#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ptq s GLU 2 N 0.00 3.95 0.10 0.03 2.56 -1.26 -5.00 118.70 119.08 2ptq s GLU 2 Ca 0.00 0.85 -0.31 0.00 0.00 0.00 0.00 54.97 55.52 2ptq s GLU 2 Cb 0.00 -2.22 -0.07 0.00 2.00 0.00 0.00 34.13 33.84 2ptq s GLU 2 CO 0.00 -0.16 1.30 -1.17 -0.56 0.00 0.00 175.26 174.67 2ptq s LEU 3 N -3.83 4.38 0.25 2.70 2.96 -1.26 -4.78 118.68 119.09 2ptq s LEU 3 Ca 0.57 2.21 -0.14 0.00 -0.22 0.00 0.00 54.13 56.56 2ptq s LEU 3 Cb -0.10 -3.59 -0.00 0.00 0.50 0.00 0.00 46.19 43.00 2ptq s LEU 3 CO 0.28 -0.56 0.50 -0.94 -1.32 0.00 0.00 176.35 174.31 2ptq s SER 4 N 0.99 -0.11 0.51 3.68 1.04 -1.26 -4.98 113.70 113.57 2ptq s SER 4 Ca 0.61 -0.89 0.19 0.00 0.48 0.00 0.00 55.95 56.34 2ptq s SER 4 Cb -0.34 0.60 1.32 0.00 0.10 0.00 0.00 66.02 67.70 2ptq s SER 4 CO 0.31 -1.16 2.12 0.77 0.98 0.00 0.00 173.24 176.26 2ptq h SER 5 N 2.23 0.00 0.51 7.02 4.64 -1.88 0.45 113.55 126.52 2ptq h SER 5 Ca -0.25 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.86 2ptq h SER 5 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 2ptq h SER 5 CO 0.34 0.06 -0.90 -0.07 -0.87 0.00 0.00 176.83 175.39 2ptq h LEU 6 N 0.00 0.33 -0.28 5.97 3.38 -1.89 -3.32 115.31 119.50 2ptq h LEU 6 Ca -0.00 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2ptq h LEU 6 Cb 0.11 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2ptq h LEU 6 CO 0.01 1.07 -0.68 0.35 0.09 0.00 0.00 178.44 179.28 2ptq n THR 7 N -3.68 0.00 -1.70 0.22 -2.24 -0.77 -4.96 114.28 101.15 2ptq n THR 7 Ca -0.04 -0.07 -0.44 0.00 -2.27 0.00 0.00 64.05 61.22 2ptq n THR 7 Cb 0.81 0.81 -0.03 0.00 -2.10 0.00 0.00 70.33 69.82 2ptq n THR 7 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ptq n ALA 8 N -1.08 1.73 -0.09 6.98 0.00 0.08 -4.81 120.51 123.31 2ptq n ALA 8 Ca 0.06 0.41 -0.11 0.00 0.00 0.00 0.00 53.44 53.80 2ptq n ALA 8 Cb 0.36 -2.37 -0.04 0.00 0.00 0.00 0.00 19.45 17.41 2ptq n ALA 8 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2ptq h VAL 9 N 3.32 1.25 -3.25 0.00 2.07 -1.93 -3.43 116.25 114.28 2ptq h VAL 9 Ca -0.45 -0.91 -0.58 0.00 0.82 0.00 0.00 66.70 65.58 2ptq h VAL 9 Cb 1.25 1.32 -0.06 0.00 -1.52 0.00 0.00 31.29 32.28 2ptq h VAL 9 CO 0.81 0.29 -0.08 -0.55 0.02 0.00 0.00 177.57 178.06 2ptq s SER 10 N -5.97 6.90 0.04 0.57 0.15 -1.26 -4.96 113.70 109.16 2ptq s SER 10 Ca -0.14 1.07 0.15 0.00 0.70 0.00 0.00 55.95 57.73 2ptq s SER 10 Cb 0.08 -2.33 0.63 0.00 -1.71 0.00 0.00 66.02 62.69 2ptq s SER 10 CO 0.75 0.15 1.47 -0.81 1.20 0.00 0.00 173.24 176.00 2ptq n PRO 11 N 2.59 0.03 -0.03 5.44 -0.04 -1.26 -0.80 135.00 140.93 2ptq n PRO 11 Ca -0.09 0.30 -0.06 0.00 -0.04 0.00 0.00 63.50 63.61 2ptq n PRO 11 Cb 0.51 -1.56 0.14 0.00 -0.04 0.00 0.00 33.50 32.56 2ptq n PRO 11 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2ptq h VAL 12 N 0.00 1.27 -0.00 0.52 2.07 -1.93 -1.03 116.25 117.16 2ptq h VAL 12 Ca 0.00 -1.34 0.00 0.00 0.82 0.00 0.00 66.70 66.18 2ptq h VAL 12 Cb 0.24 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 2ptq h VAL 12 CO 0.00 0.43 -0.74 0.47 0.02 0.00 0.00 177.57 177.75 2ptq n ASP 13 N -4.10 0.76 0.00 0.57 8.00 -1.00 -3.19 116.55 117.58 2ptq n ASP 13 Ca -0.00 -0.88 0.00 0.00 0.71 0.00 0.00 54.79 54.62 2ptq n ASP 13 Cb 0.43 0.99 0.00 0.00 -0.02 0.00 0.00 41.12 42.53 2ptq n ASP 13 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ptq n GLY 14 N 1.37 0.75 0.39 0.44 0.00 0.01 -4.23 105.19 103.93 2ptq n GLY 14 Ca 0.03 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.24 2ptq n GLY 14 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2ptq h ARG 15 N 0.00 0.48 -0.41 1.61 2.43 -1.67 -1.32 114.38 115.49 2ptq h ARG 15 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2ptq h ARG 15 Cb 0.00 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 2ptq h ARG 15 CO 0.00 0.32 0.00 0.66 -1.51 0.00 0.00 179.97 179.44 2ptq n TYR 16 N -4.60 0.97 -0.33 2.20 4.01 -0.41 -4.67 117.16 114.33 2ptq n TYR 16 Ca 0.22 -0.68 0.19 0.00 -0.16 0.00 0.00 57.90 57.47 2ptq n TYR 16 Cb 0.72 -0.21 0.43 0.00 -0.31 0.00 0.00 39.34 39.97 2ptq n TYR 16 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2ptq h GLY 17 N 2.58 1.56 2.00 2.72 0.00 -1.20 0.23 103.07 110.96 2ptq h GLY 17 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.06 2ptq h GLY 17 CO 0.16 -0.15 0.00 2.09 0.00 0.00 0.00 176.54 178.64 2ptq n ASP 18 N -4.74 0.58 0.04 0.19 5.75 -1.26 -2.57 116.55 114.54 2ptq n ASP 18 Ca 0.25 0.63 0.13 0.00 -0.01 0.00 0.00 54.79 55.79 2ptq n ASP 18 Cb 0.76 -0.76 0.34 0.00 -1.03 0.00 0.00 41.12 40.43 2ptq n ASP 18 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2ptq n LYS 19 N -2.13 0.15 -0.76 0.11 4.76 0.80 -4.10 118.16 117.00 2ptq n LYS 19 Ca 0.03 0.07 0.04 0.00 -2.87 0.00 0.00 58.31 55.58 2ptq n LYS 19 Cb 0.25 -1.62 0.08 0.00 -1.84 0.00 0.00 35.03 31.89 2ptq n LYS 19 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2ptq n VAL 20 N -1.85 0.80 -0.31 -0.18 0.24 -1.06 -4.75 118.33 111.22 2ptq n VAL 20 Ca 0.05 -1.40 0.22 0.00 -2.04 0.00 0.00 64.34 61.17 2ptq n VAL 20 Cb 0.39 0.37 0.51 0.00 -1.47 0.00 0.00 33.84 33.64 2ptq n VAL 20 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2ptq h SER 21 N 0.52 0.44 0.05 -1.34 4.64 -1.68 0.81 113.55 116.99 2ptq h SER 21 Ca -0.07 0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2ptq h SER 21 Cb 1.40 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.49 2ptq h SER 21 CO 0.03 0.11 -0.03 0.00 -0.87 0.00 0.00 176.83 176.07 2ptq h ALA 22 N 1.61 1.72 0.00 5.18 0.00 -1.91 -1.73 119.26 124.12 2ptq h ALA 22 Ca 0.56 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.45 2ptq h ALA 22 Cb 1.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2ptq h ALA 22 CO -0.26 0.04 0.00 -0.07 0.00 0.00 0.00 179.25 178.96 2ptq h LEU 23 N 0.00 0.00 -1.83 0.00 3.38 -1.23 -3.12 115.31 112.50 2ptq h LEU 23 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2ptq h LEU 23 Cb 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2ptq h LEU 23 CO 0.00 0.00 -0.10 0.03 0.09 0.00 0.00 178.44 178.46 2ptq h ARG 24 N 0.00 0.00 -0.35 1.13 3.08 -1.40 -1.00 114.38 115.84 2ptq h ARG 24 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ptq h ARG 24 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.74 2ptq h ARG 24 CO 0.00 0.10 0.00 0.41 -1.07 0.00 0.00 179.97 179.41 2ptq n GLY 25 N -0.48 1.22 1.18 0.04 0.00 -1.18 -4.28 105.19 101.70 2ptq n GLY 25 Ca -0.01 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2ptq n GLY 25 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2ptq n ILE 26 N 1.03 0.98 1.09 -0.61 5.41 -0.58 -4.55 119.36 122.13 2ptq n ILE 26 Ca 0.18 0.32 0.12 0.00 1.00 0.00 0.00 62.75 64.37 2ptq n ILE 26 Cb 0.49 -1.43 0.19 0.00 -0.71 0.00 0.00 39.64 38.17 2ptq n ILE 26 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 2ptq n PHE 27 N -3.45 0.00 -1.27 1.39 3.72 -0.49 -3.82 117.46 113.54 2ptq n PHE 27 Ca 0.00 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.10 2ptq n PHE 27 Cb 0.04 -0.12 0.21 0.00 -0.94 0.00 0.00 39.48 38.67 2ptq n PHE 27 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2ptq s SER 28 N -2.73 1.81 0.33 4.37 1.04 -1.25 -4.74 113.70 112.52 2ptq s SER 28 Ca 0.17 0.71 0.06 0.00 0.48 0.00 0.00 55.95 57.36 2ptq s SER 28 Cb 0.18 -1.03 0.57 0.00 0.10 0.00 0.00 66.02 65.84 2ptq s SER 28 CO 0.64 -3.58 1.80 -0.08 0.98 0.00 0.00 173.24 173.00 2ptq h GLU 29 N -2.21 0.36 -0.33 4.02 4.81 -1.92 -0.77 114.58 118.53 2ptq h GLU 29 Ca -0.47 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 58.63 2ptq h GLU 29 Cb 1.30 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 2ptq h GLU 29 CO 0.42 0.55 0.14 -0.92 -0.73 0.00 0.00 179.01 178.48 2ptq h TYR 30 N 0.33 0.49 -0.60 0.92 5.03 -1.91 -0.94 116.97 120.29 2ptq h TYR 30 Ca 0.06 -0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.32 2ptq h TYR 30 Cb 0.55 -0.15 -0.03 0.00 1.55 0.00 0.00 36.73 38.65 2ptq h TYR 30 CO 0.01 0.45 0.32 0.78 -1.32 0.00 0.00 178.16 178.40 2ptq h GLY 31 N 0.39 0.90 0.97 1.82 0.00 -1.61 0.54 103.07 106.08 2ptq h GLY 31 Ca 0.11 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 47.02 2ptq h GLY 31 CO -0.01 0.40 0.19 -2.00 0.00 0.00 0.00 176.54 175.12 2ptq h LEU 32 N 0.81 0.39 -0.96 3.11 5.85 -1.00 -1.55 115.31 121.96 2ptq h LEU 32 Ca 0.21 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.80 2ptq h LEU 32 Cb 0.07 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2ptq h LEU 32 CO -0.03 0.34 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.30 2ptq h LEU 33 N 0.41 0.69 -0.07 2.25 3.38 -0.90 -1.30 115.31 119.77 2ptq h LEU 33 Ca 0.12 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2ptq h LEU 33 Cb 0.02 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 2ptq h LEU 33 CO -0.02 0.78 0.04 0.50 0.09 0.00 0.00 178.44 179.83 2ptq h LYS 34 N 0.67 0.11 -0.33 1.13 3.64 -0.50 -1.55 116.57 119.74 2ptq h LYS 34 Ca 0.13 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.42 2ptq h LYS 34 Cb 0.47 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 2ptq h LYS 34 CO 0.02 0.17 -0.12 0.74 -2.27 0.00 0.00 179.45 177.99 2ptq h PHE 35 N 0.02 0.62 -0.58 1.91 -1.00 -1.16 -1.82 116.94 114.93 2ptq h PHE 35 Ca 0.03 -0.10 -0.04 0.00 2.81 0.00 0.00 57.97 60.66 2ptq h PHE 35 Cb 0.09 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 39.46 2ptq h PHE 35 CO -0.04 0.68 0.20 0.00 -1.61 0.00 0.00 178.31 177.54 2ptq h ARG 36 N 0.53 0.88 -0.76 1.51 3.08 -1.03 -0.90 114.38 117.69 2ptq h ARG 36 Ca 0.09 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 2ptq h ARG 36 Cb 0.52 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.41 2ptq h ARG 36 CO 0.03 0.78 0.39 0.28 -1.07 0.00 0.00 179.97 180.38 2ptq h VAL 37 N 0.81 1.24 -0.06 2.04 2.07 -0.98 -0.83 116.25 120.53 2ptq h VAL 37 Ca 0.19 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 67.09 2ptq h VAL 37 Cb 0.25 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2ptq h VAL 37 CO -0.01 0.27 0.01 -0.61 0.02 0.00 0.00 177.57 177.26 2ptq h GLN 38 N 1.06 0.04 -0.35 1.57 4.15 -0.80 -1.47 115.11 119.31 2ptq h GLN 38 Ca 0.27 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.68 2ptq h GLN 38 Cb 0.08 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.74 2ptq h GLN 38 CO -0.04 0.03 0.20 0.28 -1.93 0.00 0.00 178.83 177.37 2ptq h VAL 39 N 0.04 1.13 -0.22 2.39 2.07 -0.89 -1.16 116.25 119.62 2ptq h VAL 39 Ca 0.03 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.25 2ptq h VAL 39 Cb 0.02 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 2ptq h VAL 39 CO -0.03 0.13 0.07 -0.33 0.02 0.00 0.00 177.57 177.43 2ptq h GLU 40 N 0.45 0.17 -0.50 1.57 4.39 -1.03 -1.04 114.58 118.59 2ptq h GLU 40 Ca 0.13 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 2ptq h GLU 40 Cb 0.03 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 2ptq h GLU 40 CO -0.02 0.11 0.28 0.28 -1.16 0.00 0.00 179.01 178.50 2ptq h VAL 41 N 0.17 1.17 -0.46 3.13 2.07 -1.14 -1.87 116.25 119.33 2ptq h VAL 41 Ca 0.09 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 2ptq h VAL 41 Cb 0.06 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 2ptq h VAL 41 CO -0.10 0.18 0.16 0.03 0.02 0.00 0.00 177.57 177.86 2ptq h ARG 42 N 0.67 0.66 -0.40 1.57 2.47 -0.91 -1.44 114.38 116.98 2ptq h ARG 42 Ca 0.18 -0.10 -0.06 0.00 -1.26 0.00 0.00 59.98 58.74 2ptq h ARG 42 Cb 0.03 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.22 2ptq h ARG 42 CO -0.03 0.56 0.03 2.35 0.56 0.00 0.00 179.97 183.44 2ptq h TRP 43 N 0.65 0.75 -0.57 3.04 2.91 -0.79 -1.44 115.95 120.50 2ptq h TRP 43 Ca 0.16 -0.12 -0.06 0.00 1.13 0.00 0.00 58.89 59.99 2ptq h TRP 43 Cb 0.16 -0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 28.59 2ptq h TRP 43 CO 0.01 0.76 0.11 1.25 -1.03 0.00 0.00 178.44 179.53 2ptq h LEU 44 N 0.53 0.85 -0.78 0.65 5.85 -0.88 -2.04 115.31 119.49 2ptq h LEU 44 Ca 0.12 -0.17 -0.12 0.00 0.84 0.00 0.00 57.88 58.55 2ptq h LEU 44 Cb 0.44 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2ptq h LEU 44 CO 0.02 0.85 -0.34 1.56 -0.34 0.00 0.00 178.44 180.18 2ptq h GLN 45 N 0.86 0.53 -0.31 1.25 4.20 -1.07 -1.56 115.11 119.00 2ptq h GLN 45 Ca 0.18 -0.24 -0.15 0.00 0.06 0.00 0.00 58.65 58.51 2ptq h GLN 45 Cb 0.35 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 2ptq h GLN 45 CO 0.00 0.80 -0.39 -0.22 -0.67 0.00 0.00 178.83 178.35 2ptq h LYS 46 N 0.45 0.75 -0.54 1.46 3.64 -0.93 -0.06 116.57 121.34 2ptq h LYS 46 Ca 0.05 -0.39 -0.03 0.00 -1.27 0.00 0.00 60.65 59.01 2ptq h LYS 46 Cb 0.81 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.61 2ptq h LYS 46 CO 0.07 1.01 0.22 -0.07 -2.27 0.00 0.00 179.45 178.41 2ptq h LEU 47 N 0.62 0.73 -0.39 5.20 3.38 -1.17 0.02 115.31 123.70 2ptq h LEU 47 Ca 0.05 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 2ptq h LEU 47 Cb 0.94 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2ptq h LEU 47 CO 0.09 0.69 0.11 0.00 0.09 0.00 0.00 178.44 179.42 2ptq h ALA 48 N 1.07 0.51 0.00 1.53 0.00 -1.10 -2.72 119.26 118.54 2ptq h ALA 48 Ca 0.18 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ptq h ALA 48 Cb 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2ptq h ALA 48 CO -0.02 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.40 2ptq h ALA 49 N 0.95 1.00 -1.80 0.00 0.00 -0.75 -3.11 119.26 115.55 2ptq h ALA 49 Ca 0.12 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.47 2ptq h ALA 49 Cb 0.29 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 2ptq h ALA 49 CO -0.00 0.00 0.95 -1.58 0.00 0.00 0.00 179.25 178.62 2ptq s HIS 50 N -3.48 2.78 0.23 0.00 5.04 -0.03 -4.92 115.29 114.91 2ptq s HIS 50 Ca 0.03 0.81 -0.07 0.00 -1.54 0.00 0.00 55.06 54.29 2ptq s HIS 50 Cb 0.09 -4.22 0.30 0.00 0.04 0.00 0.00 32.58 28.79 2ptq s HIS 50 CO 0.49 -1.37 1.84 0.00 -2.34 0.00 0.00 174.74 173.36 2ptq h ALA 51 N 9.32 1.08 0.00 1.58 0.00 -1.85 -2.39 119.26 127.00 2ptq h ALA 51 Ca -0.24 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2ptq h ALA 51 Cb 1.07 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2ptq h ALA 51 CO 1.09 0.21 0.00 0.00 0.00 0.00 0.00 179.25 180.55 2ptq h ALA 52 N 1.38 1.00 -2.46 0.00 0.00 -1.94 -3.28 119.26 113.96 2ptq h ALA 52 Ca 0.35 0.00 -0.79 0.00 0.00 0.00 0.00 54.91 54.47 2ptq h ALA 52 Cb 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 17.79 17.69 2ptq h ALA 52 CO -0.17 0.00 0.55 0.42 0.00 0.00 0.00 179.25 180.05 2ptq s ILE 53 N -4.10 5.88 0.45 0.00 1.01 -0.90 -4.86 121.20 118.68 2ptq s ILE 53 Ca -0.04 -3.30 0.17 0.00 0.00 0.00 0.00 60.65 57.47 2ptq s ILE 53 Cb 0.13 -4.64 0.20 0.00 0.01 0.00 0.00 42.46 38.16 2ptq s ILE 53 CO 0.41 -1.24 2.01 0.07 0.00 0.00 0.00 174.94 176.20 2ptq h LYS 54 N 6.76 0.00 0.00 2.79 5.09 -1.80 -2.64 116.57 126.76 2ptq h LYS 54 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.93 2ptq h LYS 54 Cb 0.88 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.21 2ptq h LYS 54 CO 1.04 0.17 0.00 0.39 -2.09 0.00 0.00 179.45 178.96 2ptq n GLU 55 N -4.19 0.05 -3.70 0.07 4.71 -1.26 -3.40 120.64 112.93 2ptq n GLU 55 Ca -0.02 0.47 -0.28 0.00 -0.01 0.00 0.00 57.16 57.31 2ptq n GLU 55 Cb 0.24 -1.65 -0.12 0.00 -1.01 0.00 0.00 31.44 28.91 2ptq n GLU 55 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2ptq s VAL 56 N -3.16 1.75 0.72 2.62 1.01 -0.99 -4.93 120.40 117.41 2ptq s VAL 56 Ca 0.01 -3.37 -0.16 0.00 0.00 0.00 0.00 61.98 58.47 2ptq s VAL 56 Cb 0.05 -2.18 0.03 0.00 0.00 0.00 0.00 36.38 34.28 2ptq s VAL 56 CO 0.15 -1.05 1.23 -2.16 0.00 0.00 0.00 175.10 173.26 2ptq s PRO 57 N -0.56 2.19 0.33 2.72 0.04 -1.22 -4.11 135.00 134.40 2ptq s PRO 57 Ca 0.26 1.84 -0.27 0.00 0.04 0.00 0.00 61.00 62.86 2ptq s PRO 57 Cb -0.07 -1.83 -0.13 0.00 0.04 0.00 0.00 34.50 32.52 2ptq s PRO 57 CO -0.14 -1.81 1.06 0.00 0.04 0.00 0.00 177.00 176.15 2ptq n ALA 58 N -2.57 0.17 -1.94 8.56 0.00 -1.17 -4.76 120.51 118.80 2ptq n ALA 58 Ca 0.14 0.34 -0.34 0.00 0.00 0.00 0.00 53.44 53.58 2ptq n ALA 58 Cb 0.50 -2.08 -0.07 0.00 0.00 0.00 0.00 19.45 17.80 2ptq n ALA 58 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2ptq s PHE 59 N -1.12 3.45 0.79 0.00 0.08 -1.26 -5.04 117.98 114.88 2ptq s PHE 59 Ca 0.59 1.51 -0.11 0.00 0.12 0.00 0.00 56.93 59.03 2ptq s PHE 59 Cb -0.64 -2.75 0.07 0.00 -0.57 