#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 3.44 0.14 0.03 0.41 -1.26 -4.96 118.70 116.50 2ptq s GLU 2 Ca 0.00 1.59 -0.31 0.00 -0.41 0.00 0.00 54.97 55.85 2ptq s GLU 2 Cb 0.00 -2.04 -0.08 0.00 -1.78 0.00 0.00 34.13 30.22 2ptq s GLU 2 CO 0.00 -0.78 1.37 -1.17 -0.49 0.00 0.00 175.26 174.19 2ptq s LEU 3 N -3.71 4.38 0.22 1.80 2.96 -1.26 -4.78 118.68 118.30 2ptq s LEU 3 Ca 0.72 2.36 -0.15 0.00 -0.22 0.00 0.00 54.13 56.83 2ptq s LEU 3 Cb -0.23 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 42.87 2ptq s LEU 3 CO 0.27 -0.62 0.50 -0.94 -1.32 0.00 0.00 176.35 174.23 2ptq s SER 4 N 0.89 -0.16 0.53 3.68 1.04 -1.26 -4.99 113.70 113.43 2ptq s SER 4 Ca 0.62 -0.71 0.20 0.00 0.48 0.00 0.00 55.95 56.54 2ptq s SER 4 Cb -0.37 0.58 1.37 0.00 0.10 0.00 0.00 66.02 67.70 2ptq s SER 4 CO 0.33 -1.10 2.13 0.77 0.98 0.00 0.00 173.24 176.34 2ptq h SER 5 N 2.23 0.00 0.36 7.02 4.64 -1.90 0.26 113.55 126.17 2ptq h SER 5 Ca -0.27 0.00 -0.19 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 63.34 2ptq h SER 5 CO 0.36 0.00 -0.78 -0.07 -0.87 0.00 0.00 176.83 175.47 2ptq h LEU 6 N 0.00 0.41 -0.38 5.97 3.38 -1.89 -3.31 115.31 119.49 2ptq h LEU 6 Ca 0.06 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2ptq h LEU 6 Cb 0.23 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2ptq h LEU 6 CO -0.00 1.03 -0.65 0.35 0.09 0.00 0.00 178.44 179.26 2ptq n THR 7 N -3.79 0.00 -1.67 0.22 -2.24 -0.70 -4.97 114.28 101.14 2ptq n THR 7 Ca -0.04 -0.10 -0.45 0.00 -2.27 0.00 0.00 64.05 61.19 2ptq n THR 7 Cb 0.74 0.86 -0.03 0.00 -2.10 0.00 0.00 70.33 69.80 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 -0.93 1.05 -0.09 6.98 0.00 -0.00 -4.83 120.51 122.70 2ptq n ALA 8 Ca 0.07 0.42 -0.12 0.00 0.00 0.00 0.00 53.44 53.81 2ptq n ALA 8 Cb 0.38 -2.27 -0.04 0.00 0.00 0.00 0.00 19.45 17.51 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 3.08 1.28 -3.31 0.00 2.07 -1.93 -3.44 116.25 114.00 2ptq h VAL 9 Ca -0.45 -1.04 -0.57 0.00 0.82 0.00 0.00 66.70 65.46 2ptq h VAL 9 Cb 1.28 1.45 -0.05 0.00 -1.52 0.00 0.00 31.29 32.45 2ptq h VAL 9 CO 0.76 0.33 -0.00 -0.55 0.02 0.00 0.00 177.57 178.13 2ptq s SER 10 N -6.06 7.00 0.00 0.57 0.15 -1.26 -4.96 113.70 109.13 2ptq s SER 10 Ca -0.14 1.19 0.17 0.00 0.70 0.00 0.00 55.95 57.87 2ptq s SER 10 Cb 0.07 -2.37 0.78 0.00 -1.71 0.00 0.00 66.02 62.79 2ptq s SER 10 CO 0.76 0.10 1.55 -0.81 1.20 0.00 0.00 173.24 176.04 2ptq n PRO 11 N 2.69 0.06 0.14 5.44 -0.04 -1.26 -0.37 135.00 141.66 2ptq n PRO 11 Ca -0.07 0.18 -0.01 0.00 -0.04 0.00 0.00 63.50 63.57 2ptq n PRO 11 Cb 0.51 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.66 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 1.41 0.00 0.52 2.07 -1.93 0.41 116.25 118.73 2ptq h VAL 12 Ca 0.00 -2.02 0.00 0.00 0.82 0.00 0.00 66.70 65.50 2ptq h VAL 12 Cb 0.26 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 32.13 2ptq h VAL 12 CO 0.00 0.58 -0.96 0.47 0.02 0.00 0.00 177.57 177.68 2ptq n ASP 13 N -3.82 1.12 0.00 0.57 8.00 -0.88 -3.46 116.55 118.07 2ptq n ASP 13 Ca -0.01 -0.51 0.00 0.00 0.71 0.00 0.00 54.79 54.98 2ptq n ASP 13 Cb 0.59 1.22 0.00 0.00 -0.02 0.00 0.00 41.12 42.91 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 1.47 0.66 0.35 0.44 0.00 0.50 -4.22 105.19 104.39 2ptq n GLY 14 Ca 0.01 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.20 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 0.58 -0.57 1.61 2.43 -1.70 -0.63 114.38 116.10 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 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 2ptq h ARG 15 CO 0.00 0.38 0.00 0.66 -1.51 0.00 0.00 179.97 179.50 2ptq n TYR 16 N -4.85 1.28 -0.28 2.20 4.01 0.13 -4.64 117.16 115.01 2ptq n TYR 16 Ca 0.26 -0.62 0.09 0.00 -0.16 0.00 0.00 57.90 57.47 2ptq n TYR 16 Cb 0.73 -0.22 0.24 0.00 -0.31 0.00 0.00 39.34 39.78 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 3.57 1.28 2.00 2.72 0.00 -1.13 0.17 103.07 111.68 2ptq h GLY 17 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.21 2ptq h GLY 17 CO 0.20 -0.21 0.00 2.09 0.00 0.00 0.00 176.54 178.61 2ptq n ASP 18 N -5.08 0.29 0.06 0.19 5.68 -1.26 -2.29 116.55 114.13 2ptq n ASP 18 Ca 0.18 0.57 0.12 0.00 -0.50 0.00 0.00 54.79 55.16 2ptq n ASP 18 Cb 0.54 -0.63 0.25 0.00 -1.14 0.00 0.00 41.12 40.14 2ptq n ASP 18 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2ptq n LYS 19 N -1.82 0.23 -0.64 0.11 4.76 0.57 -4.17 118.16 117.22 2ptq n LYS 19 Ca 0.03 0.09 0.05 0.00 -2.87 0.00 0.00 58.31 55.61 2ptq n LYS 19 Cb 0.19 -1.67 0.08 0.00 -1.84 0.00 0.00 35.03 31.79 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 -2.03 0.93 -0.33 -0.18 0.24 -0.97 -4.78 118.33 111.21 2ptq n VAL 20 Ca 0.04 -1.46 0.19 0.00 -2.04 0.00 0.00 64.34 61.07 2ptq n VAL 20 Cb 0.42 0.28 0.43 0.00 -1.47 0.00 0.00 33.84 33.50 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 0.43 0.58 -0.47 -1.34 4.64 -1.68 0.32 113.55 116.03 2ptq h SER 21 Ca -0.05 0.10 0.11 0.00 -0.47 0.00 0.00 61.79 61.47 2ptq h SER 21 Cb 1.33 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.40 2ptq h SER 21 CO 0.02 0.14 0.33 0.00 -0.87 0.00 0.00 176.83 176.45 2ptq h ALA 22 N 1.65 2.24 0.00 5.18 0.00 -1.91 -0.87 119.26 125.55 2ptq h ALA 22 Ca 0.59 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.48 2ptq h ALA 22 Cb 1.26 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2ptq h ALA 22 CO -0.35 -0.36 -0.03 -0.07 0.00 0.00 0.00 179.25 178.44 2ptq h LEU 23 N 0.15 0.00 -1.82 0.00 3.38 -1.33 -3.07 115.31 112.62 2ptq h LEU 23 Ca 0.22 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 2ptq h LEU 23 Cb 0.67 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 2ptq h LEU 23 CO -0.03 0.03 -0.13 0.03 0.09 0.00 0.00 178.44 178.43 2ptq h ARG 24 N 0.00 0.00 -0.11 1.13 3.08 -1.24 -0.74 114.38 116.49 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 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2ptq h ARG 24 CO 0.00 0.13 0.00 0.41 -1.07 0.00 0.00 179.97 179.44 2ptq n GLY 25 N -1.04 0.37 0.95 0.04 0.00 -1.16 -4.25 105.19 100.10 2ptq n GLY 25 Ca -0.02 -0.49 -0.01 0.00 0.00 0.00 0.00 46.02 45.50 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 0.48 1.10 0.82 -0.61 5.41 -0.45 -4.46 119.36 121.66 2ptq n ILE 26 Ca 0.17 0.32 0.11 0.00 1.00 0.00 0.00 62.75 64.36 2ptq n ILE 26 Cb 0.39 -1.65 0.05 0.00 -0.71 0.00 0.00 39.64 37.73 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 -3.53 0.10 -1.15 1.39 3.72 -0.41 -3.79 117.46 113.78 2ptq n PHE 27 Ca -0.02 0.03 -0.30 0.00 -0.05 0.00 0.00 57.45 57.11 2ptq n PHE 27 Cb 0.12 -0.25 0.24 0.00 -0.94 0.00 0.00 39.48 38.65 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 -3.37 1.04 0.30 4.37 1.04 -1.25 -4.68 113.70 111.16 2ptq s SER 28 Ca 0.07 0.59 0.04 0.00 0.48 0.00 0.00 55.95 57.13 2ptq s SER 28 Cb 0.16 -0.80 0.49 0.00 0.10 0.00 0.00 66.02 65.96 2ptq s SER 28 CO 0.79 -4.04 1.76 -0.08 0.98 0.00 0.00 173.24 172.65 2ptq h GLU 29 N -2.53 0.43 -0.44 4.02 4.81 -1.93 -0.04 114.58 118.91 2ptq h GLU 29 Ca -0.45 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 58.60 2ptq h GLU 29 Cb 1.29 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 2ptq h GLU 29 CO 0.34 0.63 0.14 -0.92 -0.73 0.00 0.00 179.01 178.47 2ptq h TYR 30 N 0.39 0.71 -0.41 0.92 5.03 -1.91 -1.03 116.97 120.66 2ptq h TYR 30 Ca 0.06 -0.07 -0.05 0.00 2.58 0.00 0.00 58.73 61.26 2ptq h TYR 30 Cb 0.60 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.66 2ptq h TYR 30 CO 0.02 0.64 0.07 0.78 -1.32 0.00 0.00 178.16 178.34 2ptq h GLY 31 N 0.57 0.74 0.74 1.82 0.00 -1.62 -0.27 103.07 105.04 2ptq h GLY 31 Ca 0.14 -0.49 0.03 0.00 0.00 0.00 0.00 47.33 47.01 2ptq h GLY 31 CO -0.00 0.45 0.02 -2.00 0.00 0.00 0.00 176.54 175.00 2ptq h LEU 32 N 0.54 -0.04 -0.92 3.11 6.46 -0.90 -1.58 115.31 121.98 2ptq h LEU 32 Ca 0.13 0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 57.89 2ptq h LEU 32 Cb 0.37 0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 40.32 2ptq h LEU 32 CO 0.01 0.01 0.34 -0.07 -0.62 0.00 0.00 178.44 178.11 2ptq h LEU 33 N 0.09 1.02 -0.45 2.25 3.38 -1.04 -1.01 115.31 119.55 2ptq h LEU 33 Ca 0.09 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2ptq h LEU 33 Cb 0.10 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2ptq h LEU 33 CO -0.14 0.88 0.18 0.50 0.09 0.00 0.00 178.44 179.95 2ptq h LYS 34 N 1.11 0.67 -0.37 1.13 3.64 -0.56 -1.24 116.57 120.95 2ptq h LYS 34 Ca 0.26 -0.12 -0.12 0.00 -1.27 0.00 0.00 60.65 59.40 2ptq h LYS 34 Cb 0.15 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 2ptq h LYS 34 CO -0.03 0.62 -0.25 0.74 -2.27 0.00 0.00 179.45 178.25 2ptq h PHE 35 N 0.58 0.86 -0.70 1.91 0.04 -1.11 -1.69 116.94 116.83 2ptq h PHE 35 Ca 0.15 -0.20 0.03 0.00 2.80 0.00 0.00 57.97 60.75 2ptq h PHE 35 Cb 0.20 -0.20 -0.05 0.00 2.20 0.00 0.00 35.95 38.10 2ptq h PHE 35 CO 0.00 0.93 0.43 0.00 -0.60 0.00 0.00 178.31 179.07 2ptq h ARG 36 N 0.65 0.81 -0.71 1.51 3.08 -0.85 -0.47 114.38 118.40 2ptq h ARG 36 Ca 0.08 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 2ptq h ARG 36 Cb 0.77 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 2ptq h ARG 36 CO 0.06 0.54 0.28 0.28 -1.07 0.00 0.00 179.97 180.06 2ptq h VAL 37 N 0.84 1.25 0.01 2.04 2.07 -0.93 -0.89 116.25 120.63 2ptq h VAL 37 Ca 0.29 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 67.04 2ptq h VAL 37 Cb 0.04 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 2ptq h VAL 37 CO -0.12 0.31 -0.05 -0.61 0.02 0.00 0.00 177.57 177.13 2ptq h GLN 38 N 1.01 -0.08 -0.38 1.57 4.15 -0.44 -0.56 115.11 120.37 2ptq h GLN 38 Ca 0.24 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.66 2ptq h GLN 38 Cb 0.21 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.90 2ptq h GLN 38 CO -0.02 -0.05 0.24 0.28 -1.93 0.00 0.00 178.83 177.34 2ptq h VAL 39 N -0.08 1.12 -0.56 2.39 2.07 -0.91 -0.95 116.25 119.33 2ptq h VAL 39 Ca 0.02 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.28 2ptq h VAL 39 Cb 0.10 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2ptq h VAL 39 CO -0.04 0.12 0.37 -0.33 0.02 0.00 0.00 177.57 177.70 2ptq h GLU 40 N 0.50 0.72 -0.33 1.57 4.39 -0.98 -0.40 114.58 120.05 2ptq h GLU 40 Ca 0.14 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 2ptq h GLU 40 Cb -0.01 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.46 2ptq h GLU 40 CO -0.03 0.48 0.16 0.28 -1.16 0.00 0.00 179.01 178.74 2ptq h VAL 41 N 0.74 1.16 -0.28 3.13 2.07 -0.86 -1.88 116.25 120.34 2ptq h VAL 41 Ca 0.21 -0.45 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 2ptq h VAL 41 Cb -0.06 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2ptq h VAL 41 CO -0.06 0.16 -0.06 0.03 0.02 0.00 0.00 177.57 177.67 2ptq h ARG 42 N 0.40 0.45 -0.13 1.57 2.47 -0.89 -0.52 114.38 117.73 2ptq h ARG 42 Ca 0.11 -0.10 -0.01 0.00 -1.26 0.00 0.00 59.98 58.72 2ptq h ARG 42 Cb 0.11 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.37 2ptq h ARG 42 CO -0.01 0.52 0.03 2.35 0.56 0.00 0.00 179.97 183.41 2ptq h TRP 43 N 0.42 0.22 -0.69 3.04 2.91 -0.76 -0.78 115.95 120.31 2ptq h TRP 43 Ca 0.09 -0.03 0.01 0.00 1.13 0.00 0.00 58.89 60.09 2ptq h TRP 43 Cb 0.37 -0.06 -0.03 0.00 -0.51 0.00 0.00 29.16 28.92 2ptq h TRP 43 CO 0.01 0.37 0.46 1.25 -1.03 0.00 0.00 178.44 179.50 2ptq h LEU 44 N 0.01 0.80 -1.43 0.65 5.85 -1.02 -2.01 115.31 118.16 2ptq h LEU 44 Ca 0.04 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 2ptq h LEU 44 Cb 0.26 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2ptq h LEU 44 CO 0.00 0.58 0.18 1.56 -0.34 0.00 0.00 178.44 180.43 2ptq h GLN 45 N 0.94 0.57 -0.23 1.25 4.20 -0.83 -1.86 115.11 119.16 2ptq h GLN 45 Ca 0.25 -0.07 -0.20 0.00 0.06 0.00 0.00 58.65 58.70 2ptq h GLN 45 Cb -0.10 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.57 2ptq h GLN 45 CO -0.05 0.46 -0.63 -0.22 -0.67 0.00 0.00 178.83 177.71 2ptq h LYS 46 N 0.57 0.80 -0.87 1.46 3.64 -0.57 -2.09 116.57 119.51 2ptq h LYS 46 Ca 0.14 -0.56 0.01 0.00 -1.27 0.00 0.00 60.65 58.98 2ptq h LYS 46 Cb 0.08 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.95 2ptq h LYS 46 CO -0.02 1.18 0.58 -0.07 -2.27 0.00 0.00 179.45 178.85 2ptq h LEU 47 N 0.59 1.01 -0.32 5.20 3.38 -0.92 -0.32 115.31 123.92 2ptq h LEU 47 Ca -0.01 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2ptq h LEU 47 Cb 1.24 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 2ptq h LEU 47 CO 0.13 0.73 0.03 0.00 0.09 0.00 0.00 178.44 179.42 2ptq h ALA 48 N 1.32 0.43 0.00 1.53 0.00 -1.28 -2.82 119.26 118.45 2ptq h ALA 48 Ca 0.32 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2ptq h ALA 48 Cb -0.13 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2ptq h ALA 48 CO -0.07 0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.34 2ptq h ALA 49 N 0.87 1.00 -1.68 0.00 0.00 -0.98 -3.07 119.26 115.41 2ptq h ALA 49 Ca 0.10 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.45 2ptq h ALA 49 Cb 0.39 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 2ptq h ALA 49 CO 0.01 0.00 0.98 -1.58 0.00 0.00 0.00 179.25 178.66 2ptq s HIS 50 N -3.55 2.64 0.34 0.00 5.04 -0.17 -4.90 115.29 114.70 2ptq s HIS 50 Ca 0.02 0.60 0.07 0.00 -1.54 0.00 0.00 55.06 54.21 2ptq s HIS 50 Cb 0.09 -4.44 0.76 0.00 0.04 0.00 0.00 32.58 29.03 2ptq s HIS 50 CO 0.49 -1.54 1.88 0.00 -2.34 0.00 0.00 174.74 173.23 2ptq h ALA 51 N 9.72 1.77 0.00 1.58 0.00 -1.85 -1.48 119.26 128.99 2ptq h ALA 51 Ca -0.25 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2ptq h ALA 51 Cb 1.07 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2ptq h ALA 51 CO 1.14 0.01 -0.06 0.00 0.00 0.00 0.00 179.25 180.34 2ptq h ALA 52 N 1.59 1.10 -2.21 0.00 0.00 -1.93 -3.29 119.26 114.52 2ptq h ALA 52 Ca 0.44 -0.06 -0.79 0.00 0.00 0.00 0.00 54.91 54.50 2ptq h ALA 52 Cb 0.61 -0.01 -0.25 0.00 0.00 0.00 0.00 17.79 18.14 2ptq h ALA 52 CO -0.20 0.08 0.77 -0.89 0.00 0.00 0.00 179.25 179.01 2ptq n ILE 53 N -3.30 4.59 0.26 0.00 5.41 -0.56 -4.85 119.36 120.91 2ptq n ILE 53 Ca -0.01 -5.27 0.12 0.00 1.00 0.00 0.00 62.75 58.59 2ptq n ILE 53 Cb 0.24 -2.49 0.70 0.00 -0.71 0.00 0.00 39.64 37.38 2ptq n ILE 53 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2ptq h LYS 54 N 6.56 0.00 0.00 0.38 1.57 -1.78 -2.69 116.57 120.60 2ptq h LYS 54 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2ptq h LYS 54 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 2ptq h LYS 54 CO 1.14 0.13 0.00 0.39 -0.57 0.00 0.00 179.45 180.53 2ptq n GLU 55 N -3.74 0.05 -3.70 3.15 4.71 -1.26 -3.53 120.64 116.32 2ptq n GLU 55 Ca -0.02 0.40 -0.28 0.00 -0.01 0.00 0.00 57.16 57.25 2ptq n GLU 55 Cb 0.23 -1.61 -0.12 0.00 -1.01 0.00 0.00 31.44 28.93 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 -3.11 1.69 0.85 2.62 1.01 -1.02 -4.92 120.40 117.51 2ptq s VAL 56 Ca 0.03 -3.25 -0.12 0.00 0.00 0.00 0.00 61.98 58.65 2ptq s VAL 56 Cb 0.06 -2.14 0.11 0.00 0.00 0.00 0.00 36.38 34.41 2ptq s VAL 56 CO 0.20 -1.03 1.18 -2.16 0.00 0.00 0.00 175.10 173.28 2ptq s PRO 57 N -0.43 1.42 0.36 2.72 0.04 -1.23 -4.04 135.00 133.84 2ptq s PRO 57 Ca 0.25 1.64 -0.27 0.00 0.04 0.00 0.00 61.00 62.66 2ptq s PRO 57 Cb -0.09 -1.76 -0.12 0.00 0.04 0.00 0.00 34.50 32.57 2ptq s PRO 57 CO -0.12 -2.35 1.28 0.00 0.04 0.00 0.00 177.00 175.85 2ptq n ALA 58 N -3.68 1.28 -2.00 8.56 0.00 -1.16 -4.71 120.51 118.80 2ptq n ALA 58 Ca 0.13 0.33 -0.38 0.00 0.00 0.00 0.00 53.44 53.52 2ptq n ALA 58 Cb 0.51 -2.25 -0.06 0.00 0.00 0.00 0.00 19.45 17.65 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 -1.13 3.80 0.75 0.00 2.99 -1.26 -5.03 117.98 118.10 2ptq s PHE 59 Ca 0.57 1.56 -0.11 0.00 0.00 0.00 0.00 56.93 58.95 2ptq s PHE 59 Cb -0.55 -2.73 0.04 0.00 0.00 0.00 0.00 43.02 39.78 2ptq s PHE 59 CO 0.61 0.43 1.10 0.00 -0.00 0.00 0.00 175.22 177.36 2ptq s ALA 60 N -1.32 2.61 0.26 5.36 0.00 -1.26 -4.81 121.76 122.60 2ptq s ALA 60 Ca 0.39 -0.30 -0.02 0.00 0.00 0.00 0.00 51.96 52.04 2ptq s ALA 60 Cb -0.20 -3.06 0.53 0.00 0.00 0.00 0.00 23.12 20.38 2ptq s ALA 60 CO 0.24 -1.42 1.74 0.00 0.00 0.00 0.00 175.76 176.32 2ptq h ALA 61 N -0.86 1.20 -0.42 0.00 0.00 -1.99 -1.62 119.26 115.57 2ptq h ALA 61 Ca -0.46 0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 2ptq h ALA 61 Cb 1.26 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 2ptq h ALA 61 CO 0.62 -0.18 -0.14 -0.44 0.00 0.00 0.00 179.25 179.10 2ptq h ASP 62 N 0.51 0.78 -0.31 0.00 3.32 -1.99 -0.10 116.42 118.64 2ptq h ASP 62 Ca 0.45 -0.25 -0.13 0.00 0.02 0.00 0.00 57.03 57.13 2ptq h ASP 62 Cb 0.70 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2ptq h ASP 62 CO -0.41 0.93 -0.28 0.00 -1.72 0.00 0.00 179.24 177.77 2ptq h ALA 63 N 1.14 0.78 -0.47 3.45 0.00 -1.77 -0.36 119.26 122.03 2ptq h ALA 63 Ca 0.11 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 2ptq h ALA 63 Cb 0.64 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2ptq h ALA 63 CO 0.04 0.65 -0.10 0.82 0.00 0.00 0.00 179.25 180.66 2ptq h ILE 64 N 0.70 1.26 -0.43 0.00 2.04 -1.07 -1.12 117.51 118.88 2ptq h ILE 64 Ca 0.08 -1.19 -0.10 0.00 1.00 0.00 0.00 64.86 64.65 2ptq h ILE 64 Cb 0.82 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 2ptq h ILE 64 CO 0.07 0.41 -0.15 1.23 0.00 0.00 0.00 178.15 179.71 2ptq h GLY 65 N 0.97 0.87 0.98 5.37 0.00 -0.71 0.81 103.07 111.36 2ptq h GLY 65 Ca 0.13 -0.69 -0.06 0.00 0.00 0.00 0.00 47.33 46.70 2ptq h GLY 65 CO 0.04 0.63 0.05 -1.82 0.00 0.00 0.00 176.54 175.44 2ptq h TYR 66 N 0.72 0.87 -0.43 5.60 5.03 -0.70 0.22 116.97 128.27 2ptq h TYR 66 Ca 0.11 -0.13 -0.07 0.00 2.58 0.00 0.00 58.73 61.22 2ptq h TYR 66 Cb 0.65 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 38.68 2ptq h TYR 66 CO 0.03 0.81 -0.02 -0.07 -1.32 0.00 0.00 178.16 177.60 2ptq h LEU 67 N 0.67 0.77 -1.42 2.82 3.38 -0.98 -2.37 115.31 118.19 2ptq h LEU 67 Ca 0.14 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 2ptq h LEU 67 Cb 0.43 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2ptq h LEU 67 CO 0.01 0.90 0.18 0.44 0.09 0.00 0.00 178.44 180.07 2ptq h ASP 68 N 0.61 0.52 -0.35 -0.43 3.32 -0.61 -2.13 116.42 117.35 2ptq h ASP 68 Ca 0.12 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 2ptq h ASP 68 Cb 0.52 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 2ptq h ASP 68 CO 0.03 0.46 -0.10 0.00 -1.72 0.00 0.00 179.24 177.91 2ptq h ALA 69 N 1.63 1.01 -0.64 3.45 0.00 -0.61 0.19 119.26 124.29 2ptq h ALA 69 Ca 0.15 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 54.78 2ptq h ALA 69 Cb 0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2ptq h ALA 69 CO -0.02 0.60 0.38 0.82 0.00 0.00 0.00 179.25 181.03 2ptq h ILE 70 N 0.70 1.05 0.42 0.00 2.04 -0.88 0.18 117.51 121.02 2ptq h ILE 70 Ca 0.12 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.71 2ptq h ILE 70 Cb 0.57 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.89 2ptq h ILE 70 CO 0.04 0.14 -0.20 0.58 0.00 0.00 0.00 178.15 178.70 2ptq h VAL 71 N 0.74 0.42 -0.84 1.67 2.07 -1.30 -2.61 116.25 116.40 2ptq h VAL 71 Ca 0.27 -0.57 0.01 0.00 0.82 0.00 0.00 66.70 67.23 2ptq h VAL 71 Cb 0.07 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 2ptq h VAL 71 CO -0.13 0.08 0.56 0.00 0.02 0.00 0.00 177.57 178.10 2ptq h ALA 72 N -0.64 1.07 -0.24 1.67 0.00 -0.85 -3.01 119.26 117.27 2ptq h ALA 72 Ca -0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2ptq h ALA 72 Cb 0.56 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2ptq h ALA 72 CO 0.09 0.48 0.00 -1.13 0.00 0.00 0.00 179.25 178.70 2ptq n SER 73 N -4.49 2.38 -4.71 0.00 3.41 0.62 -4.97 113.62 105.85 2ptq n SER 73 Ca 0.09 -1.83 -0.63 0.00 -0.26 0.00 0.00 58.87 56.24 2ptq n SER 73 Cb 0.02 -0.15 -0.09 0.00 -0.26 0.00 0.00 64.21 63.73 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 0.80 1.84 -4.20 7.33 -0.00 -0.98 -4.93 117.46 117.32 2ptq n PHE 74 Ca 0.17 0.89 -0.27 0.00 -0.00 0.00 0.00 57.45 58.24 2ptq n PHE 74 Cb 0.44 -2.32 -0.05 0.00 -0.00 0.00 0.00 39.48 37.55 2ptq n PHE 74 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 2ptq s SER 75 N 3.44 4.42 0.40 -2.13 1.04 -1.26 -5.00 113.70 114.60 2ptq s SER 75 Ca 1.03 -1.26 0.12 0.00 0.48 0.00 0.00 55.95 56.32 2ptq s SER 75 Cb -1.33 0.01 0.82 0.00 0.10 0.00 0.00 66.02 65.62 2ptq s SER 75 CO 0.75 -0.78 1.91 -0.33 0.98 0.00 0.00 173.24 175.77 2ptq h GLU 76 N 1.21 0.11 -0.72 4.02 5.08 -1.99 -0.81 114.58 121.49 2ptq h GLU 76 Ca -0.41 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 57.85 2ptq h GLU 76 Cb 1.28 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 2ptq h GLU 76 CO 0.67 0.33 0.19 0.93 -1.00 0.00 0.00 179.01 180.13 2ptq h GLU 77 N 0.11 1.14 -0.39 2.33 3.07 -1.98 0.20 114.58 119.06 2ptq h GLU 77 Ca 0.02 -0.27 -0.04 0.00 -0.50 0.00 0.00 59.36 58.57 2ptq h GLU 77 Cb 0.44 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 28.18 2ptq h GLU 77 CO 0.03 1.00 0.08 -0.44 -1.40 0.00 0.00 179.01 178.28 2ptq h ASP 78 N 1.08 0.61 -0.89 1.42 3.32 -1.66 -1.87 116.42 118.43 2ptq h ASP 78 Ca 0.23 -0.25 0.02 0.00 0.02 0.00 0.00 57.03 57.05 2ptq h ASP 78 Cb 0.36 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.70 2ptq h ASP 78 CO -0.00 0.70 0.58 0.00 -1.72 0.00 0.00 179.24 178.80 2ptq h ALA 79 N 0.93 1.15 -0.74 3.45 0.00 -0.69 -1.77 119.26 121.59 2ptq h ALA 79 Ca 0.12 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2ptq h ALA 79 Cb 0.34 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2ptq h ALA 79 CO 0.00 0.47 0.35 0.00 0.00 0.00 0.00 179.25 180.08 2ptq h ALA 80 N 1.35 1.23 -0.28 0.00 0.00 -0.29 -1.27 119.26 120.00 2ptq h ALA 80 Ca 0.34 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2ptq h ALA 80 Cb -0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2ptq h ALA 80 CO -0.10 0.59 0.16 -0.09 0.00 0.00 0.00 179.25 179.82 2ptq h ARG 81 N 1.05 0.38 -0.54 0.00 9.65 -0.52 0.59 114.38 124.98 2ptq h ARG 81 Ca 0.26 -0.04 0.04 0.00 -1.10 0.00 0.00 59.98 59.13 2ptq h ARG 81 Cb 0.11 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 28.57 2ptq h ARG 81 CO -0.03 0.31 0.30 0.82 2.80 0.00 0.00 179.97 184.17 2ptq h ILE 82 N 0.35 1.00 -0.37 1.20 2.04 -0.96 -0.09 117.51 120.68 2ptq h ILE 82 Ca 0.10 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 2ptq h ILE 82 Cb 0.03 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 2ptq h ILE 82 CO -0.02 0.11 0.16 0.11 0.00 0.00 0.00 178.15 178.51 2ptq h LYS 83 N 0.59 0.52 -0.26 2.37 1.79 -0.81 0.20 116.57 120.98 2ptq h LYS 83 Ca 0.23 -0.06 -0.05 0.00 -2.18 0.00 0.00 60.65 58.59 2ptq h LYS 83 Cb 0.09 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.63 2ptq h LYS 83 CO -0.13 0.43 -0.04 1.15 -1.08 0.00 0.00 179.45 179.78 2ptq h THR 84 N 0.52 1.27 -0.37 -0.16 2.02 0.38 -2.52 112.91 114.06 2ptq h THR 84 Ca 0.13 -1.01 -0.07 0.00 0.77 0.00 0.00 66.41 66.23 2ptq h THR 84 Cb 0.10 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 2ptq h THR 84 CO -0.01 0.32 -0.06 0.40 0.37 0.00 0.00 175.52 176.53 2ptq h ILE 85 N 0.24 1.23 0.00 3.11 2.04 -0.37 -2.24 117.51 121.52 2ptq h ILE 85 Ca 0.07 -0.98 -0.02 0.00 1.00 0.00 0.00 64.86 64.93 2ptq h ILE 85 Cb 0.48 1.01 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 2ptq h ILE 85 CO 0.02 0.33 -0.09 -0.08 0.00 0.00 0.00 178.15 178.33 2ptq h GLU 86 N 0.58 0.00 -0.10 2.37 4.81 -0.37 -0.83 114.58 121.04 2ptq h GLU 86 Ca 0.11 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 2ptq h GLU 86 Cb 0.45 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 2ptq h GLU 86 CO 0.02 0.09 0.09 0.00 -0.73 0.00 0.00 179.01 178.48 2ptq h ARG 87 N 0.00 0.00 0.00 1.92 3.08 -0.97 0.37 114.38 118.78 2ptq h ARG 87 Ca -0.00 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.79 2ptq h ARG 87 Cb 0.19 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.20 2ptq h ARG 87 CO 0.01 0.00 -1.43 2.41 -1.07 0.00 0.00 179.97 179.89 2ptq n THR 88 N -4.14 1.53 0.11 2.04 -1.04 -0.37 -4.51 114.28 107.90 2ptq n THR 88 Ca -0.01 -0.07 -0.03 0.00 -2.04 0.00 0.00 64.05 61.90 2ptq n THR 88 Cb 0.20 -2.03 0.17 0.00 -1.82 0.00 0.00 70.33 66.85 2ptq n THR 88 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 2ptq h THR 89 N -1.00 1.37 -3.87 12.58 1.35 -1.21 -3.46 112.91 118.66 2ptq h THR 89 Ca -0.39 -1.85 -0.40 0.00 -0.55 0.00 0.00 66.41 63.22 2ptq h THR 89 Cb 1.33 1.93 0.02 0.00 -1.73 0.00 0.00 68.15 69.70 2ptq h THR 89 CO -0.24 0.54 -0.57 -3.20 -0.25 0.00 0.00 175.52 171.81 2ptq n ASN 90 N -3.91 -5.88 -3.41 5.36 4.05 0.13 -4.95 115.26 106.65 2ptq n ASN 90 Ca -0.02 -0.16 -0.09 0.00 0.45 0.00 0.00 54.58 54.77 2ptq n ASN 90 Cb 0.57 -4.82 -0.08 0.00 1.23 0.00 0.00 39.78 36.67 2ptq n ASN 90 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 177.26 171.93 2ptq s HIS 91 N -3.09 -0.84 0.09 1.20 2.46 -1.26 -5.08 115.29 108.76 2ptq s HIS 91 Ca 0.17 1.01 -0.19 0.00 0.47 0.00 0.00 55.06 56.52 2ptq s HIS 91 Cb -0.08 0.10 -0.08 0.00 -0.13 0.00 0.00 32.58 32.39 2ptq s HIS 91 CO 0.21 -0.67 1.55 0.38 -2.47 0.00 0.00 174.74 173.74 2ptq h ASP 92 N 8.18 0.37 -0.03 9.88 -0.00 -1.92 -2.52 116.42 130.39 2ptq h ASP 92 Ca -0.19 -0.27 -0.07 0.00 -0.00 0.00 0.00 57.03 56.50 2ptq h ASP 92 Cb 1.15 -0.10 -0.01 0.00 -0.00 0.00 0.00 39.33 40.36 2ptq h ASP 92 CO 0.24 0.55 -0.18 0.58 -0.00 0.00 0.00 179.24 180.42 2ptq h VAL 93 N 0.19 1.23 -0.13 4.15 2.07 -1.98 -1.65 116.25 120.14 2ptq h VAL 93 Ca 0.07 -1.06 -0.09 0.00 0.82 0.00 0.00 66.70 66.44 2ptq h VAL 93 Cb 0.33 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 2ptq h VAL 93 CO 0.01 0.34 -0.32 0.50 0.02 0.00 0.00 177.57 178.11 2ptq h LYS 94 N 0.35 0.25 -0.23 1.57 1.63 -1.99 -1.71 116.57 116.44 2ptq h LYS 94 Ca 0.06 -0.10 -0.10 0.00 -0.85 0.00 0.00 60.65 59.67 2ptq h LYS 94 Cb 0.53 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.13 2ptq h LYS 94 CO 0.03 0.55 -0.27 0.00 -3.45 0.00 0.00 179.45 176.31 2ptq h ALA 95 N 1.46 1.10 -0.43 5.00 0.00 -0.87 -1.49 119.26 124.03 2ptq h ALA 95 Ca 0.03 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 2ptq h ALA 95 Cb 0.68 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2ptq h ALA 95 CO 0.05 0.56 0.03 0.28 0.00 0.00 0.00 179.25 180.17 2ptq h VAL 96 N 0.40 1.25 -0.23 0.00 2.07 -0.58 0.54 116.25 119.71 2ptq h VAL 96 Ca 0.06 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.61 2ptq h VAL 96 Cb 0.68 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 2ptq h VAL 96 CO 0.05 0.33 0.13 -0.08 0.02 0.00 0.00 177.57 178.03 2ptq h GLU 97 N 0.59 0.27 -0.61 1.57 4.81 -0.97 -0.60 114.58 119.64 2ptq h GLU 97 Ca 0.13 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.28 2ptq h GLU 97 Cb 0.44 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.74 2ptq h GLU 97 CO 0.02 0.18 0.14 1.88 -0.73 0.00 0.00 179.01 180.50 2ptq h TYR 98 N 0.28 0.98 0.06 0.92 0.99 -1.15 -0.77 116.97 118.28 2ptq h TYR 98 Ca 0.09 -0.10 0.02 0.00 2.00 0.00 0.00 58.73 60.73 2ptq h TYR 98 Cb -0.01 -0.28 -0.03 0.00 1.00 0.00 0.00 36.73 37.42 2ptq h TYR 98 CO -0.08 0.82 -0.16 0.35 -0.00 0.00 0.00 178.16 179.08 2ptq h PHE 99 N 0.91 -0.43 -0.78 4.88 3.57 -0.30 -0.96 116.94 123.83 2ptq h PHE 99 Ca 0.19 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 2ptq h PHE 99 Cb 0.33 0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.22 2ptq h PHE 99 CO 0.02 -0.24 0.39 -0.07 -2.23 0.00 0.00 178.31 176.18 2ptq h LEU 100 N -0.30 1.00 -0.88 0.59 3.38 -0.84 -1.53 115.31 116.73 2ptq h LEU 100 Ca 0.03 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2ptq h LEU 100 Cb 0.34 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 2ptq h LEU 100 CO -0.11 0.83 0.51 0.11 0.09 0.00 0.00 178.44 179.86 2ptq h LYS 101 N 1.11 1.20 -0.65 1.13 1.57 -0.71 -1.66 116.57 118.56 2ptq h LYS 101 Ca 0.27 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.86 2ptq h LYS 101 Cb 0.08 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 2ptq h LYS 101 CO -0.04 0.86 0.12 0.93 -0.57 0.00 0.00 179.45 180.75 2ptq h GLU 102 N 1.21 1.05 -0.35 3.15 5.08 -0.57 -2.84 114.58 121.31 2ptq h GLU 102 Ca 0.31 -0.27 -0.08 0.00 -1.00 0.00 0.00 59.36 58.33 2ptq h GLU 102 Cb -0.01 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 2ptq h GLU 102 CO -0.05 0.96 -0.11 0.87 -1.00 0.00 0.00 179.01 179.68 2ptq h LYS 103 N 0.99 0.61 0.00 2.33 1.79 -0.54 -3.14 116.57 118.62 2ptq h LYS 103 Ca 0.20 -0.18 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2ptq h LYS 103 Cb 0.41 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.00 2ptq h LYS 103 CO 0.01 0.71 -0.47 1.33 -1.08 0.00 0.00 179.45 179.95 2ptq n VAL 104 N -4.19 0.30 -0.12 0.50 0.24 -0.70 -4.24 118.33 110.12 2ptq n VAL 104 Ca 0.01 -0.20 0.26 0.00 -2.04 0.00 0.00 64.34 62.37 2ptq n VAL 104 Cb 0.33 -0.15 0.72 0.00 -1.47 0.00 0.00 33.84 33.27 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 2.64 2.69 -0.00 2.33 0.00 -1.45 -0.09 119.26 125.38 2ptq h ALA 105 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2ptq h ALA 105 Cb 0.68 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2ptq h ALA 105 CO 0.00 -1.00 -0.15 -0.85 0.00 0.00 0.00 179.25 177.25 2ptq n GLU 106 N -4.16 0.53 -3.79 0.00 0.28 -1.26 -4.58 120.64 107.66 2ptq n GLU 106 Ca 0.16 -0.19 -0.36 0.00 -0.16 0.00 0.00 57.16 56.60 2ptq n GLU 106 Cb 0.88 -1.50 -0.12 0.00 1.43 0.00 0.00 31.44 32.14 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 -2.60 3.30 0.28 3.84 -1.09 -0.06 -5.00 121.20 119.87 2ptq s ILE 107 Ca 0.25 -1.92 -0.06 0.00 -2.23 0.00 0.00 60.65 56.68 2ptq s ILE 107 Cb 0.20 -3.20 0.40 0.00 -1.58 0.00 0.00 42.46 38.28 2ptq s ILE 107 CO 0.51 -0.60 1.58 1.55 -1.23 0.00 0.00 174.94 176.75 2ptq h PRO 108 N 8.06 0.01 -0.22 2.79 0.13 -1.81 0.68 132.00 141.64 2ptq h PRO 108 Ca -0.15 -0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.03 2ptq h PRO 108 Cb 1.05 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.13 2ptq h PRO 108 CO 0.68 0.01 -0.11 1.49 -0.23 0.00 0.00 178.00 179.84 2ptq h GLU 109 N 0.01 -0.08 -0.09 0.86 4.81 -1.94 0.09 114.58 118.24 2ptq h GLU 109 Ca 0.48 0.01 -0.19 0.00 -0.13 0.00 0.00 59.36 59.53 2ptq h GLU 109 Cb 0.83 0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.23 2ptq h GLU 109 CO -0.92 -0.05 -0.67 -0.07 -0.73 0.00 0.00 179.01 176.57 2ptq h LEU 110 N -0.08 0.74 -1.42 1.64 3.38 -1.22 -3.23 115.31 115.11 2ptq h LEU 110 Ca 0.12 -0.67 0.02 0.00 0.09 0.00 0.00 57.88 57.45 2ptq h LEU 110 Cb 0.26 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 2ptq h LEU 110 CO -0.28 1.30 0.41 -0.74 0.09 0.00 0.00 178.44 179.22 2ptq h HIS 111 N 0.25 0.73 0.00 1.13 2.76 0.44 -1.68 115.15 118.78 2ptq h HIS 111 Ca -0.06 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.12 2ptq h HIS 111 Cb 1.32 -0.24 -0.00 0.00 1.55 0.00 0.00 27.41 30.03 2ptq h HIS 111 CO 0.11 0.44 -0.04 0.00 -1.30 0.00 0.00 177.93 177.14 2ptq h ALA 112 N 1.63 1.74 -0.40 5.26 0.00 -1.00 -1.77 119.26 124.74 2ptq h ALA 112 Ca 0.24 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.94 2ptq h ALA 112 Cb 0.03 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.70 2ptq h ALA 112 CO -0.06 0.05 0.01 1.33 0.00 0.00 0.00 179.25 180.57 2ptq n VAL 113 N -4.21 2.57 -0.22 0.00 0.24 -0.66 -4.77 118.33 111.27 2ptq n VAL 113 Ca -0.03 -2.49 0.02 0.00 -2.04 0.00 0.00 64.34 59.80 2ptq n VAL 113 Cb 0.12 -0.32 0.14 0.00 -1.47 0.00 0.00 33.84 32.31 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 1.17 0.18 0.00 -1.34 0.87 -1.04 -1.25 113.55 112.14 2ptq h SER 114 Ca 0.22 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 2ptq h SER 114 Cb 1.74 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.79 2ptq h SER 114 CO 0.43 0.09 0.00 -0.62 -0.53 0.00 0.00 176.83 176.20 2ptq n GLU 115 N -5.03 0.64 0.00 2.24 -0.58 -1.26 -2.13 120.64 114.51 2ptq n GLU 115 Ca 0.11 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.97 2ptq n GLU 115 Cb 0.34 -1.32 0.16 0.00 -0.57 0.00 0.00 31.44 30.05 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 -0.82 0.00 -2.24 -0.32 3.01 -0.47 -4.65 117.46 111.97 2ptq n PHE 116 Ca 0.10 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.14 2ptq n PHE 116 Cb 0.05 -0.