#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hcq n SER 32 N 0.00 2.44 -0.68 4.31 7.64 -1.26 -4.00 113.62 122.07 3hcq n SER 32 Ca 0.00 -1.81 0.12 0.00 1.01 0.00 0.00 58.87 58.19 3hcq n SER 32 Cb 0.00 -0.07 0.19 0.00 -1.01 0.00 0.00 64.21 63.32 3hcq n SER 32 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hcq h GLY 34 N 4.79 0.00 -5.46 0.00 0.00 -2.00 -3.42 103.07 96.98 3hcq h GLY 34 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 3hcq h GLY 34 CO 0.00 0.00 -0.82 -1.59 0.00 0.00 0.00 176.54 174.13 3hcq s THR 35 N -4.30 1.15 -0.10 4.70 2.01 -1.26 -3.89 115.64 113.96 3hcq s THR 35 Ca -0.03 -0.55 0.01 0.00 0.31 0.00 0.00 61.69 61.43 3hcq s THR 35 Cb 0.14 -1.01 -0.02 0.00 0.01 0.00 0.00 72.50 71.62 3hcq s THR 35 CO 0.63 0.34 -0.14 -0.69 -0.69 0.00 0.00 174.62 174.08 3hcq s VAL 36 N 0.19 3.06 -0.05 3.82 1.01 -1.20 -5.06 120.40 122.17 3hcq s VAL 36 Ca -0.05 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.26 3hcq s VAL 36 Cb -0.11 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 3hcq s VAL 36 CO 0.02 0.55 -0.08 -0.13 0.00 0.00 0.00 175.10 175.46 3hcq s ARG 37 N -0.09 2.66 0.48 2.72 0.52 -1.26 -2.52 118.95 121.46 3hcq s ARG 37 Ca -0.02 -0.61 0.02 0.00 -0.52 0.00 0.00 55.73 54.60 3hcq s ARG 37 Cb -0.14 -2.54 -0.01 0.00 0.52 0.00 0.00 34.95 32.78 3hcq s ARG 37 CO 0.04 0.64 0.06 -0.06 0.02 0.00 0.00 175.30 176.00 3hcq s PHE 38 N -0.85 1.82 -0.07 -0.53 0.08 -0.85 -1.88 117.98 115.70 3hcq s PHE 38 Ca 0.13 -1.11 -0.03 0.00 0.12 0.00 0.00 56.93 56.05 3hcq s PHE 38 Cb -0.11 -1.42 0.04 0.00 -0.57 0.00 0.00 43.02 40.96 3hcq s PHE 38 CO 0.03 0.00 0.13 0.45 -0.10 0.00 0.00 175.22 175.73 3hcq s SER 39 N -3.78 0.66 -0.13 1.36 0.15 -1.18 -3.42 113.70 107.37 3hcq s SER 39 Ca 0.12 0.26 -0.00 0.00 0.70 0.00 0.00 55.95 57.03 3hcq s SER 39 Cb 0.02 0.16 0.03 0.00 -1.71 0.00 0.00 66.02 64.51 3hcq s SER 39 CO 0.07 -0.23 -0.09 -0.62 1.20 0.00 0.00 173.24 173.58 3hcq s ASP 40 N 2.04 2.42 -0.06 5.45 -1.08 -1.00 -4.71 116.67 119.72 3hcq s ASP 40 Ca 0.01 -0.41 -0.25 0.00 -0.52 0.00 0.00 52.55 51.38 3hcq s ASP 40 Cb -0.12 -0.94 -0.24 0.00 -1.46 0.00 0.00 42.92 40.15 3hcq s ASP 40 CO -0.05 -0.11 0.99 0.58 0.52 0.00 0.00 175.17 177.09 3hcq h VAL 41 N 6.18 1.58 0.00 1.11 2.07 -1.88 -3.29 116.25 122.02 3hcq h VAL 41 Ca -0.31 -2.01 0.00 0.00 0.82 0.00 0.00 66.70 65.20 3hcq h VAL 41 Cb 1.13 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.77 3hcq h VAL 41 CO 0.44 0.55 0.00 0.61 0.02 0.00 0.00 177.57 179.18 3hcq n GLY 42 N 1.14 -0.96 3.84 2.17 0.00 -1.26 -4.76 105.19 105.36 3hcq n GLY 42 Ca -0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 3hcq n GLY 42 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3hcq s TRP 43 N 0.00 3.18 0.17 1.61 0.51 -1.26 -4.98 118.94 118.16 3hcq s TRP 43 Ca 0.00 1.24 0.16 0.00 -2.12 0.00 0.00 56.10 55.38 3hcq s TRP 43 Cb 0.00 -2.96 0.51 0.00 -0.81 0.00 0.00 33.47 30.21 3hcq s TRP 43 CO 0.00 -1.27 1.66 1.15 -0.51 0.00 0.00 176.95 177.98 3hcq h THR 44 N -0.73 1.06 0.13 2.01 2.02 -2.01 -3.04 112.91 112.35 3hcq h THR 44 Ca -0.45 -1.81 -0.30 0.00 0.77 0.00 0.00 66.41 64.63 3hcq h THR 44 Cb 1.23 2.06 0.00 0.00 -1.74 0.00 0.00 68.15 69.70 3hcq h THR 44 CO 0.60 0.46 -1.42 -2.24 0.37 0.00 0.00 175.52 173.29 3hcq h ASP 45 N 0.00 0.44 0.65 4.18 2.03 -1.97 -3.22 116.42 118.53 3hcq h ASP 45 Ca -0.00 -0.54 -0.15 0.00 -0.73 0.00 0.00 57.03 55.61 3hcq h ASP 45 Cb 1.02 -0.14 -0.02 0.00 -0.83 0.00 0.00 39.33 39.36 3hcq h ASP 45 CO 0.06 1.44 -0.68 -0.29 -1.03 0.00 0.00 179.24 178.74 3hcq h ILE 46 N 0.08 1.48 0.00 4.15 6.09 -1.97 -2.80 117.51 124.53 3hcq h ILE 46 Ca -0.20 -2.31 -0.09 0.00 -1.37 0.00 0.00 64.86 60.89 3hcq h ILE 46 Cb 2.01 2.24 -0.01 0.00 0.47 0.00 0.00 36.82 41.53 3hcq h ILE 46 CO 0.19 0.66 -0.42 0.74 -3.07 0.00 0.00 178.15 176.25 3hcq h THR 47 N 0.02 1.09 0.06 2.19 2.02 -1.64 -2.74 112.91 113.91 3hcq h THR 47 Ca -0.01 -1.55 -0.26 0.00 0.77 0.00 0.00 66.41 65.36 3hcq h THR 47 Cb 1.21 1.89 -0.02 0.00 -1.74 0.00 0.00 68.15 69.48 3hcq h THR 47 CO 0.09 0.41 -1.30 0.00 0.37 0.00 0.00 175.52 175.09 3hcq h ALA 48 N 1.58 0.34 0.19 6.16 0.00 -1.54 -3.27 119.26 122.72 3hcq h ALA 48 Ca -0.00 -1.04 -0.31 0.00 0.00 0.00 0.00 54.91 53.56 3hcq h ALA 48 Cb 0.85 0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.75 3hcq h ALA 48 CO 0.05 1.21 -1.38 1.79 0.00 0.00 0.00 179.25 180.93 3hcq h THR 49 N 0.03 1.37 -0.29 0.00 1.35 -1.49 -3.36 112.91 110.53 3hcq h THR 49 Ca -0.14 -2.88 -0.18 0.00 -0.55 0.00 0.00 66.41 62.66 3hcq h THR 49 Cb 1.92 2.98 -0.00 0.00 -1.73 0.00 0.00 68.15 71.31 3hcq h THR 49 CO 0.15 0.85 -0.52 0.74 -0.25 0.00 0.00 175.52 176.49 3hcq h THR 50 N 0.11 1.28 0.00 6.82 2.02 -1.65 -3.10 112.91 118.39 3hcq h THR 50 Ca -0.20 -1.71 0.00 0.00 0.77 0.00 0.00 66.41 65.27 3hcq h THR 50 Cb 2.07 1.60 0.00 0.00 -1.74 0.00 0.00 68.15 70.08 3hcq h THR 50 CO 0.23 0.56 0.00 0.00 0.37 0.00 0.00 175.52 176.68 3hcq n ALA 51 N -2.56 1.27 -0.00 6.16 0.00 -1.23 -2.49 120.51 121.65 3hcq n ALA 51 Ca -0.04 0.09 -0.18 0.00 0.00 0.00 0.00 53.44 53.32 3hcq n ALA 51 Cb 0.61 -1.25 -0.14 0.00 0.00 0.00 0.00 19.45 18.67 3hcq n ALA 51 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3hcq h THR 52 N 0.00 1.57 0.00 0.00 2.02 -1.68 -3.33 112.91 111.48 3hcq h THR 52 Ca 0.00 -2.44 -0.04 0.00 0.77 0.00 0.00 66.41 64.70 3hcq h THR 52 Cb 0.12 3.21 -0.01 0.00 -1.74 0.00 0.00 68.15 69.73 3hcq h THR 52 CO 0.00 0.66 -0.19 0.00 0.37 0.00 0.00 175.52 176.36 3hcq h ALA 53 N 0.02 1.66 -0.06 6.16 0.00 -1.60 -3.13 119.26 122.31 3hcq h ALA 53 Ca -0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3hcq h ALA 53 Cb 1.39 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 3hcq h ALA 53 CO 0.07 0.24 0.01 1.15 0.00 0.00 0.00 179.25 180.72 3hcq h THR 54 N 0.00 1.21 -0.06 0.00 2.02 -1.67 -2.94 112.91 111.47 3hcq h THR 54 Ca -0.00 -0.65 -0.09 0.00 0.77 0.00 0.00 66.41 66.43 3hcq h THR 54 Cb 0.34 1.54 -0.01 0.00 -1.74 0.00 0.00 68.15 68.28 3hcq h THR 54 CO 0.02 0.18 -0.39 0.00 0.37 0.00 0.00 175.52 175.70 3hcq h THR 55 N -0.15 1.30 -0.09 3.16 1.03 -1.65 -0.72 112.91 115.79 3hcq h THR 55 Ca 0.02 -1.43 -0.18 0.00 -0.01 0.00 0.00 66.41 64.81 3hcq h THR 55 Cb 0.28 1.69 0.01 0.00 -1.07 0.00 0.00 68.15 69.06 3hcq h THR 55 CO 0.00 0.42 -0.64 0.40 -0.01 0.00 0.00 175.52 175.69 3hcq h ILE 56 N 0.11 1.35 0.00 0.00 2.04 -1.62 -3.05 117.51 116.33 3hcq h ILE 56 Ca 0.01 -1.94 -0.07 0.00 1.00 0.00 0.00 64.86 63.85 3hcq h ILE 56 Cb 0.75 2.24 -0.01 0.00 -0.74 0.00 0.00 36.82 39.05 3hcq h ILE 56 CO 0.06 0.59 -0.35 0.25 0.00 0.00 0.00 178.15 178.70 3hcq h LEU 57 N 0.20 0.00 -0.75 1.44 6.46 -1.43 -3.06 115.31 118.18 3hcq h LEU 57 Ca -0.06 0.00 -0.11 0.00 -0.12 0.00 0.00 57.88 57.59 3hcq h LEU 57 Cb 1.29 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.21 3hcq h LEU 57 CO 0.13 0.35 -0.26 -0.08 -0.62 0.00 0.00 178.44 177.95 3hcq h GLU 58 N 0.00 0.66 0.00 1.25 4.81 -1.17 -3.00 114.58 117.13 3hcq h GLU 58 Ca -0.00 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 3hcq h GLU 58 Cb 1.06 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.42 3hcq h GLU 58 CO 0.05 0.85 0.00 0.00 -0.73 0.00 0.00 179.01 179.18 3hcq h ALA 59 N 1.14 1.00 0.00 2.92 0.00 -1.42 -2.72 119.26 120.18 3hcq h ALA 59 Ca 0.08 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3hcq h ALA 59 Cb 0.75 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3hcq h ALA 59 CO 0.06 0.00 -0.55 -0.07 0.00 0.00 0.00 179.25 178.69 3hcq h LEU 60 N 0.00 0.00 0.00 0.00 3.38 -1.56 -3.45 115.31 113.68 3hcq h LEU 60 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hcq h LEU 60 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3hcq h LEU 60 CO 0.00 0.35 0.00 0.61 0.09 0.00 0.00 178.44 179.49 3hcq n GLY 61 N 1.21 0.70 0.00 0.83 0.00 -1.03 -3.93 105.19 102.97 3hcq n GLY 61 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3hcq n GLY 61 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hcq n TYR 62 N 0.00 0.00 -4.15 1.61 4.01 -1.23 -4.83 117.16 112.57 3hcq n TYR 62 Ca 0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.65 3hcq n TYR 62 Cb 0.00 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 38.93 3hcq n TYR 62 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3hcq s GLU 63 N -0.73 0.83 0.01 -0.72 2.02 -1.25 -4.83 118.70 114.02 3hcq s GLU 63 Ca 0.00 -1.36 0.01 0.00 0.02 0.00 0.00 54.97 53.63 3hcq s GLU 63 Cb 0.00 0.08 -0.01 0.00 0.10 0.00 0.00 34.13 34.31 3hcq s GLU 63 CO 0.00 -0.15 -0.03 0.99 0.02 0.00 0.00 175.26 176.09 3hcq s THR 64 N -3.88 0.17 -0.05 3.63 2.01 -1.26 -3.25 115.64 113.02 3hcq s THR 64 Ca 0.16 -0.34 -0.02 0.00 0.31 0.00 0.00 61.69 61.80 3hcq s THR 64 Cb 0.07 -0.20 0.03 0.00 0.01 0.00 0.00 72.50 72.41 3hcq s THR 64 CO -0.03 -0.11 0.08 -0.62 -0.69 0.00 0.00 174.62 173.25 3hcq s ASP 65 N -0.48 0.76 -0.14 3.53 2.15 -1.05 -4.99 116.67 116.45 3hcq s ASP 65 Ca -0.04 0.14 -0.00 0.00 0.43 0.00 0.00 52.55 53.07 3hcq s ASP 65 Cb -0.03 -0.02 -0.01 0.00 -0.30 0.00 0.00 42.92 42.55 3hcq s ASP 65 CO -0.00 -0.22 -0.13 -0.69 -0.17 0.00 0.00 175.17 173.96 3hcq s VAL 66 N 1.90 3.01 -0.04 1.11 1.01 -1.26 -2.01 120.40 124.12 3hcq s VAL 66 Ca 0.01 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.36 3hcq s VAL 66 Cb -0.12 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 3hcq s VAL 66 CO -0.04 0.51 -0.13 -0.54 0.00 0.00 0.00 175.10 174.90 3hcq s LYS 67 N 0.56 2.49 -0.38 2.72 -0.14 -1.22 -5.01 119.74 118.76 3hcq s LYS 67 Ca -0.08 -0.71 -0.10 0.00 -1.36 0.00 0.00 55.97 53.72 3hcq s LYS 67 Cb -0.16 -2.39 0.04 0.00 -1.68 0.00 0.00 37.83 33.64 3hcq s LYS 67 CO 0.04 0.62 0.21 0.54 -0.76 0.00 0.00 175.35 176.00 3hcq s VAL 68 N -0.78 4.47 0.30 3.17 0.11 -1.26 -2.37 120.40 124.04 3hcq s VAL 68 Ca 0.12 -0.98 0.03 0.00 -2.93 0.00 0.00 61.98 58.22 3hcq s VAL 68 Cb -0.11 -3.55 -0.04 0.00 -1.53 0.00 0.00 36.38 31.16 3hcq s VAL 68 CO 0.02 -0.29 0.14 -0.76 -3.33 0.00 0.00 175.10 170.88 3hcq s LEU 69 N 1.52 1.69 0.74 2.54 1.43 -1.24 -5.03 118.68 120.34 3hcq s LEU 69 Ca 0.02 -1.51 -0.05 0.00 -1.03 0.00 0.00 54.13 51.55 3hcq s LEU 69 Cb -0.20 0.12 0.11 0.00 0.03 0.00 0.00 46.19 46.25 3hcq s LEU 69 CO 0.06 -0.84 1.04 -0.55 0.23 0.00 0.00 176.35 176.29 3hcq s SER 70 N -3.37 4.36 -0.00 2.29 0.15 -1.26 -4.44 113.70 111.42 3hcq s SER 70 Ca 0.36 0.07 -0.24 0.00 0.70 0.00 0.00 55.95 56.83 3hcq s SER 70 Cb 0.06 -0.53 -0.16 0.00 -1.71 0.00 0.00 66.02 63.68 3hcq s SER 70 CO 0.16 -1.87 1.16 0.58 1.20 0.00 0.00 173.24 174.47 3hcq h VAL 71 N -0.71 0.70 0.00 4.45 2.07 -1.91 -2.68 116.25 118.18 3hcq h VAL 71 Ca -0.41 -0.69 -0.02 0.00 0.82 0.00 0.00 66.70 66.39 3hcq h VAL 71 Cb 1.28 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 32.09 3hcq h VAL 71 CO 0.48 0.13 -0.12 -0.65 0.02 0.00 0.00 177.57 177.43 3hcq h PRO 72 N -0.79 0.00 0.00 1.57 0.11 -1.97 -2.82 132.00 128.10 3hcq h PRO 72 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 3hcq h PRO 72 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 3hcq h PRO 72 CO 0.06 0.12 0.00 0.28 -0.21 0.00 0.00 178.00 178.25 3hcq h VAL 73 N 0.00 0.00 0.09 3.15 2.07 -1.96 -3.25 116.25 116.35 3hcq h VAL 73 Ca -0.00 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 3hcq h VAL 73 Cb 0.67 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 3hcq h VAL 73 CO 0.02 0.00 -0.04 0.74 0.02 0.00 0.00 177.57 178.30 3hcq h THR 74 N 0.00 1.16 0.00 2.57 2.02 -1.20 -3.11 112.91 114.35 3hcq h THR 74 Ca 0.00 -1.23 -0.04 0.00 0.77 0.00 0.00 66.41 65.90 3hcq h THR 74 Cb 0.60 1.91 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 3hcq h THR 74 CO 0.00 0.29 -0.21 1.88 0.37 0.00 0.00 175.52 177.85 3hcq h TYR 75 N -0.72 0.00 -0.03 3.16 0.05 -1.69 -3.01 116.97 114.73 3hcq h TYR 75 Ca -0.01 0.00 -0.20 0.00 0.05 0.00 0.00 58.73 58.56 3hcq h TYR 75 Cb 0.56 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.30 3hcq h TYR 75 CO 0.11 0.21 -0.84 1.15 -1.05 0.00 0.00 178.16 177.73 3hcq h THR 76 N 0.00 1.41 0.00 -2.88 2.02 -1.67 -3.28 112.91 108.51 3hcq h THR 76 Ca -0.00 -2.36 -0.16 0.00 0.77 0.00 0.00 66.41 64.66 3hcq h THR 76 Cb 0.78 2.31 -0.02 0.00 -1.74 0.00 0.00 68.15 69.47 3hcq h THR 76 CO 0.03 0.70 -0.77 -1.28 0.37 0.00 0.00 175.52 174.56 3hcq h SER 77 N 0.22 0.00 0.13 4.18 0.87 -1.45 -3.12 113.55 114.39 3hcq h SER 77 Ca -0.05 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.41 3hcq h SER 77 Cb 1.45 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.40 3hcq h SER 77 CO 0.14 0.77 -0.32 -0.07 -0.53 0.00 0.00 176.83 176.83 3hcq h LEU 78 N 0.00 0.29 -0.54 2.23 3.38 -1.62 -2.70 115.31 116.36 3hcq h LEU 78 Ca -0.01 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 3hcq h LEU 78 Cb 1.50 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 3hcq h LEU 78 CO 0.10 0.60 -0.48 0.50 0.09 0.00 0.00 178.44 179.26 3hcq h LYS 79 N 0.25 0.63 0.00 1.13 3.64 -1.61 -3.12 116.57 117.49 3hcq h LYS 79 Ca 0.03 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 3hcq h LYS 79 Cb 0.69 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 3hcq h LYS 79 CO 0.05 0.97 0.00 -0.91 -2.27 0.00 0.00 179.45 177.29 3hcq h ASN 80 N 0.50 0.00 -0.87 4.20 4.21 -1.46 -3.47 115.58 118.69 3hcq h ASN 80 Ca 0.03 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.50 3hcq h ASN 80 Cb 1.02 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.22 3hcq h ASN 80 CO 0.10 0.00 -0.05 0.29 -1.29 0.00 0.00 177.43 176.47 3hcq n LYS 81 N -2.44 -0.42 -0.00 0.81 5.02 -1.09 -4.99 118.16 115.04 3hcq n LYS 81 Ca 0.03 0.08 0.05 0.00 -2.02 0.00 0.00 58.31 56.44 3hcq n LYS 81 Cb 0.30 -3.19 -0.12 0.00 -0.02 0.00 0.00 35.03 32.00 3hcq n LYS 81 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3hcq n ASP 82 N 1.38 0.30 -3.69 4.39 8.00 -1.04 -5.01 116.55 120.87 3hcq n ASP 82 Ca -0.01 0.12 -0.23 0.00 0.71 0.00 0.00 54.79 55.38 3hcq n ASP 82 Cb 0.51 1.22 -0.06 0.00 -0.02 0.00 0.00 41.12 42.77 3hcq n ASP 82 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 3hcq n ILE 83 N -2.53 0.00 0.03 0.53 -5.35 -1.26 -5.05 119.36 105.73 3hcq n ILE 83 Ca -0.10 -2.13 0.00 0.00 -0.27 0.00 0.00 62.75 60.25 3hcq n ILE 83 Cb 0.73 0.73 0.00 0.00 -1.74 0.00 0.00 39.64 39.36 3hcq n ILE 83 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3hcq n ASP 84 N -1.55 0.47 -4.07 7.28 8.00 -1.22 -4.88 116.55 120.58 3hcq n ASP 84 Ca -0.06 0.10 -0.23 0.00 0.71 0.00 0.00 54.79 55.30 3hcq n ASP 84 Cb 0.55 -0.11 -0.16 0.00 -0.02 0.00 0.00 41.12 41.38 3hcq n ASP 84 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hcq s VAL 85 N -2.00 1.12 0.05 2.53 1.01 -0.79 -3.71 120.40 118.61 3hcq s VAL 85 Ca 0.00 -0.54 0.06 0.00 0.00 0.00 0.00 61.98 61.49 3hcq s VAL 85 Cb 0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 3hcq s VAL 85 CO 0.00 0.33 -0.16 0.12 0.00 0.00 0.00 175.10 175.40 3hcq s PHE 86 N 0.14 1.37 0.00 5.22 5.36 -1.21 -3.08 117.98 125.78 3hcq s PHE 86 Ca -0.04 -0.38 0.00 0.00 -0.96 0.00 0.00 56.93 55.55 3hcq s PHE 86 Cb -0.10 -0.80 0.00 0.00 -0.34 0.00 0.00 43.02 41.78 3hcq s PHE 86 CO 0.01 0.06 0.51 -0.11 -1.46 0.00 0.00 175.22 174.24 3hcq n LEU 87 N 1.71 1.01 -3.90 6.12 7.94 -1.26 -3.18 117.00 125.44 3hcq n LEU 87 Ca -0.19 -1.01 -0.30 0.00 -1.11 0.00 0.00 56.01 53.40 3hcq n LEU 87 Cb 0.54 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 44.34 3hcq n LEU 87 CO 0.23 0.25 -0.34 -0.83 -1.11 0.00 0.00 177.39 175.59 3hcq s GLY 88 N -0.05 1.52 -0.63 -3.96 0.00 -1.26 -4.75 107.32 98.18 3hcq s GLY 88 Ca 0.00 -2.04 0.05 0.00 0.00 0.00 0.00 44.72 42.73 3hcq s GLY 88 CO 0.00 1.19 0.53 -2.01 0.00 0.00 0.00 173.10 172.81 3hcq n ASN 89 N 4.54 2.46 -4.59 1.64 5.15 -1.25 -4.97 115.26 118.25 3hcq n ASN 89 Ca -0.01 -3.10 -0.42 0.00 -0.60 0.00 0.00 54.58 50.45 3hcq n ASN 89 Cb 0.42 -0.70 -0.02 0.00 -0.53 0.00 0.00 39.78 38.95 3hcq n ASN 89 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 3hcq s TRP 90 N -1.43 2.35 0.26 1.20 0.52 -1.26 -3.48 118.94 117.10 3hcq s TRP 90 Ca 0.30 0.57 0.06 0.00 0.02 0.00 0.00 56.10 57.06 3hcq s TRP 90 Cb 0.02 -4.36 -0.03 0.00 -1.15 0.00 0.00 33.47 27.95 3hcq s TRP 90 CO -0.14 -1.94 0.27 -1.64 0.02 0.00 0.00 176.95 173.52 3hcq s MET 91 N 5.24 3.07 -0.22 4.98 -1.94 -1.19 -3.02 119.30 126.22 3hcq s MET 91 Ca 0.56 -0.99 0.09 0.00 -1.71 0.00 0.00 55.69 53.64 3hcq s MET 91 Cb -0.12 -2.67 0.59 0.00 2.01 0.00 0.00 34.83 34.65 3hcq s MET 91 CO 0.29 0.36 1.50 -0.35 -0.01 0.00 0.00 175.02 176.81 3hcq n PRO 92 N -1.29 3.48 0.00 2.03 -0.04 -1.26 -4.02 135.00 133.90 3hcq n PRO 92 Ca -0.07 -2.35 0.13 0.00 -0.04 0.00 0.00 63.50 61.17 3hcq n PRO 92 Cb 0.58 -2.04 0.41 0.00 -0.04 0.00 0.00 33.50 32.41 3hcq n PRO 92 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3hcq n THR 93 N 0.19 0.02 -0.87 0.52 -2.24 -1.25 -3.81 114.28 106.83 3hcq n THR 93 Ca 0.27 -0.01 0.07 0.00 -2.27 0.00 0.00 64.05 62.11 3hcq n THR 93 Cb 1.07 -0.09 0.39 0.00 -2.10 0.00 0.00 70.33 69.59 3hcq n THR 93 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 3hcq n MET 94 N -1.53 4.61 -0.20 -0.78 1.56 -1.17 -4.59 117.12 115.03 3hcq n MET 94 Ca 0.06 -3.11 -0.09 0.00 -0.27 0.00 0.00 57.70 54.29 3hcq n MET 94 Cb 0.34 -2.19 0.02 0.00 2.15 0.00 0.00 33.22 33.54 3hcq n MET 94 CO 0.00 0.00 0.00 1.49 -0.73 0.00 0.00 175.97 176.73 3hcq h GLU 95 N 3.86 0.92 -0.00 2.12 4.57 -1.89 -3.01 114.58 121.16 3hcq h GLU 95 Ca 0.00 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 3hcq h GLU 95 Cb 1.87 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 30.36 3hcq h GLU 95 CO 0.44 0.89 0.00 0.00 -1.18 0.00 0.00 179.01 179.16 3hcq n ALA 96 N -2.43 2.68 -0.02 2.92 0.00 -1.26 -2.48 120.51 119.92 3hcq n ALA 96 Ca 0.02 -0.20 0.05 0.00 0.00 0.00 0.00 53.44 53.32 3hcq n ALA 96 Cb 0.27 -1.49 -0.12 0.00 0.00 0.00 0.00 19.45 18.11 3hcq n ALA 96 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hcq n ASP 97 N -0.94 1.34 -0.00 0.00 8.00 -1.14 -4.66 116.55 119.15 3hcq n ASP 97 Ca 0.23 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.76 3hcq n ASP 97 Cb 0.11 1.56 -0.04 0.00 -0.02 0.00 0.00 41.12 42.73 3hcq n ASP 97 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hcq n ILE 98 N -2.15 0.00 0.13 0.53 3.06 -1.19 -4.79 119.36 114.96 3hcq n ILE 98 Ca -0.07 -0.31 -0.13 0.00 -2.50 0.00 0.00 62.75 59.74 3hcq n ILE 98 Cb 0.53 0.93 -0.06 0.00 0.54 0.00 0.00 39.64 41.57 3hcq n ILE 98 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3hcq h ALA 99 N 1.03 -0.34 -0.24 1.51 0.00 -1.75 -2.64 119.26 116.83 3hcq h ALA 99 Ca 0.00 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 3hcq h ALA 99 Cb 0.20 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3hcq h ALA 99 CO 0.00 -0.72 -0.05 -1.35 0.00 0.00 0.00 179.25 177.13 3hcq h PRO 100 N -0.37 0.36 0.00 0.00 0.11 -1.88 -2.67 132.00 127.54 3hcq h PRO 100 Ca -0.00 -0.08 -0.06 0.00 0.11 0.00 0.00 66.00 65.97 3hcq h PRO 100 Cb 0.35 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 3hcq h PRO 100 CO -0.04 0.44 -0.30 1.88 -0.21 0.00 0.00 178.00 179.77 3hcq h TYR 101 N 0.35 0.00 0.00 0.65 0.05 -1.87 -2.92 116.97 113.22 3hcq h TYR 101 Ca 0.08 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 3hcq h TYR 101 Cb 0.32 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.06 3hcq h TYR 101 CO 0.01 0.30 -0.01 -0.09 -1.05 0.00 0.00 178.16 177.32 3hcq h ARG 102 N 0.00 0.00 0.18 4.88 2.43 -1.13 -2.47 114.38 118.27 3hcq h ARG 102 Ca -0.00 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 58.83 3hcq h ARG 102 Cb 1.04 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.60 3hcq h ARG 102 CO 0.04 0.01 -1.66 1.49 -1.51 0.00 0.00 179.97 178.34 3hcq h GLU 103 N 0.00 0.37 -0.49 0.20 4.81 -1.32 -3.34 114.58 114.81 3hcq h GLU 103 Ca -0.00 -0.64 0.00 0.00 -0.13 0.00 0.00 59.36 58.59 3hcq h GLU 103 Cb 0.87 0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.49 3hcq h GLU 