#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q2i n GLY 3 N 0.00 -0.94 3.77 0.23 0.00 -1.26 -4.93 105.19 102.06 2q2i n GLY 3 Ca 0.00 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 2q2i n GLY 3 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2q2i s GLU 4 N -4.39 4.26 0.35 1.61 2.12 -1.26 -5.04 118.70 116.36 2q2i s GLU 4 Ca 0.65 2.35 0.08 0.00 0.36 0.00 0.00 54.97 58.40 2q2i s GLU 4 Cb -0.23 -3.04 -0.07 0.00 0.26 0.00 0.00 34.13 31.05 2q2i s GLU 4 CO 0.61 -0.33 -0.04 0.96 -0.54 0.00 0.00 175.26 175.91 2q2i s ILE 5 N -0.99 1.98 0.40 -3.70 -4.36 -1.26 -5.17 121.20 108.10 2q2i s ILE 5 Ca 0.51 -2.11 0.02 0.00 -0.26 0.00 0.00 60.65 58.82 2q2i s ILE 5 Cb -0.42 -2.74 -0.01 0.00 1.25 0.00 0.00 42.46 40.54 2q2i s ILE 5 CO 0.55 -0.14 0.59 -0.94 0.24 0.00 0.00 174.94 175.24 2q2i s SER 6 N -3.60 5.94 0.33 4.36 1.04 -1.26 -4.99 113.70 115.51 2q2i s SER 6 Ca 0.33 0.15 0.05 0.00 0.48 0.00 0.00 55.95 56.96 2q2i s SER 6 Cb 0.06 -1.51 0.68 0.00 0.10 0.00 0.00 66.02 65.34 2q2i s SER 6 CO 0.16 -0.56 1.88 0.22 0.98 0.00 0.00 173.24 175.93 2q2i h TYR 7 N 0.61 0.95 -0.96 5.02 5.03 -2.02 -1.71 116.97 123.89 2q2i h TYR 7 Ca -0.47 0.03 0.00 0.00 2.58 0.00 0.00 58.73 60.87 2q2i h TYR 7 Cb 1.25 -0.30 -0.05 0.00 1.55 0.00 0.00 36.73 39.18 2q2i h TYR 7 CO 0.45 0.41 0.61 0.00 -1.32 0.00 0.00 178.16 178.31 2q2i h ALA 8 N 1.56 1.27 -0.86 1.82 0.00 -1.98 -0.42 119.26 120.65 2q2i h ALA 8 Ca 0.43 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2q2i h ALA 8 Cb 0.49 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2q2i h ALA 8 CO -0.19 0.65 0.55 -0.44 0.00 0.00 0.00 179.25 179.82 2q2i h ASP 9 N 1.31 1.01 -0.58 0.00 3.45 -1.70 -2.42 116.42 117.50 2q2i h ASP 9 Ca 0.35 -0.04 -0.10 0.00 0.43 0.00 0.00 57.03 57.67 2q2i h ASP 9 Cb -0.11 -0.25 -0.02 0.00 -0.56 0.00 0.00 39.33 38.38 2q2i h ASP 9 CO -0.07 0.75 -0.01 0.15 -1.57 0.00 0.00 179.24 178.49 2q2i h PHE 10 N 1.18 1.13 0.00 4.55 3.57 -1.09 -2.91 116.94 123.37 2q2i h PHE 10 Ca 0.31 -0.19 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 2q2i h PHE 10 Cb -0.10 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.35 2q2i h PHE 10 CO -0.01 1.00 -0.01 0.93 -2.23 0.00 0.00 178.31 177.99 2q2i h GLU 11 N 0.95 0.00 0.00 1.11 5.08 -0.62 -1.86 114.58 119.23 2q2i h GLU 11 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2q2i h GLU 11 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2q2i h GLU 11 CO 0.03 0.01 0.00 0.87 -1.00 0.00 0.00 179.01 178.92 2q2i h LYS 12 N 0.00 0.00 -5.61 2.33 1.57 -1.26 -3.43 116.57 110.17 2q2i h LYS 12 Ca -0.00 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.19 2q2i h LYS 12 Cb 0.26 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.48 2q2i h LYS 12 CO 0.00 0.00 -0.13 0.08 -0.57 0.00 0.00 179.45 178.83 2q2i s VAL 13 N -3.57 5.17 -0.48 0.50 1.01 -0.70 -5.04 120.40 117.30 2q2i s VAL 13 Ca 0.02 0.89 -0.05 0.00 0.00 0.00 0.00 61.98 62.84 2q2i s VAL 13 Cb 0.09 -3.80 0.12 0.00 0.00 0.00 0.00 36.38 32.80 2q2i s VAL 13 CO 0.51 0.27 0.30 -0.62 0.00 0.00 0.00 175.10 175.56 2q2i s ASP 14 N 0.84 5.42 -0.18 3.32 -1.08 -1.26 -5.04 116.67 118.69 2q2i s ASP 14 Ca 0.24 -2.16 -0.05 0.00 -0.52 0.00 0.00 52.55 50.05 2q2i s ASP 14 Cb -0.15 -1.89 -0.03 0.00 -1.46 0.00 0.00 42.92 39.39 2q2i s ASP 14 CO 0.09 -0.56 -0.00 -0.63 0.52 0.00 0.00 175.17 174.59 2q2i s ILE 15 N 0.96 4.11 0.21 4.11 1.01 -1.26 -0.86 121.20 129.48 2q2i s ILE 15 Ca 0.09 -0.27 0.09 0.00 0.00 0.00 0.00 60.65 60.57 2q2i s ILE 15 Cb -0.23 -2.84 -0.05 0.00 0.01 0.00 0.00 42.46 39.36 2q2i s ILE 15 CO -0.03 0.46 -0.18 -0.13 0.00 0.00 0.00 174.94 175.06 2q2i s ARG 16 N 0.60 1.41 0.01 2.79 1.81 -0.39 -0.84 118.95 124.34 2q2i s ARG 16 Ca -0.01 -1.56 -0.16 0.00 -1.72 0.00 0.00 55.73 52.29 2q2i s ARG 16 Cb -0.14 -1.43 -0.06 0.00 -0.45 0.00 0.00 34.95 32.87 2q2i s ARG 16 CO 0.02 0.27 0.45 0.54 -0.68 0.00 0.00 175.30 175.90 2q2i s VAL 17 N -2.38 4.97 0.29 3.52 0.11 -0.82 -1.07 120.40 125.03 2q2i s VAL 17 Ca 0.22 0.93 -0.04 0.00 -2.93 0.00 0.00 61.98 60.16 2q2i s VAL 17 Cb -0.04 -3.76 -0.01 0.00 -1.53 0.00 0.00 36.38 31.04 2q2i s VAL 17 CO 0.09 0.55 0.40 -0.83 -3.33 0.00 0.00 175.10 171.98 2q2i s GLY 18 N -0.95 1.32 -0.14 6.54 0.00 -0.60 -0.03 107.32 113.45 2q2i s GLY 18 Ca 0.25 -1.44 -0.01 0.00 0.00 0.00 0.00 44.72 43.52 2q2i s GLY 18 CO 0.14 -1.02 -0.11 -1.59 0.00 0.00 0.00 173.10 170.52 2q2i s THR 19 N -3.51 3.13 -0.01 0.90 2.01 -0.47 -0.64 115.64 117.05 2q2i s THR 19 Ca 0.31 -0.63 -0.30 0.00 0.31 0.00 0.00 61.69 61.38 2q2i s THR 19 Cb 0.01 -2.33 -0.07 0.00 0.01 0.00 0.00 72.50 70.12 2q2i s THR 19 CO 0.17 0.51 1.64 -0.63 -0.69 0.00 0.00 174.62 175.62 2q2i s ILE 20 N 0.51 3.40 -0.31 1.82 1.01 0.01 0.06 121.20 127.70 2q2i s ILE 20 Ca -0.08 0.65 0.14 0.00 0.00 0.00 0.00 60.65 61.36 2q2i s ILE 20 Cb -0.15 -3.42 -0.19 0.00 0.01 0.00 0.00 42.46 38.71 2q2i s ILE 20 CO 0.04 -0.03 0.44 1.33 0.00 0.00 0.00 174.94 176.72 2q2i n VAL 21 N 5.16 0.00 -3.72 2.92 0.24 0.20 -0.43 118.33 122.69 2q2i n VAL 21 Ca 0.16 -0.26 -0.13 0.00 -2.04 0.00 0.00 64.34 62.07 2q2i n VAL 21 Cb 0.42 0.55 -0.10 0.00 -1.47 0.00 0.00 33.84 33.25 2q2i n VAL 21 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2q2i s GLU 22 N -2.68 0.54 -0.13 7.34 2.12 -1.19 -4.91 118.70 119.79 2q2i s GLU 22 Ca -0.00 0.54 -0.07 0.00 0.36 0.00 0.00 54.97 55.80 2q2i s GLU 22 Cb 0.10 0.26 0.05 0.00 0.26 0.00 0.00 34.13 34.80 2q2i s GLU 22 CO 0.58 -0.08 0.32 0.00 -0.54 0.00 0.00 175.26 175.54 2q2i s ALA 23 N 0.08 -0.77 0.02 6.30 0.00 -1.26 -1.44 121.76 124.69 2q2i s ALA 23 Ca -0.01 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.14 2q2i s ALA 23 Cb -0.03 -0.74 -0.02 0.00 0.00 0.00 0.00 23.12 22.34 2q2i s ALA 23 CO 0.01 -0.22 -0.03 0.14 0.00 0.00 0.00 175.76 175.67 2q2i s VAL 24 N 1.21 0.12 0.55 0.00 -7.23 -0.12 -4.80 120.40 110.12 2q2i s VAL 24 Ca -0.08 -0.72 -0.22 0.00 -1.81 0.00 0.00 61.98 59.15 2q2i s VAL 24 Cb -0.09 -0.23 -0.05 0.00 0.56 0.00 0.00 36.38 36.57 2q2i s VAL 24 CO -0.09 -0.38 1.36 -2.16 -0.31 0.00 0.00 175.10 173.51 2q2i s PRO 25 N -1.15 3.14 -0.61 4.82 0.04 -1.26 -0.45 135.00 139.52 2q2i s PRO 25 Ca -0.12 2.23 0.04 0.00 0.04 0.00 0.00 61.00 63.20 2q2i s PRO 25 Cb -0.08 -2.25 0.15 0.00 0.04 0.00 0.00 34.50 32.36 2q2i s PRO 25 CO -0.01 -1.19 0.39 0.12 0.04 0.00 0.00 177.00 176.35 2q2i s PHE 26 N -1.30 3.28 0.14 0.56 2.19 0.84 -4.65 117.98 119.02 2q2i s PHE 26 Ca 0.72 -3.21 -0.23 0.00 0.33 0.00 0.00 56.93 54.54 2q2i s PHE 26 Cb -0.40 -2.66 -0.01 0.00 -1.31 0.00 0.00 43.02 38.63 2q2i s PHE 26 CO 0.48 -0.64 1.65 -1.00 1.83 0.00 0.00 175.22 177.54 2q2i h PRO 27 N 5.89 -0.22 0.00 10.12 0.13 -1.94 -2.78 132.00 143.20 2q2i h PRO 27 Ca 0.05 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2q2i h PRO 27 Cb 0.82 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.00 2q2i h PRO 27 CO 0.69 -0.14 0.00 -0.85 -0.23 0.00 0.00 178.00 177.46 2q2i n GLU 28 N -5.33 0.00 -4.51 0.86 0.00 -1.26 -4.69 120.64 105.71 2q2i n GLU 28 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 57.16 56.80 2q2i n GLU 28 Cb 0.24 0.00 -0.13 0.00 0.00 0.00 0.00 31.44 31.56 2q2i n GLU 28 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.13 174.99 2q2i s PRO 32 N 0.00 3.53 0.22 3.44 0.02 -1.26 -5.26 135.00 135.69 2q2i s PRO 32 Ca 0.00 -0.56 -0.01 0.00 0.02 0.00 0.00 61.00 60.46 