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.45 2ptq n PHE 116 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2ptq s ILE 117 N -2.39 3.61 -0.54 4.37 1.01 -0.91 -1.64 121.20 124.71 2ptq s ILE 117 Ca 0.23 1.10 0.00 0.00 0.00 0.00 0.00 60.65 61.98 2ptq s ILE 117 Cb 0.19 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.95 2ptq s ILE 117 CO 0.51 0.05 0.00 1.57 0.00 0.00 0.00 174.94 177.07 2ptq n HIS 118 N 4.52 0.00 -1.69 3.97 -0.00 -1.26 -4.92 115.22 115.83 2ptq n HIS 118 Ca 0.12 0.00 -0.55 0.00 -0.00 0.00 0.00 57.72 57.29 2ptq n HIS 118 Cb 0.44 -1.43 -0.06 0.00 -0.00 0.00 0.00 29.99 28.93 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 -2.63 2.07 -0.61 1.57 7.35 -0.65 -1.07 117.46 123.48 2ptq n PHE 119 Ca -0.05 0.43 0.00 0.00 -0.76 0.00 0.00 57.45 57.06 2ptq n PHE 119 Cb 0.28 -2.49 0.00 0.00 0.35 0.00 0.00 39.48 37.61 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 5.34 0.00 -1.89 3.13 0.00 -1.26 -4.96 120.51 120.86 2ptq n ALA 120 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.36 2ptq n ALA 120 Cb 0.17 -0.82 -0.06 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 -2.24 3.91 0.28 0.00 -1.32 -1.26 -4.85 115.64 110.15 2ptq s THR 122 Ca 0.60 -1.34 0.01 0.00 -1.21 0.00 0.00 61.69 59.74 2ptq s THR 122 Cb -0.09 -2.98 0.26 0.00 -1.51 0.00 0.00 72.50 68.18 2ptq s THR 122 CO 0.18 -0.11 1.76 0.28 -2.21 0.00 0.00 174.62 174.51 2ptq h SER 123 N 2.61 0.57 0.35 8.08 0.02 -1.96 -0.46 113.55 122.76 2ptq h SER 123 Ca -0.47 0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.57 2ptq h SER 123 Cb 1.20 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.75 2ptq h SER 123 CO 0.59 0.21 -0.03 -0.33 -1.14 0.00 0.00 176.83 176.13 2ptq h GLU 124 N 0.63 0.00 -0.50 3.45 4.39 -1.96 -0.26 114.58 120.33 2ptq h GLU 124 Ca 0.50 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 60.15 2ptq h GLU 124 Cb 0.76 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.39 2ptq h GLU 124 CO -0.39 0.03 0.10 -0.44 -1.16 0.00 0.00 179.01 177.15 2ptq h ASP 125 N 0.00 0.72 0.11 1.42 3.32 -1.34 -0.28 116.42 120.37 2ptq h ASP 125 Ca -0.00 -0.13 -0.17 0.00 0.02 0.00 0.00 57.03 56.75 2ptq h ASP 125 Cb 0.21 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 39.59 2ptq h ASP 125 CO 0.00 0.73 -0.78 0.40 -1.72 0.00 0.00 179.24 177.87 2ptq h ILE 126 N 0.74 1.48 0.12 0.35 1.08 -1.29 -3.30 117.51 116.70 2ptq h ILE 126 Ca 0.16 -2.49 0.01 0.00 -0.39 0.00 0.00 64.86 62.15 2ptq h ILE 126 Cb 0.31 3.15 -0.01 0.00 -3.07 0.00 0.00 36.82 37.20 2ptq h ILE 126 CO 0.00 0.69 -0.13 0.78 -0.69 0.00 0.00 178.15 178.80 2ptq h ASN 127 N -0.47 -0.35 -0.80 1.72 2.35 -0.96 -1.71 115.58 115.36 2ptq h ASN 127 Ca -0.15 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2ptq h ASN 127 Cb 1.56 0.12 -0.04 0.00 0.05 0.00 0.00 38.32 40.01 2ptq h ASN 127 CO 0.11 -0.20 0.49 -0.55 -1.65 0.00 0.00 177.43 175.63 2ptq h ASN 128 N -0.28 0.95 0.46 5.81 -1.07 -1.22 0.11 115.58 120.34 2ptq h ASN 128 Ca 0.01 -0.05 -0.11 0.00 0.07 0.00 0.00 56.30 56.22 2ptq h ASN 128 Cb 0.27 -0.24 -0.01 0.00 -2.07 0.00 0.00 38.32 36.27 2ptq h ASN 128 CO -0.04 0.72 -0.49 -0.07 0.07 0.00 0.00 177.43 177.62 2ptq h LEU 129 N 1.10 0.04 -0.20 6.14 3.38 -1.61 -1.00 115.31 123.18 2ptq h LEU 129 Ca 0.29 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.14 2ptq h LEU 129 Cb -0.06 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2ptq h LEU 129 CO -0.06 0.53 -0.29 0.28 0.09 0.00 0.00 178.44 179.00 2ptq h SER 130 N 0.03 0.59 -0.78 -0.43 0.02 -0.30 -1.88 113.55 110.80 2ptq h SER 130 Ca -0.00 -0.52 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 2ptq h SER 130 Cb 0.88 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.21 2ptq h SER 130 CO 0.07 0.99 0.50 0.45 -1.14 0.00 0.00 176.83 177.70 2ptq h HIS 131 N 0.20 1.01 -0.60 3.45 3.86 -0.77 0.81 115.15 123.11 2ptq h HIS 131 Ca 0.02 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.23 2ptq h HIS 131 Cb 0.86 -0.34 -0.03 0.00 1.06 0.00 0.00 27.41 28.97 2ptq h HIS 131 CO 0.09 0.66 0.31 0.00 0.86 0.00 0.00 177.93 179.85 2ptq h ALA 132 N 1.27 0.77 -0.52 2.45 0.00 -1.12 -0.12 119.26 121.99 2ptq h ALA 132 Ca 0.28 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 2ptq h ALA 132 Cb -0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 2ptq h ALA 132 CO -0.06 0.30 -0.02 -0.07 0.00 0.00 0.00 179.25 179.41 2ptq h LEU 133 N 0.81 0.88 -0.11 0.00 3.38 -0.83 0.34 115.31 119.78 2ptq h LEU 133 Ca 0.21 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2ptq h LEU 133 Cb 0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 2ptq h LEU 133 CO -0.03 0.95 0.05 0.24 0.09 0.00 0.00 178.44 179.73 2ptq h MET 134 N 0.83 0.16 -0.42 1.13 2.86 -0.40 -1.41 114.93 117.68 2ptq h MET 134 Ca 0.15 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.67 2ptq h MET 134 Cb 0.52 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 2ptq h MET 134 CO 0.03 0.26 -0.12 -0.07 1.06 0.00 0.00 176.91 178.07 2ptq h LEU 135 N 0.03 0.84 -0.57 1.22 3.38 -0.87 -1.37 115.31 117.97 2ptq h LEU 135 Ca 0.04 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 2ptq h LEU 135 Cb 0.16 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2ptq h LEU 135 CO -0.00 1.02 0.26 0.50 0.09 0.00 0.00 178.44 180.30 2ptq h LYS 136 N 0.66 0.83 -0.23 1.13 3.64 -0.91 -0.33 116.57 121.35 2ptq h LYS 136 Ca 0.11 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2ptq h LYS 136 Cb 0.66 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 2ptq h LYS 136 CO 0.05 0.69 0.12 1.15 -2.27 0.00 0.00 179.45 179.19 2ptq h THR 137 N 0.77 1.12 -0.75 1.00 2.02 -1.17 -1.21 112.91 114.70 2ptq h THR 137 Ca 0.19 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 2ptq h THR 137 Cb 0.15 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 2ptq h THR 137 CO -0.02 0.12 0.45 0.00 0.37 0.00 0.00 175.52 176.43 2ptq h ALA 138 N 1.00 0.95 0.44 6.16 0.00 -1.03 0.39 119.26 127.18 2ptq h ALA 138 Ca 0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2ptq h ALA 138 Cb 0.08 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2ptq h ALA 138 CO -0.01 0.43 -0.21 -0.09 0.00 0.00 0.00 179.25 179.36 2ptq h ARG 139 N 1.02 -0.58 -0.04 0.00 2.43 -0.84 0.18 114.38 116.55 2ptq h ARG 139 Ca 0.27 0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.34 2ptq h ARG 139 Cb -0.03 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 2ptq h ARG 139 CO -0.05 -0.28 -0.60 -0.44 -1.51 0.00 0.00 179.97 177.09 2ptq h ASP 140 N -0.84 0.17 0.00 -3.80 3.32 -1.19 -1.95 116.42 112.13 2ptq h ASP 140 Ca -0.06 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.89 2ptq h ASP 140 Cb 0.56 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.06 2ptq h ASP 140 CO 0.10 0.73 -1.88 -0.62 -1.72 0.00 0.00 179.24 175.85 2ptq n GLU 141 N -3.85 0.60 0.06 3.56 1.02 0.12 -4.69 120.64 117.46 2ptq n GLU 141 Ca -0.02 -0.18 0.00 0.00 -0.02 0.00 0.00 57.16 56.94 2ptq n GLU 141 Cb 0.61 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 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 -2.17 1.10 0.47 2.62 0.31 -0.39 -4.75 118.33 115.52 2ptq n VAL 142 Ca -0.03 0.36 -0.19 0.00 -0.01 0.00 0.00 64.34 64.47 2ptq n VAL 142 Cb 0.51 -1.49 -0.09 0.00 -0.91 0.00 0.00 33.84 31.87 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 0.00 0.10 -0.79 2.52 2.04 -0.75 -2.91 117.51 117.72 2ptq h ILE 143 Ca 0.00 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 65.90 2ptq h ILE 143 Cb 0.02 0.11 -0.05 0.00 -0.74 0.00 0.00 36.82 36.15 2ptq h ILE 143 CO 0.00 0.00 0.52 -0.07 0.00 0.00 0.00 178.15 178.60 2ptq h LEU 144 N -1.23 0.66 -1.02 1.44 3.38 -1.59 -0.62 115.31 116.34 2ptq h LEU 144 Ca -0.12 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 2ptq h LEU 144 Cb 0.91 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 2ptq h LEU 144 CO 0.20 0.40 -0.15 1.55 0.09 0.00 0.00 178.44 180.52 2ptq h PRO 145 N 0.74 0.53 -0.31 1.13 0.13 -1.78 0.86 132.00 133.29 2ptq h PRO 145 Ca 0.36 -0.17 -0.17 0.00 -0.87 0.00 0.00 66.00 65.16 2ptq h PRO 145 Cb 0.43 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.51 2ptq h PRO 145 CO -0.14 0.67 -0.46 1.88 -0.23 0.00 0.00 178.00 179.72 2ptq h TYR 146 N 0.48 1.01 -0.63 1.56 -1.99 -1.05 -2.31 116.97 114.04 2ptq h TYR 146 Ca 0.08 -0.33 -0.04 0.00 2.00 0.00 0.00 58.73 60.45 2ptq h TYR 146 Cb 0.55 -0.20 -0.03 0.00 2.00 0.00 0.00 36.73 39.05 2ptq h TYR 146 CO 0.02 1.13 0.23 -1.49 -0.00 0.00 0.00 178.16 178.05 2ptq h TRP 147 N 0.66 0.95 -0.34 4.88 4.06 -0.72 -1.18 115.95 124.25 2ptq h TRP 147 Ca 0.04 -0.07 -0.10 0.00 2.06 0.00 0.00 58.89 60.82 2ptq h TRP 147 Cb 1.05 -0.29 -0.02 0.00 -1.00 0.00 0.00 29.16 28.90 2ptq h TRP 147 CO 0.06 0.74 -0.20 -0.09 -3.56 0.00 0.00 178.44 175.40 2ptq h ARG 148 N 0.92 0.64 -0.60 0.49 9.65 -0.70 -0.81 114.38 123.96 2ptq h ARG 148 Ca 0.21 -0.23 -0.10 0.00 -1.10 0.00 0.00 59.98 58.76 2ptq h ARG 148 Cb 0.21 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 2ptq h ARG 148 CO -0.01 0.80 -0.02 1.96 2.80 0.00 0.00 179.97 185.49 2ptq h GLN 149 N 0.57 1.08 -0.09 0.20 4.20 -0.81 -0.18 115.11 120.07 2ptq h GLN 149 Ca 0.09 -0.36 -0.02 0.00 0.06 0.00 0.00 58.65 58.42 2ptq h GLN 149 Cb 0.65 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.34 2ptq h GLN 149 CO 0.05 1.06 -0.02 -0.07 -0.67 0.00 0.00 178.83 179.18 2ptq h LEU 150 N 0.98 0.18 0.12 1.46 3.38 -1.00 -0.09 115.31 120.33 2ptq h LEU 150 Ca 0.17 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.78 2ptq h LEU 150 Cb 0.59 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2ptq h LEU 150 CO 0.04 0.50 -0.12 0.40 0.09 0.00 0.00 178.44 179.34 2ptq h ILE 151 N -0.15 0.72 -0.51 1.22 2.04 -1.09 0.13 117.51 119.87 2ptq h ILE 151 Ca 0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 2ptq h ILE 151 Cb 0.42 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2ptq h ILE 151 CO 0.01 0.00 0.28 0.44 0.00 0.00 0.00 178.15 178.88 2ptq h ASP 152 N -0.27 0.61 -0.26 1.72 3.32 -1.05 -0.56 116.42 119.94 2ptq h ASP 152 Ca 0.01 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 2ptq h ASP 152 Cb 0.26 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2ptq h ASP 152 CO -0.04 0.50 0.05 1.23 -1.72 0.00 0.00 179.24 179.25 2ptq h GLY 153 N 0.77 0.45 1.21 2.75 0.00 -0.34 -0.52 103.07 107.40 2ptq h GLY 153 Ca 0.18 -0.30 -0.06 0.00 0.00 0.00 0.00 47.33 47.15 2ptq h GLY 153 CO -0.03 0.28 0.14 1.41 0.00 0.00 0.00 176.54 178.34 2ptq h LEU 154 N 0.24 0.93 -0.95 3.11 -0.00 -0.32 -1.96 115.31 116.35 2ptq h LEU 154 Ca 0.08 -0.19 -0.07 0.00 -0.00 0.00 0.00 57.88 57.70 2ptq h LEU 154 Cb 0.32 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 40.71 2ptq h LEU 154 CO 0.00 0.90 0.02 0.11 -0.00 0.00 0.00 178.44 179.47 2ptq h LYS 155 N 0.94 0.78 -0.63 1.13 1.57 -0.92 0.13 116.57 119.56 2ptq h LYS 155 Ca 0.20 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 2ptq h LYS 155 Cb 0.34 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 2ptq h LYS 155 CO 0.00 0.78 0.08 -0.44 -0.57 0.00 0.00 179.45 179.30 2ptq h ASP 156 N 0.74 1.03 -0.46 0.86 3.32 -0.66 -1.57 116.42 119.68 2ptq h ASP 156 Ca 0.15 -0.27 -0.11 0.00 0.02 0.00 0.00 57.03 56.82 2ptq h ASP 156 Cb 0.42 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2ptq h ASP 156 CO 0.02 1.04 -0.11 -0.07 -1.72 0.00 0.00 179.24 178.40 2ptq h LEU 157 N 0.98 0.92 -0.32 1.55 3.38 -0.99 -0.12 115.31 120.72 2ptq h LEU 157 Ca 0.19 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.88 2ptq h LEU 157 Cb 0.47 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 2ptq h LEU 157 CO 0.02 1.04 0.18 0.00 0.09 0.00 0.00 178.44 179.77 2ptq h ALA 158 N 1.04 0.39 -0.16 1.53 0.00 -0.59 0.29 119.26 121.76 2ptq h ALA 158 Ca 0.13 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2ptq h ALA 158 Cb 0.64 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 2ptq h ALA 158 CO 0.04 -0.19 -0.07 0.28 0.00 0.00 0.00 179.25 179.32 2ptq h VAL 159 N 0.36 1.30 -0.42 0.00 2.07 -1.15 0.16 116.25 118.57 2ptq h VAL 159 Ca 0.13 -1.09 0.02 0.00 0.82 0.00 0.00 66.70 66.57 2ptq h VAL 159 Cb 0.01 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 2ptq h VAL 159 CO -0.07 0.32 0.28 -0.61 0.02 0.00 0.00 177.57 177.51 2ptq h GLN 160 N 0.02 0.50 -0.21 1.57 4.15 -0.82 -2.72 115.11 117.60 2ptq h GLN 160 Ca 0.04 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 2ptq h GLN 160 Cb 0.53 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 2ptq h GLN 160 CO 0.02 0.33 -0.01 0.66 -1.93 0.00 0.00 178.83 177.90 2ptq n TYR 161 N -4.48 0.75 -0.31 3.99 0.53 0.07 -4.80 117.16 112.91 2ptq n TYR 161 Ca 0.04 -0.96 0.13 0.00 -1.02 0.00 0.00 57.90 56.09 2ptq n TYR 161 Cb 0.10 -0.29 0.31 0.00 -1.03 0.00 0.00 39.34 38.43 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 1.35 0.46 -0.50 -0.72 0.11 -0.62 0.15 114.38 114.62 2ptq h ARG 162 Ca 0.02 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2ptq h ARG 162 Cb 1.36 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 32.34 2ptq h ARG 162 CO 0.19 0.30 0.00 -0.40 0.10 0.00 0.00 179.97 180.16 2ptq n ASP 163 N -4.99 3.54 -4.58 0.08 3.85 -1.26 -4.35 116.55 108.83 2ptq n ASP 163 Ca 0.22 -2.13 -0.43 0.00 -0.71 0.00 0.00 54.79 51.74 2ptq n ASP 163 Cb 0.64 -0.38 -0.03 0.00 -1.35 0.00 0.00 41.12 40.00 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 -1.24 4.38 0.60 2.12 1.01 -0.98 -4.98 121.20 122.10 2ptq s ILE 164 Ca 0.36 1.00 -0.20 0.00 0.00 0.00 0.00 60.65 61.81 2ptq s ILE 164 Cb 0.20 -4.49 -0.03 0.00 0.01 0.00 0.00 42.46 38.15 2ptq s ILE 164 CO 0.22 -0.87 1.30 -2.65 0.00 0.00 0.00 174.94 172.94 2ptq n PRO 165 N 7.40 1.38 -3.78 2.79 -0.02 -1.26 -0.28 135.00 141.23 2ptq n PRO 165 Ca 0.09 0.52 -0.13 0.00 -2.02 0.00 0.00 63.50 61.95 2ptq n PRO 165 Cb 0.49 -2.53 -0.14 0.00 -0.02 0.00 0.00 33.50 31.30 2ptq n PRO 165 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2ptq s LEU 166 N -3.75 1.01 -0.59 2.45 2.96 0.48 -4.64 118.68 116.60 2ptq s LEU 166 Ca 0.77 0.26 -0.28 0.00 -0.22 0.00 0.00 54.13 54.66 2ptq s LEU 166 Cb -0.40 0.35 0.03 0.00 0.50 0.00 0.00 46.19 46.66 2ptq s LEU 166 CO 0.45 -0.11 1.24 -0.22 -1.32 0.00 0.00 176.35 176.39 2ptq s LEU 167 N 0.81 3.42 0.93 -0.68 2.96 -1.26 -1.15 118.68 123.71 2ptq s LEU 167 Ca -0.06 0.10 -0.10 0.00 -0.22 0.00 0.00 54.13 53.84 2ptq s LEU 167 Cb -0.08 -3.10 0.15 0.00 0.50 0.00 0.00 46.19 43.67 2ptq s LEU 167 CO -0.04 -1.56 1.13 -0.44 -1.32 0.00 0.00 176.35 174.12 2ptq s SER 168 N 3.31 2.85 -0.13 3.68 0.01 -1.20 -4.77 113.70 117.46 2ptq s SER 168 Ca 0.44 2.07 -0.01 0.00 1.31 0.00 0.00 55.95 59.76 2ptq s SER 168 Cb -0.08 -2.53 0.04 0.00 0.21 0.00 0.00 66.02 63.66 2ptq s SER 168 CO 0.24 -3.13 -0.01 -0.13 0.41 0.00 0.00 173.24 170.62 2ptq s ARG 169 N -4.66 0.94 -0.09 12.44 1.81 -1.26 -0.36 118.95 127.78 2ptq s ARG 169 Ca 0.66 -0.21 0.04 0.00 -1.72 0.00 0.00 55.73 54.51 2ptq s ARG 169 Cb -0.22 -1.56 -0.00 0.00 -0.45 0.00 0.00 34.95 32.72 2ptq s ARG 169 CO 0.58 -0.40 -0.23 0.95 -0.68 0.00 0.00 175.30 175.52 2ptq s THR 170 N 1.83 1.96 -1.65 0.02 -4.23 -0.62 -4.42 115.64 108.54 2ptq s THR 170 Ca 0.03 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.56 2ptq s THR 170 Cb -0.14 -1.69 0.00 0.00 1.34 0.00 0.00 72.50 72.01 2ptq s THR 170 CO -0.07 0.54 0.00 0.59 -0.54 0.00 0.00 174.62 175.14 2ptq n ASN 171 N 3.42 -4.88 0.00 3.99 4.13 -1.26 -1.03 115.26 119.63 2ptq n ASN 171 Ca -0.19 0.38 0.00 0.00 1.68 0.00 0.00 54.58 56.45 2ptq n ASN 171 Cb 0.53 -3.76 0.00 0.00 -1.54 0.00 0.00 39.78 35.01 2ptq n ASN 171 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ptq n GLY 172 N -1.06 1.84 3.90 7.41 0.00 -1.26 -5.02 105.19 111.00 2ptq n GLY 172 Ca -0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.01 3.57 -0.04 1.61 -1.52 -0.20 -4.93 