0.00 0.00 43.02 39.13 2ptq s PHE 59 CO 0.60 0.07 1.09 0.00 -0.10 0.00 0.00 175.22 176.88 2ptq s ALA 60 N -1.92 2.23 0.22 5.36 0.00 -1.26 -4.82 121.76 121.57 2ptq s ALA 60 Ca 0.55 -0.11 -0.08 0.00 0.00 0.00 0.00 51.96 52.32 2ptq s ALA 60 Cb -0.12 -3.14 0.33 0.00 0.00 0.00 0.00 23.12 20.19 2ptq s ALA 60 CO 0.17 -1.72 1.75 0.00 0.00 0.00 0.00 175.76 175.96 2ptq h ALA 61 N -1.09 0.89 0.00 0.00 0.00 -2.00 -1.88 119.26 115.19 2ptq h ALA 61 Ca -0.47 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.46 2ptq h ALA 61 Cb 1.26 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2ptq h ALA 61 CO 0.58 -0.16 -0.34 -0.44 0.00 0.00 0.00 179.25 178.88 2ptq h ASP 62 N 0.46 0.00 -0.14 0.00 5.19 -1.99 -1.66 116.42 118.28 2ptq h ASP 62 Ca 0.34 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.60 2ptq h ASP 62 Cb 0.43 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.95 2ptq h ASP 62 CO -0.32 0.34 -0.50 0.00 -3.12 0.00 0.00 179.24 175.65 2ptq h ALA 63 N 1.66 0.25 -0.51 3.45 0.00 -1.72 -1.22 119.26 121.17 2ptq h ALA 63 Ca -0.00 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 2ptq h ALA 63 Cb 0.68 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2ptq h ALA 63 CO 0.04 0.43 0.18 0.82 0.00 0.00 0.00 179.25 180.72 2ptq h ILE 64 N 0.23 1.20 -0.42 0.00 2.04 -1.24 -1.05 117.51 118.26 2ptq h ILE 64 Ca -0.02 -0.64 -0.14 0.00 1.00 0.00 0.00 64.86 65.05 2ptq h ILE 64 Cb 1.13 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2ptq h ILE 64 CO 0.11 0.25 -0.29 1.23 0.00 0.00 0.00 178.15 179.44 2ptq h GLY 65 N 0.89 0.99 1.01 5.37 0.00 -1.18 -0.35 103.07 109.81 2ptq h GLY 65 Ca 0.17 -0.93 -0.04 0.00 0.00 0.00 0.00 47.33 46.53 2ptq h GLY 65 CO -0.01 0.84 0.27 -1.82 0.00 0.00 0.00 176.54 175.82 2ptq h TYR 66 N 0.77 1.00 -0.22 5.60 3.20 -0.58 -0.95 116.97 125.80 2ptq h TYR 66 Ca 0.09 -0.07 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 2ptq h TYR 66 Cb 0.86 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 2ptq h TYR 66 CO 0.05 0.78 -0.03 -0.07 -1.64 0.00 0.00 178.16 177.26 2ptq h LEU 67 N 0.93 0.40 -1.48 2.82 3.38 -1.04 -2.43 115.31 117.90 2ptq h LEU 67 Ca 0.22 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2ptq h LEU 67 Cb 0.20 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2ptq h LEU 67 CO -0.02 0.65 0.31 0.44 0.09 0.00 0.00 178.44 179.91 2ptq h ASP 68 N 0.15 0.58 -0.31 -0.43 3.32 -0.87 -1.65 116.42 117.21 2ptq h ASP 68 Ca 0.06 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.00 2ptq h ASP 68 Cb 0.46 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 2ptq h ASP 68 CO 0.02 0.43 -0.12 0.00 -1.72 0.00 0.00 179.24 177.86 2ptq h ALA 69 N 1.67 1.03 -0.92 3.45 0.00 -0.99 -0.15 119.26 123.35 2ptq h ALA 69 Ca 0.18 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.81 2ptq h ALA 69 Cb -0.05 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 2ptq h ALA 69 CO -0.04 0.59 0.60 0.82 0.00 0.00 0.00 179.25 181.22 2ptq h ILE 70 N 0.66 1.18 0.36 0.00 2.04 -0.81 0.15 117.51 121.08 2ptq h ILE 70 Ca 0.11 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 2ptq h ILE 70 Cb 0.58 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 2ptq h ILE 70 CO 0.04 0.22 -0.17 0.58 0.00 0.00 0.00 178.15 178.81 2ptq h VAL 71 N 1.18 0.42 -0.52 1.67 2.07 -1.14 -2.91 116.25 117.02 2ptq h VAL 71 Ca 0.36 -0.70 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 2ptq h VAL 71 Cb -0.04 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 2ptq h VAL 71 CO -0.11 0.09 0.17 0.00 0.02 0.00 0.00 177.57 177.74 2ptq h ALA 72 N -0.67 1.31 -0.01 1.67 0.00 -0.95 -3.08 119.26 117.53 2ptq h ALA 72 Ca -0.05 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2ptq h ALA 72 Cb 0.52 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2ptq h ALA 72 CO 0.08 0.50 -0.37 -1.13 0.00 0.00 0.00 179.25 178.33 2ptq n SER 73 N -4.31 0.95 -3.59 0.00 3.41 0.50 -4.96 113.62 105.61 2ptq n SER 73 Ca 0.04 -0.76 -0.51 0.00 -0.26 0.00 0.00 58.87 57.38 2ptq n SER 73 Cb 0.19 0.22 -0.08 0.00 -0.26 0.00 0.00 64.21 64.28 2ptq n SER 73 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2ptq n PHE 74 N -0.87 1.29 -4.49 7.33 7.35 -1.10 -4.92 117.46 122.06 2ptq n PHE 74 Ca 0.10 0.85 -0.30 0.00 -0.76 0.00 0.00 57.45 57.33 2ptq n PHE 74 Cb 0.35 -1.71 -0.06 0.00 0.35 0.00 0.00 39.48 38.41 2ptq n PHE 74 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 2ptq s SER 75 N 2.56 4.24 0.36 -2.13 1.04 -1.26 -4.99 113.70 113.52 2ptq s SER 75 Ca 0.82 -1.48 0.08 0.00 0.48 0.00 0.00 55.95 55.85 2ptq s SER 75 Cb -1.15 0.30 0.68 0.00 0.10 0.00 0.00 66.02 65.95 2ptq s SER 75 CO 0.61 -0.83 1.85 -0.33 0.98 0.00 0.00 173.24 175.53 2ptq h GLU 76 N 1.27 0.26 -0.70 4.02 5.08 -1.98 -0.47 114.58 122.05 2ptq h GLU 76 Ca -0.42 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 57.82 2ptq h GLU 76 Cb 1.30 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 2ptq h GLU 76 CO 0.71 0.45 0.26 1.49 -1.00 0.00 0.00 179.01 180.93 2ptq h GLU 77 N 0.24 1.06 -0.29 2.33 4.81 -1.98 0.35 114.58 121.11 2ptq h GLU 77 Ca 0.04 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 59.05 2ptq h GLU 77 Cb 0.49 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2ptq h GLU 77 CO 0.03 0.89 0.12 -0.44 -0.73 0.00 0.00 179.01 178.88 2ptq h ASP 78 N 1.01 0.40 -0.77 1.04 3.45 -1.68 -1.49 116.42 118.37 2ptq h ASP 78 Ca 0.23 -0.16 -0.03 0.00 0.43 0.00 0.00 57.03 57.51 2ptq h ASP 78 Cb 0.24 -0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 38.87 2ptq h ASP 78 CO -0.02 0.45 0.38 0.00 -1.57 0.00 0.00 179.24 178.48 2ptq h ALA 79 N 0.97 1.19 -0.59 3.45 0.00 -0.68 -2.08 119.26 121.51 2ptq h ALA 79 Ca 0.10 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2ptq h ALA 79 Cb 0.17 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2ptq h ALA 79 CO -0.01 0.62 0.22 0.00 0.00 0.00 0.00 179.25 180.08 2ptq h ALA 80 N 1.30 1.26 -0.51 0.00 0.00 0.06 -1.72 119.26 119.66 2ptq h ALA 80 Ca 0.27 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2ptq h ALA 80 Cb 0.10 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2ptq h ALA 80 CO -0.04 0.53 0.09 -0.09 0.00 0.00 0.00 179.25 179.75 2ptq h ARG 81 N 0.86 0.83 -0.63 0.00 9.65 -0.63 -1.04 114.38 123.42 2ptq h ARG 81 Ca 0.20 -0.22 0.01 0.00 -1.10 0.00 0.00 59.98 58.87 2ptq h ARG 81 Cb 0.20 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.65 2ptq h ARG 81 CO -0.01 0.82 0.41 0.82 2.80 0.00 0.00 179.97 184.81 2ptq h ILE 82 N 0.71 1.15 -0.09 1.20 2.04 -0.96 -0.75 117.51 120.81 2ptq h ILE 82 Ca 0.15 -0.29 -0.06 0.00 1.00 0.00 0.00 64.86 65.67 2ptq h ILE 82 Cb 0.39 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2ptq h ILE 82 CO 0.01 0.15 -0.21 0.11 0.00 0.00 0.00 178.15 178.21 2ptq h LYS 83 N 0.84 0.14 -0.41 2.37 1.57 -1.05 0.23 116.57 120.27 2ptq h LYS 83 Ca 0.23 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.89 2ptq h LYS 83 Cb -0.08 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2ptq h LYS 83 CO -0.06 0.35 -0.09 1.15 -0.57 0.00 0.00 179.45 180.23 2ptq h THR 84 N 0.14 1.27 -0.49 -0.16 2.02 -0.21 -2.50 112.91 112.97 2ptq h THR 84 Ca 0.02 -1.18 -0.10 0.00 0.77 0.00 0.00 66.41 65.92 2ptq h THR 84 Cb 0.45 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 2ptq h THR 84 CO 0.03 0.40 -0.10 0.40 0.37 0.00 0.00 175.52 176.62 2ptq h ILE 85 N 0.61 1.26 -0.02 3.11 2.04 -0.48 -2.47 117.51 121.57 2ptq h ILE 85 Ca 0.11 -1.22 0.01 0.00 1.00 0.00 0.00 64.86 64.75 2ptq h ILE 85 Cb 0.62 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2ptq h ILE 85 CO 0.04 0.42 0.03 -0.08 0.00 0.00 0.00 178.15 178.57 2ptq h GLU 86 N 0.82 0.00 -0.47 2.37 4.81 -0.24 0.25 114.58 122.12 2ptq h GLU 86 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2ptq h GLU 86 Cb 0.63 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 2ptq h GLU 86 CO 0.04 0.00 0.31 0.00 -0.73 0.00 0.00 179.01 178.63 2ptq h ARG 87 N 0.00 0.61 0.00 1.92 2.47 -1.01 0.61 114.38 118.99 2ptq h ARG 87 Ca 0.01 -0.04 -0.07 0.00 -1.26 0.00 0.00 59.98 58.62 2ptq h ARG 87 Cb 0.07 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.24 2ptq h ARG 87 CO -0.00 0.41 -0.41 1.15 0.56 0.00 0.00 179.97 181.68 2ptq h THR 88 N 0.63 1.43 -0.00 2.04 2.02 -1.09 -3.39 112.91 114.55 2ptq h THR 88 Ca 0.17 -2.23 -0.17 0.00 0.77 0.00 0.00 66.41 64.95 2ptq h THR 88 Cb -0.07 2.85 -0.02 0.00 -1.74 0.00 0.00 68.15 69.17 2ptq h THR 88 CO -0.04 0.48 -0.80 0.71 0.37 0.00 0.00 175.52 176.24 2ptq h THR 89 N -1.00 1.54 -4.59 3.16 1.35 -1.35 -3.47 112.91 108.55 2ptq h THR 89 Ca -0.11 -2.64 -0.39 0.00 -0.55 0.00 0.00 66.41 62.71 2ptq h THR 89 Cb 1.06 2.44 0.01 0.00 -1.73 0.00 0.00 68.15 69.93 2ptq h THR 89 CO -0.07 0.76 -0.57 -3.20 -0.25 0.00 0.00 175.52 172.19 2ptq n ASN 90 N -3.63 -5.32 -3.34 5.36 5.15 0.21 -4.93 115.26 108.76 2ptq n ASN 90 Ca -0.02 -0.26 -0.09 0.00 -0.60 0.00 0.00 54.58 53.62 2ptq n ASN 90 Cb 0.77 -4.34 -0.07 0.00 -0.53 0.00 0.00 39.78 35.60 2ptq n ASN 90 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 2ptq s HIS 91 N -3.07 -0.88 0.12 1.20 2.46 -1.26 -5.08 115.29 108.78 2ptq s HIS 91 Ca 0.29 0.81 -0.20 0.00 0.47 0.00 0.00 55.06 56.43 2ptq s HIS 91 Cb -0.14 0.02 -0.07 0.00 -0.13 0.00 0.00 32.58 32.26 2ptq s HIS 91 CO 0.36 -0.76 1.76 0.38 -2.47 0.00 0.00 174.74 174.01 2ptq h ASP 92 N 8.17 0.22 -0.09 9.88 3.04 -1.91 -2.55 116.42 133.19 2ptq h ASP 92 Ca -0.18 -0.02 -0.09 0.00 -3.24 0.00 0.00 57.03 53.49 2ptq h ASP 92 Cb 1.15 -0.06 -0.01 0.00 -1.04 0.00 0.00 39.33 39.37 2ptq h ASP 92 CO 0.27 0.18 -0.22 0.58 -2.04 0.00 0.00 179.24 178.01 2ptq h VAL 93 N 0.25 1.26 -0.43 4.15 2.07 -1.98 -1.92 116.25 119.65 2ptq h VAL 93 Ca 0.07 -1.22 -0.06 0.00 0.82 0.00 0.00 66.70 66.31 2ptq h VAL 93 Cb -0.01 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 2ptq h VAL 93 CO -0.01 0.39 0.00 0.50 0.02 0.00 0.00 177.57 178.47 2ptq h LYS 94 N 0.45 0.69 -0.29 1.57 1.63 -1.98 -1.23 116.57 117.41 2ptq h LYS 94 Ca 0.07 -0.17 -0.05 0.00 -0.85 0.00 0.00 60.65 59.65 2ptq h LYS 94 Cb 0.63 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.16 2ptq h LYS 94 CO 0.05 0.70 -0.02 0.00 -3.45 0.00 0.00 179.45 176.72 2ptq h ALA 95 N 1.36 1.42 -0.40 5.00 0.00 -0.96 0.11 119.26 125.79 2ptq h ALA 95 Ca 0.13 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2ptq h ALA 95 Cb 0.40 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2ptq h ALA 95 CO 0.01 0.41 -0.14 0.28 0.00 0.00 0.00 179.25 179.81 2ptq h VAL 96 N 0.43 1.28 0.02 0.00 2.07 -0.59 -0.04 116.25 119.44 2ptq h VAL 96 Ca 0.09 -1.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.35 2ptq h VAL 96 Cb 0.33 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2ptq h VAL 96 CO 0.01 0.42 -0.01 -0.08 0.02 0.00 0.00 177.57 177.93 2ptq h GLU 97 N 0.62 -0.03 -0.40 1.57 4.81 -0.42 -1.14 114.58 119.58 2ptq h GLU 97 Ca 0.10 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 2ptq h GLU 97 Cb 0.68 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.05 2ptq h GLU 97 CO 0.05 -0.00 0.09 1.88 -0.73 0.00 0.00 179.01 180.30 2ptq h TYR 98 N -0.05 0.60 -0.50 0.92 0.05 -0.93 -0.97 116.97 116.09 2ptq h TYR 98 Ca -0.00 -0.04 -0.04 0.00 0.05 0.00 0.00 58.73 58.69 2ptq h TYR 98 Cb 0.04 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 37.58 2ptq h TYR 98 CO -0.07 0.52 0.14 0.35 -1.05 0.00 0.00 178.16 178.06 2ptq h PHE 99 N 0.58 0.81 -0.40 4.88 3.04 -0.61 -1.38 116.94 123.85 2ptq h PHE 99 Ca 0.13 -0.09 -0.11 0.00 3.98 0.00 0.00 57.97 61.89 2ptq h PHE 99 Cb 0.23 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.49 2ptq h PHE 99 CO 0.01 0.72 -0.18 -0.07 -2.02 0.00 0.00 178.31 176.76 2ptq h LEU 100 N 0.68 0.77 -1.15 0.59 3.38 -0.73 -1.41 115.31 117.44 2ptq h LEU 100 Ca 0.16 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 2ptq h LEU 100 Cb 0.29 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2ptq h LEU 100 CO -0.00 0.95 0.00 0.11 0.09 0.00 0.00 178.44 179.59 2ptq h LYS 101 N 0.68 0.59 -0.38 1.13 1.57 -0.96 -2.07 116.57 117.13 2ptq h LYS 101 Ca 0.10 -0.13 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2ptq h LYS 101 Cb 0.68 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 2ptq h LYS 101 CO 0.05 0.61 -0.15 0.93 -0.57 0.00 0.00 179.45 180.33 2ptq h GLU 102 N 0.57 0.78 -0.74 3.15 5.08 -0.81 -2.77 114.58 119.83 2ptq h GLU 102 Ca 0.12 -0.32 -0.03 0.00 -1.00 0.00 0.00 59.36 58.12 2ptq h GLU 102 Cb 0.36 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 2ptq h GLU 102 CO 0.01 0.94 0.33 0.87 -1.00 0.00 0.00 179.01 180.16 2ptq h LYS 103 N 0.58 1.06 -0.00 2.33 1.79 -0.82 -3.03 116.57 118.48 2ptq h LYS 103 Ca 0.09 -0.16 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 2ptq h LYS 103 Cb 0.68 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 2ptq h LYS 103 CO 0.05 0.84 -0.34 1.33 -1.08 0.00 0.00 179.45 180.24 2ptq n VAL 104 N -4.31 0.00 -0.05 0.50 0.24 -0.82 -4.25 118.33 109.64 2ptq n VAL 104 Ca 0.07 -0.02 0.21 0.00 -2.04 0.00 0.00 64.34 62.56 2ptq n VAL 104 Cb 0.15 0.09 0.67 0.00 -1.47 0.00 0.00 33.84 33.28 2ptq n VAL 104 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ptq h ALA 105 N 3.13 2.50 -0.00 2.33 0.00 -1.36 -0.26 119.26 125.60 2ptq h ALA 105 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2ptq h ALA 105 Cb 0.49 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2ptq h ALA 105 CO 0.00 -0.68 -0.13 -0.85 0.00 0.00 0.00 179.25 177.59 2ptq n GLU 106 N -4.38 0.08 -3.65 0.00 0.28 -1.26 -4.57 120.64 107.15 2ptq n GLU 106 Ca 0.12 -0.02 -0.39 0.00 -0.16 0.00 0.00 57.16 56.71 2ptq n GLU 106 Cb 0.65 -1.50 -0.10 0.00 1.43 0.00 0.00 31.44 31.93 2ptq n GLU 106 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2ptq s ILE 107 N -2.93 3.85 0.26 3.84 -1.09 -0.12 -4.99 121.20 120.02 2ptq s ILE 107 Ca 0.15 -1.80 -0.11 0.00 -2.23 0.00 0.00 60.65 56.66 2ptq s ILE 107 Cb 0.19 -3.53 0.39 0.00 -1.58 0.00 0.00 42.46 37.92 2ptq s ILE 107 CO 0.56 -0.68 1.56 1.55 -1.23 0.00 0.00 174.94 176.70 2ptq h PRO 108 N 8.29 -0.00 -0.92 2.79 0.13 -1.80 0.49 132.00 140.97 2ptq h PRO 108 Ca -0.19 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.00 2ptq h PRO 108 Cb 1.07 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.13 2ptq h PRO 108 CO 0.78 -0.00 0.59 1.49 -0.23 0.00 0.00 178.00 180.62 2ptq h GLU 109 N -0.00 1.05 0.08 0.86 4.81 -1.94 0.24 114.58 119.68 2ptq h GLU 109 Ca 0.43 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.48 2ptq h GLU 109 Cb 0.68 -0.24 0.01 0.00 0.63 0.00 0.00 28.75 29.84 2ptq h GLU 109 CO -1.01 0.69 -0.52 -0.07 -0.73 0.00 0.00 179.01 177.37 2ptq h LEU 110 N 1.08 0.32 -1.76 1.64 3.38 -1.09 -3.25 115.31 115.62 2ptq h LEU 110 Ca 0.39 -0.94 0.13 0.00 0.09 0.00 0.00 57.88 57.55 2ptq h LEU 110 Cb 0.14 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 2ptq h LEU 110 CO -0.16 1.23 0.41 -0.74 0.09 0.00 0.00 178.44 179.27 2ptq h HIS 111 N -0.54 0.28 -0.51 1.13 2.76 0.00 -0.22 115.15 118.05 2ptq h HIS 111 Ca -0.09 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.11 2ptq h HIS 111 Cb 1.39 -0.09 -0.03 0.00 1.55 0.00 0.00 27.41 30.23 2ptq h HIS 111 CO 0.22 0.12 0.34 0.00 -1.30 0.00 0.00 177.93 177.31 2ptq h ALA 112 N 1.71 1.72 -0.36 5.26 0.00 -0.98 -2.03 119.26 124.57 2ptq h ALA 112 Ca 0.28 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 2ptq h ALA 112 Cb 0.76 -0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.29 2ptq h ALA 112 CO -0.06 0.24 -0.03 1.33 0.00 0.00 0.00 179.25 180.73 2ptq n VAL 113 N -4.47 2.52 -0.35 0.00 0.24 -0.15 -4.75 118.33 111.37 2ptq n VAL 113 Ca 0.05 -2.52 0.10 0.00 -2.04 0.00 0.00 64.34 59.94 2ptq n VAL 113 Cb 0.11 -0.31 0.28 0.00 -1.47 0.00 0.00 33.84 32.45 2ptq n VAL 113 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 2ptq h SER 114 N 1.16 0.82 0.00 -1.34 0.87 -0.76 -0.40 113.55 113.90 2ptq h SER 114 Ca 0.19 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.83 2ptq h SER 114 Cb 1.67 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.55 2ptq h SER 114 CO 0.38 0.35 0.00 -0.62 -0.53 0.00 0.00 176.83 176.42 2ptq n GLU 115 N -4.72 0.81 0.00 2.24 -0.58 -1.26 -2.30 120.64 114.83 2ptq n GLU 115 Ca 0.21 0.00 0.10 0.00 -0.42 0.00 0.00 57.16 57.05 2ptq n GLU 115 Cb 0.47 -1.08 0.06 0.00 -0.57 0.00 0.00 31.44 30.32 2ptq n GLU 