2q2i s PRO 32 Cb 0.00 -2.82 -0.04 0.00 0.02 0.00 0.00 34.50 31.66 2q2i s PRO 32 CO 0.00 0.27 0.17 0.00 -0.33 0.00 0.00 177.00 177.12 2q2i s ALA 33 N 0.25 1.18 -0.05 -1.55 0.00 -1.05 -4.34 121.76 116.20 2q2i s ALA 33 Ca -0.04 -1.70 0.05 0.00 0.00 0.00 0.00 51.96 50.26 2q2i s ALA 33 Cb -0.14 1.38 -0.00 0.00 0.00 0.00 0.00 23.12 24.35 2q2i s ALA 33 CO 0.03 -0.62 -0.19 0.42 0.00 0.00 0.00 175.76 175.41 2q2i s ILE 34 N -4.04 1.57 0.01 0.00 1.01 -0.17 -0.11 121.20 119.48 2q2i s ILE 34 Ca 0.38 -0.80 -0.20 0.00 0.00 0.00 0.00 60.65 60.04 2q2i s ILE 34 Cb 0.06 -1.35 -0.06 0.00 0.01 0.00 0.00 42.46 41.12 2q2i s ILE 34 CO 0.14 0.45 0.57 -0.54 0.00 0.00 0.00 174.94 175.56 2q2i s LYS 35 N -0.00 4.26 0.11 2.79 1.02 0.40 -1.50 119.74 126.82 2q2i s LYS 35 Ca -0.04 0.70 0.05 0.00 0.02 0.00 0.00 55.97 56.70 2q2i s LYS 35 Cb -0.12 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.84 2q2i s LYS 35 CO 0.03 0.45 -0.13 0.14 -0.92 0.00 0.00 175.35 174.91 2q2i s VAL 36 N -0.44 1.23 -0.08 3.17 -7.23 0.81 -0.95 120.40 116.91 2q2i s VAL 36 Ca 0.30 -1.62 0.01 0.00 -1.81 0.00 0.00 61.98 58.85 2q2i s VAL 36 Cb -0.18 -1.41 -0.03 0.00 0.56 0.00 0.00 36.38 35.32 2q2i s VAL 36 CO 0.17 -0.40 -0.07 -0.54 -0.31 0.00 0.00 175.10 173.95 2q2i s LYS 37 N -2.50 2.82 -0.09 4.82 1.02 -0.52 -1.11 119.74 124.18 2q2i s LYS 37 Ca 0.06 -0.56 0.03 0.00 0.02 0.00 0.00 55.97 55.52 2q2i s LYS 37 Cb -0.06 -2.60 0.01 0.00 -0.52 0.00 0.00 37.83 34.66 2q2i s LYS 37 CO 0.02 0.62 -0.17 0.42 -0.92 0.00 0.00 175.35 175.32 2q2i s ILE 38 N -0.68 1.54 -0.55 2.17 1.01 0.62 -0.63 121.20 124.68 2q2i s ILE 38 Ca 0.10 -0.70 -0.24 0.00 0.00 0.00 0.00 60.65 59.81 2q2i s ILE 38 Cb -0.11 -1.37 0.04 0.00 0.01 0.00 0.00 42.46 41.03 2q2i s ILE 38 CO 0.02 0.45 0.92 -0.62 0.00 0.00 0.00 174.94 175.70 2q2i s ASP 39 N 0.65 6.33 -0.16 3.58 -1.08 0.11 -1.11 116.67 124.99 2q2i s ASP 39 Ca -0.14 -0.41 0.10 0.00 -0.52 0.00 0.00 52.55 51.58 2q2i s ASP 39 Cb -0.16 -2.43 0.58 0.00 -1.46 0.00 0.00 42.92 39.45 2q2i s ASP 39 CO 0.04 -1.21 1.38 0.49 0.52 0.00 0.00 175.17 176.39 2q2i n PHE 40 N 7.37 1.46 -0.45 -5.34 3.01 -0.58 -1.36 117.46 121.57 2q2i n PHE 40 Ca 0.01 -0.51 0.00 0.00 1.01 0.00 0.00 57.45 57.96 2q2i n PHE 40 Cb 0.47 -0.39 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 2q2i n PHE 40 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2q2i n GLY 41 N 0.46 -2.74 0.26 1.37 0.00 -1.26 -2.51 105.19 100.77 2q2i n GLY 41 Ca 0.20 -1.69 0.04 0.00 0.00 0.00 0.00 46.02 44.57 2q2i n GLY 41 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2q2i h PRO 42 N 0.00 0.22 0.11 1.61 0.11 -1.93 0.25 132.00 132.36 2q2i h PRO 42 Ca 0.00 -0.03 -0.28 0.00 0.11 0.00 0.00 66.00 65.80 2q2i h PRO 42 Cb 0.00 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 2q2i h PRO 42 CO 0.00 0.26 -1.34 0.93 -0.21 0.00 0.00 178.00 177.64 2q2i h GLU 43 N 0.22 0.23 0.00 1.05 4.39 -1.95 -3.39 114.58 115.12 2q2i h GLU 43 Ca 0.05 -0.39 -0.38 0.00 0.34 0.00 0.00 59.36 58.99 2q2i h GLU 43 Cb 0.18 0.14 -0.07 0.00 -0.10 0.00 0.00 28.75 28.90 2q2i h GLU 43 CO 0.00 1.13 -2.43 -0.89 -1.16 0.00 0.00 179.01 175.67 2q2i n ILE 44 N -3.47 1.44 -3.48 3.13 5.41 -1.17 -5.11 119.36 116.12 2q2i n ILE 44 Ca -0.11 -0.56 0.00 0.00 1.00 0.00 0.00 62.75 63.09 2q2i n ILE 44 Cb 1.02 -1.38 0.00 0.00 -0.71 0.00 0.00 39.64 38.57 2q2i n ILE 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2q2i n GLY 45 N 2.29 -1.39 3.73 7.39 0.00 0.87 -4.86 105.19 113.23 2q2i n GLY 45 Ca -0.44 -1.37 -0.40 0.00 0.00 0.00 0.00 46.02 43.80 2q2i n GLY 45 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2q2i s ILE 46 N 0.00 4.87 0.04 -0.61 -1.09 -1.26 -1.52 