#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q3t n LYS 15 N 0.00 0.00 -3.65 2.12 4.76 -1.26 -4.59 118.16 115.55 1q3t n LYS 15 Ca 0.00 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.41 1q3t n LYS 15 Cb 0.00 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.13 1q3t n LYS 15 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1q3t s THR 16 N 0.00 0.00 -0.05 -0.18 -4.23 -1.26 -4.87 115.64 105.05 1q3t s THR 16 Ca 0.00 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.30 1q3t s THR 16 Cb 0.00 -1.00 0.04 0.00 1.34 0.00 0.00 72.50 72.88 1q3t s THR 16 CO 0.00 0.00 0.48 0.27 -0.54 0.00 0.00 174.62 174.83 1q3t s ILE 17 N -0.16 0.03 0.50 2.99 -0.00 -1.26 -4.21 121.20 119.08 1q3t s ILE 17 Ca 0.08 -0.23 -0.13 0.00 -0.00 0.00 0.00 60.65 60.37 1q3t s ILE 17 Cb -0.04 -0.77 -0.06 0.00 -0.00 0.00 0.00 42.46 41.58 1q3t s ILE 17 CO -0.14 -0.12 0.91 -1.10 -0.00 0.00 0.00 174.94 174.49 1q3t s GLN 18 N -1.03 3.80 -0.35 0.37 1.11 -1.26 -2.24 119.66 120.05 1q3t s GLN 18 Ca -0.11 0.71 -0.00 0.00 0.01 0.00 0.00 55.36 55.97 1q3t s GLN 18 Cb -0.03 -2.22 0.12 0.00 -1.01 0.00 0.00 33.01 29.87 1q3t s GLN 18 CO 0.06 -0.26 0.17 0.42 0.01 0.00 0.00 175.29 175.69 1q3t s ILE 19 N -2.67 0.72 -0.04 1.08 -1.09 0.16 -2.27 121.20 117.09 1q3t s ILE 19 Ca 0.55 -1.70 -0.06 0.00 -2.23 0.00 0.00 60.65 57.20 1q3t s ILE 19 Cb -0.10 -1.53 -0.04 0.00 -1.58 0.00 0.00 42.46 39.20 1q3t s ILE 19 CO 0.37 -0.82 0.21 0.00 -1.23 0.00 0.00 174.94 173.48 1q3t s ALA 20 N 1.21 3.88 -0.04 9.38 0.00 -0.27 0.49 121.76 136.40 1q3t s ALA 20 Ca 0.14 -0.62 0.01 0.00 0.00 0.00 0.00 51.96 51.49 1q3t s ALA 20 Cb -0.20 -2.01 0.02 0.00 0.00 0.00 0.00 23.12 20.92 1q3t s ALA 20 CO -0.14 0.65 -0.05 -1.50 0.00 0.00 0.00 175.76 174.72 1q3t s ILE 21 N -1.20 0.57 0.48 0.00 2.07 -0.80 -0.88 121.20 121.45 1q3t s ILE 21 Ca 0.23 -0.16 0.02 0.00 -1.41 0.00 0.00 60.65 59.33 1q3t s ILE 21 Cb -0.13 -0.58 -0.01 0.00 0.13 0.00 0.00 42.46 41.87 1q3t s ILE 21 CO 0.12 0.23 0.07 0.47 -1.91 0.00 0.00 174.94 173.92 1q3t n ASP 22 N 3.94 2.41 0.00 4.50 9.92 0.18 -2.66 116.55 134.83 1q3t n ASP 22 Ca -0.25 -3.28 0.00 0.00 -0.53 0.00 0.00 54.79 50.74 1q3t n ASP 22 Cb 0.51 0.70 0.00 0.00 -0.64 0.00 0.00 41.12 41.69 1q3t n ASP 22 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1q3t n GLY 23 N -1.10 3.37 0.26 0.44 0.00 -1.26 -0.95 105.19 105.95 1q3t n GLY 23 Ca -0.14 -1.27 0.10 0.00 0.00 0.00 0.00 46.02 44.70 1q3t n GLY 23 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1q3t h PRO 24 N 0.00 0.00 0.00 1.61 0.13 -1.94 -3.42 132.00 128.39 1q3t h PRO 24 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1q3t h PRO 24 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1q3t h PRO 24 CO 0.00 0.05 0.00 0.00 -0.23 0.00 0.00 178.00 177.82 1q3t n ALA 25 N -2.45 0.55 -1.92 -0.56 0.00 -1.26 -5.09 120.51 109.78 1q3t n ALA 25 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.41 1q3t n ALA 25 Cb 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.58 1q3t n ALA 25 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1q3t n SER 26 N -2.12 -5.68 -2.08 0.00 7.64 -1.26 -4.88 113.62 105.24 1q3t n SER 26 Ca 0.00 1.12 -0.19 0.00 1.01 0.00 0.00 58.87 60.81 1q3t n SER 26 Cb 0.00 -3.69 0.18 0.00 -1.01 0.00 0.00 64.21 59.69 1q3t n SER 26 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1q3t n SER 27 N 1.15 3.83 -1.08 6.43 2.88 -1.26 -4.27 113.62 121.30 1q3t n SER 27 Ca -0.05 -3.40 -0.02 0.00 -1.33 0.00 0.00 58.87 54.07 1q3t n SER 27 Cb 0.08 -0.79 -0.00 0.00 -0.75 0.00 0.00 64.21 62.75 1q3t n SER 27 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1q3t n GLY 28 N -0.84 -0.11 0.12 0.46 0.00 -1.26 -4.98 105.19 98.57 1q3t n GLY 28 Ca 0.51 -0.02 -0.21 0.00 0.00 0.00 0.00 46.02 46.31 1q3t n GLY 28 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1q3t h LYS 29 N 0.11 0.32 0.50 1.61 2.10 -1.92 -2.83 116.57 116.46 1q3t h LYS 29 Ca -0.17 -0.54 -0.02 0.00 -2.00 0.00 0.00 60.65 57.91 1q3t h LYS 29 Cb 0.90 0.20 0.00 0.00 -0.90 0.00 0.00 32.23 32.44 1q3t h LYS 29 CO -0.08 1.26 -0.24 1.03 -2.00 0.00 0.00 179.45 179.42 1q3t h SER 30 N -0.32 -0.57 0.15 7.07 0.87 -1.95 -0.28 113.55 118.52 1q3t h SER 30 Ca -0.17 -0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.34 1q3t h SER 30 Cb 1.70 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 63.79 1q3t h SER 30 CO 0.16 -0.27 -0.16 0.74 -0.53 0.00 0.00 176.83 176.77 1q3t h THR 31 N -0.86 0.65 0.62 2.23 2.02 -1.97 0.67 112.91 116.27 1q3t h THR 31 Ca -0.07 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 1q3t h THR 31 Cb 0.59 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1q3t h THR 31 CO 0.11 0.00 -0.45 0.58 0.37 0.00 0.00 175.52 176.13 1q3t h VAL 32 N -0.34 0.00 -0.63 3.16 2.07 -1.55 0.19 116.25 119.15 1q3t h VAL 32 Ca 0.01 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.68 1q3t h VAL 32 Cb 0.33 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.06 1q3t h VAL 32 CO -0.05 0.00 0.44 0.00 0.02 0.00 0.00 177.57 177.98 1q3t h ALA 33 N -1.16 2.32 0.33 1.67 0.00 -1.04 -0.49 119.26 120.89 1q3t h ALA 33 Ca -0.08 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1q3t h ALA 33 Cb 0.84 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1q3t h ALA 33 CO 0.04 -0.49 -0.16 0.87 0.00 0.00 0.00 179.25 179.51 1q3t h LYS 34 N 0.19 -0.42 -0.89 0.00 1.57 -0.38 -2.82 116.57 113.82 1q3t h LYS 34 Ca 0.30 0.03 0.14 0.00 -1.87 0.00 0.00 60.65 59.26 1q3t h LYS 34 Cb 0.93 0.10 -0.09 0.00 0.08 0.00 0.00 32.23 33.24 1q3t h LYS 34 CO -0.05 -0.17 0.49 0.82 -0.57 0.00 0.00 179.45 179.97 1q3t h ILE 35 N -1.05 0.77 0.59 1.86 2.04 -0.25 0.11 117.51 121.59 1q3t h ILE 35 Ca -0.05 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 1q3t h ILE 35 Cb 0.45 -0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1q3t h ILE 35 CO 0.07 0.13 -0.41 0.40 0.00 0.00 0.00 178.15 178.34 1q3t h ILE 36 N 0.71 0.17 0.00 -0.67 2.04 -1.17 -2.34 117.51 116.25 1q3t h ILE 36 Ca 0.48 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.31 1q3t h ILE 36 Cb 0.64 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1q3t h ILE 36 CO -0.34 0.00 -0.12 0.00 0.00 0.00 0.00 178.15 177.69 1q3t h ALA 37 N -0.70 1.70 -0.08 1.87 0.00 -1.17 -0.46 119.26 120.41 1q3t h ALA 37 Ca -0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1q3t h ALA 37 Cb 0.80 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1q3t h ALA 37 CO 0.04 0.15 -0.13 -0.22 0.00 0.00 0.00 179.25 179.09 1q3t h LYS 38 N 0.00 0.13 0.00 0.00 3.64 -0.31 0.85 116.57 120.87 1q3t h LYS 38 Ca -0.00 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.21 1q3t h LYS 38 Cb 0.23 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 1q3t h LYS 38 CO 0.02 0.27 -1.08 -0.25 -2.27 0.00 0.00 179.45 176.14 1q3t n ASP 39 N -4.32 1.86 -0.07 4.20 8.00 -0.71 -4.46 116.55 121.04 1q3t n ASP 39 Ca -0.01 0.49 -0.07 0.00 0.71 0.00 0.00 54.79 55.90 1q3t n ASP 39 Cb 0.24 -0.89 0.10 0.00 -0.02 0.00 0.00 41.12 40.55 1q3t n ASP 39 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1q3t h PHE 40 N -1.00 0.83 -0.01 1.24 0.04 -1.18 -3.47 116.94 113.39 1q3t h PHE 40 Ca -0.21 -0.20 0.00 0.00 2.80 0.00 0.00 57.97 60.36 1q3t h PHE 40 Cb 0.99 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.94 1q3t h PHE 40 CO -0.11 0.91 0.00 0.41 -0.60 0.00 0.00 178.31 178.92 1q3t n GLY 41 N -0.20 1.68 3.86 -1.45 0.00 0.29 -5.04 105.19 104.32 1q3t n GLY 41 Ca -0.00 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1q3t n GLY 41 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1q3t s PHE 42 N -2.01 3.39 -0.11 1.61 0.08 -1.05 -4.94 117.98 114.94 1q3t s PHE 42 Ca 0.00 1.11 -0.30 0.00 0.12 0.00 0.00 56.93 57.86 1q3t s PHE 42 Cb 0.00 -2.45 -0.02 0.00 -0.57 0.00 0.00 43.02 39.98 1q3t s PHE 42 CO 0.00 0.15 1.23 0.99 -0.10 0.00 0.00 175.22 