115 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 2ptq n PHE 116 N -0.58 0.00 -2.39 -0.32 3.72 -0.16 -4.65 117.46 113.09 2ptq n PHE 116 Ca 0.03 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 2ptq n PHE 116 Cb 0.01 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.53 2ptq n PHE 116 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2ptq s ILE 117 N -1.95 4.15 -0.15 4.37 1.01 -0.97 -1.97 121.20 125.68 2ptq s ILE 117 Ca 0.22 1.46 0.00 0.00 0.00 0.00 0.00 60.65 62.32 2ptq s ILE 117 Cb 0.17 -3.94 0.00 0.00 0.01 0.00 0.00 42.46 38.70 2ptq s ILE 117 CO 0.35 -0.05 0.00 1.57 0.00 0.00 0.00 174.94 176.82 2ptq n HIS 118 N 5.75 0.00 -1.68 3.97 -0.00 -1.26 -4.94 115.22 117.06 2ptq n HIS 118 Ca 0.12 0.00 -0.56 0.00 -0.00 0.00 0.00 57.72 57.28 2ptq n HIS 118 Cb 0.45 -0.68 -0.07 0.00 -0.00 0.00 0.00 29.99 29.69 2ptq n HIS 118 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2ptq n PHE 119 N -2.80 2.03 -0.72 1.57 7.35 -0.83 -1.01 117.46 123.05 2ptq n PHE 119 Ca -0.01 0.47 0.00 0.00 -0.76 0.00 0.00 57.45 57.14 2ptq n PHE 119 Cb 0.13 -2.48 0.00 0.00 0.35 0.00 0.00 39.48 37.47 2ptq n PHE 119 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2ptq n ALA 120 N 5.94 0.00 -1.97 3.13 0.00 -1.26 -4.97 120.51 121.37 2ptq n ALA 120 Ca 0.28 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.41 2ptq n ALA 120 Cb 0.15 -0.82 -0.03 0.00 0.00 0.00 0.00 19.45 18.74 2ptq n ALA 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ptq s THR 122 N -2.55 3.08 0.28 0.00 -1.32 -1.26 -4.83 115.64 109.04 2ptq s THR 122 Ca 0.56 -1.59 0.01 0.00 -1.21 0.00 0.00 61.69 59.46 2ptq s THR 122 Cb -0.10 -2.49 0.27 0.00 -1.51 0.00 0.00 72.50 68.67 2ptq s THR 122 CO 0.32 -0.03 1.71 0.28 -2.21 0.00 0.00 174.62 174.69 2ptq h SER 123 N 3.22 0.33 0.19 8.08 0.02 -1.96 -0.32 113.55 123.10 2ptq h SER 123 Ca -0.48 0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.60 2ptq h SER 123 Cb 1.19 0.11 -0.00 0.00 0.14 0.00 0.00 62.40 63.84 2ptq h SER 123 CO 0.52 0.05 -0.04 -0.33 -1.14 0.00 0.00 176.83 175.89 2ptq h GLU 124 N 0.44 0.00 -0.56 3.45 4.39 -1.96 0.45 114.58 120.79 2ptq h GLU 124 Ca 0.51 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 60.15 2ptq h GLU 124 Cb 0.90 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.52 2ptq h GLU 124 CO -0.48 0.04 0.11 -0.44 -1.16 0.00 0.00 179.01 177.08 2ptq h ASP 125 N 0.00 0.82 0.06 1.42 3.32 -1.31 -0.43 116.42 120.29 2ptq h ASP 125 Ca -0.00 -0.16 -0.13 0.00 0.02 0.00 0.00 57.03 56.76 2ptq h ASP 125 Cb 0.14 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.49 2ptq h ASP 125 CO 0.00 0.81 -0.54 0.40 -1.72 0.00 0.00 179.24 178.20 2ptq h ILE 126 N 0.83 1.54 0.18 0.35 1.08 -1.17 -3.28 117.51 117.03 2ptq h ILE 126 Ca 0.18 -2.28 -0.01 0.00 -0.39 0.00 0.00 64.86 62.36 2ptq h ILE 126 Cb 0.33 2.99 0.00 0.00 -3.07 0.00 0.00 36.82 37.08 2ptq h ILE 126 CO 0.00 0.64 -0.09 0.78 -0.69 0.00 0.00 178.15 178.79 2ptq h ASN 127 N -0.42 -0.21 -0.74 1.72 2.35 -0.81 -1.72 115.58 115.76 2ptq h ASN 127 Ca -0.08 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 2ptq h ASN 127 Cb 1.35 0.05 -0.04 0.00 0.05 0.00 0.00 38.32 39.73 2ptq h ASN 127 CO 0.10 -0.12 0.40 -0.55 -1.65 0.00 0.00 177.43 175.61 2ptq h ASN 128 N -0.28 0.94 0.25 5.81 -1.07 -1.25 0.92 115.58 120.90 2ptq h ASN 128 Ca -0.02 -0.08 -0.11 0.00 0.07 0.00 0.00 56.30 56.15 2ptq h ASN 128 Cb 0.21 -0.24 -0.01 0.00 -2.07 0.00 0.00 38.32 36.21 2ptq h ASN 128 CO 0.04 0.77 -0.43 -0.07 0.07 0.00 0.00 177.43 177.80 2ptq h LEU 129 N 1.05 0.25 -0.32 6.14 3.38 -1.61 -0.23 115.31 123.98 2ptq h LEU 129 Ca 0.26 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 2ptq h LEU 129 Cb 0.05 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2ptq h LEU 129 CO -0.04 0.66 -0.02 0.28 0.09 0.00 0.00 178.44 179.41 2ptq h SER 130 N 0.20 0.56 -0.88 -0.43 0.02 -0.30 -1.94 113.55 110.79 2ptq h SER 130 Ca 0.02 -0.32 -0.03 0.00 -0.84 0.00 0.00 61.79 60.62 2ptq h SER 130 Cb 0.85 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 63.20 2ptq h SER 130 CO 0.07 0.75 0.45 0.45 -1.14 0.00 0.00 176.83 177.41 2ptq h HIS 131 N 0.36 1.23 -0.52 3.45 3.86 -0.50 -0.94 115.15 122.09 2ptq h HIS 131 Ca 0.09 -0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 2ptq h HIS 131 Cb 0.47 -0.39 -0.03 0.00 1.06 0.00 0.00 27.41 28.53 2ptq h HIS 131 CO 0.04 0.87 0.32 0.00 0.86 0.00 0.00 177.93 180.02 2ptq h ALA 132 N 1.25 0.67 -0.40 2.45 0.00 -0.87 -0.92 119.26 121.43 2ptq h ALA 132 Ca 0.30 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 2ptq h ALA 132 Cb 0.08 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2ptq h ALA 132 CO -0.04 0.15 -0.15 -0.07 0.00 0.00 0.00 179.25 179.13 2ptq h LEU 133 N 0.71 0.73 0.09 0.00 3.38 -0.95 0.31 115.31 119.57 2ptq h LEU 133 Ca 0.19 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2ptq h LEU 133 Cb -0.02 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.53 2ptq h LEU 133 CO -0.04 0.89 -0.04 0.24 0.09 0.00 0.00 178.44 179.58 2ptq h MET 134 N 0.66 -0.12 -0.58 1.13 2.86 -0.81 -0.92 114.93 117.15 2ptq h MET 134 Ca 0.11 0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.67 2ptq h MET 134 Cb 0.62 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.29 2ptq h MET 134 CO 0.04 0.05 0.04 -0.07 1.06 0.00 0.00 176.91 178.02 2ptq h LEU 135 N -0.27 0.95 -0.35 1.22 3.38 -1.04 0.03 115.31 119.24 2ptq h LEU 135 Ca -0.01 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.65 2ptq h LEU 135 Cb 0.22 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2ptq h LEU 135 CO 0.02 0.99 -0.02 0.50 0.09 0.00 0.00 178.44 180.02 2ptq h LYS 136 N 0.92 0.63 -0.48 1.13 3.64 -0.89 -1.22 116.57 120.29 2ptq h LYS 136 Ca 0.17 -0.21 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 2ptq h LYS 136 Cb 0.48 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 2ptq h LYS 136 CO 0.02 0.76 0.22 1.15 -2.27 0.00 0.00 179.45 179.33 2ptq h THR 137 N 0.43 1.19 -0.37 1.00 2.02 -0.99 -1.52 112.91 114.67 2ptq h THR 137 Ca 0.10 -0.57 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 2ptq h THR 137 Cb 0.49 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 2ptq h THR 137 CO 0.02 0.22 0.21 0.00 0.37 0.00 0.00 175.52 176.34 2ptq h ALA 138 N 1.06 0.47 0.48 6.16 0.00 -0.88 -0.84 119.26 125.71 2ptq h ALA 138 Ca 0.16 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2ptq h ALA 138 Cb 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2ptq h ALA 138 CO -0.02 -0.02 -0.23 -0.09 0.00 0.00 0.00 179.25 178.89 2ptq h ARG 139 N 0.48 -0.62 -0.08 0.00 2.43 -1.08 0.56 114.38 116.06 2ptq h ARG 139 Ca 0.13 0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.24 2ptq h ARG 139 Cb 0.03 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2ptq h ARG 139 CO -0.02 -0.33 -0.40 -0.44 -1.51 0.00 0.00 179.97 177.27 2ptq h ASP 140 N -0.87 0.18 0.00 -3.80 3.32 -1.30 -1.49 116.42 112.46 2ptq h ASP 140 Ca -0.07 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 56.84 2ptq h ASP 140 Cb 0.58 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 2ptq h ASP 140 CO 0.11 0.57 -1.91 -0.62 -1.72 0.00 0.00 179.24 175.67 2ptq n GLU 141 N -4.04 0.71 0.04 3.56 1.02 -0.32 -4.71 120.64 116.89 2ptq n GLU 141 Ca -0.01 -0.13 -0.01 0.00 -0.02 0.00 0.00 57.16 56.99 2ptq n GLU 141 Cb 0.46 -1.43 -0.00 0.00 -0.02 0.00 0.00 31.44 30.45 2ptq n GLU 141 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2ptq n VAL 142 N -2.25 1.21 0.33 2.62 0.31 -0.24 -4.72 118.33 115.59 2ptq n VAL 142 Ca -0.09 0.38 -0.17 0.00 -0.01 0.00 0.00 64.34 64.44 2ptq n VAL 142 Cb 0.61 -1.63 -0.09 0.00 -0.91 0.00 0.00 33.84 31.83 2ptq n VAL 142 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2ptq h ILE 143 N -0.07 0.40 -0.95 2.52 2.04 -0.99 -2.92 117.51 117.53 2ptq h ILE 143 Ca 0.00 -0.04 0.07 0.00 1.00 0.00 0.00 64.86 65.89 2ptq h ILE 143 Cb 0.07 0.41 -0.06 0.00 -0.74 0.00 0.00 36.82 36.50 2ptq h ILE 143 CO 0.00 0.01 0.62 -0.07 0.00 0.00 0.00 178.15 178.70 2ptq h LEU 144 N -0.84 0.96 -1.21 1.44 3.38 -1.51 -1.21 115.31 116.32 2ptq h LEU 144 Ca -0.08 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 2ptq h LEU 144 Cb 0.64 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2ptq h LEU 144 CO 0.14 0.60 -0.10 1.55 0.09 0.00 0.00 178.44 180.72 2ptq h PRO 145 N 1.08 0.43 -0.27 1.13 0.13 -1.78 0.60 132.00 133.32 2ptq h PRO 145 Ca 0.41 -0.11 -0.14 0.00 -0.87 0.00 0.00 66.00 65.30 2ptq h PRO 145 Cb 0.22 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.29 2ptq h PRO 145 CO -0.16 0.54 -0.38 1.88 -0.23 0.00 0.00 178.00 179.65 2ptq h TYR 146 N 0.40 0.90 -0.97 1.56 -1.99 -1.16 -1.87 116.97 113.84 2ptq h TYR 146 Ca 0.08 -0.30 0.00 0.00 2.00 0.00 0.00 58.73 60.52 2ptq h TYR 146 Cb 0.42 -0.18 -0.05 0.00 2.00 0.00 0.00 36.73 38.93 2ptq h TYR 146 CO 0.01 1.07 0.62 -1.49 -0.00 0.00 0.00 178.16 178.37 2ptq h TRP 147 N 0.47 1.25 -0.42 4.88 4.06 -0.84 -0.19 115.95 125.15 2ptq h TRP 147 Ca 0.03 0.01 -0.09 0.00 2.06 0.00 0.00 58.89 60.91 2ptq h TRP 147 Cb 0.97 -0.42 -0.02 0.00 -1.00 0.00 0.00 29.16 28.69 2ptq h TRP 147 CO 0.08 0.80 -0.09 -0.09 -3.56 0.00 0.00 178.44 175.58 2ptq h ARG 148 N 1.33 0.74 -0.47 0.49 9.65 -0.77 0.77 114.38 126.12 2ptq h ARG 148 Ca 0.35 -0.23 -0.05 0.00 -1.10 0.00 0.00 59.98 58.95 2ptq h ARG 148 Cb -0.11 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.38 2ptq h ARG 148 CO -0.07 0.81 0.09 1.96 2.80 0.00 0.00 179.97 185.56 2ptq h GLN 149 N 0.68 0.77 -0.48 0.20 4.20 -0.46 0.16 115.11 120.18 2ptq h GLN 149 Ca 0.12 -0.20 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 2ptq h GLN 149 Cb 0.55 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 2ptq h GLN 149 CO 0.03 0.77 0.04 -0.07 -0.67 0.00 0.00 178.83 178.93 2ptq h LEU 150 N 0.64 0.78 -0.24 1.46 3.38 -0.73 0.10 115.31 120.71 2ptq h LEU 150 Ca 0.14 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2ptq h LEU 150 Cb 0.36 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2ptq h LEU 150 CO 0.01 0.87 0.07 0.40 0.09 0.00 0.00 178.44 179.88 2ptq h ILE 151 N 0.67 1.20 -0.31 1.22 2.04 -0.69 -0.51 117.51 121.13 2ptq h ILE 151 Ca 0.14 -0.63 -0.07 0.00 1.00 0.00 0.00 64.86 65.30 2ptq h ILE 151 Cb 0.44 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 2ptq h ILE 151 CO 0.02 0.20 -0.10 0.44 0.00 0.00 0.00 178.15 178.71 2ptq h ASP 152 N 0.22 0.50 -0.29 1.72 3.32 -0.90 -1.56 116.42 119.42 2ptq h ASP 152 Ca 0.08 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 2ptq h ASP 152 Cb 0.25 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2ptq h ASP 152 CO -0.00 0.64 0.07 1.23 -1.72 0.00 0.00 179.24 179.45 2ptq h GLY 153 N 0.91 0.49 1.28 2.75 0.00 -0.43 -1.03 103.07 107.04 2ptq h GLY 153 Ca 0.09 -0.31 -0.07 0.00 0.00 0.00 0.00 47.33 47.04 2ptq h GLY 153 CO 0.03 0.29 0.03 1.41 0.00 0.00 0.00 176.54 178.30 2ptq h LEU 154 N 0.30 0.85 -0.61 3.11 -0.00 -0.88 -1.92 115.31 116.15 2ptq h LEU 154 Ca 0.09 -0.20 -0.04 0.00 -0.00 0.00 0.00 57.88 57.72 2ptq h LEU 154 Cb 0.29 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 40.70 2ptq h LEU 154 CO 0.00 0.89 0.21 0.11 -0.00 0.00 0.00 178.44 179.66 2ptq h LYS 155 N 0.83 0.93 -0.73 1.13 1.57 -1.11 0.34 116.57 119.53 2ptq h LYS 155 Ca 0.16 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2ptq h LYS 155 Cb 0.45 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 2ptq h LYS 155 CO 0.02 0.82 0.48 -0.44 -0.57 0.00 0.00 179.45 179.75 2ptq h ASP 156 N 0.86 0.84 -0.71 0.86 3.32 -0.86 -0.26 116.42 120.48 2ptq h ASP 156 Ca 0.20 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.16 2ptq h ASP 156 Cb 0.25 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 2ptq h ASP 156 CO -0.01 0.62 0.22 -0.07 -1.72 0.00 0.00 179.24 178.28 2ptq h LEU 157 N 0.99 1.05 -0.21 1.55 3.38 -0.93 0.40 115.31 121.53 2ptq h LEU 157 Ca 0.27 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2ptq h LEU 157 Cb -0.10 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.36 2ptq h LEU 157 CO -0.06 0.98 0.14 0.00 0.09 0.00 0.00 178.44 179.59 2ptq h ALA 158 N 1.16 0.27 -0.21 1.53 0.00 -0.02 0.02 119.26 122.01 2ptq h ALA 158 Ca 0.23 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 2ptq h ALA 158 Cb 0.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2ptq h ALA 158 CO -0.01 -0.25 0.02 0.28 0.00 0.00 0.00 179.25 179.29 2ptq h VAL 159 N 0.29 1.24 -0.66 0.00 2.07 -0.87 0.10 116.25 118.41 2ptq h VAL 159 Ca 0.08 -0.81 0.02 0.00 0.82 0.00 0.00 66.70 66.81 2ptq h VAL 159 Cb -0.03 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 2ptq h VAL 159 CO -0.02 0.25 0.44 -0.61 0.02 0.00 0.00 177.57 177.65 2ptq h GLN 160 N 0.14 0.81 -0.30 1.57 4.15 -0.74 -2.83 115.11 117.92 2ptq h GLN 160 Ca 0.06 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2ptq h GLN 160 Cb 0.36 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.86 2ptq h GLN 160 CO 0.01 0.54 0.00 0.66 -1.93 0.00 0.00 178.83 178.10 2ptq n TYR 161 N -4.45 0.83 -0.32 3.99 0.53 -0.02 -4.78 117.16 112.94 2ptq n TYR 161 Ca 0.08 -0.76 0.19 0.00 -1.02 0.00 0.00 57.90 56.39 2ptq n TYR 161 Cb 0.09 -0.23 0.39 0.00 -1.03 0.00 0.00 39.34 38.56 2ptq n TYR 161 CO 0.00 0.00 0.00 0.07 -1.02 0.00 0.00 176.86 175.91 2ptq h ARG 162 N 1.94 0.22 -0.47 -0.72 0.11 -0.53 -0.25 114.38 114.68 2ptq h ARG 162 Ca 0.00 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2ptq h ARG 162 Cb 1.25 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 32.28 2ptq h ARG 162 CO 0.16 0.15 0.00 -0.40 0.10 0.00 0.00 179.97 179.98 2ptq n ASP 163 N -5.17 3.32 -4.59 0.08 3.85 -1.26 -4.34 116.55 108.43 2ptq n ASP 163 Ca 0.27 -1.96 -0.43 0.00 -0.71 0.00 0.00 54.79 51.96 2ptq n ASP 163 Cb 0.86 -0.31 -0.03 0.00 -1.35 0.00 0.00 41.12 40.29 2ptq n ASP 163 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 2ptq s ILE 164 N -1.08 4.32 0.57 2.12 1.01 -0.76 -4.98 121.20 122.40 2ptq s ILE 164 Ca 0.34 1.05 -0.21 0.00 0.00 0.00 0.00 60.65 61.83 2ptq s ILE 164 Cb 0.18 -4.