121.20 121.64 2q2i s ILE 46 Ca 0.00 1.55 0.05 0.00 -2.23 0.00 0.00 60.65 60.02 2q2i s ILE 46 Cb 0.00 -4.08 -0.02 0.00 -1.58 0.00 0.00 42.46 36.78 2q2i s ILE 46 CO 0.00 0.32 -0.16 -0.54 -1.23 0.00 0.00 174.94 173.33 2q2i s LYS 47 N 0.31 1.03 0.13 2.79 -0.14 -0.26 -4.94 119.74 118.65 2q2i s LYS 47 Ca 0.38 -0.82 -0.06 0.00 -1.36 0.00 0.00 55.97 54.11 2q2i s LYS 47 Cb -0.19 -1.07 -0.06 0.00 -1.68 0.00 0.00 37.83 34.83 2q2i s LYS 47 CO 0.21 0.26 0.39 0.15 -0.76 0.00 0.00 175.35 175.61 2q2i s LYS 48 N -1.21 3.67 0.17 1.68 1.02 -1.26 -0.28 119.74 123.53 2q2i s LYS 48 Ca 0.03 0.01 -0.15 0.00 0.02 0.00 0.00 55.97 55.87 2q2i s LYS 48 Cb -0.08 -2.87 0.02 0.00 -0.52 0.00 0.00 37.83 34.38 2q2i s LYS 48 CO 0.02 0.48 0.43 0.45 -0.92 0.00 0.00 175.35 175.81 2q2i s SER 49 N -2.24 -0.18 0.02 2.83 0.15 -0.27 -0.81 113.70 113.20 2q2i s SER 49 Ca 0.39 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.51 2q2i s SER 49 Cb -0.12 0.52 -0.02 0.00 -1.71 0.00 0.00 66.02 64.68 2q2i s SER 49 CO 0.22 -0.96 -0.03 -0.94 1.20 0.00 0.00 173.24 172.73 2q2i s SER 50 N -2.88 0.30 -0.06 5.45 1.04 -1.26 -0.14 113.70 116.15 2q2i s SER 50 Ca 0.09 -0.43 -0.19 0.00 0.48 0.00 0.00 55.95 55.90 2q2i s SER 50 Cb 0.01 0.07 0.04 0.00 0.10 0.00 0.00 66.02 66.24 2q2i s SER 50 CO -0.05 -0.24 0.45 0.00 0.98 0.00 0.00 173.24 174.38 2q2i s ALA 51 N -1.22 -1.14 -1.42 5.32 0.00 -0.56 -4.78 121.76 117.96 2q2i s ALA 51 Ca -0.13 0.83 -0.15 0.00 0.00 0.00 0.00 51.96 52.52 2q2i s ALA 51 Cb -0.08 -0.15 0.05 0.00 0.00 0.00 0.00 23.12 22.93 2q2i s ALA 51 CO -0.01 -0.28 2.12 1.04 0.00 0.00 0.00 175.76 178.64 2q2i n GLN 52 N 1.56 2.94 -0.72 0.00 6.02 -1.26 -1.00 117.38 124.93 2q2i n GLN 52 Ca -0.19 -2.76 0.06 0.00 -0.01 0.00 0.00 57.00 54.09 2q2i n GLN 52 Cb 0.56 -3.31 0.19 0.00 1.02 0.00 0.00 30.24 28.70 2q2i n GLN 52 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 2q2i n ILE 53 N 5.27 1.94 0.55 5.09 -5.35 -1.26 -4.43 119.36 121.18 2q2i n ILE 53 Ca 0.51 -2.98 0.13 0.00 -0.27 0.00 0.00 62.75 60.13 2q2i n ILE 53 Cb 0.40 -0.09 0.34 0.00 -1.74 0.00 0.00 39.64 38.55 2q2i n ILE 53 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 2q2i h THR 54 N 1.73 0.00 0.17 7.28 1.35 -1.81 -2.80 112.91 118.83 2q2i h THR 54 Ca -0.03 -0.57 -0.01 0.00 -0.55 0.00 0.00 66.41 65.26 2q2i h THR 54 Cb 1.11 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 2q2i h THR 54 CO 0.02 0.00 -0.08 0.58 -0.25 0.00 0.00 175.52 175.79 2q2i h VAL 55 N 0.00 0.95 0.00 6.82 2.07 -1.91 -3.35 116.25 120.82 2q2i h VAL 55 Ca 0.00 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.59 2q2i h VAL 55 Cb 0.78 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 2q2i h VAL 55 CO 0.00 0.20 -0.94 1.41 0.02 0.00 0.00 177.57 178.26 2q2i n HIS 56 N -4.98 0.19 -4.33 1.57 8.25 -1.26 -4.99 115.22 109.67 2q2i n HIS 56 Ca -0.09 0.06 -0.18 0.00 -0.26 0.00 0.00 57.72 57.25 2q2i n HIS 56 Cb 0.26 -0.35 -0.10 0.00 1.12 0.00 0.00 29.99 30.91 2q2i n HIS 56 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2q2i s TYR 57 N -3.14 1.62 0.24 4.41 1.51 -1.05 -5.09 117.35 115.85 2q2i s TYR 57 Ca 0.05 -0.65 0.05 0.00 -1.01 0.00 0.00 57.07 55.51 2q2i s TYR 57 Cb 0.15 -0.80 -0.05 0.00 -0.11 0.00 0.00 41.96 41.15 2q2i s TYR 57 CO 0.79 0.26 -0.03 0.95 -1.11 0.00 0.00 175.55 176.42 2q2i s THR 58 N -3.08 1.24 0.27 -0.71 -4.23 -1.26 -4.37 115.64 103.49 2q2i s THR 58 Ca 0.22 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.67 2q2i s THR 58 Cb 0.01 -2.33 0.26 0.00 1.34 0.00 0.00 72.50 71.78 2q2i s THR 58 CO 0.06 -0.36 1.70 -0.65 -0.54 0.00 0.00 174.62 174.84 2q2i h PRO 59 N 2.44 0.39 -0.80 3.99 0.11 -1.96 -1.68 132.00 134.49 2q2i h