#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h6k h GLU 28 N 0.00 0.00 0.00 1.09 5.08 -2.01 0.21 114.58 118.94 1h6k h GLU 28 Ca 0.00 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 1h6k h GLU 28 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1h6k h GLU 28 CO 0.00 0.00 -0.78 -0.44 -1.00 0.00 0.00 179.01 176.79 1h6k h ASP 29 N 0.00 0.00 0.08 1.42 3.45 -2.04 -3.15 116.42 116.18 1h6k h ASP 29 Ca 0.08 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.54 1h6k h ASP 29 Cb 0.41 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.18 1h6k h ASP 29 CO -0.00 0.78 -0.04 -0.74 -1.57 0.00 0.00 179.24 177.67 1h6k h HIS 30 N 0.00 -0.10 -0.68 4.55 2.76 -1.04 -2.51 115.15 118.12 1h6k h HIS 30 Ca -0.01 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.19 1h6k h HIS 30 Cb 1.45 0.03 -0.04 0.00 1.55 0.00 0.00 27.41 30.40 1h6k h HIS 30 CO 0.00 0.24 0.43 -0.07 -1.30 0.00 0.00 177.93 177.23 1h6k h LEU 31 N -0.46 0.70 -1.11 0.26 4.07 -1.59 -0.64 115.31 116.53 1h6k h LEU 31 Ca -0.01 -0.00 0.17 0.00 0.08 0.00 0.00 57.88 58.12 1h6k h LEU 31 Cb 0.39 -0.15 -0.09 0.00 1.08 0.00 0.00 40.66 41.89 1h6k h LEU 31 CO 0.02 0.49 0.61 -0.08 -1.08 0.00 0.00 178.44 178.40 1h6k h GLU 32 N 0.84 0.74 -0.32 1.13 4.81 -1.51 0.37 114.58 120.63 1h6k h GLU 32 Ca 0.27 -0.04 -0.17 0.00 -0.13 0.00 0.00 59.36 59.29 1h6k h GLU 32 Cb 0.02 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.23 1h6k h GLU 32 CO -0.11 0.49 -0.47 1.03 -0.73 0.00 0.00 179.01 179.23 1h6k h SER 33 N 0.76 0.97 -0.53 1.04 0.87 -0.69 -0.85 113.55 115.12 1h6k h SER 33 Ca 0.53 -0.51 -0.09 0.00 -1.23 0.00 0.00 61.79 60.49 1h6k h SER 33 Cb 0.82 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 1h6k h SER 33 CO -0.30 1.29 -0.03 -0.07 -0.53 0.00 0.00 176.83 177.19 1h6k h LEU 34 N 0.69 0.95 -0.18 2.23 3.38 -0.22 -1.13 115.31 121.03 1h6k h LEU 34 Ca 0.03 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 1h6k h LEU 34 Cb 1.07 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1h6k h LEU 34 CO 0.11 1.04 -0.06 0.40 0.09 0.00 0.00 178.44 180.02 1h6k h ILE 35 N 0.84 1.30 0.00 1.22 2.04 -0.97 -2.61 117.51 119.32 1h6k h ILE 35 Ca 0.15 -1.07 -0.07 0.00 1.00 0.00 0.00 64.86 64.87 1h6k h ILE 35 Cb 0.57 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1h6k h ILE 35 CO 0.03 0.32 -0.34 0.00 0.00 0.00 0.00 178.15 178.16 1h6k n LYS 37 N -4.10 0.16 -1.76 0.00 5.02 -0.43 -4.94 118.16 112.10 1h6k n LYS 37 Ca -0.02 -0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 55.85 1h6k n LYS 37 Cb 0.38 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 1h6k n LYS 37 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1h6k n VAL 38 N -1.75 2.17 0.00 -0.18 3.14 -0.99 -1.84 118.33 118.89 1h6k n VAL 38 Ca 0.03 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.91 1h6k n VAL 38 Cb 0.39 -1.89 0.00 0.00 -1.06 0.00 0.00 33.84 31.28 1h6k n VAL 38 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1h6k n GLY 39 N 0.52 1.73 3.69 7.55 0.00 -1.26 -5.05 105.19 112.37 1h6k n GLY 39 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1h6k n GLY 39 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1h6k n GLU 40 N -2.00 -1.72 -1.61 1.61 1.02 -0.76 -4.93 120.64 112.25 1h6k n GLU 40 Ca 0.00 -1.94 -0.57 0.00 -0.02 0.00 0.00 57.16 54.63 1h6k n GLU 40 Cb 0.00 -1.41 -0.07 0.00 -0.02 0.00 0.00 31.44 29.94 1h6k n GLU 40 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1h6k n LYS 41 N -4.01 0.67 -3.64 3.49 2.85 -1.26 -4.95 118.16 111.32 1h6k n LYS 41 Ca 0.16 0.24 -0.13 0.00 -1.05 0.00 0.00 58.31 57.54 1h6k n LYS 41 Cb 0.57 -1.84 -0.06 0.00 -0.65 0.00 0.00 35.03 33.05 1h6k n LYS 41 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1h6k s SER 42 N 1.27 -0.31 0.20 -5.58 0.15 -1.26 -5.03 113.70 103.14 1h6k s SER 42 Ca 0.92 -0.01 0.10 0.00 0.70 0.00 0.00 55.95 57.66 1h6k s SER 42 Cb -1.14 0.45 0.03 0.00 -1.71 0.00 0.00 66.02 63.65 1h6k s SER 42 CO 0.58 -0.70 1.42 0.00 1.20 0.00 0.00 173.24 175.73 1h6k h ALA 43 N 2.87 0.60 -1.90 5.45 0.00 -2.05 -3.45 119.26 120.77 1h6k h ALA 43 Ca -0.32 -0.72 -0.44 0.00 0.00 0.00 0.00 54.91 53.43 1h6k h ALA 43 Cb 1.21 -0.13 0.04 0.00 0.00 0.00 0.00 17.79 18.91 1h6k h ALA 43 CO 0.43 0.99 -0.09 0.00 0.00 0.00 0.00 179.25 180.59 1h6k s SER 45 N -4.33 5.46 0.14 0.00 1.04 -1.26 -4.89 113.70 109.86 1h6k s SER 45 Ca 0.53 1.77 -0.18 0.00 0.48 0.00 0.00 55.95 58.55 1h6k s SER 45 Cb -0.10 -2.52 0.01 0.00 0.10 0.00 0.00 66.02 63.51 1h6k s SER 45 CO 0.37 -1.39 1.74 0.25 0.98 0.00 0.00 173.24 175.20 1h6k h LEU 46 N -0.14 0.05 -0.56 2.42 5.85 -1.96 -1.72 115.31 119.26 1h6k h LEU 46 Ca -0.45 0.04 0.10 0.00 0.84 0.00 0.00 57.88 58.41 1h6k h LEU 46 Cb 1.22 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 42.21 1h6k h LEU 46 CO 0.56 0.06 0.09 -0.33 -0.34 0.00 0.00 178.44 178.48 1h6k h GLU 47 N 0.18 0.21 -0.11 1.25 3.07 -1.95 0.79 114.58 118.02 1h6k h GLU 47 Ca 0.12 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 59.00 1h6k h GLU 47 Cb 0.11 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 27.95 1h6k h GLU 47 CO -0.15 0.14 -0.05 1.03 -1.40 0.00 0.00 179.01 178.58 1h6k h SER 48 N 0.21 -0.17 -0.24 1.42 0.87 -1.81 -1.29 113.55 112.54 1h6k h SER 48 Ca 0.29 0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.82 1h6k h SER 48 Cb 0.42 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 1h6k h SER 48 CO -0.40 -0.07 -0.08 0.78 -0.53 0.00 0.00 176.83 176.53 1h6k h ASN 49 N -0.04 0.60 0.02 6.23 -0.26 -0.59 0.12 115.58 121.66 1h6k h ASN 49 Ca 0.06 -0.15 -0.00 0.00 -0.56 0.00 0.00 56.30 55.65 1h6k h ASN 49 Cb 0.13 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 37.23 1h6k h ASN 49 CO -0.14 0.72 -0.01 -0.07 -1.06 0.00 0.00 177.43 176.88 1h6k h LEU 50 N 0.57 -0.02 -0.76 1.61 3.38 -0.65 0.20 115.31 119.64 1h6k h LEU 50 Ca 0.11 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1h6k h LEU 50 Cb 0.49 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1h6k h LEU 50 CO 0.03 0.24 0.39 -0.08 0.09 0.00 0.00 178.44 179.11 1h6k h GLU 51 N -0.28 1.08 -0.42 1.13 4.57 -1.07 0.87 114.58 120.46 1h6k h GLU 51 Ca -0.00 -0.14 -0.01 0.00 -1.18 0.00 0.00 59.36 58.03 1h6k h GLU 51 Cb 0.27 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 1h6k h GLU 51 CO 0.00 0.82 0.23 0.78 -1.18 0.00 0.00 179.01 179.67 1h6k h GLY 52 N 1.06 0.63 1.36 1.92 0.00 -0.67 -2.32 103.07 105.06 1h6k h GLY 52 Ca 0.26 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 1h6k h GLY 52 CO -0.04 0.28 -0.04 -2.00 0.00 0.00 0.00 176.54 174.74 1h6k h LEU 53 N 0.55 0.75 -0.60 3.11 5.85 -0.15 -2.32 115.31 122.50 1h6k h LEU 53 Ca 0.15 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.69 1h6k h LEU 53 Cb 0.06 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.85 1h6k h LEU 53 CO -0.02 0.84 0.38 0.00 -0.34 0.00 0.00 178.44 179.29 1h6k h ALA 54 N 1.24 0.77 -0.26 1.25 0.00 -0.61 -0.37 119.26 121.28 1h6k h ALA 54 Ca 0.13 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1h6k h ALA 54 Cb 0.50 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1h6k h ALA 54 CO 0.03 0.13 -0.05 0.78 0.00 0.00 0.00 179.25 180.13 1h6k h GLY 55 N 0.75 0.43 1.01 0.00 0.00 -1.03 -1.07 103.07 103.15 1h6k h GLY 55 Ca 0.23 -0.25 -0.19 0.00 0.00 0.00 0.00 47.33 47.12 1h6k h GLY 55 CO -0.08 0.24 -0.68 -2.08 0.00 0.00 0.00 176.54 173.93 1h6k h VAL 56 N 0.38 1.33 -0.46 4.60 2.07 -0.87 -2.93 116.25 120.37 1h6k h VAL 56 Ca 0.08 -1.96 -0.12 0.00 0.82 0.00 0.00 66.70 65.53 1h6k h VAL 56 Cb 0.34 2.18 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 1h6k h VAL 56 CO 0.01 0.60 -0.18 -0.07 0.02 0.00 0.00 177.57 177.96 1h6k h LEU 57 N 0.28 0.92 -0.17 2.57 3.38 -0.86 -3.02 115.31 118.41 1h6k h LEU 57 Ca -0.06 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.61 1h6k h LEU 57 Cb 1.33 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1h6k h LEU 57 CO 0.14 1.08 0.04 -0.08 0.09 0.00 0.00 178.44 179.71 1h6k h GLU 58 N 0.80 0.10 0.00 1.13 4.81 -1.24 -2.13 114.58 118.05 1h6k h GLU 58 Ca 0.11 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1h6k h GLU 58 Cb 0.72 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1h6k h GLU 58 CO 0.06 0.07 0.03 0.00 -0.73 0.00 0.00 179.01 178.43 1h6k h ALA 59 N 1.12 1.02 -0.25 2.92 0.00 -1.39 -1.29 119.26 121.39 1h6k h ALA 59 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1h6k h ALA 59 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1h6k h ALA 59 CO -0.10 -0.02 0.00 -0.25 0.00 0.00 0.00 179.25 178.88 1h6k n ASP 60 N -2.65 2.71 -0.31 0.00 8.00 -0.83 -4.58 116.55 118.90 1h6k n ASP 60 Ca -0.02 -1.82 -0.02 0.00 0.71 0.00 0.00 54.79 53.64 1h6k n ASP 60 Cb 0.08 -0.17 0.11 0.00 -0.02 0.00 0.00 41.12 41.12 1h6k n ASP 60 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1h6k h LEU 61 N 2.54 0.90 -0.19 0.64 3.38 -0.93 0.26 115.31 121.91 1h6k h LEU 61 Ca 0.00 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1h6k h LEU 61 Cb 0.69 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.17 1h6k h LEU 61 CO 0.00 0.62 -0.28 1.55 0.09 0.00 0.00 178.44 180.42 1h6k h PRO 62 N 1.06 -0.31 -0.23 1.13 0.13 -1.81 -0.28 132.00 131.70 1h6k h PRO 62 Ca 0.34 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.49 1h6k h PRO 62 Cb 0.01 0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.21 1h6k h PRO 62 CO -0.12 -0.21 0.00 0.09 -0.23 0.00 0.00 178.00 177.54 1h6k n ASN 63 N -5.39 2.96 0.00 1.44 4.13 -1.17 -4.56 115.26 112.67 1h6k n ASN 63 Ca -0.02 -1.87 0.00 0.00 1.68 0.00 0.00 54.58 54.37 1h6k n ASN 63 Cb 0.31 -0.14 0.00 0.00 -1.54 0.00 0.00 39.78 38.41 1h6k n ASN 63 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1h6k n TYR 64 N 1.15 0.00 -0.21 3.10 4.01 0.89 -4.94 117.16 121.16 1h6k n TYR 64 Ca 0.14 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.76 1h6k n TYR 64 Cb 0.51 0.01 -0.09 0.00 -0.31 0.00 0.00 39.34 39.45 1h6k n TYR 64 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1h6k h LYS 65 N 0.00 -0.28 -0.59 -0.72 3.64 -1.08 0.22 116.57 117.75 1h6k h LYS 65 Ca 0.00 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.52 1h6k h LYS 65 Cb 0.89 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.74 1h6k h LYS 65 CO 0.00 -0.19 0.41 1.03 -2.27 0.00 0.00 179.45 178.43 1h6k h SER 66 N -0.29 0.24 0.00 4.20 0.87 -1.92 0.60 113.55 117.25 1h6k h SER 66 Ca 0.10 0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 60.53 1h6k h SER 66 Cb 0.55 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.48 1h6k h SER 66 CO -0.68 0.14 -0.56 0.50 -0.53 0.00 0.00 176.83 175.69 1h6k h LYS 67 N 0.26 0.37 -0.80 2.24 1.63 -1.30 -2.96 116.57 116.02 1h6k h LYS 67 Ca 0.28 -0.41 -0.03 0.00 -0.85 0.00 0.00 60.65 59.65 1h6k h LYS 67 Cb 0.76 0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 32.46 1h6k h LYS 67 CO -0.06 1.08 0.40 0.82 -3.45 0.00 0.00 179.45 178.24 1h6k h ILE 68 N -0.17 1.24 0.45 2.00 2.04 0.39 0.18 117.51 123.64 1h6k h ILE 68 Ca -0.07 -0.66 -0.01 0.00 1.00 0.00 0.00 64.86 65.11 1h6k h ILE 68 Cb 1.29 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1h6k h ILE 68 CO 0.11 0.29 -0.36 -0.07 0.00 0.00 0.00 178.15 178.12 1h6k h LEU 69 N 1.13 -0.94 -0.97 1.44 3.38 -0.98 -0.54 115.31 117.82 1h6k h LEU 69 Ca 0.28 0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.38 1h6k h LEU 69 Cb 0.09 0.30 -0.07 0.00 0.09 0.00 0.00 40.66 41.07 1h6k h LEU 69 CO -0.04 -0.52 0.63 -0.09 0.09 0.00 0.00 178.44 178.51 1h6k h ARG 70 N -0.80 1.11 -0.53 1.13 2.43 -1.32 0.98 114.38 117.39 1h6k h ARG 70 Ca -0.04 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.03 1h6k h ARG 70 Cb 0.69 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.96 1h6k h ARG 70 CO -0.01 0.74 0.21 -0.07 -1.51 0.00 0.00 179.97 179.32 1h6k h LEU 71 N 1.14 0.73 -0.42 3.80 3.38 -0.68 -0.62 115.31 122.64 1h6k h LEU 71 Ca 0.42 -0.17 -0.16 0.00 0.09 0.00 0.00 57.88 58.05 1h6k h LEU 71 Cb 0.15 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1h6k h LEU 71 CO -0.17 0.70 -0.44 -0.07 0.09 0.00 0.00 178.44 178.56 1h6k h LEU 72 N 0.71 0.91 -1.72 1.67 3.38 -0.51 -2.42 115.31 117.33 1h6k h LEU 72 Ca 0.18 -0.44 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1h6k h LEU 72 Cb 0.20 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1h6k h LEU 72 CO -0.01 1.21 -0.03 0.00 0.09 0.00 0.00 178.44 179.70 1h6k h THR 74 N 0.13 1.35 0.00 0.00 2.02 -0.80 -2.78 112.91 112.84 1h6k h THR 74 Ca 0.03 -1.75 -0.06 0.00 0.77 0.00 0.00 66.41 65.40 1h6k h THR 74 Cb 0.15 2.08 -0.01 0.00 -1.74 0.00 0.00 68.15 68.63 1h6k h THR 74 CO 0.01 0.53 -0.30 -0.37 0.37 0.00 0.00 175.52 175.76 1h6k h VAL 75 N 0.17 0.69 -0.36 3.16 -1.51 -1.27 -0.57 116.25 116.57 1h6k h VAL 75 Ca -0.02 -1.35 -0.10 0.00 -1.23 0.00 0.00 66.70 64.00 1h6k h VAL 75 Cb 1.09 1.88 -0.02 0.00 -2.13 0.00 0.00 31.29 32.11 1h6k h VAL 75 CO 0.10 0.29 -0.17 0.00 -1.23 0.00 0.00 177.57 176.56 1h6k h ALA 76 N 1.70 1.03 0.00 5.19 0.00 -1.38 -0.08 119.26 125.73 1h6k h ALA 76 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1h6k h ALA 76 Cb 0.86 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1h6k h ALA 76 CO 0.04 0.58 -1.28 2.89 0.00 0.00 0.00 179.25 181.48 1h6k n ARG 77 N -4.15 0.50 -0.02 0.00 1.85 -1.05 -4.31 116.66 109.49 1h6k n ARG 77 Ca 0.01 -0.01 0.04 0.00 -1.00 0.00 0.00 57.85 56.89 1h6k n ARG 77 Cb 0.38 -1.66 -0.11 0.00 -1.05 0.00 0.00 32.46 30.03 1h6k n ARG 77 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1h6k n LEU 78 N -2.29 0.00 -2.99 2.89 4.77 -0.25 -4.71 117.00 114.43 1h6k n LEU 78 Ca -0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.71 1h6k n LEU 78 Cb 0.51 0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.62 1h6k n LEU 78 CO 0.42 0.06 0.11 0.18 -1.33 0.00 0.00 177.39 176.83 1h6k n LEU 79 N -2.08 4.13 0.30 2.23 4.32 -0.05 -4.88 117.00 120.97 1h6k n LEU 79 Ca -0.06 -5.62 0.15 0.00 -0.02 0.00 0.00 56.01 50.46 1h6k n LEU 79 Cb 0.47 -0.45 0.91 0.00 -1.62 0.00 0.00 43.42 42.73 1h6k n LEU 79 CO 0.29 2.34 1.12 1.55 -1.22 0.00 0.00 177.39 181.47 1h6k h PRO 80 N 3.05 0.00 0.00 3.23 0.13 -1.81 -0.36 132.00 136.24 1h6k h PRO 80 Ca 0.13 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.25 1h6k h PRO 80 Cb 0.55 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.68 1h6k h PRO 80 CO 0.79 0.00 -0.04 1.05 -0.23 0.00 0.00 178.00 179.58 1h6k h GLU 81 N 0.00 0.00 -0.49 0.86 9.09 -1.90 -2.02 114.58 120.12 1h6k h GLU 81 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1h6k h GLU 81 Cb 0.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.11 1h6k h GLU 81 CO 0.00 0.04 0.00 1.63 0.05 0.00 0.00 179.01 180.73 1h6k n LYS 82 N -3.25 3.28 -0.32 1.06 5.02 -0.15 -4.81 118.16 118.99 1h6k n LYS 82 Ca -0.01 -2.64 -0.07 0.00 -2.02 0.00 0.00 58.31 53.57 1h6k n LYS 82 Cb 0.22 -1.69 -0.05 0.00 -0.02 0.00 0.00 35.03 33.48 1h6k n LYS 82 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1h6k n LEU 83 N 0.66 -0.75 0.20 -0.35 7.94 -0.76 -1.36 117.00 122.58 1h6k n LEU 83 Ca 0.21 1.38 0.14 0.00 -1.11 0.00 0.00 56.01 56.63 1h6k n LEU 83 Cb 0.75 -0.21 0.51 0.00 0.53 0.00 0.00 43.42 45.00 1h6k n LEU 83 CO 0.17 -1.15 0.91 0.71 -1.11 0.00 0.00 177.39 176.92 1h6k h THR 84 N 0.00 0.00 -0.06 1.96 1.35 -1.86 -1.06 112.91 113.23 1h6k h THR 84 Ca 0.16 -0.49 -0.09 0.00 -0.55 0.00 0.00 66.41 65.44 1h6k h THR 84 Cb 0.35 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 1h6k h THR 84 CO -0.74 0.00 -0.30 0.40 -0.25 0.00 0.00 175.52 174.63 1h6k h ILE 85 N 0.00 1.43 -0.17 6.82 2.04 -1.55 -2.98 117.51 123.11 1h6k h ILE 85 Ca 0.00 -1.72 -0.17 0.00 1.00 0.00 0.00 64.86 63.97 1h6k h ILE 85 Cb 0.57 2.35 -0.00 0.00 -0.74 0.00 0.00 36.82 38.99 1h6k h ILE 85 CO 0.00 0.49 -0.62 1.88 0.00 0.00 0.00 178.15 179.91 1h6k h TYR 86 N -0.19 0.74 -0.72 1.37 0.05 -1.08 -2.14 116.97 115.00 1h6k h TYR 86 Ca -0.02 -0.28 -0.04 0.00 0.05 0.00 0.00 58.73 58.44 1h6k h TYR 86 Cb 0.95 -0.13 -0.03 0.00 1.01 0.00 0.00 36.73 38.53 1h6k h TYR 86 CO 0.13 1.04 0.30 1.79 -1.05 0.00 0.00 178.16 180.37 1h6k h THR 87 N 0.43 1.24 -0.49 -2.88 1.35 -1.33 -0.68 112.91 110.55 1h6k h THR 87 Ca -0.01 -0.75 -0.00 0.00 -0.55 0.00 0.00 66.41 65.10 1h6k h THR 87 Cb 1.18 0.36 -0.02 0.00 -1.73 0.00 0.00 68.15 67.94 1h6k h THR 87 CO 0.12 0.30 0.30 0.74 -0.25 0.00 0.00 175.52 176.73 1h6k h THR 88 N 1.04 1.15 -0.18 6.82 2.02 -1.34 0.16 112.91 122.59 1h6k h THR 88 Ca 0.24 -0.35 0.02 0.00 0.77 0.00 0.00 66.41 67.09 1h6k h THR 88 Cb 0.18 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 1h6k h THR 88 CO -0.02 0.16 0.07 0.25 0.37 0.00 0.00 175.52 176.34 1h6k h LEU 89 N 0.66 0.08 -1.28 2.58 5.85 -0.91 0.18 115.31 122.47 1h6k h LEU 89 Ca 0.18 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 1h6k h LEU 89 Cb -0.01 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1h6k h LEU 89 CO -0.03 0.07 0.40 0.58 -0.34 0.00 0.00 178.44 179.12 1h6k h VAL 90 N 0.16 1.18 -0.44 1.05 2.07 -0.80 -0.15 116.25 119.31 1h6k h VAL 90 Ca 0.07 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 1h6k h VAL 90 Cb 0.04 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1h6k h VAL 90 CO -0.07 0.19 0.18 1.23 0.02 0.00 0.00 177.57 179.12 1h6k h GLY 91 N 0.93 0.71 1.14 2.17 0.00 0.21 0.16 103.07 108.40 1h6k h GLY 91 Ca 0.24 -0.38 -0.10 0.00 0.00 0.00 0.00 47.33 47.08 1h6k h GLY 91 CO -0.05 0.36 -0.05 1.41 0.00 0.00 0.00 176.54 178.22 1h6k h LEU 92 N 0.57 1.00 -0.27 3.11 3.38 -0.44 -1.21 115.31 121.45 1h6k h LEU 92 Ca 0.15 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1h6k h LEU 92 Cb 0.19 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1h6k h LEU 92 CO -0.01 1.08 0.10 -0.07 0.09 0.00 0.00 178.44 179.63 1h6k h LEU 93 N 0.92 0.38 -1.29 1.67 4.07 -0.78 -2.46 115.31 117.81 1h6k h LEU 93 Ca 0.15 -0.17 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 1h6k h LEU 93 Cb 0.60 -0.10 -0.03 0.00 1.08 0.00 0.00 40.66 42.22 1h6k h LEU 93 CO 0.04 0.44 0.27 -1.13 -1.08 0.00 0.00 178.44 176.98 1h6k h ASN 94 N 0.28 0.68 0.39 -0.43 -1.24 -0.49 0.13 115.58 114.91 1h6k h ASN 94 Ca 0.09 -0.06 -0.05 0.00 0.71 0.00 0.00 56.30 57.00 1h6k h ASN 94 Cb 0.19 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 1h6k h ASN 94 CO -0.01 0.57 -0.22 0.00 -1.29 0.00 0.00 177.43 176.49 1h6k h ALA 95 N 1.54 1.35 0.12 1.57 0.00 -0.93 -2.65 119.26 120.26 1h6k h ALA 95 Ca 0.19 -0.20 -0.32 0.00 0.00 0.00 0.00 54.91 54.58 1h6k h ALA 95 Cb 0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1h6k h ALA 95 CO -0.03 0.27 -1.68 0.00 0.00 0.00 0.00 179.25 177.82 1h6k h ARG 96 N 0.00 0.25 -2.58 0.00 3.08 -0.76 -3.44 114.38 110.92 1h6k h ARG 96 Ca -0.00 -0.43 -0.48 0.00 0.07 0.00 0.00 59.98 59.14 1h6k h ARG 96 Cb 0.47 0.16 -0.38 0.00 0.08 0.00 0.00 29.97 30.30 1h6k h ARG 96 CO 0.03 1.10 -0.75 1.21 -1.07 0.00 0.00 179.97 180.49 1h6k s ASN 97 N -6.94 2.95 0.19 7.04 3.84 0.35 -5.03 114.94 117.33 1h6k s ASN 97 Ca -0.12 -1.24 -0.12 0.00 0.21 0.00 0.00 52.86 51.59 1h6k s ASN 97 Cb 0.07 -0.11 0.10 0.00 -0.55 0.00 0.00 41.25 40.76 1h6k s ASN 97 CO 0.83 -0.41 1.84 0.22 -2.79 0.00 0.00 177.10 176.79 1h6k h TYR 98 N 8.22 0.80 -0.47 0.43 3.20 -1.74 -2.80 116.97 124.61 1h6k h TYR 98 Ca -0.15 0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.77 1h6k h TYR 98 Cb 1.02 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.98 1h6k h TYR 98 CO 0.30 0.52 0.22 -0.91 -1.64 0.00 0.00 178.16 176.66 1h6k h ASN 99 N 0.84 0.30 -0.73 -2.11 4.21 -1.96 -1.90 115.58 114.23 1h6k h ASN 99 Ca 0.23 0.03 0.07 0.00 1.21 0.00 0.00 56.30 57.84 1h6k h ASN 99 Cb -0.06 -0.02 -0.06 0.00 -1.12 0.00 0.00 38.32 37.06 1h6k h ASN 99 CO -0.05 0.21 0.41 0.15 -1.29 0.00 0.00 177.43 176.86 1h6k h PHE 100 N 0.44 0.74 -0.84 1.19 3.57 -1.88 -1.15 116.94 119.02 1h6k h PHE 100 Ca 0.21 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.73 1h6k h PHE 100 Cb 0.15 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 1h6k h PHE 100 CO -0.12 0.33 0.49 0.78 -2.23 0.00 0.00 178.31 177.57 1h6k h GLY 101 N 0.72 1.22 1.08 2.40 0.00 -1.18 0.16 103.07 107.47 1h6k h GLY 101 Ca 0.34 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 1h6k h GLY 101 CO -0.21 0.50 0.30 -1.33 0.00 0.00 0.00 176.54 175.79 1h6k h GLY 102 N 1.17 1.25 1.92 4.60 0.00 -0.51 -0.39 103.07 111.11 1h6k h GLY 102 Ca 0.30 -0.69 -0.13 0.00 0.00 0.00 0.00 47.33 46.81 1h6k h GLY 102 CO -0.05 0.65 -0.58 0.83 0.00 0.00 0.00 176.54 177.38 1h6k h GLU 103 N 1.13 0.08 0.24 4.80 5.08 -0.32 -0.93 114.58 124.66 1h6k h GLU 103 Ca 0.26 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1h6k h GLU 103 Cb 0.23 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1h6k h GLU 103 CO -0.02 0.64 -0.11 0.35 -1.00 0.00 0.00 179.01 178.87 1h6k h PHE 104 N 0.06 -0.30 -1.01 4.33 3.57 -0.17 0.35 116.94 123.78 1h6k h PHE 104 Ca -0.01 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 1h6k h PHE 104 Cb 1.05 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.82 1h6k h PHE 104 CO 0.01 0.05 0.66 0.28 -2.23 0.00 0.00 178.31 177.07 1h6k h VAL 105 N -0.68 1.13 -0.17 1.41 2.07 -1.03 0.27 116.25 119.25 1h6k h VAL 105 Ca -0.03 -0.42 0.01 0.00 0.82 0.00 0.00 66.70 67.07 1h6k h VAL 105 Cb 0.48 -0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 1h6k h VAL 105 CO 0.05 0.22 0.09 -0.08 0.02 0.00 0.00 177.57 177.88 1h6k h GLU 106 N 1.23 0.18 0.00 1.57 4.81 -1.14 -2.01 114.58 119.22 1h6k h GLU 106 Ca 0.42 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.59 1h6k h GLU 106 Cb 0.08 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 1h6k h GLU 106 CO -0.15 0.12 -0.21 0.00 -0.73 0.00 0.00 179.01 178.04 1h6k h ALA 107 N 1.08 1.24 -0.12 2.92 0.00 0.82 -2.46 119.26 122.76 1h6k h ALA 107 Ca 0.07 -0.19 -0.23 0.00 0.00 0.00 0.00 54.91 54.56 1h6k h ALA 107 Cb 0.01 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1h6k h ALA 107 CO -0.04 0.26 -0.83 0.52 0.00 0.00 0.00 179.25 179.16 1h6k h MET 108 N 0.00 0.73 -0.85 0.00 2.86 -0.14 -1.57 114.93 115.96 1h6k h MET 108 Ca -0.00 -0.63 -0.03 0.00 -2.06 0.00 0.00 59.70 56.98 1h6k h MET 108 Cb 0.52 0.14 -0.04 0.00 0.06 0.00 0.00 31.60 32.28 1h6k h MET 108 CO 0.03 1.24 0.43 0.82 1.06 0.00 0.00 176.91 180.48 1h6k h ILE 109 N 0.48 1.26 -0.20 -1.22 1.08 -1.11 -0.22 117.51 117.58 1h6k h ILE 109 Ca -0.06 -0.70 -0.01 0.00 -0.39 0.00 0.00 64.86 63.70 1h6k h ILE 109 Cb 1.45 0.15 -0.01 0.00 -3.07 0.00 0.00 36.82 35.34 1h6k h ILE 109 CO 0.17 0.30 0.09 0.03 -0.69 0.00 0.00 178.15 178.05 1h6k h ARG 110 N 1.21 0.29 -0.77 2.37 3.08 -1.36 -1.81 114.38 117.39 1h6k h ARG 110 Ca 0.29 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.28 1h6k h ARG 110 Cb 0.09 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 1h6k h ARG 110 CO -0.04 0.33 0.40 0.37 -1.07 0.00 0.00 179.97 179.96 1h6k h GLN 111 N 0.18 1.08 -0.14 0.04 5.75 -0.94 -1.47 115.11 119.61 1h6k h GLN 111 Ca 0.07 -0.13 -0.00 0.00 -0.15 0.00 0.00 58.65 58.43 1h6k h GLN 111 Cb 0.14 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 1h6k h GLN 111 CO -0.01 0.81 0.08 1.25 -2.65 0.00 0.00 178.83 178.31 1h6k h LEU 112 N 1.08 0.17 -0.80 -2.39 5.85 -0.80 0.36 115.31 118.79 1h6k h LEU 112 Ca 0.27 -0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.97 1h6k h LEU 112 Cb 0.06 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 40.99 1h6k h LEU 112 CO -0.04 0.20 0.48 0.11 -0.34 0.00 0.00 178.44 178.85 1h6k h LYS 113 N 0.13 0.85 -0.31 1.25 1.57 -1.04 -0.55 116.57 118.48 1h6k h LYS 113 Ca 0.05 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 1h6k h LYS 113 Cb 0.06 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.18 1h6k h LYS 113 CO -0.01 0.56 -0.37 0.93 -0.57 0.00 0.00 179.45 180.00 1h6k h GLU 114 N 0.87 0.79 -0.74 3.15 3.07 -0.74 -1.08 114.58 119.91 1h6k h GLU 114 Ca 0.35 -0.44 -0.03 0.00 -0.50 0.00 0.00 59.36 58.74 1h6k h GLU 114 Cb 0.19 0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.09 1h6k h GLU 114 CO -0.18 1.07 0.35 0.77 -1.40 0.00 0.00 179.01 179.62 1h6k h SER 115 N 0.56 0.97 -0.31 1.42 0.02 0.05 -0.63 113.55 115.63 1h6k h SER 115 Ca 0.04 -0.14 -0.05 0.00 -0.84 0.00 0.00 61.79 60.80 1h6k h SER 115 Cb 0.96 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.23 1h6k h SER 115 CO 0.09 0.83 0.02 -0.07 -1.14 0.00 0.00 176.83 176.56 1h6k h LEU 116 N 1.04 0.59 -0.43 5.07 3.38 -0.98 0.27 115.31 124.25 1h6k h LEU 116 Ca 0.25 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 1h6k h LEU 116 Cb 0.13 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1h6k h LEU 116 CO -0.03 0.65 -0.04 0.50 0.09 0.00 0.00 178.44 179.61 1h6k h LYS 117 N 0.60 0.79 -0.69 1.13 1.63 -0.33 -2.70 116.57 117.01 1h6k h LYS 117 Ca 0.13 -0.27 0.00 0.00 -0.85 0.00 0.00 60.65 59.66 1h6k h LYS 117 Cb 0.35 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 31.92 1h6k h LYS 117 CO 0.01 0.88 0.00 0.00 -3.45 0.00 0.00 179.45 176.89 1h6k n ALA 118 N -2.43 2.60 -2.35 5.00 0.00 -0.33 -4.86 120.51 118.14 1h6k n ALA 118 Ca -0.00 -0.19 -0.16 0.00 0.00 0.00 0.00 53.44 53.09 1h6k n ALA 118 Cb 0.33 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.76 1h6k n ALA 118 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1h6k n ASN 119 N -0.03 -4.67 -3.77 0.00 3.02 -1.02 -4.88 115.26 103.91 1h6k n ASN 119 Ca 0.03 0.13 -0.42 0.00 -0.03 0.00 0.00 54.58 54.29 1h6k n ASN 119 Cb 0.27 -3.95 0.01 0.00 -0.61 0.00 0.00 39.78 35.50 1h6k n ASN 119 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1h6k n ASN 120 N -1.81 6.83 0.26 6.41 3.02 0.06 -4.74 115.26 125.30 1h6k n ASN 120 Ca -0.19 -3.42 0.10 0.00 -0.03 0.00 0.00 54.58 51.05 1h6k n ASN 120 Cb 0.63 -1.28 0.70 