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.08 2ptq s ILE 164 CO 0.25 -0.93 1.34 -2.84 0.00 0.00 0.00 174.94 172.76 2ptq s PRO 165 N 4.16 2.98 -0.06 2.79 0.02 -1.26 -0.21 135.00 143.43 2ptq s PRO 165 Ca 0.44 2.19 -0.03 0.00 0.02 0.00 0.00 61.00 63.61 2ptq s PRO 165 Cb -0.08 -2.15 0.03 0.00 0.02 0.00 0.00 34.50 32.32 2ptq s PRO 165 CO 0.29 -1.30 0.13 -1.17 -0.33 0.00 0.00 177.00 174.62 2ptq s LEU 166 N -3.75 0.93 -0.51 -5.54 2.96 0.34 -4.65 118.68 108.46 2ptq s LEU 166 Ca 0.75 0.26 -0.28 0.00 -0.22 0.00 0.00 54.13 54.64 2ptq s LEU 166 Cb -0.40 0.33 0.01 0.00 0.50 0.00 0.00 46.19 46.64 2ptq s LEU 166 CO 0.45 -0.12 1.41 -0.22 -1.32 0.00 0.00 176.35 176.55 2ptq s LEU 167 N 0.93 3.47 0.85 -0.68 2.96 -1.26 -1.55 118.68 123.39 2ptq s LEU 167 Ca -0.07 0.48 -0.11 0.00 -0.22 0.00 0.00 54.13 54.20 2ptq s LEU 167 Cb -0.09 -3.23 0.10 0.00 0.50 0.00 0.00 46.19 43.47 2ptq s LEU 167 CO -0.04 -1.61 1.14 -0.44 -1.32 0.00 0.00 176.35 174.07 2ptq s SER 168 N 4.27 3.54 -0.16 3.68 0.01 -1.22 -4.79 113.70 119.04 2ptq s SER 168 Ca 0.56 2.13 -0.01 0.00 1.31 0.00 0.00 55.95 59.93 2ptq s SER 168 Cb -0.12 -2.56 0.05 0.00 0.21 0.00 0.00 66.02 63.60 2ptq s SER 168 CO 0.28 -2.69 -0.01 -0.13 0.41 0.00 0.00 173.24 171.10 2ptq s ARG 169 N -4.58 0.98 -0.08 12.44 1.81 -1.26 -0.04 118.95 128.22 2ptq s ARG 169 Ca 0.67 -0.35 0.04 0.00 -1.72 0.00 0.00 55.73 54.37 2ptq s ARG 169 Cb -0.22 -1.82 -0.00 0.00 -0.45 0.00 0.00 34.95 32.45 2ptq s ARG 169 CO 0.55 -0.48 -0.23 0.95 -0.68 0.00 0.00 175.30 175.42 2ptq s THR 170 N 1.78 1.92 -1.05 0.02 -4.23 -0.78 -4.41 115.64 108.89 2ptq s THR 170 Ca 0.01 -0.96 0.00 0.00 -1.18 0.00 0.00 61.69 59.56 2ptq s THR 170 Cb -0.15 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 72.04 2ptq s THR 170 CO -0.07 0.53 0.00 0.59 -0.54 0.00 0.00 174.62 175.13 2ptq n ASN 171 N 3.36 -4.85 0.00 3.99 3.02 -1.26 -1.07 115.26 118.45 2ptq n ASN 171 Ca -0.19 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.61 2ptq n ASN 171 Cb 0.53 -3.22 0.00 0.00 -0.61 0.00 0.00 39.78 36.48 2ptq n ASN 171 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ptq n GLY 172 N -0.89 0.87 3.85 7.41 0.00 -1.26 -5.02 105.19 110.14 2ptq n GLY 172 Ca -0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 2ptq n GLY 172 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ptq s GLN 173 N -0.03 3.18 -0.04 1.61 -1.52 -0.24 -4.95 119.66 117.68 2ptq s GLN 173 Ca 0.00 -0.53 -0.37 0.00 -1.95 0.00 0.00 55.36 52.51 2ptq s GLN 173 Cb 0.00 -2.91 -0.15 0.00 -0.22 0.00 0.00 33.01 29.73 2ptq s GLN 173 CO 0.00 0.60 1.57 -2.30 -0.25 0.00 0.00 175.29 174.91 2ptq n PRO 174 N 0.51 1.43 -4.04 2.91 -0.02 -1.26 -1.86 135.00 132.66 2ptq n PRO 174 Ca -0.08 0.52 -0.19 0.00 -2.02 0.00 0.00 63.50 61.73 2ptq n PRO 174 Cb 0.52 -2.22 -0.07 0.00 -0.02 0.00 0.00 33.50 31.71 2ptq n PRO 174 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ptq n ALA 175 N 4.04 0.62 -1.66 3.55 0.00 0.94 -4.86 120.51 123.14 2ptq n ALA 175 Ca 0.21 -1.77 -0.55 0.00 0.00 0.00 0.00 53.44 51.33 2ptq n ALA 175 Cb 0.20 1.38 -0.07 0.00 0.00 0.00 0.00 19.45 20.96 2ptq n ALA 175 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2ptq n THR 176 N -0.63 0.17 -0.89 0.00 -1.04 -1.26 -3.45 114.28 107.18 2ptq n THR 176 Ca 0.04 -0.03 -0.32 0.00 -2.04 0.00 0.00 64.05 61.70 2ptq n THR 176 Cb 0.54 -1.03 0.15 0.00 -1.82 0.00 0.00 70.33 68.17 2ptq n THR 176 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2ptq n PRO 177 N 4.07 -0.15 -0.30 -2.82 -0.02 -1.26 -4.00 135.00 130.52 2ptq n PRO 177 Ca 0.23 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2ptq n PRO 177 Cb 0.16 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.24 2ptq n PRO 177 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2ptq n SER 178 N -3.71 0.00 -4.24 2.55 2.88 -0.60 -4.58 113.62 105.93 2ptq n SER 178 Ca 0.13 -0.16 -0.19 0.00 -1.33 0.00 0.00 58.87 57.31 2ptq n SER 178 Cb 0.51 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.86 2ptq n SER 178 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2ptq s THR 179 N -1.48 1.37 0.21 2.46 -4.23 -1.26 -0.51 115.64 112.21 2ptq s THR 179 Ca 0.00 -1.59 -0.09 0.00 -1.18 0.00 0.00 61.69 58.82 2ptq s THR 179 Cb 0.00 -1.43 0.14 0.00 1.34 0.00 0.00 72.50 72.55 2ptq s THR 179 CO 0.00 -0.30 1.76 0.40 -0.54 0.00 0.00 174.62 175.94 2ptq h ILE 180 N 3.80 0.81 -0.83 2.99 1.08 -0.72 -2.20 117.51 122.43 2ptq h ILE 180 Ca -0.41 -0.16 0.06 0.00 -0.39 0.00 0.00 64.86 63.95 2ptq h ILE 180 Cb 1.19 0.30 -0.06 0.00 -3.07 0.00 0.00 36.82 35.19 2ptq h ILE 180 CO 0.46 0.08 0.52 1.23 -0.69 0.00 0.00 178.15 179.75 2ptq h GLY 181 N 0.46 1.25 1.01 5.37 0.00 -1.28 -2.18 103.07 107.71 2ptq h GLY 181 Ca 0.31 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 2ptq h GLY 181 CO -0.28 0.27 0.24 1.70 0.00 0.00 0.00 176.54 178.47 2ptq h LYS 182 N 0.95 0.97 0.00 4.80 1.63 -1.66 -0.13 116.57 123.13 2ptq h LYS 182 Ca 0.36 -0.18 -0.03 0.00 -0.85 0.00 0.00 60.65 59.94 2ptq h LYS 182 Cb 0.15 -0.15 -0.00 0.00 -0.60 0.00 0.00 32.23 31.62 2ptq h LYS 182 CO -0.16 0.83 -0.15 0.93 -3.45 0.00 0.00 179.45 177.44 2ptq h GLU 183 N 0.91 0.00 0.10 1.90 4.39 -1.00 -1.49 114.58 119.40 2ptq h GLU 183 Ca 0.21 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.65 2ptq h GLU 183 Cb 0.23 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 28.90 2ptq h GLU 183 CO -0.01 0.15 -1.09 0.52 -1.16 0.00 0.00 179.01 177.42 2ptq h MET 184 N 0.00 0.56 -0.98 2.33 2.86 -0.81 -3.30 114.93 115.60 2ptq h MET 184 Ca -0.00 -0.74 0.03 0.00 -2.06 0.00 0.00 59.70 56.93 2ptq h MET 184 Cb 0.36 0.24 -0.06 0.00 0.06 0.00 0.00 31.60 32.21 2ptq h MET 184 CO 0.02 1.32 0.64 0.00 1.06 0.00 0.00 176.91 179.95 2ptq h ALA 185 N 0.27 1.28 -0.87 6.32 0.00 -0.26 -2.22 119.26 123.79 2ptq h ALA 185 Ca -0.16 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.75 2ptq h ALA 185 Cb 1.79 -0.36 -0.06 0.00 0.00 0.00 0.00 17.79 19.16 2ptq h ALA 185 CO 0.21 0.54 0.55 -0.91 0.00 0.00 0.00 179.25 179.64 2ptq h ASN 186 N 1.25 0.88 -0.36 0.00 2.35 -1.38 -1.64 115.58 116.68 2ptq h ASN 186 Ca 0.38 0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 56.03 2ptq h ASN 186 Cb -0.03 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 2ptq h ASN 186 CO -0.12 0.58 -0.22 0.58 -1.65 0.00 0.00 177.43 176.60 2ptq h VAL 187 N 1.03 1.29 -0.55 2.81 2.07 -1.52 -2.54 116.25 118.84 2ptq h VAL 187 Ca 0.37 -1.37 0.01 0.00 0.82 0.00 0.00 66.70 66.53 2ptq h VAL 187 Cb 0.11 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 2ptq h VAL 187 CO -0.15 0.45 0.36 0.00 0.02 0.00 0.00 177.57 178.25 2ptq h ALA 188 N 0.78 0.71 -0.47 1.67 0.00 -1.02 -0.51 119.26 120.42 2ptq h ALA 188 Ca 0.07 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2ptq h ALA 188 Cb 0.78 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2ptq h ALA 188 CO 0.06 0.11 0.27 -0.92 0.00 0.00 0.00 179.25 178.78 2ptq h TYR 189 N 0.72 0.51 -0.42 0.00 5.03 -1.25 -0.61 116.97 120.96 2ptq h TYR 189 Ca 0.21 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.51 2ptq h TYR 189 Cb -0.05 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 38.05 2ptq h TYR 189 CO -0.04 0.29 0.16 0.00 -1.32 0.00 0.00 178.16 177.25 2ptq h ARG 190 N 0.55 0.63 -0.74 1.82 3.08 -1.02 -2.61 114.38 116.09 2ptq h ARG 190 Ca 0.19 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2ptq h ARG 190 Cb 0.02 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 29.94 2ptq h ARG 190 CO -0.09 0.59 0.47 0.52 -1.07 0.00 0.00 179.97 180.38 2ptq h MET 191 N 0.53 0.99 -0.81 0.04 2.86 -0.77 -2.46 114.93 115.32 2ptq h MET 191 Ca 0.14 -0.07 -0.04 0.00 -2.06 0.00 0.00 59.70 57.66 2ptq h MET 191 Cb 0.20 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 31.61 2ptq h MET 191 CO -0.01 0.68 0.33 1.49 1.06 0.00 0.00 176.91 180.46 2ptq h GLU 192 N 1.01 1.20 -0.67 1.72 4.57 -0.81 -0.87 114.58 120.73 2ptq h GLU 192 Ca 0.27 -0.21 0.01 0.00 -1.18 0.00 0.00 59.36 58.24 2ptq h GLU 192 Cb -0.08 -0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 28.28 2ptq h GLU 192 CO -0.05 0.96 0.44 0.00 -1.18 0.00 0.00 179.01 179.17 2ptq h ARG 193 N 1.17 0.88 -0.24 1.92 3.08 -1.08 -1.87 114.38 118.24 2ptq h ARG 193 Ca 0.27 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 60.13 2ptq h ARG 193 Cb 0.20 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2ptq h ARG 193 CO -0.02 0.59 -0.42 1.96 -1.07 0.00 0.00 179.97 181.01 2ptq h GLN 194 N 0.91 0.58 -0.38 0.04 1.08 -1.31 -2.30 115.11 113.72 2ptq h GLN 194 Ca 0.24 -0.30 0.02 0.00 -1.45 0.00 0.00 58.65 57.16 2ptq h GLN 194 Cb -0.10 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.31 2ptq h GLN 194 CO -0.05 0.89 0.22 -0.92 -0.95 0.00 0.00 178.83 178.02 2ptq h TYR 195 N 0.47 0.41 -0.53 2.96 5.03 -0.72 0.20 116.97 124.79 2ptq h TYR 195 Ca 0.04 0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.36 2ptq h TYR 195 Cb 0.93 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 39.05 2ptq h TYR 195 CO 0.04 0.24 0.33 -0.09 -1.32 0.00 0.00 178.16 177.35 2ptq h ARG 196 N 0.45 0.72 -0.29 1.82 2.43 -1.24 -1.61 114.38 116.66 2ptq h ARG 196 Ca 0.15 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 2ptq h ARG 196 Cb 0.02 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 2ptq h ARG 196 CO -0.08 0.52 0.09 1.96 -1.51 0.00 0.00 179.97 180.95 2ptq h GLN 197 N 0.72 0.45 -0.84 0.20 4.20 -0.89 -1.96 115.11 116.99 2ptq h GLN 197 Ca 0.19 -0.10 0.02 0.00 0.06 0.00 0.00 58.65 58.82 2ptq h GLN 197 Cb -0.02 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.65 2ptq h GLN 197 CO -0.04 0.51 0.55 1.25 -0.67 0.00 0.00 178.83 180.43 2ptq h LEU 198 N 0.31 0.94 -1.53 1.46 5.85 -0.41 -1.81 115.31 120.12 2ptq h LEU 198 Ca 0.09 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 2ptq h LEU 198 Cb 0.25 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2ptq h LEU 198 CO -0.00 0.67 -0.25 -1.13 -0.34 0.00 0.00 178.44 177.39 2ptq h ASN 199 N 1.11 0.00 0.40 1.25 -1.24 -1.12 -2.58 115.58 113.40 2ptq h ASN 199 Ca 0.31 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.32 2ptq h ASN 199 Cb -0.09 0.00 0.00 0.00 0.73 0.00 0.00 38.32 38.96 2ptq h ASN 199 CO -0.08 0.25 -0.30 0.00 -1.29 0.00 0.00 177.43 176.00 2ptq n GLN 200 N -4.10 0.47 -1.94 6.67 6.02 -0.75 -4.90 117.38 118.85 2ptq n GLN 200 Ca -0.02 -0.25 -0.42 0.00 -0.01 0.00 0.00 57.00 56.31 2ptq n GLN 200 Cb 0.31 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 30.05 2ptq n GLN 200 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2ptq s VAL 201 N -2.70 2.52 0.26 5.09 1.01 -0.81 -4.96 120.40 120.80 2ptq s VAL 201 Ca 0.20 0.41 -0.30 0.00 0.00 0.00 0.00 61.98 62.30 2ptq s VAL 201 Cb 0.19 -3.27 -0.09 0.00 0.00 0.00 0.00 36.38 33.21 2ptq s VAL 201 CO 0.58 0.06 0.99 -1.61 0.00 0.00 0.00 175.10 175.11 2ptq s GLU 202 N 0.03 4.78 -0.34 2.72 2.02 -1.26 -5.02 118.70 121.62 2ptq s GLU 202 Ca 0.63 1.57 -0.02 0.00 0.02 0.00 0.00 54.97 57.17 2ptq s GLU 202 Cb -0.44 -3.22 0.07 0.00 0.10 0.00 0.00 34.13 30.64 2ptq s GLU 202 CO 0.41 0.41 0.08 0.42 0.02 0.00 0.00 175.26 176.60 2ptq s ILE 203 N -1.20 3.06 0.22 -1.63 1.01 -1.26 -4.81 121.20 116.58 2ptq s ILE 203 Ca 0.43 -1.68 -0.05 0.00 0.00 0.00 0.00 60.65 59.35 2ptq s ILE 203 Cb -0.27 -2.91 -0.06 0.00 0.01 0.00 0.00 42.46 39.23 2ptq s ILE 203 CO 0.34 -0.34 0.47 -0.76 0.00 0.00 0.00 174.94 174.65 2ptq s LEU 204 N 1.19 4.17 0.04 2.97 1.43 -1.26 -1.61 118.68 125.62 2ptq s LEU 204 Ca 0.01 0.67 -0.12 0.00 -1.03 0.00 0.00 54.13 53.66 2ptq s LEU 204 Cb -0.21 -3.44 0.01 0.00 0.03 0.00 0.00 46.19 42.59 2ptq s LEU 204 CO -0.03 -0.07 0.26 -0.83 0.23 0.00 0.00 176.35 175.91 2ptq s GLY 205 N -2.76 -0.05 0.16 -3.19 0.00 0.23 -4.72 107.32 96.99 2ptq s GLY 205 Ca 0.43 -0.13 -0.06 0.00 0.00 0.00 0.00 44.72 44.96 2ptq s GLY 205 CO 0.26 -0.33 0.19 -1.59 0.00 0.00 0.00 173.10 171.63 2ptq s LYS 206 N -2.61 1.09 -0.30 2.90 0.00 -1.26 -1.13 119.74 118.42 2ptq s LYS 206 Ca -0.05 -1.31 -0.03 0.00 0.00 0.00 0.00 55.97 54.59 2ptq s LYS 206 Cb -0.01 0.32 0.19 0.00 0.00 0.00 0.00 37.83 38.33 2ptq s LYS 206 CO -0.04 -0.37 0.71 -1.50 0.00 0.00 0.00 175.35 174.15 2ptq s ILE 207 N -4.01 -0.84 0.00 3.79 2.07 -1.26 -4.67 121.20 116.28 2ptq s ILE 207 Ca 0.21 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.45 2ptq s ILE 207 Cb 0.05 -0.97 0.00 0.00 0.13 0.00 0.00 42.46 41.67 2ptq s ILE 207 CO 0.02 0.00 0.51 -0.46 -1.91 0.00 0.00 174.94 173.10 2ptq n ASN 208 N 5.43 0.00 0.00 4.50 0.23 -1.26 -4.73 115.26 119.42 2ptq n ASN 208 Ca -0.01 -1.14 0.00 0.00 -0.53 0.00 0.00 54.58 52.90 2ptq n ASN 208 Cb 0.52 -0.03 0.00 0.00 -2.08 0.00 0.00 39.78 38.19 2ptq n ASN 208 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2ptq n GLY 209 N 0.00 -2.72 0.21 4.83 0.00 -1.26 -0.48 105.19 105.77 2ptq n GLY 209 Ca 0.00 -1.69 -0.03 0.00 0.00 0.00 0.00 46.02 44.30 2ptq n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ptq n ALA 210 N -0.37 -0.19 -0.57 4.61 0.00 -1.26 -2.30 120.51 120.43 2ptq n ALA 210 Ca 0.00 0.49 0.02 0.00 0.00 0.00 0.00 53.44 53.95 2ptq n ALA 210 Cb 0.00 -0.16 0.03 0.00 0.00 0.00 0.00 19.45 19.32 2ptq n ALA 210 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2ptq n VAL 211 N -4.72 0.96 -0.35 0.00 0.24 -1.26 -4.08 118.33 109.12 2ptq n VAL 211 Ca 0.03 -1.05 0.00 0.00 -2.04 0.00 0.00 64.34 61.29 2ptq n VAL 211 Cb 0.18 0.42 0.00 0.00 -1.47 0.00 0.00 33.84 32.96 2ptq n VAL 211 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ptq n GLY 212 N -0.59 0.82 0.45 7.63 0.00 -0.97 -3.99 105.19 108.54 2ptq n GLY 212 Ca 0.04 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.11 2ptq n GLY 212 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ptq n ASN 213 N 0.01 2.89 -2.07 1.61 3.02 -1.16 -4.77 115.26 114.80 2ptq n ASN 213 Ca 0.00 -2.58 -0.16 0.00 -0.03 0.00 0.00 54.58 51.82 2ptq n ASN 213 Cb 0.00 -0.33 -0.03 0.00 -0.61 0.00 0.00 39.78 38.81 2ptq n ASN 213 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2ptq n TYR 214 N -0.48 -0.88 -0.05 3.10 4.01 0.37 -4.87 117.16 118.35 2ptq n TYR 214 Ca 0.13 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.76 2ptq n TYR 214 Cb 0.59 -3.13 -0.06 0.00 -0.31 0.00 0.00 39.34 36.43 2ptq n TYR 214 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 2ptq h ASN 215 N 0.00 -1.38 -0.78 7.72 2.35 -1.94 -0.89 115.58 120.66 2ptq h ASN 215 Ca -0.36 0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.56 2ptq h ASN 215 Cb 1.19 0.58 -0.04 0.00 0.05 0.00 0.00 38.32 40.10 2ptq h ASN 215 CO 0.46 -0.41 0.40 0.00 -1.65 0.00 0.00 177.43 176.23 2ptq h ALA 216 N 0.21 1.00 0.09 -0.83 0.00 -1.89 -1.80 119.26 116.03 2ptq h ALA 216 Ca 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2ptq h ALA 216 Cb 0.61 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2ptq h ALA 216 CO -0.47 0.54 -0.09 0.45 0.00 0.00 0.00 179.25 179.68 2ptq h HIS 217 N 1.09 -0.24 -0.65 0.00 3.86 -1.70 -2.73 115.15 114.78 2ptq h HIS 217 Ca 0.27 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.42 2ptq h HIS 217 Cb 0.07 0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.61 2ptq h HIS 217 CO 0.01 -0.15 0.17 0.82 0.86 0.00 0.00 177.93 179.64 2ptq h ILE 218 N -0.21 1.25 -0.68 2.45 2.04 -1.09 0.28 117.51 121.56 2ptq h ILE 218 Ca 0.01 -0.90 0.02 0.00 1.00 0.00 0.00 64.86 64.99 2ptq h ILE 218 Cb 0.20 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 2ptq h ILE 218 CO -0.03 0.34 0.45 0.00 0.00 0.00 0.00 178.15 178.91 2ptq h ALA 219 N 1.20 1.56 0.09 1.87 0.00 -1.16 -1.57 119.26 121.25 2ptq h ALA 219 Ca 0.21 -0.04 -0.32 0.00 0.00 0.00 0.00 54.91 54.76 2ptq h ALA 219 Cb 0.33 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2ptq h ALA 219 CO -0.00 0.39 -1.72 0.00 0.00 0.00 0.00 179.25 177.92 2ptq h ALA 220 N 1.59 0.36 -2.54 0.00 0.00 -1.21 -3.42 119.26 114.03 2ptq h ALA 220 Ca 0.26 -1.31 -0.60 0.00 0.00 0.00 0.00 54.91 53.26 2ptq h ALA 220 Cb -0.03 0.70 -0.41 0.00 0.00 0.00 0.00 17.79 18.06 2ptq h ALA 220 CO -0.06 1.08 -0.73 0.66 0.00 0.00 0.00 179.25 180.19 2ptq n TYR 221 N -3.83 2.07 0.29 0.00 4.02 0.96 -4.94 117.16 115.74 2ptq n TYR 221 Ca -0.31 -3.97 0.13 0.00 -0.01 0.00 0.00 57.90 53.73 2ptq n TYR 221 Cb 0.92 -0.40 0.62 0.00 -0.02 0.00 0.00 39.34 40.46 2ptq n TYR 221 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2ptq h PRO 222 N 4.89 0.00 0.00 -0.72 0.13 -1.48 -2.60 132.00 132.22 2ptq h PRO 222 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2ptq h PRO 222 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2ptq h PRO 222 CO 0.65 0.00 -0.65 -0.85 -0.23 0.00 0.00 178.00 176.92 2ptq n GLU 223 N -2.42 0.08 -3.19 0.86 0.00 -1.26 -4.89 120.64 109.81 2ptq n GLU 223 Ca 0.00 0.01 -0.39 0.00 0.00 0.00 0.00 57.16 56.78 2ptq n GLU 223 Cb 0.15 -1.53 -0.06 0.00 0.00 0.00 0.00 31.44 30.00 2ptq n GLU 223 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2ptq s VAL 224 N -3.05 4.84 -0.95 3.84 1.01 -0.98 -5.00 120.40 120.11 2ptq s VAL 224 Ca 0.09 1.29 -0.22 0.00 0.00 0.00 0.00 61.98 63.14 2ptq s VAL 224 Cb 0.16 -3.95 0.08 0.00 0.00 0.00 0.00 36.38 32.68 2ptq s VAL 224 CO 0.74 0.45 1.30 -0.62 0.00 0.00 0.00 175.10 176.96 2ptq s ASP 225 N -0.40 6.51 0.49 3.32 3.68 -1.26 -4.82 116.67 124.19 2ptq s ASP 225 Ca 0.31 -1.59 0.29 0.00 2.13 0.00 0.00 52.55 53.69 2ptq s ASP 225 Cb -0.19 -2.50 1.08 0.00 -1.45 0.00 0.00 42.92 39.86 2ptq s ASP 225 CO 0.18 -1.36 1.88 -0.50 0.13 0.00 0.00 175.17 175.50 2ptq h TRP 226 N 9.45 0.00 -0.29 -5.34 4.06 -1.94 -1.79 115.95 120.11 2ptq h TRP 226 Ca 0.13 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.93 2ptq h TRP 226 Cb 1.02 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.17 2ptq h TRP 226 CO 1.22 0.10 -0.46 1.25 -3.56 0.00 0.00 178.44 176.99 2ptq h HIS 227 N 0.00 0.92 -0.16 0.49 2.76 -1.97 0.14 115.15 117.32 2ptq h HIS 227 Ca -0.00 -0.29 -0.17 0.00 -2.20 0.00 0.00 60.37 57.70 2ptq h HIS 227 Cb 0.66 -0.19 0.01 0.00 1.55 0.00 0.00 27.41 29.44 2ptq h HIS 227 CO 0.00 1.07 -0.58 0.37 -1.30 0.00 0.00 177.93 177.49 2ptq h GLN 228 N 0.60 0.68 -0.71 5.26 4.15 -1.92 -2.77 115.11 120.40 2ptq h GLN 228 Ca 0.04 -0.51 0.06 0.00 0.77 0.00 0.00 58.65 59.00 2ptq h GLN 228 Cb 1.02 0.09 -0.05 0.00 0.21 0.00 0.00 27.48 28.75 2ptq h GLN 228 CO 0.10 1.13 0.42 0.35 -1.93 0.00 0.00 178.83 178.90 2ptq h PHE 229 N 0.36 0.77 0.15 3.99 3.04 -1.20 -1.32 116.94 122.74 2ptq h PHE 229 Ca -0.03 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 2ptq h PHE 229 Cb 1.21 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 39.48 2ptq h PHE 229 CO 0.10 0.38 -0.07 