PRO 59 Ca -0.39 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.67 2q2i h PRO 59 Cb 1.22 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 2q2i h PRO 59 CO 0.65 0.26 0.39 0.93 -0.21 0.00 0.00 178.00 180.02 2q2i h GLU 60 N 0.40 1.15 0.00 1.05 3.07 -1.95 -2.49 114.58 115.81 2q2i h GLU 60 Ca 0.50 -0.16 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 2q2i h GLU 60 Cb 0.89 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.59 2q2i h GLU 60 CO -0.49 0.88 -0.21 -1.13 -1.40 0.00 0.00 179.01 176.66 2q2i n SER 61 N -4.31 0.45 0.01 1.42 3.41 -0.89 -3.96 113.62 109.75 2q2i n SER 61 Ca 0.08 0.31 -0.22 0.00 -0.26 0.00 0.00 58.87 58.78 2q2i n SER 61 Cb 0.14 -0.32 -0.14 0.00 -0.26 0.00 0.00 64.21 63.63 2q2i n SER 61 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2q2i h LEU 62 N 0.00 0.42 -9.41 1.04 3.38 -1.05 -3.43 115.31 106.27 2q2i h LEU 62 Ca 0.00 -0.88 -0.54 0.00 0.09 0.00 0.00 57.88 56.55 2q2i h LEU 62 Cb 0.61 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 41.24 2q2i h LEU 62 CO 0.00 1.73 0.98 -0.69 0.09 0.00 0.00 178.44 180.55 2q2i s VAL 63 N -2.52 3.25 0.00 1.22 1.01 -0.96 -1.22 120.40 121.19 2q2i s VAL 63 Ca -0.20 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.41 2q2i s VAL 63 Cb 0.05 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 33.02 2q2i s VAL 63 CO 0.78 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.47 2q2i n GLY 64 N 3.95 2.20 3.76 4.51 0.00 0.42 -5.01 105.19 115.02 2q2i n GLY 64 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2q2i n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q2i s ARG 65 N -0.82 4.61 0.04 1.61 0.52 -0.35 -4.76 118.95 119.80 2q2i s ARG 65 Ca 0.00 1.83 -0.22 0.00 -0.52 0.00 0.00 55.73 56.82 2q2i s ARG 65 Cb 0.00 -3.17 -0.06 0.00 0.52 0.00 0.00 34.95 32.24 2q2i s ARG 65 CO 0.00 0.18 0.66 -0.65 0.02 0.00 0.00 175.30 175.51 2q2i s GLN 66 N -1.48 4.38 0.25 3.54 -0.21 -1.26 -0.81 119.66 124.07 2q2i s GLN 66 Ca 0.45 0.88 0.04 0.00 0.02 0.00 0.00 55.36 56.74 2q2i s GLN 66 Cb -0.32 -3.32 -0.05 0.00 1.00 0.00 0.00 33.01 30.31 2q2i s GLN 66 CO 0.42 0.42 0.00 0.14 -2.12 0.00 0.00 175.29 174.15 2q2i s VAL 67 N -0.44 1.11 -0.03 1.09 -7.23 0.18 -4.54 120.40 110.55 2q2i s VAL 67 Ca 0.33 -2.04 0.00 0.00 -1.81 0.00 0.00 61.98 58.47 2q2i s VAL 67 Cb -0.20 -2.44 -0.03 0.00 0.56 0.00 0.00 36.38 34.26 2q2i s VAL 67 CO 0.20 -0.25 -0.01 -0.76 -0.31 0.00 0.00 175.10 173.97 2q2i s LEU 68 N -3.35 3.49 -0.01 1.32 1.43 -1.26 -1.56 118.68 118.74 2q2i s LEU 68 Ca 0.30 0.04 -0.07 0.00 -1.03 0.00 0.00 54.13 53.37 2q2i s LEU 68 Cb 0.06 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.36 2q2i s LEU 68 CO 0.10 0.32 0.15 -0.83 0.23 0.00 0.00 176.35 176.32 2q2i s GLY 69 N -1.27 0.01 -0.21 -3.19 0.00 -0.23 -0.59 107.32 101.83 2q2i s GLY 69 Ca 0.17 -0.02 -0.26 0.00 0.00 0.00 0.00 44.72 44.61 2q2i s GLY 69 CO 0.07 -0.15 0.87 0.14 0.00 0.00 0.00 173.10 174.03 2q2i s VAL 70 N -1.14 4.82 -1.95 1.40 1.01 -0.50 -1.26 120.40 122.79 2q2i s VAL 70 Ca -0.12 1.68 0.21 0.00 0.00 0.00 0.00 61.98 63.75 2q2i s VAL 70 Cb -0.06 -4.16 0.01 0.00 0.00 0.00 0.00 36.38 32.16 2q2i s VAL 70 CO 0.01 -0.05 1.03 1.33 0.00 0.00 0.00 175.10 177.42 2q2i n VAL 71 N 5.07 0.00 -1.62 2.92 0.24 -0.04 -2.77 118.33 122.12 2q2i n VAL 71 Ca 0.06 -0.31 -0.08 0.00 -2.04 0.00 0.00 64.34 61.98 2q2i n VAL 71 Cb 0.48 1.26 0.15 0.00 -1.47 0.00 0.00 33.84 34.26 2q2i n VAL 71 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2q2i n ASN 72 N 0.09 3.11 -4.88 -1.34 6.94 -1.26 -4.98 115.26 112.95 2q2i n ASN 72 Ca 0.09 -3.82 -0.30 0.00 -0.02 0.00 0.00 54.58 50.53 2q2i n ASN 72 Cb 0.44 -0.56 -0.03 0.00 -2.36 0.00 