#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q2l s ALA 2 N 0.00 3.91 -0.07 -5.12 0.00 -0.09 -4.92 121.76 115.46 2q2l s ALA 2 Ca 0.00 -0.87 -0.05 0.00 0.00 0.00 0.00 51.96 51.04 2q2l s ALA 2 Cb 0.00 -1.91 0.03 0.00 0.00 0.00 0.00 23.12 21.24 2q2l s ALA 2 CO 0.00 0.57 0.18 0.15 0.00 0.00 0.00 175.76 176.66 2q2l s LYS 3 N -3.06 0.19 0.25 0.00 1.02 -1.26 -1.14 119.74 115.73 2q2l s LYS 3 Ca 0.37 0.32 0.04 0.00 0.02 0.00 0.00 55.97 56.72 2q2l s LYS 3 Cb -0.12 0.01 -0.05 0.00 -0.52 0.00 0.00 37.83 37.15 2q2l s LYS 3 CO 0.28 -0.07 -0.01 0.20 -0.92 0.00 0.00 175.35 174.83 2q2l s GLY 4 N 0.48 1.65 -0.13 -3.33 0.00 -0.25 -0.79 107.32 104.95 2q2l s GLY 4 Ca -0.03 -1.82 -0.08 0.00 0.00 0.00 0.00 44.72 42.79 2q2l s GLY 4 CO -0.02 -1.71 0.32 0.54 0.00 0.00 0.00 173.10 172.22 2q2l s VAL 5 N -3.33 -0.03 -0.22 1.40 0.11 0.75 -0.54 120.40 118.54 2q2l s VAL 5 Ca 0.29 0.10 -0.04 0.00 -2.93 0.00 0.00 61.98 59.40 2q2l s VAL 5 Cb 0.06 -0.47 -0.01 0.00 -1.53 0.00 0.00 36.38 34.42 2q2l s VAL 5 CO 0.10 0.04 -0.04 0.00 -3.33 0.00 0.00 175.10 171.87 2q2l s ALA 6 N 1.09 2.83 -0.21 1.54 0.00 0.58 -0.84 121.76 126.75 2q2l s ALA 6 Ca -0.08 -1.16 -0.16 0.00 0.00 0.00 0.00 51.96 50.57 2q2l s ALA 6 Cb -0.08 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 2q2l s ALA 6 CO -0.08 -0.42 0.39 0.08 0.00 0.00 0.00 175.76 175.72 2q2l s VAL 7 N 1.46 5.20 0.00 0.00 1.01 -1.26 -1.43 120.40 125.39 2q2l s VAL 7 Ca 0.06 0.67 -0.28 0.00 0.00 0.00 0.00 61.98 62.43 2q2l s VAL 7 Cb -0.14 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 2q2l s VAL 7 CO -0.03 0.25 0.87 -0.76 0.00 0.00 0.00 175.10 175.43 2q2l s LEU 8 N 1.35 4.38 0.07 3.92 1.02 -0.36 -3.97 118.68 125.10 2q2l s LEU 8 Ca 0.18 1.52 0.05 0.00 0.02 0.00 0.00 54.13 55.90 2q2l s LEU 8 Cb -0.15 -3.40 -0.04 0.00 0.02 0.00 0.00 46.19 42.63 2q2l s LEU 8 CO 0.08 -0.16 -0.03 -0.44 0.02 0.00 0.00 176.35 175.82 2q2l s SER 9 N 0.68 4.86 -0.06 2.29 0.01 0.81 -4.42 113.70 117.86 2q2l s SER 9 Ca 0.46 -0.19 -0.22 0.00 1.31 0.00 0.00 55.95 57.31 2q2l s SER 9 Cb -0.20 -1.13 0.05 0.00 0.21 0.00 0.00 66.02 64.94 2q2l s SER 9 CO 0.25 0.21 0.50 -0.55 0.41 0.00 0.00 173.24 174.05 2q2l s SER 10 N -2.06 -0.44 0.12 2.44 0.15 -1.26 -1.98 113.70 110.67 2q2l s SER 10 Ca 0.23 0.52 0.21 0.00 0.70 0.00 0.00 55.95 57.61 2q2l s SER 10 Cb -0.11 0.55 -0.09 0.00 -1.71 0.00 0.00 66.02 64.66 2q2l s SER 10 CO 0.15 -0.46 0.88 -1.54 1.20 0.00 0.00 173.24 173.47 2q2l n SER 11 N 1.43 0.72 -1.80 5.45 3.41 -1.26 -4.82 113.62 116.75 2q2l n SER 11 Ca -0.19 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 2q2l n SER 11 Cb 0.56 0.59 0.00 0.00 -0.26 0.00 0.00 64.21 65.10 2q2l n SER 11 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2q2l n GLU 12 N -2.68 2.93 0.10 4.33 -0.58 -1.26 -4.93 120.64 118.54 2q2l n GLU 12 Ca -0.04 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.76 2q2l n GLU 12 Cb 0.65 0.00 0.34 0.00 -0.57 0.00 0.00 31.44 31.86 2q2l n GLU 12 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2q2l n GLY 13 N 5.00 -0.70 3.70 0.62 0.00 -1.26 -4.94 105.19 107.62 2q2l n GLY 13 Ca 0.00 0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 2q2l n GLY 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q2l s VAL 14 N -3.31 5.08 0.26 1.61 1.01 -1.26 -4.52 120.40 119.28 2q2l s VAL 14 Ca -0.01 1.21 0.05 0.00 0.00 0.00 0.00 61.98 63.23 2q2l s VAL 14 Cb 0.04 -3.94 -0.06 0.00 0.00 0.00 0.00 36.38 32.42 2q2l s VAL 14 CO 0.11 0.23 -0.03 0.00 0.00 0.00 0.00 175.10 175.42 2q2l s ALA 15 N 1.10 2.13 0.00 5.51 0.00 -0.55 -4.11 121.76 125.84 2q2l s ALA 15 Ca 0.31 -1.86 0.00 0.00 0.00 0.00 0.00 51.96 50.41 2q2l s ALA 15 Cb -0.16 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.29 2q2l s ALA 15 CO 0.13 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.14 2q2l n GLY 16 N -0.52 2.15 2.98 0.00 0.00 -1.26 -2.21 105.19 106.32 2q2l n GLY 16 Ca -0.05 -1.71 -0.11 0.00 0.00 0.00 0.00 46.02 44.15 2q2l n GLY 16 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2q2l s THR 17 N -1.68 0.20 -0.05 2.61 -1.32 -0.77 -1.22 115.64 113.41 2q2l s THR 17 Ca 0.00 -0.73 -0.01 0.00 -1.21 0.00 0.00 61.69 59.75 2q2l s THR 17 Cb 0.00 -0.29 0.03 0.00 -1.51 0.00 0.00 72.50 70.72 2q2l s THR 17 CO 0.00 -0.34 0.00 -0.63 -2.21 0.00 0.00 174.62 171.44 2q2l s ILE 18 N -1.08 0.29 -0.09 5.08 1.01 -0.52 -2.28 121.20 123.61 2q2l s ILE 18 Ca -0.11 0.11 -0.02 0.00 0.00 0.00 0.00 60.65 60.64 2q2l s ILE 18 Cb -0.08 -0.42 -0.03 0.00 0.01 0.00 0.00 42.46 41.94 2q2l s ILE 18 CO -0.00 0.21 -0.01 -0.76 0.00 0.00 0.00 174.94 174.37 2q2l s LEU 19 N 1.58 3.48 0.07 2.97 1.43 -0.06 -0.31 118.68 127.84 2q2l s LEU 19 Ca -0.01 0.09 0.09 0.00 -1.03 0.00 0.00 54.13 53.27 2q2l s LEU 19 Cb -0.13 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 2q2l s LEU 19 CO -0.03 0.35 -0.25 -0.36 0.23 0.00 0.00 176.35 176.29 2q2l s PHE 20 N -0.73 2.37 -0.09 0.29 0.40 0.30 -1.27 117.98 