1.03 -2.02 0.00 0.00 178.31 177.73 2ptq h SER 230 N 0.77 -0.17 -0.96 0.41 0.87 -0.92 -1.25 113.55 112.29 2ptq h SER 230 Ca 0.31 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 2ptq h SER 230 Cb 0.16 0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.12 2ptq h SER 230 CO -0.17 -0.05 0.62 -0.08 -0.53 0.00 0.00 176.83 176.61 2ptq h GLU 231 N -0.28 1.28 -0.25 2.24 4.81 -1.24 -1.45 114.58 119.69 2ptq h GLU 231 Ca -0.02 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 2ptq h GLU 231 Cb 0.22 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2ptq h GLU 231 CO 0.03 0.86 0.07 0.93 -0.73 0.00 0.00 179.01 180.18 2ptq h GLU 232 N 1.31 0.39 -0.09 1.92 5.08 -1.07 -2.06 114.58 120.06 2ptq h GLU 232 Ca 0.35 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2ptq h GLU 232 Cb -0.12 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.07 2ptq h GLU 232 CO -0.07 0.47 0.04 0.35 -1.00 0.00 0.00 179.01 178.80 2ptq h PHE 233 N 0.23 0.13 -0.22 4.33 3.04 -0.90 -0.04 116.94 123.50 2ptq h PHE 233 Ca 0.08 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.02 2ptq h PHE 233 Cb 0.25 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.71 2ptq h PHE 233 CO 0.01 0.20 0.14 0.28 -2.02 0.00 0.00 178.31 176.92 2ptq h VAL 234 N 0.01 1.07 0.00 1.41 2.07 -1.27 -2.12 116.25 117.43 2ptq h VAL 234 Ca 0.03 -0.16 -0.04 0.00 0.82 0.00 0.00 66.70 67.35 2ptq h VAL 234 Cb 0.12 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2ptq h VAL 234 CO -0.00 0.07 -0.21 0.71 0.02 0.00 0.00 177.57 178.15 2ptq h THR 235 N 0.29 0.80 0.00 2.57 1.35 -1.31 -1.89 112.91 114.71 2ptq h THR 235 Ca 0.08 -0.84 -0.03 0.00 -0.55 0.00 0.00 66.41 65.07 2ptq h THR 235 Cb -0.01 1.51 -0.00 0.00 -1.73 0.00 0.00 68.15 67.91 2ptq h THR 235 CO -0.02 0.21 -0.13 0.77 -0.25 0.00 0.00 175.52 176.11 2ptq h SER 236 N 0.00 0.00 0.20 5.36 4.64 -0.31 -1.42 113.55 122.02 2ptq h SER 236 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ptq h SER 236 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2ptq h SER 236 CO 0.03 0.13 -0.11 0.18 -0.87 0.00 0.00 176.83 176.19 2ptq n LEU 237 N -3.41 0.82 0.00 5.97 4.77 -0.74 -4.89 117.00 119.52 2ptq n LEU 237 Ca -0.01 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 2ptq n LEU 237 Cb 0.31 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2ptq n LEU 237 CO 0.30 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2ptq n GLY 238 N 1.24 0.62 3.73 -0.72 0.00 -0.53 -5.04 105.19 104.49 2ptq n GLY 238 Ca 0.16 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 2ptq n GLY 238 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ptq s ILE 239 N -2.00 4.27 0.09 -0.61 -1.09 -1.04 -5.02 121.20 115.81 2ptq s ILE 239 Ca 0.00 -0.92 -0.26 0.00 -2.23 0.00 0.00 60.65 57.25 2ptq s ILE 239 Cb 0.00 -3.07 -0.06 0.00 -1.58 0.00 0.00 42.46 37.75 2ptq s ILE 239 CO 0.00 0.09 0.79 -1.10 -1.23 0.00 0.00 174.94 173.50 2ptq s GLN 240 N -2.44 4.54 0.11 2.79 -0.21 -0.64 -3.43 119.66 120.38 2ptq s GLN 240 Ca 0.28 1.14 -0.30 0.00 0.02 0.00 0.00 55.36 56.50 2ptq s GLN 240 Cb -0.12 -3.33 -0.06 0.00 1.00 0.00 0.00 33.01 30.50 2ptq s GLN 240 CO 0.20 0.36 1.14 -0.46 -2.12 0.00 0.00 175.29 174.42 2ptq s TRP 241 N -0.39 3.51 -0.44 0.91 -0.00 -1.26 -0.60 118.94 120.68 2ptq s TRP 241 Ca 0.39 1.46 0.01 0.00 -0.00 0.00 0.00 56.10 57.96 2ptq s TRP 241 Cb -0.22 -3.34 0.12 0.00 -0.00 0.00 0.00 33.47 30.03 2ptq s TRP 241 CO 0.25 -0.91 0.19 1.21 -0.00 0.00 0.00 176.95 177.69 2ptq s ASN 242 N 0.53 4.86 0.41 5.86 3.04 -0.28 -4.83 114.94 124.53 2ptq s ASN 242 Ca 0.54 -2.42 0.15 0.00 0.04 0.00 0.00 52.86 51.17 2ptq s ASN 242 Cb -0.29 -1.71 0.87 0.00 -1.54 0.00 0.00 41.25 38.58 2ptq s ASN 242 CO 0.32 -0.39 1.89 1.55 -3.04 0.00 0.00 177.10 177.44 2ptq h PRO 243 N 7.39 0.00 -4.84 0.43 0.13 -1.96 -3.42 132.00 129.73 2ptq h PRO 243 Ca -0.07 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.38 2ptq h PRO 243 Cb 0.99 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.80 2ptq h PRO 243 CO 0.63 0.29 -0.71 0.71 -0.23 0.00 0.00 178.00 178.69 2ptq s TYR 244 N -4.29 3.15 0.26 1.56 1.51 -1.26 -5.08 117.35 113.20 2ptq s TYR 244 Ca -0.03 -1.60 -0.11 0.00 -1.01 0.00 0.00 57.07 54.33 2ptq s TYR 244 Cb 0.14 -2.10 -0.00 0.00 -0.11 0.00 0.00 41.96 39.89 2ptq s TYR 244 CO 0.70 -0.74 0.47 0.95 -1.11 0.00 0.00 175.55 175.82 2ptq s THR 245 N 1.32 0.00 0.00 -0.71 -4.23 -1.26 -4.90 115.64 105.86 2ptq s THR 245 Ca -0.02 -1.46 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 2ptq s THR 245 Cb -0.18 -2.32 0.00 0.00 1.34 0.00 0.00 72.50 71.34 2ptq s THR 245 CO -0.02 0.00 0.00 0.35 -0.54 0.00 0.00 174.62 174.41 2ptq n THR 246 N -0.41 0.00 0.05 3.99 -2.24 -1.26 -4.37 114.28 110.04 2ptq n THR 246 Ca -0.01 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.75 2ptq n THR 246 Cb 0.62 0.00 0.25 0.00 -2.10 0.00 0.00 70.33 69.10 2ptq n THR 246 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2ptq h GLN 247 N 0.00 0.39 -6.20 -0.78 4.15 -1.64 -3.24 115.11 107.79 2ptq h GLN 247 Ca 0.00 -0.14 -0.50 0.00 0.77 0.00 0.00 58.65 58.78 2ptq h GLN 247 Cb 0.00 -0.03 -0.05 0.00 0.21 0.00 0.00 27.48 27.61 2ptq h GLN 247 CO 0.00 0.61 -0.53 0.96 -1.93 0.00 0.00 178.83 177.94 2ptq s ILE 248 N -4.51 4.44 0.01 2.39 -4.36 -1.26 -4.63 121.20 113.28 2ptq s ILE 248 Ca -0.06 -1.41 -0.30 0.00 -0.26 0.00 0.00 60.65 58.62 2ptq s ILE 248 Cb 0.14 -3.40 -0.04 0.00 1.25 0.00 0.00 42.46 40.41 2ptq s ILE 248 CO 0.77 -0.35 1.05 -0.70 0.24 0.00 0.00 174.94 175.96 2ptq s GLU 249 N -3.84 4.51 0.65 0.37 -6.30 -1.26 -4.79 118.70 108.03 2ptq s GLU 249 Ca 0.33 1.53 0.24 0.00 -2.50 0.00 0.00 54.97 54.57 2ptq s GLU 249 Cb -0.08 -3.44 1.27 0.00 0.00 0.00 0.00 34.13 31.89 2ptq s GLU 249 CO 0.25 -0.14 1.72 -1.00 0.02 0.00 0.00 175.26 176.10 2ptq h PRO 250 N 6.84 0.00 -0.05 4.30 0.13 -1.96 -3.46 132.00 137.80 2ptq h PRO 250 Ca -0.40 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.70 2ptq h PRO 250 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2ptq h PRO 250 CO 0.78 0.00 -0.02 0.72 -0.23 0.00 0.00 178.00 179.25 2ptq n HIS 251 N -3.00 0.00 -0.26 1.56 8.25 -1.26 -4.01 115.22 116.51 2ptq n HIS 251 Ca 0.02 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.41 2ptq n HIS 251 Cb 0.61 -0.60 0.05 0.00 1.12 0.00 0.00 29.99 31.17 2ptq n HIS 251 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 2ptq h ASP 252 N 0.00 1.05 0.24 0.41 3.32 -1.95 -2.47 116.42 117.03 2ptq h ASP 252 Ca -0.02 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 56.77 2ptq h ASP 252 Cb 0.23 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 2ptq h ASP 252 CO 0.03 1.00 -0.15 0.10 -1.72 0.00 0.00 179.24 178.49 2ptq h TYR 253 N 1.06 0.00 -0.28 4.55 -0.00 -1.92 -1.00 116.97 119.38 2ptq h TYR 253 Ca 0.23 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.83 2ptq h TYR 253 Cb 0.34 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.06 2ptq h TYR 253 CO 0.03 0.15 -0.34 0.82 -0.00 0.00 0.00 178.16 178.82 2ptq h ILE 254 N 0.00 1.29 -0.51 -0.90 2.04 -1.77 0.15 117.51 117.81 2ptq h ILE 254 Ca -0.00 -1.47 -0.11 0.00 1.00 0.00 0.00 64.86 64.28 2ptq h ILE 254 Cb 0.32 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 2ptq h ILE 254 CO 0.02 0.47 -0.11 0.00 0.00 0.00 0.00 178.15 178.53 2ptq h ALA 255 N 1.11 0.70 -0.79 1.87 0.00 -1.10 -0.37 119.26 120.67 2ptq h ALA 255 Ca 0.06 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2ptq h ALA 255 Cb 0.83 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 2ptq h ALA 255 CO 0.07 0.61 0.44 0.93 0.00 0.00 0.00 179.25 181.29 2ptq h GLU 256 N 0.83 1.10 0.21 0.00 5.08 -0.71 0.22 114.58 121.30 2ptq h GLU 256 Ca 0.13 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2ptq h GLU 256 Cb 0.67 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2ptq h GLU 256 CO 0.05 0.81 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.70 2ptq h LEU 257 N 1.09 -0.24 -1.22 1.33 3.38 -0.46 -3.02 115.31 116.19 2ptq h LEU 257 Ca 0.28 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 2ptq h LEU 257 Cb 0.03 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2ptq h LEU 257 CO -0.05 0.06 -0.32 -0.26 0.09 0.00 0.00 178.44 177.97 2ptq h PHE 258 N -0.54 0.14 -0.63 1.13 -1.00 -0.95 -2.37 116.94 112.73 2ptq h PHE 258 Ca -0.03 -0.03 -0.09 0.00 2.81 0.00 0.00 57.97 60.63 2ptq h PHE 258 Cb 0.40 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.91 2ptq h PHE 258 CO 0.01 0.43 0.03 -0.44 -1.61 0.00 0.00 178.31 176.73 2ptq h ASP 259 N 0.11 1.06 0.28 2.17 3.32 -0.58 -0.23 116.42 122.56 2ptq h ASP 259 Ca 0.01 -0.29 -0.18 0.00 0.02 0.00 0.00 57.03 56.59 2ptq h ASP 259 Cb 0.62 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 2ptq h ASP 259 CO 0.05 1.10 -0.73 0.00 -1.72 0.00 0.00 179.24 177.93 2ptq h VAL 261 N 0.26 1.26 -0.47 0.00 2.07 -1.23 -1.68 116.25 116.46 2ptq h VAL 261 Ca -0.03 -0.99 -0.07 0.00 0.82 0.00 0.00 66.70 66.43 2ptq h VAL 261 Cb 1.31 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 2ptq h VAL 261 CO 0.12 0.38 0.01 0.00 0.02 0.00 0.00 177.57 178.10 2ptq h ALA 262 N 1.11 1.14 -0.42 1.67 0.00 -0.88 0.03 119.26 121.90 2ptq h ALA 262 Ca 0.21 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2ptq h ALA 262 Cb 0.39 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2ptq h ALA 262 CO 0.01 0.56 0.08 0.00 0.00 0.00 0.00 179.25 179.89 2ptq h ARG 263 N 0.72 0.70 -0.02 0.00 3.08 -0.92 -0.07 114.38 117.87 2ptq h ARG 263 Ca 0.14 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 2ptq h ARG 263 Cb 0.43 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 2ptq h ARG 263 CO 0.02 0.72 0.01 0.35 -1.07 0.00 0.00 179.97 180.00 2ptq h PHE 264 N 0.56 0.03 -0.98 3.04 3.57 -1.00 -1.91 116.94 120.25 2ptq h PHE 264 Ca 0.13 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.76 2ptq h PHE 264 Cb 0.36 -0.01 -0.09 0.00 2.79 0.00 0.00 35.95 39.00 2ptq h PHE 264 CO 0.02 0.09 0.60 -0.91 -2.23 0.00 0.00 178.31 175.88 2ptq h ASN 265 N -0.05 0.85 -0.68 0.41 2.35 -0.80 -0.34 115.58 117.33 2ptq h ASN 265 Ca 0.01 0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.75 2ptq h ASN 265 Cb 0.07 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.31 2ptq h ASN 265 CO -0.00 0.43 0.17 0.74 -1.65 0.00 0.00 177.43 177.12 2ptq h THR 266 N 0.91 1.26 -0.73 2.81 2.02 -0.59 0.13 112.91 118.73 2ptq h THR 266 Ca 0.50 -0.95 -0.05 0.00 0.77 0.00 0.00 66.41 66.68 2ptq h THR 266 Cb 0.56 0.54 -0.03 0.00 -1.74 0.00 0.00 68.15 67.47 2ptq h THR 266 CO -0.29 0.36 0.26 0.40 0.37 0.00 0.00 175.52 176.62 2ptq h ILE 267 N 1.04 1.26 -0.16 3.11 2.04 -0.38 -1.65 117.51 122.76 2ptq h ILE 267 Ca 0.22 -0.85 -0.10 0.00 1.00 0.00 0.00 64.86 65.13 2ptq h ILE 267 Cb 0.36 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 2ptq h ILE 267 CO 0.00 0.34 -0.33 0.25 0.00 0.00 0.00 178.15 178.41 2ptq h LEU 268 N 1.07 0.34 -0.28 1.44 5.85 -0.43 -1.20 115.31 122.10 2ptq h LEU 268 Ca 0.24 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 2ptq h LEU 268 Cb 0.26 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 2ptq h LEU 268 CO -0.01 0.66 0.08 0.40 -0.34 0.00 0.00 178.44 179.23 2ptq h ILE 269 N 0.29 1.20 -0.80 4.05 2.04 -0.33 0.23 117.51 124.19 2ptq h ILE 269 Ca 0.04 -0.66 0.06 0.00 1.00 0.00 0.00 64.86 65.29 2ptq h ILE 269 Cb 0.73 1.12 -0.06 0.00 -0.74 0.00 0.00 36.82 37.87 2ptq h ILE 269 CO 0.06 0.22 0.49 -0.78 0.00 0.00 0.00 178.15 178.13 2ptq h ASP 270 N 0.28 0.77 0.01 1.72 3.58 -0.99 -0.70 116.42 121.09 2ptq h ASP 270 Ca 0.09 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.55 2ptq h ASP 270 Cb 0.26 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.16 2ptq h ASP 270 CO -0.00 0.50 -0.01 0.15 -2.88 0.00 0.00 179.24 177.00 2ptq h PHE 271 N 0.90 -0.02 -0.84 0.28 3.57 -0.77 -1.22 116.94 118.83 2ptq h PHE 271 Ca 0.35 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.97 2ptq h PHE 271 Cb 0.15 0.01 -0.09 0.00 2.79 0.00 0.00 35.95 38.81 2ptq h PHE 271 CO -0.04 0.29 0.46 -0.44 -2.23 0.00 0.00 178.31 176.35 2ptq h ASP 272 N -0.32 0.60 -0.22 0.41 3.32 -0.15 -1.21 116.42 118.85 2ptq h ASP 272 Ca -0.00 0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 2ptq h ASP 272 Cb 0.31 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2ptq h ASP 272 CO 0.00 0.30 -0.11 0.03 -1.72 0.00 0.00 179.24 177.74 2ptq h ARG 273 N 0.70 0.47 -0.52 3.56 3.08 -1.02 -1.85 114.38 118.80 2ptq h ARG 273 Ca 0.44 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 60.28 2ptq h ARG 273 Cb 0.53 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 2ptq h ARG 273 CO -0.31 0.75 0.31 -0.44 -1.07 0.00 0.00 179.97 179.21 2ptq h ASP 274 N 0.18 0.63 -0.48 7.04 3.32 -0.66 -1.12 116.42 125.33 2ptq h ASP 274 Ca 0.05 -0.06 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 2ptq h ASP 274 Cb 0.60 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 2ptq h ASP 274 CO 0.03 0.51 -0.12 0.58 -1.72 0.00 0.00 179.24 178.52 2ptq h VAL 275 N 0.70 1.27 -0.76 -1.35 2.07 -1.27 0.71 116.25 117.62 2ptq h VAL 275 Ca 0.19 -1.27 0.09 0.00 0.82 0.00 0.00 66.70 66.54 2ptq h VAL 275 Cb -0.00 1.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.70 2ptq h VAL 275 CO -0.03 0.44 0.41 -0.25 0.02 0.00 0.00 177.57 178.16 2ptq h TRP 276 N 0.86 0.73 -0.40 1.57 7.01 -1.02 0.94 115.95 125.63 2ptq h TRP 276 Ca 0.13 0.03 -0.15 0.00 2.11 0.00 0.00 58.89 61.01 2ptq h TRP 276 Cb 0.67 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 27.51 2ptq h TRP 276 CO 0.04 0.28 -0.34 0.78 -2.79 0.00 0.00 178.44 176.41 2ptq h GLY 277 N 0.68 1.02 1.53 2.65 0.00 -0.50 -1.39 103.07 107.06 2ptq h GLY 277 Ca 0.37 -1.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.65 2ptq h GLY 277 CO -0.26 0.91 0.00 -0.97 0.00 0.00 0.00 176.54 176.22 2ptq h TYR 278 N 0.78 0.61 -0.30 5.60 0.05 0.04 -0.71 116.97 123.05 2ptq h TYR 278 Ca 0.07 -0.07 -0.15 0.00 0.05 0.00 0.00 58.73 58.64 2ptq h TYR 278 Cb 0.93 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 38.48 2ptq h TYR 278 CO 0.06 0.59 -0.41 0.82 -1.05 0.00 0.00 178.16 178.17 2ptq h ILE 279 N 0.56 1.29 -0.49 -2.88 2.04 -0.70 0.66 117.51 117.99 2ptq h ILE 279 Ca 0.12 -1.59 -0.06 0.00 1.00 0.00 0.00 64.86 64.33 2ptq h ILE 279 Cb 0.36 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 2ptq h ILE 279 CO 0.01 0.51 0.06 0.00 0.00 0.00 0.00 178.15 178.74 2ptq h ALA 280 N 0.95 1.19 0.00 1.87 0.00 -0.57 -1.56 119.26 121.13 2ptq h ALA 280 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2ptq h ALA 280 Cb 0.96 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2ptq h ALA 280 CO 0.09 0.54 0.00 1.28 0.00 0.00 0.00 179.25 181.16 2ptq n LEU 281 N -4.25 0.00 -0.97 0.00 4.77 -0.34 -4.91 117.00 111.30 2ptq n LEU 281 Ca 0.03 0.25 -0.09 0.00 -0.03 0.00 0.00 56.01 56.16 2ptq n LEU 281 Cb 0.26 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.09 2ptq n LEU 281 CO 0.40 -0.01 -0.11 -3.20 -1.33 0.00 0.00 177.39 173.14 2ptq n ASN 282 N -1.25 -3.41 0.13 -1.43 4.05 -0.59 -4.89 115.26 107.87 2ptq n ASN 282 Ca 0.15 0.05 0.12 0.00 0.45 0.00 0.00 54.58 55.35 2ptq n ASN 282 Cb 0.21 -2.46 0.23 0.00 1.23 0.00 0.00 39.78 38.99 2ptq n ASN 282 CO 0.00 0.00 0.00 0.45 -3.05 0.00 0.00 177.26 174.66 2ptq h HIS 283 N 0.00 0.00 -3.68 1.20 3.86 -1.12 -3.44 115.15 111.98 2ptq h HIS 283 Ca -0.21 0.00 -0.39 0.00 -1.16 0.00 0.00 60.37 58.61 2ptq h HIS 283 Cb 1.03 0.00 -0.32 0.00 1.06 0.00 0.00 27.41 29.18 2ptq h HIS 283 CO 0.25 0.00 -0.77 -0.06 0.86 0.00 0.00 177.93 178.21 2ptq s PHE 284 N -3.18 0.71 0.35 2.45 0.40 -1.22 -0.74 117.98 116.74 2ptq s PHE 284 Ca 0.07 -0.17 0.04 0.00 -0.60 0.00 0.00 56.93 56.27 2ptq s PHE 284 Cb 0.10 -0.56 -0.01 0.00 0.51 0.00 0.00 43.02 43.06 2ptq s PHE 284 CO 0.67 -0.11 0.51 0.21 0.70 0.00 0.00 175.22 177.20 2ptq s LYS 285 N 0.45 3.18 -0.11 0.44 2.47 0.24 -4.59 119.74 121.82 2ptq s LYS 285 Ca -0.06 -0.79 0.02 0.00 -1.56 0.00 0.00 55.97 53.58 2ptq s LYS 285 Cb -0.10 -2.76 -0.01 0.00 -1.46 0.00 0.00 37.83 33.51 2ptq s LYS 285 CO 0.00 0.05 -0.19 -0.65 0.16 0.00 0.00 175.35 174.72 2ptq s GLN 286 N -4.24 3.15 0.36 4.03 -0.21 -1.26 -1.32 119.66 120.16 2ptq s GLN 286 Ca 0.44 -0.80 -0.28 0.00 0.02 0.00 0.00 55.36 54.74 2ptq s GLN 286 Cb -0.10 -2.43 -0.11 0.00 1.00 0.00 0.00 33.01 31.37 2ptq s GLN 286 CO 0.33 0.22 1.46 0.21 -2.12 0.00 0.00 175.29 175.38 2ptq s LYS 287 N 0.29 4.16 0.01 2.91 2.20 0.65 -4.99 119.74 124.97 2ptq s LYS 287 Ca -0.14 2.50 0.06 0.00 -0.36 0.00 0.00 55.97 58.03 2ptq s LYS 287 Cb -0.17 -3.00 -0.03 0.00 -1.51 0.00 0.00 37.83 33.13 2ptq s LYS 287 CO 0.07 -0.47 -0.18 0.99 -0.36 0.00 0.00 175.35 175.40 2ptq s THR 288 N -1.01 2.81 -0.12 3.43 2.01 -1.26 -4.98 115.64 116.52 2ptq s THR 288 Ca 0.53 -1.05 -0.05 0.00 0.31 0.00 0.00 61.69 61.43 2ptq s THR 288 Cb -0.45 -2.