#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q9t s VAL 2 N 0.00 4.66 -0.04 6.31 1.01 -1.26 -3.80 120.40 127.28 1q9t s VAL 2 Ca 0.00 1.83 0.02 0.00 0.00 0.00 0.00 61.98 63.83 1q9t s VAL 2 Cb 0.00 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 32.18 1q9t s VAL 2 CO 0.00 0.32 -0.09 -0.54 0.00 0.00 0.00 175.10 174.80 1q9t s LYS 3 N 0.09 1.17 -0.10 2.72 -0.14 0.16 -4.97 119.74 118.67 1q9t s LYS 3 Ca 0.43 -0.28 0.00 0.00 -1.36 0.00 0.00 55.97 54.76 1q9t s LYS 3 Cb -0.22 -1.05 0.02 0.00 -1.68 0.00 0.00 37.83 34.90 1q9t s LYS 3 CO 0.26 0.02 -0.09 -0.51 -0.76 0.00 0.00 175.35 174.27 1q9t s LEU 4 N 0.58 1.30 -0.16 3.17 1.43 -1.26 -1.46 118.68 122.28 1q9t s LEU 4 Ca -0.10 -0.31 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 1q9t s LEU 4 Cb -0.13 -0.85 0.05 0.00 0.03 0.00 0.00 46.19 45.29 1q9t s LEU 4 CO 0.02 -0.09 0.04 -0.69 0.23 0.00 0.00 176.35 175.86 1q9t s VAL 5 N 1.48 0.41 0.39 -1.59 1.01 -0.35 -4.10 120.40 117.65 1q9t s VAL 5 Ca 0.01 -0.36 -0.13 0.00 0.00 0.00 0.00 61.98 61.50 1q9t s VAL 5 Cb -0.13 -0.86 -0.08 0.00 0.00 0.00 0.00 36.38 35.31 1q9t s VAL 5 CO -0.06 -0.12 0.79 -1.61 0.00 0.00 0.00 175.10 174.10 1q9t s GLU 6 N 1.92 3.89 0.17 2.72 8.01 -1.26 -1.34 118.70 132.80 1q9t s GLU 6 Ca 0.01 0.61 -0.14 0.00 0.01 0.00 0.00 54.97 55.45 1q9t s GLU 6 Cb -0.16 -2.37 0.02 0.00 -4.31 0.00 0.00 34.13 27.31 1q9t s GLU 6 CO -0.07 0.00 0.42 -1.12 0.01 0.00 0.00 175.26 174.49 1q9t s SER 7 N -2.82 -0.15 0.00 -0.19 0.01 -0.07 -4.79 113.70 105.69 1q9t s SER 7 Ca 0.53 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 57.22 1q9t s SER 7 Cb -0.10 0.51 0.00 0.00 0.21 0.00 0.00 66.02 66.63 1q9t s SER 7 CO 0.26 -0.95 0.00 0.61 0.41 0.00 0.00 173.24 173.57 1q9t n GLY 8 N -0.27 2.65 3.74 3.44 0.00 -1.26 -1.19 105.19 112.30 1q9t n GLY 8 Ca -0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 1q9t n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1q9t s GLY 9 N -2.48 2.68 0.00 -0.02 0.00 -1.26 -4.84 107.32 101.40 1q9t s GLY 9 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 44.72 45.75 1q9t s GLY 9 CO 0.00 1.44 0.00 0.61 0.00 0.00 0.00 173.10 175.15 1q9t n GLY 10 N 0.57 -0.65 3.76 0.20 0.00 -0.54 -4.86 105.19 103.67 1q9t n GLY 10 Ca 0.14 -0.95 -0.39 0.00 0.00 0.00 0.00 46.02 44.83 1q9t n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1q9t s LEU 11 N 0.00 4.40 -0.03 0.99 2.96 -1.26 -0.83 118.68 124.90 1q9t s LEU 11 Ca 0.00 1.11 -0.07 0.00 -0.22 0.00 0.00 54.13 54.95 1q9t s LEU 11 Cb 0.00 -2.89 0.01 0.00 0.50 0.00 0.00 46.19 43.81 1q9t s LEU 11 CO 0.00 0.09 0.17 0.54 -1.32 0.00 0.00 176.35 175.83 1q9t s VAL 12 N -0.09 0.04 0.52 1.68 0.11 -0.39 -4.96 120.40 117.31 1q9t s VAL 12 Ca 0.30 -0.35 -0.09 0.00 -2.93 0.00 0.00 61.98 58.91 1q9t s VAL 12 Cb -0.18 -0.36 -0.05 0.00 -1.53 0.00 0.00 36.38 34.26 1q9t s VAL 12 CO 0.16 -0.19 0.89 -1.10 -3.33 0.00 0.00 175.10 171.53 1q9t s GLN 13 N -0.67 3.64 0.22 1.54 -0.21 -1.25 -1.10 119.66 121.83 1q9t s GLN 13 Ca -0.08 0.50 -0.32 0.00 0.02 0.00 0.00 55.36 55.49 1q9t s GLN 13 Cb -0.04 -2.25 -0.13 0.00 1.00 0.00 0.00 33.01 31.58 1q9t s GLN 13 CO 0.01 -0.31 1.48 0.45 -2.12 0.00 0.00 175.29 174.80 1q9t n SER 14 N -2.22 3.00 0.00 5.90 2.88 -1.26 -1.16 113.62 120.76 1q9t n SER 14 Ca 0.03 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 1q9t n SER 14 Cb 0.54 -1.45 0.00 0.00 -0.75 0.00 0.00 64.21 62.55 1q9t n SER 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1q9t n GLY 15 N 2.54 2.26 2.55 0.46 0.00 0.52 -4.93 105.19 108.59 1q9t n GLY 15 Ca 0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.95 1q9t n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q9t n GLY 16 N -2.00 -1.36 3.46 -0.02 0.00 -0.31 -3.91 105.19 101.04 1q9t n GLY 16 Ca 0.00 -1.70 -0.22 0.00 0.00 0.00 0.00 46.02 44.10 1q9t n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1q9t s SER 17 N -4.21 3.02 -0.28 1.61 0.01 -1.26 -1.81 113.70 110.78 1q9t s SER 17 Ca 0.50 -1.18 -0.23 0.00 1.31 0.00 0.00 55.95 56.34 1q9t s SER 17 Cb -0.01 -0.22 0.10 0.00 0.21 0.00 0.00 66.02 66.10 1q9t s SER 17 CO 0.35 -0.29 0.86 -0.22 0.41 0.00 0.00 173.24 174.34 1q9t s LEU 18 N -3.48 -0.64 -0.09 2.44 2.96 -0.44 -4.99 118.68 114.44 1q9t s LEU 18 Ca 0.30 1.18 0.03 0.00 -0.22 0.00 0.00 54.13 55.43 1q9t s LEU 18 Cb 0.03 2.18 -0.01 0.00 0.50 0.00 0.00 46.19 48.89 1q9t s LEU 18 CO 0.13 -0.20 -0.20 -0.60 -1.32 0.00 0.00 176.35 174.15 1q9t s ARG 19 N 0.52 2.98 0.20 1.98 3.52 -1.26 -0.41 118.95 126.48 1q9t s ARG 19 Ca -0.00 -0.82 0.06 0.00 -0.13 0.00 0.00 55.73 54.83 1q9t s ARG 19 Cb -0.05 -2.37 -0.04 0.00 -1.56 0.00 0.00 34.95 30.94 1q9t s ARG 19 CO -0.05 0.27 0.18 -0.51 -0.81 0.00 0.00 175.30 174.38 1q9t s LEU 20 N 0.14 3.87 0.12 -0.88 1.02 0.20 -4.71 118.68 118.43 1q9t s LEU 20 Ca -0.11 -0.14 0.04 0.00 0.02 0.00 0.00 54.13 53.95 1q9t s LEU 20 Cb -0.16 -2.44 -0.04 0.00 0.02 0.00 0.00 46.19 43.57 1q9t s LEU 20 CO 0.06 0.03 -0.10 -0.94 0.02 0.00 0.00 176.35 175.41 1q9t s SER 21 N -3.39 1.67 -0.22 2.29 1.04 -0.33 -1.49 113.70 113.26 1q9t s SER 21 Ca 0.32 -0.92 -0.04 0.00 0.48 0.00 0.00 55.95 55.79 1q9t s SER 21 Cb -0.09 -0.01 0.09 0.00 0.10 0.00 0.00 66.02 66.11 1q9t s SER 21 CO 0.24 -0.29 0.19 0.00 0.98 0.00 0.00 173.24 174.36 1q9t s ALA 23 N 2.25 3.43 0.28 0.00 0.00 -0.45 -0.61 121.76 126.65 1q9t s ALA 23 Ca 0.06 0.02 0.10 0.00 0.00 0.00 0.00 51.96 52.15 1q9t s ALA 23 Cb -0.16 -2.80 -0.05 0.00 0.00 0.00 0.00 23.12 20.11 1q9t s ALA 23 CO -0.19 0.03 -0.16 0.95 0.00 0.00 0.00 175.76 176.40 1q9t s THR 24 N 0.35 2.21 -0.09 0.00 -4.23 -0.81 -1.21 115.64 111.86 1q9t s THR 24 Ca 0.32 -2.31 -0.30 0.00 -1.18 0.00 0.00 61.69 58.22 1q9t s THR 24 Cb -0.17 -2.33 0.12 0.00 1.34 0.00 0.00 72.50 71.45 1q9t s THR 24 CO 0.16 -0.39 0.99 -0.94 -0.54 0.00 0.00 174.62 173.90 1q9t s SER 25 N -3.48 -0.31 0.00 3.99 1.04 -0.53 -4.84 113.70 109.56 1q9t s SER 25 Ca 0.29 0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.83 1q9t s SER 25 Cb -0.02 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.41 1q9t s SER 25 CO 0.13 -0.46 0.00 0.61 0.98 0.00 0.00 173.24 174.50 1q9t n GLY 26 N 0.06 0.82 3.59 7.32 0.00 -1.25 0.40 105.19 116.12 1q9t n GLY 26 Ca -0.07 -0.31 -0.04 0.00 0.00 0.00 0.00 46.02 45.59 1q9t n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1q9t s PHE 27 N -2.00 -0.15 -1.03 1.61 -0.71 -1.26 -4.27 117.98 110.17 1q9t s PHE 27 Ca 0.00 0.08 -0.23 0.00 -1.04 0.00 0.00 56.93 55.74 1q9t s PHE 27 Cb 0.00 0.52 0.03 0.00 -1.21 0.00 0.00 43.02 42.36 1q9t s PHE 27 CO 0.00 -0.27 1.58 0.99 -1.34 0.00 0.00 175.22 176.18 1q9t s THR 28 N -2.54 3.84 0.24 -4.49 2.01 -1.26 -4.90 115.64 108.55 1q9t s THR 28 Ca 0.09 -0.79 -0.14 0.00 0.31 0.00 0.00 61.69 61.16 1q9t s THR 28 Cb -0.00 -4.86 0.31 0.00 0.01 0.00 0.00 72.50 67.95 1q9t s THR 28 CO -0.05 -1.74 1.54 0.33 -0.69 0.00 0.00 174.62 174.01 1q9t n PHE 29 N 9.93 0.14 0.24 4.92 7.35 -1.26 -1.20 117.46 137.57 1q9t n PHE 29 Ca 0.36 1.21 0.16 0.00 -0.76 0.00 0.00 57.45 58.42 1q9t n PHE 29 Cb 0.50 -0.94 0.85 0.00 0.35 0.00 0.00 39.48 40.24 1q9t n PHE 29 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 1q9t h THR 30 N 0.00 0.00 -0.00 -2.13 1.35 -1.90 -1.82 112.91 108.40 1q9t h THR 30 Ca 0.39 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 66.24 1q9t h THR 30 Cb 0.63 0.71 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 1q9t h THR 30 CO -0.99 0.00 -0.23 0.47 -0.25 0.00 0.00 175.52 174.52 1q9t n ASP 31 N -2.60 0.52 -4.52 5.36 8.00 -0.34 -0.62 116.55 122.35 1q9t n ASP 31 Ca -0.02 -0.38 -0.31 0.00 0.71 0.00 0.00 