103 CO 0.00 1.28 0.00 -0.40 -0.73 0.00 0.00 179.01 179.16 3hcq n ASP 104 N -3.57 2.83 -3.12 1.04 5.75 -1.23 -4.96 116.55 113.29 3hcq n ASP 104 Ca -0.21 -1.97 -0.14 0.00 -0.01 0.00 0.00 54.79 52.46 3hcq n ASP 104 Cb 1.07 -0.32 0.07 0.00 -1.03 0.00 0.00 41.12 40.90 3hcq n ASP 104 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3hcq n LYS 105 N 1.05 -2.39 -0.07 0.11 5.02 -1.25 -4.99 118.16 115.64 3hcq n LYS 105 Ca 0.18 0.80 -0.07 0.00 -2.02 0.00 0.00 58.31 57.20 3hcq n LYS 105 Cb 0.46 -5.51 -0.10 0.00 -0.02 0.00 0.00 35.03 29.86 3hcq n LYS 105 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3hcq n SER 106 N -3.08 2.01 -4.17 4.39 2.88 -0.93 -5.03 113.62 109.69 3hcq n SER 106 Ca -0.08 -0.02 -0.14 0.00 -1.33 0.00 0.00 58.87 57.30 3hcq n SER 106 Cb 0.61 0.62 -0.11 0.00 -0.75 0.00 0.00 64.21 64.59 3hcq n SER 106 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3hcq s VAL 107 N -2.31 0.91 0.05 2.46 -7.23 -1.23 -4.11 120.40 108.94 3hcq s VAL 107 Ca -0.09 -1.63 0.06 0.00 -1.81 0.00 0.00 61.98 58.51 3hcq s VAL 107 Cb 0.04 -1.35 -0.03 0.00 0.56 0.00 0.00 36.38 35.61 3hcq s VAL 107 CO 0.50 -0.57 -0.18 -1.61 -0.31 0.00 0.00 175.10 172.93 3hcq s GLU 108 N -2.80 1.14 -0.06 4.82 2.02 -1.10 -4.84 118.70 117.88 3hcq s GLU 108 Ca 0.05 -0.91 -0.02 0.00 0.02 0.00 0.00 54.97 54.12 3hcq s GLU 108 Cb -0.03 -1.24 -0.03 0.00 0.10 0.00 0.00 34.13 32.93 3hcq s GLU 108 CO -0.00 0.31 0.03 0.99 0.02 0.00 0.00 175.26 176.60 3hcq s THR 109 N -0.91 4.46 -0.09 3.63 2.01 -1.26 -2.32 115.64 121.16 3hcq s THR 109 Ca 0.05 -0.28 -0.12 0.00 0.31 0.00 0.00 61.69 61.65 3hcq s THR 109 Cb -0.09 -2.92 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 3hcq s THR 109 CO 0.02 0.54 -0.23 0.52 -0.69 0.00 0.00 174.62 174.78 3hcq n VAL 110 N 1.88 1.39 -3.49 3.82 0.31 -0.23 -5.01 118.33 116.99 3hcq n VAL 110 Ca -0.17 0.21 -0.11 0.00 -0.01 0.00 0.00 64.34 64.25 3hcq n VAL 110 Cb 0.53 -2.07 -0.03 0.00 -0.91 0.00 0.00 33.84 31.37 3hcq n VAL 110 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 3hcq s ARG 111 N -2.58 0.96 0.24 5.55 3.52 -1.26 -5.01 118.95 120.36 3hcq s ARG 111 Ca -0.19 -0.19 -0.23 0.00 -0.13 0.00 0.00 55.73 54.98 3hcq s ARG 111 Cb 0.03 0.44 -0.09 0.00 -1.56 0.00 0.00 34.95 33.78 3hcq s ARG 111 CO 0.28 -0.39 0.81 -2.00 -0.81 0.00 0.00 175.30 173.20 3hcq s GLU 112 N -2.69 4.46 0.00 5.12 2.12 -1.26 -2.26 118.70 124.18 3hcq s GLU 112 Ca 0.00 1.11 0.00 0.00 0.36 0.00 0.00 54.97 56.44 3hcq s GLU 112 Cb -0.01 -2.97 0.00 0.00 0.26 0.00 0.00 34.13 31.42 3hcq s GLU 112 CO -0.06 0.41 0.00 0.27 -0.54 0.00 0.00 175.26 175.34 3hcq n ASN 113 N 0.92 0.59 -3.79 -1.70 6.94 -0.97 -5.00 115.26 112.24 3hcq n ASN 113 Ca -0.02 -0.18 -0.13 0.00 -0.02 0.00 0.00 54.58 54.23 3hcq n ASN 113 Cb 0.50 0.48 -0.10 0.00 -2.36 0.00 0.00 39.78 38.30 3hcq n ASN 113 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3hcq s LEU 114 N -1.08 1.02 -0.02 -4.53 0.20 -1.26 -3.15 118.68 109.86 3hcq s LEU 114 Ca 0.00 0.26 -0.01 0.00 0.69 0.00 0.00 54.13 55.07 3hcq s LEU 114 Cb 0.00 1.01 0.01 0.00 -0.43 0.00 0.00 46.19 46.78 3hcq s LEU 114 CO 0.00 -0.27 0.04 0.00 -0.29 0.00 0.00 176.35 175.83 3hcq s ALA 115 N -0.63 -0.06 0.00 5.97 0.00 -1.26 -3.29 121.76 122.49 3hcq s ALA 115 Ca -0.07 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.06 3hcq s ALA 115 Cb -0.04 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.96 3hcq s ALA 115 CO 0.02 -0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.15 3hcq n GLY 116 N 3.37 0.73 3.26 0.00 0.00 -1.24 -4.94 105.19 106.36 3hcq n GLY 116 Ca -0.16 -0.69 -0.14 0.00 0.00 0.00 0.00 46.02 45.03 3hcq n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hcq s ALA 117 N -1.38 1.43 0.02 4.61 0.00 -1.25 -4.86 121.76 120.34 3hcq s ALA 117 Ca 0.00 -1.76 -0.05 0.00 0.00 0.00 0.00 51.96 50.16 3hcq s ALA 117 Cb 0.00 1.13 -0.01 0.00 0.00 0.00 0.00 23.12 24.24 3hcq s ALA 117 CO 0.00 -0.50 0.07 0.15 0.00 0.00 0.00 175.76 175.48 3hcq s LYS 118 N -4.07 0.50 -0.30 0.00 1.02 -1.23 -2.46 119.74 113.19 3hcq s LYS 118 Ca 0.36 -0.65 -0.09 0.00 0.02 0.00 0.00 55.97 55.61 3hcq s LYS 118 Cb 0.07 0.19 0.15 0.00 -0.52 0.00 0.00 37.83 37.73 3hcq s LYS 118 CO 0.12 -0.11 0.74 -0.47 -0.92 0.00 0.00 175.35 174.70 3hcq s TYR 119 N -2.08 -1.21 0.00 3.18 5.04 -1.15 -2.55 117.35 118.58 3hcq s TYR 119 Ca -0.10 1.82 0.00 0.00 -2.44 0.00 0.00 57.07 56.35 3hcq s TYR 119 Cb -0.04 0.62 0.00 0.00 0.35 0.00 0.00 41.96 42.89 3hcq s TYR 119 CO -0.02 -0.62 0.00 -2.37 -1.34 0.00 0.00 175.55 171.20 3hcq n THR 120 N 5.34 0.00 -3.34 4.34 5.66 -1.15 -4.73 114.28 120.41 3hcq n THR 120 Ca -0.08 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.64 3hcq n THR 120 Cb 0.51 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.26 3hcq n THR 120 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 3hcq s LEU 121 N 0.00 4.04 0.27 1.09 1.43 -1.26 -2.16 118.68 122.09 3hcq s LEU 121 Ca 0.00 0.64 -0.09 0.00 -1.03 0.00 0.00 54.13 53.65 3hcq s LEU 121 Cb 0.00 -3.47 -0.00 0.00 0.03 0.00 0.00 46.19 42.74 3hcq s LEU 121 CO 0.00 -0.22 0.45 0.00 0.23 0.00 0.00 176.35 176.81 3hcq s ALA 122 N -2.14 0.14 0.37 4.21 0.00 -1.04 -3.31 121.76 119.98 3hcq s ALA 122 Ca 0.43 -1.12 0.07 0.00 0.00 0.00 0.00 51.96 51.34 3hcq s ALA 122 Cb -0.10 1.11 -0.03 0.00 0.00 0.00 0.00 23.12 24.10 3hcq s ALA 122 CO 0.32 -0.82 0.25 -2.37 0.00 0.00 0.00 175.76 173.14 3hcq n THR 123 N -0.42 0.00 -4.13 0.00 5.66 -0.81 -3.11 114.28 111.47 3hcq n THR 123 Ca -0.01 -2.49 -0.28 0.00 -3.05 0.00 0.00 64.05 58.22 3hcq n THR 123 Cb 0.62 1.14 -0.02 0.00 -1.55 0.00 0.00 70.33 70.52 3hcq n THR 123 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3hcq s ASN 124 N -3.45 4.49 0.27 1.09 4.22 -1.26 -2.96 114.94 117.35 3hcq s ASN 124 Ca 0.35 -1.39 -0.02 0.00 -2.14 0.00 0.00 52.86 49.66 3hcq s ASN 124 Cb 0.02 0.53 0.41 0.00 1.28 0.00 0.00 41.25 43.49 3hcq s ASN 124 CO 0.25 -1.08 1.90 0.00 -2.04 0.00 0.00 177.10 176.12 3hcq h ALA 125 N 0.87 1.41 0.00 3.54 0.00 -1.98 -1.33 119.26 121.76 3hcq h ALA 125 Ca -0.38 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.41 3hcq h ALA 125 Cb 1.31 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3hcq h ALA 125 CO 0.61 0.47 -0.42 0.87 0.00 0.00 0.00 179.25 180.78 3hcq h LYS 126 N 1.18 0.00 -0.04 0.00 1.79 -1.97 -2.92 116.57 114.60 3hcq h LYS 126 Ca 0.41 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.77 3hcq h LYS 126 Cb 0.12 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 3hcq h LYS 126 CO -0.15 0.42 -0.49 0.78 -1.08 0.00 0.00 179.45 178.93 3hcq h GLY 127 N 1.41 0.12 1.63 3.86 0.00 -1.62 -3.14 103.07 105.32 3hcq h GLY 127 Ca -0.00 -0.12 -0.19 0.00 0.00 0.00 0.00 47.33 47.02 3hcq h GLY 127 CO 0.05 0.11 -0.75 0.00 0.00 0.00 0.00 176.54 175.95 3hcq h ALA 128 N 1.42 0.59 -0.07 3.60 0.00 -1.28 -1.85 119.26 121.67 3hcq h ALA 128 Ca 0.00 -0.62 -0.12 0.00 0.00 0.00 0.00 54.91 54.17 3hcq h ALA 128 Cb 0.90 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3hcq h ALA 128 CO 0.07 0.78 -0.50 0.93 0.00 0.00 0.00 179.25 180.53 3hcq h GLU 129 N 0.24 0.18 0.18 0.00 5.08 -1.49 -3.29 114.58 115.48 3hcq h GLU 129 Ca -0.03 -0.10 -0.29 0.00 -1.00 0.00 0.00 59.36 57.93 3hcq h GLU 129 Cb 1.33 0.01 0.02 0.00 0.50 0.00 0.00 28.75 30.61 3hcq h GLU 129 CO 0.13 0.64 -1.38 -0.07 -1.00 0.00 0.00 179.01 177.33 3hcq h LEU 130 N 0.14 0.61 0.00 1.33 4.07 -1.62 -3.49 115.31 116.35 3hcq h LEU 130 Ca 0.00 -0.92 0.00 0.00 0.08 0.00 0.00 57.88 57.05 3hcq h LEU 130 Cb 0.94 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.48 3hcq h LEU 130 CO 0.07 1.64 0.00 0.61 -1.08 0.00 0.00 178.44 179.68 3hcq n GLY 131 N 1.75 0.31 3.40 0.83 0.00 -1.17 -5.09 105.19 105.22 3hcq n GLY 131 Ca -0.20 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.37 3hcq n GLY 131 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hcq s ILE 132 N -0.55 5.07 -0.23 -0.61 -1.09 -0.70 -4.84 121.20 118.24 3hcq s ILE 132 Ca 0.00 -1.85 -0.11 0.00 -2.23 0.00 0.00 60.65 56.46 3hcq s ILE 132 Cb 0.00 -4.63 -0.10 0.00 -1.58 0.00 0.00 42.46 36.15 3hcq s ILE 132 CO 0.00 -1.29 -0.30 0.29 -1.23 0.00 0.00 174.94 172.41 3hcq n LYS 133 N 5.56 0.49 -3.39 2.79 4.76 -1.26 -4.68 118.16 122.43 3hcq n LYS 133 Ca 0.16 0.22 -0.18 0.00 -2.87 0.00 0.00 58.31 55.64 3hcq n LYS 133 Cb 0.48 -1.33 -0.03 0.00 -1.84 0.00 0.00 35.03 32.31 3hcq n LYS 133 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3hcq n ASP 134 N -4.03 2.63 0.19 4.39 2.03 -1.26 -4.07 116.55 116.44 3hcq n ASP 134 Ca -0.46 -2.25 0.05 0.00 0.52 0.00 0.00 54.79 52.65 3hcq n ASP 134 Cb 0.83 0.15 0.38 0.00 -0.72 0.00 0.00 41.12 41.76 3hcq n ASP 134 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 3hcq h PHE 135 N 1.02 0.00 -0.47 -0.67 3.57 -1.61 -3.23 116.94 115.55 3hcq h PHE 135 Ca -0.24 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.26 3hcq h PHE 135 Cb 0.74 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.48 3hcq h PHE 135 CO 0.00 0.36 0.00 1.63 -2.23 0.00 0.00 178.31 178.07 3hcq n LYS 136 N -3.71 3.69 -0.04 1.11 5.02 -1.26 -4.15 118.16 118.81 3hcq n LYS 136 Ca -0.01 -2.36 0.03 0.00 -2.02 0.00 0.00 58.31 53.95 3hcq n LYS 136 Cb 0.45 -1.97 -0.15 0.00 -0.02 0.00 0.00 35.03 33.34 3hcq n LYS 136 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3hcq n ASP 137 N 0.62 0.36 -0.27 4.39 8.00 -1.22 -4.68 116.55 123.75 3hcq n ASP 137 Ca 0.21 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.73 3hcq n ASP 137 Cb 0.89 1.58 0.14 0.00 -0.02 0.00 0.00 41.12 43.71 3hcq n ASP 137 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3hcq h ILE 138 N 0.00 0.90 0.00 0.53 2.04 -1.80 -3.00 117.51 116.18 3hcq h ILE 138 Ca -0.18 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 3hcq h ILE 138 Cb 1.37 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 3hcq h ILE 138 CO 0.01 0.13 -0.02 0.00 0.00 0.00 0.00 178.15 178.26 3hcq h ALA 139 N 1.43 1.31 -0.50 1.87 