177.49 1q3t s THR 43 N -1.94 4.27 0.05 0.64 2.01 -0.02 -4.52 115.64 116.13 1q3t s THR 43 Ca 0.52 1.57 -0.28 0.00 0.31 0.00 0.00 61.69 63.81 1q3t s THR 43 Cb -0.10 -4.01 -0.05 0.00 0.01 0.00 0.00 72.50 68.35 1q3t s THR 43 CO 0.19 -0.07 0.89 -0.47 -0.69 0.00 0.00 174.62 174.47 1q3t s TYR 44 N 2.85 3.74 -0.01 4.92 6.14 -1.26 0.46 117.35 134.18 1q3t s TYR 44 Ca 0.55 1.65 0.01 0.00 0.64 0.00 0.00 57.07 59.92 1q3t s TYR 44 Cb -0.23 -2.99 0.00 0.00 0.42 0.00 0.00 41.96 39.16 1q3t s TYR 44 CO 0.18 0.16 -0.04 -1.17 0.64 0.00 0.00 175.55 175.32 1q3t s LEU 45 N 0.30 1.79 -0.12 6.97 2.96 0.95 -4.92 118.68 126.60 1q3t s LEU 45 Ca 0.45 -0.09 0.03 0.00 -0.22 0.00 0.00 54.13 54.30 1q3t s LEU 45 Cb -0.22 -0.28 0.00 0.00 0.50 0.00 0.00 46.19 46.20 1q3t s LEU 45 CO 0.27 0.02 -0.22 1.51 -1.32 0.00 0.00 176.35 176.61 1q3t s ASP 46 N 0.20 3.19 0.54 3.68 -4.77 -1.26 -2.31 116.67 115.93 1q3t s ASP 46 Ca -0.02 -0.56 0.36 0.00 -3.30 0.00 0.00 52.55 49.03 1q3t s ASP 46 Cb -0.05 -1.45 1.54 0.00 -1.09 0.00 0.00 42.92 41.87 1q3t s ASP 46 CO -0.00 0.12 1.80 0.74 0.70 0.00 0.00 175.17 178.53 1q3t h THR 47 N 5.74 0.41 0.02 2.11 2.02 -1.93 0.41 112.91 121.69 1q3t h THR 47 Ca -0.26 -0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 1q3t h THR 47 Cb 1.21 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1q3t h THR 47 CO 0.52 0.00 -0.01 1.23 0.37 0.00 0.00 175.52 177.63 1q3t h GLY 48 N 0.01 -0.03 0.79 2.16 0.00 -1.94 -2.63 103.07 101.43 1q3t h GLY 48 Ca 0.57 0.01 0.05 0.00 0.00 0.00 0.00 47.33 47.96 1q3t h GLY 48 CO -0.02 -0.01 0.63 0.00 0.00 0.00 0.00 176.54 177.15 1q3t h ALA 49 N 0.76 1.34 -0.40 3.60 0.00 -1.34 0.84 119.26 124.05 1q3t h ALA 49 Ca -0.00 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.93 1q3t h ALA 49 Cb 0.21 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 1q3t h ALA 49 CO 0.00 0.46 0.10 0.52 0.00 0.00 0.00 179.25 180.34 1q3t h MET 50 N 1.18 0.23 -0.06 0.00 2.86 -1.33 -0.51 114.93 117.30 1q3t h MET 50 Ca 0.41 -0.01 -0.11 0.00 -2.06 0.00 0.00 59.70 57.93 1q3t h MET 50 Cb 0.10 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1q3t h MET 50 CO -0.15 0.15 -0.45 1.88 1.06 0.00 0.00 176.91 179.40 1q3t h TYR 51 N 0.24 0.17 0.00 -0.22 0.05 -0.99 -2.85 116.97 113.37 1q3t h TYR 51 Ca 0.19 -0.05 -0.00 0.00 0.05 0.00 0.00 58.73 58.92 1q3t h TYR 51 Cb 0.21 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.91 1q3t h TYR 51 CO -0.18 0.57 -0.00 0.00 -1.05 0.00 0.00 178.16 177.50 1q3t h ARG 52 N 0.12 -0.00 -0.92 4.88 3.08 0.55 0.18 114.38 122.26 1q3t h ARG 52 Ca 0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1q3t h ARG 52 Cb 0.84 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.85 1q3t h ARG 52 CO 0.06 0.04 0.54 0.00 -1.07 0.00 0.00 179.97 179.54 1q3t h ALA 53 N 0.95 1.18 0.09 0.04 0.00 -1.09 0.40 119.26 120.83 1q3t h ALA 53 Ca -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1q3t h ALA 53 Cb 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.46 1q3t h ALA 53 CO 0.00 0.65 -0.04 0.00 0.00 0.00 0.00 179.25 179.86 1q3t h ALA 54 N 1.30 -0.12 -0.48 0.00 0.00 -1.25 -2.84 119.26 115.88 1q3t h ALA 54 Ca 0.33 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1q3t h ALA 54 Cb -0.03 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1q3t h ALA 54 CO -0.06 -0.42 0.05 0.00 0.00 0.00 0.00 179.25 178.82 1q3t h THR 55 N -0.42 1.23 -0.12 0.00 1.03 -0.48 -2.81 112.91 111.34 1q3t h THR 55 Ca -0.01 -0.89 0.05 0.00 -0.01 0.00 0.00 66.41 65.54 1q3t h THR 55 Cb 0.36 0.81 -0.06 0.00 -1.07 0.00 0.00 68.15 68.19 1q3t h THR 55 CO 0.02 0.32 -0.28 0.22 -0.01 0.00 0.00 175.52 175.79 1q3t h TYR 56 N 0.72 -0.77 -0.90 0.00 3.20 -0.11 -0.79 116.97 118.32 1q3t h TYR 56 Ca 0.15 0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.10 1q3t h TYR 56 Cb 0.37 0.36 -0.05 0.00 1.54 0.00 0.00 36.73 38.94 1q3t h TYR 56 CO 0.02 -0.37 0.59 0.52 -1.64 0.00 0.00 178.16 177.28 1q3t h MET 57 N -0.36 1.05 -0.04 1.82 2.86 -1.37 -0.94 114.93 117.95 1q3t h MET 57 Ca 0.10 -0.06 0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1q3t h MET 57 Cb 0.51 -0.24 -0.06 0.00 0.06 0.00 0.00 31.60 31.87 1q3t h MET 57 CO -0.33 0.69 -0.41 0.00 1.06 0.00 0.00 176.91 177.92 1q3t h ALA 58 N 1.49 -0.64 0.00 6.32 0.00 -0.90 0.97 119.26 126.50 1q3t h ALA 58 Ca 0.37 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.17 1q3t h ALA 58 Cb 0.09 0.75 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1q3t h ALA 58 CO -0.12 -0.94 -0.35 -0.07 0.00 0.00 0.00 179.25 177.77 1q3t h LEU 59 N -0.55 0.00 -0.71 0.00 3.38 -1.10 0.91 115.31 117.25 1q3t h LEU 59 Ca 0.06 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1q3t h LEU 59 Cb 0.64 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 1q3t h LEU 59 CO -0.34 0.35 0.08 0.50 0.09 0.00 0.00 178.44 179.12 1q3t h LYS 60 N 0.00 1.08 -0.05 1.13 3.11 0.08 -3.16 116.57 118.76 1q3t h LYS 60 Ca -0.00 -0.30 -0.02 0.00 -2.81 0.00 0.00 60.65 57.52 1q3t h LYS 60 Cb 0.66 -0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 31.75 1q3t h LYS 60 CO 0.05 1.00 -0.39 0.09 -2.81 0.00 0.00 179.45 177.38 1q3t n ASN 61 N -4.21 1.90 -4.37 4.20 3.02 0.21 -4.98 115.26 111.04 1q3t n ASN 61 Ca 0.04 -3.80 -0.35 0.00 -0.03 0.00 0.00 54.58 50.43 1q3t n ASN 61 Cb 0.30 -0.53 -0.08 0.00 -0.61 0.00 0.00 39.78 38.86 1q3t n ASN 61 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1q3t n GLN 62 N -1.14 -1.25 -1.94 3.52 7.27 0.85 -4.81 117.38 119.87 1q3t n GLN 62 Ca 0.21 0.16 -0.39 0.00 0.07 0.00 0.00 57.00 57.05 1q3t n GLN 62 Cb 0.73 -4.22 -0.01 0.00 2.41 0.00 0.00 30.24 29.15 1q3t n GLN 62 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1q3t n LEU 63 N -4.36 7.88 -4.21 1.69 7.99 0.28 -4.98 117.00 121.29 1q3t n LEU 63 Ca -0.12 -4.80 -0.35 0.00 -0.01 0.00 0.00 56.01 50.73 1q3t n LEU 63 Cb 0.59 -1.35 0.08 0.00 -0.11 0.00 0.00 43.42 42.63 1q3t n LEU 63 CO 0.89 2.03 -0.70 0.61 -1.51 0.00 0.00 177.39 178.71 1q3t n GLY 64 N 1.62 -3.31 0.46 -0.72 0.00 -1.26 -4.64 105.19 97.33 1q3t n GLY 64 Ca 0.61 -0.76 0.26 0.00 0.00 0.00 0.00 46.02 46.13 1q3t n GLY 64 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1q3t h VAL 65 N -1.26 0.33 -0.01 1.61 -1.51 -1.94 0.30 116.25 113.78 1q3t h VAL 65 Ca -0.44 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1q3t h VAL 65 Cb 1.29 0.47 -0.00 0.00 -2.13 0.00 0.00 31.29 30.92 1q3t h VAL 65 CO 0.29 0.00 0.04 -0.33 -1.23 0.00 0.00 177.57 176.34 1q3t h GLU 66 N 0.00 0.00 -2.19 5.19 5.08 -1.98 -2.88 114.58 117.81 1q3t h GLU 66 Ca 0.36 0.00 -0.76 0.00 -1.00 0.00 0.00 59.36 57.96 1q3t h GLU 66 Cb 1.76 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 30.72 1q3t h GLU 66 CO -0.00 0.00 0.74 -1.91 -1.00 0.00 0.00 179.01 176.84 1q3t n GLU 67 N -3.16 4.62 -0.11 2.33 2.13 0.11 -4.77 120.64 121.78 1q3t n GLU 67 Ca -0.03 -4.50 -0.10 0.00 0.66 0.00 0.00 57.16 53.20 1q3t n GLU 67 Cb 0.11 -2.40 -0.02 0.00 0.27 0.00 0.00 31.44 29.40 1q3t n GLU 67 CO 0.00 0.00 0.00 -0.24 -0.41 0.00 0.00 177.13 176.48 1q3t h VAL 68 N 2.30 1.19 0.46 6.31 3.04 -1.72 0.30 116.25 128.12 1q3t h VAL 68 Ca 0.48 -0.58 -0.01 0.00 -1.01 0.00 0.00 66.70 65.58 1q3t h VAL 68 Cb 0.32 0.93 -0.02 0.00 -2.01 0.00 0.00 31.29 30.51 1q3t h VAL 68 CO 1.16 0.20 -0.40 -0.33 -1.01 0.00 0.00 177.57 177.20 1q3t h GLU 69 N 0.40 -0.83 0.32 4.17 5.08 -1.90 0.43 114.58 122.25 1q3t h GLU 69 Ca 0.11 0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1q3t h GLU 69 Cb 0.19 0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1q3t h GLU 69 CO -0.01 -0.55 -0.15 0.00 -1.00 0.00 0.00 179.01 177.30 1q3t h ALA 70 N -0.51 -0.43 -0.24 3.43 0.00 -1.95 -2.66 119.26 116.90 1q3t h ALA 70 Ca -0.05 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.77 1q3t h ALA 70 Cb 0.74 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1q3t h ALA 70 CO -0.03 -0.65 0.17 1.25 0.00 0.00 0.00 179.25 180.00 1q3t h LEU 71 N -0.61 0.05 0.76 0.00 5.85 -0.93 -0.92 115.31 119.52 1q3t h LEU 71 Ca -0.04 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.64 1q3t h LEU 71 Cb 0.44 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.46 1q3t h LEU 71 CO 0.07 0.03 -0.37 0.25 -0.34 0.00 0.00 178.44 178.09 1q3t h LEU 72 N 0.06 -0.86 -1.76 2.25 5.85 0.08 0.35 115.31 121.29 1q3t h LEU 72 Ca 0.11 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1q3t h LEU 72 Cb 0.38 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1q3t h LEU 72 CO -0.01 -0.49 0.14 0.00 -0.34 0.00 0.00 178.44 177.74 1q3t h ALA 73 N -1.26 1.82 -0.03 1.25 0.00 -1.24 -2.64 119.26 117.16 1q3t h ALA 73 Ca -0.10 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1q3t h ALA 73 Cb 0.78 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1q3t h ALA 73 CO 0.17 0.16 -0.13 1.25 0.00 0.00 0.00 179.25 180.71 1q3t h LEU 74 N 0.31 0.17 -1.25 0.00 5.85 -1.11 -2.35 115.31 116.93 1q3t h LEU 74 Ca 0.08 -0.64 0.24 0.00 0.84 0.00 0.00 57.88 58.41 1q3t h LEU 74 Cb -0.02 -0.05 -0.10 0.00 0.37 0.00 0.00 40.66 40.86 1q3t h LEU 74 CO -0.02 0.78 0.64 -0.07 -0.34 0.00 0.00 178.44 179.43 1q3t h LEU 75 N -0.43 0.54 -0.32 2.25 3.38 0.06 0.85 115.31 121.65 1q3t h LEU 75 Ca -0.01 0.09 -0.17 0.00 0.09 0.00 0.00 57.88 57.89 1q3t h LEU 75 Cb 0.77 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1q3t h LEU 75 CO 0.03 0.13 -0.81 -0.78 0.09 0.00 0.00 178.44 177.10 1q3t h ASP 76 N 0.49 0.00 0.61 -0.43 3.58 -1.49 -3.18 116.42 116.00 1q3t h ASP 76 Ca 0.59 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.92 1q3t h ASP 76 Cb 1.33 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.36 1q3t h ASP 76 CO -0.33 0.81 -0.56 -0.61 -2.88 0.00 0.00 179.24 175.66 1q3t h GLN 77 N 0.00 0.00 -6.28 0.28 4.15 0.12 -3.43 115.11 109.95 1q3t h GLN 77 Ca -0.01 0.00 -0.57 0.00 0.77 0.00 0.00 58.65 58.84 1q3t h GLN 77 Cb 1.46 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 29.13 1q3t h GLN 77 CO 0.10 0.56 1.22 -1.01 -1.93 0.00 0.00 178.83 177.77 1q3t s HIS 78 N -3.68 1.90 -0.88 3.99 3.76 0.35 -4.89 115.29 115.84 1q3t s HIS 78 Ca -0.01 0.55 -0.21 0.00 -0.15 0.00 0.00 55.06 55.24 1q3t s HIS 78 Cb 0.13 -4.08 -0.13 0.00 1.11 0.00 0.00 32.58 29.61 1q3t s HIS 78 CO 0.75 -3.05 1.96 -0.35 -0.85 0.00 0.00 174.74 173.20 1q3t n PRO 79 N 8.11 1.68 -2.43 8.40 -0.04 -1.26 -4.80 135.00 144.66 1q3t n PRO 79 Ca 0.21 -1.99 -0.34 0.00 -0.04 0.00 0.00 63.50 61.34 1q3t n PRO 79 Cb 0.46 -3.02 -0.02 0.00 -0.04 0.00 0.00 33.50 30.88 1q3t n PRO 79 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1q3t s ILE 80 N 5.18 3.70 -0.14 0.52 1.01 -1.26 -4.22 121.20 126.00 1q3t s ILE 80 Ca 0.57 1.02 -0.33 0.00 0.00 0.00 0.00 60.65 61.90 1q3t s ILE 80 Cb 0.13 -3.41 0.13 0.00 0.01 0.00 0.00 42.46 39.32 1q3t s ILE 80 CO 0.10 -0.27 1.14 -0.55 0.00 0.00 0.00 174.94 175.36 1q3t s SER 81 N -2.07 -0.18 0.38 3.58 0.15 0.14 -4.92 113.70 110.78 1q3t s SER 81 Ca 0.68 -0.01 0.08 0.00 0.70 0.00 0.00 55.95 57.39 1q3t s SER 81 Cb -0.17 0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 64.30 1q3t s SER 81 CO 0.23 -0.33 0.21 -0.36 1.20 0.00 0.00 173.24 174.19 1q3t s PHE 82 N -2.59 2.68 -0.22 3.44 0.08 -1.26 0.10 117.98 120.21 1q3t s PHE 82 Ca 0.09 -0.48 -0.27 0.00 0.12 0.00 0.00 56.93 56.39 1q3t s PHE 82 Cb -0.01 -1.87 0.11 0.00 -0.57 0.00 0.00 43.02 40.68 1q3t s PHE 82 CO -0.05 0.18 0.95 0.20 -0.10 0.00 0.00 175.22 176.39 1q3t s GLY 83 N -3.93 -0.28 -0.29 4.36 0.00 -1.02 -4.92 107.32 101.24 1q3t s GLY 83 Ca 0.41 2.25 -0.27 0.00 0.00 0.00 0.00 44.72 47.12 1q3t s GLY 83 CO 0.24 1.48 0.94 0.50 0.00 0.00 0.00 173.10 176.26 1q3t s ARG 84 N -0.32 4.09 0.44 2.90 0.52 -1.26 -0.27 118.95 125.05 1q3t s ARG 84 Ca -0.00 0.95 -0.24 0.00 -0.52 0.00 0.00 55.73 55.92 1q3t s ARG 84 Cb -0.03 -3.70 -0.08 0.00 0.52 0.00 0.00 34.95 31.66 1q3t s ARG 84 CO -0.01 -0.72 1.24 0.45 0.02 0.00 0.00 175.30 176.28 1q3t s SER 85 N 1.51 6.17 0.56 0.23 0.15 0.18 -4.80 113.70 117.69 1q3t s SER 85 Ca 0.39 2.50 0.39 0.00 0.70 0.00 0.00 55.95 59.93 1q3t s SER 85 Cb -0.14 -2.62 1.55 0.00 -1.71 0.00 0.00 66.02 63.10 1q3t s SER 85 CO 0.11 -0.93 1.71 -0.08 1.20 0.00 0.00 173.24 175.25 1q3t h GLU 86 N 2.31 0.00 -1.02 5.44 4.81 -1.95 0.93 114.58 125.10 1q3t h GLU 86 Ca -0.49 0.00 -0.41 0.00 -0.13 0.00 0.00 59.36 58.33 1q3t h GLU 86 Cb 1.25 0.00 -0.24 0.00 0.63 0.00 0.00 28.75 30.39 1q3t h GLU 86 CO 0.61 0.00 0.52 2.41 -0.73 0.00 0.00 179.01 181.82 1q3t n THR 87 N -4.00 2.74 -3.47 0.32 -1.04 -1.26 -4.88 114.28 102.68 1q3t n THR 87 Ca 0.29 -1.54 -0.18 0.00 -2.04 0.00 0.00 64.05 60.58 1q3t n THR 87 Cb 1.43 -0.64 0.07 0.00 -1.82 0.00 0.00 70.33 69.37 1q3t n THR 87 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1q3t n GLY 88 N -0.73 -0.52 2.71 3.41 0.00 0.32 -5.00 105.19 105.37 1q3t n GLY 88 Ca 0.46 0.21 -0.27 0.00 0.00 0.00 0.00 46.02 46.42 1q3t n GLY 88 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1q3t s ASP 89 N -4.15 2.77 -0.41 1.61 -1.08 -1.11 -4.87 116.67 109.44 1q3t s ASP 89 Ca 0.11 -0.77 -0.27 0.00 -0.52 0.00 0.00 52.55 51.09 1q3t s ASP 89 Cb -0.02 -0.52 -0.04 0.00 -1.46 0.00 0.00 42.92 40.88 1q3t s ASP 89 CO 0.76 -0.31 2.03 -1.58 0.52 0.00 0.00 175.17 176.59 1q3t s GLN 90 N 1.92 2.86 0.27 4.34 0.74 -1.26 0.49 119.66 129.02 1q3t s GLN 90 Ca -0.00 1.36 -0.07 0.00 0.05 0.00 0.00 55.36 56.70 1q3t s GLN 90 Cb -0.17 -4.36 -0.06 0.00 1.10 0.00 0.00 33.01 29.52 1q3t s GLN 90 CO -0.08 -2.42 0.57 -0.51 -0.55 0.00 0.00 175.29 172.29 1q3t s LEU 91 N 8.86 4.08 -0.24 3.68 1.43 0.63 -4.91 118.68 132.20 1q3t s LEU 91 Ca 0.85 0.82 -0.10 0.00 -1.03 0.00 0.00 54.13 54.67 1q3t s LEU 91 Cb -0.21 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 42.34 1q3t s LEU 91 CO 0.29 -0.16 0.14 -0.69 0.23 0.00 0.00 176.35 176.16 1q3t s VAL 92 N -2.00 5.13 -0.24 -1.59 1.01 -0.86 -2.44 120.40 119.41 1q3t s VAL 92 Ca 0.46 0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.49 1q3t s VAL 92 Cb -0.11 -3.39 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 1q3t s VAL 92 CO 0.27 0.34 0.00 -0.36 0.00 0.00 0.00 175.10 175.35 1q3t s PHE 93 N 1.20 3.01 -0.04 5.22 0.40 0.12 0.17 117.98 128.06 1q3t s PHE 93 Ca 0.07 -0.80 -0.02 0.00 -0.60 0.00 0.00 56.93 55.58 1q3t s PHE 93 Cb -0.14 -2.16 0.03 0.00 0.51 0.00 0.00 43.02 41.26 1q3t s PHE 93 CO 0.05 -0.50 0.09 0.54 0.70 0.00 0.00 175.22 176.11 1q3t s VAL 94 N 1.52 -0.05 -1.10 -0.44 0.11 -1.10 0.25 120.40 119.60 1q3t s VAL 94 Ca 0.06 0.17 0.00 0.00 -2.93 0.00 0.00 61.98 59.27 1q3t s VAL 94 Cb -0.15 -0.16 0.00 0.00 -1.53 0.00 0.00 36.38 34.54 1q3t s VAL 94 CO -0.01 0.07 0.00 0.61 -3.33 0.00 0.00 175.10 172.44 1q3t n GLY 95 N 4.02 0.71 2.16 6.54 0.00 -1.26 -2.44 105.19 114.93 1q3t n GLY 95 Ca -0.25 -0.47 -0.06 0.00 0.00 0.00 0.00 46.02 45.23 1q3t n GLY 95 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1q3t n ASP 96 N 0.05 -3.28 -3.91 1.61 2.03 -1.26 -5.01 116.55 106.78 1q3t n ASP 96 Ca -0.12 0.09 -0.29 0.00 0.52 0.00 0.00 54.79 54.99 1q3t n ASP 96 Cb 0.46 -1.85 -0.16 0.00 -0.72 0.00 0.00 41.12 38.85 1q3t n ASP 96 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1q3t s VAL 97 N -2.27 1.25 -0.40 5.18 1.01 -1.02 -5.08 120.40 119.07 1q3t s VAL 97 Ca 0.00 -0.83 -0.28 0.00 0.00 0.00 0.00 61.98 60.86 1q3t s VAL 97 Cb 0.00 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.91 1q3t s VAL 97 CO 0.00 0.05 1.68 1.51 0.00 0.00 0.00 175.10 178.34 1q3t s ASP 98 N 1.55 5.95 -0.15 3.32 -4.77 -1.26 -2.71 116.67 118.60 1q3t s ASP 98 Ca -0.01 1.01 -0.00 0.00 -3.30 0.00 0.00 52.55 50.24 1q3t s ASP 98 Cb -0.16 -2.53 0.04 0.00 -1.09 0.00 0.00 42.92 39.17 1q3t s ASP 98 CO -0.07 -1.71 -0.06 0.27 0.70 0.00 0.00 175.17 174.29 1q3t s ILE 99 N 6.71 1.10 -0.03 2.11 -4.36 0.13 -4.97 121.20 