119.24 2q2l s PHE 20 Ca 0.11 -0.37 -0.04 0.00 -0.60 0.00 0.00 56.93 56.04 2q2l s PHE 20 Cb -0.11 -1.36 0.05 0.00 0.51 0.00 0.00 43.02 42.11 2q2l s PHE 20 CO 0.02 0.22 0.18 0.99 0.70 0.00 0.00 175.22 177.34 2q2l s THR 21 N -0.92 -0.24 -0.13 0.64 2.01 -0.84 -1.09 115.64 115.07 2q2l s THR 21 Ca 0.13 0.30 -0.02 0.00 0.31 0.00 0.00 61.69 62.41 2q2l s THR 21 Cb -0.10 -0.32 0.04 0.00 0.01 0.00 0.00 72.50 72.14 2q2l s THR 21 CO 0.04 0.13 0.03 -1.58 -0.69 0.00 0.00 174.62 172.55 2q2l s GLN 22 N 2.06 0.51 -0.29 4.92 0.74 -0.29 -0.96 119.66 126.36 2q2l s GLN 22 Ca -0.00 -0.11 -0.14 0.00 0.05 0.00 0.00 55.36 55.16 2q2l s GLN 22 Cb -0.12 -1.51 -0.04 0.00 1.10 0.00 0.00 33.01 32.44 2q2l s GLN 22 CO -0.06 -0.49 0.31 -1.21 -0.55 0.00 0.00 175.29 173.29 2q2l s GLU 23 N 1.96 3.91 7.58 1.67 2.02 -1.26 -0.91 118.70 133.66 2q2l s GLU 23 Ca 0.02 -0.17 0.00 0.00 0.02 0.00 0.00 54.97 54.85 2q2l s GLU 23 Cb -0.15 -3.69 0.00 0.00 0.10 0.00 0.00 34.13 30.40 2q2l s GLU 23 CO -0.07 -0.29 0.00 0.41 0.02 0.00 0.00 175.26 175.33 2q2l n GLY 24 N 4.86 4.04 2.46 -1.39 0.00 -1.26 -1.43 105.19 112.46 2q2l n GLY 24 Ca -0.10 0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 2q2l n GLY 24 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2q2l n ASP 25 N 7.26 4.35 -2.25 1.61 5.68 -1.26 -4.94 116.55 127.00 2q2l n ASP 25 Ca 0.00 -3.59 0.00 0.00 -0.50 0.00 0.00 54.79 50.70 2q2l n ASP 25 Cb 0.00 -0.46 0.00 0.00 -1.14 0.00 0.00 41.12 39.52 2q2l n ASP 25 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2q2l n GLY 26 N -0.46 -1.57 3.82 6.12 0.00 -0.51 -5.04 105.19 107.55 2q2l n GLY 26 Ca 0.36 -1.59 -0.30 0.00 0.00 0.00 0.00 46.02 44.49 2q2l n GLY 26 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2q2l s PRO 27 N -2.78 2.58 0.06 1.61 0.04 -1.26 -4.78 135.00 130.48 2q2l s PRO 27 Ca 0.00 0.78 -0.21 0.00 0.04 0.00 0.00 61.00 61.61 2q2l s PRO 27 Cb 0.00 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.51 2q2l s PRO 27 CO 0.00 -1.31 0.63 -0.08 0.04 0.00 0.00 177.00 176.29 2q2l s THR 28 N -3.12 4.73 -0.27 1.26 -1.32 0.36 -4.45 115.64 112.83 2q2l s THR 28 Ca 0.59 1.35 -0.10 0.00 -1.21 0.00 0.00 61.69 62.32 2q2l s THR 28 Cb -0.14 -3.97 -0.05 0.00 -1.51 0.00 0.00 72.50 66.83 2q2l s THR 28 CO 0.54 0.49 0.16 -0.89 -2.21 0.00 0.00 174.62 172.72 2q2l s THR 29 N -0.72 5.10 -0.26 5.08 2.01 -0.14 -1.33 115.64 125.38 2q2l s THR 29 Ca 0.32 0.10 -0.06 0.00 0.31 0.00 0.00 61.69 62.35 2q2l s THR 29 Cb -0.20 -3.42 -0.01 0.00 0.01 0.00 0.00 72.50 68.89 2q2l s THR 29 CO 0.20 0.27 0.04 0.54 -0.69 0.00 0.00 174.62 174.99 2q2l s VAL 30 N 1.69 3.89 -0.13 3.82 0.11 0.12 -1.98 120.40 127.92 2q2l s VAL 30 Ca 0.07 -0.51 -0.01 0.00 -2.93 0.00 0.00 61.98 58.60 2q2l s VAL 30 Cb -0.16 -2.90 -0.02 0.00 -1.53 0.00 0.00 36.38 31.78 2q2l s VAL 30 CO 0.09 0.24 -0.11 0.42 -3.33 0.00 0.00 175.10 172.41 2q2l s THR 31 N 1.52 3.21 0.13 5.04 -4.23 -0.40 -0.83 115.64 120.08 2q2l s THR 31 Ca 0.04 -0.61 0.07 0.00 -1.18 0.00 0.00 61.69 60.02 2q2l s THR 31 Cb -0.16 -2.36 -0.04 0.00 1.34 0.00 0.00 72.50 71.28 2q2l s THR 31 CO 0.01 0.52 -0.17 -0.83 -0.54 0.00 0.00 174.62 173.61 2q2l s GLY 32 N 0.34 1.21 -0.28 3.99 0.00 -0.64 -0.88 107.32 111.07 2q2l s GLY 32 Ca -0.10 -1.33 -0.03 0.00 0.00 0.00 0.00 44.72 43.26 2q2l s GLY 32 CO 0.05 -1.37 0.54 0.21 0.00 0.00 0.00 173.10 172.53 2q2l s ASN 33 N -2.34 -0.86 0.06 1.64 3.84 -0.97 -1.90 114.94 114.41 2q2l s ASN 33 Ca 0.10 0.86 -0.08 0.00 0.21 0.00 0.00 52.86 53.94 2q2l s ASN 33 Cb -0.07 1.87 -0.00 0.00 -0.55 0.00 0.00 41.25 42.50 2q2l s ASN 33 CO 0.05 -0.26 0.17 0.27 -2.79 0.00 0.00 177.10 174.53 2q2l s ILE 34 N 2.77 0.13 0.09 -5.21 -4.36 0.28 -1.85 121.20 113.06 2q2l s ILE 34 Ca 0.12 -1.10 -0.17 0.00 -0.26 0.00 0.00 60.65 59.25 2q2l s ILE 34 Cb -0.14 -1.14 0.03 0.00 1.25 0.00 0.00 42.46 42.46 2q2l s ILE 34 CO -0.19 -0.61 0.40 -0.94 0.24 0.00 0.00 174.94 173.84 2q2l s SER 35 N -2.49 -0.24 0.00 4.36 1.04 -0.94 -1.38 113.70 114.05 2q2l s SER 35 Ca 0.00 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2q2l s SER 35 Cb 0.02 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.59 2q2l s SER 35 CO -0.08 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 173.97 2q2l n GLY 36 N 0.04 0.73 3.54 7.32 0.00 -0.72 -1.48 105.19 114.62 2q2l n GLY 36 Ca -0.17 -0.47 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 2q2l n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q2l s LEU 37 N 0.00 2.94 0.13 0.99 1.43 -0.86 -4.20 118.68 119.11 2q2l s LEU 37 Ca 0.00 -0.30 -0.34 0.00 -1.03 0.00 0.00 54.13 52.46 2q2l s LEU 37 Cb 0.00 -1.72 -0.14 0.00 0.03 0.00 0.00 46.19 44.36 2q2l s LEU 37 CO 0.00 0.25 1.56 1.17 0.23 0.00 0.00 176.35 179.56 2q2l n LYS 38 N 1.35 1.99 -1.12 1.70 4.81 -1.26 -4.00 118.16 121.62 2q2l n LYS 38 Ca -0.15 0.72 -0.36 0.00 -0.87 0.00 0.00 58.31 57.65 2q2l n LYS 38 Cb 0.52 -2.47 0.07 0.00 0.02 0.00 0.00 35.03 33.17 2q2l n LYS 38 