#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ous s THR 2 N 0.00 2.41 0.09 0.00 2.01 -1.26 -5.02 115.64 113.87 1ous s THR 2 Ca 0.00 0.41 0.04 0.00 0.31 0.00 0.00 61.69 62.44 1ous s THR 2 Cb 0.00 -3.26 -0.03 0.00 0.01 0.00 0.00 72.50 69.22 1ous s THR 2 CO 0.00 0.09 -0.10 -1.10 -0.69 0.00 0.00 174.62 172.82 1ous s GLN 3 N -1.78 0.80 0.00 4.92 -1.52 -1.26 -4.84 119.66 115.97 1ous s GLN 3 Ca 0.52 -1.09 0.00 0.00 -1.95 0.00 0.00 55.36 52.84 1ous s GLN 3 Cb -0.43 -0.51 0.00 0.00 -0.22 0.00 0.00 33.01 31.85 1ous s GLN 3 CO 0.56 0.08 0.00 0.41 -0.25 0.00 0.00 175.29 176.10 1ous n GLY 4 N 0.73 0.65 3.41 3.09 0.00 -1.26 -4.89 105.19 106.93 1ous n GLY 4 Ca -0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 1ous n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ous s VAL 5 N -2.33 3.33 0.01 1.61 1.01 -1.26 -0.30 120.40 122.46 1ous s VAL 5 Ca 0.00 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.44 1ous s VAL 5 Cb 0.00 -2.42 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 1ous s VAL 5 CO 0.00 0.52 -0.06 -0.36 0.00 0.00 0.00 175.10 175.20 1ous s PHE 6 N 0.34 0.53 -0.34 5.22 0.08 0.33 -5.01 117.98 119.12 1ous s PHE 6 Ca -0.09 -0.19 -0.11 0.00 0.12 0.00 0.00 56.93 56.67 1ous s PHE 6 Cb -0.15 -0.34 0.01 0.00 -0.57 0.00 0.00 43.02 41.97 1ous s PHE 6 CO 0.05 -0.03 0.19 0.99 -0.10 0.00 0.00 175.22 176.32 1ous s THR 7 N -0.43 4.68 0.30 0.64 2.01 -1.26 -1.12 115.64 120.46 1ous s THR 7 Ca -0.01 -0.60 0.06 0.00 0.31 0.00 0.00 61.69 61.45 1ous s THR 7 Cb -0.04 -3.49 -0.02 0.00 0.01 0.00 0.00 72.50 68.96 1ous s THR 7 CO -0.00 -0.09 0.41 -0.76 -0.69 0.00 0.00 174.62 173.50 1ous s LEU 8 N 1.60 4.05 0.50 4.42 1.02 0.10 -5.00 118.68 125.38 1ous s LEU 8 Ca 0.04 -0.13 -0.23 0.00 0.02 0.00 0.00 54.13 53.83 1ous s LEU 8 Cb -0.18 -2.74 -0.06 0.00 0.02 0.00 0.00 46.19 43.23 1ous s LEU 8 CO 0.07 -0.30 1.33 -2.16 0.02 0.00 0.00 176.35 175.31 1ous s PRO 9 N -4.09 3.41 0.68 1.29 0.04 -1.26 -4.42 135.00 130.65 1ous s PRO 9 Ca 0.41 2.18 -0.17 0.00 0.04 0.00 0.00 61.00 63.46 1ous s PRO 9 Cb -0.09 -2.39 0.01 0.00 0.04 0.00 0.00 34.50 32.07 1ous s PRO 9 CO 0.30 -0.96 1.25 0.00 0.04 0.00 0.00 177.00 177.63 1ous s ALA 10 N -1.32 2.27 -1.52 8.56 0.00 -1.26 -3.60 121.76 124.88 1ous s ALA 10 Ca 0.67 1.07 -0.01 0.00 0.00 0.00 0.00 51.96 53.69 1ous s ALA 10 Cb -0.39 -3.52 0.01 0.00 0.00 0.00 0.00 23.12 19.23 1ous s ALA 10 CO 0.47 -1.70 0.18 0.09 0.00 0.00 0.00 175.76 174.80 1ous n ASN 11 N -2.23 0.34 -4.24 0.00 3.02 0.13 -4.89 115.26 107.40 1ous n ASN 11 Ca 0.15 -1.18 -0.30 0.00 -0.03 0.00 0.00 54.58 53.22 1ous n ASN 11 Cb 0.49 -2.10 -0.16 0.00 -0.61 0.00 0.00 39.78 37.40 1ous n ASN 11 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ous s THR 12 N -4.18 1.86 0.20 3.41 2.01 -1.24 -4.86 115.64 112.84 1ous s THR 12 Ca 0.05 -0.97 -0.30 0.00 0.31 0.00 0.00 61.69 60.78 1ous s THR 12 Cb -0.03 -1.57 -0.08 0.00 0.01 0.00 0.00 72.50 70.83 1ous s THR 12 CO 0.96 0.52 1.03 -0.13 -0.69 0.00 0.00 174.62 176.31 1ous s ARG 13 N -0.22 4.69 0.05 4.92 0.52 -1.26 -0.61 118.95 127.04 1ous s ARG 13 Ca -0.00 1.62 -0.02 0.00 -0.52 0.00 0.00 55.73 56.81 1ous s ARG 13 Cb -0.12 -3.28 -0.03 0.00 0.52 0.00 0.00 34.95 32.04 1ous s ARG 13 CO 0.02 0.25 -0.00 -0.59 0.02 0.00 0.00 175.30 175.00 1ous s PHE 14 N -0.61 0.42 -0.01 -0.53 -0.71 0.33 -4.18 117.98 112.68 1ous s PHE 14 Ca 0.46 -0.89 -0.02 0.00 -1.04 0.00 0.00 56.93 55.44 1ous s PHE 14 Cb -0.28 -0.31 -0.04 0.00 -1.21 0.00 0.00 43.02 41.18 1ous s PHE 14 CO 0.34 -0.36 0.12 0.20 -1.34 0.00 0.00 175.22 174.18 1ous s GLY 15 N -2.59 2.08 -0.05 1.99 0.00 -0.35 -1.05 107.32 107.34 1ous s GLY 15 Ca 0.02 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 43.92 1ous s GLY 15 CO -0.08 -0.69 -0.04 0.54 0.00 0.00 0.00 173.10 172.83 1ous s VAL 16 N -1.22 0.53 -0.01 1.40 0.11 -0.49 -1.41 