0.00 -0.61 0.00 0.00 39.78 39.22 1h6k n ASN 120 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1h6k h TYR 121 N 4.92 0.00 -0.20 3.10 0.05 -1.89 -1.53 116.97 121.41 1h6k h TYR 121 Ca 0.43 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 59.19 1h6k h TYR 121 Cb 0.46 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.19 1h6k h TYR 121 CO 1.26 0.09 0.05 -0.91 -1.05 0.00 0.00 178.16 177.60 1h6k h ASN 122 N 0.00 0.30 0.01 3.88 4.21 -1.95 -1.96 115.58 120.07 1h6k h ASN 122 Ca -0.00 -0.23 -0.09 0.00 1.21 0.00 0.00 56.30 57.19 1h6k h ASN 122 Cb 0.19 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.30 1h6k h ASN 122 CO 0.01 0.45 -0.28 -0.33 -1.29 0.00 0.00 177.43 176.00 1h6k h GLU 123 N 0.14 0.42 -0.82 0.81 5.08 -1.73 -2.98 114.58 115.50 1h6k h GLU 123 Ca 0.06 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1h6k h GLU 123 Cb 0.27 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 1h6k h GLU 123 CO 0.00 0.66 0.41 0.00 -1.00 0.00 0.00 179.01 179.08 1h6k h ALA 124 N 1.34 1.18 -0.62 3.43 0.00 -0.98 -1.67 119.26 121.95 1h6k h ALA 124 Ca 0.05 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.87 1h6k h ALA 124 Cb 0.68 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1h6k h ALA 124 CO 0.05 0.63 0.33 0.28 0.00 0.00 0.00 179.25 180.54 1h6k h VAL 125 N 1.16 0.95 -0.60 0.00 2.07 -1.20 -0.42 116.25 118.21 1h6k h VAL 125 Ca 0.28 -0.21 -0.06 0.00 0.82 0.00 0.00 66.70 67.53 1h6k h VAL 125 Cb 0.08 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 1h6k h VAL 125 CO -0.04 0.11 0.13 1.88 0.02 0.00 0.00 177.57 179.67 1h6k h TYR 126 N 0.61 0.98 -0.56 1.57 0.05 -1.35 -0.59 116.97 117.67 1h6k h TYR 126 Ca 0.28 -0.11 -0.07 0.00 0.05 0.00 0.00 58.73 58.88 1h6k h TYR 126 Cb 0.19 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 1h6k h TYR 126 CO -0.09 0.82 0.07 -0.07 -1.05 0.00 0.00 178.16 177.84 1h6k h LEU 127 N 0.90 0.87 -0.49 3.88 3.38 -0.75 0.71 115.31 123.81 1h6k h LEU 127 Ca 0.19 -0.19 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1h6k h LEU 127 Cb 0.35 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1h6k h LEU 127 CO 0.00 0.88 -0.28 0.58 0.09 0.00 0.00 178.44 179.72 1h6k h VAL 128 N 0.86 1.27 -0.70 1.22 2.07 -0.59 -1.50 116.25 118.88 1h6k h VAL 128 Ca 0.17 -1.44 -0.06 0.00 0.82 0.00 0.00 66.70 66.19 1h6k h VAL 128 Cb 0.40 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 1h6k h VAL 128 CO 0.01 0.49 0.21 -0.09 0.02 0.00 0.00 177.57 178.21 1h6k h ARG 129 N 0.81 1.09 -0.08 1.57 2.43 -0.79 0.81 114.38 120.23 1h6k h ARG 129 Ca 0.09 -0.23 -0.01 0.00 -0.81 0.00 0.00 59.98 59.02 1h6k h ARG 129 Cb 0.85 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.24 1h6k h ARG 129 CO 0.08 0.94 0.02 0.35 -1.51 0.00 0.00 179.97 179.85 1h6k h PHE 130 N 1.05 0.12 -1.01 2.20 3.04 -0.61 0.25 116.94 121.98 1h6k h PHE 130 Ca 0.23 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.20 1h6k h PHE 130 Cb 0.31 -0.04 -0.06 0.00 2.56 0.00 0.00 35.95 38.72 1h6k h PHE 130 CO 0.02 0.28 0.66 -0.07 -2.02 0.00 0.00 178.31 177.18 1h6k h LEU 131 N -0.07 1.11 0.23 0.59 3.38 -1.10 -0.84 115.31 118.61 1h6k h LEU 131 Ca 0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1h6k h LEU 131 Cb 0.21 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1h6k h LEU 131 CO -0.00 0.76 -0.11 0.28 0.09 0.00 0.00 178.44 179.46 1h6k h SER 132 N 1.28 -0.27 0.86 -0.43 0.02 -0.34 -2.74 113.55 111.94 1h6k h SER 132 Ca 0.40 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.33 1h6k h SER 132 Cb -0.01 0.07 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 1h6k h SER 132 CO -0.12 -0.16 -0.03 -0.78 -1.14 0.00 0.00 176.83 174.59 1h6k h ASP 133 N -0.35 0.00 0.30 3.07 3.58 -0.62 -1.41 116.42 120.99 1h6k h ASP 133 Ca -0.03 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.39 1h6k h ASP 133 Cb 0.27 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.31 1h6k h ASP 133 CO 0.05 0.03 -0.11 -0.07 -2.88 0.00 0.00 179.24 176.26 1h6k h LEU 134 N 0.00 0.00 -0.50 2.28 3.38 -0.84 -0.97 115.31 118.66 1h6k h LEU 134 Ca -0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1h6k h LEU 134 Cb 0.47 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1h6k h LEU 134 CO 0.00 0.11 0.32 0.58 0.09 0.00 0.00 178.44 179.55 1h6k h VAL 135 N 0.00 1.09 0.00 1.22 2.07 -1.23 -1.38 116.25 118.03 1h6k h VAL 135 Ca -0.00 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1h6k h VAL 135 Cb 0.29 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1h6k h VAL 135 CO 0.01 0.12 -0.11 0.78 0.02 0.00 0.00 177.57 178.39 1h6k h ASN 136 N 0.65 0.00 -0.02 0.57 2.35 -1.31 0.96 115.58 118.77 1h6k h ASN 136 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1h6k h ASN 136 Cb -0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.34 1h6k h ASN 136 CO -0.06 0.11 0.00 0.00 -1.65 0.00 0.00 177.43 175.83 1h6k n HIS 138 N -0.01 -1.47 -0.04 0.00 8.25 0.33 -4.63 115.22 117.65 1h6k n HIS 138 Ca 0.20 0.26 -0.12 0.00 -0.26 0.00 0.00 57.72 57.79 1h6k n HIS 138 Cb 0.31 -4.22 -0.14 0.00 1.12 0.00 0.00 29.99 27.05 1h6k n HIS 138 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1h6k n VAL 139 N -4.27 1.58 -5.08 1.59 0.31 -0.63 -2.89 118.33 108.95 1h6k n VAL 139 Ca -0.18 -0.77 -0.30 0.00 -0.01 0.00 0.00 64.34 63.09 1h6k n VAL 139 Cb 0.65 -1.07 -0.16 0.00 -0.91 0.00 0.00 33.84 32.35 1h6k n VAL 139 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1h6k s ILE 140 N -2.56 1.80 0.30 2.52 1.01 -1.19 -0.24 121.20 122.84 1h6k s ILE 140 Ca -0.12 -0.91 -0.29 0.00 0.00 0.00 0.00 60.65 59.34 1h6k s ILE 140 Cb 0.07 -1.55 -0.10 0.00 0.01 0.00 0.00 42.46 40.90 1h6k s ILE 140 CO 0.80 0.51 1.22 0.00 0.00 0.00 0.00 174.94 177.46 1h6k s ALA 141 N 0.09 3.46 0.24 9.38 0.00 -0.37 -4.09 121.76 130.47 1h6k s ALA 141 Ca -0.08 1.10 -0.05 0.00 0.00 0.00 0.00 51.96 52.92 1h6k s ALA 141 Cb -0.14 -3.42 0.37 0.00 0.00 0.00 0.00 23.12 19.93 1h6k s ALA 141 CO 0.05 -0.44 1.81 0.00 0.00 0.00 0.00 175.76 177.18 1h6k h ALA 142 N 3.67 1.12 0.00 0.00 0.00 -1.91 -1.35 119.26 120.78 1h6k h ALA 142 Ca -0.48 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 1h6k h ALA 142 Cb 1.22 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1h6k h ALA 142 CO 0.67 0.09 -0.02 -1.35 0.00 0.00 0.00 179.25 178.63 1h6k h PRO 143 N 0.77 0.00 -0.68 0.00 0.11 -1.97 -1.63 132.00 128.59 1h6k h PRO 143 Ca 0.38 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.46 1h6k h PRO 143 Cb 0.33 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.41 1h6k h PRO 143 CO -0.24 0.02 0.31 0.77 -0.21 0.00 0.00 178.00 178.65 1h6k h SER 144 N 0.00 0.91 0.50 -2.05 0.02 -1.61 -0.03 113.55 111.29 1h6k h SER 144 Ca -0.00 -0.15 -0.19 0.00 -0.84 0.00 0.00 61.79 60.61 1h6k h SER 144 Cb 0.05 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1h6k h SER 144 CO 0.00 0.80 -0.84 0.24 -1.14 0.00 0.00 176.83 175.90 1h6k h MET 145 N 0.96 0.25 -0.53 3.45 2.86 -1.39 -1.26 114.93 119.26 1h6k h MET 145 Ca 0.23 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1h6k h MET 145 Cb 0.15 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.85 1h6k h MET 145 CO -0.03 0.95 0.30 0.28 1.06 0.00 0.00 176.91 179.47 1h6k h VAL 146 N 0.15 1.18 -0.28 -2.22 2.07 -1.10 0.69 116.25 116.73 1h6k h VAL 146 Ca -0.04 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1h6k h VAL 146 Cb 1.45 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1h6k h VAL 146 CO 0.13 0.19 0.14 0.00 0.02 0.00 0.00 177.57 178.05 1h6k h ALA 147 N 1.13 0.36 -0.83 1.67 0.00 -0.91 -0.14 119.26 120.55 1h6k h ALA 147 Ca 0.19 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.03 1h6k h ALA 147 Cb 0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1h6k h ALA 147 CO -0.03 -0.08 0.54 1.98 0.00 0.00 0.00 179.25 181.66 1h6k h MET 148 N 0.32 1.05 0.00 0.00 -1.53 -0.84 -1.64 114.93 112.30 1h6k h MET 148 Ca 0.10 -0.06 -0.12 0.00 -3.44 0.00 0.00 59.70 56.18 1h6k h MET 148 Cb 0.11 -0.24 -0.02 0.00 -0.55 0.00 0.00 31.60 30.90 1h6k h MET 148 CO -0.01 0.70 -0.56 0.74 0.14 0.00 0.00 176.91 177.92 1h6k h PHE 149 N 1.09 0.00 -0.69 1.39 0.04 -0.63 -0.58 116.94 117.55 1h6k h PHE 149 Ca 0.32 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.05 1h6k h PHE 149 Cb -0.07 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.05 1h6k h PHE 149 CO -0.02 0.56 0.30 0.93 -0.60 0.00 0.00 178.31 179.47 1h6k h GLU 150 N 0.00 1.02 -0.63 1.51 5.08 -0.34 -1.39 114.58 119.83 1h6k h GLU 150 Ca -0.01 -0.17 -0.09 0.00 -1.00 0.00 0.00 59.36 58.09 1h6k h GLU 150 Cb 1.01 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1h6k h GLU 150 CO 0.07 0.83 0.05 -0.91 -1.00 0.00 0.00 179.01 178.05 1h6k h ASN 151 N 0.97 1.06 -0.54 1.42 2.35 -0.72 -1.87 115.58 118.25 1h6k h ASN 151 Ca 0.23 -0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1h6k h ASN 151 Cb 0.18 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 1h6k h ASN 151 CO -0.02 1.08 0.35 -0.26 -1.65 0.00 0.00 177.43 176.93 1h6k h PHE 152 N 1.00 0.68 0.00 1.19 -1.00 -0.84 -2.65 116.94 115.31 1h6k h PHE 152 Ca 0.19 0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.91 1h6k h PHE 152 Cb 0.51 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 39.83 1h6k h PHE 152 CO 0.04 0.44 -0.33 0.28 -1.61 0.00 0.00 178.31 177.13 1h6k h VAL 153 N 0.73 0.86 0.00 -0.55 2.07 -1.08 -1.76 116.25 116.52 1h6k h VAL 153 Ca 0.20 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.39 1h6k h VAL 153 Cb -0.06 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1h6k h VAL 153 CO -0.04 0.32 0.00 0.77 0.02 0.00 0.00 177.57 178.64 1h6k h SER 154 N 0.00 0.00 -0.12 0.57 4.64 -0.97 -1.88 113.55 115.79 1h6k h SER 154 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h6k h SER 154 Cb 0.78 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1h6k h SER 154 CO 0.04 0.00 0.08 0.58 -0.87 0.00 0.00 176.83 176.66 1h6k h VAL 155 N 0.00 1.02 0.00 0.95 2.07 -1.26 0.21 116.25 119.24 1h6k h VAL 155 Ca 0.00 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1h6k h VAL 155 Cb 0.34 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1h6k h VAL 155 CO 0.00 0.03 0.00 0.35 0.02 0.00 0.00 177.57 177.97 1h6k n THR 156 N -4.52 0.56 0.87 2.57 -2.24 -0.70 -1.72 114.28 109.09 1h6k n THR 156 Ca -0.01 0.14 0.09 0.00 -2.27 0.00 0.00 64.05 62.00 1h6k n THR 156 Cb 0.09 -0.82 -0.04 0.00 -2.10 0.00 0.00 70.33 67.46 1h6k n THR 156 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1h6k n GLN 157 N -1.37 1.27 -1.32 -0.78 -0.06 0.71 -4.97 117.38 110.85 1h6k n GLN 157 Ca 0.07 -0.63 -0.34 0.00 -2.00 0.00 0.00 57.00 54.11 1h6k n GLN 157 Cb 0.18 -1.38 0.10 0.00 -4.06 0.00 0.00 30.24 25.08 1h6k n GLN 157 CO 0.00 0.00 0.00 -1.21 -0.20 0.00 0.00 177.06 175.65 1h6k s GLU 158 N -2.38 1.99 -0.06 3.69 2.02 -0.70 -5.00 118.70 118.25 1h6k s GLU 158 Ca 0.13 1.70 -0.02 0.00 0.02 0.00 0.00 54.97 56.80 1h6k s GLU 158 Cb 0.15 -1.82 -0.04 0.00 0.10 0.00 0.00 34.13 32.52 1h6k s GLU 158 CO 0.58 -1.94 0.04 -1.21 0.02 0.00 0.00 175.26 172.75 1h6k s GLU 159 N -4.06 3.05 -1.28 1.61 2.02 -1.26 -4.65 118.70 114.12 1h6k s GLU 159 Ca 0.73 -0.41 -0.02 0.00 0.02 0.00 0.00 54.97 55.29 1h6k s GLU 159 Cb -0.28 -2.86 -0.00 0.00 0.10 0.00 0.00 34.13 31.09 1h6k s GLU 159 CO 0.48 0.69 0.70 -0.25 0.02 0.00 0.00 175.26 176.90 1h6k n ASP 160 N 1.80 -1.78 -4.29 -0.19 8.00 -1.26 -5.01 116.55 113.81 1h6k n ASP 160 Ca -0.17 -0.85 -0.20 0.00 0.71 0.00 0.00 54.79 54.29 1h6k n ASP 160 Cb 0.53 -3.99 -0.11 0.00 -0.02 0.00 0.00 41.12 37.54 1h6k n ASP 160 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1h6k s VAL 161 N -3.66 1.56 0.41 2.53 -7.23 -1.26 -5.12 120.40 107.63 1h6k s VAL 161 Ca 0.07 -1.84 -0.27 0.00 -1.81 0.00 0.00 61.98 58.13 1h6k s VAL 161 Cb -0.02 -1.71 -0.10 0.00 0.56 0.00 0.00 36.38 35.12 1h6k s VAL 161 CO 0.82 -0.39 1.43 -2.84 -0.31 0.00 0.00 175.10 173.81 1h6k s PRO 162 N -2.81 3.93 0.34 4.82 0.02 -1.26 -4.89 135.00 135.15 1h6k s PRO 162 Ca 0.13 2.44 0.04 0.00 0.02 0.00 0.00 61.00 63.63 1h6k s PRO 162 Cb -0.05 -2.82 0.66 0.00 0.02 0.00 0.00 34.50 32.31 1h6k s PRO 162 CO 0.05 -0.63 1.95 0.37 -0.33 0.00 0.00 177.00 178.41 1h6k h GLN 163 N 2.71 0.83 0.00 5.54 4.15 -1.65 -0.71 115.11 125.98 1h6k h GLN 163 Ca -0.51 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 58.86 1h6k h GLN 163 Cb 1.25 -0.19 -0.00 0.00 0.21 0.00 0.00 27.48 28.75 1h6k h GLN 163 CO 0.63 0.55 -0.02 -0.39 -1.93 0.00 0.00 178.83 177.67 1h6k h VAL 164 N 0.85 0.39 0.00 2.39 -1.51 -1.62 0.33 116.25 117.08 1h6k h VAL 164 Ca 0.33 -0.09 -0.00 0.00 -1.23 0.00 0.00 66.70 65.71 1h6k h VAL 164 Cb 0.20 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 30.43 1h6k h VAL 164 CO -0.11 0.02 -0.00 -0.09 -1.23 0.00 0.00 177.57 176.16 1h6k h ARG 165 N 0.00 -0.00 -0.86 5.19 2.43 -1.42 -2.56 114.38 117.17 1h6k h ARG 165 Ca -0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1h6k h ARG 165 Cb 0.06 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.57 1h6k h ARG 165 CO 0.00 0.71 0.45 0.00 -1.51 0.00 0.00 179.97 179.63 1h6k h ARG 166 N -0.72 1.21 -0.38 0.20 3.08 -1.13 -2.70 114.38 113.95 1h6k h ARG 166 Ca -0.00 -0.15 0.06 0.00 0.07 0.00 0.00 59.98 59.95 1h6k h ARG 166 Cb 0.72 -0.23 -0.05 0.00 0.08 0.00 0.00 29.97 30.48 1h6k h ARG 166 CO 0.00 0.90 0.07 -0.44 -1.07 0.00 0.00 179.97 179.43 1h6k h ASP 167 N 1.20 0.00 -0.17 7.04 3.32 -0.42 -2.40 116.42 124.99 1h6k h ASP 167 Ca 0.30 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.41 1h6k h ASP 167 Cb 0.06 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1h6k h ASP 167 CO -0.05 0.04 0.11 -0.25 -1.72 0.00 0.00 179.24 177.37 1h6k h TRP 168 N 0.19 0.23 -0.48 4.55 7.01 -1.12 0.14 115.95 126.47 1h6k h TRP 168 Ca 0.18 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.18 1h6k h TRP 168 Cb 0.21 -0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 27.17 1h6k h TRP 168 CO -0.20 0.17 0.28 1.88 -2.79 0.00 0.00 178.44 177.78 1h6k h TYR 169 N 0.21 0.63 -0.28 2.65 0.05 -1.44 0.88 116.97 119.69 1h6k h TYR 169 Ca 0.06 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.67 1h6k h TYR 169 Cb 0.01 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 37.54 1h6k h TYR 169 CO -0.06 0.44 -0.53 0.28 -1.05 0.00 0.00 178.16 177.24 1h6k h VAL 170 N 0.67 1.28 -0.22 -2.88 2.07 -0.89 -2.62 116.25 113.65 1h6k h VAL 170 Ca 0.17 -1.72 -0.02 0.00 0.82 0.00 0.00 66.70 65.95 1h6k h VAL 170 Cb -0.00 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1h6k h VAL 170 CO -0.03 0.56 0.06 0.22 0.02 0.00 0.00 177.57 178.39 1h6k h TYR 171 N 0.63 0.37 -0.71 1.57 3.20 -0.05 -1.13 116.97 120.84 1h6k h TYR 171 Ca 0.02 -0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.90 1h6k h TYR 171 Cb 1.12 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.25 1h6k h TYR 171 CO 0.07 0.45 0.47 0.00 -1.64 0.00 0.00 178.16 177.51 1h6k h ALA 172 N 0.87 1.66 0.47 1.82 0.00 -0.85 0.73 119.26 123.96 1h6k h ALA 172 Ca 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1h6k h ALA 172 Cb 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1h6k h ALA 172 CO 0.00 0.25 -0.22 0.35 0.00 0.00 0.00 179.25 179.62 1h6k h PHE 173 N 0.80 -0.58 -0.99 0.00 3.57 -1.31 -3.25 116.94 115.17 1h6k h PHE 173 Ca 0.30 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.82 1h6k h PHE 173 Cb 0.17 0.19 -0.06 0.00 2.79 0.00 0.00 35.95 39.05 1h6k h PHE 173 CO -0.00 -0.35 0.65 -0.07 -2.23 0.00 0.00 178.31 176.31 1h6k h LEU 174 N -1.16 1.09 0.00 0.59 3.38 -0.98 -2.05 115.31 116.18 1h6k h LEU 174 Ca -0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1h6k h LEU 174 Cb 0.49 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1h6k h LEU 174 CO 0.11 0.75 0.00 -1.54 0.09 0.00 0.00 178.44 177.85 1h6k n SER 175 N -4.44 0.00 0.12 -0.43 3.41 0.23 -1.79 113.62 110.71 1h6k n SER 175 Ca 0.13 0.47 0.12 0.00 -0.26 0.00 0.00 58.87 59.33 1h6k n SER 175 Cb 0.08 -0.49 0.09 0.00 -0.26 0.00 0.00 64.21 63.63 1h6k n SER 175 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1h6k h SER 176 N 0.00 0.00 0.18 4.04 0.02 -1.40 -3.39 113.55 112.99 1h6k h SER 176 Ca 0.00 -0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 60.82 1h6k h SER 176 Cb 0.31 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 1h6k h SER 176 CO 0.00 0.03 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.37 1h6k h LEU 177 N 0.00 0.16 -2.04 5.07 3.38 -1.37 -1.73 115.31 118.78 1h6k h LEU 177 Ca 0.00 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 57.97 1h6k h LEU 177 Cb 0.93 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 1h6k h LEU 177 CO 0.00 0.44 0.13 -0.65 0.09 0.00 0.00 178.44 178.45 1h6k h PRO 178 N 0.15 0.00 0.03 1.13 0.11 -1.77 0.51 132.00 132.16 1h6k h PRO 178 Ca 0.02 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.99 1h6k h PRO 178 Cb 0.57 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 1h6k h PRO 178 CO 0.04 0.00 -0.77 -1.49 -0.21 0.00 0.00 178.00 175.57 1h6k h TRP 179 N 0.00 0.11 -0.00 0.65 6.55 -1.64 -3.43 115.95 118.19 1h6k h TRP 179 Ca 0.08 -0.08 0.00 0.00 0.95 0.00 0.00 58.89 59.85 1h6k h TRP 179 Cb 0.35 -0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.65 1h6k h TRP 179 CO 0.00 1.30 -0.03 1.55 -1.05 0.00 0.00 178.44 180.21 1h6k n VAL 180 N -4.40 0.00 -0.19 1.49 3.14 -0.80 -4.75 118.33 112.83 1h6k n VAL 180 Ca -0.21 -0.49 -0.02 0.00 -2.96 0.00 0.00 64.34 60.66 1h6k n VAL 180 Cb 0.65 1.07 0.04 0.00 -1.06 0.00 0.00 33.84 34.54 1h6k n VAL 180 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1h6k h GLY 181 N 0.80 0.32 0.88 7.55 0.00 -0.17 -1.95 103.07 110.50 1h6k h GLY 181 Ca 0.00 0.23 0.02 0.00 0.00 0.00 0.00 47.33 47.58 1h6k h GLY 181 CO 0.00 -0.22 0.12 1.70 0.00 0.00 0.00 176.54 178.13 1h6k h LYS 182 N -0.04 0.24 -0.24 4.80 3.64 -1.77 -1.08 116.57 122.12 1h6k h LYS 182 Ca 0.27 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1h6k h LYS 182 Cb 0.45 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1h6k h LYS 182 CO -0.60 0.16 0.07 1.49 -2.27 0.00 0.00 179.45 178.30 1h6k h GLU 183 N 0.25 0.38 -0.96 1.90 4.57 -1.84 -0.10 114.58 118.79 1h6k h GLU 183 Ca 0.10 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1h6k h GLU 183 Cb 0.03 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.52 1h6k h GLU 183 CO -0.07 0.47 0.60 -0.07 -1.18 0.00 0.00 179.01 178.75 1h6k h LEU 184 N 0.22 1.13 -0.68 1.64 3.38 -1.21 -1.46 115.31 118.33 1h6k h LEU 184 Ca 0.08 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 1h6k h LEU 184 Cb 0.25 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1h6k h LEU 184 CO -0.00 0.84 -0.54 0.22 0.09 0.00 0.00 178.44 179.05 1h6k h TYR 185 N 1.31 0.41 -0.44 1.13 3.20 -0.98 0.44 116.97 122.05 1h6k h TYR 185 Ca 0.35 -0.14 -0.05 0.00 3.14 0.00 0.00 58.73 62.02 1h6k h TYR 185 Cb -0.10 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.08 1h6k h TYR 185 CO 0.00 0.80 0.06 0.93 -1.64 0.00 0.00 178.16 178.32 1h6k h GLU 186 N 0.26 0.74 0.23 1.82 5.08 -0.36 -2.75 114.58 119.59 1h6k h GLU 186 Ca 0.00 -0.20 -0.31 0.00 -1.00 0.00 0.00 59.36 57.85 1h6k h GLU 186 Cb 1.04 -0.08 0.03 0.00 0.50 0.00 0.00 28.75 30.24 1h6k h GLU 186 CO 0.09 0.77 -1.39 0.87 -1.00 0.00 0.00 179.01 178.35 1h6k h LYS 187 N 0.60 0.48 -2.04 2.33 1.79 -1.21 -3.41 116.57 115.10 1h6k h LYS 187 Ca 0.13 -0.83 -0.51 0.00 -2.18 0.00 0.00 60.65 57.27 1h6k h LYS 187 Cb 0.39 0.31 -0.40 0.00 -1.58 0.00 0.00 32.23 30.95 1h6k h LYS 187 CO 0.01 1.40 -1.10 1.63 -1.08 0.00 0.00 179.45 180.30 1h6k n LYS 188 N -3.79 1.29 -0.30 3.15 4.76 0.14 -4.96 118.16 118.46 1h6k n LYS 188 Ca -0.17 -3.59 -0.04 0.00 -2.87 0.00 0.00 58.31 51.63 1h6k n LYS 188 Cb 1.05 -1.75 0.11 0.00 -1.84 0.00 0.00 35.03 32.60 1h6k n LYS 188 CO 0.00 0.00 0.00 0.38 -1.37 0.00 0.00 177.40 176.41 1h6k h ASP 189 N 3.11 1.07 -0.40 4.39 2.03 -1.63 -0.82 116.42 124.18 1h6k h ASP 189 Ca 0.10 -0.11 -0.10 0.00 -0.73 0.00 0.00 57.03 56.19 1h6k h ASP 189 Cb 0.89 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 39.10 1h6k h ASP 189 CO 0.55 0.89 -0.15 0.00 -1.03 0.00 0.00 179.24 179.50 1h6k h ALA 190 N 1.28 0.56 -0.39 4.15 0.00 -1.93 -1.03 119.26 121.91 1h6k h ALA 190 Ca 0.29 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1h6k h ALA 190 Cb 0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1h6k h ALA 190 CO -0.04 0.48 0.16 0.93 0.00 0.00 0.00 179.25 180.78 1h6k h GLU 191 N 0.63 0.58 -0.49 0.00 3.07 -1.89 -2.60 114.58 113.87 1h6k h GLU 191 Ca 0.10 -0.10 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 1h6k h GLU 191 Cb 0.69 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.48 1h6k h GLU 191 CO 0.05 0.54 0.28 0.52 -1.40 0.00 0.00 179.01 179.00 1h6k h MET 192 N 0.48 0.68 -0.97 2.33 2.86 -1.03 -2.01 114.93 117.28 1h6k h MET 192 Ca 0.13 -0.07 0.11 0.00 -2.06 0.00 0.00 59.70 57.81 1h6k h MET 192 Cb 0.18 -0.14 -0.08 0.00 0.06 0.00 0.00 31.60 31.62 1h6k h MET 192 CO -0.01 0.51 0.62 -0.44 1.06 0.00 0.00 176.91 178.65 1h6k h ASP 193 N 0.65 0.90 -0.53 1.22 3.32 -1.03 0.13 116.42 121.08 1h6k h ASP 193 Ca 0.17 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.17 1h6k h ASP 193 Cb 0.02 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1h6k h ASP 193 CO -0.03 0.51 0.02 0.03 -1.72 0.00 0.00 179.24 178.04 1h6k h ARG 194 N 0.98 0.96 -0.43 3.56 3.08 -1.04 0.68 114.38 122.16 1h6k h ARG 194 Ca 0.46 -0.28 -0.09 0.00 0.07 0.00 0.00 59.98 60.14 1h6k h ARG 194 Cb 0.43 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1h6k h ARG 194 CO -0.22 0.94 -0.09 0.82 -1.07 0.00 0.00 179.97 180.35 1h6k h ILE 195 N 0.89 1.25 -0.30 2.04 2.04 -0.16 -1.88 117.51 121.39 1h6k h ILE 195 Ca 0.17 -1.13 -0.14 0.00 1.00 0.00 0.00 64.86 64.76 1h6k h ILE 195 Cb 0.50 1.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1h6k h ILE 195 CO 0.02 0.39 -0.34 -0.26 0.00 0.00 0.00 178.15 177.96 1h6k h PHE 196 N 0.70 0.93 -0.42 1.37 0.04 -0.56 0.62 116.94 119.62 1h6k h PHE 196 Ca 0.12 -0.29 0.05 0.00 2.80 0.00 0.00 57.97 60.65 1h6k h PHE 196 Cb 0.56 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 38.48 1h6k h PHE 196 CO 0.03 1.06 0.17 0.00 -0.60 0.00 0.00 178.31 178.97 1h6k h ALA 197 N 0.71 0.51 -0.52 2.45 0.00 -0.68 0.24 119.26 121.98 1h6k h ALA 197 Ca 0.04 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1h6k h ALA 197 Cb 0.92 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1h6k h ALA 197 CO 0.08 -0.21 -0.09 -0.91 0.00 0.00 0.00 179.25 178.12 1h6k h ASN 198 N 0.35 0.94 -0.14 0.00 -0.26 -1.21 -2.22 115.58 113.04 1h6k h ASN 198 Ca 0.19 -0.29 -0.00 0.00 -0.56 0.00 0.00 56.30 55.63 1h6k h ASN 198 Cb 0.15 -0.26 -0.01 0.00 -1.06 0.00 0.00 38.32 37.15 1h6k h ASN 198 CO -0.17 1.05 0.08 0.74 -1.06 0.00 0.00 177.43 178.06 1h6k h THR 199 N 0.85 1.10 -0.84 2.81 2.02 -0.18 -1.92 112.91 116.75 1h6k h THR 199 Ca 0.14 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 67.03 1h6k h THR 199 Cb 0.63 1.02 -0.04 0.00 -1.74 0.00 0.00 68.15 68.02 1h6k h THR 199 CO 0.04 0.09 0.42 -0.08 0.37 0.00 0.00 175.52 176.36 1h6k h GLU 200 N 0.13 1.21 -0.75 6.66 4.81 -0.40 0.65 114.58 126.89 1h6k h GLU 200 Ca 0.05 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.05 1h6k h GLU 200 Cb 0.07 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 1h6k h GLU 200 CO -0.01 0.92 0.23 0.66 -0.73 0.00 0.00 179.01 180.08 1h6k h SER 201 N 1.19 1.09 -0.26 1.04 4.64 -1.30 -1.03 113.55 118.92 1h6k h SER 201 Ca 0.29 -0.21 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 1h6k h SER 201 Cb 0.10 -0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 1h6k h SER 201 CO -0.04 1.01 0.13 0.22 -0.87 0.00 0.00 176.83 177.28 1h6k h TYR 202 N 1.12 0.37 -0.29 4.77 3.20 -0.55 -3.05 116.97 122.55 1h6k h TYR 202 Ca 0.24 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 1h6k h TYR 202 Cb 0.31 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1h6k h TYR 202 CO 0.03 0.34 0.18 -0.07 -1.64 0.00 0.00 178.16 176.99 1h6k h LEU 203 N 0.29 0.34 -1.07 2.82 3.38 -0.37 -2.45 115.31 118.25 1h6k h LEU 203 Ca 0.09 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 1h6k h LEU 203 Cb 0.10 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1h6k h LEU 203 CO -0.01 0.26 -0.28 0.11 0.09 0.00 0.00 178.44 178.61 1h6k h LYS 204 N 0.40 0.00 -0.12 1.13 1.57 -1.09 -3.09 116.57 115.36 1h6k h LYS 204 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1h6k h LYS 204 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1h6k h LYS 204 CO -0.02 0.28 0.00 2.89 -0.57 0.00 0.00 179.45 182.03 1h6k n ARG 205 N -3.46 2.29 -1.86 3.15 1.85 -0.94 -4.98 116.66 112.70 1h6k n ARG 205 Ca -0.00 -1.99 -0.40 0.00 -1.00 0.00 0.00 57.85 54.46 1h6k n ARG 205 Cb 0.45 -1.46 0.01 0.00 -1.05 0.00 0.00 32.46 30.41 1h6k n ARG 205 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1h6k s ARG 206 N -1.81 3.81 0.27 2.89 0.52 -1.12 -4.98 118.95 118.52 1h6k s ARG 206 Ca 0.30 2.37 -0.29 0.00 -0.52 0.00 0.00 55.73 57.59 1h6k s ARG 206 Cb 0.20 -2.72 -0.09 0.00 0.52 0.00 0.00 34.95 32.86 1h6k s ARG 206 CO 0.30 -0.70 1.02 -0.65 0.02 0.00 0.00 175.30 175.29 1h6k s GLN 207 N -2.35 4.72 -0.17 3.54 -1.52 -1.26 -4.95 119.66 117.67 1h6k s GLN 207 Ca 0.59 1.64 0.17 0.00 -1.95 0.00 0.00 55.36 55.82 1h6k s GLN 207 Cb -0.43 -3.20 0.46 0.00 -0.22 0.00 0.00 33.01 29.63 1h6k s GLN 207 CO 0.55 0.34 1.35 1.63 -0.25 0.00 0.00 175.29 178.91 1h6k n LYS 208 N 1.27 2.43 -0.10 2.91 4.76 -1.26 -4.76 118.16 123.41 1h6k n LYS 208 Ca -0.01 -2.78 0.12 0.00 -2.87 0.00 0.00 58.31 52.77 1h6k n LYS 208 Cb 0.46 -1.75 0.50 0.00 -1.84 0.00 0.00 35.03 32.40 1h6k n LYS 208 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1h6k h THR 209 N 1.28 0.89 0.00 -0.18 2.02 -1.96 -2.01 112.91 112.94 1h6k h THR 209 Ca 0.00 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.04 1h6k h THR 209 Cb 1.32 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.16 1h6k h THR 209 CO 0.16 0.08 0.00 1.12 0.37 0.00 0.00 175.52 177.25 1h6k h HIS 210 N 0.42 0.00 -0.10 3.16 2.07 -1.86 -3.39 115.15 115.46 1h6k h HIS 210 Ca 0.29 0.00 0.04 0.00 -2.85 0.00 0.00 60.37 57.85 1h6k h HIS 210 Cb 0.57 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.50 1h6k h HIS 210 CO -0.00 0.00 -0.18 0.28 -3.07 0.00 0.00 177.93 174.96 1h6k h VAL 211 N 0.00 0.54 0.00 6.12 2.07 -1.74 -2.71 116.25 120.54 1h6k h VAL 211 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1h6k h VAL 211 Cb 0.57 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1h6k h VAL 211 CO 0.00 0.00 -0.03 -0.65 0.02 0.00 0.00 177.57 176.91 1h6k h PRO 212 N -0.24 0.00 0.00 1.57 0.11 -1.81 -1.01 132.00 130.61 1h6k h PRO 212 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1h6k h PRO 212 Cb 0.