119.66 118.14 2ptq s GLN 173 Ca 0.00 -0.17 -0.37 0.00 -1.95 0.00 0.00 55.36 52.87 2ptq s GLN 173 Cb 0.00 -2.91 -0.15 0.00 -0.22 0.00 0.00 33.01 29.74 2ptq s GLN 173 CO 0.00 0.51 1.61 -2.30 -0.25 0.00 0.00 175.29 174.86 2ptq n PRO 174 N 0.18 1.55 -4.26 2.91 -0.02 -1.26 -1.58 135.00 132.52 2ptq n PRO 174 Ca -0.03 0.56 -0.18 0.00 -2.02 0.00 0.00 63.50 61.83 2ptq n PRO 174 Cb 0.52 -2.28 -0.08 0.00 -0.02 0.00 0.00 33.50 31.63 2ptq n PRO 174 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ptq s ALA 175 N 2.16 1.70 -0.39 3.55 0.00 0.52 -4.85 121.76 124.44 2ptq s ALA 175 Ca 0.89 -1.99 -0.45 0.00 0.00 0.00 0.00 51.96 50.41 2ptq s ALA 175 Cb -0.88 1.45 -0.19 0.00 0.00 0.00 0.00 23.12 23.49 2ptq s ALA 175 CO 0.51 -0.67 1.55 2.41 0.00 0.00 0.00 175.76 179.57 2ptq n THR 176 N -0.58 0.05 -0.79 0.00 -1.04 -1.26 -3.21 114.28 107.45 2ptq n THR 176 Ca 0.06 -0.01 -0.32 0.00 -2.04 0.00 0.00 64.05 61.74 2ptq n THR 176 Cb 0.63 -0.56 0.14 0.00 -1.82 0.00 0.00 70.33 68.72 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 3.89 -0.30 -0.30 -2.82 -0.02 -1.25 -3.97 135.00 130.23 2ptq n PRO 177 Ca 0.29 -0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2ptq n PRO 177 Cb -0.01 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 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 -2.94 0.00 -4.23 2.55 2.88 -0.30 -4.60 113.62 106.99 2ptq n SER 178 Ca 0.10 -0.18 -0.20 0.00 -1.33 0.00 0.00 58.87 57.27 2ptq n SER 178 Cb 0.52 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.87 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 -1.70 1.35 0.24 2.46 -4.23 -1.26 -0.39 115.64 112.10 2ptq s THR 179 Ca 0.00 -1.53 -0.05 0.00 -1.18 0.00 0.00 61.69 58.93 2ptq s THR 179 Cb 0.00 -1.37 0.20 0.00 1.34 0.00 0.00 72.50 72.67 2ptq s THR 179 CO 0.00 -0.26 1.82 0.40 -0.54 0.00 0.00 174.62 176.04 2ptq h ILE 180 N 3.93 0.95 -0.97 2.99 1.08 -0.76 -1.88 117.51 122.85 2ptq h ILE 180 Ca -0.42 -0.28 0.00 0.00 -0.39 0.00 0.00 64.86 63.78 2ptq h ILE 180 Cb 1.19 0.06 -0.05 0.00 -3.07 0.00 0.00 36.82 34.96 2ptq h ILE 180 CO 0.44 0.15 0.61 1.23 -0.69 0.00 0.00 178.15 179.89 2ptq h GLY 181 N 0.81 1.39 1.03 5.37 0.00 -0.91 -2.35 103.07 108.41 2ptq h GLY 181 Ca 0.37 -0.55 -0.04 0.00 0.00 0.00 0.00 47.33 47.11 2ptq h GLY 181 CO -0.22 0.54 0.29 1.70 0.00 0.00 0.00 176.54 178.85 2ptq h LYS 182 N 1.33 1.09 0.00 4.80 1.63 -1.60 -0.20 116.57 123.62 2ptq h LYS 182 Ca 0.35 -0.20 -0.05 0.00 -0.85 0.00 0.00 60.65 59.90 2ptq h LYS 182 Cb -0.10 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 31.35 2ptq h LYS 182 CO -0.07 0.90 -0.23 0.93 -3.45 0.00 0.00 179.45 177.53 2ptq h GLU 183 N 1.05 0.00 0.15 1.90 4.39 -1.01 -1.81 114.58 119.25 2ptq h GLU 183 Ca 0.24 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.65 2ptq h GLU 183 Cb 0.22 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 28.90 2ptq h GLU 183 CO -0.02 0.23 -1.23 0.52 -1.16 0.00 0.00 179.01 177.35 2ptq h MET 184 N 0.00 0.57 -0.92 2.33 2.86 -0.93 -3.30 114.93 115.55 2ptq h MET 184 Ca -0.00 -0.81 0.04 0.00 -2.06 0.00 0.00 59.70 56.86 2ptq h MET 184 Cb 0.52 0.28 -0.06 0.00 0.06 0.00 0.00 31.60 32.40 2ptq h MET 184 CO 0.03 1.37 0.59 0.00 1.06 0.00 0.00 176.91 179.96 2ptq h ALA 185 N 0.24 1.22 -0.67 6.32 0.00 -0.51 -2.12 119.26 123.74 2ptq h ALA 185 Ca -0.20 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 54.76 2ptq h ALA 185 Cb 1.92 -0.31 -0.07 0.00 0.00 0.00 0.00 17.79 19.33 2ptq h ALA 185 CO 0.23 0.44 0.33 -0.91 0.00 0.00 0.00 179.25 179.35 2ptq h ASN 186 N 1.14 0.44 -0.31 0.00 2.35 -1.42 -1.43 115.58 116.35 2ptq h ASN 186 Ca 0.37 0.05 -0.06 0.00 -0.55 0.00 0.00 56.30 56.12 2ptq h ASN 186 Cb 0.03 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 2ptq h ASN 186 CO -0.13 0.26 -0.04 0.58 -1.65 0.00 0.00 177.43 176.45 2ptq h VAL 187 N 0.58 1.27 -1.01 2.81 2.07 -1.50 -2.56 116.25 117.92 2ptq h VAL 187 Ca 0.33 -1.04 0.03 0.00 0.82 0.00 0.00 66.70 66.83 2ptq h VAL 187 Cb 0.32 1.33 -0.06 0.00 -1.52 0.00 0.00 31.29 31.36 2ptq h VAL 187 CO -0.25 0.34 0.66 0.00 0.02 0.00 0.00 177.57 178.34 2ptq h ALA 188 N 0.81 1.32 -0.54 1.67 0.00 -1.00 -0.58 119.26 120.94 2ptq h ALA 188 Ca 0.08 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2ptq h ALA 188 Cb 0.51 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2ptq h ALA 188 CO 0.02 0.59 0.22 -0.92 0.00 0.00 0.00 179.25 179.17 2ptq h TYR 189 N 1.30 0.82 -0.58 0.00 5.03 -1.14 -1.16 116.97 121.24 2ptq h TYR 189 Ca 0.39 -0.06 -0.10 0.00 2.58 0.00 0.00 58.73 61.54 2ptq h TYR 189 Cb -0.05 -0.25 -0.02 0.00 1.55 0.00 0.00 36.73 37.96 2ptq h TYR 189 CO -0.00 0.67 -0.02 0.00 -1.32 0.00 0.00 178.16 177.48 2ptq h ARG 190 N 0.73 1.03 -0.71 1.82 3.08 -0.99 -2.65 114.38 116.70 2ptq h ARG 190 Ca 0.18 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 2ptq h ARG 190 Cb 0.19 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 2ptq h ARG 190 CO -0.02 1.02 0.35 0.52 -1.07 0.00 0.00 179.97 180.77 2ptq h MET 191 N 0.94 1.01 -0.51 0.04 2.86 -0.85 -2.65 114.93 115.77 2ptq h MET 191 Ca 0.16 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 2ptq h MET 191 Cb 0.57 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.03 2ptq h MET 191 CO 0.03 0.79 0.21 0.93 1.06 0.00 0.00 176.91 179.94 2ptq h GLU 192 N 0.98 0.73 -0.17 1.72 4.39 -1.03 -0.11 114.58 121.09 2ptq h GLU 192 Ca 0.24 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 2ptq h GLU 192 Cb 0.11 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2ptq h GLU 192 CO -0.03 0.59 0.08 0.00 -1.16 0.00 0.00 179.01 178.50 2ptq h ARG 193 N 0.72 0.24 -0.20 2.33 3.08 -1.12 -1.69 114.38 117.73 2ptq h ARG 193 Ca 0.18 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 60.11 2ptq h ARG 193 Cb 0.13 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2ptq h ARG 193 CO -0.02 0.27 -0.26 1.96 -1.07 0.00 0.00 179.97 180.85 2ptq h GLN 194 N 0.15 0.37 -0.12 0.04 1.08 -1.25 -2.04 115.11 113.34 2ptq h GLN 194 Ca 0.06 -0.13 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 2ptq h GLN 194 Cb 0.10 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.50 2ptq h GLN 194 CO -0.01 0.61 0.07 -0.92 -0.95 0.00 0.00 178.83 177.63 2ptq h TYR 195 N 0.33 0.13 -0.80 2.96 5.03 -0.72 0.17 116.97 124.08 2ptq h TYR 195 Ca 0.05 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.35 2ptq h TYR 195 Cb 0.63 -0.04 -0.04 0.00 1.55 0.00 0.00 36.73 38.84 2ptq h TYR 195 CO 0.02 0.08 0.44 0.00 -1.32 0.00 0.00 178.16 177.37 2ptq h ARG 196 N 0.15 1.11 -0.10 1.82 2.47 -1.08 -1.75 114.38 117.01 2ptq h ARG 196 Ca 0.05 -0.13 -0.01 0.00 -1.26 0.00 0.00 59.98 58.63 2ptq h ARG 196 Cb -0.00 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.09 2ptq h ARG 196 CO -0.02 0.82 0.02 1.96 0.56 0.00 0.00 179.97 183.31 2ptq h GLN 197 N 1.11 0.16 -0.72 0.04 4.20 -0.85 -1.80 115.11 117.24 2ptq h GLN 197 Ca 0.28 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 59.00 2ptq h GLN 197 Cb 0.03 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 27.74 2ptq h GLN 197 CO -0.05 0.33 0.43 1.25 -0.67 0.00 0.00 178.83 180.13 2ptq h LEU 198 N -0.05 0.67 -1.66 1.46 5.85 -0.50 -0.90 115.31 120.18 2ptq h LEU 198 Ca 0.03 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2ptq h LEU 198 Cb 0.25 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2ptq h LEU 198 CO 0.00 0.44 -0.19 -1.13 -0.34 0.00 0.00 178.44 177.22 2ptq h ASN 199 N 0.81 0.00 0.83 1.25 -1.24 -1.18 -2.59 115.58 113.47 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 0.13 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.18 2ptq h ASN 199 CO -0.16 0.19 -0.39 0.00 -1.29 0.00 0.00 177.43 175.79 2ptq n GLN 200 N -4.17 0.13 -1.82 6.67 6.02 -0.43 -4.91 117.38 118.87 2ptq n GLN 200 Ca -0.02 0.05 -0.41 0.00 -0.01 0.00 0.00 57.00 56.61 2ptq n GLN 200 Cb 0.26 -1.60 -0.01 0.00 1.02 0.00 0.00 30.24 29.92 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 -3.07 2.11 0.06 5.09 1.01 -0.70 -4.96 120.40 119.95 2ptq s VAL 201 Ca 0.10 0.11 -0.27 0.00 0.00 0.00 0.00 61.98 61.92 2ptq s VAL 201 Cb 0.16 -3.07 -0.05 0.00 0.00 0.00 0.00 36.38 33.42 2ptq s VAL 201 CO 0.66 0.02 0.85 -1.61 0.00 0.00 0.00 175.10 175.02 2ptq s GLU 202 N -1.73 4.57 -0.42 2.72 2.02 -1.26 -5.02 118.70 119.58 2ptq s GLU 202 Ca 0.55 1.22 -0.09 0.00 0.02 0.00 0.00 54.97 56.67 2ptq s GLU 202 Cb -0.46 -3.38 0.08 0.00 0.10 0.00 0.00 34.13 30.47 2ptq s GLU 202 CO 0.59 0.23 0.26 0.42 0.02 0.00 0.00 175.26 176.78 2ptq s ILE 203 N 0.05 4.17 0.30 -1.63 1.01 -1.26 -4.79 121.20 119.04 2ptq s ILE 203 Ca 0.42 -1.45 -0.06 0.00 0.00 0.00 0.00 60.65 59.56 2ptq s ILE 203 Cb -0.21 -3.57 -0.06 0.00 0.01 0.00 0.00 42.46 38.63 2ptq s ILE 203 CO 0.26 -0.52 0.59 -0.76 0.00 0.00 0.00 174.94 174.50 2ptq s LEU 204 N 1.41 4.04 0.09 2.97 1.43 -1.26 -1.66 118.68 125.69 2ptq s LEU 204 Ca 0.03 0.81 -0.13 0.00 -1.03 0.00 0.00 54.13 53.81 2ptq s LEU 204 Cb -0.23 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.38 2ptq s LEU 204 CO 0.02 -0.21 0.31 -0.83 0.23 0.00 0.00 176.35 175.86 2ptq s GLY 205 N -3.04 -0.11 0.21 -3.19 0.00 0.42 -4.73 107.32 96.87 2ptq s GLY 205 Ca 0.45 -0.22 -0.10 0.00 0.00 0.00 0.00 44.72 44.86 2ptq s GLY 205 CO 0.29 -0.44 0.36 -1.59 0.00 0.00 0.00 173.10 171.72 2ptq s LYS 206 N -3.47 1.36 -0.30 2.90 0.00 -1.26 -0.83 119.74 118.14 2ptq s LYS 206 Ca 0.01 -1.27 -0.06 0.00 0.00 0.00 0.00 55.97 54.66 2ptq s LYS 206 Cb 0.02 0.41 0.18 0.00 0.00 0.00 0.00 37.83 38.44 2ptq s LYS 206 CO -0.09 -0.53 0.76 -1.50 0.00 0.00 0.00 175.35 173.99 2ptq s ILE 207 N -4.02 -0.77 0.00 3.79 2.07 -1.26 -4.68 121.20 116.33 2ptq s ILE 207 Ca 0.23 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.47 2ptq s ILE 207 Cb 0.02 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.61 2ptq s ILE 207 CO 0.06 0.00 0.64 -0.46 -1.91 0.00 0.00 174.94 173.27 2ptq n ASN 208 N 5.43 -0.32 0.00 4.50 0.23 -1.26 -4.73 115.26 119.11 2ptq n ASN 208 Ca -0.04 -1.28 0.00 0.00 -0.53 0.00 0.00 54.58 52.73 2ptq n ASN 208 Cb 0.52 0.10 0.00 0.00 -2.08 0.00 0.00 39.78 38.32 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 -0.87 0.28 4.83 0.00 -1.26 -0.70 105.19 107.47 2ptq n GLY 209 Ca -0.09 -1.68 0.02 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.54 0.06 -0.31 4.61 0.00 -1.26 -2.54 120.51 120.52 2ptq n ALA 210 Ca 0.00 0.79 0.00 0.00 0.00 0.00 0.00 53.44 54.23 2ptq n ALA 210 Cb 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.02 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 -5.17 0.66 -0.14 0.00 0.24 -1.26 -4.10 118.33 108.55 2ptq n VAL 211 Ca 0.10 -0.67 0.00 0.00 -2.04 0.00 0.00 64.34 61.73 2ptq n VAL 211 Cb 0.34 0.68 0.00 0.00 -1.47 0.00 0.00 33.84 33.40 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 -0.33 0.91 0.35 7.63 0.00 -1.05 -3.97 105.19 108.73 2ptq n GLY 212 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 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 0.00 2.69 -2.01 1.61 3.02 -1.11 -4.77 115.26 114.70 2ptq n ASN 213 Ca 0.00 -2.48 -0.18 0.00 -0.03 0.00 0.00 54.58 51.90 2ptq n ASN 213 Cb 0.00 -0.27 -0.04 0.00 -0.61 0.00 0.00 39.78 38.86 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 -0.49 -0.71 -0.11 3.10 4.01 0.12 -4.88 117.16 118.20 2ptq n TYR 214 Ca 0.11 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.75 2ptq n TYR 214 Cb 0.52 -3.32 -0.05 0.00 -0.31 0.00 0.00 39.34 36.18 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 -1.45 -0.64 7.72 2.35 -1.94 -0.50 115.58 121.11 2ptq h ASN 215 Ca -0.39 0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 55.55 2ptq h ASN 215 Cb 1.23 0.63 -0.03 0.00 0.05 0.00 0.00 38.32 40.20 2ptq h ASN 215 CO 0.51 -0.38 0.31 0.00 -1.65 0.00 0.00 177.43 176.22 2ptq h ALA 216 N 0.35 0.83 -0.15 -0.83 0.00 -1.89 -1.41 119.26 116.17 2ptq h ALA 216 Ca 0.13 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2ptq h ALA 216 Cb 0.59 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2ptq h ALA 216 CO -0.56 0.40 -0.05 0.45 0.00 0.00 0.00 179.25 179.49 2ptq h HIS 217 N 0.89 -0.10 -0.14 0.00 3.86 -1.67 -2.59 115.15 115.39 2ptq h HIS 217 Ca 0.22 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.35 2ptq h HIS 217 Cb 0.12 0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 2ptq h HIS 217 CO 0.00 -0.08 -0.32 0.82 0.86 0.00 0.00 177.93 179.21 2ptq h ILE 218 N -0.02 1.27 -0.86 2.45 2.04 -0.98 0.66 117.51 122.08 2ptq h ILE 218 Ca 0.07 -1.32 -0.02 0.00 1.00 0.00 0.00 64.86 64.60 2ptq h ILE 218 Cb 0.13 1.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 2ptq h ILE 218 CO -0.16 0.40 0.47 0.00 0.00 0.00 0.00 178.15 178.86 2ptq h ALA 219 N 1.42 1.10 0.14 1.87 0.00 -0.88 -2.43 119.26 120.48 2ptq h ALA 219 Ca 0.03 -0.13 -0.36 0.00 0.00 0.00 0.00 54.91 54.46 2ptq h ALA 219 Cb 0.70 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2ptq h ALA 219 CO 0.05 0.61 -1.91 0.00 0.00 0.00 0.00 179.25 178.00 2ptq h ALA 220 N 1.25 0.35 -2.51 0.00 0.00 -1.35 -3.42 119.26 113.59 2ptq h ALA 220 Ca 0.30 -1.32 -0.60 0.00 0.00 0.00 0.00 54.91 53.30 2ptq h ALA 220 Cb 0.03 0.64 -0.41 0.00 0.00 0.00 0.00 17.79 18.05 2ptq h ALA 220 CO -0.05 1.22 -0.76 0.66 0.00 0.00 0.00 179.25 180.32 2ptq n TYR 221 N -3.54 1.80 0.30 0.00 4.02 0.21 -4.95 117.16 115.00 2ptq n TYR 221 Ca -0.30 -3.92 0.19 0.00 -0.01 0.00 0.00 57.90 53.86 2ptq n TYR 221 Cb 1.05 -0.36 0.86 0.00 -0.02 0.00 0.00 39.34 40.86 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 -1.63 -2.73 132.00 131.94 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 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 2ptq h PRO 222 CO 0.63 0.01 -0.24 0.39 -0.23 0.00 0.00 178.00 178.56 2ptq n GLU 223 N -3.13 0.50 -3.43 0.86 4.71 -1.26 -4.86 120.64 114.03 2ptq n GLU 223 Ca -0.01 -0.23 -0.38 0.00 -0.01 0.00 0.00 57.16 56.53 2ptq n GLU 223 Cb 0.23 -1.50 -0.06 0.00 -1.01 0.00 0.00 31.44 29.10 2ptq n GLU 223 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2ptq s VAL 224 N -2.66 5.00 -0.99 2.62 1.01 -1.03 -5.01 120.40 119.34 2ptq s VAL 224 Ca 0.22 0.92 -0.20 0.00 0.00 0.00 0.00 61.98 62.92 2ptq s VAL 224 Cb 0.19 -3.76 0.11 0.00 0.00 0.00 0.00 36.38 32.92 2ptq s VAL 224 CO 0.55 0.53 1.27 -0.62 0.00 0.00 0.00 175.10 176.84 2ptq s ASP 225 N -0.80 6.63 0.52 3.32 3.68 -1.26 -4.84 116.67 123.92 2ptq s ASP 225 Ca 0.25 -1.95 0.31 0.00 2.13 0.00 0.00 52.55 53.28 2ptq s ASP 225 Cb -0.17 -2.46 1.26 0.00 -1.45 0.00 0.00 42.92 40.10 2ptq s ASP 225 CO 0.14 -1.18 1.95 -0.50 0.13 0.00 0.00 175.17 175.71 2ptq h TRP 226 N 8.95 0.00 -0.42 -5.34 4.06 -1.95 -1.75 115.95 119.50 2ptq h TRP 226 Ca 0.19 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 61.02 2ptq h TRP 226 Cb 1.00 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.15 2ptq h TRP 226 CO 1.21 0.08 -0.24 1.25 -3.56 0.00 0.00 178.44 177.18 2ptq h HIS 227 N 0.00 1.04 -0.30 0.49 2.76 -1.97 0.13 115.15 117.31 2ptq h HIS 227 Ca -0.00 -0.27 -0.15 0.00 -2.20 0.00 0.00 60.37 57.75 2ptq h HIS 227 Cb 0.56 -0.24 -0.00 0.00 1.55 0.00 0.00 27.41 29.28 2ptq h HIS 227 CO 0.00 1.07 -0.41 0.37 -1.30 0.00 0.00 177.93 177.65 2ptq h GLN 228 N 0.72 0.80 -0.41 5.26 4.15 -1.92 -2.70 115.11 121.01 2ptq h GLN 228 Ca 0.09 -0.47 0.05 0.00 0.77 0.00 0.00 58.65 59.09 2ptq h GLN 228 Cb 0.81 0.04 -0.05 0.00 0.21 0.00 0.00 27.48 28.49 2ptq h GLN 228 CO 0.07 1.10 0.13 0.35 -1.93 0.00 0.00 178.83 178.55 2ptq h PHE 229 N 0.57 0.23 0.21 3.99 3.04 -1.10 -1.49 116.94 122.39 2ptq h PHE 229 Ca 0.03 0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.01 2ptq h PHE 229 Cb 1.01 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 39.46 2ptq h PHE 229 CO 0.07 0.08 -0.23 1.03 -2.02 0.00 0.00 178.31 177.24 2ptq h SER 230 N 0.28 -0.62 -0.60 0.41 0.87 -0.66 -1.24 113.55 111.99 2ptq h SER 230 Ca 0.19 0.06 0.04 0.00 -1.23 0.00 0.00 61.79 60.85 2ptq h SER 230 Cb 0.19 0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 62.32 2ptq h SER 230 CO -0.21 -0.33 0.35 -0.08 -0.53 0.00 0.00 176.83 176.03 2ptq h GLU 231 N -0.48 0.65 -0.11 2.24 4.81 -1.24 -1.12 114.58 119.32 2ptq h GLU 231 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2ptq h GLU 231 Cb 0.46 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2ptq h GLU 231 CO -0.06 0.43 0.07 0.93 -0.73 0.00 0.00 179.01 179.65 2ptq h GLU 232 N 0.67 0.15 0.12 1.92 5.08 -1.09 -1.59 114.58 119.84 2ptq h GLU 232 Ca 0.26 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 2ptq h GLU 232 Cb 0.10 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2ptq h GLU 232 CO -0.14 0.12 -0.06 0.35 -1.00 0.00 0.00 179.01 178.28 2ptq h PHE 233 N 0.14 -0.15 -0.41 4.33 3.04 -0.92 0.10 116.94 123.08 2ptq h PHE 233 Ca 0.04 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.00 2ptq h PHE 233 Cb -0.00 0.05 -0.03 0.00 2.56 0.00 0.00 35.95 38.53 2ptq h PHE 233 CO -0.07 -0.07 0.24 0.28 -2.02 0.00 0.00 178.31 176.68 2ptq h VAL 234 N -0.18 1.05 0.00 1.41 2.07 -1.15 -2.17 116.25 117.28 2ptq h VAL 234 Ca -0.02 -0.17 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 2ptq h VAL 234 Cb 0.14 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 2ptq h VAL 234 CO 0.03 0.09 -0.36 0.71 0.02 0.00 0.00 177.57 178.06 2ptq h THR 235 N 0.49 1.23 0.00 2.57 1.35 -1.18 -2.12 112.91 115.26 2ptq h THR 235 Ca 0.16 -1.25 -0.02 0.00 -0.55 0.00 0.00 66.41 64.76 2ptq h THR 235 Cb 0.00 1.68 -0.00 0.00 -1.73 0.00 0.00 68.15 68.10 2ptq h THR 235 CO -0.07 0.35 -0.07 0.77 -0.25 0.00 0.00 175.52 176.25 2ptq h SER 236 N 0.00 0.00 0.00 5.36 4.64 -0.14 0.04 113.55 123.45 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 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2ptq h SER 236 CO 0.05 0.07 -0.00 0.18 -0.87 0.00 0.00 176.83 176.26 2ptq n LEU 237 N -3.33 0.86 0.00 5.97 4.77 -0.82 -4.88 117.00 119.57 2ptq n LEU 237 Ca -0.01 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 2ptq n LEU 237 Cb 0.25 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2ptq n LEU 237 CO 0.28 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2ptq n GLY 238 N 1.11 0.51 3.78 -0.72 0.00 0.00 -5.04 105.19 104.83 2ptq n GLY 238 Ca 0.21 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 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 4.48 0.03 -0.61 -1.09 -1.05 -5.02 121.20 115.93 2ptq s ILE 239 Ca 0.00 -0.91 -0.23 0.00 -2.23 0.00 0.00 60.65 57.28 2ptq s ILE 239 Cb 0.00 -3.21 -0.05 0.00 -1.58 0.00 0.00 42.46 37.62 2ptq s ILE 239 CO 0.00 0.03 0.70 -1.10 -1.23 0.00 0.00 174.94 173.34 2ptq s GLN 240 N -2.68 4.43 0.19 2.79 -0.21 -0.67 -3.37 119.66 120.15 2ptq s GLN 240 Ca 0.30 0.94 -0.30 0.00 0.02 0.00 0.00 55.36 56.32 2ptq s GLN 240 Cb -0.11 -3.36 -0.08 0.00 1.00 0.00 0.00 33.01 30.46 2ptq s GLN 240 CO 0.22 0.31 1.23 -0.46 -2.12 0.00 0.00 175.29 174.47 2ptq s TRP 241 N -0.09 3.37 -0.42 0.91 -0.00 -1.26 -0.44 118.94 121.02 2ptq s TRP 241 Ca 0.36 1.37 0.04 0.00 -0.00 0.00 0.00 56.10 57.87 2ptq s TRP 241 Cb -0.20 -3.48 0.11 0.00 -0.00 0.00 0.00 33.47 29.91 2ptq s TRP 241 CO 0.21 -1.39 0.14 1.21 -0.00 0.00 0.00 176.95 177.12 2ptq s ASN 242 N 0.17 4.52 0.47 5.86 3.04 -0.01 -4.80 114.94 124.19 2ptq s ASN 242 Ca 0.54 -2.51 0.22 0.00 0.04 0.00 0.00 52.86 51.15 2ptq s ASN 242 Cb -0.34 -1.59 1.17 0.00 -1.54 0.00 0.00 41.25 38.95 2ptq s ASN 242 CO 0.37 -0.32 1.97 1.55 -3.04 0.00 0.00 177.10 177.64 2ptq h PRO 243 N 7.13 0.00 -4.90 0.43 0.13 -1.96 -3.42 132.00 129.42 2ptq h PRO 243 Ca -0.06 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.40 2ptq h PRO 243 Cb 0.96 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 31.78 2ptq h PRO 243 CO 0.59 0.20 -0.74 0.71 -0.23 0.00 0.00 178.00 178.53 2ptq s TYR 244 N -4.14 3.07 0.24 1.56 1.51 -1.26 -5.08 117.35 113.25 2ptq s TYR 244 Ca -0.02 -1.52 -0.17 0.00 -1.01 0.00 0.00 57.07 54.35 2ptq s TYR 244 Cb 0.13 -2.07 0.01 0.00 -0.11 0.00 0.00 41.96 39.92 2ptq s TYR 244 CO 0.63 -0.72 0.57 0.95 -1.11 0.00 0.00 175.55 175.87 2ptq s THR 245 N 1.33 0.01 0.00 -0.71 -4.23 -1.26 -4.89 115.64 105.89 2ptq s THR 245 Ca 0.00 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.40 2ptq s THR 245 Cb -0.17 -1.97 0.00 0.00 1.34 0.00 0.00 72.50 71.70 2ptq s THR 245 CO -0.04 -0.03 0.00 0.35 -0.54 0.00 0.00 174.62 174.36 2ptq n THR 246 N -0.40 0.00 0.05 3.99 -2.24 -1.26 -4.32 114.28 110.10 2ptq n THR 246 Ca -0.05 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.67 2ptq n THR 246 Cb 0.61 0.00 0.11 0.00 -2.10 0.00 0.00 70.33 68.95 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 -6.19 -0.78 4.15 -1.61 -3.22 115.11 107.85 2ptq h GLN 247 Ca 0.00 -0.24 -0.49 0.00 0.77 0.00 0.00 58.65 58.68 2ptq h GLN 247 Cb 0.00 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.68 2ptq h GLN 247 CO 0.00 0.83 -0.50 0.96 -1.93 0.00 0.00 178.83 178.19 2ptq s ILE 248 N -3.95 4.68 0.04 2.39 -4.36 -1.26 -4.65 121.20 114.10 2ptq s ILE 248 Ca -0.06 -1.27 -0.30 0.00 -0.26 0.00 0.00 60.65 58.76 2ptq s ILE 248 Cb 0.12 -3.53 -0.05 0.00 1.25 0.00 0.00 42.46 40.25 2ptq s ILE 248 CO 0.81 -0.34 1.09 -0.70 0.24 0.00 0.00 174.94 176.05 2ptq s GLU 249 N -3.86 4.50 0.65 0.37 -6.30 -1.26 -4.81 118.70 108.00 2ptq s GLU 249 Ca 0.33 1.61 0.26 0.00 -2.50 0.00 0.00 54.97 54.67 2ptq s GLU 249 Cb -0.08 -3.39 1.41 0.00 0.00 0.00 0.00 34.13 32.06 2ptq s GLU 249 CO 0.26 -0.14 1.80 -1.00 0.02 0.00 0.00 175.26 176.20 2ptq h PRO 250 N 6.69 0.00 0.00 4.30 0.13 -1.97 -3.46 132.00 137.70 2ptq h PRO 250 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2ptq h PRO 250 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2ptq h PRO 250 CO 0.78 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.27 2ptq n HIS 251 N -3.02 0.00 -0.21 1.56 8.25 -1.26 -4.01 115.22 116.54 2ptq n HIS 251 Ca 0.01 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.45 2ptq n HIS 251 Cb 0.53 -0.17 0.19 0.00 1.12 0.00 0.00 29.99 31.67 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 0.88 0.46 0.41 3.32 -1.94 -2.04 116.42 117.51 2ptq h ASP 252 Ca 0.00 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 56.91 2ptq h ASP 252 Cb 0.08 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2ptq h ASP 252 CO 0.00 0.73 -0.25 0.10 -1.72 0.00 0.00 179.24 178.10 2ptq h TYR 253 N 0.99 0.00 -0.48 4.55 -0.00 -1.92 -1.17 116.97 118.94 2ptq h TYR 253 Ca 0.25 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 58.85 2ptq h TYR 253 Cb 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.78 2ptq h TYR 253 CO 0.01 0.25 -0.21 0.82 -0.00 0.00 0.00 178.16 179.03 2ptq h ILE 254 N 0.00 1.27 -0.48 -0.90 2.04 -1.70 0.94 117.51 118.68 2ptq h ILE 254 Ca -0.00 -1.37 -0.04 0.00 1.00 0.00 0.00 64.86 64.44 2ptq h ILE 254 Cb 0.55 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 2ptq h ILE 254 CO 0.03 0.47 0.13 0.00 0.00 0.00 0.00 178.15 178.78 2ptq h ALA 255 N 0.87 0.63 -0.75 1.87 0.00 -1.17 0.13 119.26 120.84 2ptq h ALA 255 Ca 0.11 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.83 2ptq h ALA 255 Cb 0.79 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 2ptq h ALA 255 CO 0.07 0.31 0.49 0.93 0.00 0.00 0.00 179.25 181.05 2ptq h GLU 256 N 0.65 0.98 -0.06 0.00 5.08 -0.97 0.44 114.58 120.70 2ptq h GLU 256 Ca 0.15 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2ptq h GLU 256 Cb 0.31 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 2ptq h GLU 256 CO -0.00 0.65 0.00 1.25 -1.00 0.00 0.00 179.01 179.91 2ptq h LEU 257 N 1.01 0.10 -1.22 1.33 6.46 -0.50 -2.93 115.31 119.57 2ptq h LEU 257 Ca 0.27 -0.30 -0.07 0.00 -0.12 0.00 0.00 57.88 57.66 2ptq h LEU 257 Cb -0.12 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 39.78 2ptq h LEU 257 CO -0.06 0.38 -0.34 -0.26 -0.62 0.00 0.00 178.44 177.54 2ptq h PHE 258 N -0.18 0.00 -0.22 1.25 -1.00 -0.44 -2.64 116.94 113.71 2ptq h PHE 258 Ca 0.02 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.69 2ptq h PHE 258 Cb 0.33 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.87 2ptq h PHE 258 CO 0.03 0.34 -0.32 -0.44 -1.61 0.00 0.00 178.31 176.31 2ptq h ASP 259 N 0.00 0.47 0.45 2.17 3.32 -0.06 -1.50 116.42 121.28 2ptq h ASP 259 Ca -0.00 -0.18 -0.24 0.00 0.02 0.00 0.00 57.03 56.63 2ptq h ASP 259 Cb 0.72 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.15 2ptq h ASP 259 CO 0.04 0.77 -1.02 0.00 -1.72 0.00 0.00 179.24 177.32 2ptq h VAL 261 N 0.17 1.26 -0.47 0.00 2.07 -1.35 -1.38 116.25 116.55 2ptq h VAL 261 Ca -0.09 -0.95 -0.08 0.00 0.82 0.00 0.00 66.70 66.40 2ptq h VAL 261 Cb 1.68 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 2ptq h VAL 261 CO 0.17 0.37 -0.01 0.00 0.02 0.00 0.00 177.57 178.11 2ptq h ALA 262 N 1.13 1.09 -0.59 1.67 0.00 -1.23 0.12 119.26 121.45 2ptq h ALA 262 Ca 0.22 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2ptq h ALA 262 Cb 0.36 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2ptq h ALA 262 CO 0.00 0.58 -0.01 0.00 0.00 0.00 0.00 179.25 179.82 2ptq h ARG 263 N 0.74 1.04 -0.12 0.00 3.08 -0.97 -0.07 114.38 118.08 2ptq h ARG 263 Ca 0.14 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 2ptq h ARG 263 Cb 0.47 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 2ptq h ARG 263 CO 0.02 1.02 0.02 0.35 -1.07 0.00 0.00 179.97 180.31 2ptq h PHE 264 N 0.95 0.21 -0.60 3.04 3.57 -0.83 -2.11 116.94 121.17 2ptq h PHE 264 Ca 0.17 -0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.68 2ptq h PHE 264 Cb 0.56 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 2ptq h PHE 264 CO 0.04 0.40 0.40 -0.91 -2.23 0.00 0.00 178.31 176.00 2ptq h ASN 265 N -0.04 0.56 -0.53 0.41 2.35 -0.58 -1.36 115.58 116.41 2ptq h ASN 265 Ca 0.04 -0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.68 2ptq h ASN 265 Cb 0.30 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 2ptq h ASN 265 CO 0.00 0.38 -0.08 0.74 -1.65 0.00 0.00 177.43 176.82 2ptq h THR 266 N 0.64 1.27 -0.65 2.81 2.02 -0.72 0.16 112.91 118.44 2ptq h THR 266 Ca 0.25 -1.22 -0.03 0.00 0.77 0.00 0.00 66.41 66.18 2ptq h THR 266 Cb 0.18 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 2ptq h THR 266 CO -0.07 0.43 0.29 0.40 0.37 0.00 0.00 175.52 176.93 2ptq h ILE 267 N 0.85 1.22 -0.11 3.11 2.04 -0.63 -1.71 117.51 122.27 2ptq h ILE 267 Ca 0.14 -0.65 -0.15 0.00 1.00 0.00 0.00 64.86 65.20 2ptq h ILE 267 Cb 0.63 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2ptq h ILE 267 CO 0.04 0.27 -0.59 0.25 0.00 0.00 0.00 178.15 178.12 2ptq h LEU 268 N 0.92 0.42 -0.32 1.44 5.85 -0.81 -1.52 115.31 121.29 2ptq h LEU 268 Ca 0.22 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 2ptq h LEU 268 Cb 0.14 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2ptq h LEU 268 CO -0.02 0.91 0.10 0.40 -0.34 0.00 0.00 178.44 179.49 2ptq h ILE 269 N 0.28 1.21 -0.75 4.05 2.04 -0.54 0.27 117.51 124.07 2ptq h ILE 269 Ca -0.00 -0.68 0.08 0.00 1.00 0.00 0.00 64.86 65.26 2ptq h ILE 269 Cb 1.11 1.04 -0.07 0.00 -0.74 0.00 0.00 36.82 38.17 2ptq h ILE 269 CO 0.10 0.23 0.42 -0.78 0.00 0.00 0.00 178.15 178.12 2ptq h ASP 270 N 0.37 0.60 0.04 1.72 3.58 -1.13 -0.11 116.42 121.48 2ptq h ASP 270 Ca 0.10 0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 2ptq h ASP 270 Cb 0.26 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.24 2ptq h ASP 270 CO -0.00 0.36 -0.02 0.15 -2.88 0.00 0.00 179.24 176.85 2ptq h PHE 271 N 0.73 -0.04 -0.75 0.28 3.57 -0.80 -1.36 116.94 118.55 2ptq h PHE 271 Ca 0.36 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.97 2ptq h PHE 271 Cb 0.30 0.01 -0.08 0.00 2.79 0.00 0.00 35.95 38.97 2ptq h PHE 271 CO -0.08 0.33 0.36 -0.44 -2.23 0.00 0.00 178.31 176.25 2ptq h ASP 272 N -0.42 0.44 -0.37 0.41 3.32 -0.06 -1.08 116.42 118.65 2ptq h ASP 272 Ca -0.00 0.08 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 2ptq h ASP 272 Cb 0.39 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 2ptq h ASP 272 CO 0.01 0.22 -0.08 0.03 -1.72 0.00 0.00 179.24 177.70 2ptq h ARG 273 N 0.58 0.71 -0.37 3.56 3.08 -0.97 -1.47 114.38 119.49 2ptq h ARG 273 Ca 0.39 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 2ptq h ARG 273 Cb 0.48 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 2ptq h ARG 273 CO -0.32 0.85 0.18 -0.44 -1.07 0.00 0.00 179.97 179.17 2ptq h ASP 274 N 0.51 0.48 -0.28 7.04 3.32 -0.62 -1.75 116.42 125.12 2ptq h ASP 274 Ca 0.09 -0.13 -0.09 0.00 0.02 0.00 0.00 57.03 56.92 2ptq h ASP 274 Cb 0.59 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 2ptq h ASP 274 CO 0.03 0.47 -0.15 0.58 -1.72 0.00 0.00 179.24 178.46 2ptq h VAL 275 N 0.46 1.26 -0.87 -1.35 2.07 -1.22 0.86 116.25 117.46 2ptq h VAL 275 Ca 0.13 -1.19 0.06 0.00 0.82 0.00 0.00 66.70 66.51 2ptq h VAL 275 Cb 0.12 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 30.95 2ptq h VAL 275 CO -0.02 0.40 0.55 -0.25 0.02 0.00 0.00 177.57 178.27 2ptq h TRP 276 N 0.64 1.01 -0.14 1.57 7.01 -1.04 0.63 115.95 125.63 2ptq h TRP 276 Ca 0.10 0.03 -0.20 0.00 2.11 0.00 0.00 58.89 60.94 2ptq h TRP 276 Cb 0.61 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 27.34 2ptq h TRP 276 CO 0.03 0.53 -0.70 0.78 -2.79 0.00 0.00 178.44 176.28 2ptq h GLY 277 N 1.01 0.68 1.65 2.65 0.00 -0.55 -1.00 103.07 107.51 2ptq h GLY 277 Ca 0.37 -0.92 -0.06 0.00 0.00 0.00 0.00 47.33 46.72 2ptq h GLY 277 CO -0.16 0.82 -0.12 -0.97 0.00 0.00 0.00 176.54 176.11 2ptq h TYR 278 N 0.44 0.45 -0.27 5.60 0.05 -0.21 0.23 116.97 123.26 2ptq h TYR 278 Ca -0.03 -0.06 -0.17 0.00 0.05 0.00 0.00 58.73 58.52 2ptq h TYR 278 Cb 1.30 -0.12 -0.00 0.00 1.01 0.00 0.00 36.73 38.91 2ptq h TYR 278 CO 0.06 0.54 -0.52 0.82 -1.05 0.00 0.00 178.16 178.01 2ptq h ILE 279 N 0.40 1.29 -0.49 -2.88 2.04 -0.77 0.63 117.51 117.72 2ptq h ILE 279 Ca 0.08 -1.72 -0.04 0.00 1.00 0.00 0.00 64.86 64.18 2ptq h ILE 279 Cb 0.45 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 2ptq h ILE 279 CO 0.03 0.55 0.15 0.00 0.00 0.00 0.00 178.15 178.88 2ptq h ALA 280 N 0.80 1.34 -0.00 1.87 0.00 -0.38 -1.33 119.26 121.56 2ptq h ALA 280 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2ptq h ALA 280 Cb 1.10 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2ptq h ALA 280 CO 0.11 0.48 -0.02 1.28 0.00 0.00 0.00 179.25 181.10 2ptq n LEU 281 N -4.32 0.04 -1.15 0.00 4.77 -0.01 -4.91 117.00 111.42 2ptq n LEU 281 Ca 0.04 0.34 -0.09 0.00 -0.03 0.00 0.00 56.01 56.27 2ptq n LEU 281 Cb 0.19 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 2ptq n LEU 281 CO 0.39 0.01 -0.09 -3.20 -1.33 0.00 0.00 177.39 173.17 2ptq n ASN 282 N -1.35 -3.27 0.15 -1.43 5.15 -0.50 -4.90 115.26 109.10 2ptq n ASN 282 Ca 0.11 -0.04 0.12 0.00 -0.60 0.00 0.00 54.58 54.18 2ptq n ASN 282 Cb 0.28 -2.46 0.19 0.00 -0.53 0.00 0.00 39.78 37.26 2ptq n ASN 282 CO 0.00 0.00 0.00 0.45 1.40 0.00 0.00 177.26 179.11 2ptq h HIS 283 N -0.15 0.00 -3.90 1.20 3.86 -1.13 -3.44 115.15 111.59 2ptq h HIS 283 Ca -0.22 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 58.65 2ptq h HIS 283 Cb 1.16 0.00 -0.29 0.00 1.06 0.00 0.00 27.41 29.35 2ptq h HIS 283 CO 0.24 0.00 -0.76 -0.06 0.86 0.00 0.00 177.93 178.21 2ptq s PHE 284 N -3.21 0.52 0.32 2.45 0.40 -1.23 -0.30 117.98 116.93 2ptq s PHE 284 Ca 0.06 -0.10 0.07 0.00 -0.60 0.00 0.00 56.93 56.36 2ptq s PHE 284 Cb 0.09 -0.34 -0.02 0.00 0.51 0.00 0.00 43.02 43.26 2ptq s PHE 284 CO 0.68 -0.02 0.35 0.15 0.70 0.00 0.00 175.22 177.09 2ptq s LYS 285 N -0.09 2.92 -0.12 0.44 1.02 0.11 -4.61 119.74 119.42 2ptq s LYS 285 Ca 0.02 -1.14 0.01 0.00 0.02 0.00 0.00 55.97 54.87 2ptq s LYS 285 Cb -0.03 -2.63 -0.01 0.00 -0.52 0.00 0.00 37.83 34.64 2ptq s LYS 285 CO -0.00 0.13 -0.14 -0.65 -0.92 0.00 0.00 175.35 173.76 2ptq s GLN 286 N -4.04 3.24 0.16 1.68 -0.21 -1.26 -1.64 119.66 117.58 2ptq s GLN 286 Ca 0.41 -0.71 -0.30 0.00 0.02 0.00 0.00 55.36 54.78 2ptq s GLN 286 Cb -0.07 -2.56 -0.08 0.00 1.00 0.00 0.00 33.01 31.30 2ptq s GLN 286 CO 0.28 0.26 1.19 0.21 -2.12 0.00 0.00 175.29 175.12 2ptq s LYS 287 N 0.21 4.49 0.04 2.91 2.20 0.53 -5.01 119.74 125.11 2ptq s LYS 