120.40 119.30 1ous s VAL 16 Ca 0.24 -0.08 0.03 0.00 -2.93 0.00 0.00 61.98 59.24 1ous s VAL 16 Cb -0.12 -0.59 -0.00 0.00 -1.53 0.00 0.00 36.38 34.14 1ous s VAL 16 CO 0.15 0.24 -0.09 -0.89 -3.33 0.00 0.00 175.10 171.18 1ous s THR 17 N 1.21 0.76 0.03 5.04 2.01 -0.04 -1.65 115.64 123.00 1ous s THR 17 Ca -0.06 -0.39 0.08 0.00 0.31 0.00 0.00 61.69 61.62 1ous s THR 17 Cb -0.14 -0.65 -0.03 0.00 0.01 0.00 0.00 72.50 71.70 1ous s THR 17 CO -0.02 0.22 -0.21 0.00 -0.69 0.00 0.00 174.62 173.92 1ous s ALA 18 N -0.12 2.44 0.07 7.40 0.00 -0.32 -0.70 121.76 130.53 1ous s ALA 18 Ca 0.02 -1.20 0.07 0.00 0.00 0.00 0.00 51.96 50.85 1ous s ALA 18 Cb -0.05 -0.64 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 1ous s ALA 18 CO -0.00 0.55 -0.19 -0.06 0.00 0.00 0.00 175.76 176.06 1ous s PHE 19 N -0.84 1.67 -0.03 0.00 0.08 0.76 -1.39 117.98 118.23 1ous s PHE 19 Ca 0.13 -0.39 0.05 0.00 0.12 0.00 0.00 56.93 56.83 1ous s PHE 19 Cb -0.10 -0.96 -0.01 0.00 -0.57 0.00 0.00 43.02 41.38 1ous s PHE 19 CO 0.03 0.12 -0.17 0.00 -0.10 0.00 0.00 175.22 175.10 1ous s ALA 20 N -0.98 1.47 -0.41 5.36 0.00 -0.71 -1.25 121.76 125.24 1ous s ALA 20 Ca 0.05 -0.72 0.09 0.00 0.00 0.00 0.00 51.96 51.38 1ous s ALA 20 Cb -0.09 -0.43 0.30 0.00 0.00 0.00 0.00 23.12 22.90 1ous s ALA 20 CO 0.03 0.32 0.79 0.09 0.00 0.00 0.00 175.76 176.98 1ous n ASN 21 N 2.88 -0.59 -3.63 0.00 3.02 -0.02 -1.96 115.26 114.96 1ous n ASN 21 Ca -0.16 -3.13 -0.13 0.00 -0.03 0.00 0.00 54.58 51.13 1ous n ASN 21 Cb 0.53 0.30 -0.06 0.00 -0.61 0.00 0.00 39.78 39.95 1ous n ASN 21 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ous s SER 22 N -1.75 -0.33 0.50 6.41 0.15 0.24 -4.03 113.70 114.90 1ous s SER 22 Ca 0.34 0.00 0.29 0.00 0.70 0.00 0.00 55.95 57.28 1ous s SER 22 Cb 0.27 0.45 1.02 0.00 -1.71 0.00 0.00 66.02 66.05 1ous s SER 22 CO -0.11 -0.71 1.86 0.77 1.20 0.00 0.00 173.24 176.25 1ous h SER 23 N 2.83 0.00 -3.14 5.45 4.64 -1.96 -3.32 113.55 118.05 1ous h SER 23 Ca -0.32 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.46 1ous h SER 23 Cb 1.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.29 1ous h SER 23 CO 0.43 0.04 -0.23 -0.83 -0.87 0.00 0.00 176.83 175.38 1ous s GLY 24 N -4.21 2.00 -0.02 -0.77 0.00 -1.26 -4.94 107.32 98.12 1ous s GLY 24 Ca 0.03 -0.59 -0.30 0.00 0.00 0.00 0.00 44.72 43.86 1ous s GLY 24 CO 0.59 -0.50 1.30 -1.59 0.00 0.00 0.00 173.10 172.91 1ous s THR 25 N -1.89 3.97 0.02 0.90 2.01 -1.26 -4.71 115.64 114.68 1ous s THR 25 Ca 0.42 1.33 -0.09 0.00 0.31 0.00 0.00 61.69 63.66 1ous s THR 25 Cb -0.11 -3.86 -0.05 0.00 0.01 0.00 0.00 72.50 68.49 1ous s THR 25 CO 0.27 0.00 0.33 -1.10 -0.69 0.00 0.00 174.62 173.44 1ous s GLN 26 N 2.25 3.70 -0.09 4.92 -1.52 0.09 -4.33 119.66 124.67 1ous s GLN 26 Ca 0.60 0.11 0.00 0.00 -1.95 0.00 0.00 55.36 54.12 1ous s GLN 26 Cb -0.28 -3.09 0.02 0.00 -0.22 0.00 0.00 33.01 29.44 1ous s GLN 26 CO 0.24 0.64 -0.07 0.99 -0.25 0.00 0.00 175.29 176.84 1ous s THR 27 N -1.27 0.94 -0.14 -0.19 2.01 -0.30 -1.95 115.64 114.74 1ous s THR 27 Ca 0.28 -0.27 -0.00 0.00 0.31 0.00 0.00 61.69 62.00 1ous s THR 27 Cb -0.14 -0.95 -0.01 0.00 0.01 0.00 0.00 72.50 71.41 1ous s THR 27 CO 0.15 0.34 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.60 1ous s VAL 28 N 1.46 2.91 -0.07 3.82 1.01 0.55 -0.85 120.40 129.24 1ous s VAL 28 Ca -0.00 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.32 1ous s VAL 28 Cb -0.13 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 1ous s VAL 28 CO -0.05 0.51 -0.18 0.20 0.00 0.00 0.00 175.10 175.58 1ous s ASN 29 N 0.60 3.64 -0.21 3.32 -0.87 0.04 -0.86 114.94 120.61 1ous s ASN 29 Ca -0.08 -0.35 0.00 0.00 -1.57 0.00 0.00 52.86 50.86 1ous s ASN 29 Cb -0.16 -1.01 0.02 0.00 -0.02 0.00 0.00 41.25 40.09 1ous s ASN 29 CO 0.03 0.27 -0.15 -0.69 -2.57 0.00 0.00 177.10 173.99 1ous s VAL 30 N -0.27 2.37 -0.12 