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.48 1h6k h PRO 212 CO -0.24 0.03 0.00 -0.12 -0.21 0.00 0.00 178.00 177.46 1h6k n MET 213 N -4.46 0.06 -0.00 1.05 0.00 -1.03 -3.83 117.12 108.92 1h6k n MET 213 Ca -0.03 0.14 0.02 0.00 -0.00 0.00 0.00 57.70 57.83 1h6k n MET 213 Cb 0.12 -1.59 -0.02 0.00 0.00 0.00 0.00 33.22 31.73 1h6k n MET 213 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1h6k n LEU 214 N -1.70 0.18 -4.74 -0.89 4.77 -0.43 -4.91 117.00 109.28 1h6k n LEU 214 Ca 0.05 -0.49 -0.41 0.00 -0.03 0.00 0.00 56.01 55.13 1h6k n LEU 214 Cb 0.30 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.36 1h6k n LEU 214 CO 0.23 0.05 0.85 -1.10 -1.33 0.00 0.00 177.39 176.09 1h6k s GLN 215 N -1.39 4.54 0.17 3.23 -0.21 -0.89 -4.52 119.66 120.59 1h6k s GLN 215 Ca 0.01 1.84 -0.01 0.00 0.02 0.00 0.00 55.36 57.22 1h6k s GLN 215 Cb 0.03 -3.23 0.05 0.00 1.00 0.00 0.00 33.01 30.86 1h6k s GLN 215 CO 0.16 0.01 1.43 0.28 -2.12 0.00 0.00 175.29 175.05 1h6k h VAL 216 N 3.58 1.38 -4.05 1.09 2.07 -1.93 -3.42 116.25 114.97 1h6k h VAL 216 Ca -0.45 -2.17 -0.49 0.00 0.82 0.00 0.00 66.70 64.41 1h6k h VAL 216 Cb 1.21 2.14 -0.24 0.00 -1.52 0.00 0.00 31.29 32.88 1h6k h VAL 216 CO 0.72 0.65 -0.81 0.26 0.02 0.00 0.00 177.57 178.41 1h6k s TRP 217 N -3.59 1.46 -0.14 1.57 0.51 -1.26 -0.29 118.94 117.19 1h6k s TRP 217 Ca -0.06 -0.38 0.18 0.00 -2.12 0.00 0.00 56.10 53.72 1h6k s TRP 217 Cb 0.10 -0.85 -0.12 0.00 -0.81 0.00 0.00 33.47 31.79 1h6k s TRP 217 CO 0.84 0.07 0.84 0.25 -0.51 0.00 0.00 176.95 178.44 1h6k n THR 218 N 1.72 1.08 -1.69 2.01 -2.24 -0.99 -4.67 114.28 109.50 1h6k n THR 218 Ca -0.18 -0.67 -0.38 0.00 -2.27 0.00 0.00 64.05 60.55 1h6k n THR 218 Cb 0.54 -0.66 0.05 0.00 -2.10 0.00 0.00 70.33 68.16 1h6k n THR 218 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h6k n ALA 219 N -2.36 0.95 0.31 6.98 0.00 -1.26 -4.90 120.51 120.23 1h6k n ALA 219 Ca -0.08 0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.54 1h6k n ALA 219 Cb 0.79 -2.25 0.10 0.00 0.00 0.00 0.00 19.45 18.09 1h6k n ALA 219 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1h6k h ASP 220 N 0.93 0.00 -4.18 0.00 3.32 -1.92 -3.42 116.42 111.16 1h6k h ASP 220 Ca -0.50 -0.08 -0.63 0.00 0.02 0.00 0.00 57.03 55.84 1h6k h ASP 220 Cb 1.33 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.64 1h6k h ASP 220 CO 0.54 0.04 -0.86 -0.54 -1.72 0.00 0.00 179.24 176.71 1h6k s LYS 221 N -3.26 1.45 0.42 3.56 1.02 -1.26 -2.48 119.74 119.19 1h6k s LYS 221 Ca 0.03 -1.13 0.26 0.00 0.02 0.00 0.00 55.97 55.15 1h6k s LYS 221 Cb 0.10 -1.70 0.64 0.00 -0.52 0.00 0.00 37.83 36.35 1h6k s LYS 221 CO 0.74 0.42 1.71 -1.00 -0.92 0.00 0.00 175.35 176.31 1h6k h PRO 222 N 4.45 0.00 -4.29 -1.68 0.13 -1.98 -3.48 132.00 125.15 1h6k h PRO 222 Ca -0.46 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.13 1h6k h PRO 222 Cb 1.16 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.92 1h6k h PRO 222 CO 0.42 0.00 -0.81 -1.01 -0.23 0.00 0.00 178.00 176.37 1h6k s HIS 223 N -3.29 1.57 0.33 1.56 3.76 -1.23 -5.11 115.29 112.88 1h6k s HIS 223 Ca 0.06 -0.79 -0.29 0.00 -0.15 0.00 0.00 55.06 53.89 1h6k s HIS 223 Cb 0.07 -1.27 -0.11 0.00 1.11 0.00 0.00 32.58 32.38 1h6k s HIS 223 CO 0.62 -0.52 1.44 -2.14 -0.85 0.00 0.00 174.74 173.28 1h6k s PRO 224 N 1.64 4.21 -0.53 8.40 0.02 -1.03 -4.76 135.00 142.95 1h6k s PRO 224 Ca 0.04 2.42 -0.19 0.00 0.02 0.00 0.00 61.00 63.29 1h6k s PRO 224 Cb -0.13 -3.03 0.07 0.00 0.02 0.00 0.00 34.50 31.44 1h6k s PRO 224 CO -0.08 -0.42 0.65 -0.65 -0.33 0.00 0.00 177.00 176.17 1h6k s GLN 225 N -1.55 3.10 0.10 5.54 -1.52 -1.26 -4.80 119.66 119.27 1h6k s GLN 225 Ca 0.54 -1.01 -0.20 0.00 -1.95 0.00 0.00 55.36 52.74 1h6k s GLN 225 Cb -0.44 -4.15 -0.07 0.00 -0.22 0.00 0.00 33.01 28.14 1h6k s GLN 225 CO 0.55 -1.31 0.61 -1.21 -0.25 0.00 0.00 175.29 173.67 1h6k s GLU 226 N 2.66 4.24 0.28 2.91 2.02 -1.25 -4.80 118.70 124.76 1h6k s GLU 226 Ca 0.14 0.79 -0.30 0.00 0.02 0.00 0.00 54.97 55.62 1h6k s GLU 226 Cb -0.21 -3.20 -0.11 0.00 0.10 0.00 0.00 34.13 30.71 1h6k s GLU 226 CO 0.10 0.60 1.58 -2.00 0.02 0.00 0.00 175.26 175.57 1h6k s GLU 227 N -1.23 4.14 0.34 1.61 -6.30 -1.26 0.51 118.70 116.51 1h6k s GLU 227 Ca 0.31 2.54 0.04 0.00 -2.50 0.00 0.00 54.97 55.36 1h6k s GLU 227 Cb -0.20 -3.04 0.67 0.00 0.00 0.00 0.00 34.13 31.56 1h6k s GLU 227 CO 0.20 -0.61 1.95 0.10 0.02 0.00 0.00 175.26 176.92 1h6k h TYR 228 N 5.10 0.84 0.02 5.30 -0.00 -1.36 -0.73 116.97 126.14 1h6k h TYR 228 Ca -0.46 0.02 -0.22 0.00 -0.00 0.00 0.00 58.73 58.07 1h6k h TYR 228 Cb 1.22 -0.28 -0.00 0.00 -0.00 0.00 0.00 36.73 37.66 1h6k h TYR 228 CO 0.59 0.46 -0.94 -0.07 -0.00 0.00 0.00 178.16 178.20 1h6k h LEU 229 N 0.84 0.38 -0.61 0.10 3.38 -1.90 -0.96 115.31 116.54 1h6k h LEU 229 Ca 0.32 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1h6k h LEU 229 Cb 0.19 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1h6k h LEU 229 CO -0.11 1.13 0.27 0.44 0.09 0.00 0.00 178.44 180.26 1h6k h ASP 230 N 0.15 0.82 0.07 -0.43 3.32 -1.76 0.37 116.42 118.96 1h6k h ASP 230 Ca -0.07 -0.15 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 1h6k h ASP 230 Cb 1.59 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.93 1h6k h ASP 230 CO 0.15 0.74 -0.03 0.00 -1.72 0.00 0.00 179.24 178.38 1h6k h LEU 232 N -0.40 1.13 -0.63 0.00 5.85 -1.13 -0.69 115.31 119.45 1h6k h LEU 232 Ca -0.01 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1h6k h LEU 232 Cb 0.34 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1h6k h LEU 232 CO 0.02 0.85 0.34 -0.25 -0.34 0.00 0.00 178.44 179.06 1h6k h TRP 233 N 1.30 0.87 -0.74 1.25 2.91 -0.84 0.10 115.95 120.81 1h6k h TRP 233 Ca 0.34 -0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.31 1h6k h TRP 233 Cb -0.08 -0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 28.26 1h6k h TRP 233 CO 0.00 0.63 0.36 0.00 -1.03 0.00 0.00 178.44 178.41 1h6k h ALA 234 N 1.16 1.25 -0.58 2.65 0.00 -0.85 0.18 119.26 123.07 1h6k h ALA 234 Ca 0.22 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1h6k h ALA 234 Cb 0.06 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1h6k h ALA 234 CO -0.03 0.58 0.09 1.96 0.00 0.00 0.00 179.25 181.85 1h6k h GLN 235 N 1.04 0.95 -0.54 0.00 4.20 -0.52 -1.63 115.11 118.61 1h6k h GLN 235 Ca 0.26 -0.26 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 1h6k h GLN 235 Cb 0.09 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1h6k h GLN 235 CO -0.03 0.91 -0.05 0.82 -0.67 0.00 0.00 178.83 179.81 1h6k h ILE 236 N 0.85 1.26 -0.89 2.54 1.08 -0.53 -0.07 117.51 121.76 1h6k h ILE 236 Ca 0.17 -1.17 -0.02 0.00 -0.39 0.00 0.00 64.86 63.46 1h6k h ILE 236 Cb 0.42 0.89 -0.04 0.00 -3.07 0.00 0.00 36.82 35.02 1h6k h ILE 236 CO 0.01 0.42 0.49 1.56 -0.69 0.00 0.00 178.15 179.94 1h6k h GLN 237 N 0.88 1.23 -0.55 2.37 1.08 -0.79 0.16 115.11 119.50 1h6k h GLN 237 Ca 0.15 -0.14 -0.06 0.00 -1.45 0.00 0.00 58.65 57.15 1h6k h GLN 237 Cb 0.58 -0.24 -0.02 0.00 -0.05 0.00 0.00 27.48 27.75 1h6k h GLN 237 CO 0.04 0.90 0.11 -0.22 -0.95 0.00 0.00 178.83 178.70 1h6k h LYS 238 N 1.24 0.90 -0.69 1.46 3.64 -0.68 -0.87 116.57 121.57 1h6k h LYS 238 Ca 0.31 -0.23 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1h6k h LYS 238 Cb 0.02 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.69 1h6k h LYS 238 CO -0.05 0.86 0.42 1.25 -2.27 0.00 0.00 179.45 179.66 1h6k h LEU 239 N 0.79 0.82 -0.04 5.20 5.85 -0.28 -1.15 115.31 126.49 1h6k h LEU 239 Ca 0.17 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1h6k h LEU 239 Cb 0.38 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 1h6k h LEU 239 CO 0.01 0.63 0.03 0.50 -0.34 0.00 0.00 178.44 179.27 1h6k h LYS 240 N 0.94 0.06 -0.24 1.25 3.64 -0.46 0.40 116.57 122.15 1h6k h LYS 240 Ca 0.25 -0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.69 1h6k h LYS 240 Cb -0.04 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1h6k h LYS 240 CO -0.05 0.06 0.21 -0.22 -2.27 0.00 0.00 179.45 177.18 1h6k h LYS 241 N 0.04 0.00 -0.75 1.90 3.64 -0.81 0.19 116.57 120.79 1h6k h LYS 241 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1h6k h LYS 241 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1h6k h LYS 241 CO -0.00 0.00 0.00 -0.25 -2.27 0.00 0.00 179.45 176.93 1h6k n ASP 242 N -4.13 3.60 -2.95 4.20 8.00 -0.47 -4.88 116.55 119.93 1h6k n ASP 242 Ca 0.03 -2.50 -0.22 0.00 0.71 0.00 0.00 54.79 52.81 1h6k n ASP 242 Cb 0.35 -0.59 0.03 0.00 -0.02 0.00 0.00 41.12 40.88 1h6k n ASP 242 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1h6k n ARG 243 N 0.36 -4.28 -2.15 -1.24 1.74 0.67 -2.09 116.66 109.68 1h6k n ARG 243 Ca 0.15 0.89 -0.17 0.00 -0.77 0.00 0.00 57.85 57.95 1h6k n ARG 243 Cb 0.76 -5.71 -0.02 0.00 -1.02 0.00 0.00 32.46 26.48 1h6k n ARG 243 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1h6k n TRP 244 N -4.38 -0.63 -3.95 -1.55 7.02 0.13 -4.92 117.44 109.17 1h6k n TRP 244 Ca -0.13 0.00 -0.35 0.00 -1.02 0.00 0.00 57.50 56.01 1h6k n TRP 244 Cb 0.62 -3.30 -0.10 0.00 -2.42 0.00 0.00 31.31 26.12 1h6k n TRP 244 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 1h6k s GLN 245 N -4.54 3.98 0.31 -0.99 -1.52 -0.89 -4.39 119.66 111.62 1h6k s GLN 245 Ca 0.00 -0.34 0.05 0.00 -1.95 0.00 0.00 55.36 53.12 1h6k s GLN 245 Cb 0.00 -3.26 -0.06 0.00 -0.22 0.00 0.00 33.01 29.47 1h6k s GLN 245 CO 0.00 0.24 0.01 -1.83 -0.25 0.00 0.00 175.29 173.46 1h6k s GLU 246 N 0.48 1.62 -0.10 2.91 4.04 -1.26 -4.88 118.70 121.51 1h6k s GLU 246 Ca 0.04 -1.87 0.15 0.00 0.04 0.00 0.00 54.97 53.33 1h6k s GLU 246 Cb -0.12 -1.00 0.23 0.00 0.02 0.00 0.00 34.13 33.26 1h6k s GLU 246 CO 0.00 -0.10 1.12 0.54 -1.84 0.00 0.00 175.26 174.98 1h6k n ARG 247 N -0.66 1.55 0.00 -4.83 1.74 -1.26 -4.82 116.66 108.38 1h6k n ARG 247 Ca -0.04 -2.36 0.00 0.00 -0.77 0.00 0.00 57.85 54.68 1h6k n ARG 247 Cb 0.65 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.70 1h6k n ARG 247 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 1h6k n HIS 248 N -1.25 0.00 -1.89 -1.55 -0.00 -1.26 -3.57 115.22 105.70 1h6k n HIS 248 Ca 0.13 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.89 1h6k n HIS 248 Cb 0.57 0.02 -0.03 0.00 -0.12 0.00 0.00 29.99 30.44 1h6k n HIS 248 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1h6k s ILE 249 N -1.83 2.70 -0.04 3.57 1.01 -1.26 -0.84 121.20 124.51 1h6k s ILE 249 Ca 0.00 0.38 -0.25 0.00 0.00 0.00 0.00 60.65 60.78 1h6k s ILE 249 Cb 0.00 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 1h6k s ILE 249 CO 0.00 0.02 0.75 -0.76 0.00 0.00 0.00 174.94 174.94 1h6k s LEU 250 N 1.84 4.34 -0.51 2.97 1.43 -1.26 -4.70 118.68 122.80 1h6k s LEU 250 Ca 0.73 1.29 0.03 0.00 -1.03 0.00 0.00 54.13 55.15 1h6k s LEU 250 Cb -0.43 -3.17 0.14 0.00 0.03 0.00 0.00 46.19 42.76 1h6k s LEU 250 CO 0.32 -0.12 0.30 -0.13 0.23 0.00 0.00 176.35 176.95 1h6k s ARG 251 N 0.71 1.68 0.52 1.70 0.52 -1.26 -4.75 118.95 118.08 1h6k s ARG 251 Ca 0.40 -2.45 0.25 0.00 -0.52 0.00 0.00 55.73 53.41 1h6k s ARG 251 Cb -0.19 -2.76 1.37 0.00 0.52 0.00 0.00 34.95 33.90 1h6k s ARG 251 CO 0.20 -1.19 1.99 -1.35 0.02 0.00 0.00 175.30 174.97 1h6k h PRO 252 N 6.33 0.04 0.00 3.54 0.11 -1.96 -1.38 132.00 138.67 1h6k h PRO 252 Ca 0.02 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 1h6k h PRO 252 Cb 0.88 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.98 1h6k h PRO 252 CO 0.58 0.02 -0.03 0.10 -0.21 0.00 0.00 178.00 178.46 1h6k h TYR 253 N 0.04 0.00 0.00 0.65 -0.00 -1.93 -1.70 116.97 114.03 1h6k h TYR 253 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.00 1h6k h TYR 253 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.75 1h6k h TYR 253 CO -0.00 0.03 0.00 1.28 -0.00 0.00 0.00 178.16 179.47 1h6k n LEU 254 N -4.01 0.44 0.00 0.10 4.77 -0.52 -0.88 117.00 116.90 1h6k n LEU 254 Ca -0.03 0.68 0.12 0.00 -0.03 0.00 0.00 56.01 56.76 1h6k n LEU 254 Cb 0.12 -0.71 0.31 0.00 -2.33 0.00 0.00 43.42 40.81 1h6k n LEU 254 CO 0.30 -0.77 0.54 0.00 -1.33 0.00 0.00 177.39 176.13 1h6k n ALA 255 N -1.71 3.32 -1.52 -1.18 0.00 -0.64 -3.97 120.51 114.81 1h6k n ALA 255 Ca -0.00 -0.30 -0.06 0.00 0.00 0.00 0.00 53.44 53.07 1h6k n ALA 255 Cb 0.06 -1.18 0.18 0.00 0.00 0.00 0.00 19.45 18.51 1h6k n ALA 255 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1h6k n PHE 256 N -1.51 1.19 -0.17 0.00 3.01 -0.06 -4.75 117.46 115.16 1h6k n PHE 256 Ca 0.06 -1.71 0.22 0.00 1.01 0.00 0.00 57.45 57.02 1h6k n PHE 256 Cb 0.34 -0.49 0.61 0.00 -0.01 0.00 0.00 39.48 39.92 1h6k n PHE 256 CO 0.00 0.00 0.00 0.22 1.01 0.00 0.00 176.76 177.99 1h6k h ASP 257 N 1.14 0.21 -0.34 4.37 1.82 -1.69 0.05 116.42 121.98 1h6k h ASP 257 Ca 0.23 0.02 -0.16 0.00 -0.39 0.00 0.00 57.03 56.73 1h6k h ASP 257 Cb 1.55 -0.02 -0.01 0.00 0.68 0.00 0.00 39.33 41.54 1h6k h ASP 257 CO 0.43 0.09 -0.41 0.77 -1.61 0.00 0.00 179.24 178.50 1h6k h SER 258 N 0.21 0.97 0.01 2.28 4.64 -1.93 -3.33 113.55 116.40 1h6k h SER 258 Ca 0.41 -0.46 -0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1h6k h SER 258 Cb 1.27 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1h6k h SER 258 CO -0.09 1.25 -0.00 0.40 -0.87 0.00 0.00 176.83 177.52 1h6k h ILE 259 N 0.73 1.55 -3.50 0.95 2.04 -1.57 -3.44 117.51 114.26 1h6k h ILE 259 Ca 0.05 -1.76 -0.52 0.00 1.00 0.00 0.00 64.86 63.63 1h6k h ILE 259 Cb 1.00 2.72 -0.02 0.00 -0.74 0.00 0.00 36.82 39.79 1h6k h ILE 259 CO 0.10 0.45 0.39 -0.76 0.00 0.00 0.00 178.15 178.32 1h6k s LEU 260 N -8.69 4.45 0.17 1.44 1.43 -0.13 -4.96 118.68 112.39 1h6k s LEU 260 Ca -0.17 1.80 -0.22 0.00 -1.03 0.00 0.00 54.13 54.50 1h6k s LEU 260 Cb -0.01 -3.58 0.06 0.00 0.03 0.00 0.00 46.19 42.69 1h6k s LEU 260 CO 0.66 -0.16 0.60 0.00 0.23 0.00 0.00 176.35 177.68 1h6k h GLU 262 N 2.02 0.00 0.00 0.00 5.08 -1.95 -1.22 114.58 118.51 1h6k h GLU 262 Ca -0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1h6k h GLU 262 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1h6k h GLU 262 CO 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.38 1h6k h ALA 263 N 1.94 1.00 -0.31 3.43 0.00 -1.96 -1.57 119.26 121.79 1h6k h ALA 263 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1h6k h ALA 263 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1h6k h ALA 263 CO -0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1h6k n LEU 264 N -2.72 2.97 -4.75 0.00 4.77 -0.46 -4.99 117.00 111.82 1h6k n LEU 264 Ca -0.01 -1.25 -0.35 0.00 -0.03 0.00 0.00 56.01 54.37 1h6k n LEU 264 Cb 0.13 -0.20 0.04 0.00 -2.33 0.00 0.00 43.42 41.07 1h6k n LEU 264 CO 0.18 0.62 0.81 -1.10 -1.33 0.00 0.00 177.39 176.58 1h6k s GLN 265 N -1.61 2.82 0.16 3.23 -0.21 -0.59 -4.62 119.66 118.84 1h6k s GLN 265 Ca 0.36 1.72 0.10 0.00 0.02 0.00 0.00 55.36 57.57 1h6k s GLN 265 Cb 0.21 -1.92 -0.04 0.00 1.00 0.00 0.00 33.01 32.26 1h6k s GLN 265 CO 0.30 -1.30 -0.22 -1.01 -2.12 0.00 0.00 175.29 170.95 1h6k s HIS 266 N -1.81 2.40 -0.12 0.91 3.76 0.66 -4.87 115.29 116.23 1h6k s HIS 266 Ca 0.75 -0.32 -0.09 0.00 -0.15 0.00 0.00 55.06 55.24 1h6k s HIS 266 Cb -0.28 -1.24 -0.04 0.00 1.11 0.00 0.00 32.58 32.13 1h6k s HIS 266 CO 0.36 0.43 0.19 -0.80 -0.85 0.00 0.00 174.74 174.07 1h6k s ASN 267 N -2.40 6.43 0.35 1.40 0.01 -1.26 -1.24 114.94 118.23 1h6k s ASN 267 Ca 0.19 0.51 -0.22 0.00 -0.71 0.00 0.00 52.86 52.62 1h6k s ASN 267 Cb -0.09 -2.11 -0.10 0.00 0.41 0.00 0.00 41.25 39.36 1h6k s ASN 267 CO 0.10 0.33 0.91 -0.76 -1.51 0.00 0.00 177.10 176.16 1h6k s LEU 268 N -0.67 4.16 0.62 0.60 1.43 -1.26 -5.04 118.68 118.53 1h6k s LEU 268 Ca 0.15 1.69 -0.17 0.00 -1.03 0.00 0.00 54.13 54.77 1h6k s LEU 268 Cb -0.13 -4.18 -0.02 0.00 0.03 0.00 0.00 46.19 41.90 1h6k s LEU 268 CO 0.04 -0.18 1.16 -2.84 0.23 0.00 0.00 176.35 174.76 1h6k s PRO 269 N -2.56 2.88 0.39 1.29 0.02 -1.26 -4.93 135.00 130.83 1h6k s PRO 269 Ca 0.54 1.62 -0.26 0.00 0.02 0.00 0.00 61.00 62.93 1h6k s PRO 269 Cb -0.14 -1.94 -0.11 0.00 0.02 0.00 0.00 34.50 32.33 1h6k s PRO 269 CO 0.19 -1.23 1.13 -2.30 -0.33 0.00 0.00 177.00 174.46 1h6k n PRO 270 N -1.96 1.65 -3.98 5.54 -0.02 -1.26 -4.99 135.00 129.98 1h6k n PRO 270 Ca 0.12 0.58 -0.29 0.00 -2.02 0.00 0.00 63.50 61.89 1h6k n PRO 270 Cb 0.51 -2.16 -0.16 0.00 -0.02 0.00 0.00 33.50 31.66 1h6k n PRO 270 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1h6k s PHE 271 N -1.19 2.08 -0.21 6.00 2.19 -1.26 -5.10 117.98 120.49 1h6k s PHE 271 Ca 0.61 -1.25 -0.04 0.00 0.33 0.00 0.00 56.93 56.58 1h6k s PHE 271 Cb -0.56 -1.52 -0.01 0.00 -1.31 0.00 0.00 43.02 39.61 1h6k s PHE 271 CO 0.58 -0.66 -0.03 0.99 1.83 0.00 0.00 175.22 177.93 1h6k s THR 272 N 1.51 3.53 0.05 0.12 2.01 -1.26 -4.92 115.64 116.67 1h6k s THR 272 Ca 0.03 -0.45 -0.32 0.00 0.31 0.00 0.00 61.69 61.26 1h6k s THR 272 Cb -0.14 -2.60 -0.11 0.00 0.01 0.00 0.00 72.50 69.66 1h6k s THR 272 CO -0.09 0.43 1.86 -0.81 -0.69 0.00 0.00 174.62 175.32 1h6k n PRO 273 N 4.58 2.59 -1.60 4.92 -0.04 -1.26 -4.88 135.00 139.32 1h6k n PRO 273 Ca -0.18 0.95 -0.47 0.00 -0.04 0.00 0.00 63.50 63.76 1h6k n PRO 273 Cb 0.51 -2.83 -0.03 0.00 -0.04 0.00 0.00 33.50 31.11 1h6k n PRO 273 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1h6k n PRO 274 N 6.23 1.35 -1.72 0.54 -0.02 -1.26 -4.88 135.00 135.24 1h6k n PRO 274 Ca 0.20 0.48 -0.37 0.00 -2.02 0.00 0.00 63.50 61.79 1h6k n PRO 274 Cb 0.35 -1.97 0.07 0.00 -0.02 0.00 0.00 33.50 31.93 1h6k n PRO 274 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1h6k n PRO 275 N 1.52 1.13 -2.16 0.52 -0.02 -1.26 -4.94 135.00 129.78 1h6k n PRO 275 Ca 0.13 0.44 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 1h6k n PRO 275 Cb 0.28 -2.51 -0.03 0.00 -0.02 0.00 0.00 33.50 31.21 1h6k n PRO 275 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1h6k s HIS 276 N -1.39 2.94 0.00 6.00 5.65 -1.26 -5.02 115.29 122.21 1h6k s HIS 276 Ca 0.82 0.80 0.00 0.00 0.25 0.00 0.00 55.06 56.93 1h6k s HIS 276 Cb -0.38 -3.71 0.00 0.00 -1.18 0.00 0.00 32.58 27.31 1h6k s HIS 276 CO 0.41 -2.62 0.00 0.25 -0.65 0.00 0.00 174.74 172.13 1h6k n THR 277 N 4.41 0.00 0.08 0.89 -2.24 -1.26 -5.04 114.28 111.12 1h6k n THR 277 Ca 0.13 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.69 1h6k n THR 277 Cb 0.43 -0.36 -0.14 0.00 -2.10 0.00 0.00 70.33 68.15 1h6k n THR 277 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1h6k h GLU 278 N 0.00 0.45 -0.14 -0.78 5.08 -2.06 -3.32 114.58 113.81 1h6k h GLU 278 Ca 0.00 -0.69 0.00 0.00 -1.00 0.00 0.00 59.36 57.67 1h6k h GLU 278 Cb 0.00 0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1h6k h GLU 278 CO 0.00 1.31 0.00 -0.25 -1.00 0.00 0.00 179.01 179.07 1h6k n ASP 279 N -3.95 0.82 -4.71 1.42 9.92 -1.26 -4.89 116.55 113.90 1h6k n ASP 279 Ca -0.14 -1.90 -0.42 0.00 -0.53 0.00 0.00 54.79 51.79 1h6k n ASP 279 Cb 0.92 -0.09 -0.03 0.00 -0.64 0.00 0.00 41.12 41.28 1h6k n ASP 279 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1h6k s SER 280 N -1.12 7.10 -0.25 -2.24 0.01 -1.25 -5.00 113.70 110.95 1h6k s SER 280 Ca 0.15 1.93 0.02 0.00 1.31 0.00 0.00 55.95 59.36 1h6k s SER 280 Cb 0.07 -2.57 0.06 0.00 0.21 0.00 0.00 66.02 63.79 1h6k s SER 280 CO 0.11 -0.48 -0.11 -0.69 0.41 0.00 0.00 173.24 172.48 1h6k s VAL 281 N 1.35 2.05 0.10 3.43 1.01 -1.26 -4.97 120.40 122.11 1h6k s VAL 281 Ca 0.57 -1.49 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1h6k s VAL 281 Cb -0.27 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1h6k s VAL 281 CO 0.27 0.03 0.17 -0.31 0.00 0.00 0.00 175.10 175.26 1h6k s TYR 282 N 1.17 3.35 0.60 5.22 1.51 -1.26 -4.85 117.35 123.09 1h6k s TYR 282 Ca -0.07 0.13 -0.19 0.00 -1.01 0.00 0.00 57.07 55.92 1h6k s TYR 282 Cb -0.19 -1.66 -0.03 0.00 -0.11 0.00 0.00 41.96 39.97 1h6k s TYR 282 CO -0.06 0.54 1.20 -2.30 -1.11 0.00 0.00 175.55 173.82 1h6k n PRO 283 N 0.07 1.19 -1.42 -1.71 -0.02 -1.26 -4.97 135.00 126.88 1h6k n PRO 283 Ca -0.07 0.45 -0.32 0.00 -2.02 0.00 0.00 63.50 61.55 1h6k n PRO 283 Cb 0.52 -2.41 0.08 0.00 -0.02 0.00 0.00 33.50 31.67 1h6k n PRO 283 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1h6k s MET 284 N -3.02 2.44 0.87 -0.52 -1.94 -1.26 -4.89 119.30 110.97 1h6k s MET 284 Ca 0.77 1.23 -0.12 0.00 -1.71 0.00 0.00 55.69 55.87 1h6k s MET 284 Cb -0.41 -1.92 0.11 0.00 2.01 0.00 0.00 34.83 34.63 1h6k s MET 284 CO 0.45 -1.51 1.09 -1.25 -0.01 0.00 0.00 175.02 173.79 1h6k s PRO 285 N -4.67 1.50 0.14 2.03 0.04 -1.26 -5.07 135.00 127.71 1h6k s PRO 285 Ca 0.63 0.76 0.03 0.00 0.04 0.00 0.00 61.00 62.45 1h6k s PRO 285 Cb -0.18 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 1h6k s PRO 285 CO 0.52 -2.06 -0.06 1.03 0.04 0.00 0.00 177.00 176.47 1h6k s ARG 286 N -5.01 0.99 -0.04 4.56 0.52 -1.26 -4.99 118.95 113.72 1h6k s ARG 286 Ca 0.63 -1.43 0.07 0.00 -0.52 0.00 0.00 55.73 54.47 1h6k s ARG 286 Cb -0.17 -0.37 -0.01 0.00 0.52 0.00 0.00 34.95 34.91 1h6k s ARG 286 CO 0.56 -0.01 -0.24 0.08 0.02 0.00 0.00 175.30 175.70 1h6k s VAL 287 N -3.52 1.97 -0.31 3.52 1.01 -1.26 -0.90 120.40 120.91 1h6k s VAL 287 Ca 0.17 -1.04 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 1h6k s VAL 287 Cb 0.05 -1.65 0.01 0.00 0.00 0.00 0.00 36.38 34.78 1h6k s VAL 287 CO -0.01 0.55 1.11 -0.63 0.00 0.00 0.00 175.10 176.13 1h6k s ILE 288 N -0.32 4.45 0.17 2.22 -1.09 0.18 -4.89 121.20 121.93 1h6k s ILE 288 Ca 0.02 1.68 -0.31 0.00 -2.23 0.00 0.00 60.65 59.80 1h6k s ILE 288 Cb -0.12 -4.36 -0.09 0.00 -1.58 0.00 0.00 42.46 36.31 1h6k s ILE 288 CO 0.02 -0.46 1.48 0.12 -1.23 0.00 0.00 174.94 174.87 1h6k s PHE 289 N 3.74 3.11 -0.12 3.97 5.36 -1.26 -3.80 117.98 128.97 1h6k s PHE 289 Ca 0.47 0.82 -0.05 0.00 -0.96 0.00 0.00 56.93 57.22 1h6k s PHE 289 Cb -0.13 -3.82 0.06 0.00 -0.34 0.00 0.00 43.02 38.78 1h6k s PHE 289 CO 0.16 -2.92 0.25 0.50 -1.46 0.00 0.00 175.22 171.76 1h6k s ARG 290 N 0.78 0.14 0.00 10.12 6.06 -1.26 -4.99 118.95 129.80 1h6k s ARG 290 Ca 0.66 0.71 0.00 0.00 -2.50 0.00 0.00 55.73 54.59 1h6k s ARG 290 Cb -0.41 -0.07 0.00 0.00 0.06 0.00 0.00 34.95 34.53 1h6k s ARG 290 CO 0.34 -0.27 0.00 0.00 -2.50 0.00 0.00 175.30 172.86 1h6k n MET 291 N 5.22 2.46 -4.04 5.12 0.00 -1.26 -4.78 117.12 119.84 1h6k n MET 291 Ca -0.08 0.00 -0.32 0.00 0.00 0.00 0.00 57.70 57.30 1h6k n MET 291 Cb 0.50 -0.68 -0.06 0.00 0.00 0.00 0.00 33.22 32.98 1h6k n MET 291 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 1h6k s PHE 292 N -1.09 3.29 0.35 3.17 0.08 -1.26 -4.99 117.98 117.52 1h6k s PHE 292 Ca 0.00 0.16 0.06 0.00 0.12 0.00 0.00 56.93 57.27 1h6k s PHE 292 Cb 0.00 -1.69 -0.03 0.00 -0.57 0.00 0.00 43.02 40.73 1h6k s PHE 292 CO 0.00 0.55 0.23 0.16 -0.10 0.00 0.00 175.22 176.05 1h6k s ASP 293 N -2.15 1.92 0.60 1.36 3.84 -1.26 -4.93 116.67 116.05 1h6k s ASP 293 Ca 0.28 -1.72 0.30 0.00 -0.00 0.00 0.00 52.55 51.41 1h6k s ASP 293 Cb -0.12 0.54 1.70 0.00 -1.38 0.00 0.00 42.92 43.66 1h6k s ASP 293 CO 0.20 -1.02 2.08 0.10 -0.00 0.00 0.00 175.17 176.53 1h6k h TYR 294 N 2.06 0.00 0.00 2.11 -0.00 -1.91 -0.11 116.97 119.12 1h6k h TYR 294 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.45 1h6k h TYR 294 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.98 1h6k h TYR 294 CO 1.59 0.00 0.00 1.79 -0.00 0.00 0.00 178.16 181.54 1h6k h THR 295 N 0.00 0.00 0.00 -0.90 1.35 -1.97 -3.00 112.91 108.39 1h6k h THR 295 Ca 0.08 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1h6k h THR 295 Cb 0.54 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.15 1h6k h THR 295 CO -0.00 0.00 -0.04 0.47 -0.25 0.00 0.00 175.52 175.70 1h6k n ASP 296 N -2.38 0.50 -3.19 5.36 8.00 -0.05 -3.75 116.55 121.05 1h6k n ASP 296 Ca 0.03 0.50 -0.21 0.00 0.71 0.00 0.00 54.79 55.82 1h6k n ASP 296 Cb 0.30 -0.61 -0.05 0.00 -0.02 0.00 0.00 41.12 40.73 1h6k n ASP 296 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1h6k n ASP 297 N -1.96 0.87 0.05 -2.24 2.03 -1.14 -4.99 116.55 109.18 1h6k n ASP 297 Ca 0.06 -2.93 0.08 0.00 0.52 0.00 0.00 54.79 52.52 1h6k n ASP 297 Cb 0.40 -0.63 0.36 0.00 -0.72 0.00 0.00 41.12 40.52 1h6k n ASP 297 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1h6k n PRO 298 N 0.73 0.07 -0.05 -0.67 -0.04 -1.22 -2.01 135.00 131.82 1h6k n PRO 298 Ca 0.24 0.36 0.05 0.00 -0.04 0.00 0.00 63.50 64.10 1h6k n PRO 298 Cb 0.58 -1.65 0.07 0.00 -0.04 0.00 0.00 33.50 32.46 1h6k n PRO 298 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1h6k n GLU 299 N -1.79 1.10 -0.53 0.54 1.02 -1.26 -5.03 120.64 114.69 1h6k n GLU 299 Ca 0.02 -1.34 0.00 0.00 -0.02 0.00 0.00 57.16 55.82 1h6k n GLU 299 Cb 0.16 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1h6k n GLU 299 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h6k