54.79 54.79 1q9t n ASP 31 Cb 0.05 -0.01 -0.11 0.00 -0.02 0.00 0.00 41.12 41.03 1q9t n ASP 31 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1q9t s TYR 32 N -2.70 2.66 0.53 1.24 2.02 -0.69 -4.65 117.35 115.76 1q9t s TYR 32 Ca 0.21 -0.19 -0.17 0.00 -0.37 0.00 0.00 57.07 56.55 1q9t s TYR 32 Cb 0.19 -1.47 -0.07 0.00 -0.40 0.00 0.00 41.96 40.21 1q9t s TYR 32 CO 0.55 0.33 1.00 0.71 -1.57 0.00 0.00 175.55 176.58 1q9t s TYR 33 N -1.04 3.36 -0.02 2.71 1.51 -0.31 -3.95 117.35 119.62 1q9t s TYR 33 Ca 0.17 1.48 0.03 0.00 -1.01 0.00 0.00 57.07 57.74 1q9t s TYR 33 Cb -0.11 -2.83 -0.00 0.00 -0.11 0.00 0.00 41.96 38.91 1q9t s TYR 33 CO 0.08 -0.50 -0.10 -1.64 -1.11 0.00 0.00 175.55 172.28 1q9t s MET 34 N -4.04 0.97 0.24 -0.62 -1.94 -0.38 -1.04 119.30 112.49 1q9t s MET 34 Ca 0.60 -0.36 0.11 0.00 -1.71 0.00 0.00 55.69 54.33 1q9t s MET 34 Cb -0.11 -0.92 -0.05 0.00 2.01 0.00 0.00 34.83 35.77 1q9t s MET 34 CO 0.32 0.17 -0.14 -1.12 -0.01 0.00 0.00 175.02 174.24 1q9t s SER 35 N -0.01 3.91 -0.04 3.03 0.01 -0.31 -0.83 113.70 119.46 1q9t s SER 35 Ca 0.00 -0.82 0.06 0.00 1.31 0.00 0.00 55.95 56.50 1q9t s SER 35 Cb -0.07 -0.50 -0.02 0.00 0.21 0.00 0.00 66.02 65.64 1q9t s SER 35 CO 0.00 0.06 -0.21 0.26 0.41 0.00 0.00 173.24 173.76 1q9t s TRP 36 N -2.13 2.49 0.01 2.43 0.52 -0.63 -1.14 118.94 120.48 1q9t s TRP 36 Ca 0.27 -0.41 0.01 0.00 0.02 0.00 0.00 56.10 55.99 1q9t s TRP 36 Cb -0.07 -1.57 -0.01 0.00 -1.15 0.00 0.00 33.47 30.67 1q9t s TRP 36 CO 0.15 -0.00 -0.03 0.08 0.02 0.00 0.00 176.95 177.17 1q9t s VAL 37 N -0.53 0.19 0.32 4.03 1.01 -0.28 -1.37 120.40 123.78 1q9t s VAL 37 Ca 0.07 -0.29 0.07 0.00 0.00 0.00 0.00 61.98 61.84 1q9t s VAL 37 Cb -0.11 -0.20 -0.06 0.00 0.00 0.00 0.00 36.38 36.00 1q9t s VAL 37 CO 0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 175.10 175.00 1q9t s ARG 38 N -0.37 1.69 -0.25 2.72 1.70 -0.14 0.03 118.95 124.33 1q9t s ARG 38 Ca -0.02 -1.89 -0.02 0.00 -0.47 0.00 0.00 55.73 53.33 1q9t s ARG 38 Cb -0.03 -1.32 0.13 0.00 -0.57 0.00 0.00 34.95 33.16 1q9t s ARG 38 CO -0.00 0.02 0.36 -1.14 -1.08 0.00 0.00 175.30 173.45 1q9t s GLN 39 N -3.72 0.34 0.60 3.89 0.74 0.81 -0.57 119.66 121.75 1q9t s GLN 39 Ca 0.32 0.32 -0.19 0.00 0.05 0.00 0.00 55.36 55.87 1q9t s GLN 39 Cb 0.05 -0.55 -0.03 0.00 1.10 0.00 0.00 33.01 33.58 1q9t s GLN 39 CO 0.14 -0.77 1.22 -2.14 -0.55 0.00 0.00 175.29 173.19 1q9t s PRO 40 N 2.50 2.90 -0.08 1.67 0.02 -1.26 -1.26 135.00 139.48 1q9t s PRO 40 Ca 0.11 1.86 -0.38 0.00 0.02 0.00 0.00 61.00 62.61 1q9t s PRO 40 Cb -0.15 -1.92 -0.16 0.00 0.02 0.00 0.00 34.50 32.30 1q9t s PRO 40 CO -0.21 -1.27 1.52 -2.30 -0.33 0.00 0.00 177.00 174.42 1q9t n PRO 41 N -1.65 1.13 -1.00 5.54 -0.02 -1.26 -1.15 135.00 136.59 1q9t n PRO 41 Ca 0.14 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1q9t n PRO 41 Cb 0.49 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 1q9t n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1q9t n GLY 42 N 3.27 0.26 1.88 -1.23 0.00 -1.26 -4.99 105.19 103.12 1q9t n GLY 42 Ca 0.22 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.08 1q9t n GLY 42 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1q9t n LYS 43 N -1.04 1.31 -1.80 1.61 3.00 -0.30 -5.14 118.16 115.80 1q9t n LYS 43 Ca 0.00 -1.87 -0.31 0.00 -0.00 0.00 0.00 58.31 56.13 1q9t n LYS 43 Cb 0.24 0.45 0.03 0.00 0.00 0.00 0.00 35.03 35.74 1q9t n LYS 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1q9t s ALA 44 N -2.44 2.96 0.45 3.14 0.00 -1.26 -4.68 121.76 119.93 1q9t s ALA 44 Ca 0.03 -0.09 -0.23 0.00 0.00 0.00 0.00 51.96 51.67 1q9t s ALA 44 Cb -0.00 -3.09 -0.08 0.00 0.00 0.00 0.00 23.12 19.95 1q9t s ALA 44 CO 0.02 -0.89 1.15 -0.51 0.00 0.00 0.00 175.76 175.53 1q9t s LEU 45 N -5.30 4.03 -0.08 0.00 1.43 -1.26 -4.31 118.68 113.18 1q9t s LEU 45 Ca 0.56 2.28 -0.02 0.00 -1.03 0.00 0.00 54.13 55.93 1q9t s LEU 45 Cb -0.12 -4.23 0.03 0.00 0.03 0.00 0.00 46.19 41.91 1q9t s LEU 45 CO 0.54 -0.87 0.02 -0.70 0.23 0.00 0.00 176.35 175.58 1q9t s GLU 46 N -2.66 0.42 0.12 1.70 2.12 0.26 -4.98 118.70 115.68 1q9t s GLU 46 Ca 0.63 0.10 -0.30 0.00 0.36 0.00 0.00 54.97 55.75 1q9t s GLU 46 Cb -0.28 -1.05 -0.07 0.00 0.26 0.00 0.00 34.13 32.99 1q9t s GLU 46 CO 0.34 -0.37 1.23 -0.46 -0.54 0.00 0.00 175.26 175.46 1q9t s TRP 47 N 2.02 3.40 -0.18 5.30 -0.00 -1.26 -0.97 118.94 127.25 1q9t s TRP 47 Ca 0.04 1.29 0.09 0.00 -0.00 0.00 0.00 56.10 57.52 1q9t s TRP 47 Cb -0.13 -3.46 -0.17 0.00 -0.00 0.00 0.00 33.47 29.70 1q9t s TRP 47 CO -0.05 -1.42 -0.05 1.28 -0.00 0.00 0.00 176.95 176.70 1q9t n LEU 48 N 3.39 1.34 0.00 5.86 4.77 -0.47 -4.64 117.00 127.25 1q9t n LEU 48 Ca 0.08 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1q9t n LEU 48 Cb 0.45 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1q9t n LEU 48 CO 0.56 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.84 1q9t n GLY 49 N 2.21 0.96 3.25 -0.72 0.00 -1.21 -0.55 105.19 109.13 1q9t n GLY 49 Ca -0.31 -1.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.57 1q9t n GLY 49 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1q9t s PHE 50 N -2.00 0.61 -0.11 1.61 -0.12 -0.45 -1.60 117.98 115.91 1q9t s PHE 50 Ca 0.00 -0.97 0.01 0.00 -0.05 0.00 0.00 56.93 55.92 1q9t s PHE 50 Cb 0.00 -0.25 0.02 0.00 -0.63 0.00 0.00 43.02 42.16 1q9t s PHE 50 CO 0.00 -0.63 -0.13 -1.50 -0.05 0.00 0.00 175.22 172.91 1q9t s ILE 51 N -4.00 1.34 1.00 -4.49 2.07 -0.01 -2.11 121.20 115.01 1q9t s ILE 51 Ca 0.20 -0.52 -0.12 0.00 -1.41 0.00 0.00 60.65 58.80 1q9t s ILE 51 Cb 0.05 -1.26 0.19 0.00 0.13 0.00 0.00 42.46 41.57 1q9t s ILE 51 CO 0.01 0.41 1.08 -0.13 -1.91 0.00 0.00 174.94 174.40 1q9t s ARG 52 N 1.26 0.40 0.72 3.50 0.52 0.21 -1.25 118.95 124.31 1q9t s ARG 52 Ca -0.02 0.79 -0.12 0.00 -0.52 0.00 0.00 55.73 55.86 1q9t s ARG 52 Cb -0.14 -1.71 0.17 0.00 0.52 0.00 0.00 34.95 33.79 1q9t s ARG 52 CO -0.05 -2.82 0.84 0.27 0.02 0.00 0.00 175.30 173.56 1q9t n ASN 52 N -4.28 -0.59 -0.01 0.23 0.23 -1.25 -3.76 115.26 105.82 1q9t n ASN 52 Ca 0.06 -1.19 -0.11 0.00 -0.53 0.00 0.00 54.58 52.82 1q9t n ASN 52 Cb 0.55 -0.68 -0.05 0.00 -2.08 0.00 0.00 39.78 37.53 1q9t n ASN 52 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 1q9t h LYS 52 N 0.00 0.15 -0.38 -3.83 3.64 -1.17 -0.71 116.57 114.28 1q9t h LYS 52 Ca -0.28 -0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.20 1q9t h LYS 52 Cb 0.81 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.58 1q9t h LYS 52 CO 0.20 0.10 0.35 0.00 -2.27 0.00 0.00 179.45 177.83 1q9t h ALA 52 N 1.06 2.14 -0.49 5.00 0.00 -1.94 -0.48 119.26 124.54 1q9t h ALA 52 Ca 0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1q9t h ALA 52 Cb -0.01 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1q9t h ALA 52 CO -0.02 -0.55 0.04 0.09 0.00 0.00 0.00 179.25 178.81 1q9t n ASN 52 N -3.93 4.91 -0.95 0.00 3.02 -0.76 -4.95 115.26 112.59 1q9t n ASN 52 Ca 0.06 -3.04 -0.12 0.00 -0.03 0.00 0.00 54.58 51.45 1q9t n ASN 52 Cb 0.53 -0.65 -0.05 0.00 -0.61 0.00 0.00 39.78 39.00 1q9t n ASN 52 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1q9t n GLY 52 N 0.07 1.33 3.84 7.41 0.00 -0.19 -3.46 105.19 114.20 1q9t n GLY 52 Ca 0.28 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1q9t n GLY 52 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1q9t n TYR 53 N -2.64 -2.05 -2.01 1.61 4.01 -0.34 -4.95 117.16 110.80 1q9t n TYR 53 Ca -0.12 0.77 -0.32 0.00 -0.16 0.00 0.00 57.90 58.07 1q9t n TYR 53 Cb 0.41 -3.51 0.00 0.00 -0.31 0.00 0.00 39.34 35.93 1q9t n TYR 53 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1q9t s THR 