1.60 1.01 -0.04 -0.80 120.40 124.16 1ous s VAL 30 Ca 0.01 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 1ous s VAL 30 Cb -0.13 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 1ous s VAL 30 CO 0.03 0.40 0.03 -0.76 0.00 0.00 0.00 175.10 174.80 1ous s LEU 31 N 1.30 3.70 -0.17 3.92 1.02 0.72 -0.06 118.68 129.12 1ous s LEU 31 Ca 0.03 0.14 0.01 0.00 0.02 0.00 0.00 54.13 54.33 1ous s LEU 31 Cb -0.15 -1.88 0.02 0.00 0.02 0.00 0.00 46.19 44.20 1ous s LEU 31 CO -0.09 0.32 -0.20 -0.69 0.02 0.00 0.00 176.35 175.70 1ous s VAL 32 N -0.50 2.02 -1.37 -1.59 1.01 0.15 -0.57 120.40 119.56 1ous s VAL 32 Ca 0.09 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.09 1ous s VAL 32 Cb -0.12 -1.82 0.03 0.00 0.00 0.00 0.00 36.38 34.47 1ous s VAL 32 CO 0.02 0.54 0.88 -3.20 0.00 0.00 0.00 175.10 173.34 1ous n ASN 33 N 4.49 -3.00 -1.27 3.32 2.85 -0.26 -1.98 115.26 119.40 1ous n ASN 33 Ca -0.20 -0.75 -0.16 0.00 -0.11 0.00 0.00 54.58 53.36 1ous n ASN 33 Cb 0.50 -4.26 -0.07 0.00 1.24 0.00 0.00 39.78 37.19 1ous n ASN 33 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1ous n ASN 34 N -3.00 -4.95 -4.04 1.20 3.02 -1.26 -5.00 115.26 101.23 1ous n ASN 34 Ca -0.16 0.38 -0.23 0.00 -0.03 0.00 0.00 54.58 54.55 1ous n ASN 34 Cb 0.62 -3.89 -0.16 0.00 -0.61 0.00 0.00 39.78 35.74 1ous n ASN 34 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1ous s GLU 35 N -3.43 1.33 0.04 3.52 2.02 -0.84 -5.06 118.70 116.27 1ous s GLU 35 Ca 0.00 -0.41 -0.33 0.00 0.02 0.00 0.00 54.97 54.26 1ous s GLU 35 Cb 0.00 -1.18 -0.11 0.00 0.10 0.00 0.00 34.13 32.94 1ous s GLU 35 CO 0.00 0.13 1.83 2.41 0.02 0.00 0.00 175.26 179.65 1ous n THR 36 N 3.36 0.44 -0.01 3.63 -1.04 -1.26 -0.67 114.28 118.73 1ous n THR 36 Ca -0.19 -0.08 0.02 0.00 -2.04 0.00 0.00 64.05 61.76 1ous n THR 36 Cb 0.53 -1.95 -0.05 0.00 -1.82 0.00 0.00 70.33 67.04 1ous n THR 36 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ous n ALA 37 N 5.87 2.19 -3.49 2.41 0.00 0.92 -4.88 120.51 123.53 1ous n ALA 37 Ca 0.20 -0.19 -0.17 0.00 0.00 0.00 0.00 53.44 53.28 1ous n ALA 37 Cb 0.33 -0.18 -0.07 0.00 0.00 0.00 0.00 19.45 19.54 1ous n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ous s ALA 38 N -2.41 -1.64 -0.04 0.00 0.00 -1.06 -5.01 121.76 111.61 1ous s ALA 38 Ca -0.02 1.27 -0.01 0.00 0.00 0.00 0.00 51.96 53.19 1ous s ALA 38 Cb 0.04 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.05 1ous s ALA 38 CO 0.27 -0.35 0.07 0.99 0.00 0.00 0.00 175.76 176.74 1ous s THR 39 N -1.01 -0.04 0.12 0.00 2.01 -1.26 -0.86 115.64 114.60 1ous s THR 39 Ca -0.10 0.15 0.06 0.00 0.31 0.00 0.00 61.69 62.12 1ous s THR 39 Cb -0.01 -0.13 -0.04 0.00 0.01 0.00 0.00 72.50 72.33 1ous s THR 39 CO 0.08 0.06 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.57 1ous s PHE 40 N 0.86 1.43 0.05 4.92 0.08 -0.04 -4.98 117.98 120.29 1ous s PHE 40 Ca -0.07 -0.53 -0.21 0.00 0.12 0.00 0.00 56.93 56.24 1ous s PHE 40 Cb -0.09 -0.75 0.05 0.00 -0.57 0.00 0.00 43.02 41.65 1ous s PHE 40 CO -0.03 0.15 0.49 0.45 -0.10 0.00 0.00 175.22 176.17 1ous s SER 41 N -2.35 -0.39 0.00 1.36 0.15 -1.26 -0.33 113.70 110.88 1ous s SER 41 Ca 0.08 0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.83 1ous s SER 41 Cb -0.06 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.73 1ous s SER 41 CO 0.03 -0.72 0.00 0.61 1.20 0.00 0.00 173.24 174.36 1ous n GLY 42 N 0.37 0.13 2.69 9.45 0.00 -0.82 -4.83 105.19 112.18 1ous n GLY 42 Ca -0.18 -0.95 -0.22 0.00 0.00 0.00 0.00 46.02 44.67 1ous n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ous s GLN 43 N -2.00 0.12 -0.10 1.61 -0.44 -1.26 -0.74 119.66 116.85 1ous s GLN 43 Ca 0.00 0.11 -0.16 0.00 -2.50 0.00 0.00 55.36 52.82 1ous s GLN 43 Cb 0.00 -1.39 0.04 0.00 -1.64 0.00 0.00 33.01 30.02 1ous s GLN 43 CO 0.00 -0.63 0.39 0.45 0.50 0.00 0.00 175.29 176.00 1ous s SER 44 N 2.24 -0.36 -0.25 6.67 0.15 -1.25 -5.01 113.70 115.89 1ous s SER 44 Ca 0.04 0.56 0.11 0.00 0.70 0.00 0.00 55.95 57.36 1ous s SER 44 Cb -0.15 0.63 0.48 0.00 -1.71 0.00 0.00 66.02 65.26 1ous s SER 44 CO -0.10 -0.28 1.39 0.35 1.20 0.00 0.00 173.24 175.80 1ous n THR 45 N 2.17 2.40 -2.80 6.45 -2.24 -1.26 -0.59 114.28 118.42 1ous n THR 45 Ca -0.16 -2.70 0.00 0.00 -2.27 0.00 0.00 64.05 58.92 1ous n THR 45 Cb 0.57 -0.29 0.05 0.00 -2.10 0.00 0.00 70.33 68.56 1ous n THR 45 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ous n ASN 46 N -1.07 1.43 -3.34 3.42 5.15 -1.26 -4.89 115.26 114.70 1ous n ASN 46 Ca 0.28 -2.02 -0.24 0.00 -0.60 0.00 0.00 54.58 51.99 1ous n ASN 46 Cb 0.92 -0.43 0.02 0.00 -0.53 0.00 0.00 39.78 39.76 1ous n ASN 46 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1ous n ASN 47 N -0.51 -5.00 -4.77 1.20 5.15 -0.83 -4.93 115.26 105.57 1ous n ASN 47 Ca 0.06 -0.43 -0.40 0.00 -0.60 0.00 0.00 54.58 53.22 1ous n ASN 47 Cb 0.84 -4.05 0.01 0.00 -0.53 0.00 0.00 39.78 36.05 1ous n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ous s ALA 48 N -3.11 3.33 -0.99 5.20 0.00 -1.17 -4.60 121.76 120.41 1ous s ALA 48 Ca 0.42 1.45 -0.19 0.00 0.00 0.00 0.00 51.96 53.64 1ous s ALA 48 Cb -0.21 -3.58 0.12 0.00 0.00 0.00 0.00 23.12 19.45 1ous s ALA 48 CO 0.52 -1.10 1.25 0.08 0.00 0.00 0.00 175.76 176.51 1ous s VAL 49 N -1.19 4.57 -0.59 0.00 1.01 -1.26 -1.74 120.40 121.21 1ous s VAL 49 Ca 0.58 -1.53 0.19 0.00 0.00 0.00 0.00 61.98 61.22 1ous s VAL 49 Cb -0.43 -4.87 0.19 0.00 0.00 0.00 0.00 36.38 31.27 1ous s VAL 49 CO 0.57 -1.63 1.59 2.30 0.00 0.00 0.00 175.10 177.93 1ous n ILE 50 N 5.72 1.00 -3.63 2.22 -5.35 -0.48 -4.83 119.36 114.01 1ous n ILE 50 Ca 0.28 0.35 -0.04 0.00 -0.27 0.00 0.00 62.75 63.07 1ous n ILE 50 Cb 0.49 -1.26 -0.04 0.00 -1.74 0.00 0.00 39.64 37.09 1ous n ILE 50 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1ous s GLY 51 N -3.38 -0.05 -0.03 3.28 0.00 -1.23 -4.38 107.32 101.53 1ous s GLY 51 Ca 0.03 2.44 -0.25 0.00 0.00 0.00 0.00 44.72 46.93 1ous s GLY 51 CO 0.30 0.96 0.56 -1.08 0.00 0.00 0.00 173.10 173.83 1ous s THR 52 N -1.35 0.02 -0.06 0.90 -1.32 -1.26 -1.18 115.64 111.39 1ous s THR 52 Ca 0.08 -0.16 -0.29 0.00 -1.21 0.00 0.00 61.69 60.10 1ous s THR 52 Cb -0.01 -0.88 0.11 0.00 -1.51 0.00 0.00 72.50 70.21 1ous s THR 52 CO -0.05 -0.09 0.91 -1.58 -2.21 0.00 0.00 174.62 171.59 1ous s GLN 53 N -1.33 0.76 -0.19 7.08 0.74 -0.66 -5.01 119.66 121.05 1ous s GLN 53 Ca -0.11 -0.10 -0.06 0.00 0.05 0.00 0.00 55.36 55.14 1ous s GLN 53 Cb -0.02 0.36 -0.03 0.00 1.10 0.00 0.00 33.01 34.42 1ous s GLN 53 CO 0.07 -0.30 0.02 0.08 -0.55 0.00 0.00 175.29 174.62 1ous s VAL 54 N -2.28 4.24 0.35 1.34 1.01 -1.26 -1.40 120.40 122.40 1ous s VAL 54 Ca 0.01 -0.22 0.06 0.00 0.00 0.00 0.00 61.98 61.83 1ous s VAL 54 Cb -0.01 -2.91 -0.07 0.00 0.00 0.00 0.00 36.38 33.39 1ous s VAL 54 CO -0.04 0.43 0.01 -0.76 0.00 0.00 0.00 175.10 174.75 1ous s LEU 55 N 0.79 2.54 -0.11 3.92 1.43 -0.21 -4.95 118.68 122.08 1ous s LEU 55 Ca 0.01 -1.34 0.01 0.00 -1.03 0.00 0.00 54.13 51.79 1ous s LEU 55 Cb -0.14 -0.67 -0.01 0.00 0.03 0.00 0.00 46.19 45.40 1ous s LEU 55 CO 0.02 -0.48 -0.15 0.21 0.23 0.00 0.00 176.35 176.18 1ous s ASN 56 N -3.58 3.89 0.31 2.29 3.84 -1.26 -0.52 114.94 119.92 1ous s ASN 56 Ca 0.35 -0.34 0.24 0.00 0.21 0.00 0.00 52.86 53.32 1ous s ASN 56 Cb 0.08 -1.47 1.13 0.00 -0.55 0.00 0.00 41.25 40.44 1ous s ASN 56 CO 0.16 0.19 1.72 0.77 -2.79 0.00 0.00 177.10 177.16 1ous h SER 57 N 6.51 0.00 -2.99 -4.21 4.64 -1.17 -3.47 113.55 112.87 1ous h SER 57 Ca -0.28 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.16 1ous h SER 57 Cb 1.21 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.27 1ous h SER 57 CO 0.54 0.00 -0.15 0.61 -0.87 0.00 0.00 176.83 176.96 1ous n GLY 58 N -0.59 -1.77 0.28 -0.77 0.00 -1.26 -2.14 105.19 