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2q2l n PRO 39 N 3.52 0.10 0.00 1.64 -0.02 -1.26 -4.76 135.00 134.22 2q2l n PRO 39 Ca 0.18 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 2q2l n PRO 39 Cb 0.27 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2q2l n PRO 39 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q2l n GLY 40 N 2.00 -0.15 3.74 -1.23 0.00 0.01 -4.91 105.19 104.64 2q2l n GLY 40 Ca 0.07 -2.12 -0.35 0.00 0.00 0.00 0.00 46.02 43.62 2q2l n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q2l s LEU 41 N 0.00 4.08 -0.07 0.99 1.43 -1.26 0.16 118.68 124.02 2q2l s LEU 41 Ca 0.00 0.24 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 2q2l s LEU 41 Cb 0.00 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 44.21 2q2l s LEU 41 CO 0.00 0.26 -0.13 -1.00 0.23 0.00 0.00 176.35 175.70 2q2l s HIS 42 N -0.12 1.55 0.38 0.29 3.76 -0.56 -2.51 115.29 118.06 2q2l s HIS 42 Ca 0.09 -0.56 -0.25 0.00 -0.15 0.00 0.00 55.06 54.18 2q2l s HIS 42 Cb -0.12 -1.11 -0.12 0.00 1.11 0.00 0.00 32.58 32.34 2q2l s HIS 42 CO 0.01 -0.27 0.95 0.41 -0.85 0.00 0.00 174.74 174.98 2q2l n GLY 43 N 3.73 -0.40 2.71 -2.22 0.00 -0.33 -0.85 105.19 107.83 2q2l n GLY 43 Ca -0.22 0.19 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 2q2l n GLY 43 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2q2l s PHE 44 N -1.23 0.02 0.04 1.61 5.36 0.16 -2.20 117.98 121.75 2q2l s PHE 44 Ca 0.62 0.28 -0.07 0.00 -0.96 0.00 0.00 56.93 56.80 2q2l s PHE 44 Cb -0.61 -0.41 -0.01 0.00 -0.34 0.00 0.00 43.02 41.65 2q2l s PHE 44 CO 0.58 -0.18 0.13 -1.01 -1.46 0.00 0.00 175.22 173.28 2q2l s HIS 45 N 1.99 0.15 -0.41 10.12 3.76 -1.06 -1.46 115.29 128.38 2q2l s HIS 45 Ca 0.02 -0.43 -0.19 0.00 -0.15 0.00 0.00 55.06 54.31 2q2l s HIS 45 Cb -0.12 -0.10 0.02 0.00 1.11 0.00 0.00 32.58 33.48 2q2l s HIS 45 CO -0.03 -0.39 0.57 0.08 -0.85 0.00 0.00 174.74 174.11 2q2l s VAL 46 N -2.63 4.93 0.86 -0.90 1.01 0.73 -1.63 120.40 122.76 2q2l s VAL 46 Ca -0.05 0.08 -0.13 0.00 0.00 0.00 0.00 61.98 61.89 2q2l s VAL 46 Cb -0.01 -4.11 0.11 0.00 0.00 0.00 0.00 36.38 32.37 2q2l s VAL 46 CO -0.05 -0.46 1.18 -1.00 0.00 0.00 0.00 175.10 174.77 2q2l s HIS 47 N 2.57 2.66 0.08 5.22 3.76 0.10 0.20 115.29 129.88 2q2l s HIS 47 Ca 0.19 0.73 -0.03 0.00 -0.15 0.00 0.00 55.06 55.81 2q2l s HIS 47 Cb -0.15 -3.53 -0.26 0.00 1.11 0.00 0.00 32.58 29.74 2q2l s HIS 47 CO 0.16 -2.06 1.17 0.00 -0.85 0.00 0.00 174.74 173.16 2q2l h ALA 48 N -1.26 0.14 -1.82 -1.40 0.00 -0.08 -3.35 119.26 111.50 2q2l h ALA 48 Ca -0.47 -0.88 -0.59 0.00 0.00 0.00 0.00 54.91 52.97 2q2l h ALA 48 Cb 1.32 -0.02 -0.13 0.00 0.00 0.00 0.00 17.79 18.96 2q2l h ALA 48 CO 0.62 1.01 -0.63 -0.51 0.00 0.00 0.00 179.25 179.74 2q2l s LEU 49 N -7.10 2.71 -0.15 0.00 1.43 -0.75 -4.86 118.68 109.96 2q2l s LEU 49 Ca -0.03 -1.31 0.16 0.00 -1.03 0.00 0.00 54.13 51.91 2q2l s LEU 49 Cb 0.08 -0.82 0.43 0.00 0.03 0.00 0.00 46.19 45.90 2q2l s LEU 49 CO 0.87 -0.41 1.20 0.61 0.23 0.00 0.00 176.35 178.86 2q2l n GLY 50 N -0.85 3.81 3.63 -3.19 0.00 -1.18 -1.45 105.19 105.95 2q2l n GLY 50 Ca -0.05 -1.21 -0.43 0.00 0.00 0.00 0.00 46.02 44.34 2q2l n GLY 50 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2q2l s ASP 51 N -2.87 6.84 -0.01 1.61 -1.08 -1.26 -4.90 116.67 115.01 2q2l s ASP 51 Ca 0.37 1.05 0.03 0.00 -0.52 0.00 0.00 52.55 53.48 2q2l s ASP 51 Cb 0.38 -2.54 0.07 0.00 -1.46 0.00 0.00 42.92 39.37 2q2l s ASP 51 CO -0.10 -0.96 1.06 0.41 0.52 0.00 0.00 175.17 176.10 2q2l n THR 52 N 6.03 1.04 0.25 1.71 -1.04 -1.26 -2.71 114.28 118.29 2q2l n THR 52 Ca 0.13 -1.05 0.08 0.00 -2.04 0.00 0.00 64.05 61.17 2q2l n THR 52 Cb 0.47 0.47 0.61 0.00 -1.82 0.00 0.00 70.33 70.06 2q2l n THR 52 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 2q2l h THR 53 N 0.41 0.96 -1.16 12.58 1.35 -1.93 0.67 112.91 125.78 2q2l h THR 53 Ca 0.00 -0.41 -0.61 0.00 -0.55 0.00 0.00 66.41 64.83 2q2l h THR 53 Cb 0.57 1.23 -0.38 0.00 -1.73 0.00 0.00 68.15 67.84 2q2l h THR 53 CO 0.00 0.11 -0.24 -3.20 -0.25 0.00 0.00 175.52 171.95 2q2l n ASN 54 N -4.22 5.72 0.00 5.36 4.05 -1.26 -5.07 115.26 119.85 2q2l n ASN 54 Ca -0.03 -3.76 0.00 0.00 0.45 0.00 0.00 54.58 51.24 2q2l n ASN 54 Cb 0.19 -0.58 0.00 0.00 1.23 0.00 0.00 39.78 40.62 2q2l n ASN 54 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2q2l n GLY 55 N -0.67 3.32 0.14 8.20 0.00 0.23 -2.78 105.19 113.64 2q2l n GLY 55 Ca 0.47 -0.19 0.02 0.00 0.00 0.00 0.00 46.02 46.32 2q2l n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q2l h MET 57 N 0.00 0.26 0.00 0.00 2.07 -1.85 -2.56 114.93 112.85 2q2l h MET 57 Ca -0.01 -0.02 0.00 0.00 -2.07 0.00 0.00 59.70 57.61 2q2l h MET 57 Cb 1.22 -0.06 0.00 0.00 -1.87 0.00 0.00 31.60 30.89 2q2l h MET 57 CO 0.07 0.17 0.00 -1.13 1.07 0.00 0.00 176.91 177.09 2q2l n SER 58 N -5.14 0.00 -0.07 1.22 3.41 -1.23 -3.91 113.62 107.90 2q2l n SER 58 Ca 0.11 -0.66 0.00 0.00 -0.26 0.00 0.00 58.87 58.06 