.00 0.00 23.12 24.10 1ue1 s ALA 15 CO 0.74 -1.00 0.89 -0.25 0.00 0.00 0.00 175.76 176.14 1ue1 n ASP 16 N -0.45 0.17 -4.70 0.00 8.00 -1.26 -4.56 116.55 113.75 1ue1 n ASP 16 Ca -0.06 0.65 -0.42 0.00 0.71 0.00 0.00 54.79 55.67 1ue1 n ASP 16 Cb 0.60 -1.37 -0.03 0.00 -0.02 0.00 0.00 41.12 40.30 1ue1 n ASP 16 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 1ue1 s PRO 17 N -3.23 4.26 -0.64 -0.24 0.02 -1.26 -4.90 135.00 129.01 1ue1 s PRO 17 Ca 0.72 2.19 -0.23 0.00 0.02 0.00 0.00 61.00 63.70 1ue1 s PRO 17 Cb -0.35 -3.39 0.06 0.00 0.02 0.00 0.00 34.50 30.85 1ue1 s PRO 17 CO 0.52 -0.58 0.97 -2.00 -0.33 0.00 0.00 177.00 175.58 1ue1 s GLU 18 N 1.78 3.16 -0.26 5.54 2.12 -0.28 -4.86 118.70 125.90 1ue1 s GLU 18 Ca 0.68 -0.68 -0.18 0.00 0.36 0.00 0.00 54.97 55.15 1ue1 s GLU 18 Cb -0.38 -4.19 -0.03 0.00 0.26 0.00 0.00 34.13 29.80 1ue1 s GLU 18 CO 0.30 -1.76 0.52 -1.17 -0.54 0.00 0.00 175.26 172.61 1ue1 s LEU 19 N 4.12 4.06 0.41 2.70 2.96 -1.26 -1.89 118.68 129.78 1ue1 s LEU 19 Ca 0.24 0.51 0.04 0.00 -0.22 0.00 0.00 54.13 54.70 1ue1 s LEU 19 Cb -0.15 -2.67 -0.02 0.00 0.50 0.00 0.00 46.19 43.85 1ue1 s LEU 19 CO 0.12 -0.29 0.13 -0.13 -1.32 0.00 0.00 176.35 174.85 1ue1 s ARG 20 N 2.32 1.94 -0.02 1.98 3.00 -0.13 -4.99 118.95 123.06 1ue1 s ARG 20 Ca 0.21 -2.19 0.02 0.00 0.00 0.00 0.00 55.73 53.77 1ue1 s ARG 20 Cb -0.16 -0.64 0.00 0.00 0.00 0.00 0.00 34.95 34.16 1ue1 s ARG 20 CO 0.09 -0.48 -0.05 -0.06 0.00 0.00 0.00 175.30 174.81 1ue1 s PHE 21 N -3.19 0.56 1.22 -0.53 0.40 -1.26 -0.90 117.98 114.27 1ue1 s PHE 21 Ca 0.23 -0.11 -0.17 0.00 -0.60 0.00 0.00 56.93 56.27 1ue1 s PHE 21 Cb 0.02 -0.42 0.29 0.00 0.51 0.00 0.00 43.02 43.42 1ue1 s PHE 21 CO 0.14 -0.06 1.04 0.95 0.70 0.00 0.00 175.22 177.99 1ue1 s THR 22 N 0.22 1.66 0.20 0.64 -4.23 -0.07 -4.86 115.64 109.20 1ue1 s THR 22 Ca -0.02 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.39 1ue1 s THR 22 Cb -0.06 -2.29 0.14 0.00 1.34 0.00 0.00 72.50 71.63 1ue1 s THR 22 CO -0.00 0.00 1.81 1.55 -0.54 0.00 0.00 174.62 177.44 1ue1 h PRO 23 N -2.69 1.06 0.00 3.99 0.13 -2.01 -2.57 132.00 129.90 1ue1 h PRO 23 Ca -0.50 -0.13 -0.00 0.00 -0.87 0.00 0.00 66.00 64.49 1ue1 h PRO 23 Cb 1.32 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 1ue1 h PRO 23 CO 0.41 0.80 -0.01 0.66 -0.23 0.00 0.00 178.00 179.63 1ue1 h SER 24 N 1.04 0.00 0.00 1.44 4.64 -2.06 -3.46 113.55 115.15 1ue1 h SER 24 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1ue1 h SER 24 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1ue1 h SER 24 CO -0.04 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.54 1ue1 n GLY 25 N -0.43 2.10 3.70 -0.77 0.00 -0.97 -5.09 105.19 103.73 1ue1 n GLY 25 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1ue1 n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ue1 s ALA 26 N -1.97 3.80 0.67 4.61 0.00 -1.26 -4.61 121.76 123.00 1ue1 s ALA 26 Ca 0.00 1.48 -0.15 0.00 0.00 0.00 0.00 51.96 53.29 1ue1 s ALA 26 Cb 0.00 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1ue1 s ALA 26 CO 0.00 -1.17 1.11 0.00 0.00 0.00 0.00 175.76 175.70 1ue1 s ALA 27 N 2.43 2.46 -0.22 0.00 0.00 -1.26 -0.89 121.76 124.28 1ue1 s ALA 27 Ca 0.80 0.52 -0.09 0.00 0.00 0.00 0.00 51.96 53.18 1ue1 s ALA 27 Cb -0.47 -3.31 0.09 0.00 0.00 0.00 0.00 23.12 19.43 1ue1 s ALA 27 CO 0.36 -1.31 0.49 0.08 0.00 0.00 0.00 175.76 175.37 1ue1 s VAL 28 N -2.39 -0.49 -0.08 0.00 1.01 -0.08 -2.51 120.40 115.86 1ue1 s VAL 28 Ca 0.66 0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.77 1ue1 s VAL 28 Cb -0.20 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 