121.89 1q3t s ILE 99 Ca 0.72 -0.55 0.04 0.00 -0.26 0.00 0.00 60.65 60.60 1q3t s ILE 99 Cb -0.18 -1.23 -0.05 0.00 1.25 0.00 0.00 42.46 42.24 1q3t s ILE 99 CO 0.31 0.19 0.03 1.07 0.24 0.00 0.00 174.94 176.79 1q3t n THR 100 N 4.89 0.20 -0.08 8.37 5.66 -1.26 -2.03 114.28 130.03 1q3t n THR 100 Ca -0.12 -0.15 -0.12 0.00 -3.05 0.00 0.00 64.05 60.61 1q3t n THR 100 Cb 0.48 -0.57 -0.09 0.00 -1.55 0.00 0.00 70.33 68.60 1q3t n THR 100 CO 0.00 0.00 0.00 0.45 -3.05 0.00 0.00 175.07 172.47 1q3t h HIS 101 N 0.00 0.00 -0.88 1.09 3.86 -1.96 -3.34 115.15 113.92 1q3t h HIS 101 Ca -0.08 0.00 0.25 0.00 -1.16 0.00 0.00 60.37 59.38 1q3t h HIS 101 Cb 0.98 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.42 1q3t h HIS 101 CO 0.00 0.80 0.70 -1.35 0.86 0.00 0.00 177.93 178.94 1q3t h PRO 102 N -1.00 0.00 -3.07 2.45 0.11 -1.98 -2.99 132.00 125.52 1q3t h PRO 102 Ca -0.09 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 65.34 1q3t h PRO 102 Cb 0.82 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.95 1q3t h PRO 102 CO -0.06 0.00 3.81 0.44 -0.21 0.00 0.00 178.00 181.98 1q3t n ILE 103 N -4.05 4.27 -0.14 4.15 -5.35 -1.26 -4.91 119.36 112.08 1q3t n ILE 103 Ca 0.18 -2.62 -0.09 0.00 -0.27 0.00 0.00 62.75 59.95 1q3t n ILE 103 Cb 1.00 -2.62 0.08 0.00 -1.74 0.00 0.00 39.64 36.37 1q3t n ILE 103 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1q3t n ARG 104 N 3.75 -1.72 -0.04 6.28 1.74 -1.13 -4.97 116.66 120.57 1q3t n ARG 104 Ca 0.77 -0.41 -0.08 0.00 -0.77 0.00 0.00 57.85 57.36 1q3t n ARG 104 Cb 0.24 -0.65 -0.03 0.00 -1.02 0.00 0.00 32.46 31.01 1q3t n ARG 104 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1q3t n GLU 105 N -2.21 0.32 0.22 5.56 1.02 -1.26 -4.32 120.64 119.97 1q3t n GLU 105 Ca 0.04 0.13 -0.09 0.00 -0.02 0.00 0.00 57.16 57.22 1q3t n GLU 105 Cb 0.17 -1.05 -0.04 0.00 -0.02 0.00 0.00 31.44 30.49 1q3t n GLU 105 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1q3t h ASN 106 N -0.59 -0.51 -0.50 1.62 4.21 -1.97 0.21 115.58 118.04 1q3t h ASN 106 Ca -0.08 0.02 0.10 0.00 1.21 0.00 0.00 56.30 57.54 1q3t h ASN 106 Cb 0.73 0.13 -0.08 0.00 -1.12 0.00 0.00 38.32 37.99 1q3t h ASN 106 CO -0.05 -0.21 0.01 -0.08 -1.29 0.00 0.00 177.43 175.81 1q3t h GLU 107 N -0.92 0.12 -0.11 0.81 4.81 -2.00 0.14 114.58 117.43 1q3t h GLU 107 Ca -0.06 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.10 1q3t h GLU 107 Cb 0.46 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1q3t h GLU 107 CO 0.10 0.08 -0.22 0.28 -0.73 0.00 0.00 179.01 178.52 1q3t h VAL 108 N 0.12 1.21 -0.24 0.32 2.07 -1.75 -2.83 116.25 115.16 1q3t h VAL 108 Ca 0.25 -0.98 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 1q3t h VAL 108 Cb 0.38 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1q3t h VAL 108 CO -0.41 0.29 -0.09 0.74 0.02 0.00 0.00 177.57 178.13 1q3t h THR 109 N 0.17 1.29 -0.53 2.57 2.02 0.18 0.51 112.91 119.13 1q3t h THR 109 Ca 0.03 -1.13 0.07 0.00 0.77 0.00 0.00 66.41 66.15 1q3t h THR 109 Cb 0.49 1.52 -0.06 0.00 -1.74 0.00 0.00 68.15 68.37 1q3t h THR 109 CO 0.03 0.35 0.21 0.78 0.37 0.00 0.00 175.52 177.26 1q3t h ASN 110 N 0.22 0.23 0.78 4.18 2.35 -0.61 0.41 115.58 123.14 1q3t h ASN 110 Ca 0.06 0.06 -0.21 0.00 -0.55 0.00 0.00 56.30 55.65 1q3t h ASN 110 Cb 0.57 0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 1q3t h ASN 110 CO 0.03 0.16 -0.98 -0.74 -1.65 0.00 0.00 177.43 174.25 1q3t h HIS 111 N 0.40 0.18 -0.57 1.19 2.76 -1.45 -2.88 115.15 114.78 1q3t h HIS 111 Ca 0.25 -0.11 -0.09 0.00 -2.20 0.00 0.00 60.37 58.22 1q3t h HIS 111 Cb 0.26 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.19 1q3t h HIS 111 CO -0.15 1.01 -0.01 0.28 -1.30 0.00 0.00 177.93 177.76 1q3t h VAL 112 N 0.04 1.26 -0.34 5.26 2.07 0.80 0.16 116.25 125.50 1q3t h VAL 112 Ca -0.04 -1.14 -0.08 0.00 0.82 0.00 0.00 66.70 66.26 1q3t h VAL 112 Cb 1.67 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1q3t h VAL 112 CO 0.14 0.41 -0.11 -1.28 0.02 0.00 0.00 177.57 176.75 1q3t h SER 113 N 0.91 0.69 -0.34 0.57 0.87 -0.25 0.35 113.55 116.35 1q3t h SER 113 Ca 0.16 -0.38 -0.09 0.00 -1.23 0.00 0.00 61.79 60.25 1q3t h SER 113 Cb 0.55 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 1q3t h SER 113 CO 0.03 0.91 -0.12 0.00 -0.53 0.00 0.00 176.83 177.12 1q3t h ALA 114 N 0.80 0.99 0.20 6.23 0.00 -1.34 -2.41 119.26 123.73 1q3t h ALA 114 Ca 0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1q3t h ALA 114 Cb 0.63 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1q3t h ALA 114 CO 0.04 0.60 -0.10 0.82 0.00 0.00 0.00 179.25 180.61 1q3t h ILE 115 N 0.70 0.62 -0.80 0.00 1.08 -0.54 -3.22 117.51 115.35 1q3t h ILE 115 Ca 0.12 -1.04 0.23 0.00 -0.39 0.00 0.00 64.86 63.78 1q3t h ILE 115 Cb 0.60 1.06 -0.03 0.00 -3.07 0.00 0.00 36.82 35.37 1q3t h ILE 115 CO 0.04 0.17 0.69 0.00 -0.69 0.00 0.00 178.15 178.35 1q3t h ALA 116 N -0.53 2.66 -0.67 1.87 0.00 -0.34 0.22 119.26 122.47 1q3t h ALA 116 Ca -0.03 -0.03 0.18 0.00 0.00 0.00 0.00 54.91 55.03 1q3t h ALA 116 Cb 0.48 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1q3t h ALA 116 CO 0.05 -1.10 0.47 0.00 0.00 0.00 0.00 179.25 178.67 1q3t h ALA 117 N 1.38 2.46 -2.73 0.00 0.00 -1.43 -3.41 119.26 115.53 1q3t h ALA 117 Ca 0.38 -0.01 -0.52 0.00 0.00 0.00 0.00 54.91 54.76 1q3t h ALA 117 Cb 1.75 0.02 0.03 0.00 0.00 0.00 0.00 17.79 19.59 1q3t h ALA 117 CO -0.00 -0.65 0.59 0.42 0.00 0.00 0.00 179.25 179.60 1q3t s ILE 118 N -5.12 3.30 0.03 0.00 1.01 0.78 -4.96 121.20 116.24 1q3t s ILE 118 Ca -0.06 1.15 -0.20 0.00 0.00 0.00 0.00 60.65 61.55 1q3t s ILE 118 Cb 0.20 -3.74 -0.17 0.00 0.01 0.00 0.00 42.46 38.77 1q3t s ILE 118 CO 0.75 0.21 1.25 1.55 0.00 0.00 0.00 174.94 178.70 1q3t h PRO 119 N 4.74 0.42 -0.39 2.79 0.13 -1.88 -3.14 132.00 134.68 1q3t h PRO 119 Ca -0.46 -0.29 -0.00 0.00 -0.87 0.00 0.00 66.00 64.38 1q3t h PRO 119 Cb 1.22 0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.37 1q3t h PRO 119 CO 0.73 0.91 0.23 0.93 -0.23 0.00 0.00 178.00 180.57 1q3t h GLU 120 N -0.01 0.51 0.63 0.86 5.08 -1.95 -2.56 114.58 117.15 1q3t h GLU 120 Ca -0.01 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1q3t h GLU 120 Cb 0.93 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 30.07 1q3t h GLU 120 CO 0.07 0.36 -0.30 0.28 -1.00 0.00 0.00 179.01 178.42 1q3t h VAL 121 N 0.53 0.32 -0.62 3.13 2.07 -1.88 -2.46 116.25 117.33 1q3t h VAL 121 Ca 0.14 -0.19 0.11 0.00 0.82 0.00 0.00 66.70 67.58 1q3t h VAL 121 Cb -0.02 0.38 -0.08 0.00 -1.52 0.00 0.00 31.29 30.04 1q3t h VAL 121 CO -0.03 0.02 0.18 0.03 0.02 0.00 0.00 177.57 177.79 1q3t h ARG 122 N -0.98 0.31 -0.25 1.57 3.08 -1.47 0.17 114.38 116.80 1q3t h ARG 122 Ca -0.09 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.01 1q3t h ARG 122 Cb 0.68 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.60 1q3t h ARG 122 CO 0.14 0.21 -0.15 1.49 -1.07 0.00 0.00 179.97 180.58 1q3t h GLU 123 N 0.32 -0.13 0.02 0.04 4.81 -1.40 0.17 114.58 118.41 1q3t h GLU 123 Ca 0.33 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.57 1q3t h GLU 123 Cb 0.47 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1q3t h GLU 123 CO -0.38 -0.08 -0.01 -0.22 -0.73 0.00 0.00 179.01 177.58 1q3t h LYS 124 N -0.13 -0.03 -0.75 1.92 1.63 -0.85 -2.68 116.57 115.68 1q3t h LYS 124 Ca 0.14 0.00 0.18 0.00 -0.85 0.00 0.00 60.65 60.12 1q3t h LYS 124 Cb 0.34 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.93 1q3t h LYS 124 CO -0.34 0.23 0.51 -0.07 -3.45 0.00 0.00 179.45 176.34 1q3t h LEU 125 N -0.29 0.24 -0.38 5.20 -0.00 -0.36 0.59 115.31 120.32 1q3t h LEU 125 Ca -0.00 0.02 -0.04 0.00 -0.00 0.00 0.00 57.88 57.86 1q3t h LEU 125 Cb 0.27 -0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 40.89 1q3t h LEU 125 CO 0.01 0.11 0.08 0.58 -0.00 0.00 0.00 178.44 179.22 1q3t h VAL 126 N 0.25 1.23 -0.85 1.22 2.07 -0.36 -2.52 116.25 