0.00 -1.84 -2.55 119.26 118.98 3hcq h ALA 139 Ca 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3hcq h ALA 139 Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3hcq h ALA 139 CO -0.24 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.04 3hcq n ALA 140 N -2.24 2.93 -2.34 0.00 0.00 -1.13 -4.03 120.51 113.70 3hcq n ALA 140 Ca -0.03 -1.19 0.04 0.00 0.00 0.00 0.00 53.44 52.26 3hcq n ALA 140 Cb 0.12 -1.02 0.06 0.00 0.00 0.00 0.00 19.45 18.60 3hcq n ALA 140 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3hcq n HIS 141 N 0.83 0.05 -0.30 0.00 8.25 -0.96 -4.91 115.22 118.18 3hcq n HIS 141 Ca 0.20 -0.74 -0.05 0.00 -0.26 0.00 0.00 57.72 56.87 3hcq n HIS 141 Cb 0.70 -0.17 0.07 0.00 1.12 0.00 0.00 29.99 31.71 3hcq n HIS 141 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3hcq h LYS 142 N 1.05 1.15 -0.60 -0.41 3.64 -1.70 -2.98 116.57 116.73 3hcq h LYS 142 Ca -0.18 -0.14 0.03 0.00 -1.27 0.00 0.00 60.65 59.09 3hcq h LYS 142 Cb 1.72 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 33.27 3hcq h LYS 142 CO 0.09 0.85 0.36 -0.44 -2.27 0.00 0.00 179.45 178.05 3hcq h ASP 143 N 1.15 0.58 1.26 4.20 5.19 -1.93 -1.89 116.42 124.98 3hcq h ASP 143 Ca 0.29 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.71 3hcq h ASP 143 Cb 0.04 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.43 3hcq h ASP 143 CO -0.05 0.40 -0.12 -0.62 -3.12 0.00 0.00 179.24 175.74 3hcq n GLU 144 N -4.75 0.21 0.00 3.56 1.02 -1.19 -3.46 120.64 116.03 3hcq n GLU 144 Ca 0.06 0.15 0.10 0.00 -0.02 0.00 0.00 57.16 57.45 3hcq n GLU 144 Cb 0.09 -1.72 -0.06 0.00 -0.02 0.00 0.00 31.44 29.74 3hcq n GLU 144 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 3hcq n LEU 145 N -2.07 1.52 0.00 -4.62 0.00 -0.93 -4.86 117.00 106.03 3hcq n LEU 145 Ca 0.05 -0.64 0.00 0.00 0.00 0.00 0.00 56.01 55.42 3hcq n LEU 145 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.83 3hcq n LEU 145 CO 0.31 0.31 0.00 0.47 0.00 0.00 0.00 177.39 178.48 3hcq n ASP 146 N -0.70 -3.60 -2.60 1.96 8.00 -0.76 -3.13 116.55 115.73 3hcq n ASP 146 Ca 0.07 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.46 3hcq n ASP 146 Cb 0.39 -2.64 0.06 0.00 -0.02 0.00 0.00 41.12 38.91 3hcq n ASP 146 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hcq n GLY 147 N -0.50 -0.17 2.88 0.44 0.00 -1.19 -5.00 105.19 101.63 3hcq n GLY 147 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 3hcq n GLY 147 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hcq s LYS 148 N -4.65 0.01 -0.02 1.61 1.02 -1.18 -2.88 119.74 113.64 3hcq s LYS 148 Ca 0.07 0.02 0.03 0.00 0.02 0.00 0.00 55.97 56.12 3hcq s LYS 148 Cb -0.01 -0.01 -0.00 0.00 -0.52 0.00 0.00 37.83 37.29 3hcq s LYS 148 CO 0.48 -0.01 -0.10 0.42 -0.92 0.00 0.00 175.35 175.21 3hcq s ILE 149 N 0.06 0.87 -0.17 2.17 1.09 -1.10 -4.84 121.20 119.29 3hcq s ILE 149 Ca -0.00 -0.43 -0.06 0.00 -1.10 0.00 0.00 60.65 59.05 3hcq s ILE 149 Cb -0.01 -0.76 -0.04 0.00 -1.06 0.00 0.00 42.46 40.60 3hcq s ILE 149 CO -0.00 0.26 0.03 -0.31 -0.10 0.00 0.00 174.94 174.82 3hcq s TYR 150 N 0.03 3.19 0.00 3.97 2.02 -1.23 -2.16 117.35 123.17 3hcq s TYR 150 Ca -0.01 -0.02 0.00 0.00 -0.37 0.00 0.00 57.07 56.68 3hcq s TYR 150 Cb -0.07 -2.03 0.00 0.00 -0.40 0.00 0.00 41.96 39.46 3hcq s TYR 150 CO 0.00 0.13 0.00 0.41 -1.57 0.00 0.00 175.55 174.52 3hcq n GLY 151 N 3.44 5.12 0.00 0.71 0.00 -1.01 -4.13 105.19 109.32 3hcq n GLY 151 Ca -0.17 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.15 3hcq n GLY 151 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3hcq n ILE 152 N 0.00 0.00 -1.91 -0.61 -5.35 -1.26 -4.29 119.36 105.94 3hcq n ILE 152 Ca 0.00 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 62.15 3hcq n ILE 152 Cb 0.00 0.00 0.03 0.00 -1.74 0.00 0.00 39.64 37.93 3hcq n ILE 152 CO 0.00 0.00 0.00 -1.83 -1.76 0.00 0.00 176.55 172.96 3hcq s GLU 153 N 1.90 3.06 0.32 6.28 1.03 -1.21 -2.99 118.70 127.10 3hcq s GLU 153 Ca 0.00 1.32 -0.29 0.00 0.03 0.00 0.00 54.97 56.03 3hcq s GLU 153 Cb 0.00 -1.99 -0.11 0.00 -0.80 0.00 0.00 34.13 31.23 3hcq s GLU 153 CO 0.00 -1.03 1.54 -2.14 -1.33 0.00 0.00 175.26 172.29 3hcq s PRO 154 N -4.04 4.13 -0.11 -4.83 0.02 -1.26 -3.68 135.00 125.23 3hcq s PRO 154 Ca 0.66 2.55 -0.00 0.00 0.02 0.00 0.00 61.00 64.23 3hcq s PRO 154 Cb -0.19 -3.01 -0.00 0.00 0.02 0.00 0.00 34.50 31.32 3hcq s PRO 154 CO 0.39 -0.57 0.09 0.41 -0.33 0.00 0.00 177.00 176.99 3hcq n GLY 155 N 1.48 0.50 3.25 0.52 0.00 -1.26 -4.90 105.19 104.78 3hcq n GLY 155 Ca 0.05 -0.34 -0.26 0.00 0.00 0.00 0.00 46.02 45.47 3hcq n GLY 155 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hcq s ASN 156 N -3.09 2.45 0.51 1.61 3.84 -1.24 -4.38 114.94 114.64 3hcq s ASN 156 Ca 0.02 -0.51 0.33 0.00 0.21 0.00 0.00 52.86 52.91 3hcq s ASN 156 Cb -0.00 -0.21 1.42 0.00 -0.55 0.00 0.00 41.25 41.91 3hcq s ASN 156 CO 0.07 0.17 1.98 -2.24 -2.79 0.00 0.00 177.10 174.28 3hcq h ASP 157 N 4.95 0.00 -0.00 -4.21 2.03 -1.93 -2.82 116.42 114.43 3hcq h ASP 157 Ca -0.42 0.00 -0.13 0.00 -0.73 0.00 0.00 57.03 55.75 3hcq h ASP 157 Cb 1.16 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.67 3hcq h ASP 157 CO 0.44 0.00 -0.50 1.23 -1.03 0.00 0.00 179.24 179.38 3hcq h GLY 158 N 1.82 0.38 1.04 7.15 0.00 -1.96 -3.33 103.07 108.18 3hcq h GLY 158 Ca 0.00 -0.67 -0.12 0.00 0.00 0.00 0.00 47.33 46.55 3hcq h GLY 158 CO 0.00 0.59 -0.20 3.43 0.00 0.00 0.00 176.54 180.36 3hcq h ASN 159 N -0.22 0.90 -0.75 0.19 -0.26 -1.90 -3.29 115.58 110.24 3hcq h ASN 159 Ca -0.06 -0.40 0.12 0.00 -0.56 0.00 0.00 56.30 55.40 3hcq h ASN 159 Cb 1.23 -0.25 -0.08 0.00 -1.06 0.00 0.00 38.32 38.15 3hcq h ASN 159 CO 0.10 1.10 0.35 -0.09 -1.06 0.00 0.00 177.43 177.83 3hcq h ARG 160 N 0.70 0.54 0.00 0.81 2.43 -1.64 -1.91 114.38 115.30 3hcq h ARG 160 Ca 0.09 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3hcq h ARG 160 Cb 0.76 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 3hcq h ARG 160 CO 0.06 0.36 0.00 -0.07 -1.51 0.00 0.00 179.97 178.81 3hcq h LEU 161 N 0.55 0.00 0.03 3.80 3.38 -1.67 -2.67 115.31 118.74 3hcq h LEU 161 Ca 0.39 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.19 3hcq h LEU 161 Cb 0.51 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3hcq h LEU 161 CO -0.33 0.00 -0.90 0.40 0.09 0.00 0.00 178.44 177.70 3hcq h ILE 162 N 0.00 1.22 -0.25 1.22 2.04 -1.49 -3.34 117.51 116.92 3hcq h ILE 162 Ca 0.00 -2.29 0.07 0.00 1.00 0.00 0.00 64.86 63.64 3hcq h ILE 162 Cb 0.57 2.72 -0.01 0.00 -0.74 0.00 0.00 36.82 39.36 3hcq h ILE 162 CO 0.00 0.50 0.20 0.40 0.00 0.00 0.00 178.15 179.25 3hcq h ILE 163 N -0.83 0.76 -0.66 -0.67 2.04 -1.35 -0.64 117.51 116.16 3hcq h ILE 163 Ca -0.23 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.55 3hcq h ILE 163 Cb 1.32 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 3hcq h ILE 163 CO -0.08 0.00 0.10 -0.78 0.00 0.00 0.00 178.15 177.40 3hcq h ASP 164 N 0.00 1.05 0.52 1.72 1.82 -1.62 -3.31 116.42 116.59 3hcq h ASP 164 Ca 0.12 -0.25 -0.03 0.00 -0.39 0.00 0.00 57.03 56.48 3hcq h ASP 164 Cb 0.51 -0.28 0.01 0.00 0.68 0.00 0.00 39.33 40.25 3hcq h ASP 164 CO -0.00 1.04 -0.25 0.24 -1.61 0.00 0.00 179.24 178.66 3hcq h MET 165 N 1.02 -0.67 0.00 0.28 2.86 -1.23 -3.00 114.93 114.19 3hcq h MET 165 Ca 0.20 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 3hcq h MET 165 Cb 0.44 0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.25 3hcq h MET 165 CO 0.01 -0.38 0.00 -0.39 1.06 0.00 0.00 176.91 177.21 3hcq h VAL 166 N -0.87 0.00 0.00 -2.22 -1.51 -1.69 -1.04 116.25 108.91 3hcq h VAL 166 Ca -0.07 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 65.31 3hcq h VAL 166 Cb 0.60 0.84 0.00 0.00 -2.13 0.00 0.00 31.29 30.60 3hcq h VAL 166 CO 0.12 0.00 -0.73 -0.08 -1.23 0.00 0.00 177.57 175.65 3hcq h GLU 167 N 0.00 0.00 0.00 5.19 4.81 -1.62 -3.37 114.58 119.59 3hcq h GLU 167 Ca 0.00 0.00 -0.38 0.00 -0.13 0.00 0.00 59.36 58.85 3hcq h GLU 167 Cb 0.11 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.42 3hcq h GLU 167 CO 0.00 0.00 -2.43 1.17 -0.73 0.00 0.00 179.01 177.02 3hcq n LYS 168 N -2.63 0.67 0.00 1.92 3.00 -0.49 -5.04 118.16 115.59 3hcq n LYS 168 Ca 0.01 0.10 0.00 0.00 -0.00 0.00 0.00 58.31 58.42 3hcq n LYS 168 Cb 0.52 -1.51 0.00 0.00 0.00 0.00 0.00 35.03 34.04 3hcq n LYS 168 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3hcq n GLY 169 N 2.11 0.97 3.68 3.14 0.00 -0.64 -5.09 105.19 109.37 3hcq n GLY 169 Ca -0.41 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.21 3hcq n GLY 169 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hcq s THR 170 N -1.94 5.06 -1.61 2.61 2.01 -1.21 -3.88 115.64 116.68 3hcq s THR 170 Ca 0.00 1.19 0.00 0.00 0.31 0.00 0.00 61.69 63.19 3hcq s THR 170 Cb 0.00 -3.94 0.00 0.00 0.01 0.00 0.00 72.50 68.57 3hcq s THR 170 CO 0.00 0.19 0.00 0.49 -0.69 0.00 0.00 174.62 174.61 3hcq n PHE 171 N 4.49 -0.77 -2.69 4.92 3.72 -1.26 -3.01 117.46 122.85 3hcq n PHE 171 Ca -0.03 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.16 3hcq n PHE 171 Cb 0.50 -3.56 0.01 0.00 -0.94 0.00 0.00 39.48 35.50 3hcq n PHE 171 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3hcq n ASP 172 N -1.44 -6.00 -0.51 4.37 9.92 -1.25 -4.71 116.55 116.93 3hcq n ASP 172 Ca -0.21 -0.14 0.00 0.00 -0.53 0.00 0.00 54.79 53.91 3hcq n ASP 172 Cb 0.66 -4.93 0.02 0.00 -0.64 0.00 0.00 41.12 36.24 3hcq n ASP 172 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3hcq n LEU 173 N -3.49 1.13 -4.62 0.64 4.32 -1.17 -4.87 117.00 108.94 3hcq n LEU 173 Ca -0.18 -0.57 -0.43 0.00 -0.02 0.00 0.00 56.01 54.81 3hcq n LEU 173 Cb 0.66 -0.44 -0.02 0.00 -1.62 0.00 0.00 43.42 42.00 3hcq n LEU 173 CO 0.37 0.24 1.21 -0.75 -1.22 0.00 0.00 177.39 177.24 3hcq s LYS 174 N -1.24 3.76 0.00 3.23 2.20 -1.26 -3.48 119.74 122.95 3hcq s LYS 174 Ca 0.03 1.17 0.00 0.00 -0.36 0.00 0.00 55.97 56.82 3hcq s LYS 174 Cb 0.02 -3.96 0.00 0.00 -1.51 0.00 0.00 37.83 32.38 3hcq s LYS 174 CO 