2q2l n SER 58 Cb 0.37 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2q2l n SER 58 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2q2l n THR 59 N -1.06 0.00 -4.77 6.66 -2.24 -0.96 -4.38 114.28 107.52 2q2l n THR 59 Ca 0.18 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 2q2l n THR 59 Cb 0.12 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 2q2l n THR 59 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q2l n GLY 60 N 0.44 -0.81 0.00 3.38 0.00 -1.25 -1.82 105.19 105.13 2q2l n GLY 60 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.97 2q2l n GLY 60 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2q2l n PRO 61 N -1.18 1.34 -2.02 1.61 -0.04 -1.26 -4.58 135.00 128.87 2q2l n PRO 61 Ca 0.00 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.06 2q2l n PRO 61 Cb 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.45 2q2l n PRO 61 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2q2l s HIS 62 N 0.59 2.85 -0.27 0.54 3.76 -1.26 0.29 115.29 121.79 2q2l s HIS 62 Ca 0.00 1.36 -0.31 0.00 -0.15 0.00 0.00 55.06 55.97 2q2l s HIS 62 Cb 0.00 -3.75 -0.07 0.00 1.11 0.00 0.00 32.58 29.87 2q2l s HIS 62 CO 0.00 -2.19 2.21 0.34 -0.85 0.00 0.00 174.74 174.25 2q2l n PHE 63 N 0.43 1.82 -3.21 1.40 7.35 0.13 -4.48 117.46 120.89 2q2l n PHE 63 Ca 0.02 0.03 -0.24 0.00 -0.76 0.00 0.00 57.45 56.50 2q2l n PHE 63 Cb 0.42 -2.65 -0.06 0.00 0.35 0.00 0.00 39.48 37.54 2q2l n PHE 63 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2q2l n ASN 64 N 11.01 2.00 -0.02 -2.13 5.15 -1.26 -0.70 115.26 129.32 2q2l n ASN 64 Ca 0.34 -3.13 0.03 0.00 -0.60 0.00 0.00 54.58 51.22 2q2l n ASN 64 Cb 0.36 -0.63 0.39 0.00 -0.53 0.00 0.00 39.78 39.37 2q2l n ASN 64 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2q2l h PRO 65 N 3.66 0.58 -0.00 1.20 0.13 -1.99 -2.55 132.00 133.03 2q2l h PRO 65 Ca 0.12 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2q2l h PRO 65 Cb 0.78 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.78 2q2l h PRO 65 CO 0.63 0.41 -0.00 0.00 -0.23 0.00 0.00 178.00 178.81 2q2l n ALA 66 N -2.47 2.66 -3.61 -0.56 0.00 -1.26 -4.92 120.51 110.35 2q2l n ALA 66 Ca 0.03 -0.21 -0.26 0.00 0.00 0.00 0.00 53.44 53.00 2q2l n ALA 66 Cb 0.09 -1.49 0.05 0.00 0.00 0.00 0.00 19.45 18.09 2q2l n ALA 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q2l n GLY 67 N 1.05 -0.52 4.02 0.00 0.00 -0.96 -5.01 105.19 103.77 2q2l n GLY 67 Ca 0.22 0.20 -0.19 0.00 0.00 0.00 0.00 46.02 46.26 2q2l n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q2l s LYS 68 N -6.32 2.43 0.61 1.61 -0.14 -1.26 -5.13 119.74 111.56 2q2l s LYS 68 Ca 0.56 -1.56 -0.06 0.00 -1.36 0.00 0.00 55.97 53.56 2q2l s LYS 68 Cb -0.27 -2.65 0.02 0.00 -1.68 0.00 0.00 37.83 33.26 2q2l s LYS 68 CO 0.69 -0.70 0.92 -1.21 -0.76 0.00 0.00 175.35 174.30 2q2l s GLU 69 N -4.57 2.73 0.37 1.68 2.02 -1.26 -4.75 118.70 114.92 2q2l s GLU 69 Ca 0.59 -0.10 -0.27 0.00 0.02 0.00 0.00 54.97 55.21 2q2l s GLU 69 Cb -0.07 -2.26 -0.09 0.00 0.10 0.00 0.00 34.13 31.81 2q2l s GLU 69 CO 0.37 -0.83 1.23 -1.58 0.02 0.00 0.00 175.26 174.47 2q2l s HIS 70 N -3.04 3.06 0.03 1.61 5.65 0.10 -1.80 115.29 120.89 2q2l s HIS 70 Ca 0.55 1.50 -0.01 0.00 0.25 0.00 0.00 55.06 57.36 2q2l s HIS 70 Cb -0.11 -3.53 0.00 0.00 -1.18 0.00 0.00 32.58 27.76 2q2l s HIS 70 CO 0.45 -1.57 0.04 0.41 -0.65 0.00 0.00 174.74 173.42 2q2l n GLY 71 N 0.76 2.60 3.94 1.59 0.00 -1.22 -4.53 105.19 108.33 2q2l n GLY 71 Ca 0.02 -1.24 -0.24 0.00 0.00 0.00 0.00 46.02 44.56 2q2l n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2q2l s SER 72 N -1.15 5.97 0.67 1.61 1.04 -1.25 -4.72 113.70 115.88 2q2l s SER 72 Ca 0.02 0.45 0.44 0.00 0.48 0.00 0.00 55.95 57.34 2q2l s SER 72 Cb -0.00 -1.76 2.42 0.00 0.10 0.00 0.00 66.02 66.78 2q2l s SER 72 CO 0.01 -0.62 2.36 1.55 0.98 0.00 0.00 173.24 177.52 2q2l h PRO 73 N 0.40 0.00 0.00 4.02 0.13 -1.88 -1.35 132.00 133.33 2q2l h PRO 73 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2q2l h PRO 73 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2q2l h PRO 73 CO 0.59 0.00 -0.40 -1.91 -0.23 0.00 0.00 178.00 176.05 2q2l n GLU 74 N -3.08 0.15 -2.96 0.86 4.07 -1.26 -4.89 120.64 113.52 2q2l n GLU 74 Ca -0.03 0.06 -0.33 0.00 -0.06 0.00 0.00 57.16 56.80 2q2l n GLU 74 Cb 0.08 -1.61 -0.07 0.00 -0.06 0.00 0.00 31.44 29.78 2q2l n GLU 74 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2q2l s ASP 75 N -3.66 6.86 0.18 4.31 1.01 -0.51 -4.96 116.67 119.90 2q2l s ASP 75 Ca 0.10 1.50 0.01 0.00 0.71 0.00 0.00 52.55 54.87 2q2l s ASP 75 Cb 0.16 -2.46 0.08 0.00 1.01 0.00 0.00 42.92 41.70 2q2l s ASP 75 CO 0.66 -0.29 1.44 -0.08 0.21 0.00 0.00 175.17 177.11 2q2l h GLU 76 N 2.06 0.29 -6.15 8.23 4.81 -1.90 -3.41 114.58 118.51 2q2l h GLU 76 Ca -0.48 -0.25 -0.59 0.00 -0.13 0.00 0.00 59.36 57.90 2q2l h GLU 76 Cb 1.18 0.06 -0.09 0.00 0.63 0.00 0.00 28.75 30.53 2q2l h GLU 76 CO 0.63 0.92 0.64 0.99 -0.73 0.00 0.00 