117.29 1q3t h VAL 126 Ca 0.37 -0.80 0.13 0.00 0.82 0.00 0.00 66.70 67.23 1q3t h VAL 126 Cb 1.08 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 1q3t h VAL 126 CO -0.09 0.27 0.55 -1.28 0.02 0.00 0.00 177.57 177.05 1q3t h SER 127 N 0.46 0.61 -0.44 0.57 0.87 -0.62 -0.44 113.55 114.56 1q3t h SER 127 Ca 0.12 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.69 1q3t h SER 127 Cb 0.32 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.17 1q3t h SER 127 CO 0.00 0.32 0.19 -0.07 -0.53 0.00 0.00 176.83 176.75 1q3t h LEU 128 N 0.65 0.59 -0.86 2.23 -0.00 -1.17 -2.09 115.31 114.66 1q3t h LEU 128 Ca 0.42 -0.15 0.16 0.00 -0.00 0.00 0.00 57.88 58.31 1q3t h LEU 128 Cb 0.68 -0.15 -0.10 0.00 -0.00 0.00 0.00 40.66 41.09 1q3t h LEU 128 CO -0.18 0.58 0.43 1.56 -0.00 0.00 0.00 178.44 180.83 1q3t h GLN 129 N 0.56 0.56 -0.12 1.13 4.20 -0.84 0.22 115.11 120.82 1q3t h GLN 129 Ca 0.15 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.72 1q3t h GLN 129 Cb 0.16 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1q3t h GLN 129 CO -0.02 0.37 -0.39 0.37 -0.67 0.00 0.00 178.83 178.49 1q3t h GLN 130 N 0.58 0.27 -0.19 1.46 4.15 -1.22 -2.74 115.11 117.42 1q3t h GLN 130 Ca 0.48 -0.13 -0.06 0.00 0.77 0.00 0.00 58.65 59.71 1q3t h GLN 130 Cb 0.73 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.40 1q3t h GLN 130 CO -0.39 0.63 -0.16 0.93 -1.93 0.00 0.00 178.83 177.91 1q3t h GLU 131 N 0.23 0.32 -0.08 1.69 5.08 0.07 0.18 114.58 122.07 1q3t h GLU 131 Ca 0.02 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 1q3t h GLU 131 Cb 0.80 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 1q3t h GLU 131 CO 0.06 0.48 -0.10 0.82 -1.00 0.00 0.00 179.01 179.27 1q3t h ILE 132 N 0.30 1.39 -0.00 3.13 2.04 -0.99 -3.12 117.51 120.25 1q3t h ILE 132 Ca 0.06 -1.32 0.00 0.00 1.00 0.00 0.00 64.86 64.60 1q3t h ILE 132 Cb 0.46 2.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.62 1q3t h ILE 132 CO 0.03 0.37 -0.05 0.00 0.00 0.00 0.00 178.15 178.50 1q3t n ALA 133 N -2.40 2.65 -0.23 1.87 0.00 -1.09 -4.11 120.51 117.20 1q3t n ALA 133 Ca -0.07 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1q3t n ALA 133 Cb 0.34 -1.41 0.08 0.00 0.00 0.00 0.00 19.45 18.45 1q3t n ALA 133 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1q3t h GLN 134 N 0.38 0.00 0.00 0.00 4.15 -0.58 0.83 115.11 119.90 1q3t h GLN 134 Ca 0.00 -0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 1q3t h GLN 134 Cb 0.27 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.95 1q3t h GLN 134 CO 0.00 0.00 -0.13 0.37 -1.93 0.00 0.00 178.83 177.14 1q3t h GLN 135 N 0.00 0.00 0.00 1.69 5.75 -1.79 -3.49 115.11 117.28 1q3t h GLN 135 Ca 0.33 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.83 1q3t h GLN 135 Cb 0.51 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.06 1q3t h GLN 135 CO -0.70 0.13 0.00 0.41 -2.65 0.00 0.00 178.83 176.02 1q3t n GLY 136 N -0.51 0.36 2.48 2.39 0.00 0.29 -4.87 105.19 105.33 1q3t n GLY 136 Ca -0.01 -1.81 -0.04 0.00 0.00 0.00 0.00 46.02 44.15 1q3t n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3t n GLY 137 N 0.56 -0.60 3.24 -0.02 0.00 -1.00 -4.63 105.19 102.74 1q3t n GLY 137 Ca 0.00 0.22 -0.12 0.00 0.00 0.00 0.00 46.02 46.12 1q3t n GLY 137 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1q3t s ILE 138 N -3.11 -0.01 -0.30 -0.61 -5.25 -0.95 -0.84 121.20 110.13 1q3t s ILE 138 Ca 0.13 0.05 -0.11 0.00 -0.99 0.00 0.00 60.65 59.73 1q3t s ILE 138 Cb -0.02 -0.53 -0.04 0.00 2.95 0.00 0.00 42.46 44.82 1q3t s ILE 138 CO 0.44 0.02 0.20 0.68 -1.79 0.00 0.00 174.94 174.49 1q3t s VAL 139 N 0.72 5.27 0.14 8.37 -7.23 0.17 0.37 120.40 128.21 1q3t s VAL 139 Ca -0.04 0.05 0.11 0.00 -1.81 0.00 0.00 61.98 60.28 1q3t s VAL 139 Cb -0.05 -3.57 -0.04 0.00 0.56 0.00 0.00 36.38 33.28 1q3t s VAL 139 CO -0.05 0.18 -0.25 0.00 -0.31 0.00 0.00 175.10 174.67 1q3t s MET 140 N 1.74 1.49 -0.08 4.82 0.23 0.18 -0.04 119.30 127.64 1q3t s MET 140 Ca 0.07 -1.34 -0.05 0.00 -1.03 0.00 0.00 55.69 53.34 1q3t s MET 140 Cb -0.16 -1.93 0.04 0.00 -1.53 0.00 0.00 34.83 31.24 1q3t s MET 140 CO 0.11 0.45 0.20 0.16 -2.03 0.00 0.00 175.02 173.90 1q3t s ASP 141 N -2.15 -0.19 0.12 -1.18 -4.77 -0.98 -1.90 116.67 105.61 1q3t s ASP 141 Ca 0.16 0.41 -0.11 0.00 -3.30 0.00 0.00 52.55 49.70 1q3t s ASP 141 Cb -0.10 0.33 0.04 0.00 -1.09 0.00 0.00 42.92 42.10 1q3t s ASP 141 CO 0.07 -0.13 0.55 0.61 0.70 0.00 0.00 175.17 176.97 1q3t n GLY 142 N 3.84 1.00 0.08 2.12 0.00 -1.09 -2.67 105.19 108.47 1q3t n GLY 142 Ca -0.22 -1.06 -0.08 0.00 0.00 0.00 0.00 46.02 44.66 1q3t n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q3t n ARG 143 N -0.38 1.39 -1.19 1.61 1.74 -1.26 -4.39 116.66 114.18 1q3t n ARG 143 Ca -0.02 -0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.78 1q3t n ARG 143 Cb 0.32 -1.40 0.10 0.00 -1.02 0.00 0.00 32.46 30.46 1q3t n ARG 143 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1q3t n ASP 144 N -2.60 6.19 -2.74 0.55 9.92 -1.26 -4.58 116.55 122.03 1q3t n ASP 144 Ca -0.26 -3.57 -0.34 0.00 -0.53 0.00 0.00 54.79 50.09 1q3t n ASP 144 Cb 1.01 -0.93 0.02 0.00 -0.64 0.00 0.00 41.12 40.57 1q3t n ASP 144 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1q3t n ILE 145 N -0.77 3.11 -0.10 0.53 2.08 -1.26 -4.63 119.36 118.32 1q3t n ILE 145 Ca 0.55 -4.68 -0.14 0.00 0.56 0.00 0.00 62.75 59.04 1q3t n ILE 145 Cb 0.95 -1.27 -0.09 0.00 -0.75 0.00 0.00 39.64 38.48 1q3t n ILE 145 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1q3t n GLY 146 N -0.49 -0.27 2.39 7.39 0.00 -1.26 -4.56 105.19 108.38 1q3t n GLY 146 Ca 0.46 -0.13 -0.26 0.00 0.00 0.00 0.00 46.02 46.09 1q3t n GLY 146 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1q3t n THR 147 N -3.12 -0.60 0.00 2.61 -2.24 -1.26 -4.59 114.28 105.08 1q3t n THR 147 Ca -0.35 -3.83 0.00 0.00 -2.27 0.00 0.00 64.05 57.60 1q3t n THR 147 Cb 0.86 -1.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.28 1q3t n THR 147 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1q3t n VAL 148 N 2.24 0.00 0.03 2.28 0.24 -1.26 -4.97 118.33 116.89 1q3t n VAL 148 Ca 0.26 0.00 -0.05 0.00 -2.04 0.00 0.00 64.34 62.52 1q3t n VAL 148 Cb 0.48 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.75 1q3t n VAL 148 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 1q3t h VAL 149 N 0.00 0.98 -0.11 3.34 3.04 -1.90 -3.37 116.25 118.22 1q3t h VAL 149 Ca 0.00 -2.65 0.05 0.00 -1.01 0.00 0.00 66.70 63.09 1q3t h VAL 149 Cb 0.00 2.43 -0.06 0.00 -2.01 0.00 0.00 31.29 31.65 1q3t h VAL 149 CO 0.00 0.56 -0.27 -0.07 -1.01 0.00 0.00 177.57 176.78 1q3t h LEU 150 N 0.00 -0.83 -1.87 3.16 -0.00 -1.86 -1.06 115.31 112.86 1q3t h LEU 150 Ca -0.15 0.13 0.38 0.00 -0.00 0.00 0.00 57.88 58.24 1q3t h LEU 150 Cb 1.77 0.36 -0.05 0.00 -0.00 0.00 0.00 40.66 42.74 1q3t h LEU 150 CO 0.08 -0.32 1.03 -0.65 -0.00 0.00 0.00 178.44 178.59 1q3t h PRO 151 N -0.35 0.00 -0.37 1.13 0.11 -1.86 0.85 132.00 131.52 1q3t h PRO 151 Ca 0.09 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.01 1q3t h PRO 151 Cb 0.49 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 31.48 1q3t h PRO 151 CO -0.31 0.00 -0.10 0.94 -0.21 0.00 0.00 178.00 178.31 1q3t n GLN 152 N -3.93 1.88 -4.01 1.05 -0.06 -0.44 -4.95 117.38 106.93 1q3t n GLN 152 Ca 0.29 -3.24 -0.34 0.00 -2.00 0.00 0.00 57.00 51.72 1q3t n GLN 152 Cb 1.45 -1.83 -0.15 0.00 -4.06 0.00 0.00 30.24 25.65 1q3t n GLN 152 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1q3t s ALA 153 N -3.28 2.60 0.05 1.69 0.00 0.30 -4.87 121.76 118.25 1q3t s ALA 153 Ca 0.45 -1.51 -0.13 0.00 0.00 0.00 0.00 51.96 50.77 1q3t s ALA 153 Cb 0.41 -1.58 -0.05 0.00 0.00 0.00 0.00 23.12 21.90 1q3t s ALA 153 CO -0.01 -0.85 1.22 1.49 0.00 0.00 0.00 175.76 177.62 1q3t h GLU 154 N 7.94 -0.21 -5.20 0.00 4.57 -1.84 -3.39 114.58 116.44 1q3t h GLU 154 Ca -0.31 