54 N -3.21 4.46 0.15 -0.72 -4.23 -1.22 -4.53 115.64 106.34 1q9t s THR 54 Ca 0.62 0.95 0.09 0.00 -1.18 0.00 0.00 61.69 62.17 1q9t s THR 54 Cb -0.32 -3.70 -0.04 0.00 1.34 0.00 0.00 72.50 69.78 1q9t s THR 54 CO 0.77 -0.90 -0.16 0.42 -0.54 0.00 0.00 174.62 174.21 1q9t s THR 55 N -2.91 2.89 0.02 3.99 -4.23 -1.26 0.64 115.64 114.77 1q9t s THR 55 Ca 0.58 -1.64 -0.01 0.00 -1.18 0.00 0.00 61.69 59.44 1q9t s THR 55 Cb -0.12 -2.37 -0.02 0.00 1.34 0.00 0.00 72.50 71.33 1q9t s THR 55 CO 0.45 -0.01 -0.01 -1.61 -0.54 0.00 0.00 174.62 172.90 1q9t s GLU 56 N -2.47 0.30 0.08 3.99 0.41 -0.89 -5.00 118.70 115.12 1q9t s GLU 56 Ca 0.21 -0.54 0.03 0.00 -0.41 0.00 0.00 54.97 54.26 1q9t s GLU 56 Cb -0.10 0.11 -0.03 0.00 -1.78 0.00 0.00 34.13 32.33 1q9t s GLU 56 CO 0.12 -0.05 -0.10 0.71 -0.49 0.00 0.00 175.26 175.45 1q9t s TYR 57 N -1.34 0.97 0.55 1.61 2.02 -1.26 -1.34 117.35 118.56 1q9t s TYR 57 Ca -0.15 -0.62 -0.18 0.00 -0.37 0.00 0.00 57.07 55.75 1q9t s TYR 57 Cb -0.09 -0.55 -0.06 0.00 -0.40 0.00 0.00 41.96 40.87 1q9t s TYR 57 CO -0.01 -0.03 1.07 -1.54 -1.57 0.00 0.00 175.55 173.47 1q9t s SER 58 N -2.21 5.95 0.50 2.29 1.04 0.29 -4.80 113.70 116.75 1q9t s SER 58 Ca 0.01 1.94 0.19 0.00 0.48 0.00 0.00 55.95 58.58 1q9t s SER 58 Cb -0.05 -2.55 1.26 0.00 0.10 0.00 0.00 66.02 64.78 1q9t s SER 58 CO -0.00 -1.06 2.04 -0.65 0.98 0.00 0.00 173.24 174.55 1q9t h PRO 59 N 1.00 0.11 0.00 4.02 0.11 -1.94 -0.98 132.00 134.33 1q9t h PRO 59 Ca -0.49 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1q9t h PRO 59 Cb 1.23 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1q9t h PRO 59 CO 0.58 0.07 -0.03 0.66 -0.21 0.00 0.00 178.00 179.07 1q9t h SER 60 N 0.11 0.00 0.00 -2.05 4.64 -1.94 -3.24 113.55 111.07 1q9t h SER 60 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1q9t h SER 60 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1q9t h SER 60 CO -0.02 0.03 0.00 1.33 -0.87 0.00 0.00 176.83 177.30 1q9t n VAL 61 N -3.48 0.00 -1.67 0.95 0.24 -0.84 -5.03 118.33 108.50 1q9t n VAL 61 Ca -0.02 -0.26 -0.45 0.00 -2.04 0.00 0.00 64.34 61.56 1q9t n VAL 61 Cb 0.14 1.25 -0.03 0.00 -1.47 0.00 0.00 33.84 33.73 1q9t n VAL 61 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1q9t n LYS 62 N -0.25 2.05 -0.41 7.34 4.81 -0.43 -1.21 118.16 130.06 1q9t n LYS 62 Ca 0.00 0.73 0.00 0.00 -0.87 0.00 0.00 58.31 58.17 1q9t n LYS 62 Cb 0.06 -2.44 0.00 0.00 0.02 0.00 0.00 35.03 32.68 1q9t n LYS 62 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1q9t n GLY 63 N 2.68 1.16 0.00 3.14 0.00 -1.26 -4.78 105.19 106.13 1q9t n GLY 63 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1q9t n GLY 63 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1q9t n ARG 64 N -2.00 1.78 -4.51 1.61 0.63 -0.35 -5.05 116.66 108.78 1q9t n ARG 64 Ca 0.00 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.60 1q9t n ARG 64 Cb 0.00 -0.83 -0.11 0.00 0.45 0.00 0.00 32.46 31.98 1q9t n ARG 64 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1q9t s PHE 65 N -1.65 2.90 -0.08 -0.14 0.40 -0.63 -2.40 117.98 116.38 1q9t s PHE 65 Ca 0.00 -0.02 0.02 0.00 -0.60 0.00 0.00 56.93 56.33 1q9t s PHE 65 Cb 0.00 -1.64 0.01 0.00 0.51 0.00 0.00 43.02 41.91 1q9t s PHE 65 CO 0.00 0.36 -0.13 0.99 0.70 0.00 0.00 175.22 177.14 1q9t s THR 66 N -0.94 1.21 -0.10 0.64 2.01 -0.04 -4.82 115.64 113.60 1q9t s THR 66 Ca 0.16 -0.50 -0.04 0.00 0.31 0.00 0.00 61.69 61.62 1q9t s THR 66 Cb -0.11 -1.12 -0.04 0.00 0.01 0.00 0.00 72.50 71.25 1q9t s THR 66 CO 0.06 0.38 0.05 -0.63 -0.69 0.00 0.00 174.62 173.78 1q9t s ILE 67 N 0.82 4.69 0.23 1.82 1.01 -1.26 -0.39 121.20 128.12 1q9t s ILE 67 Ca -0.11 -0.10 -0.06 0.00 0.00 0.00 0.00 60.65 60.37 1q9t s ILE 67 Cb -0.15 -3.00 -0.02 0.00 0.01 0.00 0.00 42.46 39.29 1q9t s ILE 67 CO 0.02 0.60 0.31 -0.94 0.00 0.00 0.00 174.94 174.93 1q9t s SER 68 N -0.87 0.11 0.02 3.58 1.04 -0.89 -4.98 113.70 111.70 1q9t s SER 68 Ca 0.13 -1.19 -0.09 0.00 0.48 0.00 0.00 55.95 55.28 1q9t s SER 68 Cb -0.12 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.50 1q9t s SER 68 CO 0.03 -1.00 0.19 0.00 0.98 0.00 0.00 173.24 173.43 1q9t s ARG 69 N -4.03 0.63 -0.37 4.02 1.70 -1.26 -0.47 118.95 119.17 1q9t s ARG 69 Ca 0.31 -0.52 -0.02 0.00 -0.47 0.00 0.00 55.73 55.03 1q9t s ARG 69 Cb 0.03 0.26 0.09 0.00 -0.57 0.00 0.00 34.95 34.76 1q9t s ARG 69 CO 0.11 -0.17 0.13 0.34 -1.08 0.00 0.00 175.30 174.63 1q9t s ASP 70 N -1.80 5.10 0.11 -2.89 3.68 0.20 -4.96 116.67 116.12 1q9t s ASP 70 Ca -0.09 -1.81 0.25 0.00 2.13 0.00 0.00 52.55 53.04 1q9t s ASP 70 Cb -0.03 -1.78 0.97 0.00 -1.45 0.00 0.00 42.92 40.63 1q9t s ASP 70 CO -0.01 -0.44 1.78 0.59 0.13 0.00 0.00 175.17 177.22 1q9t n ASN 71 N 4.57 0.38 -0.01 -0.34 5.03 -1.26 -0.36 115.26 123.27 1q9t n ASN 71 Ca -0.05 0.55 -0.17 0.00 0.87 0.00 0.00 54.58 55.78 1q9t n ASN 71 Cb 0.42 -0.65 -0.09 0.00 -1.02 0.00 0.00 39.78 38.45 1q9t n ASN 71 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1q9t h SER 72 N 0.00 0.79 -0.01 6.41 0.02 -1.96 -3.34 113.55 115.45 1q9t h SER 72 Ca 0.00 -0.66 0.00 0.00 -0.84 0.00 0.00 61.79 60.29 1q9t h SER 72 Cb 0.53 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1q9t h SER 72 CO 0.00 1.33 -0.25 0.00 -1.14 0.00 0.00 176.83 176.77 1q9t n GLN 73 N -4.06 1.77 -3.10 3.45 6.02 -1.17 -5.00 117.38 115.29 1q9t n GLN 73 Ca -0.09 -0.77 -0.13 0.00 -0.01 0.00 0.00 57.00 56.00 1q9t n GLN 73 Cb 0.71 -1.19 0.05 0.00 1.02 0.00 0.00 30.24 30.83 1q9t n GLN 73 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1q9t n SER 74 N -0.09 -4.14 -4.43 1.08 7.64 0.51 -4.74 113.62 109.44 1q9t n SER 74 Ca 0.06 -0.33 -0.33 0.00 1.01 0.00 0.00 58.87 59.28 1q9t n SER 74 Cb 0.29 -3.21 -0.14 0.00 -1.01 0.00 0.00 64.21 60.14 1q9t n SER 74 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1q9t s ILE 75 N -3.19 3.15 -0.06 0.44 1.01 -0.87 -1.93 121.20 119.74 1q9t s ILE 75 Ca 0.29 -0.65 -0.02 0.00 0.00 0.00 0.00 60.65 60.26 1q9t s ILE 75 Cb -0.13 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 1q9t s ILE 75 CO 0.43 0.55 0.06 -0.22 0.00 0.00 0.00 174.94 175.77 1q9t s LEU 76 N -0.10 3.87 0.15 2.97 2.96 0.22 -0.63 118.68 128.11 1q9t s LEU 76 Ca -0.01 0.21 0.09 0.00 -0.22 0.00 0.00 54.13 54.20 1q9t s LEU 76 Cb -0.14 -2.04 -0.04 0.00 0.50 0.00 0.00 46.19 44.47 1q9t s LEU 76 CO 0.03 0.34 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.90 1q9t s TYR 77 N -1.03 1.84 -0.19 5.38 2.02 0.38 -0.46 117.35 125.29 1q9t s TYR 77 Ca 0.17 -0.45 -0.04 0.00 -0.37 0.00 0.00 57.07 56.39 1q9t s TYR 77 Cb -0.12 -0.95 0.06 0.00 -0.40 0.00 0.00 41.96 40.56 1q9t s TYR 77 CO 0.07 0.30 0.07 -1.17 -1.57 0.00 0.00 175.55 173.25 1q9t s LEU 78 N -2.41 0.74 -0.15 -1.29 2.96 -0.56 -2.09 118.68 115.87 1q9t s LEU 78 Ca 0.13 -0.76 -0.17 0.00 -0.22 0.00 0.00 54.13 53.11 1q9t s LEU 78 Cb -0.07 -0.40 -0.04 0.00 0.50 0.00 0.00 46.19 46.17 1q9t s LEU 78 CO 0.06 -0.34 0.42 -1.58 -1.32 0.00 0.00 176.35 173.59 1q9t s GLN 79 N 2.01 4.27 -0.06 1.98 2.00 0.48 -0.63 119.66 129.71 1q9t s GLN 79 Ca 0.01 0.31 0.06 0.00 -2.00 0.00 0.00 55.36 53.74 1q9t s GLN 79 Cb -0.16 -3.47 -0.01 0.00 0.80 0.00 0.00 33.01 30.17 1q9t s GLN 79 CO -0.11 0.11 -0.25 -1.64 -0.50 0.00 0.00 175.29 172.90 1q9t s MET 80 N 0.82 2.54 0.25 1.67 -1.94 0.46 -0.86 119.30 122.25 1q9t s MET 80 Ca 0.22 -0.90 0.05 0.00 -1.71 0.00 0.00 55.69 53.35 1q9t s MET 80 Cb -0.14 -2.17 -0.05 0.00 2.01 0.00 0.00 34.83 34.48 1q9t s MET 80 CO 0.08 0.39 -0.04 -0.80 -0.01 0.00 0.00 175.02 174.64 1q9t s ASN 81 N -0.18 2.34 -1.26 3.03 0.01 -1.01 -1.33 114.94 116.54 1q9t s ASN 81 Ca -0.03 -1.18 -0.29 0.00 -0.71 0.00 0.00 52.86 50.65 1q9t s ASN 81 Cb -0.14 -0.09 0.04 0.00 0.41 0.00 0.00 41.25 41.47 1q9t s ASN 81 CO 0.04 -0.40 0.59 0.41 -1.51 0.00 0.00 177.10 176.23 1q9t n THR 82 N -0.49 -2.72 -2.13 1.60 -1.04 -1.06 -4.85 114.28 103.59 1q9t n THR 82 Ca -0.06 -0.61 -0.38 0.00 -2.04 0.00 0.00 64.05 60.96 1q9t n THR 82 Cb 0.63 -2.27 0.00 0.00 -1.82 0.00 0.00 70.33 66.88 1q9t n THR 82 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1q9t s LEU 82 N -7.39 4.00 0.22 -4.42 1.02 -0.75 -4.67 118.68 106.68 1q9t s LEU 82 Ca 0.42 2.44 0.04 0.00 0.02 0.00 0.00 54.13 57.05 1q9t s LEU 82 Cb -0.23 -4.21 -0.05 0.00 0.02 0.00 0.00 46.19 41.73 1q9t s LEU 82 CO 0.97 -1.04 -0.03 -0.13 0.02 0.00 0.00 176.35 176.13 1q9t s ARG 83 N -2.68 1.30 0.30 1.70 1.81 -1.26 -0.35 118.95 119.77 1q9t s ARG 83 Ca 0.64 -1.64 0.06 0.00 -1.72 0.00 0.00 55.73 53.08 1q9t s ARG 83 Cb -0.32 -0.67 0.78 0.00 -0.45 0.00 0.00 34.95 34.28 1q9t s ARG 83 CO 0.39 -0.05 1.74 0.00 -0.68 0.00 0.00 175.30 176.70 1q9t h ALA 84 N 2.52 1.63 0.00 2.13 0.00 -1.97 0.29 119.26 123.86 1q9t h ALA 84 Ca -0.38 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1q9t h ALA 84 Cb 1.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1q9t h ALA 84 CO 0.64 -0.21 0.01 1.49 0.00 0.00 0.00 179.25 181.18 1q9t h GLU 85 N 0.59 0.00 -0.01 0.00 4.81 -1.96 -0.63 114.58 117.39 1q9t h GLU 85 Ca 0.59 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.82 1q9t h GLU 85 Cb 1.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.43 1q9t h GLU 85 CO -0.45 0.00 -0.10 -0.25 -0.73 0.00 0.00 179.01 177.48 1q9t n ASP 86 N -2.68 1.01 -4.68 1.04 10.43 0.10 -4.84 116.55 116.94 1q9t n ASP 86 Ca -0.02 -1.08 -0.42 0.00 2.57 0.00 0.00 54.79 55.84 1q9t n ASP 86 Cb 0.06 0.03 -0.03 0.00 1.84 0.00 0.00 41.12 43.02 1q9t n ASP 86 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 1q9t s SER 87 N -2.25 6.75 -0.09 -2.24 0.01 -0.24 -4.87 113.70 110.77 1q9t s SER 87 Ca 0.33 2.19 -0.32 0.00 1.31 0.00 0.00 55.95 59.45 1q9t s SER 87 Cb 0.20 -2.55 0.14 0.00 0.21 0.00 0.00 66.02 64.02 1q9t s SER 87 CO 0.42 -0.83 1.42 0.00 0.41 0.00 0.00 173.24 174.67 1q9t s ALA 88 N 3.11 -2.54 -0.12 1.44 0.00 -0.60 -4.46 121.76 118.60 1q9t s ALA 88 Ca 0.68 0.82 -0.19 0.00 0.00 0.00 0.00 51.96 53.26 1q9t s ALA 88 Cb -0.33 0.36 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 1q9t s ALA 88 CO 0.27 -1.08 0.53 0.99 0.00 0.00 0.00 175.76 176.47 1q9t s THR 89 N -2.04 5.15 -0.20 0.00 2.01 -0.39 -0.60 115.64 119.58 1q9t s THR 89 Ca 0.18 1.05 -0.06 0.00 0.31 0.00 0.00 61.69 63.17 1q9t s THR 89 Cb 0.06 -3.86 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 1q9t s THR 89 CO -0.06 0.30 0.02 -0.31 -0.69 0.00 0.00 174.62 173.88 1q9t s TYR 90 N 0.76 3.09 -0.01 4.92 1.51 0.32 -0.13 117.35 127.80 1q9t s TYR 90 Ca 0.28 -0.30 0.05 0.00 -1.01 0.00 0.00 57.07 56.09 1q9t s TYR 90 Cb -0.16 -2.09 -0.03 0.00 -0.11 0.00 0.00 41.96 39.58 1q9t s TYR 90 CO 0.12 -0.14 -0.15 0.71 -1.11 0.00 0.00 175.55 174.98 1q9t s TYR 91 N 0.86 2.66 0.09 2.71 2.02 0.10 -1.05 117.35 124.75 1q9t s TYR 91 Ca 0.02 -0.19 0.03 0.00 -0.37 0.00 0.00 57.07 56.56 1q9t s TYR 91 Cb -0.14 -1.57 -0.04 0.00 -0.40 0.00 0.00 41.96 39.81 1q9t s TYR 91 CO 0.02 0.22 0.08 0.00 -1.57 0.00 0.00 175.55 174.30 1q9t s ALA 93 N -1.43 -0.61 -0.07 0.00 0.00 -0.29 -1.66 121.76 117.71 1q9t s ALA 93 Ca 0.29 0.53 -0.30 0.00 0.00 0.00 0.00 51.96 52.48 1q9t s ALA 93 Cb -0.12 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1q9t s ALA 93 CO 0.22 -0.16 1.24 0.50 0.00 0.00 0.00 175.76 177.56 1q9t s ARG 94 N -0.33 4.32 0.00 0.00 3.52 0.42 -1.16 118.95 125.72 1q9t s ARG 94 Ca -0.04 1.71 0.00 0.00 -0.13 0.00 0.00 55.73 57.27 1q9t s ARG 94 Cb -0.03 -3.60 0.00 0.00 -1.56 0.00 0.00 34.95 29.76 1q9t s ARG 94 CO 0.01 -0.51 0.00 -3.47 -0.81 0.00 0.00 175.30 170.52 1q9t n ASP 95 N 5.48 0.24 -3.59 -2.12 4.64 -0.20 -3.25 116.55 117.74 1q9t n ASP 95 Ca 0.12 0.00 -0.33 0.00 -1.38 0.00 0.00 54.79 53.20 1q9t n ASP 95 Cb 0.46 0.00 0.01 0.00 -1.04 0.00 0.00 41.12 40.55 1q9t n ASP 95 CO 0.00 0.00 0.00 1.57 -0.82 0.00 0.00 177.20 177.95 1q9t n HIS 96 N 0.00 -2.64 -1.88 -0.67 -0.00 -1.26 -4.26 115.22 104.51 1q9t n HIS 96 Ca 0.00 0.35 0.02 0.00 0.46 0.00 0.00 57.72 58.55 1q9t n HIS 96 Cb 0.00 -1.41 0.02 0.00 -0.12 0.00 0.00 29.99 28.48 1q9t n HIS 96 CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 1q9t n ASP 97 N 2.21 0.40 0.00 0.26 5.75 -1.26 -1.16 116.55 122.74 1q9t n ASP 97 Ca 0.06 -2.17 0.00 0.00 -0.01 0.00 0.00 54.79 52.67 1q9t n ASP 97 Cb 0.41 -0.24 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 1q9t n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1q9t n GLY 98 N -0.20 3.18 0.59 6.12 0.00 -1.26 -4.78 105.19 108.84 1q9t n GLY 98 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 1q9t n GLY 98 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1q9t n TYR 99 N -1.75 0.00 -3.50 1.61 4.02 -1.26 -5.05 117.16 111.22 1q9t n TYR 99 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.52 1q9t n TYR 99 Cb 0.00 -0.32 -0.06 0.00 -0.02 0.00 0.00 39.34 38.94 1q9t n TYR 99 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1q9t s TYR 100 N -2.36 3.68 -0.58 -0.72 2.02 -1.26 -5.06 117.35 113.07 1q9t s TYR 100 Ca -0.15 0.95 -0.15 0.00 -0.37 0.00 0.00 57.07 57.35 1q9t s TYR 100 Cb 0.04 -2.26 0.14 0.00 -0.40 0.00 0.00 41.96 39.48 1q9t s TYR 100 CO 0.21 0.59 0.52 -1.21 -1.57 0.00 0.00 175.55 174.09 1q9t s GLU 100 N -1.40 3.01 0.00 -0.62 0.41 -1.26 -4.12 118.70 114.72 1q9t s GLU 100 Ca 0.28 -1.85 0.00 0.00 -0.41 0.00 0.00 54.97 52.99 1q9t s GLU 100 Cb -0.16 -4.26 0.00 0.00 -1.78 0.00 0.00 34.13 27.93 1q9t s GLU 100 CO 0.15 -1.30 0.00 2.89 -0.49 0.00 0.00 175.26 176.51 1q9t n ARG 100 N 4.98 0.00 -3.29 1.61 1.85 -1.26 -5.07 116.66 115.48 1q9t n ARG 100 Ca -0.09 0.00 -0.46 0.00 -1.00 0.00 0.00 57.85 56.31 1q9t n ARG 100 Cb 0.41 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.81 1q9t n ARG 100 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1q9t s PHE 100 N -2.00 3.96 0.21 2.89 0.08 -1.26 -4.09 117.98 117.77 1q9t s PHE 100 Ca 0.00 -2.30 -0.02 0.00 0.12 0.00 0.00 56.93 54.73 1q9t s PHE 100 Cb 0.00 -3.88 0.17 0.00 -0.57 0.00 0.00 43.02 38.74 1q9t s PHE 100 CO 0.00 -1.02 1.56 0.66 -0.10 0.00 0.00 175.22 176.32 1q9t h SER 100 N 7.27 0.61 -3.68 1.36 4.64 -1.89 -3.45 113.55 118.42 1q9t h SER 100 Ca 0.16 -0.29 -0.55 0.00 -0.47 0.00 0.00 61.79 60.64 1q9t h SER 100 Cb 0.95 -0.17 -0.32 0.00 -0.31 0.00 0.00 62.40 62.55 1q9t h SER 100 CO 0.92 0.98 -0.83 -0.31 -0.87 0.00 0.00 176.83 176.72 1q9t s TYR 100 N -4.15 1.65 0.14 4.77 2.02 -1.26 -5.01 117.35 115.51 1q9t s TYR 100 Ca -0.07 -0.54 0.08 0.00 -0.37 0.00 0.00 57.07 56.17 1q9t s TYR 100 Cb 0.12 -1.15 -0.04 0.00 -0.40 0.00 0.00 41.96 40.49 1q9t s TYR 100 CO 0.83 -0.22 -0.19 -1.58 -1.57 0.00 0.00 175.55 172.81 1q9t s TRP 101 N 0.29 1.81 0.83 2.71 0.52 -1.26 -0.43 118.94 123.40 1q9t s TRP 101 Ca -0.09 -0.45 -0.13 0.00 0.02 0.00 0.00 56.10 55.46 1q9t s TRP 101 Cb -0.13 -0.94 0.19 0.00 -1.15 0.00 0.00 33.47 31.44 1q9t s TRP 101 CO 0.03 0.28 1.13 0.41 0.02 0.00 0.00 176.95 178.82 1q9t n GLY 102 N 0.63 -1.16 0.16 0.98 0.00 -0.66 -4.75 105.19 100.39 1q9t n GLY 102 Ca -0.16 -1.75 0.12 0.00 0.00 0.00 0.00 46.02 44.23 1q9t n GLY 102 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1q9t h GLN 103 N 0.00 0.00 0.00 1.61 -0.00 -1.91 -3.46 115.11 111.35 1q9t h GLN 103 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.28 1q9t h GLN 103 Cb 1.05 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.53 