0.00 39.78 37.26 2q2i n ASN 72 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 2q2i s PHE 73 N -3.37 3.47 0.47 -2.53 2.99 -1.26 -4.99 117.98 112.76 2q2i s PHE 73 Ca 0.45 0.96 -0.25 0.00 0.00 0.00 0.00 56.93 58.10 2q2i s PHE 73 Cb 0.40 -2.37 -0.08 0.00 0.00 0.00 0.00 43.02 40.98 2q2i s PHE 73 CO -0.01 -0.03 1.40 -2.14 -0.00 0.00 0.00 175.22 174.44 2q2i s PRO 74 N -3.73 3.59 0.60 0.24 0.02 -1.26 -4.93 135.00 129.53 2q2i s PRO 74 Ca 0.50 2.35 -0.17 0.00 0.02 0.00 0.00 61.00 63.69 2q2i s PRO 74 Cb -0.10 -2.57 -0.03 0.00 0.02 0.00 0.00 34.50 31.82 2q2i s PRO 74 CO 0.30 -0.87 1.13 -1.25 -0.33 0.00 0.00 177.00 175.98 2q2i s PRO 75 N -2.54 3.05 0.00 5.54 0.04 -1.26 -4.92 135.00 134.92 2q2i s PRO 75 Ca 0.63 1.52 -0.00 0.00 0.04 0.00 0.00 61.00 63.19 2q2i s PRO 75 Cb -0.42 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.14 2q2i s PRO 75 CO 0.54 -1.07 -0.00 1.03 0.04 0.00 0.00 177.00 177.53 2q2i s ARG 76 N -3.68 0.11 -0.02 4.56 1.81 0.21 -4.99 118.95 116.94 2q2i s ARG 76 Ca 0.70 -0.18 -0.24 0.00 -1.72 0.00 0.00 55.73 54.29 2q2i s ARG 76 Cb -0.23 0.04 -0.04 0.00 -0.45 0.00 0.00 34.95 34.27 2q2i s ARG 76 CO 0.34 -0.02 0.71 -0.65 -0.68 0.00 0.00 175.30 175.01 2q2i s GLN 77 N -0.46 4.44 -0.75 3.54 -1.52 -1.26 -0.38 119.66 123.26 2q2i s GLN 77 Ca -0.05 0.93 0.02 0.00 -1.95 0.00 0.00 55.36 54.31 2q2i s GLN 77 Cb -0.03 -3.40 0.18 0.00 -0.22 0.00 0.00 33.01 29.54 2q2i s GLN 77 CO -0.00 0.18 0.57 0.42 -0.25 0.00 0.00 175.29 176.21 2q2i s ILE 78 N 0.37 3.45 0.00 1.08 1.01 0.17 -4.94 121.20 122.34 2q2i s ILE 78 Ca 0.37 -3.96 0.00 0.00 0.00 0.00 0.00 60.65 57.06 2q2i s ILE 78 Cb -0.19 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.06 2q2i s ILE 78 CO 0.20 -1.01 0.00 0.61 0.00 0.00 0.00 174.94 174.74 2q2i n GLY 79 N 2.30 3.03 0.00 6.18 0.00 -1.26 -2.77 105.19 112.68 2q2i n GLY 79 Ca 0.18 -0.27 0.10 0.00 0.00 0.00 0.00 46.02 46.04 2q2i n GLY 79 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2q2i n PRO 80 N 13.76 0.07 -2.95 1.61 -0.04 -1.26 -4.75 135.00 141.44 2q2i n PRO 80 Ca 0.00 0.14 -0.41 0.00 -0.04 0.00 0.00 63.50 63.19 2q2i n PRO 80 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 2q2i n PRO 80 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2q2i s PHE 81 N -2.90 3.40 -0.58 0.54 5.36 -1.11 -5.01 117.98 117.68 2q2i s PHE 81 Ca 0.12 1.15 -0.20 0.00 -0.96 0.00 0.00 56.93 57.04 2q2i s PHE 81 Cb 0.13 -2.96 0.08 0.00 -0.34 0.00 0.00 43.02 39.94 2q2i s PHE 81 CO 0.36 -0.23 0.75 0.50 -1.46 0.00 0.00 175.22 175.13 2q2i s ARG 82 N 2.14 3.10 -0.03 10.12 3.52 -1.26 0.43 118.95 136.97 2q2i s ARG 82 Ca 0.35 -1.02 -0.28 0.00 -0.13 0.00 0.00 55.73 54.64 2q2i s ARG 82 Cb -0.16 -4.19 -0.03 0.00 -1.56 0.00 0.00 34.95 29.01 2q2i s ARG 82 CO 0.11 -1.49 0.92 0.45 -0.81 0.00 0.00 175.30 174.48 2q2i s SER 83 N 3.30 7.27 -0.01 -2.12 0.15 0.49 -4.65 113.70 118.13 2q2i s SER 83 Ca 0.16 1.54 0.02 0.00 0.70 0.00 0.00 55.95 58.37 2q2i s SER 83 Cb -0.20 -2.53 -0.03 0.00 -1.71 0.00 0.00 66.02 61.54 2q2i s SER 83 CO 0.10 -0.25 0.03 -0.62 1.20 0.00 0.00 173.24 173.69 2q2i n GLU 84 N 4.01 1.86 -4.01 5.44 1.02 0.01 -0.62 120.64 128.35 2q2i n GLU 84 Ca 0.05 -0.01 -0.08 0.00 -0.02 0.00 0.00 57.16 57.09 2q2i n GLU 84 Cb 0.51 -1.05 -0.10 0.00 -0.02 0.00 0.00 31.44 30.77 2q2i n GLU 84 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2q2i s VAL 85 N -2.10 0.15 -0.31 2.62 -7.23 -0.73 -4.69 120.40 108.10 2q2i s VAL 85 Ca -0.01 -1.24 -0.19 0.00 -1.81 0.00 0.00 61.98 58.73 2q2i s VAL 85 Cb 0.01 -0.77 -0.01 0.00 0.56 0.00 0.00 36.38 36.17 2q2i s VAL 85 CO 0.09 -0.68 0.59 -0.22 -0.31 0.00 0.00 175.10 174.56 2q2i s LEU 86 N -2.04 4.18 -0.18 