1ue1 s VAL 28 CO 0.43 0.04 -0.14 0.00 0.00 0.00 0.00 175.10 175.43 1ue1 s ALA 29 N 2.27 2.66 0.17 5.51 0.00 -0.72 -0.95 121.76 130.70 1ue1 s ALA 29 Ca -0.05 -0.95 0.11 0.00 0.00 0.00 0.00 51.96 51.07 1ue1 s ALA 29 Cb -0.10 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 21.92 1ue1 s ALA 29 CO -0.15 0.46 -0.24 -0.80 0.00 0.00 0.00 175.76 175.03 1ue1 s ASN 30 N -0.38 3.45 -0.13 0.00 -0.87 -0.79 -1.45 114.94 114.76 1ue1 s ASN 30 Ca 0.04 -0.81 -0.34 0.00 -1.57 0.00 0.00 52.86 50.19 1ue1 s ASN 30 Cb -0.12 -0.27 0.15 0.00 -0.02 0.00 0.00 41.25 40.98 1ue1 s ASN 30 CO 0.02 0.14 1.43 0.72 -2.57 0.00 0.00 177.10 176.84 1ue1 s PHE 31 N -1.45 -0.00 -0.03 2.20 -0.71 -0.76 -1.12 117.98 116.11 1ue1 s PHE 31 Ca 0.19 -0.00 0.02 0.00 -1.04 0.00 0.00 56.93 56.09 1ue1 s PHE 31 Cb -0.09 0.50 0.01 0.00 -1.21 0.00 0.00 43.02 42.23 1ue1 s PHE 31 CO 0.09 -0.02 -0.07 0.95 -1.34 0.00 0.00 175.22 174.83 1ue1 s THR 32 N -2.03 0.64 -0.06 -4.49 -4.23 -1.26 0.15 115.64 104.36 1ue1 s THR 32 Ca 0.14 -0.26 -0.20 0.00 -1.18 0.00 0.00 61.69 60.19 1ue1 s THR 32 Cb 0.06 -0.59 -0.05 0.00 1.34 0.00 0.00 72.50 73.26 1ue1 s THR 32 CO -0.06 0.21 0.57 -0.69 -0.54 0.00 0.00 174.62 174.12 1ue1 s VAL 33 N 0.35 5.04 -0.58 2.29 1.01 0.95 -1.84 120.40 127.62 1ue1 s VAL 33 Ca -0.05 1.18 -0.11 0.00 0.00 0.00 0.00 61.98 63.00 1ue1 s VAL 33 Cb -0.09 -3.91 0.15 0.00 0.00 0.00 0.00 36.38 32.53 1ue1 s VAL 33 CO 0.00 0.36 0.49 0.00 0.00 0.00 0.00 175.10 175.95 1ue1 s ALA 34 N 0.27 3.63 -0.39 5.51 0.00 0.15 -1.84 121.76 129.09 1ue1 s ALA 34 Ca 0.30 -2.79 -0.19 0.00 0.00 0.00 0.00 51.96 49.29 1ue1 s ALA 34 Cb -0.17 -3.07 0.01 0.00 0.00 0.00 0.00 23.12 19.89 1ue1 s ALA 34 CO 0.15 -2.04 0.54 0.45 0.00 0.00 0.00 175.76 174.86 1ue1 s SER 35 N 2.58 6.30 -0.31 0.00 0.15 -0.53 -1.58 113.70 120.31 1ue1 s SER 35 Ca 0.09 -0.25 -0.08 0.00 0.70 0.00 0.00 55.95 56.41 1ue1 s SER 35 Cb -0.23 -2.28 0.01 0.00 -1.71 0.00 0.00 66.02 61.81 1ue1 s SER 35 CO -0.02 -0.60 0.11 0.42 1.20 0.00 0.00 173.24 174.35 1ue1 s THR 36 N 2.49 4.15 0.30 6.45 -4.23 -1.26 -0.48 115.64 123.06 1ue1 s THR 36 Ca 0.19 -0.66 -0.13 0.00 -1.18 0.00 0.00 61.69 59.90 1ue1 s THR 36 Cb -0.15 -3.16 -0.08 0.00 1.34 0.00 0.00 72.50 70.45 1ue1 s THR 36 CO 0.15 0.04 0.69 -2.16 -0.54 0.00 0.00 174.62 172.80 1ue1 s PRO 37 N 1.53 3.94 0.16 3.99 0.04 -1.26 -4.90 135.00 138.49 1ue1 s PRO 37 Ca 0.03 0.55 -0.13 0.00 0.04 0.00 0.00 61.00 61.49 1ue1 s PRO 37 Cb -0.17 -2.49 -0.07 0.00 0.04 0.00 0.00 34.50 31.81 1ue1 s PRO 37 CO 0.04 0.19 0.54 1.03 0.04 0.00 0.00 177.00 178.83 1ue1 s ARG 38 N -2.98 3.91 -0.02 4.56 1.81 -1.26 0.30 118.95 125.27 1ue1 s ARG 38 Ca 0.52 0.40 0.04 0.00 -1.72 0.00 0.00 55.73 54.97 1ue1 s ARG 38 Cb -0.10 -2.85 -0.01 0.00 -0.45 0.00 0.00 34.95 31.54 1ue1 s ARG 38 CO 0.19 0.44 -0.14 0.96 -0.68 0.00 0.00 175.30 176.07 1ue1 s ILE 39 N -1.56 1.14 -0.29 1.52 -4.36 0.35 -4.74 121.20 113.25 1ue1 s ILE 39 Ca 0.40 -0.59 -0.06 0.00 -0.26 0.00 0.00 60.65 60.15 1ue1 s ILE 39 Cb -0.14 -0.97 0.02 0.00 1.25 0.00 0.00 42.46 42.62 1ue1 s ILE 39 CO 0.20 0.33 0.06 -0.47 0.24 0.00 0.00 174.94 175.29 1ue1 s TYR 40 N -0.12 3.15 -0.68 1.37 6.04 -1.26 0.16 117.35 126.02 1ue1 s TYR 40 Ca 0.01 -1.18 -0.26 0.00 0.04 0.00 0.00 57.07 55.68 1ue1 s TYR 40 Cb -0.08 -2.22 -0.03 0.00 -1.04 0.00 0.00 41.96 38.59 1ue1 s TYR 40 CO 0.00 -0.63 1.91 -0.51 -1.54 0.00 0.00 175.55 174.78 1ue1 s ASP 41 N 1.45 5.19 0.00 4.32 1.01 -1.25 -4.75 116.67 122.63 1ue1 s ASP 41 Ca 0.01 0.12 0.00 0.00 0.71 0.00 0.00 52.55 53.39 1ue1 s ASP 41 Cb -0.18 