0.01 -0.61 0.00 -1.18 0.00 0.00 59.36 57.27 1q3t h GLU 154 Cb 1.09 0.05 -0.14 0.00 -0.16 0.00 0.00 28.75 29.60 1q3t h GLU 154 CO 0.56 -0.14 -0.38 -0.51 -1.18 0.00 0.00 179.01 177.35 1q3t s LEU 155 N -7.20 4.12 -0.11 1.64 1.02 -0.96 -5.04 118.68 112.15 1q3t s LEU 155 Ca -0.06 0.26 -0.01 0.00 0.02 0.00 0.00 54.13 54.33 1q3t s LEU 155 Cb 0.03 -2.27 0.03 0.00 0.02 0.00 0.00 46.19 44.00 1q3t s LEU 155 CO 0.24 -0.01 -0.01 -1.59 0.02 0.00 0.00 176.35 175.01 1q3t s LYS 156 N 1.25 0.80 0.14 1.70 -2.85 -1.26 -1.12 119.74 118.40 1q3t s LYS 156 Ca 0.12 -0.08 0.08 0.00 -1.00 0.00 0.00 55.97 55.09 1q3t s LYS 156 Cb -0.14 -1.34 -0.04 0.00 -2.06 0.00 0.00 37.83 34.24 1q3t s LYS 156 CO 0.06 -0.37 -0.12 0.42 0.10 0.00 0.00 175.35 175.44 1q3t s ILE 157 N 1.89 3.16 -0.46 3.79 -1.09 -0.06 -1.32 121.20 127.13 1q3t s ILE 157 Ca 0.04 -1.48 0.03 0.00 -2.23 0.00 0.00 60.65 57.01 1q3t s ILE 157 Cb -0.13 -2.51 0.13 0.00 -1.58 0.00 0.00 42.46 38.37 1q3t s ILE 157 CO -0.06 0.03 0.24 0.12 -1.23 0.00 0.00 174.94 174.03 1q3t s PHE 158 N -1.38 2.25 -0.26 3.97 5.36 0.14 -0.65 117.98 127.41 1q3t s PHE 158 Ca 0.22 -2.59 -0.29 0.00 -0.96 0.00 0.00 56.93 53.30 1q3t s PHE 158 Cb -0.10 -2.10 0.00 0.00 -0.34 0.00 0.00 43.02 40.48 1q3t s PHE 158 CO 0.13 -0.77 1.20 -1.17 -1.46 0.00 0.00 175.22 173.15 1q3t s LEU 159 N 0.21 4.00 0.15 6.12 1.98 -0.12 -2.34 118.68 128.67 1q3t s LEU 159 Ca 0.17 1.33 0.05 0.00 -2.89 0.00 0.00 54.13 52.79 1q3t s LEU 159 Cb -0.25 -3.54 -0.04 0.00 0.66 0.00 0.00 46.19 43.02 1q3t s LEU 159 CO 0.00 -0.89 0.08 -0.69 -1.89 0.00 0.00 176.35 172.96 1q3t s VAL 160 N 3.81 4.26 0.27 1.68 1.01 -0.86 -4.04 120.40 126.53 1q3t s VAL 160 Ca 0.52 -1.12 -0.13 0.00 0.00 0.00 0.00 61.98 61.25 1q3t s VAL 160 Cb -0.17 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.08 1q3t s VAL 160 CO 0.17 -0.06 0.54 0.00 0.00 0.00 0.00 175.10 175.74 1q3t s ALA 161 N -1.66 -0.30 -0.10 5.51 0.00 -1.26 -1.72 121.76 122.23 1q3t s ALA 161 Ca 0.29 -0.86 -0.04 0.00 0.00 0.00 0.00 51.96 51.35 1q3t s ALA 161 Cb -0.10 1.02 -0.04 0.00 0.00 0.00 0.00 23.12 24.00 1q3t s ALA 161 CO 0.22 -0.88 0.07 -1.12 0.00 0.00 0.00 175.76 174.04 1q3t s SER 162 N -3.03 5.79 0.31 0.00 0.01 -1.26 -4.95 113.70 110.56 1q3t s SER 162 Ca 0.21 0.30 0.07 0.00 1.31 0.00 0.00 55.95 57.83 1q3t s SER 162 Cb -0.02 -1.75 0.83 0.00 0.21 0.00 0.00 66.02 65.29 1q3t s SER 162 CO 0.10 0.39 1.67 -0.37 0.41 0.00 0.00 173.24 175.45 1q3t h VAL 163 N 4.04 0.38 0.15 3.43 -1.51 -2.00 -0.25 116.25 120.49 1q3t h VAL 163 Ca -0.53 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 64.83 1q3t h VAL 163 Cb 1.21 0.02 -0.01 0.00 -2.13 0.00 0.00 31.29 30.38 1q3t h VAL 163 CO 0.56 0.06 -0.12 -0.78 -1.23 0.00 0.00 177.57 176.07 1q3t h ASP 164 N 0.34 -0.31 0.38 4.19 1.82 -1.97 0.47 116.42 121.34 1q3t h ASP 164 Ca 0.61 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 57.27 1q3t h ASP 164 Cb 1.25 0.10 -0.03 0.00 0.68 0.00 0.00 39.33 41.33 1q3t h ASP 164 CO -0.58 -0.19 -0.51 -0.33 -1.61 0.00 0.00 179.24 176.01 1q3t h GLU 165 N -0.28 -0.89 0.12 0.28 4.39 -1.47 -1.18 114.58 115.55 1q3t h GLU 165 Ca -0.00 0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 1q3t h GLU 165 Cb 0.25 0.20 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1q3t h GLU 165 CO -0.01 -0.59 -0.06 -0.09 -1.16 0.00 0.00 179.01 177.09 1q3t h ARG 166 N -0.93 -0.16 -1.14 2.33 2.43 -1.39 -2.31 114.38 113.23 1q3t h ARG 166 Ca -0.04 0.01 0.32 0.00 -0.81 0.00 0.00 59.98 59.46 1q3t h ARG 166 Cb 0.84 0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.36 1q3t h ARG 166 CO -0.14 -0.07 0.79 0.00 -1.51 0.00 0.00 179.97 179.05 1q3t h ALA 167 N 0.67 2.85 -0.01 2.80 0.00 0.05 0.49 119.26 126.10 1q3t h ALA 167 Ca -0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1q3t h ALA 167 Cb 0.16 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1q3t h ALA 167 CO 0.03 -1.21 -0.12 1.49 0.00 0.00 0.00 179.25 179.43 1q3t h GLU 168 N 0.11 0.10 -0.64 0.00 4.81 -0.68 -2.73 114.58 115.55 1q3t h GLU 168 Ca 0.57 -0.09 0.15 0.00 -0.13 0.00 0.00 59.36 59.86 1q3t h GLU 168 Cb 2.03 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 31.40 1q3t h GLU 168 CO -0.10 0.82 0.44 0.00 -0.73 0.00 0.00 179.01 179.44 1q3t h ARG 169 N -0.60 0.22 -0.05 1.92 3.08 -0.47 -1.36 114.38 117.12 1q3t h ARG 169 Ca -0.01 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 59.91 1q3t h ARG 169 Cb 0.86 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.87 1q3t h ARG 169 CO 0.02 0.14 -0.40 0.00 -1.07 0.00 0.00 179.97 178.66 1q3t h ARG 170 N 0.22 0.37 -0.59 0.04 2.47 -1.32 -2.81 114.38 112.77 1q3t h ARG 170 Ca 0.31 -0.33 0.12 0.00 -1.26 0.00 0.00 59.98 58.82 1q3t h ARG 170 Cb 0.90 0.08 -0.09 0.00 -1.65 0.00 0.00 29.97 29.21 1q3t h ARG 170 CO -0.06 0.98 0.05 -0.92 0.56 0.00 0.00 179.97 180.58 1q3t h TYR 171 N -0.13 0.06 0.14 3.04 3.20 -0.93 -1.29 116.97 121.06 1q3t h TYR 171 Ca -0.04 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 1q3t h TYR 171 Cb 1.08 0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.41 1q3t h TYR 171 CO 0.14 -0.10 -0.07 0.87 -1.64 0.00 0.00 178.16 177.35 1q3t h LYS 172 N 0.17 -0.19 -0.82 1.82 1.57 -1.53 -2.35 116.57 115.24 1q3t h LYS 172 Ca 0.31 0.01 0.24 0.00 -1.87 0.00 0.00 60.65 59.34 1q3t h LYS 172 Cb 0.48 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 1q3t h LYS 172 CO -0.46 0.04 0.65 0.93 -0.57 0.00 0.00 179.45 180.05 1q3t h GLU 173 N -0.40 0.00 0.01 3.15 5.08 -1.12 0.94 114.58 122.25 1q3t h GLU 173 Ca -0.02 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.13 1q3t h GLU 173 Cb 0.32 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1q3t h GLU 173 CO 0.03 0.00 -0.97 -0.91 -1.00 0.00 0.00 179.01 176.16 1q3t h ASN 174 N 0.00 0.07 0.01 1.42 4.21 -0.87 -2.93 115.58 117.49 1q3t h ASN 174 Ca 0.39 -0.07 -0.00 0.00 1.21 0.00 0.00 56.30 57.83 1q3t h ASN 174 Cb 1.69 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 38.87 1q3t h ASN 174 CO -0.00 1.00 -0.00 0.40 -1.29 0.00 0.00 177.43 177.53 1q3t h ILE 175 N 0.02 1.41 -0.08 2.81 1.08 0.12 -2.41 117.51 120.46 1q3t h ILE 175 Ca -0.03 -2.00 0.02 0.00 -0.39 0.00 0.00 64.86 62.46 1q3t h ILE 175 Cb 1.69 2.63 -0.00 0.00 -3.07 0.00 0.00 36.82 38.07 1q3t h ILE 175 CO 0.13 0.47 0.07 0.00 -0.69 0.00 0.00 178.15 178.13 1q3t h ALA 176 N -0.18 1.78 0.00 1.87 0.00 -0.51 -0.14 119.26 122.08 1q3t h ALA 176 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1q3t h ALA 176 Cb 0.77 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1q3t h ALA 176 CO 0.00 -0.11 0.00 1.63 0.00 0.00 0.00 179.25 180.77 1q3t n LYS 177 N -4.05 0.14 0.00 0.00 4.01 -1.11 -4.84 118.16 112.31 1q3t n LYS 177 Ca -0.01 0.30 0.00 0.00 -0.51 0.00 0.00 58.31 58.09 1q3t n LYS 177 Cb 0.17 -1.73 0.00 0.00 -0.51 0.00 0.00 35.03 32.97 1q3t n LYS 177 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1q3t n GLY 178 N 0.35 1.96 2.17 0.72 0.00 -0.08 -5.10 105.19 105.21 1q3t n GLY 178 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.89 1q3t n GLY 178 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1q3t n ILE 179 N -0.40 0.00 -2.84 -0.61 5.41 -0.91 -5.03 119.36 114.98 1q3t n ILE 179 Ca 0.00 -1.54 -0.12 0.00 1.00 0.00 0.00 62.75 62.09 1q3t n ILE 179 Cb 0.00 0.56 0.02 0.00 -0.71 0.00 0.00 39.64 39.51 1q3t n ILE 179 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1q3t n GLU 180 N -0.59 1.08 -2.04 0.38 2.13 -1.26 -4.13 120.64 116.21 1q3t n GLU 180 Ca -0.03 -3.16 -0.41 0.00 0.66 0.00 0.00 57.16 54.22 1q3t n GLU 180 Cb 0.40 -1.32 -0.02 0.00 0.27 0.00 0.00 31.44 30.77 1q3t n GLU 180 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1q3t s THR 181 N -2.57 2.70 0.31 6.31 2.01 -1.26 -5.00 115.64 118.15 1q3t s THR 181 Ca 0.31 0.61 -0.21 0.00 0.31 0.00 0.00 61.69 62.71 1q3t s THR 181 Cb 0.41 -3.39 -0.09 0.00 0.01 