0.01 -1.33 0.00 0.41 -0.36 0.00 0.00 175.35 174.08 3hcq n GLY 175 N 4.67 1.37 3.96 5.54 0.00 -1.26 -5.14 105.19 114.33 3hcq n GLY 175 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 3hcq n GLY 175 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hcq s PHE 176 N -1.90 2.97 0.09 1.61 0.40 -1.23 -5.00 117.98 114.93 3hcq s PHE 176 Ca 0.00 0.08 0.08 0.00 -0.60 0.00 0.00 56.93 56.49 3hcq s PHE 176 Cb 0.00 -2.65 -0.03 0.00 0.51 0.00 0.00 43.02 40.85 3hcq s PHE 176 CO 0.00 -0.75 -0.21 -2.00 0.70 0.00 0.00 175.22 172.97 3hcq s GLU 177 N -4.72 1.14 -0.24 0.44 2.12 -1.14 -5.05 118.70 111.25 3hcq s GLU 177 Ca 0.55 -1.12 -0.00 0.00 0.36 0.00 0.00 54.97 54.75 3hcq s GLU 177 Cb -0.10 -1.37 0.03 0.00 0.26 0.00 0.00 34.13 32.94 3hcq s GLU 177 CO 0.39 0.32 -0.10 0.08 -0.54 0.00 0.00 175.26 175.41 3hcq s VAL 178 N -1.12 2.59 -0.25 3.70 1.01 -1.26 -2.70 120.40 122.38 3hcq s VAL 178 Ca 0.06 -1.11 -0.13 0.00 0.00 0.00 0.00 61.98 60.80 3hcq s VAL 178 Cb -0.10 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 3hcq s VAL 178 CO 0.04 0.23 0.29 -0.69 0.00 0.00 0.00 175.10 174.97 3hcq s VAL 179 N 1.28 5.25 -0.10 2.92 1.01 -0.92 -5.02 120.40 124.83 3hcq s VAL 179 Ca -0.00 0.43 -0.03 0.00 0.00 0.00 0.00 61.98 62.38 3hcq s VAL 179 Cb -0.16 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 3hcq s VAL 179 CO -0.06 0.24 0.04 -1.61 0.00 0.00 0.00 175.10 173.71 3hcq s GLU 180 N 1.57 3.15 0.00 2.72 2.02 -1.26 -2.41 118.70 124.49 3hcq s GLU 180 Ca 0.13 -0.34 0.00 0.00 0.02 0.00 0.00 54.97 54.77 3hcq s GLU 180 Cb -0.15 -2.91 0.00 0.00 0.10 0.00 0.00 34.13 31.17 3hcq s GLU 180 CO 0.08 0.69 0.00 0.45 0.02 0.00 0.00 175.26 176.50 3hcq n SER 181 N 2.21 0.00 -2.74 -0.19 2.88 -1.16 -5.01 113.62 109.61 3hcq n SER 181 Ca -0.19 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.25 3hcq n SER 181 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 3hcq n SER 181 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3hcq n SER 182 N 0.00 -1.73 0.23 -3.46 2.88 -1.26 -3.28 113.62 107.00 3hcq n SER 182 Ca 0.00 -2.60 -0.15 0.00 -1.33 0.00 0.00 58.87 54.79 3hcq n SER 182 Cb 0.00 3.00 -0.08 0.00 -0.75 0.00 0.00 64.21 66.37 3hcq n SER 182 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 3hcq h GLU 183 N 0.00 -0.52 0.00 -1.46 4.81 -1.95 0.25 114.58 115.71 3hcq h GLU 183 Ca -0.28 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 3hcq h GLU 183 Cb 1.12 0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.62 3hcq h GLU 183 CO 0.37 -0.30 0.00 0.00 -0.73 0.00 0.00 179.01 178.35 3hcq n GLN 184 N -5.29 0.58 0.13 1.92 10.64 -1.26 -2.99 117.38 121.11 3hcq n GLN 184 Ca -0.11 0.01 -0.22 0.00 -1.83 0.00 0.00 57.00 54.85 3hcq n GLN 184 Cb 0.25 -1.50 -0.15 0.00 -0.86 0.00 0.00 30.24 27.98 3hcq n GLN 184 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.06 176.01 3hcq h GLY 185 N 4.81 0.53 0.97 2.61 0.00 -1.79 -3.28 103.07 106.91 3hcq h GLY 185 Ca 0.00 -1.35 -0.11 0.00 0.00 0.00 0.00 47.33 45.87 3hcq h GLY 185 CO 0.00 1.18 -0.26 1.98 0.00 0.00 0.00 176.54 179.44 3hcq h MET 186 N 0.13 0.70 -0.07 4.80 1.85 -0.86 -3.29 114.93 118.18 3hcq h MET 186 Ca -0.23 -0.36 -0.05 0.00 -0.61 0.00 0.00 59.70 58.45 3hcq h MET 186 Cb 2.12 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 34.14 3hcq h MET 186 CO 0.25 0.97 -0.18 -0.07 -0.40 0.00 0.00 176.91 177.48 3hcq h LEU 187 N 0.45 0.11 -1.14 3.39 3.38 -1.69 -3.01 115.31 116.81 3hcq h LEU 187 Ca 0.05 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 3hcq h LEU 187 Cb 0.83 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 3hcq h LEU 187 CO 0.07 0.31 -0.17 0.00 0.09 0.00 0.00 178.44 178.73 3hcq h ALA 188 N 1.71 1.28 -0.08 1.53 0.00 -1.62 -2.87 119.26 119.21 3hcq h ALA 188 Ca 0.02 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 3hcq h ALA 188 Cb 0.39 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3hcq h ALA 188 CO 0.03 0.48 -0.63 1.96 0.00 0.00 0.00 179.25 181.08 3hcq h GLN 189 N 0.36 0.31 -0.39 0.00 1.08 -1.66 -3.21 115.11 111.60 3hcq h GLN 189 Ca 0.06 -0.23 -0.07 0.00 -1.45 0.00 0.00 58.65 56.97 3hcq h GLN 189 Cb 0.52 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.97 3hcq h GLN 189 CO 0.03 0.84 -0.03 0.28 -0.95 0.00 0.00 178.83 179.01 3hcq h VAL 190 N 0.23 1.23 -0.00 -0.54 2.07 -1.55 -2.70 116.25 114.98 3hcq h VAL 190 Ca -0.01 -0.94 -0.11 0.00 0.82 0.00 0.00 66.70 66.45 3hcq h VAL 190 Cb 1.16 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 3hcq h VAL 190 CO 0.10 0.32 -0.55 0.00 0.02 0.00 0.00 177.57 177.47 3hcq h ALA 191 N 1.37 1.10 0.00 1.67 0.00 -1.55 -3.06 119.26 118.78 3hcq h ALA 191 Ca 0.12 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3hcq h ALA 191 Cb 0.42 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3hcq h ALA 191 CO 0.02 0.68 0.00 0.00 0.00 0.00 0.00 179.25 179.95 3hcq h ARG 192 N 0.00 0.00 0.00 0.00 3.08 -1.48 -3.11 114.38 112.87 3hcq h ARG 192 Ca -0.01 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 3hcq h ARG 192 Cb 0.97 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 3hcq h ARG 192 CO 0.07 0.00 -0.96 0.00 -1.07 0.00 0.00 179.97 178.01 3hcq h ALA 193 N 2.04 0.62 0.00 0.04 0.00 -1.44 -3.35 119.26 117.17 3hcq h ALA 193 Ca 0.00 -0.71 -0.15 0.00 0.00 0.00 0.00 54.91 54.05 3hcq h ALA 193 Cb 0.66 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3hcq h ALA 193 CO 0.00 0.87 -0.72 0.93 0.00 0.00 0.00 179.25 180.33 3hcq h GLU 194 N 0.00 0.00 -0.75 0.00 4.39 -1.57 0.11 114.58 116.76 3hcq h GLU 194 Ca -0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.62 3hcq h GLU 194 Cb 1.54 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.19 3hcq h GLU 194 CO 0.07 0.72 0.00 1.17 -1.16 0.00 0.00 179.01 179.80 3hcq n LYS 195 N -3.55 3.28 0.11 2.33 4.81 -1.24 -4.40 118.16 119.50 3hcq n LYS 195 Ca -0.00 -1.85 0.00 0.00 -0.87 0.00 0.00 58.31 55.59 3hcq n LYS 195 Cb 0.73 -1.94 0.00 0.00 0.02 0.00 0.00 35.03 33.84 3hcq n LYS 195 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3hcq n SER 196 N 0.37 -0.69 0.00 3.14 2.88 -1.17 -5.11 113.62 113.04 3hcq n SER 196 Ca 0.16 0.39 0.00 0.00 -1.33 0.00 0.00 58.87 58.09 3hcq n SER 196 Cb 0.80 0.81 0.00 0.00 -0.75 0.00 0.00 64.21 65.07 3hcq n SER 196 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hcq n GLY 197 N 0.89 0.71 3.03 0.46 0.00 0.38 -5.12 105.19 105.54 3hcq n GLY 197 Ca 0.00 -0.81 -0.23 0.00 0.00 0.00 0.00 46.02 44.98 3hcq n GLY 197 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hcq s ASP 198 N -1.27 1.55 0.43 1.61 1.01 -1.18 -5.09 116.67 113.73 3hcq s ASP 198 Ca 0.00 -0.25 -0.25 0.00 0.71 0.00 0.00 52.55 52.77 3hcq s ASP 198 Cb 0.00 -0.54 -0.08 0.00 1.01 0.00 0.00 42.92 43.31 3hcq s ASP 198 CO 0.00 0.07 1.21 -2.16 0.21 0.00 0.00 175.17 174.50 3hcq s PRO 199 N 0.35 3.89 0.19 8.23 0.04 -1.26 -4.86 135.00 141.58 3hcq s PRO 199 Ca -0.07 1.93 -0.05 0.00 0.04 0.00 0.00 61.00 62.85 3hcq s PRO 199 Cb -0.12 -2.59 -0.03 0.00 0.04 0.00 0.00 34.50 31.80 3hcq s PRO 199 CO 0.02 -0.49 0.21 -1.50 0.04 0.00 0.00 177.00 175.28 3hcq s ILE 200 N -1.40 0.03 -0.08 0.56 2.07 -1.26 -4.90 121.20 116.22 3hcq s ILE 200 Ca 0.60 -1.77 -0.06 0.00 -1.41 0.00 0.00 60.65 58.00 3hcq s ILE 200 Cb -0.33 -2.26 0.02 0.00 0.13 0.00 0.00 42.46 40.02 3hcq s ILE 200 CO 0.41 -0.12 0.19 0.54 -1.91 0.00 0.00 174.94 174.05 3hcq s VAL 201 N -4.08 -0.01 0.22 4.00 0.11 -1.26 -4.22 120.40 115.15 3hcq s VAL 201 Ca 0.30 0.03 -0.08 0.00 -2.93 0.00 0.00 61.98 59.30 3hcq s VAL 201 Cb 0.05 -0.28 0.03 0.00 -1.53 0.00 0.00 36.38 34.65 3hcq s VAL 201 CO 0.08 0.01 0.43 2.22 -3.33 0.00 0.00 175.10 174.51 3hcq n PHE 202 N 3.20 -1.72 -4.01 1.54 -1.74 -1.18 -3.57 117.46 109.99 3hcq n PHE 202 Ca -0.15 -1.04 -0.35 0.00 -0.56 0.00 0.00 57.45 55.35 3hcq n PHE 202 Cb 0.58 0.50 -0.09 0.00 1.52 0.00 0.00 39.48 41.99 3hcq n PHE 202 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 3hcq s LEU 203 N 0.00 3.96 0.10 5.98 1.43 -1.26 -2.50 118.68 126.39 3hcq s LEU 203 Ca 0.09 0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.42 3hcq s LEU 203 Cb -0.03 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 3hcq s LEU 203 CO 0.07 0.27 -0.07 -0.83 0.23 0.00 0.00 176.35 176.02 3hcq s GLY 204 N -0.23 0.79 0.24 -3.19 0.00 -0.92 -4.97 107.32 99.04 3hcq s GLY 204 Ca 0.09 -1.32 -0.14 0.00 0.00 0.00 0.00 44.72 43.34 3hcq s GLY 204 CO 0.01 -1.43 0.51 0.66 0.00 0.00 0.00 173.10 172.86 3hcq s TRP 205 N -3.40 0.22 -0.01 1.90 -2.14 -1.26 -2.91 118.94 111.34 3hcq s TRP 205 Ca 0.11 -0.60 0.03 0.00 2.66 0.00 0.00 56.10 58.30 3hcq s TRP 205 Cb 0.04 0.28 -0.01 0.00 -3.10 0.00 0.00 33.47 30.68 3hcq s TRP 205 CO -0.04 -1.01 -0.09 -1.21 -2.66 0.00 0.00 176.95 171.94 3hcq s GLU 206 N -3.98 0.79 0.25 3.25 0.41 -1.06 -4.26 118.70 114.10 3hcq s GLU 206 Ca 0.19 -0.33 -0.13 0.00 -0.41 0.00 0.00 54.97 54.28 3hcq s GLU 206 Cb -0.01 -0.76 -0.08 0.00 -1.78 0.00 0.00 34.13 31.50 3hcq s GLU 206 CO 0.07 0.19 0.63 -1.25 -0.49 0.00 0.00 175.26 174.41 3hcq s PRO 207 N -0.18 3.95 -0.26 0.39 0.04 -1.26 -3.56 135.00 134.12 3hcq s PRO 207 Ca 0.03 0.51 -0.26 0.00 0.04 0.00 0.00 61.00 61.32 3hcq s PRO 207 Cb -0.04 -2.65 0.10 0.00 0.04 0.00 0.00 34.50 31.96 3hcq s PRO 207 CO -0.00 0.30 0.92 -1.58 0.04 0.00 0.00 177.00 176.68 3hcq s HIS 208 N -1.78 -0.57 -1.82 0.56 2.46 -1.26 -5.02 115.29 107.86 3hcq s HIS 208 Ca 0.48 1.36 0.00 0.00 0.47 0.00 0.00 55.06 57.36 3hcq s HIS 208 Cb -0.12 0.34 0.00 0.00 -0.13 0.00 0.00 32.58 32.67 3hcq s HIS 208 CO 0.19 -0.30 0.06 -2.30 -2.47 0.00 0.00 174.74 169.93 3hcq n PRO 209 N 2.22 0.07 -0.05 2.88 -0.02 -1.26 -3.15 135.00 135.68 3hcq n PRO 209 Ca -0.13 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.26 3hcq n PRO 209 Cb 0.56 -1.01 0.08 0.00 -0.02 0.00 0.00 33.50 33.11 3hcq n PRO 209 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 3hcq h MET 210 N 0.17 0.68 0.00 -0.52 4.05 -1.95 -3.25 114.93 114.11 3hcq h MET 