1.32 2.96 -1.11 -4.54 118.68 119.27 2q2i s LEU 86 Ca -0.07 0.31 -0.25 0.00 -0.22 0.00 0.00 54.13 53.90 2q2i s LEU 86 Cb -0.03 -2.74 -0.01 0.00 0.50 0.00 0.00 46.19 43.91 2q2i s LEU 86 CO -0.04 -0.46 0.83 -0.89 -1.32 0.00 0.00 176.35 174.47 2q2i s THR 87 N 2.53 4.87 0.16 3.68 2.01 -1.26 -1.41 115.64 126.22 2q2i s THR 87 Ca 0.23 1.63 -0.16 0.00 0.31 0.00 0.00 61.69 63.70 2q2i s THR 87 Cb -0.15 -4.14 -0.07 0.00 0.01 0.00 0.00 72.50 68.15 2q2i s THR 87 CO 0.12 0.01 0.60 -0.76 -0.69 0.00 0.00 174.62 173.90 2q2i s LEU 88 N 2.25 4.37 0.00 4.42 1.43 0.24 -5.00 118.68 126.38 2q2i s LEU 88 Ca 0.38 1.20 -0.01 0.00 -1.03 0.00 0.00 54.13 54.66 2q2i s LEU 88 Cb -0.16 -3.30 0.00 0.00 0.03 0.00 0.00 46.19 42.76 2q2i s LEU 88 CO 0.12 0.11 0.07 0.61 0.23 0.00 0.00 176.35 177.48 2q2i n GLY 89 N 0.92 1.48 2.99 -3.19 0.00 -1.26 -1.49 105.19 104.64 2q2i n GLY 89 Ca -0.05 -0.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.90 2q2i n GLY 89 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2q2i s PHE 90 N -6.66 0.17 0.09 1.61 0.40 0.37 -4.84 117.98 109.13 2q2i s PHE 90 Ca 0.01 -0.36 -0.30 0.00 -0.60 0.00 0.00 56.93 55.69 2q2i s PHE 90 Cb -0.00 -0.13 -0.06 0.00 0.51 0.00 0.00 43.02 43.34 2q2i s PHE 90 CO 0.01 -0.18 1.11 0.00 0.70 0.00 0.00 175.22 176.85 2q2i s ALA 91 N -1.22 3.33 1.00 5.36 0.00 -1.26 -0.43 121.76 128.55 2q2i s ALA 91 Ca -0.13 0.77 -0.04 0.00 0.00 0.00 0.00 51.96 52.55 2q2i s ALA 91 Cb -0.08 -3.38 0.06 0.00 0.00 0.00 0.00 23.12 19.72 2q2i s ALA 91 CO -0.00 -0.30 0.34 -0.40 0.00 0.00 0.00 175.76 175.40 2q2i n ASP 92 N 3.30 -0.06 0.33 0.00 5.68 0.76 -4.83 116.55 121.73 2q2i n ASP 92 Ca 0.06 -1.10 0.21 0.00 -0.50 0.00 0.00 54.79 53.47 2q2i n ASP 92 Cb 0.47 -0.27 1.14 0.00 -1.14 0.00 0.00 41.12 41.33 2q2i n ASP 92 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2q2i h ALA 93 N -1.96 1.08 -0.02 2.12 0.00 -1.97 -1.23 119.26 117.27 2q2i h ALA 93 Ca -0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2q2i h ALA 93 Cb 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2q2i h ALA 93 CO 0.08 0.00 -0.06 0.09 0.00 0.00 0.00 179.25 179.36 2q2i n ASN 94 N -3.20 2.57 0.00 0.00 3.02 -1.26 -4.97 115.26 111.41 2q2i n ASN 94 Ca -0.03 -1.78 0.00 0.00 -0.03 0.00 0.00 54.58 52.74 2q2i n ASN 94 Cb 0.09 0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 2q2i n ASN 94 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q2i n GLY 95 N 1.17 0.73 3.85 7.41 0.00 -0.47 -5.06 105.19 112.82 2q2i n GLY 95 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 2q2i n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2q2i s ASP 96 N -2.81 6.78 -0.07 1.61 -0.00 -1.26 -4.60 116.67 116.32 2q2i s ASP 96 Ca 0.00 1.21 -0.27 0.00 -0.00 0.00 0.00 52.55 53.50 2q2i s ASP 96 Cb 0.00 -2.34 -0.03 0.00 -0.00 0.00 0.00 42.92 40.55 2q2i s ASP 96 CO 0.00 -0.13 0.86 -0.63 -0.00 0.00 0.00 175.17 175.26 2q2i s ILE 97 N -1.87 4.92 -0.15 0.77 -1.09 -1.26 -0.17 121.20 122.35 2q2i s ILE 97 Ca 0.51 1.76 -0.03 0.00 -2.23 0.00 0.00 60.65 60.66 2q2i s ILE 97 Cb -0.11 -4.19 -0.02 0.00 -1.58 0.00 0.00 42.46 36.56 2q2i s ILE 97 CO 0.19 0.14 -0.07 -0.69 -1.23 0.00 0.00 174.94 173.29 2q2i s VAL 98 N 1.30 3.64 0.29 2.92 1.01 0.43 -4.64 120.40 125.34 2q2i s VAL 98 Ca 0.44 -0.45 -0.29 0.00 0.00 0.00 0.00 61.98 61.68 2q2i s VAL 98 Cb -0.19 -2.58 -0.10 0.00 0.00 0.00 0.00 36.38 33.52 2q2i s VAL 98 CO 0.20 0.50 1.26 -0.76 0.00 0.00 0.00 175.10 176.31 2q2i s LEU 99 N 0.35 4.45 0.70 3.92 1.43 -1.26 -0.47 118.68 127.80 2q2i s LEU 99 Ca -0.06 2.52 -0.15 0.00 -1.03 0.00 0.00 54.13 55.40 2q2i s LEU 99 Cb -0.15 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.46 2q2i s LEU 99 CO 0.04 -0.44 1.19 0.00 0.23 0.00 0.00 176.35 177.36 2q2i s ALA 100 N -0.82 2.23 0.33 4.21 0.00 -0.55 -4.88 121.76 122.29 2q2i s ALA 100 Ca 0.50 0.83 -0.02 0.00 0.00 0.00 0.00 51.96 53.27 2q2i s ALA 100 Cb -0.37 -3.44 -0.00 0.00 0.00 0.00 0.00 23.12 19.31 2q2i s ALA 100 CO 0.46 -1.68 0.46 0.00 0.00 0.00 0.00 175.76 175.00 2q2i s ALA 101 N -2.00 0.78 0.06 0.00 0.00 -1.26 -4.20 121.76 115.14 2q2i s ALA 101 Ca 0.73 -1.52 0.07 0.00 0.00 0.00 0.00 51.96 51.25 2q2i s ALA 101 Cb -0.28 1.