98.94 1ous n GLY 58 Ca 0.00 -1.26 0.03 0.00 0.00 0.00 0.00 46.02 44.79 1ous n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ous h SER 59 N -0.38 0.40 0.78 1.61 4.64 -1.94 0.38 113.55 119.04 1ous h SER 59 Ca 0.01 -0.04 -0.25 0.00 -0.47 0.00 0.00 61.79 61.04 1ous h SER 59 Cb 0.38 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 1ous h SER 59 CO 0.00 0.39 -1.28 0.77 -0.87 0.00 0.00 176.83 175.84 1ous h SER 60 N 0.45 0.05 0.00 4.97 4.64 -1.97 -3.45 113.55 118.24 1ous h SER 60 Ca 0.11 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1ous h SER 60 Cb 0.13 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1ous h SER 60 CO -0.01 1.05 0.00 0.61 -0.87 0.00 0.00 176.83 177.61 1ous n GLY 61 N 1.45 0.74 3.67 -0.77 0.00 -0.91 -4.82 105.19 104.54 1ous n GLY 61 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1ous n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ous s LYS 62 N -0.25 4.29 -0.07 1.61 2.20 -1.26 0.02 119.74 126.29 1ous s LYS 62 Ca 0.00 1.26 0.03 0.00 -0.36 0.00 0.00 55.97 56.90 1ous s LYS 62 Cb 0.00 -3.61 0.01 0.00 -1.51 0.00 0.00 37.83 32.72 1ous s LYS 62 CO 0.00 -0.49 -0.16 0.08 -0.36 0.00 0.00 175.35 174.41 1ous s VAL 63 N 2.71 1.42 -0.03 4.02 1.01 -0.27 -1.10 120.40 128.16 1ous s VAL 63 Ca 0.43 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.78 1ous s VAL 63 Cb -0.16 -1.26 -0.00 0.00 0.00 0.00 0.00 36.38 34.96 1ous s VAL 63 CO 0.10 0.42 -0.13 -1.58 0.00 0.00 0.00 175.10 173.91 1ous s GLN 64 N 0.43 1.35 -0.15 2.72 0.74 0.26 -0.51 119.66 124.50 1ous s GLN 64 Ca -0.13 -0.45 -0.04 0.00 0.05 0.00 0.00 55.36 54.79 1ous s GLN 64 Cb -0.15 -1.21 -0.03 0.00 1.10 0.00 0.00 33.01 32.72 1ous s GLN 64 CO 0.05 0.18 -0.03 0.08 -0.55 0.00 0.00 175.29 175.01 1ous s VAL 65 N 0.11 3.96 -0.00 1.34 1.01 0.59 -0.20 120.40 127.21 1ous s VAL 65 Ca -0.03 -0.34 0.06 0.00 0.00 0.00 0.00 61.98 61.67 1ous s VAL 65 Cb -0.10 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 1ous s VAL 65 CO 0.01 0.50 -0.20 -1.10 0.00 0.00 0.00 175.10 174.32 1ous s GLN 66 N 0.22 1.55 -0.04 2.72 -0.21 0.02 -4.72 119.66 119.20 1ous s GLN 66 Ca -0.02 -0.75 0.03 0.00 0.02 0.00 0.00 55.36 54.63 1ous s GLN 66 Cb -0.14 -1.53 0.01 0.00 1.00 0.00 0.00 33.01 32.34 1ous s GLN 66 CO 0.03 0.42 -0.12 0.08 -2.12 0.00 0.00 175.29 173.58 1ous s VAL 67 N -0.53 1.02 0.04 1.09 1.01 -1.26 -0.78 120.40 120.99 1ous s VAL 67 Ca 0.08 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.57 1ous s VAL 67 Cb -0.08 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.37 1ous s VAL 67 CO -0.00 0.31 0.01 -0.94 0.00 0.00 0.00 175.10 174.49 1ous s SER 68 N 0.33 0.31 -0.07 3.32 1.04 -0.03 -0.80 113.70 117.79 1ous s SER 68 Ca -0.07 -0.69 -0.01 0.00 0.48 0.00 0.00 55.95 55.66 1ous s SER 68 Cb -0.12 0.18 0.03 0.00 0.10 0.00 0.00 66.02 66.21 1ous s SER 68 CO 0.02 -0.48 -0.01 -0.69 0.98 0.00 0.00 173.24 173.06 1ous s VAL 69 N -2.75 0.46 -1.43 5.02 1.01 -0.16 -1.14 120.40 121.40 1ous s VAL 69 Ca -0.04 0.06 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 1ous s VAL 69 Cb -0.00 -0.59 0.04 0.00 0.00 0.00 0.00 36.38 35.82 1ous s VAL 69 CO -0.06 0.27 0.55 0.59 0.00 0.00 0.00 175.10 176.45 1ous n ASN 70 N 5.06 -5.01 0.00 3.32 5.03 -1.26 -0.88 115.26 121.52 1ous n ASN 70 Ca -0.09 -0.32 0.00 0.00 0.87 0.00 0.00 54.58 55.04 1ous n ASN 70 Cb 0.50 -4.08 0.00 0.00 -1.02 0.00 0.00 39.78 35.18 1ous n ASN 70 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ous n GLY 71 N -1.36 0.90 3.68 7.41 0.00 -1.26 -5.03 105.19 109.54 1ous n GLY 71 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1ous n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ous s ARG 72 N -0.04 4.09 0.12 1.61 3.00 -0.06 -5.05 118.95 122.63 1ous s ARG 72 Ca 0.00 -0.28 -0.31 0.00 0.00 0.00 0.00 55.73 55.14 1ous s ARG 72 Cb 0.00 -3.32 -0.08 0.00 0.00 0.00 0.00 34.95 