179.01 181.46 2q2l s THR 77 N -3.48 4.55 0.00 0.32 2.01 -1.26 -4.96 115.64 112.81 2q2l s THR 77 Ca -0.04 1.19 0.00 0.00 0.31 0.00 0.00 61.69 63.15 2q2l s THR 77 Cb 0.11 -4.36 0.00 0.00 0.01 0.00 0.00 72.50 68.25 2q2l s THR 77 CO 0.83 -0.59 0.00 -1.14 -0.69 0.00 0.00 174.62 173.03 2q2l n ARG 78 N 6.88 0.00 -1.98 4.92 0.63 -0.75 -3.40 116.66 122.97 2q2l n ARG 78 Ca 0.08 0.00 -0.32 0.00 -0.92 0.00 0.00 57.85 56.69 2q2l n ARG 78 Cb 0.48 0.00 0.01 0.00 0.45 0.00 0.00 32.46 33.40 2q2l n ARG 78 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 2q2l s HIS 79 N -0.72 3.35 0.18 -0.14 3.76 -1.15 -4.56 115.29 116.00 2q2l s HIS 79 Ca 0.00 1.41 -0.10 0.00 -0.15 0.00 0.00 55.06 56.22 2q2l s HIS 79 Cb 0.00 -2.83 0.08 0.00 1.11 0.00 0.00 32.58 30.94 2q2l s HIS 79 CO 0.00 -0.80 1.68 0.00 -0.85 0.00 0.00 174.74 174.77 2q2l h ALA 80 N 0.06 0.84 0.00 -1.40 0.00 -1.58 -2.74 119.26 114.45 2q2l h ALA 80 Ca -0.45 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2q2l h ALA 80 Cb 1.20 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2q2l h ALA 80 CO 0.60 0.58 0.00 0.41 0.00 0.00 0.00 179.25 180.84 2q2l n GLY 81 N -0.59 -0.55 3.53 0.00 0.00 0.13 -4.54 105.19 103.16 2q2l n GLY 81 Ca 0.04 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 2q2l n GLY 81 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2q2l s ASP 82 N -2.05 6.44 0.00 1.61 1.01 -1.03 -0.20 116.67 122.45 2q2l s ASP 82 Ca 0.24 -1.36 0.22 0.00 0.71 0.00 0.00 52.55 52.36 2q2l s ASP 82 Cb 0.11 -2.52 0.52 0.00 1.01 0.00 0.00 42.92 42.05 2q2l s ASP 82 CO 0.20 -1.47 1.44 0.18 0.21 0.00 0.00 175.17 175.73 2q2l n LEU 83 N 8.38 2.87 0.00 1.23 4.32 -0.53 -3.37 117.00 129.90 2q2l n LEU 83 Ca 0.23 -1.24 0.00 0.00 -0.02 0.00 0.00 56.01 54.98 2q2l n LEU 83 Cb 0.50 -0.21 0.00 0.00 -1.62 0.00 0.00 43.42 42.09 2q2l n LEU 83 CO 0.63 0.62 0.00 0.61 -1.22 0.00 0.00 177.39 178.03 2q2l n GLY 84 N 1.38 0.32 3.52 -0.72 0.00 -1.07 -4.78 105.19 103.84 2q2l n GLY 84 Ca 0.18 -0.87 -0.30 0.00 0.00 0.00 0.00 46.02 45.03 2q2l n GLY 84 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2q2l s ASN 85 N -4.00 4.09 0.07 1.61 -0.87 -1.26 0.37 114.94 114.95 2q2l s ASN 85 Ca 0.00 -0.43 0.06 0.00 -1.57 0.00 0.00 52.86 50.92 2q2l s ASN 85 Cb 0.00 -0.71 -0.04 0.00 -0.02 0.00 0.00 41.25 40.48 2q2l s ASN 85 CO 0.00 0.21 -0.09 0.27 -2.57 0.00 0.00 177.10 174.92 2q2l s ILE 86 N -1.09 3.44 -0.36 0.60 -4.36 -0.03 -4.91 121.20 114.49 2q2l s ILE 86 Ca 0.18 -1.11 -0.13 0.00 -0.26 0.00 0.00 60.65 59.33 2q2l s ILE 86 Cb -0.11 -2.57 -0.01 0.00 1.25 0.00 0.00 42.46 41.03 2q2l s ILE 86 CO 0.10 0.21 0.26 -0.89 0.24 0.00 0.00 174.94 174.85 2q2l s THR 87 N -1.14 5.28 -0.11 8.37 2.01 -1.26 -1.50 115.64 127.28 2q2l s THR 87 Ca 0.20 -0.34 -0.22 0.00 0.31 0.00 0.00 61.69 61.64 2q2l s THR 87 Cb -0.11 -3.78 -0.03 0.00 0.01 0.00 0.00 72.50 68.59 2q2l s THR 87 CO 0.12 -0.10 0.65 -0.69 -0.69 0.00 0.00 174.62 173.91 2q2l s VAL 88 N 1.71 5.06 0.82 3.82 1.01 0.43 -4.62 120.40 128.63 2q2l s VAL 88 Ca 0.06 1.30 -0.11 0.00 0.00 0.00 0.00 61.98 63.23 2q2l s VAL 88 Cb -0.18 -3.98 0.11 0.00 0.00 0.00 0.00 36.38 32.33 2q2l s VAL 88 CO 0.10 0.22 1.16 -0.83 0.00 0.00 0.00 175.10 175.75 2q2l s GLY 89 N 0.87 1.69 0.44 4.51 0.00 0.13 -0.81 107.32 114.16 2q2l s GLY 89 Ca 0.33 -0.99 0.19 0.00 0.00 0.00 0.00 44.72 44.26 2q2l s GLY 89 CO 0.14 -0.43 1.89 -0.55 0.00 0.00 0.00 173.10 174.16 2q2l h ASP 90 N -1.06 0.32 -0.07 1.64 5.19 -1.97 -0.55 116.42 119.92 2q2l h ASP 90 Ca -0.44 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 2q2l h ASP 90 Cb 1.29 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.77 2q2l h ASP 90 CO 0.54 0.14 0.00 -0.90 -3.12 0.00 0.00 179.24 175.90 2q2l n ASP 91 N -4.46 0.65 0.00 6.45 5.68 -1.26 -4.77 116.55 118.84 2q2l n ASP 91 Ca 0.17 -1.57 0.00 0.00 -0.50 0.00 0.00 54.79 52.89 2q2l n ASP 91 Cb 0.66 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.59 2q2l n ASP 91 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2q2l n GLY 92 N 0.91 0.70 3.41 6.12 0.00 -0.22 -4.77 105.19 111.34 2q2l n GLY 92 Ca 0.14 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 2q2l n GLY 92 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q2l s THR 93 N -2.00 2.63 0.04 2.61 2.01 -1.24 -1.76 115.64 117.92 2q2l s THR 93 Ca 0.00 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 61.11 2q2l s THR 93 Cb 0.00 -1.99 -0.02 0.00 0.01 0.00 0.00 72.50 70.49 2q2l s THR 93 CO 0.00 0.57 -0.08 0.00 -0.69 0.00 0.00 174.62 174.42 2q2l s ALA 94 N -0.70 0.60 -0.33 7.40 0.00 -0.48 0.20 121.76 128.45 2q2l s ALA 94 Ca 0.11 -0.69 0.04 0.00 0.00 0.00 0.00 51.96 51.42 2q2l s ALA 94 Cb -0.10 0.00 0.16 0.00 0.00 0.00 0.00 23.12 23.18 2q2l s ALA 94 CO 0.00 0.02 0.45 0.00 0.00 0.00 0.00 175.76 176.23 2q2l s PHE 96 N 2.13 1.89 -0.12 0.00 -0.71 -0.80 -4.97 117.98 115.40 2q2l s PHE 96 Ca 0.13 -1.08 -0.05 0.00 -1.04 0.00 0.00 56.93 54.88 2q2l s PHE 96 Cb -0.12 -1.25 0.06 0.00 -1.21 0.00 0.00 43.02 40.50 2q2l s PHE 96 CO -0.19 -0.10 0.26 0.99 -1.34 0.00 0.00 175.22 174.85 2q2l s THR 97 N -3.25 -0.30 -0.08 -4.49 2.01 -1.26 -1.61 115.64 106.66 2q2l s THR 97 Ca 0.30 0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.57 2q2l s THR 97 Cb 0.06 -0.43 0.01 0.00 0.01 0.00 0.00 72.50 72.15 2q2l s THR 97 CO 0.14 0.10 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.36 2q2l s ILE 98 N 2.07 1.60 -0.22 1.82 1.01 -0.01 -4.98 121.20 122.49 2q2l s ILE 98 Ca -0.02 -0.75 -0.07 0.00 0.00 0.00 0.00 60.65 59.81 2q2l s ILE 98 Cb -0.11 -1.