210 Ca 0.00 -0.34 0.00 0.00 -0.28 0.00 0.00 59.70 59.08 3hcq h MET 210 Cb 0.01 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.81 3hcq h MET 210 CO 0.00 0.94 0.00 0.09 0.23 0.00 0.00 176.91 178.17 3hcq n ASN 211 N -4.05 0.29 -0.03 1.39 3.02 -1.19 -3.11 115.26 111.58 3hcq n ASN 211 Ca -0.01 0.54 0.02 0.00 -0.03 0.00 0.00 54.58 55.09 3hcq n ASN 211 Cb 0.51 -0.61 -0.15 0.00 -0.61 0.00 0.00 39.78 38.91 3hcq n ASN 211 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hcq n ALA 212 N -1.61 2.19 0.06 5.41 0.00 -1.23 -4.47 120.51 120.86 3hcq n ALA 212 Ca 0.05 -0.82 0.07 0.00 0.00 0.00 0.00 53.44 52.74 3hcq n ALA 212 Cb 0.31 -0.57 -0.06 0.00 0.00 0.00 0.00 19.45 19.13 3hcq n ALA 212 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hcq n ASN 213 N -2.54 0.68 -4.08 0.00 4.13 -1.21 -4.99 115.26 107.24 3hcq n ASN 213 Ca -0.16 0.28 -0.27 0.00 1.68 0.00 0.00 54.58 56.11 3hcq n ASN 213 Cb 0.83 0.63 -0.08 0.00 -1.54 0.00 0.00 39.78 39.62 3hcq n ASN 213 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3hcq s PHE 214 N -3.22 1.78 -0.25 3.10 0.08 -1.18 -5.14 117.98 113.15 3hcq s PHE 214 Ca -0.03 -1.33 -0.01 0.00 0.12 0.00 0.00 56.93 55.69 3hcq s PHE 214 Cb 0.10 -1.17 0.07 0.00 -0.57 0.00 0.00 43.02 41.45 3hcq s PHE 214 CO 0.82 -0.32 0.03 0.15 -0.10 0.00 0.00 175.22 175.79 3hcq s LYS 215 N -3.67 1.03 0.30 0.44 1.02 -1.26 -4.81 119.74 112.79 3hcq s LYS 215 Ca 0.20 -0.89 0.10 0.00 0.02 0.00 0.00 55.97 55.41 3hcq s LYS 215 Cb 0.01 -2.29 -0.06 0.00 -0.52 0.00 0.00 37.83 34.97 3hcq s LYS 215 CO 0.14 -0.75 -0.15 -0.51 -0.92 0.00 0.00 175.35 173.16 3hcq s LEU 216 N 1.58 2.64 -0.11 3.17 1.43 -1.26 -4.33 118.68 121.80 3hcq s LEU 216 Ca 0.01 -1.11 0.02 0.00 -1.03 0.00 0.00 54.13 52.02 3hcq s LEU 216 Cb -0.18 -1.01 0.02 0.00 0.03 0.00 0.00 46.19 45.05 3hcq s LEU 216 CO -0.13 -0.10 -0.14 -0.89 0.23 0.00 0.00 176.35 175.32 3hcq s THR 217 N -2.61 1.45 0.22 5.49 2.01 -1.15 -5.03 115.64 116.01 3hcq s THR 217 Ca 0.31 -0.61 -0.24 0.00 0.31 0.00 0.00 61.69 61.46 3hcq s THR 217 Cb -0.01 -1.33 -0.08 0.00 0.01 0.00 0.00 72.50 71.08 3hcq s THR 217 CO 0.15 0.43 0.80 -0.31 -0.69 0.00 0.00 174.62 175.00 3hcq s TYR 218 N 1.03 3.80 0.48 4.92 1.51 -1.26 -1.93 117.35 125.90 3hcq s TYR 218 Ca -0.06 1.61 -0.03 0.00 -1.01 0.00 0.00 57.07 57.57 3hcq s TYR 218 Cb -0.15 -2.76 -0.02 0.00 -0.11 0.00 0.00 41.96 38.92 3hcq s TYR 218 CO -0.02 0.41 0.75 -0.51 -1.11 0.00 0.00 175.55 175.06 3hcq s LEU 219 N -1.56 3.62 0.33 -1.29 1.43 -1.21 -4.99 118.68 115.01 3hcq s LEU 219 Ca 0.41 0.70 0.07 0.00 -1.03 0.00 0.00 54.13 54.28 3hcq s LEU 219 Cb -0.21 -3.60 -0.06 0.00 0.03 0.00 0.00 46.19 42.35 3hcq s LEU 219 CO 0.25 -0.65 -0.05 -0.94 0.23 0.00 0.00 176.35 175.19 3hcq s SER 220 N -4.15 3.27 0.00 2.29 1.04 -1.26 -4.90 113.70 109.99 3hcq s SER 220 Ca 0.48 -1.25 0.00 0.00 0.48 0.00 0.00 55.95 55.66 3hcq s SER 220 Cb -0.10 -0.27 0.00 0.00 0.10 0.00 0.00 66.02 65.75 3hcq s SER 220 CO 0.42 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 174.91 3hcq n GLY 221 N -0.74 1.68 1.89 7.32 0.00 -1.26 -1.42 105.19 112.66 3hcq n GLY 221 Ca -0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 3hcq n GLY 221 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hcq n GLY 222 N -0.18 3.09 0.29 -0.02 0.00 -1.26 -4.59 105.19 102.52 3hcq n GLY 222 Ca 0.00 -0.89 -0.05 0.00 0.00 0.00 0.00 46.02 45.08 3hcq n GLY 222 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hcq h ASP 223 N 2.23 0.87 -0.18 1.61 3.32 -1.95 -2.75 116.42 119.57 3hcq h ASP 223 Ca 0.16 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3hcq h ASP 223 Cb 1.21 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.54 3hcq h ASP 223 CO 0.28 0.67 0.00 0.47 -1.72 0.00 0.00 179.24 178.94 3hcq n ASP 224 N -4.53 1.46 0.03 6.45 9.92 -1.26 -2.66 116.55 125.96 3hcq n ASP 224 Ca 0.06 -1.75 -0.01 0.00 -0.53 0.00 0.00 54.79 52.57 3hcq n ASP 224 Cb 0.05 -0.12 -0.00 0.00 -0.64 0.00 0.00 41.12 40.41 3hcq n ASP 224 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 3hcq n VAL 225 N 0.21 1.16 0.79 2.53 0.31 -1.18 -4.87 118.33 117.29 3hcq n VAL 225 Ca 0.14 0.35 0.11 0.00 -0.01 0.00 0.00 64.34 64.93 3hcq n VAL 225 Cb 0.28 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 3hcq n VAL 225 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3hcq n PHE 226 N -3.52 0.09 0.00 3.52 3.01 -1.05 -5.08 117.46 114.43 3hcq n PHE 226 Ca -0.02 0.03 0.00 0.00 1.01 0.00 0.00 57.45 58.47 3hcq n PHE 226 Cb 0.06 -0.23 0.00 0.00 -0.01 0.00 0.00 39.48 39.30 3hcq n PHE 226 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hcq n GLY 227 N 1.44 3.01 3.79 1.37 0.00 -1.09 -4.73 105.19 108.99 3hcq n GLY 227 Ca 0.03 -1.79 -0.29 0.00 0.00 0.00 0.00 46.02 43.97 3hcq n GLY 227 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hcq s PRO 228 N -3.78 1.15 -1.33 1.61 0.04 -1.22 -3.77 135.00 127.69 3hcq s PRO 228 Ca 0.00 0.26 -0.07 0.00 0.04 0.00 0.00 61.00 61.23 3hcq s PRO 228 Cb 0.00 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 32.71 3hcq s PRO 228 CO 0.00 -2.19 1.16 -1.71 0.04 0.00 0.00 177.00 174.30 3hcq n ASN 229 N -3.75 -5.68 0.00 6.66 2.85 -1.26 -2.10 115.26 111.98 3hcq n ASN 229 Ca 0.07 -0.55 0.00 0.00 -0.11 0.00 0.00 54.58 53.99 3hcq n ASN 229 Cb 0.59 -5.04 0.00 0.00 1.24 0.00 0.00 39.78 36.57 3hcq n ASN 229 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 3hcq n TYR 230 N -4.87 0.00 -0.12 1.20 4.01 -1.26 -4.18 117.16 111.95 3hcq n TYR 230 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 3hcq n TYR 230 Cb 0.58 -0.85 0.00 0.00 -0.31 0.00 0.00 39.34 38.75 3hcq n TYR 230 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hcq n GLY 231 N -2.00 0.85 3.80 2.72 0.00 -0.89 -4.41 105.19 105.25 3hcq n GLY 231 Ca 0.00 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.93 3hcq n GLY 231 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hcq s GLY 232 N -2.05 2.35 0.24 -0.02 0.00 -1.26 -2.93 107.32 103.65 3hcq s GLY 232 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 44.72 45.24 3hcq s GLY 232 CO 0.00 0.83 0.12 0.00 0.00 0.00 0.00 173.10 174.05 3hcq s ALA 233 N -2.18 1.49 -0.10 3.20 0.00 -1.03 -4.83 121.76 118.32 3hcq s ALA 233 Ca 0.66 -1.79 -0.12 0.00 0.00 0.00 0.00 51.96 50.71 3hcq s ALA 233 Cb -0.16 1.22 0.03 0.00 0.00 0.00 0.00 23.12 24.21 3hcq s ALA 233 CO 0.27 -0.53 0.33 0.95 0.00 0.00 0.00 175.76 176.78 3hcq s THR 234 N -3.93 0.01 0.13 0.00 -4.23 -1.26 -3.72 115.64 102.65 3hcq s THR 234 Ca 0.38 -0.10 0.06 0.00 -1.18 0.00 0.00 61.69 60.86 3hcq s THR 234 Cb 0.07 -0.49 -0.04 0.00 1.34 0.00 0.00 72.50 73.38 3hcq s THR 234 CO 0.13 -0.05 -0.00 -0.69 -0.54 0.00 0.00 174.62 173.47 3hcq s VAL 235 N -0.12 3.84 0.31 2.29 1.01 -1.21 -3.19 120.40 123.34 3hcq s VAL 235 Ca -0.03 -1.20 0.06 0.00 0.00 0.00 0.00 61.98 60.81 3hcq s VAL 235 Cb -0.03 -2.88 -0.02 0.00 0.00 0.00 0.00 36.38 33.45 3hcq s VAL 235 CO 0.01 0.01 0.21 1.41 0.00 0.00 0.00 175.10 176.74 3hcq n HIS 236 N 0.25 -0.44 -4.09 5.22 8.25 -1.23 -2.30 115.22 120.88 3hcq n HIS 236 Ca -0.11 -2.41 -0.19 0.00 -0.26 0.00 0.00 57.72 54.75 3hcq n HIS 236 Cb 0.53 0.17 -0.16 0.00 1.12 0.00 0.00 29.99 31.65 3hcq n HIS 236 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3hcq s THR 237 N -3.10 0.45 0.11 1.59 2.01 -0.96 -3.79 115.64 111.95 3hcq s THR 237 Ca 0.30 -0.06 0.08 0.00 0.31 0.00 0.00 61.69 62.31 3hcq s THR 237 Cb 0.01 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 72.00 3hcq s THR 237 CO 0.21 0.21 -0.20 0.20 -0.69 0.00 0.00 174.62 174.35 3hcq s ASN 238 N 0.98 2.47 0.16 3.53 0.01 -1.19 -1.07 114.94 119.83 3hcq s ASN 238 Ca -0.10 -0.70 -0.06 0.00 -0.71 0.00 0.00 52.86 51.29 3hcq s ASN 238 Cb -0.14 -0.13 -0.02 0.00 0.41 0.00 0.00 41.25 41.37 3hcq s ASN 238 CO -0.01 0.03 0.21 0.68 -1.51 0.00 0.00 177.10 176.51 3hcq s VAL 239 N -1.28 0.06 0.52 1.60 -7.23 -0.98 -3.31 120.40 109.77 3hcq s VAL 239 Ca 0.07 -1.62 -0.18 0.00 -1.81 0.00 0.00 61.98 58.43 3hcq s VAL 239 Cb -0.09 -2.01 -0.07 0.00 0.56 0.00 0.00 36.38 34.77 3hcq s VAL 239 CO 0.04 -0.29 1.02 0.00 -0.31 0.00 0.00 175.10 175.56 3hcq s ARG 240 N -4.02 3.73 0.17 4.82 1.70 -1.24 -2.71 118.95 121.39 3hcq s ARG 240 Ca 0.22 1.19 -0.34 0.00 -0.47 0.00 0.00 55.73 56.33 3hcq s ARG 240 Cb 0.05 -2.09 -0.14 0.00 -0.57 0.00 0.00 34.95 32.20 3hcq s ARG 240 CO 0.03 -0.47 1.58 0.00 -1.08 0.00 0.00 175.30 175.36 3hcq n ALA 241 N -1.41 1.48 -0.96 7.88 0.00 -1.26 -2.94 120.51 123.29 3hcq n ALA 241 Ca 0.08 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.96 3hcq n ALA 241 Cb 0.53 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.62 3hcq n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hcq n GLY 242 N 3.41 0.49 0.20 0.00 0.00 -1.26 -4.94 105.19 103.09 3hcq n GLY 242 Ca 0.17 -0.30 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 3hcq n GLY 242 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3hcq h TYR 243 N 0.00 0.75 0.00 1.61 3.20 -1.93 -3.19 116.97 117.42 3hcq h TYR 243 Ca 0.00 -0.31 0.00 0.00 3.14 0.00 0.00 58.73 61.56 3hcq h TYR 243 Cb 0.00 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.15 3hcq h TYR 243 CO 0.00 1.08 0.00 0.00 -1.64 0.00 0.00 178.16 177.60 3hcq h THR 244 N 0.41 0.00 -0.01 1.81 1.03 -1.88 -1.54 112.91 112.73 3hcq h THR 244 Ca -0.02 -0.22 0.00 0.00 -0.01 0.00 0.00 66.41 66.16 3hcq h THR 244 Cb 1.27 1.07 0.00 0.00 -1.07 0.00 0.00 68.15 69.42 3hcq h THR 244 CO 0.13 0.00 -0.40 0.35 -0.01 0.00 0.00 175.52 175.59 3hcq n THR 245 N -2.77 0.00 -0.10 0.00 -2.24 -1.24 -4.40 114.28 103.53 3hcq n THR 245 Ca -0.00 -0.30 -0.23 0.00 -2.27 0.00 0.00 64.05 61.25 3hcq n THR 245 Cb 0.18 1.10 -0.12 0.00 -2.10 0.00 0.00 70.33 69.39 3hcq n THR 245 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3hcq n GLU 246 N -0.60 0.59 -3.79 -0.78 2.13 -0.64 -4.68 120.64 112.87 3hcq n GLU 246 Ca 0.04 0.49 -0.28 0.00 0.66 0.00 0.00 57.16 58.07 3hcq n GLU 246 Cb 0.25 -1.70 -0.12 0.00 0.27 0.00 0.00 31.44 30.13 3hcq n GLU 246 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3hcq h PRO 248 N 5.81 0.44 0.02 0.00 0.11 -1.81 -3.11 132.00 133.47 3hcq h PRO 248 Ca 0.11 -0.14 -0.13 0.00 0.11 0.00 0.00 66.00 65.95 3hcq h PRO 248 Cb 0.83 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 31.91 3hcq h PRO 248 CO 0.62 0.60 -0.54 -0.97 -0.21 0.00 0.00 178.00 177.50 3hcq h ASN 249 N 0.41 0.43 0.66 -2.05 -1.24 -1.95 -3.21 115.58 108.64 3hcq h ASN 249 Ca 0.07 -0.80 0.00 0.00 0.71 0.00 0.00 56.30 56.28 3hcq h ASN 249 Cb 0.53 -0.13 0.00 0.00 0.73 0.00 0.00 38.32 39.45 3hcq h ASN 249 CO 0.03 1.19 0.00 0.55 -1.29 0.00 0.00 177.43 177.91 3hcq n VAL 250 N -4.28 0.88 -0.98 2.57 3.14 -1.24 -1.81 118.33 116.61 3hcq n VAL 250 Ca -0.11 0.22 0.05 0.00 -2.96 0.00 0.00 64.34 61.54 3hcq n VAL 250 Cb 0.65 -1.07 0.35 0.00 -1.06 0.00 0.00 33.84 32.71 3hcq n VAL 250 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 3hcq n ASP 251 N -1.93 5.02 -0.08 6.55 5.68 -1.18 -4.30 116.55 126.32 3hcq n ASP 251 Ca 0.03 -3.04 -0.07 0.00 -0.50 0.00 0.00 54.79 51.21 3hcq n ASP 251 Cb 0.21 -0.66 -0.14 0.00 -1.14 0.00 0.00 41.12 39.39 3hcq n ASP 251 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 3hcq n LYS 252 N 0.13 1.02 0.13 0.11 3.00 -0.75 -4.37 118.16 117.43 3hcq n LYS 252 Ca 0.29 -0.03 -0.01 0.00 -0.00 0.00 0.00 58.31 58.57 3hcq n LYS 252 Cb 1.16 -1.46 0.14 0.00 0.00 0.00 0.00 35.03 34.87 3hcq n LYS 252 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 3hcq h LEU 253 N 0.00 0.00 -0.14 3.14 6.46 -1.75 -3.17 115.31 119.86 3hcq h LEU 253 Ca -0.44 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.32 3hcq h LEU 253 Cb 1.98 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.91 3hcq h LEU 253 CO 0.02 0.64 0.00 0.18 -0.62 0.00 0.00 178.44 178.66 3hcq n LEU 254 N -3.65 0.12 -0.90 2.25 4.77 -1.26 -1.89 117.00 116.45 3hcq n LEU 254 Ca -0.01 0.53 0.11 0.00 -0.03 0.00 0.00 56.01 56.61 3hcq n LEU 254 Cb 0.66 -0.52 0.28 0.00 -2.33 0.00 0.00 43.42 41.51 3hcq n LEU 254 CO 0.42 -0.32 0.73 0.00 -1.33 0.00 0.00 177.39 176.89 3hcq n GLN 255 N -1.64 2.17 -0.01 3.23 6.02 -1.20 -4.38 117.38 121.58 3hcq n GLN 255 Ca 0.03 -1.77 -0.00 0.00 -0.01 0.00 0.00 57.00 55.25 3hcq n GLN 255 Cb 0.17 -1.45 -0.02 0.00 1.02 0.00 0.00 30.24 29.96 3hcq n GLN 255 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3hcq n ASN 256 N 0.98 4.47 -4.71 1.08 3.02 -0.79 -5.06 115.26 114.25 3hcq n ASN 256 Ca 0.18 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.31 3hcq n ASN 256 Cb 0.48 0.75 -0.03 0.00 -0.61 0.00 0.00 39.78 40.37 3hcq n ASN 256 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3hcq s LEU 257 N -3.81 4.36 0.26 3.41 1.43 -1.21 -4.84 118.68 118.29 3hcq s LEU 257 Ca -0.01 2.27 0.02 0.00 -1.03 0.00 0.00 54.13 55.37 3hcq s LEU 257 Cb 0.01 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.60 3hcq s LEU 257 CO 0.09 -0.65 0.09 -0.44 0.23 0.00 0.00 176.35 175.67 3hcq s SER 258 N 1.25 1.30 0.17 2.29 0.01 -1.26 -4.89 113.70 112.57 3hcq s SER 258 Ca 0.64 -1.37 -0.03 0.00 1.31 0.00 0.00 55.95 56.50 3hcq s SER 258 Cb -0.35 0.14 -0.03 0.00 0.21 0.00 0.00 66.02 65.98 3hcq s SER 258 CO 0.30 -0.71 0.14 -0.36 0.41 0.00 0.00 173.24 173.02 3hcq s PHE 259 N -3.71 0.89 0.13 2.43 0.08 -1.19 -5.11 117.98 111.51 3hcq s PHE 259 Ca 0.37 -1.20 -0.00 0.00 0.12 0.00 0.00 56.93 56.22 3hcq s PHE 259 Cb 0.08 -0.42 -0.04 0.00 -0.57 0.00 0.00 43.02 42.07 3hcq s PHE 259 CO 0.13 -0.62 0.03 0.45 -0.10 0.00 0.00 175.22 175.11 3hcq s SER 260 N -3.08 0.61 0.20 1.36 0.15 -1.26 -4.83 113.70 106.85 3hcq s SER 260 Ca 0.29 -1.17 0.05 0.00 0.70 0.00 0.00 55.95 55.82 3hcq s SER 260 Cb 0.06 0.23 0.11 0.00 -1.71 0.00 0.00 66.02 64.71 3hcq s SER 260 CO 0.06 -0.66 1.46 -0.07 1.20 0.00 0.00 173.24 175.23 3hcq h LEU 261 N 2.85 0.18 0.18 3.45 4.07 -1.96 -3.05 115.31 121.02 3hcq h LEU 261 Ca -0.35 -0.13 -0.30 0.00 0.08 0.00 0.00 57.88 57.17 3hcq h LEU 261 Cb 1.19 -0.05 0.02 0.00 1.08 0.00 0.00 40.66 42.90 3hcq h LEU 261 CO 0.61 0.88 -1.37 -0.61 -1.08 0.00 0.00 178.44 176.87 3hcq h GLN 262 N 0.09 0.38 -0.31 1.13 4.15 -2.00 -3.29 115.11 115.26 3hcq h GLN 262 Ca -0.02 -0.64 -0.09 0.00 0.77 0.00 0.00 58.65 58.66 3hcq h GLN 262 Cb 1.35 0.24 -0.01 0.00 0.21 0.00 0.00 27.48 29.27 3hcq h GLN 262 CO 0.11 1.30 -0.15 1.98 -1.93 0.00 0.00 178.83 180.15 3hcq h MET 263 N 0.10 0.65 -0.11 1.69 4.05 -1.99 -2.97 114.93 116.36 3hcq h MET 263 Ca -0.19 -0.28 -0.08 0.00 -0.28 0.00 0.00 59.70 58.86 3hcq h MET 263 Cb 2.06 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 32.82 3hcq h MET 263 CO 0.23 0.87 -0.30 0.93 0.23 0.00 0.00 176.91 178.87 3hcq h GLU 264 N 0.41 0.20 0.00 0.39 5.08 -1.69 -3.02 114.58 115.94 3hcq h GLU 264 Ca 0.07 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 3hcq h GLU 264 Cb 0.67 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 3hcq h GLU 264 CO 0.05 0.48 -0.40 -0.97 -1.00 0.00 0.00 179.01 177.17 3hcq h ASN 265 N 0.18 0.00 -0.09 1.42 -0.73 -1.61 -3.08 115.58 111.66 3hcq h ASN 265 Ca 0.02 0.00 -0.08 0.00 1.87 0.00 0.00 56.30 58.11 3hcq h ASN 265 Cb 0.63 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.22 3hcq h ASN 265 CO 0.05 0.40 -0.27 -0.33 -0.37 0.00 0.00 177.43 176.90 3hcq h GLU 266 N 0.00 0.34 0.00 6.67 5.08 -1.39 -3.17 114.58 122.11 3hcq h GLU 266 Ca -0.00 -0.25 -0.11 0.00 -1.00 0.00 0.00 59.36 58.00 3hcq h GLU 266 Cb 1.11 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.38 3hcq h GLU 266 CO 0.05 0.87 -0.52 0.82 -1.00 0.00 0.00 179.01 179.23 3hcq h ILE 267 N -0.12 1.18 -0.27 3.13 2.04 -1.66 -3.24 117.51 118.57 3hcq h ILE 267 Ca -0.01 -1.93 -0.07 0.00 1.00 0.00 0.00 64.86 63.85 3hcq h ILE 267 Cb 0.90 2.10 -0.01 0.00 -0.74 0.00 0.00 36.82 39.06 3hcq h ILE 267 CO 0.06 0.51 -0.15 -0.03 0.00 0.00 0.00 178.15 178.54 3hcq h MET 268 N 0.00 0.46 0.00 2.37 4.05 -1.57 -2.92 114.93 117.32 3hcq h MET 268 Ca -0.01 -0.14 -0.04 0.00 -0.28 0.00 0.00 59.70 59.24 3hcq h MET 268 Cb 1.05 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.80 3hcq h MET 268 CO 0.07 0.61 -0.18 0.78 0.23 0.00 0.00 176.91 178.41 3hcq h GLY 269 N 0.93 0.00 2.00 1.39 0.00 -1.57 -3.25 103.07 102.58 3hcq h GLY 269 Ca 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.36 3hcq h GLY 269 CO 0.03 0.00 -0.23 0.50 0.00 0.00 0.00 176.54 176.84 3hcq h LYS 270 N 0.00 0.00 0.07 4.80 1.57 -1.63 -3.00 116.57 118.38 3hcq h LYS 270 Ca -0.00 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.43 3hcq h LYS 270 Cb 0.87 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.15 3hcq h LYS 270 CO 0.02 0.23 -1.98 -0.89 -0.57 0.00 0.00 179.45 176.26 3hcq n ILE 271 N -3.35 1.66 -0.05 1.86 5.41 -1.23 -3.14 119.36 120.52 3hcq n ILE 271 Ca 0.00 -0.48 -0.12 0.00 1.00 0.00 0.00 62.75 63.15 3hcq n ILE 271 Cb 0.45 -1.75 -0.11 0.00 -0.71 0.00 0.00 39.64 37.52 3hcq n ILE 271 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3hcq h LEU 272 N -0.26 -0.02 -0.47 1.39 3.38 -1.68 -2.62 115.31 115.03 3hcq h LEU 272 Ca -0.46 -0.75 -0.05 0.00 0.09 0.00 0.00 57.88 56.71 3hcq h LEU 272 Cb 1.82 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.57 3hcq h LEU 272 CO -0.05 0.80 -0.26 0.78 0.09 0.00 0.00 178.44 179.80 3hcq h ASN 273 N -0.91 0.00 0.00 -0.43 2.35 -1.78 -3.37 115.58 111.44 3hcq h ASN 273 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3hcq h ASN 273 Cb 0.77 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.14 3hcq h ASN 273 CO 0.00 0.26 -0.66 0.47 -1.65 0.00 0.00 177.43 175.85 3hcq n ASP 274 N -3.24 3.30 -2.14 5.81 8.00 -1.25 -5.09 116.55 121.94 3hcq n ASP 274 Ca 0.02 -0.03 -0.02 0.00 0.71 0.00 0.00 54.79 55.46 3hcq n ASP 274 Cb 0.56 0.73 0.01 0.00 -0.02 0.00 0.00 41.12 42.39 3hcq n ASP 274 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hcq n GLY 275 N 1.72 -0.34 3.38 0.44 0.00 -0.99 -5.02 105.19 104.39 3hcq n GLY 275 Ca 0.00 0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 3hcq n GLY 275 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hcq s GLU 276 N -3.23 1.68 0.19 1.61 2.12 -1.19 -5.03 118.70 114.85 3hcq s GLU 276 Ca 0.08 -1.19 -0.32 0.00 0.36 0.00 0.00 54.97 53.90 3hcq s GLU 276 Cb -0.01 -1.98 -0.11 0.00 0.26 0.00 0.00 34.13 32.29 3hcq s GLU 276 CO 0.29 0.49 1.61 0.34 -0.54 0.00 0.00 175.26 177.45 3hcq s ASP 277 N -1.64 6.52 0.00 -1.70 2.15 -1.26 -4.60 116.67 116.14 3hcq s ASP 277 Ca 0.13 2.71 0.07 0.00 0.43 0.00 0.00 52.55 55.90 3hcq s ASP 277 Cb -0.10 -2.60 0.32 0.00 -0.30 0.00 0.00 42.92 40.24 3hcq s ASP 277 CO 0.04 -0.87 1.23 -2.65 -0.17 0.00 0.00 175.17 172.76 3hcq n PRO 278 N 3.80 0.01 -0.09 4.34 -0.02 -1.26 -2.46 135.00 139.32 3hcq n PRO 278 Ca 0.14 0.36 -0.12 0.00 -2.02 0.00 0.00 63.50 61.86 3hcq n PRO 278 Cb 0.38 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.21 3hcq n PRO 278 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3hcq n GLU 279 N -1.49 0.68 0.00 -0.52 2.13 -1.26 -3.91 120.64 116.27 3hcq n GLU 279 Ca 0.02 0.09 0.13 0.00 0.66 0.00 0.00 57.16 58.06 3hcq n GLU 279 Cb 0.08 -1.58 0.44 0.00 0.27 0.00 0.00 31.44 30.65 3hcq n GLU 279 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 3hcq n LYS 280 N -2.92 0.01 0.00 5.31 4.81 -1.04 -3.64 118.16 120.70 3hcq n LYS 280 Ca -0.32 -0.01 -0.07 0.00 -0.87 0.00 0.00 58.31 57.05 3hcq n LYS 280 Cb 1.11 -1.50 -0.12 0.00 0.02 0.00 0.00 35.03 34.54 3hcq n LYS 280 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hcq h ALA 281 N 3.01 0.69 -0.12 3.14 0.00 -1.65 -3.33 119.26 121.00 3hcq h ALA 281 Ca 0.00 -1.25 -0.21 0.00 0.00 0.00 0.00 54.91 53.45 3hcq h ALA 281 Cb 0.50 0.35 0.01 0.00 0.00 0.00 0.00 17.79 18.64 3hcq h ALA 281 CO 0.00 1.40 -0.78 0.00 0.00 0.00 0.00 179.25 179.87 3hcq h ALA 282 N 1.09 0.40 0.00 0.00 0.00 -1.68 -3.12 119.26 115.95 3hcq h ALA 282 Ca -0.22 -0.61 -0.09 0.00 0.00 0.00 0.00 54.91 54.00 3hcq h ALA 282 Cb 1.89 