31.55 1ous s ARG 72 CO 0.00 0.29 1.45 -2.14 0.00 0.00 0.00 175.30 174.90 1ous s PRO 73 N 0.36 4.29 0.70 3.54 0.02 -1.26 -0.99 135.00 141.66 1ous s PRO 73 Ca 0.06 2.16 -0.11 0.00 0.02 0.00 0.00 61.00 63.12 1ous s PRO 73 Cb -0.12 -3.24 0.01 0.00 0.02 0.00 0.00 34.50 31.17 1ous s PRO 73 CO -0.01 -0.50 1.07 -1.12 -0.33 0.00 0.00 177.00 176.12 1ous s SER 74 N 1.18 5.40 -0.34 2.53 0.01 0.02 -4.94 113.70 117.57 1ous s SER 74 Ca 0.66 1.33 -0.25 0.00 1.31 0.00 0.00 55.95 59.00 1ous s SER 74 Cb -0.39 -2.19 0.01 0.00 0.21 0.00 0.00 66.02 63.67 1ous s SER 74 CO 0.30 -1.39 0.89 -0.62 0.41 0.00 0.00 173.24 172.83 1ous s ASP 75 N -4.11 6.71 0.15 2.44 2.15 -0.20 -4.86 116.67 118.94 1ous s ASP 75 Ca 0.58 0.67 -0.05 0.00 0.43 0.00 0.00 52.55 54.18 1ous s ASP 75 Cb -0.12 -2.45 -0.06 0.00 -0.30 0.00 0.00 42.92 39.99 1ous s ASP 75 CO 0.53 -0.76 0.39 -0.76 -0.17 0.00 0.00 175.17 174.40 1ous s LEU 76 N 3.29 4.26 0.01 -1.34 1.43 -1.26 -1.37 118.68 123.69 1ous s LEU 76 Ca 0.37 0.62 0.01 0.00 -1.03 0.00 0.00 54.13 54.10 1ous s LEU 76 Cb -0.13 -3.35 -0.01 0.00 0.03 0.00 0.00 46.19 42.74 1ous s LEU 76 CO 0.16 0.04 -0.05 0.68 0.23 0.00 0.00 176.35 177.41 1ous s VAL 77 N -1.67 0.36 0.23 -1.59 -7.23 -0.65 -4.88 120.40 104.97 1ous s VAL 77 Ca 0.42 -0.37 -0.19 0.00 -1.81 0.00 0.00 61.98 60.02 1ous s VAL 77 Cb -0.12 -0.34 0.03 0.00 0.56 0.00 0.00 36.38 36.50 1ous s VAL 77 CO 0.24 -0.02 0.60 -0.94 -0.31 0.00 0.00 175.10 174.68 1ous s SER 78 N -0.43 -0.29 -0.13 4.85 1.04 -1.26 -0.36 113.70 117.12 1ous s SER 78 Ca -0.01 -0.51 -0.33 0.00 0.48 0.00 0.00 55.95 55.59 1ous s SER 78 Cb -0.03 0.64 0.13 0.00 0.10 0.00 0.00 66.02 66.85 1ous s SER 78 CO -0.00 -1.16 1.10 0.00 0.98 0.00 0.00 173.24 174.16 1ous s ALA 79 N -3.89 -1.98 -0.06 5.32 0.00 -0.85 -4.92 121.76 115.38 1ous s ALA 79 Ca 0.10 1.42 0.05 0.00 0.00 0.00 0.00 51.96 53.53 1ous s ALA 79 Cb -0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 1ous s ALA 79 CO 0.01 -0.59 -0.21 -1.14 0.00 0.00 0.00 175.76 173.82 1ous s GLN 80 N -2.50 2.54 -0.05 0.00 0.74 -1.26 -0.83 119.66 118.30 1ous s GLN 80 Ca 0.07 -0.83 0.03 0.00 0.05 0.00 0.00 55.36 54.69 1ous s GLN 80 Cb -0.01 -2.25 0.00 0.00 1.10 0.00 0.00 33.01 31.85 1ous s GLN 80 CO -0.06 0.47 -0.14 0.08 -0.55 0.00 0.00 175.29 175.09 1ous s VAL 81 N -0.35 1.22 -0.13 1.34 1.01 0.14 -4.99 120.40 118.63 1ous s VAL 81 Ca 0.03 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.45 1ous s VAL 81 Cb -0.12 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.19 1ous s VAL 81 CO 0.02 0.36 -0.22 -0.63 0.00 0.00 0.00 175.10 174.63 1ous s ILE 82 N 0.25 2.11 -0.06 2.22 1.01 -1.26 -0.98 121.20 124.50 1ous s ILE 82 Ca -0.07 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 59.60 1ous s ILE 82 Cb -0.12 -1.84 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 1ous s ILE 82 CO 0.02 0.55 0.02 -0.76 0.00 0.00 0.00 174.94 174.77 1ous s LEU 83 N 0.70 3.64 -1.30 2.97 1.43 0.19 -4.52 118.68 121.78 1ous s LEU 83 Ca -0.10 0.12 -0.15 0.00 -1.03 0.00 0.00 54.13 52.98 1ous s LEU 83 Cb -0.16 -1.93 0.14 0.00 0.03 0.00 0.00 46.19 44.27 1ous s LEU 83 CO 0.01 0.34 0.46 1.07 0.23 0.00 0.00 176.35 178.46 1ous n THR 84 N 1.84 -0.34 -1.43 5.49 5.66 -1.26 -1.34 114.28 122.89 1ous n THR 84 Ca -0.17 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.68 1ous n THR 84 Cb 0.53 -0.82 -0.07 0.00 -1.55 0.00 0.00 70.33 68.42 1ous n THR 84 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1ous n ASN 85 N -2.22 -4.21 0.00 1.09 5.15 -1.26 -4.65 115.26 109.15 1ous n ASN 85 Ca 0.06 0.38 0.00 0.00 -0.60 0.00 0.00 54.58 54.41 1ous n ASN 85 Cb 0.49 -3.78 0.00 0.00 -0.53 0.00 0.00 39.78 35.96 1ous n ASN 85 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1ous n GLU 86 N -1.93 0.00 -3.17 1.20 -0.58 -0.45 -5.06 120.64 110.65 1ous n GLU 86 Ca -0.15 