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 2q2l s ILE 98 CO -0.09 0.46 0.05 -0.69 0.00 0.00 0.00 174.94 174.67 2q2l s VAL 99 N 0.51 4.31 0.06 2.92 1.01 -1.26 0.16 120.40 128.12 2q2l s VAL 99 Ca -0.17 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 61.64 2q2l s VAL 99 Cb -0.17 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 2q2l s VAL 99 CO 0.06 0.38 -0.05 -0.62 0.00 0.00 0.00 175.10 174.88 2q2l s ASP 100 N 1.23 0.69 -0.01 3.32 2.15 -0.44 -4.99 116.67 118.62 2q2l s ASP 100 Ca 0.04 -0.85 0.16 0.00 0.43 0.00 0.00 52.55 52.33 2q2l s ASP 100 Cb -0.14 0.13 -0.19 0.00 -0.30 0.00 0.00 42.92 42.41 2q2l s ASP 100 CO 0.03 -0.45 0.57 0.29 -0.17 0.00 0.00 175.17 175.44 2q2l n LYS 101 N 0.52 1.45 -0.15 4.34 5.02 -1.26 -0.49 118.16 127.59 2q2l n LYS 101 Ca -0.16 -0.04 0.06 0.00 -2.02 0.00 0.00 58.31 56.15 2q2l n LYS 101 Cb 0.59 -1.28 0.14 0.00 -0.02 0.00 0.00 35.03 34.46 2q2l n LYS 101 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2q2l n GLN 102 N -1.57 2.26 -3.05 1.97 6.02 -1.26 -4.73 117.38 117.01 2q2l n GLN 102 Ca 0.01 -1.89 -0.26 0.00 -0.01 0.00 0.00 57.00 54.85 2q2l n GLN 102 Cb 0.29 -1.29 -0.05 0.00 1.02 0.00 0.00 30.24 30.21 2q2l n GLN 102 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 2q2l n ILE 103 N 0.70 2.46 -1.43 5.09 -5.35 -1.26 -4.78 119.36 114.79 2q2l n ILE 103 Ca 0.12 -5.37 -0.35 0.00 -0.27 0.00 0.00 62.75 56.88 2q2l n ILE 103 Cb 0.42 -1.37 0.10 0.00 -1.74 0.00 0.00 39.64 37.05 2q2l n ILE 103 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2q2l s PRO 104 N -3.14 2.10 0.01 6.28 0.04 -1.26 -4.64 135.00 134.39 2q2l s PRO 104 Ca 0.46 1.86 0.22 0.00 0.04 0.00 0.00 61.00 63.58 2q2l s PRO 104 Cb 0.27 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.96 2q2l s PRO 104 CO -0.11 -1.89 1.01 1.28 0.04 0.00 0.00 177.00 177.33 2q2l n LEU 105 N -2.65 0.77 -4.26 -3.56 4.32 -1.26 -1.44 117.00 108.91 2q2l n LEU 105 Ca 0.14 -0.28 -0.18 0.00 -0.02 0.00 0.00 56.01 55.67 2q2l n LEU 105 Cb 0.50 -0.07 -0.11 0.00 -1.62 0.00 0.00 43.42 42.12 2q2l n LEU 105 CO 0.47 0.17 -0.45 0.42 -1.22 0.00 0.00 177.39 176.79 2q2l s THR 106 N -3.06 1.40 0.00 -5.08 -4.23 -1.26 -4.65 115.64 98.75 2q2l s THR 106 Ca 0.07 -1.79 0.00 0.00 -1.18 0.00 0.00 61.69 58.79 2q2l s THR 106 Cb 0.16 -1.61 0.00 0.00 1.34 0.00 0.00 72.50 72.39 2q2l s THR 106 CO 0.82 -0.43 0.00 0.61 -0.54 0.00 0.00 174.62 175.08 2q2l n GLY 107 N 0.41 -1.81 0.18 3.99 0.00 -1.26 -4.12 105.19 102.59 2q2l n GLY 107 Ca -0.14 -1.69 0.06 0.00 0.00 0.00 0.00 46.02 44.24 2q2l n GLY 107 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2q2l h PRO 108 N 0.00 0.00 -0.61 1.61 0.14 -1.99 -2.30 132.00 128.85 2q2l h PRO 108 Ca 0.00 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.14 2q2l h PRO 108 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.14 2q2l h PRO 108 CO 0.00 0.37 0.00 0.72 0.14 0.00 0.00 178.00 179.23 2q2l n HIS 109 N -3.42 1.06 -1.61 1.56 8.25 -1.26 -5.03 115.22 114.76 2q2l n HIS 109 Ca 0.00 -0.45 -0.47 0.00 -0.26 0.00 0.00 57.72 56.55 2q2l n HIS 109 Cb 0.55 -0.13 -0.03 0.00 1.12 0.00 0.00 29.99 31.49 2q2l n HIS 109 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2q2l n SER 110 N 0.99 1.84 -0.51 0.41 2.88 -0.87 -4.43 113.62 113.94 2q2l n SER 110 Ca 0.20 1.15 0.13 0.00 -1.33 0.00 0.00 58.87 59.02 2q2l n SER 110 Cb 0.65 -1.31 0.32 0.00 -0.75 0.00 0.00 64.21 63.13 2q2l n SER 110 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2q2l n ILE 111 N 1.37 0.00 -1.86 2.46 -5.35 -0.52 -4.89 119.36 110.57 2q2l n ILE 111 Ca 0.13 -0.27 -0.42 0.00 -0.27 0.00 0.00 62.75 61.92 2q2l n ILE 111 Cb 0.28 0.79 -0.03 0.00 -1.74 0.00 0.00 39.64 38.94 2q2l n ILE 111 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2q2l s ILE 112 N -2.21 2.88 0.00 7.28 -1.09 -1.26 -1.90 121.20 124.90 2q2l s ILE 112 Ca 0.29 0.36 0.00 0.00 -2.23 0.00 0.00 60.65 59.07 2q2l s ILE 112 Cb 0.20 -3.23 0.00 0.00 -1.58 0.00 0.00 42.46 37.85 2q2l s ILE 112 CO 0.42 -0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.73 2q2l n GLY 113 N 4.06 0.42 3.88 6.18 0.00 0.13 -5.01 105.19 114.86 2q2l n GLY 113 Ca 0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 2q2l n GLY 113 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q2l s ARG 114 N -0.96 2.38 0.07 1.61 0.52 -0.80 -3.13 118.95 118.65 