n GLY 300 N 0.50 1.00 3.75 0.62 0.00 -0.85 -5.03 105.19 105.17 1h6k n GLY 300 Ca 0.07 -1.97 -0.41 0.00 0.00 0.00 0.00 46.02 43.71 1h6k n GLY 300 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h6k s PRO 301 N -1.33 4.36 -0.11 1.61 0.04 -1.26 -4.85 135.00 133.45 1h6k s PRO 301 Ca 0.00 2.17 -0.35 0.00 0.04 0.00 0.00 61.00 62.86 1h6k s PRO 301 Cb 0.00 -3.12 -0.13 0.00 0.04 0.00 0.00 34.50 31.29 1h6k s PRO 301 CO 0.00 -0.24 1.84 0.28 0.04 0.00 0.00 177.00 178.92 1h6k n VAL 302 N 1.74 0.50 -1.83 -0.36 0.31 -1.26 -4.53 118.33 112.91 1h6k n VAL 302 Ca 0.03 -0.09 -0.42 0.00 -0.01 0.00 0.00 64.34 63.86 1h6k n VAL 302 Cb 0.42 -1.73 -0.02 0.00 -0.91 0.00 0.00 33.84 31.59 1h6k n VAL 302 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 1h6k s MET 303 N 3.83 4.16 0.23 5.55 1.75 -1.26 -4.88 119.30 128.67 1h6k s MET 303 Ca 0.93 2.51 -0.32 0.00 -1.25 0.00 0.00 55.69 57.56 1h6k s MET 303 Cb -0.76 -3.08 -0.13 0.00 2.84 0.00 0.00 34.83 33.70 1h6k s MET 303 CO 0.54 -0.64 1.48 -2.30 -0.65 0.00 0.00 175.02 173.45 1h6k n PRO 304 N 3.13 2.18 -1.25 4.11 -0.02 -1.26 -4.67 135.00 137.21 1h6k n PRO 304 Ca 0.12 0.78 -0.31 0.00 -2.02 0.00 0.00 63.50 62.07 1h6k n PRO 304 Cb 0.37 -2.49 0.11 0.00 -0.02 0.00 0.00 33.50 31.47 1h6k n PRO 304 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1h6k s GLY 305 N 0.48 1.65 0.44 -1.23 0.00 -1.26 -4.76 107.32 102.64 1h6k s GLY 305 Ca 0.70 0.13 0.20 0.00 0.00 0.00 0.00 44.72 45.75 1h6k s GLY 305 CO 0.46 0.53 1.85 1.76 0.00 0.00 0.00 173.10 177.71 1h6k h SER 306 N -1.27 0.35 -0.64 1.64 0.02 -1.92 -1.05 113.55 110.68 1h6k h SER 306 Ca -0.46 0.04 -0.17 0.00 -0.84 0.00 0.00 61.79 60.37 1h6k h SER 306 Cb 1.25 -0.02 -0.10 0.00 0.14 0.00 0.00 62.40 63.67 1h6k h SER 306 CO 0.53 0.13 0.19 1.41 -1.14 0.00 0.00 176.83 177.94 1h6k n HIS 307 N -4.48 2.14 -3.81 3.45 8.25 -1.26 -4.85 115.22 114.66 1h6k n HIS 307 Ca 0.20 -1.15 -0.31 0.00 -0.26 0.00 0.00 57.72 56.20 1h6k n HIS 307 Cb 0.76 -0.61 -0.04 0.00 1.12 0.00 0.00 29.99 31.21 1h6k n HIS 307 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1h6k s SER 308 N -1.24 6.41 0.48 0.41 1.04 -0.40 -4.09 113.70 116.32 1h6k s SER 308 Ca 0.53 0.41 0.27 0.00 0.48 0.00 0.00 55.95 57.64 1h6k s SER 308 Cb 0.43 -2.02 0.80 0.00 0.10 0.00 0.00 66.02 65.33 1h6k s SER 308 CO 0.12 0.11 1.77 -0.37 0.98 0.00 0.00 173.24 175.86 1h6k h VAL 309 N 2.04 0.04 -0.18 5.02 -1.51 -1.88 -3.02 116.25 116.76 1h6k h VAL 309 Ca -0.46 -0.83 0.00 0.00 -1.23 0.00 0.00 66.70 64.19 1h6k h VAL 309 Cb 1.16 1.79 -0.01 0.00 -2.13 0.00 0.00 31.29 32.11 1h6k h VAL 309 CO 0.74 0.02 0.11 -0.33 -1.23 0.00 0.00 177.57 176.89 1h6k h GLU 310 N 0.00 0.24 -0.75 5.19 3.07 -1.93 0.06 114.58 120.46 1h6k h GLU 310 Ca -0.00 -0.02 0.05 0.00 -0.50 0.00 0.00 59.36 58.89 1h6k h GLU 310 Cb 0.79 -0.05 -0.05 0.00 -0.84 0.00 0.00 28.75 28.60 1h6k h GLU 310 CO 0.00 0.18 0.45 -0.09 -1.40 0.00 0.00 179.01 178.15 1h6k h ARG 311 N 0.23 0.82 0.20 2.33 9.65 -1.75 0.68 114.38 126.53 1h6k h ARG 311 Ca 0.06 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.89 1h6k h ARG 311 Cb -0.01 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 28.39 1h6k h ARG 311 CO -0.01 0.54 -0.10 0.35 2.80 0.00 0.00 179.97 183.55 1h6k h PHE 312 N 0.85 -0.25 -0.30 2.20 3.57 -1.33 -2.36 116.94 119.31 1h6k h PHE 312 Ca 0.32 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 1h6k h PHE 312 Cb 0.12 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1h6k h PHE 312 CO -0.05 -0.11 0.15 0.28 -2.23 0.00 0.00 178.31 176.35 1h6k h VAL 313 N -0.32 1.15 -0.32 1.41 2.07 -0.75 -0.42 116.25 119.06 1h6k h VAL 313 Ca -0.03 -0.41 0.06 0.00 0.82 0.00 0.00 66.70 67.15 1h6k h VAL 313 Cb 0.25 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 30.82 1h6k h VAL 313 CO 0.05 0.15 -0.03 0.40 0.02 0.00 0.00 177.57 178.15 1h6k h ILE 314 N 0.36 0.72 -0.45 4.57 2.04 -0.83 0.41 117.51 124.33 1h6k h ILE 314 Ca 0.11 -0.02 -0.12 0.00 1.00 0.00 0.00 64.86 65.82 1h6k h ILE 314 Cb 0.10 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1h6k h ILE 314 CO -0.01 0.01 -0.20 -0.33 0.00 0.00 0.00 178.15 177.62 1h6k h GLU 315 N 0.05 0.93 -0.19 2.37 5.08 -1.27 -0.07 114.58 121.48 1h6k h GLU 315 Ca 0.16 -0.40 0.01 0.00 -1.00 0.00 0.00 59.36 58.12 1h6k h GLU 315 Cb 0.23 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1h6k h GLU 315 CO -0.29 1.06 0.11 1.49 -1.00 0.00 0.00 179.01 180.38 1h6k h GLU 316 N 0.77 0.22 -0.68 2.33 4.57 -0.70 0.74 114.58 121.84 1h6k h GLU 316 Ca 0.10 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.23 1h6k h GLU 316 Cb 0.77 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.28 1h6k h GLU 316 CO 0.06 0.15 0.27 -0.91 -1.18 0.00 0.00 179.01 177.40 1h6k h ASN 317 N 0.23 0.94 -0.57 1.04 2.35 -0.76 0.10 115.58 118.90 1h6k h ASN 317 Ca 0.07 -0.17 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 1h6k h ASN 317 Cb -0.01 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.09 1h6k h ASN 317 CO -0.03 0.86 0.25 -0.07 -1.65 0.00 0.00 177.43 176.78 1h6k h LEU 318 N 0.96 0.78 -0.87 1.61 3.38 -0.61 0.13 115.31 120.70 1h6k h LEU 318 Ca 0.23 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1h6k h LEU 318 Cb 0.21 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1h6k h LEU 318 CO -0.02 0.72 0.53 0.45 0.09 0.00 0.00 178.44 180.22 1h6k h HIS 319 N 0.79 1.13 -0.51 1.13 3.86 -0.64 -2.02 115.15 118.88 1h6k h HIS 319 Ca 0.19 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.34 1h6k h HIS 319 Cb 0.17 -0.37 -0.02 0.00 1.06 0.00 0.00 27.41 28.25 1h6k h HIS 319 CO 0.01 0.74 0.05 0.00 0.86 0.00 0.00 177.93 179.59 1h6k h ILE 321 N 0.78 1.16 -0.99 0.00 2.04 -0.40 -1.26 117.51 118.83 1h6k h ILE 321 Ca 0.16 -0.47 0.04 0.00 1.00 0.00 0.00 64.86 65.59 1h6k h ILE 321 Cb 0.39 0.94 -0.06 0.00 -0.74 0.00 0.00 36.82 37.35 1h6k h ILE 321 CO 0.01 0.17 0.65 0.40 0.00 0.00 0.00 178.15 179.38 1h6k h ILE 322 N 0.33 1.16 -0.62 -0.67 2.04 -1.14 -1.59 117.51 117.02 1h6k h ILE 322 Ca 0.10 -0.43 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 1h6k h ILE 322 Cb 0.14 -0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.00 1h6k h ILE 322 CO -0.01 0.23 0.23 0.50 0.00 0.00 0.00 178.15 179.10 1h6k h LYS 323 N 1.24 0.90 0.00 2.37 3.64 -0.75 0.15 116.57 124.12 1h6k h LYS 323 Ca 0.40 -0.15 -0.06 0.00 -1.27 0.00 0.00 60.65 59.57 1h6k h LYS 323 Cb 0.03 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 1h6k h LYS 323 CO -0.13 0.75 -0.28 0.77 -2.27 0.00 0.00 179.45 178.29 1h6k h SER 324 N 0.89 0.00 0.00 4.20 0.02 -0.55 -3.36 113.55 114.75 1h6k h SER 324 Ca 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1h6k h SER 324 Cb 0.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.73 1h6k h SER 324 CO -0.02 0.28 -0.12 1.41 -1.14 0.00 0.00 176.83 177.24 1h6k n HIS 325 N -3.26 0.00 -0.05 3.45 8.25 -0.66 -4.85 115.22 118.09 1h6k n HIS 325 Ca 0.02 -0.41 0.13 0.00 -0.26 0.00 0.00 57.72 57.20 1h6k n HIS 325 Cb 0.56 -0.07 0.54 0.00 1.12 0.00 0.00 29.99 32.14 1h6k n HIS 325 CO 0.00 0.00 0.00 0.11 0.64 0.00 0.00 176.34 177.09 1h6k h TRP 326 N 0.00 0.34 0.00 4.41 5.08 -0.88 -1.37 115.95 123.53 1h6k h TRP 326 Ca 0.00 0.01 -0.07 0.00 1.08 0.00 0.00 58.89 59.91 1h6k h TRP 326 Cb 0.96 -0.11 -0.01 0.00 -3.00 0.00 0.00 29.16 27.00 1h6k h TRP 326 CO 0.02 0.16 -0.33 0.87 -1.28 0.00 0.00 178.44 177.88 1h6k h LYS 327 N 0.31 0.00 -3.67 0.12 1.57 -1.89 -3.38 116.57 109.64 1h6k h LYS 327 Ca 0.26 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.35 1h6k h LYS 327 Cb 0.61 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 32.56 1h6k h LYS 327 CO -0.06 0.33 -0.43 -1.21 -0.57 0.00 0.00 179.45 177.52 1h6k s GLU 328 N -4.19 2.41 0.42 3.15 0.41 -0.51 -4.97 118.70 115.42 1h6k s GLU 328 Ca -0.03 -2.47 0.14 0.00 -0.41 0.00 0.00 54.97 52.20 1h6k s GLU 328 Cb 0.14 -3.65 1.00 0.00 -1.78 0.00 0.00 34.13 29.84 1h6k s GLU 328 CO 0.71 -1.15 1.94 0.07 -0.49 0.00 0.00 175.26 176.34 1h6k h ARG 329 N 7.06 0.45 -0.18 1.61 0.11 -1.76 0.45 114.38 122.11 1h6k h ARG 329 Ca -0.04 -0.03 -0.10 0.00 0.10 0.00 0.00 59.98 59.92 1h6k h ARG 329 Cb 0.95 -0.10 -0.00 0.00 1.11 0.00 0.00 29.97 31.93 1h6k h ARG 329 CO 0.71 0.30 -0.29 0.87 0.10 0.00 0.00 179.97 181.65 1h6k h LYS 330 N 0.46 0.51 -0.46 0.08 6.56 -1.93 -1.08 116.57 120.72 1h6k h LYS 330 Ca 0.34 -0.31 -0.12 0.00 -1.06 0.00 0.00 60.65 59.50 1h6k h LYS 330 Cb 0.68 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.36 1h6k h LYS 330 CO -0.11 0.91 -0.19 1.15 -2.06 0.00 0.00 179.45 179.16 1h6k h THR 331 N 0.16 1.27 -0.23 -0.16 2.02 -1.64 -1.66 112.91 112.69 1h6k h THR 331 Ca 0.01 -1.34 0.02 0.00 0.77 0.00 0.00 66.41 65.87 1h6k h THR 331 Cb 0.87 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.43 1h6k h THR 331 CO 0.07 0.46 0.10 0.00 0.37 0.00 0.00 175.52 176.52 1h6k h ALA 333 N 1.12 1.02 -0.55 0.00 0.00 -1.12 -1.81 119.26 117.94 1h6k h ALA 333 Ca 0.10 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1h6k h ALA 333 Cb 0.04 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1h6k h ALA 333 CO -0.08 0.59 0.10 0.00 0.00 0.00 0.00 179.25 179.87 1h6k h ALA 334 N 1.20 0.72 -0.27 0.00 0.00 -0.81 -1.56 119.26 118.54 1h6k h ALA 334 Ca 0.27 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1h6k h ALA 334 Cb 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1h6k h ALA 334 CO -0.03 0.45 -0.25 1.96 0.00 0.00 0.00 179.25 181.38 1h6k h GLN 335 N 0.79 0.53 -0.30 0.00 1.08 -0.59 -1.06 115.11 115.56 1h6k h GLN 335 Ca 0.17 -0.20 -0.11 0.00 -1.45 0.00 0.00 58.65 57.06 1h6k h GLN 335 Cb 0.39 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.78 1h6k h GLN 335 CO 0.01 0.73 -0.24 -0.07 -0.95 0.00 0.00 178.83 178.31 1h6k h LEU 336 N 0.46 0.73 -1.21 1.46 3.38 -1.13 -2.57 115.31 116.44 1h6k h LEU 336 Ca 0.07 -0.45 -0.05 0.00 0.09 0.00 0.00 57.88 57.53 1h6k h LEU 336 Cb 0.68 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1h6k h LEU 336 CO 0.05 1.02 -0.26 0.58 0.09 0.00 0.00 178.44 179.93 1h6k h VAL 337 N 0.44 0.69 -0.42 1.22 2.07 -1.04 -2.78 116.25 116.43 1h6k h VAL 337 Ca 0.05 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.43 1h6k h VAL 337 Cb 0.80 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 1h6k h VAL 337 CO 0.06 0.25 0.00 -1.54 0.02 0.00 0.00 177.57 176.37 1h6k n SER 338 N -3.51 3.02 -4.62 0.57 3.41 -0.42 -4.93 113.62 107.14 1h6k n SER 338 Ca -0.00 -1.94 -0.51 0.00 -0.26 0.00 0.00 58.87 56.16 1h6k n SER 338 Cb 0.42 -0.27 -0.06 0.00 -0.26 0.00 0.00 64.21 64.04 1h6k n SER 338 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1h6k n TYR 339 N 1.19 2.06 -2.75 7.33 9.36 -0.98 -4.95 117.16 128.42 1h6k n TYR 339 Ca 0.19 0.17 -0.26 0.00 3.32 0.00 0.00 57.90 61.32 1h6k n TYR 339 Cb 0.52 -2.59 0.00 0.00 -0.63 0.00 0.00 39.34 36.64 1h6k n TYR 339 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1h6k s PRO 340 N 4.69 3.36 0.04 2.98 0.04 -1.26 -5.10 135.00 139.75 1h6k s PRO 340 Ca 0.99 -0.00 -0.27 0.00 0.04 0.00 0.00 61.00 61.75 1h6k s PRO 340 Cb -0.79 -2.42 0.07 0.00 0.04 0.00 0.00 34.50 31.39 1h6k s PRO 340 CO 0.53 -0.25 0.64 0.20 0.04 0.00 0.00 177.00 178.16 1h6k s GLY 341 N -4.14 -0.58 0.28 0.56 0.00 -1.26 -4.95 107.32 97.22 1h6k s GLY 341 Ca 0.47 0.95 -0.00 0.00 0.00 0.00 0.00 44.72 46.14 1h6k s GLY 341 CO 0.43 0.61 1.86 1.70 0.00 0.00 0.00 173.10 177.69 1h6k h LYS 342 N 2.61 1.04 -5.09 2.90 3.64 -1.21 -3.44 116.57 117.02 1h6k h LYS 342 Ca -0.30 -0.06 -0.43 0.00 -1.27 0.00 0.00 60.65 58.58 1h6k h LYS 342 Cb 1.21 -0.23 -0.14 0.00 -0.41 0.00 0.00 32.23 32.65 1h6k h LYS 342 CO 0.39 0.69 -0.60 -0.80 -2.27 0.00 0.00 179.45 176.85 1h6k s ASN 343 N -5.79 1.98 0.05 4.20 0.01 -1.23 -5.01 114.94 109.15 1h6k s ASN 343 Ca -0.12 -1.40 -0.31 0.00 -0.71 0.00 0.00 52.86 50.32 1h6k s ASN 343 Cb 0.21 0.05 -0.06 0.00 0.41 0.00 0.00 41.25 41.86 1h6k s ASN 343 CO 0.81 -0.68 1.34 -0.75 -1.51 0.00 0.00 177.10 176.32 1h6k s LYS 344 N -3.93 4.33 0.13 -0.60 2.20 -1.26 -5.02 119.74 115.59 1h6k s LYS 344 Ca 0.36 1.95 0.05 0.00 -0.36 0.00 0.00 55.97 57.97 1h6k s LYS 344 Cb 0.08 -3.40 -0.04 0.00 -1.51 0.00 0.00 37.83 32.96 1h6k s LYS 344 CO 0.15 -0.45 -0.11 0.96 -0.36 0.00 0.00 175.35 175.54 1h6k s ILE 345 N 1.60 1.17 -1.34 5.43 -4.36 -1.26 -4.81 121.20 117.64 1h6k s ILE 345 Ca 0.63 -1.84 -0.14 0.00 -0.26 0.00 0.00 60.65 59.03 1h6k s ILE 345 Cb -0.33 -1.62 -0.02 0.00 1.25 0.00 0.00 42.46 41.74 1h6k s ILE 345 CO 0.28 -0.59 2.30 -0.81 0.24 0.00 0.00 174.94 176.37 1h6k n PRO 346 N 0.23 2.72 -0.29 0.37 -0.04 -1.26 -4.79 135.00 131.93 1h6k n PRO 346 Ca -0.13 -2.33 0.10 0.00 -0.04 0.00 0.00 63.50 61.10 1h6k n PRO 346 Cb 0.59 -3.08 0.22 0.00 -0.04 0.00 0.00 33.50 31.19 1h6k n PRO 346 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1h6k h LEU 347 N 10.02 -0.31 -0.98 1.53 5.85 -1.99 0.12 115.31 129.56 1h6k h LEU 347 Ca 0.60 0.22 0.09 0.00 0.84 0.00 0.00 57.88 59.62 1h6k h LEU 347 Cb 0.55 0.37 -0.07 0.00 0.37 0.00 0.00 40.66 41.87 1h6k h LEU 347 CO 1.86 -0.22 0.63 0.78 -0.34 0.00 0.00 178.44 181.14 1h6k h ASN 348 N 0.10 0.97 -0.41 1.25 2.35 -1.97 0.17 115.58 118.04 1h6k h ASN 348 Ca 0.50 0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 56.23 1h6k h ASN 348 Cb 0.95 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 39.13 1h6k h ASN 348 CO -0.74 0.58 0.09 1.88 -1.65 0.00 0.00 177.43 177.59 1h6k h TYR 349 N 1.08 0.70 -0.62 1.19 -1.99 -1.39 -1.68 116.97 114.27 1h6k h TYR 349 Ca 0.45 -0.09 -0.03 0.00 2.00 0.00 0.00 58.73 61.06 1h6k h TYR 349 Cb 0.29 -0.20 -0.03 0.00 2.00 0.00 0.00 36.73 38.79 1h6k h TYR 349 CO -0.01 0.67 0.28 0.45 -0.00 0.00 0.00 178.16 179.55 1h6k h HIS 350 N 0.52 0.91 0.13 4.88 3.86 -0.91 0.81 115.15 125.35 1h6k h HIS 350 Ca 0.13 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1h6k h HIS 350 Cb 0.33 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.53 1h6k h HIS 350 CO 0.02 0.70 -0.06 0.82 0.86 0.00 0.00 177.93 180.27 1h6k h ILE 351 N 0.85 0.89 -0.72 2.45 2.04 -0.65 -0.43 117.51 121.94 1h6k h ILE 351 Ca 0.21 -0.05 -0.06 0.00 1.00 0.00 0.00 64.86 65.96 1h6k h ILE 351 Cb 0.15 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 1h6k h ILE 351 CO -0.02 0.01 0.21 0.58 0.00 0.00 0.00 178.15 178.93 1h6k h VAL 352 N -0.19 1.26 -0.57 1.67 2.07 -1.12 -1.29 116.25 118.09 1h6k h VAL 352 Ca -0.02 -0.92 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 1h6k h VAL 352 Cb 0.15 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1h6k h VAL 352 CO 0.03 0.36 0.18 -0.08 0.02 0.00 0.00 177.57 178.08 1h6k h GLU 353 N 1.08 0.88 -0.30 1.57 4.81 -0.70 -1.87 114.58 120.05 1h6k h GLU 353 Ca 0.23 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 1h6k h GLU 353 Cb 0.32 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 1h6k h GLU 353 CO -0.00 0.79 -0.16 0.28 -0.73 0.00 0.00 179.01 179.19 1h6k h VAL 354 N 0.79 1.24 -0.27 0.32 2.07 -0.81 0.47 116.25 120.07 1h6k h VAL 354 Ca 0.18 -1.11 -0.10 0.00 0.82 0.00 0.00 66.70 66.49 1h6k h VAL 354 Cb 0.28 1.19 -0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1h6k h VAL 354 CO -0.01 0.36 -0.24 0.40 0.02 0.00 0.00 177.57 178.11 1h6k h ILE 355 N 0.48 1.31 -0.11 4.57 2.04 -0.95 -1.07 117.51 123.77 1h6k h ILE 355 Ca 0.08 -1.39 -0.11 0.00 1.00 0.00 0.00 64.86 64.44 1h6k h ILE 355 Cb 0.56 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 1h6k h ILE 355 CO 0.04 0.44 -0.42 -0.26 0.00 0.00 0.00 178.15 177.95 1h6k h PHE 356 N 0.37 0.30 -0.75 1.37 0.04 -1.20 -0.90 116.94 116.17 1h6k h PHE 356 Ca 0.05 -0.08 0.06 0.00 2.80 0.00 0.00 57.97 60.79 1h6k h PHE 356 Cb 0.79 -0.07 -0.06 0.00 2.20 0.00 0.00 35.95 38.82 1h6k h PHE 356 CO 0.07 0.64 0.45 0.00 -0.60 0.00 0.00 178.31 178.87 1h6k h ALA 357 N 1.35 1.02 0.01 2.45 0.00 -0.57 -0.01 119.26 123.50 1h6k h ALA 357 Ca 0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1h6k h ALA 357 Cb 0.83 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1h6k h ALA 357 CO 0.07 0.17 -0.00 0.93 0.00 0.00 0.00 179.25 180.42 1h6k h GLU 358 N 0.84 -0.01 -0.95 0.00 5.08 -0.84 -2.03 114.58 116.66 1h6k h GLU 358 Ca 0.33 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.73 1h6k h GLU 358 Cb 0.15 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 1h6k h GLU 358 CO -0.17 0.46 0.63 1.25 -1.00 0.00 0.00 179.01 180.18 1h6k h LEU 359 N -0.48 1.04 -1.69 1.33 5.85 -0.95 -1.69 115.31 118.72 1h6k h LEU 359 Ca -0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1h6k h LEU 359 Cb 0.47 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1h6k h LEU 359 CO 0.00 0.71 0.00 0.49 -0.34 0.00 0.00 178.44 179.30 1h6k n PHE 360 N -4.44 0.31 -1.73 1.25 3.72 -0.04 -4.58 117.46 111.94 1h6k n PHE 360 Ca 0.13 -0.15 -0.42 0.00 -0.05 0.00 0.00 57.45 56.95 1h6k n PHE 360 Cb 0.10 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.63 1h6k n PHE 360 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 1h6k n GLN 361 N 0.91 2.50 -4.65 -1.08 7.27 -0.63 -4.86 117.38 116.83 1h6k n GLN 361 Ca 0.17 0.88 -0.33 0.00 0.07 0.00 0.00 57.00 57.79 1h6k n GLN 361 Cb 0.47 -2.60 -0.11 0.00 2.41 0.00 0.00 30.24 30.41 1h6k n GLN 361 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1h6k s LEU 362 N -0.81 3.08 0.25 1.69 1.43 -1.26 -2.61 118.68 120.45 1h6k s LEU 362 Ca 0.61 -0.08 0.04 0.00 -1.03 0.00 0.00 54.13 53.67 1h6k s LEU 362 Cb -0.53 -1.68 0.31 0.00 0.03 0.00 0.00 46.19 44.32 1h6k s LEU 362 CO 0.54 0.35 1.61 1.55 0.23 0.00 0.00 176.35 180.63 1h6k h PRO 363 N 5.14 0.29 -3.71 1.29 0.13 -1.91 -3.47 132.00 129.76 1h6k h PRO 363 Ca -0.48 -0.17 -0.13 0.00 -0.87 0.00 0.00 66.00 64.35 1h6k h PRO 363 Cb 1.17 0.01 -0.18 0.00 0.13 0.00 0.00 31.00 32.13 1h6k h PRO 363 CO 0.52 0.74 -0.49 0.00 -0.23 0.00 0.00 178.00 178.53 1h6k s ALA 364 N -3.96 -0.16 0.76 -0.56 0.00 -1.07 -4.74 121.76 112.02 1h6k s ALA 364 Ca -0.05 -0.43 -0.14 0.00 0.00 0.00 0.00 51.96 51.35 1h6k s ALA 364 Cb 0.12 0.23 0.06 0.00 0.00 0.00 0.00 23.12 23.53 1h6k s ALA 364 CO 0.79 -0.31 1.17 -2.14 0.00 0.00 0.00 175.76 175.28 1h6k s PRO 365 N -2.39 2.03 0.48 0.00 0.02 -1.24 -4.74 135.00 129.16 1h6k s PRO 365 Ca -0.07 1.61 0.15 0.00 0.02 0.00 0.00 61.00 62.72 1h6k s PRO 365 Cb -0.02 -1.84 1.11 0.00 0.02 0.00 0.00 34.50 33.78 1h6k s PRO 365 CO -0.03 -1.89 2.05 -1.35 -0.33 0.00 0.00 177.00 175.45 1h6k h PRO 366 N -0.63 0.00 -5.03 5.54 0.11 -1.95 -3.45 132.00 126.60 1h6k h PRO 366 Ca -0.46 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.30 1h6k h PRO 366 Cb 1.28 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.24 1h6k h PRO 366 CO 0.49 0.12 -0.67 -1.01 -0.21 0.00 0.00 178.00 176.71 1h6k s HIS 367 N -4.77 1.41 0.17 0.65 3.76 -1.26 -5.11 115.29 110.15 1h6k s HIS 367 Ca -0.04 -0.89 -0.33 0.00 -0.15 0.00 0.00 55.06 53.64 1h6k s HIS 367 Cb 0.16 -0.79 -0.15 0.00 1.11 0.00 0.00 32.58 32.91 1h6k s HIS 367 CO 0.68 -0.04 1.30 1.51 -0.85 0.00 0.00 174.74 177.35 1h6k n ILE 368 N -0.32 0.65 -0.26 0.60 3.06 -1.26 -4.85 119.36 116.98 1h6k n ILE 368 Ca -0.07 -0.16 0.06 0.00 -2.50 0.00 0.00 62.75 60.08 1h6k n ILE 368 Cb 0.63 -1.07 0.20 0.00 0.54 0.00 0.00 39.64 39.94 1h6k n ILE 368 CO 0.00 0.00 0.00 0.44 -2.50 0.00 0.00 176.55 174.49 1h6k h ASP 369 N 4.06 0.26 0.00 9.51 5.19 -1.98 -1.60 116.42 131.87 1h6k h ASP 369 Ca -0.45 0.12 -0.00 0.00 -0.62 0.00 0.00 57.03 56.08 1h6k h ASP 369 Cb 1.32 0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.93 1h6k h ASP 369 CO 0.75 0.08 -0.00 1.62 -3.12 0.00 0.00 179.24 178.57 1h6k h VAL 370 N 0.43 0.88 -0.92 -1.35 3.04 -2.01 -2.23 116.25 114.09 1h6k h VAL 370 Ca 0.44 -0.00 0.10 0.00 -1.01 0.00 0.00 66.70 66.22 1h6k h VAL 370 Cb 0.69 1.00 -0.08 0.00 -2.01 0.00 0.00 31.29 30.90 1h6k h VAL 370 CO -0.43 0.00 0.56 -0.03 -1.01 0.00 0.00 177.57 176.66 1h6k h MET 371 N 0.00 0.90 -0.40 4.17 -1.53 -1.64 -2.12 114.93 114.31 1h6k h MET 371 Ca -0.00 -0.05 -0.06 0.00 -3.44 0.00 0.00 59.70 56.15 1h6k h MET 371 Cb 0.00 -0.20 -0.02 0.00 -0.55 0.00 0.00 31.60 30.83 1h6k h MET 371 CO 0.00 0.60 -0.00 1.88 0.14 0.00 0.00 176.91 179.53 1h6k h TYR 372 N 0.93 0.68 -0.14 1.39 0.05 -1.55 0.21 116.97 118.54 1h6k h TYR 372 Ca 0.44 -0.08 -0.01 0.00 0.05 0.00 0.00 58.73 59.13 1h6k h TYR 372 Cb 0.38 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.92 1h6k h TYR 372 CO -0.03 0.65 0.05 1.15 -1.05 0.00 0.00 178.16 178.93 1h6k h THR 373 N 0.61 1.16 0.00 -2.88 2.02 -1.47 -0.93 112.91 111.42 1h6k h THR 373 Ca 0.13 -0.48 -0.14 0.00 0.77 0.00 0.00 66.41 66.69 1h6k h THR 373 Cb 0.39 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.99 1h6k h THR 373 CO 0.01 0.15 -0.65 0.71 0.37 0.00 0.00 175.52 176.11 1h6k h THR 374 N 0.07 1.39 -0.42 3.16 1.35 -1.17 -2.49 112.91 114.80 1h6k h THR 374 Ca 0.05 -2.28 -0.04 0.00 -0.55 0.00 0.00 66.41 63.58 1h6k h THR 374 Cb 0.18 2.25 -0.02 0.00 -1.73 0.00 0.00 68.15 68.84 1h6k h THR 374 CO -0.00 0.64 0.10 0.25 -0.25 0.00 0.00 175.52 176.25 1h6k h LEU 375 N 0.00 0.63 -1.12 3.87 5.85 -0.36 0.05 115.31 124.24 1h6k h LEU 375 Ca -0.01 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.44 1h6k h LEU 375 Cb 1.20 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1h6k h LEU 375 CO 0.08 0.70 0.14 -0.07 -0.34 0.00 0.00 178.44 178.96 1h6k h LEU 376 N 0.53 0.71 -0.50 2.25 3.38 -1.03 0.12 115.31 120.76 1h6k h LEU 376 Ca 0.13 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1h6k h LEU 376 Cb 0.32 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1h6k h LEU 376 CO 0.00 0.68 0.10 0.40 0.09 0.00 0.00 178.44 179.71 1h6k h ILE 377 N 0.75 1.25 -0.62 1.22 2.04 -1.03 0.70 117.51 121.82 1h6k h ILE 377 Ca 0.17 -0.91 -0.02 0.00 1.00 0.00 0.00 64.86 65.10 1h6k h ILE 377 Cb 0.24 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1h6k h ILE 377 CO -0.01 0.33 0.29 -0.33 0.00 0.00 0.00 178.15 178.43 1h6k h GLU 378 N 0.71 0.89 -0.72 2.37 4.39 -0.35 -1.94 114.58 119.93 1h6k h GLU 378 Ca 0.16 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 1h6k h GLU 378 Cb 0.38 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.83 1h6k h GLU 378 CO 0.01 0.72 0.40 -0.07 -1.16 0.00 0.00 179.01 178.91 1h6k h LEU 379 N 0.85 0.89 -1.03 1.33 3.38 -0.51 -0.71 115.31 119.50 1h6k h LEU 379 Ca 0.21 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1h6k h LEU 379 Cb 0.13 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1h6k h LEU 379 CO -0.03 0.72 0.57 0.00 0.09 0.00 0.00 178.44 179.79 1h6k h LYS 381 N 1.25 0.48 0.05 0.00 1.57 -0.89 -2.44 116.57 116.59 1h6k h LYS 381 Ca 0.33 -0.20 -0.25 0.00 -1.87 0.00 0.00 60.65 58.66 1h6k h LYS 381 Cb -0.08 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.22 1h6k h LYS 381 CO -0.06 0.73 -1.07 1.25 -0.57 0.00 0.00 179.45 179.73 1h6k h LEU 382 N 0.42 0.56 -5.82 2.94 5.85 -0.47 -3.35 115.31 115.43 1h6k h LEU 382 Ca 0.05 -0.49 -0.57 0.00 0.84 0.00 0.00 57.88 57.71 1h6k h LEU 382 Cb 0.74 -0.17 -0.41 0.00 0.37 0.00 0.00 40.66 41.18 1h6k h LEU 382 CO 0.06 1.32 -0.78 0.00 -0.34 0.00 0.00 178.44 178.70 1h6k n GLN 383 N -3.70 2.28 0.28 1.25 1.13 -0.22 -4.93 117.38 113.48 1h6k n GLN 383 Ca -0.08 -4.33 0.14 0.00 -1.94 0.00 0.00 57.00 50.78 1h6k n GLN 383 Cb 0.91 -2.01 0.80 0.00 0.11 0.00 0.00 30.24 30.05 1h6k n GLN 383 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1h6k h PRO 384 N 3.56 0.00 -0.01 -1.09 0.11 -1.58 -0.71 132.00 132.28 1h6k h PRO 384 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1h6k h PRO 384 Cb 0.68 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1h6k h PRO 384 CO 0.73 0.08 -0.27 0.41 -0.21 0.00 0.00 178.00 178.73 1h6k n GLY 385 N -0.91 -0.67 0.00 -0.55 0.00 -1.26 -4.65 105.19 97.15 1h6k n GLY 385 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1h6k n GLY 385 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h6k n SER 386 N -0.73 0.17 -0.03 1.61 3.41 -0.88 -4.94 113.62 112.23 1h6k n SER 386 Ca 0.12 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.56 1h6k n SER 386 Cb 0.34 0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 64.23 1h6k n SER 386 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1h6k h LEU 387 N 0.00 0.85 -0.91 1.04 7.12 -1.42 -3.26 115.31 118.73 1h6k h LEU 387 Ca 0.00 -0.62 0.09 0.00 0.13 0.00 0.00 57.88 57.48 1h6k h LEU 387 Cb 0.04 -0.25 -0.07 0.00 -0.53 0.00 0.00 40.66 39.85 1h6k h LEU 387 CO 0.00 1.33 0.56 -0.65 -0.13 0.00 0.00 178.44 179.55 1h6k h PRO 388 N 0.42 0.92 -0.44 5.25 0.11 -1.83 -0.35 132.00 136.08 1h6k h PRO 388 Ca -0.04 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.03 1h6k h PRO 388 Cb 1.30 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 1h6k h PRO 388 CO 0.14 0.61 0.27 1.96 -0.21 0.00 0.00 178.00 180.77 1h6k h GLN 389 N 0.95 0.54 -0.40 1.05 7.50 -1.92 0.55 115.11 123.38 1h6k h GLN 389 Ca 0.43 -0.03 -0.02 0.00 0.50 0.00 0.00 58.65 59.52 1h6k h GLN 389 Cb 0.33 -0.12 -0.02 0.00 0.05 0.00 0.00 27.48 27.72 1h6k h GLN 389 CO -0.23 0.35 0.16 0.28 -1.50 0.00 0.00 178.83 177.89 1h6k h VAL 390 N 0.55 1.20 -0.74 -0.54 2.07 -1.42 0.20 116.25 117.56 1h6k h VAL 390 Ca 0.17 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 1h6k h VAL 390 Cb -0.02 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1h6k h VAL 390 CO -0.07 0.22 0.36 0.25 0.02 0.00 0.00 177.57 178.36 1h6k h LEU 391 N 0.50 0.96 -0.90 2.57 5.85 -0.75 0.22 115.31 123.75 1h6k h LEU 391 Ca 0.13 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1h6k h LEU 391 Cb 0.19 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1h6k h LEU 391 CO -0.01 0.82 0.02 0.00 -0.34 0.00 0.00 178.44 178.94 1h6k h ALA 392 N 1.18 1.09 -0.41 1.25 0.00 -0.61 0.13 119.26 121.89 1h6k h ALA 392 Ca 0.25 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1h6k h ALA 392 Cb 0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1h6k h ALA 392 CO -0.03 0.58 -0.04 0.37 0.00 0.00 0.00 179.25 180.13 1h6k h GLN 393 N 0.78 0.74 -0.75 0.00 4.15 -0.30 -2.15 115.11 117.58 1h6k h GLN 393 Ca 0.15 -0.26 -0.01 0.00 0.77 0.00 0.00 58.65 59.31 1h6k h GLN 393 Cb 0.44 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.03 1h6k h GLN 393 CO 0.02 0.85 0.43 0.00 -1.93 0.00 0.00 178.83 178.19 1h6k h ALA 394 N 0.87 1.35 -0.41 3.38 0.00 -0.09 -2.05 119.26 122.30 1h6k h ALA 394 Ca 0.11 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1h6k h ALA 394 Cb 0.54 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1h6k h ALA 394 CO 0.03 0.55 0.07 1.15 0.00 0.00 0.00 179.25 181.05 1h6k h THR 395 N 1.04 1.24 -0.56 0.00 2.02 -0.80 0.02 112.91 115.86 1h6k h THR 395 Ca 0.27 -0.86 0.03 0.00 0.77 0.00 0.00 66.41 66.62 1h6k h THR 395 Cb -0.01 1.