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1ue1 s ASP 41 CO 0.01 -2.50 0.19 0.54 0.21 0.00 0.00 175.17 173.63 1ue1 n ARG 42 N 9.10 0.00 -3.53 8.23 5.12 -1.26 -3.42 116.66 130.90 1ue1 n ARG 42 Ca 0.26 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.89 1ue1 n ARG 42 Cb 0.51 -1.41 -0.12 0.00 -1.16 0.00 0.00 32.46 30.28 1ue1 n ARG 42 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1ue1 s GLN 43 N -1.38 0.83 0.08 5.56 -0.44 -1.26 -5.11 119.66 117.95 1ue1 s GLN 43 Ca 0.00 -1.64 0.00 0.00 -2.50 0.00 0.00 55.36 51.22 1ue1 s GLN 43 Cb 0.00 -1.65 0.00 0.00 -1.64 0.00 0.00 33.01 29.72 1ue1 s GLN 43 CO 0.00 -1.21 0.00 -2.37 0.50 0.00 0.00 175.29 172.21 1ue1 n THR 44 N 3.74 0.00 -3.37 -0.34 5.66 -1.22 -5.06 114.28 113.69 1ue1 n THR 44 Ca 0.13 0.06 0.04 0.00 -3.05 0.00 0.00 64.05 61.23 1ue1 n THR 44 Cb 0.37 -0.16 -0.01 0.00 -1.55 0.00 0.00 70.33 68.99 1ue1 n THR 44 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ue1 n GLY 45 N -2.48 -1.62 0.00 1.09 0.00 -1.26 -4.46 105.19 96.45 1ue1 n GLY 45 Ca -0.00 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1ue1 n GLY 45 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ue1 n GLU 46 N -1.75 1.36 -1.87 1.61 1.02 -1.26 -4.91 120.64 114.84 1ue1 n GLU 46 Ca 0.00 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.81 1ue1 n GLU 46 Cb 0.13 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.58 1ue1 n GLU 46 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1ue1 s TRP 47 N 3.62 2.81 0.06 -0.32 0.52 -1.26 -3.94 118.94 120.44 1ue1 s TRP 47 Ca 0.00 1.53 0.03 0.00 0.02 0.00 0.00 56.10 57.68 1ue1 s TRP 47 Cb 0.00 -3.08 -0.03 0.00 -1.15 0.00 0.00 33.47 29.21 1ue1 s TRP 47 CO 0.00 -1.41 -0.09 0.15 0.02 0.00 0.00 176.95 175.62 1ue1 s LYS 48 N -4.15 0.68 -0.94 4.98 1.02 0.42 -4.91 119.74 116.84 1ue1 s LYS 48 Ca 0.65 -0.94 -0.24 0.00 0.02 0.00 0.00 55.97 55.46 1ue1 s LYS 48 Cb -0.18 -0.43 0.04 0.00 -0.52 0.00 0.00 37.83 36.74 1ue1 s LYS 48 CO 0.40 0.07 1.43 -0.51 -0.92 0.00 0.00 175.35 175.83 1ue1 s ASP 49 N -1.95 6.35 0.90 2.83 1.11 -1.26 0.13 116.67 124.78 1ue1 s ASP 49 Ca -0.03 -1.16 0.00 0.00 0.18 0.00 0.00 52.55 51.54 1ue1 s ASP 49 Cb -0.07 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.36 1ue1 s ASP 49 CO 0.00 -1.64 0.00 0.61 1.18 0.00 0.00 175.17 175.32 1ue1 n GLY 50 N 6.50 -3.03 3.65 0.21 0.00 0.15 -4.88 105.19 107.79 1ue1 n GLY 50 Ca 0.26 -1.34 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 1ue1 n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ue1 s GLU 51 N -2.71 3.99 0.53 1.61 2.02 -1.26 -4.53 118.70 118.36 1ue1 s GLU 51 Ca 0.00 2.15 -0.18 0.00 0.02 0.00 0.00 54.97 56.96 1ue1 s GLU 51 Cb 0.00 -4.07 -0.07 0.00 0.10 0.00 0.00 34.13 30.09 1ue1 s GLU 51 CO 0.00 -1.08 1.05 0.00 0.02 0.00 0.00 175.26 175.25 1ue1 s ALA 52 N 4.77 2.82 -0.13 5.21 0.00 -1.26 -4.43 121.76 128.74 1ue1 s ALA 52 Ca 0.79 0.53 -0.02 0.00 0.00 0.00 0.00 51.96 53.25 1ue1 s ALA 52 Cb -0.34 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 1ue1 s ALA 52 CO 0.33 -0.51 -0.04 -1.17 0.00 0.00 0.00 175.76 174.36 1ue1 s LEU 53 N -3.88 3.24 -0.25 0.00 2.96 0.37 -4.96 118.68 116.16 1ue1 s LEU 53 Ca 0.66 -0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 54.45 1ue1 s LEU 53 Cb -0.16 -1.76 0.01 0.00 0.50 0.00 0.00 46.19 44.78 1ue1 s LEU 53 CO 0.27 0.23 -0.02 -0.36 -1.32 0.00 0.00 176.35 175.15 1ue1 s PHE 54 N -0.03 3.06 -0.15 5.38 0.40 -1.26 -1.45 117.98 123.94 1ue1 s PHE 54 Ca 0.01 -1.29 0.01 0.00 -0.60 0.00 0.00 56.93 55.06 1ue1 s PHE 54 Cb -0.13 -2.11 0.02 0.00 0.51 0.00 0.00 43.02 41.30 1ue1 s PHE 54 CO 0.03 -0.66 -0.18 -0.51 0.70 0.00 0.00 175.22 174.60 1ue1 s LEU 55 N 1.40 1.94 0.20 -0.37 1.43 -0.77 -4.95 118.68 117.57 1ue1 s LEU 55 Ca 0.02 -0.56 -0.28 0.00 -1.03 0.00 0.00 54.13 52.28 1ue1 s LEU 55 Cb -0.16 -1.33 -0.08 0.00 0.03 0.00 0.00 46.19 44.65 1ue1 s LEU 55 CO -0.03 0.01 0.87 -0.60 0.23 0.00 0.00 176.35 176.84 1ue1 s ARG 56 N 1.16 4.73 -0.01 1.70 6.06 -1.26 -0.03 118.95 131.30 1ue1 s ARG 56 Ca -0.00 1.35 0.03 0.00 -2.50 0.00 0.00 55.73 54.60 1ue1 s ARG 56 Cb -0.14 -3.28 -0.01 0.00 0.06 0.00 0.00 34.95 31.59 1ue1 s ARG 56 CO -0.07 0.53 -0.09 0.00 -2.50 0.00 0.00 175.30 173.16 1ue1 s ASN 58 N -0.17 2.64 0.07 0.00 4.22 -0.52 -1.82 114.94 119.36 1ue1 s ASN 58 Ca 0.03 -0.48 0.06 0.00 -2.14 0.00 0.00 52.86 50.33 1ue1 s ASN 58 Cb -0.04 -1.20 -0.04 0.00 1.28 0.00 0.00 41.25 41.25 1ue1 s ASN 58 CO -0.00 0.05 -0.11 -0.51 -2.04 0.00 0.00 177.10 174.49 1ue1 s ILE 59 N 0.81 3.30 0.31 0.54 2.07 -0.52 -2.65 121.20 125.07 1ue1 s ILE 59 Ca -0.09 -1.17 0.09 0.00 -1.41 0.00 0.00 60.65 58.07 1ue1 s ILE 59 Cb -0.16 -2.50 -0.04 0.00 0.13 0.00 0.00 42.46 39.89 1ue1 s ILE 59 CO 0.00 0.21 0.06 0.26 -1.91 0.00 0.00 174.94 173.56 1ue1 s TRP 60 N -1.12 2.67 0.00 3.50 0.51 -1.26 -1.76 118.94 121.48 1ue1 s TRP 60 Ca 0.19 -0.34 0.00 0.00 -2.12 0.00 0.00 56.10 53.84 1ue1 s TRP 60 Cb -0.11 -1.45 0.00 0.00 -0.81 0.00 0.00 33.47 31.10 1ue1 s TRP 60 CO 0.11 0.47 0.00 0.54 -0.51 0.00 0.00 176.95 177.56 1ue1 n ARG 61 N -1.02 0.00 0.22 4.98 5.12 -1.04 -2.61 116.66 122.32 1ue1 n ARG 61 Ca -0.04 0.00 0.08 0.00 -1.93 0.00 0.00 57.85 55.96 1ue1 n ARG 61 Cb 0.61 0.00 0.53 0.00 -1.16 0.00 0.00 32.46 32.43 1ue1 n ARG 61 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1ue1 h GLU 62 N 0.00 0.00 -0.27 5.56 4.39 -1.97 -2.27 114.58 120.02 1ue1 h GLU 62 Ca 0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 1ue1 h GLU 62 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1ue1 h GLU 62 CO 0.00 0.24 0.15 0.00 -1.16 0.00 0.00 179.01 178.24 1ue1 h ALA 63 N 1.76 0.35 -0.17 3.43 0.00 -1.89 0.40 119.26 123.13 1ue1 h ALA 63 Ca -0.00 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1ue1 h ALA 63 Cb 0.57 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1ue1 h ALA 63 CO 0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 179.25 179.14 1ue1 h ALA 64 N 1.03 0.14 -1.00 0.00 0.00 -1.22 0.25 119.26 118.46 1ue1 h ALA 64 Ca 0.10 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1ue1 h ALA 64 Cb 0.06 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 1ue1 h ALA 64 CO -0.02 -0.45 0.65 0.93 0.00 0.00 0.00 179.25 180.36 1ue1 h GLU 65 N 0.04 1.21 -0.30 0.00 5.08 -1.08 0.17 114.58 119.70 1ue1 h GLU 65 Ca 0.08 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1ue1 h GLU 65 Cb 0.11 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 1ue1 h GLU 65 CO -0.15 0.80 -0.04 -0.91 -1.00 0.00 0.00 179.01 177.72 1ue1 h ASN 66 N 1.24 0.44 0.59 1.42 2.35 0.10 -1.87 115.58 119.85 1ue1 h ASN 66 Ca 0.40 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 56.04 1ue1 h ASN 66 Cb 0.04 -0.12 0.01 0.00 0.05 0.00 0.00 38.32 38.30 1ue1 h ASN 66 CO -0.13 0.53 -0.28 0.58 -1.65 0.00 0.00 177.43 176.48 1ue1 h VAL 67 N 0.45 0.09 -1.07 2.81 2.07 0.18 -2.17 116.25 118.62 1ue1 h VAL 67 Ca 0.09 -0.42 0.30 0.00 0.82 0.00 0.00 66.70 67.50 1ue1 h VAL 67 Cb 0.35 0.13 -0.12 0.00 -1.52 0.00 0.00 31.29 30.13 1ue1 h VAL 67 CO 0.01 0.02 0.65 0.00 0.02 0.00 0.00 177.57 178.27 1ue1 h ALA 68 N -1.10 2.13 -0.00 1.67 0.00 -0.62 0.25 119.26 121.59 1ue1 h ALA 68 Ca -0.08 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ue1 