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.64 3hcq h ALA 282 CO 0.08 0.71 -0.41 0.00 0.00 0.00 0.00 179.25 179.64 3hcq h ALA 283 N 0.68 1.07 -0.00 0.00 0.00 -1.74 -3.06 119.26 116.20 3hcq h ALA 283 Ca -0.05 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.33 3hcq h ALA 283 Cb 1.39 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 3hcq h ALA 283 CO 0.15 0.51 -0.75 0.00 0.00 0.00 0.00 179.25 179.16 3hcq h ALA 284 N 1.59 0.74 -0.10 0.00 0.00 -1.67 -2.88 119.26 116.94 3hcq h ALA 284 Ca -0.00 -0.67 -0.23 0.00 0.00 0.00 0.00 54.91 54.00 3hcq h ALA 284 Cb 0.87 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.56 3hcq h ALA 284 CO 0.05 0.91 -0.84 2.35 0.00 0.00 0.00 179.25 181.72 3hcq h TRP 285 N 0.03 1.00 0.00 0.00 7.01 -1.47 -2.70 115.95 119.81 3hcq h TRP 285 Ca -0.01 -0.47 -0.11 0.00 2.11 0.00 0.00 58.89 60.40 3hcq h TRP 285 Cb 1.33 -0.14 -0.02 0.00 -2.10 0.00 0.00 29.16 28.23 3hcq h TRP 285 CO 0.01 1.30 -0.54 -0.07 -2.79 0.00 0.00 178.44 176.35 3hcq h LEU 286 N 0.47 0.00 -0.55 0.65 3.38 -1.62 -1.93 115.31 115.71 3hcq h LEU 286 Ca -0.07 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.74 3hcq h LEU 286 Cb 1.48 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.22 3hcq h LEU 286 CO 0.17 0.54 -0.62 0.50 0.09 0.00 0.00 178.44 179.11 3hcq h LYS 287 N 0.00 0.37 0.00 1.13 3.64 -1.51 -3.12 116.57 117.08 3hcq h LYS 287 Ca -0.01 -0.26 -0.17 0.00 -1.27 0.00 0.00 60.65 58.94 3hcq h LYS 287 Cb 1.10 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 3hcq h LYS 287 CO 0.07 0.88 -0.83 0.22 -2.27 0.00 0.00 179.45 177.51 3hcq h ASP 288 N 0.27 0.00 -4.08 4.20 1.82 -1.41 -3.40 116.42 113.82 3hcq h ASP 288 Ca -0.01 0.00 -0.64 0.00 -0.39 0.00 0.00 57.03 55.99 3hcq h ASP 288 Cb 1.15 0.00 -0.41 0.00 0.68 0.00 0.00 39.33 40.76 3hcq h ASP 288 CO 0.10 0.83 -0.59 0.20 -1.61 0.00 0.00 179.24 178.18 3hcq s ASN 289 N -6.64 4.51 0.63 2.28 -0.87 -0.73 -4.97 114.94 109.16 3hcq s ASN 289 Ca 0.02 -3.20 0.41 0.00 -1.57 0.00 0.00 52.86 48.52 3hcq s ASN 289 Cb 0.09 -1.66 2.13 0.00 -0.02 0.00 0.00 41.25 41.80 3hcq s ASN 289 CO 0.79 -0.21 2.28 -0.65 -2.57 0.00 0.00 177.10 176.74 3hcq h PRO 290 N 6.29 0.00 -6.69 -0.60 0.11 -1.78 -3.41 132.00 125.92 3hcq h PRO 290 Ca -0.02 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 65.41 3hcq h PRO 290 Cb 0.86 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 31.77 3hcq h PRO 290 CO 0.70 0.01 -0.81 -1.14 -0.21 0.00 0.00 178.00 176.55 3hcq s GLN 291 N -4.09 1.85 -0.45 1.05 0.74 -1.26 -4.02 119.66 113.48 3hcq s GLN 291 Ca -0.04 -1.13 -0.00 0.00 0.05 0.00 0.00 55.36 54.24 3hcq s GLN 291 Cb 0.12 -2.12 0.12 0.00 1.10 0.00 0.00 33.01 32.23 3hcq s GLN 291 CO 0.46 0.50 0.22 -1.12 -0.55 0.00 0.00 175.29 174.79 3hcq s SER 292 N -1.92 4.99 0.00 6.67 0.01 -1.26 -5.08 113.70 117.12 3hcq s SER 292 Ca 0.17 -2.36 0.25 0.00 1.31 0.00 0.00 55.95 55.32 3hcq s SER 292 Cb -0.10 -1.76 0.51 0.00 0.21 0.00 0.00 66.02 64.88 3hcq s SER 292 CO 0.08 -0.42 1.43 0.00 0.41 0.00 0.00 173.24 174.74 3hcq n ILE 293 N 4.09 0.00 -0.02 1.44 3.06 -1.26 -4.41 119.36 122.25 3hcq n ILE 293 Ca 0.02 -0.33 -0.15 0.00 -2.50 0.00 0.00 62.75 59.79 3hcq n ILE 293 Cb 0.40 0.99 -0.11 0.00 0.54 0.00 0.00 39.64 41.45 3hcq n ILE 293 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 3hcq h GLU 294 N 3.08 0.23 0.00 9.51 3.07 -1.94 -3.35 114.58 125.18 3hcq h GLU 294 Ca 0.00 -0.22 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 3hcq h GLU 294 Cb 0.73 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.70 3hcq h GLU 294 CO 0.00 0.91 0.00 -1.00 -1.40 0.00 0.00 179.01 177.52 3hcq h PRO 295 N -0.37 0.00 -0.00 2.33 0.13 -2.01 -2.89 132.00 129.19 3hcq h PRO 295 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 3hcq h PRO 295 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 3hcq h PRO 295 CO 0.06 0.00 -0.40 0.91 -0.23 0.00 0.00 178.00 178.34 3hcq n TRP 296 N -2.34 0.00 -3.29 1.56 8.01 -1.25 -4.47 117.44 115.66 3hcq n TRP 296 Ca 0.03 0.00 -0.26 0.00 -1.31 0.00 0.00 57.50 55.95 3hcq n TRP 296 Cb 0.27 -0.27 -0.07 0.00 -2.01 0.00 0.00 31.31 29.23 3hcq n TRP 296 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 3hcq n LEU 297 N -1.41 3.24 -4.04 -0.99 4.77 -1.09 -4.91 117.00 112.57 3hcq n LEU 297 Ca 0.07 -5.36 -0.34 0.00 -0.03 0.00 0.00 56.01 50.35 3hcq n LEU 297 Cb 0.33 -0.39 -0.09 0.00 -2.33 0.00 0.00 43.42 40.94 3hcq n LEU 297 CO 0.33 2.13 0.11 -0.44 -1.33 0.00 0.00 177.39 178.18 3hcq s SER 298 N -2.47 5.31 0.00 -1.43 0.01 -1.26 -4.59 113.70 109.27 3hcq s SER 298 Ca 0.41 -3.42 0.00 0.00 1.31 0.00 0.00 55.95 54.25 3hcq s SER 298 Cb 0.19 -1.80 0.00 0.00 0.21 0.00 0.00 66.02 64.61 3hcq s SER 298 CO -0.05 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 173.99 3hcq n GLY 299 N 2.68 0.86 3.12 3.44 0.00 -1.26 -5.11 105.19 108.92 3hcq n GLY 299 Ca 0.15 -0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3hcq n GLY 299 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hcq s VAL 300 N -2.05 1.88 0.40 1.61 1.01 -1.26 -5.06 120.40 116.93 3hcq s VAL 300 Ca 0.00 -0.86 0.08 0.00 0.00 0.00 0.00 61.98 61.19 3hcq s VAL 300 Cb 0.00 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 3hcq s VAL 300 CO 0.00 0.51 0.36 0.00 0.00 0.00 0.00 175.10 175.97 3hcq s ALA 301 N 0.96 4.02 0.87 5.51 0.00 -1.26 -3.62 121.76 128.24 3hcq s ALA 301 Ca -0.05 -1.84 -0.11 0.00 0.00 0.00 0.00 51.96 49.97 3hcq s ALA 301 Cb -0.15 -1.05 0.17 0.00 0.00 0.00 0.00 23.12 22.08 3hcq s ALA 301 CO -0.04 -0.18 1.20 -0.08 0.00 0.00 0.00 175.76 176.67 3hcq s THR 302 N -2.44 2.05 0.35 0.00 -1.32 -0.95 -4.90 115.64 108.44 3hcq s THR 302 Ca 0.47 -0.19 0.10 0.00 -1.21 0.00 0.00 61.69 60.86 3hcq s THR 302 Cb -0.04 -2.86 0.33 0.00 -1.51 0.00 0.00 72.50 68.42 3hcq s THR 302 CO 0.28 0.00 1.81 0.50 -2.21 0.00 0.00 174.62 175.00 3hcq h LYS 303 N -1.23 0.63 -0.19 7.08 3.64 -1.89 -2.42 116.57 122.19 3hcq h LYS 303 Ca -0.42 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 58.88 3hcq h LYS 303 Cb 1.25 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.90 3hcq h LYS 303 CO 0.41 0.41 -0.07 -0.40 -2.27 0.00 0.00 179.45 177.54 3hcq n ASP 304 N -4.64 2.90 0.00 4.20 5.75 -1.26 -4.98 116.55 118.51 3hcq n ASP 304 Ca 0.21 -3.32 0.00 0.00 -0.01 0.00 0.00 54.79 51.68 3hcq n ASP 304 Cb 0.60 -0.54 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 3hcq n ASP 304 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hcq n GLY 305 N -0.98 1.27 4.00 6.12 0.00 -0.91 -5.10 105.19 109.59 3hcq n GLY 305 Ca 0.23 -0.36 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 3hcq n GLY 305 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hcq s GLY 306 N -2.40 1.90 0.36 -0.02 0.00 -1.26 -4.87 107.32 101.03 3hcq s GLY 306 Ca 0.00 -1.89 -0.28 0.00 0.00 0.00 0.00 44.72 42.55 3hcq s GLY 306 CO 0.00 -1.66 1.40 -0.35 0.00 0.00 0.00 173.10 172.49 3hcq s ASP 307 N -4.48 6.55 -0.16 1.64 -1.08 -1.26 -2.24 116.67 115.63 3hcq s ASP 307 Ca 0.56 2.87 -0.15 0.00 -0.52 0.00 0.00 52.55 55.31 3hcq s ASP 307 Cb -0.06 -2.66 -0.12 0.00 -1.46 0.00 0.00 42.92 38.62 3hcq s ASP 307 CO 0.34 -0.71 0.12 1.23 0.52 0.00 0.00 175.17 176.67 3hcq h GLY 308 N 3.18 0.00 0.96 2.66 0.00 -1.91 -3.37 103.07 104.59 3hcq h GLY 308 Ca -0.50 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 3hcq h GLY 308 CO 0.65 0.00 0.20 -2.00 0.00 0.00 0.00 176.54 175.38 3hcq h LEU 309 N -1.00 0.58 -1.23 3.11 5.85 -1.90 -3.03 115.31 117.70 3hcq h LEU 309 Ca -0.14 -0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.36 3hcq h LEU 309 Cb 0.82 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 3hcq h LEU 309 CO -0.08 0.56 -0.33 0.00 -0.34 0.00 0.00 178.44 178.25 3hcq h ALA 310 N 1.04 1.36 -0.29 1.25 0.00 -2.00 -2.10 119.26 118.52 3hcq h ALA 310 Ca 0.15 -0.32 -0.18 0.00 0.00 0.00 0.00 54.91 54.55 3hcq h ALA 310 Cb 0.15 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3hcq h ALA 310 CO -0.02 0.46 -0.54 0.00 0.00 0.00 0.00 179.25 179.15 3hcq h ALA 311 N 1.59 0.48 -0.16 0.00 0.00 -1.69 -2.99 119.26 116.48 3hcq h ALA 311 Ca 0.01 -0.51 -0.19 0.00 0.00 0.00 0.00 54.91 54.22 3hcq h ALA 311 Cb 0.62 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3hcq h ALA 311 CO 0.05 0.68 -0.66 0.28 0.00 0.00 0.00 179.25 179.59 3hcq h VAL 312 N 0.67 1.32 -0.75 0.00 2.07 -1.41 -2.77 116.25 115.37 3hcq h VAL 312 Ca 0.02 -1.94 -0.01 0.00 0.82 0.00 0.00 66.70 65.60 3hcq h VAL 312 Cb 1.15 1.91 -0.04 0.00 -1.52 0.00 0.00 31.29 32.79 3hcq h VAL 312 CO 0.12 0.60 0.45 0.50 0.02 0.00 0.00 177.57 179.26 3hcq h LYS 313 N 0.45 1.02 0.21 1.57 3.64 -1.40 -2.43 116.57 119.63 3hcq h LYS 313 Ca -0.02 -0.09 -0.33 0.00 -1.27 0.00 0.00 60.65 58.94 3hcq h LYS 313 Cb 1.25 -0.21 0.02 0.00 -0.41 0.00 0.00 32.23 32.88 3hcq h LYS 313 CO 0.13 0.72 -1.50 0.00 -2.27 0.00 0.00 179.45 176.53 3hcq h ALA 314 N 1.24 -0.02 -0.26 5.00 0.00 -1.59 -2.20 119.26 121.43 3hcq h ALA 314 Ca 0.27 -0.94 -0.08 0.00 0.00 0.00 0.00 54.91 54.15 3hcq h ALA 314 Cb -0.03 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3hcq h ALA 314 CO -0.05 0.85 -0.20 0.00 0.00 0.00 0.00 179.25 179.84 3hcq h ALA 315 N 0.25 1.18 0.00 0.00 0.00 -1.47 -2.72 119.26 116.50 3hcq h ALA 315 Ca -0.25 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.22 3hcq h ALA 315 Cb 2.11 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.76 3hcq h ALA 315 CO 0.24 0.53 -0.59 1.25 0.00 0.00 0.00 179.25 180.67 3hcq h LEU 316 N 0.42 0.00 0.00 0.00 6.46 -1.57 -3.48 115.31 117.15 3hcq h LEU 316 Ca 0.07 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.83 3hcq h LEU 316 Cb 0.59 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.52 3hcq h LEU 316 CO 0.04 0.59 0.00 0.61 -0.62 0.00 0.00 178.44 179.06 3hcq n GLY 317 N 0.83 0.97 0.00 3.75 0.00 -1.03 -5.08 105.19 104.64 3hcq n GLY 317 Ca 0.00 -0.20 0.12 0.00 0.00 0.00 0.00 46.02 45.94 3hcq n GLY 317 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36