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.98 2q2i s ALA 101 CO 0.43 -0.78 -0.16 0.14 0.00 0.00 0.00 175.76 175.39 2q2i s VAL 102 N -3.15 2.94 0.39 0.00 -7.23 -1.26 -4.94 120.40 107.15 2q2i s VAL 102 Ca 0.31 -1.22 0.19 0.00 -1.81 0.00 0.00 61.98 59.44 2q2i s VAL 102 Cb -0.00 -2.28 0.19 0.00 0.56 0.00 0.00 36.38 34.85 2q2i s VAL 102 CO 0.20 0.27 1.95 -0.08 -0.31 0.00 0.00 175.10 177.13 2q2i h GLU 103 N 4.27 0.00 -3.53 4.82 4.22 -2.02 -3.44 114.58 118.90 2q2i h GLU 103 Ca -0.48 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 58.90 2q2i h GLU 103 Cb 1.16 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.30 2q2i h GLU 103 CO 0.48 0.23 -0.12 -0.98 -2.18 0.00 0.00 179.01 176.44 2q2i s ARG 104 N -4.26 1.23 0.33 1.92 1.70 -1.26 -5.15 118.95 113.47 2q2i s ARG 104 Ca -0.03 -0.95 -0.28 0.00 -0.47 0.00 0.00 55.73 54.00 2q2i s ARG 104 Cb 0.14 0.46 -0.12 0.00 -0.57 0.00 0.00 34.95 34.85 2q2i s ARG 104 CO 0.66 -0.49 1.33 -2.30 -1.08 0.00 0.00 175.30 173.42 2q2i n PRO 105 N -0.27 2.19 -4.25 3.89 -0.02 -1.26 -5.02 135.00 130.26 2q2i n PRO 105 Ca -0.10 0.77 -0.18 0.00 -2.02 0.00 0.00 63.50 61.96 2q2i n PRO 105 Cb 0.63 -2.38 -0.13 0.00 -0.02 0.00 0.00 33.50 31.60 2q2i n PRO 105 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2q2i s VAL 106 N -0.95 0.97 0.24 -1.45 1.01 -1.26 -5.12 120.40 113.85 2q2i s VAL 106 Ca 0.57 -1.03 -0.31 0.00 0.00 0.00 0.00 61.98 61.20 2q2i s VAL 106 Cb -0.57 -0.91 -0.13 0.00 0.00 0.00 0.00 36.38 34.78 2q2i s VAL 106 CO 0.61 -0.11 1.56 -2.65 0.00 0.00 0.00 175.10 174.50 2q2i n PRO 107 N 1.75 2.43 -1.67 2.72 -0.02 -1.26 -4.90 135.00 134.04 2q2i n PRO 107 Ca -0.19 0.87 -0.44 0.00 -2.02 0.00 0.00 63.50 61.71 2q2i n PRO 107 Cb 0.55 -2.62 -0.02 0.00 -0.02 0.00 0.00 33.50 31.39 2q2i n PRO 107 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2q2i n ASN 108 N 2.62 2.61 0.00 2.55 3.02 -1.26 -2.17 115.26 122.63 2q2i n ASN 108 Ca 0.12 1.16 0.00 0.00 -0.03 0.00 0.00 54.58 55.83 2q2i n ASN 108 Cb 0.34 -1.43 0.00 0.00 -0.61 0.00 0.00 39.78 38.08 2q2i n ASN 108 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q2i n GLY 109 N 1.69 0.62 3.77 7.41 0.00 0.95 -4.27 105.19 115.36 2q2i n GLY 109 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2q2i n GLY 109 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2q2i s GLU 110 N -0.79 3.96 0.08 1.61 0.41 -0.92 -4.77 118.70 118.28 2q2i s GLU 110 Ca 0.00 2.22 -0.24 0.00 -0.41 0.00 0.00 54.97 56.54 2q2i s GLU 110 Cb 0.00 -2.78 -0.06 0.00 -1.78 0.00 0.00 34.13 29.51 2q2i s GLU 110 CO 0.00 -0.52 0.75 0.15 -0.49 0.00 0.00 175.26 175.14 2q2i s LYS 111 N -2.23 4.49 0.13 1.61 1.02 -1.26 -1.94 119.74 121.56 2q2i s LYS 111 Ca 0.57 1.06 -0.30 0.00 0.02 0.00 0.00 55.97 57.31 2q2i s LYS 111 Cb -0.39 -3.32 -0.07 0.00 -0.52 0.00 0.00 37.83 33.52 2q2i s LYS 111 CO 0.51 0.40 1.25 1.41 -0.92 0.00 0.00 175.35 178.00 2q2i s MET 112 N -0.47 4.42 0.00 1.68 -2.45 -0.02 -4.98 119.30 117.47 2q2i s MET 112 Ca 0.37 1.90 0.00 0.00 -1.25 0.00 0.00 55.69 56.70 2q2i s MET 112 Cb -0.21 -3.28 0.00 0.00 1.25 0.00 0.00 34.83 32.59 2q2i s MET 112 CO 0.23 -0.24 0.00 0.00 1.05 0.00 0.00 175.02 176.06