2q2l s ARG 114 Ca 0.00 -1.75 0.06 0.00 -0.52 0.00 0.00 55.73 53.52 2q2l s ARG 114 Cb 0.00 -2.26 -0.04 0.00 0.52 0.00 0.00 34.95 33.18 2q2l s ARG 114 CO 0.00 -0.39 -0.11 0.00 0.02 0.00 0.00 175.30 174.82 2q2l s ALA 115 N -2.61 2.89 0.06 2.13 0.00 -0.53 -0.35 121.76 123.36 2q2l s ALA 115 Ca 0.43 -1.20 -0.08 0.00 0.00 0.00 0.00 51.96 51.12 2q2l s ALA 115 Cb -0.02 -0.90 -0.05 0.00 0.00 0.00 0.00 23.12 22.14 2q2l s ALA 115 CO 0.26 0.62 0.35 0.14 0.00 0.00 0.00 175.76 177.12 2q2l s VAL 116 N -1.12 5.19 -0.04 0.00 -7.23 -1.00 0.01 120.40 116.20 2q2l s VAL 116 Ca 0.19 0.26 0.01 0.00 -1.81 0.00 0.00 61.98 60.63 2q2l s VAL 116 Cb -0.11 -3.61 0.02 0.00 0.56 0.00 0.00 36.38 33.24 2q2l s VAL 116 CO 0.11 0.27 -0.03 -0.69 -0.31 0.00 0.00 175.10 174.45 2q2l s VAL 117 N -1.41 0.43 -0.05 1.32 1.01 -0.65 -2.28 120.40 118.78 2q2l s VAL 117 Ca 0.32 -0.06 -0.08 0.00 0.00 0.00 0.00 61.98 62.16 2q2l s VAL 117 Cb -0.13 -0.48 -0.05 0.00 0.00 0.00 0.00 36.38 35.72 2q2l s VAL 117 CO 0.19 0.20 0.23 0.54 0.00 0.00 0.00 175.10 176.26 2q2l s VAL 118 N 0.97 5.35 0.24 2.92 0.11 -0.18 -2.58 120.40 127.24 2q2l s VAL 118 Ca -0.10 0.30 0.07 0.00 -2.93 0.00 0.00 61.98 59.32 2q2l s VAL 118 Cb -0.14 -3.52 -0.04 0.00 -1.53 0.00 0.00 36.38 31.16 2q2l s VAL 118 CO -0.00 0.52 0.18 -1.00 -3.33 0.00 0.00 175.10 171.47 2q2l s HIS 119 N -1.13 3.10 0.22 1.54 3.76 -0.93 -0.26 115.29 121.58 2q2l s HIS 119 Ca 0.21 -0.10 -0.08 0.00 -0.15 0.00 0.00 55.06 54.94 2q2l s HIS 119 Cb -0.13 -1.41 0.17 0.00 1.11 0.00 0.00 32.58 32.32 2q2l s HIS 119 CO 0.10 0.52 1.80 0.00 -0.85 0.00 0.00 174.74 176.31 2q2l h ALA 120 N 1.61 1.07 -1.22 -1.40 0.00 -0.65 -3.38 119.26 115.30 2q2l h ALA 120 Ca -0.48 -0.18 -0.62 0.00 0.00 0.00 0.00 54.91 53.63 2q2l h ALA 120 Cb 1.23 -0.33 -0.13 0.00 0.00 0.00 0.00 17.79 18.57 2q2l h ALA 120 CO 0.61 0.66 -0.56 -0.51 0.00 0.00 0.00 179.25 179.45 2q2l s ASP 121 N -6.31 3.61 0.43 0.00 1.01 0.47 -4.84 116.67 111.04 2q2l s ASP 121 Ca -0.12 -1.52 -0.26 0.00 0.71 0.00 0.00 52.55 51.36 2q2l s ASP 121 Cb 0.16 0.12 -0.09 0.00 1.01 0.00 0.00 42.92 44.12 2q2l s ASP 121 CO 0.84 -0.69 1.39 -2.65 0.21 0.00 0.00 175.17 174.27 2q2l n PRO 122 N -1.03 2.23 -2.60 8.23 -0.02 -1.05 -1.18 135.00 139.58 2q2l n PRO 122 Ca -0.10 0.79 -0.43 0.00 -2.02 0.00 0.00 63.50 61.74 2q2l n PRO 122 Cb 0.67 -2.56 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 2q2l n PRO 122 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2q2l s ASP 123 N -0.43 7.15 0.53 2.55 3.68 -1.26 -3.82 116.67 125.07 2q2l s ASP 123 Ca 0.60 1.62 0.32 0.00 2.13 0.00 0.00 52.55 57.21 2q2l s ASP 123 Cb -0.47 -2.55 1.48 0.00 -1.45 0.00 0.00 42.92 39.92 2q2l s ASP 123 CO 0.59 -0.53 1.88 0.44 0.13 0.00 0.00 175.17 177.67 2q2l h ASP 124 N 7.32 0.01 -0.55 -0.34 5.19 -0.63 -3.47 116.42 123.95 2q2l h ASP 124 Ca -0.30 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 55.87 2q2l h ASP 124 Cb 1.14 -0.00 -0.09 0.00 0.18 0.00 0.00 39.33 40.56 2q2l h ASP 124 CO 0.88 0.00 -0.21 0.18 -3.12 0.00 0.00 179.24 176.97 2q2l n LEU 125 N -4.27 -0.61 0.00 1.55 4.32 -1.26 -1.79 117.00 114.95 2q2l n LEU 125 Ca 0.19 0.28 0.00 0.00 -0.02 0.00 0.00 56.01 56.47 2q2l n LEU 125 Cb 0.98 -2.26 0.00 0.00 -1.62 0.00 0.00 43.42 40.52 2q2l n LEU 125 CO 0.39 -0.83 0.00 0.61 -1.22 0.00 0.00 177.39 176.34 2q2l n GLY 126 N -0.66 0.64 0.28 -0.72 0.00 -1.25 -3.74 105.19 99.75 2q2l n GLY 126 Ca -0.12 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.98 2q2l n GLY 126 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2q2l n LYS 127 N -2.03 2.01 -2.03 1.61 4.76 -0.74 -4.50 118.16 117.25 2q2l n LYS 127 Ca 0.00 -2.44 -0.15 0.00 -2.87 0.00 0.00 58.31 52.85 2q2l n LYS 127 Cb 0.00 -1.48 0.08 0.00 -1.84 0.00 0.00 35.03 31.78 2q2l n LYS 127 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2q2l n GLY 128 N -0.97 0.92 0.00 0.72 0.00 -1.25 -4.95 105.19 99.66 2q2l n GLY 128 Ca 0.14 -2.04 0.10 0.00 0.00 0.00 0.00 46.02 44.22 2q2l n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q2l n GLY 129 N -0.17 -1.19 3.89 -0.02 0.00 -1.26 -4.93 105.19 101.51 2q2l n GLY 129 Ca 0.11 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2q2l n GLY 129 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2q2l s HIS 130 N -2.93 3.58 0.51 1.61 5.65 -1.26 -4.95 115.29 117.50 2q2l s HIS 130 Ca 0.12 0.98 0.27 0.00 0.25 0.00 0.00 55.06 56.68 2q2l s HIS 130 Cb 0.14 -2.45 1.57 0.00 -1.18 0.00 0.00 32.58 30.66 2q2l s HIS 130 CO 0.38 -0.41 2.16 0.93 -0.65 0.00 0.00 174.74 177.14 2q2l h GLU 131 N 0.09 0.00 0.00 2.88 4.39 -2.03 -2.86 114.58 117.05 2q2l h GLU 131 Ca -0.46 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.24 2q2l h GLU 131 Cb 1.20 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 2q2l h GLU 131 CO 0.62 0.06 -1.13 1.28 -1.16 0.00 0.00 179.01 178.68 2q2l n LEU 132 N -3.85 0.84 -0.28 1.33 4.77 -1.26 -4.55 117.00 113.99 2q2l n LEU 132 Ca -0.02 -0.41 