1q9t h GLN 103 CO 0.27 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.51 1q9t n GLY 104 N 1.19 0.07 3.05 0.06 0.00 -1.26 -5.03 105.19 103.27 1q9t n GLY 104 Ca 0.04 -1.54 -0.24 0.00 0.00 0.00 0.00 46.02 44.28 1q9t n GLY 104 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1q9t s THR 105 N -2.72 1.11 -0.17 2.61 -1.32 -0.22 -4.84 115.64 110.09 1q9t s THR 105 Ca 0.00 -0.51 -0.21 0.00 -1.21 0.00 0.00 61.69 59.76 1q9t s THR 105 Cb 0.00 -0.98 -0.03 0.00 -1.51 0.00 0.00 72.50 69.98 1q9t s THR 105 CO 0.00 0.34 0.65 -0.22 -2.21 0.00 0.00 174.62 173.17 1q9t s LEU 106 N 0.34 4.18 -0.15 9.08 2.96 -1.26 -0.53 118.68 133.30 1q9t s LEU 106 Ca -0.08 0.91 -0.04 0.00 -0.22 0.00 0.00 54.13 54.70 1q9t s LEU 106 Cb -0.12 -2.93 -0.03 0.00 0.50 0.00 0.00 46.19 43.60 1q9t s LEU 106 CO 0.02 -0.24 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.10 1q9t s VAL 107 N 1.68 4.11 -0.16 1.68 1.01 0.24 -1.46 120.40 127.48 1q9t s VAL 107 Ca 0.31 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 62.01 1q9t s VAL 107 Cb -0.16 -2.80 0.02 0.00 0.00 0.00 0.00 36.38 33.44 1q9t s VAL 107 CO 0.12 0.50 -0.18 -0.89 0.00 0.00 0.00 175.10 174.65 1q9t s THR 108 N 0.22 1.86 -0.39 3.92 2.01 -0.01 -1.55 115.64 121.70 1q9t s THR 108 Ca -0.01 -0.82 -0.15 0.00 0.31 0.00 0.00 61.69 61.02 1q9t s THR 108 Cb -0.13 -1.70 0.01 0.00 0.01 0.00 0.00 72.50 70.68 1q9t s THR 108 CO 0.02 0.51 0.30 -0.69 -0.69 0.00 0.00 174.62 174.07 1q9t s VAL 109 N 1.33 5.25 0.11 3.82 1.01 -1.26 -1.27 120.40 129.39 1q9t s VAL 109 Ca 0.04 -0.52 -0.25 0.00 0.00 0.00 0.00 61.98 61.25 1q9t s VAL 109 Cb -0.13 -3.89 0.08 0.00 0.00 0.00 0.00 36.38 32.44 1q9t s VAL 109 CO -0.11 -0.24 0.75 -0.55 0.00 0.00 0.00 175.10 174.95 1q9t s SER 110 N 1.70 -0.42 0.06 3.32 0.15 -0.26 -4.65 113.70 113.59 1q9t s SER 110 Ca 0.06 -0.10 0.23 0.00 0.70 0.00 0.00 55.95 56.83 1q9t s SER 110 Cb -0.18 0.52 -0.00 0.00 -1.71 0.00 0.00 66.02 64.65 1q9t s SER 110 CO 0.10 -0.88 0.97 0.00 1.20 0.00 0.00 173.24 174.64 1q9t n ALA 111 N -0.35 3.29 -1.47 5.45 0.00 -1.26 -3.85 120.51 122.31 1q9t n ALA 111 Ca -0.12 -0.40 -0.35 0.00 0.00 0.00 0.00 53.44 52.57 1q9t n ALA 111 Cb 0.63 -0.96 0.09 0.00 0.00 0.00 0.00 19.45 19.21 1q9t n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q9t s ALA 112 N -3.24 2.17 0.41 0.00 0.00 -1.26 -5.00 121.76 114.84 1q9t s ALA 112 Ca 0.02 1.04 -0.11 0.00 0.00 0.00 0.00 51.96 52.91 1q9t s ALA 112 Cb 0.14 -3.52 -0.06 0.00 0.00 0.00 0.00 23.12 19.68 1q9t s ALA 112 CO 0.81 -1.85 0.77 0.15 0.00 0.00 0.00 175.76 175.65 1q9t s LYS 113 N -3.70 3.78 0.07 0.00 1.02 -1.26 -5.01 119.74 114.64 1q9t s LYS 113 Ca 0.78 0.48 -0.31 0.00 0.02 0.00 0.00 55.97 56.94 1q9t s LYS 113 Cb -0.33 -2.39 -0.07 0.00 -0.52 0.00 0.00 37.83 34.53 1q9t s LYS 113 CO 0.44 -0.04 1.31 0.99 -0.92 0.00 0.00 175.35 177.13 1q9t s THR 114 N -2.38 3.67 -0.09 2.17 2.01 -1.26 -4.70 115.64 115.06 1q9t s THR 114 Ca 0.51 1.18 0.00 0.00 0.31 0.00 0.00 61.69 63.69 1q9t s THR 114 Cb -0.10 -3.76 0.02 0.00 0.01 0.00 0.00 72.50 68.67 1q9t s THR 114 CO 0.31 0.07 -0.07 -0.89 -0.69 0.00 0.00 174.62 173.35 1q9t s THR 115 N 1.32 0.92 0.62 -0.82 2.01 0.40 -4.94 115.64 115.15 1q9t s THR 115 Ca 0.62 -0.26 -0.16 0.00 0.31 0.00 0.00 61.69 62.20 1q9t s THR 115 Cb -0.33 -0.93 -0.02 0.00 0.01 0.00 0.00 72.50 71.23 1q9t s THR 115 CO 0.29 0.34 1.11 -2.16 -0.69 0.00 0.00 174.62 173.51 1q9t s PRO 116 N 1.43 2.99 0.65 4.92 0.04 -1.26 -1.50 135.00 142.26 1q9t s PRO 116 Ca -0.01 1.42 -0.11 0.00 0.04 0.00 0.00 61.00 62.34 1q9t s PRO 116 Cb -0.13 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.41 1q9t s PRO 116 CO -0.04 -1.11 1.05 -1.25 0.04 0.00 0.00 177.00 175.69 1q9t s PRO 117 N -3.90 3.34 -0.11 0.56 0.04 -1.26 -4.47 135.00 129.20 1q9t s PRO 117 Ca 0.68 0.63 -0.03 0.00 0.04 0.00 0.00 61.00 62.32 1q9t s PRO 117 Cb -0.21 -2.07 -0.03 0.00 0.04 0.00 0.00 34.50 32.23 1q9t s PRO 117 CO 0.37 -0.72 0.03 -1.12 0.04 0.00 0.00 177.00 175.60 1q9t s SER 118 N -4.24 5.42 -0.17 6.66 0.01 -0.15 -4.92 113.70 116.30 1q9t s SER 118 Ca 0.56 0.16 0.01 0.00 1.31 0.00 0.00 55.95 57.99 1q9t s SER 118 Cb -0.11 -1.64 0.02 0.00 0.21 0.00 0.00 66.02 64.49 1q9t s SER 118 CO 0.53 0.34 -0.20 -0.69 0.41 0.00 0.00 173.24 173.63 1q9t s VAL 119 N -0.65 2.11 -0.01 3.43 1.01 -1.26 -0.80 120.40 124.23 1q9t s VAL 119 Ca 0.11 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 61.23 1q9t s VAL 119 Cb -0.12 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 1q9t s VAL 119 CO 0.02 0.54 -0.23 -0.31 0.00 0.00 0.00 175.10 175.12 1q9t s TYR 120 N 1.22 2.43 0.32 5.22 2.02 -0.01 -4.96 117.35 123.59 1q9t s TYR 120 Ca 0.03 -0.36 -0.27 0.00 -0.37 0.00 0.00 57.07 56.10 1q9t s TYR 120 Cb -0.13 -1.51 -0.09 0.00 -0.40 0.00 0.00 41.96 39.82 1q9t s TYR 120 CO -0.11 0.05 1.00 -1.25 -1.57 0.00 0.00 175.55 173.68 1q9t s PRO 121 N -0.78 4.52 -0.36 -1.71 0.04 -1.26 -0.88 135.00 134.57 1q9t s PRO 121 Ca 0.11 1.49 0.01 0.00 0.04 0.00 0.00 61.00 62.66 1q9t s PRO 121 Cb -0.10 -2.88 0.10 0.00 0.04 0.00 0.00 34.50 31.67 1q9t s PRO 121 CO 0.00 0.19 0.11 -0.51 0.04 0.00 0.00 177.00 176.83 1q9t s LEU 122 N -1.97 4.93 0.08 -3.56 1.43 0.44 -4.87 118.68 115.16 1q9t s LEU 122 Ca 0.50 -2.09 0.09 0.00 -1.03 0.00 0.00 54.13 51.59 1q9t s LEU 122 Cb -0.23 -1.71 -0.03 0.00 0.03 0.00 0.00 46.19 44.25 1q9t s LEU 122 CO 0.29 -0.44 -0.22 0.00 0.23 0.00 0.00 176.35 176.22 1q9t s ALA 123 N 1.00 2.50 0.37 4.21 0.00 -1.26 -1.39 121.76 127.19 1q9t s ALA 123 Ca 0.10 -1.30 -0.26 0.00 0.00 0.00 0.00 51.96 50.49 1q9t s ALA 123 Cb -0.20 -0.59 -0.12 0.00 0.00 0.00 0.00 23.12 22.21 1q9t s ALA 123 CO -0.06 0.56 1.13 -2.30 0.00 0.00 0.00 175.76 175.09 1q9t n PRO 124 N 1.29 1.66 -1.06 0.00 -0.02 -1.26 -4.94 135.00 130.67 1q9t n PRO 124 Ca -0.17 0.59 -0.30 0.00 -2.02 0.00 0.00 63.50 61.60 1q9t n PRO 124 Cb 0.52 -2.14 0.14 0.00 -0.02 0.00 0.00 33.50 32.01 1q9t n PRO 124 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1q9t s GLY 125 N -0.55 1.64 -0.83 -1.23 0.00 -1.26 -4.47 107.32 100.61 1q9t s GLY 125 Ca 0.60 0.13 -0.07 0.00 0.00 0.00 0.00 44.72 45.37 1q9t s GLY 125 CO 0.59 0.59 2.91 1.44 0.00 0.00 0.00 173.10 178.63 1q9t n SER 126 N -3.96 6.35 0.00 1.64 7.64 -1.26 -2.37 113.62 121.66 1q9t n SER 126 Ca 0.08 -2.43 0.00 0.00 1.01 0.00 0.00 58.87 57.53 1q9t n SER 126 Cb 0.54 -1.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 1q9t n SER 126 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1q9t n ALA 127 N 3.28 0.00 -2.13 -0.43 0.00 -1.26 -5.10 120.51 114.87 1q9t n ALA 127 Ca 0.56 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.58 1q9t n ALA 127 Cb 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.86 1q9t n ALA 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q9t s ALA 128 N -0.09 3.46 0.35 0.00 0.00 -1.00 -4.99 121.76 119.48 1q9t s ALA 128 Ca 0.00 0.97 -0.26 0.00 0.00 0.00 0.00 51.96 52.67 1q9t s ALA 128 Cb 0.00 -3.44 -0.09 0.00 0.00 0.00 0.00 23.12 19.58 1q9t s ALA 128 CO 0.00 -0.43 1.01 1.14 0.00 0.00 0.00 175.76 177.48 1q9t s GLN 129 N 0.15 4.41 -0.07 0.00 -2.07 -1.26 -4.90 119.66 115.93 1q9t s GLN 129 Ca 0.56 1.46 -0.26 0.00 -1.82 0.00 0.00 55.36 55.30 1q9t s GLN 129 Cb -0.33 -2.73 -0.03 0.00 -1.09 0.00 0.00 33.01 28.83 1q9t s GLN 129 CO 0.35 0.09 0.81 -0.08 -1.32 0.00 0.00 175.29 175.14 1q9t s THR 130 N -1.58 4.96 0.00 3.63 -1.32 -1.26 -5.05 115.64 115.02 1q9t s THR 130 Ca 0.53 1.68 0.00 0.00 -1.21 0.00 0.00 61.69 62.68 1q9t s THR 130 Cb -0.22 -4.15 0.00 0.00 -1.51 0.00 0.00 72.50 66.63 1q9t s THR 130 CO 0.27 