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.18 1ous n GLU 86 Cb 0.52 -0.49 -0.07 0.00 -0.57 0.00 0.00 31.44 30.82 1ous n GLU 86 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1ous s LEU 87 N -2.30 4.11 -0.14 -4.62 2.96 -0.49 -4.36 118.68 113.84 1ous s LEU 87 Ca 0.00 0.47 -0.03 0.00 -0.22 0.00 0.00 54.13 54.35 1ous s LEU 87 Cb 0.00 -2.75 -0.03 0.00 0.50 0.00 0.00 46.19 43.91 1ous s LEU 87 CO 0.00 -0.39 -0.02 0.20 -1.32 0.00 0.00 176.35 174.82 1ous s ASN 88 N 1.59 4.94 -0.12 3.68 0.01 -0.29 -0.64 114.94 124.11 1ous s ASN 88 Ca 0.23 -0.05 0.01 0.00 -0.71 0.00 0.00 52.86 52.35 1ous s ASN 88 Cb -0.15 -1.68 0.02 0.00 0.41 0.00 0.00 41.25 39.84 1ous s ASN 88 CO 0.10 0.23 -0.15 -0.36 -1.51 0.00 0.00 177.10 175.41 1ous s PHE 89 N 0.01 2.07 -0.30 2.20 0.40 -0.15 -2.39 117.98 119.82 1ous s PHE 89 Ca 0.01 -1.04 -0.04 0.00 -0.60 0.00 0.00 56.93 55.26 1ous s PHE 89 Cb -0.13 -1.50 0.03 0.00 0.51 0.00 0.00 43.02 41.93 1ous s PHE 89 CO 0.02 -0.54 0.04 0.00 0.70 0.00 0.00 175.22 175.45 1ous s ALA 90 N 1.11 2.93 -0.09 5.36 0.00 0.58 -0.68 121.76 130.97 1ous s ALA 90 Ca -0.03 -1.63 -0.01 0.00 0.00 0.00 0.00 51.96 50.29 1ous s ALA 90 Cb -0.14 -2.05 -0.03 0.00 0.00 0.00 0.00 23.12 20.89 1ous s ALA 90 CO -0.04 -1.13 -0.04 -0.51 0.00 0.00 0.00 175.76 174.04 1ous s LEU 91 N 1.37 3.33 -0.03 0.00 1.43 -0.01 -0.85 118.68 123.92 1ous s LEU 91 Ca -0.01 0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.12 1ous s LEU 91 Cb -0.18 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.30 1ous s LEU 91 CO 0.00 0.33 -0.05 -0.69 0.23 0.00 0.00 176.35 176.18 1ous s VAL 92 N -0.63 0.53 0.30 -1.59 1.01 -0.23 -2.01 120.40 117.78 1ous s VAL 92 Ca 0.10 -0.17 0.10 0.00 0.00 0.00 0.00 61.98 62.00 1ous s VAL 92 Cb -0.12 -0.52 -0.06 0.00 0.00 0.00 0.00 36.38 35.69 1ous s VAL 92 CO 0.02 0.20 -0.13 -0.83 0.00 0.00 0.00 175.10 174.36 1ous s GLY 93 N 0.56 1.97 -0.05 4.51 0.00 0.51 -0.82 107.32 114.01 1ous s GLY 93 Ca -0.07 -1.96 -0.25 0.00 0.00 0.00 0.00 44.72 42.44 1ous s GLY 93 CO 0.00 -1.96 0.55 -1.35 0.00 0.00 0.00 173.10 170.34 1ous s SER 94 N -3.53 -0.50 -0.13 1.64 1.04 -0.62 -1.63 113.70 109.98 1ous s SER 94 Ca 0.30 0.53 0.02 0.00 0.48 0.00 0.00 55.95 57.29 1ous s SER 94 Cb -0.00 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1ous s SER 94 CO 0.14 -0.54 -0.21 -0.70 0.98 0.00 0.00 173.24 172.92 1ous s GLU 95 N -1.17 3.10 0.00 4.02 2.56 -0.47 -2.47 118.70 124.27 1ous s GLU 95 Ca -0.11 -0.83 0.14 0.00 0.00 0.00 0.00 54.97 54.17 1ous s GLU 95 Cb -0.02 -2.43 0.17 0.00 2.00 0.00 0.00 34.13 33.85 1ous s GLU 95 CO 0.08 0.09 1.03 -0.40 -0.56 0.00 0.00 175.26 175.50 1ous n ASP 96 N 3.79 2.40 0.00 -1.70 5.68 -1.26 -1.04 116.55 124.43 1ous n ASP 96 Ca -0.19 -1.68 0.00 0.00 -0.50 0.00 0.00 54.79 52.42 1ous n ASP 96 Cb 0.52 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 1ous n ASP 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ous n GLY 97 N 0.80 5.55 1.08 6.12 0.00 -1.26 -5.02 105.19 112.45 1ous n GLY 97 Ca 0.10 -1.09 0.04 0.00 0.00 0.00 0.00 46.02 45.07 1ous n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ous n THR 98 N 0.00 0.61 -0.31 2.61 -2.24 -1.26 -4.84 114.28 108.85 1ous n THR 98 Ca 0.00 -1.45 0.10 0.00 -2.27 0.00 0.00 64.05 60.43 1ous n THR 98 Cb 0.00 0.58 0.32 0.00 -2.10 0.00 0.00 70.33 69.13 1ous n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ous n ASP 99 N -0.05 4.03 -3.65 3.42 5.68 -1.26 -4.95 116.55 119.76 1ous n ASP 99 Ca 0.09 -2.16 -0.21 0.00 -0.50 0.00 0.00 54.79 52.01 1ous n ASP 99 Cb 0.95 -0.50 0.05 0.00 -1.14 0.00 0.00 41.12 40.48 1ous n ASP 99 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1ous n ASN 100 N 1.36 -1.98 -3.85 -1.12 4.05 -1.26 -4.98 115.26 107.48 1ous n ASN 100 Ca 0.24 -0.76 -0.30 0.00 0.45 0.00 0.00 54.58 54.21 1ous n ASN 100 Cb 0.68 -4.34 -0.15 0.00 1.23 0.00 