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.37 1h6k h THR 395 CO -0.05 0.30 0.32 -0.08 0.37 0.00 0.00 175.52 176.38 1h6k h GLU 396 N 0.54 0.61 -0.43 6.66 4.57 -1.11 -0.37 114.58 125.06 1h6k h GLU 396 Ca 0.13 -0.04 -0.09 0.00 -1.18 0.00 0.00 59.36 58.18 1h6k h GLU 396 Cb 0.36 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 1h6k h GLU 396 CO 0.01 0.41 -0.08 0.52 -1.18 0.00 0.00 179.01 178.68 1h6k h MET 397 N 0.63 0.81 -0.38 1.92 2.86 -1.07 0.43 114.93 120.14 1h6k h MET 397 Ca 0.23 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1h6k h MET 397 Cb 0.06 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 1h6k h MET 397 CO -0.12 0.92 0.21 -0.07 1.06 0.00 0.00 176.91 178.91 1h6k h LEU 398 N 0.64 0.48 -0.32 1.22 3.38 -0.79 -1.36 115.31 118.56 1h6k h LEU 398 Ca 0.11 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.03 1h6k h LEU 398 Cb 0.60 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 1h6k h LEU 398 CO 0.04 0.43 0.09 0.22 0.09 0.00 0.00 178.44 179.31 1h6k h TYR 399 N 0.49 0.16 0.00 1.13 3.20 -0.81 -2.20 116.97 118.93 1h6k h TYR 399 Ca 0.13 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.02 1h6k h TYR 399 Cb 0.06 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.30 1h6k h TYR 399 CO -0.03 0.06 0.00 -1.33 -1.64 0.00 0.00 178.16 175.22 1h6k n MET 400 N -5.05 0.17 -0.23 1.82 2.81 0.12 -2.21 117.12 114.55 1h6k n MET 400 Ca 0.00 0.45 0.07 0.00 -1.81 0.00 0.00 57.70 56.41 1h6k n MET 400 Cb 0.12 -1.86 0.19 0.00 -0.71 0.00 0.00 33.22 30.97 1h6k n MET 400 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1h6k n ARG 401 N -2.18 2.87 0.08 0.03 1.74 -0.56 -4.65 116.66 113.98 1h6k n ARG 401 Ca 0.02 -2.21 0.15 0.00 -0.77 0.00 0.00 57.85 55.04 1h6k n ARG 401 Cb 0.19 -1.35 0.65 0.00 -1.02 0.00 0.00 32.46 30.93 1h6k n ARG 401 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1h6k h LEU 402 N 2.48 0.04 -1.29 0.55 3.38 -1.11 -3.17 115.31 116.20 1h6k h LEU 402 Ca 0.00 0.00 0.24 0.00 0.09 0.00 0.00 57.88 58.21 1h6k h LEU 402 Cb 0.81 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.46 1h6k h LEU 402 CO 0.01 0.02 0.64 0.44 0.09 0.00 0.00 178.44 179.64 1h6k h ASP 403 N 0.04 0.53 -0.07 -0.43 3.32 -1.84 -1.88 116.42 116.09 1h6k h ASP 403 Ca 0.17 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1h6k h ASP 403 Cb 0.62 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1h6k h ASP 403 CO -0.01 0.14 0.00 0.35 -1.72 0.00 0.00 179.24 178.00 1h6k n THR 404 N -4.65 1.65 -2.33 0.35 -2.24 -1.20 -4.93 114.28 100.94 1h6k n THR 404 Ca 0.24 -1.78 -0.41 0.00 -2.27 0.00 0.00 64.05 59.83 1h6k n THR 404 Cb 0.77 0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.98 1h6k n THR 404 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1h6k s MET 405 N -2.24 4.47 0.33 -0.78 0.00 -0.71 -2.35 119.30 118.02 1h6k s MET 405 Ca 0.25 1.94 -0.29 0.00 0.00 0.00 0.00 55.69 57.58 1h6k s MET 405 Cb 0.20 -3.21 -0.11 0.00 0.00 0.00 0.00 34.83 31.72 1h6k s MET 405 CO 0.04 -0.10 1.49 1.21 0.00 0.00 0.00 175.02 177.66 1h6k s ASN 406 N 0.02 6.44 0.28 1.11 3.84 0.60 -4.80 114.94 122.43 1h6k s ASN 406 Ca 0.52 2.93 0.02 0.00 0.21 0.00 0.00 52.86 56.54 1h6k s ASN 406 Cb -0.34 -2.65 0.65 0.00 -0.55 0.00 0.00 41.25 38.36 1h6k s ASN 406 CO 0.39 -0.82 1.75 0.74 -2.79 0.00 0.00 177.10 176.36 1h6k h THR 407 N 3.19 0.65 -0.88 -5.21 2.02 -1.91 -0.40 112.91 110.37 1h6k h THR 407 Ca -0.49 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.49 1h6k h THR 407 Cb 1.23 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 1h6k h THR 407 CO 0.71 0.11 0.56 0.74 0.37 0.00 0.00 175.52 178.01 1h6k h THR 408 N 0.59 1.24 -0.12 3.16 2.02 -1.90 -1.27 112.91 116.62 1h6k h THR 408 Ca 0.52 -0.47 -0.14 0.00 0.77 0.00 0.00 66.41 67.09 1h6k h THR 408 Cb 0.84 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1h6k h THR 408 CO -0.42 0.24 -0.54 0.00 0.37 0.00 0.00 175.52 175.17 1h6k h VAL 410 N 0.27 1.25 -0.49 0.00 2.07 -0.19 -0.67 116.25 118.49 1h6k h VAL 410 Ca 0.01 -0.86 0.06 0.00 0.82 0.00 0.00 66.70 66.73 1h6k h VAL 410 Cb 1.03 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 1h6k h VAL 410 CO 0.09 0.33 0.19 0.44 0.02 0.00 0.00 177.57 178.65 1h6k h ASP 411 N 1.00 0.23 -0.79 0.57 5.19 -1.19 0.17 116.42 121.59 1h6k h ASP 411 Ca 0.22 0.05 -0.04 0.00 -0.62 0.00 0.00 57.03 56.64 1h6k h ASP 411 Cb 0.28 0.02 -0.04 0.00 0.18 0.00 0.00 39.33 39.78 1h6k h ASP 411 CO -0.01 0.16 0.34 0.03 -3.12 0.00 0.00 179.24 176.64 1h6k h ARG 412 N 0.38 1.17 -0.13 3.56 3.08 -1.34 0.45 114.38 121.55 1h6k h ARG 412 Ca 0.23 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1h6k h ARG 412 Cb 0.21 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1h6k h ARG 412 CO -0.21 0.93 0.08 0.35 -1.07 0.00 0.00 179.97 180.05 1h6k h PHE 413 N 1.15 0.18 -0.16 3.04 3.57 -0.63 0.17 116.94 124.25 1h6k h PHE 413 Ca 0.27 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.79 1h6k h PHE 413 Cb 0.18 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 1h6k h PHE 413 CO 0.02 0.18 0.02 0.82 -2.23 0.00 0.00 178.31 177.12 1h6k h ILE 414 N 0.13 0.92 -0.34 1.41 2.04 -0.40 0.12 117.51 121.40 1h6k h ILE 414 Ca 0.05 -0.03 -0.12 0.00 1.00 0.00 0.00 64.86 65.76 1h6k h ILE 414 Cb 0.05 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1h6k h ILE 414 CO -0.01 0.02 -0.27 0.78 0.00 0.00 0.00 178.15 178.66 1h6k h ASN 415 N 0.09 0.71 0.30 1.72 2.35 -0.79 -2.14 115.58 117.81 1h6k h ASN 415 Ca 0.07 -0.27 -0.01 0.00 -0.55 0.00 0.00 56.30 55.54 1h6k h ASN 415 Cb 0.07 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.25 1h6k h ASN 415 CO -0.10 0.95 -0.14 -0.25 -1.65 0.00 0.00 177.43 176.23 1h6k h TRP 416 N 0.60 -0.38 -0.62 1.19 7.01 -0.45 -2.91 115.95 120.39 1h6k h TRP 416 Ca 0.08 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.03 1h6k h TRP 416 Cb 0.77 0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 27.93 1h6k h TRP 416 CO 0.04 -0.06 0.22 0.35 -2.79 0.00 0.00 178.44 176.20 1h6k h PHE 417 N -0.70 0.96 -0.45 2.65 3.57 -0.71 0.16 116.94 122.42 1h6k h PHE 417 Ca -0.04 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.36 1h6k h PHE 417 Cb 0.48 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1h6k h PHE 417 CO 0.02 0.78 0.23 0.66 -2.23 0.00 0.00 178.31 177.76 1h6k h SER 418 N 0.87 0.59 -0.44 0.41 4.64 -1.51 0.49 113.55 118.60 1h6k h SER 418 Ca 0.20 -0.12 -0.04 0.00 -0.47 0.00 0.00 61.79 61.36 1h6k h SER 418 Cb 0.24 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 1h6k h SER 418 CO -0.01 0.54 0.11 -0.74 -0.87 0.00 0.00 176.83 175.86 1h6k h HIS 419 N 0.59 0.73 -0.34 4.77 -0.00 -1.24 -1.89 115.15 117.78 1h6k h HIS 419 Ca 0.16 -0.08 0.04 0.00 -0.00 0.00 0.00 60.37 60.48 1h6k h HIS 419 Cb 0.10 -0.21 -0.04 0.00 -0.00 0.00 0.00 27.41 27.27 1h6k h HIS 419 CO -0.01 0.67 0.12 1.25 -0.00 0.00 0.00 177.93 179.96 1h6k h HIS 420 N 0.57 0.21 -0.61 5.26 6.17 -0.50 -2.20 115.15 124.05 1h6k h HIS 420 Ca 0.14 0.02 0.04 0.00 0.71 0.00 0.00 60.37 61.28 1h6k h HIS 420 Cb 0.31 -0.04 -0.03 0.00 2.52 0.00 0.00 27.41 30.16 1h6k h HIS 420 CO 0.02 0.09 0.41 -0.07 0.71 0.00 0.00 177.93 179.08 1h6k h LEU 421 N 0.26 0.60 -1.03 0.26 3.38 -0.57 -1.24 115.31 116.97 1h6k h LEU 421 Ca 0.15 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1h6k h LEU 421 Cb 0.13 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1h6k h LEU 421 CO -0.16 0.41 0.00 0.77 0.09 0.00 0.00 178.44 179.55 1h6k h SER 422 N 0.69 0.00 -0.02 -0.43 4.64 -0.70 0.68 113.55 118.40 1h6k h SER 422 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1h6k h SER 422 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1h6k h SER 422 CO -0.07 0.00 -0.01 0.59 -0.87 0.00 0.00 176.83 176.47 1h6k n ASN 423 N -2.45 2.35 -2.63 4.97 3.02 -0.48 -4.20 115.26 115.83 1h6k n ASN 423 Ca 0.01 -1.78 -0.09 0.00 -0.03 0.00 0.00 54.58 52.69 1h6k n ASN 423 Cb 0.22 0.01 0.03 0.00 -0.61 0.00 0.00 39.78 39.43 1h6k n ASN 423 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1h6k n PHE 424 N 0.83 1.65 -2.41 3.10 3.72 -0.44 -4.97 117.46 118.94 1h6k n PHE 424 Ca 0.16 -2.51 -0.15 0.00 -0.05 0.00 0.00 57.45 54.90 1h6k n PHE 424 Cb 0.49 -0.28 -0.01 0.00 -0.94 0.00 0.00 39.48 38.74 1h6k n PHE 424 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1h6k n GLN 425 N -0.39 -2.06 -2.69 -1.08 6.02 -1.15 -1.93 117.38 114.10 1h6k n GLN 425 Ca 0.16 0.72 -0.18 0.00 -0.01 0.00 0.00 57.00 57.69 1h6k n GLN 425 Cb 0.81 -5.33 0.00 0.00 1.02 0.00 0.00 30.24 26.74 1h6k n GLN 425 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1h6k n PHE 426 N -3.53 -1.48 -2.96 1.08 3.72 0.22 -4.92 117.46 109.59 1h6k n PHE 426 Ca -0.17 0.18 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 1h6k n PHE 426 Cb 0.63 -3.45 -0.05 0.00 -0.94 0.00 0.00 39.48 35.66 1h6k n PHE 426 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1h6k s ARG 427 N -5.32 3.95 0.01 -1.08 0.52 -0.81 -4.97 118.95 111.25 1h6k s ARG 427 Ca 0.12 0.54 -0.13 0.00 -0.52 0.00 0.00 55.73 55.75 1h6k s ARG 427 Cb -0.06 -3.73 0.02 0.00 0.52 0.00 0.00 34.95 31.70 1h6k s ARG 427 CO 0.15 -0.67 0.27 -0.46 0.02 0.00 0.00 175.30 174.61 1h6k s TRP 428 N 2.92 -0.10 -1.25 -0.53 -0.11 -1.26 -5.02 118.94 113.60 1h6k s TRP 428 Ca 0.31 0.06 -0.11 0.00 1.22 0.00 0.00 56.10 57.59 1h6k s TRP 428 Cb -0.14 0.06 0.18 0.00 -1.50 0.00 0.00 33.47 32.06 1h6k s TRP 428 CO 0.13 -0.41 1.69 -1.13 -4.62 0.00 0.00 176.95 172.61 1h6k n SER 429 N 1.06 5.19 -0.12 5.86 3.41 -1.26 -4.81 113.62 122.95 1h6k n SER 429 Ca -0.21 -3.07 0.16 0.00 -0.26 0.00 0.00 58.87 55.50 1h6k n SER 429 Cb 0.57 -1.50 0.55 0.00 -0.26 0.00 0.00 64.21 63.56 1h6k n SER 429 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1h6k h TRP 430 N 6.27 0.37 -0.80 7.33 4.06 -1.97 -0.32 115.95 130.88 1h6k h TRP 430 Ca 0.36 0.01 0.23 0.00 2.06 0.00 0.00 58.89 61.55 1h6k h TRP 430 Cb 0.72 -0.12 -0.03 0.00 -1.00 0.00 0.00 29.16 28.74 1h6k h TRP 430 CO 1.18 0.14 0.58 1.05 -3.56 0.00 0.00 178.44 177.84 1h6k h GLU 431 N 0.32 0.00 0.00 0.49 9.09 -2.00 0.39 114.58 122.87 1h6k h GLU 431 Ca 0.34 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.74 1h6k h GLU 431 Cb 0.87 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.97 1h6k h GLU 431 CO -0.09 0.00 -0.02 -0.44 0.05 0.00 0.00 179.01 178.52 1h6k h ASP 432 N 0.00 0.00 -0.45 3.06 3.32 -1.46 -2.51 116.42 118.38 1h6k h ASP 432 Ca 0.38 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.32 1h6k h ASP 432 Cb 1.54 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 41.03 1h6k h ASP 432 CO -0.00 0.02 0.08 0.79 -1.72 0.00 0.00 179.24 178.40 1h6k n TRP 433 N -3.48 1.54 0.26 4.55 8.01 0.14 -4.65 117.44 123.81 1h6k n TRP 433 Ca -0.03 -1.11 0.17 0.00 -1.31 0.00 0.00 57.50 55.22 1h6k n TRP 433 Cb 0.11 -0.48 0.86 0.00 -2.01 0.00 0.00 31.31 29.78 1h6k n TRP 433 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 1h6k h SER 434 N 2.07 0.00 0.27 -0.99 0.02 -1.47 -2.06 113.55 111.38 1h6k h SER 434 Ca 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1h6k h SER 434 Cb 1.81 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.35 1h6k h SER 434 CO 0.44 0.00 0.00 -2.24 -1.14 0.00 0.00 176.83 173.89 1h6k h ASP 435 N 0.00 0.00 1.24 3.07 2.03 -1.86 -2.16 116.42 118.73 1h6k h ASP 435 Ca 0.00 0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 56.25 1h6k h ASP 435 Cb 0.07 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.56 1h6k h ASP 435 CO 0.00 0.00 -0.22 0.00 -1.03 0.00 0.00 179.24 177.99 1h6k h LEU 437 N 0.00 0.67 -1.22 0.00 3.38 -1.60 -2.55 115.31 113.99 1h6k h LEU 437 Ca -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1h6k h LEU 437 Cb 0.90 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1h6k h LEU 437 CO 0.03 0.61 -0.01 -1.54 0.09 0.00 0.00 178.44 177.61 1h6k n SER 438 N -4.34 1.90 -4.91 -0.43 3.41 -1.25 -4.94 113.62 103.05 1h6k n SER 438 Ca 0.04 -1.62 -0.27 0.00 -0.26 0.00 0.00 58.87 56.76 1h6k n SER 438 Cb 0.16 0.01 0.03 0.00 -0.26 0.00 0.00 64.21 64.15 1h6k n SER 438 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1h6k s GLN 439 N -2.02 3.04 -0.00 4.33 -0.21 -0.96 -5.00 119.66 118.84 1h6k s GLN 439 Ca 0.35 0.08 -0.34 0.00 0.02 0.00 0.00 55.36 55.47 1h6k s GLN 439 Cb 0.21 -2.27 -0.13 0.00 1.00 0.00 0.00 33.01 31.82 1h6k s GLN 439 CO 0.33 -0.64 1.76 -3.47 -2.12 0.00 0.00 175.29 171.16 1h6k n ASP 440 N -2.56 3.25 0.25 5.90 -0.08 -1.26 -4.84 116.55 117.22 1h6k n ASP 440 Ca 0.04 1.02 0.17 0.00 -1.51 0.00 0.00 54.79 54.50 1h6k n ASP 440 Cb 0.57 -1.38 0.78 0.00 2.34 0.00 0.00 41.12 43.43 1h6k n ASP 440 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1h6k h PRO 441 N 7.92 0.00 -0.00 -0.67 0.11 -1.94 0.32 132.00 137.74 1h6k h PRO 441 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1h6k h PRO 441 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1h6k h PRO 441 CO 0.92 0.00 -0.13 0.39 -0.21 0.00 0.00 178.00 178.98 1h6k n GLU 442 N -3.17 0.18 -2.05 1.05 1.02 -1.26 -3.81 120.64 112.61 1h6k n GLU 442 Ca 0.01 -0.04 -0.35 0.00 -0.02 0.00 0.00 57.16 56.76 1h6k n GLU 442 Cb 0.47 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.42 1h6k n GLU 442 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1h6k s SER 443 N -2.85 5.34 0.24 1.62 0.01 0.11 -4.83 113.70 113.35 1h6k s SER 443 Ca 0.18 2.24 -0.05 0.00 1.31 0.00 0.00 55.95 59.63 1h6k s SER 443 Cb 0.19 -2.58 0.46 0.00 0.21 0.00 0.00 66.02 64.29 1h6k s SER 443 CO 0.55 -1.48 1.69 -0.65 0.41 0.00 0.00 173.24 173.76 1h6k h PRO 444 N 0.83 0.29 0.92 12.44 0.11 -1.89 -2.24 132.00 142.46 1h6k h PRO 444 Ca -0.50 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 1h6k h PRO 444 Cb 1.28 -0.07 0.01 0.00 0.11 0.00 0.00 31.00 32.33 1h6k h PRO 444 CO 0.55 0.19 -0.44 0.87 -0.21 0.00 0.00 178.00 178.96 1h6k h LYS 445 N 0.30 -1.19 -0.08 1.05 1.57 -1.91 0.11 116.57 116.42 1h6k h LYS 445 Ca 0.41 0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 59.23 1h6k h LYS 445 Cb 0.69 0.27 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 1h6k h LYS 445 CO -0.49 -0.79 -0.15 -1.00 -0.57 0.00 0.00 179.45 176.45 1h6k h PRO 446 N -1.32 0.12 -0.37 3.15 0.13 -1.78 -1.38 132.00 130.55 1h6k h PRO 446 Ca -0.13 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 64.89 1h6k h PRO 446 Cb 0.95 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.05 1h6k h PRO 446 CO 0.21 0.28 -0.11 -0.22 -0.23 0.00 0.00 178.00 177.93 1h6k h LYS 447 N 0.12 0.73 -0.29 0.86 3.64 -1.34 -0.77 116.57 119.51 1h6k h LYS 447 Ca 0.02 -0.29 0.03 0.00 -1.27 0.00 0.00 60.65 59.14 1h6k h LYS 447 Cb 0.35 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 1h6k h LYS 447 CO 0.02 0.89 0.11 0.35 -2.27 0.00 0.00 179.45 178.55 1h6k h PHE 448 N 0.53 0.20 -0.48 1.91 3.57 -0.27 -0.46 116.94 121.94 1h6k h PHE 448 Ca 0.09 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1h6k h PHE 448 Cb 0.63 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 1h6k h PHE 448 CO 0.05 0.10 0.30 0.28 -2.23 0.00 0.00 178.31 176.82 1h6k h VAL 449 N 0.25 1.09 -0.59 1.41 2.07 -1.08 0.14 116.25 119.55 1h6k h VAL 449 Ca 0.13 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1h6k h VAL 449 Cb 0.08 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 1h6k h VAL 449 CO -0.12 0.11 0.28 0.03 0.02 0.00 0.00 177.57 177.89 1h6k h ARG 450 N 0.62 0.84 -0.59 1.57 3.08 -0.82 -0.96 114.38 118.12 1h6k h ARG 450 Ca 0.18 -0.12 -0.11 0.00 0.07 0.00 0.00 59.98 60.00 1h6k h ARG 450 Cb -0.04 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 1h6k h ARG 450 CO -0.06 0.68 -0.05 0.93 -1.07 0.00 0.00 179.97 180.41 1h6k h GLU 451 N 0.80 1.07 -0.27 0.04 4.39 -0.64 -1.11 114.58 118.85 1h6k h GLU 451 Ca 0.20 -0.36 0.00 0.00 0.34 0.00 0.00 59.36 59.54 1h6k h GLU 451 Cb 0.12 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 1h6k h GLU 451 CO -0.03 1.06 0.17 0.28 -1.16 0.00 0.00 179.01 179.34 1h6k h VAL 452 N 0.96 1.08 -0.26 3.13 2.07 -0.54 -1.09 116.25 121.60 1h6k h VAL 452 Ca 0.16 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.46 1h6k h VAL 452 Cb 0.61 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1h6k h VAL 452 CO 0.04 0.08 -0.03 -0.07 0.02 0.00 0.00 177.57 177.61 1h6k h LEU 453 N 0.36 0.38 -0.55 2.57 3.38 -0.98 -0.61 115.31 119.86 1h6k h LEU 453 Ca 0.10 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1h6k h LEU 453 Cb -0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1h6k h LEU 453 CO -0.02 0.47 0.05 -0.08 0.09 0.00 0.00 178.44 178.95 1h6k h GLU 454 N 0.39 0.94 -0.51 1.13 4.81 -0.89 -1.40 114.58 119.05 1h6k h GLU 454 Ca 0.09 -0.27 -0.07 0.00 -0.13 0.00 0.00 59.36 58.98 1h6k h GLU 454 Cb 0.31 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 1h6k h GLU 454 CO 0.01 0.92 0.06 0.87 -0.73 0.00 0.00 179.01 180.14 1h6k h LYS 455 N 0.82 0.86 -0.68 1.92 1.79 -0.59 -2.71 116.57 117.98 1h6k h LYS 455 Ca 0.16 -0.24 0.05 0.00 -2.18 0.00 0.00 60.65 58.44 1h6k h LYS 455 Cb 0.47 -0.09 -0.05 0.00 -1.58 0.00 0.00 32.23 30.97 1h6k h LYS 455 CO 0.02 0.86 0.40 0.00 -1.08 0.00 0.00 179.45 179.65 1h6k h MET 457 N 0.75 0.84 0.00 0.00 1.85 -1.06 -1.48 114.93 115.83 1h6k h MET 457 Ca 0.30 -0.06 0.00 0.00 -0.61 0.00 0.00 59.70 59.33 1h6k h MET 457 Cb 0.14 -0.19 0.00 0.00 0.43 0.00 0.00 31.60 31.98 1h6k h MET 457 CO -0.16 0.56 0.00 0.00 -0.40 0.00 0.00 176.91 176.92 1h6k h ARG 458 N 0.86 0.00 -0.47 0.39 3.08 -1.03 -1.06 114.38 116.15 1h6k h ARG 458 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1h6k h ARG 458 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1h6k h ARG 458 CO -0.05 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.13 1h6k n LEU 459 N -3.04 3.93 0.00 3.04 4.77 -0.60 -4.99 117.00 120.10 1h6k n LEU 459 Ca -0.01 -2.41 0.00 0.00 -0.03 0.00 0.00 56.01 53.57 1h6k n LEU 459 Cb 0.22 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1h6k n LEU 459 CO 0.24 0.77 0.00 -0.24 -1.33 0.00 0.00 177.39 176.83 1h6k n SER 460 N 0.59 2.87 -4.17 -1.43 2.88 -0.40 -5.07 113.62 108.89 1h6k n SER 460 Ca 0.20 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.58 1h6k n SER 460 Cb 0.73 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 64.07 1h6k n SER 460 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1h6k s TYR 461 N 0.32 1.13 0.12 0.66 2.02 -1.24 -4.91 117.35 115.44 1h6k s TYR 461 Ca 0.00 -0.53 -0.25 0.00 -0.37 0.00 0.00 57.07 55.92 1h6k s TYR 461 Cb 0.00 -0.63 -0.06 0.00 -0.40 0.00 0.00 41.96 40.87 1h6k s TYR 461 CO 0.00 0.04 1.66 1.25 -1.57 0.00 0.00 175.55 176.93 1h6k h HIS 462 N 4.00 -0.51 -0.17 2.71 -0.00 -1.98 -2.17 115.15 117.04 1h6k h HIS 462 Ca -0.39 0.02 -0.10 0.00 -0.00 0.00 0.00 60.37 59.90 1h6k h HIS 462 Cb 1.19 0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 28.81 1h6k h HIS 462 CO 0.64 -0.28 -0.33 0.37 -0.00 0.00 0.00 177.93 178.33 1h6k h GLN 463 N -0.32 0.35 -0.20 5.26 5.75 -1.98 -1.46 115.11 122.50 1h6k h GLN 463 Ca 0.05 -0.14 0.02 0.00 -0.15 0.00 0.00 58.65 58.43 1h6k h GLN 463 Cb 0.39 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.90 1h6k h GLN 463 CO -0.17 0.64 0.07 -0.09 -2.65 0.00 0.00 178.83 176.63 1h6k h ARG 464 N 0.30 0.16 -0.22 1.69 1.12 -1.94 -0.89 114.38 114.60 1h6k h ARG 464 Ca 0.04 -0.01 -0.20 0.00 -1.11 0.00 0.00 59.98 58.69 1h6k h ARG 464 Cb 0.73 -0.04 0.01 0.00 -0.01 0.00 0.00 29.97 30.66 1h6k h ARG 464 CO 0.06 0.11 -0.66 0.82 -3.11 0.00 0.00 179.97 177.18 1h6k h ILE 465 N 0.17 1.28 -0.92 1.20 1.08 -1.16 -2.28 117.51 116.88 1h6k h ILE 465 Ca 0.09 -1.85 0.18 0.00 -0.39 0.00 0.00 64.86 62.89 1h6k h ILE 465 Cb 0.05 1.80 -0.07 0.00 -3.07 0.00 0.00 36.82 35.53 1h6k h ILE 465 CO -0.09 0.60 0.59 0.25 -0.69 0.00 0.00 178.15 178.81 1h6k h LEU 466 N 0.60 0.56 0.00 1.44 5.85 -1.06 -1.83 115.31 120.87 1h6k h LEU 466 Ca -0.02 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1h6k h LEU 466 Cb 1.28 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1h6k h LEU 466 CO 0.14 0.24 -0.16 0.44 -0.34 0.00 0.00 178.44 178.76 1h6k h ASP 467 N 0.57 0.00 1.54 1.25 3.32 -0.61 -3.32 116.42 119.16 1h6k h ASP 467 Ca 0.48 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1h6k h ASP 467 Cb 0.97 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.52 1h6k h ASP 467 CO -0.22 0.03 0.00 0.16 -1.72 0.00 0.00 179.24 177.48 1h6k h ILE 468 N 0.00 0.00 -2.44 0.35 3.07 -0.90 -3.46 117.51 114.14 1h6k h ILE 468 Ca 0.00 -0.63 -0.50 0.00 1.55 0.00 0.00 64.86 65.27 1h6k h ILE 468 Cb 0.75 1.60 -0.02 0.00 -0.27 0.00 0.00 36.82 38.89 1h6k h ILE 468 CO 0.00 0.00 -0.43 0.68 -1.05 0.00 0.00 178.15 177.35 1h6k s VAL 469 N -3.21 5.28 0.66 0.16 -7.23 -1.25 -4.86 120.40 109.95 1h6k s VAL 469 Ca 0.08 -0.77 -0.16 0.00 -1.81 0.00 0.00 61.98 59.31 1h6k s VAL 469 Cb 0.09 -3.80 -0.00 0.00 0.56 0.00 0.00 36.38 33.24 1h6k s VAL 469 CO 0.60 -0.22 1.16 -2.84 -0.31 0.00 0.00 175.10 173.49 1h6k s PRO 470 N -3.59 2.67 0.47 4.82 0.02 -1.26 -4.88 135.00 133.25 1h6k s PRO 470 Ca 0.35 1.62 0.27 0.00 0.02 0.00 0.00 61.00 63.26 1h6k s PRO 470 Cb -0.10 -1.91 1.33 0.00 0.02 0.00 0.00 34.50 33.83 1h6k s PRO 470 CO 0.29 -1.39 1.81 -1.35 -0.33 0.00 0.00 177.00 176.03 1h6k h PRO 471 N 0.21 0.18 0.00 5.54 0.11 -1.97 0.37 132.00 136.44 1h6k h PRO 471 Ca -0.48 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1h6k h PRO 471 Cb 1.27 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1h6k h PRO 471 CO 0.53 0.12 -0.03 1.79 -0.21 0.00 0.00 178.00 180.20 1h6k h THR 472 N 0.19 0.14 -0.02 -1.15 1.35 -2.02 -2.58 112.91 108.82 1h6k h THR 472 Ca 0.55 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 66.07 1h6k h THR 472 Cb 1.78 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 69.48 1h6k h THR 472 CO -0.14 0.03 -0.27 0.49 -0.25 0.00 0.00 175.52 175.39 1h6k n PHE 473 N -3.23 0.00 -0.26 4.73 3.01 0.13 -4.61 117.46 117.23 1h6k n PHE 473 Ca -0.01 0.00 0.19 0.00 1.01 0.00 0.00 57.45 58.64 1h6k n PHE 473 Cb 0.20 -0.01 0.50 0.00 -0.01 0.00 0.00 39.48 40.16 1h6k n PHE 473 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1h6k h SER 474 N 3.24 0.44 0.73 4.37 4.64 -1.38 0.15 113.55 125.74 1h6k h SER 474 Ca 0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1h6k h SER 474 Cb 0.83 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1h6k h SER 474 CO 0.00 0.16 0.00 0.00 -0.87 0.00 0.00 176.83 176.12 1h6k n ALA 475 N -2.50 1.79 1.10 5.18 0.00 -1.26 -2.44 120.51 122.37 1h6k n ALA 475 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.77 1h6k n ALA 475 Cb 0.72 -1.34 0.26 0.00 0.00 0.00 0.00 19.45 19.09 1h6k n ALA 475 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1h6k n LEU 476 N -1.86 0.81 -4.78 0.00 4.32 0.51 -4.91 117.00 111.08 1h6k n LEU 476 Ca 0.03 -0.17 -0.36 0.00 -0.02 0.00 0.00 56.01 55.50 1h6k n LEU 476 Cb 0.23 -0.17 -0.02 0.00 -1.62 0.00 0.00 43.42 41.84 1h6k n LEU 476 CO 0.19 0.17 0.76 0.00 -1.22 0.00 0.00 177.39 177.29 1h6k s PRO 478 N -2.89 2.24 0.50 0.00 0.04 -1.26 -5.01 135.00 128.62 1h6k s PRO 478 Ca 0.65 1.51 -0.18 0.00 0.04 0.00 0.00 61.00 63.02 1h6k s PRO 478 Cb -0.23 -1.87 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 1h6k s PRO 478 CO 0.27 -1.71 0.98 -1.54 0.04 0.00 0.00 177.00 175.05 1h6k s SER 479 N -2.52 6.62 0.10 6.66 1.04 -1.26 -4.97 113.70 119.37 1h6k s SER 479 Ca 0.69 1.62 -0.32 0.00 0.48 0.00 0.00 55.95 58.42 1h6k s SER 479 Cb -0.23 -2.52 -0.11 0.00 0.10 0.00 0.00 66.02 63.26 1h6k s SER 479 CO 0.47 -0.59 1.82 -3.20 0.98 0.00 0.00 173.24 172.73 1h6k n ASN 480 N -1.40 3.88 -3.27 7.02 5.15 -1.26 -4.82 115.26 120.56 1h6k n ASN 480 Ca 0.07 0.99 -0.27 0.00 -0.60 0.00 0.00 54.58 54.77 1h6k n ASN 480 Cb 0.54 -1.51 -0.02 0.00 -0.53 0.00 0.00 39.78 38.25 1h6k n ASN 480 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1h6k n PRO 481 N 5.56 2.20 -3.41 1.20 -0.04 -1.26 -4.87 135.00 134.39 1h6k n PRO 481 Ca 0.18 -1.62 -0.31 0.00 -0.04 0.00 0.00 63.50 61.71 1h6k n PRO 481 Cb 0.36 -2.58 -0.05 0.00 -0.04 0.00 0.00 33.50 31.19 1h6k n PRO 481 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1h6k s THR 482 N 3.49 4.99 0.46 0.52 -4.23 -1.26 -4.72 115.64 114.88 1h6k s THR 482 Ca 0.45 0.29 -0.23 0.00 -1.18 0.00 0.00 61.69 61.02 1h6k s THR 482 Cb 0.12 -3.66 -0.07 0.00 1.34 0.00 0.00 72.50 70.23 1h6k s THR 482 CO -0.02 -0.15 1.19 0.00 -0.54 0.00 0.00 174.62 175.10 1h6k s ILE 484 N -1.49 2.40 -0.30 0.00 1.01 -0.23 -5.05 121.20 117.53 1h6k s ILE 484 Ca 0.63 -1.65 -0.11 0.00 0.00 0.00 0.00 60.65 59.51 1h6k s ILE 484 Cb -0.30 -2.