h ALA 68 Cb 0.63 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1ue1 h ALA 68 CO 0.13 -0.65 -0.32 -1.91 0.00 0.00 0.00 179.25 176.50 1ue1 n GLU 69 N -4.81 0.51 -0.01 0.00 2.13 -0.72 -4.46 120.64 113.29 1ue1 n GLU 69 Ca 0.29 -0.28 -0.01 0.00 0.66 0.00 0.00 57.16 57.82 1ue1 n GLU 69 Cb 0.96 -1.49 -0.01 0.00 0.27 0.00 0.00 31.44 31.16 1ue1 n GLU 69 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1ue1 n SER 70 N -1.00 4.31 -4.63 4.31 7.64 0.62 -5.07 113.62 119.82 1ue1 n SER 70 Ca 0.10 -0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.65 1ue1 n SER 70 Cb 0.34 0.37 -0.10 0.00 -1.01 0.00 0.00 64.21 63.81 1ue1 n SER 70 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ue1 s LEU 71 N -4.44 3.30 0.00 -3.43 1.43 0.20 -5.08 118.68 110.66 1ue1 s LEU 71 Ca -0.02 -0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.02 1ue1 s LEU 71 Cb 0.01 -1.87 -0.01 0.00 0.03 0.00 0.00 46.19 44.34 1ue1 s LEU 71 CO 0.07 0.29 0.08 0.35 0.23 0.00 0.00 176.35 177.37 1ue1 n THR 72 N 1.55 0.00 -1.62 5.49 -2.24 -1.26 -4.32 114.28 111.88 1ue1 n THR 72 Ca -0.15 -1.02 -0.46 0.00 -2.27 0.00 0.00 64.05 60.14 1ue1 n THR 72 Cb 0.53 0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 69.13 1ue1 n THR 72 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1ue1 n ARG 73 N -0.36 1.59 -1.11 -0.78 0.63 -1.26 -2.27 116.66 113.10 1ue1 n ARG 73 Ca -0.01 0.57 -0.04 0.00 -0.92 0.00 0.00 57.85 57.45 1ue1 n ARG 73 Cb 0.26 -2.12 -0.02 0.00 0.45 0.00 0.00 32.46 31.04 1ue1 n ARG 73 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ue1 n GLY 74 N 1.90 0.44 3.76 5.14 0.00 0.41 -4.93 105.19 111.92 1ue1 n GLY 74 Ca 0.12 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1ue1 n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ue1 s ALA 75 N -1.47 3.45 -0.01 4.61 0.00 -0.96 -4.58 121.76 122.80 1ue1 s ALA 75 Ca 0.00 1.07 -0.24 0.00 0.00 0.00 0.00 51.96 52.78 1ue1 s ALA 75 Cb 0.00 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 1ue1 s ALA 75 CO 0.00 -0.39 0.74 0.50 0.00 0.00 0.00 175.76 176.61 1ue1 s ARG 76 N -1.54 4.46 0.05 0.00 3.52 -1.26 -1.65 118.95 122.52 1ue1 s ARG 76 Ca 0.47 0.98 -0.01 0.00 -0.13 0.00 0.00 55.73 57.04 1ue1 s ARG 76 Cb -0.36 -3.40 -0.04 0.00 -1.56 0.00 0.00 34.95 29.59 1ue1 s ARG 76 CO 0.46 0.18 -0.03 0.14 -0.81 0.00 0.00 175.30 175.24 1ue1 s VAL 77 N 0.36 0.23 -0.16 7.11 -7.23 0.34 -1.72 120.40 119.34 1ue1 s VAL 77 Ca 0.38 -1.77 -0.04 0.00 -1.81 0.00 0.00 61.98 58.75 1ue1 s VAL 77 Cb -0.19 -1.47 -0.03 0.00 0.56 0.00 0.00 36.38 35.26 1ue1 s VAL 77 CO 0.21 -0.97 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.36 1ue1 s ILE 78 N -3.79 3.84 -0.12 -0.62 1.01 0.15 -2.54 121.20 119.12 1ue1 s ILE 78 Ca 0.06 -0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.34 1ue1 s ILE 78 Cb 0.07 -2.68 0.02 0.00 0.01 0.00 0.00 42.46 39.88 1ue1 s ILE 78 CO -0.09 0.49 -0.12 -0.69 0.00 0.00 0.00 174.94 174.53 1ue1 s VAL 79 N 0.41 1.30 -0.19 2.92 1.01 -0.69 -1.92 120.40 123.24 1ue1 s VAL 79 Ca -0.04 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 61.41 1ue1 s VAL 79 Cb -0.14 -1.24 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 1ue1 s VAL 79 CO 0.03 0.41 -0.01 -0.55 0.00 0.00 0.00 175.10 174.97 1ue1 s SER 80 N 1.40 4.74 0.02 3.32 0.15 -0.10 -1.12 113.70 122.12 1ue1 s SER 80 Ca 0.01 -0.22 -0.01 0.00 0.70 0.00 0.00 55.95 56.43 1ue1 s SER 80 Cb -0.13 -1.80 0.00 0.00 -1.71 0.00 0.00 66.02 62.38 1ue1 s SER 80 CO -0.07 0.07 0.05 0.61 1.20 0.00 0.00 173.24 175.11 1ue1 n GLY 81 N 4.18 1.83 3.24 9.45 0.00 -0.29 -1.29 105.19 122.31 1ue1 n GLY 81 Ca -0.17 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 1ue1 n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ue1 s ARG 82 N -2.01 2.63 0.12 1.61 0.52 -0.46 -1.27 118.95 120.10 1ue1 s ARG 82 Ca 0.01 -0.87 -0.30 0.00 -0.52 0.00 0.00 55.73 54.05 1ue1 s ARG 82 Cb -0.00 -2.15 -0.07 0.00 0.52 0.00 0.00 34.95 33.25 1ue1 s ARG 82 CO 0.01 0.30 1.21 -0.51 0.02 0.00 0.00 175.30 176.33 1ue1 s LEU 83 N 0.02 4.41 -0.03 2.53 1.43 -0.34 -1.11 118.68 125.58 1ue1 s LEU 83 Ca -0.08 2.13 0.02 0.00 -1.03 0.00 0.00 54.13 55.17 1ue1 s LEU 83 Cb -0.15 -3.59 0.01 0.00 0.03 0.00 0.00 46.19 42.49 1ue1 s LEU 83 CO 0.05 -0.43 -0.09 -0.54 0.23 0.00 0.00 176.35 175.57 1ue1 s LYS 84 N 0.47 1.10 -0.41 1.70 3.01 -0.11 -4.65 119.74 120.85 1ue1 s LYS 84 Ca 0.56 -0.32 -0.10 0.00 -1.01 0.00 0.00 55.97 55.11 1ue1 s LYS 84 Cb -0.31 -1.01 0.07 0.00 -1.01 0.00 0.00 37.83 35.57 1ue1 s LYS 84 CO 0.32 0.09 0.26 -1.14 0.51 0.00 0.00 175.35 175.39 1ue1 s GLN 85 N 0.34 2.65 0.65 1.68 0.74 -1.26 -1.29 119.66 123.16 1ue1 s GLN 85 Ca -0.06 -1.40 -0.11 0.00 0.05 0.00 0.00 55.36 53.84 1ue1 s GLN 85 Cb -0.11 -3.78 0.15 0.00 1.10 0.00 0.00 33.01 30.38 1ue1 s GLN 85 CO 0.01 -0.92 0.77 0.54 -0.55 0.00 0.00 175.29 175.14 1ue1 n ARG 86 N 4.94 -1.29 -3.40 1.67 1.74 -0.07 -4.86 116.66 115.39 1ue1 n ARG 86 Ca -0.10 -1.20 -0.13 0.00 -0.77 0.00 0.00 57.85 55.65 1ue1 n ARG 86 Cb 0.43 -0.89 -0.10 0.00 -1.02 0.00 0.00 32.46 30.89 1ue1 n ARG 86 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1ue1 s SER 87 N -3.77 0.80 0.01 0.55 0.01 -1.26 -2.97 113.70 107.07 1ue1 s SER 87 Ca 0.45 -0.09 0.08 0.00 1.31 0.00 0.00 55.95 57.71 1ue1 s SER 87 Cb -0.02 0.81 -0.02 0.00 0.21 0.00 0.00 66.02 66.99 1ue1 s SER 87 CO 0.33 -0.32 -0.25 0.72 0.41 0.00 0.00 173.24 174.12 1ue1 s PHE 88 N 2.45 2.24 -0.14 2.43 -0.71 -0.77 -4.98 117.98 118.50 1ue1 s PHE 88 Ca 0.10 -0.41 -0.06 0.00 -1.04 0.00 0.00 56.93 55.52 1ue1 s PHE 88 Cb -0.15 -1.39 -0.04 0.00 -1.21 0.00 0.00 43.02 40.23 1ue1 s PHE 88 CO -0.18 0.04 0.07 -1.21 -1.34 0.00 0.00 175.22 172.60 1ue1 s GLU 89 N -0.92 3.61 0.00 1.99 2.02 -1.26 -2.74 118.70 121.39 1ue1 s GLU 89 Ca 0.10 -0.31 0.00 0.00 0.02 0.00 0.00 54.97 54.79 1ue1 s GLU 89 Cb -0.10 -3.11 0.00 0.00 0.10 0.00 0.00 34.13 31.02 1ue1 s GLU 89 CO 0.01 0.50 0.00 0.25 0.02 0.00 0.00 175.26 176.04 1ue1 n THR 90 N 2.82 0.00 0.00 3.63 -2.24 -1.26 -4.95 114.28 112.27 1ue1 n THR 90 Ca -0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1ue1 n THR 90 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 1ue1 n THR 90 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ue1 n ARG 91 N 0.00 0.00 -0.17 -0.78 1.74 -1.26 -5.17 116.66 111.02 1ue1 n ARG 91 Ca 0.00 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.02 1ue1 n ARG 91 Cb 0.00 -1.70 0.01 0.00 -1.02 0.00 0.00 32.46 29.75 1ue1 n ARG 91 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1ue1 n LYS 95 N 0.00 0.00 0.00 5.56 0.00 -1.26 -5.34 118.16 117.12 1ue1 n LYS 95 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1ue1 n LYS 95 Cb 0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 35.03 34.86 1ue1 n LYS 95 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 1ue1 n ARG 96 N 0.43 0.00 -4.29 -1.58 1.85 -1.11 -4.61 116.66 107.35 1ue1 n ARG 96 Ca -0.00 0.00 -0.25 0.00 -1.00 0.00 0.00 57.85 56.60 1ue1 n ARG 96 Cb 0.11 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.44 1ue1 n ARG 96 CO 0.00 0.00 0.00 -0.08 -0.01 0.00 0.00 177.63 177.54 1ue1 s THR 97 N 0.00 3.35 0.03 8.89 -1.32 -1.26 -1.84 115.64 123.49 1ue1 s THR 97 Ca 0.00 -1.78 0.02 0.00 -1.21 0.00 0.00 61.69 58.72 1ue1 s THR 97 Cb 0.00 -2.73 -0.02 0.00 -1.51 0.00 0.00 72.50 68.24 1ue1 s THR 97 CO 0.00 -0.25 -0.07 -0.69 -2.21 0.00 0.00 174.62 171.40 1ue1 s VAL 98 N -2.03 0.53 -0.29 5.08 1.01 -1.16 -4.97 120.40 118.57 1ue1 s VAL 98 Ca 0.28 -0.90 -0.07 0.00 0.00 0.00 0.00 61.98 61.29 1ue1 s VAL 98 Cb -0.08 -0.56 -0.00 0.00 0.00 0.00 0.00 36.38 35.74 1ue1 s VAL 98 CO 0.18 -0.27 0.09 -0.63 0.00 0.00 0.00 175.10 174.47 1ue1 s ILE 99 N -1.11 4.15 0.33 2.22 1.01 -1.26 -0.89 121.20 125.65 1ue1 s ILE 99 Ca -0.07 -0.54 0.04 0.00 0.00 0.00 0.00 60.65 60.08 1ue1 s ILE 99 Cb -0.08 -3.10 -0.06 0.00 0.01 0.00 0.00 42.46 39.22 1ue1 s ILE 99 CO 0.00 0.13 0.04 -1.83 0.00 0.00 0.00 174.94 173.28 1ue1 s GLU 100 N 1.54 1.67 -0.09 2.79 -1.05 -0.41 -4.66 118.70 118.50 1ue1 s GLU 100 Ca 0.04 -1.92 -0.02 0.00 -0.15 0.00 0.00 54.97 52.92 1ue1 s GLU 100 Cb -0.17 -0.99 -0.03 0.00 -0.44 0.00 0.00 34.13 32.50 1ue1 s GLU 100 CO 0.03 -0.15 -0.00 0.08 0.95 0.00 0.00 175.26 176.18 1ue1 s VAL 101 N -3.20 4.29 -0.36 1.83 1.01 0.29 -0.93 120.40 123.33 1ue1 s VAL 101 Ca 0.35 -0.25 -0.07 0.00 0.00 0.00 0.00 61.98 62.01 1ue1 s VAL 101 Cb 0.08 -2.81 0.05 0.00 0.00 0.00 0.00 36.38 33.70 1ue1 s VAL 101 CO 0.15 0.60 0.14 -0.70 0.00 0.00 0.00 175.10 175.29 1ue1 s GLU 102 N -0.79 2.62 0.30 2.72 2.12 -0.27 -1.44 118.70 123.96 1ue1 s GLU 102 Ca 0.12 -1.23 -0.29 0.00 0.36 0.00 0.00 54.97 53.93 1ue1 s GLU 102 Cb -0.11 -3.54 -0.10 0.00 0.26 0.00 0.00 34.13 30.63 1ue1 s GLU 102 CO 0.02 -0.72 1.27 0.08 -0.54 0.00 0.00 175.26 175.37 1ue1 s VAL 103 N 1.42 2.93 -0.06 3.70 1.01 -1.08 -1.35 120.40 126.96 1ue1 s VAL 103 Ca -0.00 0.90 0.06 0.00 0.00 0.00 0.00 61.98 62.94 1ue1 s VAL 103 Cb -0.20 -3.57 -0.09 0.00 0.00 0.00 0.00 36.38 32.52 1ue1 s VAL 103 CO 0.03 0.20 0.04 0.47 0.00 0.00 0.00 175.10 175.84 1ue1 n ASP 104 N 1.21 3.27 -3.64 3.32 8.00 -0.41 -4.68 116.55 123.62 1ue1 n ASP 104 Ca 0.01 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.37 1ue1 n ASP 104 Cb 0.42 0.76 -0.07 0.00 -0.02 0.00 0.00 41.12 42.21 1ue1 n ASP 104 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1ue1 s GLU 105 N -2.22 0.81 -0.18 -1.24 0.41 -1.04 -5.03 118.70 110.22 1ue1 s GLU 105 Ca -0.03 0.99 -0.17 0.00 -0.41 0.00 0.00 54.97 55.34 1ue1 s GLU 105 Cb 0.02 0.38 0.05 0.00 -1.78 0.00 0.00 34.13 32.81 1ue1 s GLU 105 CO 0.29 -0.10 0.48 -1.50 -0.49 0.00 0.00 175.26 173.94 1ue1 s ILE 106 N 0.44 0.00 0.08 -1.63 2.07 -1.26 -0.93 121.20 119.98 1ue1 s ILE 106 Ca -0.01 -0.00 -0.19 0.00 -1.41 0.00 0.00 60.65 59.05 1ue1 s ILE 106 Cb -0.05 -0.68 0.04 0.00 0.13 0.00 0.00 42.46 41.90 1ue1 s ILE 106 CO -0.00 -0.00 0.44 -0.83 -1.91 0.00 0.00 174.94 172.64 1ue1 s GLY 107 N 0.24 -0.33 0.08 1.50 0.00 -0.81 -4.98 107.32 103.03 1ue1 s GLY 107 Ca -0.00 0.25 -0.31 0.00 0.00 0.00 0.00 44.72 44.66 1ue1 s GLY 107 CO 0.01 -0.02 1.30 2.56 0.00 0.00 0.00 173.10 176.94 1ue1 s PRO 108 N -3.03 4.37 0.02 2.90 0.04 -1.26 -0.68 135.00 137.36 1ue1 s PRO 108 Ca -0.02 1.92 -0.30 0.00 0.04 0.00 0.00 61.00 62.64 1ue1 s PRO 108 Cb 0.00 -3.31 -0.05 0.00 0.04 0.00 0.00 34.50 31.18 1ue1 s PRO 108 CO -0.06 -0.36 1.23 0.45 0.04 0.00 0.00 177.00 178.30 1ue1 s SER 109 N 1.12 7.03 -0.06 6.66 0.15 -0.70 -4.85 113.70 123.06 1ue1 s SER 109 Ca 0.62 1.98 0.01 0.00 0.70 0.00 0.00 55.95 59.25 1ue1 s SER 109 Cb -0.33 -2.57 0.10 0.00 -1.71 0.00 0.00 66.02 61.51 1ue1 s SER 109 CO 0.29 -0.54 1.11 0.18 1.20 0.00 0.00 173.24 175.48 1ue1 n LEU 110 N 4.51 3.43 0.05 3.45 4.77 -1.26 -4.33 117.00 127.62 1ue1 n LEU 110 Ca 0.10 -1.75 -0.02 0.00 -0.03 0.00 0.00 