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.87 2ptq s THR 288 CO 0.60 0.42 0.05 -0.63 -0.69 0.00 0.00 174.62 174.37 2ptq s ILE 289 N -0.85 4.73 0.12 1.82 1.01 -1.26 -5.07 121.20 121.70 2ptq s ILE 289 Ca 0.13 -0.08 -0.31 0.00 0.00 0.00 0.00 60.65 60.40 2ptq s ILE 289 Cb -0.10 -3.05 -0.08 0.00 0.01 0.00 0.00 42.46 39.23 2ptq s ILE 289 CO 0.04 0.57 1.43 0.00 0.00 0.00 0.00 174.94 176.97 2ptq s ALA 290 N -0.54 3.63 0.00 9.38 0.00 -1.26 -2.69 121.76 130.28 2ptq s ALA 290 Ca 0.10 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2ptq s ALA 290 Cb -0.12 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2ptq s ALA 290 CO 0.02 -0.66 0.00 0.41 0.00 0.00 0.00 175.76 175.53 2ptq n GLY 291 N 3.56 2.87 3.79 0.00 0.00 -1.26 -5.07 105.19 109.08 2ptq n GLY 291 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2ptq n GLY 291 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ptq s GLU 292 N -0.37 3.23 -0.19 1.61 2.02 -1.09 -5.05 118.70 118.85 2ptq s GLU 292 Ca 0.00 1.32 -0.01 0.00 0.02 0.00 0.00 54.97 56.30 2ptq s GLU 292 Cb 0.00 -2.01 0.00 0.00 0.10 0.00 0.00 34.13 32.22 2ptq s GLU 292 CO 0.00 -0.90 -0.12 0.42 0.02 0.00 0.00 175.26 174.68 2ptq s ILE 293 N -2.29 2.80 -0.14 -1.63 -1.09 -1.26 -5.00 121.20 112.59 2ptq s ILE 293 Ca 0.66 -0.70 -0.27 0.00 -2.23 0.00 0.00 60.65 58.10 2ptq s ILE 293 Cb -0.18 -2.22 -0.25 0.00 -1.58 0.00 0.00 42.46 38.23 2ptq s ILE 293 CO 0.35 0.49 0.74 1.23 -1.23 0.00 0.00 174.94 176.52 2ptq h GLY 294 N 7.77 -0.00 -4.78 6.18 0.00 -1.88 -3.47 103.07 106.89 2ptq h GLY 294 Ca -0.40 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.51 2ptq h GLY 294 CO 0.60 -0.00 -0.79 -0.45 0.00 0.00 0.00 176.54 175.90 2ptq s SER 295 N -6.18 1.55 0.39 0.19 0.15 -1.26 -4.82 113.70 103.72 2ptq s SER 295 Ca -0.18 -0.43 0.26 0.00 0.70 0.00 0.00 55.95 56.30 2ptq s SER 295 Cb -0.03 -0.10 0.76 0.00 -1.71 0.00 0.00 66.02 64.95 2ptq s SER 295 CO 0.65 0.03 1.75 0.77 1.20 0.00 0.00 173.24 177.64 2ptq h SER 296 N 5.01 0.00 0.00 5.45 4.64 -2.00 -3.37 113.55 123.28 2ptq h SER 296 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2ptq h SER 296 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2ptq h SER 296 CO 0.44 0.00 -0.73 1.07 -0.87 0.00 0.00 176.83 176.75 2ptq n THR 297 N -2.79 0.00 -3.60 2.95 5.66 -1.26 -4.93 114.28 110.30 2ptq n THR 297 Ca 0.03 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.64 2ptq n THR 297 Cb 0.42 -0.23 -0.08 0.00 -1.55 0.00 0.00 70.33 68.89 2ptq n THR 297 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 175.07 171.98 2ptq s MET 298 N -1.60 2.71 0.47 1.09 -1.94 -1.26 -4.97 119.30 113.80 2ptq s MET 298 Ca 0.00 -2.28 0.27 0.00 -1.71 0.00 0.00 55.69 51.98 2ptq s MET 298 Cb 0.00 -3.91 1.33 0.00 2.01 0.00 0.00 34.83 34.26 2ptq s MET 298 CO 0.00 -1.19 1.79 -1.35 -0.01 0.00 0.00 175.02 174.26 2ptq h PRO 299 N 7.61 0.18 0.00 2.03 0.11 -1.92 -2.43 132.00 137.58 2ptq h PRO 299 Ca -0.05 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 2ptq h PRO 299 Cb 1.01 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.07 2ptq h PRO 299 CO 0.76 0.12 -0.05 1.12 -0.21 0.00 0.00 178.00 179.74 2ptq h HIS 300 N 0.19 0.00 -3.03 0.65 2.07 -1.94 -3.46 115.15 109.64 2ptq h HIS 300 Ca 0.57 0.00 -0.56 0.00 -2.85 0.00 0.00 60.37 57.53 2ptq h HIS 300 Cb 1.86 0.00 0.09 0.00 2.57 0.00 0.00 27.41 31.93 2ptq h HIS 300 CO -0.00 0.05 0.70 1.63 -3.07 0.00 0.00 177.93 177.24 2ptq n LYS 301 N -3.13 2.31 -3.66 5.12 4.76 -0.91 -5.01 118.16 117.64 2ptq n LYS 301 Ca 0.02 0.82 -0.27 0.00 -2.87 0.00 0.00 58.31 56.01 2ptq n LYS 301 Cb 0.43 -2.52 -0.16 0.00 -1.84 0.00 0.00 35.03 30.94 2ptq n LYS 301 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2ptq s VAL 302 N -0.22 0.20 0.08 -0.18 1.01 -1.26 -3.93 120.40 116.10 2ptq s VAL 302 Ca 0.64 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 62.22 2ptq s VAL 302 Cb -0.58 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 2ptq s VAL 302 CO 0.51 -0.33 -0.03 0.20 0.00 0.00 0.00 175.10 175.46 2ptq s ASN 303 N 2.00 4.84 -1.04 3.32 0.01 -1.26 -5.02 114.94 117.78 2ptq s ASN 303 Ca 0.02 -0.22 -0.08 0.00 -0.71 0.00 0.00 52.86 51.87 2ptq s ASN 303 Cb -0.16 -1.10 -0.10 0.00 0.41 0.00 0.00 41.25 40.29 2ptq s ASN 303 CO -0.13 0.19 3.07 -0.81 -1.51 0.00 0.00 177.10 177.91 2ptq n PRO 304 N 0.73 3.25 0.28 -0.60 -0.04 -1.26 -4.68 135.00 132.68 2ptq n PRO 304 Ca -0.12 -2.03 0.12 0.00 -0.04 0.00 0.00 63.50 61.43 2ptq n PRO 304 Cb 0.52 -2.50 0.80 0.00 -0.04 0.00 0.00 33.50 32.28 2ptq n PRO 304 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 2ptq h ILE 305 N 2.59 0.70 -0.31 0.52 3.07 -1.99 -2.60 117.51 119.49 2ptq h ILE 305 Ca 0.63 -0.06 -0.10 0.00 1.55 0.00 0.00 64.86 66.87 2ptq h ILE 305 Cb 0.67 1.04 -0.01 0.00 -0.27 0.00 0.00 36.82 38.25 2ptq h ILE 305 CO 1.24 0.02 -0.19 0.44 -1.05 0.00 0.00 178.15 178.61 2ptq h ASP 306 N 0.00 0.70 -0.12 2.16 3.32 -1.86 0.26 116.42 120.89 2ptq h ASP 306 Ca -0.00 -0.43 -0.11 0.00 0.02 0.00 0.00 57.03 56.51 2ptq h ASP 306 Cb 0.04 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 2ptq h ASP 306 CO 0.00 0.97 -0.28 -0.26 -1.72 0.00 0.00 179.24 177.96 2ptq h PHE 307 N 0.43 0.66 -0.36 4.55 -1.00 -1.69 -1.93 116.94 117.59 2ptq h PHE 307 Ca 0.06 -0.16 -0.13 0.00 2.81 0.00 0.00 57.97 60.56 2ptq h PHE 307 Cb 0.73 -0.16 -0.01 0.00 3.61 0.00 0.00 35.95 40.13 2ptq h PHE 307 CO 0.06 0.80 -0.29 0.93 -1.61 0.00 0.00 178.31 178.21 2ptq h GLU 308 N 0.50 0.84 -0.40 1.51 5.08 -1.35 -0.78 114.58 119.97 2ptq h GLU 308 Ca 0.07 -0.41 -0.01 0.00 -1.00 0.00 0.00 59.36 58.01 2ptq h GLU 308 Cb 0.74 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 2ptq h GLU 308 CO 0.06 1.05 0.22 -0.97 -1.00 0.00 0.00 179.01 178.37 2ptq h ASN 309 N 0.63 0.50 -0.50 1.42 -0.73 -0.82 -1.37 115.58 114.71 2ptq h ASN 309 Ca 0.07 -0.08 -0.01 0.00 1.87 0.00 0.00 56.30 58.14 2ptq h ASN 309 Cb 0.86 -0.13 -0.02 0.00 0.27 0.00 0.00 38.32 39.30 2ptq h ASN 309 CO 0.08 0.44 0.28 -1.28 -0.37 0.00 0.00 177.43 176.58 2ptq h SER 310 N 0.52 0.62 -0.58 1.15 0.87 -1.26 -1.85 113.55 113.03 2ptq h SER 310 Ca 0.14 -0.08 0.01 0.00 -1.23 0.00 0.00 61.79 60.63 2ptq h SER 310 Cb 0.05 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.82 2ptq h SER 310 CO -0.02 0.53 0.37 -0.08 -0.53 0.00 0.00 176.83 177.10 2ptq h GLU 311 N 0.67 0.73 -0.43 2.24 4.81 -0.80 -0.67 114.58 121.14 2ptq h GLU 311 Ca 0.18 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.33 2ptq h GLU 311 Cb 0.04 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 2ptq h GLU 311 CO -0.03 0.49 0.13 0.78 -0.73 0.00 0.00 179.01 179.65 2ptq h GLY 312 N 0.76 0.71 2.00 1.92 0.00 -1.03 -2.85 103.07 104.58 2ptq h GLY 312 Ca 0.22 -0.42 -0.07 0.00 0.00 0.00 0.00 47.33 47.05 2ptq h GLY 312 CO -0.06 0.40 -0.34 3.43 0.00 0.00 0.00 176.54 179.96 2ptq h ASN 313 N 0.55 0.00 -0.01 0.19 2.35 -1.08 -2.79 115.58 114.80 2ptq h ASN 313 Ca 0.14 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.75 2ptq h ASN 313 Cb 0.26 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 2ptq h ASN 313 CO -0.00 0.34 -0.45 -0.07 -1.65 0.00 0.00 177.43 175.60 2ptq h LEU 314 N 0.00 0.59 -0.56 1.61 3.38 -0.98 0.15 115.31 119.49 2ptq h LEU 314 Ca -0.00 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 2ptq h LEU 314 Cb 0.79 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 2ptq h LEU 314 CO 0.04 0.95 0.07 1.23 0.09 0.00 0.00 178.44 180.83 2ptq h GLY 315 N 1.07 1.02 0.93 0.83 0.00 -1.27 -1.32 103.07 104.32 2ptq h GLY 315 Ca 0.03 -0.70 -0.05 0.00 0.00 0.00 0.00 47.33 46.61 2ptq h GLY 315 CO 0.09 0.65 0.03 1.41 0.00 0.00 0.00 176.54 178.71 2ptq h LEU 316 N 0.84 0.62 -0.07 3.11 3.38 -1.31 -2.13 115.31 119.74 2ptq h LEU 316 Ca 0.17 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.89 2ptq h LEU 316 Cb 0.44 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2ptq h LEU 316 CO 0.02 0.75 -0.15 -1.28 0.09 0.00 0.00 178.44 177.87 2ptq h SER 317 N 0.46 -0.45 -0.15 -0.43 0.87 -0.76 -2.16 113.55 110.93 2ptq h SER 317 Ca 0.11 0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 2ptq h SER 317 Cb 0.42 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.57 2ptq h SER 317 CO 0.01 -0.20 0.01 0.78 -0.53 0.00 0.00 176.83 176.91 2ptq h ASN 318 N -0.21 0.32 -0.52 6.23 4.21 -1.16 0.22 115.58 124.67 2ptq h ASN 318 Ca 0.07 -0.04 -0.05 0.00 1.21 0.00 0.00 56.30 57.49 2ptq h ASN 318 Cb 0.32 -0.08 -0.02 0.00 -1.12 0.00 0.00 38.32 37.41 2ptq h ASN 318 CO -0.20 0.37 0.13 0.00 -1.29 0.00 0.00 177.43 176.45 2ptq h ALA 319 N 1.67 0.68 -0.04 -0.83 0.00 -0.86 0.10 119.26 119.99 2ptq h ALA 319 Ca 0.08 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2ptq h ALA 319 Cb 0.22 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2ptq h ALA 319 CO 0.00 0.37 -0.20 0.28 0.00 0.00 0.00 179.25 179.71 2ptq h VAL 320 N 0.72 1.47 -0.68 0.00 2.07 -0.95 -2.51 116.25 116.37 2ptq h VAL 320 Ca 0.16 -1.69 0.05 0.00 0.82 0.00 0.00 66.70 66.04 2ptq h VAL 320 Cb 0.32 2.47 -0.05 0.00 -1.52 0.00 0.00 31.29 32.51 2ptq h VAL 320 CO 0.00 0.47 0.40 -0.07 0.02 0.00 0.00 177.57 178.39 2ptq h LEU 321 N -0.37 0.62 -0.59 2.57 3.38 -0.95 -1.72 115.31 118.25 2ptq h LEU 321 Ca -0.01 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2ptq h LEU 321 Cb 0.87 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 2ptq h LEU 321 CO 0.04 0.41 0.20 -0.61 0.09 0.00 0.00 178.44 178.57 2ptq h GLN 322 N 0.75 0.90 -0.23 1.13 5.75 -1.03 -0.10 115.11 122.29 2ptq h GLN 322 Ca 0.29 -0.19 -0.00 0.00 -0.15 0.00 0.00 58.65 58.60 2ptq h GLN 322 Cb 0.13 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 2ptq h GLN 322 CO -0.15 0.80 0.12 1.25 -2.65 0.00 0.00 178.83 178.20 2ptq h HIS 323 N 0.82 0.31 -0.61 3.99 2.76 -0.99 -1.62 115.15 119.82 2ptq h HIS 323 Ca 0.19 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 2ptq h HIS 323 Cb 0.26 -0.10 -0.03 0.00 1.55 0.00 0.00 27.41 29.09 2ptq h HIS 323 CO 0.02 0.28 0.25 -0.07 -1.30 0.00 0.00 177.93 177.11 2ptq h LEU 324 N 0.26 0.83 -0.75 0.26 4.07 -1.18 0.26 115.31 119.06 2ptq h LEU 324 Ca 0.08 -0.16 0.00 0.00 0.08 0.00 0.00 57.88 57.88 2ptq h LEU 324 Cb 0.07 -0.22 -0.04 0.00 1.08 0.00 0.00 40.66 41.56 2ptq h LEU 324 CO -0.01 0.77 0.49 0.00 -1.08 0.00 0.00 178.44 178.60 2ptq h ALA 325 N 1.10 0.95 0.00 1.53 0.00 -0.79 -1.48 119.26 120.58 2ptq h ALA 325 Ca 0.20 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 2ptq h ALA 325 Cb 0.19 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2ptq h ALA 325 CO -0.02 0.39 -1.13 0.66 0.00 0.00 0.00 179.25 179.15 2ptq h SER 326 N 1.02 0.00 0.14 0.00 4.64 -1.17 -3.40 113.55 114.78 2ptq h SER 326 Ca 0.27 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.23 2ptq h SER 326 Cb -0.09 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 61.97 2ptq h SER 326 CO -0.06 0.65 -2.03 1.17 -0.87 0.00 0.00 176.83 175.69 2ptq n LYS 327 N -3.05 0.74 -0.16 4.77 0.00 0.07 -4.53 118.16 115.99 2ptq n LYS 327 Ca -0.06 0.25 -0.03 0.00 0.00 0.00 0.00 58.31 58.47 2ptq n LYS 327 Cb 0.84 -1.70 0.06 0.00 0.00 0.00 0.00 35.03 34.24 2ptq n LYS 327 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2ptq h LEU 328 N 0.06 0.19 0.00 3.14 3.38 -1.46 -2.75 115.31 117.87 2ptq h LEU 328 Ca -0.43 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2ptq h LEU 328 Cb 2.02 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.81 2ptq h LEU 328 CO 0.07 0.14 0.00 -2.65 0.09 0.00 0.00 178.44 176.09 2ptq n PRO 329 N -5.00 0.30 -3.88 1.13 -0.02 -1.26 -4.50 135.00 121.78 2ptq n PRO 329 Ca 0.05 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 61.18 2ptq n PRO 329 Cb 0.19 -1.47 -0.14 0.00 -0.02 0.00 0.00 33.50 32.06 2ptq n PRO 329 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ptq s VAL 330 N -2.00 3.40 -0.09 -1.45 1.01 -1.04 -4.98 120.40 115.25 2ptq s VAL 330 Ca 0.14 -0.65 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 2ptq s VAL 330 Cb 0.06 -2.64 0.05 0.00 0.00 0.00 0.00 36.38 33.85 2ptq s VAL 330 CO 0.10 0.30 0.19 -0.55 0.00 0.00 0.00 175.10 175.14 2ptq s SER 331 N 1.45 0.11 0.03 3.32 0.15 -1.26 -4.97 113.70 112.53 2ptq s SER 331 Ca 0.04 0.39 -0.34 0.00 0.70 0.00 0.00 55.95 56.74 2ptq s SER 331 Cb -0.15 0.32 -0.12 0.00 -1.71 0.00 0.00 66.02 64.35 2ptq s SER 331 CO -0.02 -0.19 1.76 0.54 1.20 0.00 0.00 173.24 176.53 2ptq n ARG 332 N 4.61 2.25 0.00 5.44 1.74 -1.26 -4.37 116.66 125.06 2ptq n ARG 332 Ca -0.19 0.82 0.00 0.00 -0.77 0.00 0.00 57.85 57.71 2ptq n ARG 332 Cb 0.51 -2.64 0.00 0.00 -1.02 0.00 0.00 32.46 29.31 2ptq n ARG 332 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2ptq n TRP 333 N 5.29 0.00 1.53 -1.55 8.01 -1.26 0.18 117.44 129.63 2ptq n TRP 333 Ca 0.20 0.00 0.07 0.00 -1.31 0.00 0.00 57.50 56.46 2ptq n TRP 333 Cb 0.30 0.00 0.40 0.00 -2.01 0.00 0.00 31.31 30.00 2ptq n TRP 333 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.69 177.72 2ptq n GLN 334 N 14.00 0.76 0.00 -0.99 3.00 -1.26 -4.88 117.38 128.01 2ptq n GLN 334 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2ptq n GLN 334 Cb 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 30.24 28.97 2ptq n GLN 334 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95 2ptq n ARG 335 N -0.77 0.00 -4.27 -1.09 -4.01 0.13 -2.68 116.66 103.96 2ptq n ARG 335 Ca 0.10 0.00 -0.24 0.00 -1.04 0.00 0.00 57.85 56.67 2ptq n ARG 335 Cb 0.05 0.00 -0.07 0.00 -3.04 0.00 0.00 32.46 29.39 2ptq n ARG 335 CO 0.00 0.00 0.00 0.16 -3.04 0.00 0.00 177.63 174.75 2ptq s ASP 336 N 0.00 4.60 0.00 2.89 3.84 -1.21 -4.71 116.67 122.07 2ptq s ASP 336 Ca 0.00 -0.58 0.11 0.00 -0.00 0.00 0.00 52.55 52.08 2ptq s ASP 336 Cb 0.00 -0.89 0.54 0.00 -1.38 0.00 0.00 42.92 41.20 2ptq s ASP 336 CO 0.00 0.02 1.37 -0.11 -0.00 0.00 0.00 175.17 176.45 2ptq n LEU 337 N -0.69 0.59 0.31 2.11 7.94 -1.26 -4.21 117.00 121.79 2ptq n LEU 337 Ca -0.07 -0.27 0.19 0.00 -1.11 0.00 0.00 56.01 54.74 2ptq n LEU 337 Cb 0.58 -0.06 1.00 0.00 0.53 0.00 0.00 43.42 45.47 2ptq n LEU 337 CO 0.40 0.14 1.11 0.71 -1.11 0.00 0.00 177.39 178.63 2ptq h THR 338 N 0.72 0.19 0.00 1.96 1.35 -1.97 -2.47 112.91 112.69 2ptq h THR 338 Ca 0.00 -0.18 -0.06 0.00 -0.55 0.00 0.00 66.41 65.61 2ptq h THR 338 Cb 0.16 1.15 -0.01 0.00 -1.73 0.00 0.00 68.15 67.72 2ptq h THR 338 CO 0.00 0.02 -0.31 -2.24 -0.25 0.00 0.00 175.52 172.74 2ptq h ASP 339 N 0.00 0.00 0.50 5.36 -0.00 -1.94 -3.25 116.42 117.08 2ptq h ASP 339 Ca -0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.03 57.01 2ptq h ASP 339 Cb 0.15 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.47 2ptq h ASP 339 CO 0.00 0.31 -0.30 -1.28 -0.00 0.00 0.00 179.24 177.97 2ptq h SER 340 N 0.00 -0.76 -0.71 4.15 0.87 -1.77 0.20 113.55 115.54 2ptq h SER 340 Ca -0.00 0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.56 2ptq h SER 340 Cb 1.05 0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 63.20 2ptq h SER 340 CO 0.04 -0.48 0.30 0.00 -0.53 0.00 0.00 176.83 176.15 2ptq h THR 341 N -0.77 1.24 -0.67 2.23 1.03 -1.74 -2.67 112.91 111.58 2ptq h THR 341 Ca -0.06 -0.76 -0.03 0.00 -0.01 0.00 0.00 66.41 65.56 2ptq h THR 341 Cb 0.62 0.37 -0.03 0.00 -1.07 0.00 0.00 68.15 68.04 2ptq h THR 341 CO 0.06 0.31 0.30 0.58 -0.01 0.00 0.00 175.52 176.76 2ptq h VAL 342 N 1.05 1.23 0.00 0.00 2.07 -1.54 -2.40 116.25 116.66 2ptq h VAL 342 Ca 0.24 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2ptq h VAL 342 Cb 0.19 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2ptq h VAL 342 CO -0.02 0.27 0.00 0.18 0.02 0.00 0.00 177.57 178.02 2ptq n LEU 343 N -4.45 0.00 -0.20 2.57 4.77 0.69 -0.69 117.00 119.68 2ptq n LEU 343 Ca 0.05 0.37 0.15 0.00 -0.03 0.00 0.00 56.01 56.55 2ptq n LEU 343 Cb 0.14 -0.37 0.75 0.00 -2.33 0.00 0.00 43.42 41.61 2ptq n LEU 343 CO 