287 Ca -0.09 1.84 -0.02 0.00 -0.36 0.00 0.00 55.97 57.35 2ptq s LYS 287 Cb -0.15 -3.26 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 2ptq s LYS 287 CO 0.05 -0.11 -0.01 -0.08 -0.36 0.00 0.00 175.35 174.85 2ptq s THR 288 N 0.16 0.18 0.04 3.43 -1.32 -1.26 -4.89 115.64 111.98 2ptq s THR 288 Ca 0.54 -1.49 0.03 0.00 -1.21 0.00 0.00 61.69 59.55 2ptq s THR 288 Cb -0.32 -1.15 -0.04 0.00 -1.51 0.00 0.00 72.50 69.49 2ptq s THR 288 CO 0.35 -0.82 0.01 -0.63 -2.21 0.00 0.00 174.62 171.32 2ptq s ILE 289 N -3.19 4.18 0.32 5.08 -1.09 -1.26 -5.08 121.20 120.16 2ptq s ILE 289 Ca 0.00 -0.76 -0.29 0.00 -2.23 0.00 0.00 60.65 57.38 2ptq s ILE 289 Cb 0.03 -2.93 -0.12 0.00 -1.58 0.00 0.00 42.46 37.85 2ptq s ILE 289 CO -0.07 0.25 1.44 0.00 -1.23 0.00 0.00 174.94 175.32 2ptq n ALA 290 N 0.96 1.84 0.00 9.38 0.00 -1.26 -1.88 120.51 129.55 2ptq n ALA 290 Ca -0.12 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2ptq n ALA 290 Cb 0.52 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2ptq n ALA 290 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ptq n GLY 291 N 1.30 2.92 3.74 0.00 0.00 -1.26 -5.05 105.19 106.84 2ptq n GLY 291 Ca 0.06 -0.63 -0.37 0.00 0.00 0.00 0.00 46.02 45.08 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 0.00 2.92 -0.16 1.61 2.02 -0.79 -5.00 118.70 119.31 2ptq s GLU 292 Ca 0.00 2.06 -0.00 0.00 0.02 0.00 0.00 54.97 57.05 2ptq s GLU 292 Cb 0.00 -2.04 -0.01 0.00 0.10 0.00 0.00 34.13 32.18 2ptq s GLU 292 CO 0.00 -1.31 -0.13 0.42 0.02 0.00 0.00 175.26 174.26 2ptq s ILE 293 N -1.41 2.86 -0.14 -1.63 -1.09 -1.26 -4.99 121.20 113.53 2ptq s ILE 293 Ca 0.76 -0.71 -0.19 0.00 -2.23 0.00 0.00 60.65 58.29 2ptq s ILE 293 Cb -0.37 -2.22 -0.17 0.00 -1.58 0.00 0.00 42.46 38.13 2ptq s ILE 293 CO 0.41 0.51 0.41 1.23 -1.23 0.00 0.00 174.94 176.27 2ptq h GLY 294 N 7.24 0.00 -4.85 6.18 0.00 -1.89 -3.48 103.07 106.27 2ptq h GLY 294 Ca -0.32 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.61 2ptq h GLY 294 CO 0.57 0.00 -0.78 -0.45 0.00 0.00 0.00 176.54 175.88 2ptq s SER 295 N -6.15 1.36 0.44 0.19 0.15 -1.25 -4.82 113.70 103.63 2ptq s SER 295 Ca -0.16 -0.40 0.25 0.00 0.70 0.00 0.00 55.95 56.33 2ptq s SER 295 Cb -0.00 -0.08 0.65 0.00 -1.71 0.00 0.00 66.02 64.88 2ptq s SER 295 CO 0.48 0.01 1.71 0.77 1.20 0.00 0.00 173.24 177.41 2ptq h SER 296 N 5.09 0.00 0.00 5.45 4.64 -2.00 -3.37 113.55 123.37 2ptq h SER 296 Ca -0.36 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.89 2ptq h SER 296 Cb 1.18 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2ptq h SER 296 CO 0.45 0.12 -1.26 1.07 -0.87 0.00 0.00 176.83 176.34 2ptq n THR 297 N -3.17 0.26 -3.56 2.95 5.66 -1.26 -4.90 114.28 110.26 2ptq n THR 297 Ca 0.02 -0.15 -0.41 0.00 -3.05 0.00 0.00 64.05 60.46 2ptq n THR 297 Cb 0.49 -0.88 -0.07 0.00 -1.55 0.00 0.00 70.33 68.32 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 -2.09 2.76 0.50 1.09 -1.94 -1.26 -4.97 119.30 113.40 2ptq s MET 298 Ca -0.02 -2.19 0.28 0.00 -1.71 0.00 0.00 55.69 52.05 2ptq s MET 298 Cb 0.01 -3.97 1.55 0.00 2.01 0.00 0.00 34.83 34.43 2ptq s MET 298 CO 0.15 -1.21 1.85 -1.00 -0.01 0.00 0.00 175.02 174.80 2ptq h PRO 299 N 7.81 0.00 0.00 2.03 0.13 -1.91 -2.60 132.00 137.46 2ptq h PRO 299 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2ptq h PRO 299 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2ptq h PRO 299 CO 0.78 0.00 -0.37 -2.39 -0.23 0.00 0.00 178.00 175.79 2ptq n HIS 300 N -2.60 0.72 -1.85 1.56 1.44 -1.26 -4.87 115.22 108.38 2ptq n HIS 300 Ca -0.02 0.21 -0.41 0.00 -2.01 0.00 0.00 57.72 55.49 2ptq n HIS 300 Cb 0.18 -0.78 -0.01 0.00 0.12 0.00 0.00 29.99 29.50 2ptq n HIS 300 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2ptq s LYS 301 N -3.14 4.15 -0.19 -1.40 -0.14 -0.98 -5.02 119.74 113.03 2ptq s LYS 301 Ca 0.08 2.51 -0.05 0.00 -1.36 0.00 0.00 55.97 57.16 2ptq s LYS 301 Cb 0.13 -3.01 0.06 0.00 -1.68 0.00 0.00 37.83 33.34 2ptq s LYS 301 CO 0.67 -0.52 0.09 0.08 -0.76 0.00 0.00 175.35 174.91 2ptq s VAL 302 N -0.70 0.02 0.13 3.17 1.01 -1.26 -3.79 120.40 118.98 2ptq s VAL 302 Ca 0.56 -0.30 0.07 0.00 0.00 0.00 0.00 61.98 62.31 2ptq s VAL 302 Cb -0.46 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 2ptq s VAL 302 CO 0.56 -0.32 -0.07 0.20 0.00 0.00 0.00 175.10 175.47 2ptq s ASN 303 N 2.09 4.52 -0.76 3.32 0.01 -1.26 -5.00 114.94 117.86 2ptq s ASN 303 Ca 0.02 -0.40 -0.07 0.00 -0.71 0.00 0.00 52.86 51.70 2ptq s ASN 303 Cb -0.16 -0.89 -0.11 0.00 0.41 0.00 0.00 41.25 40.50 2ptq s ASN 303 CO -0.12 0.14 3.13 -0.81 -1.51 0.00 0.00 177.10 177.93 2ptq n PRO 304 N 0.37 2.94 0.19 -0.60 -0.04 -1.26 -4.69 135.00 131.92 2ptq n PRO 304 Ca -0.12 -1.91 0.15 0.00 -0.04 0.00 0.00 63.50 61.58 2ptq n PRO 304 Cb 0.53 -2.36 0.76 0.00 -0.04 0.00 0.00 33.50 32.40 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 2.39 0.69 -0.25 0.52 3.07 -1.99 -2.45 117.51 119.49 2ptq h ILE 305 Ca 0.51 0.00 -0.07 0.00 1.55 0.00 0.00 64.86 66.85 2ptq h ILE 305 Cb 0.85 0.89 -0.01 0.00 -0.27 0.00 0.00 36.82 38.28 2ptq h ILE 305 CO 0.98 0.00 -0.10 0.44 -1.05 0.00 0.00 178.15 178.42 2ptq h ASP 306 N 0.00 0.53 -0.28 2.16 3.32 -1.86 -0.24 116.42 120.05 2ptq h ASP 306 Ca 0.08 -0.40 -0.10 0.00 0.02 0.00 0.00 57.03 56.64 2ptq h ASP 306 Cb 0.39 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 2ptq h ASP 306 CO -0.00 0.81 -0.17 -0.26 -1.72 0.00 0.00 179.24 177.90 2ptq h PHE 307 N 0.24 0.80 -0.42 4.55 -1.00 -1.67 -1.60 116.94 117.84 2ptq h PHE 307 Ca 0.06 -0.16 -0.10 0.00 2.81 0.00 0.00 57.97 60.58 2ptq h PHE 307 Cb 0.60 -0.20 -0.01 0.00 3.61 0.00 0.00 35.95 39.95 2ptq h PHE 307 CO 0.06 0.84 -0.12 0.93 -1.61 0.00 0.00 178.31 178.40 2ptq h GLU 308 N 0.64 0.82 -0.56 1.51 5.08 -1.37 -0.04 114.58 120.67 2ptq h GLU 308 Ca 0.10 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.12 2ptq h GLU 308 Cb 0.64 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 2ptq h GLU 308 CO 0.05 0.95 0.30 -0.97 -1.00 0.00 0.00 179.01 178.34 2ptq h ASN 309 N 0.64 0.70 0.01 1.42 -0.73 -0.88 -1.64 115.58 115.11 2ptq h ASN 309 Ca 0.10 -0.10 -0.00 0.00 1.87 0.00 0.00 56.30 58.17 2ptq h ASN 309 Cb 0.66 -0.18 0.00 0.00 0.27 0.00 0.00 38.32 39.07 2ptq h ASN 309 CO 0.05 0.60 -0.00 -1.28 -0.37 0.00 0.00 177.43 176.43 2ptq h SER 310 N 0.75 -0.01 -0.51 1.15 0.87 -1.07 -2.02 113.55 112.72 2ptq h SER 310 Ca 0.20 -0.03 0.07 0.00 -1.23 0.00 0.00 61.79 60.79 2ptq h SER 310 Cb 0.06 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 61.97 2ptq h SER 310 CO -0.03 0.02 0.20 -0.08 -0.53 0.00 0.00 176.83 176.41 2ptq h GLU 311 N -0.03 0.38 -0.54 2.24 4.81 -0.73 -0.03 114.58 120.66 2ptq h GLU 311 Ca -0.00 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2ptq h GLU 311 Cb 0.03 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 2ptq h GLU 311 CO 0.00 0.25 0.20 0.78 -0.73 0.00 0.00 179.01 179.50 2ptq h GLY 312 N 0.39 0.89 2.00 1.92 0.00 -1.18 -2.74 103.07 104.34 2ptq h GLY 312 Ca 0.24 -0.51 -0.07 0.00 0.00 0.00 0.00 47.33 46.99 2ptq h GLY 312 CO -0.23 0.48 -0.35 3.43 0.00 0.00 0.00 176.54 179.87 2ptq h ASN 313 N 0.75 0.00 -0.06 0.19 2.35 -0.82 -2.74 115.58 115.25 2ptq h ASN 313 Ca 0.18 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.79 2ptq h ASN 313 Cb 0.24 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 2ptq h ASN 313 CO -0.01 0.35 -0.41 -0.07 -1.65 0.00 0.00 177.43 175.63 2ptq h LEU 314 N 0.00 0.62 -0.47 1.61 3.38 -0.75 -0.47 115.31 119.23 2ptq h LEU 314 Ca -0.00 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.65 2ptq h LEU 314 Cb 0.72 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2ptq h LEU 314 CO 0.05 0.96 0.13 1.23 0.09 0.00 0.00 178.44 180.90 2ptq h GLY 315 N 1.04 0.80 0.94 0.83 0.00 -1.21 -1.47 103.07 104.00 2ptq h GLY 315 Ca 0.04 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 2ptq h GLY 315 CO 0.08 0.46 0.14 1.41 0.00 0.00 0.00 176.54 178.63 2ptq h LEU 316 N 0.64 0.37 0.10 3.11 3.38 -1.33 -1.89 115.31 119.68 2ptq h LEU 316 Ca 0.15 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 58.02 2ptq h LEU 316 Cb 0.30 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 2ptq h LEU 316 CO -0.00 0.38 -0.30 -1.28 0.09 0.00 0.00 178.44 177.33 2ptq h SER 317 N 0.33 -0.86 -0.57 -0.43 0.87 -0.86 -2.06 113.55 109.96 2ptq h SER 317 Ca 0.10 0.10 0.02 0.00 -1.23 0.00 0.00 61.79 60.78 2ptq h SER 317 Cb 0.11 0.33 -0.03 0.00 -0.44 0.00 0.00 62.40 62.37 2ptq h SER 317 CO -0.01 -0.39 0.38 0.78 -0.53 0.00 0.00 176.83 177.06 2ptq h ASN 318 N -0.51 0.60 -0.61 6.23 4.21 -1.20 0.19 115.58 124.49 2ptq h ASN 318 Ca 0.04 -0.01 -0.05 0.00 1.21 0.00 0.00 56.30 57.48 2ptq h ASN 318 Cb 0.55 -0.14 -0.03 0.00 -1.12 0.00 0.00 38.32 37.58 2ptq h ASN 318 CO -0.19 0.42 0.18 0.00 -1.29 0.00 0.00 177.43 176.55 2ptq h ALA 319 N 1.66 0.80 -0.03 -0.83 0.00 -0.86 0.13 119.26 120.13 2ptq h ALA 319 Ca 0.22 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 2ptq h ALA 319 Cb 0.04 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.60 2ptq h ALA 319 CO -0.06 0.49 -0.50 0.28 0.00 0.00 0.00 179.25 179.47 2ptq h VAL 320 N 0.88 1.43 -0.51 0.00 2.07 -0.75 -2.59 116.25 116.78 2ptq h VAL 320 Ca 0.20 -1.96 0.04 0.00 0.82 0.00 0.00 66.70 65.79 2ptq h VAL 320 Cb 0.31 2.51 -0.04 0.00 -1.52 0.00 0.00 31.29 32.55 2ptq h VAL 320 CO -0.00 0.57 0.27 -0.07 0.02 0.00 0.00 177.57 178.36 2ptq h LEU 321 N -0.12 0.41 -0.78 2.57 4.07 -0.57 -1.68 115.31 119.20 2ptq h LEU 321 Ca -0.05 0.02 -0.10 0.00 0.08 0.00 0.00 57.88 57.83 2ptq h LEU 321 Cb 1.19 -0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.85 2ptq h LEU 321 CO 0.10 0.29 -0.13 -0.61 -1.08 0.00 0.00 178.44 177.01 2ptq h GLN 322 N 0.53 0.79 -0.22 1.13 -0.00 -0.81 0.42 115.11 116.96 2ptq h GLN 322 Ca 0.22 -0.27 -0.02 0.00 -0.00 0.00 0.00 58.65 58.57 2ptq h GLN 322 Cb 0.09 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 27.50 2ptq h GLN 322 CO -0.13 0.88 0.05 1.25 0.00 0.00 0.00 178.83 180.87 2ptq h HIS 323 N 0.71 0.36 -0.63 3.99 2.76 -1.11 -1.56 115.15 119.67 2ptq h HIS 323 Ca 0.12 -0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.20 2ptq h HIS 323 Cb 0.61 -0.10 -0.03 0.00 1.55 0.00 0.00 27.41 29.44 2ptq h HIS 323 CO 0.03 0.46 0.23 -0.07 -1.30 0.00 0.00 177.93 177.27 2ptq h LEU 324 N 0.17 0.89 -0.90 0.26 4.07 -1.12 -0.16 115.31 118.51 2ptq h LEU 324 Ca 0.07 -0.19 -0.00 0.00 0.08 0.00 0.00 57.88 57.83 2ptq h LEU 324 Cb 0.27 -0.23 -0.04 0.00 1.08 0.00 0.00 40.66 41.74 2ptq h LEU 324 CO 0.00 0.84 0.54 0.00 -1.08 0.00 0.00 178.44 178.74 2ptq h ALA 325 N 1.09 1.15 0.00 1.53 0.00 -0.76 -1.98 119.26 120.29 2ptq h ALA 325 Ca 0.21 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2ptq h ALA 325 Cb 0.25 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2ptq h ALA 325 CO -0.01 0.61 -1.19 0.66 0.00 0.00 0.00 179.25 179.31 2ptq h SER 326 N 1.24 0.00 0.14 0.00 4.64 -1.14 -3.40 113.55 115.03 2ptq h SER 326 Ca 0.32 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.28 2ptq h SER 326 Cb -0.05 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 2ptq h SER 326 CO -0.06 0.32 -2.05 1.17 -0.87 0.00 0.00 176.83 175.33 2ptq n LYS 327 N -2.81 0.73 -0.18 4.77 0.00 -0.08 -4.53 118.16 116.06 2ptq n LYS 327 Ca -0.05 0.24 -0.02 0.00 0.00 0.00 0.00 58.31 58.48 2ptq n LYS 327 Cb 0.71 -1.68 0.08 0.00 0.00 0.00 0.00 35.03 34.13 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 0.05 0.23 0.00 3.14 3.38 -1.55 -2.79 115.31 117.78 2ptq h LEU 328 Ca -0.44 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 42.80 2ptq h LEU 328 CO 0.06 0.15 0.00 -2.65 0.09 0.00 0.00 178.44 176.09 2ptq n PRO 329 N -4.98 0.31 -3.84 1.13 -0.02 -1.26 -4.48 135.00 121.86 2ptq n PRO 329 Ca 0.07 0.02 -0.36 0.00 -2.02 0.00 0.00 63.50 61.21 2ptq n PRO 329 Cb 0.22 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.07 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 -2.06 3.50 -0.04 -1.45 1.01 -1.05 -4.97 120.40 115.34 2ptq s VAL 330 Ca 0.15 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 2ptq s VAL 330 Cb 0.07 -2.82 0.03 0.00 0.00 0.00 0.00 36.38 33.67 2ptq s VAL 330 CO 0.13 0.10 0.07 -0.55 0.00 0.00 0.00 175.10 174.84 2ptq s SER 331 N 1.42 0.52 0.03 3.32 0.15 -1.26 -4.98 113.70 112.89 2ptq s SER 331 Ca 0.01 0.11 -0.34 0.00 0.70 0.00 0.00 55.95 56.43 2ptq s SER 331 Cb -0.17 -0.04 -0.12 0.00 -1.71 0.00 0.00 66.02 63.98 2ptq s SER 331 CO -0.00 -0.19 1.77 0.54 1.20 0.00 0.00 173.24 176.56 2ptq n ARG 332 N 4.72 2.27 0.00 5.44 1.74 -1.26 -4.38 116.66 125.18 2ptq n ARG 332 Ca -0.16 0.83 0.00 0.00 -0.77 0.00 0.00 57.85 57.74 2ptq n ARG 332 Cb 0.50 -2.66 0.00 0.00 -1.02 0.00 0.00 32.46 29.29 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 5.41 0.00 1.59 -1.55 8.01 -1.26 -0.17 117.44 129.47 2ptq n TRP 333 Ca 0.20 0.00 0.06 0.00 -1.31 0.00 0.00 57.50 56.45 2ptq n TRP 333 Cb 0.31 0.00 0.38 0.00 -2.01 0.00 0.00 31.31 29.99 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 0.79 0.00 -0.99 3.00 -1.26 -4.88 117.38 128.05 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 -1.25 0.00 0.00 0.00 0.00 0.00 30.24 28.99 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 -0.75 0.00 -4.37 -1.09 -4.01 0.76 -2.47 116.66 104.72 2ptq n ARG 335 Ca 0.10 0.00 -0.25 0.00 -1.04 0.00 0.00 57.85 56.65 2ptq n ARG 335 Cb 0.04 0.00 -0.10 0.00 -3.04 0.00 0.00 32.46 29.37 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 3.94 0.00 2.89 3.84 -1.22 -4.71 116.67 121.41 2ptq s ASP 336 Ca 0.00 -0.78 0.16 0.00 -0.00 0.00 0.00 52.55 51.93 2ptq s ASP 336 Cb 0.00 -0.52 0.84 0.00 -1.38 0.00 0.00 42.92 41.86 2ptq s ASP 336 CO 0.00 0.07 1.56 -0.11 -0.00 0.00 0.00 175.17 176.69 2ptq n LEU 337 N -0.26 0.49 0.31 2.11 7.94 -1.26 -4.16 117.00 122.16 2ptq n LEU 337 Ca -0.09 -0.21 0.18 0.00 -1.11 0.00 0.00 56.01 54.78 2ptq n LEU 337 Cb 0.57 -0.04 1.03 0.00 0.53 0.00 0.00 43.42 45.51 2ptq n LEU 337 CO 0.35 0.11 1.14 0.71 -1.11 0.00 0.00 177.39 178.59 2ptq h THR 338 N 0.62 0.30 0.00 1.96 1.35 -1.97 -1.95 112.91 113.22 2ptq h THR 338 Ca 0.00 -0.06 -0.05 0.00 -0.55 0.00 0.00 66.41 65.75 2ptq h THR 338 Cb 0.14 1.04 -0.01 0.00 -1.73 0.00 0.00 68.15 67.59 2ptq h THR 338 CO 0.00 0.01 -0.22 -2.24 -0.25 0.00 0.00 175.52 172.82 2ptq h ASP 339 N 0.00 0.00 0.79 5.36 -0.00 -1.94 -3.25 116.42 117.39 2ptq h ASP 339 Ca -0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.03 56.99 2ptq h ASP 339 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.38 2ptq h ASP 339 CO 0.00 0.22 -0.40 -1.28 -0.00 0.00 0.00 179.24 177.78 2ptq h SER 340 N 0.00 -0.97 -0.50 4.15 0.87 -1.67 0.17 113.55 115.60 2ptq h SER 340 Ca -0.00 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 2ptq h SER 340 Cb 0.96 0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 63.15 2ptq h SER 340 CO 0.03 -0.67 0.20 0.00 -0.53 0.00 0.00 176.83 175.86 2ptq h THR 341 N -1.10 1.20 -0.70 2.23 1.03 -1.73 -2.35 112.91 111.50 2ptq h THR 341 Ca -0.11 -0.65 -0.06 0.00 -0.01 0.00 0.00 66.41 65.58 2ptq h THR 341 Cb 0.85 0.57 -0.03 0.00 -1.07 0.00 0.00 68.15 68.47 2ptq h THR 341 CO 0.16 0.25 0.19 0.58 -0.01 0.00 0.00 175.52 176.69 2ptq h VAL 342 N 0.78 1.26 0.00 0.00 2.07 -1.54 -2.28 116.25 116.54 2ptq h VAL 342 Ca 0.18 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.77 2ptq h VAL 342 Cb 0.18 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2ptq h VAL 342 CO -0.02 0.36 0.00 0.18 0.02 0.00 0.00 177.57 178.12 2ptq n LEU 343 N -4.24 0.00 -0.05 2.57 4.77 0.57 -0.99 117.00 119.64 2ptq n LEU 343 Ca 0.05 0.45 0.16 0.00 -0.03 0.00 0.00 56.01 56.65 2ptq n LEU 343 Cb 0.25 -0.45 0.91 0.00 -2.33 0.00 0.00 43.42 41.79 2ptq n LEU 343 CO 0.42 -0.26 1.09 0.54 -1.33 0.00 0.00 177.39 177.84 2ptq n ARG 344 N -1.45 1.06 -0.25 3.23 1.74 -0.86 -3.10 116.66 117.04 2ptq n ARG 344 Ca 0.04 -0.09 0.06 0.00 -0.77 0.00 0.00 57.85 57.08 2ptq n ARG 344 Cb 0.13 -1.50 0.18 0.00 -1.02 0.00 0.00 32.46 30.25 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 -0.89 3.16 -0.23 0.55 3.02 -0.16 -4.63 115.26 116.09 2ptq n ASN 345 Ca 0.23 -2.29 0.08 0.00 -0.03 0.00 0.00 54.58 52.58 2ptq n ASN 345 Cb 0.13 -0.31 0.35 0.00 -0.61 0.00 0.00 39.78 39.34 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 1.89 0.68 -0.29 3.41 3.38 -1.69 -1.96 115.31 120.73 2ptq h LEU 346 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2ptq h LEU 346 Cb 0.92 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2ptq h LEU 346 CO 0.06 0.41 0.00 1.23 0.09 0.00 0.00 178.44 180.23 2ptq h GLY 347 N 0.76 0.00 0.76 0.83 0.00 -1.87 -3.29 103.07 100.26 2ptq h GLY 347 Ca 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.70 2ptq h GLY 347 CO -0.15 0.00 -0.05 -2.08 0.00 0.00 0.00 176.54 174.26 2ptq h VAL 348 N 0.00 1.03 -0.87 4.60 2.07 -1.67 0.66 116.25 122.07 2ptq h VAL 348 Ca 0.00 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 2ptq h VAL 348 Cb 0.89 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.98 2ptq h VAL 348 CO 0.00 0.13 0.45 1.23 0.02 0.00 0.00 177.57 179.40 2ptq h GLY 349 N -0.39 1.32 1.21 2.17 0.00 -1.68 -1.84 103.07 103.87 2ptq h GLY 349 Ca -0.01 -0.63 -0.11 0.00 0.00 0.00 0.00 47.33 46.57 2ptq h GLY 349 CO 0.02 0.60 -0.14 -2.22 0.00 0.00 0.00 176.54 174.80 2ptq h ILE 350 N 1.23 1.27 -0.34 2.60 2.04 -1.59 -2.95 117.51 119.76 2ptq h ILE 350 Ca 0.30 -1.27 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 2ptq h ILE 350 Cb 0.07 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 2ptq h ILE 350 CO -0.04 0.44 0.20 1.23 0.00 0.00 0.00 178.15 179.98 2ptq h GLY 351 N 0.95 0.50 0.84 5.37 0.00 0.95 -0.70 103.07 110.98 2ptq h GLY 351 Ca 0.12 -0.22 0.05 0.00 0.00 0.00 0.00 47.33 47.28 2ptq h GLY 351 CO 0.05 0.21 0.66 -0.97 0.00 0.00 0.00 176.54 176.48 2ptq h TYR 352 N 0.44 1.23 -0.31 5.60 0.05 -1.31 -1.60 116.97 121.06 2ptq h TYR 352 Ca 0.12 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.91 2ptq h TYR 352 Cb 0.03 -0.41 -0.01 0.00 1.01 0.00 0.00 36.73 37.34 2ptq h TYR 352 CO -0.04 0.69 0.11 0.00 -1.05 0.00 0.00 178.16 177.87 2ptq h ALA 353 N 1.43 0.41 -0.75 3.88 0.00 -1.27 -2.08 119.26 120.88 2ptq h ALA 353 Ca 0.41 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.19 2ptq h ALA 353 Cb 0.05 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2ptq h ALA 353 CO -0.14 0.03 0.50 -0.07 0.00 0.00 0.00 179.25 179.56 2ptq h LEU 354 N 0.35 0.85 -0.54 0.00 3.38 -0.55 0.49 115.31 119.28 2ptq h LEU 354 Ca 0.10 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.08 2ptq h LEU 354 Cb 0.21 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2ptq h LEU 354 CO -0.01 0.61 0.33 0.40 0.09 0.00 0.00 178.44 179.87 2ptq h ILE 355 N 1.01 1.07 -0.66 1.22 2.04 -1.18 -2.15 117.51 118.84 2ptq h ILE 355 Ca 0.28 -0.23 -0.07 0.00 1.00 0.00 0.00 64.86 65.85 2ptq h ILE 355 Cb -0.10 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.31 2ptq h ILE 355 CO -0.07 0.12 0.15 0.00 0.00 0.00 0.00 178.15 178.35 2ptq h ALA 356 N 1.24 1.01 -0.62 1.87 0.00 -0.61 -1.76 119.26 120.39 2ptq h ALA 356 Ca 0.22 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2ptq h ALA 356 Cb 0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2ptq h ALA 356 CO -0.09 0.64 0.23 1.88 0.00 0.00 0.00 179.25 181.91 2ptq h TYR 357 N 1.01 0.97 -0.45 0.00 0.05 -0.52 -1.32 116.97 116.71 2ptq h TYR 357 Ca 0.21 -0.08 -0.14 0.00 0.05 0.00 0.00 58.73 58.77 2ptq h TYR 357 Cb 0.37 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 2ptq h TYR 357 CO 0.03 0.78 -0.26 1.96 -1.05 0.00 0.00 178.16 179.62 2ptq h GLN 358 N 0.88 0.95 -0.58 4.88 4.20 -1.27 -2.10 115.11 122.08 2ptq h GLN 358 Ca 0.20 -0.43 -0.03 0.00 0.06 0.00 0.00 58.65 58.46 2ptq h GLN 358 Cb 0.24 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.97 2ptq h GLN 358 CO -0.01 1.09 0.24 0.77 -0.67 0.00 0.00 178.83 180.24 2ptq h SER 359 N 0.81 0.79 -0.49 1.46 0.02 -1.11 -1.05 113.55 113.99 2ptq h SER 359 Ca 0.10 -0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 60.85 2ptq h SER 359 Cb 0.83 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.14 2ptq h SER 359 CO 0.07 0.74 0.20 0.74 -1.14 0.00 0.00 176.83 177.44 2ptq h THR 360 N 0.80 1.21 -0.69 -2.27 2.02 -1.15 0.39 112.91 113.22 2ptq h THR 360 Ca 0.19 -0.65 -0.01 0.00 0.77 0.00 0.00 66.41 66.71 2ptq h THR 360 Cb 0.19 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 2ptq h THR 360 CO -0.02 0.24 0.38 -0.07 0.37 0.00 0.00 175.52 176.43 2ptq h LEU 361 N 0.65 0.84 -0.30 2.58 3.38 -1.17 0.17 115.31 121.46 2ptq h LEU 361 Ca 0.16 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 2ptq h LEU 361 Cb 0.19 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2ptq h LEU 361 CO -0.01 0.67 -0.05 0.50 0.09 0.00 0.00 178.44 179.64 2ptq h LYS 362 N 0.96 0.57 -0.58 1.13 3.64 -0.73 -2.15 116.57 119.40 2ptq h LYS 362 Ca 0.25 -0.21 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2ptq h LYS 362 Cb 0.01 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 2ptq h LYS 362 CO -0.04 0.75 0.36 0.78 -2.27 0.00 0.00 179.45 179.03 2ptq h GLY 363 N 0.35 0.84 0.88 5.01 0.00 -0.15 -2.58 103.07 107.42 2ptq h GLY 363 Ca 0.08 -0.34 0.03 0.00 0.00 0.00 0.00 47.33 47.10 2ptq h GLY 363 CO 0.03 0.33 0.64 -2.08 0.00 0.00 0.00 176.54 175.46 2ptq h VAL 364 N 0.79 1.17 0.00 4.60 2.07 -0.58 -1.61 116.25 122.69 2ptq h VAL 364 Ca 0.21 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 2ptq h VAL 364 Cb -0.03 -0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 29.56 2ptq h VAL 364 CO -0.04 0.23 -0.01 0.77 0.02 0.00 0.00 177.57 178.53 2ptq h SER 365 N 1.24 0.00 -0.11 0.57 4.64 -0.97 -2.34 113.55 116.58 2ptq h SER 365 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2ptq h SER 365 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2ptq h SER 365 CO -0.12 0.01 0.00 0.29 -0.87 0.00 0.00 176.83 176.14 2ptq n LYS 366 N -3.34 2.22 -2.47 4.77 5.02 -0.61 -4.96 118.16 118.79 2ptq n LYS 366 Ca -0.03 -1.79 -0.40 0.00 -2.02 0.00 0.00 58.31 54.07 2ptq n LYS 366 Cb 0.11 -1.47 -0.04 0.00 -0.02 0.00 0.00 35.03 33.60 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 -1.87 4.53 -0.25 -0.35 1.43 -0.88 -0.35 118.68 120.94 2ptq s LEU 367 Ca 0.32 2.27 -0.04 0.00 -1.03 0.00 0.00 54.13 55.64 2ptq s LEU 367 Cb 0.21 -3.66 0.09 0.00 0.03 0.00 0.00 46.19 42.86 2ptq s LEU 367 CO 0.31 -0.17 0.12 -1.61 0.23 0.00 0.00 176.35 175.23 2ptq s GLU 368 N -1.51 0.16 0.39 1.70 2.02 -0.65 -4.88 118.70 115.93 2ptq s GLU 368 Ca 0.45 -0.40 -0.27 0.00 0.02 0.00 0.00 54.97 54.78 2ptq s GLU 368 Cb -0.32 -1.39 -0.11 0.00 0.10 0.00 0.00 34.13 32.42 2ptq s GLU 368 CO 0.41 -0.91 1.32 1.55 0.02 0.00 0.00 175.26 177.65 2ptq n VAL 369 N 5.25 2.32 -3.58 2.63 3.14 -1.26 0.07 118.33 126.89 2ptq n VAL 369 Ca -0.06 -0.50 -0.37 0.00 -2.96 0.00 0.00 64.34 60.45 2ptq n VAL 369 Cb 0.44 -1.64 -0.06 0.00 -1.06 0.00 0.00 33.84 31.53 2ptq n VAL 369 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2ptq n ASN 370 N 0.39 4.41 -0.31 6.55 4.05 0.59 -4.76 115.26 126.18 2ptq n ASN 370 Ca 0.05 -3.14 0.04 0.00 0.45 0.00 0.00 54.58 51.98 2ptq n ASN 370 Cb 0.38 -1.08 0.19 0.00 1.23 0.00 0.00 39.78 40.50 2ptq n ASN 370 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 177.26 174.24 2ptq h ARG 371 N 5.97 0.78 -0.33 1.20 3.08 -1.92 -2.36 114.38 120.81 2ptq h ARG 371 Ca 0.17 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.23 2ptq h ARG 371 Cb 0.80 -0.18 -0.05 0.00 0.08 0.00 0.00 29.97 30.63 2ptq h ARG 371 CO 0.89 0.51 0.02 -0.44 -1.07 0.00 0.00 179.97 179.88 2ptq h ASP 372 N 0.80 -0.09 -0.34 7.04 3.32 -1.97 -1.00 116.42 124.18 2ptq h ASP 372 Ca 0.43 0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.49 2ptq h ASP 372 Cb 0.44 0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 2ptq h ASP 372 CO -0.27 -0.01 -0.01 -0.74 -1.72 0.00 0.00 179.24 176.49 2ptq h HIS 373 N 0.12 0.66 -0.45 4.55 2.76 -1.77 -0.89 115.15 120.13 2ptq h HIS 373 Ca 0.16 -0.12 0.04 0.00 -2.20 0.00 0.00 60.37 58.25 2ptq h HIS 373 Cb 0.20 -0.17 -0.04 0.00 1.55 0.00 0.00 27.41 28.95 2ptq h HIS 373 CO -0.22 0.72 0.20 -0.07 -1.30 0.00 0.00 177.93 177.27 2ptq h LEU 374 N 0.41 0.27 -0.36 0.26 3.38 -1.17 -0.52 115.31 117.58 2ptq h LEU 374 Ca 0.10 0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.93 2ptq h LEU 374 Cb 0.47 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 2ptq h LEU 374 CO 0.02 0.19 -0.43 -0.07 0.09 0.00 0.00 178.44 178.24 2ptq h LEU 375 N 0.41 1.00 -0.90 1.67 3.38 -1.14 -2.43 115.31 117.29 2ptq h LEU 375 Ca 0.20 -0.49 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 2ptq h LEU 375 Cb 0.14 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2ptq h LEU 375 CO -0.16 1.28 0.29 -0.78 0.09 0.00 0.00 178.44 179.16 2ptq h ASP 376 N 0.73 1.01 -0.46 -0.43 1.82 -0.87 -1.47 116.42 116.75 2ptq h ASP 376 Ca 0.05 -0.15 -0.07 0.00 -0.39 0.00 0.00 57.03 56.47 2ptq h ASP 376 Cb 1.03 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 40.77 2ptq h ASP 376 CO 0.10 0.90 0.03 -0.08 -1.61 0.00 0.00 179.24 178.58 2ptq h GLU 377 N 1.07 0.79 -0.55 0.28 4.81 -1.04 -2.82 114.58 117.13 2ptq h GLU 377 Ca 0.25 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 2ptq h GLU 377 Cb 0.20 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 2ptq h GLU 377 CO -0.02 0.83 0.28 -0.07 -0.73 0.00 0.00 179.01 179.30 2ptq h LEU 378 N 0.64 0.68 0.00 1.64 3.38 -1.08 -1.73 115.31 118.83 2ptq h LEU 378 Ca 0.13 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2ptq h LEU 378 Cb 0.46 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2ptq h LEU 378 CO 0.02 0.56 0.00 -0.67 0.09 0.00 0.00 178.44 178.44 2ptq n ASP 379 N -4.38 0.00 -0.60 -0.43 2.03 -0.59 -1.99 116.55 110.59 2ptq n ASP 379 Ca 0.05 0.02 0.05 0.00 0.52 0.00 0.00 54.79 55.43 2ptq n ASP 379 Cb 0.11 -0.28 0.14 0.00 -0.72 0.00 0.00 41.12 40.37 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 -1.28 0.44 -2.77 -0.67 8.25 -0.66 -4.66 115.22 113.88 2ptq n HIS 380 Ca 0.09 -0.51 -0.19 0.00 -0.26 0.00 0.00 57.72 56.85 2ptq n HIS 380 Cb 0.15 -0.03 -0.00 0.00 1.12 0.00 0.00 29.99 31.22 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 0.42 2.79 0.02 0.41 3.02 -0.84 -4.88 115.26 116.19 2ptq n ASN 381 Ca 0.11 -3.23 0.07 0.00 -0.03 0.00 0.00 54.58 51.50 2ptq n ASN 381 Cb 0.42 -0.53 0.30 0.00 -0.61 0.00 0.00 39.78 39.36 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 -0.14 0.13 0.31 3.10 7.02 -1.26 -2.62 117.44 123.98 2ptq n TRP 382 Ca 0.25 0.05 0.20 0.00 -1.02 0.00 0.00 57.50 56.98 2ptq n TRP 382 Cb 0.67 -0.59 0.96 0.00 -2.42 0.00 0.00 31.31 29.93 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 -1.98 114.58 112.78 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 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 2ptq h GLU 383 CO 0.00 0.00 0.00 1.33 -1.40 0.00 0.00 179.01 178.94 2ptq n VAL 384 N -3.10 1.24 1.81 3.13 0.24 -1.08 -1.66 118.33 118.91 2ptq n VAL 384 Ca -0.01 0.32 0.15 0.00 -2.04 0.00 0.00 64.34 62.76 2ptq n VAL 384 Cb 0.19 -1.14 0.78 0.00 -1.47 0.00 0.00 33.84 32.20 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 -1.53 0.57 -0.14 1.34 4.77 -0.74 -3.72 117.00 117.54 2ptq n LEU 385 Ca 0.03 -0.19 -0.05 0.00 -0.03 0.00 0.00 56.01 55.77 2ptq n LEU 385 Cb 0.13 -0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.36 2ptq n LEU 385 CO 0.10 0.10 0.92 0.00 -1.33 0.00 0.00 177.39 177.18 2ptq h ALA 386 N 4.13 1.10 0.56 -1.18 0.00 -1.53 -2.61 119.26 119.73 2ptq h ALA 386 Ca 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2ptq h ALA 386 Cb 0.19 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.77 2ptq h ALA 386 CO 0.00 0.58 -0.27 1.49 0.00 0.00 0.00 179.25 181.05 2ptq h GLU 387 N 0.82 -0.73 -0.65 0.00 4.81 -1.81 -1.25 114.58 115.77 2ptq h GLU 387 Ca 0.17 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 2ptq h GLU 387 Cb 0.40 0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 2ptq h GLU 387 CO 0.01 -0.48 0.38 -1.00 -0.73 0.00 0.00 179.01 177.20 2ptq h PRO 388 N -0.78 0.89 0.10 0.92 0.13 -1.79 -0.70 132.00 130.78 2ptq h PRO 388 Ca -0.08 -0.08 -0.01 0.00 -0.87 0.00 0.00 66.00 64.97 2ptq h PRO 388 Cb 0.59 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 31.53 2ptq h PRO 388 CO 0.13 0.63 -0.05 0.82 -0.23 0.00 0.00 178.00 179.30 2ptq h ILE 389 N 0.90 0.99 -0.44 -3.56 2.04 -1.37 -0.88 117.51 115.20 2ptq h ILE 389 Ca 0.23 -0.34 -0.04 0.00 1.00 0.00 0.00 64.86 65.71 2ptq h ILE 389 Cb -0.02 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2ptq h ILE 389 CO -0.04 0.08 0.12 0.06 0.00 0.00 0.00 178.15 178.37 2ptq h GLN 390 N -0.30 0.65 -0.46 2.37 -0.00 -1.00 -1.01 115.11 115.37 2ptq h GLN 390 Ca -0.01 -0.11 -0.07 0.00 -0.00 0.00 0.00 58.65 58.45 2ptq h GLN 390 Cb 0.25 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.48 27.60 2ptq h GLN 390 CO 0.02 0.59 0.01 1.15 -0.00 0.00 0.00 178.83 180.60 2ptq h THR 391 N 0.64 1.26 -0.69 1.86 2.02 -0.94 0.08 112.91 117.14 2ptq h THR 391 Ca 0.15 -1.04 -0.08 0.00 0.77 0.00 0.00 66.41 66.21 2ptq h THR 391 Cb 0.23 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 2ptq h THR 391 CO -0.01 0.36 0.12 0.58 0.37 0.00 0.00 175.52 176.95 2ptq h VAL 392 N 0.67 1.26 -0.72 3.16 2.07 -0.74 -1.98 116.25 119.97 2ptq h VAL 392 Ca 0.13 -1.03 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 2ptq h VAL 392 Cb 0.49 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 2ptq h VAL 392 CO 0.02 0.39 0.35 0.24 0.02 0.00 0.00 177.57 178.59 2ptq h MET 393 N 1.06 1.03 -0.16 1.57 2.86 -0.92 -2.28 114.93 118.10 2ptq h MET 393 Ca 0.21 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2ptq h MET 393 Cb 0.43 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 2ptq h MET 393 CO 0.01 0.79 0.10 0.00 1.06 0.00 0.00 176.91 178.88 2ptq h ARG 394 N 1.02 0.21 -0.61 1.72 3.08 -0.44 -1.31 114.38 118.05 2ptq h ARG 394 Ca 0.25 -0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.36 2ptq h ARG 394 Cb 0.11 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.05 2ptq h ARG 394 CO -0.03 0.14 0.28 -0.09 -1.07 0.00 0.00 179.97 179.20 2ptq h ARG 395 N 0.21 0.49 -0.87 0.04 2.43 -0.86 -2.60 114.38 113.22 2ptq h ARG 395 Ca 0.06 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.09 2ptq h ARG 395 Cb -0.02 -0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 29.35 2ptq h ARG 395 CO -0.01 0.32 0.14 0.66 -1.51 0.00 0.00 179.97 179.57 2ptq n TYR 396 N -4.92 1.30 -1.58 2.20 4.02 -0.91 -4.92 117.16 112.36 2ptq n TYR 396 Ca 0.08 -0.72 -0.17 0.00 -0.01 0.00 0.00 57.90 57.08 2ptq n TYR 396 Cb 0.23 -0.44 -0.07 0.00 -0.02 0.00 0.00 39.34 39.04 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 0.04 1.51 3.75 2.72 0.00 -0.98 -4.99 105.19 107.24 2ptq n GLY 397 Ca 0.21 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.66 3.74 0.55 -0.61 1.01 -0.51 -4.99 121.20 117.71 2ptq s ILE 398 Ca 0.00 1.61 -0.19 0.00 0.00 0.00 0.00 60.65 62.06 2ptq s ILE 398 Cb 0.00 -4.02 -0.06 0.00 0.01 0.00 0.00 42.46 38.39 2ptq s ILE 398 CO 0.00 0.33 1.13 -1.83 0.00 0.00 0.00 174.94 174.56 2ptq s GLU 399 N -0.84 3.35 -1.33 2.79 4.04 -1.26 -3.94 118.70 121.51 2ptq s GLU 399 Ca 0.47 1.60 -0.03 0.00 0.04 0.00 0.00 54.97 57.05 2ptq s GLU 399 Cb -0.30 -2.01 0.00 0.00 0.02 0.00 0.00 34.13 31.85 2ptq s GLU 399 CO 0.37 -0.85 0.05 1.63 -1.84 0.00 0.00 175.26 174.62 2ptq n LYS 400 N -1.33 -0.89 0.32 -4.83 4.76 -1.26 -4.87 118.16 110.06 2ptq n LYS 400 Ca 0.11 0.07 -0.17 0.00 -2.87 0.00 0.00 58.31 55.45 2ptq n LYS 400 Cb 0.51 -3.03 -0.09 0.00 -1.84 0.00 0.00 35.03 30.59 2ptq n LYS 400 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 2ptq h PRO 401 N -1.48 -0.85 -0.50 1.97 0.13 -1.89 -0.73 132.00 128.65 2ptq h PRO 401 Ca -0.58 0.06 0.03 0.00 -0.87 0.00 0.00 66.00 64.64 2ptq h PRO 401 Cb 1.22 0.19 -0.04 0.00 0.13 0.00 0.00 31.00 32.51 2ptq h PRO 401 CO 0.61 -0.57 0.28 -0.92 -0.23 0.00 0.00 178.00 177.17 2ptq h TYR 402 N -0.88 0.52 -0.78 1.56 5.03 -1.89 -2.49 116.97 118.02 2ptq h TYR 402 Ca -0.06 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.27 2ptq h TYR 402 Cb 0.73 -0.16 -0.04 0.00 1.55 0.00 0.00 36.73 38.81 2ptq h TYR 402 CO -0.12 0.28 0.51 0.93 -1.32 0.00 0.00 178.16 178.44 2ptq h GLU 403 N 0.55 1.04 -0.48 1.82 3.07 -1.92 -1.74 114.58 116.92 2ptq h GLU 403 Ca 0.21 -0.07 -0.07 0.00 -0.50 0.00 0.00 59.36 58.93 2ptq h GLU 403 Cb 0.07 -0.23 -0.02 0.00 -0.84 0.00 0.00 28.75 27.73 2ptq h GLU 403 CO -0.12 0.70 0.04 0.87 -1.40 0.00 0.00 179.01 179.10 2ptq h LYS 404 N 1.07 0.83 -0.01 2.33 1.57 -0.70 -2.44 116.57 119.21 2ptq h LYS 404 Ca 0.29 -0.25 -0.11 0.00 -1.87 0.00 0.00 60.65 58.71 2ptq h LYS 404 Cb -0.10 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 2ptq h LYS 404 CO -0.06 0.85 -0.50 -0.07 -0.57 0.00 0.00 179.45 179.11 2ptq h LEU 405 N 0.69 0.02 -0.33 2.94 -0.00 -1.20 -2.46 115.31 114.97 2ptq h LEU 405 Ca 0.14 -0.01 -0.05 0.00 -0.00 0.00 0.00 57.88 57.96 2ptq h LEU 405 Cb 0.46 -0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 41.10 2ptq h LEU 405 CO 0.02 0.51 -0.01 0.50 -0.00 0.00 0.00 178.44 179.47 2ptq h LYS 406 N 0.01 0.58 -0.21 1.13 3.11 -1.10 0.25 116.57 120.36 2ptq h LYS 406 Ca -0.00 -0.19 -0.04 0.00 -2.81 0.00 0.00 60.65 57.61 2ptq h LYS 406 Cb 0.89 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 32.05 2ptq h LYS 406 CO 0.07 0.72 -0.04 0.93 -2.81 0.00 0.00 179.45 178.31 2ptq h GLU 407 N 0.39 0.31 0.03 1.90 4.39 -1.33 0.38 114.58 120.65 2ptq h GLU 407 Ca 0.09 -0.06 -0.22 0.00 0.34 0.00 0.00 59.36 59.52 2ptq h GLU 407 Cb 0.46 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 2ptq h GLU 407 CO 0.02 0.38 -0.96 1.25 -1.16 0.00 0.00 179.01 178.53 2ptq h LEU 408 N 0.30 0.32 0.00 1.33 5.85 -1.02 -3.42 115.31 118.67 2ptq h LEU 408 Ca 0.07 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 2ptq h LEU 408 Cb 0.28 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 2ptq h LEU 408 CO 0.01 1.11 -1.02 0.35 -0.34 0.00 0.00 178.44 178.55 2ptq n THR 409 N -3.63 0.02 -1.83 1.05 -2.24 0.04 -4.77 114.28 102.91 2ptq n THR 409 Ca -0.05 -0.01 -0.43 0.00 -2.27 0.00 0.00 64.05 61.29 2ptq n THR 409 Cb 0.86 -0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.57 2ptq n THR 409 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2ptq s ARG 410 N -2.02 3.71 0.00 -0.78 3.52 0.11 -1.25 118.95 122.24 2ptq s ARG 410 Ca -0.00 2.06 0.00 0.00 -0.13 0.00 0.00 55.73 57.66 2ptq s ARG 410 Cb 0.00 -4.17 0.00 0.00 -1.56 0.00 0.00 34.95 29.22 2ptq s ARG 410 CO 0.02 -1.42 0.00 0.41 -0.81 0.00 0.00 175.30 173.49 2ptq n GLY 411 N 4.94 0.73 3.37 8.12 0.00 -1.26 -4.94 105.19 116.15 2ptq n GLY 411 Ca 0.22 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.07 1.48 -0.20 1.61 1.02 -0.38 -5.12 119.74 118.07 2ptq s LYS 412 Ca 0.00 -1.28 -0.15 0.00 0.02 0.00 0.00 55.97 54.56 2ptq s LYS 412 Cb 0.00 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 35.38 2ptq s LYS 412 CO 0.00 0.46 0.36 -0.98 -0.92 0.00 0.00 175.35 174.27 2ptq s ARG 413 N -1.85 4.16 -0.08 1.68 1.04 -1.26 -4.80 118.95 117.84 2ptq s ARG 413 Ca 0.13 0.14 -0.00 0.00 -1.04 0.00 0.00 55.73 54.95 2ptq s ARG 413 Cb -0.10 -3.53 0.02 0.00 -2.04 0.00 0.00 34.95 29.30 2ptq s ARG 413 CO 0.05 -0.01 -0.04 0.08 -0.04 0.00 0.00 175.30 175.33 2ptq s VAL 414 N 1.24 0.69 0.75 4.99 1.01 -1.26 -5.10 120.40 122.72 2ptq s VAL 414 Ca 0.17 -0.12 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2ptq s VAL 414 Cb -0.14 -0.75 0.14 0.00 0.00 0.00 0.00 36.38 35.62 2ptq s VAL 414 CO 0.07 0.30 1.03 1.51 0.00 0.00 0.00 175.10 178.01 2ptq s ASP 415 N 1.56 4.19 0.29 3.32 3.84 -1.26 -4.04 116.67 124.57 2ptq s ASP 415 Ca 0.00 -0.44 0.03 0.00 -0.00 0.00 0.00 52.55 52.15 2ptq s ASP 415 Cb -0.13 0.14 0.67 0.00 -1.38 0.00 0.00 42.92 42.21 2ptq s ASP 415 CO -0.04 -1.98 1.77 0.00 -0.00 0.00 0.00 175.17 174.92 2ptq h ALA 416 N -0.62 1.54 -0.03 2.11 0.00 -1.94 -1.30 119.26 119.03 2ptq h ALA 416 Ca -0.35 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2ptq h ALA 416 Cb 1.26 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2ptq h ALA 416 CO 0.38 -0.05 0.01 1.49 0.00 0.00 0.00 179.25 181.08 2ptq h GLU 417 N 0.73 0.05 -0.81 0.00 4.57 -1.99 -0.95 114.58 116.18 2ptq h GLU 417 Ca 0.54 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.70 2ptq h GLU 417 Cb 0.80 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.35 2ptq h GLU 417 CO -0.37 0.24 0.47 0.78 -1.18 0.00 0.00 179.01 178.95 2ptq h GLY 418 N -0.15 1.18 1.28 1.92 0.00 -1.74 0.06 103.07 105.62 2ptq h GLY 418 Ca 0.01 -0.50 -0.13 0.00 0.00 0.00 0.00 47.33 46.71 2ptq h GLY 418 CO -0.00 0.48 -0.28 -0.33 0.00 0.00 0.00 176.54 176.41 2ptq h MET 419 N 1.12 0.81 -0.37 4.80 2.86 -1.17 -2.49 114.93 120.49 2ptq h MET 419 Ca 0.29 -0.36 -0.04 0.00 -2.06 0.00 0.00 59.70 57.53 2ptq h MET 419 Cb -0.02 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 2ptq h MET 419 CO -0.05 0.99 0.09 0.87 1.06 0.00 0.00 176.91 179.87 2ptq h LYS 420 N 0.69 0.60 -0.77 1.72 1.57 -0.51 -2.24 116.57 117.63 2ptq h LYS 420 Ca 0.08 -0.14 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2ptq h LYS 420 Cb 0.82 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.01 2ptq h LYS 420 CO 0.07 0.64 0.50 1.96 -0.57 0.00 0.00 179.45 182.04 2ptq h GLN 421 N 0.45 0.97 -0.37 3.15 4.20 -0.92 -1.87 115.11 120.72 2ptq h GLN 421 Ca 0.12 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2ptq h GLN 421 Cb 0.31 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 2ptq h GLN 421 CO 0.00 0.64 0.24 0.35 -0.67 0.00 0.00 178.83 179.39 2ptq h PHE 422 N 1.00 0.46 -0.97 2.96 3.57 -1.22 -2.62 116.94 120.11 2ptq h PHE 422 Ca 0.30 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.82 2ptq h PHE 422 Cb -0.05 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 38.49 2ptq h PHE 422 CO -0.03 0.29 0.65 0.82 -2.23 0.00 0.00 178.31 177.81 2ptq h ILE 423 N 0.50 1.25 -0.40 1.41 2.04 -0.96 -2.39 117.51 118.96 2ptq h ILE 423 Ca 0.14 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2ptq h ILE 423 Cb -0.05 -0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 35.82 2ptq h ILE 423 CO -0.03 0.24 0.26 0.44 0.00 0.00 0.00 178.15 179.06 2ptq h ASP 424 N 1.32 0.46 0.46 1.72 3.45 -0.98 -1.48 116.42 121.36 2ptq h ASP 424 Ca 0.36 -0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.81 2ptq h ASP 424 Cb -0.15 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 38.51 2ptq h ASP 424 CO -0.08 0.33 0.00 0.61 -1.57 0.00 0.00 179.24 178.53 2ptq n GLY 425 N -1.48 -1.21 3.76 2.75 0.00 -0.90 -4.86 105.19 103.24 2ptq n GLY 425 Ca 0.03 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.47 4.58 -1.36 0.99 1.43 -0.56 -4.96 118.68 116.34 2ptq s LEU 426 Ca 0.31 2.04 -0.11 0.00 -1.03 0.00 0.00 54.13 55.34 2ptq s LEU 426 Cb 0.20 -3.66 0.11 0.00 0.03 0.00 0.00 46.19 42.87 2ptq s LEU 426 CO 0.44 0.04 2.05 0.00 0.23 0.00 0.00 176.35 179.10 2ptq n ALA 427 N 1.28 5.50 -2.41 4.21 0.00 -1.26 -4.92 120.51 122.91 2ptq n ALA 427 Ca -0.01 -4.12 -0.21 0.00 0.00 0.00 0.00 53.44 49.09 2ptq n ALA 427 Cb 0.47 -3.21 -0.10 0.00 0.00 0.00 0.00 19.45 16.60 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 0.79 2.56 0.29 0.00 1.43 -1.26 -4.99 118.68 117.50 2ptq s LEU 428 Ca 0.43 -1.01 -0.29 0.00 -1.03 0.00 0.00 54.13 52.23 2ptq s LEU 428 Cb 0.12 -0.88 -0.10 0.00 0.03 0.00 0.00 46.19 45.36 2ptq s LEU 428 CO -0.04 -0.06 1.34 -2.16 0.23 0.00 0.00 176.35 175.66 2ptq s PRO 429 N -3.51 4.34 0.26 1.29 0.04 -1.26 -4.77 135.00 131.39 2ptq s PRO 429 Ca 0.25 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.50 2ptq s PRO 429 Cb -0.03 -3.10 0.61 0.00 0.04 0.00 0.00 34.50 32.02 2ptq s PRO 429 CO 0.10 -0.26 1.34 -0.85 0.04 0.00 0.00 177.00 177.38 2ptq n GLU 430 N 1.51 -0.07 -0.24 4.56 0.00 -1.26 -0.14 120.64 125.01 2ptq n GLU 430 Ca 0.03 1.29 -0.00 0.00 0.00 0.00 0.00 57.16 58.47 2ptq n GLU 430 Cb 0.42 -2.03 0.12 0.00 0.00 0.00 0.00 31.44 29.94 2ptq n GLU 430 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 2ptq h GLU 431 N 0.00 0.67 -0.14 3.44 -0.00 -2.00 0.14 114.58 116.70 2ptq h GLU 431 Ca 0.50 -0.04 -0.15 0.00 -0.00 0.00 0.00 59.36 59.67 2ptq h GLU 431 Cb 1.00 -0.15 -0.01 0.00 -0.00 0.00 0.00 28.75 29.59 2ptq h GLU 431 CO -0.82 0.44 -0.55 0.93 -0.00 0.00 0.00 179.01 179.02 2ptq h GLU 432 N 0.69 0.41 -0.49 1.06 4.39 -0.89 -2.03 114.58 117.73 2ptq h GLU 432 Ca 0.32 -0.26 -0.08 0.00 0.34 0.00 0.00 59.36 59.69 2ptq h GLU 432 Cb 0.24 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 2ptq h GLU 432 CO -0.21 0.85 -0.01 0.87 -1.16 0.00 0.00 179.01 179.36 2ptq h LYS 433 N 0.32 0.87 -0.59 2.33 1.57 -0.79 -1.93 116.57 118.34 2ptq h LYS 433 Ca 0.01 -0.28 -0.03 0.00 -1.87 0.00 0.00 60.65 58.47 2ptq h LYS 433 Cb 1.06 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.27 2ptq h LYS 433 CO 0.09 0.91 0.24 0.00 -0.57 0.00 0.00 179.45 180.13 2ptq h ALA 434 N 0.92 0.77 -0.67 3.86 0.00 -0.88 -0.22 119.26 123.04 2ptq h ALA 434 Ca 0.14 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2ptq h ALA 434 Cb 0.53 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2ptq h ALA 434 CO 0.03 0.38 0.38 -0.09 0.00 0.00 0.00 179.25 179.95 2ptq h ARG 435 N 0.82 0.92 -0.49 0.00 2.43 -1.18 0.27 114.38 117.15 2ptq h ARG 435 Ca 0.20 -0.10 -0.11 0.00 -0.81 0.00 0.00 59.98 59.16 2ptq h ARG 435 Cb 0.20 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 2ptq h ARG 435 CO -0.02 0.68 -0.13 -0.07 -1.51 0.00 0.00 179.97 178.92 2ptq h LEU 436 N 0.91 0.93 -0.53 3.80 3.38 -1.05 -2.26 115.31 120.49 2ptq h LEU 436 Ca 0.24 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2ptq h LEU 436 Cb 0.02 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.51 2ptq h LEU 436 CO -0.04 1.06 0.00 0.29 0.09 0.00 0.00 178.44 179.84 2ptq n LYS 437 N -4.14 0.21 0.07 1.13 5.02 -0.12 -2.60 118.16 117.73 2ptq n LYS 437 Ca 0.01 0.37 0.12 0.00 -2.02 0.00 0.00 58.31 56.79 2ptq n LYS 437 Cb 0.40 -1.85 0.09 0.00 -0.02 0.00 0.00 35.03 33.65 2ptq n LYS 437 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ptq n ALA 438 N -1.77 2.89 -2.26 7.82 0.00 0.04 -4.93 120.51 122.29 2ptq n ALA 438 Ca 0.03 -0.27 -0.29 0.00 0.00 0.00 0.00 53.44 52.90 2ptq n ALA 438 Cb 0.27 -1.11 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 2ptq n ALA 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ptq s MET 439 N -3.24 3.67 0.14 0.00 0.23 -1.07 -5.06 119.30 113.98 2ptq s MET 439 Ca 0.04 0.31 -0.01 0.00 -1.03 0.00 0.00 55.69 55.00 2ptq s MET 439 Cb 0.12 -2.42 -0.04 0.00 -1.53 0.00 0.00 34.83 30.96 2ptq s MET 439 CO 0.76 -0.06 0.05 0.95 -2.03 0.00 0.00 175.02 174.69 2ptq s THR 440 N -2.46 0.18 0.24 3.16 -4.23 -1.26 -5.02 115.64 106.24 2ptq s THR 440 Ca 0.49 -1.92 -0.05 0.00 -1.18 0.00 0.00 61.69 59.02 2ptq s THR 440 Cb -0.10 -2.07 0.19 0.00 1.34 0.00 0.00 72.50 71.86 2ptq s THR 440 CO 0.36 -0.45 1.79 -0.65 -0.54 0.00 0.00 174.62 175.13 2ptq h PRO 441 N 2.83 0.64 -0.08 3.99 0.11 -1.89 -0.39 132.00 137.21 2ptq h PRO 441 Ca -0.35 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.69 2ptq h PRO 441 Cb 1.20 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2ptq h PRO 441 CO 0.59 0.42 -0.06 0.00 -0.21 0.00 0.00 178.00 178.75 2ptq h ALA 442 N 1.45 1.75 -0.04 -0.75 0.00 -1.94 -2.78 119.26 116.95 2ptq h ALA 442 Ca 0.38 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2ptq h ALA 442 Cb 0.40 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2ptq h ALA 442 CO -0.27 0.19 0.00 0.27 0.00 0.00 0.00 179.25 179.44 2ptq n ASN 443 N -4.40 2.75 -3.59 0.00 2.04 -0.74 -4.57 115.26 106.75 2ptq n ASN 443 Ca -0.02 -1.87 -0.41 0.00 -0.44 0.00 0.00 54.58 51.85 2ptq n ASN 443 Cb 0.18 -0.01 -0.00 0.00 -2.53 0.00 0.00 39.78 37.42 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 1.17 2.70 -0.15 -2.53 -0.00 -0.23 -4.50 117.16 113.61 2ptq n TYR 444 Ca 0.12 -2.84 0.05 0.00 -0.00 0.00 0.00 57.90 55.24 2ptq n TYR 444 Cb 0.52 -1.94 0.13 0.00 -0.00 0.00 0.00 39.34 38.05 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 2.44 1.00 -1.27 2.97 -5.35 -1.26 -3.95 119.36 113.95 2ptq n ILE 445 Ca 0.56 -1.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 2ptq n ILE 445 Cb 0.28 0.50 0.00 0.00 -1.74 0.00 0.00 39.64 38.69 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 0.39 3.08 0.97 3.28 0.00 -1.26 -2.22 105.19 109.43 2ptq n GLY 446 Ca 0.10 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 46.03 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 2.30 -0.33 1.61 0.63 -1.26 -4.68 116.66 128.93 2ptq n ARG 447 Ca 0.00 -1.80 -0.02 0.00 -0.92 0.00 0.00 57.85 55.11 2ptq n ARG 447 Cb 0.00 -1.45 0.04 0.00 0.45 0.00 0.00 32.46 31.50 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 3.84 0.14 -0.43 5.13 0.00 -1.85 -0.01 119.26 126.08 2ptq h ALA 448 Ca 0.00 0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 2ptq h ALA 448 Cb 0.75 0.93 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 2ptq h ALA 448 CO 0.04 -0.62 0.10 0.82 0.00 0.00 0.00 179.25 179.59 2ptq h ILE 449 N -0.04 1.23 -0.28 0.00 2.04 -1.83 -2.41 117.51 116.22 2ptq h ILE 449 Ca 0.33 -0.80 -0.08 0.00 1.00 0.00 0.00 64.86 65.31 2ptq h ILE 449 Cb 0.59 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2ptq h ILE 449 CO -0.91 0.28 -0.15 0.74 0.00 0.00 0.00 178.15 178.11 2ptq h THR 450 N 0.55 1.24 -0.50 -0.27 2.02 -1.76 -1.40 112.91 112.80 2ptq h THR 450 Ca 0.13 -1.07 0.01 0.00 0.77 0.00 0.00 66.41 66.25 2ptq h THR 450 Cb 0.32 1.19 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 2ptq h THR 450 CO 0.00 0.35 0.32 0.24 0.37 0.00 0.00 175.52 176.80 2ptq h MET 451 N 0.45 0.62 -0.21 6.66 2.86 -0.75 -0.18 114.93 124.38 2ptq h MET 451 Ca 0.08 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2ptq h MET 451 Cb 0.53 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 2ptq h MET 451 CO 0.03 0.41 0.10 0.28 1.06 0.00 0.00 176.91 178.80 2ptq h VAL 452 N 0.64 1.13 0.00 -2.22 2.07 -0.96 -2.47 116.25 114.45 2ptq h VAL 452 Ca 0.19 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2ptq h VAL 452 Cb -0.04 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 2ptq h VAL 452 CO -0.06 0.13 -0.07 0.44 0.02 0.00 0.00 177.57 178.03 2ptq h ASP 453 N 0.21 0.00 0.32 0.57 3.32 -0.84 -2.38 116.42 117.62 2ptq h ASP 453 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2ptq h ASP 453 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2ptq h ASP 453 CO -0.01 0.07 -0.34 -0.62 -1.72 0.00 0.00 179.24 176.62 2ptq n GLU 454 N -4.08 0.57 -0.26 3.56 1.02 -0.12 -4.29 120.64 117.03 2ptq n GLU 454 Ca -0.03 -0.33 0.05 0.00 -0.02 0.00 0.00 57.16 56.83 2ptq n GLU 454 Cb 0.15 -1.49 0.19 0.00 -0.02 0.00 0.00 31.44 30.27 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 0.81 0.31 -2.13 -4.62 5.85 -0.98 0.24 115.31 114.80 2ptq h LEU 455 Ca 0.00 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.85 2ptq h LEU 455 Cb 0.50 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.60 2ptq h LEU 455 CO 0.00 0.12 0.30 0.07 -0.34 0.00 0.00 178.44 178.59 2ptq h LYS 456 N 0.47 0.00 -0.00 1.25 2.10 -1.79 0.37 116.57 118.97 2ptq h LYS 456 Ca 0.42 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.07 2ptq h LYS 456 Cb 0.62 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.95 2ptq h LYS 456 CO -0.39 0.00 -0.07 0.72 -2.00 0.00 0.00 179.45 177.70 2ptq n HIS 457 N -3.15 0.00 -4.05 0.07 8.25 0.07 -4.82 115.22 111.59 2ptq n HIS 457 Ca -0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 2ptq n HIS 457 Cb 0.38 -0.24 -0.06 0.00 1.12 0.00 0.00 29.99 31.19 2ptq n HIS 457 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2ptq s HIS 458 N -2.55 3.19 0.00 4.41 3.76 0.12 -5.18 115.29 119.04 2ptq s HIS 458 Ca 0.28 0.07 0.00 0.00 -0.15 0.00 0.00 55.06 55.26 2ptq s HIS 458 Cb 0.20 -1.61 0.00 0.00 1.11 0.00 0.00 32.58 32.28 2ptq s HIS 458 CO 0.48 0.52 0.00 0.72 -0.85 0.00 0.00 174.74 175.61