56.01 54.31 1ue1 n LEU 110 Cb 0.46 -0.55 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 1ue1 n LEU 110 CO 0.56 0.56 0.25 -0.09 -1.33 0.00 0.00 177.39 177.35 1ue1 h ARG 111 N 0.17 -0.14 -0.98 3.23 9.65 -1.96 -3.37 114.38 120.98 1ue1 h ARG 111 Ca 0.09 0.01 -0.62 0.00 -1.10 0.00 0.00 59.98 58.35 1ue1 h ARG 111 Cb 1.24 0.03 -0.36 0.00 -1.39 0.00 0.00 29.97 29.49 1ue1 h ARG 111 CO 0.15 -0.09 0.02 0.66 2.80 0.00 0.00 179.97 183.51 1ue1 n TYR 112 N -2.69 3.01 0.00 2.20 4.02 -1.26 -5.01 117.16 117.43 1ue1 n TYR 112 Ca -0.02 -2.63 0.00 0.00 -0.01 0.00 0.00 57.90 55.24 1ue1 n TYR 112 Cb 0.06 -0.85 0.00 0.00 -0.02 0.00 0.00 39.34 38.53 1ue1 n TYR 112 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1ue1 n ALA 113 N -0.77 0.00 -3.28 -0.72 0.00 -1.26 -5.11 120.51 109.36 1ue1 n ALA 113 Ca 0.52 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.87 1ue1 n ALA 113 Cb 0.78 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.24 1ue1 n ALA 113 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ue1 n THR 114 N -0.01 0.00 -3.64 0.00 -2.24 -1.26 -4.27 114.28 102.86 1ue1 n THR 114 Ca 0.00 -0.75 -0.08 0.00 -2.27 0.00 0.00 64.05 60.95 1ue1 n THR 114 Cb 0.00 -0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 67.55 1ue1 n THR 114 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ue1 s ALA 115 N -2.27 -2.03 -0.39 6.98 0.00 -1.26 -4.95 121.76 117.83 1ue1 s ALA 115 Ca 0.18 1.83 -0.12 0.00 0.00 0.00 0.00 51.96 53.85 1ue1 s ALA 115 Cb -0.01 -1.50 0.04 0.00 0.00 0.00 0.00 23.12 21.64 1ue1 s ALA 115 CO 0.11 -0.21 0.24 0.15 0.00 0.00 0.00 175.76 176.06 1ue1 s LYS 116 N 0.15 2.81 -0.27 0.00 3.01 -1.26 -5.07 119.74 119.11 1ue1 s LYS 116 Ca 0.04 -1.16 -0.14 0.00 -1.01 0.00 0.00 55.97 53.70 1ue1 s LYS 116 Cb -0.05 -3.80 -0.04 0.00 -1.01 0.00 0.00 37.83 32.93 1ue1 s LYS 116 CO -0.08 -0.78 0.32 0.08 0.51 0.00 0.00 175.35 175.41 1ue1 s VAL 117 N 1.55 5.21 -0.40 3.17 1.01 -1.26 -5.05 120.40 124.63 1ue1 s VAL 117 Ca 0.02 0.46 -0.14 0.00 0.00 0.00 0.00 61.98 62.33 1ue1 s VAL 117 Cb -0.20 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.55 1ue1 s VAL 117 CO 0.06 0.18 0.27 0.20 0.00 0.00 0.00 175.10 175.82 1ue1 s ASN 118 N 1.67 6.00 0.90 3.32 0.01 -1.26 -5.08 114.94 120.50 1ue1 s ASN 118 Ca 0.13 -0.91 -0.10 0.00 -0.71 0.00 0.00 52.86 51.27 1ue1 s ASN 118 Cb -0.16 -2.12 0.14 0.00 0.41 0.00 0.00 41.25 39.52 1ue1 s ASN 118 CO 0.10 -0.42 1.14 -0.54 -1.51 0.00 0.00 177.10 175.87 1ue1 s LYS 119 N 1.64 1.13 0.00 -0.60 1.02 -1.26 -5.02 119.74 116.65 1ue1 s LYS 119 Ca 0.04 1.53 0.00 0.00 0.02 0.00 0.00 55.97 57.56 1ue1 s LYS 119 Cb -0.19 -1.74 0.00 0.00 -0.52 0.00 0.00 37.83 35.38 1ue1 s LYS 119 CO 0.09 -2.55 0.00 0.00 -0.92 0.00 0.00 175.35 171.97 1ue1 n ALA 120 N -4.16 0.00 -3.26 5.17 0.00 -1.26 -5.10 120.51 111.90 1ue1 n ALA 120 Ca 0.12 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.59 1ue1 n ALA 120 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.95 1ue1 n ALA 120 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ue1 s SER 121 N -1.00 -1.13 0.00 0.00 1.04 -1.26 -5.07 113.70 106.28 1ue1 s SER 121 Ca 0.00 0.91 0.00 0.00 0.48 0.00 0.00 55.95 57.34 1ue1 s SER 121 Cb 0.00 2.03 0.00 0.00 0.10 0.00 0.00 66.02 68.15 1ue1 s SER 121 CO 0.00 -0.21 0.00 -2.11 0.98 0.00 0.00 173.24 171.90 1ue1 n ARG 122 N 5.41 0.00 0.00 4.02 1.85 -1.26 -5.36 116.66 121.31 1ue1 n ARG 122 Ca -0.05 0.00 0.06 0.00 -1.00 0.00 0.00 57.85 56.86 1ue1 n ARG 122 Cb 0.51 0.00 0.05 0.00 -1.05 0.00 0.00 32.46 31.97 1ue1 n ARG 122 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49