0.39 -0.26 1.00 0.54 -1.33 0.00 0.00 177.39 177.72 2ptq n ARG 344 N -1.37 1.28 -0.25 3.23 1.74 -0.90 -3.39 116.66 117.00 2ptq n ARG 344 Ca 0.03 -0.41 0.06 0.00 -0.77 0.00 0.00 57.85 56.77 2ptq n ARG 344 Cb 0.08 -1.48 0.18 0.00 -1.02 0.00 0.00 32.46 30.22 2ptq n ARG 344 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2ptq n ASN 345 N -0.49 3.19 -0.15 0.55 3.02 0.13 -4.61 115.26 116.90 2ptq n ASN 345 Ca 0.21 -2.28 0.03 0.00 -0.03 0.00 0.00 54.58 52.51 2ptq n ASN 345 Cb 0.21 -0.32 0.32 0.00 -0.61 0.00 0.00 39.78 39.39 2ptq n ASN 345 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2ptq h LEU 346 N 1.95 0.71 -0.17 3.41 3.38 -1.70 -2.33 115.31 120.55 2ptq h LEU 346 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2ptq h LEU 346 Cb 0.93 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.51 2ptq h LEU 346 CO 0.06 0.50 0.00 1.23 0.09 0.00 0.00 178.44 180.32 2ptq h GLY 347 N 0.83 0.00 0.65 0.83 0.00 -1.86 -3.26 103.07 100.26 2ptq h GLY 347 Ca 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.57 2ptq h GLY 347 CO -0.06 0.00 -0.07 -2.08 0.00 0.00 0.00 176.54 174.33 2ptq h VAL 348 N 0.00 1.01 -0.87 4.60 2.07 -1.73 0.46 116.25 121.79 2ptq h VAL 348 Ca 0.00 -0.72 -0.02 0.00 0.82 0.00 0.00 66.70 66.78 2ptq h VAL 348 Cb 0.90 1.45 -0.04 0.00 -1.52 0.00 0.00 31.29 32.08 2ptq h VAL 348 CO 0.00 0.17 0.47 1.23 0.02 0.00 0.00 177.57 179.46 2ptq h GLY 349 N -0.54 1.31 1.08 2.17 0.00 -1.66 -2.24 103.07 103.19 2ptq h GLY 349 Ca -0.02 -0.60 -0.12 0.00 0.00 0.00 0.00 47.33 46.59 2ptq h GLY 349 CO 0.03 0.58 -0.15 -2.22 0.00 0.00 0.00 176.54 174.78 2ptq h ILE 350 N 1.22 1.27 -0.43 2.60 2.04 -1.58 -3.12 117.51 119.51 2ptq h ILE 350 Ca 0.31 -1.30 0.02 0.00 1.00 0.00 0.00 64.86 64.88 2ptq h ILE 350 Cb 0.04 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 2ptq h ILE 350 CO -0.05 0.45 0.26 1.23 0.00 0.00 0.00 178.15 180.04 2ptq h GLY 351 N 0.84 0.60 0.87 5.37 0.00 0.44 -0.92 103.07 110.27 2ptq h GLY 351 Ca 0.12 -0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.30 2ptq h GLY 351 CO 0.05 0.17 0.64 -0.97 0.00 0.00 0.00 176.54 176.44 2ptq h TYR 352 N 0.52 1.21 -0.29 5.60 0.05 -1.44 -1.73 116.97 120.88 2ptq h TYR 352 Ca 0.17 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.96 2ptq h TYR 352 Cb 0.01 -0.40 -0.01 0.00 1.01 0.00 0.00 36.73 37.33 2ptq h TYR 352 CO -0.07 0.69 0.12 0.00 -1.05 0.00 0.00 178.16 177.85 2ptq h ALA 353 N 1.41 0.38 -0.89 3.88 0.00 -1.35 -2.02 119.26 120.66 2ptq h ALA 353 Ca 0.39 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 2ptq h ALA 353 Cb 0.01 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2ptq h ALA 353 CO -0.13 -0.03 0.53 -0.07 0.00 0.00 0.00 179.25 179.55 2ptq h LEU 354 N 0.32 1.08 -0.69 0.00 3.38 -0.75 0.73 115.31 119.38 2ptq h LEU 354 Ca 0.10 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2ptq h LEU 354 Cb 0.18 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2ptq h LEU 354 CO -0.01 0.84 0.42 0.40 0.09 0.00 0.00 178.44 180.19 2ptq h ILE 355 N 1.23 1.20 -0.51 1.22 2.04 -1.16 -2.04 117.51 119.49 2ptq h ILE 355 Ca 0.32 -0.42 -0.12 0.00 1.00 0.00 0.00 64.86 65.63 2ptq h ILE 355 Cb -0.03 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 2ptq h ILE 355 CO -0.06 0.20 -0.15 0.00 0.00 0.00 0.00 178.15 178.14 2ptq h ALA 356 N 1.22 0.76 -0.62 1.87 0.00 -0.69 -1.79 119.26 120.02 2ptq h ALA 356 Ca 0.25 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2ptq h ALA 356 Cb -0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2ptq h ALA 356 CO -0.05 0.67 0.38 1.88 0.00 0.00 0.00 179.25 182.13 2ptq h TYR 357 N 0.87 0.81 -0.53 0.00 0.05 -0.50 -0.49 116.97 117.17 2ptq h TYR 357 Ca 0.13 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.80 2ptq h TYR 357 Cb 0.72 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 38.18 2ptq h TYR 357 CO 0.05 0.54 -0.10 1.96 -1.05 0.00 0.00 178.16 179.57 2ptq h GLN 358 N 0.83 1.00 -0.56 4.88 4.20 -1.28 -2.02 115.11 122.15 2ptq h GLN 358 Ca 0.22 -0.37 -0.03 0.00 0.06 0.00 0.00 58.65 58.54 2ptq h GLN 358 Cb -0.03 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 2ptq h GLN 358 CO -0.04 1.05 0.25 0.77 -0.67 0.00 0.00 178.83 180.18 2ptq h SER 359 N 0.87 0.75 -0.46 1.46 0.02 -0.94 -0.24 113.55 115.01 2ptq h SER 359 Ca 0.14 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 2ptq h SER 359 Cb 0.66 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 2ptq h SER 359 CO 0.05 0.69 0.26 0.74 -1.14 0.00 0.00 176.83 177.43 2ptq h THR 360 N 0.76 1.16 -0.95 -2.27 2.02 -0.99 0.12 112.91 112.76 2ptq h THR 360 Ca 0.19 -0.40 0.01 0.00 0.77 0.00 0.00 66.41 66.98 2ptq h THR 360 Cb 0.16 0.59 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 2ptq h THR 360 CO -0.02 0.17 0.62 -0.07 0.37 0.00 0.00 175.52 176.59 2ptq h LEU 361 N 0.61 1.10 -0.52 2.58 3.38 -1.09 0.11 115.31 121.48 2ptq h LEU 361 Ca 0.16 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 2ptq h LEU 361 Cb 0.04 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2ptq h LEU 361 CO -0.03 0.81 0.17 0.50 0.09 0.00 0.00 178.44 179.98 2ptq h LYS 362 N 1.29 0.79 -0.55 1.13 3.64 -0.40 -1.93 116.57 120.54 2ptq h LYS 362 Ca 0.35 -0.17 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2ptq h LYS 362 Cb -0.13 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.55 2ptq h LYS 362 CO -0.07 0.73 0.18 0.78 -2.27 0.00 0.00 179.45 178.79 2ptq h GLY 363 N 0.70 0.91 0.84 5.01 0.00 -0.03 -2.80 103.07 107.70 2ptq h GLY 363 Ca 0.17 -0.53 0.04 0.00 0.00 0.00 0.00 47.33 47.01 2ptq h GLY 363 CO -0.01 0.50 0.66 -2.08 0.00 0.00 0.00 176.54 175.61 2ptq h VAL 364 N 0.76 1.15 0.00 4.60 2.07 -0.57 -1.39 116.25 122.87 2ptq h VAL 364 Ca 0.18 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2ptq h VAL 364 Cb 0.27 -0.21 0.00 0.00 -1.52 0.00 0.00 31.29 29.83 2ptq h VAL 364 CO -0.01 0.23 0.00 0.77 0.02 0.00 0.00 177.57 178.58 2ptq h SER 365 N 1.25 0.00 -0.09 0.57 4.64 -1.08 -2.24 113.55 116.61 2ptq h SER 365 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 2ptq h SER 365 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 2ptq h SER 365 CO -0.14 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.11 2ptq n LYS 366 N -2.39 2.16 -2.34 4.77 5.02 -0.53 -4.94 118.16 119.91 2ptq n LYS 366 Ca -0.00 -1.90 -0.41 0.00 -2.02 0.00 0.00 58.31 53.98 2ptq n LYS 366 Cb 0.13 -1.44 -0.03 0.00 -0.02 0.00 0.00 35.03 33.66 2ptq n LYS 366 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2ptq s LEU 367 N -1.79 4.44 -0.28 -0.35 1.43 -0.85 -0.26 118.68 121.04 2ptq s LEU 367 Ca 0.28 2.27 -0.03 0.00 -1.03 0.00 0.00 54.13 55.62 2ptq s LEU 367 Cb 0.19 -3.61 0.09 0.00 0.03 0.00 0.00 46.19 42.89 2ptq s LEU 367 CO 0.28 -0.40 0.10 -1.61 0.23 0.00 0.00 176.35 174.96 2ptq s GLU 368 N -0.27 0.43 0.41 1.70 2.02 -0.44 -4.88 118.70 117.67 2ptq s GLU 368 Ca 0.53 -0.68 -0.27 0.00 0.02 0.00 0.00 54.97 54.58 2ptq s GLU 368 Cb -0.33 -1.63 -0.10 0.00 0.10 0.00 0.00 34.13 32.16 2ptq s GLU 368 CO 0.37 -0.93 1.40 1.55 0.02 0.00 0.00 175.26 177.67 2ptq n VAL 369 N 5.08 2.38 -3.68 2.63 3.14 -1.26 0.79 118.33 127.42 2ptq n VAL 369 Ca -0.05 -0.50 -0.35 0.00 -2.96 0.00 0.00 64.34 60.48 2ptq n VAL 369 Cb 0.43 -1.80 -0.07 0.00 -1.06 0.00 0.00 33.84 31.34 2ptq n VAL 369 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 2ptq s ASN 370 N -0.35 5.78 0.24 6.55 3.04 0.08 -4.76 114.94 125.53 2ptq s ASN 370 Ca 0.58 -3.66 -0.06 0.00 0.04 0.00 0.00 52.86 49.76 2ptq s ASN 370 Cb -0.48 -1.87 0.32 0.00 -1.54 0.00 0.00 41.25 37.68 2ptq s ASN 370 CO 0.60 -0.19 1.84 0.03 -3.04 0.00 0.00 177.10 176.34 2ptq h ARG 371 N 6.03 0.87 -0.32 0.43 3.08 -1.93 -2.02 114.38 120.53 2ptq h ARG 371 Ca 0.14 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 60.20 2ptq h ARG 371 Cb 0.82 -0.20 -0.07 0.00 0.08 0.00 0.00 29.97 30.61 2ptq h ARG 371 CO 0.82 0.58 -0.11 -0.44 -1.07 0.00 0.00 179.97 179.75 2ptq h ASP 372 N 0.90 -0.40 -0.12 7.04 3.32 -1.97 0.11 116.42 125.29 2ptq h ASP 372 Ca 0.36 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.50 2ptq h ASP 372 Cb 0.19 0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.98 2ptq h ASP 372 CO -0.18 -0.15 0.01 -0.74 -1.72 0.00 0.00 179.24 176.46 2ptq h HIS 373 N -0.05 0.22 -0.52 4.55 2.76 -1.80 -0.34 115.15 119.97 2ptq h HIS 373 Ca 0.16 -0.03 0.10 0.00 -2.20 0.00 0.00 60.37 58.39 2ptq h HIS 373 Cb 0.29 -0.06 -0.08 0.00 1.55 0.00 0.00 27.41 29.11 2ptq h HIS 373 CO -0.33 0.42 0.05 -0.07 -1.30 0.00 0.00 177.93 176.70 2ptq h LEU 374 N -0.04 -0.12 -0.34 0.26 3.38 -0.94 0.09 115.31 117.60 2ptq h LEU 374 Ca 0.04 0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.97 2ptq h LEU 374 Cb 0.32 0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 2ptq h LEU 374 CO 0.00 -0.04 -0.37 -0.07 0.09 0.00 0.00 178.44 178.06 2ptq h LEU 375 N 0.17 0.91 -0.79 1.67 3.38 -0.74 -2.63 115.31 117.28 2ptq h LEU 375 Ca 0.27 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2ptq h LEU 375 Cb 0.39 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2ptq h LEU 375 CO -0.40 1.21 0.50 -0.78 0.09 0.00 0.00 178.44 179.06 2ptq h ASP 376 N 0.64 0.92 -0.24 -0.43 -0.00 -0.48 -1.25 116.42 115.58 2ptq h ASP 376 Ca 0.05 -0.04 -0.01 0.00 -0.00 0.00 0.00 57.03 57.03 2ptq h ASP 376 Cb 0.96 -0.23 -0.01 0.00 -0.00 0.00 0.00 39.33 40.05 2ptq h ASP 376 CO 0.09 0.69 0.11 -0.08 -0.00 0.00 0.00 179.24 180.04 2ptq h GLU 377 N 1.07 0.35 -0.95 0.28 4.81 -0.96 -2.62 114.58 116.57 2ptq h GLU 377 Ca 0.29 -0.06 0.07 0.00 -0.13 0.00 0.00 59.36 59.53 2ptq h GLU 377 Cb -0.09 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.16 2ptq h GLU 377 CO -0.06 0.37 0.62 -0.07 -0.73 0.00 0.00 179.01 179.14 2ptq h LEU 378 N 0.24 0.95 0.00 1.64 3.38 -1.10 -0.34 115.31 120.09 2ptq h LEU 378 Ca 0.08 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2ptq h LEU 378 Cb 0.15 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2ptq h LEU 378 CO -0.01 0.60 0.00 -0.67 0.09 0.00 0.00 178.44 178.45 2ptq n ASP 379 N -4.51 0.00 -0.80 -0.43 2.03 -0.51 -1.41 116.55 110.93 2ptq n ASP 379 Ca 0.15 0.15 0.08 0.00 0.52 0.00 0.00 54.79 55.69 2ptq n ASP 379 Cb 0.21 -0.32 0.16 0.00 -0.72 0.00 0.00 41.12 40.46 2ptq n ASP 379 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2ptq n HIS 380 N -1.32 0.42 -3.01 -0.67 8.25 -0.15 -4.65 115.22 114.10 2ptq n HIS 380 Ca 0.06 -0.32 -0.22 0.00 -0.26 0.00 0.00 57.72 56.98 2ptq n HIS 380 Cb 0.12 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.19 2ptq n HIS 380 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2ptq n ASN 381 N 0.91 2.73 0.00 0.41 3.02 -0.50 -4.87 115.26 116.96 2ptq n ASN 381 Ca 0.14 -3.34 0.08 0.00 -0.03 0.00 0.00 54.58 51.43 2ptq n ASN 381 Cb 0.46 -0.58 0.35 0.00 -0.61 0.00 0.00 39.78 39.40 2ptq n ASN 381 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2ptq n TRP 382 N -0.02 0.00 0.30 3.10 7.02 -1.26 -2.82 117.44 123.76 2ptq n TRP 382 Ca 0.28 0.00 0.19 0.00 -1.02 0.00 0.00 57.50 56.95 2ptq n TRP 382 Cb 0.55 -0.48 0.90 0.00 -2.42 0.00 0.00 31.31 29.86 2ptq n TRP 382 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 2ptq h GLU 383 N 0.00 0.00 0.00 -0.99 3.07 -1.90 -2.23 114.58 112.53 2ptq h GLU 383 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2ptq h GLU 383 Cb 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 2ptq h GLU 383 CO 0.00 0.02 0.00 1.33 -1.40 0.00 0.00 179.01 178.96 2ptq n VAL 384 N -3.15 1.15 1.57 3.13 0.24 -1.13 -1.41 118.33 118.73 2ptq n VAL 384 Ca -0.01 0.29 0.15 0.00 -2.04 0.00 0.00 64.34 62.72 2ptq n VAL 384 Cb 0.21 -1.10 0.67 0.00 -1.47 0.00 0.00 33.84 32.15 2ptq n VAL 384 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2ptq n LEU 385 N -1.47 0.58 -0.10 1.34 4.77 -0.84 -3.72 117.00 117.56 2ptq n LEU 385 Ca 0.03 -0.10 -0.02 0.00 -0.03 0.00 0.00 56.01 55.89 2ptq n LEU 385 Cb 0.12 -0.10 0.23 0.00 -2.33 0.00 0.00 43.42 41.35 2ptq n LEU 385 CO 0.10 0.10 0.99 0.00 -1.33 0.00 0.00 177.39 177.26 2ptq h ALA 386 N 3.86 1.29 0.74 -1.18 0.00 -1.44 -2.47 119.26 120.06 2ptq h ALA 386 Ca 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 2ptq h ALA 386 Cb 0.30 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.90 2ptq h ALA 386 CO 0.00 0.50 -0.35 1.49 0.00 0.00 0.00 179.25 180.89 2ptq h GLU 387 N 0.73 -0.95 -0.95 0.00 4.81 -1.80 -2.06 114.58 114.36 2ptq h GLU 387 Ca 0.17 0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.48 2ptq h GLU 387 Cb 0.26 0.22 -0.05 0.00 0.63 0.00 0.00 28.75 29.80 2ptq h GLU 387 CO -0.00 -0.62 0.63 -1.00 -0.73 0.00 0.00 179.01 177.29 2ptq h PRO 388 N -1.06 1.21 -0.15 0.92 0.13 -1.78 -1.13 132.00 130.15 2ptq h PRO 388 Ca -0.10 -0.07 0.01 0.00 -0.87 0.00 0.00 66.00 64.96 2ptq h PRO 388 Cb 0.77 -0.27 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 2ptq h PRO 388 CO 0.17 0.80 0.07 0.82 -0.23 0.00 0.00 178.00 179.63 2ptq h ILE 389 N 1.25 0.99 -0.39 -3.56 2.04 -1.41 -0.04 117.51 116.39 2ptq h ILE 389 Ca 0.36 -0.05 -0.10 0.00 1.00 0.00 0.00 64.86 66.07 2ptq h ILE 389 Cb -0.08 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 2ptq h ILE 389 CO -0.09 0.03 -0.15 0.06 0.00 0.00 0.00 178.15 178.00 2ptq h GLN 390 N 0.15 0.72 -0.54 2.37 -0.00 -1.08 -1.22 115.11 115.51 2ptq h GLN 390 Ca 0.06 -0.25 -0.03 0.00 -0.00 0.00 0.00 58.65 58.43 2ptq h GLN 390 Cb 0.01 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.48 27.41 2ptq h GLN 390 CO -0.04 0.83 0.20 1.15 -0.00 0.00 0.00 178.83 180.97 2ptq h THR 391 N 0.65 1.22 -0.77 1.86 2.02 -0.87 0.20 112.91 117.22 2ptq h THR 391 Ca 0.11 -0.71 -0.04 0.00 0.77 0.00 0.00 66.41 66.54 2ptq h THR 391 Cb 0.61 0.68 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 2ptq h THR 391 CO 0.04 0.27 0.33 0.58 0.37 0.00 0.00 175.52 177.11 2ptq h VAL 392 N 0.73 1.25 -0.64 3.16 2.07 -0.76 -1.28 116.25 120.80 2ptq h VAL 392 Ca 0.18 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 2ptq h VAL 392 Cb 0.22 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 2ptq h VAL 392 CO -0.01 0.32 0.30 0.24 0.02 0.00 0.00 177.57 178.43 2ptq h MET 393 N 1.10 0.92 -0.33 1.57 2.86 -0.66 -1.98 114.93 118.41 2ptq h MET 393 Ca 0.26 -0.14 0.05 0.00 -2.06 0.00 0.00 59.70 57.81 2ptq h MET 393 Cb 0.18 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.64 2ptq h MET 393 CO -0.03 0.74 0.06 0.00 1.06 0.00 0.00 176.91 178.75 2ptq h ARG 394 N 0.88 0.17 -0.76 1.72 3.08 -0.07 -1.43 114.38 117.97 2ptq h ARG 394 Ca 0.22 -0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.34 2ptq h ARG 394 Cb 0.13 -0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.07 2ptq h ARG 394 CO -0.03 0.11 0.42 -0.09 -1.07 0.00 0.00 179.97 179.32 2ptq h ARG 395 N 0.18 0.70 -0.94 0.04 2.43 -0.57 -2.40 114.38 113.81 2ptq h ARG 395 Ca 0.16 -0.04 -0.28 0.00 -0.81 0.00 0.00 59.98 59.00 2ptq h ARG 395 Cb 0.17 -0.16 -0.17 0.00 -0.42 0.00 0.00 29.97 29.40 2ptq h ARG 395 CO -0.21 0.46 0.36 0.66 -1.51 0.00 0.00 179.97 179.74 2ptq n TYR 396 N -4.78 1.98 -3.14 2.20 4.02 -0.81 -4.92 117.16 111.70 2ptq n TYR 396 Ca 0.12 -1.24 -0.23 0.00 -0.01 0.00 0.00 57.90 56.55 2ptq n TYR 396 Cb 0.25 -0.66 0.02 0.00 -0.02 0.00 0.00 39.34 38.93 2ptq n TYR 396 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2ptq n GLY 397 N -0.41 -0.51 3.70 2.72 0.00 -0.91 -4.97 105.19 104.80 2ptq n GLY 397 Ca 0.37 0.12 -0.40 0.00 0.00 0.00 0.00 46.02 46.11 2ptq n GLY 397 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ptq s ILE 398 N -3.08 5.03 0.45 -0.61 1.01 -0.59 -5.02 121.20 118.39 2ptq s ILE 398 Ca 0.34 1.35 -0.24 0.00 0.00 0.00 0.00 60.65 62.10 2ptq s ILE 398 Cb -0.16 -4.00 -0.09 0.00 0.01 0.00 0.00 42.46 38.21 2ptq s ILE 398 CO 0.42 0.19 1.07 -0.62 0.00 0.00 0.00 174.94 176.00 2ptq n GLU 399 N 4.31 1.43 -3.87 2.79 1.02 -1.26 -3.58 120.64 121.49 2ptq n GLU 399 Ca -0.01 0.52 -0.27 0.00 -0.02 0.00 0.00 57.16 57.38 2ptq n GLU 399 Cb 0.51 -2.15 -0.04 0.00 -0.02 0.00 0.00 31.44 29.74 2ptq n GLU 399 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2ptq n LYS 400 N -0.06 -0.76 0.23 3.49 5.02 -1.26 -4.86 118.16 119.95 2ptq n LYS 400 Ca 0.09 -0.01 -0.15 0.00 -2.02 0.00 0.00 58.31 56.22 2ptq n LYS 400 Cb 0.40 -2.11 -0.08 0.00 -0.02 0.00 0.00 35.03 33.23 2ptq n LYS 400 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2ptq