0.18 0.00 0.59 -2.21 0.00 0.00 174.62 173.45 1q9t n ASN 131 N 4.11 1.79 0.19 8.08 3.02 -1.26 -5.05 115.26 126.14 1q9t n ASN 131 Ca 0.02 -0.28 -0.14 0.00 -0.03 0.00 0.00 54.58 54.15 1q9t n ASN 131 Cb 0.51 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.61 1q9t n ASN 131 CO 0.00 0.00 0.00 -1.28 -2.62 0.00 0.00 177.26 173.36 1q9t h SER 132 N 0.00 -0.60 -2.87 6.41 0.87 -1.98 -3.42 113.55 111.96 1q9t h SER 132 Ca 0.00 0.05 -0.60 0.00 -1.23 0.00 0.00 61.79 60.01 1q9t h SER 132 Cb 0.00 0.20 -0.09 0.00 -0.44 0.00 0.00 62.40 62.07 1q9t h SER 132 CO 0.00 -0.35 -0.60 -0.32 -0.53 0.00 0.00 176.83 175.03 1q9t s MET 133 N -6.09 2.77 -0.01 2.24 1.75 -1.26 -1.47 119.30 117.23 1q9t s MET 133 Ca -0.16 -0.88 0.03 0.00 -1.25 0.00 0.00 55.69 53.43 1q9t s MET 133 Cb 0.06 -2.59 -0.01 0.00 2.84 0.00 0.00 34.83 35.13 1q9t s MET 133 CO 0.64 0.50 -0.10 0.54 -0.65 0.00 0.00 175.02 175.95 1q9t s VAL 134 N -1.65 0.80 -0.12 10.11 0.11 0.29 -4.75 120.40 125.18 1q9t s VAL 134 Ca 0.30 -0.42 0.00 0.00 -2.93 0.00 0.00 61.98 58.93 1q9t s VAL 134 Cb -0.10 -0.67 -0.02 0.00 -1.53 0.00 0.00 36.38 34.06 1q9t s VAL 134 CO 0.22 0.23 -0.13 -0.89 -3.33 0.00 0.00 175.10 171.20 1q9t s THR 135 N -0.16 3.08 0.42 5.04 2.01 -1.26 -0.64 115.64 124.13 1q9t s THR 135 Ca 0.03 -0.66 0.04 0.00 0.31 0.00 0.00 61.69 61.41 1q9t s THR 135 Cb -0.05 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 70.13 1q9t s THR 135 CO -0.00 0.53 0.04 -0.76 -0.69 0.00 0.00 174.62 173.74 1q9t s LEU 136 N 0.22 2.41 0.00 4.42 1.43 0.43 -4.64 118.68 122.94 1q9t s LEU 136 Ca -0.08 -1.51 -0.19 0.00 -1.03 0.00 0.00 54.13 51.32 1q9t s LEU 136 Cb -0.15 -0.61 0.07 0.00 0.03 0.00 0.00 46.19 45.52 1q9t s LEU 136 CO 0.05 -0.69 0.90 0.61 0.23 0.00 0.00 176.35 177.45 1q9t n GLY 137 N -1.00 0.72 2.92 -3.19 0.00 -0.48 -0.92 105.19 103.24 1q9t n GLY 137 Ca -0.09 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 1q9t n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q9t s LEU 139 N 0.52 3.49 -0.44 0.00 2.96 -0.06 -1.66 118.68 123.49 1q9t s LEU 139 Ca -0.04 -0.18 -0.05 0.00 -0.22 0.00 0.00 54.13 53.65 1q9t s LEU 139 Cb -0.06 -1.93 0.12 0.00 0.50 0.00 0.00 46.19 44.82 1q9t s LEU 139 CO -0.02 -0.02 0.25 -0.69 -1.32 0.00 0.00 176.35 174.55 1q9t s VAL 140 N 1.53 3.55 -0.03 1.68 1.01 0.78 -0.83 120.40 128.10 1q9t s VAL 140 Ca 0.06 -2.04 0.05 0.00 0.00 0.00 0.00 61.98 60.05 1q9t s VAL 140 Cb -0.15 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 1q9t s VAL 140 CO 0.04 -0.72 -0.17 -0.75 0.00 0.00 0.00 175.10 173.50 1q9t s LYS 141 N 1.13 2.35 -0.61 2.72 2.20 0.02 -0.68 119.74 126.87 1q9t s LYS 141 Ca 0.08 -0.79 -0.03 0.00 -0.36 0.00 0.00 55.97 54.87 1q9t s LYS 141 Cb -0.23 -2.28 0.00 0.00 -1.51 0.00 0.00 37.83 33.80 1q9t s LYS 141 CO -0.03 0.60 0.52 0.41 -0.36 0.00 0.00 175.35 176.48 1q9t n GLY 142 N 2.16 0.18 3.64 5.54 0.00 -0.51 -0.97 105.19 115.23 1q9t n GLY 142 Ca -0.17 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.39 1q9t n GLY 142 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1q9t s TYR 143 N -3.16 2.59 -0.28 1.61 1.13 -0.67 -4.53 117.35 114.03 1q9t s TYR 143 Ca 0.16 -0.38 -0.23 0.00 -1.41 0.00 0.00 57.07 55.21 1q9t s TYR 143 Cb -0.07 -1.43 0.10 0.00 -1.10 0.00 0.00 41.96 39.46 1q9t s TYR 143 CO 0.34 0.49 0.89 0.12 -2.51 0.00 0.00 175.55 174.88 1q9t s PHE 144 N -2.47 -0.65 0.43 -3.49 5.36 -0.56 -0.37 117.98 116.23 1q9t s PHE 144 Ca 0.34 1.52 -0.01 0.00 -0.96 0.00 0.00 56.93 57.82 1q9t s PHE 144 Cb -0.02 0.36 0.09 0.00 -0.34 0.00 0.00 43.02 43.11 1q9t s PHE 144 CO 0.20 -0.32 0.59 -0.35 -1.46 0.00 0.00 175.22 173.88 1q9t n PRO 145 N 2.74 0.10 -1.30 10.12 -0.04 -1.26 -0.46 135.00 144.89 1q9t n PRO 145 Ca -0.14 -1.51 -0.31 0.00 -0.04 0.00 0.00 63.50 61.50 1q9t n PRO 145 Cb 0.56 -0.42 0.10 0.00 -0.04 0.00 0.00 33.50 33.70 1q9t n PRO 145 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1q9t s GLU 146 N -4.02 2.05 0.50 0.54 0.41 -1.26 -4.79 118.70 112.13 1q9t s GLU 146 Ca 0.38 1.00 0.08 0.00 -0.41 0.00 0.00 54.97 56.02 1q9t s GLU 146 Cb -0.02 -1.89 0.03 0.00 -1.78 0.00 0.00 34.13 30.48 1q9t s GLU 146 CO 0.26 -1.74 0.52 -1.25 -0.49 0.00 0.00 175.26 172.56 1q9t s PRO 147 N -4.95 2.40 0.10 0.39 0.04 -1.26 -4.94 135.00 126.78 1q9t s PRO 147 Ca 0.61 -1.70 0.05 0.00 0.04 0.00 0.00 61.00 60.00 1q9t s PRO 147 Cb -0.17 -2.40 -0.03 0.00 0.04 0.00 0.00 34.50 31.94 1q9t s PRO 147 CO 0.56 -0.53 -0.13 0.14 0.04 0.00 0.00 177.00 177.07 1q9t s VAL 148 N -2.62 1.18 0.00 -0.36 -7.23 -1.26 -4.25 120.40 105.86 1q9t s VAL 148 Ca 0.48 -1.55 0.08 0.00 -1.81 0.00 0.00 61.98 59.18 1q9t s VAL 148 Cb -0.04 -1.33 -0.02 0.00 0.56 0.00 0.00 36.38 35.54 1q9t s VAL 148 CO 0.29 -0.37 -0.25 0.42 -0.31 0.00 0.00 175.10 174.88 1q9t s THR 149 N -1.87 2.03 -0.04 5.32 -4.23 -0.62 -4.97 115.64 111.26 1q9t s THR 149 Ca 0.04 -1.18 0.02 0.00 -1.18 0.00 0.00 61.69 59.39 1q9t s THR 149 Cb -0.06 -1.70 0.01 0.00 1.34 0.00 0.00 72.50 72.09 1q9t s THR 149 CO 0.02 0.49 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.82 1q9t s VAL 150 N -0.67 0.76 0.20 2.29 1.01 -1.26 -1.61 120.40 121.13 1q9t s VAL 150 Ca 0.10 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.81 1q9t s VAL 150 Cb -0.10 -0.71 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 1q9t s VAL 150 CO 0.00 0.26 0.01 0.42 0.00 0.00 0.00 175.10 175.79 1q9t s THR 151 N 0.56 0.81 -0.10 3.92 -4.23 -0.36 -4.97 115.64 111.27 1q9t s THR 151 Ca -0.09 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.44 1q9t s THR 151 Cb -0.12 -2.26 0.01 0.00 1.34 0.00 0.00 72.50 71.47 1q9t s THR 151 CO 0.01 -0.37 -0.19 0.26 -0.54 0.00 0.00 174.62 173.79 1q9t s TRP 152 N -3.57 2.18 -1.40 3.99 0.52 -1.25 -0.13 118.94 119.26 1q9t s TRP 152 Ca 0.27 -0.93 -0.01 0.00 0.02 0.00 0.00 56.10 55.44 1q9t s TRP 152 Cb 0.06 -1.50 0.01 0.00 -1.15 0.00 0.00 33.47 30.89 1q9t s TRP 152 CO 0.07 -0.42 0.52 0.09 0.02 0.00 0.00 176.95 177.22 1q9t n ASN 153 N 3.80 -0.80 -2.01 2.95 3.02 0.23 -1.41 115.26 121.04 1q9t n ASN 153 Ca -0.20 -0.96 -0.16 0.00 -0.03 0.00 0.00 54.58 53.23 1q9t n ASN 153 Cb 0.52 -3.29 -0.03 0.00 -0.61 0.00 0.00 39.78 36.36 1q9t n ASN 153 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1q9t n SER 154 N -2.98 -4.63 0.00 6.41 7.64 -1.26 -1.08 113.62 117.72 1q9t n SER 154 Ca -0.28 0.23 0.00 0.00 1.01 0.00 0.00 58.87 59.83 1q9t n SER 154 Cb 0.67 -4.01 0.00 0.00 -1.01 0.00 0.00 64.21 59.85 1q9t n SER 154 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1q9t n GLY 155 N -0.65 2.84 0.36 0.23 0.00 -0.50 -4.93 105.19 102.55 1q9t n GLY 155 Ca -0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.96 1q9t n GLY 155 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1q9t h SER 156 N 0.19 0.77 -3.53 1.61 0.87 -1.03 -3.32 113.55 109.10 1q9t h SER 156 Ca 0.00 0.07 -0.71 0.00 -1.23 0.00 0.00 61.79 59.92 1q9t h SER 156 Cb 0.00 -0.08 -0.24 0.00 -0.44 0.00 0.00 62.40 61.65 1q9t h SER 156 CO 0.00 0.33 -0.48 -0.76 -0.53 0.00 0.00 176.83 175.40 1q9t s LEU 157 N -10.11 4.92 0.00 2.23 1.43 -0.73 -4.83 118.68 111.59 1q9t s LEU 157 Ca -0.11 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 51.95 1q9t s LEU 157 Cb 0.24 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 44.39 1q9t s LEU 157 CO 0.80 -0.43 0.00 -1.54 0.23 0.00 0.00 176.35 175.41 1q9t n SER 158 N 5.05 2.87 -4.76 2.29 3.41 -1.25 -3.91 113.62 117.32 1q9t n SER 158 Ca -0.11 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.10 1q9t n SER 158 Cb 0.46 0.29 -0.06 0.00 -0.26 0.00 0.00 64.21 64.65 1q9t n SER 158 