0.00 39.78 37.20 1ous n ASN 100 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1ous s ASP 101 N -4.21 4.19 -0.18 1.20 -1.08 -1.26 -4.99 116.67 110.34 1ous s ASP 101 Ca 0.10 -1.70 0.10 0.00 -0.52 0.00 0.00 52.55 50.53 1ous s ASP 101 Cb -0.05 -1.14 0.60 0.00 -1.46 0.00 0.00 42.92 40.87 1ous s ASP 101 CO 0.79 -0.37 1.42 -1.22 0.52 0.00 0.00 175.17 176.31 1ous n TYR 102 N 4.64 1.55 0.17 -5.34 4.01 -1.26 -3.80 117.16 117.13 1ous n TYR 102 Ca -0.02 -0.55 0.10 0.00 -0.16 0.00 0.00 57.90 57.27 1ous n TYR 102 Cb 0.42 -0.41 0.19 0.00 -0.31 0.00 0.00 39.34 39.24 1ous n TYR 102 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1ous n ASN 103 N 0.43 3.25 -0.33 7.72 3.02 -1.24 -1.59 115.26 126.52 1ous n ASN 103 Ca 0.21 -1.93 0.10 0.00 -0.03 0.00 0.00 54.58 52.92 1ous n ASN 103 Cb 0.96 -0.24 0.27 0.00 -0.61 0.00 0.00 39.78 40.16 1ous n ASN 103 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1ous h ASP 104 N 3.78 0.71 -3.10 6.41 3.32 -1.58 -3.23 116.42 122.74 1ous h ASP 104 Ca 0.00 0.09 -0.19 0.00 0.02 0.00 0.00 57.03 56.95 1ous h ASP 104 Cb 0.88 -0.04 -0.30 0.00 0.22 0.00 0.00 39.33 40.09 1ous h ASP 104 CO 0.00 0.30 -0.47 0.00 -1.72 0.00 0.00 179.24 177.34 1ous s ALA 105 N -5.92 -0.65 -0.02 3.45 0.00 -1.23 -0.84 121.76 116.54 1ous s ALA 105 Ca -0.12 1.07 0.06 0.00 0.00 0.00 0.00 51.96 52.98 1ous s ALA 105 Cb 0.23 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.48 1ous s ALA 105 CO 0.79 -0.40 -0.21 0.08 0.00 0.00 0.00 175.76 176.02 1ous s VAL 106 N 1.79 1.70 -0.07 0.00 1.01 -0.38 -1.78 120.40 122.67 1ous s VAL 106 Ca -0.05 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.04 1ous s VAL 106 Cb -0.11 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.87 1ous s VAL 106 CO -0.09 0.48 -0.13 -0.69 0.00 0.00 0.00 175.10 174.67 1ous s VAL 107 N -0.42 1.16 -0.14 2.92 1.01 0.00 -0.17 120.40 124.77 1ous s VAL 107 Ca 0.06 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.56 1ous s VAL 107 Cb -0.09 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.24 1ous s VAL 107 CO -0.00 0.36 -0.20 -0.69 0.00 0.00 0.00 175.10 174.57 1ous s VAL 108 N 0.64 2.29 -0.12 2.92 1.01 0.12 -1.06 120.40 126.20 1ous s VAL 108 Ca -0.14 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 60.94 1ous s VAL 108 Cb -0.16 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 1ous s VAL 108 CO 0.04 0.54 -0.16 -0.63 0.00 0.00 0.00 175.10 174.89 1ous s ILE 109 N 0.71 2.77 0.02 2.22 1.01 -0.03 -0.86 121.20 127.04 1ous s ILE 109 Ca -0.09 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 59.81 1ous s ILE 109 Cb -0.16 -2.14 -0.01 0.00 0.01 0.00 0.00 42.46 40.16 1ous s ILE 109 CO 0.01 0.54 -0.04 0.54 0.00 0.00 0.00 174.94 175.98 1ous s ASN 110 N 0.32 0.41 0.15 3.58 4.22 -0.50 -0.31 114.94 122.82 1ous s ASN 110 Ca -0.13 -0.35 -0.23 0.00 -2.14 0.00 0.00 52.86 50.02 1ous s ASN 110 Cb -0.16 0.04 0.07 0.00 1.28 0.00 0.00 41.25 42.47 1ous s ASN 110 CO 0.07 -0.16 0.59 -1.66 -2.04 0.00 0.00 177.10 173.90 1ous s TRP 111 N -0.93 -0.52 0.83 1.54 -2.14 -1.00 -1.21 118.94 115.51 1ous s TRP 111 Ca -0.08 0.31 -0.12 0.00 2.66 0.00 0.00 56.10 58.87 1ous s TRP 111 Cb -0.07 0.53 0.09 0.00 -3.10 0.00 0.00 33.47 30.93 1ous s TRP 111 CO -0.00 -0.83 1.12 -1.25 -2.66 0.00 0.00 176.95 173.33 1ous s PRO 112 N -3.71 1.82 0.48 3.25 0.04 -1.26 -1.13 135.00 134.49 1ous s PRO 112 Ca 0.01 0.42 0.06 0.00 0.04 0.00 0.00 61.00 61.53 1ous s PRO 112 Cb -0.01 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.62 1ous s PRO 112 CO -0.13 -1.75 0.28 -0.51 0.04 0.00 0.00 177.00 174.93 1ous s LEU 113 N -5.79 2.89 0.00 -3.56 1.43 -1.26 -5.00 118.68 107.39 1ous s LEU 113 Ca 0.62 -1.17 0.00 0.00 -1.03 0.00 0.00 54.13 52.55 1ous s LEU 113 Cb -0.14 -1.34 0.00 0.00 0.03 0.00 0.00 46.19 44.74 1ous s LEU 113 CO 0.53 -0.83 0.00 0.61 0.23 0.00 0.00 176.35 176.89