h PRO 401 N -0.98 -0.67 -0.31 1.97 0.13 -1.88 -0.07 132.00 130.18 2ptq h PRO 401 Ca -0.48 0.05 0.04 0.00 -0.87 0.00 0.00 66.00 64.73 2ptq h PRO 401 Cb 0.99 0.15 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 2ptq h PRO 401 CO 0.45 -0.45 0.10 -0.92 -0.23 0.00 0.00 178.00 176.95 2ptq h TYR 402 N -0.70 0.18 -0.78 1.56 3.20 -1.89 -2.07 116.97 116.47 2ptq h TYR 402 Ca -0.03 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.91 2ptq h TYR 402 Cb 0.62 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.80 2ptq h TYR 402 CO -0.17 0.07 0.48 0.93 -1.64 0.00 0.00 178.16 177.84 2ptq h GLU 403 N 0.23 0.88 -0.67 1.82 3.07 -1.90 -0.42 114.58 117.59 2ptq h GLU 403 Ca 0.14 -0.05 -0.08 0.00 -0.50 0.00 0.00 59.36 58.87 2ptq h GLU 403 Cb 0.12 -0.20 -0.03 0.00 -0.84 0.00 0.00 28.75 27.80 2ptq h GLU 403 CO -0.15 0.58 0.12 0.87 -1.40 0.00 0.00 179.01 179.04 2ptq h LYS 404 N 0.91 1.09 -0.02 2.33 1.57 -0.63 -1.85 116.57 119.97 2ptq h LYS 404 Ca 0.33 -0.28 -0.13 0.00 -1.87 0.00 0.00 60.65 58.70 2ptq h LYS 404 Cb 0.11 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 2ptq h LYS 404 CO -0.15 0.99 -0.59 -0.07 -0.57 0.00 0.00 179.45 179.06 2ptq h LEU 405 N 1.03 0.08 -0.47 2.94 -0.00 -0.93 -2.43 115.31 115.53 2ptq h LEU 405 Ca 0.21 -0.05 -0.11 0.00 -0.00 0.00 0.00 57.88 57.93 2ptq h LEU 405 Cb 0.42 -0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 41.04 2ptq h LEU 405 CO 0.01 0.66 -0.12 0.50 -0.00 0.00 0.00 178.44 179.49 2ptq h LYS 406 N 0.06 0.92 -0.62 1.13 3.64 -0.77 -0.61 116.57 120.33 2ptq h LYS 406 Ca -0.01 -0.35 -0.02 0.00 -1.27 0.00 0.00 60.65 59.00 2ptq h LYS 406 Cb 1.06 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.80 2ptq h LYS 406 CO 0.08 1.01 0.30 1.49 -2.27 0.00 0.00 179.45 180.06 2ptq h GLU 407 N 0.76 0.87 -0.13 1.90 4.57 -1.20 -0.87 114.58 120.48 2ptq h GLU 407 Ca 0.12 -0.11 -0.23 0.00 -1.18 0.00 0.00 59.36 57.96 2ptq h GLU 407 Cb 0.67 -0.17 0.01 0.00 -0.16 0.00 0.00 28.75 29.11 2ptq h GLU 407 CO 0.05 0.67 -0.81 1.25 -1.18 0.00 0.00 179.01 178.99 2ptq h LEU 408 N 0.87 0.89 0.00 1.64 5.85 -1.02 -3.41 115.31 120.13 2ptq h LEU 408 Ca 0.22 -0.60 -0.12 0.00 0.84 0.00 0.00 57.88 58.21 2ptq h LEU 408 Cb 0.09 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 2ptq h LEU 408 CO -0.03 1.40 -1.49 0.35 -0.34 0.00 0.00 178.44 178.33 2ptq n THR 409 N -3.91 0.47 -1.60 1.05 -2.24 -0.27 -4.74 114.28 103.03 2ptq n THR 409 Ca -0.07 -0.30 -0.44 0.00 -2.27 0.00 0.00 64.05 60.97 2ptq n THR 409 Cb 0.76 -0.74 -0.04 0.00 -2.10 0.00 0.00 70.33 68.22 2ptq n THR 409 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2ptq n ARG 410 N -2.24 2.05 -1.12 -0.78 0.63 -0.34 -0.78 116.66 114.08 2ptq n ARG 410 Ca -0.11 0.62 -0.04 0.00 -0.92 0.00 0.00 57.85 57.40 2ptq n ARG 410 Cb 0.70 -3.07 -0.02 0.00 0.45 0.00 0.00 32.46 30.52 2ptq n ARG 410 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ptq n GLY 411 N 5.54 0.68 3.07 5.14 0.00 -1.26 -4.96 105.19 113.39 2ptq n GLY 411 Ca 0.29 -0.49 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 2ptq n GLY 411 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ptq s LYS 412 N -1.85 1.00 -0.07 1.61 1.02 0.04 -5.12 119.74 116.37 2ptq s LYS 412 Ca 0.00 -0.42 -0.27 0.00 0.02 0.00 0.00 55.97 55.30 2ptq s LYS 412 Cb 0.00 -0.96 -0.03 0.00 -0.52 0.00 0.00 37.83 36.33 2ptq s LYS 412 CO 0.00 0.24 0.86 -0.98 -0.92 0.00 0.00 175.35 174.55 2ptq s ARG 413 N -0.23 4.44 -0.09 1.68 1.04 -1.26 -4.76 118.95 119.78 2ptq s ARG 413 Ca 0.04 1.15 -0.02 0.00 -1.04 0.00 0.00 55.73 55.86 2ptq s ARG 413 Cb -0.05 -3.49 0.03 0.00 -2.04 0.00 0.00 34.95 29.40 2ptq s ARG 413 CO -0.00 -0.11 0.01 0.08 -0.04 0.00 0.00 175.30 175.24 2ptq s VAL 414 N 1.33 0.37 0.72 4.99 1.01 -1.26 -5.09 120.40 122.47 2ptq s VAL 414 Ca 0.44 0.05 -0.04 0.00 0.00 0.00 0.00 61.98 62.42 2ptq s VAL 414 Cb -0.19 -0.58 0.15 0.00 0.00 0.00 0.00 36.38 35.76 2ptq s VAL 414 CO 0.20 0.19 0.98 -0.90 0.00 0.00 0.00 175.10 175.57 2ptq n ASP 415 N 5.14 0.92 -0.20 3.32 3.85 -1.26 -4.02 116.55 124.30 2ptq n ASP 415 Ca -0.07 -1.87 0.00 0.00 -0.71 0.00 0.00 54.79 52.14 2ptq n ASP 415 Cb 0.50 -0.67 0.11 0.00 -1.35 0.00 0.00 41.12 39.70 2ptq n ASP 415 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2ptq h ALA 416 N -0.92 0.77 -0.54 2.12 0.00 -1.93 -0.52 119.26 118.25 2ptq h ALA 416 Ca -0.32 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2ptq h ALA 416 Cb 1.09 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2ptq h ALA 416 CO 0.31 -0.21 0.32 1.05 0.00 0.00 0.00 179.25 180.72 2ptq h GLU 417 N 0.39 0.74 -0.42 0.00 4.11 -1.98 0.10 114.58 117.52 2ptq h GLU 417 Ca 0.31 -0.07 -0.02 0.00 0.07 0.00 0.00 59.36 59.64 2ptq h GLU 417 Cb 0.39 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2ptq h GLU 417 CO -0.32 0.55 0.17 0.78 0.07 0.00 0.00 179.01 180.26 2ptq h GLY 418 N 0.72 0.67 1.12 1.06 0.00 -1.75 0.19 103.07 105.08 2ptq h GLY 418 Ca 0.19 -0.37 -0.09 0.00 0.00 0.00 0.00 47.33 47.07 2ptq h GLY 418 CO -0.03 0.35 0.05 -0.33 0.00 0.00 0.00 176.54 176.58 2ptq h MET 419 N 0.53 1.07 -0.67 4.80 2.86 -0.92 -2.09 114.93 120.51 2ptq h MET 419 Ca 0.14 -0.31 -0.05 0.00 -2.06 0.00 0.00 59.70 57.42 2ptq h MET 419 Cb 0.19 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 2ptq h MET 419 CO -0.01 1.01 0.22 0.87 1.06 0.00 0.00 176.91 180.05 2ptq h LYS 420 N 0.99 1.04 -0.59 1.72 1.57 -0.45 -2.14 116.57 118.71 2ptq h LYS 420 Ca 0.19 -0.22 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2ptq h LYS 420 Cb 0.49 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.62 2ptq h LYS 420 CO 0.02 0.90 0.23 0.37 -0.57 0.00 0.00 179.45 180.40 2ptq h GLN 421 N 0.98 0.87 -0.41 3.15 4.15 -0.35 -1.91 115.11 121.58 2ptq h GLN 421 Ca 0.22 -0.14 -0.06 0.00 0.77 0.00 0.00 58.65 59.44 2ptq h GLN 421 Cb 0.29 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 2ptq h GLN 421 CO -0.01 0.72 0.01 0.35 -1.93 0.00 0.00 178.83 177.96 2ptq h PHE 422 N 0.85 0.79 -0.61 3.99 3.57 -0.98 -3.06 116.94 121.49 2ptq h PHE 422 Ca 0.20 -0.14 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 2ptq h PHE 422 Cb 0.18 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 2ptq h PHE 422 CO 0.01 0.79 0.37 0.82 -2.23 0.00 0.00 178.31 178.07 2ptq h ILE 423 N 0.56 1.18 -0.17 1.41 2.04 -1.00 -2.47 117.51 119.07 2ptq h ILE 423 Ca 0.12 -0.40 0.05 0.00 1.00 0.00 0.00 64.86 65.62 2ptq h ILE 423 Cb 0.47 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 2ptq h ILE 423 CO 0.02 0.19 0.13 0.44 0.00 0.00 0.00 178.15 178.93 2ptq h ASP 424 N 0.83 0.00 -0.09 1.72 3.45 -1.27 -1.20 116.42 119.86 2ptq h ASP 424 Ca 0.22 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.68 2ptq h ASP 424 Cb -0.02 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.75 2ptq h ASP 424 CO -0.04 0.00 0.00 0.61 -1.57 0.00 0.00 179.24 178.24 2ptq n GLY 425 N -1.53 -0.25 3.80 2.75 0.00 -0.93 -4.89 105.19 104.14 2ptq n GLY 425 Ca 0.01 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.35 2ptq n GLY 425 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ptq s LEU 426 N -1.59 4.52 -1.36 0.99 1.43 -0.45 -4.98 118.68 117.23 2ptq s LEU 426 Ca 0.31 1.41 -0.13 0.00 -1.03 0.00 0.00 54.13 54.69 2ptq s LEU 426 Cb 0.16 -3.16 0.10 0.00 0.03 0.00 0.00 46.19 43.32 2ptq s LEU 426 CO 0.25 0.21 1.97 0.00 0.23 0.00 0.00 176.35 179.01 2ptq n ALA 427 N 1.48 5.04 -2.41 4.21 0.00 -1.26 -4.91 120.51 122.66 2ptq n ALA 427 Ca -0.07 -4.05 -0.19 0.00 0.00 0.00 0.00 53.44 49.13 2ptq n ALA 427 Cb 0.50 -3.33 -0.11 0.00 0.00 0.00 0.00 19.45 16.52 2ptq n ALA 427 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ptq s LEU 428 N 1.70 2.49 0.23 0.00 1.43 -1.26 -5.00 118.68 118.27 2ptq s LEU 428 Ca 0.45 -0.93 -0.31 0.00 -1.03 0.00 0.00 54.13 52.32 2ptq s LEU 428 Cb 0.10 -0.69 -0.10 0.00 0.03 0.00 0.00 46.19 45.53 2ptq s LEU 428 CO -0.03 -0.13 1.52 -2.16 0.23 0.00 0.00 176.35 175.78 2ptq s PRO 429 N -3.19 4.22 0.31 1.29 0.04 -1.26 -4.73 135.00 131.68 2ptq s PRO 429 Ca 0.17 2.38 0.10 0.00 0.04 0.00 0.00 61.00 63.70 2ptq s PRO 429 Cb -0.03 -3.10 0.96 0.00 0.04 0.00 0.00 34.50 32.37 2ptq s PRO 429 CO 0.06 -0.53 1.43 0.39 0.04 0.00 0.00 177.00 178.39 2ptq n GLU 430 N 2.83 -0.06 -0.18 4.56 -0.58 -1.26 0.08 120.64 126.03 2ptq n GLU 430 Ca 0.09 1.31 -0.01 0.00 -0.42 0.00 0.00 57.16 58.13 2ptq n GLU 430 Cb 0.39 -2.21 0.09 0.00 -0.57 0.00 0.00 31.44 29.14 2ptq n GLU 430 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 2ptq h GLU 431 N 0.00 0.25 -0.19 3.49 4.39 -1.99 0.14 114.58 120.66 2ptq h GLU 431 Ca 0.66 -0.01 -0.18 0.00 0.34 0.00 0.00 59.36 60.17 2ptq h GLU 431 Cb 1.59 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 30.18 2ptq h GLU 431 CO -0.78 0.16 -0.60 0.93 -1.16 0.00 0.00 179.01 177.56 2ptq h GLU 432 N 0.25 0.62 -0.42 2.33 4.39 -0.70 -1.90 114.58 119.16 2ptq h GLU 432 Ca 0.28 -0.42 0.00 0.00 0.34 0.00 0.00 59.36 59.56 2ptq h GLU 432 Cb 0.40 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.09 2ptq h GLU 432 CO -0.36 1.04 0.26 0.87 -1.16 0.00 0.00 179.01 179.66 2ptq h LYS 433 N 0.47 0.56 -0.40 2.33 1.57 -0.57 -1.00 116.57 119.53 2ptq h LYS 433 Ca -0.00 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 2ptq h LYS 433 Cb 1.18 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.35 2ptq h LYS 433 CO 0.12 0.40 -0.08 0.00 -0.57 0.00 0.00 179.45 179.32 2ptq h ALA 434 N 1.13 1.12 -0.77 3.86 0.00 -0.72 -1.03 119.26 122.85 2ptq h ALA 434 Ca 0.15 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2ptq h ALA 434 Cb -0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2ptq h ALA 434 CO -0.03 0.55 0.33 -0.09 0.00 0.00 0.00 179.25 180.01 2ptq h ARG 435 N 0.63 1.13 -0.29 0.00 2.43 -0.76 -1.25 114.38 116.27 2ptq h ARG 435 Ca 0.12 -0.18 -0.18 0.00 -0.81 0.00 0.00 59.98 58.92 2ptq h ARG 435 Cb 0.51 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2ptq h ARG 435 CO 0.03 0.90 -0.52 -0.07 -1.51 0.00 0.00 179.97 178.79 2ptq h LEU 436 N 1.11 0.96 -0.91 3.80 3.38 -0.72 -2.98 115.31 119.95 2ptq h LEU 436 Ca 0.26 -0.53 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2ptq h LEU 436 Cb 0.17 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2ptq h LEU 436 CO -0.03 1.31 0.00 0.11 0.09 0.00 0.00 178.44 179.92 2ptq h LYS 437 N 0.65 0.00 0.00 1.13 1.57 -0.90 -2.77 116.57 116.24 2ptq h LYS 437 Ca 0.02 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 2ptq h LYS 437 Cb 1.13 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.44 2ptq h LYS 437 CO 0.12 0.00 -0.63 0.00 -0.57 0.00 0.00 179.45 178.37 2ptq h ALA 438 N 2.20 0.71 -2.27 3.86 0.00 -1.08 -3.47 119.26 119.21 2ptq h ALA 438 Ca 0.00 -0.11 -0.49 0.00 0.00 0.00 0.00 54.91 54.31 2ptq h ALA 438 Cb 0.41 0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.25 2ptq h ALA 438 CO 0.00 0.13 0.33 0.00 0.00 0.00 0.00 179.25 179.71 2ptq s MET 439 N -3.24 3.79 0.12 0.00 0.23 -1.05 -5.05 119.30 114.09 2ptq s MET 439 Ca 0.02 0.76 -0.01 0.00 -1.03 0.00 0.00 55.69 55.43 2ptq s MET 439 Cb 0.08 -2.18 -0.04 0.00 -1.53 0.00 0.00 34.83 31.16 2ptq s MET 439 CO 0.74 -0.32 0.04 0.95 -2.03 0.00 0.00 175.02 174.40 2ptq s THR 440 N -2.76 0.15 0.51 3.16 -4.23 -1.26 -5.02 115.64 106.20 2ptq s THR 440 Ca 0.56 -1.89 0.16 0.00 -1.18 0.00 0.00 61.69 59.33 2ptq s THR 440 Cb -0.10 -1.94 0.28 0.00 1.34 0.00 0.00 72.50 72.08 2ptq s THR 440 CO 0.39 -0.58 2.13 1.55 -0.54 0.00 0.00 174.62 177.58 2ptq h PRO 441 N 2.92 0.04 -0.02 3.99 0.13 -1.88 -0.49 132.00 136.69 2ptq h PRO 441 Ca -0.35 -0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.68 2ptq h PRO 441 Cb 1.19 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2ptq h PRO 441 CO 0.61 0.03 -0.47 0.00 -0.23 0.00 0.00 178.00 177.94 2ptq h ALA 442 N 1.96 1.20 -0.03 -0.56 0.00 -1.94 -3.10 119.26 116.79 2ptq h ALA 442 Ca 0.03 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2ptq h ALA 442 Cb 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2ptq h ALA 442 CO -0.00 0.59 0.00 0.27 0.00 0.00 0.00 179.25 180.11 2ptq n ASN 443 N -3.98 2.64 -3.59 0.00 2.04 -0.75 -4.58 115.26 107.03 2ptq n ASN 443 Ca -0.02 -1.82 -0.41 0.00 -0.44 0.00 0.00 54.58 51.90 2ptq n ASN 443 Cb 0.49 -0.00 -0.00 0.00 -2.53 0.00 0.00 39.78 37.74 2ptq n ASN 443 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2ptq n TYR 444 N 1.10 2.73 -0.17 -2.53 -0.00 -0.27 -4.53 117.16 113.50 2ptq n TYR 444 Ca 0.11 -2.86 0.06 0.00 -0.00 0.00 0.00 57.90 55.22 2ptq n TYR 444 Cb 0.49 -2.00 0.16 0.00 -0.00 0.00 0.00 39.34 37.99 2ptq n TYR 444 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.86 177.30 2ptq n ILE 445 N 2.67 0.98 -2.15 2.97 -5.35 -1.26 -4.05 119.36 113.17 2ptq n ILE 445 Ca 0.57 -0.99 0.00 0.00 -0.27 0.00 0.00 62.75 62.06 2ptq n ILE 445 Cb 0.29 0.51 0.00 0.00 -1.74 0.00 0.00 39.64 38.70 2ptq n ILE 445 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ptq n GLY 446 N 0.56 3.02 0.97 3.28 0.00 -1.26 -2.35 105.19 109.40 2ptq n GLY 446 Ca 0.12 -0.22 0.08 0.00 0.00 0.00 0.00 46.02 46.00 2ptq n GLY 446 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2ptq n ARG 447 N 14.00 2.27 -0.32 1.61 0.63 -1.26 -4.66 116.66 128.92 2ptq n ARG 447 Ca 0.00 -1.86 -0.05 0.00 -0.92 0.00 0.00 57.85 55.03 2ptq n ARG 447 Cb 0.00 -1.43 -0.00 0.00 0.45 0.00 0.00 32.46 31.48 2ptq n ARG 447 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2ptq h ALA 448 N 3.91 -0.07 -0.28 5.13 0.00 -1.87 0.10 119.26 126.17 2ptq h ALA 448 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2ptq h ALA 448 Cb 0.73 1.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 2ptq h ALA 448 CO 0.02 -0.72 0.18 0.82 0.00 0.00 0.00 179.25 179.55 2ptq h ILE 449 N -0.07 1.08 -0.20 0.00 2.04 -1.83 -2.19 117.51 116.34 2ptq h ILE 449 Ca 0.27 -0.17 -0.07 0.00 1.00 0.00 0.00 64.86 65.88 2ptq h ILE 449 Cb 0.56 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 2ptq h ILE 449 CO -0.87 0.08 -0.20 0.74 0.00 0.00 0.00 178.15 177.90 2ptq h THR 450 N 0.37 1.23 -0.78 -0.27 2.02 -1.76 -1.87 112.91 111.86 2ptq h THR 450 Ca 0.10 -1.07 0.01 0.00 0.77 0.00 0.00 66.41 66.22 2ptq h THR 450 Cb -0.02 1.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 2ptq h THR 450 CO -0.02 0.33 0.52 0.24 0.37 0.00 0.00 175.52 176.96 2ptq h MET 451 N 0.32 1.02 -0.26 6.66 2.86 -0.40 -0.95 114.93 124.17 2ptq h MET 451 Ca 0.05 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 2ptq h MET 451 Cb 0.54 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2ptq h MET 451 CO 0.04 0.67 0.02 0.28 1.06 0.00 0.00 176.91 178.98 2ptq h VAL 452 N 1.05 1.25 0.00 -2.22 2.07 -0.83 -2.87 116.25 114.69 2ptq h VAL 452 Ca 0.29 -0.86 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 2ptq h VAL 452 Cb -0.10 1.30 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2ptq h VAL 452 CO -0.07 0.27 -0.14 0.44 0.02 0.00 0.00 177.57 178.09 2ptq h ASP 453 N 0.24 0.00 0.29 0.57 3.32 -0.89 -2.54 116.42 117.42 2ptq h ASP 453 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2ptq h ASP 453 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2ptq h ASP 453 CO 0.01 0.14 -0.23 -0.62 -1.72 0.00 0.00 179.24 176.82 2ptq n GLU 454 N -4.20 0.74 -0.30 3.56 1.02 -0.40 -4.23 120.64 116.83 2ptq n GLU 454 Ca -0.02 -0.39 0.08 0.00 -0.02 0.00 0.00 57.16 56.80 2ptq n GLU 454 Cb 0.22 -1.49 0.24 0.00 -0.02 0.00 0.00 31.44 30.38 2ptq n GLU 454 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2ptq h LEU 455 N 0.96 0.50 -0.98 -4.62 5.85 -1.23 0.18 115.31 115.96 2ptq h LEU 455 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2ptq h LEU 455 Cb 0.47 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2ptq h LEU 455 CO 0.00 0.18 0.02 2.29 -0.34 0.00 0.00 178.44 180.59 2ptq n LYS 456 N -4.90 0.09 0.00 1.25 2.85 -1.26 -0.97 118.16 115.22 2ptq n LYS 456 Ca 0.18 0.59 0.14 0.00 -1.05 0.00 0.00 58.31 58.17 2ptq n LYS 456 Cb 0.47 -1.83 0.57 0.00 -0.65 0.00 0.00 35.03 33.59 2ptq n LYS 456 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2ptq n HIS 457 N -2.01 0.00 0.54 5.58 8.25 0.61 -5.25 115.22 122.94 2ptq n HIS 457 Ca -0.01 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.52 2ptq n HIS 457 Cb 0.04 -0.03 0.05 0.00 1.12 0.00 0.00 29.99 31.18 2ptq n HIS 457 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70