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1q9t s SER 159 N -2.13 7.51 -0.32 4.04 0.15 -1.26 -3.37 113.70 118.32 1q9t s SER 159 Ca 0.00 2.00 0.00 0.00 0.70 0.00 0.00 55.95 58.65 1q9t s SER 159 Cb 0.00 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 1q9t s SER 159 CO 0.00 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.10 1q9t n GLY 160 N 1.27 0.61 3.66 9.45 0.00 -1.26 -4.77 105.19 114.16 1q9t n GLY 160 Ca -0.01 -0.89 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 1q9t n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q9t s VAL 161 N -2.10 4.47 -0.16 1.61 1.01 -1.22 -1.77 120.40 122.24 1q9t s VAL 161 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 61.98 61.80 1q9t s VAL 161 Cb 0.00 -2.93 0.04 0.00 0.00 0.00 0.00 36.38 33.49 1q9t s VAL 161 CO 0.00 0.56 -0.06 -1.00 0.00 0.00 0.00 175.10 174.60 1q9t s HIS 162 N -0.44 1.70 -0.25 5.22 3.76 0.02 -4.97 115.29 120.32 1q9t s HIS 162 Ca 0.09 -1.04 -0.04 0.00 -0.15 0.00 0.00 55.06 53.91 1q9t s HIS 162 Cb -0.12 -1.32 0.00 0.00 1.11 0.00 0.00 32.58 32.25 1q9t s HIS 162 CO 0.02 -0.60 0.00 0.99 -0.85 0.00 0.00 174.74 174.30 1q9t s THR 163 N 1.63 3.50 0.24 1.30 2.01 -1.26 -0.03 115.64 123.04 1q9t s THR 163 Ca 0.02 -0.67 -0.30 0.00 0.31 0.00 0.00 61.69 61.05 1q9t s THR 163 Cb -0.15 -2.72 -0.09 0.00 0.01 0.00 0.00 72.50 69.56 1q9t s THR 163 CO -0.08 0.25 0.94 -0.36 -0.69 0.00 0.00 174.62 174.68 1q9t s PHE 164 N 1.46 3.98 0.38 4.92 0.08 -0.03 -5.00 117.98 123.77 1q9t s PHE 164 Ca 0.03 1.91 -0.28 0.00 0.12 0.00 0.00 56.93 58.72 1q9t s PHE 164 Cb -0.16 -2.98 -0.11 0.00 -0.57 0.00 0.00 43.02 39.21 1q9t s PHE 164 CO -0.01 0.45 1.48 -2.14 -0.10 0.00 0.00 175.22 174.90 1q9t s PRO 165 N -1.22 4.09 0.66 0.24 0.02 -1.26 -4.21 135.00 133.32 1q9t s PRO 165 Ca 0.41 2.56 -0.16 0.00 0.02 0.00 0.00 61.00 63.83 1q9t s PRO 165 Cb -0.26 -2.95 0.00 0.00 0.02 0.00 0.00 34.50 31.31 1q9t s PRO 165 CO 0.32 -0.55 1.18 0.00 -0.33 0.00 0.00 177.00 177.62 1q9t s ALA 166 N -1.13 2.36 -0.06 -1.55 0.00 -1.26 -4.84 121.76 115.29 1q9t s ALA 166 Ca 0.53 0.84 0.04 0.00 0.00 0.00 0.00 51.96 53.37 1q9t s ALA 166 Cb -0.46 -3.42 -0.00 0.00 0.00 0.00 0.00 23.12 19.23 1q9t s ALA 166 CO 0.63 -1.47 -0.18 0.08 0.00 0.00 0.00 175.76 174.82 1q9t s VAL 167 N -1.94 1.54 -0.16 0.00 1.01 -0.64 -4.92 120.40 115.30 1q9t s VAL 167 Ca 0.74 -0.76 -0.20 0.00 0.00 0.00 0.00 61.98 61.75 1q9t s VAL 167 Cb -0.27 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 1q9t s VAL 167 CO 0.40 0.44 0.59 -0.22 0.00 0.00 0.00 175.10 176.31 1q9t s LEU 168 N 0.15 4.20 -0.09 3.92 2.96 -1.26 -2.02 118.68 126.53 1q9t s LEU 168 Ca -0.07 0.86 -0.04 0.00 -0.22 0.00 0.00 54.13 54.65 1q9t s LEU 168 Cb -0.13 -2.85 0.05 0.00 0.50 0.00 0.00 46.19 43.76 1q9t s LEU 168 CO 0.03 -0.18 0.18 -1.10 -1.32 0.00 0.00 176.35 173.97 1q9t s GLN 169 N 1.43 0.10 -1.19 1.98 -0.21 -0.06 -4.92 119.66 116.79 1q9t s GLN 169 Ca 0.29 0.51 -0.22 0.00 0.02 0.00 0.00 55.36 55.96 1q9t s GLN 169 Cb -0.16 -0.18 0.01 0.00 1.00 0.00 0.00 33.01 33.68 1q9t s GLN 169 CO 0.11 -0.23 0.71 -1.13 -2.12 0.00 0.00 175.29 172.64 1q9t n SER 170 N 4.73 -4.36 -0.03 5.90 3.41 -1.26 -1.75 113.62 120.26 1q9t n SER 170 Ca -0.16 -1.09 -0.00 0.00 -0.26 0.00 0.00 58.87 57.35 1q9t n SER 170 Cb 0.51 -2.89 -0.00 0.00 -0.26 0.00 0.00 64.21 61.56 1q9t n SER 170 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1q9t n ASP 171 N -2.58 -5.53 -3.93 4.04 10.43 -1.26 -4.96 116.55 112.76 1q9t n ASP 171 Ca -0.13 0.01 -0.12 0.00 2.57 0.00 0.00 54.79 57.12 1q9t n ASP 171 Cb 0.60 -3.06 -0.13 0.00 1.84 0.00 0.00 41.12 40.37 1q9t n ASP 171 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1q9t s LEU 172 N -0.08 2.08 0.19 0.64 1.43 -0.72 -4.83 118.68 117.40 1q9t s LEU 172 Ca 0.00 -0.19 -0.06 0.00 -1.03 0.00 0.00 54.13 52.86 1q9t s LEU 172 Cb 0.00 -0.03 -0.06 0.00 0.03 0.00 0.00 46.19 46.14 1q9t s LEU 172 CO 0.00 -0.08 0.45 -0.31 0.23 0.00 0.00 176.35 176.64 1q9t s TYR 173 N -0.50 3.46 -0.04 0.29 2.02 0.50 -0.88 117.35 122.20 1q9t s TYR 173 Ca -0.05 0.64 -0.03 0.00 -0.37 0.00 0.00 57.07 57.27 1q9t s TYR 173 Cb -0.04 -2.08 0.02 0.00 -0.40 0.00 0.00 41.96 39.46 1q9t s TYR 173 CO -0.00 0.35 0.10 0.99 -1.57 0.00 0.00 175.55 175.42 1q9t s THR 174 N -1.78 -0.02 0.19 -0.71 2.01 -0.86 -1.42 115.64 113.06 1q9t s THR 174 Ca 0.43 0.07 -0.04 0.00 0.31 0.00 0.00 61.69 62.46 1q9t s THR 174 Cb -0.12 -0.16 -0.03 0.00 0.01 0.00 0.00 72.50 72.21 1q9t s THR 174 CO 0.25 0.03 0.20 -1.48 -0.69 0.00 0.00 174.62 172.92 1q9t s LEU 175 N 0.44 1.09 0.08 4.42 0.05 0.14 -1.62 118.68 123.28 1q9t s LEU 175 Ca -0.03 -1.22 -0.03 0.00 0.05 0.00 0.00 54.13 52.90 1q9t s LEU 175 Cb -0.05 0.70 -0.03 0.00 -2.05 0.00 0.00 46.19 44.76 1q9t s LEU 175 CO -0.02 -0.88 0.06 -0.94 -0.55 0.00 0.00 176.35 174.02 1q9t s SER 176 N -3.09 0.34 -0.00 1.48 1.04 -1.26 -0.16 113.70 112.04 1q9t s SER 176 Ca 0.31 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 55.79 1q9t s SER 176 Cb 0.05 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1q9t s SER 176 CO 0.08 -0.68 -0.01 -0.55 0.98 0.00 0.00 173.24 173.07 1q9t s SER 177 N -2.93 0.13 0.13 7.02 0.15 -0.67 -0.85 113.70 116.68 1q9t s SER 177 Ca 0.11 -0.01 0.10 0.00 0.70 0.00 0.00 55.95 56.85 1q9t s SER 177 Cb 0.07 -0.03 -0.04 0.00 -1.71 0.00 0.00 66.02 64.31 1q9t s SER 177 CO -0.07 -0.01 -0.24 -0.94 1.20 0.00 0.00 173.24 173.18 1q9t s SER 178 N 0.15 3.49 -0.01 5.45 1.04 0.96 -1.70 113.70 123.07 1q9t s SER 178 Ca -0.01 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.72 1q9t s SER 178 Cb -0.02 -0.31 0.01 0.00 0.10 0.00 0.00 66.02 65.79 1q9t s SER 178 CO -0.00 0.17 -0.01 0.54 0.98 0.00 0.00 173.24 174.92 1q9t s VAL 179 N -1.13 0.13 -0.16 5.02 0.11 -0.10 -0.80 120.40 123.47 1q9t s VAL 179 Ca 0.16 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.21 1q9t s VAL 179 Cb -0.10 -0.16 0.00 0.00 -1.53 0.00 0.00 36.38 34.59 1q9t s VAL 179 CO 0.07 0.07 -0.16 -0.89 -3.33 0.00 0.00 175.10 170.87 1q9t s THR 180 N 0.37 2.58 0.19 5.04 2.01 -0.73 -0.43 115.64 124.68 1q9t s THR 180 Ca -0.03 -0.79 0.01 0.00 0.31 0.00 0.00 61.69 61.18 1q9t s THR 180 Cb -0.06 -2.09 -0.05 0.00 0.01 0.00 0.00 72.50 70.32 1q9t s THR 180 CO -0.01 0.52 0.05 0.68 -0.69 0.00 0.00 174.62 175.16 1q9t s VAL 181 N 0.87 0.50 0.13 3.82 -7.23 0.19 -4.81 120.40 113.87 1q9t s VAL 181 Ca -0.04 -1.98 -0.31 0.00 -1.81 0.00 0.00 61.98 57.84 1q9t s VAL 181 Cb -0.15 -2.28 -0.08 0.00 0.56 0.00 0.00 36.38 34.42 1q9t s VAL 181 CO -0.01 -0.30 1.39 -2.84 -0.31 0.00 0.00 175.10 173.03 1q9t s PRO 182 N -3.99 4.32 0.64 4.82 0.02 -1.26 -0.55 135.00 139.00 1q9t s PRO 182 Ca 0.29 2.10 0.30 0.00 0.02 0.00 0.00 61.00 63.71 1q9t s PRO 182 Cb 0.07 -3.23 1.64 0.00 0.02 0.00 0.00 34.50 33.00 1q9t s PRO 182 CO 0.07 -0.43 1.96 0.66 -0.33 0.00 0.00 177.00 178.94 1q9t h SER 183 N 6.58 0.00 1.09 2.53 4.64 -1.50 0.13 113.55 127.02 1q9t h SER 183 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1q9t h SER 183 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1q9t h SER 183 CO 0.85 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 177.58 1q9t h SER 184 N 0.00 0.00 0.34 4.97 4.64 -1.90 -3.03 113.55 118.57 1q9t h SER 184 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1q9t h SER 184 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1q9t h SER 184 CO -0.00 0.00 -1.18 0.35 -0.87 0.00 0.00 176.83 175.13 1q9t n THR 185 N -2.92 0.14 -4.01 2.95 -2.24 0.44 -4.57 114.28 104.07 1q9t n THR 185 Ca 0.01 -0.27 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 1q9t n THR 185 Cb 0.32 0.25 -0.14 0.00 -2.10 0.00 0.00 70.33 68.66 1q9t n THR 185 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1q9t s TRP 186 N -3.23 0.24 -2.00 4.78 -0.00 -1.14 0.24 118.94 117.83 1q9t s TRP 186 Ca 0.02 -0.04 0.09 0.00 -0.00 0.00 0.00 56.10 56.17 1q9t s TRP 186 Cb 0.14 -0.17 0.52 0.00 -0.00 0.00 0.00 33.47 33.97 1q9t s TRP 186 CO 0.83 -0.01 1.22 -0.35 -0.00 0.00 0.00 176.95 178.63 1q9t n PRO 187 N 3.07 0.86 -0.24 5.86 -0.04 -1.26 -4.69 135.00 138.55 1q9t n PRO 187 Ca -0.13 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.23 1q9t n PRO 187 Cb 0.59 -1.16 -0.07 0.00 -0.04 0.00 0.00 33.50 32.82 1q9t n PRO 187 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1q9t h SER 188 N 0.00 -1.76 -2.37 3.54 0.87 -1.80 -3.40 113.55 108.63 1q9t h SER 188 Ca 0.00 0.27 -0.51 0.00 -1.23 0.00 0.00 61.79 60.31 1q9t h SER 188 Cb 0.00 0.77 -0.04 0.00 -0.44 0.00 0.00 62.40 62.70 1q9t h SER 188 CO 0.00 -0.33 -0.50 -1.61 -0.53 0.00 0.00 176.83 173.86 1q9t s GLU 189 N -5.71 3.15 0.29 2.24 0.41 0.65 -5.07 118.70 114.67 1q9t s GLU 189 Ca -0.14 -0.85 -0.28 0.00 -0.41 0.00 0.00 54.97 53.29 1q9t s GLU 189 Cb 0.12 -2.74 -0.09 0.00 -1.78 0.00 0.00 34.13 29.63 1q9t s GLU 189 CO 0.64 0.45 0.96 -0.08 -0.49 0.00 0.00 175.26 176.74 1q9t s THR 190 N -1.94 4.08 -0.08 3.63 -1.32 -1.26 -4.40 115.64 114.34 1q9t s THR 190 Ca 0.33 1.87 -0.00 0.00 -1.21 0.00 0.00 61.69 62.68 1q9t s THR 190 Cb -0.09 -4.11 0.02 0.00 -1.51 0.00 0.00 72.50 66.82 1q9t s THR 190 CO 0.26 0.28 -0.05 -0.69 -2.21 0.00 0.00 174.62 172.22 1q9t s VAL 191 N -1.42 0.73 -0.02 5.08 1.01 -1.26 -5.00 120.40 119.52 1q9t s VAL 191 Ca 0.47 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.34 1q9t s VAL 191 Cb -0.23 -0.79 -0.00 0.00 0.00 0.00 0.00 36.38 35.36 1q9t s VAL 191 CO 0.28 0.31 -0.09 -0.89 0.00 0.00 0.00 175.10 174.71 1q9t s THR 192 N 1.59 0.79 -0.13 3.92 2.01 -1.26 -1.11 115.64 121.45 1q9t s THR 192 Ca 0.01 -0.39 -0.08 0.00 0.31 0.00 0.00 61.69 61.54 1q9t s THR 192 Cb -0.13 -0.69 -0.04 0.00 0.01 0.00 0.00 72.50 71.65 1q9t s THR 192 CO -0.05 0.24 0.16 0.00 -0.69 0.00 0.00 174.62 174.28 1q9t s ASN 194 N -0.65 5.08 -0.08 0.00 0.01 0.81 -1.09 114.94 119.01 1q9t s ASN 194 Ca 0.14 -0.34 0.05 0.00 -0.71 0.00 0.00 52.86 52.00 1q9t s ASN 194 Cb -0.12 -1.90 -0.00 0.00 0.41 0.00 0.00 41.25 39.63 1q9t s ASN 194 CO 0.03 -0.07 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.62 1q9t s VAL 195 N 1.58 1.98 -0.01 1.60 1.01 0.48 -1.22 120.40 125.81 1q9t s VAL 195 Ca 0.06 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 61.10 1q9t s VAL 195 Cb -0.16 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 1q9t s VAL 195 CO 0.03 0.54 -0.17 0.00 0.00 0.00 0.00 175.10 175.50 1q9t s ALA 196 N 0.20 1.41 -0.42 5.51 0.00 -0.63 -0.68 121.76 127.14 1q9t s ALA 196 Ca -0.14 -0.74 0.02 0.00 0.00 0.00 0.00 51.96 51.10 1q9t s ALA 196 Cb -0.16 -0.35 0.13 0.00 0.00 0.00 0.00 23.12 22.73 1q9t s ALA 196 CO 0.07 0.34 0.21 -1.58 0.00 0.00 0.00 175.76 174.80 1q9t s HIS 197 N -0.43 2.22 0.31 0.00 2.46 -0.46 -1.59 115.29 117.81 1q9t s HIS 197 Ca 0.06 -2.46 0.08 0.00 0.47 0.00 0.00 55.06 53.21 1q9t s HIS 197 Cb -0.07 -2.06 0.81 0.00 -0.13 0.00 0.00 32.58 31.13 1q9t s HIS 197 CO -0.00 -0.80 1.76 -1.00 -2.47 0.00 0.00 174.74 172.22 1q9t h PRO 198 N 6.97 0.66 -0.35 2.88 0.13 -1.82 -0.91 132.00 139.56 1q9t h PRO 198 Ca -0.04 -0.04 0.08 0.00 -0.87 0.00 0.00 66.00 65.13 1q9t h PRO 198 Cb 0.94 -0.15 -0.02 0.00 0.13 0.00 0.00 31.00 31.91 1q9t h PRO 198 CO 0.51 0.44 0.24 0.00 -0.23 0.00 0.00 178.00 178.96 1q9t h ALA 199 N 1.68 2.19 -0.23 -0.56 0.00 -1.90 -1.32 119.26 119.12 1q9t h ALA 199 Ca 0.61 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.51 1q9t h ALA 199 Cb 1.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1q9t h ALA 199 CO -0.42 -0.27 0.00 -1.13 0.00 0.00 0.00 179.25 177.43 1q9t n SER 200 N -4.46 2.80 -3.01 0.00 3.41 -0.51 -4.97 113.62 106.88 1q9t n SER 200 Ca 0.05 -2.19 -0.20 0.00 -0.26 0.00 0.00 58.87 56.28 1q9t n SER 200 Cb 0.35 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1q9t n SER 200 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1q9t n SER 201 N 0.04 -4.16 -4.74 4.04 7.64 -0.46 -4.92 113.62 111.06 1q9t n SER 201 Ca 0.10 -0.18 -0.40 0.00 1.01 0.00 0.00 58.87 59.39 1q9t n SER 201 Cb 0.45 -3.45 -0.05 0.00 -1.01 0.00 0.00 64.21 60.15 1q9t n SER 201 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1q9t s THR 202 N -2.87 4.68 -0.08 0.44 2.01 -0.81 -4.92 115.64 114.09 1q9t s THR 202 Ca 0.25 1.80 -0.01 0.00 0.31 0.00 0.00 61.69 64.04 1q9t s THR 202 Cb -0.13 -4.19 0.03 0.00 0.01 0.00 0.00 72.50 68.21 1q9t s THR 202 CO 0.31 0.33 -0.03 -0.54 -0.69 0.00 0.00 174.62 174.00 1q9t s LYS 203 N 0.08 0.91 -0.04 4.92 1.02 -1.26 -1.35 119.74 124.03 1q9t s LYS 203 Ca 0.42 -0.03 0.02 0.00 0.02 0.00 0.00 55.97 56.40 1q9t s LYS 203 Cb -0.21 -1.12 0.01 0.00 -0.52 0.00 0.00 37.83 35.98 1q9t s LYS 203 CO 0.25 -0.25 -0.09 0.08 -0.92 0.00 0.00 175.35 174.43 1q9t s VAL 204 N 1.70 0.80 -0.25 3.17 1.01 0.14 -5.01 120.40 121.96 1q9t s VAL 204 Ca 0.02 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.69 1q9t s VAL 204 Cb -0.13 -0.73 0.06 0.00 0.00 0.00 0.00 36.38 35.58 1q9t s VAL 204 CO -0.05 0.26 -0.11 -1.81 0.00 0.00 0.00 175.10 173.40 1q9t s ASP 205 N 0.40 4.34 -0.31 3.32 1.01 -1.26 -0.39 116.67 123.78 1q9t s ASP 205 Ca -0.07 -1.35 -0.06 0.00 0.71 0.00 0.00 52.55 51.79 1q9t s ASP 205 Cb -0.11 -1.50 0.03 0.00 1.01 0.00 0.00 42.92 42.35 1q9t s ASP 205 CO 0.01 -0.19 0.07 -0.75 0.21 0.00 0.00 175.17 174.52 1q9t s LYS 206 N 1.14 2.76 0.10 8.23 2.47 -0.25 -4.95 119.74 129.24 1q9t s LYS 206 Ca -0.08 -1.07 -0.30 0.00 -1.56 0.00 0.00 55.97 52.95 1q9t s LYS 206 Cb -0.20 -3.37 -0.06 0.00 -1.46 0.00 0.00 37.83 32.75 1q9t s LYS 206 CO -0.05 -0.57 1.04 0.21 0.16 0.00 0.00 175.35 176.14 1q9t s LYS 207 N 1.41 4.60 -0.49 4.03 2.20 -1.26 -1.65 119.74 128.58 1q9t s LYS 207 Ca -0.01 1.58 -0.22 0.00 -0.36 0.00 0.00 55.97 56.96 1q9t s LYS 207 Cb -0.19 -3.36 0.04 0.00 -1.51 0.00 0.00 37.83 32.81 1q9t s LYS 207 CO 0.02 0.05 0.78 0.42 -0.36 0.00 0.00 175.35 176.26 1q9t s ILE 208 N 0.28 4.63 -0.13 5.43 -1.09 -0.26 -4.95 121.20 125.12 1q9t s ILE 208 Ca 0.50 0.15 -0.06 0.00 -2.23 0.00 0.00 60.65 59.01 1q9t s ILE 208 Cb -0.26 -4.37 -0.04 0.00 -1.58 0.00 0.00 42.46 36.21 1q9t s ILE 208 CO 0.31 -0.85 0.09 0.54 -1.23 0.00 0.00 174.94 173.80 1q9t s VAL 209 N 3.30 5.08 0.60 2.92 0.11 -1.26 -4.66 120.40 126.50 1q9t s VAL 209 Ca 0.26 0.05 -0.18 0.00 -2.93 0.00 0.00 61.98 59.18 1q9t s VAL 209 Cb -0.14 -3.21 -0.03 0.00 -1.53 0.00 0.00 36.38 31.47 1q9t s VAL 209 CO 0.19 0.58 1.19 -2.16 -3.33 0.00 0.00 175.10 171.56 1q9t s PRO 210 N -0.67 2.94 0.19 1.54 0.04 -1.26 -4.86 135.00 132.92 1q9t s PRO 210 Ca 0.12 1.75 -0.11 0.00 0.04 0.00 0.00 61.00 62.81 1q9t s PRO 210 Cb -0.12 -1.93 0.11 0.00 0.04 0.00 0.00 34.50 32.60 1q9t s PRO 210 CO 0.02 -1.21 1.77 0.00 0.04 0.00 0.00 177.00 177.62 1q9t h ARG 211 N 0.76 0.98 0.00 4.56 2.47 -1.93 -3.42 114.38 117.79 1q9t h ARG 211 Ca -0.50 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.07 1q9t h ARG 211 Cb 1.29 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 29.44 1q9t h ARG 211 CO 0.55 0.79 0.00 -0.25 0.56 0.00 0.00 179.97 181.62 1q9t n ASP 212 N -4.44 0.00 0.00 7.04 10.43 -1.26 -5.02 116.55 123.30 1q9t n ASP 212 Ca 0.05 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.41 1q9t n ASP 212 Cb 0.14 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.10 1q9t n ASP 212 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13