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.69 1h6k s ILE 484 CO 0.37 -0.12 0.20 -0.47 0.00 0.00 0.00 174.94 174.92 1h6k s TYR 485 N 1.12 3.21 0.37 3.97 6.04 -1.26 -4.37 117.35 126.44 1h6k s TYR 485 Ca -0.06 -0.06 0.22 0.00 0.04 0.00 0.00 57.07 57.21 1h6k s TYR 485 Cb -0.20 -2.40 1.14 0.00 -1.04 0.00 0.00 41.96 39.46 1h6k s TYR 485 CO -0.04 -0.25 1.97 -0.22 -1.54 0.00 0.00 175.55 175.46 1h6k h LYS 486 N 8.40 0.00 -0.53 4.97 3.64 -1.95 -3.17 116.57 127.94 1h6k h LYS 486 Ca -0.34 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 58.67 1h6k h LYS 486 Cb 1.18 0.00 -0.25 0.00 -0.41 0.00 0.00 32.23 32.74 1h6k h LYS 486 CO 0.58 0.21 -0.41 0.66 -2.27 0.00 0.00 179.45 178.22 1h6k n TYR 487 N -3.81 1.86 -2.06 1.91 4.02 -1.26 -4.66 117.16 113.17 1h6k n TYR 487 Ca -0.02 -2.02 -0.17 0.00 -0.01 0.00 0.00 57.90 55.68 1h6k n TYR 487 Cb 0.31 -0.47 0.10 0.00 -0.02 0.00 0.00 39.34 39.26 1h6k n TYR 487 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1h6k n GLY 488 N -0.91 -0.29 3.46 2.72 0.00 -1.20 -4.81 105.19 104.16 1h6k n GLY 488 Ca 0.38 -1.86 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 1h6k n GLY 488 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h6k n ASP 489 N -3.23 1.99 0.00 1.61 10.43 -1.26 -0.73 116.55 125.36 1h6k n ASP 489 Ca 0.11 -2.59 0.00 0.00 2.57 0.00 0.00 54.79 54.88 1h6k n ASP 489 Cb 0.38 -1.32 0.00 0.00 1.84 0.00 0.00 41.12 42.02 1h6k n ASP 489 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 1h6k n GLU 490 N 7.91 0.00 -2.63 -1.24 2.13 -1.26 -5.14 120.64 120.40 1h6k n GLU 490 Ca 0.45 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.89 1h6k n GLU 490 Cb 0.44 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.10 1h6k n GLU 490 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1h6k s SER 491 N 0.00 7.23 0.03 4.31 1.04 0.09 -5.01 113.70 121.39 1h6k s SER 491 Ca 0.00 2.03 -0.30 0.00 0.48 0.00 0.00 55.95 58.15 1h6k s SER 491 Cb 0.00 -2.60 -0.04 0.00 0.10 0.00 0.00 66.02 63.48 1h6k s SER 491 CO 0.00 -0.15 1.07 -0.94 0.98 0.00 0.00 173.24 174.20 1h6k s SER 492 N -1.32 7.26 0.00 7.02 1.04 -1.26 -4.89 113.70 121.54 1h6k s SER 492 Ca 0.49 1.82 0.04 0.00 0.48 0.00 0.00 55.95 58.77 1h6k s SER 492 Cb -0.24 -2.58 0.22 0.00 0.10 0.00 0.00 66.02 63.52 1h6k s SER 492 CO 0.31 -0.33 0.57 -0.46 0.98 0.00 0.00 173.24 174.31 1h6k n ASN 493 N 3.81 0.00 0.02 7.02 2.04 -1.26 -1.75 115.26 125.14 1h6k n ASN 493 Ca 0.07 -0.47 0.12 0.00 -0.44 0.00 0.00 54.58 53.86 1h6k n ASN 493 Cb 0.49 0.00 0.29 0.00 -2.53 0.00 0.00 39.78 38.03 1h6k n ASN 493 CO 0.00 0.00 0.00 -1.54 -0.44 0.00 0.00 177.26 175.28 1h6k n SER 494 N -0.69 0.48 -4.77 0.53 3.41 -1.26 -4.79 113.62 106.53 1h6k n SER 494 Ca 0.03 -0.01 -0.41 0.00 -0.26 0.00 0.00 58.87 58.22 1h6k n SER 494 Cb 0.01 0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.03 1h6k n SER 494 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1h6k s LEU 495 N -3.36 4.40 0.19 1.04 1.43 -0.72 -4.92 118.68 116.73 1h6k s LEU 495 Ca 0.10 2.77 -0.33 0.00 -1.03 0.00 0.00 54.13 55.64 1h6k s LEU 495 Cb 0.17 -3.65 -0.14 0.00 0.03 0.00 0.00 46.19 42.59 1h6k s LEU 495 CO 0.68 -0.64 1.43 -2.65 0.23 0.00 0.00 176.35 175.40 1h6k n PRO 496 N 0.97 1.88 -1.08 1.29 -0.02 -1.26 -1.53 135.00 135.25 1h6k n PRO 496 Ca 0.01 0.67 -0.03 0.00 -2.02 0.00 0.00 63.50 62.14 1h6k n PRO 496 Cb 0.41 -2.35 -0.01 0.00 -0.02 0.00 0.00 33.50 31.53 1h6k n PRO 496 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h6k n GLY 497 N 2.63 0.49 0.37 -1.23 0.00 -1.26 -4.89 105.19 101.30 1h6k n GLY 497 Ca 0.15 -0.14 0.06 0.00 0.00 0.00 0.00 46.02 46.09 1h6k n GLY 497 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1h6k h HIS 498 N 0.00 1.13 -0.31 1.61 2.76 -1.58 0.50 115.15 119.25 1h6k h HIS 498 Ca -0.06 0.03 -0.18 0.00 -2.20 0.00 0.00 60.37 57.97 1h6k h HIS 498 Cb 0.57 -0.36 -0.00 0.00 1.55 0.00 0.00 27.41 29.16 1h6k h HIS 498 CO 0.32 0.50 -0.49 0.66 -1.30 0.00 0.00 177.93 177.61 1h6k h SER 499 N 1.03 0.95 -0.37 3.26 4.64 -1.88 -2.68 113.55 118.50 1h6k h SER 499 Ca 0.47 -0.48 -0.06 0.00 -0.47 0.00 0.00 61.79 61.25 1h6k h SER 499 Cb 0.40 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1h6k h SER 499 CO -0.23 1.28 0.01 0.58 -0.87 0.00 0.00 176.83 177.61 1h6k h VAL 500 N 0.68 1.25 -0.52 0.95 2.07 -1.75 -1.41 116.25 117.53 1h6k h VAL 500 Ca 0.03 -0.96 0.09 0.00 0.82 0.00 0.00 66.70 66.68 1h6k h VAL 500 Cb 1.09 1.14 -0.08 0.00 -1.52 0.00 0.00 31.29 31.93 1h6k h VAL 500 CO 0.11 0.32 0.08 0.00 0.02 0.00 0.00 177.57 178.10 1h6k h ALA 501 N 0.88 0.57 -0.18 1.67 0.00 -0.88 0.40 119.26 121.72 1h6k h ALA 501 Ca 0.11 0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.16 1h6k h ALA 501 Cb 0.44 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1h6k h ALA 501 CO 0.02 -0.33 0.04 -0.07 0.00 0.00 0.00 179.25 178.91 1h6k h LEU 502 N 0.20 0.03 -0.67 0.00 3.38 -1.25 0.10 115.31 117.11 1h6k h LEU 502 Ca 0.26 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.33 1h6k h LEU 502 Cb 0.38 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 1h6k h LEU 502 CO -0.37 0.04 0.35 0.00 0.09 0.00 0.00 178.44 178.56 1h6k h LEU 504 N 0.64 0.53 0.37 0.00 3.38 0.35 0.48 115.31 121.06 1h6k h LEU 504 Ca 0.31 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 1h6k h LEU 504 Cb 0.24 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1h6k h LEU 504 CO -0.21 0.39 -0.45 0.00 0.09 0.00 0.00 178.44 178.26 1h6k h ALA 505 N 1.16 -0.96 -1.01 1.53 0.00 0.18 0.29 119.26 120.45 1h6k h ALA 505 Ca 0.17 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1h6k h ALA 505 Cb -0.06 0.68 -0.06 0.00 0.00 0.00 0.00 17.79 18.36 1h6k h ALA 505 CO -0.04 -1.09 0.66 0.28 0.00 0.00 0.00 179.25 179.07 1h6k h VAL 506 N -0.86 1.19 -0.71 0.00 2.07 -1.20 -2.02 116.25 114.72 1h6k h VAL 506 Ca -0.03 -0.45 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1h6k h VAL 506 Cb 0.78 -0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1h6k h VAL 506 CO -0.11 0.24 0.36 0.00 0.02 0.00 0.00 177.57 178.07 1h6k h ALA 507 N 1.40 1.29 -0.41 1.67 0.00 -0.23 -2.45 119.26 120.53 1h6k h ALA 507 Ca 0.39 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 1h6k h ALA 507 Cb -0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1h6k h ALA 507 CO -0.12 0.56 -0.20 0.74 0.00 0.00 0.00 179.25 180.23 1h6k h PHE 508 N 1.00 0.90 -0.80 0.00 0.05 0.26 -2.80 116.94 115.55 1h6k h PHE 508 Ca 0.25 -0.20 -0.04 0.00 3.82 0.00 0.00 57.97 61.80 1h6k h PHE 508 Cb 0.08 -0.22 -0.04 0.00 2.00 0.00 0.00 35.95 37.78 1h6k h PHE 508 CO 0.01 0.93 0.35 0.87 -0.18 0.00 0.00 178.31 180.29 1h6k h LYS 509 N 0.70 1.17 0.00 1.51 1.57 -1.07 -1.20 116.57 119.26 1h6k h LYS 509 Ca 0.10 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1h6k h LYS 509 Cb 0.71 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1h6k h LYS 509 CO 0.05 0.93 0.00 0.43 -0.57 0.00 0.00 179.45 180.29 1h6k n SER 510 N -4.29 0.00 -3.40 0.86 7.64 -0.96 -4.88 113.62 108.59 1h6k n SER 510 Ca 0.08 -1.24 -0.12 0.00 1.01 0.00 0.00 58.87 58.60 1h6k n SER 510 Cb 0.16 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 1h6k n SER 510 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1h6k n LYS 511 N -0.65 -1.42 -1.99 1.43 5.02 -0.45 -4.98 118.16 115.12 1h6k n LYS 511 Ca 0.05 1.13 -0.28 0.00 -2.02 0.00 0.00 58.31 57.19 1h6k n LYS 511 Cb 0.02 -4.22 0.11 0.00 -0.02 0.00 0.00 35.03 30.93 1h6k n LYS 511 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1h6k s ALA 512 N -3.02 2.69 0.43 7.82 0.00 -1.09 -5.05 121.76 123.53 1h6k s ALA 512 Ca 0.03 -0.87 0.07 0.00 0.00 0.00 0.00 51.96 51.18 1h6k s ALA 512 Cb -0.01 -2.81 0.01 0.00 0.00 0.00 0.00 23.12 20.31 1h6k s ALA 512 CO 0.82 -1.78 0.58 0.95 0.00 0.00 0.00 175.76 176.33 1h6k s THR 513 N -3.57 3.05 0.17 0.00 -4.23 -1.26 -4.95 115.64 104.84 1h6k s THR 513 Ca 0.65 -0.96 -0.15 0.00 -1.18 0.00 0.00 61.69 60.05 1h6k s THR 513 Cb -0.09 -3.03 0.06 0.00 1.34 0.00 0.00 72.50 70.77 1h6k s THR 513 CO 0.49 -0.01 1.75 0.78 -0.54 0.00 0.00 174.62 177.09 1h6k h ASN 514 N 0.60 0.17 -0.95 3.99 -0.26 -1.99 -1.05 115.58 116.10 1h6k h ASN 514 Ca -0.41 0.05 0.06 0.00 -0.56 0.00 0.00 56.30 55.44 1h6k h ASN 514 Cb 1.28 0.03 -0.06 0.00 -1.06 0.00 0.00 38.32 38.51 1h6k h ASN 514 CO 0.46 0.13 0.62 0.44 -1.06 0.00 0.00 177.43 178.02 1h6k h ASP 515 N 0.33 0.98 -0.73 5.81 3.32 -1.98 0.49 116.42 124.64 1h6k h ASP 515 Ca 0.20 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.22 1h6k h ASP 515 Cb 0.18 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 1h6k h ASP 515 CO -0.20 0.64 0.31 -0.33 -1.72 0.00 0.00 179.24 177.94 1h6k h GLU 516 N 1.11 1.07 -0.15 3.56 5.08 -1.63 0.44 114.58 124.06 1h6k h GLU 516 Ca 0.40 -0.18 -0.07 0.00 -1.00 0.00 0.00 59.36 58.50 1h6k h GLU 516 Cb 0.14 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 1h6k h GLU 516 CO -0.15 0.87 -0.19 0.82 -1.00 0.00 0.00 179.01 179.36 1h6k h ILE 517 N 1.03 1.35 -0.45 3.13 5.03 0.00 -2.92 117.51 124.69 1h6k h ILE 517 Ca 0.24 -1.39 0.09 0.00 -0.12 0.00 0.00 64.86 63.68 1h6k h ILE 517 Cb 0.18 1.92 -0.10 0.00 -3.03 0.00 0.00 36.82 35.80 1h6k h ILE 517 CO -0.02 0.41 -0.26 -0.26 -0.68 0.00 0.00 178.15 177.34 1h6k h PHE 518 N 0.01 -0.68 -0.57 1.37 0.04 0.14 -0.63 116.94 116.62 1h6k h PHE 518 Ca 0.02 0.05 0.12 0.00 2.80 0.00 0.00 57.97 60.96 1h6k h PHE 518 Cb 0.75 0.37 -0.10 0.00 2.20 0.00 0.00 35.95 39.16 1h6k h PHE 518 CO 0.09 -0.33 -0.09 1.03 -0.60 0.00 0.00 178.31 178.41 1h6k h SER 519 N -0.17 -0.42 -0.36 2.17 0.87 -0.86 -1.29 113.55 113.50 1h6k h SER 519 Ca 0.21 0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.92 1h6k h SER 519 Cb 0.49 0.31 -0.02 0.00 -0.44 0.00 0.00 62.40 62.75 1h6k h SER 519 CO -0.55 -0.16 0.19 0.40 -0.53 0.00 0.00 176.83 176.18 1h6k h ILE 520 N 0.04 1.15 -0.21 2.23 2.04 -1.10 -2.97 117.51 118.69 1h6k h ILE 520 Ca 0.28 -0.41 0.02 0.00 1.00 0.00 0.00 64.86 65.75 1h6k h ILE 520 Cb 0.44 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1h6k h ILE 520 CO -0.55 0.16 0.14 -0.07 0.00 0.00 0.00 178.15 177.83 1h6k h LEU 521 N 0.45 0.16 -2.76 1.44 3.38 -0.04 -2.16 115.31 115.78 1h6k h LEU 521 Ca 0.12 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1h6k h LEU 521 Cb 0.08 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1h6k h LEU 521 CO -0.02 0.11 0.06 0.11 0.09 0.00 0.00 178.44 178.80 1h6k h LYS 522 N 0.19 0.00 -0.99 1.13 1.57 -1.19 -1.83 116.57 115.45 1h6k h LYS 522 Ca 0.09 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 1h6k h LYS 522 Cb 0.11 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 1h6k h LYS 522 CO -0.02 0.00 0.08 -0.25 -0.57 0.00 0.00 179.45 178.69 1h6k n ASP 523 N -3.01 2.95 -4.12 0.86 8.00 -0.81 -4.76 116.55 115.65 1h6k n ASP 523 Ca -0.03 -2.20 -0.32 0.00 0.71 0.00 0.00 54.79 52.95 1h6k n ASP 523 Cb 0.12 -0.54 -0.16 0.00 -0.02 0.00 0.00 41.12 40.52 1h6k n ASP 523 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1h6k s VAL 524 N -0.52 1.93 0.00 2.53 1.01 -0.69 -4.97 120.40 119.69 1h6k s VAL 524 Ca 0.08 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1h6k s VAL 524 Cb 0.06 -1.73 0.00 0.00 0.00 0.00 0.00 36.38 34.71 1h6k s VAL 524 CO 0.02 0.52 0.00 -0.81 0.00 0.00 0.00 175.10 174.83 1h6k n PRO 525 N 4.31 1.61 0.00 2.72 -0.04 -1.26 -4.96 135.00 137.38 1h6k n PRO 525 Ca -0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 1h6k n PRO 525 Cb 0.51 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.97 1h6k n PRO 525 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1h6k n ASN 526 N 0.00 0.00 0.00 3.54 5.15 -1.26 -4.84 115.26 117.85 1h6k n ASN 526 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1h6k n ASN 526 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1h6k n ASN 526 CO 0.00 0.00 0.00 0.33 1.40 0.00 0.00 177.26 178.99 1h6k n PHE 539 N 0.33 0.00 -4.02 1.20 7.35 -1.26 -5.17 117.46 115.89 1h6k n PHE 539 Ca 0.00 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.38 1h6k n PHE 539 Cb 0.00 0.00 -0.15 0.00 0.35 0.00 0.00 39.48 39.68 1h6k n PHE 539 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1h6k s ASN 540 N 0.00 4.74 0.39 -2.13 3.84 -1.26 -4.98 114.94 115.53 1h6k s ASN 540 Ca 0.00 -2.11 0.07 0.00 0.21 0.00 0.00 52.86 51.03 1h6k s ASN 540 Cb 0.00 -1.61 0.80 0.00 -0.55 0.00 0.00 41.25 39.89 1h6k s ASN 540 CO 0.00 -0.37 1.99 1.55 -2.79 0.00 0.00 177.10 177.48 1h6k h PRO 541 N 7.63 0.46 -0.19 0.43 0.13 -1.96 -1.80 132.00 136.70 1h6k h PRO 541 Ca -0.05 -0.06 -0.17 0.00 -0.87 0.00 0.00 66.00 64.85 1h6k h PRO 541 Cb 1.02 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.06 1h6k h PRO 541 CO 0.52 0.39 -0.59 1.25 -0.23 0.00 0.00 178.00 179.34 1h6k h LEU 542 N 0.46 0.69 -0.23 1.56 5.85 -1.94 -0.43 115.31 121.27 1h6k h LEU 542 Ca 0.11 -0.39 -0.01 0.00 0.84 0.00 0.00 57.88 58.44 1h6k h LEU 542 Cb 0.11 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 1h6k h LEU 542 CO -0.01 1.12 0.10 0.11 -0.34 0.00 0.00 178.44 179.43 1h6k h LYS 543 N 0.46 0.34 -0.26 1.25 1.57 -1.73 -1.41 116.57 116.78 1h6k h LYS 543 Ca -0.00 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1h6k h LYS 543 Cb 1.15 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.39 1h6k h LYS 543 CO 0.11 0.37 0.14 0.82 -0.57 0.00 0.00 179.45 180.32 1h6k h ILE 544 N 0.24 1.00 -0.07 1.86 2.04 -1.22 -1.85 117.51 119.51 1h6k h ILE 544 Ca 0.08 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 65.85 1h6k h ILE 544 Cb 0.14 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1h6k h ILE 544 CO -0.01 0.05 -0.01 -0.08 0.00 0.00 0.00 178.15 178.11 1h6k h GLU 545 N 0.29 0.01 0.00 2.37 4.81 -0.85 0.15 114.58 121.36 1h6k h GLU 545 Ca 0.11 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.24 1h6k h GLU 545 Cb 0.02 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1h6k h GLU 545 CO -0.07 0.01 -0.47 -0.39 -0.73 0.00 0.00 179.01 177.36 1h6k h VAL 546 N 0.01 1.26 0.04 0.32 -1.51 -1.22 -1.28 116.25 113.88 1h6k h VAL 546 Ca 0.03 -1.64 -0.00 0.00 -1.23 0.00 0.00 66.70 63.86 1h6k h VAL 546 Cb 0.04 1.90 0.00 0.00 -2.13 0.00 0.00 31.29 31.11 1h6k h VAL 546 CO -0.06 0.46 -0.02 0.15 -1.23 0.00 0.00 177.57 176.87 1h6k h PHE 547 N 0.00 -0.05 -0.19 5.19 3.57 -0.98 -2.80 116.94 121.69 1h6k h PHE 547 Ca -0.00 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 1h6k h PHE 547 Cb 0.87 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.61 1h6k h PHE 547 CO 0.00 0.60 0.02 0.28 -2.23 0.00 0.00 178.31 176.98 1h6k h VAL 548 N -0.77 1.24 -0.43 1.41 2.07 -0.72 0.97 116.25 120.01 1h6k h VAL 548 Ca -0.01 -0.78 0.07 0.00 0.82 0.00 0.00 66.70 66.80 1h6k h VAL 548 Cb 0.67 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.77 1h6k h VAL 548 CO 0.01 0.24 0.08 1.56 0.02 0.00 0.00 177.57 179.48 1h6k h GLN 549 N 0.09 0.21 -0.15 1.57 1.08 -1.37 0.10 115.11 116.64 1h6k h GLN 549 Ca 0.06 -0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.15 1h6k h GLN 549 Cb 0.34 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.72 1h6k h GLN 549 CO 0.01 0.14 -0.25 1.15 -0.95 0.00 0.00 178.83 178.92 1h6k h THR 550 N 0.22 1.36 -0.28 -0.54 2.02 -1.38 -1.41 112.91 112.89 1h6k h THR 550 Ca 0.21 -1.49 -0.02 0.00 0.77 0.00 0.00 66.41 65.88 1h6k h THR 550 Cb 0.26 1.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 1h6k h THR 550 CO -0.27 0.44 0.10 0.25 0.37 0.00 0.00 175.52 176.41 1h6k h LEU 551 N 0.06 0.40 -0.44 2.58 5.85 -0.66 -2.49 115.31 120.61 1h6k h LEU 551 Ca 0.01 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.50 1h6k h LEU 551 Cb 0.83 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 1h6k h LEU 551 CO 0.06 0.48 0.09 -0.07 -0.34 0.00 0.00 178.44 178.65 1h6k h LEU 552 N 0.30 0.69 -1.57 2.25 3.38 -0.82 -2.43 115.31 117.10 1h6k h LEU 552 Ca 0.09 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.84 1h6k h LEU 552 Cb 0.21 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1h6k h LEU 552 CO -0.01 0.76 0.31 -0.74 0.09 0.00 0.00 178.44 178.86 1h6k h HIS 553 N 0.59 0.54 0.00 1.13 2.76 -1.23 -1.62 115.15 117.32 1h6k h HIS 553 Ca 0.14 0.01 -0.17 0.00 -2.20 0.00 0.00 60.37 58.15 1h6k h HIS 553 Cb 0.36 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.11 1h6k h HIS 553 CO 0.02 0.32 -0.82 -0.07 -1.30 0.00 0.00 177.93 176.09 1h6k h LEU 554 N 0.57 0.00 -3.34 0.26 3.38 -1.12 -3.13 115.31 111.93 1h6k h LEU 554 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1h6k h LEU 554 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1h6k h LEU 554 CO -0.04 0.82 0.00 0.00 0.09 0.00 0.00 178.44 179.31 1h6k n ALA 555 N -2.31 3.44 0.64 1.53 0.00 -0.94 -4.57 120.51 118.30 1h6k n ALA 555 Ca 0.01 -1.78 0.06 0.00 0.00 0.00 0.00 53.44 51.72 1h6k n ALA 555 Cb 0.87 -1.04 0.32 0.00 0.00 0.00 0.00 19.45 19.59 1h6k n ALA 555 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h6k n ALA 556 N 0.82 1.80 -0.10 0.00 0.00 -0.64 -3.10 120.51 119.30 1h6k n ALA 556 Ca 0.26 -0.06 -0.14 0.00 0.00 0.00 0.00 53.44 53.50 1h6k n ALA 556 Cb 1.03 -1.19 -0.04 0.00 0.00 0.00 0.00 19.45 19.25 1h6k n ALA 556 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1h6k h LYS 557 N 0.00 0.86 -3.60 0.00 3.64 -1.86 -3.48 116.57 112.14 1h6k h LYS 557 Ca 0.00 -0.50 -0.06 0.00 -1.27 0.00 0.00 60.65 58.82 1h6k h LYS 557 Cb 0.07 0.04 -0.10 0.00 -0.41 0.00 0.00 32.23 31.82 1h6k h LYS 557 CO 0.00 1.14 -0.13 -1.54 -2.27 0.00 0.00 179.45 176.65 1h6k s SER 558 N -6.82 -0.11 0.15 4.20 1.04 -1.23 -5.03 113.70 105.91 1h6k s SER 558 Ca -0.11 -0.75 -0.15 0.00 0.48 0.00 0.00 55.95 55.41 1h6k s SER 558 Cb 0.10 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.78 1h6k s SER 558 CO 0.87 -1.03 1.77 -0.26 0.98 0.00 0.00 173.24 175.57 1h6k h PHE 559 N 2.33 0.60 -0.69 5.02 -1.00 -1.92 -2.14 116.94 119.13 1h6k h PHE 559 Ca -0.29 -0.01 0.05 0.00 2.81 0.00 0.00 57.97 60.54 1h6k h PHE 559 Cb 1.25 -0.19 -0.05 0.00 3.61 0.00 0.00 35.95 40.56 1h6k h PHE 559 CO 0.38 0.44 0.41 0.77 -1.61 0.00 0.00 178.31 178.70 1h6k h SER 560 N 0.58 0.63 -0.41 2.17 0.02 -1.96 0.41 113.55 115.00 1h6k h SER 560 Ca 0.16 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.07 1h6k h SER 560 Cb 0.03 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 1h6k h SER 560 CO -0.03 0.42 0.02 0.45 -1.14 0.00 0.00 176.83 176.54 1h6k h HIS 561 N 0.76 0.78 -0.73 3.45 3.86 -1.79 -0.10 115.15 121.38 1h6k h HIS 561 Ca 0.30 -0.13 -0.04 0.00 -1.16 0.00 0.00 60.37 59.34 1h6k h HIS 561 Cb 0.13 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.37 1h6k h HIS 561 CO -0.06 0.78 0.28 0.77 0.86 0.00 0.00 177.93 180.56 1h6k h SER 562 N 0.55 1.01 -0.18 2.45 0.02 -0.73 0.31 113.55 116.99 1h6k h SER 562 Ca 0.12 -0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1h6k h SER 562 Cb 0.46 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 1h6k h SER 562 CO 0.02 0.90 0.04 -0.26 -1.14 0.00 0.00 176.83 176.38 1h6k h PHE 563 N 1.07 0.30 0.00 3.45 0.05 0.11 -1.66 116.94 120.25 1h6k h PHE 563 Ca 0.25 -0.04 -0.10 0.00 3.82 0.00 0.00 57.97 61.90 1h6k h PHE 563 Cb 0.21 -0.08 -0.01 0.00 2.00 0.00 0.00 35.95 38.07 1h6k h PHE 563 CO 0.02 0.43 -0.48 0.66 -0.18 0.00 0.00 178.31 178.76 1h6k h SER 564 N 0.09 0.00 -0.57 2.17 4.64 -0.82 -0.79 113.55 118.27 1h6k h SER 564 Ca 0.05 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.27 1h6k h SER 564 Cb 0.28 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.36 1h6k h SER 564 CO 0.00 0.48 -0.06 0.00 -0.87 0.00 0.00 176.83 176.38 1h6k h ALA 565 N 1.52 0.78 -0.42 5.18 0.00 -0.82 0.19 119.26 125.69 1h6k h ALA 565 Ca -0.00 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.47 1h6k h ALA 565 Cb 0.89 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1h6k h ALA 565 CO 0.06 0.66 -0.15 -0.07 0.00 0.00 0.00 179.25 179.75 1h6k h LEU 566 N 0.93 0.78 -0.18 0.00 3.38 -0.81 -2.53 115.31 116.89 1h6k h LEU 566 Ca 0.16 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 1h6k h LEU 566 Cb 0.62 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1h6k h LEU 566 CO 0.04 0.94 -0.07 0.00 0.09 0.00 0.00 178.44 179.44 1h6k h ALA 567 N 1.12 0.25 -0.73 1.53 0.00 -0.82 -2.60 119.26 118.02 1h6k h ALA 567 Ca 0.11 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1h6k h ALA 567 Cb 0.65 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1h6k h ALA 567 CO 0.05 0.05 0.45 -0.22 0.00 0.00 0.00 179.25 179.58 1h6k h LYS 568 N 0.07 0.98 -0.69 0.00 3.64 -0.56 -2.93 116.57 117.07 1h6k h LYS 568 Ca 0.04 -0.08 -0.40 0.00 -1.27 0.00 0.00 60.65 58.95 1h6k h LYS 568 Cb 0.54 -0.21 -0.23 0.00 -0.41 0.00 0.00 32.23 31.92 1h6k h LYS 568 CO 0.02 0.68 0.22 1.19 -2.27 0.00 0.00 179.45 179.30 1h6k n PHE 569 N -4.54 2.18 -0.15 1.91 3.01 -0.96 -4.66 117.46 114.25 1h6k n PHE 569 Ca 0.07 -1.96 -0.03 0.00 1.01 0.00 0.00 57.45 56.54 1h6k n PHE 569 Cb 0.05 -0.77 0.06 0.00 -0.01 0.00 0.00 39.48 38.80 1h6k n PHE 569 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1h6k h HIS 570 N 1.25 -0.01 -0.72 1.38 2.76 -1.27 -1.68 115.15 116.87 1h6k h HIS 570 Ca 0.43 0.04 0.14 0.00 -2.20 0.00 0.00 60.37 58.77 1h6k h HIS 570 Cb 1.91 0.08 -0.10 0.00 1.55 0.00 0.00 27.41 30.85 1h6k h HIS 570 CO 1.27 -0.10 0.22 0.93 -1.30 0.00 0.00 177.93 178.95 1h6k h GLU 571 N 0.13 0.34 -0.21 5.26 5.08 -1.86 -0.34 114.58 122.97 1h6k h GLU 571 Ca 0.24 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.59 1h6k h GLU 571 Cb 0.36 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1h6k h GLU 571 CO -0.40 0.22 0.13 0.28 -1.00 0.00 0.00 179.01 178.25 1h6k h VAL 572 N 0.35 1.04 0.15 3.13 2.07 -1.68 -1.51 116.25 119.79 1h6k h VAL 572 Ca 0.39 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.83 1h6k h VAL 572 Cb 0.62 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1h6k h VAL 572 CO -0.44 0.05 -0.15 -0.26 0.02 0.00 0.00 177.57 176.79 1h6k h PHE 573 N 0.27 -0.39 -0.80 1.57 -1.00 -0.86 0.17 116.94 115.89 1h6k h PHE 573 Ca 0.08 0.00 0.10 0.00 2.81 0.00 0.00 57.97 60.96 1h6k h PHE 573 Cb -0.02 0.15 -0.06 0.00 3.61 0.00 0.00 35.95 39.64 1h6k h PHE 573 CO -0.07 -0.23 0.53 0.87 -1.61 0.00 0.00 178.31 177.79 1h6k h LYS 574 N -0.33 0.73 -0.00 1.51 1.79 -0.97 0.75 116.57 120.04 1h6k h LYS 574 Ca 0.00 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1h6k h LYS 574 Cb 0.32 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 1h6k h LYS 574 CO -0.04 0.48 -0.00 1.15 -1.08 0.00 0.00 179.45 179.96 1h6k h THR 575 N 0.75 1.62 -0.24 -0.16 2.02 -0.88 -2.61 112.91 113.42 1h6k h THR 575 Ca 0.37 -1.83 -0.08 0.00 0.77 0.00 0.00 66.41 65.64 1h6k h THR 575 Cb 0.44 2.87 -0.01 0.00 -1.74 0.00 0.00 68.15 69.70 1h6k h THR 575 CO -0.14 0.48 -0.19 -0.07 0.37 0.00 0.00 175.52 175.96 1h6k h LEU 576 N -0.78 0.41 -4.48 2.58 4.07 -0.23 -3.18 115.31 113.70 1h6k h LEU 576 Ca -0.00 -0.12 -0.64 0.00 0.08 0.00 0.00 57.88 57.21 1h6k h LEU 576 Cb 0.78 -0.11 -0.37 0.00 1.08 0.00 0.00 40.66 42.04 1h6k h LEU 576 CO 0.00 0.62 -0.15 0.00 -1.08 0.00 0.00 178.44 177.83 1h6k n ALA 577 N -2.48 5.54 0.07 1.53 0.00 0.26 -4.66 120.51 120.76 1h6k n ALA 577 Ca -0.00 -4.12 -0.07 0.00 0.00 0.00 0.00 53.44 49.24 1h6k n ALA 577 Cb 0.35 -0.98 -0.09 0.00 0.00 0.00 0.00 19.45 18.73 1h6k n ALA 577 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1h6k h GLU 578 N 2.58 0.03 -7.12 0.00 4.81 -1.44 -3.39 114.58 110.05 1h6k h GLU 578 Ca 0.41 -0.05 -0.45 0.00 -0.13 0.00 0.00 59.36 59.14 1h6k h GLU 578 Cb 0.78 0.02 0.07 0.00 0.63 0.00 0.00 28.75 30.24 1h6k h GLU 578 CO 1.05 0.98 0.12 -1.54 -0.73 0.00 0.00 179.01 178.89 1h6k s SER 579 N -6.77 4.92 0.15 1.04 1.04 -1.26 -4.97 113.70 107.86 1h6k s SER 579 Ca 0.00 0.21 -0.10 0.00 0.48 0.00 0.00 55.95 56.54 1h6k s SER 579 Cb 0.10 -0.92 -0.02 0.00 0.10 0.00 0.00 66.02 65.28 1h6k s SER 579 CO 0.82 -1.47 1.49 0.44 0.98 0.00 0.00 173.24 175.50 1h6k h ASP 580 N -0.36 0.97 -0.71 7.02 3.32 -1.99 -2.26 116.42 122.42 1h6k h ASP 580 Ca -0.43 -0.45 -0.00 0.00 0.02 0.00 0.00 57.03 56.17 1h6k h ASP 580 Cb 1.30 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.55 1h6k h ASP 580 CO 0.55 1.24 0.43 -0.33 -1.72 0.00 0.00 179.24 179.41 1h6k h GLU 581 N 0.74 0.97 -0.22 3.56 5.08 -1.97 -1.39 114.58 121.35 1h6k h GLU 581 Ca 0.06 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1h6k h GLU 581 Cb 0.98 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 1h6k h GLU 581 CO 0.09 0.69 0.14 0.78 -1.00 0.00 0.00 179.01 179.71 1h6k h GLY 582 N 0.97 0.31 0.91 -3.84 0.00 -1.80 -0.01 103.07 99.61 1h6k h GLY 582 Ca 0.26 -0.12 0.02 0.00 0.00 0.00 0.00 47.33 47.49 1h6k h GLY 582 CO -0.05 0.12 0.36 0.50 0.00 0.00 0.00 176.54 177.47 1h6k h LYS 583 N 0.29 0.70 -0.75 4.80 1.57 -1.11 -0.37 116.57 121.70 1h6k h LYS 583 Ca 0.08 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 1h6k h LYS 583 Cb -0.02 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.10 1h6k h LYS 583 CO -0.02 0.46 0.24 1.25 -0.57 0.00 0.00 179.45 180.82 1h6k h LEU 584 N 0.72 1.09 -1.03 2.94 7.12 -1.01 -2.47 115.31 122.67 1h6k h LEU 584 Ca 0.23 -0.20 -0.10 0.00 0.13 0.00 0.00 57.88 57.93 1h6k h LEU 584 Cb -0.01 -0.28 -0.01 0.00 -0.53 0.00 0.00 40.66 39.82 1h6k h LEU 584 CO -0.09 1.00 -0.47 -0.74 -0.13 0.00 0.00 178.44 178.02 1h6k h HIS 585 N 1.12 0.05 0.01 1.25 2.76 -0.32 0.11 115.15 120.12 1h6k h HIS 585 Ca 0.24 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.40 1h6k h HIS 585 Cb 0.30 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.25 1h6k h HIS 585 CO 0.03 0.50 -0.00 0.28 -1.30 0.00 0.00 177.93 177.43 1h6k h VAL 586 N 0.03 1.16 -0.78 5.26 2.07 -0.80 0.80 116.25 123.99 1h6k h VAL 586 Ca -0.00 -0.49 0.04 0.00 0.82 0.00 0.00 66.70 67.07 1h6k h VAL 586 Cb 0.84 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 32.04 1h6k h VAL 586 CO 0.06 0.13 0.48 -0.07 0.02 0.00 0.00 177.57 178.19 1h6k h LEU 587 N -0.21 0.78 -0.35 2.57 3.38 -1.14 0.19 115.31 120.53 1h6k h LEU 587 Ca -0.00 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1h6k h LEU 587 Cb 0.21 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1h6k h LEU 587 CO 0.00 0.53 0.15 -0.09 0.09 0.00 0.00 178.44 179.12 1h6k h ARG 588 N 0.92 0.51 -0.34 1.13 2.43 -0.51 -0.24 114.38 118.28 1h6k h ARG 588 Ca 0.32 -0.08 -0.17 0.00 -0.81 0.00 0.00 59.98 59.24 1h6k h ARG 588 Cb 0.07 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1h6k h ARG 588 CO -0.13 0.48 -0.45 0.28 -1.51 0.00 0.00 179.97 178.64 1h6k h VAL 589 N 0.42 1.27 -0.65 0.20 2.07 -0.41 -1.88 116.25 117.27 1h6k h VAL 589 Ca 0.12 -1.63 0.08 0.00 0.82 0.00 0.00 66.70 66.09 1h6k h VAL 589 Cb 0.16 1.