0.00 0.00 72.50 69.44 1q3t s THR 181 CO -0.01 0.11 0.84 -1.81 -0.69 0.00 0.00 174.62 173.05 1q3t s ASP 182 N 0.19 7.07 0.05 3.53 1.01 -1.26 -4.89 116.67 122.37 1q3t s ASP 182 Ca 0.57 1.58 -0.23 0.00 0.71 0.00 0.00 52.55 55.18 1q3t s ASP 182 Cb -0.41 -2.48 -0.15 0.00 1.01 0.00 0.00 42.92 40.88 1q3t s ASP 182 CO 0.45 -0.12 1.54 0.25 0.21 0.00 0.00 175.17 177.50 1q3t h LEU 183 N 2.85 0.08 -1.95 1.23 6.46 -1.96 -2.68 115.31 119.34 1q3t h LEU 183 Ca -0.48 -0.22 0.32 0.00 -0.12 0.00 0.00 57.88 57.38 1q3t h LEU 183 Cb 1.19 -0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 41.05 1q3t h LEU 183 CO 0.64 0.28 0.82 -0.33 -0.62 0.00 0.00 178.44 179.23 1q3t h GLU 184 N -0.13 0.00 0.00 1.25 5.08 -1.99 0.14 114.58 118.94 1q3t h GLU 184 Ca 0.02 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1q3t h GLU 184 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1q3t h GLU 184 CO -0.00 0.00 -0.00 1.15 -1.00 0.00 0.00 179.01 179.16 1q3t h THR 185 N 0.00 1.44 -0.57 1.13 2.02 -1.88 -2.84 112.91 112.21 1q3t h THR 185 Ca 0.52 -1.34 -0.07 0.00 0.77 0.00 0.00 66.41 66.29 1q3t h THR 185 Cb 2.15 2.35 -0.02 0.00 -1.74 0.00 0.00 68.15 70.89 1q3t h THR 185 CO -0.01 0.35 0.10 -0.07 0.37 0.00 0.00 175.52 176.26 1q3t h LEU 186 N -0.58 0.91 -0.41 2.58 3.38 -0.77 -0.75 115.31 119.67 1q3t h LEU 186 Ca -0.00 -0.26 0.07 0.00 0.09 0.00 0.00 57.88 57.78 1q3t h LEU 186 Cb 0.57 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 1q3t h LEU 186 CO 0.00 0.93 0.04 0.50 0.09 0.00 0.00 178.44 180.00 1q3t h LYS 187 N 0.84 0.15 0.19 1.13 3.64 -0.92 0.10 116.57 121.70 1q3t h LYS 187 Ca 0.17 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1q3t h LYS 187 Cb 0.41 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1q3t h LYS 187 CO 0.01 0.10 -0.09 0.87 -2.27 0.00 0.00 179.45 178.07 1q3t h LYS 188 N 0.15 -0.24 -0.73 1.90 1.57 -1.37 -2.31 116.57 115.54 1q3t h LYS 188 Ca 0.20 0.02 0.16 0.00 -1.87 0.00 0.00 60.65 59.16 1q3t h LYS 188 Cb 0.27 0.05 -0.12 0.00 0.08 0.00 0.00 32.23 32.51 1q3t h LYS 188 CO -0.30 0.14 0.09 1.49 -0.57 0.00 0.00 179.45 180.30 1q3t h GLU 189 N -0.70 0.17 -0.20 3.15 4.81 -0.92 0.33 114.58 121.22 1q3t h GLU 189 Ca -0.03 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.12 1q3t h GLU 189 Cb 0.49 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1q3t h GLU 189 CO 0.04 0.11 -0.19 0.82 -0.73 0.00 0.00 179.01 179.07 1q3t h ILE 190 N 0.18 1.23 -0.51 2.32 2.04 -0.82 -2.59 117.51 119.35 1q3t h ILE 190 Ca 0.41 -1.03 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 1q3t h ILE 190 Cb 0.72 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 1q3t h ILE 190 CO -0.58 0.32 0.17 0.00 0.00 0.00 0.00 178.15 178.06 1q3t h ALA 191 N 1.49 1.34 0.17 1.87 0.00 0.22 0.41 119.26 124.76 1q3t h ALA 191 Ca 0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1q3t h ALA 191 Cb 0.52 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1q3t h ALA 191 CO 0.03 0.48 -0.08 0.00 0.00 0.00 0.00 179.25 179.68 1q3t h ALA 192 N 1.45 -0.22 -0.02 0.00 0.00 -1.00 -2.77 119.26 116.70 1q3t h ALA 192 Ca 0.17 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1q3t h ALA 192 Cb 0.21 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1q3t h ALA 192 CO -0.01 -0.32 0.01 0.00 0.00 0.00 0.00 179.25 178.93 1q3t h ARG 193 N -0.84 0.03 -0.83 0.00 3.08 -1.42 -0.93 114.38 113.46 1q3t h ARG 193 Ca -0.02 -0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.20 1q3t h ARG 193 Cb 0.53 -0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.46 1q3t h ARG 193 CO 0.04 0.18 0.34 0.22 -1.07 0.00 0.00 179.97 179.68 1q3t h ASP 194 N -0.13 0.30 0.42 7.04 3.58 -0.31 0.84 116.42 128.17 1q3t h ASP 194 Ca 0.01 0.13 -0.02 0.00 0.42 0.00 0.00 57.03 57.57 1q3t h ASP 194 Cb 0.16 0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.33 1q3t h ASP 194 CO -0.00 0.05 -0.20 0.22 -2.88 0.00 0.00 179.24 176.43 1q3t h TYR 195 N 0.43 -0.52 -1.11 0.28 5.03 -1.27 0.58 116.97 120.39 1q3t h TYR 195 Ca 0.49 -0.01 0.31 0.00 2.58 0.00 0.00 58.73 62.09 1q3t h TYR 195 Cb 0.83 0.17 -0.06 0.00 1.55 0.00 0.00 36.73 39.22 1q3t h TYR 195 CO -0.16 -0.20 0.77 0.87 -1.32 0.00 0.00 178.16 178.12 1q3t h LYS 196 N -0.98 0.12 0.09 1.82 1.57 -0.59 0.60 116.57 119.20 1q3t h LYS 196 Ca -0.06 -0.01 -0.28 0.00 -1.87 0.00 0.00 60.65 58.44 1q3t h LYS 196 Cb 0.55 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1q3t h LYS 196 CO 0.09 0.08 -1.38 0.22 -0.57 0.00 0.00 179.45 177.89 1q3t h ASP 197 N 0.13 0.29 -0.50 0.86 3.58 -0.75 -3.30 116.42 116.72 1q3t h ASP 197 Ca 0.56 -0.37 -0.02 0.00 0.42 0.00 0.00 57.03 57.62 1q3t h ASP 197 Cb 1.96 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 42.90 1q3t h ASP 197 CO -0.10 1.30 0.03 -0.24 -2.88 0.00 0.00 179.24 177.34 1q3t n SER 198 N -3.41 4.94 -1.65 2.28 2.88 0.16 -4.11 113.62 114.71 1q3t n SER 198 Ca -0.12 -2.81 0.03 0.00 -1.33 0.00 0.00 58.87 54.64 1q3t n SER 198 Cb 1.02 -0.66 0.02 0.00 -0.75 0.00 0.00 64.21 63.84 1q3t n SER 198 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 1q3t n HIS 199 N 0.46 0.14 -3.56 0.66 -0.00 0.16 -4.96 115.22 108.11 1q3t n HIS 199 Ca 0.25 -0.70 0.00 0.00 0.46 0.00 0.00 57.72 57.73 1q3t n HIS 199 Cb 1.07 -0.13 0.00 0.00 -0.12 0.00 0.00 29.99 30.82 1q3t n HIS 199 CO 0.00 0.00 0.00 -2.13 0.46 0.00 0.00 176.34 174.67 1q3t n ARG 200 N 0.34 2.74 0.07 1.57 0.63 -1.25 -4.95 116.66 115.81 1q3t n ARG 200 Ca 0.05 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.98 1q3t n ARG 200 Cb 1.09 0.00 0.00 0.00 0.45 0.00 0.00 32.46 34.00 1q3t n ARG 200 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1q3t n GLU 201 N -0.03 0.00 -1.57 -0.14 2.13 -1.26 -4.97 120.64 114.81 1q3t n GLU 201 Ca 0.00 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.39 1q3t n GLU 201 Cb 0.00 -0.39 0.00 0.00 0.27 0.00 0.00 31.44 31.32 1q3t n GLU 201 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1q3t n THR 202 N -3.47 2.16 -3.80 6.31 -1.04 -1.26 -2.50 114.28 110.68 1q3t n THR 202 Ca 0.00 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.05 61.21 1q3t n THR 202 Cb 0.00 -0.95 0.02 0.00 -1.82 0.00 0.00 70.33 67.58 1q3t n THR 202 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1q3t n SER 203 N 0.92 -3.49 -4.65 8.00 7.64 -1.26 -4.89 113.62 115.89 1q3t n SER 203 Ca 0.10 -1.03 -0.43 0.00 1.01 0.00 0.00 58.87 58.52 1q3t n SER 203 Cb 0.37 -3.18 -0.02 0.00 -1.01 0.00 0.00 64.21 60.36 1q3t n SER 203 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1q3t s PRO 204 N -6.26 4.18 0.00 1.43 0.04 -1.04 -4.96 135.00 128.39 1q3t s PRO 204 Ca 0.31 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.72 1q3t s PRO 204 Cb -0.12 -3.71 0.00 0.00 0.04 0.00 0.00 34.50 30.71 1q3t s PRO 204 CO 0.88 -0.75 0.38 1.28 0.04 0.00 0.00 177.00 178.83 1q3t n LEU 205 N 6.62 0.09 -2.44 -3.56 4.32 -1.26 -4.78 117.00 115.99 1q3t n LEU 205 Ca 0.13 0.38 -0.06 0.00 -0.02 0.00 0.00 56.01 56.44 1q3t n LEU 205 Cb 0.46 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.26 1q3t n LEU 205 CO 0.55 0.00 -0.08 1.17 -1.22 0.00 0.00 177.39 177.81 1q3t n LYS 206 N -0.40 -2.57 -2.09 3.23 4.81 -1.26 -3.93 118.16 115.96 1q3t n LYS 206 Ca 0.00 0.30 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 1q3t n LYS 206 Cb 0.00 -4.84 0.00 0.00 0.02 0.00 0.00 35.03 30.21 1q3t n LYS 206 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1q3t n GLN 207 N -2.62 -5.10 -0.61 1.64 7.27 -1.26 -4.94 117.38 111.75 1q3t n GLN 207 Ca -0.07 3.68 -0.26 0.00 0.07 0.00 0.00 57.00 60.42 1q3t n GLN 207 Cb 0.55 -4.19 0.15 0.00 2.41 0.00 0.00 30.24 29.16 1q3t n GLN 207 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1q3t n ALA 208 N 1.76 -2.61 -0.07 1.69 0.00 -1.25 -4.81 120.51 115.22 1q3t n ALA 208 Ca 0.00 -1.19 -0.12 0.00 0.00 0.00 0.00 53.44 52.12 1q3t n ALA 208 Cb 0.00 