0.01 0.00 -0.03 0.00 0.00 56.01 55.56 2q2l n LEU 132 Cb 0.16 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.32 2q2l n LEU 132 CO 0.30 0.21 0.68 0.28 -1.33 0.00 0.00 177.39 177.52 2q2l h SER 133 N 0.00 -0.88 -0.19 -1.43 0.02 -1.82 0.28 113.55 109.54 2q2l h SER 133 Ca 0.00 0.25 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2q2l h SER 133 Cb 0.58 0.54 0.00 0.00 0.14 0.00 0.00 62.40 63.65 2q2l h SER 133 CO 0.00 -0.27 0.00 0.29 -1.14 0.00 0.00 176.83 175.71 2q2l n LYS 134 N -5.51 1.67 0.00 3.45 5.02 -1.26 -1.33 118.16 120.20 2q2l n LYS 134 Ca 0.10 -1.01 0.00 0.00 -2.02 0.00 0.00 58.31 55.38 2q2l n LYS 134 Cb 0.40 -1.35 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 2q2l n LYS 134 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2q2l n SER 135 N 0.25 4.45 0.00 4.39 3.41 -0.47 -0.73 113.62 124.92 2q2l n SER 135 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 2q2l n SER 135 Cb 0.29 0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.66 2q2l n SER 135 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2q2l n THR 136 N -1.89 0.00 -1.47 6.66 -2.24 0.86 -4.62 114.28 111.59 2q2l n THR 136 Ca 0.00 -0.12 -0.16 0.00 -2.27 0.00 0.00 64.05 61.50 2q2l n THR 136 Cb 0.45 1.25 -0.07 0.00 -2.10 0.00 0.00 70.33 69.86 2q2l n THR 136 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q2l n GLY 137 N 0.16 1.54 3.91 3.38 0.00 -0.44 -3.72 105.19 110.02 2q2l n GLY 137 Ca 0.00 -0.02 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 2q2l n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2q2l n ASN 138 N -1.23 -3.09 -0.06 1.61 5.15 -1.25 0.12 115.26 116.51 2q2l n ASN 138 Ca -0.16 -0.85 0.16 0.00 -0.60 0.00 0.00 54.58 53.13 2q2l n ASN 138 Cb 0.63 -3.68 0.89 0.00 -0.53 0.00 0.00 39.78 37.10 2q2l n ASN 138 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2q2l n ALA 139 N -4.51 2.67 -0.34 5.20 0.00 -1.24 -4.81 120.51 117.48 2q2l n ALA 139 Ca -0.09 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2q2l n ALA 139 Cb 0.58 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2q2l n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q2l n GLY 140 N 1.03 -0.47 3.72 0.00 0.00 -1.26 -0.39 105.19 107.81 2q2l n GLY 140 Ca 0.23 -1.09 -0.34 0.00 0.00 0.00 0.00 46.02 44.82 2q2l n GLY 140 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2q2l s GLY 141 N -1.20 2.30 -0.73 -0.02 0.00 -1.26 -4.51 107.32 101.90 2q2l s GLY 141 Ca 0.00 0.85 -0.25 0.00 0.00 0.00 0.00 44.72 45.32 2q2l s GLY 141 CO 0.00 1.25 1.18 0.50 0.00 0.00 0.00 173.10 176.03 2q2l s ARG 142 N -3.97 3.19 0.12 2.90 0.52 -1.26 -0.34 118.95 120.11 2q2l s ARG 142 Ca 0.74 -0.51 0.23 0.00 -0.52 0.00 0.00 55.73 55.66 2q2l s ARG 142 Cb -0.28 -4.26 0.14 0.00 0.52 0.00 0.00 34.95 31.06 2q2l s ARG 142 CO 0.46 -2.03 1.13 0.44 0.02 0.00 0.00 175.30 175.32 2q2l n ILE 143 N 6.23 0.36 -3.52 1.52 -5.35 0.64 -4.91 119.36 114.32 2q2l n ILE 143 Ca 0.02 -0.35 -0.14 0.00 -0.27 0.00 0.00 62.75 62.02 2q2l n ILE 143 Cb 0.48 -0.08 -0.05 0.00 -1.74 0.00 0.00 39.64 38.25 2q2l n ILE 143 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2q2l s ALA 144 N -3.24 -1.80 0.02 -1.28 0.00 -1.13 -4.49 121.76 109.84 2q2l s ALA 144 Ca 0.03 1.24 -0.28 0.00 0.00 0.00 0.00 51.96 52.96 2q2l s ALA 144 Cb 0.13 -0.03 0.10 0.00 0.00 0.00 0.00 23.12 23.32 2q2l s ALA 144 CO 0.77 -0.45 0.84 0.00 0.00 0.00 0.00 175.76 176.92 2q2l s GLY 146 N -2.50 -0.34 0.29 0.00 0.00 -0.96 -0.14 107.32 103.67 2q2l s GLY 146 Ca 0.04 0.62 -0.29 0.00 0.00 0.00 0.00 44.72 45.09 2q2l s GLY 146 CO -0.09 0.34 1.02 -0.42 0.00 0.00 0.00 173.10 173.95 2q2l s ILE 147 N -1.78 3.79 -0.80 0.90 1.01 -1.26 -2.39 121.20 120.67 2q2l s ILE 147 Ca -0.09 1.71 -0.25 0.00 0.00 0.00 0.00 60.65 62.02 2q2l s ILE 147 Cb -0.02 -4.05 0.05 0.00 0.01 0.00 0.00 42.46 38.44 2q2l s ILE 147 CO 0.03 0.34 1.26 -0.63 0.00 0.00 0.00 174.94 175.94 2q2l s ILE 148 N -1.28 3.91 0.33 2.92 1.01 0.53 -4.07 121.20 124.56 2q2l s ILE 148 Ca 0.46 -0.07 -0.19 0.00 0.00 0.00 0.00 60.65 60.85 2q2l s ILE 148 Cb -0.27 -4.91 -0.09 0.00 0.01 0.00 0.00 42.46 37.20 2q2l s ILE 148 CO 0.34 -1.80 0.81 -0.83 0.00 0.00 0.00 174.94 173.47 2q2l s GLY 149 N 4.00 2.45 0.19 6.18 0.00 -0.02 -0.69 107.32 119.43 2q2l s GLY 149 Ca 0.35 0.21 -0.30 0.00 0.00 0.00 0.00 44.72 44.98 2q2l s GLY 149 CO 0.07 0.49 1.28 -2.27 0.00 0.00 0.00 173.10 172.67 2q2l s LEU 150 N -2.74 4.42 0.23 0.66 0.20 -1.26 -0.18 118.68 120.01 2q2l s LEU 150 Ca 0.54 2.36 0.09 0.00 0.69 0.00 0.00 54.13 57.80 2q2l s LEU 150 Cb -0.12 -3.61 -0.04 0.00 -0.43 0.00 0.00 46.19 41.99 2q2l s LEU 150 CO 0.18 -0.49 -0.01 -1.58 -0.29 0.00 0.00 176.35 174.15 2q2l s GLN 151 N -0.13 2.30 0.00 1.98 0.74 0.03 -4.81 119.66 119.75 2q2l s GLN 151 Ca 0.56 -1.31 0.25 0.00 0.05 0.00 0.00 55.36 54.91 2q2l s GLN 151 Cb -0.35 -2.22 0.50 0.00 1.10 0.00 0.00 33.01 32.04 2q2l s GLN 151 CO 0.38 0.40 1.44 0.41 -0.55 0.00 0.00 175.29 177.36