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.34 1h6k h VAL 589 CO -0.01 0.54 0.31 -0.03 0.02 0.00 0.00 177.57 178.39 1h6k h MET 590 N 0.72 0.53 -0.49 1.57 1.85 -0.40 -0.97 114.93 117.73 1h6k h MET 590 Ca 0.04 -0.03 -0.05 0.00 -0.61 0.00 0.00 59.70 59.05 1h6k h MET 590 Cb 1.05 -0.12 -0.02 0.00 0.43 0.00 0.00 31.60 32.93 1h6k h MET 590 CO 0.10 0.35 0.10 0.35 -0.40 0.00 0.00 176.91 177.41 1h6k h PHE 591 N 0.54 0.78 0.00 1.39 3.57 -0.75 -0.28 116.94 122.20 1h6k h PHE 591 Ca 0.32 -0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.69 1h6k h PHE 591 Cb 0.32 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 1h6k h PHE 591 CO -0.12 0.68 -0.23 0.93 -2.23 0.00 0.00 178.31 177.34 1h6k h GLU 592 N 0.73 0.00 0.17 1.11 5.08 -0.38 -0.39 114.58 120.90 1h6k h GLU 592 Ca 0.16 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.24 1h6k h GLU 592 Cb 0.31 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.57 1h6k h GLU 592 CO 0.00 0.23 -1.30 0.28 -1.00 0.00 0.00 179.01 177.22 1h6k h VAL 593 N 0.00 1.23 -0.11 3.13 2.07 -0.58 -3.40 116.25 118.58 1h6k h VAL 593 Ca -0.00 -2.53 -0.01 0.00 0.82 0.00 0.00 66.70 64.98 1h6k h VAL 593 Cb 0.45 2.96 -0.01 0.00 -1.52 0.00 0.00 31.29 33.18 1h6k h VAL 593 CO 0.03 0.76 -0.03 0.79 0.02 0.00 0.00 177.57 179.14 1h6k n TRP 594 N -3.89 0.40 0.15 1.57 5.03 -0.19 -1.07 117.44 119.45 1h6k n TRP 594 Ca -0.20 -1.01 0.18 0.00 3.03 0.00 0.00 57.50 59.51 1h6k n TRP 594 Cb 0.95 -0.23 0.78 0.00 -1.03 0.00 0.00 31.31 31.78 1h6k n TRP 594 CO 0.00 0.00 0.00 0.07 -0.03 0.00 0.00 177.69 177.73 1h6k h ARG 595 N 0.75 0.00 -0.00 -0.99 0.11 -1.29 0.24 114.38 113.20 1h6k h ARG 595 Ca 0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.09 1h6k h ARG 595 Cb 1.20 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.28 1h6k h ARG 595 CO 0.10 0.00 -0.01 0.09 0.10 0.00 0.00 179.97 180.25 1h6k n ASN 596 N -3.95 0.04 -3.34 0.08 3.02 -1.26 -4.41 115.26 105.44 1h6k n ASN 596 Ca 0.04 -0.47 -0.26 0.00 -0.03 0.00 0.00 54.58 53.87 1h6k n ASN 596 Cb 0.42 -0.18 -0.08 0.00 -0.61 0.00 0.00 39.78 39.33 1h6k n ASN 596 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1h6k n HIS 597 N -1.16 0.94 -0.28 3.10 -0.00 0.83 -3.99 115.22 114.67 1h6k n HIS 597 Ca 0.18 -3.75 0.12 0.00 0.46 0.00 0.00 57.72 54.73 1h6k n HIS 597 Cb 0.20 -0.34 0.37 0.00 -0.12 0.00 0.00 29.99 30.10 1h6k n HIS 597 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1h6k h PRO 598 N 4.38 0.68 -0.69 1.57 0.11 -1.77 0.36 132.00 136.64 1h6k h PRO 598 Ca 0.14 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.18 1h6k h PRO 598 Cb 0.81 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.74 1h6k h PRO 598 CO 0.57 0.45 0.31 0.37 -0.21 0.00 0.00 178.00 179.50 1h6k h GLN 599 N 0.70 0.99 -0.39 1.05 4.15 -1.93 -1.04 115.11 118.64 1h6k h GLN 599 Ca 0.46 -0.14 -0.08 0.00 0.77 0.00 0.00 58.65 59.66 1h6k h GLN 599 Cb 0.74 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.24 1h6k h GLN 599 CO -0.22 0.77 -0.06 1.98 -1.93 0.00 0.00 178.83 179.37 1h6k h MET 600 N 0.98 0.73 -0.57 1.69 4.05 -1.30 -2.60 114.93 117.90 1h6k h MET 600 Ca 0.24 -0.26 0.07 0.00 -0.28 0.00 0.00 59.70 59.46 1h6k h MET 600 Cb 0.13 -0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 30.82 1h6k h MET 600 CO -0.03 0.85 0.26 0.82 0.23 0.00 0.00 176.91 179.04 1h6k h ILE 601 N 0.54 0.87 0.15 1.77 2.04 -0.93 -0.72 117.51 121.23 1h6k h ILE 601 Ca 0.10 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 65.80 1h6k h ILE 601 Cb 0.57 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1h6k h ILE 601 CO 0.03 0.09 -0.15 0.00 0.00 0.00 0.00 178.15 178.12 1h6k h ALA 602 N 1.35 -0.30 0.00 1.87 0.00 -1.01 -0.65 119.26 120.52 1h6k h ALA 602 Ca 0.27 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 1h6k h ALA 602 Cb 0.25 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1h6k h ALA 602 CO -0.23 -0.69 -0.32 -0.39 0.00 0.00 0.00 179.25 177.62 1h6k h VAL 603 N -0.33 1.03 -0.11 0.00 -1.51 -1.22 -1.57 116.25 112.54 1h6k h VAL 603 Ca 0.01 -1.17 -0.08 0.00 -1.23 0.00 0.00 66.70 64.22 1h6k h VAL 603 Cb 0.32 1.67 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 1h6k h VAL 603 CO -0.05 0.31 -0.26 -0.07 -1.23 0.00 0.00 177.57 176.27 1h6k h LEU 604 N 0.00 0.42 -0.36 4.19 3.38 -0.81 -1.56 115.31 120.57 1h6k h LEU 604 Ca -0.00 -0.58 0.01 0.00 0.09 0.00 0.00 57.88 57.40 1h6k h LEU 604 Cb 0.64 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1h6k h LEU 604 CO 0.04 0.92 0.21 0.58 0.09 0.00 0.00 178.44 180.29 1h6k h VAL 605 N -0.07 1.04 -0.49 1.22 2.07 -0.90 0.69 116.25 119.81 1h6k h VAL 605 Ca -0.00 -0.15 0.04 0.00 0.82 0.00 0.00 66.70 67.40 1h6k h VAL 605 Cb 0.87 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 1h6k h VAL 605 CO 0.06 0.08 0.26 -0.78 0.02 0.00 0.00 177.57 177.21 1h6k h ASP 606 N 0.44 0.39 -0.47 0.57 1.82 -1.30 -0.55 116.42 117.32 1h6k h ASP 606 Ca 0.14 0.02 -0.11 0.00 -0.39 0.00 0.00 57.03 56.70 1h6k h ASP 606 Cb 0.00 -0.06 -0.02 0.00 0.68 0.00 0.00 39.33 39.94 1h6k h ASP 606 CO -0.07 0.28 -0.11 0.50 -1.61 0.00 0.00 179.24 178.23 1h6k h LYS 607 N 0.51 0.95 -0.14 0.28 1.63 -0.82 -1.13 116.57 117.85 1h6k h LYS 607 Ca 0.21 -0.34 -0.06 0.00 -0.85 0.00 0.00 60.65 59.61 1h6k h LYS 607 Cb 0.09 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.64 1h6k h LYS 607 CO -0.13 1.00 -0.19 0.52 -3.45 0.00 0.00 179.45 177.20 1h6k h MET 608 N 0.85 0.24 -0.07 1.90 2.86 -0.47 -1.33 114.93 118.90 1h6k h MET 608 Ca 0.13 -0.07 -0.10 0.00 -2.06 0.00 0.00 59.70 57.61 1h6k h MET 608 Cb 0.65 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.29 1h6k h MET 608 CO 0.05 0.43 -0.34 0.82 1.06 0.00 0.00 176.91 178.92 1h6k h ILE 609 N 0.22 1.42 0.00 -1.22 2.04 -0.69 0.54 117.51 119.82 1h6k h ILE 609 Ca 0.04 -1.75 -0.04 0.00 1.00 0.00 0.00 64.86 64.11 1h6k h ILE 609 Cb 0.47 2.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.88 1h6k h ILE 609 CO 0.03 0.51 -0.19 0.03 0.00 0.00 0.00 178.15 178.52 1h6k h ARG 610 N -0.14 0.00 -0.63 2.37 3.08 -0.95 -1.98 114.38 116.14 1h6k h ARG 610 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1h6k h ARG 610 Cb 1.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1h6k h ARG 610 CO 0.07 0.19 0.00 0.25 -1.07 0.00 0.00 179.97 179.41 1h6k n THR 611 N -4.31 1.17 -1.96 2.04 -2.24 -0.53 -4.96 114.28 103.50 1h6k n THR 611 Ca -0.02 -1.06 -0.18 0.00 -2.27 0.00 0.00 64.05 60.52 1h6k n THR 611 Cb 0.25 0.42 -0.04 0.00 -2.10 0.00 0.00 70.33 68.86 1h6k n THR 611 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h6k n GLN 612 N 1.27 -1.38 -0.05 -0.78 6.02 -0.74 -4.87 117.38 116.85 1h6k n GLN 612 Ca 0.22 1.02 -0.08 0.00 -0.01 0.00 0.00 57.00 58.15 1h6k n GLN 612 Cb 0.63 -5.43 0.10 0.00 1.02 0.00 0.00 30.24 26.56 1h6k n GLN 612 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1h6k h ILE 613 N 0.00 1.28 -3.16 5.09 2.04 -0.19 -3.44 117.51 119.13 1h6k h ILE 613 Ca -0.41 -1.43 -0.43 0.00 1.00 0.00 0.00 64.86 63.58 1h6k h ILE 613 Cb 1.27 1.37 -0.14 0.00 -0.74 0.00 0.00 36.82 38.57 1h6k h ILE 613 CO 0.54 0.47 -0.61 0.68 0.00 0.00 0.00 178.15 179.23 1h6k s VAL 614 N -4.44 0.95 0.45 1.67 -7.23 -0.86 -4.81 120.40 106.12 1h6k s VAL 614 Ca -0.08 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.14 1h6k s VAL 614 Cb 0.13 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.30 1h6k s VAL 614 CO 0.83 0.00 0.09 1.51 -0.31 0.00 0.00 175.10 177.22 1h6k s ASP 615 N -3.43 4.16 0.39 4.85 1.47 -1.26 -4.25 116.67 118.60 1h6k s ASP 615 Ca 0.37 -1.37 0.12 0.00 1.18 0.00 0.00 52.55 52.85 1h6k s ASP 615 Cb 0.08 -0.08 0.80 0.00 -0.34 0.00 0.00 42.92 43.38 1h6k s ASP 615 CO 0.15 -0.65 1.88 0.00 0.68 0.00 0.00 175.17 177.23 1h6k h ALA 617 N 1.67 1.08 -0.54 0.00 0.00 -1.96 -0.03 119.26 119.48 1h6k h ALA 617 Ca 0.01 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1h6k h ALA 617 Cb 0.51 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1h6k h ALA 617 CO 0.04 0.64 0.06 0.00 0.00 0.00 0.00 179.25 179.98 1h6k h ALA 618 N 1.20 0.72 -0.31 0.00 0.00 -1.83 -0.81 119.26 118.23 1h6k h ALA 618 Ca 0.24 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1h6k h ALA 618 Cb 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1h6k h ALA 618 CO -0.01 0.49 0.07 0.28 0.00 0.00 0.00 179.25 180.08 1h6k h VAL 619 N 0.79 1.22 -0.63 0.00 2.07 -1.14 0.62 116.25 119.18 1h6k h VAL 619 Ca 0.16 -0.75 0.05 0.00 0.82 0.00 0.00 66.70 66.98 1h6k h VAL 619 Cb 0.45 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.29 1h6k h VAL 619 CO 0.02 0.25 0.36 0.00 0.02 0.00 0.00 177.57 178.21 1h6k h ALA 620 N 0.91 0.83 -0.63 1.67 0.00 -0.88 0.13 119.26 121.29 1h6k h ALA 620 Ca 0.10 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1h6k h ALA 620 Cb 0.30 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1h6k h ALA 620 CO 0.00 0.05 0.18 -0.91 0.00 0.00 0.00 179.25 178.57 1h6k h ASN 621 N 0.68 0.90 -0.62 0.00 2.35 -0.82 -2.84 115.58 115.23 1h6k h ASN 621 Ca 0.27 -0.16 -0.07 0.00 -0.55 0.00 0.00 56.30 55.79 1h6k h ASN 621 Cb 0.13 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 1h6k h ASN 621 CO -0.16 0.86 0.13 -0.25 -1.65 0.00 0.00 177.43 176.36 1h6k h TRP 622 N 0.93 1.07 -0.98 1.19 7.01 0.13 -2.77 115.95 122.54 1h6k h TRP 622 Ca 0.20 -0.14 0.10 0.00 2.11 0.00 0.00 58.89 61.17 1h6k h TRP 622 Cb 0.30 -0.30 -0.08 0.00 -2.10 0.00 0.00 29.16 26.98 1h6k h TRP 622 CO 0.02 0.91 0.61 0.82 -2.79 0.00 0.00 178.44 178.01 1h6k h ILE 623 N 0.93 0.95 -0.48 2.65 1.08 -0.55 -0.98 117.51 121.10 1h6k h ILE 623 Ca 0.19 -0.34 0.00 0.00 -0.39 0.00 0.00 64.86 64.32 1h6k h ILE 623 Cb 0.39 -0.14 0.00 0.00 -3.07 0.00 0.00 36.82 34.00 1h6k h ILE 623 CO 0.01 0.18 0.00 0.49 -0.69 0.00 0.00 178.15 178.14 1h6k n PHE 624 N -4.61 0.99 -2.51 1.37 3.01 -1.12 -4.83 117.46 109.76 1h6k n PHE 624 Ca 0.17 -0.41 -0.32 0.00 1.01 0.00 0.00 57.45 57.90 1h6k n PHE 624 Cb 0.31 -0.14 -0.04 0.00 -0.01 0.00 0.00 39.48 39.59 1h6k n PHE 624 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1h6k s SER 625 N -0.84 6.65 0.36 4.37 1.04 -0.37 -4.95 113.70 119.96 1h6k s SER 625 Ca 0.36 1.53 0.08 0.00 0.48 0.00 0.00 55.95 58.41 1h6k s SER 625 Cb 0.22 -2.49 0.80 0.00 0.10 0.00 0.00 66.02 64.66 1h6k s SER 625 CO 0.19 -0.53 1.90 0.77 0.98 0.00 0.00 173.24 176.55 1h6k h SER 626 N 1.10 0.65 0.11 7.02 4.64 -1.91 -0.12 113.55 125.04 1h6k h SER 626 Ca -0.47 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 60.86 1h6k h SER 626 Cb 1.18 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1h6k h SER 626 CO 0.62 0.36 -0.07 -0.33 -0.87 0.00 0.00 176.83 176.54 1h6k h GLU 627 N 0.70 0.00 -0.02 4.77 3.07 -1.92 -1.59 114.58 119.59 1h6k h GLU 627 Ca 0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 1h6k h GLU 627 Cb 0.59 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.50 1h6k h GLU 627 CO -0.17 0.07 -0.08 1.28 -1.40 0.00 0.00 179.01 178.71 1h6k n LEU 628 N -4.12 2.27 -0.30 1.33 4.32 -0.09 -4.55 117.00 115.86 1h6k n LEU 628 Ca -0.03 -0.76 0.08 0.00 -0.02 0.00 0.00 56.01 55.28 1h6k n LEU 628 Cb 0.15 -0.01 0.23 0.00 -1.62 0.00 0.00 43.42 42.18 1h6k n LEU 628 CO 0.32 0.39 1.11 0.28 -1.22 0.00 0.00 177.39 178.26 1h6k h SER 629 N 3.44 0.55 1.22 -1.43 0.02 -0.93 0.13 113.55 116.55 1h6k h SER 629 Ca 0.00 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1h6k h SER 629 Cb 0.78 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.33 1h6k h SER 629 CO 0.00 0.23 0.00 0.03 -1.14 0.00 0.00 176.83 175.95 1h6k h ARG 630 N 0.64 0.00 -0.06 3.45 3.08 -1.80 -2.98 114.38 116.70 1h6k h ARG 630 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.53 1h6k h ARG 630 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.73 1h6k h ARG 630 CO -0.37 0.00 0.00 -0.25 -1.07 0.00 0.00 179.97 178.28 1h6k n ASP 631 N -2.70 2.40 -0.18 7.04 8.00 0.01 -4.72 116.55 126.39 1h6k n ASP 631 Ca 0.03 -1.68 0.26 0.00 0.71 0.00 0.00 54.79 54.10 1h6k n ASP 631 Cb 0.35 -0.03 0.67 0.00 -0.02 0.00 0.00 41.12 42.09 1h6k n ASP 631 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1h6k h PHE 632 N 3.05 0.13 -0.01 1.24 3.57 -0.68 -0.02 116.94 124.23 1h6k h PHE 632 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1h6k h PHE 632 Cb 0.67 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.37 1h6k h PHE 632 CO 0.03 0.03 -0.28 0.25 -2.23 0.00 0.00 178.31 176.11 1h6k n THR 633 N -4.34 0.00 -2.51 4.41 -2.24 -1.26 -4.88 114.28 103.45 1h6k n THR 633 Ca 0.18 -0.13 -0.36 0.00 -2.27 0.00 0.00 64.05 61.47 1h6k n THR 633 Cb 0.88 0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 69.52 1h6k n THR 633 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1h6k s ARG 634 N -2.51 3.99 0.27 -0.78 0.52 -0.02 -4.95 118.95 115.46 1h6k s ARG 634 Ca 0.24 1.49 -0.01 0.00 -0.52 0.00 0.00 55.73 56.93 1h6k s ARG 634 Cb 0.19 -2.37 0.56 0.00 0.52 0.00 0.00 34.95 33.85 1h6k s ARG 634 CO 0.53 -0.29 1.75 -0.07 0.02 0.00 0.00 175.30 177.24 1h6k h LEU 635 N 2.12 0.48 -1.43 2.53 4.07 -1.92 -2.81 115.31 118.36 1h6k h LEU 635 Ca -0.49 0.10 0.05 0.00 0.08 0.00 0.00 57.88 57.62 1h6k h LEU 635 Cb 1.22 0.03 -0.04 0.00 1.08 0.00 0.00 40.66 42.95 1h6k h LEU 635 CO 0.61 0.18 0.43 2.19 -1.08 0.00 0.00 178.44 180.77 1h6k h PHE 636 N 0.58 0.71 -0.43 1.13 -0.00 -1.92 -0.04 116.94 116.96 1h6k h PHE 636 Ca 0.47 0.02 0.00 0.00 -0.00 0.00 0.00 57.97 58.46 1h6k h PHE 636 Cb 0.71 -0.24 -0.02 0.00 -0.00 0.00 0.00 35.95 36.40 1h6k h PHE 636 CO -0.10 0.40 0.27 0.28 -0.00 0.00 0.00 178.31 179.16 1h6k h VAL 637 N 0.72 1.12 0.00 0.88 2.07 -1.79 -0.93 116.25 118.33 1h6k h VAL 637 Ca 0.27 -0.26 -0.13 0.00 0.82 0.00 0.00 66.70 67.40 1h6k h VAL 637 Cb 0.17 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1h6k h VAL 637 CO -0.08 0.12 -0.64 -0.50 0.02 0.00 0.00 177.57 176.49 1h6k h TRP 638 N 0.58 0.00 -0.47 1.57 4.06 -1.36 -1.12 115.95 119.21 1h6k h TRP 638 Ca 0.16 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.07 1h6k h TRP 638 Cb -0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.11 1h6k h TRP 638 CO -0.04 0.64 0.16 0.93 -3.56 0.00 0.00 178.44 176.57 1h6k h GLU 639 N 0.00 0.72 -0.24 0.49 5.08 -0.65 -1.08 114.58 118.90 1h6k h GLU 639 Ca -0.01 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.15 1h6k h GLU 639 Cb 1.22 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1h6k h GLU 639 CO 0.08 0.68 -0.07 0.82 -1.00 0.00 0.00 179.01 179.52 1h6k h ILE 640 N 0.62 1.29 -0.35 3.13 2.04 -0.99 -1.54 117.51 121.70 1h6k h ILE 640 Ca 0.15 -1.08 0.03 0.00 1.00 0.00 0.00 64.86 64.96 1h6k h ILE 640 Cb 0.25 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 1h6k h ILE 640 CO -0.01 0.34 0.17 0.25 0.00 0.00 0.00 178.15 178.89 1h6k h LEU 641 N 0.21 0.24 -0.62 1.44 5.85 -1.08 0.50 115.31 121.84 1h6k h LEU 641 Ca 0.06 0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.65 1h6k h LEU 641 Cb 0.54 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1h6k h LEU 641 CO 0.03 0.18 -0.50 0.45 -0.34 0.00 0.00 178.44 178.25 1h6k h HIS 642 N 0.34 0.59 -0.52 1.25 3.86 -1.21 -0.51 115.15 118.96 1h6k h HIS 642 Ca 0.15 -0.20 -0.04 0.00 -1.16 0.00 0.00 60.37 59.12 1h6k h HIS 642 Cb 0.07 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.40 1h6k h HIS 642 CO -0.11 0.89 0.16 1.03 0.86 0.00 0.00 177.93 180.76 1h6k h SER 643 N 0.38 0.71 -0.26 2.45 0.87 -0.97 0.54 113.55 117.27 1h6k h SER 643 Ca 0.02 -0.11 -0.05 0.00 -1.23 0.00 0.00 61.79 60.42 1h6k h SER 643 Cb 1.01 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.78 1h6k h SER 643 CO 0.09 0.68 -0.05 0.74 -0.53 0.00 0.00 176.83 177.76 1h6k h THR 644 N 0.75 1.28 -0.34 2.23 2.02 -0.44 -1.81 112.91 116.60 1h6k h THR 644 Ca 0.17 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.31 1h6k h THR 644 Cb 0.23 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 1h6k h THR 644 CO -0.01 0.33 0.21 0.40 0.37 0.00 0.00 175.52 176.82 1h6k h ILE 645 N 0.24 1.11 -0.88 3.11 2.04 -0.70 -2.35 117.51 120.08 1h6k h ILE 645 Ca 0.07 -0.24 0.04 0.00 1.00 0.00 0.00 64.86 65.73 1h6k h ILE 645 Cb 0.51 0.66 -0.06 0.00 -0.74 0.00 0.00 36.82 37.19 1h6k h ILE 645 CO 0.02 0.11 0.57 0.03 0.00 0.00 0.00 178.15 178.88 1h6k h ARG 646 N 0.45 1.04 -0.56 2.37 3.08 -0.81 -0.35 114.38 119.61 1h6k h ARG 646 Ca 0.12 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 1h6k h ARG 646 Cb -0.01 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.78 1h6k h ARG 646 CO -0.02 0.69 0.22 0.87 -1.07 0.00 0.00 179.97 180.65 1h6k h LYS 647 N 1.07 0.84 -0.09 0.04 1.57 -1.14 -0.18 116.57 118.68 1h6k h LYS 647 Ca 0.36 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1h6k h LYS 647 Cb 0.06 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 1h6k h LYS 647 CO -0.14 0.73 0.06 1.98 -0.57 0.00 0.00 179.45 181.52 1h6k h MET 648 N 0.77 0.12 -0.25 3.15 4.05 -0.84 0.34 114.93 122.27 1h6k h MET 648 Ca 0.19 -0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.63 1h6k h MET 648 Cb 0.21 -0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.95 1h6k h MET 648 CO -0.01 0.09 0.05 -0.91 0.23 0.00 0.00 176.91 176.36 1h6k h ASN 649 N 0.12 0.02 0.04 1.39 -0.26 -0.88 -1.97 115.58 114.04 1h6k h ASN 649 Ca 0.03 0.04 -0.06 0.00 -0.56 0.00 0.00 56.30 55.75 1h6k h ASN 649 Cb -0.00 0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 37.29 1h6k h ASN 649 CO -0.01 0.05 -0.16 0.11 -1.06 0.00 0.00 177.43 176.35 1h6k h LYS 650 N 0.15 0.25 -0.46 0.81 1.57 -0.81 -1.47 116.57 116.61 1h6k h LYS 650 Ca 0.12 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 1h6k h LYS 650 Cb 0.11 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1h6k h LYS 650 CO -0.15 0.42 0.12 1.25 -0.57 0.00 0.00 179.45 180.52 1h6k h HIS 651 N 0.24 0.77 -0.10 -1.35 2.76 -0.44 0.49 115.15 117.53 1h6k h HIS 651 Ca 0.05 -0.09 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 1h6k h HIS 651 Cb 0.44 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.17 1h6k h HIS 651 CO 0.01 0.70 0.06 0.28 -1.30 0.00 0.00 177.93 177.68 1h6k h VAL 652 N 0.62 1.02 -0.73 5.26 2.07 -0.77 -1.52 116.25 122.21 1h6k h VAL 652 Ca 0.15 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.65 1h6k h VAL 652 Cb 0.31 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1h6k h VAL 652 CO 0.00 0.02 0.46 -0.07 0.02 0.00 0.00 177.57 178.00 1h6k h LEU 653 N 0.13 0.75 -0.02 2.57 3.38 -1.10 -0.70 115.31 120.33 1h6k h LEU 653 Ca 0.04 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.01 1h6k h LEU 653 Cb -0.01 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1h6k h LEU 653 CO -0.01 0.52 -0.02 0.50 0.09 0.00 0.00 178.44 179.53 1h6k h LYS 654 N 0.89 -0.02 -0.42 1.13 3.64 -0.46 -0.69 116.57 120.64 1h6k h LYS 654 Ca 0.29 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.56 1h6k h LYS 654 Cb 0.01 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1h6k h LYS 654 CO -0.11 -0.01 -0.21 0.82 -2.27 0.00 0.00 179.45 177.67 1h6k h ILE 655 N -0.02 1.27 -0.89 2.00 2.04 -1.17 -2.47 117.51 118.28 1h6k h ILE 655 Ca 0.01 -1.33 0.03 0.00 1.00 0.00 0.00 64.86 64.58 1h6k h ILE 655 Cb 0.04 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 1h6k h ILE 655 CO -0.03 0.45 0.57 1.56 0.00 0.00 0.00 178.15 180.70 1h6k h GLN 656 N 0.72 1.08 0.26 2.37 4.20 -0.86 -1.57 115.11 121.31 1h6k h GLN 656 Ca 0.10 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 1h6k h GLN 656 Cb 0.73 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1h6k h GLN 656 CO 0.06 0.72 -0.12 -0.22 -0.67 0.00 0.00 178.83 178.59 1h6k h LYS 657 N 1.11 -0.33 -0.63 1.46 3.64 -0.78 0.08 116.57 121.13 1h6k h LYS 657 Ca 0.35 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.88 1h6k h LYS 657 Cb 0.00 0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 31.81 1h6k h LYS 657 CO -0.12 -0.19 0.13 0.93 -2.27 0.00 0.00 179.45 177.93 1h6k h GLU 658 N -0.39 0.25 -0.37 1.90 5.08 -1.18 0.14 114.58 119.99 1h6k h GLU 658 Ca -0.04 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 1h6k h GLU 658 Cb 0.30 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 1h6k h GLU 658 CO 0.06 0.16 0.16 1.25 -1.00 0.00 0.00 179.01 179.64 1h6k h LEU 659 N 0.25 0.20 -0.32 1.33 5.85 -0.85 -1.70 115.31 120.08 1h6k h LEU 659 Ca 0.34 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 59.09 1h6k h LEU 659 Cb 0.52 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1h6k h LEU 659 CO -0.43 0.15 0.19 -0.08 -0.34 0.00 0.00 178.44 177.93 1h6k h GLU 660 N 0.33 0.43 -0.70 1.25 4.81 0.21 -2.34 114.58 118.55 1h6k h GLU 660 Ca 0.17 -0.04 0.13 0.00 -0.13 0.00 0.00 59.36 59.49 1h6k h GLU 660 Cb 0.11 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.36 1h6k h GLU 660 CO -0.15 0.32 0.47 0.93 -0.73 0.00 0.00 179.01 179.85 1h6k h GLU 661 N 0.41 0.42 0.00 1.92 5.08 -0.28 0.20 114.58 122.32 1h6k h GLU 661 Ca 0.11 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1h6k h GLU 661 Cb -0.00 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1h6k h GLU 661 CO -0.02 0.28 0.00 0.00 -1.00 0.00 0.00 179.01 178.26 1h6k h ALA 662 N 1.66 1.00 -0.74 3.43 0.00 -0.82 -3.07 119.26 120.72 1h6k h ALA 662 Ca 0.34 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.19 1h6k h ALA 662 Cb 0.72 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1h6k h ALA 662 CO -0.10 0.00 0.25 -0.22 0.00 0.00 0.00 179.25 179.17 1h6k h LYS 663 N 0.00 1.14 -0.21 0.00 1.63 -0.14 -2.94 116.57 116.06 1h6k h LYS 663 Ca 0.00 -0.24 -0.19 0.00 -0.85 0.00 0.00 60.65 59.37 1h6k h LYS 663 Cb 0.84 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 32.31 1h6k h LYS 663 CO 0.00 0.96 -0.64 0.93 -3.45 0.00 0.00 179.45 177.25 1h6k h GLU 664 N 1.09 0.75 0.00 1.90 5.08 -1.47 -3.52 114.58 118.41 1h6k h GLU 664 Ca 0.24 -0.53 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1h6k h GLU 664 Cb 0.29 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1h6k h GLU 664 CO -0.01 1.15 0.00 1.17 -1.00 0.00 0.00 179.01 180.32 1h6k n LYS 665 N -3.96 0.00 0.00 2.33 4.81 -1.11 -5.16 118.16 115.07 1h6k n LYS 665 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 1h6k n LYS 665 Cb 0.67 -0.09 0.00 0.00 0.02 0.00 0.00 35.03 35.63 1h6k n LYS 665 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1h6k n GLU 690 N 0.00 0.00 -0.01 1.64 2.13 -1.26 -4.97 120.64 118.18 1h6k n GLU 690 Ca 0.00 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.81 1h6k n GLU 690 Cb 0.00 0.00 -0.00 0.00 0.27 0.00 0.00 31.44 31.71 1h6k n GLU 690 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1h6k n GLN 691 N 0.00 0.07 -0.37 5.31 -0.06 -1.26 -4.01 117.38 117.06 1h6k n GLN 691 Ca 0.00 0.03 0.29 0.00 -2.00 0.00 0.00 57.00 55.32 1h6k n GLN 691 Cb 0.00 -0.43 0.59 0.00 -4.06 0.00 0.00 30.24 26.34 1h6k n GLN 691 CO 0.00 0.00 0.00 0.97 -0.20 0.00 0.00 177.06 177.83 1h6k h ILE 692 N -0.12 0.37 0.13 1.69 6.09 -1.93 0.46 117.51 124.19 1h6k h ILE 692 Ca 0.00 -0.08 -0.20 0.00 -1.37 0.00 0.00 64.86 63.21 1h6k h ILE 692 Cb 0.12 0.11 0.02 0.00 0.47 0.00 0.00 36.82 37.54 1h6k h ILE 692 CO 0.00 0.04 -0.85 -0.08 -3.07 0.00 0.00 178.15 174.19 1h6k h GLU 693 N 0.24 0.35 -0.20 2.19 4.81 -1.97 -2.87 114.58 117.12 1h6k h GLU 693 Ca 0.67 -0.55 -0.03 0.00 -0.13 0.00 0.00 59.36 59.33 1h6k h GLU 693 Cb 1.99 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 31.55 1h6k h GLU 693 CO -0.30 1.24 0.00 0.00 -0.73 0.00 0.00 179.01 179.23 1h6k h ARG 694 N -0.27 0.28 0.00 1.92 2.47 -0.95 -0.47 114.38 117.37 1h6k h ARG 694 Ca -0.14 -0.04 -0.10 0.00 -1.26 0.00 0.00 59.98 58.43 1h6k h ARG 694 Cb 1.65 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.90 1h6k h ARG 694 CO 0.16 0.31 -0.49 1.25 0.56 0.00 0.00 179.97 181.76 1h6k h LEU 695 N 0.28 0.00 -1.88 3.04 5.85 -0.29 -2.79 115.31 119.53 1h6k h LEU 695 Ca 0.07 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1h6k h LEU 695 Cb 0.19 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 1h6k h LEU 695 CO 0.00 0.49 -0.12 -0.61 -0.34 0.00 0.00 178.44 177.86 1h6k h GLN 696 N 0.00 0.00 0.02 1.25 4.15 -0.85 -1.54 115.11 118.15 1h6k h GLN 696 Ca -0.00 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.21 1h6k h GLN 696 Cb 1.11 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.78 1h6k h GLN 696 CO 0.06 0.12 -0.94 0.93 -1.93 0.00 0.00 178.83 177.07 1h6k h GLU 697 N 0.00 0.17 -0.14 1.69 5.08 -1.34 -2.92 114.58 117.12 1h6k h GLU 697 Ca -0.00 -0.21 -0.11 0.00 -1.00 0.00 0.00 59.36 58.04 1h6k h GLU 697 Cb 0.36 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1h6k h GLU 697 CO 0.02 0.99 -0.39 0.87 -1.00 0.00 0.00 179.01 179.49 1h6k h LYS 698 N 0.08 0.31 -0.13 2.33 1.57 -1.32 -2.60 116.57 116.82 1h6k h LYS 698 Ca -0.05 -0.15 -0.22 0.00 -1.87 0.00 0.00 60.65 58.36 1h6k h LYS 698 Cb 1.60 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.91 1h6k h LYS 698 CO 0.14 0.66 -0.80 -0.39 -0.57 0.00 0.00 179.45 178.49 1h6k h VAL 699 N 0.26 1.29 -0.12 0.50 -1.51 -1.43 -1.85 116.25 113.38 1h6k h VAL 699 Ca 0.03 -2.02 -0.08 0.00 -1.23 0.00 0.00 66.70 63.39 1h6k h VAL 699 Cb 0.81 2.03 -0.01 0.00 -2.13 0.00 0.00 31.29 31.99 1h6k h VAL 699 CO 0.06 0.64 -0.30 1.05 -1.23 0.00 0.00 177.57 177.79 1h6k h GLU 700 N 0.50 0.23 -0.30 5.19 4.11 -1.48 0.25 114.58 123.08 1h6k h GLU 700 Ca -0.06 -0.09 -0.16 0.00 0.07 0.00 0.00 59.36 59.12 1h6k h GLU 700 Cb 1.43 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.66 1h6k h GLU 700 CO 0.16 0.52 -0.45 0.66 0.07 0.00 0.00 179.01 179.97 1h6k h SER 701 N 0.21 0.92 -0.37 3.06 4.64 -1.41 -0.88 113.55 119.72 1h6k h SER 701 Ca 0.03 -0.51 -0.08 0.00 -0.47 0.00 0.00 61.79 60.76 1h6k h SER 701 Cb 0.65 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1h6k h SER 701 CO 0.05 1.25 -0.08 0.00 -0.87 0.00 0.00 176.83 177.18 1h6k h ALA 702 N 0.70 0.50 -0.51 5.18 0.00 -0.92 0.81 119.26 125.01 1h6k h ALA 702 Ca 0.03 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1h6k h ALA 702 Cb 1.05 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1h6k h ALA 702 CO 0.10 0.34 0.24 1.96 0.00 0.00 0.00 179.25 181.90 1h6k h GLN 703 N 0.50 0.71 -0.08 0.00 4.20 -0.47 0.15 115.11 120.11 1h6k h GLN 703 Ca 0.09 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1h6k h GLN 703 Cb 0.58 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 1h6k h GLN 703 CO 0.03 0.56 -0.05 0.77 -0.67 0.00 0.00 178.83 179.47 1h6k h SER 704 N 0.71 0.19 -0.88 1.46 0.02 -0.83 -0.78 113.55 113.44 1h6k h SER 704 Ca 0.18 -0.44 0.07 0.00 -0.84 0.00 0.00 61.79 60.75 1h6k h SER 704 Cb 0.08 -0.05 -0.06 0.00 0.14 0.00 0.00 62.40 62.51 1h6k h SER 704 CO -0.02 0.59 0.55 -0.08 -1.14 0.00 0.00 176.83 176.72 1h6k h GLU 705 N -0.21 0.96 0.00 3.45 4.81 -0.38 0.11 114.58 123.32 1h6k h GLU 705 Ca 0.02 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1h6k h GLU 705 Cb 0.52 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1h6k h GLU 705 CO 0.01 0.63 -0.00 0.37 -0.73 0.00 0.00 179.01 179.30 1h6k h GLN 706 N 0.99 -0.01 -0.81 1.92 4.15 -0.93 0.10 115.11 120.52 1h6k h GLN 706 Ca 0.39 0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.84 1h6k h GLN 706 Cb 0.20 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 27.84 1h6k h GLN 706 CO -0.18 0.28 0.52 -0.22 -1.93 0.00 0.00 178.83 177.30 1h6k h LYS 707 N -0.29 1.00 -0.39 1.69 3.64 -0.67 -2.15 116.57 119.39 1h6k h LYS 707 Ca -0.00 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.25 1h6k h LYS 707 Cb 0.29 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 1h6k h LYS 707 CO 0.00 0.66 -0.04 -0.91 -2.27 0.00 0.00 179.45 176.89 1h6k h ASN 708 N 1.03 0.61 -0.03 4.20 -0.26 -0.62 -1.36 115.58 119.15 1h6k h ASN 708 Ca 0.32 -0.14 0.03 0.00 -0.56 0.00 0.00 56.30 55.94 1h6k h ASN 708 Cb -0.02 -0.16 -0.04 0.00 -1.06 0.00 0.00 38.32 37.04 1h6k h ASN 708 CO -0.10 0.71 -0.18 0.25 -1.06 0.00 0.00 177.43 177.05 1h6k h LEU 709 N 0.59 -0.54 -0.69 1.61 5.85 -0.33 -0.09 115.31 121.72 1h6k h LEU 709 Ca 0.12 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 1h6k h LEU 709 Cb 0.44 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 1h6k h LEU 709 CO 0.02 -0.24 0.37 -0.26 -0.34 0.00 0.00 178.44 177.99 1h6k h PHE 710 N -0.28 0.96 -0.63 1.25 -1.00 -1.13 -1.14 116.94 114.97 1h6k h PHE 710 Ca 0.07 -0.03 0.06 0.00 2.81 0.00 0.00 57.97 60.88 1h6k h PHE 710 Cb 0.37 -0.30 -0.05 0.00 3.61 0.00 0.00 35.95 39.57 1h6k h PHE 710 CO -0.25 0.68 0.34 -0.07 -1.61 0.00 0.00 178.31 177.41 1h6k h LEU 711 N 0.95 0.51 -0.19 1.54 4.07 -0.87 -0.21 115.31 121.11 1h6k h LEU 711 Ca 0.24 0.03 -0.04 0.00 0.08 0.00 0.00 57.88 58.20 1h6k h LEU 711 Cb 0.05 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 41.71 1h6k h LEU 711 CO -0.04 0.33 -0.02 0.58 -1.08 0.00 0.00 178.44 178.22 1h6k h VAL 712 N 0.64 1.27 -0.18 1.22 2.07 -0.58 -0.40 116.25 120.28 1h6k h VAL 712 Ca 0.28 -0.93 0.03 0.00 0.82 0.00 0.00 66.70 66.91 1h6k h VAL 712 Cb 0.17 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1h6k h VAL 712 CO -0.18 0.28 -0.02 0.40 0.02 0.00 0.00 177.57 178.07 1h6k h ILE 713 N 0.09 0.85 -0.71 4.57 2.04 -0.90 0.27 117.51 123.72 1h6k h ILE 713 Ca 0.05 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 1h6k h ILE 713 Cb 0.43 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1h6k h ILE 713 CO 0.01 0.00 0.39 -0.26 0.00 0.00 0.00 178.15 178.30 1h6k h PHE 714 N 0.03 0.98 -0.20 1.37 0.04 -1.01 -1.57 116.94 116.57 1h6k h PHE 714 Ca 0.08 -0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.85 1h6k h PHE 714 Cb 0.12 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 37.93 1h6k h PHE 714 CO -0.19 0.69 0.06 0.37 -0.60 0.00 0.00 178.31 178.64 1h6k h GLN 715 N 0.98 0.14 -0.58 1.51 -0.00 -0.41 -0.02 115.11 116.73 1h6k h GLN 715 Ca 0.25 -0.01 0.02 0.00 -0.00 0.00 0.00 58.65 58.91 1h6k h GLN 715 Cb 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 27.48 27.45 1h6k h GLN 715 CO -0.04 0.09 0.37 0.00 0.00 0.00 0.00 178.83 179.25 1h6k h ARG 716 N 0.15 0.71 -0.09 1.69 2.47 -0.76 0.29 114.38 118.83 1h6k h ARG 716 Ca 0.09 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 1h6k h ARG 716 Cb 0.07 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 28.22 1h6k h ARG 716 CO -0.10 0.47 0.06 0.74 0.56 0.00 0.00 179.97 181.70 1h6k h PHE 717 N 0.73 0.12 -0.37 3.04 0.04 -0.91 -0.66 116.94 118.93 1h6k h PHE 717 Ca 0.23 0.00 0.05 0.00 2.80 0.00 0.00 57.97 61.05 1h6k h PHE 717 Cb -0.02 -0.04 -0.05 0.00 2.20 0.00 0.00 35.95 38.05 1h6k h PHE 717 CO -0.05 0.09 0.09 0.82 -0.60 0.00 0.00 178.31 178.67 1h6k h ILE 718 N 0.11 0.84 0.13 -0.55 2.04 -0.66 -0.66 117.51 118.75 1h6k h ILE 718 Ca 0.03 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 65.82 1h6k h ILE 718 Cb 0.01 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 1h6k h ILE 718 CO -0.01 0.04 -0.15 -0.03 0.00 0.00 0.00 178.15 178.00 1h6k h MET 719 N 0.22 -0.31 -0.00 2.37 4.05 -0.68 0.36 114.93 120.94 1h6k h MET 719 Ca 0.17 0.02 -0.13 0.00 -0.28 0.00 0.00 59.70 59.48 1h6k h MET 719 Cb 0.19 0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.04 1h6k h MET 719 CO -0.21 -0.20 -0.62 -0.84 0.23 0.00 0.00 176.91 175.26 1h6k h ILE 720 N -0.32 1.45 -0.20 1.77 3.07 -0.94 -1.34 117.51 121.00 1h6k h ILE 720 Ca 0.01 -2.13 -0.17 0.00 1.55 0.00 0.00 64.86 64.12 1h6k h ILE 720 Cb 0.31 2.15 0.00 0.00 -0.27 0.00 0.00 36.82 39.01 1h6k h ILE 720 CO -0.05 0.61 -0.52 -0.07 -1.05 0.00 0.00 178.15 177.06 1h6k h LEU 721 N 0.01 0.81 -0.49 0.16 3.38 -1.01 -2.17 115.31 116.00 1h6k h LEU 721 Ca -0.01 -0.57 0.02 0.00 0.09 0.00 0.00 57.88 57.40 1h6k h LEU 721 Cb 1.11 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.59 1h6k h LEU 721 CO 0.08 1.24 0.31 0.74 0.09 0.00 0.00 178.44 180.89 1h6k h THR 722 N 0.41 1.08 -0.79 0.22 2.02 -0.81 0.37 112.91 115.40 1h6k h THR 722 Ca -0.01 -0.21 0.04 0.00 0.77 0.00 0.00 66.41 67.00 1h6k h THR 722 Cb 1.14 0.41 -0.05 0.00 -1.74 0.00 0.00 68.15 67.92 1h6k h THR 722 CO 0.11 0.11 0.52 -0.08 0.37 0.00 0.00 175.52 176.56 1h6k h GLU 723 N 0.62 0.95 -0.03 6.66 4.81 -1.18 0.37 114.58 126.76 1h6k h GLU 723 Ca 0.19 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1h6k h GLU 723 Cb -0.02 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.15 1h6k h GLU 723 CO -0.07 0.63 -0.24 1.25 -0.73 0.00 0.00 179.01 179.84 1h6k h HIS 724 N 0.97 0.31 -0.62 0.92 2.76 -0.67 -2.62 115.15 116.20 1h6k h HIS 724 Ca 0.32 -0.14 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 1h6k h HIS 724 Cb 0.05 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 28.93 1h6k h HIS 724 CO -0.00 0.89 0.40 -0.07 -1.30 0.00 0.00 177.93 177.85 1h6k h LEU 725 N -0.36 0.72 -0.20 0.26 3.38 0.18 -1.31 115.31 117.99 1h6k h LEU 725 Ca -0.02 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1h6k h LEU 725 Cb 0.93 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 1h6k h LEU 725 CO 0.05 0.53 0.11 0.58 0.09 0.00 0.00 178.44 179.80 1h6k h VAL 726 N 0.84 1.10 -0.17 1.22 2.07 -0.36 -2.68 116.25 118.27 1h6k h VAL 726 Ca 0.23 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 1h6k h VAL 726 Cb -0.08 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1h6k h VAL 726 CO -0.05 0.10 -0.13 -0.09 0.02 0.00 0.00 177.57 177.42 1h6k h ARG 727 N 0.22 0.28 -0.06 1.57 2.43 -1.26 -1.30 114.38 116.26 1h6k h ARG 727 Ca 0.07 -0.07 -0.13 0.00 -0.81 0.00 0.00 59.98 59.05 1h6k h ARG 727 Cb 0.06 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1h6k h ARG 727 CO -0.01 0.42 -0.54 0.00 -1.51 0.00 0.00 179.97 178.33 1h6k h GLU 729 N 0.13 -0.09 -0.62 0.00 4.22 -1.14 0.87 114.58 117.94 1h6k h GLU 729 Ca 0.00 0.01 0.12 0.00 0.08 0.00 0.00 59.36 59.57 1h6k h GLU 729 Cb 0.99 0.02 -0.12 0.00 0.50 0.00 0.00 28.75 30.14 1h6k h GLU 729 CO 0.08 0.47 -0.15 1.15 -2.18 0.00 0.00 179.01 178.38 1h6k h THR 730 N -0.78 0.39 -0.01 0.32 2.02 -1.22 -1.63 112.91 112.01 1h6k h THR 730 Ca -0.01 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1h6k h THR 730 Cb 0.60 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.40 1h6k h THR 730 CO 0.02 0.00 -0.31 0.47 0.37 0.00 0.00 175.52 176.06 1h6k n ASP 731 N -5.42 0.84 -1.83 4.18 9.92 -0.43 -4.94 116.55 118.86 1h6k n ASP 731 Ca 0.07 -0.68 -0.16 0.00 -0.53 0.00 0.00 54.79 53.49 1h6k n ASP 731 Cb 0.32 0.15 -0.01 0.00 -0.64 0.00 0.00 41.12 40.94 1h6k n ASP 731 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1h6k n GLY 732 N 1.38 -0.28 3.96 0.44 0.00 -0.06 -5.00 105.19 105.63 1h6k n GLY 732 Ca 0.10 -0.22 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 1h6k n GLY 732 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h6k s THR 733 N -2.80 5.20 0.28 2.61 2.01 0.10 -5.01 115.64 118.02 1h6k s THR 733 Ca 0.01 -0.85 -0.30 0.00 0.31 0.00 0.00 61.69 60.87 1h6k s THR 733 Cb -0.01 -3.85 -0.11 0.00 0.01 0.00 0.00 72.50 68.54 1h6k s THR 733 CO 0.02 -0.39 1.51 -0.55 -0.69 0.00 0.00 174.62 174.52 1h6k s SER 734 N -4.00 6.51 0.07 3.53 0.15 -1.26 -4.62 113.70 114.09 1h6k s SER 734 Ca 0.36 2.82 -0.16 0.00 0.70 0.00 0.00 55.95 59.67 1h6k s SER 734 Cb -0.09 -2.63 -0.14 0.00 -1.71 0.00 0.00 66.02 61.44 1h6k s SER 734 CO 0.31 -0.81 1.31 0.58 1.20 0.00 0.00 173.24 175.83 1h6k h VAL 735 N 3.43 1.33 -0.68 4.45 2.07 -1.96 -3.40 116.25 121.48 1h6k h VAL 735 Ca -0.47 -1.73 -0.49 0.00 0.82 0.00 0.00 66.70 64.83 1h6k h VAL 735 Cb 1.22 1.95 -0.06 0.00 -1.52 0.00 0.00 31.29 32.88 1h6k h VAL 735 CO 0.78 0.54 1.54 -0.76 0.02 0.00 0.00 177.57 179.69 1h6k s LEU 736 N -8.68 3.41 0.32 2.57 1.43 -1.26 -4.72 118.68 111.74 1h6k s LEU 736 Ca -0.12 -1.92 0.08 0.00 -1.03 0.00 0.00 54.13 51.13 1h6k s LEU 736 Cb 0.07 -2.58 -0.03 0.00 0.03 0.00 0.00 46.19 43.67 1h6k s LEU 736 CO 0.84 -2.19 0.20 0.42 0.23 0.00 0.00 176.35 175.85 1h6k s THR 737 N 7.85 3.51 0.27 5.49 -4.23 -1.26 -4.97 115.64 122.30 1h6k s THR 737 Ca 0.61 -1.53 0.01 0.00 -1.18 0.00 0.00 61.69 59.60 1h6k s THR 737 Cb 0.01 -3.12 0.26 0.00 1.34 0.00 0.00 72.50 70.99 1h6k s THR 737 CO 0.09 -0.22 1.79 -0.65 -0.54 0.00 0.00 174.62 175.09 1h6k h PRO 738 N 1.44 0.77 -0.81 3.99 0.11 -1.92 0.14 132.00 135.72 1h6k h PRO 738 Ca -0.45 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1h6k h PRO 738 Cb 1.25 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 32.15 1h6k h PRO 738 CO 0.60 0.51 0.48 2.35 -0.21 0.00 0.00 178.00 181.73 1h6k h TRP 739 N 0.79 1.08 -0.38 0.65 7.01 -1.95 -2.16 115.95 121.00 1h6k h TRP 739 Ca 0.49 -0.01 -0.16 0.00 2.11 0.00 0.00 58.89 61.32 1h6k h TRP 739 Cb 0.61 -0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 27.31 1h6k h TRP 739 CO -0.04 0.73 -0.39 -0.92 -2.79 0.00 0.00 178.44 175.03 1h6k h TYR 740 N 1.12 1.11 -0.45 2.65 3.20 -1.44 -1.51 116.97 121.64 1h6k h TYR 740 Ca 0.29 -0.33 0.07 0.00 3.14 0.00 0.00 58.73 61.90 1h6k h TYR 740 Cb -0.02 -0.23 -0.06 0.00 1.54 0.00 0.00 36.73 37.95 1h6k h TYR 740 CO -0.00 1.16 0.09 -0.22 -1.64 0.00 0.00 178.16 177.54 1h6k h LYS 741 N 0.75 0.22 0.21 1.82 3.64 -0.38 -1.72 116.57 121.11 1h6k h LYS 741 Ca 0.06 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1h6k h LYS 741 Cb 0.98 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1h6k h LYS 741 CO 0.10 0.14 -0.10 -0.97 -2.27 0.00 0.00 179.45 176.35 1h6k h ASN 742 N 0.22 -0.23 0.07 4.20 -1.24 -1.22 -2.37 115.58 115.00 1h6k h ASN 742 Ca 0.22 -0.06 0.02 0.00 0.71 0.00 0.00 56.30 57.19 1h6k h ASN 742 Cb 0.28 0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.35 1h6k h ASN 742 CO -0.29 -0.09 -0.21 0.00 -1.29 0.00 0.00 177.43 175.56 1h6k h ILE 744 N -0.37 1.25 0.00 0.00 6.09 -1.38 -0.79 117.51 122.30 1h6k h ILE 744 Ca 0.04 -1.10 -0.08 0.00 -1.37 0.00 0.00 64.86 62.35 1h6k h ILE 744 Cb 0.41 1.11 -0.01 0.00 0.47 0.00 0.00 36.82 38.80 1h6k h ILE 744 CO -0.15 0.37 -0.38 -0.33 -3.07 0.00 0.00 178.15 174.59 1h6k h GLU 745 N 0.57 0.00 -0.12 2.19 5.08 -0.99 -0.59 114.58 120.71 1h6k h GLU 745 Ca 0.10 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.32 1h6k h GLU 745 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1h6k h GLU 745 CO 0.03 0.38 -0.54 0.00 -1.00 0.00 0.00 179.01 177.88 1h6k h ARG 746 N 0.00 0.36 -0.18 2.33 2.47 0.35 -0.40 114.38 119.30 1h6k h ARG 746 Ca -0.00 -0.22 -0.05 0.00 -1.26 0.00 0.00 59.98 58.45 1h6k h ARG 746 Cb 1.15 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.49 1h6k h ARG 746 CO 0.05 0.81 -0.06 1.25 0.56 0.00 0.00 179.97 182.58 1h6k h LEU 747 N 0.28 0.37 -0.99 3.04 5.85 -0.89 -2.56 115.31 120.40 1h6k h LEU 747 Ca 0.00 -0.39 0.13 0.00 0.84 0.00 0.00 57.88 58.47 1h6k h LEU 747 Cb 1.04 -0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.88 1h6k h LEU 747 CO 0.09 0.67 0.61 -0.61 -0.34 0.00 0.00 178.44 178.86 1h6k h GLN 748 N 0.06 0.90 -0.27 1.25 4.15 -0.93 -1.84 115.11 118.42 1h6k h GLN 748 Ca 0.04 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.35 1h6k h GLN 748 Cb 0.52 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 28.00 1h6k h GLN 748 CO 0.02 0.59 -0.10 0.37 -1.93 0.00 0.00 178.83 177.79 1h6k h GLN 749 N 0.92 0.44 -0.31 1.69 4.15 -0.84 -1.51 115.11 119.66 1h6k h GLN 749 Ca 0.51 -0.11 0.03 0.00 0.77 0.00 0.00 58.65 59.84 1h6k h GLN 749 Cb 0.57 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.17 1h6k h GLN 749 CO -0.29 0.55 0.14 0.82 -1.93 0.00 0.00 178.83 178.12 1h6k h ILE 750 N 0.41 0.96 -0.20 2.39 1.08 -0.93 -0.37 117.51 120.85 1h6k h ILE 750 Ca 0.08 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 64.44 1h6k h ILE 750 Cb 0.43 0.64 -0.01 0.00 -3.07 0.00 0.00 36.82 34.81 1h6k h ILE 750 CO 0.02 0.05 0.10 -0.26 -0.69 0.00 0.00 178.15 177.38 1h6k h PHE 751 N 0.30 0.29 -0.54 1.37 0.04 -1.37 -2.68 116.94 114.35 1h6k h PHE 751 Ca 0.13 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.86 1h6k h PHE 751 Cb 0.07 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 1h6k h PHE 751 CO -0.11 0.29 0.23 -0.07 -0.60 0.00 0.00 178.31 178.05 1h6k h LEU 752 N 0.21 0.73 -0.37 1.54 3.38 -1.01 -0.51 115.31 119.28 1h6k h LEU 752 Ca 0.07 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 1h6k h LEU 752 Cb 0.10 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1h6k h LEU 752 CO -0.01 0.69 -0.56 -0.61 0.09 0.00 0.00 178.44 178.04 1h6k h GLN 753 N 0.73 0.00 -0.04 1.13 4.15 -1.11 -3.32 115.11 116.64 1h6k h GLN 753 Ca 0.18 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.54 1h6k h GLN 753 Cb 0.17 0.00 -0.10 0.00 0.21 0.00 0.00 27.48 27.76 1h6k h GLN 753 CO -0.02 0.56 -0.62 0.72 -1.93 0.00 0.00 178.83 177.54 1h6k n HIS 754 N -3.39 0.16 -0.26 3.99 8.25 -1.01 -4.86 115.22 118.10 1h6k n HIS 754 Ca 0.01 -1.36 0.05 0.00 -0.26 0.00 0.00 57.72 56.16 1h6k n HIS 754 Cb 0.69 -0.24 0.19 0.00 1.12 0.00 0.00 29.99 31.75 1h6k n HIS 754 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 1h6k h HIS 755 N 1.08 0.55 -0.69 4.41 2.07 -1.19 -0.87 115.15 120.51 1h6k h HIS 755 Ca -0.02 0.04 0.02 0.00 -2.85 0.00 0.00 60.37 57.55 1h6k h HIS 755 Cb 1.20 -0.13 -0.04 0.00 2.57 0.00 0.00 27.41 31.01 1h6k h HIS 755 CO 0.66 0.08 0.45 0.37 -3.07 0.00 0.00 177.93 176.42 1h6k h GLN 756 N 0.47 0.87 -0.18 5.12 5.75 -1.89 -1.21 115.11 124.05 1h6k h GLN 756 Ca 0.42 -0.05 -0.22 0.00 -0.15 0.00 0.00 58.65 58.65 1h6k h GLN 756 Cb 0.63 -0.20 0.01 0.00 1.07 0.00 0.00 27.48 28.99 1h6k h GLN 756 CO -0.39 0.58 -0.73 0.82 -2.65 0.00 0.00 178.83 176.45 1h6k h ILE 757 N 0.90 1.28 0.00 2.39 2.04 -1.79 -3.26 117.51 119.06 1h6k h ILE 757 Ca 0.26 -1.93 -0.08 0.00 1.00 0.00 0.00 64.86 64.11 1h6k h ILE 757 Cb -0.06 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1h6k h ILE 757 CO -0.08 0.61 -0.39 0.40 0.00 0.00 0.00 178.15 178.70 1h6k h ILE 758 N 0.56 1.16 -0.18 -0.67 2.04 -0.89 -2.98 117.51 116.55 1h6k h ILE 758 Ca -0.04 -1.39 0.05 0.00 1.00 0.00 0.00 64.86 64.49 1h6k h ILE 758 Cb 1.36 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 39.21 1h6k h ILE 758 CO 0.15 0.38 0.17 1.56 0.00 0.00 0.00 178.15 180.41 1h6k h GLN 759 N 0.00 0.00 0.00 2.37 4.20 -1.27 0.27 115.11 120.68 1h6k h GLN 759 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1h6k h GLN 759 Cb 0.74 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.52 1h6k h GLN 759 CO 0.05 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.21 1h6k n GLN 760 N -4.02 0.10 -0.14 1.46 10.64 -1.13 -3.10 117.38 121.19 1h6k n GLN 760 Ca 0.02 0.18 0.11 0.00 -1.83 0.00 0.00 57.00 55.47 1h6k n GLN 760 Cb 0.30 -1.64 0.17 0.00 -0.86 0.00 0.00 30.24 28.21 1h6k n GLN 760 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1h6k n TYR 761 N -1.82 0.37 -0.23 2.61 0.53 0.93 -4.69 117.16 114.86 1h6k n TYR 761 Ca 0.05 -0.21 0.04 0.00 -1.02 0.00 0.00 57.90 56.76 1h6k n TYR 761 Cb 0.31 -0.00 0.15 0.00 -1.03 0.00 0.00 39.34 38.77 1h6k n TYR 761 CO 0.00 0.00 0.00 0.52 -1.02 0.00 0.00 176.86 176.36 1h6k h MET 762 N 4.02 0.21 0.20 -0.72 2.86 -1.47 0.24 114.93 120.27 1h6k h MET 762 Ca 0.00 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1h6k h MET 762 Cb 0.91 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.52 1h6k h MET 762 CO 0.00 0.14 -0.10 0.28 1.06 0.00 0.00 176.91 178.30 1h6k h VAL 763 N 0.22 0.87 -0.29 -2.22 2.07 -1.87 -0.53 116.25 114.49 1h6k h VAL 763 Ca 0.38 -0.33 0.05 0.00 0.82 0.00 0.00 66.70 67.61 1h6k h VAL 763 Cb 0.63 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.42 1h6k h VAL 763 CO -0.51 0.08 0.02 0.74 0.02 0.00 0.00 177.57 177.92 1h6k h THR 764 N -0.43 0.81 -0.64 2.57 2.02 -1.74 0.13 112.91 115.62 1h6k h THR 764 Ca -0.03 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 1h6k h THR 764 Cb 0.33 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 1h6k h THR 764 CO 0.05 0.02 0.39 -0.07 0.37 0.00 0.00 175.52 176.27 1h6k h LEU 765 N 0.12 0.78 -0.71 2.58 3.38 -0.42 0.15 115.31 121.18 1h6k h LEU 765 Ca 0.14 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1h6k h LEU 765 Cb 0.17 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1h6k h LEU 765 CO -0.22 0.61 -0.23 -0.08 0.09 0.00 0.00 178.44 178.61 1h6k h GLU 766 N 0.88 0.74 0.06 1.13 4.81 -0.75 0.14 114.58 121.59 1h6k h GLU 766 Ca 0.23 -0.30 -0.25 0.00 -0.13 0.00 0.00 59.36 58.91 1h6k h GLU 766 Cb -0.02 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.33 1h6k h GLU 766 CO -0.04 0.90 -1.09 -0.91 -0.73 0.00 0.00 179.01 177.15 1h6k h ASN 767 N 0.65 0.51 0.11 1.04 2.35 -0.19 -3.35 115.58 116.70 1h6k h ASN 767 Ca 0.09 -0.47 -0.36 0.00 -0.55 0.00 0.00 56.30 55.01 1h6k h ASN 767 Cb 0.74 -0.16 -0.05 0.00 0.05 0.00 0.00 38.32 38.89 1h6k h ASN 767 CO 0.06 1.30 -2.22 0.18 -1.65 0.00 0.00 177.43 175.10 1h6k n LEU 768 N -3.66 1.77 0.02 1.61 4.77 0.49 -4.88 117.00 117.11 1h6k n LEU 768 Ca -0.08 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1h6k n LEU 768 Cb 0.92 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1h6k n LEU 768 CO 0.53 0.71 -0.30 0.18 -1.33 0.00 0.00 177.39 177.19 1h6k n LEU 769 N -3.14 0.31 -4.00 2.23 4.77 -0.17 -4.86 117.00 112.15 1h6k n LEU 769 Ca -0.35 0.06 -0.43 0.00 -0.03 0.00 0.00 56.01 55.27 1h6k n LEU 769 Cb 1.06 -0.08 0.01 0.00 -2.33 0.00 0.00 43.42 42.07 1h6k n LEU 769 CO 0.37 -0.29 1.58 0.49 -1.33 0.00 0.00 177.39 178.21 1h6k n PHE 770 N -3.12 3.07 -2.82 -1.77 3.01 0.32 -4.87 117.46 111.28 1h6k n PHE 770 Ca 0.00 -2.85 -0.22 0.00 1.01 0.00 0.00 57.45 55.40 1h6k n PHE 770 Cb 0.30 -1.75 0.02 0.00 -0.01 0.00 0.00 39.48 38.04 1h6k n PHE 770 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1h6k s THR 771 N -0.57 3.29 0.64 4.37 -4.23 -1.26 -4.55 115.64 113.34 1h6k s THR 771 Ca 0.37 -0.61 0.40 0.00 -1.18 0.00 0.00 61.69 60.67 1h6k s THR 771 Cb 0.06 -3.22 0.42 0.00 1.34 0.00 0.00 72.50 71.09 1h6k s THR 771 CO 0.03 -0.15 2.33 0.00 -0.54 0.00 0.00 174.62 176.29 1h6k h ALA 772 N 0.25 1.18 -0.00 3.99 0.00 -1.93 -1.07 119.26 121.68 1h6k h ALA 772 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1h6k h ALA 772 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1h6k h ALA 772 CO 0.54 -0.01 -0.32 0.39 0.00 0.00 0.00 179.25 179.85 1h6k n GLU 773 N -3.32 0.32 -1.96 0.00 -0.58 -1.26 -4.90 120.64 108.94 1h6k n GLU 773 Ca -0.03 -0.16 -0.41 0.00 -0.42 0.00 0.00 57.16 56.14 1h6k n GLU 773 Cb 0.09 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 29.44 1h6k n GLU 773 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1h6k s LEU 774 N -2.79 4.38 0.08 -4.62 0.20 -0.41 -4.90 118.68 110.62 1h6k s LEU 774 Ca 0.17 2.82 -0.37 0.00 0.69 0.00 0.00 54.13 57.44 1h6k s LEU 774 Cb 0.18 -3.65 -0.17 0.00 -0.43 0.00 0.00 46.19 42.13 1h6k s LEU 774 CO 0.60 -0.72 1.29 -0.67 -0.29 0.00 0.00 176.35 176.56 1h6k n ASP 775 N 1.30 1.39 -0.14 3.68 -0.08 -1.26 -4.60 116.55 116.84 1h6k n ASP 775 Ca 0.03 1.13 0.22 0.00 -1.51 0.00 0.00 54.79 54.66 1h6k n ASP 775 Cb 0.40 -1.15 0.63 0.00 2.34 0.00 0.00 41.12 43.34 1h6k n ASP 775 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1h6k h PRO 776 N 4.29 0.16 -0.86 -0.67 0.13 -1.94 -0.18 132.00 132.92 1h6k h PRO 776 Ca -0.48 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1h6k h PRO 776 Cb 1.35 -0.04 -0.04 0.00 0.13 0.00 0.00 31.00 32.40 1h6k h PRO 776 CO 0.76 0.10 0.57 0.45 -0.23 0.00 0.00 178.00 179.65 1h6k h HIS 777 N 0.16 1.07 0.09 1.56 3.86 -2.01 -1.22 115.15 118.66 1h6k h HIS 777 Ca 0.38 0.03 -0.15 0.00 -1.16 0.00 0.00 60.37 59.47 1h6k h HIS 777 Cb 1.25 -0.36 0.01 0.00 1.06 0.00 0.00 27.41 29.37 1h6k h HIS 777 CO -0.00 0.66 -0.69 0.82 0.86 0.00 0.00 177.93 179.58 1h6k h ILE 778 N 1.14 1.49 -0.39 2.45 2.04 -1.42 -3.33 117.51 119.49 1h6k h ILE 778 Ca 0.32 -2.44 0.03 0.00 1.00 0.00 0.00 64.86 63.77 1h6k h ILE 778 Cb -0.10 3.13 -0.02 0.00 -0.74 0.00 0.00 36.82 39.09 1h6k h ILE 778 CO -0.08 0.66 0.26 0.25 0.00 0.00 0.00 178.15 179.24 1h6k h LEU 779 N -0.59 0.36 -1.37 1.44 5.85 -1.25 -2.10 115.31 117.65 1h6k h LEU 779 Ca -0.14 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.66 1h6k h LEU 779 Cb 1.45 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 42.34 1h6k h LEU 779 CO 0.07 0.25 0.50 0.00 -0.34 0.00 0.00 178.44 178.92 1h6k h ALA 780 N 1.77 1.75 -0.48 1.25 0.00 -1.33 -0.54 119.26 121.69 1h6k h ALA 780 Ca 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1h6k h ALA 780 Cb 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1h6k h ALA 780 CO -0.04 0.11 0.25 0.28 0.00 0.00 0.00 179.25 179.84 1h6k h VAL 781 N 0.73 1.18 -0.70 0.00 2.07 -1.53 0.56 116.25 118.56 1h6k h VAL 781 Ca 0.34 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 1h6k h VAL 781 Cb 0.38 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1h6k h VAL 781 CO -0.12 0.20 0.15 0.15 0.02 0.00 0.00 177.57 177.96 1h6k h PHE 782 N 0.63 1.19 -0.37 1.57 3.57 -1.41 -0.29 116.94 121.83 1h6k h PHE 782 Ca 0.17 -0.15 -0.11 0.00 3.53 0.00 0.00 57.97 61.40 1h6k h PHE 782 Cb 0.09 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.48 1h6k h PHE 782 CO -0.01 0.98 -0.23 1.96 -2.23 0.00 0.00 178.31 178.78 1h6k h GLN 783 N 1.06 0.73 -0.47 1.11 4.20 -0.54 -0.36 115.11 120.86 1h6k h GLN 783 Ca 0.22 -0.29 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 1h6k h GLN 783 Cb 0.40 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 1h6k h GLN 783 CO 0.01 0.89 0.06 1.96 -0.67 0.00 0.00 178.83 181.08 1h6k h GLN 784 N 0.64 0.79 -0.55 1.46 4.20 0.56 -1.94 115.11 120.26 1h6k h GLN 784 Ca 0.09 -0.22 -0.00 0.00 0.06 0.00 0.00 58.65 58.58 1h6k h GLN 784 Cb 0.72 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.39 1h6k h GLN 784 CO 0.06 0.81 0.33 0.35 -0.67 0.00 0.00 178.83 179.71 1h6k h PHE 785 N 0.65 0.72 -0.84 2.96 3.57 -0.73 -2.37 116.94 120.89 1h6k h PHE 785 Ca 0.14 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1h6k h PHE 785 Cb 0.42 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.88 1h6k h PHE 785 CO 0.03 0.50 0.54 0.00 -2.23 0.00 0.00 178.31 177.15 1h6k n ALA 787 N -2.41 1.22 0.26 0.00 0.00 -0.75 -2.15 120.51 116.69 1h6k n ALA 787 Ca 0.09 0.06 0.15 0.00 0.00 0.00 0.00 53.44 53.74 1h6k n ALA 787 Cb 0.04 -1.18 0.66 0.00 0.00 0.00 0.00 19.45 18.97 1h6k n ALA 787 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1h6k h LEU 788 N 0.00 0.00 -2.07 0.00 3.38 -1.29 -3.24 115.31 112.10 1h6k h LEU 788 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h6k h LEU 788 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1h6k h LEU 788 CO 0.00 0.08 -0.27 0.00 0.09 0.00 0.00 178.44 178.34 1h6k n GLN 789 N -3.23 0.46 0.00 1.13 1.13 -0.91 -4.28 117.38 111.68 1h6k n GLN 789 Ca -0.00 -1.24 0.14 0.00 -1.94 0.00 0.00 57.00 53.95 1h6k n GLN 789 Cb 0.32 -0.73 0.50 0.00 0.11 0.00 0.00 30.24 30.44 1h6k n GLN 789 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62