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.24 1q3t n ALA 208 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1q3t h GLU 209 N -2.34 -0.42 -0.56 0.00 4.81 -1.92 -3.07 114.58 111.08 1q3t h GLU 209 Ca -0.38 0.03 -0.41 0.00 -0.13 0.00 0.00 59.36 58.47 1q3t h GLU 209 Cb 1.07 0.10 -0.35 0.00 0.63 0.00 0.00 28.75 30.19 1q3t h GLU 209 CO 0.25 -0.28 -0.81 -0.25 -0.73 0.00 0.00 179.01 177.19 1q3t n ASP 210 N -5.42 3.83 -4.63 1.04 9.92 -1.26 -5.04 116.55 114.99 1q3t n ASP 210 Ca -0.03 -3.50 -0.43 0.00 -0.53 0.00 0.00 54.79 50.31 1q3t n ASP 210 Cb 0.36 -0.39 -0.02 0.00 -0.64 0.00 0.00 41.12 40.43 1q3t n ASP 210 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1q3t s ALA 211 N -3.45 3.34 -0.09 2.24 0.00 -1.16 -4.77 121.76 117.87 1q3t s ALA 211 Ca 0.45 0.42 -0.29 0.00 0.00 0.00 0.00 51.96 52.54 1q3t s ALA 211 Cb 0.39 -3.81 -0.07 0.00 0.00 0.00 0.00 23.12 19.63 1q3t s ALA 211 CO 0.00 -1.82 1.98 0.08 0.00 0.00 0.00 175.76 176.00 1q3t s VAL 212 N 4.82 3.15 -0.08 0.00 1.01 -0.43 -4.73 120.40 124.14 1q3t s VAL 212 Ca 0.67 0.17 -0.30 0.00 0.00 0.00 0.00 61.98 62.52 1q3t s VAL 212 Cb -0.23 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 1q3t s VAL 212 CO 0.27 -0.05 1.08 -0.47 0.00 0.00 0.00 175.10 175.93 1q3t s TYR 213 N 5.74 3.40 -0.29 5.22 6.14 -1.26 0.23 117.35 136.54 1q3t s TYR 213 Ca 0.89 1.46 0.01 0.00 0.64 0.00 0.00 57.07 60.07 1q3t s TYR 213 Cb -0.36 -3.27 0.18 0.00 0.42 0.00 0.00 41.96 38.92 1q3t s TYR 213 CO 0.37 -0.62 0.55 -1.17 0.64 0.00 0.00 175.55 175.31 1q3t s LEU 214 N 2.02 -1.30 -0.10 6.97 2.96 -0.99 -4.95 118.68 123.30 1q3t s LEU 214 Ca 0.51 0.44 -0.14 0.00 -0.22 0.00 0.00 54.13 54.72 1q3t s LEU 214 Cb -0.21 1.87 -0.05 0.00 0.50 0.00 0.00 46.19 48.31 1q3t s LEU 214 CO 0.20 -0.29 0.36 1.51 -1.32 0.00 0.00 176.35 176.81 1q3t s ASP 215 N 2.77 6.60 -0.47 3.68 -4.77 -1.26 -2.03 116.67 121.20 1q3t s ASP 215 Ca 0.15 0.71 0.03 0.00 -3.30 0.00 0.00 52.55 50.14 1q3t s ASP 215 Cb -0.13 -2.22 0.15 0.00 -1.09 0.00 0.00 42.92 39.63 1q3t s ASP 215 CO -0.23 0.18 0.29 -0.89 0.70 0.00 0.00 175.17 175.22 1q3t s THR 216 N -0.12 1.32 -0.26 2.11 2.01 -0.70 -4.91 115.64 115.10 1q3t s THR 216 Ca 0.21 -2.75 -0.21 0.00 0.31 0.00 0.00 61.69 59.25 1q3t s THR 216 Cb -0.15 -1.91 -0.02 0.00 0.01 0.00 0.00 72.50 70.44 1q3t s THR 216 CO 0.08 -0.98 0.65 0.42 -0.69 0.00 0.00 174.62 174.10 1q3t s THR 217 N 0.10 4.96 -0.94 -0.82 -4.23 -1.26 -4.18 115.64 109.27 1q3t s THR 217 Ca 0.22 1.15 -0.05 0.00 -1.18 0.00 0.00 61.69 61.83 1q3t s THR 217 Cb -0.16 -3.96 0.04 0.00 1.34 0.00 0.00 72.50 69.77 1q3t s THR 217 CO -0.06 0.00 0.22 0.61 -0.54 0.00 0.00 174.62 174.86 1q3t n GLY 218 N 4.14 -0.49 3.83 3.99 0.00 -1.26 -4.93 105.19 110.48 1q3t n GLY 218 Ca 0.00 0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1q3t n GLY 218 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1q3t s LEU 219 N -5.90 4.03 0.54 0.99 1.43 -1.26 -5.07 118.68 113.45 1q3t s LEU 219 Ca 0.20 0.11 -0.19 0.00 -1.03 0.00 0.00 54.13 53.23 1q3t s LEU 219 Cb -0.11 -2.67 -0.10 0.00 0.03 0.00 0.00 46.19 43.34 1q3t s LEU 219 CO 0.25 0.18 0.44 -3.20 0.23 0.00 0.00 176.35 174.25 1q3t n ASN 220 N 0.42 -1.36 -0.04 2.29 2.85 -1.26 -4.91 115.26 113.26 1q3t n ASN 220 Ca -0.07 0.75 -0.16 0.00 -0.11 0.00 0.00 54.58 54.99 1q3t n ASN 220 Cb 0.51 -1.12 -0.08 0.00 1.24 0.00 0.00 39.78 40.33 1q3t n ASN 220 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1q3t h ILE 221 N 0.28 1.36 -0.55 -1.44 1.08 -1.97 -3.17 117.51 113.10 1q3t h ILE 221 Ca -0.44 -1.76 0.07 0.00 -0.39 0.00 0.00 64.86 62.34 1q3t h ILE 221 Cb 1.41 2.10 -0.03 0.00 -3.07 0.00 0.00 36.82 37.22 1q3t h ILE 221 CO 0.47 0.53 0.37 0.06 -0.69 0.00 0.00 178.15 178.89 1q3t h GLN 222 N 0.16 0.45 -0.53 2.37 3.07 -2.00 -0.60 115.11 118.02 1q3t h GLN 222 Ca -0.02 -0.03 0.03 0.00 0.09 0.00 0.00 58.65 58.72 1q3t h GLN 222 Cb 1.09 -0.10 -0.03 0.00 0.08 0.00 0.00 27.48 28.52 1q3t h GLN 222 CO 0.10 0.30 0.35 0.93 0.09 0.00 0.00 178.83 180.60 1q3t h GLU 223 N 0.46 0.58 -0.02 0.06 4.39 -1.91 -2.27 114.58 115.87 1q3t h GLU 223 Ca 0.24 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.88 1q3t h GLU 223 Cb 0.36 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1q3t h GLU 223 CO -0.07 0.38 -0.08 0.28 -1.16 0.00 0.00 179.01 178.37 1q3t h VAL 224 N 0.60 1.49 -0.81 3.13 2.07 -1.20 -2.82 116.25 118.71 1q3t h VAL 224 Ca 0.21 -1.57 0.16 0.00 0.82 0.00 0.00 66.70 66.32 1q3t h VAL 224 Cb 0.10 2.48 -0.10 0.00 -1.52 0.00 0.00 31.29 32.25 1q3t h VAL 224 CO -0.06 0.42 0.36 0.58 0.02 0.00 0.00 177.57 178.89 1q3t h VAL 225 N -0.51 0.65 -0.20 2.57 2.07 -1.21 -1.15 116.25 118.46 1q3t h VAL 225 Ca -0.00 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 1q3t h VAL 225 Cb 0.73 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1q3t h VAL 225 CO 0.02 0.09 0.06 -0.08 0.02 0.00 0.00 177.57 177.67 1q3t h GLU 226 N 0.49 0.31 -0.35 1.57 4.81 -1.47 -0.39 114.58 119.56 1q3t h GLU 226 Ca 0.46 -0.07 0.08 0.00 -0.13 0.00 0.00 59.36 59.69 1q3t h GLU 226 Cb 0.71 -0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.97 1q3t h GLU 226 CO -0.41 0.42 -0.26 0.87 -0.73 0.00 0.00 179.01 178.90 1q3t h LYS 227 N 0.14 -0.21 -0.03 1.92 1.79 -0.97 0.15 116.57 119.36 1q3t h LYS 227 Ca 0.06 0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1q3t h LYS 227 Cb 0.24 0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 30.94 1q3t h LYS 227 CO -0.00 -0.14 0.01 0.82 -1.08 0.00 0.00 179.45 179.06 1q3t h ILE 228 N -0.21 1.21 -0.65 1.86 5.03 -1.33 -2.63 117.51 120.78 1q3t h ILE 228 Ca 0.17 -0.64 0.13 0.00 -0.12 0.00 0.00 64.86 64.41 1q3t h ILE 228 Cb 0.48 1.58 -0.10 0.00 -3.03 0.00 0.00 36.82 35.75 1q3t h ILE 228 CO -0.47 0.17 0.08 0.50 -0.68 0.00 0.00 178.15 177.75 1q3t h LYS 229 N -0.20 0.19 -0.83 2.37 1.63 -0.53 0.12 116.57 119.33 1q3t h LYS 229 Ca 0.01 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1q3t h LYS 229 Cb 0.27 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.82 1q3t h LYS 229 CO 0.00 0.12 0.51 0.00 -3.45 0.00 0.00 179.45 176.63 1q3t h ALA 230 N 1.56 1.34 -0.29 5.00 0.00 -0.65 0.19 119.26 126.40 1q3t h ALA 230 Ca 0.35 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 1q3t h ALA 230 Cb 0.56 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1q3t h ALA 230 CO -0.49 0.58 -0.25 1.49 0.00 0.00 0.00 179.25 180.58 1q3t h GLU 231 N 1.14 0.57 0.04 0.00 4.57 -0.48 -1.49 114.58 118.93 1q3t h GLU 231 Ca 0.30 -0.22 -0.00 0.00 -1.18 0.00 0.00 59.36 58.25 1q3t h GLU 231 Cb -0.06 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1q3t h GLU 231 CO -0.06 0.77 -0.02 0.00 -1.18 0.00 0.00 179.01 178.53 1q3t h ALA 232 N 1.23 -0.05 -0.52 2.92 0.00 -0.32 -2.05 119.26 120.46 1q3t h ALA 232 Ca 0.07 -0.33 0.07 0.00 0.00 0.00 0.00 54.91 54.71 1q3t h ALA 232 Cb 0.70 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.45 1q3t h ALA 232 CO 0.05 -0.14 0.21 1.49 0.00 0.00 0.00 179.25 180.87 1q3t h GLU 233 N -0.84 0.39 -0.14 0.00 4.81 -0.68 -0.76 114.58 117.37 1q3t h GLU 233 Ca -0.01 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1q3t h GLU 233 Cb 0.68 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1q3t h GLU 233 CO 0.01 0.26 0.03 -0.22 -0.73 0.00 0.00 179.01 178.36 1q3t h LYS 234 N 0.41 0.22 -0.33 1.92 3.64 -1.37 -2.66 116.57 118.39 1q3t h LYS 234 Ca 0.25 -0.06 0.10 0.00 -1.27 0.00 0.00 60.65 59.67 1q3t h LYS 234 Cb 0.24 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1q3t h LYS 234 CO -0.23 0.39 0.25 -0.09 -2.27 0.00 0.00 179.45 177.49 1q3t h ARG 235 N 0.02 0.00 -0.00 1.90 2.43 -0.93 -3.51 114.38 114.28 1q3t h ARG 235 Ca 0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1q3t h ARG 235 Cb 0.27 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1q3t h ARG 235 CO 0.00 0.00 0.00 -1.33 -1.51 0.00 0.00 179.97 177.13